NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
6903 | 1joq | 4053 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H ALA 1 H1 ALA 1 23.523 -16.378 -12.195 2 2H ALA 1 H2 ALA 1 24.291 -17.892 -12.286 3 3H ALA 1 H3 ALA 1 24.699 -16.810 -11.045 4 HA ALA 1 HA ALA 1 26.395 -16.212 -12.344 5 1HB ALA 1 HB1 ALA 1 25.738 -18.231 -13.802 6 2HB ALA 1 HB2 ALA 1 24.899 -17.066 -14.825 7 3HB ALA 1 HB3 ALA 1 26.642 -16.939 -14.592 8 H THR 2 H THR 2 23.297 -15.604 -14.038 9 HA THR 2 HA THR 2 24.214 -12.813 -14.526 10 HB THR 2 HB THR 2 21.621 -13.797 -15.614 11 HG1 THR 2 HG1 THR 2 23.235 -14.596 -17.378 12 1HG2 THR 2 HG21 THR 2 22.874 -11.530 -15.987 13 2HG2 THR 2 HG22 THR 2 23.862 -12.467 -17.107 14 3HG2 THR 2 HG23 THR 2 22.123 -12.334 -17.364 15 H SER 3 H SER 3 22.831 -11.040 -13.916 16 HA SER 3 HA SER 3 21.556 -11.344 -11.369 17 1HB SER 3 HB2 SER 3 20.646 -9.010 -11.906 18 2HB SER 3 HB3 SER 3 22.399 -9.181 -11.911 19 HG SER 3 HG SER 3 20.960 -9.637 -14.275 20 H THR 4 H THR 4 19.481 -11.910 -10.875 21 HA THR 4 HA THR 4 17.468 -11.887 -13.083 22 HB THR 4 HB THR 4 16.566 -14.030 -12.077 23 HG1 THR 4 HG1 THR 4 17.759 -13.718 -10.087 24 1HG2 THR 4 HG21 THR 4 18.421 -13.667 -14.009 25 2HG2 THR 4 HG22 THR 4 19.353 -14.656 -12.884 26 3HG2 THR 4 HG23 THR 4 17.829 -15.260 -13.535 27 H LYS 5 H LYS 5 15.689 -10.745 -12.489 28 HA LYS 5 HA LYS 5 15.110 -10.503 -9.562 29 1HB LYS 5 HB2 LYS 5 15.830 -8.440 -11.262 30 2HB LYS 5 HB3 LYS 5 14.068 -8.343 -11.250 31 1HG LYS 5 HG2 LYS 5 13.984 -7.734 -9.053 32 2HG LYS 5 HG3 LYS 5 15.328 -8.787 -8.608 33 1HD LYS 5 HD2 LYS 5 16.946 -7.212 -9.366 34 2HD LYS 5 HD3 LYS 5 15.730 -6.262 -10.220 35 1HE LYS 5 HE2 LYS 5 14.938 -5.277 -8.287 36 2HE LYS 5 HE3 LYS 5 15.376 -6.656 -7.279 37 1HZ LYS 5 HZ1 LYS 5 17.648 -5.410 -8.493 38 2HZ LYS 5 HZ2 LYS 5 16.779 -4.335 -7.511 39 3HZ LYS 5 HZ3 LYS 5 17.365 -5.791 -6.862 40 H LYS 6 H LYS 6 12.631 -9.207 -9.831 41 HA LYS 6 HA LYS 6 11.027 -11.239 -11.332 42 1HB LYS 6 HB2 LYS 6 11.029 -11.455 -8.779 43 2HB LYS 6 HB3 LYS 6 10.152 -9.924 -8.753 44 1HG LYS 6 HG2 LYS 6 8.303 -11.236 -8.930 45 2HG LYS 6 HG3 LYS 6 8.740 -11.317 -10.639 46 1HD LYS 6 HD2 LYS 6 10.282 -13.235 -9.115 47 2HD LYS 6 HD3 LYS 6 8.556 -13.476 -8.840 48 1HE LYS 6 HE2 LYS 6 8.117 -13.755 -11.162 49 2HE LYS 6 HE3 LYS 6 9.700 -13.122 -11.615 50 1HZ LYS 6 HZ1 LYS 6 9.864 -15.369 -9.846 51 2HZ LYS 6 HZ2 LYS 6 9.067 -15.746 -11.298 52 3HZ LYS 6 HZ3 LYS 6 10.639 -15.103 -11.332 53 H LEU 7 H LEU 7 9.215 -10.433 -12.441 54 HA LEU 7 HA LEU 7 8.064 -8.786 -13.669 55 1HB LEU 7 HB2 LEU 7 7.864 -8.168 -10.811 56 2HB LEU 7 HB3 LEU 7 7.652 -6.746 -11.833 57 HG LEU 7 HG LEU 7 6.246 -9.213 -12.708 58 1HD1 LEU 7 HD11 LEU 7 6.071 -8.572 -10.032 59 2HD1 LEU 7 HD12 LEU 7 4.721 -7.670 -10.721 60 3HD1 LEU 7 HD13 LEU 7 4.824 -9.416 -10.952 61 1HD2 LEU 7 HD21 LEU 7 5.859 -6.239 -12.711 62 2HD2 LEU 7 HD22 LEU 7 5.750 -7.380 -14.051 63 3HD2 LEU 7 HD23 LEU 7 4.441 -7.276 -12.873 64 H HIS 8 H HIS 8 8.057 -6.055 -13.644 65 HA HIS 8 HA HIS 8 10.918 -5.404 -14.209 66 1HB HIS 8 HB2 HIS 8 8.858 -5.298 -15.958 67 2HB HIS 8 HB3 HIS 8 8.753 -3.674 -15.279 68 HD1 HIS 8 HD1 HIS 8 10.734 -2.061 -15.704 69 HD2 HIS 8 HD2 HIS 8 11.239 -5.813 -17.447 70 HE1 HIS 8 HE1 HIS 8 12.701 -1.858 -17.283 71 H LYS 9 H LYS 9 11.757 -4.231 -12.547 72 HA LYS 9 HA LYS 9 9.979 -2.461 -10.976 73 1HB LYS 9 HB2 LYS 9 12.690 -3.667 -10.581 74 2HB LYS 9 HB3 LYS 9 12.303 -2.177 -9.719 75 1HG LYS 9 HG2 LYS 9 10.042 -3.879 -9.488 76 2HG LYS 9 HG3 LYS 9 11.462 -4.854 -9.113 77 1HD LYS 9 HD2 LYS 9 11.794 -2.293 -7.885 78 2HD LYS 9 HD3 LYS 9 10.192 -2.900 -7.465 79 1HE LYS 9 HE2 LYS 9 11.380 -3.984 -5.827 80 2HE LYS 9 HE3 LYS 9 11.608 -5.163 -7.118 81 1HZ LYS 9 HZ1 LYS 9 13.580 -3.409 -7.605 82 2HZ LYS 9 HZ2 LYS 9 13.513 -3.366 -5.907 83 3HZ LYS 9 HZ3 LYS 9 13.768 -4.839 -6.707 84 H GLU 10 H GLU 10 9.959 -0.287 -11.281 85 HA GLU 10 HA GLU 10 12.233 0.933 -12.796 86 1HB GLU 10 HB2 GLU 10 9.378 1.920 -12.921 87 2HB GLU 10 HB3 GLU 10 10.716 2.320 -13.999 88 1HG GLU 10 HG2 GLU 10 10.277 -0.550 -13.904 89 2HG GLU 10 HG3 GLU 10 8.810 0.301 -14.390 90 HA PRO 11 HA PRO 11 12.588 3.631 -9.334 91 1HB PRO 11 HB2 PRO 11 13.851 5.720 -10.569 92 2HB PRO 11 HB3 PRO 11 14.652 4.193 -10.168 93 1HG PRO 11 HG2 PRO 11 13.624 5.151 -12.814 94 2HG PRO 11 HG3 PRO 11 15.064 4.183 -12.454 95 1HD PRO 11 HD2 PRO 11 12.699 3.118 -13.417 96 2HD PRO 11 HD3 PRO 11 13.889 2.195 -12.472 97 H ALA 12 H ALA 12 11.856 5.737 -8.549 98 HA ALA 12 HA ALA 12 10.029 7.274 -10.294 99 1HB ALA 12 HB1 ALA 12 9.150 5.464 -8.112 100 2HB ALA 12 HB2 ALA 12 8.414 7.066 -8.121 101 3HB ALA 12 HB3 ALA 12 8.269 6.023 -9.534 102 H THR 13 H THR 13 8.993 9.096 -8.722 103 HA THR 13 HA THR 13 11.231 10.042 -6.970 104 HB THR 13 HB THR 13 9.400 11.810 -8.611 105 HG1 THR 13 HG1 THR 13 11.729 11.988 -9.612 106 1HG2 THR 13 HG21 THR 13 11.001 12.378 -6.431 107 2HG2 THR 13 HG22 THR 13 12.048 12.767 -7.797 108 3HG2 THR 13 HG23 THR 13 10.474 13.547 -7.640 109 H LEU 14 H LEU 14 10.625 11.046 -5.023 110 HA LEU 14 HA LEU 14 7.875 10.466 -4.132 111 1HB LEU 14 HB2 LEU 14 9.839 9.963 -2.672 112 2HB LEU 14 HB3 LEU 14 10.188 11.690 -2.598 113 HG LEU 14 HG LEU 14 7.897 12.067 -1.669 114 1HD1 LEU 14 HD11 LEU 14 7.856 9.033 -1.586 115 2HD1 LEU 14 HD12 LEU 14 6.657 10.088 -0.836 116 3HD1 LEU 14 HD13 LEU 14 6.827 10.053 -2.592 117 1HD2 LEU 14 HD21 LEU 14 10.162 11.296 -0.370 118 2HD2 LEU 14 HD22 LEU 14 8.670 11.740 0.460 119 3HD2 LEU 14 HD23 LEU 14 9.046 10.042 0.170 120 H ILE 15 H ILE 15 6.539 12.016 -5.088 121 HA ILE 15 HA ILE 15 7.292 14.851 -5.044 122 HB ILE 15 HB ILE 15 4.733 13.448 -5.871 123 1HG1 ILE 15 HG12 ILE 15 6.981 14.691 -7.489 124 2HG1 ILE 15 HG13 ILE 15 6.722 12.960 -7.273 125 1HG2 ILE 15 HG21 ILE 15 5.434 16.286 -5.519 126 2HG2 ILE 15 HG22 ILE 15 4.784 15.905 -7.113 127 3HG2 ILE 15 HG23 ILE 15 3.847 15.529 -5.667 128 1HD1 ILE 15 HD11 ILE 15 4.305 14.346 -8.161 129 2HD1 ILE 15 HD12 ILE 15 5.639 14.517 -9.302 130 3HD1 ILE 15 HD13 ILE 15 5.083 12.912 -8.829 131 H LYS 16 H LYS 16 4.471 13.053 -3.741 132 HA LYS 16 HA LYS 16 4.723 14.322 -1.143 133 1HB LYS 16 HB2 LYS 16 3.740 16.115 -2.758 134 2HB LYS 16 HB3 LYS 16 2.267 15.147 -2.683 135 1HG LYS 16 HG2 LYS 16 2.050 16.775 -0.952 136 2HG LYS 16 HG3 LYS 16 2.486 15.273 -0.137 137 1HD LYS 16 HD2 LYS 16 4.781 15.958 0.075 138 2HD LYS 16 HD3 LYS 16 4.521 17.352 -0.975 139 1HE LYS 16 HE2 LYS 16 2.824 18.176 0.730 140 2HE LYS 16 HE3 LYS 16 3.406 16.904 1.804 141 1HZ LYS 16 HZ1 LYS 16 5.412 18.618 0.563 142 2HZ LYS 16 HZ2 LYS 16 4.453 19.319 1.774 143 3HZ LYS 16 HZ3 LYS 16 5.377 17.934 2.118 144 H ALA 17 H ALA 17 4.210 12.508 0.008 145 HA ALA 17 HA ALA 17 2.339 10.516 -0.952 146 1HB ALA 17 HB1 ALA 17 4.228 9.998 0.597 147 2HB ALA 17 HB2 ALA 17 3.412 10.921 1.858 148 3HB ALA 17 HB3 ALA 17 2.674 9.451 1.222 149 H ILE 18 H ILE 18 0.164 10.309 -0.481 150 HA ILE 18 HA ILE 18 -1.076 12.594 0.961 151 HB ILE 18 HB ILE 18 -2.476 10.439 -0.641 152 1HG1 ILE 18 HG12 ILE 18 -1.633 13.169 -1.644 153 2HG1 ILE 18 HG13 ILE 18 -0.666 11.721 -1.919 154 1HG2 ILE 18 HG21 ILE 18 -3.256 12.869 0.804 155 2HG2 ILE 18 HG22 ILE 18 -3.829 12.846 -0.864 156 3HG2 ILE 18 HG23 ILE 18 -4.256 11.533 0.234 157 1HD1 ILE 18 HD11 ILE 18 -3.512 11.374 -2.567 158 2HD1 ILE 18 HD12 ILE 18 -2.703 12.588 -3.559 159 3HD1 ILE 18 HD13 ILE 18 -2.084 10.937 -3.506 160 H ASP 19 H ASP 19 -1.920 9.119 0.684 161 HA ASP 19 HA ASP 19 -2.457 9.175 3.626 162 1HB ASP 19 HB2 ASP 19 -3.582 7.115 1.735 163 2HB ASP 19 HB3 ASP 19 -4.199 7.624 3.307 164 H GLY 20 H GLY 20 -2.585 6.407 4.035 165 1HA GLY 20 HA2 GLY 20 0.264 5.758 4.081 166 2HA GLY 20 HA3 GLY 20 -1.035 4.762 4.738 167 H ASP 21 H ASP 21 -2.587 4.713 2.269 168 HA ASP 21 HA ASP 21 -0.830 2.871 0.704 169 1HB ASP 21 HB2 ASP 21 -3.085 1.962 -0.116 170 2HB ASP 21 HB3 ASP 21 -2.676 1.637 1.569 171 H THR 22 H THR 22 -1.015 5.813 0.377 172 HA THR 22 HA THR 22 -1.511 5.814 -2.522 173 HB THR 22 HB THR 22 -2.951 7.840 -0.795 174 HG1 THR 22 HG1 THR 22 -4.647 6.212 -1.980 175 1HG2 THR 22 HG21 THR 22 -2.320 8.262 -3.259 176 2HG2 THR 22 HG22 THR 22 -3.518 7.026 -3.645 177 3HG2 THR 22 HG23 THR 22 -4.008 8.500 -2.807 178 H VAL 23 H VAL 23 0.153 6.954 -3.396 179 HA VAL 23 HA VAL 23 1.132 9.380 -2.016 180 HB VAL 23 HB VAL 23 3.508 8.564 -2.236 181 1HG1 VAL 23 HG11 VAL 23 1.745 8.249 -0.198 182 2HG1 VAL 23 HG12 VAL 23 2.190 6.566 -0.482 183 3HG1 VAL 23 HG13 VAL 23 3.435 7.755 -0.097 184 1HG2 VAL 23 HG21 VAL 23 2.657 6.700 -3.884 185 2HG2 VAL 23 HG22 VAL 23 3.988 6.339 -2.786 186 3HG2 VAL 23 HG23 VAL 23 2.357 5.790 -2.403 187 H LYS 24 H LYS 24 1.847 10.907 -3.479 188 HA LYS 24 HA LYS 24 1.548 10.229 -6.338 189 1HB LYS 24 HB2 LYS 24 2.321 12.938 -5.267 190 2HB LYS 24 HB3 LYS 24 1.414 12.546 -6.729 191 1HG LYS 24 HG2 LYS 24 -0.523 11.918 -5.470 192 2HG LYS 24 HG3 LYS 24 0.375 11.942 -3.953 193 1HD LYS 24 HD2 LYS 24 -0.243 14.088 -3.691 194 2HD LYS 24 HD3 LYS 24 0.747 14.492 -5.093 195 1HE LYS 24 HE2 LYS 24 -1.056 14.602 -6.507 196 2HE LYS 24 HE3 LYS 24 -1.934 13.332 -5.654 197 1HZ LYS 24 HZ1 LYS 24 -1.671 15.453 -3.889 198 2HZ LYS 24 HZ2 LYS 24 -2.153 16.131 -5.371 199 3HZ LYS 24 HZ3 LYS 24 -3.088 14.910 -4.648 200 H LEU 25 H LEU 25 3.303 9.590 -7.488 201 HA LEU 25 HA LEU 25 5.977 10.643 -6.649 202 1HB LEU 25 HB2 LEU 25 5.706 8.020 -8.079 203 2HB LEU 25 HB3 LEU 25 6.959 8.556 -6.959 204 HG LEU 25 HG LEU 25 4.722 8.639 -5.369 205 1HD1 LEU 25 HD11 LEU 25 4.298 6.705 -7.578 206 2HD1 LEU 25 HD12 LEU 25 3.968 6.100 -5.955 207 3HD1 LEU 25 HD13 LEU 25 3.117 7.521 -6.556 208 1HD2 LEU 25 HD21 LEU 25 7.062 7.587 -5.055 209 2HD2 LEU 25 HD22 LEU 25 5.712 6.801 -4.237 210 3HD2 LEU 25 HD23 LEU 25 6.354 6.121 -5.731 211 H MET 26 H MET 26 7.584 10.395 -8.583 212 HA MET 26 HA MET 26 6.186 11.424 -11.009 213 1HB MET 26 HB2 MET 26 8.134 12.669 -9.686 214 2HB MET 26 HB3 MET 26 9.154 11.615 -10.666 215 1HG MET 26 HG2 MET 26 7.764 12.415 -12.676 216 2HG MET 26 HG3 MET 26 7.164 13.683 -11.607 217 1HE MET 26 HE1 MET 26 8.068 14.625 -13.901 218 2HE MET 26 HE2 MET 26 8.322 15.945 -12.763 219 3HE MET 26 HE3 MET 26 9.590 15.525 -13.909 220 H TYR 27 H TYR 27 6.404 10.329 -12.942 221 HA TYR 27 HA TYR 27 8.312 8.033 -13.007 222 1HB TYR 27 HB2 TYR 27 6.006 7.218 -12.520 223 2HB TYR 27 HB3 TYR 27 5.451 7.971 -14.015 224 HD1 TYR 27 HD1 TYR 27 7.838 5.446 -12.655 225 HD2 TYR 27 HD2 TYR 27 5.717 6.883 -16.102 226 HE1 TYR 27 HE1 TYR 27 8.554 3.443 -13.930 227 HE2 TYR 27 HE2 TYR 27 6.433 4.881 -17.378 228 HH TYR 27 HH TYR 27 8.297 2.282 -15.822 229 H LYS 28 H LYS 28 9.681 8.410 -14.676 230 HA LYS 28 HA LYS 28 10.492 9.331 -16.692 231 1HB LYS 28 HB2 LYS 28 8.076 7.724 -17.231 232 2HB LYS 28 HB3 LYS 28 8.523 8.840 -18.522 233 1HG LYS 28 HG2 LYS 28 10.315 7.597 -19.101 234 2HG LYS 28 HG3 LYS 28 10.848 7.463 -17.425 235 1HD LYS 28 HD2 LYS 28 8.714 5.827 -17.318 236 2HD LYS 28 HD3 LYS 28 9.132 5.626 -19.020 237 1HE LYS 28 HE2 LYS 28 11.423 5.547 -17.149 238 2HE LYS 28 HE3 LYS 28 10.289 4.204 -17.003 239 1HZ LYS 28 HZ1 LYS 28 10.507 4.325 -19.629 240 2HZ LYS 28 HZ2 LYS 28 12.040 4.930 -19.215 241 3HZ LYS 28 HZ3 LYS 28 11.553 3.396 -18.671 242 H GLY 29 H GLY 29 9.287 11.308 -15.070 243 1HA GLY 29 HA2 GLY 29 8.676 13.567 -15.343 244 2HA GLY 29 HA3 GLY 29 8.660 13.301 -17.087 245 H GLN 30 H GLN 30 6.789 11.606 -14.575 246 HA GLN 30 HA GLN 30 4.313 12.921 -15.523 247 1HB GLN 30 HB2 GLN 30 4.910 10.739 -16.865 248 2HB GLN 30 HB3 GLN 30 4.342 9.920 -15.410 249 1HG GLN 30 HG2 GLN 30 2.196 10.312 -15.962 250 2HG GLN 30 HG3 GLN 30 2.512 12.039 -16.126 251 1HE2 GLN 30 HE21 GLN 30 2.580 8.949 -17.918 252 2HE2 GLN 30 HE22 GLN 30 2.538 9.656 -19.460 253 HA PRO 31 HA PRO 31 4.155 12.340 -11.006 254 1HB PRO 31 HB2 PRO 31 2.563 14.528 -10.605 255 2HB PRO 31 HB3 PRO 31 4.323 14.636 -10.789 256 1HG PRO 31 HG2 PRO 31 2.175 15.237 -12.791 257 2HG PRO 31 HG3 PRO 31 3.726 16.053 -12.526 258 1HD PRO 31 HD2 PRO 31 3.275 14.233 -14.559 259 2HD PRO 31 HD3 PRO 31 4.879 14.573 -13.871 260 H MET 32 H MET 32 2.797 10.566 -10.725 261 HA MET 32 HA MET 32 -0.121 11.033 -11.199 262 1HB MET 32 HB2 MET 32 1.466 9.183 -12.532 263 2HB MET 32 HB3 MET 32 0.713 8.227 -11.256 264 1HG MET 32 HG2 MET 32 -1.508 9.033 -11.941 265 2HG MET 32 HG3 MET 32 -0.769 10.021 -13.202 266 1HE MET 32 HE1 MET 32 -0.864 6.489 -11.681 267 2HE MET 32 HE2 MET 32 -0.257 5.458 -12.984 268 3HE MET 32 HE3 MET 32 0.811 6.625 -12.210 269 H THR 33 H THR 33 -1.436 9.372 -9.849 270 HA THR 33 HA THR 33 -0.246 9.310 -7.114 271 HB THR 33 HB THR 33 -2.408 10.560 -7.481 272 HG1 THR 33 HG1 THR 33 -2.893 8.309 -5.872 273 1HG2 THR 33 HG21 THR 33 -3.082 8.469 -9.075 274 2HG2 THR 33 HG22 THR 33 -3.900 8.004 -7.582 275 3HG2 THR 33 HG23 THR 33 -4.264 9.553 -8.342 276 H PHE 34 H PHE 34 0.465 7.341 -6.469 277 HA PHE 34 HA PHE 34 -0.654 4.922 -7.796 278 1HB PHE 34 HB2 PHE 34 1.893 5.481 -6.279 279 2HB PHE 34 HB3 PHE 34 1.346 3.829 -6.571 280 HD1 PHE 34 HD1 PHE 34 2.393 6.991 -8.201 281 HD2 PHE 34 HD2 PHE 34 1.458 2.836 -8.752 282 HE1 PHE 34 HE1 PHE 34 3.321 7.089 -10.498 283 HE2 PHE 34 HE2 PHE 34 2.381 2.934 -11.050 284 HZ PHE 34 HZ PHE 34 3.311 5.058 -11.926 285 H ARG 35 H ARG 35 -1.589 3.258 -6.567 286 HA ARG 35 HA ARG 35 -2.005 3.873 -3.668 287 1HB ARG 35 HB2 ARG 35 -4.092 4.267 -4.833 288 2HB ARG 35 HB3 ARG 35 -3.962 2.723 -5.677 289 1HG ARG 35 HG2 ARG 35 -5.126 1.798 -3.984 290 2HG ARG 35 HG3 ARG 35 -3.722 2.083 -2.955 291 1HD ARG 35 HD2 ARG 35 -4.579 4.135 -2.155 292 2HD ARG 35 HD3 ARG 35 -5.748 4.259 -3.469 293 HE ARG 35 HE ARG 35 -6.239 1.904 -1.871 294 1HH1 ARG 35 HH11 ARG 35 -7.347 4.944 -2.781 295 2HH1 ARG 35 HH12 ARG 35 -8.385 5.167 -1.413 296 1HH2 ARG 35 HH21 ARG 35 -7.243 2.346 0.250 297 2HH2 ARG 35 HH22 ARG 35 -8.326 3.696 0.303 298 H LEU 36 H LEU 36 -1.367 2.247 -2.323 299 HA LEU 36 HA LEU 36 0.038 -0.026 -3.153 300 1HB LEU 36 HB2 LEU 36 -1.614 0.385 -0.644 301 2HB LEU 36 HB3 LEU 36 -0.498 -0.962 -0.879 302 HG LEU 36 HG LEU 36 0.195 1.990 -0.868 303 1HD1 LEU 36 HD11 LEU 36 -0.123 0.337 1.259 304 2HD1 LEU 36 HD12 LEU 36 1.563 0.003 0.863 305 3HD1 LEU 36 HD13 LEU 36 1.052 1.652 1.226 306 1HD2 LEU 36 HD21 LEU 36 1.842 -0.463 -1.542 307 2HD2 LEU 36 HD22 LEU 36 1.549 0.945 -2.562 308 3HD2 LEU 36 HD23 LEU 36 2.560 1.092 -1.124 309 H LEU 37 H LEU 37 -0.545 -2.033 -3.887 310 HA LEU 37 HA LEU 37 -3.403 -2.467 -4.482 311 1HB LEU 37 HB2 LEU 37 -0.822 -3.449 -5.517 312 2HB LEU 37 HB3 LEU 37 -2.104 -4.659 -5.465 313 HG LEU 37 HG LEU 37 -2.494 -1.908 -6.659 314 1HD1 LEU 37 HD11 LEU 37 -1.691 -4.514 -7.988 315 2HD1 LEU 37 HD12 LEU 37 -2.274 -3.097 -8.862 316 3HD1 LEU 37 HD13 LEU 37 -0.764 -3.014 -7.955 317 1HD2 LEU 37 HD21 LEU 37 -4.353 -3.698 -5.857 318 2HD2 LEU 37 HD22 LEU 37 -4.584 -2.653 -7.259 319 3HD2 LEU 37 HD23 LEU 37 -4.039 -4.316 -7.478 320 H LEU 38 H LEU 38 -4.548 -4.333 -3.830 321 HA LEU 38 HA LEU 38 -5.170 -6.079 -2.411 322 1HB LEU 38 HB2 LEU 38 -2.166 -6.383 -2.171 323 2HB LEU 38 HB3 LEU 38 -3.343 -7.545 -1.557 324 HG LEU 38 HG LEU 38 -3.461 -6.661 -4.430 325 1HD1 LEU 38 HD11 LEU 38 -1.305 -8.144 -3.169 326 2HD1 LEU 38 HD12 LEU 38 -2.142 -9.136 -4.363 327 3HD1 LEU 38 HD13 LEU 38 -1.446 -7.586 -4.836 328 1HD2 LEU 38 HD21 LEU 38 -4.407 -8.981 -2.759 329 2HD2 LEU 38 HD22 LEU 38 -5.336 -7.950 -3.848 330 3HD2 LEU 38 HD23 LEU 38 -4.235 -9.161 -4.505 331 H VAL 39 H VAL 39 -4.634 -3.283 -1.317 332 HA VAL 39 HA VAL 39 -4.686 -4.145 1.519 333 HB VAL 39 HB VAL 39 -2.988 -2.692 2.254 334 1HG1 VAL 39 HG11 VAL 39 -2.289 -4.698 0.755 335 2HG1 VAL 39 HG12 VAL 39 -1.866 -3.465 -0.433 336 3HG1 VAL 39 HG13 VAL 39 -1.073 -3.482 1.143 337 1HG2 VAL 39 HG21 VAL 39 -3.774 -0.738 0.886 338 2HG2 VAL 39 HG22 VAL 39 -2.019 -0.913 0.901 339 3HG2 VAL 39 HG23 VAL 39 -2.944 -1.432 -0.508 340 H ASP 40 H ASP 40 -5.770 -2.649 2.903 341 HA ASP 40 HA ASP 40 -6.982 -0.254 1.666 342 1HB ASP 40 HB2 ASP 40 -8.637 -1.922 1.115 343 2HB ASP 40 HB3 ASP 40 -8.572 -2.598 2.743 344 H THR 41 H THR 41 -6.241 1.196 3.173 345 HA THR 41 HA THR 41 -5.984 0.504 5.987 346 HB THR 41 HB THR 41 -5.295 2.833 6.277 347 HG1 THR 41 HG1 THR 41 -5.400 4.199 4.407 348 1HG2 THR 41 HG21 THR 41 -4.262 1.618 3.700 349 2HG2 THR 41 HG22 THR 41 -3.462 2.905 4.602 350 3HG2 THR 41 HG23 THR 41 -3.641 1.305 5.320 351 HA PRO 42 HA PRO 42 -10.070 1.555 7.289 352 1HB PRO 42 HB2 PRO 42 -9.526 2.050 9.922 353 2HB PRO 42 HB3 PRO 42 -9.537 0.417 9.232 354 1HG PRO 42 HG2 PRO 42 -7.204 2.159 9.928 355 2HG PRO 42 HG3 PRO 42 -7.368 0.399 10.051 356 1HD PRO 42 HD2 PRO 42 -6.016 1.698 8.004 357 2HD PRO 42 HD3 PRO 42 -6.703 0.063 7.870 358 H GLU 43 H GLU 43 -7.373 3.748 7.837 359 HA GLU 43 HA GLU 43 -8.952 5.999 8.729 360 1HB GLU 43 HB2 GLU 43 -6.514 5.851 9.121 361 2HB GLU 43 HB3 GLU 43 -6.232 5.949 7.382 362 1HG GLU 43 HG2 GLU 43 -6.157 8.190 7.652 363 2HG GLU 43 HG3 GLU 43 -7.902 8.115 7.899 364 H THR 44 H THR 44 -7.684 4.987 5.558 365 HA THR 44 HA THR 44 -8.527 7.216 4.048 366 HB THR 44 HB THR 44 -8.680 5.547 2.133 367 HG1 THR 44 HG1 THR 44 -9.125 3.872 3.956 368 1HG2 THR 44 HG21 THR 44 -6.310 5.907 3.929 369 2HG2 THR 44 HG22 THR 44 -6.175 4.802 2.563 370 3HG2 THR 44 HG23 THR 44 -6.570 6.499 2.287 371 H LYS 45 H LYS 45 -10.533 8.027 3.906 372 HA LYS 45 HA LYS 45 -12.834 6.118 3.965 373 1HB LYS 45 HB2 LYS 45 -14.122 8.217 4.810 374 2HB LYS 45 HB3 LYS 45 -13.104 7.346 5.953 375 1HG LYS 45 HG2 LYS 45 -11.517 9.311 4.563 376 2HG LYS 45 HG3 LYS 45 -12.944 10.080 5.244 377 1HD LYS 45 HD2 LYS 45 -12.359 9.572 7.423 378 2HD LYS 45 HD3 LYS 45 -11.443 8.140 6.951 379 1HE LYS 45 HE2 LYS 45 -9.843 9.803 7.638 380 2HE LYS 45 HE3 LYS 45 -9.753 9.693 5.880 381 1HZ LYS 45 HZ1 LYS 45 -11.351 11.702 7.374 382 2HZ LYS 45 HZ2 LYS 45 -9.827 11.994 6.682 383 3HZ LYS 45 HZ3 LYS 45 -11.156 11.621 5.691 384 H HIS 46 H HIS 46 -11.970 6.341 1.545 385 HA HIS 46 HA HIS 46 -12.860 8.728 0.142 386 1HB HIS 46 HB2 HIS 46 -11.316 6.386 -0.463 387 2HB HIS 46 HB3 HIS 46 -12.575 6.584 -1.682 388 HD1 HIS 46 HD1 HIS 46 -9.414 7.192 -2.027 389 HD2 HIS 46 HD2 HIS 46 -12.453 10.002 -1.526 390 HE1 HIS 46 HE1 HIS 46 -8.545 9.365 -2.993 391 HA PRO 47 HA PRO 47 -16.448 5.856 -1.138 392 1HB PRO 47 HB2 PRO 47 -16.445 3.295 -0.184 393 2HB PRO 47 HB3 PRO 47 -15.565 3.785 -1.641 394 1HG PRO 47 HG2 PRO 47 -14.503 3.057 1.017 395 2HG PRO 47 HG3 PRO 47 -13.684 3.077 -0.552 396 1HD PRO 47 HD2 PRO 47 -13.536 5.061 1.533 397 2HD PRO 47 HD3 PRO 47 -12.741 5.097 -0.053 398 H LYS 48 H LYS 48 -18.407 4.638 0.030 399 HA LYS 48 HA LYS 48 -19.057 6.175 2.376 400 1HB LYS 48 HB2 LYS 48 -20.415 3.678 1.317 401 2HB LYS 48 HB3 LYS 48 -21.118 4.865 2.418 402 1HG LYS 48 HG2 LYS 48 -21.228 6.528 0.757 403 2HG LYS 48 HG3 LYS 48 -20.048 5.710 -0.268 404 1HD LYS 48 HD2 LYS 48 -21.982 5.113 -1.379 405 2HD LYS 48 HD3 LYS 48 -21.889 3.782 -0.224 406 1HE LYS 48 HE2 LYS 48 -23.264 5.346 1.339 407 2HE LYS 48 HE3 LYS 48 -23.645 6.227 -0.141 408 1HZ LYS 48 HZ1 LYS 48 -24.206 3.875 -1.025 409 2HZ LYS 48 HZ2 LYS 48 -24.354 3.478 0.621 410 3HZ LYS 48 HZ3 LYS 48 -25.330 4.694 -0.055 411 H LYS 49 H LYS 49 -17.137 3.434 1.996 412 HA LYS 49 HA LYS 49 -17.741 1.775 4.169 413 1HB LYS 49 HB2 LYS 49 -15.353 2.406 2.592 414 2HB LYS 49 HB3 LYS 49 -14.970 1.944 4.252 415 1HG LYS 49 HG2 LYS 49 -17.030 0.274 2.949 416 2HG LYS 49 HG3 LYS 49 -15.420 0.154 2.238 417 1HD LYS 49 HD2 LYS 49 -14.506 -0.216 4.557 418 2HD LYS 49 HD3 LYS 49 -16.170 -0.306 5.136 419 1HE LYS 49 HE2 LYS 49 -15.641 -2.560 4.750 420 2HE LYS 49 HE3 LYS 49 -16.471 -2.098 3.264 421 1HZ LYS 49 HZ1 LYS 49 -13.666 -1.533 3.186 422 2HZ LYS 49 HZ2 LYS 49 -13.982 -3.184 3.431 423 3HZ LYS 49 HZ3 LYS 49 -14.628 -2.390 2.079 424 H GLY 50 H GLY 50 -15.295 4.394 4.316 425 1HA GLY 50 HA2 GLY 50 -15.014 6.016 6.028 426 2HA GLY 50 HA3 GLY 50 -16.393 5.317 6.880 427 H VAL 51 H VAL 51 -14.373 5.881 8.504 428 HA VAL 51 HA VAL 51 -12.497 3.626 8.711 429 HB VAL 51 HB VAL 51 -12.912 5.705 10.848 430 1HG1 VAL 51 HG11 VAL 51 -10.949 3.684 10.135 431 2HG1 VAL 51 HG12 VAL 51 -10.202 5.276 10.267 432 3HG1 VAL 51 HG13 VAL 51 -11.103 4.609 11.628 433 1HG2 VAL 51 HG21 VAL 51 -11.546 6.057 8.164 434 2HG2 VAL 51 HG22 VAL 51 -12.860 7.027 8.830 435 3HG2 VAL 51 HG23 VAL 51 -11.251 7.112 9.547 436 H GLU 52 H GLU 52 -13.072 1.758 9.712 437 HA GLU 52 HA GLU 52 -15.527 1.260 10.984 438 1HB GLU 52 HB2 GLU 52 -12.832 -0.059 11.430 439 2HB GLU 52 HB3 GLU 52 -14.357 -0.701 12.040 440 1HG GLU 52 HG2 GLU 52 -14.124 -0.020 9.128 441 2HG GLU 52 HG3 GLU 52 -13.419 -1.526 9.716 442 H LYS 53 H LYS 53 -12.440 1.431 12.774 443 HA LYS 53 HA LYS 53 -13.248 3.452 14.609 444 1HB LYS 53 HB2 LYS 53 -13.492 1.773 16.606 445 2HB LYS 53 HB3 LYS 53 -14.889 2.087 15.578 446 1HG LYS 53 HG2 LYS 53 -14.339 0.074 14.239 447 2HG LYS 53 HG3 LYS 53 -12.979 -0.254 15.315 448 1HD LYS 53 HD2 LYS 53 -14.719 -0.179 17.223 449 2HD LYS 53 HD3 LYS 53 -15.928 -0.330 15.949 450 1HE LYS 53 HE2 LYS 53 -15.523 -2.566 16.527 451 2HE LYS 53 HE3 LYS 53 -14.464 -2.335 15.136 452 1HZ LYS 53 HZ1 LYS 53 -12.895 -1.534 17.150 453 2HZ LYS 53 HZ2 LYS 53 -13.797 -2.751 17.919 454 3HZ LYS 53 HZ3 LYS 53 -12.902 -3.109 16.521 455 H TYR 54 H TYR 54 -10.923 2.454 13.141 456 HA TYR 54 HA TYR 54 -9.038 2.261 15.443 457 1HB TYR 54 HB2 TYR 54 -9.582 0.180 13.591 458 2HB TYR 54 HB3 TYR 54 -8.000 0.832 13.167 459 HD1 TYR 54 HD1 TYR 54 -6.342 1.238 15.152 460 HD2 TYR 54 HD2 TYR 54 -9.770 -1.342 15.362 461 HE1 TYR 54 HE1 TYR 54 -5.332 0.053 17.083 462 HE2 TYR 54 HE2 TYR 54 -8.760 -2.526 17.294 463 HH TYR 54 HH TYR 54 -6.069 -1.313 18.990 464 H GLY 55 H GLY 55 -10.037 4.191 13.136 465 1HA GLY 55 HA2 GLY 55 -8.175 4.880 11.273 466 2HA GLY 55 HA3 GLY 55 -8.978 6.114 12.242 467 HA PRO 56 HA PRO 56 -4.602 5.348 14.038 468 1HB PRO 56 HB2 PRO 56 -2.908 3.947 12.414 469 2HB PRO 56 HB3 PRO 56 -4.012 3.164 13.557 470 1HG PRO 56 HG2 PRO 56 -4.137 3.242 10.614 471 2HG PRO 56 HG3 PRO 56 -4.943 2.139 11.740 472 1HD PRO 56 HD2 PRO 56 -6.060 4.460 10.406 473 2HD PRO 56 HD3 PRO 56 -6.883 3.312 11.484 474 H GLU 57 H GLU 57 -2.106 5.597 12.690 475 HA GLU 57 HA GLU 57 -2.568 8.078 11.086 476 1HB GLU 57 HB2 GLU 57 -0.170 7.316 12.786 477 2HB GLU 57 HB3 GLU 57 -0.353 8.819 11.881 478 1HG GLU 57 HG2 GLU 57 -2.662 8.860 13.286 479 2HG GLU 57 HG3 GLU 57 -1.645 7.969 14.419 480 H ALA 58 H ALA 58 -2.737 5.822 9.620 481 HA ALA 58 HA ALA 58 -0.376 4.595 8.687 482 1HB ALA 58 HB1 ALA 58 -2.907 5.303 7.174 483 2HB ALA 58 HB2 ALA 58 -1.649 4.235 6.554 484 3HB ALA 58 HB3 ALA 58 -2.558 3.782 7.995 485 H SER 59 H SER 59 -1.986 7.528 7.409 486 HA SER 59 HA SER 59 -0.296 8.182 5.316 487 1HB SER 59 HB2 SER 59 -1.046 10.302 7.318 488 2HB SER 59 HB3 SER 59 -0.977 10.421 5.562 489 HG SER 59 HG SER 59 -3.020 9.672 7.168 490 H ALA 60 H ALA 60 0.299 8.836 8.776 491 HA ALA 60 HA ALA 60 2.834 10.101 8.417 492 1HB ALA 60 HB1 ALA 60 1.208 9.445 10.585 493 2HB ALA 60 HB2 ALA 60 2.668 8.489 10.844 494 3HB ALA 60 HB3 ALA 60 2.778 10.241 10.673 495 H PHE 61 H PHE 61 1.927 6.707 8.882 496 HA PHE 61 HA PHE 61 4.462 5.541 9.141 497 1HB PHE 61 HB2 PHE 61 2.139 4.414 9.139 498 2HB PHE 61 HB3 PHE 61 2.322 4.337 7.387 499 HD1 PHE 61 HD1 PHE 61 3.710 3.204 10.624 500 HD2 PHE 61 HD2 PHE 61 3.919 2.850 6.348 501 HE1 PHE 61 HE1 PHE 61 5.139 1.192 10.860 502 HE2 PHE 61 HE2 PHE 61 5.347 0.837 6.584 503 HZ PHE 61 HZ PHE 61 5.958 0.008 8.840 504 H THR 62 H THR 62 2.693 5.833 6.054 505 HA THR 62 HA THR 62 5.001 5.272 4.443 506 HB THR 62 HB THR 62 2.614 6.894 3.540 507 HG1 THR 62 HG1 THR 62 2.837 4.077 3.769 508 1HG2 THR 62 HG21 THR 62 4.888 5.656 2.280 509 2HG2 THR 62 HG22 THR 62 3.406 4.894 1.703 510 3HG2 THR 62 HG23 THR 62 3.619 6.637 1.548 511 H LYS 63 H LYS 63 3.952 8.116 6.084 512 HA LYS 63 HA LYS 63 5.107 10.119 4.415 513 1HB LYS 63 HB2 LYS 63 3.688 10.149 6.746 514 2HB LYS 63 HB3 LYS 63 5.300 10.576 7.323 515 1HG LYS 63 HG2 LYS 63 4.603 11.966 4.849 516 2HG LYS 63 HG3 LYS 63 3.475 12.322 6.157 517 1HD LYS 63 HD2 LYS 63 5.382 12.883 7.635 518 2HD LYS 63 HD3 LYS 63 6.494 12.566 6.304 519 1HE LYS 63 HE2 LYS 63 4.258 14.473 5.791 520 2HE LYS 63 HE3 LYS 63 5.579 15.031 6.817 521 1HZ LYS 63 HZ1 LYS 63 6.405 13.626 4.429 522 2HZ LYS 63 HZ2 LYS 63 5.610 15.097 4.139 523 3HZ LYS 63 HZ3 LYS 63 7.003 15.063 5.110 524 H LYS 64 H LYS 64 6.473 8.968 7.501 525 HA LYS 64 HA LYS 64 9.121 9.896 6.844 526 1HB LYS 64 HB2 LYS 64 7.802 8.545 9.070 527 2HB LYS 64 HB3 LYS 64 9.427 7.919 8.786 528 1HG LYS 64 HG2 LYS 64 10.429 9.879 9.384 529 2HG LYS 64 HG3 LYS 64 9.162 10.866 8.657 530 1HD LYS 64 HD2 LYS 64 8.680 11.275 10.869 531 2HD LYS 64 HD3 LYS 64 7.734 9.800 10.662 532 1HE LYS 64 HE2 LYS 64 9.454 8.450 11.635 533 2HE LYS 64 HE3 LYS 64 10.619 9.772 11.573 534 1HZ LYS 64 HZ1 LYS 64 8.113 9.874 13.152 535 2HZ LYS 64 HZ2 LYS 64 9.604 9.375 13.796 536 3HZ LYS 64 HZ3 LYS 64 9.414 10.960 13.212 537 H MET 65 H MET 65 7.368 6.990 6.147 538 HA MET 65 HA MET 65 9.536 5.177 5.786 539 1HB MET 65 HB2 MET 65 7.056 4.624 5.780 540 2HB MET 65 HB3 MET 65 7.006 5.243 4.128 541 1HG MET 65 HG2 MET 65 7.903 3.342 3.315 542 2HG MET 65 HG3 MET 65 9.226 3.405 4.478 543 1HE MET 65 HE1 MET 65 9.005 0.975 3.926 544 2HE MET 65 HE2 MET 65 9.454 0.923 5.628 545 3HE MET 65 HE3 MET 65 8.191 -0.145 5.025 546 H VAL 66 H VAL 66 7.709 6.645 3.103 547 HA VAL 66 HA VAL 66 9.810 6.260 1.204 548 HB VAL 66 HB VAL 66 8.485 8.081 -0.087 549 1HG1 VAL 66 HG11 VAL 66 7.767 5.332 0.689 550 2HG1 VAL 66 HG12 VAL 66 6.406 6.284 0.094 551 3HG1 VAL 66 HG13 VAL 66 7.838 6.067 -0.913 552 1HG2 VAL 66 HG21 VAL 66 7.418 8.484 2.461 553 2HG2 VAL 66 HG22 VAL 66 6.758 9.112 0.951 554 3HG2 VAL 66 HG23 VAL 66 6.158 7.590 1.609 555 H GLU 67 H GLU 67 9.111 8.894 3.438 556 HA GLU 67 HA GLU 67 10.745 10.898 2.238 557 1HB GLU 67 HB2 GLU 67 9.574 10.408 4.905 558 2HB GLU 67 HB3 GLU 67 11.030 11.404 4.909 559 1HG GLU 67 HG2 GLU 67 9.535 12.363 2.747 560 2HG GLU 67 HG3 GLU 67 8.345 12.085 4.019 561 H ASN 68 H ASN 68 11.533 8.234 4.426 562 HA ASN 68 HA ASN 68 14.385 9.050 4.416 563 1HB ASN 68 HB2 ASN 68 12.670 7.325 6.096 564 2HB ASN 68 HB3 ASN 68 14.298 6.703 5.820 565 1HD2 ASN 68 HD21 ASN 68 12.462 9.378 7.249 566 2HD2 ASN 68 HD22 ASN 68 13.766 10.048 8.104 567 H ALA 69 H ALA 69 12.263 7.052 2.674 568 HA ALA 69 HA ALA 69 13.883 4.807 2.050 569 1HB ALA 69 HB1 ALA 69 11.460 5.152 1.399 570 2HB ALA 69 HB2 ALA 69 12.027 6.230 0.122 571 3HB ALA 69 HB3 ALA 69 12.484 4.527 0.106 572 H LYS 70 H LYS 70 15.946 4.934 1.301 573 HA LYS 70 HA LYS 70 17.042 7.242 -0.002 574 1HB LYS 70 HB2 LYS 70 18.202 4.495 -0.387 575 2HB LYS 70 HB3 LYS 70 19.036 6.029 -0.137 576 1HG LYS 70 HG2 LYS 70 17.762 5.955 2.193 577 2HG LYS 70 HG3 LYS 70 17.753 4.220 1.874 578 1HD LYS 70 HD2 LYS 70 20.175 6.036 2.018 579 2HD LYS 70 HD3 LYS 70 19.763 4.721 3.119 580 1HE LYS 70 HE2 LYS 70 20.261 4.311 0.160 581 2HE LYS 70 HE3 LYS 70 21.517 4.137 1.386 582 1HZ LYS 70 HZ1 LYS 70 19.776 2.595 2.496 583 2HZ LYS 70 HZ2 LYS 70 19.121 2.494 0.935 584 3HZ LYS 70 HZ3 LYS 70 20.725 2.007 1.216 585 H LYS 71 H LYS 71 15.218 4.542 -1.167 586 HA LYS 71 HA LYS 71 15.351 5.670 -3.895 587 1HB LYS 71 HB2 LYS 71 16.315 2.924 -3.127 588 2HB LYS 71 HB3 LYS 71 15.640 3.214 -4.730 589 1HG LYS 71 HG2 LYS 71 17.959 4.724 -3.488 590 2HG LYS 71 HG3 LYS 71 18.085 3.506 -4.757 591 1HD LYS 71 HD2 LYS 71 16.136 5.418 -5.584 592 2HD LYS 71 HD3 LYS 71 17.560 6.305 -5.039 593 1HE LYS 71 HE2 LYS 71 18.777 5.636 -6.821 594 2HE LYS 71 HE3 LYS 71 18.264 3.958 -6.631 595 1HZ LYS 71 HZ1 LYS 71 16.550 6.073 -7.808 596 2HZ LYS 71 HZ2 LYS 71 17.531 5.043 -8.731 597 3HZ LYS 71 HZ3 LYS 71 16.265 4.398 -7.798 598 H ILE 72 H ILE 72 13.282 5.780 -4.595 599 HA ILE 72 HA ILE 72 11.290 3.910 -3.398 600 HB ILE 72 HB ILE 72 11.052 6.649 -4.657 601 1HG1 ILE 72 HG12 ILE 72 9.624 6.101 -2.180 602 2HG1 ILE 72 HG13 ILE 72 11.341 5.724 -2.026 603 1HG2 ILE 72 HG21 ILE 72 8.857 4.663 -3.999 604 2HG2 ILE 72 HG22 ILE 72 8.579 6.377 -4.314 605 3HG2 ILE 72 HG23 ILE 72 9.230 5.340 -5.585 606 1HD1 ILE 72 HD11 ILE 72 10.920 8.215 -3.473 607 2HD1 ILE 72 HD12 ILE 72 10.188 8.264 -1.869 608 3HD1 ILE 72 HD13 ILE 72 11.906 7.906 -2.044 609 H GLU 73 H GLU 73 10.644 2.260 -4.695 610 HA GLU 73 HA GLU 73 10.852 2.668 -7.652 611 1HB GLU 73 HB2 GLU 73 11.517 0.329 -5.900 612 2HB GLU 73 HB3 GLU 73 10.967 0.030 -7.548 613 1HG GLU 73 HG2 GLU 73 12.996 0.567 -8.351 614 2HG GLU 73 HG3 GLU 73 12.894 2.157 -7.593 615 H VAL 74 H VAL 74 9.327 1.178 -8.874 616 HA VAL 74 HA VAL 74 6.812 0.610 -7.397 617 HB VAL 74 HB VAL 74 5.494 1.677 -9.198 618 1HG1 VAL 74 HG11 VAL 74 6.527 2.925 -7.110 619 2HG1 VAL 74 HG12 VAL 74 7.462 3.773 -8.342 620 3HG1 VAL 74 HG13 VAL 74 5.701 3.842 -8.370 621 1HG2 VAL 74 HG21 VAL 74 8.236 2.471 -10.226 622 2HG2 VAL 74 HG22 VAL 74 7.058 1.445 -11.046 623 3HG2 VAL 74 HG23 VAL 74 6.722 3.160 -10.812 624 H GLU 75 H GLU 75 5.797 -1.254 -8.171 625 HA GLU 75 HA GLU 75 7.009 -2.482 -10.616 626 1HB GLU 75 HB2 GLU 75 7.736 -3.557 -8.452 627 2HB GLU 75 HB3 GLU 75 6.049 -3.987 -8.169 628 1HG GLU 75 HG2 GLU 75 6.043 -5.168 -10.385 629 2HG GLU 75 HG3 GLU 75 7.777 -4.862 -10.499 630 H PHE 76 H PHE 76 5.374 -2.200 -12.101 631 HA PHE 76 HA PHE 76 2.566 -2.341 -11.403 632 1HB PHE 76 HB2 PHE 76 3.960 -2.506 -14.094 633 2HB PHE 76 HB3 PHE 76 2.217 -2.359 -13.877 634 HD1 PHE 76 HD1 PHE 76 1.231 -0.304 -12.917 635 HD2 PHE 76 HD2 PHE 76 5.442 -0.632 -13.701 636 HE1 PHE 76 HE1 PHE 76 1.462 2.158 -12.708 637 HE2 PHE 76 HE2 PHE 76 5.672 1.828 -13.494 638 HZ PHE 76 HZ PHE 76 3.682 3.223 -12.997 639 H ASP 77 H ASP 77 1.155 -4.100 -11.639 640 HA ASP 77 HA ASP 77 2.422 -6.741 -11.659 641 1HB ASP 77 HB2 ASP 77 0.125 -5.677 -10.503 642 2HB ASP 77 HB3 ASP 77 -0.496 -6.723 -11.780 643 H LYS 78 H LYS 78 0.651 -8.369 -12.947 644 HA LYS 78 HA LYS 78 1.182 -7.690 -15.769 645 1HB LYS 78 HB2 LYS 78 0.556 -10.005 -16.227 646 2HB LYS 78 HB3 LYS 78 1.692 -9.964 -14.877 647 1HG LYS 78 HG2 LYS 78 -0.852 -9.683 -13.713 648 2HG LYS 78 HG3 LYS 78 -1.034 -10.944 -14.933 649 1HD LYS 78 HD2 LYS 78 1.441 -11.435 -13.653 650 2HD LYS 78 HD3 LYS 78 0.280 -11.096 -12.370 651 1HE LYS 78 HE2 LYS 78 -0.908 -12.996 -12.771 652 2HE LYS 78 HE3 LYS 78 -0.744 -12.840 -14.520 653 1HZ LYS 78 HZ1 LYS 78 1.652 -13.500 -14.169 654 2HZ LYS 78 HZ2 LYS 78 1.210 -13.953 -12.596 655 3HZ LYS 78 HZ3 LYS 78 0.495 -14.722 -13.931 656 H GLY 79 H GLY 79 -1.435 -7.567 -13.538 657 1HA GLY 79 HA2 GLY 79 -3.595 -7.914 -15.430 658 2HA GLY 79 HA3 GLY 79 -3.733 -7.156 -13.842 659 H GLN 80 H GLN 80 -4.917 -5.337 -14.509 660 HA GLN 80 HA GLN 80 -4.234 -3.746 -16.807 661 1HB GLN 80 HB2 GLN 80 -5.586 -2.549 -14.409 662 2HB GLN 80 HB3 GLN 80 -5.931 -2.303 -16.121 663 1HG GLN 80 HG2 GLN 80 -6.631 -4.786 -16.148 664 2HG GLN 80 HG3 GLN 80 -6.653 -4.667 -14.390 665 1HE2 GLN 80 HE21 GLN 80 -9.074 -5.053 -14.664 666 2HE2 GLN 80 HE22 GLN 80 -10.064 -3.720 -15.018 667 H ARG 81 H ARG 81 -3.670 -1.283 -16.383 668 HA ARG 81 HA ARG 81 -1.268 -1.278 -14.608 669 1HB ARG 81 HB2 ARG 81 -1.462 -0.643 -17.285 670 2HB ARG 81 HB3 ARG 81 -1.549 0.941 -16.515 671 1HG ARG 81 HG2 ARG 81 0.484 0.257 -15.146 672 2HG ARG 81 HG3 ARG 81 0.629 -1.137 -16.216 673 1HD ARG 81 HD2 ARG 81 0.318 0.952 -17.995 674 2HD ARG 81 HD3 ARG 81 1.296 1.676 -16.718 675 HE ARG 81 HE ARG 81 2.301 -0.931 -17.505 676 1HH1 ARG 81 HH11 ARG 81 3.623 1.856 -16.851 677 2HH1 ARG 81 HH12 ARG 81 4.475 2.117 -18.336 678 1HH2 ARG 81 HH21 ARG 81 2.771 -0.365 -20.056 679 2HH2 ARG 81 HH22 ARG 81 3.993 0.858 -20.151 680 H THR 82 H THR 82 -4.375 0.122 -15.107 681 HA THR 82 HA THR 82 -3.919 1.881 -12.760 682 HB THR 82 HB THR 82 -4.617 3.849 -13.806 683 HG1 THR 82 HG1 THR 82 -6.495 3.035 -14.730 684 1HG2 THR 82 HG21 THR 82 -2.437 3.021 -14.732 685 2HG2 THR 82 HG22 THR 82 -3.325 2.348 -16.098 686 3HG2 THR 82 HG23 THR 82 -3.308 4.091 -15.829 687 H ASP 83 H ASP 83 -6.171 2.823 -12.080 688 HA ASP 83 HA ASP 83 -8.108 0.568 -12.241 689 1HB ASP 83 HB2 ASP 83 -7.430 2.630 -10.222 690 2HB ASP 83 HB3 ASP 83 -9.147 2.247 -10.367 691 H LYS 84 H LYS 84 -10.489 1.823 -11.719 692 HA LYS 84 HA LYS 84 -11.144 2.971 -14.285 693 1HB LYS 84 HB2 LYS 84 -13.371 3.457 -13.154 694 2HB LYS 84 HB3 LYS 84 -12.873 1.765 -13.136 695 1HG LYS 84 HG2 LYS 84 -12.181 1.886 -10.861 696 2HG LYS 84 HG3 LYS 84 -12.238 3.649 -10.860 697 1HD LYS 84 HD2 LYS 84 -14.542 3.715 -10.691 698 2HD LYS 84 HD3 LYS 84 -14.753 2.167 -11.510 699 1HE LYS 84 HE2 LYS 84 -14.415 0.944 -9.586 700 2HE LYS 84 HE3 LYS 84 -13.337 2.150 -8.884 701 1HZ LYS 84 HZ1 LYS 84 -16.020 3.099 -9.290 702 2HZ LYS 84 HZ2 LYS 84 -15.929 1.791 -8.209 703 3HZ LYS 84 HZ3 LYS 84 -15.029 3.202 -7.917 704 H TYR 85 H TYR 85 -9.744 4.290 -11.496 705 HA TYR 85 HA TYR 85 -10.785 7.017 -12.065 706 1HB TYR 85 HB2 TYR 85 -9.066 5.932 -9.815 707 2HB TYR 85 HB3 TYR 85 -9.523 7.627 -9.979 708 HD1 TYR 85 HD1 TYR 85 -11.910 8.308 -9.804 709 HD2 TYR 85 HD2 TYR 85 -10.644 4.268 -9.083 710 HE1 TYR 85 HE1 TYR 85 -14.073 7.829 -8.688 711 HE2 TYR 85 HE2 TYR 85 -12.806 3.788 -7.968 712 HH TYR 85 HH TYR 85 -15.354 6.271 -7.754 713 H GLY 86 H GLY 86 -8.258 5.030 -13.004 714 1HA GLY 86 HA2 GLY 86 -6.520 5.668 -14.519 715 2HA GLY 86 HA3 GLY 86 -6.755 7.349 -14.043 716 H ARG 87 H ARG 87 -6.706 5.594 -11.238 717 HA ARG 87 HA ARG 87 -4.168 6.632 -10.405 718 1HB ARG 87 HB2 ARG 87 -5.681 4.305 -9.182 719 2HB ARG 87 HB3 ARG 87 -4.499 5.341 -8.379 720 1HG ARG 87 HG2 ARG 87 -6.156 7.263 -9.158 721 2HG ARG 87 HG3 ARG 87 -7.323 5.941 -9.160 722 1HD ARG 87 HD2 ARG 87 -5.517 6.564 -6.811 723 2HD ARG 87 HD3 ARG 87 -7.162 7.184 -6.964 724 HE ARG 87 HE ARG 87 -6.411 4.387 -6.409 725 1HH1 ARG 87 HH11 ARG 87 -8.682 6.713 -5.828 726 2HH1 ARG 87 HH12 ARG 87 -10.069 5.703 -6.059 727 1HH2 ARG 87 HH21 ARG 87 -8.254 3.054 -7.366 728 2HH2 ARG 87 HH22 ARG 87 -9.827 3.632 -6.931 729 H GLY 88 H GLY 88 -2.161 5.573 -10.161 730 1HA GLY 88 HA2 GLY 88 -1.744 3.310 -11.999 731 2HA GLY 88 HA3 GLY 88 -0.478 4.210 -11.160 732 H LEU 89 H LEU 89 -1.619 1.216 -11.322 733 HA LEU 89 HA LEU 89 -1.546 0.733 -8.377 734 1HB LEU 89 HB2 LEU 89 -2.344 -1.269 -10.495 735 2HB LEU 89 HB3 LEU 89 -2.725 -1.291 -8.773 736 HG LEU 89 HG LEU 89 -3.668 0.913 -10.613 737 1HD1 LEU 89 HD11 LEU 89 -4.496 -1.392 -11.294 738 2HD1 LEU 89 HD12 LEU 89 -5.276 -1.490 -9.715 739 3HD1 LEU 89 HD13 LEU 89 -5.760 -0.240 -10.861 740 1HD2 LEU 89 HD21 LEU 89 -3.613 0.664 -7.846 741 2HD2 LEU 89 HD22 LEU 89 -4.654 1.757 -8.756 742 3HD2 LEU 89 HD23 LEU 89 -5.253 0.173 -8.264 743 H ALA 90 H ALA 90 0.337 -0.051 -7.582 744 HA ALA 90 HA ALA 90 1.827 -2.149 -8.892 745 1HB ALA 90 HB1 ALA 90 2.995 0.651 -8.936 746 2HB ALA 90 HB2 ALA 90 3.912 -0.817 -9.275 747 3HB ALA 90 HB3 ALA 90 2.589 -0.339 -10.339 748 H TYR 91 H TYR 91 3.256 -3.104 -7.424 749 HA TYR 91 HA TYR 91 2.975 -2.339 -4.646 750 1HB TYR 91 HB2 TYR 91 5.024 -4.241 -5.814 751 2HB TYR 91 HB3 TYR 91 4.379 -4.231 -4.171 752 HD1 TYR 91 HD1 TYR 91 2.081 -4.975 -3.708 753 HD2 TYR 91 HD2 TYR 91 3.725 -5.116 -7.673 754 HE1 TYR 91 HE1 TYR 91 0.224 -6.454 -4.426 755 HE2 TYR 91 HE2 TYR 91 1.869 -6.596 -8.391 756 HH TYR 91 HH TYR 91 0.276 -8.249 -7.210 757 H ILE 92 H ILE 92 4.074 -0.695 -3.715 758 HA ILE 92 HA ILE 92 6.455 0.417 -5.028 759 HB ILE 92 HB ILE 92 5.003 1.220 -2.490 760 1HG1 ILE 92 HG12 ILE 92 5.024 2.526 -5.226 761 2HG1 ILE 92 HG13 ILE 92 3.753 1.431 -4.679 762 1HG2 ILE 92 HG21 ILE 92 7.198 2.598 -4.069 763 2HG2 ILE 92 HG22 ILE 92 6.292 3.338 -2.749 764 3HG2 ILE 92 HG23 ILE 92 7.335 1.952 -2.433 765 1HD1 ILE 92 HD11 ILE 92 4.553 3.867 -3.081 766 2HD1 ILE 92 HD12 ILE 92 3.328 3.944 -4.348 767 3HD1 ILE 92 HD13 ILE 92 3.081 2.907 -2.943 768 H TYR 93 H TYR 93 8.520 0.582 -4.017 769 HA TYR 93 HA TYR 93 8.943 -1.160 -1.631 770 1HB TYR 93 HB2 TYR 93 10.466 -1.222 -4.249 771 2HB TYR 93 HB3 TYR 93 11.084 -1.939 -2.760 772 HD1 TYR 93 HD1 TYR 93 8.494 -2.151 -5.376 773 HD2 TYR 93 HD2 TYR 93 10.050 -3.921 -1.783 774 HE1 TYR 93 HE1 TYR 93 7.131 -4.182 -5.785 775 HE2 TYR 93 HE2 TYR 93 8.685 -5.950 -2.192 776 HH TYR 93 HH TYR 93 7.442 -6.793 -4.992 777 H ALA 94 H ALA 94 11.133 -0.688 -0.623 778 HA ALA 94 HA ALA 94 12.390 1.859 -1.360 779 1HB ALA 94 HB1 ALA 94 10.314 1.739 0.664 780 2HB ALA 94 HB2 ALA 94 11.846 2.257 1.368 781 3HB ALA 94 HB3 ALA 94 11.152 3.148 0.013 782 H ASP 95 H ASP 95 14.516 1.386 -1.119 783 HA ASP 95 HA ASP 95 16.503 0.560 -0.184 784 1HB ASP 95 HB2 ASP 95 14.800 0.325 2.316 785 2HB ASP 95 HB3 ASP 95 16.561 0.259 2.257 786 H GLY 96 H GLY 96 14.081 -1.212 -1.108 787 1HA GLY 96 HA2 GLY 96 14.239 -3.538 -1.698 788 2HA GLY 96 HA3 GLY 96 15.437 -3.755 -0.421 789 H LYS 97 H LYS 97 12.478 -2.014 0.216 790 HA LYS 97 HA LYS 97 11.488 -4.379 1.760 791 1HB LYS 97 HB2 LYS 97 12.360 -1.934 2.800 792 2HB LYS 97 HB3 LYS 97 10.600 -1.808 2.804 793 1HG LYS 97 HG2 LYS 97 10.532 -3.123 4.626 794 2HG LYS 97 HG3 LYS 97 11.244 -4.432 3.683 795 1HD LYS 97 HD2 LYS 97 13.511 -3.384 4.144 796 2HD LYS 97 HD3 LYS 97 12.699 -2.322 5.295 797 1HE LYS 97 HE2 LYS 97 12.445 -5.333 5.419 798 2HE LYS 97 HE3 LYS 97 13.720 -4.459 6.267 799 1HZ LYS 97 HZ1 LYS 97 10.892 -3.674 6.567 800 2HZ LYS 97 HZ2 LYS 97 11.542 -4.939 7.497 801 3HZ LYS 97 HZ3 LYS 97 12.196 -3.375 7.610 802 H MET 98 H MET 98 9.337 -4.875 1.462 803 HA MET 98 HA MET 98 7.911 -3.471 -0.672 804 1HB MET 98 HB2 MET 98 7.801 -5.949 -0.402 805 2HB MET 98 HB3 MET 98 6.960 -5.718 1.132 806 1HG MET 98 HG2 MET 98 5.237 -4.358 -0.151 807 2HG MET 98 HG3 MET 98 6.007 -4.930 -1.631 808 1HE MET 98 HE1 MET 98 6.021 -7.128 -2.543 809 2HE MET 98 HE2 MET 98 4.599 -8.162 -2.356 810 3HE MET 98 HE3 MET 98 4.408 -6.471 -2.811 811 H VAL 99 H VAL 99 7.002 -1.534 -0.131 812 HA VAL 99 HA VAL 99 6.284 -0.662 2.453 813 HB VAL 99 HB VAL 99 4.898 0.126 -0.125 814 1HG1 VAL 99 HG11 VAL 99 4.006 0.881 2.167 815 2HG1 VAL 99 HG12 VAL 99 5.492 1.821 2.305 816 3HG1 VAL 99 HG13 VAL 99 4.358 2.151 0.995 817 1HG2 VAL 99 HG21 VAL 99 7.660 0.439 0.746 818 2HG2 VAL 99 HG22 VAL 99 6.931 0.832 -0.812 819 3HG2 VAL 99 HG23 VAL 99 6.879 2.003 0.507 820 H ASN 100 H ASN 100 4.329 -2.371 0.022 821 HA ASN 100 HA ASN 100 1.833 -2.259 1.347 822 1HB ASN 100 HB2 ASN 100 2.943 -4.575 -0.267 823 2HB ASN 100 HB3 ASN 100 1.239 -4.251 0.056 824 1HD2 ASN 100 HD21 ASN 100 0.169 -2.870 -1.397 825 2HD2 ASN 100 HD22 ASN 100 0.948 -1.939 -2.583 826 H GLU 101 H GLU 101 4.344 -4.808 1.578 827 HA GLU 101 HA GLU 101 2.967 -6.225 3.683 828 1HB GLU 101 HB2 GLU 101 5.015 -6.874 2.041 829 2HB GLU 101 HB3 GLU 101 5.926 -6.448 3.490 830 1HG GLU 101 HG2 GLU 101 4.813 -8.084 4.803 831 2HG GLU 101 HG3 GLU 101 3.546 -8.305 3.595 832 H ALA 102 H ALA 102 4.896 -3.381 3.633 833 HA ALA 102 HA ALA 102 5.966 -3.534 6.302 834 1HB ALA 102 HB1 ALA 102 5.682 -1.470 4.204 835 2HB ALA 102 HB2 ALA 102 5.732 -0.856 5.856 836 3HB ALA 102 HB3 ALA 102 7.060 -1.838 5.240 837 H LEU 103 H LEU 103 3.201 -1.676 5.018 838 HA LEU 103 HA LEU 103 2.214 -0.878 7.576 839 1HB LEU 103 HB2 LEU 103 0.815 -1.226 4.910 840 2HB LEU 103 HB3 LEU 103 0.039 -0.526 6.331 841 HG LEU 103 HG LEU 103 2.696 0.578 5.548 842 1HD1 LEU 103 HD11 LEU 103 0.225 0.699 3.883 843 2HD1 LEU 103 HD12 LEU 103 1.125 2.200 4.094 844 3HD1 LEU 103 HD13 LEU 103 1.917 0.790 3.393 845 1HD2 LEU 103 HD21 LEU 103 0.093 1.611 6.696 846 2HD2 LEU 103 HD22 LEU 103 1.667 1.522 7.485 847 3HD2 LEU 103 HD23 LEU 103 1.393 2.694 6.196 848 H VAL 104 H VAL 104 1.409 -3.665 5.502 849 HA VAL 104 HA VAL 104 -0.612 -4.713 7.265 850 HB VAL 104 HB VAL 104 1.087 -5.962 5.096 851 1HG1 VAL 104 HG11 VAL 104 0.521 -7.670 6.812 852 2HG1 VAL 104 HG12 VAL 104 -1.182 -7.239 6.656 853 3HG1 VAL 104 HG13 VAL 104 -0.325 -7.959 5.292 854 1HG2 VAL 104 HG21 VAL 104 -1.702 -4.874 5.358 855 2HG2 VAL 104 HG22 VAL 104 -0.520 -4.611 4.075 856 3HG2 VAL 104 HG23 VAL 104 -1.382 -6.147 4.180 857 H ARG 105 H ARG 105 2.860 -4.799 7.276 858 HA ARG 105 HA ARG 105 3.079 -7.104 9.050 859 1HB ARG 105 HB2 ARG 105 4.949 -6.507 7.587 860 2HB ARG 105 HB3 ARG 105 5.062 -4.918 8.346 861 1HG ARG 105 HG2 ARG 105 6.383 -5.764 9.955 862 2HG ARG 105 HG3 ARG 105 5.114 -6.903 10.409 863 1HD ARG 105 HD2 ARG 105 6.021 -8.620 9.180 864 2HD ARG 105 HD3 ARG 105 6.671 -7.534 7.950 865 HE ARG 105 HE ARG 105 8.000 -8.275 10.480 866 1HH1 ARG 105 HH11 ARG 105 7.692 -5.687 8.296 867 2HH1 ARG 105 HH12 ARG 105 9.396 -5.452 8.092 868 1HH2 ARG 105 HH21 ARG 105 10.272 -8.240 9.959 869 2HH2 ARG 105 HH22 ARG 105 10.856 -6.896 9.037 870 H GLN 106 H GLN 106 2.645 -3.659 9.408 871 HA GLN 106 HA GLN 106 3.212 -3.800 12.315 872 1HB GLN 106 HB2 GLN 106 3.314 -1.746 10.314 873 2HB GLN 106 HB3 GLN 106 2.174 -1.254 11.567 874 1HG GLN 106 HG2 GLN 106 4.320 -0.490 12.297 875 2HG GLN 106 HG3 GLN 106 3.954 -1.917 13.269 876 1HE2 GLN 106 HE21 GLN 106 6.542 -0.583 11.881 877 2HE2 GLN 106 HE22 GLN 106 7.365 -1.958 11.322 878 H GLY 107 H GLY 107 0.701 -4.703 10.494 879 1HA GLY 107 HA2 GLY 107 -1.577 -5.024 10.949 880 2HA GLY 107 HA3 GLY 107 -1.198 -4.635 12.627 881 H LEU 108 H LEU 108 -1.108 -2.743 9.585 882 HA LEU 108 HA LEU 108 -2.800 -0.706 10.982 883 1HB LEU 108 HB2 LEU 108 -0.382 -0.432 9.232 884 2HB LEU 108 HB3 LEU 108 -1.613 0.832 9.179 885 HG LEU 108 HG LEU 108 -0.222 -0.167 11.682 886 1HD1 LEU 108 HD11 LEU 108 0.528 1.773 9.702 887 2HD1 LEU 108 HD12 LEU 108 0.150 2.613 11.206 888 3HD1 LEU 108 HD13 LEU 108 1.372 1.341 11.189 889 1HD2 LEU 108 HD21 LEU 108 -2.681 1.300 11.239 890 2HD2 LEU 108 HD22 LEU 108 -1.987 0.736 12.759 891 3HD2 LEU 108 HD23 LEU 108 -1.516 2.303 12.104 892 H ALA 109 H ALA 109 -1.954 -2.115 7.816 893 HA ALA 109 HA ALA 109 -4.594 -1.166 6.792 894 1HB ALA 109 HB1 ALA 109 -2.065 -2.025 5.363 895 2HB ALA 109 HB2 ALA 109 -3.591 -1.718 4.534 896 3HB ALA 109 HB3 ALA 109 -2.778 -0.413 5.398 897 H LYS 110 H LYS 110 -6.069 -2.676 5.976 898 HA LYS 110 HA LYS 110 -5.479 -5.505 6.675 899 1HB LYS 110 HB2 LYS 110 -8.042 -4.012 6.075 900 2HB LYS 110 HB3 LYS 110 -7.981 -5.768 6.235 901 1HG LYS 110 HG2 LYS 110 -6.944 -5.464 8.502 902 2HG LYS 110 HG3 LYS 110 -7.209 -3.728 8.339 903 1HD LYS 110 HD2 LYS 110 -9.504 -5.623 7.924 904 2HD LYS 110 HD3 LYS 110 -9.011 -5.196 9.563 905 1HE LYS 110 HE2 LYS 110 -9.086 -2.801 7.997 906 2HE LYS 110 HE3 LYS 110 -10.604 -3.665 7.759 907 1HZ LYS 110 HZ1 LYS 110 -9.862 -3.772 10.478 908 2HZ LYS 110 HZ2 LYS 110 -9.842 -2.158 9.960 909 3HZ LYS 110 HZ3 LYS 110 -11.252 -3.089 9.779 910 H VAL 111 H VAL 111 -5.371 -7.099 5.114 911 HA VAL 111 HA VAL 111 -4.858 -6.373 2.396 912 HB VAL 111 HB VAL 111 -5.581 -9.050 3.624 913 1HG1 VAL 111 HG11 VAL 111 -4.582 -8.305 0.862 914 2HG1 VAL 111 HG12 VAL 111 -4.487 -9.941 1.514 915 3HG1 VAL 111 HG13 VAL 111 -6.059 -9.180 1.268 916 1HG2 VAL 111 HG21 VAL 111 -3.001 -7.602 3.016 917 2HG2 VAL 111 HG22 VAL 111 -3.518 -8.330 4.539 918 3HG2 VAL 111 HG23 VAL 111 -3.049 -9.358 3.184 919 H ALA 112 H ALA 112 -6.191 -6.483 0.557 920 HA ALA 112 HA ALA 112 -8.780 -7.642 0.447 921 1HB ALA 112 HB1 ALA 112 -8.784 -5.375 2.069 922 2HB ALA 112 HB2 ALA 112 -9.378 -4.785 0.517 923 3HB ALA 112 HB3 ALA 112 -10.200 -6.120 1.327 924 H TYR 113 H TYR 113 -10.142 -6.135 -1.320 925 HA TYR 113 HA TYR 113 -10.170 -5.506 -3.579 926 1HB TYR 113 HB2 TYR 113 -7.565 -4.284 -2.647 927 2HB TYR 113 HB3 TYR 113 -8.168 -4.075 -4.292 928 HD1 TYR 113 HD1 TYR 113 -11.035 -3.819 -3.986 929 HD2 TYR 113 HD2 TYR 113 -7.896 -2.270 -1.498 930 HE1 TYR 113 HE1 TYR 113 -12.545 -2.013 -3.207 931 HE2 TYR 113 HE2 TYR 113 -9.405 -0.463 -0.718 932 HH TYR 113 HH TYR 113 -11.738 0.666 -2.007 933 H VAL 114 H VAL 114 -9.948 -7.906 -3.947 934 HA VAL 114 HA VAL 114 -7.305 -8.543 -5.196 935 HB VAL 114 HB VAL 114 -9.348 -10.436 -3.991 936 1HG1 VAL 114 HG11 VAL 114 -7.431 -10.903 -5.980 937 2HG1 VAL 114 HG12 VAL 114 -6.675 -11.473 -4.491 938 3HG1 VAL 114 HG13 VAL 114 -8.235 -12.124 -4.993 939 1HG2 VAL 114 HG21 VAL 114 -7.642 -8.854 -2.608 940 2HG2 VAL 114 HG22 VAL 114 -8.074 -10.482 -2.083 941 3HG2 VAL 114 HG23 VAL 114 -6.568 -10.208 -2.959 942 H TYR 115 H TYR 115 -7.564 -8.265 -7.369 943 HA TYR 115 HA TYR 115 -9.912 -9.598 -8.636 944 1HB TYR 115 HB2 TYR 115 -8.842 -6.842 -9.320 945 2HB TYR 115 HB3 TYR 115 -10.086 -7.700 -10.230 946 HD1 TYR 115 HD1 TYR 115 -9.292 -5.988 -7.062 947 HD2 TYR 115 HD2 TYR 115 -12.328 -8.008 -9.332 948 HE1 TYR 115 HE1 TYR 115 -11.020 -5.159 -5.488 949 HE2 TYR 115 HE2 TYR 115 -14.057 -7.178 -7.758 950 HH TYR 115 HH TYR 115 -14.080 -4.933 -6.071 951 H LYS 116 H LYS 116 -8.479 -11.317 -9.223 952 HA LYS 116 HA LYS 116 -5.956 -11.190 -10.366 953 1HB LYS 116 HB2 LYS 116 -8.149 -12.983 -11.436 954 2HB LYS 116 HB3 LYS 116 -6.415 -13.307 -11.411 955 1HG LYS 116 HG2 LYS 116 -6.567 -14.179 -9.344 956 2HG LYS 116 HG3 LYS 116 -7.312 -12.697 -8.743 957 1HD LYS 116 HD2 LYS 116 -9.409 -13.751 -10.096 958 2HD LYS 116 HD3 LYS 116 -8.583 -15.233 -9.612 959 1HE LYS 116 HE2 LYS 116 -8.455 -13.828 -7.289 960 2HE LYS 116 HE3 LYS 116 -9.972 -13.213 -7.947 961 1HZ LYS 116 HZ1 LYS 116 -9.849 -16.000 -8.318 962 2HZ LYS 116 HZ2 LYS 116 -9.525 -15.651 -6.690 963 3HZ LYS 116 HZ3 LYS 116 -10.963 -15.099 -7.406 964 HA PRO 117 HA PRO 117 -4.908 -12.198 -11.851 965 1HB PRO 117 HB2 PRO 117 -3.017 -11.557 -13.713 966 2HB PRO 117 HB3 PRO 117 -4.325 -12.709 -14.027 967 1HG PRO 117 HG2 PRO 117 -3.964 -9.972 -15.076 968 2HG PRO 117 HG3 PRO 117 -4.947 -11.298 -15.715 969 1HD PRO 117 HD2 PRO 117 -5.842 -9.033 -14.173 970 2HD PRO 117 HD3 PRO 117 -6.819 -10.384 -14.790 971 H ASN 118 H ASN 118 -5.462 -9.404 -10.902 972 HA ASN 118 HA ASN 118 -2.715 -8.302 -10.637 973 1HB ASN 118 HB2 ASN 118 -5.446 -7.200 -10.487 974 2HB ASN 118 HB3 ASN 118 -4.333 -6.575 -9.270 975 1HD2 ASN 118 HD21 ASN 118 -4.843 -4.569 -10.837 976 2HD2 ASN 118 HD22 ASN 118 -3.718 -4.342 -12.086 977 H ASN 119 H ASN 119 -2.241 -10.264 -9.239 978 HA ASN 119 HA ASN 119 -2.396 -9.486 -6.444 979 1HB ASN 119 HB2 ASN 119 -3.613 -11.460 -5.641 980 2HB ASN 119 HB3 ASN 119 -4.631 -10.536 -6.745 981 1HD2 ASN 119 HD21 ASN 119 -4.601 -13.525 -6.106 982 2HD2 ASN 119 HD22 ASN 119 -4.453 -14.279 -7.620 983 H THR 120 H THR 120 -0.479 -10.260 -8.613 984 HA THR 120 HA THR 120 0.696 -12.741 -8.440 985 HB THR 120 HB THR 120 2.106 -10.056 -8.380 986 HG1 THR 120 HG1 THR 120 1.776 -11.767 -10.584 987 1HG2 THR 120 HG21 THR 120 3.132 -12.829 -9.042 988 2HG2 THR 120 HG22 THR 120 4.015 -11.334 -9.358 989 3HG2 THR 120 HG23 THR 120 3.649 -11.810 -7.699 990 H HIS 121 H HIS 121 1.054 -10.117 -6.048 991 HA HIS 121 HA HIS 121 2.503 -12.016 -4.273 992 1HB HIS 121 HB2 HIS 121 2.208 -9.026 -4.364 993 2HB HIS 121 HB3 HIS 121 2.668 -9.814 -2.855 994 HD1 HIS 121 HD1 HIS 121 4.829 -11.467 -3.062 995 HD2 HIS 121 HD2 HIS 121 4.315 -8.702 -6.139 996 HE1 HIS 121 HE1 HIS 121 7.050 -11.320 -4.272 997 H GLU 122 H GLU 122 0.008 -12.894 -4.399 998 HA GLU 122 HA GLU 122 -1.665 -11.576 -2.354 999 1HB GLU 122 HB2 GLU 122 -2.796 -12.489 -4.314 1000 2HB GLU 122 HB3 GLU 122 -2.090 -14.078 -4.017 1001 1HG GLU 122 HG2 GLU 122 -4.124 -14.402 -2.985 1002 2HG GLU 122 HG3 GLU 122 -3.243 -13.707 -1.625 1003 H GLN 123 H GLN 123 0.358 -14.441 -2.732 1004 HA GLN 123 HA GLN 123 -0.462 -15.577 -0.165 1005 1HB GLN 123 HB2 GLN 123 1.917 -16.251 -1.924 1006 2HB GLN 123 HB3 GLN 123 1.310 -17.226 -0.585 1007 1HG GLN 123 HG2 GLN 123 -0.443 -18.034 -1.797 1008 2HG GLN 123 HG3 GLN 123 -0.713 -16.493 -2.615 1009 1HE2 GLN 123 HE21 GLN 123 -0.722 -18.919 -4.107 1010 2HE2 GLN 123 HE22 GLN 123 0.645 -18.947 -5.112 1011 H LEU 124 H LEU 124 2.245 -13.644 -1.390 1012 HA LEU 124 HA LEU 124 3.818 -13.784 1.019 1013 1HB LEU 124 HB2 LEU 124 4.509 -12.981 -1.358 1014 2HB LEU 124 HB3 LEU 124 3.845 -11.425 -0.858 1015 HG LEU 124 HG LEU 124 5.314 -11.613 1.220 1016 1HD1 LEU 124 HD11 LEU 124 6.434 -13.873 -0.457 1017 2HD1 LEU 124 HD12 LEU 124 7.336 -13.107 0.850 1018 3HD1 LEU 124 HD13 LEU 124 5.832 -13.960 1.198 1019 1HD2 LEU 124 HD21 LEU 124 5.830 -10.635 -1.334 1020 2HD2 LEU 124 HD22 LEU 124 6.770 -10.275 0.115 1021 3HD2 LEU 124 HD23 LEU 124 7.269 -11.583 -0.959 1022 H LEU 125 H LEU 125 1.439 -11.407 -0.180 1023 HA LEU 125 HA LEU 125 1.671 -9.657 2.091 1024 1HB LEU 125 HB2 LEU 125 -0.549 -10.085 0.073 1025 2HB LEU 125 HB3 LEU 125 -0.594 -8.829 1.311 1026 HG LEU 125 HG LEU 125 1.676 -9.133 -0.669 1027 1HD1 LEU 125 HD11 LEU 125 -0.913 -8.358 -1.285 1028 2HD1 LEU 125 HD12 LEU 125 -0.102 -6.824 -0.972 1029 3HD1 LEU 125 HD13 LEU 125 0.530 -7.921 -2.199 1030 1HD2 LEU 125 HD21 LEU 125 2.130 -7.945 1.493 1031 2HD2 LEU 125 HD22 LEU 125 2.275 -6.893 0.085 1032 3HD2 LEU 125 HD23 LEU 125 0.835 -6.814 1.099 1033 H ARG 126 H ARG 126 -0.618 -12.286 1.304 1034 HA ARG 126 HA ARG 126 -2.214 -12.089 3.641 1035 1HB ARG 126 HB2 ARG 126 -2.085 -13.798 1.451 1036 2HB ARG 126 HB3 ARG 126 -1.701 -14.850 2.815 1037 1HG ARG 126 HG2 ARG 126 -3.869 -13.094 3.540 1038 2HG ARG 126 HG3 ARG 126 -4.259 -13.919 2.029 1039 1HD ARG 126 HD2 ARG 126 -3.360 -16.047 3.279 1040 2HD ARG 126 HD3 ARG 126 -3.681 -15.098 4.732 1041 HE ARG 126 HE ARG 126 -6.051 -15.027 4.078 1042 1HH1 ARG 126 HH11 ARG 126 -5.255 -15.656 1.118 1043 2HH1 ARG 126 HH12 ARG 126 -5.956 -17.231 0.955 1044 1HH2 ARG 126 HH21 ARG 126 -6.402 -17.674 4.366 1045 2HH2 ARG 126 HH22 ARG 126 -6.605 -18.374 2.796 1046 H LYS 127 H LYS 127 0.940 -13.563 3.100 1047 HA LYS 127 HA LYS 127 1.107 -15.031 5.546 1048 1HB LYS 127 HB2 LYS 127 2.701 -15.377 3.708 1049 2HB LYS 127 HB3 LYS 127 3.315 -13.737 3.918 1050 1HG LYS 127 HG2 LYS 127 4.844 -15.148 5.089 1051 2HG LYS 127 HG3 LYS 127 3.844 -14.395 6.332 1052 1HD LYS 127 HD2 LYS 127 2.456 -16.718 5.535 1053 2HD LYS 127 HD3 LYS 127 4.145 -17.199 5.703 1054 1HE LYS 127 HE2 LYS 127 3.575 -15.492 7.891 1055 2HE LYS 127 HE3 LYS 127 2.230 -16.626 7.774 1056 1HZ LYS 127 HZ1 LYS 127 4.873 -17.767 7.430 1057 2HZ LYS 127 HZ2 LYS 127 4.531 -17.186 8.986 1058 3HZ LYS 127 HZ3 LYS 127 3.531 -18.366 8.281 1059 H SER 128 H SER 128 2.397 -11.805 4.728 1060 HA SER 128 HA SER 128 3.282 -11.142 7.345 1061 1HB SER 128 HB2 SER 128 3.521 -8.943 6.553 1062 2HB SER 128 HB3 SER 128 3.629 -9.893 5.075 1063 HG SER 128 HG SER 128 1.597 -9.313 4.547 1064 H GLU 129 H GLU 129 0.094 -11.110 5.901 1065 HA GLU 129 HA GLU 129 -1.162 -9.452 7.906 1066 1HB GLU 129 HB2 GLU 129 -2.145 -9.931 5.650 1067 2HB GLU 129 HB3 GLU 129 -2.431 -11.592 6.170 1068 1HG GLU 129 HG2 GLU 129 -3.712 -10.580 8.153 1069 2HG GLU 129 HG3 GLU 129 -3.668 -9.059 7.259 1070 H ALA 130 H ALA 130 -0.557 -12.921 7.582 1071 HA ALA 130 HA ALA 130 -2.165 -13.711 9.841 1072 1HB ALA 130 HB1 ALA 130 0.238 -15.068 8.583 1073 2HB ALA 130 HB2 ALA 130 -0.873 -15.823 9.727 1074 3HB ALA 130 HB3 ALA 130 -1.446 -15.331 8.132 1075 H GLN 131 H GLN 131 1.197 -12.705 9.451 1076 HA GLN 131 HA GLN 131 1.995 -13.349 12.151 1077 1HB GLN 131 HB2 GLN 131 3.593 -12.984 10.255 1078 2HB GLN 131 HB3 GLN 131 3.179 -11.270 10.287 1079 1HG GLN 131 HG2 GLN 131 3.745 -11.807 12.940 1080 2HG GLN 131 HG3 GLN 131 4.923 -12.800 12.081 1081 1HE2 GLN 131 HE21 GLN 131 6.598 -11.233 12.892 1082 2HE2 GLN 131 HE22 GLN 131 6.806 -9.753 12.088 1083 H ALA 132 H ALA 132 0.713 -10.430 10.585 1084 HA ALA 132 HA ALA 132 0.988 -8.755 12.925 1085 1HB ALA 132 HB1 ALA 132 0.455 -8.235 10.325 1086 2HB ALA 132 HB2 ALA 132 -1.183 -8.176 10.976 1087 3HB ALA 132 HB3 ALA 132 0.063 -7.108 11.623 1088 H LYS 133 H LYS 133 -1.313 -11.146 11.910 1089 HA LYS 133 HA LYS 133 -3.471 -10.210 13.640 1090 1HB LYS 133 HB2 LYS 133 -2.997 -12.474 11.794 1091 2HB LYS 133 HB3 LYS 133 -4.050 -12.836 13.162 1092 1HG LYS 133 HG2 LYS 133 -5.697 -11.404 12.453 1093 2HG LYS 133 HG3 LYS 133 -4.545 -10.264 11.753 1094 1HD LYS 133 HD2 LYS 133 -5.751 -11.305 9.933 1095 2HD LYS 133 HD3 LYS 133 -4.107 -11.944 9.928 1096 1HE LYS 133 HE2 LYS 133 -4.945 -14.023 10.096 1097 2HE LYS 133 HE3 LYS 133 -5.621 -13.596 11.668 1098 1HZ LYS 133 HZ1 LYS 133 -7.186 -12.494 9.584 1099 2HZ LYS 133 HZ2 LYS 133 -7.009 -14.164 9.348 1100 3HZ LYS 133 HZ3 LYS 133 -7.646 -13.577 10.809 1101 H LYS 134 H LYS 134 -0.999 -12.781 13.803 1102 HA LYS 134 HA LYS 134 -1.859 -13.738 16.391 1103 1HB LYS 134 HB2 LYS 134 0.286 -14.949 16.415 1104 2HB LYS 134 HB3 LYS 134 -0.506 -15.124 14.850 1105 1HG LYS 134 HG2 LYS 134 0.968 -13.621 13.795 1106 2HG LYS 134 HG3 LYS 134 1.489 -12.916 15.325 1107 1HD LYS 134 HD2 LYS 134 3.279 -14.333 14.597 1108 2HD LYS 134 HD3 LYS 134 2.466 -15.194 15.904 1109 1HE LYS 134 HE2 LYS 134 1.388 -15.690 13.189 1110 2HE LYS 134 HE3 LYS 134 3.010 -16.314 13.489 1111 1HZ LYS 134 HZ1 LYS 134 0.640 -16.819 15.206 1112 2HZ LYS 134 HZ2 LYS 134 1.284 -17.916 14.078 1113 3HZ LYS 134 HZ3 LYS 134 2.196 -17.455 15.436 1114 H GLU 135 H GLU 135 0.358 -11.239 15.299 1115 HA GLU 135 HA GLU 135 1.530 -10.811 17.934 1116 1HB GLU 135 HB2 GLU 135 1.511 -9.072 15.446 1117 2HB GLU 135 HB3 GLU 135 2.472 -8.753 16.891 1118 1HG GLU 135 HG2 GLU 135 2.706 -11.469 15.689 1119 2HG GLU 135 HG3 GLU 135 3.451 -10.137 14.807 1120 H LYS 136 H LYS 136 -1.378 -9.897 16.361 1121 HA LYS 136 HA LYS 136 -3.109 -8.449 16.990 1122 1HB LYS 136 HB2 LYS 136 -1.798 -8.898 19.688 1123 2HB LYS 136 HB3 LYS 136 -3.378 -8.148 19.459 1124 1HG LYS 136 HG2 LYS 136 -4.336 -10.179 19.342 1125 2HG LYS 136 HG3 LYS 136 -3.321 -10.582 17.957 1126 1HD LYS 136 HD2 LYS 136 -1.473 -11.131 19.613 1127 2HD LYS 136 HD3 LYS 136 -2.686 -10.994 20.886 1128 1HE LYS 136 HE2 LYS 136 -3.825 -12.623 18.870 1129 2HE LYS 136 HE3 LYS 136 -2.181 -13.211 19.118 1130 1HZ LYS 136 HZ1 LYS 136 -3.090 -12.727 21.634 1131 2HZ LYS 136 HZ2 LYS 136 -4.452 -13.369 20.853 1132 3HZ LYS 136 HZ3 LYS 136 -3.000 -14.249 20.887 1133 H LEU 137 H LEU 137 -1.415 -6.940 15.739 1134 HA LEU 137 HA LEU 137 -0.498 -4.778 17.572 1135 1HB LEU 137 HB2 LEU 137 0.811 -6.006 15.501 1136 2HB LEU 137 HB3 LEU 137 0.167 -4.567 14.709 1137 HG LEU 137 HG LEU 137 1.936 -4.682 17.163 1138 1HD1 LEU 137 HD11 LEU 137 2.521 -4.531 14.446 1139 2HD1 LEU 137 HD12 LEU 137 2.601 -2.853 14.983 1140 3HD1 LEU 137 HD13 LEU 137 3.602 -4.077 15.762 1141 1HD2 LEU 137 HD21 LEU 137 0.015 -2.633 16.231 1142 2HD2 LEU 137 HD22 LEU 137 0.714 -2.873 17.832 1143 3HD2 LEU 137 HD23 LEU 137 1.633 -2.026 16.587 1144 H ASN 138 H ASN 138 -1.997 -3.200 17.835 1145 HA ASN 138 HA ASN 138 -3.509 -1.502 17.287 1146 1HB ASN 138 HB2 ASN 138 -2.666 -2.071 14.431 1147 2HB ASN 138 HB3 ASN 138 -3.437 -0.601 15.030 1148 1HD2 ASN 138 HD21 ASN 138 -0.595 -1.257 13.874 1149 2HD2 ASN 138 HD22 ASN 138 0.448 -0.502 14.979 1150 H ILE 139 H ILE 139 -4.639 -2.108 14.255 1151 HA ILE 139 HA ILE 139 -7.233 -2.705 14.793 1152 HB ILE 139 HB ILE 139 -5.609 -4.010 12.591 1153 1HG1 ILE 139 HG12 ILE 139 -7.284 -1.711 11.920 1154 2HG1 ILE 139 HG13 ILE 139 -6.037 -1.303 13.098 1155 1HG2 ILE 139 HG21 ILE 139 -8.548 -3.740 13.141 1156 2HG2 ILE 139 HG22 ILE 139 -7.977 -3.741 11.472 1157 3HG2 ILE 139 HG23 ILE 139 -7.654 -5.126 12.516 1158 1HD1 ILE 139 HD11 ILE 139 -4.382 -2.501 11.575 1159 2HD1 ILE 139 HD12 ILE 139 -5.659 -2.532 10.360 1160 3HD1 ILE 139 HD13 ILE 139 -5.037 -0.990 10.945 1161 H TRP 140 H TRP 140 -4.594 -5.061 14.884 1162 HA TRP 140 HA TRP 140 -6.467 -7.264 15.415 1163 1HB TRP 140 HB2 TRP 140 -3.445 -7.289 15.590 1164 2HB TRP 140 HB3 TRP 140 -4.518 -8.677 15.402 1165 HD1 TRP 140 HD1 TRP 140 -2.685 -6.069 13.460 1166 HE1 TRP 140 HE1 TRP 140 -3.221 -6.299 10.949 1167 HE3 TRP 140 HE3 TRP 140 -6.584 -9.357 13.688 1168 HZ2 TRP 140 HZ2 TRP 140 -5.059 -7.694 9.261 1169 HZ3 TRP 140 HZ3 TRP 140 -7.708 -10.119 11.615 1170 HH2 TRP 140 HH2 TRP 140 -6.952 -9.293 9.404 1171 H SER 141 H SER 141 -6.772 -5.277 17.338 1172 HA SER 141 HA SER 141 -5.280 -6.250 19.723 1173 1HB SER 141 HB2 SER 141 -5.932 -4.238 20.803 1174 2HB SER 141 HB3 SER 141 -5.554 -3.749 19.152 1175 HG SER 141 HG SER 141 -7.991 -4.358 18.944 1176 H GLU 142 H GLU 142 -7.524 -7.695 18.304 1177 HA GLU 142 HA GLU 142 -9.871 -7.533 19.977 1178 1HB GLU 142 HB2 GLU 142 -8.999 -9.932 18.354 1179 2HB GLU 142 HB3 GLU 142 -10.642 -9.459 18.786 1180 1HG GLU 142 HG2 GLU 142 -9.331 -7.282 17.421 1181 2HG GLU 142 HG3 GLU 142 -9.216 -8.750 16.450 1182 H ASP 143 H ASP 143 -10.572 -9.803 21.036 1183 HA ASP 143 HA ASP 143 -8.366 -10.488 22.927 1184 1HB ASP 143 HB2 ASP 143 -10.488 -9.531 23.874 1185 2HB ASP 143 HB3 ASP 143 -11.348 -10.940 23.252 1186 H ASN 144 H ASN 144 -7.667 -11.916 20.989 1187 HA ASN 144 HA ASN 144 -9.242 -14.235 20.322 1188 1HB ASN 144 HB2 ASN 144 -6.696 -13.126 19.585 1189 2HB ASN 144 HB3 ASN 144 -6.482 -14.831 19.984 1190 1HD2 ASN 144 HD21 ASN 144 -6.760 -16.139 18.179 1191 2HD2 ASN 144 HD22 ASN 144 -7.842 -15.836 16.907 1192 H ALA 145 H ALA 145 -9.895 -15.194 22.310 1193 HA ALA 145 HA ALA 145 -7.675 -16.393 23.916 1194 1HB ALA 145 HB1 ALA 145 -10.480 -15.552 24.667 1195 2HB ALA 145 HB2 ALA 145 -9.530 -16.639 25.680 1196 3HB ALA 145 HB3 ALA 145 -8.955 -15.002 25.362 1197 H ASP 146 H ASP 146 -11.095 -17.094 23.094 1198 HA ASP 146 HA ASP 146 -10.693 -19.952 23.390 1199 1HB ASP 146 HB2 ASP 146 -12.969 -18.718 21.849 1200 2HB ASP 146 HB3 ASP 146 -12.975 -20.162 22.862 1201 H SER 147 H SER 147 -10.876 -17.719 20.628 1202 HA SER 147 HA SER 147 -10.170 -18.005 18.410 1203 1HB SER 147 HB2 SER 147 -8.352 -19.441 19.987 1204 2HB SER 147 HB3 SER 147 -8.821 -20.561 18.712 1205 HG SER 147 HG SER 147 -8.318 -18.907 17.205 1206 H GLY 148 H GLY 148 -10.785 -19.215 16.522 1207 1HA GLY 148 HA2 GLY 148 -11.834 -21.822 16.448 1208 2HA GLY 148 HA3 GLY 148 -13.193 -20.761 16.827 1209 H GLN 149 H GLN 149 -12.116 -22.317 14.301 1210 HA GLN 149 HA GLN 149 -11.776 -20.202 12.329 1211 1HB GLN 149 HB2 GLN 149 -11.745 -23.130 12.379 1212 2HB GLN 149 HB3 GLN 149 -12.523 -22.482 10.934 1213 1HG GLN 149 HG2 GLN 149 -10.569 -21.091 10.463 1214 2HG GLN 149 HG3 GLN 149 -9.796 -21.633 11.953 1215 1HE2 GLN 149 HE21 GLN 149 -9.470 -24.119 12.088 1216 2HE2 GLN 149 HE22 GLN 149 -9.075 -24.924 10.647 1217 HN3 PTP 150 H3 PTP 150 -10.219 -4.212 -8.703 1218 1H5M PTP 150 H51 PTP 150 -7.455 -2.255 -4.956 1219 2H5M PTP 150 H52 PTP 150 -7.195 -0.768 -5.899 1220 3H5M PTP 150 H53 PTP 150 -6.562 -2.321 -6.495 1221 H6 PTP 150 H6 PTP 150 -9.545 -0.293 -6.004 1222 H1* PTP 150 H1' PTP 150 -12.512 -0.375 -8.104 1223 2H2* PTP 150 H2' PTP 150 -12.447 -1.340 -5.258 1224 H3* PTP 150 H3' PTP 150 -13.186 0.738 -4.375 1225 H4* PTP 150 H4' PTP 150 -12.060 2.565 -6.065 1226 2H5* PTP 150 H5' PTP 150 -10.732 0.471 -4.246 Start of MODEL 2 1 1H ALA 1 H1 ALA 1 6.132 -17.239 -22.125 2 2H ALA 1 H2 ALA 1 4.561 -17.628 -22.640 3 3H ALA 1 H3 ALA 1 5.048 -16.005 -22.557 4 HA ALA 1 HA ALA 1 4.885 -15.897 -20.294 5 1HB ALA 1 HB1 ALA 1 2.687 -16.625 -21.523 6 2HB ALA 1 HB2 ALA 1 2.937 -18.158 -20.687 7 3HB ALA 1 HB3 ALA 1 2.738 -16.671 -19.760 8 H THR 2 H THR 2 5.773 -19.032 -21.482 9 HA THR 2 HA THR 2 6.333 -19.946 -18.693 10 HB THR 2 HB THR 2 6.592 -22.204 -19.751 11 HG1 THR 2 HG1 THR 2 6.428 -22.409 -21.848 12 1HG2 THR 2 HG21 THR 2 4.231 -20.700 -19.289 13 2HG2 THR 2 HG22 THR 2 3.956 -21.650 -20.748 14 3HG2 THR 2 HG23 THR 2 4.417 -22.453 -19.247 15 H SER 3 H SER 3 7.828 -18.605 -21.406 16 HA SER 3 HA SER 3 10.439 -19.907 -20.829 17 1HB SER 3 HB2 SER 3 9.343 -19.301 -23.216 18 2HB SER 3 HB3 SER 3 10.201 -17.792 -22.912 19 HG SER 3 HG SER 3 11.385 -19.575 -23.994 20 H THR 4 H THR 4 8.715 -17.381 -19.627 21 HA THR 4 HA THR 4 11.057 -16.153 -18.438 22 HB THR 4 HB THR 4 9.434 -14.327 -20.213 23 HG1 THR 4 HG1 THR 4 10.532 -14.997 -21.853 24 1HG2 THR 4 HG21 THR 4 11.779 -14.133 -18.429 25 2HG2 THR 4 HG22 THR 4 11.954 -13.306 -19.976 26 3HG2 THR 4 HG23 THR 4 10.618 -12.893 -18.902 27 H LYS 5 H LYS 5 10.439 -15.311 -16.485 28 HA LYS 5 HA LYS 5 7.674 -14.320 -16.131 29 1HB LYS 5 HB2 LYS 5 7.271 -15.764 -14.184 30 2HB LYS 5 HB3 LYS 5 7.562 -16.747 -15.620 31 1HG LYS 5 HG2 LYS 5 10.104 -16.248 -14.490 32 2HG LYS 5 HG3 LYS 5 9.048 -16.684 -13.146 33 1HD LYS 5 HD2 LYS 5 8.274 -18.528 -14.987 34 2HD LYS 5 HD3 LYS 5 9.969 -18.327 -15.432 35 1HE LYS 5 HE2 LYS 5 8.985 -18.900 -12.622 36 2HE LYS 5 HE3 LYS 5 9.639 -20.113 -13.721 37 1HZ LYS 5 HZ1 LYS 5 11.621 -18.495 -13.869 38 2HZ LYS 5 HZ2 LYS 5 11.013 -17.861 -12.414 39 3HZ LYS 5 HZ3 LYS 5 11.476 -19.493 -12.505 40 H LYS 6 H LYS 6 8.654 -12.272 -15.728 41 HA LYS 6 HA LYS 6 9.574 -11.905 -12.985 42 1HB LYS 6 HB2 LYS 6 11.621 -12.623 -14.431 43 2HB LYS 6 HB3 LYS 6 11.505 -11.001 -15.112 44 1HG LYS 6 HG2 LYS 6 12.996 -10.738 -13.300 45 2HG LYS 6 HG3 LYS 6 11.449 -10.191 -12.652 46 1HD LYS 6 HD2 LYS 6 11.857 -11.666 -10.976 47 2HD LYS 6 HD3 LYS 6 11.350 -12.889 -12.141 48 1HE LYS 6 HE2 LYS 6 13.478 -13.641 -12.481 49 2HE LYS 6 HE3 LYS 6 14.176 -12.026 -12.353 50 1HZ LYS 6 HZ1 LYS 6 13.088 -12.776 -9.869 51 2HZ LYS 6 HZ2 LYS 6 14.117 -14.015 -10.412 52 3HZ LYS 6 HZ3 LYS 6 14.702 -12.427 -10.256 53 H LEU 7 H LEU 7 8.266 -10.195 -12.515 54 HA LEU 7 HA LEU 7 7.254 -8.327 -14.407 55 1HB LEU 7 HB2 LEU 7 7.606 -8.169 -11.403 56 2HB LEU 7 HB3 LEU 7 6.810 -6.902 -12.337 57 HG LEU 7 HG LEU 7 5.969 -9.801 -12.503 58 1HD1 LEU 7 HD11 LEU 7 5.318 -7.691 -10.490 59 2HD1 LEU 7 HD12 LEU 7 4.006 -8.733 -11.043 60 3HD1 LEU 7 HD13 LEU 7 5.434 -9.439 -10.285 61 1HD2 LEU 7 HD21 LEU 7 5.354 -8.062 -14.289 62 2HD2 LEU 7 HD22 LEU 7 4.008 -8.928 -13.546 63 3HD2 LEU 7 HD23 LEU 7 4.384 -7.281 -13.041 64 H HIS 8 H HIS 8 7.746 -5.830 -14.003 65 HA HIS 8 HA HIS 8 10.717 -5.515 -14.009 66 1HB HIS 8 HB2 HIS 8 9.908 -3.387 -15.460 67 2HB HIS 8 HB3 HIS 8 10.311 -4.935 -16.188 68 HD1 HIS 8 HD1 HIS 8 7.133 -3.851 -14.361 69 HD2 HIS 8 HD2 HIS 8 8.348 -5.284 -18.074 70 HE1 HIS 8 HE1 HIS 8 5.021 -4.206 -15.712 71 H LYS 9 H LYS 9 11.520 -3.988 -12.623 72 HA LYS 9 HA LYS 9 9.521 -2.396 -11.082 73 1HB LYS 9 HB2 LYS 9 12.421 -2.913 -10.372 74 2HB LYS 9 HB3 LYS 9 11.155 -2.285 -9.317 75 1HG LYS 9 HG2 LYS 9 9.925 -4.434 -9.553 76 2HG LYS 9 HG3 LYS 9 11.248 -5.061 -10.538 77 1HD LYS 9 HD2 LYS 9 12.215 -5.740 -8.616 78 2HD LYS 9 HD3 LYS 9 12.508 -4.036 -8.264 79 1HE LYS 9 HE2 LYS 9 10.373 -3.866 -7.098 80 2HE LYS 9 HE3 LYS 9 9.972 -5.528 -7.531 81 1HZ LYS 9 HZ1 LYS 9 12.427 -5.714 -6.365 82 2HZ LYS 9 HZ2 LYS 9 11.631 -4.551 -5.416 83 3HZ LYS 9 HZ3 LYS 9 10.946 -6.092 -5.631 84 H GLU 10 H GLU 10 9.538 -0.192 -11.259 85 HA GLU 10 HA GLU 10 11.818 1.031 -12.762 86 1HB GLU 10 HB2 GLU 10 8.857 1.544 -12.817 87 2HB GLU 10 HB3 GLU 10 9.972 2.857 -13.198 88 1HG GLU 10 HG2 GLU 10 9.690 1.939 -15.308 89 2HG GLU 10 HG3 GLU 10 11.087 1.017 -14.749 90 HA PRO 11 HA PRO 11 12.477 3.646 -9.279 91 1HB PRO 11 HB2 PRO 11 13.593 5.799 -10.537 92 2HB PRO 11 HB3 PRO 11 14.434 4.253 -10.342 93 1HG PRO 11 HG2 PRO 11 13.166 5.416 -12.775 94 2HG PRO 11 HG3 PRO 11 14.551 4.320 -12.643 95 1HD PRO 11 HD2 PRO 11 11.930 3.568 -13.337 96 2HD PRO 11 HD3 PRO 11 13.224 2.465 -12.826 97 H ALA 12 H ALA 12 11.946 5.897 -8.443 98 HA ALA 12 HA ALA 12 9.910 7.424 -9.894 99 1HB ALA 12 HB1 ALA 12 9.049 5.305 -8.258 100 2HB ALA 12 HB2 ALA 12 8.788 6.763 -7.301 101 3HB ALA 12 HB3 ALA 12 8.056 6.614 -8.899 102 H THR 13 H THR 13 9.127 9.286 -8.406 103 HA THR 13 HA THR 13 11.367 10.030 -6.560 104 HB THR 13 HB THR 13 9.756 11.866 -8.356 105 HG1 THR 13 HG1 THR 13 11.396 11.743 -9.687 106 1HG2 THR 13 HG21 THR 13 11.735 12.292 -6.163 107 2HG2 THR 13 HG22 THR 13 11.818 13.360 -7.566 108 3HG2 THR 13 HG23 THR 13 10.334 13.263 -6.617 109 H LEU 14 H LEU 14 10.779 10.823 -4.565 110 HA LEU 14 HA LEU 14 8.013 10.476 -3.728 111 1HB LEU 14 HB2 LEU 14 10.048 10.047 -2.275 112 2HB LEU 14 HB3 LEU 14 10.267 11.795 -2.188 113 HG LEU 14 HG LEU 14 8.966 10.760 -0.262 114 1HD1 LEU 14 HD11 LEU 14 8.829 13.200 -1.241 115 2HD1 LEU 14 HD12 LEU 14 7.215 12.696 -1.746 116 3HD1 LEU 14 HD13 LEU 14 7.652 12.672 -0.038 117 1HD2 LEU 14 HD21 LEU 14 7.698 9.189 -1.809 118 2HD2 LEU 14 HD22 LEU 14 6.696 10.064 -0.650 119 3HD2 LEU 14 HD23 LEU 14 6.760 10.588 -2.334 120 H ILE 15 H ILE 15 6.535 11.991 -4.358 121 HA ILE 15 HA ILE 15 7.392 14.837 -4.499 122 HB ILE 15 HB ILE 15 4.907 13.436 -5.525 123 1HG1 ILE 15 HG12 ILE 15 7.199 14.747 -7.017 124 2HG1 ILE 15 HG13 ILE 15 7.086 13.012 -6.722 125 1HG2 ILE 15 HG21 ILE 15 5.276 16.156 -4.850 126 2HG2 ILE 15 HG22 ILE 15 5.398 16.069 -6.608 127 3HG2 ILE 15 HG23 ILE 15 3.957 15.461 -5.793 128 1HD1 ILE 15 HD11 ILE 15 4.620 13.469 -7.749 129 2HD1 ILE 15 HD12 ILE 15 5.539 14.715 -8.594 130 3HD1 ILE 15 HD13 ILE 15 6.010 13.022 -8.739 131 H LYS 16 H LYS 16 4.338 13.213 -3.546 132 HA LYS 16 HA LYS 16 4.447 14.529 -0.916 133 1HB LYS 16 HB2 LYS 16 3.499 16.226 -2.564 134 2HB LYS 16 HB3 LYS 16 2.122 15.139 -2.754 135 1HG LYS 16 HG2 LYS 16 1.414 15.436 -0.544 136 2HG LYS 16 HG3 LYS 16 3.006 15.967 -0.001 137 1HD LYS 16 HD2 LYS 16 2.642 17.977 -1.606 138 2HD LYS 16 HD3 LYS 16 0.941 17.511 -1.561 139 1HE LYS 16 HE2 LYS 16 1.522 17.436 1.088 140 2HE LYS 16 HE3 LYS 16 2.628 18.706 0.564 141 1HZ LYS 16 HZ1 LYS 16 -0.081 18.833 -0.485 142 2HZ LYS 16 HZ2 LYS 16 0.094 19.160 1.173 143 3HZ LYS 16 HZ3 LYS 16 0.944 20.083 0.032 144 H ALA 17 H ALA 17 3.746 12.983 0.463 145 HA ALA 17 HA ALA 17 2.233 10.684 -0.484 146 1HB ALA 17 HB1 ALA 17 3.902 11.177 1.671 147 2HB ALA 17 HB2 ALA 17 2.309 11.086 2.421 148 3HB ALA 17 HB3 ALA 17 2.909 9.735 1.460 149 H ILE 18 H ILE 18 0.079 10.113 0.218 150 HA ILE 18 HA ILE 18 -1.544 12.471 1.093 151 HB ILE 18 HB ILE 18 -2.371 10.201 -0.743 152 1HG1 ILE 18 HG12 ILE 18 -1.825 13.133 -1.314 153 2HG1 ILE 18 HG13 ILE 18 -0.786 11.790 -1.792 154 1HG2 ILE 18 HG21 ILE 18 -3.940 11.828 0.894 155 2HG2 ILE 18 HG22 ILE 18 -4.015 12.611 -0.685 156 3HG2 ILE 18 HG23 ILE 18 -4.498 10.923 -0.514 157 1HD1 ILE 18 HD11 ILE 18 -3.573 11.399 -2.599 158 2HD1 ILE 18 HD12 ILE 18 -2.855 12.845 -3.310 159 3HD1 ILE 18 HD13 ILE 18 -2.099 11.272 -3.559 160 H ASP 19 H ASP 19 -1.940 8.912 0.839 161 HA ASP 19 HA ASP 19 -2.917 8.971 3.668 162 1HB ASP 19 HB2 ASP 19 -3.837 7.111 1.454 163 2HB ASP 19 HB3 ASP 19 -4.463 7.167 3.103 164 H GLY 20 H GLY 20 -3.062 6.195 4.029 165 1HA GLY 20 HA2 GLY 20 -0.211 5.572 4.321 166 2HA GLY 20 HA3 GLY 20 -1.552 4.598 4.925 167 H ASP 21 H ASP 21 -2.778 4.806 2.118 168 HA ASP 21 HA ASP 21 -0.993 2.780 0.826 169 1HB ASP 21 HB2 ASP 21 -4.016 2.865 1.015 170 2HB ASP 21 HB3 ASP 21 -3.152 1.819 -0.112 171 H THR 22 H THR 22 -1.206 5.742 0.436 172 HA THR 22 HA THR 22 -1.448 5.658 -2.496 173 HB THR 22 HB THR 22 -3.083 7.651 -0.903 174 HG1 THR 22 HG1 THR 22 -3.918 5.529 -0.749 175 1HG2 THR 22 HG21 THR 22 -2.115 7.921 -3.406 176 2HG2 THR 22 HG22 THR 22 -3.590 7.024 -3.761 177 3HG2 THR 22 HG23 THR 22 -3.679 8.568 -2.914 178 H VAL 23 H VAL 23 0.085 6.988 -3.378 179 HA VAL 23 HA VAL 23 1.010 9.367 -1.906 180 HB VAL 23 HB VAL 23 3.348 8.680 -1.863 181 1HG1 VAL 23 HG11 VAL 23 1.899 8.056 0.058 182 2HG1 VAL 23 HG12 VAL 23 1.573 6.502 -0.714 183 3HG1 VAL 23 HG13 VAL 23 3.207 6.899 -0.183 184 1HG2 VAL 23 HG21 VAL 23 2.241 6.331 -3.375 185 2HG2 VAL 23 HG22 VAL 23 3.693 7.276 -3.697 186 3HG2 VAL 23 HG23 VAL 23 3.677 6.108 -2.376 187 H LYS 24 H LYS 24 1.998 10.875 -3.304 188 HA LYS 24 HA LYS 24 1.669 10.259 -6.187 189 1HB LYS 24 HB2 LYS 24 2.430 12.948 -5.061 190 2HB LYS 24 HB3 LYS 24 1.556 12.581 -6.548 191 1HG LYS 24 HG2 LYS 24 -0.235 11.547 -4.961 192 2HG LYS 24 HG3 LYS 24 0.559 12.502 -3.709 193 1HD LYS 24 HD2 LYS 24 0.037 13.990 -6.196 194 2HD LYS 24 HD3 LYS 24 -1.420 13.443 -5.366 195 1HE LYS 24 HE2 LYS 24 0.196 14.378 -3.304 196 2HE LYS 24 HE3 LYS 24 0.469 15.537 -4.604 197 1HZ LYS 24 HZ1 LYS 24 -2.283 14.820 -4.357 198 2HZ LYS 24 HZ2 LYS 24 -1.675 15.478 -2.913 199 3HZ LYS 24 HZ3 LYS 24 -1.566 16.357 -4.364 200 H LEU 25 H LEU 25 3.444 9.594 -7.275 201 HA LEU 25 HA LEU 25 6.092 10.722 -6.464 202 1HB LEU 25 HB2 LEU 25 5.955 7.983 -7.654 203 2HB LEU 25 HB3 LEU 25 7.118 8.649 -6.509 204 HG LEU 25 HG LEU 25 4.239 8.167 -5.731 205 1HD1 LEU 25 HD11 LEU 25 6.264 6.202 -6.353 206 2HD1 LEU 25 HD12 LEU 25 5.872 6.146 -4.634 207 3HD1 LEU 25 HD13 LEU 25 4.597 5.949 -5.836 208 1HD2 LEU 25 HD21 LEU 25 6.699 9.107 -4.458 209 2HD2 LEU 25 HD22 LEU 25 5.033 9.225 -3.891 210 3HD2 LEU 25 HD23 LEU 25 5.967 7.761 -3.584 211 H MET 26 H MET 26 7.597 10.972 -8.235 212 HA MET 26 HA MET 26 6.273 11.559 -10.777 213 1HB MET 26 HB2 MET 26 8.138 12.966 -9.861 214 2HB MET 26 HB3 MET 26 9.233 11.606 -10.115 215 1HG MET 26 HG2 MET 26 9.131 11.773 -12.428 216 2HG MET 26 HG3 MET 26 7.536 12.526 -12.405 217 1HE MET 26 HE1 MET 26 7.293 14.238 -13.361 218 2HE MET 26 HE2 MET 26 7.979 15.844 -13.077 219 3HE MET 26 HE3 MET 26 8.716 14.763 -14.256 220 H TYR 27 H TYR 27 6.418 10.340 -12.653 221 HA TYR 27 HA TYR 27 8.247 8.015 -12.726 222 1HB TYR 27 HB2 TYR 27 6.281 7.048 -11.692 223 2HB TYR 27 HB3 TYR 27 5.227 7.798 -12.890 224 HD1 TYR 27 HD1 TYR 27 7.954 5.301 -12.439 225 HD2 TYR 27 HD2 TYR 27 4.845 6.784 -15.006 226 HE1 TYR 27 HE1 TYR 27 8.246 3.339 -13.927 227 HE2 TYR 27 HE2 TYR 27 5.136 4.821 -16.493 228 HH TYR 27 HH TYR 27 7.483 2.255 -15.709 229 H LYS 28 H LYS 28 9.211 8.222 -14.676 230 HA LYS 28 HA LYS 28 9.478 8.513 -16.985 231 1HB LYS 28 HB2 LYS 28 6.611 7.818 -16.690 232 2HB LYS 28 HB3 LYS 28 7.046 8.651 -18.182 233 1HG LYS 28 HG2 LYS 28 7.205 6.112 -18.265 234 2HG LYS 28 HG3 LYS 28 8.664 6.976 -18.750 235 1HD LYS 28 HD2 LYS 28 9.631 6.654 -16.523 236 2HD LYS 28 HD3 LYS 28 8.155 5.856 -15.979 237 1HE LYS 28 HE2 LYS 28 8.625 3.914 -17.107 238 2HE LYS 28 HE3 LYS 28 9.424 4.757 -18.434 239 1HZ LYS 28 HZ1 LYS 28 10.676 4.789 -15.782 240 2HZ LYS 28 HZ2 LYS 28 10.792 3.375 -16.713 241 3HZ LYS 28 HZ3 LYS 28 11.398 4.842 -17.319 242 H GLY 29 H GLY 29 8.394 10.738 -14.926 243 1HA GLY 29 HA2 GLY 29 8.844 13.101 -15.359 244 2HA GLY 29 HA3 GLY 29 8.373 12.842 -17.038 245 H GLN 30 H GLN 30 6.089 11.132 -15.583 246 HA GLN 30 HA GLN 30 4.285 13.493 -15.345 247 1HB GLN 30 HB2 GLN 30 2.531 11.535 -15.602 248 2HB GLN 30 HB3 GLN 30 3.352 12.178 -17.022 249 1HG GLN 30 HG2 GLN 30 4.961 10.372 -16.986 250 2HG GLN 30 HG3 GLN 30 4.337 9.788 -15.443 251 1HE2 GLN 30 HE21 GLN 30 2.222 8.708 -15.448 252 2HE2 GLN 30 HE22 GLN 30 1.534 8.139 -16.892 253 HA PRO 31 HA PRO 31 3.924 12.448 -11.028 254 1HB PRO 31 HB2 PRO 31 1.920 14.215 -10.455 255 2HB PRO 31 HB3 PRO 31 3.602 14.718 -10.710 256 1HG PRO 31 HG2 PRO 31 1.262 14.948 -12.555 257 2HG PRO 31 HG3 PRO 31 2.652 16.029 -12.360 258 1HD PRO 31 HD2 PRO 31 2.360 14.168 -14.419 259 2HD PRO 31 HD3 PRO 31 3.904 14.884 -13.908 260 H MET 32 H MET 32 2.925 10.500 -10.550 261 HA MET 32 HA MET 32 -0.001 10.292 -11.142 262 1HB MET 32 HB2 MET 32 2.144 8.658 -12.104 263 2HB MET 32 HB3 MET 32 1.152 7.688 -11.014 264 1HG MET 32 HG2 MET 32 -0.868 8.313 -12.262 265 2HG MET 32 HG3 MET 32 0.093 9.335 -13.332 266 1HE MET 32 HE1 MET 32 -0.571 6.188 -11.767 267 2HE MET 32 HE2 MET 32 -0.632 4.995 -13.063 268 3HE MET 32 HE3 MET 32 0.873 5.256 -12.185 269 H THR 33 H THR 33 -1.226 9.061 -9.600 270 HA THR 33 HA THR 33 0.036 9.004 -6.909 271 HB THR 33 HB THR 33 -2.888 8.567 -7.544 272 HG1 THR 33 HG1 THR 33 -1.613 11.024 -6.950 273 1HG2 THR 33 HG21 THR 33 -1.660 8.161 -5.234 274 2HG2 THR 33 HG22 THR 33 -1.786 9.916 -5.110 275 3HG2 THR 33 HG23 THR 33 -3.243 8.937 -5.284 276 H PHE 34 H PHE 34 1.025 7.047 -6.584 277 HA PHE 34 HA PHE 34 -0.167 4.592 -7.702 278 1HB PHE 34 HB2 PHE 34 2.385 5.218 -6.218 279 2HB PHE 34 HB3 PHE 34 1.868 3.554 -6.492 280 HD1 PHE 34 HD1 PHE 34 1.572 2.697 -8.812 281 HD2 PHE 34 HD2 PHE 34 3.230 6.577 -8.014 282 HE1 PHE 34 HE1 PHE 34 2.456 2.794 -11.125 283 HE2 PHE 34 HE2 PHE 34 4.116 6.675 -10.329 284 HZ PHE 34 HZ PHE 34 3.726 4.781 -11.885 285 H ARG 35 H ARG 35 -1.347 3.138 -6.523 286 HA ARG 35 HA ARG 35 -1.624 3.687 -3.594 287 1HB ARG 35 HB2 ARG 35 -3.732 4.044 -4.729 288 2HB ARG 35 HB3 ARG 35 -3.588 2.506 -5.580 289 1HG ARG 35 HG2 ARG 35 -4.610 1.467 -3.869 290 2HG ARG 35 HG3 ARG 35 -3.310 1.978 -2.791 291 1HD ARG 35 HD2 ARG 35 -4.447 3.954 -2.165 292 2HD ARG 35 HD3 ARG 35 -5.549 3.857 -3.539 293 HE ARG 35 HE ARG 35 -5.978 1.536 -1.991 294 1HH1 ARG 35 HH11 ARG 35 -7.093 4.660 -2.488 295 2HH1 ARG 35 HH12 ARG 35 -8.005 4.758 -1.017 296 1HH2 ARG 35 HH21 ARG 35 -6.771 1.778 0.256 297 2HH2 ARG 35 HH22 ARG 35 -7.822 3.126 0.536 298 H LEU 36 H LEU 36 -1.395 1.945 -2.173 299 HA LEU 36 HA LEU 36 0.235 -0.246 -2.975 300 1HB LEU 36 HB2 LEU 36 -1.563 0.039 -0.550 301 2HB LEU 36 HB3 LEU 36 -0.311 -1.190 -0.741 302 HG LEU 36 HG LEU 36 0.066 1.810 -0.610 303 1HD1 LEU 36 HD11 LEU 36 0.066 -0.229 1.341 304 2HD1 LEU 36 HD12 LEU 36 1.760 0.177 1.070 305 3HD1 LEU 36 HD13 LEU 36 0.618 1.434 1.541 306 1HD2 LEU 36 HD21 LEU 36 2.036 -0.390 -1.308 307 2HD2 LEU 36 HD22 LEU 36 1.536 0.945 -2.346 308 3HD2 LEU 36 HD23 LEU 36 2.501 1.262 -0.905 309 H LEU 37 H LEU 37 -0.278 -2.201 -3.859 310 HA LEU 37 HA LEU 37 -3.115 -2.732 -4.485 311 1HB LEU 37 HB2 LEU 37 -0.495 -3.539 -5.561 312 2HB LEU 37 HB3 LEU 37 -1.705 -4.822 -5.550 313 HG LEU 37 HG LEU 37 -2.197 -2.051 -6.671 314 1HD1 LEU 37 HD11 LEU 37 -0.982 -4.493 -7.836 315 2HD1 LEU 37 HD12 LEU 37 -2.227 -3.717 -8.816 316 3HD1 LEU 37 HD13 LEU 37 -0.800 -2.806 -8.318 317 1HD2 LEU 37 HD21 LEU 37 -4.001 -3.931 -5.837 318 2HD2 LEU 37 HD22 LEU 37 -4.317 -2.764 -7.120 319 3HD2 LEU 37 HD23 LEU 37 -3.784 -4.396 -7.525 320 H LEU 38 H LEU 38 -4.161 -4.712 -3.945 321 HA LEU 38 HA LEU 38 -4.653 -6.590 -2.632 322 1HB LEU 38 HB2 LEU 38 -1.702 -6.627 -1.963 323 2HB LEU 38 HB3 LEU 38 -2.838 -7.973 -1.861 324 HG LEU 38 HG LEU 38 -2.068 -6.532 -4.415 325 1HD1 LEU 38 HD11 LEU 38 -1.312 -9.270 -3.349 326 2HD1 LEU 38 HD12 LEU 38 -0.923 -8.667 -4.960 327 3HD1 LEU 38 HD13 LEU 38 -0.224 -7.895 -3.536 328 1HD2 LEU 38 HD21 LEU 38 -4.405 -7.534 -4.239 329 2HD2 LEU 38 HD22 LEU 38 -3.405 -8.178 -5.542 330 3HD2 LEU 38 HD23 LEU 38 -3.626 -9.105 -4.058 331 H VAL 39 H VAL 39 -3.733 -3.670 -1.457 332 HA VAL 39 HA VAL 39 -4.321 -4.553 1.335 333 HB VAL 39 HB VAL 39 -2.676 -3.082 2.235 334 1HG1 VAL 39 HG11 VAL 39 -1.812 -5.208 1.234 335 2HG1 VAL 39 HG12 VAL 39 -1.446 -4.320 -0.246 336 3HG1 VAL 39 HG13 VAL 39 -0.610 -3.918 1.254 337 1HG2 VAL 39 HG21 VAL 39 -2.378 -2.032 -0.596 338 2HG2 VAL 39 HG22 VAL 39 -3.062 -1.162 0.776 339 3HG2 VAL 39 HG23 VAL 39 -1.346 -1.568 0.758 340 H ASP 40 H ASP 40 -5.274 -2.806 2.670 341 HA ASP 40 HA ASP 40 -6.387 -0.509 1.175 342 1HB ASP 40 HB2 ASP 40 -7.996 -2.463 0.955 343 2HB ASP 40 HB3 ASP 40 -8.203 -2.390 2.705 344 H THR 41 H THR 41 -6.655 1.260 2.513 345 HA THR 41 HA THR 41 -5.545 1.118 5.188 346 HB THR 41 HB THR 41 -5.652 3.437 5.173 347 HG1 THR 41 HG1 THR 41 -7.734 3.915 5.141 348 1HG2 THR 41 HG21 THR 41 -4.639 2.458 3.001 349 2HG2 THR 41 HG22 THR 41 -6.109 3.043 2.221 350 3HG2 THR 41 HG23 THR 41 -5.025 4.178 3.025 351 HA PRO 42 HA PRO 42 -9.186 0.458 7.571 352 1HB PRO 42 HB2 PRO 42 -8.662 2.005 9.763 353 2HB PRO 42 HB3 PRO 42 -7.797 0.497 9.416 354 1HG PRO 42 HG2 PRO 42 -6.892 3.322 9.048 355 2HG PRO 42 HG3 PRO 42 -5.951 1.886 9.488 356 1HD PRO 42 HD2 PRO 42 -6.029 3.013 6.939 357 2HD PRO 42 HD3 PRO 42 -5.543 1.341 7.294 358 H GLU 43 H GLU 43 -10.603 2.138 9.241 359 HA GLU 43 HA GLU 43 -12.367 3.536 7.635 360 1HB GLU 43 HB2 GLU 43 -11.612 3.658 10.486 361 2HB GLU 43 HB3 GLU 43 -12.359 5.132 9.869 362 1HG GLU 43 HG2 GLU 43 -14.354 4.111 10.109 363 2HG GLU 43 HG3 GLU 43 -13.886 3.054 8.776 364 H THR 44 H THR 44 -12.484 5.632 6.773 365 HA THR 44 HA THR 44 -10.305 7.542 7.309 366 HB THR 44 HB THR 44 -10.471 7.461 4.483 367 HG1 THR 44 HG1 THR 44 -11.128 5.398 4.419 368 1HG2 THR 44 HG21 THR 44 -8.554 8.026 6.101 369 2HG2 THR 44 HG22 THR 44 -8.252 6.289 6.158 370 3HG2 THR 44 HG23 THR 44 -8.124 7.156 4.628 371 H LYS 45 H LYS 45 -12.784 8.080 8.057 372 HA LYS 45 HA LYS 45 -14.041 9.636 5.838 373 1HB LYS 45 HB2 LYS 45 -15.141 8.522 8.426 374 2HB LYS 45 HB3 LYS 45 -16.019 9.712 7.465 375 1HG LYS 45 HG2 LYS 45 -16.812 8.005 6.227 376 2HG LYS 45 HG3 LYS 45 -15.171 7.769 5.621 377 1HD LYS 45 HD2 LYS 45 -14.758 5.994 7.026 378 2HD LYS 45 HD3 LYS 45 -15.806 6.623 8.299 379 1HE LYS 45 HE2 LYS 45 -17.717 5.710 7.370 380 2HE LYS 45 HE3 LYS 45 -17.080 5.785 5.728 381 1HZ LYS 45 HZ1 LYS 45 -15.999 3.957 7.794 382 2HZ LYS 45 HZ2 LYS 45 -17.239 3.508 6.727 383 3HZ LYS 45 HZ3 LYS 45 -15.708 3.926 6.120 384 H HIS 46 H HIS 46 -11.826 10.848 6.785 385 HA HIS 46 HA HIS 46 -11.796 12.393 9.067 386 1HB HIS 46 HB2 HIS 46 -10.426 12.427 6.658 387 2HB HIS 46 HB3 HIS 46 -11.174 14.023 6.717 388 HD1 HIS 46 HD1 HIS 46 -8.388 12.084 8.085 389 HD2 HIS 46 HD2 HIS 46 -10.541 15.462 9.236 390 HE1 HIS 46 HE1 HIS 46 -7.002 13.247 9.858 391 HA PRO 47 HA PRO 47 -15.730 14.558 8.386 392 1HB PRO 47 HB2 PRO 47 -16.153 15.029 11.041 393 2HB PRO 47 HB3 PRO 47 -16.533 13.481 10.268 394 1HG PRO 47 HG2 PRO 47 -14.238 14.192 12.041 395 2HG PRO 47 HG3 PRO 47 -15.090 12.648 11.866 396 1HD PRO 47 HD2 PRO 47 -12.612 13.255 10.717 397 2HD PRO 47 HD3 PRO 47 -13.685 11.936 10.203 398 H LYS 48 H LYS 48 -13.400 15.620 10.902 399 HA LYS 48 HA LYS 48 -12.838 18.121 9.576 400 1HB LYS 48 HB2 LYS 48 -15.266 18.173 10.842 401 2HB LYS 48 HB3 LYS 48 -14.197 18.734 12.128 402 1HG LYS 48 HG2 LYS 48 -13.460 19.991 9.637 403 2HG LYS 48 HG3 LYS 48 -15.179 20.238 9.943 404 1HD LYS 48 HD2 LYS 48 -14.315 20.764 12.401 405 2HD LYS 48 HD3 LYS 48 -12.821 21.146 11.544 406 1HE LYS 48 HE2 LYS 48 -14.244 23.150 11.778 407 2HE LYS 48 HE3 LYS 48 -14.048 22.705 10.082 408 1HZ LYS 48 HZ1 LYS 48 -16.270 21.386 11.297 409 2HZ LYS 48 HZ2 LYS 48 -16.414 23.076 11.393 410 3HZ LYS 48 HZ3 LYS 48 -16.213 22.323 9.884 411 H LYS 49 H LYS 49 -13.201 16.993 12.964 412 HA LYS 49 HA LYS 49 -10.359 17.791 13.403 413 1HB LYS 49 HB2 LYS 49 -10.993 17.616 15.848 414 2HB LYS 49 HB3 LYS 49 -11.859 18.867 14.957 415 1HG LYS 49 HG2 LYS 49 -13.864 17.762 15.076 416 2HG LYS 49 HG3 LYS 49 -13.109 16.170 14.980 417 1HD LYS 49 HD2 LYS 49 -12.203 16.662 17.348 418 2HD LYS 49 HD3 LYS 49 -13.393 17.965 17.392 419 1HE LYS 49 HE2 LYS 49 -14.488 15.411 16.432 420 2HE LYS 49 HE3 LYS 49 -13.895 15.345 18.092 421 1HZ LYS 49 HZ1 LYS 49 -15.206 17.692 18.046 422 2HZ LYS 49 HZ2 LYS 49 -16.161 16.755 16.998 423 3HZ LYS 49 HZ3 LYS 49 -15.871 16.228 18.588 424 H GLY 50 H GLY 50 -10.393 15.511 12.034 425 1HA GLY 50 HA2 GLY 50 -9.564 13.314 12.127 426 2HA GLY 50 HA3 GLY 50 -9.243 13.582 13.841 427 H VAL 51 H VAL 51 -10.176 11.122 13.178 428 HA VAL 51 HA VAL 51 -13.063 11.222 13.959 429 HB VAL 51 HB VAL 51 -12.847 10.248 11.754 430 1HG1 VAL 51 HG11 VAL 51 -10.696 8.566 13.064 431 2HG1 VAL 51 HG12 VAL 51 -11.407 8.166 11.500 432 3HG1 VAL 51 HG13 VAL 51 -10.516 9.674 11.703 433 1HG2 VAL 51 HG21 VAL 51 -14.104 9.032 13.826 434 2HG2 VAL 51 HG22 VAL 51 -14.153 8.412 12.176 435 3HG2 VAL 51 HG23 VAL 51 -13.010 7.738 13.337 436 H GLU 52 H GLU 52 -10.021 10.592 15.120 437 HA GLU 52 HA GLU 52 -9.274 9.504 17.060 438 1HB GLU 52 HB2 GLU 52 -12.217 9.736 17.437 439 2HB GLU 52 HB3 GLU 52 -11.378 8.577 18.468 440 1HG GLU 52 HG2 GLU 52 -10.869 10.346 19.783 441 2HG GLU 52 HG3 GLU 52 -9.708 10.786 18.532 442 H LYS 53 H LYS 53 -10.041 7.216 18.334 443 HA LYS 53 HA LYS 53 -10.125 4.880 18.125 444 1HB LYS 53 HB2 LYS 53 -12.220 5.394 16.820 445 2HB LYS 53 HB3 LYS 53 -11.237 5.409 15.355 446 1HG LYS 53 HG2 LYS 53 -12.396 3.198 15.888 447 2HG LYS 53 HG3 LYS 53 -10.658 3.103 15.601 448 1HD LYS 53 HD2 LYS 53 -10.181 2.925 17.928 449 2HD LYS 53 HD3 LYS 53 -11.813 3.421 18.377 450 1HE LYS 53 HE2 LYS 53 -12.093 1.166 16.682 451 2HE LYS 53 HE3 LYS 53 -10.826 0.770 17.842 452 1HZ LYS 53 HZ1 LYS 53 -13.227 2.084 18.860 453 2HZ LYS 53 HZ2 LYS 53 -13.369 0.458 18.396 454 3HZ LYS 53 HZ3 LYS 53 -12.242 0.906 19.587 455 H TYR 54 H TYR 54 -7.878 6.653 17.033 456 HA TYR 54 HA TYR 54 -5.784 6.227 16.069 457 1HB TYR 54 HB2 TYR 54 -5.292 4.180 16.931 458 2HB TYR 54 HB3 TYR 54 -6.919 3.573 16.655 459 HD1 TYR 54 HD1 TYR 54 -7.553 2.717 14.371 460 HD2 TYR 54 HD2 TYR 54 -3.508 3.708 15.419 461 HE1 TYR 54 HE1 TYR 54 -6.733 1.415 12.430 462 HE2 TYR 54 HE2 TYR 54 -2.685 2.404 13.478 463 HH TYR 54 HH TYR 54 -4.585 1.471 10.952 464 H GLY 55 H GLY 55 -8.603 6.359 14.527 465 1HA GLY 55 HA2 GLY 55 -8.513 5.236 12.019 466 2HA GLY 55 HA3 GLY 55 -9.046 6.899 12.269 467 HA PRO 56 HA PRO 56 -5.314 8.461 10.477 468 1HB PRO 56 HB2 PRO 56 -4.345 10.264 12.285 469 2HB PRO 56 HB3 PRO 56 -5.841 10.525 11.370 470 1HG PRO 56 HG2 PRO 56 -5.488 9.797 14.233 471 2HG PRO 56 HG3 PRO 56 -6.805 10.685 13.452 472 1HD PRO 56 HD2 PRO 56 -6.858 7.963 14.227 473 2HD PRO 56 HD3 PRO 56 -8.038 8.781 13.178 474 H GLU 57 H GLU 57 -3.431 7.309 10.188 475 HA GLU 57 HA GLU 57 -1.296 7.265 12.054 476 1HB GLU 57 HB2 GLU 57 -3.356 5.350 12.629 477 2HB GLU 57 HB3 GLU 57 -1.906 4.487 12.116 478 1HG GLU 57 HG2 GLU 57 -1.822 6.709 14.166 479 2HG GLU 57 HG3 GLU 57 -2.068 5.020 14.613 480 H ALA 58 H ALA 58 -2.773 4.835 9.865 481 HA ALA 58 HA ALA 58 -0.392 3.896 8.711 482 1HB ALA 58 HB1 ALA 58 -3.081 4.270 7.357 483 2HB ALA 58 HB2 ALA 58 -1.779 3.236 6.771 484 3HB ALA 58 HB3 ALA 58 -2.586 2.860 8.294 485 H SER 59 H SER 59 -2.248 6.805 7.917 486 HA SER 59 HA SER 59 -0.956 7.479 5.485 487 1HB SER 59 HB2 SER 59 -1.545 9.757 7.261 488 2HB SER 59 HB3 SER 59 -2.136 9.414 5.637 489 HG SER 59 HG SER 59 -3.828 8.476 6.470 490 H ALA 60 H ALA 60 -0.202 8.837 8.719 491 HA ALA 60 HA ALA 60 2.231 10.071 7.938 492 1HB ALA 60 HB1 ALA 60 0.883 9.399 10.451 493 2HB ALA 60 HB2 ALA 60 2.641 9.354 10.585 494 3HB ALA 60 HB3 ALA 60 1.836 10.824 10.036 495 H PHE 61 H PHE 61 1.500 6.737 8.699 496 HA PHE 61 HA PHE 61 4.100 5.794 9.321 497 1HB PHE 61 HB2 PHE 61 2.186 4.336 9.585 498 2HB PHE 61 HB3 PHE 61 1.819 4.435 7.863 499 HD1 PHE 61 HD1 PHE 61 4.279 3.191 10.353 500 HD2 PHE 61 HD2 PHE 61 2.990 3.096 6.256 501 HE1 PHE 61 HE1 PHE 61 5.799 1.280 9.919 502 HE2 PHE 61 HE2 PHE 61 4.510 1.185 5.822 503 HZ PHE 61 HZ PHE 61 5.916 0.278 7.654 504 H THR 62 H THR 62 2.491 5.531 6.148 505 HA THR 62 HA THR 62 4.920 4.936 4.743 506 HB THR 62 HB THR 62 2.289 6.053 3.724 507 HG1 THR 62 HG1 THR 62 2.032 4.042 4.629 508 1HG2 THR 62 HG21 THR 62 4.798 5.129 2.370 509 2HG2 THR 62 HG22 THR 62 3.243 4.822 1.596 510 3HG2 THR 62 HG23 THR 62 3.738 6.476 1.957 511 H LYS 63 H LYS 63 3.642 7.881 5.957 512 HA LYS 63 HA LYS 63 4.741 9.687 4.010 513 1HB LYS 63 HB2 LYS 63 3.010 10.274 5.756 514 2HB LYS 63 HB3 LYS 63 4.308 10.247 6.952 515 1HG LYS 63 HG2 LYS 63 5.362 12.122 6.053 516 2HG LYS 63 HG3 LYS 63 4.643 11.887 4.460 517 1HD LYS 63 HD2 LYS 63 2.380 12.313 5.732 518 2HD LYS 63 HD3 LYS 63 3.423 13.088 6.925 519 1HE LYS 63 HE2 LYS 63 2.991 13.835 4.037 520 2HE LYS 63 HE3 LYS 63 2.870 14.856 5.470 521 1HZ LYS 63 HZ1 LYS 63 5.329 14.381 5.762 522 2HZ LYS 63 HZ2 LYS 63 5.306 13.807 4.162 523 3HZ LYS 63 HZ3 LYS 63 4.897 15.422 4.495 524 H LYS 64 H LYS 64 5.934 8.930 7.292 525 HA LYS 64 HA LYS 64 8.501 10.151 6.829 526 1HB LYS 64 HB2 LYS 64 7.125 9.033 9.024 527 2HB LYS 64 HB3 LYS 64 8.610 8.096 8.857 528 1HG LYS 64 HG2 LYS 64 9.621 9.793 9.959 529 2HG LYS 64 HG3 LYS 64 9.473 10.696 8.451 530 1HD LYS 64 HD2 LYS 64 8.050 12.133 9.433 531 2HD LYS 64 HD3 LYS 64 6.958 10.803 9.820 532 1HE LYS 64 HE2 LYS 64 7.713 10.632 11.972 533 2HE LYS 64 HE3 LYS 64 9.373 11.025 11.528 534 1HZ LYS 64 HZ1 LYS 64 7.377 13.137 11.256 535 2HZ LYS 64 HZ2 LYS 64 7.836 12.706 12.834 536 3HZ LYS 64 HZ3 LYS 64 9.006 13.238 11.723 537 H MET 65 H MET 65 7.242 6.915 6.301 538 HA MET 65 HA MET 65 9.742 5.546 6.094 539 1HB MET 65 HB2 MET 65 7.274 4.637 6.113 540 2HB MET 65 HB3 MET 65 7.405 4.808 4.363 541 1HG MET 65 HG2 MET 65 8.590 2.901 4.251 542 2HG MET 65 HG3 MET 65 9.810 3.588 5.324 543 1HE MET 65 HE1 MET 65 8.104 0.687 4.730 544 2HE MET 65 HE2 MET 65 9.665 0.627 5.544 545 3HE MET 65 HE3 MET 65 8.259 -0.121 6.295 546 H VAL 66 H VAL 66 7.641 6.362 3.333 547 HA VAL 66 HA VAL 66 9.645 6.118 1.362 548 HB VAL 66 HB VAL 66 8.166 7.415 -0.088 549 1HG1 VAL 66 HG11 VAL 66 7.432 5.124 1.401 550 2HG1 VAL 66 HG12 VAL 66 5.998 6.147 1.335 551 3HG1 VAL 66 HG13 VAL 66 6.786 5.638 -0.158 552 1HG2 VAL 66 HG21 VAL 66 7.233 8.437 2.542 553 2HG2 VAL 66 HG22 VAL 66 7.336 9.262 0.987 554 3HG2 VAL 66 HG23 VAL 66 5.983 8.182 1.323 555 H GLU 67 H GLU 67 8.922 8.802 3.517 556 HA GLU 67 HA GLU 67 10.349 10.836 2.109 557 1HB GLU 67 HB2 GLU 67 9.316 10.440 4.846 558 2HB GLU 67 HB3 GLU 67 10.708 11.520 4.734 559 1HG GLU 67 HG2 GLU 67 9.043 12.220 2.575 560 2HG GLU 67 HG3 GLU 67 7.963 12.008 3.952 561 H ASN 68 H ASN 68 11.408 8.464 4.529 562 HA ASN 68 HA ASN 68 14.195 9.418 4.272 563 1HB ASN 68 HB2 ASN 68 12.718 7.585 6.106 564 2HB ASN 68 HB3 ASN 68 14.438 7.276 5.865 565 1HD2 ASN 68 HD21 ASN 68 12.131 9.825 6.875 566 2HD2 ASN 68 HD22 ASN 68 13.262 10.709 7.780 567 H ALA 69 H ALA 69 12.192 7.368 2.575 568 HA ALA 69 HA ALA 69 13.854 5.090 2.111 569 1HB ALA 69 HB1 ALA 69 11.767 6.441 0.380 570 2HB ALA 69 HB2 ALA 69 12.539 4.914 -0.044 571 3HB ALA 69 HB3 ALA 69 11.547 5.026 1.409 572 H LYS 70 H LYS 70 15.747 4.942 1.004 573 HA LYS 70 HA LYS 70 16.826 7.320 -0.320 574 1HB LYS 70 HB2 LYS 70 17.950 4.507 -0.122 575 2HB LYS 70 HB3 LYS 70 18.834 5.937 -0.654 576 1HG LYS 70 HG2 LYS 70 18.538 6.980 1.537 577 2HG LYS 70 HG3 LYS 70 17.562 5.613 2.080 578 1HD LYS 70 HD2 LYS 70 19.769 4.291 1.240 579 2HD LYS 70 HD3 LYS 70 20.504 5.817 1.734 580 1HE LYS 70 HE2 LYS 70 18.977 5.493 3.871 581 2HE LYS 70 HE3 LYS 70 19.034 3.797 3.389 582 1HZ LYS 70 HZ1 LYS 70 21.478 3.992 3.323 583 2HZ LYS 70 HZ2 LYS 70 21.351 5.569 3.943 584 3HZ LYS 70 HZ3 LYS 70 20.836 4.243 4.873 585 H LYS 71 H LYS 71 15.039 4.528 -1.253 586 HA LYS 71 HA LYS 71 15.242 5.380 -4.081 587 1HB LYS 71 HB2 LYS 71 16.054 2.677 -3.021 588 2HB LYS 71 HB3 LYS 71 15.465 2.862 -4.673 589 1HG LYS 71 HG2 LYS 71 17.201 4.613 -5.057 590 2HG LYS 71 HG3 LYS 71 17.830 4.302 -3.438 591 1HD LYS 71 HD2 LYS 71 18.510 2.105 -4.000 592 2HD LYS 71 HD3 LYS 71 17.520 2.082 -5.459 593 1HE LYS 71 HE2 LYS 71 19.115 4.246 -5.949 594 2HE LYS 71 HE3 LYS 71 20.214 3.218 -5.027 595 1HZ LYS 71 HZ1 LYS 71 19.300 1.388 -6.604 596 2HZ LYS 71 HZ2 LYS 71 18.909 2.700 -7.607 597 3HZ LYS 71 HZ3 LYS 71 20.522 2.440 -7.143 598 H ILE 72 H ILE 72 13.212 5.417 -4.908 599 HA ILE 72 HA ILE 72 11.166 3.614 -3.671 600 HB ILE 72 HB ILE 72 10.808 6.418 -4.776 601 1HG1 ILE 72 HG12 ILE 72 9.941 5.887 -2.044 602 2HG1 ILE 72 HG13 ILE 72 11.660 5.552 -2.254 603 1HG2 ILE 72 HG21 ILE 72 8.844 4.375 -3.710 604 2HG2 ILE 72 HG22 ILE 72 8.462 6.091 -3.854 605 3HG2 ILE 72 HG23 ILE 72 8.837 5.147 -5.295 606 1HD1 ILE 72 HD11 ILE 72 11.605 7.861 -3.562 607 2HD1 ILE 72 HD12 ILE 72 10.181 8.137 -2.559 608 3HD1 ILE 72 HD13 ILE 72 11.744 7.824 -1.804 609 H GLU 73 H GLU 73 10.753 2.035 -5.158 610 HA GLU 73 HA GLU 73 10.466 2.893 -8.013 611 1HB GLU 73 HB2 GLU 73 11.215 0.513 -8.555 612 2HB GLU 73 HB3 GLU 73 12.462 1.584 -7.915 613 1HG GLU 73 HG2 GLU 73 12.164 0.652 -5.675 614 2HG GLU 73 HG3 GLU 73 10.846 -0.368 -6.252 615 H VAL 74 H VAL 74 8.673 2.096 -9.103 616 HA VAL 74 HA VAL 74 6.699 0.615 -7.429 617 HB VAL 74 HB VAL 74 5.017 1.481 -9.003 618 1HG1 VAL 74 HG11 VAL 74 6.904 3.254 -7.550 619 2HG1 VAL 74 HG12 VAL 74 5.826 4.051 -8.695 620 3HG1 VAL 74 HG13 VAL 74 5.157 3.088 -7.377 621 1HG2 VAL 74 HG21 VAL 74 7.440 2.035 -10.566 622 2HG2 VAL 74 HG22 VAL 74 5.773 1.850 -11.111 623 3HG2 VAL 74 HG23 VAL 74 6.334 3.407 -10.500 624 H GLU 75 H GLU 75 6.064 -1.427 -8.048 625 HA GLU 75 HA GLU 75 7.233 -2.478 -10.589 626 1HB GLU 75 HB2 GLU 75 8.001 -3.734 -8.683 627 2HB GLU 75 HB3 GLU 75 6.364 -3.864 -8.040 628 1HG GLU 75 HG2 GLU 75 5.719 -5.444 -9.618 629 2HG GLU 75 HG3 GLU 75 6.929 -4.918 -10.789 630 H PHE 76 H PHE 76 5.648 -2.130 -12.124 631 HA PHE 76 HA PHE 76 2.831 -2.263 -11.615 632 1HB PHE 76 HB2 PHE 76 4.433 -2.528 -14.173 633 2HB PHE 76 HB3 PHE 76 2.671 -2.460 -14.132 634 HD1 PHE 76 HD1 PHE 76 1.613 -0.454 -12.833 635 HD2 PHE 76 HD2 PHE 76 5.672 -0.538 -14.239 636 HE1 PHE 76 HE1 PHE 76 1.711 2.021 -12.700 637 HE2 PHE 76 HE2 PHE 76 5.769 1.936 -14.106 638 HZ PHE 76 HZ PHE 76 3.789 3.216 -13.336 639 H ASP 77 H ASP 77 1.545 -4.032 -11.375 640 HA ASP 77 HA ASP 77 2.665 -6.694 -11.436 641 1HB ASP 77 HB2 ASP 77 0.481 -5.579 -10.241 642 2HB ASP 77 HB3 ASP 77 -0.280 -6.430 -11.587 643 H LYS 78 H LYS 78 0.776 -8.274 -12.694 644 HA LYS 78 HA LYS 78 1.283 -7.580 -15.545 645 1HB LYS 78 HB2 LYS 78 0.172 -10.169 -15.413 646 2HB LYS 78 HB3 LYS 78 1.857 -9.751 -15.701 647 1HG LYS 78 HG2 LYS 78 1.966 -11.193 -13.844 648 2HG LYS 78 HG3 LYS 78 2.038 -9.590 -13.114 649 1HD LYS 78 HD2 LYS 78 0.257 -10.192 -11.865 650 2HD LYS 78 HD3 LYS 78 -0.699 -10.133 -13.347 651 1HE LYS 78 HE2 LYS 78 0.600 -12.519 -12.044 652 2HE LYS 78 HE3 LYS 78 -1.078 -12.317 -12.549 653 1HZ LYS 78 HZ1 LYS 78 0.245 -11.966 -14.856 654 2HZ LYS 78 HZ2 LYS 78 1.228 -13.121 -14.090 655 3HZ LYS 78 HZ3 LYS 78 -0.417 -13.446 -14.348 656 H GLY 79 H GLY 79 -1.027 -6.832 -13.507 657 1HA GLY 79 HA2 GLY 79 -3.325 -7.723 -15.167 658 2HA GLY 79 HA3 GLY 79 -3.444 -6.952 -13.584 659 H GLN 80 H GLN 80 -4.302 -4.944 -13.763 660 HA GLN 80 HA GLN 80 -4.000 -3.447 -16.287 661 1HB GLN 80 HB2 GLN 80 -5.476 -2.712 -13.738 662 2HB GLN 80 HB3 GLN 80 -5.587 -1.865 -15.281 663 1HG GLN 80 HG2 GLN 80 -7.195 -3.288 -15.945 664 2HG GLN 80 HG3 GLN 80 -6.062 -4.631 -15.784 665 1HE2 GLN 80 HE21 GLN 80 -8.813 -4.993 -15.142 666 2HE2 GLN 80 HE22 GLN 80 -8.956 -5.223 -13.466 667 H ARG 81 H ARG 81 -3.654 -0.920 -15.809 668 HA ARG 81 HA ARG 81 -1.278 -0.713 -14.002 669 1HB ARG 81 HB2 ARG 81 -1.766 0.545 -16.716 670 2HB ARG 81 HB3 ARG 81 -0.455 1.032 -15.640 671 1HG ARG 81 HG2 ARG 81 0.370 -1.319 -15.628 672 2HG ARG 81 HG3 ARG 81 -0.896 -1.744 -16.781 673 1HD ARG 81 HD2 ARG 81 0.366 0.531 -17.860 674 2HD ARG 81 HD3 ARG 81 1.672 -0.501 -17.278 675 HE ARG 81 HE ARG 81 -0.288 -2.021 -18.774 676 1HH1 ARG 81 HH11 ARG 81 2.914 -1.571 -18.663 677 2HH1 ARG 81 HH12 ARG 81 3.185 -1.371 -20.362 678 1HH2 ARG 81 HH21 ARG 81 -0.180 -1.024 -21.127 679 2HH2 ARG 81 HH22 ARG 81 1.433 -1.059 -21.756 680 H THR 82 H THR 82 -4.382 0.460 -14.774 681 HA THR 82 HA THR 82 -4.106 2.559 -12.720 682 HB THR 82 HB THR 82 -5.347 4.155 -14.377 683 HG1 THR 82 HG1 THR 82 -3.854 2.700 -16.261 684 1HG2 THR 82 HG21 THR 82 -2.994 4.366 -13.441 685 2HG2 THR 82 HG22 THR 82 -2.428 3.579 -14.913 686 3HG2 THR 82 HG23 THR 82 -3.256 5.134 -15.007 687 H ASP 83 H ASP 83 -6.079 2.977 -11.690 688 HA ASP 83 HA ASP 83 -8.278 1.120 -12.410 689 1HB ASP 83 HB2 ASP 83 -7.283 2.344 -9.953 690 2HB ASP 83 HB3 ASP 83 -9.030 2.529 -10.121 691 H LYS 84 H LYS 84 -10.464 2.511 -11.405 692 HA LYS 84 HA LYS 84 -11.009 4.341 -13.600 693 1HB LYS 84 HB2 LYS 84 -13.228 4.537 -12.618 694 2HB LYS 84 HB3 LYS 84 -12.739 2.842 -12.583 695 1HG LYS 84 HG2 LYS 84 -12.113 3.009 -10.246 696 2HG LYS 84 HG3 LYS 84 -12.401 4.750 -10.253 697 1HD LYS 84 HD2 LYS 84 -14.600 4.452 -9.871 698 2HD LYS 84 HD3 LYS 84 -14.733 3.335 -11.231 699 1HE LYS 84 HE2 LYS 84 -13.896 1.499 -9.813 700 2HE LYS 84 HE3 LYS 84 -13.753 2.613 -8.452 701 1HZ LYS 84 HZ1 LYS 84 -16.191 3.073 -8.803 702 2HZ LYS 84 HZ2 LYS 84 -16.217 1.716 -9.824 703 3HZ LYS 84 HZ3 LYS 84 -15.804 1.536 -8.189 704 H TYR 85 H TYR 85 -9.650 4.680 -10.480 705 HA TYR 85 HA TYR 85 -10.480 7.483 -10.154 706 1HB TYR 85 HB2 TYR 85 -8.727 5.596 -8.587 707 2HB TYR 85 HB3 TYR 85 -8.751 7.321 -8.226 708 HD1 TYR 85 HD1 TYR 85 -10.875 4.280 -8.491 709 HD2 TYR 85 HD2 TYR 85 -10.588 8.326 -7.078 710 HE1 TYR 85 HE1 TYR 85 -12.978 3.982 -7.214 711 HE2 TYR 85 HE2 TYR 85 -12.693 8.028 -5.800 712 HH TYR 85 HH TYR 85 -14.879 5.930 -6.321 713 H GLY 86 H GLY 86 -8.242 5.925 -12.059 714 1HA GLY 86 HA2 GLY 86 -6.596 6.909 -13.449 715 2HA GLY 86 HA3 GLY 86 -6.816 8.429 -12.580 716 H ARG 87 H ARG 87 -6.398 5.835 -10.450 717 HA ARG 87 HA ARG 87 -3.685 6.791 -9.788 718 1HB ARG 87 HB2 ARG 87 -5.336 4.653 -8.408 719 2HB ARG 87 HB3 ARG 87 -3.931 5.498 -7.755 720 1HG ARG 87 HG2 ARG 87 -5.258 7.661 -8.076 721 2HG ARG 87 HG3 ARG 87 -6.668 6.636 -8.351 722 1HD ARG 87 HD2 ARG 87 -4.939 6.700 -5.861 723 2HD ARG 87 HD3 ARG 87 -6.607 7.257 -6.000 724 HE ARG 87 HE ARG 87 -5.728 4.448 -5.849 725 1HH1 ARG 87 HH11 ARG 87 -8.113 6.299 -4.728 726 2HH1 ARG 87 HH12 ARG 87 -9.446 5.378 -5.338 727 1HH2 ARG 87 HH21 ARG 87 -7.485 3.434 -7.435 728 2HH2 ARG 87 HH22 ARG 87 -9.091 3.755 -6.870 729 H GLY 88 H GLY 88 -1.836 5.423 -9.815 730 1HA GLY 88 HA2 GLY 88 -1.987 3.251 -11.788 731 2HA GLY 88 HA3 GLY 88 -0.515 3.871 -11.041 732 H LEU 89 H LEU 89 -1.375 1.056 -11.323 733 HA LEU 89 HA LEU 89 -1.629 0.355 -8.425 734 1HB LEU 89 HB2 LEU 89 -2.280 -1.416 -10.796 735 2HB LEU 89 HB3 LEU 89 -2.631 -1.733 -9.097 736 HG LEU 89 HG LEU 89 -3.722 0.691 -10.537 737 1HD1 LEU 89 HD11 LEU 89 -4.377 -1.612 -11.542 738 2HD1 LEU 89 HD12 LEU 89 -5.280 -1.844 -10.045 739 3HD1 LEU 89 HD13 LEU 89 -5.677 -0.498 -11.114 740 1HD2 LEU 89 HD21 LEU 89 -3.657 -0.097 -7.851 741 2HD2 LEU 89 HD22 LEU 89 -4.697 1.144 -8.550 742 3HD2 LEU 89 HD23 LEU 89 -5.283 -0.512 -8.391 743 H ALA 90 H ALA 90 0.256 -0.339 -7.578 744 HA ALA 90 HA ALA 90 1.851 -2.385 -8.838 745 1HB ALA 90 HB1 ALA 90 2.493 0.387 -9.443 746 2HB ALA 90 HB2 ALA 90 3.835 -0.423 -8.634 747 3HB ALA 90 HB3 ALA 90 3.173 -1.089 -10.127 748 H TYR 91 H TYR 91 3.834 -2.849 -7.484 749 HA TYR 91 HA TYR 91 3.197 -2.293 -4.644 750 1HB TYR 91 HB2 TYR 91 5.400 -4.088 -5.676 751 2HB TYR 91 HB3 TYR 91 4.580 -4.154 -4.116 752 HD1 TYR 91 HD1 TYR 91 4.245 -4.830 -7.737 753 HD2 TYR 91 HD2 TYR 91 2.408 -5.190 -3.871 754 HE1 TYR 91 HE1 TYR 91 2.569 -6.399 -8.678 755 HE2 TYR 91 HE2 TYR 91 0.732 -6.759 -4.812 756 HH TYR 91 HH TYR 91 0.080 -7.889 -6.605 757 H ILE 92 H ILE 92 4.228 -0.627 -3.659 758 HA ILE 92 HA ILE 92 6.542 0.641 -4.916 759 HB ILE 92 HB ILE 92 5.064 1.162 -2.323 760 1HG1 ILE 92 HG12 ILE 92 5.270 2.814 -4.857 761 2HG1 ILE 92 HG13 ILE 92 3.960 1.673 -4.550 762 1HG2 ILE 92 HG21 ILE 92 7.713 1.920 -3.025 763 2HG2 ILE 92 HG22 ILE 92 6.704 3.357 -3.194 764 3HG2 ILE 92 HG23 ILE 92 6.754 2.490 -1.659 765 1HD1 ILE 92 HD11 ILE 92 4.676 3.928 -2.660 766 2HD1 ILE 92 HD12 ILE 92 3.440 4.066 -3.911 767 3HD1 ILE 92 HD13 ILE 92 3.245 2.898 -2.603 768 H TYR 93 H TYR 93 8.675 0.522 -4.221 769 HA TYR 93 HA TYR 93 9.223 -1.285 -1.901 770 1HB TYR 93 HB2 TYR 93 10.656 -1.169 -4.571 771 2HB TYR 93 HB3 TYR 93 11.246 -2.062 -3.171 772 HD1 TYR 93 HD1 TYR 93 10.094 -4.069 -2.368 773 HD2 TYR 93 HD2 TYR 93 8.663 -1.894 -5.786 774 HE1 TYR 93 HE1 TYR 93 8.636 -5.981 -2.975 775 HE2 TYR 93 HE2 TYR 93 7.205 -3.806 -6.389 776 HH TYR 93 HH TYR 93 7.108 -6.233 -6.006 777 H ALA 94 H ALA 94 10.507 -0.337 -0.391 778 HA ALA 94 HA ALA 94 12.109 2.047 -1.226 779 1HB ALA 94 HB1 ALA 94 10.061 2.078 0.558 780 2HB ALA 94 HB2 ALA 94 11.407 1.714 1.637 781 3HB ALA 94 HB3 ALA 94 11.439 3.175 0.649 782 H ASP 95 H ASP 95 14.266 1.670 -1.114 783 HA ASP 95 HA ASP 95 16.329 0.862 -0.335 784 1HB ASP 95 HB2 ASP 95 14.789 -0.186 2.054 785 2HB ASP 95 HB3 ASP 95 16.516 0.154 1.959 786 H GLY 96 H GLY 96 13.866 -0.920 -1.432 787 1HA GLY 96 HA2 GLY 96 14.284 -3.015 -2.606 788 2HA GLY 96 HA3 GLY 96 15.509 -3.405 -1.398 789 H LYS 97 H LYS 97 12.837 -2.083 0.133 790 HA LYS 97 HA LYS 97 11.871 -4.817 0.850 791 1HB LYS 97 HB2 LYS 97 12.527 -2.483 2.404 792 2HB LYS 97 HB3 LYS 97 10.825 -2.877 2.638 793 1HG LYS 97 HG2 LYS 97 11.356 -4.656 3.908 794 2HG LYS 97 HG3 LYS 97 12.402 -5.296 2.641 795 1HD LYS 97 HD2 LYS 97 13.594 -2.985 3.960 796 2HD LYS 97 HD3 LYS 97 13.237 -4.281 5.103 797 1HE LYS 97 HE2 LYS 97 14.601 -5.828 3.966 798 2HE LYS 97 HE3 LYS 97 14.597 -4.877 2.481 799 1HZ LYS 97 HZ1 LYS 97 15.804 -3.126 3.788 800 2HZ LYS 97 HZ2 LYS 97 16.003 -4.279 5.019 801 3HZ LYS 97 HZ3 LYS 97 16.686 -4.544 3.485 802 H MET 98 H MET 98 9.623 -5.243 0.793 803 HA MET 98 HA MET 98 8.105 -3.626 -1.099 804 1HB MET 98 HB2 MET 98 7.970 -6.175 -0.794 805 2HB MET 98 HB3 MET 98 6.998 -5.837 0.639 806 1HG MET 98 HG2 MET 98 5.181 -5.362 -0.607 807 2HG MET 98 HG3 MET 98 6.102 -4.267 -1.640 808 1HE MET 98 HE1 MET 98 5.643 -7.895 -0.630 809 2HE MET 98 HE2 MET 98 4.155 -7.534 -1.515 810 3HE MET 98 HE3 MET 98 5.289 -8.729 -2.140 811 H VAL 99 H VAL 99 7.522 -1.628 -0.275 812 HA VAL 99 HA VAL 99 6.942 -0.936 2.367 813 HB VAL 99 HB VAL 99 5.503 0.108 -0.091 814 1HG1 VAL 99 HG11 VAL 99 5.526 0.826 2.763 815 2HG1 VAL 99 HG12 VAL 99 5.857 2.184 1.687 816 3HG1 VAL 99 HG13 VAL 99 4.367 1.257 1.505 817 1HG2 VAL 99 HG21 VAL 99 8.141 0.854 1.200 818 2HG2 VAL 99 HG22 VAL 99 7.880 0.291 -0.451 819 3HG2 VAL 99 HG23 VAL 99 7.307 1.886 0.039 820 H ASN 100 H ASN 100 4.766 -2.383 -0.043 821 HA ASN 100 HA ASN 100 2.349 -2.246 1.403 822 1HB ASN 100 HB2 ASN 100 3.333 -4.518 -0.354 823 2HB ASN 100 HB3 ASN 100 1.654 -4.231 0.109 824 1HD2 ASN 100 HD21 ASN 100 0.475 -3.004 -1.364 825 2HD2 ASN 100 HD22 ASN 100 1.145 -1.933 -2.498 826 H GLU 101 H GLU 101 4.796 -4.861 1.449 827 HA GLU 101 HA GLU 101 3.522 -6.383 3.506 828 1HB GLU 101 HB2 GLU 101 5.438 -7.117 1.969 829 2HB GLU 101 HB3 GLU 101 6.511 -6.241 3.063 830 1HG GLU 101 HG2 GLU 101 6.453 -7.920 4.560 831 2HG GLU 101 HG3 GLU 101 4.689 -7.907 4.571 832 H ALA 102 H ALA 102 5.503 -3.515 3.581 833 HA ALA 102 HA ALA 102 6.389 -3.633 6.289 834 1HB ALA 102 HB1 ALA 102 7.173 -1.972 4.575 835 2HB ALA 102 HB2 ALA 102 5.621 -1.149 4.732 836 3HB ALA 102 HB3 ALA 102 6.717 -1.233 6.110 837 H LEU 103 H LEU 103 3.611 -1.823 4.959 838 HA LEU 103 HA LEU 103 2.446 -1.108 7.428 839 1HB LEU 103 HB2 LEU 103 1.205 -1.692 4.729 840 2HB LEU 103 HB3 LEU 103 0.260 -1.106 6.099 841 HG LEU 103 HG LEU 103 2.610 0.510 5.882 842 1HD1 LEU 103 HD11 LEU 103 2.276 -0.472 3.437 843 2HD1 LEU 103 HD12 LEU 103 1.001 0.744 3.366 844 3HD1 LEU 103 HD13 LEU 103 2.667 1.232 3.678 845 1HD2 LEU 103 HD21 LEU 103 0.181 0.945 6.735 846 2HD2 LEU 103 HD22 LEU 103 1.043 2.264 5.943 847 3HD2 LEU 103 HD23 LEU 103 -0.165 1.340 5.051 848 H VAL 104 H VAL 104 1.851 -4.011 5.429 849 HA VAL 104 HA VAL 104 -0.102 -5.257 7.001 850 HB VAL 104 HB VAL 104 2.231 -6.468 5.491 851 1HG1 VAL 104 HG11 VAL 104 0.410 -7.697 7.355 852 2HG1 VAL 104 HG12 VAL 104 0.077 -8.299 5.731 853 3HG1 VAL 104 HG13 VAL 104 1.696 -8.450 6.413 854 1HG2 VAL 104 HG21 VAL 104 0.077 -5.126 4.521 855 2HG2 VAL 104 HG22 VAL 104 0.857 -6.452 3.659 856 3HG2 VAL 104 HG23 VAL 104 -0.592 -6.755 4.617 857 H ARG 105 H ARG 105 3.425 -5.234 7.459 858 HA ARG 105 HA ARG 105 3.450 -7.001 9.718 859 1HB ARG 105 HB2 ARG 105 5.327 -5.165 8.383 860 2HB ARG 105 HB3 ARG 105 5.599 -5.325 10.119 861 1HG ARG 105 HG2 ARG 105 6.374 -7.438 9.903 862 2HG ARG 105 HG3 ARG 105 5.050 -7.895 8.831 863 1HD ARG 105 HD2 ARG 105 6.663 -7.979 7.230 864 2HD ARG 105 HD3 ARG 105 6.500 -6.224 7.215 865 HE ARG 105 HE ARG 105 8.339 -6.732 9.241 866 1HH1 ARG 105 HH11 ARG 105 8.274 -8.599 6.468 867 2HH1 ARG 105 HH12 ARG 105 9.848 -8.146 5.906 868 1HH2 ARG 105 HH21 ARG 105 10.269 -5.654 8.279 869 2HH2 ARG 105 HH22 ARG 105 10.978 -6.481 6.932 870 H GLN 106 H GLN 106 3.212 -3.459 9.432 871 HA GLN 106 HA GLN 106 3.118 -3.068 12.317 872 1HB GLN 106 HB2 GLN 106 2.622 -1.301 9.923 873 2HB GLN 106 HB3 GLN 106 2.259 -0.740 11.556 874 1HG GLN 106 HG2 GLN 106 4.931 -1.989 11.052 875 2HG GLN 106 HG3 GLN 106 4.658 -0.342 10.482 876 1HE2 GLN 106 HE21 GLN 106 6.073 0.601 12.116 877 2HE2 GLN 106 HE22 GLN 106 5.633 0.641 13.754 878 H GLY 107 H GLY 107 0.952 -4.453 10.252 879 1HA GLY 107 HA2 GLY 107 -1.340 -4.919 10.420 880 2HA GLY 107 HA3 GLY 107 -1.197 -4.457 12.116 881 H LEU 108 H LEU 108 -0.586 -2.408 9.278 882 HA LEU 108 HA LEU 108 -2.710 -0.575 10.303 883 1HB LEU 108 HB2 LEU 108 -0.193 -0.122 8.699 884 2HB LEU 108 HB3 LEU 108 -1.479 1.085 8.744 885 HG LEU 108 HG LEU 108 -0.327 -0.094 11.274 886 1HD1 LEU 108 HD11 LEU 108 0.750 2.059 9.490 887 2HD1 LEU 108 HD12 LEU 108 0.881 2.268 11.237 888 3HD1 LEU 108 HD13 LEU 108 1.621 0.869 10.457 889 1HD2 LEU 108 HD21 LEU 108 -2.296 1.950 10.526 890 2HD2 LEU 108 HD22 LEU 108 -2.071 1.121 12.067 891 3HD2 LEU 108 HD23 LEU 108 -1.096 2.539 11.677 892 H ALA 109 H ALA 109 -1.574 -2.328 7.467 893 HA ALA 109 HA ALA 109 -4.021 -1.410 6.010 894 1HB ALA 109 HB1 ALA 109 -1.776 -0.851 4.976 895 2HB ALA 109 HB2 ALA 109 -1.509 -2.584 4.791 896 3HB ALA 109 HB3 ALA 109 -2.844 -1.803 3.944 897 H LYS 110 H LYS 110 -5.522 -2.966 5.574 898 HA LYS 110 HA LYS 110 -4.845 -5.766 6.281 899 1HB LYS 110 HB2 LYS 110 -7.492 -4.423 5.659 900 2HB LYS 110 HB3 LYS 110 -7.312 -6.123 6.093 901 1HG LYS 110 HG2 LYS 110 -5.896 -4.883 8.094 902 2HG LYS 110 HG3 LYS 110 -7.197 -3.726 7.803 903 1HD LYS 110 HD2 LYS 110 -7.632 -6.693 8.245 904 2HD LYS 110 HD3 LYS 110 -7.785 -5.472 9.509 905 1HE LYS 110 HE2 LYS 110 -9.361 -4.333 7.660 906 2HE LYS 110 HE3 LYS 110 -9.559 -6.019 7.177 907 1HZ LYS 110 HZ1 LYS 110 -9.940 -6.406 9.672 908 2HZ LYS 110 HZ2 LYS 110 -10.231 -4.737 9.744 909 3HZ LYS 110 HZ3 LYS 110 -11.198 -5.725 8.756 910 H VAL 111 H VAL 111 -5.749 -7.492 4.786 911 HA VAL 111 HA VAL 111 -4.921 -6.879 2.031 912 HB VAL 111 HB VAL 111 -5.914 -9.445 3.312 913 1HG1 VAL 111 HG11 VAL 111 -6.052 -8.933 0.678 914 2HG1 VAL 111 HG12 VAL 111 -4.356 -9.407 0.771 915 3HG1 VAL 111 HG13 VAL 111 -5.615 -10.524 1.302 916 1HG2 VAL 111 HG21 VAL 111 -3.138 -8.468 2.565 917 2HG2 VAL 111 HG22 VAL 111 -3.756 -8.687 4.201 918 3HG2 VAL 111 HG23 VAL 111 -3.512 -10.087 3.157 919 H ALA 112 H ALA 112 -6.334 -6.420 0.392 920 HA ALA 112 HA ALA 112 -9.071 -7.448 0.425 921 1HB ALA 112 HB1 ALA 112 -9.263 -5.488 1.933 922 2HB ALA 112 HB2 ALA 112 -8.609 -4.459 0.659 923 3HB ALA 112 HB3 ALA 112 -10.170 -5.250 0.440 924 H TYR 113 H TYR 113 -10.225 -6.847 -1.591 925 HA TYR 113 HA TYR 113 -10.253 -6.637 -3.927 926 1HB TYR 113 HB2 TYR 113 -8.023 -4.647 -3.407 927 2HB TYR 113 HB3 TYR 113 -9.039 -4.733 -4.846 928 HD1 TYR 113 HD1 TYR 113 -11.551 -4.381 -4.595 929 HD2 TYR 113 HD2 TYR 113 -8.742 -3.481 -1.472 930 HE1 TYR 113 HE1 TYR 113 -13.244 -2.949 -3.486 931 HE2 TYR 113 HE2 TYR 113 -10.436 -2.049 -0.362 932 HH TYR 113 HH TYR 113 -12.559 -0.711 -1.222 933 H VAL 114 H VAL 114 -9.303 -8.884 -3.876 934 HA VAL 114 HA VAL 114 -6.511 -8.865 -4.956 935 HB VAL 114 HB VAL 114 -7.938 -11.098 -3.478 936 1HG1 VAL 114 HG11 VAL 114 -6.061 -11.495 -5.316 937 2HG1 VAL 114 HG12 VAL 114 -4.992 -11.003 -4.003 938 3HG1 VAL 114 HG13 VAL 114 -6.048 -12.401 -3.802 939 1HG2 VAL 114 HG21 VAL 114 -7.108 -8.923 -2.244 940 2HG2 VAL 114 HG22 VAL 114 -6.726 -10.507 -1.568 941 3HG2 VAL 114 HG23 VAL 114 -5.509 -9.626 -2.491 942 H TYR 115 H TYR 115 -7.524 -8.487 -7.085 943 HA TYR 115 HA TYR 115 -8.950 -10.883 -8.154 944 1HB TYR 115 HB2 TYR 115 -8.733 -8.140 -9.423 945 2HB TYR 115 HB3 TYR 115 -9.820 -9.449 -9.886 946 HD1 TYR 115 HD1 TYR 115 -11.643 -10.170 -8.308 947 HD2 TYR 115 HD2 TYR 115 -9.266 -6.658 -7.628 948 HE1 TYR 115 HE1 TYR 115 -13.331 -9.341 -6.690 949 HE2 TYR 115 HE2 TYR 115 -10.953 -5.829 -6.011 950 HH TYR 115 HH TYR 115 -13.899 -6.655 -5.843 951 H LYS 116 H LYS 116 -8.104 -11.959 -9.949 952 HA LYS 116 HA LYS 116 -5.250 -11.494 -10.487 953 1HB LYS 116 HB2 LYS 116 -6.950 -13.519 -11.925 954 2HB LYS 116 HB3 LYS 116 -5.251 -13.625 -11.470 955 1HG LYS 116 HG2 LYS 116 -6.226 -13.438 -9.017 956 2HG LYS 116 HG3 LYS 116 -7.690 -14.052 -9.787 957 1HD LYS 116 HD2 LYS 116 -6.037 -15.803 -10.857 958 2HD LYS 116 HD3 LYS 116 -5.014 -15.375 -9.486 959 1HE LYS 116 HE2 LYS 116 -6.462 -16.282 -7.940 960 2HE LYS 116 HE3 LYS 116 -7.887 -15.948 -8.925 961 1HZ LYS 116 HZ1 LYS 116 -6.335 -17.725 -10.367 962 2HZ LYS 116 HZ2 LYS 116 -6.344 -18.313 -8.776 963 3HZ LYS 116 HZ3 LYS 116 -7.812 -18.044 -9.589 964 HA PRO 117 HA PRO 117 -4.034 -12.380 -12.073 965 1HB PRO 117 HB2 PRO 117 -2.174 -11.361 -13.789 966 2HB PRO 117 HB3 PRO 117 -3.326 -12.624 -14.256 967 1HG PRO 117 HG2 PRO 117 -3.276 -9.762 -15.018 968 2HG PRO 117 HG3 PRO 117 -4.017 -11.135 -15.854 969 1HD PRO 117 HD2 PRO 117 -5.342 -9.197 -14.219 970 2HD PRO 117 HD3 PRO 117 -6.051 -10.656 -14.944 971 H ASN 118 H ASN 118 -4.918 -9.423 -11.328 972 HA ASN 118 HA ASN 118 -2.307 -8.237 -10.650 973 1HB ASN 118 HB2 ASN 118 -5.098 -7.339 -10.755 974 2HB ASN 118 HB3 ASN 118 -4.220 -6.741 -9.348 975 1HD2 ASN 118 HD21 ASN 118 -4.697 -4.659 -10.837 976 2HD2 ASN 118 HD22 ASN 118 -3.429 -4.238 -11.884 977 H ASN 119 H ASN 119 -2.029 -10.428 -9.339 978 HA ASN 119 HA ASN 119 -2.311 -9.699 -6.530 979 1HB ASN 119 HB2 ASN 119 -3.658 -11.614 -5.851 980 2HB ASN 119 HB3 ASN 119 -4.554 -10.678 -7.049 981 1HD2 ASN 119 HD21 ASN 119 -5.024 -13.504 -6.572 982 2HD2 ASN 119 HD22 ASN 119 -4.594 -14.341 -7.984 983 H THR 120 H THR 120 -0.168 -10.378 -8.425 984 HA THR 120 HA THR 120 0.844 -12.974 -8.234 985 HB THR 120 HB THR 120 1.841 -10.859 -9.379 986 HG1 THR 120 HG1 THR 120 2.727 -13.094 -9.148 987 1HG2 THR 120 HG21 THR 120 3.236 -10.745 -6.692 988 2HG2 THR 120 HG22 THR 120 3.680 -9.808 -8.117 989 3HG2 THR 120 HG23 THR 120 2.128 -9.529 -7.329 990 H HIS 121 H HIS 121 1.253 -10.325 -5.888 991 HA HIS 121 HA HIS 121 2.474 -12.186 -3.948 992 1HB HIS 121 HB2 HIS 121 1.851 -9.224 -3.879 993 2HB HIS 121 HB3 HIS 121 2.495 -10.098 -2.489 994 HD1 HIS 121 HD1 HIS 121 4.558 -11.909 -3.761 995 HD2 HIS 121 HD2 HIS 121 4.074 -7.931 -4.905 996 HE1 HIS 121 HE1 HIS 121 6.741 -11.201 -4.830 997 H GLU 122 H GLU 122 -0.069 -13.041 -4.553 998 HA GLU 122 HA GLU 122 -2.030 -11.937 -2.701 999 1HB GLU 122 HB2 GLU 122 -2.693 -13.045 -4.821 1000 2HB GLU 122 HB3 GLU 122 -2.044 -14.568 -4.213 1001 1HG GLU 122 HG2 GLU 122 -3.953 -13.179 -2.419 1002 2HG GLU 122 HG3 GLU 122 -4.637 -13.836 -3.906 1003 H GLN 123 H GLN 123 -0.788 -15.288 -2.886 1004 HA GLN 123 HA GLN 123 -1.435 -15.989 -0.233 1005 1HB GLN 123 HB2 GLN 123 0.554 -16.991 -2.236 1006 2HB GLN 123 HB3 GLN 123 0.662 -17.578 -0.576 1007 1HG GLN 123 HG2 GLN 123 -1.919 -17.606 -2.155 1008 2HG GLN 123 HG3 GLN 123 -0.799 -18.968 -2.134 1009 1HE2 GLN 123 HE21 GLN 123 -3.576 -18.817 -0.979 1010 2HE2 GLN 123 HE22 GLN 123 -3.397 -19.185 0.669 1011 H LEU 124 H LEU 124 1.265 -14.134 -1.470 1012 HA LEU 124 HA LEU 124 2.946 -14.357 0.858 1013 1HB LEU 124 HB2 LEU 124 3.758 -13.577 -1.361 1014 2HB LEU 124 HB3 LEU 124 2.802 -12.106 -1.170 1015 HG LEU 124 HG LEU 124 4.070 -11.810 1.066 1016 1HD1 LEU 124 HD11 LEU 124 5.217 -14.260 0.082 1017 2HD1 LEU 124 HD12 LEU 124 6.475 -13.026 0.172 1018 3HD1 LEU 124 HD13 LEU 124 5.534 -13.432 1.608 1019 1HD2 LEU 124 HD21 LEU 124 4.416 -10.436 -0.987 1020 2HD2 LEU 124 HD22 LEU 124 5.912 -10.671 -0.082 1021 3HD2 LEU 124 HD23 LEU 124 5.609 -11.611 -1.543 1022 H LEU 125 H LEU 125 0.798 -11.689 -0.216 1023 HA LEU 125 HA LEU 125 1.061 -10.229 2.248 1024 1HB LEU 125 HB2 LEU 125 -0.877 -10.143 -0.055 1025 2HB LEU 125 HB3 LEU 125 -1.159 -9.166 1.387 1026 HG LEU 125 HG LEU 125 1.475 -9.141 -0.099 1027 1HD1 LEU 125 HD11 LEU 125 -0.407 -8.424 -1.586 1028 2HD1 LEU 125 HD12 LEU 125 -0.838 -7.200 -0.392 1029 3HD1 LEU 125 HD13 LEU 125 0.716 -7.115 -1.221 1030 1HD2 LEU 125 HD21 LEU 125 1.090 -8.314 2.362 1031 2HD2 LEU 125 HD22 LEU 125 1.987 -7.289 1.243 1032 3HD2 LEU 125 HD23 LEU 125 0.292 -6.945 1.586 1033 H ARG 126 H ARG 126 -0.763 -13.016 1.386 1034 HA ARG 126 HA ARG 126 -2.904 -12.660 3.312 1035 1HB ARG 126 HB2 ARG 126 -2.554 -14.337 1.213 1036 2HB ARG 126 HB3 ARG 126 -2.100 -15.410 2.538 1037 1HG ARG 126 HG2 ARG 126 -4.266 -15.690 3.070 1038 2HG ARG 126 HG3 ARG 126 -4.434 -13.952 3.326 1039 1HD ARG 126 HD2 ARG 126 -5.912 -14.128 1.589 1040 2HD ARG 126 HD3 ARG 126 -4.442 -14.022 0.620 1041 HE ARG 126 HE ARG 126 -4.874 -16.757 1.276 1042 1HH1 ARG 126 HH11 ARG 126 -5.582 -14.261 -0.933 1043 2HH1 ARG 126 HH12 ARG 126 -6.581 -15.242 -1.954 1044 1HH2 ARG 126 HH21 ARG 126 -6.457 -18.006 0.134 1045 2HH2 ARG 126 HH22 ARG 126 -7.079 -17.361 -1.347 1046 H LYS 127 H LYS 127 -0.051 -14.839 3.293 1047 HA LYS 127 HA LYS 127 -0.348 -15.677 5.999 1048 1HB LYS 127 HB2 LYS 127 2.096 -16.265 5.829 1049 2HB LYS 127 HB3 LYS 127 1.118 -16.898 4.504 1050 1HG LYS 127 HG2 LYS 127 2.768 -15.949 3.231 1051 2HG LYS 127 HG3 LYS 127 1.785 -14.502 3.455 1052 1HD LYS 127 HD2 LYS 127 3.864 -13.713 4.128 1053 2HD LYS 127 HD3 LYS 127 3.208 -14.260 5.672 1054 1HE LYS 127 HE2 LYS 127 4.509 -16.214 5.679 1055 2HE LYS 127 HE3 LYS 127 4.783 -16.151 3.937 1056 1HZ LYS 127 HZ1 LYS 127 5.997 -13.991 4.423 1057 2HZ LYS 127 HZ2 LYS 127 5.999 -14.480 6.050 1058 3HZ LYS 127 HZ3 LYS 127 6.774 -15.433 4.879 1059 H SER 128 H SER 128 1.306 -12.903 4.567 1060 HA SER 128 HA SER 128 2.631 -12.024 6.951 1061 1HB SER 128 HB2 SER 128 2.964 -9.943 5.801 1062 2HB SER 128 HB3 SER 128 3.053 -11.206 4.577 1063 HG SER 128 HG SER 128 1.645 -9.258 4.212 1064 H GLU 129 H GLU 129 -0.574 -11.305 5.583 1065 HA GLU 129 HA GLU 129 -1.343 -9.353 7.520 1066 1HB GLU 129 HB2 GLU 129 -2.690 -9.570 5.554 1067 2HB GLU 129 HB3 GLU 129 -2.945 -11.292 5.836 1068 1HG GLU 129 HG2 GLU 129 -3.789 -9.799 8.154 1069 2HG GLU 129 HG3 GLU 129 -4.575 -9.153 6.714 1070 H ALA 130 H ALA 130 -1.583 -12.898 7.502 1071 HA ALA 130 HA ALA 130 -3.100 -13.132 9.921 1072 1HB ALA 130 HB1 ALA 130 -1.236 -14.974 8.432 1073 2HB ALA 130 HB2 ALA 130 -1.909 -15.447 9.992 1074 3HB ALA 130 HB3 ALA 130 -2.983 -15.104 8.636 1075 H GLN 131 H GLN 131 0.350 -12.787 9.276 1076 HA GLN 131 HA GLN 131 1.231 -13.348 11.960 1077 1HB GLN 131 HB2 GLN 131 2.692 -13.278 9.881 1078 2HB GLN 131 HB3 GLN 131 2.589 -11.520 9.962 1079 1HG GLN 131 HG2 GLN 131 4.443 -11.719 11.276 1080 2HG GLN 131 HG3 GLN 131 3.268 -12.102 12.536 1081 1HE2 GLN 131 HE21 GLN 131 3.957 -13.912 13.678 1082 2HE2 GLN 131 HE22 GLN 131 4.692 -15.279 12.992 1083 H ALA 132 H ALA 132 0.361 -10.350 10.250 1084 HA ALA 132 HA ALA 132 0.951 -8.599 12.457 1085 1HB ALA 132 HB1 ALA 132 0.327 -8.181 9.854 1086 2HB ALA 132 HB2 ALA 132 -1.242 -7.857 10.591 1087 3HB ALA 132 HB3 ALA 132 0.174 -6.930 11.087 1088 H LYS 133 H LYS 133 -1.803 -10.580 11.581 1089 HA LYS 133 HA LYS 133 -3.713 -9.352 13.356 1090 1HB LYS 133 HB2 LYS 133 -3.551 -11.750 11.678 1091 2HB LYS 133 HB3 LYS 133 -4.437 -12.029 13.176 1092 1HG LYS 133 HG2 LYS 133 -5.775 -9.950 12.683 1093 2HG LYS 133 HG3 LYS 133 -4.990 -9.889 11.104 1094 1HD LYS 133 HD2 LYS 133 -5.818 -12.499 11.190 1095 2HD LYS 133 HD3 LYS 133 -7.112 -11.693 12.079 1096 1HE LYS 133 HE2 LYS 133 -6.865 -9.963 10.030 1097 2HE LYS 133 HE3 LYS 133 -6.335 -11.436 9.218 1098 1HZ LYS 133 HZ1 LYS 133 -8.425 -12.434 10.347 1099 2HZ LYS 133 HZ2 LYS 133 -8.939 -10.817 10.434 1100 3HZ LYS 133 HZ3 LYS 133 -8.595 -11.523 8.926 1101 H LYS 134 H LYS 134 -1.280 -11.888 13.737 1102 HA LYS 134 HA LYS 134 -2.137 -12.566 16.442 1103 1HB LYS 134 HB2 LYS 134 0.304 -13.251 14.787 1104 2HB LYS 134 HB3 LYS 134 0.071 -13.824 16.435 1105 1HG LYS 134 HG2 LYS 134 -2.340 -14.465 15.352 1106 2HG LYS 134 HG3 LYS 134 -1.294 -14.651 13.944 1107 1HD LYS 134 HD2 LYS 134 0.111 -16.227 15.093 1108 2HD LYS 134 HD3 LYS 134 -0.680 -15.895 16.634 1109 1HE LYS 134 HE2 LYS 134 -2.488 -17.202 16.140 1110 2HE LYS 134 HE3 LYS 134 -2.470 -16.755 14.434 1111 1HZ LYS 134 HZ1 LYS 134 -0.138 -18.201 15.032 1112 2HZ LYS 134 HZ2 LYS 134 -1.472 -19.075 15.607 1113 3HZ LYS 134 HZ3 LYS 134 -1.399 -18.616 13.973 1114 H GLU 135 H GLU 135 0.142 -10.372 14.933 1115 HA GLU 135 HA GLU 135 1.656 -9.804 17.338 1116 1HB GLU 135 HB2 GLU 135 1.350 -8.442 14.666 1117 2HB GLU 135 HB3 GLU 135 2.267 -7.687 15.969 1118 1HG GLU 135 HG2 GLU 135 3.835 -9.470 16.043 1119 2HG GLU 135 HG3 GLU 135 2.797 -10.528 15.086 1120 H LYS 136 H LYS 136 -1.455 -8.880 16.216 1121 HA LYS 136 HA LYS 136 -2.994 -7.285 17.007 1122 1HB LYS 136 HB2 LYS 136 -1.310 -7.926 19.427 1123 2HB LYS 136 HB3 LYS 136 -2.623 -6.752 19.522 1124 1HG LYS 136 HG2 LYS 136 -3.620 -9.026 18.129 1125 2HG LYS 136 HG3 LYS 136 -2.794 -9.613 19.572 1126 1HD LYS 136 HD2 LYS 136 -4.477 -7.223 20.000 1127 2HD LYS 136 HD3 LYS 136 -5.364 -8.682 19.557 1128 1HE LYS 136 HE2 LYS 136 -4.113 -9.908 21.361 1129 2HE LYS 136 HE3 LYS 136 -3.424 -8.365 21.863 1130 1HZ LYS 136 HZ1 LYS 136 -6.335 -8.915 21.684 1131 2HZ LYS 136 HZ2 LYS 136 -5.432 -9.009 23.119 1132 3HZ LYS 136 HZ3 LYS 136 -5.600 -7.523 22.313 1133 H LEU 137 H LEU 137 -1.473 -5.941 15.421 1134 HA LEU 137 HA LEU 137 -0.201 -3.725 16.965 1135 1HB LEU 137 HB2 LEU 137 0.359 -5.025 14.367 1136 2HB LEU 137 HB3 LEU 137 0.523 -3.268 14.380 1137 HG LEU 137 HG LEU 137 1.690 -4.506 16.755 1138 1HD1 LEU 137 HD11 LEU 137 2.014 -6.228 14.811 1139 2HD1 LEU 137 HD12 LEU 137 3.173 -5.051 14.194 1140 3HD1 LEU 137 HD13 LEU 137 3.410 -5.770 15.787 1141 1HD2 LEU 137 HD21 LEU 137 1.950 -2.175 15.332 1142 2HD2 LEU 137 HD22 LEU 137 3.119 -2.747 16.523 1143 3HD2 LEU 137 HD23 LEU 137 3.378 -3.066 14.809 1144 H ASN 138 H ASN 138 -0.718 -1.558 16.428 1145 HA ASN 138 HA ASN 138 -2.361 0.097 16.086 1146 1HB ASN 138 HB2 ASN 138 -2.069 -1.228 13.379 1147 2HB ASN 138 HB3 ASN 138 -2.878 0.317 13.633 1148 1HD2 ASN 138 HD21 ASN 138 0.265 -1.271 14.441 1149 2HD2 ASN 138 HD22 ASN 138 1.193 0.135 14.230 1150 H ILE 139 H ILE 139 -3.990 -1.568 13.543 1151 HA ILE 139 HA ILE 139 -6.533 -1.383 14.789 1152 HB ILE 139 HB ILE 139 -5.632 -3.240 12.574 1153 1HG1 ILE 139 HG12 ILE 139 -7.202 -0.955 11.762 1154 2HG1 ILE 139 HG13 ILE 139 -5.785 -0.418 12.667 1155 1HG2 ILE 139 HG21 ILE 139 -8.228 -2.678 13.866 1156 2HG2 ILE 139 HG22 ILE 139 -8.246 -2.653 12.101 1157 3HG2 ILE 139 HG23 ILE 139 -7.703 -4.096 12.958 1158 1HD1 ILE 139 HD11 ILE 139 -4.821 -2.463 11.022 1159 2HD1 ILE 139 HD12 ILE 139 -5.931 -1.558 9.993 1160 3HD1 ILE 139 HD13 ILE 139 -4.588 -0.732 10.781 1161 H TRP 140 H TRP 140 -4.592 -4.327 14.187 1162 HA TRP 140 HA TRP 140 -6.293 -6.046 15.710 1163 1HB TRP 140 HB2 TRP 140 -3.339 -6.514 15.334 1164 2HB TRP 140 HB3 TRP 140 -4.646 -7.700 15.373 1165 HD1 TRP 140 HD1 TRP 140 -2.646 -5.625 13.033 1166 HE1 TRP 140 HE1 TRP 140 -3.595 -5.798 10.644 1167 HE3 TRP 140 HE3 TRP 140 -7.103 -7.918 14.017 1168 HZ2 TRP 140 HZ2 TRP 140 -5.936 -6.775 9.323 1169 HZ3 TRP 140 HZ3 TRP 140 -8.673 -8.456 12.176 1170 HH2 TRP 140 HH2 TRP 140 -8.095 -7.888 9.832 1171 H SER 141 H SER 141 -4.298 -3.562 16.783 1172 HA SER 141 HA SER 141 -3.077 -4.596 19.111 1173 1HB SER 141 HB2 SER 141 -4.396 -1.883 18.794 1174 2HB SER 141 HB3 SER 141 -3.177 -2.310 19.992 1175 HG SER 141 HG SER 141 -1.931 -2.963 17.993 1176 H GLU 142 H GLU 142 -6.438 -3.936 18.424 1177 HA GLU 142 HA GLU 142 -7.208 -4.205 21.262 1178 1HB GLU 142 HB2 GLU 142 -8.812 -3.800 18.722 1179 2HB GLU 142 HB3 GLU 142 -9.540 -3.960 20.321 1180 1HG GLU 142 HG2 GLU 142 -7.602 -2.065 20.774 1181 2HG GLU 142 HG3 GLU 142 -8.109 -1.676 19.131 1182 H ASP 143 H ASP 143 -9.469 -5.695 21.223 1183 HA ASP 143 HA ASP 143 -8.434 -8.391 20.498 1184 1HB ASP 143 HB2 ASP 143 -9.375 -7.608 22.867 1185 2HB ASP 143 HB3 ASP 143 -10.919 -8.008 22.116 1186 H ASN 144 H ASN 144 -9.489 -9.638 18.983 1187 HA ASN 144 HA ASN 144 -11.735 -8.347 17.540 1188 1HB ASN 144 HB2 ASN 144 -9.594 -10.242 16.859 1189 2HB ASN 144 HB3 ASN 144 -11.167 -10.685 16.191 1190 1HD2 ASN 144 HD21 ASN 144 -9.105 -7.737 16.549 1191 2HD2 ASN 144 HD22 ASN 144 -9.509 -7.096 15.031 1192 H ALA 145 H ALA 145 -10.955 -11.344 19.280 1193 HA ALA 145 HA ALA 145 -13.573 -12.521 18.814 1194 1HB ALA 145 HB1 ALA 145 -11.161 -13.190 20.438 1195 2HB ALA 145 HB2 ALA 145 -12.695 -13.902 20.940 1196 3HB ALA 145 HB3 ALA 145 -12.075 -14.198 19.315 1197 H ASP 146 H ASP 146 -12.024 -10.990 21.655 1198 HA ASP 146 HA ASP 146 -12.994 -10.025 23.560 1199 1HB ASP 146 HB2 ASP 146 -15.019 -9.478 21.395 1200 2HB ASP 146 HB3 ASP 146 -15.323 -8.976 23.058 1201 H SER 147 H SER 147 -16.187 -10.885 22.401 1202 HA SER 147 HA SER 147 -16.546 -12.599 24.768 1203 1HB SER 147 HB2 SER 147 -18.859 -12.742 23.197 1204 2HB SER 147 HB3 SER 147 -18.600 -11.689 24.586 1205 HG SER 147 HG SER 147 -18.355 -11.159 21.839 1206 H GLY 148 H GLY 148 -17.997 -13.295 21.624 1207 1HA GLY 148 HA2 GLY 148 -16.499 -15.240 20.478 1208 2HA GLY 148 HA3 GLY 148 -17.126 -16.096 21.887 1209 H GLN 149 H GLN 149 -18.595 -17.478 20.921 1210 HA GLN 149 HA GLN 149 -20.712 -18.058 20.065 1211 1HB GLN 149 HB2 GLN 149 -21.130 -15.532 21.033 1212 2HB GLN 149 HB3 GLN 149 -21.489 -15.306 19.321 1213 1HG GLN 149 HG2 GLN 149 -22.964 -17.373 19.477 1214 2HG GLN 149 HG3 GLN 149 -22.766 -17.278 21.227 1215 1HE2 GLN 149 HE21 GLN 149 -22.939 -14.572 21.762 1216 2HE2 GLN 149 HE22 GLN 149 -24.436 -13.955 21.249 1217 HN3 PTP 150 H3 PTP 150 -10.899 -4.651 -7.858 1218 1H5M PTP 150 H51 PTP 150 -7.509 -1.422 -5.134 1219 2H5M PTP 150 H52 PTP 150 -6.809 -2.234 -6.555 1220 3H5M PTP 150 H53 PTP 150 -7.293 -3.190 -5.133 1221 H6 PTP 150 H6 PTP 150 -9.491 -0.521 -5.843 1222 H1* PTP 150 H1' PTP 150 -12.603 -0.462 -7.684 1223 2H2* PTP 150 H2' PTP 150 -12.496 -1.121 -4.744 1224 H3* PTP 150 H3' PTP 150 -13.011 1.117 -4.110 1225 H4* PTP 150 H4' PTP 150 -11.732 2.582 -6.029 1226 2H5* PTP 150 H5' PTP 150 -10.684 0.629 -3.915 Start of MODEL 3 1 1H ALA 1 H1 ALA 1 16.297 -19.250 -6.725 2 2H ALA 1 H2 ALA 1 14.956 -18.340 -7.233 3 3H ALA 1 H3 ALA 1 16.383 -17.554 -6.764 4 HA ALA 1 HA ALA 1 15.563 -19.212 -4.654 5 1HB ALA 1 HB1 ALA 1 16.588 -16.616 -5.126 6 2HB ALA 1 HB2 ALA 1 15.093 -16.398 -4.217 7 3HB ALA 1 HB3 ALA 1 16.378 -17.416 -3.568 8 H THR 2 H THR 2 13.818 -16.269 -5.652 9 HA THR 2 HA THR 2 11.277 -17.787 -5.714 10 HB THR 2 HB THR 2 11.344 -17.208 -3.391 11 HG1 THR 2 HG1 THR 2 9.388 -16.691 -4.413 12 1HG2 THR 2 HG21 THR 2 13.205 -15.547 -3.644 13 2HG2 THR 2 HG22 THR 2 12.021 -14.377 -4.226 14 3HG2 THR 2 HG23 THR 2 11.911 -14.996 -2.579 15 H SER 3 H SER 3 13.070 -16.071 -7.511 16 HA SER 3 HA SER 3 10.881 -14.264 -8.445 17 1HB SER 3 HB2 SER 3 13.839 -13.610 -8.532 18 2HB SER 3 HB3 SER 3 12.511 -12.561 -9.024 19 HG SER 3 HG SER 3 13.560 -12.556 -6.720 20 H THR 4 H THR 4 11.174 -13.702 -10.815 21 HA THR 4 HA THR 4 12.887 -15.478 -12.394 22 HB THR 4 HB THR 4 9.962 -15.748 -12.984 23 HG1 THR 4 HG1 THR 4 11.316 -17.444 -11.179 24 1HG2 THR 4 HG21 THR 4 12.410 -17.506 -13.275 25 2HG2 THR 4 HG22 THR 4 10.777 -18.014 -13.701 26 3HG2 THR 4 HG23 THR 4 11.539 -16.679 -14.565 27 H LYS 5 H LYS 5 12.703 -12.659 -12.208 28 HA LYS 5 HA LYS 5 12.321 -10.729 -13.509 29 1HB LYS 5 HB2 LYS 5 13.579 -12.795 -15.057 30 2HB LYS 5 HB3 LYS 5 12.506 -11.870 -16.107 31 1HG LYS 5 HG2 LYS 5 13.558 -9.775 -15.025 32 2HG LYS 5 HG3 LYS 5 14.815 -10.868 -14.443 33 1HD LYS 5 HD2 LYS 5 15.683 -11.202 -16.534 34 2HD LYS 5 HD3 LYS 5 14.105 -11.112 -17.316 35 1HE LYS 5 HE2 LYS 5 15.060 -8.598 -16.067 36 2HE LYS 5 HE3 LYS 5 15.963 -9.139 -17.482 37 1HZ LYS 5 HZ1 LYS 5 13.007 -8.986 -17.446 38 2HZ LYS 5 HZ2 LYS 5 13.977 -7.677 -17.917 39 3HZ LYS 5 HZ3 LYS 5 14.033 -9.132 -18.793 40 H LYS 6 H LYS 6 9.905 -12.108 -12.772 41 HA LYS 6 HA LYS 6 8.183 -12.353 -15.099 42 1HB LYS 6 HB2 LYS 6 7.531 -12.053 -12.151 43 2HB LYS 6 HB3 LYS 6 6.352 -12.436 -13.406 44 1HG LYS 6 HG2 LYS 6 8.071 -14.361 -13.990 45 2HG LYS 6 HG3 LYS 6 8.575 -14.125 -12.315 46 1HD LYS 6 HD2 LYS 6 6.891 -15.662 -11.970 47 2HD LYS 6 HD3 LYS 6 5.932 -14.184 -11.913 48 1HE LYS 6 HE2 LYS 6 4.697 -15.312 -13.490 49 2HE LYS 6 HE3 LYS 6 5.894 -14.598 -14.569 50 1HZ LYS 6 HZ1 LYS 6 6.713 -17.082 -13.350 51 2HZ LYS 6 HZ2 LYS 6 5.375 -17.227 -14.388 52 3HZ LYS 6 HZ3 LYS 6 6.828 -16.574 -14.967 53 H LEU 7 H LEU 7 7.771 -10.098 -12.355 54 HA LEU 7 HA LEU 7 6.435 -8.170 -14.082 55 1HB LEU 7 HB2 LEU 7 7.417 -7.952 -11.218 56 2HB LEU 7 HB3 LEU 7 6.419 -6.746 -12.032 57 HG LEU 7 HG LEU 7 5.684 -9.609 -11.376 58 1HD1 LEU 7 HD11 LEU 7 4.698 -6.872 -10.560 59 2HD1 LEU 7 HD12 LEU 7 3.696 -8.310 -10.364 60 3HD1 LEU 7 HD13 LEU 7 5.243 -8.193 -9.524 61 1HD2 LEU 7 HD21 LEU 7 4.684 -7.765 -13.470 62 2HD2 LEU 7 HD22 LEU 7 4.584 -9.524 -13.378 63 3HD2 LEU 7 HD23 LEU 7 3.439 -8.527 -12.479 64 H HIS 8 H HIS 8 7.482 -5.727 -13.183 65 HA HIS 8 HA HIS 8 10.356 -5.792 -13.926 66 1HB HIS 8 HB2 HIS 8 8.456 -5.210 -15.818 67 2HB HIS 8 HB3 HIS 8 8.857 -3.606 -15.205 68 HD1 HIS 8 HD1 HIS 8 10.485 -2.681 -16.876 69 HD2 HIS 8 HD2 HIS 8 11.382 -6.620 -15.849 70 HE1 HIS 8 HE1 HIS 8 12.681 -3.234 -18.009 71 H LYS 9 H LYS 9 11.386 -4.661 -12.359 72 HA LYS 9 HA LYS 9 9.887 -2.713 -10.734 73 1HB LYS 9 HB2 LYS 9 12.585 -4.025 -10.560 74 2HB LYS 9 HB3 LYS 9 12.275 -2.556 -9.635 75 1HG LYS 9 HG2 LYS 9 10.017 -4.268 -9.313 76 2HG LYS 9 HG3 LYS 9 11.466 -5.231 -9.023 77 1HD LYS 9 HD2 LYS 9 12.211 -3.121 -7.618 78 2HD LYS 9 HD3 LYS 9 10.475 -2.811 -7.555 79 1HE LYS 9 HE2 LYS 9 10.032 -4.813 -6.409 80 2HE LYS 9 HE3 LYS 9 11.560 -5.544 -6.903 81 1HZ LYS 9 HZ1 LYS 9 11.521 -3.122 -5.221 82 2HZ LYS 9 HZ2 LYS 9 11.340 -4.660 -4.523 83 3HZ LYS 9 HZ3 LYS 9 12.748 -4.284 -5.391 84 H GLU 10 H GLU 10 9.890 -0.574 -11.197 85 HA GLU 10 HA GLU 10 12.158 0.499 -12.830 86 1HB GLU 10 HB2 GLU 10 9.286 1.477 -12.853 87 2HB GLU 10 HB3 GLU 10 10.599 2.032 -13.893 88 1HG GLU 10 HG2 GLU 10 10.106 0.405 -15.361 89 2HG GLU 10 HG3 GLU 10 10.480 -0.801 -14.129 90 HA PRO 11 HA PRO 11 12.772 3.435 -9.611 91 1HB PRO 11 HB2 PRO 11 13.767 5.527 -11.062 92 2HB PRO 11 HB3 PRO 11 14.683 4.046 -10.741 93 1HG PRO 11 HG2 PRO 11 13.284 4.899 -13.244 94 2HG PRO 11 HG3 PRO 11 14.777 3.965 -13.055 95 1HD PRO 11 HD2 PRO 11 12.298 2.856 -13.655 96 2HD PRO 11 HD3 PRO 11 13.653 1.962 -12.929 97 H ALA 12 H ALA 12 12.087 5.604 -8.861 98 HA ALA 12 HA ALA 12 10.032 7.024 -10.400 99 1HB ALA 12 HB1 ALA 12 9.255 4.949 -8.614 100 2HB ALA 12 HB2 ALA 12 8.839 6.481 -7.844 101 3HB ALA 12 HB3 ALA 12 8.212 6.101 -9.449 102 H THR 13 H THR 13 9.005 8.730 -8.659 103 HA THR 13 HA THR 13 11.275 9.693 -6.968 104 HB THR 13 HB THR 13 9.516 11.625 -8.458 105 HG1 THR 13 HG1 THR 13 11.787 10.230 -9.408 106 1HG2 THR 13 HG21 THR 13 12.063 11.636 -6.938 107 2HG2 THR 13 HG22 THR 13 12.003 12.681 -8.357 108 3HG2 THR 13 HG23 THR 13 10.820 12.882 -7.064 109 H LEU 14 H LEU 14 10.634 10.848 -5.086 110 HA LEU 14 HA LEU 14 7.905 10.206 -4.179 111 1HB LEU 14 HB2 LEU 14 9.789 9.846 -2.641 112 2HB LEU 14 HB3 LEU 14 10.219 11.553 -2.750 113 HG LEU 14 HG LEU 14 8.140 12.216 -1.721 114 1HD1 LEU 14 HD11 LEU 14 7.362 9.503 -2.526 115 2HD1 LEU 14 HD12 LEU 14 6.853 9.913 -0.888 116 3HD1 LEU 14 HD13 LEU 14 6.354 10.923 -2.245 117 1HD2 LEU 14 HD21 LEU 14 10.080 11.171 -0.323 118 2HD2 LEU 14 HD22 LEU 14 8.519 11.415 0.461 119 3HD2 LEU 14 HD23 LEU 14 8.980 9.811 -0.109 120 H ILE 15 H ILE 15 6.430 11.622 -5.073 121 HA ILE 15 HA ILE 15 7.069 14.483 -5.308 122 HB ILE 15 HB ILE 15 4.440 13.058 -5.816 123 1HG1 ILE 15 HG12 ILE 15 6.594 13.795 -7.818 124 2HG1 ILE 15 HG13 ILE 15 6.420 12.178 -7.135 125 1HG2 ILE 15 HG21 ILE 15 5.038 15.771 -5.682 126 2HG2 ILE 15 HG22 ILE 15 5.132 15.413 -7.407 127 3HG2 ILE 15 HG23 ILE 15 3.653 15.061 -6.512 128 1HD1 ILE 15 HD11 ILE 15 4.106 12.065 -7.995 129 2HD1 ILE 15 HD12 ILE 15 4.290 13.675 -8.690 130 3HD1 ILE 15 HD13 ILE 15 5.259 12.335 -9.302 131 H LYS 16 H LYS 16 4.535 12.576 -3.628 132 HA LYS 16 HA LYS 16 4.800 13.959 -1.154 133 1HB LYS 16 HB2 LYS 16 3.949 15.842 -2.647 134 2HB LYS 16 HB3 LYS 16 2.436 14.942 -2.767 135 1HG LYS 16 HG2 LYS 16 2.054 15.090 -0.408 136 2HG LYS 16 HG3 LYS 16 3.689 15.681 -0.115 137 1HD LYS 16 HD2 LYS 16 3.161 17.817 -0.706 138 2HD LYS 16 HD3 LYS 16 2.109 17.294 -2.022 139 1HE LYS 16 HE2 LYS 16 0.260 17.399 -0.723 140 2HE LYS 16 HE3 LYS 16 1.061 16.580 0.618 141 1HZ LYS 16 HZ1 LYS 16 2.145 19.166 0.255 142 2HZ LYS 16 HZ2 LYS 16 0.461 19.271 0.415 143 3HZ LYS 16 HZ3 LYS 16 1.382 18.510 1.623 144 H ALA 17 H ALA 17 4.156 12.259 0.085 145 HA ALA 17 HA ALA 17 2.269 10.272 -0.786 146 1HB ALA 17 HB1 ALA 17 3.441 10.971 1.913 147 2HB ALA 17 HB2 ALA 17 2.285 9.654 1.709 148 3HB ALA 17 HB3 ALA 17 3.840 9.601 0.876 149 H ILE 18 H ILE 18 0.060 10.212 -0.557 150 HA ILE 18 HA ILE 18 -1.230 12.626 0.591 151 HB ILE 18 HB ILE 18 -2.479 10.346 -0.970 152 1HG1 ILE 18 HG12 ILE 18 -1.923 13.059 -2.121 153 2HG1 ILE 18 HG13 ILE 18 -0.603 11.891 -2.039 154 1HG2 ILE 18 HG21 ILE 18 -3.431 12.943 0.156 155 2HG2 ILE 18 HG22 ILE 18 -4.060 12.459 -1.419 156 3HG2 ILE 18 HG23 ILE 18 -4.290 11.413 -0.019 157 1HD1 ILE 18 HD11 ILE 18 -3.049 10.656 -3.016 158 2HD1 ILE 18 HD12 ILE 18 -2.575 12.026 -4.021 159 3HD1 ILE 18 HD13 ILE 18 -1.448 10.696 -3.754 160 H ASP 19 H ASP 19 -1.343 9.069 0.876 161 HA ASP 19 HA ASP 19 -2.342 9.429 3.649 162 1HB ASP 19 HB2 ASP 19 -4.070 8.747 1.580 163 2HB ASP 19 HB3 ASP 19 -3.655 7.191 2.301 164 H GLY 20 H GLY 20 -2.828 6.585 3.975 165 1HA GLY 20 HA2 GLY 20 -0.022 5.732 4.249 166 2HA GLY 20 HA3 GLY 20 -1.428 4.898 4.913 167 H ASP 21 H ASP 21 -2.583 5.322 2.018 168 HA ASP 21 HA ASP 21 -1.124 3.011 0.802 169 1HB ASP 21 HB2 ASP 21 -3.813 3.105 1.696 170 2HB ASP 21 HB3 ASP 21 -3.865 3.115 -0.067 171 H THR 22 H THR 22 -1.811 6.218 0.460 172 HA THR 22 HA THR 22 -1.726 6.007 -2.524 173 HB THR 22 HB THR 22 -2.739 8.543 -1.428 174 HG1 THR 22 HG1 THR 22 -4.699 7.692 -0.787 175 1HG2 THR 22 HG21 THR 22 -2.861 7.020 -3.803 176 2HG2 THR 22 HG22 THR 22 -4.511 7.096 -3.186 177 3HG2 THR 22 HG23 THR 22 -3.617 8.584 -3.497 178 H VAL 23 H VAL 23 -0.081 7.154 -3.506 179 HA VAL 23 HA VAL 23 1.290 9.321 -2.073 180 HB VAL 23 HB VAL 23 3.529 8.157 -2.318 181 1HG1 VAL 23 HG11 VAL 23 2.022 8.306 -0.196 182 2HG1 VAL 23 HG12 VAL 23 1.716 6.593 -0.488 183 3HG1 VAL 23 HG13 VAL 23 3.361 7.157 -0.194 184 1HG2 VAL 23 HG21 VAL 23 1.740 6.134 -3.427 185 2HG2 VAL 23 HG22 VAL 23 3.496 6.246 -3.529 186 3HG2 VAL 23 HG23 VAL 23 2.741 5.482 -2.130 187 H LYS 24 H LYS 24 1.645 10.810 -3.636 188 HA LYS 24 HA LYS 24 1.565 10.086 -6.457 189 1HB LYS 24 HB2 LYS 24 2.327 12.721 -5.158 190 2HB LYS 24 HB3 LYS 24 1.910 12.480 -6.855 191 1HG LYS 24 HG2 LYS 24 -0.285 11.407 -5.776 192 2HG LYS 24 HG3 LYS 24 0.141 12.490 -4.450 193 1HD LYS 24 HD2 LYS 24 -0.289 14.379 -5.672 194 2HD LYS 24 HD3 LYS 24 0.266 13.653 -7.181 195 1HE LYS 24 HE2 LYS 24 -1.809 12.913 -7.723 196 2HE LYS 24 HE3 LYS 24 -2.147 12.385 -6.074 197 1HZ LYS 24 HZ1 LYS 24 -2.264 14.918 -5.621 198 2HZ LYS 24 HZ2 LYS 24 -2.537 15.031 -7.295 199 3HZ LYS 24 HZ3 LYS 24 -3.594 14.129 -6.319 200 H LEU 25 H LEU 25 3.302 9.546 -7.702 201 HA LEU 25 HA LEU 25 6.013 10.381 -6.779 202 1HB LEU 25 HB2 LEU 25 5.712 7.674 -8.006 203 2HB LEU 25 HB3 LEU 25 6.880 8.240 -6.813 204 HG LEU 25 HG LEU 25 3.935 7.857 -6.216 205 1HD1 LEU 25 HD11 LEU 25 6.066 5.911 -6.495 206 2HD1 LEU 25 HD12 LEU 25 5.472 5.949 -4.834 207 3HD1 LEU 25 HD13 LEU 25 4.355 5.643 -6.164 208 1HD2 LEU 25 HD21 LEU 25 5.905 9.274 -4.873 209 2HD2 LEU 25 HD22 LEU 25 4.424 8.650 -4.149 210 3HD2 LEU 25 HD23 LEU 25 5.914 7.711 -4.056 211 H MET 26 H MET 26 7.588 10.449 -8.538 212 HA MET 26 HA MET 26 6.307 11.119 -11.110 213 1HB MET 26 HB2 MET 26 8.349 12.300 -9.798 214 2HB MET 26 HB3 MET 26 9.269 11.189 -10.814 215 1HG MET 26 HG2 MET 26 9.056 12.738 -12.448 216 2HG MET 26 HG3 MET 26 7.375 12.219 -12.560 217 1HE MET 26 HE1 MET 26 7.182 14.630 -13.669 218 2HE MET 26 HE2 MET 26 7.411 16.149 -12.806 219 3HE MET 26 HE3 MET 26 8.805 15.137 -13.203 220 H TYR 27 H TYR 27 6.275 9.723 -12.814 221 HA TYR 27 HA TYR 27 8.225 7.459 -12.803 222 1HB TYR 27 HB2 TYR 27 6.121 6.523 -12.074 223 2HB TYR 27 HB3 TYR 27 5.248 7.355 -13.362 224 HD1 TYR 27 HD1 TYR 27 7.857 4.772 -12.709 225 HD2 TYR 27 HD2 TYR 27 5.051 6.400 -15.524 226 HE1 TYR 27 HE1 TYR 27 8.266 2.853 -14.225 227 HE2 TYR 27 HE2 TYR 27 5.461 4.481 -17.042 228 HH TYR 27 HH TYR 27 7.980 2.110 -16.365 229 H LYS 28 H LYS 28 9.466 7.700 -14.593 230 HA LYS 28 HA LYS 28 10.104 8.312 -16.774 231 1HB LYS 28 HB2 LYS 28 7.369 7.089 -17.086 232 2HB LYS 28 HB3 LYS 28 8.228 7.725 -18.490 233 1HG LYS 28 HG2 LYS 28 10.207 6.302 -17.800 234 2HG LYS 28 HG3 LYS 28 9.151 5.542 -16.607 235 1HD LYS 28 HD2 LYS 28 7.592 4.891 -18.422 236 2HD LYS 28 HD3 LYS 28 8.687 5.608 -19.604 237 1HE LYS 28 HE2 LYS 28 10.387 3.982 -18.188 238 2HE LYS 28 HE3 LYS 28 8.893 3.044 -18.168 239 1HZ LYS 28 HZ1 LYS 28 9.784 4.275 -20.682 240 2HZ LYS 28 HZ2 LYS 28 10.531 2.843 -20.154 241 3HZ LYS 28 HZ3 LYS 28 8.859 2.872 -20.437 242 H GLY 29 H GLY 29 9.195 10.489 -15.222 243 1HA GLY 29 HA2 GLY 29 8.627 12.744 -15.568 244 2HA GLY 29 HA3 GLY 29 8.564 12.393 -17.297 245 H GLN 30 H GLN 30 6.657 10.686 -14.875 246 HA GLN 30 HA GLN 30 4.232 12.201 -15.664 247 1HB GLN 30 HB2 GLN 30 4.493 10.250 -17.242 248 2HB GLN 30 HB3 GLN 30 4.366 9.177 -15.846 249 1HG GLN 30 HG2 GLN 30 2.123 9.449 -15.709 250 2HG GLN 30 HG3 GLN 30 2.242 11.196 -15.930 251 1HE2 GLN 30 HE21 GLN 30 0.308 9.375 -17.267 252 2HE2 GLN 30 HE22 GLN 30 0.596 9.525 -18.933 253 HA PRO 31 HA PRO 31 4.202 11.341 -11.184 254 1HB PRO 31 HB2 PRO 31 2.873 13.653 -10.574 255 2HB PRO 31 HB3 PRO 31 4.628 13.584 -10.820 256 1HG PRO 31 HG2 PRO 31 2.496 14.560 -12.685 257 2HG PRO 31 HG3 PRO 31 4.139 15.175 -12.435 258 1HD PRO 31 HD2 PRO 31 3.403 13.560 -14.561 259 2HD PRO 31 HD3 PRO 31 5.062 13.682 -13.932 260 H MET 32 H MET 32 2.623 9.948 -10.501 261 HA MET 32 HA MET 32 -0.220 10.659 -11.031 262 1HB MET 32 HB2 MET 32 1.068 7.968 -11.578 263 2HB MET 32 HB3 MET 32 -0.673 8.253 -11.575 264 1HG MET 32 HG2 MET 32 0.322 10.274 -13.210 265 2HG MET 32 HG3 MET 32 1.300 8.870 -13.637 266 1HE MET 32 HE1 MET 32 -0.010 6.682 -12.968 267 2HE MET 32 HE2 MET 32 -1.754 6.727 -12.723 268 3HE MET 32 HE3 MET 32 -1.086 6.122 -14.246 269 H THR 33 H THR 33 -1.692 9.265 -9.627 270 HA THR 33 HA THR 33 -0.529 9.130 -6.920 271 HB THR 33 HB THR 33 -3.367 8.433 -7.690 272 HG1 THR 33 HG1 THR 33 -3.835 10.518 -7.809 273 1HG2 THR 33 HG21 THR 33 -1.863 9.133 -5.217 274 2HG2 THR 33 HG22 THR 33 -3.515 9.735 -5.351 275 3HG2 THR 33 HG23 THR 33 -3.197 8.003 -5.439 276 H PHE 34 H PHE 34 0.521 7.249 -6.423 277 HA PHE 34 HA PHE 34 -0.363 4.726 -7.693 278 1HB PHE 34 HB2 PHE 34 2.064 5.641 -6.211 279 2HB PHE 34 HB3 PHE 34 1.664 3.926 -6.151 280 HD1 PHE 34 HD1 PHE 34 1.552 2.578 -8.220 281 HD2 PHE 34 HD2 PHE 34 2.787 6.692 -8.269 282 HE1 PHE 34 HE1 PHE 34 2.483 2.272 -10.498 283 HE2 PHE 34 HE2 PHE 34 3.718 6.385 -10.547 284 HZ PHE 34 HZ PHE 34 3.565 4.175 -11.661 285 H ARG 35 H ARG 35 -1.607 3.252 -6.636 286 HA ARG 35 HA ARG 35 -2.070 3.688 -3.713 287 1HB ARG 35 HB2 ARG 35 -4.044 3.933 -5.292 288 2HB ARG 35 HB3 ARG 35 -3.876 2.213 -5.647 289 1HG ARG 35 HG2 ARG 35 -5.304 1.967 -3.885 290 2HG ARG 35 HG3 ARG 35 -3.835 2.161 -2.926 291 1HD ARG 35 HD2 ARG 35 -4.252 4.519 -2.631 292 2HD ARG 35 HD3 ARG 35 -5.589 4.478 -3.781 293 HE ARG 35 HE ARG 35 -6.111 2.632 -1.653 294 1HH1 ARG 35 HH11 ARG 35 -7.341 5.343 -2.998 295 2HH1 ARG 35 HH12 ARG 35 -7.857 6.103 -1.531 296 1HH2 ARG 35 HH21 ARG 35 -6.161 3.886 0.527 297 2HH2 ARG 35 HH22 ARG 35 -7.187 5.280 0.465 298 H LEU 36 H LEU 36 -1.551 2.022 -2.340 299 HA LEU 36 HA LEU 36 0.064 -0.142 -3.192 300 1HB LEU 36 HB2 LEU 36 -1.670 -0.026 -0.705 301 2HB LEU 36 HB3 LEU 36 -0.265 -1.062 -0.951 302 HG LEU 36 HG LEU 36 -0.342 1.945 -0.664 303 1HD1 LEU 36 HD11 LEU 36 -0.017 0.048 1.213 304 2HD1 LEU 36 HD12 LEU 36 1.652 0.162 0.652 305 3HD1 LEU 36 HD13 LEU 36 0.833 1.593 1.280 306 1HD2 LEU 36 HD21 LEU 36 1.923 0.211 -1.704 307 2HD2 LEU 36 HD22 LEU 36 1.067 1.457 -2.609 308 3HD2 LEU 36 HD23 LEU 36 2.086 1.903 -1.241 309 H LEU 37 H LEU 37 -0.425 -2.134 -4.008 310 HA LEU 37 HA LEU 37 -3.261 -2.709 -4.589 311 1HB LEU 37 HB2 LEU 37 -0.632 -3.557 -5.649 312 2HB LEU 37 HB3 LEU 37 -1.885 -4.796 -5.658 313 HG LEU 37 HG LEU 37 -2.478 -2.025 -6.673 314 1HD1 LEU 37 HD11 LEU 37 -0.438 -2.897 -7.842 315 2HD1 LEU 37 HD12 LEU 37 -1.369 -4.314 -8.325 316 3HD1 LEU 37 HD13 LEU 37 -1.827 -2.717 -8.914 317 1HD2 LEU 37 HD21 LEU 37 -3.773 -4.649 -6.564 318 2HD2 LEU 37 HD22 LEU 37 -4.485 -3.061 -6.850 319 3HD2 LEU 37 HD23 LEU 37 -3.775 -3.963 -8.189 320 H LEU 38 H LEU 38 -4.355 -4.546 -3.853 321 HA LEU 38 HA LEU 38 -4.823 -6.401 -2.497 322 1HB LEU 38 HB2 LEU 38 -1.860 -6.599 -1.947 323 2HB LEU 38 HB3 LEU 38 -3.063 -7.889 -1.920 324 HG LEU 38 HG LEU 38 -1.981 -6.416 -4.329 325 1HD1 LEU 38 HD11 LEU 38 -0.937 -8.559 -3.188 326 2HD1 LEU 38 HD12 LEU 38 -2.252 -9.387 -4.023 327 3HD1 LEU 38 HD13 LEU 38 -1.065 -8.463 -4.944 328 1HD2 LEU 38 HD21 LEU 38 -4.482 -8.066 -3.986 329 2HD2 LEU 38 HD22 LEU 38 -4.280 -6.532 -4.835 330 3HD2 LEU 38 HD23 LEU 38 -3.641 -8.019 -5.536 331 H VAL 39 H VAL 39 -3.726 -3.506 -1.429 332 HA VAL 39 HA VAL 39 -4.271 -4.294 1.387 333 HB VAL 39 HB VAL 39 -2.383 -3.117 2.253 334 1HG1 VAL 39 HG11 VAL 39 -1.668 -4.778 -0.175 335 2HG1 VAL 39 HG12 VAL 39 -0.465 -4.209 0.984 336 3HG1 VAL 39 HG13 VAL 39 -1.744 -5.305 1.506 337 1HG2 VAL 39 HG21 VAL 39 -1.988 -2.162 -0.597 338 2HG2 VAL 39 HG22 VAL 39 -2.410 -1.173 0.801 339 3HG2 VAL 39 HG23 VAL 39 -0.814 -1.915 0.696 340 H ASP 40 H ASP 40 -4.987 -2.495 2.715 341 HA ASP 40 HA ASP 40 -5.615 0.037 1.327 342 1HB ASP 40 HB2 ASP 40 -7.593 -1.201 0.784 343 2HB ASP 40 HB3 ASP 40 -7.700 -1.871 2.413 344 H THR 41 H THR 41 -4.684 1.414 2.779 345 HA THR 41 HA THR 41 -4.489 0.828 5.604 346 HB THR 41 HB THR 41 -3.537 3.064 5.793 347 HG1 THR 41 HG1 THR 41 -3.573 4.034 3.414 348 1HG2 THR 41 HG21 THR 41 -2.575 1.034 4.149 349 2HG2 THR 41 HG22 THR 41 -2.404 2.488 3.167 350 3HG2 THR 41 HG23 THR 41 -1.645 2.403 4.757 351 HA PRO 42 HA PRO 42 -8.325 2.452 7.047 352 1HB PRO 42 HB2 PRO 42 -7.567 3.190 9.566 353 2HB PRO 42 HB3 PRO 42 -7.747 1.499 9.071 354 1HG PRO 42 HG2 PRO 42 -5.255 3.096 9.468 355 2HG PRO 42 HG3 PRO 42 -5.539 1.367 9.733 356 1HD PRO 42 HD2 PRO 42 -4.242 2.455 7.505 357 2HD PRO 42 HD3 PRO 42 -4.956 0.829 7.580 358 H GLU 43 H GLU 43 -9.399 4.453 7.172 359 HA GLU 43 HA GLU 43 -8.044 6.801 6.266 360 1HB GLU 43 HB2 GLU 43 -10.202 7.954 7.079 361 2HB GLU 43 HB3 GLU 43 -10.379 6.704 5.847 362 1HG GLU 43 HG2 GLU 43 -10.418 5.568 8.527 363 2HG GLU 43 HG3 GLU 43 -11.681 6.782 8.321 364 H THR 44 H THR 44 -8.135 8.922 7.589 365 HA THR 44 HA THR 44 -6.961 8.347 10.265 366 HB THR 44 HB THR 44 -6.254 10.813 10.062 367 HG1 THR 44 HG1 THR 44 -7.607 11.469 8.441 368 1HG2 THR 44 HG21 THR 44 -4.813 8.773 9.612 369 2HG2 THR 44 HG22 THR 44 -5.203 8.972 7.904 370 3HG2 THR 44 HG23 THR 44 -4.323 10.237 8.760 371 H LYS 45 H LYS 45 -8.606 8.318 11.759 372 HA LYS 45 HA LYS 45 -10.583 10.560 11.655 373 1HB LYS 45 HB2 LYS 45 -10.952 7.755 11.921 374 2HB LYS 45 HB3 LYS 45 -11.362 8.477 13.477 375 1HG LYS 45 HG2 LYS 45 -13.240 9.427 12.653 376 2HG LYS 45 HG3 LYS 45 -12.397 10.026 11.222 377 1HD LYS 45 HD2 LYS 45 -13.210 8.345 9.963 378 2HD LYS 45 HD3 LYS 45 -12.641 7.141 11.120 379 1HE LYS 45 HE2 LYS 45 -14.704 6.873 11.993 380 2HE LYS 45 HE3 LYS 45 -14.945 8.615 12.132 381 1HZ LYS 45 HZ1 LYS 45 -14.991 7.900 9.419 382 2HZ LYS 45 HZ2 LYS 45 -16.054 6.877 10.258 383 3HZ LYS 45 HZ3 LYS 45 -16.243 8.559 10.359 384 H HIS 46 H HIS 46 -8.534 11.626 12.731 385 HA HIS 46 HA HIS 46 -8.360 10.973 15.616 386 1HB HIS 46 HB2 HIS 46 -6.672 12.429 13.655 387 2HB HIS 46 HB3 HIS 46 -6.667 13.066 15.300 388 HD1 HIS 46 HD1 HIS 46 -5.691 10.057 13.285 389 HD2 HIS 46 HD2 HIS 46 -5.525 11.327 17.251 390 HE1 HIS 46 HE1 HIS 46 -4.174 8.429 14.495 391 HA PRO 47 HA PRO 47 -11.214 14.287 16.466 392 1HB PRO 47 HB2 PRO 47 -11.016 14.151 19.189 393 2HB PRO 47 HB3 PRO 47 -11.926 12.974 18.226 394 1HG PRO 47 HG2 PRO 47 -9.252 12.685 19.522 395 2HG PRO 47 HG3 PRO 47 -10.501 11.463 19.230 396 1HD PRO 47 HD2 PRO 47 -8.188 11.797 17.690 397 2HD PRO 47 HD3 PRO 47 -9.645 10.922 17.174 398 H LYS 48 H LYS 48 -8.791 14.422 19.072 399 HA LYS 48 HA LYS 48 -7.556 16.839 17.951 400 1HB LYS 48 HB2 LYS 48 -9.464 17.886 18.975 401 2HB LYS 48 HB3 LYS 48 -9.289 16.912 20.436 402 1HG LYS 48 HG2 LYS 48 -7.090 17.979 20.863 403 2HG LYS 48 HG3 LYS 48 -7.317 18.989 19.435 404 1HD LYS 48 HD2 LYS 48 -9.478 18.955 21.506 405 2HD LYS 48 HD3 LYS 48 -8.009 19.871 21.842 406 1HE LYS 48 HE2 LYS 48 -8.970 20.324 19.126 407 2HE LYS 48 HE3 LYS 48 -10.181 20.756 20.333 408 1HZ LYS 48 HZ1 LYS 48 -7.458 21.592 20.902 409 2HZ LYS 48 HZ2 LYS 48 -8.209 22.373 19.594 410 3HZ LYS 48 HZ3 LYS 48 -8.922 22.423 21.132 411 H LYS 49 H LYS 49 -7.929 14.677 20.747 412 HA LYS 49 HA LYS 49 -4.978 14.919 21.173 413 1HB LYS 49 HB2 LYS 49 -6.641 15.926 22.952 414 2HB LYS 49 HB3 LYS 49 -6.845 14.238 23.424 415 1HG LYS 49 HG2 LYS 49 -4.050 14.740 23.051 416 2HG LYS 49 HG3 LYS 49 -4.708 15.995 24.102 417 1HD LYS 49 HD2 LYS 49 -5.499 14.418 25.682 418 2HD LYS 49 HD3 LYS 49 -5.348 13.079 24.543 419 1HE LYS 49 HE2 LYS 49 -2.883 13.362 24.563 420 2HE LYS 49 HE3 LYS 49 -3.055 14.657 25.748 421 1HZ LYS 49 HZ1 LYS 49 -4.171 11.958 26.211 422 2HZ LYS 49 HZ2 LYS 49 -2.571 12.344 26.624 423 3HZ LYS 49 HZ3 LYS 49 -3.860 13.182 27.347 424 H GLY 50 H GLY 50 -5.361 13.012 19.516 425 1HA GLY 50 HA2 GLY 50 -4.916 10.697 19.289 426 2HA GLY 50 HA3 GLY 50 -5.036 10.539 21.041 427 H VAL 51 H VAL 51 -6.247 8.543 19.798 428 HA VAL 51 HA VAL 51 -9.139 9.301 19.697 429 HB VAL 51 HB VAL 51 -7.875 6.851 18.442 430 1HG1 VAL 51 HG11 VAL 51 -10.535 7.579 18.960 431 2HG1 VAL 51 HG12 VAL 51 -10.295 7.932 17.249 432 3HG1 VAL 51 HG13 VAL 51 -9.988 6.308 17.865 433 1HG2 VAL 51 HG21 VAL 51 -8.178 9.664 17.458 434 2HG2 VAL 51 HG22 VAL 51 -6.885 8.506 17.150 435 3HG2 VAL 51 HG23 VAL 51 -8.429 8.347 16.313 436 H GLU 52 H GLU 52 -8.950 5.983 19.707 437 HA GLU 52 HA GLU 52 -8.494 5.568 22.556 438 1HB GLU 52 HB2 GLU 52 -11.050 4.593 22.509 439 2HB GLU 52 HB3 GLU 52 -10.607 6.168 23.163 440 1HG GLU 52 HG2 GLU 52 -10.980 7.132 20.853 441 2HG GLU 52 HG3 GLU 52 -11.645 5.568 20.380 442 H LYS 53 H LYS 53 -10.605 4.039 20.092 443 HA LYS 53 HA LYS 53 -10.087 1.384 20.661 444 1HB LYS 53 HB2 LYS 53 -10.265 1.019 18.108 445 2HB LYS 53 HB3 LYS 53 -11.632 1.786 18.917 446 1HG LYS 53 HG2 LYS 53 -10.029 3.946 18.299 447 2HG LYS 53 HG3 LYS 53 -9.782 2.885 16.914 448 1HD LYS 53 HD2 LYS 53 -12.545 2.782 17.468 449 2HD LYS 53 HD3 LYS 53 -12.095 4.486 17.577 450 1HE LYS 53 HE2 LYS 53 -11.265 4.529 15.365 451 2HE LYS 53 HE3 LYS 53 -11.167 2.771 15.276 452 1HZ LYS 53 HZ1 LYS 53 -13.674 4.352 15.458 453 2HZ LYS 53 HZ2 LYS 53 -13.070 3.615 14.052 454 3HZ LYS 53 HZ3 LYS 53 -13.575 2.662 15.364 455 H TYR 54 H TYR 54 -8.106 3.441 18.503 456 HA TYR 54 HA TYR 54 -5.634 2.391 19.379 457 1HB TYR 54 HB2 TYR 54 -5.438 0.403 18.342 458 2HB TYR 54 HB3 TYR 54 -7.074 0.573 17.722 459 HD1 TYR 54 HD1 TYR 54 -3.500 1.373 17.004 460 HD2 TYR 54 HD2 TYR 54 -7.475 0.984 15.423 461 HE1 TYR 54 HE1 TYR 54 -2.604 1.582 14.700 462 HE2 TYR 54 HE2 TYR 54 -6.580 1.194 13.120 463 HH TYR 54 HH TYR 54 -4.249 0.712 12.003 464 H GLY 55 H GLY 55 -4.748 4.371 19.098 465 1HA GLY 55 HA2 GLY 55 -5.253 6.358 17.270 466 2HA GLY 55 HA3 GLY 55 -3.628 6.058 17.878 467 HA PRO 56 HA PRO 56 -4.253 4.049 13.500 468 1HB PRO 56 HB2 PRO 56 -5.744 5.663 11.877 469 2HB PRO 56 HB3 PRO 56 -6.447 4.363 12.855 470 1HG PRO 56 HG2 PRO 56 -6.489 7.313 13.325 471 2HG PRO 56 HG3 PRO 56 -7.708 6.092 13.727 472 1HD PRO 56 HD2 PRO 56 -5.903 7.207 15.545 473 2HD PRO 56 HD3 PRO 56 -6.775 5.677 15.782 474 H GLU 57 H GLU 57 -2.086 4.593 13.101 475 HA GLU 57 HA GLU 57 -1.558 7.372 12.128 476 1HB GLU 57 HB2 GLU 57 -0.059 5.518 13.859 477 2HB GLU 57 HB3 GLU 57 0.917 6.272 12.598 478 1HG GLU 57 HG2 GLU 57 0.967 8.185 13.777 479 2HG GLU 57 HG3 GLU 57 -0.793 8.278 13.698 480 H ALA 58 H ALA 58 -2.640 5.194 10.491 481 HA ALA 58 HA ALA 58 -0.643 3.905 8.927 482 1HB ALA 58 HB1 ALA 58 -3.511 4.639 8.529 483 2HB ALA 58 HB2 ALA 58 -2.577 4.192 7.102 484 3HB ALA 58 HB3 ALA 58 -2.736 3.058 8.444 485 H SER 59 H SER 59 -2.377 6.976 8.306 486 HA SER 59 HA SER 59 -1.044 7.708 5.937 487 1HB SER 59 HB2 SER 59 -2.036 9.758 6.221 488 2HB SER 59 HB3 SER 59 -2.936 8.891 7.463 489 HG SER 59 HG SER 59 -1.833 10.939 8.064 490 H ALA 60 H ALA 60 -0.164 8.655 9.280 491 HA ALA 60 HA ALA 60 2.278 9.936 8.604 492 1HB ALA 60 HB1 ALA 60 1.520 8.444 11.135 493 2HB ALA 60 HB2 ALA 60 2.912 9.517 10.977 494 3HB ALA 60 HB3 ALA 60 1.278 10.164 10.824 495 H PHE 61 H PHE 61 1.449 6.560 8.816 496 HA PHE 61 HA PHE 61 4.089 5.501 9.171 497 1HB PHE 61 HB2 PHE 61 1.888 4.232 9.366 498 2HB PHE 61 HB3 PHE 61 1.858 4.190 7.604 499 HD1 PHE 61 HD1 PHE 61 3.585 2.995 10.631 500 HD2 PHE 61 HD2 PHE 61 3.482 2.876 6.339 501 HE1 PHE 61 HE1 PHE 61 5.124 1.051 10.648 502 HE2 PHE 61 HE2 PHE 61 5.021 0.932 6.356 503 HZ PHE 61 HZ PHE 61 5.842 0.019 8.510 504 H THR 62 H THR 62 2.187 5.447 6.153 505 HA THR 62 HA THR 62 4.420 5.003 4.447 506 HB THR 62 HB THR 62 1.732 6.299 3.905 507 HG1 THR 62 HG1 THR 62 2.747 3.761 3.177 508 1HG2 THR 62 HG21 THR 62 4.106 5.858 2.170 509 2HG2 THR 62 HG22 THR 62 2.538 5.428 1.487 510 3HG2 THR 62 HG23 THR 62 2.833 7.073 2.050 511 H LYS 63 H LYS 63 3.355 7.857 6.071 512 HA LYS 63 HA LYS 63 4.497 9.805 4.285 513 1HB LYS 63 HB2 LYS 63 2.842 10.218 6.200 514 2HB LYS 63 HB3 LYS 63 4.233 10.113 7.279 515 1HG LYS 63 HG2 LYS 63 5.308 11.979 6.211 516 2HG LYS 63 HG3 LYS 63 4.122 11.986 4.904 517 1HD LYS 63 HD2 LYS 63 2.394 12.298 6.866 518 2HD LYS 63 HD3 LYS 63 3.804 12.880 7.751 519 1HE LYS 63 HE2 LYS 63 3.843 14.824 6.601 520 2HE LYS 63 HE3 LYS 63 3.655 13.996 5.056 521 1HZ LYS 63 HZ1 LYS 63 1.235 13.718 6.310 522 2HZ LYS 63 HZ2 LYS 63 1.696 15.318 6.644 523 3HZ LYS 63 HZ3 LYS 63 1.594 14.778 5.036 524 H LYS 64 H LYS 64 5.698 8.529 7.395 525 HA LYS 64 HA LYS 64 8.329 9.654 7.068 526 1HB LYS 64 HB2 LYS 64 6.916 8.188 9.064 527 2HB LYS 64 HB3 LYS 64 8.415 7.319 8.731 528 1HG LYS 64 HG2 LYS 64 9.469 8.826 10.033 529 2HG LYS 64 HG3 LYS 64 9.157 10.021 8.773 530 1HD LYS 64 HD2 LYS 64 7.701 11.104 10.103 531 2HD LYS 64 HD3 LYS 64 6.767 9.627 10.336 532 1HE LYS 64 HE2 LYS 64 9.175 10.544 11.929 533 2HE LYS 64 HE3 LYS 64 7.522 10.338 12.511 534 1HZ LYS 64 HZ1 LYS 64 8.154 7.925 11.411 535 2HZ LYS 64 HZ2 LYS 64 9.591 8.392 12.188 536 3HZ LYS 64 HZ3 LYS 64 8.146 8.294 13.069 537 H MET 65 H MET 65 6.811 6.722 5.951 538 HA MET 65 HA MET 65 9.176 5.176 5.472 539 1HB MET 65 HB2 MET 65 6.342 5.099 4.631 540 2HB MET 65 HB3 MET 65 7.476 4.342 3.512 541 1HG MET 65 HG2 MET 65 7.999 3.679 6.325 542 2HG MET 65 HG3 MET 65 6.422 3.131 5.758 543 1HE MET 65 HE1 MET 65 9.548 2.529 6.495 544 2HE MET 65 HE2 MET 65 9.912 0.937 5.815 545 3HE MET 65 HE3 MET 65 10.532 2.393 5.041 546 H VAL 66 H VAL 66 7.161 6.607 2.915 547 HA VAL 66 HA VAL 66 9.221 6.638 0.963 548 HB VAL 66 HB VAL 66 7.777 8.169 -0.292 549 1HG1 VAL 66 HG11 VAL 66 7.178 5.681 0.168 550 2HG1 VAL 66 HG12 VAL 66 5.928 6.334 1.225 551 3HG1 VAL 66 HG13 VAL 66 5.922 6.727 -0.494 552 1HG2 VAL 66 HG21 VAL 66 6.627 8.615 2.445 553 2HG2 VAL 66 HG22 VAL 66 7.010 9.794 1.192 554 3HG2 VAL 66 HG23 VAL 66 5.574 8.781 1.040 555 H GLU 67 H GLU 67 8.293 9.077 3.366 556 HA GLU 67 HA GLU 67 9.863 11.228 2.371 557 1HB GLU 67 HB2 GLU 67 8.877 10.460 5.106 558 2HB GLU 67 HB3 GLU 67 9.981 11.822 4.921 559 1HG GLU 67 HG2 GLU 67 8.351 12.628 3.072 560 2HG GLU 67 HG3 GLU 67 7.207 11.492 3.787 561 H ASN 68 H ASN 68 10.731 8.444 4.360 562 HA ASN 68 HA ASN 68 13.527 9.432 4.533 563 1HB ASN 68 HB2 ASN 68 12.125 7.067 5.813 564 2HB ASN 68 HB3 ASN 68 13.837 7.436 6.029 565 1HD2 ASN 68 HD21 ASN 68 11.926 7.462 8.214 566 2HD2 ASN 68 HD22 ASN 68 11.817 9.059 8.781 567 H ALA 69 H ALA 69 11.679 7.663 2.408 568 HA ALA 69 HA ALA 69 13.658 5.590 1.791 569 1HB ALA 69 HB1 ALA 69 11.081 5.491 1.429 570 2HB ALA 69 HB2 ALA 69 11.409 6.419 -0.035 571 3HB ALA 69 HB3 ALA 69 12.127 4.822 0.178 572 H LYS 70 H LYS 70 15.563 6.384 0.977 573 HA LYS 70 HA LYS 70 15.763 8.765 -0.617 574 1HB LYS 70 HB2 LYS 70 18.066 7.703 -1.189 575 2HB LYS 70 HB3 LYS 70 17.754 8.164 0.482 576 1HG LYS 70 HG2 LYS 70 16.831 5.454 -0.138 577 2HG LYS 70 HG3 LYS 70 18.568 5.655 -0.372 578 1HD LYS 70 HD2 LYS 70 18.115 6.998 2.003 579 2HD LYS 70 HD3 LYS 70 17.014 5.624 2.114 580 1HE LYS 70 HE2 LYS 70 19.891 5.275 1.271 581 2HE LYS 70 HE3 LYS 70 19.418 5.266 2.971 582 1HZ LYS 70 HZ1 LYS 70 17.737 3.620 1.338 583 2HZ LYS 70 HZ2 LYS 70 19.360 3.129 1.290 584 3HZ LYS 70 HZ3 LYS 70 18.552 3.242 2.780 585 H LYS 71 H LYS 71 15.475 5.333 -1.405 586 HA LYS 71 HA LYS 71 15.268 6.114 -4.287 587 1HB LYS 71 HB2 LYS 71 16.258 3.541 -3.026 588 2HB LYS 71 HB3 LYS 71 15.937 3.723 -4.751 589 1HG LYS 71 HG2 LYS 71 17.489 5.921 -4.278 590 2HG LYS 71 HG3 LYS 71 18.178 4.768 -3.133 591 1HD LYS 71 HD2 LYS 71 19.117 3.542 -4.783 592 2HD LYS 71 HD3 LYS 71 17.633 3.555 -5.737 593 1HE LYS 71 HE2 LYS 71 18.175 5.904 -6.437 594 2HE LYS 71 HE3 LYS 71 19.723 5.747 -5.607 595 1HZ LYS 71 HZ1 LYS 71 18.861 3.791 -7.646 596 2HZ LYS 71 HZ2 LYS 71 19.655 5.225 -8.082 597 3HZ LYS 71 HZ3 LYS 71 20.429 4.101 -7.071 598 H ILE 72 H ILE 72 13.308 5.743 -5.205 599 HA ILE 72 HA ILE 72 11.439 3.890 -3.783 600 HB ILE 72 HB ILE 72 10.786 6.366 -5.410 601 1HG1 ILE 72 HG12 ILE 72 9.771 6.612 -2.824 602 2HG1 ILE 72 HG13 ILE 72 11.366 5.901 -2.583 603 1HG2 ILE 72 HG21 ILE 72 9.196 4.250 -5.308 604 2HG2 ILE 72 HG22 ILE 72 8.826 4.875 -3.701 605 3HG2 ILE 72 HG23 ILE 72 8.534 5.874 -5.124 606 1HD1 ILE 72 HD11 ILE 72 12.314 7.681 -4.082 607 2HD1 ILE 72 HD12 ILE 72 10.722 8.438 -4.109 608 3HD1 ILE 72 HD13 ILE 72 11.613 8.311 -2.592 609 H GLU 73 H GLU 73 10.778 2.166 -4.988 610 HA GLU 73 HA GLU 73 11.026 2.382 -7.961 611 1HB GLU 73 HB2 GLU 73 12.020 0.283 -6.078 612 2HB GLU 73 HB3 GLU 73 11.426 -0.235 -7.656 613 1HG GLU 73 HG2 GLU 73 13.831 0.203 -7.784 614 2HG GLU 73 HG3 GLU 73 12.955 1.400 -8.740 615 H VAL 74 H VAL 74 9.123 1.976 -8.977 616 HA VAL 74 HA VAL 74 6.899 0.823 -7.400 617 HB VAL 74 HB VAL 74 5.481 1.562 -9.261 618 1HG1 VAL 74 HG11 VAL 74 7.512 3.483 -8.142 619 2HG1 VAL 74 HG12 VAL 74 6.272 4.050 -9.261 620 3HG1 VAL 74 HG13 VAL 74 5.806 3.312 -7.728 621 1HG2 VAL 74 HG21 VAL 74 7.321 1.043 -10.986 622 2HG2 VAL 74 HG22 VAL 74 6.362 2.497 -11.267 623 3HG2 VAL 74 HG23 VAL 74 7.983 2.629 -10.585 624 H GLU 75 H GLU 75 5.855 -1.110 -7.992 625 HA GLU 75 HA GLU 75 7.240 -2.700 -10.116 626 1HB GLU 75 HB2 GLU 75 7.759 -3.579 -7.885 627 2HB GLU 75 HB3 GLU 75 6.038 -3.674 -7.507 628 1HG GLU 75 HG2 GLU 75 5.670 -5.400 -9.086 629 2HG GLU 75 HG3 GLU 75 7.206 -5.096 -9.899 630 H PHE 76 H PHE 76 5.594 -1.922 -11.623 631 HA PHE 76 HA PHE 76 2.808 -2.105 -11.296 632 1HB PHE 76 HB2 PHE 76 4.605 -2.402 -13.697 633 2HB PHE 76 HB3 PHE 76 2.861 -2.607 -13.853 634 HD1 PHE 76 HD1 PHE 76 1.512 -0.695 -12.406 635 HD2 PHE 76 HD2 PHE 76 5.394 -0.276 -14.197 636 HE1 PHE 76 HE1 PHE 76 1.225 1.768 -12.449 637 HE2 PHE 76 HE2 PHE 76 5.108 2.187 -14.241 638 HZ PHE 76 HZ PHE 76 3.024 3.209 -13.367 639 H ASP 77 H ASP 77 1.358 -3.800 -11.310 640 HA ASP 77 HA ASP 77 2.444 -6.510 -11.090 641 1HB ASP 77 HB2 ASP 77 0.388 -5.394 -9.847 642 2HB ASP 77 HB3 ASP 77 -0.496 -5.947 -11.270 643 H LYS 78 H LYS 78 0.726 -8.169 -12.320 644 HA LYS 78 HA LYS 78 1.296 -7.674 -15.169 645 1HB LYS 78 HB2 LYS 78 0.480 -10.000 -15.473 646 2HB LYS 78 HB3 LYS 78 1.745 -9.905 -14.247 647 1HG LYS 78 HG2 LYS 78 -0.536 -9.475 -12.762 648 2HG LYS 78 HG3 LYS 78 -1.085 -10.647 -13.960 649 1HD LYS 78 HD2 LYS 78 1.508 -11.451 -13.069 650 2HD LYS 78 HD3 LYS 78 0.521 -11.118 -11.645 651 1HE LYS 78 HE2 LYS 78 -0.435 -13.137 -11.945 652 2HE LYS 78 HE3 LYS 78 -1.190 -12.482 -13.399 653 1HZ LYS 78 HZ1 LYS 78 1.583 -13.443 -13.526 654 2HZ LYS 78 HZ2 LYS 78 0.316 -14.575 -13.542 655 3HZ LYS 78 HZ3 LYS 78 0.404 -13.387 -14.748 656 H GLY 79 H GLY 79 -1.353 -7.413 -12.972 657 1HA GLY 79 HA2 GLY 79 -3.450 -7.666 -14.981 658 2HA GLY 79 HA3 GLY 79 -3.661 -7.059 -13.338 659 H GLN 80 H GLN 80 -4.954 -5.295 -14.197 660 HA GLN 80 HA GLN 80 -4.044 -3.463 -16.177 661 1HB GLN 80 HB2 GLN 80 -5.739 -2.691 -13.794 662 2HB GLN 80 HB3 GLN 80 -5.774 -2.008 -15.419 663 1HG GLN 80 HG2 GLN 80 -7.504 -3.435 -15.768 664 2HG GLN 80 HG3 GLN 80 -6.251 -4.668 -15.919 665 1HE2 GLN 80 HE21 GLN 80 -7.958 -6.189 -15.024 666 2HE2 GLN 80 HE22 GLN 80 -8.194 -6.247 -13.345 667 H ARG 81 H ARG 81 -3.136 -1.304 -15.859 668 HA ARG 81 HA ARG 81 -1.375 -1.190 -13.448 669 1HB ARG 81 HB2 ARG 81 -1.025 -0.028 -16.226 670 2HB ARG 81 HB3 ARG 81 0.045 0.331 -14.871 671 1HG ARG 81 HG2 ARG 81 1.128 -1.635 -15.099 672 2HG ARG 81 HG3 ARG 81 -0.390 -2.533 -15.147 673 1HD ARG 81 HD2 ARG 81 0.670 -2.898 -17.266 674 2HD ARG 81 HD3 ARG 81 -0.636 -1.750 -17.557 675 HE ARG 81 HE ARG 81 1.237 0.032 -17.336 676 1HH1 ARG 81 HH11 ARG 81 2.674 -2.950 -17.350 677 2HH1 ARG 81 HH12 ARG 81 3.626 -2.705 -18.776 678 1HH2 ARG 81 HH21 ARG 81 2.042 0.254 -19.647 679 2HH2 ARG 81 HH22 ARG 81 3.268 -0.892 -20.076 680 H THR 82 H THR 82 -4.100 0.198 -14.851 681 HA THR 82 HA THR 82 -3.868 2.532 -13.029 682 HB THR 82 HB THR 82 -4.994 3.868 -14.984 683 HG1 THR 82 HG1 THR 82 -5.027 1.828 -16.241 684 1HG2 THR 82 HG21 THR 82 -2.739 4.291 -13.998 685 2HG2 THR 82 HG22 THR 82 -2.059 3.136 -15.144 686 3HG2 THR 82 HG23 THR 82 -2.805 4.625 -15.728 687 H ASP 83 H ASP 83 -5.801 2.940 -11.999 688 HA ASP 83 HA ASP 83 -8.069 1.165 -12.671 689 1HB ASP 83 HB2 ASP 83 -9.041 2.178 -10.545 690 2HB ASP 83 HB3 ASP 83 -7.554 1.253 -10.331 691 H LYS 84 H LYS 84 -10.267 2.593 -11.981 692 HA LYS 84 HA LYS 84 -10.689 4.284 -14.273 693 1HB LYS 84 HB2 LYS 84 -12.899 4.707 -13.293 694 2HB LYS 84 HB3 LYS 84 -12.505 2.991 -13.171 695 1HG LYS 84 HG2 LYS 84 -11.678 3.408 -10.838 696 2HG LYS 84 HG3 LYS 84 -12.266 5.065 -10.973 697 1HD LYS 84 HD2 LYS 84 -14.212 4.235 -10.154 698 2HD LYS 84 HD3 LYS 84 -14.458 3.619 -11.789 699 1HE LYS 84 HE2 LYS 84 -13.735 1.461 -11.224 700 2HE LYS 84 HE3 LYS 84 -12.862 2.025 -9.799 701 1HZ LYS 84 HZ1 LYS 84 -15.432 2.777 -9.329 702 2HZ LYS 84 HZ2 LYS 84 -15.607 1.257 -10.069 703 3HZ LYS 84 HZ3 LYS 84 -14.660 1.420 -8.667 704 H TYR 85 H TYR 85 -9.816 4.900 -10.925 705 HA TYR 85 HA TYR 85 -10.338 7.740 -10.982 706 1HB TYR 85 HB2 TYR 85 -8.547 6.028 -9.239 707 2HB TYR 85 HB3 TYR 85 -8.783 7.755 -8.981 708 HD1 TYR 85 HD1 TYR 85 -10.542 4.481 -9.157 709 HD2 TYR 85 HD2 TYR 85 -10.752 8.592 -7.929 710 HE1 TYR 85 HE1 TYR 85 -12.641 4.006 -7.925 711 HE2 TYR 85 HE2 TYR 85 -12.851 8.117 -6.698 712 HH TYR 85 HH TYR 85 -14.600 6.554 -6.581 713 H GLY 86 H GLY 86 -8.068 5.886 -12.617 714 1HA GLY 86 HA2 GLY 86 -6.321 6.618 -14.031 715 2HA GLY 86 HA3 GLY 86 -6.603 8.266 -13.462 716 H ARG 87 H ARG 87 -6.055 5.563 -11.289 717 HA ARG 87 HA ARG 87 -3.537 6.897 -10.405 718 1HB ARG 87 HB2 ARG 87 -5.058 4.771 -8.890 719 2HB ARG 87 HB3 ARG 87 -3.913 5.952 -8.257 720 1HG ARG 87 HG2 ARG 87 -5.565 7.745 -9.070 721 2HG ARG 87 HG3 ARG 87 -6.727 6.429 -9.240 722 1HD ARG 87 HD2 ARG 87 -5.201 6.798 -6.670 723 2HD ARG 87 HD3 ARG 87 -6.662 7.733 -6.987 724 HE ARG 87 HE ARG 87 -6.819 4.779 -7.250 725 1HH1 ARG 87 HH11 ARG 87 -6.784 6.977 -4.750 726 2HH1 ARG 87 HH12 ARG 87 -8.376 6.622 -4.163 727 1HH2 ARG 87 HH21 ARG 87 -9.215 4.626 -6.872 728 2HH2 ARG 87 HH22 ARG 87 -9.751 5.288 -5.365 729 H GLY 88 H GLY 88 -1.655 5.564 -10.012 730 1HA GLY 88 HA2 GLY 88 -1.552 3.211 -11.796 731 2HA GLY 88 HA3 GLY 88 -0.164 3.999 -11.043 732 H LEU 89 H LEU 89 -1.910 1.215 -10.971 733 HA LEU 89 HA LEU 89 -1.664 0.827 -8.036 734 1HB LEU 89 HB2 LEU 89 -2.822 -1.088 -10.078 735 2HB LEU 89 HB3 LEU 89 -3.044 -1.121 -8.328 736 HG LEU 89 HG LEU 89 -3.925 1.198 -10.063 737 1HD1 LEU 89 HD11 LEU 89 -5.059 -1.402 -9.917 738 2HD1 LEU 89 HD12 LEU 89 -6.099 -0.339 -8.968 739 3HD1 LEU 89 HD13 LEU 89 -5.760 0.038 -10.658 740 1HD2 LEU 89 HD21 LEU 89 -3.680 0.774 -7.247 741 2HD2 LEU 89 HD22 LEU 89 -4.344 2.180 -8.080 742 3HD2 LEU 89 HD23 LEU 89 -5.400 0.840 -7.636 743 H ALA 90 H ALA 90 0.154 -0.117 -7.279 744 HA ALA 90 HA ALA 90 1.324 -2.450 -8.513 745 1HB ALA 90 HB1 ALA 90 2.861 0.157 -8.742 746 2HB ALA 90 HB2 ALA 90 3.505 -1.442 -9.116 747 3HB ALA 90 HB3 ALA 90 2.196 -0.770 -10.087 748 H TYR 91 H TYR 91 3.686 -2.713 -7.402 749 HA TYR 91 HA TYR 91 3.181 -2.230 -4.509 750 1HB TYR 91 HB2 TYR 91 5.316 -4.003 -5.717 751 2HB TYR 91 HB3 TYR 91 4.664 -4.053 -4.079 752 HD1 TYR 91 HD1 TYR 91 2.234 -4.700 -3.739 753 HD2 TYR 91 HD2 TYR 91 4.266 -5.188 -7.492 754 HE1 TYR 91 HE1 TYR 91 0.483 -6.292 -4.482 755 HE2 TYR 91 HE2 TYR 91 2.515 -6.780 -8.233 756 HH TYR 91 HH TYR 91 0.341 -8.218 -6.159 757 H ILE 92 H ILE 92 4.234 -0.539 -3.602 758 HA ILE 92 HA ILE 92 6.513 0.695 -4.989 759 HB ILE 92 HB ILE 92 5.401 1.457 -2.282 760 1HG1 ILE 92 HG12 ILE 92 4.433 2.304 -5.034 761 2HG1 ILE 92 HG13 ILE 92 3.537 1.299 -3.895 762 1HG2 ILE 92 HG21 ILE 92 7.157 2.687 -4.362 763 2HG2 ILE 92 HG22 ILE 92 6.074 3.757 -3.471 764 3HG2 ILE 92 HG23 ILE 92 7.263 2.784 -2.604 765 1HD1 ILE 92 HD11 ILE 92 4.543 3.923 -2.897 766 2HD1 ILE 92 HD12 ILE 92 3.181 3.953 -4.017 767 3HD1 ILE 92 HD13 ILE 92 3.055 3.065 -2.498 768 H TYR 93 H TYR 93 8.629 0.871 -4.083 769 HA TYR 93 HA TYR 93 9.171 -0.911 -1.748 770 1HB TYR 93 HB2 TYR 93 10.540 -0.879 -4.441 771 2HB TYR 93 HB3 TYR 93 11.343 -1.509 -3.002 772 HD1 TYR 93 HD1 TYR 93 8.396 -1.913 -5.226 773 HD2 TYR 93 HD2 TYR 93 10.735 -3.621 -2.054 774 HE1 TYR 93 HE1 TYR 93 7.177 -4.057 -5.483 775 HE2 TYR 93 HE2 TYR 93 9.517 -5.766 -2.311 776 HH TYR 93 HH TYR 93 6.655 -6.044 -4.147 777 H ALA 94 H ALA 94 10.288 0.174 -0.207 778 HA ALA 94 HA ALA 94 11.955 2.505 -1.071 779 1HB ALA 94 HB1 ALA 94 10.120 2.155 1.295 780 2HB ALA 94 HB2 ALA 94 11.451 3.311 1.352 781 3HB ALA 94 HB3 ALA 94 10.183 3.484 0.137 782 H ASP 95 H ASP 95 14.070 2.413 -0.433 783 HA ASP 95 HA ASP 95 16.009 1.686 0.671 784 1HB ASP 95 HB2 ASP 95 14.107 0.468 2.696 785 2HB ASP 95 HB3 ASP 95 15.813 0.849 2.936 786 H GLY 96 H GLY 96 14.055 -0.123 -1.046 787 1HA GLY 96 HA2 GLY 96 14.715 -2.158 -2.146 788 2HA GLY 96 HA3 GLY 96 15.784 -2.513 -0.789 789 H LYS 97 H LYS 97 13.147 -1.589 0.790 790 HA LYS 97 HA LYS 97 12.131 -4.380 0.976 791 1HB LYS 97 HB2 LYS 97 12.910 -2.824 2.988 792 2HB LYS 97 HB3 LYS 97 11.259 -2.216 2.852 793 1HG LYS 97 HG2 LYS 97 11.215 -5.086 2.682 794 2HG LYS 97 HG3 LYS 97 12.123 -4.608 4.117 795 1HD LYS 97 HD2 LYS 97 9.586 -3.141 3.583 796 2HD LYS 97 HD3 LYS 97 9.443 -4.814 4.125 797 1HE LYS 97 HE2 LYS 97 11.448 -3.353 5.654 798 2HE LYS 97 HE3 LYS 97 9.861 -2.590 5.758 799 1HZ LYS 97 HZ1 LYS 97 9.565 -5.379 5.950 800 2HZ LYS 97 HZ2 LYS 97 10.742 -4.881 7.069 801 3HZ LYS 97 HZ3 LYS 97 9.193 -4.193 7.107 802 H MET 98 H MET 98 9.760 -4.676 1.139 803 HA MET 98 HA MET 98 8.379 -3.002 -0.838 804 1HB MET 98 HB2 MET 98 8.080 -5.455 -0.844 805 2HB MET 98 HB3 MET 98 7.388 -5.371 0.777 806 1HG MET 98 HG2 MET 98 5.715 -3.676 -0.261 807 2HG MET 98 HG3 MET 98 6.244 -4.332 -1.811 808 1HE MET 98 HE1 MET 98 5.073 -5.805 -2.915 809 2HE MET 98 HE2 MET 98 6.132 -7.090 -2.340 810 3HE MET 98 HE3 MET 98 4.380 -7.332 -2.373 811 H VAL 99 H VAL 99 7.319 -1.182 -0.232 812 HA VAL 99 HA VAL 99 6.891 -0.380 2.458 813 HB VAL 99 HB VAL 99 5.554 0.471 -0.123 814 1HG1 VAL 99 HG11 VAL 99 5.118 1.345 2.719 815 2HG1 VAL 99 HG12 VAL 99 4.986 2.527 1.418 816 3HG1 VAL 99 HG13 VAL 99 3.934 1.111 1.432 817 1HG2 VAL 99 HG21 VAL 99 8.058 0.909 0.446 818 2HG2 VAL 99 HG22 VAL 99 7.076 2.273 -0.089 819 3HG2 VAL 99 HG23 VAL 99 7.430 2.060 1.626 820 H ASN 100 H ASN 100 4.735 -2.033 0.161 821 HA ASN 100 HA ASN 100 2.395 -1.999 1.789 822 1HB ASN 100 HB2 ASN 100 3.256 -4.158 -0.160 823 2HB ASN 100 HB3 ASN 100 1.613 -3.849 0.400 824 1HD2 ASN 100 HD21 ASN 100 0.844 -3.326 -1.770 825 2HD2 ASN 100 HD22 ASN 100 1.297 -1.887 -2.546 826 H GLU 101 H GLU 101 5.084 -4.328 1.592 827 HA GLU 101 HA GLU 101 4.009 -6.215 3.448 828 1HB GLU 101 HB2 GLU 101 5.924 -6.755 2.006 829 2HB GLU 101 HB3 GLU 101 6.903 -5.545 2.836 830 1HG GLU 101 HG2 GLU 101 7.187 -6.849 4.697 831 2HG GLU 101 HG3 GLU 101 5.584 -7.572 4.562 832 H ALA 102 H ALA 102 5.964 -3.299 3.897 833 HA ALA 102 HA ALA 102 6.496 -3.638 6.678 834 1HB ALA 102 HB1 ALA 102 7.622 -1.932 5.281 835 2HB ALA 102 HB2 ALA 102 6.096 -1.058 5.133 836 3HB ALA 102 HB3 ALA 102 6.879 -1.204 6.706 837 H LEU 103 H LEU 103 3.743 -2.219 4.963 838 HA LEU 103 HA LEU 103 2.394 -1.206 7.278 839 1HB LEU 103 HB2 LEU 103 1.237 -2.200 4.654 840 2HB LEU 103 HB3 LEU 103 0.375 -1.226 5.845 841 HG LEU 103 HG LEU 103 3.010 -0.223 4.840 842 1HD1 LEU 103 HD11 LEU 103 1.109 -1.000 3.006 843 2HD1 LEU 103 HD12 LEU 103 0.674 0.685 3.295 844 3HD1 LEU 103 HD13 LEU 103 2.298 0.276 2.742 845 1HD2 LEU 103 HD21 LEU 103 0.370 1.070 5.600 846 2HD2 LEU 103 HD22 LEU 103 1.803 0.967 6.623 847 3HD2 LEU 103 HD23 LEU 103 1.837 1.943 5.155 848 H VAL 104 H VAL 104 2.114 -4.317 5.542 849 HA VAL 104 HA VAL 104 0.131 -5.419 7.303 850 HB VAL 104 HB VAL 104 2.206 -6.793 5.566 851 1HG1 VAL 104 HG11 VAL 104 -0.258 -7.855 6.981 852 2HG1 VAL 104 HG12 VAL 104 0.637 -8.743 5.749 853 3HG1 VAL 104 HG13 VAL 104 1.414 -8.330 7.277 854 1HG2 VAL 104 HG21 VAL 104 0.026 -5.237 4.842 855 2HG2 VAL 104 HG22 VAL 104 0.787 -6.464 3.828 856 3HG2 VAL 104 HG23 VAL 104 -0.624 -6.876 4.800 857 H ARG 105 H ARG 105 3.584 -5.040 7.544 858 HA ARG 105 HA ARG 105 3.988 -7.052 9.594 859 1HB ARG 105 HB2 ARG 105 5.645 -5.454 8.031 860 2HB ARG 105 HB3 ARG 105 5.856 -4.800 9.655 861 1HG ARG 105 HG2 ARG 105 6.059 -7.747 8.970 862 2HG ARG 105 HG3 ARG 105 7.446 -6.667 9.127 863 1HD ARG 105 HD2 ARG 105 6.757 -6.151 11.456 864 2HD ARG 105 HD3 ARG 105 5.416 -7.285 11.294 865 HE ARG 105 HE ARG 105 7.086 -9.101 11.098 866 1HH1 ARG 105 HH11 ARG 105 7.675 -6.471 13.084 867 2HH1 ARG 105 HH12 ARG 105 9.350 -6.820 13.355 868 1HH2 ARG 105 HH21 ARG 105 9.476 -9.355 10.992 869 2HH2 ARG 105 HH22 ARG 105 10.370 -8.453 12.170 870 H GLN 106 H GLN 106 3.198 -3.607 9.576 871 HA GLN 106 HA GLN 106 3.274 -3.542 12.539 872 1HB GLN 106 HB2 GLN 106 4.040 -1.658 10.800 873 2HB GLN 106 HB3 GLN 106 2.339 -1.207 10.929 874 1HG GLN 106 HG2 GLN 106 3.591 0.015 12.614 875 2HG GLN 106 HG3 GLN 106 2.590 -1.191 13.423 876 1HE2 GLN 106 HE21 GLN 106 4.232 -1.045 15.230 877 2HE2 GLN 106 HE22 GLN 106 5.677 -1.926 15.095 878 H GLY 107 H GLY 107 1.219 -4.963 10.713 879 1HA GLY 107 HA2 GLY 107 -1.125 -5.201 10.587 880 2HA GLY 107 HA3 GLY 107 -1.026 -4.894 12.321 881 H LEU 108 H LEU 108 -0.241 -2.623 9.707 882 HA LEU 108 HA LEU 108 -2.330 -0.809 10.827 883 1HB LEU 108 HB2 LEU 108 0.305 -0.372 9.471 884 2HB LEU 108 HB3 LEU 108 -0.949 0.855 9.281 885 HG LEU 108 HG LEU 108 0.018 -0.228 11.943 886 1HD1 LEU 108 HD11 LEU 108 1.080 1.812 10.172 887 2HD1 LEU 108 HD12 LEU 108 0.573 2.518 11.707 888 3HD1 LEU 108 HD13 LEU 108 1.745 1.200 11.686 889 1HD2 LEU 108 HD21 LEU 108 -2.011 1.839 11.096 890 2HD2 LEU 108 HD22 LEU 108 -2.199 0.522 12.253 891 3HD2 LEU 108 HD23 LEU 108 -1.231 1.934 12.675 892 H ALA 109 H ALA 109 -1.239 -2.428 7.910 893 HA ALA 109 HA ALA 109 -3.442 -1.129 6.376 894 1HB ALA 109 HB1 ALA 109 -0.942 -2.610 5.561 895 2HB ALA 109 HB2 ALA 109 -2.261 -2.343 4.421 896 3HB ALA 109 HB3 ALA 109 -1.427 -0.967 5.143 897 H LYS 110 H LYS 110 -5.106 -2.380 5.506 898 HA LYS 110 HA LYS 110 -5.183 -5.217 6.445 899 1HB LYS 110 HB2 LYS 110 -7.365 -3.209 5.839 900 2HB LYS 110 HB3 LYS 110 -7.695 -4.932 6.023 901 1HG LYS 110 HG2 LYS 110 -6.620 -4.859 8.275 902 2HG LYS 110 HG3 LYS 110 -6.427 -3.115 8.092 903 1HD LYS 110 HD2 LYS 110 -9.141 -3.814 7.469 904 2HD LYS 110 HD3 LYS 110 -8.714 -4.518 9.030 905 1HE LYS 110 HE2 LYS 110 -9.536 -2.293 9.457 906 2HE LYS 110 HE3 LYS 110 -7.788 -2.259 9.692 907 1HZ LYS 110 HZ1 LYS 110 -8.469 -1.759 6.981 908 2HZ LYS 110 HZ2 LYS 110 -9.257 -0.661 8.005 909 3HZ LYS 110 HZ3 LYS 110 -7.565 -0.804 8.056 910 H VAL 111 H VAL 111 -4.882 -6.706 4.856 911 HA VAL 111 HA VAL 111 -4.550 -6.165 2.130 912 HB VAL 111 HB VAL 111 -5.576 -8.681 3.474 913 1HG1 VAL 111 HG11 VAL 111 -5.037 -8.010 0.613 914 2HG1 VAL 111 HG12 VAL 111 -4.521 -9.595 1.192 915 3HG1 VAL 111 HG13 VAL 111 -6.218 -9.125 1.301 916 1HG2 VAL 111 HG21 VAL 111 -3.105 -7.483 3.604 917 2HG2 VAL 111 HG22 VAL 111 -3.387 -9.213 3.807 918 3HG2 VAL 111 HG23 VAL 111 -2.901 -8.577 2.235 919 H ALA 112 H ALA 112 -5.999 -5.216 0.780 920 HA ALA 112 HA ALA 112 -8.788 -6.241 0.777 921 1HB ALA 112 HB1 ALA 112 -8.053 -3.737 1.881 922 2HB ALA 112 HB2 ALA 112 -8.823 -3.394 0.332 923 3HB ALA 112 HB3 ALA 112 -9.682 -4.328 1.557 924 H TYR 113 H TYR 113 -9.970 -5.340 -1.222 925 HA TYR 113 HA TYR 113 -10.050 -5.132 -3.556 926 1HB TYR 113 HB2 TYR 113 -7.351 -3.825 -3.089 927 2HB TYR 113 HB3 TYR 113 -8.249 -3.772 -4.606 928 HD1 TYR 113 HD1 TYR 113 -10.838 -3.071 -4.275 929 HD2 TYR 113 HD2 TYR 113 -7.603 -2.010 -1.654 930 HE1 TYR 113 HE1 TYR 113 -12.152 -1.143 -3.432 931 HE2 TYR 113 HE2 TYR 113 -8.917 -0.084 -0.812 932 HH TYR 113 HH TYR 113 -12.235 0.273 -1.397 933 H VAL 114 H VAL 114 -9.816 -7.551 -3.464 934 HA VAL 114 HA VAL 114 -7.170 -8.427 -4.550 935 HB VAL 114 HB VAL 114 -9.295 -9.958 -3.027 936 1HG1 VAL 114 HG11 VAL 114 -8.273 -11.266 -4.922 937 2HG1 VAL 114 HG12 VAL 114 -6.695 -11.007 -4.179 938 3HG1 VAL 114 HG13 VAL 114 -7.929 -11.935 -3.327 939 1HG2 VAL 114 HG21 VAL 114 -6.791 -8.616 -2.349 940 2HG2 VAL 114 HG22 VAL 114 -8.043 -9.251 -1.281 941 3HG2 VAL 114 HG23 VAL 114 -6.773 -10.318 -1.885 942 H TYR 115 H TYR 115 -7.626 -8.034 -6.754 943 HA TYR 115 HA TYR 115 -9.789 -9.756 -7.892 944 1HB TYR 115 HB2 TYR 115 -8.930 -7.032 -8.914 945 2HB TYR 115 HB3 TYR 115 -10.209 -8.045 -9.585 946 HD1 TYR 115 HD1 TYR 115 -12.230 -8.593 -8.158 947 HD2 TYR 115 HD2 TYR 115 -9.331 -5.629 -7.032 948 HE1 TYR 115 HE1 TYR 115 -13.847 -7.622 -6.547 949 HE2 TYR 115 HE2 TYR 115 -10.948 -4.661 -5.421 950 HH TYR 115 HH TYR 115 -14.199 -6.072 -5.004 951 H LYS 116 H LYS 116 -9.223 -10.914 -9.731 952 HA LYS 116 HA LYS 116 -6.352 -11.156 -10.285 953 1HB LYS 116 HB2 LYS 116 -8.484 -12.538 -11.889 954 2HB LYS 116 HB3 LYS 116 -6.904 -13.142 -11.389 955 1HG LYS 116 HG2 LYS 116 -8.035 -12.733 -8.962 956 2HG LYS 116 HG3 LYS 116 -9.473 -13.118 -9.907 957 1HD LYS 116 HD2 LYS 116 -8.174 -15.135 -10.794 958 2HD LYS 116 HD3 LYS 116 -6.998 -14.810 -9.520 959 1HE LYS 116 HE2 LYS 116 -9.934 -15.051 -8.884 960 2HE LYS 116 HE3 LYS 116 -8.913 -16.485 -9.003 961 1HZ LYS 116 HZ1 LYS 116 -7.658 -14.460 -7.460 962 2HZ LYS 116 HZ2 LYS 116 -9.189 -14.829 -6.824 963 3HZ LYS 116 HZ3 LYS 116 -8.038 -16.058 -7.028 964 HA PRO 117 HA PRO 117 -5.418 -12.205 -11.936 965 1HB PRO 117 HB2 PRO 117 -3.403 -11.688 -13.702 966 2HB PRO 117 HB3 PRO 117 -4.886 -12.541 -14.159 967 1HG PRO 117 HG2 PRO 117 -4.021 -9.808 -14.864 968 2HG PRO 117 HG3 PRO 117 -5.217 -10.845 -15.654 969 1HD PRO 117 HD2 PRO 117 -5.707 -8.663 -13.831 970 2HD PRO 117 HD3 PRO 117 -6.903 -9.712 -14.622 971 H ASN 118 H ASN 118 -5.483 -9.469 -10.674 972 HA ASN 118 HA ASN 118 -2.623 -8.818 -10.327 973 1HB ASN 118 HB2 ASN 118 -5.212 -7.574 -9.424 974 2HB ASN 118 HB3 ASN 118 -3.689 -7.111 -8.663 975 1HD2 ASN 118 HD21 ASN 118 -5.601 -5.706 -10.710 976 2HD2 ASN 118 HD22 ASN 118 -4.537 -5.156 -11.913 977 H ASN 119 H ASN 119 -2.514 -11.188 -9.410 978 HA ASN 119 HA ASN 119 -2.852 -10.979 -6.450 979 1HB ASN 119 HB2 ASN 119 -3.863 -13.017 -8.325 980 2HB ASN 119 HB3 ASN 119 -3.006 -13.676 -6.933 981 1HD2 ASN 119 HD21 ASN 119 -5.727 -14.177 -7.020 982 2HD2 ASN 119 HD22 ASN 119 -6.547 -13.217 -5.886 983 H THR 120 H THR 120 -0.552 -10.611 -8.427 984 HA THR 120 HA THR 120 1.289 -12.711 -8.392 985 HB THR 120 HB THR 120 1.723 -9.730 -8.108 986 HG1 THR 120 HG1 THR 120 2.650 -10.466 -10.321 987 1HG2 THR 120 HG21 THR 120 3.670 -12.000 -8.097 988 2HG2 THR 120 HG22 THR 120 4.102 -10.530 -8.970 989 3HG2 THR 120 HG23 THR 120 3.743 -10.457 -7.245 990 H HIS 121 H HIS 121 1.447 -10.041 -6.013 991 HA HIS 121 HA HIS 121 2.739 -11.901 -4.112 992 1HB HIS 121 HB2 HIS 121 2.338 -8.912 -4.197 993 2HB HIS 121 HB3 HIS 121 2.881 -9.720 -2.725 994 HD1 HIS 121 HD1 HIS 121 4.981 -11.545 -3.339 995 HD2 HIS 121 HD2 HIS 121 4.498 -8.165 -5.731 996 HE1 HIS 121 HE1 HIS 121 7.185 -11.194 -4.537 997 H GLU 122 H GLU 122 -0.144 -12.158 -4.763 998 HA GLU 122 HA GLU 122 -1.656 -11.114 -2.517 999 1HB GLU 122 HB2 GLU 122 -2.862 -11.642 -4.533 1000 2HB GLU 122 HB3 GLU 122 -2.233 -13.290 -4.544 1001 1HG GLU 122 HG2 GLU 122 -4.528 -13.285 -3.686 1002 2HG GLU 122 HG3 GLU 122 -3.408 -13.729 -2.398 1003 H GLN 123 H GLN 123 -0.153 -14.246 -3.283 1004 HA GLN 123 HA GLN 123 -1.085 -15.623 -0.951 1005 1HB GLN 123 HB2 GLN 123 0.456 -16.267 -3.181 1006 2HB GLN 123 HB3 GLN 123 1.578 -16.440 -1.831 1007 1HG GLN 123 HG2 GLN 123 0.343 -18.131 -0.838 1008 2HG GLN 123 HG3 GLN 123 -1.175 -17.582 -1.549 1009 1HE2 GLN 123 HE21 GLN 123 0.009 -20.330 -1.680 1010 2HE2 GLN 123 HE22 GLN 123 0.195 -20.670 -3.332 1011 H LEU 124 H LEU 124 1.869 -13.739 -1.583 1012 HA LEU 124 HA LEU 124 3.085 -14.214 0.966 1013 1HB LEU 124 HB2 LEU 124 4.359 -13.299 -0.918 1014 2HB LEU 124 HB3 LEU 124 3.358 -11.848 -0.914 1015 HG LEU 124 HG LEU 124 4.125 -11.809 1.655 1016 1HD1 LEU 124 HD11 LEU 124 5.463 -13.962 1.158 1017 2HD1 LEU 124 HD12 LEU 124 6.578 -12.912 0.282 1018 3HD1 LEU 124 HD13 LEU 124 6.306 -12.666 2.008 1019 1HD2 LEU 124 HD21 LEU 124 4.464 -10.106 -0.231 1020 2HD2 LEU 124 HD22 LEU 124 5.694 -10.117 1.032 1021 3HD2 LEU 124 HD23 LEU 124 6.017 -10.890 -0.520 1022 H LEU 125 H LEU 125 1.506 -11.195 -0.154 1023 HA LEU 125 HA LEU 125 1.305 -9.892 2.294 1024 1HB LEU 125 HB2 LEU 125 -0.587 -9.967 -0.060 1025 2HB LEU 125 HB3 LEU 125 -0.900 -8.945 1.344 1026 HG LEU 125 HG LEU 125 1.559 -8.873 -0.428 1027 1HD1 LEU 125 HD11 LEU 125 -0.985 -7.516 -0.476 1028 2HD1 LEU 125 HD12 LEU 125 0.297 -6.351 -0.146 1029 3HD1 LEU 125 HD13 LEU 125 0.372 -7.357 -1.593 1030 1HD2 LEU 125 HD21 LEU 125 0.882 -7.531 2.193 1031 2HD2 LEU 125 HD22 LEU 125 2.353 -8.399 1.754 1032 3HD2 LEU 125 HD23 LEU 125 2.029 -6.810 1.064 1033 H ARG 126 H ARG 126 -0.639 -12.578 1.106 1034 HA ARG 126 HA ARG 126 -2.692 -12.450 3.105 1035 1HB ARG 126 HB2 ARG 126 -2.422 -13.914 0.888 1036 2HB ARG 126 HB3 ARG 126 -1.798 -15.095 2.039 1037 1HG ARG 126 HG2 ARG 126 -3.952 -14.397 3.420 1038 2HG ARG 126 HG3 ARG 126 -4.547 -13.928 1.826 1039 1HD ARG 126 HD2 ARG 126 -4.484 -16.107 1.011 1040 2HD ARG 126 HD3 ARG 126 -3.251 -16.612 2.164 1041 HE ARG 126 HE ARG 126 -6.150 -16.490 2.676 1042 1HH1 ARG 126 HH11 ARG 126 -3.820 -18.535 3.346 1043 2HH1 ARG 126 HH12 ARG 126 -3.896 -18.472 5.075 1044 1HH2 ARG 126 HH21 ARG 126 -5.878 -15.626 5.149 1045 2HH2 ARG 126 HH22 ARG 126 -5.063 -16.826 6.096 1046 H LYS 127 H LYS 127 0.307 -14.401 2.940 1047 HA LYS 127 HA LYS 127 0.005 -15.596 5.514 1048 1HB LYS 127 HB2 LYS 127 1.603 -16.505 3.936 1049 2HB LYS 127 HB3 LYS 127 2.491 -14.981 3.897 1050 1HG LYS 127 HG2 LYS 127 3.753 -15.761 5.592 1051 2HG LYS 127 HG3 LYS 127 2.323 -15.668 6.619 1052 1HD LYS 127 HD2 LYS 127 2.859 -17.916 6.844 1053 2HD LYS 127 HD3 LYS 127 1.745 -17.984 5.477 1054 1HE LYS 127 HE2 LYS 127 3.624 -17.958 3.908 1055 2HE LYS 127 HE3 LYS 127 4.764 -17.808 5.245 1056 1HZ LYS 127 HZ1 LYS 127 2.985 -19.996 5.628 1057 2HZ LYS 127 HZ2 LYS 127 3.814 -20.140 4.157 1058 3HZ LYS 127 HZ3 LYS 127 4.684 -19.979 5.607 1059 H SER 128 H SER 128 2.244 -12.965 4.613 1060 HA SER 128 HA SER 128 3.092 -12.162 7.114 1061 1HB SER 128 HB2 SER 128 2.283 -9.847 5.507 1062 2HB SER 128 HB3 SER 128 3.889 -10.336 6.038 1063 HG SER 128 HG SER 128 3.899 -10.588 3.865 1064 H GLU 129 H GLU 129 0.005 -11.260 5.570 1065 HA GLU 129 HA GLU 129 -0.952 -9.529 7.598 1066 1HB GLU 129 HB2 GLU 129 -2.041 -9.951 5.357 1067 2HB GLU 129 HB3 GLU 129 -2.638 -11.480 6.004 1068 1HG GLU 129 HG2 GLU 129 -3.225 -9.421 7.902 1069 2HG GLU 129 HG3 GLU 129 -3.775 -8.881 6.316 1070 H ALA 130 H ALA 130 -1.528 -13.047 7.227 1071 HA ALA 130 HA ALA 130 -2.981 -13.482 9.584 1072 1HB ALA 130 HB1 ALA 130 -1.546 -15.090 7.695 1073 2HB ALA 130 HB2 ALA 130 -1.129 -15.637 9.319 1074 3HB ALA 130 HB3 ALA 130 -2.818 -15.589 8.810 1075 H GLN 131 H GLN 131 0.410 -12.756 9.182 1076 HA GLN 131 HA GLN 131 1.258 -13.624 11.808 1077 1HB GLN 131 HB2 GLN 131 2.690 -13.038 9.695 1078 2HB GLN 131 HB3 GLN 131 2.578 -11.382 10.293 1079 1HG GLN 131 HG2 GLN 131 3.281 -12.514 12.587 1080 2HG GLN 131 HG3 GLN 131 3.943 -13.750 11.516 1081 1HE2 GLN 131 HE21 GLN 131 4.914 -12.281 9.371 1082 2HE2 GLN 131 HE22 GLN 131 6.103 -11.187 9.892 1083 H ALA 132 H ALA 132 0.446 -10.419 10.447 1084 HA ALA 132 HA ALA 132 0.655 -9.031 12.958 1085 1HB ALA 132 HB1 ALA 132 0.464 -8.182 10.426 1086 2HB ALA 132 HB2 ALA 132 -1.242 -8.070 10.860 1087 3HB ALA 132 HB3 ALA 132 -0.037 -7.169 11.779 1088 H LYS 133 H LYS 133 -1.669 -11.189 11.697 1089 HA LYS 133 HA LYS 133 -3.984 -10.132 13.106 1090 1HB LYS 133 HB2 LYS 133 -3.523 -12.103 11.159 1091 2HB LYS 133 HB3 LYS 133 -4.113 -12.982 12.569 1092 1HG LYS 133 HG2 LYS 133 -5.734 -10.703 12.434 1093 2HG LYS 133 HG3 LYS 133 -5.568 -11.234 10.760 1094 1HD LYS 133 HD2 LYS 133 -6.314 -13.082 13.042 1095 2HD LYS 133 HD3 LYS 133 -7.492 -12.304 11.984 1096 1HE LYS 133 HE2 LYS 133 -5.434 -13.534 10.386 1097 2HE LYS 133 HE3 LYS 133 -6.092 -14.720 11.512 1098 1HZ LYS 133 HZ1 LYS 133 -8.341 -13.696 10.751 1099 2HZ LYS 133 HZ2 LYS 133 -7.450 -13.227 9.383 1100 3HZ LYS 133 HZ3 LYS 133 -7.571 -14.867 9.793 1101 H LYS 134 H LYS 134 -1.931 -13.025 13.632 1102 HA LYS 134 HA LYS 134 -3.045 -13.499 16.268 1103 1HB LYS 134 HB2 LYS 134 -1.429 -15.268 16.438 1104 2HB LYS 134 HB3 LYS 134 -1.981 -15.250 14.763 1105 1HG LYS 134 HG2 LYS 134 -0.005 -14.071 14.043 1106 2HG LYS 134 HG3 LYS 134 0.505 -13.803 15.711 1107 1HD LYS 134 HD2 LYS 134 0.371 -16.446 15.834 1108 2HD LYS 134 HD3 LYS 134 0.583 -16.318 14.088 1109 1HE LYS 134 HE2 LYS 134 2.797 -16.145 14.495 1110 2HE LYS 134 HE3 LYS 134 2.454 -14.530 15.116 1111 1HZ LYS 134 HZ1 LYS 134 2.093 -15.487 17.305 1112 2HZ LYS 134 HZ2 LYS 134 2.444 -17.038 16.706 1113 3HZ LYS 134 HZ3 LYS 134 3.653 -15.850 16.738 1114 H GLU 135 H GLU 135 -0.633 -11.391 15.036 1115 HA GLU 135 HA GLU 135 0.775 -11.178 17.622 1116 1HB GLU 135 HB2 GLU 135 1.151 -9.988 14.887 1117 2HB GLU 135 HB3 GLU 135 1.929 -9.238 16.282 1118 1HG GLU 135 HG2 GLU 135 2.652 -11.734 16.809 1119 2HG GLU 135 HG3 GLU 135 2.400 -11.939 15.075 1120 H LYS 136 H LYS 136 -2.099 -10.062 16.467 1121 HA LYS 136 HA LYS 136 -3.413 -8.150 16.901 1122 1HB LYS 136 HB2 LYS 136 -2.001 -8.033 19.554 1123 2HB LYS 136 HB3 LYS 136 -3.715 -7.816 19.199 1124 1HG LYS 136 HG2 LYS 136 -3.776 -10.259 18.518 1125 2HG LYS 136 HG3 LYS 136 -2.149 -10.405 19.184 1126 1HD LYS 136 HD2 LYS 136 -3.720 -11.065 20.905 1127 2HD LYS 136 HD3 LYS 136 -3.038 -9.503 21.360 1128 1HE LYS 136 HE2 LYS 136 -5.009 -8.346 20.512 1129 2HE LYS 136 HE3 LYS 136 -5.679 -9.864 19.914 1130 1HZ LYS 136 HZ1 LYS 136 -4.983 -10.079 22.653 1131 2HZ LYS 136 HZ2 LYS 136 -6.029 -8.762 22.416 1132 3HZ LYS 136 HZ3 LYS 136 -6.488 -10.318 21.910 1133 H LEU 137 H LEU 137 -1.714 -7.094 15.309 1134 HA LEU 137 HA LEU 137 -0.128 -5.017 16.730 1135 1HB LEU 137 HB2 LEU 137 0.278 -6.554 14.351 1136 2HB LEU 137 HB3 LEU 137 0.197 -4.849 13.902 1137 HG LEU 137 HG LEU 137 2.511 -5.590 14.506 1138 1HD1 LEU 137 HD11 LEU 137 1.109 -3.523 16.214 1139 2HD1 LEU 137 HD12 LEU 137 2.858 -3.747 16.250 1140 3HD1 LEU 137 HD13 LEU 137 2.062 -3.257 14.754 1141 1HD2 LEU 137 HD21 LEU 137 1.183 -6.915 16.573 1142 2HD2 LEU 137 HD22 LEU 137 2.929 -6.731 16.416 1143 3HD2 LEU 137 HD23 LEU 137 2.005 -5.582 17.384 1144 H ASN 138 H ASN 138 -0.820 -2.946 16.775 1145 HA ASN 138 HA ASN 138 -2.264 -1.121 16.476 1146 1HB ASN 138 HB2 ASN 138 -1.785 -2.086 13.651 1147 2HB ASN 138 HB3 ASN 138 -2.637 -0.586 14.017 1148 1HD2 ASN 138 HD21 ASN 138 0.475 -2.256 14.754 1149 2HD2 ASN 138 HD22 ASN 138 1.386 -0.828 14.854 1150 H ILE 139 H ILE 139 -3.738 -2.479 13.630 1151 HA ILE 139 HA ILE 139 -6.373 -2.228 14.668 1152 HB ILE 139 HB ILE 139 -5.388 -3.966 12.390 1153 1HG1 ILE 139 HG12 ILE 139 -6.794 -1.522 11.694 1154 2HG1 ILE 139 HG13 ILE 139 -5.376 -1.168 12.683 1155 1HG2 ILE 139 HG21 ILE 139 -7.674 -4.495 13.316 1156 2HG2 ILE 139 HG22 ILE 139 -8.152 -2.845 12.914 1157 3HG2 ILE 139 HG23 ILE 139 -7.679 -3.963 11.634 1158 1HD1 ILE 139 HD11 ILE 139 -4.586 -3.169 10.841 1159 2HD1 ILE 139 HD12 ILE 139 -5.483 -1.966 9.916 1160 3HD1 ILE 139 HD13 ILE 139 -4.081 -1.480 10.869 1161 H TRP 140 H TRP 140 -4.587 -5.255 13.966 1162 HA TRP 140 HA TRP 140 -6.490 -6.937 15.287 1163 1HB TRP 140 HB2 TRP 140 -3.552 -7.585 15.028 1164 2HB TRP 140 HB3 TRP 140 -4.928 -8.687 14.964 1165 HD1 TRP 140 HD1 TRP 140 -2.729 -6.597 12.808 1166 HE1 TRP 140 HE1 TRP 140 -3.567 -6.651 10.371 1167 HE3 TRP 140 HE3 TRP 140 -7.297 -8.780 13.490 1168 HZ2 TRP 140 HZ2 TRP 140 -5.870 -7.502 8.904 1169 HZ3 TRP 140 HZ3 TRP 140 -8.792 -9.196 11.557 1170 HH2 TRP 140 HH2 TRP 140 -8.085 -8.561 9.267 1171 H SER 141 H SER 141 -4.298 -4.705 16.555 1172 HA SER 141 HA SER 141 -3.347 -5.955 18.908 1173 1HB SER 141 HB2 SER 141 -2.722 -3.651 18.116 1174 2HB SER 141 HB3 SER 141 -4.296 -3.083 18.665 1175 HG SER 141 HG SER 141 -2.518 -4.499 20.350 1176 H GLU 142 H GLU 142 -6.553 -4.911 18.040 1177 HA GLU 142 HA GLU 142 -7.470 -5.525 20.817 1178 1HB GLU 142 HB2 GLU 142 -9.595 -4.254 19.766 1179 2HB GLU 142 HB3 GLU 142 -8.285 -3.388 20.564 1180 1HG GLU 142 HG2 GLU 142 -7.172 -3.169 18.308 1181 2HG GLU 142 HG3 GLU 142 -8.638 -3.835 17.588 1182 H ASP 143 H ASP 143 -9.870 -6.347 20.733 1183 HA ASP 143 HA ASP 143 -9.937 -8.529 18.709 1184 1HB ASP 143 HB2 ASP 143 -10.190 -8.764 21.363 1185 2HB ASP 143 HB3 ASP 143 -11.876 -8.418 20.980 1186 H ASN 144 H ASN 144 -12.341 -9.136 18.121 1187 HA ASN 144 HA ASN 144 -13.452 -6.946 16.662 1188 1HB ASN 144 HB2 ASN 144 -15.506 -8.544 16.553 1189 2HB ASN 144 HB3 ASN 144 -13.993 -9.079 15.819 1190 1HD2 ASN 144 HD21 ASN 144 -14.133 -11.340 16.210 1191 2HD2 ASN 144 HD22 ASN 144 -14.243 -12.016 17.762 1192 H ALA 145 H ALA 145 -15.160 -5.558 17.136 1193 HA ALA 145 HA ALA 145 -16.814 -5.920 19.512 1194 1HB ALA 145 HB1 ALA 145 -14.594 -4.984 20.373 1195 2HB ALA 145 HB2 ALA 145 -14.981 -3.511 19.482 1196 3HB ALA 145 HB3 ALA 145 -16.034 -4.056 20.789 1197 H ASP 146 H ASP 146 -18.682 -4.653 19.357 1198 HA ASP 146 HA ASP 146 -18.804 -2.848 16.972 1199 1HB ASP 146 HB2 ASP 146 -20.770 -4.795 18.142 1200 2HB ASP 146 HB3 ASP 146 -21.363 -3.394 17.251 1201 H SER 147 H SER 147 -18.636 -0.793 17.780 1202 HA SER 147 HA SER 147 -19.302 1.144 18.934 1203 1HB SER 147 HB2 SER 147 -21.528 -0.393 20.244 1204 2HB SER 147 HB3 SER 147 -21.499 1.288 19.719 1205 HG SER 147 HG SER 147 -22.110 0.672 17.804 1206 H GLY 148 H GLY 148 -17.702 1.459 20.439 1207 1HA GLY 148 HA2 GLY 148 -17.232 1.688 22.827 1208 2HA GLY 148 HA3 GLY 148 -18.103 0.178 23.101 1209 H GLN 149 H GLN 149 -16.012 -0.317 24.299 1210 HA GLN 149 HA GLN 149 -13.969 -1.368 22.382 1211 1HB GLN 149 HB2 GLN 149 -12.282 -1.010 24.090 1212 2HB GLN 149 HB3 GLN 149 -13.174 0.496 23.872 1213 1HG GLN 149 HG2 GLN 149 -13.926 0.457 25.998 1214 2HG GLN 149 HG3 GLN 149 -14.449 -1.222 25.849 1215 1HE2 GLN 149 HE21 GLN 149 -13.315 -2.649 27.166 1216 2HE2 GLN 149 HE22 GLN 149 -11.738 -2.402 27.744 1217 HN3 PTP 150 H3 PTP 150 -9.822 -4.324 -8.651 1218 1H5M PTP 150 H51 PTP 150 -6.487 -2.857 -5.773 1219 2H5M PTP 150 H52 PTP 150 -7.207 -1.412 -5.024 1220 3H5M PTP 150 H53 PTP 150 -6.302 -1.265 -6.548 1221 H6 PTP 150 H6 PTP 150 -9.036 -0.243 -6.238 1222 H1* PTP 150 H1' PTP 150 -11.913 -0.338 -8.459 1223 2H2* PTP 150 H2' PTP 150 -12.009 -1.050 -5.533 1224 H3* PTP 150 H3' PTP 150 -12.731 1.127 -4.904 1225 H4* PTP 150 H4' PTP 150 -11.443 2.731 -6.711 1226 2H5* PTP 150 H5' PTP 150 -10.316 0.823 -4.582 Start of MODEL 4 1 1H ALA 1 H1 ALA 1 21.043 -11.142 -3.606 2 2H ALA 1 H2 ALA 1 22.157 -11.473 -4.846 3 3H ALA 1 H3 ALA 1 22.573 -10.402 -3.598 4 HA ALA 1 HA ALA 1 20.172 -9.661 -5.010 5 1HB ALA 1 HB1 ALA 1 21.948 -8.452 -3.322 6 2HB ALA 1 HB2 ALA 1 22.536 -7.889 -4.887 7 3HB ALA 1 HB3 ALA 1 20.868 -7.575 -4.406 8 H THR 2 H THR 2 20.857 -11.398 -6.769 9 HA THR 2 HA THR 2 22.262 -9.869 -8.903 10 HB THR 2 HB THR 2 23.950 -11.396 -8.078 11 HG1 THR 2 HG1 THR 2 24.274 -12.574 -9.949 12 1HG2 THR 2 HG21 THR 2 21.738 -13.448 -8.278 13 2HG2 THR 2 HG22 THR 2 23.438 -13.885 -8.109 14 3HG2 THR 2 HG23 THR 2 22.635 -12.964 -6.837 15 H SER 3 H SER 3 19.423 -10.934 -8.073 16 HA SER 3 HA SER 3 18.805 -12.452 -10.555 17 1HB SER 3 HB2 SER 3 17.037 -11.816 -8.175 18 2HB SER 3 HB3 SER 3 16.629 -12.889 -9.511 19 HG SER 3 HG SER 3 18.282 -13.282 -7.334 20 H THR 4 H THR 4 17.104 -11.702 -11.971 21 HA THR 4 HA THR 4 16.895 -8.742 -12.003 22 HB THR 4 HB THR 4 15.581 -9.901 -14.243 23 HG1 THR 4 HG1 THR 4 16.941 -11.415 -14.916 24 1HG2 THR 4 HG21 THR 4 16.998 -7.771 -13.962 25 2HG2 THR 4 HG22 THR 4 18.398 -8.820 -14.186 26 3HG2 THR 4 HG23 THR 4 17.194 -8.669 -15.467 27 H LYS 5 H LYS 5 15.121 -11.369 -10.894 28 HA LYS 5 HA LYS 5 12.903 -11.565 -10.152 29 1HB LYS 5 HB2 LYS 5 13.111 -8.561 -10.476 30 2HB LYS 5 HB3 LYS 5 11.677 -9.358 -9.828 31 1HG LYS 5 HG2 LYS 5 13.992 -10.427 -8.512 32 2HG LYS 5 HG3 LYS 5 14.064 -8.666 -8.439 33 1HD LYS 5 HD2 LYS 5 12.296 -8.539 -7.024 34 2HD LYS 5 HD3 LYS 5 11.381 -9.750 -7.924 35 1HE LYS 5 HE2 LYS 5 11.794 -10.822 -5.871 36 2HE LYS 5 HE3 LYS 5 13.074 -11.449 -6.911 37 1HZ LYS 5 HZ1 LYS 5 14.205 -9.224 -5.955 38 2HZ LYS 5 HZ2 LYS 5 13.246 -9.673 -4.631 39 3HZ LYS 5 HZ3 LYS 5 14.393 -10.760 -5.254 40 H LYS 6 H LYS 6 11.226 -12.345 -11.334 41 HA LYS 6 HA LYS 6 10.983 -12.143 -14.109 42 1HB LYS 6 HB2 LYS 6 9.645 -13.537 -12.231 43 2HB LYS 6 HB3 LYS 6 8.432 -12.305 -12.581 44 1HG LYS 6 HG2 LYS 6 7.996 -14.094 -14.103 45 2HG LYS 6 HG3 LYS 6 8.797 -12.840 -15.052 46 1HD LYS 6 HD2 LYS 6 10.663 -14.103 -15.382 47 2HD LYS 6 HD3 LYS 6 10.622 -14.766 -13.748 48 1HE LYS 6 HE2 LYS 6 10.138 -16.627 -15.119 49 2HE LYS 6 HE3 LYS 6 8.552 -16.096 -14.557 50 1HZ LYS 6 HZ1 LYS 6 9.235 -14.665 -16.876 51 2HZ LYS 6 HZ2 LYS 6 9.450 -16.319 -17.184 52 3HZ LYS 6 HZ3 LYS 6 7.946 -15.746 -16.639 53 H LEU 7 H LEU 7 9.036 -10.301 -11.726 54 HA LEU 7 HA LEU 7 7.814 -8.599 -13.669 55 1HB LEU 7 HB2 LEU 7 8.197 -8.518 -10.703 56 2HB LEU 7 HB3 LEU 7 7.682 -7.040 -11.518 57 HG LEU 7 HG LEU 7 6.313 -9.734 -11.775 58 1HD1 LEU 7 HD11 LEU 7 6.219 -8.110 -9.594 59 2HD1 LEU 7 HD12 LEU 7 4.932 -7.403 -10.570 60 3HD1 LEU 7 HD13 LEU 7 4.864 -9.108 -10.122 61 1HD2 LEU 7 HD21 LEU 7 5.827 -6.992 -12.942 62 2HD2 LEU 7 HD22 LEU 7 5.909 -8.541 -13.778 63 3HD2 LEU 7 HD23 LEU 7 4.513 -8.155 -12.772 64 H HIS 8 H HIS 8 8.234 -6.157 -13.719 65 HA HIS 8 HA HIS 8 11.183 -5.704 -13.830 66 1HB HIS 8 HB2 HIS 8 10.224 -3.682 -15.312 67 2HB HIS 8 HB3 HIS 8 10.547 -5.271 -16.001 68 HD1 HIS 8 HD1 HIS 8 8.374 -6.949 -15.980 69 HD2 HIS 8 HD2 HIS 8 7.590 -2.874 -15.580 70 HE1 HIS 8 HE1 HIS 8 5.916 -6.636 -16.513 71 H LYS 9 H LYS 9 11.980 -4.288 -12.353 72 HA LYS 9 HA LYS 9 10.045 -2.572 -10.878 73 1HB LYS 9 HB2 LYS 9 12.908 -3.359 -10.254 74 2HB LYS 9 HB3 LYS 9 11.912 -2.314 -9.241 75 1HG LYS 9 HG2 LYS 9 10.342 -4.599 -9.787 76 2HG LYS 9 HG3 LYS 9 11.948 -5.198 -9.374 77 1HD LYS 9 HD2 LYS 9 11.277 -3.050 -7.591 78 2HD LYS 9 HD3 LYS 9 9.955 -4.217 -7.602 79 1HE LYS 9 HE2 LYS 9 11.234 -5.371 -6.121 80 2HE LYS 9 HE3 LYS 9 12.150 -5.865 -7.545 81 1HZ LYS 9 HZ1 LYS 9 12.908 -3.281 -6.564 82 2HZ LYS 9 HZ2 LYS 9 13.142 -4.508 -5.415 83 3HZ LYS 9 HZ3 LYS 9 13.876 -4.621 -6.942 84 H GLU 10 H GLU 10 9.962 -0.440 -11.385 85 HA GLU 10 HA GLU 10 12.298 0.744 -12.825 86 1HB GLU 10 HB2 GLU 10 9.395 0.936 -13.194 87 2HB GLU 10 HB3 GLU 10 10.189 2.510 -13.143 88 1HG GLU 10 HG2 GLU 10 10.370 1.949 -15.408 89 2HG GLU 10 HG3 GLU 10 11.918 1.397 -14.767 90 HA PRO 11 HA PRO 11 12.773 3.711 -9.595 91 1HB PRO 11 HB2 PRO 11 13.600 5.887 -11.021 92 2HB PRO 11 HB3 PRO 11 14.596 4.438 -10.807 93 1HG PRO 11 HG2 PRO 11 13.148 5.378 -13.218 94 2HG PRO 11 HG3 PRO 11 14.573 4.337 -13.097 95 1HD PRO 11 HD2 PRO 11 11.887 3.502 -13.559 96 2HD PRO 11 HD3 PRO 11 13.289 2.457 -13.238 97 H ALA 12 H ALA 12 12.124 6.015 -8.907 98 HA ALA 12 HA ALA 12 9.802 7.185 -10.267 99 1HB ALA 12 HB1 ALA 12 9.560 5.779 -7.597 100 2HB ALA 12 HB2 ALA 12 8.412 7.009 -8.127 101 3HB ALA 12 HB3 ALA 12 8.594 5.517 -9.049 102 H THR 13 H THR 13 8.926 9.021 -8.615 103 HA THR 13 HA THR 13 11.323 10.216 -7.287 104 HB THR 13 HB THR 13 9.363 11.541 -9.171 105 HG1 THR 13 HG1 THR 13 11.695 12.253 -9.791 106 1HG2 THR 13 HG21 THR 13 10.693 12.639 -6.846 107 2HG2 THR 13 HG22 THR 13 11.276 13.416 -8.318 108 3HG2 THR 13 HG23 THR 13 9.553 13.416 -7.944 109 H LEU 14 H LEU 14 10.915 10.919 -5.242 110 HA LEU 14 HA LEU 14 8.265 10.545 -4.100 111 1HB LEU 14 HB2 LEU 14 10.403 10.154 -2.841 112 2HB LEU 14 HB3 LEU 14 10.693 11.893 -2.876 113 HG LEU 14 HG LEU 14 9.581 10.974 -0.762 114 1HD1 LEU 14 HD11 LEU 14 9.425 13.391 -1.941 115 2HD1 LEU 14 HD12 LEU 14 7.717 12.957 -1.965 116 3HD1 LEU 14 HD13 LEU 14 8.589 13.017 -0.434 117 1HD2 LEU 14 HD21 LEU 14 8.035 9.473 -2.145 118 2HD2 LEU 14 HD22 LEU 14 7.263 10.392 -0.852 119 3HD2 LEU 14 HD23 LEU 14 7.121 10.932 -2.525 120 H ILE 15 H ILE 15 6.723 12.014 -4.704 121 HA ILE 15 HA ILE 15 7.493 14.873 -4.953 122 HB ILE 15 HB ILE 15 4.853 13.532 -5.605 123 1HG1 ILE 15 HG12 ILE 15 7.099 14.323 -7.484 124 2HG1 ILE 15 HG13 ILE 15 6.832 12.674 -6.918 125 1HG2 ILE 15 HG21 ILE 15 6.030 16.270 -6.081 126 2HG2 ILE 15 HG22 ILE 15 4.741 15.638 -7.106 127 3HG2 ILE 15 HG23 ILE 15 4.467 15.855 -5.377 128 1HD1 ILE 15 HD11 ILE 15 4.687 14.298 -8.304 129 2HD1 ILE 15 HD12 ILE 15 5.788 13.226 -9.171 130 3HD1 ILE 15 HD13 ILE 15 4.680 12.566 -7.968 131 H LYS 16 H LYS 16 4.711 13.081 -3.557 132 HA LYS 16 HA LYS 16 5.002 14.352 -0.975 133 1HB LYS 16 HB2 LYS 16 3.995 16.112 -2.726 134 2HB LYS 16 HB3 LYS 16 2.499 15.271 -2.317 135 1HG LYS 16 HG2 LYS 16 3.066 15.626 0.118 136 2HG LYS 16 HG3 LYS 16 4.402 16.652 -0.407 137 1HD LYS 16 HD2 LYS 16 3.019 18.354 -1.050 138 2HD LYS 16 HD3 LYS 16 1.766 17.254 -1.625 139 1HE LYS 16 HE2 LYS 16 0.809 17.022 0.482 140 2HE LYS 16 HE3 LYS 16 2.311 17.414 1.320 141 1HZ LYS 16 HZ1 LYS 16 2.064 19.706 0.401 142 2HZ LYS 16 HZ2 LYS 16 0.504 19.275 -0.113 143 3HZ LYS 16 HZ3 LYS 16 0.883 19.267 1.540 144 H ALA 17 H ALA 17 3.874 13.138 0.511 145 HA ALA 17 HA ALA 17 2.251 10.909 -0.540 146 1HB ALA 17 HB1 ALA 17 3.947 10.485 1.216 147 2HB ALA 17 HB2 ALA 17 3.078 11.568 2.303 148 3HB ALA 17 HB3 ALA 17 2.326 10.066 1.769 149 H ILE 18 H ILE 18 0.059 10.580 -0.002 150 HA ILE 18 HA ILE 18 -1.319 12.982 1.131 151 HB ILE 18 HB ILE 18 -2.452 10.916 -0.778 152 1HG1 ILE 18 HG12 ILE 18 -1.660 13.771 -1.404 153 2HG1 ILE 18 HG13 ILE 18 -0.580 12.404 -1.685 154 1HG2 ILE 18 HG21 ILE 18 -3.901 12.382 0.875 155 2HG2 ILE 18 HG22 ILE 18 -3.565 13.659 -0.293 156 3HG2 ILE 18 HG23 ILE 18 -4.397 12.191 -0.806 157 1HD1 ILE 18 HD11 ILE 18 -3.228 11.849 -2.729 158 2HD1 ILE 18 HD12 ILE 18 -2.587 13.342 -3.415 159 3HD1 ILE 18 HD13 ILE 18 -1.678 11.839 -3.569 160 H ASP 19 H ASP 19 -1.132 9.457 1.110 161 HA ASP 19 HA ASP 19 -2.523 9.445 3.733 162 1HB ASP 19 HB2 ASP 19 -3.654 8.469 1.255 163 2HB ASP 19 HB3 ASP 19 -3.429 7.134 2.387 164 H GLY 20 H GLY 20 -2.591 6.646 4.028 165 1HA GLY 20 HA2 GLY 20 0.296 6.118 4.355 166 2HA GLY 20 HA3 GLY 20 -1.014 5.164 5.052 167 H ASP 21 H ASP 21 -2.145 5.444 2.092 168 HA ASP 21 HA ASP 21 -0.475 3.235 0.964 169 1HB ASP 21 HB2 ASP 21 -3.477 3.420 1.227 170 2HB ASP 21 HB3 ASP 21 -2.717 2.366 0.033 171 H THR 22 H THR 22 -1.725 6.314 0.512 172 HA THR 22 HA THR 22 -1.526 6.015 -2.460 173 HB THR 22 HB THR 22 -3.124 8.092 -0.934 174 HG1 THR 22 HG1 THR 22 -4.312 6.339 -0.680 175 1HG2 THR 22 HG21 THR 22 -2.792 7.400 -3.855 176 2HG2 THR 22 HG22 THR 22 -4.164 8.336 -3.259 177 3HG2 THR 22 HG23 THR 22 -2.523 8.956 -3.069 178 H VAL 23 H VAL 23 0.284 6.985 -3.231 179 HA VAL 23 HA VAL 23 1.173 9.522 -1.950 180 HB VAL 23 HB VAL 23 3.571 8.639 -2.261 181 1HG1 VAL 23 HG11 VAL 23 1.999 8.741 -0.103 182 2HG1 VAL 23 HG12 VAL 23 2.168 6.989 -0.204 183 3HG1 VAL 23 HG13 VAL 23 3.600 8.005 -0.041 184 1HG2 VAL 23 HG21 VAL 23 1.933 6.115 -2.560 185 2HG2 VAL 23 HG22 VAL 23 3.224 6.706 -3.606 186 3HG2 VAL 23 HG23 VAL 23 3.605 6.078 -2.002 187 H LYS 24 H LYS 24 1.872 11.026 -3.429 188 HA LYS 24 HA LYS 24 1.597 10.330 -6.279 189 1HB LYS 24 HB2 LYS 24 2.358 13.015 -5.109 190 2HB LYS 24 HB3 LYS 24 1.637 12.688 -6.684 191 1HG LYS 24 HG2 LYS 24 -0.375 11.756 -5.469 192 2HG LYS 24 HG3 LYS 24 0.333 12.363 -3.971 193 1HD LYS 24 HD2 LYS 24 -1.066 14.131 -4.620 194 2HD LYS 24 HD3 LYS 24 0.502 14.629 -5.258 195 1HE LYS 24 HE2 LYS 24 -0.622 13.003 -7.256 196 2HE LYS 24 HE3 LYS 24 -1.942 14.028 -6.696 197 1HZ LYS 24 HZ1 LYS 24 0.660 15.282 -7.140 198 2HZ LYS 24 HZ2 LYS 24 -0.235 14.835 -8.510 199 3HZ LYS 24 HZ3 LYS 24 -0.902 15.908 -7.375 200 H LEU 25 H LEU 25 3.325 9.737 -7.480 201 HA LEU 25 HA LEU 25 6.002 10.852 -6.781 202 1HB LEU 25 HB2 LEU 25 5.740 7.966 -7.591 203 2HB LEU 25 HB3 LEU 25 7.053 8.759 -6.722 204 HG LEU 25 HG LEU 25 4.279 8.487 -5.550 205 1HD1 LEU 25 HD11 LEU 25 6.663 6.644 -5.196 206 2HD1 LEU 25 HD12 LEU 25 5.148 6.546 -4.298 207 3HD1 LEU 25 HD13 LEU 25 5.166 6.235 -6.034 208 1HD2 LEU 25 HD21 LEU 25 6.186 10.131 -4.748 209 2HD2 LEU 25 HD22 LEU 25 5.260 9.212 -3.562 210 3HD2 LEU 25 HD23 LEU 25 6.868 8.668 -4.038 211 H MET 26 H MET 26 7.359 11.128 -8.610 212 HA MET 26 HA MET 26 5.955 11.282 -11.161 213 1HB MET 26 HB2 MET 26 7.940 12.758 -10.144 214 2HB MET 26 HB3 MET 26 8.921 11.579 -11.016 215 1HG MET 26 HG2 MET 26 8.396 12.499 -13.007 216 2HG MET 26 HG3 MET 26 6.673 12.474 -12.629 217 1HE MET 26 HE1 MET 26 8.779 14.098 -14.083 218 2HE MET 26 HE2 MET 26 8.043 15.699 -14.077 219 3HE MET 26 HE3 MET 26 9.556 15.429 -13.215 220 H TYR 27 H TYR 27 6.035 9.822 -12.812 221 HA TYR 27 HA TYR 27 8.049 7.623 -12.645 222 1HB TYR 27 HB2 TYR 27 5.935 6.726 -11.815 223 2HB TYR 27 HB3 TYR 27 5.083 7.353 -13.226 224 HD1 TYR 27 HD1 TYR 27 7.611 4.896 -12.074 225 HD2 TYR 27 HD2 TYR 27 5.163 6.223 -15.344 226 HE1 TYR 27 HE1 TYR 27 8.158 2.826 -13.324 227 HE2 TYR 27 HE2 TYR 27 5.709 4.152 -16.594 228 HH TYR 27 HH TYR 27 8.108 1.865 -15.398 229 H LYS 28 H LYS 28 9.279 7.890 -14.451 230 HA LYS 28 HA LYS 28 9.850 8.269 -16.697 231 1HB LYS 28 HB2 LYS 28 7.302 6.817 -16.705 232 2HB LYS 28 HB3 LYS 28 7.558 7.786 -18.156 233 1HG LYS 28 HG2 LYS 28 8.487 5.403 -18.225 234 2HG LYS 28 HG3 LYS 28 9.616 6.689 -18.653 235 1HD LYS 28 HD2 LYS 28 10.791 6.511 -16.648 236 2HD LYS 28 HD3 LYS 28 9.425 5.799 -15.792 237 1HE LYS 28 HE2 LYS 28 10.143 3.723 -16.281 238 2HE LYS 28 HE3 LYS 28 10.168 4.104 -18.003 239 1HZ LYS 28 HZ1 LYS 28 12.340 5.195 -17.626 240 2HZ LYS 28 HZ2 LYS 28 12.321 4.620 -16.028 241 3HZ LYS 28 HZ3 LYS 28 12.363 3.525 -17.326 242 H GLY 29 H GLY 29 8.790 10.484 -15.107 243 1HA GLY 29 HA2 GLY 29 8.427 12.767 -15.619 244 2HA GLY 29 HA3 GLY 29 8.236 12.321 -17.315 245 H GLN 30 H GLN 30 6.387 10.594 -14.939 246 HA GLN 30 HA GLN 30 4.002 12.293 -15.460 247 1HB GLN 30 HB2 GLN 30 4.205 10.321 -17.115 248 2HB GLN 30 HB3 GLN 30 3.849 9.291 -15.728 249 1HG GLN 30 HG2 GLN 30 1.885 11.099 -15.412 250 2HG GLN 30 HG3 GLN 30 2.085 11.215 -17.160 251 1HE2 GLN 30 HE21 GLN 30 -0.120 10.165 -17.288 252 2HE2 GLN 30 HE22 GLN 30 -0.235 8.480 -17.124 253 HA PRO 31 HA PRO 31 4.099 11.223 -11.037 254 1HB PRO 31 HB2 PRO 31 2.724 13.462 -10.281 255 2HB PRO 31 HB3 PRO 31 4.469 13.460 -10.596 256 1HG PRO 31 HG2 PRO 31 2.236 14.441 -12.336 257 2HG PRO 31 HG3 PRO 31 3.868 15.099 -12.123 258 1HD PRO 31 HD2 PRO 31 3.096 13.550 -14.285 259 2HD PRO 31 HD3 PRO 31 4.774 13.702 -13.718 260 H MET 32 H MET 32 2.575 9.855 -10.201 261 HA MET 32 HA MET 32 -0.301 10.427 -10.713 262 1HB MET 32 HB2 MET 32 1.217 7.930 -11.418 263 2HB MET 32 HB3 MET 32 -0.483 7.818 -10.959 264 1HG MET 32 HG2 MET 32 -1.186 9.140 -12.779 265 2HG MET 32 HG3 MET 32 0.428 9.800 -13.039 266 1HE MET 32 HE1 MET 32 -1.348 6.398 -12.590 267 2HE MET 32 HE2 MET 32 -0.312 5.301 -13.499 268 3HE MET 32 HE3 MET 32 0.319 6.115 -12.070 269 H THR 33 H THR 33 -1.706 9.167 -9.196 270 HA THR 33 HA THR 33 -0.412 9.010 -6.541 271 HB THR 33 HB THR 33 -2.864 8.599 -5.832 272 HG1 THR 33 HG1 THR 33 -4.380 8.971 -7.342 273 1HG2 THR 33 HG21 THR 33 -1.805 11.123 -7.088 274 2HG2 THR 33 HG22 THR 33 -3.411 11.082 -6.363 275 3HG2 THR 33 HG23 THR 33 -1.990 10.735 -5.378 276 H PHE 34 H PHE 34 0.596 7.056 -6.246 277 HA PHE 34 HA PHE 34 -0.550 4.606 -7.391 278 1HB PHE 34 HB2 PHE 34 1.952 5.266 -5.852 279 2HB PHE 34 HB3 PHE 34 1.451 3.589 -6.071 280 HD1 PHE 34 HD1 PHE 34 1.122 2.682 -8.397 281 HD2 PHE 34 HD2 PHE 34 2.906 6.517 -7.647 282 HE1 PHE 34 HE1 PHE 34 2.049 2.700 -10.696 283 HE2 PHE 34 HE2 PHE 34 3.835 6.535 -9.948 284 HZ PHE 34 HZ PHE 34 3.405 4.625 -11.473 285 H ARG 35 H ARG 35 -1.678 3.074 -6.273 286 HA ARG 35 HA ARG 35 -2.142 3.591 -3.363 287 1HB ARG 35 HB2 ARG 35 -4.181 3.901 -4.669 288 2HB ARG 35 HB3 ARG 35 -3.961 2.330 -5.440 289 1HG ARG 35 HG2 ARG 35 -5.410 1.695 -3.766 290 2HG ARG 35 HG3 ARG 35 -3.892 1.527 -2.883 291 1HD ARG 35 HD2 ARG 35 -4.149 3.739 -1.914 292 2HD ARG 35 HD3 ARG 35 -5.582 4.043 -2.895 293 HE ARG 35 HE ARG 35 -5.765 1.689 -1.146 294 1HH1 ARG 35 HH11 ARG 35 -6.116 5.107 -1.429 295 2HH1 ARG 35 HH12 ARG 35 -7.430 5.197 -0.305 296 1HH2 ARG 35 HH21 ARG 35 -7.553 1.777 0.241 297 2HH2 ARG 35 HH22 ARG 35 -8.243 3.314 0.640 298 H LEU 36 H LEU 36 -1.434 1.995 -2.017 299 HA LEU 36 HA LEU 36 0.076 -0.213 -2.805 300 1HB LEU 36 HB2 LEU 36 -1.712 0.047 -0.368 301 2HB LEU 36 HB3 LEU 36 -0.456 -1.178 -0.567 302 HG LEU 36 HG LEU 36 -0.101 1.823 -0.406 303 1HD1 LEU 36 HD11 LEU 36 -0.262 0.335 1.681 304 2HD1 LEU 36 HD12 LEU 36 1.270 -0.366 1.162 305 3HD1 LEU 36 HD13 LEU 36 1.173 1.352 1.548 306 1HD2 LEU 36 HD21 LEU 36 1.785 -0.342 -1.350 307 2HD2 LEU 36 HD22 LEU 36 1.382 1.177 -2.150 308 3HD2 LEU 36 HD23 LEU 36 2.377 1.183 -0.694 309 H LEU 37 H LEU 37 -0.395 -2.217 -3.620 310 HA LEU 37 HA LEU 37 -3.216 -2.775 -4.296 311 1HB LEU 37 HB2 LEU 37 -0.552 -3.691 -5.244 312 2HB LEU 37 HB3 LEU 37 -1.866 -4.862 -5.348 313 HG LEU 37 HG LEU 37 -2.320 -2.057 -6.316 314 1HD1 LEU 37 HD11 LEU 37 -0.711 -4.223 -7.654 315 2HD1 LEU 37 HD12 LEU 37 -1.648 -3.084 -8.622 316 3HD1 LEU 37 HD13 LEU 37 -0.371 -2.496 -7.555 317 1HD2 LEU 37 HD21 LEU 37 -4.003 -4.110 -6.084 318 2HD2 LEU 37 HD22 LEU 37 -4.098 -3.010 -7.460 319 3HD2 LEU 37 HD23 LEU 37 -3.288 -4.568 -7.630 320 H LEU 38 H LEU 38 -4.321 -4.647 -3.630 321 HA LEU 38 HA LEU 38 -4.831 -6.507 -2.298 322 1HB LEU 38 HB2 LEU 38 -1.878 -6.633 -1.660 323 2HB LEU 38 HB3 LEU 38 -3.055 -7.943 -1.564 324 HG LEU 38 HG LEU 38 -2.335 -6.504 -4.133 325 1HD1 LEU 38 HD11 LEU 38 -0.455 -7.849 -3.059 326 2HD1 LEU 38 HD12 LEU 38 -1.474 -9.275 -3.268 327 3HD1 LEU 38 HD13 LEU 38 -0.929 -8.366 -4.678 328 1HD2 LEU 38 HD21 LEU 38 -4.160 -8.747 -3.353 329 2HD2 LEU 38 HD22 LEU 38 -4.405 -7.469 -4.542 330 3HD2 LEU 38 HD23 LEU 38 -3.355 -8.835 -4.920 331 H VAL 39 H VAL 39 -3.970 -3.596 -1.182 332 HA VAL 39 HA VAL 39 -4.489 -4.440 1.629 333 HB VAL 39 HB VAL 39 -2.800 -2.947 2.498 334 1HG1 VAL 39 HG11 VAL 39 -2.218 -5.276 1.349 335 2HG1 VAL 39 HG12 VAL 39 -1.307 -4.241 0.250 336 3HG1 VAL 39 HG13 VAL 39 -0.944 -4.229 1.977 337 1HG2 VAL 39 HG21 VAL 39 -3.125 -1.241 0.653 338 2HG2 VAL 39 HG22 VAL 39 -1.441 -1.536 1.092 339 3HG2 VAL 39 HG23 VAL 39 -2.112 -2.258 -0.372 340 H ASP 40 H ASP 40 -5.385 -2.691 2.953 341 HA ASP 40 HA ASP 40 -6.435 -0.361 1.442 342 1HB ASP 40 HB2 ASP 40 -8.097 -2.346 1.497 343 2HB ASP 40 HB3 ASP 40 -8.260 -1.986 3.215 344 H THR 41 H THR 41 -6.502 1.474 2.715 345 HA THR 41 HA THR 41 -5.275 1.336 5.353 346 HB THR 41 HB THR 41 -5.104 3.640 5.215 347 HG1 THR 41 HG1 THR 41 -6.822 4.673 3.717 348 1HG2 THR 41 HG21 THR 41 -4.423 2.391 2.991 349 2HG2 THR 41 HG22 THR 41 -5.764 3.313 2.311 350 3HG2 THR 41 HG23 THR 41 -4.407 4.154 3.060 351 HA PRO 42 HA PRO 42 -8.927 1.222 7.820 352 1HB PRO 42 HB2 PRO 42 -8.052 2.584 10.019 353 2HB PRO 42 HB3 PRO 42 -7.480 0.959 9.603 354 1HG PRO 42 HG2 PRO 42 -6.090 3.579 9.309 355 2HG PRO 42 HG3 PRO 42 -5.411 1.969 9.599 356 1HD PRO 42 HD2 PRO 42 -5.468 3.300 7.119 357 2HD PRO 42 HD3 PRO 42 -5.153 1.568 7.360 358 H GLU 43 H GLU 43 -9.784 3.192 9.672 359 HA GLU 43 HA GLU 43 -11.232 4.987 7.985 360 1HB GLU 43 HB2 GLU 43 -11.389 4.225 10.631 361 2HB GLU 43 HB3 GLU 43 -10.848 5.900 10.755 362 1HG GLU 43 HG2 GLU 43 -13.292 5.835 10.721 363 2HG GLU 43 HG3 GLU 43 -12.700 6.580 9.236 364 H THR 44 H THR 44 -10.851 7.146 7.446 365 HA THR 44 HA THR 44 -8.511 8.532 8.586 366 HB THR 44 HB THR 44 -8.667 8.236 5.587 367 HG1 THR 44 HG1 THR 44 -7.350 6.598 7.484 368 1HG2 THR 44 HG21 THR 44 -7.257 9.961 7.081 369 2HG2 THR 44 HG22 THR 44 -6.148 8.591 7.135 370 3HG2 THR 44 HG23 THR 44 -6.622 9.282 5.583 371 H LYS 45 H LYS 45 -10.607 9.693 9.250 372 HA LYS 45 HA LYS 45 -11.969 11.225 7.165 373 1HB LYS 45 HB2 LYS 45 -12.330 10.687 9.994 374 2HB LYS 45 HB3 LYS 45 -12.491 12.412 9.662 375 1HG LYS 45 HG2 LYS 45 -14.344 12.127 8.321 376 2HG LYS 45 HG3 LYS 45 -13.842 10.521 7.790 377 1HD LYS 45 HD2 LYS 45 -14.523 10.896 10.678 378 2HD LYS 45 HD3 LYS 45 -15.847 10.829 9.514 379 1HE LYS 45 HE2 LYS 45 -14.537 8.720 8.610 380 2HE LYS 45 HE3 LYS 45 -13.851 8.711 10.235 381 1HZ LYS 45 HZ1 LYS 45 -16.761 8.948 9.836 382 2HZ LYS 45 HZ2 LYS 45 -16.010 7.424 9.805 383 3HZ LYS 45 HZ3 LYS 45 -15.911 8.389 11.196 384 H HIS 46 H HIS 46 -9.937 12.162 9.969 385 HA HIS 46 HA HIS 46 -9.240 14.645 8.471 386 1HB HIS 46 HB2 HIS 46 -9.685 14.013 11.316 387 2HB HIS 46 HB3 HIS 46 -8.271 15.021 11.009 388 HD1 HIS 46 HD1 HIS 46 -11.639 15.466 11.815 389 HD2 HIS 46 HD2 HIS 46 -9.224 17.130 8.852 390 HE1 HIS 46 HE1 HIS 46 -12.774 17.610 11.086 391 HA PRO 47 HA PRO 47 -5.189 12.845 7.995 392 1HB PRO 47 HB2 PRO 47 -4.030 15.037 6.846 393 2HB PRO 47 HB3 PRO 47 -5.138 13.964 5.972 394 1HG PRO 47 HG2 PRO 47 -5.646 16.677 7.114 395 2HG PRO 47 HG3 PRO 47 -6.327 15.921 5.663 396 1HD PRO 47 HD2 PRO 47 -7.646 16.138 8.115 397 2HD PRO 47 HD3 PRO 47 -8.066 14.983 6.832 398 H LYS 48 H LYS 48 -5.941 15.737 9.785 399 HA LYS 48 HA LYS 48 -3.402 15.391 11.323 400 1HB LYS 48 HB2 LYS 48 -4.683 17.933 10.312 401 2HB LYS 48 HB3 LYS 48 -3.578 17.942 11.687 402 1HG LYS 48 HG2 LYS 48 -1.999 16.581 10.117 403 2HG LYS 48 HG3 LYS 48 -3.016 17.213 8.822 404 1HD LYS 48 HD2 LYS 48 -2.631 19.526 9.923 405 2HD LYS 48 HD3 LYS 48 -1.299 18.742 10.774 406 1HE LYS 48 HE2 LYS 48 -0.107 18.330 8.802 407 2HE LYS 48 HE3 LYS 48 -1.548 18.451 7.791 408 1HZ LYS 48 HZ1 LYS 48 -1.173 20.873 9.171 409 2HZ LYS 48 HZ2 LYS 48 0.282 20.456 8.402 410 3HZ LYS 48 HZ3 LYS 48 -1.145 20.592 7.496 411 H LYS 49 H LYS 49 -6.675 16.830 11.381 412 HA LYS 49 HA LYS 49 -6.847 17.138 14.204 413 1HB LYS 49 HB2 LYS 49 -8.649 17.258 11.929 414 2HB LYS 49 HB3 LYS 49 -9.433 16.496 13.314 415 1HG LYS 49 HG2 LYS 49 -8.535 18.444 14.710 416 2HG LYS 49 HG3 LYS 49 -8.154 19.231 13.178 417 1HD LYS 49 HD2 LYS 49 -10.585 18.822 12.513 418 2HD LYS 49 HD3 LYS 49 -10.875 18.391 14.199 419 1HE LYS 49 HE2 LYS 49 -9.517 20.735 14.503 420 2HE LYS 49 HE3 LYS 49 -10.372 21.042 12.991 421 1HZ LYS 49 HZ1 LYS 49 -12.222 19.837 14.607 422 2HZ LYS 49 HZ2 LYS 49 -11.395 20.897 15.648 423 3HZ LYS 49 HZ3 LYS 49 -12.132 21.493 14.241 424 H GLY 50 H GLY 50 -6.813 14.309 12.270 425 1HA GLY 50 HA2 GLY 50 -6.960 12.046 12.877 426 2HA GLY 50 HA3 GLY 50 -6.915 12.574 14.561 427 H VAL 51 H VAL 51 -8.578 10.528 14.173 428 HA VAL 51 HA VAL 51 -11.236 11.779 14.500 429 HB VAL 51 HB VAL 51 -11.158 11.228 12.109 430 1HG1 VAL 51 HG11 VAL 51 -9.409 9.424 12.396 431 2HG1 VAL 51 HG12 VAL 51 -10.690 8.367 12.987 432 3HG1 VAL 51 HG13 VAL 51 -10.745 8.980 11.335 433 1HG2 VAL 51 HG21 VAL 51 -12.850 9.424 13.856 434 2HG2 VAL 51 HG22 VAL 51 -13.317 10.955 13.114 435 3HG2 VAL 51 HG23 VAL 51 -13.063 9.529 12.108 436 H GLU 52 H GLU 52 -9.258 8.841 14.598 437 HA GLU 52 HA GLU 52 -10.374 8.129 17.192 438 1HB GLU 52 HB2 GLU 52 -11.162 5.846 16.347 439 2HB GLU 52 HB3 GLU 52 -12.194 7.218 15.942 440 1HG GLU 52 HG2 GLU 52 -11.879 6.892 13.735 441 2HG GLU 52 HG3 GLU 52 -10.127 6.853 13.937 442 H LYS 53 H LYS 53 -9.517 5.712 17.674 443 HA LYS 53 HA LYS 53 -6.684 5.835 17.636 444 1HB LYS 53 HB2 LYS 53 -6.819 3.382 18.246 445 2HB LYS 53 HB3 LYS 53 -7.791 4.445 19.264 446 1HG LYS 53 HG2 LYS 53 -9.256 3.549 16.902 447 2HG LYS 53 HG3 LYS 53 -8.719 2.200 17.903 448 1HD LYS 53 HD2 LYS 53 -10.031 2.817 19.684 449 2HD LYS 53 HD3 LYS 53 -9.888 4.538 19.327 450 1HE LYS 53 HE2 LYS 53 -12.192 3.564 18.926 451 2HE LYS 53 HE3 LYS 53 -11.483 4.380 17.532 452 1HZ LYS 53 HZ1 LYS 53 -10.704 1.658 17.593 453 2HZ LYS 53 HZ2 LYS 53 -12.395 1.777 17.657 454 3HZ LYS 53 HZ3 LYS 53 -11.542 2.505 16.382 455 H TYR 54 H TYR 54 -5.162 5.088 16.187 456 HA TYR 54 HA TYR 54 -4.279 4.128 14.232 457 1HB TYR 54 HB2 TYR 54 -6.938 2.731 13.882 458 2HB TYR 54 HB3 TYR 54 -5.357 2.221 13.291 459 HD1 TYR 54 HD1 TYR 54 -3.666 2.716 15.678 460 HD2 TYR 54 HD2 TYR 54 -7.587 0.993 15.351 461 HE1 TYR 54 HE1 TYR 54 -3.286 1.453 17.778 462 HE2 TYR 54 HE2 TYR 54 -7.207 -0.270 17.452 463 HH TYR 54 HH TYR 54 -4.744 -1.085 18.683 464 H GLY 55 H GLY 55 -5.876 6.633 14.277 465 1HA GLY 55 HA2 GLY 55 -7.269 6.624 11.676 466 2HA GLY 55 HA3 GLY 55 -7.145 7.995 12.778 467 HA PRO 56 HA PRO 56 -3.784 9.535 10.379 468 1HB PRO 56 HB2 PRO 56 -2.535 11.045 12.280 469 2HB PRO 56 HB3 PRO 56 -4.102 11.482 11.577 470 1HG PRO 56 HG2 PRO 56 -3.490 10.405 14.275 471 2HG PRO 56 HG3 PRO 56 -4.856 11.397 13.742 472 1HD PRO 56 HD2 PRO 56 -4.873 8.588 14.187 473 2HD PRO 56 HD3 PRO 56 -6.164 9.552 13.438 474 H GLU 57 H GLU 57 -3.237 6.869 11.268 475 HA GLU 57 HA GLU 57 -0.415 7.066 12.229 476 1HB GLU 57 HB2 GLU 57 -2.172 5.622 13.465 477 2HB GLU 57 HB3 GLU 57 -2.037 4.525 12.091 478 1HG GLU 57 HG2 GLU 57 -0.434 3.685 13.592 479 2HG GLU 57 HG3 GLU 57 0.528 4.687 12.504 480 H ALA 58 H ALA 58 -2.496 5.549 9.772 481 HA ALA 58 HA ALA 58 -0.416 4.171 8.379 482 1HB ALA 58 HB1 ALA 58 -3.174 4.470 8.088 483 2HB ALA 58 HB2 ALA 58 -2.511 5.200 6.626 484 3HB ALA 58 HB3 ALA 58 -2.116 3.531 7.035 485 H SER 59 H SER 59 -1.941 7.331 7.637 486 HA SER 59 HA SER 59 -0.207 8.027 5.506 487 1HB SER 59 HB2 SER 59 -2.187 9.341 5.870 488 2HB SER 59 HB3 SER 59 -1.692 9.742 7.511 489 HG SER 59 HG SER 59 -0.261 10.444 5.160 490 H ALA 60 H ALA 60 0.393 7.854 8.896 491 HA ALA 60 HA ALA 60 2.679 9.692 8.838 492 1HB ALA 60 HB1 ALA 60 1.073 8.974 10.850 493 2HB ALA 60 HB2 ALA 60 2.299 7.722 11.051 494 3HB ALA 60 HB3 ALA 60 2.755 9.424 11.132 495 H PHE 61 H PHE 61 2.123 6.201 8.825 496 HA PHE 61 HA PHE 61 4.878 5.436 9.070 497 1HB PHE 61 HB2 PHE 61 2.871 3.926 9.386 498 2HB PHE 61 HB3 PHE 61 2.697 3.906 7.632 499 HD1 PHE 61 HD1 PHE 61 4.361 2.806 6.208 500 HD2 PHE 61 HD2 PHE 61 4.753 2.827 10.485 501 HE1 PHE 61 HE1 PHE 61 6.077 1.022 6.058 502 HE2 PHE 61 HE2 PHE 61 6.469 1.042 10.337 503 HZ PHE 61 HZ PHE 61 7.131 0.140 8.124 504 H THR 62 H THR 62 2.777 5.892 6.233 505 HA THR 62 HA THR 62 4.903 5.331 4.342 506 HB THR 62 HB THR 62 2.336 6.867 3.853 507 HG1 THR 62 HG1 THR 62 2.412 4.553 4.798 508 1HG2 THR 62 HG21 THR 62 4.480 6.485 2.194 509 2HG2 THR 62 HG22 THR 62 3.482 5.086 1.802 510 3HG2 THR 62 HG23 THR 62 2.822 6.712 1.639 511 H LYS 63 H LYS 63 3.646 8.230 5.899 512 HA LYS 63 HA LYS 63 4.820 10.203 4.252 513 1HB LYS 63 HB2 LYS 63 3.284 10.745 6.099 514 2HB LYS 63 HB3 LYS 63 4.502 10.230 7.267 515 1HG LYS 63 HG2 LYS 63 6.040 11.962 6.065 516 2HG LYS 63 HG3 LYS 63 4.527 12.634 5.455 517 1HD LYS 63 HD2 LYS 63 3.713 12.672 7.869 518 2HD LYS 63 HD3 LYS 63 5.374 12.315 8.343 519 1HE LYS 63 HE2 LYS 63 4.767 14.785 8.316 520 2HE LYS 63 HE3 LYS 63 6.185 14.349 7.361 521 1HZ LYS 63 HZ1 LYS 63 3.513 14.393 6.119 522 2HZ LYS 63 HZ2 LYS 63 4.385 15.838 6.318 523 3HZ LYS 63 HZ3 LYS 63 5.035 14.571 5.391 524 H LYS 64 H LYS 64 6.195 8.825 7.244 525 HA LYS 64 HA LYS 64 8.802 9.975 6.791 526 1HB LYS 64 HB2 LYS 64 7.504 8.529 8.858 527 2HB LYS 64 HB3 LYS 64 8.948 7.611 8.425 528 1HG LYS 64 HG2 LYS 64 10.284 9.132 9.410 529 2HG LYS 64 HG3 LYS 64 9.540 10.444 8.496 530 1HD LYS 64 HD2 LYS 64 8.994 11.037 10.685 531 2HD LYS 64 HD3 LYS 64 7.561 10.130 10.198 532 1HE LYS 64 HE2 LYS 64 9.668 8.400 11.257 533 2HE LYS 64 HE3 LYS 64 9.130 9.601 12.429 534 1HZ LYS 64 HZ1 LYS 64 6.807 8.916 11.821 535 2HZ LYS 64 HZ2 LYS 64 7.487 7.600 10.990 536 3HZ LYS 64 HZ3 LYS 64 7.711 7.758 12.667 537 H MET 65 H MET 65 7.234 7.074 5.676 538 HA MET 65 HA MET 65 9.643 5.594 5.071 539 1HB MET 65 HB2 MET 65 6.764 5.293 4.646 540 2HB MET 65 HB3 MET 65 7.716 4.707 3.281 541 1HG MET 65 HG2 MET 65 7.324 2.945 5.010 542 2HG MET 65 HG3 MET 65 9.036 3.284 4.758 543 1HE MET 65 HE1 MET 65 9.455 2.052 6.488 544 2HE MET 65 HE2 MET 65 10.248 3.033 7.728 545 3HE MET 65 HE3 MET 65 8.794 2.118 8.119 546 H VAL 66 H VAL 66 7.323 6.787 2.660 547 HA VAL 66 HA VAL 66 9.132 6.852 0.505 548 HB VAL 66 HB VAL 66 7.517 8.446 -0.546 549 1HG1 VAL 66 HG11 VAL 66 6.544 5.989 0.909 550 2HG1 VAL 66 HG12 VAL 66 5.466 6.913 -0.138 551 3HG1 VAL 66 HG13 VAL 66 6.923 6.174 -0.803 552 1HG2 VAL 66 HG21 VAL 66 6.913 8.926 2.241 553 2HG2 VAL 66 HG22 VAL 66 6.368 9.820 0.824 554 3HG2 VAL 66 HG23 VAL 66 5.455 8.421 1.387 555 H GLU 67 H GLU 67 8.612 9.243 3.042 556 HA GLU 67 HA GLU 67 10.019 11.381 1.690 557 1HB GLU 67 HB2 GLU 67 9.230 10.889 4.559 558 2HB GLU 67 HB3 GLU 67 10.192 12.292 4.096 559 1HG GLU 67 HG2 GLU 67 7.902 11.916 2.330 560 2HG GLU 67 HG3 GLU 67 7.412 12.119 4.013 561 H ASN 68 H ASN 68 10.978 9.024 4.177 562 HA ASN 68 HA ASN 68 13.773 9.961 4.009 563 1HB ASN 68 HB2 ASN 68 12.277 8.021 5.755 564 2HB ASN 68 HB3 ASN 68 14.040 7.965 5.686 565 1HD2 ASN 68 HD21 ASN 68 11.963 10.882 5.464 566 2HD2 ASN 68 HD22 ASN 68 12.584 11.621 6.862 567 H ALA 69 H ALA 69 11.939 8.044 2.103 568 HA ALA 69 HA ALA 69 13.649 5.722 1.813 569 1HB ALA 69 HB1 ALA 69 11.179 5.989 1.087 570 2HB ALA 69 HB2 ALA 69 11.827 6.801 -0.337 571 3HB ALA 69 HB3 ALA 69 12.259 5.124 -0.006 572 H LYS 70 H LYS 70 15.755 6.093 1.226 573 HA LYS 70 HA LYS 70 16.622 8.309 -0.374 574 1HB LYS 70 HB2 LYS 70 18.038 5.652 -0.022 575 2HB LYS 70 HB3 LYS 70 18.773 7.200 -0.436 576 1HG LYS 70 HG2 LYS 70 17.592 7.959 1.829 577 2HG LYS 70 HG3 LYS 70 17.735 6.239 2.197 578 1HD LYS 70 HD2 LYS 70 20.211 6.934 1.089 579 2HD LYS 70 HD3 LYS 70 19.803 8.281 2.152 580 1HE LYS 70 HE2 LYS 70 19.539 5.411 3.055 581 2HE LYS 70 HE3 LYS 70 21.052 6.301 3.221 582 1HZ LYS 70 HZ1 LYS 70 18.585 7.566 4.164 583 2HZ LYS 70 HZ2 LYS 70 19.253 6.322 5.105 584 3HZ LYS 70 HZ3 LYS 70 20.171 7.709 4.756 585 H LYS 71 H LYS 71 15.292 5.205 -1.175 586 HA LYS 71 HA LYS 71 15.640 5.876 -4.059 587 1HB LYS 71 HB2 LYS 71 16.620 3.505 -2.616 588 2HB LYS 71 HB3 LYS 71 15.673 3.122 -4.054 589 1HG LYS 71 HG2 LYS 71 17.685 3.424 -5.103 590 2HG LYS 71 HG3 LYS 71 17.204 5.120 -5.041 591 1HD LYS 71 HD2 LYS 71 19.501 4.843 -4.199 592 2HD LYS 71 HD3 LYS 71 18.426 5.385 -2.908 593 1HE LYS 71 HE2 LYS 71 20.049 3.424 -2.395 594 2HE LYS 71 HE3 LYS 71 18.364 3.257 -1.898 595 1HZ LYS 71 HZ1 LYS 71 19.490 2.216 -4.440 596 2HZ LYS 71 HZ2 LYS 71 19.215 1.281 -3.047 597 3HZ LYS 71 HZ3 LYS 71 17.909 1.990 -3.872 598 H ILE 72 H ILE 72 13.756 5.646 -5.207 599 HA ILE 72 HA ILE 72 11.523 4.164 -3.878 600 HB ILE 72 HB ILE 72 11.334 6.739 -5.471 601 1HG1 ILE 72 HG12 ILE 72 10.300 7.037 -2.865 602 2HG1 ILE 72 HG13 ILE 72 11.835 6.189 -2.670 603 1HG2 ILE 72 HG21 ILE 72 9.414 5.010 -5.566 604 2HG2 ILE 72 HG22 ILE 72 9.153 5.403 -3.865 605 3HG2 ILE 72 HG23 ILE 72 8.998 6.658 -5.095 606 1HD1 ILE 72 HD11 ILE 72 11.526 8.675 -4.370 607 2HD1 ILE 72 HD12 ILE 72 12.009 8.721 -2.674 608 3HD1 ILE 72 HD13 ILE 72 13.028 7.902 -3.859 609 H GLU 73 H GLU 73 11.082 2.414 -5.125 610 HA GLU 73 HA GLU 73 11.000 2.803 -8.085 611 1HB GLU 73 HB2 GLU 73 12.075 0.347 -6.663 612 2HB GLU 73 HB3 GLU 73 11.989 0.589 -8.407 613 1HG GLU 73 HG2 GLU 73 13.949 1.691 -8.396 614 2HG GLU 73 HG3 GLU 73 13.339 2.828 -7.193 615 H VAL 74 H VAL 74 9.165 1.965 -9.027 616 HA VAL 74 HA VAL 74 7.289 0.512 -7.214 617 HB VAL 74 HB VAL 74 5.559 1.213 -8.928 618 1HG1 VAL 74 HG11 VAL 74 6.368 2.502 -6.763 619 2HG1 VAL 74 HG12 VAL 74 6.967 3.671 -7.941 620 3HG1 VAL 74 HG13 VAL 74 5.250 3.270 -7.890 621 1HG2 VAL 74 HG21 VAL 74 7.499 1.584 -10.655 622 2HG2 VAL 74 HG22 VAL 74 6.115 2.676 -10.673 623 3HG2 VAL 74 HG23 VAL 74 7.622 3.175 -9.905 624 H GLU 75 H GLU 75 5.937 -1.194 -8.297 625 HA GLU 75 HA GLU 75 7.257 -2.425 -10.664 626 1HB GLU 75 HB2 GLU 75 8.160 -3.450 -8.535 627 2HB GLU 75 HB3 GLU 75 6.522 -4.006 -8.184 628 1HG GLU 75 HG2 GLU 75 6.484 -5.456 -10.040 629 2HG GLU 75 HG3 GLU 75 7.820 -4.622 -10.833 630 H PHE 76 H PHE 76 5.463 -2.052 -11.990 631 HA PHE 76 HA PHE 76 2.740 -2.401 -11.189 632 1HB PHE 76 HB2 PHE 76 4.012 -2.579 -13.938 633 2HB PHE 76 HB3 PHE 76 2.274 -2.503 -13.643 634 HD1 PHE 76 HD1 PHE 76 1.226 -0.462 -12.772 635 HD2 PHE 76 HD2 PHE 76 5.443 -0.645 -13.562 636 HE1 PHE 76 HE1 PHE 76 1.361 2.011 -12.621 637 HE2 PHE 76 HE2 PHE 76 5.579 1.827 -13.411 638 HZ PHE 76 HZ PHE 76 3.539 3.154 -12.941 639 H ASP 77 H ASP 77 1.288 -4.171 -11.747 640 HA ASP 77 HA ASP 77 2.642 -6.791 -11.532 641 1HB ASP 77 HB2 ASP 77 0.282 -5.738 -10.469 642 2HB ASP 77 HB3 ASP 77 -0.267 -6.867 -11.709 643 H LYS 78 H LYS 78 0.878 -8.472 -12.804 644 HA LYS 78 HA LYS 78 1.528 -7.952 -15.623 645 1HB LYS 78 HB2 LYS 78 0.518 -10.233 -15.955 646 2HB LYS 78 HB3 LYS 78 1.849 -10.210 -14.797 647 1HG LYS 78 HG2 LYS 78 -0.600 -9.634 -13.410 648 2HG LYS 78 HG3 LYS 78 -0.810 -11.107 -14.357 649 1HD LYS 78 HD2 LYS 78 1.759 -10.864 -12.890 650 2HD LYS 78 HD3 LYS 78 0.320 -11.085 -11.895 651 1HE LYS 78 HE2 LYS 78 0.937 -13.295 -12.349 652 2HE LYS 78 HE3 LYS 78 -0.255 -12.981 -13.608 653 1HZ LYS 78 HZ1 LYS 78 1.763 -12.213 -14.963 654 2HZ LYS 78 HZ2 LYS 78 2.684 -13.073 -13.824 655 3HZ LYS 78 HZ3 LYS 78 1.519 -13.879 -14.762 656 H GLY 79 H GLY 79 -1.151 -7.499 -13.519 657 1HA GLY 79 HA2 GLY 79 -3.191 -7.639 -15.615 658 2HA GLY 79 HA3 GLY 79 -3.444 -7.082 -13.959 659 H GLN 80 H GLN 80 -4.685 -5.311 -15.026 660 HA GLN 80 HA GLN 80 -3.641 -3.425 -16.823 661 1HB GLN 80 HB2 GLN 80 -5.459 -2.923 -14.444 662 2HB GLN 80 HB3 GLN 80 -5.223 -1.812 -15.794 663 1HG GLN 80 HG2 GLN 80 -6.304 -3.227 -17.318 664 2HG GLN 80 HG3 GLN 80 -6.060 -4.655 -16.312 665 1HE2 GLN 80 HE21 GLN 80 -8.032 -5.329 -15.473 666 2HE2 GLN 80 HE22 GLN 80 -9.257 -4.299 -14.907 667 H ARG 81 H ARG 81 -2.971 -1.114 -16.207 668 HA ARG 81 HA ARG 81 -0.937 -1.283 -14.026 669 1HB ARG 81 HB2 ARG 81 -1.049 0.489 -16.485 670 2HB ARG 81 HB3 ARG 81 0.207 0.564 -15.249 671 1HG ARG 81 HG2 ARG 81 1.197 -1.378 -15.943 672 2HG ARG 81 HG3 ARG 81 -0.339 -2.123 -16.385 673 1HD ARG 81 HD2 ARG 81 -0.204 -1.397 -18.529 674 2HD ARG 81 HD3 ARG 81 0.357 0.203 -18.043 675 HE ARG 81 HE ARG 81 2.045 -1.996 -18.879 676 1HH1 ARG 81 HH11 ARG 81 2.843 0.806 -19.301 677 2HH1 ARG 81 HH12 ARG 81 4.074 1.049 -18.106 678 1HH2 ARG 81 HH21 ARG 81 3.177 -1.731 -16.237 679 2HH2 ARG 81 HH22 ARG 81 4.263 -0.389 -16.370 680 H THR 82 H THR 82 -3.948 -0.002 -14.682 681 HA THR 82 HA THR 82 -3.635 1.956 -12.485 682 HB THR 82 HB THR 82 -4.597 3.787 -13.711 683 HG1 THR 82 HG1 THR 82 -5.430 3.540 -15.717 684 1HG2 THR 82 HG21 THR 82 -2.180 3.446 -14.050 685 2HG2 THR 82 HG22 THR 82 -2.520 2.415 -15.439 686 3HG2 THR 82 HG23 THR 82 -2.930 4.129 -15.493 687 H ASP 83 H ASP 83 -5.895 2.815 -11.868 688 HA ASP 83 HA ASP 83 -7.843 0.572 -12.181 689 1HB ASP 83 HB2 ASP 83 -8.858 1.700 -10.063 690 2HB ASP 83 HB3 ASP 83 -7.382 0.752 -9.882 691 H LYS 84 H LYS 84 -10.164 1.796 -11.406 692 HA LYS 84 HA LYS 84 -10.896 3.275 -13.771 693 1HB LYS 84 HB2 LYS 84 -13.089 3.511 -12.676 694 2HB LYS 84 HB3 LYS 84 -12.500 1.855 -12.533 695 1HG LYS 84 HG2 LYS 84 -11.502 2.614 -10.269 696 2HG LYS 84 HG3 LYS 84 -12.575 4.005 -10.419 697 1HD LYS 84 HD2 LYS 84 -14.143 1.740 -11.050 698 2HD LYS 84 HD3 LYS 84 -13.219 1.310 -9.610 699 1HE LYS 84 HE2 LYS 84 -14.065 3.964 -9.195 700 2HE LYS 84 HE3 LYS 84 -15.466 3.118 -9.854 701 1HZ LYS 84 HZ1 LYS 84 -13.984 1.646 -7.857 702 2HZ LYS 84 HZ2 LYS 84 -14.738 3.055 -7.279 703 3HZ LYS 84 HZ3 LYS 84 -15.661 1.851 -8.037 704 H TYR 85 H TYR 85 -9.468 4.217 -10.809 705 HA TYR 85 HA TYR 85 -10.496 6.988 -11.004 706 1HB TYR 85 HB2 TYR 85 -8.716 5.583 -8.999 707 2HB TYR 85 HB3 TYR 85 -9.063 7.312 -8.932 708 HD1 TYR 85 HD1 TYR 85 -11.430 8.100 -8.668 709 HD2 TYR 85 HD2 TYR 85 -10.340 3.959 -8.325 710 HE1 TYR 85 HE1 TYR 85 -13.590 7.625 -7.548 711 HE2 TYR 85 HE2 TYR 85 -12.501 3.483 -7.205 712 HH TYR 85 HH TYR 85 -14.328 5.574 -5.776 713 H GLY 86 H GLY 86 -8.195 5.305 -12.587 714 1HA GLY 86 HA2 GLY 86 -6.466 6.113 -13.979 715 2HA GLY 86 HA3 GLY 86 -6.747 7.726 -13.326 716 H ARG 87 H ARG 87 -6.481 5.880 -10.648 717 HA ARG 87 HA ARG 87 -3.851 6.860 -10.005 718 1HB ARG 87 HB2 ARG 87 -5.283 4.585 -8.613 719 2HB ARG 87 HB3 ARG 87 -4.113 5.711 -7.923 720 1HG ARG 87 HG2 ARG 87 -5.856 7.535 -8.670 721 2HG ARG 87 HG3 ARG 87 -6.986 6.181 -8.647 722 1HD ARG 87 HD2 ARG 87 -5.705 5.786 -6.281 723 2HD ARG 87 HD3 ARG 87 -5.630 7.543 -6.395 724 HE ARG 87 HE ARG 87 -8.131 7.506 -6.624 725 1HH1 ARG 87 HH11 ARG 87 -8.322 4.515 -7.093 726 2HH1 ARG 87 HH12 ARG 87 -8.862 3.959 -5.545 727 1HH2 ARG 87 HH21 ARG 87 -8.028 6.895 -3.902 728 2HH2 ARG 87 HH22 ARG 87 -8.698 5.306 -3.739 729 H GLY 88 H GLY 88 -1.908 5.587 -9.685 730 1HA GLY 88 HA2 GLY 88 -1.677 3.411 -11.663 731 2HA GLY 88 HA3 GLY 88 -0.340 4.171 -10.799 732 H LEU 89 H LEU 89 -1.695 1.278 -11.104 733 HA LEU 89 HA LEU 89 -1.632 0.628 -8.194 734 1HB LEU 89 HB2 LEU 89 -2.578 -1.100 -10.498 735 2HB LEU 89 HB3 LEU 89 -2.774 -1.435 -8.778 736 HG LEU 89 HG LEU 89 -3.847 1.122 -9.942 737 1HD1 LEU 89 HD11 LEU 89 -4.601 -1.283 -11.005 738 2HD1 LEU 89 HD12 LEU 89 -5.741 -1.131 -9.667 739 3HD1 LEU 89 HD13 LEU 89 -5.656 0.125 -10.902 740 1HD2 LEU 89 HD21 LEU 89 -3.971 -0.382 -7.431 741 2HD2 LEU 89 HD22 LEU 89 -4.340 1.315 -7.739 742 3HD2 LEU 89 HD23 LEU 89 -5.566 0.080 -8.022 743 H ALA 90 H ALA 90 0.254 -0.191 -7.464 744 HA ALA 90 HA ALA 90 1.642 -2.324 -8.824 745 1HB ALA 90 HB1 ALA 90 2.259 0.085 -9.918 746 2HB ALA 90 HB2 ALA 90 3.453 0.016 -8.623 747 3HB ALA 90 HB3 ALA 90 3.394 -1.262 -9.838 748 H TYR 91 H TYR 91 3.780 -2.790 -7.620 749 HA TYR 91 HA TYR 91 3.256 -2.421 -4.739 750 1HB TYR 91 HB2 TYR 91 5.444 -4.012 -6.111 751 2HB TYR 91 HB3 TYR 91 4.973 -4.120 -4.415 752 HD1 TYR 91 HD1 TYR 91 2.493 -4.726 -3.919 753 HD2 TYR 91 HD2 TYR 91 4.408 -5.391 -7.707 754 HE1 TYR 91 HE1 TYR 91 0.751 -6.390 -4.508 755 HE2 TYR 91 HE2 TYR 91 2.667 -7.056 -8.293 756 HH TYR 91 HH TYR 91 -0.146 -7.278 -7.076 757 H ILE 92 H ILE 92 4.177 -0.740 -3.684 758 HA ILE 92 HA ILE 92 6.387 0.747 -4.920 759 HB ILE 92 HB ILE 92 4.806 1.123 -2.365 760 1HG1 ILE 92 HG12 ILE 92 5.007 3.013 -4.701 761 2HG1 ILE 92 HG13 ILE 92 3.913 1.632 -4.775 762 1HG2 ILE 92 HG21 ILE 92 7.402 2.200 -3.157 763 2HG2 ILE 92 HG22 ILE 92 6.209 3.473 -2.899 764 3HG2 ILE 92 HG23 ILE 92 6.565 2.324 -1.609 765 1HD1 ILE 92 HD11 ILE 92 3.916 3.602 -2.477 766 2HD1 ILE 92 HD12 ILE 92 2.879 3.779 -3.892 767 3HD1 ILE 92 HD13 ILE 92 2.703 2.375 -2.840 768 H TYR 93 H TYR 93 8.504 0.802 -4.163 769 HA TYR 93 HA TYR 93 9.145 -0.956 -1.835 770 1HB TYR 93 HB2 TYR 93 10.607 -0.822 -4.490 771 2HB TYR 93 HB3 TYR 93 11.179 -1.701 -3.073 772 HD1 TYR 93 HD1 TYR 93 9.963 -3.680 -2.236 773 HD2 TYR 93 HD2 TYR 93 8.738 -1.630 -5.806 774 HE1 TYR 93 HE1 TYR 93 8.545 -5.617 -2.862 775 HE2 TYR 93 HE2 TYR 93 7.320 -3.568 -6.432 776 HH TYR 93 HH TYR 93 7.310 -6.540 -4.489 777 H ALA 94 H ALA 94 10.336 0.126 -0.340 778 HA ALA 94 HA ALA 94 11.939 2.473 -1.270 779 1HB ALA 94 HB1 ALA 94 10.064 2.189 1.062 780 2HB ALA 94 HB2 ALA 94 11.426 3.303 1.167 781 3HB ALA 94 HB3 ALA 94 10.209 3.515 -0.092 782 H ASP 95 H ASP 95 14.064 2.286 -0.766 783 HA ASP 95 HA ASP 95 16.020 1.625 0.351 784 1HB ASP 95 HB2 ASP 95 14.189 0.603 2.539 785 2HB ASP 95 HB3 ASP 95 15.895 1.026 2.681 786 H GLY 96 H GLY 96 13.983 -0.263 -1.155 787 1HA GLY 96 HA2 GLY 96 14.502 -2.400 -2.097 788 2HA GLY 96 HA3 GLY 96 15.683 -2.652 -0.813 789 H LYS 97 H LYS 97 12.566 -1.523 0.161 790 HA LYS 97 HA LYS 97 11.844 -4.306 0.990 791 1HB LYS 97 HB2 LYS 97 12.679 -2.688 2.829 792 2HB LYS 97 HB3 LYS 97 11.142 -1.854 2.599 793 1HG LYS 97 HG2 LYS 97 9.898 -3.619 3.430 794 2HG LYS 97 HG3 LYS 97 11.092 -4.824 2.944 795 1HD LYS 97 HD2 LYS 97 12.045 -4.762 4.980 796 2HD LYS 97 HD3 LYS 97 12.273 -3.017 4.853 797 1HE LYS 97 HE2 LYS 97 9.993 -2.629 5.650 798 2HE LYS 97 HE3 LYS 97 9.692 -4.366 5.701 799 1HZ LYS 97 HZ1 LYS 97 12.047 -3.801 7.123 800 2HZ LYS 97 HZ2 LYS 97 10.823 -2.763 7.681 801 3HZ LYS 97 HZ3 LYS 97 10.590 -4.446 7.705 802 H MET 98 H MET 98 9.580 -4.774 0.996 803 HA MET 98 HA MET 98 8.050 -3.180 -0.931 804 1HB MET 98 HB2 MET 98 8.010 -5.709 -0.836 805 2HB MET 98 HB3 MET 98 7.113 -5.570 0.677 806 1HG MET 98 HG2 MET 98 5.214 -4.758 -0.359 807 2HG MET 98 HG3 MET 98 6.124 -4.016 -1.676 808 1HE MET 98 HE1 MET 98 5.938 -7.155 0.162 809 2HE MET 98 HE2 MET 98 4.402 -7.646 -0.565 810 3HE MET 98 HE3 MET 98 5.894 -8.477 -1.002 811 H VAL 99 H VAL 99 7.361 -1.254 -0.027 812 HA VAL 99 HA VAL 99 6.690 -0.699 2.618 813 HB VAL 99 HB VAL 99 5.135 0.368 0.249 814 1HG1 VAL 99 HG11 VAL 99 5.351 1.011 3.091 815 2HG1 VAL 99 HG12 VAL 99 5.718 2.398 2.066 816 3HG1 VAL 99 HG13 VAL 99 4.171 1.568 1.905 817 1HG2 VAL 99 HG21 VAL 99 7.940 0.893 1.205 818 2HG2 VAL 99 HG22 VAL 99 7.350 0.700 -0.445 819 3HG2 VAL 99 HG23 VAL 99 7.016 2.186 0.443 820 H ASN 100 H ASN 100 4.674 -2.256 0.149 821 HA ASN 100 HA ASN 100 2.206 -2.261 1.525 822 1HB ASN 100 HB2 ASN 100 3.319 -4.526 -0.159 823 2HB ASN 100 HB3 ASN 100 1.618 -4.192 0.164 824 1HD2 ASN 100 HD21 ASN 100 0.568 -2.849 -1.324 825 2HD2 ASN 100 HD22 ASN 100 1.357 -1.875 -2.468 826 H GLU 101 H GLU 101 4.800 -4.725 1.619 827 HA GLU 101 HA GLU 101 3.531 -6.277 3.695 828 1HB GLU 101 HB2 GLU 101 5.166 -7.379 2.332 829 2HB GLU 101 HB3 GLU 101 6.376 -6.139 2.666 830 1HG GLU 101 HG2 GLU 101 6.444 -6.804 5.025 831 2HG GLU 101 HG3 GLU 101 5.185 -8.007 4.739 832 H ALA 102 H ALA 102 5.343 -3.350 3.699 833 HA ALA 102 HA ALA 102 6.402 -3.542 6.382 834 1HB ALA 102 HB1 ALA 102 6.073 -1.397 4.341 835 2HB ALA 102 HB2 ALA 102 6.258 -0.884 6.018 836 3HB ALA 102 HB3 ALA 102 7.506 -1.868 5.254 837 H LEU 103 H LEU 103 3.443 -2.172 4.986 838 HA LEU 103 HA LEU 103 2.468 -1.139 7.512 839 1HB LEU 103 HB2 LEU 103 1.024 -1.781 4.922 840 2HB LEU 103 HB3 LEU 103 0.303 -0.924 6.285 841 HG LEU 103 HG LEU 103 2.868 0.234 5.554 842 1HD1 LEU 103 HD11 LEU 103 2.129 -0.668 3.313 843 2HD1 LEU 103 HD12 LEU 103 0.690 0.341 3.450 844 3HD1 LEU 103 HD13 LEU 103 2.285 1.087 3.370 845 1HD2 LEU 103 HD21 LEU 103 0.020 1.096 5.969 846 2HD2 LEU 103 HD22 LEU 103 1.472 1.592 6.839 847 3HD2 LEU 103 HD23 LEU 103 1.156 2.220 5.222 848 H VAL 104 H VAL 104 1.607 -4.008 5.548 849 HA VAL 104 HA VAL 104 -0.288 -5.123 7.314 850 HB VAL 104 HB VAL 104 1.739 -6.665 5.668 851 1HG1 VAL 104 HG11 VAL 104 -0.979 -7.310 6.833 852 2HG1 VAL 104 HG12 VAL 104 -0.247 -8.268 5.545 853 3HG1 VAL 104 HG13 VAL 104 0.547 -8.149 7.115 854 1HG2 VAL 104 HG21 VAL 104 -0.406 -4.866 4.891 855 2HG2 VAL 104 HG22 VAL 104 0.779 -5.687 3.875 856 3HG2 VAL 104 HG23 VAL 104 -0.720 -6.504 4.317 857 H ARG 105 H ARG 105 3.256 -5.373 7.335 858 HA ARG 105 HA ARG 105 3.412 -7.257 9.498 859 1HB ARG 105 HB2 ARG 105 5.246 -6.305 7.808 860 2HB ARG 105 HB3 ARG 105 5.541 -5.188 9.140 861 1HG ARG 105 HG2 ARG 105 6.800 -6.804 10.082 862 2HG ARG 105 HG3 ARG 105 5.302 -7.690 10.370 863 1HD ARG 105 HD2 ARG 105 5.523 -8.925 8.343 864 2HD ARG 105 HD3 ARG 105 6.786 -7.851 7.741 865 HE ARG 105 HE ARG 105 7.396 -9.333 10.224 866 1HH1 ARG 105 HH11 ARG 105 7.037 -10.742 7.373 867 2HH1 ARG 105 HH12 ARG 105 8.710 -10.976 6.994 868 1HH2 ARG 105 HH21 ARG 105 9.847 -8.867 9.499 869 2HH2 ARG 105 HH22 ARG 105 10.302 -9.914 8.196 870 H GLN 106 H GLN 106 3.225 -3.726 9.366 871 HA GLN 106 HA GLN 106 3.547 -3.484 12.278 872 1HB GLN 106 HB2 GLN 106 4.105 -1.775 10.264 873 2HB GLN 106 HB3 GLN 106 2.485 -1.213 10.675 874 1HG GLN 106 HG2 GLN 106 3.260 -0.193 12.524 875 2HG GLN 106 HG3 GLN 106 3.979 -1.701 13.093 876 1HE2 GLN 106 HE21 GLN 106 5.308 0.823 13.443 877 2HE2 GLN 106 HE22 GLN 106 6.710 0.820 12.486 878 H GLY 107 H GLY 107 1.095 -4.617 10.448 879 1HA GLY 107 HA2 GLY 107 -1.219 -4.816 10.778 880 2HA GLY 107 HA3 GLY 107 -0.878 -4.452 12.470 881 H LEU 108 H LEU 108 -0.494 -2.457 9.532 882 HA LEU 108 HA LEU 108 -2.202 -0.400 10.874 883 1HB LEU 108 HB2 LEU 108 0.123 -0.157 8.960 884 2HB LEU 108 HB3 LEU 108 -0.986 1.182 9.256 885 HG LEU 108 HG LEU 108 0.447 -0.287 11.481 886 1HD1 LEU 108 HD11 LEU 108 1.406 1.756 9.595 887 2HD1 LEU 108 HD12 LEU 108 1.601 2.211 11.288 888 3HD1 LEU 108 HD13 LEU 108 2.322 0.718 10.689 889 1HD2 LEU 108 HD21 LEU 108 -1.621 0.994 12.046 890 2HD2 LEU 108 HD22 LEU 108 -0.180 1.693 12.783 891 3HD2 LEU 108 HD23 LEU 108 -0.887 2.438 11.350 892 H ALA 109 H ALA 109 -2.127 -2.624 8.350 893 HA ALA 109 HA ALA 109 -4.470 -1.312 7.098 894 1HB ALA 109 HB1 ALA 109 -1.828 -1.686 5.822 895 2HB ALA 109 HB2 ALA 109 -3.201 -2.239 4.864 896 3HB ALA 109 HB3 ALA 109 -3.127 -0.565 5.413 897 H LYS 110 H LYS 110 -5.718 -2.862 5.775 898 HA LYS 110 HA LYS 110 -5.203 -5.673 6.652 899 1HB LYS 110 HB2 LYS 110 -7.708 -4.083 6.217 900 2HB LYS 110 HB3 LYS 110 -7.755 -5.830 5.974 901 1HG LYS 110 HG2 LYS 110 -6.708 -6.089 8.259 902 2HG LYS 110 HG3 LYS 110 -6.936 -4.355 8.490 903 1HD LYS 110 HD2 LYS 110 -9.383 -4.675 8.029 904 2HD LYS 110 HD3 LYS 110 -9.102 -6.417 7.997 905 1HE LYS 110 HE2 LYS 110 -9.198 -6.497 10.243 906 2HE LYS 110 HE3 LYS 110 -7.879 -5.333 10.355 907 1HZ LYS 110 HZ1 LYS 110 -10.218 -3.986 9.586 908 2HZ LYS 110 HZ2 LYS 110 -10.573 -4.936 10.950 909 3HZ LYS 110 HZ3 LYS 110 -9.312 -3.799 11.008 910 H VAL 111 H VAL 111 -5.496 -7.351 5.081 911 HA VAL 111 HA VAL 111 -4.787 -6.548 2.367 912 HB VAL 111 HB VAL 111 -5.412 -9.259 3.576 913 1HG1 VAL 111 HG11 VAL 111 -5.054 -8.388 0.816 914 2HG1 VAL 111 HG12 VAL 111 -3.844 -9.580 1.288 915 3HG1 VAL 111 HG13 VAL 111 -5.559 -9.961 1.434 916 1HG2 VAL 111 HG21 VAL 111 -3.380 -8.122 4.450 917 2HG2 VAL 111 HG22 VAL 111 -2.973 -9.552 3.502 918 3HG2 VAL 111 HG23 VAL 111 -2.788 -7.946 2.798 919 H ALA 112 H ALA 112 -6.216 -6.165 0.743 920 HA ALA 112 HA ALA 112 -8.706 -7.630 0.481 921 1HB ALA 112 HB1 ALA 112 -8.950 -5.652 2.292 922 2HB ALA 112 HB2 ALA 112 -9.229 -4.718 0.824 923 3HB ALA 112 HB3 ALA 112 -10.262 -6.097 1.200 924 H TYR 113 H TYR 113 -10.123 -6.070 -1.214 925 HA TYR 113 HA TYR 113 -10.166 -5.274 -3.418 926 1HB TYR 113 HB2 TYR 113 -7.600 -4.113 -2.354 927 2HB TYR 113 HB3 TYR 113 -8.033 -3.906 -4.051 928 HD1 TYR 113 HD1 TYR 113 -10.952 -3.664 -3.958 929 HD2 TYR 113 HD2 TYR 113 -7.976 -2.028 -1.327 930 HE1 TYR 113 HE1 TYR 113 -12.505 -1.833 -3.340 931 HE2 TYR 113 HE2 TYR 113 -9.530 -0.197 -0.708 932 HH TYR 113 HH TYR 113 -12.398 -0.110 -0.806 933 H VAL 114 H VAL 114 -10.096 -7.438 -4.276 934 HA VAL 114 HA VAL 114 -7.408 -8.208 -5.341 935 HB VAL 114 HB VAL 114 -9.736 -10.038 -4.673 936 1HG1 VAL 114 HG11 VAL 114 -7.882 -10.506 -6.551 937 2HG1 VAL 114 HG12 VAL 114 -6.946 -10.991 -5.138 938 3HG1 VAL 114 HG13 VAL 114 -8.479 -11.787 -5.496 939 1HG2 VAL 114 HG21 VAL 114 -8.337 -8.891 -2.773 940 2HG2 VAL 114 HG22 VAL 114 -8.609 -10.632 -2.702 941 3HG2 VAL 114 HG23 VAL 114 -7.067 -10.003 -3.281 942 H TYR 115 H TYR 115 -7.294 -8.067 -7.527 943 HA TYR 115 HA TYR 115 -9.767 -8.561 -9.112 944 1HB TYR 115 HB2 TYR 115 -7.911 -6.185 -9.453 945 2HB TYR 115 HB3 TYR 115 -9.237 -6.600 -10.539 946 HD1 TYR 115 HD1 TYR 115 -11.591 -6.505 -9.744 947 HD2 TYR 115 HD2 TYR 115 -8.315 -5.164 -7.311 948 HE1 TYR 115 HE1 TYR 115 -13.179 -5.296 -8.272 949 HE2 TYR 115 HE2 TYR 115 -9.903 -3.954 -5.838 950 HH TYR 115 HH TYR 115 -13.349 -4.371 -6.122 951 H LYS 116 H LYS 116 -8.577 -10.626 -9.488 952 HA LYS 116 HA LYS 116 -6.040 -10.959 -10.561 953 1HB LYS 116 HB2 LYS 116 -8.617 -12.340 -11.359 954 2HB LYS 116 HB3 LYS 116 -7.017 -12.887 -11.863 955 1HG LYS 116 HG2 LYS 116 -6.349 -13.324 -9.611 956 2HG LYS 116 HG3 LYS 116 -7.744 -12.464 -8.959 957 1HD LYS 116 HD2 LYS 116 -9.260 -14.157 -9.809 958 2HD LYS 116 HD3 LYS 116 -7.939 -14.973 -10.647 959 1HE LYS 116 HE2 LYS 116 -7.577 -14.534 -7.730 960 2HE LYS 116 HE3 LYS 116 -8.789 -15.726 -8.199 961 1HZ LYS 116 HZ1 LYS 116 -6.801 -16.389 -9.825 962 2HZ LYS 116 HZ2 LYS 116 -5.902 -15.790 -8.514 963 3HZ LYS 116 HZ3 LYS 116 -6.998 -17.062 -8.279 964 HA PRO 117 HA PRO 117 -5.261 -12.301 -12.141 965 1HB PRO 117 HB2 PRO 117 -3.210 -12.005 -13.915 966 2HB PRO 117 HB3 PRO 117 -4.723 -12.834 -14.321 967 1HG PRO 117 HG2 PRO 117 -3.765 -10.158 -15.172 968 2HG PRO 117 HG3 PRO 117 -4.900 -11.254 -15.974 969 1HD PRO 117 HD2 PRO 117 -5.559 -8.951 -14.431 970 2HD PRO 117 HD3 PRO 117 -6.689 -10.171 -15.060 971 H ASN 118 H ASN 118 -5.207 -9.427 -11.144 972 HA ASN 118 HA ASN 118 -2.342 -8.851 -10.824 973 1HB ASN 118 HB2 ASN 118 -4.901 -7.526 -9.950 974 2HB ASN 118 HB3 ASN 118 -3.366 -7.057 -9.216 975 1HD2 ASN 118 HD21 ASN 118 -4.997 -5.349 -10.980 976 2HD2 ASN 118 HD22 ASN 118 -4.047 -5.015 -12.346 977 H ASN 119 H ASN 119 -2.477 -11.273 -9.809 978 HA ASN 119 HA ASN 119 -2.601 -10.868 -6.850 979 1HB ASN 119 HB2 ASN 119 -3.923 -12.876 -8.545 980 2HB ASN 119 HB3 ASN 119 -3.022 -13.570 -7.198 981 1HD2 ASN 119 HD21 ASN 119 -5.730 -13.865 -6.988 982 2HD2 ASN 119 HD22 ASN 119 -6.386 -12.778 -5.862 983 H THR 120 H THR 120 -0.339 -10.690 -8.777 984 HA THR 120 HA THR 120 1.290 -12.990 -8.807 985 HB THR 120 HB THR 120 2.189 -10.113 -8.472 986 HG1 THR 120 HG1 THR 120 2.320 -11.300 -10.932 987 1HG2 THR 120 HG21 THR 120 3.579 -12.666 -9.270 988 2HG2 THR 120 HG22 THR 120 4.190 -11.093 -9.782 989 3HG2 THR 120 HG23 THR 120 4.072 -11.475 -8.064 990 H HIS 121 H HIS 121 0.797 -10.599 -6.237 991 HA HIS 121 HA HIS 121 2.337 -12.415 -4.425 992 1HB HIS 121 HB2 HIS 121 2.191 -9.385 -4.371 993 2HB HIS 121 HB3 HIS 121 2.956 -10.373 -3.126 994 HD1 HIS 121 HD1 HIS 121 4.159 -12.468 -5.245 995 HD2 HIS 121 HD2 HIS 121 4.656 -8.331 -5.317 996 HE1 HIS 121 HE1 HIS 121 6.267 -12.024 -6.577 997 H GLU 122 H GLU 122 -0.447 -12.671 -4.871 998 HA GLU 122 HA GLU 122 -1.947 -11.216 -2.858 999 1HB GLU 122 HB2 GLU 122 -2.858 -12.380 -4.972 1000 2HB GLU 122 HB3 GLU 122 -2.736 -13.879 -4.051 1001 1HG GLU 122 HG2 GLU 122 -3.984 -12.210 -2.256 1002 2HG GLU 122 HG3 GLU 122 -4.667 -11.672 -3.792 1003 H GLN 123 H GLN 123 -0.987 -14.670 -3.068 1004 HA GLN 123 HA GLN 123 -1.711 -15.385 -0.438 1005 1HB GLN 123 HB2 GLN 123 0.650 -16.399 -2.055 1006 2HB GLN 123 HB3 GLN 123 -0.056 -17.208 -0.656 1007 1HG GLN 123 HG2 GLN 123 -2.249 -17.272 -1.890 1008 2HG GLN 123 HG3 GLN 123 -1.407 -16.654 -3.311 1009 1HE2 GLN 123 HE21 GLN 123 -2.209 -19.523 -1.612 1010 2HE2 GLN 123 HE22 GLN 123 -1.171 -20.579 -2.441 1011 H LEU 124 H LEU 124 1.265 -13.878 -1.645 1012 HA LEU 124 HA LEU 124 2.874 -14.007 0.643 1013 1HB LEU 124 HB2 LEU 124 3.049 -12.725 -1.767 1014 2HB LEU 124 HB3 LEU 124 2.852 -11.362 -0.666 1015 HG LEU 124 HG LEU 124 5.236 -11.913 -0.945 1016 1HD1 LEU 124 HD11 LEU 124 3.892 -12.384 1.702 1017 2HD1 LEU 124 HD12 LEU 124 5.644 -12.540 1.571 1018 3HD1 LEU 124 HD13 LEU 124 4.863 -11.009 1.178 1019 1HD2 LEU 124 HD21 LEU 124 4.474 -14.473 -1.219 1020 2HD2 LEU 124 HD22 LEU 124 6.099 -14.037 -0.693 1021 3HD2 LEU 124 HD23 LEU 124 4.884 -14.503 0.496 1022 H LEU 125 H LEU 125 0.928 -11.115 -0.169 1023 HA LEU 125 HA LEU 125 1.048 -9.977 2.421 1024 1HB LEU 125 HB2 LEU 125 -0.895 -9.688 0.133 1025 2HB LEU 125 HB3 LEU 125 -1.142 -8.820 1.651 1026 HG LEU 125 HG LEU 125 1.518 -8.724 0.239 1027 1HD1 LEU 125 HD11 LEU 125 -0.686 -7.962 -1.103 1028 2HD1 LEU 125 HD12 LEU 125 -0.430 -6.504 -0.144 1029 3HD1 LEU 125 HD13 LEU 125 0.840 -7.084 -1.222 1030 1HD2 LEU 125 HD21 LEU 125 0.045 -7.094 2.309 1031 2HD2 LEU 125 HD22 LEU 125 1.638 -7.840 2.428 1032 3HD2 LEU 125 HD23 LEU 125 1.406 -6.415 1.415 1033 H ARG 126 H ARG 126 -0.836 -12.629 1.237 1034 HA ARG 126 HA ARG 126 -2.992 -12.486 3.139 1035 1HB ARG 126 HB2 ARG 126 -2.938 -13.912 1.042 1036 2HB ARG 126 HB3 ARG 126 -1.845 -15.000 1.898 1037 1HG ARG 126 HG2 ARG 126 -3.637 -16.006 2.816 1038 2HG ARG 126 HG3 ARG 126 -4.000 -14.500 3.662 1039 1HD ARG 126 HD2 ARG 126 -5.178 -13.727 1.547 1040 2HD ARG 126 HD3 ARG 126 -5.007 -15.375 0.944 1041 HE ARG 126 HE ARG 126 -6.426 -14.836 3.518 1042 1HH1 ARG 126 HH11 ARG 126 -8.031 -14.563 0.961 1043 2HH1 ARG 126 HH12 ARG 126 -8.712 -16.149 0.811 1044 1HH2 ARG 126 HH21 ARG 126 -6.515 -17.592 3.072 1045 2HH2 ARG 126 HH22 ARG 126 -7.852 -17.864 2.005 1046 H LYS 127 H LYS 127 -0.384 -14.938 3.122 1047 HA LYS 127 HA LYS 127 -0.662 -15.700 5.813 1048 1HB LYS 127 HB2 LYS 127 1.842 -16.300 5.609 1049 2HB LYS 127 HB3 LYS 127 0.734 -17.063 4.469 1050 1HG LYS 127 HG2 LYS 127 1.437 -15.737 2.686 1051 2HG LYS 127 HG3 LYS 127 2.013 -14.446 3.742 1052 1HD LYS 127 HD2 LYS 127 3.570 -16.597 4.512 1053 2HD LYS 127 HD3 LYS 127 3.424 -16.828 2.769 1054 1HE LYS 127 HE2 LYS 127 5.260 -15.401 2.873 1055 2HE LYS 127 HE3 LYS 127 3.944 -14.242 2.688 1056 1HZ LYS 127 HZ1 LYS 127 4.220 -14.839 5.408 1057 2HZ LYS 127 HZ2 LYS 127 5.763 -14.469 4.799 1058 3HZ LYS 127 HZ3 LYS 127 4.494 -13.357 4.623 1059 H SER 128 H SER 128 1.082 -12.970 4.423 1060 HA SER 128 HA SER 128 2.591 -12.208 6.703 1061 1HB SER 128 HB2 SER 128 3.065 -10.304 5.520 1062 2HB SER 128 HB3 SER 128 2.338 -11.212 4.199 1063 HG SER 128 HG SER 128 1.398 -9.149 4.412 1064 H GLU 129 H GLU 129 -0.697 -11.202 5.714 1065 HA GLU 129 HA GLU 129 -1.196 -9.555 7.993 1066 1HB GLU 129 HB2 GLU 129 -2.663 -9.382 6.092 1067 2HB GLU 129 HB3 GLU 129 -3.067 -11.097 6.177 1068 1HG GLU 129 HG2 GLU 129 -4.848 -9.637 7.147 1069 2HG GLU 129 HG3 GLU 129 -4.182 -10.774 8.320 1070 H ALA 130 H ALA 130 -1.479 -13.032 7.477 1071 HA ALA 130 HA ALA 130 -3.029 -13.687 9.764 1072 1HB ALA 130 HB1 ALA 130 -1.952 -15.151 7.771 1073 2HB ALA 130 HB2 ALA 130 -0.787 -15.507 9.048 1074 3HB ALA 130 HB3 ALA 130 -2.497 -15.870 9.288 1075 H GLN 131 H GLN 131 0.473 -13.238 9.395 1076 HA GLN 131 HA GLN 131 1.129 -13.914 12.114 1077 1HB GLN 131 HB2 GLN 131 2.869 -13.886 10.414 1078 2HB GLN 131 HB3 GLN 131 2.572 -12.179 10.086 1079 1HG GLN 131 HG2 GLN 131 4.181 -11.751 11.616 1080 2HG GLN 131 HG3 GLN 131 2.995 -12.236 12.830 1081 1HE2 GLN 131 HE21 GLN 131 5.163 -12.917 13.952 1082 2HE2 GLN 131 HE22 GLN 131 5.713 -14.491 13.633 1083 H ALA 132 H ALA 132 0.423 -10.831 10.481 1084 HA ALA 132 HA ALA 132 0.877 -9.161 12.763 1085 1HB ALA 132 HB1 ALA 132 0.424 -8.603 10.200 1086 2HB ALA 132 HB2 ALA 132 -1.240 -8.462 10.765 1087 3HB ALA 132 HB3 ALA 132 0.018 -7.443 11.465 1088 H LYS 133 H LYS 133 -1.633 -11.381 12.001 1089 HA LYS 133 HA LYS 133 -3.657 -10.099 13.690 1090 1HB LYS 133 HB2 LYS 133 -3.797 -11.907 11.642 1091 2HB LYS 133 HB3 LYS 133 -3.961 -12.966 13.042 1092 1HG LYS 133 HG2 LYS 133 -5.560 -10.685 13.566 1093 2HG LYS 133 HG3 LYS 133 -5.912 -11.179 11.910 1094 1HD LYS 133 HD2 LYS 133 -5.959 -13.001 14.335 1095 2HD LYS 133 HD3 LYS 133 -7.378 -12.355 13.510 1096 1HE LYS 133 HE2 LYS 133 -6.934 -13.601 11.537 1097 2HE LYS 133 HE3 LYS 133 -5.284 -13.963 12.042 1098 1HZ LYS 133 HZ1 LYS 133 -7.152 -14.853 13.980 1099 2HZ LYS 133 HZ2 LYS 133 -7.524 -15.509 12.461 1100 3HZ LYS 133 HZ3 LYS 133 -5.981 -15.744 13.131 1101 H LYS 134 H LYS 134 -1.538 -12.968 13.913 1102 HA LYS 134 HA LYS 134 -2.409 -13.709 16.551 1103 1HB LYS 134 HB2 LYS 134 -0.401 -15.120 16.600 1104 2HB LYS 134 HB3 LYS 134 -1.198 -15.256 15.032 1105 1HG LYS 134 HG2 LYS 134 0.398 -13.823 13.985 1106 2HG LYS 134 HG3 LYS 134 1.051 -13.299 15.538 1107 1HD LYS 134 HD2 LYS 134 1.300 -16.074 15.616 1108 2HD LYS 134 HD3 LYS 134 1.722 -15.657 13.954 1109 1HE LYS 134 HE2 LYS 134 3.776 -15.197 14.806 1110 2HE LYS 134 HE3 LYS 134 3.031 -13.699 15.365 1111 1HZ LYS 134 HZ1 LYS 134 2.327 -15.146 17.367 1112 2HZ LYS 134 HZ2 LYS 134 3.593 -16.164 16.869 1113 3HZ LYS 134 HZ3 LYS 134 3.917 -14.553 17.289 1114 H GLU 135 H GLU 135 -0.227 -11.283 15.364 1115 HA GLU 135 HA GLU 135 1.041 -10.928 18.009 1116 1HB GLU 135 HB2 GLU 135 1.411 -9.667 15.297 1117 2HB GLU 135 HB3 GLU 135 2.104 -8.923 16.739 1118 1HG GLU 135 HG2 GLU 135 2.673 -11.723 16.831 1119 2HG GLU 135 HG3 GLU 135 3.125 -11.125 15.234 1120 H LYS 136 H LYS 136 -1.696 -9.819 16.303 1121 HA LYS 136 HA LYS 136 -3.245 -8.124 16.758 1122 1HB LYS 136 HB2 LYS 136 -1.996 -8.570 19.476 1123 2HB LYS 136 HB3 LYS 136 -3.350 -7.468 19.226 1124 1HG LYS 136 HG2 LYS 136 -4.608 -9.377 18.163 1125 2HG LYS 136 HG3 LYS 136 -3.293 -10.443 18.658 1126 1HD LYS 136 HD2 LYS 136 -4.577 -8.660 20.703 1127 2HD LYS 136 HD3 LYS 136 -5.395 -10.146 20.220 1128 1HE LYS 136 HE2 LYS 136 -3.715 -11.512 21.066 1129 2HE LYS 136 HE3 LYS 136 -2.482 -10.260 20.921 1130 1HZ LYS 136 HZ1 LYS 136 -4.745 -10.166 22.839 1131 2HZ LYS 136 HZ2 LYS 136 -3.180 -10.696 23.232 1132 3HZ LYS 136 HZ3 LYS 136 -3.434 -9.088 22.756 1133 H LEU 137 H LEU 137 -1.402 -6.973 15.369 1134 HA LEU 137 HA LEU 137 0.000 -4.870 16.884 1135 1HB LEU 137 HB2 LEU 137 0.220 -6.096 14.248 1136 2HB LEU 137 HB3 LEU 137 0.320 -4.336 14.169 1137 HG LEU 137 HG LEU 137 1.839 -5.418 16.413 1138 1HD1 LEU 137 HD11 LEU 137 2.363 -6.422 13.619 1139 2HD1 LEU 137 HD12 LEU 137 3.682 -6.233 14.773 1140 3HD1 LEU 137 HD13 LEU 137 2.349 -7.330 15.129 1141 1HD2 LEU 137 HD21 LEU 137 1.928 -3.310 14.428 1142 2HD2 LEU 137 HD22 LEU 137 2.769 -3.410 15.975 1143 3HD2 LEU 137 HD23 LEU 137 3.493 -4.118 14.531 1144 H ASN 138 H ASN 138 -1.518 -3.379 17.603 1145 HA ASN 138 HA ASN 138 -2.946 -1.534 17.455 1146 1HB ASN 138 HB2 ASN 138 -2.198 -1.633 14.519 1147 2HB ASN 138 HB3 ASN 138 -2.924 -0.262 15.360 1148 1HD2 ASN 138 HD21 ASN 138 -0.013 -1.184 14.197 1149 2HD2 ASN 138 HD22 ASN 138 1.018 -0.482 15.348 1150 H ILE 139 H ILE 139 -4.028 -1.851 14.241 1151 HA ILE 139 HA ILE 139 -6.707 -2.095 14.699 1152 HB ILE 139 HB ILE 139 -5.168 -3.534 12.521 1153 1HG1 ILE 139 HG12 ILE 139 -6.639 -1.001 12.031 1154 2HG1 ILE 139 HG13 ILE 139 -5.177 -0.866 13.011 1155 1HG2 ILE 139 HG21 ILE 139 -7.762 -3.975 13.125 1156 2HG2 ILE 139 HG22 ILE 139 -7.940 -2.536 12.121 1157 3HG2 ILE 139 HG23 ILE 139 -7.158 -3.975 11.469 1158 1HD1 ILE 139 HD11 ILE 139 -4.749 -2.620 10.736 1159 2HD1 ILE 139 HD12 ILE 139 -5.296 -1.027 10.215 1160 3HD1 ILE 139 HD13 ILE 139 -3.853 -1.180 11.217 1161 H TRP 140 H TRP 140 -4.403 -4.791 14.707 1162 HA TRP 140 HA TRP 140 -6.545 -6.733 15.232 1163 1HB TRP 140 HB2 TRP 140 -3.530 -7.066 15.274 1164 2HB TRP 140 HB3 TRP 140 -4.718 -8.372 15.284 1165 HD1 TRP 140 HD1 TRP 140 -2.861 -6.075 13.000 1166 HE1 TRP 140 HE1 TRP 140 -3.619 -6.451 10.564 1167 HE3 TRP 140 HE3 TRP 140 -6.965 -9.003 13.799 1168 HZ2 TRP 140 HZ2 TRP 140 -5.696 -7.813 9.143 1169 HZ3 TRP 140 HZ3 TRP 140 -8.316 -9.824 11.889 1170 HH2 TRP 140 HH2 TRP 140 -7.687 -9.233 9.565 1171 H SER 141 H SER 141 -6.457 -4.690 17.199 1172 HA SER 141 HA SER 141 -5.163 -6.003 19.537 1173 1HB SER 141 HB2 SER 141 -5.952 -3.226 18.857 1174 2HB SER 141 HB3 SER 141 -6.185 -3.699 20.538 1175 HG SER 141 HG SER 141 -3.801 -3.890 19.002 1176 H GLU 142 H GLU 142 -8.256 -5.363 18.097 1177 HA GLU 142 HA GLU 142 -9.846 -5.654 20.492 1178 1HB GLU 142 HB2 GLU 142 -10.570 -6.122 17.582 1179 2HB GLU 142 HB3 GLU 142 -11.725 -6.016 18.911 1180 1HG GLU 142 HG2 GLU 142 -10.661 -3.723 19.418 1181 2HG GLU 142 HG3 GLU 142 -9.936 -3.845 17.816 1182 H ASP 143 H ASP 143 -11.691 -7.671 19.777 1183 HA ASP 143 HA ASP 143 -10.183 -10.163 19.386 1184 1HB ASP 143 HB2 ASP 143 -10.498 -9.177 21.993 1185 2HB ASP 143 HB3 ASP 143 -11.736 -10.422 21.828 1186 H ASN 144 H ASN 144 -11.846 -12.078 19.789 1187 HA ASN 144 HA ASN 144 -14.413 -11.218 18.523 1188 1HB ASN 144 HB2 ASN 144 -12.659 -12.961 17.490 1189 2HB ASN 144 HB3 ASN 144 -13.560 -14.078 18.516 1190 1HD2 ASN 144 HD21 ASN 144 -15.539 -14.824 17.703 1191 2HD2 ASN 144 HD22 ASN 144 -16.340 -14.161 16.361 1192 H ALA 145 H ALA 145 -15.092 -10.724 20.824 1193 HA ALA 145 HA ALA 145 -16.354 -13.147 21.976 1194 1HB ALA 145 HB1 ALA 145 -14.266 -11.482 23.275 1195 2HB ALA 145 HB2 ALA 145 -15.655 -11.904 24.277 1196 3HB ALA 145 HB3 ALA 145 -14.680 -13.176 23.540 1197 H ASP 146 H ASP 146 -15.980 -9.603 22.313 1198 HA ASP 146 HA ASP 146 -18.759 -9.406 23.297 1199 1HB ASP 146 HB2 ASP 146 -16.637 -8.001 24.041 1200 2HB ASP 146 HB3 ASP 146 -17.076 -7.011 22.649 1201 H SER 147 H SER 147 -18.616 -10.415 20.678 1202 HA SER 147 HA SER 147 -20.127 -8.329 19.254 1203 1HB SER 147 HB2 SER 147 -17.436 -8.470 18.730 1204 2HB SER 147 HB3 SER 147 -18.090 -9.567 17.516 1205 HG SER 147 HG SER 147 -19.117 -7.943 16.585 1206 H GLY 148 H GLY 148 -20.493 -11.098 20.398 1207 1HA GLY 148 HA2 GLY 148 -22.377 -12.192 18.741 1208 2HA GLY 148 HA3 GLY 148 -20.876 -12.817 18.057 1209 H GLN 149 H GLN 149 -22.693 -12.622 21.118 1210 HA GLN 149 HA GLN 149 -21.536 -15.287 21.818 1211 1HB GLN 149 HB2 GLN 149 -21.758 -14.432 24.258 1212 2HB GLN 149 HB3 GLN 149 -20.394 -13.850 23.304 1213 1HG GLN 149 HG2 GLN 149 -21.753 -11.834 22.692 1214 2HG GLN 149 HG3 GLN 149 -23.005 -12.394 23.800 1215 1HE2 GLN 149 HE21 GLN 149 -22.357 -10.152 24.825 1216 2HE2 GLN 149 HE22 GLN 149 -21.114 -10.194 25.981 1217 HN3 PTP 150 H3 PTP 150 -9.198 -3.568 -9.443 1218 1H5M PTP 150 H51 PTP 150 -6.474 -0.449 -6.000 1219 2H5M PTP 150 H52 PTP 150 -5.682 -1.730 -6.947 1220 3H5M PTP 150 H53 PTP 150 -6.530 -2.137 -5.436 1221 H6 PTP 150 H6 PTP 150 -8.821 -0.151 -6.085 1222 H1* PTP 150 H1' PTP 150 -11.798 -0.111 -8.173 1223 2H2* PTP 150 H2' PTP 150 -11.610 -1.563 -5.550 1224 H3* PTP 150 H3' PTP 150 -12.499 0.250 -4.302 1225 H4* PTP 150 H4' PTP 150 -11.564 2.444 -5.632 1226 2H5* PTP 150 H5' PTP 150 -10.014 0.175 -4.251 Start of MODEL 5 1 1H ALA 1 H1 ALA 1 14.344 -16.417 -23.470 2 2H ALA 1 H2 ALA 1 15.528 -16.857 -24.606 3 3H ALA 1 H3 ALA 1 14.072 -16.162 -25.127 4 HA ALA 1 HA ALA 1 14.106 -18.563 -25.509 5 1HB ALA 1 HB1 ALA 1 15.396 -18.617 -23.067 6 2HB ALA 1 HB2 ALA 1 13.779 -19.189 -22.658 7 3HB ALA 1 HB3 ALA 1 14.723 -20.025 -23.889 8 H THR 2 H THR 2 12.252 -19.959 -23.807 9 HA THR 2 HA THR 2 9.842 -18.339 -24.379 10 HB THR 2 HB THR 2 8.613 -20.374 -24.188 11 HG1 THR 2 HG1 THR 2 10.887 -21.702 -23.196 12 1HG2 THR 2 HG21 THR 2 11.332 -20.744 -25.436 13 2HG2 THR 2 HG22 THR 2 10.120 -22.024 -25.495 14 3HG2 THR 2 HG23 THR 2 9.785 -20.457 -26.234 15 H SER 3 H SER 3 10.419 -16.846 -22.538 16 HA SER 3 HA SER 3 9.415 -17.989 -19.964 17 1HB SER 3 HB2 SER 3 11.954 -16.720 -20.522 18 2HB SER 3 HB3 SER 3 11.046 -15.770 -19.351 19 HG SER 3 HG SER 3 10.653 -18.100 -18.490 20 H THR 4 H THR 4 7.896 -16.729 -18.900 21 HA THR 4 HA THR 4 7.389 -13.982 -19.912 22 HB THR 4 HB THR 4 4.935 -14.487 -20.016 23 HG1 THR 4 HG1 THR 4 5.721 -17.195 -20.007 24 1HG2 THR 4 HG21 THR 4 6.934 -15.034 -21.886 25 2HG2 THR 4 HG22 THR 4 5.903 -16.465 -21.919 26 3HG2 THR 4 HG23 THR 4 5.209 -14.871 -22.219 27 H LYS 5 H LYS 5 8.567 -14.858 -17.457 28 HA LYS 5 HA LYS 5 6.412 -14.092 -15.527 29 1HB LYS 5 HB2 LYS 5 7.792 -16.468 -15.528 30 2HB LYS 5 HB3 LYS 5 8.764 -15.488 -14.428 31 1HG LYS 5 HG2 LYS 5 6.413 -14.839 -13.418 32 2HG LYS 5 HG3 LYS 5 5.903 -16.350 -14.170 33 1HD LYS 5 HD2 LYS 5 8.437 -16.441 -12.619 34 2HD LYS 5 HD3 LYS 5 6.953 -16.246 -11.686 35 1HE LYS 5 HE2 LYS 5 6.824 -18.512 -11.833 36 2HE LYS 5 HE3 LYS 5 6.214 -18.198 -13.457 37 1HZ LYS 5 HZ1 LYS 5 8.923 -18.057 -13.720 38 2HZ LYS 5 HZ2 LYS 5 8.700 -19.351 -12.641 39 3HZ LYS 5 HZ3 LYS 5 7.946 -19.375 -14.159 40 H LYS 6 H LYS 6 7.863 -13.463 -13.334 41 HA LYS 6 HA LYS 6 9.328 -11.881 -12.393 42 1HB LYS 6 HB2 LYS 6 10.731 -12.887 -14.594 43 2HB LYS 6 HB3 LYS 6 10.785 -11.135 -14.800 44 1HG LYS 6 HG2 LYS 6 12.675 -11.716 -13.442 45 2HG LYS 6 HG3 LYS 6 11.487 -10.983 -12.362 46 1HD LYS 6 HD2 LYS 6 11.185 -12.908 -11.205 47 2HD LYS 6 HD3 LYS 6 11.150 -13.886 -12.673 48 1HE LYS 6 HE2 LYS 6 13.682 -13.534 -12.796 49 2HE LYS 6 HE3 LYS 6 13.573 -12.914 -11.147 50 1HZ LYS 6 HZ1 LYS 6 12.144 -15.359 -11.449 51 2HZ LYS 6 HZ2 LYS 6 13.773 -15.543 -11.897 52 3HZ LYS 6 HZ3 LYS 6 13.374 -14.961 -10.351 53 H LEU 7 H LEU 7 8.403 -9.942 -11.956 54 HA LEU 7 HA LEU 7 6.963 -8.460 -14.022 55 1HB LEU 7 HB2 LEU 7 7.600 -7.809 -11.128 56 2HB LEU 7 HB3 LEU 7 6.581 -6.813 -12.167 57 HG LEU 7 HG LEU 7 6.037 -9.747 -11.673 58 1HD1 LEU 7 HD11 LEU 7 5.013 -7.297 -10.212 59 2HD1 LEU 7 HD12 LEU 7 4.242 -8.881 -10.118 60 3HD1 LEU 7 HD13 LEU 7 5.887 -8.664 -9.519 61 1HD2 LEU 7 HD21 LEU 7 5.076 -8.532 -13.698 62 2HD2 LEU 7 HD22 LEU 7 3.885 -9.257 -12.618 63 3HD2 LEU 7 HD23 LEU 7 4.185 -7.520 -12.561 64 H HIS 8 H HIS 8 7.511 -5.830 -13.568 65 HA HIS 8 HA HIS 8 10.432 -5.588 -14.175 66 1HB HIS 8 HB2 HIS 8 8.521 -5.184 -16.031 67 2HB HIS 8 HB3 HIS 8 8.538 -3.580 -15.295 68 HD1 HIS 8 HD1 HIS 8 10.162 -2.053 -16.385 69 HD2 HIS 8 HD2 HIS 8 11.460 -6.010 -16.545 70 HE1 HIS 8 HE1 HIS 8 12.378 -2.031 -17.613 71 H LYS 9 H LYS 9 11.364 -4.514 -12.506 72 HA LYS 9 HA LYS 9 9.732 -2.635 -10.903 73 1HB LYS 9 HB2 LYS 9 12.487 -3.832 -10.528 74 2HB LYS 9 HB3 LYS 9 11.830 -2.593 -9.458 75 1HG LYS 9 HG2 LYS 9 9.809 -4.565 -9.785 76 2HG LYS 9 HG3 LYS 9 11.314 -5.419 -9.443 77 1HD LYS 9 HD2 LYS 9 11.526 -3.441 -7.626 78 2HD LYS 9 HD3 LYS 9 9.768 -3.543 -7.726 79 1HE LYS 9 HE2 LYS 9 9.776 -5.420 -6.488 80 2HE LYS 9 HE3 LYS 9 10.852 -6.203 -7.645 81 1HZ LYS 9 HZ1 LYS 9 12.341 -4.349 -6.175 82 2HZ LYS 9 HZ2 LYS 9 11.450 -5.279 -5.072 83 3HZ LYS 9 HZ3 LYS 9 12.485 -6.041 -6.183 84 H GLU 10 H GLU 10 9.910 -0.460 -11.113 85 HA GLU 10 HA GLU 10 12.295 0.635 -12.545 86 1HB GLU 10 HB2 GLU 10 9.488 1.740 -12.806 87 2HB GLU 10 HB3 GLU 10 10.901 2.145 -13.778 88 1HG GLU 10 HG2 GLU 10 10.334 -0.719 -13.801 89 2HG GLU 10 HG3 GLU 10 8.985 0.235 -14.417 90 HA PRO 11 HA PRO 11 12.452 3.522 -9.215 91 1HB PRO 11 HB2 PRO 11 13.568 5.675 -10.469 92 2HB PRO 11 HB3 PRO 11 14.463 4.188 -10.118 93 1HG PRO 11 HG2 PRO 11 13.425 5.189 -12.714 94 2HG PRO 11 HG3 PRO 11 14.794 4.115 -12.391 95 1HD PRO 11 HD2 PRO 11 12.215 3.334 -13.279 96 2HD PRO 11 HD3 PRO 11 13.505 2.256 -12.707 97 H ALA 12 H ALA 12 11.714 5.741 -8.517 98 HA ALA 12 HA ALA 12 9.650 6.991 -10.230 99 1HB ALA 12 HB1 ALA 12 9.060 5.245 -7.965 100 2HB ALA 12 HB2 ALA 12 8.375 6.857 -7.755 101 3HB ALA 12 HB3 ALA 12 7.968 5.905 -9.182 102 H THR 13 H THR 13 8.632 8.890 -8.751 103 HA THR 13 HA THR 13 10.920 10.148 -7.287 104 HB THR 13 HB THR 13 8.900 11.783 -8.799 105 HG1 THR 13 HG1 THR 13 11.159 10.420 -9.810 106 1HG2 THR 13 HG21 THR 13 11.301 12.224 -7.284 107 2HG2 THR 13 HG22 THR 13 11.562 12.753 -8.946 108 3HG2 THR 13 HG23 THR 13 10.223 13.418 -8.010 109 H LEU 14 H LEU 14 10.402 10.769 -5.240 110 HA LEU 14 HA LEU 14 7.652 10.432 -4.301 111 1HB LEU 14 HB2 LEU 14 9.777 9.869 -2.981 112 2HB LEU 14 HB3 LEU 14 9.960 11.606 -2.738 113 HG LEU 14 HG LEU 14 8.738 10.409 -0.874 114 1HD1 LEU 14 HD11 LEU 14 8.305 12.893 -1.995 115 2HD1 LEU 14 HD12 LEU 14 6.677 12.217 -1.931 116 3HD1 LEU 14 HD13 LEU 14 7.638 12.347 -0.457 117 1HD2 LEU 14 HD21 LEU 14 7.434 9.131 -2.910 118 2HD2 LEU 14 HD22 LEU 14 6.823 9.232 -1.259 119 3HD2 LEU 14 HD23 LEU 14 6.256 10.370 -2.481 120 H ILE 15 H ILE 15 6.262 12.041 -4.926 121 HA ILE 15 HA ILE 15 7.209 14.845 -4.952 122 HB ILE 15 HB ILE 15 4.445 13.821 -5.643 123 1HG1 ILE 15 HG12 ILE 15 6.876 14.135 -7.436 124 2HG1 ILE 15 HG13 ILE 15 6.124 12.606 -6.980 125 1HG2 ILE 15 HG21 ILE 15 4.802 16.281 -5.281 126 2HG2 ILE 15 HG22 ILE 15 5.993 16.255 -6.582 127 3HG2 ILE 15 HG23 ILE 15 4.304 15.879 -6.925 128 1HD1 ILE 15 HD11 ILE 15 3.973 13.478 -8.000 129 2HD1 ILE 15 HD12 ILE 15 4.911 14.826 -8.643 130 3HD1 ILE 15 HD13 ILE 15 5.271 13.177 -9.155 131 H LYS 16 H LYS 16 4.225 13.266 -3.736 132 HA LYS 16 HA LYS 16 4.607 14.483 -1.097 133 1HB LYS 16 HB2 LYS 16 3.667 16.376 -2.351 134 2HB LYS 16 HB3 LYS 16 2.325 15.366 -2.890 135 1HG LYS 16 HG2 LYS 16 1.251 16.154 -1.053 136 2HG LYS 16 HG3 LYS 16 2.251 15.003 -0.165 137 1HD LYS 16 HD2 LYS 16 3.845 17.311 -0.623 138 2HD LYS 16 HD3 LYS 16 2.283 17.870 -0.023 139 1HE LYS 16 HE2 LYS 16 2.517 16.786 2.006 140 2HE LYS 16 HE3 LYS 16 3.557 15.529 1.335 141 1HZ LYS 16 HZ1 LYS 16 4.613 18.230 1.245 142 2HZ LYS 16 HZ2 LYS 16 4.460 17.556 2.796 143 3HZ LYS 16 HZ3 LYS 16 5.393 16.771 1.614 144 H ALA 17 H ALA 17 4.090 12.744 0.142 145 HA ALA 17 HA ALA 17 2.273 10.675 -0.758 146 1HB ALA 17 HB1 ALA 17 4.202 10.307 0.823 147 2HB ALA 17 HB2 ALA 17 3.283 11.171 2.056 148 3HB ALA 17 HB3 ALA 17 2.669 9.653 1.403 149 H ILE 18 H ILE 18 0.087 10.574 -0.460 150 HA ILE 18 HA ILE 18 -1.221 12.819 0.943 151 HB ILE 18 HB ILE 18 -2.483 10.488 -0.527 152 1HG1 ILE 18 HG12 ILE 18 -2.618 12.956 -1.967 153 2HG1 ILE 18 HG13 ILE 18 -0.932 12.666 -1.537 154 1HG2 ILE 18 HG21 ILE 18 -3.517 13.222 0.286 155 2HG2 ILE 18 HG22 ILE 18 -4.406 12.054 -0.692 156 3HG2 ILE 18 HG23 ILE 18 -4.003 11.678 0.985 157 1HD1 ILE 18 HD11 ILE 18 -2.384 10.280 -2.494 158 2HD1 ILE 18 HD12 ILE 18 -2.173 11.547 -3.702 159 3HD1 ILE 18 HD13 ILE 18 -0.766 10.850 -2.898 160 H ASP 19 H ASP 19 -1.863 9.294 0.929 161 HA ASP 19 HA ASP 19 -2.247 9.493 3.890 162 1HB ASP 19 HB2 ASP 19 -3.761 7.719 1.947 163 2HB ASP 19 HB3 ASP 19 -4.016 7.802 3.692 164 H GLY 20 H GLY 20 -2.620 6.683 4.245 165 1HA GLY 20 HA2 GLY 20 0.189 5.821 4.019 166 2HA GLY 20 HA3 GLY 20 -1.079 4.990 4.919 167 H ASP 21 H ASP 21 -2.528 5.620 2.081 168 HA ASP 21 HA ASP 21 -1.494 3.121 0.803 169 1HB ASP 21 HB2 ASP 21 -4.055 3.562 1.884 170 2HB ASP 21 HB3 ASP 21 -4.257 3.685 0.136 171 H THR 22 H THR 22 -2.131 6.443 0.464 172 HA THR 22 HA THR 22 -1.901 6.177 -2.507 173 HB THR 22 HB THR 22 -3.146 8.615 -1.311 174 HG1 THR 22 HG1 THR 22 -4.999 7.625 -0.898 175 1HG2 THR 22 HG21 THR 22 -2.636 8.108 -3.801 176 2HG2 THR 22 HG22 THR 22 -4.019 7.017 -3.710 177 3HG2 THR 22 HG23 THR 22 -4.232 8.739 -3.396 178 H VAL 23 H VAL 23 -0.033 7.031 -3.251 179 HA VAL 23 HA VAL 23 1.146 9.353 -1.794 180 HB VAL 23 HB VAL 23 3.418 8.308 -2.287 181 1HG1 VAL 23 HG11 VAL 23 1.777 8.088 -0.116 182 2HG1 VAL 23 HG12 VAL 23 2.066 6.388 -0.487 183 3HG1 VAL 23 HG13 VAL 23 3.426 7.464 -0.168 184 1HG2 VAL 23 HG21 VAL 23 1.981 6.564 -3.814 185 2HG2 VAL 23 HG22 VAL 23 3.584 6.206 -3.171 186 3HG2 VAL 23 HG23 VAL 23 2.146 5.631 -2.326 187 H LYS 24 H LYS 24 1.608 10.991 -3.192 188 HA LYS 24 HA LYS 24 1.252 10.549 -6.067 189 1HB LYS 24 HB2 LYS 24 2.188 13.088 -4.714 190 2HB LYS 24 HB3 LYS 24 1.370 12.927 -6.269 191 1HG LYS 24 HG2 LYS 24 -0.586 11.910 -4.972 192 2HG LYS 24 HG3 LYS 24 0.216 12.487 -3.510 193 1HD LYS 24 HD2 LYS 24 -1.092 14.332 -3.954 194 2HD LYS 24 HD3 LYS 24 0.320 14.756 -4.923 195 1HE LYS 24 HE2 LYS 24 -0.711 14.080 -6.936 196 2HE LYS 24 HE3 LYS 24 -1.939 13.136 -6.093 197 1HZ LYS 24 HZ1 LYS 24 -2.648 15.351 -5.102 198 2HZ LYS 24 HZ2 LYS 24 -1.715 16.073 -6.321 199 3HZ LYS 24 HZ3 LYS 24 -3.025 15.075 -6.736 200 H LEU 25 H LEU 25 2.909 9.848 -7.315 201 HA LEU 25 HA LEU 25 5.661 10.795 -6.635 202 1HB LEU 25 HB2 LEU 25 5.318 8.099 -7.877 203 2HB LEU 25 HB3 LEU 25 6.562 8.672 -6.767 204 HG LEU 25 HG LEU 25 3.679 8.221 -5.955 205 1HD1 LEU 25 HD11 LEU 25 5.831 6.324 -6.412 206 2HD1 LEU 25 HD12 LEU 25 5.337 6.322 -4.719 207 3HD1 LEU 25 HD13 LEU 25 4.147 6.016 -5.984 208 1HD2 LEU 25 HD21 LEU 25 5.660 9.690 -4.740 209 2HD2 LEU 25 HD22 LEU 25 4.312 8.934 -3.889 210 3HD2 LEU 25 HD23 LEU 25 5.869 8.111 -3.983 211 H MET 26 H MET 26 7.110 10.035 -8.698 212 HA MET 26 HA MET 26 5.600 10.886 -11.135 213 1HB MET 26 HB2 MET 26 7.419 12.467 -9.947 214 2HB MET 26 HB3 MET 26 8.514 11.485 -10.919 215 1HG MET 26 HG2 MET 26 7.317 12.060 -12.951 216 2HG MET 26 HG3 MET 26 6.077 12.906 -12.026 217 1HE MET 26 HE1 MET 26 6.413 14.806 -10.565 218 2HE MET 26 HE2 MET 26 7.345 16.196 -11.114 219 3HE MET 26 HE3 MET 26 6.122 15.492 -12.169 220 H TYR 27 H TYR 27 5.612 9.275 -12.621 221 HA TYR 27 HA TYR 27 7.887 7.336 -12.574 222 1HB TYR 27 HB2 TYR 27 5.759 6.261 -12.076 223 2HB TYR 27 HB3 TYR 27 5.019 6.991 -13.500 224 HD1 TYR 27 HD1 TYR 27 8.074 4.973 -12.643 225 HD2 TYR 27 HD2 TYR 27 4.845 5.654 -15.393 226 HE1 TYR 27 HE1 TYR 27 8.845 3.062 -14.023 227 HE2 TYR 27 HE2 TYR 27 5.617 3.743 -16.773 228 HH TYR 27 HH TYR 27 7.995 1.518 -15.661 229 H LYS 28 H LYS 28 9.264 7.610 -14.254 230 HA LYS 28 HA LYS 28 10.055 8.101 -16.406 231 1HB LYS 28 HB2 LYS 28 7.204 7.299 -16.897 232 2HB LYS 28 HB3 LYS 28 8.172 7.939 -18.226 233 1HG LYS 28 HG2 LYS 28 8.864 5.553 -16.487 234 2HG LYS 28 HG3 LYS 28 8.380 5.510 -18.180 235 1HD LYS 28 HD2 LYS 28 10.400 7.083 -18.586 236 2HD LYS 28 HD3 LYS 28 10.942 6.558 -16.991 237 1HE LYS 28 HE2 LYS 28 11.775 4.688 -17.918 238 2HE LYS 28 HE3 LYS 28 10.140 4.224 -18.393 239 1HZ LYS 28 HZ1 LYS 28 10.397 5.537 -20.408 240 2HZ LYS 28 HZ2 LYS 28 11.975 5.961 -19.954 241 3HZ LYS 28 HZ3 LYS 28 11.599 4.342 -20.306 242 H GLY 29 H GLY 29 8.653 10.194 -14.605 243 1HA GLY 29 HA2 GLY 29 8.691 12.568 -14.868 244 2HA GLY 29 HA3 GLY 29 8.783 12.347 -16.616 245 H GLN 30 H GLN 30 6.391 10.694 -14.646 246 HA GLN 30 HA GLN 30 4.307 12.521 -15.759 247 1HB GLN 30 HB2 GLN 30 4.663 9.998 -16.675 248 2HB GLN 30 HB3 GLN 30 3.571 9.679 -15.326 249 1HG GLN 30 HG2 GLN 30 2.994 11.877 -17.309 250 2HG GLN 30 HG3 GLN 30 2.509 10.210 -17.626 251 1HE2 GLN 30 HE21 GLN 30 0.339 11.726 -17.428 252 2HE2 GLN 30 HE22 GLN 30 -0.395 11.648 -15.900 253 HA PRO 31 HA PRO 31 3.326 12.694 -11.390 254 1HB PRO 31 HB2 PRO 31 1.269 14.474 -11.656 255 2HB PRO 31 HB3 PRO 31 2.974 14.952 -11.734 256 1HG PRO 31 HG2 PRO 31 1.016 14.578 -13.967 257 2HG PRO 31 HG3 PRO 31 2.322 15.764 -13.805 258 1HD PRO 31 HD2 PRO 31 2.495 13.469 -15.349 259 2HD PRO 31 HD3 PRO 31 3.899 14.332 -14.681 260 H MET 32 H MET 32 2.219 10.962 -10.529 261 HA MET 32 HA MET 32 -0.648 10.663 -11.170 262 1HB MET 32 HB2 MET 32 1.382 8.955 -12.312 263 2HB MET 32 HB3 MET 32 0.349 8.019 -11.232 264 1HG MET 32 HG2 MET 32 -1.647 8.789 -12.392 265 2HG MET 32 HG3 MET 32 -0.683 9.862 -13.407 266 1HE MET 32 HE1 MET 32 -0.551 6.515 -11.896 267 2HE MET 32 HE2 MET 32 -0.414 5.330 -13.192 268 3HE MET 32 HE3 MET 32 1.012 6.232 -12.659 269 H THR 33 H THR 33 -1.774 9.440 -9.552 270 HA THR 33 HA THR 33 -0.301 9.303 -6.982 271 HB THR 33 HB THR 33 -3.061 8.569 -6.724 272 HG1 THR 33 HG1 THR 33 -2.501 10.850 -8.305 273 1HG2 THR 33 HG21 THR 33 -1.141 10.183 -5.479 274 2HG2 THR 33 HG22 THR 33 -2.415 11.298 -5.973 275 3HG2 THR 33 HG23 THR 33 -2.800 9.919 -4.942 276 H PHE 34 H PHE 34 0.546 7.360 -6.408 277 HA PHE 34 HA PHE 34 -0.436 4.906 -7.718 278 1HB PHE 34 HB2 PHE 34 1.927 5.608 -5.999 279 2HB PHE 34 HB3 PHE 34 1.458 3.919 -6.194 280 HD1 PHE 34 HD1 PHE 34 2.296 7.009 -8.117 281 HD2 PHE 34 HD2 PHE 34 2.021 2.722 -8.149 282 HE1 PHE 34 HE1 PHE 34 3.394 6.955 -10.340 283 HE2 PHE 34 HE2 PHE 34 3.120 2.668 -10.372 284 HZ PHE 34 HZ PHE 34 3.806 4.784 -11.467 285 H ARG 35 H ARG 35 -1.539 3.266 -6.663 286 HA ARG 35 HA ARG 35 -2.279 3.794 -3.811 287 1HB ARG 35 HB2 ARG 35 -4.237 4.089 -5.194 288 2HB ARG 35 HB3 ARG 35 -3.912 2.589 -6.062 289 1HG ARG 35 HG2 ARG 35 -5.687 2.319 -4.333 290 2HG ARG 35 HG3 ARG 35 -4.289 1.288 -4.028 291 1HD ARG 35 HD2 ARG 35 -5.217 2.589 -2.017 292 2HD ARG 35 HD3 ARG 35 -3.481 2.709 -2.303 293 HE ARG 35 HE ARG 35 -3.838 4.960 -3.182 294 1HH1 ARG 35 HH11 ARG 35 -5.892 3.959 -0.781 295 2HH1 ARG 35 HH12 ARG 35 -7.126 5.139 -1.072 296 1HH2 ARG 35 HH21 ARG 35 -5.737 6.243 -4.051 297 2HH2 ARG 35 HH22 ARG 35 -7.038 6.433 -2.923 298 H LEU 36 H LEU 36 -1.581 2.222 -2.436 299 HA LEU 36 HA LEU 36 -0.035 0.013 -3.166 300 1HB LEU 36 HB2 LEU 36 -1.899 0.101 -0.777 301 2HB LEU 36 HB3 LEU 36 -0.437 -0.870 -0.939 302 HG LEU 36 HG LEU 36 -0.690 2.113 -0.590 303 1HD1 LEU 36 HD11 LEU 36 0.622 -0.198 0.788 304 2HD1 LEU 36 HD12 LEU 36 1.373 1.392 0.921 305 3HD1 LEU 36 HD13 LEU 36 -0.282 1.150 1.477 306 1HD2 LEU 36 HD21 LEU 36 1.714 0.609 -1.680 307 2HD2 LEU 36 HD22 LEU 36 0.756 1.801 -2.558 308 3HD2 LEU 36 HD23 LEU 36 1.724 2.295 -1.168 309 H LEU 37 H LEU 37 -0.471 -1.979 -3.994 310 HA LEU 37 HA LEU 37 -3.272 -2.596 -4.696 311 1HB LEU 37 HB2 LEU 37 -0.584 -3.430 -5.621 312 2HB LEU 37 HB3 LEU 37 -1.823 -4.683 -5.665 313 HG LEU 37 HG LEU 37 -2.552 -1.986 -6.713 314 1HD1 LEU 37 HD11 LEU 37 -0.318 -2.415 -7.688 315 2HD1 LEU 37 HD12 LEU 37 -0.867 -3.999 -8.237 316 3HD1 LEU 37 HD13 LEU 37 -1.580 -2.536 -8.913 317 1HD2 LEU 37 HD21 LEU 37 -3.497 -4.730 -6.796 318 2HD2 LEU 37 HD22 LEU 37 -4.341 -3.253 -7.259 319 3HD2 LEU 37 HD23 LEU 37 -3.314 -4.085 -8.426 320 H LEU 38 H LEU 38 -4.218 -4.674 -4.197 321 HA LEU 38 HA LEU 38 -4.645 -6.559 -2.879 322 1HB LEU 38 HB2 LEU 38 -1.827 -6.263 -1.813 323 2HB LEU 38 HB3 LEU 38 -2.826 -7.717 -1.831 324 HG LEU 38 HG LEU 38 -1.753 -6.256 -4.262 325 1HD1 LEU 38 HD11 LEU 38 -0.880 -8.592 -2.659 326 2HD1 LEU 38 HD12 LEU 38 -0.856 -8.818 -4.409 327 3HD1 LEU 38 HD13 LEU 38 0.067 -7.506 -3.677 328 1HD2 LEU 38 HD21 LEU 38 -3.893 -8.254 -3.875 329 2HD2 LEU 38 HD22 LEU 38 -3.603 -7.166 -5.233 330 3HD2 LEU 38 HD23 LEU 38 -2.711 -8.683 -5.113 331 H VAL 39 H VAL 39 -2.366 -4.968 -0.635 332 HA VAL 39 HA VAL 39 -4.365 -5.073 1.471 333 HB VAL 39 HB VAL 39 -2.666 -4.248 2.910 334 1HG1 VAL 39 HG11 VAL 39 -2.146 -6.340 1.087 335 2HG1 VAL 39 HG12 VAL 39 -0.642 -5.428 1.219 336 3HG1 VAL 39 HG13 VAL 39 -1.401 -6.092 2.667 337 1HG2 VAL 39 HG21 VAL 39 -1.315 -3.224 0.392 338 2HG2 VAL 39 HG22 VAL 39 -2.048 -2.245 1.663 339 3HG2 VAL 39 HG23 VAL 39 -0.592 -3.180 1.999 340 H ASP 40 H ASP 40 -4.972 -3.120 2.735 341 HA ASP 40 HA ASP 40 -4.830 -0.506 1.457 342 1HB ASP 40 HB2 ASP 40 -6.616 -1.587 0.110 343 2HB ASP 40 HB3 ASP 40 -7.512 -1.925 1.592 344 H THR 41 H THR 41 -4.699 0.860 3.172 345 HA THR 41 HA THR 41 -4.873 0.232 5.845 346 HB THR 41 HB THR 41 -5.843 2.753 5.977 347 HG1 THR 41 HG1 THR 41 -4.428 2.924 3.600 348 1HG2 THR 41 HG21 THR 41 -3.092 1.733 5.289 349 2HG2 THR 41 HG22 THR 41 -3.387 3.449 5.563 350 3HG2 THR 41 HG23 THR 41 -3.701 2.285 6.849 351 HA PRO 42 HA PRO 42 -9.078 -0.506 6.911 352 1HB PRO 42 HB2 PRO 42 -9.113 0.462 9.468 353 2HB PRO 42 HB3 PRO 42 -8.286 -1.039 9.015 354 1HG PRO 42 HG2 PRO 42 -7.126 1.665 9.564 355 2HG PRO 42 HG3 PRO 42 -6.460 0.063 9.920 356 1HD PRO 42 HD2 PRO 42 -5.669 1.636 7.774 357 2HD PRO 42 HD3 PRO 42 -5.490 -0.132 7.840 358 H GLU 43 H GLU 43 -7.920 2.759 7.802 359 HA GLU 43 HA GLU 43 -10.411 3.880 6.652 360 1HB GLU 43 HB2 GLU 43 -10.031 3.604 9.438 361 2HB GLU 43 HB3 GLU 43 -9.766 5.311 9.075 362 1HG GLU 43 HG2 GLU 43 -12.041 4.239 7.605 363 2HG GLU 43 HG3 GLU 43 -12.245 4.053 9.347 364 H THR 44 H THR 44 -10.168 6.107 6.027 365 HA THR 44 HA THR 44 -7.663 7.516 6.504 366 HB THR 44 HB THR 44 -7.394 7.588 3.838 367 HG1 THR 44 HG1 THR 44 -8.079 4.899 4.211 368 1HG2 THR 44 HG21 THR 44 -5.816 6.784 5.750 369 2HG2 THR 44 HG22 THR 44 -6.341 5.167 5.280 370 3HG2 THR 44 HG23 THR 44 -5.521 6.203 4.112 371 H LYS 45 H LYS 45 -10.146 8.397 7.103 372 HA LYS 45 HA LYS 45 -10.773 10.331 4.906 373 1HB LYS 45 HB2 LYS 45 -12.497 8.466 5.897 374 2HB LYS 45 HB3 LYS 45 -12.843 9.830 6.961 375 1HG LYS 45 HG2 LYS 45 -12.916 11.226 4.762 376 2HG LYS 45 HG3 LYS 45 -13.110 9.665 3.966 377 1HD LYS 45 HD2 LYS 45 -14.895 9.511 6.080 378 2HD LYS 45 HD3 LYS 45 -15.037 11.191 5.561 379 1HE LYS 45 HE2 LYS 45 -15.017 9.966 3.146 380 2HE LYS 45 HE3 LYS 45 -15.761 8.698 4.120 381 1HZ LYS 45 HZ1 LYS 45 -16.771 11.354 4.630 382 2HZ LYS 45 HZ2 LYS 45 -17.083 10.780 3.061 383 3HZ LYS 45 HZ3 LYS 45 -17.611 9.896 4.412 384 H HIS 46 H HIS 46 -8.775 10.767 6.952 385 HA HIS 46 HA HIS 46 -9.725 12.241 9.178 386 1HB HIS 46 HB2 HIS 46 -7.195 12.965 7.710 387 2HB HIS 46 HB3 HIS 46 -7.507 12.983 9.443 388 HD1 HIS 46 HD1 HIS 46 -6.414 10.768 6.676 389 HD2 HIS 46 HD2 HIS 46 -7.563 10.345 10.662 390 HE1 HIS 46 HE1 HIS 46 -5.716 8.437 7.379 391 HA PRO 47 HA PRO 47 -11.382 15.701 6.832 392 1HB PRO 47 HB2 PRO 47 -12.462 16.965 9.003 393 2HB PRO 47 HB3 PRO 47 -13.221 15.567 8.220 394 1HG PRO 47 HG2 PRO 47 -11.661 15.688 10.770 395 2HG PRO 47 HG3 PRO 47 -13.050 14.673 10.348 396 1HD PRO 47 HD2 PRO 47 -10.415 13.794 10.349 397 2HD PRO 47 HD3 PRO 47 -11.727 13.035 9.420 398 H LYS 48 H LYS 48 -9.826 16.296 10.013 399 HA LYS 48 HA LYS 48 -7.805 18.009 8.857 400 1HB LYS 48 HB2 LYS 48 -9.976 19.418 8.840 401 2HB LYS 48 HB3 LYS 48 -9.797 19.465 10.595 402 1HG LYS 48 HG2 LYS 48 -8.728 21.433 9.611 403 2HG LYS 48 HG3 LYS 48 -7.497 20.377 10.306 404 1HD LYS 48 HD2 LYS 48 -6.561 19.954 8.286 405 2HD LYS 48 HD3 LYS 48 -8.132 19.737 7.512 406 1HE LYS 48 HE2 LYS 48 -7.879 22.494 8.206 407 2HE LYS 48 HE3 LYS 48 -6.399 22.008 7.380 408 1HZ LYS 48 HZ1 LYS 48 -8.520 20.834 6.024 409 2HZ LYS 48 HZ2 LYS 48 -8.953 22.456 6.288 410 3HZ LYS 48 HZ3 LYS 48 -7.508 22.086 5.483 411 H LYS 49 H LYS 49 -9.681 17.306 11.806 412 HA LYS 49 HA LYS 49 -7.145 17.478 13.367 413 1HB LYS 49 HB2 LYS 49 -8.658 17.491 15.355 414 2HB LYS 49 HB3 LYS 49 -8.972 18.834 14.257 415 1HG LYS 49 HG2 LYS 49 -11.000 17.988 13.577 416 2HG LYS 49 HG3 LYS 49 -10.489 16.312 13.783 417 1HD LYS 49 HD2 LYS 49 -10.751 16.431 16.162 418 2HD LYS 49 HD3 LYS 49 -10.944 18.183 16.117 419 1HE LYS 49 HE2 LYS 49 -12.907 17.166 14.371 420 2HE LYS 49 HE3 LYS 49 -12.956 16.129 15.796 421 1HZ LYS 49 HZ1 LYS 49 -12.703 18.945 16.372 422 2HZ LYS 49 HZ2 LYS 49 -14.162 18.519 15.609 423 3HZ LYS 49 HZ3 LYS 49 -13.717 17.781 17.073 424 H GLY 50 H GLY 50 -7.932 15.211 11.599 425 1HA GLY 50 HA2 GLY 50 -7.620 12.878 11.739 426 2HA GLY 50 HA3 GLY 50 -7.333 13.068 13.469 427 H VAL 51 H VAL 51 -8.718 11.067 13.569 428 HA VAL 51 HA VAL 51 -11.558 11.878 13.882 429 HB VAL 51 HB VAL 51 -10.571 9.514 12.265 430 1HG1 VAL 51 HG11 VAL 51 -12.848 9.665 13.977 431 2HG1 VAL 51 HG12 VAL 51 -13.427 9.736 12.312 432 3HG1 VAL 51 HG13 VAL 51 -12.427 8.383 12.842 433 1HG2 VAL 51 HG21 VAL 51 -12.063 12.061 11.717 434 2HG2 VAL 51 HG22 VAL 51 -10.767 11.307 10.789 435 3HG2 VAL 51 HG23 VAL 51 -12.400 10.644 10.721 436 H GLU 52 H GLU 52 -10.462 8.550 13.926 437 HA GLU 52 HA GLU 52 -9.716 8.388 16.680 438 1HB GLU 52 HB2 GLU 52 -11.748 7.446 17.654 439 2HB GLU 52 HB3 GLU 52 -12.103 9.045 17.003 440 1HG GLU 52 HG2 GLU 52 -13.452 8.222 15.354 441 2HG GLU 52 HG3 GLU 52 -12.450 6.789 15.112 442 H LYS 53 H LYS 53 -9.637 6.062 17.401 443 HA LYS 53 HA LYS 53 -9.082 3.824 16.968 444 1HB LYS 53 HB2 LYS 53 -11.507 4.125 15.876 445 2HB LYS 53 HB3 LYS 53 -10.593 3.853 14.393 446 1HG LYS 53 HG2 LYS 53 -10.106 2.033 16.720 447 2HG LYS 53 HG3 LYS 53 -11.573 1.806 15.766 448 1HD LYS 53 HD2 LYS 53 -9.048 2.176 14.240 449 2HD LYS 53 HD3 LYS 53 -9.222 0.653 15.113 450 1HE LYS 53 HE2 LYS 53 -11.292 1.781 13.205 451 2HE LYS 53 HE3 LYS 53 -10.117 0.536 12.783 452 1HZ LYS 53 HZ1 LYS 53 -11.161 -0.470 15.022 453 2HZ LYS 53 HZ2 LYS 53 -12.513 0.347 14.397 454 3HZ LYS 53 HZ3 LYS 53 -11.734 -0.837 13.466 455 H TYR 54 H TYR 54 -6.871 4.505 16.514 456 HA TYR 54 HA TYR 54 -4.971 4.780 15.147 457 1HB TYR 54 HB2 TYR 54 -6.518 2.834 13.407 458 2HB TYR 54 HB3 TYR 54 -4.773 3.094 13.392 459 HD1 TYR 54 HD1 TYR 54 -3.706 2.984 15.901 460 HD2 TYR 54 HD2 TYR 54 -7.256 0.965 14.571 461 HE1 TYR 54 HE1 TYR 54 -3.440 1.318 17.719 462 HE2 TYR 54 HE2 TYR 54 -6.991 -0.700 16.388 463 HH TYR 54 HH TYR 54 -4.837 -0.254 18.991 464 H GLY 55 H GLY 55 -7.313 6.587 14.651 465 1HA GLY 55 HA2 GLY 55 -7.904 7.077 11.982 466 2HA GLY 55 HA3 GLY 55 -7.685 8.372 13.158 467 HA PRO 56 HA PRO 56 -4.122 9.610 10.873 468 1HB PRO 56 HB2 PRO 56 -3.005 11.221 12.775 469 2HB PRO 56 HB3 PRO 56 -4.458 11.670 11.865 470 1HG PRO 56 HG2 PRO 56 -4.220 10.701 14.680 471 2HG PRO 56 HG3 PRO 56 -5.380 11.838 13.975 472 1HD PRO 56 HD2 PRO 56 -5.915 9.154 14.541 473 2HD PRO 56 HD3 PRO 56 -6.851 10.165 13.419 474 H GLU 57 H GLU 57 -2.981 7.555 10.798 475 HA GLU 57 HA GLU 57 -0.633 7.488 12.582 476 1HB GLU 57 HB2 GLU 57 -2.533 6.102 13.629 477 2HB GLU 57 HB3 GLU 57 -2.298 4.985 12.284 478 1HG GLU 57 HG2 GLU 57 0.150 4.887 12.911 479 2HG GLU 57 HG3 GLU 57 -0.256 5.797 14.367 480 H ALA 58 H ALA 58 -2.160 5.077 10.423 481 HA ALA 58 HA ALA 58 0.165 4.204 9.153 482 1HB ALA 58 HB1 ALA 58 -2.089 3.203 8.814 483 2HB ALA 58 HB2 ALA 58 -2.535 4.593 7.824 484 3HB ALA 58 HB3 ALA 58 -1.258 3.501 7.287 485 H SER 59 H SER 59 -1.875 6.988 8.264 486 HA SER 59 HA SER 59 -0.700 7.806 5.890 487 1HB SER 59 HB2 SER 59 -1.775 9.779 6.262 488 2HB SER 59 HB3 SER 59 -2.433 8.956 7.672 489 HG SER 59 HG SER 59 -0.781 11.060 7.558 490 H ALA 60 H ALA 60 0.443 8.817 9.138 491 HA ALA 60 HA ALA 60 2.836 10.047 8.197 492 1HB ALA 60 HB1 ALA 60 1.916 10.384 10.479 493 2HB ALA 60 HB2 ALA 60 2.341 8.719 10.879 494 3HB ALA 60 HB3 ALA 60 3.609 9.891 10.523 495 H PHE 61 H PHE 61 2.076 6.711 9.044 496 HA PHE 61 HA PHE 61 4.630 5.588 9.223 497 1HB PHE 61 HB2 PHE 61 2.476 4.344 9.508 498 2HB PHE 61 HB3 PHE 61 2.279 4.364 7.756 499 HD1 PHE 61 HD1 PHE 61 3.830 3.115 6.293 500 HD2 PHE 61 HD2 PHE 61 4.123 2.922 10.576 501 HE1 PHE 61 HE1 PHE 61 5.283 1.114 6.104 502 HE2 PHE 61 HE2 PHE 61 5.576 0.921 10.385 503 HZ PHE 61 HZ PHE 61 6.157 0.018 8.149 504 H THR 62 H THR 62 2.729 5.482 6.208 505 HA THR 62 HA THR 62 5.012 4.978 4.554 506 HB THR 62 HB THR 62 2.368 6.235 3.754 507 HG1 THR 62 HG1 THR 62 3.198 3.527 3.899 508 1HG2 THR 62 HG21 THR 62 4.758 5.317 2.304 509 2HG2 THR 62 HG22 THR 62 3.245 4.648 1.691 510 3HG2 THR 62 HG23 THR 62 3.466 6.396 1.777 511 H LYS 63 H LYS 63 3.884 7.835 6.058 512 HA LYS 63 HA LYS 63 4.819 9.766 4.137 513 1HB LYS 63 HB2 LYS 63 3.234 10.260 6.022 514 2HB LYS 63 HB3 LYS 63 4.592 10.109 7.137 515 1HG LYS 63 HG2 LYS 63 5.301 12.189 6.653 516 2HG LYS 63 HG3 LYS 63 5.289 11.842 4.924 517 1HD LYS 63 HD2 LYS 63 3.150 12.662 4.632 518 2HD LYS 63 HD3 LYS 63 2.659 12.265 6.279 519 1HE LYS 63 HE2 LYS 63 2.825 14.630 6.267 520 2HE LYS 63 HE3 LYS 63 4.323 14.088 7.022 521 1HZ LYS 63 HZ1 LYS 63 4.353 14.341 4.126 522 2HZ LYS 63 HZ2 LYS 63 4.256 15.792 4.997 523 3HZ LYS 63 HZ3 LYS 63 5.554 14.727 5.265 524 H LYS 64 H LYS 64 6.242 9.280 7.361 525 HA LYS 64 HA LYS 64 8.785 10.313 6.673 526 1HB LYS 64 HB2 LYS 64 7.773 8.525 8.860 527 2HB LYS 64 HB3 LYS 64 9.512 8.756 8.677 528 1HG LYS 64 HG2 LYS 64 9.414 11.005 9.209 529 2HG LYS 64 HG3 LYS 64 7.759 11.178 8.625 530 1HD LYS 64 HD2 LYS 64 7.645 11.312 11.016 531 2HD LYS 64 HD3 LYS 64 7.043 9.712 10.579 532 1HE LYS 64 HE2 LYS 64 9.963 9.863 11.003 533 2HE LYS 64 HE3 LYS 64 8.988 10.149 12.445 534 1HZ LYS 64 HZ1 LYS 64 7.915 7.991 10.982 535 2HZ LYS 64 HZ2 LYS 64 9.570 7.713 11.252 536 3HZ LYS 64 HZ3 LYS 64 8.535 8.001 12.565 537 H MET 65 H MET 65 7.419 7.127 6.184 538 HA MET 65 HA MET 65 9.819 5.650 5.802 539 1HB MET 65 HB2 MET 65 6.975 5.332 5.125 540 2HB MET 65 HB3 MET 65 8.069 4.535 3.993 541 1HG MET 65 HG2 MET 65 8.519 4.224 6.946 542 2HG MET 65 HG3 MET 65 7.281 3.253 6.149 543 1HE MET 65 HE1 MET 65 7.659 2.658 3.822 544 2HE MET 65 HE2 MET 65 9.203 2.388 3.018 545 3HE MET 65 HE3 MET 65 8.437 1.082 3.934 546 H VAL 66 H VAL 66 7.705 6.671 3.125 547 HA VAL 66 HA VAL 66 9.748 6.509 1.145 548 HB VAL 66 HB VAL 66 8.209 7.781 -0.283 549 1HG1 VAL 66 HG11 VAL 66 6.973 5.744 1.576 550 2HG1 VAL 66 HG12 VAL 66 6.099 6.401 0.192 551 3HG1 VAL 66 HG13 VAL 66 7.590 5.492 -0.056 552 1HG2 VAL 66 HG21 VAL 66 7.490 8.965 2.199 553 2HG2 VAL 66 HG22 VAL 66 6.877 9.372 0.598 554 3HG2 VAL 66 HG23 VAL 66 6.048 8.163 1.579 555 H GLU 67 H GLU 67 9.138 8.875 3.559 556 HA GLU 67 HA GLU 67 10.329 11.125 2.165 557 1HB GLU 67 HB2 GLU 67 9.311 10.551 4.887 558 2HB GLU 67 HB3 GLU 67 10.581 11.772 4.792 559 1HG GLU 67 HG2 GLU 67 9.056 12.576 2.719 560 2HG GLU 67 HG3 GLU 67 7.806 11.839 3.723 561 H ASN 68 H ASN 68 11.538 8.525 4.202 562 HA ASN 68 HA ASN 68 14.256 9.752 4.079 563 1HB ASN 68 HB2 ASN 68 13.375 7.412 5.788 564 2HB ASN 68 HB3 ASN 68 14.849 8.366 5.951 565 1HD2 ASN 68 HD21 ASN 68 12.832 8.048 8.057 566 2HD2 ASN 68 HD22 ASN 68 12.198 9.590 8.371 567 H ALA 69 H ALA 69 12.365 7.522 2.480 568 HA ALA 69 HA ALA 69 14.143 5.318 2.109 569 1HB ALA 69 HB1 ALA 69 12.037 6.485 0.263 570 2HB ALA 69 HB2 ALA 69 12.846 4.943 -0.007 571 3HB ALA 69 HB3 ALA 69 11.817 5.163 1.408 572 H LYS 70 H LYS 70 16.134 5.364 1.192 573 HA LYS 70 HA LYS 70 17.112 7.681 -0.233 574 1HB LYS 70 HB2 LYS 70 18.314 4.899 -0.135 575 2HB LYS 70 HB3 LYS 70 19.155 6.398 -0.533 576 1HG LYS 70 HG2 LYS 70 18.764 7.259 1.719 577 2HG LYS 70 HG3 LYS 70 17.826 5.823 2.131 578 1HD LYS 70 HD2 LYS 70 19.822 4.414 1.736 579 2HD LYS 70 HD3 LYS 70 20.758 5.860 1.358 580 1HE LYS 70 HE2 LYS 70 19.499 6.394 3.822 581 2HE LYS 70 HE3 LYS 70 20.111 4.745 3.946 582 1HZ LYS 70 HZ1 LYS 70 21.812 6.873 2.830 583 2HZ LYS 70 HZ2 LYS 70 21.658 6.706 4.513 584 3HZ LYS 70 HZ3 LYS 70 22.268 5.424 3.581 585 H LYS 71 H LYS 71 15.642 4.648 -1.199 586 HA LYS 71 HA LYS 71 15.644 5.634 -4.003 587 1HB LYS 71 HB2 LYS 71 16.948 3.155 -2.990 588 2HB LYS 71 HB3 LYS 71 16.036 3.015 -4.495 589 1HG LYS 71 HG2 LYS 71 17.492 4.346 -5.659 590 2HG LYS 71 HG3 LYS 71 17.826 5.375 -4.265 591 1HD LYS 71 HD2 LYS 71 18.973 3.164 -3.339 592 2HD LYS 71 HD3 LYS 71 19.098 2.785 -5.058 593 1HE LYS 71 HE2 LYS 71 21.114 3.960 -4.395 594 2HE LYS 71 HE3 LYS 71 20.157 5.036 -5.412 595 1HZ LYS 71 HZ1 LYS 71 19.735 5.099 -2.513 596 2HZ LYS 71 HZ2 LYS 71 21.121 5.847 -3.142 597 3HZ LYS 71 HZ3 LYS 71 19.580 6.346 -3.655 598 H ILE 72 H ILE 72 13.657 5.353 -4.919 599 HA ILE 72 HA ILE 72 11.798 3.409 -3.607 600 HB ILE 72 HB ILE 72 11.149 6.111 -4.827 601 1HG1 ILE 72 HG12 ILE 72 10.558 5.334 -1.997 602 2HG1 ILE 72 HG13 ILE 72 12.221 5.752 -2.411 603 1HG2 ILE 72 HG21 ILE 72 9.540 3.751 -4.379 604 2HG2 ILE 72 HG22 ILE 72 8.981 5.067 -3.345 605 3HG2 ILE 72 HG23 ILE 72 9.066 5.293 -5.092 606 1HD1 ILE 72 HD11 ILE 72 10.984 7.793 -3.634 607 2HD1 ILE 72 HD12 ILE 72 9.786 7.473 -2.381 608 3HD1 ILE 72 HD13 ILE 72 11.446 7.867 -1.933 609 H GLU 73 H GLU 73 11.129 1.839 -4.984 610 HA GLU 73 HA GLU 73 11.069 2.465 -7.908 611 1HB GLU 73 HB2 GLU 73 11.769 -0.277 -6.882 612 2HB GLU 73 HB3 GLU 73 12.127 0.443 -8.452 613 1HG GLU 73 HG2 GLU 73 14.187 0.827 -7.581 614 2HG GLU 73 HG3 GLU 73 13.408 2.168 -6.743 615 H VAL 74 H VAL 74 9.101 2.052 -8.792 616 HA VAL 74 HA VAL 74 7.070 0.666 -7.165 617 HB VAL 74 HB VAL 74 5.498 1.422 -8.880 618 1HG1 VAL 74 HG11 VAL 74 6.861 3.039 -7.166 619 2HG1 VAL 74 HG12 VAL 74 7.222 3.826 -8.701 620 3HG1 VAL 74 HG13 VAL 74 5.546 3.603 -8.198 621 1HG2 VAL 74 HG21 VAL 74 8.043 1.837 -10.389 622 2HG2 VAL 74 HG22 VAL 74 6.484 1.246 -10.962 623 3HG2 VAL 74 HG23 VAL 74 6.725 2.970 -10.685 624 H GLU 75 H GLU 75 5.794 -1.123 -8.106 625 HA GLU 75 HA GLU 75 7.232 -2.604 -10.263 626 1HB GLU 75 HB2 GLU 75 7.857 -3.514 -8.012 627 2HB GLU 75 HB3 GLU 75 6.154 -3.874 -7.730 628 1HG GLU 75 HG2 GLU 75 6.087 -5.508 -9.417 629 2HG GLU 75 HG3 GLU 75 7.535 -4.884 -10.208 630 H PHE 76 H PHE 76 5.476 -1.838 -11.634 631 HA PHE 76 HA PHE 76 2.723 -2.152 -11.147 632 1HB PHE 76 HB2 PHE 76 4.281 -2.403 -13.735 633 2HB PHE 76 HB3 PHE 76 2.519 -2.350 -13.658 634 HD1 PHE 76 HD1 PHE 76 1.532 -0.358 -12.195 635 HD2 PHE 76 HD2 PHE 76 5.438 -0.394 -13.981 636 HE1 PHE 76 HE1 PHE 76 1.610 2.117 -12.074 637 HE2 PHE 76 HE2 PHE 76 5.516 2.081 -13.860 638 HZ PHE 76 HZ PHE 76 3.602 3.338 -12.908 639 H ASP 77 H ASP 77 1.278 -3.877 -11.420 640 HA ASP 77 HA ASP 77 2.498 -6.553 -11.295 641 1HB ASP 77 HB2 ASP 77 0.371 -5.515 -10.003 642 2HB ASP 77 HB3 ASP 77 -0.459 -6.232 -11.385 643 H LYS 78 H LYS 78 0.682 -8.170 -12.536 644 HA LYS 78 HA LYS 78 1.241 -7.605 -15.374 645 1HB LYS 78 HB2 LYS 78 0.365 -9.896 -15.737 646 2HB LYS 78 HB3 LYS 78 1.627 -9.873 -14.503 647 1HG LYS 78 HG2 LYS 78 -0.917 -9.377 -13.257 648 2HG LYS 78 HG3 LYS 78 -1.027 -10.838 -14.238 649 1HD LYS 78 HD2 LYS 78 1.450 -10.577 -12.638 650 2HD LYS 78 HD3 LYS 78 -0.030 -10.800 -11.705 651 1HE LYS 78 HE2 LYS 78 0.287 -12.550 -14.083 652 2HE LYS 78 HE3 LYS 78 1.380 -12.866 -12.735 653 1HZ LYS 78 HZ1 LYS 78 -1.385 -12.414 -12.005 654 2HZ LYS 78 HZ2 LYS 78 -1.104 -13.830 -12.902 655 3HZ LYS 78 HZ3 LYS 78 -0.286 -13.579 -11.439 656 H GLY 79 H GLY 79 -1.396 -7.353 -13.153 657 1HA GLY 79 HA2 GLY 79 -3.536 -7.535 -15.096 658 2HA GLY 79 HA3 GLY 79 -3.673 -6.844 -13.479 659 H GLN 80 H GLN 80 -4.727 -4.925 -14.028 660 HA GLN 80 HA GLN 80 -3.776 -3.259 -16.234 661 1HB GLN 80 HB2 GLN 80 -5.720 -2.606 -13.996 662 2HB GLN 80 HB3 GLN 80 -5.491 -1.674 -15.476 663 1HG GLN 80 HG2 GLN 80 -6.302 -4.592 -15.471 664 2HG GLN 80 HG3 GLN 80 -7.467 -3.269 -15.507 665 1HE2 GLN 80 HE21 GLN 80 -7.898 -4.482 -17.720 666 2HE2 GLN 80 HE22 GLN 80 -7.021 -3.910 -19.054 667 H ARG 81 H ARG 81 -2.446 -1.464 -16.074 668 HA ARG 81 HA ARG 81 -0.928 -1.179 -13.571 669 1HB ARG 81 HB2 ARG 81 -0.678 0.320 -16.197 670 2HB ARG 81 HB3 ARG 81 0.481 0.361 -14.867 671 1HG ARG 81 HG2 ARG 81 0.939 -2.013 -15.127 672 2HG ARG 81 HG3 ARG 81 -0.320 -2.158 -16.354 673 1HD ARG 81 HD2 ARG 81 1.238 -0.097 -17.334 674 2HD ARG 81 HD3 ARG 81 2.434 -1.174 -16.614 675 HE ARG 81 HE ARG 81 0.426 -2.153 -18.607 676 1HH1 ARG 81 HH11 ARG 81 3.130 -2.958 -16.797 677 2HH1 ARG 81 HH12 ARG 81 4.036 -3.622 -18.116 678 1HH2 ARG 81 HH21 ARG 81 1.789 -2.565 -20.536 679 2HH2 ARG 81 HH22 ARG 81 3.277 -3.399 -20.233 680 H THR 82 H THR 82 -3.851 -0.088 -14.418 681 HA THR 82 HA THR 82 -3.559 2.339 -12.742 682 HB THR 82 HB THR 82 -5.234 3.369 -14.573 683 HG1 THR 82 HG1 THR 82 -4.492 2.751 -16.628 684 1HG2 THR 82 HG21 THR 82 -2.828 4.037 -13.691 685 2HG2 THR 82 HG22 THR 82 -2.325 3.449 -15.276 686 3HG2 THR 82 HG23 THR 82 -3.485 4.773 -15.153 687 H ASP 83 H ASP 83 -5.699 3.095 -11.960 688 HA ASP 83 HA ASP 83 -7.647 0.831 -11.870 689 1HB ASP 83 HB2 ASP 83 -6.486 2.387 -9.820 690 2HB ASP 83 HB3 ASP 83 -8.165 2.915 -9.933 691 H LYS 84 H LYS 84 -9.824 2.380 -10.884 692 HA LYS 84 HA LYS 84 -10.859 3.426 -13.378 693 1HB LYS 84 HB2 LYS 84 -12.185 4.091 -10.787 694 2HB LYS 84 HB3 LYS 84 -12.894 3.527 -12.297 695 1HG LYS 84 HG2 LYS 84 -11.687 1.296 -11.815 696 2HG LYS 84 HG3 LYS 84 -11.490 1.912 -10.173 697 1HD LYS 84 HD2 LYS 84 -14.184 1.872 -11.540 698 2HD LYS 84 HD3 LYS 84 -13.582 0.483 -10.634 699 1HE LYS 84 HE2 LYS 84 -13.261 1.970 -8.652 700 2HE LYS 84 HE3 LYS 84 -13.994 3.290 -9.564 701 1HZ LYS 84 HZ1 LYS 84 -15.521 0.840 -9.560 702 2HZ LYS 84 HZ2 LYS 84 -15.354 1.554 -8.030 703 3HZ LYS 84 HZ3 LYS 84 -16.032 2.441 -9.312 704 H TYR 85 H TYR 85 -9.520 4.822 -10.437 705 HA TYR 85 HA TYR 85 -10.157 7.564 -11.251 706 1HB TYR 85 HB2 TYR 85 -8.332 6.528 -9.058 707 2HB TYR 85 HB3 TYR 85 -8.858 8.201 -9.252 708 HD1 TYR 85 HD1 TYR 85 -10.066 4.730 -8.641 709 HD2 TYR 85 HD2 TYR 85 -10.991 8.922 -8.482 710 HE1 TYR 85 HE1 TYR 85 -12.145 4.223 -7.389 711 HE2 TYR 85 HE2 TYR 85 -13.071 8.415 -7.230 712 HH TYR 85 HH TYR 85 -13.703 5.310 -5.899 713 H GLY 86 H GLY 86 -8.091 5.440 -12.550 714 1HA GLY 86 HA2 GLY 86 -6.290 5.798 -14.033 715 2HA GLY 86 HA3 GLY 86 -6.400 7.523 -13.677 716 H ARG 87 H ARG 87 -6.284 5.833 -10.789 717 HA ARG 87 HA ARG 87 -3.699 6.849 -10.087 718 1HB ARG 87 HB2 ARG 87 -5.712 5.044 -8.844 719 2HB ARG 87 HB3 ARG 87 -4.057 4.900 -8.251 720 1HG ARG 87 HG2 ARG 87 -3.990 7.319 -7.806 721 2HG ARG 87 HG3 ARG 87 -5.633 7.486 -8.425 722 1HD ARG 87 HD2 ARG 87 -4.915 5.670 -6.111 723 2HD ARG 87 HD3 ARG 87 -5.462 7.333 -5.900 724 HE ARG 87 HE ARG 87 -7.497 6.426 -7.360 725 1HH1 ARG 87 HH11 ARG 87 -5.874 3.819 -6.249 726 2HH1 ARG 87 HH12 ARG 87 -7.093 3.246 -5.160 727 1HH2 ARG 87 HH21 ARG 87 -9.009 6.130 -5.366 728 2HH2 ARG 87 HH22 ARG 87 -8.868 4.554 -4.663 729 H GLY 88 H GLY 88 -1.682 5.817 -10.028 730 1HA GLY 88 HA2 GLY 88 -1.320 3.607 -11.889 731 2HA GLY 88 HA3 GLY 88 -0.047 4.377 -10.941 732 H LEU 89 H LEU 89 -1.760 1.541 -11.297 733 HA LEU 89 HA LEU 89 -1.654 0.798 -8.435 734 1HB LEU 89 HB2 LEU 89 -2.481 -0.931 -10.781 735 2HB LEU 89 HB3 LEU 89 -2.851 -1.186 -9.076 736 HG LEU 89 HG LEU 89 -3.837 1.103 -10.800 737 1HD1 LEU 89 HD11 LEU 89 -4.808 -1.453 -10.646 738 2HD1 LEU 89 HD12 LEU 89 -5.716 -0.662 -9.360 739 3HD1 LEU 89 HD13 LEU 89 -5.796 -0.038 -11.007 740 1HD2 LEU 89 HD21 LEU 89 -3.953 0.545 -7.843 741 2HD2 LEU 89 HD22 LEU 89 -3.589 2.060 -8.669 742 3HD2 LEU 89 HD23 LEU 89 -5.246 1.456 -8.622 743 H ALA 90 H ALA 90 0.151 -0.130 -7.616 744 HA ALA 90 HA ALA 90 1.605 -2.198 -9.008 745 1HB ALA 90 HB1 ALA 90 2.774 0.588 -8.926 746 2HB ALA 90 HB2 ALA 90 3.789 -0.847 -9.066 747 3HB ALA 90 HB3 ALA 90 2.604 -0.481 -10.319 748 H TYR 91 H TYR 91 3.912 -2.378 -7.730 749 HA TYR 91 HA TYR 91 3.178 -2.187 -4.838 750 1HB TYR 91 HB2 TYR 91 5.234 -4.018 -6.106 751 2HB TYR 91 HB3 TYR 91 4.604 -4.099 -4.461 752 HD1 TYR 91 HD1 TYR 91 1.877 -4.102 -4.412 753 HD2 TYR 91 HD2 TYR 91 4.349 -5.558 -7.610 754 HE1 TYR 91 HE1 TYR 91 0.018 -5.546 -5.191 755 HE2 TYR 91 HE2 TYR 91 2.489 -7.002 -8.390 756 HH TYR 91 HH TYR 91 0.215 -8.040 -6.885 757 H ILE 92 H ILE 92 4.197 -0.487 -3.898 758 HA ILE 92 HA ILE 92 6.636 0.649 -5.039 759 HB ILE 92 HB ILE 92 5.235 1.287 -2.426 760 1HG1 ILE 92 HG12 ILE 92 5.023 2.717 -5.088 761 2HG1 ILE 92 HG13 ILE 92 3.853 1.512 -4.547 762 1HG2 ILE 92 HG21 ILE 92 7.741 2.036 -3.181 763 2HG2 ILE 92 HG22 ILE 92 6.788 3.322 -3.918 764 3HG2 ILE 92 HG23 ILE 92 6.686 3.034 -2.182 765 1HD1 ILE 92 HD11 ILE 92 3.785 2.985 -2.365 766 2HD1 ILE 92 HD12 ILE 92 4.411 4.242 -3.432 767 3HD1 ILE 92 HD13 ILE 92 2.862 3.478 -3.785 768 H TYR 93 H TYR 93 8.711 0.569 -4.134 769 HA TYR 93 HA TYR 93 9.070 -1.250 -1.791 770 1HB TYR 93 HB2 TYR 93 10.611 -1.243 -4.401 771 2HB TYR 93 HB3 TYR 93 11.175 -2.063 -2.945 772 HD1 TYR 93 HD1 TYR 93 8.587 -2.008 -5.577 773 HD2 TYR 93 HD2 TYR 93 10.076 -4.064 -2.112 774 HE1 TYR 93 HE1 TYR 93 7.145 -3.953 -6.111 775 HE2 TYR 93 HE2 TYR 93 8.635 -6.010 -2.647 776 HH TYR 93 HH TYR 93 6.103 -5.988 -4.422 777 H ALA 94 H ALA 94 10.109 -0.146 -0.204 778 HA ALA 94 HA ALA 94 11.832 2.158 -1.005 779 1HB ALA 94 HB1 ALA 94 9.827 2.548 0.524 780 2HB ALA 94 HB2 ALA 94 10.691 1.617 1.747 781 3HB ALA 94 HB3 ALA 94 11.376 3.124 1.140 782 H ASP 95 H ASP 95 13.987 1.870 -0.772 783 HA ASP 95 HA ASP 95 16.035 1.046 0.011 784 1HB ASP 95 HB2 ASP 95 14.370 0.212 2.405 785 2HB ASP 95 HB3 ASP 95 16.132 0.285 2.350 786 H GLY 96 H GLY 96 14.441 -0.600 -1.711 787 1HA GLY 96 HA2 GLY 96 14.538 -2.791 -2.549 788 2HA GLY 96 HA3 GLY 96 15.777 -3.124 -1.340 789 H LYS 97 H LYS 97 12.886 -1.848 -0.033 790 HA LYS 97 HA LYS 97 12.038 -4.610 0.754 791 1HB LYS 97 HB2 LYS 97 13.042 -3.017 2.550 792 2HB LYS 97 HB3 LYS 97 11.510 -2.153 2.420 793 1HG LYS 97 HG2 LYS 97 10.523 -3.683 3.738 794 2HG LYS 97 HG3 LYS 97 10.943 -4.953 2.589 795 1HD LYS 97 HD2 LYS 97 12.503 -5.758 3.994 796 2HD LYS 97 HD3 LYS 97 13.299 -4.185 4.050 797 1HE LYS 97 HE2 LYS 97 12.134 -3.511 5.951 798 2HE LYS 97 HE3 LYS 97 10.785 -4.602 5.635 799 1HZ LYS 97 HZ1 LYS 97 12.811 -6.323 5.934 800 2HZ LYS 97 HZ2 LYS 97 13.281 -5.095 7.010 801 3HZ LYS 97 HZ3 LYS 97 11.771 -5.854 7.189 802 H MET 98 H MET 98 9.677 -4.796 1.197 803 HA MET 98 HA MET 98 8.154 -3.273 -0.814 804 1HB MET 98 HB2 MET 98 7.888 -5.758 -0.511 805 2HB MET 98 HB3 MET 98 7.178 -5.436 1.071 806 1HG MET 98 HG2 MET 98 5.473 -3.978 -0.067 807 2HG MET 98 HG3 MET 98 6.121 -4.516 -1.616 808 1HE MET 98 HE1 MET 98 6.710 -7.070 -1.925 809 2HE MET 98 HE2 MET 98 5.296 -8.132 -1.974 810 3HE MET 98 HE3 MET 98 5.280 -6.598 -2.840 811 H VAL 99 H VAL 99 7.109 -1.425 -0.268 812 HA VAL 99 HA VAL 99 6.922 -0.492 2.444 813 HB VAL 99 HB VAL 99 5.320 0.441 0.043 814 1HG1 VAL 99 HG11 VAL 99 5.731 1.389 2.821 815 2HG1 VAL 99 HG12 VAL 99 5.850 2.629 1.572 816 3HG1 VAL 99 HG13 VAL 99 4.379 1.669 1.723 817 1HG2 VAL 99 HG21 VAL 99 8.173 0.741 0.809 818 2HG2 VAL 99 HG22 VAL 99 7.419 0.845 -0.781 819 3HG2 VAL 99 HG23 VAL 99 7.355 2.224 0.316 820 H ASN 100 H ASN 100 4.561 -1.973 0.227 821 HA ASN 100 HA ASN 100 2.297 -1.770 1.947 822 1HB ASN 100 HB2 ASN 100 2.958 -3.921 -0.091 823 2HB ASN 100 HB3 ASN 100 1.361 -3.619 0.597 824 1HD2 ASN 100 HD21 ASN 100 0.888 -3.241 -1.858 825 2HD2 ASN 100 HD22 ASN 100 1.120 -1.664 -2.440 826 H GLU 101 H GLU 101 4.822 -4.260 1.664 827 HA GLU 101 HA GLU 101 3.692 -6.082 3.555 828 1HB GLU 101 HB2 GLU 101 5.719 -6.378 1.927 829 2HB GLU 101 HB3 GLU 101 6.663 -5.705 3.257 830 1HG GLU 101 HG2 GLU 101 6.416 -7.567 4.549 831 2HG GLU 101 HG3 GLU 101 4.755 -7.835 4.020 832 H ALA 102 H ALA 102 5.713 -3.214 3.906 833 HA ALA 102 HA ALA 102 6.351 -3.552 6.678 834 1HB ALA 102 HB1 ALA 102 6.263 -1.235 4.780 835 2HB ALA 102 HB2 ALA 102 6.394 -0.904 6.507 836 3HB ALA 102 HB3 ALA 102 7.626 -1.874 5.698 837 H LEU 103 H LEU 103 3.682 -1.886 5.029 838 HA LEU 103 HA LEU 103 2.374 -0.890 7.352 839 1HB LEU 103 HB2 LEU 103 1.369 -1.709 4.622 840 2HB LEU 103 HB3 LEU 103 0.275 -1.096 5.863 841 HG LEU 103 HG LEU 103 2.714 0.517 5.503 842 1HD1 LEU 103 HD11 LEU 103 0.718 0.115 3.268 843 2HD1 LEU 103 HD12 LEU 103 1.662 1.597 3.421 844 3HD1 LEU 103 HD13 LEU 103 2.479 0.052 3.181 845 1HD2 LEU 103 HD21 LEU 103 0.049 0.772 6.459 846 2HD2 LEU 103 HD22 LEU 103 1.318 1.998 6.472 847 3HD2 LEU 103 HD23 LEU 103 0.214 1.885 5.101 848 H VAL 104 H VAL 104 2.041 -3.991 5.632 849 HA VAL 104 HA VAL 104 0.006 -5.057 7.354 850 HB VAL 104 HB VAL 104 2.117 -6.612 5.829 851 1HG1 VAL 104 HG11 VAL 104 -0.525 -7.239 7.100 852 2HG1 VAL 104 HG12 VAL 104 -0.053 -8.118 5.646 853 3HG1 VAL 104 HG13 VAL 104 0.961 -8.187 7.087 854 1HG2 VAL 104 HG21 VAL 104 0.905 -4.875 4.443 855 2HG2 VAL 104 HG22 VAL 104 0.639 -6.537 3.916 856 3HG2 VAL 104 HG23 VAL 104 -0.602 -5.697 4.845 857 H ARG 105 H ARG 105 3.485 -4.807 7.601 858 HA ARG 105 HA ARG 105 3.840 -6.764 9.687 859 1HB ARG 105 HB2 ARG 105 5.799 -6.080 8.502 860 2HB ARG 105 HB3 ARG 105 5.463 -4.373 8.789 861 1HG ARG 105 HG2 ARG 105 6.386 -4.417 10.864 862 2HG ARG 105 HG3 ARG 105 5.670 -5.982 11.247 863 1HD ARG 105 HD2 ARG 105 7.390 -7.142 9.989 864 2HD ARG 105 HD3 ARG 105 8.053 -5.612 9.413 865 HE ARG 105 HE ARG 105 9.042 -5.273 11.557 866 1HH1 ARG 105 HH11 ARG 105 6.513 -7.566 11.786 867 2HH1 ARG 105 HH12 ARG 105 7.178 -8.380 13.163 868 1HH2 ARG 105 HH21 ARG 105 10.091 -6.495 13.201 869 2HH2 ARG 105 HH22 ARG 105 9.205 -7.773 13.964 870 H GLN 106 H GLN 106 2.879 -3.389 9.625 871 HA GLN 106 HA GLN 106 2.900 -3.322 12.604 872 1HB GLN 106 HB2 GLN 106 3.519 -1.395 10.629 873 2HB GLN 106 HB3 GLN 106 2.009 -0.864 11.372 874 1HG GLN 106 HG2 GLN 106 3.626 0.075 12.788 875 2HG GLN 106 HG3 GLN 106 3.209 -1.421 13.624 876 1HE2 GLN 106 HE21 GLN 106 5.125 -2.277 14.451 877 2HE2 GLN 106 HE22 GLN 106 6.582 -2.404 13.591 878 H GLY 107 H GLY 107 0.909 -4.704 10.709 879 1HA GLY 107 HA2 GLY 107 -1.430 -4.893 10.467 880 2HA GLY 107 HA3 GLY 107 -1.424 -4.529 12.192 881 H LEU 108 H LEU 108 -0.807 -2.634 9.216 882 HA LEU 108 HA LEU 108 -2.727 -0.604 10.287 883 1HB LEU 108 HB2 LEU 108 -0.195 -0.205 8.667 884 2HB LEU 108 HB3 LEU 108 -1.364 1.074 9.000 885 HG LEU 108 HG LEU 108 0.185 -0.517 11.064 886 1HD1 LEU 108 HD11 LEU 108 0.583 2.054 9.696 887 2HD1 LEU 108 HD12 LEU 108 0.655 2.172 11.454 888 3HD1 LEU 108 HD13 LEU 108 1.736 1.071 10.599 889 1HD2 LEU 108 HD21 LEU 108 -1.961 1.608 11.322 890 2HD2 LEU 108 HD22 LEU 108 -2.009 -0.041 11.948 891 3HD2 LEU 108 HD23 LEU 108 -0.899 1.137 12.648 892 H ALA 109 H ALA 109 -2.360 -2.929 7.981 893 HA ALA 109 HA ALA 109 -4.345 -1.599 6.225 894 1HB ALA 109 HB1 ALA 109 -1.660 -2.670 5.356 895 2HB ALA 109 HB2 ALA 109 -3.020 -2.600 4.236 896 3HB ALA 109 HB3 ALA 109 -2.402 -1.119 4.965 897 H LYS 110 H LYS 110 -5.920 -3.040 5.601 898 HA LYS 110 HA LYS 110 -5.540 -5.870 6.430 899 1HB LYS 110 HB2 LYS 110 -8.071 -4.420 5.593 900 2HB LYS 110 HB3 LYS 110 -7.977 -6.040 6.287 901 1HG LYS 110 HG2 LYS 110 -6.681 -4.801 8.226 902 2HG LYS 110 HG3 LYS 110 -7.533 -3.385 7.610 903 1HD LYS 110 HD2 LYS 110 -8.959 -5.970 8.260 904 2HD LYS 110 HD3 LYS 110 -8.730 -4.692 9.453 905 1HE LYS 110 HE2 LYS 110 -10.468 -3.549 8.602 906 2HE LYS 110 HE3 LYS 110 -9.696 -3.519 7.018 907 1HZ LYS 110 HZ1 LYS 110 -10.538 -5.970 6.948 908 2HZ LYS 110 HZ2 LYS 110 -11.659 -5.412 8.096 909 3HZ LYS 110 HZ3 LYS 110 -11.583 -4.692 6.560 910 H VAL 111 H VAL 111 -5.868 -7.582 4.954 911 HA VAL 111 HA VAL 111 -5.178 -7.015 2.207 912 HB VAL 111 HB VAL 111 -6.247 -9.576 3.436 913 1HG1 VAL 111 HG11 VAL 111 -6.134 -9.094 0.817 914 2HG1 VAL 111 HG12 VAL 111 -4.427 -9.464 1.063 915 3HG1 VAL 111 HG13 VAL 111 -5.657 -10.658 1.478 916 1HG2 VAL 111 HG21 VAL 111 -3.941 -8.268 4.126 917 2HG2 VAL 111 HG22 VAL 111 -4.146 -10.019 4.204 918 3HG2 VAL 111 HG23 VAL 111 -3.375 -9.283 2.799 919 H ALA 112 H ALA 112 -6.535 -6.572 0.535 920 HA ALA 112 HA ALA 112 -9.247 -7.633 0.426 921 1HB ALA 112 HB1 ALA 112 -9.214 -5.500 1.976 922 2HB ALA 112 HB2 ALA 112 -9.117 -4.633 0.443 923 3HB ALA 112 HB3 ALA 112 -10.490 -5.690 0.773 924 H TYR 113 H TYR 113 -10.379 -6.105 -1.491 925 HA TYR 113 HA TYR 113 -10.318 -5.835 -3.826 926 1HB TYR 113 HB2 TYR 113 -7.611 -4.644 -3.147 927 2HB TYR 113 HB3 TYR 113 -8.529 -4.355 -4.625 928 HD1 TYR 113 HD1 TYR 113 -10.868 -3.325 -4.414 929 HD2 TYR 113 HD2 TYR 113 -8.011 -3.355 -1.206 930 HE1 TYR 113 HE1 TYR 113 -12.112 -1.496 -3.292 931 HE2 TYR 113 HE2 TYR 113 -9.254 -1.527 -0.082 932 HH TYR 113 HH TYR 113 -11.381 0.411 -1.532 933 H VAL 114 H VAL 114 -10.123 -8.229 -4.042 934 HA VAL 114 HA VAL 114 -7.401 -9.031 -4.993 935 HB VAL 114 HB VAL 114 -9.630 -10.648 -3.737 936 1HG1 VAL 114 HG11 VAL 114 -7.752 -11.456 -5.754 937 2HG1 VAL 114 HG12 VAL 114 -7.333 -12.248 -4.235 938 3HG1 VAL 114 HG13 VAL 114 -8.950 -12.440 -4.914 939 1HG2 VAL 114 HG21 VAL 114 -7.148 -9.461 -2.833 940 2HG2 VAL 114 HG22 VAL 114 -8.388 -10.286 -1.889 941 3HG2 VAL 114 HG23 VAL 114 -7.091 -11.213 -2.643 942 H TYR 115 H TYR 115 -7.710 -8.390 -7.171 943 HA TYR 115 HA TYR 115 -9.839 -9.913 -8.623 944 1HB TYR 115 HB2 TYR 115 -8.643 -7.341 -9.643 945 2HB TYR 115 HB3 TYR 115 -10.173 -8.099 -10.091 946 HD1 TYR 115 HD1 TYR 115 -11.856 -8.462 -8.052 947 HD2 TYR 115 HD2 TYR 115 -8.704 -5.548 -8.159 948 HE1 TYR 115 HE1 TYR 115 -13.025 -7.134 -6.315 949 HE2 TYR 115 HE2 TYR 115 -9.872 -4.218 -6.422 950 HH TYR 115 HH TYR 115 -12.660 -4.150 -5.729 951 H LYS 116 H LYS 116 -9.051 -11.333 -10.097 952 HA LYS 116 HA LYS 116 -6.168 -11.441 -10.598 953 1HB LYS 116 HB2 LYS 116 -8.482 -13.108 -11.637 954 2HB LYS 116 HB3 LYS 116 -6.783 -13.451 -11.965 955 1HG LYS 116 HG2 LYS 116 -6.491 -13.373 -9.386 956 2HG LYS 116 HG3 LYS 116 -8.244 -13.549 -9.331 957 1HD LYS 116 HD2 LYS 116 -6.482 -15.416 -10.927 958 2HD LYS 116 HD3 LYS 116 -6.900 -15.722 -9.241 959 1HE LYS 116 HE2 LYS 116 -8.713 -16.781 -10.124 960 2HE LYS 116 HE3 LYS 116 -9.356 -15.146 -10.291 961 1HZ LYS 116 HZ1 LYS 116 -7.607 -16.102 -12.417 962 2HZ LYS 116 HZ2 LYS 116 -9.147 -16.807 -12.327 963 3HZ LYS 116 HZ3 LYS 116 -8.995 -15.125 -12.506 964 HA PRO 117 HA PRO 117 -5.130 -12.682 -12.273 965 1HB PRO 117 HB2 PRO 117 -2.954 -11.843 -13.693 966 2HB PRO 117 HB3 PRO 117 -4.245 -12.831 -14.399 967 1HG PRO 117 HG2 PRO 117 -3.716 -9.908 -14.717 968 2HG PRO 117 HG3 PRO 117 -4.396 -11.062 -15.876 969 1HD PRO 117 HD2 PRO 117 -5.889 -9.237 -14.378 970 2HD PRO 117 HD3 PRO 117 -6.542 -10.699 -15.150 971 H ASN 118 H ASN 118 -5.301 -9.401 -11.665 972 HA ASN 118 HA ASN 118 -2.751 -8.771 -10.569 973 1HB ASN 118 HB2 ASN 118 -5.521 -7.740 -10.268 974 2HB ASN 118 HB3 ASN 118 -4.406 -7.359 -8.956 975 1HD2 ASN 118 HD21 ASN 118 -5.170 -5.159 -10.353 976 2HD2 ASN 118 HD22 ASN 118 -3.961 -4.647 -11.429 977 H ASN 119 H ASN 119 -2.019 -10.663 -9.429 978 HA ASN 119 HA ASN 119 -2.841 -10.738 -6.635 979 1HB ASN 119 HB2 ASN 119 -4.155 -12.467 -8.465 980 2HB ASN 119 HB3 ASN 119 -3.046 -13.461 -7.526 981 1HD2 ASN 119 HD21 ASN 119 -5.122 -14.361 -6.545 982 2HD2 ASN 119 HD22 ASN 119 -5.842 -13.509 -5.266 983 H THR 120 H THR 120 -0.421 -10.489 -8.489 984 HA THR 120 HA THR 120 1.236 -12.784 -8.238 985 HB THR 120 HB THR 120 2.099 -9.875 -8.219 986 HG1 THR 120 HG1 THR 120 2.416 -10.553 -10.541 987 1HG2 THR 120 HG21 THR 120 3.556 -12.299 -7.966 988 2HG2 THR 120 HG22 THR 120 3.852 -11.688 -9.595 989 3HG2 THR 120 HG23 THR 120 4.200 -10.673 -8.194 990 H HIS 121 H HIS 121 0.936 -9.935 -6.094 991 HA HIS 121 HA HIS 121 2.524 -11.402 -4.048 992 1HB HIS 121 HB2 HIS 121 1.659 -8.510 -4.296 993 2HB HIS 121 HB3 HIS 121 2.437 -9.159 -2.852 994 HD1 HIS 121 HD1 HIS 121 4.197 -11.141 -4.875 995 HD2 HIS 121 HD2 HIS 121 4.105 -6.974 -4.736 996 HE1 HIS 121 HE1 HIS 121 6.366 -10.340 -5.909 997 H GLU 122 H GLU 122 -0.331 -12.008 -4.777 998 HA GLU 122 HA GLU 122 -2.007 -11.029 -2.630 999 1HB GLU 122 HB2 GLU 122 -2.850 -11.925 -4.824 1000 2HB GLU 122 HB3 GLU 122 -2.378 -13.538 -4.290 1001 1HG GLU 122 HG2 GLU 122 -4.062 -11.921 -2.432 1002 2HG GLU 122 HG3 GLU 122 -4.843 -12.583 -3.869 1003 H GLN 123 H GLN 123 -0.306 -14.129 -3.181 1004 HA GLN 123 HA GLN 123 -1.122 -15.273 -0.665 1005 1HB GLN 123 HB2 GLN 123 0.691 -15.976 -2.871 1006 2HB GLN 123 HB3 GLN 123 1.236 -16.549 -1.294 1007 1HG GLN 123 HG2 GLN 123 -1.078 -17.484 -0.924 1008 2HG GLN 123 HG3 GLN 123 -1.445 -17.078 -2.601 1009 1HE2 GLN 123 HE21 GLN 123 -0.237 -18.240 -4.302 1010 2HE2 GLN 123 HE22 GLN 123 0.536 -19.711 -3.959 1011 H LEU 124 H LEU 124 1.764 -13.463 -1.689 1012 HA LEU 124 HA LEU 124 3.272 -13.785 0.696 1013 1HB LEU 124 HB2 LEU 124 3.614 -12.441 -1.686 1014 2HB LEU 124 HB3 LEU 124 3.493 -11.125 -0.517 1015 HG LEU 124 HG LEU 124 5.815 -11.752 -0.641 1016 1HD1 LEU 124 HD11 LEU 124 4.518 -11.566 1.671 1017 2HD1 LEU 124 HD12 LEU 124 4.973 -13.265 1.803 1018 3HD1 LEU 124 HD13 LEU 124 6.219 -12.029 1.625 1019 1HD2 LEU 124 HD21 LEU 124 4.647 -14.431 -0.866 1020 2HD2 LEU 124 HD22 LEU 124 6.215 -13.844 -1.418 1021 3HD2 LEU 124 HD23 LEU 124 6.010 -14.373 0.251 1022 H LEU 125 H LEU 125 1.281 -10.941 -0.214 1023 HA LEU 125 HA LEU 125 1.364 -9.677 2.314 1024 1HB LEU 125 HB2 LEU 125 -0.758 -9.667 0.154 1025 2HB LEU 125 HB3 LEU 125 -0.840 -8.634 1.581 1026 HG LEU 125 HG LEU 125 1.546 -8.697 -0.282 1027 1HD1 LEU 125 HD11 LEU 125 -1.015 -7.695 -0.857 1028 2HD1 LEU 125 HD12 LEU 125 -0.068 -6.285 -0.380 1029 3HD1 LEU 125 HD13 LEU 125 0.482 -7.310 -1.706 1030 1HD2 LEU 125 HD21 LEU 125 0.729 -7.189 2.158 1031 2HD2 LEU 125 HD22 LEU 125 2.337 -7.687 1.631 1032 3HD2 LEU 125 HD23 LEU 125 1.566 -6.279 0.900 1033 H ARG 126 H ARG 126 -0.540 -12.393 1.190 1034 HA ARG 126 HA ARG 126 -2.535 -12.351 3.251 1035 1HB ARG 126 HB2 ARG 126 -1.500 -14.356 1.302 1036 2HB ARG 126 HB3 ARG 126 -2.394 -14.972 2.692 1037 1HG ARG 126 HG2 ARG 126 -3.797 -12.694 1.690 1038 2HG ARG 126 HG3 ARG 126 -3.438 -13.755 0.326 1039 1HD ARG 126 HD2 ARG 126 -5.610 -14.268 1.537 1040 2HD ARG 126 HD3 ARG 126 -4.497 -15.628 1.394 1041 HE ARG 126 HE ARG 126 -4.254 -14.070 3.879 1042 1HH1 ARG 126 HH11 ARG 126 -6.232 -16.379 2.332 1043 2HH1 ARG 126 HH12 ARG 126 -6.302 -17.452 3.690 1044 1HH2 ARG 126 HH21 ARG 126 -4.064 -15.611 5.594 1045 2HH2 ARG 126 HH22 ARG 126 -5.073 -17.017 5.538 1046 H LYS 127 H LYS 127 0.579 -14.087 3.001 1047 HA LYS 127 HA LYS 127 0.415 -15.377 5.536 1048 1HB LYS 127 HB2 LYS 127 2.082 -16.141 4.001 1049 2HB LYS 127 HB3 LYS 127 2.767 -14.525 3.837 1050 1HG LYS 127 HG2 LYS 127 4.099 -14.841 5.623 1051 2HG LYS 127 HG3 LYS 127 2.728 -15.328 6.619 1052 1HD LYS 127 HD2 LYS 127 3.513 -17.439 6.570 1053 2HD LYS 127 HD3 LYS 127 3.190 -17.469 4.835 1054 1HE LYS 127 HE2 LYS 127 5.465 -16.237 4.610 1055 2HE LYS 127 HE3 LYS 127 5.761 -16.799 6.256 1056 1HZ LYS 127 HZ1 LYS 127 4.936 -18.607 4.059 1057 2HZ LYS 127 HZ2 LYS 127 6.561 -18.301 4.439 1058 3HZ LYS 127 HZ3 LYS 127 5.545 -19.034 5.587 1059 H SER 128 H SER 128 2.385 -12.519 4.703 1060 HA SER 128 HA SER 128 3.089 -11.763 7.305 1061 1HB SER 128 HB2 SER 128 3.768 -9.750 6.391 1062 2HB SER 128 HB3 SER 128 3.618 -10.703 4.918 1063 HG SER 128 HG SER 128 2.518 -8.553 5.056 1064 H GLU 129 H GLU 129 -0.004 -11.482 5.710 1065 HA GLU 129 HA GLU 129 -1.128 -9.508 7.497 1066 1HB GLU 129 HB2 GLU 129 -2.200 -9.873 5.368 1067 2HB GLU 129 HB3 GLU 129 -2.404 -11.593 5.707 1068 1HG GLU 129 HG2 GLU 129 -4.507 -10.321 6.076 1069 2HG GLU 129 HG3 GLU 129 -3.921 -11.072 7.561 1070 H ALA 130 H ALA 130 -1.543 -13.071 7.329 1071 HA ALA 130 HA ALA 130 -3.074 -13.332 9.694 1072 1HB ALA 130 HB1 ALA 130 -1.135 -15.189 8.312 1073 2HB ALA 130 HB2 ALA 130 -1.978 -15.668 9.786 1074 3HB ALA 130 HB3 ALA 130 -2.898 -15.265 8.335 1075 H GLN 131 H GLN 131 0.340 -12.741 9.260 1076 HA GLN 131 HA GLN 131 1.187 -13.541 11.897 1077 1HB GLN 131 HB2 GLN 131 2.460 -12.659 9.602 1078 2HB GLN 131 HB3 GLN 131 2.666 -11.299 10.709 1079 1HG GLN 131 HG2 GLN 131 3.802 -12.608 12.304 1080 2HG GLN 131 HG3 GLN 131 3.210 -14.120 11.617 1081 1HE2 GLN 131 HE21 GLN 131 5.566 -14.762 11.508 1082 2HE2 GLN 131 HE22 GLN 131 6.508 -14.208 10.209 1083 H ALA 132 H ALA 132 0.488 -10.322 10.501 1084 HA ALA 132 HA ALA 132 0.707 -8.851 12.914 1085 1HB ALA 132 HB1 ALA 132 0.174 -8.201 10.329 1086 2HB ALA 132 HB2 ALA 132 -1.432 -8.021 11.034 1087 3HB ALA 132 HB3 ALA 132 -0.078 -7.092 11.677 1088 H LYS 133 H LYS 133 -1.828 -10.927 11.705 1089 HA LYS 133 HA LYS 133 -3.943 -9.988 13.418 1090 1HB LYS 133 HB2 LYS 133 -3.670 -11.907 11.395 1091 2HB LYS 133 HB3 LYS 133 -4.085 -12.833 12.839 1092 1HG LYS 133 HG2 LYS 133 -6.050 -11.466 13.224 1093 2HG LYS 133 HG3 LYS 133 -5.598 -10.377 11.913 1094 1HD LYS 133 HD2 LYS 133 -6.403 -13.288 11.669 1095 2HD LYS 133 HD3 LYS 133 -7.286 -11.885 11.065 1096 1HE LYS 133 HE2 LYS 133 -4.806 -11.539 9.921 1097 2HE LYS 133 HE3 LYS 133 -4.985 -13.292 9.894 1098 1HZ LYS 133 HZ1 LYS 133 -7.303 -12.805 8.985 1099 2HZ LYS 133 HZ2 LYS 133 -6.719 -11.246 8.663 1100 3HZ LYS 133 HZ3 LYS 133 -5.984 -12.594 7.936 1101 H LYS 134 H LYS 134 -1.515 -12.575 13.753 1102 HA LYS 134 HA LYS 134 -2.499 -13.327 16.398 1103 1HB LYS 134 HB2 LYS 134 -0.258 -14.160 14.605 1104 2HB LYS 134 HB3 LYS 134 -0.102 -14.500 16.329 1105 1HG LYS 134 HG2 LYS 134 -2.770 -15.153 15.436 1106 2HG LYS 134 HG3 LYS 134 -1.579 -15.978 14.431 1107 1HD LYS 134 HD2 LYS 134 -0.761 -16.086 17.196 1108 2HD LYS 134 HD3 LYS 134 -2.409 -16.698 17.035 1109 1HE LYS 134 HE2 LYS 134 -0.170 -17.580 15.204 1110 2HE LYS 134 HE3 LYS 134 -0.548 -18.419 16.708 1111 1HZ LYS 134 HZ1 LYS 134 -2.954 -18.324 15.712 1112 2HZ LYS 134 HZ2 LYS 134 -2.111 -18.220 14.241 1113 3HZ LYS 134 HZ3 LYS 134 -1.872 -19.553 15.268 1114 H GLU 135 H GLU 135 -0.357 -10.942 15.140 1115 HA GLU 135 HA GLU 135 1.033 -10.619 17.738 1116 1HB GLU 135 HB2 GLU 135 1.377 -9.423 14.995 1117 2HB GLU 135 HB3 GLU 135 2.134 -8.677 16.402 1118 1HG GLU 135 HG2 GLU 135 3.444 -10.595 16.860 1119 2HG GLU 135 HG3 GLU 135 2.450 -11.622 15.827 1120 H LYS 136 H LYS 136 -1.891 -9.742 16.559 1121 HA LYS 136 HA LYS 136 -3.333 -7.913 16.921 1122 1HB LYS 136 HB2 LYS 136 -1.785 -7.904 19.530 1123 2HB LYS 136 HB3 LYS 136 -3.370 -7.177 19.270 1124 1HG LYS 136 HG2 LYS 136 -4.270 -9.418 18.668 1125 2HG LYS 136 HG3 LYS 136 -2.694 -10.123 19.028 1126 1HD LYS 136 HD2 LYS 136 -3.198 -8.635 21.293 1127 2HD LYS 136 HD3 LYS 136 -4.804 -9.226 20.868 1128 1HE LYS 136 HE2 LYS 136 -3.617 -11.529 20.565 1129 2HE LYS 136 HE3 LYS 136 -2.328 -10.807 21.528 1130 1HZ LYS 136 HZ1 LYS 136 -5.001 -10.415 22.562 1131 2HZ LYS 136 HZ2 LYS 136 -4.473 -12.027 22.559 1132 3HZ LYS 136 HZ3 LYS 136 -3.572 -10.840 23.375 1133 H LEU 137 H LEU 137 -1.753 -6.831 15.237 1134 HA LEU 137 HA LEU 137 -0.156 -4.658 16.441 1135 1HB LEU 137 HB2 LEU 137 -0.121 -6.105 13.958 1136 2HB LEU 137 HB3 LEU 137 -0.268 -4.380 13.623 1137 HG LEU 137 HG LEU 137 2.088 -4.903 13.774 1138 1HD1 LEU 137 HD11 LEU 137 0.811 -2.981 15.297 1139 2HD1 LEU 137 HD12 LEU 137 1.849 -3.781 16.477 1140 3HD1 LEU 137 HD13 LEU 137 2.552 -3.069 15.025 1141 1HD2 LEU 137 HD21 LEU 137 1.368 -6.116 16.463 1142 2HD2 LEU 137 HD22 LEU 137 1.919 -6.995 15.036 1143 3HD2 LEU 137 HD23 LEU 137 3.014 -5.892 15.869 1144 H ASN 138 H ASN 138 -1.529 -3.090 17.214 1145 HA ASN 138 HA ASN 138 -3.084 -1.342 17.172 1146 1HB ASN 138 HB2 ASN 138 -2.366 -1.450 14.229 1147 2HB ASN 138 HB3 ASN 138 -3.242 -0.127 15.002 1148 1HD2 ASN 138 HD21 ASN 138 -0.210 -0.889 13.971 1149 2HD2 ASN 138 HD22 ASN 138 0.716 -0.015 15.092 1150 H ILE 139 H ILE 139 -4.036 -2.164 13.910 1151 HA ILE 139 HA ILE 139 -6.771 -2.186 14.333 1152 HB ILE 139 HB ILE 139 -5.261 -3.985 12.419 1153 1HG1 ILE 139 HG12 ILE 139 -6.520 -1.359 11.689 1154 2HG1 ILE 139 HG13 ILE 139 -4.940 -1.355 12.476 1155 1HG2 ILE 139 HG21 ILE 139 -7.741 -4.443 12.860 1156 2HG2 ILE 139 HG22 ILE 139 -8.055 -2.862 12.145 1157 3HG2 ILE 139 HG23 ILE 139 -7.295 -4.130 11.183 1158 1HD1 ILE 139 HD11 ILE 139 -4.242 -3.088 10.708 1159 2HD1 ILE 139 HD12 ILE 139 -5.711 -2.629 9.848 1160 3HD1 ILE 139 HD13 ILE 139 -4.456 -1.428 10.152 1161 H TRP 140 H TRP 140 -4.680 -5.095 14.418 1162 HA TRP 140 HA TRP 140 -6.916 -6.727 15.376 1163 1HB TRP 140 HB2 TRP 140 -3.987 -7.476 15.246 1164 2HB TRP 140 HB3 TRP 140 -5.373 -8.567 15.270 1165 HD1 TRP 140 HD1 TRP 140 -3.189 -6.614 12.964 1166 HE1 TRP 140 HE1 TRP 140 -4.046 -6.828 10.541 1167 HE3 TRP 140 HE3 TRP 140 -7.730 -8.786 13.821 1168 HZ2 TRP 140 HZ2 TRP 140 -6.354 -7.792 9.151 1169 HZ3 TRP 140 HZ3 TRP 140 -9.237 -9.341 11.934 1170 HH2 TRP 140 HH2 TRP 140 -8.554 -8.847 9.601 1171 H SER 141 H SER 141 -6.224 -4.515 17.133 1172 HA SER 141 HA SER 141 -4.939 -5.894 19.434 1173 1HB SER 141 HB2 SER 141 -4.196 -3.575 18.786 1174 2HB SER 141 HB3 SER 141 -5.805 -2.997 19.205 1175 HG SER 141 HG SER 141 -5.350 -3.225 21.259 1176 H GLU 142 H GLU 142 -7.571 -6.710 18.586 1177 HA GLU 142 HA GLU 142 -9.597 -5.449 20.209 1178 1HB GLU 142 HB2 GLU 142 -9.401 -8.081 18.751 1179 2HB GLU 142 HB3 GLU 142 -10.785 -7.717 19.782 1180 1HG GLU 142 HG2 GLU 142 -10.070 -5.519 17.968 1181 2HG GLU 142 HG3 GLU 142 -10.560 -6.993 17.131 1182 H ASP 143 H ASP 143 -8.784 -8.880 20.574 1183 HA ASP 143 HA ASP 143 -9.405 -9.003 23.322 1184 1HB ASP 143 HB2 ASP 143 -8.445 -10.783 21.373 1185 2HB ASP 143 HB3 ASP 143 -7.237 -10.814 22.658 1186 H ASN 144 H ASN 144 -8.264 -8.531 25.173 1187 HA ASN 144 HA ASN 144 -5.434 -7.626 24.828 1188 1HB ASN 144 HB2 ASN 144 -6.054 -6.070 26.835 1189 2HB ASN 144 HB3 ASN 144 -6.556 -5.599 25.210 1190 1HD2 ASN 144 HD21 ASN 144 -7.843 -7.680 27.877 1191 2HD2 ASN 144 HD22 ASN 144 -9.442 -7.133 27.722 1192 H ALA 145 H ALA 145 -7.057 -10.108 25.923 1193 HA ALA 145 HA ALA 145 -6.085 -10.201 28.700 1194 1HB ALA 145 HB1 ALA 145 -7.814 -11.887 26.959 1195 2HB ALA 145 HB2 ALA 145 -6.931 -12.719 28.238 1196 3HB ALA 145 HB3 ALA 145 -8.039 -11.408 28.641 1197 H ASP 146 H ASP 146 -4.312 -11.401 29.398 1198 HA ASP 146 HA ASP 146 -2.742 -12.800 27.269 1199 1HB ASP 146 HB2 ASP 146 -1.999 -10.500 28.771 1200 2HB ASP 146 HB3 ASP 146 -1.028 -11.847 29.368 1201 H SER 147 H SER 147 -1.976 -14.818 27.840 1202 HA SER 147 HA SER 147 -2.823 -15.838 30.496 1203 1HB SER 147 HB2 SER 147 -2.465 -18.057 29.539 1204 2HB SER 147 HB3 SER 147 -3.450 -17.099 28.438 1205 HG SER 147 HG SER 147 -1.785 -18.121 27.305 1206 H GLY 148 H GLY 148 -1.138 -17.674 31.260 1207 1HA GLY 148 HA2 GLY 148 1.147 -18.233 31.735 1208 2HA GLY 148 HA3 GLY 148 1.654 -16.764 30.901 1209 H GLN 149 H GLN 149 0.162 -17.952 33.894 1210 HA GLN 149 HA GLN 149 0.774 -15.331 35.174 1211 1HB GLN 149 HB2 GLN 149 -0.729 -16.020 36.950 1212 2HB GLN 149 HB3 GLN 149 -1.537 -16.291 35.405 1213 1HG GLN 149 HG2 GLN 149 -0.405 -18.686 35.623 1214 2HG GLN 149 HG3 GLN 149 -0.428 -18.286 37.341 1215 1HE2 GLN 149 HE21 GLN 149 -2.055 -20.306 37.034 1216 2HE2 GLN 149 HE22 GLN 149 -3.686 -19.868 36.852 1217 HN3 PTP 150 H3 PTP 150 -8.611 -3.452 -7.955 1218 1H5M PTP 150 H51 PTP 150 -6.220 0.043 -4.861 1219 2H5M PTP 150 H52 PTP 150 -5.881 -1.694 -4.671 1220 3H5M PTP 150 H53 PTP 150 -7.103 -0.908 -3.643 1221 H6 PTP 150 H6 PTP 150 -8.843 0.478 -5.200 1222 H1* PTP 150 H1' PTP 150 -11.188 0.267 -7.945 1223 2H2* PTP 150 H2' PTP 150 -11.813 -0.827 -5.207 1224 H3* PTP 150 H3' PTP 150 -12.984 1.146 -4.562 1225 H4* PTP 150 H4' PTP 150 -11.541 3.113 -5.774 1226 2H5* PTP 150 H5' PTP 150 -10.760 1.016 -3.681 Start of MODEL 6 1 1H ALA 1 H1 ALA 1 4.432 -16.346 -20.484 2 2H ALA 1 H2 ALA 1 4.302 -14.765 -19.875 3 3H ALA 1 H3 ALA 1 4.351 -15.025 -21.549 4 HA ALA 1 HA ALA 1 6.589 -15.479 -21.581 5 1HB ALA 1 HB1 ALA 1 6.053 -13.114 -20.848 6 2HB ALA 1 HB2 ALA 1 6.346 -13.634 -19.189 7 3HB ALA 1 HB3 ALA 1 7.653 -13.685 -20.373 8 H THR 2 H THR 2 8.623 -15.918 -20.189 9 HA THR 2 HA THR 2 7.884 -17.751 -17.941 10 HB THR 2 HB THR 2 10.367 -18.573 -19.016 11 HG1 THR 2 HG1 THR 2 8.370 -18.221 -20.997 12 1HG2 THR 2 HG21 THR 2 7.909 -19.656 -18.232 13 2HG2 THR 2 HG22 THR 2 8.090 -20.137 -19.920 14 3HG2 THR 2 HG23 THR 2 9.336 -20.557 -18.745 15 H SER 3 H SER 3 9.997 -15.240 -19.119 16 HA SER 3 HA SER 3 11.813 -15.477 -16.808 17 1HB SER 3 HB2 SER 3 13.003 -14.760 -18.683 18 2HB SER 3 HB3 SER 3 11.682 -13.750 -19.261 19 HG SER 3 HG SER 3 13.733 -12.930 -17.956 20 H THR 4 H THR 4 11.188 -14.632 -14.885 21 HA THR 4 HA THR 4 9.577 -12.111 -14.933 22 HB THR 4 HB THR 4 9.013 -13.400 -12.509 23 HG1 THR 4 HG1 THR 4 8.801 -15.456 -12.935 24 1HG2 THR 4 HG21 THR 4 7.653 -12.183 -14.555 25 2HG2 THR 4 HG22 THR 4 7.100 -13.851 -14.703 26 3HG2 THR 4 HG23 THR 4 6.886 -12.982 -13.183 27 H LYS 5 H LYS 5 11.296 -14.095 -12.490 28 HA LYS 5 HA LYS 5 12.853 -13.448 -10.857 29 1HB LYS 5 HB2 LYS 5 13.862 -12.639 -13.246 30 2HB LYS 5 HB3 LYS 5 13.751 -11.087 -12.413 31 1HG LYS 5 HG2 LYS 5 14.959 -13.478 -11.034 32 2HG LYS 5 HG3 LYS 5 15.928 -12.490 -12.127 33 1HD LYS 5 HD2 LYS 5 14.641 -10.597 -10.571 34 2HD LYS 5 HD3 LYS 5 14.985 -11.887 -9.418 35 1HE LYS 5 HE2 LYS 5 17.071 -10.807 -11.323 36 2HE LYS 5 HE3 LYS 5 16.830 -10.151 -9.703 37 1HZ LYS 5 HZ1 LYS 5 16.943 -12.777 -9.208 38 2HZ LYS 5 HZ2 LYS 5 18.008 -12.662 -10.527 39 3HZ LYS 5 HZ3 LYS 5 18.282 -11.738 -9.128 40 H LYS 6 H LYS 6 10.575 -12.667 -9.940 41 HA LYS 6 HA LYS 6 9.512 -11.086 -8.569 42 1HB LYS 6 HB2 LYS 6 12.345 -10.240 -8.651 43 2HB LYS 6 HB3 LYS 6 11.201 -8.970 -8.216 44 1HG LYS 6 HG2 LYS 6 11.138 -11.698 -6.916 45 2HG LYS 6 HG3 LYS 6 12.122 -10.378 -6.281 46 1HD LYS 6 HD2 LYS 6 10.167 -8.983 -5.974 47 2HD LYS 6 HD3 LYS 6 9.142 -10.167 -6.788 48 1HE LYS 6 HE2 LYS 6 10.723 -10.868 -4.311 49 2HE LYS 6 HE3 LYS 6 9.103 -10.178 -4.216 50 1HZ LYS 6 HZ1 LYS 6 9.134 -12.267 -6.107 51 2HZ LYS 6 HZ2 LYS 6 9.794 -12.831 -4.646 52 3HZ LYS 6 HZ3 LYS 6 8.238 -12.148 -4.673 53 H LEU 7 H LEU 7 8.988 -10.981 -11.334 54 HA LEU 7 HA LEU 7 8.217 -9.535 -13.025 55 1HB LEU 7 HB2 LEU 7 7.267 -8.604 -10.431 56 2HB LEU 7 HB3 LEU 7 7.397 -7.281 -11.590 57 HG LEU 7 HG LEU 7 6.283 -9.559 -12.929 58 1HD1 LEU 7 HD11 LEU 7 5.283 -9.029 -10.171 59 2HD1 LEU 7 HD12 LEU 7 4.072 -9.288 -11.424 60 3HD1 LEU 7 HD13 LEU 7 5.282 -10.529 -11.097 61 1HD2 LEU 7 HD21 LEU 7 5.979 -6.775 -12.796 62 2HD2 LEU 7 HD22 LEU 7 5.092 -7.874 -13.851 63 3HD2 LEU 7 HD23 LEU 7 4.417 -7.417 -12.287 64 H HIS 8 H HIS 8 8.220 -6.729 -13.181 65 HA HIS 8 HA HIS 8 11.157 -6.184 -13.231 66 1HB HIS 8 HB2 HIS 8 10.146 -4.285 -14.866 67 2HB HIS 8 HB3 HIS 8 10.618 -5.882 -15.441 68 HD1 HIS 8 HD1 HIS 8 8.617 -7.693 -15.570 69 HD2 HIS 8 HD2 HIS 8 7.438 -3.716 -15.160 70 HE1 HIS 8 HE1 HIS 8 6.166 -7.604 -16.201 71 H LYS 9 H LYS 9 11.900 -4.483 -12.024 72 HA LYS 9 HA LYS 9 9.834 -2.779 -10.698 73 1HB LYS 9 HB2 LYS 9 12.677 -3.309 -9.790 74 2HB LYS 9 HB3 LYS 9 11.410 -2.487 -8.879 75 1HG LYS 9 HG2 LYS 9 10.230 -4.903 -9.576 76 2HG LYS 9 HG3 LYS 9 11.896 -5.354 -9.209 77 1HD LYS 9 HD2 LYS 9 10.124 -3.681 -7.402 78 2HD LYS 9 HD3 LYS 9 10.429 -5.406 -7.192 79 1HE LYS 9 HE2 LYS 9 12.908 -3.914 -7.521 80 2HE LYS 9 HE3 LYS 9 11.970 -3.323 -6.150 81 1HZ LYS 9 HZ1 LYS 9 12.441 -6.208 -6.590 82 2HZ LYS 9 HZ2 LYS 9 13.545 -5.245 -5.731 83 3HZ LYS 9 HZ3 LYS 9 11.953 -5.426 -5.167 84 H GLU 10 H GLU 10 9.861 -0.629 -11.129 85 HA GLU 10 HA GLU 10 12.226 0.462 -12.598 86 1HB GLU 10 HB2 GLU 10 9.271 1.021 -12.816 87 2HB GLU 10 HB3 GLU 10 10.451 2.226 -13.334 88 1HG GLU 10 HG2 GLU 10 10.271 1.078 -15.316 89 2HG GLU 10 HG3 GLU 10 11.496 0.065 -14.551 90 HA PRO 11 HA PRO 11 12.791 3.408 -9.387 91 1HB PRO 11 HB2 PRO 11 13.638 5.578 -10.817 92 2HB PRO 11 HB3 PRO 11 14.630 4.130 -10.571 93 1HG PRO 11 HG2 PRO 11 13.101 4.982 -12.996 94 2HG PRO 11 HG3 PRO 11 14.641 4.114 -12.886 95 1HD PRO 11 HD2 PRO 11 12.191 2.909 -13.424 96 2HD PRO 11 HD3 PRO 11 13.611 2.060 -12.774 97 H ALA 12 H ALA 12 12.093 5.590 -8.603 98 HA ALA 12 HA ALA 12 9.892 6.931 -9.990 99 1HB ALA 12 HB1 ALA 12 8.839 4.918 -8.840 100 2HB ALA 12 HB2 ALA 12 9.311 5.651 -7.307 101 3HB ALA 12 HB3 ALA 12 8.175 6.483 -8.369 102 H THR 13 H THR 13 9.132 8.845 -8.625 103 HA THR 13 HA THR 13 11.279 9.662 -6.702 104 HB THR 13 HB THR 13 9.969 11.800 -8.282 105 HG1 THR 13 HG1 THR 13 11.586 11.308 -9.970 106 1HG2 THR 13 HG21 THR 13 12.217 11.472 -6.628 107 2HG2 THR 13 HG22 THR 13 12.864 11.704 -8.253 108 3HG2 THR 13 HG23 THR 13 11.784 12.911 -7.553 109 H LEU 14 H LEU 14 10.530 10.494 -4.791 110 HA LEU 14 HA LEU 14 7.709 10.384 -4.196 111 1HB LEU 14 HB2 LEU 14 9.297 10.002 -2.410 112 2HB LEU 14 HB3 LEU 14 10.047 11.575 -2.678 113 HG LEU 14 HG LEU 14 7.827 12.639 -2.132 114 1HD1 LEU 14 HD11 LEU 14 6.934 9.985 -2.368 115 2HD1 LEU 14 HD12 LEU 14 6.826 10.354 -0.648 116 3HD1 LEU 14 HD13 LEU 14 5.990 11.371 -1.821 117 1HD2 LEU 14 HD21 LEU 14 9.431 11.004 -0.193 118 2HD2 LEU 14 HD22 LEU 14 9.303 12.757 -0.334 119 3HD2 LEU 14 HD23 LEU 14 7.985 11.831 0.384 120 H ILE 15 H ILE 15 6.209 12.055 -4.089 121 HA ILE 15 HA ILE 15 7.186 14.778 -4.853 122 HB ILE 15 HB ILE 15 4.697 13.346 -5.829 123 1HG1 ILE 15 HG12 ILE 15 7.191 14.356 -7.234 124 2HG1 ILE 15 HG13 ILE 15 6.732 12.669 -7.003 125 1HG2 ILE 15 HG21 ILE 15 5.637 16.208 -6.097 126 2HG2 ILE 15 HG22 ILE 15 4.481 15.488 -7.219 127 3HG2 ILE 15 HG23 ILE 15 4.079 15.628 -5.507 128 1HD1 ILE 15 HD11 ILE 15 4.552 13.289 -8.244 129 2HD1 ILE 15 HD12 ILE 15 5.410 14.746 -8.747 130 3HD1 ILE 15 HD13 ILE 15 6.024 13.157 -9.207 131 H LYS 16 H LYS 16 4.155 13.200 -3.769 132 HA LYS 16 HA LYS 16 4.150 14.832 -1.324 133 1HB LYS 16 HB2 LYS 16 3.176 16.309 -3.127 134 2HB LYS 16 HB3 LYS 16 1.885 15.122 -3.316 135 1HG LYS 16 HG2 LYS 16 0.897 16.537 -1.773 136 2HG LYS 16 HG3 LYS 16 1.704 15.411 -0.680 137 1HD LYS 16 HD2 LYS 16 3.715 17.194 -1.151 138 2HD LYS 16 HD3 LYS 16 2.306 18.252 -1.239 139 1HE LYS 16 HE2 LYS 16 2.087 16.391 0.984 140 2HE LYS 16 HE3 LYS 16 3.562 17.352 1.096 141 1HZ LYS 16 HZ1 LYS 16 1.225 18.848 0.313 142 2HZ LYS 16 HZ2 LYS 16 1.126 18.184 1.874 143 3HZ LYS 16 HZ3 LYS 16 2.414 19.215 1.466 144 H ALA 17 H ALA 17 3.819 13.099 0.027 145 HA ALA 17 HA ALA 17 2.186 10.824 -0.676 146 1HB ALA 17 HB1 ALA 17 3.772 11.715 1.627 147 2HB ALA 17 HB2 ALA 17 2.324 10.820 2.088 148 3HB ALA 17 HB3 ALA 17 3.509 10.085 1.008 149 H ILE 18 H ILE 18 0.046 10.377 -0.106 150 HA ILE 18 HA ILE 18 -1.494 12.707 0.955 151 HB ILE 18 HB ILE 18 -2.606 10.331 -0.555 152 1HG1 ILE 18 HG12 ILE 18 -1.811 13.031 -1.688 153 2HG1 ILE 18 HG13 ILE 18 -0.850 11.564 -1.876 154 1HG2 ILE 18 HG21 ILE 18 -3.789 12.459 0.844 155 2HG2 ILE 18 HG22 ILE 18 -3.919 12.903 -0.858 156 3HG2 ILE 18 HG23 ILE 18 -4.587 11.372 -0.292 157 1HD1 ILE 18 HD11 ILE 18 -3.001 10.499 -2.823 158 2HD1 ILE 18 HD12 ILE 18 -3.602 12.150 -2.966 159 3HD1 ILE 18 HD13 ILE 18 -2.156 11.659 -3.849 160 H ASP 19 H ASP 19 -2.141 9.191 0.851 161 HA ASP 19 HA ASP 19 -2.620 9.335 3.801 162 1HB ASP 19 HB2 ASP 19 -4.268 7.408 3.322 163 2HB ASP 19 HB3 ASP 19 -4.766 9.029 2.842 164 H GLY 20 H GLY 20 -2.899 6.630 4.314 165 1HA GLY 20 HA2 GLY 20 -0.124 5.746 4.107 166 2HA GLY 20 HA3 GLY 20 -1.422 4.894 4.941 167 H ASP 21 H ASP 21 -2.662 5.569 1.968 168 HA ASP 21 HA ASP 21 -1.520 3.082 0.763 169 1HB ASP 21 HB2 ASP 21 -4.343 3.775 1.373 170 2HB ASP 21 HB3 ASP 21 -4.045 3.009 -0.188 171 H THR 22 H THR 22 -2.105 6.367 0.385 172 HA THR 22 HA THR 22 -1.891 6.076 -2.584 173 HB THR 22 HB THR 22 -3.139 8.532 -1.434 174 HG1 THR 22 HG1 THR 22 -5.141 7.463 -1.379 175 1HG2 THR 22 HG21 THR 22 -2.703 7.437 -3.975 176 2HG2 THR 22 HG22 THR 22 -4.430 7.227 -3.684 177 3HG2 THR 22 HG23 THR 22 -3.709 8.834 -3.591 178 H VAL 23 H VAL 23 -0.046 6.962 -3.353 179 HA VAL 23 HA VAL 23 1.109 9.316 -1.947 180 HB VAL 23 HB VAL 23 3.405 8.143 -2.426 181 1HG1 VAL 23 HG11 VAL 23 2.051 8.593 -0.185 182 2HG1 VAL 23 HG12 VAL 23 1.887 6.837 -0.198 183 3HG1 VAL 23 HG13 VAL 23 3.490 7.573 -0.179 184 1HG2 VAL 23 HG21 VAL 23 2.351 6.252 -3.674 185 2HG2 VAL 23 HG22 VAL 23 3.307 5.705 -2.296 186 3HG2 VAL 23 HG23 VAL 23 1.548 5.755 -2.185 187 H LYS 24 H LYS 24 1.620 10.861 -3.429 188 HA LYS 24 HA LYS 24 1.500 10.170 -6.289 189 1HB LYS 24 HB2 LYS 24 2.130 12.882 -5.110 190 2HB LYS 24 HB3 LYS 24 1.433 12.517 -6.689 191 1HG LYS 24 HG2 LYS 24 -0.508 11.435 -5.366 192 2HG LYS 24 HG3 LYS 24 0.132 12.311 -3.976 193 1HD LYS 24 HD2 LYS 24 0.031 14.102 -6.213 194 2HD LYS 24 HD3 LYS 24 -1.541 13.316 -6.048 195 1HE LYS 24 HE2 LYS 24 -1.587 13.927 -3.650 196 2HE LYS 24 HE3 LYS 24 -0.032 14.739 -3.835 197 1HZ LYS 24 HZ1 LYS 24 -1.039 16.202 -5.478 198 2HZ LYS 24 HZ2 LYS 24 -2.537 15.429 -5.273 199 3HZ LYS 24 HZ3 LYS 24 -1.849 16.309 -3.993 200 H LEU 25 H LEU 25 3.321 9.521 -7.323 201 HA LEU 25 HA LEU 25 5.930 10.590 -6.326 202 1HB LEU 25 HB2 LEU 25 5.754 8.045 -7.906 203 2HB LEU 25 HB3 LEU 25 6.945 8.532 -6.699 204 HG LEU 25 HG LEU 25 4.050 7.988 -6.008 205 1HD1 LEU 25 HD11 LEU 25 6.438 6.134 -6.068 206 2HD1 LEU 25 HD12 LEU 25 5.021 5.816 -5.069 207 3HD1 LEU 25 HD13 LEU 25 4.862 5.897 -6.823 208 1HD2 LEU 25 HD21 LEU 25 6.551 8.689 -4.553 209 2HD2 LEU 25 HD22 LEU 25 4.879 9.110 -4.180 210 3HD2 LEU 25 HD23 LEU 25 5.495 7.506 -3.781 211 H MET 26 H MET 26 7.477 9.684 -8.483 212 HA MET 26 HA MET 26 6.317 11.155 -10.808 213 1HB MET 26 HB2 MET 26 8.272 12.217 -9.257 214 2HB MET 26 HB3 MET 26 9.256 11.290 -10.390 215 1HG MET 26 HG2 MET 26 8.885 12.785 -12.032 216 2HG MET 26 HG3 MET 26 7.141 12.688 -11.792 217 1HE MET 26 HE1 MET 26 7.858 14.856 -12.871 218 2HE MET 26 HE2 MET 26 7.581 16.327 -11.942 219 3HE MET 26 HE3 MET 26 9.227 15.756 -12.206 220 H TYR 27 H TYR 27 6.049 9.569 -12.308 221 HA TYR 27 HA TYR 27 8.130 7.447 -12.521 222 1HB TYR 27 HB2 TYR 27 5.875 6.585 -12.232 223 2HB TYR 27 HB3 TYR 27 5.283 7.589 -13.555 224 HD1 TYR 27 HD1 TYR 27 7.697 4.851 -12.763 225 HD2 TYR 27 HD2 TYR 27 5.361 6.820 -15.780 226 HE1 TYR 27 HE1 TYR 27 8.287 3.068 -14.382 227 HE2 TYR 27 HE2 TYR 27 5.951 5.040 -17.401 228 HH TYR 27 HH TYR 27 8.357 2.616 -16.672 229 H LYS 28 H LYS 28 9.590 7.729 -14.133 230 HA LYS 28 HA LYS 28 10.527 8.402 -16.171 231 1HB LYS 28 HB2 LYS 28 7.600 8.193 -16.878 232 2HB LYS 28 HB3 LYS 28 8.807 8.679 -18.070 233 1HG LYS 28 HG2 LYS 28 10.080 6.535 -17.151 234 2HG LYS 28 HG3 LYS 28 8.445 6.040 -16.712 235 1HD LYS 28 HD2 LYS 28 7.766 5.842 -18.893 236 2HD LYS 28 HD3 LYS 28 8.814 7.149 -19.445 237 1HE LYS 28 HE2 LYS 28 10.112 4.656 -18.435 238 2HE LYS 28 HE3 LYS 28 9.359 4.605 -20.028 239 1HZ LYS 28 HZ1 LYS 28 11.302 6.683 -19.187 240 2HZ LYS 28 HZ2 LYS 28 11.733 5.277 -20.040 241 3HZ LYS 28 HZ3 LYS 28 10.696 6.414 -20.752 242 H GLY 29 H GLY 29 9.247 10.389 -14.122 243 1HA GLY 29 HA2 GLY 29 9.662 12.746 -14.027 244 2HA GLY 29 HA3 GLY 29 9.801 12.768 -15.785 245 H GLN 30 H GLN 30 7.095 11.118 -14.353 246 HA GLN 30 HA GLN 30 5.354 13.426 -15.125 247 1HB GLN 30 HB2 GLN 30 5.091 11.639 -16.761 248 2HB GLN 30 HB3 GLN 30 4.841 10.456 -15.475 249 1HG GLN 30 HG2 GLN 30 2.821 11.749 -14.750 250 2HG GLN 30 HG3 GLN 30 3.040 12.800 -16.151 251 1HE2 GLN 30 HE21 GLN 30 1.735 12.177 -17.870 252 2HE2 GLN 30 HE22 GLN 30 1.288 10.581 -18.232 253 HA PRO 31 HA PRO 31 3.942 13.085 -10.928 254 1HB PRO 31 HB2 PRO 31 1.804 14.773 -11.166 255 2HB PRO 31 HB3 PRO 31 3.481 15.345 -11.101 256 1HG PRO 31 HG2 PRO 31 1.666 15.081 -13.464 257 2HG PRO 31 HG3 PRO 31 2.912 16.296 -13.134 258 1HD PRO 31 HD2 PRO 31 3.247 14.132 -14.847 259 2HD PRO 31 HD3 PRO 31 4.580 15.016 -14.069 260 H MET 32 H MET 32 2.914 11.190 -10.332 261 HA MET 32 HA MET 32 0.120 10.792 -11.249 262 1HB MET 32 HB2 MET 32 2.323 9.326 -12.303 263 2HB MET 32 HB3 MET 32 1.417 8.234 -11.255 264 1HG MET 32 HG2 MET 32 -0.158 9.977 -13.092 265 2HG MET 32 HG3 MET 32 0.724 8.631 -13.813 266 1HE MET 32 HE1 MET 32 0.843 6.546 -13.123 267 2HE MET 32 HE2 MET 32 0.213 5.926 -11.599 268 3HE MET 32 HE3 MET 32 -0.657 5.623 -13.109 269 H THR 33 H THR 33 -1.100 9.425 -9.830 270 HA THR 33 HA THR 33 0.111 9.197 -7.122 271 HB THR 33 HB THR 33 -2.051 10.426 -7.360 272 HG1 THR 33 HG1 THR 33 -1.434 9.050 -5.498 273 1HG2 THR 33 HG21 THR 33 -2.802 7.832 -8.631 274 2HG2 THR 33 HG22 THR 33 -4.026 8.659 -7.669 275 3HG2 THR 33 HG23 THR 33 -3.294 9.472 -9.051 276 H PHE 34 H PHE 34 -0.124 7.179 -5.945 277 HA PHE 34 HA PHE 34 -0.791 4.833 -7.667 278 1HB PHE 34 HB2 PHE 34 1.693 5.338 -6.043 279 2HB PHE 34 HB3 PHE 34 1.139 3.689 -6.332 280 HD1 PHE 34 HD1 PHE 34 1.079 2.746 -8.591 281 HD2 PHE 34 HD2 PHE 34 2.495 6.739 -7.875 282 HE1 PHE 34 HE1 PHE 34 2.063 2.806 -10.866 283 HE2 PHE 34 HE2 PHE 34 3.478 6.799 -10.151 284 HZ PHE 34 HZ PHE 34 3.263 4.831 -11.647 285 H ARG 35 H ARG 35 -1.702 3.065 -6.542 286 HA ARG 35 HA ARG 35 -2.408 3.627 -3.689 287 1HB ARG 35 HB2 ARG 35 -4.095 3.136 -5.971 288 2HB ARG 35 HB3 ARG 35 -4.295 1.827 -4.804 289 1HG ARG 35 HG2 ARG 35 -4.304 4.707 -3.912 290 2HG ARG 35 HG3 ARG 35 -5.773 3.942 -4.520 291 1HD ARG 35 HD2 ARG 35 -5.910 2.466 -2.738 292 2HD ARG 35 HD3 ARG 35 -4.172 2.502 -2.440 293 HE ARG 35 HE ARG 35 -4.531 4.802 -1.473 294 1HH1 ARG 35 HH11 ARG 35 -5.914 2.577 0.135 295 2HH1 ARG 35 HH12 ARG 35 -7.442 3.324 0.467 296 1HH2 ARG 35 HH21 ARG 35 -7.050 5.803 -1.925 297 2HH2 ARG 35 HH22 ARG 35 -8.085 5.149 -0.700 298 H LEU 36 H LEU 36 -1.758 2.062 -2.274 299 HA LEU 36 HA LEU 36 -0.113 -0.099 -2.994 300 1HB LEU 36 HB2 LEU 36 -1.959 0.035 -0.591 301 2HB LEU 36 HB3 LEU 36 -0.522 -0.979 -0.745 302 HG LEU 36 HG LEU 36 -0.663 2.037 -0.579 303 1HD1 LEU 36 HD11 LEU 36 -0.307 0.048 1.328 304 2HD1 LEU 36 HD12 LEU 36 1.340 0.567 0.968 305 3HD1 LEU 36 HD13 LEU 36 0.144 1.742 1.514 306 1HD2 LEU 36 HD21 LEU 36 1.610 0.249 -1.488 307 2HD2 LEU 36 HD22 LEU 36 0.892 1.602 -2.363 308 3HD2 LEU 36 HD23 LEU 36 1.856 1.900 -0.916 309 H LEU 37 H LEU 37 -0.515 -2.115 -3.797 310 HA LEU 37 HA LEU 37 -3.305 -2.775 -4.492 311 1HB LEU 37 HB2 LEU 37 -0.620 -3.530 -5.441 312 2HB LEU 37 HB3 LEU 37 -1.793 -4.845 -5.439 313 HG LEU 37 HG LEU 37 -2.283 -2.124 -6.679 314 1HD1 LEU 37 HD11 LEU 37 -0.939 -4.545 -7.668 315 2HD1 LEU 37 HD12 LEU 37 -2.255 -3.997 -8.707 316 3HD1 LEU 37 HD13 LEU 37 -0.924 -2.907 -8.319 317 1HD2 LEU 37 HD21 LEU 37 -3.862 -4.646 -6.345 318 2HD2 LEU 37 HD22 LEU 37 -4.404 -2.970 -6.273 319 3HD2 LEU 37 HD23 LEU 37 -4.073 -3.724 -7.833 320 H LEU 38 H LEU 38 -4.384 -4.628 -3.812 321 HA LEU 38 HA LEU 38 -4.952 -6.405 -2.409 322 1HB LEU 38 HB2 LEU 38 -2.016 -6.850 -1.918 323 2HB LEU 38 HB3 LEU 38 -3.312 -8.042 -2.028 324 HG LEU 38 HG LEU 38 -2.365 -6.322 -4.340 325 1HD1 LEU 38 HD11 LEU 38 -1.638 -9.090 -3.412 326 2HD1 LEU 38 HD12 LEU 38 -1.608 -8.701 -5.132 327 3HD1 LEU 38 HD13 LEU 38 -0.584 -7.809 -4.007 328 1HD2 LEU 38 HD21 LEU 38 -4.678 -8.010 -3.880 329 2HD2 LEU 38 HD22 LEU 38 -4.310 -6.990 -5.270 330 3HD2 LEU 38 HD23 LEU 38 -3.705 -8.645 -5.206 331 H VAL 39 H VAL 39 -4.222 -3.624 -1.264 332 HA VAL 39 HA VAL 39 -4.312 -4.551 1.550 333 HB VAL 39 HB VAL 39 -2.499 -3.214 2.298 334 1HG1 VAL 39 HG11 VAL 39 -2.002 -5.326 0.834 335 2HG1 VAL 39 HG12 VAL 39 -1.401 -4.155 -0.339 336 3HG1 VAL 39 HG13 VAL 39 -0.673 -4.251 1.264 337 1HG2 VAL 39 HG21 VAL 39 -3.071 -1.239 0.872 338 2HG2 VAL 39 HG22 VAL 39 -1.344 -1.592 0.892 339 3HG2 VAL 39 HG23 VAL 39 -2.322 -2.056 -0.500 340 H ASP 40 H ASP 40 -4.986 -2.770 3.028 341 HA ASP 40 HA ASP 40 -6.243 -0.447 1.671 342 1HB ASP 40 HB2 ASP 40 -7.994 -2.186 1.768 343 2HB ASP 40 HB3 ASP 40 -7.736 -2.347 3.506 344 H THR 41 H THR 41 -6.320 1.379 3.002 345 HA THR 41 HA THR 41 -5.029 1.049 5.673 346 HB THR 41 HB THR 41 -4.955 3.715 5.266 347 HG1 THR 41 HG1 THR 41 -5.617 4.052 3.307 348 1HG2 THR 41 HG21 THR 41 -3.116 1.820 5.494 349 2HG2 THR 41 HG22 THR 41 -2.949 2.085 3.758 350 3HG2 THR 41 HG23 THR 41 -2.689 3.419 4.883 351 HA PRO 42 HA PRO 42 -8.624 2.441 7.801 352 1HB PRO 42 HB2 PRO 42 -7.552 4.085 9.706 353 2HB PRO 42 HB3 PRO 42 -7.374 2.321 9.741 354 1HG PRO 42 HG2 PRO 42 -5.390 4.404 8.910 355 2HG PRO 42 HG3 PRO 42 -5.122 2.867 9.750 356 1HD PRO 42 HD2 PRO 42 -4.658 3.257 7.045 357 2HD PRO 42 HD3 PRO 42 -4.986 1.673 7.782 358 H GLU 43 H GLU 43 -6.818 4.583 5.929 359 HA GLU 43 HA GLU 43 -7.504 6.567 4.851 360 1HB GLU 43 HB2 GLU 43 -9.914 5.471 5.843 361 2HB GLU 43 HB3 GLU 43 -9.911 7.167 6.329 362 1HG GLU 43 HG2 GLU 43 -10.906 7.031 4.129 363 2HG GLU 43 HG3 GLU 43 -9.311 7.767 3.956 364 H THR 44 H THR 44 -7.536 8.872 5.381 365 HA THR 44 HA THR 44 -7.333 9.598 8.234 366 HB THR 44 HB THR 44 -5.050 10.324 6.399 367 HG1 THR 44 HG1 THR 44 -5.239 8.114 8.165 368 1HG2 THR 44 HG21 THR 44 -5.831 10.852 9.138 369 2HG2 THR 44 HG22 THR 44 -4.257 10.060 9.080 370 3HG2 THR 44 HG23 THR 44 -4.518 11.564 8.199 371 H LYS 45 H LYS 45 -9.309 10.360 6.458 372 HA LYS 45 HA LYS 45 -8.567 13.187 5.816 373 1HB LYS 45 HB2 LYS 45 -9.240 11.611 3.890 374 2HB LYS 45 HB3 LYS 45 -10.868 11.683 4.565 375 1HG LYS 45 HG2 LYS 45 -10.593 13.392 2.818 376 2HG LYS 45 HG3 LYS 45 -10.818 14.154 4.392 377 1HD LYS 45 HD2 LYS 45 -8.619 14.867 4.519 378 2HD LYS 45 HD3 LYS 45 -8.026 13.552 3.503 379 1HE LYS 45 HE2 LYS 45 -9.878 15.560 2.280 380 2HE LYS 45 HE3 LYS 45 -8.201 16.031 2.559 381 1HZ LYS 45 HZ1 LYS 45 -7.677 13.790 1.442 382 2HZ LYS 45 HZ2 LYS 45 -9.264 13.886 0.842 383 3HZ LYS 45 HZ3 LYS 45 -8.135 15.099 0.465 384 H HIS 46 H HIS 46 -9.129 13.294 8.260 385 HA HIS 46 HA HIS 46 -11.683 12.929 9.319 386 1HB HIS 46 HB2 HIS 46 -9.978 15.352 9.909 387 2HB HIS 46 HB3 HIS 46 -11.071 14.502 10.999 388 HD1 HIS 46 HD1 HIS 46 -7.688 14.899 10.833 389 HD2 HIS 46 HD2 HIS 46 -10.016 11.444 10.695 390 HE1 HIS 46 HE1 HIS 46 -6.171 12.985 11.507 391 HA PRO 47 HA PRO 47 -13.841 15.892 6.686 392 1HB PRO 47 HB2 PRO 47 -16.318 14.856 7.187 393 2HB PRO 47 HB3 PRO 47 -15.184 14.129 6.038 394 1HG PRO 47 HG2 PRO 47 -15.962 13.204 8.751 395 2HG PRO 47 HG3 PRO 47 -15.378 12.267 7.367 396 1HD PRO 47 HD2 PRO 47 -13.853 13.064 9.625 397 2HD PRO 47 HD3 PRO 47 -13.225 12.357 8.121 398 H LYS 48 H LYS 48 -15.973 14.968 9.379 399 HA LYS 48 HA LYS 48 -15.589 17.654 10.597 400 1HB LYS 48 HB2 LYS 48 -18.146 17.745 10.845 401 2HB LYS 48 HB3 LYS 48 -17.499 18.063 9.234 402 1HG LYS 48 HG2 LYS 48 -17.833 15.591 8.738 403 2HG LYS 48 HG3 LYS 48 -18.733 15.493 10.252 404 1HD LYS 48 HD2 LYS 48 -20.566 16.244 9.191 405 2HD LYS 48 HD3 LYS 48 -19.724 17.753 8.838 406 1HE LYS 48 HE2 LYS 48 -20.407 16.842 6.724 407 2HE LYS 48 HE3 LYS 48 -18.670 16.569 6.851 408 1HZ LYS 48 HZ1 LYS 48 -19.984 14.409 8.043 409 2HZ LYS 48 HZ2 LYS 48 -20.705 14.674 6.528 410 3HZ LYS 48 HZ3 LYS 48 -19.033 14.412 6.635 411 H LYS 49 H LYS 49 -17.267 14.506 10.876 412 HA LYS 49 HA LYS 49 -17.330 14.751 13.804 413 1HB LYS 49 HB2 LYS 49 -19.008 13.502 12.145 414 2HB LYS 49 HB3 LYS 49 -17.897 12.160 12.426 415 1HG LYS 49 HG2 LYS 49 -18.159 12.875 14.955 416 2HG LYS 49 HG3 LYS 49 -19.660 13.599 14.380 417 1HD LYS 49 HD2 LYS 49 -20.631 11.569 13.942 418 2HD LYS 49 HD3 LYS 49 -19.104 10.823 13.472 419 1HE LYS 49 HE2 LYS 49 -19.110 9.824 15.498 420 2HE LYS 49 HE3 LYS 49 -18.752 11.414 16.172 421 1HZ LYS 49 HZ1 LYS 49 -21.541 10.891 15.549 422 2HZ LYS 49 HZ2 LYS 49 -20.892 9.991 16.835 423 3HZ LYS 49 HZ3 LYS 49 -20.855 11.689 16.879 424 H GLY 50 H GLY 50 -15.088 13.729 11.477 425 1HA GLY 50 HA2 GLY 50 -12.886 12.943 11.889 426 2HA GLY 50 HA3 GLY 50 -13.327 12.678 13.577 427 H VAL 51 H VAL 51 -12.205 10.572 13.278 428 HA VAL 51 HA VAL 51 -14.142 8.530 12.353 429 HB VAL 51 HB VAL 51 -11.260 8.644 11.414 430 1HG1 VAL 51 HG11 VAL 51 -13.180 6.462 11.681 431 2HG1 VAL 51 HG12 VAL 51 -12.646 6.671 10.013 432 3HG1 VAL 51 HG13 VAL 51 -11.462 6.397 11.292 433 1HG2 VAL 51 HG21 VAL 51 -13.934 9.104 10.089 434 2HG2 VAL 51 HG22 VAL 51 -12.500 10.130 10.050 435 3HG2 VAL 51 HG23 VAL 51 -12.525 8.614 9.149 436 H GLU 52 H GLU 52 -11.145 9.304 14.063 437 HA GLU 52 HA GLU 52 -10.278 8.380 16.040 438 1HB GLU 52 HB2 GLU 52 -12.767 6.655 16.116 439 2HB GLU 52 HB3 GLU 52 -11.721 7.096 17.466 440 1HG GLU 52 HG2 GLU 52 -12.801 9.050 17.776 441 2HG GLU 52 HG3 GLU 52 -12.696 9.453 16.062 442 H LYS 53 H LYS 53 -10.794 5.533 16.797 443 HA LYS 53 HA LYS 53 -9.870 3.427 16.320 444 1HB LYS 53 HB2 LYS 53 -10.905 4.437 13.769 445 2HB LYS 53 HB3 LYS 53 -9.560 3.314 13.567 446 1HG LYS 53 HG2 LYS 53 -11.699 2.096 13.620 447 2HG LYS 53 HG3 LYS 53 -10.712 1.679 15.022 448 1HD LYS 53 HD2 LYS 53 -11.965 3.358 16.368 449 2HD LYS 53 HD3 LYS 53 -12.993 3.678 14.970 450 1HE LYS 53 HE2 LYS 53 -14.315 2.036 15.813 451 2HE LYS 53 HE3 LYS 53 -13.111 0.935 15.144 452 1HZ LYS 53 HZ1 LYS 53 -11.963 1.566 17.451 453 2HZ LYS 53 HZ2 LYS 53 -13.596 1.704 17.902 454 3HZ LYS 53 HZ3 LYS 53 -13.007 0.243 17.267 455 H TYR 54 H TYR 54 -8.473 4.854 13.422 456 HA TYR 54 HA TYR 54 -5.884 5.267 14.798 457 1HB TYR 54 HB2 TYR 54 -6.264 3.372 12.458 458 2HB TYR 54 HB3 TYR 54 -4.700 3.887 13.092 459 HD1 TYR 54 HD1 TYR 54 -4.120 3.373 15.510 460 HD2 TYR 54 HD2 TYR 54 -7.503 1.637 13.511 461 HE1 TYR 54 HE1 TYR 54 -4.240 1.607 17.246 462 HE2 TYR 54 HE2 TYR 54 -7.622 -0.129 15.248 463 HH TYR 54 HH TYR 54 -6.706 -0.127 17.937 464 H GLY 55 H GLY 55 -7.203 7.383 14.010 465 1HA GLY 55 HA2 GLY 55 -7.296 8.214 11.349 466 2HA GLY 55 HA3 GLY 55 -6.949 9.310 12.686 467 HA PRO 56 HA PRO 56 -2.865 9.811 11.136 468 1HB PRO 56 HB2 PRO 56 -1.619 10.581 13.443 469 2HB PRO 56 HB3 PRO 56 -2.755 11.622 12.566 470 1HG PRO 56 HG2 PRO 56 -3.178 10.061 15.077 471 2HG PRO 56 HG3 PRO 56 -3.876 11.613 14.584 472 1HD PRO 56 HD2 PRO 56 -5.197 9.153 14.454 473 2HD PRO 56 HD3 PRO 56 -5.659 10.609 13.545 474 H GLU 57 H GLU 57 -2.407 7.533 10.676 475 HA GLU 57 HA GLU 57 -0.367 6.422 12.489 476 1HB GLU 57 HB2 GLU 57 -3.091 5.362 12.298 477 2HB GLU 57 HB3 GLU 57 -1.863 4.153 11.921 478 1HG GLU 57 HG2 GLU 57 -1.026 5.720 14.197 479 2HG GLU 57 HG3 GLU 57 -2.636 5.059 14.485 480 H ALA 58 H ALA 58 -2.275 4.782 9.977 481 HA ALA 58 HA ALA 58 0.025 3.827 8.591 482 1HB ALA 58 HB1 ALA 58 -2.597 3.241 8.442 483 2HB ALA 58 HB2 ALA 58 -2.471 4.297 7.035 484 3HB ALA 58 HB3 ALA 58 -1.470 2.850 7.143 485 H SER 59 H SER 59 -1.876 6.785 8.234 486 HA SER 59 HA SER 59 -0.778 7.643 5.739 487 1HB SER 59 HB2 SER 59 -2.535 9.014 6.290 488 2HB SER 59 HB3 SER 59 -2.197 8.924 8.016 489 HG SER 59 HG SER 59 -1.458 10.787 6.219 490 H ALA 60 H ALA 60 0.195 8.435 9.091 491 HA ALA 60 HA ALA 60 2.548 9.896 8.261 492 1HB ALA 60 HB1 ALA 60 1.172 9.589 10.637 493 2HB ALA 60 HB2 ALA 60 2.651 8.675 10.934 494 3HB ALA 60 HB3 ALA 60 2.743 10.375 10.471 495 H PHE 61 H PHE 61 1.812 6.559 8.468 496 HA PHE 61 HA PHE 61 4.487 5.606 9.049 497 1HB PHE 61 HB2 PHE 61 2.390 4.251 9.371 498 2HB PHE 61 HB3 PHE 61 2.259 4.139 7.616 499 HD1 PHE 61 HD1 PHE 61 4.508 3.380 10.495 500 HD2 PHE 61 HD2 PHE 61 3.536 2.561 6.392 501 HE1 PHE 61 HE1 PHE 61 6.113 1.489 10.492 502 HE2 PHE 61 HE2 PHE 61 5.140 0.669 6.390 503 HZ PHE 61 HZ PHE 61 6.428 0.134 8.440 504 H THR 62 H THR 62 2.572 5.626 6.034 505 HA THR 62 HA THR 62 4.919 5.043 4.416 506 HB THR 62 HB THR 62 2.555 6.249 3.101 507 HG1 THR 62 HG1 THR 62 2.447 3.896 4.668 508 1HG2 THR 62 HG21 THR 62 4.538 4.087 2.700 509 2HG2 THR 62 HG22 THR 62 2.927 3.769 2.056 510 3HG2 THR 62 HG23 THR 62 3.824 5.193 1.527 511 H LYS 63 H LYS 63 3.505 7.892 5.731 512 HA LYS 63 HA LYS 63 4.493 9.749 3.734 513 1HB LYS 63 HB2 LYS 63 2.633 10.171 5.450 514 2HB LYS 63 HB3 LYS 63 3.924 10.398 6.630 515 1HG LYS 63 HG2 LYS 63 4.920 12.065 4.911 516 2HG LYS 63 HG3 LYS 63 3.317 12.041 4.178 517 1HD LYS 63 HD2 LYS 63 2.309 13.045 6.011 518 2HD LYS 63 HD3 LYS 63 3.532 12.453 7.137 519 1HE LYS 63 HE2 LYS 63 5.142 14.057 6.366 520 2HE LYS 63 HE3 LYS 63 4.124 14.513 4.999 521 1HZ LYS 63 HZ1 LYS 63 2.640 14.807 7.355 522 2HZ LYS 63 HZ2 LYS 63 4.133 15.584 7.579 523 3HZ LYS 63 HZ3 LYS 63 3.138 16.011 6.270 524 H LYS 64 H LYS 64 5.600 8.908 7.020 525 HA LYS 64 HA LYS 64 8.062 10.404 6.765 526 1HB LYS 64 HB2 LYS 64 6.692 9.100 8.836 527 2HB LYS 64 HB3 LYS 64 8.206 8.210 8.669 528 1HG LYS 64 HG2 LYS 64 9.031 9.875 9.995 529 2HG LYS 64 HG3 LYS 64 9.116 10.765 8.475 530 1HD LYS 64 HD2 LYS 64 7.590 12.243 9.211 531 2HD LYS 64 HD3 LYS 64 6.444 10.941 9.532 532 1HE LYS 64 HE2 LYS 64 7.307 10.600 11.738 533 2HE LYS 64 HE3 LYS 64 8.709 11.621 11.418 534 1HZ LYS 64 HZ1 LYS 64 6.765 13.330 10.890 535 2HZ LYS 64 HZ2 LYS 64 5.967 12.372 12.040 536 3HZ LYS 64 HZ3 LYS 64 7.425 13.144 12.444 537 H MET 65 H MET 65 7.082 7.106 6.047 538 HA MET 65 HA MET 65 9.716 5.992 5.777 539 1HB MET 65 HB2 MET 65 6.964 5.204 5.144 540 2HB MET 65 HB3 MET 65 8.139 4.603 3.973 541 1HG MET 65 HG2 MET 65 8.486 4.312 6.969 542 2HG MET 65 HG3 MET 65 7.740 3.075 5.957 543 1HE MET 65 HE1 MET 65 8.594 2.384 3.866 544 2HE MET 65 HE2 MET 65 10.273 2.000 3.494 545 3HE MET 65 HE3 MET 65 9.430 1.103 4.755 546 H VAL 66 H VAL 66 7.423 7.047 3.254 547 HA VAL 66 HA VAL 66 9.255 6.906 1.090 548 HB VAL 66 HB VAL 66 7.702 8.513 -0.039 549 1HG1 VAL 66 HG11 VAL 66 6.767 6.067 1.415 550 2HG1 VAL 66 HG12 VAL 66 5.572 7.040 0.557 551 3HG1 VAL 66 HG13 VAL 66 6.934 6.342 -0.319 552 1HG2 VAL 66 HG21 VAL 66 6.813 8.814 2.797 553 2HG2 VAL 66 HG22 VAL 66 6.900 10.022 1.515 554 3HG2 VAL 66 HG23 VAL 66 5.570 8.865 1.546 555 H GLU 67 H GLU 67 8.572 9.517 3.387 556 HA GLU 67 HA GLU 67 10.138 11.531 2.091 557 1HB GLU 67 HB2 GLU 67 9.075 11.097 4.853 558 2HB GLU 67 HB3 GLU 67 10.324 12.322 4.627 559 1HG GLU 67 HG2 GLU 67 8.265 12.466 2.562 560 2HG GLU 67 HG3 GLU 67 7.595 12.668 4.181 561 H ASN 68 H ASN 68 10.977 8.891 4.255 562 HA ASN 68 HA ASN 68 13.798 9.847 4.312 563 1HB ASN 68 HB2 ASN 68 12.460 7.626 5.886 564 2HB ASN 68 HB3 ASN 68 14.116 8.192 6.104 565 1HD2 ASN 68 HD21 ASN 68 12.093 8.314 8.194 566 2HD2 ASN 68 HD22 ASN 68 11.816 9.952 8.537 567 H ALA 69 H ALA 69 11.897 7.931 2.410 568 HA ALA 69 HA ALA 69 13.638 5.622 2.103 569 1HB ALA 69 HB1 ALA 69 11.488 6.744 0.277 570 2HB ALA 69 HB2 ALA 69 12.267 5.174 0.078 571 3HB ALA 69 HB3 ALA 69 11.264 5.487 1.495 572 H LYS 70 H LYS 70 15.640 5.801 1.228 573 HA LYS 70 HA LYS 70 16.411 8.088 -0.389 574 1HB LYS 70 HB2 LYS 70 17.812 5.505 0.338 575 2HB LYS 70 HB3 LYS 70 18.558 6.750 -0.665 576 1HG LYS 70 HG2 LYS 70 17.548 8.179 1.495 577 2HG LYS 70 HG3 LYS 70 18.161 6.698 2.230 578 1HD LYS 70 HD2 LYS 70 19.975 7.752 0.198 579 2HD LYS 70 HD3 LYS 70 19.692 8.905 1.502 580 1HE LYS 70 HE2 LYS 70 21.453 7.655 2.379 581 2HE LYS 70 HE3 LYS 70 20.060 6.804 3.047 582 1HZ LYS 70 HZ1 LYS 70 20.989 5.966 0.413 583 2HZ LYS 70 HZ2 LYS 70 21.981 5.571 1.732 584 3HZ LYS 70 HZ3 LYS 70 20.367 5.038 1.694 585 H LYS 71 H LYS 71 15.299 4.829 -1.039 586 HA LYS 71 HA LYS 71 15.513 5.446 -3.957 587 1HB LYS 71 HB2 LYS 71 16.106 2.842 -2.532 588 2HB LYS 71 HB3 LYS 71 15.835 2.944 -4.273 589 1HG LYS 71 HG2 LYS 71 17.659 4.984 -3.780 590 2HG LYS 71 HG3 LYS 71 18.200 3.680 -2.721 591 1HD LYS 71 HD2 LYS 71 18.030 2.123 -4.707 592 2HD LYS 71 HD3 LYS 71 17.751 3.545 -5.714 593 1HE LYS 71 HE2 LYS 71 19.933 4.148 -5.656 594 2HE LYS 71 HE3 LYS 71 20.063 3.825 -3.927 595 1HZ LYS 71 HZ1 LYS 71 19.725 1.402 -5.328 596 2HZ LYS 71 HZ2 LYS 71 21.012 2.266 -6.016 597 3HZ LYS 71 HZ3 LYS 71 21.028 1.899 -4.357 598 H ILE 72 H ILE 72 13.547 5.400 -4.920 599 HA ILE 72 HA ILE 72 11.407 3.740 -3.645 600 HB ILE 72 HB ILE 72 11.159 6.427 -5.032 601 1HG1 ILE 72 HG12 ILE 72 10.056 6.065 -2.338 602 2HG1 ILE 72 HG13 ILE 72 11.803 5.833 -2.402 603 1HG2 ILE 72 HG21 ILE 72 9.310 4.383 -5.071 604 2HG2 ILE 72 HG22 ILE 72 8.823 5.299 -3.645 605 3HG2 ILE 72 HG23 ILE 72 8.921 6.097 -5.214 606 1HD1 ILE 72 HD11 ILE 72 11.350 8.070 -4.013 607 2HD1 ILE 72 HD12 ILE 72 10.265 8.294 -2.640 608 3HD1 ILE 72 HD13 ILE 72 11.995 8.079 -2.371 609 H GLU 73 H GLU 73 10.716 2.141 -4.989 610 HA GLU 73 HA GLU 73 10.824 2.641 -7.930 611 1HB GLU 73 HB2 GLU 73 11.482 -0.052 -6.743 612 2HB GLU 73 HB3 GLU 73 11.837 0.552 -8.362 613 1HG GLU 73 HG2 GLU 73 13.386 2.232 -7.351 614 2HG GLU 73 HG3 GLU 73 13.096 1.502 -5.772 615 H VAL 74 H VAL 74 9.024 1.920 -9.029 616 HA VAL 74 HA VAL 74 6.869 0.702 -7.375 617 HB VAL 74 HB VAL 74 5.363 1.446 -9.177 618 1HG1 VAL 74 HG11 VAL 74 7.111 3.204 -7.627 619 2HG1 VAL 74 HG12 VAL 74 6.478 3.995 -9.070 620 3HG1 VAL 74 HG13 VAL 74 5.369 3.303 -7.885 621 1HG2 VAL 74 HG21 VAL 74 7.700 1.356 -10.722 622 2HG2 VAL 74 HG22 VAL 74 6.121 1.943 -11.248 623 3HG2 VAL 74 HG23 VAL 74 7.313 3.073 -10.605 624 H GLU 75 H GLU 75 5.865 -1.248 -8.033 625 HA GLU 75 HA GLU 75 7.170 -2.645 -10.335 626 1HB GLU 75 HB2 GLU 75 8.054 -3.604 -8.285 627 2HB GLU 75 HB3 GLU 75 6.428 -3.790 -7.627 628 1HG GLU 75 HG2 GLU 75 5.856 -5.413 -9.330 629 2HG GLU 75 HG3 GLU 75 7.382 -5.134 -10.171 630 H PHE 76 H PHE 76 5.395 -2.224 -11.727 631 HA PHE 76 HA PHE 76 2.651 -2.596 -11.017 632 1HB PHE 76 HB2 PHE 76 3.971 -2.867 -13.737 633 2HB PHE 76 HB3 PHE 76 2.241 -2.674 -13.453 634 HD1 PHE 76 HD1 PHE 76 5.535 -1.016 -13.317 635 HD2 PHE 76 HD2 PHE 76 1.306 -0.546 -12.726 636 HE1 PHE 76 HE1 PHE 76 5.821 1.446 -13.231 637 HE2 PHE 76 HE2 PHE 76 1.591 1.916 -12.641 638 HZ PHE 76 HZ PHE 76 3.850 2.911 -12.894 639 H ASP 77 H ASP 77 1.235 -4.389 -11.676 640 HA ASP 77 HA ASP 77 2.602 -6.995 -11.327 641 1HB ASP 77 HB2 ASP 77 0.262 -5.990 -10.299 642 2HB ASP 77 HB3 ASP 77 -0.329 -6.975 -11.639 643 H LYS 78 H LYS 78 0.548 -8.542 -12.672 644 HA LYS 78 HA LYS 78 1.423 -8.035 -15.472 645 1HB LYS 78 HB2 LYS 78 0.326 -10.422 -15.731 646 2HB LYS 78 HB3 LYS 78 1.933 -10.259 -15.030 647 1HG LYS 78 HG2 LYS 78 0.505 -11.763 -13.681 648 2HG LYS 78 HG3 LYS 78 0.975 -10.332 -12.767 649 1HD LYS 78 HD2 LYS 78 -1.426 -10.831 -12.466 650 2HD LYS 78 HD3 LYS 78 -1.201 -9.286 -13.282 651 1HE LYS 78 HE2 LYS 78 -2.938 -10.522 -14.446 652 2HE LYS 78 HE3 LYS 78 -1.509 -10.469 -15.477 653 1HZ LYS 78 HZ1 LYS 78 -2.093 -12.716 -13.636 654 2HZ LYS 78 HZ2 LYS 78 -2.595 -12.697 -15.260 655 3HZ LYS 78 HZ3 LYS 78 -0.941 -12.666 -14.883 656 H GLY 79 H GLY 79 -1.127 -7.225 -13.576 657 1HA GLY 79 HA2 GLY 79 -3.197 -7.753 -15.638 658 2HA GLY 79 HA3 GLY 79 -3.504 -7.148 -14.010 659 H GLN 80 H GLN 80 -4.663 -5.301 -14.691 660 HA GLN 80 HA GLN 80 -3.620 -3.478 -16.690 661 1HB GLN 80 HB2 GLN 80 -5.607 -2.742 -14.537 662 2HB GLN 80 HB3 GLN 80 -5.487 -2.107 -16.178 663 1HG GLN 80 HG2 GLN 80 -5.825 -4.992 -16.211 664 2HG GLN 80 HG3 GLN 80 -7.132 -4.214 -15.319 665 1HE2 GLN 80 HE21 GLN 80 -8.563 -4.821 -17.192 666 2HE2 GLN 80 HE22 GLN 80 -8.541 -3.864 -18.594 667 H ARG 81 H ARG 81 -2.903 -1.243 -16.200 668 HA ARG 81 HA ARG 81 -1.268 -1.206 -13.706 669 1HB ARG 81 HB2 ARG 81 -1.007 0.674 -16.062 670 2HB ARG 81 HB3 ARG 81 0.184 0.332 -14.807 671 1HG ARG 81 HG2 ARG 81 0.835 -1.647 -15.770 672 2HG ARG 81 HG3 ARG 81 -0.775 -1.993 -16.400 673 1HD ARG 81 HD2 ARG 81 0.084 0.355 -17.713 674 2HD ARG 81 HD3 ARG 81 1.461 -0.747 -17.738 675 HE ARG 81 HE ARG 81 -0.297 -2.452 -18.645 676 1HH1 ARG 81 HH11 ARG 81 0.949 -0.293 -20.505 677 2HH1 ARG 81 HH12 ARG 81 -0.457 0.182 -21.398 678 1HH2 ARG 81 HH21 ARG 81 -2.685 -1.306 -19.198 679 2HH2 ARG 81 HH22 ARG 81 -2.514 -0.391 -20.658 680 H THR 82 H THR 82 -4.221 -0.154 -14.654 681 HA THR 82 HA THR 82 -4.119 2.089 -12.720 682 HB THR 82 HB THR 82 -5.677 3.315 -14.481 683 HG1 THR 82 HG1 THR 82 -5.663 1.773 -16.057 684 1HG2 THR 82 HG21 THR 82 -2.900 3.403 -13.794 685 2HG2 THR 82 HG22 THR 82 -3.060 3.753 -15.515 686 3HG2 THR 82 HG23 THR 82 -3.936 4.725 -14.332 687 H ASP 83 H ASP 83 -6.033 2.284 -11.560 688 HA ASP 83 HA ASP 83 -7.991 0.118 -11.916 689 1HB ASP 83 HB2 ASP 83 -7.038 1.579 -9.723 690 2HB ASP 83 HB3 ASP 83 -8.706 2.110 -9.924 691 H LYS 84 H LYS 84 -10.314 1.460 -11.008 692 HA LYS 84 HA LYS 84 -11.229 2.621 -13.514 693 1HB LYS 84 HB2 LYS 84 -13.386 2.881 -12.325 694 2HB LYS 84 HB3 LYS 84 -12.733 1.254 -12.123 695 1HG LYS 84 HG2 LYS 84 -11.599 2.359 -9.982 696 2HG LYS 84 HG3 LYS 84 -12.965 3.465 -10.124 697 1HD LYS 84 HD2 LYS 84 -13.311 0.461 -10.163 698 2HD LYS 84 HD3 LYS 84 -13.343 1.396 -8.668 699 1HE LYS 84 HE2 LYS 84 -15.055 2.865 -10.166 700 2HE LYS 84 HE3 LYS 84 -15.338 1.270 -10.861 701 1HZ LYS 84 HZ1 LYS 84 -15.213 1.439 -7.954 702 2HZ LYS 84 HZ2 LYS 84 -16.582 2.117 -8.699 703 3HZ LYS 84 HZ3 LYS 84 -16.201 0.480 -8.944 704 H TYR 85 H TYR 85 -9.567 3.882 -10.872 705 HA TYR 85 HA TYR 85 -10.768 6.586 -11.202 706 1HB TYR 85 HB2 TYR 85 -9.009 5.318 -9.110 707 2HB TYR 85 HB3 TYR 85 -9.120 7.073 -9.241 708 HD1 TYR 85 HD1 TYR 85 -11.161 3.977 -8.834 709 HD2 TYR 85 HD2 TYR 85 -10.994 8.247 -8.392 710 HE1 TYR 85 HE1 TYR 85 -13.317 3.934 -7.609 711 HE2 TYR 85 HE2 TYR 85 -13.150 8.204 -7.166 712 HH TYR 85 HH TYR 85 -15.214 6.540 -7.139 713 H GLY 86 H GLY 86 -8.383 4.784 -12.603 714 1HA GLY 86 HA2 GLY 86 -6.742 5.512 -14.148 715 2HA GLY 86 HA3 GLY 86 -7.059 7.175 -13.653 716 H ARG 87 H ARG 87 -6.653 5.426 -10.867 717 HA ARG 87 HA ARG 87 -4.064 6.613 -10.337 718 1HB ARG 87 HB2 ARG 87 -5.339 4.390 -8.733 719 2HB ARG 87 HB3 ARG 87 -4.261 5.665 -8.163 720 1HG ARG 87 HG2 ARG 87 -6.144 7.274 -9.029 721 2HG ARG 87 HG3 ARG 87 -7.168 5.842 -8.909 722 1HD ARG 87 HD2 ARG 87 -5.978 5.663 -6.520 723 2HD ARG 87 HD3 ARG 87 -5.835 7.406 -6.745 724 HE ARG 87 HE ARG 87 -8.203 7.584 -6.572 725 1HH1 ARG 87 HH11 ARG 87 -7.483 4.447 -7.649 726 2HH1 ARG 87 HH12 ARG 87 -8.846 3.700 -6.884 727 1HH2 ARG 87 HH21 ARG 87 -9.823 6.579 -5.214 728 2HH2 ARG 87 HH22 ARG 87 -10.171 4.907 -5.506 729 H GLY 88 H GLY 88 -2.041 5.547 -10.190 730 1HA GLY 88 HA2 GLY 88 -1.768 3.204 -11.917 731 2HA GLY 88 HA3 GLY 88 -0.448 4.055 -11.111 732 H LEU 89 H LEU 89 -1.530 1.102 -11.250 733 HA LEU 89 HA LEU 89 -1.546 0.631 -8.300 734 1HB LEU 89 HB2 LEU 89 -2.333 -1.330 -10.469 735 2HB LEU 89 HB3 LEU 89 -2.651 -1.452 -8.737 736 HG LEU 89 HG LEU 89 -3.678 0.899 -10.314 737 1HD1 LEU 89 HD11 LEU 89 -4.788 -1.899 -10.175 738 2HD1 LEU 89 HD12 LEU 89 -5.867 -0.514 -10.344 739 3HD1 LEU 89 HD13 LEU 89 -4.645 -0.835 -11.575 740 1HD2 LEU 89 HD21 LEU 89 -3.638 0.479 -7.676 741 2HD2 LEU 89 HD22 LEU 89 -5.009 1.267 -8.458 742 3HD2 LEU 89 HD23 LEU 89 -5.092 -0.446 -8.048 743 H ALA 90 H ALA 90 0.357 -0.054 -7.494 744 HA ALA 90 HA ALA 90 1.858 -2.211 -8.684 745 1HB ALA 90 HB1 ALA 90 2.482 0.460 -9.572 746 2HB ALA 90 HB2 ALA 90 3.843 -0.192 -8.659 747 3HB ALA 90 HB3 ALA 90 3.221 -1.065 -10.060 748 H TYR 91 H TYR 91 3.558 -2.918 -7.264 749 HA TYR 91 HA TYR 91 3.165 -2.069 -4.491 750 1HB TYR 91 HB2 TYR 91 5.275 -3.980 -5.507 751 2HB TYR 91 HB3 TYR 91 4.532 -3.930 -3.907 752 HD1 TYR 91 HD1 TYR 91 2.270 -4.768 -3.533 753 HD2 TYR 91 HD2 TYR 91 4.070 -4.893 -7.430 754 HE1 TYR 91 HE1 TYR 91 0.492 -6.314 -4.305 755 HE2 TYR 91 HE2 TYR 91 2.292 -6.441 -8.202 756 HH TYR 91 HH TYR 91 0.673 -7.933 -7.379 757 H ILE 92 H ILE 92 4.211 -0.304 -3.714 758 HA ILE 92 HA ILE 92 6.530 0.822 -5.053 759 HB ILE 92 HB ILE 92 5.281 1.462 -2.363 760 1HG1 ILE 92 HG12 ILE 92 5.074 3.064 -4.913 761 2HG1 ILE 92 HG13 ILE 92 3.941 1.757 -4.568 762 1HG2 ILE 92 HG21 ILE 92 7.640 2.504 -3.817 763 2HG2 ILE 92 HG22 ILE 92 6.536 3.732 -3.198 764 3HG2 ILE 92 HG23 ILE 92 7.261 2.562 -2.096 765 1HD1 ILE 92 HD11 ILE 92 4.141 3.279 -2.191 766 2HD1 ILE 92 HD12 ILE 92 3.971 4.438 -3.508 767 3HD1 ILE 92 HD13 ILE 92 2.760 3.176 -3.282 768 H TYR 93 H TYR 93 8.676 0.989 -4.131 769 HA TYR 93 HA TYR 93 9.252 -0.957 -1.942 770 1HB TYR 93 HB2 TYR 93 10.448 -0.823 -4.696 771 2HB TYR 93 HB3 TYR 93 11.433 -1.388 -3.346 772 HD1 TYR 93 HD1 TYR 93 8.445 -2.059 -5.402 773 HD2 TYR 93 HD2 TYR 93 10.927 -3.468 -2.191 774 HE1 TYR 93 HE1 TYR 93 7.344 -4.278 -5.525 775 HE2 TYR 93 HE2 TYR 93 9.828 -5.687 -2.314 776 HH TYR 93 HH TYR 93 7.438 -6.416 -4.833 777 H ALA 94 H ALA 94 10.550 -0.077 -0.397 778 HA ALA 94 HA ALA 94 12.224 2.279 -1.152 779 1HB ALA 94 HB1 ALA 94 10.059 2.849 0.116 780 2HB ALA 94 HB2 ALA 94 10.798 2.049 1.503 781 3HB ALA 94 HB3 ALA 94 11.563 3.472 0.796 782 H ASP 95 H ASP 95 14.317 1.825 -0.707 783 HA ASP 95 HA ASP 95 16.207 1.032 0.439 784 1HB ASP 95 HB2 ASP 95 14.297 0.164 2.626 785 2HB ASP 95 HB3 ASP 95 16.028 0.469 2.770 786 H GLY 96 H GLY 96 14.228 -0.663 -1.210 787 1HA GLY 96 HA2 GLY 96 14.486 -2.855 -2.074 788 2HA GLY 96 HA3 GLY 96 15.660 -3.185 -0.799 789 H LYS 97 H LYS 97 12.746 -1.809 0.342 790 HA LYS 97 HA LYS 97 11.757 -4.533 1.095 791 1HB LYS 97 HB2 LYS 97 12.809 -3.197 2.982 792 2HB LYS 97 HB3 LYS 97 11.493 -2.037 2.791 793 1HG LYS 97 HG2 LYS 97 10.034 -3.380 3.870 794 2HG LYS 97 HG3 LYS 97 10.511 -4.781 2.910 795 1HD LYS 97 HD2 LYS 97 12.676 -4.154 4.659 796 2HD LYS 97 HD3 LYS 97 11.198 -4.182 5.622 797 1HE LYS 97 HE2 LYS 97 10.778 -6.381 4.116 798 2HE LYS 97 HE3 LYS 97 12.541 -6.390 4.149 799 1HZ LYS 97 HZ1 LYS 97 12.328 -6.084 6.622 800 2HZ LYS 97 HZ2 LYS 97 10.677 -6.445 6.449 801 3HZ LYS 97 HZ3 LYS 97 11.845 -7.599 6.022 802 H MET 98 H MET 98 9.713 -4.918 0.405 803 HA MET 98 HA MET 98 8.191 -3.080 -1.117 804 1HB MET 98 HB2 MET 98 7.847 -5.550 -1.115 805 2HB MET 98 HB3 MET 98 7.143 -5.425 0.498 806 1HG MET 98 HG2 MET 98 5.438 -3.839 -0.430 807 2HG MET 98 HG3 MET 98 6.090 -4.144 -2.040 808 1HE MET 98 HE1 MET 98 5.816 -5.587 -3.357 809 2HE MET 98 HE2 MET 98 5.814 -7.323 -3.016 810 3HE MET 98 HE3 MET 98 4.316 -6.505 -3.453 811 H VAL 99 H VAL 99 7.261 -1.224 -0.408 812 HA VAL 99 HA VAL 99 6.923 -0.537 2.336 813 HB VAL 99 HB VAL 99 5.568 0.560 -0.146 814 1HG1 VAL 99 HG11 VAL 99 4.821 0.944 2.521 815 2HG1 VAL 99 HG12 VAL 99 5.810 2.354 2.136 816 3HG1 VAL 99 HG13 VAL 99 4.391 1.977 1.158 817 1HG2 VAL 99 HG21 VAL 99 8.133 1.062 1.297 818 2HG2 VAL 99 HG22 VAL 99 7.778 1.155 -0.428 819 3HG2 VAL 99 HG23 VAL 99 7.287 2.465 0.645 820 H ASN 100 H ASN 100 4.666 -1.915 -0.036 821 HA ASN 100 HA ASN 100 2.310 -1.781 1.549 822 1HB ASN 100 HB2 ASN 100 3.099 -3.928 -0.447 823 2HB ASN 100 HB3 ASN 100 1.461 -3.579 0.109 824 1HD2 ASN 100 HD21 ASN 100 0.590 -2.811 -1.888 825 2HD2 ASN 100 HD22 ASN 100 1.164 -1.419 -2.672 826 H GLU 101 H GLU 101 4.460 -4.621 1.086 827 HA GLU 101 HA GLU 101 3.295 -6.220 3.107 828 1HB GLU 101 HB2 GLU 101 5.186 -6.731 1.328 829 2HB GLU 101 HB3 GLU 101 6.260 -6.309 2.663 830 1HG GLU 101 HG2 GLU 101 5.745 -8.191 3.838 831 2HG GLU 101 HG3 GLU 101 4.040 -8.117 3.389 832 H ALA 102 H ALA 102 5.549 -3.546 3.328 833 HA ALA 102 HA ALA 102 6.508 -4.018 5.975 834 1HB ALA 102 HB1 ALA 102 6.693 -1.940 4.032 835 2HB ALA 102 HB2 ALA 102 6.172 -1.206 5.549 836 3HB ALA 102 HB3 ALA 102 7.662 -2.147 5.491 837 H LEU 103 H LEU 103 3.710 -2.165 4.799 838 HA LEU 103 HA LEU 103 2.770 -1.330 7.360 839 1HB LEU 103 HB2 LEU 103 1.402 -1.786 4.705 840 2HB LEU 103 HB3 LEU 103 0.499 -1.263 6.127 841 HG LEU 103 HG LEU 103 2.959 0.274 5.718 842 1HD1 LEU 103 HD11 LEU 103 1.068 -0.143 3.474 843 2HD1 LEU 103 HD12 LEU 103 1.470 1.538 3.825 844 3HD1 LEU 103 HD13 LEU 103 2.750 0.385 3.446 845 1HD2 LEU 103 HD21 LEU 103 0.044 0.738 6.280 846 2HD2 LEU 103 HD22 LEU 103 1.451 1.202 7.238 847 3HD2 LEU 103 HD23 LEU 103 1.047 2.097 5.771 848 H VAL 104 H VAL 104 1.909 -4.172 5.373 849 HA VAL 104 HA VAL 104 -0.014 -5.329 7.052 850 HB VAL 104 HB VAL 104 2.152 -6.760 5.480 851 1HG1 VAL 104 HG11 VAL 104 0.270 -7.786 7.293 852 2HG1 VAL 104 HG12 VAL 104 -0.428 -8.077 5.700 853 3HG1 VAL 104 HG13 VAL 104 1.175 -8.700 6.087 854 1HG2 VAL 104 HG21 VAL 104 -0.166 -5.198 4.700 855 2HG2 VAL 104 HG22 VAL 104 1.066 -5.940 3.679 856 3HG2 VAL 104 HG23 VAL 104 -0.345 -6.873 4.177 857 H ARG 105 H ARG 105 3.528 -5.495 7.293 858 HA ARG 105 HA ARG 105 3.627 -7.355 9.465 859 1HB ARG 105 HB2 ARG 105 5.550 -6.453 7.963 860 2HB ARG 105 HB3 ARG 105 5.620 -5.120 9.116 861 1HG ARG 105 HG2 ARG 105 5.458 -7.592 10.569 862 2HG ARG 105 HG3 ARG 105 6.761 -7.710 9.385 863 1HD ARG 105 HD2 ARG 105 6.602 -5.149 10.874 864 2HD ARG 105 HD3 ARG 105 7.075 -6.560 11.821 865 HE ARG 105 HE ARG 105 8.626 -5.354 9.622 866 1HH1 ARG 105 HH11 ARG 105 9.564 -6.257 12.414 867 2HH1 ARG 105 HH12 ARG 105 10.513 -7.645 11.995 868 1HH2 ARG 105 HH21 ARG 105 9.215 -7.894 8.790 869 2HH2 ARG 105 HH22 ARG 105 10.315 -8.573 9.944 870 H GLN 106 H GLN 106 3.520 -3.789 9.413 871 HA GLN 106 HA GLN 106 3.502 -3.621 12.328 872 1HB GLN 106 HB2 GLN 106 4.115 -1.847 10.336 873 2HB GLN 106 HB3 GLN 106 2.497 -1.310 10.788 874 1HG GLN 106 HG2 GLN 106 3.861 -1.865 13.208 875 2HG GLN 106 HG3 GLN 106 4.976 -0.936 12.207 876 1HE2 GLN 106 HE21 GLN 106 4.423 1.273 11.710 877 2HE2 GLN 106 HE22 GLN 106 3.096 2.059 12.420 878 H GLY 107 H GLY 107 1.236 -4.763 10.275 879 1HA GLY 107 HA2 GLY 107 -1.086 -5.050 10.434 880 2HA GLY 107 HA3 GLY 107 -0.901 -4.655 12.143 881 H LEU 108 H LEU 108 -0.138 -2.576 9.368 882 HA LEU 108 HA LEU 108 -2.106 -0.611 10.456 883 1HB LEU 108 HB2 LEU 108 0.461 -0.320 8.901 884 2HB LEU 108 HB3 LEU 108 -0.730 0.981 8.926 885 HG LEU 108 HG LEU 108 0.589 -0.282 11.348 886 1HD1 LEU 108 HD11 LEU 108 0.981 2.251 9.794 887 2HD1 LEU 108 HD12 LEU 108 1.229 2.285 11.539 888 3HD1 LEU 108 HD13 LEU 108 2.186 1.195 10.533 889 1HD2 LEU 108 HD21 LEU 108 -1.879 1.228 11.019 890 2HD2 LEU 108 HD22 LEU 108 -1.243 0.434 12.460 891 3HD2 LEU 108 HD23 LEU 108 -0.742 2.078 12.064 892 H ALA 109 H ALA 109 -1.662 -2.808 7.937 893 HA ALA 109 HA ALA 109 -3.814 -1.463 6.380 894 1HB ALA 109 HB1 ALA 109 -1.158 -2.448 5.332 895 2HB ALA 109 HB2 ALA 109 -2.568 -2.302 4.281 896 3HB ALA 109 HB3 ALA 109 -1.917 -0.874 5.086 897 H LYS 110 H LYS 110 -5.408 -2.886 5.828 898 HA LYS 110 HA LYS 110 -4.952 -5.758 6.427 899 1HB LYS 110 HB2 LYS 110 -7.555 -4.400 5.683 900 2HB LYS 110 HB3 LYS 110 -7.347 -5.970 6.460 901 1HG LYS 110 HG2 LYS 110 -6.619 -4.995 8.493 902 2HG LYS 110 HG3 LYS 110 -6.315 -3.434 7.729 903 1HD LYS 110 HD2 LYS 110 -8.380 -3.259 8.981 904 2HD LYS 110 HD3 LYS 110 -8.785 -3.265 7.264 905 1HE LYS 110 HE2 LYS 110 -9.637 -5.433 7.334 906 2HE LYS 110 HE3 LYS 110 -8.691 -5.867 8.757 907 1HZ LYS 110 HZ1 LYS 110 -10.888 -3.876 8.794 908 2HZ LYS 110 HZ2 LYS 110 -11.102 -5.518 9.178 909 3HZ LYS 110 HZ3 LYS 110 -10.082 -4.546 10.128 910 H VAL 111 H VAL 111 -5.000 -7.322 4.822 911 HA VAL 111 HA VAL 111 -4.535 -6.552 2.108 912 HB VAL 111 HB VAL 111 -5.306 -9.194 3.368 913 1HG1 VAL 111 HG11 VAL 111 -5.076 -8.391 0.515 914 2HG1 VAL 111 HG12 VAL 111 -4.272 -9.893 0.969 915 3HG1 VAL 111 HG13 VAL 111 -6.003 -9.702 1.244 916 1HG2 VAL 111 HG21 VAL 111 -2.763 -7.870 2.443 917 2HG2 VAL 111 HG22 VAL 111 -3.098 -8.668 3.978 918 3HG2 VAL 111 HG23 VAL 111 -2.872 -9.629 2.517 919 H ALA 112 H ALA 112 -5.971 -5.995 0.543 920 HA ALA 112 HA ALA 112 -8.630 -7.171 0.399 921 1HB ALA 112 HB1 ALA 112 -8.795 -5.341 2.189 922 2HB ALA 112 HB2 ALA 112 -8.522 -4.188 0.881 923 3HB ALA 112 HB3 ALA 112 -9.942 -5.233 0.854 924 H TYR 113 H TYR 113 -9.916 -5.787 -1.384 925 HA TYR 113 HA TYR 113 -9.956 -5.093 -3.624 926 1HB TYR 113 HB2 TYR 113 -7.265 -3.949 -2.821 927 2HB TYR 113 HB3 TYR 113 -8.064 -3.616 -4.357 928 HD1 TYR 113 HD1 TYR 113 -10.845 -3.281 -3.728 929 HD2 TYR 113 HD2 TYR 113 -7.413 -2.063 -1.451 930 HE1 TYR 113 HE1 TYR 113 -12.194 -1.505 -2.645 931 HE2 TYR 113 HE2 TYR 113 -8.762 -0.287 -0.367 932 HH TYR 113 HH TYR 113 -10.923 1.053 -1.051 933 H VAL 114 H VAL 114 -9.368 -7.722 -3.360 934 HA VAL 114 HA VAL 114 -6.906 -8.257 -4.932 935 HB VAL 114 HB VAL 114 -8.873 -10.203 -3.687 936 1HG1 VAL 114 HG11 VAL 114 -7.291 -10.874 -5.653 937 2HG1 VAL 114 HG12 VAL 114 -6.011 -10.755 -4.445 938 3HG1 VAL 114 HG13 VAL 114 -7.337 -11.897 -4.217 939 1HG2 VAL 114 HG21 VAL 114 -7.001 -8.489 -2.439 940 2HG2 VAL 114 HG22 VAL 114 -7.845 -9.856 -1.711 941 3HG2 VAL 114 HG23 VAL 114 -6.262 -10.090 -2.452 942 H TYR 115 H TYR 115 -7.951 -7.209 -6.860 943 HA TYR 115 HA TYR 115 -10.128 -8.807 -8.088 944 1HB TYR 115 HB2 TYR 115 -8.799 -6.281 -9.112 945 2HB TYR 115 HB3 TYR 115 -10.297 -6.999 -9.703 946 HD1 TYR 115 HD1 TYR 115 -12.347 -6.962 -8.325 947 HD2 TYR 115 HD2 TYR 115 -8.731 -5.035 -7.036 948 HE1 TYR 115 HE1 TYR 115 -13.629 -5.699 -6.618 949 HE2 TYR 115 HE2 TYR 115 -10.013 -3.772 -5.329 950 HH TYR 115 HH TYR 115 -12.632 -4.470 -4.108 951 H LYS 116 H LYS 116 -9.049 -10.693 -8.776 952 HA LYS 116 HA LYS 116 -6.519 -10.864 -10.003 953 1HB LYS 116 HB2 LYS 116 -7.616 -12.885 -11.232 954 2HB LYS 116 HB3 LYS 116 -7.525 -12.928 -9.472 955 1HG LYS 116 HG2 LYS 116 -9.926 -11.567 -10.459 956 2HG LYS 116 HG3 LYS 116 -9.835 -13.255 -10.961 957 1HD LYS 116 HD2 LYS 116 -9.069 -13.475 -8.360 958 2HD LYS 116 HD3 LYS 116 -10.179 -12.108 -8.253 959 1HE LYS 116 HE2 LYS 116 -10.770 -14.857 -9.381 960 2HE LYS 116 HE3 LYS 116 -11.477 -14.121 -7.943 961 1HZ LYS 116 HZ1 LYS 116 -11.746 -13.010 -10.682 962 2HZ LYS 116 HZ2 LYS 116 -12.909 -14.004 -9.943 963 3HZ LYS 116 HZ3 LYS 116 -12.549 -12.485 -9.280 964 HA PRO 117 HA PRO 117 -5.885 -12.331 -11.646 965 1HB PRO 117 HB2 PRO 117 -4.048 -12.006 -13.638 966 2HB PRO 117 HB3 PRO 117 -5.557 -12.910 -13.856 967 1HG PRO 117 HG2 PRO 117 -4.820 -10.211 -14.860 968 2HG PRO 117 HG3 PRO 117 -5.961 -11.389 -15.528 969 1HD PRO 117 HD2 PRO 117 -6.620 -9.087 -14.006 970 2HD PRO 117 HD3 PRO 117 -7.720 -10.410 -14.450 971 H ASN 118 H ASN 118 -5.789 -9.180 -11.147 972 HA ASN 118 HA ASN 118 -2.923 -8.672 -10.919 973 1HB ASN 118 HB2 ASN 118 -5.441 -7.202 -10.326 974 2HB ASN 118 HB3 ASN 118 -4.029 -6.755 -9.369 975 1HD2 ASN 118 HD21 ASN 118 -5.243 -5.028 -11.385 976 2HD2 ASN 118 HD22 ASN 118 -4.091 -4.798 -12.610 977 H ASN 119 H ASN 119 -2.468 -10.654 -9.609 978 HA ASN 119 HA ASN 119 -2.497 -9.999 -6.756 979 1HB ASN 119 HB2 ASN 119 -3.584 -12.156 -6.107 980 2HB ASN 119 HB3 ASN 119 -4.685 -11.064 -6.949 981 1HD2 ASN 119 HD21 ASN 119 -6.026 -12.640 -7.968 982 2HD2 ASN 119 HD22 ASN 119 -5.443 -13.757 -9.106 983 H THR 120 H THR 120 -0.462 -10.410 -8.775 984 HA THR 120 HA THR 120 0.691 -13.011 -8.691 985 HB THR 120 HB THR 120 2.075 -10.322 -8.935 986 HG1 THR 120 HG1 THR 120 1.912 -10.817 -11.167 987 1HG2 THR 120 HG21 THR 120 2.966 -13.153 -9.520 988 2HG2 THR 120 HG22 THR 120 3.784 -11.733 -10.171 989 3HG2 THR 120 HG23 THR 120 3.720 -11.991 -8.428 990 H HIS 121 H HIS 121 0.426 -10.601 -6.257 991 HA HIS 121 HA HIS 121 2.263 -12.203 -4.531 992 1HB HIS 121 HB2 HIS 121 2.022 -9.190 -4.381 993 2HB HIS 121 HB3 HIS 121 3.196 -10.219 -3.562 994 HD1 HIS 121 HD1 HIS 121 4.907 -11.533 -5.210 995 HD2 HIS 121 HD2 HIS 121 2.836 -8.332 -6.896 996 HE1 HIS 121 HE1 HIS 121 6.140 -10.922 -7.337 997 H GLU 122 H GLU 122 -0.723 -12.084 -4.886 998 HA GLU 122 HA GLU 122 -1.791 -10.734 -2.547 999 1HB GLU 122 HB2 GLU 122 -3.269 -11.144 -4.419 1000 2HB GLU 122 HB3 GLU 122 -2.940 -12.876 -4.357 1001 1HG GLU 122 HG2 GLU 122 -3.838 -11.850 -1.779 1002 2HG GLU 122 HG3 GLU 122 -5.024 -11.560 -3.053 1003 H GLN 123 H GLN 123 -1.010 -14.130 -3.323 1004 HA GLN 123 HA GLN 123 -1.833 -15.239 -0.833 1005 1HB GLN 123 HB2 GLN 123 -0.758 -16.248 -3.153 1006 2HB GLN 123 HB3 GLN 123 0.577 -16.452 -2.020 1007 1HG GLN 123 HG2 GLN 123 -0.570 -18.407 -1.587 1008 2HG GLN 123 HG3 GLN 123 -1.391 -17.342 -0.445 1009 1HE2 GLN 123 HE21 GLN 123 -3.501 -16.383 -1.188 1010 2HE2 GLN 123 HE22 GLN 123 -4.422 -17.210 -2.349 1011 H LEU 124 H LEU 124 1.190 -13.686 -1.827 1012 HA LEU 124 HA LEU 124 2.711 -14.340 0.507 1013 1HB LEU 124 HB2 LEU 124 3.484 -13.253 -1.730 1014 2HB LEU 124 HB3 LEU 124 3.012 -11.731 -0.972 1015 HG LEU 124 HG LEU 124 4.453 -12.457 1.022 1016 1HD1 LEU 124 HD11 LEU 124 5.324 -14.457 -1.078 1017 2HD1 LEU 124 HD12 LEU 124 6.300 -14.054 0.335 1018 3HD1 LEU 124 HD13 LEU 124 4.715 -14.799 0.541 1019 1HD2 LEU 124 HD21 LEU 124 5.129 -10.726 -0.632 1020 2HD2 LEU 124 HD22 LEU 124 6.512 -11.655 -0.054 1021 3HD2 LEU 124 HD23 LEU 124 5.828 -11.990 -1.644 1022 H LEU 125 H LEU 125 0.867 -11.374 -0.288 1023 HA LEU 125 HA LEU 125 1.212 -10.146 2.264 1024 1HB LEU 125 HB2 LEU 125 -0.981 -9.861 0.191 1025 2HB LEU 125 HB3 LEU 125 -0.846 -8.831 1.616 1026 HG LEU 125 HG LEU 125 1.131 -9.107 -0.659 1027 1HD1 LEU 125 HD11 LEU 125 -1.014 -7.422 -0.326 1028 2HD1 LEU 125 HD12 LEU 125 0.301 -6.468 0.361 1029 3HD1 LEU 125 HD13 LEU 125 0.408 -7.050 -1.301 1030 1HD2 LEU 125 HD21 LEU 125 1.514 -8.288 2.165 1031 2HD2 LEU 125 HD22 LEU 125 2.694 -8.880 0.995 1032 3HD2 LEU 125 HD23 LEU 125 2.188 -7.191 0.961 1033 H ARG 126 H ARG 126 -0.845 -12.728 1.194 1034 HA ARG 126 HA ARG 126 -2.830 -12.517 3.281 1035 1HB ARG 126 HB2 ARG 126 -2.666 -13.995 1.026 1036 2HB ARG 126 HB3 ARG 126 -2.130 -15.200 2.198 1037 1HG ARG 126 HG2 ARG 126 -4.151 -15.051 3.439 1038 2HG ARG 126 HG3 ARG 126 -4.623 -13.552 2.639 1039 1HD ARG 126 HD2 ARG 126 -5.672 -14.707 1.019 1040 2HD ARG 126 HD3 ARG 126 -4.186 -15.580 0.649 1041 HE ARG 126 HE ARG 126 -6.418 -16.624 2.160 1042 1HH1 ARG 126 HH11 ARG 126 -3.790 -17.695 0.618 1043 2HH1 ARG 126 HH12 ARG 126 -3.220 -18.780 1.842 1044 1HH2 ARG 126 HH21 ARG 126 -5.346 -17.555 4.291 1045 2HH2 ARG 126 HH22 ARG 126 -4.103 -18.704 3.920 1046 H LYS 127 H LYS 127 0.143 -14.463 2.920 1047 HA LYS 127 HA LYS 127 -0.039 -15.732 5.482 1048 1HB LYS 127 HB2 LYS 127 1.451 -16.700 3.890 1049 2HB LYS 127 HB3 LYS 127 2.280 -15.167 3.628 1050 1HG LYS 127 HG2 LYS 127 3.656 -15.508 5.386 1051 2HG LYS 127 HG3 LYS 127 2.313 -15.959 6.437 1052 1HD LYS 127 HD2 LYS 127 3.018 -18.092 6.320 1053 2HD LYS 127 HD3 LYS 127 2.590 -18.086 4.609 1054 1HE LYS 127 HE2 LYS 127 4.773 -18.305 4.109 1055 2HE LYS 127 HE3 LYS 127 5.054 -16.710 4.808 1056 1HZ LYS 127 HZ1 LYS 127 5.296 -17.759 6.981 1057 2HZ LYS 127 HZ2 LYS 127 5.063 -19.290 6.282 1058 3HZ LYS 127 HZ3 LYS 127 6.431 -18.367 5.877 1059 H SER 128 H SER 128 2.242 -13.164 4.506 1060 HA SER 128 HA SER 128 3.152 -12.411 7.021 1061 1HB SER 128 HB2 SER 128 3.131 -9.995 5.957 1062 2HB SER 128 HB3 SER 128 4.183 -11.241 5.290 1063 HG SER 128 HG SER 128 2.352 -9.895 4.022 1064 H GLU 129 H GLU 129 0.126 -11.411 5.442 1065 HA GLU 129 HA GLU 129 -0.742 -9.530 7.374 1066 1HB GLU 129 HB2 GLU 129 -1.962 -9.749 5.308 1067 2HB GLU 129 HB3 GLU 129 -2.313 -11.447 5.632 1068 1HG GLU 129 HG2 GLU 129 -3.191 -9.816 7.850 1069 2HG GLU 129 HG3 GLU 129 -3.893 -9.220 6.345 1070 H ALA 130 H ALA 130 -1.423 -13.039 7.198 1071 HA ALA 130 HA ALA 130 -2.896 -13.250 9.597 1072 1HB ALA 130 HB1 ALA 130 -2.173 -15.030 7.723 1073 2HB ALA 130 HB2 ALA 130 -0.962 -15.427 8.943 1074 3HB ALA 130 HB3 ALA 130 -2.678 -15.531 9.338 1075 H GLN 131 H GLN 131 0.565 -12.992 9.054 1076 HA GLN 131 HA GLN 131 1.403 -13.750 11.699 1077 1HB GLN 131 HB2 GLN 131 3.001 -13.651 9.846 1078 2HB GLN 131 HB3 GLN 131 2.714 -11.921 9.662 1079 1HG GLN 131 HG2 GLN 131 4.678 -11.993 10.954 1080 2HG GLN 131 HG3 GLN 131 3.414 -11.770 12.165 1081 1HE2 GLN 131 HE21 GLN 131 3.114 -13.435 13.713 1082 2HE2 GLN 131 HE22 GLN 131 4.002 -14.881 13.721 1083 H ALA 132 H ALA 132 0.462 -10.665 10.229 1084 HA ALA 132 HA ALA 132 1.110 -9.057 12.536 1085 1HB ALA 132 HB1 ALA 132 -0.527 -8.674 10.050 1086 2HB ALA 132 HB2 ALA 132 -0.701 -7.520 11.372 1087 3HB ALA 132 HB3 ALA 132 0.874 -7.763 10.616 1088 H LYS 133 H LYS 133 -1.754 -10.848 11.501 1089 HA LYS 133 HA LYS 133 -3.603 -9.772 13.384 1090 1HB LYS 133 HB2 LYS 133 -3.568 -11.879 11.476 1091 2HB LYS 133 HB3 LYS 133 -4.066 -12.588 13.013 1092 1HG LYS 133 HG2 LYS 133 -5.547 -10.345 13.090 1093 2HG LYS 133 HG3 LYS 133 -5.431 -10.538 11.340 1094 1HD LYS 133 HD2 LYS 133 -6.346 -12.694 13.268 1095 2HD LYS 133 HD3 LYS 133 -7.416 -11.708 12.271 1096 1HE LYS 133 HE2 LYS 133 -7.053 -13.014 10.473 1097 2HE LYS 133 HE3 LYS 133 -5.304 -12.866 10.658 1098 1HZ LYS 133 HZ1 LYS 133 -6.063 -14.496 12.707 1099 2HZ LYS 133 HZ2 LYS 133 -7.035 -15.012 11.412 1100 3HZ LYS 133 HZ3 LYS 133 -5.347 -14.994 11.249 1101 H LYS 134 H LYS 134 -1.428 -12.600 13.616 1102 HA LYS 134 HA LYS 134 -2.146 -13.250 16.317 1103 1HB LYS 134 HB2 LYS 134 0.489 -13.797 14.924 1104 2HB LYS 134 HB3 LYS 134 -0.209 -14.688 16.272 1105 1HG LYS 134 HG2 LYS 134 -1.790 -14.430 13.741 1106 2HG LYS 134 HG3 LYS 134 -0.473 -15.603 13.811 1107 1HD LYS 134 HD2 LYS 134 -1.467 -16.711 15.712 1108 2HD LYS 134 HD3 LYS 134 -2.686 -15.447 15.874 1109 1HE LYS 134 HE2 LYS 134 -3.440 -17.597 14.703 1110 2HE LYS 134 HE3 LYS 134 -3.767 -16.090 13.848 1111 1HZ LYS 134 HZ1 LYS 134 -1.189 -17.308 13.314 1112 2HZ LYS 134 HZ2 LYS 134 -2.536 -18.173 12.746 1113 3HZ LYS 134 HZ3 LYS 134 -2.283 -16.569 12.250 1114 H GLU 135 H GLU 135 0.064 -10.949 14.881 1115 HA GLU 135 HA GLU 135 1.513 -10.438 17.367 1116 1HB GLU 135 HB2 GLU 135 1.673 -9.593 14.583 1117 2HB GLU 135 HB3 GLU 135 1.865 -8.230 15.687 1118 1HG GLU 135 HG2 GLU 135 3.670 -9.331 16.849 1119 2HG GLU 135 HG3 GLU 135 3.389 -10.833 15.967 1120 H LYS 136 H LYS 136 -1.511 -9.538 16.091 1121 HA LYS 136 HA LYS 136 -3.035 -7.835 16.672 1122 1HB LYS 136 HB2 LYS 136 -1.672 -8.554 19.274 1123 2HB LYS 136 HB3 LYS 136 -3.013 -7.412 19.209 1124 1HG LYS 136 HG2 LYS 136 -4.539 -9.053 18.890 1125 2HG LYS 136 HG3 LYS 136 -3.525 -9.876 17.703 1126 1HD LYS 136 HD2 LYS 136 -3.888 -11.256 19.744 1127 2HD LYS 136 HD3 LYS 136 -2.184 -10.871 19.494 1128 1HE LYS 136 HE2 LYS 136 -2.100 -9.434 21.296 1129 2HE LYS 136 HE3 LYS 136 -3.798 -8.979 21.146 1130 1HZ LYS 136 HZ1 LYS 136 -4.247 -11.387 21.822 1131 2HZ LYS 136 HZ2 LYS 136 -2.635 -11.406 22.356 1132 3HZ LYS 136 HZ3 LYS 136 -3.742 -10.307 23.028 1133 H LEU 137 H LEU 137 -1.392 -6.446 15.326 1134 HA LEU 137 HA LEU 137 -0.106 -4.403 17.075 1135 1HB LEU 137 HB2 LEU 137 0.540 -5.587 14.486 1136 2HB LEU 137 HB3 LEU 137 0.588 -3.823 14.446 1137 HG LEU 137 HG LEU 137 1.953 -5.472 16.587 1138 1HD1 LEU 137 HD11 LEU 137 2.687 -5.099 13.838 1139 2HD1 LEU 137 HD12 LEU 137 3.821 -4.210 14.852 1140 3HD1 LEU 137 HD13 LEU 137 3.579 -5.938 15.106 1141 1HD2 LEU 137 HD21 LEU 137 1.270 -2.905 16.752 1142 2HD2 LEU 137 HD22 LEU 137 2.832 -3.465 17.346 1143 3HD2 LEU 137 HD23 LEU 137 2.715 -2.695 15.764 1144 H ASN 138 H ASN 138 -1.473 -2.742 17.499 1145 HA ASN 138 HA ASN 138 -2.892 -0.925 17.124 1146 1HB ASN 138 HB2 ASN 138 -2.187 -1.386 14.213 1147 2HB ASN 138 HB3 ASN 138 -2.864 0.088 14.904 1148 1HD2 ASN 138 HD21 ASN 138 0.080 -1.585 14.251 1149 2HD2 ASN 138 HD22 ASN 138 1.116 -0.545 15.102 1150 H ILE 139 H ILE 139 -4.077 -1.471 14.026 1151 HA ILE 139 HA ILE 139 -6.728 -1.753 14.596 1152 HB ILE 139 HB ILE 139 -5.291 -3.309 12.426 1153 1HG1 ILE 139 HG12 ILE 139 -6.659 -0.753 11.827 1154 2HG1 ILE 139 HG13 ILE 139 -5.201 -0.605 12.808 1155 1HG2 ILE 139 HG21 ILE 139 -8.162 -2.593 12.961 1156 2HG2 ILE 139 HG22 ILE 139 -7.598 -2.773 11.300 1157 3HG2 ILE 139 HG23 ILE 139 -7.483 -4.129 12.423 1158 1HD1 ILE 139 HD11 ILE 139 -4.748 -2.494 10.675 1159 2HD1 ILE 139 HD12 ILE 139 -5.347 -0.977 10.008 1160 3HD1 ILE 139 HD13 ILE 139 -3.898 -0.987 11.014 1161 H TRP 140 H TRP 140 -4.398 -4.443 14.537 1162 HA TRP 140 HA TRP 140 -6.492 -6.349 15.322 1163 1HB TRP 140 HB2 TRP 140 -3.495 -6.776 15.175 1164 2HB TRP 140 HB3 TRP 140 -4.748 -8.019 15.179 1165 HD1 TRP 140 HD1 TRP 140 -2.773 -5.878 12.892 1166 HE1 TRP 140 HE1 TRP 140 -3.666 -6.067 10.481 1167 HE3 TRP 140 HE3 TRP 140 -7.184 -8.294 13.774 1168 HZ2 TRP 140 HZ2 TRP 140 -5.951 -7.106 9.108 1169 HZ3 TRP 140 HZ3 TRP 140 -8.699 -8.870 11.900 1170 HH2 TRP 140 HH2 TRP 140 -8.089 -8.279 9.570 1171 H SER 141 H SER 141 -6.284 -4.286 17.194 1172 HA SER 141 HA SER 141 -4.858 -5.580 19.477 1173 1HB SER 141 HB2 SER 141 -5.489 -2.733 18.796 1174 2HB SER 141 HB3 SER 141 -5.400 -3.188 20.495 1175 HG SER 141 HG SER 141 -3.352 -2.649 19.898 1176 H GLU 142 H GLU 142 -6.080 -6.278 21.199 1177 HA GLU 142 HA GLU 142 -9.020 -5.759 21.029 1178 1HB GLU 142 HB2 GLU 142 -8.032 -7.991 22.720 1179 2HB GLU 142 HB3 GLU 142 -9.423 -7.924 21.639 1180 1HG GLU 142 HG2 GLU 142 -7.413 -7.749 19.825 1181 2HG GLU 142 HG3 GLU 142 -6.625 -8.724 21.066 1182 H ASP 143 H ASP 143 -6.781 -6.780 23.633 1183 HA ASP 143 HA ASP 143 -8.048 -4.678 25.344 1184 1HB ASP 143 HB2 ASP 143 -8.161 -7.255 25.907 1185 2HB ASP 143 HB3 ASP 143 -6.514 -6.994 26.481 1186 H ASN 144 H ASN 144 -6.722 -3.037 25.965 1187 HA ASN 144 HA ASN 144 -3.875 -3.505 26.461 1188 1HB ASN 144 HB2 ASN 144 -4.857 -2.243 23.959 1189 2HB ASN 144 HB3 ASN 144 -3.537 -1.406 24.776 1190 1HD2 ASN 144 HD21 ASN 144 -4.302 -4.089 22.749 1191 2HD2 ASN 144 HD22 ASN 144 -2.777 -4.833 22.785 1192 H ALA 145 H ALA 145 -5.096 -0.399 25.387 1193 HA ALA 145 HA ALA 145 -4.606 0.694 28.075 1194 1HB ALA 145 HB1 ALA 145 -4.887 1.753 25.340 1195 2HB ALA 145 HB2 ALA 145 -5.629 2.765 26.580 1196 3HB ALA 145 HB3 ALA 145 -3.918 2.354 26.684 1197 H ASP 146 H ASP 146 -7.342 0.098 25.908 1198 HA ASP 146 HA ASP 146 -9.652 0.171 26.316 1199 1HB ASP 146 HB2 ASP 146 -8.604 -1.307 28.285 1200 2HB ASP 146 HB3 ASP 146 -9.193 0.039 29.262 1201 H SER 147 H SER 147 -8.158 2.690 26.285 1202 HA SER 147 HA SER 147 -9.638 4.302 28.307 1203 1HB SER 147 HB2 SER 147 -7.382 4.951 28.355 1204 2HB SER 147 HB3 SER 147 -7.200 4.793 26.610 1205 HG SER 147 HG SER 147 -7.374 6.952 27.038 1206 H GLY 148 H GLY 148 -10.883 6.141 27.600 1207 1HA GLY 148 HA2 GLY 148 -11.514 6.207 24.685 1208 2HA GLY 148 HA3 GLY 148 -12.826 6.079 25.857 1209 H GLN 149 H GLN 149 -9.979 8.130 25.149 1210 HA GLN 149 HA GLN 149 -11.589 10.454 26.135 1211 1HB GLN 149 HB2 GLN 149 -8.566 10.245 25.998 1212 2HB GLN 149 HB3 GLN 149 -9.509 11.532 26.752 1213 1HG GLN 149 HG2 GLN 149 -10.551 9.502 28.115 1214 2HG GLN 149 HG3 GLN 149 -9.013 8.740 27.705 1215 1HE2 GLN 149 HE21 GLN 149 -7.858 8.907 29.667 1216 2HE2 GLN 149 HE22 GLN 149 -7.568 10.372 30.474 1217 HN3 PTP 150 H3 PTP 150 -8.489 -3.035 -7.325 1218 1H5M PTP 150 H51 PTP 150 -6.078 0.351 -4.558 1219 2H5M PTP 150 H52 PTP 150 -6.447 -1.081 -3.568 1220 3H5M PTP 150 H53 PTP 150 -7.371 0.423 -3.337 1221 H6 PTP 150 H6 PTP 150 -9.158 0.969 -4.752 1222 H1* PTP 150 H1' PTP 150 -11.487 0.290 -7.510 1223 2H2* PTP 150 H2' PTP 150 -11.849 -0.285 -4.573 1224 H3* PTP 150 H3' PTP 150 -13.114 1.706 -4.230 1225 H4* PTP 150 H4' PTP 150 -11.899 3.473 -5.913 1226 2H5* PTP 150 H5' PTP 150 -10.852 1.896 -3.505 Start of MODEL 7 1 1H ALA 1 H1 ALA 1 21.089 -20.509 -7.126 2 2H ALA 1 H2 ALA 1 21.724 -19.375 -6.031 3 3H ALA 1 H3 ALA 1 21.430 -20.967 -5.526 4 HA ALA 1 HA ALA 1 19.051 -19.892 -6.584 5 1HB ALA 1 HB1 ALA 1 20.075 -21.119 -4.070 6 2HB ALA 1 HB2 ALA 1 18.574 -20.201 -3.954 7 3HB ALA 1 HB3 ALA 1 18.685 -21.572 -5.057 8 H THR 2 H THR 2 20.819 -17.748 -6.749 9 HA THR 2 HA THR 2 19.964 -15.982 -4.492 10 HB THR 2 HB THR 2 21.919 -14.704 -4.812 11 HG1 THR 2 HG1 THR 2 21.955 -15.931 -7.354 12 1HG2 THR 2 HG21 THR 2 22.176 -17.281 -4.188 13 2HG2 THR 2 HG22 THR 2 23.090 -17.305 -5.696 14 3HG2 THR 2 HG23 THR 2 23.586 -16.240 -4.380 15 H SER 3 H SER 3 18.785 -14.143 -4.977 16 HA SER 3 HA SER 3 17.515 -12.641 -6.258 17 1HB SER 3 HB2 SER 3 18.993 -13.330 -8.755 18 2HB SER 3 HB3 SER 3 18.528 -11.752 -8.126 19 HG SER 3 HG SER 3 20.449 -11.642 -7.308 20 H THR 4 H THR 4 15.820 -12.669 -7.932 21 HA THR 4 HA THR 4 15.313 -15.307 -9.190 22 HB THR 4 HB THR 4 13.107 -13.966 -7.634 23 HG1 THR 4 HG1 THR 4 13.961 -14.649 -5.862 24 1HG2 THR 4 HG21 THR 4 13.585 -16.538 -9.046 25 2HG2 THR 4 HG22 THR 4 12.627 -16.614 -7.568 26 3HG2 THR 4 HG23 THR 4 12.106 -15.589 -8.905 27 H LYS 5 H LYS 5 14.293 -11.928 -8.765 28 HA LYS 5 HA LYS 5 13.458 -10.400 -10.339 29 1HB LYS 5 HB2 LYS 5 14.371 -12.495 -12.335 30 2HB LYS 5 HB3 LYS 5 13.959 -10.822 -12.708 31 1HG LYS 5 HG2 LYS 5 15.795 -10.005 -11.350 32 2HG LYS 5 HG3 LYS 5 16.151 -11.637 -10.781 33 1HD LYS 5 HD2 LYS 5 17.643 -10.784 -12.663 34 2HD LYS 5 HD3 LYS 5 16.865 -12.340 -12.956 35 1HE LYS 5 HE2 LYS 5 15.054 -11.156 -14.200 36 2HE LYS 5 HE3 LYS 5 15.931 -9.642 -13.981 37 1HZ LYS 5 HZ1 LYS 5 17.350 -11.937 -15.127 38 2HZ LYS 5 HZ2 LYS 5 16.265 -11.083 -16.116 39 3HZ LYS 5 HZ3 LYS 5 17.576 -10.277 -15.406 40 H LYS 6 H LYS 6 11.491 -10.036 -11.460 41 HA LYS 6 HA LYS 6 9.826 -12.313 -12.264 42 1HB LYS 6 HB2 LYS 6 9.572 -11.132 -9.630 43 2HB LYS 6 HB3 LYS 6 8.096 -10.880 -10.564 44 1HG LYS 6 HG2 LYS 6 7.686 -13.156 -10.791 45 2HG LYS 6 HG3 LYS 6 9.388 -13.586 -10.606 46 1HD LYS 6 HD2 LYS 6 8.419 -12.256 -8.222 47 2HD LYS 6 HD3 LYS 6 7.404 -13.646 -8.609 48 1HE LYS 6 HE2 LYS 6 9.103 -15.155 -8.276 49 2HE LYS 6 HE3 LYS 6 10.347 -14.036 -8.833 50 1HZ LYS 6 HZ1 LYS 6 10.049 -12.784 -6.760 51 2HZ LYS 6 HZ2 LYS 6 8.940 -13.953 -6.220 52 3HZ LYS 6 HZ3 LYS 6 10.561 -14.380 -6.480 53 H LEU 7 H LEU 7 8.661 -9.180 -11.113 54 HA LEU 7 HA LEU 7 7.571 -8.623 -13.780 55 1HB LEU 7 HB2 LEU 7 7.541 -6.887 -11.291 56 2HB LEU 7 HB3 LEU 7 6.529 -6.689 -12.722 57 HG LEU 7 HG LEU 7 6.520 -9.246 -11.114 58 1HD1 LEU 7 HD11 LEU 7 4.902 -6.718 -10.715 59 2HD1 LEU 7 HD12 LEU 7 4.385 -8.290 -10.105 60 3HD1 LEU 7 HD13 LEU 7 5.884 -7.567 -9.522 61 1HD2 LEU 7 HD21 LEU 7 4.658 -7.933 -13.114 62 2HD2 LEU 7 HD22 LEU 7 5.539 -9.449 -13.307 63 3HD2 LEU 7 HD23 LEU 7 4.206 -9.344 -12.157 64 H HIS 8 H HIS 8 7.926 -5.676 -13.416 65 HA HIS 8 HA HIS 8 10.811 -5.532 -14.198 66 1HB HIS 8 HB2 HIS 8 9.339 -5.127 -16.116 67 2HB HIS 8 HB3 HIS 8 8.469 -3.890 -15.209 68 HD1 HIS 8 HD1 HIS 8 9.175 -1.938 -16.737 69 HD2 HIS 8 HD2 HIS 8 12.405 -4.020 -15.123 70 HE1 HIS 8 HE1 HIS 8 11.235 -0.548 -17.219 71 H LYS 9 H LYS 9 11.600 -4.895 -12.162 72 HA LYS 9 HA LYS 9 10.353 -2.900 -10.516 73 1HB LYS 9 HB2 LYS 9 13.020 -4.240 -10.617 74 2HB LYS 9 HB3 LYS 9 12.893 -2.741 -9.696 75 1HG LYS 9 HG2 LYS 9 10.634 -4.075 -8.890 76 2HG LYS 9 HG3 LYS 9 11.776 -5.403 -9.110 77 1HD LYS 9 HD2 LYS 9 13.386 -3.665 -7.826 78 2HD LYS 9 HD3 LYS 9 11.834 -3.161 -7.154 79 1HE LYS 9 HE2 LYS 9 13.034 -4.993 -5.859 80 2HE LYS 9 HE3 LYS 9 11.375 -5.363 -6.329 81 1HZ LYS 9 HZ1 LYS 9 13.375 -6.076 -8.287 82 2HZ LYS 9 HZ2 LYS 9 13.482 -6.943 -6.830 83 3HZ LYS 9 HZ3 LYS 9 12.040 -6.962 -7.722 84 H GLU 10 H GLU 10 10.261 -0.739 -10.875 85 HA GLU 10 HA GLU 10 12.444 0.508 -12.496 86 1HB GLU 10 HB2 GLU 10 9.452 0.819 -12.758 87 2HB GLU 10 HB3 GLU 10 10.550 2.089 -13.302 88 1HG GLU 10 HG2 GLU 10 10.516 -0.795 -14.237 89 2HG GLU 10 HG3 GLU 10 10.066 0.625 -15.183 90 HA PRO 11 HA PRO 11 12.616 3.388 -9.169 91 1HB PRO 11 HB2 PRO 11 13.747 5.503 -10.476 92 2HB PRO 11 HB3 PRO 11 14.638 4.027 -10.070 93 1HG PRO 11 HG2 PRO 11 13.567 4.918 -12.708 94 2HG PRO 11 HG3 PRO 11 14.998 3.938 -12.346 95 1HD PRO 11 HD2 PRO 11 12.532 2.940 -13.244 96 2HD PRO 11 HD3 PRO 11 13.818 1.978 -12.482 97 H ALA 12 H ALA 12 11.880 5.622 -8.543 98 HA ALA 12 HA ALA 12 9.866 6.875 -10.297 99 1HB ALA 12 HB1 ALA 12 8.656 5.067 -9.031 100 2HB ALA 12 HB2 ALA 12 9.109 5.881 -7.533 101 3HB ALA 12 HB3 ALA 12 8.053 6.690 -8.693 102 H THR 13 H THR 13 8.913 8.865 -9.022 103 HA THR 13 HA THR 13 11.122 10.006 -7.350 104 HB THR 13 HB THR 13 9.302 11.642 -9.118 105 HG1 THR 13 HG1 THR 13 11.765 10.381 -9.708 106 1HG2 THR 13 HG21 THR 13 10.700 12.636 -7.211 107 2HG2 THR 13 HG22 THR 13 12.112 12.217 -8.180 108 3HG2 THR 13 HG23 THR 13 10.917 13.353 -8.807 109 H LEU 14 H LEU 14 10.391 10.182 -5.287 110 HA LEU 14 HA LEU 14 7.646 10.148 -4.514 111 1HB LEU 14 HB2 LEU 14 9.734 9.716 -3.063 112 2HB LEU 14 HB3 LEU 14 9.840 11.468 -2.908 113 HG LEU 14 HG LEU 14 8.567 10.357 -1.042 114 1HD1 LEU 14 HD11 LEU 14 8.079 12.726 -2.339 115 2HD1 LEU 14 HD12 LEU 14 6.488 11.966 -2.379 116 3HD1 LEU 14 HD13 LEU 14 7.300 12.232 -0.837 117 1HD2 LEU 14 HD21 LEU 14 7.494 8.780 -2.930 118 2HD2 LEU 14 HD22 LEU 14 6.648 9.135 -1.425 119 3HD2 LEU 14 HD23 LEU 14 6.247 10.027 -2.893 120 H ILE 15 H ILE 15 6.153 11.801 -4.311 121 HA ILE 15 HA ILE 15 7.152 14.572 -4.835 122 HB ILE 15 HB ILE 15 4.533 13.361 -5.769 123 1HG1 ILE 15 HG12 ILE 15 6.907 14.234 -7.434 124 2HG1 ILE 15 HG13 ILE 15 6.678 12.566 -6.907 125 1HG2 ILE 15 HG21 ILE 15 5.190 16.022 -5.281 126 2HG2 ILE 15 HG22 ILE 15 5.470 15.835 -7.012 127 3HG2 ILE 15 HG23 ILE 15 3.889 15.454 -6.328 128 1HD1 ILE 15 HD11 ILE 15 4.627 14.150 -8.481 129 2HD1 ILE 15 HD12 ILE 15 5.766 13.011 -9.200 130 3HD1 ILE 15 HD13 ILE 15 4.545 12.440 -8.063 131 H LYS 16 H LYS 16 3.994 13.171 -3.893 132 HA LYS 16 HA LYS 16 4.199 14.600 -1.299 133 1HB LYS 16 HB2 LYS 16 2.970 15.883 -3.330 134 2HB LYS 16 HB3 LYS 16 1.617 14.917 -2.744 135 1HG LYS 16 HG2 LYS 16 1.905 15.801 -0.490 136 2HG LYS 16 HG3 LYS 16 3.343 16.690 -0.993 137 1HD LYS 16 HD2 LYS 16 2.065 18.412 -1.669 138 2HD LYS 16 HD3 LYS 16 1.203 17.348 -2.782 139 1HE LYS 16 HE2 LYS 16 -0.095 16.565 -0.664 140 2HE LYS 16 HE3 LYS 16 0.512 18.053 0.064 141 1HZ LYS 16 HZ1 LYS 16 -0.381 19.162 -2.039 142 2HZ LYS 16 HZ2 LYS 16 -1.272 17.734 -2.268 143 3HZ LYS 16 HZ3 LYS 16 -1.507 18.663 -0.869 144 H ALA 17 H ALA 17 3.845 12.935 0.102 145 HA ALA 17 HA ALA 17 2.259 10.611 -0.594 146 1HB ALA 17 HB1 ALA 17 4.194 10.970 1.213 147 2HB ALA 17 HB2 ALA 17 2.814 11.291 2.264 148 3HB ALA 17 HB3 ALA 17 2.948 9.741 1.433 149 H ILE 18 H ILE 18 0.136 10.149 -0.021 150 HA ILE 18 HA ILE 18 -1.434 12.448 1.052 151 HB ILE 18 HB ILE 18 -2.335 10.016 -0.523 152 1HG1 ILE 18 HG12 ILE 18 -2.355 12.890 -1.440 153 2HG1 ILE 18 HG13 ILE 18 -0.919 11.885 -1.647 154 1HG2 ILE 18 HG21 ILE 18 -3.763 11.946 1.087 155 2HG2 ILE 18 HG22 ILE 18 -4.235 12.101 -0.607 156 3HG2 ILE 18 HG23 ILE 18 -4.394 10.547 0.215 157 1HD1 ILE 18 HD11 ILE 18 -3.544 10.747 -2.506 158 2HD1 ILE 18 HD12 ILE 18 -2.816 11.992 -3.521 159 3HD1 ILE 18 HD13 ILE 18 -1.937 10.500 -3.187 160 H ASP 19 H ASP 19 -1.651 8.867 1.127 161 HA ASP 19 HA ASP 19 -2.261 9.099 4.042 162 1HB ASP 19 HB2 ASP 19 -4.008 7.466 3.854 163 2HB ASP 19 HB3 ASP 19 -4.306 8.659 2.588 164 H GLY 20 H GLY 20 -2.617 6.060 3.932 165 1HA GLY 20 HA2 GLY 20 0.239 5.459 4.314 166 2HA GLY 20 HA3 GLY 20 -1.106 4.388 4.703 167 H ASP 21 H ASP 21 -2.440 4.169 2.304 168 HA ASP 21 HA ASP 21 -0.374 2.827 0.620 169 1HB ASP 21 HB2 ASP 21 -3.374 2.401 0.758 170 2HB ASP 21 HB3 ASP 21 -2.262 1.496 -0.270 171 H THR 22 H THR 22 -0.840 5.681 0.429 172 HA THR 22 HA THR 22 -1.505 5.786 -2.447 173 HB THR 22 HB THR 22 -2.782 7.852 -0.682 174 HG1 THR 22 HG1 THR 22 -3.912 5.344 -1.372 175 1HG2 THR 22 HG21 THR 22 -2.659 8.053 -3.183 176 2HG2 THR 22 HG22 THR 22 -3.640 6.592 -3.297 177 3HG2 THR 22 HG23 THR 22 -4.306 8.044 -2.550 178 H VAL 23 H VAL 23 0.370 6.683 -3.186 179 HA VAL 23 HA VAL 23 1.281 9.211 -1.898 180 HB VAL 23 HB VAL 23 3.624 8.477 -2.062 181 1HG1 VAL 23 HG11 VAL 23 2.368 8.027 0.023 182 2HG1 VAL 23 HG12 VAL 23 1.868 6.464 -0.621 183 3HG1 VAL 23 HG13 VAL 23 3.570 6.773 -0.282 184 1HG2 VAL 23 HG21 VAL 23 2.405 6.408 -3.682 185 2HG2 VAL 23 HG22 VAL 23 4.111 6.821 -3.515 186 3HG2 VAL 23 HG23 VAL 23 3.366 5.685 -2.391 187 H LYS 24 H LYS 24 1.766 10.769 -3.400 188 HA LYS 24 HA LYS 24 1.443 10.074 -6.242 189 1HB LYS 24 HB2 LYS 24 2.176 12.799 -5.173 190 2HB LYS 24 HB3 LYS 24 1.280 12.398 -6.638 191 1HG LYS 24 HG2 LYS 24 -0.618 11.625 -5.328 192 2HG LYS 24 HG3 LYS 24 0.282 11.856 -3.828 193 1HD LYS 24 HD2 LYS 24 -0.761 13.886 -3.817 194 2HD LYS 24 HD3 LYS 24 0.530 14.328 -4.934 195 1HE LYS 24 HE2 LYS 24 -1.049 14.784 -6.472 196 2HE LYS 24 HE3 LYS 24 -1.426 13.062 -6.515 197 1HZ LYS 24 HZ1 LYS 24 -2.567 14.320 -4.233 198 2HZ LYS 24 HZ2 LYS 24 -3.075 15.084 -5.660 199 3HZ LYS 24 HZ3 LYS 24 -3.325 13.416 -5.456 200 H LEU 25 H LEU 25 3.184 9.439 -7.415 201 HA LEU 25 HA LEU 25 5.842 10.612 -6.699 202 1HB LEU 25 HB2 LEU 25 5.668 7.923 -8.008 203 2HB LEU 25 HB3 LEU 25 6.902 8.561 -6.924 204 HG LEU 25 HG LEU 25 4.475 8.515 -5.448 205 1HD1 LEU 25 HD11 LEU 25 4.569 6.446 -7.464 206 2HD1 LEU 25 HD12 LEU 25 4.682 5.728 -5.856 207 3HD1 LEU 25 HD13 LEU 25 3.316 6.766 -6.264 208 1HD2 LEU 25 HD21 LEU 25 7.195 7.488 -5.351 209 2HD2 LEU 25 HD22 LEU 25 6.143 7.983 -4.025 210 3HD2 LEU 25 HD23 LEU 25 6.051 6.339 -4.657 211 H MET 26 H MET 26 7.339 9.845 -8.814 212 HA MET 26 HA MET 26 5.818 10.859 -11.182 213 1HB MET 26 HB2 MET 26 7.680 12.341 -10.028 214 2HB MET 26 HB3 MET 26 8.776 11.283 -10.918 215 1HG MET 26 HG2 MET 26 7.454 11.802 -13.003 216 2HG MET 26 HG3 MET 26 6.568 13.009 -12.070 217 1HE MET 26 HE1 MET 26 7.899 14.658 -10.462 218 2HE MET 26 HE2 MET 26 8.862 15.820 -11.373 219 3HE MET 26 HE3 MET 26 7.250 15.388 -11.936 220 H TYR 27 H TYR 27 5.622 9.237 -12.624 221 HA TYR 27 HA TYR 27 7.865 7.277 -12.872 222 1HB TYR 27 HB2 TYR 27 5.780 6.231 -12.113 223 2HB TYR 27 HB3 TYR 27 4.909 6.942 -13.472 224 HD1 TYR 27 HD1 TYR 27 8.039 4.941 -12.891 225 HD2 TYR 27 HD2 TYR 27 4.538 5.561 -15.302 226 HE1 TYR 27 HE1 TYR 27 8.672 3.007 -14.308 227 HE2 TYR 27 HE2 TYR 27 5.172 3.627 -16.720 228 HH TYR 27 HH TYR 27 8.186 1.819 -16.119 229 H LYS 28 H LYS 28 8.971 7.441 -14.750 230 HA LYS 28 HA LYS 28 9.473 7.884 -16.988 231 1HB LYS 28 HB2 LYS 28 6.458 7.730 -17.190 232 2HB LYS 28 HB3 LYS 28 7.503 7.977 -18.586 233 1HG LYS 28 HG2 LYS 28 8.751 5.865 -17.417 234 2HG LYS 28 HG3 LYS 28 7.079 5.543 -16.954 235 1HD LYS 28 HD2 LYS 28 6.538 6.040 -19.454 236 2HD LYS 28 HD3 LYS 28 8.259 5.755 -19.715 237 1HE LYS 28 HE2 LYS 28 7.136 3.704 -18.002 238 2HE LYS 28 HE3 LYS 28 6.240 3.806 -19.518 239 1HZ LYS 28 HZ1 LYS 28 8.476 3.805 -20.640 240 2HZ LYS 28 HZ2 LYS 28 9.145 3.362 -19.146 241 3HZ LYS 28 HZ3 LYS 28 8.018 2.343 -19.906 242 H GLY 29 H GLY 29 8.266 10.056 -14.902 243 1HA GLY 29 HA2 GLY 29 8.879 12.409 -15.143 244 2HA GLY 29 HA3 GLY 29 8.599 12.264 -16.876 245 H GLN 30 H GLN 30 6.129 10.649 -15.295 246 HA GLN 30 HA GLN 30 4.412 13.092 -15.389 247 1HB GLN 30 HB2 GLN 30 2.611 11.134 -15.741 248 2HB GLN 30 HB3 GLN 30 3.463 11.872 -17.094 249 1HG GLN 30 HG2 GLN 30 5.188 10.073 -16.934 250 2HG GLN 30 HG3 GLN 30 4.230 9.311 -15.662 251 1HE2 GLN 30 HE21 GLN 30 3.578 7.426 -16.836 252 2HE2 GLN 30 HE22 GLN 30 2.602 7.496 -18.223 253 HA PRO 31 HA PRO 31 3.726 12.128 -11.090 254 1HB PRO 31 HB2 PRO 31 1.798 14.020 -10.667 255 2HB PRO 31 HB3 PRO 31 3.522 14.412 -10.798 256 1HG PRO 31 HG2 PRO 31 1.350 14.744 -12.833 257 2HG PRO 31 HG3 PRO 31 2.753 15.777 -12.508 258 1HD PRO 31 HD2 PRO 31 2.616 13.971 -14.604 259 2HD PRO 31 HD3 PRO 31 4.136 14.547 -13.883 260 H MET 32 H MET 32 2.379 10.601 -10.179 261 HA MET 32 HA MET 32 -0.448 10.445 -11.023 262 1HB MET 32 HB2 MET 32 1.623 8.329 -11.569 263 2HB MET 32 HB3 MET 32 -0.056 7.869 -11.284 264 1HG MET 32 HG2 MET 32 -0.797 9.311 -13.113 265 2HG MET 32 HG3 MET 32 0.854 9.880 -13.363 266 1HE MET 32 HE1 MET 32 -1.366 6.736 -13.047 267 2HE MET 32 HE2 MET 32 -0.360 5.460 -13.728 268 3HE MET 32 HE3 MET 32 0.128 6.253 -12.231 269 H THR 33 H THR 33 -1.744 9.257 -9.504 270 HA THR 33 HA THR 33 -0.498 9.075 -6.826 271 HB THR 33 HB THR 33 -3.380 8.430 -7.276 272 HG1 THR 33 HG1 THR 33 -3.839 10.328 -8.027 273 1HG2 THR 33 HG21 THR 33 -1.946 8.695 -5.054 274 2HG2 THR 33 HG22 THR 33 -2.307 10.403 -5.303 275 3HG2 THR 33 HG23 THR 33 -3.621 9.239 -5.125 276 H PHE 34 H PHE 34 0.463 7.132 -6.405 277 HA PHE 34 HA PHE 34 -0.605 4.681 -7.662 278 1HB PHE 34 HB2 PHE 34 1.895 5.367 -6.136 279 2HB PHE 34 HB3 PHE 34 1.421 3.681 -6.350 280 HD1 PHE 34 HD1 PHE 34 1.330 2.664 -8.584 281 HD2 PHE 34 HD2 PHE 34 2.566 6.741 -8.033 282 HE1 PHE 34 HE1 PHE 34 2.228 2.706 -10.897 283 HE2 PHE 34 HE2 PHE 34 3.462 6.784 -10.345 284 HZ PHE 34 HZ PHE 34 3.292 4.765 -11.777 285 H ARG 35 H ARG 35 -1.504 2.973 -6.505 286 HA ARG 35 HA ARG 35 -2.007 3.480 -3.599 287 1HB ARG 35 HB2 ARG 35 -3.876 3.043 -5.799 288 2HB ARG 35 HB3 ARG 35 -4.097 1.867 -4.504 289 1HG ARG 35 HG2 ARG 35 -3.679 4.631 -3.568 290 2HG ARG 35 HG3 ARG 35 -5.161 4.395 -4.496 291 1HD ARG 35 HD2 ARG 35 -5.762 2.490 -3.028 292 2HD ARG 35 HD3 ARG 35 -4.300 2.773 -2.083 293 HE ARG 35 HE ARG 35 -5.701 5.216 -2.127 294 1HH1 ARG 35 HH11 ARG 35 -5.214 2.524 -0.231 295 2HH1 ARG 35 HH12 ARG 35 -6.659 2.691 0.709 296 1HH2 ARG 35 HH21 ARG 35 -7.983 5.201 -1.282 297 2HH2 ARG 35 HH22 ARG 35 -8.227 4.206 0.114 298 H LEU 36 H LEU 36 -1.110 1.891 -2.377 299 HA LEU 36 HA LEU 36 0.274 -0.336 -3.275 300 1HB LEU 36 HB2 LEU 36 -1.344 -0.073 -0.724 301 2HB LEU 36 HB3 LEU 36 -0.156 -1.342 -1.022 302 HG LEU 36 HG LEU 36 0.322 1.636 -0.807 303 1HD1 LEU 36 HD11 LEU 36 0.300 -0.048 1.192 304 2HD1 LEU 36 HD12 LEU 36 1.847 -0.583 0.538 305 3HD1 LEU 36 HD13 LEU 36 1.640 1.091 1.054 306 1HD2 LEU 36 HD21 LEU 36 1.927 -0.509 -2.156 307 2HD2 LEU 36 HD22 LEU 36 1.724 1.184 -2.607 308 3HD2 LEU 36 HD23 LEU 36 2.784 0.750 -1.266 309 H LEU 37 H LEU 37 -0.259 -2.337 -4.059 310 HA LEU 37 HA LEU 37 -3.117 -2.858 -4.597 311 1HB LEU 37 HB2 LEU 37 -0.518 -3.798 -5.679 312 2HB LEU 37 HB3 LEU 37 -1.838 -4.968 -5.702 313 HG LEU 37 HG LEU 37 -2.197 -2.147 -6.718 314 1HD1 LEU 37 HD11 LEU 37 -0.351 -3.194 -7.981 315 2HD1 LEU 37 HD12 LEU 37 -1.364 -4.604 -8.293 316 3HD1 LEU 37 HD13 LEU 37 -1.792 -3.038 -8.984 317 1HD2 LEU 37 HD21 LEU 37 -3.742 -4.688 -6.666 318 2HD2 LEU 37 HD22 LEU 37 -4.317 -3.022 -6.609 319 3HD2 LEU 37 HD23 LEU 37 -3.849 -3.741 -8.149 320 H LEU 38 H LEU 38 -4.168 -4.805 -3.967 321 HA LEU 38 HA LEU 38 -4.657 -6.620 -2.569 322 1HB LEU 38 HB2 LEU 38 -1.651 -6.730 -2.199 323 2HB LEU 38 HB3 LEU 38 -2.793 -8.007 -1.787 324 HG LEU 38 HG LEU 38 -2.238 -6.914 -4.560 325 1HD1 LEU 38 HD11 LEU 38 -1.699 -9.578 -3.216 326 2HD1 LEU 38 HD12 LEU 38 -1.530 -9.299 -4.949 327 3HD1 LEU 38 HD13 LEU 38 -0.500 -8.429 -3.811 328 1HD2 LEU 38 HD21 LEU 38 -4.529 -8.328 -3.430 329 2HD2 LEU 38 HD22 LEU 38 -4.346 -7.595 -5.024 330 3HD2 LEU 38 HD23 LEU 38 -3.776 -9.240 -4.739 331 H VAL 39 H VAL 39 -3.915 -3.718 -1.512 332 HA VAL 39 HA VAL 39 -4.240 -4.534 1.324 333 HB VAL 39 HB VAL 39 -2.483 -3.122 2.127 334 1HG1 VAL 39 HG11 VAL 39 -1.979 -5.380 0.764 335 2HG1 VAL 39 HG12 VAL 39 -1.066 -4.252 -0.239 336 3HG1 VAL 39 HG13 VAL 39 -0.692 -4.409 1.478 337 1HG2 VAL 39 HG21 VAL 39 -2.913 -1.327 0.375 338 2HG2 VAL 39 HG22 VAL 39 -1.214 -1.626 0.739 339 3HG2 VAL 39 HG23 VAL 39 -1.929 -2.286 -0.732 340 H ASP 40 H ASP 40 -5.002 -2.720 2.682 341 HA ASP 40 HA ASP 40 -6.041 -0.360 1.238 342 1HB ASP 40 HB2 ASP 40 -7.813 -2.097 1.022 343 2HB ASP 40 HB3 ASP 40 -7.862 -2.234 2.780 344 H THR 41 H THR 41 -6.103 1.417 2.590 345 HA THR 41 HA THR 41 -4.876 1.202 5.196 346 HB THR 41 HB THR 41 -4.997 3.548 5.266 347 HG1 THR 41 HG1 THR 41 -6.616 4.610 3.872 348 1HG2 THR 41 HG21 THR 41 -3.855 2.575 3.185 349 2HG2 THR 41 HG22 THR 41 -5.294 3.078 2.298 350 3HG2 THR 41 HG23 THR 41 -4.298 4.281 3.117 351 HA PRO 42 HA PRO 42 -8.391 0.591 7.776 352 1HB PRO 42 HB2 PRO 42 -7.655 2.040 9.978 353 2HB PRO 42 HB3 PRO 42 -6.900 0.498 9.536 354 1HG PRO 42 HG2 PRO 42 -5.859 3.280 9.175 355 2HG PRO 42 HG3 PRO 42 -4.979 1.787 9.544 356 1HD PRO 42 HD2 PRO 42 -5.100 2.945 7.024 357 2HD PRO 42 HD3 PRO 42 -4.749 1.228 7.323 358 H GLU 43 H GLU 43 -7.588 3.875 8.857 359 HA GLU 43 HA GLU 43 -10.024 4.921 7.515 360 1HB GLU 43 HB2 GLU 43 -10.282 4.119 10.055 361 2HB GLU 43 HB3 GLU 43 -9.588 5.711 10.363 362 1HG GLU 43 HG2 GLU 43 -11.410 6.427 8.534 363 2HG GLU 43 HG3 GLU 43 -12.221 4.993 9.164 364 H THR 44 H THR 44 -9.947 7.209 7.187 365 HA THR 44 HA THR 44 -8.048 8.991 8.287 366 HB THR 44 HB THR 44 -6.743 8.952 5.863 367 HG1 THR 44 HG1 THR 44 -7.906 6.850 5.626 368 1HG2 THR 44 HG21 THR 44 -6.199 8.311 8.636 369 2HG2 THR 44 HG22 THR 44 -5.241 7.291 7.563 370 3HG2 THR 44 HG23 THR 44 -5.137 9.047 7.436 371 H LYS 45 H LYS 45 -10.769 8.983 7.344 372 HA LYS 45 HA LYS 45 -10.627 10.844 5.013 373 1HB LYS 45 HB2 LYS 45 -12.919 9.241 6.182 374 2HB LYS 45 HB3 LYS 45 -13.119 10.437 4.901 375 1HG LYS 45 HG2 LYS 45 -11.888 9.176 3.352 376 2HG LYS 45 HG3 LYS 45 -11.078 8.245 4.613 377 1HD LYS 45 HD2 LYS 45 -12.664 6.730 3.746 378 2HD LYS 45 HD3 LYS 45 -13.446 7.364 5.195 379 1HE LYS 45 HE2 LYS 45 -15.163 8.077 3.932 380 2HE LYS 45 HE3 LYS 45 -14.060 9.148 3.068 381 1HZ LYS 45 HZ1 LYS 45 -14.298 6.277 2.399 382 2HZ LYS 45 HZ2 LYS 45 -15.313 7.443 1.702 383 3HZ LYS 45 HZ3 LYS 45 -13.634 7.528 1.460 384 H HIS 46 H HIS 46 -10.959 10.794 8.377 385 HA HIS 46 HA HIS 46 -11.798 12.356 9.931 386 1HB HIS 46 HB2 HIS 46 -9.784 13.470 8.943 387 2HB HIS 46 HB3 HIS 46 -10.842 14.264 7.778 388 HD1 HIS 46 HD1 HIS 46 -9.193 15.138 10.695 389 HD2 HIS 46 HD2 HIS 46 -13.200 15.443 9.585 390 HE1 HIS 46 HE1 HIS 46 -10.220 16.904 12.193 391 HA PRO 47 HA PRO 47 -15.794 13.101 7.821 392 1HB PRO 47 HB2 PRO 47 -17.289 11.980 9.811 393 2HB PRO 47 HB3 PRO 47 -16.540 11.029 8.518 394 1HG PRO 47 HG2 PRO 47 -15.726 11.299 11.370 395 2HG PRO 47 HG3 PRO 47 -15.512 9.935 10.262 396 1HD PRO 47 HD2 PRO 47 -13.527 11.806 10.972 397 2HD PRO 47 HD3 PRO 47 -13.446 10.669 9.611 398 H LYS 48 H LYS 48 -16.363 13.056 11.304 399 HA LYS 48 HA LYS 48 -16.587 16.039 11.252 400 1HB LYS 48 HB2 LYS 48 -18.837 15.200 11.295 401 2HB LYS 48 HB3 LYS 48 -18.433 14.002 12.526 402 1HG LYS 48 HG2 LYS 48 -17.883 15.874 14.096 403 2HG LYS 48 HG3 LYS 48 -18.451 17.014 12.874 404 1HD LYS 48 HD2 LYS 48 -20.374 14.869 13.350 405 2HD LYS 48 HD3 LYS 48 -20.025 15.788 14.815 406 1HE LYS 48 HE2 LYS 48 -21.696 17.110 13.912 407 2HE LYS 48 HE3 LYS 48 -20.284 17.856 13.165 408 1HZ LYS 48 HZ1 LYS 48 -21.673 15.607 11.855 409 2HZ LYS 48 HZ2 LYS 48 -22.247 17.196 11.682 410 3HZ LYS 48 HZ3 LYS 48 -20.683 16.800 11.160 411 H LYS 49 H LYS 49 -16.197 13.177 13.357 412 HA LYS 49 HA LYS 49 -14.873 14.913 15.376 413 1HB LYS 49 HB2 LYS 49 -15.097 13.035 16.895 414 2HB LYS 49 HB3 LYS 49 -16.647 13.276 16.089 415 1HG LYS 49 HG2 LYS 49 -15.997 11.520 14.426 416 2HG LYS 49 HG3 LYS 49 -14.542 11.217 15.377 417 1HD LYS 49 HD2 LYS 49 -16.006 9.616 16.242 418 2HD LYS 49 HD3 LYS 49 -16.234 10.955 17.369 419 1HE LYS 49 HE2 LYS 49 -18.439 10.758 16.881 420 2HE LYS 49 HE3 LYS 49 -18.029 11.561 15.365 421 1HZ LYS 49 HZ1 LYS 49 -18.028 8.625 15.811 422 2HZ LYS 49 HZ2 LYS 49 -19.238 9.495 14.996 423 3HZ LYS 49 HZ3 LYS 49 -17.669 9.408 14.351 424 H GLY 50 H GLY 50 -13.809 13.730 12.671 425 1HA GLY 50 HA2 GLY 50 -11.745 12.928 11.891 426 2HA GLY 50 HA3 GLY 50 -11.082 13.548 13.404 427 H VAL 51 H VAL 51 -9.674 11.599 13.298 428 HA VAL 51 HA VAL 51 -11.100 9.083 14.035 429 HB VAL 51 HB VAL 51 -8.154 9.218 13.465 430 1HG1 VAL 51 HG11 VAL 51 -10.334 7.216 13.559 431 2HG1 VAL 51 HG12 VAL 51 -9.186 7.013 12.236 432 3HG1 VAL 51 HG13 VAL 51 -8.614 7.026 13.904 433 1HG2 VAL 51 HG21 VAL 51 -10.415 9.564 11.514 434 2HG2 VAL 51 HG22 VAL 51 -8.841 10.358 11.543 435 3HG2 VAL 51 HG23 VAL 51 -8.971 8.679 11.020 436 H GLU 52 H GLU 52 -10.501 7.979 15.960 437 HA GLU 52 HA GLU 52 -8.878 9.623 17.864 438 1HB GLU 52 HB2 GLU 52 -11.290 7.856 18.353 439 2HB GLU 52 HB3 GLU 52 -10.266 8.473 19.651 440 1HG GLU 52 HG2 GLU 52 -10.951 10.663 19.339 441 2HG GLU 52 HG3 GLU 52 -11.314 10.416 17.630 442 H LYS 53 H LYS 53 -9.299 6.553 16.338 443 HA LYS 53 HA LYS 53 -7.038 5.493 17.982 444 1HB LYS 53 HB2 LYS 53 -8.098 3.205 17.622 445 2HB LYS 53 HB3 LYS 53 -8.969 4.274 18.722 446 1HG LYS 53 HG2 LYS 53 -9.647 4.300 15.797 447 2HG LYS 53 HG3 LYS 53 -10.287 3.017 16.826 448 1HD LYS 53 HD2 LYS 53 -10.521 5.737 17.954 449 2HD LYS 53 HD3 LYS 53 -11.482 5.454 16.502 450 1HE LYS 53 HE2 LYS 53 -11.501 3.403 18.693 451 2HE LYS 53 HE3 LYS 53 -12.481 4.859 18.865 452 1HZ LYS 53 HZ1 LYS 53 -12.891 3.978 16.288 453 2HZ LYS 53 HZ2 LYS 53 -12.938 2.576 17.247 454 3HZ LYS 53 HZ3 LYS 53 -13.978 3.876 17.585 455 H TYR 54 H TYR 54 -5.330 4.913 16.731 456 HA TYR 54 HA TYR 54 -4.089 4.271 14.847 457 1HB TYR 54 HB2 TYR 54 -6.745 3.437 13.654 458 2HB TYR 54 HB3 TYR 54 -5.140 2.850 13.213 459 HD1 TYR 54 HD1 TYR 54 -3.784 2.264 15.647 460 HD2 TYR 54 HD2 TYR 54 -7.955 1.767 14.744 461 HE1 TYR 54 HE1 TYR 54 -3.951 0.504 17.385 462 HE2 TYR 54 HE2 TYR 54 -8.121 0.006 16.483 463 HH TYR 54 HH TYR 54 -5.247 -1.107 18.249 464 H GLY 55 H GLY 55 -6.040 6.817 15.022 465 1HA GLY 55 HA2 GLY 55 -6.651 7.703 12.434 466 2HA GLY 55 HA3 GLY 55 -6.155 8.785 13.737 467 HA PRO 56 HA PRO 56 -2.378 9.483 11.566 468 1HB PRO 56 HB2 PRO 56 -0.889 10.437 13.647 469 2HB PRO 56 HB3 PRO 56 -2.213 11.357 12.911 470 1HG PRO 56 HG2 PRO 56 -2.136 9.935 15.522 471 2HG PRO 56 HG3 PRO 56 -3.084 11.350 15.039 472 1HD PRO 56 HD2 PRO 56 -4.034 8.690 15.217 473 2HD PRO 56 HD3 PRO 56 -4.871 10.054 14.445 474 H GLU 57 H GLU 57 -2.469 6.813 11.795 475 HA GLU 57 HA GLU 57 0.072 6.046 13.179 476 1HB GLU 57 HB2 GLU 57 -2.592 4.784 13.080 477 2HB GLU 57 HB3 GLU 57 -1.253 3.676 12.774 478 1HG GLU 57 HG2 GLU 57 -1.016 5.601 15.055 479 2HG GLU 57 HG3 GLU 57 -2.044 4.182 15.255 480 H ALA 58 H ALA 58 -2.004 4.655 10.607 481 HA ALA 58 HA ALA 58 0.282 3.620 9.172 482 1HB ALA 58 HB1 ALA 58 -2.485 3.239 9.086 483 2HB ALA 58 HB2 ALA 58 -2.103 3.986 7.535 484 3HB ALA 58 HB3 ALA 58 -1.298 2.493 8.017 485 H SER 59 H SER 59 -2.022 6.254 8.386 486 HA SER 59 HA SER 59 -0.879 7.250 6.073 487 1HB SER 59 HB2 SER 59 -2.847 8.309 6.967 488 2HB SER 59 HB3 SER 59 -1.999 8.772 8.440 489 HG SER 59 HG SER 59 -1.649 9.736 5.802 490 H ALA 60 H ALA 60 0.037 8.387 9.350 491 HA ALA 60 HA ALA 60 2.311 9.867 8.485 492 1HB ALA 60 HB1 ALA 60 1.156 9.923 10.778 493 2HB ALA 60 HB2 ALA 60 2.099 8.482 11.164 494 3HB ALA 60 HB3 ALA 60 2.917 9.997 10.785 495 H PHE 61 H PHE 61 1.926 6.476 9.402 496 HA PHE 61 HA PHE 61 4.623 5.706 9.593 497 1HB PHE 61 HB2 PHE 61 2.771 4.166 10.078 498 2HB PHE 61 HB3 PHE 61 2.321 4.154 8.371 499 HD1 PHE 61 HD1 PHE 61 5.253 3.509 10.616 500 HD2 PHE 61 HD2 PHE 61 3.241 2.545 6.946 501 HE1 PHE 61 HE1 PHE 61 6.897 1.700 10.191 502 HE2 PHE 61 HE2 PHE 61 4.884 0.736 6.520 503 HZ PHE 61 HZ PHE 61 6.712 0.315 8.142 504 H THR 62 H THR 62 2.709 5.027 6.669 505 HA THR 62 HA THR 62 4.948 4.730 4.957 506 HB THR 62 HB THR 62 2.203 5.731 4.145 507 HG1 THR 62 HG1 THR 62 3.019 3.045 4.162 508 1HG2 THR 62 HG21 THR 62 4.584 4.625 2.738 509 2HG2 THR 62 HG22 THR 62 2.998 4.107 2.167 510 3HG2 THR 62 HG23 THR 62 3.410 5.822 2.191 511 H LYS 63 H LYS 63 3.514 7.579 6.271 512 HA LYS 63 HA LYS 63 4.222 9.470 4.253 513 1HB LYS 63 HB2 LYS 63 2.846 9.700 6.522 514 2HB LYS 63 HB3 LYS 63 4.413 10.230 7.137 515 1HG LYS 63 HG2 LYS 63 4.032 12.258 6.242 516 2HG LYS 63 HG3 LYS 63 4.063 11.517 4.641 517 1HD LYS 63 HD2 LYS 63 1.886 12.059 4.438 518 2HD LYS 63 HD3 LYS 63 1.541 10.869 5.694 519 1HE LYS 63 HE2 LYS 63 2.441 13.647 6.429 520 2HE LYS 63 HE3 LYS 63 0.746 13.319 6.069 521 1HZ LYS 63 HZ1 LYS 63 0.836 11.524 7.741 522 2HZ LYS 63 HZ2 LYS 63 2.412 12.013 8.149 523 3HZ LYS 63 HZ3 LYS 63 1.100 13.064 8.402 524 H LYS 64 H LYS 64 5.923 8.931 7.344 525 HA LYS 64 HA LYS 64 8.324 10.242 6.495 526 1HB LYS 64 HB2 LYS 64 7.365 8.886 8.841 527 2HB LYS 64 HB3 LYS 64 8.978 8.287 8.450 528 1HG LYS 64 HG2 LYS 64 9.762 10.145 9.460 529 2HG LYS 64 HG3 LYS 64 9.199 11.023 8.038 530 1HD LYS 64 HD2 LYS 64 8.012 12.190 9.619 531 2HD LYS 64 HD3 LYS 64 6.872 10.863 9.387 532 1HE LYS 64 HE2 LYS 64 7.800 9.670 11.294 533 2HE LYS 64 HE3 LYS 64 9.060 10.889 11.487 534 1HZ LYS 64 HZ1 LYS 64 6.177 11.551 11.597 535 2HZ LYS 64 HZ2 LYS 64 7.059 11.104 12.978 536 3HZ LYS 64 HZ3 LYS 64 7.490 12.498 12.111 537 H MET 65 H MET 65 7.108 7.019 6.044 538 HA MET 65 HA MET 65 9.564 5.666 5.502 539 1HB MET 65 HB2 MET 65 6.894 4.960 5.581 540 2HB MET 65 HB3 MET 65 7.285 4.802 3.869 541 1HG MET 65 HG2 MET 65 9.214 3.687 5.866 542 2HG MET 65 HG3 MET 65 7.722 2.798 5.558 543 1HE MET 65 HE1 MET 65 9.285 1.096 5.219 544 2HE MET 65 HE2 MET 65 9.634 0.528 3.588 545 3HE MET 65 HE3 MET 65 10.848 1.452 4.486 546 H VAL 66 H VAL 66 7.167 6.523 3.011 547 HA VAL 66 HA VAL 66 9.048 6.430 0.869 548 HB VAL 66 HB VAL 66 7.301 7.586 -0.447 549 1HG1 VAL 66 HG11 VAL 66 6.509 5.373 1.444 550 2HG1 VAL 66 HG12 VAL 66 5.388 5.970 0.220 551 3HG1 VAL 66 HG13 VAL 66 6.928 5.261 -0.265 552 1HG2 VAL 66 HG21 VAL 66 6.537 8.481 2.217 553 2HG2 VAL 66 HG22 VAL 66 6.039 9.110 0.646 554 3HG2 VAL 66 HG23 VAL 66 5.171 7.756 1.370 555 H GLU 67 H GLU 67 8.215 8.984 3.112 556 HA GLU 67 HA GLU 67 9.250 11.176 1.564 557 1HB GLU 67 HB2 GLU 67 8.666 10.735 4.480 558 2HB GLU 67 HB3 GLU 67 9.530 12.185 3.967 559 1HG GLU 67 HG2 GLU 67 7.683 12.657 2.347 560 2HG GLU 67 HG3 GLU 67 6.802 11.276 3.004 561 H ASN 68 H ASN 68 10.733 8.901 3.828 562 HA ASN 68 HA ASN 68 13.350 10.266 3.459 563 1HB ASN 68 HB2 ASN 68 12.279 8.256 5.421 564 2HB ASN 68 HB3 ASN 68 14.020 8.403 5.181 565 1HD2 ASN 68 HD21 ASN 68 11.897 9.366 7.367 566 2HD2 ASN 68 HD22 ASN 68 12.423 10.947 7.690 567 H ALA 69 H ALA 69 11.556 7.771 2.091 568 HA ALA 69 HA ALA 69 13.342 5.668 1.654 569 1HB ALA 69 HB1 ALA 69 10.890 6.401 0.622 570 2HB ALA 69 HB2 ALA 69 11.939 6.489 -0.792 571 3HB ALA 69 HB3 ALA 69 11.816 4.986 0.121 572 H LYS 70 H LYS 70 15.404 5.716 0.909 573 HA LYS 70 HA LYS 70 16.513 8.020 -0.435 574 1HB LYS 70 HB2 LYS 70 17.582 5.199 -0.116 575 2HB LYS 70 HB3 LYS 70 18.518 6.559 -0.735 576 1HG LYS 70 HG2 LYS 70 17.168 7.166 1.794 577 2HG LYS 70 HG3 LYS 70 18.318 5.836 1.931 578 1HD LYS 70 HD2 LYS 70 19.120 8.321 0.452 579 2HD LYS 70 HD3 LYS 70 19.155 8.315 2.216 580 1HE LYS 70 HE2 LYS 70 20.365 5.927 1.653 581 2HE LYS 70 HE3 LYS 70 20.903 6.913 0.294 582 1HZ LYS 70 HZ1 LYS 70 21.642 8.600 1.866 583 2HZ LYS 70 HZ2 LYS 70 21.151 7.624 3.166 584 3HZ LYS 70 HZ3 LYS 70 22.414 7.114 2.156 585 H LYS 71 H LYS 71 15.363 4.852 -1.500 586 HA LYS 71 HA LYS 71 15.238 5.918 -4.271 587 1HB LYS 71 HB2 LYS 71 16.240 3.120 -3.740 588 2HB LYS 71 HB3 LYS 71 16.342 4.057 -5.230 589 1HG LYS 71 HG2 LYS 71 18.048 5.448 -4.384 590 2HG LYS 71 HG3 LYS 71 17.700 5.007 -2.713 591 1HD LYS 71 HD2 LYS 71 18.369 2.612 -3.390 592 2HD LYS 71 HD3 LYS 71 19.062 3.350 -4.835 593 1HE LYS 71 HE2 LYS 71 20.050 4.986 -2.876 594 2HE LYS 71 HE3 LYS 71 20.010 3.432 -2.042 595 1HZ LYS 71 HZ1 LYS 71 21.192 3.812 -4.735 596 2HZ LYS 71 HZ2 LYS 71 22.095 3.898 -3.298 597 3HZ LYS 71 HZ3 LYS 71 21.325 2.449 -3.729 598 H ILE 72 H ILE 72 13.190 5.607 -4.976 599 HA ILE 72 HA ILE 72 11.622 3.365 -3.766 600 HB ILE 72 HB ILE 72 10.635 5.936 -5.043 601 1HG1 ILE 72 HG12 ILE 72 10.131 5.320 -2.188 602 2HG1 ILE 72 HG13 ILE 72 11.804 5.699 -2.596 603 1HG2 ILE 72 HG21 ILE 72 9.172 3.706 -3.594 604 2HG2 ILE 72 HG22 ILE 72 8.440 5.214 -4.144 605 3HG2 ILE 72 HG23 ILE 72 9.068 4.059 -5.320 606 1HD1 ILE 72 HD11 ILE 72 10.982 7.761 -3.773 607 2HD1 ILE 72 HD12 ILE 72 9.366 7.408 -3.163 608 3HD1 ILE 72 HD13 ILE 72 10.674 7.771 -2.037 609 H GLU 73 H GLU 73 10.744 1.843 -5.143 610 HA GLU 73 HA GLU 73 10.928 2.401 -8.067 611 1HB GLU 73 HB2 GLU 73 11.656 -0.227 -6.740 612 2HB GLU 73 HB3 GLU 73 11.754 0.141 -8.463 613 1HG GLU 73 HG2 GLU 73 13.852 0.885 -8.128 614 2HG GLU 73 HG3 GLU 73 13.182 2.196 -7.154 615 H VAL 74 H VAL 74 9.019 2.020 -9.075 616 HA VAL 74 HA VAL 74 6.833 0.748 -7.570 617 HB VAL 74 HB VAL 74 5.516 1.368 -9.657 618 1HG1 VAL 74 HG11 VAL 74 6.435 2.929 -7.524 619 2HG1 VAL 74 HG12 VAL 74 6.706 3.931 -8.950 620 3HG1 VAL 74 HG13 VAL 74 5.090 3.316 -8.597 621 1HG2 VAL 74 HG21 VAL 74 8.135 1.662 -10.687 622 2HG2 VAL 74 HG22 VAL 74 6.619 2.033 -11.507 623 3HG2 VAL 74 HG23 VAL 74 7.459 3.288 -10.596 624 H GLU 75 H GLU 75 5.624 -1.072 -8.440 625 HA GLU 75 HA GLU 75 7.085 -2.655 -10.506 626 1HB GLU 75 HB2 GLU 75 7.664 -3.506 -8.237 627 2HB GLU 75 HB3 GLU 75 5.948 -3.775 -7.926 628 1HG GLU 75 HG2 GLU 75 5.795 -5.468 -9.568 629 2HG GLU 75 HG3 GLU 75 7.304 -4.976 -10.337 630 H PHE 76 H PHE 76 5.416 -2.031 -12.002 631 HA PHE 76 HA PHE 76 2.622 -2.282 -11.517 632 1HB PHE 76 HB2 PHE 76 4.232 -2.482 -14.076 633 2HB PHE 76 HB3 PHE 76 2.468 -2.475 -14.039 634 HD1 PHE 76 HD1 PHE 76 1.344 -0.519 -12.708 635 HD2 PHE 76 HD2 PHE 76 5.393 -0.450 -14.142 636 HE1 PHE 76 HE1 PHE 76 1.356 1.956 -12.555 637 HE2 PHE 76 HE2 PHE 76 5.406 2.025 -13.989 638 HZ PHE 76 HZ PHE 76 3.388 3.228 -13.197 639 H ASP 77 H ASP 77 1.280 -4.045 -11.509 640 HA ASP 77 HA ASP 77 2.486 -6.701 -11.523 641 1HB ASP 77 HB2 ASP 77 0.267 -5.600 -10.319 642 2HB ASP 77 HB3 ASP 77 -0.450 -6.550 -11.622 643 H LYS 78 H LYS 78 0.543 -8.268 -12.746 644 HA LYS 78 HA LYS 78 1.148 -7.740 -15.588 645 1HB LYS 78 HB2 LYS 78 0.260 -10.007 -15.956 646 2HB LYS 78 HB3 LYS 78 1.461 -10.017 -14.664 647 1HG LYS 78 HG2 LYS 78 -1.107 -9.449 -13.521 648 2HG LYS 78 HG3 LYS 78 -1.242 -10.890 -14.530 649 1HD LYS 78 HD2 LYS 78 1.171 -10.740 -12.813 650 2HD LYS 78 HD3 LYS 78 -0.362 -10.956 -11.966 651 1HE LYS 78 HE2 LYS 78 -0.818 -12.803 -13.746 652 2HE LYS 78 HE3 LYS 78 0.924 -12.747 -14.017 653 1HZ LYS 78 HZ1 LYS 78 0.581 -12.784 -11.282 654 2HZ LYS 78 HZ2 LYS 78 -0.514 -13.935 -11.883 655 3HZ LYS 78 HZ3 LYS 78 1.134 -14.058 -12.260 656 H GLY 79 H GLY 79 -1.439 -7.290 -13.376 657 1HA GLY 79 HA2 GLY 79 -3.611 -7.478 -15.296 658 2HA GLY 79 HA3 GLY 79 -3.710 -6.742 -13.696 659 H GLN 80 H GLN 80 -4.932 -4.977 -14.705 660 HA GLN 80 HA GLN 80 -3.939 -3.353 -16.817 661 1HB GLN 80 HB2 GLN 80 -5.552 -2.325 -14.472 662 2HB GLN 80 HB3 GLN 80 -5.552 -1.726 -16.131 663 1HG GLN 80 HG2 GLN 80 -7.249 -3.127 -16.601 664 2HG GLN 80 HG3 GLN 80 -6.176 -4.488 -16.272 665 1HE2 GLN 80 HE21 GLN 80 -8.578 -5.218 -15.535 666 2HE2 GLN 80 HE22 GLN 80 -8.891 -5.006 -13.881 667 H ARG 81 H ARG 81 -3.543 -0.817 -16.105 668 HA ARG 81 HA ARG 81 -1.304 -0.905 -14.120 669 1HB ARG 81 HB2 ARG 81 -1.462 0.541 -16.778 670 2HB ARG 81 HB3 ARG 81 -0.223 0.869 -15.566 671 1HG ARG 81 HG2 ARG 81 0.660 -1.339 -15.721 672 2HG ARG 81 HG3 ARG 81 -0.744 -1.916 -16.618 673 1HD ARG 81 HD2 ARG 81 0.892 -1.622 -18.290 674 2HD ARG 81 HD3 ARG 81 -0.074 -0.150 -18.395 675 HE ARG 81 HE ARG 81 2.558 -0.283 -16.974 676 1HH1 ARG 81 HH11 ARG 81 -0.064 1.668 -17.792 677 2HH1 ARG 81 HH12 ARG 81 0.886 2.987 -18.391 678 1HH2 ARG 81 HH21 ARG 81 3.887 1.263 -18.195 679 2HH2 ARG 81 HH22 ARG 81 3.121 2.756 -18.622 680 H THR 82 H THR 82 -4.178 0.677 -15.201 681 HA THR 82 HA THR 82 -3.906 2.594 -12.951 682 HB THR 82 HB THR 82 -4.703 4.456 -14.390 683 HG1 THR 82 HG1 THR 82 -5.631 2.981 -15.969 684 1HG2 THR 82 HG21 THR 82 -2.244 3.956 -13.988 685 2HG2 THR 82 HG22 THR 82 -2.227 3.187 -15.576 686 3HG2 THR 82 HG23 THR 82 -2.594 4.906 -15.433 687 H ASP 83 H ASP 83 -5.962 3.323 -12.155 688 HA ASP 83 HA ASP 83 -8.190 1.514 -12.914 689 1HB ASP 83 HB2 ASP 83 -7.338 2.880 -10.469 690 2HB ASP 83 HB3 ASP 83 -9.060 3.085 -10.793 691 H LYS 84 H LYS 84 -10.377 3.055 -12.210 692 HA LYS 84 HA LYS 84 -10.706 4.704 -14.556 693 1HB LYS 84 HB2 LYS 84 -12.901 5.286 -13.546 694 2HB LYS 84 HB3 LYS 84 -12.613 3.546 -13.532 695 1HG LYS 84 HG2 LYS 84 -11.587 4.018 -11.158 696 2HG LYS 84 HG3 LYS 84 -12.556 5.489 -11.243 697 1HD LYS 84 HD2 LYS 84 -14.459 4.350 -10.844 698 2HD LYS 84 HD3 LYS 84 -14.089 3.177 -12.109 699 1HE LYS 84 HE2 LYS 84 -13.772 1.685 -10.442 700 2HE LYS 84 HE3 LYS 84 -12.275 2.551 -10.099 701 1HZ LYS 84 HZ1 LYS 84 -14.134 4.080 -8.886 702 2HZ LYS 84 HZ2 LYS 84 -14.758 2.522 -8.640 703 3HZ LYS 84 HZ3 LYS 84 -13.189 2.900 -8.109 704 H TYR 85 H TYR 85 -9.458 5.308 -11.405 705 HA TYR 85 HA TYR 85 -9.968 8.213 -11.556 706 1HB TYR 85 HB2 TYR 85 -8.404 6.581 -9.532 707 2HB TYR 85 HB3 TYR 85 -8.808 8.291 -9.380 708 HD1 TYR 85 HD1 TYR 85 -11.354 8.895 -9.603 709 HD2 TYR 85 HD2 TYR 85 -9.869 4.974 -8.669 710 HE1 TYR 85 HE1 TYR 85 -13.556 8.291 -8.637 711 HE2 TYR 85 HE2 TYR 85 -12.073 4.370 -7.702 712 HH TYR 85 HH TYR 85 -14.794 6.672 -7.756 713 H GLY 86 H GLY 86 -7.836 6.202 -13.037 714 1HA GLY 86 HA2 GLY 86 -5.907 6.762 -14.287 715 2HA GLY 86 HA3 GLY 86 -5.983 8.387 -13.602 716 H ARG 87 H ARG 87 -6.228 6.411 -11.002 717 HA ARG 87 HA ARG 87 -3.590 6.992 -10.044 718 1HB ARG 87 HB2 ARG 87 -5.552 4.894 -9.064 719 2HB ARG 87 HB3 ARG 87 -4.173 5.523 -8.160 720 1HG ARG 87 HG2 ARG 87 -5.200 7.838 -8.447 721 2HG ARG 87 HG3 ARG 87 -6.652 7.024 -9.030 722 1HD ARG 87 HD2 ARG 87 -5.453 7.028 -6.284 723 2HD ARG 87 HD3 ARG 87 -7.142 7.184 -6.767 724 HE ARG 87 HE ARG 87 -5.713 4.573 -7.035 725 1HH1 ARG 87 HH11 ARG 87 -7.532 6.172 -4.775 726 2HH1 ARG 87 HH12 ARG 87 -8.833 5.029 -4.724 727 1HH2 ARG 87 HH21 ARG 87 -7.728 3.248 -7.486 728 2HH2 ARG 87 HH22 ARG 87 -8.944 3.374 -6.260 729 H GLY 88 H GLY 88 -1.741 5.697 -9.970 730 1HA GLY 88 HA2 GLY 88 -1.683 3.464 -11.895 731 2HA GLY 88 HA3 GLY 88 -0.281 4.188 -11.109 732 H LEU 89 H LEU 89 -1.849 1.364 -11.261 733 HA LEU 89 HA LEU 89 -1.723 0.780 -8.349 734 1HB LEU 89 HB2 LEU 89 -2.622 -1.074 -10.566 735 2HB LEU 89 HB3 LEU 89 -2.930 -1.233 -8.836 736 HG LEU 89 HG LEU 89 -3.879 1.171 -10.398 737 1HD1 LEU 89 HD11 LEU 89 -4.729 -1.106 -11.289 738 2HD1 LEU 89 HD12 LEU 89 -5.598 -1.226 -9.758 739 3HD1 LEU 89 HD13 LEU 89 -5.939 0.105 -10.864 740 1HD2 LEU 89 HD21 LEU 89 -3.755 1.168 -7.862 741 2HD2 LEU 89 HD22 LEU 89 -5.363 1.461 -8.524 742 3HD2 LEU 89 HD23 LEU 89 -4.952 -0.127 -7.879 743 H ALA 90 H ALA 90 0.155 -0.009 -7.585 744 HA ALA 90 HA ALA 90 1.542 -2.200 -8.851 745 1HB ALA 90 HB1 ALA 90 2.563 0.596 -9.250 746 2HB ALA 90 HB2 ALA 90 3.718 -0.724 -9.062 747 3HB ALA 90 HB3 ALA 90 2.548 -0.757 -10.382 748 H TYR 91 H TYR 91 3.532 -2.776 -7.576 749 HA TYR 91 HA TYR 91 3.073 -2.173 -4.732 750 1HB TYR 91 HB2 TYR 91 5.186 -3.933 -6.014 751 2HB TYR 91 HB3 TYR 91 4.734 -3.911 -4.309 752 HD1 TYR 91 HD1 TYR 91 2.599 -4.844 -3.552 753 HD2 TYR 91 HD2 TYR 91 3.720 -4.926 -7.699 754 HE1 TYR 91 HE1 TYR 91 0.799 -6.489 -4.007 755 HE2 TYR 91 HE2 TYR 91 1.921 -6.571 -8.153 756 HH TYR 91 HH TYR 91 0.645 -8.418 -6.445 757 H ILE 92 H ILE 92 4.392 -0.868 -3.484 758 HA ILE 92 HA ILE 92 6.556 0.571 -4.944 759 HB ILE 92 HB ILE 92 5.072 1.274 -2.393 760 1HG1 ILE 92 HG12 ILE 92 5.040 2.725 -5.044 761 2HG1 ILE 92 HG13 ILE 92 3.899 1.428 -4.686 762 1HG2 ILE 92 HG21 ILE 92 7.571 2.242 -3.558 763 2HG2 ILE 92 HG22 ILE 92 6.380 3.530 -3.376 764 3HG2 ILE 92 HG23 ILE 92 6.871 2.578 -1.974 765 1HD1 ILE 92 HD11 ILE 92 3.338 2.709 -2.543 766 2HD1 ILE 92 HD12 ILE 92 4.225 4.063 -3.242 767 3HD1 ILE 92 HD13 ILE 92 2.788 3.439 -4.051 768 H TYR 93 H TYR 93 8.657 0.324 -4.318 769 HA TYR 93 HA TYR 93 9.159 -1.245 -1.821 770 1HB TYR 93 HB2 TYR 93 10.659 -1.183 -4.452 771 2HB TYR 93 HB3 TYR 93 11.305 -1.929 -2.989 772 HD1 TYR 93 HD1 TYR 93 8.540 -2.052 -5.466 773 HD2 TYR 93 HD2 TYR 93 10.492 -4.039 -2.195 774 HE1 TYR 93 HE1 TYR 93 7.225 -4.104 -5.928 775 HE2 TYR 93 HE2 TYR 93 9.178 -6.090 -2.657 776 HH TYR 93 HH TYR 93 7.992 -7.049 -4.889 777 H ALA 94 H ALA 94 10.188 -0.092 -0.267 778 HA ALA 94 HA ALA 94 11.794 2.281 -1.124 779 1HB ALA 94 HB1 ALA 94 9.730 1.956 0.879 780 2HB ALA 94 HB2 ALA 94 11.236 2.475 1.636 781 3HB ALA 94 HB3 ALA 94 10.526 3.435 0.339 782 H ASP 95 H ASP 95 13.937 2.276 -0.573 783 HA ASP 95 HA ASP 95 15.967 1.536 0.341 784 1HB ASP 95 HB2 ASP 95 13.987 0.855 2.503 785 2HB ASP 95 HB3 ASP 95 15.665 0.333 2.650 786 H GLY 96 H GLY 96 14.145 -0.239 -1.353 787 1HA GLY 96 HA2 GLY 96 14.514 -2.355 -2.335 788 2HA GLY 96 HA3 GLY 96 15.816 -2.623 -1.177 789 H LYS 97 H LYS 97 12.666 -1.671 -0.030 790 HA LYS 97 HA LYS 97 12.149 -4.493 0.815 791 1HB LYS 97 HB2 LYS 97 13.001 -2.625 2.569 792 2HB LYS 97 HB3 LYS 97 11.268 -2.295 2.617 793 1HG LYS 97 HG2 LYS 97 10.928 -4.800 2.947 794 2HG LYS 97 HG3 LYS 97 12.669 -4.907 3.218 795 1HD LYS 97 HD2 LYS 97 12.245 -4.398 5.376 796 2HD LYS 97 HD3 LYS 97 11.868 -2.767 4.818 797 1HE LYS 97 HE2 LYS 97 9.527 -3.312 4.584 798 2HE LYS 97 HE3 LYS 97 9.843 -5.019 4.898 799 1HZ LYS 97 HZ1 LYS 97 10.813 -3.224 6.940 800 2HZ LYS 97 HZ2 LYS 97 9.122 -3.233 6.769 801 3HZ LYS 97 HZ3 LYS 97 9.949 -4.679 7.091 802 H MET 98 H MET 98 9.867 -4.978 1.126 803 HA MET 98 HA MET 98 8.161 -3.493 -0.737 804 1HB MET 98 HB2 MET 98 8.120 -6.001 -0.516 805 2HB MET 98 HB3 MET 98 7.415 -5.797 1.089 806 1HG MET 98 HG2 MET 98 5.587 -4.418 -0.009 807 2HG MET 98 HG3 MET 98 6.228 -4.949 -1.564 808 1HE MET 98 HE1 MET 98 6.241 -6.724 -2.529 809 2HE MET 98 HE2 MET 98 6.298 -8.337 -1.806 810 3HE MET 98 HE3 MET 98 4.800 -7.738 -2.512 811 H VAL 99 H VAL 99 7.316 -1.594 0.007 812 HA VAL 99 HA VAL 99 6.922 -0.952 2.764 813 HB VAL 99 HB VAL 99 5.360 0.249 0.471 814 1HG1 VAL 99 HG11 VAL 99 6.301 1.168 3.190 815 2HG1 VAL 99 HG12 VAL 99 5.826 2.319 1.940 816 3HG1 VAL 99 HG13 VAL 99 4.658 1.147 2.551 817 1HG2 VAL 99 HG21 VAL 99 8.272 0.342 1.095 818 2HG2 VAL 99 HG22 VAL 99 7.450 0.516 -0.456 819 3HG2 VAL 99 HG23 VAL 99 7.503 1.872 0.671 820 H ASN 100 H ASN 100 4.792 -2.389 0.331 821 HA ASN 100 HA ASN 100 2.332 -2.206 1.716 822 1HB ASN 100 HB2 ASN 100 3.313 -4.501 -0.012 823 2HB ASN 100 HB3 ASN 100 1.631 -4.152 0.389 824 1HD2 ASN 100 HD21 ASN 100 1.171 -3.817 -1.942 825 2HD2 ASN 100 HD22 ASN 100 1.660 -2.384 -2.711 826 H GLU 101 H GLU 101 4.596 -4.993 1.718 827 HA GLU 101 HA GLU 101 3.276 -6.418 3.795 828 1HB GLU 101 HB2 GLU 101 4.939 -7.556 2.477 829 2HB GLU 101 HB3 GLU 101 6.180 -6.388 2.934 830 1HG GLU 101 HG2 GLU 101 6.537 -7.367 4.962 831 2HG GLU 101 HG3 GLU 101 4.824 -7.718 5.201 832 H ALA 102 H ALA 102 5.539 -3.739 3.893 833 HA ALA 102 HA ALA 102 6.314 -3.939 6.631 834 1HB ALA 102 HB1 ALA 102 6.526 -1.995 4.499 835 2HB ALA 102 HB2 ALA 102 6.106 -1.193 6.012 836 3HB ALA 102 HB3 ALA 102 7.554 -2.195 5.917 837 H LEU 103 H LEU 103 3.548 -2.353 5.080 838 HA LEU 103 HA LEU 103 2.487 -1.185 7.478 839 1HB LEU 103 HB2 LEU 103 1.173 -1.996 4.871 840 2HB LEU 103 HB3 LEU 103 0.328 -1.134 6.156 841 HG LEU 103 HG LEU 103 2.882 0.117 5.556 842 1HD1 LEU 103 HD11 LEU 103 1.262 -0.800 3.304 843 2HD1 LEU 103 HD12 LEU 103 1.455 0.953 3.316 844 3HD1 LEU 103 HD13 LEU 103 2.877 -0.090 3.306 845 1HD2 LEU 103 HD21 LEU 103 0.270 0.790 6.401 846 2HD2 LEU 103 HD22 LEU 103 1.646 1.880 6.226 847 3HD2 LEU 103 HD23 LEU 103 0.524 1.654 4.885 848 H VAL 104 H VAL 104 1.511 -4.151 5.713 849 HA VAL 104 HA VAL 104 -0.358 -5.061 7.644 850 HB VAL 104 HB VAL 104 1.415 -6.672 5.782 851 1HG1 VAL 104 HG11 VAL 104 -0.549 -7.435 7.813 852 2HG1 VAL 104 HG12 VAL 104 -0.961 -8.049 6.213 853 3HG1 VAL 104 HG13 VAL 104 0.600 -8.442 6.933 854 1HG2 VAL 104 HG21 VAL 104 -1.322 -5.414 5.537 855 2HG2 VAL 104 HG22 VAL 104 0.063 -5.234 4.460 856 3HG2 VAL 104 HG23 VAL 104 -0.827 -6.756 4.505 857 H ARG 105 H ARG 105 3.110 -5.020 7.704 858 HA ARG 105 HA ARG 105 3.427 -7.123 9.680 859 1HB ARG 105 HB2 ARG 105 5.199 -6.077 8.057 860 2HB ARG 105 HB3 ARG 105 5.387 -4.869 9.329 861 1HG ARG 105 HG2 ARG 105 5.394 -7.254 10.736 862 2HG ARG 105 HG3 ARG 105 6.283 -7.657 9.268 863 1HD ARG 105 HD2 ARG 105 7.722 -5.659 9.621 864 2HD ARG 105 HD3 ARG 105 6.869 -5.338 11.131 865 HE ARG 105 HE ARG 105 8.703 -7.627 10.643 866 1HH1 ARG 105 HH11 ARG 105 8.055 -5.186 12.754 867 2HH1 ARG 105 HH12 ARG 105 7.985 -6.160 14.184 868 1HH2 ARG 105 HH21 ARG 105 7.992 -9.166 12.456 869 2HH2 ARG 105 HH22 ARG 105 7.950 -8.414 14.016 870 H GLN 106 H GLN 106 3.301 -3.561 9.821 871 HA GLN 106 HA GLN 106 3.446 -3.605 12.757 872 1HB GLN 106 HB2 GLN 106 3.831 -1.657 10.685 873 2HB GLN 106 HB3 GLN 106 2.605 -1.058 11.801 874 1HG GLN 106 HG2 GLN 106 4.569 -0.344 12.840 875 2HG GLN 106 HG3 GLN 106 4.282 -1.884 13.648 876 1HE2 GLN 106 HE21 GLN 106 5.834 -3.548 13.358 877 2HE2 GLN 106 HE22 GLN 106 7.204 -3.391 12.368 878 H GLY 107 H GLY 107 1.083 -4.535 10.786 879 1HA GLY 107 HA2 GLY 107 -1.245 -4.699 11.012 880 2HA GLY 107 HA3 GLY 107 -1.005 -4.256 12.703 881 H LEU 108 H LEU 108 -0.042 -2.232 9.980 882 HA LEU 108 HA LEU 108 -1.944 -0.166 10.974 883 1HB LEU 108 HB2 LEU 108 0.510 0.042 9.201 884 2HB LEU 108 HB3 LEU 108 -0.536 1.403 9.610 885 HG LEU 108 HG LEU 108 0.863 -0.334 11.662 886 1HD1 LEU 108 HD11 LEU 108 1.632 2.271 10.346 887 2HD1 LEU 108 HD12 LEU 108 2.210 1.860 11.961 888 3HD1 LEU 108 HD13 LEU 108 2.619 0.829 10.589 889 1HD2 LEU 108 HD21 LEU 108 -0.828 2.166 11.759 890 2HD2 LEU 108 HD22 LEU 108 -1.030 0.671 12.673 891 3HD2 LEU 108 HD23 LEU 108 0.294 1.770 13.061 892 H ALA 109 H ALA 109 -2.199 -2.563 8.906 893 HA ALA 109 HA ALA 109 -4.162 -1.221 7.247 894 1HB ALA 109 HB1 ALA 109 -1.545 -1.063 6.303 895 2HB ALA 109 HB2 ALA 109 -2.227 -2.429 5.421 896 3HB ALA 109 HB3 ALA 109 -3.007 -0.849 5.339 897 H LYS 110 H LYS 110 -4.920 -2.898 5.472 898 HA LYS 110 HA LYS 110 -4.454 -5.689 6.368 899 1HB LYS 110 HB2 LYS 110 -6.834 -6.150 6.590 900 2HB LYS 110 HB3 LYS 110 -6.412 -4.806 7.653 901 1HG LYS 110 HG2 LYS 110 -7.955 -3.535 6.624 902 2HG LYS 110 HG3 LYS 110 -7.049 -3.691 5.118 903 1HD LYS 110 HD2 LYS 110 -8.224 -5.793 4.611 904 2HD LYS 110 HD3 LYS 110 -9.120 -5.664 6.126 905 1HE LYS 110 HE2 LYS 110 -9.241 -3.262 4.410 906 2HE LYS 110 HE3 LYS 110 -10.019 -4.694 3.734 907 1HZ LYS 110 HZ1 LYS 110 -11.173 -4.940 5.909 908 2HZ LYS 110 HZ2 LYS 110 -10.561 -3.420 6.356 909 3HZ LYS 110 HZ3 LYS 110 -11.617 -3.553 5.037 910 H VAL 111 H VAL 111 -4.628 -7.162 4.683 911 HA VAL 111 HA VAL 111 -4.425 -6.287 2.011 912 HB VAL 111 HB VAL 111 -5.504 -8.961 2.955 913 1HG1 VAL 111 HG11 VAL 111 -5.353 -7.962 0.396 914 2HG1 VAL 111 HG12 VAL 111 -3.799 -8.780 0.559 915 3HG1 VAL 111 HG13 VAL 111 -5.297 -9.677 0.808 916 1HG2 VAL 111 HG21 VAL 111 -3.088 -7.840 3.644 917 2HG2 VAL 111 HG22 VAL 111 -3.391 -9.574 3.535 918 3HG2 VAL 111 HG23 VAL 111 -2.673 -8.718 2.172 919 H ALA 112 H ALA 112 -5.936 -6.012 0.354 920 HA ALA 112 HA ALA 112 -8.712 -6.762 0.599 921 1HB ALA 112 HB1 ALA 112 -8.206 -4.601 2.132 922 2HB ALA 112 HB2 ALA 112 -8.479 -3.794 0.587 923 3HB ALA 112 HB3 ALA 112 -9.734 -4.820 1.280 924 H TYR 113 H TYR 113 -10.000 -5.698 -1.252 925 HA TYR 113 HA TYR 113 -10.166 -5.353 -3.567 926 1HB TYR 113 HB2 TYR 113 -7.704 -3.716 -2.904 927 2HB TYR 113 HB3 TYR 113 -8.479 -3.703 -4.488 928 HD1 TYR 113 HD1 TYR 113 -11.188 -3.475 -4.300 929 HD2 TYR 113 HD2 TYR 113 -8.324 -2.011 -1.452 930 HE1 TYR 113 HE1 TYR 113 -12.848 -1.827 -3.477 931 HE2 TYR 113 HE2 TYR 113 -9.986 -0.363 -0.629 932 HH TYR 113 HH TYR 113 -12.357 -0.011 -0.587 933 H VAL 114 H VAL 114 -9.279 -7.821 -3.197 934 HA VAL 114 HA VAL 114 -6.685 -8.177 -4.581 935 HB VAL 114 HB VAL 114 -8.610 -10.177 -3.358 936 1HG1 VAL 114 HG11 VAL 114 -6.389 -10.494 -5.199 937 2HG1 VAL 114 HG12 VAL 114 -6.053 -11.301 -3.667 938 3HG1 VAL 114 HG13 VAL 114 -7.503 -11.713 -4.582 939 1HG2 VAL 114 HG21 VAL 114 -7.099 -8.473 -1.977 940 2HG2 VAL 114 HG22 VAL 114 -7.261 -10.155 -1.472 941 3HG2 VAL 114 HG23 VAL 114 -5.834 -9.639 -2.371 942 H TYR 115 H TYR 115 -7.252 -7.515 -6.717 943 HA TYR 115 HA TYR 115 -9.329 -9.192 -8.060 944 1HB TYR 115 HB2 TYR 115 -8.086 -6.584 -8.988 945 2HB TYR 115 HB3 TYR 115 -9.413 -7.444 -9.769 946 HD1 TYR 115 HD1 TYR 115 -11.519 -7.925 -8.305 947 HD2 TYR 115 HD2 TYR 115 -8.545 -4.977 -7.344 948 HE1 TYR 115 HE1 TYR 115 -13.139 -6.774 -6.822 949 HE2 TYR 115 HE2 TYR 115 -10.166 -3.826 -5.862 950 HH TYR 115 HH TYR 115 -12.895 -3.750 -5.834 951 H LYS 116 H LYS 116 -8.735 -10.476 -9.786 952 HA LYS 116 HA LYS 116 -5.833 -10.833 -10.220 953 1HB LYS 116 HB2 LYS 116 -6.491 -12.859 -11.434 954 2HB LYS 116 HB3 LYS 116 -7.318 -12.806 -9.876 955 1HG LYS 116 HG2 LYS 116 -9.291 -11.762 -11.045 956 2HG LYS 116 HG3 LYS 116 -8.470 -12.060 -12.577 957 1HD LYS 116 HD2 LYS 116 -9.105 -14.220 -12.570 958 2HD LYS 116 HD3 LYS 116 -8.456 -14.451 -10.946 959 1HE LYS 116 HE2 LYS 116 -10.645 -13.068 -10.283 960 2HE LYS 116 HE3 LYS 116 -11.232 -13.755 -11.797 961 1HZ LYS 116 HZ1 LYS 116 -9.895 -15.761 -10.379 962 2HZ LYS 116 HZ2 LYS 116 -10.980 -15.009 -9.309 963 3HZ LYS 116 HZ3 LYS 116 -11.546 -15.671 -10.766 964 HA PRO 117 HA PRO 117 -4.849 -12.032 -11.720 965 1HB PRO 117 HB2 PRO 117 -2.775 -11.596 -13.438 966 2HB PRO 117 HB3 PRO 117 -4.201 -12.553 -13.872 967 1HG PRO 117 HG2 PRO 117 -3.425 -9.843 -14.775 968 2HG PRO 117 HG3 PRO 117 -4.490 -11.025 -15.550 969 1HD PRO 117 HD2 PRO 117 -5.270 -8.727 -14.022 970 2HD PRO 117 HD3 PRO 117 -6.331 -9.975 -14.712 971 H ASN 118 H ASN 118 -5.086 -9.181 -10.749 972 HA ASN 118 HA ASN 118 -2.294 -8.337 -10.352 973 1HB ASN 118 HB2 ASN 118 -4.960 -7.230 -9.447 974 2HB ASN 118 HB3 ASN 118 -3.425 -6.552 -8.905 975 1HD2 ASN 118 HD21 ASN 118 -5.484 -5.287 -10.695 976 2HD2 ASN 118 HD22 ASN 118 -4.665 -4.917 -12.135 977 H ASN 119 H ASN 119 -2.549 -10.852 -9.315 978 HA ASN 119 HA ASN 119 -2.389 -10.318 -6.386 979 1HB ASN 119 HB2 ASN 119 -3.382 -12.704 -6.136 980 2HB ASN 119 HB3 ASN 119 -4.491 -11.382 -6.505 981 1HD2 ASN 119 HD21 ASN 119 -5.921 -13.090 -7.495 982 2HD2 ASN 119 HD22 ASN 119 -5.585 -13.637 -9.065 983 H THR 120 H THR 120 -0.278 -10.522 -8.348 984 HA THR 120 HA THR 120 0.898 -13.123 -8.444 985 HB THR 120 HB THR 120 2.260 -10.410 -8.461 986 HG1 THR 120 HG1 THR 120 2.127 -10.727 -10.729 987 1HG2 THR 120 HG21 THR 120 3.187 -13.211 -8.909 988 2HG2 THR 120 HG22 THR 120 3.835 -11.957 -9.967 989 3HG2 THR 120 HG23 THR 120 4.052 -11.837 -8.221 990 H HIS 121 H HIS 121 1.201 -10.475 -6.090 991 HA HIS 121 HA HIS 121 2.839 -12.272 -4.361 992 1HB HIS 121 HB2 HIS 121 2.339 -9.283 -4.272 993 2HB HIS 121 HB3 HIS 121 3.246 -10.161 -3.042 994 HD1 HIS 121 HD1 HIS 121 5.580 -11.089 -3.701 995 HD2 HIS 121 HD2 HIS 121 3.683 -9.001 -6.771 996 HE1 HIS 121 HE1 HIS 121 7.331 -10.694 -5.489 997 H GLU 122 H GLU 122 0.013 -12.737 -4.677 998 HA GLU 122 HA GLU 122 -1.403 -11.581 -2.414 999 1HB GLU 122 HB2 GLU 122 -2.575 -12.374 -4.453 1000 2HB GLU 122 HB3 GLU 122 -2.073 -14.025 -4.084 1001 1HG GLU 122 HG2 GLU 122 -3.187 -13.346 -1.712 1002 2HG GLU 122 HG3 GLU 122 -4.159 -12.350 -2.796 1003 H GLN 123 H GLN 123 0.198 -14.691 -3.063 1004 HA GLN 123 HA GLN 123 -0.553 -16.001 -0.653 1005 1HB GLN 123 HB2 GLN 123 0.956 -16.673 -2.845 1006 2HB GLN 123 HB3 GLN 123 2.187 -16.548 -1.589 1007 1HG GLN 123 HG2 GLN 123 0.292 -17.915 -0.227 1008 2HG GLN 123 HG3 GLN 123 -0.045 -18.487 -1.860 1009 1HE2 GLN 123 HE21 GLN 123 1.744 -19.284 0.811 1010 2HE2 GLN 123 HE22 GLN 123 3.035 -20.093 0.063 1011 H LEU 124 H LEU 124 2.051 -13.710 -1.348 1012 HA LEU 124 HA LEU 124 3.339 -14.035 1.234 1013 1HB LEU 124 HB2 LEU 124 4.155 -12.955 -1.095 1014 2HB LEU 124 HB3 LEU 124 3.645 -11.484 -0.267 1015 HG LEU 124 HG LEU 124 5.052 -12.123 1.682 1016 1HD1 LEU 124 HD11 LEU 124 5.020 -14.637 0.414 1017 2HD1 LEU 124 HD12 LEU 124 6.685 -14.068 0.289 1018 3HD1 LEU 124 HD13 LEU 124 5.913 -14.196 1.870 1019 1HD2 LEU 124 HD21 LEU 124 5.843 -10.854 -0.515 1020 2HD2 LEU 124 HD22 LEU 124 7.003 -11.280 0.744 1021 3HD2 LEU 124 HD23 LEU 124 6.862 -12.281 -0.701 1022 H LEU 125 H LEU 125 1.303 -11.427 -0.149 1023 HA LEU 125 HA LEU 125 1.124 -9.917 2.260 1024 1HB LEU 125 HB2 LEU 125 -0.552 -10.096 -0.229 1025 2HB LEU 125 HB3 LEU 125 -1.105 -9.128 1.138 1026 HG LEU 125 HG LEU 125 1.632 -8.842 -0.130 1027 1HD1 LEU 125 HD11 LEU 125 -0.947 -7.316 -0.564 1028 2HD1 LEU 125 HD12 LEU 125 0.634 -6.682 -1.016 1029 3HD1 LEU 125 HD13 LEU 125 0.025 -8.151 -1.777 1030 1HD2 LEU 125 HD21 LEU 125 0.287 -7.751 2.236 1031 2HD2 LEU 125 HD22 LEU 125 1.998 -7.727 1.809 1032 3HD2 LEU 125 HD23 LEU 125 0.912 -6.495 1.168 1033 H ARG 126 H ARG 126 -0.419 -12.869 1.313 1034 HA ARG 126 HA ARG 126 -2.685 -12.611 3.127 1035 1HB ARG 126 HB2 ARG 126 -1.883 -14.404 1.079 1036 2HB ARG 126 HB3 ARG 126 -2.032 -15.357 2.557 1037 1HG ARG 126 HG2 ARG 126 -4.292 -14.684 2.888 1038 2HG ARG 126 HG3 ARG 126 -4.160 -13.393 1.693 1039 1HD ARG 126 HD2 ARG 126 -5.385 -15.368 0.805 1040 2HD ARG 126 HD3 ARG 126 -3.910 -15.038 -0.102 1041 HE ARG 126 HE ARG 126 -3.283 -16.892 1.965 1042 1HH1 ARG 126 HH11 ARG 126 -6.061 -17.614 0.640 1043 2HH1 ARG 126 HH12 ARG 126 -5.530 -18.843 -0.459 1044 1HH2 ARG 126 HH21 ARG 126 -2.169 -18.053 -0.135 1045 2HH2 ARG 126 HH22 ARG 126 -3.325 -19.092 -0.897 1046 H LYS 127 H LYS 127 0.298 -14.597 3.182 1047 HA LYS 127 HA LYS 127 -0.057 -15.580 5.831 1048 1HB LYS 127 HB2 LYS 127 2.422 -15.961 5.767 1049 2HB LYS 127 HB3 LYS 127 1.590 -16.577 4.339 1050 1HG LYS 127 HG2 LYS 127 2.295 -14.740 3.004 1051 2HG LYS 127 HG3 LYS 127 2.793 -13.808 4.415 1052 1HD LYS 127 HD2 LYS 127 4.078 -16.470 3.919 1053 2HD LYS 127 HD3 LYS 127 4.596 -15.083 2.960 1054 1HE LYS 127 HE2 LYS 127 5.617 -14.082 4.731 1055 2HE LYS 127 HE3 LYS 127 4.342 -14.554 5.855 1056 1HZ LYS 127 HZ1 LYS 127 6.413 -16.389 4.777 1057 2HZ LYS 127 HZ2 LYS 127 6.473 -15.657 6.309 1058 3HZ LYS 127 HZ3 LYS 127 5.240 -16.764 5.947 1059 H SER 128 H SER 128 1.254 -12.555 4.603 1060 HA SER 128 HA SER 128 2.472 -11.678 7.055 1061 1HB SER 128 HB2 SER 128 2.831 -9.672 5.958 1062 2HB SER 128 HB3 SER 128 2.558 -10.718 4.568 1063 HG SER 128 HG SER 128 1.263 -8.866 4.439 1064 H GLU 129 H GLU 129 -0.745 -11.045 5.624 1065 HA GLU 129 HA GLU 129 -1.743 -9.404 7.708 1066 1HB GLU 129 HB2 GLU 129 -2.779 -10.194 5.377 1067 2HB GLU 129 HB3 GLU 129 -3.580 -11.375 6.413 1068 1HG GLU 129 HG2 GLU 129 -3.603 -8.618 7.465 1069 2HG GLU 129 HG3 GLU 129 -4.512 -8.838 5.969 1070 H ALA 130 H ALA 130 -1.449 -12.908 7.463 1071 HA ALA 130 HA ALA 130 -3.053 -13.480 9.805 1072 1HB ALA 130 HB1 ALA 130 -0.985 -15.070 8.274 1073 2HB ALA 130 HB2 ALA 130 -1.809 -15.711 9.695 1074 3HB ALA 130 HB3 ALA 130 -2.736 -15.277 8.259 1075 H GLN 131 H GLN 131 0.348 -12.783 9.224 1076 HA GLN 131 HA GLN 131 1.286 -13.541 11.839 1077 1HB GLN 131 HB2 GLN 131 2.791 -13.207 9.886 1078 2HB GLN 131 HB3 GLN 131 2.434 -11.480 9.930 1079 1HG GLN 131 HG2 GLN 131 4.033 -11.193 11.482 1080 2HG GLN 131 HG3 GLN 131 3.162 -12.275 12.569 1081 1HE2 GLN 131 HE21 GLN 131 3.420 -14.676 10.919 1082 2HE2 GLN 131 HE22 GLN 131 5.054 -15.133 10.954 1083 H ALA 132 H ALA 132 0.232 -10.435 10.441 1084 HA ALA 132 HA ALA 132 0.667 -8.898 12.826 1085 1HB ALA 132 HB1 ALA 132 -0.562 -8.511 10.208 1086 2HB ALA 132 HB2 ALA 132 -1.464 -7.694 11.485 1087 3HB ALA 132 HB3 ALA 132 0.247 -7.337 11.247 1088 H LYS 133 H LYS 133 -1.939 -10.975 11.733 1089 HA LYS 133 HA LYS 133 -3.948 -10.068 13.573 1090 1HB LYS 133 HB2 LYS 133 -3.491 -12.511 11.914 1091 2HB LYS 133 HB3 LYS 133 -4.658 -12.625 13.230 1092 1HG LYS 133 HG2 LYS 133 -5.520 -10.328 12.227 1093 2HG LYS 133 HG3 LYS 133 -4.747 -10.933 10.761 1094 1HD LYS 133 HD2 LYS 133 -7.099 -11.630 10.817 1095 2HD LYS 133 HD3 LYS 133 -6.047 -13.039 10.968 1096 1HE LYS 133 HE2 LYS 133 -6.489 -13.281 13.263 1097 2HE LYS 133 HE3 LYS 133 -7.049 -11.617 13.425 1098 1HZ LYS 133 HZ1 LYS 133 -8.666 -12.849 11.532 1099 2HZ LYS 133 HZ2 LYS 133 -8.547 -13.927 12.836 1100 3HZ LYS 133 HZ3 LYS 133 -9.097 -12.341 13.094 1101 H LYS 134 H LYS 134 -1.664 -12.819 13.735 1102 HA LYS 134 HA LYS 134 -2.373 -13.527 16.434 1103 1HB LYS 134 HB2 LYS 134 -0.105 -14.181 14.576 1104 2HB LYS 134 HB3 LYS 134 0.010 -14.631 16.275 1105 1HG LYS 134 HG2 LYS 134 -2.487 -15.508 15.775 1106 2HG LYS 134 HG3 LYS 134 -1.801 -15.677 14.158 1107 1HD LYS 134 HD2 LYS 134 -0.108 -16.651 16.394 1108 2HD LYS 134 HD3 LYS 134 -1.565 -17.588 16.061 1109 1HE LYS 134 HE2 LYS 134 -0.686 -18.439 14.166 1110 2HE LYS 134 HE3 LYS 134 -0.190 -16.842 13.604 1111 1HZ LYS 134 HZ1 LYS 134 1.581 -17.204 15.521 1112 2HZ LYS 134 HZ2 LYS 134 1.310 -18.831 15.117 1113 3HZ LYS 134 HZ3 LYS 134 1.843 -17.738 13.931 1114 H GLU 135 H GLU 135 -0.341 -11.081 15.059 1115 HA GLU 135 HA GLU 135 1.140 -10.663 17.580 1116 1HB GLU 135 HB2 GLU 135 1.196 -9.285 14.885 1117 2HB GLU 135 HB3 GLU 135 2.129 -8.716 16.270 1118 1HG GLU 135 HG2 GLU 135 3.116 -11.044 16.435 1119 2HG GLU 135 HG3 GLU 135 2.346 -11.403 14.890 1120 H LYS 136 H LYS 136 -1.805 -9.720 16.206 1121 HA LYS 136 HA LYS 136 -3.280 -7.936 16.649 1122 1HB LYS 136 HB2 LYS 136 -2.119 -8.388 19.414 1123 2HB LYS 136 HB3 LYS 136 -3.670 -7.629 19.052 1124 1HG LYS 136 HG2 LYS 136 -4.502 -9.694 18.065 1125 2HG LYS 136 HG3 LYS 136 -2.928 -10.464 18.276 1126 1HD LYS 136 HD2 LYS 136 -3.452 -11.041 20.384 1127 2HD LYS 136 HD3 LYS 136 -3.783 -9.357 20.790 1128 1HE LYS 136 HE2 LYS 136 -5.776 -10.787 21.145 1129 2HE LYS 136 HE3 LYS 136 -6.062 -9.570 19.901 1130 1HZ LYS 136 HZ1 LYS 136 -5.117 -11.541 18.413 1131 2HZ LYS 136 HZ2 LYS 136 -5.819 -12.459 19.654 1132 3HZ LYS 136 HZ3 LYS 136 -6.770 -11.367 18.765 1133 H LEU 137 H LEU 137 -1.536 -6.575 15.412 1134 HA LEU 137 HA LEU 137 -0.262 -4.611 17.251 1135 1HB LEU 137 HB2 LEU 137 0.422 -5.734 14.651 1136 2HB LEU 137 HB3 LEU 137 0.494 -3.971 14.645 1137 HG LEU 137 HG LEU 137 1.642 -5.179 17.064 1138 1HD1 LEU 137 HD11 LEU 137 2.281 -6.901 15.398 1139 2HD1 LEU 137 HD12 LEU 137 2.980 -5.641 14.380 1140 3HD1 LEU 137 HD13 LEU 137 3.683 -5.990 15.960 1141 1HD2 LEU 137 HD21 LEU 137 2.020 -2.915 15.244 1142 2HD2 LEU 137 HD22 LEU 137 2.401 -3.047 16.961 1143 3HD2 LEU 137 HD23 LEU 137 3.547 -3.636 15.755 1144 H ASN 138 H ASN 138 -1.738 -3.054 17.748 1145 HA ASN 138 HA ASN 138 -3.110 -1.189 17.439 1146 1HB ASN 138 HB2 ASN 138 -2.136 -1.407 14.578 1147 2HB ASN 138 HB3 ASN 138 -2.971 -0.018 15.271 1148 1HD2 ASN 138 HD21 ASN 138 0.106 -1.220 14.628 1149 2HD2 ASN 138 HD22 ASN 138 0.985 -0.297 15.749 1150 H ILE 139 H ILE 139 -3.925 -1.738 14.147 1151 HA ILE 139 HA ILE 139 -6.651 -1.859 14.439 1152 HB ILE 139 HB ILE 139 -5.016 -3.468 12.456 1153 1HG1 ILE 139 HG12 ILE 139 -6.372 -0.920 11.739 1154 2HG1 ILE 139 HG13 ILE 139 -4.959 -0.780 12.787 1155 1HG2 ILE 139 HG21 ILE 139 -7.919 -2.590 12.450 1156 2HG2 ILE 139 HG22 ILE 139 -7.084 -3.291 11.064 1157 3HG2 ILE 139 HG23 ILE 139 -7.325 -4.249 12.525 1158 1HD1 ILE 139 HD11 ILE 139 -4.161 -2.625 10.870 1159 2HD1 ILE 139 HD12 ILE 139 -5.101 -1.453 9.946 1160 3HD1 ILE 139 HD13 ILE 139 -3.720 -0.918 10.903 1161 H TRP 140 H TRP 140 -4.532 -4.747 14.419 1162 HA TRP 140 HA TRP 140 -6.794 -6.450 15.190 1163 1HB TRP 140 HB2 TRP 140 -3.853 -7.162 15.074 1164 2HB TRP 140 HB3 TRP 140 -5.221 -8.275 15.034 1165 HD1 TRP 140 HD1 TRP 140 -3.004 -6.282 12.833 1166 HE1 TRP 140 HE1 TRP 140 -3.848 -6.359 10.399 1167 HE3 TRP 140 HE3 TRP 140 -7.624 -8.326 13.566 1168 HZ2 TRP 140 HZ2 TRP 140 -6.178 -7.179 8.953 1169 HZ3 TRP 140 HZ3 TRP 140 -9.135 -8.743 11.647 1170 HH2 TRP 140 HH2 TRP 140 -8.418 -8.173 9.343 1171 H SER 141 H SER 141 -6.356 -4.420 17.102 1172 HA SER 141 HA SER 141 -5.087 -5.908 19.360 1173 1HB SER 141 HB2 SER 141 -4.057 -3.759 19.099 1174 2HB SER 141 HB3 SER 141 -5.618 -2.961 18.922 1175 HG SER 141 HG SER 141 -4.729 -2.748 21.036 1176 H GLU 142 H GLU 142 -6.923 -7.200 19.875 1177 HA GLU 142 HA GLU 142 -9.355 -5.686 20.724 1178 1HB GLU 142 HB2 GLU 142 -8.974 -8.607 20.003 1179 2HB GLU 142 HB3 GLU 142 -10.477 -7.934 20.635 1180 1HG GLU 142 HG2 GLU 142 -9.676 -6.234 18.517 1181 2HG GLU 142 HG3 GLU 142 -9.481 -7.886 17.930 1182 H ASP 143 H ASP 143 -7.953 -8.819 21.719 1183 HA ASP 143 HA ASP 143 -8.318 -7.943 24.548 1184 1HB ASP 143 HB2 ASP 143 -9.361 -10.130 23.485 1185 2HB ASP 143 HB3 ASP 143 -7.748 -10.782 23.773 1186 H ASN 144 H ASN 144 -6.487 -7.439 25.651 1187 HA ASN 144 HA ASN 144 -4.041 -8.999 25.293 1188 1HB ASN 144 HB2 ASN 144 -4.421 -6.544 23.815 1189 2HB ASN 144 HB3 ASN 144 -3.101 -6.357 24.970 1190 1HD2 ASN 144 HD21 ASN 144 -2.338 -6.374 22.325 1191 2HD2 ASN 144 HD22 ASN 144 -1.607 -7.851 21.917 1192 H ALA 145 H ALA 145 -3.861 -9.353 27.485 1193 HA ALA 145 HA ALA 145 -3.961 -6.964 29.275 1194 1HB ALA 145 HB1 ALA 145 -4.950 -9.676 29.513 1195 2HB ALA 145 HB2 ALA 145 -3.844 -9.307 30.836 1196 3HB ALA 145 HB3 ALA 145 -5.257 -8.288 30.557 1197 H ASP 146 H ASP 146 -1.648 -7.035 27.915 1198 HA ASP 146 HA ASP 146 0.309 -7.657 30.013 1199 1HB ASP 146 HB2 ASP 146 -0.102 -9.724 28.397 1200 2HB ASP 146 HB3 ASP 146 0.949 -8.804 27.320 1201 H SER 147 H SER 147 1.062 -5.557 30.058 1202 HA SER 147 HA SER 147 1.760 -4.263 27.470 1203 1HB SER 147 HB2 SER 147 1.256 -3.251 30.256 1204 2HB SER 147 HB3 SER 147 2.197 -2.278 29.129 1205 HG SER 147 HG SER 147 0.400 -1.782 28.175 1206 H GLY 148 H GLY 148 3.216 -4.475 30.741 1207 1HA GLY 148 HA2 GLY 148 5.517 -5.668 30.656 1208 2HA GLY 148 HA3 GLY 148 5.888 -4.479 29.407 1209 H GLN 149 H GLN 149 6.209 -5.096 32.654 1210 HA GLN 149 HA GLN 149 6.181 -2.206 33.391 1211 1HB GLN 149 HB2 GLN 149 5.755 -4.740 34.862 1212 2HB GLN 149 HB3 GLN 149 6.700 -3.525 35.722 1213 1HG GLN 149 HG2 GLN 149 4.348 -3.186 36.237 1214 2HG GLN 149 HG3 GLN 149 4.903 -1.852 35.225 1215 1HE2 GLN 149 HE21 GLN 149 3.370 -1.359 33.661 1216 2HE2 GLN 149 HE22 GLN 149 2.400 -2.489 32.851 1217 HN3 PTP 150 H3 PTP 150 -9.090 -3.217 -8.422 1218 1H5M PTP 150 H51 PTP 150 -7.684 -1.295 -3.829 1219 2H5M PTP 150 H52 PTP 150 -6.932 -0.011 -4.806 1220 3H5M PTP 150 H53 PTP 150 -6.393 -1.698 -4.986 1221 H6 PTP 150 H6 PTP 150 -9.443 0.384 -5.260 1222 H1* PTP 150 H1' PTP 150 -11.781 0.367 -8.062 1223 2H2* PTP 150 H2' PTP 150 -12.305 -0.816 -5.344 1224 H3* PTP 150 H3' PTP 150 -13.404 1.139 -4.555 1225 H4* PTP 150 H4' PTP 150 -12.047 3.153 -5.808 1226 2H5* PTP 150 H5' PTP 150 -11.072 1.017 -3.826 Start of MODEL 8 1 1H ALA 1 H1 ALA 1 16.629 -21.600 -10.180 2 2H ALA 1 H2 ALA 1 15.687 -22.751 -10.999 3 3H ALA 1 H3 ALA 1 16.047 -21.269 -11.740 4 HA ALA 1 HA ALA 1 13.930 -20.846 -11.041 5 1HB ALA 1 HB1 ALA 1 14.654 -22.731 -8.805 6 2HB ALA 1 HB2 ALA 1 13.249 -21.675 -8.667 7 3HB ALA 1 HB3 ALA 1 13.338 -22.857 -9.972 8 H THR 2 H THR 2 16.492 -19.467 -10.606 9 HA THR 2 HA THR 2 15.875 -17.975 -8.090 10 HB THR 2 HB THR 2 18.438 -17.584 -9.585 11 HG1 THR 2 HG1 THR 2 18.492 -19.743 -9.530 12 1HG2 THR 2 HG21 THR 2 17.446 -16.589 -7.266 13 2HG2 THR 2 HG22 THR 2 18.304 -18.004 -6.656 14 3HG2 THR 2 HG23 THR 2 19.170 -16.778 -7.581 15 H SER 3 H SER 3 14.652 -16.202 -8.560 16 HA SER 3 HA SER 3 15.635 -14.327 -10.612 17 1HB SER 3 HB2 SER 3 12.732 -14.751 -10.845 18 2HB SER 3 HB3 SER 3 13.943 -14.550 -12.108 19 HG SER 3 HG SER 3 12.787 -16.732 -11.601 20 H THR 4 H THR 4 15.954 -12.813 -8.945 21 HA THR 4 HA THR 4 13.788 -12.204 -7.064 22 HB THR 4 HB THR 4 16.074 -12.000 -6.268 23 HG1 THR 4 HG1 THR 4 14.825 -9.493 -6.699 24 1HG2 THR 4 HG21 THR 4 16.363 -10.293 -8.726 25 2HG2 THR 4 HG22 THR 4 17.429 -10.039 -7.344 26 3HG2 THR 4 HG23 THR 4 17.397 -11.604 -8.156 27 H LYS 5 H LYS 5 14.763 -11.177 -10.201 28 HA LYS 5 HA LYS 5 13.383 -8.573 -9.992 29 1HB LYS 5 HB2 LYS 5 15.480 -8.847 -11.346 30 2HB LYS 5 HB3 LYS 5 14.590 -9.917 -12.430 31 1HG LYS 5 HG2 LYS 5 13.095 -8.158 -13.082 32 2HG LYS 5 HG3 LYS 5 13.689 -7.096 -11.805 33 1HD LYS 5 HD2 LYS 5 15.676 -6.636 -12.917 34 2HD LYS 5 HD3 LYS 5 15.638 -8.149 -13.825 35 1HE LYS 5 HE2 LYS 5 13.451 -7.104 -14.877 36 2HE LYS 5 HE3 LYS 5 14.178 -5.583 -14.357 37 1HZ LYS 5 HZ1 LYS 5 15.749 -7.570 -15.868 38 2HZ LYS 5 HZ2 LYS 5 14.739 -6.473 -16.676 39 3HZ LYS 5 HZ3 LYS 5 16.012 -5.898 -15.709 40 H LYS 6 H LYS 6 11.212 -9.314 -9.592 41 HA LYS 6 HA LYS 6 9.957 -11.083 -11.587 42 1HB LYS 6 HB2 LYS 6 9.508 -10.872 -8.966 43 2HB LYS 6 HB3 LYS 6 8.356 -9.652 -9.511 44 1HG LYS 6 HG2 LYS 6 6.938 -11.218 -10.304 45 2HG LYS 6 HG3 LYS 6 8.237 -12.060 -11.150 46 1HD LYS 6 HD2 LYS 6 8.288 -12.330 -8.206 47 2HD LYS 6 HD3 LYS 6 6.911 -13.092 -9.001 48 1HE LYS 6 HE2 LYS 6 8.367 -14.381 -10.437 49 2HE LYS 6 HE3 LYS 6 9.785 -13.506 -9.862 50 1HZ LYS 6 HZ1 LYS 6 9.319 -14.370 -7.625 51 2HZ LYS 6 HZ2 LYS 6 8.039 -15.292 -8.257 52 3HZ LYS 6 HZ3 LYS 6 9.633 -15.608 -8.745 53 H LEU 7 H LEU 7 8.081 -10.416 -12.821 54 HA LEU 7 HA LEU 7 7.205 -8.950 -14.444 55 1HB LEU 7 HB2 LEU 7 6.812 -7.653 -11.762 56 2HB LEU 7 HB3 LEU 7 6.262 -6.837 -13.225 57 HG LEU 7 HG LEU 7 5.523 -9.669 -13.171 58 1HD1 LEU 7 HD11 LEU 7 5.461 -9.006 -10.704 59 2HD1 LEU 7 HD12 LEU 7 4.191 -7.862 -11.141 60 3HD1 LEU 7 HD13 LEU 7 3.940 -9.591 -11.379 61 1HD2 LEU 7 HD21 LEU 7 4.362 -7.003 -13.812 62 2HD2 LEU 7 HD22 LEU 7 4.309 -8.504 -14.736 63 3HD2 LEU 7 HD23 LEU 7 3.219 -8.271 -13.369 64 H HIS 8 H HIS 8 8.062 -6.108 -12.634 65 HA HIS 8 HA HIS 8 10.617 -5.630 -13.886 66 1HB HIS 8 HB2 HIS 8 8.503 -5.297 -15.614 67 2HB HIS 8 HB3 HIS 8 8.738 -3.664 -14.995 68 HD1 HIS 8 HD1 HIS 8 10.389 -2.370 -16.327 69 HD2 HIS 8 HD2 HIS 8 11.277 -6.442 -16.354 70 HE1 HIS 8 HE1 HIS 8 12.455 -2.643 -17.765 71 H LYS 9 H LYS 9 11.482 -4.561 -12.158 72 HA LYS 9 HA LYS 9 9.800 -2.686 -10.610 73 1HB LYS 9 HB2 LYS 9 12.696 -3.484 -10.186 74 2HB LYS 9 HB3 LYS 9 11.667 -2.622 -9.040 75 1HG LYS 9 HG2 LYS 9 10.113 -4.601 -9.056 76 2HG LYS 9 HG3 LYS 9 11.301 -5.462 -10.035 77 1HD LYS 9 HD2 LYS 9 11.687 -6.081 -7.736 78 2HD LYS 9 HD3 LYS 9 12.998 -5.004 -8.219 79 1HE LYS 9 HE2 LYS 9 12.027 -3.148 -7.074 80 2HE LYS 9 HE3 LYS 9 10.496 -3.994 -6.854 81 1HZ LYS 9 HZ1 LYS 9 12.532 -5.567 -5.761 82 2HZ LYS 9 HZ2 LYS 9 12.732 -3.990 -5.170 83 3HZ LYS 9 HZ3 LYS 9 11.252 -4.795 -4.953 84 H GLU 10 H GLU 10 9.766 -0.558 -11.136 85 HA GLU 10 HA GLU 10 12.131 0.558 -12.591 86 1HB GLU 10 HB2 GLU 10 9.192 0.908 -12.960 87 2HB GLU 10 HB3 GLU 10 10.210 2.325 -13.218 88 1HG GLU 10 HG2 GLU 10 10.670 1.524 -15.273 89 2HG GLU 10 HG3 GLU 10 11.555 0.212 -14.494 90 HA PRO 11 HA PRO 11 12.516 3.592 -9.419 91 1HB PRO 11 HB2 PRO 11 13.428 5.722 -10.861 92 2HB PRO 11 HB3 PRO 11 14.402 4.275 -10.558 93 1HG PRO 11 HG2 PRO 11 13.035 5.132 -13.058 94 2HG PRO 11 HG3 PRO 11 14.493 4.151 -12.853 95 1HD PRO 11 HD2 PRO 11 11.906 3.178 -13.440 96 2HD PRO 11 HD3 PRO 11 13.296 2.204 -12.912 97 H ALA 12 H ALA 12 11.828 5.872 -8.785 98 HA ALA 12 HA ALA 12 9.590 7.033 -10.301 99 1HB ALA 12 HB1 ALA 12 8.926 5.097 -8.485 100 2HB ALA 12 HB2 ALA 12 8.872 6.541 -7.474 101 3HB ALA 12 HB3 ALA 12 7.871 6.441 -8.922 102 H THR 13 H THR 13 8.633 8.872 -8.618 103 HA THR 13 HA THR 13 11.011 10.141 -7.325 104 HB THR 13 HB THR 13 8.973 11.775 -8.827 105 HG1 THR 13 HG1 THR 13 11.416 11.009 -9.969 106 1HG2 THR 13 HG21 THR 13 11.473 12.204 -7.390 107 2HG2 THR 13 HG22 THR 13 11.531 12.867 -9.023 108 3HG2 THR 13 HG23 THR 13 10.264 13.380 -7.908 109 H LEU 14 H LEU 14 10.535 10.482 -5.216 110 HA LEU 14 HA LEU 14 7.916 10.222 -4.111 111 1HB LEU 14 HB2 LEU 14 10.007 9.943 -2.796 112 2HB LEU 14 HB3 LEU 14 10.308 11.675 -2.941 113 HG LEU 14 HG LEU 14 7.949 11.972 -1.925 114 1HD1 LEU 14 HD11 LEU 14 8.282 9.069 -1.888 115 2HD1 LEU 14 HD12 LEU 14 7.908 9.720 -0.292 116 3HD1 LEU 14 HD13 LEU 14 6.825 10.031 -1.649 117 1HD2 LEU 14 HD21 LEU 14 10.363 10.938 -0.432 118 2HD2 LEU 14 HD22 LEU 14 9.811 12.605 -0.595 119 3HD2 LEU 14 HD23 LEU 14 8.915 11.474 0.419 120 H ILE 15 H ILE 15 6.447 11.616 -5.162 121 HA ILE 15 HA ILE 15 7.017 14.477 -5.391 122 HB ILE 15 HB ILE 15 4.400 12.989 -5.776 123 1HG1 ILE 15 HG12 ILE 15 6.501 13.805 -7.809 124 2HG1 ILE 15 HG13 ILE 15 6.241 12.158 -7.237 125 1HG2 ILE 15 HG21 ILE 15 5.000 15.749 -5.688 126 2HG2 ILE 15 HG22 ILE 15 4.806 15.350 -7.394 127 3HG2 ILE 15 HG23 ILE 15 3.506 15.000 -6.255 128 1HD1 ILE 15 HD11 ILE 15 4.025 13.801 -8.473 129 2HD1 ILE 15 HD12 ILE 15 5.090 12.779 -9.439 130 3HD1 ILE 15 HD13 ILE 15 4.063 12.059 -8.201 131 H LYS 16 H LYS 16 4.410 12.682 -3.710 132 HA LYS 16 HA LYS 16 4.831 14.098 -1.223 133 1HB LYS 16 HB2 LYS 16 3.820 15.974 -2.329 134 2HB LYS 16 HB3 LYS 16 2.562 14.958 -3.034 135 1HG LYS 16 HG2 LYS 16 1.635 14.501 -0.824 136 2HG LYS 16 HG3 LYS 16 2.937 15.414 -0.060 137 1HD LYS 16 HD2 LYS 16 2.190 17.467 -1.162 138 2HD LYS 16 HD3 LYS 16 0.933 16.574 -2.018 139 1HE LYS 16 HE2 LYS 16 1.065 16.481 0.986 140 2HE LYS 16 HE3 LYS 16 0.298 17.846 0.175 141 1HZ LYS 16 HZ1 LYS 16 -0.648 15.587 -1.088 142 2HZ LYS 16 HZ2 LYS 16 -0.690 15.219 0.568 143 3HZ LYS 16 HZ3 LYS 16 -1.500 16.593 -0.016 144 H ALA 17 H ALA 17 4.512 12.247 -0.037 145 HA ALA 17 HA ALA 17 2.515 10.265 -0.735 146 1HB ALA 17 HB1 ALA 17 4.126 10.676 1.802 147 2HB ALA 17 HB2 ALA 17 3.119 9.266 1.475 148 3HB ALA 17 HB3 ALA 17 4.528 9.595 0.468 149 H ILE 18 H ILE 18 0.380 10.335 -0.238 150 HA ILE 18 HA ILE 18 -0.595 12.461 1.565 151 HB ILE 18 HB ILE 18 -2.127 10.417 -0.075 152 1HG1 ILE 18 HG12 ILE 18 -1.817 13.353 -0.698 153 2HG1 ILE 18 HG13 ILE 18 -0.616 12.185 -1.252 154 1HG2 ILE 18 HG21 ILE 18 -3.049 11.882 2.041 155 2HG2 ILE 18 HG22 ILE 18 -3.349 12.994 0.706 156 3HG2 ILE 18 HG23 ILE 18 -4.051 11.378 0.680 157 1HD1 ILE 18 HD11 ILE 18 -3.305 11.223 -1.770 158 2HD1 ILE 18 HD12 ILE 18 -3.050 12.805 -2.506 159 3HD1 ILE 18 HD13 ILE 18 -1.973 11.465 -2.900 160 H ASP 19 H ASP 19 -1.656 9.066 1.214 161 HA ASP 19 HA ASP 19 -1.651 8.902 4.202 162 1HB ASP 19 HB2 ASP 19 -3.418 7.559 2.140 163 2HB ASP 19 HB3 ASP 19 -3.384 7.085 3.839 164 H GLY 20 H GLY 20 -1.694 6.299 4.712 165 1HA GLY 20 HA2 GLY 20 0.947 5.394 3.924 166 2HA GLY 20 HA3 GLY 20 -0.197 4.491 4.918 167 H ASP 21 H ASP 21 -2.063 5.226 2.411 168 HA ASP 21 HA ASP 21 -1.186 2.839 0.835 169 1HB ASP 21 HB2 ASP 21 -4.001 3.851 1.346 170 2HB ASP 21 HB3 ASP 21 -3.584 2.470 0.332 171 H THR 22 H THR 22 -1.867 6.185 0.780 172 HA THR 22 HA THR 22 -1.928 6.118 -2.211 173 HB THR 22 HB THR 22 -2.950 8.488 -0.693 174 HG1 THR 22 HG1 THR 22 -4.783 7.512 -0.181 175 1HG2 THR 22 HG21 THR 22 -3.035 7.370 -3.388 176 2HG2 THR 22 HG22 THR 22 -4.638 7.812 -2.800 177 3HG2 THR 22 HG23 THR 22 -3.354 9.019 -2.848 178 H VAL 23 H VAL 23 0.018 6.775 -2.971 179 HA VAL 23 HA VAL 23 1.321 9.106 -1.645 180 HB VAL 23 HB VAL 23 3.535 7.982 -2.067 181 1HG1 VAL 23 HG11 VAL 23 2.286 7.951 0.149 182 2HG1 VAL 23 HG12 VAL 23 1.716 6.340 -0.288 183 3HG1 VAL 23 HG13 VAL 23 3.442 6.638 -0.079 184 1HG2 VAL 23 HG21 VAL 23 1.741 6.052 -3.301 185 2HG2 VAL 23 HG22 VAL 23 3.497 6.171 -3.416 186 3HG2 VAL 23 HG23 VAL 23 2.759 5.285 -2.082 187 H LYS 24 H LYS 24 1.742 10.671 -3.129 188 HA LYS 24 HA LYS 24 1.380 10.080 -5.979 189 1HB LYS 24 HB2 LYS 24 1.884 12.584 -4.377 190 2HB LYS 24 HB3 LYS 24 2.000 12.598 -6.136 191 1HG LYS 24 HG2 LYS 24 -0.362 11.271 -5.784 192 2HG LYS 24 HG3 LYS 24 -0.387 12.377 -4.409 193 1HD LYS 24 HD2 LYS 24 -1.222 13.857 -5.928 194 2HD LYS 24 HD3 LYS 24 0.471 14.048 -6.384 195 1HE LYS 24 HE2 LYS 24 0.258 12.519 -8.203 196 2HE LYS 24 HE3 LYS 24 -1.305 11.940 -7.625 197 1HZ LYS 24 HZ1 LYS 24 -1.697 14.602 -7.887 198 2HZ LYS 24 HZ2 LYS 24 -0.678 14.263 -9.199 199 3HZ LYS 24 HZ3 LYS 24 -2.149 13.429 -9.030 200 H LEU 25 H LEU 25 3.027 9.520 -7.309 201 HA LEU 25 HA LEU 25 5.779 10.442 -6.617 202 1HB LEU 25 HB2 LEU 25 5.400 7.725 -7.827 203 2HB LEU 25 HB3 LEU 25 6.707 8.322 -6.806 204 HG LEU 25 HG LEU 25 3.887 7.949 -5.775 205 1HD1 LEU 25 HD11 LEU 25 6.226 6.019 -5.724 206 2HD1 LEU 25 HD12 LEU 25 4.756 5.833 -4.766 207 3HD1 LEU 25 HD13 LEU 25 4.675 5.769 -6.526 208 1HD2 LEU 25 HD21 LEU 25 5.747 9.421 -4.652 209 2HD2 LEU 25 HD22 LEU 25 4.830 8.293 -3.654 210 3HD2 LEU 25 HD23 LEU 25 6.452 7.868 -4.200 211 H MET 26 H MET 26 7.254 10.123 -8.609 212 HA MET 26 HA MET 26 5.667 10.815 -11.044 213 1HB MET 26 HB2 MET 26 7.383 12.474 -9.947 214 2HB MET 26 HB3 MET 26 8.585 11.456 -10.739 215 1HG MET 26 HG2 MET 26 7.448 11.795 -12.904 216 2HG MET 26 HG3 MET 26 6.256 12.825 -12.114 217 1HE MET 26 HE1 MET 26 9.724 11.926 -12.461 218 2HE MET 26 HE2 MET 26 10.142 13.110 -13.698 219 3HE MET 26 HE3 MET 26 10.701 13.328 -12.033 220 H TYR 27 H TYR 27 6.032 9.663 -12.913 221 HA TYR 27 HA TYR 27 8.168 7.574 -12.837 222 1HB TYR 27 HB2 TYR 27 6.010 6.489 -12.422 223 2HB TYR 27 HB3 TYR 27 5.317 7.276 -13.840 224 HD1 TYR 27 HD1 TYR 27 7.896 4.841 -12.716 225 HD2 TYR 27 HD2 TYR 27 5.661 6.406 -16.034 226 HE1 TYR 27 HE1 TYR 27 8.726 2.993 -14.146 227 HE2 TYR 27 HE2 TYR 27 6.491 4.557 -17.464 228 HH TYR 27 HH TYR 27 7.389 2.032 -16.861 229 H LYS 28 H LYS 28 9.582 8.144 -14.431 230 HA LYS 28 HA LYS 28 10.378 9.006 -16.471 231 1HB LYS 28 HB2 LYS 28 8.078 7.273 -17.046 232 2HB LYS 28 HB3 LYS 28 8.393 8.468 -18.305 233 1HG LYS 28 HG2 LYS 28 10.470 7.597 -18.815 234 2HG LYS 28 HG3 LYS 28 10.730 6.986 -17.181 235 1HD LYS 28 HD2 LYS 28 8.854 5.315 -17.658 236 2HD LYS 28 HD3 LYS 28 8.989 5.800 -19.350 237 1HE LYS 28 HE2 LYS 28 11.534 5.128 -17.976 238 2HE LYS 28 HE3 LYS 28 10.439 3.781 -18.284 239 1HZ LYS 28 HZ1 LYS 28 11.045 5.730 -20.411 240 2HZ LYS 28 HZ2 LYS 28 12.118 4.453 -20.090 241 3HZ LYS 28 HZ3 LYS 28 10.520 4.119 -20.552 242 H GLY 29 H GLY 29 8.819 10.798 -14.769 243 1HA GLY 29 HA2 GLY 29 8.233 13.083 -15.040 244 2HA GLY 29 HA3 GLY 29 8.227 12.845 -16.788 245 H GLN 30 H GLN 30 6.453 10.860 -14.459 246 HA GLN 30 HA GLN 30 3.912 12.069 -15.458 247 1HB GLN 30 HB2 GLN 30 4.394 9.939 -16.669 248 2HB GLN 30 HB3 GLN 30 4.421 9.098 -15.120 249 1HG GLN 30 HG2 GLN 30 2.192 8.844 -15.309 250 2HG GLN 30 HG3 GLN 30 2.042 10.589 -15.097 251 1HE2 GLN 30 HE21 GLN 30 0.336 8.898 -16.830 252 2HE2 GLN 30 HE22 GLN 30 0.543 9.474 -18.413 253 HA PRO 31 HA PRO 31 3.714 12.006 -10.903 254 1HB PRO 31 HB2 PRO 31 2.102 14.211 -10.767 255 2HB PRO 31 HB3 PRO 31 3.864 14.312 -10.937 256 1HG PRO 31 HG2 PRO 31 1.741 14.694 -13.012 257 2HG PRO 31 HG3 PRO 31 3.297 15.522 -12.830 258 1HD PRO 31 HD2 PRO 31 2.823 13.475 -14.645 259 2HD PRO 31 HD3 PRO 31 4.431 13.913 -14.027 260 H MET 32 H MET 32 2.325 10.386 -10.257 261 HA MET 32 HA MET 32 -0.582 10.805 -10.672 262 1HB MET 32 HB2 MET 32 0.937 8.937 -12.184 263 2HB MET 32 HB3 MET 32 -0.016 8.010 -11.025 264 1HG MET 32 HG2 MET 32 -2.066 9.032 -11.777 265 2HG MET 32 HG3 MET 32 -1.184 10.186 -12.779 266 1HE MET 32 HE1 MET 32 -1.462 6.451 -11.951 267 2HE MET 32 HE2 MET 32 -0.916 5.646 -13.419 268 3HE MET 32 HE3 MET 32 0.221 6.591 -12.449 269 H THR 33 H THR 33 -1.870 9.623 -9.111 270 HA THR 33 HA THR 33 -0.420 9.148 -6.600 271 HB THR 33 HB THR 33 -2.475 10.306 -6.313 272 HG1 THR 33 HG1 THR 33 -3.474 8.971 -4.932 273 1HG2 THR 33 HG21 THR 33 -3.482 8.298 -8.299 274 2HG2 THR 33 HG22 THR 33 -4.624 9.046 -7.182 275 3HG2 THR 33 HG23 THR 33 -3.682 10.050 -8.284 276 H PHE 34 H PHE 34 0.419 7.169 -6.173 277 HA PHE 34 HA PHE 34 -0.738 4.801 -7.546 278 1HB PHE 34 HB2 PHE 34 1.888 5.376 -6.189 279 2HB PHE 34 HB3 PHE 34 1.369 3.711 -6.451 280 HD1 PHE 34 HD1 PHE 34 1.052 2.827 -8.730 281 HD2 PHE 34 HD2 PHE 34 2.485 6.819 -8.047 282 HE1 PHE 34 HE1 PHE 34 1.790 2.967 -11.094 283 HE2 PHE 34 HE2 PHE 34 3.222 6.959 -10.411 284 HZ PHE 34 HZ PHE 34 2.874 5.032 -11.935 285 H ARG 35 H ARG 35 -1.937 3.328 -6.424 286 HA ARG 35 HA ARG 35 -2.111 3.684 -3.465 287 1HB ARG 35 HB2 ARG 35 -4.205 3.916 -4.895 288 2HB ARG 35 HB3 ARG 35 -4.055 2.193 -5.244 289 1HG ARG 35 HG2 ARG 35 -5.182 1.802 -3.332 290 2HG ARG 35 HG3 ARG 35 -3.761 2.384 -2.464 291 1HD ARG 35 HD2 ARG 35 -4.619 4.600 -2.330 292 2HD ARG 35 HD3 ARG 35 -5.869 4.268 -3.530 293 HE ARG 35 HE ARG 35 -6.183 2.530 -1.256 294 1HH1 ARG 35 HH11 ARG 35 -6.222 5.886 -1.949 295 2HH1 ARG 35 HH12 ARG 35 -7.673 6.199 -1.054 296 1HH2 ARG 35 HH21 ARG 35 -8.220 2.865 -0.270 297 2HH2 ARG 35 HH22 ARG 35 -8.804 4.488 -0.104 298 H LEU 36 H LEU 36 -1.752 1.908 -2.113 299 HA LEU 36 HA LEU 36 -0.072 -0.195 -3.097 300 1HB LEU 36 HB2 LEU 36 -1.652 0.015 -0.515 301 2HB LEU 36 HB3 LEU 36 -0.416 -1.202 -0.837 302 HG LEU 36 HG LEU 36 -0.027 1.802 -0.731 303 1HD1 LEU 36 HD11 LEU 36 -0.157 0.465 1.427 304 2HD1 LEU 36 HD12 LEU 36 1.287 -0.394 0.888 305 3HD1 LEU 36 HD13 LEU 36 1.352 1.344 1.180 306 1HD2 LEU 36 HD21 LEU 36 1.490 -0.317 -2.072 307 2HD2 LEU 36 HD22 LEU 36 1.636 1.433 -2.226 308 3HD2 LEU 36 HD23 LEU 36 2.465 0.591 -0.917 309 H LEU 37 H LEU 37 -0.594 -2.197 -3.892 310 HA LEU 37 HA LEU 37 -3.458 -2.770 -4.331 311 1HB LEU 37 HB2 LEU 37 -0.872 -3.782 -5.455 312 2HB LEU 37 HB3 LEU 37 -2.299 -4.814 -5.562 313 HG LEU 37 HG LEU 37 -2.486 -1.927 -6.378 314 1HD1 LEU 37 HD11 LEU 37 -1.038 -4.126 -7.765 315 2HD1 LEU 37 HD12 LEU 37 -2.109 -3.138 -8.760 316 3HD1 LEU 37 HD13 LEU 37 -0.793 -2.382 -7.861 317 1HD2 LEU 37 HD21 LEU 37 -3.871 -4.506 -7.177 318 2HD2 LEU 37 HD22 LEU 37 -4.556 -3.193 -6.222 319 3HD2 LEU 37 HD23 LEU 37 -4.188 -2.943 -7.928 320 H LEU 38 H LEU 38 -4.352 -4.888 -3.806 321 HA LEU 38 HA LEU 38 -4.756 -6.683 -2.360 322 1HB LEU 38 HB2 LEU 38 -1.745 -6.571 -2.384 323 2HB LEU 38 HB3 LEU 38 -2.597 -7.718 -1.350 324 HG LEU 38 HG LEU 38 -3.099 -7.458 -4.326 325 1HD1 LEU 38 HD11 LEU 38 -0.766 -8.207 -3.807 326 2HD1 LEU 38 HD12 LEU 38 -1.443 -9.536 -2.865 327 3HD1 LEU 38 HD13 LEU 38 -1.730 -9.451 -4.603 328 1HD2 LEU 38 HD21 LEU 38 -4.106 -9.177 -2.098 329 2HD2 LEU 38 HD22 LEU 38 -4.968 -8.541 -3.499 330 3HD2 LEU 38 HD23 LEU 38 -3.894 -9.928 -3.680 331 H VAL 39 H VAL 39 -4.070 -3.720 -1.372 332 HA VAL 39 HA VAL 39 -4.512 -4.436 1.468 333 HB VAL 39 HB VAL 39 -2.723 -3.106 2.311 334 1HG1 VAL 39 HG11 VAL 39 -2.102 -5.354 1.364 335 2HG1 VAL 39 HG12 VAL 39 -1.604 -4.534 -0.116 336 3HG1 VAL 39 HG13 VAL 39 -0.766 -4.203 1.400 337 1HG2 VAL 39 HG21 VAL 39 -3.009 -1.262 0.637 338 2HG2 VAL 39 HG22 VAL 39 -1.320 -1.695 0.902 339 3HG2 VAL 39 HG23 VAL 39 -2.157 -2.254 -0.547 340 H ASP 40 H ASP 40 -5.877 -2.986 2.476 341 HA ASP 40 HA ASP 40 -6.482 -0.449 1.016 342 1HB ASP 40 HB2 ASP 40 -8.265 -2.127 0.604 343 2HB ASP 40 HB3 ASP 40 -8.500 -2.285 2.345 344 H THR 41 H THR 41 -6.458 1.327 2.333 345 HA THR 41 HA THR 41 -5.596 1.139 5.051 346 HB THR 41 HB THR 41 -5.138 3.196 3.971 347 HG1 THR 41 HG1 THR 41 -5.676 4.066 5.796 348 1HG2 THR 41 HG21 THR 41 -7.927 2.876 2.995 349 2HG2 THR 41 HG22 THR 41 -7.362 4.528 3.240 350 3HG2 THR 41 HG23 THR 41 -6.495 3.454 2.142 351 HA PRO 42 HA PRO 42 -9.363 0.351 7.198 352 1HB PRO 42 HB2 PRO 42 -8.705 1.459 9.611 353 2HB PRO 42 HB3 PRO 42 -8.021 -0.070 9.031 354 1HG PRO 42 HG2 PRO 42 -6.782 2.659 9.068 355 2HG PRO 42 HG3 PRO 42 -6.030 1.080 9.352 356 1HD PRO 42 HD2 PRO 42 -5.831 2.465 6.969 357 2HD PRO 42 HD3 PRO 42 -5.681 0.698 7.102 358 H GLU 43 H GLU 43 -8.056 3.649 7.178 359 HA GLU 43 HA GLU 43 -10.545 4.855 6.512 360 1HB GLU 43 HB2 GLU 43 -11.146 4.171 8.834 361 2HB GLU 43 HB3 GLU 43 -9.802 5.142 9.439 362 1HG GLU 43 HG2 GLU 43 -10.926 7.091 9.154 363 2HG GLU 43 HG3 GLU 43 -11.573 6.592 7.591 364 H THR 44 H THR 44 -10.053 6.841 5.684 365 HA THR 44 HA THR 44 -8.232 8.707 6.843 366 HB THR 44 HB THR 44 -6.620 8.355 4.680 367 HG1 THR 44 HG1 THR 44 -6.494 6.309 4.136 368 1HG2 THR 44 HG21 THR 44 -6.404 8.195 7.432 369 2HG2 THR 44 HG22 THR 44 -5.827 6.616 6.901 370 3HG2 THR 44 HG23 THR 44 -5.061 8.086 6.296 371 H LYS 45 H LYS 45 -10.645 9.263 5.962 372 HA LYS 45 HA LYS 45 -10.410 10.240 3.155 373 1HB LYS 45 HB2 LYS 45 -12.712 9.579 4.963 374 2HB LYS 45 HB3 LYS 45 -12.953 10.734 3.652 375 1HG LYS 45 HG2 LYS 45 -11.493 8.297 2.866 376 2HG LYS 45 HG3 LYS 45 -13.160 8.016 3.370 377 1HD LYS 45 HD2 LYS 45 -12.229 9.959 1.238 378 2HD LYS 45 HD3 LYS 45 -13.123 8.461 0.974 379 1HE LYS 45 HE2 LYS 45 -14.688 9.788 2.829 380 2HE LYS 45 HE3 LYS 45 -14.106 11.097 1.802 381 1HZ LYS 45 HZ1 LYS 45 -15.400 8.604 0.837 382 2HZ LYS 45 HZ2 LYS 45 -16.157 10.118 0.956 383 3HZ LYS 45 HZ3 LYS 45 -14.872 9.896 -0.133 384 H HIS 46 H HIS 46 -12.214 11.512 5.962 385 HA HIS 46 HA HIS 46 -11.778 14.240 5.167 386 1HB HIS 46 HB2 HIS 46 -13.104 12.815 7.366 387 2HB HIS 46 HB3 HIS 46 -12.411 14.363 7.851 388 HD1 HIS 46 HD1 HIS 46 -15.138 12.858 5.827 389 HD2 HIS 46 HD2 HIS 46 -13.467 16.636 6.389 390 HE1 HIS 46 HE1 HIS 46 -16.758 14.518 4.808 391 HA PRO 47 HA PRO 47 -7.795 14.886 6.993 392 1HB PRO 47 HB2 PRO 47 -7.758 17.602 6.716 393 2HB PRO 47 HB3 PRO 47 -7.562 16.491 5.349 394 1HG PRO 47 HG2 PRO 47 -9.900 18.165 6.089 395 2HG PRO 47 HG3 PRO 47 -9.410 17.556 4.502 396 1HD PRO 47 HD2 PRO 47 -11.450 16.485 6.168 397 2HD PRO 47 HD3 PRO 47 -10.789 15.749 4.692 398 H LYS 48 H LYS 48 -9.155 14.268 9.127 399 HA LYS 48 HA LYS 48 -9.063 16.665 10.918 400 1HB LYS 48 HB2 LYS 48 -10.919 14.270 11.105 401 2HB LYS 48 HB3 LYS 48 -10.857 15.610 12.253 402 1HG LYS 48 HG2 LYS 48 -11.120 16.533 9.493 403 2HG LYS 48 HG3 LYS 48 -12.458 15.490 9.979 404 1HD LYS 48 HD2 LYS 48 -12.451 16.950 12.158 405 2HD LYS 48 HD3 LYS 48 -11.583 18.114 11.157 406 1HE LYS 48 HE2 LYS 48 -14.188 16.851 10.282 407 2HE LYS 48 HE3 LYS 48 -14.126 18.359 11.196 408 1HZ LYS 48 HZ1 LYS 48 -12.649 17.925 8.662 409 2HZ LYS 48 HZ2 LYS 48 -14.195 18.620 8.731 410 3HZ LYS 48 HZ3 LYS 48 -12.883 19.392 9.487 411 H LYS 49 H LYS 49 -6.846 14.949 10.372 412 HA LYS 49 HA LYS 49 -5.138 13.951 11.646 413 1HB LYS 49 HB2 LYS 49 -6.811 15.188 13.578 414 2HB LYS 49 HB3 LYS 49 -6.463 13.562 14.168 415 1HG LYS 49 HG2 LYS 49 -4.355 14.152 14.688 416 2HG LYS 49 HG3 LYS 49 -4.072 14.714 13.040 417 1HD LYS 49 HD2 LYS 49 -5.689 16.697 14.081 418 2HD LYS 49 HD3 LYS 49 -4.678 16.261 15.459 419 1HE LYS 49 HE2 LYS 49 -3.254 16.512 12.875 420 2HE LYS 49 HE3 LYS 49 -3.906 18.015 13.528 421 1HZ LYS 49 HZ1 LYS 49 -2.793 16.721 15.676 422 2HZ LYS 49 HZ2 LYS 49 -1.681 16.480 14.418 423 3HZ LYS 49 HZ3 LYS 49 -2.144 18.057 14.850 424 H GLY 50 H GLY 50 -7.531 12.543 10.365 425 1HA GLY 50 HA2 GLY 50 -8.197 10.311 10.085 426 2HA GLY 50 HA3 GLY 50 -6.758 9.866 11.003 427 H VAL 51 H VAL 51 -8.552 8.214 11.719 428 HA VAL 51 HA VAL 51 -10.422 9.269 13.723 429 HB VAL 51 HB VAL 51 -9.759 6.357 13.298 430 1HG1 VAL 51 HG11 VAL 51 -12.077 7.977 14.324 431 2HG1 VAL 51 HG12 VAL 51 -12.344 6.352 13.694 432 3HG1 VAL 51 HG13 VAL 51 -11.271 6.598 15.072 433 1HG2 VAL 51 HG21 VAL 51 -10.718 8.214 11.320 434 2HG2 VAL 51 HG22 VAL 51 -10.468 6.474 11.163 435 3HG2 VAL 51 HG23 VAL 51 -12.016 7.096 11.736 436 H GLU 52 H GLU 52 -10.112 9.210 15.931 437 HA GLU 52 HA GLU 52 -7.609 9.257 17.112 438 1HB GLU 52 HB2 GLU 52 -10.326 8.522 18.151 439 2HB GLU 52 HB3 GLU 52 -8.925 8.298 19.200 440 1HG GLU 52 HG2 GLU 52 -8.459 10.804 18.171 441 2HG GLU 52 HG3 GLU 52 -10.217 10.788 18.308 442 H LYS 53 H LYS 53 -9.511 6.421 16.252 443 HA LYS 53 HA LYS 53 -8.153 4.438 17.725 444 1HB LYS 53 HB2 LYS 53 -9.882 4.535 15.399 445 2HB LYS 53 HB3 LYS 53 -8.625 3.316 15.190 446 1HG LYS 53 HG2 LYS 53 -10.679 2.436 16.329 447 2HG LYS 53 HG3 LYS 53 -9.215 2.265 17.297 448 1HD LYS 53 HD2 LYS 53 -10.150 3.477 18.942 449 2HD LYS 53 HD3 LYS 53 -10.344 4.838 17.837 450 1HE LYS 53 HE2 LYS 53 -12.356 3.083 17.060 451 2HE LYS 53 HE3 LYS 53 -12.347 2.947 18.818 452 1HZ LYS 53 HZ1 LYS 53 -12.209 5.524 18.687 453 2HZ LYS 53 HZ2 LYS 53 -12.865 5.300 17.136 454 3HZ LYS 53 HZ3 LYS 53 -13.706 4.746 18.506 455 H TYR 54 H TYR 54 -7.473 5.217 14.289 456 HA TYR 54 HA TYR 54 -4.580 5.134 14.853 457 1HB TYR 54 HB2 TYR 54 -5.832 3.205 12.875 458 2HB TYR 54 HB3 TYR 54 -4.116 3.350 13.261 459 HD1 TYR 54 HD1 TYR 54 -3.300 2.766 15.561 460 HD2 TYR 54 HD2 TYR 54 -7.329 1.987 14.290 461 HE1 TYR 54 HE1 TYR 54 -3.592 1.190 17.454 462 HE2 TYR 54 HE2 TYR 54 -7.620 0.410 16.182 463 HH TYR 54 HH TYR 54 -5.556 0.283 18.802 464 H GLY 55 H GLY 55 -5.605 7.408 14.126 465 1HA GLY 55 HA2 GLY 55 -6.011 7.714 11.260 466 2HA GLY 55 HA3 GLY 55 -5.841 9.027 12.426 467 HA PRO 56 HA PRO 56 -1.588 9.522 11.347 468 1HB PRO 56 HB2 PRO 56 -0.389 9.923 13.767 469 2HB PRO 56 HB3 PRO 56 -1.494 11.099 13.032 470 1HG PRO 56 HG2 PRO 56 -1.961 9.249 15.313 471 2HG PRO 56 HG3 PRO 56 -2.708 10.815 14.963 472 1HD PRO 56 HD2 PRO 56 -3.863 8.269 14.499 473 2HD PRO 56 HD3 PRO 56 -4.468 9.827 13.894 474 H GLU 57 H GLU 57 -2.145 6.768 11.325 475 HA GLU 57 HA GLU 57 0.223 5.585 12.716 476 1HB GLU 57 HB2 GLU 57 -2.483 4.488 11.999 477 2HB GLU 57 HB3 GLU 57 -1.113 3.391 12.168 478 1HG GLU 57 HG2 GLU 57 -1.579 5.429 14.312 479 2HG GLU 57 HG3 GLU 57 -2.617 4.003 14.265 480 H ALA 58 H ALA 58 -1.758 4.748 9.846 481 HA ALA 58 HA ALA 58 0.605 3.745 8.460 482 1HB ALA 58 HB1 ALA 58 -2.085 3.254 8.239 483 2HB ALA 58 HB2 ALA 58 -1.803 4.302 6.849 484 3HB ALA 58 HB3 ALA 58 -0.888 2.805 7.025 485 H SER 59 H SER 59 -1.355 6.686 8.370 486 HA SER 59 HA SER 59 -0.288 7.814 5.985 487 1HB SER 59 HB2 SER 59 -0.732 10.011 7.537 488 2HB SER 59 HB3 SER 59 -2.005 9.148 6.675 489 HG SER 59 HG SER 59 -2.022 9.549 9.159 490 H ALA 60 H ALA 60 0.710 8.410 9.378 491 HA ALA 60 HA ALA 60 3.076 9.874 8.616 492 1HB ALA 60 HB1 ALA 60 1.777 9.037 11.066 493 2HB ALA 60 HB2 ALA 60 3.515 8.754 11.165 494 3HB ALA 60 HB3 ALA 60 2.902 10.369 10.809 495 H PHE 61 H PHE 61 2.344 6.485 9.034 496 HA PHE 61 HA PHE 61 4.961 5.454 9.416 497 1HB PHE 61 HB2 PHE 61 2.875 4.101 9.569 498 2HB PHE 61 HB3 PHE 61 2.706 4.212 7.817 499 HD1 PHE 61 HD1 PHE 61 4.690 2.793 10.583 500 HD2 PHE 61 HD2 PHE 61 4.201 3.006 6.321 501 HE1 PHE 61 HE1 PHE 61 6.226 0.865 10.310 502 HE2 PHE 61 HE2 PHE 61 5.736 1.078 6.048 503 HZ PHE 61 HZ PHE 61 6.749 0.008 8.042 504 H THR 62 H THR 62 3.210 5.344 6.316 505 HA THR 62 HA THR 62 5.589 5.017 4.758 506 HB THR 62 HB THR 62 2.837 6.025 3.976 507 HG1 THR 62 HG1 THR 62 2.726 3.934 4.615 508 1HG2 THR 62 HG21 THR 62 5.257 6.142 2.520 509 2HG2 THR 62 HG22 THR 62 4.337 4.794 1.848 510 3HG2 THR 62 HG23 THR 62 3.624 6.406 1.907 511 H LYS 63 H LYS 63 3.953 7.830 6.017 512 HA LYS 63 HA LYS 63 4.897 9.847 4.299 513 1HB LYS 63 HB2 LYS 63 3.333 10.337 6.103 514 2HB LYS 63 HB3 LYS 63 4.552 9.918 7.308 515 1HG LYS 63 HG2 LYS 63 5.952 11.773 6.628 516 2HG LYS 63 HG3 LYS 63 4.885 12.135 5.270 517 1HD LYS 63 HD2 LYS 63 3.035 12.552 6.916 518 2HD LYS 63 HD3 LYS 63 4.211 12.359 8.216 519 1HE LYS 63 HE2 LYS 63 5.090 14.417 7.873 520 2HE LYS 63 HE3 LYS 63 5.103 14.209 6.122 521 1HZ LYS 63 HZ1 LYS 63 2.599 14.686 7.620 522 2HZ LYS 63 HZ2 LYS 63 3.565 15.969 7.065 523 3HZ LYS 63 HZ3 LYS 63 2.888 14.878 5.957 524 H LYS 64 H LYS 64 6.419 9.079 7.430 525 HA LYS 64 HA LYS 64 8.901 10.349 6.729 526 1HB LYS 64 HB2 LYS 64 7.757 9.160 9.035 527 2HB LYS 64 HB3 LYS 64 9.281 8.322 8.737 528 1HG LYS 64 HG2 LYS 64 10.286 10.078 9.736 529 2HG LYS 64 HG3 LYS 64 9.908 10.990 8.275 530 1HD LYS 64 HD2 LYS 64 8.327 12.215 9.329 531 2HD LYS 64 HD3 LYS 64 7.622 10.787 10.088 532 1HE LYS 64 HE2 LYS 64 8.772 11.102 12.018 533 2HE LYS 64 HE3 LYS 64 10.259 11.521 11.167 534 1HZ LYS 64 HZ1 LYS 64 8.871 13.662 10.607 535 2HZ LYS 64 HZ2 LYS 64 8.065 13.246 12.044 536 3HZ LYS 64 HZ3 LYS 64 9.737 13.528 12.062 537 H MET 65 H MET 65 7.613 7.172 6.163 538 HA MET 65 HA MET 65 10.078 5.757 5.802 539 1HB MET 65 HB2 MET 65 7.300 5.210 5.516 540 2HB MET 65 HB3 MET 65 8.080 4.773 3.997 541 1HG MET 65 HG2 MET 65 9.337 3.948 6.597 542 2HG MET 65 HG3 MET 65 7.987 3.017 5.948 543 1HE MET 65 HE1 MET 65 11.372 4.041 6.044 544 2HE MET 65 HE2 MET 65 12.287 3.139 4.828 545 3HE MET 65 HE3 MET 65 11.502 4.657 4.399 546 H VAL 66 H VAL 66 7.877 6.501 3.114 547 HA VAL 66 HA VAL 66 9.867 6.426 1.112 548 HB VAL 66 HB VAL 66 8.245 7.775 -0.255 549 1HG1 VAL 66 HG11 VAL 66 7.483 5.332 1.303 550 2HG1 VAL 66 HG12 VAL 66 6.270 6.086 0.267 551 3HG1 VAL 66 HG13 VAL 66 7.785 5.506 -0.426 552 1HG2 VAL 66 HG21 VAL 66 7.469 8.790 2.183 553 2HG2 VAL 66 HG22 VAL 66 6.529 8.925 0.698 554 3HG2 VAL 66 HG23 VAL 66 6.183 7.631 1.845 555 H GLU 67 H GLU 67 8.957 9.022 3.295 556 HA GLU 67 HA GLU 67 10.260 11.149 1.857 557 1HB GLU 67 HB2 GLU 67 9.318 10.751 4.679 558 2HB GLU 67 HB3 GLU 67 10.354 12.129 4.305 559 1HG GLU 67 HG2 GLU 67 8.319 11.898 2.283 560 2HG GLU 67 HG3 GLU 67 7.560 11.907 3.875 561 H ASN 68 H ASN 68 11.364 8.774 4.214 562 HA ASN 68 HA ASN 68 14.086 9.978 4.133 563 1HB ASN 68 HB2 ASN 68 12.948 7.797 5.908 564 2HB ASN 68 HB3 ASN 68 14.572 8.474 6.034 565 1HD2 ASN 68 HD21 ASN 68 13.345 8.869 8.332 566 2HD2 ASN 68 HD22 ASN 68 12.663 10.414 8.484 567 H ALA 69 H ALA 69 12.413 7.893 2.293 568 HA ALA 69 HA ALA 69 14.207 5.615 2.192 569 1HB ALA 69 HB1 ALA 69 11.762 6.471 0.883 570 2HB ALA 69 HB2 ALA 69 12.908 5.822 -0.291 571 3HB ALA 69 HB3 ALA 69 12.404 4.840 1.084 572 H LYS 70 H LYS 70 15.759 5.165 0.518 573 HA LYS 70 HA LYS 70 16.955 7.639 -0.623 574 1HB LYS 70 HB2 LYS 70 18.024 4.884 -0.021 575 2HB LYS 70 HB3 LYS 70 18.890 5.977 -1.103 576 1HG LYS 70 HG2 LYS 70 18.100 7.456 1.217 577 2HG LYS 70 HG3 LYS 70 18.890 5.972 1.750 578 1HD LYS 70 HD2 LYS 70 20.795 7.189 1.412 579 2HD LYS 70 HD3 LYS 70 20.556 6.697 -0.265 580 1HE LYS 70 HE2 LYS 70 20.915 9.117 -0.158 581 2HE LYS 70 HE3 LYS 70 19.261 8.780 -0.668 582 1HZ LYS 70 HZ1 LYS 70 19.789 9.073 2.196 583 2HZ LYS 70 HZ2 LYS 70 19.780 10.479 1.243 584 3HZ LYS 70 HZ3 LYS 70 18.406 9.481 1.304 585 H LYS 71 H LYS 71 15.531 4.559 -1.527 586 HA LYS 71 HA LYS 71 15.603 5.472 -4.364 587 1HB LYS 71 HB2 LYS 71 16.398 2.758 -3.292 588 2HB LYS 71 HB3 LYS 71 15.943 3.011 -4.978 589 1HG LYS 71 HG2 LYS 71 17.944 4.895 -3.836 590 2HG LYS 71 HG3 LYS 71 18.485 3.242 -4.126 591 1HD LYS 71 HD2 LYS 71 17.668 3.396 -6.461 592 2HD LYS 71 HD3 LYS 71 17.181 5.066 -6.168 593 1HE LYS 71 HE2 LYS 71 19.856 4.875 -5.286 594 2HE LYS 71 HE3 LYS 71 19.795 4.036 -6.835 595 1HZ LYS 71 HZ1 LYS 71 18.339 6.537 -6.717 596 2HZ LYS 71 HZ2 LYS 71 20.023 6.682 -6.580 597 3HZ LYS 71 HZ3 LYS 71 19.345 5.920 -7.938 598 H ILE 72 H ILE 72 13.546 5.564 -5.090 599 HA ILE 72 HA ILE 72 11.526 3.758 -3.826 600 HB ILE 72 HB ILE 72 11.177 6.438 -5.206 601 1HG1 ILE 72 HG12 ILE 72 10.131 6.439 -2.589 602 2HG1 ILE 72 HG13 ILE 72 11.694 5.629 -2.467 603 1HG2 ILE 72 HG21 ILE 72 9.350 4.314 -4.988 604 2HG2 ILE 72 HG22 ILE 72 8.900 5.443 -3.709 605 3HG2 ILE 72 HG23 ILE 72 8.975 5.991 -5.384 606 1HD1 ILE 72 HD11 ILE 72 11.322 8.249 -3.935 607 2HD1 ILE 72 HD12 ILE 72 11.752 8.165 -2.227 608 3HD1 ILE 72 HD13 ILE 72 12.837 7.493 -3.443 609 H GLU 73 H GLU 73 10.884 2.113 -5.136 610 HA GLU 73 HA GLU 73 10.882 2.610 -8.086 611 1HB GLU 73 HB2 GLU 73 11.491 -0.065 -6.813 612 2HB GLU 73 HB3 GLU 73 11.735 0.419 -8.492 613 1HG GLU 73 HG2 GLU 73 13.466 2.010 -7.816 614 2HG GLU 73 HG3 GLU 73 13.187 1.624 -6.118 615 H VAL 74 H VAL 74 8.965 2.147 -9.064 616 HA VAL 74 HA VAL 74 6.800 0.998 -7.409 617 HB VAL 74 HB VAL 74 5.359 1.659 -9.345 618 1HG1 VAL 74 HG11 VAL 74 6.948 3.405 -7.642 619 2HG1 VAL 74 HG12 VAL 74 6.488 4.213 -9.141 620 3HG1 VAL 74 HG13 VAL 74 5.247 3.531 -8.089 621 1HG2 VAL 74 HG21 VAL 74 7.438 1.380 -10.930 622 2HG2 VAL 74 HG22 VAL 74 6.245 2.629 -11.284 623 3HG2 VAL 74 HG23 VAL 74 7.762 3.058 -10.494 624 H GLU 75 H GLU 75 5.646 -0.905 -8.047 625 HA GLU 75 HA GLU 75 7.047 -2.541 -10.125 626 1HB GLU 75 HB2 GLU 75 7.481 -3.374 -7.832 627 2HB GLU 75 HB3 GLU 75 5.743 -3.520 -7.568 628 1HG GLU 75 HG2 GLU 75 5.524 -5.260 -9.143 629 2HG GLU 75 HG3 GLU 75 7.067 -4.882 -9.908 630 H PHE 76 H PHE 76 5.509 -1.942 -11.746 631 HA PHE 76 HA PHE 76 2.670 -2.086 -11.395 632 1HB PHE 76 HB2 PHE 76 4.450 -2.276 -13.834 633 2HB PHE 76 HB3 PHE 76 2.692 -2.353 -13.947 634 HD1 PHE 76 HD1 PHE 76 1.355 -0.438 -12.798 635 HD2 PHE 76 HD2 PHE 76 5.532 -0.194 -13.771 636 HE1 PHE 76 HE1 PHE 76 1.236 2.037 -12.685 637 HE2 PHE 76 HE2 PHE 76 5.412 2.282 -13.659 638 HZ PHE 76 HZ PHE 76 3.265 3.396 -13.116 639 H ASP 77 H ASP 77 1.242 -3.811 -11.677 640 HA ASP 77 HA ASP 77 2.375 -6.490 -11.429 641 1HB ASP 77 HB2 ASP 77 0.083 -5.416 -10.524 642 2HB ASP 77 HB3 ASP 77 -0.520 -6.115 -12.027 643 H LYS 78 H LYS 78 0.703 -8.080 -12.946 644 HA LYS 78 HA LYS 78 1.708 -7.495 -15.675 645 1HB LYS 78 HB2 LYS 78 1.055 -9.850 -16.145 646 2HB LYS 78 HB3 LYS 78 2.163 -9.731 -14.778 647 1HG LYS 78 HG2 LYS 78 -0.679 -9.516 -14.035 648 2HG LYS 78 HG3 LYS 78 -0.234 -11.077 -14.728 649 1HD LYS 78 HD2 LYS 78 1.568 -9.876 -12.662 650 2HD LYS 78 HD3 LYS 78 0.058 -10.616 -12.129 651 1HE LYS 78 HE2 LYS 78 1.287 -12.538 -12.139 652 2HE LYS 78 HE3 LYS 78 0.955 -12.510 -13.870 653 1HZ LYS 78 HZ1 LYS 78 3.099 -10.857 -13.581 654 2HZ LYS 78 HZ2 LYS 78 3.427 -12.112 -12.484 655 3HZ LYS 78 HZ3 LYS 78 3.151 -12.464 -14.123 656 H GLY 79 H GLY 79 -1.187 -7.372 -13.830 657 1HA GLY 79 HA2 GLY 79 -2.984 -7.646 -16.134 658 2HA GLY 79 HA3 GLY 79 -3.463 -7.210 -14.493 659 H GLN 80 H GLN 80 -4.595 -5.317 -14.875 660 HA GLN 80 HA GLN 80 -3.763 -3.314 -16.771 661 1HB GLN 80 HB2 GLN 80 -5.471 -2.717 -14.361 662 2HB GLN 80 HB3 GLN 80 -5.584 -2.047 -15.990 663 1HG GLN 80 HG2 GLN 80 -6.069 -4.525 -16.692 664 2HG GLN 80 HG3 GLN 80 -6.477 -4.739 -14.989 665 1HE2 GLN 80 HE21 GLN 80 -7.169 -2.382 -17.645 666 2HE2 GLN 80 HE22 GLN 80 -8.796 -2.160 -17.216 667 H ARG 81 H ARG 81 -3.317 -0.974 -15.935 668 HA ARG 81 HA ARG 81 -1.403 -1.125 -13.640 669 1HB ARG 81 HB2 ARG 81 -1.097 0.560 -16.142 670 2HB ARG 81 HB3 ARG 81 0.062 0.421 -14.819 671 1HG ARG 81 HG2 ARG 81 0.817 -1.616 -15.519 672 2HG ARG 81 HG3 ARG 81 -0.785 -2.142 -16.036 673 1HD ARG 81 HD2 ARG 81 0.349 -1.910 -18.076 674 2HD ARG 81 HD3 ARG 81 -0.484 -0.363 -17.927 675 HE ARG 81 HE ARG 81 1.832 0.336 -16.828 676 1HH1 ARG 81 HH11 ARG 81 1.659 0.961 -19.674 677 2HH1 ARG 81 HH12 ARG 81 2.978 0.075 -20.366 678 1HH2 ARG 81 HH21 ARG 81 3.364 -2.008 -17.619 679 2HH2 ARG 81 HH22 ARG 81 3.943 -1.606 -19.201 680 H THR 82 H THR 82 -4.287 0.119 -14.589 681 HA THR 82 HA THR 82 -4.089 2.305 -12.621 682 HB THR 82 HB THR 82 -5.085 3.957 -14.207 683 HG1 THR 82 HG1 THR 82 -5.950 2.565 -15.718 684 1HG2 THR 82 HG21 THR 82 -2.533 3.547 -13.787 685 2HG2 THR 82 HG22 THR 82 -2.542 2.943 -15.444 686 3HG2 THR 82 HG23 THR 82 -3.030 4.604 -15.107 687 H ASP 83 H ASP 83 -6.192 2.958 -11.851 688 HA ASP 83 HA ASP 83 -8.272 0.909 -12.385 689 1HB ASP 83 HB2 ASP 83 -9.324 1.696 -10.337 690 2HB ASP 83 HB3 ASP 83 -7.608 1.423 -10.027 691 H LYS 84 H LYS 84 -10.520 2.461 -11.623 692 HA LYS 84 HA LYS 84 -11.104 3.765 -14.148 693 1HB LYS 84 HB2 LYS 84 -13.296 4.245 -13.122 694 2HB LYS 84 HB3 LYS 84 -12.837 2.562 -12.863 695 1HG LYS 84 HG2 LYS 84 -12.107 3.043 -10.604 696 2HG LYS 84 HG3 LYS 84 -12.346 4.773 -10.850 697 1HD LYS 84 HD2 LYS 84 -14.446 4.508 -10.078 698 2HD LYS 84 HD3 LYS 84 -14.798 3.594 -11.545 699 1HE LYS 84 HE2 LYS 84 -15.299 1.940 -10.043 700 2HE LYS 84 HE3 LYS 84 -13.557 1.672 -10.104 701 1HZ LYS 84 HZ1 LYS 84 -14.376 3.732 -8.261 702 2HZ LYS 84 HZ2 LYS 84 -14.954 2.188 -7.863 703 3HZ LYS 84 HZ3 LYS 84 -13.286 2.448 -8.043 704 H TYR 85 H TYR 85 -9.796 4.822 -11.137 705 HA TYR 85 HA TYR 85 -10.537 7.640 -11.640 706 1HB TYR 85 HB2 TYR 85 -8.930 6.372 -9.403 707 2HB TYR 85 HB3 TYR 85 -9.406 8.069 -9.478 708 HD1 TYR 85 HD1 TYR 85 -12.086 8.224 -10.260 709 HD2 TYR 85 HD2 TYR 85 -10.229 5.131 -7.928 710 HE1 TYR 85 HE1 TYR 85 -14.286 7.651 -9.267 711 HE2 TYR 85 HE2 TYR 85 -12.429 4.558 -6.936 712 HH TYR 85 HH TYR 85 -15.169 6.569 -7.259 713 H GLY 86 H GLY 86 -8.262 5.632 -12.865 714 1HA GLY 86 HA2 GLY 86 -6.389 6.219 -14.198 715 2HA GLY 86 HA3 GLY 86 -6.535 7.876 -13.617 716 H ARG 87 H ARG 87 -6.658 6.149 -10.865 717 HA ARG 87 HA ARG 87 -4.062 6.894 -9.973 718 1HB ARG 87 HB2 ARG 87 -5.594 4.559 -8.827 719 2HB ARG 87 HB3 ARG 87 -4.554 5.707 -7.984 720 1HG ARG 87 HG2 ARG 87 -6.555 7.252 -9.244 721 2HG ARG 87 HG3 ARG 87 -7.386 5.881 -8.507 722 1HD ARG 87 HD2 ARG 87 -5.351 6.908 -6.720 723 2HD ARG 87 HD3 ARG 87 -6.462 8.193 -7.195 724 HE ARG 87 HE ARG 87 -7.807 7.160 -5.536 725 1HH1 ARG 87 HH11 ARG 87 -5.822 4.694 -6.626 726 2HH1 ARG 87 HH12 ARG 87 -7.017 3.444 -6.530 727 1HH2 ARG 87 HH21 ARG 87 -9.631 5.627 -5.879 728 2HH2 ARG 87 HH22 ARG 87 -9.174 3.973 -6.108 729 H GLY 88 H GLY 88 -2.114 5.752 -9.885 730 1HA GLY 88 HA2 GLY 88 -1.878 3.497 -11.761 731 2HA GLY 88 HA3 GLY 88 -0.542 4.314 -10.950 732 H LEU 89 H LEU 89 -1.819 1.381 -11.134 733 HA LEU 89 HA LEU 89 -1.715 0.830 -8.204 734 1HB LEU 89 HB2 LEU 89 -2.649 -0.960 -10.468 735 2HB LEU 89 HB3 LEU 89 -2.778 -1.308 -8.744 736 HG LEU 89 HG LEU 89 -4.034 1.126 -10.034 737 1HD1 LEU 89 HD11 LEU 89 -4.970 -1.696 -9.796 738 2HD1 LEU 89 HD12 LEU 89 -6.145 -0.425 -9.458 739 3HD1 LEU 89 HD13 LEU 89 -5.341 -0.489 -11.028 740 1HD2 LEU 89 HD21 LEU 89 -4.189 -0.221 -7.333 741 2HD2 LEU 89 HD22 LEU 89 -3.800 1.460 -7.695 742 3HD2 LEU 89 HD23 LEU 89 -5.453 0.876 -7.890 743 H ALA 90 H ALA 90 0.188 0.064 -7.446 744 HA ALA 90 HA ALA 90 1.629 -2.068 -8.754 745 1HB ALA 90 HB1 ALA 90 2.635 0.758 -9.037 746 2HB ALA 90 HB2 ALA 90 3.764 -0.596 -8.995 747 3HB ALA 90 HB3 ALA 90 2.541 -0.507 -10.262 748 H TYR 91 H TYR 91 3.471 -2.770 -7.434 749 HA TYR 91 HA TYR 91 3.071 -2.139 -4.601 750 1HB TYR 91 HB2 TYR 91 5.252 -3.867 -5.787 751 2HB TYR 91 HB3 TYR 91 4.571 -3.949 -4.163 752 HD1 TYR 91 HD1 TYR 91 2.275 -4.819 -3.801 753 HD2 TYR 91 HD2 TYR 91 4.126 -4.860 -7.677 754 HE1 TYR 91 HE1 TYR 91 0.565 -6.429 -4.602 755 HE2 TYR 91 HE2 TYR 91 2.417 -6.469 -8.477 756 HH TYR 91 HH TYR 91 -0.155 -6.986 -7.640 757 H ILE 92 H ILE 92 4.105 -0.466 -3.627 758 HA ILE 92 HA ILE 92 6.370 0.835 -4.969 759 HB ILE 92 HB ILE 92 5.027 1.453 -2.319 760 1HG1 ILE 92 HG12 ILE 92 4.672 2.619 -5.101 761 2HG1 ILE 92 HG13 ILE 92 3.483 1.671 -4.209 762 1HG2 ILE 92 HG21 ILE 92 7.467 2.372 -3.420 763 2HG2 ILE 92 HG22 ILE 92 6.301 3.676 -3.646 764 3HG2 ILE 92 HG23 ILE 92 6.604 3.033 -2.031 765 1HD1 ILE 92 HD11 ILE 92 4.603 4.114 -2.898 766 2HD1 ILE 92 HD12 ILE 92 3.411 4.330 -4.179 767 3HD1 ILE 92 HD13 ILE 92 3.001 3.394 -2.741 768 H TYR 93 H TYR 93 8.500 0.789 -4.270 769 HA TYR 93 HA TYR 93 9.082 -0.969 -1.917 770 1HB TYR 93 HB2 TYR 93 10.397 -0.811 -4.627 771 2HB TYR 93 HB3 TYR 93 11.278 -1.422 -3.228 772 HD1 TYR 93 HD1 TYR 93 8.380 -1.981 -5.455 773 HD2 TYR 93 HD2 TYR 93 10.718 -3.542 -2.208 774 HE1 TYR 93 HE1 TYR 93 7.265 -4.180 -5.711 775 HE2 TYR 93 HE2 TYR 93 9.603 -5.743 -2.464 776 HH TYR 93 HH TYR 93 8.244 -6.976 -3.749 777 H ALA 94 H ALA 94 10.275 0.021 -0.356 778 HA ALA 94 HA ALA 94 11.867 2.429 -1.136 779 1HB ALA 94 HB1 ALA 94 10.080 2.014 1.270 780 2HB ALA 94 HB2 ALA 94 11.304 3.282 1.204 781 3HB ALA 94 HB3 ALA 94 9.971 3.281 0.049 782 H ASP 95 H ASP 95 13.981 2.287 -0.530 783 HA ASP 95 HA ASP 95 15.921 1.502 0.534 784 1HB ASP 95 HB2 ASP 95 13.789 1.218 2.592 785 2HB ASP 95 HB3 ASP 95 15.273 0.303 2.864 786 H GLY 96 H GLY 96 13.918 -0.281 -1.066 787 1HA GLY 96 HA2 GLY 96 14.263 -2.445 -1.980 788 2HA GLY 96 HA3 GLY 96 15.509 -2.728 -0.764 789 H LYS 97 H LYS 97 12.379 -1.550 0.216 790 HA LYS 97 HA LYS 97 11.674 -4.293 1.176 791 1HB LYS 97 HB2 LYS 97 12.615 -2.838 3.007 792 2HB LYS 97 HB3 LYS 97 11.266 -1.732 2.746 793 1HG LYS 97 HG2 LYS 97 9.864 -3.046 3.923 794 2HG LYS 97 HG3 LYS 97 10.333 -4.471 2.995 795 1HD LYS 97 HD2 LYS 97 11.825 -3.303 5.363 796 2HD LYS 97 HD3 LYS 97 10.906 -4.808 5.348 797 1HE LYS 97 HE2 LYS 97 12.772 -4.851 3.168 798 2HE LYS 97 HE3 LYS 97 13.637 -4.431 4.647 799 1HZ LYS 97 HZ1 LYS 97 11.984 -6.407 5.457 800 2HZ LYS 97 HZ2 LYS 97 12.395 -6.912 3.887 801 3HZ LYS 97 HZ3 LYS 97 13.615 -6.615 5.027 802 H MET 98 H MET 98 9.644 -4.869 0.555 803 HA MET 98 HA MET 98 7.994 -3.233 -1.063 804 1HB MET 98 HB2 MET 98 7.727 -5.653 -1.041 805 2HB MET 98 HB3 MET 98 7.259 -5.619 0.660 806 1HG MET 98 HG2 MET 98 5.120 -5.373 0.000 807 2HG MET 98 HG3 MET 98 5.552 -3.785 -0.632 808 1HE MET 98 HE1 MET 98 6.509 -7.235 -1.132 809 2HE MET 98 HE2 MET 98 5.087 -7.774 -2.023 810 3HE MET 98 HE3 MET 98 6.617 -7.503 -2.871 811 H VAL 99 H VAL 99 7.396 -1.242 -0.241 812 HA VAL 99 HA VAL 99 6.862 -0.490 2.375 813 HB VAL 99 HB VAL 99 5.262 0.390 -0.049 814 1HG1 VAL 99 HG11 VAL 99 5.144 1.090 2.725 815 2HG1 VAL 99 HG12 VAL 99 5.792 2.468 1.834 816 3HG1 VAL 99 HG13 VAL 99 4.230 1.781 1.385 817 1HG2 VAL 99 HG21 VAL 99 7.920 1.320 1.078 818 2HG2 VAL 99 HG22 VAL 99 7.621 0.645 -0.523 819 3HG2 VAL 99 HG23 VAL 99 6.988 2.237 -0.105 820 H ASN 100 H ASN 100 4.619 -2.068 0.105 821 HA ASN 100 HA ASN 100 2.290 -2.011 1.704 822 1HB ASN 100 HB2 ASN 100 3.219 -4.239 -0.136 823 2HB ASN 100 HB3 ASN 100 1.565 -3.981 0.419 824 1HD2 ASN 100 HD21 ASN 100 0.645 -3.464 -1.646 825 2HD2 ASN 100 HD22 ASN 100 1.086 -2.082 -2.526 826 H GLU 101 H GLU 101 4.913 -4.433 1.632 827 HA GLU 101 HA GLU 101 3.789 -6.131 3.640 828 1HB GLU 101 HB2 GLU 101 5.674 -6.743 2.089 829 2HB GLU 101 HB3 GLU 101 6.731 -5.711 3.053 830 1HG GLU 101 HG2 GLU 101 6.361 -7.057 5.025 831 2HG GLU 101 HG3 GLU 101 5.117 -8.001 4.205 832 H ALA 102 H ALA 102 5.781 -3.228 3.823 833 HA ALA 102 HA ALA 102 6.559 -3.418 6.548 834 1HB ALA 102 HB1 ALA 102 6.129 -1.137 4.647 835 2HB ALA 102 HB2 ALA 102 6.407 -0.792 6.354 836 3HB ALA 102 HB3 ALA 102 7.619 -1.673 5.422 837 H LEU 103 H LEU 103 3.683 -1.885 5.107 838 HA LEU 103 HA LEU 103 2.511 -1.063 7.580 839 1HB LEU 103 HB2 LEU 103 1.127 -1.830 4.990 840 2HB LEU 103 HB3 LEU 103 0.414 -0.890 6.301 841 HG LEU 103 HG LEU 103 2.922 0.303 5.615 842 1HD1 LEU 103 HD11 LEU 103 2.488 -0.930 3.431 843 2HD1 LEU 103 HD12 LEU 103 1.044 0.067 3.251 844 3HD1 LEU 103 HD13 LEU 103 2.637 0.822 3.290 845 1HD2 LEU 103 HD21 LEU 103 0.165 0.989 6.082 846 2HD2 LEU 103 HD22 LEU 103 1.588 2.027 6.182 847 3HD2 LEU 103 HD23 LEU 103 0.738 1.843 4.648 848 H VAL 104 H VAL 104 2.118 -4.047 5.667 849 HA VAL 104 HA VAL 104 0.132 -5.255 7.303 850 HB VAL 104 HB VAL 104 2.371 -6.693 5.850 851 1HG1 VAL 104 HG11 VAL 104 0.775 -7.916 7.469 852 2HG1 VAL 104 HG12 VAL 104 -0.482 -7.582 6.279 853 3HG1 VAL 104 HG13 VAL 104 0.914 -8.563 5.835 854 1HG2 VAL 104 HG21 VAL 104 0.102 -5.094 4.873 855 2HG2 VAL 104 HG22 VAL 104 1.532 -5.658 4.009 856 3HG2 VAL 104 HG23 VAL 104 0.146 -6.729 4.214 857 H ARG 105 H ARG 105 3.630 -5.021 7.679 858 HA ARG 105 HA ARG 105 3.846 -6.958 9.804 859 1HB ARG 105 HB2 ARG 105 5.603 -5.249 8.364 860 2HB ARG 105 HB3 ARG 105 5.808 -4.872 10.075 861 1HG ARG 105 HG2 ARG 105 5.595 -7.728 9.726 862 2HG ARG 105 HG3 ARG 105 6.860 -7.092 8.676 863 1HD ARG 105 HD2 ARG 105 7.787 -7.651 10.882 864 2HD ARG 105 HD3 ARG 105 7.859 -5.909 10.609 865 HE ARG 105 HE ARG 105 5.687 -5.840 11.999 866 1HH1 ARG 105 HH11 ARG 105 5.913 -8.936 12.257 867 2HH1 ARG 105 HH12 ARG 105 6.481 -9.059 13.888 868 1HH2 ARG 105 HH21 ARG 105 7.361 -5.713 14.114 869 2HH2 ARG 105 HH22 ARG 105 7.301 -7.234 14.940 870 H GLN 106 H GLN 106 3.256 -3.463 9.715 871 HA GLN 106 HA GLN 106 3.111 -3.376 12.668 872 1HB GLN 106 HB2 GLN 106 3.700 -1.489 10.621 873 2HB GLN 106 HB3 GLN 106 2.232 -0.938 11.431 874 1HG GLN 106 HG2 GLN 106 3.891 -0.008 12.785 875 2HG GLN 106 HG3 GLN 106 3.553 -1.523 13.625 876 1HE2 GLN 106 HE21 GLN 106 5.301 -2.945 13.905 877 2HE2 GLN 106 HE22 GLN 106 6.804 -2.779 13.135 878 H GLY 107 H GLY 107 1.117 -4.676 10.606 879 1HA GLY 107 HA2 GLY 107 -1.217 -4.886 10.401 880 2HA GLY 107 HA3 GLY 107 -1.220 -4.535 12.130 881 H LEU 108 H LEU 108 -0.718 -2.707 9.087 882 HA LEU 108 HA LEU 108 -2.497 -0.594 10.242 883 1HB LEU 108 HB2 LEU 108 -0.070 -0.338 8.445 884 2HB LEU 108 HB3 LEU 108 -1.198 0.986 8.742 885 HG LEU 108 HG LEU 108 0.329 -0.515 10.891 886 1HD1 LEU 108 HD11 LEU 108 0.929 1.871 9.255 887 2HD1 LEU 108 HD12 LEU 108 1.147 2.094 10.991 888 3HD1 LEU 108 HD13 LEU 108 2.023 0.814 10.148 889 1HD2 LEU 108 HD21 LEU 108 -1.582 1.836 10.935 890 2HD2 LEU 108 HD22 LEU 108 -1.753 0.298 11.779 891 3HD2 LEU 108 HD23 LEU 108 -0.511 1.445 12.281 892 H ALA 109 H ALA 109 -1.692 -2.577 7.471 893 HA ALA 109 HA ALA 109 -4.026 -1.391 6.021 894 1HB ALA 109 HB1 ALA 109 -1.434 -1.630 5.116 895 2HB ALA 109 HB2 ALA 109 -2.190 -3.083 4.462 896 3HB ALA 109 HB3 ALA 109 -2.854 -1.494 4.078 897 H LYS 110 H LYS 110 -5.623 -2.813 5.284 898 HA LYS 110 HA LYS 110 -5.402 -5.596 6.333 899 1HB LYS 110 HB2 LYS 110 -7.727 -3.790 5.685 900 2HB LYS 110 HB3 LYS 110 -7.951 -5.536 5.809 901 1HG LYS 110 HG2 LYS 110 -7.444 -5.581 8.077 902 2HG LYS 110 HG3 LYS 110 -6.470 -4.113 7.992 903 1HD LYS 110 HD2 LYS 110 -8.377 -3.287 9.024 904 2HD LYS 110 HD3 LYS 110 -8.786 -3.006 7.331 905 1HE LYS 110 HE2 LYS 110 -9.882 -5.308 7.347 906 2HE LYS 110 HE3 LYS 110 -9.698 -5.283 9.101 907 1HZ LYS 110 HZ1 LYS 110 -10.809 -2.853 8.085 908 2HZ LYS 110 HZ2 LYS 110 -11.763 -4.202 7.688 909 3HZ LYS 110 HZ3 LYS 110 -11.389 -3.878 9.310 910 H VAL 111 H VAL 111 -5.136 -7.231 4.895 911 HA VAL 111 HA VAL 111 -4.742 -6.842 2.126 912 HB VAL 111 HB VAL 111 -5.616 -9.344 3.602 913 1HG1 VAL 111 HG11 VAL 111 -5.209 -8.782 0.768 914 2HG1 VAL 111 HG12 VAL 111 -4.132 -10.052 1.349 915 3HG1 VAL 111 HG13 VAL 111 -5.876 -10.222 1.537 916 1HG2 VAL 111 HG21 VAL 111 -2.890 -8.351 2.706 917 2HG2 VAL 111 HG22 VAL 111 -3.471 -8.390 4.370 918 3HG2 VAL 111 HG23 VAL 111 -3.207 -9.897 3.493 919 H ALA 112 H ALA 112 -6.140 -6.659 0.420 920 HA ALA 112 HA ALA 112 -8.784 -7.808 0.390 921 1HB ALA 112 HB1 ALA 112 -9.105 -5.889 1.999 922 2HB ALA 112 HB2 ALA 112 -8.688 -4.792 0.683 923 3HB ALA 112 HB3 ALA 112 -10.128 -5.804 0.564 924 H TYR 113 H TYR 113 -10.076 -6.575 -1.520 925 HA TYR 113 HA TYR 113 -10.099 -6.091 -3.814 926 1HB TYR 113 HB2 TYR 113 -7.467 -4.829 -3.014 927 2HB TYR 113 HB3 TYR 113 -8.109 -4.734 -4.653 928 HD1 TYR 113 HD1 TYR 113 -10.862 -4.252 -4.520 929 HD2 TYR 113 HD2 TYR 113 -7.842 -2.893 -1.786 930 HE1 TYR 113 HE1 TYR 113 -12.324 -2.368 -3.842 931 HE2 TYR 113 HE2 TYR 113 -9.303 -1.007 -1.108 932 HH TYR 113 HH TYR 113 -12.332 -0.341 -2.772 933 H VAL 114 H VAL 114 -9.945 -8.460 -4.123 934 HA VAL 114 HA VAL 114 -7.254 -9.320 -5.102 935 HB VAL 114 HB VAL 114 -9.618 -10.960 -4.139 936 1HG1 VAL 114 HG11 VAL 114 -7.446 -11.630 -5.904 937 2HG1 VAL 114 HG12 VAL 114 -7.252 -12.506 -4.385 938 3HG1 VAL 114 HG13 VAL 114 -8.743 -12.669 -5.312 939 1HG2 VAL 114 HG21 VAL 114 -6.836 -10.507 -3.014 940 2HG2 VAL 114 HG22 VAL 114 -8.339 -9.880 -2.337 941 3HG2 VAL 114 HG23 VAL 114 -8.033 -11.616 -2.344 942 H TYR 115 H TYR 115 -7.542 -8.406 -7.213 943 HA TYR 115 HA TYR 115 -9.684 -9.727 -8.832 944 1HB TYR 115 HB2 TYR 115 -8.324 -7.045 -9.210 945 2HB TYR 115 HB3 TYR 115 -9.426 -7.768 -10.381 946 HD1 TYR 115 HD1 TYR 115 -11.728 -8.624 -9.345 947 HD2 TYR 115 HD2 TYR 115 -9.216 -5.606 -7.605 948 HE1 TYR 115 HE1 TYR 115 -13.666 -7.747 -8.070 949 HE2 TYR 115 HE2 TYR 115 -11.154 -4.728 -6.330 950 HH TYR 115 HH TYR 115 -14.296 -5.447 -7.039 951 H LYS 116 H LYS 116 -8.474 -11.534 -9.490 952 HA LYS 116 HA LYS 116 -5.759 -11.407 -10.401 953 1HB LYS 116 HB2 LYS 116 -6.368 -13.616 -11.536 954 2HB LYS 116 HB3 LYS 116 -6.617 -13.555 -9.792 955 1HG LYS 116 HG2 LYS 116 -8.984 -12.571 -11.055 956 2HG LYS 116 HG3 LYS 116 -8.547 -14.097 -11.824 957 1HD LYS 116 HD2 LYS 116 -9.175 -15.274 -10.008 958 2HD LYS 116 HD3 LYS 116 -8.195 -14.260 -8.949 959 1HE LYS 116 HE2 LYS 116 -9.987 -13.053 -8.280 960 2HE LYS 116 HE3 LYS 116 -10.581 -12.880 -9.932 961 1HZ LYS 116 HZ1 LYS 116 -10.822 -15.557 -8.965 962 2HZ LYS 116 HZ2 LYS 116 -11.668 -14.454 -7.989 963 3HZ LYS 116 HZ3 LYS 116 -12.002 -14.545 -9.649 964 HA PRO 117 HA PRO 117 -4.724 -12.723 -11.899 965 1HB PRO 117 HB2 PRO 117 -2.772 -12.048 -13.682 966 2HB PRO 117 HB3 PRO 117 -4.038 -13.234 -14.042 967 1HG PRO 117 HG2 PRO 117 -3.753 -10.436 -15.012 968 2HG PRO 117 HG3 PRO 117 -4.521 -11.826 -15.795 969 1HD PRO 117 HD2 PRO 117 -5.859 -9.734 -14.446 970 2HD PRO 117 HD3 PRO 117 -6.571 -11.286 -14.940 971 H ASN 118 H ASN 118 -5.300 -9.598 -11.496 972 HA ASN 118 HA ASN 118 -2.609 -8.599 -10.900 973 1HB ASN 118 HB2 ASN 118 -5.373 -7.518 -10.866 974 2HB ASN 118 HB3 ASN 118 -4.254 -6.815 -9.697 975 1HD2 ASN 118 HD21 ASN 118 -5.245 -5.314 -11.948 976 2HD2 ASN 118 HD22 ASN 118 -3.937 -4.989 -12.980 977 H ASN 119 H ASN 119 -2.222 -10.532 -9.433 978 HA ASN 119 HA ASN 119 -2.595 -9.703 -6.662 979 1HB ASN 119 HB2 ASN 119 -3.744 -11.808 -5.971 980 2HB ASN 119 HB3 ASN 119 -4.750 -10.810 -7.024 981 1HD2 ASN 119 HD21 ASN 119 -5.725 -13.185 -7.280 982 2HD2 ASN 119 HD22 ASN 119 -5.095 -14.088 -8.572 983 H THR 120 H THR 120 -0.487 -10.440 -8.673 984 HA THR 120 HA THR 120 0.733 -12.900 -8.319 985 HB THR 120 HB THR 120 1.951 -10.137 -8.476 986 HG1 THR 120 HG1 THR 120 2.566 -11.451 -10.548 987 1HG2 THR 120 HG21 THR 120 3.241 -12.799 -8.084 988 2HG2 THR 120 HG22 THR 120 3.995 -11.683 -9.223 989 3HG2 THR 120 HG23 THR 120 3.767 -11.205 -7.541 990 H HIS 121 H HIS 121 1.119 -10.077 -6.150 991 HA HIS 121 HA HIS 121 2.483 -11.804 -4.175 992 1HB HIS 121 HB2 HIS 121 1.906 -8.838 -4.305 993 2HB HIS 121 HB3 HIS 121 2.606 -9.607 -2.880 994 HD1 HIS 121 HD1 HIS 121 4.699 -11.406 -3.804 995 HD2 HIS 121 HD2 HIS 121 3.961 -7.845 -5.842 996 HE1 HIS 121 HE1 HIS 121 6.801 -10.884 -5.117 997 H GLU 122 H GLU 122 -0.080 -12.713 -4.484 998 HA GLU 122 HA GLU 122 -1.795 -11.439 -2.451 999 1HB GLU 122 HB2 GLU 122 -2.663 -12.498 -4.612 1000 2HB GLU 122 HB3 GLU 122 -2.298 -14.060 -3.877 1001 1HG GLU 122 HG2 GLU 122 -3.830 -12.165 -2.185 1002 2HG GLU 122 HG3 GLU 122 -4.688 -12.810 -3.585 1003 H GLN 123 H GLN 123 -0.173 -14.588 -2.928 1004 HA GLN 123 HA GLN 123 -0.855 -15.634 -0.346 1005 1HB GLN 123 HB2 GLN 123 1.530 -16.268 -2.114 1006 2HB GLN 123 HB3 GLN 123 0.971 -17.249 -0.760 1007 1HG GLN 123 HG2 GLN 123 -1.279 -16.742 -2.436 1008 2HG GLN 123 HG3 GLN 123 0.046 -17.282 -3.469 1009 1HE2 GLN 123 HE21 GLN 123 -2.490 -18.712 -2.385 1010 2HE2 GLN 123 HE22 GLN 123 -1.882 -20.156 -1.734 1011 H LEU 124 H LEU 124 1.783 -13.605 -1.510 1012 HA LEU 124 HA LEU 124 3.438 -13.783 0.824 1013 1HB LEU 124 HB2 LEU 124 3.766 -12.664 -1.609 1014 2HB LEU 124 HB3 LEU 124 3.354 -11.219 -0.685 1015 HG LEU 124 HG LEU 124 5.731 -11.424 -0.553 1016 1HD1 LEU 124 HD11 LEU 124 4.521 -10.967 1.600 1017 2HD1 LEU 124 HD12 LEU 124 4.623 -12.688 1.970 1018 3HD1 LEU 124 HD13 LEU 124 6.096 -11.729 1.828 1019 1HD2 LEU 124 HD21 LEU 124 5.366 -14.054 -1.086 1020 2HD2 LEU 124 HD22 LEU 124 6.878 -13.406 -0.451 1021 3HD2 LEU 124 HD23 LEU 124 5.708 -14.145 0.642 1022 H LEU 125 H LEU 125 1.230 -11.135 -0.176 1023 HA LEU 125 HA LEU 125 1.334 -9.791 2.348 1024 1HB LEU 125 HB2 LEU 125 -0.535 -9.723 -0.005 1025 2HB LEU 125 HB3 LEU 125 -0.964 -8.866 1.476 1026 HG LEU 125 HG LEU 125 1.598 -8.496 -0.104 1027 1HD1 LEU 125 HD11 LEU 125 -0.452 -7.523 -1.144 1028 2HD1 LEU 125 HD12 LEU 125 -0.745 -6.620 0.344 1029 3HD1 LEU 125 HD13 LEU 125 0.692 -6.286 -0.622 1030 1HD2 LEU 125 HD21 LEU 125 0.833 -7.848 2.634 1031 2HD2 LEU 125 HD22 LEU 125 2.412 -7.723 1.858 1032 3HD2 LEU 125 HD23 LEU 125 1.252 -6.402 1.718 1033 H ARG 126 H ARG 126 -0.296 -12.653 1.359 1034 HA ARG 126 HA ARG 126 -2.488 -12.493 3.256 1035 1HB ARG 126 HB2 ARG 126 -1.510 -14.375 1.258 1036 2HB ARG 126 HB3 ARG 126 -2.031 -15.199 2.729 1037 1HG ARG 126 HG2 ARG 126 -4.030 -13.355 2.410 1038 2HG ARG 126 HG3 ARG 126 -3.630 -13.727 0.733 1039 1HD ARG 126 HD2 ARG 126 -5.325 -15.294 1.448 1040 2HD ARG 126 HD3 ARG 126 -3.803 -16.173 1.315 1041 HE ARG 126 HE ARG 126 -4.276 -15.141 3.998 1042 1HH1 ARG 126 HH11 ARG 126 -6.695 -16.807 3.231 1043 2HH1 ARG 126 HH12 ARG 126 -6.215 -18.379 3.780 1044 1HH2 ARG 126 HH21 ARG 126 -2.862 -17.544 4.072 1045 2HH2 ARG 126 HH22 ARG 126 -4.046 -18.796 4.255 1046 H LYS 127 H LYS 127 0.523 -14.437 3.205 1047 HA LYS 127 HA LYS 127 0.245 -15.492 5.828 1048 1HB LYS 127 HB2 LYS 127 1.883 -16.447 4.344 1049 2HB LYS 127 HB3 LYS 127 2.705 -14.897 4.166 1050 1HG LYS 127 HG2 LYS 127 4.009 -16.149 5.729 1051 2HG LYS 127 HG3 LYS 127 3.109 -14.975 6.688 1052 1HD LYS 127 HD2 LYS 127 1.476 -17.301 6.381 1053 2HD LYS 127 HD3 LYS 127 3.076 -17.820 6.913 1054 1HE LYS 127 HE2 LYS 127 2.210 -15.432 8.333 1055 2HE LYS 127 HE3 LYS 127 1.059 -16.753 8.532 1056 1HZ LYS 127 HZ1 LYS 127 3.988 -17.010 8.942 1057 2HZ LYS 127 HZ2 LYS 127 2.867 -16.756 10.193 1058 3HZ LYS 127 HZ3 LYS 127 2.805 -18.182 9.277 1059 H SER 128 H SER 128 1.880 -12.545 4.697 1060 HA SER 128 HA SER 128 2.912 -11.713 7.209 1061 1HB SER 128 HB2 SER 128 2.030 -10.157 4.772 1062 2HB SER 128 HB3 SER 128 2.746 -9.376 6.180 1063 HG SER 128 HG SER 128 3.935 -11.562 4.817 1064 H GLU 129 H GLU 129 -0.279 -11.228 5.734 1065 HA GLU 129 HA GLU 129 -1.272 -9.412 7.719 1066 1HB GLU 129 HB2 GLU 129 -2.363 -9.787 5.516 1067 2HB GLU 129 HB3 GLU 129 -2.823 -11.407 6.041 1068 1HG GLU 129 HG2 GLU 129 -3.697 -9.810 8.128 1069 2HG GLU 129 HG3 GLU 129 -4.033 -8.823 6.705 1070 H ALA 130 H ALA 130 -1.596 -12.963 7.405 1071 HA ALA 130 HA ALA 130 -3.128 -13.416 9.728 1072 1HB ALA 130 HB1 ALA 130 -1.433 -15.000 7.961 1073 2HB ALA 130 HB2 ALA 130 -1.354 -15.564 9.629 1074 3HB ALA 130 HB3 ALA 130 -2.910 -15.466 8.805 1075 H GLN 131 H GLN 131 0.373 -13.012 9.376 1076 HA GLN 131 HA GLN 131 1.036 -13.632 12.097 1077 1HB GLN 131 HB2 GLN 131 2.725 -13.524 10.285 1078 2HB GLN 131 HB3 GLN 131 2.468 -11.783 10.161 1079 1HG GLN 131 HG2 GLN 131 4.390 -12.060 11.556 1080 2HG GLN 131 HG3 GLN 131 3.059 -11.656 12.642 1081 1HE2 GLN 131 HE21 GLN 131 5.643 -13.662 12.529 1082 2HE2 GLN 131 HE22 GLN 131 5.032 -14.999 13.377 1083 H ALA 132 H ALA 132 0.176 -10.602 10.455 1084 HA ALA 132 HA ALA 132 0.636 -8.861 12.668 1085 1HB ALA 132 HB1 ALA 132 -1.405 -8.634 10.434 1086 2HB ALA 132 HB2 ALA 132 -0.923 -7.321 11.508 1087 3HB ALA 132 HB3 ALA 132 0.247 -8.021 10.390 1088 H LYS 133 H LYS 133 -2.044 -10.993 11.852 1089 HA LYS 133 HA LYS 133 -3.928 -9.899 13.734 1090 1HB LYS 133 HB2 LYS 133 -3.916 -11.974 11.828 1091 2HB LYS 133 HB3 LYS 133 -4.239 -12.756 13.375 1092 1HG LYS 133 HG2 LYS 133 -5.826 -10.536 13.564 1093 2HG LYS 133 HG3 LYS 133 -5.911 -10.873 11.835 1094 1HD LYS 133 HD2 LYS 133 -6.289 -13.062 13.876 1095 2HD LYS 133 HD3 LYS 133 -7.637 -12.048 13.360 1096 1HE LYS 133 HE2 LYS 133 -6.081 -13.002 11.089 1097 2HE LYS 133 HE3 LYS 133 -6.707 -14.337 12.057 1098 1HZ LYS 133 HZ1 LYS 133 -8.486 -12.095 11.407 1099 2HZ LYS 133 HZ2 LYS 133 -8.158 -13.249 10.207 1100 3HZ LYS 133 HZ3 LYS 133 -8.862 -13.730 11.677 1101 H LYS 134 H LYS 134 -1.640 -12.639 13.934 1102 HA LYS 134 HA LYS 134 -2.266 -13.281 16.667 1103 1HB LYS 134 HB2 LYS 134 -0.171 -14.006 14.700 1104 2HB LYS 134 HB3 LYS 134 0.304 -14.139 16.393 1105 1HG LYS 134 HG2 LYS 134 -2.298 -15.216 16.242 1106 2HG LYS 134 HG3 LYS 134 -1.424 -15.872 14.858 1107 1HD LYS 134 HD2 LYS 134 -0.739 -17.402 16.428 1108 2HD LYS 134 HD3 LYS 134 0.485 -16.168 16.726 1109 1HE LYS 134 HE2 LYS 134 -0.261 -15.945 18.834 1110 2HE LYS 134 HE3 LYS 134 -1.838 -15.453 18.217 1111 1HZ LYS 134 HZ1 LYS 134 -1.063 -18.299 18.347 1112 2HZ LYS 134 HZ2 LYS 134 -1.728 -17.508 19.696 1113 3HZ LYS 134 HZ3 LYS 134 -2.617 -17.628 18.253 1114 H GLU 135 H GLU 135 -0.443 -10.748 15.214 1115 HA GLU 135 HA GLU 135 1.045 -10.199 17.721 1116 1HB GLU 135 HB2 GLU 135 1.171 -9.108 14.914 1117 2HB GLU 135 HB3 GLU 135 1.935 -8.251 16.253 1118 1HG GLU 135 HG2 GLU 135 2.634 -10.997 16.507 1119 2HG GLU 135 HG3 GLU 135 2.904 -10.541 14.823 1120 H LYS 136 H LYS 136 -1.932 -9.463 16.368 1121 HA LYS 136 HA LYS 136 -3.482 -7.735 16.736 1122 1HB LYS 136 HB2 LYS 136 -2.035 -7.656 19.401 1123 2HB LYS 136 HB3 LYS 136 -3.668 -7.067 19.085 1124 1HG LYS 136 HG2 LYS 136 -4.320 -9.383 18.396 1125 2HG LYS 136 HG3 LYS 136 -2.715 -9.937 18.874 1126 1HD LYS 136 HD2 LYS 136 -4.185 -8.331 20.892 1127 2HD LYS 136 HD3 LYS 136 -4.837 -9.937 20.558 1128 1HE LYS 136 HE2 LYS 136 -2.525 -10.868 20.901 1129 2HE LYS 136 HE3 LYS 136 -2.012 -9.263 21.421 1130 1HZ LYS 136 HZ1 LYS 136 -4.300 -10.675 22.660 1131 2HZ LYS 136 HZ2 LYS 136 -2.708 -10.857 23.226 1132 3HZ LYS 136 HZ3 LYS 136 -3.448 -9.331 23.255 1133 H LEU 137 H LEU 137 -1.871 -6.577 15.122 1134 HA LEU 137 HA LEU 137 -0.433 -4.333 16.395 1135 1HB LEU 137 HB2 LEU 137 -0.383 -5.688 13.792 1136 2HB LEU 137 HB3 LEU 137 -0.281 -3.931 13.668 1137 HG LEU 137 HG LEU 137 1.957 -5.031 13.904 1138 1HD1 LEU 137 HD11 LEU 137 0.914 -3.109 15.978 1139 2HD1 LEU 137 HD12 LEU 137 2.603 -3.617 15.994 1140 3HD1 LEU 137 HD13 LEU 137 1.947 -2.780 14.587 1141 1HD2 LEU 137 HD21 LEU 137 0.698 -6.645 15.716 1142 2HD2 LEU 137 HD22 LEU 137 2.448 -6.443 15.631 1143 3HD2 LEU 137 HD23 LEU 137 1.508 -5.505 16.791 1144 H ASN 138 H ASN 138 -1.875 -2.796 17.088 1145 HA ASN 138 HA ASN 138 -3.495 -1.115 16.980 1146 1HB ASN 138 HB2 ASN 138 -2.730 -1.195 14.048 1147 2HB ASN 138 HB3 ASN 138 -3.575 0.129 14.854 1148 1HD2 ASN 138 HD21 ASN 138 -0.475 -1.092 14.069 1149 2HD2 ASN 138 HD22 ASN 138 0.438 -0.083 15.084 1150 H ILE 139 H ILE 139 -4.457 -1.722 13.716 1151 HA ILE 139 HA ILE 139 -7.149 -1.945 14.067 1152 HB ILE 139 HB ILE 139 -5.507 -3.664 12.184 1153 1HG1 ILE 139 HG12 ILE 139 -6.937 -1.239 11.251 1154 2HG1 ILE 139 HG13 ILE 139 -5.548 -0.943 12.299 1155 1HG2 ILE 139 HG21 ILE 139 -8.431 -2.858 12.157 1156 2HG2 ILE 139 HG22 ILE 139 -7.601 -3.658 10.823 1157 3HG2 ILE 139 HG23 ILE 139 -7.797 -4.491 12.365 1158 1HD1 ILE 139 HD11 ILE 139 -4.982 -3.003 10.316 1159 2HD1 ILE 139 HD12 ILE 139 -5.456 -1.482 9.560 1160 3HD1 ILE 139 HD13 ILE 139 -4.090 -1.525 10.675 1161 H TRP 140 H TRP 140 -4.921 -4.729 14.259 1162 HA TRP 140 HA TRP 140 -7.099 -6.469 15.175 1163 1HB TRP 140 HB2 TRP 140 -4.145 -7.102 15.152 1164 2HB TRP 140 HB3 TRP 140 -5.497 -8.231 15.061 1165 HD1 TRP 140 HD1 TRP 140 -3.192 -6.232 12.948 1166 HE1 TRP 140 HE1 TRP 140 -3.895 -6.373 10.472 1167 HE3 TRP 140 HE3 TRP 140 -7.805 -8.365 13.460 1168 HZ2 TRP 140 HZ2 TRP 140 -6.119 -7.271 8.914 1169 HZ3 TRP 140 HZ3 TRP 140 -9.193 -8.849 11.465 1170 HH2 TRP 140 HH2 TRP 140 -8.358 -8.306 9.195 1171 H SER 141 H SER 141 -6.804 -4.307 16.919 1172 HA SER 141 HA SER 141 -5.328 -5.428 19.252 1173 1HB SER 141 HB2 SER 141 -4.855 -3.067 18.603 1174 2HB SER 141 HB3 SER 141 -6.549 -2.675 18.881 1175 HG SER 141 HG SER 141 -4.661 -3.660 20.762 1176 H GLU 142 H GLU 142 -6.489 -6.325 20.905 1177 HA GLU 142 HA GLU 142 -9.351 -6.600 20.706 1178 1HB GLU 142 HB2 GLU 142 -9.043 -7.515 23.098 1179 2HB GLU 142 HB3 GLU 142 -8.219 -8.373 21.797 1180 1HG GLU 142 HG2 GLU 142 -6.150 -7.750 22.524 1181 2HG GLU 142 HG3 GLU 142 -6.695 -6.143 23.006 1182 H ASP 143 H ASP 143 -10.418 -6.168 23.165 1183 HA ASP 143 HA ASP 143 -10.192 -3.206 23.440 1184 1HB ASP 143 HB2 ASP 143 -12.421 -4.787 23.055 1185 2HB ASP 143 HB3 ASP 143 -12.433 -4.532 24.801 1186 H ASN 144 H ASN 144 -9.435 -6.129 25.018 1187 HA ASN 144 HA ASN 144 -8.777 -6.614 27.225 1188 1HB ASN 144 HB2 ASN 144 -7.113 -4.813 26.349 1189 2HB ASN 144 HB3 ASN 144 -7.984 -3.712 27.418 1190 1HD2 ASN 144 HD21 ASN 144 -5.430 -4.005 28.203 1191 2HD2 ASN 144 HD22 ASN 144 -5.271 -5.082 29.506 1192 H ALA 145 H ALA 145 -10.751 -6.947 28.294 1193 HA ALA 145 HA ALA 145 -11.933 -4.533 29.611 1194 1HB ALA 145 HB1 ALA 145 -13.136 -6.989 28.418 1195 2HB ALA 145 HB2 ALA 145 -13.913 -6.321 29.853 1196 3HB ALA 145 HB3 ALA 145 -13.729 -5.329 28.408 1197 H ASP 146 H ASP 146 -10.971 -4.509 31.618 1198 HA ASP 146 HA ASP 146 -11.019 -7.064 33.174 1199 1HB ASP 146 HB2 ASP 146 -9.271 -4.676 33.790 1200 2HB ASP 146 HB3 ASP 146 -9.089 -6.336 34.359 1201 H SER 147 H SER 147 -11.888 -3.671 33.103 1202 HA SER 147 HA SER 147 -13.982 -3.949 34.997 1203 1HB SER 147 HB2 SER 147 -11.787 -4.191 36.429 1204 2HB SER 147 HB3 SER 147 -11.712 -2.440 36.258 1205 HG SER 147 HG SER 147 -13.118 -2.417 37.813 1206 H GLY 148 H GLY 148 -14.148 -2.704 32.689 1207 1HA GLY 148 HA2 GLY 148 -14.996 -0.652 31.866 1208 2HA GLY 148 HA3 GLY 148 -14.599 0.095 33.414 1209 H GLN 149 H GLN 149 -13.972 0.755 30.454 1210 HA GLN 149 HA GLN 149 -11.384 1.922 30.951 1211 1HB GLN 149 HB2 GLN 149 -10.821 -0.537 30.549 1212 2HB GLN 149 HB3 GLN 149 -11.381 -0.298 28.894 1213 1HG GLN 149 HG2 GLN 149 -9.750 1.615 28.701 1214 2HG GLN 149 HG3 GLN 149 -9.109 1.153 30.278 1215 1HE2 GLN 149 HE21 GLN 149 -8.075 0.941 27.296 1216 2HE2 GLN 149 HE22 GLN 149 -7.474 -0.645 27.229 1217 HN3 PTP 150 H3 PTP 150 -10.082 -3.575 -9.525 1218 1H5M PTP 150 H51 PTP 150 -7.110 -0.862 -5.888 1219 2H5M PTP 150 H52 PTP 150 -6.309 -1.763 -7.197 1220 3H5M PTP 150 H53 PTP 150 -7.041 -2.640 -5.832 1221 H6 PTP 150 H6 PTP 150 -9.240 -0.162 -6.248 1222 H1* PTP 150 H1' PTP 150 -12.200 0.226 -8.303 1223 2H2* PTP 150 H2' PTP 150 -12.224 -1.238 -5.662 1224 H3* PTP 150 H3' PTP 150 -13.042 0.678 -4.506 1225 H4* PTP 150 H4' PTP 150 -11.805 2.730 -5.830 1226 2H5* PTP 150 H5' PTP 150 -10.538 0.377 -4.301 Start of MODEL 9 1 1H ALA 1 H1 ALA 1 -0.786 -19.775 -25.060 2 2H ALA 1 H2 ALA 1 -0.546 -19.622 -23.385 3 3H ALA 1 H3 ALA 1 -1.450 -18.455 -24.219 4 HA ALA 1 HA ALA 1 1.467 -18.938 -24.329 5 1HB ALA 1 HB1 ALA 1 0.481 -18.710 -26.636 6 2HB ALA 1 HB2 ALA 1 -0.151 -17.135 -26.154 7 3HB ALA 1 HB3 ALA 1 1.591 -17.408 -26.205 8 H THR 2 H THR 2 1.839 -18.000 -22.318 9 HA THR 2 HA THR 2 0.868 -15.186 -22.003 10 HB THR 2 HB THR 2 1.508 -17.005 -19.683 11 HG1 THR 2 HG1 THR 2 -0.870 -17.201 -19.639 12 1HG2 THR 2 HG21 THR 2 -0.183 -14.514 -20.030 13 2HG2 THR 2 HG22 THR 2 -0.039 -15.426 -18.527 14 3HG2 THR 2 HG23 THR 2 1.374 -14.618 -19.207 15 H SER 3 H SER 3 2.382 -13.720 -21.047 16 HA SER 3 HA SER 3 5.199 -14.733 -21.040 17 1HB SER 3 HB2 SER 3 4.828 -11.840 -21.406 18 2HB SER 3 HB3 SER 3 5.849 -12.963 -22.301 19 HG SER 3 HG SER 3 4.143 -12.129 -23.582 20 H THR 4 H THR 4 6.069 -12.065 -20.022 21 HA THR 4 HA THR 4 6.525 -11.126 -17.919 22 HB THR 4 HB THR 4 3.679 -11.910 -17.247 23 HG1 THR 4 HG1 THR 4 3.012 -10.422 -18.571 24 1HG2 THR 4 HG21 THR 4 5.697 -10.527 -15.851 25 2HG2 THR 4 HG22 THR 4 4.577 -9.290 -16.420 26 3HG2 THR 4 HG23 THR 4 3.987 -10.624 -15.430 27 H LYS 5 H LYS 5 8.014 -12.716 -17.195 28 HA LYS 5 HA LYS 5 6.868 -14.618 -15.200 29 1HB LYS 5 HB2 LYS 5 8.327 -15.253 -17.643 30 2HB LYS 5 HB3 LYS 5 9.142 -15.886 -16.213 31 1HG LYS 5 HG2 LYS 5 7.675 -17.614 -16.432 32 2HG LYS 5 HG3 LYS 5 6.545 -16.511 -15.646 33 1HD LYS 5 HD2 LYS 5 5.387 -16.106 -17.578 34 2HD LYS 5 HD3 LYS 5 6.832 -16.200 -18.584 35 1HE LYS 5 HE2 LYS 5 6.553 -18.785 -17.582 36 2HE LYS 5 HE3 LYS 5 4.897 -18.285 -17.930 37 1HZ LYS 5 HZ1 LYS 5 6.491 -17.412 -20.036 38 2HZ LYS 5 HZ2 LYS 5 6.925 -19.024 -19.736 39 3HZ LYS 5 HZ3 LYS 5 5.305 -18.628 -20.062 40 H LYS 6 H LYS 6 7.918 -12.137 -14.509 41 HA LYS 6 HA LYS 6 9.893 -12.808 -12.587 42 1HB LYS 6 HB2 LYS 6 11.182 -12.944 -14.870 43 2HB LYS 6 HB3 LYS 6 11.163 -11.184 -14.773 44 1HG LYS 6 HG2 LYS 6 13.202 -11.941 -13.728 45 2HG LYS 6 HG3 LYS 6 12.124 -11.386 -12.447 46 1HD LYS 6 HD2 LYS 6 11.526 -14.127 -12.914 47 2HD LYS 6 HD3 LYS 6 13.280 -13.989 -12.797 48 1HE LYS 6 HE2 LYS 6 13.187 -13.586 -10.579 49 2HE LYS 6 HE3 LYS 6 11.941 -12.356 -10.791 50 1HZ LYS 6 HZ1 LYS 6 11.113 -15.118 -11.169 51 2HZ LYS 6 HZ2 LYS 6 11.497 -14.664 -9.578 52 3HZ LYS 6 HZ3 LYS 6 10.292 -13.827 -10.430 53 H LEU 7 H LEU 7 8.396 -10.347 -14.606 54 HA LEU 7 HA LEU 7 7.677 -8.184 -14.068 55 1HB LEU 7 HB2 LEU 7 7.833 -9.628 -11.493 56 2HB LEU 7 HB3 LEU 7 7.880 -7.870 -11.369 57 HG LEU 7 HG LEU 7 5.792 -9.422 -12.923 58 1HD1 LEU 7 HD11 LEU 7 6.043 -8.841 -10.094 59 2HD1 LEU 7 HD12 LEU 7 4.625 -8.038 -10.767 60 3HD1 LEU 7 HD13 LEU 7 4.810 -9.785 -10.927 61 1HD2 LEU 7 HD21 LEU 7 6.479 -6.563 -12.577 62 2HD2 LEU 7 HD22 LEU 7 5.613 -7.360 -13.889 63 3HD2 LEU 7 HD23 LEU 7 4.768 -6.949 -12.397 64 H HIS 8 H HIS 8 8.605 -6.090 -13.494 65 HA HIS 8 HA HIS 8 11.469 -6.181 -12.671 66 1HB HIS 8 HB2 HIS 8 11.582 -6.066 -15.070 67 2HB HIS 8 HB3 HIS 8 10.323 -4.834 -15.129 68 HD1 HIS 8 HD1 HIS 8 13.329 -4.881 -12.804 69 HD2 HIS 8 HD2 HIS 8 11.816 -2.657 -15.983 70 HE1 HIS 8 HE1 HIS 8 14.825 -2.848 -13.029 71 H LYS 9 H LYS 9 12.119 -4.378 -11.470 72 HA LYS 9 HA LYS 9 9.916 -2.569 -10.622 73 1HB LYS 9 HB2 LYS 9 12.676 -2.758 -9.398 74 2HB LYS 9 HB3 LYS 9 11.200 -2.133 -8.661 75 1HG LYS 9 HG2 LYS 9 10.219 -4.353 -8.610 76 2HG LYS 9 HG3 LYS 9 11.588 -5.017 -9.503 77 1HD LYS 9 HD2 LYS 9 11.911 -5.516 -7.153 78 2HD LYS 9 HD3 LYS 9 13.087 -4.289 -7.623 79 1HE LYS 9 HE2 LYS 9 11.364 -2.561 -6.819 80 2HE LYS 9 HE3 LYS 9 10.531 -3.915 -6.055 81 1HZ LYS 9 HZ1 LYS 9 12.699 -4.455 -4.971 82 2HZ LYS 9 HZ2 LYS 9 13.294 -2.973 -5.541 83 3HZ LYS 9 HZ3 LYS 9 11.988 -3.001 -4.455 84 H GLU 10 H GLU 10 9.987 -0.384 -11.061 85 HA GLU 10 HA GLU 10 12.432 0.613 -12.471 86 1HB GLU 10 HB2 GLU 10 9.503 1.071 -12.986 87 2HB GLU 10 HB3 GLU 10 10.680 2.298 -13.457 88 1HG GLU 10 HG2 GLU 10 10.929 1.090 -15.358 89 2HG GLU 10 HG3 GLU 10 11.848 -0.039 -14.363 90 HA PRO 11 HA PRO 11 12.670 3.754 -9.405 91 1HB PRO 11 HB2 PRO 11 13.845 5.750 -10.850 92 2HB PRO 11 HB3 PRO 11 14.700 4.287 -10.337 93 1HG PRO 11 HG2 PRO 11 13.651 5.012 -13.035 94 2HG PRO 11 HG3 PRO 11 15.064 4.035 -12.606 95 1HD PRO 11 HD2 PRO 11 12.587 3.017 -13.437 96 2HD PRO 11 HD3 PRO 11 13.847 2.091 -12.591 97 H ALA 12 H ALA 12 11.841 5.849 -8.785 98 HA ALA 12 HA ALA 12 9.954 7.166 -10.657 99 1HB ALA 12 HB1 ALA 12 8.685 5.411 -9.341 100 2HB ALA 12 HB2 ALA 12 9.085 6.316 -7.881 101 3HB ALA 12 HB3 ALA 12 8.089 7.058 -9.134 102 H THR 13 H THR 13 8.821 9.001 -8.970 103 HA THR 13 HA THR 13 11.131 10.265 -7.555 104 HB THR 13 HB THR 13 9.194 11.999 -9.033 105 HG1 THR 13 HG1 THR 13 11.470 11.166 -10.384 106 1HG2 THR 13 HG21 THR 13 11.604 12.303 -7.582 107 2HG2 THR 13 HG22 THR 13 11.988 12.648 -9.268 108 3HG2 THR 13 HG23 THR 13 10.712 13.550 -8.454 109 H LEU 14 H LEU 14 10.122 9.578 -5.561 110 HA LEU 14 HA LEU 14 7.461 9.965 -4.777 111 1HB LEU 14 HB2 LEU 14 8.972 8.807 -3.304 112 2HB LEU 14 HB3 LEU 14 10.018 10.220 -3.174 113 HG LEU 14 HG LEU 14 8.044 11.457 -2.166 114 1HD1 LEU 14 HD11 LEU 14 6.895 8.722 -2.530 115 2HD1 LEU 14 HD12 LEU 14 6.451 9.613 -1.074 116 3HD1 LEU 14 HD13 LEU 14 6.109 10.297 -2.664 117 1HD2 LEU 14 HD21 LEU 14 9.216 9.019 -0.805 118 2HD2 LEU 14 HD22 LEU 14 9.780 10.685 -0.694 119 3HD2 LEU 14 HD23 LEU 14 8.250 10.221 0.049 120 H ILE 15 H ILE 15 6.464 11.876 -5.396 121 HA ILE 15 HA ILE 15 7.786 14.460 -4.998 122 HB ILE 15 HB ILE 15 5.017 13.665 -5.929 123 1HG1 ILE 15 HG12 ILE 15 6.969 15.243 -7.543 124 2HG1 ILE 15 HG13 ILE 15 7.325 13.534 -7.294 125 1HG2 ILE 15 HG21 ILE 15 5.879 16.155 -4.801 126 2HG2 ILE 15 HG22 ILE 15 5.610 16.387 -6.529 127 3HG2 ILE 15 HG23 ILE 15 4.314 15.759 -5.511 128 1HD1 ILE 15 HD11 ILE 15 4.548 13.765 -7.915 129 2HD1 ILE 15 HD12 ILE 15 5.450 14.698 -9.110 130 3HD1 ILE 15 HD13 ILE 15 5.814 12.989 -8.866 131 H LYS 16 H LYS 16 4.563 13.353 -3.904 132 HA LYS 16 HA LYS 16 5.212 14.107 -1.133 133 1HB LYS 16 HB2 LYS 16 4.487 16.231 -2.349 134 2HB LYS 16 HB3 LYS 16 2.901 15.481 -2.523 135 1HG LYS 16 HG2 LYS 16 2.772 15.205 -0.063 136 2HG LYS 16 HG3 LYS 16 4.336 16.004 0.096 137 1HD LYS 16 HD2 LYS 16 3.485 18.077 -0.668 138 2HD LYS 16 HD3 LYS 16 2.036 17.329 -1.340 139 1HE LYS 16 HE2 LYS 16 2.219 16.714 1.469 140 2HE LYS 16 HE3 LYS 16 2.345 18.458 1.237 141 1HZ LYS 16 HZ1 LYS 16 0.303 17.018 -0.282 142 2HZ LYS 16 HZ2 LYS 16 0.029 17.257 1.377 143 3HZ LYS 16 HZ3 LYS 16 0.272 18.590 0.351 144 H ALA 17 H ALA 17 4.392 12.406 -0.017 145 HA ALA 17 HA ALA 17 2.440 10.596 -1.065 146 1HB ALA 17 HB1 ALA 17 3.960 10.919 1.400 147 2HB ALA 17 HB2 ALA 17 2.321 10.352 1.716 148 3HB ALA 17 HB3 ALA 17 3.376 9.442 0.635 149 H ILE 18 H ILE 18 0.254 10.220 -0.139 150 HA ILE 18 HA ILE 18 -1.028 12.794 0.691 151 HB ILE 18 HB ILE 18 -2.334 10.516 -0.823 152 1HG1 ILE 18 HG12 ILE 18 -1.820 13.093 -2.184 153 2HG1 ILE 18 HG13 ILE 18 -0.380 12.131 -1.849 154 1HG2 ILE 18 HG21 ILE 18 -3.166 13.389 -0.304 155 2HG2 ILE 18 HG22 ILE 18 -4.070 12.218 -1.264 156 3HG2 ILE 18 HG23 ILE 18 -3.859 11.963 0.469 157 1HD1 ILE 18 HD11 ILE 18 -2.690 10.621 -2.921 158 2HD1 ILE 18 HD12 ILE 18 -1.948 11.764 -4.040 159 3HD1 ILE 18 HD13 ILE 18 -0.977 10.485 -3.313 160 H ASP 19 H ASP 19 -1.907 9.317 0.709 161 HA ASP 19 HA ASP 19 -2.648 9.670 3.587 162 1HB ASP 19 HB2 ASP 19 -3.938 8.007 1.411 163 2HB ASP 19 HB3 ASP 19 -4.283 7.768 3.125 164 H GLY 20 H GLY 20 -3.019 6.976 4.219 165 1HA GLY 20 HA2 GLY 20 -0.229 6.091 4.363 166 2HA GLY 20 HA3 GLY 20 -1.603 5.320 5.155 167 H ASP 21 H ASP 21 -2.574 5.750 2.039 168 HA ASP 21 HA ASP 21 -1.300 3.231 1.074 169 1HB ASP 21 HB2 ASP 21 -4.115 3.657 1.772 170 2HB ASP 21 HB3 ASP 21 -3.896 3.054 0.129 171 H THR 22 H THR 22 -1.737 6.390 0.480 172 HA THR 22 HA THR 22 -1.648 5.950 -2.467 173 HB THR 22 HB THR 22 -2.945 8.464 -1.673 174 HG1 THR 22 HG1 THR 22 -4.820 7.536 -0.967 175 1HG2 THR 22 HG21 THR 22 -2.913 6.547 -3.826 176 2HG2 THR 22 HG22 THR 22 -4.576 6.860 -3.330 177 3HG2 THR 22 HG23 THR 22 -3.537 8.196 -3.824 178 H VAL 23 H VAL 23 -0.144 7.255 -3.512 179 HA VAL 23 HA VAL 23 1.066 9.515 -2.029 180 HB VAL 23 HB VAL 23 3.374 8.566 -2.665 181 1HG1 VAL 23 HG11 VAL 23 1.888 8.412 -0.372 182 2HG1 VAL 23 HG12 VAL 23 2.244 6.709 -0.663 183 3HG1 VAL 23 HG13 VAL 23 3.561 7.870 -0.504 184 1HG2 VAL 23 HG21 VAL 23 1.893 6.678 -3.970 185 2HG2 VAL 23 HG22 VAL 23 3.559 6.429 -3.445 186 3HG2 VAL 23 HG23 VAL 23 2.223 5.848 -2.450 187 H LYS 24 H LYS 24 2.169 10.990 -3.440 188 HA LYS 24 HA LYS 24 1.461 10.599 -6.312 189 1HB LYS 24 HB2 LYS 24 2.263 13.171 -4.921 190 2HB LYS 24 HB3 LYS 24 1.547 13.004 -6.525 191 1HG LYS 24 HG2 LYS 24 -0.391 11.791 -5.234 192 2HG LYS 24 HG3 LYS 24 0.257 12.652 -3.836 193 1HD LYS 24 HD2 LYS 24 0.092 14.444 -6.091 194 2HD LYS 24 HD3 LYS 24 -1.474 13.677 -5.822 195 1HE LYS 24 HE2 LYS 24 -0.802 14.244 -3.264 196 2HE LYS 24 HE3 LYS 24 0.035 15.559 -4.089 197 1HZ LYS 24 HZ1 LYS 24 -2.666 15.033 -4.999 198 2HZ LYS 24 HZ2 LYS 24 -2.545 15.628 -3.416 199 3HZ LYS 24 HZ3 LYS 24 -1.884 16.513 -4.706 200 H LEU 25 H LEU 25 3.155 9.857 -7.501 201 HA LEU 25 HA LEU 25 5.851 11.020 -6.933 202 1HB LEU 25 HB2 LEU 25 5.589 8.219 -7.971 203 2HB LEU 25 HB3 LEU 25 6.891 8.941 -7.026 204 HG LEU 25 HG LEU 25 4.755 9.181 -5.313 205 1HD1 LEU 25 HD11 LEU 25 4.420 6.720 -7.025 206 2HD1 LEU 25 HD12 LEU 25 3.864 6.746 -5.352 207 3HD1 LEU 25 HD13 LEU 25 3.195 7.885 -6.521 208 1HD2 LEU 25 HD21 LEU 25 7.221 8.086 -5.246 209 2HD2 LEU 25 HD22 LEU 25 6.034 7.818 -3.970 210 3HD2 LEU 25 HD23 LEU 25 6.258 6.609 -5.235 211 H MET 26 H MET 26 7.322 10.823 -8.869 212 HA MET 26 HA MET 26 5.765 11.408 -11.327 213 1HB MET 26 HB2 MET 26 7.774 12.815 -10.283 214 2HB MET 26 HB3 MET 26 8.744 11.666 -11.203 215 1HG MET 26 HG2 MET 26 7.465 12.234 -13.246 216 2HG MET 26 HG3 MET 26 6.527 13.407 -12.322 217 1HE MET 26 HE1 MET 26 6.662 15.199 -13.089 218 2HE MET 26 HE2 MET 26 7.846 16.353 -12.462 219 3HE MET 26 HE3 MET 26 7.919 15.836 -14.146 220 H TYR 27 H TYR 27 6.196 10.296 -13.292 221 HA TYR 27 HA TYR 27 8.019 7.959 -13.179 222 1HB TYR 27 HB2 TYR 27 5.699 7.239 -12.448 223 2HB TYR 27 HB3 TYR 27 5.130 7.692 -14.055 224 HD1 TYR 27 HD1 TYR 27 7.482 5.468 -12.220 225 HD2 TYR 27 HD2 TYR 27 5.505 6.286 -15.944 226 HE1 TYR 27 HE1 TYR 27 8.239 3.278 -13.103 227 HE2 TYR 27 HE2 TYR 27 6.263 4.095 -16.827 228 HH TYR 27 HH TYR 27 7.712 2.374 -16.472 229 H LYS 28 H LYS 28 9.238 8.127 -15.002 230 HA LYS 28 HA LYS 28 9.873 8.812 -17.169 231 1HB LYS 28 HB2 LYS 28 7.335 7.313 -17.348 232 2HB LYS 28 HB3 LYS 28 7.696 8.318 -18.751 233 1HG LYS 28 HG2 LYS 28 8.656 6.065 -19.025 234 2HG LYS 28 HG3 LYS 28 9.930 7.280 -18.922 235 1HD LYS 28 HD2 LYS 28 10.719 6.462 -16.955 236 2HD LYS 28 HD3 LYS 28 9.098 6.187 -16.316 237 1HE LYS 28 HE2 LYS 28 9.912 4.003 -16.562 238 2HE LYS 28 HE3 LYS 28 9.011 4.241 -18.060 239 1HZ LYS 28 HZ1 LYS 28 11.425 5.217 -18.702 240 2HZ LYS 28 HZ2 LYS 28 11.854 3.959 -17.645 241 3HZ LYS 28 HZ3 LYS 28 10.920 3.626 -19.020 242 H GLY 29 H GLY 29 8.852 10.921 -15.528 243 1HA GLY 29 HA2 GLY 29 8.318 13.192 -15.868 244 2HA GLY 29 HA3 GLY 29 8.184 12.853 -17.595 245 H GLN 30 H GLN 30 6.419 11.248 -14.970 246 HA GLN 30 HA GLN 30 3.932 12.651 -15.755 247 1HB GLN 30 HB2 GLN 30 4.239 10.579 -17.214 248 2HB GLN 30 HB3 GLN 30 4.056 9.629 -15.740 249 1HG GLN 30 HG2 GLN 30 1.820 10.052 -15.587 250 2HG GLN 30 HG3 GLN 30 1.996 11.713 -16.154 251 1HE2 GLN 30 HE21 GLN 30 1.467 12.119 -18.328 252 2HE2 GLN 30 HE22 GLN 30 1.166 10.909 -19.480 253 HA PRO 31 HA PRO 31 3.994 12.069 -11.245 254 1HB PRO 31 HB2 PRO 31 2.394 14.235 -10.762 255 2HB PRO 31 HB3 PRO 31 4.140 14.366 -11.042 256 1HG PRO 31 HG2 PRO 31 1.877 14.938 -12.920 257 2HG PRO 31 HG3 PRO 31 3.433 15.768 -12.750 258 1HD PRO 31 HD2 PRO 31 2.878 13.932 -14.746 259 2HD PRO 31 HD3 PRO 31 4.516 14.299 -14.161 260 H MET 32 H MET 32 2.683 10.247 -10.951 261 HA MET 32 HA MET 32 -0.264 10.677 -11.248 262 1HB MET 32 HB2 MET 32 1.492 8.521 -12.209 263 2HB MET 32 HB3 MET 32 0.076 7.942 -11.330 264 1HG MET 32 HG2 MET 32 -0.831 10.035 -13.005 265 2HG MET 32 HG3 MET 32 0.219 9.023 -13.997 266 1HE MET 32 HE1 MET 32 0.018 6.516 -14.293 267 2HE MET 32 HE2 MET 32 0.005 6.245 -12.552 268 3HE MET 32 HE3 MET 32 -1.218 5.483 -13.578 269 H THR 33 H THR 33 -1.510 9.113 -9.776 270 HA THR 33 HA THR 33 -0.150 9.051 -7.121 271 HB THR 33 HB THR 33 -2.493 8.882 -6.223 272 HG1 THR 33 HG1 THR 33 -4.076 9.560 -7.905 273 1HG2 THR 33 HG21 THR 33 -1.143 11.110 -7.303 274 2HG2 THR 33 HG22 THR 33 -2.829 11.284 -7.791 275 3HG2 THR 33 HG23 THR 33 -2.417 11.125 -6.083 276 H PHE 34 H PHE 34 0.519 7.064 -6.469 277 HA PHE 34 HA PHE 34 -0.750 4.676 -7.717 278 1HB PHE 34 HB2 PHE 34 1.876 5.076 -6.263 279 2HB PHE 34 HB3 PHE 34 1.261 3.486 -6.714 280 HD1 PHE 34 HD1 PHE 34 2.438 6.748 -8.014 281 HD2 PHE 34 HD2 PHE 34 1.249 2.742 -9.005 282 HE1 PHE 34 HE1 PHE 34 3.311 7.058 -10.315 283 HE2 PHE 34 HE2 PHE 34 2.122 3.052 -11.305 284 HZ PHE 34 HZ PHE 34 3.152 5.209 -11.960 285 H ARG 35 H ARG 35 -1.627 3.026 -6.424 286 HA ARG 35 HA ARG 35 -1.956 3.723 -3.531 287 1HB ARG 35 HB2 ARG 35 -3.923 3.211 -5.578 288 2HB ARG 35 HB3 ARG 35 -4.036 1.974 -4.327 289 1HG ARG 35 HG2 ARG 35 -3.696 4.764 -3.371 290 2HG ARG 35 HG3 ARG 35 -5.249 4.383 -4.119 291 1HD ARG 35 HD2 ARG 35 -5.672 2.618 -2.564 292 2HD ARG 35 HD3 ARG 35 -4.013 2.654 -1.966 293 HE ARG 35 HE ARG 35 -4.527 4.750 -0.824 294 1HH1 ARG 35 HH11 ARG 35 -6.638 3.098 0.331 295 2HH1 ARG 35 HH12 ARG 35 -8.083 3.992 -0.004 296 1HH2 ARG 35 HH21 ARG 35 -6.614 5.961 -2.451 297 2HH2 ARG 35 HH22 ARG 35 -8.069 5.614 -1.579 298 H LEU 36 H LEU 36 -1.882 1.944 -2.052 299 HA LEU 36 HA LEU 36 -0.077 -0.162 -2.763 300 1HB LEU 36 HB2 LEU 36 -2.017 -0.089 -0.432 301 2HB LEU 36 HB3 LEU 36 -0.560 -1.076 -0.556 302 HG LEU 36 HG LEU 36 -0.737 1.936 -0.352 303 1HD1 LEU 36 HD11 LEU 36 -0.047 -0.303 1.423 304 2HD1 LEU 36 HD12 LEU 36 1.165 0.980 1.404 305 3HD1 LEU 36 HD13 LEU 36 -0.506 1.352 1.827 306 1HD2 LEU 36 HD21 LEU 36 1.324 0.197 -1.564 307 2HD2 LEU 36 HD22 LEU 36 1.047 1.927 -1.774 308 3HD2 LEU 36 HD23 LEU 36 1.939 1.340 -0.371 309 H LEU 37 H LEU 37 -0.471 -2.123 -3.682 310 HA LEU 37 HA LEU 37 -3.257 -2.769 -4.420 311 1HB LEU 37 HB2 LEU 37 -0.542 -3.583 -5.329 312 2HB LEU 37 HB3 LEU 37 -1.830 -4.773 -5.511 313 HG LEU 37 HG LEU 37 -1.977 -1.914 -6.509 314 1HD1 LEU 37 HD11 LEU 37 -0.801 -4.338 -7.639 315 2HD1 LEU 37 HD12 LEU 37 -2.060 -3.664 -8.674 316 3HD1 LEU 37 HD13 LEU 37 -0.682 -2.670 -8.200 317 1HD2 LEU 37 HD21 LEU 37 -3.853 -4.228 -6.396 318 2HD2 LEU 37 HD22 LEU 37 -4.196 -2.500 -6.330 319 3HD2 LEU 37 HD23 LEU 37 -3.856 -3.272 -7.878 320 H LEU 38 H LEU 38 -4.306 -4.687 -3.814 321 HA LEU 38 HA LEU 38 -4.817 -6.543 -2.481 322 1HB LEU 38 HB2 LEU 38 -1.814 -6.672 -2.079 323 2HB LEU 38 HB3 LEU 38 -2.965 -7.956 -1.714 324 HG LEU 38 HG LEU 38 -2.467 -6.768 -4.460 325 1HD1 LEU 38 HD11 LEU 38 -1.594 -9.318 -3.097 326 2HD1 LEU 38 HD12 LEU 38 -1.680 -9.195 -4.854 327 3HD1 LEU 38 HD13 LEU 38 -0.600 -8.137 -3.947 328 1HD2 LEU 38 HD21 LEU 38 -4.509 -8.613 -3.323 329 2HD2 LEU 38 HD22 LEU 38 -4.630 -7.510 -4.694 330 3HD2 LEU 38 HD23 LEU 38 -3.824 -9.068 -4.884 331 H VAL 39 H VAL 39 -3.909 -3.669 -1.331 332 HA VAL 39 HA VAL 39 -4.476 -4.507 1.453 333 HB VAL 39 HB VAL 39 -2.144 -4.470 1.652 334 1HG1 VAL 39 HG11 VAL 39 -2.285 -2.207 -0.330 335 2HG1 VAL 39 HG12 VAL 39 -0.832 -2.490 0.626 336 3HG1 VAL 39 HG13 VAL 39 -1.424 -3.739 -0.469 337 1HG2 VAL 39 HG21 VAL 39 -3.013 -1.616 2.202 338 2HG2 VAL 39 HG22 VAL 39 -3.164 -2.971 3.321 339 3HG2 VAL 39 HG23 VAL 39 -1.569 -2.387 2.854 340 H ASP 40 H ASP 40 -4.901 -2.530 2.838 341 HA ASP 40 HA ASP 40 -5.472 0.005 1.565 342 1HB ASP 40 HB2 ASP 40 -7.331 -1.624 0.760 343 2HB ASP 40 HB3 ASP 40 -7.939 -1.509 2.413 344 H THR 41 H THR 41 -6.021 1.586 3.132 345 HA THR 41 HA THR 41 -5.470 0.787 5.905 346 HB THR 41 HB THR 41 -5.260 3.100 6.357 347 HG1 THR 41 HG1 THR 41 -6.524 3.757 3.932 348 1HG2 THR 41 HG21 THR 41 -3.984 1.992 4.140 349 2HG2 THR 41 HG22 THR 41 -4.538 3.569 3.580 350 3HG2 THR 41 HG23 THR 41 -3.500 3.453 5.000 351 HA PRO 42 HA PRO 42 -9.651 0.711 7.297 352 1HB PRO 42 HB2 PRO 42 -9.344 1.622 9.854 353 2HB PRO 42 HB3 PRO 42 -8.782 0.027 9.324 354 1HG PRO 42 HG2 PRO 42 -7.204 2.493 9.875 355 2HG PRO 42 HG3 PRO 42 -6.733 0.794 10.044 356 1HD PRO 42 HD2 PRO 42 -6.014 2.488 7.918 357 2HD PRO 42 HD3 PRO 42 -5.890 0.716 7.917 358 H GLU 43 H GLU 43 -11.298 2.214 8.587 359 HA GLU 43 HA GLU 43 -11.923 4.473 7.124 360 1HB GLU 43 HB2 GLU 43 -12.516 3.580 9.892 361 2HB GLU 43 HB3 GLU 43 -12.789 5.291 9.561 362 1HG GLU 43 HG2 GLU 43 -14.149 4.657 7.571 363 2HG GLU 43 HG3 GLU 43 -13.945 2.960 8.006 364 H THR 44 H THR 44 -10.394 5.990 6.590 365 HA THR 44 HA THR 44 -9.283 7.616 8.796 366 HB THR 44 HB THR 44 -7.522 5.974 8.452 367 HG1 THR 44 HG1 THR 44 -5.894 7.388 7.888 368 1HG2 THR 44 HG21 THR 44 -8.480 5.985 5.805 369 2HG2 THR 44 HG22 THR 44 -6.828 6.595 5.714 370 3HG2 THR 44 HG23 THR 44 -7.148 5.025 6.449 371 H LYS 45 H LYS 45 -11.266 7.998 6.633 372 HA LYS 45 HA LYS 45 -9.861 10.152 5.100 373 1HB LYS 45 HB2 LYS 45 -12.469 8.934 4.223 374 2HB LYS 45 HB3 LYS 45 -11.233 9.730 3.248 375 1HG LYS 45 HG2 LYS 45 -9.698 7.840 3.638 376 2HG LYS 45 HG3 LYS 45 -10.928 7.042 4.618 377 1HD LYS 45 HD2 LYS 45 -12.441 6.961 2.681 378 2HD LYS 45 HD3 LYS 45 -11.233 7.785 1.695 379 1HE LYS 45 HE2 LYS 45 -10.873 5.523 1.170 380 2HE LYS 45 HE3 LYS 45 -9.660 5.834 2.411 381 1HZ LYS 45 HZ1 LYS 45 -11.548 5.098 4.000 382 2HZ LYS 45 HZ2 LYS 45 -12.191 4.351 2.616 383 3HZ LYS 45 HZ3 LYS 45 -10.644 3.923 3.175 384 H HIS 46 H HIS 46 -10.755 10.726 7.666 385 HA HIS 46 HA HIS 46 -13.441 11.923 7.459 386 1HB HIS 46 HB2 HIS 46 -11.468 11.418 9.628 387 2HB HIS 46 HB3 HIS 46 -12.514 12.822 9.831 388 HD1 HIS 46 HD1 HIS 46 -12.683 9.072 9.341 389 HD2 HIS 46 HD2 HIS 46 -15.184 12.218 10.447 390 HE1 HIS 46 HE1 HIS 46 -14.841 8.021 10.150 391 HA PRO 47 HA PRO 47 -11.904 15.903 6.283 392 1HB PRO 47 HB2 PRO 47 -14.190 17.308 6.788 393 2HB PRO 47 HB3 PRO 47 -14.021 16.207 5.410 394 1HG PRO 47 HG2 PRO 47 -15.532 15.830 7.944 395 2HG PRO 47 HG3 PRO 47 -15.831 15.140 6.342 396 1HD PRO 47 HD2 PRO 47 -14.607 13.819 8.526 397 2HD PRO 47 HD3 PRO 47 -14.643 13.254 6.841 398 H LYS 48 H LYS 48 -14.191 17.003 8.700 399 HA LYS 48 HA LYS 48 -11.894 17.888 10.403 400 1HB LYS 48 HB2 LYS 48 -14.398 19.302 9.532 401 2HB LYS 48 HB3 LYS 48 -13.660 19.720 11.079 402 1HG LYS 48 HG2 LYS 48 -11.783 19.511 8.798 403 2HG LYS 48 HG3 LYS 48 -12.928 20.851 8.715 404 1HD LYS 48 HD2 LYS 48 -12.230 21.667 10.884 405 2HD LYS 48 HD3 LYS 48 -11.217 20.246 11.141 406 1HE LYS 48 HE2 LYS 48 -10.229 21.123 8.765 407 2HE LYS 48 HE3 LYS 48 -10.704 22.656 9.498 408 1HZ LYS 48 HZ1 LYS 48 -9.089 20.610 10.911 409 2HZ LYS 48 HZ2 LYS 48 -8.403 21.892 10.031 410 3HZ LYS 48 HZ3 LYS 48 -9.373 22.218 11.384 411 H LYS 49 H LYS 49 -12.829 15.439 11.005 412 HA LYS 49 HA LYS 49 -14.575 15.929 13.385 413 1HB LYS 49 HB2 LYS 49 -14.900 14.047 11.163 414 2HB LYS 49 HB3 LYS 49 -14.939 13.256 12.739 415 1HG LYS 49 HG2 LYS 49 -17.007 14.049 13.129 416 2HG LYS 49 HG3 LYS 49 -16.451 15.703 12.867 417 1HD LYS 49 HD2 LYS 49 -17.407 15.779 10.827 418 2HD LYS 49 HD3 LYS 49 -16.644 14.261 10.353 419 1HE LYS 49 HE2 LYS 49 -19.149 14.486 12.047 420 2HE LYS 49 HE3 LYS 49 -19.126 14.104 10.325 421 1HZ LYS 49 HZ1 LYS 49 -17.352 12.350 11.358 422 2HZ LYS 49 HZ2 LYS 49 -18.522 12.431 12.586 423 3HZ LYS 49 HZ3 LYS 49 -18.974 12.000 11.006 424 H GLY 50 H GLY 50 -12.091 13.810 11.943 425 1HA GLY 50 HA2 GLY 50 -10.111 13.064 13.060 426 2HA GLY 50 HA3 GLY 50 -10.795 13.620 14.589 427 H VAL 51 H VAL 51 -9.731 11.198 14.790 428 HA VAL 51 HA VAL 51 -12.108 9.425 14.953 429 HB VAL 51 HB VAL 51 -9.669 7.982 14.173 430 1HG1 VAL 51 HG11 VAL 51 -12.569 7.844 13.908 431 2HG1 VAL 51 HG12 VAL 51 -11.753 7.453 12.395 432 3HG1 VAL 51 HG13 VAL 51 -11.379 6.544 13.860 433 1HG2 VAL 51 HG21 VAL 51 -11.016 9.837 12.181 434 2HG2 VAL 51 HG22 VAL 51 -9.360 9.987 12.768 435 3HG2 VAL 51 HG23 VAL 51 -9.823 8.602 11.780 436 H GLU 52 H GLU 52 -8.729 10.014 15.826 437 HA GLU 52 HA GLU 52 -7.598 9.616 17.838 438 1HB GLU 52 HB2 GLU 52 -10.369 9.995 18.551 439 2HB GLU 52 HB3 GLU 52 -9.640 8.782 19.604 440 1HG GLU 52 HG2 GLU 52 -8.177 10.276 20.543 441 2HG GLU 52 HG3 GLU 52 -8.001 11.197 19.049 442 H LYS 53 H LYS 53 -7.036 7.624 16.403 443 HA LYS 53 HA LYS 53 -6.793 5.340 18.014 444 1HB LYS 53 HB2 LYS 53 -8.427 3.807 16.760 445 2HB LYS 53 HB3 LYS 53 -9.135 4.916 17.934 446 1HG LYS 53 HG2 LYS 53 -9.354 6.536 15.891 447 2HG LYS 53 HG3 LYS 53 -9.184 5.064 14.933 448 1HD LYS 53 HD2 LYS 53 -11.039 4.589 17.083 449 2HD LYS 53 HD3 LYS 53 -11.530 6.030 16.191 450 1HE LYS 53 HE2 LYS 53 -11.173 4.661 14.061 451 2HE LYS 53 HE3 LYS 53 -11.066 3.245 15.107 452 1HZ LYS 53 HZ1 LYS 53 -13.279 4.408 16.036 453 2HZ LYS 53 HZ2 LYS 53 -13.367 4.860 14.401 454 3HZ LYS 53 HZ3 LYS 53 -13.279 3.218 14.827 455 H TYR 54 H TYR 54 -7.622 5.994 14.584 456 HA TYR 54 HA TYR 54 -4.933 4.944 13.850 457 1HB TYR 54 HB2 TYR 54 -7.539 4.152 12.506 458 2HB TYR 54 HB3 TYR 54 -5.925 3.677 11.975 459 HD1 TYR 54 HD1 TYR 54 -4.588 3.166 14.573 460 HD2 TYR 54 HD2 TYR 54 -8.529 2.124 13.217 461 HE1 TYR 54 HE1 TYR 54 -4.628 1.258 16.156 462 HE2 TYR 54 HE2 TYR 54 -8.568 0.215 14.801 463 HH TYR 54 HH TYR 54 -6.581 -0.095 17.353 464 H GLY 55 H GLY 55 -6.112 7.656 14.021 465 1HA GLY 55 HA2 GLY 55 -6.676 8.550 11.317 466 2HA GLY 55 HA3 GLY 55 -6.359 9.593 12.702 467 HA PRO 56 HA PRO 56 -2.333 10.345 11.076 468 1HB PRO 56 HB2 PRO 56 -1.136 11.238 13.360 469 2HB PRO 56 HB3 PRO 56 -2.353 12.179 12.480 470 1HG PRO 56 HG2 PRO 56 -2.618 10.681 15.037 471 2HG PRO 56 HG3 PRO 56 -3.495 12.113 14.475 472 1HD PRO 56 HD2 PRO 56 -4.463 9.458 14.450 473 2HD PRO 56 HD3 PRO 56 -5.184 10.843 13.605 474 H GLU 57 H GLU 57 -2.455 7.657 11.248 475 HA GLU 57 HA GLU 57 0.071 6.939 12.664 476 1HB GLU 57 HB2 GLU 57 -2.624 5.743 12.968 477 2HB GLU 57 HB3 GLU 57 -1.298 4.594 12.786 478 1HG GLU 57 HG2 GLU 57 -1.484 5.010 15.133 479 2HG GLU 57 HG3 GLU 57 -0.075 5.921 14.590 480 H ALA 58 H ALA 58 -2.337 5.831 10.263 481 HA ALA 58 HA ALA 58 -0.416 4.125 8.904 482 1HB ALA 58 HB1 ALA 58 -3.213 5.072 8.342 483 2HB ALA 58 HB2 ALA 58 -2.284 4.296 7.059 484 3HB ALA 58 HB3 ALA 58 -2.618 3.424 8.555 485 H SER 59 H SER 59 -2.061 7.144 7.863 486 HA SER 59 HA SER 59 -0.548 7.616 5.547 487 1HB SER 59 HB2 SER 59 -1.385 9.796 5.596 488 2HB SER 59 HB3 SER 59 -2.548 8.950 6.615 489 HG SER 59 HG SER 59 -1.646 10.945 7.494 490 H ALA 60 H ALA 60 0.232 8.455 8.914 491 HA ALA 60 HA ALA 60 2.678 9.845 8.260 492 1HB ALA 60 HB1 ALA 60 1.437 8.734 10.750 493 2HB ALA 60 HB2 ALA 60 3.150 9.153 10.781 494 3HB ALA 60 HB3 ALA 60 1.946 10.385 10.396 495 H PHE 61 H PHE 61 1.853 6.490 8.937 496 HA PHE 61 HA PHE 61 4.434 5.432 9.379 497 1HB PHE 61 HB2 PHE 61 2.176 4.228 9.510 498 2HB PHE 61 HB3 PHE 61 2.301 4.032 7.762 499 HD1 PHE 61 HD1 PHE 61 3.923 3.234 11.007 500 HD2 PHE 61 HD2 PHE 61 3.805 2.445 6.785 501 HE1 PHE 61 HE1 PHE 61 5.411 1.275 11.331 502 HE2 PHE 61 HE2 PHE 61 5.293 0.487 7.110 503 HZ PHE 61 HZ PHE 61 6.095 -0.098 9.382 504 H THR 62 H THR 62 2.673 5.471 6.275 505 HA THR 62 HA THR 62 5.013 4.788 4.738 506 HB THR 62 HB THR 62 2.759 6.283 3.473 507 HG1 THR 62 HG1 THR 62 1.332 4.741 3.877 508 1HG2 THR 62 HG21 THR 62 4.871 4.760 2.574 509 2HG2 THR 62 HG22 THR 62 3.534 3.611 2.533 510 3HG2 THR 62 HG23 THR 62 3.421 5.128 1.641 511 H LYS 63 H LYS 63 3.604 7.827 5.795 512 HA LYS 63 HA LYS 63 4.851 9.619 4.015 513 1HB LYS 63 HB2 LYS 63 3.222 10.057 6.019 514 2HB LYS 63 HB3 LYS 63 4.708 10.239 6.952 515 1HG LYS 63 HG2 LYS 63 5.405 12.107 5.728 516 2HG LYS 63 HG3 LYS 63 4.396 11.697 4.341 517 1HD LYS 63 HD2 LYS 63 2.372 12.200 5.691 518 2HD LYS 63 HD3 LYS 63 3.408 12.674 7.037 519 1HE LYS 63 HE2 LYS 63 4.156 13.986 4.530 520 2HE LYS 63 HE3 LYS 63 2.505 14.362 5.026 521 1HZ LYS 63 HZ1 LYS 63 4.162 14.427 7.286 522 2HZ LYS 63 HZ2 LYS 63 4.889 15.366 6.075 523 3HZ LYS 63 HZ3 LYS 63 3.301 15.704 6.572 524 H LYS 64 H LYS 64 6.084 8.925 7.285 525 HA LYS 64 HA LYS 64 8.707 9.915 6.770 526 1HB LYS 64 HB2 LYS 64 7.322 8.558 8.924 527 2HB LYS 64 HB3 LYS 64 8.950 7.909 8.730 528 1HG LYS 64 HG2 LYS 64 9.831 9.751 9.668 529 2HG LYS 64 HG3 LYS 64 9.039 10.772 8.468 530 1HD LYS 64 HD2 LYS 64 7.665 11.534 10.078 531 2HD LYS 64 HD3 LYS 64 7.012 9.903 10.246 532 1HE LYS 64 HE2 LYS 64 9.533 10.845 11.635 533 2HE LYS 64 HE3 LYS 64 7.937 10.874 12.386 534 1HZ LYS 64 HZ1 LYS 64 8.200 8.357 11.312 535 2HZ LYS 64 HZ2 LYS 64 9.708 8.683 12.018 536 3HZ LYS 64 HZ3 LYS 64 8.294 8.778 12.956 537 H MET 65 H MET 65 7.208 6.834 6.096 538 HA MET 65 HA MET 65 9.573 5.257 5.816 539 1HB MET 65 HB2 MET 65 6.779 4.932 5.360 540 2HB MET 65 HB3 MET 65 7.619 4.442 3.889 541 1HG MET 65 HG2 MET 65 8.483 3.501 6.629 542 2HG MET 65 HG3 MET 65 7.300 2.621 5.661 543 1HE MET 65 HE1 MET 65 10.359 2.795 6.895 544 2HE MET 65 HE2 MET 65 10.305 1.101 6.417 545 3HE MET 65 HE3 MET 65 11.574 2.146 5.786 546 H VAL 66 H VAL 66 7.591 6.144 3.013 547 HA VAL 66 HA VAL 66 9.735 5.996 1.164 548 HB VAL 66 HB VAL 66 8.244 7.201 -0.388 549 1HG1 VAL 66 HG11 VAL 66 6.854 5.200 1.420 550 2HG1 VAL 66 HG12 VAL 66 6.283 5.669 -0.182 551 3HG1 VAL 66 HG13 VAL 66 7.821 4.825 -0.007 552 1HG2 VAL 66 HG21 VAL 66 7.458 8.743 1.580 553 2HG2 VAL 66 HG22 VAL 66 6.308 8.331 0.307 554 3HG2 VAL 66 HG23 VAL 66 6.253 7.483 1.854 555 H GLU 67 H GLU 67 8.885 8.522 3.384 556 HA GLU 67 HA GLU 67 10.100 10.711 1.958 557 1HB GLU 67 HB2 GLU 67 9.230 10.214 4.772 558 2HB GLU 67 HB3 GLU 67 10.337 11.553 4.476 559 1HG GLU 67 HG2 GLU 67 8.268 11.554 2.469 560 2HG GLU 67 HG3 GLU 67 7.537 11.529 4.074 561 H ASN 68 H ASN 68 11.333 8.327 4.263 562 HA ASN 68 HA ASN 68 14.035 9.542 4.068 563 1HB ASN 68 HB2 ASN 68 12.660 7.725 5.960 564 2HB ASN 68 HB3 ASN 68 14.360 7.361 5.668 565 1HD2 ASN 68 HD21 ASN 68 12.815 8.737 8.020 566 2HD2 ASN 68 HD22 ASN 68 13.727 10.138 8.309 567 H ALA 69 H ALA 69 12.161 7.179 2.544 568 HA ALA 69 HA ALA 69 14.063 5.118 2.045 569 1HB ALA 69 HB1 ALA 69 11.480 5.380 1.423 570 2HB ALA 69 HB2 ALA 69 12.155 5.924 -0.113 571 3HB ALA 69 HB3 ALA 69 12.539 4.315 0.499 572 H LYS 70 H LYS 70 16.049 5.463 1.172 573 HA LYS 70 HA LYS 70 16.704 7.788 -0.400 574 1HB LYS 70 HB2 LYS 70 18.264 5.197 -0.326 575 2HB LYS 70 HB3 LYS 70 18.882 6.823 -0.615 576 1HG LYS 70 HG2 LYS 70 18.013 7.398 1.730 577 2HG LYS 70 HG3 LYS 70 17.844 5.658 1.971 578 1HD LYS 70 HD2 LYS 70 20.046 5.462 2.376 579 2HD LYS 70 HD3 LYS 70 20.424 6.208 0.822 580 1HE LYS 70 HE2 LYS 70 19.725 8.423 2.142 581 2HE LYS 70 HE3 LYS 70 20.227 7.455 3.528 582 1HZ LYS 70 HZ1 LYS 70 22.335 7.031 2.386 583 2HZ LYS 70 HZ2 LYS 70 21.851 8.038 1.111 584 3HZ LYS 70 HZ3 LYS 70 22.088 8.688 2.663 585 H LYS 71 H LYS 71 15.032 4.971 -1.197 586 HA LYS 71 HA LYS 71 15.330 5.600 -4.076 587 1HB LYS 71 HB2 LYS 71 16.267 3.120 -2.745 588 2HB LYS 71 HB3 LYS 71 15.344 2.891 -4.231 589 1HG LYS 71 HG2 LYS 71 17.005 3.727 -5.528 590 2HG LYS 71 HG3 LYS 71 17.337 5.047 -4.404 591 1HD LYS 71 HD2 LYS 71 19.059 3.929 -3.467 592 2HD LYS 71 HD3 LYS 71 18.093 2.464 -3.284 593 1HE LYS 71 HE2 LYS 71 19.736 1.765 -4.793 594 2HE LYS 71 HE3 LYS 71 18.429 2.242 -5.876 595 1HZ LYS 71 HZ1 LYS 71 20.526 4.149 -5.042 596 2HZ LYS 71 HZ2 LYS 71 20.738 3.123 -6.380 597 3HZ LYS 71 HZ3 LYS 71 19.470 4.253 -6.364 598 H ILE 72 H ILE 72 13.324 5.648 -4.960 599 HA ILE 72 HA ILE 72 11.176 4.039 -3.632 600 HB ILE 72 HB ILE 72 10.949 6.719 -5.039 601 1HG1 ILE 72 HG12 ILE 72 9.961 7.005 -2.494 602 2HG1 ILE 72 HG13 ILE 72 11.283 5.865 -2.231 603 1HG2 ILE 72 HG21 ILE 72 9.030 4.659 -4.672 604 2HG2 ILE 72 HG22 ILE 72 8.640 5.930 -3.512 605 3HG2 ILE 72 HG23 ILE 72 8.745 6.307 -5.231 606 1HD1 ILE 72 HD11 ILE 72 11.810 8.230 -3.979 607 2HD1 ILE 72 HD12 ILE 72 11.711 8.497 -2.239 608 3HD1 ILE 72 HD13 ILE 72 12.903 7.374 -2.891 609 H GLU 73 H GLU 73 10.634 2.365 -4.952 610 HA GLU 73 HA GLU 73 10.603 2.890 -7.899 611 1HB GLU 73 HB2 GLU 73 11.449 0.410 -6.386 612 2HB GLU 73 HB3 GLU 73 11.109 0.408 -8.117 613 1HG GLU 73 HG2 GLU 73 13.328 0.915 -8.288 614 2HG GLU 73 HG3 GLU 73 12.770 2.554 -7.951 615 H VAL 74 H VAL 74 9.144 1.258 -9.051 616 HA VAL 74 HA VAL 74 6.810 0.463 -7.379 617 HB VAL 74 HB VAL 74 5.310 1.340 -9.193 618 1HG1 VAL 74 HG11 VAL 74 6.941 2.928 -7.331 619 2HG1 VAL 74 HG12 VAL 74 6.248 3.876 -8.646 620 3HG1 VAL 74 HG13 VAL 74 5.196 2.940 -7.585 621 1HG2 VAL 74 HG21 VAL 74 7.567 1.441 -10.703 622 2HG2 VAL 74 HG22 VAL 74 6.122 2.389 -11.057 623 3HG2 VAL 74 HG23 VAL 74 7.466 3.123 -10.180 624 H GLU 75 H GLU 75 5.856 -1.465 -8.083 625 HA GLU 75 HA GLU 75 7.105 -2.704 -10.505 626 1HB GLU 75 HB2 GLU 75 7.820 -3.936 -8.575 627 2HB GLU 75 HB3 GLU 75 6.187 -3.957 -7.906 628 1HG GLU 75 HG2 GLU 75 5.407 -5.445 -9.605 629 2HG GLU 75 HG3 GLU 75 6.865 -5.215 -10.573 630 H PHE 76 H PHE 76 5.518 -2.233 -12.028 631 HA PHE 76 HA PHE 76 2.689 -2.377 -11.498 632 1HB PHE 76 HB2 PHE 76 4.232 -2.533 -14.107 633 2HB PHE 76 HB3 PHE 76 2.480 -2.365 -13.992 634 HD1 PHE 76 HD1 PHE 76 1.460 -0.304 -13.133 635 HD2 PHE 76 HD2 PHE 76 5.718 -0.695 -13.537 636 HE1 PHE 76 HE1 PHE 76 1.709 2.150 -12.884 637 HE2 PHE 76 HE2 PHE 76 5.968 1.758 -13.288 638 HZ PHE 76 HZ PHE 76 3.964 3.182 -12.962 639 H ASP 77 H ASP 77 1.378 -4.162 -11.454 640 HA ASP 77 HA ASP 77 2.530 -6.807 -11.613 641 1HB ASP 77 HB2 ASP 77 0.254 -5.762 -10.495 642 2HB ASP 77 HB3 ASP 77 -0.399 -6.595 -11.906 643 H LYS 78 H LYS 78 0.708 -8.320 -13.052 644 HA LYS 78 HA LYS 78 1.364 -7.482 -15.831 645 1HB LYS 78 HB2 LYS 78 0.984 -9.814 -16.437 646 2HB LYS 78 HB3 LYS 78 2.076 -9.751 -15.053 647 1HG LYS 78 HG2 LYS 78 -0.752 -9.819 -14.280 648 2HG LYS 78 HG3 LYS 78 -0.248 -11.247 -15.185 649 1HD LYS 78 HD2 LYS 78 1.871 -10.910 -13.480 650 2HD LYS 78 HD3 LYS 78 0.524 -10.370 -12.477 651 1HE LYS 78 HE2 LYS 78 0.138 -12.558 -12.063 652 2HE LYS 78 HE3 LYS 78 -0.474 -12.646 -13.715 653 1HZ LYS 78 HZ1 LYS 78 2.369 -12.753 -13.642 654 2HZ LYS 78 HZ2 LYS 78 1.691 -13.987 -12.697 655 3HZ LYS 78 HZ3 LYS 78 1.268 -13.844 -14.337 656 H GLY 79 H GLY 79 -1.066 -6.866 -13.852 657 1HA GLY 79 HA2 GLY 79 -3.216 -7.511 -15.822 658 2HA GLY 79 HA3 GLY 79 -3.496 -7.151 -14.117 659 H GLN 80 H GLN 80 -4.940 -5.418 -14.637 660 HA GLN 80 HA GLN 80 -4.559 -3.309 -16.416 661 1HB GLN 80 HB2 GLN 80 -5.552 -2.813 -13.609 662 2HB GLN 80 HB3 GLN 80 -6.082 -2.054 -15.110 663 1HG GLN 80 HG2 GLN 80 -6.787 -4.453 -15.818 664 2HG GLN 80 HG3 GLN 80 -6.673 -4.828 -14.097 665 1HE2 GLN 80 HE21 GLN 80 -9.081 -5.130 -14.134 666 2HE2 GLN 80 HE22 GLN 80 -10.092 -3.767 -14.090 667 H ARG 81 H ARG 81 -3.639 -1.161 -16.143 668 HA ARG 81 HA ARG 81 -1.268 -1.187 -14.331 669 1HB ARG 81 HB2 ARG 81 -1.120 -0.852 -16.927 670 2HB ARG 81 HB3 ARG 81 -1.666 0.786 -16.567 671 1HG ARG 81 HG2 ARG 81 0.216 0.914 -14.862 672 2HG ARG 81 HG3 ARG 81 0.826 -0.592 -15.545 673 1HD ARG 81 HD2 ARG 81 0.327 1.946 -17.127 674 2HD ARG 81 HD3 ARG 81 1.908 1.406 -16.562 675 HE ARG 81 HE ARG 81 1.622 -0.590 -18.046 676 1HH1 ARG 81 HH11 ARG 81 1.440 2.211 -19.481 677 2HH1 ARG 81 HH12 ARG 81 0.232 1.841 -20.667 678 1HH2 ARG 81 HH21 ARG 81 -0.746 -1.112 -19.133 679 2HH2 ARG 81 HH22 ARG 81 -1.005 -0.041 -20.469 680 H THR 82 H THR 82 -4.338 0.214 -14.768 681 HA THR 82 HA THR 82 -3.744 2.165 -12.612 682 HB THR 82 HB THR 82 -5.126 3.886 -13.893 683 HG1 THR 82 HG1 THR 82 -5.270 3.554 -16.106 684 1HG2 THR 82 HG21 THR 82 -2.438 3.416 -13.834 685 2HG2 THR 82 HG22 THR 82 -2.744 3.415 -15.572 686 3HG2 THR 82 HG23 THR 82 -3.179 4.822 -14.600 687 H ASP 83 H ASP 83 -5.840 3.046 -11.696 688 HA ASP 83 HA ASP 83 -7.843 0.855 -11.651 689 1HB ASP 83 HB2 ASP 83 -6.789 2.685 -9.708 690 2HB ASP 83 HB3 ASP 83 -8.529 2.943 -9.839 691 H LYS 84 H LYS 84 -10.077 2.381 -10.844 692 HA LYS 84 HA LYS 84 -11.052 3.286 -13.411 693 1HB LYS 84 HB2 LYS 84 -12.461 4.057 -10.891 694 2HB LYS 84 HB3 LYS 84 -13.120 3.418 -12.394 695 1HG LYS 84 HG2 LYS 84 -11.936 1.218 -11.792 696 2HG LYS 84 HG3 LYS 84 -11.736 1.905 -10.180 697 1HD LYS 84 HD2 LYS 84 -14.456 2.023 -11.407 698 2HD LYS 84 HD3 LYS 84 -13.890 0.462 -10.810 699 1HE LYS 84 HE2 LYS 84 -13.307 1.612 -8.634 700 2HE LYS 84 HE3 LYS 84 -14.136 3.043 -9.245 701 1HZ LYS 84 HZ1 LYS 84 -15.712 0.696 -9.579 702 2HZ LYS 84 HZ2 LYS 84 -15.283 0.917 -7.950 703 3HZ LYS 84 HZ3 LYS 84 -16.099 2.147 -8.791 704 H TYR 85 H TYR 85 -9.869 4.869 -10.491 705 HA TYR 85 HA TYR 85 -10.521 7.547 -11.466 706 1HB TYR 85 HB2 TYR 85 -8.816 6.585 -9.150 707 2HB TYR 85 HB3 TYR 85 -9.182 8.279 -9.475 708 HD1 TYR 85 HD1 TYR 85 -11.568 9.069 -9.438 709 HD2 TYR 85 HD2 TYR 85 -10.430 5.134 -8.143 710 HE1 TYR 85 HE1 TYR 85 -13.740 8.826 -8.266 711 HE2 TYR 85 HE2 TYR 85 -12.601 4.891 -6.971 712 HH TYR 85 HH TYR 85 -14.818 7.582 -6.630 713 H GLY 86 H GLY 86 -8.255 5.356 -12.432 714 1HA GLY 86 HA2 GLY 86 -6.484 5.720 -13.969 715 2HA GLY 86 HA3 GLY 86 -6.630 7.454 -13.681 716 H ARG 87 H ARG 87 -6.445 5.471 -10.868 717 HA ARG 87 HA ARG 87 -3.887 6.697 -10.153 718 1HB ARG 87 HB2 ARG 87 -5.896 4.948 -8.786 719 2HB ARG 87 HB3 ARG 87 -4.254 5.001 -8.139 720 1HG ARG 87 HG2 ARG 87 -4.427 7.205 -7.502 721 2HG ARG 87 HG3 ARG 87 -5.516 7.610 -8.829 722 1HD ARG 87 HD2 ARG 87 -6.592 7.634 -6.536 723 2HD ARG 87 HD3 ARG 87 -7.386 6.586 -7.712 724 HE ARG 87 HE ARG 87 -5.493 5.534 -5.645 725 1HH1 ARG 87 HH11 ARG 87 -8.734 5.794 -6.047 726 2HH1 ARG 87 HH12 ARG 87 -9.081 4.097 -6.107 727 1HH2 ARG 87 HH21 ARG 87 -5.754 3.158 -6.388 728 2HH2 ARG 87 HH22 ARG 87 -7.393 2.605 -6.303 729 H GLY 88 H GLY 88 -1.897 5.746 -10.325 730 1HA GLY 88 HA2 GLY 88 -1.570 3.376 -11.908 731 2HA GLY 88 HA3 GLY 88 -0.285 4.186 -11.013 732 H LEU 89 H LEU 89 -1.292 1.255 -11.304 733 HA LEU 89 HA LEU 89 -1.439 0.671 -8.372 734 1HB LEU 89 HB2 LEU 89 -2.399 -0.941 -10.754 735 2HB LEU 89 HB3 LEU 89 -2.388 -1.541 -9.096 736 HG LEU 89 HG LEU 89 -3.802 1.002 -9.931 737 1HD1 LEU 89 HD11 LEU 89 -4.705 -1.105 -11.030 738 2HD1 LEU 89 HD12 LEU 89 -5.057 -1.705 -9.409 739 3HD1 LEU 89 HD13 LEU 89 -5.854 -0.248 -10.002 740 1HD2 LEU 89 HD21 LEU 89 -3.081 -0.052 -7.429 741 2HD2 LEU 89 HD22 LEU 89 -4.244 1.239 -7.729 742 3HD2 LEU 89 HD23 LEU 89 -4.794 -0.433 -7.606 743 H ALA 90 H ALA 90 0.446 -0.110 -7.571 744 HA ALA 90 HA ALA 90 1.914 -2.227 -8.877 745 1HB ALA 90 HB1 ALA 90 2.911 0.602 -9.109 746 2HB ALA 90 HB2 ALA 90 4.058 -0.734 -9.014 747 3HB ALA 90 HB3 ALA 90 2.888 -0.669 -10.332 748 H TYR 91 H TYR 91 3.473 -3.129 -7.459 749 HA TYR 91 HA TYR 91 3.102 -2.491 -4.657 750 1HB TYR 91 HB2 TYR 91 5.240 -4.239 -5.912 751 2HB TYR 91 HB3 TYR 91 4.674 -4.291 -4.242 752 HD1 TYR 91 HD1 TYR 91 2.475 -5.213 -3.676 753 HD2 TYR 91 HD2 TYR 91 3.873 -5.116 -7.738 754 HE1 TYR 91 HE1 TYR 91 0.676 -6.787 -4.334 755 HE2 TYR 91 HE2 TYR 91 2.073 -6.690 -8.394 756 HH TYR 91 HH TYR 91 0.665 -8.467 -7.206 757 H ILE 92 H ILE 92 4.002 -0.685 -3.796 758 HA ILE 92 HA ILE 92 6.348 0.578 -4.975 759 HB ILE 92 HB ILE 92 4.830 1.140 -2.412 760 1HG1 ILE 92 HG12 ILE 92 4.826 2.632 -5.050 761 2HG1 ILE 92 HG13 ILE 92 3.626 1.410 -4.630 762 1HG2 ILE 92 HG21 ILE 92 7.374 1.935 -2.889 763 2HG2 ILE 92 HG22 ILE 92 6.497 3.217 -3.724 764 3HG2 ILE 92 HG23 ILE 92 6.208 2.923 -2.010 765 1HD1 ILE 92 HD11 ILE 92 4.194 3.787 -2.851 766 2HD1 ILE 92 HD12 ILE 92 2.980 3.834 -4.129 767 3HD1 ILE 92 HD13 ILE 92 2.812 2.694 -2.793 768 H TYR 93 H TYR 93 8.444 0.618 -4.140 769 HA TYR 93 HA TYR 93 8.970 -1.135 -1.775 770 1HB TYR 93 HB2 TYR 93 10.486 -0.996 -4.396 771 2HB TYR 93 HB3 TYR 93 11.112 -1.789 -2.950 772 HD1 TYR 93 HD1 TYR 93 8.371 -1.828 -5.456 773 HD2 TYR 93 HD2 TYR 93 10.310 -3.932 -2.253 774 HE1 TYR 93 HE1 TYR 93 7.072 -3.866 -6.010 775 HE2 TYR 93 HE2 TYR 93 9.012 -5.971 -2.807 776 HH TYR 93 HH TYR 93 7.735 -6.945 -4.446 777 H ALA 94 H ALA 94 10.096 -0.075 -0.215 778 HA ALA 94 HA ALA 94 11.595 2.386 -1.018 779 1HB ALA 94 HB1 ALA 94 9.563 1.990 0.955 780 2HB ALA 94 HB2 ALA 94 11.073 2.352 1.793 781 3HB ALA 94 HB3 ALA 94 10.446 3.471 0.583 782 H ASP 95 H ASP 95 13.759 2.308 -0.680 783 HA ASP 95 HA ASP 95 15.843 1.641 0.156 784 1HB ASP 95 HB2 ASP 95 14.190 0.504 2.432 785 2HB ASP 95 HB3 ASP 95 15.935 0.757 2.448 786 H GLY 96 H GLY 96 13.882 -0.218 -1.382 787 1HA GLY 96 HA2 GLY 96 14.398 -2.278 -2.462 788 2HA GLY 96 HA3 GLY 96 15.678 -2.547 -1.280 789 H LYS 97 H LYS 97 12.558 -1.649 -0.078 790 HA LYS 97 HA LYS 97 12.016 -4.509 0.605 791 1HB LYS 97 HB2 LYS 97 12.858 -2.646 2.434 792 2HB LYS 97 HB3 LYS 97 11.105 -2.502 2.567 793 1HG LYS 97 HG2 LYS 97 11.316 -4.277 3.983 794 2HG LYS 97 HG3 LYS 97 11.379 -5.211 2.488 795 1HD LYS 97 HD2 LYS 97 13.998 -4.278 2.861 796 2HD LYS 97 HD3 LYS 97 13.462 -4.785 4.465 797 1HE LYS 97 HE2 LYS 97 12.525 -6.765 2.696 798 2HE LYS 97 HE3 LYS 97 14.180 -6.423 2.189 799 1HZ LYS 97 HZ1 LYS 97 14.704 -6.561 4.674 800 2HZ LYS 97 HZ2 LYS 97 13.205 -7.348 4.817 801 3HZ LYS 97 HZ3 LYS 97 14.426 -8.011 3.838 802 H MET 98 H MET 98 9.708 -4.941 1.032 803 HA MET 98 HA MET 98 8.010 -3.433 -0.814 804 1HB MET 98 HB2 MET 98 7.819 -5.884 -0.661 805 2HB MET 98 HB3 MET 98 7.364 -5.748 1.039 806 1HG MET 98 HG2 MET 98 5.247 -5.788 0.162 807 2HG MET 98 HG3 MET 98 5.550 -4.062 -0.038 808 1HE MET 98 HE1 MET 98 6.407 -7.476 -1.655 809 2HE MET 98 HE2 MET 98 4.644 -7.332 -1.663 810 3HE MET 98 HE3 MET 98 5.535 -7.377 -3.184 811 H VAL 99 H VAL 99 7.119 -1.543 -0.133 812 HA VAL 99 HA VAL 99 6.881 -0.739 2.594 813 HB VAL 99 HB VAL 99 5.421 0.216 0.113 814 1HG1 VAL 99 HG11 VAL 99 5.421 1.197 2.966 815 2HG1 VAL 99 HG12 VAL 99 5.132 2.307 1.625 816 3HG1 VAL 99 HG13 VAL 99 4.047 0.942 1.889 817 1HG2 VAL 99 HG21 VAL 99 8.082 0.451 0.838 818 2HG2 VAL 99 HG22 VAL 99 7.229 1.532 -0.263 819 3HG2 VAL 99 HG23 VAL 99 7.381 1.952 1.443 820 H ASN 100 H ASN 100 4.394 -1.960 0.327 821 HA ASN 100 HA ASN 100 2.199 -1.937 2.089 822 1HB ASN 100 HB2 ASN 100 2.838 -4.038 -0.005 823 2HB ASN 100 HB3 ASN 100 1.246 -3.711 0.682 824 1HD2 ASN 100 HD21 ASN 100 0.544 -3.177 -1.583 825 2HD2 ASN 100 HD22 ASN 100 0.915 -1.651 -2.228 826 H GLU 101 H GLU 101 4.872 -4.228 1.844 827 HA GLU 101 HA GLU 101 3.705 -6.189 3.627 828 1HB GLU 101 HB2 GLU 101 5.663 -6.482 1.944 829 2HB GLU 101 HB3 GLU 101 6.668 -5.804 3.225 830 1HG GLU 101 HG2 GLU 101 5.862 -7.561 4.774 831 2HG GLU 101 HG3 GLU 101 4.894 -8.252 3.472 832 H ALA 102 H ALA 102 5.791 -3.371 4.035 833 HA ALA 102 HA ALA 102 6.499 -3.807 6.765 834 1HB ALA 102 HB1 ALA 102 7.176 -1.930 4.944 835 2HB ALA 102 HB2 ALA 102 5.993 -1.014 5.878 836 3HB ALA 102 HB3 ALA 102 7.407 -1.698 6.678 837 H LEU 103 H LEU 103 3.750 -2.109 5.289 838 HA LEU 103 HA LEU 103 2.540 -1.227 7.716 839 1HB LEU 103 HB2 LEU 103 1.374 -1.924 5.009 840 2HB LEU 103 HB3 LEU 103 0.399 -1.269 6.326 841 HG LEU 103 HG LEU 103 2.879 0.232 5.868 842 1HD1 LEU 103 HD11 LEU 103 0.784 0.015 3.689 843 2HD1 LEU 103 HD12 LEU 103 1.945 1.339 3.796 844 3HD1 LEU 103 HD13 LEU 103 2.510 -0.313 3.544 845 1HD2 LEU 103 HD21 LEU 103 0.798 0.816 7.271 846 2HD2 LEU 103 HD22 LEU 103 1.435 2.090 6.231 847 3HD2 LEU 103 HD23 LEU 103 0.009 1.178 5.736 848 H VAL 104 H VAL 104 1.809 -4.133 5.744 849 HA VAL 104 HA VAL 104 -0.024 -5.278 7.601 850 HB VAL 104 HB VAL 104 1.794 -6.598 5.564 851 1HG1 VAL 104 HG11 VAL 104 -0.189 -7.678 7.502 852 2HG1 VAL 104 HG12 VAL 104 -0.263 -8.318 5.861 853 3HG1 VAL 104 HG13 VAL 104 1.228 -8.453 6.794 854 1HG2 VAL 104 HG21 VAL 104 -0.586 -5.019 5.364 855 2HG2 VAL 104 HG22 VAL 104 0.291 -5.833 4.068 856 3HG2 VAL 104 HG23 VAL 104 -0.993 -6.680 4.929 857 H ARG 105 H ARG 105 3.430 -5.043 7.634 858 HA ARG 105 HA ARG 105 3.921 -7.280 9.409 859 1HB ARG 105 HB2 ARG 105 5.500 -5.504 7.947 860 2HB ARG 105 HB3 ARG 105 5.844 -5.096 9.628 861 1HG ARG 105 HG2 ARG 105 5.798 -7.881 9.620 862 2HG ARG 105 HG3 ARG 105 6.608 -7.470 8.109 863 1HD ARG 105 HD2 ARG 105 8.472 -7.194 9.360 864 2HD ARG 105 HD3 ARG 105 7.730 -5.696 9.921 865 HE ARG 105 HE ARG 105 7.212 -8.247 11.381 866 1HH1 ARG 105 HH11 ARG 105 9.358 -5.668 11.300 867 2HH1 ARG 105 HH12 ARG 105 9.128 -5.195 12.950 868 1HH2 ARG 105 HH21 ARG 105 6.471 -7.360 13.478 869 2HH2 ARG 105 HH22 ARG 105 7.493 -6.153 14.184 870 H GLN 106 H GLN 106 3.225 -3.839 9.858 871 HA GLN 106 HA GLN 106 3.415 -4.203 12.804 872 1HB GLN 106 HB2 GLN 106 4.358 -2.166 11.383 873 2HB GLN 106 HB3 GLN 106 2.698 -1.589 11.533 874 1HG GLN 106 HG2 GLN 106 2.804 -1.608 13.922 875 2HG GLN 106 HG3 GLN 106 4.313 -2.523 13.913 876 1HE2 GLN 106 HE21 GLN 106 2.975 0.667 13.863 877 2HE2 GLN 106 HE22 GLN 106 4.430 1.507 13.623 878 H GLY 107 H GLY 107 1.187 -5.037 10.744 879 1HA GLY 107 HA2 GLY 107 -1.157 -5.163 10.766 880 2HA GLY 107 HA3 GLY 107 -1.009 -4.933 12.509 881 H LEU 108 H LEU 108 -0.307 -2.776 9.743 882 HA LEU 108 HA LEU 108 -1.933 -0.691 11.123 883 1HB LEU 108 HB2 LEU 108 0.501 -0.657 9.436 884 2HB LEU 108 HB3 LEU 108 -0.651 0.642 9.124 885 HG LEU 108 HG LEU 108 0.418 -0.082 11.867 886 1HD1 LEU 108 HD11 LEU 108 1.600 1.419 9.721 887 2HD1 LEU 108 HD12 LEU 108 1.188 2.526 11.032 888 3HD1 LEU 108 HD13 LEU 108 2.234 1.140 11.343 889 1HD2 LEU 108 HD21 LEU 108 -1.755 1.593 10.892 890 2HD2 LEU 108 HD22 LEU 108 -1.354 1.143 12.549 891 3HD2 LEU 108 HD23 LEU 108 -0.577 2.539 11.801 892 H ALA 109 H ALA 109 -1.895 -2.773 8.389 893 HA ALA 109 HA ALA 109 -4.358 -1.447 7.390 894 1HB ALA 109 HB1 ALA 109 -1.856 -1.968 5.782 895 2HB ALA 109 HB2 ALA 109 -3.437 -1.844 5.012 896 3HB ALA 109 HB3 ALA 109 -2.783 -0.474 5.909 897 H LYS 110 H LYS 110 -5.615 -2.906 5.966 898 HA LYS 110 HA LYS 110 -4.989 -5.776 6.539 899 1HB LYS 110 HB2 LYS 110 -7.756 -4.926 5.797 900 2HB LYS 110 HB3 LYS 110 -7.232 -6.201 6.896 901 1HG LYS 110 HG2 LYS 110 -6.725 -4.632 8.628 902 2HG LYS 110 HG3 LYS 110 -6.864 -3.263 7.524 903 1HD LYS 110 HD2 LYS 110 -8.932 -3.193 8.597 904 2HD LYS 110 HD3 LYS 110 -9.312 -4.164 7.174 905 1HE LYS 110 HE2 LYS 110 -8.890 -6.226 8.523 906 2HE LYS 110 HE3 LYS 110 -8.660 -5.207 9.944 907 1HZ LYS 110 HZ1 LYS 110 -11.105 -4.969 8.315 908 2HZ LYS 110 HZ2 LYS 110 -10.973 -6.194 9.486 909 3HZ LYS 110 HZ3 LYS 110 -10.863 -4.565 9.948 910 H VAL 111 H VAL 111 -5.488 -7.302 4.824 911 HA VAL 111 HA VAL 111 -4.862 -6.276 2.181 912 HB VAL 111 HB VAL 111 -5.655 -9.007 3.215 913 1HG1 VAL 111 HG11 VAL 111 -5.229 -8.023 0.402 914 2HG1 VAL 111 HG12 VAL 111 -4.814 -9.682 0.834 915 3HG1 VAL 111 HG13 VAL 111 -6.473 -9.111 1.018 916 1HG2 VAL 111 HG21 VAL 111 -3.092 -7.746 2.206 917 2HG2 VAL 111 HG22 VAL 111 -3.415 -8.374 3.823 918 3HG2 VAL 111 HG23 VAL 111 -3.277 -9.482 2.457 919 H ALA 112 H ALA 112 -6.275 -6.330 0.324 920 HA ALA 112 HA ALA 112 -9.022 -7.118 0.441 921 1HB ALA 112 HB1 ALA 112 -8.507 -4.155 0.839 922 2HB ALA 112 HB2 ALA 112 -10.083 -4.880 0.526 923 3HB ALA 112 HB3 ALA 112 -9.227 -5.246 2.023 924 H TYR 113 H TYR 113 -10.266 -5.743 -1.408 925 HA TYR 113 HA TYR 113 -10.346 -5.555 -3.753 926 1HB TYR 113 HB2 TYR 113 -7.932 -3.868 -3.036 927 2HB TYR 113 HB3 TYR 113 -8.719 -3.846 -4.615 928 HD1 TYR 113 HD1 TYR 113 -11.288 -3.422 -4.637 929 HD2 TYR 113 HD2 TYR 113 -8.732 -2.479 -1.316 930 HE1 TYR 113 HE1 TYR 113 -12.995 -1.848 -3.770 931 HE2 TYR 113 HE2 TYR 113 -10.440 -0.905 -0.448 932 HH TYR 113 HH TYR 113 -12.359 0.453 -1.440 933 H VAL 114 H VAL 114 -9.620 -7.962 -3.665 934 HA VAL 114 HA VAL 114 -6.913 -8.265 -4.886 935 HB VAL 114 HB VAL 114 -8.684 -10.495 -3.871 936 1HG1 VAL 114 HG11 VAL 114 -6.296 -10.477 -5.281 937 2HG1 VAL 114 HG12 VAL 114 -5.770 -10.673 -3.609 938 3HG1 VAL 114 HG13 VAL 114 -6.904 -11.823 -4.317 939 1HG2 VAL 114 HG21 VAL 114 -8.233 -8.699 -2.118 940 2HG2 VAL 114 HG22 VAL 114 -7.646 -10.314 -1.713 941 3HG2 VAL 114 HG23 VAL 114 -6.520 -9.084 -2.289 942 H TYR 115 H TYR 115 -7.372 -7.802 -7.056 943 HA TYR 115 HA TYR 115 -9.392 -9.591 -8.351 944 1HB TYR 115 HB2 TYR 115 -8.461 -6.895 -9.376 945 2HB TYR 115 HB3 TYR 115 -9.808 -7.864 -9.977 946 HD1 TYR 115 HD1 TYR 115 -8.604 -5.760 -7.184 947 HD2 TYR 115 HD2 TYR 115 -11.925 -7.946 -8.809 948 HE1 TYR 115 HE1 TYR 115 -10.118 -4.680 -5.542 949 HE2 TYR 115 HE2 TYR 115 -13.439 -6.867 -7.168 950 HH TYR 115 HH TYR 115 -13.443 -5.709 -5.157 951 H LYS 116 H LYS 116 -8.617 -10.921 -9.926 952 HA LYS 116 HA LYS 116 -5.732 -10.872 -10.493 953 1HB LYS 116 HB2 LYS 116 -7.587 -12.746 -11.900 954 2HB LYS 116 HB3 LYS 116 -5.990 -13.053 -11.219 955 1HG LYS 116 HG2 LYS 116 -7.114 -12.657 -8.919 956 2HG LYS 116 HG3 LYS 116 -8.637 -12.876 -9.785 957 1HD LYS 116 HD2 LYS 116 -6.823 -14.947 -10.589 958 2HD LYS 116 HD3 LYS 116 -6.872 -14.894 -8.826 959 1HE LYS 116 HE2 LYS 116 -8.678 -16.297 -9.318 960 2HE LYS 116 HE3 LYS 116 -9.465 -14.727 -9.166 961 1HZ LYS 116 HZ1 LYS 116 -9.270 -14.475 -11.585 962 2HZ LYS 116 HZ2 LYS 116 -8.613 -16.034 -11.693 963 3HZ LYS 116 HZ3 LYS 116 -10.211 -15.823 -11.155 964 HA PRO 117 HA PRO 117 -4.659 -11.986 -11.972 965 1HB PRO 117 HB2 PRO 117 -2.720 -11.424 -13.808 966 2HB PRO 117 HB3 PRO 117 -4.054 -12.543 -14.130 967 1HG PRO 117 HG2 PRO 117 -3.598 -9.830 -15.208 968 2HG PRO 117 HG3 PRO 117 -4.599 -11.139 -15.851 969 1HD PRO 117 HD2 PRO 117 -5.470 -8.833 -14.361 970 2HD PRO 117 HD3 PRO 117 -6.468 -10.170 -14.974 971 H ASN 118 H ASN 118 -5.148 -9.112 -11.143 972 HA ASN 118 HA ASN 118 -2.390 -8.073 -10.847 973 1HB ASN 118 HB2 ASN 118 -5.123 -6.962 -10.627 974 2HB ASN 118 HB3 ASN 118 -3.959 -6.327 -9.463 975 1HD2 ASN 118 HD21 ASN 118 -4.413 -4.298 -10.938 976 2HD2 ASN 118 HD22 ASN 118 -3.388 -4.109 -12.278 977 H ASN 119 H ASN 119 -2.179 -10.240 -9.484 978 HA ASN 119 HA ASN 119 -2.135 -9.399 -6.684 979 1HB ASN 119 HB2 ASN 119 -3.553 -11.129 -5.801 980 2HB ASN 119 HB3 ASN 119 -4.477 -10.308 -7.059 981 1HD2 ASN 119 HD21 ASN 119 -5.489 -11.724 -8.475 982 2HD2 ASN 119 HD22 ASN 119 -4.938 -13.281 -8.864 983 H THR 120 H THR 120 -0.320 -10.360 -8.881 984 HA THR 120 HA THR 120 0.600 -12.973 -8.591 985 HB THR 120 HB THR 120 2.490 -10.616 -8.694 986 HG1 THR 120 HG1 THR 120 0.588 -11.517 -10.514 987 1HG2 THR 120 HG21 THR 120 2.520 -13.391 -9.913 988 2HG2 THR 120 HG22 THR 120 3.751 -12.158 -10.176 989 3HG2 THR 120 HG23 THR 120 3.514 -12.835 -8.566 990 H HIS 121 H HIS 121 0.833 -10.336 -6.307 991 HA HIS 121 HA HIS 121 2.460 -12.089 -4.511 992 1HB HIS 121 HB2 HIS 121 2.228 -9.101 -4.790 993 2HB HIS 121 HB3 HIS 121 2.761 -9.812 -3.266 994 HD1 HIS 121 HD1 HIS 121 4.794 -11.689 -3.638 995 HD2 HIS 121 HD2 HIS 121 4.315 -8.753 -6.558 996 HE1 HIS 121 HE1 HIS 121 6.969 -11.607 -4.934 997 H GLU 122 H GLU 122 -0.131 -12.820 -4.564 998 HA GLU 122 HA GLU 122 -1.611 -11.333 -2.483 999 1HB GLU 122 HB2 GLU 122 -2.837 -12.192 -4.445 1000 2HB GLU 122 HB3 GLU 122 -2.347 -13.835 -4.034 1001 1HG GLU 122 HG2 GLU 122 -3.414 -13.122 -1.672 1002 2HG GLU 122 HG3 GLU 122 -4.367 -12.078 -2.728 1003 H GLN 123 H GLN 123 0.098 -14.398 -2.908 1004 HA GLN 123 HA GLN 123 -0.751 -15.549 -0.401 1005 1HB GLN 123 HB2 GLN 123 0.591 -16.502 -2.581 1006 2HB GLN 123 HB3 GLN 123 1.913 -16.321 -1.428 1007 1HG GLN 123 HG2 GLN 123 0.300 -17.509 0.244 1008 2HG GLN 123 HG3 GLN 123 -0.559 -18.025 -1.207 1009 1HE2 GLN 123 HE21 GLN 123 0.084 -20.275 -0.992 1010 2HE2 GLN 123 HE22 GLN 123 1.689 -20.772 -1.233 1011 H LEU 124 H LEU 124 2.022 -13.546 -1.366 1012 HA LEU 124 HA LEU 124 3.494 -13.747 1.060 1013 1HB LEU 124 HB2 LEU 124 4.056 -12.560 -1.235 1014 2HB LEU 124 HB3 LEU 124 3.374 -11.146 -0.430 1015 HG LEU 124 HG LEU 124 4.932 -11.520 1.479 1016 1HD1 LEU 124 HD11 LEU 124 5.326 -14.012 0.088 1017 2HD1 LEU 124 HD12 LEU 124 6.870 -13.171 0.233 1018 3HD1 LEU 124 HD13 LEU 124 5.923 -13.531 1.676 1019 1HD2 LEU 124 HD21 LEU 124 5.824 -10.969 -1.312 1020 2HD2 LEU 124 HD22 LEU 124 5.879 -9.929 0.111 1021 3HD2 LEU 124 HD23 LEU 124 7.085 -11.198 -0.101 1022 H LEU 125 H LEU 125 1.286 -11.095 0.071 1023 HA LEU 125 HA LEU 125 1.201 -9.849 2.626 1024 1HB LEU 125 HB2 LEU 125 -0.904 -9.907 0.441 1025 2HB LEU 125 HB3 LEU 125 -0.894 -8.789 1.806 1026 HG LEU 125 HG LEU 125 1.156 -9.004 -0.411 1027 1HD1 LEU 125 HD11 LEU 125 -1.161 -7.541 -0.252 1028 2HD1 LEU 125 HD12 LEU 125 0.020 -6.408 0.404 1029 3HD1 LEU 125 HD13 LEU 125 0.245 -7.081 -1.210 1030 1HD2 LEU 125 HD21 LEU 125 1.250 -7.472 2.206 1031 2HD2 LEU 125 HD22 LEU 125 2.374 -8.721 1.668 1032 3HD2 LEU 125 HD23 LEU 125 2.328 -7.162 0.845 1033 H ARG 126 H ARG 126 -0.518 -12.624 1.339 1034 HA ARG 126 HA ARG 126 -2.615 -12.727 3.288 1035 1HB ARG 126 HB2 ARG 126 -1.442 -14.543 1.284 1036 2HB ARG 126 HB3 ARG 126 -2.129 -15.365 2.685 1037 1HG ARG 126 HG2 ARG 126 -3.915 -13.265 1.903 1038 2HG ARG 126 HG3 ARG 126 -3.519 -14.222 0.476 1039 1HD ARG 126 HD2 ARG 126 -4.220 -15.598 3.056 1040 2HD ARG 126 HD3 ARG 126 -5.500 -14.990 2.005 1041 HE ARG 126 HE ARG 126 -3.487 -16.667 0.669 1042 1HH1 ARG 126 HH11 ARG 126 -6.485 -16.130 0.034 1043 2HH1 ARG 126 HH12 ARG 126 -7.142 -17.703 0.337 1044 1HH2 ARG 126 HH21 ARG 126 -4.343 -18.838 2.036 1045 2HH2 ARG 126 HH22 ARG 126 -5.931 -19.235 1.470 1046 H LYS 127 H LYS 127 0.672 -14.079 3.233 1047 HA LYS 127 HA LYS 127 0.397 -15.407 5.794 1048 1HB LYS 127 HB2 LYS 127 2.083 -16.267 4.343 1049 2HB LYS 127 HB3 LYS 127 2.769 -14.665 4.073 1050 1HG LYS 127 HG2 LYS 127 4.038 -14.785 5.939 1051 2HG LYS 127 HG3 LYS 127 2.690 -15.382 6.907 1052 1HD LYS 127 HD2 LYS 127 3.874 -17.325 6.943 1053 2HD LYS 127 HD3 LYS 127 3.207 -17.553 5.326 1054 1HE LYS 127 HE2 LYS 127 5.425 -15.880 4.953 1055 2HE LYS 127 HE3 LYS 127 5.963 -17.087 6.120 1056 1HZ LYS 127 HZ1 LYS 127 4.939 -18.772 4.565 1057 2HZ LYS 127 HZ2 LYS 127 4.858 -17.528 3.412 1058 3HZ LYS 127 HZ3 LYS 127 6.362 -18.017 4.024 1059 H SER 128 H SER 128 2.475 -12.652 4.884 1060 HA SER 128 HA SER 128 3.178 -11.732 7.391 1061 1HB SER 128 HB2 SER 128 2.350 -10.059 5.001 1062 2HB SER 128 HB3 SER 128 3.197 -9.428 6.410 1063 HG SER 128 HG SER 128 4.223 -11.689 5.121 1064 H GLU 129 H GLU 129 0.047 -11.372 5.799 1065 HA GLU 129 HA GLU 129 -1.049 -9.528 7.731 1066 1HB GLU 129 HB2 GLU 129 -2.030 -9.844 5.479 1067 2HB GLU 129 HB3 GLU 129 -2.481 -11.493 5.916 1068 1HG GLU 129 HG2 GLU 129 -4.444 -10.541 6.563 1069 2HG GLU 129 HG3 GLU 129 -3.540 -10.090 8.008 1070 H ALA 130 H ALA 130 -1.491 -13.061 7.296 1071 HA ALA 130 HA ALA 130 -3.085 -13.559 9.542 1072 1HB ALA 130 HB1 ALA 130 -2.275 -15.233 7.786 1073 2HB ALA 130 HB2 ALA 130 -0.791 -15.355 8.730 1074 3HB ALA 130 HB3 ALA 130 -2.332 -15.825 9.447 1075 H GLN 131 H GLN 131 0.424 -13.129 9.377 1076 HA GLN 131 HA GLN 131 0.936 -13.764 12.134 1077 1HB GLN 131 HB2 GLN 131 2.587 -13.454 10.104 1078 2HB GLN 131 HB3 GLN 131 2.598 -11.768 10.626 1079 1HG GLN 131 HG2 GLN 131 4.152 -12.366 12.150 1080 2HG GLN 131 HG3 GLN 131 2.863 -13.221 12.996 1081 1HE2 GLN 131 HE21 GLN 131 2.369 -15.449 11.506 1082 2HE2 GLN 131 HE22 GLN 131 3.771 -16.383 11.298 1083 H ALA 132 H ALA 132 0.184 -10.737 10.434 1084 HA ALA 132 HA ALA 132 0.559 -8.985 12.656 1085 1HB ALA 132 HB1 ALA 132 0.041 -8.518 10.091 1086 2HB ALA 132 HB2 ALA 132 -1.624 -8.461 10.671 1087 3HB ALA 132 HB3 ALA 132 -0.421 -7.352 11.330 1088 H LYS 133 H LYS 133 -1.969 -11.243 11.868 1089 HA LYS 133 HA LYS 133 -3.948 -10.045 13.656 1090 1HB LYS 133 HB2 LYS 133 -3.763 -12.474 11.943 1091 2HB LYS 133 HB3 LYS 133 -4.854 -12.562 13.327 1092 1HG LYS 133 HG2 LYS 133 -6.137 -10.712 12.574 1093 2HG LYS 133 HG3 LYS 133 -4.900 -10.224 11.416 1094 1HD LYS 133 HD2 LYS 133 -6.859 -11.388 10.355 1095 2HD LYS 133 HD3 LYS 133 -5.316 -12.189 10.055 1096 1HE LYS 133 HE2 LYS 133 -5.855 -14.006 11.342 1097 2HE LYS 133 HE3 LYS 133 -6.774 -13.042 12.498 1098 1HZ LYS 133 HZ1 LYS 133 -7.817 -13.329 9.774 1099 2HZ LYS 133 HZ2 LYS 133 -7.966 -14.645 10.832 1100 3HZ LYS 133 HZ3 LYS 133 -8.654 -13.147 11.241 1101 H LYS 134 H LYS 134 -1.706 -12.815 13.795 1102 HA LYS 134 HA LYS 134 -2.496 -13.688 16.410 1103 1HB LYS 134 HB2 LYS 134 -0.129 -14.115 14.629 1104 2HB LYS 134 HB3 LYS 134 0.010 -14.572 16.326 1105 1HG LYS 134 HG2 LYS 134 -2.483 -15.558 15.599 1106 2HG LYS 134 HG3 LYS 134 -1.489 -15.866 14.175 1107 1HD LYS 134 HD2 LYS 134 0.246 -16.869 15.720 1108 2HD LYS 134 HD3 LYS 134 -0.941 -16.750 17.020 1109 1HE LYS 134 HE2 LYS 134 -2.129 -17.960 14.669 1110 2HE LYS 134 HE3 LYS 134 -0.684 -18.845 15.158 1111 1HZ LYS 134 HZ1 LYS 134 -1.871 -18.378 17.516 1112 2HZ LYS 134 HZ2 LYS 134 -3.222 -18.566 16.509 1113 3HZ LYS 134 HZ3 LYS 134 -2.063 -19.804 16.613 1114 H GLU 135 H GLU 135 -0.277 -11.218 15.261 1115 HA GLU 135 HA GLU 135 0.844 -10.757 17.938 1116 1HB GLU 135 HB2 GLU 135 1.096 -9.050 15.445 1117 2HB GLU 135 HB3 GLU 135 2.116 -8.977 16.881 1118 1HG GLU 135 HG2 GLU 135 2.878 -11.286 16.464 1119 2HG GLU 135 HG3 GLU 135 1.857 -11.364 15.028 1120 H LYS 136 H LYS 136 -1.964 -9.875 16.260 1121 HA LYS 136 HA LYS 136 -3.542 -8.156 16.575 1122 1HB LYS 136 HB2 LYS 136 -2.612 -8.867 19.363 1123 2HB LYS 136 HB3 LYS 136 -3.932 -7.730 19.078 1124 1HG LYS 136 HG2 LYS 136 -5.183 -9.424 17.850 1125 2HG LYS 136 HG3 LYS 136 -3.842 -10.561 17.996 1126 1HD LYS 136 HD2 LYS 136 -4.141 -10.051 20.588 1127 2HD LYS 136 HD3 LYS 136 -5.780 -9.638 20.080 1128 1HE LYS 136 HE2 LYS 136 -5.745 -11.989 20.668 1129 2HE LYS 136 HE3 LYS 136 -5.910 -11.862 18.918 1130 1HZ LYS 136 HZ1 LYS 136 -3.303 -12.200 20.289 1131 2HZ LYS 136 HZ2 LYS 136 -4.224 -13.501 19.701 1132 3HZ LYS 136 HZ3 LYS 136 -3.621 -12.331 18.628 1133 H LEU 137 H LEU 137 -1.709 -6.768 15.500 1134 HA LEU 137 HA LEU 137 -0.661 -4.746 17.413 1135 1HB LEU 137 HB2 LEU 137 0.235 -5.850 14.855 1136 2HB LEU 137 HB3 LEU 137 0.304 -4.088 14.898 1137 HG LEU 137 HG LEU 137 1.271 -5.389 17.358 1138 1HD1 LEU 137 HD11 LEU 137 2.271 -6.200 14.710 1139 2HD1 LEU 137 HD12 LEU 137 3.528 -5.610 15.797 1140 3HD1 LEU 137 HD13 LEU 137 2.506 -6.963 16.283 1141 1HD2 LEU 137 HD21 LEU 137 2.145 -3.195 15.476 1142 2HD2 LEU 137 HD22 LEU 137 1.616 -3.055 17.152 1143 3HD2 LEU 137 HD23 LEU 137 3.193 -3.751 16.782 1144 H ASN 138 H ASN 138 -2.007 -3.052 17.721 1145 HA ASN 138 HA ASN 138 -3.414 -1.246 17.254 1146 1HB ASN 138 HB2 ASN 138 -2.459 -1.626 14.404 1147 2HB ASN 138 HB3 ASN 138 -3.135 -0.156 15.107 1148 1HD2 ASN 138 HD21 ASN 138 -0.229 -1.385 14.200 1149 2HD2 ASN 138 HD22 ASN 138 0.783 -0.643 15.344 1150 H ILE 139 H ILE 139 -4.318 -1.650 14.063 1151 HA ILE 139 HA ILE 139 -7.001 -2.012 14.404 1152 HB ILE 139 HB ILE 139 -5.374 -3.382 12.244 1153 1HG1 ILE 139 HG12 ILE 139 -6.664 -0.877 11.541 1154 2HG1 ILE 139 HG13 ILE 139 -5.550 -0.652 12.890 1155 1HG2 ILE 139 HG21 ILE 139 -8.223 -3.153 12.790 1156 2HG2 ILE 139 HG22 ILE 139 -7.806 -2.428 11.237 1157 3HG2 ILE 139 HG23 ILE 139 -7.397 -4.113 11.561 1158 1HD1 ILE 139 HD11 ILE 139 -4.499 -2.375 10.746 1159 2HD1 ILE 139 HD12 ILE 139 -4.802 -0.710 10.247 1160 3HD1 ILE 139 HD13 ILE 139 -3.722 -1.043 11.601 1161 H TRP 140 H TRP 140 -4.580 -4.596 14.528 1162 HA TRP 140 HA TRP 140 -6.667 -6.644 14.876 1163 1HB TRP 140 HB2 TRP 140 -3.665 -6.920 15.196 1164 2HB TRP 140 HB3 TRP 140 -4.832 -8.221 14.952 1165 HD1 TRP 140 HD1 TRP 140 -2.686 -5.800 13.114 1166 HE1 TRP 140 HE1 TRP 140 -3.118 -5.973 10.579 1167 HE3 TRP 140 HE3 TRP 140 -6.897 -8.691 13.131 1168 HZ2 TRP 140 HZ2 TRP 140 -5.001 -7.177 8.794 1169 HZ3 TRP 140 HZ3 TRP 140 -7.988 -9.333 11.000 1170 HH2 TRP 140 HH2 TRP 140 -7.046 -8.581 8.833 1171 H SER 141 H SER 141 -6.732 -4.587 16.864 1172 HA SER 141 HA SER 141 -5.561 -5.897 19.264 1173 1HB SER 141 HB2 SER 141 -5.311 -3.375 18.757 1174 2HB SER 141 HB3 SER 141 -7.005 -3.248 19.219 1175 HG SER 141 HG SER 141 -5.274 -4.673 20.887 1176 H GLU 142 H GLU 142 -8.482 -5.734 17.557 1177 HA GLU 142 HA GLU 142 -10.347 -5.736 19.744 1178 1HB GLU 142 HB2 GLU 142 -11.854 -6.856 18.012 1179 2HB GLU 142 HB3 GLU 142 -11.212 -5.278 17.564 1180 1HG GLU 142 HG2 GLU 142 -9.666 -6.192 16.059 1181 2HG GLU 142 HG3 GLU 142 -9.717 -7.781 16.824 1182 H ASP 143 H ASP 143 -11.867 -8.003 19.522 1183 HA ASP 143 HA ASP 143 -10.397 -9.909 21.075 1184 1HB ASP 143 HB2 ASP 143 -13.093 -9.503 20.314 1185 2HB ASP 143 HB3 ASP 143 -12.665 -11.126 19.769 1186 H ASN 144 H ASN 144 -10.526 -12.362 20.255 1187 HA ASN 144 HA ASN 144 -9.845 -12.613 17.395 1188 1HB ASN 144 HB2 ASN 144 -7.680 -12.028 18.309 1189 2HB ASN 144 HB3 ASN 144 -7.872 -13.189 19.624 1190 1HD2 ASN 144 HD21 ASN 144 -8.831 -13.853 16.259 1191 2HD2 ASN 144 HD22 ASN 144 -7.664 -15.055 15.988 1192 H ALA 145 H ALA 145 -9.879 -14.273 20.560 1193 HA ALA 145 HA ALA 145 -10.597 -16.811 19.225 1194 1HB ALA 145 HB1 ALA 145 -9.755 -15.991 21.974 1195 2HB ALA 145 HB2 ALA 145 -10.729 -17.453 21.816 1196 3HB ALA 145 HB3 ALA 145 -9.182 -17.329 20.979 1197 H ASP 146 H ASP 146 -12.696 -15.959 18.435 1198 HA ASP 146 HA ASP 146 -15.030 -15.797 18.600 1199 1HB ASP 146 HB2 ASP 146 -14.183 -17.723 20.585 1200 2HB ASP 146 HB3 ASP 146 -15.576 -16.816 21.178 1201 H SER 147 H SER 147 -16.643 -15.304 20.876 1202 HA SER 147 HA SER 147 -17.404 -13.443 22.091 1203 1HB SER 147 HB2 SER 147 -14.644 -12.688 22.880 1204 2HB SER 147 HB3 SER 147 -16.065 -12.961 23.884 1205 HG SER 147 HG SER 147 -14.335 -14.865 22.698 1206 H GLY 148 H GLY 148 -17.453 -12.683 19.600 1207 1HA GLY 148 HA2 GLY 148 -15.708 -10.300 19.252 1208 2HA GLY 148 HA3 GLY 148 -16.689 -11.042 17.986 1209 H GLN 149 H GLN 149 -18.540 -10.927 20.752 1210 HA GLN 149 HA GLN 149 -19.570 -8.193 20.147 1211 1HB GLN 149 HB2 GLN 149 -20.904 -10.741 19.689 1212 2HB GLN 149 HB3 GLN 149 -21.823 -9.720 20.795 1213 1HG GLN 149 HG2 GLN 149 -22.184 -8.085 19.210 1214 2HG GLN 149 HG3 GLN 149 -20.676 -8.426 18.363 1215 1HE2 GLN 149 HE21 GLN 149 -23.133 -8.196 16.922 1216 2HE2 GLN 149 HE22 GLN 149 -23.540 -9.724 16.303 1217 HN3 PTP 150 H3 PTP 150 -9.039 -3.403 -8.076 1218 1H5M PTP 150 H51 PTP 150 -6.567 -2.093 -4.394 1219 2H5M PTP 150 H52 PTP 150 -7.682 -0.966 -3.585 1220 3H5M PTP 150 H53 PTP 150 -6.487 -0.351 -4.751 1221 H6 PTP 150 H6 PTP 150 -9.141 0.447 -5.201 1222 H1* PTP 150 H1' PTP 150 -11.307 0.484 -8.135 1223 2H2* PTP 150 H2' PTP 150 -12.129 -0.464 -5.405 1224 H3* PTP 150 H3' PTP 150 -13.020 1.644 -4.770 1225 H4* PTP 150 H4' PTP 150 -11.378 3.421 -6.032 1226 2H5* PTP 150 H5' PTP 150 -10.808 1.297 -3.894 Start of MODEL 10 1 1H ALA 1 H1 ALA 1 9.192 -22.278 -23.327 2 2H ALA 1 H2 ALA 1 7.578 -22.739 -23.592 3 3H ALA 1 H3 ALA 1 8.326 -21.633 -24.639 4 HA ALA 1 HA ALA 1 7.891 -19.899 -23.335 5 1HB ALA 1 HB1 ALA 1 6.202 -22.053 -22.039 6 2HB ALA 1 HB2 ALA 1 6.054 -20.343 -21.635 7 3HB ALA 1 HB3 ALA 1 5.705 -20.895 -23.274 8 H THR 2 H THR 2 10.223 -20.079 -22.526 9 HA THR 2 HA THR 2 10.234 -20.648 -19.588 10 HB THR 2 HB THR 2 12.435 -21.408 -19.737 11 HG1 THR 2 HG1 THR 2 12.894 -20.521 -22.324 12 1HG2 THR 2 HG21 THR 2 10.600 -22.501 -21.474 13 2HG2 THR 2 HG22 THR 2 11.979 -22.197 -22.530 14 3HG2 THR 2 HG23 THR 2 12.173 -23.203 -21.093 15 H SER 3 H SER 3 10.130 -18.741 -18.501 16 HA SER 3 HA SER 3 10.603 -16.528 -17.882 17 1HB SER 3 HB2 SER 3 12.930 -17.224 -17.860 18 2HB SER 3 HB3 SER 3 13.028 -17.089 -19.613 19 HG SER 3 HG SER 3 12.201 -14.875 -18.102 20 H THR 4 H THR 4 8.713 -15.848 -19.139 21 HA THR 4 HA THR 4 9.425 -13.896 -21.187 22 HB THR 4 HB THR 4 9.299 -16.093 -22.445 23 HG1 THR 4 HG1 THR 4 8.922 -14.298 -23.630 24 1HG2 THR 4 HG21 THR 4 6.948 -16.354 -20.885 25 2HG2 THR 4 HG22 THR 4 6.426 -16.194 -22.562 26 3HG2 THR 4 HG23 THR 4 7.556 -17.470 -22.109 27 H LYS 5 H LYS 5 8.069 -13.977 -18.572 28 HA LYS 5 HA LYS 5 5.802 -12.306 -19.242 29 1HB LYS 5 HB2 LYS 5 5.368 -15.177 -18.674 30 2HB LYS 5 HB3 LYS 5 4.354 -14.072 -17.744 31 1HG LYS 5 HG2 LYS 5 4.487 -13.176 -20.479 32 2HG LYS 5 HG3 LYS 5 4.002 -14.871 -20.438 33 1HD LYS 5 HD2 LYS 5 2.117 -14.424 -19.085 34 2HD LYS 5 HD3 LYS 5 2.732 -12.841 -18.602 35 1HE LYS 5 HE2 LYS 5 1.994 -13.534 -21.456 36 2HE LYS 5 HE3 LYS 5 0.877 -12.770 -20.327 37 1HZ LYS 5 HZ1 LYS 5 3.460 -11.511 -20.435 38 2HZ LYS 5 HZ2 LYS 5 2.628 -11.460 -21.912 39 3HZ LYS 5 HZ3 LYS 5 1.911 -10.819 -20.510 40 H LYS 6 H LYS 6 7.891 -11.587 -17.736 41 HA LYS 6 HA LYS 6 6.997 -11.920 -14.903 42 1HB LYS 6 HB2 LYS 6 9.640 -11.779 -16.192 43 2HB LYS 6 HB3 LYS 6 9.483 -10.744 -14.773 44 1HG LYS 6 HG2 LYS 6 9.335 -12.509 -13.344 45 2HG LYS 6 HG3 LYS 6 8.335 -13.445 -14.455 46 1HD LYS 6 HD2 LYS 6 10.371 -13.904 -15.833 47 2HD LYS 6 HD3 LYS 6 11.339 -13.074 -14.615 48 1HE LYS 6 HE2 LYS 6 10.632 -14.683 -12.911 49 2HE LYS 6 HE3 LYS 6 9.586 -15.489 -14.079 50 1HZ LYS 6 HZ1 LYS 6 11.856 -15.567 -15.405 51 2HZ LYS 6 HZ2 LYS 6 12.490 -15.549 -13.829 52 3HZ LYS 6 HZ3 LYS 6 11.414 -16.776 -14.301 53 H LEU 7 H LEU 7 8.154 -9.726 -13.745 54 HA LEU 7 HA LEU 7 6.641 -7.503 -15.035 55 1HB LEU 7 HB2 LEU 7 7.714 -7.569 -12.207 56 2HB LEU 7 HB3 LEU 7 6.465 -6.512 -12.868 57 HG LEU 7 HG LEU 7 6.257 -9.515 -12.493 58 1HD1 LEU 7 HD11 LEU 7 5.536 -7.172 -10.878 59 2HD1 LEU 7 HD12 LEU 7 4.179 -8.262 -11.159 60 3HD1 LEU 7 HD13 LEU 7 5.655 -8.866 -10.405 61 1HD2 LEU 7 HD21 LEU 7 4.838 -7.661 -14.222 62 2HD2 LEU 7 HD22 LEU 7 4.689 -9.415 -14.115 63 3HD2 LEU 7 HD23 LEU 7 3.741 -8.382 -13.044 64 H HIS 8 H HIS 8 8.015 -5.482 -13.463 65 HA HIS 8 HA HIS 8 10.854 -5.579 -14.034 66 1HB HIS 8 HB2 HIS 8 9.427 -5.065 -16.276 67 2HB HIS 8 HB3 HIS 8 9.568 -3.428 -15.633 68 HD1 HIS 8 HD1 HIS 8 11.344 -2.584 -17.274 69 HD2 HIS 8 HD2 HIS 8 12.494 -6.059 -15.279 70 HE1 HIS 8 HE1 HIS 8 13.800 -2.930 -17.792 71 H LYS 9 H LYS 9 11.706 -4.340 -12.438 72 HA LYS 9 HA LYS 9 9.967 -2.356 -11.106 73 1HB LYS 9 HB2 LYS 9 12.721 -3.423 -10.422 74 2HB LYS 9 HB3 LYS 9 11.828 -2.263 -9.438 75 1HG LYS 9 HG2 LYS 9 10.017 -4.355 -9.970 76 2HG LYS 9 HG3 LYS 9 11.542 -5.138 -9.557 77 1HD LYS 9 HD2 LYS 9 10.720 -2.831 -7.865 78 2HD LYS 9 HD3 LYS 9 9.795 -4.322 -7.680 79 1HE LYS 9 HE2 LYS 9 12.794 -4.452 -7.713 80 2HE LYS 9 HE3 LYS 9 11.969 -3.948 -6.239 81 1HZ LYS 9 HZ1 LYS 9 10.541 -6.100 -6.997 82 2HZ LYS 9 HZ2 LYS 9 12.106 -6.549 -7.473 83 3HZ LYS 9 HZ3 LYS 9 11.800 -6.126 -5.855 84 H GLU 10 H GLU 10 10.130 -0.218 -11.493 85 HA GLU 10 HA GLU 10 12.624 0.795 -12.804 86 1HB GLU 10 HB2 GLU 10 9.730 1.594 -13.221 87 2HB GLU 10 HB3 GLU 10 11.085 2.565 -13.796 88 1HG GLU 10 HG2 GLU 10 11.287 -0.287 -14.493 89 2HG GLU 10 HG3 GLU 10 9.905 0.531 -15.222 90 HA PRO 11 HA PRO 11 12.967 3.641 -9.474 91 1HB PRO 11 HB2 PRO 11 14.006 5.825 -10.748 92 2HB PRO 11 HB3 PRO 11 14.931 4.350 -10.432 93 1HG PRO 11 HG2 PRO 11 13.684 5.286 -12.986 94 2HG PRO 11 HG3 PRO 11 15.191 4.387 -12.736 95 1HD PRO 11 HD2 PRO 11 12.804 3.233 -13.564 96 2HD PRO 11 HD3 PRO 11 14.119 2.347 -12.760 97 H ALA 12 H ALA 12 12.143 5.662 -8.600 98 HA ALA 12 HA ALA 12 10.067 7.055 -10.198 99 1HB ALA 12 HB1 ALA 12 9.438 5.060 -8.283 100 2HB ALA 12 HB2 ALA 12 9.052 6.610 -7.533 101 3HB ALA 12 HB3 ALA 12 8.322 6.171 -9.078 102 H THR 13 H THR 13 9.106 8.869 -8.537 103 HA THR 13 HA THR 13 11.443 9.961 -7.022 104 HB THR 13 HB THR 13 9.567 11.619 -8.726 105 HG1 THR 13 HG1 THR 13 12.234 10.821 -9.255 106 1HG2 THR 13 HG21 THR 13 11.487 12.223 -6.693 107 2HG2 THR 13 HG22 THR 13 12.104 12.814 -8.235 108 3HG2 THR 13 HG23 THR 13 10.524 13.343 -7.655 109 H LEU 14 H LEU 14 10.923 10.943 -5.072 110 HA LEU 14 HA LEU 14 8.197 10.512 -4.076 111 1HB LEU 14 HB2 LEU 14 10.243 10.122 -2.664 112 2HB LEU 14 HB3 LEU 14 10.536 11.862 -2.691 113 HG LEU 14 HG LEU 14 7.982 11.927 -1.910 114 1HD1 LEU 14 HD11 LEU 14 8.414 9.201 -1.958 115 2HD1 LEU 14 HD12 LEU 14 8.690 9.599 -0.262 116 3HD1 LEU 14 HD13 LEU 14 7.154 10.010 -1.027 117 1HD2 LEU 14 HD21 LEU 14 10.402 12.413 -0.737 118 2HD2 LEU 14 HD22 LEU 14 8.853 12.631 0.078 119 3HD2 LEU 14 HD23 LEU 14 9.772 11.145 0.314 120 H ILE 15 H ILE 15 6.671 12.003 -4.629 121 HA ILE 15 HA ILE 15 7.511 14.839 -4.956 122 HB ILE 15 HB ILE 15 4.874 13.524 -5.672 123 1HG1 ILE 15 HG12 ILE 15 7.342 14.129 -7.332 124 2HG1 ILE 15 HG13 ILE 15 6.663 12.537 -6.992 125 1HG2 ILE 15 HG21 ILE 15 6.112 16.223 -6.270 126 2HG2 ILE 15 HG22 ILE 15 4.717 15.588 -7.141 127 3HG2 ILE 15 HG23 ILE 15 4.607 15.901 -5.409 128 1HD1 ILE 15 HD11 ILE 15 4.569 14.142 -8.066 129 2HD1 ILE 15 HD12 ILE 15 5.977 14.342 -9.109 130 3HD1 ILE 15 HD13 ILE 15 5.334 12.730 -8.793 131 H LYS 16 H LYS 16 4.801 13.003 -3.475 132 HA LYS 16 HA LYS 16 4.990 14.453 -0.994 133 1HB LYS 16 HB2 LYS 16 3.904 16.046 -2.872 134 2HB LYS 16 HB3 LYS 16 2.451 15.180 -2.370 135 1HG LYS 16 HG2 LYS 16 2.371 16.265 -0.391 136 2HG LYS 16 HG3 LYS 16 4.089 16.002 -0.094 137 1HD LYS 16 HD2 LYS 16 4.163 18.280 -0.352 138 2HD LYS 16 HD3 LYS 16 4.270 17.839 -2.057 139 1HE LYS 16 HE2 LYS 16 2.506 19.334 -2.151 140 2HE LYS 16 HE3 LYS 16 1.618 17.838 -1.863 141 1HZ LYS 16 HZ1 LYS 16 2.257 18.618 0.630 142 2HZ LYS 16 HZ2 LYS 16 2.002 20.113 -0.136 143 3HZ LYS 16 HZ3 LYS 16 0.774 18.939 -0.130 144 H ALA 17 H ALA 17 4.427 12.772 0.304 145 HA ALA 17 HA ALA 17 2.751 10.599 -0.501 146 1HB ALA 17 HB1 ALA 17 4.454 10.787 1.482 147 2HB ALA 17 HB2 ALA 17 3.066 11.397 2.384 148 3HB ALA 17 HB3 ALA 17 3.019 9.780 1.679 149 H ILE 18 H ILE 18 0.605 10.068 0.473 150 HA ILE 18 HA ILE 18 -0.996 12.542 1.000 151 HB ILE 18 HB ILE 18 -1.794 10.056 -0.546 152 1HG1 ILE 18 HG12 ILE 18 -1.595 12.949 -1.435 153 2HG1 ILE 18 HG13 ILE 18 -0.334 11.748 -1.717 154 1HG2 ILE 18 HG21 ILE 18 -3.358 12.050 0.878 155 2HG2 ILE 18 HG22 ILE 18 -3.720 12.075 -0.848 156 3HG2 ILE 18 HG23 ILE 18 -3.901 10.579 0.068 157 1HD1 ILE 18 HD11 ILE 18 -3.136 11.083 -2.534 158 2HD1 ILE 18 HD12 ILE 18 -2.213 12.198 -3.541 159 3HD1 ILE 18 HD13 ILE 18 -1.608 10.568 -3.250 160 H ASP 19 H ASP 19 -1.910 9.112 1.088 161 HA ASP 19 HA ASP 19 -2.568 9.488 3.978 162 1HB ASP 19 HB2 ASP 19 -4.308 8.821 2.022 163 2HB ASP 19 HB3 ASP 19 -3.734 7.211 2.457 164 H GLY 20 H GLY 20 -2.987 6.455 4.013 165 1HA GLY 20 HA2 GLY 20 -0.191 5.821 4.693 166 2HA GLY 20 HA3 GLY 20 -1.596 4.817 5.051 167 H ASP 21 H ASP 21 -2.689 4.767 2.396 168 HA ASP 21 HA ASP 21 -0.623 3.062 1.069 169 1HB ASP 21 HB2 ASP 21 -2.463 1.821 0.077 170 2HB ASP 21 HB3 ASP 21 -2.729 1.924 1.817 171 H THR 22 H THR 22 -1.657 6.103 0.845 172 HA THR 22 HA THR 22 -1.664 6.059 -2.147 173 HB THR 22 HB THR 22 -2.853 8.314 -0.548 174 HG1 THR 22 HG1 THR 22 -4.329 7.001 0.113 175 1HG2 THR 22 HG21 THR 22 -2.542 7.636 -3.301 176 2HG2 THR 22 HG22 THR 22 -4.264 7.590 -2.924 177 3HG2 THR 22 HG23 THR 22 -3.331 9.054 -2.612 178 H VAL 23 H VAL 23 0.091 7.031 -3.023 179 HA VAL 23 HA VAL 23 1.334 9.329 -1.615 180 HB VAL 23 HB VAL 23 3.604 8.324 -1.978 181 1HG1 VAL 23 HG11 VAL 23 2.301 8.158 0.200 182 2HG1 VAL 23 HG12 VAL 23 1.830 6.533 -0.298 183 3HG1 VAL 23 HG13 VAL 23 3.531 6.915 -0.031 184 1HG2 VAL 23 HG21 VAL 23 2.080 6.457 -3.479 185 2HG2 VAL 23 HG22 VAL 23 3.821 6.442 -3.198 186 3HG2 VAL 23 HG23 VAL 23 2.745 5.576 -2.103 187 H LYS 24 H LYS 24 2.017 10.876 -3.081 188 HA LYS 24 HA LYS 24 1.593 10.257 -5.946 189 1HB LYS 24 HB2 LYS 24 2.402 12.931 -4.796 190 2HB LYS 24 HB3 LYS 24 1.543 12.603 -6.301 191 1HG LYS 24 HG2 LYS 24 -0.174 11.456 -4.566 192 2HG LYS 24 HG3 LYS 24 0.511 12.694 -3.512 193 1HD LYS 24 HD2 LYS 24 -0.622 13.242 -6.271 194 2HD LYS 24 HD3 LYS 24 -1.512 13.480 -4.766 195 1HE LYS 24 HE2 LYS 24 0.097 15.125 -4.005 196 2HE LYS 24 HE3 LYS 24 1.142 14.802 -5.387 197 1HZ LYS 24 HZ1 LYS 24 -1.609 15.534 -5.984 198 2HZ LYS 24 HZ2 LYS 24 -0.633 16.764 -5.345 199 3HZ LYS 24 HZ3 LYS 24 -0.170 15.971 -6.775 200 H LEU 25 H LEU 25 3.294 9.699 -7.213 201 HA LEU 25 HA LEU 25 5.987 10.772 -6.500 202 1HB LEU 25 HB2 LEU 25 5.812 8.007 -7.621 203 2HB LEU 25 HB3 LEU 25 7.006 8.699 -6.527 204 HG LEU 25 HG LEU 25 4.153 8.221 -5.655 205 1HD1 LEU 25 HD11 LEU 25 5.544 6.145 -6.523 206 2HD1 LEU 25 HD12 LEU 25 6.372 6.324 -4.976 207 3HD1 LEU 25 HD13 LEU 25 4.632 6.039 -5.017 208 1HD2 LEU 25 HD21 LEU 25 6.757 8.979 -4.405 209 2HD2 LEU 25 HD22 LEU 25 5.128 9.534 -4.023 210 3HD2 LEU 25 HD23 LEU 25 5.675 7.953 -3.463 211 H MET 26 H MET 26 7.425 10.955 -8.334 212 HA MET 26 HA MET 26 5.976 11.372 -10.868 213 1HB MET 26 HB2 MET 26 7.906 12.845 -9.744 214 2HB MET 26 HB3 MET 26 8.937 11.735 -10.648 215 1HG MET 26 HG2 MET 26 8.283 12.566 -12.674 216 2HG MET 26 HG3 MET 26 6.625 12.841 -12.138 217 1HE MET 26 HE1 MET 26 9.631 14.022 -13.276 218 2HE MET 26 HE2 MET 26 8.459 15.175 -13.928 219 3HE MET 26 HE3 MET 26 9.778 15.738 -12.905 220 H TYR 27 H TYR 27 5.847 9.732 -12.316 221 HA TYR 27 HA TYR 27 8.076 7.739 -12.375 222 1HB TYR 27 HB2 TYR 27 6.161 6.647 -11.396 223 2HB TYR 27 HB3 TYR 27 5.093 7.285 -12.647 224 HD1 TYR 27 HD1 TYR 27 8.220 5.245 -12.288 225 HD2 TYR 27 HD2 TYR 27 4.608 5.954 -14.500 226 HE1 TYR 27 HE1 TYR 27 8.703 3.270 -13.709 227 HE2 TYR 27 HE2 TYR 27 5.090 3.980 -15.922 228 HH TYR 27 HH TYR 27 6.367 2.105 -16.086 229 H LYS 28 H LYS 28 9.019 7.558 -14.342 230 HA LYS 28 HA LYS 28 9.363 7.736 -16.651 231 1HB LYS 28 HB2 LYS 28 6.422 7.330 -16.399 232 2HB LYS 28 HB3 LYS 28 7.022 7.924 -17.949 233 1HG LYS 28 HG2 LYS 28 8.599 6.048 -18.082 234 2HG LYS 28 HG3 LYS 28 8.056 5.463 -16.510 235 1HD LYS 28 HD2 LYS 28 5.773 5.165 -17.414 236 2HD LYS 28 HD3 LYS 28 6.333 5.722 -18.992 237 1HE LYS 28 HE2 LYS 28 7.874 3.507 -17.732 238 2HE LYS 28 HE3 LYS 28 6.262 3.112 -18.331 239 1HZ LYS 28 HZ1 LYS 28 7.345 4.640 -20.306 240 2HZ LYS 28 HZ2 LYS 28 8.653 3.693 -19.792 241 3HZ LYS 28 HZ3 LYS 28 7.220 2.946 -20.314 242 H GLY 29 H GLY 29 8.461 10.155 -14.753 243 1HA GLY 29 HA2 GLY 29 9.052 12.451 -15.315 244 2HA GLY 29 HA3 GLY 29 8.602 12.119 -16.988 245 H GLN 30 H GLN 30 6.147 10.662 -15.686 246 HA GLN 30 HA GLN 30 4.529 13.157 -15.491 247 1HB GLN 30 HB2 GLN 30 2.658 11.234 -15.773 248 2HB GLN 30 HB3 GLN 30 3.438 12.005 -17.151 249 1HG GLN 30 HG2 GLN 30 4.970 10.192 -17.419 250 2HG GLN 30 HG3 GLN 30 4.544 9.510 -15.849 251 1HE2 GLN 30 HE21 GLN 30 3.108 10.230 -19.070 252 2HE2 GLN 30 HE22 GLN 30 1.981 8.961 -19.017 253 HA PRO 31 HA PRO 31 4.036 12.142 -11.176 254 1HB PRO 31 HB2 PRO 31 2.268 14.150 -10.613 255 2HB PRO 31 HB3 PRO 31 4.006 14.427 -10.829 256 1HG PRO 31 HG2 PRO 31 1.755 14.966 -12.727 257 2HG PRO 31 HG3 PRO 31 3.254 15.876 -12.472 258 1HD PRO 31 HD2 PRO 31 2.833 14.119 -14.580 259 2HD PRO 31 HD3 PRO 31 4.434 14.588 -13.970 260 H MET 32 H MET 32 2.571 10.801 -10.110 261 HA MET 32 HA MET 32 -0.273 10.824 -10.871 262 1HB MET 32 HB2 MET 32 1.634 8.789 -11.830 263 2HB MET 32 HB3 MET 32 0.192 8.126 -11.060 264 1HG MET 32 HG2 MET 32 -1.242 9.437 -12.547 265 2HG MET 32 HG3 MET 32 0.172 10.193 -13.279 266 1HE MET 32 HE1 MET 32 -1.023 7.005 -11.970 267 2HE MET 32 HE2 MET 32 -1.060 5.837 -13.298 268 3HE MET 32 HE3 MET 32 0.443 6.144 -12.433 269 H THR 33 H THR 33 -1.588 9.711 -9.341 270 HA THR 33 HA THR 33 -0.288 9.376 -6.711 271 HB THR 33 HB THR 33 -3.214 9.211 -7.504 272 HG1 THR 33 HG1 THR 33 -2.528 11.272 -7.806 273 1HG2 THR 33 HG21 THR 33 -1.985 8.292 -5.205 274 2HG2 THR 33 HG22 THR 33 -2.507 9.914 -4.752 275 3HG2 THR 33 HG23 THR 33 -3.685 8.743 -5.345 276 H PHE 34 H PHE 34 0.475 7.383 -6.190 277 HA PHE 34 HA PHE 34 -0.682 5.015 -7.553 278 1HB PHE 34 HB2 PHE 34 1.868 5.527 -6.029 279 2HB PHE 34 HB3 PHE 34 1.320 3.881 -6.351 280 HD1 PHE 34 HD1 PHE 34 0.909 3.156 -8.734 281 HD2 PHE 34 HD2 PHE 34 2.846 6.860 -7.748 282 HE1 PHE 34 HE1 PHE 34 1.795 3.307 -11.044 283 HE2 PHE 34 HE2 PHE 34 3.732 7.013 -10.060 284 HZ PHE 34 HZ PHE 34 3.207 5.235 -11.708 285 H ARG 35 H ARG 35 -1.560 3.271 -6.390 286 HA ARG 35 HA ARG 35 -2.062 3.784 -3.484 287 1HB ARG 35 HB2 ARG 35 -4.089 4.118 -4.923 288 2HB ARG 35 HB3 ARG 35 -3.946 2.439 -5.446 289 1HG ARG 35 HG2 ARG 35 -5.199 1.894 -3.651 290 2HG ARG 35 HG3 ARG 35 -3.796 2.297 -2.663 291 1HD ARG 35 HD2 ARG 35 -4.586 4.452 -2.187 292 2HD ARG 35 HD3 ARG 35 -5.664 4.468 -3.584 293 HE ARG 35 HE ARG 35 -6.473 2.393 -1.780 294 1HH1 ARG 35 HH11 ARG 35 -6.559 5.771 -2.441 295 2HH1 ARG 35 HH12 ARG 35 -7.854 6.091 -1.337 296 1HH2 ARG 35 HH21 ARG 35 -8.069 2.815 -0.222 297 2HH2 ARG 35 HH22 ARG 35 -8.707 4.419 -0.080 298 H LEU 36 H LEU 36 -1.925 1.946 -2.125 299 HA LEU 36 HA LEU 36 -0.196 -0.167 -2.984 300 1HB LEU 36 HB2 LEU 36 -2.066 -0.065 -0.596 301 2HB LEU 36 HB3 LEU 36 -0.763 -1.231 -0.820 302 HG LEU 36 HG LEU 36 -0.557 1.744 -0.359 303 1HD1 LEU 36 HD11 LEU 36 0.382 -0.779 0.970 304 2HD1 LEU 36 HD12 LEU 36 1.288 0.715 1.208 305 3HD1 LEU 36 HD13 LEU 36 -0.407 0.627 1.684 306 1HD2 LEU 36 HD21 LEU 36 1.446 -0.126 -1.638 307 2HD2 LEU 36 HD22 LEU 36 0.926 1.464 -2.197 308 3HD2 LEU 36 HD23 LEU 36 1.957 1.324 -0.774 309 H LEU 37 H LEU 37 -0.647 -2.134 -3.885 310 HA LEU 37 HA LEU 37 -3.435 -2.631 -4.716 311 1HB LEU 37 HB2 LEU 37 -0.735 -3.576 -5.544 312 2HB LEU 37 HB3 LEU 37 -2.085 -4.680 -5.806 313 HG LEU 37 HG LEU 37 -2.286 -1.793 -6.639 314 1HD1 LEU 37 HD11 LEU 37 -0.703 -3.981 -7.886 315 2HD1 LEU 37 HD12 LEU 37 -1.704 -3.019 -8.973 316 3HD1 LEU 37 HD13 LEU 37 -0.476 -2.234 -7.979 317 1HD2 LEU 37 HD21 LEU 37 -4.261 -3.429 -6.525 318 2HD2 LEU 37 HD22 LEU 37 -4.015 -2.609 -8.068 319 3HD2 LEU 37 HD23 LEU 37 -3.494 -4.282 -7.865 320 H LEU 38 H LEU 38 -4.418 -4.753 -4.434 321 HA LEU 38 HA LEU 38 -5.137 -6.514 -3.066 322 1HB LEU 38 HB2 LEU 38 -2.178 -6.740 -3.248 323 2HB LEU 38 HB3 LEU 38 -2.968 -7.703 -1.999 324 HG LEU 38 HG LEU 38 -3.822 -7.682 -4.906 325 1HD1 LEU 38 HD11 LEU 38 -1.538 -8.886 -3.734 326 2HD1 LEU 38 HD12 LEU 38 -2.710 -10.178 -3.993 327 3HD1 LEU 38 HD13 LEU 38 -2.193 -9.172 -5.346 328 1HD2 LEU 38 HD21 LEU 38 -4.702 -9.080 -2.409 329 2HD2 LEU 38 HD22 LEU 38 -5.674 -8.453 -3.740 330 3HD2 LEU 38 HD23 LEU 38 -4.786 -9.964 -3.932 331 H VAL 39 H VAL 39 -4.534 -3.760 -1.783 332 HA VAL 39 HA VAL 39 -4.915 -4.739 0.970 333 HB VAL 39 HB VAL 39 -3.093 -3.469 1.927 334 1HG1 VAL 39 HG11 VAL 39 -2.580 -5.742 1.046 335 2HG1 VAL 39 HG12 VAL 39 -2.094 -5.014 -0.486 336 3HG1 VAL 39 HG13 VAL 39 -1.179 -4.673 0.983 337 1HG2 VAL 39 HG21 VAL 39 -3.264 -1.642 0.155 338 2HG2 VAL 39 HG22 VAL 39 -1.625 -2.087 0.628 339 3HG2 VAL 39 HG23 VAL 39 -2.298 -2.687 -0.888 340 H ASP 40 H ASP 40 -5.503 -2.925 2.451 341 HA ASP 40 HA ASP 40 -6.393 -0.444 1.090 342 1HB ASP 40 HB2 ASP 40 -8.262 -2.198 1.056 343 2HB ASP 40 HB3 ASP 40 -8.302 -2.037 2.813 344 H THR 41 H THR 41 -6.269 1.320 2.470 345 HA THR 41 HA THR 41 -5.072 0.827 5.110 346 HB THR 41 HB THR 41 -5.391 3.522 5.003 347 HG1 THR 41 HG1 THR 41 -4.875 3.964 2.723 348 1HG2 THR 41 HG21 THR 41 -3.253 1.891 3.608 349 2HG2 THR 41 HG22 THR 41 -3.090 3.577 4.100 350 3HG2 THR 41 HG23 THR 41 -3.276 2.317 5.319 351 HA PRO 42 HA PRO 42 -8.722 1.389 7.504 352 1HB PRO 42 HB2 PRO 42 -7.638 2.514 9.748 353 2HB PRO 42 HB3 PRO 42 -7.408 0.810 9.315 354 1HG PRO 42 HG2 PRO 42 -5.507 3.103 9.038 355 2HG PRO 42 HG3 PRO 42 -5.173 1.402 9.404 356 1HD PRO 42 HD2 PRO 42 -4.830 2.575 6.902 357 2HD PRO 42 HD3 PRO 42 -5.028 0.831 7.182 358 H GLU 43 H GLU 43 -9.189 3.470 9.385 359 HA GLU 43 HA GLU 43 -9.984 5.622 7.576 360 1HB GLU 43 HB2 GLU 43 -10.649 4.731 10.270 361 2HB GLU 43 HB3 GLU 43 -10.442 6.481 10.198 362 1HG GLU 43 HG2 GLU 43 -12.322 6.764 8.966 363 2HG GLU 43 HG3 GLU 43 -11.940 5.397 7.919 364 H THR 44 H THR 44 -8.643 7.263 7.048 365 HA THR 44 HA THR 44 -7.084 8.646 9.086 366 HB THR 44 HB THR 44 -5.532 7.362 6.826 367 HG1 THR 44 HG1 THR 44 -5.802 5.620 7.972 368 1HG2 THR 44 HG21 THR 44 -4.589 9.408 7.846 369 2HG2 THR 44 HG22 THR 44 -4.691 8.653 9.436 370 3HG2 THR 44 HG23 THR 44 -3.604 7.992 8.215 371 H LYS 45 H LYS 45 -9.089 9.667 7.566 372 HA LYS 45 HA LYS 45 -8.052 10.859 5.102 373 1HB LYS 45 HB2 LYS 45 -10.605 10.431 6.237 374 2HB LYS 45 HB3 LYS 45 -10.408 12.180 6.121 375 1HG LYS 45 HG2 LYS 45 -9.998 12.085 3.779 376 2HG LYS 45 HG3 LYS 45 -9.749 10.339 3.818 377 1HD LYS 45 HD2 LYS 45 -12.109 9.998 4.414 378 2HD LYS 45 HD3 LYS 45 -12.370 11.744 4.417 379 1HE LYS 45 HE2 LYS 45 -12.422 11.869 2.143 380 2HE LYS 45 HE3 LYS 45 -11.138 10.676 1.951 381 1HZ LYS 45 HZ1 LYS 45 -13.445 9.463 3.046 382 2HZ LYS 45 HZ2 LYS 45 -13.855 10.286 1.617 383 3HZ LYS 45 HZ3 LYS 45 -12.637 9.107 1.593 384 H HIS 46 H HIS 46 -8.960 12.079 8.342 385 HA HIS 46 HA HIS 46 -7.409 14.554 7.708 386 1HB HIS 46 HB2 HIS 46 -9.946 14.076 9.065 387 2HB HIS 46 HB3 HIS 46 -8.835 15.012 10.065 388 HD1 HIS 46 HD1 HIS 46 -10.916 15.208 6.994 389 HD2 HIS 46 HD2 HIS 46 -7.984 17.509 8.863 390 HE1 HIS 46 HE1 HIS 46 -10.981 17.486 5.889 391 HA PRO 47 HA PRO 47 -4.749 12.391 10.741 392 1HB PRO 47 HB2 PRO 47 -2.425 13.266 9.604 393 2HB PRO 47 HB3 PRO 47 -3.303 11.840 9.024 394 1HG PRO 47 HG2 PRO 47 -3.188 14.592 7.856 395 2HG PRO 47 HG3 PRO 47 -3.303 13.026 7.036 396 1HD PRO 47 HD2 PRO 47 -5.450 14.749 7.442 397 2HD PRO 47 HD3 PRO 47 -5.597 13.004 7.143 398 H LYS 48 H LYS 48 -4.404 15.701 9.439 399 HA LYS 48 HA LYS 48 -2.813 16.904 11.364 400 1HB LYS 48 HB2 LYS 48 -4.756 17.790 9.451 401 2HB LYS 48 HB3 LYS 48 -5.013 18.670 10.959 402 1HG LYS 48 HG2 LYS 48 -2.201 18.511 10.541 403 2HG LYS 48 HG3 LYS 48 -2.930 19.035 9.023 404 1HD LYS 48 HD2 LYS 48 -4.335 20.601 10.667 405 2HD LYS 48 HD3 LYS 48 -2.908 20.392 11.682 406 1HE LYS 48 HE2 LYS 48 -2.981 21.452 8.845 407 2HE LYS 48 HE3 LYS 48 -2.559 22.351 10.302 408 1HZ LYS 48 HZ1 LYS 48 -0.943 20.093 10.230 409 2HZ LYS 48 HZ2 LYS 48 -0.902 20.762 8.672 410 3HZ LYS 48 HZ3 LYS 48 -0.476 21.714 10.014 411 H LYS 49 H LYS 49 -6.384 16.629 11.599 412 HA LYS 49 HA LYS 49 -6.364 17.420 14.398 413 1HB LYS 49 HB2 LYS 49 -8.527 16.117 12.713 414 2HB LYS 49 HB3 LYS 49 -8.767 16.774 14.332 415 1HG LYS 49 HG2 LYS 49 -7.513 18.855 13.005 416 2HG LYS 49 HG3 LYS 49 -8.570 18.178 11.766 417 1HD LYS 49 HD2 LYS 49 -9.388 19.100 14.535 418 2HD LYS 49 HD3 LYS 49 -9.811 19.864 13.002 419 1HE LYS 49 HE2 LYS 49 -11.520 18.430 12.659 420 2HE LYS 49 HE3 LYS 49 -10.508 17.033 13.028 421 1HZ LYS 49 HZ1 LYS 49 -10.777 18.009 15.450 422 2HZ LYS 49 HZ2 LYS 49 -12.220 18.607 14.791 423 3HZ LYS 49 HZ3 LYS 49 -11.913 16.937 14.782 424 H GLY 50 H GLY 50 -6.854 14.327 12.679 425 1HA GLY 50 HA2 GLY 50 -6.119 12.187 13.441 426 2HA GLY 50 HA3 GLY 50 -5.737 12.904 15.006 427 H VAL 51 H VAL 51 -7.065 10.545 15.081 428 HA VAL 51 HA VAL 51 -9.784 11.388 15.969 429 HB VAL 51 HB VAL 51 -9.452 8.662 14.781 430 1HG1 VAL 51 HG11 VAL 51 -11.565 10.486 15.594 431 2HG1 VAL 51 HG12 VAL 51 -11.802 9.944 13.932 432 3HG1 VAL 51 HG13 VAL 51 -11.660 8.762 15.233 433 1HG2 VAL 51 HG21 VAL 51 -8.398 10.167 13.119 434 2HG2 VAL 51 HG22 VAL 51 -9.943 9.552 12.529 435 3HG2 VAL 51 HG23 VAL 51 -9.829 11.199 13.152 436 H GLU 52 H GLU 52 -10.497 8.711 16.808 437 HA GLU 52 HA GLU 52 -8.535 8.379 19.041 438 1HB GLU 52 HB2 GLU 52 -10.431 7.581 20.397 439 2HB GLU 52 HB3 GLU 52 -10.751 9.200 19.773 440 1HG GLU 52 HG2 GLU 52 -12.528 8.487 18.580 441 2HG GLU 52 HG3 GLU 52 -11.621 7.128 17.913 442 H LYS 53 H LYS 53 -9.176 7.012 16.222 443 HA LYS 53 HA LYS 53 -9.090 4.214 17.277 444 1HB LYS 53 HB2 LYS 53 -10.727 5.349 15.300 445 2HB LYS 53 HB3 LYS 53 -9.515 4.427 14.409 446 1HG LYS 53 HG2 LYS 53 -10.329 2.436 15.130 447 2HG LYS 53 HG3 LYS 53 -10.562 3.028 16.775 448 1HD LYS 53 HD2 LYS 53 -12.699 2.428 15.541 449 2HD LYS 53 HD3 LYS 53 -12.650 4.067 16.193 450 1HE LYS 53 HE2 LYS 53 -12.088 4.985 14.029 451 2HE LYS 53 HE3 LYS 53 -11.886 3.372 13.346 452 1HZ LYS 53 HZ1 LYS 53 -14.411 3.462 14.498 453 2HZ LYS 53 HZ2 LYS 53 -14.243 4.892 13.602 454 3HZ LYS 53 HZ3 LYS 53 -14.025 3.387 12.845 455 H TYR 54 H TYR 54 -8.074 5.595 14.153 456 HA TYR 54 HA TYR 54 -5.259 4.894 14.797 457 1HB TYR 54 HB2 TYR 54 -6.678 3.954 12.286 458 2HB TYR 54 HB3 TYR 54 -4.998 3.641 12.719 459 HD1 TYR 54 HD1 TYR 54 -4.466 2.234 14.726 460 HD2 TYR 54 HD2 TYR 54 -8.465 2.666 13.222 461 HE1 TYR 54 HE1 TYR 54 -5.165 0.235 16.015 462 HE2 TYR 54 HE2 TYR 54 -9.166 0.665 14.511 463 HH TYR 54 HH TYR 54 -8.499 -0.653 16.366 464 H GLY 55 H GLY 55 -6.261 7.474 14.677 465 1HA GLY 55 HA2 GLY 55 -6.207 8.715 12.115 466 2HA GLY 55 HA3 GLY 55 -5.850 9.537 13.636 467 HA PRO 56 HA PRO 56 -1.609 9.767 12.490 468 1HB PRO 56 HB2 PRO 56 -0.465 9.831 14.972 469 2HB PRO 56 HB3 PRO 56 -1.378 11.192 14.294 470 1HG PRO 56 HG2 PRO 56 -2.223 9.183 16.346 471 2HG PRO 56 HG3 PRO 56 -2.638 10.901 16.215 472 1HD PRO 56 HD2 PRO 56 -4.315 8.822 15.444 473 2HD PRO 56 HD3 PRO 56 -4.431 10.488 14.833 474 H GLU 57 H GLU 57 -1.546 7.541 11.580 475 HA GLU 57 HA GLU 57 0.352 5.855 13.022 476 1HB GLU 57 HB2 GLU 57 -2.394 5.364 13.428 477 2HB GLU 57 HB3 GLU 57 -1.856 4.132 12.284 478 1HG GLU 57 HG2 GLU 57 -0.794 3.023 13.927 479 2HG GLU 57 HG3 GLU 57 0.143 4.463 14.328 480 H ALA 58 H ALA 58 -2.124 5.131 10.544 481 HA ALA 58 HA ALA 58 -0.196 3.869 8.813 482 1HB ALA 58 HB1 ALA 58 -3.075 4.608 8.662 483 2HB ALA 58 HB2 ALA 58 -2.237 4.376 7.127 484 3HB ALA 58 HB3 ALA 58 -2.288 3.068 8.311 485 H SER 59 H SER 59 -2.008 6.943 8.416 486 HA SER 59 HA SER 59 -0.705 7.861 6.106 487 1HB SER 59 HB2 SER 59 -2.465 9.237 6.741 488 2HB SER 59 HB3 SER 59 -2.002 9.223 8.439 489 HG SER 59 HG SER 59 -1.519 11.117 6.797 490 H ALA 60 H ALA 60 0.238 8.503 9.505 491 HA ALA 60 HA ALA 60 2.677 9.858 8.762 492 1HB ALA 60 HB1 ALA 60 1.359 9.903 11.019 493 2HB ALA 60 HB2 ALA 60 2.303 8.462 11.401 494 3HB ALA 60 HB3 ALA 60 3.122 9.988 11.061 495 H PHE 61 H PHE 61 1.804 6.511 9.089 496 HA PHE 61 HA PHE 61 4.395 5.420 9.616 497 1HB PHE 61 HB2 PHE 61 2.353 4.063 9.789 498 2HB PHE 61 HB3 PHE 61 2.089 4.224 8.053 499 HD1 PHE 61 HD1 PHE 61 3.732 3.225 6.443 500 HD2 PHE 61 HD2 PHE 61 3.942 2.502 10.672 501 HE1 PHE 61 HE1 PHE 61 5.216 1.280 6.037 502 HE2 PHE 61 HE2 PHE 61 5.425 0.557 10.266 503 HZ PHE 61 HZ PHE 61 6.063 -0.054 7.948 504 H THR 62 H THR 62 2.675 5.683 6.495 505 HA THR 62 HA THR 62 5.070 5.094 4.976 506 HB THR 62 HB THR 62 2.626 4.789 4.224 507 HG1 THR 62 HG1 THR 62 4.350 4.564 2.796 508 1HG2 THR 62 HG21 THR 62 2.103 7.230 4.863 509 2HG2 THR 62 HG22 THR 62 2.907 7.665 3.355 510 3HG2 THR 62 HG23 THR 62 1.466 6.648 3.325 511 H LYS 63 H LYS 63 3.790 7.922 6.461 512 HA LYS 63 HA LYS 63 4.858 9.947 4.772 513 1HB LYS 63 HB2 LYS 63 3.312 10.178 6.837 514 2HB LYS 63 HB3 LYS 63 4.805 10.167 7.778 515 1HG LYS 63 HG2 LYS 63 5.243 11.950 5.627 516 2HG LYS 63 HG3 LYS 63 3.644 12.331 6.268 517 1HD LYS 63 HD2 LYS 63 4.713 12.278 8.589 518 2HD LYS 63 HD3 LYS 63 6.271 12.266 7.762 519 1HE LYS 63 HE2 LYS 63 6.150 14.489 7.457 520 2HE LYS 63 HE3 LYS 63 4.630 14.300 6.583 521 1HZ LYS 63 HZ1 LYS 63 3.571 14.105 8.856 522 2HZ LYS 63 HZ2 LYS 63 5.034 14.699 9.485 523 3HZ LYS 63 HZ3 LYS 63 4.128 15.647 8.407 524 H LYS 64 H LYS 64 6.273 8.631 7.775 525 HA LYS 64 HA LYS 64 8.870 9.805 7.221 526 1HB LYS 64 HB2 LYS 64 7.911 7.742 9.217 527 2HB LYS 64 HB3 LYS 64 9.594 8.262 9.123 528 1HG LYS 64 HG2 LYS 64 8.573 9.643 10.782 529 2HG LYS 64 HG3 LYS 64 8.731 10.651 9.344 530 1HD LYS 64 HD2 LYS 64 6.434 10.472 8.822 531 2HD LYS 64 HD3 LYS 64 6.216 9.073 9.874 532 1HE LYS 64 HE2 LYS 64 7.160 11.619 11.121 533 2HE LYS 64 HE3 LYS 64 5.465 11.514 10.646 534 1HZ LYS 64 HZ1 LYS 64 5.388 9.368 11.883 535 2HZ LYS 64 HZ2 LYS 64 6.937 9.716 12.487 536 3HZ LYS 64 HZ3 LYS 64 5.634 10.734 12.861 537 H MET 65 H MET 65 7.299 6.782 6.474 538 HA MET 65 HA MET 65 9.637 5.218 5.940 539 1HB MET 65 HB2 MET 65 7.239 4.380 6.148 540 2HB MET 65 HB3 MET 65 6.990 4.966 4.504 541 1HG MET 65 HG2 MET 65 7.658 2.826 3.995 542 2HG MET 65 HG3 MET 65 9.252 3.575 4.103 543 1HE MET 65 HE1 MET 65 10.694 2.132 4.578 544 2HE MET 65 HE2 MET 65 11.094 2.851 6.135 545 3HE MET 65 HE3 MET 65 10.905 1.105 6.003 546 H VAL 66 H VAL 66 7.413 6.421 3.435 547 HA VAL 66 HA VAL 66 9.276 6.265 1.318 548 HB VAL 66 HB VAL 66 7.735 7.584 0.044 549 1HG1 VAL 66 HG11 VAL 66 6.970 5.350 1.354 550 2HG1 VAL 66 HG12 VAL 66 5.779 6.482 1.993 551 3HG1 VAL 66 HG13 VAL 66 5.902 6.221 0.253 552 1HG2 VAL 66 HG21 VAL 66 7.153 8.761 2.722 553 2HG2 VAL 66 HG22 VAL 66 7.277 9.552 1.151 554 3HG2 VAL 66 HG23 VAL 66 5.812 8.669 1.581 555 H GLU 67 H GLU 67 8.764 8.820 3.698 556 HA GLU 67 HA GLU 67 10.279 10.849 2.331 557 1HB GLU 67 HB2 GLU 67 9.359 10.415 5.149 558 2HB GLU 67 HB3 GLU 67 10.593 11.637 4.843 559 1HG GLU 67 HG2 GLU 67 8.844 12.228 2.855 560 2HG GLU 67 HG3 GLU 67 7.729 11.617 4.078 561 H ASN 68 H ASN 68 11.166 8.244 4.539 562 HA ASN 68 HA ASN 68 13.991 9.144 4.500 563 1HB ASN 68 HB2 ASN 68 12.671 6.826 5.949 564 2HB ASN 68 HB3 ASN 68 14.352 7.328 6.139 565 1HD2 ASN 68 HD21 ASN 68 11.705 7.456 7.909 566 2HD2 ASN 68 HD22 ASN 68 11.792 9.020 8.561 567 H ALA 69 H ALA 69 11.961 7.224 2.648 568 HA ALA 69 HA ALA 69 13.641 4.980 2.063 569 1HB ALA 69 HB1 ALA 69 11.356 6.348 0.684 570 2HB ALA 69 HB2 ALA 69 12.304 5.162 -0.216 571 3HB ALA 69 HB3 ALA 69 11.476 4.687 1.267 572 H LYS 70 H LYS 70 15.654 5.116 1.218 573 HA LYS 70 HA LYS 70 16.602 7.497 -0.140 574 1HB LYS 70 HB2 LYS 70 17.745 4.807 0.529 575 2HB LYS 70 HB3 LYS 70 18.563 5.801 -0.677 576 1HG LYS 70 HG2 LYS 70 17.769 7.292 1.728 577 2HG LYS 70 HG3 LYS 70 18.933 6.007 2.047 578 1HD LYS 70 HD2 LYS 70 20.406 7.678 1.458 579 2HD LYS 70 HD3 LYS 70 20.079 7.024 -0.147 580 1HE LYS 70 HE2 LYS 70 19.507 9.157 -0.677 581 2HE LYS 70 HE3 LYS 70 18.002 8.794 0.167 582 1HZ LYS 70 HZ1 LYS 70 19.592 9.438 2.205 583 2HZ LYS 70 HZ2 LYS 70 20.239 10.439 0.995 584 3HZ LYS 70 HZ3 LYS 70 18.596 10.555 1.401 585 H LYS 71 H LYS 71 15.311 4.393 -1.145 586 HA LYS 71 HA LYS 71 15.493 5.341 -3.975 587 1HB LYS 71 HB2 LYS 71 16.273 2.702 -2.788 588 2HB LYS 71 HB3 LYS 71 15.580 2.722 -4.410 589 1HG LYS 71 HG2 LYS 71 17.541 3.418 -5.261 590 2HG LYS 71 HG3 LYS 71 17.510 4.836 -4.211 591 1HD LYS 71 HD2 LYS 71 18.511 3.527 -2.387 592 2HD LYS 71 HD3 LYS 71 18.515 2.089 -3.410 593 1HE LYS 71 HE2 LYS 71 19.848 3.650 -5.071 594 2HE LYS 71 HE3 LYS 71 20.212 4.555 -3.601 595 1HZ LYS 71 HZ1 LYS 71 20.574 1.902 -2.959 596 2HZ LYS 71 HZ2 LYS 71 21.280 2.083 -4.494 597 3HZ LYS 71 HZ3 LYS 71 21.784 3.066 -3.203 598 H ILE 72 H ILE 72 13.509 5.446 -4.895 599 HA ILE 72 HA ILE 72 11.327 3.778 -3.705 600 HB ILE 72 HB ILE 72 11.076 6.475 -5.074 601 1HG1 ILE 72 HG12 ILE 72 10.255 6.687 -2.415 602 2HG1 ILE 72 HG13 ILE 72 11.721 5.709 -2.328 603 1HG2 ILE 72 HG21 ILE 72 9.137 4.551 -3.800 604 2HG2 ILE 72 HG22 ILE 72 8.777 6.276 -3.870 605 3HG2 ILE 72 HG23 ILE 72 9.020 5.366 -5.360 606 1HD1 ILE 72 HD11 ILE 72 12.289 7.740 -4.193 607 2HD1 ILE 72 HD12 ILE 72 11.457 8.543 -2.862 608 3HD1 ILE 72 HD13 ILE 72 12.916 7.603 -2.550 609 H GLU 73 H GLU 73 10.716 2.196 -5.104 610 HA GLU 73 HA GLU 73 10.816 2.822 -8.031 611 1HB GLU 73 HB2 GLU 73 11.413 0.176 -6.669 612 2HB GLU 73 HB3 GLU 73 11.367 0.435 -8.413 613 1HG GLU 73 HG2 GLU 73 13.099 2.337 -7.910 614 2HG GLU 73 HG3 GLU 73 13.358 1.454 -6.405 615 H VAL 74 H VAL 74 9.318 1.302 -9.286 616 HA VAL 74 HA VAL 74 6.933 0.507 -7.687 617 HB VAL 74 HB VAL 74 5.573 1.449 -9.687 618 1HG1 VAL 74 HG11 VAL 74 6.485 2.579 -7.243 619 2HG1 VAL 74 HG12 VAL 74 6.527 3.863 -8.451 620 3HG1 VAL 74 HG13 VAL 74 5.025 2.991 -8.142 621 1HG2 VAL 74 HG21 VAL 74 7.609 1.839 -11.095 622 2HG2 VAL 74 HG22 VAL 74 6.631 3.292 -10.884 623 3HG2 VAL 74 HG23 VAL 74 8.115 3.086 -9.954 624 H GLU 75 H GLU 75 5.930 -1.360 -8.487 625 HA GLU 75 HA GLU 75 7.055 -2.473 -11.024 626 1HB GLU 75 HB2 GLU 75 8.049 -3.593 -9.034 627 2HB GLU 75 HB3 GLU 75 6.427 -4.038 -8.503 628 1HG GLU 75 HG2 GLU 75 6.080 -5.312 -10.579 629 2HG GLU 75 HG3 GLU 75 7.686 -4.848 -11.141 630 H PHE 76 H PHE 76 5.157 -1.854 -12.182 631 HA PHE 76 HA PHE 76 2.486 -2.262 -11.353 632 1HB PHE 76 HB2 PHE 76 3.616 -2.480 -14.163 633 2HB PHE 76 HB3 PHE 76 1.916 -2.241 -13.755 634 HD1 PHE 76 HD1 PHE 76 1.125 -0.116 -12.816 635 HD2 PHE 76 HD2 PHE 76 5.247 -0.688 -13.879 636 HE1 PHE 76 HE1 PHE 76 1.499 2.332 -12.675 637 HE2 PHE 76 HE2 PHE 76 5.623 1.759 -13.738 638 HZ PHE 76 HZ PHE 76 3.749 3.270 -13.135 639 H ASP 77 H ASP 77 1.057 -4.029 -11.586 640 HA ASP 77 HA ASP 77 2.368 -6.661 -11.620 641 1HB ASP 77 HB2 ASP 77 0.254 -5.699 -10.213 642 2HB ASP 77 HB3 ASP 77 -0.593 -6.490 -11.543 643 H LYS 78 H LYS 78 0.510 -8.307 -12.787 644 HA LYS 78 HA LYS 78 0.893 -7.667 -15.639 645 1HB LYS 78 HB2 LYS 78 -0.086 -9.985 -15.950 646 2HB LYS 78 HB3 LYS 78 1.400 -9.935 -15.001 647 1HG LYS 78 HG2 LYS 78 -0.889 -9.547 -13.279 648 2HG LYS 78 HG3 LYS 78 -1.080 -11.028 -14.217 649 1HD LYS 78 HD2 LYS 78 1.468 -10.342 -12.735 650 2HD LYS 78 HD3 LYS 78 0.169 -11.295 -12.018 651 1HE LYS 78 HE2 LYS 78 0.950 -13.133 -13.048 652 2HE LYS 78 HE3 LYS 78 0.695 -12.361 -14.612 653 1HZ LYS 78 HZ1 LYS 78 2.998 -11.322 -13.311 654 2HZ LYS 78 HZ2 LYS 78 3.108 -13.007 -13.471 655 3HZ LYS 78 HZ3 LYS 78 2.860 -12.040 -14.845 656 H GLY 79 H GLY 79 -1.634 -7.629 -13.258 657 1HA GLY 79 HA2 GLY 79 -3.859 -7.748 -15.109 658 2HA GLY 79 HA3 GLY 79 -3.939 -7.184 -13.439 659 H GLN 80 H GLN 80 -5.305 -5.409 -14.191 660 HA GLN 80 HA GLN 80 -4.556 -3.522 -16.175 661 1HB GLN 80 HB2 GLN 80 -6.153 -3.120 -13.627 662 2HB GLN 80 HB3 GLN 80 -6.060 -1.948 -14.942 663 1HG GLN 80 HG2 GLN 80 -6.761 -4.701 -15.768 664 2HG GLN 80 HG3 GLN 80 -7.971 -3.885 -14.776 665 1HE2 GLN 80 HE21 GLN 80 -5.731 -2.302 -17.078 666 2HE2 GLN 80 HE22 GLN 80 -6.948 -1.731 -18.115 667 H ARG 81 H ARG 81 -3.826 -1.228 -15.710 668 HA ARG 81 HA ARG 81 -1.775 -1.223 -13.530 669 1HB ARG 81 HB2 ARG 81 -1.658 -0.076 -16.331 670 2HB ARG 81 HB3 ARG 81 -0.514 0.372 -15.065 671 1HG ARG 81 HG2 ARG 81 0.045 -2.049 -14.776 672 2HG ARG 81 HG3 ARG 81 -0.999 -2.417 -16.150 673 1HD ARG 81 HD2 ARG 81 0.772 -0.283 -16.889 674 2HD ARG 81 HD3 ARG 81 1.725 -1.600 -16.205 675 HE ARG 81 HE ARG 81 -0.031 -1.818 -18.600 676 1HH1 ARG 81 HH11 ARG 81 0.184 -4.347 -16.952 677 2HH1 ARG 81 HH12 ARG 81 1.525 -5.141 -17.706 678 1HH2 ARG 81 HH21 ARG 81 2.624 -2.295 -19.354 679 2HH2 ARG 81 HH22 ARG 81 2.906 -3.979 -19.068 680 H THR 82 H THR 82 -4.690 -0.002 -14.245 681 HA THR 82 HA THR 82 -4.188 2.429 -12.647 682 HB THR 82 HB THR 82 -5.610 3.747 -14.352 683 HG1 THR 82 HG1 THR 82 -4.631 1.691 -16.037 684 1HG2 THR 82 HG21 THR 82 -2.782 2.842 -14.926 685 2HG2 THR 82 HG22 THR 82 -3.568 4.156 -15.799 686 3HG2 THR 82 HG23 THR 82 -3.292 4.291 -14.064 687 H ASP 83 H ASP 83 -5.965 2.933 -11.374 688 HA ASP 83 HA ASP 83 -8.146 0.984 -11.316 689 1HB ASP 83 HB2 ASP 83 -7.170 3.196 -9.596 690 2HB ASP 83 HB3 ASP 83 -8.906 2.894 -9.538 691 H LYS 84 H LYS 84 -10.394 2.375 -10.735 692 HA LYS 84 HA LYS 84 -11.170 3.428 -13.328 693 1HB LYS 84 HB2 LYS 84 -13.371 3.774 -12.274 694 2HB LYS 84 HB3 LYS 84 -12.750 2.165 -11.904 695 1HG LYS 84 HG2 LYS 84 -12.277 2.708 -9.689 696 2HG LYS 84 HG3 LYS 84 -12.148 4.433 -10.034 697 1HD LYS 84 HD2 LYS 84 -14.352 4.768 -9.671 698 2HD LYS 84 HD3 LYS 84 -14.798 3.377 -10.660 699 1HE LYS 84 HE2 LYS 84 -14.972 1.999 -8.861 700 2HE LYS 84 HE3 LYS 84 -13.539 2.677 -8.089 701 1HZ LYS 84 HZ1 LYS 84 -15.480 4.662 -8.095 702 2HZ LYS 84 HZ2 LYS 84 -16.249 3.241 -7.571 703 3HZ LYS 84 HZ3 LYS 84 -14.873 3.808 -6.758 704 H TYR 85 H TYR 85 -10.020 4.789 -10.344 705 HA TYR 85 HA TYR 85 -10.982 7.492 -10.940 706 1HB TYR 85 HB2 TYR 85 -9.065 6.399 -8.864 707 2HB TYR 85 HB3 TYR 85 -9.495 8.104 -8.986 708 HD1 TYR 85 HD1 TYR 85 -10.800 4.700 -8.317 709 HD2 TYR 85 HD2 TYR 85 -11.656 8.910 -8.287 710 HE1 TYR 85 HE1 TYR 85 -12.873 4.269 -7.027 711 HE2 TYR 85 HE2 TYR 85 -13.730 8.479 -6.997 712 HH TYR 85 HH TYR 85 -14.459 6.440 -5.321 713 H GLY 86 H GLY 86 -8.533 5.579 -12.169 714 1HA GLY 86 HA2 GLY 86 -6.972 6.285 -13.840 715 2HA GLY 86 HA3 GLY 86 -7.191 7.952 -13.306 716 H ARG 87 H ARG 87 -6.768 5.889 -10.667 717 HA ARG 87 HA ARG 87 -4.171 7.051 -10.065 718 1HB ARG 87 HB2 ARG 87 -5.791 4.881 -8.700 719 2HB ARG 87 HB3 ARG 87 -4.283 5.537 -8.059 720 1HG ARG 87 HG2 ARG 87 -5.456 7.853 -8.356 721 2HG ARG 87 HG3 ARG 87 -6.942 6.903 -8.397 722 1HD ARG 87 HD2 ARG 87 -5.090 6.158 -6.227 723 2HD ARG 87 HD3 ARG 87 -5.738 7.793 -6.099 724 HE ARG 87 HE ARG 87 -7.770 6.803 -5.468 725 1HH1 ARG 87 HH11 ARG 87 -5.691 4.408 -6.691 726 2HH1 ARG 87 HH12 ARG 87 -6.945 3.249 -6.989 727 1HH2 ARG 87 HH21 ARG 87 -9.517 5.434 -6.188 728 2HH2 ARG 87 HH22 ARG 87 -9.110 3.830 -6.700 729 H GLY 88 H GLY 88 -2.179 5.846 -9.816 730 1HA GLY 88 HA2 GLY 88 -1.947 3.655 -11.786 731 2HA GLY 88 HA3 GLY 88 -0.602 4.497 -11.013 732 H LEU 89 H LEU 89 -1.561 1.529 -11.221 733 HA LEU 89 HA LEU 89 -1.373 0.953 -8.290 734 1HB LEU 89 HB2 LEU 89 -2.523 -0.798 -10.484 735 2HB LEU 89 HB3 LEU 89 -2.517 -1.159 -8.757 736 HG LEU 89 HG LEU 89 -3.789 1.352 -9.850 737 1HD1 LEU 89 HD11 LEU 89 -4.656 -1.343 -10.264 738 2HD1 LEU 89 HD12 LEU 89 -5.745 -0.590 -9.098 739 3HD1 LEU 89 HD13 LEU 89 -5.499 0.150 -10.681 740 1HD2 LEU 89 HD21 LEU 89 -3.260 0.315 -7.261 741 2HD2 LEU 89 HD22 LEU 89 -4.207 1.744 -7.671 742 3HD2 LEU 89 HD23 LEU 89 -4.999 0.177 -7.514 743 H ALA 90 H ALA 90 0.521 0.044 -7.670 744 HA ALA 90 HA ALA 90 1.840 -2.022 -9.196 745 1HB ALA 90 HB1 ALA 90 2.996 0.775 -9.253 746 2HB ALA 90 HB2 ALA 90 3.970 -0.663 -9.559 747 3HB ALA 90 HB3 ALA 90 2.623 -0.267 -10.627 748 H TYR 91 H TYR 91 3.615 -2.938 -7.984 749 HA TYR 91 HA TYR 91 3.403 -2.504 -5.119 750 1HB TYR 91 HB2 TYR 91 5.492 -4.102 -6.633 751 2HB TYR 91 HB3 TYR 91 5.065 -4.268 -4.929 752 HD1 TYR 91 HD1 TYR 91 2.617 -4.873 -4.366 753 HD2 TYR 91 HD2 TYR 91 4.340 -5.341 -8.273 754 HE1 TYR 91 HE1 TYR 91 0.814 -6.465 -4.970 755 HE2 TYR 91 HE2 TYR 91 2.538 -6.934 -8.877 756 HH TYR 91 HH TYR 91 0.427 -8.285 -6.557 757 H ILE 92 H ILE 92 4.333 -0.757 -4.172 758 HA ILE 92 HA ILE 92 6.678 0.526 -5.416 759 HB ILE 92 HB ILE 92 5.125 1.244 -2.910 760 1HG1 ILE 92 HG12 ILE 92 5.039 2.685 -5.554 761 2HG1 ILE 92 HG13 ILE 92 4.000 1.290 -5.268 762 1HG2 ILE 92 HG21 ILE 92 7.336 2.603 -4.459 763 2HG2 ILE 92 HG22 ILE 92 6.238 3.511 -3.419 764 3HG2 ILE 92 HG23 ILE 92 7.269 2.257 -2.731 765 1HD1 ILE 92 HD11 ILE 92 3.895 3.031 -2.979 766 2HD1 ILE 92 HD12 ILE 92 3.557 3.964 -4.438 767 3HD1 ILE 92 HD13 ILE 92 2.584 2.545 -4.054 768 H TYR 93 H TYR 93 8.748 0.436 -4.588 769 HA TYR 93 HA TYR 93 9.123 -1.203 -2.111 770 1HB TYR 93 HB2 TYR 93 10.703 -1.125 -4.685 771 2HB TYR 93 HB3 TYR 93 11.394 -1.756 -3.192 772 HD1 TYR 93 HD1 TYR 93 8.798 -2.244 -5.767 773 HD2 TYR 93 HD2 TYR 93 10.594 -3.825 -2.199 774 HE1 TYR 93 HE1 TYR 93 7.639 -4.403 -6.142 775 HE2 TYR 93 HE2 TYR 93 9.433 -5.985 -2.573 776 HH TYR 93 HH TYR 93 8.080 -7.140 -3.891 777 H ALA 94 H ALA 94 11.067 -0.622 -0.854 778 HA ALA 94 HA ALA 94 12.167 2.077 -1.425 779 1HB ALA 94 HB1 ALA 94 10.410 1.329 0.846 780 2HB ALA 94 HB2 ALA 94 11.834 2.282 1.258 781 3HB ALA 94 HB3 ALA 94 10.666 2.903 0.091 782 H ASP 95 H ASP 95 14.300 1.507 -1.602 783 HA ASP 95 HA ASP 95 16.426 0.806 -0.894 784 1HB ASP 95 HB2 ASP 95 15.116 0.302 1.791 785 2HB ASP 95 HB3 ASP 95 16.829 0.571 1.473 786 H GLY 96 H GLY 96 13.952 -1.089 -1.511 787 1HA GLY 96 HA2 GLY 96 14.314 -3.391 -2.248 788 2HA GLY 96 HA3 GLY 96 15.515 -3.569 -0.968 789 H LYS 97 H LYS 97 12.850 -1.872 0.186 790 HA LYS 97 HA LYS 97 11.744 -4.384 1.376 791 1HB LYS 97 HB2 LYS 97 12.865 -2.563 2.863 792 2HB LYS 97 HB3 LYS 97 11.389 -1.642 2.571 793 1HG LYS 97 HG2 LYS 97 10.411 -2.810 4.228 794 2HG LYS 97 HG3 LYS 97 10.531 -4.246 3.210 795 1HD LYS 97 HD2 LYS 97 11.832 -5.070 4.882 796 2HD LYS 97 HD3 LYS 97 13.089 -4.044 4.190 797 1HE LYS 97 HE2 LYS 97 12.764 -3.723 6.667 798 2HE LYS 97 HE3 LYS 97 12.555 -2.248 5.721 799 1HZ LYS 97 HZ1 LYS 97 10.148 -3.799 6.034 800 2HZ LYS 97 HZ2 LYS 97 10.772 -3.203 7.498 801 3HZ LYS 97 HZ3 LYS 97 10.401 -2.131 6.238 802 H MET 98 H MET 98 9.767 -4.889 0.583 803 HA MET 98 HA MET 98 8.231 -3.157 -1.089 804 1HB MET 98 HB2 MET 98 8.036 -5.646 -1.070 805 2HB MET 98 HB3 MET 98 7.257 -5.545 0.509 806 1HG MET 98 HG2 MET 98 5.282 -4.880 -0.383 807 2HG MET 98 HG3 MET 98 6.064 -3.763 -1.500 808 1HE MET 98 HE1 MET 98 6.075 -7.218 -0.434 809 2HE MET 98 HE2 MET 98 4.702 -7.777 -1.400 810 3HE MET 98 HE3 MET 98 6.344 -8.216 -1.861 811 H VAL 99 H VAL 99 6.995 -1.443 -0.506 812 HA VAL 99 HA VAL 99 6.583 -0.709 2.241 813 HB VAL 99 HB VAL 99 5.018 0.273 -0.162 814 1HG1 VAL 99 HG11 VAL 99 5.016 0.906 2.637 815 2HG1 VAL 99 HG12 VAL 99 5.648 2.290 1.746 816 3HG1 VAL 99 HG13 VAL 99 4.059 1.637 1.348 817 1HG2 VAL 99 HG21 VAL 99 7.784 0.327 0.142 818 2HG2 VAL 99 HG22 VAL 99 6.840 1.402 -0.889 819 3HG2 VAL 99 HG23 VAL 99 7.272 1.904 0.745 820 H ASN 100 H ASN 100 4.412 -2.112 -0.221 821 HA ASN 100 HA ASN 100 2.026 -2.178 1.242 822 1HB ASN 100 HB2 ASN 100 3.080 -4.401 -0.534 823 2HB ASN 100 HB3 ASN 100 1.391 -4.101 -0.126 824 1HD2 ASN 100 HD21 ASN 100 0.258 -2.746 -1.538 825 2HD2 ASN 100 HD22 ASN 100 0.981 -1.721 -2.682 826 H GLU 101 H GLU 101 4.763 -4.451 1.380 827 HA GLU 101 HA GLU 101 3.472 -6.128 3.381 828 1HB GLU 101 HB2 GLU 101 5.406 -6.703 1.680 829 2HB GLU 101 HB3 GLU 101 6.444 -6.089 2.968 830 1HG GLU 101 HG2 GLU 101 4.513 -7.777 4.193 831 2HG GLU 101 HG3 GLU 101 5.143 -8.644 2.792 832 H ALA 102 H ALA 102 5.554 -3.310 3.411 833 HA ALA 102 HA ALA 102 6.534 -3.508 6.077 834 1HB ALA 102 HB1 ALA 102 7.291 -1.826 4.367 835 2HB ALA 102 HB2 ALA 102 5.773 -0.963 4.618 836 3HB ALA 102 HB3 ALA 102 6.929 -1.117 5.940 837 H LEU 103 H LEU 103 3.606 -1.921 4.814 838 HA LEU 103 HA LEU 103 2.617 -1.144 7.403 839 1HB LEU 103 HB2 LEU 103 1.183 -1.588 4.769 840 2HB LEU 103 HB3 LEU 103 0.428 -0.885 6.199 841 HG LEU 103 HG LEU 103 2.900 0.474 5.762 842 1HD1 LEU 103 HD11 LEU 103 2.506 -0.458 3.398 843 2HD1 LEU 103 HD12 LEU 103 1.101 0.605 3.337 844 3HD1 LEU 103 HD13 LEU 103 2.714 1.287 3.535 845 1HD2 LEU 103 HD21 LEU 103 0.417 1.079 6.639 846 2HD2 LEU 103 HD22 LEU 103 1.558 2.311 6.100 847 3HD2 LEU 103 HD23 LEU 103 0.307 1.727 5.003 848 H VAL 104 H VAL 104 1.781 -3.881 5.249 849 HA VAL 104 HA VAL 104 -0.069 -5.119 7.019 850 HB VAL 104 HB VAL 104 1.752 -6.242 4.878 851 1HG1 VAL 104 HG11 VAL 104 1.295 -7.966 6.622 852 2HG1 VAL 104 HG12 VAL 104 -0.433 -7.693 6.402 853 3HG1 VAL 104 HG13 VAL 104 0.531 -8.350 5.079 854 1HG2 VAL 104 HG21 VAL 104 -0.951 -5.099 5.033 855 2HG2 VAL 104 HG22 VAL 104 0.097 -5.314 3.630 856 3HG2 VAL 104 HG23 VAL 104 -0.900 -6.653 4.199 857 H ARG 105 H ARG 105 3.358 -4.819 7.160 858 HA ARG 105 HA ARG 105 3.815 -7.129 8.883 859 1HB ARG 105 HB2 ARG 105 5.413 -5.076 7.593 860 2HB ARG 105 HB3 ARG 105 5.892 -5.274 9.279 861 1HG ARG 105 HG2 ARG 105 5.539 -7.886 8.411 862 2HG ARG 105 HG3 ARG 105 6.272 -7.090 7.017 863 1HD ARG 105 HD2 ARG 105 8.034 -6.166 8.548 864 2HD ARG 105 HD3 ARG 105 7.347 -7.136 9.851 865 HE ARG 105 HE ARG 105 7.802 -9.099 8.131 866 1HH1 ARG 105 HH11 ARG 105 9.956 -7.955 10.085 867 2HH1 ARG 105 HH12 ARG 105 11.329 -7.937 9.029 868 1HH2 ARG 105 HH21 ARG 105 9.451 -8.351 6.146 869 2HH2 ARG 105 HH22 ARG 105 11.043 -8.162 6.800 870 H GLN 106 H GLN 106 3.313 -3.647 9.314 871 HA GLN 106 HA GLN 106 3.593 -3.844 12.230 872 1HB GLN 106 HB2 GLN 106 3.417 -1.725 10.239 873 2HB GLN 106 HB3 GLN 106 2.365 -1.405 11.619 874 1HG GLN 106 HG2 GLN 106 5.289 -2.175 11.845 875 2HG GLN 106 HG3 GLN 106 4.689 -0.519 11.930 876 1HE2 GLN 106 HE21 GLN 106 6.019 -1.559 14.175 877 2HE2 GLN 106 HE22 GLN 106 4.902 -1.826 15.425 878 H GLY 107 H GLY 107 1.158 -4.502 9.982 879 1HA GLY 107 HA2 GLY 107 -1.043 -5.260 10.411 880 2HA GLY 107 HA3 GLY 107 -0.811 -4.860 12.113 881 H LEU 108 H LEU 108 -0.171 -2.505 9.599 882 HA LEU 108 HA LEU 108 -2.426 -0.878 10.668 883 1HB LEU 108 HB2 LEU 108 0.245 -0.286 9.544 884 2HB LEU 108 HB3 LEU 108 -1.038 0.798 9.008 885 HG LEU 108 HG LEU 108 -0.535 0.115 11.915 886 1HD1 LEU 108 HD11 LEU 108 0.537 2.306 10.150 887 2HD1 LEU 108 HD12 LEU 108 0.303 2.584 11.876 888 3HD1 LEU 108 HD13 LEU 108 1.397 1.314 11.327 889 1HD2 LEU 108 HD21 LEU 108 -2.829 0.909 11.173 890 2HD2 LEU 108 HD22 LEU 108 -2.039 1.947 12.361 891 3HD2 LEU 108 HD23 LEU 108 -2.063 2.413 10.660 892 H ALA 109 H ALA 109 -1.928 -2.985 8.179 893 HA ALA 109 HA ALA 109 -3.960 -1.577 6.514 894 1HB ALA 109 HB1 ALA 109 -1.319 -1.686 5.758 895 2HB ALA 109 HB2 ALA 109 -1.982 -3.118 4.971 896 3HB ALA 109 HB3 ALA 109 -2.676 -1.532 4.642 897 H LYS 110 H LYS 110 -5.495 -2.954 5.631 898 HA LYS 110 HA LYS 110 -5.188 -5.847 6.311 899 1HB LYS 110 HB2 LYS 110 -7.738 -5.846 6.078 900 2HB LYS 110 HB3 LYS 110 -7.088 -4.976 7.469 901 1HG LYS 110 HG2 LYS 110 -7.657 -2.920 6.623 902 2HG LYS 110 HG3 LYS 110 -7.404 -3.424 4.952 903 1HD LYS 110 HD2 LYS 110 -9.713 -3.304 4.963 904 2HD LYS 110 HD3 LYS 110 -9.508 -4.976 5.489 905 1HE LYS 110 HE2 LYS 110 -9.782 -4.362 7.801 906 2HE LYS 110 HE3 LYS 110 -9.725 -2.644 7.409 907 1HZ LYS 110 HZ1 LYS 110 -11.775 -4.427 6.246 908 2HZ LYS 110 HZ2 LYS 110 -11.998 -3.694 7.764 909 3HZ LYS 110 HZ3 LYS 110 -11.795 -2.733 6.381 910 H VAL 111 H VAL 111 -5.237 -7.306 4.642 911 HA VAL 111 HA VAL 111 -4.865 -6.519 1.963 912 HB VAL 111 HB VAL 111 -6.136 -9.126 2.829 913 1HG1 VAL 111 HG11 VAL 111 -5.971 -8.605 0.379 914 2HG1 VAL 111 HG12 VAL 111 -4.222 -8.469 0.569 915 3HG1 VAL 111 HG13 VAL 111 -5.024 -10.014 0.858 916 1HG2 VAL 111 HG21 VAL 111 -3.430 -8.010 3.301 917 2HG2 VAL 111 HG22 VAL 111 -4.294 -9.272 4.177 918 3HG2 VAL 111 HG23 VAL 111 -3.470 -9.655 2.665 919 H ALA 112 H ALA 112 -6.341 -6.786 0.108 920 HA ALA 112 HA ALA 112 -9.126 -7.229 0.303 921 1HB ALA 112 HB1 ALA 112 -8.440 -4.832 1.555 922 2HB ALA 112 HB2 ALA 112 -9.016 -4.334 -0.036 923 3HB ALA 112 HB3 ALA 112 -10.054 -5.298 1.016 924 H TYR 113 H TYR 113 -10.290 -6.315 -1.684 925 HA TYR 113 HA TYR 113 -10.354 -6.077 -4.018 926 1HB TYR 113 HB2 TYR 113 -7.696 -4.700 -3.517 927 2HB TYR 113 HB3 TYR 113 -8.614 -4.624 -5.021 928 HD1 TYR 113 HD1 TYR 113 -11.335 -4.232 -4.333 929 HD2 TYR 113 HD2 TYR 113 -7.858 -2.702 -2.329 930 HE1 TYR 113 HE1 TYR 113 -12.684 -2.361 -3.423 931 HE2 TYR 113 HE2 TYR 113 -9.207 -0.830 -1.418 932 HH TYR 113 HH TYR 113 -11.872 -0.564 -0.909 933 H VAL 114 H VAL 114 -9.715 -8.579 -3.384 934 HA VAL 114 HA VAL 114 -7.130 -9.315 -4.614 935 HB VAL 114 HB VAL 114 -9.336 -10.983 -3.365 936 1HG1 VAL 114 HG11 VAL 114 -7.189 -11.729 -5.125 937 2HG1 VAL 114 HG12 VAL 114 -6.863 -12.377 -3.519 938 3HG1 VAL 114 HG13 VAL 114 -8.375 -12.770 -4.339 939 1HG2 VAL 114 HG21 VAL 114 -6.577 -10.134 -2.427 940 2HG2 VAL 114 HG22 VAL 114 -8.123 -9.640 -1.735 941 3HG2 VAL 114 HG23 VAL 114 -7.588 -11.316 -1.595 942 H TYR 115 H TYR 115 -7.351 -8.928 -6.831 943 HA TYR 115 HA TYR 115 -9.446 -10.566 -8.198 944 1HB TYR 115 HB2 TYR 115 -8.413 -7.908 -9.212 945 2HB TYR 115 HB3 TYR 115 -9.788 -8.832 -9.817 946 HD1 TYR 115 HD1 TYR 115 -11.508 -9.506 -7.791 947 HD2 TYR 115 HD2 TYR 115 -8.954 -6.055 -7.917 948 HE1 TYR 115 HE1 TYR 115 -13.000 -8.344 -6.187 949 HE2 TYR 115 HE2 TYR 115 -10.446 -4.893 -6.314 950 HH TYR 115 HH TYR 115 -13.153 -5.238 -5.740 951 H LYS 116 H LYS 116 -8.712 -11.780 -9.919 952 HA LYS 116 HA LYS 116 -5.786 -11.862 -10.324 953 1HB LYS 116 HB2 LYS 116 -7.984 -13.620 -11.462 954 2HB LYS 116 HB3 LYS 116 -6.252 -13.929 -11.575 955 1HG LYS 116 HG2 LYS 116 -6.411 -13.646 -8.921 956 2HG LYS 116 HG3 LYS 116 -8.069 -14.167 -9.220 957 1HD LYS 116 HD2 LYS 116 -5.652 -15.640 -10.293 958 2HD LYS 116 HD3 LYS 116 -6.437 -16.050 -8.767 959 1HE LYS 116 HE2 LYS 116 -7.511 -17.482 -10.282 960 2HE LYS 116 HE3 LYS 116 -8.623 -16.116 -10.200 961 1HZ LYS 116 HZ1 LYS 116 -6.461 -16.120 -12.194 962 2HZ LYS 116 HZ2 LYS 116 -7.874 -17.018 -12.488 963 3HZ LYS 116 HZ3 LYS 116 -7.970 -15.342 -12.246 964 HA PRO 117 HA PRO 117 -4.683 -12.962 -11.823 965 1HB PRO 117 HB2 PRO 117 -2.643 -12.325 -13.524 966 2HB PRO 117 HB3 PRO 117 -3.969 -13.412 -13.972 967 1HG PRO 117 HG2 PRO 117 -3.438 -10.646 -14.871 968 2HG PRO 117 HG3 PRO 117 -4.402 -11.913 -15.644 969 1HD PRO 117 HD2 PRO 117 -5.364 -9.688 -14.101 970 2HD PRO 117 HD3 PRO 117 -6.322 -11.006 -14.811 971 H ASN 118 H ASN 118 -5.188 -10.168 -10.827 972 HA ASN 118 HA ASN 118 -2.501 -9.045 -10.410 973 1HB ASN 118 HB2 ASN 118 -5.304 -8.232 -9.773 974 2HB ASN 118 HB3 ASN 118 -4.016 -7.583 -8.757 975 1HD2 ASN 118 HD21 ASN 118 -5.392 -5.765 -10.362 976 2HD2 ASN 118 HD22 ASN 118 -4.406 -5.261 -11.648 977 H ASN 119 H ASN 119 -2.146 -11.425 -9.403 978 HA ASN 119 HA ASN 119 -2.335 -11.040 -6.459 979 1HB ASN 119 HB2 ASN 119 -3.561 -13.164 -8.080 980 2HB ASN 119 HB3 ASN 119 -2.574 -13.767 -6.751 981 1HD2 ASN 119 HD21 ASN 119 -5.301 -14.198 -6.527 982 2HD2 ASN 119 HD22 ASN 119 -5.975 -13.156 -5.368 983 H THR 120 H THR 120 -0.253 -11.039 -8.795 984 HA THR 120 HA THR 120 1.555 -13.128 -8.665 985 HB THR 120 HB THR 120 2.206 -10.165 -8.619 986 HG1 THR 120 HG1 THR 120 2.278 -11.864 -10.849 987 1HG2 THR 120 HG21 THR 120 3.997 -12.104 -8.113 988 2HG2 THR 120 HG22 THR 120 4.001 -12.177 -9.875 989 3HG2 THR 120 HG23 THR 120 4.401 -10.668 -9.054 990 H HIS 121 H HIS 121 1.165 -10.522 -6.270 991 HA HIS 121 HA HIS 121 2.861 -12.150 -4.414 992 1HB HIS 121 HB2 HIS 121 2.508 -9.139 -4.366 993 2HB HIS 121 HB3 HIS 121 3.611 -10.094 -3.374 994 HD1 HIS 121 HD1 HIS 121 4.566 -11.989 -5.741 995 HD2 HIS 121 HD2 HIS 121 4.528 -7.821 -5.843 996 HE1 HIS 121 HE1 HIS 121 6.261 -11.299 -7.491 997 H GLU 122 H GLU 122 0.243 -12.810 -4.484 998 HA GLU 122 HA GLU 122 -1.214 -11.210 -2.473 999 1HB GLU 122 HB2 GLU 122 -2.469 -12.061 -4.397 1000 2HB GLU 122 HB3 GLU 122 -1.995 -13.713 -3.999 1001 1HG GLU 122 HG2 GLU 122 -3.206 -12.279 -1.741 1002 2HG GLU 122 HG3 GLU 122 -4.297 -12.467 -3.115 1003 H GLN 123 H GLN 123 0.381 -14.350 -2.786 1004 HA GLN 123 HA GLN 123 -0.522 -15.377 -0.240 1005 1HB GLN 123 HB2 GLN 123 1.919 -16.099 -1.892 1006 2HB GLN 123 HB3 GLN 123 1.300 -17.036 -0.532 1007 1HG GLN 123 HG2 GLN 123 -0.435 -17.887 -1.742 1008 2HG GLN 123 HG3 GLN 123 -0.699 -16.375 -2.612 1009 1HE2 GLN 123 HE21 GLN 123 -0.843 -17.922 -4.558 1010 2HE2 GLN 123 HE22 GLN 123 0.607 -18.366 -5.319 1011 H LEU 124 H LEU 124 2.273 -13.479 -1.289 1012 HA LEU 124 HA LEU 124 3.741 -13.654 1.171 1013 1HB LEU 124 HB2 LEU 124 4.669 -12.838 -1.018 1014 2HB LEU 124 HB3 LEU 124 3.732 -11.358 -0.809 1015 HG LEU 124 HG LEU 124 4.927 -11.375 1.577 1016 1HD1 LEU 124 HD11 LEU 124 6.588 -13.135 -0.206 1017 2HD1 LEU 124 HD12 LEU 124 7.384 -12.099 0.978 1018 3HD1 LEU 124 HD13 LEU 124 6.225 -13.317 1.510 1019 1HD2 LEU 124 HD21 LEU 124 5.063 -9.740 -0.456 1020 2HD2 LEU 124 HD22 LEU 124 6.365 -9.712 0.735 1021 3HD2 LEU 124 HD23 LEU 124 6.591 -10.553 -0.799 1022 H LEU 125 H LEU 125 1.323 -11.319 -0.017 1023 HA LEU 125 HA LEU 125 1.475 -9.631 2.322 1024 1HB LEU 125 HB2 LEU 125 -0.806 -9.966 0.350 1025 2HB LEU 125 HB3 LEU 125 -0.592 -8.621 1.471 1026 HG LEU 125 HG LEU 125 1.489 -9.361 -0.594 1027 1HD1 LEU 125 HD11 LEU 125 -0.840 -7.434 -0.785 1028 2HD1 LEU 125 HD12 LEU 125 0.553 -7.385 -1.865 1029 3HD1 LEU 125 HD13 LEU 125 -0.497 -8.802 -1.843 1030 1HD2 LEU 125 HD21 LEU 125 1.250 -7.428 1.564 1031 2HD2 LEU 125 HD22 LEU 125 2.658 -7.825 0.578 1032 3HD2 LEU 125 HD23 LEU 125 1.500 -6.619 0.016 1033 H ARG 126 H ARG 126 -0.535 -12.410 1.415 1034 HA ARG 126 HA ARG 126 -2.326 -12.216 3.660 1035 1HB ARG 126 HB2 ARG 126 -1.751 -14.136 1.519 1036 2HB ARG 126 HB3 ARG 126 -2.198 -14.915 3.037 1037 1HG ARG 126 HG2 ARG 126 -3.794 -12.601 1.940 1038 2HG ARG 126 HG3 ARG 126 -4.113 -14.258 1.426 1039 1HD ARG 126 HD2 ARG 126 -3.999 -14.586 4.129 1040 2HD ARG 126 HD3 ARG 126 -4.658 -12.952 4.024 1041 HE ARG 126 HE ARG 126 -5.941 -15.096 2.412 1042 1HH1 ARG 126 HH11 ARG 126 -5.905 -13.560 5.448 1043 2HH1 ARG 126 HH12 ARG 126 -7.620 -13.338 5.529 1044 1HH2 ARG 126 HH21 ARG 126 -8.191 -14.506 2.315 1045 2HH2 ARG 126 HH22 ARG 126 -8.914 -13.874 3.757 1046 H LYS 127 H LYS 127 0.920 -13.390 3.282 1047 HA LYS 127 HA LYS 127 0.902 -15.017 5.704 1048 1HB LYS 127 HB2 LYS 127 2.477 -15.574 3.939 1049 2HB LYS 127 HB3 LYS 127 3.162 -13.949 3.991 1050 1HG LYS 127 HG2 LYS 127 4.654 -14.764 5.477 1051 2HG LYS 127 HG3 LYS 127 3.321 -14.816 6.632 1052 1HD LYS 127 HD2 LYS 127 3.743 -17.080 4.691 1053 2HD LYS 127 HD3 LYS 127 4.665 -17.006 6.193 1054 1HE LYS 127 HE2 LYS 127 2.167 -16.506 7.137 1055 2HE LYS 127 HE3 LYS 127 1.784 -17.554 5.771 1056 1HZ LYS 127 HZ1 LYS 127 3.905 -18.781 6.918 1057 2HZ LYS 127 HZ2 LYS 127 3.062 -18.188 8.265 1058 3HZ LYS 127 HZ3 LYS 127 2.278 -19.209 7.156 1059 H SER 128 H SER 128 2.799 -12.102 4.902 1060 HA SER 128 HA SER 128 3.548 -11.416 7.509 1061 1HB SER 128 HB2 SER 128 2.751 -9.163 5.735 1062 2HB SER 128 HB3 SER 128 4.252 -9.419 6.622 1063 HG SER 128 HG SER 128 5.051 -10.378 4.930 1064 H GLU 129 H GLU 129 0.547 -10.549 5.791 1065 HA GLU 129 HA GLU 129 -0.560 -8.905 7.835 1066 1HB GLU 129 HB2 GLU 129 -1.376 -9.580 5.354 1067 2HB GLU 129 HB3 GLU 129 -2.414 -10.652 6.294 1068 1HG GLU 129 HG2 GLU 129 -2.169 -7.806 7.178 1069 2HG GLU 129 HG3 GLU 129 -3.152 -8.149 5.754 1070 H ALA 130 H ALA 130 -0.858 -12.421 7.267 1071 HA ALA 130 HA ALA 130 -2.617 -13.026 9.387 1072 1HB ALA 130 HB1 ALA 130 -1.326 -14.531 7.552 1073 2HB ALA 130 HB2 ALA 130 -0.333 -14.886 8.965 1074 3HB ALA 130 HB3 ALA 130 -2.065 -15.220 8.997 1075 H GLN 131 H GLN 131 0.838 -12.353 9.404 1076 HA GLN 131 HA GLN 131 1.285 -13.121 12.154 1077 1HB GLN 131 HB2 GLN 131 3.120 -12.875 10.491 1078 2HB GLN 131 HB3 GLN 131 2.815 -11.138 10.440 1079 1HG GLN 131 HG2 GLN 131 3.375 -10.917 12.795 1080 2HG GLN 131 HG3 GLN 131 3.537 -12.666 12.956 1081 1HE2 GLN 131 HE21 GLN 131 5.109 -9.754 11.734 1082 2HE2 GLN 131 HE22 GLN 131 6.585 -10.494 11.341 1083 H ALA 132 H ALA 132 0.294 -10.147 10.532 1084 HA ALA 132 HA ALA 132 0.524 -8.437 12.838 1085 1HB ALA 132 HB1 ALA 132 -1.072 -8.259 10.275 1086 2HB ALA 132 HB2 ALA 132 -1.149 -7.009 11.519 1087 3HB ALA 132 HB3 ALA 132 0.380 -7.360 10.715 1088 H LYS 133 H LYS 133 -1.936 -10.665 11.690 1089 HA LYS 133 HA LYS 133 -4.047 -9.665 13.403 1090 1HB LYS 133 HB2 LYS 133 -3.594 -12.135 11.764 1091 2HB LYS 133 HB3 LYS 133 -4.880 -12.140 12.968 1092 1HG LYS 133 HG2 LYS 133 -5.278 -9.711 11.764 1093 2HG LYS 133 HG3 LYS 133 -4.713 -10.687 10.409 1094 1HD LYS 133 HD2 LYS 133 -7.008 -11.376 12.268 1095 2HD LYS 133 HD3 LYS 133 -7.152 -10.850 10.590 1096 1HE LYS 133 HE2 LYS 133 -6.348 -12.859 9.746 1097 2HE LYS 133 HE3 LYS 133 -5.438 -13.230 11.211 1098 1HZ LYS 133 HZ1 LYS 133 -8.387 -13.108 11.245 1099 2HZ LYS 133 HZ2 LYS 133 -7.581 -14.522 10.758 1100 3HZ LYS 133 HZ3 LYS 133 -7.340 -13.907 12.319 1101 H LYS 134 H LYS 134 -1.710 -12.353 13.655 1102 HA LYS 134 HA LYS 134 -2.608 -13.269 16.223 1103 1HB LYS 134 HB2 LYS 134 -0.302 -14.285 16.364 1104 2HB LYS 134 HB3 LYS 134 -1.170 -14.689 14.881 1105 1HG LYS 134 HG2 LYS 134 0.077 -13.110 13.601 1106 2HG LYS 134 HG3 LYS 134 0.726 -12.340 15.049 1107 1HD LYS 134 HD2 LYS 134 2.534 -13.663 14.515 1108 2HD LYS 134 HD3 LYS 134 1.630 -14.821 15.492 1109 1HE LYS 134 HE2 LYS 134 0.544 -15.024 12.904 1110 2HE LYS 134 HE3 LYS 134 2.291 -14.941 12.673 1111 1HZ LYS 134 HZ1 LYS 134 1.082 -16.719 14.700 1112 2HZ LYS 134 HZ2 LYS 134 1.270 -17.214 13.086 1113 3HZ LYS 134 HZ3 LYS 134 2.631 -16.798 14.013 1114 H GLU 135 H GLU 135 -0.536 -10.655 15.187 1115 HA GLU 135 HA GLU 135 0.458 -10.142 17.912 1116 1HB GLU 135 HB2 GLU 135 1.079 -9.230 15.191 1117 2HB GLU 135 HB3 GLU 135 1.090 -7.925 16.379 1118 1HG GLU 135 HG2 GLU 135 2.715 -9.042 17.732 1119 2HG GLU 135 HG3 GLU 135 2.527 -10.548 16.832 1120 H LYS 136 H LYS 136 -2.228 -9.284 15.954 1121 HA LYS 136 HA LYS 136 -3.957 -7.720 16.255 1122 1HB LYS 136 HB2 LYS 136 -2.999 -8.080 19.111 1123 2HB LYS 136 HB3 LYS 136 -4.470 -7.212 18.671 1124 1HG LYS 136 HG2 LYS 136 -5.246 -9.290 17.473 1125 2HG LYS 136 HG3 LYS 136 -3.852 -10.132 18.151 1126 1HD LYS 136 HD2 LYS 136 -4.959 -10.449 20.081 1127 2HD LYS 136 HD3 LYS 136 -5.168 -8.707 20.261 1128 1HE LYS 136 HE2 LYS 136 -7.358 -8.911 19.800 1129 2HE LYS 136 HE3 LYS 136 -6.970 -9.620 18.234 1130 1HZ LYS 136 HZ1 LYS 136 -6.650 -11.767 19.441 1131 2HZ LYS 136 HZ2 LYS 136 -7.306 -11.029 20.821 1132 3HZ LYS 136 HZ3 LYS 136 -8.250 -11.195 19.419 1133 H LEU 137 H LEU 137 -2.028 -6.394 15.136 1134 HA LEU 137 HA LEU 137 -1.237 -4.128 16.904 1135 1HB LEU 137 HB2 LEU 137 -0.182 -5.260 14.333 1136 2HB LEU 137 HB3 LEU 137 0.120 -3.566 14.716 1137 HG LEU 137 HG LEU 137 0.689 -5.739 16.722 1138 1HD1 LEU 137 HD11 LEU 137 1.882 -6.217 14.562 1139 2HD1 LEU 137 HD12 LEU 137 2.633 -4.624 14.678 1140 3HD1 LEU 137 HD13 LEU 137 2.974 -5.850 15.899 1141 1HD2 LEU 137 HD21 LEU 137 1.653 -2.902 16.260 1142 2HD2 LEU 137 HD22 LEU 137 0.686 -3.493 17.611 1143 3HD2 LEU 137 HD23 LEU 137 2.372 -3.988 17.449 1144 H ASN 138 H ASN 138 -2.001 -2.072 16.521 1145 HA ASN 138 HA ASN 138 -3.401 -0.408 15.644 1146 1HB ASN 138 HB2 ASN 138 -3.131 -1.563 12.909 1147 2HB ASN 138 HB3 ASN 138 -2.926 0.102 13.443 1148 1HD2 ASN 138 HD21 ASN 138 -1.000 -0.145 15.421 1149 2HD2 ASN 138 HD22 ASN 138 0.437 -0.781 14.784 1150 H ILE 139 H ILE 139 -4.888 -1.080 12.993 1151 HA ILE 139 HA ILE 139 -7.449 -1.397 13.740 1152 HB ILE 139 HB ILE 139 -6.317 -3.145 11.551 1153 1HG1 ILE 139 HG12 ILE 139 -7.127 -0.691 10.464 1154 2HG1 ILE 139 HG13 ILE 139 -6.190 -0.259 11.894 1155 1HG2 ILE 139 HG21 ILE 139 -8.920 -2.645 12.458 1156 2HG2 ILE 139 HG22 ILE 139 -8.740 -1.636 11.022 1157 3HG2 ILE 139 HG23 ILE 139 -8.465 -3.375 10.918 1158 1HD1 ILE 139 HD11 ILE 139 -5.000 -2.429 10.300 1159 2HD1 ILE 139 HD12 ILE 139 -5.100 -0.885 9.451 1160 3HD1 ILE 139 HD13 ILE 139 -4.245 -0.992 10.988 1161 H TRP 140 H TRP 140 -5.088 -4.041 13.809 1162 HA TRP 140 HA TRP 140 -7.157 -5.964 14.647 1163 1HB TRP 140 HB2 TRP 140 -4.175 -6.422 14.742 1164 2HB TRP 140 HB3 TRP 140 -5.461 -7.612 14.541 1165 HD1 TRP 140 HD1 TRP 140 -2.979 -5.834 12.590 1166 HE1 TRP 140 HE1 TRP 140 -3.571 -5.831 10.080 1167 HE3 TRP 140 HE3 TRP 140 -7.859 -7.317 12.832 1168 HZ2 TRP 140 HZ2 TRP 140 -5.817 -6.383 8.399 1169 HZ3 TRP 140 HZ3 TRP 140 -9.201 -7.570 10.764 1170 HH2 TRP 140 HH2 TRP 140 -8.187 -7.105 8.549 1171 H SER 141 H SER 141 -7.007 -3.755 16.384 1172 HA SER 141 HA SER 141 -5.602 -4.882 18.770 1173 1HB SER 141 HB2 SER 141 -5.108 -2.486 17.910 1174 2HB SER 141 HB3 SER 141 -6.690 -2.076 18.566 1175 HG SER 141 HG SER 141 -5.376 -1.777 20.256 1176 H GLU 142 H GLU 142 -7.269 -6.326 19.409 1177 HA GLU 142 HA GLU 142 -9.950 -5.161 19.932 1178 1HB GLU 142 HB2 GLU 142 -9.126 -8.023 20.433 1179 2HB GLU 142 HB3 GLU 142 -10.741 -7.387 20.126 1180 1HG GLU 142 HG2 GLU 142 -9.702 -6.614 17.840 1181 2HG GLU 142 HG3 GLU 142 -8.494 -7.852 18.189 1182 H ASP 143 H ASP 143 -10.595 -6.900 22.125 1183 HA ASP 143 HA ASP 143 -9.176 -5.437 24.272 1184 1HB ASP 143 HB2 ASP 143 -11.767 -6.875 24.007 1185 2HB ASP 143 HB3 ASP 143 -11.000 -6.926 25.595 1186 H ASN 144 H ASN 144 -7.430 -6.388 25.193 1187 HA ASN 144 HA ASN 144 -7.358 -9.379 25.278 1188 1HB ASN 144 HB2 ASN 144 -5.439 -7.455 24.293 1189 2HB ASN 144 HB3 ASN 144 -4.741 -8.374 25.627 1190 1HD2 ASN 144 HD21 ASN 144 -6.072 -8.650 22.354 1191 2HD2 ASN 144 HD22 ASN 144 -5.567 -10.249 22.095 1192 H ALA 145 H ALA 145 -5.811 -10.117 27.133 1193 HA ALA 145 HA ALA 145 -6.678 -8.671 29.577 1194 1HB ALA 145 HB1 ALA 145 -5.542 -11.432 29.089 1195 2HB ALA 145 HB2 ALA 145 -5.738 -10.766 30.710 1196 3HB ALA 145 HB3 ALA 145 -7.149 -11.012 29.681 1197 H ASP 146 H ASP 146 -3.692 -10.483 28.816 1198 HA ASP 146 HA ASP 146 -1.446 -9.923 29.192 1199 1HB ASP 146 HB2 ASP 146 -2.766 -7.419 28.394 1200 2HB ASP 146 HB3 ASP 146 -1.318 -7.174 29.371 1201 H SER 147 H SER 147 -0.044 -9.275 30.939 1202 HA SER 147 HA SER 147 -1.332 -8.097 33.331 1203 1HB SER 147 HB2 SER 147 -0.975 -9.921 34.745 1204 2HB SER 147 HB3 SER 147 -1.461 -10.725 33.254 1205 HG SER 147 HG SER 147 0.444 -11.634 34.110 1206 H GLY 148 H GLY 148 0.798 -7.325 31.398 1207 1HA GLY 148 HA2 GLY 148 2.727 -5.970 31.769 1208 2HA GLY 148 HA3 GLY 148 2.839 -6.621 33.405 1209 H GLN 149 H GLN 149 2.427 -9.372 31.947 1210 HA GLN 149 HA GLN 149 5.280 -9.974 31.805 1211 1HB GLN 149 HB2 GLN 149 3.516 -11.562 32.685 1212 2HB GLN 149 HB3 GLN 149 2.958 -11.757 31.023 1213 1HG GLN 149 HG2 GLN 149 4.953 -12.796 30.340 1214 2HG GLN 149 HG3 GLN 149 5.860 -12.167 31.715 1215 1HE2 GLN 149 HE21 GLN 149 2.638 -13.551 32.156 1216 2HE2 GLN 149 HE22 GLN 149 3.155 -14.953 32.961 1217 HN3 PTP 150 H3 PTP 150 -11.113 -3.586 -8.769 1218 1H5M PTP 150 H51 PTP 150 -7.760 -0.648 -5.674 1219 2H5M PTP 150 H52 PTP 150 -7.093 -1.403 -7.141 1220 3H5M PTP 150 H53 PTP 150 -7.552 -2.414 -5.750 1221 H6 PTP 150 H6 PTP 150 -9.870 0.113 -5.961 1222 H1* PTP 150 H1' PTP 150 -13.070 0.332 -7.634 1223 2H2* PTP 150 H2' PTP 150 -12.789 -0.961 -4.945 1224 H3* PTP 150 H3' PTP 150 -13.252 1.029 -3.738 1225 H4* PTP 150 H4' PTP 150 -12.183 2.988 -5.305 1226 2H5* PTP 150 H5' PTP 150 -10.817 0.571 -3.979 Start of MODEL 11 1 1H ALA 1 H1 ALA 1 13.118 -14.623 -19.428 2 2H ALA 1 H2 ALA 1 13.152 -13.455 -20.661 3 3H ALA 1 H3 ALA 1 11.987 -14.687 -20.694 4 HA ALA 1 HA ALA 1 13.331 -15.923 -21.919 5 1HB ALA 1 HB1 ALA 1 14.381 -13.496 -22.269 6 2HB ALA 1 HB2 ALA 1 15.741 -14.225 -21.413 7 3HB ALA 1 HB3 ALA 1 15.166 -14.934 -22.922 8 H THR 2 H THR 2 14.989 -14.730 -19.000 9 HA THR 2 HA THR 2 16.131 -17.473 -18.655 10 HB THR 2 HB THR 2 17.900 -15.844 -18.745 11 HG1 THR 2 HG1 THR 2 18.235 -17.284 -17.104 12 1HG2 THR 2 HG21 THR 2 15.939 -14.234 -17.232 13 2HG2 THR 2 HG22 THR 2 17.614 -14.046 -16.715 14 3HG2 THR 2 HG23 THR 2 17.166 -13.719 -18.389 15 H SER 3 H SER 3 13.392 -16.583 -17.920 16 HA SER 3 HA SER 3 13.405 -17.615 -15.187 17 1HB SER 3 HB2 SER 3 13.750 -14.929 -15.315 18 2HB SER 3 HB3 SER 3 11.991 -15.008 -15.360 19 HG SER 3 HG SER 3 12.494 -16.655 -13.531 20 H THR 4 H THR 4 11.195 -18.074 -14.451 21 HA THR 4 HA THR 4 9.497 -19.039 -16.524 22 HB THR 4 HB THR 4 7.863 -19.448 -14.755 23 HG1 THR 4 HG1 THR 4 8.727 -18.614 -12.593 24 1HG2 THR 4 HG21 THR 4 10.761 -19.972 -14.270 25 2HG2 THR 4 HG22 THR 4 9.628 -20.360 -12.975 26 3HG2 THR 4 HG23 THR 4 9.447 -21.111 -14.560 27 H LYS 5 H LYS 5 8.966 -16.233 -14.342 28 HA LYS 5 HA LYS 5 8.085 -14.498 -16.423 29 1HB LYS 5 HB2 LYS 5 6.171 -16.458 -15.766 30 2HB LYS 5 HB3 LYS 5 5.617 -14.974 -14.988 31 1HG LYS 5 HG2 LYS 5 5.879 -13.768 -17.141 32 2HG LYS 5 HG3 LYS 5 6.367 -15.278 -17.912 33 1HD LYS 5 HD2 LYS 5 3.970 -15.852 -16.530 34 2HD LYS 5 HD3 LYS 5 3.702 -14.313 -17.350 35 1HE LYS 5 HE2 LYS 5 4.841 -15.540 -19.387 36 2HE LYS 5 HE3 LYS 5 4.346 -16.997 -18.526 37 1HZ LYS 5 HZ1 LYS 5 2.317 -14.949 -18.707 38 2HZ LYS 5 HZ2 LYS 5 2.774 -15.617 -20.201 39 3HZ LYS 5 HZ3 LYS 5 2.197 -16.622 -18.958 40 H LYS 6 H LYS 6 9.170 -12.898 -15.260 41 HA LYS 6 HA LYS 6 8.086 -12.290 -12.538 42 1HB LYS 6 HB2 LYS 6 10.728 -12.683 -13.300 43 2HB LYS 6 HB3 LYS 6 10.572 -10.926 -13.273 44 1HG LYS 6 HG2 LYS 6 9.458 -11.201 -10.987 45 2HG LYS 6 HG3 LYS 6 10.019 -12.871 -11.025 46 1HD LYS 6 HD2 LYS 6 12.351 -12.029 -11.379 47 2HD LYS 6 HD3 LYS 6 11.746 -10.384 -11.178 48 1HE LYS 6 HE2 LYS 6 12.111 -10.669 -8.965 49 2HE LYS 6 HE3 LYS 6 10.700 -11.727 -8.982 50 1HZ LYS 6 HZ1 LYS 6 13.036 -13.062 -9.917 51 2HZ LYS 6 HZ2 LYS 6 13.267 -12.444 -8.355 52 3HZ LYS 6 HZ3 LYS 6 11.973 -13.499 -8.667 53 H LEU 7 H LEU 7 8.036 -9.896 -12.044 54 HA LEU 7 HA LEU 7 6.866 -8.481 -14.354 55 1HB LEU 7 HB2 LEU 7 7.016 -7.888 -11.393 56 2HB LEU 7 HB3 LEU 7 6.378 -6.725 -12.555 57 HG LEU 7 HG LEU 7 5.359 -9.562 -12.470 58 1HD1 LEU 7 HD11 LEU 7 5.138 -8.509 -10.203 59 2HD1 LEU 7 HD12 LEU 7 4.217 -7.202 -10.948 60 3HD1 LEU 7 HD13 LEU 7 3.587 -8.849 -10.971 61 1HD2 LEU 7 HD21 LEU 7 4.457 -6.913 -13.591 62 2HD2 LEU 7 HD22 LEU 7 4.626 -8.461 -14.419 63 3HD2 LEU 7 HD23 LEU 7 3.291 -8.202 -13.296 64 H HIS 8 H HIS 8 7.421 -5.910 -14.105 65 HA HIS 8 HA HIS 8 10.407 -5.754 -14.228 66 1HB HIS 8 HB2 HIS 8 9.510 -5.389 -16.428 67 2HB HIS 8 HB3 HIS 8 8.273 -4.297 -15.807 68 HD1 HIS 8 HD1 HIS 8 11.923 -4.204 -14.807 69 HD2 HIS 8 HD2 HIS 8 9.204 -1.941 -17.012 70 HE1 HIS 8 HE1 HIS 8 13.090 -2.026 -15.364 71 H LYS 9 H LYS 9 11.177 -4.653 -12.491 72 HA LYS 9 HA LYS 9 9.425 -2.698 -11.123 73 1HB LYS 9 HB2 LYS 9 12.217 -3.580 -10.346 74 2HB LYS 9 HB3 LYS 9 11.025 -2.777 -9.323 75 1HG LYS 9 HG2 LYS 9 9.555 -4.714 -9.434 76 2HG LYS 9 HG3 LYS 9 10.637 -5.511 -10.576 77 1HD LYS 9 HD2 LYS 9 11.314 -6.491 -8.576 78 2HD LYS 9 HD3 LYS 9 12.429 -5.127 -8.675 79 1HE LYS 9 HE2 LYS 9 11.660 -4.476 -6.657 80 2HE LYS 9 HE3 LYS 9 10.139 -4.075 -7.454 81 1HZ LYS 9 HZ1 LYS 9 10.402 -6.876 -6.937 82 2HZ LYS 9 HZ2 LYS 9 10.486 -5.954 -5.513 83 3HZ LYS 9 HZ3 LYS 9 9.137 -5.815 -6.532 84 H GLU 10 H GLU 10 9.795 -0.507 -11.158 85 HA GLU 10 HA GLU 10 12.260 0.449 -12.550 86 1HB GLU 10 HB2 GLU 10 9.439 0.871 -13.241 87 2HB GLU 10 HB3 GLU 10 10.347 2.376 -13.091 88 1HG GLU 10 HG2 GLU 10 12.109 0.775 -14.477 89 2HG GLU 10 HG3 GLU 10 10.551 0.263 -15.127 90 HA PRO 11 HA PRO 11 12.589 3.358 -9.251 91 1HB PRO 11 HB2 PRO 11 13.650 5.516 -10.541 92 2HB PRO 11 HB3 PRO 11 14.552 4.018 -10.259 93 1HG PRO 11 HG2 PRO 11 13.385 5.062 -12.782 94 2HG PRO 11 HG3 PRO 11 14.751 3.962 -12.546 95 1HD PRO 11 HD2 PRO 11 12.105 3.237 -13.293 96 2HD PRO 11 HD3 PRO 11 13.417 2.131 -12.829 97 H ALA 12 H ALA 12 11.906 5.552 -8.471 98 HA ALA 12 HA ALA 12 9.822 6.922 -10.047 99 1HB ALA 12 HB1 ALA 12 8.818 4.952 -8.637 100 2HB ALA 12 HB2 ALA 12 9.078 6.035 -7.269 101 3HB ALA 12 HB3 ALA 12 8.024 6.526 -8.597 102 H THR 13 H THR 13 8.969 8.856 -8.656 103 HA THR 13 HA THR 13 11.144 9.822 -6.849 104 HB THR 13 HB THR 13 9.777 11.823 -8.576 105 HG1 THR 13 HG1 THR 13 11.701 11.186 -10.052 106 1HG2 THR 13 HG21 THR 13 11.937 11.757 -6.817 107 2HG2 THR 13 HG22 THR 13 12.686 11.820 -8.412 108 3HG2 THR 13 HG23 THR 13 11.539 13.068 -7.926 109 H LEU 14 H LEU 14 10.216 10.167 -4.893 110 HA LEU 14 HA LEU 14 7.399 10.358 -4.464 111 1HB LEU 14 HB2 LEU 14 8.905 9.672 -2.668 112 2HB LEU 14 HB3 LEU 14 9.708 11.242 -2.706 113 HG LEU 14 HG LEU 14 7.382 12.248 -2.243 114 1HD1 LEU 14 HD11 LEU 14 6.904 9.308 -1.832 115 2HD1 LEU 14 HD12 LEU 14 6.024 10.484 -0.857 116 3HD1 LEU 14 HD13 LEU 14 5.868 10.502 -2.613 117 1HD2 LEU 14 HD21 LEU 14 9.293 10.917 -0.462 118 2HD2 LEU 14 HD22 LEU 14 8.541 12.505 -0.312 119 3HD2 LEU 14 HD23 LEU 14 7.687 11.068 0.251 120 H ILE 15 H ILE 15 6.085 12.183 -4.032 121 HA ILE 15 HA ILE 15 7.312 14.845 -4.600 122 HB ILE 15 HB ILE 15 4.787 13.681 -5.806 123 1HG1 ILE 15 HG12 ILE 15 7.356 14.797 -6.975 124 2HG1 ILE 15 HG13 ILE 15 6.836 13.112 -7.005 125 1HG2 ILE 15 HG21 ILE 15 5.261 16.357 -5.001 126 2HG2 ILE 15 HG22 ILE 15 5.453 16.320 -6.753 127 3HG2 ILE 15 HG23 ILE 15 3.951 15.759 -6.019 128 1HD1 ILE 15 HD11 ILE 15 4.700 14.060 -8.185 129 2HD1 ILE 15 HD12 ILE 15 5.722 15.457 -8.524 130 3HD1 ILE 15 HD13 ILE 15 6.181 13.863 -9.124 131 H LYS 16 H LYS 16 4.144 13.422 -3.701 132 HA LYS 16 HA LYS 16 4.207 14.891 -1.151 133 1HB LYS 16 HB2 LYS 16 3.216 16.340 -3.149 134 2HB LYS 16 HB3 LYS 16 1.778 15.368 -2.835 135 1HG LYS 16 HG2 LYS 16 2.478 16.039 -0.294 136 2HG LYS 16 HG3 LYS 16 3.041 17.465 -1.166 137 1HD LYS 16 HD2 LYS 16 0.904 18.021 -1.911 138 2HD LYS 16 HD3 LYS 16 0.311 16.366 -1.757 139 1HE LYS 16 HE2 LYS 16 0.224 16.526 0.634 140 2HE LYS 16 HE3 LYS 16 1.111 18.051 0.627 141 1HZ LYS 16 HZ1 LYS 16 -1.276 18.073 -0.984 142 2HZ LYS 16 HZ2 LYS 16 -1.575 17.821 0.667 143 3HZ LYS 16 HZ3 LYS 16 -0.725 19.201 0.161 144 H ALA 17 H ALA 17 3.776 13.120 0.110 145 HA ALA 17 HA ALA 17 2.205 10.878 -0.673 146 1HB ALA 17 HB1 ALA 17 2.761 11.929 2.119 147 2HB ALA 17 HB2 ALA 17 2.168 10.314 1.735 148 3HB ALA 17 HB3 ALA 17 3.782 10.805 1.221 149 H ILE 18 H ILE 18 0.083 10.254 0.343 150 HA ILE 18 HA ILE 18 -1.666 12.648 0.746 151 HB ILE 18 HB ILE 18 -2.404 10.086 -0.702 152 1HG1 ILE 18 HG12 ILE 18 -2.019 12.864 -1.848 153 2HG1 ILE 18 HG13 ILE 18 -0.767 11.621 -1.892 154 1HG2 ILE 18 HG21 ILE 18 -3.875 12.615 0.017 155 2HG2 ILE 18 HG22 ILE 18 -4.355 11.667 -1.392 156 3HG2 ILE 18 HG23 ILE 18 -4.395 10.941 0.215 157 1HD1 ILE 18 HD11 ILE 18 -2.695 10.142 -2.917 158 2HD1 ILE 18 HD12 ILE 18 -3.403 11.705 -3.323 159 3HD1 ILE 18 HD13 ILE 18 -1.810 11.269 -3.943 160 H ASP 19 H ASP 19 -2.309 9.143 0.909 161 HA ASP 19 HA ASP 19 -3.082 9.552 3.771 162 1HB ASP 19 HB2 ASP 19 -4.807 8.864 1.844 163 2HB ASP 19 HB3 ASP 19 -4.172 7.257 2.203 164 H GLY 20 H GLY 20 -3.449 6.564 3.939 165 1HA GLY 20 HA2 GLY 20 -0.635 5.951 4.575 166 2HA GLY 20 HA3 GLY 20 -2.034 4.971 5.018 167 H ASP 21 H ASP 21 -2.920 5.318 2.066 168 HA ASP 21 HA ASP 21 -0.970 3.413 0.851 169 1HB ASP 21 HB2 ASP 21 -2.893 2.109 -0.053 170 2HB ASP 21 HB3 ASP 21 -2.826 2.072 1.709 171 H THR 22 H THR 22 -1.490 6.310 0.455 172 HA THR 22 HA THR 22 -1.861 6.189 -2.480 173 HB THR 22 HB THR 22 -3.296 8.386 -1.039 174 HG1 THR 22 HG1 THR 22 -4.566 7.005 -0.133 175 1HG2 THR 22 HG21 THR 22 -2.987 7.490 -3.695 176 2HG2 THR 22 HG22 THR 22 -4.653 7.123 -3.250 177 3HG2 THR 22 HG23 THR 22 -4.050 8.775 -3.120 178 H VAL 23 H VAL 23 -0.058 7.197 -3.242 179 HA VAL 23 HA VAL 23 0.769 9.751 -1.964 180 HB VAL 23 HB VAL 23 3.163 9.005 -2.081 181 1HG1 VAL 23 HG11 VAL 23 1.676 8.857 -0.003 182 2HG1 VAL 23 HG12 VAL 23 1.512 7.138 -0.367 183 3HG1 VAL 23 HG13 VAL 23 3.100 7.818 -0.011 184 1HG2 VAL 23 HG21 VAL 23 1.776 6.488 -2.959 185 2HG2 VAL 23 HG22 VAL 23 3.243 7.229 -3.597 186 3HG2 VAL 23 HG23 VAL 23 3.287 6.371 -2.057 187 H LYS 24 H LYS 24 1.636 11.222 -3.438 188 HA LYS 24 HA LYS 24 1.393 10.446 -6.289 189 1HB LYS 24 HB2 LYS 24 2.073 13.208 -5.291 190 2HB LYS 24 HB3 LYS 24 1.243 12.746 -6.776 191 1HG LYS 24 HG2 LYS 24 -0.704 11.998 -5.487 192 2HG LYS 24 HG3 LYS 24 0.125 12.391 -3.980 193 1HD LYS 24 HD2 LYS 24 -1.509 14.157 -4.825 194 2HD LYS 24 HD3 LYS 24 0.123 14.733 -4.482 195 1HE LYS 24 HE2 LYS 24 0.686 14.882 -6.758 196 2HE LYS 24 HE3 LYS 24 -0.607 13.788 -7.246 197 1HZ LYS 24 HZ1 LYS 24 -1.883 15.853 -5.986 198 2HZ LYS 24 HZ2 LYS 24 -0.668 16.618 -6.894 199 3HZ LYS 24 HZ3 LYS 24 -1.792 15.602 -7.661 200 H LEU 25 H LEU 25 3.215 9.743 -7.285 201 HA LEU 25 HA LEU 25 5.820 10.918 -6.394 202 1HB LEU 25 HB2 LEU 25 5.653 8.217 -7.695 203 2HB LEU 25 HB3 LEU 25 6.864 8.841 -6.574 204 HG LEU 25 HG LEU 25 3.992 8.181 -5.854 205 1HD1 LEU 25 HD11 LEU 25 6.104 6.432 -6.269 206 2HD1 LEU 25 HD12 LEU 25 6.160 6.721 -4.531 207 3HD1 LEU 25 HD13 LEU 25 4.685 6.105 -5.275 208 1HD2 LEU 25 HD21 LEU 25 5.348 10.063 -4.628 209 2HD2 LEU 25 HD22 LEU 25 4.499 8.853 -3.667 210 3HD2 LEU 25 HD23 LEU 25 6.239 8.713 -3.924 211 H MET 26 H MET 26 7.332 9.761 -8.525 212 HA MET 26 HA MET 26 6.071 11.026 -10.918 213 1HB MET 26 HB2 MET 26 7.799 12.516 -9.845 214 2HB MET 26 HB3 MET 26 8.998 11.265 -10.176 215 1HG MET 26 HG2 MET 26 8.907 11.586 -12.471 216 2HG MET 26 HG3 MET 26 7.255 12.203 -12.423 217 1HE MET 26 HE1 MET 26 10.662 12.644 -10.971 218 2HE MET 26 HE2 MET 26 10.985 14.375 -10.911 219 3HE MET 26 HE3 MET 26 9.875 13.638 -9.747 220 H TYR 27 H TYR 27 5.867 9.490 -12.443 221 HA TYR 27 HA TYR 27 7.980 7.383 -12.624 222 1HB TYR 27 HB2 TYR 27 5.888 6.369 -11.944 223 2HB TYR 27 HB3 TYR 27 5.007 7.228 -13.207 224 HD1 TYR 27 HD1 TYR 27 5.250 6.599 -15.573 225 HD2 TYR 27 HD2 TYR 27 7.284 4.448 -12.461 226 HE1 TYR 27 HE1 TYR 27 5.724 4.753 -17.159 227 HE2 TYR 27 HE2 TYR 27 7.757 2.601 -14.046 228 HH TYR 27 HH TYR 27 7.110 1.718 -16.081 229 H LYS 28 H LYS 28 9.076 7.378 -14.525 230 HA LYS 28 HA LYS 28 9.621 7.796 -16.760 231 1HB LYS 28 HB2 LYS 28 6.630 7.771 -16.828 232 2HB LYS 28 HB3 LYS 28 7.505 8.363 -18.241 233 1HG LYS 28 HG2 LYS 28 8.145 5.727 -16.900 234 2HG LYS 28 HG3 LYS 28 7.007 5.870 -18.237 235 1HD LYS 28 HD2 LYS 28 8.680 6.583 -19.746 236 2HD LYS 28 HD3 LYS 28 9.799 6.988 -18.443 237 1HE LYS 28 HE2 LYS 28 9.800 4.512 -17.841 238 2HE LYS 28 HE3 LYS 28 8.956 4.231 -19.363 239 1HZ LYS 28 HZ1 LYS 28 10.917 5.712 -20.260 240 2HZ LYS 28 HZ2 LYS 28 11.709 5.088 -18.892 241 3HZ LYS 28 HZ3 LYS 28 11.089 4.032 -20.065 242 H GLY 29 H GLY 29 8.854 10.030 -14.614 243 1HA GLY 29 HA2 GLY 29 9.651 12.301 -14.744 244 2HA GLY 29 HA3 GLY 29 9.480 12.234 -16.496 245 H GLN 30 H GLN 30 6.720 10.916 -15.129 246 HA GLN 30 HA GLN 30 5.333 13.561 -15.286 247 1HB GLN 30 HB2 GLN 30 3.334 11.784 -15.739 248 2HB GLN 30 HB3 GLN 30 4.276 12.526 -17.028 249 1HG GLN 30 HG2 GLN 30 5.884 10.559 -16.812 250 2HG GLN 30 HG3 GLN 30 4.672 9.798 -15.781 251 1HE2 GLN 30 HE21 GLN 30 4.682 11.548 -18.951 252 2HE2 GLN 30 HE22 GLN 30 3.651 10.442 -19.724 253 HA PRO 31 HA PRO 31 3.982 12.812 -11.154 254 1HB PRO 31 HB2 PRO 31 1.864 14.539 -11.124 255 2HB PRO 31 HB3 PRO 31 3.551 15.080 -11.094 256 1HG PRO 31 HG2 PRO 31 1.606 15.090 -13.360 257 2HG PRO 31 HG3 PRO 31 2.921 16.221 -13.001 258 1HD PRO 31 HD2 PRO 31 3.041 14.183 -14.911 259 2HD PRO 31 HD3 PRO 31 4.450 14.995 -14.195 260 H MET 32 H MET 32 2.870 11.000 -10.514 261 HA MET 32 HA MET 32 0.068 10.654 -11.414 262 1HB MET 32 HB2 MET 32 2.264 9.127 -12.471 263 2HB MET 32 HB3 MET 32 1.237 8.064 -11.507 264 1HG MET 32 HG2 MET 32 0.081 9.978 -13.538 265 2HG MET 32 HG3 MET 32 0.599 8.352 -13.982 266 1HE MET 32 HE1 MET 32 -0.152 6.400 -13.410 267 2HE MET 32 HE2 MET 32 -0.406 6.269 -11.671 268 3HE MET 32 HE3 MET 32 -1.743 5.958 -12.775 269 H THR 33 H THR 33 -1.187 9.808 -9.786 270 HA THR 33 HA THR 33 0.052 9.418 -7.172 271 HB THR 33 HB THR 33 -2.809 8.725 -7.805 272 HG1 THR 33 HG1 THR 33 -1.841 11.342 -7.339 273 1HG2 THR 33 HG21 THR 33 -1.852 8.404 -5.518 274 2HG2 THR 33 HG22 THR 33 -1.505 10.131 -5.459 275 3HG2 THR 33 HG23 THR 33 -3.174 9.570 -5.555 276 H PHE 34 H PHE 34 -0.306 7.404 -5.897 277 HA PHE 34 HA PHE 34 -0.699 4.973 -7.568 278 1HB PHE 34 HB2 PHE 34 1.750 5.711 -5.986 279 2HB PHE 34 HB3 PHE 34 1.310 4.014 -6.181 280 HD1 PHE 34 HD1 PHE 34 1.197 2.991 -8.437 281 HD2 PHE 34 HD2 PHE 34 2.548 7.025 -7.846 282 HE1 PHE 34 HE1 PHE 34 2.168 3.000 -10.720 283 HE2 PHE 34 HE2 PHE 34 3.518 7.036 -10.128 284 HZ PHE 34 HZ PHE 34 3.328 5.023 -11.566 285 H ARG 35 H ARG 35 -1.631 3.261 -6.423 286 HA ARG 35 HA ARG 35 -2.221 3.799 -3.540 287 1HB ARG 35 HB2 ARG 35 -4.236 4.045 -4.947 288 2HB ARG 35 HB3 ARG 35 -3.987 2.420 -5.586 289 1HG ARG 35 HG2 ARG 35 -5.187 1.627 -3.854 290 2HG ARG 35 HG3 ARG 35 -3.884 2.150 -2.785 291 1HD ARG 35 HD2 ARG 35 -4.918 4.355 -2.550 292 2HD ARG 35 HD3 ARG 35 -6.189 3.903 -3.686 293 HE ARG 35 HE ARG 35 -5.970 2.132 -1.359 294 1HH1 ARG 35 HH11 ARG 35 -6.900 5.327 -2.019 295 2HH1 ARG 35 HH12 ARG 35 -8.474 5.183 -1.312 296 1HH2 ARG 35 HH21 ARG 35 -8.203 1.769 -0.761 297 2HH2 ARG 35 HH22 ARG 35 -9.213 3.167 -0.598 298 H LEU 36 H LEU 36 -1.692 2.158 -2.149 299 HA LEU 36 HA LEU 36 -0.015 0.028 -2.917 300 1HB LEU 36 HB2 LEU 36 -1.874 0.195 -0.527 301 2HB LEU 36 HB3 LEU 36 -0.535 -0.941 -0.692 302 HG LEU 36 HG LEU 36 -0.414 2.068 -0.444 303 1HD1 LEU 36 HD11 LEU 36 0.336 -0.303 1.171 304 2HD1 LEU 36 HD12 LEU 36 1.509 1.015 1.160 305 3HD1 LEU 36 HD13 LEU 36 -0.145 1.312 1.694 306 1HD2 LEU 36 HD21 LEU 36 1.770 0.163 -1.351 307 2HD2 LEU 36 HD22 LEU 36 1.056 1.462 -2.306 308 3HD2 LEU 36 HD23 LEU 36 2.035 1.844 -0.890 309 H LEU 37 H LEU 37 -0.397 -1.988 -3.742 310 HA LEU 37 HA LEU 37 -3.175 -2.646 -4.495 311 1HB LEU 37 HB2 LEU 37 -0.464 -3.416 -5.393 312 2HB LEU 37 HB3 LEU 37 -1.673 -4.696 -5.465 313 HG LEU 37 HG LEU 37 -2.254 -1.946 -6.557 314 1HD1 LEU 37 HD11 LEU 37 -0.133 -3.269 -7.505 315 2HD1 LEU 37 HD12 LEU 37 -1.387 -4.154 -8.374 316 3HD1 LEU 37 HD13 LEU 37 -1.236 -2.409 -8.579 317 1HD2 LEU 37 HD21 LEU 37 -3.683 -4.400 -6.268 318 2HD2 LEU 37 HD22 LEU 37 -4.228 -2.916 -7.050 319 3HD2 LEU 37 HD23 LEU 37 -3.396 -4.153 -7.991 320 H LEU 38 H LEU 38 -4.233 -4.554 -3.869 321 HA LEU 38 HA LEU 38 -4.786 -6.357 -2.488 322 1HB LEU 38 HB2 LEU 38 -1.794 -6.518 -2.610 323 2HB LEU 38 HB3 LEU 38 -2.675 -7.574 -1.505 324 HG LEU 38 HG LEU 38 -3.376 -7.321 -4.438 325 1HD1 LEU 38 HD11 LEU 38 -1.608 -9.366 -3.059 326 2HD1 LEU 38 HD12 LEU 38 -2.162 -9.464 -4.730 327 3HD1 LEU 38 HD13 LEU 38 -1.075 -8.165 -4.236 328 1HD2 LEU 38 HD21 LEU 38 -4.209 -9.049 -2.126 329 2HD2 LEU 38 HD22 LEU 38 -5.209 -8.285 -3.362 330 3HD2 LEU 38 HD23 LEU 38 -4.260 -9.717 -3.758 331 H VAL 39 H VAL 39 -4.457 -3.607 -1.312 332 HA VAL 39 HA VAL 39 -4.403 -4.527 1.503 333 HB VAL 39 HB VAL 39 -2.838 -2.890 2.251 334 1HG1 VAL 39 HG11 VAL 39 -1.879 -4.919 1.126 335 2HG1 VAL 39 HG12 VAL 39 -1.740 -3.975 -0.357 336 3HG1 VAL 39 HG13 VAL 39 -0.812 -3.516 1.069 337 1HG2 VAL 39 HG21 VAL 39 -3.652 -1.066 0.761 338 2HG2 VAL 39 HG22 VAL 39 -1.892 -1.183 0.773 339 3HG2 VAL 39 HG23 VAL 39 -2.809 -1.824 -0.590 340 H ASP 40 H ASP 40 -5.049 -2.548 2.954 341 HA ASP 40 HA ASP 40 -6.726 -0.548 1.617 342 1HB ASP 40 HB2 ASP 40 -8.293 -2.390 1.620 343 2HB ASP 40 HB3 ASP 40 -7.924 -2.763 3.303 344 H THR 41 H THR 41 -6.737 1.275 2.870 345 HA THR 41 HA THR 41 -5.696 1.010 5.651 346 HB THR 41 HB THR 41 -5.425 3.579 5.344 347 HG1 THR 41 HG1 THR 41 -5.290 4.183 3.169 348 1HG2 THR 41 HG21 THR 41 -3.791 1.367 4.753 349 2HG2 THR 41 HG22 THR 41 -3.576 2.485 3.407 350 3HG2 THR 41 HG23 THR 41 -3.265 3.021 5.058 351 HA PRO 42 HA PRO 42 -9.518 2.313 7.405 352 1HB PRO 42 HB2 PRO 42 -8.645 3.834 9.501 353 2HB PRO 42 HB3 PRO 42 -8.489 2.068 9.460 354 1HG PRO 42 HG2 PRO 42 -6.404 4.159 8.959 355 2HG PRO 42 HG3 PRO 42 -6.246 2.580 9.747 356 1HD PRO 42 HD2 PRO 42 -5.481 3.091 7.133 357 2HD PRO 42 HD3 PRO 42 -5.908 1.479 7.751 358 H GLU 43 H GLU 43 -10.909 3.843 6.612 359 HA GLU 43 HA GLU 43 -10.101 6.234 5.320 360 1HB GLU 43 HB2 GLU 43 -12.770 5.592 6.613 361 2HB GLU 43 HB3 GLU 43 -12.485 6.879 5.441 362 1HG GLU 43 HG2 GLU 43 -13.058 5.305 3.903 363 2HG GLU 43 HG3 GLU 43 -11.412 4.720 4.142 364 H THR 44 H THR 44 -10.096 8.414 6.020 365 HA THR 44 HA THR 44 -10.541 8.922 8.912 366 HB THR 44 HB THR 44 -8.388 9.963 9.211 367 HG1 THR 44 HG1 THR 44 -6.909 9.921 7.402 368 1HG2 THR 44 HG21 THR 44 -8.222 7.286 7.812 369 2HG2 THR 44 HG22 THR 44 -6.845 8.032 8.624 370 3HG2 THR 44 HG23 THR 44 -8.282 7.591 9.548 371 H LYS 45 H LYS 45 -11.567 9.681 6.053 372 HA LYS 45 HA LYS 45 -11.406 12.643 6.420 373 1HB LYS 45 HB2 LYS 45 -12.182 12.726 4.024 374 2HB LYS 45 HB3 LYS 45 -10.605 11.965 4.237 375 1HG LYS 45 HG2 LYS 45 -11.380 9.888 3.664 376 2HG LYS 45 HG3 LYS 45 -12.958 10.160 4.403 377 1HD LYS 45 HD2 LYS 45 -13.857 10.948 2.474 378 2HD LYS 45 HD3 LYS 45 -12.417 11.891 2.086 379 1HE LYS 45 HE2 LYS 45 -11.606 10.275 0.732 380 2HE LYS 45 HE3 LYS 45 -11.933 9.014 1.920 381 1HZ LYS 45 HZ1 LYS 45 -14.370 9.388 1.224 382 2HZ LYS 45 HZ2 LYS 45 -13.703 10.096 -0.169 383 3HZ LYS 45 HZ3 LYS 45 -13.357 8.479 0.208 384 H HIS 46 H HIS 46 -13.478 9.919 6.610 385 HA HIS 46 HA HIS 46 -16.006 10.796 5.924 386 1HB HIS 46 HB2 HIS 46 -14.984 8.762 7.531 387 2HB HIS 46 HB3 HIS 46 -16.033 9.672 8.618 388 HD1 HIS 46 HD1 HIS 46 -16.421 6.800 6.878 389 HD2 HIS 46 HD2 HIS 46 -18.468 10.416 6.549 390 HE1 HIS 46 HE1 HIS 46 -18.644 6.267 5.788 391 HA PRO 47 HA PRO 47 -15.990 14.603 8.403 392 1HB PRO 47 HB2 PRO 47 -18.005 15.765 6.964 393 2HB PRO 47 HB3 PRO 47 -16.314 15.759 6.428 394 1HG PRO 47 HG2 PRO 47 -18.594 14.041 5.512 395 2HG PRO 47 HG3 PRO 47 -17.257 14.728 4.573 396 1HD PRO 47 HD2 PRO 47 -17.336 12.101 5.414 397 2HD PRO 47 HD3 PRO 47 -15.829 12.986 5.086 398 H LYS 48 H LYS 48 -16.920 13.006 10.078 399 HA LYS 48 HA LYS 48 -19.393 13.944 11.096 400 1HB LYS 48 HB2 LYS 48 -20.081 12.542 8.978 401 2HB LYS 48 HB3 LYS 48 -19.771 11.160 10.029 402 1HG LYS 48 HG2 LYS 48 -21.455 11.778 11.552 403 2HG LYS 48 HG3 LYS 48 -21.499 13.443 10.966 404 1HD LYS 48 HD2 LYS 48 -23.358 12.676 9.863 405 2HD LYS 48 HD3 LYS 48 -22.149 12.167 8.683 406 1HE LYS 48 HE2 LYS 48 -22.975 10.079 8.953 407 2HE LYS 48 HE3 LYS 48 -22.162 10.086 10.518 408 1HZ LYS 48 HZ1 LYS 48 -24.820 11.310 10.273 409 2HZ LYS 48 HZ2 LYS 48 -24.694 9.619 10.376 410 3HZ LYS 48 HZ3 LYS 48 -24.084 10.597 11.624 411 H LYS 49 H LYS 49 -17.903 10.696 10.788 412 HA LYS 49 HA LYS 49 -17.448 10.769 13.743 413 1HB LYS 49 HB2 LYS 49 -19.389 9.279 12.952 414 2HB LYS 49 HB3 LYS 49 -18.153 8.255 12.221 415 1HG LYS 49 HG2 LYS 49 -17.340 7.545 14.249 416 2HG LYS 49 HG3 LYS 49 -17.722 9.068 15.053 417 1HD LYS 49 HD2 LYS 49 -20.204 7.991 14.273 418 2HD LYS 49 HD3 LYS 49 -19.287 6.636 14.933 419 1HE LYS 49 HE2 LYS 49 -19.857 7.400 16.979 420 2HE LYS 49 HE3 LYS 49 -18.741 8.734 16.688 421 1HZ LYS 49 HZ1 LYS 49 -20.938 9.512 15.342 422 2HZ LYS 49 HZ2 LYS 49 -21.623 8.709 16.674 423 3HZ LYS 49 HZ3 LYS 49 -20.549 10.001 16.919 424 H GLY 50 H GLY 50 -16.459 9.409 10.609 425 1HA GLY 50 HA2 GLY 50 -14.377 8.593 9.897 426 2HA GLY 50 HA3 GLY 50 -13.688 9.728 11.059 427 H VAL 51 H VAL 51 -12.067 8.291 11.789 428 HA VAL 51 HA VAL 51 -13.070 5.855 13.207 429 HB VAL 51 HB VAL 51 -10.187 6.290 12.461 430 1HG1 VAL 51 HG11 VAL 51 -11.932 4.108 13.409 431 2HG1 VAL 51 HG12 VAL 51 -10.834 3.648 12.108 432 3HG1 VAL 51 HG13 VAL 51 -10.193 4.324 13.606 433 1HG2 VAL 51 HG21 VAL 51 -11.598 6.659 10.420 434 2HG2 VAL 51 HG22 VAL 51 -10.586 5.218 10.307 435 3HG2 VAL 51 HG23 VAL 51 -12.306 5.062 10.667 436 H GLU 52 H GLU 52 -13.027 6.025 15.391 437 HA GLU 52 HA GLU 52 -11.423 8.186 16.627 438 1HB GLU 52 HB2 GLU 52 -13.376 6.267 17.932 439 2HB GLU 52 HB3 GLU 52 -12.721 7.747 18.634 440 1HG GLU 52 HG2 GLU 52 -14.176 7.888 16.012 441 2HG GLU 52 HG3 GLU 52 -15.103 7.780 17.510 442 H LYS 53 H LYS 53 -10.962 4.987 15.817 443 HA LYS 53 HA LYS 53 -9.339 4.372 18.229 444 1HB LYS 53 HB2 LYS 53 -10.860 2.803 16.380 445 2HB LYS 53 HB3 LYS 53 -9.172 2.304 16.265 446 1HG LYS 53 HG2 LYS 53 -9.960 0.973 18.024 447 2HG LYS 53 HG3 LYS 53 -9.249 2.341 18.881 448 1HD LYS 53 HD2 LYS 53 -11.506 3.414 18.950 449 2HD LYS 53 HD3 LYS 53 -12.183 1.958 18.219 450 1HE LYS 53 HE2 LYS 53 -12.179 0.869 20.193 451 2HE LYS 53 HE3 LYS 53 -10.500 1.309 20.500 452 1HZ LYS 53 HZ1 LYS 53 -12.412 3.470 20.750 453 2HZ LYS 53 HZ2 LYS 53 -12.566 2.237 21.910 454 3HZ LYS 53 HZ3 LYS 53 -11.094 3.067 21.737 455 H TYR 54 H TYR 54 -8.794 3.710 14.760 456 HA TYR 54 HA TYR 54 -6.093 4.957 15.070 457 1HB TYR 54 HB2 TYR 54 -6.786 2.445 13.514 458 2HB TYR 54 HB3 TYR 54 -5.193 3.201 13.587 459 HD1 TYR 54 HD1 TYR 54 -4.036 3.412 15.844 460 HD2 TYR 54 HD2 TYR 54 -7.528 0.986 15.231 461 HE1 TYR 54 HE1 TYR 54 -3.548 2.178 17.939 462 HE2 TYR 54 HE2 TYR 54 -7.040 -0.248 17.326 463 HH TYR 54 HH TYR 54 -5.710 -0.418 19.089 464 H GLY 55 H GLY 55 -7.907 6.635 14.150 465 1HA GLY 55 HA2 GLY 55 -8.644 6.478 11.403 466 2HA GLY 55 HA3 GLY 55 -8.493 7.980 12.317 467 HA PRO 56 HA PRO 56 -4.820 8.873 10.049 468 1HB PRO 56 HB2 PRO 56 -3.700 10.674 11.771 469 2HB PRO 56 HB3 PRO 56 -5.146 11.031 10.810 470 1HG PRO 56 HG2 PRO 56 -4.915 10.463 13.717 471 2HG PRO 56 HG3 PRO 56 -6.135 11.405 12.847 472 1HD PRO 56 HD2 PRO 56 -6.421 8.744 13.797 473 2HD PRO 56 HD3 PRO 56 -7.532 9.604 12.708 474 H GLU 57 H GLU 57 -3.456 7.046 10.030 475 HA GLU 57 HA GLU 57 -1.316 7.021 12.060 476 1HB GLU 57 HB2 GLU 57 -3.495 5.307 12.369 477 2HB GLU 57 HB3 GLU 57 -2.269 4.302 11.595 478 1HG GLU 57 HG2 GLU 57 -1.575 4.036 13.768 479 2HG GLU 57 HG3 GLU 57 -0.715 5.535 13.415 480 H ALA 58 H ALA 58 -2.667 5.148 9.317 481 HA ALA 58 HA ALA 58 -0.095 4.244 8.400 482 1HB ALA 58 HB1 ALA 58 -2.207 3.127 7.763 483 2HB ALA 58 HB2 ALA 58 -2.688 4.561 6.855 484 3HB ALA 58 HB3 ALA 58 -1.292 3.616 6.336 485 H SER 59 H SER 59 -1.775 7.241 8.101 486 HA SER 59 HA SER 59 -0.584 8.160 5.647 487 1HB SER 59 HB2 SER 59 -1.001 10.417 7.266 488 2HB SER 59 HB3 SER 59 -2.106 9.769 6.059 489 HG SER 59 HG SER 59 -3.163 9.848 8.023 490 H ALA 60 H ALA 60 0.249 8.943 9.049 491 HA ALA 60 HA ALA 60 2.695 10.273 8.365 492 1HB ALA 60 HB1 ALA 60 1.314 10.218 10.616 493 2HB ALA 60 HB2 ALA 60 2.370 8.856 10.989 494 3HB ALA 60 HB3 ALA 60 3.062 10.444 10.658 495 H PHE 61 H PHE 61 1.879 6.905 8.930 496 HA PHE 61 HA PHE 61 4.502 5.873 9.324 497 1HB PHE 61 HB2 PHE 61 2.345 4.588 9.593 498 2HB PHE 61 HB3 PHE 61 2.248 4.504 7.834 499 HD1 PHE 61 HD1 PHE 61 4.318 3.560 10.777 500 HD2 PHE 61 HD2 PHE 61 3.578 2.964 6.588 501 HE1 PHE 61 HE1 PHE 61 5.844 1.605 10.786 502 HE2 PHE 61 HE2 PHE 61 5.105 1.010 6.595 503 HZ PHE 61 HZ PHE 61 6.237 0.330 8.694 504 H THR 62 H THR 62 2.619 5.791 6.294 505 HA THR 62 HA THR 62 4.880 5.186 4.646 506 HB THR 62 HB THR 62 2.233 6.490 3.943 507 HG1 THR 62 HG1 THR 62 1.800 4.340 3.226 508 1HG2 THR 62 HG21 THR 62 4.435 5.335 2.215 509 2HG2 THR 62 HG22 THR 62 2.806 5.669 1.628 510 3HG2 THR 62 HG23 THR 62 3.825 6.990 2.200 511 H LYS 63 H LYS 63 3.847 8.108 6.128 512 HA LYS 63 HA LYS 63 4.881 10.000 4.243 513 1HB LYS 63 HB2 LYS 63 3.557 10.145 6.659 514 2HB LYS 63 HB3 LYS 63 5.152 10.782 7.052 515 1HG LYS 63 HG2 LYS 63 3.518 11.709 4.674 516 2HG LYS 63 HG3 LYS 63 3.508 12.523 6.239 517 1HD LYS 63 HD2 LYS 63 6.181 12.327 5.828 518 2HD LYS 63 HD3 LYS 63 5.619 12.455 4.160 519 1HE LYS 63 HE2 LYS 63 4.288 14.472 4.820 520 2HE LYS 63 HE3 LYS 63 5.019 14.380 6.423 521 1HZ LYS 63 HZ1 LYS 63 7.219 14.427 5.212 522 2HZ LYS 63 HZ2 LYS 63 6.349 14.898 3.831 523 3HZ LYS 63 HZ3 LYS 63 6.335 15.875 5.221 524 H LYS 64 H LYS 64 6.345 9.225 7.399 525 HA LYS 64 HA LYS 64 8.947 10.149 6.648 526 1HB LYS 64 HB2 LYS 64 8.206 8.124 8.785 527 2HB LYS 64 HB3 LYS 64 9.722 9.019 8.688 528 1HG LYS 64 HG2 LYS 64 7.004 10.341 8.904 529 2HG LYS 64 HG3 LYS 64 8.045 10.009 10.290 530 1HD LYS 64 HD2 LYS 64 9.852 11.249 8.774 531 2HD LYS 64 HD3 LYS 64 8.407 11.986 8.081 532 1HE LYS 64 HE2 LYS 64 7.750 12.305 10.630 533 2HE LYS 64 HE3 LYS 64 9.495 12.199 10.863 534 1HZ LYS 64 HZ1 LYS 64 8.722 13.894 8.673 535 2HZ LYS 64 HZ2 LYS 64 8.141 14.436 10.171 536 3HZ LYS 64 HZ3 LYS 64 9.807 14.191 9.946 537 H MET 65 H MET 65 7.260 7.223 5.969 538 HA MET 65 HA MET 65 9.526 5.479 5.641 539 1HB MET 65 HB2 MET 65 7.357 4.479 5.836 540 2HB MET 65 HB3 MET 65 6.728 5.436 4.495 541 1HG MET 65 HG2 MET 65 7.523 3.983 2.958 542 2HG MET 65 HG3 MET 65 9.099 3.899 3.746 543 1HE MET 65 HE1 MET 65 9.893 2.114 3.863 544 2HE MET 65 HE2 MET 65 9.508 0.820 5.007 545 3HE MET 65 HE3 MET 65 8.987 0.701 3.328 546 H VAL 66 H VAL 66 7.445 6.529 2.961 547 HA VAL 66 HA VAL 66 9.463 6.225 0.983 548 HB VAL 66 HB VAL 66 7.968 7.517 -0.484 549 1HG1 VAL 66 HG11 VAL 66 7.437 5.113 0.598 550 2HG1 VAL 66 HG12 VAL 66 6.037 5.999 1.203 551 3HG1 VAL 66 HG13 VAL 66 6.334 5.899 -0.532 552 1HG2 VAL 66 HG21 VAL 66 7.374 8.943 1.803 553 2HG2 VAL 66 HG22 VAL 66 6.466 9.035 0.293 554 3HG2 VAL 66 HG23 VAL 66 5.923 7.964 1.586 555 H GLU 67 H GLU 67 8.764 8.876 3.153 556 HA GLU 67 HA GLU 67 10.204 10.898 1.680 557 1HB GLU 67 HB2 GLU 67 9.267 10.626 4.528 558 2HB GLU 67 HB3 GLU 67 10.302 11.972 4.050 559 1HG GLU 67 HG2 GLU 67 8.030 11.464 2.234 560 2HG GLU 67 HG3 GLU 67 7.574 11.994 3.853 561 H ASN 68 H ASN 68 11.116 8.578 4.194 562 HA ASN 68 HA ASN 68 13.918 9.577 4.044 563 1HB ASN 68 HB2 ASN 68 12.364 7.973 6.051 564 2HB ASN 68 HB3 ASN 68 14.120 7.817 5.996 565 1HD2 ASN 68 HD21 ASN 68 11.671 9.607 7.435 566 2HD2 ASN 68 HD22 ASN 68 12.556 11.003 7.823 567 H ALA 69 H ALA 69 12.142 7.502 2.330 568 HA ALA 69 HA ALA 69 13.637 5.047 2.444 569 1HB ALA 69 HB1 ALA 69 11.899 6.296 0.304 570 2HB ALA 69 HB2 ALA 69 12.651 4.713 0.113 571 3HB ALA 69 HB3 ALA 69 11.482 4.982 1.405 572 H LYS 70 H LYS 70 15.481 4.429 1.317 573 HA LYS 70 HA LYS 70 17.175 6.557 0.281 574 1HB LYS 70 HB2 LYS 70 17.451 3.582 0.620 575 2HB LYS 70 HB3 LYS 70 18.622 4.466 -0.360 576 1HG LYS 70 HG2 LYS 70 18.107 5.865 2.128 577 2HG LYS 70 HG3 LYS 70 18.628 4.209 2.439 578 1HD LYS 70 HD2 LYS 70 20.602 4.523 1.039 579 2HD LYS 70 HD3 LYS 70 20.064 6.144 0.597 580 1HE LYS 70 HE2 LYS 70 19.997 6.274 3.335 581 2HE LYS 70 HE3 LYS 70 21.375 5.207 3.065 582 1HZ LYS 70 HZ1 LYS 70 21.913 7.023 1.258 583 2HZ LYS 70 HZ2 LYS 70 21.014 8.007 2.312 584 3HZ LYS 70 HZ3 LYS 70 22.399 7.207 2.875 585 H LYS 71 H LYS 71 15.537 3.739 -1.139 586 HA LYS 71 HA LYS 71 15.582 5.156 -3.759 587 1HB LYS 71 HB2 LYS 71 16.613 2.396 -3.147 588 2HB LYS 71 HB3 LYS 71 15.940 2.750 -4.739 589 1HG LYS 71 HG2 LYS 71 18.139 4.371 -3.424 590 2HG LYS 71 HG3 LYS 71 18.420 3.100 -4.614 591 1HD LYS 71 HD2 LYS 71 16.541 4.579 -5.913 592 2HD LYS 71 HD3 LYS 71 17.362 5.840 -4.993 593 1HE LYS 71 HE2 LYS 71 19.551 4.946 -5.865 594 2HE LYS 71 HE3 LYS 71 18.630 3.867 -6.912 595 1HZ LYS 71 HZ1 LYS 71 18.330 6.820 -6.886 596 2HZ LYS 71 HZ2 LYS 71 19.305 5.971 -7.988 597 3HZ LYS 71 HZ3 LYS 71 17.624 5.732 -7.979 598 H ILE 72 H ILE 72 13.595 5.086 -4.734 599 HA ILE 72 HA ILE 72 11.605 3.158 -3.602 600 HB ILE 72 HB ILE 72 11.260 5.962 -4.690 601 1HG1 ILE 72 HG12 ILE 72 9.989 5.229 -2.166 602 2HG1 ILE 72 HG13 ILE 72 11.733 4.969 -2.124 603 1HG2 ILE 72 HG21 ILE 72 9.173 3.870 -4.008 604 2HG2 ILE 72 HG22 ILE 72 8.819 5.582 -4.247 605 3HG2 ILE 72 HG23 ILE 72 9.444 4.617 -5.583 606 1HD1 ILE 72 HD11 ILE 72 10.672 7.521 -3.289 607 2HD1 ILE 72 HD12 ILE 72 10.738 7.342 -1.535 608 3HD1 ILE 72 HD13 ILE 72 12.215 7.216 -2.490 609 H GLU 73 H GLU 73 10.891 1.649 -5.017 610 HA GLU 73 HA GLU 73 10.959 2.316 -7.930 611 1HB GLU 73 HB2 GLU 73 11.525 -0.121 -8.312 612 2HB GLU 73 HB3 GLU 73 12.812 0.817 -7.551 613 1HG GLU 73 HG2 GLU 73 12.297 -0.066 -5.385 614 2HG GLU 73 HG3 GLU 73 10.790 -0.777 -5.961 615 H VAL 74 H VAL 74 9.057 1.884 -8.973 616 HA VAL 74 HA VAL 74 6.910 0.574 -7.381 617 HB VAL 74 HB VAL 74 5.385 1.585 -9.067 618 1HG1 VAL 74 HG11 VAL 74 7.402 3.450 -7.782 619 2HG1 VAL 74 HG12 VAL 74 5.853 3.970 -8.447 620 3HG1 VAL 74 HG13 VAL 74 5.896 2.871 -7.068 621 1HG2 VAL 74 HG21 VAL 74 7.517 1.575 -10.733 622 2HG2 VAL 74 HG22 VAL 74 6.136 2.647 -10.958 623 3HG2 VAL 74 HG23 VAL 74 7.595 3.243 -10.167 624 H GLU 75 H GLU 75 5.869 -1.284 -8.134 625 HA GLU 75 HA GLU 75 6.933 -2.439 -10.683 626 1HB GLU 75 HB2 GLU 75 7.865 -3.736 -8.888 627 2HB GLU 75 HB3 GLU 75 6.310 -3.814 -8.059 628 1HG GLU 75 HG2 GLU 75 5.371 -5.216 -9.766 629 2HG GLU 75 HG3 GLU 75 6.760 -4.959 -10.823 630 H PHE 76 H PHE 76 5.213 -2.057 -12.051 631 HA PHE 76 HA PHE 76 2.452 -2.193 -11.210 632 1HB PHE 76 HB2 PHE 76 3.710 -2.290 -13.970 633 2HB PHE 76 HB3 PHE 76 1.977 -2.139 -13.670 634 HD1 PHE 76 HD1 PHE 76 5.257 -0.468 -13.377 635 HD2 PHE 76 HD2 PHE 76 1.017 -0.085 -12.802 636 HE1 PHE 76 HE1 PHE 76 5.517 1.982 -13.098 637 HE2 PHE 76 HE2 PHE 76 1.277 2.366 -12.522 638 HZ PHE 76 HZ PHE 76 3.527 3.400 -12.671 639 H ASP 77 H ASP 77 0.973 -3.900 -11.474 640 HA ASP 77 HA ASP 77 2.113 -6.573 -11.488 641 1HB ASP 77 HB2 ASP 77 -0.227 -5.448 -10.524 642 2HB ASP 77 HB3 ASP 77 -0.785 -6.403 -11.897 643 H LYS 78 H LYS 78 0.431 -8.128 -12.969 644 HA LYS 78 HA LYS 78 1.156 -7.323 -15.735 645 1HB LYS 78 HB2 LYS 78 0.692 -9.690 -16.294 646 2HB LYS 78 HB3 LYS 78 1.863 -9.560 -14.981 647 1HG LYS 78 HG2 LYS 78 -0.627 -9.562 -13.702 648 2HG LYS 78 HG3 LYS 78 -0.779 -10.778 -14.971 649 1HD LYS 78 HD2 LYS 78 1.733 -10.762 -13.352 650 2HD LYS 78 HD3 LYS 78 0.267 -11.386 -12.595 651 1HE LYS 78 HE2 LYS 78 0.844 -12.317 -15.362 652 2HE LYS 78 HE3 LYS 78 1.885 -12.939 -14.081 653 1HZ LYS 78 HZ1 LYS 78 -0.947 -12.923 -13.479 654 2HZ LYS 78 HZ2 LYS 78 -0.484 -13.988 -14.720 655 3HZ LYS 78 HZ3 LYS 78 0.222 -14.120 -13.183 656 H GLY 79 H GLY 79 -1.483 -7.136 -13.691 657 1HA GLY 79 HA2 GLY 79 -3.537 -7.733 -15.706 658 2HA GLY 79 HA3 GLY 79 -3.829 -7.120 -14.077 659 H GLN 80 H GLN 80 -4.547 -5.056 -14.014 660 HA GLN 80 HA GLN 80 -4.242 -3.354 -16.408 661 1HB GLN 80 HB2 GLN 80 -5.673 -2.763 -13.800 662 2HB GLN 80 HB3 GLN 80 -5.835 -1.874 -15.314 663 1HG GLN 80 HG2 GLN 80 -6.383 -4.826 -15.274 664 2HG GLN 80 HG3 GLN 80 -7.616 -3.707 -14.690 665 1HE2 GLN 80 HE21 GLN 80 -7.717 -1.636 -16.356 666 2HE2 GLN 80 HE22 GLN 80 -7.878 -2.096 -17.982 667 H ARG 81 H ARG 81 -3.617 -1.009 -16.023 668 HA ARG 81 HA ARG 81 -1.325 -0.917 -14.107 669 1HB ARG 81 HB2 ARG 81 -1.851 0.423 -16.757 670 2HB ARG 81 HB3 ARG 81 -0.667 1.085 -15.630 671 1HG ARG 81 HG2 ARG 81 0.488 -1.111 -15.580 672 2HG ARG 81 HG3 ARG 81 -0.666 -1.727 -16.764 673 1HD ARG 81 HD2 ARG 81 0.234 0.665 -17.881 674 2HD ARG 81 HD3 ARG 81 1.684 -0.053 -17.180 675 HE ARG 81 HE ARG 81 0.275 -2.079 -18.608 676 1HH1 ARG 81 HH11 ARG 81 3.187 -0.822 -18.757 677 2HH1 ARG 81 HH12 ARG 81 3.266 -0.530 -20.462 678 1HH2 ARG 81 HH21 ARG 81 -0.134 -0.989 -20.965 679 2HH2 ARG 81 HH22 ARG 81 1.385 -0.624 -21.712 680 H THR 82 H THR 82 -4.432 0.325 -14.748 681 HA THR 82 HA THR 82 -4.071 2.324 -12.583 682 HB THR 82 HB THR 82 -5.645 3.822 -14.073 683 HG1 THR 82 HG1 THR 82 -5.216 3.515 -16.269 684 1HG2 THR 82 HG21 THR 82 -2.775 3.569 -13.778 685 2HG2 THR 82 HG22 THR 82 -3.177 4.235 -15.361 686 3HG2 THR 82 HG23 THR 82 -3.755 5.031 -13.897 687 H ASP 83 H ASP 83 -6.257 3.052 -11.752 688 HA ASP 83 HA ASP 83 -8.164 0.766 -11.935 689 1HB ASP 83 HB2 ASP 83 -7.209 2.439 -9.762 690 2HB ASP 83 HB3 ASP 83 -8.971 2.458 -9.849 691 H LYS 84 H LYS 84 -10.441 2.095 -10.950 692 HA LYS 84 HA LYS 84 -11.417 3.328 -13.382 693 1HB LYS 84 HB2 LYS 84 -13.503 3.668 -12.074 694 2HB LYS 84 HB3 LYS 84 -12.905 2.013 -11.940 695 1HG LYS 84 HG2 LYS 84 -11.601 3.107 -9.852 696 2HG LYS 84 HG3 LYS 84 -13.017 4.158 -9.881 697 1HD LYS 84 HD2 LYS 84 -13.320 1.164 -10.037 698 2HD LYS 84 HD3 LYS 84 -13.145 1.973 -8.479 699 1HE LYS 84 HE2 LYS 84 -15.098 3.245 -10.284 700 2HE LYS 84 HE3 LYS 84 -15.536 1.613 -9.779 701 1HZ LYS 84 HZ1 LYS 84 -14.499 3.185 -7.627 702 2HZ LYS 84 HZ2 LYS 84 -15.877 3.889 -8.321 703 3HZ LYS 84 HZ3 LYS 84 -15.947 2.300 -7.722 704 H TYR 85 H TYR 85 -9.750 4.537 -10.650 705 HA TYR 85 HA TYR 85 -10.785 7.289 -11.125 706 1HB TYR 85 HB2 TYR 85 -9.034 6.198 -8.900 707 2HB TYR 85 HB3 TYR 85 -9.633 7.854 -9.009 708 HD1 TYR 85 HD1 TYR 85 -12.044 8.346 -8.780 709 HD2 TYR 85 HD2 TYR 85 -10.503 4.367 -8.292 710 HE1 TYR 85 HE1 TYR 85 -14.174 7.652 -7.717 711 HE2 TYR 85 HE2 TYR 85 -12.633 3.672 -7.230 712 HH TYR 85 HH TYR 85 -15.022 5.947 -6.247 713 H GLY 86 H GLY 86 -8.582 5.469 -12.543 714 1HA GLY 86 HA2 GLY 86 -6.748 6.060 -13.899 715 2HA GLY 86 HA3 GLY 86 -6.956 7.729 -13.369 716 H ARG 87 H ARG 87 -6.828 5.789 -10.654 717 HA ARG 87 HA ARG 87 -4.254 6.820 -9.862 718 1HB ARG 87 HB2 ARG 87 -5.768 4.501 -8.630 719 2HB ARG 87 HB3 ARG 87 -4.560 5.519 -7.845 720 1HG ARG 87 HG2 ARG 87 -5.995 7.341 -7.685 721 2HG ARG 87 HG3 ARG 87 -6.980 6.814 -9.051 722 1HD ARG 87 HD2 ARG 87 -6.915 5.585 -6.282 723 2HD ARG 87 HD3 ARG 87 -8.253 6.470 -7.014 724 HE ARG 87 HE ARG 87 -7.878 4.418 -8.789 725 1HH1 ARG 87 HH11 ARG 87 -9.885 4.769 -6.327 726 2HH1 ARG 87 HH12 ARG 87 -9.854 3.143 -5.736 727 1HH2 ARG 87 HH21 ARG 87 -7.082 2.233 -7.609 728 2HH2 ARG 87 HH22 ARG 87 -8.269 1.705 -6.463 729 H GLY 88 H GLY 88 -2.256 5.729 -9.713 730 1HA GLY 88 HA2 GLY 88 -1.886 3.563 -11.649 731 2HA GLY 88 HA3 GLY 88 -0.612 4.340 -10.707 732 H LEU 89 H LEU 89 -1.777 1.408 -11.159 733 HA LEU 89 HA LEU 89 -1.851 0.676 -8.266 734 1HB LEU 89 HB2 LEU 89 -2.759 -0.840 -10.729 735 2HB LEU 89 HB3 LEU 89 -2.784 -1.496 -9.091 736 HG LEU 89 HG LEU 89 -4.149 1.107 -9.795 737 1HD1 LEU 89 HD11 LEU 89 -4.931 -1.639 -10.449 738 2HD1 LEU 89 HD12 LEU 89 -6.135 -0.804 -9.465 739 3HD1 LEU 89 HD13 LEU 89 -5.621 -0.114 -11.004 740 1HD2 LEU 89 HD21 LEU 89 -4.079 -0.792 -7.469 741 2HD2 LEU 89 HD22 LEU 89 -3.983 0.968 -7.472 742 3HD2 LEU 89 HD23 LEU 89 -5.531 0.169 -7.750 743 H ALA 90 H ALA 90 0.025 -0.105 -7.475 744 HA ALA 90 HA ALA 90 1.533 -2.169 -8.813 745 1HB ALA 90 HB1 ALA 90 2.776 0.598 -8.699 746 2HB ALA 90 HB2 ALA 90 3.621 -0.881 -9.159 747 3HB ALA 90 HB3 ALA 90 2.311 -0.262 -10.167 748 H TYR 91 H TYR 91 3.557 -2.687 -7.502 749 HA TYR 91 HA TYR 91 2.944 -2.226 -4.639 750 1HB TYR 91 HB2 TYR 91 5.061 -4.030 -5.842 751 2HB TYR 91 HB3 TYR 91 4.424 -4.080 -4.197 752 HD1 TYR 91 HD1 TYR 91 3.558 -4.608 -7.774 753 HD2 TYR 91 HD2 TYR 91 2.376 -5.198 -3.686 754 HE1 TYR 91 HE1 TYR 91 1.749 -6.132 -8.517 755 HE2 TYR 91 HE2 TYR 91 0.566 -6.723 -4.429 756 HH TYR 91 HH TYR 91 -0.203 -7.937 -6.194 757 H ILE 92 H ILE 92 4.065 -0.721 -3.501 758 HA ILE 92 HA ILE 92 6.410 0.561 -4.754 759 HB ILE 92 HB ILE 92 5.144 1.202 -2.079 760 1HG1 ILE 92 HG12 ILE 92 4.515 2.496 -4.743 761 2HG1 ILE 92 HG13 ILE 92 3.526 1.207 -4.055 762 1HG2 ILE 92 HG21 ILE 92 7.387 2.206 -3.551 763 2HG2 ILE 92 HG22 ILE 92 6.142 3.455 -3.517 764 3HG2 ILE 92 HG23 ILE 92 6.752 2.775 -2.007 765 1HD1 ILE 92 HD11 ILE 92 3.955 3.077 -1.973 766 2HD1 ILE 92 HD12 ILE 92 3.525 4.014 -3.405 767 3HD1 ILE 92 HD13 ILE 92 2.445 2.747 -2.823 768 H TYR 93 H TYR 93 8.503 0.276 -4.054 769 HA TYR 93 HA TYR 93 8.894 -1.384 -1.596 770 1HB TYR 93 HB2 TYR 93 10.468 -1.537 -4.185 771 2HB TYR 93 HB3 TYR 93 10.805 -2.467 -2.724 772 HD1 TYR 93 HD1 TYR 93 9.323 -4.277 -2.004 773 HD2 TYR 93 HD2 TYR 93 8.507 -2.015 -5.564 774 HE1 TYR 93 HE1 TYR 93 7.668 -5.985 -2.711 775 HE2 TYR 93 HE2 TYR 93 6.854 -3.722 -6.269 776 HH TYR 93 HH TYR 93 6.702 -6.740 -5.065 777 H ALA 94 H ALA 94 10.471 -0.639 -0.205 778 HA ALA 94 HA ALA 94 12.196 1.606 -1.158 779 1HB ALA 94 HB1 ALA 94 10.671 1.460 1.462 780 2HB ALA 94 HB2 ALA 94 11.865 2.695 1.063 781 3HB ALA 94 HB3 ALA 94 10.367 2.586 0.139 782 H ASP 95 H ASP 95 14.317 1.330 -0.611 783 HA ASP 95 HA ASP 95 16.233 0.422 0.393 784 1HB ASP 95 HB2 ASP 95 14.301 -0.422 2.575 785 2HB ASP 95 HB3 ASP 95 16.057 -0.362 2.708 786 H GLY 96 H GLY 96 13.938 -1.248 -1.065 787 1HA GLY 96 HA2 GLY 96 14.278 -3.387 -2.107 788 2HA GLY 96 HA3 GLY 96 15.450 -3.785 -0.849 789 H LYS 97 H LYS 97 12.501 -2.388 0.247 790 HA LYS 97 HA LYS 97 11.535 -5.110 1.036 791 1HB LYS 97 HB2 LYS 97 12.346 -2.990 2.707 792 2HB LYS 97 HB3 LYS 97 10.584 -3.005 2.782 793 1HG LYS 97 HG2 LYS 97 10.753 -4.725 4.229 794 2HG LYS 97 HG3 LYS 97 11.317 -5.707 2.876 795 1HD LYS 97 HD2 LYS 97 13.172 -5.962 4.186 796 2HD LYS 97 HD3 LYS 97 13.611 -4.397 3.503 797 1HE LYS 97 HE2 LYS 97 13.403 -3.374 5.502 798 2HE LYS 97 HE3 LYS 97 11.820 -4.100 5.779 799 1HZ LYS 97 HZ1 LYS 97 14.415 -5.489 6.183 800 2HZ LYS 97 HZ2 LYS 97 13.489 -4.788 7.424 801 3HZ LYS 97 HZ3 LYS 97 12.872 -6.101 6.545 802 H MET 98 H MET 98 9.169 -5.262 1.286 803 HA MET 98 HA MET 98 7.797 -3.688 -0.785 804 1HB MET 98 HB2 MET 98 7.452 -6.166 -0.509 805 2HB MET 98 HB3 MET 98 6.664 -5.832 1.033 806 1HG MET 98 HG2 MET 98 5.033 -4.369 -0.158 807 2HG MET 98 HG3 MET 98 5.782 -4.824 -1.687 808 1HE MET 98 HE1 MET 98 5.056 -6.333 -3.051 809 2HE MET 98 HE2 MET 98 6.013 -7.638 -2.355 810 3HE MET 98 HE3 MET 98 4.319 -7.913 -2.751 811 H VAL 99 H VAL 99 7.362 -1.625 -0.033 812 HA VAL 99 HA VAL 99 6.824 -0.775 2.564 813 HB VAL 99 HB VAL 99 5.504 0.211 0.015 814 1HG1 VAL 99 HG11 VAL 99 5.794 1.434 2.774 815 2HG1 VAL 99 HG12 VAL 99 5.326 2.354 1.342 816 3HG1 VAL 99 HG13 VAL 99 4.294 1.050 1.929 817 1HG2 VAL 99 HG21 VAL 99 8.101 0.853 1.424 818 2HG2 VAL 99 HG22 VAL 99 7.858 0.406 -0.264 819 3HG2 VAL 99 HG23 VAL 99 7.348 1.994 0.310 820 H ASN 100 H ASN 100 4.535 -2.185 0.236 821 HA ASN 100 HA ASN 100 2.169 -1.833 1.767 822 1HB ASN 100 HB2 ASN 100 2.875 -4.142 -0.072 823 2HB ASN 100 HB3 ASN 100 1.250 -3.684 0.437 824 1HD2 ASN 100 HD21 ASN 100 0.406 -2.965 -1.578 825 2HD2 ASN 100 HD22 ASN 100 1.065 -1.672 -2.457 826 H GLU 101 H GLU 101 4.495 -4.547 1.731 827 HA GLU 101 HA GLU 101 3.108 -6.038 3.777 828 1HB GLU 101 HB2 GLU 101 5.092 -6.663 2.046 829 2HB GLU 101 HB3 GLU 101 6.050 -6.369 3.499 830 1HG GLU 101 HG2 GLU 101 4.291 -7.873 4.689 831 2HG GLU 101 HG3 GLU 101 3.875 -8.406 3.059 832 H ALA 102 H ALA 102 5.207 -3.300 3.833 833 HA ALA 102 HA ALA 102 6.247 -3.661 6.505 834 1HB ALA 102 HB1 ALA 102 6.936 -1.994 4.541 835 2HB ALA 102 HB2 ALA 102 5.813 -0.924 5.380 836 3HB ALA 102 HB3 ALA 102 7.214 -1.576 6.231 837 H LEU 103 H LEU 103 3.449 -1.949 5.156 838 HA LEU 103 HA LEU 103 2.546 -0.880 7.678 839 1HB LEU 103 HB2 LEU 103 1.102 -1.426 5.069 840 2HB LEU 103 HB3 LEU 103 0.357 -0.609 6.443 841 HG LEU 103 HG LEU 103 2.910 0.596 5.933 842 1HD1 LEU 103 HD11 LEU 103 1.355 -0.182 3.548 843 2HD1 LEU 103 HD12 LEU 103 1.781 1.528 3.615 844 3HD1 LEU 103 HD13 LEU 103 3.046 0.301 3.680 845 1HD2 LEU 103 HD21 LEU 103 0.019 1.357 6.012 846 2HD2 LEU 103 HD22 LEU 103 1.370 1.990 6.953 847 3HD2 LEU 103 HD23 LEU 103 1.146 2.499 5.279 848 H VAL 104 H VAL 104 1.415 -3.662 5.725 849 HA VAL 104 HA VAL 104 -0.515 -4.647 7.519 850 HB VAL 104 HB VAL 104 1.327 -6.061 5.582 851 1HG1 VAL 104 HG11 VAL 104 -0.405 -7.184 7.674 852 2HG1 VAL 104 HG12 VAL 104 -0.777 -7.786 6.059 853 3HG1 VAL 104 HG13 VAL 104 0.850 -7.966 6.713 854 1HG2 VAL 104 HG21 VAL 104 -1.417 -4.904 5.564 855 2HG2 VAL 104 HG22 VAL 104 -0.224 -4.987 4.268 856 3HG2 VAL 104 HG23 VAL 104 -1.188 -6.409 4.673 857 H ARG 105 H ARG 105 3.000 -5.101 7.530 858 HA ARG 105 HA ARG 105 3.097 -7.079 9.588 859 1HB ARG 105 HB2 ARG 105 5.022 -6.451 8.123 860 2HB ARG 105 HB3 ARG 105 5.148 -4.926 8.999 861 1HG ARG 105 HG2 ARG 105 5.054 -6.857 11.011 862 2HG ARG 105 HG3 ARG 105 6.083 -7.576 9.771 863 1HD ARG 105 HD2 ARG 105 6.482 -4.715 10.622 864 2HD ARG 105 HD3 ARG 105 7.194 -6.034 11.550 865 HE ARG 105 HE ARG 105 7.780 -6.270 8.719 866 1HH1 ARG 105 HH11 ARG 105 8.630 -4.801 11.726 867 2HH1 ARG 105 HH12 ARG 105 10.259 -4.464 11.248 868 1HH2 ARG 105 HH21 ARG 105 9.889 -5.794 8.069 869 2HH2 ARG 105 HH22 ARG 105 10.971 -5.023 9.180 870 H GLN 106 H GLN 106 3.312 -3.511 9.774 871 HA GLN 106 HA GLN 106 3.509 -3.495 12.661 872 1HB GLN 106 HB2 GLN 106 3.917 -1.623 10.713 873 2HB GLN 106 HB3 GLN 106 2.354 -1.110 11.349 874 1HG GLN 106 HG2 GLN 106 3.422 -0.164 13.088 875 2HG GLN 106 HG3 GLN 106 3.942 -1.771 13.596 876 1HE2 GLN 106 HE21 GLN 106 5.922 -0.356 14.312 877 2HE2 GLN 106 HE22 GLN 106 7.152 -0.147 13.163 878 H GLY 107 H GLY 107 0.904 -3.960 10.489 879 1HA GLY 107 HA2 GLY 107 -1.304 -4.607 11.130 880 2HA GLY 107 HA3 GLY 107 -0.975 -4.012 12.759 881 H LEU 108 H LEU 108 -0.146 -1.947 10.105 882 HA LEU 108 HA LEU 108 -2.357 -0.128 10.918 883 1HB LEU 108 HB2 LEU 108 0.301 0.286 9.561 884 2HB LEU 108 HB3 LEU 108 -0.961 1.514 9.463 885 HG LEU 108 HG LEU 108 0.177 0.360 12.027 886 1HD1 LEU 108 HD11 LEU 108 1.168 2.374 10.306 887 2HD1 LEU 108 HD12 LEU 108 0.448 3.213 11.680 888 3HD1 LEU 108 HD13 LEU 108 1.708 2.008 11.945 889 1HD2 LEU 108 HD21 LEU 108 -2.024 2.333 11.411 890 2HD2 LEU 108 HD22 LEU 108 -2.063 0.946 12.500 891 3HD2 LEU 108 HD23 LEU 108 -1.157 2.393 12.945 892 H ALA 109 H ALA 109 -2.023 -2.494 8.741 893 HA ALA 109 HA ALA 109 -3.993 -1.290 6.931 894 1HB ALA 109 HB1 ALA 109 -1.610 -0.696 6.087 895 2HB ALA 109 HB2 ALA 109 -1.492 -2.405 5.668 896 3HB ALA 109 HB3 ALA 109 -2.741 -1.401 4.933 897 H LYS 110 H LYS 110 -4.932 -2.948 5.487 898 HA LYS 110 HA LYS 110 -4.287 -5.737 6.346 899 1HB LYS 110 HB2 LYS 110 -6.887 -6.056 6.011 900 2HB LYS 110 HB3 LYS 110 -6.263 -5.437 7.540 901 1HG LYS 110 HG2 LYS 110 -7.156 -3.373 7.209 902 2HG LYS 110 HG3 LYS 110 -6.737 -3.366 5.496 903 1HD LYS 110 HD2 LYS 110 -8.995 -3.580 5.220 904 2HD LYS 110 HD3 LYS 110 -8.653 -5.287 5.507 905 1HE LYS 110 HE2 LYS 110 -8.846 -4.191 8.067 906 2HE LYS 110 HE3 LYS 110 -10.136 -3.402 7.162 907 1HZ LYS 110 HZ1 LYS 110 -10.119 -6.092 6.438 908 2HZ LYS 110 HZ2 LYS 110 -10.040 -6.037 8.131 909 3HZ LYS 110 HZ3 LYS 110 -11.308 -5.254 7.316 910 H VAL 111 H VAL 111 -4.753 -7.354 4.732 911 HA VAL 111 HA VAL 111 -4.351 -6.418 2.018 912 HB VAL 111 HB VAL 111 -4.910 -9.146 3.203 913 1HG1 VAL 111 HG11 VAL 111 -5.236 -8.251 0.475 914 2HG1 VAL 111 HG12 VAL 111 -3.899 -9.397 0.576 915 3HG1 VAL 111 HG13 VAL 111 -5.502 -9.858 1.150 916 1HG2 VAL 111 HG21 VAL 111 -2.665 -7.928 3.496 917 2HG2 VAL 111 HG22 VAL 111 -2.596 -9.546 2.798 918 3HG2 VAL 111 HG23 VAL 111 -2.456 -8.130 1.757 919 H ALA 112 H ALA 112 -5.854 -6.334 0.331 920 HA ALA 112 HA ALA 112 -8.554 -7.381 0.626 921 1HB ALA 112 HB1 ALA 112 -8.091 -4.881 1.787 922 2HB ALA 112 HB2 ALA 112 -8.822 -4.509 0.227 923 3HB ALA 112 HB3 ALA 112 -9.664 -5.561 1.365 924 H TYR 113 H TYR 113 -9.946 -6.164 -1.257 925 HA TYR 113 HA TYR 113 -10.153 -6.178 -3.605 926 1HB TYR 113 HB2 TYR 113 -7.730 -4.409 -3.163 927 2HB TYR 113 HB3 TYR 113 -8.599 -4.529 -4.694 928 HD1 TYR 113 HD1 TYR 113 -11.184 -4.144 -4.597 929 HD2 TYR 113 HD2 TYR 113 -8.443 -2.868 -1.547 930 HE1 TYR 113 HE1 TYR 113 -12.857 -2.508 -3.778 931 HE2 TYR 113 HE2 TYR 113 -10.116 -1.231 -0.727 932 HH TYR 113 HH TYR 113 -12.714 -1.053 -0.826 933 H VAL 114 H VAL 114 -9.536 -8.510 -3.648 934 HA VAL 114 HA VAL 114 -6.791 -8.943 -4.748 935 HB VAL 114 HB VAL 114 -8.750 -10.806 -3.382 936 1HG1 VAL 114 HG11 VAL 114 -6.139 -11.485 -4.772 937 2HG1 VAL 114 HG12 VAL 114 -7.108 -12.600 -3.809 938 3HG1 VAL 114 HG13 VAL 114 -7.748 -11.957 -5.321 939 1HG2 VAL 114 HG21 VAL 114 -6.770 -9.176 -2.371 940 2HG2 VAL 114 HG22 VAL 114 -7.368 -10.637 -1.584 941 3HG2 VAL 114 HG23 VAL 114 -5.916 -10.705 -2.584 942 H TYR 115 H TYR 115 -6.964 -8.743 -6.957 943 HA TYR 115 HA TYR 115 -9.000 -10.461 -8.294 944 1HB TYR 115 HB2 TYR 115 -8.345 -7.596 -9.042 945 2HB TYR 115 HB3 TYR 115 -9.410 -8.668 -9.951 946 HD1 TYR 115 HD1 TYR 115 -11.566 -9.418 -8.992 947 HD2 TYR 115 HD2 TYR 115 -9.046 -6.600 -6.952 948 HE1 TYR 115 HE1 TYR 115 -13.456 -8.801 -7.510 949 HE2 TYR 115 HE2 TYR 115 -10.936 -5.982 -5.470 950 HH TYR 115 HH TYR 115 -13.404 -7.644 -4.851 951 H LYS 116 H LYS 116 -8.295 -11.377 -10.243 952 HA LYS 116 HA LYS 116 -5.372 -11.327 -10.661 953 1HB LYS 116 HB2 LYS 116 -7.362 -12.929 -12.268 954 2HB LYS 116 HB3 LYS 116 -5.680 -13.314 -11.907 955 1HG LYS 116 HG2 LYS 116 -6.530 -13.256 -9.405 956 2HG LYS 116 HG3 LYS 116 -8.098 -13.566 -10.153 957 1HD LYS 116 HD2 LYS 116 -5.592 -15.230 -10.547 958 2HD LYS 116 HD3 LYS 116 -6.985 -15.683 -9.565 959 1HE LYS 116 HE2 LYS 116 -7.763 -14.890 -12.262 960 2HE LYS 116 HE3 LYS 116 -6.638 -16.249 -12.271 961 1HZ LYS 116 HZ1 LYS 116 -8.517 -16.626 -10.218 962 2HZ LYS 116 HZ2 LYS 116 -9.356 -16.280 -11.655 963 3HZ LYS 116 HZ3 LYS 116 -8.260 -17.574 -11.603 964 HA PRO 117 HA PRO 117 -4.273 -12.219 -12.319 965 1HB PRO 117 HB2 PRO 117 -2.281 -11.386 -13.984 966 2HB PRO 117 HB3 PRO 117 -3.626 -12.403 -14.527 967 1HG PRO 117 HG2 PRO 117 -3.099 -9.550 -15.093 968 2HG PRO 117 HG3 PRO 117 -4.098 -10.706 -15.985 969 1HD PRO 117 HD2 PRO 117 -4.987 -8.686 -14.141 970 2HD PRO 117 HD3 PRO 117 -5.980 -9.887 -14.997 971 H ASN 118 H ASN 118 -4.708 -9.416 -11.104 972 HA ASN 118 HA ASN 118 -1.957 -8.517 -10.572 973 1HB ASN 118 HB2 ASN 118 -4.661 -7.594 -9.562 974 2HB ASN 118 HB3 ASN 118 -3.134 -6.875 -9.043 975 1HD2 ASN 118 HD21 ASN 118 -4.661 -5.053 -10.278 976 2HD2 ASN 118 HD22 ASN 118 -4.198 -4.798 -11.891 977 H ASN 119 H ASN 119 -2.356 -11.186 -9.753 978 HA ASN 119 HA ASN 119 -2.389 -10.904 -6.777 979 1HB ASN 119 HB2 ASN 119 -3.535 -12.934 -8.612 980 2HB ASN 119 HB3 ASN 119 -2.756 -13.562 -7.161 981 1HD2 ASN 119 HD21 ASN 119 -5.681 -13.513 -7.750 982 2HD2 ASN 119 HD22 ASN 119 -6.391 -12.606 -6.504 983 H THR 120 H THR 120 -0.165 -10.737 -8.914 984 HA THR 120 HA THR 120 1.532 -12.975 -8.831 985 HB THR 120 HB THR 120 2.266 -10.031 -8.761 986 HG1 THR 120 HG1 THR 120 2.705 -10.683 -11.047 987 1HG2 THR 120 HG21 THR 120 3.904 -12.392 -8.519 988 2HG2 THR 120 HG22 THR 120 4.256 -11.575 -10.041 989 3HG2 THR 120 HG23 THR 120 4.398 -10.700 -8.517 990 H HIS 121 H HIS 121 1.023 -10.461 -6.390 991 HA HIS 121 HA HIS 121 2.767 -12.046 -4.544 992 1HB HIS 121 HB2 HIS 121 2.185 -9.071 -4.602 993 2HB HIS 121 HB3 HIS 121 3.042 -9.881 -3.290 994 HD1 HIS 121 HD1 HIS 121 5.029 -11.631 -4.515 995 HD2 HIS 121 HD2 HIS 121 4.067 -7.986 -6.296 996 HE1 HIS 121 HE1 HIS 121 6.976 -11.032 -6.021 997 H GLU 122 H GLU 122 0.094 -12.783 -4.910 998 HA GLU 122 HA GLU 122 -1.576 -11.518 -2.872 999 1HB GLU 122 HB2 GLU 122 -2.532 -12.579 -4.918 1000 2HB GLU 122 HB3 GLU 122 -1.971 -14.146 -4.336 1001 1HG GLU 122 HG2 GLU 122 -3.296 -13.638 -2.191 1002 2HG GLU 122 HG3 GLU 122 -4.065 -12.346 -3.113 1003 H GLN 123 H GLN 123 0.302 -14.522 -3.165 1004 HA GLN 123 HA GLN 123 -0.491 -15.535 -0.570 1005 1HB GLN 123 HB2 GLN 123 0.741 -16.643 -2.727 1006 2HB GLN 123 HB3 GLN 123 2.129 -16.368 -1.672 1007 1HG GLN 123 HG2 GLN 123 1.301 -17.766 0.007 1008 2HG GLN 123 HG3 GLN 123 -0.365 -17.619 -0.556 1009 1HE2 GLN 123 HE21 GLN 123 2.673 -19.336 -1.044 1010 2HE2 GLN 123 HE22 GLN 123 2.069 -20.466 -2.159 1011 H LEU 124 H LEU 124 2.390 -13.804 -1.778 1012 HA LEU 124 HA LEU 124 3.890 -13.780 0.606 1013 1HB LEU 124 HB2 LEU 124 4.461 -12.822 -1.751 1014 2HB LEU 124 HB3 LEU 124 3.711 -11.340 -1.155 1015 HG LEU 124 HG LEU 124 5.262 -11.249 0.717 1016 1HD1 LEU 124 HD11 LEU 124 5.728 -14.037 -0.098 1017 2HD1 LEU 124 HD12 LEU 124 7.209 -13.146 0.256 1018 3HD1 LEU 124 HD13 LEU 124 5.944 -13.275 1.478 1019 1HD2 LEU 124 HD21 LEU 124 5.927 -10.535 -1.709 1020 2HD2 LEU 124 HD22 LEU 124 7.187 -10.630 -0.479 1021 3HD2 LEU 124 HD23 LEU 124 6.997 -11.936 -1.649 1022 H LEU 125 H LEU 125 1.524 -11.329 -0.499 1023 HA LEU 125 HA LEU 125 1.592 -9.835 1.955 1024 1HB LEU 125 HB2 LEU 125 -0.351 -9.995 -0.347 1025 2HB LEU 125 HB3 LEU 125 -0.694 -8.998 1.068 1026 HG LEU 125 HG LEU 125 1.866 -8.801 -0.540 1027 1HD1 LEU 125 HD11 LEU 125 -0.814 -7.529 -0.876 1028 2HD1 LEU 125 HD12 LEU 125 0.606 -6.512 -1.112 1029 3HD1 LEU 125 HD13 LEU 125 0.385 -7.959 -2.095 1030 1HD2 LEU 125 HD21 LEU 125 1.351 -7.962 2.006 1031 2HD2 LEU 125 HD22 LEU 125 2.480 -7.153 0.919 1032 3HD2 LEU 125 HD23 LEU 125 0.831 -6.551 1.084 1033 H ARG 126 H ARG 126 -0.063 -12.743 0.988 1034 HA ARG 126 HA ARG 126 -2.181 -12.636 2.943 1035 1HB ARG 126 HB2 ARG 126 -1.055 -14.635 1.086 1036 2HB ARG 126 HB3 ARG 126 -1.761 -15.315 2.553 1037 1HG ARG 126 HG2 ARG 126 -3.669 -13.500 1.927 1038 2HG ARG 126 HG3 ARG 126 -3.076 -13.880 0.310 1039 1HD ARG 126 HD2 ARG 126 -4.378 -15.721 0.383 1040 2HD ARG 126 HD3 ARG 126 -3.254 -16.364 1.580 1041 HE ARG 126 HE ARG 126 -4.847 -14.966 3.209 1042 1HH1 ARG 126 HH11 ARG 126 -5.277 -17.750 1.444 1043 2HH1 ARG 126 HH12 ARG 126 -7.006 -17.782 1.555 1044 1HH2 ARG 126 HH21 ARG 126 -7.245 -14.606 2.923 1045 2HH2 ARG 126 HH22 ARG 126 -8.119 -16.003 2.391 1046 H LYS 127 H LYS 127 0.659 -14.820 2.945 1047 HA LYS 127 HA LYS 127 0.544 -15.653 5.586 1048 1HB LYS 127 HB2 LYS 127 3.020 -15.916 5.473 1049 2HB LYS 127 HB3 LYS 127 2.215 -16.522 4.025 1050 1HG LYS 127 HG2 LYS 127 2.620 -14.203 3.013 1051 2HG LYS 127 HG3 LYS 127 3.713 -13.920 4.368 1052 1HD LYS 127 HD2 LYS 127 3.926 -16.184 2.361 1053 2HD LYS 127 HD3 LYS 127 4.965 -14.760 2.427 1054 1HE LYS 127 HE2 LYS 127 5.182 -15.644 4.991 1055 2HE LYS 127 HE3 LYS 127 4.959 -17.174 4.143 1056 1HZ LYS 127 HZ1 LYS 127 6.757 -15.464 2.751 1057 2HZ LYS 127 HZ2 LYS 127 7.285 -15.737 4.343 1058 3HZ LYS 127 HZ3 LYS 127 6.994 -17.050 3.305 1059 H SER 128 H SER 128 2.158 -12.710 4.384 1060 HA SER 128 HA SER 128 3.080 -11.778 6.906 1061 1HB SER 128 HB2 SER 128 2.901 -9.474 5.769 1062 2HB SER 128 HB3 SER 128 3.931 -10.671 4.990 1063 HG SER 128 HG SER 128 2.346 -9.506 3.633 1064 H GLU 129 H GLU 129 -0.049 -11.344 5.277 1065 HA GLU 129 HA GLU 129 -1.158 -9.475 7.123 1066 1HB GLU 129 HB2 GLU 129 -2.078 -10.360 4.834 1067 2HB GLU 129 HB3 GLU 129 -2.836 -11.608 5.824 1068 1HG GLU 129 HG2 GLU 129 -3.133 -8.839 6.832 1069 2HG GLU 129 HG3 GLU 129 -3.981 -9.191 5.326 1070 H ALA 130 H ALA 130 -1.153 -13.038 7.114 1071 HA ALA 130 HA ALA 130 -2.765 -13.329 9.471 1072 1HB ALA 130 HB1 ALA 130 -2.258 -15.161 7.820 1073 2HB ALA 130 HB2 ALA 130 -0.618 -15.221 8.468 1074 3HB ALA 130 HB3 ALA 130 -1.990 -15.626 9.499 1075 H GLN 131 H GLN 131 0.630 -12.645 8.960 1076 HA GLN 131 HA GLN 131 1.540 -13.346 11.602 1077 1HB GLN 131 HB2 GLN 131 2.802 -12.610 9.314 1078 2HB GLN 131 HB3 GLN 131 2.869 -11.089 10.206 1079 1HG GLN 131 HG2 GLN 131 4.681 -11.964 11.243 1080 2HG GLN 131 HG3 GLN 131 3.530 -12.960 12.135 1081 1HE2 GLN 131 HE21 GLN 131 6.331 -13.261 10.436 1082 2HE2 GLN 131 HE22 GLN 131 6.128 -14.821 9.798 1083 H ALA 132 H ALA 132 0.529 -10.256 10.133 1084 HA ALA 132 HA ALA 132 0.823 -8.687 12.507 1085 1HB ALA 132 HB1 ALA 132 0.411 -7.949 10.033 1086 2HB ALA 132 HB2 ALA 132 -1.295 -8.131 10.440 1087 3HB ALA 132 HB3 ALA 132 -0.295 -6.986 11.333 1088 H LYS 133 H LYS 133 -1.743 -10.787 11.334 1089 HA LYS 133 HA LYS 133 -3.795 -9.883 13.131 1090 1HB LYS 133 HB2 LYS 133 -3.374 -12.137 11.298 1091 2HB LYS 133 HB3 LYS 133 -4.316 -12.570 12.725 1092 1HG LYS 133 HG2 LYS 133 -5.586 -10.320 12.204 1093 2HG LYS 133 HG3 LYS 133 -4.943 -10.569 10.580 1094 1HD LYS 133 HD2 LYS 133 -6.475 -12.686 12.113 1095 2HD LYS 133 HD3 LYS 133 -7.226 -11.583 10.960 1096 1HE LYS 133 HE2 LYS 133 -5.350 -12.410 9.334 1097 2HE LYS 133 HE3 LYS 133 -5.227 -13.771 10.450 1098 1HZ LYS 133 HZ1 LYS 133 -7.731 -13.937 10.198 1099 2HZ LYS 133 HZ2 LYS 133 -7.559 -12.917 8.849 1100 3HZ LYS 133 HZ3 LYS 133 -6.791 -14.428 8.869 1101 H LYS 134 H LYS 134 -1.383 -12.502 13.361 1102 HA LYS 134 HA LYS 134 -2.220 -13.297 16.021 1103 1HB LYS 134 HB2 LYS 134 0.026 -13.948 14.171 1104 2HB LYS 134 HB3 LYS 134 0.302 -14.237 15.890 1105 1HG LYS 134 HG2 LYS 134 -2.334 -15.156 15.028 1106 2HG LYS 134 HG3 LYS 134 -1.028 -15.949 14.144 1107 1HD LYS 134 HD2 LYS 134 -0.550 -15.682 17.043 1108 2HD LYS 134 HD3 LYS 134 -1.906 -16.727 16.620 1109 1HE LYS 134 HE2 LYS 134 -0.175 -18.259 16.498 1110 2HE LYS 134 HE3 LYS 134 -0.175 -17.670 14.836 1111 1HZ LYS 134 HZ1 LYS 134 1.467 -16.400 16.943 1112 2HZ LYS 134 HZ2 LYS 134 2.037 -17.724 16.043 1113 3HZ LYS 134 HZ3 LYS 134 1.633 -16.277 15.256 1114 H GLU 135 H GLU 135 -0.377 -10.696 14.776 1115 HA GLU 135 HA GLU 135 1.174 -10.303 17.251 1116 1HB GLU 135 HB2 GLU 135 0.942 -8.737 14.672 1117 2HB GLU 135 HB3 GLU 135 1.902 -8.184 16.046 1118 1HG GLU 135 HG2 GLU 135 3.447 -9.911 15.840 1119 2HG GLU 135 HG3 GLU 135 2.301 -10.976 15.024 1120 H LYS 136 H LYS 136 -1.875 -9.369 15.950 1121 HA LYS 136 HA LYS 136 -3.454 -7.772 16.664 1122 1HB LYS 136 HB2 LYS 136 -2.153 -8.728 19.220 1123 2HB LYS 136 HB3 LYS 136 -3.515 -7.607 19.229 1124 1HG LYS 136 HG2 LYS 136 -4.548 -9.423 17.569 1125 2HG LYS 136 HG3 LYS 136 -3.433 -10.485 18.430 1126 1HD LYS 136 HD2 LYS 136 -4.632 -10.384 20.361 1127 2HD LYS 136 HD3 LYS 136 -4.974 -8.664 20.168 1128 1HE LYS 136 HE2 LYS 136 -7.095 -9.490 19.809 1129 2HE LYS 136 HE3 LYS 136 -6.482 -9.581 18.157 1130 1HZ LYS 136 HZ1 LYS 136 -6.210 -11.820 20.075 1131 2HZ LYS 136 HZ2 LYS 136 -7.565 -11.650 19.069 1132 3HZ LYS 136 HZ3 LYS 136 -6.023 -11.854 18.387 1133 H LEU 137 H LEU 137 -1.820 -6.217 15.518 1134 HA LEU 137 HA LEU 137 -0.723 -4.295 17.528 1135 1HB LEU 137 HB2 LEU 137 0.100 -5.018 14.727 1136 2HB LEU 137 HB3 LEU 137 0.539 -3.450 15.405 1137 HG LEU 137 HG LEU 137 1.072 -6.014 16.900 1138 1HD1 LEU 137 HD11 LEU 137 2.113 -5.792 14.488 1139 2HD1 LEU 137 HD12 LEU 137 3.183 -4.631 15.274 1140 3HD1 LEU 137 HD13 LEU 137 3.128 -6.302 15.836 1141 1HD2 LEU 137 HD21 LEU 137 1.534 -3.164 17.282 1142 2HD2 LEU 137 HD22 LEU 137 1.704 -4.484 18.440 1143 3HD2 LEU 137 HD23 LEU 137 3.041 -4.075 17.365 1144 H ASN 138 H ASN 138 -1.414 -2.191 17.486 1145 HA ASN 138 HA ASN 138 -2.983 -0.484 17.103 1146 1HB ASN 138 HB2 ASN 138 -2.920 -0.283 14.299 1147 2HB ASN 138 HB3 ASN 138 -1.905 0.586 15.445 1148 1HD2 ASN 138 HD21 ASN 138 0.313 0.044 15.516 1149 2HD2 ASN 138 HD22 ASN 138 1.007 -1.217 14.617 1150 H ILE 139 H ILE 139 -3.690 -1.885 13.943 1151 HA ILE 139 HA ILE 139 -6.512 -1.753 14.384 1152 HB ILE 139 HB ILE 139 -4.864 -3.257 12.337 1153 1HG1 ILE 139 HG12 ILE 139 -6.680 -0.996 11.670 1154 2HG1 ILE 139 HG13 ILE 139 -5.225 -0.590 12.582 1155 1HG2 ILE 139 HG21 ILE 139 -7.729 -3.378 12.972 1156 2HG2 ILE 139 HG22 ILE 139 -7.404 -2.945 11.294 1157 3HG2 ILE 139 HG23 ILE 139 -6.757 -4.445 11.959 1158 1HD1 ILE 139 HD11 ILE 139 -4.315 -2.372 10.645 1159 2HD1 ILE 139 HD12 ILE 139 -5.491 -1.379 9.785 1160 3HD1 ILE 139 HD13 ILE 139 -4.129 -0.619 10.608 1161 H TRP 140 H TRP 140 -4.400 -4.629 14.126 1162 HA TRP 140 HA TRP 140 -6.502 -6.376 15.133 1163 1HB TRP 140 HB2 TRP 140 -3.542 -6.967 14.882 1164 2HB TRP 140 HB3 TRP 140 -4.867 -8.133 14.922 1165 HD1 TRP 140 HD1 TRP 140 -2.896 -5.973 12.596 1166 HE1 TRP 140 HE1 TRP 140 -3.822 -6.189 10.200 1167 HE3 TRP 140 HE3 TRP 140 -7.251 -8.460 13.554 1168 HZ2 TRP 140 HZ2 TRP 140 -6.109 -7.270 8.866 1169 HZ3 TRP 140 HZ3 TRP 140 -8.786 -9.069 11.703 1170 HH2 TRP 140 HH2 TRP 140 -8.221 -8.476 9.363 1171 H SER 141 H SER 141 -4.741 -4.099 16.690 1172 HA SER 141 HA SER 141 -3.668 -5.426 18.965 1173 1HB SER 141 HB2 SER 141 -3.951 -2.775 18.120 1174 2HB SER 141 HB3 SER 141 -4.859 -2.857 19.627 1175 HG SER 141 HG SER 141 -2.279 -3.980 19.363 1176 H GLU 142 H GLU 142 -6.940 -4.286 18.256 1177 HA GLU 142 HA GLU 142 -7.839 -5.411 20.867 1178 1HB GLU 142 HB2 GLU 142 -9.287 -3.609 18.902 1179 2HB GLU 142 HB3 GLU 142 -9.933 -4.160 20.447 1180 1HG GLU 142 HG2 GLU 142 -7.294 -3.025 20.811 1181 2HG GLU 142 HG3 GLU 142 -8.349 -1.873 19.990 1182 H ASP 143 H ASP 143 -10.161 -6.420 20.641 1183 HA ASP 143 HA ASP 143 -9.944 -8.504 18.552 1184 1HB ASP 143 HB2 ASP 143 -10.408 -9.121 20.933 1185 2HB ASP 143 HB3 ASP 143 -11.940 -8.254 20.822 1186 H ASN 144 H ASN 144 -11.984 -5.788 19.468 1187 HA ASN 144 HA ASN 144 -13.911 -4.902 18.436 1188 1HB ASN 144 HB2 ASN 144 -12.510 -5.849 15.921 1189 2HB ASN 144 HB3 ASN 144 -13.622 -4.488 16.079 1190 1HD2 ASN 144 HD21 ASN 144 -12.769 -2.939 18.066 1191 2HD2 ASN 144 HD22 ASN 144 -11.131 -2.517 17.927 1192 H ALA 145 H ALA 145 -15.023 -6.927 19.389 1193 HA ALA 145 HA ALA 145 -16.970 -7.923 17.668 1194 1HB ALA 145 HB1 ALA 145 -14.411 -9.454 17.536 1195 2HB ALA 145 HB2 ALA 145 -15.909 -10.382 17.565 1196 3HB ALA 145 HB3 ALA 145 -15.631 -9.197 16.289 1197 H ASP 146 H ASP 146 -17.985 -10.041 18.602 1198 HA ASP 146 HA ASP 146 -17.322 -10.382 21.481 1199 1HB ASP 146 HB2 ASP 146 -19.773 -10.231 22.023 1200 2HB ASP 146 HB3 ASP 146 -19.072 -8.701 21.494 1201 H SER 147 H SER 147 -17.206 -12.536 21.885 1202 HA SER 147 HA SER 147 -18.350 -14.430 19.935 1203 1HB SER 147 HB2 SER 147 -16.366 -14.560 22.151 1204 2HB SER 147 HB3 SER 147 -17.270 -16.032 21.810 1205 HG SER 147 HG SER 147 -15.515 -16.054 20.476 1206 H GLY 148 H GLY 148 -20.566 -13.511 20.746 1207 1HA GLY 148 HA2 GLY 148 -21.434 -14.736 23.298 1208 2HA GLY 148 HA3 GLY 148 -22.388 -13.631 22.307 1209 H GLN 149 H GLN 149 -21.475 -16.966 22.795 1210 HA GLN 149 HA GLN 149 -22.398 -18.949 21.948 1211 1HB GLN 149 HB2 GLN 149 -24.481 -17.555 22.711 1212 2HB GLN 149 HB3 GLN 149 -24.755 -17.350 20.980 1213 1HG GLN 149 HG2 GLN 149 -24.576 -19.867 20.754 1214 2HG GLN 149 HG3 GLN 149 -24.584 -19.953 22.517 1215 1HE2 GLN 149 HE21 GLN 149 -26.630 -20.121 23.445 1216 2HE2 GLN 149 HE22 GLN 149 -28.081 -19.661 22.695 1217 HN3 PTP 150 H3 PTP 150 -10.490 -4.074 -9.635 1218 1H5M PTP 150 H51 PTP 150 -7.966 -2.638 -5.271 1219 2H5M PTP 150 H52 PTP 150 -7.170 -1.573 -6.455 1220 3H5M PTP 150 H53 PTP 150 -7.059 -3.341 -6.633 1221 H6 PTP 150 H6 PTP 150 -9.758 -0.838 -6.158 1222 H1* PTP 150 H1' PTP 150 -12.610 -0.311 -8.368 1223 2H2* PTP 150 H2' PTP 150 -12.724 -1.805 -5.769 1224 H3* PTP 150 H3' PTP 150 -13.327 0.101 -4.494 1225 H4* PTP 150 H4' PTP 150 -12.055 2.154 -5.770 1226 2H5* PTP 150 H5' PTP 150 -10.972 -0.331 -4.336 Start of MODEL 12 1 1H ALA 1 H1 ALA 1 11.544 -19.433 -8.884 2 2H ALA 1 H2 ALA 1 11.629 -18.162 -7.759 3 3H ALA 1 H3 ALA 1 12.110 -17.905 -9.365 4 HA ALA 1 HA ALA 1 13.860 -18.342 -7.471 5 1HB ALA 1 HB1 ALA 1 12.660 -20.984 -8.176 6 2HB ALA 1 HB2 ALA 1 14.408 -20.913 -7.962 7 3HB ALA 1 HB3 ALA 1 13.338 -20.434 -6.644 8 H THR 2 H THR 2 13.272 -20.258 -10.445 9 HA THR 2 HA THR 2 15.778 -19.065 -11.548 10 HB THR 2 HB THR 2 15.743 -21.547 -11.350 11 HG1 THR 2 HG1 THR 2 16.172 -21.899 -13.634 12 1HG2 THR 2 HG21 THR 2 13.171 -21.538 -11.811 13 2HG2 THR 2 HG22 THR 2 13.650 -21.582 -13.508 14 3HG2 THR 2 HG23 THR 2 14.141 -22.879 -12.418 15 H SER 3 H SER 3 13.665 -17.373 -11.714 16 HA SER 3 HA SER 3 12.573 -16.059 -13.335 17 1HB SER 3 HB2 SER 3 14.487 -17.581 -14.817 18 2HB SER 3 HB3 SER 3 12.974 -17.588 -15.720 19 HG SER 3 HG SER 3 12.946 -15.283 -15.420 20 H THR 4 H THR 4 10.888 -17.492 -11.965 21 HA THR 4 HA THR 4 9.316 -19.185 -13.850 22 HB THR 4 HB THR 4 9.064 -18.868 -10.843 23 HG1 THR 4 HG1 THR 4 9.806 -21.213 -11.232 24 1HG2 THR 4 HG21 THR 4 7.316 -19.975 -12.834 25 2HG2 THR 4 HG22 THR 4 7.934 -21.281 -11.824 26 3HG2 THR 4 HG23 THR 4 7.093 -19.918 -11.086 27 H LYS 5 H LYS 5 9.362 -16.111 -12.313 28 HA LYS 5 HA LYS 5 7.135 -15.108 -13.739 29 1HB LYS 5 HB2 LYS 5 6.305 -16.764 -11.639 30 2HB LYS 5 HB3 LYS 5 6.105 -15.124 -11.019 31 1HG LYS 5 HG2 LYS 5 4.601 -14.525 -12.707 32 2HG LYS 5 HG3 LYS 5 5.162 -15.797 -13.792 33 1HD LYS 5 HD2 LYS 5 4.283 -17.359 -11.813 34 2HD LYS 5 HD3 LYS 5 3.248 -15.963 -11.506 35 1HE LYS 5 HE2 LYS 5 1.897 -16.795 -13.117 36 2HE LYS 5 HE3 LYS 5 3.122 -16.248 -14.262 37 1HZ LYS 5 HZ1 LYS 5 3.510 -18.833 -12.942 38 2HZ LYS 5 HZ2 LYS 5 2.355 -18.738 -14.180 39 3HZ LYS 5 HZ3 LYS 5 3.973 -18.330 -14.497 40 H LYS 6 H LYS 6 8.017 -13.095 -13.892 41 HA LYS 6 HA LYS 6 8.342 -11.529 -11.417 42 1HB LYS 6 HB2 LYS 6 10.569 -12.528 -11.698 43 2HB LYS 6 HB3 LYS 6 10.633 -11.947 -13.363 44 1HG LYS 6 HG2 LYS 6 10.047 -9.634 -12.053 45 2HG LYS 6 HG3 LYS 6 11.018 -10.461 -10.834 46 1HD LYS 6 HD2 LYS 6 12.656 -10.942 -12.804 47 2HD LYS 6 HD3 LYS 6 11.801 -9.633 -13.621 48 1HE LYS 6 HE2 LYS 6 12.297 -8.678 -11.024 49 2HE LYS 6 HE3 LYS 6 13.790 -9.478 -11.518 50 1HZ LYS 6 HZ1 LYS 6 13.327 -8.196 -13.727 51 2HZ LYS 6 HZ2 LYS 6 12.433 -7.170 -12.715 52 3HZ LYS 6 HZ3 LYS 6 14.088 -7.419 -12.421 53 H LEU 7 H LEU 7 8.010 -9.326 -11.793 54 HA LEU 7 HA LEU 7 7.126 -8.645 -14.546 55 1HB LEU 7 HB2 LEU 7 6.796 -7.128 -11.938 56 2HB LEU 7 HB3 LEU 7 6.079 -6.680 -13.486 57 HG LEU 7 HG LEU 7 5.580 -9.458 -12.547 58 1HD1 LEU 7 HD11 LEU 7 4.226 -7.034 -11.323 59 2HD1 LEU 7 HD12 LEU 7 3.737 -8.711 -11.081 60 3HD1 LEU 7 HD13 LEU 7 5.295 -8.151 -10.474 61 1HD2 LEU 7 HD21 LEU 7 3.928 -7.269 -13.847 62 2HD2 LEU 7 HD22 LEU 7 4.635 -8.669 -14.651 63 3HD2 LEU 7 HD23 LEU 7 3.325 -8.887 -13.490 64 H HIS 8 H HIS 8 7.508 -5.834 -14.343 65 HA HIS 8 HA HIS 8 10.490 -5.699 -14.438 66 1HB HIS 8 HB2 HIS 8 9.752 -3.580 -15.934 67 2HB HIS 8 HB3 HIS 8 9.997 -5.181 -16.615 68 HD1 HIS 8 HD1 HIS 8 7.017 -3.765 -14.676 69 HD2 HIS 8 HD2 HIS 8 7.909 -5.477 -18.363 70 HE1 HIS 8 HE1 HIS 8 4.813 -4.018 -15.897 71 H LYS 9 H LYS 9 11.152 -4.714 -12.584 72 HA LYS 9 HA LYS 9 9.471 -2.688 -11.282 73 1HB LYS 9 HB2 LYS 9 12.251 -3.701 -10.606 74 2HB LYS 9 HB3 LYS 9 11.279 -2.636 -9.589 75 1HG LYS 9 HG2 LYS 9 9.569 -4.763 -10.214 76 2HG LYS 9 HG3 LYS 9 11.126 -5.523 -9.887 77 1HD LYS 9 HD2 LYS 9 10.518 -3.395 -7.981 78 2HD LYS 9 HD3 LYS 9 9.299 -4.671 -7.970 79 1HE LYS 9 HE2 LYS 9 11.273 -5.044 -6.408 80 2HE LYS 9 HE3 LYS 9 10.942 -6.361 -7.534 81 1HZ LYS 9 HZ1 LYS 9 12.849 -4.206 -8.203 82 2HZ LYS 9 HZ2 LYS 9 13.336 -5.565 -7.313 83 3HZ LYS 9 HZ3 LYS 9 12.718 -5.757 -8.884 84 H GLU 10 H GLU 10 10.055 -0.484 -11.042 85 HA GLU 10 HA GLU 10 12.389 0.482 -12.607 86 1HB GLU 10 HB2 GLU 10 9.537 0.897 -13.261 87 2HB GLU 10 HB3 GLU 10 10.512 2.366 -13.253 88 1HG GLU 10 HG2 GLU 10 11.130 1.770 -15.348 89 2HG GLU 10 HG3 GLU 10 12.145 0.560 -14.565 90 HA PRO 11 HA PRO 11 12.710 3.464 -9.381 91 1HB PRO 11 HB2 PRO 11 13.570 5.677 -10.731 92 2HB PRO 11 HB3 PRO 11 14.584 4.248 -10.471 93 1HG PRO 11 HG2 PRO 11 13.176 5.137 -12.946 94 2HG PRO 11 HG3 PRO 11 14.698 4.249 -12.777 95 1HD PRO 11 HD2 PRO 11 12.226 3.104 -13.439 96 2HD PRO 11 HD3 PRO 11 13.641 2.216 -12.832 97 H ALA 12 H ALA 12 11.914 5.642 -8.618 98 HA ALA 12 HA ALA 12 9.680 6.829 -10.126 99 1HB ALA 12 HB1 ALA 12 9.318 5.076 -7.745 100 2HB ALA 12 HB2 ALA 12 8.358 6.554 -7.794 101 3HB ALA 12 HB3 ALA 12 8.227 5.374 -9.098 102 H THR 13 H THR 13 8.816 8.781 -8.887 103 HA THR 13 HA THR 13 11.022 9.947 -7.232 104 HB THR 13 HB THR 13 9.027 11.549 -8.831 105 HG1 THR 13 HG1 THR 13 10.709 11.626 -10.416 106 1HG2 THR 13 HG21 THR 13 10.577 12.476 -6.954 107 2HG2 THR 13 HG22 THR 13 11.863 12.271 -8.143 108 3HG2 THR 13 HG23 THR 13 10.503 13.338 -8.491 109 H LEU 14 H LEU 14 10.448 10.336 -5.154 110 HA LEU 14 HA LEU 14 7.632 10.161 -4.356 111 1HB LEU 14 HB2 LEU 14 9.720 9.306 -3.050 112 2HB LEU 14 HB3 LEU 14 9.891 10.985 -2.539 113 HG LEU 14 HG LEU 14 8.549 9.608 -0.936 114 1HD1 LEU 14 HD11 LEU 14 8.200 12.158 -1.567 115 2HD1 LEU 14 HD12 LEU 14 6.655 11.569 -2.182 116 3HD1 LEU 14 HD13 LEU 14 7.072 11.343 -0.484 117 1HD2 LEU 14 HD21 LEU 14 7.431 8.557 -3.239 118 2HD2 LEU 14 HD22 LEU 14 6.780 8.354 -1.611 119 3HD2 LEU 14 HD23 LEU 14 6.165 9.636 -2.655 120 H ILE 15 H ILE 15 6.605 12.006 -5.195 121 HA ILE 15 HA ILE 15 7.762 14.664 -4.794 122 HB ILE 15 HB ILE 15 5.039 13.775 -5.788 123 1HG1 ILE 15 HG12 ILE 15 7.236 15.051 -7.406 124 2HG1 ILE 15 HG13 ILE 15 7.260 13.314 -7.098 125 1HG2 ILE 15 HG21 ILE 15 5.680 16.249 -4.752 126 2HG2 ILE 15 HG22 ILE 15 6.015 16.465 -6.470 127 3HG2 ILE 15 HG23 ILE 15 4.413 15.951 -5.941 128 1HD1 ILE 15 HD11 ILE 15 4.624 13.818 -7.846 129 2HD1 ILE 15 HD12 ILE 15 5.571 14.846 -8.922 130 3HD1 ILE 15 HD13 ILE 15 5.873 13.109 -8.870 131 H LYS 16 H LYS 16 4.719 13.122 -3.669 132 HA LYS 16 HA LYS 16 5.113 14.118 -0.970 133 1HB LYS 16 HB2 LYS 16 4.288 16.114 -2.485 134 2HB LYS 16 HB3 LYS 16 2.721 15.323 -2.325 135 1HG LYS 16 HG2 LYS 16 3.941 15.363 0.255 136 2HG LYS 16 HG3 LYS 16 4.058 16.987 -0.423 137 1HD LYS 16 HD2 LYS 16 1.546 16.575 -1.097 138 2HD LYS 16 HD3 LYS 16 1.606 15.365 0.185 139 1HE LYS 16 HE2 LYS 16 2.451 17.108 1.749 140 2HE LYS 16 HE3 LYS 16 2.281 18.307 0.468 141 1HZ LYS 16 HZ1 LYS 16 -0.125 17.013 0.529 142 2HZ LYS 16 HZ2 LYS 16 0.286 17.178 2.166 143 3HZ LYS 16 HZ3 LYS 16 0.204 18.551 1.170 144 H ALA 17 H ALA 17 4.314 12.410 0.142 145 HA ALA 17 HA ALA 17 2.394 10.568 -0.967 146 1HB ALA 17 HB1 ALA 17 3.501 10.980 1.817 147 2HB ALA 17 HB2 ALA 17 2.312 9.729 1.454 148 3HB ALA 17 HB3 ALA 17 3.892 9.697 0.672 149 H ILE 18 H ILE 18 0.221 10.160 -0.029 150 HA ILE 18 HA ILE 18 -1.038 12.715 0.886 151 HB ILE 18 HB ILE 18 -2.410 10.427 -0.550 152 1HG1 ILE 18 HG12 ILE 18 -1.521 13.049 -1.774 153 2HG1 ILE 18 HG13 ILE 18 -0.535 11.589 -1.861 154 1HG2 ILE 18 HG21 ILE 18 -3.170 13.319 -0.035 155 2HG2 ILE 18 HG22 ILE 18 -4.120 12.172 -0.980 156 3HG2 ILE 18 HG23 ILE 18 -3.880 11.906 0.747 157 1HD1 ILE 18 HD11 ILE 18 -2.775 10.490 -2.722 158 2HD1 ILE 18 HD12 ILE 18 -3.197 12.155 -3.126 159 3HD1 ILE 18 HD13 ILE 18 -1.762 11.413 -3.833 160 H ASP 19 H ASP 19 -1.525 9.166 1.065 161 HA ASP 19 HA ASP 19 -2.214 9.531 3.945 162 1HB ASP 19 HB2 ASP 19 -4.100 8.974 1.977 163 2HB ASP 19 HB3 ASP 19 -3.724 7.387 2.650 164 H GLY 20 H GLY 20 -2.812 6.723 4.293 165 1HA GLY 20 HA2 GLY 20 -0.042 5.713 4.320 166 2HA GLY 20 HA3 GLY 20 -1.427 4.960 5.114 167 H ASP 21 H ASP 21 -2.730 5.530 2.260 168 HA ASP 21 HA ASP 21 -1.566 3.103 0.958 169 1HB ASP 21 HB2 ASP 21 -3.712 2.537 2.045 170 2HB ASP 21 HB3 ASP 21 -4.504 3.834 1.150 171 H THR 22 H THR 22 -1.663 6.260 0.625 172 HA THR 22 HA THR 22 -1.870 6.097 -2.333 173 HB THR 22 HB THR 22 -2.999 8.548 -1.083 174 HG1 THR 22 HG1 THR 22 -4.473 7.488 -0.064 175 1HG2 THR 22 HG21 THR 22 -3.420 6.856 -3.530 176 2HG2 THR 22 HG22 THR 22 -4.667 7.998 -3.024 177 3HG2 THR 22 HG23 THR 22 -3.048 8.578 -3.419 178 H VAL 23 H VAL 23 -0.398 7.458 -3.378 179 HA VAL 23 HA VAL 23 0.987 9.572 -1.889 180 HB VAL 23 HB VAL 23 3.251 8.447 -2.528 181 1HG1 VAL 23 HG11 VAL 23 1.747 8.556 -0.206 182 2HG1 VAL 23 HG12 VAL 23 2.125 6.839 -0.347 183 3HG1 VAL 23 HG13 VAL 23 3.427 8.029 -0.308 184 1HG2 VAL 23 HG21 VAL 23 1.420 6.488 -3.432 185 2HG2 VAL 23 HG22 VAL 23 3.176 6.347 -3.349 186 3HG2 VAL 23 HG23 VAL 23 2.182 5.815 -1.992 187 H LYS 24 H LYS 24 1.876 11.085 -3.306 188 HA LYS 24 HA LYS 24 1.346 10.591 -6.187 189 1HB LYS 24 HB2 LYS 24 2.232 13.187 -4.909 190 2HB LYS 24 HB3 LYS 24 1.430 12.964 -6.465 191 1HG LYS 24 HG2 LYS 24 -0.525 11.963 -5.139 192 2HG LYS 24 HG3 LYS 24 0.257 12.619 -3.701 193 1HD LYS 24 HD2 LYS 24 -0.013 14.844 -4.412 194 2HD LYS 24 HD3 LYS 24 -0.252 14.372 -6.096 195 1HE LYS 24 HE2 LYS 24 -2.341 13.081 -5.058 196 2HE LYS 24 HE3 LYS 24 -2.190 14.329 -3.821 197 1HZ LYS 24 HZ1 LYS 24 -2.089 15.117 -6.645 198 2HZ LYS 24 HZ2 LYS 24 -3.598 14.742 -5.960 199 3HZ LYS 24 HZ3 LYS 24 -2.655 15.986 -5.300 200 H LEU 25 H LEU 25 3.040 9.879 -7.390 201 HA LEU 25 HA LEU 25 5.776 10.821 -6.619 202 1HB LEU 25 HB2 LEU 25 5.451 8.211 -8.033 203 2HB LEU 25 HB3 LEU 25 6.656 8.700 -6.842 204 HG LEU 25 HG LEU 25 3.752 8.036 -6.281 205 1HD1 LEU 25 HD11 LEU 25 6.259 6.519 -6.262 206 2HD1 LEU 25 HD12 LEU 25 5.393 6.437 -4.728 207 3HD1 LEU 25 HD13 LEU 25 4.595 5.937 -6.219 208 1HD2 LEU 25 HD21 LEU 25 5.417 9.806 -4.906 209 2HD2 LEU 25 HD22 LEU 25 3.972 9.027 -4.260 210 3HD2 LEU 25 HD23 LEU 25 5.557 8.299 -4.001 211 H MET 26 H MET 26 7.216 9.957 -8.738 212 HA MET 26 HA MET 26 5.817 11.050 -11.140 213 1HB MET 26 HB2 MET 26 7.647 12.523 -9.860 214 2HB MET 26 HB3 MET 26 8.750 11.519 -10.801 215 1HG MET 26 HG2 MET 26 8.376 12.884 -12.553 216 2HG MET 26 HG3 MET 26 6.724 12.271 -12.600 217 1HE MET 26 HE1 MET 26 9.204 14.658 -11.137 218 2HE MET 26 HE2 MET 26 8.664 15.476 -12.601 219 3HE MET 26 HE3 MET 26 8.346 16.201 -11.026 220 H TYR 27 H TYR 27 5.675 9.331 -12.509 221 HA TYR 27 HA TYR 27 7.927 7.376 -12.554 222 1HB TYR 27 HB2 TYR 27 5.664 6.462 -12.106 223 2HB TYR 27 HB3 TYR 27 5.110 7.111 -13.650 224 HD1 TYR 27 HD1 TYR 27 7.909 5.017 -12.279 225 HD2 TYR 27 HD2 TYR 27 5.153 5.699 -15.502 226 HE1 TYR 27 HE1 TYR 27 8.757 2.992 -13.432 227 HE2 TYR 27 HE2 TYR 27 6.000 3.673 -16.655 228 HH TYR 27 HH TYR 27 7.152 1.519 -15.975 229 H LYS 28 H LYS 28 9.203 7.259 -14.345 230 HA LYS 28 HA LYS 28 10.058 7.777 -16.465 231 1HB LYS 28 HB2 LYS 28 7.120 7.412 -16.897 232 2HB LYS 28 HB3 LYS 28 8.087 8.063 -18.220 233 1HG LYS 28 HG2 LYS 28 8.583 5.459 -16.750 234 2HG LYS 28 HG3 LYS 28 8.007 5.632 -18.406 235 1HD LYS 28 HD2 LYS 28 10.189 5.502 -18.995 236 2HD LYS 28 HD3 LYS 28 10.299 7.165 -18.416 237 1HE LYS 28 HE2 LYS 28 11.994 6.126 -17.188 238 2HE LYS 28 HE3 LYS 28 10.633 6.035 -16.070 239 1HZ LYS 28 HZ1 LYS 28 10.263 3.810 -17.467 240 2HZ LYS 28 HZ2 LYS 28 11.956 3.921 -17.558 241 3HZ LYS 28 HZ3 LYS 28 11.185 3.870 -16.044 242 H GLY 29 H GLY 29 9.019 9.974 -14.533 243 1HA GLY 29 HA2 GLY 29 9.437 12.320 -14.667 244 2HA GLY 29 HA3 GLY 29 9.513 12.180 -16.425 245 H GLN 30 H GLN 30 6.890 10.982 -14.360 246 HA GLN 30 HA GLN 30 5.148 13.156 -15.402 247 1HB GLN 30 HB2 GLN 30 5.117 10.655 -16.520 248 2HB GLN 30 HB3 GLN 30 3.856 10.514 -15.296 249 1HG GLN 30 HG2 GLN 30 3.803 13.032 -16.840 250 2HG GLN 30 HG3 GLN 30 3.460 11.581 -17.782 251 1HE2 GLN 30 HE21 GLN 30 1.399 13.479 -17.289 252 2HE2 GLN 30 HE22 GLN 30 0.257 12.788 -16.240 253 HA PRO 31 HA PRO 31 4.016 13.036 -11.078 254 1HB PRO 31 HB2 PRO 31 2.197 15.071 -11.209 255 2HB PRO 31 HB3 PRO 31 3.949 15.340 -11.214 256 1HG PRO 31 HG2 PRO 31 2.018 15.430 -13.497 257 2HG PRO 31 HG3 PRO 31 3.468 16.408 -13.211 258 1HD PRO 31 HD2 PRO 31 3.356 14.247 -14.955 259 2HD PRO 31 HD3 PRO 31 4.850 14.873 -14.225 260 H MET 32 H MET 32 2.774 11.230 -10.601 261 HA MET 32 HA MET 32 -0.118 11.367 -11.286 262 1HB MET 32 HB2 MET 32 1.645 9.656 -12.604 263 2HB MET 32 HB3 MET 32 0.905 8.636 -11.369 264 1HG MET 32 HG2 MET 32 -1.344 9.552 -12.128 265 2HG MET 32 HG3 MET 32 -0.497 10.258 -13.505 266 1HE MET 32 HE1 MET 32 -0.972 7.186 -11.374 267 2HE MET 32 HE2 MET 32 -0.625 5.801 -12.418 268 3HE MET 32 HE3 MET 32 0.685 6.835 -11.857 269 H THR 33 H THR 33 -1.128 9.252 -10.052 270 HA THR 33 HA THR 33 -0.028 9.401 -7.273 271 HB THR 33 HB THR 33 -2.304 9.100 -6.463 272 HG1 THR 33 HG1 THR 33 -2.990 8.982 -9.213 273 1HG2 THR 33 HG21 THR 33 -1.521 11.395 -7.142 274 2HG2 THR 33 HG22 THR 33 -2.339 11.156 -8.687 275 3HG2 THR 33 HG23 THR 33 -3.271 11.192 -7.190 276 H PHE 34 H PHE 34 -0.419 7.398 -5.966 277 HA PHE 34 HA PHE 34 -0.874 4.938 -7.547 278 1HB PHE 34 HB2 PHE 34 1.727 5.650 -6.186 279 2HB PHE 34 HB3 PHE 34 1.265 3.973 -6.482 280 HD1 PHE 34 HD1 PHE 34 1.049 3.102 -8.766 281 HD2 PHE 34 HD2 PHE 34 2.266 7.152 -8.023 282 HE1 PHE 34 HE1 PHE 34 1.813 3.303 -11.117 283 HE2 PHE 34 HE2 PHE 34 3.034 7.353 -10.372 284 HZ PHE 34 HZ PHE 34 2.805 5.428 -11.920 285 H ARG 35 H ARG 35 -1.554 3.193 -6.249 286 HA ARG 35 HA ARG 35 -1.774 3.754 -3.321 287 1HB ARG 35 HB2 ARG 35 -3.900 3.102 -5.302 288 2HB ARG 35 HB3 ARG 35 -4.009 2.305 -3.731 289 1HG ARG 35 HG2 ARG 35 -3.344 5.002 -3.202 290 2HG ARG 35 HG3 ARG 35 -4.628 5.039 -4.412 291 1HD ARG 35 HD2 ARG 35 -5.946 3.457 -2.992 292 2HD ARG 35 HD3 ARG 35 -4.693 3.580 -1.756 293 HE ARG 35 HE ARG 35 -5.471 6.218 -2.346 294 1HH1 ARG 35 HH11 ARG 35 -5.968 3.864 -0.085 295 2HH1 ARG 35 HH12 ARG 35 -7.537 4.396 0.421 296 1HH2 ARG 35 HH21 ARG 35 -7.892 6.675 -2.167 297 2HH2 ARG 35 HH22 ARG 35 -8.624 5.987 -0.756 298 H LEU 36 H LEU 36 -1.355 1.982 -2.013 299 HA LEU 36 HA LEU 36 0.146 -0.192 -3.020 300 1HB LEU 36 HB2 LEU 36 -1.476 0.039 -0.470 301 2HB LEU 36 HB3 LEU 36 -0.331 -1.263 -0.799 302 HG LEU 36 HG LEU 36 0.305 1.698 -0.662 303 1HD1 LEU 36 HD11 LEU 36 -0.052 0.105 1.444 304 2HD1 LEU 36 HD12 LEU 36 1.588 -0.400 1.037 305 3HD1 LEU 36 HD13 LEU 36 1.252 1.291 1.407 306 1HD2 LEU 36 HD21 LEU 36 1.654 -0.523 -1.960 307 2HD2 LEU 36 HD22 LEU 36 2.058 1.193 -1.992 308 3HD2 LEU 36 HD23 LEU 36 2.661 0.169 -0.688 309 H LEU 37 H LEU 37 -0.442 -2.101 -3.958 310 HA LEU 37 HA LEU 37 -3.315 -2.571 -4.442 311 1HB LEU 37 HB2 LEU 37 -0.766 -3.389 -5.687 312 2HB LEU 37 HB3 LEU 37 -2.023 -4.626 -5.687 313 HG LEU 37 HG LEU 37 -2.528 -1.786 -6.597 314 1HD1 LEU 37 HD11 LEU 37 -1.202 -4.039 -7.966 315 2HD1 LEU 37 HD12 LEU 37 -2.539 -3.329 -8.868 316 3HD1 LEU 37 HD13 LEU 37 -1.187 -2.319 -8.357 317 1HD2 LEU 37 HD21 LEU 37 -4.073 -4.291 -6.352 318 2HD2 LEU 37 HD22 LEU 37 -4.640 -2.622 -6.404 319 3HD2 LEU 37 HD23 LEU 37 -4.257 -3.471 -7.902 320 H LEU 38 H LEU 38 -4.407 -4.461 -3.807 321 HA LEU 38 HA LEU 38 -4.861 -6.380 -2.543 322 1HB LEU 38 HB2 LEU 38 -1.863 -6.605 -2.192 323 2HB LEU 38 HB3 LEU 38 -3.059 -7.890 -2.019 324 HG LEU 38 HG LEU 38 -2.575 -6.368 -4.594 325 1HD1 LEU 38 HD11 LEU 38 -0.665 -7.868 -3.711 326 2HD1 LEU 38 HD12 LEU 38 -1.758 -9.217 -4.022 327 3HD1 LEU 38 HD13 LEU 38 -1.245 -8.174 -5.348 328 1HD2 LEU 38 HD21 LEU 38 -4.588 -8.244 -3.655 329 2HD2 LEU 38 HD22 LEU 38 -4.540 -7.328 -5.161 330 3HD2 LEU 38 HD23 LEU 38 -3.727 -8.889 -5.053 331 H VAL 39 H VAL 39 -3.898 -3.561 -1.351 332 HA VAL 39 HA VAL 39 -4.200 -4.531 1.447 333 HB VAL 39 HB VAL 39 -2.393 -3.242 2.277 334 1HG1 VAL 39 HG11 VAL 39 -1.763 -4.694 -0.276 335 2HG1 VAL 39 HG12 VAL 39 -0.477 -3.848 0.584 336 3HG1 VAL 39 HG13 VAL 39 -1.371 -5.140 1.384 337 1HG2 VAL 39 HG21 VAL 39 -2.903 -1.219 0.902 338 2HG2 VAL 39 HG22 VAL 39 -1.180 -1.591 0.948 339 3HG2 VAL 39 HG23 VAL 39 -2.133 -1.999 -0.479 340 H ASP 40 H ASP 40 -5.082 -2.873 2.885 341 HA ASP 40 HA ASP 40 -6.155 -0.461 1.516 342 1HB ASP 40 HB2 ASP 40 -7.971 -2.029 1.309 343 2HB ASP 40 HB3 ASP 40 -7.795 -2.537 2.989 344 H THR 41 H THR 41 -5.323 1.149 2.762 345 HA THR 41 HA THR 41 -5.158 0.734 5.705 346 HB THR 41 HB THR 41 -3.550 2.482 5.749 347 HG1 THR 41 HG1 THR 41 -4.850 3.214 3.407 348 1HG2 THR 41 HG21 THR 41 -3.311 0.778 3.274 349 2HG2 THR 41 HG22 THR 41 -2.044 1.919 3.726 350 3HG2 THR 41 HG23 THR 41 -2.472 0.601 4.816 351 HA PRO 42 HA PRO 42 -8.512 3.483 6.477 352 1HB PRO 42 HB2 PRO 42 -7.701 4.593 8.842 353 2HB PRO 42 HB3 PRO 42 -8.258 2.916 8.704 354 1HG PRO 42 HG2 PRO 42 -5.464 3.965 8.934 355 2HG PRO 42 HG3 PRO 42 -6.167 2.478 9.597 356 1HD PRO 42 HD2 PRO 42 -4.585 2.571 7.317 357 2HD PRO 42 HD3 PRO 42 -5.755 1.280 7.671 358 H GLU 43 H GLU 43 -8.926 5.423 5.497 359 HA GLU 43 HA GLU 43 -6.749 7.313 4.981 360 1HB GLU 43 HB2 GLU 43 -8.683 8.649 3.929 361 2HB GLU 43 HB3 GLU 43 -8.302 7.091 3.196 362 1HG GLU 43 HG2 GLU 43 -10.191 6.801 5.391 363 2HG GLU 43 HG3 GLU 43 -10.802 7.899 4.153 364 H THR 44 H THR 44 -7.846 9.787 5.225 365 HA THR 44 HA THR 44 -9.289 10.344 7.612 366 HB THR 44 HB THR 44 -7.438 9.406 8.847 367 HG1 THR 44 HG1 THR 44 -6.718 11.299 9.922 368 1HG2 THR 44 HG21 THR 44 -5.927 10.312 6.643 369 2HG2 THR 44 HG22 THR 44 -5.316 11.192 8.044 370 3HG2 THR 44 HG23 THR 44 -5.336 9.429 8.050 371 H LYS 45 H LYS 45 -9.874 11.676 5.581 372 HA LYS 45 HA LYS 45 -8.068 13.887 4.935 373 1HB LYS 45 HB2 LYS 45 -10.991 13.785 4.206 374 2HB LYS 45 HB3 LYS 45 -9.653 14.500 3.306 375 1HG LYS 45 HG2 LYS 45 -8.850 11.889 3.463 376 2HG LYS 45 HG3 LYS 45 -10.601 11.705 3.362 377 1HD LYS 45 HD2 LYS 45 -10.585 12.230 1.174 378 2HD LYS 45 HD3 LYS 45 -9.713 13.729 1.501 379 1HE LYS 45 HE2 LYS 45 -8.335 11.039 1.409 380 2HE LYS 45 HE3 LYS 45 -8.518 12.060 -0.017 381 1HZ LYS 45 HZ1 LYS 45 -7.505 13.396 2.344 382 2HZ LYS 45 HZ2 LYS 45 -6.470 12.224 1.686 383 3HZ LYS 45 HZ3 LYS 45 -7.006 13.517 0.724 384 H HIS 46 H HIS 46 -9.799 13.306 7.627 385 HA HIS 46 HA HIS 46 -10.742 16.118 7.922 386 1HB HIS 46 HB2 HIS 46 -11.689 13.533 8.902 387 2HB HIS 46 HB3 HIS 46 -11.534 14.726 10.192 388 HD1 HIS 46 HD1 HIS 46 -13.777 13.688 7.540 389 HD2 HIS 46 HD2 HIS 46 -12.912 17.296 9.443 390 HE1 HIS 46 HE1 HIS 46 -15.704 15.250 7.025 391 HA PRO 47 HA PRO 47 -7.036 16.480 10.457 392 1HB PRO 47 HB2 PRO 47 -7.060 19.209 10.497 393 2HB PRO 47 HB3 PRO 47 -6.470 18.271 9.115 394 1HG PRO 47 HG2 PRO 47 -9.008 19.790 9.408 395 2HG PRO 47 HG3 PRO 47 -8.086 19.409 7.946 396 1HD PRO 47 HD2 PRO 47 -10.424 18.086 8.840 397 2HD PRO 47 HD3 PRO 47 -9.332 17.537 7.551 398 H LYS 48 H LYS 48 -10.090 18.233 11.011 399 HA LYS 48 HA LYS 48 -9.510 18.872 13.771 400 1HB LYS 48 HB2 LYS 48 -11.627 19.358 11.898 401 2HB LYS 48 HB3 LYS 48 -12.326 18.695 13.376 402 1HG LYS 48 HG2 LYS 48 -11.915 20.593 14.525 403 2HG LYS 48 HG3 LYS 48 -10.246 20.652 13.955 404 1HD LYS 48 HD2 LYS 48 -11.230 21.466 11.715 405 2HD LYS 48 HD3 LYS 48 -12.719 21.753 12.618 406 1HE LYS 48 HE2 LYS 48 -11.884 23.688 13.398 407 2HE LYS 48 HE3 LYS 48 -10.538 22.817 14.133 408 1HZ LYS 48 HZ1 LYS 48 -9.487 22.842 11.876 409 2HZ LYS 48 HZ2 LYS 48 -10.699 23.930 11.391 410 3HZ LYS 48 HZ3 LYS 48 -9.613 24.357 12.626 411 H LYS 49 H LYS 49 -12.087 16.690 12.575 412 HA LYS 49 HA LYS 49 -11.434 14.901 14.884 413 1HB LYS 49 HB2 LYS 49 -14.075 15.612 13.597 414 2HB LYS 49 HB3 LYS 49 -13.889 14.181 14.612 415 1HG LYS 49 HG2 LYS 49 -12.851 16.770 15.676 416 2HG LYS 49 HG3 LYS 49 -14.600 16.543 15.643 417 1HD LYS 49 HD2 LYS 49 -14.204 15.553 17.673 418 2HD LYS 49 HD3 LYS 49 -13.867 14.151 16.658 419 1HE LYS 49 HE2 LYS 49 -11.610 14.261 17.022 420 2HE LYS 49 HE3 LYS 49 -11.602 16.023 17.084 421 1HZ LYS 49 HZ1 LYS 49 -13.094 15.021 19.248 422 2HZ LYS 49 HZ2 LYS 49 -11.583 14.244 19.219 423 3HZ LYS 49 HZ3 LYS 49 -11.668 15.940 19.279 424 H GLY 50 H GLY 50 -13.716 14.065 12.365 425 1HA GLY 50 HA2 GLY 50 -13.433 12.629 10.481 426 2HA GLY 50 HA3 GLY 50 -11.731 12.445 10.908 427 H VAL 51 H VAL 51 -11.124 10.743 12.257 428 HA VAL 51 HA VAL 51 -13.327 8.861 12.991 429 HB VAL 51 HB VAL 51 -10.440 8.045 12.804 430 1HG1 VAL 51 HG11 VAL 51 -12.931 6.779 13.294 431 2HG1 VAL 51 HG12 VAL 51 -12.394 6.238 11.704 432 3HG1 VAL 51 HG13 VAL 51 -11.354 6.011 13.110 433 1HG2 VAL 51 HG21 VAL 51 -11.117 9.332 10.716 434 2HG2 VAL 51 HG22 VAL 51 -10.639 7.658 10.438 435 3HG2 VAL 51 HG23 VAL 51 -12.347 8.098 10.449 436 H GLU 52 H GLU 52 -12.893 7.569 14.998 437 HA GLU 52 HA GLU 52 -11.161 9.007 16.954 438 1HB GLU 52 HB2 GLU 52 -14.091 8.317 17.251 439 2HB GLU 52 HB3 GLU 52 -13.052 8.625 18.643 440 1HG GLU 52 HG2 GLU 52 -12.803 10.865 18.141 441 2HG GLU 52 HG3 GLU 52 -13.009 10.607 16.408 442 H LYS 53 H LYS 53 -10.064 6.859 16.029 443 HA LYS 53 HA LYS 53 -10.001 4.982 18.200 444 1HB LYS 53 HB2 LYS 53 -10.888 3.001 16.958 445 2HB LYS 53 HB3 LYS 53 -12.133 4.209 17.285 446 1HG LYS 53 HG2 LYS 53 -11.807 5.136 15.004 447 2HG LYS 53 HG3 LYS 53 -10.617 3.874 14.678 448 1HD LYS 53 HD2 LYS 53 -12.694 3.097 13.766 449 2HD LYS 53 HD3 LYS 53 -12.424 2.181 15.249 450 1HE LYS 53 HE2 LYS 53 -14.776 3.110 14.961 451 2HE LYS 53 HE3 LYS 53 -13.976 3.533 16.475 452 1HZ LYS 53 HZ1 LYS 53 -13.860 5.279 14.088 453 2HZ LYS 53 HZ2 LYS 53 -15.110 5.397 15.234 454 3HZ LYS 53 HZ3 LYS 53 -13.500 5.676 15.699 455 H TYR 54 H TYR 54 -7.865 6.150 17.298 456 HA TYR 54 HA TYR 54 -5.729 5.733 16.429 457 1HB TYR 54 HB2 TYR 54 -5.397 3.578 17.084 458 2HB TYR 54 HB3 TYR 54 -7.021 3.090 16.617 459 HD1 TYR 54 HD1 TYR 54 -7.508 2.581 14.192 460 HD2 TYR 54 HD2 TYR 54 -3.520 3.162 15.678 461 HE1 TYR 54 HE1 TYR 54 -6.596 1.480 12.168 462 HE2 TYR 54 HE2 TYR 54 -2.606 2.060 13.652 463 HH TYR 54 HH TYR 54 -4.734 1.047 10.996 464 H GLY 55 H GLY 55 -8.422 6.195 14.740 465 1HA GLY 55 HA2 GLY 55 -8.218 5.364 12.130 466 2HA GLY 55 HA3 GLY 55 -8.691 7.011 12.543 467 HA PRO 56 HA PRO 56 -4.841 8.636 11.127 468 1HB PRO 56 HB2 PRO 56 -3.816 10.079 13.209 469 2HB PRO 56 HB3 PRO 56 -5.258 10.576 12.305 470 1HG PRO 56 HG2 PRO 56 -5.063 9.341 15.017 471 2HG PRO 56 HG3 PRO 56 -6.241 10.509 14.394 472 1HD PRO 56 HD2 PRO 56 -6.703 7.772 14.685 473 2HD PRO 56 HD3 PRO 56 -7.646 8.857 13.640 474 H GLU 57 H GLU 57 -3.205 7.181 10.698 475 HA GLU 57 HA GLU 57 -1.030 6.817 12.519 476 1HB GLU 57 HB2 GLU 57 -3.106 5.234 13.279 477 2HB GLU 57 HB3 GLU 57 -2.292 4.161 12.139 478 1HG GLU 57 HG2 GLU 57 -1.033 3.641 13.979 479 2HG GLU 57 HG3 GLU 57 -0.145 5.087 13.497 480 H ALA 58 H ALA 58 -2.664 4.651 10.172 481 HA ALA 58 HA ALA 58 -0.414 3.697 8.849 482 1HB ALA 58 HB1 ALA 58 -3.230 3.902 8.272 483 2HB ALA 58 HB2 ALA 58 -2.306 4.246 6.810 484 3HB ALA 58 HB3 ALA 58 -2.065 2.724 7.668 485 H SER 59 H SER 59 -2.235 6.653 7.965 486 HA SER 59 HA SER 59 -0.735 7.563 5.827 487 1HB SER 59 HB2 SER 59 -2.467 9.010 6.352 488 2HB SER 59 HB3 SER 59 -2.124 8.960 8.078 489 HG SER 59 HG SER 59 -1.147 10.783 7.695 490 H ALA 60 H ALA 60 0.096 7.952 9.279 491 HA ALA 60 HA ALA 60 2.529 9.399 8.786 492 1HB ALA 60 HB1 ALA 60 1.737 7.679 11.152 493 2HB ALA 60 HB2 ALA 60 3.095 8.802 11.124 494 3HB ALA 60 HB3 ALA 60 1.447 9.411 10.989 495 H PHE 61 H PHE 61 1.877 5.947 9.351 496 HA PHE 61 HA PHE 61 4.467 4.935 9.408 497 1HB PHE 61 HB2 PHE 61 2.294 3.617 9.540 498 2HB PHE 61 HB3 PHE 61 2.256 3.670 7.777 499 HD1 PHE 61 HD1 PHE 61 4.414 2.674 10.663 500 HD2 PHE 61 HD2 PHE 61 3.503 2.127 6.502 501 HE1 PHE 61 HE1 PHE 61 5.992 0.764 10.569 502 HE2 PHE 61 HE2 PHE 61 5.081 0.216 6.408 503 HZ PHE 61 HZ PHE 61 6.324 -0.465 8.441 504 H THR 62 H THR 62 2.535 5.232 6.422 505 HA THR 62 HA THR 62 4.804 4.828 4.696 506 HB THR 62 HB THR 62 2.089 6.073 4.162 507 HG1 THR 62 HG1 THR 62 2.995 3.577 3.267 508 1HG2 THR 62 HG21 THR 62 4.485 5.940 2.538 509 2HG2 THR 62 HG22 THR 62 3.182 5.007 1.802 510 3HG2 THR 62 HG23 THR 62 2.939 6.712 2.180 511 H LYS 63 H LYS 63 3.611 7.575 6.416 512 HA LYS 63 HA LYS 63 4.596 9.658 4.720 513 1HB LYS 63 HB2 LYS 63 3.082 9.778 6.855 514 2HB LYS 63 HB3 LYS 63 4.619 9.898 7.715 515 1HG LYS 63 HG2 LYS 63 4.564 11.638 5.381 516 2HG LYS 63 HG3 LYS 63 3.243 12.003 6.493 517 1HD LYS 63 HD2 LYS 63 4.852 12.150 8.360 518 2HD LYS 63 HD3 LYS 63 6.173 11.790 7.248 519 1HE LYS 63 HE2 LYS 63 6.288 14.089 7.194 520 2HE LYS 63 HE3 LYS 63 5.096 13.848 5.916 521 1HZ LYS 63 HZ1 LYS 63 3.478 13.897 7.971 522 2HZ LYS 63 HZ2 LYS 63 4.730 14.827 8.646 523 3HZ LYS 63 HZ3 LYS 63 3.981 15.324 7.204 524 H LYS 64 H LYS 64 6.055 8.552 7.782 525 HA LYS 64 HA LYS 64 8.603 9.729 7.260 526 1HB LYS 64 HB2 LYS 64 7.456 7.866 9.231 527 2HB LYS 64 HB3 LYS 64 9.174 7.610 8.922 528 1HG LYS 64 HG2 LYS 64 8.723 9.258 10.761 529 2HG LYS 64 HG3 LYS 64 9.671 9.929 9.433 530 1HD LYS 64 HD2 LYS 64 7.946 11.530 10.021 531 2HD LYS 64 HD3 LYS 64 7.543 10.831 8.453 532 1HE LYS 64 HE2 LYS 64 5.765 9.615 9.295 533 2HE LYS 64 HE3 LYS 64 6.473 9.494 10.906 534 1HZ LYS 64 HZ1 LYS 64 5.974 12.201 10.202 535 2HZ LYS 64 HZ2 LYS 64 4.552 11.278 10.078 536 3HZ LYS 64 HZ3 LYS 64 5.412 11.317 11.541 537 H MET 65 H MET 65 7.280 6.538 6.509 538 HA MET 65 HA MET 65 9.627 5.177 5.786 539 1HB MET 65 HB2 MET 65 6.839 4.796 5.450 540 2HB MET 65 HB3 MET 65 7.574 4.599 3.859 541 1HG MET 65 HG2 MET 65 9.279 3.294 5.716 542 2HG MET 65 HG3 MET 65 7.632 2.789 6.093 543 1HE MET 65 HE1 MET 65 10.474 1.638 4.723 544 2HE MET 65 HE2 MET 65 10.297 1.141 3.034 545 3HE MET 65 HE3 MET 65 10.517 2.842 3.437 546 H VAL 66 H VAL 66 7.473 6.499 3.286 547 HA VAL 66 HA VAL 66 9.466 6.599 1.273 548 HB VAL 66 HB VAL 66 7.897 8.212 0.134 549 1HG1 VAL 66 HG11 VAL 66 7.687 5.584 0.346 550 2HG1 VAL 66 HG12 VAL 66 6.259 5.986 1.301 551 3HG1 VAL 66 HG13 VAL 66 6.379 6.523 -0.375 552 1HG2 VAL 66 HG21 VAL 66 7.049 8.590 2.834 553 2HG2 VAL 66 HG22 VAL 66 6.437 9.388 1.385 554 3HG2 VAL 66 HG23 VAL 66 5.697 7.888 1.943 555 H GLU 67 H GLU 67 8.640 8.933 3.781 556 HA GLU 67 HA GLU 67 9.986 11.194 2.665 557 1HB GLU 67 HB2 GLU 67 8.953 10.404 5.312 558 2HB GLU 67 HB3 GLU 67 10.309 11.529 5.365 559 1HG GLU 67 HG2 GLU 67 8.642 12.468 3.300 560 2HG GLU 67 HG3 GLU 67 7.558 12.039 4.624 561 H ASN 68 H ASN 68 11.167 8.374 4.389 562 HA ASN 68 HA ASN 68 13.910 9.558 4.354 563 1HB ASN 68 HB2 ASN 68 12.729 7.271 5.955 564 2HB ASN 68 HB3 ASN 68 14.447 7.674 5.949 565 1HD2 ASN 68 HD21 ASN 68 12.643 7.864 8.284 566 2HD2 ASN 68 HD22 ASN 68 12.629 9.497 8.749 567 H ALA 69 H ALA 69 11.970 7.588 2.531 568 HA ALA 69 HA ALA 69 13.908 5.492 1.917 569 1HB ALA 69 HB1 ALA 69 11.175 5.825 1.520 570 2HB ALA 69 HB2 ALA 69 11.848 5.969 -0.104 571 3HB ALA 69 HB3 ALA 69 12.161 4.522 0.855 572 H LYS 70 H LYS 70 15.800 6.383 1.090 573 HA LYS 70 HA LYS 70 15.800 8.556 -0.825 574 1HB LYS 70 HB2 LYS 70 17.922 6.579 0.046 575 2HB LYS 70 HB3 LYS 70 18.229 7.861 -1.126 576 1HG LYS 70 HG2 LYS 70 17.232 9.448 0.671 577 2HG LYS 70 HG3 LYS 70 17.514 8.114 1.791 578 1HD LYS 70 HD2 LYS 70 19.914 8.088 0.730 579 2HD LYS 70 HD3 LYS 70 19.513 9.735 0.240 580 1HE LYS 70 HE2 LYS 70 19.741 10.522 2.346 581 2HE LYS 70 HE3 LYS 70 18.791 9.200 3.022 582 1HZ LYS 70 HZ1 LYS 70 21.090 7.990 2.258 583 2HZ LYS 70 HZ2 LYS 70 21.640 9.491 2.825 584 3HZ LYS 70 HZ3 LYS 70 20.719 8.486 3.839 585 H LYS 71 H LYS 71 14.901 5.357 -1.129 586 HA LYS 71 HA LYS 71 15.302 5.491 -4.075 587 1HB LYS 71 HB2 LYS 71 15.820 3.005 -2.418 588 2HB LYS 71 HB3 LYS 71 16.028 3.173 -4.162 589 1HG LYS 71 HG2 LYS 71 18.195 3.609 -3.583 590 2HG LYS 71 HG3 LYS 71 17.568 5.233 -3.302 591 1HD LYS 71 HD2 LYS 71 18.459 4.941 -1.221 592 2HD LYS 71 HD3 LYS 71 16.964 4.051 -0.925 593 1HE LYS 71 HE2 LYS 71 18.986 2.758 -0.252 594 2HE LYS 71 HE3 LYS 71 18.059 1.948 -1.515 595 1HZ LYS 71 HZ1 LYS 71 20.034 3.773 -2.527 596 2HZ LYS 71 HZ2 LYS 71 20.704 2.496 -1.627 597 3HZ LYS 71 HZ3 LYS 71 19.718 2.162 -2.966 598 H ILE 72 H ILE 72 13.343 5.239 -5.010 599 HA ILE 72 HA ILE 72 11.365 3.438 -3.680 600 HB ILE 72 HB ILE 72 10.789 6.122 -4.973 601 1HG1 ILE 72 HG12 ILE 72 9.823 6.214 -2.411 602 2HG1 ILE 72 HG13 ILE 72 11.269 5.227 -2.193 603 1HG2 ILE 72 HG21 ILE 72 9.147 3.911 -4.872 604 2HG2 ILE 72 HG22 ILE 72 8.701 4.773 -3.399 605 3HG2 ILE 72 HG23 ILE 72 8.585 5.581 -4.963 606 1HD1 ILE 72 HD11 ILE 72 11.306 7.834 -3.726 607 2HD1 ILE 72 HD12 ILE 72 11.601 7.753 -1.989 608 3HD1 ILE 72 HD13 ILE 72 12.682 6.921 -3.107 609 H GLU 73 H GLU 73 10.686 1.875 -5.073 610 HA GLU 73 HA GLU 73 10.833 2.466 -8.002 611 1HB GLU 73 HB2 GLU 73 11.540 -0.128 -6.596 612 2HB GLU 73 HB3 GLU 73 11.494 0.097 -8.346 613 1HG GLU 73 HG2 GLU 73 13.660 0.719 -8.189 614 2HG GLU 73 HG3 GLU 73 13.068 2.211 -7.457 615 H VAL 74 H VAL 74 9.056 1.817 -9.189 616 HA VAL 74 HA VAL 74 6.843 0.533 -7.644 617 HB VAL 74 HB VAL 74 5.422 1.533 -9.549 618 1HG1 VAL 74 HG11 VAL 74 6.906 3.206 -7.513 619 2HG1 VAL 74 HG12 VAL 74 5.592 3.857 -8.492 620 3HG1 VAL 74 HG13 VAL 74 5.286 2.522 -7.381 621 1HG2 VAL 74 HG21 VAL 74 7.880 2.057 -10.657 622 2HG2 VAL 74 HG22 VAL 74 6.390 2.892 -11.100 623 3HG2 VAL 74 HG23 VAL 74 7.486 3.611 -9.920 624 H GLU 75 H GLU 75 5.993 -1.384 -8.420 625 HA GLU 75 HA GLU 75 7.080 -2.364 -11.030 626 1HB GLU 75 HB2 GLU 75 8.024 -3.554 -9.043 627 2HB GLU 75 HB3 GLU 75 6.387 -4.040 -8.600 628 1HG GLU 75 HG2 GLU 75 6.186 -5.071 -10.914 629 2HG GLU 75 HG3 GLU 75 7.919 -4.793 -11.099 630 H PHE 76 H PHE 76 5.201 -1.669 -12.176 631 HA PHE 76 HA PHE 76 2.518 -2.084 -11.428 632 1HB PHE 76 HB2 PHE 76 3.772 -2.181 -14.190 633 2HB PHE 76 HB3 PHE 76 2.038 -2.084 -13.887 634 HD1 PHE 76 HD1 PHE 76 1.030 -0.063 -12.921 635 HD2 PHE 76 HD2 PHE 76 5.240 -0.287 -13.749 636 HE1 PHE 76 HE1 PHE 76 1.211 2.398 -12.671 637 HE2 PHE 76 HE2 PHE 76 5.420 2.173 -13.499 638 HZ PHE 76 HZ PHE 76 3.405 3.516 -12.961 639 H ASP 77 H ASP 77 1.187 -3.873 -11.418 640 HA ASP 77 HA ASP 77 2.393 -6.495 -11.526 641 1HB ASP 77 HB2 ASP 77 0.143 -5.498 -10.363 642 2HB ASP 77 HB3 ASP 77 -0.554 -6.298 -11.771 643 H LYS 78 H LYS 78 0.574 -8.079 -12.900 644 HA LYS 78 HA LYS 78 1.306 -7.436 -15.688 645 1HB LYS 78 HB2 LYS 78 0.474 -9.727 -16.167 646 2HB LYS 78 HB3 LYS 78 1.689 -9.724 -14.889 647 1HG LYS 78 HG2 LYS 78 -0.724 -9.332 -13.538 648 2HG LYS 78 HG3 LYS 78 -1.105 -10.537 -14.769 649 1HD LYS 78 HD2 LYS 78 1.471 -10.969 -13.396 650 2HD LYS 78 HD3 LYS 78 0.053 -11.119 -12.356 651 1HE LYS 78 HE2 LYS 78 -0.674 -13.006 -13.406 652 2HE LYS 78 HE3 LYS 78 -0.195 -12.421 -15.000 653 1HZ LYS 78 HZ1 LYS 78 2.055 -12.899 -13.313 654 2HZ LYS 78 HZ2 LYS 78 1.112 -14.296 -13.498 655 3HZ LYS 78 HZ3 LYS 78 1.725 -13.499 -14.868 656 H GLY 79 H GLY 79 -1.475 -7.390 -13.599 657 1HA GLY 79 HA2 GLY 79 -3.478 -7.471 -15.684 658 2HA GLY 79 HA3 GLY 79 -3.732 -6.889 -14.038 659 H GLN 80 H GLN 80 -4.906 -5.035 -14.778 660 HA GLN 80 HA GLN 80 -3.875 -3.198 -16.730 661 1HB GLN 80 HB2 GLN 80 -5.750 -2.573 -14.429 662 2HB GLN 80 HB3 GLN 80 -5.591 -1.678 -15.941 663 1HG GLN 80 HG2 GLN 80 -6.321 -4.605 -15.932 664 2HG GLN 80 HG3 GLN 80 -7.553 -3.355 -15.752 665 1HE2 GLN 80 HE21 GLN 80 -8.542 -3.198 -17.785 666 2HE2 GLN 80 HE22 GLN 80 -7.704 -3.033 -19.253 667 H ARG 81 H ARG 81 -3.063 -0.985 -16.232 668 HA ARG 81 HA ARG 81 -1.250 -1.073 -13.867 669 1HB ARG 81 HB2 ARG 81 -1.159 0.593 -16.399 670 2HB ARG 81 HB3 ARG 81 -0.008 0.738 -15.070 671 1HG ARG 81 HG2 ARG 81 1.109 -1.128 -15.696 672 2HG ARG 81 HG3 ARG 81 -0.384 -2.030 -15.953 673 1HD ARG 81 HD2 ARG 81 -0.572 -0.415 -18.066 674 2HD ARG 81 HD3 ARG 81 1.182 -0.368 -17.881 675 HE ARG 81 HE ARG 81 -0.346 -2.918 -18.230 676 1HH1 ARG 81 HH11 ARG 81 0.888 -1.663 -20.654 677 2HH1 ARG 81 HH12 ARG 81 2.424 -2.460 -20.733 678 1HH2 ARG 81 HH21 ARG 81 2.290 -3.619 -17.469 679 2HH2 ARG 81 HH22 ARG 81 3.218 -3.564 -18.930 680 H THR 82 H THR 82 -4.234 0.003 -14.430 681 HA THR 82 HA THR 82 -3.914 2.240 -12.522 682 HB THR 82 HB THR 82 -5.515 3.606 -14.025 683 HG1 THR 82 HG1 THR 82 -6.059 2.515 -15.728 684 1HG2 THR 82 HG21 THR 82 -2.947 3.871 -13.617 685 2HG2 THR 82 HG22 THR 82 -2.799 3.244 -15.257 686 3HG2 THR 82 HG23 THR 82 -3.692 4.735 -14.961 687 H ASP 83 H ASP 83 -6.145 2.987 -11.768 688 HA ASP 83 HA ASP 83 -7.950 0.609 -11.664 689 1HB ASP 83 HB2 ASP 83 -6.942 2.381 -9.652 690 2HB ASP 83 HB3 ASP 83 -8.692 2.576 -9.736 691 H LYS 84 H LYS 84 -10.253 1.897 -10.762 692 HA LYS 84 HA LYS 84 -11.308 2.936 -13.253 693 1HB LYS 84 HB2 LYS 84 -12.801 3.351 -10.705 694 2HB LYS 84 HB3 LYS 84 -13.376 2.756 -12.258 695 1HG LYS 84 HG2 LYS 84 -11.923 0.668 -11.770 696 2HG LYS 84 HG3 LYS 84 -11.907 1.251 -10.105 697 1HD LYS 84 HD2 LYS 84 -14.376 0.629 -11.755 698 2HD LYS 84 HD3 LYS 84 -13.754 -0.330 -10.411 699 1HE LYS 84 HE2 LYS 84 -13.938 1.964 -9.104 700 2HE LYS 84 HE3 LYS 84 -15.118 2.338 -10.361 701 1HZ LYS 84 HZ1 LYS 84 -15.952 -0.058 -9.745 702 2HZ LYS 84 HZ2 LYS 84 -15.216 0.303 -8.261 703 3HZ LYS 84 HZ3 LYS 84 -16.452 1.304 -8.860 704 H TYR 85 H TYR 85 -10.208 4.342 -10.221 705 HA TYR 85 HA TYR 85 -11.140 7.025 -10.934 706 1HB TYR 85 HB2 TYR 85 -9.408 5.939 -8.705 707 2HB TYR 85 HB3 TYR 85 -9.713 7.665 -8.908 708 HD1 TYR 85 HD1 TYR 85 -12.007 8.574 -8.698 709 HD2 TYR 85 HD2 TYR 85 -11.145 4.432 -7.957 710 HE1 TYR 85 HE1 TYR 85 -14.200 8.320 -7.567 711 HE2 TYR 85 HE2 TYR 85 -13.339 4.178 -6.828 712 HH TYR 85 HH TYR 85 -15.672 5.504 -7.031 713 H GLY 86 H GLY 86 -8.834 5.223 -12.301 714 1HA GLY 86 HA2 GLY 86 -7.058 5.842 -13.721 715 2HA GLY 86 HA3 GLY 86 -7.399 7.527 -13.330 716 H ARG 87 H ARG 87 -6.825 5.177 -10.800 717 HA ARG 87 HA ARG 87 -4.438 6.725 -9.987 718 1HB ARG 87 HB2 ARG 87 -6.282 4.776 -8.665 719 2HB ARG 87 HB3 ARG 87 -4.638 4.914 -8.040 720 1HG ARG 87 HG2 ARG 87 -5.062 7.473 -8.075 721 2HG ARG 87 HG3 ARG 87 -6.768 7.043 -8.205 722 1HD ARG 87 HD2 ARG 87 -5.246 5.593 -6.117 723 2HD ARG 87 HD3 ARG 87 -5.473 7.318 -5.832 724 HE ARG 87 HE ARG 87 -7.751 6.875 -5.431 725 1HH1 ARG 87 HH11 ARG 87 -6.188 3.977 -6.041 726 2HH1 ARG 87 HH12 ARG 87 -7.604 3.107 -6.531 727 1HH2 ARG 87 HH21 ARG 87 -9.635 5.918 -6.576 728 2HH2 ARG 87 HH22 ARG 87 -9.557 4.207 -6.834 729 H GLY 88 H GLY 88 -2.359 5.831 -9.901 730 1HA GLY 88 HA2 GLY 88 -1.852 3.588 -11.679 731 2HA GLY 88 HA3 GLY 88 -0.634 4.464 -10.751 732 H LEU 89 H LEU 89 -1.670 1.461 -11.108 733 HA LEU 89 HA LEU 89 -1.562 0.843 -8.182 734 1HB LEU 89 HB2 LEU 89 -2.668 -0.961 -10.345 735 2HB LEU 89 HB3 LEU 89 -2.873 -1.114 -8.599 736 HG LEU 89 HG LEU 89 -3.779 1.426 -9.882 737 1HD1 LEU 89 HD11 LEU 89 -5.225 -1.232 -10.081 738 2HD1 LEU 89 HD12 LEU 89 -6.006 0.329 -10.331 739 3HD1 LEU 89 HD13 LEU 89 -4.717 -0.196 -11.415 740 1HD2 LEU 89 HD21 LEU 89 -3.836 0.876 -7.390 741 2HD2 LEU 89 HD22 LEU 89 -5.370 1.390 -8.088 742 3HD2 LEU 89 HD23 LEU 89 -5.075 -0.319 -7.772 743 H ALA 90 H ALA 90 0.301 -0.105 -7.552 744 HA ALA 90 HA ALA 90 1.552 -2.237 -9.042 745 1HB ALA 90 HB1 ALA 90 2.963 0.451 -9.022 746 2HB ALA 90 HB2 ALA 90 3.675 -1.068 -9.565 747 3HB ALA 90 HB3 ALA 90 2.318 -0.367 -10.446 748 H TYR 91 H TYR 91 3.476 -3.056 -7.876 749 HA TYR 91 HA TYR 91 3.171 -2.716 -4.999 750 1HB TYR 91 HB2 TYR 91 5.275 -4.240 -6.564 751 2HB TYR 91 HB3 TYR 91 4.946 -4.404 -4.839 752 HD1 TYR 91 HD1 TYR 91 2.440 -4.940 -4.206 753 HD2 TYR 91 HD2 TYR 91 4.182 -5.662 -8.066 754 HE1 TYR 91 HE1 TYR 91 0.662 -6.595 -4.699 755 HE2 TYR 91 HE2 TYR 91 2.403 -7.318 -8.558 756 HH TYR 91 HH TYR 91 0.388 -8.604 -6.201 757 H ILE 92 H ILE 92 3.982 -0.890 -4.072 758 HA ILE 92 HA ILE 92 6.282 0.511 -5.213 759 HB ILE 92 HB ILE 92 4.911 0.975 -2.549 760 1HG1 ILE 92 HG12 ILE 92 4.322 2.158 -5.284 761 2HG1 ILE 92 HG13 ILE 92 3.285 1.031 -4.408 762 1HG2 ILE 92 HG21 ILE 92 7.191 2.026 -3.059 763 2HG2 ILE 92 HG22 ILE 92 6.369 2.943 -4.321 764 3HG2 ILE 92 HG23 ILE 92 5.895 3.145 -2.635 765 1HD1 ILE 92 HD11 ILE 92 4.039 3.319 -2.765 766 2HD1 ILE 92 HD12 ILE 92 3.195 3.810 -4.232 767 3HD1 ILE 92 HD13 ILE 92 2.437 2.674 -3.116 768 H TYR 93 H TYR 93 8.356 0.683 -4.236 769 HA TYR 93 HA TYR 93 8.878 -1.177 -1.961 770 1HB TYR 93 HB2 TYR 93 10.461 -0.981 -4.539 771 2HB TYR 93 HB3 TYR 93 11.001 -1.859 -3.108 772 HD1 TYR 93 HD1 TYR 93 8.410 -1.709 -5.757 773 HD2 TYR 93 HD2 TYR 93 10.049 -3.982 -2.502 774 HE1 TYR 93 HE1 TYR 93 7.062 -3.672 -6.450 775 HE2 TYR 93 HE2 TYR 93 8.702 -5.946 -3.195 776 HH TYR 93 HH TYR 93 7.497 -6.452 -5.986 777 H ALA 94 H ALA 94 10.313 -0.368 -0.461 778 HA ALA 94 HA ALA 94 11.808 2.116 -1.175 779 1HB ALA 94 HB1 ALA 94 9.603 1.899 0.650 780 2HB ALA 94 HB2 ALA 94 11.065 2.256 1.571 781 3HB ALA 94 HB3 ALA 94 10.564 3.325 0.260 782 H ASP 95 H ASP 95 13.901 2.117 -0.407 783 HA ASP 95 HA ASP 95 15.843 1.323 0.641 784 1HB ASP 95 HB2 ASP 95 13.668 0.602 2.569 785 2HB ASP 95 HB3 ASP 95 15.271 -0.090 2.819 786 H GLY 96 H GLY 96 14.344 -0.287 -1.393 787 1HA GLY 96 HA2 GLY 96 14.750 -2.352 -2.448 788 2HA GLY 96 HA3 GLY 96 15.949 -2.691 -1.201 789 H LYS 97 H LYS 97 12.739 -1.827 -0.203 790 HA LYS 97 HA LYS 97 12.166 -4.707 0.368 791 1HB LYS 97 HB2 LYS 97 12.845 -2.943 2.308 792 2HB LYS 97 HB3 LYS 97 11.105 -2.663 2.244 793 1HG LYS 97 HG2 LYS 97 10.743 -4.564 3.384 794 2HG LYS 97 HG3 LYS 97 11.560 -5.485 2.120 795 1HD LYS 97 HD2 LYS 97 12.702 -5.866 4.239 796 2HD LYS 97 HD3 LYS 97 13.750 -4.917 3.184 797 1HE LYS 97 HE2 LYS 97 13.838 -3.849 5.321 798 2HE LYS 97 HE3 LYS 97 12.790 -2.842 4.321 799 1HZ LYS 97 HZ1 LYS 97 11.234 -4.834 5.530 800 2HZ LYS 97 HZ2 LYS 97 12.176 -4.103 6.736 801 3HZ LYS 97 HZ3 LYS 97 11.160 -3.152 5.761 802 H MET 98 H MET 98 9.753 -5.026 0.823 803 HA MET 98 HA MET 98 8.238 -3.573 -1.251 804 1HB MET 98 HB2 MET 98 8.133 -6.100 -0.915 805 2HB MET 98 HB3 MET 98 7.224 -5.775 0.561 806 1HG MET 98 HG2 MET 98 5.338 -5.347 -0.598 807 2HG MET 98 HG3 MET 98 6.183 -4.242 -1.681 808 1HE MET 98 HE1 MET 98 6.922 -7.860 -0.756 809 2HE MET 98 HE2 MET 98 5.176 -7.982 -0.962 810 3HE MET 98 HE3 MET 98 6.249 -8.822 -2.079 811 H VAL 99 H VAL 99 7.450 -1.622 -0.578 812 HA VAL 99 HA VAL 99 6.995 -0.771 2.053 813 HB VAL 99 HB VAL 99 5.472 0.011 -0.451 814 1HG1 VAL 99 HG11 VAL 99 4.658 0.566 2.058 815 2HG1 VAL 99 HG12 VAL 99 5.828 1.868 1.848 816 3HG1 VAL 99 HG13 VAL 99 4.474 1.710 0.729 817 1HG2 VAL 99 HG21 VAL 99 8.119 0.697 0.705 818 2HG2 VAL 99 HG22 VAL 99 7.579 0.739 -0.973 819 3HG2 VAL 99 HG23 VAL 99 7.164 2.059 0.120 820 H ASN 100 H ASN 100 4.708 -2.385 -0.159 821 HA ASN 100 HA ASN 100 2.426 -2.298 1.515 822 1HB ASN 100 HB2 ASN 100 3.261 -4.511 -0.386 823 2HB ASN 100 HB3 ASN 100 1.632 -4.249 0.236 824 1HD2 ASN 100 HD21 ASN 100 0.468 -3.474 -1.552 825 2HD2 ASN 100 HD22 ASN 100 0.957 -2.168 -2.519 826 H GLU 101 H GLU 101 5.073 -4.685 1.391 827 HA GLU 101 HA GLU 101 3.960 -6.425 3.383 828 1HB GLU 101 HB2 GLU 101 5.775 -7.130 1.863 829 2HB GLU 101 HB3 GLU 101 6.866 -5.978 2.634 830 1HG GLU 101 HG2 GLU 101 6.545 -7.144 4.799 831 2HG GLU 101 HG3 GLU 101 5.499 -8.316 3.998 832 H ALA 102 H ALA 102 5.969 -3.532 3.577 833 HA ALA 102 HA ALA 102 6.769 -3.753 6.292 834 1HB ALA 102 HB1 ALA 102 7.273 -1.941 4.381 835 2HB ALA 102 HB2 ALA 102 6.013 -1.064 5.250 836 3HB ALA 102 HB3 ALA 102 7.477 -1.570 6.093 837 H LEU 103 H LEU 103 3.925 -2.099 4.915 838 HA LEU 103 HA LEU 103 2.759 -1.354 7.401 839 1HB LEU 103 HB2 LEU 103 1.502 -1.967 4.713 840 2HB LEU 103 HB3 LEU 103 0.596 -1.320 6.081 841 HG LEU 103 HG LEU 103 3.089 0.136 5.543 842 1HD1 LEU 103 HD11 LEU 103 2.105 -0.642 3.233 843 2HD1 LEU 103 HD12 LEU 103 0.881 0.585 3.554 844 3HD1 LEU 103 HD13 LEU 103 2.581 1.042 3.451 845 1HD2 LEU 103 HD21 LEU 103 0.264 0.619 6.312 846 2HD2 LEU 103 HD22 LEU 103 1.742 1.359 6.931 847 3HD2 LEU 103 HD23 LEU 103 1.041 1.925 5.415 848 H VAL 104 H VAL 104 2.058 -4.209 5.343 849 HA VAL 104 HA VAL 104 0.234 -5.450 7.122 850 HB VAL 104 HB VAL 104 2.235 -6.778 5.265 851 1HG1 VAL 104 HG11 VAL 104 0.266 -7.817 7.119 852 2HG1 VAL 104 HG12 VAL 104 -0.154 -8.257 5.463 853 3HG1 VAL 104 HG13 VAL 104 1.422 -8.698 6.120 854 1HG2 VAL 104 HG21 VAL 104 -0.415 -5.449 4.878 855 2HG2 VAL 104 HG22 VAL 104 0.975 -5.513 3.795 856 3HG2 VAL 104 HG23 VAL 104 -0.091 -6.911 3.946 857 H ARG 105 H ARG 105 3.674 -5.074 7.292 858 HA ARG 105 HA ARG 105 4.206 -7.253 9.114 859 1HB ARG 105 HB2 ARG 105 5.762 -5.461 7.711 860 2HB ARG 105 HB3 ARG 105 5.923 -4.875 9.366 861 1HG ARG 105 HG2 ARG 105 6.187 -7.814 8.800 862 2HG ARG 105 HG3 ARG 105 7.555 -6.740 8.504 863 1HD ARG 105 HD2 ARG 105 7.938 -6.420 10.721 864 2HD ARG 105 HD3 ARG 105 6.218 -6.302 11.093 865 HE ARG 105 HE ARG 105 7.262 -9.001 10.483 866 1HH1 ARG 105 HH11 ARG 105 7.348 -6.806 13.031 867 2HH1 ARG 105 HH12 ARG 105 6.598 -7.856 14.186 868 1HH2 ARG 105 HH21 ARG 105 5.809 -10.297 11.854 869 2HH2 ARG 105 HH22 ARG 105 5.727 -9.832 13.521 870 H GLN 106 H GLN 106 3.498 -3.790 9.542 871 HA GLN 106 HA GLN 106 3.431 -4.163 12.479 872 1HB GLN 106 HB2 GLN 106 3.910 -1.954 10.700 873 2HB GLN 106 HB3 GLN 106 2.559 -1.558 11.763 874 1HG GLN 106 HG2 GLN 106 4.089 -2.529 13.650 875 2HG GLN 106 HG3 GLN 106 5.392 -2.251 12.494 876 1HE2 GLN 106 HE21 GLN 106 6.345 -0.240 12.782 877 2HE2 GLN 106 HE22 GLN 106 5.539 1.160 13.302 878 H GLY 107 H GLY 107 1.390 -5.155 10.333 879 1HA GLY 107 HA2 GLY 107 -0.944 -5.372 10.178 880 2HA GLY 107 HA3 GLY 107 -0.916 -5.163 11.929 881 H LEU 108 H LEU 108 -0.362 -3.034 9.096 882 HA LEU 108 HA LEU 108 -2.136 -1.032 10.438 883 1HB LEU 108 HB2 LEU 108 0.385 -0.789 8.859 884 2HB LEU 108 HB3 LEU 108 -0.827 0.475 8.643 885 HG LEU 108 HG LEU 108 0.110 -0.436 11.372 886 1HD1 LEU 108 HD11 LEU 108 2.022 0.455 10.061 887 2HD1 LEU 108 HD12 LEU 108 1.095 1.919 9.731 888 3HD1 LEU 108 HD13 LEU 108 1.576 1.533 11.383 889 1HD2 LEU 108 HD21 LEU 108 -1.470 1.905 10.286 890 2HD2 LEU 108 HD22 LEU 108 -1.974 0.720 11.491 891 3HD2 LEU 108 HD23 LEU 108 -0.751 1.925 11.896 892 H ALA 109 H ALA 109 -1.597 -2.958 7.612 893 HA ALA 109 HA ALA 109 -3.974 -1.661 6.337 894 1HB ALA 109 HB1 ALA 109 -1.623 -1.395 5.216 895 2HB ALA 109 HB2 ALA 109 -1.855 -3.077 4.738 896 3HB ALA 109 HB3 ALA 109 -3.002 -1.844 4.211 897 H LYS 110 H LYS 110 -5.451 -3.112 5.319 898 HA LYS 110 HA LYS 110 -5.114 -5.951 6.183 899 1HB LYS 110 HB2 LYS 110 -7.532 -4.209 5.733 900 2HB LYS 110 HB3 LYS 110 -7.673 -5.967 5.705 901 1HG LYS 110 HG2 LYS 110 -7.240 -6.179 7.951 902 2HG LYS 110 HG3 LYS 110 -6.163 -4.782 7.980 903 1HD LYS 110 HD2 LYS 110 -8.072 -4.056 9.172 904 2HD LYS 110 HD3 LYS 110 -8.288 -3.375 7.560 905 1HE LYS 110 HE2 LYS 110 -9.627 -5.483 7.005 906 2HE LYS 110 HE3 LYS 110 -9.625 -5.816 8.736 907 1HZ LYS 110 HZ1 LYS 110 -10.362 -3.234 8.657 908 2HZ LYS 110 HZ2 LYS 110 -11.088 -3.826 7.244 909 3HZ LYS 110 HZ3 LYS 110 -11.443 -4.541 8.743 910 H VAL 111 H VAL 111 -5.168 -7.563 4.636 911 HA VAL 111 HA VAL 111 -4.671 -6.879 1.900 912 HB VAL 111 HB VAL 111 -5.619 -9.544 2.992 913 1HG1 VAL 111 HG11 VAL 111 -5.467 -8.945 0.424 914 2HG1 VAL 111 HG12 VAL 111 -3.735 -9.148 0.690 915 3HG1 VAL 111 HG13 VAL 111 -4.840 -10.486 1.010 916 1HG2 VAL 111 HG21 VAL 111 -2.814 -8.408 2.727 917 2HG2 VAL 111 HG22 VAL 111 -3.664 -8.712 4.243 918 3HG2 VAL 111 HG23 VAL 111 -3.203 -10.061 3.204 919 H ALA 112 H ALA 112 -6.134 -6.224 0.411 920 HA ALA 112 HA ALA 112 -8.743 -7.518 0.194 921 1HB ALA 112 HB1 ALA 112 -8.573 -5.260 1.855 922 2HB ALA 112 HB2 ALA 112 -9.242 -4.661 0.338 923 3HB ALA 112 HB3 ALA 112 -10.045 -5.976 1.198 924 H TYR 113 H TYR 113 -10.055 -6.020 -1.547 925 HA TYR 113 HA TYR 113 -10.078 -5.308 -3.785 926 1HB TYR 113 HB2 TYR 113 -7.435 -4.160 -2.854 927 2HB TYR 113 HB3 TYR 113 -8.087 -3.871 -4.467 928 HD1 TYR 113 HD1 TYR 113 -10.851 -3.409 -4.235 929 HD2 TYR 113 HD2 TYR 113 -7.773 -2.353 -1.431 930 HE1 TYR 113 HE1 TYR 113 -12.293 -1.604 -3.333 931 HE2 TYR 113 HE2 TYR 113 -9.214 -0.547 -0.528 932 HH TYR 113 HH TYR 113 -11.171 0.874 -1.448 933 H VAL 114 H VAL 114 -9.688 -7.872 -3.828 934 HA VAL 114 HA VAL 114 -7.116 -8.442 -5.223 935 HB VAL 114 HB VAL 114 -9.209 -10.317 -4.076 936 1HG1 VAL 114 HG11 VAL 114 -7.019 -10.717 -5.951 937 2HG1 VAL 114 HG12 VAL 114 -6.789 -11.666 -4.482 938 3HG1 VAL 114 HG13 VAL 114 -8.264 -11.853 -5.430 939 1HG2 VAL 114 HG21 VAL 114 -7.419 -8.825 -2.683 940 2HG2 VAL 114 HG22 VAL 114 -7.927 -10.437 -2.179 941 3HG2 VAL 114 HG23 VAL 114 -6.417 -10.226 -3.066 942 H TYR 115 H TYR 115 -7.212 -8.383 -7.407 943 HA TYR 115 HA TYR 115 -9.634 -9.473 -8.750 944 1HB TYR 115 HB2 TYR 115 -8.291 -6.870 -9.536 945 2HB TYR 115 HB3 TYR 115 -9.699 -7.599 -10.310 946 HD1 TYR 115 HD1 TYR 115 -11.789 -8.002 -8.850 947 HD2 TYR 115 HD2 TYR 115 -8.557 -5.416 -7.703 948 HE1 TYR 115 HE1 TYR 115 -13.275 -6.869 -7.220 949 HE2 TYR 115 HE2 TYR 115 -10.043 -4.283 -6.072 950 HH TYR 115 HH TYR 115 -12.211 -4.005 -5.447 951 H LYS 116 H LYS 116 -8.202 -11.313 -9.157 952 HA LYS 116 HA LYS 116 -5.676 -11.351 -10.278 953 1HB LYS 116 HB2 LYS 116 -7.876 -13.074 -11.424 954 2HB LYS 116 HB3 LYS 116 -6.179 -13.489 -11.175 955 1HG LYS 116 HG2 LYS 116 -6.725 -13.019 -8.647 956 2HG LYS 116 HG3 LYS 116 -8.393 -13.288 -9.155 957 1HD LYS 116 HD2 LYS 116 -7.268 -15.408 -10.351 958 2HD LYS 116 HD3 LYS 116 -6.115 -15.210 -9.031 959 1HE LYS 116 HE2 LYS 116 -7.868 -15.378 -7.380 960 2HE LYS 116 HE3 LYS 116 -9.114 -15.336 -8.628 961 1HZ LYS 116 HZ1 LYS 116 -7.116 -17.400 -8.964 962 2HZ LYS 116 HZ2 LYS 116 -8.097 -17.583 -7.588 963 3HZ LYS 116 HZ3 LYS 116 -8.806 -17.484 -9.126 964 HA PRO 117 HA PRO 117 -4.648 -12.487 -11.761 965 1HB PRO 117 HB2 PRO 117 -2.646 -11.860 -13.508 966 2HB PRO 117 HB3 PRO 117 -3.970 -12.965 -13.915 967 1HG PRO 117 HG2 PRO 117 -3.498 -10.184 -14.835 968 2HG PRO 117 HG3 PRO 117 -4.407 -11.488 -15.614 969 1HD PRO 117 HD2 PRO 117 -5.485 -9.297 -14.136 970 2HD PRO 117 HD3 PRO 117 -6.373 -10.702 -14.764 971 H ASN 118 H ASN 118 -5.146 -9.564 -10.946 972 HA ASN 118 HA ASN 118 -2.438 -8.508 -10.529 973 1HB ASN 118 HB2 ASN 118 -5.217 -7.583 -9.825 974 2HB ASN 118 HB3 ASN 118 -3.807 -6.814 -9.095 975 1HD2 ASN 118 HD21 ASN 118 -5.525 -5.387 -10.901 976 2HD2 ASN 118 HD22 ASN 118 -4.647 -5.050 -12.315 977 H ASN 119 H ASN 119 -1.867 -10.603 -9.341 978 HA ASN 119 HA ASN 119 -2.003 -10.085 -6.464 979 1HB ASN 119 HB2 ASN 119 -2.895 -12.396 -5.973 980 2HB ASN 119 HB3 ASN 119 -4.079 -11.303 -6.692 981 1HD2 ASN 119 HD21 ASN 119 -5.186 -13.355 -7.449 982 2HD2 ASN 119 HD22 ASN 119 -4.620 -14.109 -8.860 983 H THR 120 H THR 120 -0.006 -10.398 -8.669 984 HA THR 120 HA THR 120 1.381 -12.829 -8.637 985 HB THR 120 HB THR 120 2.412 -9.987 -8.774 986 HG1 THR 120 HG1 THR 120 2.197 -10.283 -10.866 987 1HG2 THR 120 HG21 THR 120 3.889 -12.610 -9.085 988 2HG2 THR 120 HG22 THR 120 4.500 -11.075 -9.703 989 3HG2 THR 120 HG23 THR 120 4.259 -11.295 -7.969 990 H HIS 121 H HIS 121 1.229 -10.355 -6.139 991 HA HIS 121 HA HIS 121 2.952 -12.118 -4.444 992 1HB HIS 121 HB2 HIS 121 2.903 -9.110 -4.687 993 2HB HIS 121 HB3 HIS 121 3.520 -9.902 -3.236 994 HD1 HIS 121 HD1 HIS 121 4.771 -12.380 -4.812 995 HD2 HIS 121 HD2 HIS 121 5.459 -8.355 -5.658 996 HE1 HIS 121 HE1 HIS 121 6.977 -12.275 -6.050 997 H GLU 122 H GLU 122 0.301 -12.638 -4.405 998 HA GLU 122 HA GLU 122 -0.960 -11.046 -2.257 999 1HB GLU 122 HB2 GLU 122 -2.330 -11.791 -4.178 1000 2HB GLU 122 HB3 GLU 122 -1.980 -13.470 -3.769 1001 1HG GLU 122 HG2 GLU 122 -3.810 -13.402 -2.447 1002 2HG GLU 122 HG3 GLU 122 -2.872 -12.368 -1.369 1003 H GLN 123 H GLN 123 -0.107 -14.482 -2.821 1004 HA GLN 123 HA GLN 123 -0.727 -15.531 -0.316 1005 1HB GLN 123 HB2 GLN 123 1.242 -16.180 -2.425 1006 2HB GLN 123 HB3 GLN 123 1.634 -16.809 -0.824 1007 1HG GLN 123 HG2 GLN 123 -0.398 -18.026 -0.682 1008 2HG GLN 123 HG3 GLN 123 -1.118 -17.136 -2.024 1009 1HE2 GLN 123 HE21 GLN 123 1.096 -19.760 -1.197 1010 2HE2 GLN 123 HE22 GLN 123 1.302 -20.328 -2.784 1011 H LEU 124 H LEU 124 1.996 -13.471 -1.196 1012 HA LEU 124 HA LEU 124 3.517 -13.835 1.208 1013 1HB LEU 124 HB2 LEU 124 4.519 -12.767 -0.737 1014 2HB LEU 124 HB3 LEU 124 3.330 -11.466 -0.677 1015 HG LEU 124 HG LEU 124 4.189 -11.033 1.715 1016 1HD1 LEU 124 HD11 LEU 124 6.385 -12.799 0.600 1017 2HD1 LEU 124 HD12 LEU 124 6.598 -11.740 1.994 1018 3HD1 LEU 124 HD13 LEU 124 5.441 -13.068 2.065 1019 1HD2 LEU 124 HD21 LEU 124 4.954 -10.068 -0.790 1020 2HD2 LEU 124 HD22 LEU 124 5.314 -9.316 0.763 1021 3HD2 LEU 124 HD23 LEU 124 6.484 -10.404 0.020 1022 H LEU 125 H LEU 125 1.333 -11.145 0.289 1023 HA LEU 125 HA LEU 125 1.277 -10.036 2.943 1024 1HB LEU 125 HB2 LEU 125 -0.769 -9.723 0.724 1025 2HB LEU 125 HB3 LEU 125 -0.558 -8.653 2.111 1026 HG LEU 125 HG LEU 125 1.672 -9.211 0.146 1027 1HD1 LEU 125 HD11 LEU 125 -0.609 -7.265 0.024 1028 2HD1 LEU 125 HD12 LEU 125 0.972 -6.767 -0.578 1029 3HD1 LEU 125 HD13 LEU 125 0.161 -8.166 -1.283 1030 1HD2 LEU 125 HD21 LEU 125 1.141 -7.139 2.292 1031 2HD2 LEU 125 HD22 LEU 125 2.459 -8.310 2.226 1032 3HD2 LEU 125 HD23 LEU 125 2.419 -6.962 1.090 1033 H ARG 126 H ARG 126 -0.082 -12.856 1.696 1034 HA ARG 126 HA ARG 126 -2.559 -12.843 3.228 1035 1HB ARG 126 HB2 ARG 126 -1.591 -14.360 1.148 1036 2HB ARG 126 HB3 ARG 126 -1.417 -15.464 2.512 1037 1HG ARG 126 HG2 ARG 126 -3.956 -14.091 2.668 1038 2HG ARG 126 HG3 ARG 126 -3.785 -14.872 1.095 1039 1HD ARG 126 HD2 ARG 126 -4.208 -16.867 2.039 1040 2HD ARG 126 HD3 ARG 126 -2.791 -16.674 3.071 1041 HE ARG 126 HE ARG 126 -4.335 -15.447 4.672 1042 1HH1 ARG 126 HH11 ARG 126 -4.945 -18.367 4.706 1043 2HH1 ARG 126 HH12 ARG 126 -6.663 -18.389 4.480 1044 1HH2 ARG 126 HH21 ARG 126 -6.819 -15.125 3.317 1045 2HH2 ARG 126 HH22 ARG 126 -7.723 -16.554 3.692 1046 H LYS 127 H LYS 127 0.452 -14.775 3.552 1047 HA LYS 127 HA LYS 127 -0.208 -15.667 6.210 1048 1HB LYS 127 HB2 LYS 127 2.098 -16.477 6.299 1049 2HB LYS 127 HB3 LYS 127 1.412 -16.837 4.714 1050 1HG LYS 127 HG2 LYS 127 2.425 -14.467 4.098 1051 2HG LYS 127 HG3 LYS 127 3.487 -14.811 5.464 1052 1HD LYS 127 HD2 LYS 127 3.302 -17.187 3.898 1053 2HD LYS 127 HD3 LYS 127 3.642 -15.848 2.801 1054 1HE LYS 127 HE2 LYS 127 5.796 -15.993 3.452 1055 2HE LYS 127 HE3 LYS 127 5.280 -15.368 5.018 1056 1HZ LYS 127 HZ1 LYS 127 4.800 -18.189 4.617 1057 2HZ LYS 127 HZ2 LYS 127 6.442 -17.753 4.650 1058 3HZ LYS 127 HZ3 LYS 127 5.438 -17.375 5.965 1059 H SER 128 H SER 128 1.631 -12.938 4.932 1060 HA SER 128 HA SER 128 2.724 -12.074 7.447 1061 1HB SER 128 HB2 SER 128 2.057 -10.449 4.975 1062 2HB SER 128 HB3 SER 128 3.081 -9.913 6.304 1063 HG SER 128 HG SER 128 4.278 -11.965 5.801 1064 H GLU 129 H GLU 129 -0.266 -11.237 5.695 1065 HA GLU 129 HA GLU 129 -1.192 -9.225 7.472 1066 1HB GLU 129 HB2 GLU 129 -2.250 -9.744 5.279 1067 2HB GLU 129 HB3 GLU 129 -2.854 -11.259 5.949 1068 1HG GLU 129 HG2 GLU 129 -3.729 -9.518 7.840 1069 2HG GLU 129 HG3 GLU 129 -3.786 -8.484 6.412 1070 H ALA 130 H ALA 130 -1.623 -12.762 7.554 1071 HA ALA 130 HA ALA 130 -3.256 -12.766 9.927 1072 1HB ALA 130 HB1 ALA 130 -1.834 -14.766 8.277 1073 2HB ALA 130 HB2 ALA 130 -2.025 -15.205 9.974 1074 3HB ALA 130 HB3 ALA 130 -3.444 -14.838 8.995 1075 H GLN 131 H GLN 131 0.168 -12.497 9.362 1076 HA GLN 131 HA GLN 131 1.075 -13.340 11.956 1077 1HB GLN 131 HB2 GLN 131 2.296 -12.505 9.613 1078 2HB GLN 131 HB3 GLN 131 2.628 -11.174 10.722 1079 1HG GLN 131 HG2 GLN 131 4.411 -12.598 11.190 1080 2HG GLN 131 HG3 GLN 131 3.236 -13.116 12.400 1081 1HE2 GLN 131 HE21 GLN 131 5.095 -15.020 11.716 1082 2HE2 GLN 131 HE22 GLN 131 4.410 -16.207 10.713 1083 H ALA 132 H ALA 132 0.175 -10.167 10.616 1084 HA ALA 132 HA ALA 132 0.701 -8.691 13.026 1085 1HB ALA 132 HB1 ALA 132 -0.575 -8.206 10.424 1086 2HB ALA 132 HB2 ALA 132 -1.317 -7.303 11.745 1087 3HB ALA 132 HB3 ALA 132 0.406 -7.123 11.412 1088 H LYS 133 H LYS 133 -2.166 -10.357 11.762 1089 HA LYS 133 HA LYS 133 -4.083 -9.462 13.627 1090 1HB LYS 133 HB2 LYS 133 -3.809 -11.665 11.764 1091 2HB LYS 133 HB3 LYS 133 -4.578 -12.213 13.254 1092 1HG LYS 133 HG2 LYS 133 -6.484 -11.105 12.780 1093 2HG LYS 133 HG3 LYS 133 -5.604 -9.622 12.410 1094 1HD LYS 133 HD2 LYS 133 -6.534 -10.133 10.333 1095 2HD LYS 133 HD3 LYS 133 -4.949 -10.897 10.205 1096 1HE LYS 133 HE2 LYS 133 -5.870 -12.947 10.034 1097 2HE LYS 133 HE3 LYS 133 -6.859 -12.681 11.470 1098 1HZ LYS 133 HZ1 LYS 133 -8.213 -11.185 9.853 1099 2HZ LYS 133 HZ2 LYS 133 -7.490 -12.146 8.652 1100 3HZ LYS 133 HZ3 LYS 133 -8.448 -12.869 9.853 1101 H LYS 134 H LYS 134 -1.749 -12.147 13.909 1102 HA LYS 134 HA LYS 134 -2.593 -12.946 16.539 1103 1HB LYS 134 HB2 LYS 134 -0.405 -13.577 14.691 1104 2HB LYS 134 HB3 LYS 134 0.089 -13.622 16.383 1105 1HG LYS 134 HG2 LYS 134 -2.347 -15.044 15.272 1106 2HG LYS 134 HG3 LYS 134 -0.790 -15.818 15.575 1107 1HD LYS 134 HD2 LYS 134 -1.205 -15.982 17.786 1108 2HD LYS 134 HD3 LYS 134 -1.691 -14.289 17.884 1109 1HE LYS 134 HE2 LYS 134 -3.675 -15.407 18.434 1110 2HE LYS 134 HE3 LYS 134 -3.878 -15.109 16.707 1111 1HZ LYS 134 HZ1 LYS 134 -2.935 -17.350 16.318 1112 2HZ LYS 134 HZ2 LYS 134 -2.961 -17.620 17.994 1113 3HZ LYS 134 HZ3 LYS 134 -4.413 -17.373 17.149 1114 H GLU 135 H GLU 135 -0.181 -10.653 15.346 1115 HA GLU 135 HA GLU 135 0.837 -10.033 18.004 1116 1HB GLU 135 HB2 GLU 135 1.156 -8.777 15.277 1117 2HB GLU 135 HB3 GLU 135 1.815 -8.012 16.723 1118 1HG GLU 135 HG2 GLU 135 2.842 -10.378 17.187 1119 2HG GLU 135 HG3 GLU 135 2.570 -10.635 15.463 1120 H LYS 136 H LYS 136 -2.004 -9.251 16.347 1121 HA LYS 136 HA LYS 136 -3.599 -7.536 16.629 1122 1HB LYS 136 HB2 LYS 136 -2.544 -8.121 19.395 1123 2HB LYS 136 HB3 LYS 136 -3.812 -6.921 19.145 1124 1HG LYS 136 HG2 LYS 136 -5.345 -8.557 19.010 1125 2HG LYS 136 HG3 LYS 136 -4.491 -9.247 17.629 1126 1HD LYS 136 HD2 LYS 136 -3.762 -10.965 18.883 1127 2HD LYS 136 HD3 LYS 136 -3.049 -9.852 20.050 1128 1HE LYS 136 HE2 LYS 136 -4.619 -10.586 21.501 1129 2HE LYS 136 HE3 LYS 136 -5.774 -9.650 20.552 1130 1HZ LYS 136 HZ1 LYS 136 -5.235 -12.121 19.287 1131 2HZ LYS 136 HZ2 LYS 136 -5.716 -12.392 20.895 1132 3HZ LYS 136 HZ3 LYS 136 -6.716 -11.508 19.843 1133 H LEU 137 H LEU 137 -1.786 -6.236 15.389 1134 HA LEU 137 HA LEU 137 -0.804 -4.013 17.126 1135 1HB LEU 137 HB2 LEU 137 0.372 -5.507 14.958 1136 2HB LEU 137 HB3 LEU 137 0.299 -3.798 14.530 1137 HG LEU 137 HG LEU 137 1.560 -5.011 17.002 1138 1HD1 LEU 137 HD11 LEU 137 2.651 -3.386 14.683 1139 2HD1 LEU 137 HD12 LEU 137 3.585 -3.874 16.097 1140 3HD1 LEU 137 HD13 LEU 137 2.953 -5.096 14.992 1141 1HD2 LEU 137 HD21 LEU 137 0.582 -2.267 16.406 1142 2HD2 LEU 137 HD22 LEU 137 0.803 -3.067 17.962 1143 3HD2 LEU 137 HD23 LEU 137 2.191 -2.377 17.119 1144 H ASN 138 H ASN 138 -1.582 -1.975 16.801 1145 HA ASN 138 HA ASN 138 -2.934 -0.263 15.956 1146 1HB ASN 138 HB2 ASN 138 -2.236 -1.642 13.345 1147 2HB ASN 138 HB3 ASN 138 -2.916 -0.021 13.489 1148 1HD2 ASN 138 HD21 ASN 138 -0.021 -1.972 14.244 1149 2HD2 ASN 138 HD22 ASN 138 1.023 -0.647 14.434 1150 H ILE 139 H ILE 139 -4.377 -1.176 13.209 1151 HA ILE 139 HA ILE 139 -6.974 -1.309 14.022 1152 HB ILE 139 HB ILE 139 -5.811 -3.135 11.901 1153 1HG1 ILE 139 HG12 ILE 139 -6.974 -0.661 10.949 1154 2HG1 ILE 139 HG13 ILE 139 -5.681 -0.322 12.099 1155 1HG2 ILE 139 HG21 ILE 139 -8.557 -2.110 12.564 1156 2HG2 ILE 139 HG22 ILE 139 -8.141 -2.482 10.891 1157 3HG2 ILE 139 HG23 ILE 139 -8.059 -3.742 12.123 1158 1HD1 ILE 139 HD11 ILE 139 -5.028 -2.467 10.200 1159 2HD1 ILE 139 HD12 ILE 139 -5.301 -0.904 9.433 1160 3HD1 ILE 139 HD13 ILE 139 -4.072 -1.067 10.687 1161 H TRP 140 H TRP 140 -4.668 -3.996 14.211 1162 HA TRP 140 HA TRP 140 -6.766 -5.817 15.179 1163 1HB TRP 140 HB2 TRP 140 -3.788 -6.332 15.197 1164 2HB TRP 140 HB3 TRP 140 -5.099 -7.511 15.135 1165 HD1 TRP 140 HD1 TRP 140 -2.862 -5.485 12.963 1166 HE1 TRP 140 HE1 TRP 140 -3.528 -5.766 10.487 1167 HE3 TRP 140 HE3 TRP 140 -7.357 -7.845 13.519 1168 HZ2 TRP 140 HZ2 TRP 140 -5.682 -6.846 8.948 1169 HZ3 TRP 140 HZ3 TRP 140 -8.694 -8.487 11.534 1170 HH2 TRP 140 HH2 TRP 140 -7.863 -7.992 9.251 1171 H SER 141 H SER 141 -6.562 -3.562 16.823 1172 HA SER 141 HA SER 141 -4.936 -4.375 19.161 1173 1HB SER 141 HB2 SER 141 -4.797 -2.058 18.905 1174 2HB SER 141 HB3 SER 141 -6.472 -1.915 18.376 1175 HG SER 141 HG SER 141 -7.141 -2.025 20.423 1176 H GLU 142 H GLU 142 -5.839 -5.201 21.040 1177 HA GLU 142 HA GLU 142 -8.762 -5.785 20.923 1178 1HB GLU 142 HB2 GLU 142 -7.931 -7.374 22.913 1179 2HB GLU 142 HB3 GLU 142 -7.823 -7.868 21.226 1180 1HG GLU 142 HG2 GLU 142 -5.509 -7.285 21.108 1181 2HG GLU 142 HG3 GLU 142 -5.579 -6.414 22.640 1182 H ASP 143 H ASP 143 -9.488 -6.163 23.447 1183 HA ASP 143 HA ASP 143 -9.302 -3.484 24.616 1184 1HB ASP 143 HB2 ASP 143 -10.826 -4.604 26.375 1185 2HB ASP 143 HB3 ASP 143 -11.470 -4.425 24.746 1186 H ASN 144 H ASN 144 -8.952 -3.394 27.095 1187 HA ASN 144 HA ASN 144 -6.328 -4.502 27.658 1188 1HB ASN 144 HB2 ASN 144 -6.678 -3.434 29.909 1189 2HB ASN 144 HB3 ASN 144 -6.902 -2.322 28.558 1190 1HD2 ASN 144 HD21 ASN 144 -9.020 -1.458 28.200 1191 2HD2 ASN 144 HD22 ASN 144 -10.330 -1.775 29.232 1192 H ALA 145 H ALA 145 -5.830 -6.307 28.854 1193 HA ALA 145 HA ALA 145 -6.231 -8.436 29.779 1194 1HB ALA 145 HB1 ALA 145 -7.311 -6.367 31.478 1195 2HB ALA 145 HB2 ALA 145 -8.289 -7.828 31.622 1196 3HB ALA 145 HB3 ALA 145 -6.555 -7.893 31.940 1197 H ASP 146 H ASP 146 -8.415 -9.739 30.721 1198 HA ASP 146 HA ASP 146 -10.681 -9.375 28.880 1199 1HB ASP 146 HB2 ASP 146 -8.719 -11.652 28.672 1200 2HB ASP 146 HB3 ASP 146 -10.410 -11.891 28.229 1201 H SER 147 H SER 147 -12.556 -10.213 29.782 1202 HA SER 147 HA SER 147 -12.331 -12.167 31.994 1203 1HB SER 147 HB2 SER 147 -12.439 -10.504 33.535 1204 2HB SER 147 HB3 SER 147 -12.912 -9.307 32.334 1205 HG SER 147 HG SER 147 -14.485 -11.060 33.862 1206 H GLY 148 H GLY 148 -14.617 -10.039 30.233 1207 1HA GLY 148 HA2 GLY 148 -16.203 -12.378 29.460 1208 2HA GLY 148 HA3 GLY 148 -17.015 -11.309 30.604 1209 H GLN 149 H GLN 149 -14.773 -9.921 28.342 1210 HA GLN 149 HA GLN 149 -16.861 -8.242 27.218 1211 1HB GLN 149 HB2 GLN 149 -14.128 -8.541 25.997 1212 2HB GLN 149 HB3 GLN 149 -15.134 -7.098 26.125 1213 1HG GLN 149 HG2 GLN 149 -14.780 -7.774 28.767 1214 2HG GLN 149 HG3 GLN 149 -13.227 -8.228 28.061 1215 1HE2 GLN 149 HE21 GLN 149 -14.105 -5.810 29.796 1216 2HE2 GLN 149 HE22 GLN 149 -13.524 -4.468 28.933 1217 HN3 PTP 150 H3 PTP 150 -8.347 -3.244 -7.867 1218 1H5M PTP 150 H51 PTP 150 -7.555 -0.314 -3.419 1219 2H5M PTP 150 H52 PTP 150 -6.164 -0.189 -4.522 1220 3H5M PTP 150 H53 PTP 150 -6.580 -1.757 -3.791 1221 H6 PTP 150 H6 PTP 150 -9.137 0.517 -4.981 1222 H1* PTP 150 H1' PTP 150 -11.195 0.204 -8.013 1223 2H2* PTP 150 H2' PTP 150 -11.856 -0.617 -5.194 1224 H3* PTP 150 H3' PTP 150 -13.018 1.401 -4.731 1225 H4* PTP 150 H4' PTP 150 -11.636 3.255 -6.195 1226 2H5* PTP 150 H5' PTP 150 -10.769 1.469 -3.855 Start of MODEL 13 1 1H ALA 1 H1 ALA 1 12.588 -25.448 -17.910 2 2H ALA 1 H2 ALA 1 13.113 -26.811 -17.040 3 3H ALA 1 H3 ALA 1 12.668 -25.399 -16.213 4 HA ALA 1 HA ALA 1 15.161 -25.924 -16.567 5 1HB ALA 1 HB1 ALA 1 14.234 -24.828 -19.233 6 2HB ALA 1 HB2 ALA 1 15.914 -24.752 -18.699 7 3HB ALA 1 HB3 ALA 1 15.133 -26.315 -18.933 8 H THR 2 H THR 2 12.808 -23.399 -17.341 9 HA THR 2 HA THR 2 14.280 -21.589 -15.499 10 HB THR 2 HB THR 2 13.247 -20.634 -18.179 11 HG1 THR 2 HG1 THR 2 15.592 -20.551 -18.606 12 1HG2 THR 2 HG21 THR 2 14.656 -19.449 -15.837 13 2HG2 THR 2 HG22 THR 2 15.132 -18.877 -17.436 14 3HG2 THR 2 HG23 THR 2 13.455 -18.730 -16.910 15 H SER 3 H SER 3 12.820 -20.871 -14.027 16 HA SER 3 HA SER 3 9.937 -21.046 -14.660 17 1HB SER 3 HB2 SER 3 11.378 -20.341 -12.085 18 2HB SER 3 HB3 SER 3 9.634 -20.530 -12.251 19 HG SER 3 HG SER 3 11.017 -22.415 -11.552 20 H THR 4 H THR 4 8.845 -19.284 -15.379 21 HA THR 4 HA THR 4 10.142 -16.659 -15.405 22 HB THR 4 HB THR 4 7.335 -17.453 -16.240 23 HG1 THR 4 HG1 THR 4 9.375 -16.899 -18.045 24 1HG2 THR 4 HG21 THR 4 8.716 -14.914 -16.052 25 2HG2 THR 4 HG22 THR 4 8.286 -15.267 -17.726 26 3HG2 THR 4 HG23 THR 4 7.037 -15.237 -16.482 27 H LYS 5 H LYS 5 9.897 -15.133 -13.839 28 HA LYS 5 HA LYS 5 7.401 -14.865 -12.351 29 1HB LYS 5 HB2 LYS 5 9.887 -15.967 -11.030 30 2HB LYS 5 HB3 LYS 5 8.624 -15.148 -10.112 31 1HG LYS 5 HG2 LYS 5 7.010 -16.798 -11.345 32 2HG LYS 5 HG3 LYS 5 8.473 -17.742 -11.627 33 1HD LYS 5 HD2 LYS 5 7.978 -16.730 -8.859 34 2HD LYS 5 HD3 LYS 5 7.010 -18.092 -9.426 35 1HE LYS 5 HE2 LYS 5 8.841 -19.222 -8.560 36 2HE LYS 5 HE3 LYS 5 9.368 -19.004 -10.230 37 1HZ LYS 5 HZ1 LYS 5 10.461 -16.917 -9.493 38 2HZ LYS 5 HZ2 LYS 5 10.097 -17.338 -7.887 39 3HZ LYS 5 HZ3 LYS 5 11.127 -18.322 -8.807 40 H LYS 6 H LYS 6 7.676 -13.066 -10.650 41 HA LYS 6 HA LYS 6 8.357 -10.883 -10.122 42 1HB LYS 6 HB2 LYS 6 10.594 -12.023 -9.863 43 2HB LYS 6 HB3 LYS 6 10.934 -11.605 -11.543 44 1HG LYS 6 HG2 LYS 6 11.169 -9.365 -11.085 45 2HG LYS 6 HG3 LYS 6 9.996 -9.403 -9.768 46 1HD LYS 6 HD2 LYS 6 11.568 -9.938 -8.206 47 2HD LYS 6 HD3 LYS 6 12.447 -10.995 -9.312 48 1HE LYS 6 HE2 LYS 6 13.882 -9.121 -8.877 49 2HE LYS 6 HE3 LYS 6 13.244 -8.899 -10.506 50 1HZ LYS 6 HZ1 LYS 6 11.973 -7.703 -8.113 51 2HZ LYS 6 HZ2 LYS 6 13.168 -6.900 -9.009 52 3HZ LYS 6 HZ3 LYS 6 11.696 -7.321 -9.746 53 H LEU 7 H LEU 7 7.742 -9.042 -11.161 54 HA LEU 7 HA LEU 7 7.609 -9.090 -14.115 55 1HB LEU 7 HB2 LEU 7 6.654 -6.888 -12.269 56 2HB LEU 7 HB3 LEU 7 6.127 -7.221 -13.919 57 HG LEU 7 HG LEU 7 5.680 -9.618 -12.550 58 1HD1 LEU 7 HD11 LEU 7 5.459 -7.277 -10.764 59 2HD1 LEU 7 HD12 LEU 7 4.034 -8.314 -10.793 60 3HD1 LEU 7 HD13 LEU 7 5.605 -8.987 -10.362 61 1HD2 LEU 7 HD21 LEU 7 3.898 -7.318 -13.378 62 2HD2 LEU 7 HD22 LEU 7 4.184 -8.830 -14.237 63 3HD2 LEU 7 HD23 LEU 7 3.246 -8.828 -12.744 64 H HIS 8 H HIS 8 7.730 -6.021 -14.005 65 HA HIS 8 HA HIS 8 10.714 -5.844 -13.912 66 1HB HIS 8 HB2 HIS 8 9.150 -5.467 -16.110 67 2HB HIS 8 HB3 HIS 8 9.224 -3.821 -15.477 68 HD1 HIS 8 HD1 HIS 8 10.874 -2.909 -17.221 69 HD2 HIS 8 HD2 HIS 8 12.313 -6.264 -15.211 70 HE1 HIS 8 HE1 HIS 8 13.325 -3.112 -17.830 71 H LYS 9 H LYS 9 11.544 -4.359 -12.508 72 HA LYS 9 HA LYS 9 9.611 -2.529 -11.162 73 1HB LYS 9 HB2 LYS 9 12.408 -3.307 -10.285 74 2HB LYS 9 HB3 LYS 9 11.205 -2.437 -9.333 75 1HG LYS 9 HG2 LYS 9 9.984 -4.836 -10.279 76 2HG LYS 9 HG3 LYS 9 11.548 -5.266 -9.585 77 1HD LYS 9 HD2 LYS 9 10.109 -3.287 -7.977 78 2HD LYS 9 HD3 LYS 9 9.223 -4.804 -8.145 79 1HE LYS 9 HE2 LYS 9 10.782 -4.779 -6.181 80 2HE LYS 9 HE3 LYS 9 11.128 -6.071 -7.331 81 1HZ LYS 9 HZ1 LYS 9 12.485 -3.624 -7.953 82 2HZ LYS 9 HZ2 LYS 9 12.910 -4.235 -6.425 83 3HZ LYS 9 HZ3 LYS 9 13.104 -5.199 -7.806 84 H GLU 10 H GLU 10 9.902 -0.320 -11.278 85 HA GLU 10 HA GLU 10 12.355 0.647 -12.694 86 1HB GLU 10 HB2 GLU 10 9.461 1.402 -13.118 87 2HB GLU 10 HB3 GLU 10 10.774 2.476 -13.600 88 1HG GLU 10 HG2 GLU 10 11.069 -0.348 -14.443 89 2HG GLU 10 HG3 GLU 10 9.759 0.544 -15.217 90 HA PRO 11 HA PRO 11 12.772 3.546 -9.411 91 1HB PRO 11 HB2 PRO 11 13.861 5.671 -10.739 92 2HB PRO 11 HB3 PRO 11 14.751 4.175 -10.408 93 1HG PRO 11 HG2 PRO 11 13.511 5.112 -12.963 94 2HG PRO 11 HG3 PRO 11 14.984 4.160 -12.712 95 1HD PRO 11 HD2 PRO 11 12.533 3.094 -13.492 96 2HD PRO 11 HD3 PRO 11 13.839 2.166 -12.723 97 H ALA 12 H ALA 12 12.089 5.750 -8.680 98 HA ALA 12 HA ALA 12 10.039 7.111 -10.302 99 1HB ALA 12 HB1 ALA 12 9.352 5.192 -8.255 100 2HB ALA 12 HB2 ALA 12 8.807 6.800 -7.776 101 3HB ALA 12 HB3 ALA 12 8.280 6.112 -9.311 102 H THR 13 H THR 13 9.032 8.914 -8.648 103 HA THR 13 HA THR 13 11.316 9.990 -7.050 104 HB THR 13 HB THR 13 9.525 11.697 -8.796 105 HG1 THR 13 HG1 THR 13 10.943 11.472 -10.366 106 1HG2 THR 13 HG21 THR 13 11.377 12.251 -6.719 107 2HG2 THR 13 HG22 THR 13 12.139 12.746 -8.231 108 3HG2 THR 13 HG23 THR 13 10.568 13.407 -7.777 109 H LEU 14 H LEU 14 10.705 11.081 -5.162 110 HA LEU 14 HA LEU 14 7.964 10.563 -4.243 111 1HB LEU 14 HB2 LEU 14 10.002 10.255 -2.788 112 2HB LEU 14 HB3 LEU 14 10.201 12.007 -2.796 113 HG LEU 14 HG LEU 14 7.796 12.151 -1.953 114 1HD1 LEU 14 HD11 LEU 14 8.237 9.210 -2.027 115 2HD1 LEU 14 HD12 LEU 14 7.392 9.845 -0.616 116 3HD1 LEU 14 HD13 LEU 14 6.746 10.128 -2.231 117 1HD2 LEU 14 HD21 LEU 14 10.251 11.493 -0.575 118 2HD2 LEU 14 HD22 LEU 14 8.947 12.562 -0.061 119 3HD2 LEU 14 HD23 LEU 14 8.871 10.839 0.305 120 H ILE 15 H ILE 15 6.499 11.993 -5.133 121 HA ILE 15 HA ILE 15 7.208 14.840 -5.405 122 HB ILE 15 HB ILE 15 4.556 13.481 -5.962 123 1HG1 ILE 15 HG12 ILE 15 6.928 14.001 -7.786 124 2HG1 ILE 15 HG13 ILE 15 6.348 12.419 -7.265 125 1HG2 ILE 15 HG21 ILE 15 5.719 16.194 -6.407 126 2HG2 ILE 15 HG22 ILE 15 4.697 15.533 -7.684 127 3HG2 ILE 15 HG23 ILE 15 4.055 15.730 -6.054 128 1HD1 ILE 15 HD11 ILE 15 4.115 13.012 -8.320 129 2HD1 ILE 15 HD12 ILE 15 4.911 14.417 -9.028 130 3HD1 ILE 15 HD13 ILE 15 5.444 12.792 -9.458 131 H LYS 16 H LYS 16 4.567 13.016 -3.788 132 HA LYS 16 HA LYS 16 4.832 14.585 -1.366 133 1HB LYS 16 HB2 LYS 16 3.607 16.059 -3.202 134 2HB LYS 16 HB3 LYS 16 2.214 15.084 -2.733 135 1HG LYS 16 HG2 LYS 16 2.086 16.891 -1.245 136 2HG LYS 16 HG3 LYS 16 2.936 15.674 -0.292 137 1HD LYS 16 HD2 LYS 16 5.088 16.761 -1.337 138 2HD LYS 16 HD3 LYS 16 4.026 18.143 -1.614 139 1HE LYS 16 HE2 LYS 16 3.529 18.337 0.727 140 2HE LYS 16 HE3 LYS 16 4.302 16.792 1.082 141 1HZ LYS 16 HZ1 LYS 16 5.802 19.024 -0.143 142 2HZ LYS 16 HZ2 LYS 16 5.619 18.902 1.540 143 3HZ LYS 16 HZ3 LYS 16 6.406 17.668 0.679 144 H ALA 17 H ALA 17 4.277 13.115 0.161 145 HA ALA 17 HA ALA 17 2.692 10.770 -0.489 146 1HB ALA 17 HB1 ALA 17 4.474 11.532 1.569 147 2HB ALA 17 HB2 ALA 17 2.925 11.223 2.354 148 3HB ALA 17 HB3 ALA 17 3.681 9.969 1.370 149 H ILE 18 H ILE 18 0.538 10.367 0.049 150 HA ILE 18 HA ILE 18 -0.982 12.736 1.053 151 HB ILE 18 HB ILE 18 -1.967 10.372 -0.574 152 1HG1 ILE 18 HG12 ILE 18 -1.740 13.223 -1.524 153 2HG1 ILE 18 HG13 ILE 18 -0.354 12.136 -1.629 154 1HG2 ILE 18 HG21 ILE 18 -3.326 12.340 1.000 155 2HG2 ILE 18 HG22 ILE 18 -3.647 12.678 -0.700 156 3HG2 ILE 18 HG23 ILE 18 -4.029 11.092 -0.030 157 1HD1 ILE 18 HD11 ILE 18 -1.814 10.501 -2.856 158 2HD1 ILE 18 HD12 ILE 18 -3.086 11.721 -2.872 159 3HD1 ILE 18 HD13 ILE 18 -1.570 12.017 -3.723 160 H ASP 19 H ASP 19 -1.186 9.152 1.110 161 HA ASP 19 HA ASP 19 -1.958 9.374 3.983 162 1HB ASP 19 HB2 ASP 19 -3.235 7.312 2.203 163 2HB ASP 19 HB3 ASP 19 -3.810 7.962 3.740 164 H GLY 20 H GLY 20 -2.378 6.435 4.037 165 1HA GLY 20 HA2 GLY 20 0.410 5.684 4.459 166 2HA GLY 20 HA3 GLY 20 -0.993 4.652 4.739 167 H ASP 21 H ASP 21 -2.189 4.190 2.481 168 HA ASP 21 HA ASP 21 -0.061 3.079 0.721 169 1HB ASP 21 HB2 ASP 21 -2.073 1.788 -0.245 170 2HB ASP 21 HB3 ASP 21 -1.564 1.371 1.392 171 H THR 22 H THR 22 -0.601 5.867 0.530 172 HA THR 22 HA THR 22 -1.449 5.978 -2.301 173 HB THR 22 HB THR 22 -2.618 7.976 -0.371 174 HG1 THR 22 HG1 THR 22 -4.547 6.542 -0.695 175 1HG2 THR 22 HG21 THR 22 -3.161 7.051 -3.188 176 2HG2 THR 22 HG22 THR 22 -4.374 7.940 -2.266 177 3HG2 THR 22 HG23 THR 22 -2.813 8.683 -2.616 178 H VAL 23 H VAL 23 0.255 7.000 -3.250 179 HA VAL 23 HA VAL 23 1.227 9.527 -2.063 180 HB VAL 23 HB VAL 23 3.604 8.778 -2.211 181 1HG1 VAL 23 HG11 VAL 23 2.240 8.684 -0.082 182 2HG1 VAL 23 HG12 VAL 23 1.942 6.980 -0.424 183 3HG1 VAL 23 HG13 VAL 23 3.588 7.546 -0.134 184 1HG2 VAL 23 HG21 VAL 23 2.945 6.874 -3.838 185 2HG2 VAL 23 HG22 VAL 23 4.169 6.515 -2.622 186 3HG2 VAL 23 HG23 VAL 23 2.509 5.968 -2.389 187 H LYS 24 H LYS 24 1.971 10.943 -3.632 188 HA LYS 24 HA LYS 24 1.636 10.059 -6.438 189 1HB LYS 24 HB2 LYS 24 2.383 12.860 -5.661 190 2HB LYS 24 HB3 LYS 24 1.355 12.306 -6.983 191 1HG LYS 24 HG2 LYS 24 -0.233 11.461 -5.110 192 2HG LYS 24 HG3 LYS 24 0.687 12.533 -4.054 193 1HD LYS 24 HD2 LYS 24 0.176 14.099 -6.300 194 2HD LYS 24 HD3 LYS 24 -1.322 13.197 -6.066 195 1HE LYS 24 HE2 LYS 24 -1.346 13.892 -3.682 196 2HE LYS 24 HE3 LYS 24 0.114 14.843 -3.961 197 1HZ LYS 24 HZ1 LYS 24 -1.500 15.689 -5.934 198 2HZ LYS 24 HZ2 LYS 24 -2.622 15.404 -4.690 199 3HZ LYS 24 HZ3 LYS 24 -1.323 16.470 -4.439 200 H LEU 25 H LEU 25 3.419 9.302 -7.464 201 HA LEU 25 HA LEU 25 6.050 10.565 -6.803 202 1HB LEU 25 HB2 LEU 25 5.838 7.736 -7.803 203 2HB LEU 25 HB3 LEU 25 7.131 8.489 -6.871 204 HG LEU 25 HG LEU 25 4.364 8.146 -5.714 205 1HD1 LEU 25 HD11 LEU 25 6.000 6.028 -6.523 206 2HD1 LEU 25 HD12 LEU 25 6.332 6.206 -4.800 207 3HD1 LEU 25 HD13 LEU 25 4.680 5.942 -5.357 208 1HD2 LEU 25 HD21 LEU 25 7.153 8.635 -4.652 209 2HD2 LEU 25 HD22 LEU 25 5.716 9.635 -4.438 210 3HD2 LEU 25 HD23 LEU 25 5.843 8.085 -3.606 211 H MET 26 H MET 26 7.459 10.896 -8.598 212 HA MET 26 HA MET 26 6.073 11.216 -11.156 213 1HB MET 26 HB2 MET 26 7.899 12.757 -10.122 214 2HB MET 26 HB3 MET 26 9.039 11.567 -10.751 215 1HG MET 26 HG2 MET 26 7.314 11.979 -12.884 216 2HG MET 26 HG3 MET 26 7.483 13.588 -12.187 217 1HE MET 26 HE1 MET 26 9.846 14.503 -11.385 218 2HE MET 26 HE2 MET 26 10.918 14.730 -12.774 219 3HE MET 26 HE3 MET 26 9.205 15.123 -12.904 220 H TYR 27 H TYR 27 6.410 9.983 -13.013 221 HA TYR 27 HA TYR 27 8.318 7.698 -12.791 222 1HB TYR 27 HB2 TYR 27 6.088 6.812 -12.318 223 2HB TYR 27 HB3 TYR 27 5.451 7.576 -13.775 224 HD1 TYR 27 HD1 TYR 27 7.733 4.946 -12.497 225 HD2 TYR 27 HD2 TYR 27 5.818 6.628 -15.955 226 HE1 TYR 27 HE1 TYR 27 8.411 2.970 -13.833 227 HE2 TYR 27 HE2 TYR 27 6.494 4.651 -17.291 228 HH TYR 27 HH TYR 27 7.598 1.796 -15.919 229 H LYS 28 H LYS 28 9.774 8.064 -14.397 230 HA LYS 28 HA LYS 28 10.647 8.806 -16.459 231 1HB LYS 28 HB2 LYS 28 8.178 7.214 -17.106 232 2HB LYS 28 HB3 LYS 28 9.089 7.984 -18.406 233 1HG LYS 28 HG2 LYS 28 11.142 6.861 -17.095 234 2HG LYS 28 HG3 LYS 28 9.874 5.730 -16.619 235 1HD LYS 28 HD2 LYS 28 9.270 5.763 -19.176 236 2HD LYS 28 HD3 LYS 28 10.925 6.347 -19.366 237 1HE LYS 28 HE2 LYS 28 11.825 4.388 -18.307 238 2HE LYS 28 HE3 LYS 28 10.225 3.858 -17.790 239 1HZ LYS 28 HZ1 LYS 28 10.315 4.284 -20.599 240 2HZ LYS 28 HZ2 LYS 28 11.509 3.177 -20.121 241 3HZ LYS 28 HZ3 LYS 28 9.880 2.887 -19.736 242 H GLY 29 H GLY 29 8.935 10.733 -15.026 243 1HA GLY 29 HA2 GLY 29 8.420 12.990 -15.633 244 2HA GLY 29 HA3 GLY 29 8.375 12.499 -17.327 245 H GLN 30 H GLN 30 6.651 10.851 -14.724 246 HA GLN 30 HA GLN 30 4.093 12.055 -15.614 247 1HB GLN 30 HB2 GLN 30 4.639 9.920 -16.954 248 2HB GLN 30 HB3 GLN 30 4.374 9.054 -15.441 249 1HG GLN 30 HG2 GLN 30 2.108 9.867 -15.286 250 2HG GLN 30 HG3 GLN 30 2.357 10.966 -16.643 251 1HE2 GLN 30 HE21 GLN 30 2.339 10.067 -18.802 252 2HE2 GLN 30 HE22 GLN 30 1.869 8.465 -19.109 253 HA PRO 31 HA PRO 31 4.188 11.618 -11.074 254 1HB PRO 31 HB2 PRO 31 2.692 13.868 -10.650 255 2HB PRO 31 HB3 PRO 31 4.442 13.911 -10.928 256 1HG PRO 31 HG2 PRO 31 2.213 14.549 -12.823 257 2HG PRO 31 HG3 PRO 31 3.812 15.301 -12.672 258 1HD PRO 31 HD2 PRO 31 3.147 13.439 -14.618 259 2HD PRO 31 HD3 PRO 31 4.806 13.753 -14.061 260 H MET 32 H MET 32 2.787 9.910 -10.649 261 HA MET 32 HA MET 32 -0.133 10.495 -10.893 262 1HB MET 32 HB2 MET 32 1.419 8.134 -11.882 263 2HB MET 32 HB3 MET 32 -0.203 7.858 -11.247 264 1HG MET 32 HG2 MET 32 -0.441 10.129 -12.879 265 2HG MET 32 HG3 MET 32 0.594 9.023 -13.783 266 1HE MET 32 HE1 MET 32 0.196 6.575 -12.929 267 2HE MET 32 HE2 MET 32 -1.285 6.135 -12.082 268 3HE MET 32 HE3 MET 32 -1.107 5.778 -13.807 269 H THR 33 H THR 33 -1.433 9.442 -9.263 270 HA THR 33 HA THR 33 0.070 8.959 -6.772 271 HB THR 33 HB THR 33 -1.918 10.395 -6.664 272 HG1 THR 33 HG1 THR 33 -3.108 9.008 -5.110 273 1HG2 THR 33 HG21 THR 33 -3.127 9.295 -8.565 274 2HG2 THR 33 HG22 THR 33 -3.487 7.940 -7.496 275 3HG2 THR 33 HG23 THR 33 -4.137 9.539 -7.142 276 H PHE 34 H PHE 34 0.768 6.925 -6.385 277 HA PHE 34 HA PHE 34 -0.674 4.636 -7.594 278 1HB PHE 34 HB2 PHE 34 1.987 4.914 -6.183 279 2HB PHE 34 HB3 PHE 34 1.300 3.343 -6.599 280 HD1 PHE 34 HD1 PHE 34 2.713 6.478 -7.923 281 HD2 PHE 34 HD2 PHE 34 1.081 2.633 -8.926 282 HE1 PHE 34 HE1 PHE 34 3.559 6.723 -10.243 283 HE2 PHE 34 HE2 PHE 34 1.926 2.878 -11.244 284 HZ PHE 34 HZ PHE 34 3.165 4.922 -11.903 285 H ARG 35 H ARG 35 -1.571 2.959 -6.331 286 HA ARG 35 HA ARG 35 -1.846 3.582 -3.414 287 1HB ARG 35 HB2 ARG 35 -3.947 3.938 -4.748 288 2HB ARG 35 HB3 ARG 35 -3.906 2.228 -5.180 289 1HG ARG 35 HG2 ARG 35 -4.806 1.643 -3.202 290 2HG ARG 35 HG3 ARG 35 -3.573 2.551 -2.322 291 1HD ARG 35 HD2 ARG 35 -4.849 4.627 -2.644 292 2HD ARG 35 HD3 ARG 35 -6.071 3.745 -3.560 293 HE ARG 35 HE ARG 35 -5.832 2.465 -1.047 294 1HH1 ARG 35 HH11 ARG 35 -6.001 5.780 -1.637 295 2HH1 ARG 35 HH12 ARG 35 -7.453 6.041 -0.729 296 1HH2 ARG 35 HH21 ARG 35 -8.040 2.663 -0.197 297 2HH2 ARG 35 HH22 ARG 35 -8.610 4.275 0.084 298 H LEU 36 H LEU 36 -1.078 1.979 -2.115 299 HA LEU 36 HA LEU 36 0.283 -0.287 -2.939 300 1HB LEU 36 HB2 LEU 36 -1.416 0.030 -0.444 301 2HB LEU 36 HB3 LEU 36 -0.235 -1.256 -0.689 302 HG LEU 36 HG LEU 36 0.286 1.721 -0.529 303 1HD1 LEU 36 HD11 LEU 36 0.967 -0.703 1.120 304 2HD1 LEU 36 HD12 LEU 36 2.003 0.723 1.176 305 3HD1 LEU 36 HD13 LEU 36 0.307 0.846 1.647 306 1HD2 LEU 36 HD21 LEU 36 1.950 -0.531 -1.632 307 2HD2 LEU 36 HD22 LEU 36 1.731 1.099 -2.268 308 3HD2 LEU 36 HD23 LEU 36 2.736 0.835 -0.843 309 H LEU 37 H LEU 37 -0.313 -2.112 -3.990 310 HA LEU 37 HA LEU 37 -3.164 -2.642 -4.463 311 1HB LEU 37 HB2 LEU 37 -0.571 -3.576 -5.580 312 2HB LEU 37 HB3 LEU 37 -1.914 -4.715 -5.657 313 HG LEU 37 HG LEU 37 -2.190 -1.847 -6.568 314 1HD1 LEU 37 HD11 LEU 37 -0.729 -4.029 -7.815 315 2HD1 LEU 37 HD12 LEU 37 -2.081 -3.513 -8.821 316 3HD1 LEU 37 HD13 LEU 37 -0.859 -2.345 -8.319 317 1HD2 LEU 37 HD21 LEU 37 -3.781 -4.392 -6.790 318 2HD2 LEU 37 HD22 LEU 37 -4.325 -2.784 -6.312 319 3HD2 LEU 37 HD23 LEU 37 -3.970 -3.128 -8.005 320 H LEU 38 H LEU 38 -4.226 -4.602 -3.890 321 HA LEU 38 HA LEU 38 -4.681 -6.499 -2.585 322 1HB LEU 38 HB2 LEU 38 -1.731 -6.572 -1.923 323 2HB LEU 38 HB3 LEU 38 -2.878 -7.912 -1.919 324 HG LEU 38 HG LEU 38 -1.797 -6.412 -4.313 325 1HD1 LEU 38 HD11 LEU 38 -0.538 -8.368 -3.266 326 2HD1 LEU 38 HD12 LEU 38 -1.900 -9.382 -3.741 327 3HD1 LEU 38 HD13 LEU 38 -0.947 -8.551 -4.972 328 1HD2 LEU 38 HD21 LEU 38 -4.251 -6.737 -4.540 329 2HD2 LEU 38 HD22 LEU 38 -3.351 -7.737 -5.681 330 3HD2 LEU 38 HD23 LEU 38 -4.037 -8.459 -4.225 331 H VAL 39 H VAL 39 -4.067 -3.591 -1.479 332 HA VAL 39 HA VAL 39 -4.537 -4.417 1.326 333 HB VAL 39 HB VAL 39 -2.783 -3.114 2.252 334 1HG1 VAL 39 HG11 VAL 39 -1.712 -4.445 -0.254 335 2HG1 VAL 39 HG12 VAL 39 -0.754 -4.016 1.162 336 3HG1 VAL 39 HG13 VAL 39 -2.013 -5.245 1.288 337 1HG2 VAL 39 HG21 VAL 39 -2.456 -1.986 -0.544 338 2HG2 VAL 39 HG22 VAL 39 -2.974 -1.115 0.900 339 3HG2 VAL 39 HG23 VAL 39 -1.313 -1.695 0.768 340 H ASP 40 H ASP 40 -5.269 -2.526 2.658 341 HA ASP 40 HA ASP 40 -6.266 -0.214 1.103 342 1HB ASP 40 HB2 ASP 40 -8.117 -1.746 0.880 343 2HB ASP 40 HB3 ASP 40 -8.042 -2.167 2.591 344 H THR 41 H THR 41 -5.955 1.591 2.330 345 HA THR 41 HA THR 41 -4.979 1.379 5.037 346 HB THR 41 HB THR 41 -4.225 3.235 3.701 347 HG1 THR 41 HG1 THR 41 -4.426 3.870 5.784 348 1HG2 THR 41 HG21 THR 41 -7.177 3.702 3.311 349 2HG2 THR 41 HG22 THR 41 -6.010 5.001 3.061 350 3HG2 THR 41 HG23 THR 41 -5.918 3.534 2.087 351 HA PRO 42 HA PRO 42 -8.914 1.314 7.085 352 1HB PRO 42 HB2 PRO 42 -7.963 1.705 9.616 353 2HB PRO 42 HB3 PRO 42 -7.799 0.167 8.750 354 1HG PRO 42 HG2 PRO 42 -5.745 2.272 9.262 355 2HG PRO 42 HG3 PRO 42 -5.550 0.516 9.131 356 1HD PRO 42 HD2 PRO 42 -4.942 2.353 7.110 357 2HD PRO 42 HD3 PRO 42 -5.207 0.613 6.865 358 H GLU 43 H GLU 43 -9.553 2.818 9.333 359 HA GLU 43 HA GLU 43 -10.365 5.302 8.325 360 1HB GLU 43 HB2 GLU 43 -10.556 3.962 10.773 361 2HB GLU 43 HB3 GLU 43 -9.740 5.478 11.165 362 1HG GLU 43 HG2 GLU 43 -11.999 6.081 11.308 363 2HG GLU 43 HG3 GLU 43 -11.587 6.563 9.662 364 H THR 44 H THR 44 -9.382 7.285 8.084 365 HA THR 44 HA THR 44 -7.208 8.310 9.543 366 HB THR 44 HB THR 44 -5.842 6.488 8.714 367 HG1 THR 44 HG1 THR 44 -4.967 8.642 8.684 368 1HG2 THR 44 HG21 THR 44 -7.481 6.252 6.659 369 2HG2 THR 44 HG22 THR 44 -6.313 7.312 5.871 370 3HG2 THR 44 HG23 THR 44 -5.796 5.752 6.510 371 H LYS 45 H LYS 45 -9.152 9.790 8.839 372 HA LYS 45 HA LYS 45 -9.094 10.858 6.145 373 1HB LYS 45 HB2 LYS 45 -10.990 10.944 7.971 374 2HB LYS 45 HB3 LYS 45 -10.157 12.410 8.488 375 1HG LYS 45 HG2 LYS 45 -11.693 13.236 6.922 376 2HG LYS 45 HG3 LYS 45 -10.232 13.044 5.952 377 1HD LYS 45 HD2 LYS 45 -11.048 11.191 4.830 378 2HD LYS 45 HD3 LYS 45 -12.094 10.714 6.168 379 1HE LYS 45 HE2 LYS 45 -13.594 11.534 4.533 380 2HE LYS 45 HE3 LYS 45 -13.411 12.879 5.659 381 1HZ LYS 45 HZ1 LYS 45 -11.586 12.667 3.368 382 2HZ LYS 45 HZ2 LYS 45 -13.156 13.257 3.115 383 3HZ LYS 45 HZ3 LYS 45 -12.117 14.049 4.201 384 H HIS 46 H HIS 46 -8.396 12.592 9.200 385 HA HIS 46 HA HIS 46 -6.173 13.968 7.744 386 1HB HIS 46 HB2 HIS 46 -8.411 15.011 9.334 387 2HB HIS 46 HB3 HIS 46 -6.843 15.646 9.834 388 HD1 HIS 46 HD1 HIS 46 -9.233 17.085 8.081 389 HD2 HIS 46 HD2 HIS 46 -5.517 15.752 6.737 390 HE1 HIS 46 HE1 HIS 46 -8.724 18.388 5.970 391 HA PRO 47 HA PRO 47 -3.541 12.534 10.979 392 1HB PRO 47 HB2 PRO 47 -1.492 14.305 10.626 393 2HB PRO 47 HB3 PRO 47 -1.836 12.991 9.489 394 1HG PRO 47 HG2 PRO 47 -2.348 15.906 9.205 395 2HG PRO 47 HG3 PRO 47 -2.053 14.687 7.955 396 1HD PRO 47 HD2 PRO 47 -4.573 15.752 8.689 397 2HD PRO 47 HD3 PRO 47 -4.291 14.334 7.657 398 H LYS 48 H LYS 48 -4.666 15.844 10.921 399 HA LYS 48 HA LYS 48 -3.499 16.850 13.296 400 1HB LYS 48 HB2 LYS 48 -6.348 17.420 12.464 401 2HB LYS 48 HB3 LYS 48 -5.216 18.496 13.282 402 1HG LYS 48 HG2 LYS 48 -3.744 18.247 11.176 403 2HG LYS 48 HG3 LYS 48 -5.189 17.594 10.403 404 1HD LYS 48 HD2 LYS 48 -6.016 19.665 10.119 405 2HD LYS 48 HD3 LYS 48 -5.884 19.982 11.849 406 1HE LYS 48 HE2 LYS 48 -3.602 20.722 11.616 407 2HE LYS 48 HE3 LYS 48 -3.547 20.190 9.936 408 1HZ LYS 48 HZ1 LYS 48 -5.614 22.108 10.727 409 2HZ LYS 48 HZ2 LYS 48 -4.022 22.672 10.544 410 3HZ LYS 48 HZ3 LYS 48 -4.818 21.930 9.240 411 H LYS 49 H LYS 49 -6.690 15.257 12.925 412 HA LYS 49 HA LYS 49 -6.379 13.749 15.363 413 1HB LYS 49 HB2 LYS 49 -7.037 16.387 15.834 414 2HB LYS 49 HB3 LYS 49 -8.618 15.605 15.799 415 1HG LYS 49 HG2 LYS 49 -8.263 14.659 17.810 416 2HG LYS 49 HG3 LYS 49 -6.726 13.982 17.271 417 1HD LYS 49 HD2 LYS 49 -5.875 15.407 18.846 418 2HD LYS 49 HD3 LYS 49 -6.013 16.579 17.536 419 1HE LYS 49 HE2 LYS 49 -7.915 17.563 18.431 420 2HE LYS 49 HE3 LYS 49 -8.397 16.097 19.285 421 1HZ LYS 49 HZ1 LYS 49 -6.545 16.421 20.806 422 2HZ LYS 49 HZ2 LYS 49 -6.095 17.839 19.985 423 3HZ LYS 49 HZ3 LYS 49 -7.574 17.769 20.816 424 H GLY 50 H GLY 50 -9.272 15.385 14.062 425 1HA GLY 50 HA2 GLY 50 -11.291 14.427 13.320 426 2HA GLY 50 HA3 GLY 50 -10.222 13.465 12.297 427 H VAL 51 H VAL 51 -10.379 11.302 12.583 428 HA VAL 51 HA VAL 51 -11.857 10.251 14.893 429 HB VAL 51 HB VAL 51 -10.474 8.622 12.757 430 1HG1 VAL 51 HG11 VAL 51 -12.167 8.068 14.994 431 2HG1 VAL 51 HG12 VAL 51 -13.068 7.704 13.522 432 3HG1 VAL 51 HG13 VAL 51 -11.510 6.931 13.816 433 1HG2 VAL 51 HG21 VAL 51 -12.442 10.629 12.336 434 2HG2 VAL 51 HG22 VAL 51 -11.869 9.425 11.182 435 3HG2 VAL 51 HG23 VAL 51 -13.262 9.073 12.203 436 H GLU 52 H GLU 52 -10.970 8.942 16.519 437 HA GLU 52 HA GLU 52 -8.022 9.145 16.809 438 1HB GLU 52 HB2 GLU 52 -10.301 8.597 18.704 439 2HB GLU 52 HB3 GLU 52 -8.645 8.181 19.152 440 1HG GLU 52 HG2 GLU 52 -8.651 10.820 18.030 441 2HG GLU 52 HG3 GLU 52 -9.894 10.736 19.279 442 H LYS 53 H LYS 53 -10.449 6.898 15.937 443 HA LYS 53 HA LYS 53 -9.112 4.491 16.846 444 1HB LYS 53 HB2 LYS 53 -11.377 5.115 14.982 445 2HB LYS 53 HB3 LYS 53 -10.654 3.507 14.939 446 1HG LYS 53 HG2 LYS 53 -12.336 3.246 16.546 447 2HG LYS 53 HG3 LYS 53 -10.923 3.599 17.541 448 1HD LYS 53 HD2 LYS 53 -12.558 5.057 18.402 449 2HD LYS 53 HD3 LYS 53 -11.647 6.085 17.295 450 1HE LYS 53 HE2 LYS 53 -13.319 5.727 15.543 451 2HE LYS 53 HE3 LYS 53 -14.213 4.630 16.593 452 1HZ LYS 53 HZ1 LYS 53 -13.613 7.332 17.560 453 2HZ LYS 53 HZ2 LYS 53 -14.859 7.138 16.426 454 3HZ LYS 53 HZ3 LYS 53 -14.935 6.325 17.915 455 H TYR 54 H TYR 54 -6.984 4.414 16.101 456 HA TYR 54 HA TYR 54 -5.216 4.313 14.540 457 1HB TYR 54 HB2 TYR 54 -7.330 2.901 12.889 458 2HB TYR 54 HB3 TYR 54 -5.583 2.672 12.805 459 HD1 TYR 54 HD1 TYR 54 -4.430 2.025 15.111 460 HD2 TYR 54 HD2 TYR 54 -8.585 1.431 14.197 461 HE1 TYR 54 HE1 TYR 54 -4.569 0.289 16.877 462 HE2 TYR 54 HE2 TYR 54 -8.725 -0.305 15.964 463 HH TYR 54 HH TYR 54 -7.525 -1.609 17.357 464 H GLY 55 H GLY 55 -7.020 6.676 14.335 465 1HA GLY 55 HA2 GLY 55 -7.495 7.251 11.550 466 2HA GLY 55 HA3 GLY 55 -7.446 8.446 12.846 467 HA PRO 56 HA PRO 56 -3.554 9.823 11.315 468 1HB PRO 56 HB2 PRO 56 -2.609 11.009 13.588 469 2HB PRO 56 HB3 PRO 56 -3.925 11.694 12.619 470 1HG PRO 56 HG2 PRO 56 -4.060 10.233 15.220 471 2HG PRO 56 HG3 PRO 56 -5.084 11.544 14.611 472 1HD PRO 56 HD2 PRO 56 -5.791 8.841 14.618 473 2HD PRO 56 HD3 PRO 56 -6.541 10.088 13.597 474 H GLU 57 H GLU 57 -2.692 7.576 11.097 475 HA GLU 57 HA GLU 57 -0.362 7.179 12.827 476 1HB GLU 57 HB2 GLU 57 -2.714 5.907 13.583 477 2HB GLU 57 HB3 GLU 57 -1.858 4.670 12.663 478 1HG GLU 57 HG2 GLU 57 0.211 5.316 14.054 479 2HG GLU 57 HG3 GLU 57 -0.918 6.158 15.116 480 H ALA 58 H ALA 58 -2.433 5.474 10.451 481 HA ALA 58 HA ALA 58 -0.279 4.060 9.210 482 1HB ALA 58 HB1 ALA 58 -3.074 4.796 8.381 483 2HB ALA 58 HB2 ALA 58 -1.975 4.070 7.207 484 3HB ALA 58 HB3 ALA 58 -2.389 3.199 8.683 485 H SER 59 H SER 59 -1.672 7.260 8.631 486 HA SER 59 HA SER 59 -0.301 7.783 6.166 487 1HB SER 59 HB2 SER 59 -2.076 9.259 6.659 488 2HB SER 59 HB3 SER 59 -1.512 9.531 8.306 489 HG SER 59 HG SER 59 0.130 10.211 6.129 490 H ALA 60 H ALA 60 0.541 8.512 9.560 491 HA ALA 60 HA ALA 60 2.993 9.860 8.984 492 1HB ALA 60 HB1 ALA 60 2.174 8.261 11.428 493 2HB ALA 60 HB2 ALA 60 3.575 9.329 11.348 494 3HB ALA 60 HB3 ALA 60 1.949 9.995 11.191 495 H PHE 61 H PHE 61 2.179 6.450 9.198 496 HA PHE 61 HA PHE 61 4.864 5.458 9.433 497 1HB PHE 61 HB2 PHE 61 2.619 4.192 9.741 498 2HB PHE 61 HB3 PHE 61 2.663 3.993 7.988 499 HD1 PHE 61 HD1 PHE 61 4.419 2.666 6.905 500 HD2 PHE 61 HD2 PHE 61 4.255 3.094 11.176 501 HE1 PHE 61 HE1 PHE 61 6.019 0.787 7.156 502 HE2 PHE 61 HE2 PHE 61 5.855 1.215 11.426 503 HZ PHE 61 HZ PHE 61 6.737 0.062 9.416 504 H THR 62 H THR 62 2.742 5.521 6.565 505 HA THR 62 HA THR 62 4.948 5.038 4.752 506 HB THR 62 HB THR 62 2.238 6.194 4.054 507 HG1 THR 62 HG1 THR 62 3.030 3.489 4.360 508 1HG2 THR 62 HG21 THR 62 4.536 5.076 2.580 509 2HG2 THR 62 HG22 THR 62 2.965 4.441 2.089 510 3HG2 THR 62 HG23 THR 62 3.271 6.176 2.031 511 H LYS 63 H LYS 63 3.902 7.810 6.406 512 HA LYS 63 HA LYS 63 4.584 9.770 4.369 513 1HB LYS 63 HB2 LYS 63 3.033 10.303 6.223 514 2HB LYS 63 HB3 LYS 63 4.355 10.097 7.374 515 1HG LYS 63 HG2 LYS 63 5.087 11.894 5.198 516 2HG LYS 63 HG3 LYS 63 3.666 12.467 6.071 517 1HD LYS 63 HD2 LYS 63 5.232 11.691 8.154 518 2HD LYS 63 HD3 LYS 63 6.466 12.191 6.997 519 1HE LYS 63 HE2 LYS 63 4.291 13.824 8.265 520 2HE LYS 63 HE3 LYS 63 5.999 14.211 8.062 521 1HZ LYS 63 HZ1 LYS 63 5.396 14.100 5.558 522 2HZ LYS 63 HZ2 LYS 63 3.814 14.368 6.105 523 3HZ LYS 63 HZ3 LYS 63 5.034 15.500 6.452 524 H LYS 64 H LYS 64 6.183 8.748 7.390 525 HA LYS 64 HA LYS 64 8.638 10.154 6.715 526 1HB LYS 64 HB2 LYS 64 7.853 8.182 8.860 527 2HB LYS 64 HB3 LYS 64 9.529 8.700 8.666 528 1HG LYS 64 HG2 LYS 64 9.110 10.708 9.604 529 2HG LYS 64 HG3 LYS 64 7.682 10.955 8.600 530 1HD LYS 64 HD2 LYS 64 6.387 10.551 10.394 531 2HD LYS 64 HD3 LYS 64 7.027 8.907 10.450 532 1HE LYS 64 HE2 LYS 64 7.325 10.332 12.570 533 2HE LYS 64 HE3 LYS 64 8.763 9.519 11.953 534 1HZ LYS 64 HZ1 LYS 64 8.384 12.074 10.745 535 2HZ LYS 64 HZ2 LYS 64 8.491 12.199 12.433 536 3HZ LYS 64 HZ3 LYS 64 9.742 11.454 11.557 537 H MET 65 H MET 65 7.417 6.875 6.338 538 HA MET 65 HA MET 65 9.882 5.581 5.730 539 1HB MET 65 HB2 MET 65 7.386 4.677 6.039 540 2HB MET 65 HB3 MET 65 7.408 4.760 4.278 541 1HG MET 65 HG2 MET 65 8.982 3.100 4.080 542 2HG MET 65 HG3 MET 65 9.786 3.540 5.586 543 1HE MET 65 HE1 MET 65 6.538 2.537 4.075 544 2HE MET 65 HE2 MET 65 5.794 1.351 5.156 545 3HE MET 65 HE3 MET 65 5.780 3.061 5.577 546 H VAL 66 H VAL 66 7.450 6.993 3.532 547 HA VAL 66 HA VAL 66 9.168 6.645 1.205 548 HB VAL 66 HB VAL 66 7.430 7.830 -0.008 549 1HG1 VAL 66 HG11 VAL 66 6.474 5.919 2.126 550 2HG1 VAL 66 HG12 VAL 66 5.380 6.550 0.895 551 3HG1 VAL 66 HG13 VAL 66 6.781 5.590 0.422 552 1HG2 VAL 66 HG21 VAL 66 6.784 8.811 2.737 553 2HG2 VAL 66 HG22 VAL 66 6.749 9.675 1.199 554 3HG2 VAL 66 HG23 VAL 66 5.437 8.576 1.624 555 H GLU 67 H GLU 67 8.831 9.028 3.675 556 HA GLU 67 HA GLU 67 9.862 11.266 2.136 557 1HB GLU 67 HB2 GLU 67 9.242 10.715 5.002 558 2HB GLU 67 HB3 GLU 67 10.382 12.017 4.656 559 1HG GLU 67 HG2 GLU 67 8.182 12.219 2.828 560 2HG GLU 67 HG3 GLU 67 7.544 12.094 4.468 561 H ASN 68 H ASN 68 11.275 8.695 4.086 562 HA ASN 68 HA ASN 68 13.964 9.924 3.707 563 1HB ASN 68 HB2 ASN 68 12.967 7.718 5.525 564 2HB ASN 68 HB3 ASN 68 14.677 8.104 5.332 565 1HD2 ASN 68 HD21 ASN 68 12.038 8.782 7.276 566 2HD2 ASN 68 HD22 ASN 68 12.524 10.294 7.875 567 H ALA 69 H ALA 69 11.925 7.547 2.389 568 HA ALA 69 HA ALA 69 13.746 5.491 1.679 569 1HB ALA 69 HB1 ALA 69 11.250 6.572 0.374 570 2HB ALA 69 HB2 ALA 69 12.174 5.270 -0.374 571 3HB ALA 69 HB3 ALA 69 11.472 5.044 1.227 572 H LYS 70 H LYS 70 15.749 6.148 0.912 573 HA LYS 70 HA LYS 70 16.117 8.341 -0.920 574 1HB LYS 70 HB2 LYS 70 18.069 6.064 -0.756 575 2HB LYS 70 HB3 LYS 70 18.384 7.796 -0.870 576 1HG LYS 70 HG2 LYS 70 16.976 7.567 1.510 577 2HG LYS 70 HG3 LYS 70 18.002 6.131 1.507 578 1HD LYS 70 HD2 LYS 70 19.373 8.583 0.625 579 2HD LYS 70 HD3 LYS 70 18.823 8.631 2.300 580 1HE LYS 70 HE2 LYS 70 21.100 7.692 2.150 581 2HE LYS 70 HE3 LYS 70 19.957 6.482 2.736 582 1HZ LYS 70 HZ1 LYS 70 19.998 6.396 -0.065 583 2HZ LYS 70 HZ2 LYS 70 21.603 6.348 0.485 584 3HZ LYS 70 HZ3 LYS 70 20.484 5.195 1.036 585 H LYS 71 H LYS 71 15.233 5.013 -1.335 586 HA LYS 71 HA LYS 71 15.377 5.415 -4.293 587 1HB LYS 71 HB2 LYS 71 16.023 2.890 -2.741 588 2HB LYS 71 HB3 LYS 71 15.902 2.984 -4.498 589 1HG LYS 71 HG2 LYS 71 17.622 5.084 -3.475 590 2HG LYS 71 HG3 LYS 71 18.186 3.500 -2.943 591 1HD LYS 71 HD2 LYS 71 18.988 3.071 -4.999 592 2HD LYS 71 HD3 LYS 71 17.382 3.306 -5.689 593 1HE LYS 71 HE2 LYS 71 17.832 5.806 -5.600 594 2HE LYS 71 HE3 LYS 71 19.505 5.410 -5.210 595 1HZ LYS 71 HZ1 LYS 71 19.124 3.844 -7.313 596 2HZ LYS 71 HZ2 LYS 71 18.061 5.108 -7.714 597 3HZ LYS 71 HZ3 LYS 71 19.702 5.436 -7.440 598 H ILE 72 H ILE 72 13.390 5.241 -5.188 599 HA ILE 72 HA ILE 72 11.391 3.472 -3.842 600 HB ILE 72 HB ILE 72 10.899 6.195 -5.091 601 1HG1 ILE 72 HG12 ILE 72 9.969 5.886 -2.389 602 2HG1 ILE 72 HG13 ILE 72 11.665 5.408 -2.462 603 1HG2 ILE 72 HG21 ILE 72 9.177 3.999 -4.950 604 2HG2 ILE 72 HG22 ILE 72 8.729 4.988 -3.561 605 3HG2 ILE 72 HG23 ILE 72 8.702 5.681 -5.182 606 1HD1 ILE 72 HD11 ILE 72 11.689 7.656 -4.016 607 2HD1 ILE 72 HD12 ILE 72 10.443 8.070 -2.839 608 3HD1 ILE 72 HD13 ILE 72 12.065 7.642 -2.294 609 H GLU 73 H GLU 73 10.562 1.968 -5.229 610 HA GLU 73 HA GLU 73 10.630 2.583 -8.150 611 1HB GLU 73 HB2 GLU 73 11.214 -0.180 -7.100 612 2HB GLU 73 HB3 GLU 73 11.592 0.500 -8.682 613 1HG GLU 73 HG2 GLU 73 12.959 2.213 -7.069 614 2HG GLU 73 HG3 GLU 73 13.075 0.724 -6.130 615 H VAL 74 H VAL 74 8.938 1.611 -9.357 616 HA VAL 74 HA VAL 74 6.731 0.478 -7.690 617 HB VAL 74 HB VAL 74 5.198 1.360 -9.392 618 1HG1 VAL 74 HG11 VAL 74 6.514 2.821 -7.512 619 2HG1 VAL 74 HG12 VAL 74 6.920 3.733 -8.966 620 3HG1 VAL 74 HG13 VAL 74 5.231 3.475 -8.529 621 1HG2 VAL 74 HG21 VAL 74 7.779 1.848 -10.801 622 2HG2 VAL 74 HG22 VAL 74 6.212 1.379 -11.458 623 3HG2 VAL 74 HG23 VAL 74 6.515 3.058 -11.013 624 H GLU 75 H GLU 75 5.775 -1.450 -8.381 625 HA GLU 75 HA GLU 75 7.036 -2.724 -10.778 626 1HB GLU 75 HB2 GLU 75 7.563 -3.728 -8.477 627 2HB GLU 75 HB3 GLU 75 5.869 -4.223 -8.426 628 1HG GLU 75 HG2 GLU 75 6.131 -5.524 -10.458 629 2HG GLU 75 HG3 GLU 75 7.777 -4.927 -10.675 630 H PHE 76 H PHE 76 5.421 -2.177 -12.271 631 HA PHE 76 HA PHE 76 2.613 -2.300 -11.757 632 1HB PHE 76 HB2 PHE 76 4.201 -2.512 -14.328 633 2HB PHE 76 HB3 PHE 76 2.440 -2.446 -14.284 634 HD1 PHE 76 HD1 PHE 76 1.352 -0.467 -13.024 635 HD2 PHE 76 HD2 PHE 76 5.466 -0.527 -14.255 636 HE1 PHE 76 HE1 PHE 76 1.445 2.005 -12.830 637 HE2 PHE 76 HE2 PHE 76 5.561 1.944 -14.062 638 HZ PHE 76 HZ PHE 76 3.551 3.210 -13.349 639 H ASP 77 H ASP 77 1.314 -4.054 -11.521 640 HA ASP 77 HA ASP 77 2.390 -6.732 -11.686 641 1HB ASP 77 HB2 ASP 77 0.185 -5.547 -10.479 642 2HB ASP 77 HB3 ASP 77 -0.530 -6.555 -11.737 643 H LYS 78 H LYS 78 0.925 -8.416 -12.977 644 HA LYS 78 HA LYS 78 1.228 -7.699 -15.795 645 1HB LYS 78 HB2 LYS 78 0.604 -10.010 -16.237 646 2HB LYS 78 HB3 LYS 78 1.751 -9.980 -14.897 647 1HG LYS 78 HG2 LYS 78 -0.818 -9.681 -13.748 648 2HG LYS 78 HG3 LYS 78 -0.951 -10.983 -14.932 649 1HD LYS 78 HD2 LYS 78 1.483 -11.042 -13.243 650 2HD LYS 78 HD3 LYS 78 -0.034 -11.353 -12.399 651 1HE LYS 78 HE2 LYS 78 -0.038 -13.448 -13.215 652 2HE LYS 78 HE3 LYS 78 -0.133 -12.792 -14.849 653 1HZ LYS 78 HZ1 LYS 78 2.416 -13.050 -13.361 654 2HZ LYS 78 HZ2 LYS 78 1.819 -14.266 -14.385 655 3HZ LYS 78 HZ3 LYS 78 2.205 -12.736 -15.015 656 H GLY 79 H GLY 79 -1.173 -7.113 -13.570 657 1HA GLY 79 HA2 GLY 79 -3.419 -7.552 -15.448 658 2HA GLY 79 HA3 GLY 79 -3.563 -7.006 -13.777 659 H GLN 80 H GLN 80 -4.980 -5.292 -14.631 660 HA GLN 80 HA GLN 80 -4.258 -3.363 -16.549 661 1HB GLN 80 HB2 GLN 80 -5.720 -2.694 -13.986 662 2HB GLN 80 HB3 GLN 80 -5.915 -1.948 -15.573 663 1HG GLN 80 HG2 GLN 80 -6.453 -4.534 -16.197 664 2HG GLN 80 HG3 GLN 80 -7.030 -4.490 -14.531 665 1HE2 GLN 80 HE21 GLN 80 -9.288 -4.634 -15.326 666 2HE2 GLN 80 HE22 GLN 80 -10.045 -3.274 -16.005 667 H ARG 81 H ARG 81 -3.670 -1.005 -15.979 668 HA ARG 81 HA ARG 81 -1.494 -1.026 -13.924 669 1HB ARG 81 HB2 ARG 81 -1.620 0.104 -16.701 670 2HB ARG 81 HB3 ARG 81 -0.612 0.905 -15.495 671 1HG ARG 81 HG2 ARG 81 0.722 -1.030 -15.165 672 2HG ARG 81 HG3 ARG 81 -0.446 -2.071 -15.979 673 1HD ARG 81 HD2 ARG 81 1.453 -1.630 -17.465 674 2HD ARG 81 HD3 ARG 81 -0.004 -0.873 -18.108 675 HE ARG 81 HE ARG 81 0.893 1.274 -17.022 676 1HH1 ARG 81 HH11 ARG 81 3.149 -1.201 -16.789 677 2HH1 ARG 81 HH12 ARG 81 4.452 -0.319 -17.513 678 1HH2 ARG 81 HH21 ARG 81 2.464 2.357 -18.467 679 2HH2 ARG 81 HH22 ARG 81 4.064 1.693 -18.465 680 H THR 82 H THR 82 -4.501 0.215 -14.639 681 HA THR 82 HA THR 82 -4.125 2.388 -12.676 682 HB THR 82 HB THR 82 -5.074 4.105 -14.114 683 HG1 THR 82 HG1 THR 82 -5.081 3.159 -16.484 684 1HG2 THR 82 HG21 THR 82 -2.601 3.610 -14.220 685 2HG2 THR 82 HG22 THR 82 -2.917 2.656 -15.670 686 3HG2 THR 82 HG23 THR 82 -3.248 4.389 -15.664 687 H ASP 83 H ASP 83 -5.917 2.530 -11.385 688 HA ASP 83 HA ASP 83 -8.154 0.720 -11.899 689 1HB ASP 83 HB2 ASP 83 -9.035 1.823 -9.743 690 2HB ASP 83 HB3 ASP 83 -7.535 0.904 -9.612 691 H LYS 84 H LYS 84 -10.442 1.851 -11.318 692 HA LYS 84 HA LYS 84 -11.017 3.578 -13.546 693 1HB LYS 84 HB2 LYS 84 -13.276 3.775 -12.478 694 2HB LYS 84 HB3 LYS 84 -12.739 2.105 -12.665 695 1HG LYS 84 HG2 LYS 84 -11.712 2.673 -10.213 696 2HG LYS 84 HG3 LYS 84 -13.154 3.689 -10.196 697 1HD LYS 84 HD2 LYS 84 -13.532 0.939 -11.242 698 2HD LYS 84 HD3 LYS 84 -13.182 1.061 -9.517 699 1HE LYS 84 HE2 LYS 84 -15.002 2.952 -9.558 700 2HE LYS 84 HE3 LYS 84 -15.512 2.171 -11.055 701 1HZ LYS 84 HZ1 LYS 84 -15.196 0.813 -8.433 702 2HZ LYS 84 HZ2 LYS 84 -16.675 1.279 -9.125 703 3HZ LYS 84 HZ3 LYS 84 -15.723 0.087 -9.872 704 H TYR 85 H TYR 85 -10.146 4.171 -10.209 705 HA TYR 85 HA TYR 85 -11.095 6.888 -10.068 706 1HB TYR 85 HB2 TYR 85 -9.057 5.284 -8.535 707 2HB TYR 85 HB3 TYR 85 -9.223 7.018 -8.254 708 HD1 TYR 85 HD1 TYR 85 -11.227 3.863 -8.447 709 HD2 TYR 85 HD2 TYR 85 -10.907 7.828 -6.829 710 HE1 TYR 85 HE1 TYR 85 -13.212 3.441 -7.024 711 HE2 TYR 85 HE2 TYR 85 -12.892 7.406 -5.403 712 HH TYR 85 HH TYR 85 -15.002 5.711 -5.645 713 H GLY 86 H GLY 86 -8.666 5.492 -11.933 714 1HA GLY 86 HA2 GLY 86 -7.241 6.599 -13.474 715 2HA GLY 86 HA3 GLY 86 -7.674 8.136 -12.725 716 H ARG 87 H ARG 87 -6.537 5.390 -10.850 717 HA ARG 87 HA ARG 87 -4.064 6.958 -10.247 718 1HB ARG 87 HB2 ARG 87 -5.309 4.802 -8.524 719 2HB ARG 87 HB3 ARG 87 -4.064 5.963 -8.063 720 1HG ARG 87 HG2 ARG 87 -5.654 7.813 -8.348 721 2HG ARG 87 HG3 ARG 87 -6.902 6.676 -8.855 722 1HD ARG 87 HD2 ARG 87 -5.557 6.790 -6.143 723 2HD ARG 87 HD3 ARG 87 -7.235 7.195 -6.505 724 HE ARG 87 HE ARG 87 -6.184 4.422 -6.895 725 1HH1 ARG 87 HH11 ARG 87 -8.008 6.511 -4.942 726 2HH1 ARG 87 HH12 ARG 87 -9.334 5.417 -4.734 727 1HH2 ARG 87 HH21 ARG 87 -8.102 3.079 -6.980 728 2HH2 ARG 87 HH22 ARG 87 -9.388 3.474 -5.888 729 H GLY 88 H GLY 88 -2.093 5.674 -9.901 730 1HA GLY 88 HA2 GLY 88 -1.937 3.457 -11.827 731 2HA GLY 88 HA3 GLY 88 -0.573 4.205 -10.995 732 H LEU 89 H LEU 89 -1.633 1.312 -11.295 733 HA LEU 89 HA LEU 89 -1.682 0.658 -8.377 734 1HB LEU 89 HB2 LEU 89 -2.748 -0.851 -10.779 735 2HB LEU 89 HB3 LEU 89 -2.623 -1.558 -9.167 736 HG LEU 89 HG LEU 89 -4.209 0.917 -9.910 737 1HD1 LEU 89 HD11 LEU 89 -4.874 -1.761 -10.206 738 2HD1 LEU 89 HD12 LEU 89 -5.578 -1.342 -8.645 739 3HD1 LEU 89 HD13 LEU 89 -6.022 -0.429 -10.086 740 1HD2 LEU 89 HD21 LEU 89 -3.306 -0.244 -7.333 741 2HD2 LEU 89 HD22 LEU 89 -3.748 1.418 -7.724 742 3HD2 LEU 89 HD23 LEU 89 -5.006 0.223 -7.404 743 H ALA 90 H ALA 90 0.224 -0.125 -7.650 744 HA ALA 90 HA ALA 90 1.653 -2.226 -9.020 745 1HB ALA 90 HB1 ALA 90 2.747 0.592 -9.156 746 2HB ALA 90 HB2 ALA 90 3.780 -0.828 -9.316 747 3HB ALA 90 HB3 ALA 90 2.493 -0.538 -10.486 748 H TYR 91 H TYR 91 3.461 -2.994 -7.721 749 HA TYR 91 HA TYR 91 3.072 -2.485 -4.878 750 1HB TYR 91 HB2 TYR 91 5.218 -4.113 -6.277 751 2HB TYR 91 HB3 TYR 91 4.805 -4.187 -4.562 752 HD1 TYR 91 HD1 TYR 91 2.429 -4.866 -3.910 753 HD2 TYR 91 HD2 TYR 91 4.011 -5.383 -7.871 754 HE1 TYR 91 HE1 TYR 91 0.642 -6.512 -4.409 755 HE2 TYR 91 HE2 TYR 91 2.225 -7.030 -8.369 756 HH TYR 91 HH TYR 91 -0.521 -7.380 -6.511 757 H ILE 92 H ILE 92 4.116 -0.945 -3.715 758 HA ILE 92 HA ILE 92 6.318 0.553 -5.000 759 HB ILE 92 HB ILE 92 4.945 1.052 -2.343 760 1HG1 ILE 92 HG12 ILE 92 4.360 2.071 -5.138 761 2HG1 ILE 92 HG13 ILE 92 3.275 1.163 -4.084 762 1HG2 ILE 92 HG21 ILE 92 7.289 2.080 -3.137 763 2HG2 ILE 92 HG22 ILE 92 6.216 3.180 -4.004 764 3HG2 ILE 92 HG23 ILE 92 6.106 3.039 -2.248 765 1HD1 ILE 92 HD11 ILE 92 3.734 3.180 -2.426 766 2HD1 ILE 92 HD12 ILE 92 4.114 4.033 -3.922 767 3HD1 ILE 92 HD13 ILE 92 2.516 3.319 -3.693 768 H TYR 93 H TYR 93 8.429 0.544 -4.237 769 HA TYR 93 HA TYR 93 8.984 -1.113 -1.812 770 1HB TYR 93 HB2 TYR 93 10.452 -1.184 -4.465 771 2HB TYR 93 HB3 TYR 93 11.023 -1.970 -2.993 772 HD1 TYR 93 HD1 TYR 93 9.811 -3.880 -2.027 773 HD2 TYR 93 HD2 TYR 93 8.535 -2.039 -5.691 774 HE1 TYR 93 HE1 TYR 93 8.367 -5.837 -2.507 775 HE2 TYR 93 HE2 TYR 93 7.089 -3.995 -6.171 776 HH TYR 93 HH TYR 93 6.272 -5.912 -5.386 777 H ALA 94 H ALA 94 10.166 0.029 -0.356 778 HA ALA 94 HA ALA 94 11.852 2.275 -1.392 779 1HB ALA 94 HB1 ALA 94 9.718 2.315 0.518 780 2HB ALA 94 HB2 ALA 94 11.222 2.680 1.361 781 3HB ALA 94 HB3 ALA 94 10.726 3.658 -0.019 782 H ASP 95 H ASP 95 13.974 2.268 -0.728 783 HA ASP 95 HA ASP 95 15.941 1.516 0.301 784 1HB ASP 95 HB2 ASP 95 13.940 0.735 2.442 785 2HB ASP 95 HB3 ASP 95 15.686 0.591 2.638 786 H GLY 96 H GLY 96 14.499 -0.193 -1.570 787 1HA GLY 96 HA2 GLY 96 14.721 -2.376 -2.403 788 2HA GLY 96 HA3 GLY 96 15.962 -2.633 -1.176 789 H LYS 97 H LYS 97 12.885 -1.559 -0.045 790 HA LYS 97 HA LYS 97 12.220 -4.364 0.760 791 1HB LYS 97 HB2 LYS 97 13.111 -2.613 2.548 792 2HB LYS 97 HB3 LYS 97 11.441 -2.049 2.492 793 1HG LYS 97 HG2 LYS 97 10.648 -3.906 3.538 794 2HG LYS 97 HG3 LYS 97 11.731 -4.981 2.652 795 1HD LYS 97 HD2 LYS 97 12.800 -5.171 4.653 796 2HD LYS 97 HD3 LYS 97 13.512 -3.618 4.212 797 1HE LYS 97 HE2 LYS 97 12.648 -2.974 6.231 798 2HE LYS 97 HE3 LYS 97 11.181 -2.758 5.279 799 1HZ LYS 97 HZ1 LYS 97 11.922 -5.214 6.778 800 2HZ LYS 97 HZ2 LYS 97 10.765 -4.069 7.264 801 3HZ LYS 97 HZ3 LYS 97 10.508 -4.999 5.867 802 H MET 98 H MET 98 9.868 -4.674 1.186 803 HA MET 98 HA MET 98 8.286 -3.156 -0.793 804 1HB MET 98 HB2 MET 98 8.192 -5.668 -0.657 805 2HB MET 98 HB3 MET 98 7.427 -5.500 0.923 806 1HG MET 98 HG2 MET 98 5.447 -4.752 0.042 807 2HG MET 98 HG3 MET 98 6.238 -3.917 -1.295 808 1HE MET 98 HE1 MET 98 7.254 -7.438 -0.266 809 2HE MET 98 HE2 MET 98 5.559 -7.453 0.240 810 3HE MET 98 HE3 MET 98 6.100 -8.501 -1.069 811 H VAL 99 H VAL 99 7.020 -1.479 -0.188 812 HA VAL 99 HA VAL 99 6.730 -0.699 2.574 813 HB VAL 99 HB VAL 99 5.105 0.232 0.189 814 1HG1 VAL 99 HG11 VAL 99 5.065 0.873 2.976 815 2HG1 VAL 99 HG12 VAL 99 5.700 2.267 2.102 816 3HG1 VAL 99 HG13 VAL 99 4.123 1.603 1.677 817 1HG2 VAL 99 HG21 VAL 99 7.822 1.067 1.233 818 2HG2 VAL 99 HG22 VAL 99 7.411 0.526 -0.394 819 3HG2 VAL 99 HG23 VAL 99 6.849 2.096 0.181 820 H ASN 100 H ASN 100 4.569 -2.259 0.226 821 HA ASN 100 HA ASN 100 2.186 -2.288 1.709 822 1HB ASN 100 HB2 ASN 100 3.286 -4.538 -0.004 823 2HB ASN 100 HB3 ASN 100 1.595 -4.308 0.442 824 1HD2 ASN 100 HD21 ASN 100 0.397 -3.259 -1.142 825 2HD2 ASN 100 HD22 ASN 100 1.021 -2.153 -2.270 826 H GLU 101 H GLU 101 4.975 -4.489 1.928 827 HA GLU 101 HA GLU 101 3.745 -6.162 3.955 828 1HB GLU 101 HB2 GLU 101 5.709 -6.740 2.366 829 2HB GLU 101 HB3 GLU 101 6.718 -5.883 3.532 830 1HG GLU 101 HG2 GLU 101 4.804 -8.020 4.448 831 2HG GLU 101 HG3 GLU 101 6.399 -8.450 3.829 832 H ALA 102 H ALA 102 5.734 -3.262 3.980 833 HA ALA 102 HA ALA 102 6.571 -3.311 6.691 834 1HB ALA 102 HB1 ALA 102 6.671 -1.483 4.553 835 2HB ALA 102 HB2 ALA 102 5.848 -0.633 5.861 836 3HB ALA 102 HB3 ALA 102 7.453 -1.317 6.125 837 H LEU 103 H LEU 103 3.700 -1.720 5.288 838 HA LEU 103 HA LEU 103 2.571 -0.970 7.809 839 1HB LEU 103 HB2 LEU 103 1.347 -1.400 5.075 840 2HB LEU 103 HB3 LEU 103 0.410 -0.835 6.459 841 HG LEU 103 HG LEU 103 2.961 0.593 5.991 842 1HD1 LEU 103 HD11 LEU 103 0.807 0.397 3.943 843 2HD1 LEU 103 HD12 LEU 103 1.443 2.007 4.275 844 3HD1 LEU 103 HD13 LEU 103 2.527 0.724 3.738 845 1HD2 LEU 103 HD21 LEU 103 0.897 1.004 7.626 846 2HD2 LEU 103 HD22 LEU 103 1.792 2.358 6.936 847 3HD2 LEU 103 HD23 LEU 103 0.258 1.860 6.223 848 H VAL 104 H VAL 104 1.847 -3.755 5.669 849 HA VAL 104 HA VAL 104 -0.107 -4.962 7.321 850 HB VAL 104 HB VAL 104 1.949 -6.226 5.485 851 1HG1 VAL 104 HG11 VAL 104 -0.392 -7.398 6.998 852 2HG1 VAL 104 HG12 VAL 104 0.243 -8.150 5.535 853 3HG1 VAL 104 HG13 VAL 104 1.275 -7.974 6.954 854 1HG2 VAL 104 HG21 VAL 104 -0.876 -5.222 5.209 855 2HG2 VAL 104 HG22 VAL 104 0.507 -4.944 4.149 856 3HG2 VAL 104 HG23 VAL 104 -0.296 -6.514 4.158 857 H ARG 105 H ARG 105 3.338 -4.726 7.696 858 HA ARG 105 HA ARG 105 3.588 -6.909 9.601 859 1HB ARG 105 HB2 ARG 105 5.521 -6.048 8.293 860 2HB ARG 105 HB3 ARG 105 5.400 -4.515 9.158 861 1HG ARG 105 HG2 ARG 105 6.077 -5.459 11.193 862 2HG ARG 105 HG3 ARG 105 5.637 -7.092 10.692 863 1HD ARG 105 HD2 ARG 105 7.478 -6.912 8.937 864 2HD ARG 105 HD3 ARG 105 8.005 -5.452 9.772 865 HE ARG 105 HE ARG 105 7.758 -7.956 11.352 866 1HH1 ARG 105 HH11 ARG 105 9.837 -6.131 9.372 867 2HH1 ARG 105 HH12 ARG 105 11.192 -6.223 10.446 868 1HH2 ARG 105 HH21 ARG 105 9.421 -7.809 12.970 869 2HH2 ARG 105 HH22 ARG 105 10.958 -7.173 12.484 870 H GLN 106 H GLN 106 3.139 -3.392 9.806 871 HA GLN 106 HA GLN 106 3.089 -3.511 12.756 872 1HB GLN 106 HB2 GLN 106 3.148 -1.377 10.685 873 2HB GLN 106 HB3 GLN 106 2.320 -0.983 12.192 874 1HG GLN 106 HG2 GLN 106 4.454 -0.419 12.833 875 2HG GLN 106 HG3 GLN 106 4.519 -2.140 13.219 876 1HE2 GLN 106 HE21 GLN 106 6.909 -1.992 12.792 877 2HE2 GLN 106 HE22 GLN 106 7.467 -2.019 11.189 878 H GLY 107 H GLY 107 0.974 -4.544 10.596 879 1HA GLY 107 HA2 GLY 107 -1.358 -4.790 10.545 880 2HA GLY 107 HA3 GLY 107 -1.292 -4.497 12.282 881 H LEU 108 H LEU 108 -0.448 -2.318 9.589 882 HA LEU 108 HA LEU 108 -2.415 -0.378 10.723 883 1HB LEU 108 HB2 LEU 108 0.076 0.050 9.047 884 2HB LEU 108 HB3 LEU 108 -1.060 1.334 9.462 885 HG LEU 108 HG LEU 108 0.368 -0.404 11.494 886 1HD1 LEU 108 HD11 LEU 108 1.509 1.570 9.941 887 2HD1 LEU 108 HD12 LEU 108 0.998 2.465 11.372 888 3HD1 LEU 108 HD13 LEU 108 2.081 1.082 11.536 889 1HD2 LEU 108 HD21 LEU 108 -1.921 1.259 11.665 890 2HD2 LEU 108 HD22 LEU 108 -1.025 0.530 12.997 891 3HD2 LEU 108 HD23 LEU 108 -0.603 2.146 12.430 892 H ALA 109 H ALA 109 -1.995 -2.531 8.192 893 HA ALA 109 HA ALA 109 -4.062 -1.095 6.596 894 1HB ALA 109 HB1 ALA 109 -1.691 -0.880 5.616 895 2HB ALA 109 HB2 ALA 109 -1.792 -2.611 5.298 896 3HB ALA 109 HB3 ALA 109 -2.938 -1.506 4.538 897 H LYS 110 H LYS 110 -5.449 -2.546 5.399 898 HA LYS 110 HA LYS 110 -5.303 -5.367 6.386 899 1HB LYS 110 HB2 LYS 110 -7.662 -3.597 5.711 900 2HB LYS 110 HB3 LYS 110 -7.814 -5.346 5.882 901 1HG LYS 110 HG2 LYS 110 -8.048 -5.006 8.100 902 2HG LYS 110 HG3 LYS 110 -6.344 -4.553 8.127 903 1HD LYS 110 HD2 LYS 110 -6.817 -2.352 8.389 904 2HD LYS 110 HD3 LYS 110 -8.109 -2.400 7.189 905 1HE LYS 110 HE2 LYS 110 -8.524 -3.712 9.859 906 2HE LYS 110 HE3 LYS 110 -8.704 -1.963 9.711 907 1HZ LYS 110 HZ1 LYS 110 -10.087 -3.920 7.963 908 2HZ LYS 110 HZ2 LYS 110 -10.785 -3.236 9.352 909 3HZ LYS 110 HZ3 LYS 110 -10.357 -2.245 8.044 910 H VAL 111 H VAL 111 -5.064 -6.923 4.844 911 HA VAL 111 HA VAL 111 -4.663 -6.233 2.084 912 HB VAL 111 HB VAL 111 -5.118 -8.908 3.438 913 1HG1 VAL 111 HG11 VAL 111 -5.062 -8.185 0.625 914 2HG1 VAL 111 HG12 VAL 111 -3.729 -9.267 1.025 915 3HG1 VAL 111 HG13 VAL 111 -5.391 -9.751 1.364 916 1HG2 VAL 111 HG21 VAL 111 -2.886 -7.112 3.252 917 2HG2 VAL 111 HG22 VAL 111 -2.956 -8.692 4.033 918 3HG2 VAL 111 HG23 VAL 111 -2.513 -8.569 2.331 919 H ALA 112 H ALA 112 -6.021 -6.627 0.279 920 HA ALA 112 HA ALA 112 -8.547 -7.922 0.360 921 1HB ALA 112 HB1 ALA 112 -8.516 -5.043 1.168 922 2HB ALA 112 HB2 ALA 112 -9.831 -5.593 0.128 923 3HB ALA 112 HB3 ALA 112 -9.577 -6.347 1.703 924 H TYR 113 H TYR 113 -10.008 -6.697 -1.535 925 HA TYR 113 HA TYR 113 -10.096 -6.269 -3.840 926 1HB TYR 113 HB2 TYR 113 -7.452 -4.948 -3.170 927 2HB TYR 113 HB3 TYR 113 -8.242 -4.821 -4.743 928 HD1 TYR 113 HD1 TYR 113 -10.878 -4.241 -4.542 929 HD2 TYR 113 HD2 TYR 113 -7.859 -3.225 -1.662 930 HE1 TYR 113 HE1 TYR 113 -12.318 -2.417 -3.677 931 HE2 TYR 113 HE2 TYR 113 -9.299 -1.401 -0.795 932 HH TYR 113 HH TYR 113 -12.092 -0.323 -2.451 933 H VAL 114 H VAL 114 -9.532 -8.824 -3.478 934 HA VAL 114 HA VAL 114 -6.964 -9.505 -4.777 935 HB VAL 114 HB VAL 114 -9.138 -11.447 -3.991 936 1HG1 VAL 114 HG11 VAL 114 -6.698 -11.765 -5.243 937 2HG1 VAL 114 HG12 VAL 114 -6.301 -12.077 -3.554 938 3HG1 VAL 114 HG13 VAL 114 -7.552 -13.028 -4.356 939 1HG2 VAL 114 HG21 VAL 114 -7.149 -9.975 -2.269 940 2HG2 VAL 114 HG22 VAL 114 -8.861 -10.269 -1.968 941 3HG2 VAL 114 HG23 VAL 114 -7.702 -11.590 -1.822 942 H TYR 115 H TYR 115 -7.241 -8.833 -6.936 943 HA TYR 115 HA TYR 115 -9.350 -10.328 -8.443 944 1HB TYR 115 HB2 TYR 115 -8.291 -7.577 -9.144 945 2HB TYR 115 HB3 TYR 115 -9.627 -8.431 -9.916 946 HD1 TYR 115 HD1 TYR 115 -11.107 -9.543 -7.656 947 HD2 TYR 115 HD2 TYR 115 -9.224 -5.705 -8.073 948 HE1 TYR 115 HE1 TYR 115 -12.678 -8.592 -5.988 949 HE2 TYR 115 HE2 TYR 115 -10.794 -4.753 -6.405 950 HH TYR 115 HH TYR 115 -12.722 -5.129 -5.274 951 H LYS 116 H LYS 116 -8.476 -11.682 -9.928 952 HA LYS 116 HA LYS 116 -5.606 -11.497 -10.545 953 1HB LYS 116 HB2 LYS 116 -7.415 -13.443 -11.924 954 2HB LYS 116 HB3 LYS 116 -5.781 -13.680 -11.305 955 1HG LYS 116 HG2 LYS 116 -6.968 -13.244 -8.968 956 2HG LYS 116 HG3 LYS 116 -8.393 -13.796 -9.849 957 1HD LYS 116 HD2 LYS 116 -6.114 -15.496 -10.420 958 2HD LYS 116 HD3 LYS 116 -6.413 -15.415 -8.684 959 1HE LYS 116 HE2 LYS 116 -7.736 -17.229 -9.629 960 2HE LYS 116 HE3 LYS 116 -8.821 -15.933 -9.123 961 1HZ LYS 116 HZ1 LYS 116 -8.409 -15.151 -11.576 962 2HZ LYS 116 HZ2 LYS 116 -8.085 -16.798 -11.820 963 3HZ LYS 116 HZ3 LYS 116 -9.595 -16.312 -11.211 964 HA PRO 117 HA PRO 117 -4.475 -12.515 -12.078 965 1HB PRO 117 HB2 PRO 117 -2.557 -11.677 -13.831 966 2HB PRO 117 HB3 PRO 117 -3.781 -12.887 -14.250 967 1HG PRO 117 HG2 PRO 117 -3.568 -10.061 -15.119 968 2HG PRO 117 HG3 PRO 117 -4.375 -11.423 -15.910 969 1HD PRO 117 HD2 PRO 117 -5.608 -9.358 -14.369 970 2HD PRO 117 HD3 PRO 117 -6.386 -10.815 -15.025 971 H ASN 118 H ASN 118 -5.216 -9.587 -11.305 972 HA ASN 118 HA ASN 118 -2.550 -8.443 -10.760 973 1HB ASN 118 HB2 ASN 118 -5.373 -7.504 -10.582 974 2HB ASN 118 HB3 ASN 118 -4.221 -6.783 -9.459 975 1HD2 ASN 118 HD21 ASN 118 -5.471 -5.372 -11.713 976 2HD2 ASN 118 HD22 ASN 118 -4.219 -4.915 -12.764 977 H ASN 119 H ASN 119 -2.111 -10.495 -9.408 978 HA ASN 119 HA ASN 119 -2.393 -9.788 -6.602 979 1HB ASN 119 HB2 ASN 119 -3.688 -11.690 -5.871 980 2HB ASN 119 HB3 ASN 119 -4.611 -10.879 -7.136 981 1HD2 ASN 119 HD21 ASN 119 -4.837 -13.731 -6.435 982 2HD2 ASN 119 HD22 ASN 119 -4.381 -14.609 -7.814 983 H THR 120 H THR 120 -0.247 -10.362 -8.497 984 HA THR 120 HA THR 120 0.801 -13.003 -8.101 985 HB THR 120 HB THR 120 2.170 -10.379 -8.760 986 HG1 THR 120 HG1 THR 120 1.872 -10.997 -10.780 987 1HG2 THR 120 HG21 THR 120 3.272 -12.970 -8.019 988 2HG2 THR 120 HG22 THR 120 3.759 -12.492 -9.645 989 3HG2 THR 120 HG23 THR 120 4.100 -11.435 -8.276 990 H HIS 121 H HIS 121 1.283 -9.943 -6.345 991 HA HIS 121 HA HIS 121 2.936 -11.378 -4.338 992 1HB HIS 121 HB2 HIS 121 2.398 -8.491 -4.970 993 2HB HIS 121 HB3 HIS 121 2.973 -8.932 -3.363 994 HD1 HIS 121 HD1 HIS 121 4.016 -10.675 -6.555 995 HD2 HIS 121 HD2 HIS 121 5.640 -8.121 -3.688 996 HE1 HIS 121 HE1 HIS 121 6.498 -10.535 -7.044 997 H GLU 122 H GLU 122 0.002 -11.822 -4.655 998 HA GLU 122 HA GLU 122 -1.216 -10.530 -2.320 999 1HB GLU 122 HB2 GLU 122 -2.565 -11.077 -4.324 1000 2HB GLU 122 HB3 GLU 122 -2.232 -12.791 -4.070 1001 1HG GLU 122 HG2 GLU 122 -3.204 -11.590 -1.624 1002 2HG GLU 122 HG3 GLU 122 -4.335 -11.290 -2.944 1003 H GLN 123 H GLN 123 0.170 -13.679 -3.144 1004 HA GLN 123 HA GLN 123 -0.692 -15.079 -0.806 1005 1HB GLN 123 HB2 GLN 123 1.348 -15.460 -2.914 1006 2HB GLN 123 HB3 GLN 123 1.707 -16.248 -1.378 1007 1HG GLN 123 HG2 GLN 123 0.440 -17.834 -2.638 1008 2HG GLN 123 HG3 GLN 123 -0.675 -17.166 -1.447 1009 1HE2 GLN 123 HE21 GLN 123 0.198 -17.103 -4.894 1010 2HE2 GLN 123 HE22 GLN 123 -1.239 -16.366 -5.419 1011 H LEU 124 H LEU 124 2.230 -13.146 -1.457 1012 HA LEU 124 HA LEU 124 3.501 -13.641 1.057 1013 1HB LEU 124 HB2 LEU 124 4.445 -12.497 -1.077 1014 2HB LEU 124 HB3 LEU 124 3.734 -11.022 -0.419 1015 HG LEU 124 HG LEU 124 4.964 -11.726 1.785 1016 1HD1 LEU 124 HD11 LEU 124 6.180 -13.470 -0.327 1017 2HD1 LEU 124 HD12 LEU 124 7.221 -12.821 0.940 1018 3HD1 LEU 124 HD13 LEU 124 5.842 -13.834 1.365 1019 1HD2 LEU 124 HD21 LEU 124 6.062 -10.461 -0.699 1020 2HD2 LEU 124 HD22 LEU 124 5.732 -9.736 0.873 1021 3HD2 LEU 124 HD23 LEU 124 7.162 -10.743 0.650 1022 H LEU 125 H LEU 125 1.549 -10.820 0.015 1023 HA LEU 125 HA LEU 125 1.458 -9.562 2.561 1024 1HB LEU 125 HB2 LEU 125 -0.313 -9.481 0.129 1025 2HB LEU 125 HB3 LEU 125 -0.790 -8.631 1.598 1026 HG LEU 125 HG LEU 125 1.987 -8.275 0.507 1027 1HD1 LEU 125 HD11 LEU 125 -0.524 -6.850 -0.422 1028 2HD1 LEU 125 HD12 LEU 125 1.116 -6.293 -0.756 1029 3HD1 LEU 125 HD13 LEU 125 0.556 -7.832 -1.411 1030 1HD2 LEU 125 HD21 LEU 125 1.126 -7.426 2.784 1031 2HD2 LEU 125 HD22 LEU 125 1.911 -6.242 1.739 1032 3HD2 LEU 125 HD23 LEU 125 0.152 -6.286 1.855 1033 H ARG 126 H ARG 126 -0.167 -12.374 1.370 1034 HA ARG 126 HA ARG 126 -2.403 -12.298 3.211 1035 1HB ARG 126 HB2 ARG 126 -2.176 -13.677 1.039 1036 2HB ARG 126 HB3 ARG 126 -1.237 -14.810 2.013 1037 1HG ARG 126 HG2 ARG 126 -3.377 -14.411 3.647 1038 2HG ARG 126 HG3 ARG 126 -4.139 -14.234 2.066 1039 1HD ARG 126 HD2 ARG 126 -2.567 -16.428 1.643 1040 2HD ARG 126 HD3 ARG 126 -2.989 -16.637 3.343 1041 HE ARG 126 HE ARG 126 -5.365 -15.986 1.922 1042 1HH1 ARG 126 HH11 ARG 126 -3.142 -18.498 2.653 1043 2HH1 ARG 126 HH12 ARG 126 -4.147 -19.760 2.023 1044 1HH2 ARG 126 HH21 ARG 126 -6.615 -17.598 0.901 1045 2HH2 ARG 126 HH22 ARG 126 -6.113 -19.251 1.030 1046 H LYS 127 H LYS 127 0.494 -14.428 3.166 1047 HA LYS 127 HA LYS 127 0.134 -15.506 5.746 1048 1HB LYS 127 HB2 LYS 127 2.587 -15.931 5.716 1049 2HB LYS 127 HB3 LYS 127 1.815 -16.383 4.197 1050 1HG LYS 127 HG2 LYS 127 2.461 -14.153 3.262 1051 2HG LYS 127 HG3 LYS 127 3.346 -13.827 4.753 1052 1HD LYS 127 HD2 LYS 127 5.024 -14.694 3.367 1053 2HD LYS 127 HD3 LYS 127 4.504 -16.124 4.261 1054 1HE LYS 127 HE2 LYS 127 2.826 -15.756 1.940 1055 2HE LYS 127 HE3 LYS 127 4.522 -15.779 1.458 1056 1HZ LYS 127 HZ1 LYS 127 3.373 -17.791 3.299 1057 2HZ LYS 127 HZ2 LYS 127 3.370 -17.999 1.616 1058 3HZ LYS 127 HZ3 LYS 127 4.844 -17.861 2.452 1059 H SER 128 H SER 128 1.569 -12.439 4.757 1060 HA SER 128 HA SER 128 2.585 -11.764 7.383 1061 1HB SER 128 HB2 SER 128 1.833 -9.868 5.143 1062 2HB SER 128 HB3 SER 128 2.944 -9.551 6.472 1063 HG SER 128 HG SER 128 3.359 -10.833 4.109 1064 H GLU 129 H GLU 129 -0.486 -11.345 5.720 1065 HA GLU 129 HA GLU 129 -1.596 -9.448 7.597 1066 1HB GLU 129 HB2 GLU 129 -2.435 -10.037 5.222 1067 2HB GLU 129 HB3 GLU 129 -3.215 -11.423 5.986 1068 1HG GLU 129 HG2 GLU 129 -4.715 -9.423 5.811 1069 2HG GLU 129 HG3 GLU 129 -4.468 -9.965 7.472 1070 H ALA 130 H ALA 130 -1.525 -12.982 7.392 1071 HA ALA 130 HA ALA 130 -3.350 -13.404 9.598 1072 1HB ALA 130 HB1 ALA 130 -1.286 -15.169 8.264 1073 2HB ALA 130 HB2 ALA 130 -2.297 -15.726 9.597 1074 3HB ALA 130 HB3 ALA 130 -3.038 -15.228 8.075 1075 H GLN 131 H GLN 131 0.125 -12.936 9.300 1076 HA GLN 131 HA GLN 131 0.802 -13.759 11.974 1077 1HB GLN 131 HB2 GLN 131 2.257 -13.054 9.778 1078 2HB GLN 131 HB3 GLN 131 2.411 -11.592 10.753 1079 1HG GLN 131 HG2 GLN 131 3.217 -12.902 12.654 1080 2HG GLN 131 HG3 GLN 131 2.991 -14.397 11.746 1081 1HE2 GLN 131 HE21 GLN 131 4.570 -14.945 10.128 1082 2HE2 GLN 131 HE22 GLN 131 5.994 -14.049 9.903 1083 H ALA 132 H ALA 132 -0.031 -10.619 10.526 1084 HA ALA 132 HA ALA 132 0.299 -9.113 12.963 1085 1HB ALA 132 HB1 ALA 132 -0.150 -8.475 10.323 1086 2HB ALA 132 HB2 ALA 132 -1.712 -8.114 11.057 1087 3HB ALA 132 HB3 ALA 132 -0.252 -7.332 11.661 1088 H LYS 133 H LYS 133 -2.351 -10.944 11.546 1089 HA LYS 133 HA LYS 133 -4.469 -9.947 13.174 1090 1HB LYS 133 HB2 LYS 133 -3.977 -12.379 11.541 1091 2HB LYS 133 HB3 LYS 133 -5.213 -12.524 12.792 1092 1HG LYS 133 HG2 LYS 133 -6.546 -10.841 11.852 1093 2HG LYS 133 HG3 LYS 133 -5.198 -10.136 10.962 1094 1HD LYS 133 HD2 LYS 133 -6.667 -11.332 9.413 1095 2HD LYS 133 HD3 LYS 133 -5.117 -12.168 9.526 1096 1HE LYS 133 HE2 LYS 133 -6.349 -14.020 9.958 1097 2HE LYS 133 HE3 LYS 133 -6.566 -13.331 11.566 1098 1HZ LYS 133 HZ1 LYS 133 -8.533 -12.137 10.645 1099 2HZ LYS 133 HZ2 LYS 133 -8.373 -13.065 9.231 1100 3HZ LYS 133 HZ3 LYS 133 -8.702 -13.826 10.711 1101 H LYS 134 H LYS 134 -2.556 -12.950 13.611 1102 HA LYS 134 HA LYS 134 -3.538 -13.369 16.296 1103 1HB LYS 134 HB2 LYS 134 -1.863 -15.134 16.419 1104 2HB LYS 134 HB3 LYS 134 -2.624 -15.183 14.828 1105 1HG LYS 134 HG2 LYS 134 -0.614 -14.911 13.859 1106 2HG LYS 134 HG3 LYS 134 -0.425 -13.367 14.689 1107 1HD LYS 134 HD2 LYS 134 1.441 -14.760 15.322 1108 2HD LYS 134 HD3 LYS 134 0.365 -14.650 16.716 1109 1HE LYS 134 HE2 LYS 134 -0.606 -16.828 15.250 1110 2HE LYS 134 HE3 LYS 134 1.148 -16.995 15.184 1111 1HZ LYS 134 HZ1 LYS 134 0.417 -16.231 17.778 1112 2HZ LYS 134 HZ2 LYS 134 -0.556 -17.547 17.324 1113 3HZ LYS 134 HZ3 LYS 134 1.137 -17.681 17.272 1114 H GLU 135 H GLU 135 -1.041 -11.400 14.938 1115 HA GLU 135 HA GLU 135 0.534 -11.214 17.392 1116 1HB GLU 135 HB2 GLU 135 0.628 -10.052 14.668 1117 2HB GLU 135 HB3 GLU 135 1.283 -9.034 15.950 1118 1HG GLU 135 HG2 GLU 135 2.861 -10.697 16.604 1119 2HG GLU 135 HG3 GLU 135 2.052 -11.943 15.654 1120 H LYS 136 H LYS 136 -2.349 -9.765 16.214 1121 HA LYS 136 HA LYS 136 -3.687 -8.042 17.088 1122 1HB LYS 136 HB2 LYS 136 -2.009 -8.898 19.429 1123 2HB LYS 136 HB3 LYS 136 -3.037 -7.474 19.580 1124 1HG LYS 136 HG2 LYS 136 -4.964 -8.880 18.752 1125 2HG LYS 136 HG3 LYS 136 -3.906 -10.287 18.868 1126 1HD LYS 136 HD2 LYS 136 -4.353 -8.431 21.209 1127 2HD LYS 136 HD3 LYS 136 -5.405 -9.812 20.899 1128 1HE LYS 136 HE2 LYS 136 -2.572 -10.512 20.740 1129 2HE LYS 136 HE3 LYS 136 -3.022 -9.883 22.325 1130 1HZ LYS 136 HZ1 LYS 136 -4.707 -11.896 20.989 1131 2HZ LYS 136 HZ2 LYS 136 -3.319 -12.377 21.844 1132 3HZ LYS 136 HZ3 LYS 136 -4.568 -11.547 22.643 1133 H LEU 137 H LEU 137 -1.980 -6.982 15.396 1134 HA LEU 137 HA LEU 137 -0.307 -4.955 16.758 1135 1HB LEU 137 HB2 LEU 137 -0.157 -6.334 14.287 1136 2HB LEU 137 HB3 LEU 137 -0.413 -4.634 13.899 1137 HG LEU 137 HG LEU 137 1.985 -5.086 14.105 1138 1HD1 LEU 137 HD11 LEU 137 0.517 -3.289 15.926 1139 2HD1 LEU 137 HD12 LEU 137 2.184 -3.610 16.406 1140 3HD1 LEU 137 HD13 LEU 137 1.838 -2.931 14.815 1141 1HD2 LEU 137 HD21 LEU 137 1.052 -6.394 16.615 1142 2HD2 LEU 137 HD22 LEU 137 2.354 -6.861 15.521 1143 3HD2 LEU 137 HD23 LEU 137 2.603 -5.558 16.682 1144 H ASN 138 H ASN 138 -1.439 -3.207 17.457 1145 HA ASN 138 HA ASN 138 -3.017 -1.463 17.488 1146 1HB ASN 138 HB2 ASN 138 -2.141 -1.481 14.586 1147 2HB ASN 138 HB3 ASN 138 -3.074 -0.180 15.327 1148 1HD2 ASN 138 HD21 ASN 138 0.100 -1.254 14.730 1149 2HD2 ASN 138 HD22 ASN 138 0.907 -0.254 15.840 1150 H ILE 139 H ILE 139 -3.848 -2.131 14.153 1151 HA ILE 139 HA ILE 139 -6.613 -2.110 14.493 1152 HB ILE 139 HB ILE 139 -4.961 -3.681 12.499 1153 1HG1 ILE 139 HG12 ILE 139 -6.546 -1.154 12.036 1154 2HG1 ILE 139 HG13 ILE 139 -4.887 -1.094 12.635 1155 1HG2 ILE 139 HG21 ILE 139 -7.845 -3.608 13.009 1156 2HG2 ILE 139 HG22 ILE 139 -7.431 -3.145 11.358 1157 3HG2 ILE 139 HG23 ILE 139 -6.913 -4.707 11.992 1158 1HD1 ILE 139 HD11 ILE 139 -4.737 -2.903 10.537 1159 2HD1 ILE 139 HD12 ILE 139 -5.869 -1.688 9.942 1160 3HD1 ILE 139 HD13 ILE 139 -4.255 -1.209 10.466 1161 H TRP 140 H TRP 140 -4.848 -5.157 13.911 1162 HA TRP 140 HA TRP 140 -6.967 -6.802 14.897 1163 1HB TRP 140 HB2 TRP 140 -4.026 -7.519 14.771 1164 2HB TRP 140 HB3 TRP 140 -5.401 -8.622 14.693 1165 HD1 TRP 140 HD1 TRP 140 -3.232 -6.442 12.568 1166 HE1 TRP 140 HE1 TRP 140 -4.056 -6.497 10.126 1167 HE3 TRP 140 HE3 TRP 140 -7.720 -8.792 13.204 1168 HZ2 TRP 140 HZ2 TRP 140 -6.322 -7.414 8.637 1169 HZ3 TRP 140 HZ3 TRP 140 -9.192 -9.242 11.261 1170 HH2 TRP 140 HH2 TRP 140 -8.499 -8.556 8.980 1171 H SER 141 H SER 141 -4.807 -4.824 16.592 1172 HA SER 141 HA SER 141 -4.545 -6.505 18.965 1173 1HB SER 141 HB2 SER 141 -3.065 -4.466 18.146 1174 2HB SER 141 HB3 SER 141 -4.241 -3.523 19.059 1175 HG SER 141 HG SER 141 -2.231 -4.527 20.118 1176 H GLU 142 H GLU 142 -6.676 -7.047 19.602 1177 HA GLU 142 HA GLU 142 -8.827 -5.182 19.812 1178 1HB GLU 142 HB2 GLU 142 -9.747 -6.933 21.433 1179 2HB GLU 142 HB3 GLU 142 -9.372 -7.505 19.811 1180 1HG GLU 142 HG2 GLU 142 -7.852 -8.957 20.616 1181 2HG GLU 142 HG3 GLU 142 -7.026 -7.666 21.489 1182 H ASP 143 H ASP 143 -9.850 -5.079 22.261 1183 HA ASP 143 HA ASP 143 -7.713 -3.759 23.884 1184 1HB ASP 143 HB2 ASP 143 -10.160 -2.761 22.977 1185 2HB ASP 143 HB3 ASP 143 -10.454 -3.153 24.672 1186 H ASN 144 H ASN 144 -9.488 -3.611 26.217 1187 HA ASN 144 HA ASN 144 -9.750 -6.493 26.936 1188 1HB ASN 144 HB2 ASN 144 -7.588 -5.775 27.814 1189 2HB ASN 144 HB3 ASN 144 -8.334 -4.364 28.568 1190 1HD2 ASN 144 HD21 ASN 144 -7.251 -5.577 30.548 1191 2HD2 ASN 144 HD22 ASN 144 -8.244 -6.689 31.360 1192 H ALA 145 H ALA 145 -12.050 -6.188 26.792 1193 HA ALA 145 HA ALA 145 -13.297 -4.139 28.505 1194 1HB ALA 145 HB1 ALA 145 -14.216 -6.061 26.424 1195 2HB ALA 145 HB2 ALA 145 -15.387 -5.621 27.668 1196 3HB ALA 145 HB3 ALA 145 -14.654 -4.370 26.665 1197 H ASP 146 H ASP 146 -12.814 -4.769 30.633 1198 HA ASP 146 HA ASP 146 -13.136 -7.493 31.564 1199 1HB ASP 146 HB2 ASP 146 -12.778 -6.559 33.786 1200 2HB ASP 146 HB3 ASP 146 -11.648 -5.804 32.661 1201 H SER 147 H SER 147 -15.200 -4.625 31.485 1202 HA SER 147 HA SER 147 -17.511 -4.421 31.848 1203 1HB SER 147 HB2 SER 147 -17.111 -7.291 31.234 1204 2HB SER 147 HB3 SER 147 -18.592 -6.906 32.106 1205 HG SER 147 HG SER 147 -19.340 -5.978 30.374 1206 H GLY 148 H GLY 148 -17.475 -7.477 33.564 1207 1HA GLY 148 HA2 GLY 148 -16.955 -7.628 35.995 1208 2HA GLY 148 HA3 GLY 148 -17.527 -5.966 36.145 1209 H GLN 149 H GLN 149 -19.362 -7.878 33.984 1210 HA GLN 149 HA GLN 149 -21.608 -7.869 35.911 1211 1HB GLN 149 HB2 GLN 149 -21.452 -7.402 33.181 1212 2HB GLN 149 HB3 GLN 149 -22.123 -9.032 33.271 1213 1HG GLN 149 HG2 GLN 149 -23.376 -7.390 35.272 1214 2HG GLN 149 HG3 GLN 149 -23.479 -6.577 33.710 1215 1HE2 GLN 149 HE21 GLN 149 -25.893 -7.150 33.995 1216 2HE2 GLN 149 HE22 GLN 149 -26.399 -8.681 33.468 1217 HN3 PTP 150 H3 PTP 150 -8.360 -3.525 -9.145 1218 1H5M PTP 150 H51 PTP 150 -6.008 -1.403 -5.432 1219 2H5M PTP 150 H52 PTP 150 -6.736 -2.848 -4.690 1220 3H5M PTP 150 H53 PTP 150 -7.390 -1.233 -4.323 1221 H6 PTP 150 H6 PTP 150 -9.239 -0.568 -5.460 1222 H1* PTP 150 H1' PTP 150 -11.496 -0.435 -8.370 1223 2H2* PTP 150 H2' PTP 150 -11.837 -1.790 -5.695 1224 H3* PTP 150 H3' PTP 150 -13.171 -0.001 -4.852 1225 H4* PTP 150 H4' PTP 150 -11.991 2.182 -5.979 1226 2H5* PTP 150 H5' PTP 150 -10.908 0.037 -4.077 Start of MODEL 14 1 1H ALA 1 H1 ALA 1 3.364 -21.691 -7.042 2 2H ALA 1 H2 ALA 1 4.211 -22.178 -8.433 3 3H ALA 1 H3 ALA 1 4.357 -23.068 -6.997 4 HA ALA 1 HA ALA 1 5.182 -20.789 -6.045 5 1HB ALA 1 HB1 ALA 1 6.648 -22.901 -7.608 6 2HB ALA 1 HB2 ALA 1 7.531 -21.529 -6.940 7 3HB ALA 1 HB3 ALA 1 6.643 -22.612 -5.868 8 H THR 2 H THR 2 7.335 -19.612 -7.183 9 HA THR 2 HA THR 2 6.349 -18.518 -9.783 10 HB THR 2 HB THR 2 7.787 -16.551 -8.191 11 HG1 THR 2 HG1 THR 2 5.261 -17.089 -7.158 12 1HG2 THR 2 HG21 THR 2 5.398 -16.810 -9.895 13 2HG2 THR 2 HG22 THR 2 5.246 -15.612 -8.609 14 3HG2 THR 2 HG23 THR 2 6.561 -15.489 -9.778 15 H SER 3 H SER 3 8.576 -16.625 -9.895 16 HA SER 3 HA SER 3 10.896 -18.499 -10.082 17 1HB SER 3 HB2 SER 3 11.497 -17.393 -12.240 18 2HB SER 3 HB3 SER 3 9.966 -18.260 -12.329 19 HG SER 3 HG SER 3 10.200 -15.915 -13.095 20 H THR 4 H THR 4 9.922 -16.110 -8.328 21 HA THR 4 HA THR 4 11.108 -14.509 -7.072 22 HB THR 4 HB THR 4 13.528 -14.875 -8.813 23 HG1 THR 4 HG1 THR 4 14.008 -16.751 -7.754 24 1HG2 THR 4 HG21 THR 4 12.916 -13.571 -6.386 25 2HG2 THR 4 HG22 THR 4 13.907 -14.965 -5.954 26 3HG2 THR 4 HG23 THR 4 14.509 -13.780 -7.114 27 H LYS 5 H LYS 5 10.191 -12.576 -7.619 28 HA LYS 5 HA LYS 5 9.756 -10.605 -8.817 29 1HB LYS 5 HB2 LYS 5 12.543 -11.004 -9.929 30 2HB LYS 5 HB3 LYS 5 11.690 -9.480 -9.671 31 1HG LYS 5 HG2 LYS 5 12.551 -9.364 -7.598 32 2HG LYS 5 HG3 LYS 5 11.721 -10.866 -7.184 33 1HD LYS 5 HD2 LYS 5 13.592 -12.192 -7.936 34 2HD LYS 5 HD3 LYS 5 14.394 -10.770 -8.604 35 1HE LYS 5 HE2 LYS 5 15.420 -11.274 -6.468 36 2HE LYS 5 HE3 LYS 5 14.466 -9.803 -6.285 37 1HZ LYS 5 HZ1 LYS 5 12.643 -11.638 -5.700 38 2HZ LYS 5 HZ2 LYS 5 14.037 -12.446 -5.161 39 3HZ LYS 5 HZ3 LYS 5 13.641 -10.919 -4.532 40 H LYS 6 H LYS 6 8.198 -11.119 -10.340 41 HA LYS 6 HA LYS 6 9.165 -12.234 -12.939 42 1HB LYS 6 HB2 LYS 6 6.669 -12.571 -11.366 43 2HB LYS 6 HB3 LYS 6 6.466 -12.436 -13.113 44 1HG LYS 6 HG2 LYS 6 8.685 -14.194 -12.332 45 2HG LYS 6 HG3 LYS 6 7.112 -14.760 -11.771 46 1HD LYS 6 HD2 LYS 6 6.960 -15.645 -13.868 47 2HD LYS 6 HD3 LYS 6 6.493 -14.004 -14.315 48 1HE LYS 6 HE2 LYS 6 8.542 -13.528 -15.264 49 2HE LYS 6 HE3 LYS 6 9.412 -14.623 -14.189 50 1HZ LYS 6 HZ1 LYS 6 7.579 -15.510 -16.350 51 2HZ LYS 6 HZ2 LYS 6 9.269 -15.417 -16.508 52 3HZ LYS 6 HZ3 LYS 6 8.581 -16.493 -15.392 53 H LEU 7 H LEU 7 8.759 -9.336 -11.658 54 HA LEU 7 HA LEU 7 7.493 -8.217 -14.129 55 1HB LEU 7 HB2 LEU 7 7.414 -6.980 -11.361 56 2HB LEU 7 HB3 LEU 7 6.575 -6.407 -12.803 57 HG LEU 7 HG LEU 7 6.103 -9.203 -11.795 58 1HD1 LEU 7 HD11 LEU 7 5.788 -7.449 -9.944 59 2HD1 LEU 7 HD12 LEU 7 4.469 -6.812 -10.927 60 3HD1 LEU 7 HD13 LEU 7 4.393 -8.463 -10.313 61 1HD2 LEU 7 HD21 LEU 7 5.214 -7.694 -13.975 62 2HD2 LEU 7 HD22 LEU 7 4.495 -9.193 -13.387 63 3HD2 LEU 7 HD23 LEU 7 3.870 -7.639 -12.836 64 H HIS 8 H HIS 8 8.137 -5.499 -13.398 65 HA HIS 8 HA HIS 8 11.123 -5.561 -13.396 66 1HB HIS 8 HB2 HIS 8 10.431 -5.273 -15.710 67 2HB HIS 8 HB3 HIS 8 9.305 -3.997 -15.250 68 HD1 HIS 8 HD1 HIS 8 12.881 -4.387 -14.028 69 HD2 HIS 8 HD2 HIS 8 10.592 -1.802 -16.357 70 HE1 HIS 8 HE1 HIS 8 14.361 -2.401 -14.552 71 H LYS 9 H LYS 9 11.671 -4.478 -11.551 72 HA LYS 9 HA LYS 9 9.902 -2.410 -10.452 73 1HB LYS 9 HB2 LYS 9 12.656 -3.304 -9.546 74 2HB LYS 9 HB3 LYS 9 11.541 -2.291 -8.629 75 1HG LYS 9 HG2 LYS 9 9.897 -4.114 -8.575 76 2HG LYS 9 HG3 LYS 9 10.977 -5.130 -9.531 77 1HD LYS 9 HD2 LYS 9 11.535 -5.856 -7.405 78 2HD LYS 9 HD3 LYS 9 12.692 -4.538 -7.590 79 1HE LYS 9 HE2 LYS 9 11.248 -3.019 -6.373 80 2HE LYS 9 HE3 LYS 9 9.960 -4.222 -6.317 81 1HZ LYS 9 HZ1 LYS 9 12.380 -5.290 -5.298 82 2HZ LYS 9 HZ2 LYS 9 11.979 -3.862 -4.475 83 3HZ LYS 9 HZ3 LYS 9 10.867 -5.145 -4.537 84 H GLU 10 H GLU 10 10.070 -0.281 -10.945 85 HA GLU 10 HA GLU 10 12.664 0.683 -12.086 86 1HB GLU 10 HB2 GLU 10 9.832 1.127 -12.951 87 2HB GLU 10 HB3 GLU 10 10.984 2.447 -13.158 88 1HG GLU 10 HG2 GLU 10 12.036 -0.164 -14.002 89 2HG GLU 10 HG3 GLU 10 10.633 0.363 -14.932 90 HA PRO 11 HA PRO 11 12.644 3.735 -8.918 91 1HB PRO 11 HB2 PRO 11 13.959 5.763 -10.196 92 2HB PRO 11 HB3 PRO 11 14.761 4.284 -9.643 93 1HG PRO 11 HG2 PRO 11 13.930 5.059 -12.410 94 2HG PRO 11 HG3 PRO 11 15.335 4.120 -11.880 95 1HD PRO 11 HD2 PRO 11 13.020 3.010 -12.949 96 2HD PRO 11 HD3 PRO 11 14.176 2.134 -11.922 97 H ALA 12 H ALA 12 11.902 5.997 -8.439 98 HA ALA 12 HA ALA 12 10.053 7.171 -10.435 99 1HB ALA 12 HB1 ALA 12 9.238 6.092 -7.733 100 2HB ALA 12 HB2 ALA 12 8.303 7.344 -8.552 101 3HB ALA 12 HB3 ALA 12 8.509 5.762 -9.305 102 H THR 13 H THR 13 8.878 9.105 -8.859 103 HA THR 13 HA THR 13 11.200 10.470 -7.555 104 HB THR 13 HB THR 13 9.153 11.993 -9.155 105 HG1 THR 13 HG1 THR 13 11.315 10.465 -10.038 106 1HG2 THR 13 HG21 THR 13 11.498 12.588 -7.610 107 2HG2 THR 13 HG22 THR 13 11.789 13.038 -9.290 108 3HG2 THR 13 HG23 THR 13 10.406 13.708 -8.424 109 H LEU 14 H LEU 14 10.520 10.325 -5.428 110 HA LEU 14 HA LEU 14 7.866 10.366 -4.479 111 1HB LEU 14 HB2 LEU 14 9.847 9.814 -3.076 112 2HB LEU 14 HB3 LEU 14 10.306 11.518 -3.088 113 HG LEU 14 HG LEU 14 8.004 12.027 -2.136 114 1HD1 LEU 14 HD11 LEU 14 8.029 9.008 -1.905 115 2HD1 LEU 14 HD12 LEU 14 6.976 10.033 -0.930 116 3HD1 LEU 14 HD13 LEU 14 6.813 10.019 -2.686 117 1HD2 LEU 14 HD21 LEU 14 10.216 11.776 -0.833 118 2HD2 LEU 14 HD22 LEU 14 8.723 11.649 0.097 119 3HD2 LEU 14 HD23 LEU 14 9.611 10.192 -0.350 120 H ILE 15 H ILE 15 6.528 11.935 -5.366 121 HA ILE 15 HA ILE 15 7.396 14.743 -5.457 122 HB ILE 15 HB ILE 15 4.813 13.349 -6.204 123 1HG1 ILE 15 HG12 ILE 15 6.672 14.875 -8.016 124 2HG1 ILE 15 HG13 ILE 15 7.029 13.202 -7.586 125 1HG2 ILE 15 HG21 ILE 15 5.227 16.091 -5.528 126 2HG2 ILE 15 HG22 ILE 15 5.012 15.995 -7.276 127 3HG2 ILE 15 HG23 ILE 15 3.776 15.344 -6.199 128 1HD1 ILE 15 HD11 ILE 15 4.466 12.869 -8.244 129 2HD1 ILE 15 HD12 ILE 15 4.782 14.302 -9.223 130 3HD1 ILE 15 HD13 ILE 15 5.736 12.838 -9.466 131 H LYS 16 H LYS 16 4.482 13.169 -4.074 132 HA LYS 16 HA LYS 16 4.907 14.490 -1.502 133 1HB LYS 16 HB2 LYS 16 3.798 16.155 -3.258 134 2HB LYS 16 HB3 LYS 16 2.337 15.263 -2.828 135 1HG LYS 16 HG2 LYS 16 4.199 16.436 -0.752 136 2HG LYS 16 HG3 LYS 16 2.823 17.325 -1.407 137 1HD LYS 16 HD2 LYS 16 1.627 14.963 -0.786 138 2HD LYS 16 HD3 LYS 16 2.869 15.030 0.465 139 1HE LYS 16 HE2 LYS 16 2.102 17.223 1.182 140 2HE LYS 16 HE3 LYS 16 0.949 17.292 -0.150 141 1HZ LYS 16 HZ1 LYS 16 0.018 15.156 0.833 142 2HZ LYS 16 HZ2 LYS 16 0.908 15.538 2.228 143 3HZ LYS 16 HZ3 LYS 16 -0.299 16.596 1.671 144 H ALA 17 H ALA 17 4.433 12.730 -0.253 145 HA ALA 17 HA ALA 17 2.593 10.662 -1.014 146 1HB ALA 17 HB1 ALA 17 4.504 10.944 0.946 147 2HB ALA 17 HB2 ALA 17 3.009 11.022 1.881 148 3HB ALA 17 HB3 ALA 17 3.342 9.621 0.863 149 H ILE 18 H ILE 18 0.478 10.222 -0.121 150 HA ILE 18 HA ILE 18 -0.895 12.677 0.903 151 HB ILE 18 HB ILE 18 -2.154 10.410 -0.667 152 1HG1 ILE 18 HG12 ILE 18 -1.875 13.032 -1.970 153 2HG1 ILE 18 HG13 ILE 18 -0.332 12.233 -1.665 154 1HG2 ILE 18 HG21 ILE 18 -3.079 13.198 0.094 155 2HG2 ILE 18 HG22 ILE 18 -3.955 12.114 -0.987 156 3HG2 ILE 18 HG23 ILE 18 -3.725 11.674 0.706 157 1HD1 ILE 18 HD11 ILE 18 -2.322 10.357 -2.661 158 2HD1 ILE 18 HD12 ILE 18 -2.082 11.698 -3.780 159 3HD1 ILE 18 HD13 ILE 18 -0.710 10.708 -3.284 160 H ASP 19 H ASP 19 -1.537 9.151 0.791 161 HA ASP 19 HA ASP 19 -2.228 9.331 3.698 162 1HB ASP 19 HB2 ASP 19 -3.335 7.264 1.797 163 2HB ASP 19 HB3 ASP 19 -3.958 7.743 3.376 164 H GLY 20 H GLY 20 -2.447 6.526 4.078 165 1HA GLY 20 HA2 GLY 20 0.405 5.846 4.238 166 2HA GLY 20 HA3 GLY 20 -0.925 4.905 4.917 167 H ASP 21 H ASP 21 -2.464 4.784 2.464 168 HA ASP 21 HA ASP 21 -0.751 2.852 0.962 169 1HB ASP 21 HB2 ASP 21 -3.778 3.025 1.088 170 2HB ASP 21 HB3 ASP 21 -2.838 1.766 0.286 171 H THR 22 H THR 22 -0.983 5.842 0.591 172 HA THR 22 HA THR 22 -1.377 5.745 -2.329 173 HB THR 22 HB THR 22 -2.834 7.862 -0.741 174 HG1 THR 22 HG1 THR 22 -4.704 6.553 -1.232 175 1HG2 THR 22 HG21 THR 22 -2.253 8.182 -3.184 176 2HG2 THR 22 HG22 THR 22 -3.295 6.805 -3.537 177 3HG2 THR 22 HG23 THR 22 -3.976 8.264 -2.816 178 H VAL 23 H VAL 23 0.044 7.129 -3.335 179 HA VAL 23 HA VAL 23 1.111 9.471 -1.924 180 HB VAL 23 HB VAL 23 3.472 8.728 -2.132 181 1HG1 VAL 23 HG11 VAL 23 2.217 8.401 -0.009 182 2HG1 VAL 23 HG12 VAL 23 1.741 6.794 -0.560 183 3HG1 VAL 23 HG13 VAL 23 3.440 7.154 -0.254 184 1HG2 VAL 23 HG21 VAL 23 2.702 6.987 -3.960 185 2HG2 VAL 23 HG22 VAL 23 4.072 6.612 -2.913 186 3HG2 VAL 23 HG23 VAL 23 2.485 5.924 -2.569 187 H LYS 24 H LYS 24 2.213 10.901 -3.390 188 HA LYS 24 HA LYS 24 1.605 10.299 -6.238 189 1HB LYS 24 HB2 LYS 24 2.460 12.936 -5.010 190 2HB LYS 24 HB3 LYS 24 1.771 12.683 -6.614 191 1HG LYS 24 HG2 LYS 24 -0.190 11.563 -5.193 192 2HG LYS 24 HG3 LYS 24 0.424 12.649 -3.947 193 1HD LYS 24 HD2 LYS 24 -0.939 14.180 -4.939 194 2HD LYS 24 HD3 LYS 24 0.372 14.317 -6.111 195 1HE LYS 24 HE2 LYS 24 -0.687 12.668 -7.557 196 2HE LYS 24 HE3 LYS 24 -1.953 12.389 -6.362 197 1HZ LYS 24 HZ1 LYS 24 -1.751 15.146 -6.924 198 2HZ LYS 24 HZ2 LYS 24 -1.924 14.289 -8.377 199 3HZ LYS 24 HZ3 LYS 24 -3.078 14.107 -7.144 200 H LEU 25 H LEU 25 3.246 9.749 -7.585 201 HA LEU 25 HA LEU 25 5.994 10.709 -6.945 202 1HB LEU 25 HB2 LEU 25 5.671 7.921 -7.987 203 2HB LEU 25 HB3 LEU 25 6.958 8.600 -6.993 204 HG LEU 25 HG LEU 25 4.149 8.258 -5.932 205 1HD1 LEU 25 HD11 LEU 25 6.199 6.226 -6.481 206 2HD1 LEU 25 HD12 LEU 25 5.657 6.243 -4.803 207 3HD1 LEU 25 HD13 LEU 25 4.488 6.023 -6.105 208 1HD2 LEU 25 HD21 LEU 25 6.125 9.702 -4.900 209 2HD2 LEU 25 HD22 LEU 25 5.100 8.713 -3.859 210 3HD2 LEU 25 HD23 LEU 25 6.690 8.125 -4.345 211 H MET 26 H MET 26 7.436 10.571 -8.871 212 HA MET 26 HA MET 26 5.862 11.035 -11.348 213 1HB MET 26 HB2 MET 26 7.767 12.592 -10.342 214 2HB MET 26 HB3 MET 26 8.823 11.468 -11.199 215 1HG MET 26 HG2 MET 26 7.387 11.850 -13.255 216 2HG MET 26 HG3 MET 26 6.599 13.156 -12.369 217 1HE MET 26 HE1 MET 26 7.093 15.276 -13.221 218 2HE MET 26 HE2 MET 26 8.528 15.723 -14.141 219 3HE MET 26 HE3 MET 26 7.475 14.422 -14.715 220 H TYR 27 H TYR 27 6.108 9.726 -13.146 221 HA TYR 27 HA TYR 27 8.135 7.539 -12.976 222 1HB TYR 27 HB2 TYR 27 5.909 6.664 -12.308 223 2HB TYR 27 HB3 TYR 27 5.246 7.218 -13.846 224 HD1 TYR 27 HD1 TYR 27 7.770 4.947 -12.317 225 HD2 TYR 27 HD2 TYR 27 5.525 5.951 -15.838 226 HE1 TYR 27 HE1 TYR 27 8.534 2.851 -13.402 227 HE2 TYR 27 HE2 TYR 27 6.289 3.855 -16.924 228 HH TYR 27 HH TYR 27 7.541 1.312 -15.329 229 H LYS 28 H LYS 28 9.448 7.827 -14.713 230 HA LYS 28 HA LYS 28 10.144 8.481 -16.868 231 1HB LYS 28 HB2 LYS 28 7.552 6.996 -17.326 232 2HB LYS 28 HB3 LYS 28 8.528 7.593 -18.669 233 1HG LYS 28 HG2 LYS 28 10.476 6.384 -17.286 234 2HG LYS 28 HG3 LYS 28 9.117 5.411 -16.721 235 1HD LYS 28 HD2 LYS 28 9.277 5.949 -19.649 236 2HD LYS 28 HD3 LYS 28 10.444 4.811 -18.973 237 1HE LYS 28 HE2 LYS 28 8.503 3.613 -17.880 238 2HE LYS 28 HE3 LYS 28 7.424 4.650 -18.812 239 1HZ LYS 28 HZ1 LYS 28 9.566 3.136 -20.155 240 2HZ LYS 28 HZ2 LYS 28 8.093 2.379 -19.771 241 3HZ LYS 28 HZ3 LYS 28 8.109 3.729 -20.798 242 H GLY 29 H GLY 29 8.777 10.545 -15.402 243 1HA GLY 29 HA2 GLY 29 8.113 12.749 -15.948 244 2HA GLY 29 HA3 GLY 29 8.028 12.264 -17.643 245 H GLN 30 H GLN 30 6.364 10.629 -14.986 246 HA GLN 30 HA GLN 30 3.783 11.785 -15.907 247 1HB GLN 30 HB2 GLN 30 4.174 9.639 -17.138 248 2HB GLN 30 HB3 GLN 30 4.261 8.807 -15.584 249 1HG GLN 30 HG2 GLN 30 2.011 8.521 -16.174 250 2HG GLN 30 HG3 GLN 30 1.948 9.943 -15.133 251 1HE2 GLN 30 HE21 GLN 30 -0.003 10.701 -16.287 252 2HE2 GLN 30 HE22 GLN 30 0.123 11.387 -17.834 253 HA PRO 31 HA PRO 31 3.914 11.708 -11.342 254 1HB PRO 31 HB2 PRO 31 2.502 14.036 -11.088 255 2HB PRO 31 HB3 PRO 31 4.253 13.995 -11.367 256 1HG PRO 31 HG2 PRO 31 2.045 14.586 -13.298 257 2HG PRO 31 HG3 PRO 31 3.678 15.268 -13.214 258 1HD PRO 31 HD2 PRO 31 2.896 13.289 -15.004 259 2HD PRO 31 HD3 PRO 31 4.576 13.590 -14.506 260 H MET 32 H MET 32 2.398 10.387 -10.393 261 HA MET 32 HA MET 32 -0.476 10.950 -10.844 262 1HB MET 32 HB2 MET 32 0.964 8.687 -11.988 263 2HB MET 32 HB3 MET 32 -0.352 8.160 -10.938 264 1HG MET 32 HG2 MET 32 -1.958 9.467 -12.169 265 2HG MET 32 HG3 MET 32 -0.683 10.254 -13.100 266 1HE MET 32 HE1 MET 32 -1.780 6.746 -11.932 267 2HE MET 32 HE2 MET 32 -1.161 5.694 -13.203 268 3HE MET 32 HE3 MET 32 -0.042 6.603 -12.176 269 H THR 33 H THR 33 -1.728 9.164 -9.418 270 HA THR 33 HA THR 33 -0.346 9.167 -6.769 271 HB THR 33 HB THR 33 -2.323 10.437 -6.535 272 HG1 THR 33 HG1 THR 33 -3.157 9.286 -4.995 273 1HG2 THR 33 HG21 THR 33 -3.465 8.414 -8.442 274 2HG2 THR 33 HG22 THR 33 -4.541 9.362 -7.413 275 3HG2 THR 33 HG23 THR 33 -3.470 10.174 -8.556 276 H PHE 34 H PHE 34 0.550 7.168 -6.468 277 HA PHE 34 HA PHE 34 -0.716 4.772 -7.602 278 1HB PHE 34 HB2 PHE 34 1.800 5.285 -6.019 279 2HB PHE 34 HB3 PHE 34 1.224 3.644 -6.315 280 HD1 PHE 34 HD1 PHE 34 2.359 6.780 -7.952 281 HD2 PHE 34 HD2 PHE 34 1.401 2.624 -8.471 282 HE1 PHE 34 HE1 PHE 34 3.340 6.837 -10.228 283 HE2 PHE 34 HE2 PHE 34 2.383 2.681 -10.744 284 HZ PHE 34 HZ PHE 34 3.352 4.786 -11.626 285 H ARG 35 H ARG 35 -1.596 3.060 -6.355 286 HA ARG 35 HA ARG 35 -2.136 3.725 -3.489 287 1HB ARG 35 HB2 ARG 35 -4.154 4.054 -4.919 288 2HB ARG 35 HB3 ARG 35 -4.040 2.367 -5.422 289 1HG ARG 35 HG2 ARG 35 -5.353 1.910 -3.636 290 2HG ARG 35 HG3 ARG 35 -3.910 2.196 -2.662 291 1HD ARG 35 HD2 ARG 35 -4.514 4.485 -2.282 292 2HD ARG 35 HD3 ARG 35 -5.791 4.415 -3.496 293 HE ARG 35 HE ARG 35 -6.188 2.494 -1.344 294 1HH1 ARG 35 HH11 ARG 35 -6.312 5.850 -2.087 295 2HH1 ARG 35 HH12 ARG 35 -7.759 6.137 -1.181 296 1HH2 ARG 35 HH21 ARG 35 -8.178 2.811 -0.291 297 2HH2 ARG 35 HH22 ARG 35 -8.816 4.416 -0.162 298 H LEU 36 H LEU 36 -1.216 2.190 -2.204 299 HA LEU 36 HA LEU 36 0.097 -0.116 -2.996 300 1HB LEU 36 HB2 LEU 36 -1.496 0.322 -0.452 301 2HB LEU 36 HB3 LEU 36 -0.373 -1.017 -0.698 302 HG LEU 36 HG LEU 36 0.266 1.942 -0.664 303 1HD1 LEU 36 HD11 LEU 36 0.105 0.514 1.477 304 2HD1 LEU 36 HD12 LEU 36 1.552 -0.306 0.892 305 3HD1 LEU 36 HD13 LEU 36 1.594 1.424 1.231 306 1HD2 LEU 36 HD21 LEU 36 1.792 -0.412 -1.752 307 2HD2 LEU 36 HD22 LEU 36 1.622 1.207 -2.429 308 3HD2 LEU 36 HD23 LEU 36 2.668 0.940 -1.033 309 H LEU 37 H LEU 37 -0.529 -2.012 -3.895 310 HA LEU 37 HA LEU 37 -3.414 -2.525 -4.240 311 1HB LEU 37 HB2 LEU 37 -0.882 -3.531 -5.468 312 2HB LEU 37 HB3 LEU 37 -2.303 -4.573 -5.533 313 HG LEU 37 HG LEU 37 -2.431 -1.671 -6.355 314 1HD1 LEU 37 HD11 LEU 37 -1.018 -3.808 -7.669 315 2HD1 LEU 37 HD12 LEU 37 -2.415 -3.351 -8.641 316 3HD1 LEU 37 HD13 LEU 37 -1.217 -2.137 -8.193 317 1HD2 LEU 37 HD21 LEU 37 -4.158 -4.111 -6.543 318 2HD2 LEU 37 HD22 LEU 37 -4.610 -2.447 -6.177 319 3HD2 LEU 37 HD23 LEU 37 -4.258 -2.920 -7.839 320 H LEU 38 H LEU 38 -4.396 -4.543 -3.655 321 HA LEU 38 HA LEU 38 -4.767 -6.417 -2.297 322 1HB LEU 38 HB2 LEU 38 -1.770 -6.429 -1.874 323 2HB LEU 38 HB3 LEU 38 -2.883 -7.785 -1.689 324 HG LEU 38 HG LEU 38 -2.559 -6.323 -4.313 325 1HD1 LEU 38 HD11 LEU 38 -0.383 -7.333 -3.437 326 2HD1 LEU 38 HD12 LEU 38 -1.177 -8.905 -3.549 327 3HD1 LEU 38 HD13 LEU 38 -0.931 -7.934 -5.001 328 1HD2 LEU 38 HD21 LEU 38 -4.040 -8.667 -3.285 329 2HD2 LEU 38 HD22 LEU 38 -4.399 -7.625 -4.662 330 3HD2 LEU 38 HD23 LEU 38 -3.223 -8.929 -4.827 331 H VAL 39 H VAL 39 -3.889 -3.487 -1.243 332 HA VAL 39 HA VAL 39 -4.209 -4.310 1.607 333 HB VAL 39 HB VAL 39 -2.516 -2.790 2.345 334 1HG1 VAL 39 HG11 VAL 39 -1.781 -4.558 0.036 335 2HG1 VAL 39 HG12 VAL 39 -0.541 -3.523 0.745 336 3HG1 VAL 39 HG13 VAL 39 -1.366 -4.720 1.742 337 1HG2 VAL 39 HG21 VAL 39 -3.097 -1.002 0.678 338 2HG2 VAL 39 HG22 VAL 39 -1.361 -1.255 0.855 339 3HG2 VAL 39 HG23 VAL 39 -2.210 -1.914 -0.544 340 H ASP 40 H ASP 40 -5.423 -2.827 2.862 341 HA ASP 40 HA ASP 40 -6.568 -0.509 1.359 342 1HB ASP 40 HB2 ASP 40 -8.300 -2.163 1.342 343 2HB ASP 40 HB3 ASP 40 -8.011 -2.579 3.032 344 H THR 41 H THR 41 -6.404 1.378 2.489 345 HA THR 41 HA THR 41 -5.113 1.471 5.049 346 HB THR 41 HB THR 41 -4.996 3.354 3.482 347 HG1 THR 41 HG1 THR 41 -5.635 4.996 4.991 348 1HG2 THR 41 HG21 THR 41 -7.869 2.965 3.456 349 2HG2 THR 41 HG22 THR 41 -7.467 4.644 3.810 350 3HG2 THR 41 HG23 THR 41 -6.860 3.884 2.338 351 HA PRO 42 HA PRO 42 -8.557 0.779 7.726 352 1HB PRO 42 HB2 PRO 42 -7.484 1.862 9.995 353 2HB PRO 42 HB3 PRO 42 -6.968 0.301 9.331 354 1HG PRO 42 HG2 PRO 42 -5.610 2.965 9.167 355 2HG PRO 42 HG3 PRO 42 -4.900 1.348 9.321 356 1HD PRO 42 HD2 PRO 42 -5.034 2.761 6.940 357 2HD PRO 42 HD3 PRO 42 -4.907 0.990 7.045 358 H GLU 43 H GLU 43 -7.043 3.965 8.410 359 HA GLU 43 HA GLU 43 -9.402 5.435 7.599 360 1HB GLU 43 HB2 GLU 43 -9.393 4.370 10.253 361 2HB GLU 43 HB3 GLU 43 -9.191 6.119 10.367 362 1HG GLU 43 HG2 GLU 43 -11.121 6.036 8.489 363 2HG GLU 43 HG3 GLU 43 -11.499 4.542 9.347 364 H THR 44 H THR 44 -8.961 7.677 7.524 365 HA THR 44 HA THR 44 -6.773 8.916 8.915 366 HB THR 44 HB THR 44 -5.354 7.595 7.455 367 HG1 THR 44 HG1 THR 44 -4.902 9.874 7.749 368 1HG2 THR 44 HG21 THR 44 -7.354 7.403 5.751 369 2HG2 THR 44 HG22 THR 44 -6.602 8.821 5.019 370 3HG2 THR 44 HG23 THR 44 -5.690 7.319 5.170 371 H LYS 45 H LYS 45 -9.573 9.416 8.144 372 HA LYS 45 HA LYS 45 -9.624 11.447 6.083 373 1HB LYS 45 HB2 LYS 45 -11.589 11.160 8.369 374 2HB LYS 45 HB3 LYS 45 -11.882 11.860 6.777 375 1HG LYS 45 HG2 LYS 45 -11.584 9.684 5.718 376 2HG LYS 45 HG3 LYS 45 -11.157 8.956 7.267 377 1HD LYS 45 HD2 LYS 45 -13.353 8.488 7.506 378 2HD LYS 45 HD3 LYS 45 -13.585 10.216 7.781 379 1HE LYS 45 HE2 LYS 45 -13.804 10.506 5.287 380 2HE LYS 45 HE3 LYS 45 -13.784 8.749 5.138 381 1HZ LYS 45 HZ1 LYS 45 -15.705 10.229 6.846 382 2HZ LYS 45 HZ2 LYS 45 -16.040 9.759 5.248 383 3HZ LYS 45 HZ3 LYS 45 -15.748 8.581 6.432 384 H HIS 46 H HIS 46 -8.909 11.431 9.502 385 HA HIS 46 HA HIS 46 -9.236 14.281 9.900 386 1HB HIS 46 HB2 HIS 46 -7.958 12.033 11.430 387 2HB HIS 46 HB3 HIS 46 -7.643 13.701 11.908 388 HD1 HIS 46 HD1 HIS 46 -10.525 11.283 11.416 389 HD2 HIS 46 HD2 HIS 46 -9.756 14.941 13.264 390 HE1 HIS 46 HE1 HIS 46 -12.585 11.846 12.777 391 HA PRO 47 HA PRO 47 -5.405 15.702 8.249 392 1HB PRO 47 HB2 PRO 47 -5.114 17.972 9.740 393 2HB PRO 47 HB3 PRO 47 -6.330 17.806 8.462 394 1HG PRO 47 HG2 PRO 47 -6.687 17.744 11.418 395 2HG PRO 47 HG3 PRO 47 -7.813 18.272 10.159 396 1HD PRO 47 HD2 PRO 47 -7.891 15.796 11.500 397 2HD PRO 47 HD3 PRO 47 -8.763 16.197 10.004 398 H LYS 48 H LYS 48 -5.073 16.830 11.601 399 HA LYS 48 HA LYS 48 -2.636 15.109 11.837 400 1HB LYS 48 HB2 LYS 48 -2.433 17.719 11.730 401 2HB LYS 48 HB3 LYS 48 -3.008 17.654 13.396 402 1HG LYS 48 HG2 LYS 48 -0.902 15.694 12.838 403 2HG LYS 48 HG3 LYS 48 -0.372 17.359 12.599 404 1HD LYS 48 HD2 LYS 48 -1.619 17.748 14.903 405 2HD LYS 48 HD3 LYS 48 -1.335 16.018 15.100 406 1HE LYS 48 HE2 LYS 48 1.105 16.522 14.447 407 2HE LYS 48 HE3 LYS 48 0.704 18.215 14.735 408 1HZ LYS 48 HZ1 LYS 48 0.157 16.106 16.736 409 2HZ LYS 48 HZ2 LYS 48 1.644 16.923 16.673 410 3HZ LYS 48 HZ3 LYS 48 0.211 17.786 16.967 411 H LYS 49 H LYS 49 -5.312 16.625 13.646 412 HA LYS 49 HA LYS 49 -4.884 15.541 16.181 413 1HB LYS 49 HB2 LYS 49 -6.769 17.051 15.639 414 2HB LYS 49 HB3 LYS 49 -7.549 15.746 14.743 415 1HG LYS 49 HG2 LYS 49 -7.157 14.447 17.052 416 2HG LYS 49 HG3 LYS 49 -7.221 16.092 17.689 417 1HD LYS 49 HD2 LYS 49 -9.374 16.410 16.403 418 2HD LYS 49 HD3 LYS 49 -9.336 14.684 16.040 419 1HE LYS 49 HE2 LYS 49 -9.194 15.766 18.863 420 2HE LYS 49 HE3 LYS 49 -10.715 15.337 18.079 421 1HZ LYS 49 HZ1 LYS 49 -8.635 13.337 17.885 422 2HZ LYS 49 HZ2 LYS 49 -9.193 13.622 19.462 423 3HZ LYS 49 HZ3 LYS 49 -10.287 13.161 18.246 424 H GLY 50 H GLY 50 -6.990 14.001 13.720 425 1HA GLY 50 HA2 GLY 50 -7.024 11.694 13.118 426 2HA GLY 50 HA3 GLY 50 -5.836 11.374 14.382 427 H VAL 51 H VAL 51 -7.735 9.570 14.435 428 HA VAL 51 HA VAL 51 -9.846 10.505 16.325 429 HB VAL 51 HB VAL 51 -9.852 7.727 15.231 430 1HG1 VAL 51 HG11 VAL 51 -11.576 9.055 16.769 431 2HG1 VAL 51 HG12 VAL 51 -12.159 9.631 15.208 432 3HG1 VAL 51 HG13 VAL 51 -12.136 7.902 15.557 433 1HG2 VAL 51 HG21 VAL 51 -10.174 10.239 13.603 434 2HG2 VAL 51 HG22 VAL 51 -9.363 8.734 13.170 435 3HG2 VAL 51 HG23 VAL 51 -11.125 8.806 13.206 436 H GLU 52 H GLU 52 -10.275 7.769 17.313 437 HA GLU 52 HA GLU 52 -7.951 7.661 19.182 438 1HB GLU 52 HB2 GLU 52 -10.668 6.377 19.551 439 2HB GLU 52 HB3 GLU 52 -9.432 6.657 20.779 440 1HG GLU 52 HG2 GLU 52 -10.038 9.150 19.495 441 2HG GLU 52 HG3 GLU 52 -11.546 8.398 20.015 442 H LYS 53 H LYS 53 -9.625 5.913 16.711 443 HA LYS 53 HA LYS 53 -8.682 3.272 17.464 444 1HB LYS 53 HB2 LYS 53 -10.131 4.492 15.189 445 2HB LYS 53 HB3 LYS 53 -9.152 3.080 14.784 446 1HG LYS 53 HG2 LYS 53 -11.149 2.064 15.411 447 2HG LYS 53 HG3 LYS 53 -10.277 2.062 16.945 448 1HD LYS 53 HD2 LYS 53 -11.425 4.490 17.118 449 2HD LYS 53 HD3 LYS 53 -12.623 3.689 16.101 450 1HE LYS 53 HE2 LYS 53 -11.615 2.703 18.786 451 2HE LYS 53 HE3 LYS 53 -13.208 3.385 18.460 452 1HZ LYS 53 HZ1 LYS 53 -12.204 1.021 16.997 453 2HZ LYS 53 HZ2 LYS 53 -12.998 0.870 18.492 454 3HZ LYS 53 HZ3 LYS 53 -13.805 1.558 17.165 455 H TYR 54 H TYR 54 -7.939 4.580 14.282 456 HA TYR 54 HA TYR 54 -5.056 4.707 14.884 457 1HB TYR 54 HB2 TYR 54 -6.073 2.802 12.758 458 2HB TYR 54 HB3 TYR 54 -4.407 3.014 13.298 459 HD1 TYR 54 HD1 TYR 54 -3.747 2.325 15.615 460 HD2 TYR 54 HD2 TYR 54 -7.612 1.427 13.972 461 HE1 TYR 54 HE1 TYR 54 -4.099 0.616 17.378 462 HE2 TYR 54 HE2 TYR 54 -7.965 -0.281 15.734 463 HH TYR 54 HH TYR 54 -6.835 -0.521 18.312 464 H GLY 55 H GLY 55 -6.687 6.799 14.147 465 1HA GLY 55 HA2 GLY 55 -7.050 7.291 11.395 466 2HA GLY 55 HA3 GLY 55 -6.760 8.555 12.591 467 HA PRO 56 HA PRO 56 -2.732 9.172 10.937 468 1HB PRO 56 HB2 PRO 56 -1.408 10.034 13.165 469 2HB PRO 56 HB3 PRO 56 -2.640 11.003 12.337 470 1HG PRO 56 HG2 PRO 56 -2.827 9.522 14.910 471 2HG PRO 56 HG3 PRO 56 -3.700 10.966 14.376 472 1HD PRO 56 HD2 PRO 56 -4.712 8.324 14.408 473 2HD PRO 56 HD3 PRO 56 -5.450 9.722 13.596 474 H GLU 57 H GLU 57 -2.759 6.563 10.918 475 HA GLU 57 HA GLU 57 -0.373 5.694 12.499 476 1HB GLU 57 HB2 GLU 57 -2.951 4.662 12.733 477 2HB GLU 57 HB3 GLU 57 -2.136 3.518 11.666 478 1HG GLU 57 HG2 GLU 57 -1.584 2.676 13.776 479 2HG GLU 57 HG3 GLU 57 -0.186 3.691 13.414 480 H ALA 58 H ALA 58 -2.341 4.491 9.755 481 HA ALA 58 HA ALA 58 -0.007 3.424 8.406 482 1HB ALA 58 HB1 ALA 58 -2.275 2.477 8.087 483 2HB ALA 58 HB2 ALA 58 -2.789 3.985 7.331 484 3HB ALA 58 HB3 ALA 58 -1.566 2.981 6.552 485 H SER 59 H SER 59 -1.974 6.361 8.066 486 HA SER 59 HA SER 59 -0.794 7.355 5.682 487 1HB SER 59 HB2 SER 59 -1.415 9.638 6.705 488 2HB SER 59 HB3 SER 59 -2.726 8.487 6.462 489 HG SER 59 HG SER 59 -2.872 8.188 8.573 490 H ALA 60 H ALA 60 0.045 8.171 9.072 491 HA ALA 60 HA ALA 60 2.398 9.646 8.390 492 1HB ALA 60 HB1 ALA 60 1.439 8.279 10.899 493 2HB ALA 60 HB2 ALA 60 3.047 8.999 10.831 494 3HB ALA 60 HB3 ALA 60 1.621 10.005 10.581 495 H PHE 61 H PHE 61 1.790 6.219 8.838 496 HA PHE 61 HA PHE 61 4.430 5.276 9.183 497 1HB PHE 61 HB2 PHE 61 2.392 3.847 9.297 498 2HB PHE 61 HB3 PHE 61 2.232 3.980 7.545 499 HD1 PHE 61 HD1 PHE 61 3.870 2.928 6.041 500 HD2 PHE 61 HD2 PHE 61 4.152 2.511 10.307 501 HE1 PHE 61 HE1 PHE 61 5.477 1.060 5.752 502 HE2 PHE 61 HE2 PHE 61 5.758 0.644 10.018 503 HZ PHE 61 HZ PHE 61 6.420 -0.082 7.741 504 H THR 62 H THR 62 2.760 4.985 6.058 505 HA THR 62 HA THR 62 5.097 4.785 4.494 506 HB THR 62 HB THR 62 2.486 6.060 3.626 507 HG1 THR 62 HG1 THR 62 3.005 3.587 4.502 508 1HG2 THR 62 HG21 THR 62 4.638 4.564 2.106 509 2HG2 THR 62 HG22 THR 62 3.127 5.158 1.416 510 3HG2 THR 62 HG23 THR 62 4.328 6.298 2.021 511 H LYS 63 H LYS 63 3.662 7.562 5.990 512 HA LYS 63 HA LYS 63 4.631 9.642 4.334 513 1HB LYS 63 HB2 LYS 63 3.262 9.513 6.704 514 2HB LYS 63 HB3 LYS 63 4.817 10.163 7.224 515 1HG LYS 63 HG2 LYS 63 4.656 12.002 5.687 516 2HG LYS 63 HG3 LYS 63 3.259 11.284 4.882 517 1HD LYS 63 HD2 LYS 63 2.210 11.375 7.307 518 2HD LYS 63 HD3 LYS 63 3.418 12.635 7.553 519 1HE LYS 63 HE2 LYS 63 2.301 14.110 6.246 520 2HE LYS 63 HE3 LYS 63 1.986 12.896 5.007 521 1HZ LYS 63 HZ1 LYS 63 0.209 12.007 6.388 522 2HZ LYS 63 HZ2 LYS 63 0.499 13.204 7.558 523 3HZ LYS 63 HZ3 LYS 63 -0.065 13.644 6.021 524 H LYS 64 H LYS 64 6.139 8.566 7.381 525 HA LYS 64 HA LYS 64 8.670 9.804 6.766 526 1HB LYS 64 HB2 LYS 64 7.893 7.673 8.775 527 2HB LYS 64 HB3 LYS 64 9.496 8.406 8.697 528 1HG LYS 64 HG2 LYS 64 8.788 10.287 9.721 529 2HG LYS 64 HG3 LYS 64 7.368 10.405 8.684 530 1HD LYS 64 HD2 LYS 64 6.083 9.697 10.388 531 2HD LYS 64 HD3 LYS 64 6.971 8.172 10.403 532 1HE LYS 64 HE2 LYS 64 7.989 8.730 12.330 533 2HE LYS 64 HE3 LYS 64 8.568 10.240 11.626 534 1HZ LYS 64 HZ1 LYS 64 5.788 9.912 12.582 535 2HZ LYS 64 HZ2 LYS 64 7.036 10.422 13.610 536 3HZ LYS 64 HZ3 LYS 64 6.624 11.353 12.251 537 H MET 65 H MET 65 7.267 6.694 6.066 538 HA MET 65 HA MET 65 9.604 5.163 5.603 539 1HB MET 65 HB2 MET 65 7.297 4.238 5.601 540 2HB MET 65 HB3 MET 65 6.998 5.045 4.062 541 1HG MET 65 HG2 MET 65 7.745 3.109 3.138 542 2HG MET 65 HG3 MET 65 9.349 3.720 3.548 543 1HE MET 65 HE1 MET 65 9.797 1.121 3.210 544 2HE MET 65 HE2 MET 65 9.306 -0.138 4.341 545 3HE MET 65 HE3 MET 65 8.114 0.579 3.258 546 H VAL 66 H VAL 66 7.629 6.508 2.958 547 HA VAL 66 HA VAL 66 9.763 6.390 1.057 548 HB VAL 66 HB VAL 66 8.309 7.807 -0.354 549 1HG1 VAL 66 HG11 VAL 66 7.753 5.265 0.637 550 2HG1 VAL 66 HG12 VAL 66 6.225 6.127 0.816 551 3HG1 VAL 66 HG13 VAL 66 6.996 6.016 -0.767 552 1HG2 VAL 66 HG21 VAL 66 6.935 8.218 2.292 553 2HG2 VAL 66 HG22 VAL 66 7.375 9.415 1.074 554 3HG2 VAL 66 HG23 VAL 66 6.011 8.333 0.793 555 H GLU 67 H GLU 67 8.812 8.845 3.374 556 HA GLU 67 HA GLU 67 10.199 11.052 2.197 557 1HB GLU 67 HB2 GLU 67 9.208 10.386 4.943 558 2HB GLU 67 HB3 GLU 67 10.318 11.743 4.755 559 1HG GLU 67 HG2 GLU 67 8.722 12.449 2.806 560 2HG GLU 67 HG3 GLU 67 7.562 11.390 3.609 561 H ASN 68 H ASN 68 11.283 8.417 4.275 562 HA ASN 68 HA ASN 68 14.036 9.578 4.201 563 1HB ASN 68 HB2 ASN 68 12.579 7.836 6.151 564 2HB ASN 68 HB3 ASN 68 14.325 7.638 6.000 565 1HD2 ASN 68 HD21 ASN 68 12.084 9.288 7.796 566 2HD2 ASN 68 HD22 ASN 68 12.990 10.667 8.192 567 H ALA 69 H ALA 69 12.166 7.406 2.570 568 HA ALA 69 HA ALA 69 13.800 5.077 2.389 569 1HB ALA 69 HB1 ALA 69 11.878 6.363 0.436 570 2HB ALA 69 HB2 ALA 69 12.681 4.828 0.109 571 3HB ALA 69 HB3 ALA 69 11.585 4.975 1.483 572 H LYS 70 H LYS 70 15.532 4.570 1.014 573 HA LYS 70 HA LYS 70 17.130 6.818 0.089 574 1HB LYS 70 HB2 LYS 70 17.559 3.870 -0.465 575 2HB LYS 70 HB3 LYS 70 18.769 5.151 -0.537 576 1HG LYS 70 HG2 LYS 70 17.452 5.166 2.040 577 2HG LYS 70 HG3 LYS 70 18.117 3.567 1.699 578 1HD LYS 70 HD2 LYS 70 19.978 5.639 0.894 579 2HD LYS 70 HD3 LYS 70 19.537 5.821 2.592 580 1HE LYS 70 HE2 LYS 70 21.107 4.227 2.971 581 2HE LYS 70 HE3 LYS 70 19.884 3.101 2.383 582 1HZ LYS 70 HZ1 LYS 70 20.767 3.467 0.122 583 2HZ LYS 70 HZ2 LYS 70 22.020 4.404 0.785 584 3HZ LYS 70 HZ3 LYS 70 21.899 2.756 1.172 585 H LYS 71 H LYS 71 15.499 4.100 -1.541 586 HA LYS 71 HA LYS 71 15.263 5.834 -3.954 587 1HB LYS 71 HB2 LYS 71 15.843 2.901 -4.259 588 2HB LYS 71 HB3 LYS 71 16.125 4.216 -5.402 589 1HG LYS 71 HG2 LYS 71 17.814 5.118 -3.682 590 2HG LYS 71 HG3 LYS 71 17.701 3.532 -2.918 591 1HD LYS 71 HD2 LYS 71 18.071 3.421 -5.835 592 2HD LYS 71 HD3 LYS 71 19.420 4.160 -4.972 593 1HE LYS 71 HE2 LYS 71 19.941 2.222 -3.838 594 2HE LYS 71 HE3 LYS 71 18.273 1.650 -3.835 595 1HZ LYS 71 HZ1 LYS 71 18.721 1.580 -6.414 596 2HZ LYS 71 HZ2 LYS 71 20.327 1.388 -5.896 597 3HZ LYS 71 HZ3 LYS 71 19.141 0.281 -5.402 598 H ILE 72 H ILE 72 13.167 5.906 -4.594 599 HA ILE 72 HA ILE 72 11.304 3.838 -3.555 600 HB ILE 72 HB ILE 72 10.744 6.473 -4.951 601 1HG1 ILE 72 HG12 ILE 72 9.827 6.592 -2.329 602 2HG1 ILE 72 HG13 ILE 72 11.370 5.750 -2.181 603 1HG2 ILE 72 HG21 ILE 72 9.061 4.387 -4.887 604 2HG2 ILE 72 HG22 ILE 72 8.737 5.031 -3.278 605 3HG2 ILE 72 HG23 ILE 72 8.493 6.046 -4.699 606 1HD1 ILE 72 HD11 ILE 72 11.192 8.208 -3.897 607 2HD1 ILE 72 HD12 ILE 72 11.319 8.380 -2.147 608 3HD1 ILE 72 HD13 ILE 72 12.586 7.544 -3.045 609 H GLU 73 H GLU 73 10.948 2.137 -4.904 610 HA GLU 73 HA GLU 73 10.881 2.699 -7.844 611 1HB GLU 73 HB2 GLU 73 11.762 0.135 -6.485 612 2HB GLU 73 HB3 GLU 73 11.774 0.455 -8.220 613 1HG GLU 73 HG2 GLU 73 13.316 2.411 -7.742 614 2HG GLU 73 HG3 GLU 73 13.448 1.807 -6.090 615 H VAL 74 H VAL 74 8.993 2.150 -8.829 616 HA VAL 74 HA VAL 74 6.949 0.725 -7.220 617 HB VAL 74 HB VAL 74 5.415 1.459 -9.074 618 1HG1 VAL 74 HG11 VAL 74 6.948 3.212 -7.257 619 2HG1 VAL 74 HG12 VAL 74 6.133 4.055 -8.575 620 3HG1 VAL 74 HG13 VAL 74 5.203 3.053 -7.461 621 1HG2 VAL 74 HG21 VAL 74 7.488 1.579 -10.679 622 2HG2 VAL 74 HG22 VAL 74 6.188 2.756 -10.867 623 3HG2 VAL 74 HG23 VAL 74 7.672 3.207 -10.027 624 H GLU 75 H GLU 75 5.640 -0.972 -8.365 625 HA GLU 75 HA GLU 75 7.098 -2.319 -10.579 626 1HB GLU 75 HB2 GLU 75 7.943 -3.425 -8.590 627 2HB GLU 75 HB3 GLU 75 6.307 -3.628 -7.960 628 1HG GLU 75 HG2 GLU 75 5.736 -5.199 -9.651 629 2HG GLU 75 HG3 GLU 75 7.142 -4.776 -10.628 630 H PHE 76 H PHE 76 5.330 -1.737 -11.943 631 HA PHE 76 HA PHE 76 2.582 -2.109 -11.345 632 1HB PHE 76 HB2 PHE 76 4.058 -2.260 -13.988 633 2HB PHE 76 HB3 PHE 76 2.301 -2.272 -13.851 634 HD1 PHE 76 HD1 PHE 76 1.169 -0.315 -12.631 635 HD2 PHE 76 HD2 PHE 76 5.257 -0.229 -13.946 636 HE1 PHE 76 HE1 PHE 76 1.165 2.163 -12.486 637 HE2 PHE 76 HE2 PHE 76 5.252 2.247 -13.802 638 HZ PHE 76 HZ PHE 76 3.206 3.441 -13.072 639 H ASP 77 H ASP 77 1.318 -3.928 -11.247 640 HA ASP 77 HA ASP 77 2.594 -6.538 -11.354 641 1HB ASP 77 HB2 ASP 77 0.426 -5.582 -10.034 642 2HB ASP 77 HB3 ASP 77 -0.370 -6.373 -11.396 643 H LYS 78 H LYS 78 0.786 -8.194 -12.602 644 HA LYS 78 HA LYS 78 1.276 -7.532 -15.437 645 1HB LYS 78 HB2 LYS 78 0.654 -9.829 -15.887 646 2HB LYS 78 HB3 LYS 78 1.730 -9.824 -14.490 647 1HG LYS 78 HG2 LYS 78 -1.019 -9.474 -13.648 648 2HG LYS 78 HG3 LYS 78 -0.852 -10.934 -14.624 649 1HD LYS 78 HD2 LYS 78 1.387 -11.035 -13.010 650 2HD LYS 78 HD3 LYS 78 0.165 -10.364 -11.930 651 1HE LYS 78 HE2 LYS 78 -0.107 -12.689 -11.673 652 2HE LYS 78 HE3 LYS 78 -1.362 -12.260 -12.834 653 1HZ LYS 78 HZ1 LYS 78 0.868 -12.719 -14.352 654 2HZ LYS 78 HZ2 LYS 78 0.918 -13.939 -13.174 655 3HZ LYS 78 HZ3 LYS 78 -0.454 -13.769 -14.161 656 H GLY 79 H GLY 79 -1.068 -6.687 -13.335 657 1HA GLY 79 HA2 GLY 79 -3.368 -7.230 -15.119 658 2HA GLY 79 HA3 GLY 79 -3.457 -6.504 -13.514 659 H GLN 80 H GLN 80 -4.854 -4.883 -14.651 660 HA GLN 80 HA GLN 80 -4.014 -3.178 -16.719 661 1HB GLN 80 HB2 GLN 80 -5.634 -2.430 -14.264 662 2HB GLN 80 HB3 GLN 80 -5.568 -1.512 -15.768 663 1HG GLN 80 HG2 GLN 80 -7.201 -2.801 -16.620 664 2HG GLN 80 HG3 GLN 80 -6.169 -4.220 -16.434 665 1HE2 GLN 80 HE21 GLN 80 -6.886 -5.767 -14.951 666 2HE2 GLN 80 HE22 GLN 80 -8.056 -5.490 -13.754 667 H ARG 81 H ARG 81 -3.465 -0.744 -16.303 668 HA ARG 81 HA ARG 81 -1.109 -0.699 -14.479 669 1HB ARG 81 HB2 ARG 81 -1.467 0.142 -17.136 670 2HB ARG 81 HB3 ARG 81 -1.392 1.629 -16.190 671 1HG ARG 81 HG2 ARG 81 0.715 0.930 -15.181 672 2HG ARG 81 HG3 ARG 81 0.622 -0.630 -16.000 673 1HD ARG 81 HD2 ARG 81 0.319 1.436 -17.961 674 2HD ARG 81 HD3 ARG 81 1.742 1.799 -16.986 675 HE ARG 81 HE ARG 81 1.374 -0.603 -18.681 676 1HH1 ARG 81 HH11 ARG 81 2.770 -0.709 -15.827 677 2HH1 ARG 81 HH12 ARG 81 4.423 -0.729 -16.341 678 1HH2 ARG 81 HH21 ARG 81 3.699 0.195 -19.603 679 2HH2 ARG 81 HH22 ARG 81 4.950 -0.218 -18.478 680 H THR 82 H THR 82 -4.287 0.540 -14.856 681 HA THR 82 HA THR 82 -3.900 2.216 -12.444 682 HB THR 82 HB THR 82 -5.041 4.139 -13.456 683 HG1 THR 82 HG1 THR 82 -5.828 4.056 -15.442 684 1HG2 THR 82 HG21 THR 82 -2.458 3.513 -13.798 685 2HG2 THR 82 HG22 THR 82 -2.951 3.530 -15.491 686 3HG2 THR 82 HG23 THR 82 -3.166 4.969 -14.496 687 H ASP 83 H ASP 83 -6.317 3.212 -12.007 688 HA ASP 83 HA ASP 83 -8.138 0.851 -12.241 689 1HB ASP 83 HB2 ASP 83 -9.221 1.763 -10.163 690 2HB ASP 83 HB3 ASP 83 -7.544 1.273 -9.926 691 H LYS 84 H LYS 84 -10.508 2.090 -11.475 692 HA LYS 84 HA LYS 84 -11.308 3.362 -13.935 693 1HB LYS 84 HB2 LYS 84 -13.488 3.575 -12.885 694 2HB LYS 84 HB3 LYS 84 -12.816 2.000 -12.460 695 1HG LYS 84 HG2 LYS 84 -12.202 2.735 -10.276 696 2HG LYS 84 HG3 LYS 84 -12.463 4.428 -10.695 697 1HD LYS 84 HD2 LYS 84 -14.517 4.158 -9.779 698 2HD LYS 84 HD3 LYS 84 -14.914 3.292 -11.264 699 1HE LYS 84 HE2 LYS 84 -15.368 1.530 -9.914 700 2HE LYS 84 HE3 LYS 84 -13.618 1.363 -9.771 701 1HZ LYS 84 HZ1 LYS 84 -14.697 3.364 -8.026 702 2HZ LYS 84 HZ2 LYS 84 -15.341 1.825 -7.723 703 3HZ LYS 84 HZ3 LYS 84 -13.660 2.064 -7.676 704 H TYR 85 H TYR 85 -9.719 4.582 -11.205 705 HA TYR 85 HA TYR 85 -10.816 7.319 -11.644 706 1HB TYR 85 HB2 TYR 85 -9.148 6.174 -9.388 707 2HB TYR 85 HB3 TYR 85 -9.642 7.864 -9.503 708 HD1 TYR 85 HD1 TYR 85 -12.068 8.466 -9.455 709 HD2 TYR 85 HD2 TYR 85 -10.692 4.465 -8.718 710 HE1 TYR 85 HE1 TYR 85 -14.265 7.895 -8.456 711 HE2 TYR 85 HE2 TYR 85 -12.889 3.893 -7.718 712 HH TYR 85 HH TYR 85 -15.628 5.859 -8.059 713 H GLY 86 H GLY 86 -8.382 5.476 -12.837 714 1HA GLY 86 HA2 GLY 86 -6.602 6.227 -14.228 715 2HA GLY 86 HA3 GLY 86 -6.831 7.857 -13.596 716 H ARG 87 H ARG 87 -6.801 6.143 -10.865 717 HA ARG 87 HA ARG 87 -4.200 6.962 -10.056 718 1HB ARG 87 HB2 ARG 87 -5.849 4.687 -8.909 719 2HB ARG 87 HB3 ARG 87 -4.554 5.559 -8.087 720 1HG ARG 87 HG2 ARG 87 -5.933 7.683 -8.495 721 2HG ARG 87 HG3 ARG 87 -7.265 6.606 -8.921 722 1HD ARG 87 HD2 ARG 87 -6.496 5.456 -6.603 723 2HD ARG 87 HD3 ARG 87 -6.019 7.122 -6.271 724 HE ARG 87 HE ARG 87 -8.530 7.534 -7.137 725 1HH1 ARG 87 HH11 ARG 87 -7.886 7.283 -4.175 726 2HH1 ARG 87 HH12 ARG 87 -9.047 6.100 -3.675 727 1HH2 ARG 87 HH21 ARG 87 -9.762 5.049 -6.903 728 2HH2 ARG 87 HH22 ARG 87 -10.109 4.835 -5.220 729 H GLY 88 H GLY 88 -2.267 5.702 -9.749 730 1HA GLY 88 HA2 GLY 88 -1.971 3.570 -11.773 731 2HA GLY 88 HA3 GLY 88 -0.657 4.346 -10.890 732 H LEU 89 H LEU 89 -2.002 1.441 -11.245 733 HA LEU 89 HA LEU 89 -1.960 0.725 -8.355 734 1HB LEU 89 HB2 LEU 89 -2.727 -1.005 -10.725 735 2HB LEU 89 HB3 LEU 89 -3.001 -1.359 -9.018 736 HG LEU 89 HG LEU 89 -4.225 0.932 -10.585 737 1HD1 LEU 89 HD11 LEU 89 -5.034 -1.814 -10.032 738 2HD1 LEU 89 HD12 LEU 89 -6.209 -0.650 -9.418 739 3HD1 LEU 89 HD13 LEU 89 -5.760 -0.634 -11.123 740 1HD2 LEU 89 HD21 LEU 89 -4.479 0.109 -7.676 741 2HD2 LEU 89 HD22 LEU 89 -3.781 1.610 -8.284 742 3HD2 LEU 89 HD23 LEU 89 -5.510 1.303 -8.466 743 H ALA 90 H ALA 90 -0.060 -0.031 -7.572 744 HA ALA 90 HA ALA 90 1.474 -2.060 -8.940 745 1HB ALA 90 HB1 ALA 90 2.422 0.799 -9.044 746 2HB ALA 90 HB2 ALA 90 3.578 -0.532 -9.045 747 3HB ALA 90 HB3 ALA 90 2.386 -0.398 -10.339 748 H TYR 91 H TYR 91 3.626 -2.414 -7.693 749 HA TYR 91 HA TYR 91 3.003 -2.125 -4.809 750 1HB TYR 91 HB2 TYR 91 5.254 -3.677 -6.119 751 2HB TYR 91 HB3 TYR 91 4.684 -3.834 -4.457 752 HD1 TYR 91 HD1 TYR 91 2.209 -4.513 -4.111 753 HD2 TYR 91 HD2 TYR 91 4.311 -4.993 -7.826 754 HE1 TYR 91 HE1 TYR 91 0.533 -6.188 -4.843 755 HE2 TYR 91 HE2 TYR 91 2.635 -6.667 -8.559 756 HH TYR 91 HH TYR 91 -0.257 -7.330 -6.643 757 H ILE 92 H ILE 92 4.212 -0.838 -3.450 758 HA ILE 92 HA ILE 92 6.334 0.810 -4.730 759 HB ILE 92 HB ILE 92 4.962 1.184 -2.049 760 1HG1 ILE 92 HG12 ILE 92 4.439 2.501 -4.735 761 2HG1 ILE 92 HG13 ILE 92 3.364 1.363 -3.922 762 1HG2 ILE 92 HG21 ILE 92 6.726 2.985 -3.737 763 2HG2 ILE 92 HG22 ILE 92 5.870 3.499 -2.283 764 3HG2 ILE 92 HG23 ILE 92 7.140 2.281 -2.174 765 1HD1 ILE 92 HD11 ILE 92 4.121 3.518 -2.132 766 2HD1 ILE 92 HD12 ILE 92 3.400 4.157 -3.609 767 3HD1 ILE 92 HD13 ILE 92 2.510 2.996 -2.623 768 H TYR 93 H TYR 93 8.453 0.577 -4.130 769 HA TYR 93 HA TYR 93 9.006 -1.179 -1.768 770 1HB TYR 93 HB2 TYR 93 10.412 -1.004 -4.442 771 2HB TYR 93 HB3 TYR 93 11.128 -1.793 -3.036 772 HD1 TYR 93 HD1 TYR 93 8.405 -1.919 -5.519 773 HD2 TYR 93 HD2 TYR 93 10.227 -3.878 -2.156 774 HE1 TYR 93 HE1 TYR 93 7.099 -3.969 -6.006 775 HE2 TYR 93 HE2 TYR 93 8.919 -5.929 -2.644 776 HH TYR 93 HH TYR 93 7.632 -6.961 -4.201 777 H ALA 94 H ALA 94 10.063 -0.102 -0.182 778 HA ALA 94 HA ALA 94 11.765 2.233 -0.969 779 1HB ALA 94 HB1 ALA 94 9.944 1.804 1.400 780 2HB ALA 94 HB2 ALA 94 11.262 2.975 1.464 781 3HB ALA 94 HB3 ALA 94 9.976 3.159 0.271 782 H ASP 95 H ASP 95 13.865 2.210 -0.209 783 HA ASP 95 HA ASP 95 15.806 1.363 0.804 784 1HB ASP 95 HB2 ASP 95 13.787 0.319 2.814 785 2HB ASP 95 HB3 ASP 95 15.532 0.372 3.061 786 H GLY 96 H GLY 96 14.416 -0.205 -1.233 787 1HA GLY 96 HA2 GLY 96 14.618 -2.335 -2.198 788 2HA GLY 96 HA3 GLY 96 15.866 -2.665 -0.995 789 H LYS 97 H LYS 97 12.633 -1.715 -0.036 790 HA LYS 97 HA LYS 97 12.083 -4.545 0.756 791 1HB LYS 97 HB2 LYS 97 12.521 -2.274 2.471 792 2HB LYS 97 HB3 LYS 97 10.855 -2.826 2.648 793 1HG LYS 97 HG2 LYS 97 11.641 -5.121 3.049 794 2HG LYS 97 HG3 LYS 97 13.311 -4.594 2.844 795 1HD LYS 97 HD2 LYS 97 11.475 -3.366 4.909 796 2HD LYS 97 HD3 LYS 97 12.480 -4.773 5.258 797 1HE LYS 97 HE2 LYS 97 14.332 -3.501 5.455 798 2HE LYS 97 HE3 LYS 97 14.006 -2.686 3.925 799 1HZ LYS 97 HZ1 LYS 97 12.375 -1.296 5.102 800 2HZ LYS 97 HZ2 LYS 97 12.820 -2.031 6.567 801 3HZ LYS 97 HZ3 LYS 97 13.948 -1.099 5.705 802 H MET 98 H MET 98 9.725 -4.914 1.171 803 HA MET 98 HA MET 98 8.129 -3.512 -0.874 804 1HB MET 98 HB2 MET 98 8.128 -6.047 -0.508 805 2HB MET 98 HB3 MET 98 7.203 -5.730 0.961 806 1HG MET 98 HG2 MET 98 5.308 -5.361 -0.209 807 2HG MET 98 HG3 MET 98 6.132 -4.273 -1.326 808 1HE MET 98 HE1 MET 98 6.940 -7.646 -0.151 809 2HE MET 98 HE2 MET 98 5.389 -8.302 -0.693 810 3HE MET 98 HE3 MET 98 6.876 -8.740 -1.530 811 H VAL 99 H VAL 99 7.419 -1.536 -0.119 812 HA VAL 99 HA VAL 99 6.864 -0.826 2.549 813 HB VAL 99 HB VAL 99 5.638 0.168 -0.037 814 1HG1 VAL 99 HG11 VAL 99 4.917 0.706 2.741 815 2HG1 VAL 99 HG12 VAL 99 5.418 2.170 1.893 816 3HG1 VAL 99 HG13 VAL 99 4.095 1.192 1.257 817 1HG2 VAL 99 HG21 VAL 99 8.188 0.443 0.958 818 2HG2 VAL 99 HG22 VAL 99 7.417 1.583 -0.144 819 3HG2 VAL 99 HG23 VAL 99 7.395 1.885 1.594 820 H ASN 100 H ASN 100 4.711 -2.291 0.122 821 HA ASN 100 HA ASN 100 2.297 -2.192 1.594 822 1HB ASN 100 HB2 ASN 100 3.253 -4.411 -0.245 823 2HB ASN 100 HB3 ASN 100 1.580 -4.110 0.228 824 1HD2 ASN 100 HD21 ASN 100 0.594 -3.286 -1.640 825 2HD2 ASN 100 HD22 ASN 100 1.206 -1.998 -2.561 826 H GLU 101 H GLU 101 4.902 -4.623 1.650 827 HA GLU 101 HA GLU 101 3.591 -6.299 3.613 828 1HB GLU 101 HB2 GLU 101 5.542 -6.864 1.961 829 2HB GLU 101 HB3 GLU 101 6.575 -6.210 3.232 830 1HG GLU 101 HG2 GLU 101 4.960 -7.825 4.705 831 2HG GLU 101 HG3 GLU 101 4.997 -8.717 3.183 832 H ALA 102 H ALA 102 5.461 -3.391 3.769 833 HA ALA 102 HA ALA 102 6.442 -3.676 6.459 834 1HB ALA 102 HB1 ALA 102 6.379 -1.621 4.408 835 2HB ALA 102 HB2 ALA 102 6.033 -0.939 5.998 836 3HB ALA 102 HB3 ALA 102 7.527 -1.837 5.730 837 H LEU 103 H LEU 103 3.533 -2.147 5.099 838 HA LEU 103 HA LEU 103 2.503 -1.293 7.658 839 1HB LEU 103 HB2 LEU 103 0.990 -1.846 5.085 840 2HB LEU 103 HB3 LEU 103 0.409 -0.893 6.451 841 HG LEU 103 HG LEU 103 2.906 0.213 5.830 842 1HD1 LEU 103 HD11 LEU 103 2.263 -1.207 3.609 843 2HD1 LEU 103 HD12 LEU 103 1.428 0.307 3.259 844 3HD1 LEU 103 HD13 LEU 103 3.166 0.309 3.560 845 1HD2 LEU 103 HD21 LEU 103 0.136 0.957 5.987 846 2HD2 LEU 103 HD22 LEU 103 1.557 1.989 6.152 847 3HD2 LEU 103 HD23 LEU 103 0.844 1.718 4.562 848 H VAL 104 H VAL 104 1.735 -4.077 5.546 849 HA VAL 104 HA VAL 104 -0.205 -5.271 7.235 850 HB VAL 104 HB VAL 104 1.804 -6.609 5.395 851 1HG1 VAL 104 HG11 VAL 104 0.658 -8.068 7.146 852 2HG1 VAL 104 HG12 VAL 104 -0.864 -7.669 6.351 853 3HG1 VAL 104 HG13 VAL 104 0.389 -8.539 5.468 854 1HG2 VAL 104 HG21 VAL 104 -0.642 -5.051 4.973 855 2HG2 VAL 104 HG22 VAL 104 0.582 -5.549 3.807 856 3HG2 VAL 104 HG23 VAL 104 -0.725 -6.652 4.239 857 H ARG 105 H ARG 105 3.302 -5.257 7.402 858 HA ARG 105 HA ARG 105 3.541 -7.406 9.315 859 1HB ARG 105 HB2 ARG 105 5.426 -6.530 7.907 860 2HB ARG 105 HB3 ARG 105 5.423 -5.067 8.893 861 1HG ARG 105 HG2 ARG 105 6.975 -6.255 10.098 862 2HG ARG 105 HG3 ARG 105 5.523 -6.907 10.859 863 1HD ARG 105 HD2 ARG 105 6.154 -8.958 10.183 864 2HD ARG 105 HD3 ARG 105 5.918 -8.433 8.516 865 HE ARG 105 HE ARG 105 8.255 -8.494 8.309 866 1HH1 ARG 105 HH11 ARG 105 8.044 -9.660 11.269 867 2HH1 ARG 105 HH12 ARG 105 9.337 -8.765 11.995 868 1HH2 ARG 105 HH21 ARG 105 9.622 -6.528 9.361 869 2HH2 ARG 105 HH22 ARG 105 10.230 -6.993 10.915 870 H GLN 106 H GLN 106 3.326 -3.860 9.623 871 HA GLN 106 HA GLN 106 3.339 -4.069 12.562 872 1HB GLN 106 HB2 GLN 106 4.412 -2.162 11.230 873 2HB GLN 106 HB3 GLN 106 2.771 -1.593 10.923 874 1HG GLN 106 HG2 GLN 106 2.425 -0.972 13.110 875 2HG GLN 106 HG3 GLN 106 3.470 -2.244 13.745 876 1HE2 GLN 106 HE21 GLN 106 4.144 -0.058 14.997 877 2HE2 GLN 106 HE22 GLN 106 5.461 0.765 14.312 878 H GLY 107 H GLY 107 1.083 -4.839 10.395 879 1HA GLY 107 HA2 GLY 107 -1.258 -4.958 10.455 880 2HA GLY 107 HA3 GLY 107 -1.105 -4.710 12.194 881 H LEU 108 H LEU 108 -0.678 -2.742 9.227 882 HA LEU 108 HA LEU 108 -2.196 -0.575 10.629 883 1HB LEU 108 HB2 LEU 108 -0.003 -0.325 8.546 884 2HB LEU 108 HB3 LEU 108 -0.907 1.025 9.234 885 HG LEU 108 HG LEU 108 0.864 -0.908 10.757 886 1HD1 LEU 108 HD11 LEU 108 1.772 1.092 9.284 887 2HD1 LEU 108 HD12 LEU 108 1.214 2.069 10.644 888 3HD1 LEU 108 HD13 LEU 108 2.424 0.811 10.898 889 1HD2 LEU 108 HD21 LEU 108 -1.121 1.178 11.603 890 2HD2 LEU 108 HD22 LEU 108 -0.775 -0.393 12.328 891 3HD2 LEU 108 HD23 LEU 108 0.339 0.954 12.567 892 H ALA 109 H ALA 109 -1.994 -2.654 7.902 893 HA ALA 109 HA ALA 109 -4.381 -1.301 6.737 894 1HB ALA 109 HB1 ALA 109 -1.761 -1.582 5.516 895 2HB ALA 109 HB2 ALA 109 -2.987 -2.425 4.569 896 3HB ALA 109 HB3 ALA 109 -3.175 -0.708 4.925 897 H LYS 110 H LYS 110 -5.855 -2.770 5.737 898 HA LYS 110 HA LYS 110 -5.381 -5.611 6.504 899 1HB LYS 110 HB2 LYS 110 -7.828 -3.924 6.107 900 2HB LYS 110 HB3 LYS 110 -7.948 -5.670 5.885 901 1HG LYS 110 HG2 LYS 110 -7.231 -6.104 8.120 902 2HG LYS 110 HG3 LYS 110 -6.702 -4.437 8.349 903 1HD LYS 110 HD2 LYS 110 -8.735 -4.143 9.320 904 2HD LYS 110 HD3 LYS 110 -9.340 -4.093 7.664 905 1HE LYS 110 HE2 LYS 110 -10.687 -5.773 8.490 906 2HE LYS 110 HE3 LYS 110 -9.310 -6.747 7.975 907 1HZ LYS 110 HZ1 LYS 110 -8.900 -5.693 10.579 908 2HZ LYS 110 HZ2 LYS 110 -10.350 -6.569 10.516 909 3HZ LYS 110 HZ3 LYS 110 -8.892 -7.312 10.061 910 H VAL 111 H VAL 111 -5.141 -7.146 4.933 911 HA VAL 111 HA VAL 111 -4.681 -6.474 2.221 912 HB VAL 111 HB VAL 111 -5.553 -9.132 3.402 913 1HG1 VAL 111 HG11 VAL 111 -5.513 -8.462 0.745 914 2HG1 VAL 111 HG12 VAL 111 -3.869 -9.058 0.980 915 3HG1 VAL 111 HG13 VAL 111 -5.246 -10.092 1.363 916 1HG2 VAL 111 HG21 VAL 111 -3.342 -7.824 4.108 917 2HG2 VAL 111 HG22 VAL 111 -3.317 -9.567 3.838 918 3HG2 VAL 111 HG23 VAL 111 -2.751 -8.471 2.578 919 H ALA 112 H ALA 112 -6.135 -5.797 0.717 920 HA ALA 112 HA ALA 112 -8.802 -7.071 0.617 921 1HB ALA 112 HB1 ALA 112 -8.918 -4.998 2.114 922 2HB ALA 112 HB2 ALA 112 -8.584 -4.056 0.662 923 3HB ALA 112 HB3 ALA 112 -10.045 -5.041 0.759 924 H TYR 113 H TYR 113 -10.032 -6.050 -1.365 925 HA TYR 113 HA TYR 113 -10.054 -5.813 -3.697 926 1HB TYR 113 HB2 TYR 113 -7.559 -4.215 -3.047 927 2HB TYR 113 HB3 TYR 113 -8.370 -4.212 -4.616 928 HD1 TYR 113 HD1 TYR 113 -11.202 -4.246 -3.919 929 HD2 TYR 113 HD2 TYR 113 -7.961 -2.115 -2.073 930 HE1 TYR 113 HE1 TYR 113 -12.797 -2.536 -3.093 931 HE2 TYR 113 HE2 TYR 113 -9.558 -0.405 -1.245 932 HH TYR 113 HH TYR 113 -11.745 0.448 -1.719 933 H VAL 114 H VAL 114 -9.553 -8.186 -3.749 934 HA VAL 114 HA VAL 114 -6.813 -8.663 -4.857 935 HB VAL 114 HB VAL 114 -8.615 -10.601 -3.374 936 1HG1 VAL 114 HG11 VAL 114 -6.339 -10.961 -5.157 937 2HG1 VAL 114 HG12 VAL 114 -6.012 -11.610 -3.549 938 3HG1 VAL 114 HG13 VAL 114 -7.413 -12.174 -4.459 939 1HG2 VAL 114 HG21 VAL 114 -6.690 -8.658 -2.481 940 2HG2 VAL 114 HG22 VAL 114 -7.632 -9.793 -1.515 941 3HG2 VAL 114 HG23 VAL 114 -6.063 -10.276 -2.163 942 H TYR 115 H TYR 115 -7.611 -8.164 -7.002 943 HA TYR 115 HA TYR 115 -9.442 -10.265 -8.091 944 1HB TYR 115 HB2 TYR 115 -9.049 -7.501 -9.259 945 2HB TYR 115 HB3 TYR 115 -10.314 -8.669 -9.643 946 HD1 TYR 115 HD1 TYR 115 -12.092 -9.190 -7.975 947 HD2 TYR 115 HD2 TYR 115 -9.201 -6.081 -7.323 948 HE1 TYR 115 HE1 TYR 115 -13.515 -8.245 -6.177 949 HE2 TYR 115 HE2 TYR 115 -10.622 -5.135 -5.525 950 HH TYR 115 HH TYR 115 -12.612 -6.417 -3.891 951 H LYS 116 H LYS 116 -8.501 -11.571 -9.581 952 HA LYS 116 HA LYS 116 -5.758 -11.225 -10.378 953 1HB LYS 116 HB2 LYS 116 -7.951 -13.016 -11.467 954 2HB LYS 116 HB3 LYS 116 -6.256 -13.126 -11.945 955 1HG LYS 116 HG2 LYS 116 -5.685 -13.413 -9.494 956 2HG LYS 116 HG3 LYS 116 -7.414 -13.558 -9.180 957 1HD LYS 116 HD2 LYS 116 -6.489 -15.261 -11.387 958 2HD LYS 116 HD3 LYS 116 -5.742 -15.656 -9.838 959 1HE LYS 116 HE2 LYS 116 -7.636 -16.824 -9.411 960 2HE LYS 116 HE3 LYS 116 -8.391 -15.251 -9.152 961 1HZ LYS 116 HZ1 LYS 116 -8.943 -15.191 -11.519 962 2HZ LYS 116 HZ2 LYS 116 -8.276 -16.738 -11.719 963 3HZ LYS 116 HZ3 LYS 116 -9.650 -16.526 -10.741 964 HA PRO 117 HA PRO 117 -4.677 -12.079 -12.043 965 1HB PRO 117 HB2 PRO 117 -2.766 -11.111 -13.736 966 2HB PRO 117 HB3 PRO 117 -4.044 -12.221 -14.258 967 1HG PRO 117 HG2 PRO 117 -3.733 -9.331 -14.820 968 2HG PRO 117 HG3 PRO 117 -4.632 -10.561 -15.721 969 1HD PRO 117 HD2 PRO 117 -5.702 -8.624 -13.901 970 2HD PRO 117 HD3 PRO 117 -6.580 -9.937 -14.715 971 H ASN 118 H ASN 118 -5.195 -8.971 -11.255 972 HA ASN 118 HA ASN 118 -2.490 -8.151 -10.495 973 1HB ASN 118 HB2 ASN 118 -5.249 -7.026 -10.182 974 2HB ASN 118 HB3 ASN 118 -3.969 -6.428 -9.127 975 1HD2 ASN 118 HD21 ASN 118 -5.331 -4.974 -11.372 976 2HD2 ASN 118 HD22 ASN 118 -4.092 -4.532 -12.444 977 H ASN 119 H ASN 119 -2.091 -10.207 -9.254 978 HA ASN 119 HA ASN 119 -2.517 -9.731 -6.416 979 1HB ASN 119 HB2 ASN 119 -3.811 -11.705 -5.909 980 2HB ASN 119 HB3 ASN 119 -4.683 -10.811 -7.153 981 1HD2 ASN 119 HD21 ASN 119 -4.917 -13.702 -6.712 982 2HD2 ASN 119 HD22 ASN 119 -4.360 -14.463 -8.124 983 H THR 120 H THR 120 -0.385 -10.282 -8.489 984 HA THR 120 HA THR 120 0.763 -12.832 -8.247 985 HB THR 120 HB THR 120 2.529 -10.406 -8.122 986 HG1 THR 120 HG1 THR 120 1.173 -11.213 -10.463 987 1HG2 THR 120 HG21 THR 120 3.132 -12.970 -8.473 988 2HG2 THR 120 HG22 THR 120 2.688 -12.606 -10.141 989 3HG2 THR 120 HG23 THR 120 3.988 -11.706 -9.358 990 H HIS 121 H HIS 121 1.440 -9.987 -6.169 991 HA HIS 121 HA HIS 121 2.772 -11.748 -4.214 992 1HB HIS 121 HB2 HIS 121 2.433 -8.783 -4.541 993 2HB HIS 121 HB3 HIS 121 2.856 -9.431 -2.955 994 HD1 HIS 121 HD1 HIS 121 4.829 -11.567 -3.475 995 HD2 HIS 121 HD2 HIS 121 4.808 -8.073 -5.749 996 HE1 HIS 121 HE1 HIS 121 7.139 -11.359 -4.489 997 H GLU 122 H GLU 122 -0.003 -12.291 -4.610 998 HA GLU 122 HA GLU 122 -1.551 -11.023 -2.498 999 1HB GLU 122 HB2 GLU 122 -2.767 -11.895 -4.377 1000 2HB GLU 122 HB3 GLU 122 -2.012 -13.479 -4.207 1001 1HG GLU 122 HG2 GLU 122 -4.318 -13.455 -3.289 1002 2HG GLU 122 HG3 GLU 122 -3.119 -13.802 -2.043 1003 H GLN 123 H GLN 123 -0.155 -14.293 -2.916 1004 HA GLN 123 HA GLN 123 -0.812 -15.258 -0.329 1005 1HB GLN 123 HB2 GLN 123 0.710 -16.153 -2.560 1006 2HB GLN 123 HB3 GLN 123 1.744 -16.287 -1.138 1007 1HG GLN 123 HG2 GLN 123 -0.704 -17.205 -0.218 1008 2HG GLN 123 HG3 GLN 123 -0.628 -17.842 -1.861 1009 1HE2 GLN 123 HE21 GLN 123 2.217 -18.196 -2.060 1010 2HE2 GLN 123 HE22 GLN 123 2.676 -19.418 -0.976 1011 H LEU 124 H LEU 124 2.012 -13.431 -1.480 1012 HA LEU 124 HA LEU 124 3.564 -13.534 0.886 1013 1HB LEU 124 HB2 LEU 124 3.789 -12.282 -1.559 1014 2HB LEU 124 HB3 LEU 124 3.591 -10.921 -0.455 1015 HG LEU 124 HG LEU 124 5.982 -11.581 -0.750 1016 1HD1 LEU 124 HD11 LEU 124 4.510 -11.399 1.771 1017 2HD1 LEU 124 HD12 LEU 124 6.042 -12.257 1.944 1018 3HD1 LEU 124 HD13 LEU 124 6.017 -10.616 1.295 1019 1HD2 LEU 124 HD21 LEU 124 4.966 -14.159 -0.637 1020 2HD2 LEU 124 HD22 LEU 124 6.673 -13.731 -0.533 1021 3HD2 LEU 124 HD23 LEU 124 5.732 -13.968 0.940 1022 H LEU 125 H LEU 125 1.300 -10.943 -0.119 1023 HA LEU 125 HA LEU 125 1.362 -9.600 2.414 1024 1HB LEU 125 HB2 LEU 125 -0.717 -9.606 0.205 1025 2HB LEU 125 HB3 LEU 125 -0.751 -8.511 1.589 1026 HG LEU 125 HG LEU 125 1.457 -8.726 -0.478 1027 1HD1 LEU 125 HD11 LEU 125 -0.924 -7.039 -0.153 1028 2HD1 LEU 125 HD12 LEU 125 0.564 -6.112 -0.347 1029 3HD1 LEU 125 HD13 LEU 125 0.090 -7.288 -1.574 1030 1HD2 LEU 125 HD21 LEU 125 1.309 -7.517 2.229 1031 2HD2 LEU 125 HD22 LEU 125 2.715 -8.067 1.317 1032 3HD2 LEU 125 HD23 LEU 125 2.001 -6.492 0.971 1033 H ARG 126 H ARG 126 -0.181 -12.483 1.366 1034 HA ARG 126 HA ARG 126 -2.405 -12.435 3.223 1035 1HB ARG 126 HB2 ARG 126 -1.963 -13.925 1.076 1036 2HB ARG 126 HB3 ARG 126 -1.206 -15.003 2.249 1037 1HG ARG 126 HG2 ARG 126 -3.196 -15.395 3.383 1038 2HG ARG 126 HG3 ARG 126 -3.909 -13.867 2.868 1039 1HD ARG 126 HD2 ARG 126 -4.396 -14.683 0.708 1040 2HD ARG 126 HD3 ARG 126 -3.272 -16.032 0.869 1041 HE ARG 126 HE ARG 126 -5.362 -16.213 2.848 1042 1HH1 ARG 126 HH11 ARG 126 -6.780 -15.679 0.202 1043 2HH1 ARG 126 HH12 ARG 126 -7.048 -17.294 -0.365 1044 1HH2 ARG 126 HH21 ARG 126 -4.775 -18.724 1.830 1045 2HH2 ARG 126 HH22 ARG 126 -5.914 -19.018 0.558 1046 H LYS 127 H LYS 127 0.359 -14.712 3.236 1047 HA LYS 127 HA LYS 127 0.159 -15.520 5.894 1048 1HB LYS 127 HB2 LYS 127 2.572 -16.031 5.794 1049 2HB LYS 127 HB3 LYS 127 1.768 -16.503 4.296 1050 1HG LYS 127 HG2 LYS 127 2.472 -14.336 3.279 1051 2HG LYS 127 HG3 LYS 127 3.358 -13.961 4.759 1052 1HD LYS 127 HD2 LYS 127 3.840 -16.388 3.002 1053 2HD LYS 127 HD3 LYS 127 4.844 -14.937 3.031 1054 1HE LYS 127 HE2 LYS 127 4.491 -15.831 5.727 1055 2HE LYS 127 HE3 LYS 127 4.997 -17.209 4.750 1056 1HZ LYS 127 HZ1 LYS 127 6.528 -15.093 3.890 1057 2HZ LYS 127 HZ2 LYS 127 6.505 -14.951 5.583 1058 3HZ LYS 127 HZ3 LYS 127 7.039 -16.390 4.861 1059 H SER 128 H SER 128 1.868 -12.679 4.623 1060 HA SER 128 HA SER 128 2.988 -11.744 7.045 1061 1HB SER 128 HB2 SER 128 1.888 -10.186 4.687 1062 2HB SER 128 HB3 SER 128 2.842 -9.470 5.983 1063 HG SER 128 HG SER 128 3.674 -11.672 4.395 1064 H GLU 129 H GLU 129 -0.247 -11.172 5.660 1065 HA GLU 129 HA GLU 129 -1.181 -9.410 7.702 1066 1HB GLU 129 HB2 GLU 129 -2.263 -10.087 5.417 1067 2HB GLU 129 HB3 GLU 129 -2.993 -11.395 6.347 1068 1HG GLU 129 HG2 GLU 129 -3.153 -8.701 7.575 1069 2HG GLU 129 HG3 GLU 129 -4.115 -8.938 6.116 1070 H ALA 130 H ALA 130 -1.236 -12.956 7.437 1071 HA ALA 130 HA ALA 130 -2.763 -13.466 9.787 1072 1HB ALA 130 HB1 ALA 130 -1.642 -15.032 7.852 1073 2HB ALA 130 HB2 ALA 130 -0.562 -15.356 9.208 1074 3HB ALA 130 HB3 ALA 130 -2.294 -15.658 9.367 1075 H GLN 131 H GLN 131 0.611 -12.626 9.317 1076 HA GLN 131 HA GLN 131 1.501 -13.355 11.967 1077 1HB GLN 131 HB2 GLN 131 2.939 -12.849 9.883 1078 2HB GLN 131 HB3 GLN 131 2.694 -11.149 10.283 1079 1HG GLN 131 HG2 GLN 131 3.882 -11.309 12.287 1080 2HG GLN 131 HG3 GLN 131 3.627 -13.050 12.414 1081 1HE2 GLN 131 HE21 GLN 131 5.152 -14.443 11.390 1082 2HE2 GLN 131 HE22 GLN 131 6.513 -13.873 10.551 1083 H ALA 132 H ALA 132 0.409 -10.290 10.504 1084 HA ALA 132 HA ALA 132 0.696 -8.718 12.882 1085 1HB ALA 132 HB1 ALA 132 -0.070 -8.243 10.246 1086 2HB ALA 132 HB2 ALA 132 -1.534 -7.911 11.171 1087 3HB ALA 132 HB3 ALA 132 -0.041 -7.048 11.544 1088 H LYS 133 H LYS 133 -1.721 -10.992 11.818 1089 HA LYS 133 HA LYS 133 -3.854 -10.104 13.545 1090 1HB LYS 133 HB2 LYS 133 -3.257 -12.511 11.907 1091 2HB LYS 133 HB3 LYS 133 -4.378 -12.743 13.247 1092 1HG LYS 133 HG2 LYS 133 -5.938 -11.236 12.379 1093 2HG LYS 133 HG3 LYS 133 -4.731 -10.392 11.410 1094 1HD LYS 133 HD2 LYS 133 -6.074 -11.703 9.896 1095 2HD LYS 133 HD3 LYS 133 -4.502 -12.493 10.024 1096 1HE LYS 133 HE2 LYS 133 -5.536 -14.378 10.681 1097 2HE LYS 133 HE3 LYS 133 -6.110 -13.533 12.119 1098 1HZ LYS 133 HZ1 LYS 133 -7.542 -13.007 9.641 1099 2HZ LYS 133 HZ2 LYS 133 -7.738 -14.559 10.306 1100 3HZ LYS 133 HZ3 LYS 133 -8.134 -13.188 11.224 1101 H LYS 134 H LYS 134 -1.537 -12.826 13.865 1102 HA LYS 134 HA LYS 134 -2.296 -13.429 16.570 1103 1HB LYS 134 HB2 LYS 134 0.024 -14.556 16.601 1104 2HB LYS 134 HB3 LYS 134 -1.138 -15.147 15.414 1105 1HG LYS 134 HG2 LYS 134 -0.068 -14.048 13.631 1106 2HG LYS 134 HG3 LYS 134 0.786 -12.941 14.706 1107 1HD LYS 134 HD2 LYS 134 2.492 -14.395 15.022 1108 2HD LYS 134 HD3 LYS 134 1.395 -15.756 15.249 1109 1HE LYS 134 HE2 LYS 134 1.143 -15.108 12.541 1110 2HE LYS 134 HE3 LYS 134 2.869 -14.963 12.869 1111 1HZ LYS 134 HZ1 LYS 134 2.328 -17.209 14.163 1112 2HZ LYS 134 HZ2 LYS 134 1.155 -17.310 12.943 1113 3HZ LYS 134 HZ3 LYS 134 2.797 -17.175 12.531 1114 H GLU 135 H GLU 135 -0.214 -11.025 15.166 1115 HA GLU 135 HA GLU 135 1.172 -10.460 17.695 1116 1HB GLU 135 HB2 GLU 135 1.263 -9.392 14.904 1117 2HB GLU 135 HB3 GLU 135 1.828 -8.347 16.207 1118 1HG GLU 135 HG2 GLU 135 3.062 -10.640 16.918 1119 2HG GLU 135 HG3 GLU 135 2.994 -10.877 15.171 1120 H LYS 136 H LYS 136 -1.777 -9.619 16.207 1121 HA LYS 136 HA LYS 136 -3.372 -7.961 16.679 1122 1HB LYS 136 HB2 LYS 136 -2.294 -7.857 19.475 1123 2HB LYS 136 HB3 LYS 136 -3.970 -7.908 18.929 1124 1HG LYS 136 HG2 LYS 136 -3.526 -10.269 18.115 1125 2HG LYS 136 HG3 LYS 136 -1.978 -10.186 18.960 1126 1HD LYS 136 HD2 LYS 136 -3.080 -9.832 21.083 1127 2HD LYS 136 HD3 LYS 136 -4.650 -9.680 20.295 1128 1HE LYS 136 HE2 LYS 136 -4.763 -11.965 19.786 1129 2HE LYS 136 HE3 LYS 136 -3.018 -12.178 19.925 1130 1HZ LYS 136 HZ1 LYS 136 -4.513 -11.311 22.290 1131 2HZ LYS 136 HZ2 LYS 136 -4.621 -12.941 21.825 1132 3HZ LYS 136 HZ3 LYS 136 -3.109 -12.262 22.187 1133 H LEU 137 H LEU 137 -1.665 -6.586 15.367 1134 HA LEU 137 HA LEU 137 -0.580 -4.425 17.111 1135 1HB LEU 137 HB2 LEU 137 0.359 -5.738 14.706 1136 2HB LEU 137 HB3 LEU 137 0.254 -3.994 14.459 1137 HG LEU 137 HG LEU 137 1.481 -5.067 16.983 1138 1HD1 LEU 137 HD11 LEU 137 2.691 -4.996 14.226 1139 2HD1 LEU 137 HD12 LEU 137 3.703 -4.749 15.650 1140 3HD1 LEU 137 HD13 LEU 137 2.808 -6.257 15.453 1141 1HD2 LEU 137 HD21 LEU 137 1.462 -2.535 15.384 1142 2HD2 LEU 137 HD22 LEU 137 1.325 -2.759 17.128 1143 3HD2 LEU 137 HD23 LEU 137 2.897 -2.902 16.342 1144 H ASN 138 H ASN 138 -2.179 -2.926 17.390 1145 HA ASN 138 HA ASN 138 -3.626 -1.178 16.838 1146 1HB ASN 138 HB2 ASN 138 -2.559 -1.613 14.034 1147 2HB ASN 138 HB3 ASN 138 -3.445 -0.196 14.597 1148 1HD2 ASN 138 HD21 ASN 138 -0.342 -1.250 14.013 1149 2HD2 ASN 138 HD22 ASN 138 0.500 -0.254 15.099 1150 H ILE 139 H ILE 139 -4.391 -1.903 13.621 1151 HA ILE 139 HA ILE 139 -7.080 -2.295 13.897 1152 HB ILE 139 HB ILE 139 -5.335 -3.856 11.972 1153 1HG1 ILE 139 HG12 ILE 139 -6.677 -1.416 11.039 1154 2HG1 ILE 139 HG13 ILE 139 -5.464 -1.109 12.283 1155 1HG2 ILE 139 HG21 ILE 139 -8.237 -3.507 12.323 1156 2HG2 ILE 139 HG22 ILE 139 -7.669 -3.165 10.690 1157 3HG2 ILE 139 HG23 ILE 139 -7.353 -4.738 11.422 1158 1HD1 ILE 139 HD11 ILE 139 -4.686 -3.022 10.150 1159 2HD1 ILE 139 HD12 ILE 139 -4.850 -1.336 9.658 1160 3HD1 ILE 139 HD13 ILE 139 -3.729 -1.774 10.947 1161 H TRP 140 H TRP 140 -4.624 -4.845 14.250 1162 HA TRP 140 HA TRP 140 -6.692 -6.847 14.836 1163 1HB TRP 140 HB2 TRP 140 -3.673 -7.037 15.066 1164 2HB TRP 140 HB3 TRP 140 -4.808 -8.388 15.093 1165 HD1 TRP 140 HD1 TRP 140 -2.750 -6.402 12.779 1166 HE1 TRP 140 HE1 TRP 140 -3.403 -6.881 10.332 1167 HE3 TRP 140 HE3 TRP 140 -7.142 -8.901 13.510 1168 HZ2 TRP 140 HZ2 TRP 140 -5.510 -8.154 8.876 1169 HZ3 TRP 140 HZ3 TRP 140 -8.451 -9.734 11.578 1170 HH2 TRP 140 HH2 TRP 140 -7.642 -9.364 9.264 1171 H SER 141 H SER 141 -6.863 -4.695 16.631 1172 HA SER 141 HA SER 141 -5.681 -5.810 19.134 1173 1HB SER 141 HB2 SER 141 -6.557 -3.031 18.341 1174 2HB SER 141 HB3 SER 141 -6.348 -3.478 20.032 1175 HG SER 141 HG SER 141 -4.327 -4.127 18.211 1176 H GLU 142 H GLU 142 -7.397 -4.684 20.979 1177 HA GLU 142 HA GLU 142 -9.651 -6.457 20.860 1178 1HB GLU 142 HB2 GLU 142 -10.308 -5.400 22.939 1179 2HB GLU 142 HB3 GLU 142 -8.559 -5.606 22.943 1180 1HG GLU 142 HG2 GLU 142 -8.329 -3.399 23.290 1181 2HG GLU 142 HG3 GLU 142 -9.067 -3.107 21.714 1182 H ASP 143 H ASP 143 -11.587 -4.440 21.924 1183 HA ASP 143 HA ASP 143 -12.087 -2.507 19.827 1184 1HB ASP 143 HB2 ASP 143 -12.676 -4.601 18.623 1185 2HB ASP 143 HB3 ASP 143 -13.852 -4.974 19.883 1186 H ASN 144 H ASN 144 -14.118 -4.608 21.906 1187 HA ASN 144 HA ASN 144 -15.350 -2.135 23.015 1188 1HB ASN 144 HB2 ASN 144 -16.402 -4.638 22.226 1189 2HB ASN 144 HB3 ASN 144 -16.531 -4.588 23.985 1190 1HD2 ASN 144 HD21 ASN 144 -18.214 -3.333 24.850 1191 2HD2 ASN 144 HD22 ASN 144 -19.161 -2.248 23.950 1192 H ALA 145 H ALA 145 -16.042 -2.609 25.480 1193 HA ALA 145 HA ALA 145 -13.609 -2.669 26.986 1194 1HB ALA 145 HB1 ALA 145 -16.470 -2.383 27.533 1195 2HB ALA 145 HB2 ALA 145 -15.622 -3.257 28.808 1196 3HB ALA 145 HB3 ALA 145 -15.094 -1.639 28.347 1197 H ASP 146 H ASP 146 -12.407 -4.440 27.453 1198 HA ASP 146 HA ASP 146 -13.847 -7.023 27.890 1199 1HB ASP 146 HB2 ASP 146 -11.738 -6.365 25.956 1200 2HB ASP 146 HB3 ASP 146 -11.356 -7.769 26.954 1201 H SER 147 H SER 147 -13.329 -7.966 29.806 1202 HA SER 147 HA SER 147 -10.676 -7.493 31.014 1203 1HB SER 147 HB2 SER 147 -12.578 -5.750 31.749 1204 2HB SER 147 HB3 SER 147 -13.003 -7.070 32.836 1205 HG SER 147 HG SER 147 -10.717 -7.077 33.415 1206 H GLY 148 H GLY 148 -10.407 -9.771 30.705 1207 1HA GLY 148 HA2 GLY 148 -10.326 -11.813 32.041 1208 2HA GLY 148 HA3 GLY 148 -11.917 -11.405 32.689 1209 H GLN 149 H GLN 149 -12.459 -13.662 31.985 1210 HA GLN 149 HA GLN 149 -13.245 -13.662 29.101 1211 1HB GLN 149 HB2 GLN 149 -11.587 -15.573 30.572 1212 2HB GLN 149 HB3 GLN 149 -12.968 -16.342 29.789 1213 1HG GLN 149 HG2 GLN 149 -12.343 -15.469 27.640 1214 2HG GLN 149 HG3 GLN 149 -11.124 -14.416 28.357 1215 1HE2 GLN 149 HE21 GLN 149 -9.105 -15.394 29.072 1216 2HE2 GLN 149 HE22 GLN 149 -8.679 -16.977 28.635 1217 HN3 PTP 150 H3 PTP 150 -10.754 -3.878 -7.755 1218 1H5M PTP 150 H51 PTP 150 -7.023 -1.915 -5.839 1219 2H5M PTP 150 H52 PTP 150 -7.847 -1.297 -4.387 1220 3H5M PTP 150 H53 PTP 150 -7.487 -0.200 -5.741 1221 H6 PTP 150 H6 PTP 150 -9.955 0.307 -5.530 1222 H1* PTP 150 H1' PTP 150 -13.002 0.044 -7.452 1223 2H2* PTP 150 H2' PTP 150 -12.898 -0.774 -4.553 1224 H3* PTP 150 H3' PTP 150 -13.732 1.330 -3.812 1225 H4* PTP 150 H4' PTP 150 -12.603 3.074 -5.582 1226 2H5* PTP 150 H5' PTP 150 -11.318 1.118 -3.594 Start of MODEL 15 1 1H ALA 1 H1 ALA 1 4.384 -19.546 -19.540 2 2H ALA 1 H2 ALA 1 4.285 -21.001 -18.667 3 3H ALA 1 H3 ALA 1 5.383 -19.800 -18.190 4 HA ALA 1 HA ALA 1 6.829 -21.124 -19.297 5 1HB ALA 1 HB1 ALA 1 4.357 -22.213 -20.306 6 2HB ALA 1 HB2 ALA 1 5.495 -22.006 -21.637 7 3HB ALA 1 HB3 ALA 1 5.948 -22.972 -20.233 8 H THR 2 H THR 2 5.789 -18.308 -19.830 9 HA THR 2 HA THR 2 6.865 -18.014 -22.606 10 HB THR 2 HB THR 2 4.628 -17.165 -22.552 11 HG1 THR 2 HG1 THR 2 5.826 -15.698 -23.603 12 1HG2 THR 2 HG21 THR 2 5.477 -15.803 -19.985 13 2HG2 THR 2 HG22 THR 2 3.964 -15.458 -20.821 14 3HG2 THR 2 HG23 THR 2 4.264 -17.068 -20.167 15 H SER 3 H SER 3 8.531 -18.260 -20.235 16 HA SER 3 HA SER 3 10.344 -17.173 -19.210 17 1HB SER 3 HB2 SER 3 10.212 -16.324 -21.947 18 2HB SER 3 HB3 SER 3 10.709 -14.952 -20.959 19 HG SER 3 HG SER 3 12.454 -16.331 -21.648 20 H THR 4 H THR 4 8.746 -16.487 -17.516 21 HA THR 4 HA THR 4 8.028 -13.600 -17.680 22 HB THR 4 HB THR 4 7.138 -15.768 -15.753 23 HG1 THR 4 HG1 THR 4 5.949 -14.465 -17.963 24 1HG2 THR 4 HG21 THR 4 7.071 -12.893 -15.566 25 2HG2 THR 4 HG22 THR 4 5.427 -13.520 -15.692 26 3HG2 THR 4 HG23 THR 4 6.492 -14.089 -14.407 27 H LYS 5 H LYS 5 10.177 -15.817 -16.106 28 HA LYS 5 HA LYS 5 11.847 -15.468 -14.493 29 1HB LYS 5 HB2 LYS 5 11.493 -12.859 -15.865 30 2HB LYS 5 HB3 LYS 5 12.319 -12.803 -14.307 31 1HG LYS 5 HG2 LYS 5 13.649 -14.866 -15.303 32 2HG LYS 5 HG3 LYS 5 13.148 -14.164 -16.843 33 1HD LYS 5 HD2 LYS 5 14.087 -11.969 -16.090 34 2HD LYS 5 HD3 LYS 5 14.698 -12.770 -14.642 35 1HE LYS 5 HE2 LYS 5 15.374 -13.757 -17.416 36 2HE LYS 5 HE3 LYS 5 16.344 -12.534 -16.596 37 1HZ LYS 5 HZ1 LYS 5 15.694 -14.892 -15.034 38 2HZ LYS 5 HZ2 LYS 5 16.751 -15.148 -16.339 39 3HZ LYS 5 HZ3 LYS 5 17.149 -14.020 -15.136 40 H LYS 6 H LYS 6 10.476 -12.307 -13.832 41 HA LYS 6 HA LYS 6 8.665 -13.099 -11.756 42 1HB LYS 6 HB2 LYS 6 11.046 -13.714 -10.855 43 2HB LYS 6 HB3 LYS 6 11.210 -11.974 -10.610 44 1HG LYS 6 HG2 LYS 6 9.022 -12.034 -9.347 45 2HG LYS 6 HG3 LYS 6 9.089 -13.794 -9.441 46 1HD LYS 6 HD2 LYS 6 11.007 -13.917 -8.082 47 2HD LYS 6 HD3 LYS 6 11.419 -12.223 -8.354 48 1HE LYS 6 HE2 LYS 6 10.410 -11.834 -6.364 49 2HE LYS 6 HE3 LYS 6 8.897 -12.055 -7.242 50 1HZ LYS 6 HZ1 LYS 6 9.606 -14.586 -6.745 51 2HZ LYS 6 HZ2 LYS 6 10.218 -13.815 -5.364 52 3HZ LYS 6 HZ3 LYS 6 8.571 -13.676 -5.753 53 H LEU 7 H LEU 7 8.235 -11.281 -13.659 54 HA LEU 7 HA LEU 7 7.639 -9.049 -14.043 55 1HB LEU 7 HB2 LEU 7 7.481 -9.466 -11.113 56 2HB LEU 7 HB3 LEU 7 7.532 -7.786 -11.648 57 HG LEU 7 HG LEU 7 5.653 -9.804 -12.883 58 1HD1 LEU 7 HD11 LEU 7 5.570 -8.704 -10.224 59 2HD1 LEU 7 HD12 LEU 7 4.246 -8.029 -11.172 60 3HD1 LEU 7 HD13 LEU 7 4.409 -9.777 -11.008 61 1HD2 LEU 7 HD21 LEU 7 6.298 -7.504 -13.925 62 2HD2 LEU 7 HD22 LEU 7 4.588 -7.919 -13.813 63 3HD2 LEU 7 HD23 LEU 7 5.307 -6.819 -12.637 64 H HIS 8 H HIS 8 8.401 -6.666 -12.980 65 HA HIS 8 HA HIS 8 11.355 -6.710 -12.689 66 1HB HIS 8 HB2 HIS 8 10.713 -6.475 -15.149 67 2HB HIS 8 HB3 HIS 8 9.998 -4.921 -14.720 68 HD1 HIS 8 HD1 HIS 8 11.805 -3.631 -16.106 69 HD2 HIS 8 HD2 HIS 8 13.366 -5.919 -12.991 70 HE1 HIS 8 HE1 HIS 8 14.209 -2.889 -15.806 71 H LYS 9 H LYS 9 12.141 -4.877 -11.565 72 HA LYS 9 HA LYS 9 10.007 -3.228 -10.296 73 1HB LYS 9 HB2 LYS 9 12.895 -3.412 -9.422 74 2HB LYS 9 HB3 LYS 9 11.502 -2.889 -8.474 75 1HG LYS 9 HG2 LYS 9 10.568 -5.171 -8.584 76 2HG LYS 9 HG3 LYS 9 11.964 -5.696 -9.526 77 1HD LYS 9 HD2 LYS 9 12.874 -6.226 -7.516 78 2HD LYS 9 HD3 LYS 9 13.163 -4.492 -7.364 79 1HE LYS 9 HE2 LYS 9 12.026 -5.202 -5.362 80 2HE LYS 9 HE3 LYS 9 10.865 -4.293 -6.329 81 1HZ LYS 9 HZ1 LYS 9 10.992 -7.144 -6.852 82 2HZ LYS 9 HZ2 LYS 9 10.376 -6.706 -5.330 83 3HZ LYS 9 HZ3 LYS 9 9.646 -6.118 -6.747 84 H GLU 10 H GLU 10 9.940 -1.037 -10.645 85 HA GLU 10 HA GLU 10 12.171 0.143 -12.254 86 1HB GLU 10 HB2 GLU 10 9.255 0.980 -12.225 87 2HB GLU 10 HB3 GLU 10 10.523 1.634 -13.263 88 1HG GLU 10 HG2 GLU 10 10.079 -1.320 -13.302 89 2HG GLU 10 HG3 GLU 10 8.894 -0.299 -14.117 90 HA PRO 11 HA PRO 11 12.594 3.169 -9.072 91 1HB PRO 11 HB2 PRO 11 13.640 5.217 -10.545 92 2HB PRO 11 HB3 PRO 11 14.539 3.738 -10.175 93 1HG PRO 11 HG2 PRO 11 13.328 4.604 -12.742 94 2HG PRO 11 HG3 PRO 11 14.684 3.503 -12.451 95 1HD PRO 11 HD2 PRO 11 12.002 2.773 -13.077 96 2HD PRO 11 HD3 PRO 11 13.317 1.683 -12.588 97 H ALA 12 H ALA 12 12.002 5.526 -8.541 98 HA ALA 12 HA ALA 12 9.905 6.770 -10.152 99 1HB ALA 12 HB1 ALA 12 9.033 4.808 -8.437 100 2HB ALA 12 HB2 ALA 12 8.894 6.252 -7.433 101 3HB ALA 12 HB3 ALA 12 8.053 6.170 -8.980 102 H THR 13 H THR 13 8.984 8.724 -8.818 103 HA THR 13 HA THR 13 11.172 9.814 -7.086 104 HB THR 13 HB THR 13 9.502 11.488 -8.972 105 HG1 THR 13 HG1 THR 13 12.135 10.590 -9.455 106 1HG2 THR 13 HG21 THR 13 11.291 12.090 -6.892 107 2HG2 THR 13 HG22 THR 13 12.200 12.368 -8.378 108 3HG2 THR 13 HG23 THR 13 10.671 13.206 -8.109 109 H LEU 14 H LEU 14 10.447 10.551 -5.132 110 HA LEU 14 HA LEU 14 7.600 10.387 -4.521 111 1HB LEU 14 HB2 LEU 14 9.227 9.752 -2.815 112 2HB LEU 14 HB3 LEU 14 9.951 11.360 -2.871 113 HG LEU 14 HG LEU 14 7.937 12.377 -2.014 114 1HD1 LEU 14 HD11 LEU 14 6.779 9.785 -2.839 115 2HD1 LEU 14 HD12 LEU 14 6.165 10.419 -1.312 116 3HD1 LEU 14 HD13 LEU 14 6.036 11.384 -2.783 117 1HD2 LEU 14 HD21 LEU 14 8.717 9.849 -0.537 118 2HD2 LEU 14 HD22 LEU 14 9.331 11.481 -0.269 119 3HD2 LEU 14 HD23 LEU 14 7.665 11.085 0.155 120 H ILE 15 H ILE 15 6.261 11.995 -5.168 121 HA ILE 15 HA ILE 15 7.288 14.761 -5.417 122 HB ILE 15 HB ILE 15 4.569 13.592 -6.093 123 1HG1 ILE 15 HG12 ILE 15 6.816 14.405 -7.957 124 2HG1 ILE 15 HG13 ILE 15 6.560 12.743 -7.422 125 1HG2 ILE 15 HG21 ILE 15 5.718 16.322 -6.131 126 2HG2 ILE 15 HG22 ILE 15 4.856 15.844 -7.594 127 3HG2 ILE 15 HG23 ILE 15 4.033 15.809 -6.034 128 1HD1 ILE 15 HD11 ILE 15 4.236 12.851 -8.325 129 2HD1 ILE 15 HD12 ILE 15 4.582 14.465 -8.945 130 3HD1 ILE 15 HD13 ILE 15 5.459 13.070 -9.576 131 H LYS 16 H LYS 16 4.632 13.020 -3.773 132 HA LYS 16 HA LYS 16 4.917 14.586 -1.368 133 1HB LYS 16 HB2 LYS 16 3.626 16.008 -3.289 134 2HB LYS 16 HB3 LYS 16 2.263 15.164 -2.554 135 1HG LYS 16 HG2 LYS 16 2.311 16.594 -0.821 136 2HG LYS 16 HG3 LYS 16 3.959 16.087 -0.450 137 1HD LYS 16 HD2 LYS 16 3.847 17.859 -2.770 138 2HD LYS 16 HD3 LYS 16 3.192 18.618 -1.317 139 1HE LYS 16 HE2 LYS 16 5.222 18.160 -0.084 140 2HE LYS 16 HE3 LYS 16 5.863 17.190 -1.408 141 1HZ LYS 16 HZ1 LYS 16 5.090 19.983 -1.899 142 2HZ LYS 16 HZ2 LYS 16 6.579 19.650 -1.150 143 3HZ LYS 16 HZ3 LYS 16 6.251 19.032 -2.696 144 H ALA 17 H ALA 17 4.020 13.403 0.282 145 HA ALA 17 HA ALA 17 2.602 10.933 -0.401 146 1HB ALA 17 HB1 ALA 17 3.815 12.129 2.042 147 2HB ALA 17 HB2 ALA 17 2.496 10.986 2.291 148 3HB ALA 17 HB3 ALA 17 3.941 10.486 1.414 149 H ILE 18 H ILE 18 0.431 10.458 0.136 150 HA ILE 18 HA ILE 18 -1.212 12.857 0.844 151 HB ILE 18 HB ILE 18 -1.835 10.443 -0.872 152 1HG1 ILE 18 HG12 ILE 18 -1.804 13.437 -1.374 153 2HG1 ILE 18 HG13 ILE 18 -0.639 12.265 -1.990 154 1HG2 ILE 18 HG21 ILE 18 -3.620 12.337 0.579 155 2HG2 ILE 18 HG22 ILE 18 -4.049 11.960 -1.089 156 3HG2 ILE 18 HG23 ILE 18 -3.907 10.665 0.099 157 1HD1 ILE 18 HD11 ILE 18 -3.600 12.068 -2.573 158 2HD1 ILE 18 HD12 ILE 18 -2.486 12.955 -3.614 159 3HD1 ILE 18 HD13 ILE 18 -2.279 11.220 -3.376 160 H ASP 19 H ASP 19 -1.923 9.359 0.860 161 HA ASP 19 HA ASP 19 -2.627 9.653 3.755 162 1HB ASP 19 HB2 ASP 19 -4.434 9.165 1.810 163 2HB ASP 19 HB3 ASP 19 -3.919 7.511 2.145 164 H GLY 20 H GLY 20 -3.120 6.844 4.099 165 1HA GLY 20 HA2 GLY 20 -0.323 5.932 4.290 166 2HA GLY 20 HA3 GLY 20 -1.723 5.138 5.012 167 H ASP 21 H ASP 21 -2.855 5.669 2.069 168 HA ASP 21 HA ASP 21 -1.537 3.287 0.838 169 1HB ASP 21 HB2 ASP 21 -3.927 2.776 -0.044 170 2HB ASP 21 HB3 ASP 21 -3.560 2.365 1.632 171 H THR 22 H THR 22 -2.042 6.484 0.529 172 HA THR 22 HA THR 22 -2.144 6.300 -2.453 173 HB THR 22 HB THR 22 -3.173 8.758 -1.106 174 HG1 THR 22 HG1 THR 22 -4.944 7.833 -0.423 175 1HG2 THR 22 HG21 THR 22 -2.941 7.977 -3.690 176 2HG2 THR 22 HG22 THR 22 -4.573 7.407 -3.342 177 3HG2 THR 22 HG23 THR 22 -4.170 9.111 -3.129 178 H VAL 23 H VAL 23 -0.302 7.105 -3.325 179 HA VAL 23 HA VAL 23 1.046 9.373 -1.952 180 HB VAL 23 HB VAL 23 3.260 8.180 -2.456 181 1HG1 VAL 23 HG11 VAL 23 1.569 8.138 -0.244 182 2HG1 VAL 23 HG12 VAL 23 2.003 6.443 -0.470 183 3HG1 VAL 23 HG13 VAL 23 3.266 7.656 -0.257 184 1HG2 VAL 23 HG21 VAL 23 1.655 6.404 -3.780 185 2HG2 VAL 23 HG22 VAL 23 3.272 6.020 -3.190 186 3HG2 VAL 23 HG23 VAL 23 1.857 5.586 -2.231 187 H LYS 24 H LYS 24 1.956 10.827 -3.378 188 HA LYS 24 HA LYS 24 1.486 10.300 -6.264 189 1HB LYS 24 HB2 LYS 24 2.474 12.916 -5.161 190 2HB LYS 24 HB3 LYS 24 1.445 12.619 -6.563 191 1HG LYS 24 HG2 LYS 24 -0.105 11.585 -4.574 192 2HG LYS 24 HG3 LYS 24 0.711 12.889 -3.711 193 1HD LYS 24 HD2 LYS 24 -0.063 13.874 -6.283 194 2HD LYS 24 HD3 LYS 24 -1.464 13.092 -5.548 195 1HE LYS 24 HE2 LYS 24 -1.714 14.777 -4.075 196 2HE LYS 24 HE3 LYS 24 -0.026 14.662 -3.581 197 1HZ LYS 24 HZ1 LYS 24 -0.834 15.963 -6.111 198 2HZ LYS 24 HZ2 LYS 24 -0.764 16.819 -4.646 199 3HZ LYS 24 HZ3 LYS 24 0.639 16.104 -5.277 200 H LEU 25 H LEU 25 3.193 9.863 -7.603 201 HA LEU 25 HA LEU 25 5.917 10.676 -6.708 202 1HB LEU 25 HB2 LEU 25 5.627 8.015 -8.035 203 2HB LEU 25 HB3 LEU 25 6.815 8.556 -6.850 204 HG LEU 25 HG LEU 25 3.899 8.158 -6.150 205 1HD1 LEU 25 HD11 LEU 25 6.212 6.208 -6.075 206 2HD1 LEU 25 HD12 LEU 25 4.760 6.002 -5.095 207 3HD1 LEU 25 HD13 LEU 25 4.645 5.995 -6.855 208 1HD2 LEU 25 HD21 LEU 25 5.784 9.507 -4.793 209 2HD2 LEU 25 HD22 LEU 25 4.560 8.539 -3.973 210 3HD2 LEU 25 HD23 LEU 25 6.173 7.879 -4.237 211 H MET 26 H MET 26 7.379 9.658 -8.794 212 HA MET 26 HA MET 26 6.067 10.767 -11.236 213 1HB MET 26 HB2 MET 26 7.953 12.159 -9.895 214 2HB MET 26 HB3 MET 26 8.996 11.163 -10.910 215 1HG MET 26 HG2 MET 26 8.307 12.171 -12.848 216 2HG MET 26 HG3 MET 26 6.663 12.415 -12.257 217 1HE MET 26 HE1 MET 26 10.110 12.951 -11.107 218 2HE MET 26 HE2 MET 26 10.358 14.681 -10.882 219 3HE MET 26 HE3 MET 26 9.484 13.743 -9.664 220 H TYR 27 H TYR 27 6.070 9.242 -12.810 221 HA TYR 27 HA TYR 27 8.201 7.147 -12.721 222 1HB TYR 27 HB2 TYR 27 5.894 6.286 -12.436 223 2HB TYR 27 HB3 TYR 27 5.438 7.025 -13.971 224 HD1 TYR 27 HD1 TYR 27 7.798 4.562 -12.445 225 HD2 TYR 27 HD2 TYR 27 5.821 5.904 -16.015 226 HE1 TYR 27 HE1 TYR 27 8.626 2.562 -13.658 227 HE2 TYR 27 HE2 TYR 27 6.650 3.906 -17.227 228 HH TYR 27 HH TYR 27 8.251 2.228 -17.121 229 H LYS 28 H LYS 28 9.716 7.425 -14.284 230 HA LYS 28 HA LYS 28 10.656 7.891 -16.386 231 1HB LYS 28 HB2 LYS 28 7.835 7.319 -16.950 232 2HB LYS 28 HB3 LYS 28 8.581 8.403 -18.123 233 1HG LYS 28 HG2 LYS 28 8.892 6.078 -18.827 234 2HG LYS 28 HG3 LYS 28 10.448 6.788 -18.397 235 1HD LYS 28 HD2 LYS 28 9.102 5.582 -16.099 236 2HD LYS 28 HD3 LYS 28 9.415 4.415 -17.385 237 1HE LYS 28 HE2 LYS 28 11.645 4.455 -17.016 238 2HE LYS 28 HE3 LYS 28 11.676 6.217 -16.925 239 1HZ LYS 28 HZ1 LYS 28 10.352 5.374 -14.663 240 2HZ LYS 28 HZ2 LYS 28 11.673 4.316 -14.819 241 3HZ LYS 28 HZ3 LYS 28 11.928 5.995 -14.750 242 H GLY 29 H GLY 29 9.138 9.993 -14.474 243 1HA GLY 29 HA2 GLY 29 9.765 12.344 -14.462 244 2HA GLY 29 HA3 GLY 29 9.873 12.288 -16.221 245 H GLN 30 H GLN 30 7.141 10.670 -14.934 246 HA GLN 30 HA GLN 30 5.446 13.017 -15.685 247 1HB GLN 30 HB2 GLN 30 5.395 10.701 -16.983 248 2HB GLN 30 HB3 GLN 30 4.351 10.230 -15.640 249 1HG GLN 30 HG2 GLN 30 2.761 11.916 -16.135 250 2HG GLN 30 HG3 GLN 30 3.889 12.787 -17.176 251 1HE2 GLN 30 HE21 GLN 30 2.241 9.582 -16.966 252 2HE2 GLN 30 HE22 GLN 30 2.074 9.396 -18.646 253 HA PRO 31 HA PRO 31 4.017 12.890 -11.490 254 1HB PRO 31 HB2 PRO 31 1.987 14.691 -11.791 255 2HB PRO 31 HB3 PRO 31 3.695 15.162 -11.753 256 1HG PRO 31 HG2 PRO 31 1.839 14.999 -14.075 257 2HG PRO 31 HG3 PRO 31 3.245 16.046 -13.828 258 1HD PRO 31 HD2 PRO 31 3.182 13.709 -15.408 259 2HD PRO 31 HD3 PRO 31 4.642 14.570 -14.876 260 H MET 32 H MET 32 2.934 11.025 -10.896 261 HA MET 32 HA MET 32 0.073 10.815 -11.615 262 1HB MET 32 HB2 MET 32 2.047 9.287 -12.948 263 2HB MET 32 HB3 MET 32 1.257 8.189 -11.815 264 1HG MET 32 HG2 MET 32 -0.935 8.785 -12.701 265 2HG MET 32 HG3 MET 32 -0.209 9.990 -13.765 266 1HE MET 32 HE1 MET 32 -0.216 6.571 -12.502 267 2HE MET 32 HE2 MET 32 -1.367 6.139 -13.764 268 3HE MET 32 HE3 MET 32 0.276 5.482 -13.796 269 H THR 33 H THR 33 -1.117 9.910 -9.946 270 HA THR 33 HA THR 33 0.286 9.464 -7.418 271 HB THR 33 HB THR 33 -1.918 10.624 -7.526 272 HG1 THR 33 HG1 THR 33 -1.481 9.708 -5.589 273 1HG2 THR 33 HG21 THR 33 -2.739 7.935 -8.601 274 2HG2 THR 33 HG22 THR 33 -3.904 8.956 -7.757 275 3HG2 THR 33 HG23 THR 33 -3.121 9.541 -9.226 276 H PHE 34 H PHE 34 -0.389 7.446 -6.101 277 HA PHE 34 HA PHE 34 -0.846 5.051 -7.777 278 1HB PHE 34 HB2 PHE 34 1.686 5.617 -6.233 279 2HB PHE 34 HB3 PHE 34 1.166 3.964 -6.566 280 HD1 PHE 34 HD1 PHE 34 2.343 7.125 -8.054 281 HD2 PHE 34 HD2 PHE 34 1.134 3.078 -8.836 282 HE1 PHE 34 HE1 PHE 34 3.270 7.291 -10.348 283 HE2 PHE 34 HE2 PHE 34 2.063 3.243 -11.128 284 HZ PHE 34 HZ PHE 34 3.130 5.350 -11.885 285 H ARG 35 H ARG 35 -1.601 3.255 -6.530 286 HA ARG 35 HA ARG 35 -2.189 3.899 -3.666 287 1HB ARG 35 HB2 ARG 35 -3.991 3.271 -5.857 288 2HB ARG 35 HB3 ARG 35 -4.147 2.090 -4.556 289 1HG ARG 35 HG2 ARG 35 -3.988 4.960 -3.765 290 2HG ARG 35 HG3 ARG 35 -5.483 4.419 -4.530 291 1HD ARG 35 HD2 ARG 35 -5.948 2.873 -2.830 292 2HD ARG 35 HD3 ARG 35 -4.269 2.814 -2.293 293 HE ARG 35 HE ARG 35 -4.603 5.051 -1.283 294 1HH1 ARG 35 HH11 ARG 35 -6.793 2.943 -0.422 295 2HH1 ARG 35 HH12 ARG 35 -8.165 3.995 -0.323 296 1HH2 ARG 35 HH21 ARG 35 -6.626 6.598 -2.021 297 2HH2 ARG 35 HH22 ARG 35 -8.072 6.062 -1.231 298 H LEU 36 H LEU 36 -2.134 2.095 -2.220 299 HA LEU 36 HA LEU 36 -0.225 0.050 -2.895 300 1HB LEU 36 HB2 LEU 36 -2.193 0.161 -0.587 301 2HB LEU 36 HB3 LEU 36 -0.786 -0.898 -0.689 302 HG LEU 36 HG LEU 36 -0.806 2.126 -0.538 303 1HD1 LEU 36 HD11 LEU 36 -0.875 0.372 1.493 304 2HD1 LEU 36 HD12 LEU 36 0.862 0.355 1.188 305 3HD1 LEU 36 HD13 LEU 36 0.050 1.871 1.583 306 1HD2 LEU 36 HD21 LEU 36 1.178 0.243 -1.654 307 2HD2 LEU 36 HD22 LEU 36 1.007 1.979 -1.910 308 3HD2 LEU 36 HD23 LEU 36 1.829 1.377 -0.471 309 H LEU 37 H LEU 37 -0.594 -1.801 -4.003 310 HA LEU 37 HA LEU 37 -3.367 -2.566 -4.643 311 1HB LEU 37 HB2 LEU 37 -0.671 -3.133 -5.716 312 2HB LEU 37 HB3 LEU 37 -1.813 -4.472 -5.811 313 HG LEU 37 HG LEU 37 -2.513 -1.678 -6.730 314 1HD1 LEU 37 HD11 LEU 37 -1.075 -3.913 -8.130 315 2HD1 LEU 37 HD12 LEU 37 -2.177 -2.889 -9.051 316 3HD1 LEU 37 HD13 LEU 37 -0.792 -2.175 -8.226 317 1HD2 LEU 37 HD21 LEU 37 -3.771 -4.384 -6.767 318 2HD2 LEU 37 HD22 LEU 37 -4.524 -2.799 -6.599 319 3HD2 LEU 37 HD23 LEU 37 -4.016 -3.369 -8.188 320 H LEU 38 H LEU 38 -4.286 -4.582 -4.119 321 HA LEU 38 HA LEU 38 -4.652 -6.518 -2.856 322 1HB LEU 38 HB2 LEU 38 -1.727 -6.422 -3.242 323 2HB LEU 38 HB3 LEU 38 -2.263 -7.382 -1.862 324 HG LEU 38 HG LEU 38 -3.254 -7.669 -4.713 325 1HD1 LEU 38 HD11 LEU 38 -1.246 -9.126 -3.027 326 2HD1 LEU 38 HD12 LEU 38 -2.194 -10.035 -4.204 327 3HD1 LEU 38 HD13 LEU 38 -1.169 -8.702 -4.737 328 1HD2 LEU 38 HD21 LEU 38 -4.529 -8.302 -2.288 329 2HD2 LEU 38 HD22 LEU 38 -4.962 -8.897 -3.892 330 3HD2 LEU 38 HD23 LEU 38 -3.867 -9.830 -2.871 331 H VAL 39 H VAL 39 -3.901 -3.648 -1.599 332 HA VAL 39 HA VAL 39 -4.459 -4.585 1.134 333 HB VAL 39 HB VAL 39 -2.137 -4.687 1.388 334 1HG1 VAL 39 HG11 VAL 39 -2.164 -2.532 -0.667 335 2HG1 VAL 39 HG12 VAL 39 -0.807 -2.552 0.461 336 3HG1 VAL 39 HG13 VAL 39 -1.136 -3.962 -0.547 337 1HG2 VAL 39 HG21 VAL 39 -2.850 -1.806 2.022 338 2HG2 VAL 39 HG22 VAL 39 -3.089 -3.188 3.093 339 3HG2 VAL 39 HG23 VAL 39 -1.457 -2.676 2.664 340 H ASP 40 H ASP 40 -4.808 -2.671 2.607 341 HA ASP 40 HA ASP 40 -5.322 -0.088 1.324 342 1HB ASP 40 HB2 ASP 40 -7.343 -1.781 0.966 343 2HB ASP 40 HB3 ASP 40 -7.722 -1.317 2.625 344 H THR 41 H THR 41 -6.025 1.525 2.957 345 HA THR 41 HA THR 41 -5.655 0.656 5.778 346 HB THR 41 HB THR 41 -4.350 3.046 5.806 347 HG1 THR 41 HG1 THR 41 -3.093 3.196 4.009 348 1HG2 THR 41 HG21 THR 41 -3.733 0.308 6.138 349 2HG2 THR 41 HG22 THR 41 -2.454 0.984 5.129 350 3HG2 THR 41 HG23 THR 41 -2.800 1.692 6.707 351 HA PRO 42 HA PRO 42 -8.862 3.521 6.700 352 1HB PRO 42 HB2 PRO 42 -7.999 4.632 9.048 353 2HB PRO 42 HB3 PRO 42 -8.581 2.963 8.924 354 1HG PRO 42 HG2 PRO 42 -5.764 3.974 9.083 355 2HG PRO 42 HG3 PRO 42 -6.477 2.512 9.791 356 1HD PRO 42 HD2 PRO 42 -4.947 2.507 7.490 357 2HD PRO 42 HD3 PRO 42 -6.173 1.275 7.865 358 H GLU 43 H GLU 43 -9.436 5.705 6.356 359 HA GLU 43 HA GLU 43 -7.208 7.474 5.489 360 1HB GLU 43 HB2 GLU 43 -10.043 8.322 5.157 361 2HB GLU 43 HB3 GLU 43 -8.688 8.470 4.039 362 1HG GLU 43 HG2 GLU 43 -8.816 6.040 3.576 363 2HG GLU 43 HG3 GLU 43 -10.197 5.914 4.668 364 H THR 44 H THR 44 -8.069 9.962 5.874 365 HA THR 44 HA THR 44 -8.158 10.191 8.824 366 HB THR 44 HB THR 44 -7.344 12.375 8.547 367 HG1 THR 44 HG1 THR 44 -7.536 13.365 6.389 368 1HG2 THR 44 HG21 THR 44 -6.124 10.321 7.121 369 2HG2 THR 44 HG22 THR 44 -6.177 11.655 5.971 370 3HG2 THR 44 HG23 THR 44 -5.390 11.870 7.534 371 H LYS 45 H LYS 45 -10.536 9.233 8.182 372 HA LYS 45 HA LYS 45 -12.415 11.430 7.571 373 1HB LYS 45 HB2 LYS 45 -12.447 8.562 7.363 374 2HB LYS 45 HB3 LYS 45 -13.808 9.082 8.358 375 1HG LYS 45 HG2 LYS 45 -14.899 9.797 6.527 376 2HG LYS 45 HG3 LYS 45 -13.562 10.880 6.137 377 1HD LYS 45 HD2 LYS 45 -12.417 9.137 4.915 378 2HD LYS 45 HD3 LYS 45 -13.589 7.931 5.446 379 1HE LYS 45 HE2 LYS 45 -14.484 8.413 3.375 380 2HE LYS 45 HE3 LYS 45 -15.302 9.651 4.328 381 1HZ LYS 45 HZ1 LYS 45 -13.535 11.203 3.742 382 2HZ LYS 45 HZ2 LYS 45 -12.786 10.010 2.792 383 3HZ LYS 45 HZ3 LYS 45 -14.313 10.605 2.355 384 H HIS 46 H HIS 46 -11.295 12.258 9.801 385 HA HIS 46 HA HIS 46 -12.055 11.252 12.297 386 1HB HIS 46 HB2 HIS 46 -11.627 14.053 11.272 387 2HB HIS 46 HB3 HIS 46 -12.097 13.768 12.945 388 HD1 HIS 46 HD1 HIS 46 -9.226 13.542 10.616 389 HD2 HIS 46 HD2 HIS 46 -10.142 12.236 14.468 390 HE1 HIS 46 HE1 HIS 46 -7.037 12.828 11.671 391 HA PRO 47 HA PRO 47 -16.469 11.728 12.222 392 1HB PRO 47 HB2 PRO 47 -16.894 11.149 14.857 393 2HB PRO 47 HB3 PRO 47 -16.474 9.918 13.654 394 1HG PRO 47 HG2 PRO 47 -14.777 11.128 15.779 395 2HG PRO 47 HG3 PRO 47 -14.688 9.518 15.046 396 1HD PRO 47 HD2 PRO 47 -13.021 11.709 14.423 397 2HD PRO 47 HD3 PRO 47 -13.182 10.216 13.474 398 H LYS 48 H LYS 48 -15.656 12.758 15.512 399 HA LYS 48 HA LYS 48 -16.163 15.591 14.852 400 1HB LYS 48 HB2 LYS 48 -18.417 14.567 15.243 401 2HB LYS 48 HB3 LYS 48 -17.886 14.110 16.861 402 1HG LYS 48 HG2 LYS 48 -17.695 16.360 17.563 403 2HG LYS 48 HG3 LYS 48 -17.714 16.967 15.906 404 1HD LYS 48 HD2 LYS 48 -20.063 16.126 15.681 405 2HD LYS 48 HD3 LYS 48 -20.031 15.697 17.391 406 1HE LYS 48 HE2 LYS 48 -20.056 17.901 18.087 407 2HE LYS 48 HE3 LYS 48 -19.243 18.479 16.633 408 1HZ LYS 48 HZ1 LYS 48 -21.289 17.976 15.388 409 2HZ LYS 48 HZ2 LYS 48 -22.061 17.571 16.846 410 3HZ LYS 48 HZ3 LYS 48 -21.524 19.159 16.584 411 H LYS 49 H LYS 49 -16.211 13.554 17.801 412 HA LYS 49 HA LYS 49 -14.384 15.462 19.109 413 1HB LYS 49 HB2 LYS 49 -15.914 13.026 20.016 414 2HB LYS 49 HB3 LYS 49 -14.655 13.733 21.028 415 1HG LYS 49 HG2 LYS 49 -16.177 15.920 20.167 416 2HG LYS 49 HG3 LYS 49 -17.364 14.673 20.548 417 1HD LYS 49 HD2 LYS 49 -17.106 15.400 22.690 418 2HD LYS 49 HD3 LYS 49 -15.640 14.422 22.656 419 1HE LYS 49 HE2 LYS 49 -15.363 17.138 21.515 420 2HE LYS 49 HE3 LYS 49 -15.664 17.080 23.251 421 1HZ LYS 49 HZ1 LYS 49 -13.582 15.450 21.913 422 2HZ LYS 49 HZ2 LYS 49 -13.274 16.981 22.574 423 3HZ LYS 49 HZ3 LYS 49 -13.785 15.711 23.579 424 H GLY 50 H GLY 50 -12.628 14.914 17.508 425 1HA GLY 50 HA2 GLY 50 -10.637 13.797 16.962 426 2HA GLY 50 HA3 GLY 50 -10.636 13.268 18.645 427 H VAL 51 H VAL 51 -9.650 11.465 16.907 428 HA VAL 51 HA VAL 51 -11.847 9.450 16.737 429 HB VAL 51 HB VAL 51 -11.237 10.424 14.476 430 1HG1 VAL 51 HG11 VAL 51 -8.785 10.633 15.068 431 2HG1 VAL 51 HG12 VAL 51 -8.666 8.881 14.903 432 3HG1 VAL 51 HG13 VAL 51 -9.102 9.871 13.510 433 1HG2 VAL 51 HG21 VAL 51 -11.245 7.589 15.294 434 2HG2 VAL 51 HG22 VAL 51 -12.192 8.403 14.049 435 3HG2 VAL 51 HG23 VAL 51 -10.542 7.885 13.704 436 H GLU 52 H GLU 52 -11.193 7.309 17.202 437 HA GLU 52 HA GLU 52 -8.350 6.963 18.043 438 1HB GLU 52 HB2 GLU 52 -10.677 5.818 19.599 439 2HB GLU 52 HB3 GLU 52 -8.988 5.934 20.095 440 1HG GLU 52 HG2 GLU 52 -9.140 8.367 20.192 441 2HG GLU 52 HG3 GLU 52 -10.792 8.315 19.577 442 H LYS 53 H LYS 53 -9.749 6.127 15.610 443 HA LYS 53 HA LYS 53 -9.647 3.159 15.993 444 1HB LYS 53 HB2 LYS 53 -11.732 4.738 14.945 445 2HB LYS 53 HB3 LYS 53 -10.971 3.974 13.548 446 1HG LYS 53 HG2 LYS 53 -12.218 2.159 14.071 447 2HG LYS 53 HG3 LYS 53 -11.067 1.911 15.385 448 1HD LYS 53 HD2 LYS 53 -12.747 3.800 16.463 449 2HD LYS 53 HD3 LYS 53 -13.861 2.838 15.491 450 1HE LYS 53 HE2 LYS 53 -11.902 1.277 17.067 451 2HE LYS 53 HE3 LYS 53 -13.093 2.163 18.018 452 1HZ LYS 53 HZ1 LYS 53 -14.681 1.153 16.183 453 2HZ LYS 53 HZ2 LYS 53 -13.474 -0.044 16.149 454 3HZ LYS 53 HZ3 LYS 53 -14.283 0.300 17.599 455 H TYR 54 H TYR 54 -7.239 4.353 15.613 456 HA TYR 54 HA TYR 54 -5.385 4.449 14.173 457 1HB TYR 54 HB2 TYR 54 -6.831 2.519 12.373 458 2HB TYR 54 HB3 TYR 54 -5.117 2.578 12.786 459 HD1 TYR 54 HD1 TYR 54 -4.383 1.957 15.123 460 HD2 TYR 54 HD2 TYR 54 -8.378 1.280 13.696 461 HE1 TYR 54 HE1 TYR 54 -4.770 0.350 16.971 462 HE2 TYR 54 HE2 TYR 54 -8.765 -0.327 15.545 463 HH TYR 54 HH TYR 54 -7.747 -1.548 17.162 464 H GLY 55 H GLY 55 -7.305 6.469 13.745 465 1HA GLY 55 HA2 GLY 55 -8.070 6.683 10.975 466 2HA GLY 55 HA3 GLY 55 -8.022 8.016 12.128 467 HA PRO 56 HA PRO 56 -4.375 9.462 10.126 468 1HB PRO 56 HB2 PRO 56 -3.426 11.062 12.124 469 2HB PRO 56 HB3 PRO 56 -4.866 11.458 11.173 470 1HG PRO 56 HG2 PRO 56 -4.673 10.496 13.977 471 2HG PRO 56 HG3 PRO 56 -5.934 11.471 13.206 472 1HD PRO 56 HD2 PRO 56 -6.057 8.687 13.757 473 2HD PRO 56 HD3 PRO 56 -7.197 9.622 12.765 474 H GLU 57 H GLU 57 -3.707 6.946 10.708 475 HA GLU 57 HA GLU 57 -1.180 7.162 12.298 476 1HB GLU 57 HB2 GLU 57 -3.358 5.481 12.804 477 2HB GLU 57 HB3 GLU 57 -2.181 4.442 11.998 478 1HG GLU 57 HG2 GLU 57 -0.806 4.451 13.790 479 2HG GLU 57 HG3 GLU 57 -0.926 6.203 13.962 480 H ALA 58 H ALA 58 -2.481 4.647 10.121 481 HA ALA 58 HA ALA 58 -0.063 3.963 8.904 482 1HB ALA 58 HB1 ALA 58 -2.744 3.316 8.502 483 2HB ALA 58 HB2 ALA 58 -2.244 4.013 6.962 484 3HB ALA 58 HB3 ALA 58 -1.372 2.633 7.629 485 H SER 59 H SER 59 -2.156 6.716 8.234 486 HA SER 59 HA SER 59 -1.028 7.534 5.756 487 1HB SER 59 HB2 SER 59 -2.982 8.685 6.408 488 2HB SER 59 HB3 SER 59 -2.356 9.018 8.020 489 HG SER 59 HG SER 59 -0.892 10.461 7.101 490 H ALA 60 H ALA 60 -0.225 8.761 9.034 491 HA ALA 60 HA ALA 60 2.078 10.221 8.182 492 1HB ALA 60 HB1 ALA 60 1.333 9.040 10.873 493 2HB ALA 60 HB2 ALA 60 2.739 10.075 10.624 494 3HB ALA 60 HB3 ALA 60 1.118 10.708 10.339 495 H PHE 61 H PHE 61 1.559 6.842 8.717 496 HA PHE 61 HA PHE 61 4.285 6.084 9.249 497 1HB PHE 61 HB2 PHE 61 2.238 4.640 9.624 498 2HB PHE 61 HB3 PHE 61 2.171 4.408 7.877 499 HD1 PHE 61 HD1 PHE 61 4.166 3.792 10.933 500 HD2 PHE 61 HD2 PHE 61 3.771 3.015 6.727 501 HE1 PHE 61 HE1 PHE 61 5.869 1.996 11.105 502 HE2 PHE 61 HE2 PHE 61 5.474 1.220 6.898 503 HZ PHE 61 HZ PHE 61 6.522 0.711 9.088 504 H THR 62 H THR 62 2.419 5.498 6.266 505 HA THR 62 HA THR 62 4.724 5.055 4.642 506 HB THR 62 HB THR 62 2.172 6.178 3.512 507 HG1 THR 62 HG1 THR 62 2.305 3.458 3.974 508 1HG2 THR 62 HG21 THR 62 4.427 4.450 2.652 509 2HG2 THR 62 HG22 THR 62 2.832 4.007 2.043 510 3HG2 THR 62 HG23 THR 62 3.484 5.614 1.723 511 H LYS 63 H LYS 63 3.359 7.955 5.877 512 HA LYS 63 HA LYS 63 4.214 9.756 3.795 513 1HB LYS 63 HB2 LYS 63 2.532 10.407 5.470 514 2HB LYS 63 HB3 LYS 63 3.744 10.272 6.744 515 1HG LYS 63 HG2 LYS 63 5.114 11.994 5.498 516 2HG LYS 63 HG3 LYS 63 3.726 12.231 4.436 517 1HD LYS 63 HD2 LYS 63 2.364 12.627 6.584 518 2HD LYS 63 HD3 LYS 63 3.922 12.780 7.399 519 1HE LYS 63 HE2 LYS 63 4.563 14.561 5.786 520 2HE LYS 63 HE3 LYS 63 2.966 14.440 5.048 521 1HZ LYS 63 HZ1 LYS 63 2.557 14.691 7.772 522 2HZ LYS 63 HZ2 LYS 63 3.743 15.841 7.374 523 3HZ LYS 63 HZ3 LYS 63 2.244 15.850 6.575 524 H LYS 64 H LYS 64 5.605 9.157 7.030 525 HA LYS 64 HA LYS 64 8.079 10.514 6.363 526 1HB LYS 64 HB2 LYS 64 7.670 8.529 8.610 527 2HB LYS 64 HB3 LYS 64 8.826 9.859 8.540 528 1HG LYS 64 HG2 LYS 64 7.250 11.440 9.062 529 2HG LYS 64 HG3 LYS 64 5.961 10.581 8.219 530 1HD LYS 64 HD2 LYS 64 5.501 10.474 10.595 531 2HD LYS 64 HD3 LYS 64 5.996 8.866 10.061 532 1HE LYS 64 HE2 LYS 64 7.163 9.404 12.131 533 2HE LYS 64 HE3 LYS 64 8.325 9.383 10.806 534 1HZ LYS 64 HZ1 LYS 64 7.013 11.819 11.885 535 2HZ LYS 64 HZ2 LYS 64 8.592 11.322 12.252 536 3HZ LYS 64 HZ3 LYS 64 8.193 11.771 10.662 537 H MET 65 H MET 65 6.867 7.340 5.815 538 HA MET 65 HA MET 65 9.433 5.989 5.719 539 1HB MET 65 HB2 MET 65 6.626 5.321 5.218 540 2HB MET 65 HB3 MET 65 7.730 4.537 4.087 541 1HG MET 65 HG2 MET 65 8.584 4.521 6.925 542 2HG MET 65 HG3 MET 65 7.164 3.543 6.552 543 1HE MET 65 HE1 MET 65 10.660 4.087 6.657 544 2HE MET 65 HE2 MET 65 11.494 2.858 5.708 545 3HE MET 65 HE3 MET 65 10.860 4.296 4.912 546 H VAL 66 H VAL 66 7.154 6.708 3.071 547 HA VAL 66 HA VAL 66 9.024 6.351 0.974 548 HB VAL 66 HB VAL 66 7.462 7.681 -0.404 549 1HG1 VAL 66 HG11 VAL 66 6.977 5.281 0.468 550 2HG1 VAL 66 HG12 VAL 66 5.790 6.062 1.513 551 3HG1 VAL 66 HG13 VAL 66 5.643 6.191 -0.240 552 1HG2 VAL 66 HG21 VAL 66 6.693 8.663 2.279 553 2HG2 VAL 66 HG22 VAL 66 6.589 9.469 0.713 554 3HG2 VAL 66 HG23 VAL 66 5.340 8.322 1.198 555 H GLU 67 H GLU 67 8.351 9.152 3.012 556 HA GLU 67 HA GLU 67 9.859 11.048 1.463 557 1HB GLU 67 HB2 GLU 67 8.879 10.931 4.301 558 2HB GLU 67 HB3 GLU 67 10.002 12.202 3.814 559 1HG GLU 67 HG2 GLU 67 8.130 12.164 1.758 560 2HG GLU 67 HG3 GLU 67 7.158 11.915 3.208 561 H ASN 68 H ASN 68 10.705 8.995 4.239 562 HA ASN 68 HA ASN 68 13.522 9.859 4.061 563 1HB ASN 68 HB2 ASN 68 11.878 8.272 5.975 564 2HB ASN 68 HB3 ASN 68 13.595 7.879 5.880 565 1HD2 ASN 68 HD21 ASN 68 11.334 10.589 6.489 566 2HD2 ASN 68 HD22 ASN 68 12.449 11.530 7.359 567 H ALA 69 H ALA 69 11.719 7.857 2.248 568 HA ALA 69 HA ALA 69 13.278 5.429 2.223 569 1HB ALA 69 HB1 ALA 69 10.892 6.033 1.193 570 2HB ALA 69 HB2 ALA 69 11.866 6.362 -0.240 571 3HB ALA 69 HB3 ALA 69 11.895 4.760 0.496 572 H LYS 70 H LYS 70 15.303 5.185 1.421 573 HA LYS 70 HA LYS 70 16.716 7.330 0.139 574 1HB LYS 70 HB2 LYS 70 17.275 4.421 0.643 575 2HB LYS 70 HB3 LYS 70 18.337 5.337 -0.428 576 1HG LYS 70 HG2 LYS 70 17.733 6.821 2.003 577 2HG LYS 70 HG3 LYS 70 18.476 5.263 2.361 578 1HD LYS 70 HD2 LYS 70 19.640 6.955 0.176 579 2HD LYS 70 HD3 LYS 70 19.992 7.365 1.854 580 1HE LYS 70 HE2 LYS 70 20.487 4.760 2.030 581 2HE LYS 70 HE3 LYS 70 20.763 4.929 0.296 582 1HZ LYS 70 HZ1 LYS 70 21.975 6.948 2.005 583 2HZ LYS 70 HZ2 LYS 70 22.635 5.386 2.109 584 3HZ LYS 70 HZ3 LYS 70 22.586 6.192 0.615 585 H LYS 71 H LYS 71 14.891 4.583 -1.079 586 HA LYS 71 HA LYS 71 15.042 5.760 -3.788 587 1HB LYS 71 HB2 LYS 71 15.953 2.954 -3.107 588 2HB LYS 71 HB3 LYS 71 15.544 3.463 -4.746 589 1HG LYS 71 HG2 LYS 71 17.233 5.297 -4.547 590 2HG LYS 71 HG3 LYS 71 17.699 4.649 -2.974 591 1HD LYS 71 HD2 LYS 71 18.888 2.960 -3.901 592 2HD LYS 71 HD3 LYS 71 17.624 2.610 -5.082 593 1HE LYS 71 HE2 LYS 71 18.998 5.164 -5.557 594 2HE LYS 71 HE3 LYS 71 20.059 3.760 -5.674 595 1HZ LYS 71 HZ1 LYS 71 18.400 2.742 -7.166 596 2HZ LYS 71 HZ2 LYS 71 17.512 4.191 -7.135 597 3HZ LYS 71 HZ3 LYS 71 19.072 4.168 -7.798 598 H ILE 72 H ILE 72 13.103 5.530 -4.838 599 HA ILE 72 HA ILE 72 11.097 3.705 -3.573 600 HB ILE 72 HB ILE 72 10.736 6.332 -5.042 601 1HG1 ILE 72 HG12 ILE 72 9.389 6.233 -2.552 602 2HG1 ILE 72 HG13 ILE 72 10.998 5.563 -2.272 603 1HG2 ILE 72 HG21 ILE 72 8.989 4.675 -5.669 604 2HG2 ILE 72 HG22 ILE 72 8.623 4.444 -3.960 605 3HG2 ILE 72 HG23 ILE 72 8.330 6.007 -4.720 606 1HD1 ILE 72 HD11 ILE 72 11.978 7.555 -3.423 607 2HD1 ILE 72 HD12 ILE 72 10.356 8.239 -3.545 608 3HD1 ILE 72 HD13 ILE 72 11.086 7.976 -1.960 609 H GLU 73 H GLU 73 10.691 1.951 -4.831 610 HA GLU 73 HA GLU 73 10.802 2.322 -7.797 611 1HB GLU 73 HB2 GLU 73 11.574 -0.130 -6.185 612 2HB GLU 73 HB3 GLU 73 11.553 -0.039 -7.947 613 1HG GLU 73 HG2 GLU 73 13.529 1.059 -8.016 614 2HG GLU 73 HG3 GLU 73 13.051 2.158 -6.722 615 H VAL 74 H VAL 74 8.967 1.717 -8.875 616 HA VAL 74 HA VAL 74 6.805 0.439 -7.268 617 HB VAL 74 HB VAL 74 5.337 1.238 -9.158 618 1HG1 VAL 74 HG11 VAL 74 6.133 2.551 -6.966 619 2HG1 VAL 74 HG12 VAL 74 6.834 3.628 -8.174 620 3HG1 VAL 74 HG13 VAL 74 5.098 3.314 -8.173 621 1HG2 VAL 74 HG21 VAL 74 7.867 1.639 -10.382 622 2HG2 VAL 74 HG22 VAL 74 6.278 2.006 -11.052 623 3HG2 VAL 74 HG23 VAL 74 7.158 3.236 -10.144 624 H GLU 75 H GLU 75 5.789 -1.458 -8.022 625 HA GLU 75 HA GLU 75 7.135 -2.765 -10.354 626 1HB GLU 75 HB2 GLU 75 7.719 -3.868 -8.236 627 2HB GLU 75 HB3 GLU 75 6.007 -4.057 -7.853 628 1HG GLU 75 HG2 GLU 75 5.735 -5.397 -9.949 629 2HG GLU 75 HG3 GLU 75 7.479 -5.297 -10.195 630 H PHE 76 H PHE 76 5.476 -1.962 -11.788 631 HA PHE 76 HA PHE 76 2.681 -2.245 -11.379 632 1HB PHE 76 HB2 PHE 76 4.291 -2.323 -13.950 633 2HB PHE 76 HB3 PHE 76 2.534 -2.180 -13.881 634 HD1 PHE 76 HD1 PHE 76 1.459 -0.151 -13.034 635 HD2 PHE 76 HD2 PHE 76 5.736 -0.487 -13.237 636 HE1 PHE 76 HE1 PHE 76 1.666 2.297 -12.695 637 HE2 PHE 76 HE2 PHE 76 5.944 1.961 -12.897 638 HZ PHE 76 HZ PHE 76 3.910 3.353 -12.626 639 H ASP 77 H ASP 77 1.371 -4.028 -11.401 640 HA ASP 77 HA ASP 77 2.535 -6.668 -11.603 641 1HB ASP 77 HB2 ASP 77 0.261 -5.665 -10.454 642 2HB ASP 77 HB3 ASP 77 -0.397 -6.455 -11.889 643 H LYS 78 H LYS 78 0.630 -8.112 -13.063 644 HA LYS 78 HA LYS 78 1.335 -7.255 -15.826 645 1HB LYS 78 HB2 LYS 78 0.165 -9.763 -16.043 646 2HB LYS 78 HB3 LYS 78 1.896 -9.440 -16.004 647 1HG LYS 78 HG2 LYS 78 1.490 -11.088 -14.319 648 2HG LYS 78 HG3 LYS 78 1.730 -9.565 -13.461 649 1HD LYS 78 HD2 LYS 78 -0.272 -9.895 -12.481 650 2HD LYS 78 HD3 LYS 78 -1.016 -9.648 -14.062 651 1HE LYS 78 HE2 LYS 78 -1.803 -11.774 -13.365 652 2HE LYS 78 HE3 LYS 78 -0.499 -12.135 -14.495 653 1HZ LYS 78 HZ1 LYS 78 -0.230 -12.030 -11.539 654 2HZ LYS 78 HZ2 LYS 78 -0.333 -13.450 -12.467 655 3HZ LYS 78 HZ3 LYS 78 1.003 -12.420 -12.640 656 H GLY 79 H GLY 79 -1.251 -7.195 -13.671 657 1HA GLY 79 HA2 GLY 79 -3.394 -7.632 -15.598 658 2HA GLY 79 HA3 GLY 79 -3.584 -6.964 -13.976 659 H GLN 80 H GLN 80 -4.518 -4.981 -14.177 660 HA GLN 80 HA GLN 80 -4.017 -3.318 -16.537 661 1HB GLN 80 HB2 GLN 80 -5.444 -2.406 -14.042 662 2HB GLN 80 HB3 GLN 80 -5.716 -1.906 -15.712 663 1HG GLN 80 HG2 GLN 80 -6.083 -4.714 -15.646 664 2HG GLN 80 HG3 GLN 80 -6.959 -4.060 -14.261 665 1HE2 GLN 80 HE21 GLN 80 -6.381 -2.785 -17.592 666 2HE2 GLN 80 HE22 GLN 80 -8.023 -2.509 -17.926 667 H ARG 81 H ARG 81 -3.647 -0.823 -15.867 668 HA ARG 81 HA ARG 81 -1.284 -0.802 -14.030 669 1HB ARG 81 HB2 ARG 81 -1.133 -0.393 -16.696 670 2HB ARG 81 HB3 ARG 81 -1.485 1.254 -16.170 671 1HG ARG 81 HG2 ARG 81 0.385 0.965 -14.455 672 2HG ARG 81 HG3 ARG 81 0.829 -0.503 -15.329 673 1HD ARG 81 HD2 ARG 81 1.931 0.723 -16.857 674 2HD ARG 81 HD3 ARG 81 0.449 1.599 -17.236 675 HE ARG 81 HE ARG 81 1.612 2.622 -14.810 676 1HH1 ARG 81 HH11 ARG 81 0.590 3.840 -17.571 677 2HH1 ARG 81 HH12 ARG 81 1.981 4.793 -17.968 678 1HH2 ARG 81 HH21 ARG 81 4.016 3.288 -15.598 679 2HH2 ARG 81 HH22 ARG 81 3.922 4.480 -16.850 680 H THR 82 H THR 82 -4.317 0.635 -14.884 681 HA THR 82 HA THR 82 -4.044 2.471 -12.571 682 HB THR 82 HB THR 82 -4.929 4.372 -13.873 683 HG1 THR 82 HG1 THR 82 -4.862 2.428 -15.904 684 1HG2 THR 82 HG21 THR 82 -2.369 3.528 -13.797 685 2HG2 THR 82 HG22 THR 82 -2.631 3.501 -15.541 686 3HG2 THR 82 HG23 THR 82 -2.863 4.997 -14.638 687 H ASP 83 H ASP 83 -6.021 2.867 -11.540 688 HA ASP 83 HA ASP 83 -8.190 1.018 -12.203 689 1HB ASP 83 HB2 ASP 83 -7.546 2.896 -9.977 690 2HB ASP 83 HB3 ASP 83 -9.246 2.494 -10.227 691 H LYS 84 H LYS 84 -10.510 2.314 -11.745 692 HA LYS 84 HA LYS 84 -10.881 3.857 -14.166 693 1HB LYS 84 HB2 LYS 84 -13.212 4.211 -13.220 694 2HB LYS 84 HB3 LYS 84 -12.733 2.525 -13.412 695 1HG LYS 84 HG2 LYS 84 -12.245 2.313 -11.067 696 2HG LYS 84 HG3 LYS 84 -12.414 4.050 -10.817 697 1HD LYS 84 HD2 LYS 84 -14.550 3.567 -10.227 698 2HD LYS 84 HD3 LYS 84 -14.832 3.397 -11.961 699 1HE LYS 84 HE2 LYS 84 -14.943 1.119 -11.853 700 2HE LYS 84 HE3 LYS 84 -13.684 1.017 -10.622 701 1HZ LYS 84 HZ1 LYS 84 -15.551 2.162 -9.192 702 2HZ LYS 84 HZ2 LYS 84 -16.568 1.391 -10.314 703 3HZ LYS 84 HZ3 LYS 84 -15.485 0.478 -9.376 704 H TYR 85 H TYR 85 -9.946 4.663 -10.958 705 HA TYR 85 HA TYR 85 -10.927 7.419 -11.058 706 1HB TYR 85 HB2 TYR 85 -9.013 5.976 -9.207 707 2HB TYR 85 HB3 TYR 85 -9.423 7.681 -9.029 708 HD1 TYR 85 HD1 TYR 85 -11.737 8.375 -8.476 709 HD2 TYR 85 HD2 TYR 85 -10.608 4.237 -8.686 710 HE1 TYR 85 HE1 TYR 85 -13.815 7.748 -7.275 711 HE2 TYR 85 HE2 TYR 85 -12.682 3.610 -7.487 712 HH TYR 85 HH TYR 85 -15.214 5.938 -6.840 713 H GLY 86 H GLY 86 -8.327 5.729 -12.429 714 1HA GLY 86 HA2 GLY 86 -6.762 6.687 -13.967 715 2HA GLY 86 HA3 GLY 86 -7.105 8.278 -13.288 716 H ARG 87 H ARG 87 -6.632 6.009 -10.832 717 HA ARG 87 HA ARG 87 -3.998 7.195 -10.228 718 1HB ARG 87 HB2 ARG 87 -5.631 5.188 -8.642 719 2HB ARG 87 HB3 ARG 87 -4.226 6.084 -8.062 720 1HG ARG 87 HG2 ARG 87 -5.482 8.216 -8.535 721 2HG ARG 87 HG3 ARG 87 -6.904 7.235 -8.889 722 1HD ARG 87 HD2 ARG 87 -5.381 7.197 -6.266 723 2HD ARG 87 HD3 ARG 87 -6.898 8.053 -6.541 724 HE ARG 87 HE ARG 87 -6.821 5.118 -7.013 725 1HH1 ARG 87 HH11 ARG 87 -7.174 7.312 -4.493 726 2HH1 ARG 87 HH12 ARG 87 -8.724 6.737 -3.976 727 1HH2 ARG 87 HH21 ARG 87 -9.129 4.602 -6.680 728 2HH2 ARG 87 HH22 ARG 87 -9.830 5.200 -5.213 729 H GLY 88 H GLY 88 -2.065 6.041 -10.241 730 1HA GLY 88 HA2 GLY 88 -1.969 3.650 -11.881 731 2HA GLY 88 HA3 GLY 88 -0.595 4.391 -11.059 732 H LEU 89 H LEU 89 -1.094 1.564 -11.139 733 HA LEU 89 HA LEU 89 -1.409 1.085 -8.213 734 1HB LEU 89 HB2 LEU 89 -2.638 -0.600 -10.416 735 2HB LEU 89 HB3 LEU 89 -2.682 -0.977 -8.695 736 HG LEU 89 HG LEU 89 -3.625 1.733 -9.428 737 1HD1 LEU 89 HD11 LEU 89 -4.541 -0.452 -10.946 738 2HD1 LEU 89 HD12 LEU 89 -5.796 -0.165 -9.740 739 3HD1 LEU 89 HD13 LEU 89 -5.296 1.138 -10.819 740 1HD2 LEU 89 HD21 LEU 89 -3.619 0.450 -7.140 741 2HD2 LEU 89 HD22 LEU 89 -5.033 1.407 -7.581 742 3HD2 LEU 89 HD23 LEU 89 -5.056 -0.344 -7.786 743 H ALA 90 H ALA 90 0.390 0.066 -7.475 744 HA ALA 90 HA ALA 90 1.583 -2.178 -8.852 745 1HB ALA 90 HB1 ALA 90 2.900 0.529 -9.047 746 2HB ALA 90 HB2 ALA 90 3.855 -0.953 -9.097 747 3HB ALA 90 HB3 ALA 90 2.626 -0.655 -10.326 748 H TYR 91 H TYR 91 3.566 -2.941 -7.640 749 HA TYR 91 HA TYR 91 3.148 -2.511 -4.764 750 1HB TYR 91 HB2 TYR 91 5.212 -4.237 -6.165 751 2HB TYR 91 HB3 TYR 91 4.737 -4.331 -4.469 752 HD1 TYR 91 HD1 TYR 91 2.229 -4.786 -3.967 753 HD2 TYR 91 HD2 TYR 91 4.072 -5.510 -7.779 754 HE1 TYR 91 HE1 TYR 91 0.381 -6.328 -4.568 755 HE2 TYR 91 HE2 TYR 91 2.225 -7.052 -8.379 756 HH TYR 91 HH TYR 91 -0.361 -7.238 -7.542 757 H ILE 92 H ILE 92 4.123 -0.792 -3.811 758 HA ILE 92 HA ILE 92 6.521 0.416 -4.999 759 HB ILE 92 HB ILE 92 5.162 1.125 -2.387 760 1HG1 ILE 92 HG12 ILE 92 4.638 2.311 -5.128 761 2HG1 ILE 92 HG13 ILE 92 3.609 1.079 -4.395 762 1HG2 ILE 92 HG21 ILE 92 7.484 2.030 -2.968 763 2HG2 ILE 92 HG22 ILE 92 6.709 2.884 -4.302 764 3HG2 ILE 92 HG23 ILE 92 6.245 3.240 -2.638 765 1HD1 ILE 92 HD11 ILE 92 4.237 3.789 -3.187 766 2HD1 ILE 92 HD12 ILE 92 2.721 3.342 -3.969 767 3HD1 ILE 92 HD13 ILE 92 3.202 2.557 -2.464 768 H TYR 93 H TYR 93 8.580 0.483 -3.994 769 HA TYR 93 HA TYR 93 8.933 -1.272 -1.607 770 1HB TYR 93 HB2 TYR 93 10.494 -1.377 -4.202 771 2HB TYR 93 HB3 TYR 93 11.042 -2.140 -2.709 772 HD1 TYR 93 HD1 TYR 93 9.726 -3.981 -1.678 773 HD2 TYR 93 HD2 TYR 93 8.674 -2.295 -5.487 774 HE1 TYR 93 HE1 TYR 93 8.275 -5.937 -2.144 775 HE2 TYR 93 HE2 TYR 93 7.222 -4.251 -5.952 776 HH TYR 93 HH TYR 93 7.254 -6.820 -5.039 777 H ALA 94 H ALA 94 10.005 -0.155 -0.060 778 HA ALA 94 HA ALA 94 11.718 2.139 -0.912 779 1HB ALA 94 HB1 ALA 94 9.936 1.640 1.423 780 2HB ALA 94 HB2 ALA 94 11.414 2.552 1.733 781 3HB ALA 94 HB3 ALA 94 10.247 3.139 0.547 782 H ASP 95 H ASP 95 13.852 1.618 -0.879 783 HA ASP 95 HA ASP 95 15.903 0.792 -0.087 784 1HB ASP 95 HB2 ASP 95 14.391 0.105 2.450 785 2HB ASP 95 HB3 ASP 95 16.132 0.317 2.271 786 H GLY 96 H GLY 96 13.593 -0.915 -1.231 787 1HA GLY 96 HA2 GLY 96 13.719 -3.154 -2.048 788 2HA GLY 96 HA3 GLY 96 15.003 -3.481 -0.882 789 H LYS 97 H LYS 97 12.291 -1.879 0.444 790 HA LYS 97 HA LYS 97 11.361 -4.471 1.614 791 1HB LYS 97 HB2 LYS 97 12.294 -2.186 2.908 792 2HB LYS 97 HB3 LYS 97 10.540 -2.059 3.042 793 1HG LYS 97 HG2 LYS 97 10.885 -3.414 4.858 794 2HG LYS 97 HG3 LYS 97 10.833 -4.676 3.627 795 1HD LYS 97 HD2 LYS 97 12.811 -4.891 5.133 796 2HD LYS 97 HD3 LYS 97 13.266 -4.656 3.445 797 1HE LYS 97 HE2 LYS 97 12.928 -2.107 4.794 798 2HE LYS 97 HE3 LYS 97 14.107 -3.113 5.632 799 1HZ LYS 97 HZ1 LYS 97 14.150 -2.677 2.702 800 2HZ LYS 97 HZ2 LYS 97 15.008 -1.701 3.791 801 3HZ LYS 97 HZ3 LYS 97 15.368 -3.357 3.670 802 H MET 98 H MET 98 9.330 -5.062 1.003 803 HA MET 98 HA MET 98 7.703 -3.500 -0.724 804 1HB MET 98 HB2 MET 98 7.476 -5.967 -0.439 805 2HB MET 98 HB3 MET 98 6.799 -5.694 1.167 806 1HG MET 98 HG2 MET 98 4.767 -5.291 0.290 807 2HG MET 98 HG3 MET 98 5.432 -4.031 -0.752 808 1HE MET 98 HE1 MET 98 5.099 -7.487 0.094 809 2HE MET 98 HE2 MET 98 3.993 -8.007 -1.175 810 3HE MET 98 HE3 MET 98 5.700 -8.433 -1.273 811 H VAL 99 H VAL 99 7.085 -1.474 -0.050 812 HA VAL 99 HA VAL 99 6.623 -0.565 2.544 813 HB VAL 99 HB VAL 99 5.169 0.229 0.004 814 1HG1 VAL 99 HG11 VAL 99 4.926 1.110 2.794 815 2HG1 VAL 99 HG12 VAL 99 5.284 2.429 1.679 816 3HG1 VAL 99 HG13 VAL 99 3.861 1.419 1.423 817 1HG2 VAL 99 HG21 VAL 99 7.812 0.827 1.213 818 2HG2 VAL 99 HG22 VAL 99 7.313 0.869 -0.479 819 3HG2 VAL 99 HG23 VAL 99 6.929 2.220 0.590 820 H ASN 100 H ASN 100 4.156 -1.933 0.328 821 HA ASN 100 HA ASN 100 1.959 -1.792 2.096 822 1HB ASN 100 HB2 ASN 100 2.560 -3.991 0.092 823 2HB ASN 100 HB3 ASN 100 0.976 -3.608 0.767 824 1HD2 ASN 100 HD21 ASN 100 0.243 -3.136 -1.489 825 2HD2 ASN 100 HD22 ASN 100 0.653 -1.656 -2.210 826 H GLU 101 H GLU 101 4.558 -4.182 1.881 827 HA GLU 101 HA GLU 101 3.384 -6.008 3.796 828 1HB GLU 101 HB2 GLU 101 5.123 -6.687 2.148 829 2HB GLU 101 HB3 GLU 101 6.293 -5.678 2.999 830 1HG GLU 101 HG2 GLU 101 6.193 -7.026 4.956 831 2HG GLU 101 HG3 GLU 101 4.729 -7.845 4.409 832 H ALA 102 H ALA 102 5.396 -3.145 4.024 833 HA ALA 102 HA ALA 102 6.289 -3.565 6.731 834 1HB ALA 102 HB1 ALA 102 6.404 -1.435 4.737 835 2HB ALA 102 HB2 ALA 102 6.142 -0.806 6.364 836 3HB ALA 102 HB3 ALA 102 7.545 -1.822 6.026 837 H LEU 103 H LEU 103 3.420 -2.103 5.295 838 HA LEU 103 HA LEU 103 2.426 -1.034 7.807 839 1HB LEU 103 HB2 LEU 103 0.998 -1.638 5.196 840 2HB LEU 103 HB3 LEU 103 0.299 -0.741 6.545 841 HG LEU 103 HG LEU 103 2.874 0.371 5.923 842 1HD1 LEU 103 HD11 LEU 103 2.108 -0.747 3.661 843 2HD1 LEU 103 HD12 LEU 103 1.006 0.629 3.587 844 3HD1 LEU 103 HD13 LEU 103 2.747 0.897 3.656 845 1HD2 LEU 103 HD21 LEU 103 0.071 1.174 6.288 846 2HD2 LEU 103 HD22 LEU 103 1.547 1.993 6.797 847 3HD2 LEU 103 HD23 LEU 103 0.948 2.197 5.150 848 H VAL 104 H VAL 104 1.682 -3.928 5.849 849 HA VAL 104 HA VAL 104 -0.330 -5.009 7.522 850 HB VAL 104 HB VAL 104 1.758 -6.367 5.798 851 1HG1 VAL 104 HG11 VAL 104 -0.334 -7.469 7.607 852 2HG1 VAL 104 HG12 VAL 104 -0.195 -8.211 6.013 853 3HG1 VAL 104 HG13 VAL 104 1.197 -8.178 7.096 854 1HG2 VAL 104 HG21 VAL 104 0.026 -4.902 4.709 855 2HG2 VAL 104 HG22 VAL 104 -0.075 -6.594 4.220 856 3HG2 VAL 104 HG23 VAL 104 -1.219 -5.945 5.396 857 H ARG 105 H ARG 105 3.210 -5.320 7.704 858 HA ARG 105 HA ARG 105 3.210 -7.143 9.930 859 1HB ARG 105 HB2 ARG 105 5.149 -6.548 8.326 860 2HB ARG 105 HB3 ARG 105 5.401 -5.145 9.366 861 1HG ARG 105 HG2 ARG 105 5.088 -7.338 11.110 862 2HG ARG 105 HG3 ARG 105 6.155 -7.899 9.824 863 1HD ARG 105 HD2 ARG 105 6.951 -5.247 10.494 864 2HD ARG 105 HD3 ARG 105 6.774 -6.144 12.002 865 HE ARG 105 HE ARG 105 8.564 -7.569 11.324 866 1HH1 ARG 105 HH11 ARG 105 7.193 -6.454 8.465 867 2HH1 ARG 105 HH12 ARG 105 8.687 -6.298 7.605 868 1HH2 ARG 105 HH21 ARG 105 10.661 -6.921 10.388 869 2HH2 ARG 105 HH22 ARG 105 10.652 -6.559 8.695 870 H GLN 106 H GLN 106 3.241 -3.605 9.681 871 HA GLN 106 HA GLN 106 3.568 -3.229 12.554 872 1HB GLN 106 HB2 GLN 106 4.048 -1.592 10.508 873 2HB GLN 106 HB3 GLN 106 2.380 -1.104 10.815 874 1HG GLN 106 HG2 GLN 106 3.103 0.168 12.520 875 2HG GLN 106 HG3 GLN 106 3.635 -1.297 13.347 876 1HE2 GLN 106 HE21 GLN 106 5.190 0.933 13.800 877 2HE2 GLN 106 HE22 GLN 106 6.654 0.831 12.946 878 H GLY 107 H GLY 107 1.030 -4.384 10.755 879 1HA GLY 107 HA2 GLY 107 -1.225 -4.741 11.306 880 2HA GLY 107 HA3 GLY 107 -0.841 -4.161 12.927 881 H LEU 108 H LEU 108 -0.123 -2.142 10.188 882 HA LEU 108 HA LEU 108 -2.227 -0.254 11.117 883 1HB LEU 108 HB2 LEU 108 0.297 0.100 9.489 884 2HB LEU 108 HB3 LEU 108 -0.916 1.372 9.635 885 HG LEU 108 HG LEU 108 0.522 0.036 11.948 886 1HD1 LEU 108 HD11 LEU 108 0.860 2.662 10.507 887 2HD1 LEU 108 HD12 LEU 108 1.330 2.497 12.199 888 3HD1 LEU 108 HD13 LEU 108 2.094 1.490 10.970 889 1HD2 LEU 108 HD21 LEU 108 -1.949 1.498 11.786 890 2HD2 LEU 108 HD22 LEU 108 -1.153 0.847 13.219 891 3HD2 LEU 108 HD23 LEU 108 -0.767 2.474 12.659 892 H ALA 109 H ALA 109 -1.510 -2.436 8.590 893 HA ALA 109 HA ALA 109 -3.794 -1.334 7.025 894 1HB ALA 109 HB1 ALA 109 -1.136 -2.265 5.896 895 2HB ALA 109 HB2 ALA 109 -2.563 -1.900 4.925 896 3HB ALA 109 HB3 ALA 109 -1.774 -0.621 5.849 897 H LYS 110 H LYS 110 -4.583 -3.076 5.418 898 HA LYS 110 HA LYS 110 -4.024 -5.823 6.420 899 1HB LYS 110 HB2 LYS 110 -6.538 -6.250 6.320 900 2HB LYS 110 HB3 LYS 110 -5.985 -5.248 7.663 901 1HG LYS 110 HG2 LYS 110 -7.067 -3.410 6.892 902 2HG LYS 110 HG3 LYS 110 -6.597 -3.730 5.221 903 1HD LYS 110 HD2 LYS 110 -8.404 -5.198 4.863 904 2HD LYS 110 HD3 LYS 110 -8.669 -5.436 6.590 905 1HE LYS 110 HE2 LYS 110 -9.838 -3.468 6.824 906 2HE LYS 110 HE3 LYS 110 -8.925 -2.654 5.554 907 1HZ LYS 110 HZ1 LYS 110 -10.194 -4.630 4.218 908 2HZ LYS 110 HZ2 LYS 110 -11.355 -4.179 5.375 909 3HZ LYS 110 HZ3 LYS 110 -10.723 -3.018 4.311 910 H VAL 111 H VAL 111 -4.654 -7.490 4.875 911 HA VAL 111 HA VAL 111 -4.323 -6.581 2.112 912 HB VAL 111 HB VAL 111 -4.801 -9.361 3.229 913 1HG1 VAL 111 HG11 VAL 111 -4.881 -8.370 0.569 914 2HG1 VAL 111 HG12 VAL 111 -3.361 -9.248 0.740 915 3HG1 VAL 111 HG13 VAL 111 -4.890 -10.055 1.089 916 1HG2 VAL 111 HG21 VAL 111 -2.651 -7.867 3.775 917 2HG2 VAL 111 HG22 VAL 111 -2.510 -9.591 3.435 918 3HG2 VAL 111 HG23 VAL 111 -2.173 -8.413 2.167 919 H ALA 112 H ALA 112 -5.918 -6.485 0.557 920 HA ALA 112 HA ALA 112 -8.459 -7.832 0.800 921 1HB ALA 112 HB1 ALA 112 -8.305 -4.896 1.517 922 2HB ALA 112 HB2 ALA 112 -9.801 -5.668 0.992 923 3HB ALA 112 HB3 ALA 112 -9.003 -6.206 2.471 924 H TYR 113 H TYR 113 -10.068 -6.406 -0.817 925 HA TYR 113 HA TYR 113 -10.405 -5.980 -3.103 926 1HB TYR 113 HB2 TYR 113 -7.907 -4.388 -2.481 927 2HB TYR 113 HB3 TYR 113 -8.707 -4.317 -4.051 928 HD1 TYR 113 HD1 TYR 113 -11.432 -4.147 -3.768 929 HD2 TYR 113 HD2 TYR 113 -8.487 -2.692 -1.001 930 HE1 TYR 113 HE1 TYR 113 -13.084 -2.540 -2.856 931 HE2 TYR 113 HE2 TYR 113 -10.141 -1.085 -0.084 932 HH TYR 113 HH TYR 113 -12.164 -0.054 -0.567 933 H VAL 114 H VAL 114 -9.747 -8.421 -3.213 934 HA VAL 114 HA VAL 114 -7.185 -8.762 -4.694 935 HB VAL 114 HB VAL 114 -9.086 -10.886 -3.658 936 1HG1 VAL 114 HG11 VAL 114 -7.407 -11.374 -5.560 937 2HG1 VAL 114 HG12 VAL 114 -6.158 -11.159 -4.334 938 3HG1 VAL 114 HG13 VAL 114 -7.364 -12.433 -4.151 939 1HG2 VAL 114 HG21 VAL 114 -7.737 -9.188 -2.054 940 2HG2 VAL 114 HG22 VAL 114 -7.970 -10.887 -1.646 941 3HG2 VAL 114 HG23 VAL 114 -6.453 -10.353 -2.370 942 H TYR 115 H TYR 115 -7.331 -8.728 -6.884 943 HA TYR 115 HA TYR 115 -9.682 -10.005 -8.169 944 1HB TYR 115 HB2 TYR 115 -8.703 -7.254 -8.976 945 2HB TYR 115 HB3 TYR 115 -10.115 -8.111 -9.597 946 HD1 TYR 115 HD1 TYR 115 -12.056 -8.584 -8.064 947 HD2 TYR 115 HD2 TYR 115 -8.806 -6.013 -6.939 948 HE1 TYR 115 HE1 TYR 115 -13.442 -7.631 -6.242 949 HE2 TYR 115 HE2 TYR 115 -10.190 -5.059 -5.115 950 HH TYR 115 HH TYR 115 -13.388 -5.248 -4.949 951 H LYS 116 H LYS 116 -9.191 -10.919 -10.177 952 HA LYS 116 HA LYS 116 -6.306 -11.115 -10.794 953 1HB LYS 116 HB2 LYS 116 -8.451 -12.513 -12.368 954 2HB LYS 116 HB3 LYS 116 -6.820 -13.059 -11.982 955 1HG LYS 116 HG2 LYS 116 -7.434 -13.430 -9.659 956 2HG LYS 116 HG3 LYS 116 -9.032 -12.738 -9.933 957 1HD LYS 116 HD2 LYS 116 -8.434 -14.871 -11.830 958 2HD LYS 116 HD3 LYS 116 -8.358 -15.431 -10.159 959 1HE LYS 116 HE2 LYS 116 -10.621 -13.822 -10.189 960 2HE LYS 116 HE3 LYS 116 -10.686 -14.645 -11.748 961 1HZ LYS 116 HZ1 LYS 116 -10.295 -15.998 -9.133 962 2HZ LYS 116 HZ2 LYS 116 -11.773 -15.902 -9.960 963 3HZ LYS 116 HZ3 LYS 116 -10.473 -16.752 -10.645 964 HA PRO 117 HA PRO 117 -5.339 -11.973 -12.445 965 1HB PRO 117 HB2 PRO 117 -3.403 -11.248 -14.231 966 2HB PRO 117 HB3 PRO 117 -4.827 -12.197 -14.688 967 1HG PRO 117 HG2 PRO 117 -4.182 -9.388 -15.325 968 2HG PRO 117 HG3 PRO 117 -5.320 -10.485 -16.120 969 1HD PRO 117 HD2 PRO 117 -5.916 -8.401 -14.210 970 2HD PRO 117 HD3 PRO 117 -7.055 -9.498 -15.020 971 H ASN 118 H ASN 118 -5.555 -9.056 -11.348 972 HA ASN 118 HA ASN 118 -2.710 -8.429 -10.853 973 1HB ASN 118 HB2 ASN 118 -5.323 -7.050 -10.414 974 2HB ASN 118 HB3 ASN 118 -3.978 -6.613 -9.360 975 1HD2 ASN 118 HD21 ASN 118 -4.905 -4.662 -11.133 976 2HD2 ASN 118 HD22 ASN 118 -3.777 -4.431 -12.379 977 H ASN 119 H ASN 119 -2.389 -10.505 -9.637 978 HA ASN 119 HA ASN 119 -2.650 -10.035 -6.781 979 1HB ASN 119 HB2 ASN 119 -4.016 -12.022 -6.277 980 2HB ASN 119 HB3 ASN 119 -4.920 -10.885 -7.279 981 1HD2 ASN 119 HD21 ASN 119 -6.251 -12.554 -8.261 982 2HD2 ASN 119 HD22 ASN 119 -5.606 -13.681 -9.355 983 H THR 120 H THR 120 -0.507 -10.567 -8.671 984 HA THR 120 HA THR 120 0.351 -13.297 -8.548 985 HB THR 120 HB THR 120 1.239 -11.303 -9.992 986 HG1 THR 120 HG1 THR 120 2.182 -13.201 -10.345 987 1HG2 THR 120 HG21 THR 120 3.020 -11.108 -7.549 988 2HG2 THR 120 HG22 THR 120 3.308 -10.300 -9.090 989 3HG2 THR 120 HG23 THR 120 1.904 -9.865 -8.116 990 H HIS 121 H HIS 121 1.168 -10.481 -6.520 991 HA HIS 121 HA HIS 121 2.557 -12.256 -4.603 992 1HB HIS 121 HB2 HIS 121 2.170 -9.255 -4.739 993 2HB HIS 121 HB3 HIS 121 2.958 -10.060 -3.382 994 HD1 HIS 121 HD1 HIS 121 4.555 -12.206 -4.948 995 HD2 HIS 121 HD2 HIS 121 4.406 -8.179 -6.019 996 HE1 HIS 121 HE1 HIS 121 6.618 -11.760 -6.345 997 H GLU 122 H GLU 122 -0.400 -12.402 -5.039 998 HA GLU 122 HA GLU 122 -1.681 -11.200 -2.736 999 1HB GLU 122 HB2 GLU 122 -2.977 -11.827 -4.727 1000 2HB GLU 122 HB3 GLU 122 -2.551 -13.522 -4.486 1001 1HG GLU 122 HG2 GLU 122 -3.554 -12.830 -2.019 1002 2HG GLU 122 HG3 GLU 122 -4.570 -11.884 -3.107 1003 H GLN 123 H GLN 123 -0.242 -14.367 -3.422 1004 HA GLN 123 HA GLN 123 -1.096 -15.605 -0.965 1005 1HB GLN 123 HB2 GLN 123 0.962 -16.196 -3.059 1006 2HB GLN 123 HB3 GLN 123 1.074 -17.038 -1.513 1007 1HG GLN 123 HG2 GLN 123 -1.343 -16.975 -3.343 1008 2HG GLN 123 HG3 GLN 123 -0.279 -18.356 -3.070 1009 1HE2 GLN 123 HE21 GLN 123 0.015 -17.860 -0.165 1010 2HE2 GLN 123 HE22 GLN 123 -1.473 -18.271 0.542 1011 H LEU 124 H LEU 124 2.083 -14.240 -1.918 1012 HA LEU 124 HA LEU 124 3.381 -14.478 0.554 1013 1HB LEU 124 HB2 LEU 124 4.288 -13.544 -1.678 1014 2HB LEU 124 HB3 LEU 124 3.639 -11.993 -1.143 1015 HG LEU 124 HG LEU 124 6.046 -12.321 -0.528 1016 1HD1 LEU 124 HD11 LEU 124 4.143 -11.079 0.863 1017 2HD1 LEU 124 HD12 LEU 124 4.525 -12.329 2.045 1018 3HD1 LEU 124 HD13 LEU 124 5.783 -11.226 1.491 1019 1HD2 LEU 124 HD21 LEU 124 5.167 -14.881 0.160 1020 2HD2 LEU 124 HD22 LEU 124 6.754 -14.199 0.515 1021 3HD2 LEU 124 HD23 LEU 124 5.463 -14.099 1.712 1022 H LEU 125 H LEU 125 1.663 -11.538 -0.575 1023 HA LEU 125 HA LEU 125 1.708 -10.104 1.824 1024 1HB LEU 125 HB2 LEU 125 -0.301 -10.260 -0.412 1025 2HB LEU 125 HB3 LEU 125 -0.627 -9.257 1.001 1026 HG LEU 125 HG LEU 125 1.834 -9.067 -0.760 1027 1HD1 LEU 125 HD11 LEU 125 -0.786 -7.642 -0.672 1028 2HD1 LEU 125 HD12 LEU 125 0.655 -6.668 -0.970 1029 3HD1 LEU 125 HD13 LEU 125 0.252 -8.001 -2.053 1030 1HD2 LEU 125 HD21 LEU 125 1.038 -7.878 1.856 1031 2HD2 LEU 125 HD22 LEU 125 2.644 -8.274 1.245 1032 3HD2 LEU 125 HD23 LEU 125 1.831 -6.807 0.700 1033 H ARG 126 H ARG 126 -0.352 -12.817 0.910 1034 HA ARG 126 HA ARG 126 -2.253 -12.623 3.028 1035 1HB ARG 126 HB2 ARG 126 -2.134 -14.216 0.930 1036 2HB ARG 126 HB3 ARG 126 -1.285 -15.289 2.043 1037 1HG ARG 126 HG2 ARG 126 -3.797 -14.036 3.040 1038 2HG ARG 126 HG3 ARG 126 -3.964 -15.295 1.815 1039 1HD ARG 126 HD2 ARG 126 -2.627 -16.834 3.189 1040 2HD ARG 126 HD3 ARG 126 -2.414 -15.577 4.407 1041 HE ARG 126 HE ARG 126 -5.203 -15.914 3.992 1042 1HH1 ARG 126 HH11 ARG 126 -2.826 -16.549 6.191 1043 2HH1 ARG 126 HH12 ARG 126 -3.549 -17.971 6.868 1044 1HH2 ARG 126 HH21 ARG 126 -5.989 -18.219 4.418 1045 2HH2 ARG 126 HH22 ARG 126 -5.337 -18.918 5.862 1046 H LYS 127 H LYS 127 0.812 -14.455 2.833 1047 HA LYS 127 HA LYS 127 0.738 -15.573 5.429 1048 1HB LYS 127 HB2 LYS 127 2.410 -16.282 3.812 1049 2HB LYS 127 HB3 LYS 127 3.110 -14.665 3.779 1050 1HG LYS 127 HG2 LYS 127 4.306 -16.402 5.246 1051 2HG LYS 127 HG3 LYS 127 3.931 -14.854 6.000 1052 1HD LYS 127 HD2 LYS 127 3.360 -16.893 7.400 1053 2HD LYS 127 HD3 LYS 127 2.023 -15.774 7.135 1054 1HE LYS 127 HE2 LYS 127 0.822 -17.379 6.111 1055 2HE LYS 127 HE3 LYS 127 2.136 -17.691 4.979 1056 1HZ LYS 127 HZ1 LYS 127 2.727 -18.695 7.575 1057 2HZ LYS 127 HZ2 LYS 127 1.278 -19.352 6.979 1058 3HZ LYS 127 HZ3 LYS 127 2.710 -19.508 6.084 1059 H SER 128 H SER 128 2.298 -12.542 4.377 1060 HA SER 128 HA SER 128 3.216 -11.662 6.879 1061 1HB SER 128 HB2 SER 128 1.952 -9.717 4.967 1062 2HB SER 128 HB3 SER 128 3.414 -9.531 5.931 1063 HG SER 128 HG SER 128 4.356 -10.112 4.138 1064 H GLU 129 H GLU 129 -0.046 -11.561 5.532 1065 HA GLU 129 HA GLU 129 -1.198 -9.846 7.522 1066 1HB GLU 129 HB2 GLU 129 -2.385 -10.357 5.441 1067 2HB GLU 129 HB3 GLU 129 -2.462 -12.065 5.880 1068 1HG GLU 129 HG2 GLU 129 -3.680 -11.300 8.007 1069 2HG GLU 129 HG3 GLU 129 -3.857 -9.737 7.209 1070 H ALA 130 H ALA 130 -0.932 -13.401 7.306 1071 HA ALA 130 HA ALA 130 -2.304 -14.063 9.675 1072 1HB ALA 130 HB1 ALA 130 -0.654 -15.405 7.812 1073 2HB ALA 130 HB2 ALA 130 0.043 -15.717 9.402 1074 3HB ALA 130 HB3 ALA 130 -1.641 -16.131 9.082 1075 H GLN 131 H GLN 131 1.070 -13.068 9.228 1076 HA GLN 131 HA GLN 131 1.870 -13.431 11.957 1077 1HB GLN 131 HB2 GLN 131 3.414 -13.062 9.979 1078 2HB GLN 131 HB3 GLN 131 2.953 -11.360 10.027 1079 1HG GLN 131 HG2 GLN 131 4.040 -10.978 12.039 1080 2HG GLN 131 HG3 GLN 131 3.876 -12.654 12.563 1081 1HE2 GLN 131 HE21 GLN 131 6.079 -10.416 11.247 1082 2HE2 GLN 131 HE22 GLN 131 7.248 -11.520 10.704 1083 H ALA 132 H ALA 132 0.341 -10.749 10.230 1084 HA ALA 132 HA ALA 132 0.580 -8.808 12.325 1085 1HB ALA 132 HB1 ALA 132 -0.220 -8.576 9.820 1086 2HB ALA 132 HB2 ALA 132 -1.813 -8.873 10.516 1087 3HB ALA 132 HB3 ALA 132 -0.859 -7.490 11.054 1088 H LYS 133 H LYS 133 -1.658 -11.459 11.761 1089 HA LYS 133 HA LYS 133 -3.573 -10.589 13.775 1090 1HB LYS 133 HB2 LYS 133 -3.249 -12.862 11.939 1091 2HB LYS 133 HB3 LYS 133 -3.942 -13.311 13.497 1092 1HG LYS 133 HG2 LYS 133 -5.496 -11.265 13.168 1093 2HG LYS 133 HG3 LYS 133 -4.994 -11.333 11.478 1094 1HD LYS 133 HD2 LYS 133 -6.090 -13.734 12.958 1095 2HD LYS 133 HD3 LYS 133 -7.112 -12.631 12.036 1096 1HE LYS 133 HE2 LYS 133 -4.682 -13.664 10.661 1097 2HE LYS 133 HE3 LYS 133 -5.992 -14.814 10.929 1098 1HZ LYS 133 HZ1 LYS 133 -6.665 -12.162 9.882 1099 2HZ LYS 133 HZ2 LYS 133 -5.945 -13.279 8.824 1100 3HZ LYS 133 HZ3 LYS 133 -7.408 -13.663 9.592 1101 H LYS 134 H LYS 134 -0.803 -12.802 13.687 1102 HA LYS 134 HA LYS 134 -1.208 -13.756 16.395 1103 1HB LYS 134 HB2 LYS 134 1.263 -13.817 14.638 1104 2HB LYS 134 HB3 LYS 134 1.018 -14.757 16.105 1105 1HG LYS 134 HG2 LYS 134 -0.789 -15.995 15.115 1106 2HG LYS 134 HG3 LYS 134 -0.829 -14.920 13.716 1107 1HD LYS 134 HD2 LYS 134 1.121 -15.806 12.805 1108 2HD LYS 134 HD3 LYS 134 1.715 -16.371 14.367 1109 1HE LYS 134 HE2 LYS 134 0.979 -18.274 12.997 1110 2HE LYS 134 HE3 LYS 134 -0.062 -18.095 14.410 1111 1HZ LYS 134 HZ1 LYS 134 -1.215 -16.506 12.519 1112 2HZ LYS 134 HZ2 LYS 134 -0.712 -17.868 11.638 1113 3HZ LYS 134 HZ3 LYS 134 -1.738 -18.056 12.974 1114 H GLU 135 H GLU 135 0.025 -10.874 15.046 1115 HA GLU 135 HA GLU 135 1.689 -10.313 17.450 1116 1HB GLU 135 HB2 GLU 135 1.399 -8.887 14.793 1117 2HB GLU 135 HB3 GLU 135 2.363 -8.264 16.131 1118 1HG GLU 135 HG2 GLU 135 3.148 -10.943 15.868 1119 2HG GLU 135 HG3 GLU 135 3.025 -10.341 14.214 1120 H LYS 136 H LYS 136 -1.359 -9.524 15.985 1121 HA LYS 136 HA LYS 136 -3.021 -7.969 16.596 1122 1HB LYS 136 HB2 LYS 136 -1.926 -8.128 19.393 1123 2HB LYS 136 HB3 LYS 136 -3.607 -8.078 18.861 1124 1HG LYS 136 HG2 LYS 136 -3.587 -10.325 19.150 1125 2HG LYS 136 HG3 LYS 136 -2.660 -10.375 17.650 1126 1HD LYS 136 HD2 LYS 136 -0.787 -11.014 18.729 1127 2HD LYS 136 HD3 LYS 136 -0.968 -9.736 19.931 1128 1HE LYS 136 HE2 LYS 136 -1.617 -11.270 21.441 1129 2HE LYS 136 HE3 LYS 136 -3.011 -11.651 20.430 1130 1HZ LYS 136 HZ1 LYS 136 -1.156 -12.964 19.111 1131 2HZ LYS 136 HZ2 LYS 136 -0.446 -13.021 20.654 1132 3HZ LYS 136 HZ3 LYS 136 -1.999 -13.659 20.411 1133 H LEU 137 H LEU 137 -1.308 -6.461 15.419 1134 HA LEU 137 HA LEU 137 -0.221 -4.453 17.321 1135 1HB LEU 137 HB2 LEU 137 0.583 -5.469 14.738 1136 2HB LEU 137 HB3 LEU 137 0.403 -3.714 14.672 1137 HG LEU 137 HG LEU 137 1.726 -4.633 17.120 1138 1HD1 LEU 137 HD11 LEU 137 2.684 -5.533 14.448 1139 2HD1 LEU 137 HD12 LEU 137 3.897 -4.875 15.547 1140 3HD1 LEU 137 HD13 LEU 137 2.926 -6.264 16.035 1141 1HD2 LEU 137 HD21 LEU 137 1.572 -2.348 15.504 1142 2HD2 LEU 137 HD22 LEU 137 2.600 -2.560 16.920 1143 3HD2 LEU 137 HD23 LEU 137 3.230 -2.917 15.313 1144 H ASN 138 H ASN 138 -1.375 -2.645 17.697 1145 HA ASN 138 HA ASN 138 -3.071 -1.034 17.487 1146 1HB ASN 138 HB2 ASN 138 -2.113 -1.188 14.612 1147 2HB ASN 138 HB3 ASN 138 -3.047 0.137 15.308 1148 1HD2 ASN 138 HD21 ASN 138 0.123 -0.957 14.728 1149 2HD2 ASN 138 HD22 ASN 138 0.939 0.089 15.787 1150 H ILE 139 H ILE 139 -3.655 -2.037 14.179 1151 HA ILE 139 HA ILE 139 -6.442 -2.278 14.476 1152 HB ILE 139 HB ILE 139 -4.548 -3.579 12.503 1153 1HG1 ILE 139 HG12 ILE 139 -6.536 -1.432 11.866 1154 2HG1 ILE 139 HG13 ILE 139 -5.070 -0.980 12.737 1155 1HG2 ILE 139 HG21 ILE 139 -7.532 -3.723 12.790 1156 2HG2 ILE 139 HG22 ILE 139 -6.827 -3.683 11.173 1157 3HG2 ILE 139 HG23 ILE 139 -6.396 -4.977 12.292 1158 1HD1 ILE 139 HD11 ILE 139 -4.082 -2.627 10.766 1159 2HD1 ILE 139 HD12 ILE 139 -5.402 -1.807 9.934 1160 3HD1 ILE 139 HD13 ILE 139 -4.113 -0.866 10.684 1161 H TRP 140 H TRP 140 -4.191 -5.035 14.084 1162 HA TRP 140 HA TRP 140 -6.163 -6.935 15.011 1163 1HB TRP 140 HB2 TRP 140 -3.162 -7.316 14.845 1164 2HB TRP 140 HB3 TRP 140 -4.405 -8.570 14.796 1165 HD1 TRP 140 HD1 TRP 140 -2.518 -6.192 12.622 1166 HE1 TRP 140 HE1 TRP 140 -3.367 -6.355 10.192 1167 HE3 TRP 140 HE3 TRP 140 -6.724 -8.995 13.345 1168 HZ2 TRP 140 HZ2 TRP 140 -5.546 -7.521 8.747 1169 HZ3 TRP 140 HZ3 TRP 140 -8.168 -9.615 11.428 1170 HH2 TRP 140 HH2 TRP 140 -7.586 -8.882 9.133 1171 H SER 141 H SER 141 -4.459 -4.649 16.712 1172 HA SER 141 HA SER 141 -3.532 -6.084 18.995 1173 1HB SER 141 HB2 SER 141 -3.297 -3.540 18.310 1174 2HB SER 141 HB3 SER 141 -4.753 -3.361 19.285 1175 HG SER 141 HG SER 141 -2.206 -3.682 20.069 1176 H GLU 142 H GLU 142 -6.577 -4.245 18.641 1177 HA GLU 142 HA GLU 142 -7.733 -5.527 20.990 1178 1HB GLU 142 HB2 GLU 142 -9.006 -3.814 18.833 1179 2HB GLU 142 HB3 GLU 142 -9.788 -4.296 20.338 1180 1HG GLU 142 HG2 GLU 142 -7.137 -2.856 20.347 1181 2HG GLU 142 HG3 GLU 142 -8.660 -1.970 20.277 1182 H ASP 143 H ASP 143 -9.074 -5.411 17.676 1183 HA ASP 143 HA ASP 143 -10.291 -7.039 16.500 1184 1HB ASP 143 HB2 ASP 143 -8.165 -8.102 16.195 1185 2HB ASP 143 HB3 ASP 143 -8.152 -8.697 17.856 1186 H ASN 144 H ASN 144 -12.342 -7.073 17.411 1187 HA ASN 144 HA ASN 144 -12.721 -8.828 19.802 1188 1HB ASN 144 HB2 ASN 144 -14.730 -7.553 20.280 1189 2HB ASN 144 HB3 ASN 144 -13.402 -6.417 20.037 1190 1HD2 ASN 144 HD21 ASN 144 -14.050 -4.681 18.773 1191 2HD2 ASN 144 HD22 ASN 144 -15.150 -4.765 17.483 1192 H ALA 145 H ALA 145 -12.761 -9.214 16.651 1193 HA ALA 145 HA ALA 145 -15.386 -10.648 16.592 1194 1HB ALA 145 HB1 ALA 145 -14.352 -8.790 14.793 1195 2HB ALA 145 HB2 ALA 145 -14.039 -10.342 14.017 1196 3HB ALA 145 HB3 ALA 145 -15.683 -9.902 14.478 1197 H ASP 146 H ASP 146 -15.335 -12.845 16.357 1198 HA ASP 146 HA ASP 146 -12.826 -14.117 15.390 1199 1HB ASP 146 HB2 ASP 146 -13.199 -15.849 17.274 1200 2HB ASP 146 HB3 ASP 146 -12.496 -14.296 17.728 1201 H SER 147 H SER 147 -14.370 -14.301 13.507 1202 HA SER 147 HA SER 147 -16.792 -15.711 13.520 1203 1HB SER 147 HB2 SER 147 -16.180 -16.376 11.164 1204 2HB SER 147 HB3 SER 147 -16.015 -14.654 11.494 1205 HG SER 147 HG SER 147 -13.838 -16.373 11.925 1206 H GLY 148 H GLY 148 -17.275 -17.962 13.070 1207 1HA GLY 148 HA2 GLY 148 -15.105 -19.932 13.329 1208 2HA GLY 148 HA3 GLY 148 -16.248 -19.898 14.673 1209 H GLN 149 H GLN 149 -18.586 -20.166 14.076 1210 HA GLN 149 HA GLN 149 -19.276 -21.203 11.460 1211 1HB GLN 149 HB2 GLN 149 -19.829 -23.522 12.276 1212 2HB GLN 149 HB3 GLN 149 -18.099 -23.183 12.214 1213 1HG GLN 149 HG2 GLN 149 -18.699 -22.334 14.739 1214 2HG GLN 149 HG3 GLN 149 -19.839 -23.667 14.553 1215 1HE2 GLN 149 HE21 GLN 149 -18.124 -25.241 12.741 1216 2HE2 GLN 149 HE22 GLN 149 -16.840 -25.832 13.679 1217 HN3 PTP 150 H3 PTP 150 -9.106 -4.235 -8.070 1218 1H5M PTP 150 H51 PTP 150 -6.071 -1.640 -5.188 1219 2H5M PTP 150 H52 PTP 150 -6.774 -2.907 -4.154 1220 3H5M PTP 150 H53 PTP 150 -7.287 -1.213 -3.960 1221 H6 PTP 150 H6 PTP 150 -9.105 -0.439 -5.121 1222 H1* PTP 150 H1' PTP 150 -11.624 -0.547 -7.803 1223 2H2* PTP 150 H2' PTP 150 -11.912 -1.207 -4.859 1224 H3* PTP 150 H3' PTP 150 -12.976 0.900 -4.460 1225 H4* PTP 150 H4' PTP 150 -11.563 2.541 -6.127 1226 2H5* PTP 150 H5' PTP 150 -10.482 0.769 -3.851 Start of MODEL 16 1 1H ALA 1 H1 ALA 1 13.291 -24.010 -3.444 2 2H ALA 1 H2 ALA 1 14.470 -23.312 -4.447 3 3H ALA 1 H3 ALA 1 14.917 -23.983 -2.955 4 HA ALA 1 HA ALA 1 13.423 -22.290 -1.873 5 1HB ALA 1 HB1 ALA 1 16.000 -22.225 -2.155 6 2HB ALA 1 HB2 ALA 1 15.690 -21.048 -3.430 7 3HB ALA 1 HB3 ALA 1 15.180 -20.711 -1.776 8 H THR 2 H THR 2 13.438 -19.658 -2.570 9 HA THR 2 HA THR 2 12.493 -19.202 -5.277 10 HB THR 2 HB THR 2 10.439 -20.177 -4.680 11 HG1 THR 2 HG1 THR 2 9.058 -18.444 -4.507 12 1HG2 THR 2 HG21 THR 2 11.335 -19.524 -2.014 13 2HG2 THR 2 HG22 THR 2 9.659 -19.022 -2.229 14 3HG2 THR 2 HG23 THR 2 10.121 -20.699 -2.517 15 H SER 3 H SER 3 12.939 -17.087 -5.697 16 HA SER 3 HA SER 3 13.283 -15.266 -3.357 17 1HB SER 3 HB2 SER 3 14.270 -14.566 -6.094 18 2HB SER 3 HB3 SER 3 14.957 -14.167 -4.522 19 HG SER 3 HG SER 3 16.244 -15.768 -5.088 20 H THR 4 H THR 4 13.066 -12.815 -4.506 21 HA THR 4 HA THR 4 10.192 -12.745 -5.241 22 HB THR 4 HB THR 4 10.177 -10.514 -4.488 23 HG1 THR 4 HG1 THR 4 12.295 -9.466 -4.134 24 1HG2 THR 4 HG21 THR 4 12.323 -11.934 -2.887 25 2HG2 THR 4 HG22 THR 4 11.405 -10.533 -2.337 26 3HG2 THR 4 HG23 THR 4 10.584 -12.065 -2.632 27 H LYS 5 H LYS 5 12.911 -13.121 -6.937 28 HA LYS 5 HA LYS 5 12.690 -10.998 -8.909 29 1HB LYS 5 HB2 LYS 5 14.220 -13.560 -8.660 30 2HB LYS 5 HB3 LYS 5 14.057 -12.838 -10.262 31 1HG LYS 5 HG2 LYS 5 16.040 -11.879 -9.394 32 2HG LYS 5 HG3 LYS 5 14.812 -10.638 -9.146 33 1HD LYS 5 HD2 LYS 5 15.632 -10.656 -7.009 34 2HD LYS 5 HD3 LYS 5 14.533 -12.027 -6.838 35 1HE LYS 5 HE2 LYS 5 16.267 -13.604 -7.089 36 2HE LYS 5 HE3 LYS 5 17.357 -12.422 -7.815 37 1HZ LYS 5 HZ1 LYS 5 17.188 -11.229 -5.593 38 2HZ LYS 5 HZ2 LYS 5 16.545 -12.680 -4.987 39 3HZ LYS 5 HZ3 LYS 5 18.110 -12.655 -5.640 40 H LYS 6 H LYS 6 10.707 -10.899 -9.926 41 HA LYS 6 HA LYS 6 9.994 -13.162 -11.671 42 1HB LYS 6 HB2 LYS 6 8.334 -12.263 -9.331 43 2HB LYS 6 HB3 LYS 6 7.539 -12.873 -10.783 44 1HG LYS 6 HG2 LYS 6 8.981 -14.923 -10.638 45 2HG LYS 6 HG3 LYS 6 9.592 -14.327 -9.095 46 1HD LYS 6 HD2 LYS 6 7.829 -15.757 -8.464 47 2HD LYS 6 HD3 LYS 6 7.091 -14.155 -8.417 48 1HE LYS 6 HE2 LYS 6 5.775 -14.560 -10.247 49 2HE LYS 6 HE3 LYS 6 6.995 -15.564 -11.032 50 1HZ LYS 6 HZ1 LYS 6 5.857 -16.622 -8.577 51 2HZ LYS 6 HZ2 LYS 6 4.800 -16.541 -9.905 52 3HZ LYS 6 HZ3 LYS 6 6.252 -17.416 -10.023 53 H LEU 7 H LEU 7 8.249 -10.293 -10.428 54 HA LEU 7 HA LEU 7 7.560 -9.521 -13.168 55 1HB LEU 7 HB2 LEU 7 6.852 -8.616 -10.421 56 2HB LEU 7 HB3 LEU 7 6.748 -7.408 -11.702 57 HG LEU 7 HG LEU 7 5.593 -10.077 -12.316 58 1HD1 LEU 7 HD11 LEU 7 4.546 -8.225 -10.186 59 2HD1 LEU 7 HD12 LEU 7 3.425 -9.172 -11.165 60 3HD1 LEU 7 HD13 LEU 7 4.636 -9.987 -10.175 61 1HD2 LEU 7 HD21 LEU 7 5.443 -7.333 -13.211 62 2HD2 LEU 7 HD22 LEU 7 4.822 -8.785 -13.995 63 3HD2 LEU 7 HD23 LEU 7 3.827 -7.924 -12.822 64 H HIS 8 H HIS 8 7.771 -6.810 -13.243 65 HA HIS 8 HA HIS 8 10.717 -6.365 -13.018 66 1HB HIS 8 HB2 HIS 8 9.984 -4.492 -14.793 67 2HB HIS 8 HB3 HIS 8 10.391 -6.134 -15.287 68 HD1 HIS 8 HD1 HIS 8 8.325 -7.786 -15.669 69 HD2 HIS 8 HD2 HIS 8 7.317 -3.764 -15.232 70 HE1 HIS 8 HE1 HIS 8 5.939 -7.552 -16.487 71 H LYS 9 H LYS 9 11.377 -4.653 -11.778 72 HA LYS 9 HA LYS 9 9.241 -2.821 -10.764 73 1HB LYS 9 HB2 LYS 9 11.890 -3.407 -9.425 74 2HB LYS 9 HB3 LYS 9 10.479 -2.614 -8.722 75 1HG LYS 9 HG2 LYS 9 9.296 -4.899 -9.395 76 2HG LYS 9 HG3 LYS 9 10.944 -5.517 -9.281 77 1HD LYS 9 HD2 LYS 9 10.242 -3.752 -7.052 78 2HD LYS 9 HD3 LYS 9 9.204 -5.175 -7.150 79 1HE LYS 9 HE2 LYS 9 11.225 -5.608 -5.775 80 2HE LYS 9 HE3 LYS 9 11.173 -6.637 -7.206 81 1HZ LYS 9 HZ1 LYS 9 12.539 -4.049 -7.379 82 2HZ LYS 9 HZ2 LYS 9 13.325 -5.329 -6.585 83 3HZ LYS 9 HZ3 LYS 9 12.856 -5.494 -8.209 84 H GLU 10 H GLU 10 9.545 -0.633 -11.055 85 HA GLU 10 HA GLU 10 12.163 0.214 -12.232 86 1HB GLU 10 HB2 GLU 10 9.376 0.675 -13.119 87 2HB GLU 10 HB3 GLU 10 10.418 2.097 -13.147 88 1HG GLU 10 HG2 GLU 10 11.590 1.322 -14.915 89 2HG GLU 10 HG3 GLU 10 11.766 -0.275 -14.189 90 HA PRO 11 HA PRO 11 12.367 3.293 -9.096 91 1HB PRO 11 HB2 PRO 11 13.635 5.305 -10.440 92 2HB PRO 11 HB3 PRO 11 14.445 3.804 -9.958 93 1HG PRO 11 HG2 PRO 11 13.466 4.639 -12.653 94 2HG PRO 11 HG3 PRO 11 14.866 3.642 -12.223 95 1HD PRO 11 HD2 PRO 11 12.427 2.647 -13.153 96 2HD PRO 11 HD3 PRO 11 13.640 1.702 -12.262 97 H ALA 12 H ALA 12 11.755 5.628 -8.615 98 HA ALA 12 HA ALA 12 9.876 6.905 -10.478 99 1HB ALA 12 HB1 ALA 12 8.675 5.065 -9.009 100 2HB ALA 12 HB2 ALA 12 8.778 6.297 -7.750 101 3HB ALA 12 HB3 ALA 12 7.913 6.638 -9.250 102 H THR 13 H THR 13 8.687 8.690 -8.715 103 HA THR 13 HA THR 13 11.010 9.928 -7.296 104 HB THR 13 HB THR 13 8.972 11.617 -8.728 105 HG1 THR 13 HG1 THR 13 11.365 11.103 -10.009 106 1HG2 THR 13 HG21 THR 13 11.175 12.121 -7.088 107 2HG2 THR 13 HG22 THR 13 11.765 12.441 -8.720 108 3HG2 THR 13 HG23 THR 13 10.346 13.294 -8.112 109 H LEU 14 H LEU 14 10.488 10.866 -5.319 110 HA LEU 14 HA LEU 14 7.808 10.251 -4.269 111 1HB LEU 14 HB2 LEU 14 9.997 9.925 -2.980 112 2HB LEU 14 HB3 LEU 14 10.049 11.681 -2.822 113 HG LEU 14 HG LEU 14 8.971 10.501 -0.869 114 1HD1 LEU 14 HD11 LEU 14 8.367 12.886 -1.987 115 2HD1 LEU 14 HD12 LEU 14 6.792 12.100 -2.107 116 3HD1 LEU 14 HD13 LEU 14 7.568 12.282 -0.534 117 1HD2 LEU 14 HD21 LEU 14 7.856 8.791 -2.433 118 2HD2 LEU 14 HD22 LEU 14 6.858 9.432 -1.128 119 3HD2 LEU 14 HD23 LEU 14 6.663 10.045 -2.770 120 H ILE 15 H ILE 15 6.314 11.715 -5.058 121 HA ILE 15 HA ILE 15 6.984 14.574 -5.221 122 HB ILE 15 HB ILE 15 4.358 13.130 -5.706 123 1HG1 ILE 15 HG12 ILE 15 6.117 14.284 -7.846 124 2HG1 ILE 15 HG13 ILE 15 6.528 12.709 -7.166 125 1HG2 ILE 15 HG21 ILE 15 4.949 15.891 -5.402 126 2HG2 ILE 15 HG22 ILE 15 4.696 15.611 -7.125 127 3HG2 ILE 15 HG23 ILE 15 3.442 15.169 -5.966 128 1HD1 ILE 15 HD11 ILE 15 4.250 11.897 -7.687 129 2HD1 ILE 15 HD12 ILE 15 3.856 13.467 -8.389 130 3HD1 ILE 15 HD13 ILE 15 5.083 12.446 -9.141 131 H LYS 16 H LYS 16 4.292 12.805 -3.631 132 HA LYS 16 HA LYS 16 4.784 14.104 -1.089 133 1HB LYS 16 HB2 LYS 16 2.653 15.428 -1.084 134 2HB LYS 16 HB3 LYS 16 3.857 16.034 -2.221 135 1HG LYS 16 HG2 LYS 16 2.742 14.871 -4.067 136 2HG LYS 16 HG3 LYS 16 1.558 14.195 -2.948 137 1HD LYS 16 HD2 LYS 16 0.382 16.041 -3.699 138 2HD LYS 16 HD3 LYS 16 1.209 16.750 -2.312 139 1HE LYS 16 HE2 LYS 16 2.379 16.789 -5.102 140 2HE LYS 16 HE3 LYS 16 1.360 18.086 -4.477 141 1HZ LYS 16 HZ1 LYS 16 3.033 17.928 -2.485 142 2HZ LYS 16 HZ2 LYS 16 4.061 17.290 -3.675 143 3HZ LYS 16 HZ3 LYS 16 3.401 18.844 -3.868 144 H ALA 17 H ALA 17 4.092 12.621 0.364 145 HA ALA 17 HA ALA 17 2.273 10.481 -0.432 146 1HB ALA 17 HB1 ALA 17 3.946 11.141 1.927 147 2HB ALA 17 HB2 ALA 17 2.486 10.213 2.269 148 3HB ALA 17 HB3 ALA 17 3.683 9.588 1.134 149 H ILE 18 H ILE 18 0.078 10.496 -0.171 150 HA ILE 18 HA ILE 18 -1.117 12.832 1.214 151 HB ILE 18 HB ILE 18 -2.368 10.720 -0.569 152 1HG1 ILE 18 HG12 ILE 18 -1.903 13.647 -1.171 153 2HG1 ILE 18 HG13 ILE 18 -0.700 12.416 -1.558 154 1HG2 ILE 18 HG21 ILE 18 -3.929 11.722 1.105 155 2HG2 ILE 18 HG22 ILE 18 -3.519 13.322 0.485 156 3HG2 ILE 18 HG23 ILE 18 -4.340 12.157 -0.554 157 1HD1 ILE 18 HD11 ILE 18 -2.829 11.212 -2.634 158 2HD1 ILE 18 HD12 ILE 18 -3.396 12.877 -2.755 159 3HD1 ILE 18 HD13 ILE 18 -1.889 12.400 -3.536 160 H ASP 19 H ASP 19 -1.344 9.264 1.207 161 HA ASP 19 HA ASP 19 -2.262 9.442 4.033 162 1HB ASP 19 HB2 ASP 19 -3.551 7.617 1.986 163 2HB ASP 19 HB3 ASP 19 -4.039 7.845 3.665 164 H GLY 20 H GLY 20 -2.733 6.551 4.116 165 1HA GLY 20 HA2 GLY 20 0.043 5.713 4.492 166 2HA GLY 20 HA3 GLY 20 -1.390 4.742 4.840 167 H ASP 21 H ASP 21 -2.683 4.445 2.531 168 HA ASP 21 HA ASP 21 -0.692 3.046 0.822 169 1HB ASP 21 HB2 ASP 21 -3.718 2.855 0.779 170 2HB ASP 21 HB3 ASP 21 -2.583 1.794 -0.057 171 H THR 22 H THR 22 -1.249 6.006 0.796 172 HA THR 22 HA THR 22 -1.833 6.195 -2.123 173 HB THR 22 HB THR 22 -2.791 8.263 -0.138 174 HG1 THR 22 HG1 THR 22 -4.632 6.576 -1.301 175 1HG2 THR 22 HG21 THR 22 -3.067 7.729 -3.064 176 2HG2 THR 22 HG22 THR 22 -4.433 8.468 -2.227 177 3HG2 THR 22 HG23 THR 22 -2.858 9.262 -2.219 178 H VAL 23 H VAL 23 -0.094 7.122 -3.095 179 HA VAL 23 HA VAL 23 1.244 9.413 -1.803 180 HB VAL 23 HB VAL 23 3.507 8.311 -2.189 181 1HG1 VAL 23 HG11 VAL 23 2.270 8.536 0.041 182 2HG1 VAL 23 HG12 VAL 23 1.790 6.851 -0.171 183 3HG1 VAL 23 HG13 VAL 23 3.498 7.274 -0.040 184 1HG2 VAL 23 HG21 VAL 23 1.709 6.218 -3.116 185 2HG2 VAL 23 HG22 VAL 23 3.460 6.343 -3.297 186 3HG2 VAL 23 HG23 VAL 23 2.772 5.625 -1.839 187 H LYS 24 H LYS 24 1.705 10.880 -3.368 188 HA LYS 24 HA LYS 24 1.353 10.135 -6.181 189 1HB LYS 24 HB2 LYS 24 2.049 12.758 -4.827 190 2HB LYS 24 HB3 LYS 24 1.828 12.580 -6.569 191 1HG LYS 24 HG2 LYS 24 -0.369 11.370 -5.096 192 2HG LYS 24 HG3 LYS 24 -0.183 13.075 -4.687 193 1HD LYS 24 HD2 LYS 24 0.016 13.446 -7.249 194 2HD LYS 24 HD3 LYS 24 -0.691 11.835 -7.386 195 1HE LYS 24 HE2 LYS 24 -2.718 12.495 -6.461 196 2HE LYS 24 HE3 LYS 24 -1.994 13.839 -5.576 197 1HZ LYS 24 HZ1 LYS 24 -1.943 13.859 -8.512 198 2HZ LYS 24 HZ2 LYS 24 -3.381 14.280 -7.710 199 3HZ LYS 24 HZ3 LYS 24 -1.962 15.165 -7.425 200 H LEU 25 H LEU 25 3.010 9.448 -7.449 201 HA LEU 25 HA LEU 25 5.769 10.356 -6.746 202 1HB LEU 25 HB2 LEU 25 5.404 7.650 -7.956 203 2HB LEU 25 HB3 LEU 25 6.639 8.220 -6.836 204 HG LEU 25 HG LEU 25 3.740 7.816 -6.059 205 1HD1 LEU 25 HD11 LEU 25 5.603 5.825 -6.668 206 2HD1 LEU 25 HD12 LEU 25 5.678 5.966 -4.911 207 3HD1 LEU 25 HD13 LEU 25 4.140 5.624 -5.703 208 1HD2 LEU 25 HD21 LEU 25 5.480 9.379 -4.808 209 2HD2 LEU 25 HD22 LEU 25 4.410 8.320 -3.888 210 3HD2 LEU 25 HD23 LEU 25 6.083 7.843 -4.185 211 H MET 26 H MET 26 7.131 10.730 -8.549 212 HA MET 26 HA MET 26 5.686 11.170 -11.078 213 1HB MET 26 HB2 MET 26 7.549 12.669 -9.892 214 2HB MET 26 HB3 MET 26 8.627 11.637 -10.832 215 1HG MET 26 HG2 MET 26 8.177 12.863 -12.664 216 2HG MET 26 HG3 MET 26 6.482 12.391 -12.542 217 1HE MET 26 HE1 MET 26 9.143 14.146 -10.886 218 2HE MET 26 HE2 MET 26 8.910 15.797 -11.482 219 3HE MET 26 HE3 MET 26 8.369 15.355 -9.865 220 H TYR 27 H TYR 27 5.852 9.856 -12.840 221 HA TYR 27 HA TYR 27 7.975 7.751 -12.797 222 1HB TYR 27 HB2 TYR 27 5.635 6.904 -12.277 223 2HB TYR 27 HB3 TYR 27 5.187 7.376 -13.917 224 HD1 TYR 27 HD1 TYR 27 7.535 5.254 -11.950 225 HD2 TYR 27 HD2 TYR 27 5.761 6.025 -15.785 226 HE1 TYR 27 HE1 TYR 27 8.501 3.142 -12.821 227 HE2 TYR 27 HE2 TYR 27 6.726 3.913 -16.656 228 HH TYR 27 HH TYR 27 7.622 1.877 -15.956 229 H LYS 28 H LYS 28 9.305 8.028 -14.515 230 HA LYS 28 HA LYS 28 10.074 8.800 -16.599 231 1HB LYS 28 HB2 LYS 28 7.547 7.315 -17.040 232 2HB LYS 28 HB3 LYS 28 8.073 8.335 -18.379 233 1HG LYS 28 HG2 LYS 28 9.434 6.622 -18.951 234 2HG LYS 28 HG3 LYS 28 10.423 7.109 -17.575 235 1HD LYS 28 HD2 LYS 28 8.919 5.623 -16.140 236 2HD LYS 28 HD3 LYS 28 8.279 4.977 -17.652 237 1HE LYS 28 HE2 LYS 28 11.003 4.866 -18.073 238 2HE LYS 28 HE3 LYS 28 10.870 4.481 -16.357 239 1HZ LYS 28 HZ1 LYS 28 8.906 2.997 -17.298 240 2HZ LYS 28 HZ2 LYS 28 9.896 3.007 -18.675 241 3HZ LYS 28 HZ3 LYS 28 10.505 2.432 -17.198 242 H GLY 29 H GLY 29 8.630 10.745 -14.886 243 1HA GLY 29 HA2 GLY 29 8.248 13.069 -15.233 244 2HA GLY 29 HA3 GLY 29 8.169 12.771 -16.970 245 H GLN 30 H GLN 30 6.302 11.075 -14.474 246 HA GLN 30 HA GLN 30 3.863 12.561 -15.229 247 1HB GLN 30 HB2 GLN 30 4.239 10.573 -16.838 248 2HB GLN 30 HB3 GLN 30 3.858 9.551 -15.452 249 1HG GLN 30 HG2 GLN 30 1.678 9.854 -15.929 250 2HG GLN 30 HG3 GLN 30 1.878 11.543 -15.456 251 1HE2 GLN 30 HE21 GLN 30 1.755 9.348 -18.239 252 2HE2 GLN 30 HE22 GLN 30 1.623 10.566 -19.414 253 HA PRO 31 HA PRO 31 3.888 11.517 -10.785 254 1HB PRO 31 HB2 PRO 31 2.596 13.817 -10.061 255 2HB PRO 31 HB3 PRO 31 4.346 13.736 -10.334 256 1HG PRO 31 HG2 PRO 31 2.204 14.816 -12.125 257 2HG PRO 31 HG3 PRO 31 3.858 15.398 -11.874 258 1HD PRO 31 HD2 PRO 31 3.068 13.884 -14.054 259 2HD PRO 31 HD3 PRO 31 4.737 13.962 -13.448 260 H MET 32 H MET 32 2.331 10.014 -10.312 261 HA MET 32 HA MET 32 -0.523 10.802 -10.704 262 1HB MET 32 HB2 MET 32 0.751 8.129 -11.354 263 2HB MET 32 HB3 MET 32 -0.989 8.412 -11.308 264 1HG MET 32 HG2 MET 32 -0.952 9.787 -13.191 265 2HG MET 32 HG3 MET 32 0.750 10.197 -12.980 266 1HE MET 32 HE1 MET 32 -1.431 7.135 -12.948 267 2HE MET 32 HE2 MET 32 -0.615 5.938 -13.964 268 3HE MET 32 HE3 MET 32 0.065 6.382 -12.400 269 H THR 33 H THR 33 -1.991 9.701 -9.214 270 HA THR 33 HA THR 33 -0.789 9.323 -6.581 271 HB THR 33 HB THR 33 -3.641 8.607 -7.179 272 HG1 THR 33 HG1 THR 33 -3.583 10.466 -8.271 273 1HG2 THR 33 HG21 THR 33 -1.996 9.281 -4.897 274 2HG2 THR 33 HG22 THR 33 -3.366 10.385 -5.012 275 3HG2 THR 33 HG23 THR 33 -3.642 8.645 -4.930 276 H PHE 34 H PHE 34 0.220 7.415 -6.147 277 HA PHE 34 HA PHE 34 -0.731 4.943 -7.477 278 1HB PHE 34 HB2 PHE 34 1.762 5.757 -6.021 279 2HB PHE 34 HB3 PHE 34 1.357 4.043 -6.129 280 HD1 PHE 34 HD1 PHE 34 1.255 2.901 -8.301 281 HD2 PHE 34 HD2 PHE 34 2.341 7.046 -8.005 282 HE1 PHE 34 HE1 PHE 34 2.111 2.843 -10.626 283 HE2 PHE 34 HE2 PHE 34 3.200 6.986 -10.330 284 HZ PHE 34 HZ PHE 34 3.084 4.885 -11.642 285 H ARG 35 H ARG 35 -1.739 3.296 -6.365 286 HA ARG 35 HA ARG 35 -2.126 3.714 -3.428 287 1HB ARG 35 HB2 ARG 35 -4.152 3.984 -5.031 288 2HB ARG 35 HB3 ARG 35 -4.074 2.229 -5.185 289 1HG ARG 35 HG2 ARG 35 -5.226 2.059 -3.259 290 2HG ARG 35 HG3 ARG 35 -3.849 2.778 -2.422 291 1HD ARG 35 HD2 ARG 35 -4.758 4.932 -2.498 292 2HD ARG 35 HD3 ARG 35 -5.809 4.545 -3.860 293 HE ARG 35 HE ARG 35 -6.535 2.964 -1.567 294 1HH1 ARG 35 HH11 ARG 35 -7.340 5.577 -3.541 295 2HH1 ARG 35 HH12 ARG 35 -8.473 6.280 -2.436 296 1HH2 ARG 35 HH21 ARG 35 -7.702 4.105 0.153 297 2HH2 ARG 35 HH22 ARG 35 -8.679 5.448 -0.345 298 H LEU 36 H LEU 36 -1.558 2.008 -2.136 299 HA LEU 36 HA LEU 36 -0.009 -0.146 -3.097 300 1HB LEU 36 HB2 LEU 36 -1.697 -0.062 -0.576 301 2HB LEU 36 HB3 LEU 36 -0.357 -1.167 -0.885 302 HG LEU 36 HG LEU 36 -0.229 1.844 -0.609 303 1HD1 LEU 36 HD11 LEU 36 0.216 -0.404 1.147 304 2HD1 LEU 36 HD12 LEU 36 1.726 0.480 0.917 305 3HD1 LEU 36 HD13 LEU 36 0.294 1.319 1.518 306 1HD2 LEU 36 HD21 LEU 36 1.893 -0.127 -1.518 307 2HD2 LEU 36 HD22 LEU 36 1.202 1.185 -2.474 308 3HD2 LEU 36 HD23 LEU 36 2.214 1.550 -1.076 309 H LEU 37 H LEU 37 -0.522 -2.127 -3.945 310 HA LEU 37 HA LEU 37 -3.369 -2.662 -4.515 311 1HB LEU 37 HB2 LEU 37 -0.771 -3.472 -5.645 312 2HB LEU 37 HB3 LEU 37 -1.981 -4.754 -5.605 313 HG LEU 37 HG LEU 37 -2.537 -1.988 -6.700 314 1HD1 LEU 37 HD11 LEU 37 -1.520 -4.496 -8.038 315 2HD1 LEU 37 HD12 LEU 37 -2.437 -3.285 -8.934 316 3HD1 LEU 37 HD13 LEU 37 -0.903 -2.851 -8.181 317 1HD2 LEU 37 HD21 LEU 37 -4.490 -3.327 -5.956 318 2HD2 LEU 37 HD22 LEU 37 -4.480 -3.117 -7.707 319 3HD2 LEU 37 HD23 LEU 37 -3.968 -4.650 -7.001 320 H LEU 38 H LEU 38 -4.431 -4.590 -3.882 321 HA LEU 38 HA LEU 38 -4.902 -6.439 -2.517 322 1HB LEU 38 HB2 LEU 38 -1.921 -6.572 -2.010 323 2HB LEU 38 HB3 LEU 38 -3.095 -7.879 -1.858 324 HG LEU 38 HG LEU 38 -2.222 -6.499 -4.409 325 1HD1 LEU 38 HD11 LEU 38 -1.994 -9.338 -3.367 326 2HD1 LEU 38 HD12 LEU 38 -1.588 -8.853 -5.013 327 3HD1 LEU 38 HD13 LEU 38 -0.671 -8.209 -3.652 328 1HD2 LEU 38 HD21 LEU 38 -4.467 -8.458 -3.855 329 2HD2 LEU 38 HD22 LEU 38 -4.584 -6.874 -4.622 330 3HD2 LEU 38 HD23 LEU 38 -3.797 -8.206 -5.467 331 H VAL 39 H VAL 39 -4.220 -3.544 -1.473 332 HA VAL 39 HA VAL 39 -4.690 -4.262 1.339 333 HB VAL 39 HB VAL 39 -2.783 -3.162 2.256 334 1HG1 VAL 39 HG11 VAL 39 -2.358 -5.439 1.362 335 2HG1 VAL 39 HG12 VAL 39 -1.849 -4.727 -0.169 336 3HG1 VAL 39 HG13 VAL 39 -0.914 -4.428 1.296 337 1HG2 VAL 39 HG21 VAL 39 -2.527 -2.069 -0.527 338 2HG2 VAL 39 HG22 VAL 39 -2.423 -1.224 1.018 339 3HG2 VAL 39 HG23 VAL 39 -1.077 -2.220 0.465 340 H ASP 40 H ASP 40 -6.251 -2.896 2.012 341 HA ASP 40 HA ASP 40 -6.520 -0.269 0.637 342 1HB ASP 40 HB2 ASP 40 -8.805 -0.405 1.972 343 2HB ASP 40 HB3 ASP 40 -8.606 -1.279 0.455 344 H THR 41 H THR 41 -6.790 1.640 1.924 345 HA THR 41 HA THR 41 -5.650 1.360 4.668 346 HB THR 41 HB THR 41 -4.298 2.860 3.449 347 HG1 THR 41 HG1 THR 41 -6.085 4.788 4.354 348 1HG2 THR 41 HG21 THR 41 -6.896 3.910 2.308 349 2HG2 THR 41 HG22 THR 41 -5.346 4.715 2.072 350 3HG2 THR 41 HG23 THR 41 -5.597 3.085 1.445 351 HA PRO 42 HA PRO 42 -9.490 2.619 6.440 352 1HB PRO 42 HB2 PRO 42 -8.539 3.584 8.814 353 2HB PRO 42 HB3 PRO 42 -8.593 1.855 8.429 354 1HG PRO 42 HG2 PRO 42 -6.253 3.711 8.453 355 2HG PRO 42 HG3 PRO 42 -6.322 1.983 8.834 356 1HD PRO 42 HD2 PRO 42 -5.404 3.056 6.418 357 2HD PRO 42 HD3 PRO 42 -5.928 1.374 6.657 358 H GLU 43 H GLU 43 -10.606 4.437 5.815 359 HA GLU 43 HA GLU 43 -9.621 6.859 4.942 360 1HB GLU 43 HB2 GLU 43 -12.175 5.877 5.801 361 2HB GLU 43 HB3 GLU 43 -11.951 7.502 6.450 362 1HG GLU 43 HG2 GLU 43 -12.585 8.236 4.405 363 2HG GLU 43 HG3 GLU 43 -10.985 7.730 3.865 364 H THR 44 H THR 44 -8.583 8.563 5.865 365 HA THR 44 HA THR 44 -8.967 9.184 8.715 366 HB THR 44 HB THR 44 -7.168 7.446 8.692 367 HG1 THR 44 HG1 THR 44 -5.832 9.808 9.268 368 1HG2 THR 44 HG21 THR 44 -6.237 9.130 6.514 369 2HG2 THR 44 HG22 THR 44 -4.978 8.893 7.725 370 3HG2 THR 44 HG23 THR 44 -5.735 7.498 6.956 371 H LYS 45 H LYS 45 -9.723 10.742 6.597 372 HA LYS 45 HA LYS 45 -7.547 12.729 6.195 373 1HB LYS 45 HB2 LYS 45 -10.304 12.595 4.932 374 2HB LYS 45 HB3 LYS 45 -8.996 13.681 4.466 375 1HG LYS 45 HG2 LYS 45 -7.763 11.997 3.462 376 2HG LYS 45 HG3 LYS 45 -8.444 10.741 4.498 377 1HD LYS 45 HD2 LYS 45 -10.225 10.392 3.122 378 2HD LYS 45 HD3 LYS 45 -10.403 12.109 2.760 379 1HE LYS 45 HE2 LYS 45 -9.717 10.814 0.757 380 2HE LYS 45 HE3 LYS 45 -8.500 12.005 1.215 381 1HZ LYS 45 HZ1 LYS 45 -8.204 9.421 2.476 382 2HZ LYS 45 HZ2 LYS 45 -7.994 9.408 0.790 383 3HZ LYS 45 HZ3 LYS 45 -7.035 10.420 1.755 384 H HIS 46 H HIS 46 -9.573 12.174 8.586 385 HA HIS 46 HA HIS 46 -11.015 14.676 8.829 386 1HB HIS 46 HB2 HIS 46 -10.474 12.316 10.580 387 2HB HIS 46 HB3 HIS 46 -10.995 13.813 11.352 388 HD1 HIS 46 HD1 HIS 46 -12.325 10.872 9.745 389 HD2 HIS 46 HD2 HIS 46 -13.497 14.864 9.995 390 HE1 HIS 46 HE1 HIS 46 -14.776 10.939 9.112 391 HA PRO 47 HA PRO 47 -7.609 17.098 10.331 392 1HB PRO 47 HB2 PRO 47 -9.079 19.265 11.105 393 2HB PRO 47 HB3 PRO 47 -8.750 18.883 9.407 394 1HG PRO 47 HG2 PRO 47 -11.264 18.516 10.968 395 2HG PRO 47 HG3 PRO 47 -11.050 18.863 9.245 396 1HD PRO 47 HD2 PRO 47 -11.640 16.343 10.335 397 2HD PRO 47 HD3 PRO 47 -11.014 16.638 8.698 398 H LYS 48 H LYS 48 -7.864 18.907 12.482 399 HA LYS 48 HA LYS 48 -7.785 18.996 14.821 400 1HB LYS 48 HB2 LYS 48 -10.043 17.118 14.265 401 2HB LYS 48 HB3 LYS 48 -9.424 17.200 15.914 402 1HG LYS 48 HG2 LYS 48 -10.111 19.696 14.358 403 2HG LYS 48 HG3 LYS 48 -11.326 18.827 15.296 404 1HD LYS 48 HD2 LYS 48 -9.748 18.989 17.282 405 2HD LYS 48 HD3 LYS 48 -8.777 20.102 16.315 406 1HE LYS 48 HE2 LYS 48 -10.317 21.789 16.462 407 2HE LYS 48 HE3 LYS 48 -11.688 20.679 16.432 408 1HZ LYS 48 HZ1 LYS 48 -10.660 20.016 18.756 409 2HZ LYS 48 HZ2 LYS 48 -10.100 21.616 18.696 410 3HZ LYS 48 HZ3 LYS 48 -11.766 21.296 18.595 411 H LYS 49 H LYS 49 -5.572 18.143 14.608 412 HA LYS 49 HA LYS 49 -3.866 16.598 15.081 413 1HB LYS 49 HB2 LYS 49 -4.970 16.981 17.331 414 2HB LYS 49 HB3 LYS 49 -5.881 15.496 17.053 415 1HG LYS 49 HG2 LYS 49 -4.029 14.147 17.285 416 2HG LYS 49 HG3 LYS 49 -2.927 15.377 16.668 417 1HD LYS 49 HD2 LYS 49 -2.481 16.140 18.743 418 2HD LYS 49 HD3 LYS 49 -4.197 16.225 19.148 419 1HE LYS 49 HE2 LYS 49 -4.258 13.982 19.876 420 2HE LYS 49 HE3 LYS 49 -2.755 13.579 19.047 421 1HZ LYS 49 HZ1 LYS 49 -2.185 15.656 20.794 422 2HZ LYS 49 HZ2 LYS 49 -3.118 14.540 21.672 423 3HZ LYS 49 HZ3 LYS 49 -1.687 14.036 20.914 424 H GLY 50 H GLY 50 -6.005 15.824 13.074 425 1HA GLY 50 HA2 GLY 50 -6.098 13.925 11.644 426 2HA GLY 50 HA3 GLY 50 -5.162 13.020 12.834 427 H VAL 51 H VAL 51 -6.626 11.234 12.749 428 HA VAL 51 HA VAL 51 -9.385 11.780 13.740 429 HB VAL 51 HB VAL 51 -8.533 9.052 12.863 430 1HG1 VAL 51 HG11 VAL 51 -10.932 10.379 13.492 431 2HG1 VAL 51 HG12 VAL 51 -10.964 10.170 11.741 432 3HG1 VAL 51 HG13 VAL 51 -10.768 8.769 12.795 433 1HG2 VAL 51 HG21 VAL 51 -8.848 11.460 11.057 434 2HG2 VAL 51 HG22 VAL 51 -7.533 10.285 11.084 435 3HG2 VAL 51 HG23 VAL 51 -9.122 9.818 10.476 436 H GLU 52 H GLU 52 -9.642 8.978 14.660 437 HA GLU 52 HA GLU 52 -7.959 9.167 17.128 438 1HB GLU 52 HB2 GLU 52 -10.752 8.006 16.942 439 2HB GLU 52 HB3 GLU 52 -9.815 8.296 18.408 440 1HG GLU 52 HG2 GLU 52 -9.774 10.765 17.699 441 2HG GLU 52 HG3 GLU 52 -11.033 10.337 16.542 442 H LYS 53 H LYS 53 -7.985 6.873 18.263 443 HA LYS 53 HA LYS 53 -7.303 4.632 18.140 444 1HB LYS 53 HB2 LYS 53 -9.321 4.960 16.005 445 2HB LYS 53 HB3 LYS 53 -8.227 3.594 15.786 446 1HG LYS 53 HG2 LYS 53 -10.305 3.054 17.117 447 2HG LYS 53 HG3 LYS 53 -8.793 2.700 17.956 448 1HD LYS 53 HD2 LYS 53 -9.329 4.123 19.614 449 2HD LYS 53 HD3 LYS 53 -9.556 5.435 18.456 450 1HE LYS 53 HE2 LYS 53 -11.847 4.569 17.979 451 2HE LYS 53 HE3 LYS 53 -11.615 3.347 19.229 452 1HZ LYS 53 HZ1 LYS 53 -11.357 6.260 19.723 453 2HZ LYS 53 HZ2 LYS 53 -12.797 5.398 19.966 454 3HZ LYS 53 HZ3 LYS 53 -11.415 5.015 20.878 455 H TYR 54 H TYR 54 -7.344 4.789 14.642 456 HA TYR 54 HA TYR 54 -4.356 4.946 14.691 457 1HB TYR 54 HB2 TYR 54 -6.000 3.459 12.632 458 2HB TYR 54 HB3 TYR 54 -4.261 3.351 12.912 459 HD1 TYR 54 HD1 TYR 54 -3.507 2.560 15.281 460 HD2 TYR 54 HD2 TYR 54 -7.448 1.944 13.685 461 HE1 TYR 54 HE1 TYR 54 -3.883 0.734 16.916 462 HE2 TYR 54 HE2 TYR 54 -7.824 0.119 15.320 463 HH TYR 54 HH TYR 54 -5.616 -0.486 17.939 464 H GLY 55 H GLY 55 -5.908 7.272 14.464 465 1HA GLY 55 HA2 GLY 55 -6.509 8.013 11.766 466 2HA GLY 55 HA3 GLY 55 -6.192 9.147 13.081 467 HA PRO 56 HA PRO 56 -2.304 10.080 11.243 468 1HB PRO 56 HB2 PRO 56 -0.989 11.000 13.453 469 2HB PRO 56 HB3 PRO 56 -2.293 11.901 12.660 470 1HG PRO 56 HG2 PRO 56 -2.352 10.346 15.205 471 2HG PRO 56 HG3 PRO 56 -3.277 11.784 14.742 472 1HD PRO 56 HD2 PRO 56 -4.253 9.151 14.728 473 2HD PRO 56 HD3 PRO 56 -4.993 10.531 13.886 474 H GLU 57 H GLU 57 -2.106 7.527 11.108 475 HA GLU 57 HA GLU 57 0.424 6.807 12.495 476 1HB GLU 57 HB2 GLU 57 -2.037 5.036 12.358 477 2HB GLU 57 HB3 GLU 57 -0.457 4.533 12.958 478 1HG GLU 57 HG2 GLU 57 -1.274 7.000 14.232 479 2HG GLU 57 HG3 GLU 57 -2.514 5.762 14.438 480 H ALA 58 H ALA 58 -1.979 5.475 10.185 481 HA ALA 58 HA ALA 58 0.009 4.078 8.641 482 1HB ALA 58 HB1 ALA 58 -2.877 4.620 8.465 483 2HB ALA 58 HB2 ALA 58 -2.084 4.515 6.894 484 3HB ALA 58 HB3 ALA 58 -1.978 3.167 8.027 485 H SER 59 H SER 59 -1.556 7.255 8.295 486 HA SER 59 HA SER 59 -0.306 7.902 5.783 487 1HB SER 59 HB2 SER 59 -2.302 9.050 7.093 488 2HB SER 59 HB3 SER 59 -1.006 10.025 7.782 489 HG SER 59 HG SER 59 -1.590 11.061 5.945 490 H ALA 60 H ALA 60 0.492 8.822 9.149 491 HA ALA 60 HA ALA 60 2.909 10.204 8.483 492 1HB ALA 60 HB1 ALA 60 2.007 8.823 11.024 493 2HB ALA 60 HB2 ALA 60 3.495 9.762 10.911 494 3HB ALA 60 HB3 ALA 60 1.935 10.547 10.661 495 H PHE 61 H PHE 61 2.130 6.830 8.737 496 HA PHE 61 HA PHE 61 4.785 5.831 9.203 497 1HB PHE 61 HB2 PHE 61 2.671 4.492 9.460 498 2HB PHE 61 HB3 PHE 61 2.540 4.459 7.701 499 HD1 PHE 61 HD1 PHE 61 4.719 3.493 10.564 500 HD2 PHE 61 HD2 PHE 61 3.848 2.962 6.390 501 HE1 PHE 61 HE1 PHE 61 6.289 1.577 10.480 502 HE2 PHE 61 HE2 PHE 61 5.418 1.045 6.308 503 HZ PHE 61 HZ PHE 61 6.639 0.352 8.352 504 H THR 62 H THR 62 2.894 5.871 6.174 505 HA THR 62 HA THR 62 5.208 5.343 4.532 506 HB THR 62 HB THR 62 2.841 6.734 3.368 507 HG1 THR 62 HG1 THR 62 2.604 4.027 4.008 508 1HG2 THR 62 HG21 THR 62 4.689 4.468 2.678 509 2HG2 THR 62 HG22 THR 62 3.140 4.629 1.850 510 3HG2 THR 62 HG23 THR 62 4.330 5.928 1.756 511 H LYS 63 H LYS 63 4.035 8.167 6.061 512 HA LYS 63 HA LYS 63 4.947 10.133 4.166 513 1HB LYS 63 HB2 LYS 63 3.448 10.304 6.381 514 2HB LYS 63 HB3 LYS 63 5.004 10.746 7.081 515 1HG LYS 63 HG2 LYS 63 5.161 12.692 5.859 516 2HG LYS 63 HG3 LYS 63 4.245 12.037 4.501 517 1HD LYS 63 HD2 LYS 63 2.362 12.978 5.288 518 2HD LYS 63 HD3 LYS 63 2.542 12.100 6.807 519 1HE LYS 63 HE2 LYS 63 3.110 14.001 7.864 520 2HE LYS 63 HE3 LYS 63 4.459 14.233 6.752 521 1HZ LYS 63 HZ1 LYS 63 2.425 14.951 5.208 522 2HZ LYS 63 HZ2 LYS 63 1.800 15.404 6.719 523 3HZ LYS 63 HZ3 LYS 63 3.279 16.047 6.186 524 H LYS 64 H LYS 64 6.401 9.007 7.224 525 HA LYS 64 HA LYS 64 8.941 10.293 6.626 526 1HB LYS 64 HB2 LYS 64 8.045 8.325 8.742 527 2HB LYS 64 HB3 LYS 64 9.711 8.893 8.627 528 1HG LYS 64 HG2 LYS 64 9.156 11.072 9.205 529 2HG LYS 64 HG3 LYS 64 7.497 10.913 8.626 530 1HD LYS 64 HD2 LYS 64 7.381 10.942 11.023 531 2HD LYS 64 HD3 LYS 64 7.110 9.271 10.527 532 1HE LYS 64 HE2 LYS 64 9.927 9.659 10.802 533 2HE LYS 64 HE3 LYS 64 9.149 10.291 12.253 534 1HZ LYS 64 HZ1 LYS 64 8.359 7.675 11.148 535 2HZ LYS 64 HZ2 LYS 64 9.726 7.806 12.143 536 3HZ LYS 64 HZ3 LYS 64 8.199 8.259 12.735 537 H MET 65 H MET 65 7.513 7.190 5.970 538 HA MET 65 HA MET 65 9.925 5.685 5.598 539 1HB MET 65 HB2 MET 65 7.454 4.867 5.703 540 2HB MET 65 HB3 MET 65 7.438 5.211 3.973 541 1HG MET 65 HG2 MET 65 9.419 3.748 3.677 542 2HG MET 65 HG3 MET 65 9.385 3.375 5.400 543 1HE MET 65 HE1 MET 65 9.313 1.317 5.514 544 2HE MET 65 HE2 MET 65 7.910 0.252 5.359 545 3HE MET 65 HE3 MET 65 9.021 0.454 4.007 546 H VAL 66 H VAL 66 7.786 7.111 3.118 547 HA VAL 66 HA VAL 66 9.765 6.811 1.031 548 HB VAL 66 HB VAL 66 8.230 8.026 -0.368 549 1HG1 VAL 66 HG11 VAL 66 6.841 6.324 1.714 550 2HG1 VAL 66 HG12 VAL 66 6.024 6.919 0.270 551 3HG1 VAL 66 HG13 VAL 66 7.404 5.832 0.117 552 1HG2 VAL 66 HG21 VAL 66 7.046 8.971 2.257 553 2HG2 VAL 66 HG22 VAL 66 7.790 9.960 0.999 554 3HG2 VAL 66 HG23 VAL 66 6.238 9.177 0.703 555 H GLU 67 H GLU 67 9.114 9.236 3.435 556 HA GLU 67 HA GLU 67 10.474 11.416 2.103 557 1HB GLU 67 HB2 GLU 67 9.424 10.869 4.837 558 2HB GLU 67 HB3 GLU 67 10.685 12.095 4.700 559 1HG GLU 67 HG2 GLU 67 9.035 12.725 2.585 560 2HG GLU 67 HG3 GLU 67 7.883 12.185 3.807 561 H ASN 68 H ASN 68 11.488 8.733 4.120 562 HA ASN 68 HA ASN 68 14.279 9.802 4.081 563 1HB ASN 68 HB2 ASN 68 13.021 7.665 5.831 564 2HB ASN 68 HB3 ASN 68 14.708 8.173 5.908 565 1HD2 ASN 68 HD21 ASN 68 11.838 8.646 7.475 566 2HD2 ASN 68 HD22 ASN 68 12.067 10.231 8.034 567 H ALA 69 H ALA 69 12.279 7.673 2.469 568 HA ALA 69 HA ALA 69 13.873 5.344 2.148 569 1HB ALA 69 HB1 ALA 69 11.761 6.701 0.516 570 2HB ALA 69 HB2 ALA 69 12.703 5.416 -0.237 571 3HB ALA 69 HB3 ALA 69 11.764 5.083 1.218 572 H LYS 70 H LYS 70 15.834 5.092 1.194 573 HA LYS 70 HA LYS 70 17.169 7.329 -0.071 574 1HB LYS 70 HB2 LYS 70 17.921 4.392 0.065 575 2HB LYS 70 HB3 LYS 70 18.986 5.684 -0.490 576 1HG LYS 70 HG2 LYS 70 17.833 6.402 2.056 577 2HG LYS 70 HG3 LYS 70 18.597 4.816 2.173 578 1HD LYS 70 HD2 LYS 70 20.698 5.647 1.798 579 2HD LYS 70 HD3 LYS 70 20.119 6.895 0.693 580 1HE LYS 70 HE2 LYS 70 20.990 7.840 2.833 581 2HE LYS 70 HE3 LYS 70 19.290 8.223 2.565 582 1HZ LYS 70 HZ1 LYS 70 19.918 5.767 4.019 583 2HZ LYS 70 HZ2 LYS 70 20.149 7.239 4.835 584 3HZ LYS 70 HZ3 LYS 70 18.619 6.844 4.217 585 H LYS 71 H LYS 71 15.564 4.400 -1.222 586 HA LYS 71 HA LYS 71 15.606 5.568 -3.963 587 1HB LYS 71 HB2 LYS 71 16.102 2.634 -3.379 588 2HB LYS 71 HB3 LYS 71 16.169 3.433 -4.951 589 1HG LYS 71 HG2 LYS 71 17.901 4.910 -3.303 590 2HG LYS 71 HG3 LYS 71 18.234 3.219 -2.926 591 1HD LYS 71 HD2 LYS 71 19.631 3.984 -4.808 592 2HD LYS 71 HD3 LYS 71 18.500 2.736 -5.334 593 1HE LYS 71 HE2 LYS 71 17.456 4.149 -6.754 594 2HE LYS 71 HE3 LYS 71 17.348 5.412 -5.527 595 1HZ LYS 71 HZ1 LYS 71 19.806 5.760 -5.964 596 2HZ LYS 71 HZ2 LYS 71 19.590 4.826 -7.363 597 3HZ LYS 71 HZ3 LYS 71 18.732 6.281 -7.174 598 H ILE 72 H ILE 72 13.672 5.275 -5.068 599 HA ILE 72 HA ILE 72 11.594 3.628 -3.682 600 HB ILE 72 HB ILE 72 11.121 6.189 -5.229 601 1HG1 ILE 72 HG12 ILE 72 10.527 6.905 -2.741 602 2HG1 ILE 72 HG13 ILE 72 11.695 5.648 -2.339 603 1HG2 ILE 72 HG21 ILE 72 9.408 4.278 -3.653 604 2HG2 ILE 72 HG22 ILE 72 8.937 5.970 -3.815 605 3HG2 ILE 72 HG23 ILE 72 9.117 4.964 -5.252 606 1HD1 ILE 72 HD11 ILE 72 12.772 7.208 -4.481 607 2HD1 ILE 72 HD12 ILE 72 12.219 8.311 -3.221 608 3HD1 ILE 72 HD13 ILE 72 13.384 7.045 -2.835 609 H GLU 73 H GLU 73 11.085 1.920 -4.961 610 HA GLU 73 HA GLU 73 10.840 2.396 -7.898 611 1HB GLU 73 HB2 GLU 73 11.946 -0.186 -6.799 612 2HB GLU 73 HB3 GLU 73 12.056 0.448 -8.441 613 1HG GLU 73 HG2 GLU 73 14.134 1.119 -7.800 614 2HG GLU 73 HG3 GLU 73 13.271 2.445 -7.021 615 H VAL 74 H VAL 74 8.853 1.767 -8.594 616 HA VAL 74 HA VAL 74 7.177 0.126 -6.788 617 HB VAL 74 HB VAL 74 5.319 0.827 -8.201 618 1HG1 VAL 74 HG11 VAL 74 7.083 2.605 -6.821 619 2HG1 VAL 74 HG12 VAL 74 6.457 3.449 -8.236 620 3HG1 VAL 74 HG13 VAL 74 5.343 2.763 -7.055 621 1HG2 VAL 74 HG21 VAL 74 7.504 1.287 -10.093 622 2HG2 VAL 74 HG22 VAL 74 5.784 1.051 -10.406 623 3HG2 VAL 74 HG23 VAL 74 6.395 2.656 -10.003 624 H GLU 75 H GLU 75 5.639 -1.437 -8.102 625 HA GLU 75 HA GLU 75 7.150 -2.816 -10.262 626 1HB GLU 75 HB2 GLU 75 7.818 -4.045 -8.305 627 2HB GLU 75 HB3 GLU 75 6.163 -4.085 -7.694 628 1HG GLU 75 HG2 GLU 75 5.458 -5.538 -9.483 629 2HG GLU 75 HG3 GLU 75 7.001 -5.349 -10.317 630 H PHE 76 H PHE 76 5.520 -2.115 -11.725 631 HA PHE 76 HA PHE 76 2.718 -2.335 -11.291 632 1HB PHE 76 HB2 PHE 76 4.376 -2.378 -13.824 633 2HB PHE 76 HB3 PHE 76 2.611 -2.385 -13.837 634 HD1 PHE 76 HD1 PHE 76 1.373 -0.500 -12.644 635 HD2 PHE 76 HD2 PHE 76 5.584 -0.368 -13.481 636 HE1 PHE 76 HE1 PHE 76 1.361 1.958 -12.319 637 HE2 PHE 76 HE2 PHE 76 5.572 2.091 -13.155 638 HZ PHE 76 HZ PHE 76 3.460 3.254 -12.573 639 H ASP 77 H ASP 77 1.365 -4.075 -11.317 640 HA ASP 77 HA ASP 77 2.458 -6.747 -11.428 641 1HB ASP 77 HB2 ASP 77 0.061 -5.545 -10.548 642 2HB ASP 77 HB3 ASP 77 -0.409 -6.698 -11.798 643 H LYS 78 H LYS 78 0.650 -8.235 -12.881 644 HA LYS 78 HA LYS 78 1.447 -7.539 -15.650 645 1HB LYS 78 HB2 LYS 78 0.843 -9.834 -16.195 646 2HB LYS 78 HB3 LYS 78 1.848 -9.844 -14.745 647 1HG LYS 78 HG2 LYS 78 -0.880 -9.523 -13.938 648 2HG LYS 78 HG3 LYS 78 -0.790 -10.886 -15.055 649 1HD LYS 78 HD2 LYS 78 1.444 -10.918 -13.202 650 2HD LYS 78 HD3 LYS 78 -0.092 -10.902 -12.335 651 1HE LYS 78 HE2 LYS 78 -0.875 -12.801 -13.736 652 2HE LYS 78 HE3 LYS 78 0.701 -12.843 -14.527 653 1HZ LYS 78 HZ1 LYS 78 1.150 -12.835 -11.783 654 2HZ LYS 78 HZ2 LYS 78 -0.062 -13.990 -12.075 655 3HZ LYS 78 HZ3 LYS 78 1.427 -14.103 -12.879 656 H GLY 79 H GLY 79 -1.258 -7.307 -13.592 657 1HA GLY 79 HA2 GLY 79 -3.330 -7.620 -15.601 658 2HA GLY 79 HA3 GLY 79 -3.541 -6.893 -14.007 659 H GLN 80 H GLN 80 -4.289 -4.846 -14.253 660 HA GLN 80 HA GLN 80 -3.529 -3.283 -16.640 661 1HB GLN 80 HB2 GLN 80 -5.292 -2.439 -14.325 662 2HB GLN 80 HB3 GLN 80 -5.218 -1.714 -15.932 663 1HG GLN 80 HG2 GLN 80 -5.824 -4.150 -16.735 664 2HG GLN 80 HG3 GLN 80 -6.432 -4.326 -15.087 665 1HE2 GLN 80 HE21 GLN 80 -8.243 -4.364 -17.283 666 2HE2 GLN 80 HE22 GLN 80 -9.190 -2.958 -17.235 667 H ARG 81 H ARG 81 -2.830 -0.959 -16.272 668 HA ARG 81 HA ARG 81 -0.791 -0.912 -14.102 669 1HB ARG 81 HB2 ARG 81 -0.178 -0.533 -16.566 670 2HB ARG 81 HB3 ARG 81 -1.004 1.018 -16.417 671 1HG ARG 81 HG2 ARG 81 0.558 1.078 -14.190 672 2HG ARG 81 HG3 ARG 81 1.585 0.143 -15.278 673 1HD ARG 81 HD2 ARG 81 0.275 2.622 -16.330 674 2HD ARG 81 HD3 ARG 81 1.682 2.793 -15.279 675 HE ARG 81 HE ARG 81 2.131 0.868 -17.409 676 1HH1 ARG 81 HH11 ARG 81 4.256 2.670 -16.381 677 2HH1 ARG 81 HH12 ARG 81 4.423 3.826 -17.660 678 1HH2 ARG 81 HH21 ARG 81 1.394 3.021 -19.142 679 2HH2 ARG 81 HH22 ARG 81 2.805 4.023 -19.223 680 H THR 82 H THR 82 -3.758 0.553 -15.110 681 HA THR 82 HA THR 82 -3.611 2.346 -12.747 682 HB THR 82 HB THR 82 -4.214 4.294 -13.943 683 HG1 THR 82 HG1 THR 82 -5.759 3.638 -15.306 684 1HG2 THR 82 HG21 THR 82 -1.852 3.134 -14.443 685 2HG2 THR 82 HG22 THR 82 -2.498 3.130 -16.084 686 3HG2 THR 82 HG23 THR 82 -2.326 4.651 -15.209 687 H ASP 83 H ASP 83 -5.807 3.138 -12.131 688 HA ASP 83 HA ASP 83 -7.878 1.138 -12.926 689 1HB ASP 83 HB2 ASP 83 -8.943 2.285 -10.723 690 2HB ASP 83 HB3 ASP 83 -7.858 0.898 -10.644 691 H LYS 84 H LYS 84 -10.189 2.353 -12.279 692 HA LYS 84 HA LYS 84 -10.564 4.239 -14.416 693 1HB LYS 84 HB2 LYS 84 -12.856 4.497 -13.450 694 2HB LYS 84 HB3 LYS 84 -12.400 2.812 -13.694 695 1HG LYS 84 HG2 LYS 84 -11.766 2.628 -11.320 696 2HG LYS 84 HG3 LYS 84 -12.203 4.318 -11.069 697 1HD LYS 84 HD2 LYS 84 -14.217 2.420 -12.242 698 2HD LYS 84 HD3 LYS 84 -13.949 2.444 -10.497 699 1HE LYS 84 HE2 LYS 84 -14.145 5.092 -10.922 700 2HE LYS 84 HE3 LYS 84 -15.146 4.526 -12.260 701 1HZ LYS 84 HZ1 LYS 84 -15.747 3.070 -9.917 702 2HZ LYS 84 HZ2 LYS 84 -15.860 4.733 -9.593 703 3HZ LYS 84 HZ3 LYS 84 -16.768 4.052 -10.853 704 H TYR 85 H TYR 85 -9.768 4.593 -11.038 705 HA TYR 85 HA TYR 85 -10.530 7.408 -10.905 706 1HB TYR 85 HB2 TYR 85 -8.802 5.701 -9.091 707 2HB TYR 85 HB3 TYR 85 -9.299 7.354 -8.730 708 HD1 TYR 85 HD1 TYR 85 -10.439 3.871 -9.141 709 HD2 TYR 85 HD2 TYR 85 -11.608 7.886 -8.160 710 HE1 TYR 85 HE1 TYR 85 -12.594 3.027 -8.257 711 HE2 TYR 85 HE2 TYR 85 -13.766 7.041 -7.275 712 HH TYR 85 HH TYR 85 -15.218 4.795 -7.809 713 H GLY 86 H GLY 86 -8.132 5.886 -12.574 714 1HA GLY 86 HA2 GLY 86 -6.291 6.820 -13.717 715 2HA GLY 86 HA3 GLY 86 -6.634 8.358 -12.925 716 H ARG 87 H ARG 87 -6.429 5.732 -10.757 717 HA ARG 87 HA ARG 87 -3.853 6.785 -9.750 718 1HB ARG 87 HB2 ARG 87 -5.671 4.664 -8.564 719 2HB ARG 87 HB3 ARG 87 -4.327 5.469 -7.752 720 1HG ARG 87 HG2 ARG 87 -5.504 7.659 -8.109 721 2HG ARG 87 HG3 ARG 87 -6.885 6.762 -8.740 722 1HD ARG 87 HD2 ARG 87 -5.783 6.800 -5.939 723 2HD ARG 87 HD3 ARG 87 -7.445 7.042 -6.478 724 HE ARG 87 HE ARG 87 -6.086 4.425 -6.180 725 1HH1 ARG 87 HH11 ARG 87 -8.927 6.096 -5.752 726 2HH1 ARG 87 HH12 ARG 87 -9.971 4.860 -6.373 727 1HH2 ARG 87 HH21 ARG 87 -7.377 2.903 -7.582 728 2HH2 ARG 87 HH22 ARG 87 -9.094 3.053 -7.408 729 H GLY 88 H GLY 88 -1.948 5.668 -9.933 730 1HA GLY 88 HA2 GLY 88 -1.857 3.355 -11.693 731 2HA GLY 88 HA3 GLY 88 -0.474 4.090 -10.882 732 H LEU 89 H LEU 89 -1.850 1.228 -11.106 733 HA LEU 89 HA LEU 89 -1.801 0.617 -8.187 734 1HB LEU 89 HB2 LEU 89 -2.735 -1.124 -10.490 735 2HB LEU 89 HB3 LEU 89 -2.920 -1.471 -8.770 736 HG LEU 89 HG LEU 89 -4.043 1.044 -10.008 737 1HD1 LEU 89 HD11 LEU 89 -4.869 -1.216 -11.034 738 2HD1 LEU 89 HD12 LEU 89 -5.693 -1.419 -9.488 739 3HD1 LEU 89 HD13 LEU 89 -6.066 -0.032 -10.511 740 1HD2 LEU 89 HD21 LEU 89 -3.703 0.546 -7.443 741 2HD2 LEU 89 HD22 LEU 89 -5.219 1.254 -8.000 742 3HD2 LEU 89 HD23 LEU 89 -5.129 -0.472 -7.651 743 H ALA 90 H ALA 90 0.085 -0.200 -7.430 744 HA ALA 90 HA ALA 90 1.487 -2.341 -8.767 745 1HB ALA 90 HB1 ALA 90 2.110 0.112 -9.824 746 2HB ALA 90 HB2 ALA 90 3.337 -0.050 -8.567 747 3HB ALA 90 HB3 ALA 90 3.198 -1.277 -9.825 748 H TYR 91 H TYR 91 3.551 -2.874 -7.534 749 HA TYR 91 HA TYR 91 3.064 -2.395 -4.658 750 1HB TYR 91 HB2 TYR 91 5.205 -4.116 -5.942 751 2HB TYR 91 HB3 TYR 91 4.632 -4.189 -4.275 752 HD1 TYR 91 HD1 TYR 91 2.208 -4.843 -3.841 753 HD2 TYR 91 HD2 TYR 91 4.104 -5.315 -7.666 754 HE1 TYR 91 HE1 TYR 91 0.446 -6.452 -4.517 755 HE2 TYR 91 HE2 TYR 91 2.342 -6.923 -8.341 756 HH TYR 91 HH TYR 91 0.729 -8.439 -7.265 757 H ILE 92 H ILE 92 4.046 -0.667 -3.728 758 HA ILE 92 HA ILE 92 6.381 0.572 -5.013 759 HB ILE 92 HB ILE 92 4.921 1.292 -2.454 760 1HG1 ILE 92 HG12 ILE 92 4.727 2.418 -5.267 761 2HG1 ILE 92 HG13 ILE 92 3.497 1.441 -4.466 762 1HG2 ILE 92 HG21 ILE 92 7.430 2.076 -3.179 763 2HG2 ILE 92 HG22 ILE 92 6.458 3.308 -3.981 764 3HG2 ILE 92 HG23 ILE 92 6.325 3.078 -2.238 765 1HD1 ILE 92 HD11 ILE 92 4.129 3.533 -2.671 766 2HD1 ILE 92 HD12 ILE 92 3.960 4.281 -4.260 767 3HD1 ILE 92 HD13 ILE 92 2.637 3.327 -3.590 768 H TYR 93 H TYR 93 8.465 0.643 -4.122 769 HA TYR 93 HA TYR 93 8.915 -1.069 -1.711 770 1HB TYR 93 HB2 TYR 93 10.541 -0.953 -4.269 771 2HB TYR 93 HB3 TYR 93 11.075 -1.767 -2.799 772 HD1 TYR 93 HD1 TYR 93 9.944 -3.788 -1.986 773 HD2 TYR 93 HD2 TYR 93 8.714 -1.844 -5.614 774 HE1 TYR 93 HE1 TYR 93 8.630 -5.795 -2.618 775 HE2 TYR 93 HE2 TYR 93 7.399 -3.850 -6.244 776 HH TYR 93 HH TYR 93 7.772 -6.655 -5.319 777 H ALA 94 H ALA 94 9.882 0.095 -0.119 778 HA ALA 94 HA ALA 94 11.514 2.469 -0.930 779 1HB ALA 94 HB1 ALA 94 9.860 2.009 1.571 780 2HB ALA 94 HB2 ALA 94 10.914 3.400 1.316 781 3HB ALA 94 HB3 ALA 94 9.511 3.155 0.276 782 H ASP 95 H ASP 95 13.617 2.462 -0.280 783 HA ASP 95 HA ASP 95 15.591 1.793 0.785 784 1HB ASP 95 HB2 ASP 95 13.529 1.020 2.848 785 2HB ASP 95 HB3 ASP 95 15.238 0.659 3.087 786 H GLY 96 H GLY 96 13.842 -0.074 -0.951 787 1HA GLY 96 HA2 GLY 96 14.407 -2.168 -1.916 788 2HA GLY 96 HA3 GLY 96 15.597 -2.403 -0.636 789 H LYS 97 H LYS 97 12.493 -1.476 0.466 790 HA LYS 97 HA LYS 97 11.880 -4.327 1.136 791 1HB LYS 97 HB2 LYS 97 12.641 -2.709 3.036 792 2HB LYS 97 HB3 LYS 97 11.031 -2.009 2.864 793 1HG LYS 97 HG2 LYS 97 10.125 -4.391 3.082 794 2HG LYS 97 HG3 LYS 97 11.746 -4.853 3.600 795 1HD LYS 97 HD2 LYS 97 10.584 -2.476 4.945 796 2HD LYS 97 HD3 LYS 97 9.830 -4.024 5.325 797 1HE LYS 97 HE2 LYS 97 12.822 -3.828 5.342 798 2HE LYS 97 HE3 LYS 97 11.917 -3.192 6.715 799 1HZ LYS 97 HZ1 LYS 97 10.822 -5.335 6.938 800 2HZ LYS 97 HZ2 LYS 97 11.714 -5.947 5.627 801 3HZ LYS 97 HZ3 LYS 97 12.508 -5.502 7.058 802 H MET 98 H MET 98 9.686 -4.935 0.989 803 HA MET 98 HA MET 98 8.090 -3.417 -0.885 804 1HB MET 98 HB2 MET 98 8.065 -5.944 -0.588 805 2HB MET 98 HB3 MET 98 7.133 -5.677 0.885 806 1HG MET 98 HG2 MET 98 5.240 -5.229 -0.269 807 2HG MET 98 HG3 MET 98 6.088 -4.177 -1.403 808 1HE MET 98 HE1 MET 98 5.670 -7.565 -0.079 809 2HE MET 98 HE2 MET 98 4.306 -7.759 -1.176 810 3HE MET 98 HE3 MET 98 5.766 -8.710 -1.424 811 H VAL 99 H VAL 99 7.158 -1.523 -0.246 812 HA VAL 99 HA VAL 99 6.581 -0.769 2.424 813 HB VAL 99 HB VAL 99 5.329 0.133 -0.187 814 1HG1 VAL 99 HG11 VAL 99 4.597 0.695 2.570 815 2HG1 VAL 99 HG12 VAL 99 5.110 2.162 1.737 816 3HG1 VAL 99 HG13 VAL 99 3.792 1.191 1.081 817 1HG2 VAL 99 HG21 VAL 99 7.800 0.715 1.273 818 2HG2 VAL 99 HG22 VAL 99 7.366 1.102 -0.392 819 3HG2 VAL 99 HG23 VAL 99 6.865 2.168 0.921 820 H ASN 100 H ASN 100 4.579 -2.428 0.007 821 HA ASN 100 HA ASN 100 2.117 -2.389 1.416 822 1HB ASN 100 HB2 ASN 100 3.238 -4.602 -0.334 823 2HB ASN 100 HB3 ASN 100 1.542 -4.391 0.098 824 1HD2 ASN 100 HD21 ASN 100 0.313 -3.038 -1.248 825 2HD2 ASN 100 HD22 ASN 100 0.967 -2.006 -2.428 826 H GLU 101 H GLU 101 4.906 -4.571 1.676 827 HA GLU 101 HA GLU 101 3.611 -6.245 3.689 828 1HB GLU 101 HB2 GLU 101 5.292 -7.314 2.356 829 2HB GLU 101 HB3 GLU 101 6.459 -6.030 2.680 830 1HG GLU 101 HG2 GLU 101 6.823 -6.736 4.882 831 2HG GLU 101 HG3 GLU 101 5.291 -7.607 4.960 832 H ALA 102 H ALA 102 5.407 -3.288 3.656 833 HA ALA 102 HA ALA 102 6.388 -3.399 6.372 834 1HB ALA 102 HB1 ALA 102 6.452 -1.546 4.182 835 2HB ALA 102 HB2 ALA 102 5.896 -0.697 5.623 836 3HB ALA 102 HB3 ALA 102 7.441 -1.548 5.642 837 H LEU 103 H LEU 103 3.469 -2.073 4.856 838 HA LEU 103 HA LEU 103 2.382 -1.026 7.328 839 1HB LEU 103 HB2 LEU 103 1.114 -1.693 4.657 840 2HB LEU 103 HB3 LEU 103 0.234 -0.947 5.990 841 HG LEU 103 HG LEU 103 2.805 0.350 5.345 842 1HD1 LEU 103 HD11 LEU 103 0.628 0.006 3.320 843 2HD1 LEU 103 HD12 LEU 103 1.424 1.575 3.428 844 3HD1 LEU 103 HD13 LEU 103 2.371 0.128 3.081 845 1HD2 LEU 103 HD21 LEU 103 1.157 1.232 6.971 846 2HD2 LEU 103 HD22 LEU 103 1.406 2.361 5.639 847 3HD2 LEU 103 HD23 LEU 103 -0.041 1.354 5.684 848 H VAL 104 H VAL 104 1.623 -3.927 5.368 849 HA VAL 104 HA VAL 104 -0.293 -5.065 7.100 850 HB VAL 104 HB VAL 104 1.803 -6.516 5.451 851 1HG1 VAL 104 HG11 VAL 104 -0.127 -7.484 7.283 852 2HG1 VAL 104 HG12 VAL 104 -0.760 -7.818 5.672 853 3HG1 VAL 104 HG13 VAL 104 0.829 -8.425 6.137 854 1HG2 VAL 104 HG21 VAL 104 -0.141 -4.759 4.567 855 2HG2 VAL 104 HG22 VAL 104 0.570 -6.053 3.601 856 3HG2 VAL 104 HG23 VAL 104 -0.954 -6.319 4.448 857 H ARG 105 H ARG 105 3.236 -5.099 7.254 858 HA ARG 105 HA ARG 105 3.456 -7.031 9.372 859 1HB ARG 105 HB2 ARG 105 5.348 -6.249 7.894 860 2HB ARG 105 HB3 ARG 105 5.341 -4.728 8.788 861 1HG ARG 105 HG2 ARG 105 5.512 -6.269 10.899 862 2HG ARG 105 HG3 ARG 105 6.082 -7.479 9.748 863 1HD ARG 105 HD2 ARG 105 7.724 -5.681 8.924 864 2HD ARG 105 HD3 ARG 105 7.310 -4.795 10.393 865 HE ARG 105 HE ARG 105 8.360 -7.589 10.544 866 1HH1 ARG 105 HH11 ARG 105 10.189 -5.068 10.329 867 2HH1 ARG 105 HH12 ARG 105 10.611 -4.868 11.997 868 1HH2 ARG 105 HH21 ARG 105 8.123 -6.983 13.158 869 2HH2 ARG 105 HH22 ARG 105 9.443 -5.952 13.598 870 H GLN 106 H GLN 106 3.110 -3.497 9.332 871 HA GLN 106 HA GLN 106 3.141 -3.412 12.284 872 1HB GLN 106 HB2 GLN 106 3.378 -1.470 10.088 873 2HB GLN 106 HB3 GLN 106 2.378 -0.902 11.426 874 1HG GLN 106 HG2 GLN 106 4.671 -0.278 11.891 875 2HG GLN 106 HG3 GLN 106 4.222 -1.576 12.999 876 1HE2 GLN 106 HE21 GLN 106 6.462 -2.306 13.203 877 2HE2 GLN 106 HE22 GLN 106 7.244 -3.112 11.931 878 H GLY 107 H GLY 107 0.962 -4.657 10.432 879 1HA GLY 107 HA2 GLY 107 -1.391 -4.725 10.348 880 2HA GLY 107 HA3 GLY 107 -1.261 -4.390 12.075 881 H LEU 108 H LEU 108 -0.671 -2.456 9.114 882 HA LEU 108 HA LEU 108 -2.349 -0.317 10.362 883 1HB LEU 108 HB2 LEU 108 0.133 -0.244 8.687 884 2HB LEU 108 HB3 LEU 108 -1.011 1.093 8.559 885 HG LEU 108 HG LEU 108 0.046 0.077 11.206 886 1HD1 LEU 108 HD11 LEU 108 1.295 1.787 9.175 887 2HD1 LEU 108 HD12 LEU 108 1.182 2.559 10.757 888 3HD1 LEU 108 HD13 LEU 108 2.015 1.013 10.587 889 1HD2 LEU 108 HD21 LEU 108 -1.898 2.075 10.324 890 2HD2 LEU 108 HD22 LEU 108 -1.630 1.412 11.936 891 3HD2 LEU 108 HD23 LEU 108 -0.657 2.768 11.366 892 H ALA 109 H ALA 109 -1.935 -2.400 7.626 893 HA ALA 109 HA ALA 109 -4.243 -1.030 6.301 894 1HB ALA 109 HB1 ALA 109 -1.897 -2.472 5.029 895 2HB ALA 109 HB2 ALA 109 -3.315 -1.907 4.145 896 3HB ALA 109 HB3 ALA 109 -2.248 -0.747 4.935 897 H LYS 110 H LYS 110 -5.471 -2.646 4.847 898 HA LYS 110 HA LYS 110 -5.556 -5.314 6.206 899 1HB LYS 110 HB2 LYS 110 -7.772 -3.498 5.264 900 2HB LYS 110 HB3 LYS 110 -8.039 -5.231 5.454 901 1HG LYS 110 HG2 LYS 110 -7.573 -5.162 7.777 902 2HG LYS 110 HG3 LYS 110 -6.832 -3.565 7.664 903 1HD LYS 110 HD2 LYS 110 -9.257 -2.931 6.728 904 2HD LYS 110 HD3 LYS 110 -9.719 -4.317 7.716 905 1HE LYS 110 HE2 LYS 110 -9.443 -3.148 9.623 906 2HE LYS 110 HE3 LYS 110 -7.842 -2.601 9.124 907 1HZ LYS 110 HZ1 LYS 110 -10.140 -1.398 7.790 908 2HZ LYS 110 HZ2 LYS 110 -9.867 -0.951 9.406 909 3HZ LYS 110 HZ3 LYS 110 -8.658 -0.701 8.242 910 H VAL 111 H VAL 111 -5.121 -6.977 4.840 911 HA VAL 111 HA VAL 111 -4.645 -6.589 2.043 912 HB VAL 111 HB VAL 111 -5.105 -9.090 3.688 913 1HG1 VAL 111 HG11 VAL 111 -4.656 -8.694 0.751 914 2HG1 VAL 111 HG12 VAL 111 -3.900 -10.076 1.544 915 3HG1 VAL 111 HG13 VAL 111 -5.653 -9.891 1.577 916 1HG2 VAL 111 HG21 VAL 111 -3.004 -7.445 3.794 917 2HG2 VAL 111 HG22 VAL 111 -2.798 -9.195 3.868 918 3HG2 VAL 111 HG23 VAL 111 -2.537 -8.340 2.348 919 H ALA 112 H ALA 112 -6.171 -6.253 0.511 920 HA ALA 112 HA ALA 112 -8.538 -7.950 0.358 921 1HB ALA 112 HB1 ALA 112 -8.776 -5.634 1.907 922 2HB ALA 112 HB2 ALA 112 -9.472 -5.191 0.348 923 3HB ALA 112 HB3 ALA 112 -10.104 -6.580 1.234 924 H TYR 113 H TYR 113 -10.072 -6.577 -1.413 925 HA TYR 113 HA TYR 113 -10.183 -6.022 -3.691 926 1HB TYR 113 HB2 TYR 113 -7.713 -4.534 -2.788 927 2HB TYR 113 HB3 TYR 113 -8.292 -4.445 -4.451 928 HD1 TYR 113 HD1 TYR 113 -11.123 -4.342 -4.350 929 HD2 TYR 113 HD2 TYR 113 -8.315 -2.625 -1.591 930 HE1 TYR 113 HE1 TYR 113 -12.817 -2.662 -3.673 931 HE2 TYR 113 HE2 TYR 113 -10.008 -0.944 -0.913 932 HH TYR 113 HH TYR 113 -12.793 -0.330 -2.668 933 H VAL 114 H VAL 114 -9.611 -8.491 -3.747 934 HA VAL 114 HA VAL 114 -6.983 -8.869 -5.117 935 HB VAL 114 HB VAL 114 -8.810 -10.864 -3.745 936 1HG1 VAL 114 HG11 VAL 114 -6.610 -11.175 -5.678 937 2HG1 VAL 114 HG12 VAL 114 -6.400 -12.113 -4.199 938 3HG1 VAL 114 HG13 VAL 114 -7.846 -12.332 -5.184 939 1HG2 VAL 114 HG21 VAL 114 -6.462 -9.270 -2.948 940 2HG2 VAL 114 HG22 VAL 114 -7.675 -10.063 -1.943 941 3HG2 VAL 114 HG23 VAL 114 -6.317 -10.989 -2.583 942 H TYR 115 H TYR 115 -7.122 -9.024 -7.295 943 HA TYR 115 HA TYR 115 -9.361 -10.534 -8.499 944 1HB TYR 115 HB2 TYR 115 -8.675 -7.746 -9.463 945 2HB TYR 115 HB3 TYR 115 -10.003 -8.770 -10.005 946 HD1 TYR 115 HD1 TYR 115 -11.886 -9.310 -8.432 947 HD2 TYR 115 HD2 TYR 115 -8.858 -6.417 -7.480 948 HE1 TYR 115 HE1 TYR 115 -13.337 -8.378 -6.651 949 HE2 TYR 115 HE2 TYR 115 -10.308 -5.484 -5.699 950 HH TYR 115 HH TYR 115 -12.777 -5.401 -5.195 951 H LYS 116 H LYS 116 -8.464 -11.881 -9.985 952 HA LYS 116 HA LYS 116 -5.688 -11.564 -10.788 953 1HB LYS 116 HB2 LYS 116 -6.149 -13.577 -12.202 954 2HB LYS 116 HB3 LYS 116 -6.610 -13.803 -10.515 955 1HG LYS 116 HG2 LYS 116 -8.890 -12.707 -11.666 956 2HG LYS 116 HG3 LYS 116 -8.286 -13.804 -12.909 957 1HD LYS 116 HD2 LYS 116 -8.616 -14.606 -10.007 958 2HD LYS 116 HD3 LYS 116 -9.858 -14.872 -11.230 959 1HE LYS 116 HE2 LYS 116 -7.106 -15.786 -11.903 960 2HE LYS 116 HE3 LYS 116 -7.969 -16.709 -10.672 961 1HZ LYS 116 HZ1 LYS 116 -9.891 -16.657 -12.338 962 2HZ LYS 116 HZ2 LYS 116 -8.714 -16.236 -13.488 963 3HZ LYS 116 HZ3 LYS 116 -8.598 -17.708 -12.647 964 HA PRO 117 HA PRO 117 -4.597 -12.475 -12.409 965 1HB PRO 117 HB2 PRO 117 -2.724 -11.499 -14.137 966 2HB PRO 117 HB3 PRO 117 -3.952 -12.684 -14.617 967 1HG PRO 117 HG2 PRO 117 -3.774 -9.798 -15.275 968 2HG PRO 117 HG3 PRO 117 -4.581 -11.104 -16.155 969 1HD PRO 117 HD2 PRO 117 -5.812 -9.176 -14.448 970 2HD PRO 117 HD3 PRO 117 -6.583 -10.595 -15.186 971 H ASN 118 H ASN 118 -5.323 -9.529 -11.524 972 HA ASN 118 HA ASN 118 -2.648 -8.463 -10.900 973 1HB ASN 118 HB2 ASN 118 -5.439 -7.485 -10.768 974 2HB ASN 118 HB3 ASN 118 -4.372 -6.894 -9.494 975 1HD2 ASN 118 HD21 ASN 118 -5.273 -5.037 -11.380 976 2HD2 ASN 118 HD22 ASN 118 -3.998 -4.594 -12.410 977 H ASN 119 H ASN 119 -2.161 -10.510 -9.627 978 HA ASN 119 HA ASN 119 -2.508 -9.957 -6.795 979 1HB ASN 119 HB2 ASN 119 -3.644 -12.100 -6.252 980 2HB ASN 119 HB3 ASN 119 -4.666 -11.045 -7.229 981 1HD2 ASN 119 HD21 ASN 119 -5.746 -13.207 -7.820 982 2HD2 ASN 119 HD22 ASN 119 -5.070 -14.103 -9.092 983 H THR 120 H THR 120 -0.380 -10.424 -8.800 984 HA THR 120 HA THR 120 0.812 -12.974 -8.600 985 HB THR 120 HB THR 120 2.168 -10.263 -8.742 986 HG1 THR 120 HG1 THR 120 0.664 -10.820 -10.428 987 1HG2 THR 120 HG21 THR 120 3.154 -13.067 -8.840 988 2HG2 THR 120 HG22 THR 120 3.835 -11.944 -10.018 989 3HG2 THR 120 HG23 THR 120 3.973 -11.603 -8.293 990 H HIS 121 H HIS 121 0.517 -10.463 -6.213 991 HA HIS 121 HA HIS 121 2.214 -12.110 -4.380 992 1HB HIS 121 HB2 HIS 121 2.027 -9.106 -4.651 993 2HB HIS 121 HB3 HIS 121 2.655 -9.876 -3.195 994 HD1 HIS 121 HD1 HIS 121 4.074 -12.268 -4.765 995 HD2 HIS 121 HD2 HIS 121 4.555 -8.204 -5.557 996 HE1 HIS 121 HE1 HIS 121 6.299 -12.029 -5.949 997 H GLU 122 H GLU 122 -0.514 -12.604 -4.600 998 HA GLU 122 HA GLU 122 -1.933 -11.065 -2.540 999 1HB GLU 122 HB2 GLU 122 -3.279 -11.852 -4.368 1000 2HB GLU 122 HB3 GLU 122 -2.676 -13.500 -4.181 1001 1HG GLU 122 HG2 GLU 122 -3.781 -12.543 -1.681 1002 2HG GLU 122 HG3 GLU 122 -4.969 -12.391 -2.976 1003 H GLN 123 H GLN 123 -0.697 -14.395 -2.907 1004 HA GLN 123 HA GLN 123 -1.453 -15.245 -0.270 1005 1HB GLN 123 HB2 GLN 123 0.118 -16.293 -2.502 1006 2HB GLN 123 HB3 GLN 123 0.803 -16.730 -0.937 1007 1HG GLN 123 HG2 GLN 123 -1.946 -17.090 -0.603 1008 2HG GLN 123 HG3 GLN 123 -1.619 -17.710 -2.222 1009 1HE2 GLN 123 HE21 GLN 123 1.122 -18.579 -1.691 1010 2HE2 GLN 123 HE22 GLN 123 1.030 -19.916 -0.650 1011 H LEU 124 H LEU 124 1.585 -13.921 -1.585 1012 HA LEU 124 HA LEU 124 3.202 -14.123 0.698 1013 1HB LEU 124 HB2 LEU 124 3.801 -13.201 -1.626 1014 2HB LEU 124 HB3 LEU 124 3.164 -11.659 -1.051 1015 HG LEU 124 HG LEU 124 4.758 -11.619 0.778 1016 1HD1 LEU 124 HD11 LEU 124 5.158 -14.450 -0.069 1017 2HD1 LEU 124 HD12 LEU 124 6.574 -13.581 0.525 1018 3HD1 LEU 124 HD13 LEU 124 5.149 -13.752 1.550 1019 1HD2 LEU 124 HD21 LEU 124 5.585 -11.877 -2.028 1020 2HD2 LEU 124 HD22 LEU 124 6.029 -10.656 -0.835 1021 3HD2 LEU 124 HD23 LEU 124 6.895 -12.191 -0.889 1022 H LEU 125 H LEU 125 1.278 -11.229 -0.195 1023 HA LEU 125 HA LEU 125 1.617 -9.971 2.357 1024 1HB LEU 125 HB2 LEU 125 -0.386 -9.598 0.123 1025 2HB LEU 125 HB3 LEU 125 -0.432 -8.624 1.595 1026 HG LEU 125 HG LEU 125 1.995 -8.895 -0.201 1027 1HD1 LEU 125 HD11 LEU 125 -0.221 -7.599 -0.953 1028 2HD1 LEU 125 HD12 LEU 125 0.459 -6.349 0.090 1029 3HD1 LEU 125 HD13 LEU 125 1.385 -6.951 -1.286 1030 1HD2 LEU 125 HD21 LEU 125 1.766 -8.102 2.471 1031 2HD2 LEU 125 HD22 LEU 125 3.120 -7.754 1.395 1032 3HD2 LEU 125 HD23 LEU 125 1.811 -6.586 1.573 1033 H ARG 126 H ARG 126 -0.398 -12.564 1.331 1034 HA ARG 126 HA ARG 126 -2.545 -12.175 3.231 1035 1HB ARG 126 HB2 ARG 126 -1.821 -14.109 1.219 1036 2HB ARG 126 HB3 ARG 126 -2.254 -14.945 2.710 1037 1HG ARG 126 HG2 ARG 126 -4.110 -12.802 2.323 1038 2HG ARG 126 HG3 ARG 126 -4.003 -13.715 0.818 1039 1HD ARG 126 HD2 ARG 126 -4.679 -15.722 1.837 1040 2HD ARG 126 HD3 ARG 126 -4.267 -15.148 3.453 1041 HE ARG 126 HE ARG 126 -6.720 -14.452 1.945 1042 1HH1 ARG 126 HH11 ARG 126 -4.577 -13.548 4.457 1043 2HH1 ARG 126 HH12 ARG 126 -5.831 -13.078 5.556 1044 1HH2 ARG 126 HH21 ARG 126 -8.405 -14.084 3.460 1045 2HH2 ARG 126 HH22 ARG 126 -7.999 -13.380 4.990 1046 H LYS 127 H LYS 127 0.000 -14.707 3.240 1047 HA LYS 127 HA LYS 127 -0.311 -15.512 5.901 1048 1HB LYS 127 HB2 LYS 127 2.279 -15.925 5.739 1049 2HB LYS 127 HB3 LYS 127 1.193 -16.831 4.686 1050 1HG LYS 127 HG2 LYS 127 2.014 -15.846 2.825 1051 2HG LYS 127 HG3 LYS 127 1.948 -14.243 3.554 1052 1HD LYS 127 HD2 LYS 127 4.174 -14.284 3.856 1053 2HD LYS 127 HD3 LYS 127 4.008 -15.716 4.873 1054 1HE LYS 127 HE2 LYS 127 3.827 -16.113 1.923 1055 2HE LYS 127 HE3 LYS 127 5.418 -15.760 2.595 1056 1HZ LYS 127 HZ1 LYS 127 3.717 -17.793 3.868 1057 2HZ LYS 127 HZ2 LYS 127 4.592 -18.193 2.468 1058 3HZ LYS 127 HZ3 LYS 127 5.408 -17.661 3.859 1059 H SER 128 H SER 128 1.527 -12.767 4.617 1060 HA SER 128 HA SER 128 2.817 -11.959 7.006 1061 1HB SER 128 HB2 SER 128 1.623 -9.978 5.071 1062 2HB SER 128 HB3 SER 128 3.128 -9.856 5.978 1063 HG SER 128 HG SER 128 3.526 -10.409 3.812 1064 H GLU 129 H GLU 129 -0.433 -11.140 5.783 1065 HA GLU 129 HA GLU 129 -1.192 -9.432 7.933 1066 1HB GLU 129 HB2 GLU 129 -2.396 -10.053 5.654 1067 2HB GLU 129 HB3 GLU 129 -3.202 -11.256 6.660 1068 1HG GLU 129 HG2 GLU 129 -4.558 -9.253 6.677 1069 2HG GLU 129 HG3 GLU 129 -3.800 -9.406 8.263 1070 H ALA 130 H ALA 130 -1.169 -12.942 7.607 1071 HA ALA 130 HA ALA 130 -2.728 -13.517 9.953 1072 1HB ALA 130 HB1 ALA 130 -1.894 -15.077 7.986 1073 2HB ALA 130 HB2 ALA 130 -0.515 -15.332 9.056 1074 3HB ALA 130 HB3 ALA 130 -2.141 -15.742 9.601 1075 H GLN 131 H GLN 131 0.721 -12.966 9.404 1076 HA GLN 131 HA GLN 131 1.580 -13.676 12.055 1077 1HB GLN 131 HB2 GLN 131 2.976 -13.247 9.873 1078 2HB GLN 131 HB3 GLN 131 2.964 -11.568 10.413 1079 1HG GLN 131 HG2 GLN 131 4.616 -12.030 11.864 1080 2HG GLN 131 HG3 GLN 131 3.568 -13.192 12.677 1081 1HE2 GLN 131 HE21 GLN 131 5.552 -14.557 12.987 1082 2HE2 GLN 131 HE22 GLN 131 6.122 -15.502 11.697 1083 H ALA 132 H ALA 132 0.461 -10.655 10.582 1084 HA ALA 132 HA ALA 132 1.014 -9.012 12.893 1085 1HB ALA 132 HB1 ALA 132 -0.830 -8.675 10.516 1086 2HB ALA 132 HB2 ALA 132 -0.658 -7.448 11.771 1087 3HB ALA 132 HB3 ALA 132 0.732 -7.902 10.784 1088 H LYS 133 H LYS 133 -1.566 -11.169 11.986 1089 HA LYS 133 HA LYS 133 -3.569 -10.125 13.785 1090 1HB LYS 133 HB2 LYS 133 -3.223 -12.489 12.068 1091 2HB LYS 133 HB3 LYS 133 -4.150 -12.808 13.534 1092 1HG LYS 133 HG2 LYS 133 -5.897 -11.506 12.867 1093 2HG LYS 133 HG3 LYS 133 -4.842 -10.294 12.138 1094 1HD LYS 133 HD2 LYS 133 -6.252 -11.566 10.476 1095 2HD LYS 133 HD3 LYS 133 -4.516 -11.662 10.174 1096 1HE LYS 133 HE2 LYS 133 -4.613 -13.902 10.317 1097 2HE LYS 133 HE3 LYS 133 -5.204 -13.768 11.972 1098 1HZ LYS 133 HZ1 LYS 133 -7.189 -13.187 9.969 1099 2HZ LYS 133 HZ2 LYS 133 -6.607 -14.782 9.907 1100 3HZ LYS 133 HZ3 LYS 133 -7.291 -14.180 11.341 1101 H LYS 134 H LYS 134 -1.262 -12.844 14.043 1102 HA LYS 134 HA LYS 134 -1.975 -13.539 16.727 1103 1HB LYS 134 HB2 LYS 134 0.809 -13.919 15.664 1104 2HB LYS 134 HB3 LYS 134 -0.161 -15.006 16.655 1105 1HG LYS 134 HG2 LYS 134 -1.726 -14.860 14.443 1106 2HG LYS 134 HG3 LYS 134 -0.132 -14.658 13.714 1107 1HD LYS 134 HD2 LYS 134 -0.678 -17.036 13.797 1108 2HD LYS 134 HD3 LYS 134 0.637 -16.702 14.923 1109 1HE LYS 134 HE2 LYS 134 -0.640 -17.749 16.470 1110 2HE LYS 134 HE3 LYS 134 -1.608 -16.276 16.477 1111 1HZ LYS 134 HZ1 LYS 134 -2.061 -18.619 14.710 1112 2HZ LYS 134 HZ2 LYS 134 -2.962 -18.251 16.103 1113 3HZ LYS 134 HZ3 LYS 134 -3.007 -17.212 14.760 1114 H GLU 135 H GLU 135 0.256 -11.185 15.360 1115 HA GLU 135 HA GLU 135 1.424 -10.554 17.980 1116 1HB GLU 135 HB2 GLU 135 1.740 -9.404 15.205 1117 2HB GLU 135 HB3 GLU 135 2.476 -8.644 16.617 1118 1HG GLU 135 HG2 GLU 135 4.105 -10.206 16.722 1119 2HG GLU 135 HG3 GLU 135 2.945 -11.525 16.555 1120 H LYS 136 H LYS 136 -1.415 -9.735 16.333 1121 HA LYS 136 HA LYS 136 -2.983 -8.005 16.636 1122 1HB LYS 136 HB2 LYS 136 -1.790 -7.659 19.383 1123 2HB LYS 136 HB3 LYS 136 -3.482 -7.551 18.897 1124 1HG LYS 136 HG2 LYS 136 -2.686 -10.138 18.160 1125 2HG LYS 136 HG3 LYS 136 -1.968 -9.878 19.751 1126 1HD LYS 136 HD2 LYS 136 -4.489 -8.815 20.069 1127 2HD LYS 136 HD3 LYS 136 -4.793 -10.186 19.002 1128 1HE LYS 136 HE2 LYS 136 -2.922 -10.950 21.063 1129 2HE LYS 136 HE3 LYS 136 -4.370 -10.258 21.795 1130 1HZ LYS 136 HZ1 LYS 136 -4.648 -12.196 19.603 1131 2HZ LYS 136 HZ2 LYS 136 -4.300 -12.760 21.168 1132 3HZ LYS 136 HZ3 LYS 136 -5.709 -11.861 20.888 1133 H LEU 137 H LEU 137 -1.216 -6.899 15.136 1134 HA LEU 137 HA LEU 137 0.196 -4.691 16.480 1135 1HB LEU 137 HB2 LEU 137 0.678 -6.187 14.183 1136 2HB LEU 137 HB3 LEU 137 0.166 -4.618 13.561 1137 HG LEU 137 HG LEU 137 2.648 -4.806 13.975 1138 1HD1 LEU 137 HD11 LEU 137 0.930 -2.766 15.382 1139 2HD1 LEU 137 HD12 LEU 137 2.689 -2.648 15.417 1140 3HD1 LEU 137 HD13 LEU 137 1.834 -2.597 13.877 1141 1HD2 LEU 137 HD21 LEU 137 1.782 -5.930 16.396 1142 2HD2 LEU 137 HD22 LEU 137 3.440 -5.504 15.971 1143 3HD2 LEU 137 HD23 LEU 137 2.429 -4.350 16.840 1144 H ASN 138 H ASN 138 -1.405 -3.269 17.189 1145 HA ASN 138 HA ASN 138 -2.860 -1.454 17.005 1146 1HB ASN 138 HB2 ASN 138 -1.991 -1.605 14.106 1147 2HB ASN 138 HB3 ASN 138 -2.913 -0.275 14.809 1148 1HD2 ASN 138 HD21 ASN 138 0.170 -0.995 13.942 1149 2HD2 ASN 138 HD22 ASN 138 1.026 -0.109 15.109 1150 H ILE 139 H ILE 139 -3.817 -2.024 13.743 1151 HA ILE 139 HA ILE 139 -6.521 -2.149 14.110 1152 HB ILE 139 HB ILE 139 -4.939 -3.842 12.159 1153 1HG1 ILE 139 HG12 ILE 139 -6.384 -1.312 11.464 1154 2HG1 ILE 139 HG13 ILE 139 -4.829 -1.186 12.290 1155 1HG2 ILE 139 HG21 ILE 139 -7.748 -3.751 12.749 1156 2HG2 ILE 139 HG22 ILE 139 -7.479 -3.053 11.151 1157 3HG2 ILE 139 HG23 ILE 139 -6.918 -4.687 11.506 1158 1HD1 ILE 139 HD11 ILE 139 -4.405 -3.130 10.331 1159 2HD1 ILE 139 HD12 ILE 139 -5.391 -1.910 9.524 1160 3HD1 ILE 139 HD13 ILE 139 -3.860 -1.454 10.271 1161 H TRP 140 H TRP 140 -4.414 -5.036 14.169 1162 HA TRP 140 HA TRP 140 -6.661 -6.707 15.038 1163 1HB TRP 140 HB2 TRP 140 -3.735 -7.465 14.948 1164 2HB TRP 140 HB3 TRP 140 -5.136 -8.534 14.844 1165 HD1 TRP 140 HD1 TRP 140 -2.854 -6.435 12.753 1166 HE1 TRP 140 HE1 TRP 140 -3.615 -6.492 10.292 1167 HE3 TRP 140 HE3 TRP 140 -7.421 -8.654 13.293 1168 HZ2 TRP 140 HZ2 TRP 140 -5.865 -7.360 8.753 1169 HZ3 TRP 140 HZ3 TRP 140 -8.853 -9.083 11.315 1170 HH2 TRP 140 HH2 TRP 140 -8.082 -8.439 9.048 1171 H SER 141 H SER 141 -6.212 -4.620 16.873 1172 HA SER 141 HA SER 141 -4.930 -6.029 19.176 1173 1HB SER 141 HB2 SER 141 -4.679 -3.836 20.205 1174 2HB SER 141 HB3 SER 141 -4.007 -3.778 18.578 1175 HG SER 141 HG SER 141 -5.477 -2.020 19.207 1176 H GLU 142 H GLU 142 -7.788 -6.123 17.946 1177 HA GLU 142 HA GLU 142 -9.536 -4.981 19.941 1178 1HB GLU 142 HB2 GLU 142 -10.142 -7.322 18.116 1179 2HB GLU 142 HB3 GLU 142 -11.297 -6.206 18.847 1180 1HG GLU 142 HG2 GLU 142 -9.474 -4.569 17.476 1181 2HG GLU 142 HG3 GLU 142 -9.789 -5.920 16.385 1182 H ASP 143 H ASP 143 -11.115 -6.613 21.120 1183 HA ASP 143 HA ASP 143 -9.389 -8.311 22.804 1184 1HB ASP 143 HB2 ASP 143 -12.096 -7.104 23.019 1185 2HB ASP 143 HB3 ASP 143 -11.864 -8.644 23.847 1186 H ASN 144 H ASN 144 -9.036 -9.860 20.955 1187 HA ASN 144 HA ASN 144 -11.173 -11.930 20.994 1188 1HB ASN 144 HB2 ASN 144 -11.164 -10.396 18.866 1189 2HB ASN 144 HB3 ASN 144 -9.732 -11.325 18.422 1190 1HD2 ASN 144 HD21 ASN 144 -10.271 -13.898 19.093 1191 2HD2 ASN 144 HD22 ASN 144 -11.701 -14.456 18.368 1192 H ALA 145 H ALA 145 -9.400 -12.657 22.579 1193 HA ALA 145 HA ALA 145 -7.105 -13.896 21.131 1194 1HB ALA 145 HB1 ALA 145 -7.176 -12.426 23.489 1195 2HB ALA 145 HB2 ALA 145 -7.070 -14.095 24.048 1196 3HB ALA 145 HB3 ALA 145 -5.845 -13.452 22.955 1197 H ASP 146 H ASP 146 -9.813 -15.015 21.071 1198 HA ASP 146 HA ASP 146 -9.518 -17.434 22.784 1199 1HB ASP 146 HB2 ASP 146 -11.785 -15.960 21.619 1200 2HB ASP 146 HB3 ASP 146 -11.912 -17.711 21.447 1201 H SER 147 H SER 147 -7.630 -17.549 20.916 1202 HA SER 147 HA SER 147 -8.303 -18.466 18.322 1203 1HB SER 147 HB2 SER 147 -5.938 -19.125 20.094 1204 2HB SER 147 HB3 SER 147 -6.053 -19.616 18.407 1205 HG SER 147 HG SER 147 -5.347 -17.245 19.442 1206 H GLY 148 H GLY 148 -7.692 -20.373 21.291 1207 1HA GLY 148 HA2 GLY 148 -9.535 -22.442 20.270 1208 2HA GLY 148 HA3 GLY 148 -7.868 -22.953 20.529 1209 H GLN 149 H GLN 149 -8.468 -24.380 22.240 1210 HA GLN 149 HA GLN 149 -9.609 -23.090 24.672 1211 1HB GLN 149 HB2 GLN 149 -10.471 -25.330 23.596 1212 2HB GLN 149 HB3 GLN 149 -9.082 -26.038 24.423 1213 1HG GLN 149 HG2 GLN 149 -9.863 -25.211 26.566 1214 2HG GLN 149 HG3 GLN 149 -11.173 -24.321 25.789 1215 1HE2 GLN 149 HE21 GLN 149 -10.106 -27.634 24.958 1216 2HE2 GLN 149 HE22 GLN 149 -11.566 -28.384 25.389 1217 HN3 PTP 150 H3 PTP 150 -8.319 -4.705 -8.436 1218 1H5M PTP 150 H51 PTP 150 -6.329 -3.149 -4.456 1219 2H5M PTP 150 H52 PTP 150 -7.082 -1.553 -4.227 1220 3H5M PTP 150 H53 PTP 150 -5.740 -1.747 -5.380 1221 H6 PTP 150 H6 PTP 150 -8.777 -0.822 -5.642 1222 H1* PTP 150 H1' PTP 150 -11.020 -1.124 -8.524 1223 2H2* PTP 150 H2' PTP 150 -11.597 -1.907 -5.667 1224 H3* PTP 150 H3' PTP 150 -12.749 0.131 -5.240 1225 H4* PTP 150 H4' PTP 150 -11.359 1.926 -6.779 1226 2H5* PTP 150 H5' PTP 150 -10.511 0.213 -4.379 Start of MODEL 17 1 1H ALA 1 H1 ALA 1 7.958 -14.809 -23.257 2 2H ALA 1 H2 ALA 1 9.529 -15.211 -23.763 3 3H ALA 1 H3 ALA 1 9.172 -13.622 -23.290 4 HA ALA 1 HA ALA 1 8.782 -13.139 -25.404 5 1HB ALA 1 HB1 ALA 1 9.994 -15.518 -25.674 6 2HB ALA 1 HB2 ALA 1 8.405 -15.959 -26.298 7 3HB ALA 1 HB3 ALA 1 9.318 -14.653 -27.054 8 H THR 2 H THR 2 7.032 -13.784 -27.268 9 HA THR 2 HA THR 2 4.727 -13.568 -27.701 10 HB THR 2 HB THR 2 3.491 -15.539 -26.342 11 HG1 THR 2 HG1 THR 2 4.852 -16.738 -25.318 12 1HG2 THR 2 HG21 THR 2 3.799 -15.403 -28.786 13 2HG2 THR 2 HG22 THR 2 5.466 -15.952 -28.605 14 3HG2 THR 2 HG23 THR 2 4.132 -17.031 -28.193 15 H SER 3 H SER 3 3.893 -14.906 -24.585 16 HA SER 3 HA SER 3 3.490 -12.248 -23.378 17 1HB SER 3 HB2 SER 3 0.984 -13.562 -23.096 18 2HB SER 3 HB3 SER 3 1.322 -12.049 -23.936 19 HG SER 3 HG SER 3 0.385 -13.886 -25.182 20 H THR 4 H THR 4 5.136 -13.581 -22.070 21 HA THR 4 HA THR 4 3.797 -14.604 -19.706 22 HB THR 4 HB THR 4 3.623 -16.628 -21.044 23 HG1 THR 4 HG1 THR 4 4.913 -17.984 -19.739 24 1HG2 THR 4 HG21 THR 4 6.212 -15.732 -21.996 25 2HG2 THR 4 HG22 THR 4 6.276 -17.420 -21.487 26 3HG2 THR 4 HG23 THR 4 5.111 -16.910 -22.708 27 H LYS 5 H LYS 5 5.647 -12.512 -20.222 28 HA LYS 5 HA LYS 5 8.253 -13.522 -19.229 29 1HB LYS 5 HB2 LYS 5 9.073 -11.264 -19.691 30 2HB LYS 5 HB3 LYS 5 8.204 -11.875 -21.099 31 1HG LYS 5 HG2 LYS 5 6.492 -10.477 -19.152 32 2HG LYS 5 HG3 LYS 5 7.717 -9.450 -19.899 33 1HD LYS 5 HD2 LYS 5 6.318 -11.266 -21.764 34 2HD LYS 5 HD3 LYS 5 5.304 -10.015 -21.045 35 1HE LYS 5 HE2 LYS 5 7.851 -8.893 -21.820 36 2HE LYS 5 HE3 LYS 5 7.112 -9.716 -23.193 37 1HZ LYS 5 HZ1 LYS 5 5.018 -8.497 -22.597 38 2HZ LYS 5 HZ2 LYS 5 5.950 -7.559 -21.529 39 3HZ LYS 5 HZ3 LYS 5 6.276 -7.529 -23.196 40 H LYS 6 H LYS 6 9.165 -12.731 -17.257 41 HA LYS 6 HA LYS 6 7.351 -12.431 -15.081 42 1HB LYS 6 HB2 LYS 6 10.068 -12.854 -15.335 43 2HB LYS 6 HB3 LYS 6 9.998 -11.228 -14.654 44 1HG LYS 6 HG2 LYS 6 8.849 -11.945 -12.733 45 2HG LYS 6 HG3 LYS 6 8.313 -13.440 -13.499 46 1HD LYS 6 HD2 LYS 6 11.252 -13.035 -13.282 47 2HD LYS 6 HD3 LYS 6 10.385 -13.367 -11.782 48 1HE LYS 6 HE2 LYS 6 9.356 -15.145 -13.743 49 2HE LYS 6 HE3 LYS 6 11.114 -15.205 -13.866 50 1HZ LYS 6 HZ1 LYS 6 10.904 -15.280 -11.265 51 2HZ LYS 6 HZ2 LYS 6 9.378 -15.928 -11.624 52 3HZ LYS 6 HZ3 LYS 6 10.782 -16.693 -12.201 53 H LEU 7 H LEU 7 7.489 -10.422 -13.573 54 HA LEU 7 HA LEU 7 6.582 -8.126 -15.112 55 1HB LEU 7 HB2 LEU 7 7.113 -8.498 -12.149 56 2HB LEU 7 HB3 LEU 7 6.386 -7.053 -12.853 57 HG LEU 7 HG LEU 7 5.256 -9.826 -13.282 58 1HD1 LEU 7 HD11 LEU 7 5.085 -8.023 -10.958 59 2HD1 LEU 7 HD12 LEU 7 3.518 -8.535 -11.587 60 3HD1 LEU 7 HD13 LEU 7 4.701 -9.740 -11.080 61 1HD2 LEU 7 HD21 LEU 7 4.782 -7.479 -14.611 62 2HD2 LEU 7 HD22 LEU 7 3.597 -8.776 -14.443 63 3HD2 LEU 7 HD23 LEU 7 3.564 -7.401 -13.338 64 H HIS 8 H HIS 8 7.629 -5.946 -13.762 65 HA HIS 8 HA HIS 8 10.581 -6.159 -13.986 66 1HB HIS 8 HB2 HIS 8 9.240 -5.331 -16.171 67 2HB HIS 8 HB3 HIS 8 9.338 -3.795 -15.308 68 HD1 HIS 8 HD1 HIS 8 11.547 -2.589 -15.371 69 HD2 HIS 8 HD2 HIS 8 11.896 -6.556 -16.606 70 HE1 HIS 8 HE1 HIS 8 13.919 -2.870 -16.217 71 H LYS 9 H LYS 9 11.672 -4.497 -12.805 72 HA LYS 9 HA LYS 9 9.869 -2.949 -10.989 73 1HB LYS 9 HB2 LYS 9 12.632 -4.103 -10.524 74 2HB LYS 9 HB3 LYS 9 11.852 -2.976 -9.414 75 1HG LYS 9 HG2 LYS 9 9.973 -5.037 -10.055 76 2HG LYS 9 HG3 LYS 9 11.491 -5.801 -9.584 77 1HD LYS 9 HD2 LYS 9 10.977 -3.587 -7.826 78 2HD LYS 9 HD3 LYS 9 9.549 -4.620 -7.883 79 1HE LYS 9 HE2 LYS 9 11.057 -5.413 -6.129 80 2HE LYS 9 HE3 LYS 9 10.996 -6.597 -7.434 81 1HZ LYS 9 HZ1 LYS 9 13.089 -4.511 -7.135 82 2HZ LYS 9 HZ2 LYS 9 13.267 -6.138 -6.674 83 3HZ LYS 9 HZ3 LYS 9 13.046 -5.734 -8.310 84 H GLU 10 H GLU 10 10.000 -0.764 -11.165 85 HA GLU 10 HA GLU 10 12.471 0.389 -12.398 86 1HB GLU 10 HB2 GLU 10 9.564 1.041 -12.913 87 2HB GLU 10 HB3 GLU 10 10.849 2.186 -13.290 88 1HG GLU 10 HG2 GLU 10 11.274 -0.591 -14.245 89 2HG GLU 10 HG3 GLU 10 9.983 0.308 -15.042 90 HA PRO 11 HA PRO 11 12.418 3.177 -8.976 91 1HB PRO 11 HB2 PRO 11 13.691 5.320 -10.089 92 2HB PRO 11 HB3 PRO 11 14.509 3.793 -9.720 93 1HG PRO 11 HG2 PRO 11 13.740 4.913 -12.350 94 2HG PRO 11 HG3 PRO 11 14.987 3.718 -11.959 95 1HD PRO 11 HD2 PRO 11 12.373 3.215 -13.024 96 2HD PRO 11 HD3 PRO 11 13.584 2.012 -12.528 97 H ALA 12 H ALA 12 11.749 5.452 -8.308 98 HA ALA 12 HA ALA 12 9.834 6.798 -10.107 99 1HB ALA 12 HB1 ALA 12 9.020 5.005 -7.960 100 2HB ALA 12 HB2 ALA 12 8.405 6.637 -7.706 101 3HB ALA 12 HB3 ALA 12 8.034 5.779 -9.200 102 H THR 13 H THR 13 8.803 8.715 -8.656 103 HA THR 13 HA THR 13 11.025 9.808 -6.973 104 HB THR 13 HB THR 13 9.306 11.676 -8.546 105 HG1 THR 13 HG1 THR 13 10.704 11.385 -10.331 106 1HG2 THR 13 HG21 THR 13 11.837 11.659 -7.109 107 2HG2 THR 13 HG22 THR 13 12.016 12.330 -8.731 108 3HG2 THR 13 HG23 THR 13 10.846 13.029 -7.611 109 H LEU 14 H LEU 14 10.340 10.328 -4.955 110 HA LEU 14 HA LEU 14 7.504 10.236 -4.284 111 1HB LEU 14 HB2 LEU 14 9.461 9.526 -2.779 112 2HB LEU 14 HB3 LEU 14 9.729 11.247 -2.503 113 HG LEU 14 HG LEU 14 8.271 10.155 -0.767 114 1HD1 LEU 14 HD11 LEU 14 8.153 12.635 -1.674 115 2HD1 LEU 14 HD12 LEU 14 6.578 12.118 -2.276 116 3HD1 LEU 14 HD13 LEU 14 6.930 12.043 -0.549 117 1HD2 LEU 14 HD21 LEU 14 7.157 8.713 -2.642 118 2HD2 LEU 14 HD22 LEU 14 6.155 9.292 -1.312 119 3HD2 LEU 14 HD23 LEU 14 6.115 10.118 -2.870 120 H ILE 15 H ILE 15 6.176 11.939 -4.654 121 HA ILE 15 HA ILE 15 7.361 14.671 -4.737 122 HB ILE 15 HB ILE 15 4.623 13.762 -5.671 123 1HG1 ILE 15 HG12 ILE 15 7.209 14.158 -7.210 124 2HG1 ILE 15 HG13 ILE 15 6.388 12.620 -6.942 125 1HG2 ILE 15 HG21 ILE 15 5.952 16.334 -5.404 126 2HG2 ILE 15 HG22 ILE 15 5.520 16.014 -7.083 127 3HG2 ILE 15 HG23 ILE 15 4.276 15.987 -5.831 128 1HD1 ILE 15 HD11 ILE 15 4.344 13.746 -8.061 129 2HD1 ILE 15 HD12 ILE 15 5.494 14.956 -8.630 130 3HD1 ILE 15 HD13 ILE 15 5.685 13.267 -9.103 131 H LYS 16 H LYS 16 4.512 12.940 -3.411 132 HA LYS 16 HA LYS 16 4.700 14.311 -0.885 133 1HB LYS 16 HB2 LYS 16 3.879 16.205 -2.263 134 2HB LYS 16 HB3 LYS 16 2.482 15.237 -2.738 135 1HG LYS 16 HG2 LYS 16 1.408 15.809 -0.849 136 2HG LYS 16 HG3 LYS 16 2.732 15.168 0.124 137 1HD LYS 16 HD2 LYS 16 3.128 17.303 0.751 138 2HD LYS 16 HD3 LYS 16 3.756 17.553 -0.879 139 1HE LYS 16 HE2 LYS 16 1.160 17.855 -1.432 140 2HE LYS 16 HE3 LYS 16 1.105 18.313 0.271 141 1HZ LYS 16 HZ1 LYS 16 3.327 19.552 -0.859 142 2HZ LYS 16 HZ2 LYS 16 2.026 19.815 -1.920 143 3HZ LYS 16 HZ3 LYS 16 1.905 20.282 -0.291 144 H ALA 17 H ALA 17 3.813 12.889 0.525 145 HA ALA 17 HA ALA 17 2.091 10.736 -0.462 146 1HB ALA 17 HB1 ALA 17 3.034 11.419 2.340 147 2HB ALA 17 HB2 ALA 17 2.174 9.946 1.893 148 3HB ALA 17 HB3 ALA 17 3.785 10.255 1.248 149 H ILE 18 H ILE 18 -0.107 10.450 0.072 150 HA ILE 18 HA ILE 18 -1.425 12.845 1.288 151 HB ILE 18 HB ILE 18 -2.680 10.900 -0.665 152 1HG1 ILE 18 HG12 ILE 18 -1.862 13.662 -1.469 153 2HG1 ILE 18 HG13 ILE 18 -0.607 12.425 -1.391 154 1HG2 ILE 18 HG21 ILE 18 -3.839 12.725 1.020 155 2HG2 ILE 18 HG22 ILE 18 -3.605 13.694 -0.436 156 3HG2 ILE 18 HG23 ILE 18 -4.541 12.202 -0.511 157 1HD1 ILE 18 HD11 ILE 18 -3.189 11.810 -2.793 158 2HD1 ILE 18 HD12 ILE 18 -1.961 12.766 -3.623 159 3HD1 ILE 18 HD13 ILE 18 -1.584 11.135 -3.071 160 H ASP 19 H ASP 19 -1.686 9.305 0.891 161 HA ASP 19 HA ASP 19 -2.978 9.228 3.585 162 1HB ASP 19 HB2 ASP 19 -3.721 7.549 1.169 163 2HB ASP 19 HB3 ASP 19 -4.411 7.378 2.783 164 H GLY 20 H GLY 20 -3.081 6.516 3.957 165 1HA GLY 20 HA2 GLY 20 -0.273 5.874 4.384 166 2HA GLY 20 HA3 GLY 20 -1.644 4.847 4.809 167 H ASP 21 H ASP 21 -2.789 4.878 2.116 168 HA ASP 21 HA ASP 21 -0.787 3.101 0.786 169 1HB ASP 21 HB2 ASP 21 -3.793 3.033 0.948 170 2HB ASP 21 HB3 ASP 21 -2.955 2.235 -0.383 171 H THR 22 H THR 22 -1.881 6.159 0.584 172 HA THR 22 HA THR 22 -1.846 6.139 -2.408 173 HB THR 22 HB THR 22 -3.043 8.335 -0.713 174 HG1 THR 22 HG1 THR 22 -4.799 7.200 -0.498 175 1HG2 THR 22 HG21 THR 22 -2.714 7.747 -3.549 176 2HG2 THR 22 HG22 THR 22 -4.402 8.036 -3.128 177 3HG2 THR 22 HG23 THR 22 -3.182 9.257 -2.767 178 H VAL 23 H VAL 23 -0.157 7.211 -3.322 179 HA VAL 23 HA VAL 23 1.131 9.437 -1.867 180 HB VAL 23 HB VAL 23 3.407 8.360 -2.290 181 1HG1 VAL 23 HG11 VAL 23 1.706 8.246 -0.129 182 2HG1 VAL 23 HG12 VAL 23 2.091 6.543 -0.384 183 3HG1 VAL 23 HG13 VAL 23 3.385 7.709 -0.115 184 1HG2 VAL 23 HG21 VAL 23 1.536 6.123 -2.993 185 2HG2 VAL 23 HG22 VAL 23 3.067 6.575 -3.743 186 3HG2 VAL 23 HG23 VAL 23 3.059 5.730 -2.195 187 H LYS 24 H LYS 24 1.582 11.010 -3.333 188 HA LYS 24 HA LYS 24 1.326 10.420 -6.197 189 1HB LYS 24 HB2 LYS 24 2.215 13.065 -5.063 190 2HB LYS 24 HB3 LYS 24 1.267 12.748 -6.516 191 1HG LYS 24 HG2 LYS 24 -0.505 11.771 -4.894 192 2HG LYS 24 HG3 LYS 24 0.384 12.634 -3.637 193 1HD LYS 24 HD2 LYS 24 -0.920 14.401 -4.210 194 2HD LYS 24 HD3 LYS 24 0.170 14.554 -5.589 195 1HE LYS 24 HE2 LYS 24 -1.396 12.828 -6.737 196 2HE LYS 24 HE3 LYS 24 -2.550 13.264 -5.478 197 1HZ LYS 24 HZ1 LYS 24 -1.227 15.453 -6.872 198 2HZ LYS 24 HZ2 LYS 24 -2.372 14.571 -7.760 199 3HZ LYS 24 HZ3 LYS 24 -2.825 15.330 -6.309 200 H LEU 25 H LEU 25 3.068 9.606 -7.260 201 HA LEU 25 HA LEU 25 5.769 10.639 -6.486 202 1HB LEU 25 HB2 LEU 25 5.464 7.998 -7.862 203 2HB LEU 25 HB3 LEU 25 6.688 8.524 -6.706 204 HG LEU 25 HG LEU 25 3.790 8.083 -5.948 205 1HD1 LEU 25 HD11 LEU 25 6.097 6.189 -6.158 206 2HD1 LEU 25 HD12 LEU 25 4.998 6.012 -4.790 207 3HD1 LEU 25 HD13 LEU 25 4.379 5.900 -6.437 208 1HD2 LEU 25 HD21 LEU 25 6.364 8.659 -4.493 209 2HD2 LEU 25 HD22 LEU 25 4.792 9.439 -4.312 210 3HD2 LEU 25 HD23 LEU 25 5.051 7.817 -3.670 211 H MET 26 H MET 26 7.244 9.738 -8.608 212 HA MET 26 HA MET 26 5.871 10.922 -10.986 213 1HB MET 26 HB2 MET 26 7.858 12.197 -9.675 214 2HB MET 26 HB3 MET 26 8.824 11.199 -10.763 215 1HG MET 26 HG2 MET 26 8.126 12.319 -12.627 216 2HG MET 26 HG3 MET 26 6.493 12.546 -12.001 217 1HE MET 26 HE1 MET 26 9.640 13.604 -12.849 218 2HE MET 26 HE2 MET 26 8.876 15.115 -13.339 219 3HE MET 26 HE3 MET 26 10.079 15.121 -12.051 220 H TYR 27 H TYR 27 6.035 9.724 -12.830 221 HA TYR 27 HA TYR 27 7.995 7.468 -12.865 222 1HB TYR 27 HB2 TYR 27 5.637 6.710 -12.390 223 2HB TYR 27 HB3 TYR 27 5.167 7.369 -13.956 224 HD1 TYR 27 HD1 TYR 27 7.281 4.830 -12.264 225 HD2 TYR 27 HD2 TYR 27 5.709 6.242 -16.004 226 HE1 TYR 27 HE1 TYR 27 8.037 2.742 -13.370 227 HE2 TYR 27 HE2 TYR 27 6.467 4.154 -17.111 228 HH TYR 27 HH TYR 27 8.275 2.393 -16.671 229 H LYS 28 H LYS 28 9.341 7.731 -14.578 230 HA LYS 28 HA LYS 28 10.141 8.420 -16.673 231 1HB LYS 28 HB2 LYS 28 7.242 7.809 -17.192 232 2HB LYS 28 HB3 LYS 28 8.235 8.508 -18.472 233 1HG LYS 28 HG2 LYS 28 9.819 6.671 -18.316 234 2HG LYS 28 HG3 LYS 28 8.965 6.006 -16.924 235 1HD LYS 28 HD2 LYS 28 6.902 5.892 -18.460 236 2HD LYS 28 HD3 LYS 28 8.031 6.151 -19.792 237 1HE LYS 28 HE2 LYS 28 8.268 3.927 -17.743 238 2HE LYS 28 HE3 LYS 28 7.602 3.731 -19.364 239 1HZ LYS 28 HZ1 LYS 28 10.186 5.021 -19.259 240 2HZ LYS 28 HZ2 LYS 28 10.187 3.405 -18.742 241 3HZ LYS 28 HZ3 LYS 28 9.621 3.799 -20.295 242 H GLY 29 H GLY 29 8.778 10.365 -14.653 243 1HA GLY 29 HA2 GLY 29 8.973 12.754 -14.676 244 2HA GLY 29 HA3 GLY 29 8.993 12.710 -16.439 245 H GLN 30 H GLN 30 6.598 11.081 -14.394 246 HA GLN 30 HA GLN 30 4.579 13.080 -15.306 247 1HB GLN 30 HB2 GLN 30 4.588 10.947 -16.703 248 2HB GLN 30 HB3 GLN 30 4.055 10.102 -15.249 249 1HG GLN 30 HG2 GLN 30 1.939 10.779 -15.597 250 2HG GLN 30 HG3 GLN 30 2.457 12.466 -15.592 251 1HE2 GLN 30 HE21 GLN 30 0.490 12.139 -17.355 252 2HE2 GLN 30 HE22 GLN 30 1.047 11.983 -18.952 253 HA PRO 31 HA PRO 31 3.705 12.816 -10.916 254 1HB PRO 31 HB2 PRO 31 1.813 14.790 -10.916 255 2HB PRO 31 HB3 PRO 31 3.554 15.123 -10.977 256 1HG PRO 31 HG2 PRO 31 1.533 15.229 -13.176 257 2HG PRO 31 HG3 PRO 31 2.974 16.227 -12.923 258 1HD PRO 31 HD2 PRO 31 2.817 14.104 -14.720 259 2HD PRO 31 HD3 PRO 31 4.330 14.767 -14.064 260 H MET 32 H MET 32 2.521 10.975 -10.413 261 HA MET 32 HA MET 32 -0.386 11.026 -11.057 262 1HB MET 32 HB2 MET 32 1.562 9.227 -12.192 263 2HB MET 32 HB3 MET 32 0.430 8.320 -11.188 264 1HG MET 32 HG2 MET 32 -1.458 9.145 -12.405 265 2HG MET 32 HG3 MET 32 -0.476 10.354 -13.234 266 1HE MET 32 HE1 MET 32 0.255 6.783 -12.229 267 2HE MET 32 HE2 MET 32 -1.342 6.493 -12.929 268 3HE MET 32 HE3 MET 32 0.095 5.822 -13.696 269 H THR 33 H THR 33 -1.602 9.442 -9.678 270 HA THR 33 HA THR 33 -0.359 9.315 -6.976 271 HB THR 33 HB THR 33 -3.118 8.503 -7.002 272 HG1 THR 33 HG1 THR 33 -2.466 10.887 -8.384 273 1HG2 THR 33 HG21 THR 33 -1.351 10.078 -5.496 274 2HG2 THR 33 HG22 THR 33 -2.615 11.187 -6.028 275 3HG2 THR 33 HG23 THR 33 -3.041 9.736 -5.121 276 H PHE 34 H PHE 34 0.284 7.357 -6.194 277 HA PHE 34 HA PHE 34 -0.578 4.927 -7.698 278 1HB PHE 34 HB2 PHE 34 1.887 5.660 -6.154 279 2HB PHE 34 HB3 PHE 34 1.433 3.961 -6.281 280 HD1 PHE 34 HD1 PHE 34 2.449 6.969 -8.161 281 HD2 PHE 34 HD2 PHE 34 1.492 2.790 -8.410 282 HE1 PHE 34 HE1 PHE 34 3.385 6.893 -10.455 283 HE2 PHE 34 HE2 PHE 34 2.427 2.712 -10.706 284 HZ PHE 34 HZ PHE 34 3.373 4.764 -11.729 285 H ARG 35 H ARG 35 -1.361 3.113 -6.541 286 HA ARG 35 HA ARG 35 -2.020 3.626 -3.667 287 1HB ARG 35 HB2 ARG 35 -3.787 3.128 -5.910 288 2HB ARG 35 HB3 ARG 35 -3.956 1.859 -4.698 289 1HG ARG 35 HG2 ARG 35 -3.832 4.684 -3.735 290 2HG ARG 35 HG3 ARG 35 -5.321 4.146 -4.513 291 1HD ARG 35 HD2 ARG 35 -5.743 2.522 -2.886 292 2HD ARG 35 HD3 ARG 35 -4.053 2.440 -2.389 293 HE ARG 35 HE ARG 35 -4.495 4.187 -0.876 294 1HH1 ARG 35 HH11 ARG 35 -5.334 6.201 -2.910 295 2HH1 ARG 35 HH12 ARG 35 -6.974 6.527 -2.455 296 1HH2 ARG 35 HH21 ARG 35 -7.269 3.688 -0.484 297 2HH2 ARG 35 HH22 ARG 35 -8.070 5.102 -1.084 298 H LEU 36 H LEU 36 -1.746 1.856 -2.287 299 HA LEU 36 HA LEU 36 0.049 -0.221 -3.132 300 1HB LEU 36 HB2 LEU 36 -1.698 0.013 -0.666 301 2HB LEU 36 HB3 LEU 36 -0.441 -1.205 -0.881 302 HG LEU 36 HG LEU 36 -0.109 1.796 -0.708 303 1HD1 LEU 36 HD11 LEU 36 -0.065 -0.154 1.227 304 2HD1 LEU 36 HD12 LEU 36 1.639 -0.045 0.788 305 3HD1 LEU 36 HD13 LEU 36 0.778 1.391 1.344 306 1HD2 LEU 36 HD21 LEU 36 1.558 -0.252 -2.053 307 2HD2 LEU 36 HD22 LEU 36 1.506 1.494 -2.297 308 3HD2 LEU 36 HD23 LEU 36 2.428 0.819 -0.953 309 H LEU 37 H LEU 37 -0.379 -2.271 -3.885 310 HA LEU 37 HA LEU 37 -3.184 -2.878 -4.575 311 1HB LEU 37 HB2 LEU 37 -0.500 -3.813 -5.455 312 2HB LEU 37 HB3 LEU 37 -1.823 -4.972 -5.573 313 HG LEU 37 HG LEU 37 -2.089 -2.156 -6.632 314 1HD1 LEU 37 HD11 LEU 37 -0.664 -4.507 -7.781 315 2HD1 LEU 37 HD12 LEU 37 -1.708 -3.598 -8.873 316 3HD1 LEU 37 HD13 LEU 37 -0.383 -2.785 -8.041 317 1HD2 LEU 37 HD21 LEU 37 -3.700 -4.603 -6.538 318 2HD2 LEU 37 HD22 LEU 37 -4.200 -2.945 -6.876 319 3HD2 LEU 37 HD23 LEU 37 -3.550 -3.952 -8.170 320 H LEU 38 H LEU 38 -4.202 -4.872 -4.009 321 HA LEU 38 HA LEU 38 -4.762 -6.642 -2.588 322 1HB LEU 38 HB2 LEU 38 -1.843 -6.818 -1.848 323 2HB LEU 38 HB3 LEU 38 -3.033 -8.116 -1.936 324 HG LEU 38 HG LEU 38 -1.952 -6.534 -4.286 325 1HD1 LEU 38 HD11 LEU 38 -1.159 -9.018 -2.951 326 2HD1 LEU 38 HD12 LEU 38 -1.477 -9.241 -4.670 327 3HD1 LEU 38 HD13 LEU 38 -0.283 -8.056 -4.142 328 1HD2 LEU 38 HD21 LEU 38 -4.243 -8.401 -3.935 329 2HD2 LEU 38 HD22 LEU 38 -4.029 -7.090 -5.094 330 3HD2 LEU 38 HD23 LEU 38 -3.245 -8.646 -5.368 331 H VAL 39 H VAL 39 -4.153 -3.736 -1.539 332 HA VAL 39 HA VAL 39 -4.529 -4.525 1.301 333 HB VAL 39 HB VAL 39 -2.882 -2.999 2.126 334 1HG1 VAL 39 HG11 VAL 39 -2.170 -5.236 0.925 335 2HG1 VAL 39 HG12 VAL 39 -1.426 -4.138 -0.239 336 3HG1 VAL 39 HG13 VAL 39 -0.938 -4.091 1.455 337 1HG2 VAL 39 HG21 VAL 39 -3.378 -1.241 0.381 338 2HG2 VAL 39 HG22 VAL 39 -1.661 -1.457 0.718 339 3HG2 VAL 39 HG23 VAL 39 -2.367 -2.154 -0.740 340 H ASP 40 H ASP 40 -5.114 -2.423 2.594 341 HA ASP 40 HA ASP 40 -6.401 -0.315 1.028 342 1HB ASP 40 HB2 ASP 40 -8.126 -2.016 0.834 343 2HB ASP 40 HB3 ASP 40 -8.055 -2.339 2.568 344 H THR 41 H THR 41 -6.092 1.493 2.231 345 HA THR 41 HA THR 41 -5.559 1.193 5.128 346 HB THR 41 HB THR 41 -5.225 3.833 4.685 347 HG1 THR 41 HG1 THR 41 -5.858 3.606 2.495 348 1HG2 THR 41 HG21 THR 41 -3.454 1.454 4.352 349 2HG2 THR 41 HG22 THR 41 -2.815 3.026 3.869 350 3HG2 THR 41 HG23 THR 41 -3.362 2.767 5.526 351 HA PRO 42 HA PRO 42 -9.411 2.859 6.456 352 1HB PRO 42 HB2 PRO 42 -8.631 4.427 8.556 353 2HB PRO 42 HB3 PRO 42 -8.600 2.654 8.610 354 1HG PRO 42 HG2 PRO 42 -6.333 4.573 8.227 355 2HG PRO 42 HG3 PRO 42 -6.363 3.024 9.087 356 1HD PRO 42 HD2 PRO 42 -5.325 3.367 6.537 357 2HD PRO 42 HD3 PRO 42 -5.910 1.815 7.178 358 H GLU 43 H GLU 43 -6.869 5.070 5.546 359 HA GLU 43 HA GLU 43 -6.951 7.205 4.583 360 1HB GLU 43 HB2 GLU 43 -8.696 6.101 3.158 361 2HB GLU 43 HB3 GLU 43 -9.919 6.646 4.306 362 1HG GLU 43 HG2 GLU 43 -9.670 8.879 3.724 363 2HG GLU 43 HG3 GLU 43 -8.001 8.662 3.196 364 H THR 44 H THR 44 -7.684 9.416 5.066 365 HA THR 44 HA THR 44 -9.229 9.677 7.601 366 HB THR 44 HB THR 44 -7.560 11.314 8.435 367 HG1 THR 44 HG1 THR 44 -5.448 10.907 7.134 368 1HG2 THR 44 HG21 THR 44 -6.786 8.482 7.827 369 2HG2 THR 44 HG22 THR 44 -5.607 9.549 8.590 370 3HG2 THR 44 HG23 THR 44 -7.151 9.230 9.381 371 H LYS 45 H LYS 45 -10.890 10.401 6.037 372 HA LYS 45 HA LYS 45 -10.344 12.882 4.554 373 1HB LYS 45 HB2 LYS 45 -12.504 10.865 4.662 374 2HB LYS 45 HB3 LYS 45 -13.040 12.519 4.360 375 1HG LYS 45 HG2 LYS 45 -11.844 12.689 2.367 376 2HG LYS 45 HG3 LYS 45 -10.692 11.438 2.834 377 1HD LYS 45 HD2 LYS 45 -11.915 9.960 1.655 378 2HD LYS 45 HD3 LYS 45 -13.214 10.180 2.828 379 1HE LYS 45 HE2 LYS 45 -12.781 11.880 0.353 380 2HE LYS 45 HE3 LYS 45 -14.004 10.621 0.526 381 1HZ LYS 45 HZ1 LYS 45 -14.683 11.959 2.601 382 2HZ LYS 45 HZ2 LYS 45 -13.831 13.236 1.873 383 3HZ LYS 45 HZ3 LYS 45 -15.152 12.527 1.073 384 H HIS 46 H HIS 46 -12.492 11.882 7.240 385 HA HIS 46 HA HIS 46 -13.017 14.744 7.817 386 1HB HIS 46 HB2 HIS 46 -14.519 12.339 8.083 387 2HB HIS 46 HB3 HIS 46 -14.274 12.995 9.702 388 HD1 HIS 46 HD1 HIS 46 -16.978 13.060 7.872 389 HD2 HIS 46 HD2 HIS 46 -14.406 16.235 8.696 390 HE1 HIS 46 HE1 HIS 46 -18.330 15.177 7.550 391 HA PRO 47 HA PRO 47 -9.715 14.285 10.877 392 1HB PRO 47 HB2 PRO 47 -9.402 16.976 11.242 393 2HB PRO 47 HB3 PRO 47 -8.698 16.099 9.871 394 1HG PRO 47 HG2 PRO 47 -11.117 17.857 9.948 395 2HG PRO 47 HG3 PRO 47 -9.927 17.636 8.652 396 1HD PRO 47 HD2 PRO 47 -12.444 16.453 8.691 397 2HD PRO 47 HD3 PRO 47 -11.060 15.846 7.754 398 H LYS 48 H LYS 48 -12.214 16.841 11.272 399 HA LYS 48 HA LYS 48 -12.186 16.959 14.084 400 1HB LYS 48 HB2 LYS 48 -14.579 17.728 13.866 401 2HB LYS 48 HB3 LYS 48 -13.451 18.583 12.815 402 1HG LYS 48 HG2 LYS 48 -14.556 17.894 10.980 403 2HG LYS 48 HG3 LYS 48 -14.422 16.209 11.487 404 1HD LYS 48 HD2 LYS 48 -16.678 16.303 11.718 405 2HD LYS 48 HD3 LYS 48 -16.334 17.170 13.216 406 1HE LYS 48 HE2 LYS 48 -16.756 19.258 12.262 407 2HE LYS 48 HE3 LYS 48 -16.442 18.685 10.624 408 1HZ LYS 48 HZ1 LYS 48 -18.757 17.849 12.282 409 2HZ LYS 48 HZ2 LYS 48 -18.817 19.052 11.088 410 3HZ LYS 48 HZ3 LYS 48 -18.474 17.445 10.656 411 H LYS 49 H LYS 49 -13.646 14.571 11.955 412 HA LYS 49 HA LYS 49 -14.126 12.856 14.304 413 1HB LYS 49 HB2 LYS 49 -16.339 13.692 12.409 414 2HB LYS 49 HB3 LYS 49 -16.472 12.368 13.565 415 1HG LYS 49 HG2 LYS 49 -15.731 14.141 15.325 416 2HG LYS 49 HG3 LYS 49 -16.214 15.319 14.104 417 1HD LYS 49 HD2 LYS 49 -18.142 14.953 15.478 418 2HD LYS 49 HD3 LYS 49 -18.438 14.086 13.971 419 1HE LYS 49 HE2 LYS 49 -17.621 11.995 15.041 420 2HE LYS 49 HE3 LYS 49 -17.418 12.874 16.557 421 1HZ LYS 49 HZ1 LYS 49 -19.914 13.514 16.005 422 2HZ LYS 49 HZ2 LYS 49 -19.858 12.010 15.216 423 3HZ LYS 49 HZ3 LYS 49 -19.509 12.117 16.876 424 H GLY 50 H GLY 50 -15.955 11.905 11.584 425 1HA GLY 50 HA2 GLY 50 -15.617 10.183 10.033 426 2HA GLY 50 HA3 GLY 50 -13.981 10.824 9.865 427 H VAL 51 H VAL 51 -12.407 9.401 10.406 428 HA VAL 51 HA VAL 51 -13.126 7.079 12.107 429 HB VAL 51 HB VAL 51 -10.734 6.371 11.339 430 1HG1 VAL 51 HG11 VAL 51 -13.099 6.603 9.464 431 2HG1 VAL 51 HG12 VAL 51 -11.691 5.591 9.146 432 3HG1 VAL 51 HG13 VAL 51 -12.722 5.253 10.535 433 1HG2 VAL 51 HG21 VAL 51 -10.397 8.807 10.457 434 2HG2 VAL 51 HG22 VAL 51 -9.810 7.462 9.478 435 3HG2 VAL 51 HG23 VAL 51 -11.334 8.251 9.069 436 H GLU 52 H GLU 52 -11.571 6.421 13.809 437 HA GLU 52 HA GLU 52 -9.804 8.587 14.801 438 1HB GLU 52 HB2 GLU 52 -10.777 8.294 17.111 439 2HB GLU 52 HB3 GLU 52 -11.874 9.057 15.960 440 1HG GLU 52 HG2 GLU 52 -12.929 6.845 15.535 441 2HG GLU 52 HG3 GLU 52 -11.873 6.130 16.755 442 H LYS 53 H LYS 53 -11.013 5.266 15.224 443 HA LYS 53 HA LYS 53 -9.091 4.249 16.983 444 1HB LYS 53 HB2 LYS 53 -10.794 3.138 14.846 445 2HB LYS 53 HB3 LYS 53 -9.343 2.192 15.180 446 1HG LYS 53 HG2 LYS 53 -11.097 1.387 16.636 447 2HG LYS 53 HG3 LYS 53 -9.942 2.280 17.627 448 1HD LYS 53 HD2 LYS 53 -11.369 4.241 17.628 449 2HD LYS 53 HD3 LYS 53 -12.480 3.483 16.485 450 1HE LYS 53 HE2 LYS 53 -13.490 2.250 18.104 451 2HE LYS 53 HE3 LYS 53 -11.962 1.877 18.901 452 1HZ LYS 53 HZ1 LYS 53 -12.695 4.644 19.098 453 2HZ LYS 53 HZ2 LYS 53 -13.834 3.608 19.818 454 3HZ LYS 53 HZ3 LYS 53 -12.214 3.560 20.314 455 H TYR 54 H TYR 54 -8.817 3.824 13.439 456 HA TYR 54 HA TYR 54 -5.870 4.243 13.751 457 1HB TYR 54 HB2 TYR 54 -7.097 2.525 11.596 458 2HB TYR 54 HB3 TYR 54 -5.438 2.522 12.194 459 HD1 TYR 54 HD1 TYR 54 -5.032 1.788 14.623 460 HD2 TYR 54 HD2 TYR 54 -8.717 1.083 12.530 461 HE1 TYR 54 HE1 TYR 54 -5.621 0.017 16.256 462 HE2 TYR 54 HE2 TYR 54 -9.305 -0.687 14.163 463 HH TYR 54 HH TYR 54 -8.629 -1.168 16.678 464 H GLY 55 H GLY 55 -7.266 6.484 13.296 465 1HA GLY 55 HA2 GLY 55 -7.564 6.904 10.389 466 2HA GLY 55 HA3 GLY 55 -7.952 8.077 11.648 467 HA PRO 56 HA PRO 56 -4.057 10.022 11.039 468 1HB PRO 56 HB2 PRO 56 -3.581 10.989 13.548 469 2HB PRO 56 HB3 PRO 56 -4.843 11.639 12.489 470 1HG PRO 56 HG2 PRO 56 -5.111 9.868 14.871 471 2HG PRO 56 HG3 PRO 56 -6.237 11.079 14.234 472 1HD PRO 56 HD2 PRO 56 -6.451 8.295 13.877 473 2HD PRO 56 HD3 PRO 56 -7.324 9.530 12.946 474 H GLU 57 H GLU 57 -2.879 7.935 10.682 475 HA GLU 57 HA GLU 57 -0.618 7.662 12.423 476 1HB GLU 57 HB2 GLU 57 -2.930 6.216 13.243 477 2HB GLU 57 HB3 GLU 57 -1.772 5.043 12.616 478 1HG GLU 57 HG2 GLU 57 -0.600 7.144 14.332 479 2HG GLU 57 HG3 GLU 57 -1.702 6.042 15.158 480 H ALA 58 H ALA 58 -2.707 6.078 10.027 481 HA ALA 58 HA ALA 58 -0.566 4.456 8.922 482 1HB ALA 58 HB1 ALA 58 -3.358 5.179 8.052 483 2HB ALA 58 HB2 ALA 58 -2.268 4.348 6.941 484 3HB ALA 58 HB3 ALA 58 -2.705 3.595 8.475 485 H SER 59 H SER 59 -2.314 7.313 7.643 486 HA SER 59 HA SER 59 -0.754 7.801 5.382 487 1HB SER 59 HB2 SER 59 -1.334 10.217 5.714 488 2HB SER 59 HB3 SER 59 -2.722 9.143 5.868 489 HG SER 59 HG SER 59 -2.637 9.356 8.057 490 H ALA 60 H ALA 60 -0.094 8.814 8.735 491 HA ALA 60 HA ALA 60 2.339 10.213 8.111 492 1HB ALA 60 HB1 ALA 60 0.787 9.713 10.415 493 2HB ALA 60 HB2 ALA 60 2.386 9.053 10.757 494 3HB ALA 60 HB3 ALA 60 2.212 10.746 10.295 495 H PHE 61 H PHE 61 1.627 6.866 9.008 496 HA PHE 61 HA PHE 61 4.223 5.905 9.465 497 1HB PHE 61 HB2 PHE 61 2.186 4.526 9.726 498 2HB PHE 61 HB3 PHE 61 1.994 4.493 7.973 499 HD1 PHE 61 HD1 PHE 61 4.471 3.690 10.665 500 HD2 PHE 61 HD2 PHE 61 3.041 2.820 6.709 501 HE1 PHE 61 HE1 PHE 61 6.032 1.768 10.525 502 HE2 PHE 61 HE2 PHE 61 4.600 0.896 6.569 503 HZ PHE 61 HZ PHE 61 6.097 0.371 8.475 504 H THR 62 H THR 62 2.517 5.743 6.335 505 HA THR 62 HA THR 62 4.911 5.117 4.859 506 HB THR 62 HB THR 62 2.185 6.130 4.023 507 HG1 THR 62 HG1 THR 62 2.196 3.950 3.139 508 1HG2 THR 62 HG21 THR 62 4.561 5.361 2.308 509 2HG2 THR 62 HG22 THR 62 2.917 5.558 1.699 510 3HG2 THR 62 HG23 THR 62 3.779 6.939 2.377 511 H LYS 63 H LYS 63 3.644 8.061 6.105 512 HA LYS 63 HA LYS 63 4.712 9.880 4.156 513 1HB LYS 63 HB2 LYS 63 3.079 10.234 6.237 514 2HB LYS 63 HB3 LYS 63 4.592 10.670 7.033 515 1HG LYS 63 HG2 LYS 63 5.058 12.300 5.222 516 2HG LYS 63 HG3 LYS 63 3.516 11.888 4.470 517 1HD LYS 63 HD2 LYS 63 2.302 13.055 6.011 518 2HD LYS 63 HD3 LYS 63 3.375 12.610 7.339 519 1HE LYS 63 HE2 LYS 63 5.018 14.195 5.828 520 2HE LYS 63 HE3 LYS 63 3.454 14.968 5.568 521 1HZ LYS 63 HZ1 LYS 63 4.112 14.187 8.299 522 2HZ LYS 63 HZ2 LYS 63 4.968 15.505 7.653 523 3HZ LYS 63 HZ3 LYS 63 3.274 15.551 7.730 524 H LYS 64 H LYS 64 5.981 8.937 7.357 525 HA LYS 64 HA LYS 64 8.553 10.185 6.857 526 1HB LYS 64 HB2 LYS 64 7.409 8.420 9.000 527 2HB LYS 64 HB3 LYS 64 9.156 8.658 8.918 528 1HG LYS 64 HG2 LYS 64 8.981 10.726 9.792 529 2HG LYS 64 HG3 LYS 64 7.771 11.183 8.592 530 1HD LYS 64 HD2 LYS 64 6.073 10.897 10.055 531 2HD LYS 64 HD3 LYS 64 6.703 9.338 10.590 532 1HE LYS 64 HE2 LYS 64 7.400 10.301 12.500 533 2HE LYS 64 HE3 LYS 64 8.483 11.329 11.561 534 1HZ LYS 64 HZ1 LYS 64 5.610 11.951 11.912 535 2HZ LYS 64 HZ2 LYS 64 6.799 12.501 12.996 536 3HZ LYS 64 HZ3 LYS 64 6.848 12.981 11.370 537 H MET 65 H MET 65 7.298 6.867 6.667 538 HA MET 65 HA MET 65 9.730 5.496 6.269 539 1HB MET 65 HB2 MET 65 7.560 4.347 6.515 540 2HB MET 65 HB3 MET 65 7.059 4.960 4.938 541 1HG MET 65 HG2 MET 65 8.590 3.612 3.783 542 2HG MET 65 HG3 MET 65 9.616 3.397 5.202 543 1HE MET 65 HE1 MET 65 9.954 1.615 6.057 544 2HE MET 65 HE2 MET 65 8.771 1.456 7.355 545 3HE MET 65 HE3 MET 65 8.999 0.140 6.195 546 H VAL 66 H VAL 66 7.524 6.438 3.629 547 HA VAL 66 HA VAL 66 9.481 6.148 1.576 548 HB VAL 66 HB VAL 66 7.915 7.347 0.152 549 1HG1 VAL 66 HG11 VAL 66 6.772 5.468 2.208 550 2HG1 VAL 66 HG12 VAL 66 5.734 6.151 0.957 551 3HG1 VAL 66 HG13 VAL 66 7.125 5.166 0.507 552 1HG2 VAL 66 HG21 VAL 66 7.075 8.462 2.776 553 2HG2 VAL 66 HG22 VAL 66 7.104 9.227 1.187 554 3HG2 VAL 66 HG23 VAL 66 5.780 8.146 1.621 555 H GLU 67 H GLU 67 8.741 8.808 3.745 556 HA GLU 67 HA GLU 67 9.992 10.924 2.324 557 1HB GLU 67 HB2 GLU 67 9.334 10.369 5.172 558 2HB GLU 67 HB3 GLU 67 10.548 11.614 4.871 559 1HG GLU 67 HG2 GLU 67 8.217 11.802 3.094 560 2HG GLU 67 HG3 GLU 67 7.819 12.018 4.798 561 H ASN 68 H ASN 68 11.343 8.378 4.361 562 HA ASN 68 HA ASN 68 14.071 9.478 3.891 563 1HB ASN 68 HB2 ASN 68 12.935 7.479 5.842 564 2HB ASN 68 HB3 ASN 68 14.669 7.547 5.525 565 1HD2 ASN 68 HD21 ASN 68 11.959 9.808 6.312 566 2HD2 ASN 68 HD22 ASN 68 12.894 10.804 7.320 567 H ALA 69 H ALA 69 11.927 7.307 2.522 568 HA ALA 69 HA ALA 69 13.417 5.009 1.925 569 1HB ALA 69 HB1 ALA 69 11.373 6.571 0.357 570 2HB ALA 69 HB2 ALA 69 12.145 5.150 -0.347 571 3HB ALA 69 HB3 ALA 69 11.200 4.998 1.135 572 H LYS 70 H LYS 70 15.507 5.009 1.242 573 HA LYS 70 HA LYS 70 16.720 7.184 -0.192 574 1HB LYS 70 HB2 LYS 70 17.682 4.312 -0.052 575 2HB LYS 70 HB3 LYS 70 18.661 5.745 -0.374 576 1HG LYS 70 HG2 LYS 70 17.448 6.419 1.997 577 2HG LYS 70 HG3 LYS 70 17.681 4.681 2.192 578 1HD LYS 70 HD2 LYS 70 19.972 4.846 2.179 579 2HD LYS 70 HD3 LYS 70 19.971 6.222 1.075 580 1HE LYS 70 HE2 LYS 70 18.895 7.512 3.076 581 2HE LYS 70 HE3 LYS 70 19.541 6.194 4.053 582 1HZ LYS 70 HZ1 LYS 70 21.297 7.502 2.102 583 2HZ LYS 70 HZ2 LYS 70 20.967 8.303 3.559 584 3HZ LYS 70 HZ3 LYS 70 21.686 6.763 3.581 585 H LYS 71 H LYS 71 15.332 4.091 -1.215 586 HA LYS 71 HA LYS 71 15.338 5.135 -4.006 587 1HB LYS 71 HB2 LYS 71 16.441 2.523 -3.007 588 2HB LYS 71 HB3 LYS 71 15.758 2.621 -4.631 589 1HG LYS 71 HG2 LYS 71 17.815 4.605 -3.654 590 2HG LYS 71 HG3 LYS 71 18.282 3.078 -4.404 591 1HD LYS 71 HD2 LYS 71 16.413 3.961 -6.182 592 2HD LYS 71 HD3 LYS 71 17.091 5.493 -5.630 593 1HE LYS 71 HE2 LYS 71 19.330 4.789 -6.215 594 2HE LYS 71 HE3 LYS 71 18.769 3.158 -6.585 595 1HZ LYS 71 HZ1 LYS 71 17.200 4.856 -8.085 596 2HZ LYS 71 HZ2 LYS 71 18.777 5.464 -8.236 597 3HZ LYS 71 HZ3 LYS 71 18.447 3.850 -8.649 598 H ILE 72 H ILE 72 13.290 5.085 -4.774 599 HA ILE 72 HA ILE 72 11.392 3.104 -3.578 600 HB ILE 72 HB ILE 72 10.775 5.758 -4.914 601 1HG1 ILE 72 HG12 ILE 72 9.994 5.704 -2.186 602 2HG1 ILE 72 HG13 ILE 72 11.656 5.112 -2.245 603 1HG2 ILE 72 HG21 ILE 72 9.085 3.756 -4.904 604 2HG2 ILE 72 HG22 ILE 72 8.909 4.145 -3.192 605 3HG2 ILE 72 HG23 ILE 72 8.523 5.354 -4.417 606 1HD1 ILE 72 HD11 ILE 72 10.757 7.625 -3.673 607 2HD1 ILE 72 HD12 ILE 72 11.418 7.635 -2.038 608 3HD1 ILE 72 HD13 ILE 72 12.411 7.083 -3.386 609 H GLU 73 H GLU 73 10.883 1.474 -4.967 610 HA GLU 73 HA GLU 73 10.955 2.088 -7.897 611 1HB GLU 73 HB2 GLU 73 11.671 -0.480 -6.453 612 2HB GLU 73 HB3 GLU 73 11.548 -0.329 -8.206 613 1HG GLU 73 HG2 GLU 73 13.218 1.737 -6.924 614 2HG GLU 73 HG3 GLU 73 13.850 0.095 -6.779 615 H VAL 74 H VAL 74 9.049 1.781 -8.941 616 HA VAL 74 HA VAL 74 6.814 0.527 -7.462 617 HB VAL 74 HB VAL 74 5.460 1.363 -9.414 618 1HG1 VAL 74 HG11 VAL 74 6.933 2.927 -7.439 619 2HG1 VAL 74 HG12 VAL 74 6.507 3.888 -8.855 620 3HG1 VAL 74 HG13 VAL 74 5.247 3.062 -7.939 621 1HG2 VAL 74 HG21 VAL 74 8.074 1.599 -10.547 622 2HG2 VAL 74 HG22 VAL 74 6.523 1.946 -11.311 623 3HG2 VAL 74 HG23 VAL 74 7.381 3.217 -10.441 624 H GLU 75 H GLU 75 5.780 -1.364 -8.177 625 HA GLU 75 HA GLU 75 7.108 -2.764 -10.465 626 1HB GLU 75 HB2 GLU 75 7.708 -3.860 -8.376 627 2HB GLU 75 HB3 GLU 75 6.014 -3.928 -7.887 628 1HG GLU 75 HG2 GLU 75 5.504 -5.618 -9.385 629 2HG GLU 75 HG3 GLU 75 6.776 -5.144 -10.513 630 H PHE 76 H PHE 76 5.463 -1.972 -11.914 631 HA PHE 76 HA PHE 76 2.672 -2.138 -11.510 632 1HB PHE 76 HB2 PHE 76 4.360 -2.347 -14.012 633 2HB PHE 76 HB3 PHE 76 2.597 -2.367 -14.065 634 HD1 PHE 76 HD1 PHE 76 1.469 -0.456 -12.531 635 HD2 PHE 76 HD2 PHE 76 5.402 -0.280 -14.252 636 HE1 PHE 76 HE1 PHE 76 1.434 2.019 -12.359 637 HE2 PHE 76 HE2 PHE 76 5.366 2.194 -14.079 638 HZ PHE 76 HZ PHE 76 3.383 3.344 -13.133 639 H ASP 77 H ASP 77 1.286 -3.853 -11.410 640 HA ASP 77 HA ASP 77 2.310 -6.552 -11.394 641 1HB ASP 77 HB2 ASP 77 -0.052 -5.241 -10.568 642 2HB ASP 77 HB3 ASP 77 -0.557 -6.452 -11.748 643 H LYS 78 H LYS 78 0.666 -8.160 -12.768 644 HA LYS 78 HA LYS 78 1.344 -7.529 -15.580 645 1HB LYS 78 HB2 LYS 78 0.794 -9.877 -16.012 646 2HB LYS 78 HB3 LYS 78 1.888 -9.769 -14.633 647 1HG LYS 78 HG2 LYS 78 -0.952 -9.591 -13.895 648 2HG LYS 78 HG3 LYS 78 -0.510 -11.130 -14.637 649 1HD LYS 78 HD2 LYS 78 1.432 -10.136 -12.650 650 2HD LYS 78 HD3 LYS 78 -0.151 -10.537 -11.985 651 1HE LYS 78 HE2 LYS 78 1.096 -12.565 -11.896 652 2HE LYS 78 HE3 LYS 78 0.027 -12.736 -13.288 653 1HZ LYS 78 HZ1 LYS 78 2.733 -11.614 -13.612 654 2HZ LYS 78 HZ2 LYS 78 2.505 -13.297 -13.553 655 3HZ LYS 78 HZ3 LYS 78 1.747 -12.382 -14.764 656 H GLY 79 H GLY 79 -1.348 -7.406 -13.469 657 1HA GLY 79 HA2 GLY 79 -3.408 -7.853 -15.473 658 2HA GLY 79 HA3 GLY 79 -3.661 -7.170 -13.867 659 H GLN 80 H GLN 80 -4.559 -5.179 -14.083 660 HA GLN 80 HA GLN 80 -4.004 -3.540 -16.456 661 1HB GLN 80 HB2 GLN 80 -5.593 -2.764 -13.997 662 2HB GLN 80 HB3 GLN 80 -5.702 -2.064 -15.612 663 1HG GLN 80 HG2 GLN 80 -6.208 -4.627 -16.243 664 2HG GLN 80 HG3 GLN 80 -6.804 -4.633 -14.583 665 1HE2 GLN 80 HE21 GLN 80 -7.831 -4.105 -17.709 666 2HE2 GLN 80 HE22 GLN 80 -9.128 -3.054 -17.402 667 H ARG 81 H ARG 81 -3.447 -1.153 -16.053 668 HA ARG 81 HA ARG 81 -1.354 -0.991 -13.920 669 1HB ARG 81 HB2 ARG 81 -1.410 -0.036 -16.765 670 2HB ARG 81 HB3 ARG 81 -0.454 0.854 -15.578 671 1HG ARG 81 HG2 ARG 81 0.682 -1.275 -14.951 672 2HG ARG 81 HG3 ARG 81 -0.213 -2.097 -16.230 673 1HD ARG 81 HD2 ARG 81 1.802 -1.567 -17.301 674 2HD ARG 81 HD3 ARG 81 0.762 -0.221 -17.769 675 HE ARG 81 HE ARG 81 2.074 0.515 -15.365 676 1HH1 ARG 81 HH11 ARG 81 3.163 -0.720 -18.362 677 2HH1 ARG 81 HH12 ARG 81 4.388 0.485 -18.579 678 1HH2 ARG 81 HH21 ARG 81 3.489 2.290 -15.759 679 2HH2 ARG 81 HH22 ARG 81 4.571 2.190 -17.107 680 H THR 82 H THR 82 -4.294 0.256 -15.057 681 HA THR 82 HA THR 82 -4.116 2.478 -13.101 682 HB THR 82 HB THR 82 -4.950 4.122 -14.678 683 HG1 THR 82 HG1 THR 82 -5.246 1.840 -16.255 684 1HG2 THR 82 HG21 THR 82 -2.445 3.435 -14.620 685 2HG2 THR 82 HG22 THR 82 -2.768 2.703 -16.191 686 3HG2 THR 82 HG23 THR 82 -3.004 4.435 -15.962 687 H ASP 83 H ASP 83 -6.098 2.849 -12.088 688 HA ASP 83 HA ASP 83 -8.230 0.902 -12.712 689 1HB ASP 83 HB2 ASP 83 -7.344 2.363 -10.367 690 2HB ASP 83 HB3 ASP 83 -9.079 2.568 -10.614 691 H LYS 84 H LYS 84 -10.488 2.319 -11.911 692 HA LYS 84 HA LYS 84 -11.082 3.824 -14.316 693 1HB LYS 84 HB2 LYS 84 -13.293 4.153 -13.288 694 2HB LYS 84 HB3 LYS 84 -12.790 2.469 -13.136 695 1HG LYS 84 HG2 LYS 84 -11.808 3.208 -10.840 696 2HG LYS 84 HG3 LYS 84 -12.865 4.610 -11.017 697 1HD LYS 84 HD2 LYS 84 -14.614 3.380 -10.325 698 2HD LYS 84 HD3 LYS 84 -14.380 2.283 -11.686 699 1HE LYS 84 HE2 LYS 84 -13.536 0.686 -10.339 700 2HE LYS 84 HE3 LYS 84 -12.378 1.818 -9.640 701 1HZ LYS 84 HZ1 LYS 84 -15.235 1.753 -8.858 702 2HZ LYS 84 HZ2 LYS 84 -14.042 0.842 -8.061 703 3HZ LYS 84 HZ3 LYS 84 -13.957 2.538 -8.067 704 H TYR 85 H TYR 85 -9.708 4.640 -11.293 705 HA TYR 85 HA TYR 85 -10.538 7.480 -11.521 706 1HB TYR 85 HB2 TYR 85 -8.864 6.107 -9.395 707 2HB TYR 85 HB3 TYR 85 -9.501 7.751 -9.320 708 HD1 TYR 85 HD1 TYR 85 -12.054 8.058 -9.489 709 HD2 TYR 85 HD2 TYR 85 -10.177 4.283 -8.667 710 HE1 TYR 85 HE1 TYR 85 -14.192 7.194 -8.577 711 HE2 TYR 85 HE2 TYR 85 -12.316 3.418 -7.754 712 HH TYR 85 HH TYR 85 -15.172 4.598 -8.336 713 H GLY 86 H GLY 86 -8.219 5.590 -12.871 714 1HA GLY 86 HA2 GLY 86 -6.350 6.274 -14.150 715 2HA GLY 86 HA3 GLY 86 -6.544 7.902 -13.502 716 H ARG 87 H ARG 87 -6.559 5.642 -10.996 717 HA ARG 87 HA ARG 87 -3.962 6.570 -10.052 718 1HB ARG 87 HB2 ARG 87 -5.804 4.415 -8.967 719 2HB ARG 87 HB3 ARG 87 -4.403 5.080 -8.126 720 1HG ARG 87 HG2 ARG 87 -5.872 7.326 -8.922 721 2HG ARG 87 HG3 ARG 87 -7.087 6.174 -8.366 722 1HD ARG 87 HD2 ARG 87 -4.659 6.410 -6.677 723 2HD ARG 87 HD3 ARG 87 -5.733 7.810 -6.687 724 HE ARG 87 HE ARG 87 -6.939 6.480 -5.145 725 1HH1 ARG 87 HH11 ARG 87 -5.137 4.180 -6.664 726 2HH1 ARG 87 HH12 ARG 87 -6.392 2.993 -6.807 727 1HH2 ARG 87 HH21 ARG 87 -8.918 5.167 -5.850 728 2HH2 ARG 87 HH22 ARG 87 -8.533 3.552 -6.344 729 H GLY 88 H GLY 88 -2.024 5.418 -10.045 730 1HA GLY 88 HA2 GLY 88 -1.835 3.184 -11.928 731 2HA GLY 88 HA3 GLY 88 -0.487 3.935 -11.075 732 H LEU 89 H LEU 89 -1.613 1.032 -11.389 733 HA LEU 89 HA LEU 89 -1.714 0.389 -8.475 734 1HB LEU 89 HB2 LEU 89 -2.419 -1.470 -10.752 735 2HB LEU 89 HB3 LEU 89 -2.842 -1.631 -9.047 736 HG LEU 89 HG LEU 89 -3.740 0.793 -10.578 737 1HD1 LEU 89 HD11 LEU 89 -4.387 -1.830 -11.360 738 2HD1 LEU 89 HD12 LEU 89 -5.775 -1.267 -10.430 739 3HD1 LEU 89 HD13 LEU 89 -5.224 -0.351 -11.832 740 1HD2 LEU 89 HD21 LEU 89 -4.482 -0.697 -8.084 741 2HD2 LEU 89 HD22 LEU 89 -4.279 1.038 -8.330 742 3HD2 LEU 89 HD23 LEU 89 -5.732 0.228 -8.917 743 H ALA 90 H ALA 90 0.155 -0.365 -7.648 744 HA ALA 90 HA ALA 90 1.678 -2.458 -8.918 745 1HB ALA 90 HB1 ALA 90 2.878 0.328 -8.917 746 2HB ALA 90 HB2 ALA 90 3.771 -1.152 -9.267 747 3HB ALA 90 HB3 ALA 90 2.471 -0.632 -10.340 748 H TYR 91 H TYR 91 3.695 -2.933 -7.589 749 HA TYR 91 HA TYR 91 3.110 -2.303 -4.744 750 1HB TYR 91 HB2 TYR 91 5.025 -4.339 -5.926 751 2HB TYR 91 HB3 TYR 91 4.572 -4.198 -4.227 752 HD1 TYR 91 HD1 TYR 91 2.340 -4.844 -3.453 753 HD2 TYR 91 HD2 TYR 91 3.458 -5.210 -7.584 754 HE1 TYR 91 HE1 TYR 91 0.353 -6.272 -3.864 755 HE2 TYR 91 HE2 TYR 91 1.473 -6.639 -7.994 756 HH TYR 91 HH TYR 91 -0.024 -8.138 -6.634 757 H ILE 92 H ILE 92 4.322 -0.774 -3.746 758 HA ILE 92 HA ILE 92 6.750 0.227 -5.100 759 HB ILE 92 HB ILE 92 5.239 1.200 -2.657 760 1HG1 ILE 92 HG12 ILE 92 5.480 2.307 -5.475 761 2HG1 ILE 92 HG13 ILE 92 4.073 1.455 -4.838 762 1HG2 ILE 92 HG21 ILE 92 7.912 1.766 -3.572 763 2HG2 ILE 92 HG22 ILE 92 6.913 3.207 -3.760 764 3HG2 ILE 92 HG23 ILE 92 7.060 2.436 -2.181 765 1HD1 ILE 92 HD11 ILE 92 5.194 3.924 -3.501 766 2HD1 ILE 92 HD12 ILE 92 3.976 4.017 -4.773 767 3HD1 ILE 92 HD13 ILE 92 3.612 3.181 -3.263 768 H TYR 93 H TYR 93 8.823 0.106 -4.199 769 HA TYR 93 HA TYR 93 9.064 -1.515 -1.698 770 1HB TYR 93 HB2 TYR 93 10.688 -1.702 -4.248 771 2HB TYR 93 HB3 TYR 93 11.169 -2.461 -2.730 772 HD1 TYR 93 HD1 TYR 93 8.555 -2.381 -5.364 773 HD2 TYR 93 HD2 TYR 93 10.093 -4.444 -1.925 774 HE1 TYR 93 HE1 TYR 93 7.057 -4.298 -5.844 775 HE2 TYR 93 HE2 TYR 93 8.595 -6.361 -2.406 776 HH TYR 93 HH TYR 93 7.330 -7.321 -4.122 777 H ALA 94 H ALA 94 10.077 -0.360 -0.146 778 HA ALA 94 HA ALA 94 11.968 1.792 -0.997 779 1HB ALA 94 HB1 ALA 94 10.039 1.538 1.288 780 2HB ALA 94 HB2 ALA 94 11.494 2.511 1.505 781 3HB ALA 94 HB3 ALA 94 10.343 2.918 0.233 782 H ASP 95 H ASP 95 14.078 1.470 -0.474 783 HA ASP 95 HA ASP 95 15.984 0.608 0.589 784 1HB ASP 95 HB2 ASP 95 13.890 0.534 2.665 785 2HB ASP 95 HB3 ASP 95 15.212 -0.607 2.912 786 H GLY 96 H GLY 96 14.215 -1.031 -1.193 787 1HA GLY 96 HA2 GLY 96 14.441 -3.213 -2.062 788 2HA GLY 96 HA3 GLY 96 15.568 -3.571 -0.755 789 H LYS 97 H LYS 97 12.637 -2.235 0.369 790 HA LYS 97 HA LYS 97 11.638 -4.986 1.002 791 1HB LYS 97 HB2 LYS 97 12.588 -3.326 2.872 792 2HB LYS 97 HB3 LYS 97 10.949 -2.683 2.773 793 1HG LYS 97 HG2 LYS 97 10.055 -4.979 3.114 794 2HG LYS 97 HG3 LYS 97 11.706 -5.573 3.297 795 1HD LYS 97 HD2 LYS 97 11.484 -5.116 5.499 796 2HD LYS 97 HD3 LYS 97 11.594 -3.415 5.047 797 1HE LYS 97 HE2 LYS 97 9.583 -3.634 6.330 798 2HE LYS 97 HE3 LYS 97 9.078 -3.489 4.646 799 1HZ LYS 97 HZ1 LYS 97 9.596 -6.197 5.361 800 2HZ LYS 97 HZ2 LYS 97 8.423 -5.508 6.379 801 3HZ LYS 97 HZ3 LYS 97 8.196 -5.509 4.696 802 H MET 98 H MET 98 9.295 -5.185 1.141 803 HA MET 98 HA MET 98 7.939 -3.458 -0.807 804 1HB MET 98 HB2 MET 98 7.550 -5.905 -0.788 805 2HB MET 98 HB3 MET 98 6.876 -5.775 0.838 806 1HG MET 98 HG2 MET 98 4.874 -5.171 0.010 807 2HG MET 98 HG3 MET 98 5.610 -3.845 -0.891 808 1HE MET 98 HE1 MET 98 5.677 -7.545 -0.598 809 2HE MET 98 HE2 MET 98 5.492 -8.213 -2.225 810 3HE MET 98 HE3 MET 98 7.028 -7.506 -1.728 811 H VAL 99 H VAL 99 7.062 -1.561 -0.141 812 HA VAL 99 HA VAL 99 6.660 -0.821 2.578 813 HB VAL 99 HB VAL 99 5.315 0.251 0.078 814 1HG1 VAL 99 HG11 VAL 99 5.330 1.108 2.953 815 2HG1 VAL 99 HG12 VAL 99 5.280 2.341 1.693 816 3HG1 VAL 99 HG13 VAL 99 4.004 1.126 1.790 817 1HG2 VAL 99 HG21 VAL 99 8.000 0.454 1.158 818 2HG2 VAL 99 HG22 VAL 99 7.371 1.066 -0.372 819 3HG2 VAL 99 HG23 VAL 99 7.235 2.041 1.090 820 H ASN 100 H ASN 100 4.485 -2.295 0.204 821 HA ASN 100 HA ASN 100 2.071 -2.068 1.701 822 1HB ASN 100 HB2 ASN 100 2.838 -4.365 -0.123 823 2HB ASN 100 HB3 ASN 100 1.209 -3.806 0.263 824 1HD2 ASN 100 HD21 ASN 100 1.273 -3.671 -2.291 825 2HD2 ASN 100 HD22 ASN 100 1.767 -2.181 -2.937 826 H GLU 101 H GLU 101 4.674 -4.472 1.780 827 HA GLU 101 HA GLU 101 3.298 -6.215 3.653 828 1HB GLU 101 HB2 GLU 101 5.427 -6.576 2.026 829 2HB GLU 101 HB3 GLU 101 6.270 -6.235 3.537 830 1HG GLU 101 HG2 GLU 101 4.746 -7.965 4.627 831 2HG GLU 101 HG3 GLU 101 4.251 -8.422 2.998 832 H ALA 102 H ALA 102 5.261 -3.353 3.913 833 HA ALA 102 HA ALA 102 6.032 -3.731 6.679 834 1HB ALA 102 HB1 ALA 102 6.732 -1.954 4.685 835 2HB ALA 102 HB2 ALA 102 5.769 -0.951 5.770 836 3HB ALA 102 HB3 ALA 102 7.187 -1.802 6.382 837 H LEU 103 H LEU 103 3.432 -1.923 5.062 838 HA LEU 103 HA LEU 103 2.279 -0.863 7.462 839 1HB LEU 103 HB2 LEU 103 1.012 -1.489 4.777 840 2HB LEU 103 HB3 LEU 103 0.234 -0.556 6.056 841 HG LEU 103 HG LEU 103 2.857 0.510 5.648 842 1HD1 LEU 103 HD11 LEU 103 2.081 -0.683 3.316 843 2HD1 LEU 103 HD12 LEU 103 1.382 0.924 3.120 844 3HD1 LEU 103 HD13 LEU 103 3.114 0.743 3.397 845 1HD2 LEU 103 HD21 LEU 103 0.004 1.388 5.421 846 2HD2 LEU 103 HD22 LEU 103 1.291 2.018 6.449 847 3HD2 LEU 103 HD23 LEU 103 1.249 2.433 4.735 848 H VAL 104 H VAL 104 1.611 -3.830 5.598 849 HA VAL 104 HA VAL 104 -0.538 -4.715 7.298 850 HB VAL 104 HB VAL 104 1.333 -6.264 5.481 851 1HG1 VAL 104 HG11 VAL 104 -0.986 -7.080 7.198 852 2HG1 VAL 104 HG12 VAL 104 -0.767 -7.868 5.636 853 3HG1 VAL 104 HG13 VAL 104 0.509 -7.950 6.851 854 1HG2 VAL 104 HG21 VAL 104 -0.251 -4.490 4.517 855 2HG2 VAL 104 HG22 VAL 104 -0.421 -6.121 3.865 856 3HG2 VAL 104 HG23 VAL 104 -1.573 -5.524 5.061 857 H ARG 105 H ARG 105 2.959 -4.998 7.448 858 HA ARG 105 HA ARG 105 2.997 -7.043 9.498 859 1HB ARG 105 HB2 ARG 105 4.963 -6.650 8.097 860 2HB ARG 105 HB3 ARG 105 5.082 -4.993 8.690 861 1HG ARG 105 HG2 ARG 105 5.025 -7.162 10.734 862 2HG ARG 105 HG3 ARG 105 6.499 -6.996 9.780 863 1HD ARG 105 HD2 ARG 105 5.839 -4.372 10.444 864 2HD ARG 105 HD3 ARG 105 5.475 -5.283 11.909 865 HE ARG 105 HE ARG 105 7.794 -5.801 12.121 866 1HH1 ARG 105 HH11 ARG 105 7.428 -3.126 10.265 867 2HH1 ARG 105 HH12 ARG 105 8.882 -3.303 9.341 868 1HH2 ARG 105 HH21 ARG 105 9.507 -6.530 10.447 869 2HH2 ARG 105 HH22 ARG 105 10.059 -5.231 9.444 870 H GLN 106 H GLN 106 2.753 -3.541 9.484 871 HA GLN 106 HA GLN 106 3.209 -3.346 12.382 872 1HB GLN 106 HB2 GLN 106 3.026 -1.511 10.130 873 2HB GLN 106 HB3 GLN 106 2.058 -0.953 11.494 874 1HG GLN 106 HG2 GLN 106 4.737 -2.002 12.194 875 2HG GLN 106 HG3 GLN 106 4.734 -0.502 11.263 876 1HE2 GLN 106 HE21 GLN 106 5.484 0.660 13.231 877 2HE2 GLN 106 HE22 GLN 106 4.388 1.022 14.475 878 H GLY 107 H GLY 107 0.570 -3.942 10.266 879 1HA GLY 107 HA2 GLY 107 -1.629 -4.568 10.914 880 2HA GLY 107 HA3 GLY 107 -1.266 -4.037 12.556 881 H LEU 108 H LEU 108 -0.634 -1.971 9.800 882 HA LEU 108 HA LEU 108 -2.730 -0.118 10.830 883 1HB LEU 108 HB2 LEU 108 -0.241 0.316 9.166 884 2HB LEU 108 HB3 LEU 108 -1.463 1.569 9.392 885 HG LEU 108 HG LEU 108 -0.214 0.133 11.739 886 1HD1 LEU 108 HD11 LEU 108 1.283 1.592 9.975 887 2HD1 LEU 108 HD12 LEU 108 0.742 2.852 11.082 888 3HD1 LEU 108 HD13 LEU 108 1.637 1.462 11.697 889 1HD2 LEU 108 HD21 LEU 108 -2.370 1.819 11.553 890 2HD2 LEU 108 HD22 LEU 108 -1.381 1.628 13.001 891 3HD2 LEU 108 HD23 LEU 108 -1.064 2.958 11.886 892 H ALA 109 H ALA 109 -1.822 -2.043 8.078 893 HA ALA 109 HA ALA 109 -4.191 -0.947 6.615 894 1HB ALA 109 HB1 ALA 109 -1.642 -0.671 5.734 895 2HB ALA 109 HB2 ALA 109 -2.036 -2.242 5.038 896 3HB ALA 109 HB3 ALA 109 -3.023 -0.834 4.649 897 H LYS 110 H LYS 110 -5.446 -2.527 5.463 898 HA LYS 110 HA LYS 110 -4.952 -5.321 6.405 899 1HB LYS 110 HB2 LYS 110 -7.543 -4.075 5.436 900 2HB LYS 110 HB3 LYS 110 -7.352 -5.686 6.128 901 1HG LYS 110 HG2 LYS 110 -6.733 -4.780 8.271 902 2HG LYS 110 HG3 LYS 110 -6.625 -3.148 7.610 903 1HD LYS 110 HD2 LYS 110 -8.749 -2.989 8.454 904 2HD LYS 110 HD3 LYS 110 -9.163 -3.734 6.910 905 1HE LYS 110 HE2 LYS 110 -9.169 -5.946 7.923 906 2HE LYS 110 HE3 LYS 110 -8.604 -5.282 9.455 907 1HZ LYS 110 HZ1 LYS 110 -11.050 -4.183 8.277 908 2HZ LYS 110 HZ2 LYS 110 -11.133 -5.708 9.023 909 3HZ LYS 110 HZ3 LYS 110 -10.617 -4.352 9.908 910 H VAL 111 H VAL 111 -5.212 -7.041 4.864 911 HA VAL 111 HA VAL 111 -4.432 -6.294 2.147 912 HB VAL 111 HB VAL 111 -4.955 -8.934 3.528 913 1HG1 VAL 111 HG11 VAL 111 -4.394 -8.347 0.617 914 2HG1 VAL 111 HG12 VAL 111 -3.990 -9.899 1.350 915 3HG1 VAL 111 HG13 VAL 111 -5.668 -9.357 1.299 916 1HG2 VAL 111 HG21 VAL 111 -2.643 -7.225 2.943 917 2HG2 VAL 111 HG22 VAL 111 -2.797 -8.542 4.106 918 3HG2 VAL 111 HG23 VAL 111 -2.412 -8.895 2.422 919 H ALA 112 H ALA 112 -5.956 -5.650 0.697 920 HA ALA 112 HA ALA 112 -8.368 -7.272 0.312 921 1HB ALA 112 HB1 ALA 112 -8.542 -5.109 2.069 922 2HB ALA 112 HB2 ALA 112 -9.178 -4.482 0.547 923 3HB ALA 112 HB3 ALA 112 -9.895 -5.918 1.277 924 H TYR 113 H TYR 113 -9.814 -5.726 -1.363 925 HA TYR 113 HA TYR 113 -9.869 -4.939 -3.571 926 1HB TYR 113 HB2 TYR 113 -7.335 -3.657 -2.537 927 2HB TYR 113 HB3 TYR 113 -7.934 -3.367 -4.171 928 HD1 TYR 113 HD1 TYR 113 -10.772 -3.192 -3.975 929 HD2 TYR 113 HD2 TYR 113 -7.824 -1.835 -1.160 930 HE1 TYR 113 HE1 TYR 113 -12.384 -1.529 -3.088 931 HE2 TYR 113 HE2 TYR 113 -9.436 -0.174 -0.273 932 HH TYR 113 HH TYR 113 -11.843 0.177 -0.171 933 H VAL 114 H VAL 114 -8.708 -7.557 -3.019 934 HA VAL 114 HA VAL 114 -6.449 -7.782 -4.909 935 HB VAL 114 HB VAL 114 -7.918 -9.996 -3.453 936 1HG1 VAL 114 HG11 VAL 114 -5.333 -9.748 -4.976 937 2HG1 VAL 114 HG12 VAL 114 -5.505 -10.970 -3.715 938 3HG1 VAL 114 HG13 VAL 114 -6.583 -10.984 -5.111 939 1HG2 VAL 114 HG21 VAL 114 -6.701 -7.954 -2.166 940 2HG2 VAL 114 HG22 VAL 114 -6.666 -9.612 -1.567 941 3HG2 VAL 114 HG23 VAL 114 -5.297 -8.976 -2.479 942 H TYR 115 H TYR 115 -7.254 -7.471 -6.984 943 HA TYR 115 HA TYR 115 -9.523 -9.243 -7.802 944 1HB TYR 115 HB2 TYR 115 -8.604 -6.645 -9.067 945 2HB TYR 115 HB3 TYR 115 -9.988 -7.614 -9.575 946 HD1 TYR 115 HD1 TYR 115 -11.611 -8.271 -7.500 947 HD2 TYR 115 HD2 TYR 115 -9.063 -4.819 -7.709 948 HE1 TYR 115 HE1 TYR 115 -13.030 -7.122 -5.823 949 HE2 TYR 115 HE2 TYR 115 -10.483 -3.670 -6.030 950 HH TYR 115 HH TYR 115 -13.382 -5.256 -4.684 951 H LYS 116 H LYS 116 -9.088 -10.747 -9.350 952 HA LYS 116 HA LYS 116 -6.389 -11.196 -10.246 953 1HB LYS 116 HB2 LYS 116 -9.012 -12.319 -11.289 954 2HB LYS 116 HB3 LYS 116 -7.414 -12.958 -11.667 955 1HG LYS 116 HG2 LYS 116 -7.023 -13.583 -9.387 956 2HG LYS 116 HG3 LYS 116 -8.433 -12.679 -8.832 957 1HD LYS 116 HD2 LYS 116 -9.018 -15.032 -8.897 958 2HD LYS 116 HD3 LYS 116 -9.877 -14.211 -10.200 959 1HE LYS 116 HE2 LYS 116 -8.984 -16.147 -11.228 960 2HE LYS 116 HE3 LYS 116 -7.866 -14.860 -11.683 961 1HZ LYS 116 HZ1 LYS 116 -7.364 -16.355 -9.212 962 2HZ LYS 116 HZ2 LYS 116 -6.994 -17.096 -10.692 963 3HZ LYS 116 HZ3 LYS 116 -6.261 -15.621 -10.275 964 HA PRO 117 HA PRO 117 -5.702 -12.396 -12.028 965 1HB PRO 117 HB2 PRO 117 -3.619 -11.943 -13.730 966 2HB PRO 117 HB3 PRO 117 -5.164 -12.628 -14.260 967 1HG PRO 117 HG2 PRO 117 -4.077 -9.893 -14.678 968 2HG PRO 117 HG3 PRO 117 -5.221 -10.813 -15.668 969 1HD PRO 117 HD2 PRO 117 -5.872 -8.744 -13.844 970 2HD PRO 117 HD3 PRO 117 -7.014 -9.860 -14.624 971 H ASN 118 H ASN 118 -5.207 -9.208 -11.291 972 HA ASN 118 HA ASN 118 -2.440 -9.075 -10.600 973 1HB ASN 118 HB2 ASN 118 -4.875 -7.678 -9.463 974 2HB ASN 118 HB3 ASN 118 -3.228 -7.304 -8.955 975 1HD2 ASN 118 HD21 ASN 118 -5.010 -5.447 -10.376 976 2HD2 ASN 118 HD22 ASN 118 -4.267 -5.095 -11.861 977 H ASN 119 H ASN 119 -1.892 -11.095 -9.598 978 HA ASN 119 HA ASN 119 -2.667 -11.217 -6.736 979 1HB ASN 119 HB2 ASN 119 -3.390 -13.143 -8.827 980 2HB ASN 119 HB3 ASN 119 -2.559 -13.882 -7.461 981 1HD2 ASN 119 HD21 ASN 119 -5.579 -12.608 -8.529 982 2HD2 ASN 119 HD22 ASN 119 -6.379 -12.649 -7.033 983 H THR 120 H THR 120 -0.233 -10.754 -8.693 984 HA THR 120 HA THR 120 1.677 -12.795 -8.289 985 HB THR 120 HB THR 120 2.037 -9.797 -8.522 986 HG1 THR 120 HG1 THR 120 1.541 -10.341 -10.484 987 1HG2 THR 120 HG21 THR 120 4.081 -12.032 -8.598 988 2HG2 THR 120 HG22 THR 120 4.402 -10.373 -9.104 989 3HG2 THR 120 HG23 THR 120 3.998 -10.719 -7.423 990 H HIS 121 H HIS 121 1.022 -9.923 -6.255 991 HA HIS 121 HA HIS 121 2.687 -11.195 -4.132 992 1HB HIS 121 HB2 HIS 121 1.963 -8.359 -4.783 993 2HB HIS 121 HB3 HIS 121 2.351 -8.782 -3.116 994 HD1 HIS 121 HD1 HIS 121 4.656 -10.572 -3.199 995 HD2 HIS 121 HD2 HIS 121 4.281 -7.506 -5.999 996 HE1 HIS 121 HE1 HIS 121 6.983 -10.135 -4.101 997 H GLU 122 H GLU 122 -0.158 -11.896 -4.795 998 HA GLU 122 HA GLU 122 -1.750 -10.790 -2.608 999 1HB GLU 122 HB2 GLU 122 -2.969 -11.463 -4.561 1000 2HB GLU 122 HB3 GLU 122 -2.207 -13.054 -4.565 1001 1HG GLU 122 HG2 GLU 122 -4.581 -12.972 -3.633 1002 2HG GLU 122 HG3 GLU 122 -3.375 -13.720 -2.585 1003 H GLN 123 H GLN 123 -0.140 -13.899 -3.289 1004 HA GLN 123 HA GLN 123 -0.904 -15.100 -0.775 1005 1HB GLN 123 HB2 GLN 123 1.131 -15.734 -2.900 1006 2HB GLN 123 HB3 GLN 123 1.143 -16.615 -1.372 1007 1HG GLN 123 HG2 GLN 123 -1.559 -16.413 -2.385 1008 2HG GLN 123 HG3 GLN 123 -0.500 -17.124 -3.605 1009 1HE2 GLN 123 HE21 GLN 123 -1.677 -19.213 -3.159 1010 2HE2 GLN 123 HE22 GLN 123 -1.228 -20.139 -1.808 1011 H LEU 124 H LEU 124 2.049 -13.447 -1.909 1012 HA LEU 124 HA LEU 124 3.642 -13.777 0.387 1013 1HB LEU 124 HB2 LEU 124 4.397 -12.689 -1.731 1014 2HB LEU 124 HB3 LEU 124 3.441 -11.268 -1.307 1015 HG LEU 124 HG LEU 124 4.777 -11.379 0.950 1016 1HD1 LEU 124 HD11 LEU 124 6.167 -13.311 -0.817 1017 2HD1 LEU 124 HD12 LEU 124 7.211 -12.169 0.028 1018 3HD1 LEU 124 HD13 LEU 124 6.131 -13.221 0.944 1019 1HD2 LEU 124 HD21 LEU 124 4.907 -9.650 -0.936 1020 2HD2 LEU 124 HD22 LEU 124 6.356 -9.819 0.054 1021 3HD2 LEU 124 HD23 LEU 124 6.289 -10.562 -1.543 1022 H LEU 125 H LEU 125 1.602 -10.907 -0.314 1023 HA LEU 125 HA LEU 125 1.794 -9.768 2.270 1024 1HB LEU 125 HB2 LEU 125 -0.507 -9.666 0.294 1025 2HB LEU 125 HB3 LEU 125 -0.351 -8.616 1.704 1026 HG LEU 125 HG LEU 125 2.017 -8.752 -0.080 1027 1HD1 LEU 125 HD11 LEU 125 -0.536 -8.379 -1.222 1028 2HD1 LEU 125 HD12 LEU 125 0.169 -6.768 -1.088 1029 3HD1 LEU 125 HD13 LEU 125 1.023 -8.034 -1.971 1030 1HD2 LEU 125 HD21 LEU 125 0.716 -6.948 1.835 1031 2HD2 LEU 125 HD22 LEU 125 2.415 -7.056 1.373 1032 3HD2 LEU 125 HD23 LEU 125 1.291 -6.118 0.390 1033 H ARG 126 H ARG 126 -0.137 -12.431 1.080 1034 HA ARG 126 HA ARG 126 -2.135 -12.570 3.070 1035 1HB ARG 126 HB2 ARG 126 -1.325 -14.163 0.953 1036 2HB ARG 126 HB3 ARG 126 -1.018 -15.184 2.358 1037 1HG ARG 126 HG2 ARG 126 -3.475 -14.098 2.961 1038 2HG ARG 126 HG3 ARG 126 -3.578 -14.298 1.211 1039 1HD ARG 126 HD2 ARG 126 -4.032 -16.475 1.584 1040 2HD ARG 126 HD3 ARG 126 -2.361 -16.651 2.118 1041 HE ARG 126 HE ARG 126 -4.588 -16.908 3.824 1042 1HH1 ARG 126 HH11 ARG 126 -1.320 -16.613 3.993 1043 2HH1 ARG 126 HH12 ARG 126 -1.260 -15.799 5.521 1044 1HH2 ARG 126 HH21 ARG 126 -4.672 -15.200 5.639 1045 2HH2 ARG 126 HH22 ARG 126 -3.157 -15.000 6.452 1046 H LYS 127 H LYS 127 1.031 -14.270 3.078 1047 HA LYS 127 HA LYS 127 0.780 -15.199 5.771 1048 1HB LYS 127 HB2 LYS 127 3.244 -15.547 5.651 1049 2HB LYS 127 HB3 LYS 127 2.407 -16.187 4.235 1050 1HG LYS 127 HG2 LYS 127 3.040 -14.302 2.900 1051 2HG LYS 127 HG3 LYS 127 3.622 -13.416 4.310 1052 1HD LYS 127 HD2 LYS 127 4.831 -16.091 3.761 1053 2HD LYS 127 HD3 LYS 127 5.296 -14.754 2.709 1054 1HE LYS 127 HE2 LYS 127 6.294 -13.562 4.436 1055 2HE LYS 127 HE3 LYS 127 5.293 -14.319 5.674 1056 1HZ LYS 127 HZ1 LYS 127 6.862 -16.252 4.311 1057 2HZ LYS 127 HZ2 LYS 127 7.853 -15.029 4.951 1058 3HZ LYS 127 HZ3 LYS 127 6.806 -15.891 5.972 1059 H SER 128 H SER 128 2.050 -12.205 4.399 1060 HA SER 128 HA SER 128 3.299 -11.186 6.750 1061 1HB SER 128 HB2 SER 128 1.860 -9.645 4.565 1062 2HB SER 128 HB3 SER 128 3.008 -8.968 5.716 1063 HG SER 128 HG SER 128 4.403 -10.791 4.815 1064 H GLU 129 H GLU 129 -0.065 -11.285 5.718 1065 HA GLU 129 HA GLU 129 -1.033 -9.509 7.800 1066 1HB GLU 129 HB2 GLU 129 -2.449 -9.759 5.895 1067 2HB GLU 129 HB3 GLU 129 -2.368 -11.520 5.973 1068 1HG GLU 129 HG2 GLU 129 -3.732 -11.604 7.917 1069 2HG GLU 129 HG3 GLU 129 -3.534 -9.878 8.226 1070 H ALA 130 H ALA 130 -1.186 -13.063 7.358 1071 HA ALA 130 HA ALA 130 -2.305 -13.796 9.796 1072 1HB ALA 130 HB1 ALA 130 -1.510 -15.336 7.921 1073 2HB ALA 130 HB2 ALA 130 0.102 -15.209 8.623 1074 3HB ALA 130 HB3 ALA 130 -1.213 -15.916 9.559 1075 H GLN 131 H GLN 131 0.917 -12.561 9.155 1076 HA GLN 131 HA GLN 131 2.019 -13.193 11.752 1077 1HB GLN 131 HB2 GLN 131 3.244 -12.491 9.549 1078 2HB GLN 131 HB3 GLN 131 2.915 -10.845 10.092 1079 1HG GLN 131 HG2 GLN 131 4.792 -11.023 11.337 1080 2HG GLN 131 HG3 GLN 131 3.871 -12.107 12.380 1081 1HE2 GLN 131 HE21 GLN 131 5.976 -13.268 12.771 1082 2HE2 GLN 131 HE22 GLN 131 6.539 -14.372 11.611 1083 H ALA 132 H ALA 132 0.692 -10.184 10.336 1084 HA ALA 132 HA ALA 132 0.848 -8.603 12.691 1085 1HB ALA 132 HB1 ALA 132 0.026 -8.106 10.165 1086 2HB ALA 132 HB2 ALA 132 -1.544 -8.255 10.955 1087 3HB ALA 132 HB3 ALA 132 -0.383 -7.053 11.520 1088 H LYS 133 H LYS 133 -1.233 -11.229 11.840 1089 HA LYS 133 HA LYS 133 -3.383 -10.602 13.682 1090 1HB LYS 133 HB2 LYS 133 -2.703 -12.731 11.816 1091 2HB LYS 133 HB3 LYS 133 -3.341 -13.380 13.327 1092 1HG LYS 133 HG2 LYS 133 -5.128 -11.444 13.015 1093 2HG LYS 133 HG3 LYS 133 -4.669 -11.601 11.318 1094 1HD LYS 133 HD2 LYS 133 -5.371 -14.020 12.980 1095 2HD LYS 133 HD3 LYS 133 -6.617 -13.076 12.163 1096 1HE LYS 133 HE2 LYS 133 -6.152 -14.120 10.228 1097 2HE LYS 133 HE3 LYS 133 -4.491 -13.531 10.305 1098 1HZ LYS 133 HZ1 LYS 133 -5.511 -15.970 11.659 1099 2HZ LYS 133 HZ2 LYS 133 -4.598 -15.953 10.229 1100 3HZ LYS 133 HZ3 LYS 133 -3.906 -15.409 11.684 1101 H LYS 134 H LYS 134 -0.645 -12.909 13.811 1102 HA LYS 134 HA LYS 134 -1.154 -13.656 16.552 1103 1HB LYS 134 HB2 LYS 134 1.094 -14.027 14.603 1104 2HB LYS 134 HB3 LYS 134 1.392 -14.347 16.310 1105 1HG LYS 134 HG2 LYS 134 -1.049 -15.586 15.854 1106 2HG LYS 134 HG3 LYS 134 -0.149 -15.906 14.370 1107 1HD LYS 134 HD2 LYS 134 1.783 -16.672 15.799 1108 2HD LYS 134 HD3 LYS 134 0.721 -16.536 17.202 1109 1HE LYS 134 HE2 LYS 134 -0.432 -18.421 16.668 1110 2HE LYS 134 HE3 LYS 134 -0.435 -18.043 14.946 1111 1HZ LYS 134 HZ1 LYS 134 2.017 -18.631 15.025 1112 2HZ LYS 134 HZ2 LYS 134 1.694 -19.335 16.538 1113 3HZ LYS 134 HZ3 LYS 134 0.913 -19.918 15.149 1114 H GLU 135 H GLU 135 0.300 -10.929 15.056 1115 HA GLU 135 HA GLU 135 1.894 -10.201 17.430 1116 1HB GLU 135 HB2 GLU 135 1.555 -9.155 14.658 1117 2HB GLU 135 HB3 GLU 135 2.021 -7.997 15.903 1118 1HG GLU 135 HG2 GLU 135 4.035 -9.089 16.354 1119 2HG GLU 135 HG3 GLU 135 3.459 -10.628 15.714 1120 H LYS 136 H LYS 136 -1.223 -9.543 16.020 1121 HA LYS 136 HA LYS 136 -2.980 -8.157 16.723 1122 1HB LYS 136 HB2 LYS 136 -1.663 -8.328 19.443 1123 2HB LYS 136 HB3 LYS 136 -3.379 -8.127 19.083 1124 1HG LYS 136 HG2 LYS 136 -3.616 -10.361 19.125 1125 2HG LYS 136 HG3 LYS 136 -2.537 -10.474 17.735 1126 1HD LYS 136 HD2 LYS 136 -1.133 -11.600 19.105 1127 2HD LYS 136 HD3 LYS 136 -0.794 -10.035 19.846 1128 1HE LYS 136 HE2 LYS 136 -3.255 -11.405 20.781 1129 2HE LYS 136 HE3 LYS 136 -1.729 -12.156 21.247 1130 1HZ LYS 136 HZ1 LYS 136 -1.525 -9.373 21.579 1131 2HZ LYS 136 HZ2 LYS 136 -2.940 -9.907 22.357 1132 3HZ LYS 136 HZ3 LYS 136 -1.436 -10.588 22.760 1133 H LEU 137 H LEU 137 -1.442 -6.534 15.454 1134 HA LEU 137 HA LEU 137 -0.542 -4.387 17.318 1135 1HB LEU 137 HB2 LEU 137 0.197 -5.154 14.511 1136 2HB LEU 137 HB3 LEU 137 0.428 -3.489 15.044 1137 HG LEU 137 HG LEU 137 1.430 -5.773 16.726 1138 1HD1 LEU 137 HD11 LEU 137 2.251 -5.873 14.273 1139 2HD1 LEU 137 HD12 LEU 137 3.123 -4.387 14.646 1140 3HD1 LEU 137 HD13 LEU 137 3.476 -5.865 15.541 1141 1HD2 LEU 137 HD21 LEU 137 1.302 -3.081 17.151 1142 2HD2 LEU 137 HD22 LEU 137 2.519 -4.129 17.880 1143 3HD2 LEU 137 HD23 LEU 137 2.900 -3.221 16.417 1144 H ASN 138 H ASN 138 -1.578 -2.448 17.346 1145 HA ASN 138 HA ASN 138 -3.418 -1.006 17.038 1146 1HB ASN 138 HB2 ASN 138 -3.423 -0.656 14.269 1147 2HB ASN 138 HB3 ASN 138 -2.468 0.259 15.432 1148 1HD2 ASN 138 HD21 ASN 138 -0.219 0.077 15.253 1149 2HD2 ASN 138 HD22 ASN 138 0.582 -1.099 14.327 1150 H ILE 139 H ILE 139 -3.895 -2.366 13.832 1151 HA ILE 139 HA ILE 139 -6.694 -2.633 14.136 1152 HB ILE 139 HB ILE 139 -4.826 -4.120 12.269 1153 1HG1 ILE 139 HG12 ILE 139 -6.574 -1.723 11.676 1154 2HG1 ILE 139 HG13 ILE 139 -4.908 -1.549 12.234 1155 1HG2 ILE 139 HG21 ILE 139 -7.552 -4.571 12.806 1156 2HG2 ILE 139 HG22 ILE 139 -7.514 -3.652 11.302 1157 3HG2 ILE 139 HG23 ILE 139 -6.630 -5.172 11.428 1158 1HD1 ILE 139 HD11 ILE 139 -4.995 -3.509 10.131 1159 2HD1 ILE 139 HD12 ILE 139 -5.803 -2.038 9.584 1160 3HD1 ILE 139 HD13 ILE 139 -4.137 -1.967 10.163 1161 H TRP 140 H TRP 140 -4.384 -5.360 13.911 1162 HA TRP 140 HA TRP 140 -6.330 -7.202 15.037 1163 1HB TRP 140 HB2 TRP 140 -3.361 -7.682 14.744 1164 2HB TRP 140 HB3 TRP 140 -4.664 -8.872 14.717 1165 HD1 TRP 140 HD1 TRP 140 -2.700 -6.589 12.506 1166 HE1 TRP 140 HE1 TRP 140 -3.599 -6.717 10.092 1167 HE3 TRP 140 HE3 TRP 140 -7.021 -9.186 13.311 1168 HZ2 TRP 140 HZ2 TRP 140 -5.855 -7.778 8.690 1169 HZ3 TRP 140 HZ3 TRP 140 -8.527 -9.739 11.422 1170 HH2 TRP 140 HH2 TRP 140 -7.950 -9.039 9.114 1171 H SER 141 H SER 141 -4.668 -4.810 16.519 1172 HA SER 141 HA SER 141 -3.551 -6.195 18.801 1173 1HB SER 141 HB2 SER 141 -2.670 -4.051 18.596 1174 2HB SER 141 HB3 SER 141 -4.218 -3.349 18.136 1175 HG SER 141 HG SER 141 -3.463 -2.894 20.330 1176 H GLU 142 H GLU 142 -6.057 -3.759 19.232 1177 HA GLU 142 HA GLU 142 -7.272 -5.136 21.416 1178 1HB GLU 142 HB2 GLU 142 -8.405 -3.000 19.585 1179 2HB GLU 142 HB3 GLU 142 -9.131 -3.505 21.108 1180 1HG GLU 142 HG2 GLU 142 -7.250 -2.729 22.370 1181 2HG GLU 142 HG3 GLU 142 -6.287 -2.498 20.911 1182 H ASP 143 H ASP 143 -8.579 -4.636 18.111 1183 HA ASP 143 HA ASP 143 -10.755 -6.445 18.401 1184 1HB ASP 143 HB2 ASP 143 -10.116 -4.717 16.489 1185 2HB ASP 143 HB3 ASP 143 -9.401 -6.148 15.746 1186 H ASN 144 H ASN 144 -10.183 -8.443 19.278 1187 HA ASN 144 HA ASN 144 -8.048 -9.999 17.910 1188 1HB ASN 144 HB2 ASN 144 -9.438 -10.205 20.566 1189 2HB ASN 144 HB3 ASN 144 -8.659 -11.631 19.878 1190 1HD2 ASN 144 HD21 ASN 144 -6.902 -11.652 21.430 1191 2HD2 ASN 144 HD22 ASN 144 -5.703 -10.450 21.444 1192 H ALA 145 H ALA 145 -8.885 -12.570 18.226 1193 HA ALA 145 HA ALA 145 -11.174 -12.689 16.349 1194 1HB ALA 145 HB1 ALA 145 -9.040 -14.627 17.221 1195 2HB ALA 145 HB2 ALA 145 -10.500 -15.215 16.426 1196 3HB ALA 145 HB3 ALA 145 -9.439 -14.079 15.592 1197 H ASP 146 H ASP 146 -12.971 -12.331 17.708 1198 HA ASP 146 HA ASP 146 -13.286 -13.844 20.191 1199 1HB ASP 146 HB2 ASP 146 -14.494 -11.557 19.008 1200 2HB ASP 146 HB3 ASP 146 -15.770 -12.749 19.251 1201 H SER 147 H SER 147 -14.809 -15.538 20.526 1202 HA SER 147 HA SER 147 -15.914 -16.764 18.032 1203 1HB SER 147 HB2 SER 147 -13.814 -17.810 19.521 1204 2HB SER 147 HB3 SER 147 -15.218 -18.685 20.129 1205 HG SER 147 HG SER 147 -13.940 -18.896 17.754 1206 H GLY 148 H GLY 148 -17.122 -18.957 19.434 1207 1HA GLY 148 HA2 GLY 148 -19.496 -17.605 20.445 1208 2HA GLY 148 HA3 GLY 148 -19.265 -19.352 20.346 1209 H GLN 149 H GLN 149 -20.393 -18.038 22.625 1210 HA GLN 149 HA GLN 149 -18.327 -18.777 24.644 1211 1HB GLN 149 HB2 GLN 149 -18.862 -16.177 24.197 1212 2HB GLN 149 HB3 GLN 149 -20.169 -16.538 25.324 1213 1HG GLN 149 HG2 GLN 149 -17.842 -17.779 26.365 1214 2HG GLN 149 HG3 GLN 149 -17.372 -16.147 25.886 1215 1HE2 GLN 149 HE21 GLN 149 -19.188 -14.424 26.575 1216 2HE2 GLN 149 HE22 GLN 149 -19.775 -14.606 28.157 1217 HN3 PTP 150 H3 PTP 150 -8.601 -3.266 -9.314 1218 1H5M PTP 150 H51 PTP 150 -6.175 -2.627 -5.306 1219 2H5M PTP 150 H52 PTP 150 -6.959 -1.198 -4.593 1220 3H5M PTP 150 H53 PTP 150 -5.787 -1.002 -5.917 1221 H6 PTP 150 H6 PTP 150 -8.901 -0.341 -5.511 1222 H1* PTP 150 H1' PTP 150 -11.579 -0.187 -8.045 1223 2H2* PTP 150 H2' PTP 150 -11.497 -1.524 -5.341 1224 H3* PTP 150 H3' PTP 150 -12.668 0.274 -4.311 1225 H4* PTP 150 H4' PTP 150 -11.740 2.448 -5.698 1226 2H5* PTP 150 H5' PTP 150 -10.271 0.423 -3.919 Start of MODEL 18 1 1H ALA 1 H1 ALA 1 0.149 -8.772 -24.001 2 2H ALA 1 H2 ALA 1 1.707 -9.344 -23.636 3 3H ALA 1 H3 ALA 1 1.494 -7.746 -24.162 4 HA ALA 1 HA ALA 1 0.413 -8.974 -26.223 5 1HB ALA 1 HB1 ALA 1 2.900 -7.712 -25.592 6 2HB ALA 1 HB2 ALA 1 3.237 -9.086 -26.646 7 3HB ALA 1 HB3 ALA 1 2.109 -7.833 -27.162 8 H THR 2 H THR 2 3.420 -10.391 -24.885 9 HA THR 2 HA THR 2 2.252 -13.089 -25.125 10 HB THR 2 HB THR 2 3.266 -12.396 -27.388 11 HG1 THR 2 HG1 THR 2 3.721 -14.667 -25.881 12 1HG2 THR 2 HG21 THR 2 5.390 -11.626 -25.787 13 2HG2 THR 2 HG22 THR 2 5.938 -13.156 -26.469 14 3HG2 THR 2 HG23 THR 2 5.450 -11.839 -27.537 15 H SER 3 H SER 3 3.321 -14.586 -23.786 16 HA SER 3 HA SER 3 4.603 -15.230 -21.927 17 1HB SER 3 HB2 SER 3 6.789 -13.427 -22.935 18 2HB SER 3 HB3 SER 3 6.919 -15.023 -22.200 19 HG SER 3 HG SER 3 6.451 -15.937 -24.074 20 H THR 4 H THR 4 2.928 -13.577 -20.913 21 HA THR 4 HA THR 4 4.456 -11.356 -19.620 22 HB THR 4 HB THR 4 1.445 -11.648 -19.759 23 HG1 THR 4 HG1 THR 4 1.527 -10.334 -21.534 24 1HG2 THR 4 HG21 THR 4 3.340 -9.388 -19.080 25 2HG2 THR 4 HG22 THR 4 1.617 -9.150 -19.375 26 3HG2 THR 4 HG23 THR 4 2.151 -10.145 -18.021 27 H LYS 5 H LYS 5 5.268 -13.246 -18.226 28 HA LYS 5 HA LYS 5 3.284 -13.798 -16.053 29 1HB LYS 5 HB2 LYS 5 4.061 -15.803 -17.392 30 2HB LYS 5 HB3 LYS 5 5.684 -15.502 -16.769 31 1HG LYS 5 HG2 LYS 5 5.164 -16.577 -14.866 32 2HG LYS 5 HG3 LYS 5 3.861 -15.426 -14.567 33 1HD LYS 5 HD2 LYS 5 2.265 -16.760 -15.697 34 2HD LYS 5 HD3 LYS 5 3.511 -17.728 -16.486 35 1HE LYS 5 HE2 LYS 5 4.206 -18.523 -14.180 36 2HE LYS 5 HE3 LYS 5 2.754 -17.740 -13.556 37 1HZ LYS 5 HZ1 LYS 5 2.085 -19.297 -15.801 38 2HZ LYS 5 HZ2 LYS 5 2.968 -20.257 -14.718 39 3HZ LYS 5 HZ3 LYS 5 1.558 -19.468 -14.195 40 H LYS 6 H LYS 6 5.646 -11.749 -16.658 41 HA LYS 6 HA LYS 6 6.574 -11.756 -13.841 42 1HB LYS 6 HB2 LYS 6 8.225 -12.421 -16.147 43 2HB LYS 6 HB3 LYS 6 8.849 -11.012 -15.288 44 1HG LYS 6 HG2 LYS 6 8.579 -12.357 -13.140 45 2HG LYS 6 HG3 LYS 6 8.291 -13.765 -14.163 46 1HD LYS 6 HD2 LYS 6 10.581 -13.942 -13.907 47 2HD LYS 6 HD3 LYS 6 10.526 -12.918 -15.341 48 1HE LYS 6 HE2 LYS 6 10.766 -10.914 -13.954 49 2HE LYS 6 HE3 LYS 6 10.740 -11.899 -12.492 50 1HZ LYS 6 HZ1 LYS 6 12.677 -13.049 -14.010 51 2HZ LYS 6 HZ2 LYS 6 12.894 -11.392 -14.313 52 3HZ LYS 6 HZ3 LYS 6 12.939 -11.980 -12.720 53 H LEU 7 H LEU 7 6.714 -9.683 -13.037 54 HA LEU 7 HA LEU 7 5.891 -7.498 -14.837 55 1HB LEU 7 HB2 LEU 7 6.585 -7.187 -11.918 56 2HB LEU 7 HB3 LEU 7 5.438 -6.256 -12.883 57 HG LEU 7 HG LEU 7 5.115 -9.186 -12.172 58 1HD1 LEU 7 HD11 LEU 7 4.357 -6.671 -10.808 59 2HD1 LEU 7 HD12 LEU 7 3.061 -7.858 -10.965 60 3HD1 LEU 7 HD13 LEU 7 4.561 -8.293 -10.147 61 1HD2 LEU 7 HD21 LEU 7 3.503 -7.184 -13.743 62 2HD2 LEU 7 HD22 LEU 7 3.907 -8.850 -14.158 63 3HD2 LEU 7 HD23 LEU 7 2.696 -8.518 -12.919 64 H HIS 8 H HIS 8 7.256 -5.403 -13.384 65 HA HIS 8 HA HIS 8 10.134 -5.930 -13.728 66 1HB HIS 8 HB2 HIS 8 9.201 -5.307 -16.011 67 2HB HIS 8 HB3 HIS 8 8.811 -3.727 -15.331 68 HD1 HIS 8 HD1 HIS 8 10.586 -2.611 -16.923 69 HD2 HIS 8 HD2 HIS 8 12.185 -5.334 -14.202 70 HE1 HIS 8 HE1 HIS 8 13.090 -2.238 -16.924 71 H LYS 9 H LYS 9 11.381 -4.468 -12.519 72 HA LYS 9 HA LYS 9 9.803 -2.656 -10.770 73 1HB LYS 9 HB2 LYS 9 12.655 -3.662 -10.526 74 2HB LYS 9 HB3 LYS 9 11.833 -2.640 -9.345 75 1HG LYS 9 HG2 LYS 9 10.012 -4.494 -9.335 76 2HG LYS 9 HG3 LYS 9 11.251 -5.504 -10.079 77 1HD LYS 9 HD2 LYS 9 11.591 -5.921 -7.804 78 2HD LYS 9 HD3 LYS 9 12.761 -4.639 -8.121 79 1HE LYS 9 HE2 LYS 9 10.955 -2.987 -7.415 80 2HE LYS 9 HE3 LYS 9 10.034 -4.376 -6.839 81 1HZ LYS 9 HZ1 LYS 9 12.267 -4.937 -5.655 82 2HZ LYS 9 HZ2 LYS 9 12.558 -3.272 -5.829 83 3HZ LYS 9 HZ3 LYS 9 11.197 -3.807 -4.972 84 H GLU 10 H GLU 10 10.102 -0.452 -10.810 85 HA GLU 10 HA GLU 10 12.345 0.623 -12.456 86 1HB GLU 10 HB2 GLU 10 9.409 1.012 -12.838 87 2HB GLU 10 HB3 GLU 10 10.452 2.413 -13.084 88 1HG GLU 10 HG2 GLU 10 10.877 1.613 -15.147 89 2HG GLU 10 HG3 GLU 10 11.781 0.312 -14.372 90 HA PRO 11 HA PRO 11 12.751 3.594 -9.230 91 1HB PRO 11 HB2 PRO 11 13.565 5.796 -10.625 92 2HB PRO 11 HB3 PRO 11 14.590 4.370 -10.389 93 1HG PRO 11 HG2 PRO 11 13.096 5.237 -12.823 94 2HG PRO 11 HG3 PRO 11 14.629 4.359 -12.696 95 1HD PRO 11 HD2 PRO 11 12.146 3.194 -13.269 96 2HD PRO 11 HD3 PRO 11 13.583 2.319 -12.697 97 H ALA 12 H ALA 12 12.105 5.981 -8.657 98 HA ALA 12 HA ALA 12 9.803 7.106 -10.030 99 1HB ALA 12 HB1 ALA 12 8.839 5.123 -8.763 100 2HB ALA 12 HB2 ALA 12 9.304 5.949 -7.276 101 3HB ALA 12 HB3 ALA 12 8.124 6.685 -8.361 102 H THR 13 H THR 13 8.856 8.938 -8.548 103 HA THR 13 HA THR 13 11.073 10.056 -6.878 104 HB THR 13 HB THR 13 9.257 11.702 -8.654 105 HG1 THR 13 HG1 THR 13 11.639 10.352 -9.156 106 1HG2 THR 13 HG21 THR 13 11.801 12.256 -7.111 107 2HG2 THR 13 HG22 THR 13 11.119 13.369 -8.297 108 3HG2 THR 13 HG23 THR 13 10.210 12.968 -6.840 109 H LEU 14 H LEU 14 10.425 10.861 -4.913 110 HA LEU 14 HA LEU 14 7.603 10.495 -4.173 111 1HB LEU 14 HB2 LEU 14 9.523 9.839 -2.669 112 2HB LEU 14 HB3 LEU 14 9.878 11.556 -2.471 113 HG LEU 14 HG LEU 14 8.413 10.511 -0.660 114 1HD1 LEU 14 HD11 LEU 14 8.545 13.012 -1.447 115 2HD1 LEU 14 HD12 LEU 14 6.926 12.705 -2.076 116 3HD1 LEU 14 HD13 LEU 14 7.254 12.516 -0.354 117 1HD2 LEU 14 HD21 LEU 14 7.066 9.380 -2.707 118 2HD2 LEU 14 HD22 LEU 14 6.314 9.714 -1.147 119 3HD2 LEU 14 HD23 LEU 14 6.089 10.833 -2.492 120 H ILE 15 H ILE 15 6.235 12.127 -4.729 121 HA ILE 15 HA ILE 15 7.241 14.915 -4.750 122 HB ILE 15 HB ILE 15 4.456 14.005 -5.485 123 1HG1 ILE 15 HG12 ILE 15 6.859 14.160 -7.330 124 2HG1 ILE 15 HG13 ILE 15 6.199 12.651 -6.699 125 1HG2 ILE 15 HG21 ILE 15 6.179 16.417 -5.909 126 2HG2 ILE 15 HG22 ILE 15 5.004 15.995 -7.155 127 3HG2 ILE 15 HG23 ILE 15 4.465 16.323 -5.509 128 1HD1 ILE 15 HD11 ILE 15 4.569 14.667 -8.268 129 2HD1 ILE 15 HD12 ILE 15 5.352 13.263 -8.994 130 3HD1 ILE 15 HD13 ILE 15 4.080 13.040 -7.794 131 H LYS 16 H LYS 16 4.479 13.088 -3.368 132 HA LYS 16 HA LYS 16 4.731 14.393 -0.810 133 1HB LYS 16 HB2 LYS 16 3.702 16.157 -2.485 134 2HB LYS 16 HB3 LYS 16 2.222 15.234 -2.223 135 1HG LYS 16 HG2 LYS 16 2.527 15.511 0.238 136 2HG LYS 16 HG3 LYS 16 3.931 16.530 -0.082 137 1HD LYS 16 HD2 LYS 16 2.533 18.116 -1.322 138 2HD LYS 16 HD3 LYS 16 1.122 17.083 -1.082 139 1HE LYS 16 HE2 LYS 16 2.095 17.401 1.490 140 2HE LYS 16 HE3 LYS 16 2.374 18.984 0.765 141 1HZ LYS 16 HZ1 LYS 16 -0.165 17.991 0.012 142 2HZ LYS 16 HZ2 LYS 16 -0.021 17.971 1.702 143 3HZ LYS 16 HZ3 LYS 16 0.220 19.420 0.848 144 H ALA 17 H ALA 17 4.162 12.654 0.407 145 HA ALA 17 HA ALA 17 2.358 10.600 -0.525 146 1HB ALA 17 HB1 ALA 17 3.965 11.141 1.882 147 2HB ALA 17 HB2 ALA 17 2.460 10.283 2.212 148 3HB ALA 17 HB3 ALA 17 3.630 9.608 1.076 149 H ILE 18 H ILE 18 0.174 10.293 -0.022 150 HA ILE 18 HA ILE 18 -1.164 12.632 1.266 151 HB ILE 18 HB ILE 18 -2.480 10.510 -0.442 152 1HG1 ILE 18 HG12 ILE 18 -1.857 13.192 -1.573 153 2HG1 ILE 18 HG13 ILE 18 -0.501 12.073 -1.414 154 1HG2 ILE 18 HG21 ILE 18 -3.890 11.966 1.036 155 2HG2 ILE 18 HG22 ILE 18 -3.257 13.372 0.183 156 3HG2 ILE 18 HG23 ILE 18 -4.227 12.181 -0.681 157 1HD1 ILE 18 HD11 ILE 18 -3.044 11.014 -2.568 158 2HD1 ILE 18 HD12 ILE 18 -2.059 12.066 -3.583 159 3HD1 ILE 18 HD13 ILE 18 -1.375 10.574 -2.936 160 H ASP 19 H ASP 19 -1.973 9.166 0.866 161 HA ASP 19 HA ASP 19 -2.703 9.150 3.767 162 1HB ASP 19 HB2 ASP 19 -3.748 7.170 1.750 163 2HB ASP 19 HB3 ASP 19 -4.452 7.649 3.295 164 H GLY 20 H GLY 20 -2.959 6.279 3.860 165 1HA GLY 20 HA2 GLY 20 -0.097 5.611 4.096 166 2HA GLY 20 HA3 GLY 20 -1.439 4.641 4.703 167 H ASP 21 H ASP 21 -2.811 4.912 2.019 168 HA ASP 21 HA ASP 21 -1.126 2.904 0.579 169 1HB ASP 21 HB2 ASP 21 -4.136 3.180 0.780 170 2HB ASP 21 HB3 ASP 21 -3.337 2.111 -0.374 171 H THR 22 H THR 22 -1.935 6.059 0.441 172 HA THR 22 HA THR 22 -1.936 6.035 -2.550 173 HB THR 22 HB THR 22 -3.115 8.456 -1.600 174 HG1 THR 22 HG1 THR 22 -5.037 7.014 -0.805 175 1HG2 THR 22 HG21 THR 22 -3.426 6.639 -3.657 176 2HG2 THR 22 HG22 THR 22 -4.913 6.436 -2.731 177 3HG2 THR 22 HG23 THR 22 -4.474 8.025 -3.356 178 H VAL 23 H VAL 23 -0.209 7.111 -3.373 179 HA VAL 23 HA VAL 23 0.925 9.397 -1.861 180 HB VAL 23 HB VAL 23 3.250 8.413 -2.308 181 1HG1 VAL 23 HG11 VAL 23 2.151 8.501 -0.068 182 2HG1 VAL 23 HG12 VAL 23 1.450 6.913 -0.382 183 3HG1 VAL 23 HG13 VAL 23 3.200 7.095 -0.255 184 1HG2 VAL 23 HG21 VAL 23 1.505 6.288 -3.319 185 2HG2 VAL 23 HG22 VAL 23 3.230 6.540 -3.584 186 3HG2 VAL 23 HG23 VAL 23 2.674 5.700 -2.136 187 H LYS 24 H LYS 24 1.657 10.990 -3.236 188 HA LYS 24 HA LYS 24 1.314 10.507 -6.131 189 1HB LYS 24 HB2 LYS 24 1.927 13.036 -4.568 190 2HB LYS 24 HB3 LYS 24 1.648 12.971 -6.309 191 1HG LYS 24 HG2 LYS 24 -0.509 11.575 -5.184 192 2HG LYS 24 HG3 LYS 24 -0.290 12.985 -4.146 193 1HD LYS 24 HD2 LYS 24 -0.622 14.497 -5.914 194 2HD LYS 24 HD3 LYS 24 -0.271 13.281 -7.143 195 1HE LYS 24 HE2 LYS 24 -2.405 12.504 -7.154 196 2HE LYS 24 HE3 LYS 24 -2.549 12.608 -5.399 197 1HZ LYS 24 HZ1 LYS 24 -2.747 15.049 -5.668 198 2HZ LYS 24 HZ2 LYS 24 -2.807 14.828 -7.350 199 3HZ LYS 24 HZ3 LYS 24 -4.029 14.181 -6.368 200 H LEU 25 H LEU 25 3.048 9.860 -7.308 201 HA LEU 25 HA LEU 25 5.747 10.838 -6.463 202 1HB LEU 25 HB2 LEU 25 5.502 8.189 -7.822 203 2HB LEU 25 HB3 LEU 25 6.673 8.729 -6.619 204 HG LEU 25 HG LEU 25 3.753 8.208 -6.002 205 1HD1 LEU 25 HD11 LEU 25 6.024 6.386 -6.314 206 2HD1 LEU 25 HD12 LEU 25 5.280 6.278 -4.719 207 3HD1 LEU 25 HD13 LEU 25 4.305 6.020 -6.166 208 1HD2 LEU 25 HD21 LEU 25 6.059 9.284 -4.539 209 2HD2 LEU 25 HD22 LEU 25 4.342 9.365 -4.143 210 3HD2 LEU 25 HD23 LEU 25 5.281 7.938 -3.705 211 H MET 26 H MET 26 7.264 9.964 -8.524 212 HA MET 26 HA MET 26 5.928 11.069 -10.963 213 1HB MET 26 HB2 MET 26 7.840 12.424 -9.695 214 2HB MET 26 HB3 MET 26 8.888 11.323 -10.590 215 1HG MET 26 HG2 MET 26 7.664 11.975 -12.689 216 2HG MET 26 HG3 MET 26 6.803 13.193 -11.749 217 1HE MET 26 HE1 MET 26 7.968 14.407 -10.018 218 2HE MET 26 HE2 MET 26 9.555 15.178 -10.139 219 3HE MET 26 HE3 MET 26 8.205 15.779 -11.099 220 H TYR 27 H TYR 27 5.958 9.663 -12.657 221 HA TYR 27 HA TYR 27 7.975 7.455 -12.597 222 1HB TYR 27 HB2 TYR 27 5.760 6.583 -12.048 223 2HB TYR 27 HB3 TYR 27 5.075 7.355 -13.478 224 HD1 TYR 27 HD1 TYR 27 7.368 4.698 -12.287 225 HD2 TYR 27 HD2 TYR 27 5.358 6.412 -15.674 226 HE1 TYR 27 HE1 TYR 27 7.961 2.709 -13.645 227 HE2 TYR 27 HE2 TYR 27 5.951 4.423 -17.032 228 HH TYR 27 HH TYR 27 6.524 1.818 -16.320 229 H LYS 28 H LYS 28 9.336 7.657 -14.295 230 HA LYS 28 HA LYS 28 10.117 8.068 -16.464 231 1HB LYS 28 HB2 LYS 28 7.266 7.340 -16.809 232 2HB LYS 28 HB3 LYS 28 8.003 8.205 -18.159 233 1HG LYS 28 HG2 LYS 28 8.242 5.712 -18.328 234 2HG LYS 28 HG3 LYS 28 9.785 6.565 -18.312 235 1HD LYS 28 HD2 LYS 28 10.280 5.906 -16.124 236 2HD LYS 28 HD3 LYS 28 8.588 5.607 -15.727 237 1HE LYS 28 HE2 LYS 28 9.760 3.474 -15.983 238 2HE LYS 28 HE3 LYS 28 8.591 3.670 -17.288 239 1HZ LYS 28 HZ1 LYS 28 11.322 4.644 -17.703 240 2HZ LYS 28 HZ2 LYS 28 11.047 2.969 -17.776 241 3HZ LYS 28 HZ3 LYS 28 10.216 4.015 -18.826 242 H GLY 29 H GLY 29 8.707 10.258 -14.639 243 1HA GLY 29 HA2 GLY 29 9.141 12.628 -14.934 244 2HA GLY 29 HA3 GLY 29 9.071 12.393 -16.679 245 H GLN 30 H GLN 30 6.633 10.933 -14.654 246 HA GLN 30 HA GLN 30 4.734 13.111 -15.393 247 1HB GLN 30 HB2 GLN 30 4.551 11.166 -16.981 248 2HB GLN 30 HB3 GLN 30 4.102 10.156 -15.605 249 1HG GLN 30 HG2 GLN 30 1.975 10.792 -16.063 250 2HG GLN 30 HG3 GLN 30 2.423 12.325 -15.313 251 1HE2 GLN 30 HE21 GLN 30 0.461 12.291 -17.360 252 2HE2 GLN 30 HE22 GLN 30 1.095 13.039 -18.746 253 HA PRO 31 HA PRO 31 4.096 12.554 -10.968 254 1HB PRO 31 HB2 PRO 31 2.435 14.718 -10.711 255 2HB PRO 31 HB3 PRO 31 4.201 14.854 -10.799 256 1HG PRO 31 HG2 PRO 31 2.162 15.325 -12.952 257 2HG PRO 31 HG3 PRO 31 3.652 16.221 -12.602 258 1HD PRO 31 HD2 PRO 31 3.467 14.367 -14.618 259 2HD PRO 31 HD3 PRO 31 4.986 14.719 -13.761 260 H MET 32 H MET 32 2.776 10.780 -10.653 261 HA MET 32 HA MET 32 -0.145 11.178 -11.086 262 1HB MET 32 HB2 MET 32 1.538 9.370 -12.543 263 2HB MET 32 HB3 MET 32 0.458 8.425 -11.518 264 1HG MET 32 HG2 MET 32 -1.479 9.670 -12.402 265 2HG MET 32 HG3 MET 32 -0.403 10.620 -13.427 266 1HE MET 32 HE1 MET 32 -1.145 7.100 -12.253 267 2HE MET 32 HE2 MET 32 -0.778 6.051 -13.620 268 3HE MET 32 HE3 MET 32 0.529 6.857 -12.743 269 H THR 33 H THR 33 -1.449 10.047 -9.558 270 HA THR 33 HA THR 33 -0.118 9.488 -7.022 271 HB THR 33 HB THR 33 -2.272 10.525 -6.879 272 HG1 THR 33 HG1 THR 33 -2.423 9.194 -5.257 273 1HG2 THR 33 HG21 THR 33 -3.111 8.319 -8.760 274 2HG2 THR 33 HG22 THR 33 -4.289 9.245 -7.829 275 3HG2 THR 33 HG23 THR 33 -3.244 10.064 -8.991 276 H PHE 34 H PHE 34 -0.259 7.414 -5.901 277 HA PHE 34 HA PHE 34 -0.712 5.089 -7.719 278 1HB PHE 34 HB2 PHE 34 1.701 5.767 -6.072 279 2HB PHE 34 HB3 PHE 34 1.267 4.071 -6.291 280 HD1 PHE 34 HD1 PHE 34 2.216 7.196 -8.040 281 HD2 PHE 34 HD2 PHE 34 1.481 2.982 -8.431 282 HE1 PHE 34 HE1 PHE 34 3.209 7.234 -10.312 283 HE2 PHE 34 HE2 PHE 34 2.474 3.019 -10.704 284 HZ PHE 34 HZ PHE 34 3.338 5.146 -11.644 285 H ARG 35 H ARG 35 -1.598 3.259 -6.699 286 HA ARG 35 HA ARG 35 -2.316 3.627 -3.819 287 1HB ARG 35 HB2 ARG 35 -4.203 3.854 -5.565 288 2HB ARG 35 HB3 ARG 35 -4.013 2.116 -5.806 289 1HG ARG 35 HG2 ARG 35 -5.528 1.979 -4.103 290 2HG ARG 35 HG3 ARG 35 -4.105 2.224 -3.089 291 1HD ARG 35 HD2 ARG 35 -4.527 4.576 -2.910 292 2HD ARG 35 HD3 ARG 35 -5.761 4.515 -4.169 293 HE ARG 35 HE ARG 35 -6.521 2.771 -2.033 294 1HH1 ARG 35 HH11 ARG 35 -6.814 5.879 -3.373 295 2HH1 ARG 35 HH12 ARG 35 -7.725 6.535 -2.054 296 1HH2 ARG 35 HH21 ARG 35 -7.411 3.702 -0.082 297 2HH2 ARG 35 HH22 ARG 35 -8.062 5.303 -0.192 298 H LEU 36 H LEU 36 -1.656 1.975 -2.517 299 HA LEU 36 HA LEU 36 -0.033 -0.153 -3.444 300 1HB LEU 36 HB2 LEU 36 -1.699 -0.087 -0.910 301 2HB LEU 36 HB3 LEU 36 -0.282 -1.099 -1.203 302 HG LEU 36 HG LEU 36 -0.374 1.920 -1.005 303 1HD1 LEU 36 HD11 LEU 36 0.051 -0.112 0.890 304 2HD1 LEU 36 HD12 LEU 36 1.657 0.512 0.513 305 3HD1 LEU 36 HD13 LEU 36 0.398 1.605 1.089 306 1HD2 LEU 36 HD21 LEU 36 1.497 0.119 -2.396 307 2HD2 LEU 36 HD22 LEU 36 1.287 1.862 -2.557 308 3HD2 LEU 36 HD23 LEU 36 2.277 1.211 -1.250 309 H LEU 37 H LEU 37 -0.497 -2.216 -4.144 310 HA LEU 37 HA LEU 37 -3.320 -2.782 -4.791 311 1HB LEU 37 HB2 LEU 37 -0.659 -3.750 -5.702 312 2HB LEU 37 HB3 LEU 37 -1.995 -4.899 -5.795 313 HG LEU 37 HG LEU 37 -2.281 -2.090 -6.852 314 1HD1 LEU 37 HD11 LEU 37 -0.607 -4.231 -7.891 315 2HD1 LEU 37 HD12 LEU 37 -1.883 -3.806 -9.031 316 3HD1 LEU 37 HD13 LEU 37 -0.766 -2.568 -8.456 317 1HD2 LEU 37 HD21 LEU 37 -3.762 -4.678 -6.975 318 2HD2 LEU 37 HD22 LEU 37 -4.387 -3.031 -6.880 319 3HD2 LEU 37 HD23 LEU 37 -3.796 -3.664 -8.416 320 H LEU 38 H LEU 38 -4.387 -4.710 -4.185 321 HA LEU 38 HA LEU 38 -4.991 -6.460 -2.763 322 1HB LEU 38 HB2 LEU 38 -1.983 -6.674 -2.734 323 2HB LEU 38 HB3 LEU 38 -3.000 -7.785 -1.815 324 HG LEU 38 HG LEU 38 -3.605 -7.283 -4.714 325 1HD1 LEU 38 HD11 LEU 38 -1.232 -8.644 -3.593 326 2HD1 LEU 38 HD12 LEU 38 -2.139 -9.590 -4.773 327 3HD1 LEU 38 HD13 LEU 38 -1.504 -8.005 -5.216 328 1HD2 LEU 38 HD21 LEU 38 -4.398 -9.112 -2.573 329 2HD2 LEU 38 HD22 LEU 38 -5.208 -8.758 -4.099 330 3HD2 LEU 38 HD23 LEU 38 -3.926 -9.968 -4.041 331 H VAL 39 H VAL 39 -3.921 -3.620 -1.650 332 HA VAL 39 HA VAL 39 -4.376 -4.477 1.166 333 HB VAL 39 HB VAL 39 -2.553 -3.151 1.997 334 1HG1 VAL 39 HG11 VAL 39 -2.204 -5.405 0.436 335 2HG1 VAL 39 HG12 VAL 39 -1.039 -4.275 -0.254 336 3HG1 VAL 39 HG13 VAL 39 -0.966 -4.679 1.461 337 1HG2 VAL 39 HG21 VAL 39 -2.427 -2.174 -0.855 338 2HG2 VAL 39 HG22 VAL 39 -2.544 -1.227 0.628 339 3HG2 VAL 39 HG23 VAL 39 -1.033 -2.036 0.216 340 H ASP 40 H ASP 40 -5.564 -3.005 2.375 341 HA ASP 40 HA ASP 40 -6.365 -0.489 0.970 342 1HB ASP 40 HB2 ASP 40 -8.127 -2.342 1.038 343 2HB ASP 40 HB3 ASP 40 -8.174 -2.098 2.785 344 H THR 41 H THR 41 -5.994 1.316 2.169 345 HA THR 41 HA THR 41 -4.887 1.101 4.838 346 HB THR 41 HB THR 41 -4.207 2.899 3.289 347 HG1 THR 41 HG1 THR 41 -5.571 3.709 5.635 348 1HG2 THR 41 HG21 THR 41 -7.073 3.825 3.631 349 2HG2 THR 41 HG22 THR 41 -5.802 4.748 2.831 350 3HG2 THR 41 HG23 THR 41 -6.345 3.217 2.143 351 HA PRO 42 HA PRO 42 -8.708 1.272 7.070 352 1HB PRO 42 HB2 PRO 42 -7.641 1.816 9.525 353 2HB PRO 42 HB3 PRO 42 -7.523 0.225 8.754 354 1HG PRO 42 HG2 PRO 42 -5.436 2.334 9.054 355 2HG PRO 42 HG3 PRO 42 -5.257 0.573 8.998 356 1HD PRO 42 HD2 PRO 42 -4.751 2.327 6.863 357 2HD PRO 42 HD3 PRO 42 -4.987 0.572 6.722 358 H GLU 43 H GLU 43 -9.430 2.896 9.100 359 HA GLU 43 HA GLU 43 -10.142 5.343 7.986 360 1HB GLU 43 HB2 GLU 43 -10.305 4.148 10.546 361 2HB GLU 43 HB3 GLU 43 -9.588 5.741 10.792 362 1HG GLU 43 HG2 GLU 43 -11.548 6.772 10.370 363 2HG GLU 43 HG3 GLU 43 -11.770 5.861 8.877 364 H THR 44 H THR 44 -9.140 7.327 7.721 365 HA THR 44 HA THR 44 -6.807 8.183 9.137 366 HB THR 44 HB THR 44 -5.701 6.382 7.872 367 HG1 THR 44 HG1 THR 44 -4.091 7.681 7.592 368 1HG2 THR 44 HG21 THR 44 -7.432 6.520 5.982 369 2HG2 THR 44 HG22 THR 44 -6.469 7.858 5.353 370 3HG2 THR 44 HG23 THR 44 -5.756 6.252 5.502 371 H LYS 45 H LYS 45 -9.092 9.526 8.590 372 HA LYS 45 HA LYS 45 -8.807 11.117 6.143 373 1HB LYS 45 HB2 LYS 45 -10.777 10.887 8.356 374 2HB LYS 45 HB3 LYS 45 -10.659 12.467 7.580 375 1HG LYS 45 HG2 LYS 45 -10.629 10.356 5.595 376 2HG LYS 45 HG3 LYS 45 -12.058 10.223 6.620 377 1HD LYS 45 HD2 LYS 45 -11.203 12.863 5.427 378 2HD LYS 45 HD3 LYS 45 -12.251 11.745 4.552 379 1HE LYS 45 HE2 LYS 45 -12.866 12.656 7.368 380 2HE LYS 45 HE3 LYS 45 -13.434 13.536 5.949 381 1HZ LYS 45 HZ1 LYS 45 -13.886 10.671 5.919 382 2HZ LYS 45 HZ2 LYS 45 -14.775 11.537 7.080 383 3HZ LYS 45 HZ3 LYS 45 -14.908 11.941 5.438 384 H HIS 46 H HIS 46 -9.506 12.628 9.244 385 HA HIS 46 HA HIS 46 -7.757 14.827 8.736 386 1HB HIS 46 HB2 HIS 46 -9.597 14.025 10.798 387 2HB HIS 46 HB3 HIS 46 -8.101 14.589 11.543 388 HD1 HIS 46 HD1 HIS 46 -10.709 16.287 11.702 389 HD2 HIS 46 HD2 HIS 46 -7.751 16.791 8.811 390 HE1 HIS 46 HE1 HIS 46 -10.945 18.658 10.842 391 HA PRO 47 HA PRO 47 -3.925 12.941 9.980 392 1HB PRO 47 HB2 PRO 47 -2.397 15.185 9.699 393 2HB PRO 47 HB3 PRO 47 -3.000 14.253 8.318 394 1HG PRO 47 HG2 PRO 47 -3.905 16.889 9.343 395 2HG PRO 47 HG3 PRO 47 -4.004 16.224 7.705 396 1HD PRO 47 HD2 PRO 47 -6.113 16.358 9.607 397 2HD PRO 47 HD3 PRO 47 -6.133 15.482 8.060 398 H LYS 48 H LYS 48 -5.379 15.703 11.549 399 HA LYS 48 HA LYS 48 -3.554 15.343 13.888 400 1HB LYS 48 HB2 LYS 48 -4.660 17.672 12.581 401 2HB LYS 48 HB3 LYS 48 -5.166 17.629 14.271 402 1HG LYS 48 HG2 LYS 48 -2.298 17.085 13.545 403 2HG LYS 48 HG3 LYS 48 -2.879 18.746 13.672 404 1HD LYS 48 HD2 LYS 48 -3.864 17.298 15.928 405 2HD LYS 48 HD3 LYS 48 -2.136 16.973 15.787 406 1HE LYS 48 HE2 LYS 48 -1.659 19.372 15.707 407 2HE LYS 48 HE3 LYS 48 -3.384 19.737 15.759 408 1HZ LYS 48 HZ1 LYS 48 -3.416 18.461 17.908 409 2HZ LYS 48 HZ2 LYS 48 -1.718 18.500 17.871 410 3HZ LYS 48 HZ3 LYS 48 -2.603 19.948 17.950 411 H LYS 49 H LYS 49 -6.881 16.596 13.607 412 HA LYS 49 HA LYS 49 -7.737 15.516 16.091 413 1HB LYS 49 HB2 LYS 49 -9.005 16.764 13.744 414 2HB LYS 49 HB3 LYS 49 -10.054 15.643 14.614 415 1HG LYS 49 HG2 LYS 49 -9.937 16.869 16.604 416 2HG LYS 49 HG3 LYS 49 -8.435 17.667 16.137 417 1HD LYS 49 HD2 LYS 49 -9.659 18.912 14.376 418 2HD LYS 49 HD3 LYS 49 -11.161 18.146 14.898 419 1HE LYS 49 HE2 LYS 49 -9.457 19.619 16.890 420 2HE LYS 49 HE3 LYS 49 -10.554 20.513 15.838 421 1HZ LYS 49 HZ1 LYS 49 -12.188 18.622 16.646 422 2HZ LYS 49 HZ2 LYS 49 -11.156 18.638 17.991 423 3HZ LYS 49 HZ3 LYS 49 -11.966 20.057 17.528 424 H GLY 50 H GLY 50 -9.302 14.417 13.107 425 1HA GLY 50 HA2 GLY 50 -10.023 12.264 12.505 426 2HA GLY 50 HA3 GLY 50 -8.425 11.748 13.046 427 H VAL 51 H VAL 51 -8.579 10.153 14.538 428 HA VAL 51 HA VAL 51 -10.760 10.369 16.575 429 HB VAL 51 HB VAL 51 -9.622 7.772 15.513 430 1HG1 VAL 51 HG11 VAL 51 -11.897 8.571 17.321 431 2HG1 VAL 51 HG12 VAL 51 -11.923 7.028 16.467 432 3HG1 VAL 51 HG13 VAL 51 -10.626 7.383 17.608 433 1HG2 VAL 51 HG21 VAL 51 -11.996 9.413 14.613 434 2HG2 VAL 51 HG22 VAL 51 -10.707 8.729 13.624 435 3HG2 VAL 51 HG23 VAL 51 -11.919 7.671 14.348 436 H GLU 52 H GLU 52 -7.447 10.308 16.012 437 HA GLU 52 HA GLU 52 -5.627 10.228 17.490 438 1HB GLU 52 HB2 GLU 52 -7.704 10.043 19.688 439 2HB GLU 52 HB3 GLU 52 -6.041 10.613 19.830 440 1HG GLU 52 HG2 GLU 52 -6.523 12.662 18.938 441 2HG GLU 52 HG3 GLU 52 -7.719 12.006 17.818 442 H LYS 53 H LYS 53 -7.355 7.759 16.625 443 HA LYS 53 HA LYS 53 -6.235 5.865 18.649 444 1HB LYS 53 HB2 LYS 53 -8.819 6.039 17.767 445 2HB LYS 53 HB3 LYS 53 -8.163 4.831 16.661 446 1HG LYS 53 HG2 LYS 53 -8.267 3.279 18.283 447 2HG LYS 53 HG3 LYS 53 -7.187 4.249 19.285 448 1HD LYS 53 HD2 LYS 53 -8.892 4.732 20.667 449 2HD LYS 53 HD3 LYS 53 -9.768 5.475 19.328 450 1HE LYS 53 HE2 LYS 53 -11.174 3.721 20.171 451 2HE LYS 53 HE3 LYS 53 -10.495 3.136 18.652 452 1HZ LYS 53 HZ1 LYS 53 -8.704 2.090 20.037 453 2HZ LYS 53 HZ2 LYS 53 -9.646 2.448 21.406 454 3HZ LYS 53 HZ3 LYS 53 -10.249 1.406 20.210 455 H TYR 54 H TYR 54 -7.125 5.612 15.190 456 HA TYR 54 HA TYR 54 -4.341 4.680 14.652 457 1HB TYR 54 HB2 TYR 54 -6.898 3.349 13.707 458 2HB TYR 54 HB3 TYR 54 -5.279 2.918 13.159 459 HD1 TYR 54 HD1 TYR 54 -3.833 3.322 15.811 460 HD2 TYR 54 HD2 TYR 54 -7.503 1.319 14.823 461 HE1 TYR 54 HE1 TYR 54 -3.560 1.845 17.785 462 HE2 TYR 54 HE2 TYR 54 -7.229 -0.157 16.796 463 HH TYR 54 HH TYR 54 -4.849 0.450 19.228 464 H GLY 55 H GLY 55 -6.530 6.978 14.010 465 1HA GLY 55 HA2 GLY 55 -6.720 7.088 11.172 466 2HA GLY 55 HA3 GLY 55 -6.809 8.491 12.238 467 HA PRO 56 HA PRO 56 -2.762 9.741 11.044 468 1HB PRO 56 HB2 PRO 56 -1.751 10.710 13.389 469 2HB PRO 56 HB3 PRO 56 -3.046 11.519 12.489 470 1HG PRO 56 HG2 PRO 56 -3.215 9.896 14.985 471 2HG PRO 56 HG3 PRO 56 -4.209 11.265 14.463 472 1HD PRO 56 HD2 PRO 56 -4.956 8.564 14.302 473 2HD PRO 56 HD3 PRO 56 -5.723 9.901 13.417 474 H GLU 57 H GLU 57 -2.229 7.289 10.803 475 HA GLU 57 HA GLU 57 0.229 6.761 12.333 476 1HB GLU 57 HB2 GLU 57 -1.728 5.738 13.626 477 2HB GLU 57 HB3 GLU 57 -1.925 4.639 12.261 478 1HG GLU 57 HG2 GLU 57 0.514 4.019 12.528 479 2HG GLU 57 HG3 GLU 57 0.513 4.942 14.031 480 H ALA 58 H ALA 58 -2.103 5.513 9.939 481 HA ALA 58 HA ALA 58 -0.072 3.932 8.570 482 1HB ALA 58 HB1 ALA 58 -2.959 4.452 8.297 483 2HB ALA 58 HB2 ALA 58 -2.121 4.243 6.759 484 3HB ALA 58 HB3 ALA 58 -2.047 2.975 7.983 485 H SER 59 H SER 59 -1.789 6.989 7.866 486 HA SER 59 HA SER 59 -0.435 7.543 5.416 487 1HB SER 59 HB2 SER 59 -0.968 10.018 6.209 488 2HB SER 59 HB3 SER 59 -2.268 8.933 5.725 489 HG SER 59 HG SER 59 -2.770 9.840 7.712 490 H ALA 60 H ALA 60 0.324 8.474 8.778 491 HA ALA 60 HA ALA 60 2.685 9.969 8.084 492 1HB ALA 60 HB1 ALA 60 1.341 9.968 10.309 493 2HB ALA 60 HB2 ALA 60 2.310 8.551 10.719 494 3HB ALA 60 HB3 ALA 60 3.096 10.098 10.404 495 H PHE 61 H PHE 61 2.052 6.568 8.704 496 HA PHE 61 HA PHE 61 4.721 5.686 9.123 497 1HB PHE 61 HB2 PHE 61 2.623 4.295 9.380 498 2HB PHE 61 HB3 PHE 61 2.575 4.167 7.621 499 HD1 PHE 61 HD1 PHE 61 4.458 3.264 10.670 500 HD2 PHE 61 HD2 PHE 61 4.191 2.828 6.404 501 HE1 PHE 61 HE1 PHE 61 6.101 1.408 10.756 502 HE2 PHE 61 HE2 PHE 61 5.835 0.973 6.491 503 HZ PHE 61 HZ PHE 61 6.790 0.263 8.666 504 H THR 62 H THR 62 2.902 5.338 6.074 505 HA THR 62 HA THR 62 5.197 4.883 4.455 506 HB THR 62 HB THR 62 2.652 6.227 3.515 507 HG1 THR 62 HG1 THR 62 3.110 3.704 4.528 508 1HG2 THR 62 HG21 THR 62 4.910 4.721 2.271 509 2HG2 THR 62 HG22 THR 62 3.300 4.519 1.579 510 3HG2 THR 62 HG23 THR 62 4.028 6.123 1.666 511 H LYS 63 H LYS 63 3.918 7.793 5.821 512 HA LYS 63 HA LYS 63 4.979 9.683 3.949 513 1HB LYS 63 HB2 LYS 63 3.316 10.153 5.814 514 2HB LYS 63 HB3 LYS 63 4.682 10.115 6.928 515 1HG LYS 63 HG2 LYS 63 5.622 12.055 6.063 516 2HG LYS 63 HG3 LYS 63 4.867 11.837 4.482 517 1HD LYS 63 HD2 LYS 63 2.686 12.432 5.390 518 2HD LYS 63 HD3 LYS 63 3.357 12.529 7.019 519 1HE LYS 63 HE2 LYS 63 4.572 14.481 6.541 520 2HE LYS 63 HE3 LYS 63 4.507 14.207 4.800 521 1HZ LYS 63 HZ1 LYS 63 1.950 14.495 6.149 522 2HZ LYS 63 HZ2 LYS 63 2.903 15.894 6.074 523 3HZ LYS 63 HZ3 LYS 63 2.461 15.094 4.643 524 H LYS 64 H LYS 64 6.262 8.997 7.208 525 HA LYS 64 HA LYS 64 8.829 10.128 6.684 526 1HB LYS 64 HB2 LYS 64 8.107 7.967 8.687 527 2HB LYS 64 HB3 LYS 64 9.543 8.992 8.737 528 1HG LYS 64 HG2 LYS 64 8.398 10.735 9.616 529 2HG LYS 64 HG3 LYS 64 7.056 10.524 8.492 530 1HD LYS 64 HD2 LYS 64 5.836 9.584 10.128 531 2HD LYS 64 HD3 LYS 64 7.039 8.303 10.280 532 1HE LYS 64 HE2 LYS 64 8.359 9.721 11.809 533 2HE LYS 64 HE3 LYS 64 7.154 11.000 11.663 534 1HZ LYS 64 HZ1 LYS 64 6.300 8.307 12.469 535 2HZ LYS 64 HZ2 LYS 64 7.039 9.317 13.619 536 3HZ LYS 64 HZ3 LYS 64 5.613 9.815 12.846 537 H MET 65 H MET 65 7.528 6.914 6.109 538 HA MET 65 HA MET 65 9.969 5.504 5.754 539 1HB MET 65 HB2 MET 65 7.168 5.068 5.200 540 2HB MET 65 HB3 MET 65 8.148 4.507 3.844 541 1HG MET 65 HG2 MET 65 7.819 2.740 5.572 542 2HG MET 65 HG3 MET 65 9.519 3.153 5.346 543 1HE MET 65 HE1 MET 65 10.806 3.035 6.789 544 2HE MET 65 HE2 MET 65 10.940 3.973 8.276 545 3HE MET 65 HE3 MET 65 10.253 2.352 8.325 546 H VAL 66 H VAL 66 7.885 6.511 3.048 547 HA VAL 66 HA VAL 66 9.906 6.393 1.077 548 HB VAL 66 HB VAL 66 8.424 7.722 -0.317 549 1HG1 VAL 66 HG11 VAL 66 7.678 5.391 1.056 550 2HG1 VAL 66 HG12 VAL 66 6.260 6.437 1.138 551 3HG1 VAL 66 HG13 VAL 66 6.955 6.014 -0.427 552 1HG2 VAL 66 HG21 VAL 66 7.537 8.714 2.334 553 2HG2 VAL 66 HG22 VAL 66 7.606 9.554 0.785 554 3HG2 VAL 66 HG23 VAL 66 6.255 8.478 1.147 555 H GLU 67 H GLU 67 9.162 8.899 3.412 556 HA GLU 67 HA GLU 67 10.548 11.064 2.177 557 1HB GLU 67 HB2 GLU 67 9.901 10.379 5.041 558 2HB GLU 67 HB3 GLU 67 10.844 11.816 4.640 559 1HG GLU 67 HG2 GLU 67 8.277 11.307 3.174 560 2HG GLU 67 HG3 GLU 67 8.214 11.969 4.807 561 H ASN 68 H ASN 68 11.676 8.449 4.285 562 HA ASN 68 HA ASN 68 14.459 9.465 3.996 563 1HB ASN 68 HB2 ASN 68 13.452 7.185 5.722 564 2HB ASN 68 HB3 ASN 68 15.031 7.965 5.809 565 1HD2 ASN 68 HD21 ASN 68 12.126 7.900 7.391 566 2HD2 ASN 68 HD22 ASN 68 12.098 9.480 8.012 567 H ALA 69 H ALA 69 12.441 7.527 2.294 568 HA ALA 69 HA ALA 69 14.000 5.148 1.890 569 1HB ALA 69 HB1 ALA 69 11.586 5.460 1.217 570 2HB ALA 69 HB2 ALA 69 12.150 6.477 -0.110 571 3HB ALA 69 HB3 ALA 69 12.605 4.773 -0.049 572 H LYS 70 H LYS 70 16.013 5.096 1.027 573 HA LYS 70 HA LYS 70 17.208 7.324 -0.327 574 1HB LYS 70 HB2 LYS 70 18.054 4.412 -0.305 575 2HB LYS 70 HB3 LYS 70 19.066 5.771 -0.796 576 1HG LYS 70 HG2 LYS 70 19.131 6.662 1.400 577 2HG LYS 70 HG3 LYS 70 17.770 5.673 1.930 578 1HD LYS 70 HD2 LYS 70 19.706 3.856 0.980 579 2HD LYS 70 HD3 LYS 70 20.590 5.035 1.949 580 1HE LYS 70 HE2 LYS 70 18.346 4.583 3.486 581 2HE LYS 70 HE3 LYS 70 18.658 2.989 2.799 582 1HZ LYS 70 HZ1 LYS 70 20.959 4.467 3.807 583 2HZ LYS 70 HZ2 LYS 70 19.873 3.866 4.967 584 3HZ LYS 70 HZ3 LYS 70 20.620 2.804 3.876 585 H LYS 71 H LYS 71 15.667 4.354 -1.487 586 HA LYS 71 HA LYS 71 15.669 5.562 -4.217 587 1HB LYS 71 HB2 LYS 71 16.156 2.636 -3.580 588 2HB LYS 71 HB3 LYS 71 16.088 3.350 -5.192 589 1HG LYS 71 HG2 LYS 71 18.084 4.588 -4.848 590 2HG LYS 71 HG3 LYS 71 18.038 4.331 -3.104 591 1HD LYS 71 HD2 LYS 71 18.032 1.751 -4.186 592 2HD LYS 71 HD3 LYS 71 19.185 2.644 -5.180 593 1HE LYS 71 HE2 LYS 71 19.250 2.842 -2.171 594 2HE LYS 71 HE3 LYS 71 20.072 1.530 -3.015 595 1HZ LYS 71 HZ1 LYS 71 20.628 4.007 -4.263 596 2HZ LYS 71 HZ2 LYS 71 21.002 4.100 -2.609 597 3HZ LYS 71 HZ3 LYS 71 21.707 2.894 -3.570 598 H ILE 72 H ILE 72 13.614 5.748 -4.944 599 HA ILE 72 HA ILE 72 11.526 4.007 -3.709 600 HB ILE 72 HB ILE 72 11.281 6.659 -5.164 601 1HG1 ILE 72 HG12 ILE 72 10.421 6.302 -2.344 602 2HG1 ILE 72 HG13 ILE 72 12.162 6.265 -2.626 603 1HG2 ILE 72 HG21 ILE 72 9.361 4.918 -5.339 604 2HG2 ILE 72 HG22 ILE 72 9.105 5.247 -3.625 605 3HG2 ILE 72 HG23 ILE 72 8.952 6.548 -4.806 606 1HD1 ILE 72 HD11 ILE 72 10.363 8.441 -3.717 607 2HD1 ILE 72 HD12 ILE 72 11.199 8.571 -2.170 608 3HD1 ILE 72 HD13 ILE 72 12.126 8.431 -3.664 609 H GLU 73 H GLU 73 11.015 2.297 -4.992 610 HA GLU 73 HA GLU 73 10.897 2.769 -7.942 611 1HB GLU 73 HB2 GLU 73 11.850 0.287 -6.483 612 2HB GLU 73 HB3 GLU 73 11.629 0.404 -8.229 613 1HG GLU 73 HG2 GLU 73 13.441 1.828 -8.502 614 2HG GLU 73 HG3 GLU 73 13.322 2.462 -6.860 615 H VAL 74 H VAL 74 9.071 1.965 -8.966 616 HA VAL 74 HA VAL 74 7.019 0.741 -7.176 617 HB VAL 74 HB VAL 74 5.454 1.449 -9.094 618 1HG1 VAL 74 HG11 VAL 74 6.982 3.487 -7.451 619 2HG1 VAL 74 HG12 VAL 74 5.494 3.851 -8.326 620 3HG1 VAL 74 HG13 VAL 74 5.479 2.677 -7.009 621 1HG2 VAL 74 HG21 VAL 74 7.515 1.776 -10.632 622 2HG2 VAL 74 HG22 VAL 74 6.246 2.999 -10.696 623 3HG2 VAL 74 HG23 VAL 74 7.726 3.312 -9.790 624 H GLU 75 H GLU 75 5.669 -0.978 -8.147 625 HA GLU 75 HA GLU 75 6.980 -2.389 -10.422 626 1HB GLU 75 HB2 GLU 75 7.651 -3.348 -8.147 627 2HB GLU 75 HB3 GLU 75 5.965 -3.838 -7.968 628 1HG GLU 75 HG2 GLU 75 6.147 -5.052 -10.157 629 2HG GLU 75 HG3 GLU 75 7.870 -4.674 -10.173 630 H PHE 76 H PHE 76 5.194 -1.626 -11.708 631 HA PHE 76 HA PHE 76 2.458 -1.858 -11.081 632 1HB PHE 76 HB2 PHE 76 3.869 -2.145 -13.749 633 2HB PHE 76 HB3 PHE 76 2.119 -2.006 -13.574 634 HD1 PHE 76 HD1 PHE 76 5.347 -0.261 -13.196 635 HD2 PHE 76 HD2 PHE 76 1.077 0.083 -12.883 636 HE1 PHE 76 HE1 PHE 76 5.557 2.207 -13.052 637 HE2 PHE 76 HE2 PHE 76 1.286 2.550 -12.739 638 HZ PHE 76 HZ PHE 76 3.525 3.611 -12.823 639 H ASP 77 H ASP 77 0.911 -3.522 -11.488 640 HA ASP 77 HA ASP 77 2.024 -6.238 -11.263 641 1HB ASP 77 HB2 ASP 77 -0.201 -5.047 -10.200 642 2HB ASP 77 HB3 ASP 77 -0.898 -5.921 -11.564 643 H LYS 78 H LYS 78 0.501 -7.907 -12.620 644 HA LYS 78 HA LYS 78 1.043 -7.211 -15.436 645 1HB LYS 78 HB2 LYS 78 0.537 -9.569 -15.888 646 2HB LYS 78 HB3 LYS 78 1.678 -9.446 -14.548 647 1HG LYS 78 HG2 LYS 78 -1.094 -9.343 -13.638 648 2HG LYS 78 HG3 LYS 78 -0.738 -10.832 -14.513 649 1HD LYS 78 HD2 LYS 78 1.258 -9.884 -12.500 650 2HD LYS 78 HD3 LYS 78 -0.234 -10.614 -11.905 651 1HE LYS 78 HE2 LYS 78 0.577 -12.658 -12.369 652 2HE LYS 78 HE3 LYS 78 0.724 -12.215 -14.069 653 1HZ LYS 78 HZ1 LYS 78 2.862 -11.084 -13.394 654 2HZ LYS 78 HZ2 LYS 78 2.737 -11.920 -11.921 655 3HZ LYS 78 HZ3 LYS 78 2.873 -12.779 -13.380 656 H GLY 79 H GLY 79 -1.611 -7.293 -13.245 657 1HA GLY 79 HA2 GLY 79 -3.723 -7.732 -15.168 658 2HA GLY 79 HA3 GLY 79 -3.924 -7.021 -13.565 659 H GLN 80 H GLN 80 -5.009 -5.126 -13.927 660 HA GLN 80 HA GLN 80 -4.549 -3.504 -16.295 661 1HB GLN 80 HB2 GLN 80 -5.926 -2.602 -13.758 662 2HB GLN 80 HB3 GLN 80 -6.207 -2.041 -15.408 663 1HG GLN 80 HG2 GLN 80 -7.873 -3.558 -15.518 664 2HG GLN 80 HG3 GLN 80 -6.619 -4.797 -15.552 665 1HE2 GLN 80 HE21 GLN 80 -8.133 -6.226 -14.323 666 2HE2 GLN 80 HE22 GLN 80 -8.326 -6.004 -12.651 667 H ARG 81 H ARG 81 -3.526 -1.430 -16.350 668 HA ARG 81 HA ARG 81 -1.360 -1.157 -14.356 669 1HB ARG 81 HB2 ARG 81 -1.146 -0.947 -16.960 670 2HB ARG 81 HB3 ARG 81 -1.755 0.687 -16.698 671 1HG ARG 81 HG2 ARG 81 0.451 -0.243 -14.921 672 2HG ARG 81 HG3 ARG 81 0.864 0.123 -16.596 673 1HD ARG 81 HD2 ARG 81 -0.872 2.182 -15.614 674 2HD ARG 81 HD3 ARG 81 0.446 1.960 -14.463 675 HE ARG 81 HE ARG 81 1.872 2.939 -16.053 676 1HH1 ARG 81 HH11 ARG 81 -0.999 3.470 -17.394 677 2HH1 ARG 81 HH12 ARG 81 -0.559 3.184 -19.044 678 1HH2 ARG 81 HH21 ARG 81 2.498 1.747 -18.258 679 2HH2 ARG 81 HH22 ARG 81 1.420 2.207 -19.534 680 H THR 82 H THR 82 -4.459 0.145 -14.974 681 HA THR 82 HA THR 82 -4.089 2.084 -12.794 682 HB THR 82 HB THR 82 -4.425 4.041 -13.986 683 HG1 THR 82 HG1 THR 82 -6.047 4.038 -15.290 684 1HG2 THR 82 HG21 THR 82 -3.123 2.177 -15.990 685 2HG2 THR 82 HG22 THR 82 -3.110 3.936 -16.111 686 3HG2 THR 82 HG23 THR 82 -2.301 3.140 -14.760 687 H ASP 83 H ASP 83 -6.124 2.763 -11.906 688 HA ASP 83 HA ASP 83 -8.328 0.905 -12.547 689 1HB ASP 83 HB2 ASP 83 -7.499 2.512 -10.240 690 2HB ASP 83 HB3 ASP 83 -9.232 2.603 -10.550 691 H LYS 84 H LYS 84 -10.560 2.416 -11.950 692 HA LYS 84 HA LYS 84 -10.911 3.914 -14.411 693 1HB LYS 84 HB2 LYS 84 -13.184 4.337 -13.563 694 2HB LYS 84 HB3 LYS 84 -12.759 2.635 -13.373 695 1HG LYS 84 HG2 LYS 84 -12.424 2.851 -11.051 696 2HG LYS 84 HG3 LYS 84 -12.273 4.606 -11.144 697 1HD LYS 84 HD2 LYS 84 -14.465 3.968 -10.212 698 2HD LYS 84 HD3 LYS 84 -14.656 4.779 -11.767 699 1HE LYS 84 HE2 LYS 84 -15.687 2.974 -12.625 700 2HE LYS 84 HE3 LYS 84 -14.306 1.957 -12.209 701 1HZ LYS 84 HZ1 LYS 84 -16.177 2.770 -10.096 702 2HZ LYS 84 HZ2 LYS 84 -16.623 1.516 -11.152 703 3HZ LYS 84 HZ3 LYS 84 -15.220 1.371 -10.210 704 H TYR 85 H TYR 85 -10.077 4.720 -11.120 705 HA TYR 85 HA TYR 85 -10.718 7.554 -11.382 706 1HB TYR 85 HB2 TYR 85 -9.069 6.001 -9.369 707 2HB TYR 85 HB3 TYR 85 -9.363 7.736 -9.256 708 HD1 TYR 85 HD1 TYR 85 -10.993 4.400 -9.273 709 HD2 TYR 85 HD2 TYR 85 -11.477 8.604 -8.538 710 HE1 TYR 85 HE1 TYR 85 -13.190 3.961 -8.208 711 HE2 TYR 85 HE2 TYR 85 -13.674 8.166 -7.474 712 HH TYR 85 HH TYR 85 -15.466 5.787 -7.865 713 H GLY 86 H GLY 86 -8.447 5.734 -12.895 714 1HA GLY 86 HA2 GLY 86 -6.592 6.424 -14.179 715 2HA GLY 86 HA3 GLY 86 -6.829 8.062 -13.566 716 H ARG 87 H ARG 87 -6.658 5.539 -11.219 717 HA ARG 87 HA ARG 87 -4.162 6.683 -10.171 718 1HB ARG 87 HB2 ARG 87 -6.213 4.730 -9.186 719 2HB ARG 87 HB3 ARG 87 -4.609 4.718 -8.452 720 1HG ARG 87 HG2 ARG 87 -4.801 7.099 -7.919 721 2HG ARG 87 HG3 ARG 87 -6.373 7.170 -8.717 722 1HD ARG 87 HD2 ARG 87 -6.315 5.016 -6.780 723 2HD ARG 87 HD3 ARG 87 -5.882 6.547 -6.018 724 HE ARG 87 HE ARG 87 -8.043 7.458 -6.848 725 1HH1 ARG 87 HH11 ARG 87 -7.610 4.270 -7.916 726 2HH1 ARG 87 HH12 ARG 87 -9.234 3.767 -7.580 727 1HH2 ARG 87 HH21 ARG 87 -10.109 6.729 -6.005 728 2HH2 ARG 87 HH22 ARG 87 -10.648 5.159 -6.499 729 H GLY 88 H GLY 88 -2.186 5.567 -10.032 730 1HA GLY 88 HA2 GLY 88 -1.871 3.372 -11.979 731 2HA GLY 88 HA3 GLY 88 -0.562 4.228 -11.163 732 H LEU 89 H LEU 89 -1.675 1.250 -11.393 733 HA LEU 89 HA LEU 89 -1.635 0.640 -8.477 734 1HB LEU 89 HB2 LEU 89 -2.263 -1.183 -10.819 735 2HB LEU 89 HB3 LEU 89 -2.481 -1.561 -9.109 736 HG LEU 89 HG LEU 89 -3.783 0.926 -10.078 737 1HD1 LEU 89 HD11 LEU 89 -4.641 -1.857 -10.900 738 2HD1 LEU 89 HD12 LEU 89 -5.753 -0.489 -10.863 739 3HD1 LEU 89 HD13 LEU 89 -4.359 -0.463 -11.943 740 1HD2 LEU 89 HD21 LEU 89 -4.313 -1.310 -8.136 741 2HD2 LEU 89 HD22 LEU 89 -4.236 0.426 -7.835 742 3HD2 LEU 89 HD23 LEU 89 -5.637 -0.265 -8.651 743 H ALA 90 H ALA 90 0.284 0.016 -7.629 744 HA ALA 90 HA ALA 90 1.979 -1.934 -8.913 745 1HB ALA 90 HB1 ALA 90 2.535 0.111 -10.254 746 2HB ALA 90 HB2 ALA 90 3.079 0.887 -8.766 747 3HB ALA 90 HB3 ALA 90 3.916 -0.541 -9.373 748 H TYR 91 H TYR 91 3.438 -2.793 -7.408 749 HA TYR 91 HA TYR 91 2.991 -2.081 -4.630 750 1HB TYR 91 HB2 TYR 91 5.163 -3.867 -5.765 751 2HB TYR 91 HB3 TYR 91 4.519 -3.882 -4.121 752 HD1 TYR 91 HD1 TYR 91 2.153 -4.591 -3.711 753 HD2 TYR 91 HD2 TYR 91 4.023 -4.971 -7.559 754 HE1 TYR 91 HE1 TYR 91 0.379 -6.173 -4.416 755 HE2 TYR 91 HE2 TYR 91 2.250 -6.554 -8.265 756 HH TYR 91 HH TYR 91 0.635 -8.157 -7.067 757 H ILE 92 H ILE 92 4.067 -0.539 -3.503 758 HA ILE 92 HA ILE 92 6.303 0.880 -4.761 759 HB ILE 92 HB ILE 92 5.039 1.236 -2.026 760 1HG1 ILE 92 HG12 ILE 92 4.574 2.734 -4.626 761 2HG1 ILE 92 HG13 ILE 92 3.460 1.557 -3.927 762 1HG2 ILE 92 HG21 ILE 92 7.423 2.151 -2.559 763 2HG2 ILE 92 HG22 ILE 92 6.572 3.308 -3.582 764 3HG2 ILE 92 HG23 ILE 92 6.236 3.248 -1.852 765 1HD1 ILE 92 HD11 ILE 92 3.327 2.963 -1.870 766 2HD1 ILE 92 HD12 ILE 92 4.349 4.165 -2.658 767 3HD1 ILE 92 HD13 ILE 92 2.746 3.808 -3.305 768 H TYR 93 H TYR 93 8.453 0.842 -4.053 769 HA TYR 93 HA TYR 93 9.088 -1.081 -1.855 770 1HB TYR 93 HB2 TYR 93 10.424 -0.803 -4.558 771 2HB TYR 93 HB3 TYR 93 11.166 -1.649 -3.200 772 HD1 TYR 93 HD1 TYR 93 10.235 -3.749 -2.352 773 HD2 TYR 93 HD2 TYR 93 8.442 -1.696 -5.672 774 HE1 TYR 93 HE1 TYR 93 8.912 -5.777 -2.892 775 HE2 TYR 93 HE2 TYR 93 7.121 -3.723 -6.212 776 HH TYR 93 HH TYR 93 7.731 -6.777 -4.675 777 H ALA 94 H ALA 94 10.125 -0.001 -0.263 778 HA ALA 94 HA ALA 94 11.765 2.383 -1.012 779 1HB ALA 94 HB1 ALA 94 9.686 2.112 0.878 780 2HB ALA 94 HB2 ALA 94 11.178 2.206 1.815 781 3HB ALA 94 HB3 ALA 94 10.768 3.491 0.679 782 H ASP 95 H ASP 95 13.926 2.092 -0.777 783 HA ASP 95 HA ASP 95 15.971 1.275 0.034 784 1HB ASP 95 HB2 ASP 95 14.316 0.247 2.360 785 2HB ASP 95 HB3 ASP 95 16.066 0.468 2.332 786 H GLY 96 H GLY 96 13.918 -0.398 -1.515 787 1HA GLY 96 HA2 GLY 96 14.178 -2.520 -2.547 788 2HA GLY 96 HA3 GLY 96 15.467 -2.885 -1.400 789 H LYS 97 H LYS 97 12.595 -1.695 0.040 790 HA LYS 97 HA LYS 97 11.846 -4.494 0.798 791 1HB LYS 97 HB2 LYS 97 12.817 -2.911 2.599 792 2HB LYS 97 HB3 LYS 97 11.282 -2.051 2.481 793 1HG LYS 97 HG2 LYS 97 10.080 -3.780 3.413 794 2HG LYS 97 HG3 LYS 97 11.163 -5.016 2.772 795 1HD LYS 97 HD2 LYS 97 12.536 -3.268 4.653 796 2HD LYS 97 HD3 LYS 97 11.135 -4.045 5.393 797 1HE LYS 97 HE2 LYS 97 11.983 -6.187 5.079 798 2HE LYS 97 HE3 LYS 97 12.983 -5.700 3.710 799 1HZ LYS 97 HZ1 LYS 97 13.555 -4.529 6.332 800 2HZ LYS 97 HZ2 LYS 97 14.020 -6.139 6.060 801 3HZ LYS 97 HZ3 LYS 97 14.613 -4.901 5.060 802 H MET 98 H MET 98 9.637 -5.016 0.736 803 HA MET 98 HA MET 98 7.986 -3.382 -1.003 804 1HB MET 98 HB2 MET 98 7.782 -5.827 -1.005 805 2HB MET 98 HB3 MET 98 7.289 -5.804 0.688 806 1HG MET 98 HG2 MET 98 5.161 -5.580 -0.011 807 2HG MET 98 HG3 MET 98 5.587 -3.974 -0.603 808 1HE MET 98 HE1 MET 98 6.577 -7.385 -1.118 809 2HE MET 98 HE2 MET 98 5.486 -7.990 -2.371 810 3HE MET 98 HE3 MET 98 7.093 -7.411 -2.801 811 H VAL 99 H VAL 99 7.334 -1.437 -0.138 812 HA VAL 99 HA VAL 99 6.884 -0.786 2.545 813 HB VAL 99 HB VAL 99 5.423 0.219 0.084 814 1HG1 VAL 99 HG11 VAL 99 4.658 0.585 2.722 815 2HG1 VAL 99 HG12 VAL 99 5.653 2.005 2.401 816 3HG1 VAL 99 HG13 VAL 99 4.254 1.660 1.384 817 1HG2 VAL 99 HG21 VAL 99 8.053 0.447 0.607 818 2HG2 VAL 99 HG22 VAL 99 7.134 1.742 -0.159 819 3HG2 VAL 99 HG23 VAL 99 7.467 1.802 1.571 820 H ASN 100 H ASN 100 4.666 -2.354 0.261 821 HA ASN 100 HA ASN 100 2.317 -2.273 1.849 822 1HB ASN 100 HB2 ASN 100 3.239 -4.462 -0.040 823 2HB ASN 100 HB3 ASN 100 1.587 -4.231 0.535 824 1HD2 ASN 100 HD21 ASN 100 1.312 -4.028 -1.991 825 2HD2 ASN 100 HD22 ASN 100 1.460 -2.463 -2.633 826 H GLU 101 H GLU 101 4.951 -4.682 1.782 827 HA GLU 101 HA GLU 101 3.772 -6.392 3.772 828 1HB GLU 101 HB2 GLU 101 5.524 -7.243 2.316 829 2HB GLU 101 HB3 GLU 101 6.657 -6.030 2.914 830 1HG GLU 101 HG2 GLU 101 5.496 -7.492 5.126 831 2HG GLU 101 HG3 GLU 101 6.226 -8.606 3.969 832 H ALA 102 H ALA 102 6.036 -3.673 3.951 833 HA ALA 102 HA ALA 102 6.666 -3.907 6.720 834 1HB ALA 102 HB1 ALA 102 7.137 -2.029 4.610 835 2HB ALA 102 HB2 ALA 102 6.553 -1.143 6.020 836 3HB ALA 102 HB3 ALA 102 7.980 -2.171 6.152 837 H LEU 103 H LEU 103 3.917 -2.468 5.049 838 HA LEU 103 HA LEU 103 2.846 -1.147 7.394 839 1HB LEU 103 HB2 LEU 103 1.683 -1.920 4.714 840 2HB LEU 103 HB3 LEU 103 0.699 -1.169 5.972 841 HG LEU 103 HG LEU 103 3.308 0.131 5.380 842 1HD1 LEU 103 HD11 LEU 103 1.999 -0.593 3.174 843 2HD1 LEU 103 HD12 LEU 103 1.016 0.813 3.583 844 3HD1 LEU 103 HD13 LEU 103 2.749 0.998 3.310 845 1HD2 LEU 103 HD21 LEU 103 1.372 0.809 7.021 846 2HD2 LEU 103 HD22 LEU 103 2.163 2.060 6.061 847 3HD2 LEU 103 HD23 LEU 103 0.595 1.424 5.562 848 H VAL 104 H VAL 104 1.904 -4.149 5.671 849 HA VAL 104 HA VAL 104 -0.106 -5.003 7.437 850 HB VAL 104 HB VAL 104 1.942 -6.730 6.011 851 1HG1 VAL 104 HG11 VAL 104 -0.477 -7.296 7.626 852 2HG1 VAL 104 HG12 VAL 104 -0.376 -8.156 6.089 853 3HG1 VAL 104 HG13 VAL 104 0.914 -8.325 7.281 854 1HG2 VAL 104 HG21 VAL 104 0.411 -4.998 4.738 855 2HG2 VAL 104 HG22 VAL 104 0.573 -6.642 4.122 856 3HG2 VAL 104 HG23 VAL 104 -0.853 -6.187 5.053 857 H ARG 105 H ARG 105 3.416 -5.325 7.739 858 HA ARG 105 HA ARG 105 3.391 -7.019 10.053 859 1HB ARG 105 HB2 ARG 105 5.389 -6.444 8.552 860 2HB ARG 105 HB3 ARG 105 5.495 -4.930 9.451 861 1HG ARG 105 HG2 ARG 105 5.400 -6.528 11.553 862 2HG ARG 105 HG3 ARG 105 5.975 -7.734 10.401 863 1HD ARG 105 HD2 ARG 105 7.305 -5.139 11.192 864 2HD ARG 105 HD3 ARG 105 7.944 -6.776 11.338 865 HE ARG 105 HE ARG 105 7.522 -5.430 8.697 866 1HH1 ARG 105 HH11 ARG 105 8.244 -8.452 9.533 867 2HH1 ARG 105 HH12 ARG 105 9.888 -8.472 8.987 868 1HH2 ARG 105 HH21 ARG 105 10.068 -5.035 8.561 869 2HH2 ARG 105 HH22 ARG 105 10.919 -6.538 8.436 870 H GLN 106 H GLN 106 3.484 -3.474 9.689 871 HA GLN 106 HA GLN 106 3.529 -2.976 12.542 872 1HB GLN 106 HB2 GLN 106 3.410 -1.401 10.069 873 2HB GLN 106 HB3 GLN 106 2.464 -0.699 11.382 874 1HG GLN 106 HG2 GLN 106 4.914 0.013 11.278 875 2HG GLN 106 HG3 GLN 106 4.362 -0.613 12.832 876 1HE2 GLN 106 HE21 GLN 106 6.203 -1.501 9.899 877 2HE2 GLN 106 HE22 GLN 106 7.038 -2.791 10.619 878 H GLY 107 H GLY 107 1.108 -4.056 10.438 879 1HA GLY 107 HA2 GLY 107 -1.151 -4.542 10.903 880 2HA GLY 107 HA3 GLY 107 -0.907 -3.897 12.527 881 H LEU 108 H LEU 108 -0.285 -2.177 9.492 882 HA LEU 108 HA LEU 108 -2.469 -0.278 10.259 883 1HB LEU 108 HB2 LEU 108 0.213 0.241 8.947 884 2HB LEU 108 HB3 LEU 108 -1.077 1.441 9.021 885 HG LEU 108 HG LEU 108 -0.026 0.051 11.492 886 1HD1 LEU 108 HD11 LEU 108 0.888 2.641 10.206 887 2HD1 LEU 108 HD12 LEU 108 1.273 2.173 11.862 888 3HD1 LEU 108 HD13 LEU 108 1.868 1.206 10.512 889 1HD2 LEU 108 HD21 LEU 108 -2.212 1.758 10.961 890 2HD2 LEU 108 HD22 LEU 108 -1.595 1.284 12.543 891 3HD2 LEU 108 HD23 LEU 108 -1.011 2.760 11.775 892 H ALA 109 H ALA 109 -2.122 -2.719 8.295 893 HA ALA 109 HA ALA 109 -3.671 -1.428 6.126 894 1HB ALA 109 HB1 ALA 109 -0.929 -2.095 5.831 895 2HB ALA 109 HB2 ALA 109 -1.843 -3.306 4.933 896 3HB ALA 109 HB3 ALA 109 -2.053 -1.593 4.569 897 H LYS 110 H LYS 110 -5.185 -2.845 5.217 898 HA LYS 110 HA LYS 110 -5.200 -5.607 6.373 899 1HB LYS 110 HB2 LYS 110 -7.522 -3.822 5.586 900 2HB LYS 110 HB3 LYS 110 -7.682 -5.500 6.108 901 1HG LYS 110 HG2 LYS 110 -7.615 -4.853 8.260 902 2HG LYS 110 HG3 LYS 110 -6.032 -4.119 7.999 903 1HD LYS 110 HD2 LYS 110 -6.897 -2.031 7.936 904 2HD LYS 110 HD3 LYS 110 -8.208 -2.526 6.865 905 1HE LYS 110 HE2 LYS 110 -8.876 -3.747 9.257 906 2HE LYS 110 HE3 LYS 110 -8.204 -2.202 9.778 907 1HZ LYS 110 HZ1 LYS 110 -9.677 -1.214 7.967 908 2HZ LYS 110 HZ2 LYS 110 -10.494 -2.703 7.981 909 3HZ LYS 110 HZ3 LYS 110 -10.437 -1.755 9.387 910 H VAL 111 H VAL 111 -4.999 -7.211 4.888 911 HA VAL 111 HA VAL 111 -4.667 -6.748 2.112 912 HB VAL 111 HB VAL 111 -5.415 -9.247 3.650 913 1HG1 VAL 111 HG11 VAL 111 -5.408 -8.728 0.765 914 2HG1 VAL 111 HG12 VAL 111 -4.333 -10.047 1.226 915 3HG1 VAL 111 HG13 VAL 111 -6.042 -10.112 1.655 916 1HG2 VAL 111 HG21 VAL 111 -2.905 -7.939 2.683 917 2HG2 VAL 111 HG22 VAL 111 -3.205 -8.817 4.183 918 3HG2 VAL 111 HG23 VAL 111 -2.967 -9.702 2.676 919 H ALA 112 H ALA 112 -6.211 -5.999 0.741 920 HA ALA 112 HA ALA 112 -8.891 -7.270 0.809 921 1HB ALA 112 HB1 ALA 112 -8.452 -4.268 0.866 922 2HB ALA 112 HB2 ALA 112 -10.012 -5.070 0.674 923 3HB ALA 112 HB3 ALA 112 -9.115 -5.236 2.183 924 H TYR 113 H TYR 113 -10.176 -6.045 -1.161 925 HA TYR 113 HA TYR 113 -10.290 -5.884 -3.497 926 1HB TYR 113 HB2 TYR 113 -7.521 -4.748 -3.016 927 2HB TYR 113 HB3 TYR 113 -8.337 -4.711 -4.578 928 HD1 TYR 113 HD1 TYR 113 -11.052 -4.047 -4.098 929 HD2 TYR 113 HD2 TYR 113 -7.577 -2.661 -1.985 930 HE1 TYR 113 HE1 TYR 113 -12.284 -2.009 -3.407 931 HE2 TYR 113 HE2 TYR 113 -8.812 -0.624 -1.294 932 HH TYR 113 HH TYR 113 -12.159 -0.325 -1.560 933 H VAL 114 H VAL 114 -10.337 -8.203 -3.790 934 HA VAL 114 HA VAL 114 -7.706 -9.393 -4.573 935 HB VAL 114 HB VAL 114 -10.278 -10.819 -3.829 936 1HG1 VAL 114 HG11 VAL 114 -7.588 -11.656 -4.788 937 2HG1 VAL 114 HG12 VAL 114 -8.296 -12.619 -3.494 938 3HG1 VAL 114 HG13 VAL 114 -9.156 -12.428 -5.022 939 1HG2 VAL 114 HG21 VAL 114 -9.064 -9.484 -1.992 940 2HG2 VAL 114 HG22 VAL 114 -9.333 -11.199 -1.676 941 3HG2 VAL 114 HG23 VAL 114 -7.743 -10.635 -2.190 942 H TYR 115 H TYR 115 -7.503 -9.130 -6.763 943 HA TYR 115 HA TYR 115 -9.687 -10.207 -8.460 944 1HB TYR 115 HB2 TYR 115 -8.396 -7.532 -9.048 945 2HB TYR 115 HB3 TYR 115 -9.755 -8.277 -9.890 946 HD1 TYR 115 HD1 TYR 115 -11.979 -8.402 -8.846 947 HD2 TYR 115 HD2 TYR 115 -8.687 -6.469 -6.878 948 HE1 TYR 115 HE1 TYR 115 -13.556 -7.328 -7.262 949 HE2 TYR 115 HE2 TYR 115 -10.264 -5.393 -5.295 950 HH TYR 115 HH TYR 115 -13.728 -5.570 -5.748 951 H LYS 116 H LYS 116 -8.880 -11.367 -10.153 952 HA LYS 116 HA LYS 116 -5.946 -11.552 -10.426 953 1HB LYS 116 HB2 LYS 116 -8.089 -13.082 -11.933 954 2HB LYS 116 HB3 LYS 116 -6.393 -13.526 -11.753 955 1HG LYS 116 HG2 LYS 116 -7.686 -13.089 -9.173 956 2HG LYS 116 HG3 LYS 116 -8.479 -14.359 -10.107 957 1HD LYS 116 HD2 LYS 116 -5.606 -14.609 -10.328 958 2HD LYS 116 HD3 LYS 116 -6.086 -14.580 -8.631 959 1HE LYS 116 HE2 LYS 116 -7.170 -16.579 -8.770 960 2HE LYS 116 HE3 LYS 116 -7.803 -16.233 -10.379 961 1HZ LYS 116 HZ1 LYS 116 -4.953 -16.542 -10.336 962 2HZ LYS 116 HZ2 LYS 116 -5.766 -17.935 -9.809 963 3HZ LYS 116 HZ3 LYS 116 -6.109 -17.280 -11.339 964 HA PRO 117 HA PRO 117 -4.845 -12.604 -11.999 965 1HB PRO 117 HB2 PRO 117 -2.758 -12.036 -13.659 966 2HB PRO 117 HB3 PRO 117 -4.174 -12.965 -14.178 967 1HG PRO 117 HG2 PRO 117 -3.391 -10.211 -14.897 968 2HG PRO 117 HG3 PRO 117 -4.485 -11.321 -15.735 969 1HD PRO 117 HD2 PRO 117 -5.191 -9.125 -14.005 970 2HD PRO 117 HD3 PRO 117 -6.284 -10.254 -14.834 971 H ASN 118 H ASN 118 -5.090 -9.833 -10.812 972 HA ASN 118 HA ASN 118 -2.308 -8.996 -10.367 973 1HB ASN 118 HB2 ASN 118 -4.976 -8.029 -9.323 974 2HB ASN 118 HB3 ASN 118 -3.445 -7.386 -8.726 975 1HD2 ASN 118 HD21 ASN 118 -5.374 -5.794 -10.210 976 2HD2 ASN 118 HD22 ASN 118 -4.643 -5.341 -11.673 977 H ASN 119 H ASN 119 -1.921 -11.328 -9.517 978 HA ASN 119 HA ASN 119 -2.292 -11.270 -6.558 979 1HB ASN 119 HB2 ASN 119 -3.237 -13.278 -8.479 980 2HB ASN 119 HB3 ASN 119 -2.252 -13.965 -7.189 981 1HD2 ASN 119 HD21 ASN 119 -4.967 -11.614 -7.588 982 2HD2 ASN 119 HD22 ASN 119 -5.765 -12.073 -6.162 983 H THR 120 H THR 120 -0.031 -10.583 -8.394 984 HA THR 120 HA THR 120 1.935 -12.649 -8.399 985 HB THR 120 HB THR 120 2.456 -9.673 -8.166 986 HG1 THR 120 HG1 THR 120 2.608 -10.193 -10.608 987 1HG2 THR 120 HG21 THR 120 4.066 -12.081 -8.766 988 2HG2 THR 120 HG22 THR 120 4.324 -10.714 -9.849 989 3HG2 THR 120 HG23 THR 120 4.569 -10.521 -8.113 990 H HIS 121 H HIS 121 0.844 -10.471 -5.883 991 HA HIS 121 HA HIS 121 2.838 -11.739 -4.049 992 1HB HIS 121 HB2 HIS 121 2.061 -8.856 -4.366 993 2HB HIS 121 HB3 HIS 121 2.547 -9.450 -2.778 994 HD1 HIS 121 HD1 HIS 121 4.910 -10.991 -2.964 995 HD2 HIS 121 HD2 HIS 121 4.243 -8.041 -5.832 996 HE1 HIS 121 HE1 HIS 121 7.161 -10.485 -4.008 997 H GLU 122 H GLU 122 -0.011 -12.394 -4.675 998 HA GLU 122 HA GLU 122 -1.684 -11.491 -2.518 999 1HB GLU 122 HB2 GLU 122 -2.727 -12.446 -4.468 1000 2HB GLU 122 HB3 GLU 122 -1.806 -13.940 -4.295 1001 1HG GLU 122 HG2 GLU 122 -4.140 -14.175 -3.460 1002 2HG GLU 122 HG3 GLU 122 -2.946 -14.437 -2.188 1003 H GLN 123 H GLN 123 0.194 -14.499 -2.978 1004 HA GLN 123 HA GLN 123 -0.454 -15.637 -0.439 1005 1HB GLN 123 HB2 GLN 123 1.350 -16.204 -2.637 1006 2HB GLN 123 HB3 GLN 123 2.146 -16.490 -1.089 1007 1HG GLN 123 HG2 GLN 123 -0.261 -17.615 -0.578 1008 2HG GLN 123 HG3 GLN 123 -0.161 -17.897 -2.316 1009 1HE2 GLN 123 HE21 GLN 123 1.254 -19.543 -3.039 1010 2HE2 GLN 123 HE22 GLN 123 2.290 -20.413 -2.014 1011 H LEU 124 H LEU 124 1.943 -13.257 -1.417 1012 HA LEU 124 HA LEU 124 3.529 -13.387 0.985 1013 1HB LEU 124 HB2 LEU 124 4.316 -12.321 -1.119 1014 2HB LEU 124 HB3 LEU 124 3.121 -11.043 -0.895 1015 HG LEU 124 HG LEU 124 4.174 -10.619 1.381 1016 1HD1 LEU 124 HD11 LEU 124 5.900 -12.792 0.329 1017 2HD1 LEU 124 HD12 LEU 124 6.743 -11.448 1.101 1018 3HD1 LEU 124 HD13 LEU 124 5.527 -12.359 1.998 1019 1HD2 LEU 124 HD21 LEU 124 4.746 -9.581 -1.068 1020 2HD2 LEU 124 HD22 LEU 124 5.491 -9.011 0.426 1021 3HD2 LEU 124 HD23 LEU 124 6.340 -10.172 -0.596 1022 H LEU 125 H LEU 125 1.174 -10.882 -0.042 1023 HA LEU 125 HA LEU 125 1.003 -9.603 2.485 1024 1HB LEU 125 HB2 LEU 125 -1.013 -9.842 0.236 1025 2HB LEU 125 HB3 LEU 125 -1.253 -8.807 1.644 1026 HG LEU 125 HG LEU 125 1.176 -8.638 -0.157 1027 1HD1 LEU 125 HD11 LEU 125 -1.521 -7.333 -0.296 1028 2HD1 LEU 125 HD12 LEU 125 -0.100 -6.398 -0.758 1029 3HD1 LEU 125 HD13 LEU 125 -0.485 -7.896 -1.607 1030 1HD2 LEU 125 HD21 LEU 125 0.649 -7.644 2.411 1031 2HD2 LEU 125 HD22 LEU 125 1.927 -7.103 1.323 1032 3HD2 LEU 125 HD23 LEU 125 0.372 -6.271 1.339 1033 H ARG 126 H ARG 126 -0.292 -12.619 1.400 1034 HA ARG 126 HA ARG 126 -2.460 -12.782 3.319 1035 1HB ARG 126 HB2 ARG 126 -1.820 -14.209 1.103 1036 2HB ARG 126 HB3 ARG 126 -1.204 -15.290 2.352 1037 1HG ARG 126 HG2 ARG 126 -3.289 -15.933 2.898 1038 2HG ARG 126 HG3 ARG 126 -3.784 -14.257 3.135 1039 1HD ARG 126 HD2 ARG 126 -3.834 -14.188 0.511 1040 2HD ARG 126 HD3 ARG 126 -3.948 -15.943 0.654 1041 HE ARG 126 HE ARG 126 -5.881 -14.919 2.406 1042 1HH1 ARG 126 HH11 ARG 126 -6.309 -12.730 0.504 1043 2HH1 ARG 126 HH12 ARG 126 -7.410 -13.410 -0.646 1044 1HH2 ARG 126 HH21 ARG 126 -6.788 -16.689 0.297 1045 2HH2 ARG 126 HH22 ARG 126 -7.683 -15.651 -0.764 1046 H LYS 127 H LYS 127 0.639 -14.585 3.170 1047 HA LYS 127 HA LYS 127 0.533 -15.649 5.772 1048 1HB LYS 127 HB2 LYS 127 3.023 -15.780 5.619 1049 2HB LYS 127 HB3 LYS 127 2.219 -16.373 4.165 1050 1HG LYS 127 HG2 LYS 127 2.539 -14.122 3.124 1051 2HG LYS 127 HG3 LYS 127 3.456 -13.631 4.549 1052 1HD LYS 127 HD2 LYS 127 5.022 -14.351 2.836 1053 2HD LYS 127 HD3 LYS 127 5.020 -15.547 4.133 1054 1HE LYS 127 HE2 LYS 127 3.033 -16.013 1.989 1055 2HE LYS 127 HE3 LYS 127 4.720 -16.179 1.501 1056 1HZ LYS 127 HZ1 LYS 127 4.252 -17.400 4.025 1057 2HZ LYS 127 HZ2 LYS 127 3.205 -18.034 2.848 1058 3HZ LYS 127 HZ3 LYS 127 4.882 -18.081 2.602 1059 H SER 128 H SER 128 1.915 -12.550 4.704 1060 HA SER 128 HA SER 128 2.881 -11.715 7.250 1061 1HB SER 128 HB2 SER 128 1.853 -10.061 4.925 1062 2HB SER 128 HB3 SER 128 2.736 -9.409 6.303 1063 HG SER 128 HG SER 128 3.661 -11.437 4.537 1064 H GLU 129 H GLU 129 -0.323 -11.464 5.761 1065 HA GLU 129 HA GLU 129 -1.456 -9.726 7.752 1066 1HB GLU 129 HB2 GLU 129 -2.371 -10.454 5.401 1067 2HB GLU 129 HB3 GLU 129 -3.082 -11.796 6.300 1068 1HG GLU 129 HG2 GLU 129 -4.632 -9.850 6.110 1069 2HG GLU 129 HG3 GLU 129 -4.239 -10.239 7.784 1070 H ALA 130 H ALA 130 -1.149 -13.249 7.501 1071 HA ALA 130 HA ALA 130 -2.830 -13.899 9.723 1072 1HB ALA 130 HB1 ALA 130 -1.732 -15.443 7.914 1073 2HB ALA 130 HB2 ALA 130 -0.382 -15.506 9.048 1074 3HB ALA 130 HB3 ALA 130 -1.978 -16.071 9.544 1075 H GLN 131 H GLN 131 0.645 -13.200 9.511 1076 HA GLN 131 HA GLN 131 1.223 -13.704 12.275 1077 1HB GLN 131 HB2 GLN 131 2.936 -13.466 10.436 1078 2HB GLN 131 HB3 GLN 131 2.626 -11.730 10.452 1079 1HG GLN 131 HG2 GLN 131 3.022 -12.530 13.152 1080 2HG GLN 131 HG3 GLN 131 4.321 -13.249 12.199 1081 1HE2 GLN 131 HE21 GLN 131 5.952 -11.747 12.974 1082 2HE2 GLN 131 HE22 GLN 131 5.939 -10.107 12.533 1083 H ALA 132 H ALA 132 0.248 -10.780 10.511 1084 HA ALA 132 HA ALA 132 0.449 -8.980 12.727 1085 1HB ALA 132 HB1 ALA 132 -0.254 -8.792 10.034 1086 2HB ALA 132 HB2 ALA 132 -1.735 -8.361 10.890 1087 3HB ALA 132 HB3 ALA 132 -0.246 -7.467 11.197 1088 H LYS 133 H LYS 133 -2.039 -11.246 11.699 1089 HA LYS 133 HA LYS 133 -4.166 -10.246 13.336 1090 1HB LYS 133 HB2 LYS 133 -3.607 -12.651 11.765 1091 2HB LYS 133 HB3 LYS 133 -4.540 -12.997 13.222 1092 1HG LYS 133 HG2 LYS 133 -5.694 -10.664 12.221 1093 2HG LYS 133 HG3 LYS 133 -5.371 -11.634 10.783 1094 1HD LYS 133 HD2 LYS 133 -6.735 -12.747 13.246 1095 2HD LYS 133 HD3 LYS 133 -7.621 -12.059 11.883 1096 1HE LYS 133 HE2 LYS 133 -6.807 -13.722 10.382 1097 2HE LYS 133 HE3 LYS 133 -5.575 -14.255 11.527 1098 1HZ LYS 133 HZ1 LYS 133 -7.555 -14.784 13.032 1099 2HZ LYS 133 HZ2 LYS 133 -8.494 -14.687 11.619 1100 3HZ LYS 133 HZ3 LYS 133 -7.243 -15.832 11.734 1101 H LYS 134 H LYS 134 -1.914 -12.974 13.923 1102 HA LYS 134 HA LYS 134 -2.736 -13.257 16.681 1103 1HB LYS 134 HB2 LYS 134 -0.892 -14.818 16.878 1104 2HB LYS 134 HB3 LYS 134 -1.656 -15.073 15.309 1105 1HG LYS 134 HG2 LYS 134 0.129 -13.271 14.524 1106 2HG LYS 134 HG3 LYS 134 0.999 -13.848 15.946 1107 1HD LYS 134 HD2 LYS 134 -0.136 -15.735 13.873 1108 2HD LYS 134 HD3 LYS 134 1.496 -15.075 13.757 1109 1HE LYS 134 HE2 LYS 134 1.609 -15.917 16.291 1110 2HE LYS 134 HE3 LYS 134 0.379 -17.038 15.709 1111 1HZ LYS 134 HZ1 LYS 134 2.987 -16.599 14.365 1112 2HZ LYS 134 HZ2 LYS 134 2.692 -17.853 15.467 1113 3HZ LYS 134 HZ3 LYS 134 1.834 -17.793 14.003 1114 H GLU 135 H GLU 135 -0.722 -11.030 15.062 1115 HA GLU 135 HA GLU 135 1.014 -10.467 17.356 1116 1HB GLU 135 HB2 GLU 135 0.649 -9.347 14.602 1117 2HB GLU 135 HB3 GLU 135 1.444 -8.346 15.817 1118 1HG GLU 135 HG2 GLU 135 2.944 -10.354 16.300 1119 2HG GLU 135 HG3 GLU 135 2.283 -11.082 14.836 1120 H LYS 136 H LYS 136 -2.080 -9.426 16.167 1121 HA LYS 136 HA LYS 136 -3.574 -7.790 16.948 1122 1HB LYS 136 HB2 LYS 136 -2.171 -7.862 19.599 1123 2HB LYS 136 HB3 LYS 136 -3.900 -7.830 19.252 1124 1HG LYS 136 HG2 LYS 136 -3.706 -10.153 18.333 1125 2HG LYS 136 HG3 LYS 136 -2.021 -10.175 18.857 1126 1HD LYS 136 HD2 LYS 136 -2.579 -10.198 21.116 1127 2HD LYS 136 HD3 LYS 136 -4.152 -9.447 20.839 1128 1HE LYS 136 HE2 LYS 136 -4.667 -11.648 19.509 1129 2HE LYS 136 HE3 LYS 136 -3.330 -12.312 20.450 1130 1HZ LYS 136 HZ1 LYS 136 -4.481 -11.478 22.465 1131 2HZ LYS 136 HZ2 LYS 136 -5.811 -11.065 21.495 1132 3HZ LYS 136 HZ3 LYS 136 -5.338 -12.691 21.639 1133 H LEU 137 H LEU 137 -1.924 -6.438 15.505 1134 HA LEU 137 HA LEU 137 -0.576 -4.384 17.190 1135 1HB LEU 137 HB2 LEU 137 0.159 -5.679 14.796 1136 2HB LEU 137 HB3 LEU 137 -0.223 -4.018 14.342 1137 HG LEU 137 HG LEU 137 1.508 -4.613 16.737 1138 1HD1 LEU 137 HD11 LEU 137 2.422 -5.714 14.638 1139 2HD1 LEU 137 HD12 LEU 137 2.520 -4.101 13.929 1140 3HD1 LEU 137 HD13 LEU 137 3.475 -4.495 15.358 1141 1HD2 LEU 137 HD21 LEU 137 0.403 -2.292 15.614 1142 2HD2 LEU 137 HD22 LEU 137 1.681 -2.363 16.826 1143 3HD2 LEU 137 HD23 LEU 137 2.094 -2.271 15.114 1144 H ASN 138 H ASN 138 -1.868 -2.674 17.656 1145 HA ASN 138 HA ASN 138 -3.489 -0.995 17.405 1146 1HB ASN 138 HB2 ASN 138 -2.466 -1.221 14.559 1147 2HB ASN 138 HB3 ASN 138 -3.507 0.081 15.136 1148 1HD2 ASN 138 HD21 ASN 138 -0.315 -0.569 14.542 1149 2HD2 ASN 138 HD22 ASN 138 0.407 0.459 15.684 1150 H ILE 139 H ILE 139 -4.062 -2.079 14.120 1151 HA ILE 139 HA ILE 139 -6.856 -2.235 14.361 1152 HB ILE 139 HB ILE 139 -4.999 -3.758 12.515 1153 1HG1 ILE 139 HG12 ILE 139 -6.743 -1.483 11.672 1154 2HG1 ILE 139 HG13 ILE 139 -5.312 -1.100 12.630 1155 1HG2 ILE 139 HG21 ILE 139 -7.993 -3.573 12.681 1156 2HG2 ILE 139 HG22 ILE 139 -7.216 -3.734 11.106 1157 3HG2 ILE 139 HG23 ILE 139 -6.984 -4.978 12.335 1158 1HD1 ILE 139 HD11 ILE 139 -4.250 -2.861 10.851 1159 2HD1 ILE 139 HD12 ILE 139 -5.508 -2.125 9.858 1160 3HD1 ILE 139 HD13 ILE 139 -4.266 -1.115 10.601 1161 H TRP 140 H TRP 140 -4.711 -5.099 14.157 1162 HA TRP 140 HA TRP 140 -6.761 -6.863 15.183 1163 1HB TRP 140 HB2 TRP 140 -3.784 -7.399 15.139 1164 2HB TRP 140 HB3 TRP 140 -5.097 -8.575 15.060 1165 HD1 TRP 140 HD1 TRP 140 -2.951 -6.391 12.927 1166 HE1 TRP 140 HE1 TRP 140 -3.676 -6.581 10.461 1167 HE3 TRP 140 HE3 TRP 140 -7.353 -8.911 13.498 1168 HZ2 TRP 140 HZ2 TRP 140 -5.840 -7.662 8.931 1169 HZ3 TRP 140 HZ3 TRP 140 -8.725 -9.509 11.522 1170 HH2 TRP 140 HH2 TRP 140 -7.975 -8.887 9.242 1171 H SER 141 H SER 141 -4.994 -4.530 16.750 1172 HA SER 141 HA SER 141 -4.059 -5.746 19.114 1173 1HB SER 141 HB2 SER 141 -3.782 -3.321 18.469 1174 2HB SER 141 HB3 SER 141 -5.454 -3.063 18.956 1175 HG SER 141 HG SER 141 -4.786 -3.999 21.023 1176 H GLU 142 H GLU 142 -7.198 -4.082 18.775 1177 HA GLU 142 HA GLU 142 -8.308 -5.136 21.175 1178 1HB GLU 142 HB2 GLU 142 -9.801 -4.318 18.664 1179 2HB GLU 142 HB3 GLU 142 -10.462 -4.404 20.296 1180 1HG GLU 142 HG2 GLU 142 -8.251 -2.799 20.650 1181 2HG GLU 142 HG3 GLU 142 -8.818 -2.309 19.053 1182 H ASP 143 H ASP 143 -9.572 -6.027 17.959 1183 HA ASP 143 HA ASP 143 -10.283 -8.104 17.135 1184 1HB ASP 143 HB2 ASP 143 -7.983 -8.808 17.368 1185 2HB ASP 143 HB3 ASP 143 -8.176 -9.027 19.109 1186 H ASN 144 H ASN 144 -12.276 -7.337 18.469 1187 HA ASN 144 HA ASN 144 -12.763 -9.026 20.856 1188 1HB ASN 144 HB2 ASN 144 -13.527 -6.446 20.207 1189 2HB ASN 144 HB3 ASN 144 -14.991 -7.378 19.887 1190 1HD2 ASN 144 HD21 ASN 144 -14.342 -9.442 21.944 1191 2HD2 ASN 144 HD22 ASN 144 -14.614 -8.700 23.447 1192 H ALA 145 H ALA 145 -12.498 -10.586 18.604 1193 HA ALA 145 HA ALA 145 -15.330 -11.345 18.002 1194 1HB ALA 145 HB1 ALA 145 -13.714 -10.458 16.102 1195 2HB ALA 145 HB2 ALA 145 -13.080 -12.102 16.169 1196 3HB ALA 145 HB3 ALA 145 -14.782 -11.828 15.796 1197 H ASP 146 H ASP 146 -15.509 -12.919 19.627 1198 HA ASP 146 HA ASP 146 -14.175 -15.458 19.071 1199 1HB ASP 146 HB2 ASP 146 -13.318 -15.638 21.465 1200 2HB ASP 146 HB3 ASP 146 -12.419 -14.536 20.420 1201 H SER 147 H SER 147 -14.932 -17.113 20.836 1202 HA SER 147 HA SER 147 -17.767 -17.148 20.878 1203 1HB SER 147 HB2 SER 147 -17.101 -18.765 22.990 1204 2HB SER 147 HB3 SER 147 -17.083 -19.272 21.304 1205 HG SER 147 HG SER 147 -14.964 -18.461 22.971 1206 H GLY 148 H GLY 148 -18.817 -17.549 23.276 1207 1HA GLY 148 HA2 GLY 148 -17.914 -15.769 25.358 1208 2HA GLY 148 HA3 GLY 148 -19.206 -15.019 24.419 1209 H GLN 149 H GLN 149 -21.307 -15.998 24.449 1210 HA GLN 149 HA GLN 149 -23.086 -16.924 25.694 1211 1HB GLN 149 HB2 GLN 149 -22.272 -18.838 24.328 1212 2HB GLN 149 HB3 GLN 149 -21.190 -19.291 25.645 1213 1HG GLN 149 HG2 GLN 149 -22.867 -20.222 26.851 1214 2HG GLN 149 HG3 GLN 149 -23.970 -18.889 26.506 1215 1HE2 GLN 149 HE21 GLN 149 -22.431 -21.639 24.731 1216 2HE2 GLN 149 HE22 GLN 149 -23.812 -22.007 23.814 1217 HN3 PTP 150 H3 PTP 150 -10.003 -4.242 -7.679 1218 1H5M PTP 150 H51 PTP 150 -6.964 -2.127 -4.826 1219 2H5M PTP 150 H52 PTP 150 -7.680 -0.517 -4.577 1220 3H5M PTP 150 H53 PTP 150 -6.679 -0.833 -6.015 1221 H6 PTP 150 H6 PTP 150 -9.564 0.191 -5.875 1222 H1* PTP 150 H1' PTP 150 -12.369 -0.433 -8.111 1223 2H2* PTP 150 H2' PTP 150 -12.481 -0.673 -5.111 1224 H3* PTP 150 H3' PTP 150 -13.346 1.529 -4.845 1225 H4* PTP 150 H4' PTP 150 -12.095 2.911 -6.841 1226 2H5* PTP 150 H5' PTP 150 -10.884 1.367 -4.470 Start of MODEL 19 1 1H ALA 1 H1 ALA 1 14.296 -22.084 -24.719 2 2H ALA 1 H2 ALA 1 12.645 -22.344 -25.025 3 3H ALA 1 H3 ALA 1 13.381 -20.896 -25.516 4 HA ALA 1 HA ALA 1 11.960 -20.812 -23.430 5 1HB ALA 1 HB1 ALA 1 14.056 -22.740 -22.723 6 2HB ALA 1 HB2 ALA 1 13.897 -21.430 -21.553 7 3HB ALA 1 HB3 ALA 1 12.503 -22.436 -21.946 8 H THR 2 H THR 2 12.122 -18.653 -23.103 9 HA THR 2 HA THR 2 14.625 -17.423 -22.279 10 HB THR 2 HB THR 2 14.999 -17.559 -24.721 11 HG1 THR 2 HG1 THR 2 15.281 -15.291 -25.021 12 1HG2 THR 2 HG21 THR 2 12.440 -17.457 -25.151 13 2HG2 THR 2 HG22 THR 2 12.651 -15.708 -25.082 14 3HG2 THR 2 HG23 THR 2 13.508 -16.651 -26.300 15 H SER 3 H SER 3 11.954 -17.618 -21.222 16 HA SER 3 HA SER 3 11.137 -14.740 -21.344 17 1HB SER 3 HB2 SER 3 9.575 -16.902 -22.038 18 2HB SER 3 HB3 SER 3 9.129 -16.651 -20.352 19 HG SER 3 HG SER 3 9.269 -14.564 -22.269 20 H THR 4 H THR 4 9.370 -14.871 -19.134 21 HA THR 4 HA THR 4 10.703 -16.021 -16.826 22 HB THR 4 HB THR 4 12.202 -14.077 -17.369 23 HG1 THR 4 HG1 THR 4 12.298 -14.476 -15.282 24 1HG2 THR 4 HG21 THR 4 10.273 -12.675 -18.259 25 2HG2 THR 4 HG22 THR 4 9.829 -12.379 -16.578 26 3HG2 THR 4 HG23 THR 4 11.391 -11.832 -17.186 27 H LYS 5 H LYS 5 9.347 -15.905 -14.991 28 HA LYS 5 HA LYS 5 6.636 -14.820 -15.554 29 1HB LYS 5 HB2 LYS 5 7.497 -17.242 -14.467 30 2HB LYS 5 HB3 LYS 5 6.923 -16.326 -13.073 31 1HG LYS 5 HG2 LYS 5 4.834 -16.926 -13.679 32 2HG LYS 5 HG3 LYS 5 5.014 -15.828 -15.048 33 1HD LYS 5 HD2 LYS 5 6.383 -18.125 -15.842 34 2HD LYS 5 HD3 LYS 5 4.951 -18.744 -15.017 35 1HE LYS 5 HE2 LYS 5 3.483 -17.490 -16.443 36 2HE LYS 5 HE3 LYS 5 4.826 -16.573 -17.123 37 1HZ LYS 5 HZ1 LYS 5 4.891 -19.491 -17.342 38 2HZ LYS 5 HZ2 LYS 5 3.830 -18.639 -18.358 39 3HZ LYS 5 HZ3 LYS 5 5.497 -18.314 -18.402 40 H LYS 6 H LYS 6 9.364 -13.669 -14.211 41 HA LYS 6 HA LYS 6 8.250 -12.603 -11.715 42 1HB LYS 6 HB2 LYS 6 10.799 -11.796 -13.146 43 2HB LYS 6 HB3 LYS 6 10.396 -11.512 -11.452 44 1HG LYS 6 HG2 LYS 6 10.142 -14.105 -11.327 45 2HG LYS 6 HG3 LYS 6 11.092 -14.105 -12.813 46 1HD LYS 6 HD2 LYS 6 12.902 -12.911 -11.721 47 2HD LYS 6 HD3 LYS 6 11.940 -12.718 -10.254 48 1HE LYS 6 HE2 LYS 6 11.808 -15.264 -10.161 49 2HE LYS 6 HE3 LYS 6 13.045 -15.284 -11.417 50 1HZ LYS 6 HZ1 LYS 6 13.909 -13.500 -9.486 51 2HZ LYS 6 HZ2 LYS 6 13.344 -14.860 -8.639 52 3HZ LYS 6 HZ3 LYS 6 14.544 -15.038 -9.825 53 H LEU 7 H LEU 7 8.939 -9.984 -11.630 54 HA LEU 7 HA LEU 7 7.421 -8.783 -13.914 55 1HB LEU 7 HB2 LEU 7 7.413 -8.104 -10.966 56 2HB LEU 7 HB3 LEU 7 6.796 -6.995 -12.191 57 HG LEU 7 HG LEU 7 5.849 -9.855 -11.865 58 1HD1 LEU 7 HD11 LEU 7 5.362 -8.047 -9.997 59 2HD1 LEU 7 HD12 LEU 7 4.193 -7.451 -11.176 60 3HD1 LEU 7 HD13 LEU 7 4.071 -9.103 -10.571 61 1HD2 LEU 7 HD21 LEU 7 5.524 -7.834 -13.900 62 2HD2 LEU 7 HD22 LEU 7 4.899 -9.483 -13.875 63 3HD2 LEU 7 HD23 LEU 7 3.964 -8.174 -13.151 64 H HIS 8 H HIS 8 7.898 -6.197 -13.751 65 HA HIS 8 HA HIS 8 10.878 -5.976 -13.752 66 1HB HIS 8 HB2 HIS 8 10.091 -3.839 -15.213 67 2HB HIS 8 HB3 HIS 8 10.430 -5.413 -15.926 68 HD1 HIS 8 HD1 HIS 8 8.434 -6.789 -16.785 69 HD2 HIS 8 HD2 HIS 8 7.292 -3.213 -14.971 70 HE1 HIS 8 HE1 HIS 8 5.977 -6.473 -17.310 71 H LYS 9 H LYS 9 11.787 -4.480 -12.409 72 HA LYS 9 HA LYS 9 9.926 -2.705 -10.890 73 1HB LYS 9 HB2 LYS 9 12.769 -3.517 -10.205 74 2HB LYS 9 HB3 LYS 9 11.650 -2.632 -9.167 75 1HG LYS 9 HG2 LYS 9 10.496 -5.124 -10.166 76 2HG LYS 9 HG3 LYS 9 11.967 -5.395 -9.232 77 1HD LYS 9 HD2 LYS 9 9.782 -3.569 -8.230 78 2HD LYS 9 HD3 LYS 9 9.747 -5.305 -7.921 79 1HE LYS 9 HE2 LYS 9 12.225 -3.708 -7.311 80 2HE LYS 9 HE3 LYS 9 10.886 -3.747 -6.163 81 1HZ LYS 9 HZ1 LYS 9 10.999 -6.182 -6.215 82 2HZ LYS 9 HZ2 LYS 9 12.348 -6.095 -7.242 83 3HZ LYS 9 HZ3 LYS 9 12.447 -5.488 -5.662 84 H GLU 10 H GLU 10 10.125 -0.502 -11.150 85 HA GLU 10 HA GLU 10 12.573 0.476 -12.569 86 1HB GLU 10 HB2 GLU 10 9.676 0.937 -13.149 87 2HB GLU 10 HB3 GLU 10 10.791 2.280 -13.408 88 1HG GLU 10 HG2 GLU 10 11.014 -0.496 -14.611 89 2HG GLU 10 HG3 GLU 10 10.593 0.985 -15.471 90 HA PRO 11 HA PRO 11 12.839 3.567 -9.450 91 1HB PRO 11 HB2 PRO 11 13.806 5.688 -10.874 92 2HB PRO 11 HB3 PRO 11 14.771 4.251 -10.499 93 1HG PRO 11 HG2 PRO 11 13.503 5.052 -13.076 94 2HG PRO 11 HG3 PRO 11 14.979 4.116 -12.793 95 1HD PRO 11 HD2 PRO 11 12.479 3.044 -13.499 96 2HD PRO 11 HD3 PRO 11 13.843 2.128 -12.821 97 H ALA 12 H ALA 12 12.038 5.741 -8.781 98 HA ALA 12 HA ALA 12 9.884 6.910 -10.437 99 1HB ALA 12 HB1 ALA 12 8.988 5.016 -8.867 100 2HB ALA 12 HB2 ALA 12 9.235 6.201 -7.583 101 3HB ALA 12 HB3 ALA 12 8.133 6.558 -8.914 102 H THR 13 H THR 13 8.856 8.787 -8.890 103 HA THR 13 HA THR 13 11.155 10.078 -7.477 104 HB THR 13 HB THR 13 9.223 11.715 -9.094 105 HG1 THR 13 HG1 THR 13 11.584 10.465 -10.050 106 1HG2 THR 13 HG21 THR 13 11.597 12.138 -7.536 107 2HG2 THR 13 HG22 THR 13 11.920 12.594 -9.209 108 3HG2 THR 13 HG23 THR 13 10.579 13.336 -8.335 109 H LEU 14 H LEU 14 10.448 10.067 -5.385 110 HA LEU 14 HA LEU 14 7.732 10.100 -4.540 111 1HB LEU 14 HB2 LEU 14 9.853 9.545 -3.174 112 2HB LEU 14 HB3 LEU 14 10.003 11.285 -2.936 113 HG LEU 14 HG LEU 14 8.758 10.101 -1.093 114 1HD1 LEU 14 HD11 LEU 14 8.431 12.552 -1.870 115 2HD1 LEU 14 HD12 LEU 14 6.913 11.978 -2.562 116 3HD1 LEU 14 HD13 LEU 14 7.196 11.846 -0.826 117 1HD2 LEU 14 HD21 LEU 14 7.605 8.609 -2.954 118 2HD2 LEU 14 HD22 LEU 14 6.734 9.020 -1.475 119 3HD2 LEU 14 HD23 LEU 14 6.419 9.915 -2.962 120 H ILE 15 H ILE 15 6.439 11.734 -5.356 121 HA ILE 15 HA ILE 15 7.443 14.504 -5.401 122 HB ILE 15 HB ILE 15 4.684 13.471 -6.113 123 1HG1 ILE 15 HG12 ILE 15 7.180 13.830 -7.803 124 2HG1 ILE 15 HG13 ILE 15 6.331 12.316 -7.482 125 1HG2 ILE 15 HG21 ILE 15 5.738 16.074 -5.849 126 2HG2 ILE 15 HG22 ILE 15 5.672 15.759 -7.583 127 3HG2 ILE 15 HG23 ILE 15 4.212 15.618 -6.604 128 1HD1 ILE 15 HD11 ILE 15 4.313 13.912 -8.466 129 2HD1 ILE 15 HD12 ILE 15 5.702 14.439 -9.417 130 3HD1 ILE 15 HD13 ILE 15 5.227 12.741 -9.417 131 H LYS 16 H LYS 16 4.416 13.049 -4.132 132 HA LYS 16 HA LYS 16 4.820 14.310 -1.527 133 1HB LYS 16 HB2 LYS 16 4.053 16.251 -2.817 134 2HB LYS 16 HB3 LYS 16 2.655 15.339 -3.388 135 1HG LYS 16 HG2 LYS 16 2.015 15.023 -0.945 136 2HG LYS 16 HG3 LYS 16 3.258 16.211 -0.553 137 1HD LYS 16 HD2 LYS 16 0.791 16.618 -2.259 138 2HD LYS 16 HD3 LYS 16 1.200 17.429 -0.746 139 1HE LYS 16 HE2 LYS 16 3.303 18.273 -1.983 140 2HE LYS 16 HE3 LYS 16 2.478 17.772 -3.459 141 1HZ LYS 16 HZ1 LYS 16 1.331 19.615 -1.434 142 2HZ LYS 16 HZ2 LYS 16 2.083 20.114 -2.873 143 3HZ LYS 16 HZ3 LYS 16 0.651 19.206 -2.937 144 H ALA 17 H ALA 17 3.978 12.832 -0.137 145 HA ALA 17 HA ALA 17 2.142 10.772 -1.073 146 1HB ALA 17 HB1 ALA 17 3.345 11.450 1.616 147 2HB ALA 17 HB2 ALA 17 2.152 10.164 1.429 148 3HB ALA 17 HB3 ALA 17 3.696 10.066 0.581 149 H ILE 18 H ILE 18 0.000 10.396 -0.101 150 HA ILE 18 HA ILE 18 -1.282 12.945 0.807 151 HB ILE 18 HB ILE 18 -2.518 10.730 -0.859 152 1HG1 ILE 18 HG12 ILE 18 -1.972 13.567 -1.734 153 2HG1 ILE 18 HG13 ILE 18 -0.750 12.309 -1.919 154 1HG2 ILE 18 HG21 ILE 18 -3.769 12.507 0.838 155 2HG2 ILE 18 HG22 ILE 18 -3.814 13.366 -0.702 156 3HG2 ILE 18 HG23 ILE 18 -4.522 11.756 -0.569 157 1HD1 ILE 18 HD11 ILE 18 -2.444 10.929 -3.154 158 2HD1 ILE 18 HD12 ILE 18 -3.549 12.301 -3.081 159 3HD1 ILE 18 HD13 ILE 18 -2.036 12.436 -3.975 160 H ASP 19 H ASP 19 -1.483 9.382 0.935 161 HA ASP 19 HA ASP 19 -2.559 9.674 3.706 162 1HB ASP 19 HB2 ASP 19 -4.139 8.867 1.650 163 2HB ASP 19 HB3 ASP 19 -3.462 7.316 2.148 164 H GLY 20 H GLY 20 -2.718 6.729 3.930 165 1HA GLY 20 HA2 GLY 20 0.144 6.264 4.480 166 2HA GLY 20 HA3 GLY 20 -1.191 5.236 5.006 167 H ASP 21 H ASP 21 -2.474 4.816 2.540 168 HA ASP 21 HA ASP 21 -0.435 3.116 1.187 169 1HB ASP 21 HB2 ASP 21 -2.250 1.741 0.440 170 2HB ASP 21 HB3 ASP 21 -2.569 2.094 2.139 171 H THR 22 H THR 22 -1.478 6.124 0.825 172 HA THR 22 HA THR 22 -1.596 5.916 -2.159 173 HB THR 22 HB THR 22 -2.797 8.222 -0.644 174 HG1 THR 22 HG1 THR 22 -4.796 6.852 -1.060 175 1HG2 THR 22 HG21 THR 22 -3.350 6.894 -3.312 176 2HG2 THR 22 HG22 THR 22 -4.251 8.266 -2.667 177 3HG2 THR 22 HG23 THR 22 -2.540 8.441 -3.060 178 H VAL 23 H VAL 23 0.021 7.008 -3.191 179 HA VAL 23 HA VAL 23 1.247 9.367 -1.909 180 HB VAL 23 HB VAL 23 3.545 8.431 -2.183 181 1HG1 VAL 23 HG11 VAL 23 1.629 6.897 -0.403 182 2HG1 VAL 23 HG12 VAL 23 3.385 6.829 -0.251 183 3HG1 VAL 23 HG13 VAL 23 2.534 8.350 0.022 184 1HG2 VAL 23 HG21 VAL 23 1.921 6.074 -3.087 185 2HG2 VAL 23 HG22 VAL 23 3.416 6.722 -3.762 186 3HG2 VAL 23 HG23 VAL 23 3.455 5.791 -2.265 187 H LYS 24 H LYS 24 1.767 10.849 -3.463 188 HA LYS 24 HA LYS 24 1.391 10.092 -6.285 189 1HB LYS 24 HB2 LYS 24 2.031 12.763 -4.994 190 2HB LYS 24 HB3 LYS 24 1.664 12.527 -6.703 191 1HG LYS 24 HG2 LYS 24 -0.526 11.442 -5.927 192 2HG LYS 24 HG3 LYS 24 -0.166 12.109 -4.333 193 1HD LYS 24 HD2 LYS 24 -0.439 14.302 -5.033 194 2HD LYS 24 HD3 LYS 24 -0.019 13.930 -6.706 195 1HE LYS 24 HE2 LYS 24 -2.346 12.422 -6.079 196 2HE LYS 24 HE3 LYS 24 -2.626 14.070 -5.515 197 1HZ LYS 24 HZ1 LYS 24 -1.398 14.332 -7.956 198 2HZ LYS 24 HZ2 LYS 24 -2.516 13.076 -8.176 199 3HZ LYS 24 HZ3 LYS 24 -3.041 14.591 -7.614 200 H LEU 25 H LEU 25 3.082 9.483 -7.550 201 HA LEU 25 HA LEU 25 5.805 10.480 -6.811 202 1HB LEU 25 HB2 LEU 25 5.528 7.830 -8.160 203 2HB LEU 25 HB3 LEU 25 6.733 8.376 -6.995 204 HG LEU 25 HG LEU 25 3.838 7.869 -6.267 205 1HD1 LEU 25 HD11 LEU 25 6.226 6.048 -6.353 206 2HD1 LEU 25 HD12 LEU 25 5.014 5.828 -5.091 207 3HD1 LEU 25 HD13 LEU 25 4.551 5.709 -6.789 208 1HD2 LEU 25 HD21 LEU 25 6.280 8.794 -4.872 209 2HD2 LEU 25 HD22 LEU 25 4.585 9.090 -4.488 210 3HD2 LEU 25 HD23 LEU 25 5.345 7.571 -4.014 211 H MET 26 H MET 26 7.312 9.880 -8.858 212 HA MET 26 HA MET 26 5.827 10.838 -11.273 213 1HB MET 26 HB2 MET 26 7.623 12.356 -10.110 214 2HB MET 26 HB3 MET 26 8.778 11.272 -10.885 215 1HG MET 26 HG2 MET 26 8.508 12.379 -12.822 216 2HG MET 26 HG3 MET 26 6.800 11.941 -12.825 217 1HE MET 26 HE1 MET 26 9.026 14.232 -13.412 218 2HE MET 26 HE2 MET 26 8.352 15.833 -13.117 219 3HE MET 26 HE3 MET 26 9.354 15.067 -11.887 220 H TYR 27 H TYR 27 6.027 9.589 -13.086 221 HA TYR 27 HA TYR 27 8.166 7.511 -13.141 222 1HB TYR 27 HB2 TYR 27 5.943 6.569 -12.372 223 2HB TYR 27 HB3 TYR 27 5.293 7.000 -13.953 224 HD1 TYR 27 HD1 TYR 27 8.101 5.113 -12.347 225 HD2 TYR 27 HD2 TYR 27 5.530 5.524 -15.763 226 HE1 TYR 27 HE1 TYR 27 9.032 3.021 -13.299 227 HE2 TYR 27 HE2 TYR 27 6.463 3.431 -16.716 228 HH TYR 27 HH TYR 27 8.561 2.095 -16.513 229 H LYS 28 H LYS 28 9.330 7.931 -14.952 230 HA LYS 28 HA LYS 28 9.814 8.369 -17.206 231 1HB LYS 28 HB2 LYS 28 7.051 7.357 -17.232 232 2HB LYS 28 HB3 LYS 28 7.451 8.399 -18.597 233 1HG LYS 28 HG2 LYS 28 8.015 6.124 -19.204 234 2HG LYS 28 HG3 LYS 28 9.517 7.017 -18.964 235 1HD LYS 28 HD2 LYS 28 9.923 6.008 -16.866 236 2HD LYS 28 HD3 LYS 28 8.255 5.457 -16.712 237 1HE LYS 28 HE2 LYS 28 10.209 4.461 -18.805 238 2HE LYS 28 HE3 LYS 28 9.815 3.607 -17.312 239 1HZ LYS 28 HZ1 LYS 28 7.383 4.151 -18.328 240 2HZ LYS 28 HZ2 LYS 28 8.285 3.871 -19.741 241 3HZ LYS 28 HZ3 LYS 28 8.209 2.681 -18.534 242 H GLY 29 H GLY 29 8.299 10.382 -15.182 243 1HA GLY 29 HA2 GLY 29 8.586 12.795 -15.464 244 2HA GLY 29 HA3 GLY 29 8.317 12.581 -17.194 245 H GLN 30 H GLN 30 6.148 10.653 -15.514 246 HA GLN 30 HA GLN 30 4.063 12.788 -15.688 247 1HB GLN 30 HB2 GLN 30 3.736 11.076 -17.407 248 2HB GLN 30 HB3 GLN 30 3.788 9.809 -16.181 249 1HG GLN 30 HG2 GLN 30 1.861 11.873 -15.483 250 2HG GLN 30 HG3 GLN 30 1.505 11.170 -17.062 251 1HE2 GLN 30 HE21 GLN 30 0.690 9.023 -17.118 252 2HE2 GLN 30 HE22 GLN 30 0.452 8.076 -15.729 253 HA PRO 31 HA PRO 31 3.767 11.834 -11.308 254 1HB PRO 31 HB2 PRO 31 2.035 13.868 -10.737 255 2HB PRO 31 HB3 PRO 31 3.773 14.120 -10.975 256 1HG PRO 31 HG2 PRO 31 1.509 14.707 -12.833 257 2HG PRO 31 HG3 PRO 31 3.045 15.564 -12.624 258 1HD PRO 31 HD2 PRO 31 2.483 13.773 -14.693 259 2HD PRO 31 HD3 PRO 31 4.114 14.256 -14.178 260 H MET 32 H MET 32 2.177 10.764 -10.048 261 HA MET 32 HA MET 32 -0.626 10.728 -10.832 262 1HB MET 32 HB2 MET 32 1.030 8.949 -12.197 263 2HB MET 32 HB3 MET 32 0.328 7.968 -10.910 264 1HG MET 32 HG2 MET 32 -1.895 8.456 -11.608 265 2HG MET 32 HG3 MET 32 -1.358 9.778 -12.644 266 1HE MET 32 HE1 MET 32 -0.642 6.383 -11.636 267 2HE MET 32 HE2 MET 32 -1.665 5.528 -12.787 268 3HE MET 32 HE3 MET 32 0.089 5.574 -13.019 269 H THR 33 H THR 33 -1.788 8.965 -9.434 270 HA THR 33 HA THR 33 -0.488 9.005 -6.746 271 HB THR 33 HB THR 33 -3.415 8.516 -7.332 272 HG1 THR 33 HG1 THR 33 -3.398 10.529 -7.919 273 1HG2 THR 33 HG21 THR 33 -1.706 8.943 -4.931 274 2HG2 THR 33 HG22 THR 33 -3.310 9.679 -4.915 275 3HG2 THR 33 HG23 THR 33 -3.141 7.936 -5.128 276 H PHE 34 H PHE 34 0.524 7.076 -6.396 277 HA PHE 34 HA PHE 34 -0.627 4.597 -7.528 278 1HB PHE 34 HB2 PHE 34 1.973 5.305 -6.179 279 2HB PHE 34 HB3 PHE 34 1.489 3.619 -6.369 280 HD1 PHE 34 HD1 PHE 34 2.386 6.729 -8.154 281 HD2 PHE 34 HD2 PHE 34 1.406 2.566 -8.547 282 HE1 PHE 34 HE1 PHE 34 3.153 6.771 -10.512 283 HE2 PHE 34 HE2 PHE 34 2.172 2.607 -10.906 284 HZ PHE 34 HZ PHE 34 3.046 4.710 -11.888 285 H ARG 35 H ARG 35 -1.686 3.082 -6.290 286 HA ARG 35 HA ARG 35 -1.830 3.626 -3.350 287 1HB ARG 35 HB2 ARG 35 -3.958 3.991 -4.693 288 2HB ARG 35 HB3 ARG 35 -3.956 2.258 -5.017 289 1HG ARG 35 HG2 ARG 35 -4.947 1.910 -3.028 290 2HG ARG 35 HG3 ARG 35 -3.523 2.574 -2.227 291 1HD ARG 35 HD2 ARG 35 -4.466 4.664 -1.970 292 2HD ARG 35 HD3 ARG 35 -5.469 4.505 -3.412 293 HE ARG 35 HE ARG 35 -6.401 2.613 -1.519 294 1HH1 ARG 35 HH11 ARG 35 -6.166 6.013 -2.072 295 2HH1 ARG 35 HH12 ARG 35 -7.515 6.402 -1.061 296 1HH2 ARG 35 HH21 ARG 35 -8.129 3.113 -0.150 297 2HH2 ARG 35 HH22 ARG 35 -8.627 4.763 0.027 298 H LEU 36 H LEU 36 -1.508 1.885 -1.970 299 HA LEU 36 HA LEU 36 0.049 -0.310 -2.781 300 1HB LEU 36 HB2 LEU 36 -1.883 -0.234 -0.445 301 2HB LEU 36 HB3 LEU 36 -0.488 -1.302 -0.611 302 HG LEU 36 HG LEU 36 -0.482 1.710 -0.308 303 1HD1 LEU 36 HD11 LEU 36 0.026 -0.606 1.417 304 2HD1 LEU 36 HD12 LEU 36 1.346 0.563 1.428 305 3HD1 LEU 36 HD13 LEU 36 -0.286 1.073 1.857 306 1HD2 LEU 36 HD21 LEU 36 1.591 -0.185 -1.360 307 2HD2 LEU 36 HD22 LEU 36 1.227 1.465 -1.867 308 3HD2 LEU 36 HD23 LEU 36 2.114 1.178 -0.370 309 H LEU 37 H LEU 37 -0.428 -2.333 -3.596 310 HA LEU 37 HA LEU 37 -3.197 -2.757 -4.527 311 1HB LEU 37 HB2 LEU 37 -0.511 -3.754 -5.257 312 2HB LEU 37 HB3 LEU 37 -1.819 -4.927 -5.413 313 HG LEU 37 HG LEU 37 -2.259 -2.163 -6.473 314 1HD1 LEU 37 HD11 LEU 37 -0.377 -4.219 -7.578 315 2HD1 LEU 37 HD12 LEU 37 -1.346 -3.262 -8.699 316 3HD1 LEU 37 HD13 LEU 37 -0.240 -2.461 -7.585 317 1HD2 LEU 37 HD21 LEU 37 -3.245 -4.954 -6.929 318 2HD2 LEU 37 HD22 LEU 37 -4.163 -3.457 -6.765 319 3HD2 LEU 37 HD23 LEU 37 -3.320 -3.814 -8.273 320 H LEU 38 H LEU 38 -4.137 -4.966 -4.327 321 HA LEU 38 HA LEU 38 -5.094 -6.514 -2.828 322 1HB LEU 38 HB2 LEU 38 -2.227 -7.235 -2.238 323 2HB LEU 38 HB3 LEU 38 -3.622 -8.305 -2.387 324 HG LEU 38 HG LEU 38 -2.499 -6.662 -4.674 325 1HD1 LEU 38 HD11 LEU 38 -1.004 -8.532 -3.704 326 2HD1 LEU 38 HD12 LEU 38 -2.227 -9.648 -4.311 327 3HD1 LEU 38 HD13 LEU 38 -1.358 -8.598 -5.430 328 1HD2 LEU 38 HD21 LEU 38 -4.982 -7.867 -4.337 329 2HD2 LEU 38 HD22 LEU 38 -4.251 -7.437 -5.882 330 3HD2 LEU 38 HD23 LEU 38 -4.066 -9.070 -5.243 331 H VAL 39 H VAL 39 -4.642 -3.927 -1.531 332 HA VAL 39 HA VAL 39 -4.581 -4.947 1.236 333 HB VAL 39 HB VAL 39 -2.219 -4.143 0.403 334 1HG1 VAL 39 HG11 VAL 39 -3.588 -1.533 1.086 335 2HG1 VAL 39 HG12 VAL 39 -1.848 -1.737 0.890 336 3HG1 VAL 39 HG13 VAL 39 -2.925 -1.984 -0.484 337 1HG2 VAL 39 HG21 VAL 39 -3.345 -4.527 2.839 338 2HG2 VAL 39 HG22 VAL 39 -1.664 -4.043 2.610 339 3HG2 VAL 39 HG23 VAL 39 -2.892 -2.827 2.963 340 H ASP 40 H ASP 40 -4.725 -2.691 2.657 341 HA ASP 40 HA ASP 40 -6.374 -0.624 1.487 342 1HB ASP 40 HB2 ASP 40 -7.939 -2.655 1.648 343 2HB ASP 40 HB3 ASP 40 -7.829 -2.459 3.398 344 H THR 41 H THR 41 -6.668 1.106 2.969 345 HA THR 41 HA THR 41 -5.618 0.651 5.727 346 HB THR 41 HB THR 41 -4.647 3.084 5.366 347 HG1 THR 41 HG1 THR 41 -4.367 2.048 2.766 348 1HG2 THR 41 HG21 THR 41 -3.508 0.725 5.669 349 2HG2 THR 41 HG22 THR 41 -3.124 0.920 3.959 350 3HG2 THR 41 HG23 THR 41 -2.552 2.107 5.132 351 HA PRO 42 HA PRO 42 -9.027 3.121 7.020 352 1HB PRO 42 HB2 PRO 42 -7.994 4.216 9.298 353 2HB PRO 42 HB3 PRO 42 -8.424 2.502 9.163 354 1HG PRO 42 HG2 PRO 42 -5.728 3.780 9.124 355 2HG PRO 42 HG3 PRO 42 -6.209 2.185 9.725 356 1HD PRO 42 HD2 PRO 42 -4.956 2.677 7.264 357 2HD PRO 42 HD3 PRO 42 -5.829 1.190 7.695 358 H GLU 43 H GLU 43 -9.427 4.879 5.659 359 HA GLU 43 HA GLU 43 -7.580 7.026 5.200 360 1HB GLU 43 HB2 GLU 43 -10.135 6.255 4.245 361 2HB GLU 43 HB3 GLU 43 -10.308 7.896 4.869 362 1HG GLU 43 HG2 GLU 43 -8.827 8.787 3.338 363 2HG GLU 43 HG3 GLU 43 -7.904 7.291 3.203 364 H THR 44 H THR 44 -7.756 9.245 5.986 365 HA THR 44 HA THR 44 -8.577 9.325 8.822 366 HB THR 44 HB THR 44 -7.363 11.434 8.906 367 HG1 THR 44 HG1 THR 44 -6.541 12.333 7.026 368 1HG2 THR 44 HG21 THR 44 -6.218 8.961 7.904 369 2HG2 THR 44 HG22 THR 44 -5.278 10.357 7.376 370 3HG2 THR 44 HG23 THR 44 -5.568 10.089 9.095 371 H LYS 45 H LYS 45 -10.559 9.313 6.546 372 HA LYS 45 HA LYS 45 -11.787 12.000 6.928 373 1HB LYS 45 HB2 LYS 45 -12.128 9.820 4.879 374 2HB LYS 45 HB3 LYS 45 -13.389 11.033 5.108 375 1HG LYS 45 HG2 LYS 45 -12.159 12.663 4.123 376 2HG LYS 45 HG3 LYS 45 -10.682 12.168 4.951 377 1HD LYS 45 HD2 LYS 45 -10.796 10.107 3.319 378 2HD LYS 45 HD3 LYS 45 -11.818 11.174 2.355 379 1HE LYS 45 HE2 LYS 45 -10.078 12.836 2.214 380 2HE LYS 45 HE3 LYS 45 -9.082 11.970 3.384 381 1HZ LYS 45 HZ1 LYS 45 -9.941 10.699 0.862 382 2HZ LYS 45 HZ2 LYS 45 -8.557 11.676 0.922 383 3HZ LYS 45 HZ3 LYS 45 -8.648 10.275 1.879 384 H HIS 46 H HIS 46 -13.405 8.905 6.302 385 HA HIS 46 HA HIS 46 -14.477 8.712 9.003 386 1HB HIS 46 HB2 HIS 46 -15.801 10.603 7.921 387 2HB HIS 46 HB3 HIS 46 -16.445 9.396 6.807 388 HD1 HIS 46 HD1 HIS 46 -17.854 11.029 9.348 389 HD2 HIS 46 HD2 HIS 46 -16.949 6.972 9.035 390 HE1 HIS 46 HE1 HIS 46 -19.374 9.829 10.980 391 HA PRO 47 HA PRO 47 -14.480 4.764 6.687 392 1HB PRO 47 HB2 PRO 47 -13.264 3.355 8.685 393 2HB PRO 47 HB3 PRO 47 -12.363 4.306 7.492 394 1HG PRO 47 HG2 PRO 47 -12.929 4.919 10.351 395 2HG PRO 47 HG3 PRO 47 -11.549 5.396 9.348 396 1HD PRO 47 HD2 PRO 47 -13.747 7.032 10.014 397 2HD PRO 47 HD3 PRO 47 -12.553 7.359 8.739 398 H LYS 48 H LYS 48 -15.433 5.549 10.008 399 HA LYS 48 HA LYS 48 -17.955 4.160 9.721 400 1HB LYS 48 HB2 LYS 48 -15.671 2.770 11.019 401 2HB LYS 48 HB3 LYS 48 -17.211 2.702 11.876 402 1HG LYS 48 HG2 LYS 48 -18.032 2.194 9.326 403 2HG LYS 48 HG3 LYS 48 -16.428 1.460 9.309 404 1HD LYS 48 HD2 LYS 48 -17.008 -0.168 10.808 405 2HD LYS 48 HD3 LYS 48 -18.078 0.903 11.712 406 1HE LYS 48 HE2 LYS 48 -19.648 0.790 9.687 407 2HE LYS 48 HE3 LYS 48 -18.655 -0.555 9.128 408 1HZ LYS 48 HZ1 LYS 48 -19.696 -0.546 11.881 409 2HZ LYS 48 HZ2 LYS 48 -20.709 -1.012 10.604 410 3HZ LYS 48 HZ3 LYS 48 -19.269 -1.865 10.896 411 H LYS 49 H LYS 49 -15.632 4.982 12.332 412 HA LYS 49 HA LYS 49 -17.804 6.658 13.528 413 1HB LYS 49 HB2 LYS 49 -17.224 4.567 14.827 414 2HB LYS 49 HB3 LYS 49 -15.606 5.234 15.053 415 1HG LYS 49 HG2 LYS 49 -16.345 6.917 16.459 416 2HG LYS 49 HG3 LYS 49 -17.956 6.954 15.741 417 1HD LYS 49 HD2 LYS 49 -17.999 5.973 18.017 418 2HD LYS 49 HD3 LYS 49 -18.492 4.799 16.796 419 1HE LYS 49 HE2 LYS 49 -16.966 3.557 18.057 420 2HE LYS 49 HE3 LYS 49 -15.944 4.175 16.759 421 1HZ LYS 49 HZ1 LYS 49 -16.253 5.839 19.138 422 2HZ LYS 49 HZ2 LYS 49 -15.300 4.443 19.287 423 3HZ LYS 49 HZ3 LYS 49 -14.902 5.622 18.130 424 H GLY 50 H GLY 50 -16.967 8.527 12.412 425 1HA GLY 50 HA2 GLY 50 -15.488 10.330 12.066 426 2HA GLY 50 HA3 GLY 50 -15.267 10.210 13.812 427 H VAL 51 H VAL 51 -13.017 10.837 13.490 428 HA VAL 51 HA VAL 51 -11.336 8.502 12.709 429 HB VAL 51 HB VAL 51 -10.647 11.357 11.973 430 1HG1 VAL 51 HG11 VAL 51 -9.064 9.114 12.185 431 2HG1 VAL 51 HG12 VAL 51 -9.524 9.079 10.483 432 3HG1 VAL 51 HG13 VAL 51 -8.713 10.497 11.148 433 1HG2 VAL 51 HG21 VAL 51 -11.885 9.166 10.275 434 2HG2 VAL 51 HG22 VAL 51 -12.656 10.683 10.737 435 3HG2 VAL 51 HG23 VAL 51 -11.266 10.696 9.653 436 H GLU 52 H GLU 52 -11.669 8.635 15.254 437 HA GLU 52 HA GLU 52 -9.374 10.226 16.327 438 1HB GLU 52 HB2 GLU 52 -10.628 10.414 18.454 439 2HB GLU 52 HB3 GLU 52 -11.510 11.162 17.122 440 1HG GLU 52 HG2 GLU 52 -13.252 9.779 17.449 441 2HG GLU 52 HG3 GLU 52 -12.203 8.373 17.262 442 H LYS 53 H LYS 53 -9.002 7.643 15.351 443 HA LYS 53 HA LYS 53 -8.388 6.210 17.880 444 1HB LYS 53 HB2 LYS 53 -10.526 5.277 17.029 445 2HB LYS 53 HB3 LYS 53 -9.737 4.908 15.494 446 1HG LYS 53 HG2 LYS 53 -8.945 2.982 16.341 447 2HG LYS 53 HG3 LYS 53 -8.122 3.868 17.624 448 1HD LYS 53 HD2 LYS 53 -11.036 3.625 17.999 449 2HD LYS 53 HD3 LYS 53 -10.166 2.093 18.045 450 1HE LYS 53 HE2 LYS 53 -9.749 2.626 20.213 451 2HE LYS 53 HE3 LYS 53 -8.529 3.708 19.545 452 1HZ LYS 53 HZ1 LYS 53 -11.103 4.898 19.456 453 2HZ LYS 53 HZ2 LYS 53 -10.726 4.417 21.040 454 3HZ LYS 53 HZ3 LYS 53 -9.687 5.463 20.198 455 H TYR 54 H TYR 54 -8.185 5.373 14.403 456 HA TYR 54 HA TYR 54 -5.217 5.228 14.763 457 1HB TYR 54 HB2 TYR 54 -7.093 3.381 13.277 458 2HB TYR 54 HB3 TYR 54 -5.358 3.407 12.965 459 HD1 TYR 54 HD1 TYR 54 -4.176 3.837 15.585 460 HD2 TYR 54 HD2 TYR 54 -7.558 1.425 14.489 461 HE1 TYR 54 HE1 TYR 54 -3.795 2.400 17.569 462 HE2 TYR 54 HE2 TYR 54 -7.177 -0.012 16.474 463 HH TYR 54 HH TYR 54 -4.353 0.456 18.564 464 H GLY 55 H GLY 55 -7.037 7.397 13.673 465 1HA GLY 55 HA2 GLY 55 -6.799 7.486 10.823 466 2HA GLY 55 HA3 GLY 55 -7.016 8.896 11.863 467 HA PRO 56 HA PRO 56 -2.691 9.820 11.584 468 1HB PRO 56 HB2 PRO 56 -1.938 10.287 14.167 469 2HB PRO 56 HB3 PRO 56 -3.043 11.351 13.279 470 1HG PRO 56 HG2 PRO 56 -3.636 9.443 15.468 471 2HG PRO 56 HG3 PRO 56 -4.533 10.880 14.955 472 1HD PRO 56 HD2 PRO 56 -5.154 8.156 14.348 473 2HD PRO 56 HD3 PRO 56 -5.961 9.607 13.715 474 H GLU 57 H GLU 57 -2.181 7.484 10.933 475 HA GLU 57 HA GLU 57 -0.028 6.461 12.620 476 1HB GLU 57 HB2 GLU 57 -2.480 5.496 13.293 477 2HB GLU 57 HB3 GLU 57 -2.016 4.339 12.045 478 1HG GLU 57 HG2 GLU 57 -0.183 3.567 13.245 479 2HG GLU 57 HG3 GLU 57 -0.011 5.071 14.149 480 H ALA 58 H ALA 58 -2.241 5.144 10.120 481 HA ALA 58 HA ALA 58 -0.109 3.884 8.659 482 1HB ALA 58 HB1 ALA 58 -2.846 3.745 8.584 483 2HB ALA 58 HB2 ALA 58 -2.501 4.655 7.113 484 3HB ALA 58 HB3 ALA 58 -1.784 3.062 7.354 485 H SER 59 H SER 59 -1.786 6.999 8.294 486 HA SER 59 HA SER 59 -0.494 7.761 5.852 487 1HB SER 59 HB2 SER 59 -2.526 8.831 7.145 488 2HB SER 59 HB3 SER 59 -1.271 9.789 7.926 489 HG SER 59 HG SER 59 -1.180 9.501 5.150 490 H ALA 60 H ALA 60 0.222 8.748 9.225 491 HA ALA 60 HA ALA 60 2.652 10.106 8.573 492 1HB ALA 60 HB1 ALA 60 1.457 8.978 11.082 493 2HB ALA 60 HB2 ALA 60 3.149 9.476 11.097 494 3HB ALA 60 HB3 ALA 60 1.890 10.646 10.702 495 H PHE 61 H PHE 61 1.895 6.732 8.965 496 HA PHE 61 HA PHE 61 4.528 5.764 9.541 497 1HB PHE 61 HB2 PHE 61 2.581 4.327 9.818 498 2HB PHE 61 HB3 PHE 61 2.211 4.448 8.099 499 HD1 PHE 61 HD1 PHE 61 3.825 3.496 6.411 500 HD2 PHE 61 HD2 PHE 61 4.213 2.788 10.629 501 HE1 PHE 61 HE1 PHE 61 5.329 1.578 5.951 502 HE2 PHE 61 HE2 PHE 61 5.714 0.869 10.171 503 HZ PHE 61 HZ PHE 61 6.273 0.264 7.830 504 H THR 62 H THR 62 2.791 5.617 6.423 505 HA THR 62 HA THR 62 5.188 5.115 4.917 506 HB THR 62 HB THR 62 2.709 4.695 4.249 507 HG1 THR 62 HG1 THR 62 3.324 4.781 2.108 508 1HG2 THR 62 HG21 THR 62 3.071 7.561 3.329 509 2HG2 THR 62 HG22 THR 62 1.726 6.509 2.890 510 3HG2 THR 62 HG23 THR 62 1.942 7.012 4.566 511 H LYS 63 H LYS 63 3.803 7.989 6.219 512 HA LYS 63 HA LYS 63 4.795 9.916 4.367 513 1HB LYS 63 HB2 LYS 63 3.303 10.068 6.625 514 2HB LYS 63 HB3 LYS 63 4.855 10.638 7.242 515 1HG LYS 63 HG2 LYS 63 4.024 11.751 4.621 516 2HG LYS 63 HG3 LYS 63 3.062 12.260 6.010 517 1HD LYS 63 HD2 LYS 63 5.388 12.658 7.145 518 2HD LYS 63 HD3 LYS 63 5.994 12.678 5.488 519 1HE LYS 63 HE2 LYS 63 5.461 14.902 5.642 520 2HE LYS 63 HE3 LYS 63 3.861 14.307 5.195 521 1HZ LYS 63 HZ1 LYS 63 3.561 14.001 7.709 522 2HZ LYS 63 HZ2 LYS 63 4.876 15.062 7.859 523 3HZ LYS 63 HZ3 LYS 63 3.461 15.573 7.071 524 H LYS 64 H LYS 64 6.199 9.128 7.552 525 HA LYS 64 HA LYS 64 8.737 10.317 6.946 526 1HB LYS 64 HB2 LYS 64 7.522 8.911 9.154 527 2HB LYS 64 HB3 LYS 64 9.146 8.282 8.870 528 1HG LYS 64 HG2 LYS 64 10.065 10.134 9.752 529 2HG LYS 64 HG3 LYS 64 9.169 11.154 8.625 530 1HD LYS 64 HD2 LYS 64 8.256 11.910 10.605 531 2HD LYS 64 HD3 LYS 64 7.156 10.569 10.282 532 1HE LYS 64 HE2 LYS 64 7.794 10.191 12.512 533 2HE LYS 64 HE3 LYS 64 8.888 9.141 11.612 534 1HZ LYS 64 HZ1 LYS 64 9.653 11.917 12.240 535 2HZ LYS 64 HZ2 LYS 64 9.852 10.693 13.396 536 3HZ LYS 64 HZ3 LYS 64 10.650 10.584 11.900 537 H MET 65 H MET 65 7.365 7.186 6.274 538 HA MET 65 HA MET 65 9.817 5.752 5.849 539 1HB MET 65 HB2 MET 65 7.007 5.257 5.570 540 2HB MET 65 HB3 MET 65 7.816 4.767 4.081 541 1HG MET 65 HG2 MET 65 8.521 3.883 6.894 542 2HG MET 65 HG3 MET 65 7.814 2.886 5.623 543 1HE MET 65 HE1 MET 65 9.904 1.639 6.900 544 2HE MET 65 HE2 MET 65 11.574 1.793 6.361 545 3HE MET 65 HE3 MET 65 10.882 2.991 7.464 546 H VAL 66 H VAL 66 7.548 6.576 3.241 547 HA VAL 66 HA VAL 66 9.465 6.509 1.175 548 HB VAL 66 HB VAL 66 7.836 7.593 -0.200 549 1HG1 VAL 66 HG11 VAL 66 7.245 5.372 1.135 550 2HG1 VAL 66 HG12 VAL 66 6.015 6.409 1.859 551 3HG1 VAL 66 HG13 VAL 66 6.042 6.161 0.114 552 1HG2 VAL 66 HG21 VAL 66 7.067 8.870 2.392 553 2HG2 VAL 66 HG22 VAL 66 7.209 9.588 0.787 554 3HG2 VAL 66 HG23 VAL 66 5.795 8.617 1.197 555 H GLU 67 H GLU 67 8.694 9.079 3.445 556 HA GLU 67 HA GLU 67 10.002 11.209 2.022 557 1HB GLU 67 HB2 GLU 67 9.188 10.758 4.880 558 2HB GLU 67 HB3 GLU 67 10.208 12.136 4.469 559 1HG GLU 67 HG2 GLU 67 7.927 11.791 2.650 560 2HG GLU 67 HG3 GLU 67 7.455 12.111 4.319 561 H ASN 68 H ASN 68 11.145 8.772 4.312 562 HA ASN 68 HA ASN 68 13.882 9.929 4.137 563 1HB ASN 68 HB2 ASN 68 12.777 7.742 5.928 564 2HB ASN 68 HB3 ASN 68 14.414 8.396 6.002 565 1HD2 ASN 68 HD21 ASN 68 12.281 8.545 8.108 566 2HD2 ASN 68 HD22 ASN 68 12.043 10.200 8.399 567 H ALA 69 H ALA 69 12.120 7.878 2.339 568 HA ALA 69 HA ALA 69 13.937 5.611 2.144 569 1HB ALA 69 HB1 ALA 69 11.498 5.510 1.542 570 2HB ALA 69 HB2 ALA 69 11.849 6.531 0.148 571 3HB ALA 69 HB3 ALA 69 12.564 4.924 0.264 572 H LYS 70 H LYS 70 15.708 5.419 0.820 573 HA LYS 70 HA LYS 70 16.530 7.818 -0.694 574 1HB LYS 70 HB2 LYS 70 17.955 5.214 -0.079 575 2HB LYS 70 HB3 LYS 70 18.673 6.548 -0.982 576 1HG LYS 70 HG2 LYS 70 17.441 7.338 1.579 577 2HG LYS 70 HG3 LYS 70 18.832 6.265 1.740 578 1HD LYS 70 HD2 LYS 70 19.312 8.319 -0.262 579 2HD LYS 70 HD3 LYS 70 18.911 9.030 1.302 580 1HE LYS 70 HE2 LYS 70 20.706 7.937 2.389 581 2HE LYS 70 HE3 LYS 70 20.919 6.789 1.068 582 1HZ LYS 70 HZ1 LYS 70 21.168 9.469 0.157 583 2HZ LYS 70 HZ2 LYS 70 22.258 9.163 1.420 584 3HZ LYS 70 HZ3 LYS 70 22.271 8.184 0.031 585 H LYS 71 H LYS 71 15.751 4.411 -1.260 586 HA LYS 71 HA LYS 71 15.798 4.975 -4.195 587 1HB LYS 71 HB2 LYS 71 16.274 2.472 -2.589 588 2HB LYS 71 HB3 LYS 71 15.771 2.368 -4.277 589 1HG LYS 71 HG2 LYS 71 17.788 4.291 -4.298 590 2HG LYS 71 HG3 LYS 71 18.376 3.071 -3.170 591 1HD LYS 71 HD2 LYS 71 17.793 1.323 -4.911 592 2HD LYS 71 HD3 LYS 71 17.506 2.650 -6.037 593 1HE LYS 71 HE2 LYS 71 19.808 1.763 -6.253 594 2HE LYS 71 HE3 LYS 71 19.809 3.443 -5.717 595 1HZ LYS 71 HZ1 LYS 71 19.671 1.578 -3.546 596 2HZ LYS 71 HZ2 LYS 71 21.074 1.381 -4.480 597 3HZ LYS 71 HZ3 LYS 71 20.724 2.891 -3.782 598 H ILE 72 H ILE 72 13.813 5.167 -5.095 599 HA ILE 72 HA ILE 72 11.538 3.731 -3.782 600 HB ILE 72 HB ILE 72 11.559 6.416 -5.191 601 1HG1 ILE 72 HG12 ILE 72 10.378 6.622 -2.672 602 2HG1 ILE 72 HG13 ILE 72 11.744 5.537 -2.411 603 1HG2 ILE 72 HG21 ILE 72 9.428 4.474 -4.732 604 2HG2 ILE 72 HG22 ILE 72 9.081 6.029 -3.976 605 3HG2 ILE 72 HG23 ILE 72 9.411 5.943 -5.707 606 1HD1 ILE 72 HD11 ILE 72 12.296 7.905 -4.107 607 2HD1 ILE 72 HD12 ILE 72 11.969 8.244 -2.407 608 3HD1 ILE 72 HD13 ILE 72 13.290 7.162 -2.852 609 H GLU 73 H GLU 73 10.853 2.098 -5.086 610 HA GLU 73 HA GLU 73 10.849 2.601 -8.034 611 1HB GLU 73 HB2 GLU 73 11.597 0.013 -6.640 612 2HB GLU 73 HB3 GLU 73 11.479 0.239 -8.385 613 1HG GLU 73 HG2 GLU 73 13.306 1.786 -8.403 614 2HG GLU 73 HG3 GLU 73 13.299 1.913 -6.643 615 H VAL 74 H VAL 74 9.237 1.305 -9.199 616 HA VAL 74 HA VAL 74 6.996 0.381 -7.452 617 HB VAL 74 HB VAL 74 5.455 1.255 -9.228 618 1HG1 VAL 74 HG11 VAL 74 6.215 2.539 -7.118 619 2HG1 VAL 74 HG12 VAL 74 7.236 3.472 -8.212 620 3HG1 VAL 74 HG13 VAL 74 5.484 3.484 -8.416 621 1HG2 VAL 74 HG21 VAL 74 8.006 1.700 -10.537 622 2HG2 VAL 74 HG22 VAL 74 6.380 1.783 -11.215 623 3HG2 VAL 74 HG23 VAL 74 7.086 3.200 -10.436 624 H GLU 75 H GLU 75 6.031 -1.545 -8.098 625 HA GLU 75 HA GLU 75 7.204 -2.823 -10.536 626 1HB GLU 75 HB2 GLU 75 7.908 -4.040 -8.584 627 2HB GLU 75 HB3 GLU 75 6.274 -4.030 -7.919 628 1HG GLU 75 HG2 GLU 75 5.476 -5.455 -9.722 629 2HG GLU 75 HG3 GLU 75 7.048 -5.379 -10.520 630 H PHE 76 H PHE 76 5.612 -2.355 -12.055 631 HA PHE 76 HA PHE 76 2.788 -2.420 -11.469 632 1HB PHE 76 HB2 PHE 76 4.344 -2.501 -14.065 633 2HB PHE 76 HB3 PHE 76 2.583 -2.470 -14.005 634 HD1 PHE 76 HD1 PHE 76 5.669 -0.573 -13.328 635 HD2 PHE 76 HD2 PHE 76 1.375 -0.492 -13.239 636 HE1 PHE 76 HE1 PHE 76 5.721 1.889 -13.027 637 HE2 PHE 76 HE2 PHE 76 1.427 1.969 -12.938 638 HZ PHE 76 HZ PHE 76 3.600 3.158 -12.831 639 H ASP 77 H ASP 77 1.260 -4.055 -12.051 640 HA ASP 77 HA ASP 77 2.414 -6.779 -12.027 641 1HB ASP 77 HB2 ASP 77 0.189 -5.649 -10.812 642 2HB ASP 77 HB3 ASP 77 -0.505 -6.573 -12.144 643 H LYS 78 H LYS 78 0.367 -8.161 -13.359 644 HA LYS 78 HA LYS 78 0.979 -7.404 -16.165 645 1HB LYS 78 HB2 LYS 78 0.203 -9.679 -16.715 646 2HB LYS 78 HB3 LYS 78 1.441 -9.732 -15.459 647 1HG LYS 78 HG2 LYS 78 -1.352 -9.479 -14.497 648 2HG LYS 78 HG3 LYS 78 -0.940 -11.019 -15.253 649 1HD LYS 78 HD2 LYS 78 1.085 -9.980 -13.366 650 2HD LYS 78 HD3 LYS 78 -0.452 -10.434 -12.630 651 1HE LYS 78 HE2 LYS 78 0.524 -12.510 -12.612 652 2HE LYS 78 HE3 LYS 78 -0.111 -12.557 -14.257 653 1HZ LYS 78 HZ1 LYS 78 2.544 -11.399 -13.742 654 2HZ LYS 78 HZ2 LYS 78 2.366 -13.086 -13.836 655 3HZ LYS 78 HZ3 LYS 78 1.942 -12.108 -15.159 656 H GLY 79 H GLY 79 -1.581 -7.348 -13.870 657 1HA GLY 79 HA2 GLY 79 -3.759 -7.423 -15.808 658 2HA GLY 79 HA3 GLY 79 -3.903 -6.974 -14.108 659 H GLN 80 H GLN 80 -5.138 -5.091 -14.531 660 HA GLN 80 HA GLN 80 -4.455 -3.098 -16.457 661 1HB GLN 80 HB2 GLN 80 -5.934 -2.817 -13.823 662 2HB GLN 80 HB3 GLN 80 -5.907 -1.603 -15.102 663 1HG GLN 80 HG2 GLN 80 -6.681 -4.367 -15.892 664 2HG GLN 80 HG3 GLN 80 -7.846 -3.456 -14.932 665 1HE2 GLN 80 HE21 GLN 80 -7.951 -4.194 -17.867 666 2HE2 GLN 80 HE22 GLN 80 -8.134 -2.717 -18.685 667 H ARG 81 H ARG 81 -3.338 -1.092 -16.173 668 HA ARG 81 HA ARG 81 -1.261 -1.211 -14.048 669 1HB ARG 81 HB2 ARG 81 -1.422 0.647 -16.439 670 2HB ARG 81 HB3 ARG 81 -0.022 0.374 -15.400 671 1HG ARG 81 HG2 ARG 81 0.088 -1.967 -16.127 672 2HG ARG 81 HG3 ARG 81 -1.342 -1.736 -17.132 673 1HD ARG 81 HD2 ARG 81 -0.130 -0.004 -18.432 674 2HD ARG 81 HD3 ARG 81 1.307 -0.292 -17.451 675 HE ARG 81 HE ARG 81 0.842 -2.786 -18.387 676 1HH1 ARG 81 HH11 ARG 81 2.635 -0.483 -19.631 677 2HH1 ARG 81 HH12 ARG 81 2.272 -0.735 -21.306 678 1HH2 ARG 81 HH21 ARG 81 -0.455 -2.785 -20.677 679 2HH2 ARG 81 HH22 ARG 81 0.520 -2.038 -21.899 680 H THR 82 H THR 82 -4.256 0.164 -14.503 681 HA THR 82 HA THR 82 -3.713 2.176 -12.409 682 HB THR 82 HB THR 82 -5.226 3.754 -13.956 683 HG1 THR 82 HG1 THR 82 -4.919 3.394 -16.059 684 1HG2 THR 82 HG21 THR 82 -2.861 4.083 -13.002 685 2HG2 THR 82 HG22 THR 82 -2.280 3.493 -14.559 686 3HG2 THR 82 HG23 THR 82 -3.254 4.961 -14.480 687 H ASP 83 H ASP 83 -5.903 3.188 -11.718 688 HA ASP 83 HA ASP 83 -7.947 1.015 -11.790 689 1HB ASP 83 HB2 ASP 83 -6.970 2.818 -9.712 690 2HB ASP 83 HB3 ASP 83 -8.726 2.847 -9.844 691 H LYS 84 H LYS 84 -10.206 2.362 -11.106 692 HA LYS 84 HA LYS 84 -10.865 3.738 -13.591 693 1HB LYS 84 HB2 LYS 84 -13.125 3.979 -12.529 694 2HB LYS 84 HB3 LYS 84 -12.543 2.314 -12.554 695 1HG LYS 84 HG2 LYS 84 -11.953 2.375 -10.248 696 2HG LYS 84 HG3 LYS 84 -12.098 4.132 -10.181 697 1HD LYS 84 HD2 LYS 84 -14.387 4.078 -10.033 698 2HD LYS 84 HD3 LYS 84 -14.522 2.628 -11.030 699 1HE LYS 84 HE2 LYS 84 -14.494 1.269 -9.224 700 2HE LYS 84 HE3 LYS 84 -13.118 2.118 -8.518 701 1HZ LYS 84 HZ1 LYS 84 -15.792 3.352 -8.505 702 2HZ LYS 84 HZ2 LYS 84 -15.377 2.203 -7.325 703 3HZ LYS 84 HZ3 LYS 84 -14.477 3.635 -7.466 704 H TYR 85 H TYR 85 -9.263 4.778 -10.909 705 HA TYR 85 HA TYR 85 -10.458 7.514 -11.064 706 1HB TYR 85 HB2 TYR 85 -8.854 6.150 -8.885 707 2HB TYR 85 HB3 TYR 85 -9.235 7.872 -8.874 708 HD1 TYR 85 HD1 TYR 85 -11.711 8.558 -9.052 709 HD2 TYR 85 HD2 TYR 85 -10.422 4.570 -8.109 710 HE1 TYR 85 HE1 TYR 85 -13.950 8.057 -8.111 711 HE2 TYR 85 HE2 TYR 85 -12.660 4.070 -7.169 712 HH TYR 85 HH TYR 85 -15.041 6.555 -6.665 713 H GLY 86 H GLY 86 -7.943 5.740 -12.277 714 1HA GLY 86 HA2 GLY 86 -6.156 6.606 -13.603 715 2HA GLY 86 HA3 GLY 86 -6.412 8.190 -12.868 716 H ARG 87 H ARG 87 -6.328 5.682 -10.574 717 HA ARG 87 HA ARG 87 -3.762 6.668 -9.547 718 1HB ARG 87 HB2 ARG 87 -5.510 4.414 -8.511 719 2HB ARG 87 HB3 ARG 87 -4.214 5.228 -7.633 720 1HG ARG 87 HG2 ARG 87 -5.602 7.399 -8.169 721 2HG ARG 87 HG3 ARG 87 -6.934 6.260 -8.376 722 1HD ARG 87 HD2 ARG 87 -6.045 5.300 -6.076 723 2HD ARG 87 HD3 ARG 87 -5.373 6.921 -5.907 724 HE ARG 87 HE ARG 87 -7.634 7.809 -5.924 725 1HH1 ARG 87 HH11 ARG 87 -7.840 4.657 -7.095 726 2HH1 ARG 87 HH12 ARG 87 -9.276 4.245 -6.219 727 1HH2 ARG 87 HH21 ARG 87 -9.296 7.169 -4.355 728 2HH2 ARG 87 HH22 ARG 87 -10.101 5.666 -4.667 729 H GLY 88 H GLY 88 -1.813 5.644 -9.796 730 1HA GLY 88 HA2 GLY 88 -1.620 3.417 -11.649 731 2HA GLY 88 HA3 GLY 88 -0.272 4.154 -10.780 732 H LEU 89 H LEU 89 -1.507 1.259 -11.158 733 HA LEU 89 HA LEU 89 -1.541 0.538 -8.265 734 1HB LEU 89 HB2 LEU 89 -2.334 -1.136 -10.667 735 2HB LEU 89 HB3 LEU 89 -2.551 -1.570 -8.970 736 HG LEU 89 HG LEU 89 -3.790 0.860 -10.296 737 1HD1 LEU 89 HD11 LEU 89 -4.741 -1.947 -9.866 738 2HD1 LEU 89 HD12 LEU 89 -5.904 -0.631 -9.710 739 3HD1 LEU 89 HD13 LEU 89 -5.033 -0.863 -11.226 740 1HD2 LEU 89 HD21 LEU 89 -4.213 -0.427 -7.578 741 2HD2 LEU 89 HD22 LEU 89 -3.382 1.100 -7.873 742 3HD2 LEU 89 HD23 LEU 89 -5.109 0.959 -8.203 743 H ALA 90 H ALA 90 0.350 -0.206 -7.472 744 HA ALA 90 HA ALA 90 1.880 -2.259 -8.801 745 1HB ALA 90 HB1 ALA 90 2.661 0.575 -9.185 746 2HB ALA 90 HB2 ALA 90 3.965 -0.516 -8.721 747 3HB ALA 90 HB3 ALA 90 3.024 -0.837 -10.178 748 H TYR 91 H TYR 91 3.694 -2.965 -7.450 749 HA TYR 91 HA TYR 91 3.196 -2.409 -4.609 750 1HB TYR 91 HB2 TYR 91 5.367 -4.155 -5.795 751 2HB TYR 91 HB3 TYR 91 4.677 -4.244 -4.174 752 HD1 TYR 91 HD1 TYR 91 2.430 -5.160 -3.802 753 HD2 TYR 91 HD2 TYR 91 4.150 -4.993 -7.735 754 HE1 TYR 91 HE1 TYR 91 0.679 -6.707 -4.634 755 HE2 TYR 91 HE2 TYR 91 2.402 -6.541 -8.566 756 HH TYR 91 HH TYR 91 0.259 -8.216 -6.420 757 H ILE 92 H ILE 92 4.234 -0.796 -3.555 758 HA ILE 92 HA ILE 92 6.522 0.540 -4.823 759 HB ILE 92 HB ILE 92 5.046 1.087 -2.232 760 1HG1 ILE 92 HG12 ILE 92 5.007 2.532 -4.901 761 2HG1 ILE 92 HG13 ILE 92 3.760 1.408 -4.358 762 1HG2 ILE 92 HG21 ILE 92 7.492 1.851 -2.389 763 2HG2 ILE 92 HG22 ILE 92 6.960 2.924 -3.684 764 3HG2 ILE 92 HG23 ILE 92 6.298 3.106 -2.059 765 1HD1 ILE 92 HD11 ILE 92 4.486 3.587 -2.470 766 2HD1 ILE 92 HD12 ILE 92 3.606 4.065 -3.922 767 3HD1 ILE 92 HD13 ILE 92 2.910 2.878 -2.818 768 H TYR 93 H TYR 93 8.615 0.613 -3.999 769 HA TYR 93 HA TYR 93 9.205 -1.106 -1.627 770 1HB TYR 93 HB2 TYR 93 10.588 -1.119 -4.325 771 2HB TYR 93 HB3 TYR 93 11.305 -1.820 -2.874 772 HD1 TYR 93 HD1 TYR 93 10.356 -3.819 -1.831 773 HD2 TYR 93 HD2 TYR 93 8.623 -2.119 -5.374 774 HE1 TYR 93 HE1 TYR 93 9.041 -5.893 -2.183 775 HE2 TYR 93 HE2 TYR 93 7.309 -4.193 -5.727 776 HH TYR 93 HH TYR 93 7.285 -6.781 -3.328 777 H ALA 94 H ALA 94 10.299 0.114 -0.151 778 HA ALA 94 HA ALA 94 11.910 2.417 -1.175 779 1HB ALA 94 HB1 ALA 94 9.885 2.987 0.228 780 2HB ALA 94 HB2 ALA 94 10.662 2.154 1.574 781 3HB ALA 94 HB3 ALA 94 11.410 3.589 0.875 782 H ASP 95 H ASP 95 14.063 2.237 -0.832 783 HA ASP 95 HA ASP 95 16.108 1.510 0.053 784 1HB ASP 95 HB2 ASP 95 14.258 1.477 2.402 785 2HB ASP 95 HB3 ASP 95 15.830 0.696 2.572 786 H GLY 96 H GLY 96 13.850 -0.445 -0.966 787 1HA GLY 96 HA2 GLY 96 14.237 -2.712 -1.670 788 2HA GLY 96 HA3 GLY 96 15.469 -2.862 -0.417 789 H LYS 97 H LYS 97 12.289 -1.529 0.256 790 HA LYS 97 HA LYS 97 11.578 -4.071 1.659 791 1HB LYS 97 HB2 LYS 97 12.279 -1.654 2.904 792 2HB LYS 97 HB3 LYS 97 10.518 -1.711 2.986 793 1HG LYS 97 HG2 LYS 97 10.501 -3.569 4.336 794 2HG LYS 97 HG3 LYS 97 11.974 -4.228 3.624 795 1HD LYS 97 HD2 LYS 97 13.243 -3.309 5.241 796 2HD LYS 97 HD3 LYS 97 12.535 -1.719 4.955 797 1HE LYS 97 HE2 LYS 97 11.076 -1.922 6.686 798 2HE LYS 97 HE3 LYS 97 10.739 -3.616 6.324 799 1HZ LYS 97 HZ1 LYS 97 13.353 -2.833 7.433 800 2HZ LYS 97 HZ2 LYS 97 12.014 -3.015 8.465 801 3HZ LYS 97 HZ3 LYS 97 12.553 -4.326 7.528 802 H MET 98 H MET 98 9.436 -4.685 1.398 803 HA MET 98 HA MET 98 7.875 -3.260 -0.608 804 1HB MET 98 HB2 MET 98 7.835 -5.739 -0.403 805 2HB MET 98 HB3 MET 98 7.073 -5.579 1.179 806 1HG MET 98 HG2 MET 98 5.271 -4.188 -0.023 807 2HG MET 98 HG3 MET 98 5.946 -4.831 -1.521 808 1HE MET 98 HE1 MET 98 6.936 -7.296 -1.226 809 2HE MET 98 HE2 MET 98 5.785 -8.624 -1.018 810 3HE MET 98 HE3 MET 98 5.570 -7.465 -2.328 811 H VAL 99 H VAL 99 7.165 -1.273 0.146 812 HA VAL 99 HA VAL 99 6.437 -0.523 2.725 813 HB VAL 99 HB VAL 99 5.003 0.338 0.194 814 1HG1 VAL 99 HG11 VAL 99 5.177 1.362 3.006 815 2HG1 VAL 99 HG12 VAL 99 5.053 2.529 1.689 816 3HG1 VAL 99 HG13 VAL 99 3.792 1.318 1.915 817 1HG2 VAL 99 HG21 VAL 99 7.708 0.456 0.626 818 2HG2 VAL 99 HG22 VAL 99 6.814 1.607 -0.367 819 3HG2 VAL 99 HG23 VAL 99 7.181 1.992 1.316 820 H ASN 100 H ASN 100 4.481 -2.299 0.361 821 HA ASN 100 HA ASN 100 2.003 -2.191 1.764 822 1HB ASN 100 HB2 ASN 100 3.060 -4.467 0.059 823 2HB ASN 100 HB3 ASN 100 1.369 -4.145 0.443 824 1HD2 ASN 100 HD21 ASN 100 0.811 -3.786 -1.828 825 2HD2 ASN 100 HD22 ASN 100 1.319 -2.390 -2.649 826 H GLU 101 H GLU 101 4.667 -4.562 1.937 827 HA GLU 101 HA GLU 101 3.356 -6.134 3.996 828 1HB GLU 101 HB2 GLU 101 5.341 -6.721 2.310 829 2HB GLU 101 HB3 GLU 101 6.325 -6.187 3.672 830 1HG GLU 101 HG2 GLU 101 4.418 -7.782 4.885 831 2HG GLU 101 HG3 GLU 101 4.736 -8.631 3.372 832 H ALA 102 H ALA 102 5.209 -3.225 3.981 833 HA ALA 102 HA ALA 102 6.256 -3.422 6.670 834 1HB ALA 102 HB1 ALA 102 6.791 -1.753 4.636 835 2HB ALA 102 HB2 ALA 102 5.621 -0.753 5.497 836 3HB ALA 102 HB3 ALA 102 7.086 -1.299 6.315 837 H LEU 103 H LEU 103 3.356 -1.958 5.243 838 HA LEU 103 HA LEU 103 2.349 -0.928 7.750 839 1HB LEU 103 HB2 LEU 103 0.971 -1.554 5.121 840 2HB LEU 103 HB3 LEU 103 0.183 -0.750 6.478 841 HG LEU 103 HG LEU 103 2.792 0.390 5.646 842 1HD1 LEU 103 HD11 LEU 103 0.434 0.168 3.834 843 2HD1 LEU 103 HD12 LEU 103 1.242 1.734 3.910 844 3HD1 LEU 103 HD13 LEU 103 2.149 0.296 3.438 845 1HD2 LEU 103 HD21 LEU 103 0.634 1.114 7.256 846 2HD2 LEU 103 HD22 LEU 103 1.946 2.177 6.746 847 3HD2 LEU 103 HD23 LEU 103 0.445 2.124 5.822 848 H VAL 104 H VAL 104 1.676 -3.873 5.850 849 HA VAL 104 HA VAL 104 -0.328 -4.940 7.569 850 HB VAL 104 HB VAL 104 1.670 -6.226 5.700 851 1HG1 VAL 104 HG11 VAL 104 -0.076 -7.469 7.740 852 2HG1 VAL 104 HG12 VAL 104 -0.213 -8.157 6.121 853 3HG1 VAL 104 HG13 VAL 104 1.351 -8.117 6.933 854 1HG2 VAL 104 HG21 VAL 104 -1.184 -5.349 5.628 855 2HG2 VAL 104 HG22 VAL 104 0.045 -5.276 4.365 856 3HG2 VAL 104 HG23 VAL 104 -0.762 -6.802 4.723 857 H ARG 105 H ARG 105 3.214 -5.164 7.687 858 HA ARG 105 HA ARG 105 3.349 -7.075 9.816 859 1HB ARG 105 HB2 ARG 105 5.240 -6.225 8.269 860 2HB ARG 105 HB3 ARG 105 5.377 -4.880 9.402 861 1HG ARG 105 HG2 ARG 105 6.123 -6.231 11.132 862 2HG ARG 105 HG3 ARG 105 5.309 -7.664 10.501 863 1HD ARG 105 HD2 ARG 105 7.569 -8.106 10.036 864 2HD ARG 105 HD3 ARG 105 6.978 -7.448 8.511 865 HE ARG 105 HE ARG 105 8.093 -5.334 9.062 866 1HH1 ARG 105 HH11 ARG 105 8.245 -7.500 11.687 867 2HH1 ARG 105 HH12 ARG 105 9.847 -7.050 12.164 868 1HH2 ARG 105 HH21 ARG 105 10.350 -4.950 9.451 869 2HH2 ARG 105 HH22 ARG 105 11.040 -5.606 10.898 870 H GLN 106 H GLN 106 3.189 -3.521 9.810 871 HA GLN 106 HA GLN 106 3.414 -3.346 12.709 872 1HB GLN 106 HB2 GLN 106 3.109 -1.488 10.450 873 2HB GLN 106 HB3 GLN 106 2.255 -0.979 11.907 874 1HG GLN 106 HG2 GLN 106 4.913 -2.021 12.509 875 2HG GLN 106 HG3 GLN 106 4.977 -0.646 11.405 876 1HE2 GLN 106 HE21 GLN 106 3.212 -1.589 14.422 877 2HE2 GLN 106 HE22 GLN 106 3.309 -0.048 15.127 878 H GLY 107 H GLY 107 0.864 -4.032 10.507 879 1HA GLY 107 HA2 GLY 107 -1.313 -4.787 11.129 880 2HA GLY 107 HA3 GLY 107 -1.035 -4.164 12.755 881 H LEU 108 H LEU 108 -0.282 -2.063 10.117 882 HA LEU 108 HA LEU 108 -2.639 -0.395 10.854 883 1HB LEU 108 HB2 LEU 108 -0.093 0.333 9.372 884 2HB LEU 108 HB3 LEU 108 -1.383 1.458 9.798 885 HG LEU 108 HG LEU 108 0.195 -0.190 11.796 886 1HD1 LEU 108 HD11 LEU 108 1.379 1.733 10.499 887 2HD1 LEU 108 HD12 LEU 108 0.340 2.801 11.444 888 3HD1 LEU 108 HD13 LEU 108 1.480 1.730 12.261 889 1HD2 LEU 108 HD21 LEU 108 -1.835 2.046 12.112 890 2HD2 LEU 108 HD22 LEU 108 -2.073 0.354 12.552 891 3HD2 LEU 108 HD23 LEU 108 -0.904 1.338 13.432 892 H ALA 109 H ALA 109 -2.175 -2.734 8.740 893 HA ALA 109 HA ALA 109 -4.000 -1.537 6.772 894 1HB ALA 109 HB1 ALA 109 -1.138 -2.177 6.176 895 2HB ALA 109 HB2 ALA 109 -2.345 -2.524 4.938 896 3HB ALA 109 HB3 ALA 109 -2.150 -0.879 5.543 897 H LYS 110 H LYS 110 -5.069 -3.162 5.505 898 HA LYS 110 HA LYS 110 -4.503 -5.969 6.368 899 1HB LYS 110 HB2 LYS 110 -7.258 -4.828 5.825 900 2HB LYS 110 HB3 LYS 110 -6.870 -6.413 6.497 901 1HG LYS 110 HG2 LYS 110 -6.121 -5.488 8.544 902 2HG LYS 110 HG3 LYS 110 -5.995 -3.866 7.860 903 1HD LYS 110 HD2 LYS 110 -8.664 -5.236 7.878 904 2HD LYS 110 HD3 LYS 110 -8.067 -4.503 9.367 905 1HE LYS 110 HE2 LYS 110 -7.542 -2.473 7.703 906 2HE LYS 110 HE3 LYS 110 -8.874 -3.203 6.806 907 1HZ LYS 110 HZ1 LYS 110 -8.967 -2.442 9.675 908 2HZ LYS 110 HZ2 LYS 110 -9.634 -1.535 8.401 909 3HZ LYS 110 HZ3 LYS 110 -10.250 -3.077 8.764 910 H VAL 111 H VAL 111 -5.070 -7.591 4.765 911 HA VAL 111 HA VAL 111 -4.506 -6.744 2.051 912 HB VAL 111 HB VAL 111 -5.410 -9.394 3.214 913 1HG1 VAL 111 HG11 VAL 111 -5.185 -8.463 0.434 914 2HG1 VAL 111 HG12 VAL 111 -4.247 -9.919 0.766 915 3HG1 VAL 111 HG13 VAL 111 -5.982 -9.899 1.078 916 1HG2 VAL 111 HG21 VAL 111 -3.094 -8.406 3.734 917 2HG2 VAL 111 HG22 VAL 111 -3.121 -10.027 3.040 918 3HG2 VAL 111 HG23 VAL 111 -2.735 -8.639 2.024 919 H ALA 112 H ALA 112 -5.953 -6.304 0.418 920 HA ALA 112 HA ALA 112 -8.700 -7.255 0.493 921 1HB ALA 112 HB1 ALA 112 -8.124 -4.838 1.872 922 2HB ALA 112 HB2 ALA 112 -8.970 -4.395 0.389 923 3HB ALA 112 HB3 ALA 112 -9.709 -5.527 1.521 924 H TYR 113 H TYR 113 -9.950 -5.678 -1.262 925 HA TYR 113 HA TYR 113 -10.079 -5.326 -3.583 926 1HB TYR 113 HB2 TYR 113 -7.419 -4.038 -2.907 927 2HB TYR 113 HB3 TYR 113 -8.231 -3.855 -4.463 928 HD1 TYR 113 HD1 TYR 113 -10.933 -3.385 -4.080 929 HD2 TYR 113 HD2 TYR 113 -7.726 -2.247 -1.458 930 HE1 TYR 113 HE1 TYR 113 -12.348 -1.582 -3.131 931 HE2 TYR 113 HE2 TYR 113 -9.141 -0.444 -0.510 932 HH TYR 113 HH TYR 113 -11.584 0.858 -1.829 933 H VAL 114 H VAL 114 -9.934 -7.584 -4.146 934 HA VAL 114 HA VAL 114 -7.239 -8.391 -5.170 935 HB VAL 114 HB VAL 114 -9.521 -10.096 -4.128 936 1HG1 VAL 114 HG11 VAL 114 -8.353 -11.062 -6.138 937 2HG1 VAL 114 HG12 VAL 114 -6.843 -10.992 -5.231 938 3HG1 VAL 114 HG13 VAL 114 -8.159 -12.025 -4.674 939 1HG2 VAL 114 HG21 VAL 114 -6.762 -9.370 -3.143 940 2HG2 VAL 114 HG22 VAL 114 -8.296 -9.288 -2.276 941 3HG2 VAL 114 HG23 VAL 114 -7.554 -10.852 -2.608 942 H TYR 115 H TYR 115 -7.486 -7.628 -7.293 943 HA TYR 115 HA TYR 115 -9.777 -8.804 -8.817 944 1HB TYR 115 HB2 TYR 115 -8.248 -6.244 -9.373 945 2HB TYR 115 HB3 TYR 115 -9.572 -6.882 -10.350 946 HD1 TYR 115 HD1 TYR 115 -8.679 -5.539 -7.002 947 HD2 TYR 115 HD2 TYR 115 -11.855 -6.624 -9.682 948 HE1 TYR 115 HE1 TYR 115 -10.320 -4.439 -5.502 949 HE2 TYR 115 HE2 TYR 115 -13.497 -5.525 -8.183 950 HH TYR 115 HH TYR 115 -13.303 -4.971 -5.337 951 H LYS 116 H LYS 116 -8.837 -10.634 -9.676 952 HA LYS 116 HA LYS 116 -6.141 -10.928 -10.508 953 1HB LYS 116 HB2 LYS 116 -8.674 -12.280 -11.484 954 2HB LYS 116 HB3 LYS 116 -7.053 -12.810 -11.927 955 1HG LYS 116 HG2 LYS 116 -6.945 -12.539 -9.149 956 2HG LYS 116 HG3 LYS 116 -8.525 -13.260 -9.453 957 1HD LYS 116 HD2 LYS 116 -6.160 -14.356 -10.926 958 2HD LYS 116 HD3 LYS 116 -6.361 -14.782 -9.227 959 1HE LYS 116 HE2 LYS 116 -7.633 -16.460 -10.162 960 2HE LYS 116 HE3 LYS 116 -8.877 -15.216 -10.037 961 1HZ LYS 116 HZ1 LYS 116 -7.268 -15.067 -12.428 962 2HZ LYS 116 HZ2 LYS 116 -8.205 -16.480 -12.308 963 3HZ LYS 116 HZ3 LYS 116 -8.954 -14.960 -12.242 964 HA PRO 117 HA PRO 117 -5.326 -12.223 -12.115 965 1HB PRO 117 HB2 PRO 117 -3.279 -11.957 -13.896 966 2HB PRO 117 HB3 PRO 117 -4.819 -12.731 -14.308 967 1HG PRO 117 HG2 PRO 117 -3.769 -10.097 -15.152 968 2HG PRO 117 HG3 PRO 117 -4.997 -11.116 -15.919 969 1HD PRO 117 HD2 PRO 117 -5.437 -8.803 -14.278 970 2HD PRO 117 HD3 PRO 117 -6.664 -9.884 -14.973 971 H ASN 118 H ASN 118 -5.171 -9.334 -11.119 972 HA ASN 118 HA ASN 118 -2.299 -8.847 -10.787 973 1HB ASN 118 HB2 ASN 118 -4.795 -7.521 -9.712 974 2HB ASN 118 HB3 ASN 118 -3.181 -7.048 -9.177 975 1HD2 ASN 118 HD21 ASN 118 -4.916 -5.272 -10.667 976 2HD2 ASN 118 HD22 ASN 118 -4.186 -4.978 -12.171 977 H ASN 119 H ASN 119 -2.017 -11.095 -9.809 978 HA ASN 119 HA ASN 119 -2.338 -10.883 -6.855 979 1HB ASN 119 HB2 ASN 119 -3.570 -12.843 -8.636 980 2HB ASN 119 HB3 ASN 119 -2.579 -13.602 -7.393 981 1HD2 ASN 119 HD21 ASN 119 -4.649 -14.370 -6.390 982 2HD2 ASN 119 HD22 ASN 119 -5.568 -13.297 -5.448 983 H THR 120 H THR 120 -0.081 -10.610 -8.883 984 HA THR 120 HA THR 120 1.647 -12.867 -8.725 985 HB THR 120 HB THR 120 2.223 -9.908 -9.010 986 HG1 THR 120 HG1 THR 120 1.150 -11.157 -10.694 987 1HG2 THR 120 HG21 THR 120 4.037 -12.165 -8.519 988 2HG2 THR 120 HG22 THR 120 4.429 -11.248 -9.974 989 3HG2 THR 120 HG23 THR 120 4.344 -10.431 -8.414 990 H HIS 121 H HIS 121 0.841 -10.419 -6.378 991 HA HIS 121 HA HIS 121 2.801 -11.683 -4.505 992 1HB HIS 121 HB2 HIS 121 2.201 -8.782 -5.011 993 2HB HIS 121 HB3 HIS 121 2.703 -9.294 -3.401 994 HD1 HIS 121 HD1 HIS 121 4.704 -11.530 -4.265 995 HD2 HIS 121 HD2 HIS 121 4.632 -7.687 -5.878 996 HE1 HIS 121 HE1 HIS 121 7.013 -11.109 -5.216 997 H GLU 122 H GLU 122 0.102 -12.514 -4.820 998 HA GLU 122 HA GLU 122 -1.432 -11.241 -2.647 999 1HB GLU 122 HB2 GLU 122 -2.442 -12.118 -4.835 1000 2HB GLU 122 HB3 GLU 122 -2.187 -13.736 -4.178 1001 1HG GLU 122 HG2 GLU 122 -4.460 -12.986 -3.664 1002 2HG GLU 122 HG3 GLU 122 -3.520 -13.104 -2.175 1003 H GLN 123 H GLN 123 0.185 -14.339 -3.308 1004 HA GLN 123 HA GLN 123 -0.626 -15.654 -0.904 1005 1HB GLN 123 HB2 GLN 123 1.494 -16.034 -2.952 1006 2HB GLN 123 HB3 GLN 123 1.780 -16.790 -1.384 1007 1HG GLN 123 HG2 GLN 123 0.493 -18.480 -2.179 1008 2HG GLN 123 HG3 GLN 123 -0.863 -17.405 -1.841 1009 1HE2 GLN 123 HE21 GLN 123 1.360 -18.438 -4.449 1010 2HE2 GLN 123 HE22 GLN 123 0.342 -17.960 -5.721 1011 H LEU 124 H LEU 124 2.458 -13.985 -1.645 1012 HA LEU 124 HA LEU 124 3.681 -14.168 0.851 1013 1HB LEU 124 HB2 LEU 124 4.693 -13.099 -1.165 1014 2HB LEU 124 HB3 LEU 124 3.654 -11.698 -0.908 1015 HG LEU 124 HG LEU 124 4.643 -11.428 1.366 1016 1HD1 LEU 124 HD11 LEU 124 6.463 -13.657 0.404 1017 2HD1 LEU 124 HD12 LEU 124 6.732 -12.696 1.858 1018 3HD1 LEU 124 HD13 LEU 124 5.322 -13.749 1.745 1019 1HD2 LEU 124 HD21 LEU 124 5.725 -10.743 -1.105 1020 2HD2 LEU 124 HD22 LEU 124 6.215 -10.076 0.453 1021 3HD2 LEU 124 HD23 LEU 124 7.092 -11.442 -0.237 1022 H LEU 125 H LEU 125 1.614 -11.421 -0.180 1023 HA LEU 125 HA LEU 125 1.480 -10.167 2.352 1024 1HB LEU 125 HB2 LEU 125 -0.411 -10.224 0.000 1025 2HB LEU 125 HB3 LEU 125 -0.786 -9.303 1.458 1026 HG LEU 125 HG LEU 125 1.800 -9.008 -0.092 1027 1HD1 LEU 125 HD11 LEU 125 -0.862 -7.633 -0.329 1028 2HD1 LEU 125 HD12 LEU 125 0.618 -6.725 -0.641 1029 3HD1 LEU 125 HD13 LEU 125 0.239 -8.153 -1.605 1030 1HD2 LEU 125 HD21 LEU 125 0.470 -7.362 2.086 1031 2HD2 LEU 125 HD22 LEU 125 1.925 -8.343 2.266 1032 3HD2 LEU 125 HD23 LEU 125 1.951 -6.908 1.241 1033 H ARG 126 H ARG 126 -0.290 -12.923 1.072 1034 HA ARG 126 HA ARG 126 -2.419 -13.024 2.942 1035 1HB ARG 126 HB2 ARG 126 -1.594 -14.600 0.859 1036 2HB ARG 126 HB3 ARG 126 -1.219 -15.629 2.243 1037 1HG ARG 126 HG2 ARG 126 -3.398 -16.110 2.529 1038 2HG ARG 126 HG3 ARG 126 -3.795 -14.395 2.632 1039 1HD ARG 126 HD2 ARG 126 -3.442 -14.531 -0.010 1040 2HD ARG 126 HD3 ARG 126 -3.868 -16.220 0.268 1041 HE ARG 126 HE ARG 126 -5.645 -13.890 0.731 1042 1HH1 ARG 126 HH11 ARG 126 -5.704 -16.791 -0.716 1043 2HH1 ARG 126 HH12 ARG 126 -7.054 -17.453 0.145 1044 1HH2 ARG 126 HH21 ARG 126 -7.102 -14.942 2.534 1045 2HH2 ARG 126 HH22 ARG 126 -7.848 -16.405 1.982 1046 H LYS 127 H LYS 127 0.671 -14.842 3.111 1047 HA LYS 127 HA LYS 127 0.295 -15.730 5.788 1048 1HB LYS 127 HB2 LYS 127 2.820 -16.005 5.771 1049 2HB LYS 127 HB3 LYS 127 1.975 -16.800 4.443 1050 1HG LYS 127 HG2 LYS 127 2.521 -14.984 2.931 1051 2HG LYS 127 HG3 LYS 127 3.213 -14.041 4.250 1052 1HD LYS 127 HD2 LYS 127 5.191 -14.972 3.658 1053 2HD LYS 127 HD3 LYS 127 4.584 -16.435 4.434 1054 1HE LYS 127 HE2 LYS 127 3.445 -16.905 2.139 1055 2HE LYS 127 HE3 LYS 127 4.588 -15.720 1.507 1056 1HZ LYS 127 HZ1 LYS 127 5.377 -18.085 3.117 1057 2HZ LYS 127 HZ2 LYS 127 5.385 -18.050 1.419 1058 3HZ LYS 127 HZ3 LYS 127 6.406 -17.014 2.297 1059 H SER 128 H SER 128 1.639 -12.736 4.493 1060 HA SER 128 HA SER 128 2.742 -11.786 6.979 1061 1HB SER 128 HB2 SER 128 1.656 -9.916 4.895 1062 2HB SER 128 HB3 SER 128 3.121 -9.772 5.864 1063 HG SER 128 HG SER 128 3.736 -10.373 3.820 1064 H GLU 129 H GLU 129 -0.480 -11.854 5.641 1065 HA GLU 129 HA GLU 129 -1.569 -9.831 7.427 1066 1HB GLU 129 HB2 GLU 129 -2.472 -11.177 5.154 1067 2HB GLU 129 HB3 GLU 129 -3.496 -11.794 6.452 1068 1HG GLU 129 HG2 GLU 129 -3.023 -8.871 6.496 1069 2HG GLU 129 HG3 GLU 129 -3.980 -9.460 5.137 1070 H ALA 130 H ALA 130 -1.864 -13.403 7.294 1071 HA ALA 130 HA ALA 130 -3.258 -13.744 9.721 1072 1HB ALA 130 HB1 ALA 130 -1.789 -15.409 7.889 1073 2HB ALA 130 HB2 ALA 130 -1.384 -15.861 9.545 1074 3HB ALA 130 HB3 ALA 130 -3.066 -15.871 9.014 1075 H GLN 131 H GLN 131 0.161 -13.175 9.123 1076 HA GLN 131 HA GLN 131 1.074 -13.749 11.788 1077 1HB GLN 131 HB2 GLN 131 2.604 -13.569 9.848 1078 2HB GLN 131 HB3 GLN 131 2.233 -11.849 9.725 1079 1HG GLN 131 HG2 GLN 131 2.994 -11.690 12.182 1080 2HG GLN 131 HG3 GLN 131 3.694 -13.291 11.937 1081 1HE2 GLN 131 HE21 GLN 131 4.690 -13.117 9.332 1082 2HE2 GLN 131 HE22 GLN 131 5.876 -11.905 9.245 1083 H ALA 132 H ALA 132 0.131 -10.711 10.166 1084 HA ALA 132 HA ALA 132 0.548 -8.974 12.366 1085 1HB ALA 132 HB1 ALA 132 -1.416 -8.907 10.066 1086 2HB ALA 132 HB2 ALA 132 -1.340 -7.616 11.266 1087 3HB ALA 132 HB3 ALA 132 0.066 -7.969 10.260 1088 H LYS 133 H LYS 133 -2.128 -11.143 11.582 1089 HA LYS 133 HA LYS 133 -3.986 -10.195 13.531 1090 1HB LYS 133 HB2 LYS 133 -3.566 -12.739 12.021 1091 2HB LYS 133 HB3 LYS 133 -4.638 -12.784 13.421 1092 1HG LYS 133 HG2 LYS 133 -5.455 -10.481 12.166 1093 2HG LYS 133 HG3 LYS 133 -5.031 -11.505 10.795 1094 1HD LYS 133 HD2 LYS 133 -7.413 -11.766 11.513 1095 2HD LYS 133 HD3 LYS 133 -6.497 -13.272 11.597 1096 1HE LYS 133 HE2 LYS 133 -6.405 -13.245 13.926 1097 2HE LYS 133 HE3 LYS 133 -6.629 -11.498 14.014 1098 1HZ LYS 133 HZ1 LYS 133 -8.898 -12.291 12.823 1099 2HZ LYS 133 HZ2 LYS 133 -8.598 -13.603 13.855 1100 3HZ LYS 133 HZ3 LYS 133 -8.731 -12.034 14.494 1101 H LYS 134 H LYS 134 -1.643 -12.898 13.714 1102 HA LYS 134 HA LYS 134 -2.103 -13.474 16.474 1103 1HB LYS 134 HB2 LYS 134 0.155 -14.002 14.553 1104 2HB LYS 134 HB3 LYS 134 0.321 -14.416 16.258 1105 1HG LYS 134 HG2 LYS 134 -2.034 -15.547 15.906 1106 2HG LYS 134 HG3 LYS 134 -1.550 -15.552 14.209 1107 1HD LYS 134 HD2 LYS 134 0.719 -16.504 15.241 1108 2HD LYS 134 HD3 LYS 134 -0.373 -17.035 16.519 1109 1HE LYS 134 HE2 LYS 134 -1.809 -18.125 14.809 1110 2HE LYS 134 HE3 LYS 134 -0.659 -17.644 13.563 1111 1HZ LYS 134 HZ1 LYS 134 0.457 -19.036 15.854 1112 2HZ LYS 134 HZ2 LYS 134 -0.542 -19.967 14.842 1113 3HZ LYS 134 HZ3 LYS 134 0.823 -19.190 14.202 1114 H GLU 135 H GLU 135 -0.452 -10.892 14.912 1115 HA GLU 135 HA GLU 135 1.276 -10.269 17.203 1116 1HB GLU 135 HB2 GLU 135 0.690 -8.927 14.564 1117 2HB GLU 135 HB3 GLU 135 1.624 -8.110 15.818 1118 1HG GLU 135 HG2 GLU 135 2.973 -10.385 15.853 1119 2HG GLU 135 HG3 GLU 135 2.322 -10.548 14.222 1120 H LYS 136 H LYS 136 -1.853 -9.317 15.941 1121 HA LYS 136 HA LYS 136 -3.480 -7.861 16.801 1122 1HB LYS 136 HB2 LYS 136 -2.049 -8.913 19.225 1123 2HB LYS 136 HB3 LYS 136 -3.285 -7.668 19.416 1124 1HG LYS 136 HG2 LYS 136 -4.990 -9.044 18.597 1125 2HG LYS 136 HG3 LYS 136 -3.862 -10.098 17.742 1126 1HD LYS 136 HD2 LYS 136 -3.165 -10.188 20.498 1127 2HD LYS 136 HD3 LYS 136 -4.914 -10.396 20.394 1128 1HE LYS 136 HE2 LYS 136 -4.467 -12.113 18.558 1129 2HE LYS 136 HE3 LYS 136 -2.770 -12.039 19.034 1130 1HZ LYS 136 HZ1 LYS 136 -4.635 -12.364 21.218 1131 2HZ LYS 136 HZ2 LYS 136 -4.581 -13.675 20.137 1132 3HZ LYS 136 HZ3 LYS 136 -3.164 -13.160 20.915 1133 H LEU 137 H LEU 137 -1.865 -6.298 15.573 1134 HA LEU 137 HA LEU 137 -0.843 -4.272 17.523 1135 1HB LEU 137 HB2 LEU 137 0.049 -5.146 14.804 1136 2HB LEU 137 HB3 LEU 137 0.302 -3.463 15.265 1137 HG LEU 137 HG LEU 137 1.150 -5.765 17.029 1138 1HD1 LEU 137 HD11 LEU 137 2.224 -5.733 14.692 1139 2HD1 LEU 137 HD12 LEU 137 2.958 -4.204 15.177 1140 3HD1 LEU 137 HD13 LEU 137 3.326 -5.682 16.068 1141 1HD2 LEU 137 HD21 LEU 137 0.982 -2.969 17.377 1142 2HD2 LEU 137 HD22 LEU 137 1.798 -4.121 18.434 1143 3HD2 LEU 137 HD23 LEU 137 2.694 -3.319 17.145 1144 H ASN 138 H ASN 138 -1.642 -2.197 17.408 1145 HA ASN 138 HA ASN 138 -3.315 -0.598 16.963 1146 1HB ASN 138 HB2 ASN 138 -3.225 -0.470 14.156 1147 2HB ASN 138 HB3 ASN 138 -2.274 0.484 15.287 1148 1HD2 ASN 138 HD21 ASN 138 -0.028 0.144 15.279 1149 2HD2 ASN 138 HD22 ASN 138 0.745 -1.128 14.465 1150 H ILE 139 H ILE 139 -3.880 -2.134 13.840 1151 HA ILE 139 HA ILE 139 -6.707 -2.160 14.185 1152 HB ILE 139 HB ILE 139 -4.956 -3.783 12.317 1153 1HG1 ILE 139 HG12 ILE 139 -6.631 -1.393 11.583 1154 2HG1 ILE 139 HG13 ILE 139 -5.035 -1.158 12.296 1155 1HG2 ILE 139 HG21 ILE 139 -7.623 -4.221 12.920 1156 2HG2 ILE 139 HG22 ILE 139 -7.704 -3.179 11.500 1157 3HG2 ILE 139 HG23 ILE 139 -6.820 -4.704 11.426 1158 1HD1 ILE 139 HD11 ILE 139 -4.787 -3.172 10.295 1159 2HD1 ILE 139 HD12 ILE 139 -5.682 -1.826 9.588 1160 3HD1 ILE 139 HD13 ILE 139 -4.090 -1.552 10.295 1161 H TRP 140 H TRP 140 -4.513 -4.985 14.052 1162 HA TRP 140 HA TRP 140 -6.527 -6.750 15.165 1163 1HB TRP 140 HB2 TRP 140 -3.545 -7.248 15.029 1164 2HB TRP 140 HB3 TRP 140 -4.841 -8.445 15.035 1165 HD1 TRP 140 HD1 TRP 140 -2.820 -6.285 12.755 1166 HE1 TRP 140 HE1 TRP 140 -3.639 -6.560 10.326 1167 HE3 TRP 140 HE3 TRP 140 -7.145 -8.867 13.574 1168 HZ2 TRP 140 HZ2 TRP 140 -5.841 -7.724 8.917 1169 HZ3 TRP 140 HZ3 TRP 140 -8.584 -9.547 11.673 1170 HH2 TRP 140 HH2 TRP 140 -7.938 -8.978 9.348 1171 H SER 141 H SER 141 -4.804 -4.340 16.614 1172 HA SER 141 HA SER 141 -3.873 -5.615 19.021 1173 1HB SER 141 HB2 SER 141 -3.827 -3.022 17.946 1174 2HB SER 141 HB3 SER 141 -4.759 -2.878 19.434 1175 HG SER 141 HG SER 141 -3.058 -3.670 20.573 1176 H GLU 142 H GLU 142 -7.011 -4.601 17.911 1177 HA GLU 142 HA GLU 142 -8.233 -4.515 20.556 1178 1HB GLU 142 HB2 GLU 142 -9.574 -4.835 17.854 1179 2HB GLU 142 HB3 GLU 142 -10.338 -4.306 19.353 1180 1HG GLU 142 HG2 GLU 142 -8.772 -2.352 19.401 1181 2HG GLU 142 HG3 GLU 142 -8.163 -2.851 17.823 1182 H ASP 143 H ASP 143 -10.364 -6.050 20.670 1183 HA ASP 143 HA ASP 143 -9.498 -8.822 19.974 1184 1HB ASP 143 HB2 ASP 143 -9.256 -7.960 22.489 1185 2HB ASP 143 HB3 ASP 143 -10.975 -8.354 22.530 1186 H ASN 144 H ASN 144 -11.238 -7.570 18.324 1187 HA ASN 144 HA ASN 144 -13.873 -8.762 19.091 1188 1HB ASN 144 HB2 ASN 144 -13.529 -6.295 17.369 1189 2HB ASN 144 HB3 ASN 144 -15.027 -6.935 18.048 1190 1HD2 ASN 144 HD21 ASN 144 -11.812 -5.714 19.153 1191 2HD2 ASN 144 HD22 ASN 144 -12.413 -4.984 20.563 1192 H ALA 145 H ALA 145 -15.110 -9.593 17.257 1193 HA ALA 145 HA ALA 145 -13.694 -9.765 14.668 1194 1HB ALA 145 HB1 ALA 145 -12.953 -11.691 16.212 1195 2HB ALA 145 HB2 ALA 145 -14.595 -12.309 16.023 1196 3HB ALA 145 HB3 ALA 145 -13.552 -12.132 14.612 1197 H ASP 146 H ASP 146 -16.335 -11.651 16.176 1198 HA ASP 146 HA ASP 146 -18.320 -10.236 14.521 1199 1HB ASP 146 HB2 ASP 146 -17.121 -12.363 13.341 1200 2HB ASP 146 HB3 ASP 146 -18.423 -13.185 14.203 1201 H SER 147 H SER 147 -17.682 -10.935 17.427 1202 HA SER 147 HA SER 147 -19.471 -12.813 18.497 1203 1HB SER 147 HB2 SER 147 -18.420 -10.188 19.527 1204 2HB SER 147 HB3 SER 147 -19.604 -11.096 20.463 1205 HG SER 147 HG SER 147 -18.098 -12.467 20.968 1206 H GLY 148 H GLY 148 -21.567 -12.960 17.791 1207 1HA GLY 148 HA2 GLY 148 -23.308 -10.600 18.230 1208 2HA GLY 148 HA3 GLY 148 -23.308 -11.316 16.618 1209 H GLN 149 H GLN 149 -24.226 -13.406 16.333 1210 HA GLN 149 HA GLN 149 -25.890 -14.314 18.648 1211 1HB GLN 149 HB2 GLN 149 -26.383 -14.208 15.691 1212 2HB GLN 149 HB3 GLN 149 -27.175 -15.465 16.642 1213 1HG GLN 149 HG2 GLN 149 -27.707 -13.382 18.237 1214 2HG GLN 149 HG3 GLN 149 -27.565 -12.508 16.711 1215 1HE2 GLN 149 HE21 GLN 149 -29.232 -12.804 15.132 1216 2HE2 GLN 149 HE22 GLN 149 -30.611 -13.752 15.415 1217 HN3 PTP 150 H3 PTP 150 -10.057 -3.433 -8.941 1218 1H5M PTP 150 H51 PTP 150 -6.415 -1.844 -6.521 1219 2H5M PTP 150 H52 PTP 150 -7.315 -1.779 -4.986 1220 3H5M PTP 150 H53 PTP 150 -6.991 -0.281 -5.892 1221 H6 PTP 150 H6 PTP 150 -9.394 0.183 -5.845 1222 H1* PTP 150 H1' PTP 150 -12.395 0.277 -7.907 1223 2H2* PTP 150 H2' PTP 150 -12.258 -0.975 -5.187 1224 H3* PTP 150 H3' PTP 150 -12.941 0.988 -4.047 1225 H4* PTP 150 H4' PTP 150 -11.903 3.006 -5.569 1226 2H5* PTP 150 H5' PTP 150 -10.553 0.746 -3.996 Start of MODEL 20 1 1H ALA 1 H1 ALA 1 8.265 -23.473 -9.707 2 2H ALA 1 H2 ALA 1 9.049 -24.370 -8.496 3 3H ALA 1 H3 ALA 1 8.936 -22.683 -8.361 4 HA ALA 1 HA ALA 1 11.158 -23.344 -9.047 5 1HB ALA 1 HB1 ALA 1 9.568 -25.024 -10.822 6 2HB ALA 1 HB2 ALA 1 10.782 -24.103 -11.708 7 3HB ALA 1 HB3 ALA 1 11.269 -25.162 -10.383 8 H THR 2 H THR 2 11.744 -21.238 -9.331 9 HA THR 2 HA THR 2 10.682 -19.833 -11.744 10 HB THR 2 HB THR 2 9.563 -18.984 -9.680 11 HG1 THR 2 HG1 THR 2 9.890 -16.886 -10.215 12 1HG2 THR 2 HG21 THR 2 12.064 -19.351 -8.541 13 2HG2 THR 2 HG22 THR 2 11.940 -17.597 -8.689 14 3HG2 THR 2 HG23 THR 2 10.713 -18.496 -7.798 15 H SER 3 H SER 3 12.182 -18.319 -12.682 16 HA SER 3 HA SER 3 14.750 -17.722 -11.581 17 1HB SER 3 HB2 SER 3 14.495 -20.333 -12.806 18 2HB SER 3 HB3 SER 3 15.635 -19.341 -13.709 19 HG SER 3 HG SER 3 15.785 -20.369 -11.151 20 H THR 4 H THR 4 13.439 -15.839 -12.608 21 HA THR 4 HA THR 4 14.792 -14.937 -14.940 22 HB THR 4 HB THR 4 13.330 -16.730 -15.979 23 HG1 THR 4 HG1 THR 4 14.072 -14.677 -16.988 24 1HG2 THR 4 HG21 THR 4 11.399 -15.811 -14.321 25 2HG2 THR 4 HG22 THR 4 10.994 -14.913 -15.783 26 3HG2 THR 4 HG23 THR 4 11.051 -16.675 -15.819 27 H LYS 5 H LYS 5 13.876 -12.816 -15.691 28 HA LYS 5 HA LYS 5 12.443 -11.511 -13.430 29 1HB LYS 5 HB2 LYS 5 13.234 -9.384 -14.580 30 2HB LYS 5 HB3 LYS 5 14.515 -10.417 -13.941 31 1HG LYS 5 HG2 LYS 5 15.174 -11.139 -16.056 32 2HG LYS 5 HG3 LYS 5 13.600 -10.802 -16.775 33 1HD LYS 5 HD2 LYS 5 14.513 -8.321 -15.822 34 2HD LYS 5 HD3 LYS 5 15.922 -9.074 -16.570 35 1HE LYS 5 HE2 LYS 5 15.092 -8.683 -18.623 36 2HE LYS 5 HE3 LYS 5 13.601 -9.532 -18.217 37 1HZ LYS 5 HZ1 LYS 5 13.738 -6.982 -16.956 38 2HZ LYS 5 HZ2 LYS 5 13.883 -6.840 -18.641 39 3HZ LYS 5 HZ3 LYS 5 12.532 -7.621 -17.969 40 H LYS 6 H LYS 6 10.280 -12.044 -13.976 41 HA LYS 6 HA LYS 6 9.244 -11.556 -16.659 42 1HB LYS 6 HB2 LYS 6 8.359 -12.943 -14.384 43 2HB LYS 6 HB3 LYS 6 7.215 -11.615 -14.577 44 1HG LYS 6 HG2 LYS 6 6.334 -12.500 -16.467 45 2HG LYS 6 HG3 LYS 6 7.924 -12.911 -17.113 46 1HD LYS 6 HD2 LYS 6 7.890 -15.021 -16.229 47 2HD LYS 6 HD3 LYS 6 7.009 -14.513 -14.787 48 1HE LYS 6 HE2 LYS 6 4.959 -14.243 -16.233 49 2HE LYS 6 HE3 LYS 6 5.866 -14.979 -17.554 50 1HZ LYS 6 HZ1 LYS 6 6.240 -16.623 -15.377 51 2HZ LYS 6 HZ2 LYS 6 4.589 -16.224 -15.350 52 3HZ LYS 6 HZ3 LYS 6 5.273 -16.934 -16.735 53 H LEU 7 H LEU 7 7.985 -10.164 -13.624 54 HA LEU 7 HA LEU 7 6.999 -7.800 -14.852 55 1HB LEU 7 HB2 LEU 7 7.946 -8.128 -11.985 56 2HB LEU 7 HB3 LEU 7 6.834 -6.894 -12.583 57 HG LEU 7 HG LEU 7 6.321 -9.879 -12.722 58 1HD1 LEU 7 HD11 LEU 7 6.134 -8.096 -10.513 59 2HD1 LEU 7 HD12 LEU 7 4.489 -8.431 -11.052 60 3HD1 LEU 7 HD13 LEU 7 5.559 -9.761 -10.609 61 1HD2 LEU 7 HD21 LEU 7 4.894 -7.422 -13.648 62 2HD2 LEU 7 HD22 LEU 7 4.971 -9.020 -14.389 63 3HD2 LEU 7 HD23 LEU 7 3.915 -8.739 -13.004 64 H HIS 8 H HIS 8 7.973 -5.543 -13.872 65 HA HIS 8 HA HIS 8 10.931 -5.593 -14.084 66 1HB HIS 8 HB2 HIS 8 9.865 -5.240 -16.388 67 2HB HIS 8 HB3 HIS 8 9.304 -3.687 -15.772 68 HD1 HIS 8 HD1 HIS 8 10.899 -2.356 -17.351 69 HD2 HIS 8 HD2 HIS 8 12.876 -4.928 -14.732 70 HE1 HIS 8 HE1 HIS 8 13.350 -1.725 -17.440 71 H LYS 9 H LYS 9 11.409 -4.651 -12.147 72 HA LYS 9 HA LYS 9 9.720 -2.582 -10.976 73 1HB LYS 9 HB2 LYS 9 12.521 -3.429 -10.180 74 2HB LYS 9 HB3 LYS 9 11.369 -2.538 -9.186 75 1HG LYS 9 HG2 LYS 9 9.924 -4.410 -8.985 76 2HG LYS 9 HG3 LYS 9 10.716 -5.263 -10.311 77 1HD LYS 9 HD2 LYS 9 11.463 -6.256 -8.232 78 2HD LYS 9 HD3 LYS 9 12.809 -5.344 -8.919 79 1HE LYS 9 HE2 LYS 9 12.370 -3.474 -7.430 80 2HE LYS 9 HE3 LYS 9 10.914 -4.258 -6.816 81 1HZ LYS 9 HZ1 LYS 9 12.555 -6.166 -6.262 82 2HZ LYS 9 HZ2 LYS 9 13.733 -4.943 -6.342 83 3HZ LYS 9 HZ3 LYS 9 12.457 -4.818 -5.233 84 H GLU 10 H GLU 10 9.917 -0.411 -11.302 85 HA GLU 10 HA GLU 10 12.402 0.548 -12.669 86 1HB GLU 10 HB2 GLU 10 9.598 0.857 -13.355 87 2HB GLU 10 HB3 GLU 10 10.367 2.428 -13.131 88 1HG GLU 10 HG2 GLU 10 10.921 2.055 -15.342 89 2HG GLU 10 HG3 GLU 10 12.299 1.272 -14.566 90 HA PRO 11 HA PRO 11 12.904 3.567 -9.502 91 1HB PRO 11 HB2 PRO 11 13.652 5.779 -10.921 92 2HB PRO 11 HB3 PRO 11 14.694 4.359 -10.727 93 1HG PRO 11 HG2 PRO 11 13.100 5.221 -13.100 94 2HG PRO 11 HG3 PRO 11 14.646 4.359 -13.034 95 1HD PRO 11 HD2 PRO 11 12.162 3.166 -13.522 96 2HD PRO 11 HD3 PRO 11 13.624 2.306 -12.992 97 H ALA 12 H ALA 12 12.175 5.825 -8.762 98 HA ALA 12 HA ALA 12 9.834 6.964 -10.105 99 1HB ALA 12 HB1 ALA 12 9.598 5.226 -7.681 100 2HB ALA 12 HB2 ALA 12 8.563 6.650 -7.787 101 3HB ALA 12 HB3 ALA 12 8.489 5.410 -9.039 102 H THR 13 H THR 13 8.899 8.773 -8.568 103 HA THR 13 HA THR 13 11.102 9.916 -6.910 104 HB THR 13 HB THR 13 9.457 11.543 -8.864 105 HG1 THR 13 HG1 THR 13 10.967 9.959 -9.790 106 1HG2 THR 13 HG21 THR 13 11.482 12.101 -6.795 107 2HG2 THR 13 HG22 THR 13 11.783 12.889 -8.344 108 3HG2 THR 13 HG23 THR 13 10.261 13.166 -7.495 109 H LEU 14 H LEU 14 10.325 10.460 -4.934 110 HA LEU 14 HA LEU 14 7.485 10.350 -4.361 111 1HB LEU 14 HB2 LEU 14 9.201 9.711 -2.691 112 2HB LEU 14 HB3 LEU 14 9.770 11.380 -2.650 113 HG LEU 14 HG LEU 14 7.579 12.138 -1.860 114 1HD1 LEU 14 HD11 LEU 14 6.827 9.456 -2.738 115 2HD1 LEU 14 HD12 LEU 14 6.251 9.803 -1.108 116 3HD1 LEU 14 HD13 LEU 14 5.806 10.864 -2.444 117 1HD2 LEU 14 HD21 LEU 14 9.410 11.055 -0.319 118 2HD2 LEU 14 HD22 LEU 14 7.814 11.393 0.349 119 3HD2 LEU 14 HD23 LEU 14 8.234 9.753 -0.145 120 H ILE 15 H ILE 15 6.087 11.981 -4.784 121 HA ILE 15 HA ILE 15 7.162 14.741 -5.069 122 HB ILE 15 HB ILE 15 4.454 13.594 -5.819 123 1HG1 ILE 15 HG12 ILE 15 6.889 14.308 -7.489 124 2HG1 ILE 15 HG13 ILE 15 6.274 12.680 -7.192 125 1HG2 ILE 15 HG21 ILE 15 5.639 16.326 -5.846 126 2HG2 ILE 15 HG22 ILE 15 4.705 15.855 -7.266 127 3HG2 ILE 15 HG23 ILE 15 3.955 15.830 -5.671 128 1HD1 ILE 15 HD11 ILE 15 4.591 14.843 -8.470 129 2HD1 ILE 15 HD12 ILE 15 5.586 13.734 -9.413 130 3HD1 ILE 15 HD13 ILE 15 4.268 13.110 -8.419 131 H LYS 16 H LYS 16 4.277 13.151 -3.650 132 HA LYS 16 HA LYS 16 4.608 14.607 -1.153 133 1HB LYS 16 HB2 LYS 16 3.558 16.252 -2.883 134 2HB LYS 16 HB3 LYS 16 2.096 15.287 -2.670 135 1HG LYS 16 HG2 LYS 16 2.725 15.629 -0.087 136 2HG LYS 16 HG3 LYS 16 3.480 17.085 -0.736 137 1HD LYS 16 HD2 LYS 16 1.482 18.078 -1.051 138 2HD LYS 16 HD3 LYS 16 0.845 16.662 -1.890 139 1HE LYS 16 HE2 LYS 16 0.262 15.599 0.196 140 2HE LYS 16 HE3 LYS 16 1.097 16.847 1.122 141 1HZ LYS 16 HZ1 LYS 16 -0.905 17.836 -0.711 142 2HZ LYS 16 HZ2 LYS 16 -1.522 16.878 0.549 143 3HZ LYS 16 HZ3 LYS 16 -0.606 18.259 0.907 144 H ALA 17 H ALA 17 4.111 12.940 0.191 145 HA ALA 17 HA ALA 17 2.226 10.858 -0.577 146 1HB ALA 17 HB1 ALA 17 4.291 10.603 0.941 147 2HB ALA 17 HB2 ALA 17 3.300 11.328 2.207 148 3HB ALA 17 HB3 ALA 17 2.809 9.803 1.469 149 H ILE 18 H ILE 18 0.204 10.425 0.476 150 HA ILE 18 HA ILE 18 -0.960 12.777 1.914 151 HB ILE 18 HB ILE 18 -2.510 10.937 0.078 152 1HG1 ILE 18 HG12 ILE 18 -1.401 13.679 -0.596 153 2HG1 ILE 18 HG13 ILE 18 -0.661 12.169 -1.129 154 1HG2 ILE 18 HG21 ILE 18 -3.053 13.356 1.710 155 2HG2 ILE 18 HG22 ILE 18 -3.786 13.330 0.105 156 3HG2 ILE 18 HG23 ILE 18 -4.133 12.038 1.255 157 1HD1 ILE 18 HD11 ILE 18 -3.444 12.010 -1.718 158 2HD1 ILE 18 HD12 ILE 18 -2.867 13.571 -2.300 159 3HD1 ILE 18 HD13 ILE 18 -2.099 12.083 -2.855 160 H ASP 19 H ASP 19 -2.012 9.440 1.155 161 HA ASP 19 HA ASP 19 -2.599 9.104 4.064 162 1HB ASP 19 HB2 ASP 19 -3.658 7.344 1.853 163 2HB ASP 19 HB3 ASP 19 -4.316 7.587 3.472 164 H GLY 20 H GLY 20 -2.411 6.671 4.724 165 1HA GLY 20 HA2 GLY 20 0.320 5.882 4.440 166 2HA GLY 20 HA3 GLY 20 -0.958 4.870 5.112 167 H ASP 21 H ASP 21 -2.558 5.099 2.594 168 HA ASP 21 HA ASP 21 -0.886 3.276 0.906 169 1HB ASP 21 HB2 ASP 21 -3.833 3.206 1.579 170 2HB ASP 21 HB3 ASP 21 -3.169 2.331 0.199 171 H THR 22 H THR 22 -1.177 6.218 0.720 172 HA THR 22 HA THR 22 -1.941 6.313 -2.132 173 HB THR 22 HB THR 22 -3.045 8.501 -0.418 174 HG1 THR 22 HG1 THR 22 -4.859 6.546 -0.844 175 1HG2 THR 22 HG21 THR 22 -3.098 8.510 -2.927 176 2HG2 THR 22 HG22 THR 22 -4.120 7.074 -2.866 177 3HG2 THR 22 HG23 THR 22 -4.699 8.597 -2.190 178 H VAL 23 H VAL 23 -0.088 7.158 -2.986 179 HA VAL 23 HA VAL 23 0.958 9.672 -1.803 180 HB VAL 23 HB VAL 23 3.274 8.834 -1.885 181 1HG1 VAL 23 HG11 VAL 23 1.468 8.367 0.064 182 2HG1 VAL 23 HG12 VAL 23 1.904 6.702 -0.326 183 3HG1 VAL 23 HG13 VAL 23 3.148 7.844 0.181 184 1HG2 VAL 23 HG21 VAL 23 1.880 6.317 -2.819 185 2HG2 VAL 23 HG22 VAL 23 3.200 7.185 -3.604 186 3HG2 VAL 23 HG23 VAL 23 3.498 6.281 -2.119 187 H LYS 24 H LYS 24 1.482 11.111 -3.392 188 HA LYS 24 HA LYS 24 1.249 10.229 -6.195 189 1HB LYS 24 HB2 LYS 24 1.996 13.025 -5.398 190 2HB LYS 24 HB3 LYS 24 0.980 12.481 -6.732 191 1HG LYS 24 HG2 LYS 24 -0.699 11.700 -4.998 192 2HG LYS 24 HG3 LYS 24 0.273 12.539 -3.789 193 1HD LYS 24 HD2 LYS 24 -0.090 14.350 -5.943 194 2HD LYS 24 HD3 LYS 24 -1.669 13.640 -5.602 195 1HE LYS 24 HE2 LYS 24 -1.239 14.133 -3.148 196 2HE LYS 24 HE3 LYS 24 0.161 15.074 -3.665 197 1HZ LYS 24 HZ1 LYS 24 -2.094 15.773 -5.210 198 2HZ LYS 24 HZ2 LYS 24 -2.481 15.898 -3.560 199 3HZ LYS 24 HZ3 LYS 24 -1.157 16.754 -4.193 200 H LEU 25 H LEU 25 3.034 9.573 -7.301 201 HA LEU 25 HA LEU 25 5.669 10.746 -6.500 202 1HB LEU 25 HB2 LEU 25 5.561 8.029 -7.739 203 2HB LEU 25 HB3 LEU 25 6.697 8.681 -6.558 204 HG LEU 25 HG LEU 25 3.799 8.051 -5.935 205 1HD1 LEU 25 HD11 LEU 25 5.208 6.036 -6.540 206 2HD1 LEU 25 HD12 LEU 25 6.257 6.447 -5.184 207 3HD1 LEU 25 HD13 LEU 25 4.571 6.019 -4.896 208 1HD2 LEU 25 HD21 LEU 25 5.495 9.716 -4.616 209 2HD2 LEU 25 HD22 LEU 25 4.248 8.768 -3.807 210 3HD2 LEU 25 HD23 LEU 25 5.910 8.183 -3.852 211 H MET 26 H MET 26 7.193 9.668 -8.553 212 HA MET 26 HA MET 26 5.876 10.721 -11.021 213 1HB MET 26 HB2 MET 26 7.785 12.117 -9.741 214 2HB MET 26 HB3 MET 26 8.820 11.052 -10.692 215 1HG MET 26 HG2 MET 26 7.900 11.813 -12.746 216 2HG MET 26 HG3 MET 26 6.528 12.572 -11.940 217 1HE MET 26 HE1 MET 26 6.247 14.678 -11.726 218 2HE MET 26 HE2 MET 26 6.978 14.790 -10.127 219 3HE MET 26 HE3 MET 26 7.381 15.980 -11.373 220 H TYR 27 H TYR 27 6.056 9.356 -12.751 221 HA TYR 27 HA TYR 27 8.070 7.153 -12.562 222 1HB TYR 27 HB2 TYR 27 5.794 6.292 -12.159 223 2HB TYR 27 HB3 TYR 27 5.252 7.003 -13.679 224 HD1 TYR 27 HD1 TYR 27 7.776 4.621 -12.276 225 HD2 TYR 27 HD2 TYR 27 5.439 5.793 -15.684 226 HE1 TYR 27 HE1 TYR 27 8.540 2.601 -13.494 227 HE2 TYR 27 HE2 TYR 27 6.203 3.773 -16.902 228 HH TYR 27 HH TYR 27 8.787 2.023 -16.116 229 H LYS 28 H LYS 28 9.557 7.488 -14.142 230 HA LYS 28 HA LYS 28 10.477 8.045 -16.225 231 1HB LYS 28 HB2 LYS 28 7.679 7.176 -16.931 232 2HB LYS 28 HB3 LYS 28 8.773 7.777 -18.177 233 1HG LYS 28 HG2 LYS 28 10.480 6.089 -17.299 234 2HG LYS 28 HG3 LYS 28 9.156 5.380 -16.374 235 1HD LYS 28 HD2 LYS 28 7.870 5.097 -18.487 236 2HD LYS 28 HD3 LYS 28 9.255 5.718 -19.385 237 1HE LYS 28 HE2 LYS 28 10.328 3.728 -17.735 238 2HE LYS 28 HE3 LYS 28 8.807 3.050 -18.313 239 1HZ LYS 28 HZ1 LYS 28 10.355 4.428 -20.324 240 2HZ LYS 28 HZ2 LYS 28 11.103 3.040 -19.702 241 3HZ LYS 28 HZ3 LYS 28 9.559 2.929 -20.401 242 H GLY 29 H GLY 29 8.803 10.040 -14.518 243 1HA GLY 29 HA2 GLY 29 8.869 12.437 -14.799 244 2HA GLY 29 HA3 GLY 29 8.910 12.204 -16.546 245 H GLN 30 H GLN 30 6.649 10.491 -14.475 246 HA GLN 30 HA GLN 30 4.456 12.217 -15.550 247 1HB GLN 30 HB2 GLN 30 4.657 9.955 -16.680 248 2HB GLN 30 HB3 GLN 30 4.258 9.228 -15.122 249 1HG GLN 30 HG2 GLN 30 2.069 9.832 -15.258 250 2HG GLN 30 HG3 GLN 30 2.447 11.404 -15.961 251 1HE2 GLN 30 HE21 GLN 30 0.332 9.896 -17.067 252 2HE2 GLN 30 HE22 GLN 30 0.790 9.329 -18.600 253 HA PRO 31 HA PRO 31 3.857 12.371 -11.065 254 1HB PRO 31 HB2 PRO 31 2.177 14.529 -11.162 255 2HB PRO 31 HB3 PRO 31 3.942 14.673 -11.251 256 1HG PRO 31 HG2 PRO 31 1.921 14.830 -13.457 257 2HG PRO 31 HG3 PRO 31 3.430 15.734 -13.249 258 1HD PRO 31 HD2 PRO 31 3.157 13.566 -14.946 259 2HD PRO 31 HD3 PRO 31 4.703 14.086 -14.238 260 H MET 32 H MET 32 2.528 10.647 -10.510 261 HA MET 32 HA MET 32 -0.382 10.979 -11.039 262 1HB MET 32 HB2 MET 32 1.365 8.915 -12.158 263 2HB MET 32 HB3 MET 32 0.010 8.236 -11.253 264 1HG MET 32 HG2 MET 32 -1.576 9.548 -12.563 265 2HG MET 32 HG3 MET 32 -0.254 10.348 -13.413 266 1HE MET 32 HE1 MET 32 -1.729 6.933 -12.413 267 2HE MET 32 HE2 MET 32 -0.943 5.802 -13.522 268 3HE MET 32 HE3 MET 32 0.004 6.641 -12.298 269 H THR 33 H THR 33 -1.707 9.968 -9.450 270 HA THR 33 HA THR 33 -0.398 9.586 -6.860 271 HB THR 33 HB THR 33 -2.632 9.425 -5.966 272 HG1 THR 33 HG1 THR 33 -3.541 9.253 -8.644 273 1HG2 THR 33 HG21 THR 33 -1.771 11.643 -7.032 274 2HG2 THR 33 HG22 THR 33 -2.985 11.326 -8.271 275 3HG2 THR 33 HG23 THR 33 -3.474 11.523 -6.588 276 H PHE 34 H PHE 34 -0.317 7.591 -5.706 277 HA PHE 34 HA PHE 34 -0.986 5.180 -7.344 278 1HB PHE 34 HB2 PHE 34 1.520 5.894 -5.865 279 2HB PHE 34 HB3 PHE 34 1.048 4.198 -5.971 280 HD1 PHE 34 HD1 PHE 34 0.608 3.187 -8.260 281 HD2 PHE 34 HD2 PHE 34 2.471 7.020 -7.727 282 HE1 PHE 34 HE1 PHE 34 1.475 3.087 -10.580 283 HE2 PHE 34 HE2 PHE 34 3.338 6.922 -10.049 284 HZ PHE 34 HZ PHE 34 2.840 4.955 -11.475 285 H ARG 35 H ARG 35 -1.558 3.285 -6.108 286 HA ARG 35 HA ARG 35 -2.195 3.801 -3.237 287 1HB ARG 35 HB2 ARG 35 -4.215 4.074 -4.778 288 2HB ARG 35 HB3 ARG 35 -4.068 2.350 -5.119 289 1HG ARG 35 HG2 ARG 35 -5.378 2.060 -3.292 290 2HG ARG 35 HG3 ARG 35 -3.920 2.420 -2.366 291 1HD ARG 35 HD2 ARG 35 -4.790 4.361 -1.631 292 2HD ARG 35 HD3 ARG 35 -5.167 4.869 -3.277 293 HE ARG 35 HE ARG 35 -7.227 3.241 -2.904 294 1HH1 ARG 35 HH11 ARG 35 -6.424 3.183 0.069 295 2HH1 ARG 35 HH12 ARG 35 -7.514 4.363 0.716 296 1HH2 ARG 35 HH21 ARG 35 -8.328 5.695 -2.381 297 2HH2 ARG 35 HH22 ARG 35 -8.594 5.785 -0.671 298 H LEU 36 H LEU 36 -1.263 2.222 -2.029 299 HA LEU 36 HA LEU 36 0.184 0.047 -2.970 300 1HB LEU 36 HB2 LEU 36 -1.380 0.319 -0.392 301 2HB LEU 36 HB3 LEU 36 -0.261 -1.009 -0.710 302 HG LEU 36 HG LEU 36 0.384 1.947 -0.589 303 1HD1 LEU 36 HD11 LEU 36 0.340 -0.045 1.367 304 2HD1 LEU 36 HD12 LEU 36 2.039 0.066 0.905 305 3HD1 LEU 36 HD13 LEU 36 1.184 1.500 1.475 306 1HD2 LEU 36 HD21 LEU 36 1.963 -0.405 -1.637 307 2HD2 LEU 36 HD22 LEU 36 1.690 1.159 -2.404 308 3HD2 LEU 36 HD23 LEU 36 2.767 1.035 -1.013 309 H LEU 37 H LEU 37 -0.293 -1.988 -3.711 310 HA LEU 37 HA LEU 37 -3.137 -2.575 -4.254 311 1HB LEU 37 HB2 LEU 37 -0.522 -3.415 -5.353 312 2HB LEU 37 HB3 LEU 37 -1.767 -4.665 -5.328 313 HG LEU 37 HG LEU 37 -2.266 -1.889 -6.420 314 1HD1 LEU 37 HD11 LEU 37 -0.442 -3.035 -7.681 315 2HD1 LEU 37 HD12 LEU 37 -1.526 -4.399 -7.956 316 3HD1 LEU 37 HD13 LEU 37 -1.900 -2.821 -8.649 317 1HD2 LEU 37 HD21 LEU 37 -3.970 -3.983 -5.741 318 2HD2 LEU 37 HD22 LEU 37 -4.360 -2.651 -6.829 319 3HD2 LEU 37 HD23 LEU 37 -3.757 -4.175 -7.481 320 H LEU 38 H LEU 38 -3.975 -4.775 -3.840 321 HA LEU 38 HA LEU 38 -4.469 -6.525 -2.366 322 1HB LEU 38 HB2 LEU 38 -1.455 -6.472 -2.032 323 2HB LEU 38 HB3 LEU 38 -2.512 -7.784 -1.508 324 HG LEU 38 HG LEU 38 -2.434 -6.803 -4.368 325 1HD1 LEU 38 HD11 LEU 38 -0.203 -7.718 -3.446 326 2HD1 LEU 38 HD12 LEU 38 -1.032 -9.270 -3.335 327 3HD1 LEU 38 HD13 LEU 38 -0.846 -8.480 -4.900 328 1HD2 LEU 38 HD21 LEU 38 -4.144 -8.527 -2.947 329 2HD2 LEU 38 HD22 LEU 38 -4.043 -8.352 -4.699 330 3HD2 LEU 38 HD23 LEU 38 -3.090 -9.589 -3.881 331 H VAL 39 H VAL 39 -3.933 -3.601 -1.321 332 HA VAL 39 HA VAL 39 -4.135 -4.418 1.534 333 HB VAL 39 HB VAL 39 -2.608 -2.678 2.248 334 1HG1 VAL 39 HG11 VAL 39 -1.547 -4.417 0.008 335 2HG1 VAL 39 HG12 VAL 39 -0.502 -3.465 1.062 336 3HG1 VAL 39 HG13 VAL 39 -1.503 -4.748 1.740 337 1HG2 VAL 39 HG21 VAL 39 -3.276 -1.186 0.236 338 2HG2 VAL 39 HG22 VAL 39 -1.602 -1.113 0.785 339 3HG2 VAL 39 HG23 VAL 39 -2.020 -2.052 -0.648 340 H ASP 40 H ASP 40 -4.910 -2.478 2.883 341 HA ASP 40 HA ASP 40 -6.474 -0.495 1.351 342 1HB ASP 40 HB2 ASP 40 -7.912 -2.567 1.644 343 2HB ASP 40 HB3 ASP 40 -7.825 -2.288 3.384 344 H THR 41 H THR 41 -6.059 1.406 2.364 345 HA THR 41 HA THR 41 -5.125 1.393 5.160 346 HB THR 41 HB THR 41 -4.012 2.811 3.434 347 HG1 THR 41 HG1 THR 41 -4.127 4.747 4.713 348 1HG2 THR 41 HG21 THR 41 -6.693 4.223 3.431 349 2HG2 THR 41 HG22 THR 41 -5.228 4.855 2.679 350 3HG2 THR 41 HG23 THR 41 -5.957 3.366 2.077 351 HA PRO 42 HA PRO 42 -9.047 2.468 6.877 352 1HB PRO 42 HB2 PRO 42 -8.145 3.546 9.223 353 2HB PRO 42 HB3 PRO 42 -8.131 1.805 8.892 354 1HG PRO 42 HG2 PRO 42 -5.866 3.759 8.828 355 2HG PRO 42 HG3 PRO 42 -5.868 2.056 9.316 356 1HD PRO 42 HD2 PRO 42 -4.963 2.981 6.857 357 2HD PRO 42 HD3 PRO 42 -5.504 1.316 7.166 358 H GLU 43 H GLU 43 -10.341 4.239 6.530 359 HA GLU 43 HA GLU 43 -9.521 6.644 5.405 360 1HB GLU 43 HB2 GLU 43 -11.943 5.592 6.386 361 2HB GLU 43 HB3 GLU 43 -11.741 7.148 7.193 362 1HG GLU 43 HG2 GLU 43 -11.846 8.343 5.226 363 2HG GLU 43 HG3 GLU 43 -11.150 7.032 4.271 364 H THR 44 H THR 44 -9.010 8.717 6.221 365 HA THR 44 HA THR 44 -8.493 8.881 9.156 366 HB THR 44 HB THR 44 -6.335 9.918 8.757 367 HG1 THR 44 HG1 THR 44 -6.103 10.895 6.932 368 1HG2 THR 44 HG21 THR 44 -6.903 7.314 7.383 369 2HG2 THR 44 HG22 THR 44 -5.283 8.003 7.292 370 3HG2 THR 44 HG23 THR 44 -5.990 7.618 8.860 371 H LYS 45 H LYS 45 -10.339 10.043 6.831 372 HA LYS 45 HA LYS 45 -10.081 12.885 7.738 373 1HB LYS 45 HB2 LYS 45 -10.397 11.703 5.078 374 2HB LYS 45 HB3 LYS 45 -11.616 12.929 5.424 375 1HG LYS 45 HG2 LYS 45 -10.093 14.624 5.457 376 2HG LYS 45 HG3 LYS 45 -8.862 13.634 6.242 377 1HD LYS 45 HD2 LYS 45 -7.845 13.520 4.229 378 2HD LYS 45 HD3 LYS 45 -9.162 12.454 3.736 379 1HE LYS 45 HE2 LYS 45 -10.336 14.906 3.447 380 2HE LYS 45 HE3 LYS 45 -8.663 15.279 3.033 381 1HZ LYS 45 HZ1 LYS 45 -9.613 12.825 1.877 382 2HZ LYS 45 HZ2 LYS 45 -10.483 14.189 1.357 383 3HZ LYS 45 HZ3 LYS 45 -8.802 14.127 1.146 384 H HIS 46 H HIS 46 -11.466 11.627 9.519 385 HA HIS 46 HA HIS 46 -14.299 11.372 8.721 386 1HB HIS 46 HB2 HIS 46 -12.649 10.580 11.064 387 2HB HIS 46 HB3 HIS 46 -14.336 10.975 11.395 388 HD1 HIS 46 HD1 HIS 46 -12.420 8.128 10.712 389 HD2 HIS 46 HD2 HIS 46 -15.981 9.572 9.094 390 HE1 HIS 46 HE1 HIS 46 -13.567 6.149 9.627 391 HA PRO 47 HA PRO 47 -15.282 15.453 10.135 392 1HB PRO 47 HB2 PRO 47 -17.996 15.168 10.073 393 2HB PRO 47 HB3 PRO 47 -17.009 15.307 8.608 394 1HG PRO 47 HG2 PRO 47 -18.343 12.912 9.754 395 2HG PRO 47 HG3 PRO 47 -17.920 13.267 8.073 396 1HD PRO 47 HD2 PRO 47 -16.494 11.569 9.845 397 2HD PRO 47 HD3 PRO 47 -15.943 12.139 8.255 398 H LYS 48 H LYS 48 -14.447 15.088 12.364 399 HA LYS 48 HA LYS 48 -16.398 15.476 14.393 400 1HB LYS 48 HB2 LYS 48 -16.303 13.324 15.576 401 2HB LYS 48 HB3 LYS 48 -16.945 13.096 13.948 402 1HG LYS 48 HG2 LYS 48 -15.201 11.796 13.332 403 2HG LYS 48 HG3 LYS 48 -14.026 12.904 14.040 404 1HD LYS 48 HD2 LYS 48 -13.802 10.923 15.319 405 2HD LYS 48 HD3 LYS 48 -14.799 11.978 16.320 406 1HE LYS 48 HE2 LYS 48 -16.326 10.320 16.378 407 2HE LYS 48 HE3 LYS 48 -16.626 10.643 14.670 408 1HZ LYS 48 HZ1 LYS 48 -14.691 9.133 14.212 409 2HZ LYS 48 HZ2 LYS 48 -14.752 8.674 15.846 410 3HZ LYS 48 HZ3 LYS 48 -16.078 8.375 14.833 411 H LYS 49 H LYS 49 -14.306 16.962 14.177 412 HA LYS 49 HA LYS 49 -12.317 17.705 15.187 413 1HB LYS 49 HB2 LYS 49 -13.738 16.073 17.223 414 2HB LYS 49 HB3 LYS 49 -12.036 16.407 17.545 415 1HG LYS 49 HG2 LYS 49 -12.591 18.477 18.222 416 2HG LYS 49 HG3 LYS 49 -13.195 18.825 16.601 417 1HD LYS 49 HD2 LYS 49 -15.215 17.276 17.677 418 2HD LYS 49 HD3 LYS 49 -14.687 18.236 19.059 419 1HE LYS 49 HE2 LYS 49 -15.315 19.431 16.348 420 2HE LYS 49 HE3 LYS 49 -16.493 19.321 17.657 421 1HZ LYS 49 HZ1 LYS 49 -13.846 20.574 18.052 422 2HZ LYS 49 HZ2 LYS 49 -15.167 21.460 17.456 423 3HZ LYS 49 HZ3 LYS 49 -15.250 20.746 18.994 424 H GLY 50 H GLY 50 -11.469 16.205 13.288 425 1HA GLY 50 HA2 GLY 50 -9.677 14.840 12.620 426 2HA GLY 50 HA3 GLY 50 -9.167 14.802 14.309 427 H VAL 51 H VAL 51 -8.745 12.453 13.419 428 HA VAL 51 HA VAL 51 -11.225 10.832 13.822 429 HB VAL 51 HB VAL 51 -8.697 9.748 12.601 430 1HG1 VAL 51 HG11 VAL 51 -11.658 9.142 12.366 431 2HG1 VAL 51 HG12 VAL 51 -10.417 8.363 11.383 432 3HG1 VAL 51 HG13 VAL 51 -10.426 8.141 13.133 433 1HG2 VAL 51 HG21 VAL 51 -10.677 11.648 11.399 434 2HG2 VAL 51 HG22 VAL 51 -8.942 11.512 11.114 435 3HG2 VAL 51 HG23 VAL 51 -10.048 10.346 10.389 436 H GLU 52 H GLU 52 -10.958 8.836 15.080 437 HA GLU 52 HA GLU 52 -8.583 8.890 16.895 438 1HB GLU 52 HB2 GLU 52 -9.990 8.452 18.807 439 2HB GLU 52 HB3 GLU 52 -10.655 9.858 17.975 440 1HG GLU 52 HG2 GLU 52 -12.409 8.577 16.995 441 2HG GLU 52 HG3 GLU 52 -11.633 7.052 17.419 442 H LYS 53 H LYS 53 -7.789 6.849 17.454 443 HA LYS 53 HA LYS 53 -7.616 4.497 17.442 444 1HB LYS 53 HB2 LYS 53 -10.409 4.968 17.370 445 2HB LYS 53 HB3 LYS 53 -10.071 3.774 16.117 446 1HG LYS 53 HG2 LYS 53 -10.472 2.614 18.220 447 2HG LYS 53 HG3 LYS 53 -8.768 2.451 17.793 448 1HD LYS 53 HD2 LYS 53 -8.080 3.671 19.581 449 2HD LYS 53 HD3 LYS 53 -9.381 4.847 19.392 450 1HE LYS 53 HE2 LYS 53 -10.469 3.885 21.108 451 2HE LYS 53 HE3 LYS 53 -10.594 2.400 20.166 452 1HZ LYS 53 HZ1 LYS 53 -8.344 1.819 20.952 453 2HZ LYS 53 HZ2 LYS 53 -8.360 3.186 21.956 454 3HZ LYS 53 HZ3 LYS 53 -9.477 1.933 22.212 455 H TYR 54 H TYR 54 -6.000 4.578 15.826 456 HA TYR 54 HA TYR 54 -5.105 3.918 13.753 457 1HB TYR 54 HB2 TYR 54 -7.934 3.408 12.818 458 2HB TYR 54 HB3 TYR 54 -6.444 2.671 12.231 459 HD1 TYR 54 HD1 TYR 54 -5.178 2.303 15.023 460 HD2 TYR 54 HD2 TYR 54 -9.053 1.347 13.434 461 HE1 TYR 54 HE1 TYR 54 -5.415 0.486 16.693 462 HE2 TYR 54 HE2 TYR 54 -9.289 -0.471 15.104 463 HH TYR 54 HH TYR 54 -8.430 -1.207 17.150 464 H GLY 55 H GLY 55 -6.374 6.643 14.423 465 1HA GLY 55 HA2 GLY 55 -7.266 7.689 11.855 466 2HA GLY 55 HA3 GLY 55 -6.881 8.650 13.285 467 HA PRO 56 HA PRO 56 -3.082 9.739 11.323 468 1HB PRO 56 HB2 PRO 56 -1.822 10.756 13.522 469 2HB PRO 56 HB3 PRO 56 -3.162 11.584 12.709 470 1HG PRO 56 HG2 PRO 56 -3.148 10.124 15.299 471 2HG PRO 56 HG3 PRO 56 -4.187 11.453 14.762 472 1HD PRO 56 HD2 PRO 56 -4.883 8.705 14.836 473 2HD PRO 56 HD3 PRO 56 -5.802 10.007 14.048 474 H GLU 57 H GLU 57 -2.617 7.298 11.092 475 HA GLU 57 HA GLU 57 -0.199 6.649 12.700 476 1HB GLU 57 HB2 GLU 57 -2.703 5.011 12.451 477 2HB GLU 57 HB3 GLU 57 -1.148 4.193 12.603 478 1HG GLU 57 HG2 GLU 57 -1.030 6.190 14.538 479 2HG GLU 57 HG3 GLU 57 -2.696 5.617 14.630 480 H ALA 58 H ALA 58 -2.201 5.046 10.197 481 HA ALA 58 HA ALA 58 0.090 4.057 8.770 482 1HB ALA 58 HB1 ALA 58 -2.756 4.479 7.808 483 2HB ALA 58 HB2 ALA 58 -1.535 3.502 6.992 484 3HB ALA 58 HB3 ALA 58 -2.137 3.017 8.577 485 H SER 59 H SER 59 -1.834 7.002 8.514 486 HA SER 59 HA SER 59 -0.947 7.896 5.973 487 1HB SER 59 HB2 SER 59 -2.205 9.081 8.335 488 2HB SER 59 HB3 SER 59 -1.138 10.208 7.502 489 HG SER 59 HG SER 59 -3.516 9.050 6.692 490 H ALA 60 H ALA 60 0.429 8.622 9.201 491 HA ALA 60 HA ALA 60 2.741 9.966 8.074 492 1HB ALA 60 HB1 ALA 60 1.729 9.269 10.751 493 2HB ALA 60 HB2 ALA 60 3.488 9.249 10.621 494 3HB ALA 60 HB3 ALA 60 2.590 10.712 10.216 495 H PHE 61 H PHE 61 1.948 6.666 8.875 496 HA PHE 61 HA PHE 61 4.528 5.559 9.195 497 1HB PHE 61 HB2 PHE 61 2.382 4.319 9.516 498 2HB PHE 61 HB3 PHE 61 2.183 4.282 7.764 499 HD1 PHE 61 HD1 PHE 61 4.218 3.074 10.604 500 HD2 PHE 61 HD2 PHE 61 3.550 2.853 6.366 501 HE1 PHE 61 HE1 PHE 61 5.676 1.071 10.478 502 HE2 PHE 61 HE2 PHE 61 5.008 0.850 6.240 503 HZ PHE 61 HZ PHE 61 6.070 -0.041 8.296 504 H THR 62 H THR 62 2.633 5.489 6.170 505 HA THR 62 HA THR 62 4.918 4.845 4.547 506 HB THR 62 HB THR 62 2.568 6.267 3.364 507 HG1 THR 62 HG1 THR 62 2.279 3.574 3.985 508 1HG2 THR 62 HG21 THR 62 4.427 4.017 2.678 509 2HG2 THR 62 HG22 THR 62 2.846 4.093 1.901 510 3HG2 THR 62 HG23 THR 62 3.983 5.428 1.719 511 H LYS 63 H LYS 63 3.427 7.879 5.529 512 HA LYS 63 HA LYS 63 4.582 9.661 3.696 513 1HB LYS 63 HB2 LYS 63 2.977 10.182 5.624 514 2HB LYS 63 HB3 LYS 63 4.407 10.240 6.655 515 1HG LYS 63 HG2 LYS 63 4.921 12.305 5.922 516 2HG LYS 63 HG3 LYS 63 4.857 11.770 4.242 517 1HD LYS 63 HD2 LYS 63 2.335 11.944 4.381 518 2HD LYS 63 HD3 LYS 63 2.544 12.717 5.953 519 1HE LYS 63 HE2 LYS 63 4.189 13.827 3.750 520 2HE LYS 63 HE3 LYS 63 2.452 14.098 3.619 521 1HZ LYS 63 HZ1 LYS 63 2.501 14.942 5.921 522 2HZ LYS 63 HZ2 LYS 63 4.193 14.803 5.916 523 3HZ LYS 63 HZ3 LYS 63 3.425 15.881 4.852 524 H LYS 64 H LYS 64 5.941 9.070 6.940 525 HA LYS 64 HA LYS 64 8.502 10.161 6.309 526 1HB LYS 64 HB2 LYS 64 7.228 9.007 8.575 527 2HB LYS 64 HB3 LYS 64 8.751 8.149 8.339 528 1HG LYS 64 HG2 LYS 64 9.329 10.010 9.688 529 2HG LYS 64 HG3 LYS 64 9.815 10.481 8.059 530 1HD LYS 64 HD2 LYS 64 8.019 11.956 7.805 531 2HD LYS 64 HD3 LYS 64 7.052 11.144 9.036 532 1HE LYS 64 HE2 LYS 64 9.633 12.327 9.930 533 2HE LYS 64 HE3 LYS 64 8.341 13.456 9.516 534 1HZ LYS 64 HZ1 LYS 64 6.872 12.272 11.024 535 2HZ LYS 64 HZ2 LYS 64 8.121 11.194 11.428 536 3HZ LYS 64 HZ3 LYS 64 8.250 12.832 11.845 537 H MET 65 H MET 65 7.236 6.857 6.102 538 HA MET 65 HA MET 65 9.604 5.417 5.716 539 1HB MET 65 HB2 MET 65 6.859 4.933 5.355 540 2HB MET 65 HB3 MET 65 7.606 4.567 3.798 541 1HG MET 65 HG2 MET 65 8.156 2.570 4.705 542 2HG MET 65 HG3 MET 65 9.381 3.458 5.613 543 1HE MET 65 HE1 MET 65 8.660 5.010 7.344 544 2HE MET 65 HE2 MET 65 7.452 4.726 8.594 545 3HE MET 65 HE3 MET 65 8.976 3.829 8.612 546 H VAL 66 H VAL 66 7.618 6.190 2.873 547 HA VAL 66 HA VAL 66 9.801 6.055 1.056 548 HB VAL 66 HB VAL 66 8.272 7.223 -0.535 549 1HG1 VAL 66 HG11 VAL 66 7.483 4.869 1.117 550 2HG1 VAL 66 HG12 VAL 66 6.266 5.532 0.026 551 3HG1 VAL 66 HG13 VAL 66 7.810 4.968 -0.612 552 1HG2 VAL 66 HG21 VAL 66 7.239 8.360 1.784 553 2HG2 VAL 66 HG22 VAL 66 6.513 8.459 0.180 554 3HG2 VAL 66 HG23 VAL 66 5.995 7.205 1.307 555 H GLU 67 H GLU 67 8.874 8.560 3.232 556 HA GLU 67 HA GLU 67 9.940 10.804 1.776 557 1HB GLU 67 HB2 GLU 67 9.016 10.254 4.522 558 2HB GLU 67 HB3 GLU 67 10.257 11.501 4.405 559 1HG GLU 67 HG2 GLU 67 8.422 11.948 2.279 560 2HG GLU 67 HG3 GLU 67 7.471 11.698 3.743 561 H ASN 68 H ASN 68 11.370 8.434 3.969 562 HA ASN 68 HA ASN 68 13.997 9.807 3.725 563 1HB ASN 68 HB2 ASN 68 13.229 7.400 5.404 564 2HB ASN 68 HB3 ASN 68 14.744 8.298 5.497 565 1HD2 ASN 68 HD21 ASN 68 12.101 7.938 7.293 566 2HD2 ASN 68 HD22 ASN 68 11.855 9.522 7.852 567 H ALA 69 H ALA 69 12.206 7.249 2.356 568 HA ALA 69 HA ALA 69 14.097 5.271 1.781 569 1HB ALA 69 HB1 ALA 69 11.611 5.407 1.092 570 2HB ALA 69 HB2 ALA 69 12.185 6.293 -0.321 571 3HB ALA 69 HB3 ALA 69 12.722 4.636 -0.041 572 H LYS 70 H LYS 70 16.082 5.442 0.867 573 HA LYS 70 HA LYS 70 16.974 7.828 -0.480 574 1HB LYS 70 HB2 LYS 70 18.212 5.057 -0.496 575 2HB LYS 70 HB3 LYS 70 19.027 6.561 -0.925 576 1HG LYS 70 HG2 LYS 70 17.792 6.883 1.647 577 2HG LYS 70 HG3 LYS 70 18.758 5.407 1.660 578 1HD LYS 70 HD2 LYS 70 20.692 6.672 0.773 579 2HD LYS 70 HD3 LYS 70 19.726 8.149 0.796 580 1HE LYS 70 HE2 LYS 70 19.505 8.050 3.199 581 2HE LYS 70 HE3 LYS 70 20.250 6.453 3.251 582 1HZ LYS 70 HZ1 LYS 70 21.611 8.891 2.247 583 2HZ LYS 70 HZ2 LYS 70 21.776 8.296 3.827 584 3HZ LYS 70 HZ3 LYS 70 22.308 7.364 2.510 585 H LYS 71 H LYS 71 15.487 4.858 -1.550 586 HA LYS 71 HA LYS 71 15.457 5.946 -4.316 587 1HB LYS 71 HB2 LYS 71 16.204 3.086 -3.629 588 2HB LYS 71 HB3 LYS 71 16.040 3.752 -5.254 589 1HG LYS 71 HG2 LYS 71 17.823 5.453 -4.604 590 2HG LYS 71 HG3 LYS 71 18.097 4.480 -3.157 591 1HD LYS 71 HD2 LYS 71 18.478 2.492 -4.650 592 2HD LYS 71 HD3 LYS 71 18.391 3.579 -6.036 593 1HE LYS 71 HE2 LYS 71 20.192 4.656 -4.049 594 2HE LYS 71 HE3 LYS 71 20.664 3.008 -4.461 595 1HZ LYS 71 HZ1 LYS 71 20.062 5.100 -6.477 596 2HZ LYS 71 HZ2 LYS 71 21.627 4.757 -5.919 597 3HZ LYS 71 HZ3 LYS 71 20.744 3.568 -6.752 598 H ILE 72 H ILE 72 13.410 5.835 -5.118 599 HA ILE 72 HA ILE 72 11.523 3.914 -3.811 600 HB ILE 72 HB ILE 72 11.011 6.652 -5.010 601 1HG1 ILE 72 HG12 ILE 72 10.142 5.924 -2.271 602 2HG1 ILE 72 HG13 ILE 72 11.887 6.019 -2.507 603 1HG2 ILE 72 HG21 ILE 72 9.219 4.362 -4.397 604 2HG2 ILE 72 HG22 ILE 72 8.668 5.947 -3.856 605 3HG2 ILE 72 HG23 ILE 72 9.014 5.671 -5.563 606 1HD1 ILE 72 HD11 ILE 72 10.020 8.200 -3.452 607 2HD1 ILE 72 HD12 ILE 72 10.713 8.196 -1.830 608 3HD1 ILE 72 HD13 ILE 72 11.769 8.282 -3.239 609 H GLU 73 H GLU 73 10.945 2.291 -5.171 610 HA GLU 73 HA GLU 73 10.820 2.909 -8.097 611 1HB GLU 73 HB2 GLU 73 11.918 0.515 -6.639 612 2HB GLU 73 HB3 GLU 73 11.323 0.355 -8.291 613 1HG GLU 73 HG2 GLU 73 13.058 1.546 -9.172 614 2HG GLU 73 HG3 GLU 73 13.120 2.659 -7.805 615 H VAL 74 H VAL 74 9.145 1.799 -9.271 616 HA VAL 74 HA VAL 74 6.982 0.708 -7.512 617 HB VAL 74 HB VAL 74 5.508 1.497 -9.531 618 1HG1 VAL 74 HG11 VAL 74 5.893 2.475 -7.084 619 2HG1 VAL 74 HG12 VAL 74 6.630 3.799 -7.985 620 3HG1 VAL 74 HG13 VAL 74 4.947 3.362 -8.280 621 1HG2 VAL 74 HG21 VAL 74 7.714 2.066 -10.795 622 2HG2 VAL 74 HG22 VAL 74 6.382 3.217 -10.885 623 3HG2 VAL 74 HG23 VAL 74 7.733 3.516 -9.793 624 H GLU 75 H GLU 75 5.938 -1.179 -8.245 625 HA GLU 75 HA GLU 75 7.121 -2.417 -10.699 626 1HB GLU 75 HB2 GLU 75 7.840 -3.406 -8.438 627 2HB GLU 75 HB3 GLU 75 6.179 -3.981 -8.292 628 1HG GLU 75 HG2 GLU 75 6.386 -5.214 -10.396 629 2HG GLU 75 HG3 GLU 75 8.019 -4.590 -10.624 630 H PHE 76 H PHE 76 5.440 -2.128 -12.139 631 HA PHE 76 HA PHE 76 2.654 -2.339 -11.370 632 1HB PHE 76 HB2 PHE 76 4.037 -2.326 -14.067 633 2HB PHE 76 HB3 PHE 76 2.284 -2.357 -13.874 634 HD1 PHE 76 HD1 PHE 76 1.162 -0.484 -12.563 635 HD2 PHE 76 HD2 PHE 76 5.256 -0.302 -13.850 636 HE1 PHE 76 HE1 PHE 76 1.154 1.976 -12.243 637 HE2 PHE 76 HE2 PHE 76 5.248 2.157 -13.530 638 HZ PHE 76 HZ PHE 76 3.196 3.296 -12.728 639 H ASP 77 H ASP 77 1.392 -4.162 -11.307 640 HA ASP 77 HA ASP 77 2.631 -6.762 -11.526 641 1HB ASP 77 HB2 ASP 77 0.336 -5.774 -10.340 642 2HB ASP 77 HB3 ASP 77 -0.301 -6.722 -11.683 643 H LYS 78 H LYS 78 0.810 -8.349 -12.870 644 HA LYS 78 HA LYS 78 1.474 -7.699 -15.661 645 1HB LYS 78 HB2 LYS 78 0.568 -9.941 -16.150 646 2HB LYS 78 HB3 LYS 78 1.733 -10.013 -14.827 647 1HG LYS 78 HG2 LYS 78 -1.050 -9.508 -13.981 648 2HG LYS 78 HG3 LYS 78 -0.780 -11.089 -14.716 649 1HD LYS 78 HD2 LYS 78 1.262 -10.208 -12.751 650 2HD LYS 78 HD3 LYS 78 -0.329 -10.590 -12.094 651 1HE LYS 78 HE2 LYS 78 0.756 -12.672 -12.054 652 2HE LYS 78 HE3 LYS 78 -0.155 -12.739 -13.561 653 1HZ LYS 78 HZ1 LYS 78 2.684 -11.903 -13.334 654 2HZ LYS 78 HZ2 LYS 78 2.166 -13.444 -13.819 655 3HZ LYS 78 HZ3 LYS 78 1.797 -12.086 -14.772 656 H GLY 79 H GLY 79 -1.237 -7.423 -13.535 657 1HA GLY 79 HA2 GLY 79 -3.311 -7.475 -15.548 658 2HA GLY 79 HA3 GLY 79 -3.475 -6.809 -13.923 659 H GLN 80 H GLN 80 -4.559 -4.920 -14.674 660 HA GLN 80 HA GLN 80 -3.375 -3.218 -16.715 661 1HB GLN 80 HB2 GLN 80 -5.351 -2.194 -14.704 662 2HB GLN 80 HB3 GLN 80 -5.238 -1.853 -16.430 663 1HG GLN 80 HG2 GLN 80 -5.674 -4.570 -16.412 664 2HG GLN 80 HG3 GLN 80 -6.645 -4.032 -15.042 665 1HE2 GLN 80 HE21 GLN 80 -8.753 -3.632 -15.709 666 2HE2 GLN 80 HE22 GLN 80 -9.193 -2.920 -17.186 667 H ARG 81 H ARG 81 -2.907 -0.835 -16.102 668 HA ARG 81 HA ARG 81 -1.122 -0.864 -13.711 669 1HB ARG 81 HB2 ARG 81 -1.131 0.791 -16.244 670 2HB ARG 81 HB3 ARG 81 -0.136 1.204 -14.849 671 1HG ARG 81 HG2 ARG 81 1.334 -0.472 -15.256 672 2HG ARG 81 HG3 ARG 81 0.050 -1.624 -15.624 673 1HD ARG 81 HD2 ARG 81 0.990 0.554 -17.512 674 2HD ARG 81 HD3 ARG 81 1.500 -1.132 -17.601 675 HE ARG 81 HE ARG 81 -1.412 -0.650 -17.684 676 1HH1 ARG 81 HH11 ARG 81 1.110 -0.114 -19.803 677 2HH1 ARG 81 HH12 ARG 81 0.559 -1.208 -21.028 678 1HH2 ARG 81 HH21 ARG 81 -1.949 -2.570 -19.059 679 2HH2 ARG 81 HH22 ARG 81 -1.172 -2.598 -20.607 680 H THR 82 H THR 82 -4.123 0.264 -14.731 681 HA THR 82 HA THR 82 -4.221 2.142 -12.443 682 HB THR 82 HB THR 82 -5.290 3.897 -13.828 683 HG1 THR 82 HG1 THR 82 -5.844 3.448 -15.788 684 1HG2 THR 82 HG21 THR 82 -2.714 3.615 -13.462 685 2HG2 THR 82 HG22 THR 82 -2.694 3.218 -15.179 686 3HG2 THR 82 HG23 THR 82 -3.290 4.789 -14.646 687 H ASP 83 H ASP 83 -6.372 2.412 -11.638 688 HA ASP 83 HA ASP 83 -8.221 0.274 -12.536 689 1HB ASP 83 HB2 ASP 83 -7.628 1.547 -10.025 690 2HB ASP 83 HB3 ASP 83 -9.343 1.741 -10.381 691 H LYS 84 H LYS 84 -10.667 1.385 -11.821 692 HA LYS 84 HA LYS 84 -11.235 3.011 -14.147 693 1HB LYS 84 HB2 LYS 84 -13.536 3.115 -13.225 694 2HB LYS 84 HB3 LYS 84 -12.915 1.465 -13.247 695 1HG LYS 84 HG2 LYS 84 -12.171 1.866 -10.831 696 2HG LYS 84 HG3 LYS 84 -13.168 3.321 -10.875 697 1HD LYS 84 HD2 LYS 84 -15.082 1.825 -11.662 698 2HD LYS 84 HD3 LYS 84 -14.063 0.453 -11.223 699 1HE LYS 84 HE2 LYS 84 -13.946 1.202 -8.919 700 2HE LYS 84 HE3 LYS 84 -14.791 2.696 -9.320 701 1HZ LYS 84 HZ1 LYS 84 -16.290 0.477 -10.208 702 2HZ LYS 84 HZ2 LYS 84 -15.908 0.276 -8.564 703 3HZ LYS 84 HZ3 LYS 84 -16.723 1.672 -9.087 704 H TYR 85 H TYR 85 -9.880 3.792 -11.192 705 HA TYR 85 HA TYR 85 -11.103 6.495 -11.079 706 1HB TYR 85 HB2 TYR 85 -9.309 4.906 -9.252 707 2HB TYR 85 HB3 TYR 85 -9.452 6.653 -9.063 708 HD1 TYR 85 HD1 TYR 85 -11.433 3.498 -9.216 709 HD2 TYR 85 HD2 TYR 85 -11.339 7.616 -8.005 710 HE1 TYR 85 HE1 TYR 85 -13.572 3.189 -8.001 711 HE2 TYR 85 HE2 TYR 85 -13.479 7.308 -6.790 712 HH TYR 85 HH TYR 85 -14.795 4.244 -6.138 713 H GLY 86 H GLY 86 -8.501 4.932 -12.552 714 1HA GLY 86 HA2 GLY 86 -6.906 5.976 -13.991 715 2HA GLY 86 HA3 GLY 86 -7.292 7.530 -13.247 716 H ARG 87 H ARG 87 -6.991 5.713 -10.627 717 HA ARG 87 HA ARG 87 -4.371 6.701 -9.958 718 1HB ARG 87 HB2 ARG 87 -6.259 4.738 -8.650 719 2HB ARG 87 HB3 ARG 87 -4.668 5.085 -7.971 720 1HG ARG 87 HG2 ARG 87 -5.263 7.184 -7.301 721 2HG ARG 87 HG3 ARG 87 -6.268 7.461 -8.724 722 1HD ARG 87 HD2 ARG 87 -7.567 7.302 -6.570 723 2HD ARG 87 HD3 ARG 87 -8.064 6.136 -7.797 724 HE ARG 87 HE ARG 87 -6.048 5.157 -5.892 725 1HH1 ARG 87 HH11 ARG 87 -9.394 5.670 -6.541 726 2HH1 ARG 87 HH12 ARG 87 -9.912 4.253 -5.693 727 1HH2 ARG 87 HH21 ARG 87 -6.699 3.233 -4.885 728 2HH2 ARG 87 HH22 ARG 87 -8.389 2.876 -4.753 729 H GLY 88 H GLY 88 -2.410 5.537 -9.767 730 1HA GLY 88 HA2 GLY 88 -2.214 3.209 -11.566 731 2HA GLY 88 HA3 GLY 88 -0.858 4.084 -10.854 732 H LEU 89 H LEU 89 -1.948 1.129 -10.868 733 HA LEU 89 HA LEU 89 -1.720 0.710 -7.917 734 1HB LEU 89 HB2 LEU 89 -2.741 -1.302 -9.933 735 2HB LEU 89 HB3 LEU 89 -2.955 -1.314 -8.182 736 HG LEU 89 HG LEU 89 -3.964 1.094 -9.595 737 1HD1 LEU 89 HD11 LEU 89 -4.545 -1.263 -10.816 738 2HD1 LEU 89 HD12 LEU 89 -5.832 -1.208 -9.612 739 3HD1 LEU 89 HD13 LEU 89 -5.654 0.107 -10.774 740 1HD2 LEU 89 HD21 LEU 89 -4.392 -0.427 -7.139 741 2HD2 LEU 89 HD22 LEU 89 -4.777 1.257 -7.490 742 3HD2 LEU 89 HD23 LEU 89 -5.912 -0.017 -7.935 743 H ALA 90 H ALA 90 0.208 -0.113 -7.261 744 HA ALA 90 HA ALA 90 1.539 -2.252 -8.685 745 1HB ALA 90 HB1 ALA 90 2.072 -0.017 -9.960 746 2HB ALA 90 HB2 ALA 90 3.164 0.275 -8.606 747 3HB ALA 90 HB3 ALA 90 3.378 -1.153 -9.619 748 H TYR 91 H TYR 91 3.427 -3.014 -7.487 749 HA TYR 91 HA TYR 91 3.184 -2.507 -4.626 750 1HB TYR 91 HB2 TYR 91 5.394 -4.072 -5.965 751 2HB TYR 91 HB3 TYR 91 4.725 -4.293 -4.348 752 HD1 TYR 91 HD1 TYR 91 2.220 -4.939 -4.180 753 HD2 TYR 91 HD2 TYR 91 4.543 -5.312 -7.774 754 HE1 TYR 91 HE1 TYR 91 0.569 -6.555 -5.079 755 HE2 TYR 91 HE2 TYR 91 2.891 -6.929 -8.672 756 HH TYR 91 HH TYR 91 0.747 -8.541 -6.900 757 H ILE 92 H ILE 92 4.159 -0.803 -3.653 758 HA ILE 92 HA ILE 92 6.389 0.578 -4.991 759 HB ILE 92 HB ILE 92 4.964 1.140 -2.372 760 1HG1 ILE 92 HG12 ILE 92 4.711 2.273 -5.172 761 2HG1 ILE 92 HG13 ILE 92 3.462 1.459 -4.229 762 1HG2 ILE 92 HG21 ILE 92 7.388 1.974 -2.676 763 2HG2 ILE 92 HG22 ILE 92 6.733 3.028 -3.930 764 3HG2 ILE 92 HG23 ILE 92 6.168 3.180 -2.266 765 1HD1 ILE 92 HD11 ILE 92 4.105 3.441 -2.507 766 2HD1 ILE 92 HD12 ILE 92 4.463 4.248 -4.033 767 3HD1 ILE 92 HD13 ILE 92 2.848 3.608 -3.732 768 H TYR 93 H TYR 93 8.519 0.577 -4.246 769 HA TYR 93 HA TYR 93 9.083 -1.108 -1.842 770 1HB TYR 93 HB2 TYR 93 10.656 -1.098 -4.436 771 2HB TYR 93 HB3 TYR 93 11.028 -2.055 -3.002 772 HD1 TYR 93 HD1 TYR 93 8.630 -1.576 -5.778 773 HD2 TYR 93 HD2 TYR 93 9.746 -4.020 -2.426 774 HE1 TYR 93 HE1 TYR 93 7.072 -3.344 -6.550 775 HE2 TYR 93 HE2 TYR 93 8.187 -5.790 -3.199 776 HH TYR 93 HH TYR 93 6.553 -6.297 -4.640 777 H ALA 94 H ALA 94 10.544 -0.221 -0.441 778 HA ALA 94 HA ALA 94 12.158 2.105 -1.387 779 1HB ALA 94 HB1 ALA 94 10.060 2.054 0.658 780 2HB ALA 94 HB2 ALA 94 11.593 2.676 1.271 781 3HB ALA 94 HB3 ALA 94 10.828 3.435 -0.125 782 H ASP 95 H ASP 95 14.272 1.993 -0.716 783 HA ASP 95 HA ASP 95 16.183 1.221 0.417 784 1HB ASP 95 HB2 ASP 95 14.255 0.066 2.449 785 2HB ASP 95 HB3 ASP 95 15.951 0.482 2.695 786 H GLY 96 H GLY 96 14.089 -0.570 -1.213 787 1HA GLY 96 HA2 GLY 96 14.584 -2.654 -2.282 788 2HA GLY 96 HA3 GLY 96 15.786 -2.982 -1.033 789 H LYS 97 H LYS 97 12.673 -1.871 -0.007 790 HA LYS 97 HA LYS 97 11.954 -4.673 0.758 791 1HB LYS 97 HB2 LYS 97 12.743 -2.790 2.545 792 2HB LYS 97 HB3 LYS 97 11.012 -2.457 2.490 793 1HG LYS 97 HG2 LYS 97 10.587 -4.895 2.886 794 2HG LYS 97 HG3 LYS 97 12.324 -5.122 3.098 795 1HD LYS 97 HD2 LYS 97 11.417 -2.900 4.706 796 2HD LYS 97 HD3 LYS 97 10.456 -4.336 5.064 797 1HE LYS 97 HE2 LYS 97 12.191 -5.356 6.092 798 2HE LYS 97 HE3 LYS 97 13.302 -4.946 4.785 799 1HZ LYS 97 HZ1 LYS 97 12.401 -2.868 6.668 800 2HZ LYS 97 HZ2 LYS 97 13.660 -3.922 7.106 801 3HZ LYS 97 HZ3 LYS 97 13.818 -2.927 5.737 802 H MET 98 H MET 98 9.639 -5.072 0.907 803 HA MET 98 HA MET 98 8.123 -3.508 -1.061 804 1HB MET 98 HB2 MET 98 8.055 -6.074 -0.743 805 2HB MET 98 HB3 MET 98 7.021 -5.742 0.646 806 1HG MET 98 HG2 MET 98 5.273 -5.008 -0.652 807 2HG MET 98 HG3 MET 98 6.337 -4.352 -1.897 808 1HE MET 98 HE1 MET 98 4.894 -7.084 -0.102 809 2HE MET 98 HE2 MET 98 4.383 -8.272 -1.309 810 3HE MET 98 HE3 MET 98 5.968 -8.407 -0.553 811 H VAL 99 H VAL 99 7.459 -1.549 -0.250 812 HA VAL 99 HA VAL 99 6.898 -0.823 2.378 813 HB VAL 99 HB VAL 99 5.288 0.097 -0.020 814 1HG1 VAL 99 HG11 VAL 99 4.970 0.729 2.617 815 2HG1 VAL 99 HG12 VAL 99 6.132 1.958 2.118 816 3HG1 VAL 99 HG13 VAL 99 4.580 1.823 1.290 817 1HG2 VAL 99 HG21 VAL 99 8.041 0.888 0.968 818 2HG2 VAL 99 HG22 VAL 99 7.608 0.280 -0.630 819 3HG2 VAL 99 HG23 VAL 99 7.090 1.889 -0.128 820 H ASN 100 H ASN 100 4.767 -2.496 0.088 821 HA ASN 100 HA ASN 100 2.361 -2.393 1.571 822 1HB ASN 100 HB2 ASN 100 3.405 -4.676 -0.134 823 2HB ASN 100 HB3 ASN 100 1.724 -4.439 0.349 824 1HD2 ASN 100 HD21 ASN 100 0.663 -3.775 -1.537 825 2HD2 ASN 100 HD22 ASN 100 1.191 -2.519 -2.549 826 H GLU 101 H GLU 101 4.732 -5.088 1.550 827 HA GLU 101 HA GLU 101 3.574 -6.492 3.729 828 1HB GLU 101 HB2 GLU 101 5.254 -7.520 2.274 829 2HB GLU 101 HB3 GLU 101 6.473 -6.379 2.844 830 1HG GLU 101 HG2 GLU 101 6.088 -7.250 5.178 831 2HG GLU 101 HG3 GLU 101 5.054 -8.498 4.481 832 H ALA 102 H ALA 102 5.548 -3.631 3.663 833 HA ALA 102 HA ALA 102 6.542 -3.775 6.357 834 1HB ALA 102 HB1 ALA 102 6.018 -1.392 4.559 835 2HB ALA 102 HB2 ALA 102 6.878 -1.308 6.096 836 3HB ALA 102 HB3 ALA 102 7.550 -2.241 4.759 837 H LEU 103 H LEU 103 3.788 -1.983 4.966 838 HA LEU 103 HA LEU 103 2.784 -1.002 7.444 839 1HB LEU 103 HB2 LEU 103 1.429 -1.605 4.806 840 2HB LEU 103 HB3 LEU 103 0.573 -0.882 6.169 841 HG LEU 103 HG LEU 103 3.077 0.491 5.747 842 1HD1 LEU 103 HD11 LEU 103 1.393 -0.103 3.347 843 2HD1 LEU 103 HD12 LEU 103 2.056 1.523 3.510 844 3HD1 LEU 103 HD13 LEU 103 3.138 0.130 3.462 845 1HD2 LEU 103 HD21 LEU 103 0.405 1.008 6.489 846 2HD2 LEU 103 HD22 LEU 103 1.737 2.165 6.447 847 3HD2 LEU 103 HD23 LEU 103 0.690 1.974 5.041 848 H VAL 104 H VAL 104 2.288 -4.073 5.763 849 HA VAL 104 HA VAL 104 0.156 -5.004 7.461 850 HB VAL 104 HB VAL 104 2.161 -6.438 5.705 851 1HG1 VAL 104 HG11 VAL 104 -0.156 -7.564 7.307 852 2HG1 VAL 104 HG12 VAL 104 0.690 -8.441 6.031 853 3HG1 VAL 104 HG13 VAL 104 1.550 -7.969 7.497 854 1HG2 VAL 104 HG21 VAL 104 -0.802 -5.821 5.487 855 2HG2 VAL 104 HG22 VAL 104 0.492 -5.134 4.505 856 3HG2 VAL 104 HG23 VAL 104 0.083 -6.843 4.353 857 H ARG 105 H ARG 105 3.682 -5.144 7.662 858 HA ARG 105 HA ARG 105 3.828 -7.024 9.824 859 1HB ARG 105 HB2 ARG 105 5.781 -6.350 8.428 860 2HB ARG 105 HB3 ARG 105 5.736 -4.755 9.178 861 1HG ARG 105 HG2 ARG 105 6.407 -5.567 11.264 862 2HG ARG 105 HG3 ARG 105 5.862 -7.207 10.910 863 1HD ARG 105 HD2 ARG 105 8.070 -7.603 10.516 864 2HD ARG 105 HD3 ARG 105 7.736 -6.854 8.956 865 HE ARG 105 HE ARG 105 9.212 -5.163 9.642 866 1HH1 ARG 105 HH11 ARG 105 8.009 -6.847 12.371 867 2HH1 ARG 105 HH12 ARG 105 8.522 -5.651 13.514 868 1HH2 ARG 105 HH21 ARG 105 9.667 -3.446 11.094 869 2HH2 ARG 105 HH22 ARG 105 9.460 -3.724 12.791 870 H GLN 106 H GLN 106 3.523 -3.483 9.732 871 HA GLN 106 HA GLN 106 3.585 -3.294 12.660 872 1HB GLN 106 HB2 GLN 106 4.369 -1.494 10.982 873 2HB GLN 106 HB3 GLN 106 2.655 -1.132 10.771 874 1HG GLN 106 HG2 GLN 106 2.523 -0.085 12.769 875 2HG GLN 106 HG3 GLN 106 3.415 -1.369 13.586 876 1HE2 GLN 106 HE21 GLN 106 5.880 -1.292 12.227 877 2HE2 GLN 106 HE22 GLN 106 6.620 0.214 12.483 878 H GLY 107 H GLY 107 1.327 -4.479 10.612 879 1HA GLY 107 HA2 GLY 107 -0.999 -4.766 10.743 880 2HA GLY 107 HA3 GLY 107 -0.787 -4.522 12.477 881 H LEU 108 H LEU 108 -0.275 -2.276 9.746 882 HA LEU 108 HA LEU 108 -2.124 -0.384 11.136 883 1HB LEU 108 HB2 LEU 108 0.252 0.029 9.322 884 2HB LEU 108 HB3 LEU 108 -0.933 1.310 9.579 885 HG LEU 108 HG LEU 108 0.460 -0.130 11.848 886 1HD1 LEU 108 HD11 LEU 108 1.228 2.323 10.273 887 2HD1 LEU 108 HD12 LEU 108 1.698 2.157 11.965 888 3HD1 LEU 108 HD13 LEU 108 2.244 0.973 10.778 889 1HD2 LEU 108 HD21 LEU 108 -1.696 1.779 11.631 890 2HD2 LEU 108 HD22 LEU 108 -1.048 1.008 13.078 891 3HD2 LEU 108 HD23 LEU 108 -0.339 2.511 12.489 892 H ALA 109 H ALA 109 -1.518 -2.122 8.172 893 HA ALA 109 HA ALA 109 -3.926 -0.811 6.970 894 1HB ALA 109 HB1 ALA 109 -1.303 -1.501 5.875 895 2HB ALA 109 HB2 ALA 109 -2.627 -2.164 4.917 896 3HB ALA 109 HB3 ALA 109 -2.541 -0.429 5.223 897 H LYS 110 H LYS 110 -4.994 -2.433 5.323 898 HA LYS 110 HA LYS 110 -5.147 -5.103 6.666 899 1HB LYS 110 HB2 LYS 110 -7.335 -3.586 5.211 900 2HB LYS 110 HB3 LYS 110 -7.508 -5.178 5.950 901 1HG LYS 110 HG2 LYS 110 -6.727 -4.073 8.133 902 2HG LYS 110 HG3 LYS 110 -7.013 -2.533 7.322 903 1HD LYS 110 HD2 LYS 110 -9.135 -4.676 7.389 904 2HD LYS 110 HD3 LYS 110 -8.956 -3.527 8.715 905 1HE LYS 110 HE2 LYS 110 -9.038 -2.447 5.928 906 2HE LYS 110 HE3 LYS 110 -10.550 -3.002 6.647 907 1HZ LYS 110 HZ1 LYS 110 -9.202 -1.518 8.577 908 2HZ LYS 110 HZ2 LYS 110 -9.144 -0.616 7.141 909 3HZ LYS 110 HZ3 LYS 110 -10.641 -1.114 7.769 910 H VAL 111 H VAL 111 -5.729 -6.902 5.183 911 HA VAL 111 HA VAL 111 -4.455 -6.490 2.527 912 HB VAL 111 HB VAL 111 -3.724 -8.348 4.134 913 1HG1 VAL 111 HG11 VAL 111 -6.299 -8.862 4.506 914 2HG1 VAL 111 HG12 VAL 111 -6.071 -9.894 3.094 915 3HG1 VAL 111 HG13 VAL 111 -5.109 -10.164 4.547 916 1HG2 VAL 111 HG21 VAL 111 -3.209 -8.306 1.692 917 2HG2 VAL 111 HG22 VAL 111 -3.413 -9.947 2.307 918 3HG2 VAL 111 HG23 VAL 111 -4.708 -9.182 1.386 919 H ALA 112 H ALA 112 -5.765 -6.288 0.776 920 HA ALA 112 HA ALA 112 -8.078 -7.941 0.337 921 1HB ALA 112 HB1 ALA 112 -8.532 -5.128 1.346 922 2HB ALA 112 HB2 ALA 112 -9.735 -5.981 0.380 923 3HB ALA 112 HB3 ALA 112 -9.242 -6.628 1.945 924 H TYR 113 H TYR 113 -9.524 -6.449 -1.432 925 HA TYR 113 HA TYR 113 -9.470 -5.654 -3.641 926 1HB TYR 113 HB2 TYR 113 -7.008 -4.335 -2.479 927 2HB TYR 113 HB3 TYR 113 -7.512 -4.073 -4.149 928 HD1 TYR 113 HD1 TYR 113 -10.432 -4.042 -3.964 929 HD2 TYR 113 HD2 TYR 113 -7.501 -2.351 -1.320 930 HE1 TYR 113 HE1 TYR 113 -12.090 -2.360 -3.204 931 HE2 TYR 113 HE2 TYR 113 -9.158 -0.670 -0.559 932 HH TYR 113 HH TYR 113 -12.183 -0.210 -2.164 933 H VAL 114 H VAL 114 -8.932 -8.151 -3.808 934 HA VAL 114 HA VAL 114 -6.255 -8.462 -5.100 935 HB VAL 114 HB VAL 114 -8.084 -10.669 -4.128 936 1HG1 VAL 114 HG11 VAL 114 -5.173 -10.513 -4.951 937 2HG1 VAL 114 HG12 VAL 114 -5.870 -11.907 -4.126 938 3HG1 VAL 114 HG13 VAL 114 -6.456 -11.444 -5.724 939 1HG2 VAL 114 HG21 VAL 114 -6.703 -8.774 -2.557 940 2HG2 VAL 114 HG22 VAL 114 -7.405 -10.295 -2.009 941 3HG2 VAL 114 HG23 VAL 114 -5.717 -10.236 -2.517 942 H TYR 115 H TYR 115 -7.382 -7.381 -7.004 943 HA TYR 115 HA TYR 115 -9.311 -9.118 -8.423 944 1HB TYR 115 HB2 TYR 115 -8.100 -6.503 -9.361 945 2HB TYR 115 HB3 TYR 115 -9.553 -7.290 -9.977 946 HD1 TYR 115 HD1 TYR 115 -11.451 -7.742 -8.225 947 HD2 TYR 115 HD2 TYR 115 -8.293 -4.881 -7.682 948 HE1 TYR 115 HE1 TYR 115 -12.816 -6.558 -6.528 949 HE2 TYR 115 HE2 TYR 115 -9.660 -3.696 -5.984 950 HH TYR 115 HH TYR 115 -11.778 -3.484 -5.153 951 H LYS 116 H LYS 116 -8.661 -10.544 -9.970 952 HA LYS 116 HA LYS 116 -5.819 -10.753 -10.620 953 1HB LYS 116 HB2 LYS 116 -8.287 -12.322 -11.353 954 2HB LYS 116 HB3 LYS 116 -6.751 -12.621 -12.168 955 1HG LYS 116 HG2 LYS 116 -6.006 -12.539 -9.512 956 2HG LYS 116 HG3 LYS 116 -7.584 -13.323 -9.441 957 1HD LYS 116 HD2 LYS 116 -5.724 -14.241 -11.578 958 2HD LYS 116 HD3 LYS 116 -5.324 -14.697 -9.922 959 1HE LYS 116 HE2 LYS 116 -7.991 -15.234 -9.949 960 2HE LYS 116 HE3 LYS 116 -7.577 -15.578 -11.628 961 1HZ LYS 116 HZ1 LYS 116 -5.625 -16.620 -9.842 962 2HZ LYS 116 HZ2 LYS 116 -7.170 -17.221 -9.469 963 3HZ LYS 116 HZ3 LYS 116 -6.531 -17.423 -11.029 964 HA PRO 117 HA PRO 117 -4.905 -11.962 -12.277 965 1HB PRO 117 HB2 PRO 117 -2.794 -11.303 -13.876 966 2HB PRO 117 HB3 PRO 117 -4.189 -12.228 -14.456 967 1HG PRO 117 HG2 PRO 117 -3.479 -9.382 -14.958 968 2HG PRO 117 HG3 PRO 117 -4.389 -10.511 -15.973 969 1HD PRO 117 HD2 PRO 117 -5.494 -8.484 -14.344 970 2HD PRO 117 HD3 PRO 117 -6.387 -9.822 -15.101 971 H ASN 118 H ASN 118 -5.053 -8.848 -11.466 972 HA ASN 118 HA ASN 118 -2.303 -8.320 -10.641 973 1HB ASN 118 HB2 ASN 118 -4.959 -6.970 -10.210 974 2HB ASN 118 HB3 ASN 118 -3.552 -6.480 -9.265 975 1HD2 ASN 118 HD21 ASN 118 -4.666 -4.627 -11.066 976 2HD2 ASN 118 HD22 ASN 118 -3.615 -4.412 -12.381 977 H ASN 119 H ASN 119 -2.009 -10.370 -9.422 978 HA ASN 119 HA ASN 119 -2.518 -9.972 -6.589 979 1HB ASN 119 HB2 ASN 119 -3.861 -11.979 -6.213 980 2HB ASN 119 HB3 ASN 119 -4.705 -10.915 -7.341 981 1HD2 ASN 119 HD21 ASN 119 -4.140 -14.105 -6.908 982 2HD2 ASN 119 HD22 ASN 119 -4.043 -14.625 -8.522 983 H THR 120 H THR 120 -0.324 -10.498 -8.555 984 HA THR 120 HA THR 120 0.704 -13.119 -8.375 985 HB THR 120 HB THR 120 2.229 -10.496 -8.387 986 HG1 THR 120 HG1 THR 120 2.078 -10.636 -10.536 987 1HG2 THR 120 HG21 THR 120 3.111 -13.218 -8.145 988 2HG2 THR 120 HG22 THR 120 3.610 -12.590 -9.715 989 3HG2 THR 120 HG23 THR 120 4.085 -11.751 -8.238 990 H HIS 121 H HIS 121 1.335 -10.350 -6.193 991 HA HIS 121 HA HIS 121 2.684 -12.150 -4.290 992 1HB HIS 121 HB2 HIS 121 1.996 -9.227 -3.906 993 2HB HIS 121 HB3 HIS 121 3.228 -10.161 -3.059 994 HD1 HIS 121 HD1 HIS 121 4.295 -11.603 -5.707 995 HD2 HIS 121 HD2 HIS 121 3.850 -7.493 -5.171 996 HE1 HIS 121 HE1 HIS 121 5.856 -10.491 -7.364 997 H GLU 122 H GLU 122 -0.026 -12.852 -4.695 998 HA GLU 122 HA GLU 122 -1.675 -11.689 -2.593 999 1HB GLU 122 HB2 GLU 122 -2.524 -12.818 -4.724 1000 2HB GLU 122 HB3 GLU 122 -2.114 -14.353 -3.957 1001 1HG GLU 122 HG2 GLU 122 -3.536 -13.634 -1.986 1002 2HG GLU 122 HG3 GLU 122 -4.086 -12.278 -2.972 1003 H GLN 123 H GLN 123 -0.293 -14.975 -3.011 1004 HA GLN 123 HA GLN 123 -0.833 -15.898 -0.397 1005 1HB GLN 123 HB2 GLN 123 0.570 -16.846 -2.648 1006 2HB GLN 123 HB3 GLN 123 1.739 -16.862 -1.328 1007 1HG GLN 123 HG2 GLN 123 0.218 -18.163 0.063 1008 2HG GLN 123 HG3 GLN 123 -1.039 -18.066 -1.171 1009 1HE2 GLN 123 HE21 GLN 123 0.110 -20.573 -0.199 1010 2HE2 GLN 123 HE22 GLN 123 0.892 -21.308 -1.514 1011 H LEU 124 H LEU 124 1.826 -13.916 -1.614 1012 HA LEU 124 HA LEU 124 3.498 -14.023 0.693 1013 1HB LEU 124 HB2 LEU 124 3.781 -12.897 -1.725 1014 2HB LEU 124 HB3 LEU 124 3.286 -11.462 -0.825 1015 HG LEU 124 HG LEU 124 5.665 -11.521 -0.675 1016 1HD1 LEU 124 HD11 LEU 124 4.272 -11.279 1.497 1017 2HD1 LEU 124 HD12 LEU 124 4.840 -12.904 1.876 1018 3HD1 LEU 124 HD13 LEU 124 5.999 -11.592 1.661 1019 1HD2 LEU 124 HD21 LEU 124 5.186 -14.427 -0.566 1020 2HD2 LEU 124 HD22 LEU 124 6.570 -13.539 -1.203 1021 3HD2 LEU 124 HD23 LEU 124 6.453 -13.869 0.526 1022 H LEU 125 H LEU 125 1.317 -11.334 -0.242 1023 HA LEU 125 HA LEU 125 1.381 -10.107 2.341 1024 1HB LEU 125 HB2 LEU 125 -0.640 -9.934 0.089 1025 2HB LEU 125 HB3 LEU 125 -0.696 -8.917 1.529 1026 HG LEU 125 HG LEU 125 1.743 -9.113 -0.251 1027 1HD1 LEU 125 HD11 LEU 125 -0.287 -8.220 -1.457 1028 2HD1 LEU 125 HD12 LEU 125 -0.364 -6.935 -0.251 1029 3HD1 LEU 125 HD13 LEU 125 1.036 -7.063 -1.316 1030 1HD2 LEU 125 HD21 LEU 125 0.867 -7.409 2.073 1031 2HD2 LEU 125 HD22 LEU 125 2.401 -8.244 1.830 1032 3HD2 LEU 125 HD23 LEU 125 2.036 -6.786 0.910 1033 H ARG 126 H ARG 126 -0.129 -12.965 1.301 1034 HA ARG 126 HA ARG 126 -2.481 -12.867 2.984 1035 1HB ARG 126 HB2 ARG 126 -1.760 -14.492 0.971 1036 2HB ARG 126 HB3 ARG 126 -1.223 -15.489 2.324 1037 1HG ARG 126 HG2 ARG 126 -3.550 -15.029 3.345 1038 2HG ARG 126 HG3 ARG 126 -4.006 -14.482 1.731 1039 1HD ARG 126 HD2 ARG 126 -3.352 -16.653 0.790 1040 2HD ARG 126 HD3 ARG 126 -2.840 -17.204 2.384 1041 HE ARG 126 HE ARG 126 -5.146 -17.380 3.027 1042 1HH1 ARG 126 HH11 ARG 126 -5.323 -18.485 0.222 1043 2HH1 ARG 126 HH12 ARG 126 -6.674 -17.609 -0.416 1044 1HH2 ARG 126 HH21 ARG 126 -6.617 -15.191 2.069 1045 2HH2 ARG 126 HH22 ARG 126 -7.410 -15.746 0.632 1046 H LYS 127 H LYS 127 0.591 -14.691 3.332 1047 HA LYS 127 HA LYS 127 0.072 -15.455 6.047 1048 1HB LYS 127 HB2 LYS 127 2.487 -16.001 6.129 1049 2HB LYS 127 HB3 LYS 127 1.734 -16.624 4.660 1050 1HG LYS 127 HG2 LYS 127 2.484 -14.446 3.535 1051 2HG LYS 127 HG3 LYS 127 3.493 -14.183 4.958 1052 1HD LYS 127 HD2 LYS 127 3.894 -16.876 4.134 1053 2HD LYS 127 HD3 LYS 127 4.016 -15.866 2.693 1054 1HE LYS 127 HE2 LYS 127 5.462 -15.232 5.276 1055 2HE LYS 127 HE3 LYS 127 6.188 -16.173 3.974 1056 1HZ LYS 127 HZ1 LYS 127 5.067 -13.443 3.654 1057 2HZ LYS 127 HZ2 LYS 127 6.718 -13.786 3.859 1058 3HZ LYS 127 HZ3 LYS 127 5.904 -14.341 2.479 1059 H SER 128 H SER 128 1.604 -12.627 4.599 1060 HA SER 128 HA SER 128 2.775 -11.561 6.975 1061 1HB SER 128 HB2 SER 128 1.581 -9.720 4.940 1062 2HB SER 128 HB3 SER 128 3.143 -9.632 5.745 1063 HG SER 128 HG SER 128 3.729 -10.385 3.834 1064 H GLU 129 H GLU 129 -0.416 -10.922 5.481 1065 HA GLU 129 HA GLU 129 -1.375 -9.178 7.516 1066 1HB GLU 129 HB2 GLU 129 -2.435 -9.677 5.236 1067 2HB GLU 129 HB3 GLU 129 -3.105 -11.128 5.981 1068 1HG GLU 129 HG2 GLU 129 -3.522 -8.786 7.657 1069 2HG GLU 129 HG3 GLU 129 -4.222 -8.565 6.053 1070 H ALA 130 H ALA 130 -1.768 -12.715 7.144 1071 HA ALA 130 HA ALA 130 -3.270 -13.198 9.479 1072 1HB ALA 130 HB1 ALA 130 -2.548 -14.864 7.653 1073 2HB ALA 130 HB2 ALA 130 -1.043 -15.020 8.559 1074 3HB ALA 130 HB3 ALA 130 -2.575 -15.464 9.312 1075 H GLN 131 H GLN 131 0.167 -12.559 9.086 1076 HA GLN 131 HA GLN 131 0.966 -13.328 11.739 1077 1HB GLN 131 HB2 GLN 131 2.626 -12.995 9.969 1078 2HB GLN 131 HB3 GLN 131 2.169 -11.296 9.831 1079 1HG GLN 131 HG2 GLN 131 2.968 -10.819 12.050 1080 2HG GLN 131 HG3 GLN 131 3.200 -12.532 12.396 1081 1HE2 GLN 131 HE21 GLN 131 5.204 -10.207 12.250 1082 2HE2 GLN 131 HE22 GLN 131 6.401 -10.760 11.182 1083 H ALA 132 H ALA 132 -0.093 -10.245 10.312 1084 HA ALA 132 HA ALA 132 0.168 -8.737 12.762 1085 1HB ALA 132 HB1 ALA 132 -1.235 -8.326 10.134 1086 2HB ALA 132 HB2 ALA 132 -1.591 -7.251 11.485 1087 3HB ALA 132 HB3 ALA 132 0.056 -7.372 10.864 1088 H LYS 133 H LYS 133 -2.156 -10.973 11.525 1089 HA LYS 133 HA LYS 133 -4.425 -10.093 13.086 1090 1HB LYS 133 HB2 LYS 133 -4.107 -11.880 11.057 1091 2HB LYS 133 HB3 LYS 133 -4.186 -12.977 12.437 1092 1HG LYS 133 HG2 LYS 133 -6.225 -11.309 13.061 1093 2HG LYS 133 HG3 LYS 133 -6.286 -11.215 11.300 1094 1HD LYS 133 HD2 LYS 133 -6.184 -13.836 12.813 1095 2HD LYS 133 HD3 LYS 133 -7.691 -13.068 12.312 1096 1HE LYS 133 HE2 LYS 133 -6.131 -13.010 10.009 1097 2HE LYS 133 HE3 LYS 133 -5.768 -14.583 10.719 1098 1HZ LYS 133 HZ1 LYS 133 -8.520 -13.548 10.317 1099 2HZ LYS 133 HZ2 LYS 133 -7.722 -14.566 9.213 1100 3HZ LYS 133 HZ3 LYS 133 -8.071 -15.116 10.783 1101 H LYS 134 H LYS 134 -2.273 -12.932 13.494 1102 HA LYS 134 HA LYS 134 -3.152 -13.413 16.201 1103 1HB LYS 134 HB2 LYS 134 -1.193 -14.546 14.331 1104 2HB LYS 134 HB3 LYS 134 -0.639 -14.566 16.006 1105 1HG LYS 134 HG2 LYS 134 -3.455 -15.382 15.605 1106 2HG LYS 134 HG3 LYS 134 -2.251 -16.479 14.930 1107 1HD LYS 134 HD2 LYS 134 -1.216 -15.799 17.430 1108 2HD LYS 134 HD3 LYS 134 -2.946 -15.997 17.720 1109 1HE LYS 134 HE2 LYS 134 -2.356 -18.205 17.902 1110 2HE LYS 134 HE3 LYS 134 -2.514 -18.147 16.146 1111 1HZ LYS 134 HZ1 LYS 134 -0.103 -17.526 16.098 1112 2HZ LYS 134 HZ2 LYS 134 -0.034 -17.915 17.750 1113 3HZ LYS 134 HZ3 LYS 134 -0.428 -19.111 16.615 1114 H GLU 135 H GLU 135 -1.012 -11.150 14.795 1115 HA GLU 135 HA GLU 135 0.675 -10.806 17.164 1116 1HB GLU 135 HB2 GLU 135 0.450 -9.560 14.468 1117 2HB GLU 135 HB3 GLU 135 1.122 -8.554 15.752 1118 1HG GLU 135 HG2 GLU 135 2.568 -10.684 16.280 1119 2HG GLU 135 HG3 GLU 135 2.176 -11.128 14.619 1120 H LYS 136 H LYS 136 -2.282 -9.439 15.868 1121 HA LYS 136 HA LYS 136 -3.790 -7.901 16.800 1122 1HB LYS 136 HB2 LYS 136 -2.265 -8.824 19.239 1123 2HB LYS 136 HB3 LYS 136 -3.565 -7.637 19.353 1124 1HG LYS 136 HG2 LYS 136 -5.176 -9.198 19.015 1125 2HG LYS 136 HG3 LYS 136 -4.257 -9.994 17.736 1126 1HD LYS 136 HD2 LYS 136 -4.064 -11.654 19.298 1127 2HD LYS 136 HD3 LYS 136 -2.732 -10.651 19.874 1128 1HE LYS 136 HE2 LYS 136 -4.414 -9.463 21.360 1129 2HE LYS 136 HE3 LYS 136 -5.571 -10.721 20.922 1130 1HZ LYS 136 HZ1 LYS 136 -2.894 -11.319 22.041 1131 2HZ LYS 136 HZ2 LYS 136 -4.268 -11.114 23.012 1132 3HZ LYS 136 HZ3 LYS 136 -4.215 -12.374 21.874 1133 H LEU 137 H LEU 137 -2.000 -6.568 15.424 1134 HA LEU 137 HA LEU 137 -0.680 -4.597 17.219 1135 1HB LEU 137 HB2 LEU 137 -0.011 -5.763 14.686 1136 2HB LEU 137 HB3 LEU 137 -0.170 -4.019 14.479 1137 HG LEU 137 HG LEU 137 1.336 -5.067 16.850 1138 1HD1 LEU 137 HD11 LEU 137 2.033 -6.031 14.427 1139 2HD1 LEU 137 HD12 LEU 137 2.880 -4.485 14.375 1140 3HD1 LEU 137 HD13 LEU 137 3.220 -5.634 15.669 1141 1HD2 LEU 137 HD21 LEU 137 0.825 -2.547 15.547 1142 2HD2 LEU 137 HD22 LEU 137 1.654 -2.848 17.074 1143 3HD2 LEU 137 HD23 LEU 137 2.560 -2.859 15.562 1144 H ASN 138 H ASN 138 -1.648 -2.670 17.555 1145 HA ASN 138 HA ASN 138 -3.283 -0.984 17.384 1146 1HB ASN 138 HB2 ASN 138 -2.383 -1.250 14.499 1147 2HB ASN 138 HB3 ASN 138 -3.270 0.126 15.158 1148 1HD2 ASN 138 HD21 ASN 138 -0.146 -1.040 14.555 1149 2HD2 ASN 138 HD22 ASN 138 0.711 -0.004 15.591 1150 H ILE 139 H ILE 139 -4.034 -1.952 14.108 1151 HA ILE 139 HA ILE 139 -6.810 -2.042 14.464 1152 HB ILE 139 HB ILE 139 -5.112 -3.631 12.519 1153 1HG1 ILE 139 HG12 ILE 139 -6.684 -1.206 11.768 1154 2HG1 ILE 139 HG13 ILE 139 -5.204 -0.955 12.697 1155 1HG2 ILE 139 HG21 ILE 139 -8.081 -3.052 12.635 1156 2HG2 ILE 139 HG22 ILE 139 -7.263 -3.584 11.165 1157 3HG2 ILE 139 HG23 ILE 139 -7.292 -4.630 12.585 1158 1HD1 ILE 139 HD11 ILE 139 -5.218 -2.747 10.273 1159 2HD1 ILE 139 HD12 ILE 139 -5.017 -1.002 10.108 1160 3HD1 ILE 139 HD13 ILE 139 -3.850 -1.941 11.038 1161 H TRP 140 H TRP 140 -4.790 -4.968 14.062 1162 HA TRP 140 HA TRP 140 -6.825 -6.713 15.101 1163 1HB TRP 140 HB2 TRP 140 -3.856 -7.286 15.032 1164 2HB TRP 140 HB3 TRP 140 -5.184 -8.443 14.928 1165 HD1 TRP 140 HD1 TRP 140 -2.973 -6.319 12.834 1166 HE1 TRP 140 HE1 TRP 140 -3.721 -6.409 10.368 1167 HE3 TRP 140 HE3 TRP 140 -7.507 -8.605 13.371 1168 HZ2 TRP 140 HZ2 TRP 140 -5.948 -7.330 8.828 1169 HZ3 TRP 140 HZ3 TRP 140 -8.920 -9.076 11.389 1170 HH2 TRP 140 HH2 TRP 140 -8.147 -8.442 9.121 1171 H SER 141 H SER 141 -4.871 -4.489 16.679 1172 HA SER 141 HA SER 141 -4.568 -6.080 19.147 1173 1HB SER 141 HB2 SER 141 -3.177 -4.379 19.908 1174 2HB SER 141 HB3 SER 141 -2.952 -4.228 18.168 1175 HG SER 141 HG SER 141 -4.146 -2.531 19.956 1176 H GLU 142 H GLU 142 -7.264 -5.639 18.233 1177 HA GLU 142 HA GLU 142 -8.403 -3.489 19.867 1178 1HB GLU 142 HB2 GLU 142 -9.535 -5.643 18.090 1179 2HB GLU 142 HB3 GLU 142 -10.589 -4.713 19.155 1180 1HG GLU 142 HG2 GLU 142 -8.722 -3.002 17.705 1181 2HG GLU 142 HG3 GLU 142 -9.740 -3.942 16.614 1182 H ASP 143 H ASP 143 -9.799 -6.714 19.842 1183 HA ASP 143 HA ASP 143 -10.402 -6.715 22.612 1184 1HB ASP 143 HB2 ASP 143 -10.493 -8.634 20.401 1185 2HB ASP 143 HB3 ASP 143 -10.162 -9.400 21.955 1186 H ASN 144 H ASN 144 -9.422 -7.962 24.347 1187 HA ASN 144 HA ASN 144 -6.686 -8.979 23.926 1188 1HB ASN 144 HB2 ASN 144 -6.574 -6.450 24.387 1189 2HB ASN 144 HB3 ASN 144 -7.139 -6.838 26.013 1190 1HD2 ASN 144 HD21 ASN 144 -5.778 -8.813 27.012 1191 2HD2 ASN 144 HD22 ASN 144 -4.098 -8.692 26.806 1192 H ALA 145 H ALA 145 -8.843 -7.947 26.601 1193 HA ALA 145 HA ALA 145 -9.096 -10.732 27.496 1194 1HB ALA 145 HB1 ALA 145 -7.671 -8.657 29.191 1195 2HB ALA 145 HB2 ALA 145 -8.210 -10.231 29.777 1196 3HB ALA 145 HB3 ALA 145 -6.964 -10.132 28.531 1197 H ASP 146 H ASP 146 -10.253 -10.486 29.885 1198 HA ASP 146 HA ASP 146 -12.518 -8.613 29.368 1199 1HB ASP 146 HB2 ASP 146 -12.420 -11.358 30.096 1200 2HB ASP 146 HB3 ASP 146 -13.058 -10.480 31.486 1201 H SER 147 H SER 147 -11.139 -10.096 32.321 1202 HA SER 147 HA SER 147 -11.858 -8.043 34.093 1203 1HB SER 147 HB2 SER 147 -10.861 -10.262 34.732 1204 2HB SER 147 HB3 SER 147 -9.290 -9.649 34.226 1205 HG SER 147 HG SER 147 -9.234 -8.938 36.212 1206 H GLY 148 H GLY 148 -11.527 -5.959 33.244 1207 1HA GLY 148 HA2 GLY 148 -8.945 -5.146 32.167 1208 2HA GLY 148 HA3 GLY 148 -10.307 -4.076 32.507 1209 H GLN 149 H GLN 149 -7.205 -4.724 33.432 1210 HA GLN 149 HA GLN 149 -7.412 -3.052 35.793 1211 1HB GLN 149 HB2 GLN 149 -8.067 -5.590 36.384 1212 2HB GLN 149 HB3 GLN 149 -6.312 -5.735 36.485 1213 1HG GLN 149 HG2 GLN 149 -6.567 -4.950 38.600 1214 2HG GLN 149 HG3 GLN 149 -6.762 -3.377 37.826 1215 1HE2 GLN 149 HE21 GLN 149 -8.455 -5.954 39.509 1216 2HE2 GLN 149 HE22 GLN 149 -9.966 -5.185 39.563 1217 HN3 PTP 150 H3 PTP 150 -7.950 -2.710 -7.764 1218 1H5M PTP 150 H51 PTP 150 -6.290 0.723 -4.780 1219 2H5M PTP 150 H52 PTP 150 -6.859 -0.500 -3.619 1220 3H5M PTP 150 H53 PTP 150 -7.763 1.018 -3.825 1221 H6 PTP 150 H6 PTP 150 -9.672 0.847 -5.028 1222 H1* PTP 150 H1' PTP 150 -11.686 -0.217 -7.891 1223 2H2* PTP 150 H2' PTP 150 -11.967 -1.189 -5.055 1224 H3* PTP 150 H3' PTP 150 -13.709 0.350 -4.568 1225 H4* PTP 150 H4' PTP 150 -13.024 2.536 -6.070 1226 2H5* PTP 150 H5' PTP 150 -11.557 1.153 -3.754 Start of MODEL 21 1 1H ALA 1 H1 ALA 1 4.052 -20.648 -22.629 2 2H ALA 1 H2 ALA 1 2.585 -20.670 -21.773 3 3H ALA 1 H3 ALA 1 2.577 -20.703 -23.469 4 HA ALA 1 HA ALA 1 2.057 -18.509 -23.008 5 1HB ALA 1 HB1 ALA 1 2.967 -19.030 -20.523 6 2HB ALA 1 HB2 ALA 1 4.325 -18.081 -21.128 7 3HB ALA 1 HB3 ALA 1 2.703 -17.388 -21.110 8 H THR 2 H THR 2 3.356 -16.482 -23.591 9 HA THR 2 HA THR 2 5.630 -17.304 -25.341 10 HB THR 2 HB THR 2 5.148 -15.339 -26.665 11 HG1 THR 2 HG1 THR 2 4.556 -13.760 -25.371 12 1HG2 THR 2 HG21 THR 2 2.986 -17.216 -25.936 13 2HG2 THR 2 HG22 THR 2 2.453 -15.750 -26.758 14 3HG2 THR 2 HG23 THR 2 3.638 -16.809 -27.524 15 H SER 3 H SER 3 5.303 -16.227 -22.323 16 HA SER 3 HA SER 3 7.931 -14.980 -22.295 17 1HB SER 3 HB2 SER 3 5.996 -13.132 -21.068 18 2HB SER 3 HB3 SER 3 7.406 -12.784 -22.066 19 HG SER 3 HG SER 3 6.211 -13.026 -23.857 20 H THR 4 H THR 4 8.470 -16.507 -20.714 21 HA THR 4 HA THR 4 6.785 -16.631 -18.271 22 HB THR 4 HB THR 4 9.238 -18.269 -18.397 23 HG1 THR 4 HG1 THR 4 8.819 -18.575 -20.483 24 1HG2 THR 4 HG21 THR 4 6.449 -18.406 -17.458 25 2HG2 THR 4 HG22 THR 4 7.080 -19.926 -18.089 26 3HG2 THR 4 HG23 THR 4 7.907 -19.111 -16.762 27 H LYS 5 H LYS 5 7.578 -14.312 -17.869 28 HA LYS 5 HA LYS 5 10.207 -14.418 -16.440 29 1HB LYS 5 HB2 LYS 5 9.159 -12.525 -18.418 30 2HB LYS 5 HB3 LYS 5 9.724 -11.735 -16.945 31 1HG LYS 5 HG2 LYS 5 11.909 -12.554 -17.188 32 2HG LYS 5 HG3 LYS 5 11.402 -13.861 -18.259 33 1HD LYS 5 HD2 LYS 5 11.831 -12.563 -20.044 34 2HD LYS 5 HD3 LYS 5 10.640 -11.393 -19.475 35 1HE LYS 5 HE2 LYS 5 12.781 -10.267 -19.694 36 2HE LYS 5 HE3 LYS 5 12.397 -10.413 -17.979 37 1HZ LYS 5 HZ1 LYS 5 13.862 -12.638 -19.116 38 2HZ LYS 5 HZ2 LYS 5 14.716 -11.174 -19.060 39 3HZ LYS 5 HZ3 LYS 5 14.075 -11.838 -17.633 40 H LYS 6 H LYS 6 10.010 -12.008 -15.073 41 HA LYS 6 HA LYS 6 7.629 -12.507 -13.332 42 1HB LYS 6 HB2 LYS 6 10.354 -12.494 -12.675 43 2HB LYS 6 HB3 LYS 6 9.742 -10.948 -12.084 44 1HG LYS 6 HG2 LYS 6 7.733 -12.659 -11.332 45 2HG LYS 6 HG3 LYS 6 9.159 -13.680 -11.144 46 1HD LYS 6 HD2 LYS 6 10.191 -12.130 -9.646 47 2HD LYS 6 HD3 LYS 6 9.014 -10.872 -10.028 48 1HE LYS 6 HE2 LYS 6 7.835 -11.591 -8.242 49 2HE LYS 6 HE3 LYS 6 7.455 -13.030 -9.187 50 1HZ LYS 6 HZ1 LYS 6 9.476 -14.064 -8.339 51 2HZ LYS 6 HZ2 LYS 6 9.803 -12.688 -7.403 52 3HZ LYS 6 HZ3 LYS 6 8.428 -13.630 -7.074 53 H LEU 7 H LEU 7 8.133 -10.043 -11.828 54 HA LEU 7 HA LEU 7 6.753 -8.200 -13.653 55 1HB LEU 7 HB2 LEU 7 7.528 -8.013 -10.729 56 2HB LEU 7 HB3 LEU 7 6.681 -6.731 -11.596 57 HG LEU 7 HG LEU 7 5.704 -9.583 -11.271 58 1HD1 LEU 7 HD11 LEU 7 5.330 -7.091 -9.736 59 2HD1 LEU 7 HD12 LEU 7 3.831 -7.920 -10.155 60 3HD1 LEU 7 HD13 LEU 7 5.081 -8.766 -9.241 61 1HD2 LEU 7 HD21 LEU 7 4.677 -7.175 -12.768 62 2HD2 LEU 7 HD22 LEU 7 4.837 -8.838 -13.333 63 3HD2 LEU 7 HD23 LEU 7 3.564 -8.415 -12.188 64 H HIS 8 H HIS 8 7.527 -5.787 -13.436 65 HA HIS 8 HA HIS 8 10.505 -5.737 -13.723 66 1HB HIS 8 HB2 HIS 8 9.460 -5.505 -15.917 67 2HB HIS 8 HB3 HIS 8 8.410 -4.225 -15.314 68 HD1 HIS 8 HD1 HIS 8 12.130 -4.586 -14.630 69 HD2 HIS 8 HD2 HIS 8 9.511 -2.048 -16.644 70 HE1 HIS 8 HE1 HIS 8 13.508 -2.607 -15.408 71 H LYS 9 H LYS 9 11.448 -4.370 -12.284 72 HA LYS 9 HA LYS 9 9.714 -2.427 -10.854 73 1HB LYS 9 HB2 LYS 9 12.497 -3.483 -10.289 74 2HB LYS 9 HB3 LYS 9 11.705 -2.242 -9.316 75 1HG LYS 9 HG2 LYS 9 9.759 -4.195 -9.490 76 2HG LYS 9 HG3 LYS 9 11.243 -5.142 -9.379 77 1HD LYS 9 HD2 LYS 9 11.719 -3.242 -7.484 78 2HD LYS 9 HD3 LYS 9 9.965 -3.395 -7.362 79 1HE LYS 9 HE2 LYS 9 10.098 -5.465 -6.450 80 2HE LYS 9 HE3 LYS 9 11.339 -5.979 -7.592 81 1HZ LYS 9 HZ1 LYS 9 12.882 -4.497 -6.245 82 2HZ LYS 9 HZ2 LYS 9 11.673 -4.510 -5.051 83 3HZ LYS 9 HZ3 LYS 9 12.401 -5.964 -5.535 84 H GLU 10 H GLU 10 9.973 -0.239 -11.089 85 HA GLU 10 HA GLU 10 12.319 0.708 -12.683 86 1HB GLU 10 HB2 GLU 10 9.802 2.262 -12.915 87 2HB GLU 10 HB3 GLU 10 10.998 1.868 -14.149 88 1HG GLU 10 HG2 GLU 10 10.131 -0.477 -14.181 89 2HG GLU 10 HG3 GLU 10 8.865 0.013 -13.054 90 HA PRO 11 HA PRO 11 12.824 3.832 -9.628 91 1HB PRO 11 HB2 PRO 11 13.400 6.055 -11.106 92 2HB PRO 11 HB3 PRO 11 14.514 4.691 -10.931 93 1HG PRO 11 HG2 PRO 11 12.807 5.446 -13.255 94 2HG PRO 11 HG3 PRO 11 14.377 4.627 -13.232 95 1HD PRO 11 HD2 PRO 11 11.895 3.370 -13.592 96 2HD PRO 11 HD3 PRO 11 13.409 2.551 -13.146 97 H ALA 12 H ALA 12 11.995 5.899 -8.744 98 HA ALA 12 HA ALA 12 9.632 7.115 -9.979 99 1HB ALA 12 HB1 ALA 12 9.425 5.103 -7.800 100 2HB ALA 12 HB2 ALA 12 8.459 6.566 -7.601 101 3HB ALA 12 HB3 ALA 12 8.244 5.556 -9.030 102 H THR 13 H THR 13 8.833 8.956 -8.572 103 HA THR 13 HA THR 13 11.021 9.889 -6.743 104 HB THR 13 HB THR 13 9.317 11.774 -8.362 105 HG1 THR 13 HG1 THR 13 11.466 10.186 -9.152 106 1HG2 THR 13 HG21 THR 13 11.486 11.960 -6.469 107 2HG2 THR 13 HG22 THR 13 11.980 12.648 -8.015 108 3HG2 THR 13 HG23 THR 13 10.541 13.257 -7.198 109 H LEU 14 H LEU 14 10.362 10.901 -4.832 110 HA LEU 14 HA LEU 14 7.534 10.472 -4.098 111 1HB LEU 14 HB2 LEU 14 9.332 9.807 -2.524 112 2HB LEU 14 HB3 LEU 14 9.861 11.487 -2.435 113 HG LEU 14 HG LEU 14 7.660 12.147 -1.552 114 1HD1 LEU 14 HD11 LEU 14 7.073 9.182 -1.796 115 2HD1 LEU 14 HD12 LEU 14 6.066 10.317 -0.896 116 3HD1 LEU 14 HD13 LEU 14 6.254 10.496 -2.642 117 1HD2 LEU 14 HD21 LEU 14 9.646 10.822 -0.197 118 2HD2 LEU 14 HD22 LEU 14 8.253 11.583 0.573 119 3HD2 LEU 14 HD23 LEU 14 8.231 9.855 0.219 120 H ILE 15 H ILE 15 6.298 12.106 -5.001 121 HA ILE 15 HA ILE 15 7.229 14.889 -4.960 122 HB ILE 15 HB ILE 15 4.459 13.875 -5.647 123 1HG1 ILE 15 HG12 ILE 15 6.902 14.139 -7.433 124 2HG1 ILE 15 HG13 ILE 15 6.137 12.624 -6.953 125 1HG2 ILE 15 HG21 ILE 15 6.063 16.333 -6.408 126 2HG2 ILE 15 HG22 ILE 15 4.507 15.906 -7.119 127 3HG2 ILE 15 HG23 ILE 15 4.616 16.287 -5.401 128 1HD1 ILE 15 HD11 ILE 15 3.977 13.616 -7.969 129 2HD1 ILE 15 HD12 ILE 15 5.041 14.789 -8.745 130 3HD1 ILE 15 HD13 ILE 15 5.224 13.069 -9.088 131 H LYS 16 H LYS 16 4.352 13.221 -3.617 132 HA LYS 16 HA LYS 16 4.675 14.513 -1.037 133 1HB LYS 16 HB2 LYS 16 3.793 16.422 -2.337 134 2HB LYS 16 HB3 LYS 16 2.411 15.445 -2.829 135 1HG LYS 16 HG2 LYS 16 2.559 15.215 -0.018 136 2HG LYS 16 HG3 LYS 16 2.794 16.926 -0.380 137 1HD LYS 16 HD2 LYS 16 0.607 15.401 -1.766 138 2HD LYS 16 HD3 LYS 16 0.353 15.992 -0.124 139 1HE LYS 16 HE2 LYS 16 0.485 18.225 -0.760 140 2HE LYS 16 HE3 LYS 16 1.465 17.868 -2.183 141 1HZ LYS 16 HZ1 LYS 16 -0.495 16.786 -3.166 142 2HZ LYS 16 HZ2 LYS 16 -1.423 17.278 -1.830 143 3HZ LYS 16 HZ3 LYS 16 -0.746 18.439 -2.865 144 H ALA 17 H ALA 17 4.066 12.825 0.227 145 HA ALA 17 HA ALA 17 2.189 10.808 -0.714 146 1HB ALA 17 HB1 ALA 17 4.110 10.297 0.804 147 2HB ALA 17 HB2 ALA 17 3.309 11.222 2.074 148 3HB ALA 17 HB3 ALA 17 2.563 9.750 1.450 149 H ILE 18 H ILE 18 0.145 10.309 0.346 150 HA ILE 18 HA ILE 18 -1.093 12.696 1.661 151 HB ILE 18 HB ILE 18 -2.551 10.668 -0.051 152 1HG1 ILE 18 HG12 ILE 18 -2.151 13.360 -1.158 153 2HG1 ILE 18 HG13 ILE 18 -0.651 12.446 -0.992 154 1HG2 ILE 18 HG21 ILE 18 -3.411 12.672 1.718 155 2HG2 ILE 18 HG22 ILE 18 -3.621 13.361 0.108 156 3HG2 ILE 18 HG23 ILE 18 -4.395 11.831 0.520 157 1HD1 ILE 18 HD11 ILE 18 -3.091 11.159 -2.198 158 2HD1 ILE 18 HD12 ILE 18 -2.036 12.170 -3.184 159 3HD1 ILE 18 HD13 ILE 18 -1.396 10.723 -2.406 160 H ASP 19 H ASP 19 -1.202 9.144 1.360 161 HA ASP 19 HA ASP 19 -1.880 9.005 4.244 162 1HB ASP 19 HB2 ASP 19 -3.533 7.873 1.986 163 2HB ASP 19 HB3 ASP 19 -3.575 7.155 3.597 164 H GLY 20 H GLY 20 -2.082 6.357 4.630 165 1HA GLY 20 HA2 GLY 20 0.612 5.408 4.018 166 2HA GLY 20 HA3 GLY 20 -0.597 4.547 4.972 167 H ASP 21 H ASP 21 -2.254 5.386 2.300 168 HA ASP 21 HA ASP 21 -1.366 2.976 0.766 169 1HB ASP 21 HB2 ASP 21 -3.997 3.634 1.920 170 2HB ASP 21 HB3 ASP 21 -4.055 3.156 0.223 171 H THR 22 H THR 22 -1.372 6.177 0.638 172 HA THR 22 HA THR 22 -1.717 6.195 -2.308 173 HB THR 22 HB THR 22 -2.901 8.420 -0.650 174 HG1 THR 22 HG1 THR 22 -4.691 7.321 -0.417 175 1HG2 THR 22 HG21 THR 22 -3.093 7.461 -3.502 176 2HG2 THR 22 HG22 THR 22 -4.302 8.546 -2.813 177 3HG2 THR 22 HG23 THR 22 -2.615 9.053 -2.910 178 H VAL 23 H VAL 23 -0.175 7.488 -3.289 179 HA VAL 23 HA VAL 23 1.144 9.639 -1.799 180 HB VAL 23 HB VAL 23 3.439 8.565 -2.202 181 1HG1 VAL 23 HG11 VAL 23 1.895 8.646 -0.017 182 2HG1 VAL 23 HG12 VAL 23 1.931 6.898 -0.237 183 3HG1 VAL 23 HG13 VAL 23 3.437 7.791 -0.028 184 1HG2 VAL 23 HG21 VAL 23 2.250 6.749 -3.675 185 2HG2 VAL 23 HG22 VAL 23 3.584 6.263 -2.629 186 3HG2 VAL 23 HG23 VAL 23 1.919 5.967 -2.129 187 H LYS 24 H LYS 24 1.531 11.207 -3.275 188 HA LYS 24 HA LYS 24 1.324 10.639 -6.130 189 1HB LYS 24 HB2 LYS 24 2.107 13.191 -4.684 190 2HB LYS 24 HB3 LYS 24 1.701 13.065 -6.396 191 1HG LYS 24 HG2 LYS 24 -0.548 12.147 -5.710 192 2HG LYS 24 HG3 LYS 24 -0.129 12.537 -4.041 193 1HD LYS 24 HD2 LYS 24 0.132 14.897 -4.618 194 2HD LYS 24 HD3 LYS 24 -0.174 14.540 -6.318 195 1HE LYS 24 HE2 LYS 24 -2.397 13.466 -5.353 196 2HE LYS 24 HE3 LYS 24 -2.087 14.572 -4.015 197 1HZ LYS 24 HZ1 LYS 24 -1.769 16.308 -5.843 198 2HZ LYS 24 HZ2 LYS 24 -2.568 15.204 -6.856 199 3HZ LYS 24 HZ3 LYS 24 -3.356 15.815 -5.484 200 H LEU 25 H LEU 25 3.042 9.791 -7.228 201 HA LEU 25 HA LEU 25 5.772 10.711 -6.413 202 1HB LEU 25 HB2 LEU 25 5.442 8.127 -7.871 203 2HB LEU 25 HB3 LEU 25 6.619 8.580 -6.641 204 HG LEU 25 HG LEU 25 3.679 8.129 -6.066 205 1HD1 LEU 25 HD11 LEU 25 5.227 6.124 -6.838 206 2HD1 LEU 25 HD12 LEU 25 5.857 6.261 -5.196 207 3HD1 LEU 25 HD13 LEU 25 4.144 5.934 -5.459 208 1HD2 LEU 25 HD21 LEU 25 6.123 8.438 -4.293 209 2HD2 LEU 25 HD22 LEU 25 4.818 9.611 -4.478 210 3HD2 LEU 25 HD23 LEU 25 4.502 8.051 -3.717 211 H MET 26 H MET 26 7.294 9.990 -8.452 212 HA MET 26 HA MET 26 5.997 11.167 -10.876 213 1HB MET 26 HB2 MET 26 7.892 12.456 -9.519 214 2HB MET 26 HB3 MET 26 8.950 11.380 -10.432 215 1HG MET 26 HG2 MET 26 8.078 12.177 -12.532 216 2HG MET 26 HG3 MET 26 6.799 13.079 -11.719 217 1HE MET 26 HE1 MET 26 6.709 14.935 -10.988 218 2HE MET 26 HE2 MET 26 7.882 15.469 -9.776 219 3HE MET 26 HE3 MET 26 7.793 16.279 -11.338 220 H TYR 27 H TYR 27 5.763 9.541 -12.326 221 HA TYR 27 HA TYR 27 7.945 7.506 -12.520 222 1HB TYR 27 HB2 TYR 27 5.923 6.415 -11.815 223 2HB TYR 27 HB3 TYR 27 4.965 7.284 -13.014 224 HD1 TYR 27 HD1 TYR 27 7.810 4.876 -12.692 225 HD2 TYR 27 HD2 TYR 27 4.621 6.368 -15.153 226 HE1 TYR 27 HE1 TYR 27 8.238 3.072 -14.339 227 HE2 TYR 27 HE2 TYR 27 5.049 4.564 -16.800 228 HH TYR 27 HH TYR 27 6.164 2.669 -17.200 229 H LYS 28 H LYS 28 8.931 7.303 -14.496 230 HA LYS 28 HA LYS 28 9.549 7.947 -16.672 231 1HB LYS 28 HB2 LYS 28 6.659 7.216 -16.750 232 2HB LYS 28 HB3 LYS 28 7.331 8.004 -18.178 233 1HG LYS 28 HG2 LYS 28 9.226 6.061 -17.343 234 2HG LYS 28 HG3 LYS 28 7.647 5.275 -17.326 235 1HD LYS 28 HD2 LYS 28 7.232 6.047 -19.630 236 2HD LYS 28 HD3 LYS 28 8.807 6.841 -19.651 237 1HE LYS 28 HE2 LYS 28 9.658 4.425 -18.952 238 2HE LYS 28 HE3 LYS 28 8.157 3.920 -19.727 239 1HZ LYS 28 HZ1 LYS 28 9.297 5.809 -21.391 240 2HZ LYS 28 HZ2 LYS 28 10.569 4.791 -20.920 241 3HZ LYS 28 HZ3 LYS 28 9.188 4.135 -21.659 242 H GLY 29 H GLY 29 9.114 10.144 -14.855 243 1HA GLY 29 HA2 GLY 29 8.986 12.484 -14.972 244 2HA GLY 29 HA3 GLY 29 9.003 12.311 -16.728 245 H GLN 30 H GLN 30 6.633 11.168 -14.305 246 HA GLN 30 HA GLN 30 4.641 13.075 -15.363 247 1HB GLN 30 HB2 GLN 30 4.520 11.073 -16.853 248 2HB GLN 30 HB3 GLN 30 4.159 10.083 -15.437 249 1HG GLN 30 HG2 GLN 30 2.044 10.980 -15.174 250 2HG GLN 30 HG3 GLN 30 2.493 12.523 -15.904 251 1HE2 GLN 30 HE21 GLN 30 1.377 9.252 -16.604 252 2HE2 GLN 30 HE22 GLN 30 1.104 9.502 -18.260 253 HA PRO 31 HA PRO 31 3.814 12.759 -10.960 254 1HB PRO 31 HB2 PRO 31 1.955 14.766 -10.910 255 2HB PRO 31 HB3 PRO 31 3.701 15.068 -10.972 256 1HG PRO 31 HG2 PRO 31 1.679 15.209 -13.179 257 2HG PRO 31 HG3 PRO 31 3.099 16.229 -12.888 258 1HD PRO 31 HD2 PRO 31 3.036 14.185 -14.747 259 2HD PRO 31 HD3 PRO 31 4.525 14.779 -13.978 260 H MET 32 H MET 32 2.348 11.406 -9.958 261 HA MET 32 HA MET 32 -0.458 11.325 -10.777 262 1HB MET 32 HB2 MET 32 1.449 9.474 -11.930 263 2HB MET 32 HB3 MET 32 0.257 8.607 -10.961 264 1HG MET 32 HG2 MET 32 -1.565 9.726 -12.172 265 2HG MET 32 HG3 MET 32 -0.391 10.635 -13.123 266 1HE MET 32 HE1 MET 32 -1.174 7.384 -11.689 267 2HE MET 32 HE2 MET 32 -1.299 6.220 -13.005 268 3HE MET 32 HE3 MET 32 0.277 6.581 -12.306 269 H THR 33 H THR 33 -1.730 9.979 -9.333 270 HA THR 33 HA THR 33 -0.425 9.687 -6.685 271 HB THR 33 HB THR 33 -3.335 9.616 -7.540 272 HG1 THR 33 HG1 THR 33 -3.048 11.524 -5.938 273 1HG2 THR 33 HG21 THR 33 -1.961 9.018 -4.959 274 2HG2 THR 33 HG22 THR 33 -3.487 9.900 -4.900 275 3HG2 THR 33 HG23 THR 33 -3.419 8.303 -5.645 276 H PHE 34 H PHE 34 0.335 7.694 -6.166 277 HA PHE 34 HA PHE 34 -0.737 5.332 -7.601 278 1HB PHE 34 HB2 PHE 34 1.747 5.918 -6.028 279 2HB PHE 34 HB3 PHE 34 1.211 4.245 -6.186 280 HD1 PHE 34 HD1 PHE 34 2.260 7.264 -8.067 281 HD2 PHE 34 HD2 PHE 34 1.360 3.070 -8.272 282 HE1 PHE 34 HE1 PHE 34 3.214 7.172 -10.355 283 HE2 PHE 34 HE2 PHE 34 2.312 2.976 -10.560 284 HZ PHE 34 HZ PHE 34 3.240 5.027 -11.601 285 H ARG 35 H ARG 35 -1.247 3.373 -6.348 286 HA ARG 35 HA ARG 35 -2.065 3.906 -3.529 287 1HB ARG 35 HB2 ARG 35 -3.980 4.061 -5.285 288 2HB ARG 35 HB3 ARG 35 -3.808 2.310 -5.405 289 1HG ARG 35 HG2 ARG 35 -5.239 2.240 -3.645 290 2HG ARG 35 HG3 ARG 35 -3.834 2.694 -2.680 291 1HD ARG 35 HD2 ARG 35 -4.436 4.974 -2.655 292 2HD ARG 35 HD3 ARG 35 -5.530 4.792 -4.026 293 HE ARG 35 HE ARG 35 -7.210 4.199 -2.492 294 1HH1 ARG 35 HH11 ARG 35 -6.068 1.729 -1.433 295 2HH1 ARG 35 HH12 ARG 35 -5.773 2.101 0.233 296 1HH2 ARG 35 HH21 ARG 35 -5.969 5.534 -0.225 297 2HH2 ARG 35 HH22 ARG 35 -5.715 4.255 0.917 298 H LEU 36 H LEU 36 -2.150 1.949 -2.228 299 HA LEU 36 HA LEU 36 -0.208 -0.051 -3.097 300 1HB LEU 36 HB2 LEU 36 -1.933 0.081 -0.605 301 2HB LEU 36 HB3 LEU 36 -0.608 -1.054 -0.867 302 HG LEU 36 HG LEU 36 -0.449 1.955 -0.613 303 1HD1 LEU 36 HD11 LEU 36 -0.409 0.358 1.407 304 2HD1 LEU 36 HD12 LEU 36 1.156 -0.181 0.799 305 3HD1 LEU 36 HD13 LEU 36 0.926 1.503 1.271 306 1HD2 LEU 36 HD21 LEU 36 1.419 -0.006 -1.899 307 2HD2 LEU 36 HD22 LEU 36 1.071 1.663 -2.347 308 3HD2 LEU 36 HD23 LEU 36 2.109 1.320 -0.964 309 H LEU 37 H LEU 37 -0.656 -2.017 -3.981 310 HA LEU 37 HA LEU 37 -3.487 -2.673 -4.515 311 1HB LEU 37 HB2 LEU 37 -0.852 -3.433 -5.648 312 2HB LEU 37 HB3 LEU 37 -2.093 -4.685 -5.677 313 HG LEU 37 HG LEU 37 -2.674 -1.880 -6.623 314 1HD1 LEU 37 HD11 LEU 37 -1.257 -4.126 -8.021 315 2HD1 LEU 37 HD12 LEU 37 -2.351 -3.098 -8.947 316 3HD1 LEU 37 HD13 LEU 37 -0.964 -2.390 -8.119 317 1HD2 LEU 37 HD21 LEU 37 -4.423 -3.763 -6.087 318 2HD2 LEU 37 HD22 LEU 37 -4.586 -2.842 -7.582 319 3HD2 LEU 37 HD23 LEU 37 -3.876 -4.455 -7.613 320 H LEU 38 H LEU 38 -4.368 -4.773 -3.996 321 HA LEU 38 HA LEU 38 -4.745 -6.612 -2.597 322 1HB LEU 38 HB2 LEU 38 -1.722 -6.489 -2.473 323 2HB LEU 38 HB3 LEU 38 -2.671 -7.764 -1.708 324 HG LEU 38 HG LEU 38 -2.570 -7.086 -4.658 325 1HD1 LEU 38 HD11 LEU 38 -0.750 -8.507 -3.516 326 2HD1 LEU 38 HD12 LEU 38 -2.009 -9.720 -3.291 327 3HD1 LEU 38 HD13 LEU 38 -1.552 -9.214 -4.918 328 1HD2 LEU 38 HD21 LEU 38 -4.394 -8.915 -3.078 329 2HD2 LEU 38 HD22 LEU 38 -4.856 -7.624 -4.187 330 3HD2 LEU 38 HD23 LEU 38 -4.132 -9.106 -4.812 331 H VAL 39 H VAL 39 -4.108 -3.675 -1.522 332 HA VAL 39 HA VAL 39 -4.484 -4.504 1.295 333 HB VAL 39 HB VAL 39 -2.684 -3.259 2.175 334 1HG1 VAL 39 HG11 VAL 39 -2.054 -5.373 0.914 335 2HG1 VAL 39 HG12 VAL 39 -1.550 -4.331 -0.417 336 3HG1 VAL 39 HG13 VAL 39 -0.742 -4.217 1.145 337 1HG2 VAL 39 HG21 VAL 39 -2.432 -2.025 -0.586 338 2HG2 VAL 39 HG22 VAL 39 -2.962 -1.211 0.888 339 3HG2 VAL 39 HG23 VAL 39 -1.290 -1.751 0.731 340 H ASP 40 H ASP 40 -5.127 -2.590 2.657 341 HA ASP 40 HA ASP 40 -6.095 -0.221 1.210 342 1HB ASP 40 HB2 ASP 40 -7.916 -1.839 0.825 343 2HB ASP 40 HB3 ASP 40 -8.023 -2.137 2.560 344 H THR 41 H THR 41 -6.087 1.518 2.601 345 HA THR 41 HA THR 41 -5.372 0.968 5.416 346 HB THR 41 HB THR 41 -5.097 3.521 5.445 347 HG1 THR 41 HG1 THR 41 -6.097 4.298 3.741 348 1HG2 THR 41 HG21 THR 41 -3.509 1.536 3.889 349 2HG2 THR 41 HG22 THR 41 -3.073 3.237 3.718 350 3HG2 THR 41 HG23 THR 41 -3.052 2.476 5.309 351 HA PRO 42 HA PRO 42 -9.496 1.861 6.791 352 1HB PRO 42 HB2 PRO 42 -8.921 2.012 9.457 353 2HB PRO 42 HB3 PRO 42 -8.969 0.479 8.567 354 1HG PRO 42 HG2 PRO 42 -6.611 2.024 9.529 355 2HG PRO 42 HG3 PRO 42 -6.796 0.278 9.299 356 1HD PRO 42 HD2 PRO 42 -5.474 2.038 7.538 357 2HD PRO 42 HD3 PRO 42 -5.988 0.380 7.161 358 H GLU 43 H GLU 43 -6.797 3.806 8.102 359 HA GLU 43 HA GLU 43 -8.171 5.984 9.159 360 1HB GLU 43 HB2 GLU 43 -5.762 5.911 9.286 361 2HB GLU 43 HB3 GLU 43 -5.617 5.944 7.529 362 1HG GLU 43 HG2 GLU 43 -6.789 8.196 7.581 363 2HG GLU 43 HG3 GLU 43 -6.596 8.166 9.334 364 H THR 44 H THR 44 -7.836 5.054 5.810 365 HA THR 44 HA THR 44 -9.036 7.616 4.905 366 HB THR 44 HB THR 44 -8.512 6.865 2.660 367 HG1 THR 44 HG1 THR 44 -7.799 4.797 2.284 368 1HG2 THR 44 HG21 THR 44 -6.436 6.609 4.786 369 2HG2 THR 44 HG22 THR 44 -6.002 6.092 3.157 370 3HG2 THR 44 HG23 THR 44 -6.535 7.749 3.444 371 H LYS 45 H LYS 45 -10.968 6.666 6.297 372 HA LYS 45 HA LYS 45 -12.568 4.730 4.714 373 1HB LYS 45 HB2 LYS 45 -12.532 5.662 7.528 374 2HB LYS 45 HB3 LYS 45 -14.128 5.319 6.858 375 1HG LYS 45 HG2 LYS 45 -11.772 3.412 6.751 376 2HG LYS 45 HG3 LYS 45 -13.089 3.314 7.921 377 1HD LYS 45 HD2 LYS 45 -14.099 3.544 5.201 378 2HD LYS 45 HD3 LYS 45 -13.044 2.143 5.383 379 1HE LYS 45 HE2 LYS 45 -14.369 1.583 7.489 380 2HE LYS 45 HE3 LYS 45 -15.530 2.807 6.972 381 1HZ LYS 45 HZ1 LYS 45 -15.426 1.514 4.747 382 2HZ LYS 45 HZ2 LYS 45 -14.855 0.238 5.714 383 3HZ LYS 45 HZ3 LYS 45 -16.379 0.916 6.021 384 H HIS 46 H HIS 46 -13.846 7.418 6.636 385 HA HIS 46 HA HIS 46 -15.273 8.326 4.174 386 1HB HIS 46 HB2 HIS 46 -16.073 7.988 6.984 387 2HB HIS 46 HB3 HIS 46 -16.569 9.529 6.285 388 HD1 HIS 46 HD1 HIS 46 -18.187 6.626 6.867 389 HD2 HIS 46 HD2 HIS 46 -17.347 8.526 3.252 390 HE1 HIS 46 HE1 HIS 46 -19.867 5.747 5.189 391 HA PRO 47 HA PRO 47 -13.030 12.134 4.516 392 1HB PRO 47 HB2 PRO 47 -14.495 13.532 2.683 393 2HB PRO 47 HB3 PRO 47 -13.344 12.265 2.228 394 1HG PRO 47 HG2 PRO 47 -16.318 12.181 2.260 395 2HG PRO 47 HG3 PRO 47 -15.178 11.290 1.241 396 1HD PRO 47 HD2 PRO 47 -16.526 10.271 3.504 397 2HD PRO 47 HD3 PRO 47 -15.149 9.512 2.676 398 H LYS 48 H LYS 48 -13.273 13.631 6.142 399 HA LYS 48 HA LYS 48 -14.289 15.336 7.423 400 1HB LYS 48 HB2 LYS 48 -15.701 15.507 5.126 401 2HB LYS 48 HB3 LYS 48 -16.975 14.938 6.206 402 1HG LYS 48 HG2 LYS 48 -15.249 17.109 7.267 403 2HG LYS 48 HG3 LYS 48 -16.327 17.554 5.943 404 1HD LYS 48 HD2 LYS 48 -18.082 16.164 7.402 405 2HD LYS 48 HD3 LYS 48 -16.997 16.645 8.707 406 1HE LYS 48 HE2 LYS 48 -17.175 19.021 7.588 407 2HE LYS 48 HE3 LYS 48 -18.661 18.367 6.898 408 1HZ LYS 48 HZ1 LYS 48 -19.341 17.753 9.174 409 2HZ LYS 48 HZ2 LYS 48 -17.965 18.541 9.778 410 3HZ LYS 48 HZ3 LYS 48 -19.163 19.430 8.965 411 H LYS 49 H LYS 49 -14.276 12.444 8.023 412 HA LYS 49 HA LYS 49 -16.702 12.322 9.773 413 1HB LYS 49 HB2 LYS 49 -15.682 10.432 7.898 414 2HB LYS 49 HB3 LYS 49 -15.440 9.759 9.512 415 1HG LYS 49 HG2 LYS 49 -18.073 11.045 8.911 416 2HG LYS 49 HG3 LYS 49 -17.754 9.450 8.228 417 1HD LYS 49 HD2 LYS 49 -16.936 9.602 11.019 418 2HD LYS 49 HD3 LYS 49 -18.646 9.985 10.821 419 1HE LYS 49 HE2 LYS 49 -17.854 7.719 9.168 420 2HE LYS 49 HE3 LYS 49 -17.527 7.426 10.877 421 1HZ LYS 49 HZ1 LYS 49 -19.859 8.285 11.267 422 2HZ LYS 49 HZ2 LYS 49 -20.103 8.114 9.594 423 3HZ LYS 49 HZ3 LYS 49 -19.728 6.756 10.544 424 H GLY 50 H GLY 50 -13.399 12.817 9.776 425 1HA GLY 50 HA2 GLY 50 -11.847 12.923 11.534 426 2HA GLY 50 HA3 GLY 50 -13.206 12.705 12.640 427 H VAL 51 H VAL 51 -10.991 11.427 13.412 428 HA VAL 51 HA VAL 51 -11.758 8.614 13.226 429 HB VAL 51 HB VAL 51 -10.378 8.935 11.165 430 1HG1 VAL 51 HG11 VAL 51 -8.946 10.717 12.492 431 2HG1 VAL 51 HG12 VAL 51 -7.980 9.307 12.926 432 3HG1 VAL 51 HG13 VAL 51 -8.197 9.741 11.230 433 1HG2 VAL 51 HG21 VAL 51 -10.131 6.970 13.176 434 2HG2 VAL 51 HG22 VAL 51 -9.693 6.807 11.475 435 3HG2 VAL 51 HG23 VAL 51 -8.486 7.324 12.652 436 H GLU 52 H GLU 52 -11.308 7.712 15.189 437 HA GLU 52 HA GLU 52 -9.173 9.002 16.841 438 1HB GLU 52 HB2 GLU 52 -10.584 8.436 18.832 439 2HB GLU 52 HB3 GLU 52 -11.347 9.605 17.754 440 1HG GLU 52 HG2 GLU 52 -12.599 7.733 16.674 441 2HG GLU 52 HG3 GLU 52 -11.907 6.628 17.862 442 H LYS 53 H LYS 53 -9.095 6.600 15.063 443 HA LYS 53 HA LYS 53 -8.470 4.555 17.158 444 1HB LYS 53 HB2 LYS 53 -10.234 4.298 15.037 445 2HB LYS 53 HB3 LYS 53 -8.761 3.547 14.420 446 1HG LYS 53 HG2 LYS 53 -10.045 1.837 15.556 447 2HG LYS 53 HG3 LYS 53 -8.636 2.211 16.550 448 1HD LYS 53 HD2 LYS 53 -10.311 3.992 17.615 449 2HD LYS 53 HD3 LYS 53 -11.517 2.844 17.031 450 1HE LYS 53 HE2 LYS 53 -9.279 1.504 18.340 451 2HE LYS 53 HE3 LYS 53 -10.089 2.643 19.416 452 1HZ LYS 53 HZ1 LYS 53 -12.100 1.345 18.061 453 2HZ LYS 53 HZ2 LYS 53 -10.989 0.124 18.465 454 3HZ LYS 53 HZ3 LYS 53 -11.650 1.113 19.680 455 H TYR 54 H TYR 54 -7.563 5.382 13.784 456 HA TYR 54 HA TYR 54 -4.712 5.168 14.612 457 1HB TYR 54 HB2 TYR 54 -5.599 3.955 12.007 458 2HB TYR 54 HB3 TYR 54 -4.150 3.614 12.953 459 HD1 TYR 54 HD1 TYR 54 -4.471 2.527 15.275 460 HD2 TYR 54 HD2 TYR 54 -7.519 2.614 12.250 461 HE1 TYR 54 HE1 TYR 54 -5.641 0.654 16.401 462 HE2 TYR 54 HE2 TYR 54 -8.691 0.741 13.377 463 HH TYR 54 HH TYR 54 -8.348 -0.979 14.916 464 H GLY 55 H GLY 55 -6.282 7.511 14.079 465 1HA GLY 55 HA2 GLY 55 -6.169 8.531 11.468 466 2HA GLY 55 HA3 GLY 55 -5.994 9.531 12.910 467 HA PRO 56 HA PRO 56 -1.767 10.200 11.870 468 1HB PRO 56 HB2 PRO 56 -0.781 10.751 14.359 469 2HB PRO 56 HB3 PRO 56 -1.836 11.866 13.471 470 1HG PRO 56 HG2 PRO 56 -2.490 10.072 15.768 471 2HG PRO 56 HG3 PRO 56 -3.166 11.654 15.347 472 1HD PRO 56 HD2 PRO 56 -4.405 9.194 14.852 473 2HD PRO 56 HD3 PRO 56 -4.814 10.725 14.050 474 H GLU 57 H GLU 57 -1.590 7.764 11.377 475 HA GLU 57 HA GLU 57 0.571 6.635 13.015 476 1HB GLU 57 HB2 GLU 57 -1.993 5.912 13.711 477 2HB GLU 57 HB3 GLU 57 -1.550 4.640 12.572 478 1HG GLU 57 HG2 GLU 57 -0.021 3.740 13.988 479 2HG GLU 57 HG3 GLU 57 0.581 5.322 14.486 480 H ALA 58 H ALA 58 -1.820 5.669 10.521 481 HA ALA 58 HA ALA 58 0.193 4.135 9.073 482 1HB ALA 58 HB1 ALA 58 -2.652 4.946 8.429 483 2HB ALA 58 HB2 ALA 58 -1.657 3.988 7.333 484 3HB ALA 58 HB3 ALA 58 -2.072 3.356 8.926 485 H SER 59 H SER 59 -1.742 7.022 8.175 486 HA SER 59 HA SER 59 -0.399 7.699 5.823 487 1HB SER 59 HB2 SER 59 -1.163 9.974 6.173 488 2HB SER 59 HB3 SER 59 -2.408 8.879 6.769 489 HG SER 59 HG SER 59 -1.773 9.293 8.837 490 H ALA 60 H ALA 60 0.472 8.684 9.149 491 HA ALA 60 HA ALA 60 2.842 10.109 8.340 492 1HB ALA 60 HB1 ALA 60 1.477 10.072 10.628 493 2HB ALA 60 HB2 ALA 60 2.671 8.841 11.042 494 3HB ALA 60 HB3 ALA 60 3.197 10.465 10.598 495 H PHE 61 H PHE 61 2.181 6.751 9.148 496 HA PHE 61 HA PHE 61 4.841 5.852 9.551 497 1HB PHE 61 HB2 PHE 61 3.014 4.363 10.040 498 2HB PHE 61 HB3 PHE 61 2.426 4.455 8.379 499 HD1 PHE 61 HD1 PHE 61 3.653 3.358 6.541 500 HD2 PHE 61 HD2 PHE 61 4.924 2.992 10.627 501 HE1 PHE 61 HE1 PHE 61 5.110 1.451 5.916 502 HE2 PHE 61 HE2 PHE 61 6.382 1.085 10.003 503 HZ PHE 61 HZ PHE 61 6.475 0.315 7.647 504 H THR 62 H THR 62 2.927 5.732 6.539 505 HA THR 62 HA THR 62 5.157 4.984 4.888 506 HB THR 62 HB THR 62 2.508 6.298 4.228 507 HG1 THR 62 HG1 THR 62 3.478 3.678 3.766 508 1HG2 THR 62 HG21 THR 62 4.888 5.764 2.572 509 2HG2 THR 62 HG22 THR 62 3.379 5.132 1.912 510 3HG2 THR 62 HG23 THR 62 3.532 6.851 2.276 511 H LYS 63 H LYS 63 3.989 8.054 6.081 512 HA LYS 63 HA LYS 63 5.181 9.815 4.216 513 1HB LYS 63 HB2 LYS 63 3.674 10.569 6.023 514 2HB LYS 63 HB3 LYS 63 4.913 10.174 7.214 515 1HG LYS 63 HG2 LYS 63 6.342 11.745 5.505 516 2HG LYS 63 HG3 LYS 63 4.744 12.477 5.365 517 1HD LYS 63 HD2 LYS 63 4.629 12.609 7.855 518 2HD LYS 63 HD3 LYS 63 6.279 11.993 7.934 519 1HE LYS 63 HE2 LYS 63 5.675 14.393 6.232 520 2HE LYS 63 HE3 LYS 63 5.873 14.587 7.974 521 1HZ LYS 63 HZ1 LYS 63 7.843 13.215 6.231 522 2HZ LYS 63 HZ2 LYS 63 7.952 14.853 6.673 523 3HZ LYS 63 HZ3 LYS 63 8.037 13.642 7.862 524 H LYS 64 H LYS 64 6.554 8.799 7.350 525 HA LYS 64 HA LYS 64 9.187 9.786 6.726 526 1HB LYS 64 HB2 LYS 64 7.919 8.208 8.884 527 2HB LYS 64 HB3 LYS 64 9.639 7.895 8.640 528 1HG LYS 64 HG2 LYS 64 10.028 9.753 9.855 529 2HG LYS 64 HG3 LYS 64 9.432 10.670 8.471 530 1HD LYS 64 HD2 LYS 64 8.068 11.436 10.224 531 2HD LYS 64 HD3 LYS 64 7.073 10.191 9.467 532 1HE LYS 64 HE2 LYS 64 7.708 8.571 11.147 533 2HE LYS 64 HE3 LYS 64 8.893 9.680 11.836 534 1HZ LYS 64 HZ1 LYS 64 6.089 10.530 11.637 535 2HZ LYS 64 HZ2 LYS 64 6.534 9.461 12.878 536 3HZ LYS 64 HZ3 LYS 64 7.280 10.984 12.763 537 H MET 65 H MET 65 7.558 6.710 6.249 538 HA MET 65 HA MET 65 9.759 5.024 5.763 539 1HB MET 65 HB2 MET 65 6.979 4.865 5.449 540 2HB MET 65 HB3 MET 65 7.632 4.560 3.840 541 1HG MET 65 HG2 MET 65 8.527 3.150 6.371 542 2HG MET 65 HG3 MET 65 7.429 2.470 5.170 543 1HE MET 65 HE1 MET 65 9.795 1.153 6.249 544 2HE MET 65 HE2 MET 65 11.216 0.983 5.210 545 3HE MET 65 HE3 MET 65 11.064 2.374 6.280 546 H VAL 66 H VAL 66 7.834 6.427 3.114 547 HA VAL 66 HA VAL 66 9.965 6.116 1.206 548 HB VAL 66 HB VAL 66 8.494 7.743 -0.157 549 1HG1 VAL 66 HG11 VAL 66 7.981 5.000 0.770 550 2HG1 VAL 66 HG12 VAL 66 6.547 5.816 0.150 551 3HG1 VAL 66 HG13 VAL 66 7.977 5.652 -0.869 552 1HG2 VAL 66 HG21 VAL 66 7.396 8.159 2.398 553 2HG2 VAL 66 HG22 VAL 66 6.747 8.744 0.866 554 3HG2 VAL 66 HG23 VAL 66 6.191 7.208 1.529 555 H GLU 67 H GLU 67 9.101 8.696 3.416 556 HA GLU 67 HA GLU 67 10.457 10.847 2.141 557 1HB GLU 67 HB2 GLU 67 9.702 10.223 4.975 558 2HB GLU 67 HB3 GLU 67 10.769 11.590 4.654 559 1HG GLU 67 HG2 GLU 67 8.328 11.340 2.960 560 2HG GLU 67 HG3 GLU 67 8.100 11.845 4.635 561 H ASN 68 H ASN 68 11.651 8.236 4.194 562 HA ASN 68 HA ASN 68 14.389 9.385 4.034 563 1HB ASN 68 HB2 ASN 68 13.124 7.234 5.728 564 2HB ASN 68 HB3 ASN 68 14.878 7.374 5.596 565 1HD2 ASN 68 HD21 ASN 68 12.857 8.031 7.877 566 2HD2 ASN 68 HD22 ASN 68 13.300 9.601 8.350 567 H ALA 69 H ALA 69 12.403 7.053 2.527 568 HA ALA 69 HA ALA 69 14.201 4.992 1.854 569 1HB ALA 69 HB1 ALA 69 11.867 6.232 0.411 570 2HB ALA 69 HB2 ALA 69 12.825 4.971 -0.366 571 3HB ALA 69 HB3 ALA 69 11.990 4.635 1.150 572 H LYS 70 H LYS 70 16.245 5.347 1.102 573 HA LYS 70 HA LYS 70 17.033 7.689 -0.361 574 1HB LYS 70 HB2 LYS 70 18.308 5.016 0.181 575 2HB LYS 70 HB3 LYS 70 19.063 6.147 -0.942 576 1HG LYS 70 HG2 LYS 70 18.345 7.700 1.288 577 2HG LYS 70 HG3 LYS 70 19.017 6.212 1.957 578 1HD LYS 70 HD2 LYS 70 21.060 7.078 1.548 579 2HD LYS 70 HD3 LYS 70 20.720 6.840 -0.166 580 1HE LYS 70 HE2 LYS 70 19.535 9.270 1.047 581 2HE LYS 70 HE3 LYS 70 21.293 9.263 0.912 582 1HZ LYS 70 HZ1 LYS 70 20.621 8.327 -1.476 583 2HZ LYS 70 HZ2 LYS 70 19.271 9.308 -1.174 584 3HZ LYS 70 HZ3 LYS 70 20.830 9.982 -1.153 585 H LYS 71 H LYS 71 15.535 4.725 -1.323 586 HA LYS 71 HA LYS 71 15.653 5.643 -4.146 587 1HB LYS 71 HB2 LYS 71 16.609 2.989 -3.091 588 2HB LYS 71 HB3 LYS 71 15.960 3.114 -4.726 589 1HG LYS 71 HG2 LYS 71 17.962 3.869 -5.418 590 2HG LYS 71 HG3 LYS 71 17.732 5.298 -4.407 591 1HD LYS 71 HD2 LYS 71 19.845 4.081 -3.873 592 2HD LYS 71 HD3 LYS 71 18.741 4.156 -2.499 593 1HE LYS 71 HE2 LYS 71 18.245 1.825 -4.188 594 2HE LYS 71 HE3 LYS 71 19.885 1.843 -3.539 595 1HZ LYS 71 HZ1 LYS 71 17.941 2.612 -1.593 596 2HZ LYS 71 HZ2 LYS 71 17.633 1.060 -2.210 597 3HZ LYS 71 HZ3 LYS 71 19.137 1.408 -1.509 598 H ILE 72 H ILE 72 13.651 5.521 -5.044 599 HA ILE 72 HA ILE 72 11.663 3.685 -3.764 600 HB ILE 72 HB ILE 72 11.180 6.424 -4.981 601 1HG1 ILE 72 HG12 ILE 72 10.596 5.701 -2.134 602 2HG1 ILE 72 HG13 ILE 72 12.268 6.033 -2.582 603 1HG2 ILE 72 HG21 ILE 72 9.298 4.450 -3.651 604 2HG2 ILE 72 HG22 ILE 72 8.867 6.086 -4.146 605 3HG2 ILE 72 HG23 ILE 72 9.303 4.884 -5.361 606 1HD1 ILE 72 HD11 ILE 72 9.918 7.879 -3.096 607 2HD1 ILE 72 HD12 ILE 72 11.121 8.089 -1.823 608 3HD1 ILE 72 HD13 ILE 72 11.600 8.209 -3.517 609 H GLU 73 H GLU 73 10.717 2.262 -5.169 610 HA GLU 73 HA GLU 73 10.863 2.892 -8.086 611 1HB GLU 73 HB2 GLU 73 11.575 0.289 -6.709 612 2HB GLU 73 HB3 GLU 73 11.326 0.434 -8.450 613 1HG GLU 73 HG2 GLU 73 13.559 0.887 -8.490 614 2HG GLU 73 HG3 GLU 73 13.049 2.503 -8.002 615 H VAL 74 H VAL 74 9.138 2.027 -9.333 616 HA VAL 74 HA VAL 74 6.829 1.040 -7.707 617 HB VAL 74 HB VAL 74 5.428 1.963 -9.593 618 1HG1 VAL 74 HG11 VAL 74 5.969 3.205 -7.443 619 2HG1 VAL 74 HG12 VAL 74 7.232 4.048 -8.340 620 3HG1 VAL 74 HG13 VAL 74 5.544 4.232 -8.813 621 1HG2 VAL 74 HG21 VAL 74 7.985 2.178 -10.811 622 2HG2 VAL 74 HG22 VAL 74 6.432 2.670 -11.483 623 3HG2 VAL 74 HG23 VAL 74 7.401 3.824 -10.566 624 H GLU 75 H GLU 75 6.136 -1.003 -8.189 625 HA GLU 75 HA GLU 75 7.037 -2.170 -10.794 626 1HB GLU 75 HB2 GLU 75 8.177 -3.158 -8.802 627 2HB GLU 75 HB3 GLU 75 6.598 -3.638 -8.177 628 1HG GLU 75 HG2 GLU 75 6.206 -4.976 -10.227 629 2HG GLU 75 HG3 GLU 75 7.808 -4.526 -10.814 630 H PHE 76 H PHE 76 5.058 -1.650 -11.851 631 HA PHE 76 HA PHE 76 2.455 -2.097 -10.839 632 1HB PHE 76 HB2 PHE 76 3.437 -2.378 -13.698 633 2HB PHE 76 HB3 PHE 76 1.749 -2.218 -13.213 634 HD1 PHE 76 HD1 PHE 76 0.882 -0.107 -12.323 635 HD2 PHE 76 HD2 PHE 76 4.977 -0.490 -13.558 636 HE1 PHE 76 HE1 PHE 76 1.121 2.361 -12.291 637 HE2 PHE 76 HE2 PHE 76 5.218 1.977 -13.528 638 HZ PHE 76 HZ PHE 76 3.289 3.404 -12.895 639 H ASP 77 H ASP 77 0.951 -3.887 -11.565 640 HA ASP 77 HA ASP 77 2.311 -6.487 -11.163 641 1HB ASP 77 HB2 ASP 77 -0.590 -6.587 -11.544 642 2HB ASP 77 HB3 ASP 77 0.378 -7.166 -10.193 643 H LYS 78 H LYS 78 0.941 -8.307 -12.529 644 HA LYS 78 HA LYS 78 1.652 -7.746 -15.302 645 1HB LYS 78 HB2 LYS 78 0.947 -10.049 -15.730 646 2HB LYS 78 HB3 LYS 78 1.945 -9.999 -14.276 647 1HG LYS 78 HG2 LYS 78 -0.946 -9.610 -13.806 648 2HG LYS 78 HG3 LYS 78 -0.499 -11.209 -14.404 649 1HD LYS 78 HD2 LYS 78 1.423 -10.488 -12.436 650 2HD LYS 78 HD3 LYS 78 -0.168 -10.140 -11.759 651 1HE LYS 78 HE2 LYS 78 -0.126 -12.366 -11.236 652 2HE LYS 78 HE3 LYS 78 -0.663 -12.547 -12.906 653 1HZ LYS 78 HZ1 LYS 78 2.212 -12.392 -12.306 654 2HZ LYS 78 HZ2 LYS 78 1.385 -13.858 -12.074 655 3HZ LYS 78 HZ3 LYS 78 1.427 -13.136 -13.612 656 H GLY 79 H GLY 79 -1.096 -7.197 -13.396 657 1HA GLY 79 HA2 GLY 79 -3.099 -7.576 -15.484 658 2HA GLY 79 HA3 GLY 79 -3.355 -6.760 -13.941 659 H GLN 80 H GLN 80 -4.163 -4.772 -14.502 660 HA GLN 80 HA GLN 80 -3.064 -3.331 -16.825 661 1HB GLN 80 HB2 GLN 80 -5.260 -2.714 -14.837 662 2HB GLN 80 HB3 GLN 80 -4.740 -1.558 -16.063 663 1HG GLN 80 HG2 GLN 80 -5.320 -4.316 -17.011 664 2HG GLN 80 HG3 GLN 80 -6.707 -3.352 -16.502 665 1HE2 GLN 80 HE21 GLN 80 -7.610 -2.519 -18.401 666 2HE2 GLN 80 HE22 GLN 80 -6.730 -1.751 -19.632 667 H ARG 81 H ARG 81 -2.808 -0.788 -16.226 668 HA ARG 81 HA ARG 81 -0.840 -0.727 -13.974 669 1HB ARG 81 HB2 ARG 81 -0.963 0.712 -16.622 670 2HB ARG 81 HB3 ARG 81 -0.011 1.360 -15.285 671 1HG ARG 81 HG2 ARG 81 1.523 -0.354 -15.361 672 2HG ARG 81 HG3 ARG 81 0.334 -1.532 -15.921 673 1HD ARG 81 HD2 ARG 81 0.647 -1.004 -18.128 674 2HD ARG 81 HD3 ARG 81 0.939 0.700 -17.784 675 HE ARG 81 HE ARG 81 2.976 -1.458 -17.659 676 1HH1 ARG 81 HH11 ARG 81 2.252 1.583 -16.368 677 2HH1 ARG 81 HH12 ARG 81 3.761 2.313 -16.807 678 1HH2 ARG 81 HH21 ARG 81 4.846 -0.416 -18.653 679 2HH2 ARG 81 HH22 ARG 81 5.231 1.179 -18.099 680 H THR 82 H THR 82 -3.854 0.426 -15.043 681 HA THR 82 HA THR 82 -3.891 2.376 -12.798 682 HB THR 82 HB THR 82 -5.222 3.928 -14.353 683 HG1 THR 82 HG1 THR 82 -4.120 3.368 -16.595 684 1HG2 THR 82 HG21 THR 82 -2.449 3.627 -13.881 685 2HG2 THR 82 HG22 THR 82 -2.621 4.026 -15.590 686 3HG2 THR 82 HG23 THR 82 -3.301 5.095 -14.362 687 H ASP 83 H ASP 83 -6.063 2.762 -11.997 688 HA ASP 83 HA ASP 83 -7.888 0.505 -12.623 689 1HB ASP 83 HB2 ASP 83 -7.207 1.977 -10.247 690 2HB ASP 83 HB3 ASP 83 -8.941 2.111 -10.536 691 H LYS 84 H LYS 84 -10.317 1.632 -11.873 692 HA LYS 84 HA LYS 84 -11.053 3.032 -14.291 693 1HB LYS 84 HB2 LYS 84 -13.287 3.216 -13.223 694 2HB LYS 84 HB3 LYS 84 -12.649 1.574 -13.119 695 1HG LYS 84 HG2 LYS 84 -11.732 2.240 -10.819 696 2HG LYS 84 HG3 LYS 84 -12.761 3.666 -10.941 697 1HD LYS 84 HD2 LYS 84 -14.379 2.356 -10.046 698 2HD LYS 84 HD3 LYS 84 -14.484 1.631 -11.651 699 1HE LYS 84 HE2 LYS 84 -13.067 -0.174 -11.049 700 2HE LYS 84 HE3 LYS 84 -12.501 0.650 -9.596 701 1HZ LYS 84 HZ1 LYS 84 -15.148 0.571 -9.188 702 2HZ LYS 84 HZ2 LYS 84 -14.910 -0.886 -10.031 703 3HZ LYS 84 HZ3 LYS 84 -14.057 -0.584 -8.593 704 H TYR 85 H TYR 85 -10.030 4.044 -11.121 705 HA TYR 85 HA TYR 85 -11.036 6.786 -11.469 706 1HB TYR 85 HB2 TYR 85 -9.283 5.486 -9.366 707 2HB TYR 85 HB3 TYR 85 -9.752 7.187 -9.330 708 HD1 TYR 85 HD1 TYR 85 -12.327 7.668 -9.587 709 HD2 TYR 85 HD2 TYR 85 -10.675 3.898 -8.357 710 HE1 TYR 85 HE1 TYR 85 -14.501 7.050 -8.567 711 HE2 TYR 85 HE2 TYR 85 -12.850 3.279 -7.337 712 HH TYR 85 HH TYR 85 -14.847 4.335 -6.487 713 H GLY 86 H GLY 86 -8.575 5.148 -12.881 714 1HA GLY 86 HA2 GLY 86 -6.797 5.987 -14.191 715 2HA GLY 86 HA3 GLY 86 -7.188 7.606 -13.612 716 H ARG 87 H ARG 87 -6.970 5.678 -10.924 717 HA ARG 87 HA ARG 87 -4.518 6.893 -10.038 718 1HB ARG 87 HB2 ARG 87 -5.912 4.440 -8.922 719 2HB ARG 87 HB3 ARG 87 -4.742 5.453 -8.077 720 1HG ARG 87 HG2 ARG 87 -6.503 7.357 -8.799 721 2HG ARG 87 HG3 ARG 87 -7.603 5.980 -8.698 722 1HD ARG 87 HD2 ARG 87 -6.142 5.625 -6.425 723 2HD ARG 87 HD3 ARG 87 -6.139 7.385 -6.544 724 HE ARG 87 HE ARG 87 -8.540 7.368 -6.310 725 1HH1 ARG 87 HH11 ARG 87 -7.635 4.249 -7.232 726 2HH1 ARG 87 HH12 ARG 87 -8.768 3.436 -6.206 727 1HH2 ARG 87 HH21 ARG 87 -9.771 6.328 -4.575 728 2HH2 ARG 87 HH22 ARG 87 -9.977 4.614 -4.700 729 H GLY 88 H GLY 88 -2.464 5.862 -9.674 730 1HA GLY 88 HA2 GLY 88 -1.859 3.784 -11.682 731 2HA GLY 88 HA3 GLY 88 -0.672 4.686 -10.738 732 H LEU 89 H LEU 89 -2.102 1.692 -11.069 733 HA LEU 89 HA LEU 89 -1.824 1.007 -8.189 734 1HB LEU 89 HB2 LEU 89 -2.752 -0.831 -10.402 735 2HB LEU 89 HB3 LEU 89 -3.058 -0.971 -8.671 736 HG LEU 89 HG LEU 89 -4.015 1.415 -10.253 737 1HD1 LEU 89 HD11 LEU 89 -4.838 -1.137 -10.832 738 2HD1 LEU 89 HD12 LEU 89 -5.988 -0.672 -9.579 739 3HD1 LEU 89 HD13 LEU 89 -5.836 0.302 -11.041 740 1HD2 LEU 89 HD21 LEU 89 -4.375 0.280 -7.523 741 2HD2 LEU 89 HD22 LEU 89 -4.321 1.965 -8.041 742 3HD2 LEU 89 HD23 LEU 89 -5.793 1.021 -8.266 743 H ALA 90 H ALA 90 0.052 0.124 -7.506 744 HA ALA 90 HA ALA 90 1.464 -1.903 -9.002 745 1HB ALA 90 HB1 ALA 90 2.545 0.920 -8.988 746 2HB ALA 90 HB2 ALA 90 3.604 -0.478 -9.176 747 3HB ALA 90 HB3 ALA 90 2.340 -0.165 -10.363 748 H TYR 91 H TYR 91 3.235 -2.783 -7.739 749 HA TYR 91 HA TYR 91 2.873 -2.368 -4.867 750 1HB TYR 91 HB2 TYR 91 4.905 -4.089 -6.323 751 2HB TYR 91 HB3 TYR 91 4.467 -4.203 -4.618 752 HD1 TYR 91 HD1 TYR 91 3.310 -4.765 -8.084 753 HD2 TYR 91 HD2 TYR 91 2.368 -5.194 -3.915 754 HE1 TYR 91 HE1 TYR 91 1.425 -6.271 -8.665 755 HE2 TYR 91 HE2 TYR 91 0.485 -6.698 -4.494 756 HH TYR 91 HH TYR 91 0.058 -7.960 -7.683 757 H ILE 92 H ILE 92 3.842 -0.646 -3.912 758 HA ILE 92 HA ILE 92 6.178 0.643 -5.081 759 HB ILE 92 HB ILE 92 5.045 1.101 -2.313 760 1HG1 ILE 92 HG12 ILE 92 4.153 2.312 -4.951 761 2HG1 ILE 92 HG13 ILE 92 3.219 1.167 -3.988 762 1HG2 ILE 92 HG21 ILE 92 6.901 2.500 -4.172 763 2HG2 ILE 92 HG22 ILE 92 5.782 3.514 -3.261 764 3HG2 ILE 92 HG23 ILE 92 6.901 2.449 -2.410 765 1HD1 ILE 92 HD11 ILE 92 3.452 2.850 -2.060 766 2HD1 ILE 92 HD12 ILE 92 3.993 4.001 -3.282 767 3HD1 ILE 92 HD13 ILE 92 2.375 3.305 -3.379 768 H TYR 93 H TYR 93 8.299 0.619 -4.272 769 HA TYR 93 HA TYR 93 8.856 -1.289 -2.044 770 1HB TYR 93 HB2 TYR 93 10.223 -1.153 -4.746 771 2HB TYR 93 HB3 TYR 93 10.912 -1.994 -3.358 772 HD1 TYR 93 HD1 TYR 93 8.202 -1.981 -5.850 773 HD2 TYR 93 HD2 TYR 93 9.886 -4.028 -2.470 774 HE1 TYR 93 HE1 TYR 93 6.792 -3.961 -6.346 775 HE2 TYR 93 HE2 TYR 93 8.477 -6.008 -2.967 776 HH TYR 93 HH TYR 93 7.343 -6.962 -5.113 777 H ALA 94 H ALA 94 10.103 -0.320 -0.510 778 HA ALA 94 HA ALA 94 11.747 2.036 -1.349 779 1HB ALA 94 HB1 ALA 94 9.818 1.664 0.860 780 2HB ALA 94 HB2 ALA 94 11.334 2.440 1.319 781 3HB ALA 94 HB3 ALA 94 10.331 3.144 0.051 782 H ASP 95 H ASP 95 13.882 1.970 -0.775 783 HA ASP 95 HA ASP 95 15.888 1.160 0.126 784 1HB ASP 95 HB2 ASP 95 13.989 0.143 2.261 785 2HB ASP 95 HB3 ASP 95 15.748 0.119 2.395 786 H GLY 96 H GLY 96 13.792 -0.618 -1.452 787 1HA GLY 96 HA2 GLY 96 14.291 -2.664 -2.592 788 2HA GLY 96 HA3 GLY 96 15.525 -3.009 -1.381 789 H LYS 97 H LYS 97 12.376 -1.994 -0.315 790 HA LYS 97 HA LYS 97 11.708 -4.829 0.353 791 1HB LYS 97 HB2 LYS 97 12.448 -2.815 2.185 792 2HB LYS 97 HB3 LYS 97 10.698 -2.982 2.335 793 1HG LYS 97 HG2 LYS 97 10.900 -4.975 3.364 794 2HG LYS 97 HG3 LYS 97 11.973 -5.579 2.100 795 1HD LYS 97 HD2 LYS 97 13.718 -5.393 3.501 796 2HD LYS 97 HD3 LYS 97 13.433 -3.656 3.613 797 1HE LYS 97 HE2 LYS 97 12.838 -3.949 5.763 798 2HE LYS 97 HE3 LYS 97 11.440 -4.867 5.201 799 1HZ LYS 97 HZ1 LYS 97 12.825 -6.859 5.170 800 2HZ LYS 97 HZ2 LYS 97 14.143 -5.964 5.760 801 3HZ LYS 97 HZ3 LYS 97 12.759 -6.177 6.722 802 H MET 98 H MET 98 9.372 -5.164 0.704 803 HA MET 98 HA MET 98 7.795 -3.595 -1.197 804 1HB MET 98 HB2 MET 98 7.563 -6.081 -0.932 805 2HB MET 98 HB3 MET 98 6.883 -5.803 0.672 806 1HG MET 98 HG2 MET 98 4.871 -5.221 -0.180 807 2HG MET 98 HG3 MET 98 5.605 -4.159 -1.381 808 1HE MET 98 HE1 MET 98 4.296 -7.589 -0.426 809 2HE MET 98 HE2 MET 98 4.843 -8.673 -1.703 810 3HE MET 98 HE3 MET 98 6.009 -7.977 -0.570 811 H VAL 99 H VAL 99 7.105 -1.615 -0.502 812 HA VAL 99 HA VAL 99 6.776 -0.800 2.187 813 HB VAL 99 HB VAL 99 5.203 0.227 -0.194 814 1HG1 VAL 99 HG11 VAL 99 5.969 1.369 2.501 815 2HG1 VAL 99 HG12 VAL 99 5.433 2.382 1.162 816 3HG1 VAL 99 HG13 VAL 99 4.350 1.162 1.833 817 1HG2 VAL 99 HG21 VAL 99 7.979 0.944 0.805 818 2HG2 VAL 99 HG22 VAL 99 7.587 0.186 -0.739 819 3HG2 VAL 99 HG23 VAL 99 7.091 1.848 -0.421 820 H ASN 100 H ASN 100 4.466 -2.292 -0.056 821 HA ASN 100 HA ASN 100 2.128 -2.014 1.532 822 1HB ASN 100 HB2 ASN 100 2.895 -4.299 -0.311 823 2HB ASN 100 HB3 ASN 100 1.264 -3.949 0.263 824 1HD2 ASN 100 HD21 ASN 100 0.355 -3.367 -1.790 825 2HD2 ASN 100 HD22 ASN 100 0.865 -2.004 -2.665 826 H GLU 101 H GLU 101 4.652 -4.530 1.556 827 HA GLU 101 HA GLU 101 3.341 -6.108 3.603 828 1HB GLU 101 HB2 GLU 101 5.364 -6.629 1.885 829 2HB GLU 101 HB3 GLU 101 6.299 -6.251 3.332 830 1HG GLU 101 HG2 GLU 101 5.155 -7.941 4.609 831 2HG GLU 101 HG3 GLU 101 3.987 -8.205 3.314 832 H ALA 102 H ALA 102 5.425 -3.316 3.614 833 HA ALA 102 HA ALA 102 6.415 -3.552 6.295 834 1HB ALA 102 HB1 ALA 102 6.870 -1.812 4.246 835 2HB ALA 102 HB2 ALA 102 5.854 -0.825 5.297 836 3HB ALA 102 HB3 ALA 102 7.358 -1.509 5.913 837 H LEU 103 H LEU 103 3.612 -1.804 4.962 838 HA LEU 103 HA LEU 103 2.630 -0.872 7.484 839 1HB LEU 103 HB2 LEU 103 1.201 -1.452 4.872 840 2HB LEU 103 HB3 LEU 103 0.436 -0.665 6.253 841 HG LEU 103 HG LEU 103 2.978 0.587 5.670 842 1HD1 LEU 103 HD11 LEU 103 1.121 0.034 3.391 843 2HD1 LEU 103 HD12 LEU 103 1.867 1.630 3.481 844 3HD1 LEU 103 HD13 LEU 103 2.879 0.188 3.394 845 1HD2 LEU 103 HD21 LEU 103 0.645 1.311 6.800 846 2HD2 LEU 103 HD22 LEU 103 1.756 2.490 6.103 847 3HD2 LEU 103 HD23 LEU 103 0.365 1.934 5.174 848 H VAL 104 H VAL 104 1.658 -3.693 5.506 849 HA VAL 104 HA VAL 104 -0.196 -4.774 7.367 850 HB VAL 104 HB VAL 104 1.564 -6.085 5.279 851 1HG1 VAL 104 HG11 VAL 104 -0.526 -7.283 7.110 852 2HG1 VAL 104 HG12 VAL 104 -0.059 -8.035 5.584 853 3HG1 VAL 104 HG13 VAL 104 1.135 -7.822 6.864 854 1HG2 VAL 104 HG21 VAL 104 -0.855 -4.593 5.204 855 2HG2 VAL 104 HG22 VAL 104 -0.080 -5.452 3.873 856 3HG2 VAL 104 HG23 VAL 104 -1.280 -6.272 4.872 857 H ARG 105 H ARG 105 3.275 -4.701 7.373 858 HA ARG 105 HA ARG 105 3.653 -6.911 9.216 859 1HB ARG 105 HB2 ARG 105 5.435 -5.964 7.692 860 2HB ARG 105 HB3 ARG 105 5.499 -4.553 8.748 861 1HG ARG 105 HG2 ARG 105 7.192 -5.907 9.634 862 2HG ARG 105 HG3 ARG 105 5.814 -6.315 10.656 863 1HD ARG 105 HD2 ARG 105 5.527 -8.396 9.680 864 2HD ARG 105 HD3 ARG 105 6.225 -7.885 8.142 865 HE ARG 105 HE ARG 105 8.369 -8.439 8.984 866 1HH1 ARG 105 HH11 ARG 105 6.742 -10.445 10.642 867 2HH1 ARG 105 HH12 ARG 105 7.428 -10.198 12.214 868 1HH2 ARG 105 HH21 ARG 105 8.945 -7.196 11.370 869 2HH2 ARG 105 HH22 ARG 105 8.675 -8.358 12.626 870 H GLN 106 H GLN 106 3.230 -3.407 9.540 871 HA GLN 106 HA GLN 106 3.487 -3.618 12.482 872 1HB GLN 106 HB2 GLN 106 4.332 -1.666 10.890 873 2HB GLN 106 HB3 GLN 106 2.678 -1.087 11.103 874 1HG GLN 106 HG2 GLN 106 3.026 -0.525 13.278 875 2HG GLN 106 HG3 GLN 106 3.977 -1.977 13.595 876 1HE2 GLN 106 HE21 GLN 106 6.056 -1.672 11.694 877 2HE2 GLN 106 HE22 GLN 106 6.955 -0.283 12.075 878 H GLY 107 H GLY 107 1.187 -4.691 10.714 879 1HA GLY 107 HA2 GLY 107 -1.155 -4.817 10.845 880 2HA GLY 107 HA3 GLY 107 -0.919 -4.423 12.548 881 H LEU 108 H LEU 108 -0.307 -2.470 9.620 882 HA LEU 108 HA LEU 108 -2.130 -0.408 10.792 883 1HB LEU 108 HB2 LEU 108 0.445 -0.208 9.255 884 2HB LEU 108 HB3 LEU 108 -0.723 1.112 9.171 885 HG LEU 108 HG LEU 108 0.363 -0.052 11.752 886 1HD1 LEU 108 HD11 LEU 108 1.192 2.288 10.048 887 2HD1 LEU 108 HD12 LEU 108 1.422 2.338 11.796 888 3HD1 LEU 108 HD13 LEU 108 2.204 1.080 10.839 889 1HD2 LEU 108 HD21 LEU 108 -1.673 1.997 11.026 890 2HD2 LEU 108 HD22 LEU 108 -1.599 0.935 12.432 891 3HD2 LEU 108 HD23 LEU 108 -0.604 2.390 12.372 892 H ALA 109 H ALA 109 -1.711 -2.594 8.239 893 HA ALA 109 HA ALA 109 -3.891 -1.237 6.727 894 1HB ALA 109 HB1 ALA 109 -1.209 -1.480 5.838 895 2HB ALA 109 HB2 ALA 109 -2.152 -2.649 4.913 896 3HB ALA 109 HB3 ALA 109 -2.604 -0.944 4.903 897 H LYS 110 H LYS 110 -5.060 -2.802 5.293 898 HA LYS 110 HA LYS 110 -4.846 -5.592 6.357 899 1HB LYS 110 HB2 LYS 110 -7.400 -4.338 5.343 900 2HB LYS 110 HB3 LYS 110 -7.212 -5.791 6.324 901 1HG LYS 110 HG2 LYS 110 -6.567 -4.527 8.247 902 2HG LYS 110 HG3 LYS 110 -6.368 -3.055 7.294 903 1HD LYS 110 HD2 LYS 110 -9.009 -4.503 7.635 904 2HD LYS 110 HD3 LYS 110 -8.511 -3.119 8.610 905 1HE LYS 110 HE2 LYS 110 -8.997 -1.657 6.957 906 2HE LYS 110 HE3 LYS 110 -8.174 -2.640 5.746 907 1HZ LYS 110 HZ1 LYS 110 -10.417 -4.064 6.412 908 2HZ LYS 110 HZ2 LYS 110 -10.955 -2.457 6.335 909 3HZ LYS 110 HZ3 LYS 110 -10.180 -3.157 4.995 910 H VAL 111 H VAL 111 -5.518 -7.273 4.815 911 HA VAL 111 HA VAL 111 -4.663 -6.592 2.076 912 HB VAL 111 HB VAL 111 -5.329 -9.203 3.459 913 1HG1 VAL 111 HG11 VAL 111 -4.845 -8.561 0.564 914 2HG1 VAL 111 HG12 VAL 111 -4.275 -10.096 1.219 915 3HG1 VAL 111 HG13 VAL 111 -5.992 -9.696 1.276 916 1HG2 VAL 111 HG21 VAL 111 -3.153 -8.090 3.982 917 2HG2 VAL 111 HG22 VAL 111 -2.943 -9.635 3.158 918 3HG2 VAL 111 HG23 VAL 111 -2.756 -8.126 2.264 919 H ALA 112 H ALA 112 -6.013 -6.812 0.242 920 HA ALA 112 HA ALA 112 -8.671 -7.875 0.322 921 1HB ALA 112 HB1 ALA 112 -8.337 -4.925 0.833 922 2HB ALA 112 HB2 ALA 112 -9.774 -5.533 0.011 923 3HB ALA 112 HB3 ALA 112 -9.399 -6.074 1.648 924 H TYR 113 H TYR 113 -9.960 -6.664 -1.660 925 HA TYR 113 HA TYR 113 -9.989 -6.413 -3.992 926 1HB TYR 113 HB2 TYR 113 -7.294 -5.157 -3.384 927 2HB TYR 113 HB3 TYR 113 -8.099 -5.074 -4.952 928 HD1 TYR 113 HD1 TYR 113 -10.669 -4.315 -4.809 929 HD2 TYR 113 HD2 TYR 113 -7.647 -3.399 -1.897 930 HE1 TYR 113 HE1 TYR 113 -12.015 -2.388 -4.019 931 HE2 TYR 113 HE2 TYR 113 -8.993 -1.471 -1.108 932 HH TYR 113 HH TYR 113 -12.257 -1.010 -2.028 933 H VAL 114 H VAL 114 -9.886 -8.733 -4.307 934 HA VAL 114 HA VAL 114 -7.181 -9.695 -5.154 935 HB VAL 114 HB VAL 114 -9.536 -11.280 -4.084 936 1HG1 VAL 114 HG11 VAL 114 -7.474 -12.084 -5.827 937 2HG1 VAL 114 HG12 VAL 114 -7.003 -12.676 -4.233 938 3HG1 VAL 114 HG13 VAL 114 -8.563 -13.132 -4.918 939 1HG2 VAL 114 HG21 VAL 114 -7.477 -9.862 -2.762 940 2HG2 VAL 114 HG22 VAL 114 -8.591 -11.030 -2.052 941 3HG2 VAL 114 HG23 VAL 114 -7.029 -11.566 -2.671 942 H TYR 115 H TYR 115 -7.347 -9.134 -7.354 943 HA TYR 115 HA TYR 115 -9.411 -10.672 -8.864 944 1HB TYR 115 HB2 TYR 115 -8.544 -7.939 -9.780 945 2HB TYR 115 HB3 TYR 115 -9.995 -8.841 -10.213 946 HD1 TYR 115 HD1 TYR 115 -11.805 -9.179 -8.485 947 HD2 TYR 115 HD2 TYR 115 -8.504 -6.499 -7.883 948 HE1 TYR 115 HE1 TYR 115 -13.055 -8.048 -6.667 949 HE2 TYR 115 HE2 TYR 115 -9.755 -5.366 -6.066 950 HH TYR 115 HH TYR 115 -13.033 -5.732 -5.588 951 H LYS 116 H LYS 116 -7.933 -12.215 -9.612 952 HA LYS 116 HA LYS 116 -5.286 -11.667 -10.509 953 1HB LYS 116 HB2 LYS 116 -5.466 -13.847 -11.697 954 2HB LYS 116 HB3 LYS 116 -6.053 -13.951 -10.037 955 1HG LYS 116 HG2 LYS 116 -8.370 -13.695 -10.825 956 2HG LYS 116 HG3 LYS 116 -7.796 -13.560 -12.488 957 1HD LYS 116 HD2 LYS 116 -8.264 -15.820 -12.446 958 2HD LYS 116 HD3 LYS 116 -6.598 -15.866 -11.866 959 1HE LYS 116 HE2 LYS 116 -8.208 -17.209 -10.466 960 2HE LYS 116 HE3 LYS 116 -7.328 -15.973 -9.566 961 1HZ LYS 116 HZ1 LYS 116 -9.777 -15.027 -10.738 962 2HZ LYS 116 HZ2 LYS 116 -10.014 -16.263 -9.597 963 3HZ LYS 116 HZ3 LYS 116 -9.191 -14.848 -9.153 964 HA PRO 117 HA PRO 117 -4.065 -12.708 -12.106 965 1HB PRO 117 HB2 PRO 117 -2.213 -11.610 -13.782 966 2HB PRO 117 HB3 PRO 117 -3.301 -12.919 -14.274 967 1HG PRO 117 HG2 PRO 117 -3.399 -10.027 -14.973 968 2HG PRO 117 HG3 PRO 117 -3.955 -11.429 -15.901 969 1HD PRO 117 HD2 PRO 117 -5.592 -9.686 -14.404 970 2HD PRO 117 HD3 PRO 117 -6.068 -11.275 -15.040 971 H ASN 118 H ASN 118 -5.048 -9.709 -11.475 972 HA ASN 118 HA ASN 118 -2.504 -8.465 -10.713 973 1HB ASN 118 HB2 ASN 118 -5.373 -7.697 -10.706 974 2HB ASN 118 HB3 ASN 118 -4.366 -6.951 -9.465 975 1HD2 ASN 118 HD21 ASN 118 -5.402 -5.317 -11.513 976 2HD2 ASN 118 HD22 ASN 118 -4.142 -4.834 -12.542 977 H ASN 119 H ASN 119 -1.999 -10.499 -9.363 978 HA ASN 119 HA ASN 119 -2.498 -9.867 -6.564 979 1HB ASN 119 HB2 ASN 119 -3.596 -11.977 -5.975 980 2HB ASN 119 HB3 ASN 119 -4.577 -11.103 -7.152 981 1HD2 ASN 119 HD21 ASN 119 -5.277 -13.617 -7.309 982 2HD2 ASN 119 HD22 ASN 119 -4.486 -14.486 -8.535 983 H THR 120 H THR 120 -0.258 -10.331 -8.488 984 HA THR 120 HA THR 120 1.091 -12.737 -8.259 985 HB THR 120 HB THR 120 2.326 -9.988 -7.903 986 HG1 THR 120 HG1 THR 120 1.362 -11.439 -10.072 987 1HG2 THR 120 HG21 THR 120 3.482 -12.537 -7.697 988 2HG2 THR 120 HG22 THR 120 3.893 -11.976 -9.317 989 3HG2 THR 120 HG23 THR 120 4.332 -11.007 -7.910 990 H HIS 121 H HIS 121 1.264 -10.082 -5.856 991 HA HIS 121 HA HIS 121 2.533 -11.922 -3.929 992 1HB HIS 121 HB2 HIS 121 1.834 -8.979 -3.870 993 2HB HIS 121 HB3 HIS 121 2.434 -9.830 -2.447 994 HD1 HIS 121 HD1 HIS 121 4.866 -10.879 -2.630 995 HD2 HIS 121 HD2 HIS 121 3.796 -8.381 -5.792 996 HE1 HIS 121 HE1 HIS 121 7.008 -10.329 -3.865 997 H GLU 122 H GLU 122 0.121 -12.983 -4.446 998 HA GLU 122 HA GLU 122 -1.941 -11.925 -2.657 999 1HB GLU 122 HB2 GLU 122 -2.446 -13.137 -4.807 1000 2HB GLU 122 HB3 GLU 122 -1.847 -14.614 -4.051 1001 1HG GLU 122 HG2 GLU 122 -3.567 -13.788 -2.134 1002 2HG GLU 122 HG3 GLU 122 -4.368 -13.125 -3.558 1003 H GLN 123 H GLN 123 -0.260 -15.091 -2.782 1004 HA GLN 123 HA GLN 123 -1.011 -15.864 -0.144 1005 1HB GLN 123 HB2 GLN 123 1.226 -16.698 -1.989 1006 2HB GLN 123 HB3 GLN 123 1.080 -17.377 -0.366 1007 1HG GLN 123 HG2 GLN 123 -1.261 -18.051 -0.896 1008 2HG GLN 123 HG3 GLN 123 -1.031 -17.459 -2.542 1009 1HE2 GLN 123 HE21 GLN 123 -1.450 -19.811 -3.152 1010 2HE2 GLN 123 HE22 GLN 123 -0.148 -20.899 -3.094 1011 H LEU 124 H LEU 124 1.849 -14.128 -1.354 1012 HA LEU 124 HA LEU 124 3.366 -14.085 1.021 1013 1HB LEU 124 HB2 LEU 124 3.534 -12.883 -1.472 1014 2HB LEU 124 HB3 LEU 124 3.398 -11.519 -0.365 1015 HG LEU 124 HG LEU 124 5.765 -12.226 -0.733 1016 1HD1 LEU 124 HD11 LEU 124 4.386 -11.858 1.770 1017 2HD1 LEU 124 HD12 LEU 124 5.743 -12.960 2.007 1018 3HD1 LEU 124 HD13 LEU 124 6.018 -11.356 1.327 1019 1HD2 LEU 124 HD21 LEU 124 4.810 -14.757 -0.737 1020 2HD2 LEU 124 HD22 LEU 124 6.490 -14.375 -0.364 1021 3HD2 LEU 124 HD23 LEU 124 5.338 -14.649 0.942 1022 H LEU 125 H LEU 125 1.017 -11.612 -0.080 1023 HA LEU 125 HA LEU 125 1.062 -10.123 2.364 1024 1HB LEU 125 HB2 LEU 125 -0.876 -10.334 0.067 1025 2HB LEU 125 HB3 LEU 125 -1.291 -9.388 1.497 1026 HG LEU 125 HG LEU 125 1.288 -9.015 -0.045 1027 1HD1 LEU 125 HD11 LEU 125 -1.357 -7.549 -0.266 1028 2HD1 LEU 125 HD12 LEU 125 0.160 -6.959 -0.945 1029 3HD1 LEU 125 HD13 LEU 125 -0.546 -8.462 -1.538 1030 1HD2 LEU 125 HD21 LEU 125 0.450 -8.161 2.488 1031 2HD2 LEU 125 HD22 LEU 125 1.794 -7.500 1.556 1032 3HD2 LEU 125 HD23 LEU 125 0.196 -6.762 1.445 1033 H ARG 126 H ARG 126 -0.596 -13.040 1.409 1034 HA ARG 126 HA ARG 126 -2.696 -13.009 3.349 1035 1HB ARG 126 HB2 ARG 126 -1.245 -15.221 1.895 1036 2HB ARG 126 HB3 ARG 126 -2.491 -15.578 3.089 1037 1HG ARG 126 HG2 ARG 126 -3.307 -13.495 1.204 1038 2HG ARG 126 HG3 ARG 126 -2.941 -15.025 0.408 1039 1HD ARG 126 HD2 ARG 126 -4.369 -15.816 2.646 1040 2HD ARG 126 HD3 ARG 126 -5.185 -14.330 2.159 1041 HE ARG 126 HE ARG 126 -5.197 -15.485 -0.197 1042 1HH1 ARG 126 HH11 ARG 126 -4.330 -17.710 2.097 1043 2HH1 ARG 126 HH12 ARG 126 -5.674 -18.776 1.859 1044 1HH2 ARG 126 HH21 ARG 126 -7.402 -16.569 -0.183 1045 2HH2 ARG 126 HH22 ARG 126 -7.414 -18.130 0.569 1046 H LYS 127 H LYS 127 0.381 -14.855 3.486 1047 HA LYS 127 HA LYS 127 0.150 -15.532 6.239 1048 1HB LYS 127 HB2 LYS 127 2.513 -16.083 6.135 1049 2HB LYS 127 HB3 LYS 127 1.764 -16.564 4.612 1050 1HG LYS 127 HG2 LYS 127 2.590 -14.583 3.501 1051 2HG LYS 127 HG3 LYS 127 3.169 -13.911 5.026 1052 1HD LYS 127 HD2 LYS 127 4.184 -16.613 4.353 1053 2HD LYS 127 HD3 LYS 127 4.753 -15.305 3.315 1054 1HE LYS 127 HE2 LYS 127 5.042 -14.121 5.729 1055 2HE LYS 127 HE3 LYS 127 5.291 -15.805 6.192 1056 1HZ LYS 127 HZ1 LYS 127 6.649 -15.026 3.772 1057 2HZ LYS 127 HZ2 LYS 127 7.186 -14.202 5.157 1058 3HZ LYS 127 HZ3 LYS 127 7.227 -15.898 5.111 1059 H SER 128 H SER 128 1.153 -12.587 4.665 1060 HA SER 128 HA SER 128 2.601 -11.438 6.869 1061 1HB SER 128 HB2 SER 128 1.241 -10.335 4.426 1062 2HB SER 128 HB3 SER 128 1.819 -9.236 5.674 1063 HG SER 128 HG SER 128 3.316 -9.868 3.893 1064 H GLU 129 H GLU 129 -0.813 -11.207 5.852 1065 HA GLU 129 HA GLU 129 -1.606 -9.456 7.985 1066 1HB GLU 129 HB2 GLU 129 -2.915 -9.951 5.861 1067 2HB GLU 129 HB3 GLU 129 -3.369 -11.489 6.595 1068 1HG GLU 129 HG2 GLU 129 -4.083 -9.988 8.630 1069 2HG GLU 129 HG3 GLU 129 -4.126 -8.703 7.424 1070 H ALA 130 H ALA 130 -1.766 -13.008 7.624 1071 HA ALA 130 HA ALA 130 -3.014 -13.628 10.065 1072 1HB ALA 130 HB1 ALA 130 -1.596 -15.048 8.056 1073 2HB ALA 130 HB2 ALA 130 -0.882 -15.501 9.604 1074 3HB ALA 130 HB3 ALA 130 -2.612 -15.717 9.333 1075 H GLN 131 H GLN 131 0.384 -12.875 9.418 1076 HA GLN 131 HA GLN 131 1.316 -13.438 12.084 1077 1HB GLN 131 HB2 GLN 131 2.818 -13.242 10.104 1078 2HB GLN 131 HB3 GLN 131 2.466 -11.514 10.038 1079 1HG GLN 131 HG2 GLN 131 4.326 -11.365 11.358 1080 2HG GLN 131 HG3 GLN 131 3.181 -11.749 12.644 1081 1HE2 GLN 131 HE21 GLN 131 5.243 -12.708 13.677 1082 2HE2 GLN 131 HE22 GLN 131 5.648 -14.306 13.275 1083 H ALA 132 H ALA 132 0.141 -10.498 10.471 1084 HA ALA 132 HA ALA 132 0.605 -8.768 12.739 1085 1HB ALA 132 HB1 ALA 132 0.075 -8.252 10.173 1086 2HB ALA 132 HB2 ALA 132 -1.580 -8.186 10.781 1087 3HB ALA 132 HB3 ALA 132 -0.354 -7.106 11.445 1088 H LYS 133 H LYS 133 -1.772 -11.138 12.002 1089 HA LYS 133 HA LYS 133 -3.898 -10.006 13.646 1090 1HB LYS 133 HB2 LYS 133 -3.474 -12.421 12.022 1091 2HB LYS 133 HB3 LYS 133 -4.417 -12.711 13.484 1092 1HG LYS 133 HG2 LYS 133 -5.110 -10.281 11.913 1093 2HG LYS 133 HG3 LYS 133 -5.537 -11.836 11.196 1094 1HD LYS 133 HD2 LYS 133 -6.301 -10.906 13.981 1095 2HD LYS 133 HD3 LYS 133 -7.383 -10.986 12.590 1096 1HE LYS 133 HE2 LYS 133 -6.566 -13.499 12.496 1097 2HE LYS 133 HE3 LYS 133 -6.195 -13.220 14.197 1098 1HZ LYS 133 HZ1 LYS 133 -8.537 -12.307 14.352 1099 2HZ LYS 133 HZ2 LYS 133 -8.814 -13.022 12.838 1100 3HZ LYS 133 HZ3 LYS 133 -8.385 -13.989 14.168 1101 H LYS 134 H LYS 134 -1.718 -12.826 14.045 1102 HA LYS 134 HA LYS 134 -2.410 -13.350 16.751 1103 1HB LYS 134 HB2 LYS 134 -0.080 -13.979 14.986 1104 2HB LYS 134 HB3 LYS 134 0.128 -14.197 16.723 1105 1HG LYS 134 HG2 LYS 134 -2.378 -15.267 15.514 1106 2HG LYS 134 HG3 LYS 134 -0.880 -16.132 15.162 1107 1HD LYS 134 HD2 LYS 134 -0.410 -16.159 17.642 1108 2HD LYS 134 HD3 LYS 134 -2.032 -15.513 17.894 1109 1HE LYS 134 HE2 LYS 134 -3.057 -17.453 16.949 1110 2HE LYS 134 HE3 LYS 134 -1.520 -18.037 16.310 1111 1HZ LYS 134 HZ1 LYS 134 -1.769 -17.593 19.198 1112 2HZ LYS 134 HZ2 LYS 134 -2.487 -18.976 18.530 1113 3HZ LYS 134 HZ3 LYS 134 -0.817 -18.720 18.355 1114 H GLU 135 H GLU 135 -0.275 -10.985 15.295 1115 HA GLU 135 HA GLU 135 0.987 -10.237 17.825 1116 1HB GLU 135 HB2 GLU 135 0.933 -8.934 15.089 1117 2HB GLU 135 HB3 GLU 135 1.844 -8.293 16.457 1118 1HG GLU 135 HG2 GLU 135 3.100 -10.408 16.622 1119 2HG GLU 135 HG3 GLU 135 2.188 -11.057 15.258 1120 H LYS 136 H LYS 136 -1.862 -9.351 16.034 1121 HA LYS 136 HA LYS 136 -3.539 -7.773 16.476 1122 1HB LYS 136 HB2 LYS 136 -2.453 -8.432 19.210 1123 2HB LYS 136 HB3 LYS 136 -3.740 -7.241 19.014 1124 1HG LYS 136 HG2 LYS 136 -4.589 -9.350 17.425 1125 2HG LYS 136 HG3 LYS 136 -3.865 -10.159 18.815 1126 1HD LYS 136 HD2 LYS 136 -5.382 -7.945 19.789 1127 2HD LYS 136 HD3 LYS 136 -6.399 -8.844 18.663 1128 1HE LYS 136 HE2 LYS 136 -4.812 -10.180 20.867 1129 2HE LYS 136 HE3 LYS 136 -6.482 -9.651 21.073 1130 1HZ LYS 136 HZ1 LYS 136 -6.375 -11.053 18.687 1131 2HZ LYS 136 HZ2 LYS 136 -5.509 -11.981 19.817 1132 3HZ LYS 136 HZ3 LYS 136 -7.117 -11.534 20.134 1133 H LEU 137 H LEU 137 -1.700 -6.414 15.280 1134 HA LEU 137 HA LEU 137 -0.703 -4.264 17.079 1135 1HB LEU 137 HB2 LEU 137 0.297 -5.549 14.693 1136 2HB LEU 137 HB3 LEU 137 0.189 -3.806 14.444 1137 HG LEU 137 HG LEU 137 1.227 -4.425 17.087 1138 1HD1 LEU 137 HD11 LEU 137 1.994 -6.356 15.346 1139 2HD1 LEU 137 HD12 LEU 137 3.222 -5.136 15.006 1140 3HD1 LEU 137 HD13 LEU 137 3.031 -5.762 16.644 1141 1HD2 LEU 137 HD21 LEU 137 1.387 -2.248 15.889 1142 2HD2 LEU 137 HD22 LEU 137 2.971 -2.859 16.363 1143 3HD2 LEU 137 HD23 LEU 137 2.434 -3.007 14.689 1144 H ASN 138 H ASN 138 -1.915 -2.471 17.232 1145 HA ASN 138 HA ASN 138 -3.400 -0.751 16.695 1146 1HB ASN 138 HB2 ASN 138 -2.203 -1.353 13.983 1147 2HB ASN 138 HB3 ASN 138 -3.284 0.009 14.279 1148 1HD2 ASN 138 HD21 ASN 138 -0.011 -0.965 14.385 1149 2HD2 ASN 138 HD22 ASN 138 0.591 0.331 15.301 1150 H ILE 139 H ILE 139 -4.236 -1.544 13.506 1151 HA ILE 139 HA ILE 139 -6.940 -1.775 13.813 1152 HB ILE 139 HB ILE 139 -5.249 -3.459 11.942 1153 1HG1 ILE 139 HG12 ILE 139 -6.638 -1.140 10.846 1154 2HG1 ILE 139 HG13 ILE 139 -5.514 -0.679 12.125 1155 1HG2 ILE 139 HG21 ILE 139 -8.178 -3.010 12.248 1156 2HG2 ILE 139 HG22 ILE 139 -7.538 -3.010 10.604 1157 3HG2 ILE 139 HG23 ILE 139 -7.314 -4.422 11.638 1158 1HD1 ILE 139 HD11 ILE 139 -3.927 -2.398 10.829 1159 2HD1 ILE 139 HD12 ILE 139 -4.959 -1.936 9.475 1160 3HD1 ILE 139 HD13 ILE 139 -4.045 -0.705 10.346 1161 H TRP 140 H TRP 140 -4.655 -4.498 14.129 1162 HA TRP 140 HA TRP 140 -6.835 -6.294 14.940 1163 1HB TRP 140 HB2 TRP 140 -3.842 -6.771 14.966 1164 2HB TRP 140 HB3 TRP 140 -5.106 -8.000 15.053 1165 HD1 TRP 140 HD1 TRP 140 -2.984 -6.196 12.645 1166 HE1 TRP 140 HE1 TRP 140 -3.793 -6.600 10.230 1167 HE3 TRP 140 HE3 TRP 140 -7.542 -8.301 13.580 1168 HZ2 TRP 140 HZ2 TRP 140 -6.070 -7.676 8.875 1169 HZ3 TRP 140 HZ3 TRP 140 -9.009 -9.006 11.710 1170 HH2 TRP 140 HH2 TRP 140 -8.280 -8.696 9.361 1171 H SER 141 H SER 141 -6.769 -4.154 16.677 1172 HA SER 141 HA SER 141 -5.371 -5.203 19.096 1173 1HB SER 141 HB2 SER 141 -4.812 -2.876 18.485 1174 2HB SER 141 HB3 SER 141 -6.519 -2.449 18.552 1175 HG SER 141 HG SER 141 -4.848 -3.350 20.661 1176 H GLU 142 H GLU 142 -8.492 -4.079 17.862 1177 HA GLU 142 HA GLU 142 -9.929 -4.374 20.331 1178 1HB GLU 142 HB2 GLU 142 -10.701 -4.227 17.430 1179 2HB GLU 142 HB3 GLU 142 -11.915 -4.671 18.630 1180 1HG GLU 142 HG2 GLU 142 -10.664 -2.505 19.809 1181 2HG GLU 142 HG3 GLU 142 -10.686 -2.061 18.101 1182 H ASP 143 H ASP 143 -11.079 -6.336 17.676 1183 HA ASP 143 HA ASP 143 -11.783 -8.589 17.741 1184 1HB ASP 143 HB2 ASP 143 -9.533 -8.934 16.991 1185 2HB ASP 143 HB3 ASP 143 -8.885 -8.682 18.614 1186 H ASN 144 H ASN 144 -13.264 -8.087 19.596 1187 HA ASN 144 HA ASN 144 -12.270 -9.181 22.190 1188 1HB ASN 144 HB2 ASN 144 -14.542 -7.338 21.451 1189 2HB ASN 144 HB3 ASN 144 -14.518 -8.172 23.006 1190 1HD2 ASN 144 HD21 ASN 144 -13.243 -7.249 24.644 1191 2HD2 ASN 144 HD22 ASN 144 -12.134 -5.987 24.398 1192 H ALA 145 H ALA 145 -15.651 -9.049 21.264 1193 HA ALA 145 HA ALA 145 -17.253 -10.756 21.117 1194 1HB ALA 145 HB1 ALA 145 -15.114 -11.401 19.363 1195 2HB ALA 145 HB2 ALA 145 -15.595 -12.899 20.158 1196 3HB ALA 145 HB3 ALA 145 -16.787 -11.952 19.269 1197 H ASP 146 H ASP 146 -17.492 -11.061 23.395 1198 HA ASP 146 HA ASP 146 -16.823 -13.704 24.335 1199 1HB ASP 146 HB2 ASP 146 -14.914 -11.587 24.857 1200 2HB ASP 146 HB3 ASP 146 -15.589 -12.199 26.368 1201 H SER 147 H SER 147 -17.555 -13.955 26.681 1202 HA SER 147 HA SER 147 -19.756 -12.004 27.236 1203 1HB SER 147 HB2 SER 147 -20.876 -14.003 26.761 1204 2HB SER 147 HB3 SER 147 -19.606 -14.998 27.468 1205 HG SER 147 HG SER 147 -21.598 -13.452 28.738 1206 H GLY 148 H GLY 148 -18.290 -10.748 28.577 1207 1HA GLY 148 HA2 GLY 148 -17.695 -12.085 31.187 1208 2HA GLY 148 HA3 GLY 148 -16.610 -10.888 30.477 1209 H GLN 149 H GLN 149 -19.896 -10.204 29.920 1210 HA GLN 149 HA GLN 149 -19.920 -7.698 31.142 1211 1HB GLN 149 HB2 GLN 149 -21.961 -9.601 30.205 1212 2HB GLN 149 HB3 GLN 149 -22.533 -8.510 31.469 1213 1HG GLN 149 HG2 GLN 149 -22.699 -6.856 29.956 1214 2HG GLN 149 HG3 GLN 149 -20.964 -6.969 29.656 1215 1HE2 GLN 149 HE21 GLN 149 -24.136 -8.162 28.549 1216 2HE2 GLN 149 HE22 GLN 149 -23.585 -8.724 27.045 1217 HN3 PTP 150 H3 PTP 150 -8.356 -4.503 -8.471 1218 1H5M PTP 150 H51 PTP 150 -5.884 -1.328 -5.388 1219 2H5M PTP 150 H52 PTP 150 -6.219 -2.911 -4.645 1220 3H5M PTP 150 H53 PTP 150 -7.191 -1.490 -4.192 1221 H6 PTP 150 H6 PTP 150 -8.778 -0.558 -5.761 1222 H1* PTP 150 H1' PTP 150 -10.940 -0.825 -8.685 1223 2H2* PTP 150 H2' PTP 150 -11.672 -1.720 -5.916 1224 H3* PTP 150 H3' PTP 150 -12.690 0.340 -5.330 1225 H4* PTP 150 H4' PTP 150 -11.210 2.190 -6.688 1226 2H5* PTP 150 H5' PTP 150 -10.488 0.207 -4.469 Start of MODEL 22 1 1H ALA 1 H1 ALA 1 12.829 -23.668 -19.036 2 2H ALA 1 H2 ALA 1 12.155 -24.814 -17.977 3 3H ALA 1 H3 ALA 1 12.029 -25.034 -19.654 4 HA ALA 1 HA ALA 1 10.017 -24.118 -19.465 5 1HB ALA 1 HB1 ALA 1 11.075 -23.572 -16.770 6 2HB ALA 1 HB2 ALA 1 9.878 -22.400 -17.323 7 3HB ALA 1 HB3 ALA 1 9.470 -24.115 -17.259 8 H THR 2 H THR 2 11.134 -22.972 -21.342 9 HA THR 2 HA THR 2 12.379 -20.502 -21.302 10 HB THR 2 HB THR 2 12.070 -21.278 -23.467 11 HG1 THR 2 HG1 THR 2 10.673 -19.829 -24.485 12 1HG2 THR 2 HG21 THR 2 9.474 -22.181 -22.373 13 2HG2 THR 2 HG22 THR 2 9.460 -21.746 -24.082 14 3HG2 THR 2 HG23 THR 2 10.565 -22.990 -23.498 15 H SER 3 H SER 3 11.391 -18.291 -21.722 16 HA SER 3 HA SER 3 10.030 -16.528 -20.986 17 1HB SER 3 HB2 SER 3 8.317 -18.485 -21.994 18 2HB SER 3 HB3 SER 3 7.645 -18.111 -20.410 19 HG SER 3 HG SER 3 6.979 -16.748 -22.256 20 H THR 4 H THR 4 10.768 -15.917 -18.984 21 HA THR 4 HA THR 4 10.368 -17.641 -16.643 22 HB THR 4 HB THR 4 11.216 -14.870 -16.154 23 HG1 THR 4 HG1 THR 4 12.953 -16.508 -17.647 24 1HG2 THR 4 HG21 THR 4 11.479 -17.293 -14.922 25 2HG2 THR 4 HG22 THR 4 13.046 -17.144 -15.719 26 3HG2 THR 4 HG23 THR 4 12.508 -15.899 -14.592 27 H LYS 5 H LYS 5 9.802 -15.747 -14.658 28 HA LYS 5 HA LYS 5 7.261 -14.444 -15.435 29 1HB LYS 5 HB2 LYS 5 6.082 -15.559 -13.510 30 2HB LYS 5 HB3 LYS 5 6.502 -16.663 -14.821 31 1HG LYS 5 HG2 LYS 5 8.740 -16.923 -13.389 32 2HG LYS 5 HG3 LYS 5 7.661 -16.452 -12.076 33 1HD LYS 5 HD2 LYS 5 7.019 -18.673 -14.031 34 2HD LYS 5 HD3 LYS 5 7.806 -18.949 -12.476 35 1HE LYS 5 HE2 LYS 5 5.629 -19.210 -11.789 36 2HE LYS 5 HE3 LYS 5 5.734 -17.456 -11.633 37 1HZ LYS 5 HZ1 LYS 5 5.106 -18.218 -14.297 38 2HZ LYS 5 HZ2 LYS 5 3.979 -18.866 -13.209 39 3HZ LYS 5 HZ3 LYS 5 4.257 -17.191 -13.244 40 H LYS 6 H LYS 6 9.135 -12.795 -14.883 41 HA LYS 6 HA LYS 6 8.840 -12.118 -11.986 42 1HB LYS 6 HB2 LYS 6 11.192 -12.949 -12.994 43 2HB LYS 6 HB3 LYS 6 11.300 -11.240 -13.419 44 1HG LYS 6 HG2 LYS 6 10.907 -10.597 -11.097 45 2HG LYS 6 HG3 LYS 6 10.676 -12.285 -10.642 46 1HD LYS 6 HD2 LYS 6 13.230 -11.134 -11.805 47 2HD LYS 6 HD3 LYS 6 12.965 -11.493 -10.098 48 1HE LYS 6 HE2 LYS 6 13.878 -13.511 -10.650 49 2HE LYS 6 HE3 LYS 6 12.244 -13.865 -11.210 50 1HZ LYS 6 HZ1 LYS 6 13.919 -12.452 -13.102 51 2HZ LYS 6 HZ2 LYS 6 14.424 -14.032 -12.745 52 3HZ LYS 6 HZ3 LYS 6 12.860 -13.758 -13.348 53 H LEU 7 H LEU 7 8.037 -10.094 -11.665 54 HA LEU 7 HA LEU 7 7.283 -8.440 -13.900 55 1HB LEU 7 HB2 LEU 7 7.387 -7.850 -10.926 56 2HB LEU 7 HB3 LEU 7 6.652 -6.786 -12.127 57 HG LEU 7 HG LEU 7 5.847 -9.685 -11.811 58 1HD1 LEU 7 HD11 LEU 7 5.001 -7.235 -10.315 59 2HD1 LEU 7 HD12 LEU 7 3.765 -8.418 -10.742 60 3HD1 LEU 7 HD13 LEU 7 5.141 -8.901 -9.750 61 1HD2 LEU 7 HD21 LEU 7 5.394 -8.078 -13.892 62 2HD2 LEU 7 HD22 LEU 7 4.156 -9.192 -13.314 63 3HD2 LEU 7 HD23 LEU 7 4.099 -7.490 -12.850 64 H HIS 8 H HIS 8 7.920 -5.898 -13.518 65 HA HIS 8 HA HIS 8 10.907 -5.853 -13.526 66 1HB HIS 8 HB2 HIS 8 10.369 -3.679 -14.930 67 2HB HIS 8 HB3 HIS 8 10.346 -5.262 -15.705 68 HD1 HIS 8 HD1 HIS 8 7.872 -6.430 -15.771 69 HD2 HIS 8 HD2 HIS 8 7.963 -2.316 -15.104 70 HE1 HIS 8 HE1 HIS 8 5.534 -5.578 -16.240 71 H LYS 9 H LYS 9 11.914 -3.981 -12.571 72 HA LYS 9 HA LYS 9 10.122 -2.518 -10.674 73 1HB LYS 9 HB2 LYS 9 13.100 -2.968 -10.360 74 2HB LYS 9 HB3 LYS 9 11.964 -2.390 -9.140 75 1HG LYS 9 HG2 LYS 9 10.763 -4.589 -9.307 76 2HG LYS 9 HG3 LYS 9 12.042 -5.154 -10.379 77 1HD LYS 9 HD2 LYS 9 12.600 -5.901 -8.157 78 2HD LYS 9 HD3 LYS 9 13.699 -4.581 -8.556 79 1HE LYS 9 HE2 LYS 9 11.137 -3.822 -7.249 80 2HE LYS 9 HE3 LYS 9 12.317 -4.664 -6.243 81 1HZ LYS 9 HZ1 LYS 9 13.822 -2.862 -7.590 82 2HZ LYS 9 HZ2 LYS 9 12.390 -1.997 -7.307 83 3HZ LYS 9 HZ3 LYS 9 13.247 -2.670 -6.003 84 H GLU 10 H GLU 10 9.896 -0.392 -11.155 85 HA GLU 10 HA GLU 10 12.092 0.933 -12.700 86 1HB GLU 10 HB2 GLU 10 9.095 1.323 -12.739 87 2HB GLU 10 HB3 GLU 10 10.197 2.552 -13.361 88 1HG GLU 10 HG2 GLU 10 10.815 -0.155 -14.316 89 2HG GLU 10 HG3 GLU 10 9.225 0.418 -14.817 90 HA PRO 11 HA PRO 11 12.466 3.799 -9.370 91 1HB PRO 11 HB2 PRO 11 13.451 5.947 -10.734 92 2HB PRO 11 HB3 PRO 11 14.392 4.477 -10.435 93 1HG PRO 11 HG2 PRO 11 13.132 5.424 -12.956 94 2HG PRO 11 HG3 PRO 11 14.547 4.387 -12.728 95 1HD PRO 11 HD2 PRO 11 11.932 3.527 -13.407 96 2HD PRO 11 HD3 PRO 11 13.285 2.491 -12.901 97 H ALA 12 H ALA 12 11.742 5.975 -8.614 98 HA ALA 12 HA ALA 12 9.619 7.299 -10.174 99 1HB ALA 12 HB1 ALA 12 8.826 5.269 -8.529 100 2HB ALA 12 HB2 ALA 12 8.753 6.642 -7.424 101 3HB ALA 12 HB3 ALA 12 7.822 6.665 -8.921 102 H THR 13 H THR 13 8.618 9.075 -8.481 103 HA THR 13 HA THR 13 10.920 10.194 -6.937 104 HB THR 13 HB THR 13 9.073 11.979 -8.507 105 HG1 THR 13 HG1 THR 13 11.526 10.911 -9.436 106 1HG2 THR 13 HG21 THR 13 11.443 12.238 -6.849 107 2HG2 THR 13 HG22 THR 13 11.704 12.938 -8.447 108 3HG2 THR 13 HG23 THR 13 10.360 13.493 -7.448 109 H LEU 14 H LEU 14 10.178 10.127 -4.855 110 HA LEU 14 HA LEU 14 7.421 10.181 -4.102 111 1HB LEU 14 HB2 LEU 14 9.303 9.346 -2.660 112 2HB LEU 14 HB3 LEU 14 9.795 11.020 -2.410 113 HG LEU 14 HG LEU 14 8.291 10.003 -0.604 114 1HD1 LEU 14 HD11 LEU 14 8.612 12.538 -1.374 115 2HD1 LEU 14 HD12 LEU 14 6.905 12.371 -1.786 116 3HD1 LEU 14 HD13 LEU 14 7.443 12.096 -0.129 117 1HD2 LEU 14 HD21 LEU 14 6.795 8.931 -2.411 118 2HD2 LEU 14 HD22 LEU 14 5.975 9.714 -1.061 119 3HD2 LEU 14 HD23 LEU 14 6.098 10.538 -2.615 120 H ILE 15 H ILE 15 6.267 11.939 -4.891 121 HA ILE 15 HA ILE 15 7.359 14.654 -4.677 122 HB ILE 15 HB ILE 15 4.551 13.799 -5.431 123 1HG1 ILE 15 HG12 ILE 15 6.829 14.394 -7.329 124 2HG1 ILE 15 HG13 ILE 15 6.478 12.755 -6.780 125 1HG2 ILE 15 HG21 ILE 15 5.788 16.330 -5.050 126 2HG2 ILE 15 HG22 ILE 15 5.579 16.116 -6.788 127 3HG2 ILE 15 HG23 ILE 15 4.187 16.001 -5.711 128 1HD1 ILE 15 HD11 ILE 15 4.070 13.175 -7.547 129 2HD1 ILE 15 HD12 ILE 15 4.694 14.604 -8.372 130 3HD1 ILE 15 HD13 ILE 15 5.276 13.001 -8.822 131 H LYS 16 H LYS 16 4.514 12.945 -3.320 132 HA LYS 16 HA LYS 16 4.900 14.268 -0.745 133 1HB LYS 16 HB2 LYS 16 3.736 15.998 -2.214 134 2HB LYS 16 HB3 LYS 16 2.353 14.903 -2.252 135 1HG LYS 16 HG2 LYS 16 1.889 15.186 0.004 136 2HG LYS 16 HG3 LYS 16 3.556 15.603 0.400 137 1HD LYS 16 HD2 LYS 16 3.326 17.805 -0.369 138 2HD LYS 16 HD3 LYS 16 1.928 17.411 -1.371 139 1HE LYS 16 HE2 LYS 16 0.868 18.447 0.410 140 2HE LYS 16 HE3 LYS 16 0.854 16.776 0.972 141 1HZ LYS 16 HZ1 LYS 16 3.175 18.458 1.590 142 2HZ LYS 16 HZ2 LYS 16 1.750 18.677 2.489 143 3HZ LYS 16 HZ3 LYS 16 2.515 17.163 2.469 144 H ALA 17 H ALA 17 4.204 12.843 0.775 145 HA ALA 17 HA ALA 17 2.695 10.475 -0.063 146 1HB ALA 17 HB1 ALA 17 4.246 11.325 2.301 147 2HB ALA 17 HB2 ALA 17 2.849 10.314 2.669 148 3HB ALA 17 HB3 ALA 17 4.096 9.728 1.569 149 H ILE 18 H ILE 18 0.552 10.030 0.454 150 HA ILE 18 HA ILE 18 -0.984 12.310 1.614 151 HB ILE 18 HB ILE 18 -1.755 10.048 -0.240 152 1HG1 ILE 18 HG12 ILE 18 -2.309 12.982 -0.606 153 2HG1 ILE 18 HG13 ILE 18 -0.697 12.351 -0.943 154 1HG2 ILE 18 HG21 ILE 18 -3.389 11.461 1.715 155 2HG2 ILE 18 HG22 ILE 18 -3.968 11.727 0.071 156 3HG2 ILE 18 HG23 ILE 18 -3.809 10.085 0.695 157 1HD1 ILE 18 HD11 ILE 18 -2.735 10.635 -2.095 158 2HD1 ILE 18 HD12 ILE 18 -2.911 12.294 -2.669 159 3HD1 ILE 18 HD13 ILE 18 -1.383 11.442 -2.887 160 H ASP 19 H ASP 19 -1.575 8.783 1.456 161 HA ASP 19 HA ASP 19 -1.957 8.840 4.422 162 1HB ASP 19 HB2 ASP 19 -4.018 8.569 2.656 163 2HB ASP 19 HB3 ASP 19 -3.560 6.881 2.889 164 H GLY 20 H GLY 20 -2.615 5.953 4.354 165 1HA GLY 20 HA2 GLY 20 0.130 4.953 4.406 166 2HA GLY 20 HA3 GLY 20 -1.319 4.025 4.798 167 H ASP 21 H ASP 21 -2.753 4.440 2.384 168 HA ASP 21 HA ASP 21 -1.010 2.943 0.467 169 1HB ASP 21 HB2 ASP 21 -4.020 2.827 0.834 170 2HB ASP 21 HB3 ASP 21 -3.108 1.926 -0.378 171 H THR 22 H THR 22 -0.783 5.650 0.325 172 HA THR 22 HA THR 22 -1.770 6.216 -2.345 173 HB THR 22 HB THR 22 -2.745 8.241 -0.381 174 HG1 THR 22 HG1 THR 22 -4.026 6.873 0.525 175 1HG2 THR 22 HG21 THR 22 -2.871 7.956 -3.095 176 2HG2 THR 22 HG22 THR 22 -4.417 7.260 -2.607 177 3HG2 THR 22 HG23 THR 22 -4.010 8.913 -2.147 178 H VAL 23 H VAL 23 -0.023 7.224 -3.204 179 HA VAL 23 HA VAL 23 1.184 9.497 -1.759 180 HB VAL 23 HB VAL 23 3.492 8.552 -2.091 181 1HG1 VAL 23 HG11 VAL 23 1.954 8.344 0.038 182 2HG1 VAL 23 HG12 VAL 23 1.935 6.632 -0.385 183 3HG1 VAL 23 HG13 VAL 23 3.465 7.438 -0.040 184 1HG2 VAL 23 HG21 VAL 23 2.101 6.656 -3.610 185 2HG2 VAL 23 HG22 VAL 23 3.802 6.584 -3.155 186 3HG2 VAL 23 HG23 VAL 23 2.588 5.784 -2.157 187 H LYS 24 H LYS 24 1.554 11.076 -3.245 188 HA LYS 24 HA LYS 24 1.264 10.481 -6.090 189 1HB LYS 24 HB2 LYS 24 2.121 13.089 -4.809 190 2HB LYS 24 HB3 LYS 24 1.417 12.867 -6.411 191 1HG LYS 24 HG2 LYS 24 -0.640 11.929 -5.284 192 2HG LYS 24 HG3 LYS 24 0.058 12.421 -3.741 193 1HD LYS 24 HD2 LYS 24 -1.290 14.260 -4.309 194 2HD LYS 24 HD3 LYS 24 0.307 14.758 -4.868 195 1HE LYS 24 HE2 LYS 24 -0.585 15.047 -6.916 196 2HE LYS 24 HE3 LYS 24 -0.794 13.298 -7.001 197 1HZ LYS 24 HZ1 LYS 24 -2.901 13.860 -5.574 198 2HZ LYS 24 HZ2 LYS 24 -2.744 15.375 -6.326 199 3HZ LYS 24 HZ3 LYS 24 -2.935 13.978 -7.268 200 H LEU 25 H LEU 25 2.950 9.662 -7.227 201 HA LEU 25 HA LEU 25 5.686 10.701 -6.602 202 1HB LEU 25 HB2 LEU 25 5.360 7.976 -7.791 203 2HB LEU 25 HB3 LEU 25 6.612 8.584 -6.710 204 HG LEU 25 HG LEU 25 3.748 8.163 -5.827 205 1HD1 LEU 25 HD11 LEU 25 4.742 6.014 -6.558 206 2HD1 LEU 25 HD12 LEU 25 6.127 6.308 -5.507 207 3HD1 LEU 25 HD13 LEU 25 4.527 6.063 -4.809 208 1HD2 LEU 25 HD21 LEU 25 6.382 8.579 -4.380 209 2HD2 LEU 25 HD22 LEU 25 5.017 9.694 -4.429 210 3HD2 LEU 25 HD23 LEU 25 4.869 8.157 -3.576 211 H MET 26 H MET 26 7.136 10.724 -8.494 212 HA MET 26 HA MET 26 5.605 11.232 -10.991 213 1HB MET 26 HB2 MET 26 7.478 12.779 -9.791 214 2HB MET 26 HB3 MET 26 8.515 11.829 -10.856 215 1HG MET 26 HG2 MET 26 7.949 13.416 -12.397 216 2HG MET 26 HG3 MET 26 6.488 12.441 -12.564 217 1HE MET 26 HE1 MET 26 7.279 15.178 -13.233 218 2HE MET 26 HE2 MET 26 5.591 15.679 -13.286 219 3HE MET 26 HE3 MET 26 6.725 16.537 -12.245 220 H TYR 27 H TYR 27 5.937 9.973 -12.806 221 HA TYR 27 HA TYR 27 8.162 7.990 -12.729 222 1HB TYR 27 HB2 TYR 27 6.245 6.731 -11.987 223 2HB TYR 27 HB3 TYR 27 5.236 7.416 -13.261 224 HD1 TYR 27 HD1 TYR 27 5.548 6.754 -15.618 225 HD2 TYR 27 HD2 TYR 27 7.840 4.965 -12.455 226 HE1 TYR 27 HE1 TYR 27 6.233 4.925 -17.148 227 HE2 TYR 27 HE2 TYR 27 8.524 3.137 -13.987 228 HH TYR 27 HH TYR 27 8.260 3.291 -17.264 229 H LYS 28 H LYS 28 9.331 8.271 -14.556 230 HA LYS 28 HA LYS 28 9.875 8.896 -16.755 231 1HB LYS 28 HB2 LYS 28 7.192 7.539 -17.052 232 2HB LYS 28 HB3 LYS 28 8.085 8.139 -18.449 233 1HG LYS 28 HG2 LYS 28 10.090 6.810 -17.398 234 2HG LYS 28 HG3 LYS 28 8.819 5.934 -16.544 235 1HD LYS 28 HD2 LYS 28 7.932 5.037 -18.495 236 2HD LYS 28 HD3 LYS 28 8.549 6.350 -19.499 237 1HE LYS 28 HE2 LYS 28 10.901 5.425 -18.807 238 2HE LYS 28 HE3 LYS 28 10.009 3.954 -18.420 239 1HZ LYS 28 HZ1 LYS 28 9.076 4.798 -20.878 240 2HZ LYS 28 HZ2 LYS 28 10.762 4.965 -20.955 241 3HZ LYS 28 HZ3 LYS 28 10.076 3.461 -20.563 242 H GLY 29 H GLY 29 8.557 10.911 -15.067 243 1HA GLY 29 HA2 GLY 29 7.926 13.156 -15.455 244 2HA GLY 29 HA3 GLY 29 7.875 12.803 -17.184 245 H GLN 30 H GLN 30 6.133 10.946 -14.745 246 HA GLN 30 HA GLN 30 3.586 12.183 -15.687 247 1HB GLN 30 HB2 GLN 30 4.069 9.990 -16.860 248 2HB GLN 30 HB3 GLN 30 3.963 9.205 -15.283 249 1HG GLN 30 HG2 GLN 30 1.697 9.410 -15.193 250 2HG GLN 30 HG3 GLN 30 1.719 11.022 -15.909 251 1HE2 GLN 30 HE21 GLN 30 3.027 10.501 -18.359 252 2HE2 GLN 30 HE22 GLN 30 2.070 9.454 -19.292 253 HA PRO 31 HA PRO 31 3.492 12.190 -11.138 254 1HB PRO 31 HB2 PRO 31 1.811 14.344 -10.999 255 2HB PRO 31 HB3 PRO 31 3.563 14.498 -11.226 256 1HG PRO 31 HG2 PRO 31 1.368 14.765 -13.244 257 2HG PRO 31 HG3 PRO 31 2.901 15.645 -13.125 258 1HD PRO 31 HD2 PRO 31 2.442 13.545 -14.882 259 2HD PRO 31 HD3 PRO 31 4.052 14.047 -14.320 260 H MET 32 H MET 32 2.128 10.683 -10.238 261 HA MET 32 HA MET 32 -0.783 10.917 -10.724 262 1HB MET 32 HB2 MET 32 0.848 8.978 -12.043 263 2HB MET 32 HB3 MET 32 -0.142 8.133 -10.854 264 1HG MET 32 HG2 MET 32 -2.166 8.969 -11.792 265 2HG MET 32 HG3 MET 32 -1.308 10.170 -12.756 266 1HE MET 32 HE1 MET 32 -1.097 6.494 -11.839 267 2HE MET 32 HE2 MET 32 -0.595 5.679 -13.327 268 3HE MET 32 HE3 MET 32 0.519 6.757 -12.489 269 H THR 33 H THR 33 -2.017 9.534 -9.190 270 HA THR 33 HA THR 33 -0.589 9.388 -6.598 271 HB THR 33 HB THR 33 -3.539 9.024 -7.200 272 HG1 THR 33 HG1 THR 33 -2.357 11.144 -7.600 273 1HG2 THR 33 HG21 THR 33 -2.278 8.210 -4.990 274 2HG2 THR 33 HG22 THR 33 -2.456 9.914 -4.569 275 3HG2 THR 33 HG23 THR 33 -3.882 8.941 -4.926 276 H PHE 34 H PHE 34 0.430 7.453 -6.309 277 HA PHE 34 HA PHE 34 -0.665 4.995 -7.497 278 1HB PHE 34 HB2 PHE 34 1.833 5.720 -5.994 279 2HB PHE 34 HB3 PHE 34 1.372 4.027 -6.153 280 HD1 PHE 34 HD1 PHE 34 2.260 7.102 -8.025 281 HD2 PHE 34 HD2 PHE 34 1.515 2.878 -8.259 282 HE1 PHE 34 HE1 PHE 34 3.172 7.068 -10.332 283 HE2 PHE 34 HE2 PHE 34 2.427 2.844 -10.565 284 HZ PHE 34 HZ PHE 34 3.256 4.941 -11.601 285 H ARG 35 H ARG 35 -1.446 3.216 -6.302 286 HA ARG 35 HA ARG 35 -1.923 3.701 -3.391 287 1HB ARG 35 HB2 ARG 35 -3.989 4.105 -4.804 288 2HB ARG 35 HB3 ARG 35 -3.922 2.403 -5.265 289 1HG ARG 35 HG2 ARG 35 -4.868 1.780 -3.319 290 2HG ARG 35 HG3 ARG 35 -3.655 2.669 -2.397 291 1HD ARG 35 HD2 ARG 35 -4.992 4.782 -2.983 292 2HD ARG 35 HD3 ARG 35 -6.280 3.690 -3.493 293 HE ARG 35 HE ARG 35 -5.355 3.025 -0.836 294 1HH1 ARG 35 HH11 ARG 35 -6.357 6.013 -1.883 295 2HH1 ARG 35 HH12 ARG 35 -7.805 6.076 -0.934 296 1HH2 ARG 35 HH21 ARG 35 -7.617 2.759 0.057 297 2HH2 ARG 35 HH22 ARG 35 -8.517 4.235 0.164 298 H LEU 36 H LEU 36 -1.315 1.982 -2.146 299 HA LEU 36 HA LEU 36 0.147 -0.197 -3.151 300 1HB LEU 36 HB2 LEU 36 -1.454 0.009 -0.585 301 2HB LEU 36 HB3 LEU 36 -0.280 -1.263 -0.927 302 HG LEU 36 HG LEU 36 0.332 1.706 -0.907 303 1HD1 LEU 36 HD11 LEU 36 0.396 -0.413 1.163 304 2HD1 LEU 36 HD12 LEU 36 1.831 0.608 1.072 305 3HD1 LEU 36 HD13 LEU 36 0.247 1.335 1.345 306 1HD2 LEU 36 HD21 LEU 36 1.704 -0.597 -1.980 307 2HD2 LEU 36 HD22 LEU 36 2.184 1.099 -2.039 308 3HD2 LEU 36 HD23 LEU 36 2.648 0.097 -0.663 309 H LEU 37 H LEU 37 -0.404 -2.133 -4.034 310 HA LEU 37 HA LEU 37 -3.270 -2.667 -4.508 311 1HB LEU 37 HB2 LEU 37 -0.683 -3.697 -5.633 312 2HB LEU 37 HB3 LEU 37 -2.154 -4.648 -5.836 313 HG LEU 37 HG LEU 37 -2.113 -1.710 -6.505 314 1HD1 LEU 37 HD11 LEU 37 -0.823 -3.945 -7.943 315 2HD1 LEU 37 HD12 LEU 37 -1.898 -2.957 -8.931 316 3HD1 LEU 37 HD13 LEU 37 -0.546 -2.209 -8.081 317 1HD2 LEU 37 HD21 LEU 37 -4.224 -3.212 -6.287 318 2HD2 LEU 37 HD22 LEU 37 -4.066 -2.215 -7.734 319 3HD2 LEU 37 HD23 LEU 37 -3.684 -3.936 -7.802 320 H LEU 38 H LEU 38 -4.000 -4.998 -4.272 321 HA LEU 38 HA LEU 38 -4.441 -6.818 -2.863 322 1HB LEU 38 HB2 LEU 38 -1.448 -6.575 -2.816 323 2HB LEU 38 HB3 LEU 38 -2.244 -7.748 -1.765 324 HG LEU 38 HG LEU 38 -1.575 -8.673 -4.012 325 1HD1 LEU 38 HD11 LEU 38 -3.889 -9.069 -2.524 326 2HD1 LEU 38 HD12 LEU 38 -4.489 -8.864 -4.170 327 3HD1 LEU 38 HD13 LEU 38 -3.303 -10.119 -3.815 328 1HD2 LEU 38 HD21 LEU 38 -2.036 -6.628 -5.324 329 2HD2 LEU 38 HD22 LEU 38 -2.943 -8.001 -5.957 330 3HD2 LEU 38 HD23 LEU 38 -3.756 -6.788 -4.968 331 H VAL 39 H VAL 39 -4.079 -3.901 -1.725 332 HA VAL 39 HA VAL 39 -4.380 -4.794 1.094 333 HB VAL 39 HB VAL 39 -2.892 -3.069 1.926 334 1HG1 VAL 39 HG11 VAL 39 -2.024 -5.330 0.901 335 2HG1 VAL 39 HG12 VAL 39 -1.319 -4.280 -0.329 336 3HG1 VAL 39 HG13 VAL 39 -0.867 -4.084 1.365 337 1HG2 VAL 39 HG21 VAL 39 -3.455 -1.494 -0.017 338 2HG2 VAL 39 HG22 VAL 39 -1.773 -1.499 0.514 339 3HG2 VAL 39 HG23 VAL 39 -2.238 -2.372 -0.945 340 H ASP 40 H ASP 40 -5.109 -2.754 2.439 341 HA ASP 40 HA ASP 40 -6.679 -0.836 0.837 342 1HB ASP 40 HB2 ASP 40 -8.154 -2.834 1.107 343 2HB ASP 40 HB3 ASP 40 -8.008 -2.667 2.858 344 H THR 41 H THR 41 -6.650 1.116 1.856 345 HA THR 41 HA THR 41 -5.675 1.185 4.672 346 HB THR 41 HB THR 41 -4.423 2.495 2.953 347 HG1 THR 41 HG1 THR 41 -4.100 3.968 4.412 348 1HG2 THR 41 HG21 THR 41 -6.851 3.024 1.870 349 2HG2 THR 41 HG22 THR 41 -6.592 4.509 2.785 350 3HG2 THR 41 HG23 THR 41 -5.421 4.010 1.565 351 HA PRO 42 HA PRO 42 -9.667 2.494 6.057 352 1HB PRO 42 HB2 PRO 42 -8.895 3.588 8.440 353 2HB PRO 42 HB3 PRO 42 -8.928 1.841 8.149 354 1HG PRO 42 HG2 PRO 42 -6.589 3.692 8.255 355 2HG PRO 42 HG3 PRO 42 -6.696 1.985 8.715 356 1HD PRO 42 HD2 PRO 42 -5.595 2.940 6.326 357 2HD PRO 42 HD3 PRO 42 -6.128 1.269 6.613 358 H GLU 43 H GLU 43 -10.311 4.208 4.685 359 HA GLU 43 HA GLU 43 -9.138 6.693 4.286 360 1HB GLU 43 HB2 GLU 43 -11.971 5.735 4.272 361 2HB GLU 43 HB3 GLU 43 -11.686 7.475 4.192 362 1HG GLU 43 HG2 GLU 43 -9.837 6.286 2.409 363 2HG GLU 43 HG3 GLU 43 -11.390 5.505 2.108 364 H THR 44 H THR 44 -9.656 8.831 5.225 365 HA THR 44 HA THR 44 -10.434 8.661 8.107 366 HB THR 44 HB THR 44 -8.717 10.292 8.654 367 HG1 THR 44 HG1 THR 44 -8.305 10.272 5.856 368 1HG2 THR 44 HG21 THR 44 -8.143 7.811 8.400 369 2HG2 THR 44 HG22 THR 44 -7.401 8.247 6.860 370 3HG2 THR 44 HG23 THR 44 -6.782 8.934 8.362 371 H LYS 45 H LYS 45 -12.054 9.346 5.769 372 HA LYS 45 HA LYS 45 -12.399 12.282 6.032 373 1HB LYS 45 HB2 LYS 45 -13.691 10.257 4.180 374 2HB LYS 45 HB3 LYS 45 -14.021 11.990 4.155 375 1HG LYS 45 HG2 LYS 45 -11.166 11.512 4.125 376 2HG LYS 45 HG3 LYS 45 -11.947 10.643 2.803 377 1HD LYS 45 HD2 LYS 45 -13.234 12.900 2.438 378 2HD LYS 45 HD3 LYS 45 -11.895 13.598 3.352 379 1HE LYS 45 HE2 LYS 45 -10.896 13.708 1.302 380 2HE LYS 45 HE3 LYS 45 -10.525 12.014 1.620 381 1HZ LYS 45 HZ1 LYS 45 -13.153 12.430 0.537 382 2HZ LYS 45 HZ2 LYS 45 -11.914 12.938 -0.508 383 3HZ LYS 45 HZ3 LYS 45 -11.943 11.340 0.057 384 H HIS 46 H HIS 46 -13.137 10.228 8.138 385 HA HIS 46 HA HIS 46 -15.887 9.769 8.353 386 1HB HIS 46 HB2 HIS 46 -13.674 10.218 10.292 387 2HB HIS 46 HB3 HIS 46 -15.315 10.355 10.918 388 HD1 HIS 46 HD1 HIS 46 -12.939 7.925 10.995 389 HD2 HIS 46 HD2 HIS 46 -16.772 7.889 9.359 390 HE1 HIS 46 HE1 HIS 46 -13.624 5.492 10.829 391 HA PRO 47 HA PRO 47 -17.092 14.138 8.339 392 1HB PRO 47 HB2 PRO 47 -19.632 13.654 7.464 393 2HB PRO 47 HB3 PRO 47 -18.232 13.706 6.380 394 1HG PRO 47 HG2 PRO 47 -19.768 11.352 7.358 395 2HG PRO 47 HG3 PRO 47 -18.874 11.564 5.844 396 1HD PRO 47 HD2 PRO 47 -17.972 10.151 8.117 397 2HD PRO 47 HD3 PRO 47 -16.975 10.655 6.735 398 H LYS 48 H LYS 48 -19.824 11.966 9.120 399 HA LYS 48 HA LYS 48 -20.374 13.594 11.525 400 1HB LYS 48 HB2 LYS 48 -22.074 12.549 9.737 401 2HB LYS 48 HB3 LYS 48 -22.002 11.184 10.852 402 1HG LYS 48 HG2 LYS 48 -22.304 13.850 12.113 403 2HG LYS 48 HG3 LYS 48 -23.689 13.286 11.178 404 1HD LYS 48 HD2 LYS 48 -23.357 11.047 12.464 405 2HD LYS 48 HD3 LYS 48 -22.406 12.017 13.588 406 1HE LYS 48 HE2 LYS 48 -24.335 12.630 14.575 407 2HE LYS 48 HE3 LYS 48 -24.734 13.518 13.106 408 1HZ LYS 48 HZ1 LYS 48 -25.192 10.667 12.970 409 2HZ LYS 48 HZ2 LYS 48 -26.180 11.489 14.082 410 3HZ LYS 48 HZ3 LYS 48 -26.173 11.953 12.450 411 H LYS 49 H LYS 49 -18.063 12.433 12.092 412 HA LYS 49 HA LYS 49 -18.697 10.637 14.278 413 1HB LYS 49 HB2 LYS 49 -18.791 8.992 12.472 414 2HB LYS 49 HB3 LYS 49 -17.215 9.519 11.879 415 1HG LYS 49 HG2 LYS 49 -16.161 8.813 13.977 416 2HG LYS 49 HG3 LYS 49 -17.732 8.341 14.625 417 1HD LYS 49 HD2 LYS 49 -17.331 7.117 12.040 418 2HD LYS 49 HD3 LYS 49 -15.969 6.747 13.098 419 1HE LYS 49 HE2 LYS 49 -17.423 5.060 13.727 420 2HE LYS 49 HE3 LYS 49 -17.909 6.315 14.867 421 1HZ LYS 49 HZ1 LYS 49 -19.578 7.006 13.144 422 2HZ LYS 49 HZ2 LYS 49 -19.217 5.567 12.315 423 3HZ LYS 49 HZ3 LYS 49 -19.873 5.506 13.881 424 H GLY 50 H GLY 50 -16.220 12.007 12.142 425 1HA GLY 50 HA2 GLY 50 -14.350 13.300 12.899 426 2HA GLY 50 HA3 GLY 50 -14.625 12.694 14.534 427 H VAL 51 H VAL 51 -12.217 12.312 14.427 428 HA VAL 51 HA VAL 51 -11.732 9.552 13.452 429 HB VAL 51 HB VAL 51 -9.630 11.645 12.959 430 1HG1 VAL 51 HG11 VAL 51 -10.290 8.864 12.038 431 2HG1 VAL 51 HG12 VAL 51 -9.337 9.914 10.988 432 3HG1 VAL 51 HG13 VAL 51 -8.752 9.516 12.604 433 1HG2 VAL 51 HG21 VAL 51 -11.941 10.928 11.125 434 2HG2 VAL 51 HG22 VAL 51 -11.631 12.508 11.845 435 3HG2 VAL 51 HG23 VAL 51 -10.523 11.857 10.637 436 H GLU 52 H GLU 52 -10.306 8.415 14.774 437 HA GLU 52 HA GLU 52 -8.370 9.496 16.523 438 1HB GLU 52 HB2 GLU 52 -9.584 9.343 18.703 439 2HB GLU 52 HB3 GLU 52 -10.208 10.628 17.667 440 1HG GLU 52 HG2 GLU 52 -12.242 9.661 17.567 441 2HG GLU 52 HG3 GLU 52 -11.542 8.105 17.118 442 H LYS 53 H LYS 53 -8.197 7.291 15.058 443 HA LYS 53 HA LYS 53 -7.652 5.197 16.926 444 1HB LYS 53 HB2 LYS 53 -10.308 5.299 16.570 445 2HB LYS 53 HB3 LYS 53 -9.891 4.327 15.158 446 1HG LYS 53 HG2 LYS 53 -9.743 2.527 16.500 447 2HG LYS 53 HG3 LYS 53 -8.368 3.288 17.302 448 1HD LYS 53 HD2 LYS 53 -9.648 4.075 19.058 449 2HD LYS 53 HD3 LYS 53 -11.112 4.179 18.082 450 1HE LYS 53 HE2 LYS 53 -10.991 1.595 17.985 451 2HE LYS 53 HE3 LYS 53 -9.863 1.735 19.333 452 1HZ LYS 53 HZ1 LYS 53 -12.415 3.180 19.449 453 2HZ LYS 53 HZ2 LYS 53 -12.404 1.510 19.762 454 3HZ LYS 53 HZ3 LYS 53 -11.469 2.561 20.714 455 H TYR 54 H TYR 54 -5.714 5.352 15.603 456 HA TYR 54 HA TYR 54 -4.315 4.473 13.930 457 1HB TYR 54 HB2 TYR 54 -6.752 3.034 12.862 458 2HB TYR 54 HB3 TYR 54 -5.057 2.577 12.683 459 HD1 TYR 54 HD1 TYR 54 -4.330 3.339 15.625 460 HD2 TYR 54 HD2 TYR 54 -7.419 0.916 13.881 461 HE1 TYR 54 HE1 TYR 54 -4.464 2.005 17.712 462 HE2 TYR 54 HE2 TYR 54 -7.552 -0.417 15.968 463 HH TYR 54 HH TYR 54 -6.831 -0.640 18.053 464 H GLY 55 H GLY 55 -6.317 6.823 13.591 465 1HA GLY 55 HA2 GLY 55 -6.975 6.947 10.794 466 2HA GLY 55 HA3 GLY 55 -6.900 8.331 11.886 467 HA PRO 56 HA PRO 56 -3.011 9.488 10.159 468 1HB PRO 56 HB2 PRO 56 -1.768 10.572 12.333 469 2HB PRO 56 HB3 PRO 56 -3.160 11.330 11.541 470 1HG PRO 56 HG2 PRO 56 -3.027 9.896 14.139 471 2HG PRO 56 HG3 PRO 56 -4.151 11.154 13.604 472 1HD PRO 56 HD2 PRO 56 -4.665 8.359 13.707 473 2HD PRO 56 HD3 PRO 56 -5.691 9.599 12.956 474 H GLU 57 H GLU 57 -3.183 6.698 11.631 475 HA GLU 57 HA GLU 57 -0.446 6.316 12.592 476 1HB GLU 57 HB2 GLU 57 -2.930 4.858 12.663 477 2HB GLU 57 HB3 GLU 57 -1.655 3.812 12.038 478 1HG GLU 57 HG2 GLU 57 -1.695 3.625 14.462 479 2HG GLU 57 HG3 GLU 57 -0.225 4.477 13.984 480 H ALA 58 H ALA 58 -2.326 5.131 9.781 481 HA ALA 58 HA ALA 58 0.036 3.986 8.524 482 1HB ALA 58 HB1 ALA 58 -2.817 4.019 8.061 483 2HB ALA 58 HB2 ALA 58 -1.959 4.394 6.566 484 3HB ALA 58 HB3 ALA 58 -1.608 2.899 7.434 485 H SER 59 H SER 59 -1.830 6.983 8.140 486 HA SER 59 HA SER 59 -0.626 7.973 5.794 487 1HB SER 59 HB2 SER 59 -1.549 10.024 6.361 488 2HB SER 59 HB3 SER 59 -2.501 8.960 7.391 489 HG SER 59 HG SER 59 -1.431 9.648 9.112 490 H ALA 60 H ALA 60 0.461 8.419 9.178 491 HA ALA 60 HA ALA 60 2.848 9.854 8.425 492 1HB ALA 60 HB1 ALA 60 1.818 9.960 10.696 493 2HB ALA 60 HB2 ALA 60 2.310 8.288 10.963 494 3HB ALA 60 HB3 ALA 60 3.531 9.542 10.748 495 H PHE 61 H PHE 61 2.157 6.450 9.120 496 HA PHE 61 HA PHE 61 4.714 5.369 9.222 497 1HB PHE 61 HB2 PHE 61 2.624 4.036 9.398 498 2HB PHE 61 HB3 PHE 61 2.390 4.214 7.659 499 HD1 PHE 61 HD1 PHE 61 4.614 2.795 10.270 500 HD2 PHE 61 HD2 PHE 61 3.656 2.923 6.084 501 HE1 PHE 61 HE1 PHE 61 6.119 0.867 9.866 502 HE2 PHE 61 HE2 PHE 61 5.161 0.995 5.681 503 HZ PHE 61 HZ PHE 61 6.394 -0.033 7.572 504 H THR 62 H THR 62 2.855 5.502 6.182 505 HA THR 62 HA THR 62 5.115 5.062 4.501 506 HB THR 62 HB THR 62 2.456 6.403 3.935 507 HG1 THR 62 HG1 THR 62 1.885 4.395 4.014 508 1HG2 THR 62 HG21 THR 62 4.859 6.261 2.341 509 2HG2 THR 62 HG22 THR 62 3.571 5.328 1.578 510 3HG2 THR 62 HG23 THR 62 3.320 7.032 1.958 511 H LYS 63 H LYS 63 3.796 7.985 5.928 512 HA LYS 63 HA LYS 63 4.979 9.952 4.303 513 1HB LYS 63 HB2 LYS 63 3.434 10.349 6.261 514 2HB LYS 63 HB3 LYS 63 4.816 10.077 7.323 515 1HG LYS 63 HG2 LYS 63 5.653 11.909 5.316 516 2HG LYS 63 HG3 LYS 63 4.095 12.475 5.919 517 1HD LYS 63 HD2 LYS 63 4.961 12.247 8.251 518 2HD LYS 63 HD3 LYS 63 6.537 11.813 7.589 519 1HE LYS 63 HE2 LYS 63 7.028 13.960 7.040 520 2HE LYS 63 HE3 LYS 63 5.401 14.268 6.431 521 1HZ LYS 63 HZ1 LYS 63 5.610 13.908 9.297 522 2HZ LYS 63 HZ2 LYS 63 6.367 15.303 8.691 523 3HZ LYS 63 HZ3 LYS 63 4.716 15.043 8.404 524 H LYS 64 H LYS 64 6.384 9.049 7.448 525 HA LYS 64 HA LYS 64 8.995 9.997 6.760 526 1HB LYS 64 HB2 LYS 64 8.262 7.925 8.851 527 2HB LYS 64 HB3 LYS 64 9.735 8.896 8.808 528 1HG LYS 64 HG2 LYS 64 8.656 10.819 9.482 529 2HG LYS 64 HG3 LYS 64 7.126 10.346 8.744 530 1HD LYS 64 HD2 LYS 64 6.507 9.896 10.890 531 2HD LYS 64 HD3 LYS 64 7.403 8.398 10.632 532 1HE LYS 64 HE2 LYS 64 8.969 10.788 11.484 533 2HE LYS 64 HE3 LYS 64 7.936 10.026 12.694 534 1HZ LYS 64 HZ1 LYS 64 9.904 8.561 11.023 535 2HZ LYS 64 HZ2 LYS 64 10.217 9.109 12.601 536 3HZ LYS 64 HZ3 LYS 64 9.012 7.945 12.332 537 H MET 65 H MET 65 7.340 7.084 5.967 538 HA MET 65 HA MET 65 9.612 5.344 5.692 539 1HB MET 65 HB2 MET 65 7.286 4.505 5.735 540 2HB MET 65 HB3 MET 65 6.977 5.304 4.193 541 1HG MET 65 HG2 MET 65 7.894 3.589 3.059 542 2HG MET 65 HG3 MET 65 9.373 3.696 4.012 543 1HE MET 65 HE1 MET 65 10.207 1.964 4.587 544 2HE MET 65 HE2 MET 65 9.625 0.661 5.631 545 3HE MET 65 HE3 MET 65 9.368 0.581 3.890 546 H VAL 66 H VAL 66 7.689 6.548 2.954 547 HA VAL 66 HA VAL 66 9.783 6.293 1.059 548 HB VAL 66 HB VAL 66 8.409 7.981 -0.281 549 1HG1 VAL 66 HG11 VAL 66 7.164 5.505 0.938 550 2HG1 VAL 66 HG12 VAL 66 6.419 6.393 -0.391 551 3HG1 VAL 66 HG13 VAL 66 7.999 5.641 -0.609 552 1HG2 VAL 66 HG21 VAL 66 7.512 8.810 2.135 553 2HG2 VAL 66 HG22 VAL 66 6.584 9.017 0.650 554 3HG2 VAL 66 HG23 VAL 66 6.237 7.664 1.726 555 H GLU 67 H GLU 67 9.166 8.753 3.433 556 HA GLU 67 HA GLU 67 10.683 10.869 2.192 557 1HB GLU 67 HB2 GLU 67 9.742 10.291 4.989 558 2HB GLU 67 HB3 GLU 67 10.882 11.606 4.701 559 1HG GLU 67 HG2 GLU 67 8.695 11.628 2.774 560 2HG GLU 67 HG3 GLU 67 8.109 11.752 4.433 561 H ASN 68 H ASN 68 11.511 8.186 4.331 562 HA ASN 68 HA ASN 68 14.333 9.082 4.435 563 1HB ASN 68 HB2 ASN 68 12.686 7.033 5.869 564 2HB ASN 68 HB3 ASN 68 14.430 6.784 5.768 565 1HD2 ASN 68 HD21 ASN 68 12.233 7.992 7.862 566 2HD2 ASN 68 HD22 ASN 68 13.130 9.249 8.564 567 H ALA 69 H ALA 69 12.331 7.122 2.516 568 HA ALA 69 HA ALA 69 14.171 5.033 1.810 569 1HB ALA 69 HB1 ALA 69 11.714 6.222 0.558 570 2HB ALA 69 HB2 ALA 69 12.714 5.120 -0.390 571 3HB ALA 69 HB3 ALA 69 11.991 4.574 1.123 572 H LYS 70 H LYS 70 16.150 5.440 0.943 573 HA LYS 70 HA LYS 70 16.828 7.901 -0.383 574 1HB LYS 70 HB2 LYS 70 18.267 5.233 -0.511 575 2HB LYS 70 HB3 LYS 70 18.956 6.811 -0.894 576 1HG LYS 70 HG2 LYS 70 18.584 7.550 1.424 577 2HG LYS 70 HG3 LYS 70 17.873 5.983 1.815 578 1HD LYS 70 HD2 LYS 70 19.896 4.954 1.934 579 2HD LYS 70 HD3 LYS 70 20.527 5.829 0.538 580 1HE LYS 70 HE2 LYS 70 21.170 7.681 1.828 581 2HE LYS 70 HE3 LYS 70 20.075 7.262 3.145 582 1HZ LYS 70 HZ1 LYS 70 22.079 5.268 2.524 583 2HZ LYS 70 HZ2 LYS 70 22.691 6.726 3.147 584 3HZ LYS 70 HZ3 LYS 70 21.543 5.837 4.029 585 H LYS 71 H LYS 71 15.709 4.764 -1.515 586 HA LYS 71 HA LYS 71 15.483 5.936 -4.251 587 1HB LYS 71 HB2 LYS 71 16.406 3.116 -3.611 588 2HB LYS 71 HB3 LYS 71 16.170 3.785 -5.227 589 1HG LYS 71 HG2 LYS 71 18.127 4.938 -5.170 590 2HG LYS 71 HG3 LYS 71 17.909 5.408 -3.483 591 1HD LYS 71 HD2 LYS 71 18.876 3.449 -2.670 592 2HD LYS 71 HD3 LYS 71 18.521 2.543 -4.141 593 1HE LYS 71 HE2 LYS 71 20.689 2.922 -4.687 594 2HE LYS 71 HE3 LYS 71 20.159 4.560 -5.070 595 1HZ LYS 71 HZ1 LYS 71 20.821 3.889 -2.290 596 2HZ LYS 71 HZ2 LYS 71 22.087 4.158 -3.391 597 3HZ LYS 71 HZ3 LYS 71 20.945 5.377 -3.102 598 H ILE 72 H ILE 72 13.469 5.637 -5.112 599 HA ILE 72 HA ILE 72 11.693 3.641 -3.759 600 HB ILE 72 HB ILE 72 10.918 6.269 -5.064 601 1HG1 ILE 72 HG12 ILE 72 10.167 6.298 -2.387 602 2HG1 ILE 72 HG13 ILE 72 11.757 5.536 -2.355 603 1HG2 ILE 72 HG21 ILE 72 9.382 4.026 -4.827 604 2HG2 ILE 72 HG22 ILE 72 9.056 4.815 -3.284 605 3HG2 ILE 72 HG23 ILE 72 8.735 5.667 -4.794 606 1HD1 ILE 72 HD11 ILE 72 11.948 7.687 -4.183 607 2HD1 ILE 72 HD12 ILE 72 11.098 8.313 -2.771 608 3HD1 ILE 72 HD13 ILE 72 12.687 7.571 -2.585 609 H GLU 73 H GLU 73 11.252 1.968 -5.107 610 HA GLU 73 HA GLU 73 10.996 2.575 -8.026 611 1HB GLU 73 HB2 GLU 73 11.814 -0.157 -7.121 612 2HB GLU 73 HB3 GLU 73 12.235 0.705 -8.601 613 1HG GLU 73 HG2 GLU 73 13.612 2.280 -7.159 614 2HG GLU 73 HG3 GLU 73 13.354 1.155 -5.824 615 H VAL 74 H VAL 74 9.015 2.051 -8.826 616 HA VAL 74 HA VAL 74 7.142 0.544 -7.113 617 HB VAL 74 HB VAL 74 5.447 1.225 -8.742 618 1HG1 VAL 74 HG11 VAL 74 7.294 3.112 -7.449 619 2HG1 VAL 74 HG12 VAL 74 6.382 3.823 -8.782 620 3HG1 VAL 74 HG13 VAL 74 5.531 3.076 -7.431 621 1HG2 VAL 74 HG21 VAL 74 7.788 1.462 -10.437 622 2HG2 VAL 74 HG22 VAL 74 6.086 1.433 -10.896 623 3HG2 VAL 74 HG23 VAL 74 6.855 2.958 -10.458 624 H GLU 75 H GLU 75 5.635 -1.012 -8.500 625 HA GLU 75 HA GLU 75 7.078 -2.481 -10.596 626 1HB GLU 75 HB2 GLU 75 8.013 -3.399 -8.466 627 2HB GLU 75 HB3 GLU 75 6.379 -3.857 -7.988 628 1HG GLU 75 HG2 GLU 75 6.192 -5.249 -10.040 629 2HG GLU 75 HG3 GLU 75 7.862 -4.843 -10.440 630 H PHE 76 H PHE 76 5.102 -1.784 -11.723 631 HA PHE 76 HA PHE 76 2.464 -2.358 -10.931 632 1HB PHE 76 HB2 PHE 76 3.605 -2.534 -13.738 633 2HB PHE 76 HB3 PHE 76 1.899 -2.346 -13.326 634 HD1 PHE 76 HD1 PHE 76 5.197 -0.698 -13.394 635 HD2 PHE 76 HD2 PHE 76 1.030 -0.239 -12.457 636 HE1 PHE 76 HE1 PHE 76 5.501 1.758 -13.251 637 HE2 PHE 76 HE2 PHE 76 1.333 2.219 -12.316 638 HZ PHE 76 HZ PHE 76 3.569 3.217 -12.712 639 H ASP 77 H ASP 77 1.074 -4.178 -11.418 640 HA ASP 77 HA ASP 77 2.548 -6.742 -11.336 641 1HB ASP 77 HB2 ASP 77 -0.372 -6.930 -11.330 642 2HB ASP 77 HB3 ASP 77 0.788 -7.537 -10.155 643 H LYS 78 H LYS 78 1.226 -8.570 -12.606 644 HA LYS 78 HA LYS 78 1.492 -7.902 -15.414 645 1HB LYS 78 HB2 LYS 78 0.653 -10.231 -15.770 646 2HB LYS 78 HB3 LYS 78 2.000 -10.159 -14.634 647 1HG LYS 78 HG2 LYS 78 -0.501 -9.796 -13.230 648 2HG LYS 78 HG3 LYS 78 -0.544 -11.285 -14.177 649 1HD LYS 78 HD2 LYS 78 1.979 -10.778 -12.706 650 2HD LYS 78 HD3 LYS 78 0.569 -11.124 -11.705 651 1HE LYS 78 HE2 LYS 78 0.564 -13.301 -12.307 652 2HE LYS 78 HE3 LYS 78 0.727 -12.898 -14.016 653 1HZ LYS 78 HZ1 LYS 78 3.036 -12.617 -12.214 654 2HZ LYS 78 HZ2 LYS 78 2.622 -14.149 -12.820 655 3HZ LYS 78 HZ3 LYS 78 3.010 -12.886 -13.888 656 H GLY 79 H GLY 79 -0.948 -7.285 -13.215 657 1HA GLY 79 HA2 GLY 79 -3.206 -7.752 -15.034 658 2HA GLY 79 HA3 GLY 79 -3.295 -6.991 -13.445 659 H GLN 80 H GLN 80 -4.449 -5.152 -14.100 660 HA GLN 80 HA GLN 80 -3.707 -3.574 -16.406 661 1HB GLN 80 HB2 GLN 80 -5.229 -2.542 -14.009 662 2HB GLN 80 HB3 GLN 80 -5.379 -2.048 -15.696 663 1HG GLN 80 HG2 GLN 80 -5.842 -4.896 -15.428 664 2HG GLN 80 HG3 GLN 80 -6.921 -3.988 -14.368 665 1HE2 GLN 80 HE21 GLN 80 -8.440 -2.483 -15.372 666 2HE2 GLN 80 HE22 GLN 80 -8.760 -2.530 -17.038 667 H ARG 81 H ARG 81 -3.192 -1.119 -15.988 668 HA ARG 81 HA ARG 81 -0.924 -1.024 -14.041 669 1HB ARG 81 HB2 ARG 81 -1.356 0.270 -16.732 670 2HB ARG 81 HB3 ARG 81 -0.187 0.926 -15.585 671 1HG ARG 81 HG2 ARG 81 0.801 -1.416 -15.437 672 2HG ARG 81 HG3 ARG 81 -0.208 -1.834 -16.822 673 1HD ARG 81 HD2 ARG 81 2.069 0.132 -16.681 674 2HD ARG 81 HD3 ARG 81 1.823 -1.191 -17.821 675 HE ARG 81 HE ARG 81 -0.054 0.194 -18.790 676 1HH1 ARG 81 HH11 ARG 81 2.440 1.522 -19.576 677 2HH1 ARG 81 HH12 ARG 81 2.216 3.148 -19.024 678 1HH2 ARG 81 HH21 ARG 81 -0.382 2.341 -16.875 679 2HH2 ARG 81 HH22 ARG 81 0.621 3.612 -17.492 680 H THR 82 H THR 82 -3.996 0.240 -14.806 681 HA THR 82 HA THR 82 -3.613 2.372 -12.755 682 HB THR 82 HB THR 82 -5.490 3.494 -14.379 683 HG1 THR 82 HG1 THR 82 -5.225 2.886 -16.375 684 1HG2 THR 82 HG21 THR 82 -3.093 4.215 -13.445 685 2HG2 THR 82 HG22 THR 82 -2.638 3.947 -15.128 686 3HG2 THR 82 HG23 THR 82 -3.895 5.119 -14.729 687 H ASP 83 H ASP 83 -5.990 3.215 -12.167 688 HA ASP 83 HA ASP 83 -7.665 0.757 -11.837 689 1HB ASP 83 HB2 ASP 83 -6.592 2.176 -9.826 690 2HB ASP 83 HB3 ASP 83 -8.070 3.105 -10.053 691 H LYS 84 H LYS 84 -9.986 1.971 -10.951 692 HA LYS 84 HA LYS 84 -11.116 2.910 -13.462 693 1HB LYS 84 HB2 LYS 84 -13.212 3.163 -12.095 694 2HB LYS 84 HB3 LYS 84 -12.498 1.554 -12.000 695 1HG LYS 84 HG2 LYS 84 -11.709 1.886 -9.826 696 2HG LYS 84 HG3 LYS 84 -11.726 3.642 -9.983 697 1HD LYS 84 HD2 LYS 84 -13.891 3.791 -9.333 698 2HD LYS 84 HD3 LYS 84 -14.372 2.421 -10.334 699 1HE LYS 84 HE2 LYS 84 -13.787 0.848 -8.675 700 2HE LYS 84 HE3 LYS 84 -12.788 2.010 -7.802 701 1HZ LYS 84 HZ1 LYS 84 -15.617 2.647 -8.133 702 2HZ LYS 84 HZ2 LYS 84 -15.223 1.411 -7.036 703 3HZ LYS 84 HZ3 LYS 84 -14.579 2.970 -6.832 704 H TYR 85 H TYR 85 -9.786 4.408 -10.630 705 HA TYR 85 HA TYR 85 -10.965 7.034 -11.351 706 1HB TYR 85 HB2 TYR 85 -9.192 6.207 -9.030 707 2HB TYR 85 HB3 TYR 85 -9.879 7.816 -9.256 708 HD1 TYR 85 HD1 TYR 85 -12.494 7.892 -9.625 709 HD2 TYR 85 HD2 TYR 85 -10.386 4.631 -7.785 710 HE1 TYR 85 HE1 TYR 85 -14.596 7.145 -8.537 711 HE2 TYR 85 HE2 TYR 85 -12.487 3.887 -6.697 712 HH TYR 85 HH TYR 85 -15.559 5.611 -7.256 713 H GLY 86 H GLY 86 -8.532 5.281 -12.539 714 1HA GLY 86 HA2 GLY 86 -6.729 5.955 -13.907 715 2HA GLY 86 HA3 GLY 86 -7.075 7.630 -13.470 716 H ARG 87 H ARG 87 -6.655 5.222 -10.979 717 HA ARG 87 HA ARG 87 -4.340 6.718 -9.949 718 1HB ARG 87 HB2 ARG 87 -5.384 4.168 -8.744 719 2HB ARG 87 HB3 ARG 87 -4.686 5.573 -7.936 720 1HG ARG 87 HG2 ARG 87 -6.851 6.709 -9.147 721 2HG ARG 87 HG3 ARG 87 -7.472 5.092 -8.812 722 1HD ARG 87 HD2 ARG 87 -6.213 6.974 -6.794 723 2HD ARG 87 HD3 ARG 87 -7.925 6.567 -6.908 724 HE ARG 87 HE ARG 87 -5.923 4.972 -5.602 725 1HH1 ARG 87 HH11 ARG 87 -9.138 5.088 -5.865 726 2HH1 ARG 87 HH12 ARG 87 -9.420 3.398 -6.115 727 1HH2 ARG 87 HH21 ARG 87 -6.084 2.656 -6.693 728 2HH2 ARG 87 HH22 ARG 87 -7.692 2.023 -6.588 729 H GLY 88 H GLY 88 -2.252 5.771 -9.629 730 1HA GLY 88 HA2 GLY 88 -1.573 3.734 -11.640 731 2HA GLY 88 HA3 GLY 88 -0.427 4.630 -10.643 732 H LEU 89 H LEU 89 -1.882 1.626 -11.072 733 HA LEU 89 HA LEU 89 -1.566 0.848 -8.221 734 1HB LEU 89 HB2 LEU 89 -2.456 -0.948 -10.482 735 2HB LEU 89 HB3 LEU 89 -2.773 -1.126 -8.757 736 HG LEU 89 HG LEU 89 -3.867 1.060 -10.552 737 1HD1 LEU 89 HD11 LEU 89 -4.737 -1.584 -10.109 738 2HD1 LEU 89 HD12 LEU 89 -5.799 -0.566 -9.137 739 3HD1 LEU 89 HD13 LEU 89 -5.648 -0.280 -10.871 740 1HD2 LEU 89 HD21 LEU 89 -3.303 1.439 -7.970 741 2HD2 LEU 89 HD22 LEU 89 -4.786 2.069 -8.682 742 3HD2 LEU 89 HD23 LEU 89 -4.821 0.567 -7.758 743 H ALA 90 H ALA 90 0.348 0.006 -7.583 744 HA ALA 90 HA ALA 90 1.767 -1.976 -9.131 745 1HB ALA 90 HB1 ALA 90 2.311 0.678 -9.861 746 2HB ALA 90 HB2 ALA 90 3.661 0.209 -8.827 747 3HB ALA 90 HB3 ALA 90 3.278 -0.740 -10.264 748 H TYR 91 H TYR 91 3.276 -3.047 -7.817 749 HA TYR 91 HA TYR 91 3.117 -2.546 -4.974 750 1HB TYR 91 HB2 TYR 91 5.077 -4.286 -6.506 751 2HB TYR 91 HB3 TYR 91 4.743 -4.374 -4.775 752 HD1 TYR 91 HD1 TYR 91 2.393 -4.961 -4.006 753 HD2 TYR 91 HD2 TYR 91 3.682 -5.390 -8.082 754 HE1 TYR 91 HE1 TYR 91 0.486 -6.485 -4.449 755 HE2 TYR 91 HE2 TYR 91 1.773 -6.912 -8.526 756 HH TYR 91 HH TYR 91 0.054 -8.005 -7.644 757 H ILE 92 H ILE 92 4.203 -0.946 -3.949 758 HA ILE 92 HA ILE 92 6.531 0.305 -5.258 759 HB ILE 92 HB ILE 92 5.316 1.053 -2.594 760 1HG1 ILE 92 HG12 ILE 92 4.437 1.784 -5.401 761 2HG1 ILE 92 HG13 ILE 92 3.473 0.992 -4.155 762 1HG2 ILE 92 HG21 ILE 92 7.539 2.017 -3.431 763 2HG2 ILE 92 HG22 ILE 92 6.599 2.798 -4.703 764 3HG2 ILE 92 HG23 ILE 92 6.290 3.189 -3.011 765 1HD1 ILE 92 HD11 ILE 92 4.637 3.776 -3.877 766 2HD1 ILE 92 HD12 ILE 92 2.983 3.445 -4.393 767 3HD1 ILE 92 HD13 ILE 92 3.511 2.985 -2.775 768 H TYR 93 H TYR 93 8.609 0.387 -4.340 769 HA TYR 93 HA TYR 93 9.078 -1.335 -1.944 770 1HB TYR 93 HB2 TYR 93 10.638 -1.357 -4.546 771 2HB TYR 93 HB3 TYR 93 11.154 -2.172 -3.070 772 HD1 TYR 93 HD1 TYR 93 8.614 -2.102 -5.757 773 HD2 TYR 93 HD2 TYR 93 10.072 -4.194 -2.300 774 HE1 TYR 93 HE1 TYR 93 7.198 -4.053 -6.337 775 HE2 TYR 93 HE2 TYR 93 8.657 -6.144 -2.883 776 HH TYR 93 HH TYR 93 7.628 -7.030 -5.232 777 H ALA 94 H ALA 94 10.661 -0.524 -0.549 778 HA ALA 94 HA ALA 94 12.073 1.957 -1.441 779 1HB ALA 94 HB1 ALA 94 10.227 1.561 0.791 780 2HB ALA 94 HB2 ALA 94 11.783 2.200 1.318 781 3HB ALA 94 HB3 ALA 94 10.842 3.063 0.102 782 H ASP 95 H ASP 95 14.253 1.738 -1.252 783 HA ASP 95 HA ASP 95 16.339 0.943 -0.528 784 1HB ASP 95 HB2 ASP 95 14.596 0.694 1.882 785 2HB ASP 95 HB3 ASP 95 16.131 -0.175 1.901 786 H GLY 96 H GLY 96 14.463 -0.778 -2.029 787 1HA GLY 96 HA2 GLY 96 14.579 -2.983 -2.851 788 2HA GLY 96 HA3 GLY 96 15.906 -3.279 -1.727 789 H LYS 97 H LYS 97 12.835 -2.028 -0.604 790 HA LYS 97 HA LYS 97 12.230 -4.720 0.551 791 1HB LYS 97 HB2 LYS 97 13.048 -2.510 2.003 792 2HB LYS 97 HB3 LYS 97 11.290 -2.439 2.137 793 1HG LYS 97 HG2 LYS 97 11.166 -4.386 3.336 794 2HG LYS 97 HG3 LYS 97 12.521 -5.120 2.480 795 1HD LYS 97 HD2 LYS 97 13.576 -2.904 3.892 796 2HD LYS 97 HD3 LYS 97 12.526 -3.763 5.021 797 1HE LYS 97 HE2 LYS 97 14.398 -5.357 3.309 798 2HE LYS 97 HE3 LYS 97 15.050 -4.504 4.708 799 1HZ LYS 97 HZ1 LYS 97 13.377 -5.597 6.087 800 2HZ LYS 97 HZ2 LYS 97 12.805 -6.447 4.737 801 3HZ LYS 97 HZ3 LYS 97 14.380 -6.727 5.311 802 H MET 98 H MET 98 9.901 -5.002 1.076 803 HA MET 98 HA MET 98 8.236 -3.720 -1.002 804 1HB MET 98 HB2 MET 98 8.189 -6.207 -0.599 805 2HB MET 98 HB3 MET 98 7.466 -5.881 0.977 806 1HG MET 98 HG2 MET 98 5.636 -4.621 -0.198 807 2HG MET 98 HG3 MET 98 6.318 -5.159 -1.733 808 1HE MET 98 HE1 MET 98 7.179 -7.332 -1.997 809 2HE MET 98 HE2 MET 98 6.580 -8.853 -1.320 810 3HE MET 98 HE3 MET 98 5.704 -8.061 -2.627 811 H VAL 99 H VAL 99 7.271 -1.826 -0.447 812 HA VAL 99 HA VAL 99 6.901 -0.955 2.264 813 HB VAL 99 HB VAL 99 5.246 0.075 -0.031 814 1HG1 VAL 99 HG11 VAL 99 6.647 1.371 2.329 815 2HG1 VAL 99 HG12 VAL 99 5.671 2.223 1.131 816 3HG1 VAL 99 HG13 VAL 99 4.917 1.044 2.204 817 1HG2 VAL 99 HG21 VAL 99 8.140 -0.142 0.064 818 2HG2 VAL 99 HG22 VAL 99 7.115 0.466 -1.237 819 3HG2 VAL 99 HG23 VAL 99 7.641 1.551 0.050 820 H ASN 100 H ASN 100 4.774 -2.569 -0.065 821 HA ASN 100 HA ASN 100 2.326 -2.325 1.337 822 1HB ASN 100 HB2 ASN 100 3.312 -4.685 -0.296 823 2HB ASN 100 HB3 ASN 100 1.630 -4.349 0.118 824 1HD2 ASN 100 HD21 ASN 100 0.641 -3.590 -1.767 825 2HD2 ASN 100 HD22 ASN 100 1.295 -2.406 -2.794 826 H GLU 101 H GLU 101 4.742 -4.965 1.526 827 HA GLU 101 HA GLU 101 3.417 -6.356 3.650 828 1HB GLU 101 HB2 GLU 101 5.280 -7.243 2.149 829 2HB GLU 101 HB3 GLU 101 6.401 -6.333 3.159 830 1HG GLU 101 HG2 GLU 101 5.306 -7.539 5.156 831 2HG GLU 101 HG3 GLU 101 4.618 -8.635 3.956 832 H ALA 102 H ALA 102 5.478 -3.547 3.588 833 HA ALA 102 HA ALA 102 6.394 -3.581 6.287 834 1HB ALA 102 HB1 ALA 102 6.610 -1.849 4.111 835 2HB ALA 102 HB2 ALA 102 5.756 -0.905 5.330 836 3HB ALA 102 HB3 ALA 102 7.328 -1.611 5.703 837 H LEU 103 H LEU 103 3.603 -1.825 4.910 838 HA LEU 103 HA LEU 103 2.545 -0.973 7.418 839 1HB LEU 103 HB2 LEU 103 1.053 -1.570 4.842 840 2HB LEU 103 HB3 LEU 103 0.433 -0.611 6.189 841 HG LEU 103 HG LEU 103 3.008 0.414 5.499 842 1HD1 LEU 103 HD11 LEU 103 2.440 -0.773 3.298 843 2HD1 LEU 103 HD12 LEU 103 1.125 0.390 3.136 844 3HD1 LEU 103 HD13 LEU 103 2.797 0.950 3.186 845 1HD2 LEU 103 HD21 LEU 103 0.425 1.307 6.155 846 2HD2 LEU 103 HD22 LEU 103 1.854 2.312 5.907 847 3HD2 LEU 103 HD23 LEU 103 0.755 1.994 4.564 848 H VAL 104 H VAL 104 1.862 -3.873 5.461 849 HA VAL 104 HA VAL 104 -0.192 -4.957 7.078 850 HB VAL 104 HB VAL 104 1.956 -6.354 5.459 851 1HG1 VAL 104 HG11 VAL 104 0.248 -7.465 7.390 852 2HG1 VAL 104 HG12 VAL 104 -0.526 -7.812 5.843 853 3HG1 VAL 104 HG13 VAL 104 1.132 -8.338 6.138 854 1HG2 VAL 104 HG21 VAL 104 -0.130 -4.756 4.626 855 2HG2 VAL 104 HG22 VAL 104 0.609 -6.030 3.655 856 3HG2 VAL 104 HG23 VAL 104 -0.855 -6.363 4.579 857 H ARG 105 H ARG 105 3.315 -4.998 7.484 858 HA ARG 105 HA ARG 105 3.325 -6.943 9.621 859 1HB ARG 105 HB2 ARG 105 5.258 -5.077 8.370 860 2HB ARG 105 HB3 ARG 105 5.586 -5.500 10.051 861 1HG ARG 105 HG2 ARG 105 5.365 -7.913 9.443 862 2HG ARG 105 HG3 ARG 105 5.179 -7.437 7.756 863 1HD ARG 105 HD2 ARG 105 7.395 -6.365 7.801 864 2HD ARG 105 HD3 ARG 105 7.583 -6.813 9.496 865 HE ARG 105 HE ARG 105 7.207 -9.247 8.445 866 1HH1 ARG 105 HH11 ARG 105 9.583 -6.885 8.143 867 2HH1 ARG 105 HH12 ARG 105 10.472 -7.693 6.894 868 1HH2 ARG 105 HH21 ARG 105 8.084 -10.166 6.433 869 2HH2 ARG 105 HH22 ARG 105 9.622 -9.552 5.925 870 H GLN 106 H GLN 106 3.186 -3.397 9.493 871 HA GLN 106 HA GLN 106 3.275 -3.099 12.385 872 1HB GLN 106 HB2 GLN 106 3.413 -1.378 10.142 873 2HB GLN 106 HB3 GLN 106 1.993 -0.876 11.060 874 1HG GLN 106 HG2 GLN 106 3.975 0.305 11.885 875 2HG GLN 106 HG3 GLN 106 3.380 -0.804 13.122 876 1HE2 GLN 106 HE21 GLN 106 4.840 -2.370 13.890 877 2HE2 GLN 106 HE22 GLN 106 6.355 -2.690 13.192 878 H GLY 107 H GLY 107 0.912 -4.198 10.248 879 1HA GLY 107 HA2 GLY 107 -1.318 -4.816 10.679 880 2HA GLY 107 HA3 GLY 107 -1.102 -4.251 12.336 881 H LEU 108 H LEU 108 -0.601 -2.346 9.384 882 HA LEU 108 HA LEU 108 -2.791 -0.542 10.332 883 1HB LEU 108 HB2 LEU 108 -0.392 0.119 8.594 884 2HB LEU 108 HB3 LEU 108 -1.608 1.266 9.158 885 HG LEU 108 HG LEU 108 0.069 -0.417 11.036 886 1HD1 LEU 108 HD11 LEU 108 1.005 1.641 9.401 887 2HD1 LEU 108 HD12 LEU 108 0.672 2.436 10.940 888 3HD1 LEU 108 HD13 LEU 108 1.772 1.059 10.879 889 1HD2 LEU 108 HD21 LEU 108 -1.682 2.038 11.382 890 2HD2 LEU 108 HD22 LEU 108 -2.003 0.421 12.008 891 3HD2 LEU 108 HD23 LEU 108 -0.659 1.364 12.650 892 H ALA 109 H ALA 109 -1.341 -2.080 7.478 893 HA ALA 109 HA ALA 109 -3.690 -1.224 5.861 894 1HB ALA 109 HB1 ALA 109 -0.894 -1.780 5.291 895 2HB ALA 109 HB2 ALA 109 -1.954 -2.726 4.246 896 3HB ALA 109 HB3 ALA 109 -2.095 -0.970 4.285 897 H LYS 110 H LYS 110 -5.266 -2.687 5.337 898 HA LYS 110 HA LYS 110 -4.855 -5.497 6.237 899 1HB LYS 110 HB2 LYS 110 -7.212 -3.698 5.945 900 2HB LYS 110 HB3 LYS 110 -7.476 -5.413 5.629 901 1HG LYS 110 HG2 LYS 110 -6.650 -6.021 7.811 902 2HG LYS 110 HG3 LYS 110 -6.109 -4.370 8.123 903 1HD LYS 110 HD2 LYS 110 -8.132 -3.854 8.954 904 2HD LYS 110 HD3 LYS 110 -8.879 -4.279 7.414 905 1HE LYS 110 HE2 LYS 110 -9.599 -6.289 8.185 906 2HE LYS 110 HE3 LYS 110 -8.082 -6.608 9.025 907 1HZ LYS 110 HZ1 LYS 110 -9.909 -4.554 10.065 908 2HZ LYS 110 HZ2 LYS 110 -10.238 -6.192 10.370 909 3HZ LYS 110 HZ3 LYS 110 -8.777 -5.510 10.898 910 H VAL 111 H VAL 111 -4.638 -7.094 4.730 911 HA VAL 111 HA VAL 111 -4.365 -6.551 1.956 912 HB VAL 111 HB VAL 111 -4.982 -9.147 3.399 913 1HG1 VAL 111 HG11 VAL 111 -5.640 -9.072 0.934 914 2HG1 VAL 111 HG12 VAL 111 -3.930 -8.824 0.579 915 3HG1 VAL 111 HG13 VAL 111 -4.459 -10.308 1.371 916 1HG2 VAL 111 HG21 VAL 111 -2.783 -7.831 3.783 917 2HG2 VAL 111 HG22 VAL 111 -2.646 -9.532 3.340 918 3HG2 VAL 111 HG23 VAL 111 -2.385 -8.281 2.125 919 H ALA 112 H ALA 112 -5.837 -6.546 0.274 920 HA ALA 112 HA ALA 112 -8.433 -7.773 0.395 921 1HB ALA 112 HB1 ALA 112 -8.220 -5.247 1.707 922 2HB ALA 112 HB2 ALA 112 -9.146 -5.004 0.226 923 3HB ALA 112 HB3 ALA 112 -9.676 -6.197 1.412 924 H TYR 113 H TYR 113 -9.876 -6.350 -1.395 925 HA TYR 113 HA TYR 113 -10.017 -6.070 -3.728 926 1HB TYR 113 HB2 TYR 113 -7.563 -4.448 -3.006 927 2HB TYR 113 HB3 TYR 113 -8.302 -4.418 -4.607 928 HD1 TYR 113 HD1 TYR 113 -11.154 -4.532 -4.074 929 HD2 TYR 113 HD2 TYR 113 -8.075 -2.415 -1.956 930 HE1 TYR 113 HE1 TYR 113 -12.833 -2.890 -3.274 931 HE2 TYR 113 HE2 TYR 113 -9.753 -0.775 -1.155 932 HH TYR 113 HH TYR 113 -13.154 -0.971 -2.195 933 H VAL 114 H VAL 114 -9.576 -8.322 -4.222 934 HA VAL 114 HA VAL 114 -6.786 -8.791 -5.199 935 HB VAL 114 HB VAL 114 -8.845 -10.784 -4.199 936 1HG1 VAL 114 HG11 VAL 114 -6.759 -11.146 -6.065 937 2HG1 VAL 114 HG12 VAL 114 -6.157 -11.796 -4.540 938 3HG1 VAL 114 HG13 VAL 114 -7.664 -12.406 -5.223 939 1HG2 VAL 114 HG21 VAL 114 -6.177 -9.842 -3.098 940 2HG2 VAL 114 HG22 VAL 114 -7.765 -9.539 -2.393 941 3HG2 VAL 114 HG23 VAL 114 -7.116 -11.179 -2.436 942 H TYR 115 H TYR 115 -7.789 -7.588 -7.139 943 HA TYR 115 HA TYR 115 -9.601 -9.274 -8.761 944 1HB TYR 115 HB2 TYR 115 -8.395 -6.547 -9.323 945 2HB TYR 115 HB3 TYR 115 -9.613 -7.351 -10.312 946 HD1 TYR 115 HD1 TYR 115 -11.798 -8.102 -9.080 947 HD2 TYR 115 HD2 TYR 115 -9.070 -5.152 -7.563 948 HE1 TYR 115 HE1 TYR 115 -13.585 -7.204 -7.612 949 HE2 TYR 115 HE2 TYR 115 -10.858 -4.253 -6.096 950 HH TYR 115 HH TYR 115 -13.692 -5.900 -5.434 951 H LYS 116 H LYS 116 -8.641 -10.858 -9.930 952 HA LYS 116 HA LYS 116 -5.828 -10.870 -10.582 953 1HB LYS 116 HB2 LYS 116 -8.037 -12.536 -11.821 954 2HB LYS 116 HB3 LYS 116 -6.319 -12.927 -11.771 955 1HG LYS 116 HG2 LYS 116 -6.378 -13.103 -9.345 956 2HG LYS 116 HG3 LYS 116 -8.061 -12.574 -9.317 957 1HD LYS 116 HD2 LYS 116 -8.077 -14.973 -9.132 958 2HD LYS 116 HD3 LYS 116 -8.611 -14.577 -10.766 959 1HE LYS 116 HE2 LYS 116 -6.510 -15.150 -11.709 960 2HE LYS 116 HE3 LYS 116 -5.712 -15.142 -10.137 961 1HZ LYS 116 HZ1 LYS 116 -7.957 -16.972 -10.481 962 2HZ LYS 116 HZ2 LYS 116 -6.518 -17.360 -11.300 963 3HZ LYS 116 HZ3 LYS 116 -6.510 -17.175 -9.613 964 HA PRO 117 HA PRO 117 -4.763 -12.001 -12.112 965 1HB PRO 117 HB2 PRO 117 -2.683 -11.371 -13.761 966 2HB PRO 117 HB3 PRO 117 -4.033 -12.403 -14.264 967 1HG PRO 117 HG2 PRO 117 -3.421 -9.609 -15.038 968 2HG PRO 117 HG3 PRO 117 -4.365 -10.833 -15.898 969 1HD PRO 117 HD2 PRO 117 -5.381 -8.663 -14.339 970 2HD PRO 117 HD3 PRO 117 -6.315 -9.985 -15.072 971 H ASN 118 H ASN 118 -5.146 -9.007 -11.298 972 HA ASN 118 HA ASN 118 -2.399 -8.195 -10.640 973 1HB ASN 118 HB2 ASN 118 -5.117 -7.004 -10.418 974 2HB ASN 118 HB3 ASN 118 -3.928 -6.475 -9.228 975 1HD2 ASN 118 HD21 ASN 118 -4.928 -4.710 -11.278 976 2HD2 ASN 118 HD22 ASN 118 -3.642 -4.336 -12.320 977 H ASN 119 H ASN 119 -2.058 -10.280 -9.390 978 HA ASN 119 HA ASN 119 -2.512 -9.763 -6.540 979 1HB ASN 119 HB2 ASN 119 -3.676 -11.842 -6.072 980 2HB ASN 119 HB3 ASN 119 -4.595 -10.955 -7.289 981 1HD2 ASN 119 HD21 ASN 119 -4.848 -13.792 -7.060 982 2HD2 ASN 119 HD22 ASN 119 -4.177 -14.508 -8.445 983 H THR 120 H THR 120 -0.208 -10.016 -8.308 984 HA THR 120 HA THR 120 1.025 -12.587 -8.080 985 HB THR 120 HB THR 120 2.392 -9.886 -8.225 986 HG1 THR 120 HG1 THR 120 1.684 -9.812 -10.182 987 1HG2 THR 120 HG21 THR 120 3.469 -12.410 -7.873 988 2HG2 THR 120 HG22 THR 120 3.553 -12.184 -9.620 989 3HG2 THR 120 HG23 THR 120 4.321 -11.018 -8.543 990 H HIS 121 H HIS 121 0.431 -10.153 -5.730 991 HA HIS 121 HA HIS 121 2.393 -11.479 -3.900 992 1HB HIS 121 HB2 HIS 121 1.508 -8.604 -4.116 993 2HB HIS 121 HB3 HIS 121 2.182 -9.236 -2.613 994 HD1 HIS 121 HD1 HIS 121 4.429 -10.994 -3.524 995 HD2 HIS 121 HD2 HIS 121 3.625 -7.337 -5.357 996 HE1 HIS 121 HE1 HIS 121 6.570 -10.284 -4.676 997 H GLU 122 H GLU 122 -0.321 -12.383 -4.384 998 HA GLU 122 HA GLU 122 -1.934 -11.455 -2.117 999 1HB GLU 122 HB2 GLU 122 -3.102 -12.133 -4.133 1000 2HB GLU 122 HB3 GLU 122 -2.314 -13.711 -4.108 1001 1HG GLU 122 HG2 GLU 122 -4.601 -13.870 -3.207 1002 2HG GLU 122 HG3 GLU 122 -3.412 -14.220 -1.951 1003 H GLN 123 H GLN 123 -0.046 -14.348 -2.969 1004 HA GLN 123 HA GLN 123 -0.712 -15.842 -0.609 1005 1HB GLN 123 HB2 GLN 123 1.243 -16.033 -2.807 1006 2HB GLN 123 HB3 GLN 123 1.804 -16.721 -1.282 1007 1HG GLN 123 HG2 GLN 123 -0.521 -17.868 -1.187 1008 2HG GLN 123 HG3 GLN 123 -0.621 -17.481 -2.906 1009 1HE2 GLN 123 HE21 GLN 123 0.112 -19.167 -4.192 1010 2HE2 GLN 123 HE22 GLN 123 1.338 -20.262 -3.768 1011 H LEU 124 H LEU 124 2.239 -13.949 -1.384 1012 HA LEU 124 HA LEU 124 3.448 -14.173 1.166 1013 1HB LEU 124 HB2 LEU 124 4.661 -13.258 -0.745 1014 2HB LEU 124 HB3 LEU 124 3.564 -11.879 -0.815 1015 HG LEU 124 HG LEU 124 4.329 -11.054 1.306 1016 1HD1 LEU 124 HD11 LEU 124 5.503 -13.804 1.517 1017 2HD1 LEU 124 HD12 LEU 124 6.299 -12.478 2.365 1018 3HD1 LEU 124 HD13 LEU 124 4.618 -12.871 2.724 1019 1HD2 LEU 124 HD21 LEU 124 5.866 -10.984 -0.856 1020 2HD2 LEU 124 HD22 LEU 124 6.470 -10.389 0.690 1021 3HD2 LEU 124 HD23 LEU 124 6.920 -11.999 0.129 1022 H LEU 125 H LEU 125 1.515 -11.404 -0.054 1023 HA LEU 125 HA LEU 125 1.336 -10.013 2.395 1024 1HB LEU 125 HB2 LEU 125 -0.581 -10.208 0.062 1025 2HB LEU 125 HB3 LEU 125 -0.874 -9.141 1.435 1026 HG LEU 125 HG LEU 125 1.484 -9.075 -0.466 1027 1HD1 LEU 125 HD11 LEU 125 -1.048 -7.725 -0.328 1028 2HD1 LEU 125 HD12 LEU 125 0.239 -6.553 -0.046 1029 3HD1 LEU 125 HD13 LEU 125 0.238 -7.524 -1.517 1030 1HD2 LEU 125 HD21 LEU 125 1.079 -7.923 2.269 1031 2HD2 LEU 125 HD22 LEU 125 2.556 -8.527 1.517 1032 3HD2 LEU 125 HD23 LEU 125 1.922 -6.943 1.068 1033 H ARG 126 H ARG 126 -0.178 -12.962 1.407 1034 HA ARG 126 HA ARG 126 -2.417 -12.878 3.225 1035 1HB ARG 126 HB2 ARG 126 -1.354 -14.685 1.282 1036 2HB ARG 126 HB3 ARG 126 -1.585 -15.574 2.789 1037 1HG ARG 126 HG2 ARG 126 -3.760 -13.720 1.917 1038 2HG ARG 126 HG3 ARG 126 -3.588 -15.251 1.057 1039 1HD ARG 126 HD2 ARG 126 -5.023 -15.851 2.800 1040 2HD ARG 126 HD3 ARG 126 -3.448 -16.275 3.470 1041 HE ARG 126 HE ARG 126 -3.861 -13.632 4.255 1042 1HH1 ARG 126 HH11 ARG 126 -3.791 -16.197 5.994 1043 2HH1 ARG 126 HH12 ARG 126 -5.277 -16.017 6.866 1044 1HH2 ARG 126 HH21 ARG 126 -6.531 -13.574 4.750 1045 2HH2 ARG 126 HH22 ARG 126 -6.828 -14.531 6.163 1046 H LYS 127 H LYS 127 0.525 -14.929 3.425 1047 HA LYS 127 HA LYS 127 0.194 -15.659 6.129 1048 1HB LYS 127 HB2 LYS 127 2.475 -16.359 6.095 1049 2HB LYS 127 HB3 LYS 127 1.894 -16.572 4.443 1050 1HG LYS 127 HG2 LYS 127 2.761 -14.072 4.181 1051 2HG LYS 127 HG3 LYS 127 3.791 -14.533 5.538 1052 1HD LYS 127 HD2 LYS 127 3.645 -16.549 3.390 1053 2HD LYS 127 HD3 LYS 127 4.391 -15.024 2.909 1054 1HE LYS 127 HE2 LYS 127 5.898 -15.163 4.880 1055 2HE LYS 127 HE3 LYS 127 5.186 -16.723 5.292 1056 1HZ LYS 127 HZ1 LYS 127 6.448 -16.149 2.671 1057 2HZ LYS 127 HZ2 LYS 127 7.288 -16.832 3.981 1058 3HZ LYS 127 HZ3 LYS 127 5.981 -17.662 3.288 1059 H SER 128 H SER 128 1.557 -12.729 4.731 1060 HA SER 128 HA SER 128 2.760 -11.718 7.135 1061 1HB SER 128 HB2 SER 128 1.574 -10.056 4.902 1062 2HB SER 128 HB3 SER 128 2.884 -9.612 5.991 1063 HG SER 128 HG SER 128 4.212 -11.013 4.972 1064 H GLU 129 H GLU 129 -0.460 -11.224 5.683 1065 HA GLU 129 HA GLU 129 -1.429 -9.412 7.661 1066 1HB GLU 129 HB2 GLU 129 -2.554 -9.860 5.477 1067 2HB GLU 129 HB3 GLU 129 -3.021 -11.452 6.076 1068 1HG GLU 129 HG2 GLU 129 -4.840 -9.774 6.348 1069 2HG GLU 129 HG3 GLU 129 -4.296 -10.426 7.895 1070 H ALA 130 H ALA 130 -1.332 -12.952 7.542 1071 HA ALA 130 HA ALA 130 -2.986 -13.443 9.813 1072 1HB ALA 130 HB1 ALA 130 -1.297 -14.971 8.081 1073 2HB ALA 130 HB2 ALA 130 -0.882 -15.371 9.747 1074 3HB ALA 130 HB3 ALA 130 -2.542 -15.558 9.183 1075 H GLN 131 H GLN 131 0.521 -12.936 9.536 1076 HA GLN 131 HA GLN 131 1.117 -13.265 12.311 1077 1HB GLN 131 HB2 GLN 131 2.730 -13.035 10.271 1078 2HB GLN 131 HB3 GLN 131 2.584 -11.300 10.557 1079 1HG GLN 131 HG2 GLN 131 3.259 -11.682 12.936 1080 2HG GLN 131 HG3 GLN 131 3.524 -13.383 12.551 1081 1HE2 GLN 131 HE21 GLN 131 4.513 -10.127 11.338 1082 2HE2 GLN 131 HE22 GLN 131 6.093 -10.598 10.937 1083 H ALA 132 H ALA 132 -0.145 -10.570 10.447 1084 HA ALA 132 HA ALA 132 0.233 -8.551 12.471 1085 1HB ALA 132 HB1 ALA 132 -1.715 -8.762 10.156 1086 2HB ALA 132 HB2 ALA 132 -1.552 -7.328 11.171 1087 3HB ALA 132 HB3 ALA 132 -0.193 -7.870 10.186 1088 H LYS 133 H LYS 133 -2.282 -10.930 11.799 1089 HA LYS 133 HA LYS 133 -4.264 -9.877 13.585 1090 1HB LYS 133 HB2 LYS 133 -3.865 -12.281 12.007 1091 2HB LYS 133 HB3 LYS 133 -4.530 -12.677 13.593 1092 1HG LYS 133 HG2 LYS 133 -6.340 -11.058 13.270 1093 2HG LYS 133 HG3 LYS 133 -5.656 -10.576 11.716 1094 1HD LYS 133 HD2 LYS 133 -6.010 -13.464 11.883 1095 2HD LYS 133 HD3 LYS 133 -7.531 -12.604 12.129 1096 1HE LYS 133 HE2 LYS 133 -7.211 -11.361 10.054 1097 2HE LYS 133 HE3 LYS 133 -5.629 -12.105 9.821 1098 1HZ LYS 133 HZ1 LYS 133 -6.943 -14.294 9.972 1099 2HZ LYS 133 HZ2 LYS 133 -8.300 -13.333 9.622 1100 3HZ LYS 133 HZ3 LYS 133 -7.007 -13.403 8.527 1101 H LYS 134 H LYS 134 -1.948 -12.578 14.062 1102 HA LYS 134 HA LYS 134 -2.483 -12.848 16.860 1103 1HB LYS 134 HB2 LYS 134 0.201 -13.481 15.661 1104 2HB LYS 134 HB3 LYS 134 -0.705 -14.365 16.887 1105 1HG LYS 134 HG2 LYS 134 -2.471 -14.665 14.960 1106 2HG LYS 134 HG3 LYS 134 -1.089 -14.339 13.914 1107 1HD LYS 134 HD2 LYS 134 -0.021 -16.295 14.477 1108 2HD LYS 134 HD3 LYS 134 -0.678 -16.304 16.114 1109 1HE LYS 134 HE2 LYS 134 -1.891 -18.040 15.161 1110 2HE LYS 134 HE3 LYS 134 -2.972 -16.681 14.852 1111 1HZ LYS 134 HZ1 LYS 134 -1.328 -16.591 12.730 1112 2HZ LYS 134 HZ2 LYS 134 -1.422 -18.263 13.000 1113 3HZ LYS 134 HZ3 LYS 134 -2.841 -17.364 12.743 1114 H GLU 135 H GLU 135 -0.542 -10.618 15.037 1115 HA GLU 135 HA GLU 135 1.197 -9.807 17.202 1116 1HB GLU 135 HB2 GLU 135 0.587 -8.900 14.460 1117 2HB GLU 135 HB3 GLU 135 1.070 -7.616 15.567 1118 1HG GLU 135 HG2 GLU 135 3.087 -8.901 16.182 1119 2HG GLU 135 HG3 GLU 135 2.607 -10.183 15.069 1120 H LYS 136 H LYS 136 -2.020 -8.901 16.140 1121 HA LYS 136 HA LYS 136 -3.612 -7.476 17.108 1122 1HB LYS 136 HB2 LYS 136 -1.927 -8.431 19.373 1123 2HB LYS 136 HB3 LYS 136 -2.978 -7.051 19.688 1124 1HG LYS 136 HG2 LYS 136 -4.932 -8.266 19.182 1125 2HG LYS 136 HG3 LYS 136 -4.038 -9.514 18.313 1126 1HD LYS 136 HD2 LYS 136 -3.165 -10.439 20.324 1127 2HD LYS 136 HD3 LYS 136 -3.636 -9.024 21.268 1128 1HE LYS 136 HE2 LYS 136 -6.048 -9.791 20.231 1129 2HE LYS 136 HE3 LYS 136 -5.251 -11.352 20.430 1130 1HZ LYS 136 HZ1 LYS 136 -4.750 -9.749 22.689 1131 2HZ LYS 136 HZ2 LYS 136 -6.424 -9.777 22.398 1132 3HZ LYS 136 HZ3 LYS 136 -5.576 -11.231 22.602 1133 H LEU 137 H LEU 137 -2.122 -5.971 15.596 1134 HA LEU 137 HA LEU 137 -1.011 -3.783 17.301 1135 1HB LEU 137 HB2 LEU 137 -0.011 -5.054 14.970 1136 2HB LEU 137 HB3 LEU 137 -0.467 -3.416 14.498 1137 HG LEU 137 HG LEU 137 1.036 -3.797 17.060 1138 1HD1 LEU 137 HD11 LEU 137 1.994 -4.700 14.512 1139 2HD1 LEU 137 HD12 LEU 137 2.903 -3.262 14.977 1140 3HD1 LEU 137 HD13 LEU 137 2.853 -4.658 16.052 1141 1HD2 LEU 137 HD21 LEU 137 0.042 -1.621 15.774 1142 2HD2 LEU 137 HD22 LEU 137 1.462 -1.557 16.820 1143 3HD2 LEU 137 HD23 LEU 137 1.659 -1.680 15.071 1144 H ASN 138 H ASN 138 -2.163 -1.922 17.409 1145 HA ASN 138 HA ASN 138 -3.986 -0.471 17.049 1146 1HB ASN 138 HB2 ASN 138 -2.877 -0.856 14.255 1147 2HB ASN 138 HB3 ASN 138 -4.031 0.404 14.695 1148 1HD2 ASN 138 HD21 ASN 138 -0.737 -0.168 14.354 1149 2HD2 ASN 138 HD22 ASN 138 -0.149 1.061 15.367 1150 H ILE 139 H ILE 139 -4.464 -1.784 13.844 1151 HA ILE 139 HA ILE 139 -7.228 -2.180 14.114 1152 HB ILE 139 HB ILE 139 -5.250 -3.670 12.363 1153 1HG1 ILE 139 HG12 ILE 139 -7.156 -1.623 11.336 1154 2HG1 ILE 139 HG13 ILE 139 -5.805 -1.035 12.307 1155 1HG2 ILE 139 HG21 ILE 139 -8.238 -3.750 12.576 1156 2HG2 ILE 139 HG22 ILE 139 -7.502 -3.868 10.977 1157 3HG2 ILE 139 HG23 ILE 139 -7.107 -5.055 12.221 1158 1HD1 ILE 139 HD11 ILE 139 -4.526 -2.819 10.689 1159 2HD1 ILE 139 HD12 ILE 139 -5.799 -2.247 9.609 1160 3HD1 ILE 139 HD13 ILE 139 -4.672 -1.098 10.329 1161 H TRP 140 H TRP 140 -4.872 -4.871 14.014 1162 HA TRP 140 HA TRP 140 -6.731 -6.721 15.225 1163 1HB TRP 140 HB2 TRP 140 -3.731 -7.059 15.190 1164 2HB TRP 140 HB3 TRP 140 -4.977 -8.304 15.086 1165 HD1 TRP 140 HD1 TRP 140 -2.875 -6.053 12.986 1166 HE1 TRP 140 HE1 TRP 140 -3.525 -6.295 10.502 1167 HE3 TRP 140 HE3 TRP 140 -7.186 -8.743 13.463 1168 HZ2 TRP 140 HZ2 TRP 140 -5.602 -7.476 8.926 1169 HZ3 TRP 140 HZ3 TRP 140 -8.480 -9.413 11.459 1170 HH2 TRP 140 HH2 TRP 140 -7.695 -8.783 9.193 1171 H SER 141 H SER 141 -5.012 -4.172 16.546 1172 HA SER 141 HA SER 141 -4.442 -5.481 19.128 1173 1HB SER 141 HB2 SER 141 -2.954 -3.696 18.111 1174 2HB SER 141 HB3 SER 141 -4.243 -2.539 18.433 1175 HG SER 141 HG SER 141 -3.165 -4.250 20.418 1176 H GLU 142 H GLU 142 -7.176 -4.291 17.674 1177 HA GLU 142 HA GLU 142 -8.320 -2.759 19.845 1178 1HB GLU 142 HB2 GLU 142 -9.539 -4.189 17.472 1179 2HB GLU 142 HB3 GLU 142 -10.498 -3.262 18.626 1180 1HG GLU 142 HG2 GLU 142 -8.706 -1.384 18.145 1181 2HG GLU 142 HG3 GLU 142 -8.456 -2.295 16.654 1182 H ASP 143 H ASP 143 -8.814 -6.130 18.742 1183 HA ASP 143 HA ASP 143 -10.635 -7.026 20.631 1184 1HB ASP 143 HB2 ASP 143 -8.500 -8.248 19.044 1185 2HB ASP 143 HB3 ASP 143 -8.793 -9.103 20.559 1186 H ASN 144 H ASN 144 -10.492 -7.807 22.785 1187 HA ASN 144 HA ASN 144 -9.686 -7.838 24.989 1188 1HB ASN 144 HB2 ASN 144 -7.968 -9.330 24.248 1189 2HB ASN 144 HB3 ASN 144 -7.096 -8.030 23.434 1190 1HD2 ASN 144 HD21 ASN 144 -5.406 -7.135 24.621 1191 2HD2 ASN 144 HD22 ASN 144 -5.249 -7.221 26.309 1192 H ALA 145 H ALA 145 -10.416 -5.716 25.502 1193 HA ALA 145 HA ALA 145 -8.272 -3.630 25.405 1194 1HB ALA 145 HB1 ALA 145 -10.887 -3.546 24.291 1195 2HB ALA 145 HB2 ALA 145 -10.885 -2.461 25.682 1196 3HB ALA 145 HB3 ALA 145 -9.713 -2.234 24.383 1197 H ASP 146 H ASP 146 -8.179 -5.217 27.558 1198 HA ASP 146 HA ASP 146 -8.252 -5.185 29.902 1199 1HB ASP 146 HB2 ASP 146 -9.368 -2.402 29.850 1200 2HB ASP 146 HB3 ASP 146 -8.149 -3.096 30.918 1201 H SER 147 H SER 147 -9.853 -4.970 31.756 1202 HA SER 147 HA SER 147 -12.680 -4.881 30.831 1203 1HB SER 147 HB2 SER 147 -11.210 -7.248 31.782 1204 2HB SER 147 HB3 SER 147 -12.727 -6.962 32.629 1205 HG SER 147 HG SER 147 -13.628 -7.777 30.922 1206 H GLY 148 H GLY 148 -12.177 -2.763 32.075 1207 1HA GLY 148 HA2 GLY 148 -12.948 -1.557 33.970 1208 2HA GLY 148 HA3 GLY 148 -13.218 -3.091 34.800 1209 H GLN 149 H GLN 149 -11.943 -0.903 36.064 1210 HA GLN 149 HA GLN 149 -9.164 -1.980 36.338 1211 1HB GLN 149 HB2 GLN 149 -9.277 0.302 35.271 1212 2HB GLN 149 HB3 GLN 149 -10.006 0.901 36.761 1213 1HG GLN 149 HG2 GLN 149 -8.052 0.399 38.038 1214 2HG GLN 149 HG3 GLN 149 -7.362 -0.564 36.730 1215 1HE2 GLN 149 HE21 GLN 149 -8.300 2.807 37.551 1216 2HE2 GLN 149 HE22 GLN 149 -7.179 3.535 36.504 1217 HN3 PTP 150 H3 PTP 150 -9.696 -3.490 -9.474 1218 1H5M PTP 150 H51 PTP 150 -6.262 -1.147 -6.633 1219 2H5M PTP 150 H52 PTP 150 -6.465 -2.849 -6.149 1220 3H5M PTP 150 H53 PTP 150 -7.154 -1.550 -5.147 1221 H6 PTP 150 H6 PTP 150 -9.146 -0.427 -5.811 1222 H1* PTP 150 H1' PTP 150 -12.126 -0.054 -7.877 1223 2H2* PTP 150 H2' PTP 150 -11.969 -1.680 -5.348 1224 H3* PTP 150 H3' PTP 150 -12.814 0.086 -4.004 1225 H4* PTP 150 H4' PTP 150 -11.803 2.318 -5.227 1226 2H5* PTP 150 H5' PTP 150 -10.369 -0.052 -3.897 Start of MODEL 23 1 1H ALA 1 H1 ALA 1 22.046 -12.557 -16.696 2 2H ALA 1 H2 ALA 1 20.568 -13.067 -17.362 3 3H ALA 1 H3 ALA 1 22.029 -13.644 -18.001 4 HA ALA 1 HA ALA 1 21.321 -10.769 -18.009 5 1HB ALA 1 HB1 ALA 1 23.693 -12.110 -18.502 6 2HB ALA 1 HB2 ALA 1 23.016 -11.905 -20.117 7 3HB ALA 1 HB3 ALA 1 23.293 -10.497 -19.091 8 H THR 2 H THR 2 20.138 -10.002 -19.791 9 HA THR 2 HA THR 2 18.598 -10.113 -21.559 10 HB THR 2 HB THR 2 19.815 -12.781 -22.277 11 HG1 THR 2 HG1 THR 2 21.189 -11.183 -23.578 12 1HG2 THR 2 HG21 THR 2 17.834 -11.268 -23.440 13 2HG2 THR 2 HG22 THR 2 19.267 -10.737 -24.320 14 3HG2 THR 2 HG23 THR 2 18.833 -12.446 -24.293 15 H SER 3 H SER 3 16.525 -11.001 -21.924 16 HA SER 3 HA SER 3 14.659 -12.382 -21.527 17 1HB SER 3 HB2 SER 3 16.831 -14.151 -21.410 18 2HB SER 3 HB3 SER 3 15.935 -14.442 -19.922 19 HG SER 3 HG SER 3 14.066 -14.717 -21.183 20 H THR 4 H THR 4 14.088 -10.601 -20.036 21 HA THR 4 HA THR 4 14.695 -11.042 -17.179 22 HB THR 4 HB THR 4 12.736 -8.957 -17.892 23 HG1 THR 4 HG1 THR 4 14.542 -7.678 -18.756 24 1HG2 THR 4 HG21 THR 4 14.583 -9.519 -15.864 25 2HG2 THR 4 HG22 THR 4 15.255 -8.126 -16.710 26 3HG2 THR 4 HG23 THR 4 13.626 -8.047 -16.036 27 H LYS 5 H LYS 5 13.456 -12.562 -16.180 28 HA LYS 5 HA LYS 5 10.554 -12.675 -16.900 29 1HB LYS 5 HB2 LYS 5 11.869 -14.754 -17.372 30 2HB LYS 5 HB3 LYS 5 12.251 -14.858 -15.652 31 1HG LYS 5 HG2 LYS 5 10.360 -16.139 -15.591 32 2HG LYS 5 HG3 LYS 5 9.559 -14.569 -15.517 33 1HD LYS 5 HD2 LYS 5 9.883 -14.834 -18.208 34 2HD LYS 5 HD3 LYS 5 9.678 -16.522 -17.738 35 1HE LYS 5 HE2 LYS 5 7.806 -14.546 -16.527 36 2HE LYS 5 HE3 LYS 5 7.582 -14.919 -18.236 37 1HZ LYS 5 HZ1 LYS 5 7.982 -17.351 -17.120 38 2HZ LYS 5 HZ2 LYS 5 7.082 -16.548 -15.923 39 3HZ LYS 5 HZ3 LYS 5 6.469 -16.687 -17.501 40 H LYS 6 H LYS 6 10.334 -10.852 -15.318 41 HA LYS 6 HA LYS 6 9.433 -11.799 -12.769 42 1HB LYS 6 HB2 LYS 6 12.245 -10.967 -12.964 43 2HB LYS 6 HB3 LYS 6 11.344 -10.109 -11.714 44 1HG LYS 6 HG2 LYS 6 10.726 -12.964 -11.753 45 2HG LYS 6 HG3 LYS 6 12.440 -12.655 -11.470 46 1HD LYS 6 HD2 LYS 6 12.066 -11.684 -9.439 47 2HD LYS 6 HD3 LYS 6 10.576 -10.906 -9.976 48 1HE LYS 6 HE2 LYS 6 10.694 -13.893 -9.609 49 2HE LYS 6 HE3 LYS 6 10.401 -12.831 -8.231 50 1HZ LYS 6 HZ1 LYS 6 8.770 -11.944 -10.287 51 2HZ LYS 6 HZ2 LYS 6 8.610 -13.632 -10.261 52 3HZ LYS 6 HZ3 LYS 6 8.296 -12.728 -8.857 53 H LEU 7 H LEU 7 7.977 -10.355 -14.388 54 HA LEU 7 HA LEU 7 6.846 -8.322 -14.713 55 1HB LEU 7 HB2 LEU 7 7.526 -8.542 -11.849 56 2HB LEU 7 HB3 LEU 7 7.158 -6.905 -12.390 57 HG LEU 7 HG LEU 7 5.395 -9.286 -13.011 58 1HD1 LEU 7 HD11 LEU 7 5.614 -8.806 -10.536 59 2HD1 LEU 7 HD12 LEU 7 4.973 -7.194 -10.859 60 3HD1 LEU 7 HD13 LEU 7 3.981 -8.618 -11.176 61 1HD2 LEU 7 HD21 LEU 7 5.220 -6.298 -13.355 62 2HD2 LEU 7 HD22 LEU 7 4.894 -7.568 -14.535 63 3HD2 LEU 7 HD23 LEU 7 3.750 -7.266 -13.227 64 H HIS 8 H HIS 8 7.334 -5.735 -13.917 65 HA HIS 8 HA HIS 8 10.152 -5.218 -14.770 66 1HB HIS 8 HB2 HIS 8 8.335 -4.911 -16.592 67 2HB HIS 8 HB3 HIS 8 7.843 -3.495 -15.664 68 HD1 HIS 8 HD1 HIS 8 8.979 -1.406 -16.383 69 HD2 HIS 8 HD2 HIS 8 11.370 -4.751 -17.072 70 HE1 HIS 8 HE1 HIS 8 11.102 -0.556 -17.473 71 H LYS 9 H LYS 9 11.058 -4.277 -12.990 72 HA LYS 9 HA LYS 9 9.391 -2.433 -11.354 73 1HB LYS 9 HB2 LYS 9 12.163 -3.512 -10.765 74 2HB LYS 9 HB3 LYS 9 11.093 -2.673 -9.641 75 1HG LYS 9 HG2 LYS 9 9.542 -4.774 -10.647 76 2HG LYS 9 HG3 LYS 9 11.135 -5.485 -10.383 77 1HD LYS 9 HD2 LYS 9 9.935 -3.720 -8.270 78 2HD LYS 9 HD3 LYS 9 9.417 -5.402 -8.397 79 1HE LYS 9 HE2 LYS 9 12.281 -4.454 -8.082 80 2HE LYS 9 HE3 LYS 9 11.296 -5.193 -6.819 81 1HZ LYS 9 HZ1 LYS 9 11.158 -6.865 -9.024 82 2HZ LYS 9 HZ2 LYS 9 12.796 -6.448 -8.853 83 3HZ LYS 9 HZ3 LYS 9 11.963 -7.155 -7.556 84 H GLU 10 H GLU 10 9.696 -0.264 -11.508 85 HA GLU 10 HA GLU 10 12.239 0.702 -12.757 86 1HB GLU 10 HB2 GLU 10 9.473 1.116 -13.570 87 2HB GLU 10 HB3 GLU 10 10.290 2.647 -13.259 88 1HG GLU 10 HG2 GLU 10 11.922 2.261 -14.893 89 2HG GLU 10 HG3 GLU 10 11.664 0.515 -14.874 90 HA PRO 11 HA PRO 11 12.472 3.590 -9.428 91 1HB PRO 11 HB2 PRO 11 13.384 5.842 -10.669 92 2HB PRO 11 HB3 PRO 11 14.371 4.389 -10.450 93 1HG PRO 11 HG2 PRO 11 13.108 5.446 -12.918 94 2HG PRO 11 HG3 PRO 11 14.527 4.404 -12.741 95 1HD PRO 11 HD2 PRO 11 11.895 3.584 -13.455 96 2HD PRO 11 HD3 PRO 11 13.271 2.528 -13.071 97 H ALA 12 H ALA 12 11.652 5.642 -8.520 98 HA ALA 12 HA ALA 12 9.448 6.954 -10.007 99 1HB ALA 12 HB1 ALA 12 8.858 4.903 -8.255 100 2HB ALA 12 HB2 ALA 12 8.704 6.331 -7.232 101 3HB ALA 12 HB3 ALA 12 7.749 6.197 -8.709 102 H THR 13 H THR 13 8.596 8.860 -8.581 103 HA THR 13 HA THR 13 10.910 9.982 -7.046 104 HB THR 13 HB THR 13 8.917 11.707 -8.498 105 HG1 THR 13 HG1 THR 13 9.780 10.259 -10.020 106 1HG2 THR 13 HG21 THR 13 11.719 11.972 -7.426 107 2HG2 THR 13 HG22 THR 13 11.104 13.095 -8.638 108 3HG2 THR 13 HG23 THR 13 10.305 12.965 -7.072 109 H LEU 14 H LEU 14 10.442 10.579 -4.982 110 HA LEU 14 HA LEU 14 7.745 10.220 -3.945 111 1HB LEU 14 HB2 LEU 14 9.989 9.826 -2.712 112 2HB LEU 14 HB3 LEU 14 10.015 11.575 -2.484 113 HG LEU 14 HG LEU 14 8.975 10.321 -0.568 114 1HD1 LEU 14 HD11 LEU 14 8.391 12.718 -1.307 115 2HD1 LEU 14 HD12 LEU 14 6.920 12.022 -1.984 116 3HD1 LEU 14 HD13 LEU 14 7.236 11.904 -0.253 117 1HD2 LEU 14 HD21 LEU 14 7.840 8.743 -2.411 118 2HD2 LEU 14 HD22 LEU 14 7.095 9.006 -0.833 119 3HD2 LEU 14 HD23 LEU 14 6.531 9.913 -2.237 120 H ILE 15 H ILE 15 6.303 11.756 -4.688 121 HA ILE 15 HA ILE 15 7.128 14.589 -4.792 122 HB ILE 15 HB ILE 15 4.507 13.242 -5.505 123 1HG1 ILE 15 HG12 ILE 15 6.840 14.235 -7.172 124 2HG1 ILE 15 HG13 ILE 15 6.312 12.562 -6.991 125 1HG2 ILE 15 HG21 ILE 15 4.661 15.802 -4.825 126 2HG2 ILE 15 HG22 ILE 15 5.327 15.963 -6.450 127 3HG2 ILE 15 HG23 ILE 15 3.709 15.300 -6.223 128 1HD1 ILE 15 HD11 ILE 15 4.093 13.228 -7.973 129 2HD1 ILE 15 HD12 ILE 15 4.777 14.820 -8.302 130 3HD1 ILE 15 HD13 ILE 15 5.447 13.393 -9.093 131 H LYS 16 H LYS 16 4.202 12.982 -3.477 132 HA LYS 16 HA LYS 16 4.607 14.232 -0.868 133 1HB LYS 16 HB2 LYS 16 3.690 16.098 -2.299 134 2HB LYS 16 HB3 LYS 16 2.233 15.129 -2.524 135 1HG LYS 16 HG2 LYS 16 1.650 16.460 -0.691 136 2HG LYS 16 HG3 LYS 16 2.237 14.993 0.092 137 1HD LYS 16 HD2 LYS 16 4.335 15.979 0.613 138 2HD LYS 16 HD3 LYS 16 4.071 17.316 -0.508 139 1HE LYS 16 HE2 LYS 16 2.000 17.843 0.994 140 2HE LYS 16 HE3 LYS 16 2.826 16.844 2.191 141 1HZ LYS 16 HZ1 LYS 16 4.692 18.593 1.055 142 2HZ LYS 16 HZ2 LYS 16 3.336 19.507 1.516 143 3HZ LYS 16 HZ3 LYS 16 4.137 18.545 2.660 144 H ALA 17 H ALA 17 3.936 12.643 0.477 145 HA ALA 17 HA ALA 17 2.186 10.512 -0.389 146 1HB ALA 17 HB1 ALA 17 3.071 11.308 2.403 147 2HB ALA 17 HB2 ALA 17 2.286 9.787 1.979 148 3HB ALA 17 HB3 ALA 17 3.892 10.154 1.351 149 H ILE 18 H ILE 18 0.036 10.066 0.459 150 HA ILE 18 HA ILE 18 -1.388 12.539 1.370 151 HB ILE 18 HB ILE 18 -2.336 10.337 -0.487 152 1HG1 ILE 18 HG12 ILE 18 -2.060 13.332 -0.892 153 2HG1 ILE 18 HG13 ILE 18 -0.886 12.140 -1.453 154 1HG2 ILE 18 HG21 ILE 18 -4.060 11.152 1.193 155 2HG2 ILE 18 HG22 ILE 18 -3.892 12.751 0.471 156 3HG2 ILE 18 HG23 ILE 18 -4.489 11.405 -0.498 157 1HD1 ILE 18 HD11 ILE 18 -3.546 11.359 -2.265 158 2HD1 ILE 18 HD12 ILE 18 -3.212 13.006 -2.801 159 3HD1 ILE 18 HD13 ILE 18 -2.135 11.691 -3.270 160 H ASP 19 H ASP 19 -1.271 8.993 1.504 161 HA ASP 19 HA ASP 19 -2.314 9.113 4.264 162 1HB ASP 19 HB2 ASP 19 -4.049 8.555 2.133 163 2HB ASP 19 HB3 ASP 19 -3.650 6.975 2.811 164 H GLY 20 H GLY 20 -2.747 6.278 4.444 165 1HA GLY 20 HA2 GLY 20 0.078 5.408 4.435 166 2HA GLY 20 HA3 GLY 20 -1.257 4.572 5.229 167 H ASP 21 H ASP 21 -2.583 5.213 2.374 168 HA ASP 21 HA ASP 21 -1.320 2.915 0.950 169 1HB ASP 21 HB2 ASP 21 -4.096 3.164 1.959 170 2HB ASP 21 HB3 ASP 21 -3.941 2.579 0.303 171 H THR 22 H THR 22 -1.758 6.053 0.769 172 HA THR 22 HA THR 22 -2.180 5.985 -2.174 173 HB THR 22 HB THR 22 -3.450 8.161 -0.521 174 HG1 THR 22 HG1 THR 22 -4.489 6.426 0.259 175 1HG2 THR 22 HG21 THR 22 -3.140 8.421 -2.985 176 2HG2 THR 22 HG22 THR 22 -4.121 6.976 -3.228 177 3HG2 THR 22 HG23 THR 22 -4.837 8.416 -2.504 178 H VAL 23 H VAL 23 -0.147 6.645 -2.778 179 HA VAL 23 HA VAL 23 0.836 9.203 -1.580 180 HB VAL 23 HB VAL 23 3.111 8.383 -1.709 181 1HG1 VAL 23 HG11 VAL 23 1.084 6.599 -0.386 182 2HG1 VAL 23 HG12 VAL 23 2.799 6.197 -0.297 183 3HG1 VAL 23 HG13 VAL 23 2.216 7.730 0.353 184 1HG2 VAL 23 HG21 VAL 23 1.896 6.501 -3.548 185 2HG2 VAL 23 HG22 VAL 23 3.603 6.880 -3.318 186 3HG2 VAL 23 HG23 VAL 23 2.830 5.646 -2.321 187 H LYS 24 H LYS 24 1.696 10.687 -3.053 188 HA LYS 24 HA LYS 24 1.177 10.057 -5.912 189 1HB LYS 24 HB2 LYS 24 1.944 12.768 -4.840 190 2HB LYS 24 HB3 LYS 24 0.995 12.377 -6.273 191 1HG LYS 24 HG2 LYS 24 -0.501 11.212 -4.292 192 2HG LYS 24 HG3 LYS 24 0.136 12.635 -3.465 193 1HD LYS 24 HD2 LYS 24 -1.130 12.799 -6.207 194 2HD LYS 24 HD3 LYS 24 -2.073 12.955 -4.724 195 1HE LYS 24 HE2 LYS 24 0.386 14.635 -5.236 196 2HE LYS 24 HE3 LYS 24 -1.217 15.139 -5.773 197 1HZ LYS 24 HZ1 LYS 24 -1.965 14.825 -3.438 198 2HZ LYS 24 HZ2 LYS 24 -0.343 14.586 -2.992 199 3HZ LYS 24 HZ3 LYS 24 -0.832 16.075 -3.640 200 H LEU 25 H LEU 25 2.885 9.561 -7.199 201 HA LEU 25 HA LEU 25 5.560 10.675 -6.467 202 1HB LEU 25 HB2 LEU 25 5.364 7.948 -7.693 203 2HB LEU 25 HB3 LEU 25 6.615 8.614 -6.644 204 HG LEU 25 HG LEU 25 3.795 7.998 -5.722 205 1HD1 LEU 25 HD11 LEU 25 6.354 6.401 -5.376 206 2HD1 LEU 25 HD12 LEU 25 4.805 6.028 -4.619 207 3HD1 LEU 25 HD13 LEU 25 4.976 5.932 -6.371 208 1HD2 LEU 25 HD21 LEU 25 6.168 9.281 -4.553 209 2HD2 LEU 25 HD22 LEU 25 4.488 9.334 -4.022 210 3HD2 LEU 25 HD23 LEU 25 5.517 7.979 -3.558 211 H MET 26 H MET 26 7.110 10.294 -8.447 212 HA MET 26 HA MET 26 5.582 11.070 -10.895 213 1HB MET 26 HB2 MET 26 7.490 12.531 -9.688 214 2HB MET 26 HB3 MET 26 8.520 11.534 -10.716 215 1HG MET 26 HG2 MET 26 7.941 12.723 -12.537 216 2HG MET 26 HG3 MET 26 6.229 12.447 -12.217 217 1HE MET 26 HE1 MET 26 9.251 14.190 -11.964 218 2HE MET 26 HE2 MET 26 8.711 15.848 -12.262 219 3HE MET 26 HE3 MET 26 9.140 15.337 -10.632 220 H TYR 27 H TYR 27 5.590 9.611 -12.522 221 HA TYR 27 HA TYR 27 7.861 7.682 -12.695 222 1HB TYR 27 HB2 TYR 27 6.054 6.413 -11.762 223 2HB TYR 27 HB3 TYR 27 4.892 7.121 -12.883 224 HD1 TYR 27 HD1 TYR 27 5.057 6.592 -15.342 225 HD2 TYR 27 HD2 TYR 27 7.380 4.528 -12.377 226 HE1 TYR 27 HE1 TYR 27 5.510 4.770 -16.964 227 HE2 TYR 27 HE2 TYR 27 7.832 2.707 -13.996 228 HH TYR 27 HH TYR 27 7.535 2.950 -17.166 229 H LYS 28 H LYS 28 8.784 7.745 -14.685 230 HA LYS 28 HA LYS 28 9.075 8.165 -16.972 231 1HB LYS 28 HB2 LYS 28 6.184 7.421 -16.753 232 2HB LYS 28 HB3 LYS 28 6.768 8.092 -18.277 233 1HG LYS 28 HG2 LYS 28 7.883 5.668 -16.838 234 2HG LYS 28 HG3 LYS 28 6.968 5.663 -18.344 235 1HD LYS 28 HD2 LYS 28 8.947 5.812 -19.413 236 2HD LYS 28 HD3 LYS 28 9.034 7.472 -18.822 237 1HE LYS 28 HE2 LYS 28 9.862 6.067 -16.618 238 2HE LYS 28 HE3 LYS 28 10.511 5.080 -17.929 239 1HZ LYS 28 HZ1 LYS 28 11.114 7.538 -18.777 240 2HZ LYS 28 HZ2 LYS 28 11.229 7.762 -17.099 241 3HZ LYS 28 HZ3 LYS 28 12.168 6.570 -17.862 242 H GLY 29 H GLY 29 8.697 10.394 -15.134 243 1HA GLY 29 HA2 GLY 29 8.473 12.725 -15.279 244 2HA GLY 29 HA3 GLY 29 8.418 12.520 -17.031 245 H GLN 30 H GLN 30 6.135 11.007 -14.809 246 HA GLN 30 HA GLN 30 4.058 12.975 -15.612 247 1HB GLN 30 HB2 GLN 30 4.237 10.691 -17.012 248 2HB GLN 30 HB3 GLN 30 3.280 10.098 -15.653 249 1HG GLN 30 HG2 GLN 30 2.209 12.627 -16.421 250 2HG GLN 30 HG3 GLN 30 2.404 11.663 -17.886 251 1HE2 GLN 30 HE21 GLN 30 -0.004 12.382 -15.934 252 2HE2 GLN 30 HE22 GLN 30 -0.784 10.883 -15.766 253 HA PRO 31 HA PRO 31 3.303 12.440 -11.236 254 1HB PRO 31 HB2 PRO 31 1.195 14.180 -11.106 255 2HB PRO 31 HB3 PRO 31 2.884 14.711 -11.196 256 1HG PRO 31 HG2 PRO 31 0.815 14.620 -13.363 257 2HG PRO 31 HG3 PRO 31 2.088 15.819 -13.074 258 1HD PRO 31 HD2 PRO 31 2.273 13.828 -14.977 259 2HD PRO 31 HD3 PRO 31 3.683 14.592 -14.209 260 H MET 32 H MET 32 2.123 10.808 -10.305 261 HA MET 32 HA MET 32 -0.679 10.369 -11.115 262 1HB MET 32 HB2 MET 32 1.340 8.899 -12.361 263 2HB MET 32 HB3 MET 32 0.751 7.825 -11.092 264 1HG MET 32 HG2 MET 32 -1.550 8.105 -11.884 265 2HG MET 32 HG3 MET 32 -1.006 9.245 -13.116 266 1HE MET 32 HE1 MET 32 0.024 6.034 -11.499 267 2HE MET 32 HE2 MET 32 0.451 4.919 -12.795 268 3HE MET 32 HE3 MET 32 1.521 6.269 -12.396 269 H THR 33 H THR 33 -1.855 9.213 -9.520 270 HA THR 33 HA THR 33 -0.487 9.059 -6.896 271 HB THR 33 HB THR 33 -3.166 8.327 -6.555 272 HG1 THR 33 HG1 THR 33 -3.981 10.352 -7.725 273 1HG2 THR 33 HG21 THR 33 -1.697 9.894 -5.213 274 2HG2 THR 33 HG22 THR 33 -2.045 11.136 -6.416 275 3HG2 THR 33 HG23 THR 33 -3.354 10.453 -5.449 276 H PHE 34 H PHE 34 0.406 7.118 -6.380 277 HA PHE 34 HA PHE 34 -0.693 4.661 -7.630 278 1HB PHE 34 HB2 PHE 34 1.863 5.292 -6.151 279 2HB PHE 34 HB3 PHE 34 1.376 3.631 -6.491 280 HD1 PHE 34 HD1 PHE 34 1.211 2.806 -8.800 281 HD2 PHE 34 HD2 PHE 34 2.540 6.799 -7.938 282 HE1 PHE 34 HE1 PHE 34 2.077 3.018 -11.113 283 HE2 PHE 34 HE2 PHE 34 3.406 7.010 -10.252 284 HZ PHE 34 HZ PHE 34 3.175 5.119 -11.840 285 H ARG 35 H ARG 35 -1.642 3.026 -6.430 286 HA ARG 35 HA ARG 35 -2.008 3.575 -3.510 287 1HB ARG 35 HB2 ARG 35 -4.043 3.717 -5.126 288 2HB ARG 35 HB3 ARG 35 -3.928 1.957 -5.178 289 1HG ARG 35 HG2 ARG 35 -5.273 2.066 -3.341 290 2HG ARG 35 HG3 ARG 35 -3.758 2.384 -2.494 291 1HD ARG 35 HD2 ARG 35 -4.114 4.761 -2.584 292 2HD ARG 35 HD3 ARG 35 -5.478 4.573 -3.685 293 HE ARG 35 HE ARG 35 -5.713 3.316 -1.012 294 1HH1 ARG 35 HH11 ARG 35 -6.200 6.123 -2.924 295 2HH1 ARG 35 HH12 ARG 35 -7.715 6.532 -2.190 296 1HH2 ARG 35 HH21 ARG 35 -7.806 3.705 -0.183 297 2HH2 ARG 35 HH22 ARG 35 -8.625 5.161 -0.639 298 H LEU 36 H LEU 36 -1.378 1.945 -2.141 299 HA LEU 36 HA LEU 36 0.207 -0.219 -2.994 300 1HB LEU 36 HB2 LEU 36 -1.508 -0.002 -0.500 301 2HB LEU 36 HB3 LEU 36 -0.228 -1.193 -0.741 302 HG LEU 36 HG LEU 36 0.090 1.822 -0.676 303 1HD1 LEU 36 HD11 LEU 36 0.919 -0.440 1.153 304 2HD1 LEU 36 HD12 LEU 36 1.668 1.155 1.227 305 3HD1 LEU 36 HD13 LEU 36 -0.057 0.976 1.549 306 1HD2 LEU 36 HD21 LEU 36 1.713 -0.284 -1.885 307 2HD2 LEU 36 HD22 LEU 36 1.873 1.468 -2.020 308 3HD2 LEU 36 HD23 LEU 36 2.608 0.618 -0.661 309 H LEU 37 H LEU 37 -0.307 -2.079 -4.029 310 HA LEU 37 HA LEU 37 -3.126 -2.724 -4.517 311 1HB LEU 37 HB2 LEU 37 -0.497 -3.548 -5.605 312 2HB LEU 37 HB3 LEU 37 -1.756 -4.780 -5.638 313 HG LEU 37 HG LEU 37 -2.228 -1.969 -6.644 314 1HD1 LEU 37 HD11 LEU 37 -0.341 -3.464 -7.785 315 2HD1 LEU 37 HD12 LEU 37 -1.740 -4.258 -8.509 316 3HD1 LEU 37 HD13 LEU 37 -1.477 -2.533 -8.761 317 1HD2 LEU 37 HD21 LEU 37 -3.770 -4.444 -6.382 318 2HD2 LEU 37 HD22 LEU 37 -4.335 -2.803 -6.691 319 3HD2 LEU 37 HD23 LEU 37 -3.788 -3.814 -8.029 320 H LEU 38 H LEU 38 -4.106 -4.742 -3.978 321 HA LEU 38 HA LEU 38 -4.563 -6.596 -2.627 322 1HB LEU 38 HB2 LEU 38 -1.569 -6.601 -2.160 323 2HB LEU 38 HB3 LEU 38 -2.677 -7.934 -1.835 324 HG LEU 38 HG LEU 38 -2.088 -6.716 -4.549 325 1HD1 LEU 38 HD11 LEU 38 -0.777 -8.730 -3.041 326 2HD1 LEU 38 HD12 LEU 38 -1.670 -9.555 -4.319 327 3HD1 LEU 38 HD13 LEU 38 -0.501 -8.300 -4.729 328 1HD2 LEU 38 HD21 LEU 38 -4.024 -8.866 -3.649 329 2HD2 LEU 38 HD22 LEU 38 -4.399 -7.378 -4.515 330 3HD2 LEU 38 HD23 LEU 38 -3.520 -8.672 -5.328 331 H VAL 39 H VAL 39 -3.762 -3.674 -1.492 332 HA VAL 39 HA VAL 39 -4.278 -4.544 1.305 333 HB VAL 39 HB VAL 39 -2.528 -3.230 2.231 334 1HG1 VAL 39 HG11 VAL 39 -1.887 -5.401 1.040 335 2HG1 VAL 39 HG12 VAL 39 -1.280 -4.387 -0.269 336 3HG1 VAL 39 HG13 VAL 39 -0.571 -4.265 1.341 337 1HG2 VAL 39 HG21 VAL 39 -2.873 -1.292 0.671 338 2HG2 VAL 39 HG22 VAL 39 -1.174 -1.678 0.936 339 3HG2 VAL 39 HG23 VAL 39 -1.969 -2.174 -0.558 340 H ASP 40 H ASP 40 -4.990 -2.671 2.676 341 HA ASP 40 HA ASP 40 -5.923 -0.273 1.264 342 1HB ASP 40 HB2 ASP 40 -7.734 -1.806 0.717 343 2HB ASP 40 HB3 ASP 40 -7.866 -2.304 2.405 344 H THR 41 H THR 41 -5.741 1.390 2.698 345 HA THR 41 HA THR 41 -5.135 0.822 5.492 346 HB THR 41 HB THR 41 -5.272 3.435 5.579 347 HG1 THR 41 HG1 THR 41 -6.384 3.743 3.672 348 1HG2 THR 41 HG21 THR 41 -3.284 1.579 4.793 349 2HG2 THR 41 HG22 THR 41 -3.147 2.957 3.703 350 3HG2 THR 41 HG23 THR 41 -3.044 3.199 5.447 351 HA PRO 42 HA PRO 42 -9.164 1.288 7.212 352 1HB PRO 42 HB2 PRO 42 -8.544 2.408 9.626 353 2HB PRO 42 HB3 PRO 42 -8.186 0.718 9.227 354 1HG PRO 42 HG2 PRO 42 -6.338 3.064 9.336 355 2HG PRO 42 HG3 PRO 42 -6.023 1.365 9.727 356 1HD PRO 42 HD2 PRO 42 -5.275 2.612 7.345 357 2HD PRO 42 HD3 PRO 42 -5.444 0.856 7.562 358 H GLU 43 H GLU 43 -10.824 2.859 7.544 359 HA GLU 43 HA GLU 43 -10.759 5.272 6.191 360 1HB GLU 43 HB2 GLU 43 -12.722 4.082 7.447 361 2HB GLU 43 HB3 GLU 43 -12.255 5.114 8.799 362 1HG GLU 43 HG2 GLU 43 -13.661 6.613 7.808 363 2HG GLU 43 HG3 GLU 43 -12.269 6.931 6.771 364 H THR 44 H THR 44 -10.039 7.353 6.619 365 HA THR 44 HA THR 44 -9.295 8.251 9.268 366 HB THR 44 HB THR 44 -7.368 6.829 8.986 367 HG1 THR 44 HG1 THR 44 -6.499 8.581 9.783 368 1HG2 THR 44 HG21 THR 44 -7.479 7.904 6.202 369 2HG2 THR 44 HG22 THR 44 -5.899 7.481 6.860 370 3HG2 THR 44 HG23 THR 44 -7.167 6.260 6.758 371 H LYS 45 H LYS 45 -10.953 9.401 7.409 372 HA LYS 45 HA LYS 45 -9.313 11.665 6.341 373 1HB LYS 45 HB2 LYS 45 -11.686 10.205 5.238 374 2HB LYS 45 HB3 LYS 45 -11.507 11.921 4.869 375 1HG LYS 45 HG2 LYS 45 -9.753 11.557 3.479 376 2HG LYS 45 HG3 LYS 45 -9.018 10.387 4.574 377 1HD LYS 45 HD2 LYS 45 -10.226 8.596 3.695 378 2HD LYS 45 HD3 LYS 45 -11.514 9.636 3.083 379 1HE LYS 45 HE2 LYS 45 -8.698 9.739 1.989 380 2HE LYS 45 HE3 LYS 45 -9.930 8.668 1.324 381 1HZ LYS 45 HZ1 LYS 45 -11.348 10.756 1.174 382 2HZ LYS 45 HZ2 LYS 45 -9.903 11.622 1.399 383 3HZ LYS 45 HZ3 LYS 45 -10.083 10.597 0.056 384 H HIS 46 H HIS 46 -12.824 11.561 6.537 385 HA HIS 46 HA HIS 46 -12.982 13.054 9.027 386 1HB HIS 46 HB2 HIS 46 -12.210 14.635 6.988 387 2HB HIS 46 HB3 HIS 46 -13.954 14.686 6.733 388 HD1 HIS 46 HD1 HIS 46 -11.974 16.995 7.963 389 HD2 HIS 46 HD2 HIS 46 -14.745 14.656 10.019 390 HE1 HIS 46 HE1 HIS 46 -12.560 18.268 10.073 391 HA PRO 47 HA PRO 47 -16.846 10.883 7.943 392 1HB PRO 47 HB2 PRO 47 -17.311 10.047 10.503 393 2HB PRO 47 HB3 PRO 47 -16.235 9.187 9.389 394 1HG PRO 47 HG2 PRO 47 -15.542 10.972 11.682 395 2HG PRO 47 HG3 PRO 47 -14.684 9.552 11.063 396 1HD PRO 47 HD2 PRO 47 -13.958 12.200 10.554 397 2HD PRO 47 HD3 PRO 47 -13.451 10.800 9.583 398 H LYS 48 H LYS 48 -17.211 11.816 11.304 399 HA LYS 48 HA LYS 48 -19.082 13.990 10.445 400 1HB LYS 48 HB2 LYS 48 -19.267 12.087 12.800 401 2HB LYS 48 HB3 LYS 48 -20.329 13.476 12.567 402 1HG LYS 48 HG2 LYS 48 -20.881 12.505 10.273 403 2HG LYS 48 HG3 LYS 48 -20.061 11.035 10.800 404 1HD LYS 48 HD2 LYS 48 -21.643 11.346 12.922 405 2HD LYS 48 HD3 LYS 48 -22.637 12.215 11.752 406 1HE LYS 48 HE2 LYS 48 -21.513 9.504 11.079 407 2HE LYS 48 HE3 LYS 48 -22.997 9.647 12.021 408 1HZ LYS 48 HZ1 LYS 48 -22.850 11.306 9.648 409 2HZ LYS 48 HZ2 LYS 48 -22.930 9.634 9.360 410 3HZ LYS 48 HZ3 LYS 48 -24.147 10.403 10.263 411 H LYS 49 H LYS 49 -16.437 13.045 12.493 412 HA LYS 49 HA LYS 49 -15.668 15.735 13.046 413 1HB LYS 49 HB2 LYS 49 -17.787 15.429 14.506 414 2HB LYS 49 HB3 LYS 49 -16.775 14.385 15.506 415 1HG LYS 49 HG2 LYS 49 -15.214 16.176 15.924 416 2HG LYS 49 HG3 LYS 49 -16.015 17.217 14.745 417 1HD LYS 49 HD2 LYS 49 -17.758 16.146 16.889 418 2HD LYS 49 HD3 LYS 49 -16.534 17.303 17.413 419 1HE LYS 49 HE2 LYS 49 -17.305 18.847 15.586 420 2HE LYS 49 HE3 LYS 49 -18.622 17.722 15.257 421 1HZ LYS 49 HZ1 LYS 49 -18.550 18.209 18.009 422 2HZ LYS 49 HZ2 LYS 49 -18.492 19.710 17.221 423 3HZ LYS 49 HZ3 LYS 49 -19.764 18.632 16.898 424 H GLY 50 H GLY 50 -14.112 13.792 12.143 425 1HA GLY 50 HA2 GLY 50 -11.964 12.917 12.611 426 2HA GLY 50 HA3 GLY 50 -12.171 13.409 14.293 427 H VAL 51 H VAL 51 -11.112 11.086 14.356 428 HA VAL 51 HA VAL 51 -13.353 9.120 14.598 429 HB VAL 51 HB VAL 51 -10.526 8.241 14.098 430 1HG1 VAL 51 HG11 VAL 51 -13.292 7.143 13.905 431 2HG1 VAL 51 HG12 VAL 51 -12.114 6.561 12.730 432 3HG1 VAL 51 HG13 VAL 51 -11.810 6.364 14.456 433 1HG2 VAL 51 HG21 VAL 51 -12.331 9.652 12.212 434 2HG2 VAL 51 HG22 VAL 51 -10.576 9.483 12.176 435 3HG2 VAL 51 HG23 VAL 51 -11.601 8.168 11.601 436 H GLU 52 H GLU 52 -10.223 10.207 15.845 437 HA GLU 52 HA GLU 52 -9.236 9.913 17.957 438 1HB GLU 52 HB2 GLU 52 -12.158 10.215 18.419 439 2HB GLU 52 HB3 GLU 52 -11.210 9.595 19.771 440 1HG GLU 52 HG2 GLU 52 -10.017 11.549 20.015 441 2HG GLU 52 HG3 GLU 52 -10.117 11.946 18.299 442 H LYS 53 H LYS 53 -8.588 7.727 16.988 443 HA LYS 53 HA LYS 53 -8.911 5.672 18.934 444 1HB LYS 53 HB2 LYS 53 -11.194 5.497 18.034 445 2HB LYS 53 HB3 LYS 53 -10.550 5.302 16.405 446 1HG LYS 53 HG2 LYS 53 -11.209 3.149 17.631 447 2HG LYS 53 HG3 LYS 53 -9.594 3.181 16.926 448 1HD LYS 53 HD2 LYS 53 -8.621 3.752 19.098 449 2HD LYS 53 HD3 LYS 53 -10.229 3.824 19.822 450 1HE LYS 53 HE2 LYS 53 -10.452 1.374 18.901 451 2HE LYS 53 HE3 LYS 53 -8.690 1.424 18.871 452 1HZ LYS 53 HZ1 LYS 53 -9.964 2.401 21.295 453 2HZ LYS 53 HZ2 LYS 53 -10.084 0.729 21.013 454 3HZ LYS 53 HZ3 LYS 53 -8.558 1.466 21.105 455 H TYR 54 H TYR 54 -6.611 6.473 18.009 456 HA TYR 54 HA TYR 54 -4.633 5.699 17.022 457 1HB TYR 54 HB2 TYR 54 -4.709 3.474 17.471 458 2HB TYR 54 HB3 TYR 54 -6.425 3.372 17.099 459 HD1 TYR 54 HD1 TYR 54 -3.014 3.339 15.634 460 HD2 TYR 54 HD2 TYR 54 -7.194 2.625 14.956 461 HE1 TYR 54 HE1 TYR 54 -2.477 2.240 13.477 462 HE2 TYR 54 HE2 TYR 54 -6.662 1.532 12.802 463 HH TYR 54 HH TYR 54 -3.298 1.305 11.637 464 H GLY 55 H GLY 55 -7.232 6.811 15.472 465 1HA GLY 55 HA2 GLY 55 -7.206 6.154 12.795 466 2HA GLY 55 HA3 GLY 55 -7.398 7.818 13.345 467 HA PRO 56 HA PRO 56 -3.351 8.897 11.966 468 1HB PRO 56 HB2 PRO 56 -2.146 10.083 14.113 469 2HB PRO 56 HB3 PRO 56 -3.493 10.822 13.230 470 1HG PRO 56 HG2 PRO 56 -3.500 9.465 15.887 471 2HG PRO 56 HG3 PRO 56 -4.499 10.806 15.306 472 1HD PRO 56 HD2 PRO 56 -5.330 8.139 15.481 473 2HD PRO 56 HD3 PRO 56 -6.115 9.394 14.498 474 H GLU 57 H GLU 57 -2.022 7.153 11.484 475 HA GLU 57 HA GLU 57 0.097 6.427 13.282 476 1HB GLU 57 HB2 GLU 57 -2.294 5.091 13.821 477 2HB GLU 57 HB3 GLU 57 -1.373 3.943 12.850 478 1HG GLU 57 HG2 GLU 57 -0.162 5.408 15.202 479 2HG GLU 57 HG3 GLU 57 -0.970 3.849 15.373 480 H ALA 58 H ALA 58 -1.910 4.950 10.704 481 HA ALA 58 HA ALA 58 0.363 3.752 9.383 482 1HB ALA 58 HB1 ALA 58 -2.503 3.832 9.036 483 2HB ALA 58 HB2 ALA 58 -1.705 4.125 7.491 484 3HB ALA 58 HB3 ALA 58 -1.346 2.660 8.405 485 H SER 59 H SER 59 -1.635 6.626 8.629 486 HA SER 59 HA SER 59 -0.381 7.520 6.317 487 1HB SER 59 HB2 SER 59 -2.280 8.618 7.724 488 2HB SER 59 HB3 SER 59 -0.971 9.456 8.551 489 HG SER 59 HG SER 59 -0.322 9.788 6.140 490 H ALA 60 H ALA 60 0.654 8.319 9.657 491 HA ALA 60 HA ALA 60 3.064 9.646 8.839 492 1HB ALA 60 HB1 ALA 60 1.975 9.829 11.111 493 2HB ALA 60 HB2 ALA 60 2.581 8.211 11.465 494 3HB ALA 60 HB3 ALA 60 3.713 9.530 11.165 495 H PHE 61 H PHE 61 2.255 6.283 9.424 496 HA PHE 61 HA PHE 61 4.812 5.153 9.723 497 1HB PHE 61 HB2 PHE 61 2.531 3.980 9.774 498 2HB PHE 61 HB3 PHE 61 2.653 3.912 8.015 499 HD1 PHE 61 HD1 PHE 61 4.075 2.715 11.198 500 HD2 PHE 61 HD2 PHE 61 4.324 2.515 6.914 501 HE1 PHE 61 HE1 PHE 61 5.530 0.716 11.377 502 HE2 PHE 61 HE2 PHE 61 5.780 0.515 7.092 503 HZ PHE 61 HZ PHE 61 6.383 -0.385 9.324 504 H THR 62 H THR 62 3.032 5.507 6.644 505 HA THR 62 HA THR 62 5.434 4.965 5.095 506 HB THR 62 HB THR 62 2.951 4.552 4.423 507 HG1 THR 62 HG1 THR 62 3.696 5.394 2.172 508 1HG2 THR 62 HG21 THR 62 2.448 7.056 4.854 509 2HG2 THR 62 HG22 THR 62 3.215 7.331 3.290 510 3HG2 THR 62 HG23 THR 62 1.774 6.320 3.399 511 H LYS 63 H LYS 63 4.101 7.756 6.582 512 HA LYS 63 HA LYS 63 5.019 9.780 4.785 513 1HB LYS 63 HB2 LYS 63 3.577 9.864 7.049 514 2HB LYS 63 HB3 LYS 63 5.153 10.289 7.720 515 1HG LYS 63 HG2 LYS 63 4.946 12.380 6.919 516 2HG LYS 63 HG3 LYS 63 4.794 11.746 5.280 517 1HD LYS 63 HD2 LYS 63 2.335 11.254 5.900 518 2HD LYS 63 HD3 LYS 63 2.601 12.331 7.270 519 1HE LYS 63 HE2 LYS 63 3.667 13.792 5.206 520 2HE LYS 63 HE3 LYS 63 2.328 12.969 4.406 521 1HZ LYS 63 HZ1 LYS 63 1.052 13.708 6.533 522 2HZ LYS 63 HZ2 LYS 63 2.273 14.879 6.634 523 3HZ LYS 63 HZ3 LYS 63 1.285 14.801 5.254 524 H LYS 64 H LYS 64 6.567 8.354 7.659 525 HA LYS 64 HA LYS 64 9.101 9.708 7.074 526 1HB LYS 64 HB2 LYS 64 7.928 8.308 9.303 527 2HB LYS 64 HB3 LYS 64 9.503 7.603 8.934 528 1HG LYS 64 HG2 LYS 64 10.404 9.334 10.067 529 2HG LYS 64 HG3 LYS 64 9.933 10.346 8.703 530 1HD LYS 64 HD2 LYS 64 8.240 11.316 9.859 531 2HD LYS 64 HD3 LYS 64 7.729 9.783 10.567 532 1HE LYS 64 HE2 LYS 64 8.911 10.141 12.465 533 2HE LYS 64 HE3 LYS 64 10.323 10.714 11.576 534 1HZ LYS 64 HZ1 LYS 64 7.868 12.295 12.120 535 2HZ LYS 64 HZ2 LYS 64 9.346 12.464 12.933 536 3HZ LYS 64 HZ3 LYS 64 9.238 12.846 11.281 537 H MET 65 H MET 65 7.608 6.616 6.449 538 HA MET 65 HA MET 65 9.919 5.061 5.896 539 1HB MET 65 HB2 MET 65 7.296 4.504 5.905 540 2HB MET 65 HB3 MET 65 7.516 4.711 4.168 541 1HG MET 65 HG2 MET 65 8.310 2.605 4.102 542 2HG MET 65 HG3 MET 65 9.717 3.181 4.996 543 1HE MET 65 HE1 MET 65 9.927 3.466 7.265 544 2HE MET 65 HE2 MET 65 8.399 3.870 8.043 545 3HE MET 65 HE3 MET 65 9.269 2.417 8.528 546 H VAL 66 H VAL 66 7.815 6.692 3.515 547 HA VAL 66 HA VAL 66 9.743 6.430 1.387 548 HB VAL 66 HB VAL 66 8.252 7.864 0.114 549 1HG1 VAL 66 HG11 VAL 66 7.546 5.467 1.131 550 2HG1 VAL 66 HG12 VAL 66 6.261 6.458 1.821 551 3HG1 VAL 66 HG13 VAL 66 6.485 6.397 0.073 552 1HG2 VAL 66 HG21 VAL 66 7.175 8.561 2.853 553 2HG2 VAL 66 HG22 VAL 66 7.808 9.655 1.623 554 3HG2 VAL 66 HG23 VAL 66 6.251 8.862 1.382 555 H GLU 67 H GLU 67 8.939 9.052 3.649 556 HA GLU 67 HA GLU 67 10.512 11.099 2.486 557 1HB GLU 67 HB2 GLU 67 9.526 10.498 5.241 558 2HB GLU 67 HB3 GLU 67 10.781 11.725 5.067 559 1HG GLU 67 HG2 GLU 67 9.199 12.577 3.110 560 2HG GLU 67 HG3 GLU 67 7.967 11.740 4.055 561 H ASN 68 H ASN 68 11.438 8.330 4.430 562 HA ASN 68 HA ASN 68 14.242 9.322 4.533 563 1HB ASN 68 HB2 ASN 68 12.812 7.055 5.941 564 2HB ASN 68 HB3 ASN 68 14.557 7.297 6.038 565 1HD2 ASN 68 HD21 ASN 68 12.644 7.548 8.284 566 2HD2 ASN 68 HD22 ASN 68 12.758 9.151 8.833 567 H ALA 69 H ALA 69 12.230 7.178 2.774 568 HA ALA 69 HA ALA 69 14.165 5.176 2.069 569 1HB ALA 69 HB1 ALA 69 11.467 5.679 1.498 570 2HB ALA 69 HB2 ALA 69 12.278 5.759 -0.067 571 3HB ALA 69 HB3 ALA 69 12.421 4.309 0.927 572 H LYS 70 H LYS 70 16.114 5.840 1.240 573 HA LYS 70 HA LYS 70 16.416 8.193 -0.407 574 1HB LYS 70 HB2 LYS 70 18.309 5.834 -0.178 575 2HB LYS 70 HB3 LYS 70 18.713 7.471 -0.694 576 1HG LYS 70 HG2 LYS 70 17.633 8.070 1.681 577 2HG LYS 70 HG3 LYS 70 18.168 6.429 2.046 578 1HD LYS 70 HD2 LYS 70 20.067 7.675 2.592 579 2HD LYS 70 HD3 LYS 70 20.413 7.208 0.926 580 1HE LYS 70 HE2 LYS 70 19.794 9.340 0.085 581 2HE LYS 70 HE3 LYS 70 18.993 9.789 1.591 582 1HZ LYS 70 HZ1 LYS 70 21.390 9.365 2.536 583 2HZ LYS 70 HZ2 LYS 70 21.845 9.735 0.945 584 3HZ LYS 70 HZ3 LYS 70 20.960 10.863 1.857 585 H LYS 71 H LYS 71 15.360 5.005 -1.049 586 HA LYS 71 HA LYS 71 15.536 5.570 -3.975 587 1HB LYS 71 HB2 LYS 71 15.983 2.859 -2.688 588 2HB LYS 71 HB3 LYS 71 16.066 3.228 -4.411 589 1HG LYS 71 HG2 LYS 71 17.767 5.057 -2.999 590 2HG LYS 71 HG3 LYS 71 18.157 3.414 -2.491 591 1HD LYS 71 HD2 LYS 71 17.914 3.015 -5.155 592 2HD LYS 71 HD3 LYS 71 18.461 4.692 -5.154 593 1HE LYS 71 HE2 LYS 71 19.904 2.849 -3.327 594 2HE LYS 71 HE3 LYS 71 20.166 2.594 -5.053 595 1HZ LYS 71 HZ1 LYS 71 20.465 5.194 -3.647 596 2HZ LYS 71 HZ2 LYS 71 21.745 4.175 -4.096 597 3HZ LYS 71 HZ3 LYS 71 20.779 4.899 -5.290 598 H ILE 72 H ILE 72 13.633 5.166 -5.060 599 HA ILE 72 HA ILE 72 11.528 3.599 -3.645 600 HB ILE 72 HB ILE 72 11.257 6.374 -4.826 601 1HG1 ILE 72 HG12 ILE 72 10.224 5.458 -2.161 602 2HG1 ILE 72 HG13 ILE 72 11.947 5.790 -2.339 603 1HG2 ILE 72 HG21 ILE 72 9.284 4.189 -4.506 604 2HG2 ILE 72 HG22 ILE 72 8.779 5.759 -3.883 605 3HG2 ILE 72 HG23 ILE 72 9.247 5.590 -5.575 606 1HD1 ILE 72 HD11 ILE 72 10.034 7.808 -3.425 607 2HD1 ILE 72 HD12 ILE 72 10.218 7.716 -1.673 608 3HD1 ILE 72 HD13 ILE 72 11.619 8.046 -2.691 609 H GLU 73 H GLU 73 10.574 2.150 -5.005 610 HA GLU 73 HA GLU 73 10.662 2.701 -7.935 611 1HB GLU 73 HB2 GLU 73 11.721 0.316 -6.454 612 2HB GLU 73 HB3 GLU 73 11.043 0.091 -8.066 613 1HG GLU 73 HG2 GLU 73 12.800 1.110 -9.074 614 2HG GLU 73 HG3 GLU 73 12.867 2.390 -7.861 615 H VAL 74 H VAL 74 9.215 0.940 -9.066 616 HA VAL 74 HA VAL 74 6.896 0.210 -7.354 617 HB VAL 74 HB VAL 74 5.370 1.062 -9.179 618 1HG1 VAL 74 HG11 VAL 74 6.646 2.440 -7.084 619 2HG1 VAL 74 HG12 VAL 74 6.675 3.547 -8.456 620 3HG1 VAL 74 HG13 VAL 74 5.141 2.890 -7.884 621 1HG2 VAL 74 HG21 VAL 74 8.036 1.856 -10.252 622 2HG2 VAL 74 HG22 VAL 74 6.574 1.384 -11.117 623 3HG2 VAL 74 HG23 VAL 74 6.720 3.012 -10.455 624 H GLU 75 H GLU 75 5.915 -1.716 -8.012 625 HA GLU 75 HA GLU 75 7.099 -3.000 -10.443 626 1HB GLU 75 HB2 GLU 75 7.822 -4.117 -8.383 627 2HB GLU 75 HB3 GLU 75 6.144 -4.290 -7.869 628 1HG GLU 75 HG2 GLU 75 5.658 -5.733 -9.765 629 2HG GLU 75 HG3 GLU 75 7.275 -5.471 -10.423 630 H PHE 76 H PHE 76 5.375 -2.242 -11.795 631 HA PHE 76 HA PHE 76 2.609 -2.443 -11.243 632 1HB PHE 76 HB2 PHE 76 4.068 -2.738 -13.888 633 2HB PHE 76 HB3 PHE 76 2.327 -2.509 -13.728 634 HD1 PHE 76 HD1 PHE 76 1.407 -0.392 -12.839 635 HD2 PHE 76 HD2 PHE 76 5.619 -0.922 -13.495 636 HE1 PHE 76 HE1 PHE 76 1.741 2.060 -12.677 637 HE2 PHE 76 HE2 PHE 76 5.953 1.529 -13.332 638 HZ PHE 76 HZ PHE 76 4.014 3.021 -12.924 639 H ASP 77 H ASP 77 1.061 -4.091 -11.820 640 HA ASP 77 HA ASP 77 2.150 -6.812 -11.537 641 1HB ASP 77 HB2 ASP 77 -0.245 -5.540 -10.791 642 2HB ASP 77 HB3 ASP 77 -0.706 -6.693 -12.042 643 H LYS 78 H LYS 78 0.640 -8.438 -13.019 644 HA LYS 78 HA LYS 78 1.419 -7.719 -15.783 645 1HB LYS 78 HB2 LYS 78 0.829 -10.117 -16.257 646 2HB LYS 78 HB3 LYS 78 2.086 -9.928 -15.034 647 1HG LYS 78 HG2 LYS 78 -0.631 -9.901 -13.920 648 2HG LYS 78 HG3 LYS 78 -0.216 -11.418 -14.719 649 1HD LYS 78 HD2 LYS 78 2.078 -10.724 -13.260 650 2HD LYS 78 HD3 LYS 78 0.727 -10.372 -12.181 651 1HE LYS 78 HE2 LYS 78 1.399 -12.695 -11.876 652 2HE LYS 78 HE3 LYS 78 -0.185 -12.651 -12.650 653 1HZ LYS 78 HZ1 LYS 78 0.988 -12.853 -14.810 654 2HZ LYS 78 HZ2 LYS 78 2.438 -13.105 -13.959 655 3HZ LYS 78 HZ3 LYS 78 1.162 -14.213 -13.805 656 H GLY 79 H GLY 79 -1.166 -7.006 -14.007 657 1HA GLY 79 HA2 GLY 79 -3.152 -7.696 -16.127 658 2HA GLY 79 HA3 GLY 79 -3.566 -7.267 -14.466 659 H GLN 80 H GLN 80 -4.567 -5.318 -14.468 660 HA GLN 80 HA GLN 80 -4.031 -3.337 -16.548 661 1HB GLN 80 HB2 GLN 80 -5.551 -2.680 -14.048 662 2HB GLN 80 HB3 GLN 80 -5.873 -2.194 -15.712 663 1HG GLN 80 HG2 GLN 80 -6.115 -4.914 -15.894 664 2HG GLN 80 HG3 GLN 80 -6.726 -4.619 -14.266 665 1HE2 GLN 80 HE21 GLN 80 -8.446 -5.455 -16.430 666 2HE2 GLN 80 HE22 GLN 80 -9.523 -4.184 -16.760 667 H ARG 81 H ARG 81 -3.279 -1.138 -16.056 668 HA ARG 81 HA ARG 81 -1.306 -1.143 -13.810 669 1HB ARG 81 HB2 ARG 81 -1.328 0.116 -16.540 670 2HB ARG 81 HB3 ARG 81 -0.371 0.849 -15.251 671 1HG ARG 81 HG2 ARG 81 1.182 -0.795 -15.327 672 2HG ARG 81 HG3 ARG 81 -0.047 -2.060 -15.393 673 1HD ARG 81 HD2 ARG 81 -0.315 -1.787 -17.767 674 2HD ARG 81 HD3 ARG 81 0.670 -0.325 -17.769 675 HE ARG 81 HE ARG 81 1.813 -3.012 -17.115 676 1HH1 ARG 81 HH11 ARG 81 3.090 -0.106 -16.986 677 2HH1 ARG 81 HH12 ARG 81 4.134 -0.212 -18.364 678 1HH2 ARG 81 HH21 ARG 81 2.637 -3.083 -19.607 679 2HH2 ARG 81 HH22 ARG 81 3.878 -1.899 -19.848 680 H THR 82 H THR 82 -4.253 0.171 -14.812 681 HA THR 82 HA THR 82 -4.052 2.248 -12.698 682 HB THR 82 HB THR 82 -4.959 3.976 -14.109 683 HG1 THR 82 HG1 THR 82 -4.894 2.366 -16.379 684 1HG2 THR 82 HG21 THR 82 -2.463 3.273 -14.314 685 2HG2 THR 82 HG22 THR 82 -2.929 2.656 -15.899 686 3HG2 THR 82 HG23 THR 82 -3.126 4.369 -15.526 687 H ASP 83 H ASP 83 -6.069 2.672 -11.695 688 HA ASP 83 HA ASP 83 -8.125 0.610 -12.220 689 1HB ASP 83 HB2 ASP 83 -7.232 2.108 -9.916 690 2HB ASP 83 HB3 ASP 83 -8.969 2.309 -10.129 691 H LYS 84 H LYS 84 -10.422 1.934 -11.409 692 HA LYS 84 HA LYS 84 -11.074 3.431 -13.817 693 1HB LYS 84 HB2 LYS 84 -13.315 3.479 -12.972 694 2HB LYS 84 HB3 LYS 84 -12.657 1.905 -12.525 695 1HG LYS 84 HG2 LYS 84 -12.225 2.644 -10.269 696 2HG LYS 84 HG3 LYS 84 -12.624 4.311 -10.685 697 1HD LYS 84 HD2 LYS 84 -14.712 3.813 -9.963 698 2HD LYS 84 HD3 LYS 84 -14.884 2.937 -11.484 699 1HE LYS 84 HE2 LYS 84 -14.639 0.884 -10.490 700 2HE LYS 84 HE3 LYS 84 -13.526 1.494 -9.265 701 1HZ LYS 84 HZ1 LYS 84 -15.622 2.755 -8.448 702 2HZ LYS 84 HZ2 LYS 84 -16.463 1.549 -9.300 703 3HZ LYS 84 HZ3 LYS 84 -15.411 1.118 -8.041 704 H TYR 85 H TYR 85 -9.773 4.262 -10.772 705 HA TYR 85 HA TYR 85 -10.837 7.011 -10.808 706 1HB TYR 85 HB2 TYR 85 -9.095 5.415 -8.954 707 2HB TYR 85 HB3 TYR 85 -9.087 7.177 -8.849 708 HD1 TYR 85 HD1 TYR 85 -11.502 4.314 -9.090 709 HD2 TYR 85 HD2 TYR 85 -10.694 8.233 -7.527 710 HE1 TYR 85 HE1 TYR 85 -13.639 4.253 -7.834 711 HE2 TYR 85 HE2 TYR 85 -12.831 8.172 -6.270 712 HH TYR 85 HH TYR 85 -15.159 6.814 -6.672 713 H GLY 86 H GLY 86 -8.419 5.396 -12.433 714 1HA GLY 86 HA2 GLY 86 -6.798 6.319 -13.894 715 2HA GLY 86 HA3 GLY 86 -7.173 7.916 -13.247 716 H ARG 87 H ARG 87 -6.543 5.488 -10.899 717 HA ARG 87 HA ARG 87 -3.984 6.837 -10.239 718 1HB ARG 87 HB2 ARG 87 -5.945 5.134 -8.753 719 2HB ARG 87 HB3 ARG 87 -4.267 5.134 -8.211 720 1HG ARG 87 HG2 ARG 87 -4.819 7.008 -7.065 721 2HG ARG 87 HG3 ARG 87 -4.760 7.819 -8.631 722 1HD ARG 87 HD2 ARG 87 -6.910 8.388 -8.078 723 2HD ARG 87 HD3 ARG 87 -7.255 6.797 -8.758 724 HE ARG 87 HE ARG 87 -7.631 7.524 -6.019 725 1HH1 ARG 87 HH11 ARG 87 -5.321 5.705 -5.641 726 2HH1 ARG 87 HH12 ARG 87 -6.073 4.147 -5.551 727 1HH2 ARG 87 HH21 ARG 87 -9.067 5.218 -6.934 728 2HH2 ARG 87 HH22 ARG 87 -8.193 3.872 -6.282 729 H GLY 88 H GLY 88 -2.017 5.657 -10.035 730 1HA GLY 88 HA2 GLY 88 -1.804 3.357 -11.819 731 2HA GLY 88 HA3 GLY 88 -0.476 4.100 -10.924 732 H LEU 89 H LEU 89 -1.214 1.215 -11.179 733 HA LEU 89 HA LEU 89 -1.511 0.661 -8.256 734 1HB LEU 89 HB2 LEU 89 -2.494 -1.183 -10.442 735 2HB LEU 89 HB3 LEU 89 -2.841 -1.265 -8.713 736 HG LEU 89 HG LEU 89 -3.577 1.256 -10.118 737 1HD1 LEU 89 HD11 LEU 89 -4.306 -0.537 -11.685 738 2HD1 LEU 89 HD12 LEU 89 -5.198 -1.297 -10.367 739 3HD1 LEU 89 HD13 LEU 89 -5.673 0.299 -10.948 740 1HD2 LEU 89 HD21 LEU 89 -4.045 0.000 -7.627 741 2HD2 LEU 89 HD22 LEU 89 -4.737 1.517 -8.200 742 3HD2 LEU 89 HD23 LEU 89 -5.594 -0.001 -8.470 743 H ALA 90 H ALA 90 0.311 -0.257 -7.487 744 HA ALA 90 HA ALA 90 1.598 -2.487 -8.792 745 1HB ALA 90 HB1 ALA 90 3.079 0.161 -8.819 746 2HB ALA 90 HB2 ALA 90 3.762 -1.399 -9.276 747 3HB ALA 90 HB3 ALA 90 2.469 -0.686 -10.240 748 H TYR 91 H TYR 91 3.828 -2.883 -7.586 749 HA TYR 91 HA TYR 91 3.257 -2.455 -4.701 750 1HB TYR 91 HB2 TYR 91 5.327 -4.259 -5.988 751 2HB TYR 91 HB3 TYR 91 4.806 -4.281 -4.303 752 HD1 TYR 91 HD1 TYR 91 3.855 -5.074 -7.776 753 HD2 TYR 91 HD2 TYR 91 2.644 -5.199 -3.657 754 HE1 TYR 91 HE1 TYR 91 2.007 -6.618 -8.367 755 HE2 TYR 91 HE2 TYR 91 0.795 -6.743 -4.248 756 HH TYR 91 HH TYR 91 0.638 -8.441 -7.033 757 H ILE 92 H ILE 92 4.182 -0.600 -3.939 758 HA ILE 92 HA ILE 92 6.574 0.543 -5.136 759 HB ILE 92 HB ILE 92 5.344 1.244 -2.457 760 1HG1 ILE 92 HG12 ILE 92 4.637 2.279 -5.224 761 2HG1 ILE 92 HG13 ILE 92 3.614 1.241 -4.231 762 1HG2 ILE 92 HG21 ILE 92 7.633 2.155 -3.741 763 2HG2 ILE 92 HG22 ILE 92 6.419 3.358 -4.176 764 3HG2 ILE 92 HG23 ILE 92 6.752 3.016 -2.478 765 1HD1 ILE 92 HD11 ILE 92 4.511 3.552 -2.721 766 2HD1 ILE 92 HD12 ILE 92 3.682 4.048 -4.198 767 3HD1 ILE 92 HD13 ILE 92 2.866 3.000 -3.038 768 H TYR 93 H TYR 93 8.686 0.428 -4.366 769 HA TYR 93 HA TYR 93 9.127 -1.326 -1.983 770 1HB TYR 93 HB2 TYR 93 10.705 -1.200 -4.569 771 2HB TYR 93 HB3 TYR 93 11.225 -2.085 -3.135 772 HD1 TYR 93 HD1 TYR 93 8.537 -1.828 -5.692 773 HD2 TYR 93 HD2 TYR 93 10.296 -4.210 -2.581 774 HE1 TYR 93 HE1 TYR 93 7.118 -3.749 -6.361 775 HE2 TYR 93 HE2 TYR 93 8.879 -6.131 -3.249 776 HH TYR 93 HH TYR 93 7.585 -6.940 -4.997 777 H ALA 94 H ALA 94 10.324 -0.372 -0.407 778 HA ALA 94 HA ALA 94 11.948 2.025 -1.167 779 1HB ALA 94 HB1 ALA 94 9.906 1.647 0.885 780 2HB ALA 94 HB2 ALA 94 11.428 2.222 1.566 781 3HB ALA 94 HB3 ALA 94 10.630 3.141 0.289 782 H ASP 95 H ASP 95 14.091 1.924 -0.610 783 HA ASP 95 HA ASP 95 16.082 1.106 0.326 784 1HB ASP 95 HB2 ASP 95 14.232 -0.113 2.400 785 2HB ASP 95 HB3 ASP 95 15.970 0.136 2.568 786 H GLY 96 H GLY 96 14.495 -0.443 -1.648 787 1HA GLY 96 HA2 GLY 96 14.770 -2.512 -2.731 788 2HA GLY 96 HA3 GLY 96 16.031 -2.890 -1.556 789 H LYS 97 H LYS 97 12.877 -1.967 -0.409 790 HA LYS 97 HA LYS 97 12.289 -4.837 0.190 791 1HB LYS 97 HB2 LYS 97 13.069 -3.005 2.084 792 2HB LYS 97 HB3 LYS 97 11.310 -2.872 2.159 793 1HG LYS 97 HG2 LYS 97 11.073 -5.236 2.562 794 2HG LYS 97 HG3 LYS 97 12.786 -5.515 2.246 795 1HD LYS 97 HD2 LYS 97 12.911 -5.405 4.534 796 2HD LYS 97 HD3 LYS 97 13.002 -3.674 4.205 797 1HE LYS 97 HE2 LYS 97 10.247 -4.383 4.214 798 2HE LYS 97 HE3 LYS 97 10.977 -5.108 5.647 799 1HZ LYS 97 HZ1 LYS 97 12.101 -2.688 5.655 800 2HZ LYS 97 HZ2 LYS 97 10.590 -2.316 4.976 801 3HZ LYS 97 HZ3 LYS 97 10.674 -3.067 6.494 802 H MET 98 H MET 98 9.909 -5.141 0.736 803 HA MET 98 HA MET 98 8.309 -3.665 -1.244 804 1HB MET 98 HB2 MET 98 8.091 -6.124 -1.027 805 2HB MET 98 HB3 MET 98 7.524 -5.917 0.630 806 1HG MET 98 HG2 MET 98 5.445 -5.794 -0.250 807 2HG MET 98 HG3 MET 98 5.904 -4.188 -0.816 808 1HE MET 98 HE1 MET 98 4.230 -7.102 -1.643 809 2HE MET 98 HE2 MET 98 4.787 -7.773 -3.183 810 3HE MET 98 HE3 MET 98 5.729 -8.026 -1.715 811 H VAL 99 H VAL 99 7.702 -1.660 -0.513 812 HA VAL 99 HA VAL 99 7.292 -0.844 2.146 813 HB VAL 99 HB VAL 99 5.712 0.136 -0.250 814 1HG1 VAL 99 HG11 VAL 99 5.694 0.863 2.475 815 2HG1 VAL 99 HG12 VAL 99 6.616 2.121 1.652 816 3HG1 VAL 99 HG13 VAL 99 4.972 1.752 1.134 817 1HG2 VAL 99 HG21 VAL 99 8.569 0.238 0.357 818 2HG2 VAL 99 HG22 VAL 99 7.727 0.669 -1.130 819 3HG2 VAL 99 HG23 VAL 99 7.869 1.846 0.176 820 H ASN 100 H ASN 100 4.941 -2.247 -0.141 821 HA ASN 100 HA ASN 100 2.639 -2.052 1.499 822 1HB ASN 100 HB2 ASN 100 3.341 -4.292 -0.424 823 2HB ASN 100 HB3 ASN 100 1.724 -3.875 0.145 824 1HD2 ASN 100 HD21 ASN 100 0.994 -3.342 -2.040 825 2HD2 ASN 100 HD22 ASN 100 1.522 -1.933 -2.825 826 H GLU 101 H GLU 101 5.137 -4.593 1.354 827 HA GLU 101 HA GLU 101 3.870 -6.302 3.290 828 1HB GLU 101 HB2 GLU 101 5.892 -6.721 1.616 829 2HB GLU 101 HB3 GLU 101 6.850 -6.241 3.017 830 1HG GLU 101 HG2 GLU 101 6.522 -8.245 3.985 831 2HG GLU 101 HG3 GLU 101 4.773 -8.060 3.846 832 H ALA 102 H ALA 102 5.867 -3.449 3.558 833 HA ALA 102 HA ALA 102 6.685 -3.850 6.294 834 1HB ALA 102 HB1 ALA 102 7.507 -2.114 4.478 835 2HB ALA 102 HB2 ALA 102 6.228 -1.110 5.160 836 3HB ALA 102 HB3 ALA 102 7.540 -1.685 6.188 837 H LEU 103 H LEU 103 3.942 -2.196 4.772 838 HA LEU 103 HA LEU 103 2.789 -1.189 7.192 839 1HB LEU 103 HB2 LEU 103 1.632 -1.859 4.480 840 2HB LEU 103 HB3 LEU 103 0.636 -1.223 5.789 841 HG LEU 103 HG LEU 103 3.101 0.300 5.465 842 1HD1 LEU 103 HD11 LEU 103 1.595 -0.449 3.064 843 2HD1 LEU 103 HD12 LEU 103 1.697 1.297 3.291 844 3HD1 LEU 103 HD13 LEU 103 3.170 0.332 3.201 845 1HD2 LEU 103 HD21 LEU 103 0.839 0.821 6.656 846 2HD2 LEU 103 HD22 LEU 103 1.633 2.124 5.771 847 3HD2 LEU 103 HD23 LEU 103 0.273 1.266 5.046 848 H VAL 104 H VAL 104 1.947 -4.106 5.274 849 HA VAL 104 HA VAL 104 0.060 -5.128 7.145 850 HB VAL 104 HB VAL 104 1.815 -6.934 5.494 851 1HG1 VAL 104 HG11 VAL 104 -1.092 -6.873 6.339 852 2HG1 VAL 104 HG12 VAL 104 -0.468 -8.003 5.138 853 3HG1 VAL 104 HG13 VAL 104 0.137 -8.054 6.793 854 1HG2 VAL 104 HG21 VAL 104 0.270 -4.658 4.549 855 2HG2 VAL 104 HG22 VAL 104 1.323 -5.741 3.638 856 3HG2 VAL 104 HG23 VAL 104 -0.368 -6.169 3.901 857 H ARG 105 H ARG 105 3.561 -5.239 7.068 858 HA ARG 105 HA ARG 105 3.895 -7.348 8.999 859 1HB ARG 105 HB2 ARG 105 5.721 -6.507 7.513 860 2HB ARG 105 HB3 ARG 105 5.736 -5.003 8.434 861 1HG ARG 105 HG2 ARG 105 7.086 -5.949 9.960 862 2HG ARG 105 HG3 ARG 105 5.853 -7.165 10.294 863 1HD ARG 105 HD2 ARG 105 6.914 -8.750 9.062 864 2HD ARG 105 HD3 ARG 105 7.328 -7.608 7.783 865 HE ARG 105 HE ARG 105 9.299 -6.957 9.088 866 1HH1 ARG 105 HH11 ARG 105 7.353 -8.852 11.083 867 2HH1 ARG 105 HH12 ARG 105 8.648 -9.801 11.732 868 1HH2 ARG 105 HH21 ARG 105 11.031 -8.508 9.570 869 2HH2 ARG 105 HH22 ARG 105 10.731 -9.607 10.875 870 H GLN 106 H GLN 106 3.322 -3.883 9.224 871 HA GLN 106 HA GLN 106 3.654 -3.951 12.165 872 1HB GLN 106 HB2 GLN 106 3.745 -1.915 10.105 873 2HB GLN 106 HB3 GLN 106 2.620 -1.451 11.381 874 1HG GLN 106 HG2 GLN 106 4.915 -2.585 12.635 875 2HG GLN 106 HG3 GLN 106 5.483 -1.413 11.446 876 1HE2 GLN 106 HE21 GLN 106 5.556 -1.063 14.380 877 2HE2 GLN 106 HE22 GLN 106 4.595 0.293 14.727 878 H GLY 107 H GLY 107 1.263 -4.737 10.006 879 1HA GLY 107 HA2 GLY 107 -1.000 -5.255 10.389 880 2HA GLY 107 HA3 GLY 107 -0.777 -4.759 12.067 881 H LEU 108 H LEU 108 -0.267 -2.841 9.102 882 HA LEU 108 HA LEU 108 -2.256 -0.896 10.194 883 1HB LEU 108 HB2 LEU 108 0.128 -0.522 8.363 884 2HB LEU 108 HB3 LEU 108 -1.070 0.739 8.658 885 HG LEU 108 HG LEU 108 0.439 -0.661 10.879 886 1HD1 LEU 108 HD11 LEU 108 1.682 0.895 9.056 887 2HD1 LEU 108 HD12 LEU 108 1.068 2.148 10.135 888 3HD1 LEU 108 HD13 LEU 108 2.128 0.886 10.762 889 1HD2 LEU 108 HD21 LEU 108 -1.295 1.819 10.704 890 2HD2 LEU 108 HD22 LEU 108 -1.613 0.356 11.636 891 3HD2 LEU 108 HD23 LEU 108 -0.298 1.432 12.107 892 H ALA 109 H ALA 109 -1.047 -2.162 7.062 893 HA ALA 109 HA ALA 109 -3.644 -1.421 5.829 894 1HB ALA 109 HB1 ALA 109 -0.936 -1.670 4.890 895 2HB ALA 109 HB2 ALA 109 -1.970 -2.756 3.962 896 3HB ALA 109 HB3 ALA 109 -2.340 -1.032 4.036 897 H LYS 110 H LYS 110 -5.196 -2.936 5.413 898 HA LYS 110 HA LYS 110 -4.547 -5.763 6.076 899 1HB LYS 110 HB2 LYS 110 -6.916 -6.086 6.361 900 2HB LYS 110 HB3 LYS 110 -6.499 -4.579 7.178 901 1HG LYS 110 HG2 LYS 110 -8.089 -3.578 5.932 902 2HG LYS 110 HG3 LYS 110 -7.032 -3.817 4.541 903 1HD LYS 110 HD2 LYS 110 -9.108 -4.816 3.931 904 2HD LYS 110 HD3 LYS 110 -8.049 -6.160 4.357 905 1HE LYS 110 HE2 LYS 110 -9.690 -6.808 5.771 906 2HE LYS 110 HE3 LYS 110 -9.181 -5.462 6.789 907 1HZ LYS 110 HZ1 LYS 110 -10.770 -4.331 4.868 908 2HZ LYS 110 HZ2 LYS 110 -11.571 -5.772 5.267 909 3HZ LYS 110 HZ3 LYS 110 -11.204 -4.641 6.482 910 H VAL 111 H VAL 111 -5.074 -7.456 4.597 911 HA VAL 111 HA VAL 111 -4.636 -6.877 1.840 912 HB VAL 111 HB VAL 111 -5.939 -9.328 3.067 913 1HG1 VAL 111 HG11 VAL 111 -5.043 -8.584 0.328 914 2HG1 VAL 111 HG12 VAL 111 -4.633 -10.210 0.876 915 3HG1 VAL 111 HG13 VAL 111 -6.319 -9.693 0.832 916 1HG2 VAL 111 HG21 VAL 111 -3.162 -8.327 2.937 917 2HG2 VAL 111 HG22 VAL 111 -3.880 -9.512 4.029 918 3HG2 VAL 111 HG23 VAL 111 -3.363 -9.998 2.413 919 H ALA 112 H ALA 112 -6.037 -5.963 0.420 920 HA ALA 112 HA ALA 112 -8.879 -6.729 0.471 921 1HB ALA 112 HB1 ALA 112 -7.895 -4.161 1.513 922 2HB ALA 112 HB2 ALA 112 -9.145 -3.991 0.282 923 3HB ALA 112 HB3 ALA 112 -9.463 -4.937 1.735 924 H TYR 113 H TYR 113 -10.036 -5.692 -1.438 925 HA TYR 113 HA TYR 113 -10.103 -5.423 -3.773 926 1HB TYR 113 HB2 TYR 113 -7.672 -3.740 -3.092 927 2HB TYR 113 HB3 TYR 113 -8.495 -3.718 -4.651 928 HD1 TYR 113 HD1 TYR 113 -11.188 -3.497 -4.405 929 HD2 TYR 113 HD2 TYR 113 -8.283 -2.088 -1.573 930 HE1 TYR 113 HE1 TYR 113 -12.843 -1.882 -3.512 931 HE2 TYR 113 HE2 TYR 113 -9.939 -0.473 -0.678 932 HH TYR 113 HH TYR 113 -12.357 0.632 -2.056 933 H VAL 114 H VAL 114 -9.504 -7.760 -3.934 934 HA VAL 114 HA VAL 114 -6.722 -8.114 -4.976 935 HB VAL 114 HB VAL 114 -8.610 -10.085 -3.661 936 1HG1 VAL 114 HG11 VAL 114 -6.603 -10.550 -5.652 937 2HG1 VAL 114 HG12 VAL 114 -6.016 -11.183 -4.114 938 3HG1 VAL 114 HG13 VAL 114 -7.557 -11.738 -4.766 939 1HG2 VAL 114 HG21 VAL 114 -5.876 -8.983 -2.942 940 2HG2 VAL 114 HG22 VAL 114 -7.390 -8.677 -2.091 941 3HG2 VAL 114 HG23 VAL 114 -6.678 -10.291 -2.072 942 H TYR 115 H TYR 115 -6.566 -8.582 -7.120 943 HA TYR 115 HA TYR 115 -8.767 -10.016 -8.471 944 1HB TYR 115 HB2 TYR 115 -7.778 -7.392 -9.602 945 2HB TYR 115 HB3 TYR 115 -9.168 -8.344 -10.124 946 HD1 TYR 115 HD1 TYR 115 -7.840 -6.149 -7.454 947 HD2 TYR 115 HD2 TYR 115 -11.275 -8.255 -8.945 948 HE1 TYR 115 HE1 TYR 115 -9.286 -4.919 -5.858 949 HE2 TYR 115 HE2 TYR 115 -12.721 -7.024 -7.350 950 HH TYR 115 HH TYR 115 -11.834 -5.639 -4.757 951 H LYS 116 H LYS 116 -7.919 -11.407 -9.956 952 HA LYS 116 HA LYS 116 -5.011 -11.305 -10.442 953 1HB LYS 116 HB2 LYS 116 -6.777 -13.368 -11.700 954 2HB LYS 116 HB3 LYS 116 -5.165 -13.546 -11.007 955 1HG LYS 116 HG2 LYS 116 -6.441 -12.893 -8.763 956 2HG LYS 116 HG3 LYS 116 -7.825 -13.543 -9.641 957 1HD LYS 116 HD2 LYS 116 -6.712 -15.661 -9.971 958 2HD LYS 116 HD3 LYS 116 -5.202 -15.022 -9.322 959 1HE LYS 116 HE2 LYS 116 -7.345 -14.592 -7.434 960 2HE LYS 116 HE3 LYS 116 -7.266 -16.297 -7.882 961 1HZ LYS 116 HZ1 LYS 116 -4.922 -14.684 -7.038 962 2HZ LYS 116 HZ2 LYS 116 -5.810 -15.687 -5.996 963 3HZ LYS 116 HZ3 LYS 116 -4.966 -16.361 -7.307 964 HA PRO 117 HA PRO 117 -3.779 -12.352 -11.781 965 1HB PRO 117 HB2 PRO 117 -1.802 -11.617 -13.514 966 2HB PRO 117 HB3 PRO 117 -2.959 -12.912 -13.868 967 1HG PRO 117 HG2 PRO 117 -2.792 -10.188 -15.017 968 2HG PRO 117 HG3 PRO 117 -3.524 -11.650 -15.693 969 1HD PRO 117 HD2 PRO 117 -4.880 -9.475 -14.421 970 2HD PRO 117 HD3 PRO 117 -5.590 -11.005 -14.978 971 H ASN 118 H ASN 118 -4.675 -9.441 -11.282 972 HA ASN 118 HA ASN 118 -2.128 -8.038 -10.838 973 1HB ASN 118 HB2 ASN 118 -5.016 -7.373 -10.684 974 2HB ASN 118 HB3 ASN 118 -3.969 -6.516 -9.553 975 1HD2 ASN 118 HD21 ASN 118 -4.544 -4.564 -10.958 976 2HD2 ASN 118 HD22 ASN 118 -3.641 -4.305 -12.370 977 H ASN 119 H ASN 119 -1.657 -10.145 -9.414 978 HA ASN 119 HA ASN 119 -1.727 -9.235 -6.652 979 1HB ASN 119 HB2 ASN 119 -3.028 -11.031 -5.711 980 2HB ASN 119 HB3 ASN 119 -4.002 -10.298 -6.984 981 1HD2 ASN 119 HD21 ASN 119 -4.973 -11.838 -8.292 982 2HD2 ASN 119 HD22 ASN 119 -4.314 -13.354 -8.676 983 H THR 120 H THR 120 0.147 -10.171 -8.818 984 HA THR 120 HA THR 120 1.245 -12.687 -8.478 985 HB THR 120 HB THR 120 2.651 -10.021 -8.768 986 HG1 THR 120 HG1 THR 120 2.705 -10.607 -10.885 987 1HG2 THR 120 HG21 THR 120 3.768 -12.574 -8.063 988 2HG2 THR 120 HG22 THR 120 4.280 -12.148 -9.696 989 3HG2 THR 120 HG23 THR 120 4.605 -11.050 -8.355 990 H HIS 121 H HIS 121 1.313 -10.017 -6.199 991 HA HIS 121 HA HIS 121 2.923 -11.713 -4.336 992 1HB HIS 121 HB2 HIS 121 2.567 -8.729 -4.597 993 2HB HIS 121 HB3 HIS 121 3.132 -9.445 -3.087 994 HD1 HIS 121 HD1 HIS 121 5.201 -11.317 -3.594 995 HD2 HIS 121 HD2 HIS 121 4.686 -8.153 -6.257 996 HE1 HIS 121 HE1 HIS 121 7.381 -11.087 -4.864 997 H GLU 122 H GLU 122 0.367 -12.538 -4.488 998 HA GLU 122 HA GLU 122 -1.258 -11.106 -2.483 999 1HB GLU 122 HB2 GLU 122 -2.107 -12.251 -4.666 1000 2HB GLU 122 HB3 GLU 122 -1.980 -13.744 -3.738 1001 1HG GLU 122 HG2 GLU 122 -3.330 -12.483 -1.917 1002 2HG GLU 122 HG3 GLU 122 -3.731 -11.349 -3.207 1003 H GLN 123 H GLN 123 -0.155 -14.491 -2.917 1004 HA GLN 123 HA GLN 123 -0.792 -15.500 -0.408 1005 1HB GLN 123 HB2 GLN 123 1.047 -16.191 -2.528 1006 2HB GLN 123 HB3 GLN 123 1.787 -16.509 -0.959 1007 1HG GLN 123 HG2 GLN 123 -1.010 -17.337 -1.029 1008 2HG GLN 123 HG3 GLN 123 -0.048 -18.150 -2.265 1009 1HE2 GLN 123 HE21 GLN 123 2.438 -18.406 -1.002 1010 2HE2 GLN 123 HE22 GLN 123 2.281 -19.371 0.386 1011 H LEU 124 H LEU 124 2.005 -13.489 -1.269 1012 HA LEU 124 HA LEU 124 3.388 -13.672 1.209 1013 1HB LEU 124 HB2 LEU 124 3.876 -12.406 -1.140 1014 2HB LEU 124 HB3 LEU 124 3.395 -11.033 -0.142 1015 HG LEU 124 HG LEU 124 5.049 -11.716 1.573 1016 1HD1 LEU 124 HD11 LEU 124 5.534 -13.922 -0.430 1017 2HD1 LEU 124 HD12 LEU 124 6.784 -13.435 0.717 1018 3HD1 LEU 124 HD13 LEU 124 5.241 -14.058 1.305 1019 1HD2 LEU 124 HD21 LEU 124 5.681 -10.119 -0.223 1020 2HD2 LEU 124 HD22 LEU 124 7.056 -11.095 0.293 1021 3HD2 LEU 124 HD23 LEU 124 6.225 -11.471 -1.216 1022 H LEU 125 H LEU 125 1.318 -10.946 0.137 1023 HA LEU 125 HA LEU 125 1.100 -9.769 2.720 1024 1HB LEU 125 HB2 LEU 125 -0.746 -9.650 0.319 1025 2HB LEU 125 HB3 LEU 125 -0.944 -8.645 1.755 1026 HG LEU 125 HG LEU 125 1.623 -8.746 0.155 1027 1HD1 LEU 125 HD11 LEU 125 -0.812 -6.979 -0.105 1028 2HD1 LEU 125 HD12 LEU 125 0.785 -6.427 -0.612 1029 3HD1 LEU 125 HD13 LEU 125 0.055 -7.841 -1.375 1030 1HD2 LEU 125 HD21 LEU 125 0.510 -6.911 2.297 1031 2HD2 LEU 125 HD22 LEU 125 1.931 -7.949 2.417 1032 3HD2 LEU 125 HD23 LEU 125 1.953 -6.543 1.353 1033 H ARG 126 H ARG 126 -0.272 -12.643 1.497 1034 HA ARG 126 HA ARG 126 -2.730 -12.643 3.016 1035 1HB ARG 126 HB2 ARG 126 -1.774 -14.204 1.024 1036 2HB ARG 126 HB3 ARG 126 -1.401 -15.231 2.408 1037 1HG ARG 126 HG2 ARG 126 -3.604 -15.620 2.887 1038 2HG ARG 126 HG3 ARG 126 -4.099 -13.997 2.405 1039 1HD ARG 126 HD2 ARG 126 -4.647 -14.696 0.333 1040 2HD ARG 126 HD3 ARG 126 -3.094 -15.506 0.132 1041 HE ARG 126 HE ARG 126 -4.207 -17.521 0.596 1042 1HH1 ARG 126 HH11 ARG 126 -6.660 -15.395 0.516 1043 2HH1 ARG 126 HH12 ARG 126 -7.613 -16.094 1.781 1044 1HH2 ARG 126 HH21 ARG 126 -5.090 -18.204 2.877 1045 2HH2 ARG 126 HH22 ARG 126 -6.724 -17.683 3.119 1046 H LYS 127 H LYS 127 0.171 -14.688 3.517 1047 HA LYS 127 HA LYS 127 -0.498 -15.357 6.208 1048 1HB LYS 127 HB2 LYS 127 1.836 -16.118 6.394 1049 2HB LYS 127 HB3 LYS 127 1.139 -16.631 4.857 1050 1HG LYS 127 HG2 LYS 127 2.125 -14.363 3.970 1051 2HG LYS 127 HG3 LYS 127 3.167 -14.479 5.388 1052 1HD LYS 127 HD2 LYS 127 3.274 -17.039 4.352 1053 2HD LYS 127 HD3 LYS 127 3.223 -16.036 2.902 1054 1HE LYS 127 HE2 LYS 127 5.437 -15.706 3.206 1055 2HE LYS 127 HE3 LYS 127 4.992 -14.685 4.573 1056 1HZ LYS 127 HZ1 LYS 127 5.431 -17.617 4.725 1057 2HZ LYS 127 HZ2 LYS 127 6.576 -16.443 5.170 1058 3HZ LYS 127 HZ3 LYS 127 5.114 -16.576 6.026 1059 H SER 128 H SER 128 1.269 -12.639 4.836 1060 HA SER 128 HA SER 128 2.448 -11.677 7.254 1061 1HB SER 128 HB2 SER 128 1.457 -9.947 4.979 1062 2HB SER 128 HB3 SER 128 2.781 -9.610 6.090 1063 HG SER 128 HG SER 128 3.658 -11.688 5.182 1064 H GLU 129 H GLU 129 -0.681 -10.912 5.708 1065 HA GLU 129 HA GLU 129 -1.542 -9.004 7.638 1066 1HB GLU 129 HB2 GLU 129 -2.656 -9.414 5.438 1067 2HB GLU 129 HB3 GLU 129 -3.273 -10.940 6.072 1068 1HG GLU 129 HG2 GLU 129 -3.800 -8.716 7.885 1069 2HG GLU 129 HG3 GLU 129 -4.517 -8.455 6.295 1070 H ALA 130 H ALA 130 -1.998 -12.543 7.506 1071 HA ALA 130 HA ALA 130 -3.585 -12.755 9.866 1072 1HB ALA 130 HB1 ALA 130 -2.839 -14.541 8.027 1073 2HB ALA 130 HB2 ALA 130 -1.603 -14.898 9.233 1074 3HB ALA 130 HB3 ALA 130 -3.310 -15.040 9.652 1075 H GLN 131 H GLN 131 -0.113 -12.487 9.379 1076 HA GLN 131 HA GLN 131 0.691 -13.207 12.038 1077 1HB GLN 131 HB2 GLN 131 2.072 -12.730 9.799 1078 2HB GLN 131 HB3 GLN 131 2.210 -11.126 10.522 1079 1HG GLN 131 HG2 GLN 131 3.076 -12.160 12.606 1080 2HG GLN 131 HG3 GLN 131 2.988 -13.746 11.839 1081 1HE2 GLN 131 HE21 GLN 131 4.249 -10.503 10.841 1082 2HE2 GLN 131 HE22 GLN 131 5.737 -11.097 10.282 1083 H ALA 132 H ALA 132 -0.232 -10.127 10.537 1084 HA ALA 132 HA ALA 132 0.327 -8.494 12.836 1085 1HB ALA 132 HB1 ALA 132 -1.590 -8.099 10.519 1086 2HB ALA 132 HB2 ALA 132 -1.214 -6.859 11.714 1087 3HB ALA 132 HB3 ALA 132 0.052 -7.468 10.649 1088 H LYS 133 H LYS 133 -2.535 -10.296 11.763 1089 HA LYS 133 HA LYS 133 -4.350 -9.263 13.720 1090 1HB LYS 133 HB2 LYS 133 -4.333 -11.365 11.745 1091 2HB LYS 133 HB3 LYS 133 -4.995 -11.985 13.257 1092 1HG LYS 133 HG2 LYS 133 -6.403 -9.815 13.302 1093 2HG LYS 133 HG3 LYS 133 -5.967 -9.659 11.599 1094 1HD LYS 133 HD2 LYS 133 -6.819 -12.367 12.194 1095 2HD LYS 133 HD3 LYS 133 -8.061 -11.203 12.659 1096 1HE LYS 133 HE2 LYS 133 -7.160 -10.256 10.200 1097 2HE LYS 133 HE3 LYS 133 -7.183 -12.007 9.991 1098 1HZ LYS 133 HZ1 LYS 133 -9.449 -10.455 11.112 1099 2HZ LYS 133 HZ2 LYS 133 -9.319 -10.879 9.472 1100 3HZ LYS 133 HZ3 LYS 133 -9.448 -12.088 10.659 1101 H LYS 134 H LYS 134 -2.096 -12.014 13.774 1102 HA LYS 134 HA LYS 134 -2.855 -12.908 16.412 1103 1HB LYS 134 HB2 LYS 134 -0.672 -13.474 14.477 1104 2HB LYS 134 HB3 LYS 134 -0.309 -13.802 16.173 1105 1HG LYS 134 HG2 LYS 134 -2.973 -14.730 15.448 1106 2HG LYS 134 HG3 LYS 134 -1.729 -15.471 14.441 1107 1HD LYS 134 HD2 LYS 134 -0.621 -16.417 16.283 1108 2HD LYS 134 HD3 LYS 134 -1.366 -15.298 17.425 1109 1HE LYS 134 HE2 LYS 134 -3.463 -16.715 16.104 1110 2HE LYS 134 HE3 LYS 134 -2.275 -17.898 16.654 1111 1HZ LYS 134 HZ1 LYS 134 -3.429 -15.755 18.353 1112 2HZ LYS 134 HZ2 LYS 134 -3.966 -17.364 18.340 1113 3HZ LYS 134 HZ3 LYS 134 -2.389 -17.000 18.858 1114 H GLU 135 H GLU 135 -0.820 -10.372 15.199 1115 HA GLU 135 HA GLU 135 0.481 -9.996 17.837 1116 1HB GLU 135 HB2 GLU 135 0.786 -8.369 15.295 1117 2HB GLU 135 HB3 GLU 135 1.824 -8.303 16.719 1118 1HG GLU 135 HG2 GLU 135 1.413 -10.932 15.330 1119 2HG GLU 135 HG3 GLU 135 2.542 -9.762 14.647 1120 H LYS 136 H LYS 136 -2.349 -9.068 16.270 1121 HA LYS 136 HA LYS 136 -3.837 -7.264 16.561 1122 1HB LYS 136 HB2 LYS 136 -3.516 -6.629 19.263 1123 2HB LYS 136 HB3 LYS 136 -4.632 -7.820 18.602 1124 1HG LYS 136 HG2 LYS 136 -2.694 -9.488 18.704 1125 2HG LYS 136 HG3 LYS 136 -1.845 -8.288 19.680 1126 1HD LYS 136 HD2 LYS 136 -4.582 -9.420 20.333 1127 2HD LYS 136 HD3 LYS 136 -3.073 -9.947 21.078 1128 1HE LYS 136 HE2 LYS 136 -3.675 -7.022 21.093 1129 2HE LYS 136 HE3 LYS 136 -4.584 -8.053 22.198 1130 1HZ LYS 136 HZ1 LYS 136 -2.056 -8.951 22.488 1131 2HZ LYS 136 HZ2 LYS 136 -1.811 -7.286 22.265 1132 3HZ LYS 136 HZ3 LYS 136 -2.815 -7.833 23.518 1133 H LEU 137 H LEU 137 -1.986 -6.066 15.295 1134 HA LEU 137 HA LEU 137 -0.917 -3.856 17.001 1135 1HB LEU 137 HB2 LEU 137 0.372 -5.492 15.141 1136 2HB LEU 137 HB3 LEU 137 0.117 -3.977 14.277 1137 HG LEU 137 HG LEU 137 1.516 -4.355 16.936 1138 1HD1 LEU 137 HD11 LEU 137 2.433 -4.412 14.292 1139 2HD1 LEU 137 HD12 LEU 137 2.839 -2.794 14.864 1140 3HD1 LEU 137 HD13 LEU 137 3.424 -4.210 15.738 1141 1HD2 LEU 137 HD21 LEU 137 0.387 -1.920 15.586 1142 2HD2 LEU 137 HD22 LEU 137 0.405 -2.336 17.300 1143 3HD2 LEU 137 HD23 LEU 137 1.880 -1.773 16.515 1144 H ASN 138 H ASN 138 -1.903 -1.910 16.755 1145 HA ASN 138 HA ASN 138 -3.113 -0.155 15.786 1146 1HB ASN 138 HB2 ASN 138 -2.454 -1.570 13.187 1147 2HB ASN 138 HB3 ASN 138 -2.970 0.104 13.360 1148 1HD2 ASN 138 HD21 ASN 138 -0.248 -1.534 12.701 1149 2HD2 ASN 138 HD22 ASN 138 0.905 -0.577 13.498 1150 H ILE 139 H ILE 139 -4.553 -0.941 13.071 1151 HA ILE 139 HA ILE 139 -7.151 -1.130 13.835 1152 HB ILE 139 HB ILE 139 -5.963 -2.890 11.676 1153 1HG1 ILE 139 HG12 ILE 139 -7.015 -0.519 10.582 1154 2HG1 ILE 139 HG13 ILE 139 -6.050 -0.009 11.968 1155 1HG2 ILE 139 HG21 ILE 139 -8.711 -1.680 12.094 1156 2HG2 ILE 139 HG22 ILE 139 -8.193 -2.472 10.605 1157 3HG2 ILE 139 HG23 ILE 139 -8.300 -3.395 12.104 1158 1HD1 ILE 139 HD11 ILE 139 -4.188 -1.482 11.098 1159 2HD1 ILE 139 HD12 ILE 139 -5.143 -1.710 9.633 1160 3HD1 ILE 139 HD13 ILE 139 -4.569 -0.100 10.070 1161 H TRP 140 H TRP 140 -4.807 -3.746 14.110 1162 HA TRP 140 HA TRP 140 -6.898 -5.677 14.873 1163 1HB TRP 140 HB2 TRP 140 -3.901 -6.049 15.070 1164 2HB TRP 140 HB3 TRP 140 -5.142 -7.298 14.956 1165 HD1 TRP 140 HD1 TRP 140 -2.825 -5.345 12.876 1166 HE1 TRP 140 HE1 TRP 140 -3.397 -5.606 10.375 1167 HE3 TRP 140 HE3 TRP 140 -7.433 -7.514 13.246 1168 HZ2 TRP 140 HZ2 TRP 140 -5.528 -6.603 8.747 1169 HZ3 TRP 140 HZ3 TRP 140 -8.711 -8.109 11.208 1170 HH2 TRP 140 HH2 TRP 140 -7.765 -7.657 8.961 1171 H SER 141 H SER 141 -6.762 -3.372 16.557 1172 HA SER 141 HA SER 141 -5.578 -4.511 19.054 1173 1HB SER 141 HB2 SER 141 -5.392 -1.935 17.944 1174 2HB SER 141 HB3 SER 141 -6.509 -1.774 19.296 1175 HG SER 141 HG SER 141 -3.856 -2.055 19.336 1176 H GLU 142 H GLU 142 -7.743 -5.851 18.697 1177 HA GLU 142 HA GLU 142 -10.205 -4.487 19.431 1178 1HB GLU 142 HB2 GLU 142 -9.568 -7.452 19.474 1179 2HB GLU 142 HB3 GLU 142 -11.177 -6.728 19.498 1180 1HG GLU 142 HG2 GLU 142 -9.570 -5.716 17.286 1181 2HG GLU 142 HG3 GLU 142 -9.740 -7.471 17.222 1182 H ASP 143 H ASP 143 -11.397 -5.918 21.376 1183 HA ASP 143 HA ASP 143 -9.539 -5.746 23.715 1184 1HB ASP 143 HB2 ASP 143 -10.993 -3.785 23.729 1185 2HB ASP 143 HB3 ASP 143 -12.418 -4.806 23.533 1186 H ASN 144 H ASN 144 -9.300 -7.870 24.304 1187 HA ASN 144 HA ASN 144 -11.804 -9.489 24.569 1188 1HB ASN 144 HB2 ASN 144 -9.548 -10.041 22.964 1189 2HB ASN 144 HB3 ASN 144 -9.434 -11.131 24.347 1190 1HD2 ASN 144 HD21 ASN 144 -9.940 -12.709 22.386 1191 2HD2 ASN 144 HD22 ASN 144 -11.583 -13.035 22.116 1192 H ALA 145 H ALA 145 -8.445 -10.086 25.606 1193 HA ALA 145 HA ALA 145 -8.852 -9.413 28.358 1194 1HB ALA 145 HB1 ALA 145 -10.402 -11.457 28.009 1195 2HB ALA 145 HB2 ALA 145 -8.912 -12.395 27.904 1196 3HB ALA 145 HB3 ALA 145 -9.290 -11.501 29.377 1197 H ASP 146 H ASP 146 -7.338 -12.256 26.786 1198 HA ASP 146 HA ASP 146 -4.879 -12.024 28.191 1199 1HB ASP 146 HB2 ASP 146 -3.951 -13.439 26.333 1200 2HB ASP 146 HB3 ASP 146 -5.445 -14.077 27.020 1201 H SER 147 H SER 147 -2.729 -11.651 26.849 1202 HA SER 147 HA SER 147 -2.926 -9.512 24.850 1203 1HB SER 147 HB2 SER 147 -2.930 -7.892 26.462 1204 2HB SER 147 HB3 SER 147 -2.327 -8.989 27.702 1205 HG SER 147 HG SER 147 -0.754 -7.996 25.559 1206 H GLY 148 H GLY 148 -0.339 -10.254 27.184 1207 1HA GLY 148 HA2 GLY 148 1.592 -11.633 26.774 1208 2HA GLY 148 HA3 GLY 148 1.147 -11.705 25.069 1209 H GLN 149 H GLN 149 1.059 -9.283 24.114 1210 HA GLN 149 HA GLN 149 3.309 -7.670 25.171 1211 1HB GLN 149 HB2 GLN 149 4.181 -9.382 23.482 1212 2HB GLN 149 HB3 GLN 149 3.247 -8.510 22.266 1213 1HG GLN 149 HG2 GLN 149 5.052 -7.167 22.048 1214 2HG GLN 149 HG3 GLN 149 4.591 -6.485 23.607 1215 1HE2 GLN 149 HE21 GLN 149 7.168 -7.941 22.007 1216 2HE2 GLN 149 HE22 GLN 149 8.030 -8.500 23.358 1217 HN3 PTP 150 H3 PTP 150 -9.686 -3.536 -7.888 1218 1H5M PTP 150 H51 PTP 150 -6.834 0.289 -5.587 1219 2H5M PTP 150 H52 PTP 150 -6.376 -1.426 -5.444 1220 3H5M PTP 150 H53 PTP 150 -7.433 -0.682 -4.219 1221 H6 PTP 150 H6 PTP 150 -9.355 0.745 -5.732 1222 H1* PTP 150 H1' PTP 150 -12.031 0.346 -8.107 1223 2H2* PTP 150 H2' PTP 150 -12.445 -0.492 -5.252 1224 H3* PTP 150 H3' PTP 150 -13.388 1.592 -4.611 1225 H4* PTP 150 H4' PTP 150 -12.031 3.390 -6.150 1226 2H5* PTP 150 H5' PTP 150 -11.088 1.424 -3.997 Start of MODEL 24 1 1H ALA 1 H1 ALA 1 15.158 -24.011 -11.922 2 2H ALA 1 H2 ALA 1 15.685 -24.401 -13.489 3 3H ALA 1 H3 ALA 1 16.819 -24.065 -12.274 4 HA ALA 1 HA ALA 1 15.123 -22.224 -13.800 5 1HB ALA 1 HB1 ALA 1 14.788 -22.119 -11.168 6 2HB ALA 1 HB2 ALA 1 16.349 -21.300 -11.227 7 3HB ALA 1 HB3 ALA 1 14.972 -20.640 -12.110 8 H THR 2 H THR 2 16.508 -20.292 -14.329 9 HA THR 2 HA THR 2 19.340 -20.312 -13.852 10 HB THR 2 HB THR 2 19.121 -22.324 -15.363 11 HG1 THR 2 HG1 THR 2 20.598 -21.120 -17.024 12 1HG2 THR 2 HG21 THR 2 17.222 -21.299 -16.691 13 2HG2 THR 2 HG22 THR 2 18.423 -20.269 -17.472 14 3HG2 THR 2 HG23 THR 2 18.504 -22.019 -17.665 15 H SER 3 H SER 3 16.846 -19.487 -16.269 16 HA SER 3 HA SER 3 17.962 -16.712 -16.276 17 1HB SER 3 HB2 SER 3 18.511 -17.801 -18.401 18 2HB SER 3 HB3 SER 3 16.827 -18.272 -18.620 19 HG SER 3 HG SER 3 18.067 -15.877 -19.074 20 H THR 4 H THR 4 15.669 -18.109 -14.826 21 HA THR 4 HA THR 4 13.262 -16.922 -15.994 22 HB THR 4 HB THR 4 12.697 -17.586 -13.336 23 HG1 THR 4 HG1 THR 4 14.108 -19.763 -14.316 24 1HG2 THR 4 HG21 THR 4 11.356 -18.097 -15.357 25 2HG2 THR 4 HG22 THR 4 12.532 -19.331 -15.807 26 3HG2 THR 4 HG23 THR 4 11.574 -19.519 -14.339 27 H LYS 5 H LYS 5 12.509 -14.896 -15.577 28 HA LYS 5 HA LYS 5 13.922 -13.320 -13.471 29 1HB LYS 5 HB2 LYS 5 13.186 -12.751 -16.179 30 2HB LYS 5 HB3 LYS 5 12.285 -11.663 -15.123 31 1HG LYS 5 HG2 LYS 5 14.359 -10.566 -15.575 32 2HG LYS 5 HG3 LYS 5 14.492 -11.197 -13.934 33 1HD LYS 5 HD2 LYS 5 15.583 -13.265 -14.958 34 2HD LYS 5 HD3 LYS 5 15.687 -12.350 -16.462 35 1HE LYS 5 HE2 LYS 5 16.752 -11.248 -13.861 36 2HE LYS 5 HE3 LYS 5 17.738 -12.268 -14.908 37 1HZ LYS 5 HZ1 LYS 5 16.741 -10.520 -16.663 38 2HZ LYS 5 HZ2 LYS 5 16.861 -9.536 -15.283 39 3HZ LYS 5 HZ3 LYS 5 18.237 -10.327 -15.881 40 H LYS 6 H LYS 6 12.132 -11.307 -13.024 41 HA LYS 6 HA LYS 6 9.687 -12.732 -12.051 42 1HB LYS 6 HB2 LYS 6 11.157 -10.468 -10.660 43 2HB LYS 6 HB3 LYS 6 9.747 -11.335 -10.048 44 1HG LYS 6 HG2 LYS 6 10.958 -13.297 -9.652 45 2HG LYS 6 HG3 LYS 6 12.230 -12.858 -10.793 46 1HD LYS 6 HD2 LYS 6 12.325 -10.791 -8.962 47 2HD LYS 6 HD3 LYS 6 11.962 -12.187 -7.948 48 1HE LYS 6 HE2 LYS 6 13.947 -12.958 -9.863 49 2HE LYS 6 HE3 LYS 6 14.468 -11.459 -9.093 50 1HZ LYS 6 HZ1 LYS 6 13.339 -13.301 -7.226 51 2HZ LYS 6 HZ2 LYS 6 14.672 -13.969 -8.039 52 3HZ LYS 6 HZ3 LYS 6 14.843 -12.511 -7.189 53 H LEU 7 H LEU 7 8.798 -10.029 -10.986 54 HA LEU 7 HA LEU 7 7.359 -9.200 -13.354 55 1HB LEU 7 HB2 LEU 7 7.549 -8.272 -10.518 56 2HB LEU 7 HB3 LEU 7 6.889 -7.154 -11.710 57 HG LEU 7 HG LEU 7 5.916 -10.005 -11.458 58 1HD1 LEU 7 HD11 LEU 7 5.568 -8.813 -9.312 59 2HD1 LEU 7 HD12 LEU 7 4.760 -7.508 -10.179 60 3HD1 LEU 7 HD13 LEU 7 4.040 -9.118 -10.140 61 1HD2 LEU 7 HD21 LEU 7 5.521 -8.599 -13.557 62 2HD2 LEU 7 HD22 LEU 7 4.073 -9.235 -12.778 63 3HD2 LEU 7 HD23 LEU 7 4.527 -7.546 -12.549 64 H HIS 8 H HIS 8 7.402 -6.469 -13.418 65 HA HIS 8 HA HIS 8 10.233 -5.891 -14.181 66 1HB HIS 8 HB2 HIS 8 8.814 -3.980 -15.482 67 2HB HIS 8 HB3 HIS 8 9.205 -5.543 -16.193 68 HD1 HIS 8 HD1 HIS 8 7.263 -6.973 -16.873 69 HD2 HIS 8 HD2 HIS 8 6.123 -3.995 -14.186 70 HE1 HIS 8 HE1 HIS 8 4.741 -7.105 -16.685 71 H LYS 9 H LYS 9 10.879 -5.034 -12.158 72 HA LYS 9 HA LYS 9 9.320 -2.998 -10.793 73 1HB LYS 9 HB2 LYS 9 12.080 -4.148 -10.489 74 2HB LYS 9 HB3 LYS 9 11.661 -2.663 -9.635 75 1HG LYS 9 HG2 LYS 9 9.493 -4.490 -9.313 76 2HG LYS 9 HG3 LYS 9 10.985 -5.353 -8.933 77 1HD LYS 9 HD2 LYS 9 11.229 -2.778 -7.775 78 2HD LYS 9 HD3 LYS 9 9.614 -3.362 -7.367 79 1HE LYS 9 HE2 LYS 9 10.948 -4.242 -5.641 80 2HE LYS 9 HE3 LYS 9 10.814 -5.590 -6.770 81 1HZ LYS 9 HZ1 LYS 9 13.012 -3.724 -7.193 82 2HZ LYS 9 HZ2 LYS 9 13.128 -4.739 -5.839 83 3HZ LYS 9 HZ3 LYS 9 12.963 -5.410 -7.392 84 H GLU 10 H GLU 10 9.652 -0.745 -10.831 85 HA GLU 10 HA GLU 10 11.639 0.256 -12.827 86 1HB GLU 10 HB2 GLU 10 8.716 0.564 -12.805 87 2HB GLU 10 HB3 GLU 10 9.585 2.091 -12.956 88 1HG GLU 10 HG2 GLU 10 9.367 1.366 -15.189 89 2HG GLU 10 HG3 GLU 10 10.999 0.862 -14.751 90 HA PRO 11 HA PRO 11 12.611 3.339 -9.826 91 1HB PRO 11 HB2 PRO 11 13.149 5.494 -11.412 92 2HB PRO 11 HB3 PRO 11 14.191 4.064 -11.339 93 1HG PRO 11 HG2 PRO 11 12.332 4.925 -13.488 94 2HG PRO 11 HG3 PRO 11 13.786 3.922 -13.594 95 1HD PRO 11 HD2 PRO 11 11.095 3.004 -13.593 96 2HD PRO 11 HD3 PRO 11 12.557 2.003 -13.460 97 H ALA 12 H ALA 12 12.019 5.545 -8.979 98 HA ALA 12 HA ALA 12 9.664 6.905 -9.989 99 1HB ALA 12 HB1 ALA 12 9.407 4.904 -7.772 100 2HB ALA 12 HB2 ALA 12 8.453 6.385 -7.683 101 3HB ALA 12 HB3 ALA 12 8.267 5.298 -9.059 102 H THR 13 H THR 13 9.059 8.730 -8.472 103 HA THR 13 HA THR 13 11.338 9.406 -6.656 104 HB THR 13 HB THR 13 9.907 11.606 -8.074 105 HG1 THR 13 HG1 THR 13 11.721 9.786 -9.246 106 1HG2 THR 13 HG21 THR 13 11.673 12.031 -6.396 107 2HG2 THR 13 HG22 THR 13 12.809 11.091 -7.364 108 3HG2 THR 13 HG23 THR 13 12.152 12.602 -7.994 109 H LEU 14 H LEU 14 10.746 10.927 -4.926 110 HA LEU 14 HA LEU 14 8.016 10.395 -3.955 111 1HB LEU 14 HB2 LEU 14 10.104 10.267 -2.500 112 2HB LEU 14 HB3 LEU 14 10.178 12.026 -2.600 113 HG LEU 14 HG LEU 14 8.972 11.133 -0.559 114 1HD1 LEU 14 HD11 LEU 14 8.541 13.380 -1.936 115 2HD1 LEU 14 HD12 LEU 14 6.963 12.634 -2.185 116 3HD1 LEU 14 HD13 LEU 14 7.543 12.947 -0.550 117 1HD2 LEU 14 HD21 LEU 14 7.877 9.276 -1.997 118 2HD2 LEU 14 HD22 LEU 14 6.872 10.064 -0.781 119 3HD2 LEU 14 HD23 LEU 14 6.724 10.520 -2.478 120 H ILE 15 H ILE 15 6.539 11.719 -4.983 121 HA ILE 15 HA ILE 15 7.193 14.552 -5.471 122 HB ILE 15 HB ILE 15 4.665 12.955 -5.991 123 1HG1 ILE 15 HG12 ILE 15 6.856 13.938 -7.849 124 2HG1 ILE 15 HG13 ILE 15 6.626 12.265 -7.340 125 1HG2 ILE 15 HG21 ILE 15 5.173 15.794 -5.970 126 2HG2 ILE 15 HG22 ILE 15 4.838 15.266 -7.619 127 3HG2 ILE 15 HG23 ILE 15 3.671 14.945 -6.336 128 1HD1 ILE 15 HD11 ILE 15 4.428 13.832 -8.694 129 2HD1 ILE 15 HD12 ILE 15 5.627 12.923 -9.615 130 3HD1 ILE 15 HD13 ILE 15 4.556 12.084 -8.492 131 H LYS 16 H LYS 16 4.657 12.757 -3.682 132 HA LYS 16 HA LYS 16 4.832 14.467 -1.381 133 1HB LYS 16 HB2 LYS 16 3.728 15.953 -3.200 134 2HB LYS 16 HB3 LYS 16 2.310 14.932 -2.968 135 1HG LYS 16 HG2 LYS 16 3.664 16.079 -0.554 136 2HG LYS 16 HG3 LYS 16 2.625 17.126 -1.522 137 1HD LYS 16 HD2 LYS 16 1.523 14.445 -0.893 138 2HD LYS 16 HD3 LYS 16 1.688 15.548 0.474 139 1HE LYS 16 HE2 LYS 16 0.533 16.683 -2.023 140 2HE LYS 16 HE3 LYS 16 -0.478 15.552 -1.125 141 1HZ LYS 16 HZ1 LYS 16 0.909 17.628 0.391 142 2HZ LYS 16 HZ2 LYS 16 -0.413 18.109 -0.558 143 3HZ LYS 16 HZ3 LYS 16 -0.619 16.932 0.650 144 H ALA 17 H ALA 17 4.444 12.837 0.048 145 HA ALA 17 HA ALA 17 2.781 10.568 -0.484 146 1HB ALA 17 HB1 ALA 17 4.361 11.594 1.734 147 2HB ALA 17 HB2 ALA 17 2.854 10.874 2.299 148 3HB ALA 17 HB3 ALA 17 3.973 9.924 1.321 149 H ILE 18 H ILE 18 0.617 10.188 -0.010 150 HA ILE 18 HA ILE 18 -0.960 12.586 0.798 151 HB ILE 18 HB ILE 18 -1.779 10.028 -0.613 152 1HG1 ILE 18 HG12 ILE 18 -2.062 12.789 -1.739 153 2HG1 ILE 18 HG13 ILE 18 -0.458 12.053 -1.731 154 1HG2 ILE 18 HG21 ILE 18 -3.517 11.022 0.944 155 2HG2 ILE 18 HG22 ILE 18 -3.466 12.480 -0.047 156 3HG2 ILE 18 HG23 ILE 18 -3.997 10.953 -0.752 157 1HD1 ILE 18 HD11 ILE 18 -2.478 10.159 -2.619 158 2HD1 ILE 18 HD12 ILE 18 -2.479 11.612 -3.620 159 3HD1 ILE 18 HD13 ILE 18 -0.999 10.672 -3.431 160 H ASP 19 H ASP 19 -1.490 9.064 1.144 161 HA ASP 19 HA ASP 19 -2.061 9.577 4.037 162 1HB ASP 19 HB2 ASP 19 -3.357 7.436 2.327 163 2HB ASP 19 HB3 ASP 19 -3.810 7.925 3.961 164 H GLY 20 H GLY 20 -2.426 6.654 4.422 165 1HA GLY 20 HA2 GLY 20 0.444 5.992 4.669 166 2HA GLY 20 HA3 GLY 20 -0.887 5.114 5.424 167 H ASP 21 H ASP 21 -2.129 5.376 2.520 168 HA ASP 21 HA ASP 21 -0.623 3.044 1.402 169 1HB ASP 21 HB2 ASP 21 -3.448 3.324 2.114 170 2HB ASP 21 HB3 ASP 21 -3.215 2.794 0.446 171 H THR 22 H THR 22 -1.797 6.193 0.875 172 HA THR 22 HA THR 22 -1.525 5.827 -2.082 173 HB THR 22 HB THR 22 -2.781 8.295 -0.989 174 HG1 THR 22 HG1 THR 22 -4.657 7.276 -0.512 175 1HG2 THR 22 HG21 THR 22 -3.151 6.444 -3.341 176 2HG2 THR 22 HG22 THR 22 -4.348 7.678 -2.946 177 3HG2 THR 22 HG23 THR 22 -2.696 8.148 -3.347 178 H VAL 23 H VAL 23 0.080 6.978 -3.097 179 HA VAL 23 HA VAL 23 1.266 9.331 -1.773 180 HB VAL 23 HB VAL 23 3.579 8.350 -1.974 181 1HG1 VAL 23 HG11 VAL 23 2.284 8.436 0.175 182 2HG1 VAL 23 HG12 VAL 23 1.718 6.798 -0.153 183 3HG1 VAL 23 HG13 VAL 23 3.437 7.103 0.103 184 1HG2 VAL 23 HG21 VAL 23 1.956 5.835 -2.462 185 2HG2 VAL 23 HG22 VAL 23 3.130 6.565 -3.558 186 3HG2 VAL 23 HG23 VAL 23 3.669 5.836 -2.045 187 H LYS 24 H LYS 24 1.921 10.782 -3.304 188 HA LYS 24 HA LYS 24 1.665 10.007 -6.135 189 1HB LYS 24 HB2 LYS 24 2.446 12.704 -4.990 190 2HB LYS 24 HB3 LYS 24 1.820 12.368 -6.605 191 1HG LYS 24 HG2 LYS 24 -0.304 11.565 -5.586 192 2HG LYS 24 HG3 LYS 24 0.320 12.001 -3.995 193 1HD LYS 24 HD2 LYS 24 -1.046 13.838 -4.741 194 2HD LYS 24 HD3 LYS 24 0.634 14.358 -4.875 195 1HE LYS 24 HE2 LYS 24 0.031 13.082 -7.318 196 2HE LYS 24 HE3 LYS 24 -1.357 14.109 -6.956 197 1HZ LYS 24 HZ1 LYS 24 0.214 15.945 -6.555 198 2HZ LYS 24 HZ2 LYS 24 1.490 14.946 -7.052 199 3HZ LYS 24 HZ3 LYS 24 0.267 15.371 -8.153 200 H LEU 25 H LEU 25 3.400 9.404 -7.346 201 HA LEU 25 HA LEU 25 6.107 10.317 -6.456 202 1HB LEU 25 HB2 LEU 25 5.779 7.653 -7.784 203 2HB LEU 25 HB3 LEU 25 7.004 8.184 -6.635 204 HG LEU 25 HG LEU 25 4.092 7.711 -5.942 205 1HD1 LEU 25 HD11 LEU 25 6.542 5.983 -5.825 206 2HD1 LEU 25 HD12 LEU 25 5.312 5.812 -4.573 207 3HD1 LEU 25 HD13 LEU 25 4.891 5.547 -6.265 208 1HD2 LEU 25 HD21 LEU 25 6.127 9.184 -4.650 209 2HD2 LEU 25 HD22 LEU 25 4.574 8.698 -3.972 210 3HD2 LEU 25 HD23 LEU 25 5.990 7.668 -3.759 211 H MET 26 H MET 26 7.645 10.584 -8.184 212 HA MET 26 HA MET 26 6.386 11.328 -10.731 213 1HB MET 26 HB2 MET 26 8.149 12.761 -9.768 214 2HB MET 26 HB3 MET 26 9.290 11.419 -9.852 215 1HG MET 26 HG2 MET 26 8.268 11.531 -12.427 216 2HG MET 26 HG3 MET 26 8.392 13.230 -11.970 217 1HE MET 26 HE1 MET 26 9.780 14.093 -13.222 218 2HE MET 26 HE2 MET 26 11.022 14.517 -12.047 219 3HE MET 26 HE3 MET 26 11.470 13.736 -13.569 220 H TYR 27 H TYR 27 6.119 9.841 -12.313 221 HA TYR 27 HA TYR 27 8.163 7.681 -12.579 222 1HB TYR 27 HB2 TYR 27 6.200 6.688 -11.543 223 2HB TYR 27 HB3 TYR 27 5.148 7.417 -12.756 224 HD1 TYR 27 HD1 TYR 27 5.091 6.577 -15.055 225 HD2 TYR 27 HD2 TYR 27 7.633 4.791 -12.090 226 HE1 TYR 27 HE1 TYR 27 5.441 4.617 -16.535 227 HE2 TYR 27 HE2 TYR 27 7.982 2.831 -13.568 228 HH TYR 27 HH TYR 27 6.071 2.118 -16.154 229 H LYS 28 H LYS 28 8.955 7.523 -14.622 230 HA LYS 28 HA LYS 28 9.168 7.822 -16.936 231 1HB LYS 28 HB2 LYS 28 6.234 7.666 -16.498 232 2HB LYS 28 HB3 LYS 28 6.764 8.361 -18.030 233 1HG LYS 28 HG2 LYS 28 7.669 5.687 -16.917 234 2HG LYS 28 HG3 LYS 28 6.480 5.906 -18.200 235 1HD LYS 28 HD2 LYS 28 8.097 6.153 -19.747 236 2HD LYS 28 HD3 LYS 28 8.889 7.404 -18.786 237 1HE LYS 28 HE2 LYS 28 9.626 5.304 -17.320 238 2HE LYS 28 HE3 LYS 28 9.392 4.458 -18.850 239 1HZ LYS 28 HZ1 LYS 28 10.819 6.227 -19.871 240 2HZ LYS 28 HZ2 LYS 28 11.195 6.745 -18.299 241 3HZ LYS 28 HZ3 LYS 28 11.622 5.179 -18.802 242 H GLY 29 H GLY 29 8.622 10.180 -14.826 243 1HA GLY 29 HA2 GLY 29 9.380 12.447 -15.241 244 2HA GLY 29 HA3 GLY 29 8.876 12.273 -16.921 245 H GLN 30 H GLN 30 6.318 10.954 -15.638 246 HA GLN 30 HA GLN 30 4.951 13.575 -15.221 247 1HB GLN 30 HB2 GLN 30 2.899 11.894 -15.670 248 2HB GLN 30 HB3 GLN 30 3.761 12.697 -16.980 249 1HG GLN 30 HG2 GLN 30 5.114 10.760 -17.392 250 2HG GLN 30 HG3 GLN 30 4.561 9.982 -15.908 251 1HE2 GLN 30 HE21 GLN 30 2.263 11.752 -17.904 252 2HE2 GLN 30 HE22 GLN 30 1.440 10.390 -18.492 253 HA PRO 31 HA PRO 31 4.196 12.320 -11.046 254 1HB PRO 31 HB2 PRO 31 2.240 14.144 -10.482 255 2HB PRO 31 HB3 PRO 31 3.954 14.576 -10.615 256 1HG PRO 31 HG2 PRO 31 1.741 14.997 -12.586 257 2HG PRO 31 HG3 PRO 31 3.141 16.024 -12.229 258 1HD PRO 31 HD2 PRO 31 2.967 14.330 -14.422 259 2HD PRO 31 HD3 PRO 31 4.495 14.904 -13.719 260 H MET 32 H MET 32 2.869 10.741 -10.170 261 HA MET 32 HA MET 32 0.048 10.570 -11.047 262 1HB MET 32 HB2 MET 32 2.072 8.936 -12.187 263 2HB MET 32 HB3 MET 32 1.134 7.910 -11.101 264 1HG MET 32 HG2 MET 32 -0.955 8.722 -12.178 265 2HG MET 32 HG3 MET 32 0.017 9.669 -13.304 266 1HE MET 32 HE1 MET 32 -0.754 6.235 -11.833 267 2HE MET 32 HE2 MET 32 0.111 5.092 -12.871 268 3HE MET 32 HE3 MET 32 1.007 6.176 -11.809 269 H THR 33 H THR 33 -1.263 9.700 -9.454 270 HA THR 33 HA THR 33 0.009 9.219 -6.838 271 HB THR 33 HB THR 33 -2.038 10.627 -7.023 272 HG1 THR 33 HG1 THR 33 -2.662 9.891 -5.156 273 1HG2 THR 33 HG21 THR 33 -2.932 9.033 -8.902 274 2HG2 THR 33 HG22 THR 33 -3.611 8.124 -7.551 275 3HG2 THR 33 HG23 THR 33 -4.078 9.806 -7.806 276 H PHE 34 H PHE 34 0.467 7.188 -6.128 277 HA PHE 34 HA PHE 34 -0.781 4.900 -7.583 278 1HB PHE 34 HB2 PHE 34 1.809 5.204 -6.061 279 2HB PHE 34 HB3 PHE 34 1.148 3.617 -6.456 280 HD1 PHE 34 HD1 PHE 34 2.382 6.812 -7.893 281 HD2 PHE 34 HD2 PHE 34 1.217 2.754 -8.691 282 HE1 PHE 34 HE1 PHE 34 3.307 6.998 -10.186 283 HE2 PHE 34 HE2 PHE 34 2.142 2.941 -10.985 284 HZ PHE 34 HZ PHE 34 3.187 5.063 -11.732 285 H ARG 35 H ARG 35 -1.473 3.049 -6.319 286 HA ARG 35 HA ARG 35 -1.997 3.645 -3.440 287 1HB ARG 35 HB2 ARG 35 -4.011 3.985 -5.028 288 2HB ARG 35 HB3 ARG 35 -4.001 2.229 -5.201 289 1HG ARG 35 HG2 ARG 35 -5.369 2.321 -3.371 290 2HG ARG 35 HG3 ARG 35 -3.837 2.433 -2.502 291 1HD ARG 35 HD2 ARG 35 -3.976 4.893 -2.561 292 2HD ARG 35 HD3 ARG 35 -5.503 4.790 -3.437 293 HE ARG 35 HE ARG 35 -5.298 3.519 -0.752 294 1HH1 ARG 35 HH11 ARG 35 -6.148 6.302 -2.541 295 2HH1 ARG 35 HH12 ARG 35 -7.610 6.600 -1.663 296 1HH2 ARG 35 HH21 ARG 35 -7.374 3.711 0.239 297 2HH2 ARG 35 HH22 ARG 35 -8.305 5.135 -0.091 298 H LEU 36 H LEU 36 -1.245 2.008 -2.180 299 HA LEU 36 HA LEU 36 0.127 -0.236 -3.061 300 1HB LEU 36 HB2 LEU 36 -1.615 -0.224 -0.582 301 2HB LEU 36 HB3 LEU 36 -0.155 -1.174 -0.856 302 HG LEU 36 HG LEU 36 -0.391 1.807 -0.443 303 1HD1 LEU 36 HD11 LEU 36 -0.087 0.075 1.451 304 2HD1 LEU 36 HD12 LEU 36 1.538 -0.153 0.802 305 3HD1 LEU 36 HD13 LEU 36 1.042 1.429 1.404 306 1HD2 LEU 36 HD21 LEU 36 1.643 0.243 -1.957 307 2HD2 LEU 36 HD22 LEU 36 1.163 1.931 -2.135 308 3HD2 LEU 36 HD23 LEU 36 2.259 1.458 -0.836 309 H LEU 37 H LEU 37 -0.428 -2.179 -3.944 310 HA LEU 37 HA LEU 37 -3.285 -2.666 -4.513 311 1HB LEU 37 HB2 LEU 37 -0.688 -3.554 -5.625 312 2HB LEU 37 HB3 LEU 37 -1.976 -4.759 -5.653 313 HG LEU 37 HG LEU 37 -2.360 -1.931 -6.661 314 1HD1 LEU 37 HD11 LEU 37 -1.331 -4.404 -8.038 315 2HD1 LEU 37 HD12 LEU 37 -2.241 -3.192 -8.941 316 3HD1 LEU 37 HD13 LEU 37 -0.732 -2.749 -8.144 317 1HD2 LEU 37 HD21 LEU 37 -3.953 -4.455 -6.558 318 2HD2 LEU 37 HD22 LEU 37 -4.492 -2.782 -6.414 319 3HD2 LEU 37 HD23 LEU 37 -4.120 -3.455 -8.001 320 H LEU 38 H LEU 38 -4.333 -4.650 -3.966 321 HA LEU 38 HA LEU 38 -4.859 -6.460 -2.582 322 1HB LEU 38 HB2 LEU 38 -1.839 -6.647 -2.523 323 2HB LEU 38 HB3 LEU 38 -2.909 -7.857 -1.813 324 HG LEU 38 HG LEU 38 -3.306 -6.999 -4.667 325 1HD1 LEU 38 HD11 LEU 38 -0.860 -7.738 -4.109 326 2HD1 LEU 38 HD12 LEU 38 -1.565 -9.347 -3.947 327 3HD1 LEU 38 HD13 LEU 38 -1.682 -8.482 -5.480 328 1HD2 LEU 38 HD21 LEU 38 -4.194 -9.140 -2.833 329 2HD2 LEU 38 HD22 LEU 38 -5.009 -8.453 -4.238 330 3HD2 LEU 38 HD23 LEU 38 -3.771 -9.691 -4.454 331 H VAL 39 H VAL 39 -4.136 -3.648 -1.443 332 HA VAL 39 HA VAL 39 -4.414 -4.505 1.360 333 HB VAL 39 HB VAL 39 -2.509 -3.242 2.179 334 1HG1 VAL 39 HG11 VAL 39 -2.113 -5.584 1.473 335 2HG1 VAL 39 HG12 VAL 39 -1.701 -5.017 -0.145 336 3HG1 VAL 39 HG13 VAL 39 -0.680 -4.586 1.226 337 1HG2 VAL 39 HG21 VAL 39 -2.609 -2.159 -0.537 338 2HG2 VAL 39 HG22 VAL 39 -1.878 -1.473 0.914 339 3HG2 VAL 39 HG23 VAL 39 -0.978 -2.635 -0.062 340 H ASP 40 H ASP 40 -6.021 -3.246 2.140 341 HA ASP 40 HA ASP 40 -6.372 -0.520 0.991 342 1HB ASP 40 HB2 ASP 40 -8.693 -0.796 2.053 343 2HB ASP 40 HB3 ASP 40 -8.351 -1.798 0.646 344 H THR 41 H THR 41 -5.916 1.171 2.339 345 HA THR 41 HA THR 41 -4.995 0.750 5.030 346 HB THR 41 HB THR 41 -5.691 3.420 4.914 347 HG1 THR 41 HG1 THR 41 -6.356 2.968 2.710 348 1HG2 THR 41 HG21 THR 41 -3.215 1.920 4.063 349 2HG2 THR 41 HG22 THR 41 -3.266 3.681 4.145 350 3HG2 THR 41 HG23 THR 41 -3.524 2.722 5.603 351 HA PRO 42 HA PRO 42 -8.683 1.063 7.409 352 1HB PRO 42 HB2 PRO 42 -7.905 2.643 9.497 353 2HB PRO 42 HB3 PRO 42 -7.321 0.985 9.271 354 1HG PRO 42 HG2 PRO 42 -5.912 3.564 8.757 355 2HG PRO 42 HG3 PRO 42 -5.251 2.004 9.269 356 1HD PRO 42 HD2 PRO 42 -5.159 3.022 6.657 357 2HD PRO 42 HD3 PRO 42 -4.908 1.323 7.108 358 H GLU 43 H GLU 43 -9.542 2.488 5.495 359 HA GLU 43 HA GLU 43 -10.642 4.425 4.741 360 1HB GLU 43 HB2 GLU 43 -12.075 3.649 6.656 361 2HB GLU 43 HB3 GLU 43 -11.193 4.764 7.701 362 1HG GLU 43 HG2 GLU 43 -12.419 6.506 6.977 363 2HG GLU 43 HG3 GLU 43 -12.055 6.119 5.295 364 H THR 44 H THR 44 -8.734 5.586 4.094 365 HA THR 44 HA THR 44 -8.141 7.897 5.882 366 HB THR 44 HB THR 44 -5.719 7.600 4.793 367 HG1 THR 44 HG1 THR 44 -6.539 5.666 3.702 368 1HG2 THR 44 HG21 THR 44 -6.962 6.421 7.244 369 2HG2 THR 44 HG22 THR 44 -5.292 5.997 6.865 370 3HG2 THR 44 HG23 THR 44 -5.739 7.685 7.105 371 H LYS 45 H LYS 45 -9.769 8.757 4.253 372 HA LYS 45 HA LYS 45 -8.880 9.062 1.492 373 1HB LYS 45 HB2 LYS 45 -11.249 9.796 3.100 374 2HB LYS 45 HB3 LYS 45 -10.859 10.919 1.797 375 1HG LYS 45 HG2 LYS 45 -10.915 7.947 1.301 376 2HG LYS 45 HG3 LYS 45 -12.399 8.900 1.245 377 1HD LYS 45 HD2 LYS 45 -11.269 10.433 -0.400 378 2HD LYS 45 HD3 LYS 45 -9.909 9.310 -0.434 379 1HE LYS 45 HE2 LYS 45 -12.386 7.867 -0.789 380 2HE LYS 45 HE3 LYS 45 -12.272 9.169 -1.973 381 1HZ LYS 45 HZ1 LYS 45 -9.812 7.727 -1.584 382 2HZ LYS 45 HZ2 LYS 45 -11.069 6.764 -2.191 383 3HZ LYS 45 HZ3 LYS 45 -10.599 8.167 -3.024 384 H HIS 46 H HIS 46 -9.454 11.433 4.129 385 HA HIS 46 HA HIS 46 -7.199 13.025 2.991 386 1HB HIS 46 HB2 HIS 46 -10.013 13.765 3.214 387 2HB HIS 46 HB3 HIS 46 -8.959 14.905 4.052 388 HD1 HIS 46 HD1 HIS 46 -10.494 15.222 1.162 389 HD2 HIS 46 HD2 HIS 46 -6.418 14.671 1.842 390 HE1 HIS 46 HE1 HIS 46 -9.300 16.115 -0.884 391 HA PRO 47 HA PRO 47 -5.943 13.222 7.230 392 1HB PRO 47 HB2 PRO 47 -3.988 15.099 6.907 393 2HB PRO 47 HB3 PRO 47 -3.820 13.428 6.339 394 1HG PRO 47 HG2 PRO 47 -4.290 15.907 4.771 395 2HG PRO 47 HG3 PRO 47 -3.514 14.393 4.279 396 1HD PRO 47 HD2 PRO 47 -6.169 15.202 3.673 397 2HD PRO 47 HD3 PRO 47 -5.464 13.593 3.405 398 H LYS 48 H LYS 48 -8.324 14.586 6.989 399 HA LYS 48 HA LYS 48 -7.786 17.348 7.972 400 1HB LYS 48 HB2 LYS 48 -10.437 16.120 7.162 401 2HB LYS 48 HB3 LYS 48 -10.104 17.827 7.456 402 1HG LYS 48 HG2 LYS 48 -8.516 16.335 5.385 403 2HG LYS 48 HG3 LYS 48 -10.127 16.937 4.989 404 1HD LYS 48 HD2 LYS 48 -9.427 19.210 5.733 405 2HD LYS 48 HD3 LYS 48 -7.801 18.589 6.019 406 1HE LYS 48 HE2 LYS 48 -7.359 19.084 3.862 407 2HE LYS 48 HE3 LYS 48 -8.407 17.732 3.433 408 1HZ LYS 48 HZ1 LYS 48 -10.108 19.805 4.010 409 2HZ LYS 48 HZ2 LYS 48 -8.852 20.525 3.120 410 3HZ LYS 48 HZ3 LYS 48 -9.718 19.218 2.467 411 H LYS 49 H LYS 49 -10.115 14.717 8.695 412 HA LYS 49 HA LYS 49 -9.705 15.345 11.589 413 1HB LYS 49 HB2 LYS 49 -12.105 15.559 10.045 414 2HB LYS 49 HB3 LYS 49 -12.302 14.230 11.189 415 1HG LYS 49 HG2 LYS 49 -12.773 15.814 12.733 416 2HG LYS 49 HG3 LYS 49 -11.051 16.200 12.698 417 1HD LYS 49 HD2 LYS 49 -11.351 18.058 11.361 418 2HD LYS 49 HD3 LYS 49 -12.785 17.395 10.579 419 1HE LYS 49 HE2 LYS 49 -13.783 18.980 11.935 420 2HE LYS 49 HE3 LYS 49 -13.789 17.601 13.036 421 1HZ LYS 49 HZ1 LYS 49 -11.312 18.791 13.306 422 2HZ LYS 49 HZ2 LYS 49 -12.428 20.072 13.284 423 3HZ LYS 49 HZ3 LYS 49 -12.593 18.825 14.421 424 H GLY 50 H GLY 50 -10.672 12.882 9.204 425 1HA GLY 50 HA2 GLY 50 -10.093 10.585 9.203 426 2HA GLY 50 HA3 GLY 50 -9.243 10.834 10.728 427 H VAL 51 H VAL 51 -10.742 8.580 10.576 428 HA VAL 51 HA VAL 51 -13.380 9.195 11.797 429 HB VAL 51 HB VAL 51 -12.425 6.394 11.336 430 1HG1 VAL 51 HG11 VAL 51 -14.955 7.903 11.601 431 2HG1 VAL 51 HG12 VAL 51 -14.970 6.644 10.368 432 3HG1 VAL 51 HG13 VAL 51 -14.589 6.235 12.040 433 1HG2 VAL 51 HG21 VAL 51 -13.185 8.394 9.192 434 2HG2 VAL 51 HG22 VAL 51 -11.740 7.384 9.265 435 3HG2 VAL 51 HG23 VAL 51 -13.313 6.651 8.952 436 H GLU 52 H GLU 52 -13.787 7.126 13.504 437 HA GLU 52 HA GLU 52 -11.557 7.388 15.483 438 1HB GLU 52 HB2 GLU 52 -13.230 7.386 17.258 439 2HB GLU 52 HB3 GLU 52 -13.615 8.665 16.106 440 1HG GLU 52 HG2 GLU 52 -15.173 7.034 14.959 441 2HG GLU 52 HG3 GLU 52 -14.909 5.934 16.311 442 H LYS 53 H LYS 53 -13.449 5.267 13.622 443 HA LYS 53 HA LYS 53 -13.791 2.995 15.221 444 1HB LYS 53 HB2 LYS 53 -14.443 3.247 12.784 445 2HB LYS 53 HB3 LYS 53 -12.759 2.922 12.372 446 1HG LYS 53 HG2 LYS 53 -13.413 0.743 12.353 447 2HG LYS 53 HG3 LYS 53 -13.289 0.872 14.108 448 1HD LYS 53 HD2 LYS 53 -15.727 1.720 14.031 449 2HD LYS 53 HD3 LYS 53 -15.759 1.084 12.386 450 1HE LYS 53 HE2 LYS 53 -15.005 -1.132 13.291 451 2HE LYS 53 HE3 LYS 53 -15.164 -0.473 14.918 452 1HZ LYS 53 HZ1 LYS 53 -17.529 0.168 13.901 453 2HZ LYS 53 HZ2 LYS 53 -17.221 -1.253 13.023 454 3HZ LYS 53 HZ3 LYS 53 -17.235 -1.286 14.721 455 H TYR 54 H TYR 54 -10.930 3.576 13.136 456 HA TYR 54 HA TYR 54 -9.204 2.492 15.283 457 1HB TYR 54 HB2 TYR 54 -10.023 0.946 13.009 458 2HB TYR 54 HB3 TYR 54 -8.302 1.301 12.855 459 HD1 TYR 54 HD1 TYR 54 -6.962 1.110 15.189 460 HD2 TYR 54 HD2 TYR 54 -10.610 -0.942 14.224 461 HE1 TYR 54 HE1 TYR 54 -6.462 -0.595 16.921 462 HE2 TYR 54 HE2 TYR 54 -10.110 -2.647 15.955 463 HH TYR 54 HH TYR 54 -8.114 -2.279 18.373 464 H GLY 55 H GLY 55 -9.727 5.035 13.621 465 1HA GLY 55 HA2 GLY 55 -7.817 5.746 11.800 466 2HA GLY 55 HA3 GLY 55 -8.277 6.837 13.105 467 HA PRO 56 HA PRO 56 -4.169 4.666 14.278 468 1HB PRO 56 HB2 PRO 56 -2.892 3.412 12.214 469 2HB PRO 56 HB3 PRO 56 -4.125 2.617 13.208 470 1HG PRO 56 HG2 PRO 56 -4.292 3.501 10.404 471 2HG PRO 56 HG3 PRO 56 -5.317 2.355 11.279 472 1HD PRO 56 HD2 PRO 56 -5.862 5.140 10.676 473 2HD PRO 56 HD3 PRO 56 -6.922 3.965 11.482 474 H GLU 57 H GLU 57 -1.692 4.790 13.103 475 HA GLU 57 HA GLU 57 -1.592 7.593 12.072 476 1HB GLU 57 HB2 GLU 57 0.737 6.082 13.261 477 2HB GLU 57 HB3 GLU 57 0.526 7.827 13.106 478 1HG GLU 57 HG2 GLU 57 -1.429 7.649 14.691 479 2HG GLU 57 HG3 GLU 57 -0.986 5.961 14.954 480 H ALA 58 H ALA 58 -2.039 5.107 10.485 481 HA ALA 58 HA ALA 58 0.307 4.274 9.124 482 1HB ALA 58 HB1 ALA 58 -2.272 3.537 8.971 483 2HB ALA 58 HB2 ALA 58 -2.204 4.574 7.546 484 3HB ALA 58 HB3 ALA 58 -1.121 3.189 7.682 485 H SER 59 H SER 59 -1.774 7.097 8.643 486 HA SER 59 HA SER 59 -0.823 7.982 6.145 487 1HB SER 59 HB2 SER 59 -2.226 9.140 8.397 488 2HB SER 59 HB3 SER 59 -1.062 10.292 7.749 489 HG SER 59 HG SER 59 -3.337 9.992 6.780 490 H ALA 60 H ALA 60 0.478 8.796 9.383 491 HA ALA 60 HA ALA 60 2.813 10.116 8.269 492 1HB ALA 60 HB1 ALA 60 1.789 9.431 10.967 493 2HB ALA 60 HB2 ALA 60 3.544 9.540 10.825 494 3HB ALA 60 HB3 ALA 60 2.536 10.921 10.393 495 H PHE 61 H PHE 61 1.923 6.862 8.778 496 HA PHE 61 HA PHE 61 4.489 5.705 9.322 497 1HB PHE 61 HB2 PHE 61 2.347 4.487 9.608 498 2HB PHE 61 HB3 PHE 61 2.127 4.495 7.859 499 HD1 PHE 61 HD1 PHE 61 4.095 3.513 6.438 500 HD2 PHE 61 HD2 PHE 61 3.504 2.718 10.618 501 HE1 PHE 61 HE1 PHE 61 5.496 1.475 6.249 502 HE2 PHE 61 HE2 PHE 61 4.905 0.681 10.429 503 HZ PHE 61 HZ PHE 61 5.900 0.059 8.244 504 H THR 62 H THR 62 2.678 5.767 6.246 505 HA THR 62 HA THR 62 5.017 5.042 4.697 506 HB THR 62 HB THR 62 2.331 6.180 3.868 507 HG1 THR 62 HG1 THR 62 2.216 4.124 4.755 508 1HG2 THR 62 HG21 THR 62 4.725 5.262 2.294 509 2HG2 THR 62 HG22 THR 62 3.102 5.092 1.628 510 3HG2 THR 62 HG23 THR 62 3.719 6.691 2.048 511 H LYS 63 H LYS 63 3.553 8.070 5.691 512 HA LYS 63 HA LYS 63 4.732 9.816 3.801 513 1HB LYS 63 HB2 LYS 63 3.140 10.155 5.992 514 2HB LYS 63 HB3 LYS 63 4.668 10.820 6.574 515 1HG LYS 63 HG2 LYS 63 4.798 12.311 4.644 516 2HG LYS 63 HG3 LYS 63 3.333 11.600 3.965 517 1HD LYS 63 HD2 LYS 63 2.088 12.337 6.008 518 2HD LYS 63 HD3 LYS 63 3.550 13.159 6.556 519 1HE LYS 63 HE2 LYS 63 3.221 14.892 5.143 520 2HE LYS 63 HE3 LYS 63 2.872 13.817 3.789 521 1HZ LYS 63 HZ1 LYS 63 0.707 13.534 5.396 522 2HZ LYS 63 HZ2 LYS 63 1.068 15.186 5.551 523 3HZ LYS 63 HZ3 LYS 63 0.784 14.516 4.016 524 H LYS 64 H LYS 64 5.965 9.032 7.058 525 HA LYS 64 HA LYS 64 8.529 10.257 6.596 526 1HB LYS 64 HB2 LYS 64 7.210 9.243 8.796 527 2HB LYS 64 HB3 LYS 64 8.484 8.051 8.540 528 1HG LYS 64 HG2 LYS 64 9.686 9.552 9.798 529 2HG LYS 64 HG3 LYS 64 9.942 10.283 8.213 530 1HD LYS 64 HD2 LYS 64 9.171 12.139 9.345 531 2HD LYS 64 HD3 LYS 64 7.626 11.478 8.812 532 1HE LYS 64 HE2 LYS 64 6.982 11.164 10.944 533 2HE LYS 64 HE3 LYS 64 8.417 10.189 11.261 534 1HZ LYS 64 HZ1 LYS 64 8.707 13.102 11.119 535 2HZ LYS 64 HZ2 LYS 64 8.012 12.429 12.516 536 3HZ LYS 64 HZ3 LYS 64 9.575 11.970 12.044 537 H MET 65 H MET 65 7.253 7.017 6.078 538 HA MET 65 HA MET 65 9.673 5.596 5.734 539 1HB MET 65 HB2 MET 65 6.897 5.157 5.209 540 2HB MET 65 HB3 MET 65 7.810 4.688 3.775 541 1HG MET 65 HG2 MET 65 9.384 3.617 5.707 542 2HG MET 65 HG3 MET 65 7.808 3.494 6.490 543 1HE MET 65 HE1 MET 65 9.147 3.580 3.028 544 2HE MET 65 HE2 MET 65 10.049 2.109 3.417 545 3HE MET 65 HE3 MET 65 8.728 2.056 2.253 546 H VAL 66 H VAL 66 7.676 6.477 2.931 547 HA VAL 66 HA VAL 66 9.827 6.424 1.086 548 HB VAL 66 HB VAL 66 8.232 7.994 -0.263 549 1HG1 VAL 66 HG11 VAL 66 8.446 5.557 -0.606 550 2HG1 VAL 66 HG12 VAL 66 7.316 5.272 0.718 551 3HG1 VAL 66 HG13 VAL 66 6.766 6.070 -0.756 552 1HG2 VAL 66 HG21 VAL 66 7.092 8.459 2.124 553 2HG2 VAL 66 HG22 VAL 66 6.162 8.489 0.626 554 3HG2 VAL 66 HG23 VAL 66 6.142 7.052 1.647 555 H GLU 67 H GLU 67 8.817 8.905 3.322 556 HA GLU 67 HA GLU 67 9.975 11.183 2.077 557 1HB GLU 67 HB2 GLU 67 9.172 10.421 4.820 558 2HB GLU 67 HB3 GLU 67 10.415 11.670 4.726 559 1HG GLU 67 HG2 GLU 67 8.958 12.905 3.094 560 2HG GLU 67 HG3 GLU 67 7.691 11.714 3.398 561 H ASN 68 H ASN 68 11.404 8.620 4.040 562 HA ASN 68 HA ASN 68 14.079 9.888 3.684 563 1HB ASN 68 HB2 ASN 68 12.894 8.026 5.691 564 2HB ASN 68 HB3 ASN 68 14.606 7.822 5.316 565 1HD2 ASN 68 HD21 ASN 68 12.390 9.667 7.169 566 2HD2 ASN 68 HD22 ASN 68 13.456 10.902 7.641 567 H ALA 69 H ALA 69 12.126 7.669 2.173 568 HA ALA 69 HA ALA 69 13.893 5.481 1.666 569 1HB ALA 69 HB1 ALA 69 11.647 6.661 0.007 570 2HB ALA 69 HB2 ALA 69 12.473 5.155 -0.393 571 3HB ALA 69 HB3 ALA 69 11.549 5.283 1.103 572 H LYS 70 H LYS 70 15.879 5.679 0.755 573 HA LYS 70 HA LYS 70 16.654 7.985 -0.808 574 1HB LYS 70 HB2 LYS 70 17.994 5.300 -0.373 575 2HB LYS 70 HB3 LYS 70 18.744 6.650 -1.225 576 1HG LYS 70 HG2 LYS 70 17.677 7.618 1.253 577 2HG LYS 70 HG3 LYS 70 18.660 6.191 1.584 578 1HD LYS 70 HD2 LYS 70 20.297 7.403 -0.159 579 2HD LYS 70 HD3 LYS 70 19.470 8.832 0.463 580 1HE LYS 70 HE2 LYS 70 21.091 8.697 2.076 581 2HE LYS 70 HE3 LYS 70 19.955 7.555 2.792 582 1HZ LYS 70 HZ1 LYS 70 21.344 6.042 1.020 583 2HZ LYS 70 HZ2 LYS 70 22.537 7.083 1.638 584 3HZ LYS 70 HZ3 LYS 70 21.626 6.111 2.692 585 H LYS 71 H LYS 71 15.533 4.738 -1.569 586 HA LYS 71 HA LYS 71 15.494 5.540 -4.447 587 1HB LYS 71 HB2 LYS 71 16.334 2.915 -3.209 588 2HB LYS 71 HB3 LYS 71 15.834 3.031 -4.898 589 1HG LYS 71 HG2 LYS 71 17.708 4.196 -5.516 590 2HG LYS 71 HG3 LYS 71 17.815 5.042 -3.972 591 1HD LYS 71 HD2 LYS 71 19.411 3.599 -3.325 592 2HD LYS 71 HD3 LYS 71 18.234 2.289 -3.426 593 1HE LYS 71 HE2 LYS 71 18.731 2.068 -5.855 594 2HE LYS 71 HE3 LYS 71 19.969 3.314 -5.693 595 1HZ LYS 71 HZ1 LYS 71 19.987 0.902 -3.988 596 2HZ LYS 71 HZ2 LYS 71 20.692 0.890 -5.534 597 3HZ LYS 71 HZ3 LYS 71 21.268 1.959 -4.349 598 H ILE 72 H ILE 72 13.521 5.305 -5.395 599 HA ILE 72 HA ILE 72 11.477 3.669 -3.944 600 HB ILE 72 HB ILE 72 11.136 6.307 -5.402 601 1HG1 ILE 72 HG12 ILE 72 10.266 5.790 -2.587 602 2HG1 ILE 72 HG13 ILE 72 11.992 6.003 -2.884 603 1HG2 ILE 72 HG21 ILE 72 9.179 4.242 -4.441 604 2HG2 ILE 72 HG22 ILE 72 8.734 5.948 -4.386 605 3HG2 ILE 72 HG23 ILE 72 9.154 5.195 -5.926 606 1HD1 ILE 72 HD11 ILE 72 11.484 8.137 -4.075 607 2HD1 ILE 72 HD12 ILE 72 9.785 7.939 -3.646 608 3HD1 ILE 72 HD13 ILE 72 10.993 8.171 -2.383 609 H GLU 73 H GLU 73 10.628 2.061 -5.189 610 HA GLU 73 HA GLU 73 10.704 2.401 -8.156 611 1HB GLU 73 HB2 GLU 73 11.567 -0.003 -6.530 612 2HB GLU 73 HB3 GLU 73 11.234 -0.082 -8.261 613 1HG GLU 73 HG2 GLU 73 13.006 1.423 -8.776 614 2HG GLU 73 HG3 GLU 73 13.171 1.922 -7.092 615 H VAL 74 H VAL 74 8.954 1.450 -9.262 616 HA VAL 74 HA VAL 74 6.772 0.396 -7.504 617 HB VAL 74 HB VAL 74 5.241 1.287 -9.338 618 1HG1 VAL 74 HG11 VAL 74 6.969 3.269 -7.824 619 2HG1 VAL 74 HG12 VAL 74 5.382 3.616 -8.508 620 3HG1 VAL 74 HG13 VAL 74 5.540 2.454 -7.191 621 1HG2 VAL 74 HG21 VAL 74 7.187 1.467 -10.987 622 2HG2 VAL 74 HG22 VAL 74 6.117 2.868 -10.909 623 3HG2 VAL 74 HG23 VAL 74 7.683 2.907 -10.099 624 H GLU 75 H GLU 75 6.233 -1.689 -7.938 625 HA GLU 75 HA GLU 75 7.110 -2.834 -10.552 626 1HB GLU 75 HB2 GLU 75 7.973 -3.846 -8.392 627 2HB GLU 75 HB3 GLU 75 6.316 -4.344 -8.050 628 1HG GLU 75 HG2 GLU 75 6.236 -5.719 -10.022 629 2HG GLU 75 HG3 GLU 75 7.767 -5.067 -10.607 630 H PHE 76 H PHE 76 5.261 -2.206 -11.773 631 HA PHE 76 HA PHE 76 2.557 -2.522 -10.974 632 1HB PHE 76 HB2 PHE 76 3.744 -2.776 -13.757 633 2HB PHE 76 HB3 PHE 76 2.037 -2.522 -13.393 634 HD1 PHE 76 HD1 PHE 76 5.419 -1.015 -13.205 635 HD2 PHE 76 HD2 PHE 76 1.200 -0.368 -12.728 636 HE1 PHE 76 HE1 PHE 76 5.810 1.428 -13.067 637 HE2 PHE 76 HE2 PHE 76 1.590 2.077 -12.592 638 HZ PHE 76 HZ PHE 76 3.896 2.975 -12.762 639 H ASP 77 H ASP 77 1.025 -4.222 -11.636 640 HA ASP 77 HA ASP 77 2.262 -6.898 -11.395 641 1HB ASP 77 HB2 ASP 77 0.016 -5.848 -10.270 642 2HB ASP 77 HB3 ASP 77 -0.679 -6.652 -11.677 643 H LYS 78 H LYS 78 0.218 -8.352 -12.768 644 HA LYS 78 HA LYS 78 1.075 -7.809 -15.559 645 1HB LYS 78 HB2 LYS 78 0.299 -10.073 -16.036 646 2HB LYS 78 HB3 LYS 78 1.332 -10.109 -14.606 647 1HG LYS 78 HG2 LYS 78 -1.353 -9.582 -13.764 648 2HG LYS 78 HG3 LYS 78 -1.373 -10.983 -14.834 649 1HD LYS 78 HD2 LYS 78 0.883 -11.349 -13.203 650 2HD LYS 78 HD3 LYS 78 -0.380 -10.773 -12.114 651 1HE LYS 78 HE2 LYS 78 -1.809 -12.571 -12.616 652 2HE LYS 78 HE3 LYS 78 -0.971 -12.938 -14.125 653 1HZ LYS 78 HZ1 LYS 78 1.001 -13.505 -12.709 654 2HZ LYS 78 HZ2 LYS 78 -0.025 -13.420 -11.358 655 3HZ LYS 78 HZ3 LYS 78 -0.319 -14.568 -12.571 656 H GLY 79 H GLY 79 -1.650 -7.474 -13.490 657 1HA GLY 79 HA2 GLY 79 -3.701 -7.615 -15.537 658 2HA GLY 79 HA3 GLY 79 -3.900 -6.928 -13.924 659 H GLN 80 H GLN 80 -4.914 -5.003 -14.569 660 HA GLN 80 HA GLN 80 -3.939 -3.353 -16.726 661 1HB GLN 80 HB2 GLN 80 -5.682 -2.642 -14.344 662 2HB GLN 80 HB3 GLN 80 -5.448 -1.629 -15.770 663 1HG GLN 80 HG2 GLN 80 -6.623 -3.090 -17.168 664 2HG GLN 80 HG3 GLN 80 -6.369 -4.471 -16.099 665 1HE2 GLN 80 HE21 GLN 80 -7.932 -4.856 -14.461 666 2HE2 GLN 80 HE22 GLN 80 -9.284 -3.863 -14.204 667 H ARG 81 H ARG 81 -3.342 -0.925 -16.095 668 HA ARG 81 HA ARG 81 -1.143 -1.119 -14.075 669 1HB ARG 81 HB2 ARG 81 -1.421 0.471 -16.628 670 2HB ARG 81 HB3 ARG 81 -0.232 0.898 -15.397 671 1HG ARG 81 HG2 ARG 81 0.840 -1.250 -15.576 672 2HG ARG 81 HG3 ARG 81 -0.453 -1.870 -16.602 673 1HD ARG 81 HD2 ARG 81 0.202 -0.546 -18.438 674 2HD ARG 81 HD3 ARG 81 1.145 0.549 -17.427 675 HE ARG 81 HE ARG 81 2.878 -1.157 -17.285 676 1HH1 ARG 81 HH11 ARG 81 0.264 -2.949 -18.203 677 2HH1 ARG 81 HH12 ARG 81 1.026 -3.755 -19.534 678 1HH2 ARG 81 HH21 ARG 81 3.848 -1.737 -19.480 679 2HH2 ARG 81 HH22 ARG 81 3.055 -3.065 -20.260 680 H THR 82 H THR 82 -4.170 0.247 -14.628 681 HA THR 82 HA THR 82 -3.762 2.106 -12.367 682 HB THR 82 HB THR 82 -4.888 3.962 -13.620 683 HG1 THR 82 HG1 THR 82 -4.476 3.458 -16.051 684 1HG2 THR 82 HG21 THR 82 -2.287 2.891 -14.745 685 2HG2 THR 82 HG22 THR 82 -2.892 4.523 -15.028 686 3HG2 THR 82 HG23 THR 82 -2.474 4.009 -13.393 687 H ASP 83 H ASP 83 -5.977 3.063 -11.728 688 HA ASP 83 HA ASP 83 -7.990 0.885 -11.980 689 1HB ASP 83 HB2 ASP 83 -7.096 2.491 -9.808 690 2HB ASP 83 HB3 ASP 83 -8.775 2.930 -10.122 691 H LYS 84 H LYS 84 -10.265 2.420 -11.311 692 HA LYS 84 HA LYS 84 -10.916 3.516 -13.919 693 1HB LYS 84 HB2 LYS 84 -13.106 4.047 -12.868 694 2HB LYS 84 HB3 LYS 84 -12.619 2.376 -12.573 695 1HG LYS 84 HG2 LYS 84 -11.479 3.543 -10.426 696 2HG LYS 84 HG3 LYS 84 -12.834 4.647 -10.667 697 1HD LYS 84 HD2 LYS 84 -13.789 1.965 -10.985 698 2HD LYS 84 HD3 LYS 84 -12.880 2.058 -9.476 699 1HE LYS 84 HE2 LYS 84 -14.425 4.427 -9.629 700 2HE LYS 84 HE3 LYS 84 -15.501 3.100 -10.061 701 1HZ LYS 84 HZ1 LYS 84 -13.712 2.919 -7.719 702 2HZ LYS 84 HZ2 LYS 84 -15.228 3.669 -7.603 703 3HZ LYS 84 HZ3 LYS 84 -15.123 2.033 -8.051 704 H TYR 85 H TYR 85 -9.698 4.831 -10.943 705 HA TYR 85 HA TYR 85 -10.454 7.588 -11.695 706 1HB TYR 85 HB2 TYR 85 -8.829 6.547 -9.353 707 2HB TYR 85 HB3 TYR 85 -9.363 8.215 -9.570 708 HD1 TYR 85 HD1 TYR 85 -11.871 8.679 -9.742 709 HD2 TYR 85 HD2 TYR 85 -10.269 4.925 -8.403 710 HE1 TYR 85 HE1 TYR 85 -14.055 8.115 -8.711 711 HE2 TYR 85 HE2 TYR 85 -12.453 4.361 -7.372 712 HH TYR 85 HH TYR 85 -15.264 5.831 -8.101 713 H GLY 86 H GLY 86 -8.150 5.520 -12.742 714 1HA GLY 86 HA2 GLY 86 -6.247 5.985 -14.067 715 2HA GLY 86 HA3 GLY 86 -6.451 7.697 -13.695 716 H ARG 87 H ARG 87 -6.440 5.558 -10.992 717 HA ARG 87 HA ARG 87 -3.958 6.775 -10.021 718 1HB ARG 87 HB2 ARG 87 -5.223 4.475 -8.595 719 2HB ARG 87 HB3 ARG 87 -4.557 5.970 -7.941 720 1HG ARG 87 HG2 ARG 87 -6.651 6.910 -9.448 721 2HG ARG 87 HG3 ARG 87 -7.294 5.379 -8.852 722 1HD ARG 87 HD2 ARG 87 -5.901 7.288 -6.984 723 2HD ARG 87 HD3 ARG 87 -7.607 7.496 -7.375 724 HE ARG 87 HE ARG 87 -6.544 4.967 -6.180 725 1HH1 ARG 87 HH11 ARG 87 -7.785 7.480 -4.711 726 2HH1 ARG 87 HH12 ARG 87 -9.344 6.830 -4.329 727 1HH2 ARG 87 HH21 ARG 87 -9.031 4.116 -6.464 728 2HH2 ARG 87 HH22 ARG 87 -10.050 4.925 -5.321 729 H GLY 88 H GLY 88 -1.953 5.847 -10.124 730 1HA GLY 88 HA2 GLY 88 -1.539 3.474 -11.709 731 2HA GLY 88 HA3 GLY 88 -0.295 4.320 -10.789 732 H LEU 89 H LEU 89 -1.183 1.362 -11.051 733 HA LEU 89 HA LEU 89 -1.337 0.845 -8.106 734 1HB LEU 89 HB2 LEU 89 -2.389 -0.919 -10.338 735 2HB LEU 89 HB3 LEU 89 -2.555 -1.207 -8.606 736 HG LEU 89 HG LEU 89 -3.664 1.219 -10.049 737 1HD1 LEU 89 HD11 LEU 89 -4.707 -1.508 -9.625 738 2HD1 LEU 89 HD12 LEU 89 -5.806 -0.222 -9.125 739 3HD1 LEU 89 HD13 LEU 89 -5.211 -0.278 -10.784 740 1HD2 LEU 89 HD21 LEU 89 -3.238 0.551 -7.274 741 2HD2 LEU 89 HD22 LEU 89 -3.910 2.031 -7.960 742 3HD2 LEU 89 HD23 LEU 89 -4.969 0.668 -7.593 743 H ALA 90 H ALA 90 0.522 -0.050 -7.362 744 HA ALA 90 HA ALA 90 1.805 -2.273 -8.680 745 1HB ALA 90 HB1 ALA 90 2.971 0.482 -9.011 746 2HB ALA 90 HB2 ALA 90 4.030 -0.926 -8.939 747 3HB ALA 90 HB3 ALA 90 2.811 -0.803 -10.208 748 H TYR 91 H TYR 91 3.759 -2.974 -7.437 749 HA TYR 91 HA TYR 91 3.375 -2.430 -4.582 750 1HB TYR 91 HB2 TYR 91 5.562 -4.105 -5.832 751 2HB TYR 91 HB3 TYR 91 4.884 -4.242 -4.210 752 HD1 TYR 91 HD1 TYR 91 2.461 -4.951 -3.943 753 HD2 TYR 91 HD2 TYR 91 4.568 -5.230 -7.676 754 HE1 TYR 91 HE1 TYR 91 0.756 -6.541 -4.787 755 HE2 TYR 91 HE2 TYR 91 2.864 -6.821 -8.520 756 HH TYR 91 HH TYR 91 -0.030 -7.588 -6.621 757 H ILE 92 H ILE 92 4.285 -0.612 -3.744 758 HA ILE 92 HA ILE 92 6.590 0.658 -5.006 759 HB ILE 92 HB ILE 92 5.130 1.245 -2.414 760 1HG1 ILE 92 HG12 ILE 92 5.078 2.659 -5.100 761 2HG1 ILE 92 HG13 ILE 92 3.840 1.533 -4.545 762 1HG2 ILE 92 HG21 ILE 92 7.559 2.392 -3.677 763 2HG2 ILE 92 HG22 ILE 92 6.369 3.561 -3.102 764 3HG2 ILE 92 HG23 ILE 92 7.067 2.388 -1.983 765 1HD1 ILE 92 HD11 ILE 92 4.460 3.604 -2.567 766 2HD1 ILE 92 HD12 ILE 92 3.843 4.263 -4.082 767 3HD1 ILE 92 HD13 ILE 92 2.895 3.076 -3.186 768 H TYR 93 H TYR 93 8.693 0.825 -4.108 769 HA TYR 93 HA TYR 93 9.260 -0.919 -1.756 770 1HB TYR 93 HB2 TYR 93 10.680 -0.962 -4.432 771 2HB TYR 93 HB3 TYR 93 11.321 -1.720 -2.975 772 HD1 TYR 93 HD1 TYR 93 10.081 -3.591 -1.884 773 HD2 TYR 93 HD2 TYR 93 8.858 -1.941 -5.658 774 HE1 TYR 93 HE1 TYR 93 8.675 -5.589 -2.304 775 HE2 TYR 93 HE2 TYR 93 7.450 -3.940 -6.076 776 HH TYR 93 HH TYR 93 6.878 -5.967 -5.356 777 H ALA 94 H ALA 94 10.378 0.252 -0.283 778 HA ALA 94 HA ALA 94 12.074 2.505 -1.286 779 1HB ALA 94 HB1 ALA 94 9.956 2.464 0.663 780 2HB ALA 94 HB2 ALA 94 11.470 2.890 1.461 781 3HB ALA 94 HB3 ALA 94 10.896 3.842 0.092 782 H ASP 95 H ASP 95 14.217 2.214 -0.890 783 HA ASP 95 HA ASP 95 16.193 1.428 0.111 784 1HB ASP 95 HB2 ASP 95 14.229 1.540 2.324 785 2HB ASP 95 HB3 ASP 95 15.604 0.468 2.589 786 H GLY 96 H GLY 96 13.991 -0.377 -1.167 787 1HA GLY 96 HA2 GLY 96 14.170 -2.638 -1.883 788 2HA GLY 96 HA3 GLY 96 15.456 -2.881 -0.699 789 H LYS 97 H LYS 97 12.416 -1.422 0.222 790 HA LYS 97 HA LYS 97 11.650 -3.977 1.575 791 1HB LYS 97 HB2 LYS 97 12.587 -1.750 2.892 792 2HB LYS 97 HB3 LYS 97 10.842 -1.495 2.938 793 1HG LYS 97 HG2 LYS 97 10.644 -3.914 3.734 794 2HG LYS 97 HG3 LYS 97 12.392 -3.878 3.969 795 1HD LYS 97 HD2 LYS 97 10.425 -1.951 5.237 796 2HD LYS 97 HD3 LYS 97 11.178 -3.319 6.057 797 1HE LYS 97 HE2 LYS 97 12.795 -1.834 6.632 798 2HE LYS 97 HE3 LYS 97 13.356 -2.034 4.972 799 1HZ LYS 97 HZ1 LYS 97 11.433 -0.230 4.634 800 2HZ LYS 97 HZ2 LYS 97 11.943 0.183 6.201 801 3HZ LYS 97 HZ3 LYS 97 13.054 0.179 4.916 802 H MET 98 H MET 98 9.616 -4.597 1.039 803 HA MET 98 HA MET 98 7.958 -3.045 -0.711 804 1HB MET 98 HB2 MET 98 7.762 -5.460 -0.689 805 2HB MET 98 HB3 MET 98 7.334 -5.453 1.022 806 1HG MET 98 HG2 MET 98 5.178 -5.353 0.373 807 2HG MET 98 HG3 MET 98 5.502 -3.701 -0.155 808 1HE MET 98 HE1 MET 98 4.009 -6.817 -1.022 809 2HE MET 98 HE2 MET 98 4.603 -7.368 -2.587 810 3HE MET 98 HE3 MET 98 5.641 -7.483 -1.168 811 H VAL 99 H VAL 99 6.992 -1.175 -0.062 812 HA VAL 99 HA VAL 99 6.501 -0.414 2.626 813 HB VAL 99 HB VAL 99 4.871 0.501 0.244 814 1HG1 VAL 99 HG11 VAL 99 5.020 1.239 3.010 815 2HG1 VAL 99 HG12 VAL 99 5.649 2.573 2.042 816 3HG1 VAL 99 HG13 VAL 99 4.026 1.953 1.740 817 1HG2 VAL 99 HG21 VAL 99 7.720 1.034 1.027 818 2HG2 VAL 99 HG22 VAL 99 7.027 0.825 -0.581 819 3HG2 VAL 99 HG23 VAL 99 6.776 2.333 0.297 820 H ASN 100 H ASN 100 4.366 -1.990 0.254 821 HA ASN 100 HA ASN 100 1.981 -1.986 1.769 822 1HB ASN 100 HB2 ASN 100 2.999 -4.196 -0.047 823 2HB ASN 100 HB3 ASN 100 1.320 -3.932 0.429 824 1HD2 ASN 100 HD21 ASN 100 1.184 -3.777 -2.111 825 2HD2 ASN 100 HD22 ASN 100 1.392 -2.230 -2.775 826 H GLU 101 H GLU 101 4.803 -4.113 1.945 827 HA GLU 101 HA GLU 101 3.600 -5.950 3.838 828 1HB GLU 101 HB2 GLU 101 5.509 -6.619 2.432 829 2HB GLU 101 HB3 GLU 101 6.518 -5.402 3.215 830 1HG GLU 101 HG2 GLU 101 6.509 -6.541 5.277 831 2HG GLU 101 HG3 GLU 101 5.095 -7.502 4.840 832 H ALA 102 H ALA 102 5.596 -3.040 4.093 833 HA ALA 102 HA ALA 102 6.192 -3.182 6.862 834 1HB ALA 102 HB1 ALA 102 6.956 -1.460 5.037 835 2HB ALA 102 HB2 ALA 102 5.526 -0.563 5.548 836 3HB ALA 102 HB3 ALA 102 6.801 -0.926 6.710 837 H LEU 103 H LEU 103 3.438 -1.632 5.220 838 HA LEU 103 HA LEU 103 2.097 -0.750 7.566 839 1HB LEU 103 HB2 LEU 103 1.028 -1.585 4.856 840 2HB LEU 103 HB3 LEU 103 0.024 -0.861 6.113 841 HG LEU 103 HG LEU 103 2.502 0.630 5.655 842 1HD1 LEU 103 HD11 LEU 103 1.213 -0.386 3.343 843 2HD1 LEU 103 HD12 LEU 103 0.760 1.314 3.464 844 3HD1 LEU 103 HD13 LEU 103 2.462 0.856 3.417 845 1HD2 LEU 103 HD21 LEU 103 -0.441 1.119 5.949 846 2HD2 LEU 103 HD22 LEU 103 0.902 1.796 6.871 847 3HD2 LEU 103 HD23 LEU 103 0.555 2.395 5.249 848 H VAL 104 H VAL 104 1.709 -3.787 5.713 849 HA VAL 104 HA VAL 104 -0.286 -4.972 7.314 850 HB VAL 104 HB VAL 104 2.008 -6.153 5.737 851 1HG1 VAL 104 HG11 VAL 104 0.075 -7.486 7.588 852 2HG1 VAL 104 HG12 VAL 104 0.430 -8.286 6.057 853 3HG1 VAL 104 HG13 VAL 104 1.735 -7.930 7.190 854 1HG2 VAL 104 HG21 VAL 104 -0.298 -5.028 4.893 855 2HG2 VAL 104 HG22 VAL 104 0.465 -6.375 4.049 856 3HG2 VAL 104 HG23 VAL 104 -0.866 -6.675 5.166 857 H ARG 105 H ARG 105 3.190 -4.690 7.861 858 HA ARG 105 HA ARG 105 3.320 -6.502 10.090 859 1HB ARG 105 HB2 ARG 105 5.285 -5.555 8.765 860 2HB ARG 105 HB3 ARG 105 5.067 -4.064 9.682 861 1HG ARG 105 HG2 ARG 105 5.264 -5.422 11.794 862 2HG ARG 105 HG3 ARG 105 5.688 -6.813 10.795 863 1HD ARG 105 HD2 ARG 105 7.785 -5.920 11.385 864 2HD ARG 105 HD3 ARG 105 7.500 -5.254 9.778 865 HE ARG 105 HE ARG 105 6.542 -3.535 11.941 866 1HH1 ARG 105 HH11 ARG 105 9.625 -4.572 11.384 867 2HH1 ARG 105 HH12 ARG 105 10.273 -3.039 10.905 868 1HH2 ARG 105 HH21 ARG 105 7.174 -1.497 10.695 869 2HH2 ARG 105 HH22 ARG 105 8.886 -1.299 10.515 870 H GLN 106 H GLN 106 2.639 -3.033 9.809 871 HA GLN 106 HA GLN 106 2.430 -2.723 12.722 872 1HB GLN 106 HB2 GLN 106 2.217 -0.942 10.337 873 2HB GLN 106 HB3 GLN 106 1.359 -0.444 11.796 874 1HG GLN 106 HG2 GLN 106 4.308 -1.124 11.607 875 2HG GLN 106 HG3 GLN 106 3.624 0.489 11.812 876 1HE2 GLN 106 HE21 GLN 106 5.031 -1.961 13.566 877 2HE2 GLN 106 HE22 GLN 106 4.323 -1.666 15.080 878 H GLY 107 H GLY 107 0.545 -4.337 10.678 879 1HA GLY 107 HA2 GLY 107 -1.759 -4.802 10.536 880 2HA GLY 107 HA3 GLY 107 -1.717 -4.541 12.280 881 H LEU 108 H LEU 108 -1.182 -2.203 9.639 882 HA LEU 108 HA LEU 108 -3.322 -0.529 10.868 883 1HB LEU 108 HB2 LEU 108 -0.975 0.129 9.076 884 2HB LEU 108 HB3 LEU 108 -2.275 1.280 9.384 885 HG LEU 108 HG LEU 108 -0.432 0.017 11.432 886 1HD1 LEU 108 HD11 LEU 108 -0.523 2.550 9.978 887 2HD1 LEU 108 HD12 LEU 108 -0.515 2.791 11.725 888 3HD1 LEU 108 HD13 LEU 108 0.777 1.869 10.956 889 1HD2 LEU 108 HD21 LEU 108 -3.122 1.216 11.672 890 2HD2 LEU 108 HD22 LEU 108 -2.254 0.166 12.793 891 3HD2 LEU 108 HD23 LEU 108 -1.919 1.898 12.767 892 H ALA 109 H ALA 109 -2.595 -2.459 8.125 893 HA ALA 109 HA ALA 109 -5.088 -1.460 6.817 894 1HB ALA 109 HB1 ALA 109 -2.360 -1.853 5.635 895 2HB ALA 109 HB2 ALA 109 -3.775 -2.181 4.633 896 3HB ALA 109 HB3 ALA 109 -3.537 -0.576 5.326 897 H LYS 110 H LYS 110 -6.142 -3.120 5.476 898 HA LYS 110 HA LYS 110 -5.424 -5.881 6.385 899 1HB LYS 110 HB2 LYS 110 -8.145 -4.931 5.453 900 2HB LYS 110 HB3 LYS 110 -7.757 -6.452 6.258 901 1HG LYS 110 HG2 LYS 110 -6.901 -5.007 8.208 902 2HG LYS 110 HG3 LYS 110 -7.741 -3.667 7.426 903 1HD LYS 110 HD2 LYS 110 -9.456 -5.994 7.536 904 2HD LYS 110 HD3 LYS 110 -8.864 -5.595 9.148 905 1HE LYS 110 HE2 LYS 110 -10.069 -3.676 9.241 906 2HE LYS 110 HE3 LYS 110 -9.676 -3.246 7.576 907 1HZ LYS 110 HZ1 LYS 110 -11.288 -4.995 6.881 908 2HZ LYS 110 HZ2 LYS 110 -11.767 -5.130 8.506 909 3HZ LYS 110 HZ3 LYS 110 -11.990 -3.668 7.676 910 H VAL 111 H VAL 111 -5.198 -7.467 4.808 911 HA VAL 111 HA VAL 111 -4.630 -6.653 2.120 912 HB VAL 111 HB VAL 111 -5.230 -9.412 3.233 913 1HG1 VAL 111 HG11 VAL 111 -4.977 -8.543 0.550 914 2HG1 VAL 111 HG12 VAL 111 -3.459 -9.343 0.957 915 3HG1 VAL 111 HG13 VAL 111 -4.988 -10.204 1.141 916 1HG2 VAL 111 HG21 VAL 111 -2.746 -7.727 2.973 917 2HG2 VAL 111 HG22 VAL 111 -3.311 -8.659 4.360 918 3HG2 VAL 111 HG23 VAL 111 -2.631 -9.487 2.959 919 H ALA 112 H ALA 112 -5.968 -6.479 0.358 920 HA ALA 112 HA ALA 112 -8.406 -7.965 0.036 921 1HB ALA 112 HB1 ALA 112 -8.896 -6.162 1.890 922 2HB ALA 112 HB2 ALA 112 -8.971 -5.056 0.519 923 3HB ALA 112 HB3 ALA 112 -10.070 -6.431 0.602 924 H TYR 113 H TYR 113 -9.846 -6.391 -1.646 925 HA TYR 113 HA TYR 113 -9.867 -5.552 -3.836 926 1HB TYR 113 HB2 TYR 113 -7.327 -4.375 -2.722 927 2HB TYR 113 HB3 TYR 113 -7.750 -4.140 -4.417 928 HD1 TYR 113 HD1 TYR 113 -10.709 -3.961 -4.269 929 HD2 TYR 113 HD2 TYR 113 -7.688 -2.269 -1.725 930 HE1 TYR 113 HE1 TYR 113 -12.268 -2.146 -3.626 931 HE2 TYR 113 HE2 TYR 113 -9.249 -0.452 -1.084 932 HH TYR 113 HH TYR 113 -11.258 0.430 -1.372 933 H VAL 114 H VAL 114 -9.391 -8.140 -3.915 934 HA VAL 114 HA VAL 114 -6.888 -8.520 -5.503 935 HB VAL 114 HB VAL 114 -8.636 -10.558 -4.089 936 1HG1 VAL 114 HG11 VAL 114 -6.590 -10.781 -6.164 937 2HG1 VAL 114 HG12 VAL 114 -6.172 -11.698 -4.716 938 3HG1 VAL 114 HG13 VAL 114 -7.697 -12.008 -5.548 939 1HG2 VAL 114 HG21 VAL 114 -6.615 -8.834 -3.118 940 2HG2 VAL 114 HG22 VAL 114 -7.321 -10.220 -2.287 941 3HG2 VAL 114 HG23 VAL 114 -5.867 -10.424 -3.264 942 H TYR 115 H TYR 115 -7.619 -7.931 -7.565 943 HA TYR 115 HA TYR 115 -9.915 -9.534 -8.627 944 1HB TYR 115 HB2 TYR 115 -8.900 -6.886 -9.697 945 2HB TYR 115 HB3 TYR 115 -10.378 -7.730 -10.163 946 HD1 TYR 115 HD1 TYR 115 -12.184 -8.093 -8.402 947 HD2 TYR 115 HD2 TYR 115 -8.868 -5.424 -7.832 948 HE1 TYR 115 HE1 TYR 115 -13.415 -6.954 -6.574 949 HE2 TYR 115 HE2 TYR 115 -10.098 -4.285 -6.004 950 HH TYR 115 HH TYR 115 -12.332 -3.973 -5.210 951 H LYS 116 H LYS 116 -8.768 -11.279 -9.472 952 HA LYS 116 HA LYS 116 -6.269 -11.393 -10.644 953 1HB LYS 116 HB2 LYS 116 -8.763 -12.776 -11.681 954 2HB LYS 116 HB3 LYS 116 -7.102 -13.269 -12.012 955 1HG LYS 116 HG2 LYS 116 -6.851 -13.336 -9.421 956 2HG LYS 116 HG3 LYS 116 -8.616 -13.374 -9.411 957 1HD LYS 116 HD2 LYS 116 -7.497 -15.235 -11.360 958 2HD LYS 116 HD3 LYS 116 -6.934 -15.576 -9.723 959 1HE LYS 116 HE2 LYS 116 -8.921 -16.524 -9.264 960 2HE LYS 116 HE3 LYS 116 -9.701 -14.965 -9.533 961 1HZ LYS 116 HZ1 LYS 116 -8.976 -16.752 -11.774 962 2HZ LYS 116 HZ2 LYS 116 -10.460 -16.899 -10.960 963 3HZ LYS 116 HZ3 LYS 116 -10.072 -15.457 -11.771 964 HA PRO 117 HA PRO 117 -5.311 -12.354 -12.177 965 1HB PRO 117 HB2 PRO 117 -3.327 -11.774 -13.958 966 2HB PRO 117 HB3 PRO 117 -4.745 -12.747 -14.381 967 1HG PRO 117 HG2 PRO 117 -4.071 -9.988 -15.192 968 2HG PRO 117 HG3 PRO 117 -5.171 -11.145 -15.955 969 1HD PRO 117 HD2 PRO 117 -5.864 -8.932 -14.247 970 2HD PRO 117 HD3 PRO 117 -6.961 -10.123 -14.980 971 H ASN 118 H ASN 118 -5.575 -9.594 -11.018 972 HA ASN 118 HA ASN 118 -2.765 -8.730 -10.698 973 1HB ASN 118 HB2 ASN 118 -5.445 -7.598 -9.980 974 2HB ASN 118 HB3 ASN 118 -4.028 -7.053 -9.081 975 1HD2 ASN 118 HD21 ASN 118 -5.616 -5.446 -11.015 976 2HD2 ASN 118 HD22 ASN 118 -4.540 -4.995 -12.248 977 H ASN 119 H ASN 119 -2.281 -10.880 -9.625 978 HA ASN 119 HA ASN 119 -2.411 -10.529 -6.716 979 1HB ASN 119 HB2 ASN 119 -3.365 -12.819 -6.351 980 2HB ASN 119 HB3 ASN 119 -4.517 -11.692 -7.068 981 1HD2 ASN 119 HD21 ASN 119 -5.119 -14.318 -7.515 982 2HD2 ASN 119 HD22 ASN 119 -4.734 -14.780 -9.100 983 H THR 120 H THR 120 -0.320 -10.631 -8.750 984 HA THR 120 HA THR 120 0.981 -13.189 -8.769 985 HB THR 120 HB THR 120 2.278 -10.454 -8.978 986 HG1 THR 120 HG1 THR 120 1.592 -11.984 -11.198 987 1HG2 THR 120 HG21 THR 120 3.444 -12.939 -8.831 988 2HG2 THR 120 HG22 THR 120 3.269 -12.718 -10.572 989 3HG2 THR 120 HG23 THR 120 4.164 -11.535 -9.619 990 H HIS 121 H HIS 121 0.509 -10.935 -6.273 991 HA HIS 121 HA HIS 121 2.559 -12.348 -4.634 992 1HB HIS 121 HB2 HIS 121 2.137 -9.365 -4.886 993 2HB HIS 121 HB3 HIS 121 2.934 -10.080 -3.486 994 HD1 HIS 121 HD1 HIS 121 4.776 -12.112 -4.540 995 HD2 HIS 121 HD2 HIS 121 4.120 -8.559 -6.620 996 HE1 HIS 121 HE1 HIS 121 6.773 -11.797 -6.066 997 H GLU 122 H GLU 122 -0.493 -12.351 -4.967 998 HA GLU 122 HA GLU 122 -1.662 -11.190 -2.624 999 1HB GLU 122 HB2 GLU 122 -2.950 -12.048 -4.601 1000 2HB GLU 122 HB3 GLU 122 -2.566 -13.691 -4.084 1001 1HG GLU 122 HG2 GLU 122 -3.562 -12.286 -1.812 1002 2HG GLU 122 HG3 GLU 122 -4.671 -11.989 -3.150 1003 H GLN 123 H GLN 123 -0.079 -14.291 -3.224 1004 HA GLN 123 HA GLN 123 -0.773 -15.467 -0.679 1005 1HB GLN 123 HB2 GLN 123 0.973 -16.109 -2.963 1006 2HB GLN 123 HB3 GLN 123 1.579 -16.688 -1.412 1007 1HG GLN 123 HG2 GLN 123 -0.976 -17.430 -1.128 1008 2HG GLN 123 HG3 GLN 123 -0.895 -17.462 -2.889 1009 1HE2 GLN 123 HE21 GLN 123 0.122 -19.098 0.023 1010 2HE2 GLN 123 HE22 GLN 123 0.991 -20.340 -0.738 1011 H LEU 124 H LEU 124 1.956 -13.528 -1.843 1012 HA LEU 124 HA LEU 124 3.642 -13.802 0.430 1013 1HB LEU 124 HB2 LEU 124 4.243 -12.710 -1.773 1014 2HB LEU 124 HB3 LEU 124 3.320 -11.300 -1.251 1015 HG LEU 124 HG LEU 124 4.768 -11.300 0.852 1016 1HD1 LEU 124 HD11 LEU 124 6.303 -13.262 -0.873 1017 2HD1 LEU 124 HD12 LEU 124 7.006 -12.424 0.509 1018 3HD1 LEU 124 HD13 LEU 124 5.663 -13.540 0.746 1019 1HD2 LEU 124 HD21 LEU 124 5.480 -10.537 -1.905 1020 2HD2 LEU 124 HD22 LEU 124 5.505 -9.570 -0.430 1021 3HD2 LEU 124 HD23 LEU 124 6.858 -10.636 -0.809 1022 H LEU 125 H LEU 125 1.540 -10.992 -0.309 1023 HA LEU 125 HA LEU 125 1.676 -9.842 2.276 1024 1HB LEU 125 HB2 LEU 125 -0.463 -9.728 0.137 1025 2HB LEU 125 HB3 LEU 125 -0.558 -8.786 1.626 1026 HG LEU 125 HG LEU 125 1.850 -8.701 -0.203 1027 1HD1 LEU 125 HD11 LEU 125 -0.722 -7.755 -0.811 1028 2HD1 LEU 125 HD12 LEU 125 0.163 -6.337 -0.249 1029 3HD1 LEU 125 HD13 LEU 125 0.784 -7.286 -1.600 1030 1HD2 LEU 125 HD21 LEU 125 2.068 -7.964 2.192 1031 2HD2 LEU 125 HD22 LEU 125 2.363 -6.671 1.031 1032 3HD2 LEU 125 HD23 LEU 125 0.822 -6.754 1.885 1033 H ARG 126 H ARG 126 -0.223 -12.521 1.065 1034 HA ARG 126 HA ARG 126 -2.274 -12.621 3.008 1035 1HB ARG 126 HB2 ARG 126 -1.204 -14.363 1.008 1036 2HB ARG 126 HB3 ARG 126 -1.373 -15.286 2.502 1037 1HG ARG 126 HG2 ARG 126 -3.720 -13.976 2.559 1038 2HG ARG 126 HG3 ARG 126 -3.471 -14.017 0.813 1039 1HD ARG 126 HD2 ARG 126 -4.590 -16.036 1.184 1040 2HD ARG 126 HD3 ARG 126 -2.901 -16.544 1.224 1041 HE ARG 126 HE ARG 126 -4.102 -15.822 3.823 1042 1HH1 ARG 126 HH11 ARG 126 -4.301 -18.355 1.613 1043 2HH1 ARG 126 HH12 ARG 126 -3.792 -19.586 2.719 1044 1HH2 ARG 126 HH21 ARG 126 -2.959 -17.352 5.237 1045 2HH2 ARG 126 HH22 ARG 126 -3.034 -19.019 4.772 1046 H LYS 127 H LYS 127 0.860 -14.369 3.101 1047 HA LYS 127 HA LYS 127 0.563 -15.257 5.794 1048 1HB LYS 127 HB2 LYS 127 3.080 -15.507 5.715 1049 2HB LYS 127 HB3 LYS 127 2.223 -16.302 4.395 1050 1HG LYS 127 HG2 LYS 127 2.854 -14.664 2.830 1051 2HG LYS 127 HG3 LYS 127 3.222 -13.478 4.082 1052 1HD LYS 127 HD2 LYS 127 4.788 -16.016 3.533 1053 2HD LYS 127 HD3 LYS 127 5.302 -14.376 3.129 1054 1HE LYS 127 HE2 LYS 127 4.762 -14.039 5.753 1055 2HE LYS 127 HE3 LYS 127 5.223 -15.740 5.769 1056 1HZ LYS 127 HZ1 LYS 127 7.143 -14.782 4.244 1057 2HZ LYS 127 HZ2 LYS 127 6.824 -13.384 5.156 1058 3HZ LYS 127 HZ3 LYS 127 7.266 -14.822 5.937 1059 H SER 128 H SER 128 1.850 -12.265 4.430 1060 HA SER 128 HA SER 128 3.079 -11.224 6.769 1061 1HB SER 128 HB2 SER 128 1.580 -9.703 4.615 1062 2HB SER 128 HB3 SER 128 2.731 -9.008 5.753 1063 HG SER 128 HG SER 128 4.097 -10.877 4.790 1064 H GLU 129 H GLU 129 -0.300 -11.251 5.724 1065 HA GLU 129 HA GLU 129 -1.243 -9.557 7.877 1066 1HB GLU 129 HB2 GLU 129 -2.625 -9.740 5.922 1067 2HB GLU 129 HB3 GLU 129 -2.636 -11.501 6.018 1068 1HG GLU 129 HG2 GLU 129 -3.901 -11.421 8.102 1069 2HG GLU 129 HG3 GLU 129 -3.813 -9.659 8.120 1070 H ALA 130 H ALA 130 -0.837 -13.042 7.430 1071 HA ALA 130 HA ALA 130 -2.270 -13.932 9.712 1072 1HB ALA 130 HB1 ALA 130 -1.087 -15.285 7.808 1073 2HB ALA 130 HB2 ALA 130 0.314 -15.223 8.879 1074 3HB ALA 130 HB3 ALA 130 -1.180 -15.985 9.423 1075 H GLN 131 H GLN 131 1.095 -12.847 9.379 1076 HA GLN 131 HA GLN 131 1.837 -13.350 12.107 1077 1HB GLN 131 HB2 GLN 131 3.464 -12.909 10.251 1078 2HB GLN 131 HB3 GLN 131 2.940 -11.224 10.241 1079 1HG GLN 131 HG2 GLN 131 4.321 -10.762 11.956 1080 2HG GLN 131 HG3 GLN 131 3.530 -11.989 12.944 1081 1HE2 GLN 131 HE21 GLN 131 6.256 -11.407 10.750 1082 2HE2 GLN 131 HE22 GLN 131 7.082 -12.843 11.117 1083 H ALA 132 H ALA 132 0.700 -10.400 10.445 1084 HA ALA 132 HA ALA 132 0.709 -8.670 12.679 1085 1HB ALA 132 HB1 ALA 132 -1.246 -8.778 10.361 1086 2HB ALA 132 HB2 ALA 132 -1.072 -7.418 11.470 1087 3HB ALA 132 HB3 ALA 132 0.262 -7.865 10.408 1088 H LYS 133 H LYS 133 -1.512 -11.236 11.781 1089 HA LYS 133 HA LYS 133 -3.610 -10.481 13.630 1090 1HB LYS 133 HB2 LYS 133 -3.035 -12.701 11.800 1091 2HB LYS 133 HB3 LYS 133 -3.839 -13.221 13.282 1092 1HG LYS 133 HG2 LYS 133 -5.553 -11.436 12.925 1093 2HG LYS 133 HG3 LYS 133 -4.789 -11.058 11.382 1094 1HD LYS 133 HD2 LYS 133 -5.494 -13.910 11.886 1095 2HD LYS 133 HD3 LYS 133 -6.823 -12.795 11.564 1096 1HE LYS 133 HE2 LYS 133 -5.870 -12.141 9.455 1097 2HE LYS 133 HE3 LYS 133 -4.365 -12.991 9.806 1098 1HZ LYS 133 HZ1 LYS 133 -6.643 -14.699 10.018 1099 2HZ LYS 133 HZ2 LYS 133 -6.518 -14.008 8.471 1100 3HZ LYS 133 HZ3 LYS 133 -5.224 -14.900 9.107 1101 H LYS 134 H LYS 134 -0.918 -12.822 13.770 1102 HA LYS 134 HA LYS 134 -1.539 -13.618 16.497 1103 1HB LYS 134 HB2 LYS 134 0.556 -14.212 14.484 1104 2HB LYS 134 HB3 LYS 134 1.060 -14.351 16.169 1105 1HG LYS 134 HG2 LYS 134 -1.490 -15.617 15.159 1106 2HG LYS 134 HG3 LYS 134 0.059 -16.458 15.094 1107 1HD LYS 134 HD2 LYS 134 -0.871 -15.201 17.665 1108 2HD LYS 134 HD3 LYS 134 -1.457 -16.796 17.192 1109 1HE LYS 134 HE2 LYS 134 1.167 -17.171 16.742 1110 2HE LYS 134 HE3 LYS 134 1.279 -15.946 18.006 1111 1HZ LYS 134 HZ1 LYS 134 -0.681 -17.851 18.697 1112 2HZ LYS 134 HZ2 LYS 134 0.763 -18.655 18.313 1113 3HZ LYS 134 HZ3 LYS 134 0.755 -17.454 19.516 1114 H GLU 135 H GLU 135 -0.081 -10.880 15.123 1115 HA GLU 135 HA GLU 135 1.549 -10.337 17.549 1116 1HB GLU 135 HB2 GLU 135 1.354 -8.907 14.884 1117 2HB GLU 135 HB3 GLU 135 2.366 -8.371 16.225 1118 1HG GLU 135 HG2 GLU 135 3.225 -10.885 16.125 1119 2HG GLU 135 HG3 GLU 135 2.675 -10.760 14.454 1120 H LYS 136 H LYS 136 -1.502 -9.656 16.192 1121 HA LYS 136 HA LYS 136 -3.186 -8.139 16.795 1122 1HB LYS 136 HB2 LYS 136 -1.771 -7.782 19.424 1123 2HB LYS 136 HB3 LYS 136 -3.503 -7.874 19.103 1124 1HG LYS 136 HG2 LYS 136 -3.315 -10.250 18.566 1125 2HG LYS 136 HG3 LYS 136 -1.564 -10.182 18.773 1126 1HD LYS 136 HD2 LYS 136 -2.182 -9.241 21.157 1127 2HD LYS 136 HD3 LYS 136 -3.723 -10.043 20.851 1128 1HE LYS 136 HE2 LYS 136 -2.143 -11.544 22.027 1129 2HE LYS 136 HE3 LYS 136 -2.553 -12.164 20.428 1130 1HZ LYS 136 HZ1 LYS 136 -0.199 -10.431 20.789 1131 2HZ LYS 136 HZ2 LYS 136 -0.098 -12.086 21.150 1132 3HZ LYS 136 HZ3 LYS 136 -0.507 -11.584 19.579 1133 H LEU 137 H LEU 137 -1.677 -6.796 15.190 1134 HA LEU 137 HA LEU 137 -0.421 -4.492 16.548 1135 1HB LEU 137 HB2 LEU 137 -0.054 -5.830 14.055 1136 2HB LEU 137 HB3 LEU 137 -0.499 -4.159 13.709 1137 HG LEU 137 HG LEU 137 1.975 -4.503 14.003 1138 1HD1 LEU 137 HD11 LEU 137 0.496 -2.736 15.971 1139 2HD1 LEU 137 HD12 LEU 137 2.227 -2.612 15.660 1140 3HD1 LEU 137 HD13 LEU 137 1.074 -2.292 14.365 1141 1HD2 LEU 137 HD21 LEU 137 1.480 -6.226 15.910 1142 2HD2 LEU 137 HD22 LEU 137 2.883 -5.169 16.066 1143 3HD2 LEU 137 HD23 LEU 137 1.400 -4.800 16.945 1144 H ASN 138 H ASN 138 -2.102 -3.241 17.363 1145 HA ASN 138 HA ASN 138 -3.787 -1.624 17.304 1146 1HB ASN 138 HB2 ASN 138 -2.995 -1.591 14.382 1147 2HB ASN 138 HB3 ASN 138 -4.075 -0.415 15.130 1148 1HD2 ASN 138 HD21 ASN 138 -0.779 -1.131 14.515 1149 2HD2 ASN 138 HD22 ASN 138 -0.097 0.028 15.551 1150 H ILE 139 H ILE 139 -4.783 -2.223 14.056 1151 HA ILE 139 HA ILE 139 -7.442 -2.694 14.530 1152 HB ILE 139 HB ILE 139 -5.794 -4.144 12.439 1153 1HG1 ILE 139 HG12 ILE 139 -7.375 -1.658 11.905 1154 2HG1 ILE 139 HG13 ILE 139 -5.811 -1.491 12.702 1155 1HG2 ILE 139 HG21 ILE 139 -8.172 -4.944 12.879 1156 2HG2 ILE 139 HG22 ILE 139 -8.712 -3.348 12.355 1157 3HG2 ILE 139 HG23 ILE 139 -7.848 -4.398 11.233 1158 1HD1 ILE 139 HD11 ILE 139 -4.997 -3.115 10.794 1159 2HD1 ILE 139 HD12 ILE 139 -6.433 -2.528 9.957 1160 3HD1 ILE 139 HD13 ILE 139 -5.182 -1.393 10.462 1161 H TRP 140 H TRP 140 -4.909 -5.198 14.537 1162 HA TRP 140 HA TRP 140 -6.855 -7.259 15.306 1163 1HB TRP 140 HB2 TRP 140 -3.833 -7.438 15.231 1164 2HB TRP 140 HB3 TRP 140 -4.980 -8.779 15.204 1165 HD1 TRP 140 HD1 TRP 140 -3.205 -6.352 12.993 1166 HE1 TRP 140 HE1 TRP 140 -3.957 -6.671 10.548 1167 HE3 TRP 140 HE3 TRP 140 -7.211 -9.437 13.700 1168 HZ2 TRP 140 HZ2 TRP 140 -5.991 -8.052 9.083 1169 HZ3 TRP 140 HZ3 TRP 140 -8.538 -10.239 11.765 1170 HH2 TRP 140 HH2 TRP 140 -7.934 -9.551 9.460 1171 H SER 141 H SER 141 -6.776 -5.125 17.175 1172 HA SER 141 HA SER 141 -5.027 -5.573 19.382 1173 1HB SER 141 HB2 SER 141 -6.501 -3.547 19.027 1174 2HB SER 141 HB3 SER 141 -7.869 -4.534 19.533 1175 HG SER 141 HG SER 141 -7.074 -3.496 21.331 1176 H GLU 142 H GLU 142 -7.939 -7.210 18.350 1177 HA GLU 142 HA GLU 142 -7.955 -8.761 20.901 1178 1HB GLU 142 HB2 GLU 142 -10.075 -8.817 18.745 1179 2HB GLU 142 HB3 GLU 142 -10.219 -9.344 20.421 1180 1HG GLU 142 HG2 GLU 142 -9.816 -6.977 21.143 1181 2HG GLU 142 HG3 GLU 142 -9.856 -6.498 19.446 1182 H ASP 143 H ASP 143 -8.811 -11.149 20.365 1183 HA ASP 143 HA ASP 143 -6.831 -12.260 18.467 1184 1HB ASP 143 HB2 ASP 143 -7.671 -14.452 19.545 1185 2HB ASP 143 HB3 ASP 143 -6.742 -13.356 20.564 1186 H ASN 144 H ASN 144 -7.783 -14.420 17.392 1187 HA ASN 144 HA ASN 144 -10.320 -13.595 16.044 1188 1HB ASN 144 HB2 ASN 144 -9.384 -15.469 14.377 1189 2HB ASN 144 HB3 ASN 144 -8.845 -13.793 14.278 1190 1HD2 ASN 144 HD21 ASN 144 -7.910 -17.031 15.431 1191 2HD2 ASN 144 HD22 ASN 144 -6.261 -16.672 15.617 1192 H ALA 145 H ALA 145 -8.553 -16.508 17.142 1193 HA ALA 145 HA ALA 145 -10.951 -18.159 17.007 1194 1HB ALA 145 HB1 ALA 145 -8.273 -18.641 18.353 1195 2HB ALA 145 HB2 ALA 145 -9.531 -19.858 18.135 1196 3HB ALA 145 HB3 ALA 145 -8.724 -19.162 16.729 1197 H ASP 146 H ASP 146 -12.519 -18.229 18.550 1198 HA ASP 146 HA ASP 146 -13.549 -18.075 20.660 1199 1HB ASP 146 HB2 ASP 146 -10.787 -17.718 21.835 1200 2HB ASP 146 HB3 ASP 146 -12.223 -18.381 22.615 1201 H SER 147 H SER 147 -14.116 -15.912 19.591 1202 HA SER 147 HA SER 147 -12.810 -13.643 21.031 1203 1HB SER 147 HB2 SER 147 -14.292 -12.402 19.160 1204 2HB SER 147 HB3 SER 147 -12.660 -12.980 18.838 1205 HG SER 147 HG SER 147 -13.703 -14.005 17.295 1206 H GLY 148 H GLY 148 -13.992 -12.652 22.596 1207 1HA GLY 148 HA2 GLY 148 -15.848 -11.949 23.852 1208 2HA GLY 148 HA3 GLY 148 -16.828 -12.204 22.409 1209 H GLN 149 H GLN 149 -18.519 -13.192 23.660 1210 HA GLN 149 HA GLN 149 -18.039 -16.056 24.165 1211 1HB GLN 149 HB2 GLN 149 -17.517 -14.840 26.325 1212 2HB GLN 149 HB3 GLN 149 -19.200 -14.313 26.354 1213 1HG GLN 149 HG2 GLN 149 -20.000 -16.562 26.507 1214 2HG GLN 149 HG3 GLN 149 -18.407 -17.223 26.134 1215 1HE2 GLN 149 HE21 GLN 149 -20.248 -15.485 28.657 1216 2HE2 GLN 149 HE22 GLN 149 -19.199 -15.893 29.929 1217 HN3 PTP 150 H3 PTP 150 -10.053 -3.076 -9.062 1218 1H5M PTP 150 H51 PTP 150 -6.938 -2.566 -5.642 1219 2H5M PTP 150 H52 PTP 150 -7.646 -1.285 -4.629 1220 3H5M PTP 150 H53 PTP 150 -6.631 -0.856 -6.026 1221 H6 PTP 150 H6 PTP 150 -9.415 0.130 -5.539 1222 H1* PTP 150 H1' PTP 150 -12.217 0.660 -7.840 1223 2H2* PTP 150 H2' PTP 150 -12.302 -0.688 -5.144 1224 H3* PTP 150 H3' PTP 150 -13.045 1.293 -4.057 1225 H4* PTP 150 H4' PTP 150 -11.757 3.259 -5.459 1226 2H5* PTP 150 H5' PTP 150 -10.584 0.930 -3.825 Start of MODEL 25 1 1H ALA 1 H1 ALA 1 4.722 -25.732 -20.337 2 2H ALA 1 H2 ALA 1 6.213 -26.490 -20.037 3 3H ALA 1 H3 ALA 1 5.410 -25.676 -18.785 4 HA ALA 1 HA ALA 1 7.373 -24.624 -20.316 5 1HB ALA 1 HB1 ALA 1 5.487 -24.660 -22.128 6 2HB ALA 1 HB2 ALA 1 4.831 -23.293 -21.227 7 3HB ALA 1 HB3 ALA 1 6.447 -23.194 -21.928 8 H THR 2 H THR 2 8.092 -22.909 -19.096 9 HA THR 2 HA THR 2 6.349 -22.007 -16.885 10 HB THR 2 HB THR 2 9.034 -20.810 -17.149 11 HG1 THR 2 HG1 THR 2 9.129 -23.423 -16.293 12 1HG2 THR 2 HG21 THR 2 7.217 -21.106 -15.157 13 2HG2 THR 2 HG22 THR 2 8.248 -22.503 -14.846 14 3HG2 THR 2 HG23 THR 2 8.943 -20.883 -14.868 15 H SER 3 H SER 3 5.088 -20.979 -18.891 16 HA SER 3 HA SER 3 6.210 -18.492 -19.917 17 1HB SER 3 HB2 SER 3 3.403 -19.634 -19.982 18 2HB SER 3 HB3 SER 3 3.876 -18.142 -20.789 19 HG SER 3 HG SER 3 5.656 -19.709 -21.613 20 H THR 4 H THR 4 6.697 -17.210 -18.081 21 HA THR 4 HA THR 4 4.299 -16.043 -16.762 22 HB THR 4 HB THR 4 6.311 -16.079 -14.792 23 HG1 THR 4 HG1 THR 4 7.193 -17.791 -16.154 24 1HG2 THR 4 HG21 THR 4 3.815 -16.249 -14.547 25 2HG2 THR 4 HG22 THR 4 3.930 -17.932 -15.058 26 3HG2 THR 4 HG23 THR 4 4.707 -17.409 -13.563 27 H LYS 5 H LYS 5 7.782 -15.814 -17.420 28 HA LYS 5 HA LYS 5 9.115 -13.930 -17.845 29 1HB LYS 5 HB2 LYS 5 6.438 -13.238 -18.743 30 2HB LYS 5 HB3 LYS 5 7.294 -11.818 -18.141 31 1HG LYS 5 HG2 LYS 5 9.028 -13.508 -19.761 32 2HG LYS 5 HG3 LYS 5 7.605 -12.982 -20.661 33 1HD LYS 5 HD2 LYS 5 8.066 -10.638 -19.989 34 2HD LYS 5 HD3 LYS 5 9.519 -11.179 -19.149 35 1HE LYS 5 HE2 LYS 5 9.712 -12.303 -21.712 36 2HE LYS 5 HE3 LYS 5 9.130 -10.659 -21.978 37 1HZ LYS 5 HZ1 LYS 5 11.085 -10.512 -20.019 38 2HZ LYS 5 HZ2 LYS 5 11.710 -11.523 -21.234 39 3HZ LYS 5 HZ3 LYS 5 11.182 -9.955 -21.618 40 H LYS 6 H LYS 6 10.011 -13.693 -15.771 41 HA LYS 6 HA LYS 6 8.762 -12.780 -13.438 42 1HB LYS 6 HB2 LYS 6 10.978 -12.076 -12.678 43 2HB LYS 6 HB3 LYS 6 11.116 -13.597 -13.563 44 1HG LYS 6 HG2 LYS 6 11.383 -11.787 -15.592 45 2HG LYS 6 HG3 LYS 6 12.141 -10.915 -14.260 46 1HD LYS 6 HD2 LYS 6 13.794 -12.538 -13.961 47 2HD LYS 6 HD3 LYS 6 12.830 -13.802 -14.724 48 1HE LYS 6 HE2 LYS 6 13.958 -13.403 -16.631 49 2HE LYS 6 HE3 LYS 6 13.151 -11.836 -16.704 50 1HZ LYS 6 HZ1 LYS 6 15.062 -11.291 -14.960 51 2HZ LYS 6 HZ2 LYS 6 15.855 -12.499 -15.854 52 3HZ LYS 6 HZ3 LYS 6 15.270 -11.108 -16.633 53 H LEU 7 H LEU 7 8.142 -10.769 -12.670 54 HA LEU 7 HA LEU 7 7.678 -8.664 -14.568 55 1HB LEU 7 HB2 LEU 7 7.284 -9.066 -11.656 56 2HB LEU 7 HB3 LEU 7 7.442 -7.390 -12.182 57 HG LEU 7 HG LEU 7 5.700 -9.040 -13.895 58 1HD1 LEU 7 HD11 LEU 7 5.361 -9.022 -10.994 59 2HD1 LEU 7 HD12 LEU 7 3.965 -8.340 -11.831 60 3HD1 LEU 7 HD13 LEU 7 4.512 -9.973 -12.214 61 1HD2 LEU 7 HD21 LEU 7 5.974 -6.284 -12.884 62 2HD2 LEU 7 HD22 LEU 7 5.362 -6.856 -14.438 63 3HD2 LEU 7 HD23 LEU 7 4.304 -6.833 -13.026 64 H HIS 8 H HIS 8 8.488 -6.339 -14.008 65 HA HIS 8 HA HIS 8 11.402 -6.469 -13.370 66 1HB HIS 8 HB2 HIS 8 11.293 -4.330 -14.999 67 2HB HIS 8 HB3 HIS 8 11.578 -5.956 -15.603 68 HD1 HIS 8 HD1 HIS 8 8.294 -4.340 -14.514 69 HD2 HIS 8 HD2 HIS 8 10.050 -6.025 -17.892 70 HE1 HIS 8 HE1 HIS 8 6.494 -4.408 -16.296 71 H LYS 9 H LYS 9 12.220 -4.711 -12.159 72 HA LYS 9 HA LYS 9 10.111 -3.044 -10.869 73 1HB LYS 9 HB2 LYS 9 12.934 -3.725 -9.990 74 2HB LYS 9 HB3 LYS 9 11.835 -2.670 -9.100 75 1HG LYS 9 HG2 LYS 9 10.371 -5.020 -9.684 76 2HG LYS 9 HG3 LYS 9 11.952 -5.552 -9.108 77 1HD LYS 9 HD2 LYS 9 11.018 -3.342 -7.503 78 2HD LYS 9 HD3 LYS 9 9.796 -4.613 -7.545 79 1HE LYS 9 HE2 LYS 9 11.314 -5.069 -5.704 80 2HE LYS 9 HE3 LYS 9 11.584 -6.273 -6.964 81 1HZ LYS 9 HZ1 LYS 9 13.160 -3.812 -7.061 82 2HZ LYS 9 HZ2 LYS 9 13.561 -4.959 -5.874 83 3HZ LYS 9 HZ3 LYS 9 13.586 -5.390 -7.517 84 H GLU 10 H GLU 10 10.196 -0.823 -11.020 85 HA GLU 10 HA GLU 10 12.476 0.316 -12.590 86 1HB GLU 10 HB2 GLU 10 9.544 0.620 -12.830 87 2HB GLU 10 HB3 GLU 10 10.456 2.128 -12.922 88 1HG GLU 10 HG2 GLU 10 10.645 1.539 -15.127 89 2HG GLU 10 HG3 GLU 10 11.989 0.572 -14.520 90 HA PRO 11 HA PRO 11 13.015 3.275 -9.355 91 1HB PRO 11 HB2 PRO 11 13.784 5.473 -10.783 92 2HB PRO 11 HB3 PRO 11 14.799 4.032 -10.609 93 1HG PRO 11 HG2 PRO 11 13.287 4.985 -12.974 94 2HG PRO 11 HG3 PRO 11 14.713 3.941 -12.898 95 1HD PRO 11 HD2 PRO 11 12.007 3.118 -13.289 96 2HD PRO 11 HD3 PRO 11 13.419 2.068 -13.039 97 H ALA 12 H ALA 12 12.343 5.559 -8.617 98 HA ALA 12 HA ALA 12 10.064 6.806 -9.926 99 1HB ALA 12 HB1 ALA 12 9.013 4.802 -8.845 100 2HB ALA 12 HB2 ALA 12 9.570 5.403 -7.283 101 3HB ALA 12 HB3 ALA 12 8.398 6.331 -8.219 102 H THR 13 H THR 13 9.176 8.598 -8.429 103 HA THR 13 HA THR 13 11.297 9.522 -6.536 104 HB THR 13 HB THR 13 9.874 11.521 -8.253 105 HG1 THR 13 HG1 THR 13 11.509 11.237 -9.816 106 1HG2 THR 13 HG21 THR 13 12.400 11.290 -6.677 107 2HG2 THR 13 HG22 THR 13 12.391 12.373 -8.068 108 3HG2 THR 13 HG23 THR 13 11.242 12.618 -6.752 109 H LEU 14 H LEU 14 10.505 10.564 -4.700 110 HA LEU 14 HA LEU 14 7.625 10.286 -4.204 111 1HB LEU 14 HB2 LEU 14 9.298 9.746 -2.444 112 2HB LEU 14 HB3 LEU 14 9.804 11.436 -2.434 113 HG LEU 14 HG LEU 14 7.442 12.077 -1.876 114 1HD1 LEU 14 HD11 LEU 14 7.137 9.155 -2.203 115 2HD1 LEU 14 HD12 LEU 14 6.339 9.828 -0.782 116 3HD1 LEU 14 HD13 LEU 14 5.943 10.439 -2.388 117 1HD2 LEU 14 HD21 LEU 14 9.375 10.690 -0.192 118 2HD2 LEU 14 HD22 LEU 14 8.406 12.119 0.168 119 3HD2 LEU 14 HD23 LEU 14 7.733 10.510 0.424 120 H ILE 15 H ILE 15 6.184 11.899 -4.579 121 HA ILE 15 HA ILE 15 7.259 14.668 -4.915 122 HB ILE 15 HB ILE 15 4.684 13.458 -5.970 123 1HG1 ILE 15 HG12 ILE 15 7.217 14.254 -7.442 124 2HG1 ILE 15 HG13 ILE 15 6.790 12.593 -7.028 125 1HG2 ILE 15 HG21 ILE 15 5.685 16.193 -5.724 126 2HG2 ILE 15 HG22 ILE 15 5.315 15.764 -7.395 127 3HG2 ILE 15 HG23 ILE 15 4.071 15.626 -6.152 128 1HD1 ILE 15 HD11 ILE 15 4.507 13.253 -8.227 129 2HD1 ILE 15 HD12 ILE 15 5.546 14.426 -9.036 130 3HD1 ILE 15 HD13 ILE 15 5.899 12.703 -9.161 131 H LYS 16 H LYS 16 4.394 12.904 -3.687 132 HA LYS 16 HA LYS 16 4.331 14.499 -1.272 133 1HB LYS 16 HB2 LYS 16 3.402 16.046 -3.119 134 2HB LYS 16 HB3 LYS 16 2.002 14.972 -3.135 135 1HG LYS 16 HG2 LYS 16 1.198 16.221 -1.432 136 2HG LYS 16 HG3 LYS 16 2.423 15.444 -0.428 137 1HD LYS 16 HD2 LYS 16 4.029 17.268 -1.262 138 2HD LYS 16 HD3 LYS 16 2.591 18.106 -1.845 139 1HE LYS 16 HE2 LYS 16 2.504 17.102 0.954 140 2HE LYS 16 HE3 LYS 16 3.564 18.476 0.638 141 1HZ LYS 16 HZ1 LYS 16 1.353 19.163 -0.710 142 2HZ LYS 16 HZ2 LYS 16 0.679 18.321 0.602 143 3HZ LYS 16 HZ3 LYS 16 1.693 19.655 0.877 144 H ALA 17 H ALA 17 3.838 12.798 0.047 145 HA ALA 17 HA ALA 17 2.176 10.584 -0.790 146 1HB ALA 17 HB1 ALA 17 3.961 10.428 0.967 147 2HB ALA 17 HB2 ALA 17 2.942 11.399 2.029 148 3HB ALA 17 HB3 ALA 17 2.402 9.805 1.505 149 H ILE 18 H ILE 18 0.020 10.115 -0.109 150 HA ILE 18 HA ILE 18 -1.495 12.535 0.772 151 HB ILE 18 HB ILE 18 -2.614 10.089 -0.615 152 1HG1 ILE 18 HG12 ILE 18 -1.970 12.720 -1.950 153 2HG1 ILE 18 HG13 ILE 18 -0.788 11.412 -1.891 154 1HG2 ILE 18 HG21 ILE 18 -3.617 12.909 -0.139 155 2HG2 ILE 18 HG22 ILE 18 -4.413 11.752 -1.205 156 3HG2 ILE 18 HG23 ILE 18 -4.288 11.418 0.523 157 1HD1 ILE 18 HD11 ILE 18 -3.371 10.386 -2.692 158 2HD1 ILE 18 HD12 ILE 18 -2.888 11.716 -3.746 159 3HD1 ILE 18 HD13 ILE 18 -1.834 10.315 -3.555 160 H ASP 19 H ASP 19 -1.529 8.963 1.098 161 HA ASP 19 HA ASP 19 -2.279 9.335 3.946 162 1HB ASP 19 HB2 ASP 19 -4.218 8.752 2.062 163 2HB ASP 19 HB3 ASP 19 -3.775 7.156 2.671 164 H GLY 20 H GLY 20 -2.823 6.516 4.319 165 1HA GLY 20 HA2 GLY 20 -0.030 5.557 4.287 166 2HA GLY 20 HA3 GLY 20 -1.370 4.811 5.159 167 H ASP 21 H ASP 21 -2.456 5.481 2.088 168 HA ASP 21 HA ASP 21 -1.414 2.955 0.919 169 1HB ASP 21 HB2 ASP 21 -3.688 2.195 0.361 170 2HB ASP 21 HB3 ASP 21 -3.502 2.356 2.107 171 H THR 22 H THR 22 -1.133 5.876 0.355 172 HA THR 22 HA THR 22 -1.537 5.718 -2.522 173 HB THR 22 HB THR 22 -3.080 7.858 -1.031 174 HG1 THR 22 HG1 THR 22 -4.885 6.652 -1.481 175 1HG2 THR 22 HG21 THR 22 -2.151 8.061 -3.499 176 2HG2 THR 22 HG22 THR 22 -3.528 7.024 -3.872 177 3HG2 THR 22 HG23 THR 22 -3.788 8.594 -3.114 178 H VAL 23 H VAL 23 -0.025 7.026 -3.514 179 HA VAL 23 HA VAL 23 1.015 9.405 -2.135 180 HB VAL 23 HB VAL 23 3.411 8.484 -2.431 181 1HG1 VAL 23 HG11 VAL 23 1.887 8.713 -0.275 182 2HG1 VAL 23 HG12 VAL 23 1.928 6.950 -0.328 183 3HG1 VAL 23 HG13 VAL 23 3.431 7.864 -0.195 184 1HG2 VAL 23 HG21 VAL 23 2.132 6.391 -3.619 185 2HG2 VAL 23 HG22 VAL 23 3.728 6.264 -2.879 186 3HG2 VAL 23 HG23 VAL 23 2.295 5.776 -1.974 187 H LYS 24 H LYS 24 1.592 10.906 -3.654 188 HA LYS 24 HA LYS 24 1.475 10.129 -6.491 189 1HB LYS 24 HB2 LYS 24 2.067 12.847 -5.279 190 2HB LYS 24 HB3 LYS 24 1.579 12.515 -6.941 191 1HG LYS 24 HG2 LYS 24 -0.575 11.599 -6.100 192 2HG LYS 24 HG3 LYS 24 -0.088 12.019 -4.457 193 1HD LYS 24 HD2 LYS 24 -0.324 14.291 -4.815 194 2HD LYS 24 HD3 LYS 24 0.022 14.160 -6.540 195 1HE LYS 24 HE2 LYS 24 -2.452 12.843 -5.503 196 2HE LYS 24 HE3 LYS 24 -2.454 14.599 -5.666 197 1HZ LYS 24 HZ1 LYS 24 -1.711 12.697 -7.822 198 2HZ LYS 24 HZ2 LYS 24 -3.226 13.454 -7.678 199 3HZ LYS 24 HZ3 LYS 24 -1.837 14.385 -7.963 200 H LEU 25 H LEU 25 3.317 9.304 -7.392 201 HA LEU 25 HA LEU 25 5.921 10.458 -6.474 202 1HB LEU 25 HB2 LEU 25 5.806 7.790 -7.820 203 2HB LEU 25 HB3 LEU 25 6.910 8.372 -6.574 204 HG LEU 25 HG LEU 25 3.973 7.838 -6.064 205 1HD1 LEU 25 HD11 LEU 25 6.361 6.036 -6.031 206 2HD1 LEU 25 HD12 LEU 25 5.152 5.835 -4.763 207 3HD1 LEU 25 HD13 LEU 25 4.689 5.672 -6.457 208 1HD2 LEU 25 HD21 LEU 25 6.245 8.894 -4.532 209 2HD2 LEU 25 HD22 LEU 25 4.517 8.998 -4.190 210 3HD2 LEU 25 HD23 LEU 25 5.425 7.559 -3.721 211 H MET 26 H MET 26 7.541 9.443 -8.464 212 HA MET 26 HA MET 26 6.422 10.662 -10.951 213 1HB MET 26 HB2 MET 26 8.201 12.020 -9.656 214 2HB MET 26 HB3 MET 26 9.340 10.782 -10.186 215 1HG MET 26 HG2 MET 26 8.707 11.212 -12.539 216 2HG MET 26 HG3 MET 26 7.587 12.464 -12.002 217 1HE MET 26 HE1 MET 26 7.901 14.334 -11.056 218 2HE MET 26 HE2 MET 26 9.361 15.265 -10.735 219 3HE MET 26 HE3 MET 26 8.716 15.163 -12.379 220 H TYR 27 H TYR 27 6.677 9.438 -12.769 221 HA TYR 27 HA TYR 27 8.532 7.101 -12.653 222 1HB TYR 27 HB2 TYR 27 6.228 6.317 -12.243 223 2HB TYR 27 HB3 TYR 27 5.687 7.125 -13.714 224 HD1 TYR 27 HD1 TYR 27 8.129 4.556 -12.499 225 HD2 TYR 27 HD2 TYR 27 5.750 6.001 -15.771 226 HE1 TYR 27 HE1 TYR 27 8.743 2.555 -13.829 227 HE2 TYR 27 HE2 TYR 27 6.366 4.001 -17.102 228 HH TYR 27 HH TYR 27 7.134 1.528 -16.449 229 H LYS 28 H LYS 28 9.895 7.131 -14.391 230 HA LYS 28 HA LYS 28 10.845 7.931 -16.395 231 1HB LYS 28 HB2 LYS 28 8.140 6.843 -16.990 232 2HB LYS 28 HB3 LYS 28 8.925 7.765 -18.274 233 1HG LYS 28 HG2 LYS 28 11.016 6.271 -17.584 234 2HG LYS 28 HG3 LYS 28 9.750 5.179 -17.021 235 1HD LYS 28 HD2 LYS 28 8.684 5.702 -19.379 236 2HD LYS 28 HD3 LYS 28 10.346 6.112 -19.804 237 1HE LYS 28 HE2 LYS 28 10.832 3.790 -18.569 238 2HE LYS 28 HE3 LYS 28 9.173 3.467 -19.074 239 1HZ LYS 28 HZ1 LYS 28 10.529 4.664 -21.209 240 2HZ LYS 28 HZ2 LYS 28 11.499 3.397 -20.626 241 3HZ LYS 28 HZ3 LYS 28 9.904 3.088 -21.113 242 H GLY 29 H GLY 29 9.685 9.993 -14.660 243 1HA GLY 29 HA2 GLY 29 9.499 12.339 -14.877 244 2HA GLY 29 HA3 GLY 29 9.576 12.147 -16.629 245 H GLN 30 H GLN 30 7.297 10.759 -14.257 246 HA GLN 30 HA GLN 30 5.122 12.408 -15.396 247 1HB GLN 30 HB2 GLN 30 5.334 10.296 -16.784 248 2HB GLN 30 HB3 GLN 30 4.905 9.390 -15.333 249 1HG GLN 30 HG2 GLN 30 2.823 10.814 -15.168 250 2HG GLN 30 HG3 GLN 30 3.224 11.469 -16.756 251 1HE2 GLN 30 HE21 GLN 30 0.914 10.267 -17.006 252 2HE2 GLN 30 HE22 GLN 30 1.016 8.672 -17.578 253 HA PRO 31 HA PRO 31 4.515 12.047 -10.913 254 1HB PRO 31 HB2 PRO 31 2.890 14.248 -10.776 255 2HB PRO 31 HB3 PRO 31 4.659 14.352 -10.818 256 1HG PRO 31 HG2 PRO 31 2.691 14.785 -13.042 257 2HG PRO 31 HG3 PRO 31 4.185 15.668 -12.678 258 1HD PRO 31 HD2 PRO 31 4.029 13.752 -14.639 259 2HD PRO 31 HD3 PRO 31 5.526 14.107 -13.746 260 H MET 32 H MET 32 3.179 10.220 -10.771 261 HA MET 32 HA MET 32 0.274 10.701 -11.298 262 1HB MET 32 HB2 MET 32 1.833 8.982 -12.781 263 2HB MET 32 HB3 MET 32 1.173 7.909 -11.547 264 1HG MET 32 HG2 MET 32 -1.110 8.904 -12.076 265 2HG MET 32 HG3 MET 32 -0.360 9.661 -13.480 266 1HE MET 32 HE1 MET 32 -1.204 6.486 -11.578 267 2HE MET 32 HE2 MET 32 -0.684 5.157 -12.624 268 3HE MET 32 HE3 MET 32 0.512 6.180 -11.834 269 H THR 33 H THR 33 -1.151 9.578 -9.844 270 HA THR 33 HA THR 33 -0.032 9.211 -7.179 271 HB THR 33 HB THR 33 -2.816 8.373 -7.948 272 HG1 THR 33 HG1 THR 33 -3.405 10.386 -8.264 273 1HG2 THR 33 HG21 THR 33 -1.577 9.744 -5.548 274 2HG2 THR 33 HG22 THR 33 -3.294 9.384 -5.718 275 3HG2 THR 33 HG23 THR 33 -2.121 8.069 -5.632 276 H PHE 34 H PHE 34 -0.190 7.193 -5.959 277 HA PHE 34 HA PHE 34 -0.476 4.746 -7.633 278 1HB PHE 34 HB2 PHE 34 1.916 5.606 -6.027 279 2HB PHE 34 HB3 PHE 34 1.560 3.890 -6.222 280 HD1 PHE 34 HD1 PHE 34 2.403 7.025 -8.007 281 HD2 PHE 34 HD2 PHE 34 1.795 2.786 -8.354 282 HE1 PHE 34 HE1 PHE 34 3.403 7.066 -10.280 283 HE2 PHE 34 HE2 PHE 34 2.792 2.827 -10.623 284 HZ PHE 34 HZ PHE 34 3.593 4.966 -11.586 285 H ARG 35 H ARG 35 -1.177 2.907 -6.440 286 HA ARG 35 HA ARG 35 -1.902 3.465 -3.592 287 1HB ARG 35 HB2 ARG 35 -3.565 2.527 -5.869 288 2HB ARG 35 HB3 ARG 35 -3.830 1.719 -4.324 289 1HG ARG 35 HG2 ARG 35 -3.584 4.577 -3.937 290 2HG ARG 35 HG3 ARG 35 -4.847 4.222 -5.117 291 1HD ARG 35 HD2 ARG 35 -4.620 3.197 -2.281 292 2HD ARG 35 HD3 ARG 35 -5.919 4.162 -2.983 293 HE ARG 35 HE ARG 35 -5.701 1.289 -3.126 294 1HH1 ARG 35 HH11 ARG 35 -7.894 3.599 -3.658 295 2HH1 ARG 35 HH12 ARG 35 -8.492 3.017 -5.174 296 1HH2 ARG 35 HH21 ARG 35 -5.906 0.751 -5.625 297 2HH2 ARG 35 HH22 ARG 35 -7.365 1.408 -6.289 298 H LEU 36 H LEU 36 -2.372 1.332 -2.405 299 HA LEU 36 HA LEU 36 -0.150 -0.522 -2.994 300 1HB LEU 36 HB2 LEU 36 -2.113 -0.507 -0.681 301 2HB LEU 36 HB3 LEU 36 -0.631 -1.459 -0.785 302 HG LEU 36 HG LEU 36 -0.740 1.572 -0.852 303 1HD1 LEU 36 HD11 LEU 36 -0.087 -0.385 1.367 304 2HD1 LEU 36 HD12 LEU 36 0.337 1.326 1.426 305 3HD1 LEU 36 HD13 LEU 36 -1.357 0.839 1.359 306 1HD2 LEU 36 HD21 LEU 36 1.244 -0.262 -1.678 307 2HD2 LEU 36 HD22 LEU 36 1.435 1.475 -1.441 308 3HD2 LEU 36 HD23 LEU 36 1.784 0.361 -0.119 309 H LEU 37 H LEU 37 -0.457 -2.496 -3.929 310 HA LEU 37 HA LEU 37 -3.213 -3.272 -4.654 311 1HB LEU 37 HB2 LEU 37 -0.502 -3.834 -5.652 312 2HB LEU 37 HB3 LEU 37 -1.579 -5.230 -5.663 313 HG LEU 37 HG LEU 37 -2.403 -2.543 -6.775 314 1HD1 LEU 37 HD11 LEU 37 -0.622 -4.598 -7.898 315 2HD1 LEU 37 HD12 LEU 37 -1.985 -4.196 -8.942 316 3HD1 LEU 37 HD13 LEU 37 -0.878 -2.930 -8.411 317 1HD2 LEU 37 HD21 LEU 37 -3.939 -4.656 -6.109 318 2HD2 LEU 37 HD22 LEU 37 -4.300 -3.630 -7.496 319 3HD2 LEU 37 HD23 LEU 37 -3.459 -5.161 -7.729 320 H LEU 38 H LEU 38 -4.236 -5.125 -3.907 321 HA LEU 38 HA LEU 38 -4.616 -7.031 -2.586 322 1HB LEU 38 HB2 LEU 38 -1.647 -7.092 -2.031 323 2HB LEU 38 HB3 LEU 38 -2.784 -8.441 -2.029 324 HG LEU 38 HG LEU 38 -1.817 -6.858 -4.422 325 1HD1 LEU 38 HD11 LEU 38 -0.954 -9.251 -3.162 326 2HD1 LEU 38 HD12 LEU 38 -1.748 -9.723 -4.664 327 3HD1 LEU 38 HD13 LEU 38 -0.401 -8.585 -4.699 328 1HD2 LEU 38 HD21 LEU 38 -4.301 -8.369 -3.975 329 2HD2 LEU 38 HD22 LEU 38 -3.896 -7.229 -5.258 330 3HD2 LEU 38 HD23 LEU 38 -3.388 -8.913 -5.382 331 H VAL 39 H VAL 39 -3.606 -4.106 -1.521 332 HA VAL 39 HA VAL 39 -4.260 -4.820 1.275 333 HB VAL 39 HB VAL 39 -1.946 -4.907 1.554 334 1HG1 VAL 39 HG11 VAL 39 -1.900 -2.852 -0.641 335 2HG1 VAL 39 HG12 VAL 39 -0.492 -3.066 0.401 336 3HG1 VAL 39 HG13 VAL 39 -1.088 -4.415 -0.568 337 1HG2 VAL 39 HG21 VAL 39 -2.621 -1.964 1.865 338 2HG2 VAL 39 HG22 VAL 39 -2.857 -3.215 3.086 339 3HG2 VAL 39 HG23 VAL 39 -1.227 -2.767 2.586 340 H ASP 40 H ASP 40 -4.582 -2.749 2.580 341 HA ASP 40 HA ASP 40 -5.008 -0.265 1.138 342 1HB ASP 40 HB2 ASP 40 -6.974 -1.836 0.491 343 2HB ASP 40 HB3 ASP 40 -7.534 -1.571 2.143 344 H THR 41 H THR 41 -5.704 1.442 2.595 345 HA THR 41 HA THR 41 -5.635 0.662 5.482 346 HB THR 41 HB THR 41 -4.234 2.557 5.974 347 HG1 THR 41 HG1 THR 41 -5.154 3.375 3.539 348 1HG2 THR 41 HG21 THR 41 -3.450 0.509 4.121 349 2HG2 THR 41 HG22 THR 41 -2.575 1.993 3.744 350 3HG2 THR 41 HG23 THR 41 -2.478 1.299 5.363 351 HA PRO 42 HA PRO 42 -9.239 3.154 5.922 352 1HB PRO 42 HB2 PRO 42 -8.937 3.985 8.510 353 2HB PRO 42 HB3 PRO 42 -9.348 2.316 8.072 354 1HG PRO 42 HG2 PRO 42 -6.726 3.443 8.962 355 2HG PRO 42 HG3 PRO 42 -7.426 1.844 9.267 356 1HD PRO 42 HD2 PRO 42 -5.466 2.375 7.359 357 2HD PRO 42 HD3 PRO 42 -6.542 0.961 7.338 358 H GLU 43 H GLU 43 -9.452 5.130 4.940 359 HA GLU 43 HA GLU 43 -7.408 7.175 5.093 360 1HB GLU 43 HB2 GLU 43 -8.891 8.497 3.714 361 2HB GLU 43 HB3 GLU 43 -8.966 6.831 3.141 362 1HG GLU 43 HG2 GLU 43 -11.199 6.925 3.413 363 2HG GLU 43 HG3 GLU 43 -10.915 6.988 5.153 364 H THR 44 H THR 44 -8.668 9.558 5.479 365 HA THR 44 HA THR 44 -10.334 9.559 7.864 366 HB THR 44 HB THR 44 -8.445 9.142 9.169 367 HG1 THR 44 HG1 THR 44 -9.085 11.004 10.025 368 1HG2 THR 44 HG21 THR 44 -6.859 10.843 7.226 369 2HG2 THR 44 HG22 THR 44 -6.197 10.004 8.629 370 3HG2 THR 44 HG23 THR 44 -6.862 9.081 7.280 371 H LYS 45 H LYS 45 -11.349 10.847 6.016 372 HA LYS 45 HA LYS 45 -10.155 13.508 5.566 373 1HB LYS 45 HB2 LYS 45 -12.005 11.818 4.174 374 2HB LYS 45 HB3 LYS 45 -12.800 13.354 4.518 375 1HG LYS 45 HG2 LYS 45 -11.394 14.541 3.161 376 2HG LYS 45 HG3 LYS 45 -9.999 13.536 3.557 377 1HD LYS 45 HD2 LYS 45 -10.325 12.217 1.756 378 2HD LYS 45 HD3 LYS 45 -12.041 12.035 2.118 379 1HE LYS 45 HE2 LYS 45 -11.841 13.149 -0.025 380 2HE LYS 45 HE3 LYS 45 -12.422 14.325 1.155 381 1HZ LYS 45 HZ1 LYS 45 -9.692 14.456 1.317 382 2HZ LYS 45 HZ2 LYS 45 -10.001 14.319 -0.348 383 3HZ LYS 45 HZ3 LYS 45 -10.710 15.575 0.549 384 H HIS 46 H HIS 46 -10.545 13.483 8.175 385 HA HIS 46 HA HIS 46 -13.080 15.021 8.564 386 1HB HIS 46 HB2 HIS 46 -12.172 12.607 9.915 387 2HB HIS 46 HB3 HIS 46 -12.427 13.929 11.056 388 HD1 HIS 46 HD1 HIS 46 -14.284 11.255 10.214 389 HD2 HIS 46 HD2 HIS 46 -15.078 15.310 9.659 390 HE1 HIS 46 HE1 HIS 46 -16.797 11.467 9.976 391 HA PRO 47 HA PRO 47 -9.699 17.762 9.882 392 1HB PRO 47 HB2 PRO 47 -10.951 20.039 9.046 393 2HB PRO 47 HB3 PRO 47 -10.037 18.986 7.953 394 1HG PRO 47 HG2 PRO 47 -12.982 19.308 8.228 395 2HG PRO 47 HG3 PRO 47 -12.027 18.846 6.810 396 1HD PRO 47 HD2 PRO 47 -13.479 17.088 8.484 397 2HD PRO 47 HD3 PRO 47 -12.275 16.620 7.264 398 H LYS 48 H LYS 48 -11.606 16.688 11.744 399 HA LYS 48 HA LYS 48 -12.048 19.100 13.419 400 1HB LYS 48 HB2 LYS 48 -14.146 17.097 12.587 401 2HB LYS 48 HB3 LYS 48 -14.300 18.009 14.088 402 1HG LYS 48 HG2 LYS 48 -14.684 19.989 13.007 403 2HG LYS 48 HG3 LYS 48 -13.602 19.588 11.672 404 1HD LYS 48 HD2 LYS 48 -15.472 17.765 11.165 405 2HD LYS 48 HD3 LYS 48 -16.490 18.908 12.042 406 1HE LYS 48 HE2 LYS 48 -14.693 20.119 10.028 407 2HE LYS 48 HE3 LYS 48 -15.971 19.093 9.374 408 1HZ LYS 48 HZ1 LYS 48 -17.431 20.416 11.047 409 2HZ LYS 48 HZ2 LYS 48 -16.190 21.571 10.933 410 3HZ LYS 48 HZ3 LYS 48 -17.040 21.092 9.542 411 H LYS 49 H LYS 49 -12.831 15.607 13.583 412 HA LYS 49 HA LYS 49 -11.199 15.505 16.091 413 1HB LYS 49 HB2 LYS 49 -13.920 14.514 15.455 414 2HB LYS 49 HB3 LYS 49 -12.895 13.395 16.354 415 1HG LYS 49 HG2 LYS 49 -12.818 16.193 17.307 416 2HG LYS 49 HG3 LYS 49 -14.366 15.375 17.520 417 1HD LYS 49 HD2 LYS 49 -12.277 13.552 18.238 418 2HD LYS 49 HD3 LYS 49 -12.004 15.076 19.084 419 1HE LYS 49 HE2 LYS 49 -13.457 13.929 20.532 420 2HE LYS 49 HE3 LYS 49 -14.552 14.968 19.618 421 1HZ LYS 49 HZ1 LYS 49 -14.911 13.083 18.087 422 2HZ LYS 49 HZ2 LYS 49 -13.980 12.101 19.109 423 3HZ LYS 49 HZ3 LYS 49 -15.439 12.766 19.670 424 H GLY 50 H GLY 50 -11.981 14.031 13.021 425 1HA GLY 50 HA2 GLY 50 -10.593 12.557 11.779 426 2HA GLY 50 HA3 GLY 50 -9.551 12.392 13.194 427 H VAL 51 H VAL 51 -9.835 10.036 12.267 428 HA VAL 51 HA VAL 51 -12.351 8.757 13.116 429 HB VAL 51 HB VAL 51 -9.855 7.357 12.145 430 1HG1 VAL 51 HG11 VAL 51 -12.286 6.413 13.051 431 2HG1 VAL 51 HG12 VAL 51 -12.527 6.464 11.305 432 3HG1 VAL 51 HG13 VAL 51 -11.192 5.532 11.985 433 1HG2 VAL 51 HG21 VAL 51 -12.012 8.777 10.560 434 2HG2 VAL 51 HG22 VAL 51 -10.271 9.044 10.483 435 3HG2 VAL 51 HG23 VAL 51 -10.962 7.546 9.860 436 H GLU 52 H GLU 52 -9.171 9.341 14.360 437 HA GLU 52 HA GLU 52 -8.181 8.748 16.401 438 1HB GLU 52 HB2 GLU 52 -11.073 8.812 16.865 439 2HB GLU 52 HB3 GLU 52 -10.231 7.720 17.967 440 1HG GLU 52 HG2 GLU 52 -9.429 9.466 19.135 441 2HG GLU 52 HG3 GLU 52 -8.696 10.135 17.678 442 H LYS 53 H LYS 53 -7.532 6.842 17.645 443 HA LYS 53 HA LYS 53 -7.219 4.525 17.981 444 1HB LYS 53 HB2 LYS 53 -9.852 4.665 17.046 445 2HB LYS 53 HB3 LYS 53 -9.064 3.516 15.965 446 1HG LYS 53 HG2 LYS 53 -9.626 2.069 17.667 447 2HG LYS 53 HG3 LYS 53 -8.065 2.616 18.280 448 1HD LYS 53 HD2 LYS 53 -9.814 4.571 19.182 449 2HD LYS 53 HD3 LYS 53 -10.749 3.084 19.352 450 1HE LYS 53 HE2 LYS 53 -9.553 3.271 21.393 451 2HE LYS 53 HE3 LYS 53 -8.639 2.092 20.451 452 1HZ LYS 53 HZ1 LYS 53 -7.834 4.787 19.925 453 2HZ LYS 53 HZ2 LYS 53 -7.646 4.373 21.558 454 3HZ LYS 53 HZ3 LYS 53 -6.893 3.440 20.354 455 H TYR 54 H TYR 54 -8.284 4.477 14.578 456 HA TYR 54 HA TYR 54 -5.446 3.891 13.831 457 1HB TYR 54 HB2 TYR 54 -7.915 2.779 12.467 458 2HB TYR 54 HB3 TYR 54 -6.238 2.317 12.180 459 HD1 TYR 54 HD1 TYR 54 -5.212 2.217 14.979 460 HD2 TYR 54 HD2 TYR 54 -8.893 0.784 13.291 461 HE1 TYR 54 HE1 TYR 54 -5.370 0.510 16.772 462 HE2 TYR 54 HE2 TYR 54 -9.052 -0.922 15.084 463 HH TYR 54 HH TYR 54 -8.135 -1.742 16.925 464 H GLY 55 H GLY 55 -6.789 6.489 13.845 465 1HA GLY 55 HA2 GLY 55 -7.336 7.045 10.993 466 2HA GLY 55 HA3 GLY 55 -7.502 8.195 12.320 467 HA PRO 56 HA PRO 56 -3.573 9.899 11.312 468 1HB PRO 56 HB2 PRO 56 -2.850 10.863 13.764 469 2HB PRO 56 HB3 PRO 56 -4.133 11.592 12.781 470 1HG PRO 56 HG2 PRO 56 -4.366 9.834 15.187 471 2HG PRO 56 HG3 PRO 56 -5.410 11.164 14.660 472 1HD PRO 56 HD2 PRO 56 -5.989 8.459 14.310 473 2HD PRO 56 HD3 PRO 56 -6.716 9.782 13.370 474 H GLU 57 H GLU 57 -2.738 7.576 11.000 475 HA GLU 57 HA GLU 57 -0.338 7.209 12.596 476 1HB GLU 57 HB2 GLU 57 -2.773 5.668 13.220 477 2HB GLU 57 HB3 GLU 57 -1.338 4.675 12.951 478 1HG GLU 57 HG2 GLU 57 -0.471 6.855 14.515 479 2HG GLU 57 HG3 GLU 57 -1.997 6.332 15.230 480 H ALA 58 H ALA 58 -2.635 5.610 10.374 481 HA ALA 58 HA ALA 58 -0.630 3.974 9.104 482 1HB ALA 58 HB1 ALA 58 -3.143 3.616 9.007 483 2HB ALA 58 HB2 ALA 58 -3.214 4.958 7.864 484 3HB ALA 58 HB3 ALA 58 -2.318 3.496 7.454 485 H SER 59 H SER 59 -2.230 7.003 8.070 486 HA SER 59 HA SER 59 -0.651 7.391 5.731 487 1HB SER 59 HB2 SER 59 -2.465 8.823 5.748 488 2HB SER 59 HB3 SER 59 -2.345 9.121 7.480 489 HG SER 59 HG SER 59 -1.072 10.747 7.086 490 H ALA 60 H ALA 60 0.065 7.836 9.093 491 HA ALA 60 HA ALA 60 2.285 9.679 8.674 492 1HB ALA 60 HB1 ALA 60 1.044 8.262 10.961 493 2HB ALA 60 HB2 ALA 60 2.770 8.588 11.118 494 3HB ALA 60 HB3 ALA 60 1.642 9.917 10.854 495 H PHE 61 H PHE 61 1.870 6.191 8.916 496 HA PHE 61 HA PHE 61 4.675 5.564 9.161 497 1HB PHE 61 HB2 PHE 61 2.884 3.955 9.748 498 2HB PHE 61 HB3 PHE 61 2.412 3.875 8.051 499 HD1 PHE 61 HD1 PHE 61 4.094 3.045 6.341 500 HD2 PHE 61 HD2 PHE 61 4.714 2.682 10.577 501 HE1 PHE 61 HE1 PHE 61 5.824 1.315 5.940 502 HE2 PHE 61 HE2 PHE 61 6.444 0.952 10.174 503 HZ PHE 61 HZ PHE 61 6.999 0.268 7.856 504 H THR 62 H THR 62 2.459 5.838 6.403 505 HA THR 62 HA THR 62 4.523 5.121 4.469 506 HB THR 62 HB THR 62 1.925 6.556 3.886 507 HG1 THR 62 HG1 THR 62 2.445 3.955 4.715 508 1HG2 THR 62 HG21 THR 62 4.055 5.613 2.293 509 2HG2 THR 62 HG22 THR 62 2.731 4.469 2.063 510 3HG2 THR 62 HG23 THR 62 2.479 6.185 1.740 511 H LYS 63 H LYS 63 3.270 8.087 5.870 512 HA LYS 63 HA LYS 63 4.408 9.889 3.939 513 1HB LYS 63 HB2 LYS 63 2.676 10.699 5.399 514 2HB LYS 63 HB3 LYS 63 3.597 10.246 6.832 515 1HG LYS 63 HG2 LYS 63 5.316 11.898 6.297 516 2HG LYS 63 HG3 LYS 63 4.484 12.313 4.798 517 1HD LYS 63 HD2 LYS 63 2.462 12.906 6.234 518 2HD LYS 63 HD3 LYS 63 3.531 12.774 7.632 519 1HE LYS 63 HE2 LYS 63 4.943 14.350 5.791 520 2HE LYS 63 HE3 LYS 63 3.284 14.943 5.717 521 1HZ LYS 63 HZ1 LYS 63 4.503 14.420 8.337 522 2HZ LYS 63 HZ2 LYS 63 4.918 15.840 7.509 523 3HZ LYS 63 HZ3 LYS 63 3.295 15.537 7.911 524 H LYS 64 H LYS 64 5.566 8.720 7.095 525 HA LYS 64 HA LYS 64 8.081 10.164 6.893 526 1HB LYS 64 HB2 LYS 64 6.694 8.657 8.879 527 2HB LYS 64 HB3 LYS 64 8.292 7.938 8.680 528 1HG LYS 64 HG2 LYS 64 8.334 9.744 10.365 529 2HG LYS 64 HG3 LYS 64 9.335 10.151 8.970 530 1HD LYS 64 HD2 LYS 64 8.165 12.099 8.962 531 2HD LYS 64 HD3 LYS 64 6.893 11.141 8.201 532 1HE LYS 64 HE2 LYS 64 6.257 10.548 10.687 533 2HE LYS 64 HE3 LYS 64 7.141 12.028 11.059 534 1HZ LYS 64 HZ1 LYS 64 5.319 12.274 8.843 535 2HZ LYS 64 HZ2 LYS 64 4.553 11.917 10.317 536 3HZ LYS 64 HZ3 LYS 64 5.543 13.291 10.181 537 H MET 65 H MET 65 6.985 6.905 6.092 538 HA MET 65 HA MET 65 9.559 5.727 5.719 539 1HB MET 65 HB2 MET 65 6.793 5.044 5.152 540 2HB MET 65 HB3 MET 65 7.860 4.533 3.842 541 1HG MET 65 HG2 MET 65 8.683 4.005 6.678 542 2HG MET 65 HG3 MET 65 7.479 2.957 5.927 543 1HE MET 65 HE1 MET 65 8.448 1.162 6.219 544 2HE MET 65 HE2 MET 65 8.989 0.446 4.695 545 3HE MET 65 HE3 MET 65 10.137 0.713 6.004 546 H VAL 66 H VAL 66 7.320 6.733 3.129 547 HA VAL 66 HA VAL 66 9.267 6.704 1.070 548 HB VAL 66 HB VAL 66 7.662 8.247 -0.133 549 1HG1 VAL 66 HG11 VAL 66 7.457 5.757 -0.146 550 2HG1 VAL 66 HG12 VAL 66 6.405 5.865 1.266 551 3HG1 VAL 66 HG13 VAL 66 5.894 6.565 -0.271 552 1HG2 VAL 66 HG21 VAL 66 6.770 8.602 2.608 553 2HG2 VAL 66 HG22 VAL 66 6.327 9.520 1.169 554 3HG2 VAL 66 HG23 VAL 66 5.443 8.052 1.586 555 H GLU 67 H GLU 67 8.377 9.266 3.350 556 HA GLU 67 HA GLU 67 9.742 11.411 2.075 557 1HB GLU 67 HB2 GLU 67 8.819 10.817 4.841 558 2HB GLU 67 HB3 GLU 67 10.044 12.075 4.667 559 1HG GLU 67 HG2 GLU 67 8.375 12.781 2.657 560 2HG GLU 67 HG3 GLU 67 7.214 12.051 3.765 561 H ASN 68 H ASN 68 10.911 8.855 4.217 562 HA ASN 68 HA ASN 68 13.668 9.970 3.975 563 1HB ASN 68 HB2 ASN 68 12.581 7.794 5.791 564 2HB ASN 68 HB3 ASN 68 14.236 8.407 5.804 565 1HD2 ASN 68 HD21 ASN 68 11.465 8.689 7.530 566 2HD2 ASN 68 HD22 ASN 68 11.589 10.301 8.046 567 H ALA 69 H ALA 69 11.766 7.979 2.250 568 HA ALA 69 HA ALA 69 13.301 5.580 1.965 569 1HB ALA 69 HB1 ALA 69 11.346 7.030 0.183 570 2HB ALA 69 HB2 ALA 69 12.172 5.574 -0.372 571 3HB ALA 69 HB3 ALA 69 11.126 5.509 1.047 572 H LYS 70 H LYS 70 15.367 5.449 1.237 573 HA LYS 70 HA LYS 70 16.576 7.670 -0.235 574 1HB LYS 70 HB2 LYS 70 17.624 4.943 0.579 575 2HB LYS 70 HB3 LYS 70 18.595 6.158 -0.252 576 1HG LYS 70 HG2 LYS 70 17.553 7.648 1.781 577 2HG LYS 70 HG3 LYS 70 17.688 6.072 2.563 578 1HD LYS 70 HD2 LYS 70 20.072 5.971 1.671 579 2HD LYS 70 HD3 LYS 70 19.890 7.672 1.239 580 1HE LYS 70 HE2 LYS 70 20.568 8.124 3.348 581 2HE LYS 70 HE3 LYS 70 18.965 7.589 3.851 582 1HZ LYS 70 HZ1 LYS 70 21.185 5.679 3.452 583 2HZ LYS 70 HZ2 LYS 70 20.956 6.480 4.933 584 3HZ LYS 70 HZ3 LYS 70 19.746 5.458 4.321 585 H LYS 71 H LYS 71 14.935 4.752 -1.028 586 HA LYS 71 HA LYS 71 15.451 5.268 -3.898 587 1HB LYS 71 HB2 LYS 71 16.347 2.860 -2.391 588 2HB LYS 71 HB3 LYS 71 15.624 2.582 -3.976 589 1HG LYS 71 HG2 LYS 71 17.505 3.274 -4.995 590 2HG LYS 71 HG3 LYS 71 17.432 4.815 -4.139 591 1HD LYS 71 HD2 LYS 71 19.118 4.199 -2.783 592 2HD LYS 71 HD3 LYS 71 18.265 2.723 -2.330 593 1HE LYS 71 HE2 LYS 71 19.382 1.442 -3.866 594 2HE LYS 71 HE3 LYS 71 19.480 2.753 -5.041 595 1HZ LYS 71 HZ1 LYS 71 20.987 3.096 -2.574 596 2HZ LYS 71 HZ2 LYS 71 21.561 1.912 -3.650 597 3HZ LYS 71 HZ3 LYS 71 21.395 3.523 -4.165 598 H ILE 72 H ILE 72 13.504 5.221 -4.907 599 HA ILE 72 HA ILE 72 11.352 3.518 -3.711 600 HB ILE 72 HB ILE 72 11.099 6.200 -5.107 601 1HG1 ILE 72 HG12 ILE 72 10.656 5.322 -2.235 602 2HG1 ILE 72 HG13 ILE 72 11.917 6.409 -2.814 603 1HG2 ILE 72 HG21 ILE 72 9.267 4.331 -5.387 604 2HG2 ILE 72 HG22 ILE 72 8.859 4.753 -3.723 605 3HG2 ILE 72 HG23 ILE 72 8.779 5.979 -4.988 606 1HD1 ILE 72 HD11 ILE 72 9.830 7.744 -3.787 607 2HD1 ILE 72 HD12 ILE 72 8.988 6.911 -2.480 608 3HD1 ILE 72 HD13 ILE 72 10.354 7.966 -2.117 609 H GLU 73 H GLU 73 10.775 1.894 -5.073 610 HA GLU 73 HA GLU 73 11.064 2.381 -8.012 611 1HB GLU 73 HB2 GLU 73 11.573 -0.140 -6.409 612 2HB GLU 73 HB3 GLU 73 11.458 -0.116 -8.170 613 1HG GLU 73 HG2 GLU 73 13.217 1.921 -7.760 614 2HG GLU 73 HG3 GLU 73 13.624 0.866 -6.407 615 H VAL 74 H VAL 74 9.392 1.563 -9.333 616 HA VAL 74 HA VAL 74 6.975 0.594 -7.857 617 HB VAL 74 HB VAL 74 5.756 1.671 -9.890 618 1HG1 VAL 74 HG11 VAL 74 7.130 3.273 -7.716 619 2HG1 VAL 74 HG12 VAL 74 5.867 3.934 -8.755 620 3HG1 VAL 74 HG13 VAL 74 5.506 2.587 -7.675 621 1HG2 VAL 74 HG21 VAL 74 8.456 3.054 -9.974 622 2HG2 VAL 74 HG22 VAL 74 7.737 2.083 -11.259 623 3HG2 VAL 74 HG23 VAL 74 7.013 3.628 -10.811 624 H GLU 75 H GLU 75 6.055 -1.283 -8.648 625 HA GLU 75 HA GLU 75 7.067 -2.289 -11.276 626 1HB GLU 75 HB2 GLU 75 8.186 -3.472 -9.396 627 2HB GLU 75 HB3 GLU 75 6.605 -3.952 -8.781 628 1HG GLU 75 HG2 GLU 75 6.730 -4.609 -11.567 629 2HG GLU 75 HG3 GLU 75 8.169 -5.252 -10.775 630 H PHE 76 H PHE 76 5.136 -1.746 -12.362 631 HA PHE 76 HA PHE 76 2.507 -2.228 -11.371 632 1HB PHE 76 HB2 PHE 76 3.484 -2.195 -14.246 633 2HB PHE 76 HB3 PHE 76 1.801 -2.059 -13.736 634 HD1 PHE 76 HD1 PHE 76 1.002 -0.059 -12.528 635 HD2 PHE 76 HD2 PHE 76 5.036 -0.352 -13.976 636 HE1 PHE 76 HE1 PHE 76 1.291 2.386 -12.219 637 HE2 PHE 76 HE2 PHE 76 5.324 2.093 -13.667 638 HZ PHE 76 HZ PHE 76 3.452 3.460 -12.789 639 H ASP 77 H ASP 77 1.084 -4.001 -11.721 640 HA ASP 77 HA ASP 77 2.440 -6.593 -11.942 641 1HB ASP 77 HB2 ASP 77 0.292 -5.773 -10.502 642 2HB ASP 77 HB3 ASP 77 -0.526 -6.481 -11.896 643 H LYS 78 H LYS 78 0.181 -7.968 -13.191 644 HA LYS 78 HA LYS 78 0.822 -7.281 -16.009 645 1HB LYS 78 HB2 LYS 78 -0.369 -9.522 -16.423 646 2HB LYS 78 HB3 LYS 78 1.172 -9.592 -15.567 647 1HG LYS 78 HG2 LYS 78 -1.241 -9.234 -13.875 648 2HG LYS 78 HG3 LYS 78 -1.067 -10.806 -14.657 649 1HD LYS 78 HD2 LYS 78 1.228 -9.529 -13.171 650 2HD LYS 78 HD3 LYS 78 0.029 -10.520 -12.337 651 1HE LYS 78 HE2 LYS 78 0.540 -12.215 -14.309 652 2HE LYS 78 HE3 LYS 78 2.060 -11.326 -14.387 653 1HZ LYS 78 HZ1 LYS 78 1.128 -12.143 -11.747 654 2HZ LYS 78 HZ2 LYS 78 1.706 -13.369 -12.773 655 3HZ LYS 78 HZ3 LYS 78 2.706 -12.058 -12.364 656 H GLY 79 H GLY 79 -1.671 -6.890 -13.712 657 1HA GLY 79 HA2 GLY 79 -3.915 -6.971 -15.558 658 2HA GLY 79 HA3 GLY 79 -3.945 -6.302 -13.925 659 H GLN 80 H GLN 80 -4.965 -4.346 -14.451 660 HA GLN 80 HA GLN 80 -3.933 -2.678 -16.631 661 1HB GLN 80 HB2 GLN 80 -6.118 -2.409 -14.580 662 2HB GLN 80 HB3 GLN 80 -5.578 -0.992 -15.481 663 1HG GLN 80 HG2 GLN 80 -5.964 -3.294 -17.226 664 2HG GLN 80 HG3 GLN 80 -7.440 -2.880 -16.352 665 1HE2 GLN 80 HE21 GLN 80 -4.840 -0.662 -17.462 666 2HE2 GLN 80 HE22 GLN 80 -5.848 0.262 -18.468 667 H ARG 81 H ARG 81 -3.440 -0.288 -16.027 668 HA ARG 81 HA ARG 81 -1.597 -0.310 -13.671 669 1HB ARG 81 HB2 ARG 81 -1.492 1.427 -16.158 670 2HB ARG 81 HB3 ARG 81 -0.309 1.412 -14.850 671 1HG ARG 81 HG2 ARG 81 0.465 -0.740 -15.404 672 2HG ARG 81 HG3 ARG 81 -0.984 -1.119 -16.336 673 1HD ARG 81 HD2 ARG 81 0.204 -0.525 -18.164 674 2HD ARG 81 HD3 ARG 81 0.024 1.138 -17.605 675 HE ARG 81 HE ARG 81 2.312 1.118 -17.054 676 1HH1 ARG 81 HH11 ARG 81 1.077 -2.067 -17.526 677 2HH1 ARG 81 HH12 ARG 81 2.587 -2.844 -17.190 678 1HH2 ARG 81 HH21 ARG 81 4.268 0.109 -16.511 679 2HH2 ARG 81 HH22 ARG 81 4.390 -1.616 -16.614 680 H THR 82 H THR 82 -4.584 0.742 -14.534 681 HA THR 82 HA THR 82 -4.535 2.862 -12.492 682 HB THR 82 HB THR 82 -5.497 4.568 -13.955 683 HG1 THR 82 HG1 THR 82 -6.569 3.462 -15.477 684 1HG2 THR 82 HG21 THR 82 -2.984 4.264 -13.787 685 2HG2 THR 82 HG22 THR 82 -3.063 3.408 -15.327 686 3HG2 THR 82 HG23 THR 82 -3.538 5.104 -15.234 687 H ASP 83 H ASP 83 -6.527 2.994 -11.461 688 HA ASP 83 HA ASP 83 -8.579 1.063 -12.392 689 1HB ASP 83 HB2 ASP 83 -7.677 2.044 -9.813 690 2HB ASP 83 HB3 ASP 83 -9.425 2.214 -9.975 691 H LYS 84 H LYS 84 -10.841 2.229 -11.216 692 HA LYS 84 HA LYS 84 -11.582 4.136 -13.268 693 1HB LYS 84 HB2 LYS 84 -13.711 4.304 -11.860 694 2HB LYS 84 HB3 LYS 84 -13.313 2.696 -12.464 695 1HG LYS 84 HG2 LYS 84 -12.469 1.995 -10.350 696 2HG LYS 84 HG3 LYS 84 -12.424 3.649 -9.737 697 1HD LYS 84 HD2 LYS 84 -14.703 3.719 -9.360 698 2HD LYS 84 HD3 LYS 84 -15.057 2.566 -10.648 699 1HE LYS 84 HE2 LYS 84 -14.000 0.771 -9.241 700 2HE LYS 84 HE3 LYS 84 -13.861 1.945 -7.933 701 1HZ LYS 84 HZ1 LYS 84 -16.315 2.288 -8.184 702 2HZ LYS 84 HZ2 LYS 84 -16.340 0.934 -9.204 703 3HZ LYS 84 HZ3 LYS 84 -15.857 0.766 -7.583 704 H TYR 85 H TYR 85 -10.121 4.413 -10.175 705 HA TYR 85 HA TYR 85 -11.050 7.164 -9.706 706 1HB TYR 85 HB2 TYR 85 -9.226 5.244 -8.286 707 2HB TYR 85 HB3 TYR 85 -9.145 6.963 -7.898 708 HD1 TYR 85 HD1 TYR 85 -11.492 4.071 -8.150 709 HD2 TYR 85 HD2 TYR 85 -10.780 7.982 -6.522 710 HE1 TYR 85 HE1 TYR 85 -13.512 3.847 -6.729 711 HE2 TYR 85 HE2 TYR 85 -12.801 7.758 -5.101 712 HH TYR 85 HH TYR 85 -15.095 6.226 -5.401 713 H GLY 86 H GLY 86 -8.795 5.758 -11.731 714 1HA GLY 86 HA2 GLY 86 -7.261 6.874 -13.157 715 2HA GLY 86 HA3 GLY 86 -7.508 8.347 -12.218 716 H ARG 87 H ARG 87 -6.997 6.109 -9.918 717 HA ARG 87 HA ARG 87 -4.279 6.993 -9.420 718 1HB ARG 87 HB2 ARG 87 -5.670 4.671 -8.072 719 2HB ARG 87 HB3 ARG 87 -4.424 5.728 -7.407 720 1HG ARG 87 HG2 ARG 87 -6.146 7.637 -7.830 721 2HG ARG 87 HG3 ARG 87 -7.330 6.331 -7.915 722 1HD ARG 87 HD2 ARG 87 -5.945 5.636 -5.665 723 2HD ARG 87 HD3 ARG 87 -5.862 7.395 -5.582 724 HE ARG 87 HE ARG 87 -8.448 7.229 -5.937 725 1HH1 ARG 87 HH11 ARG 87 -6.785 6.370 -3.295 726 2HH1 ARG 87 HH12 ARG 87 -7.885 5.174 -2.701 727 1HH2 ARG 87 HH21 ARG 87 -9.740 5.056 -5.638 728 2HH2 ARG 87 HH22 ARG 87 -9.560 4.418 -4.039 729 H GLY 88 H GLY 88 -2.390 5.598 -9.365 730 1HA GLY 88 HA2 GLY 88 -2.466 3.559 -11.503 731 2HA GLY 88 HA3 GLY 88 -1.010 4.217 -10.754 732 H LEU 89 H LEU 89 -1.892 1.371 -11.155 733 HA LEU 89 HA LEU 89 -1.895 0.539 -8.280 734 1HB LEU 89 HB2 LEU 89 -2.946 -0.918 -10.724 735 2HB LEU 89 HB3 LEU 89 -2.861 -1.614 -9.105 736 HG LEU 89 HG LEU 89 -4.299 0.986 -9.659 737 1HD1 LEU 89 HD11 LEU 89 -5.189 -1.009 -11.001 738 2HD1 LEU 89 HD12 LEU 89 -5.610 -1.730 -9.448 739 3HD1 LEU 89 HD13 LEU 89 -6.345 -0.204 -9.939 740 1HD2 LEU 89 HD21 LEU 89 -4.410 -1.072 -7.431 741 2HD2 LEU 89 HD22 LEU 89 -3.722 0.548 -7.324 742 3HD2 LEU 89 HD23 LEU 89 -5.459 0.341 -7.541 743 H ALA 90 H ALA 90 0.048 -0.227 -7.655 744 HA ALA 90 HA ALA 90 1.481 -2.222 -9.168 745 1HB ALA 90 HB1 ALA 90 1.988 0.041 -10.348 746 2HB ALA 90 HB2 ALA 90 2.976 0.384 -8.928 747 3HB ALA 90 HB3 ALA 90 3.346 -1.008 -9.945 748 H TYR 91 H TYR 91 3.400 -2.961 -7.976 749 HA TYR 91 HA TYR 91 3.068 -2.592 -5.092 750 1HB TYR 91 HB2 TYR 91 5.141 -4.170 -6.649 751 2HB TYR 91 HB3 TYR 91 4.862 -4.276 -4.911 752 HD1 TYR 91 HD1 TYR 91 2.831 -5.309 -4.013 753 HD2 TYR 91 HD2 TYR 91 3.542 -5.099 -8.244 754 HE1 TYR 91 HE1 TYR 91 1.027 -6.968 -4.399 755 HE2 TYR 91 HE2 TYR 91 1.738 -6.757 -8.630 756 HH TYR 91 HH TYR 91 0.652 -8.668 -7.159 757 H ILE 92 H ILE 92 4.023 -0.930 -4.031 758 HA ILE 92 HA ILE 92 6.306 0.470 -5.285 759 HB ILE 92 HB ILE 92 4.803 1.098 -2.727 760 1HG1 ILE 92 HG12 ILE 92 4.522 2.505 -5.383 761 2HG1 ILE 92 HG13 ILE 92 3.526 1.104 -4.986 762 1HG2 ILE 92 HG21 ILE 92 6.677 2.759 -4.440 763 2HG2 ILE 92 HG22 ILE 92 5.819 3.331 -3.010 764 3HG2 ILE 92 HG23 ILE 92 7.061 2.088 -2.856 765 1HD1 ILE 92 HD11 ILE 92 3.689 3.174 -2.876 766 2HD1 ILE 92 HD12 ILE 92 2.845 3.660 -4.346 767 3HD1 ILE 92 HD13 ILE 92 2.298 2.249 -3.443 768 H TYR 93 H TYR 93 8.372 0.541 -4.363 769 HA TYR 93 HA TYR 93 8.795 -1.219 -1.980 770 1HB TYR 93 HB2 TYR 93 10.505 -0.934 -4.466 771 2HB TYR 93 HB3 TYR 93 11.023 -1.779 -3.007 772 HD1 TYR 93 HD1 TYR 93 8.527 -1.765 -5.756 773 HD2 TYR 93 HD2 TYR 93 10.198 -3.961 -2.464 774 HE1 TYR 93 HE1 TYR 93 7.335 -3.804 -6.510 775 HE2 TYR 93 HE2 TYR 93 9.005 -6.001 -3.218 776 HH TYR 93 HH TYR 93 7.848 -6.472 -6.144 777 H ALA 94 H ALA 94 9.842 -0.220 -0.325 778 HA ALA 94 HA ALA 94 11.324 2.304 -0.944 779 1HB ALA 94 HB1 ALA 94 9.096 2.413 0.414 780 2HB ALA 94 HB2 ALA 94 10.060 1.747 1.732 781 3HB ALA 94 HB3 ALA 94 10.496 3.298 1.017 782 H ASP 95 H ASP 95 13.417 2.365 -0.228 783 HA ASP 95 HA ASP 95 15.404 1.687 0.818 784 1HB ASP 95 HB2 ASP 95 13.272 0.850 2.717 785 2HB ASP 95 HB3 ASP 95 14.850 0.089 2.921 786 H GLY 96 H GLY 96 13.688 -0.104 -1.101 787 1HA GLY 96 HA2 GLY 96 14.398 -2.039 -2.295 788 2HA GLY 96 HA3 GLY 96 15.595 -2.343 -1.035 789 H LYS 97 H LYS 97 12.363 -1.702 0.006 790 HA LYS 97 HA LYS 97 11.901 -4.633 0.375 791 1HB LYS 97 HB2 LYS 97 12.647 -3.122 2.444 792 2HB LYS 97 HB3 LYS 97 10.932 -2.706 2.447 793 1HG LYS 97 HG2 LYS 97 10.288 -4.797 3.102 794 2HG LYS 97 HG3 LYS 97 11.543 -5.592 2.150 795 1HD LYS 97 HD2 LYS 97 12.127 -4.035 4.679 796 2HD LYS 97 HD3 LYS 97 11.837 -5.774 4.663 797 1HE LYS 97 HE2 LYS 97 13.840 -6.239 3.643 798 2HE LYS 97 HE3 LYS 97 13.833 -4.740 2.714 799 1HZ LYS 97 HZ1 LYS 97 14.060 -4.483 5.605 800 2HZ LYS 97 HZ2 LYS 97 15.409 -5.130 4.799 801 3HZ LYS 97 HZ3 LYS 97 14.822 -3.597 4.371 802 H MET 98 H MET 98 9.555 -5.134 0.733 803 HA MET 98 HA MET 98 7.920 -3.647 -1.162 804 1HB MET 98 HB2 MET 98 7.870 -6.206 -0.499 805 2HB MET 98 HB3 MET 98 6.761 -5.644 0.753 806 1HG MET 98 HG2 MET 98 5.117 -5.660 -0.785 807 2HG MET 98 HG3 MET 98 5.951 -4.347 -1.615 808 1HE MET 98 HE1 MET 98 5.322 -8.112 -1.273 809 2HE MET 98 HE2 MET 98 6.491 -8.850 -2.378 810 3HE MET 98 HE3 MET 98 7.047 -8.028 -0.923 811 H VAL 99 H VAL 99 7.175 -1.663 -0.535 812 HA VAL 99 HA VAL 99 6.854 -0.731 2.102 813 HB VAL 99 HB VAL 99 5.397 0.039 -0.440 814 1HG1 VAL 99 HG11 VAL 99 4.724 0.678 2.258 815 2HG1 VAL 99 HG12 VAL 99 5.422 2.123 1.526 816 3HG1 VAL 99 HG13 VAL 99 4.027 1.343 0.781 817 1HG2 VAL 99 HG21 VAL 99 7.974 0.662 0.797 818 2HG2 VAL 99 HG22 VAL 99 7.418 0.976 -0.847 819 3HG2 VAL 99 HG23 VAL 99 7.033 2.111 0.446 820 H ASN 100 H ASN 100 4.429 -2.261 -0.026 821 HA ASN 100 HA ASN 100 2.208 -2.096 1.706 822 1HB ASN 100 HB2 ASN 100 2.938 -4.385 -0.150 823 2HB ASN 100 HB3 ASN 100 1.331 -4.055 0.498 824 1HD2 ASN 100 HD21 ASN 100 0.420 -3.635 -1.638 825 2HD2 ASN 100 HD22 ASN 100 0.815 -2.231 -2.507 826 H GLU 101 H GLU 101 4.795 -4.547 1.583 827 HA GLU 101 HA GLU 101 3.710 -6.219 3.641 828 1HB GLU 101 HB2 GLU 101 5.472 -7.047 2.183 829 2HB GLU 101 HB3 GLU 101 6.574 -5.789 2.743 830 1HG GLU 101 HG2 GLU 101 6.133 -6.777 5.112 831 2HG GLU 101 HG3 GLU 101 5.549 -8.194 4.238 832 H ALA 102 H ALA 102 5.720 -3.328 3.715 833 HA ALA 102 HA ALA 102 6.567 -3.447 6.421 834 1HB ALA 102 HB1 ALA 102 7.321 -1.779 4.666 835 2HB ALA 102 HB2 ALA 102 5.802 -0.925 4.931 836 3HB ALA 102 HB3 ALA 102 6.968 -1.080 6.246 837 H LEU 103 H LEU 103 3.679 -1.890 5.028 838 HA LEU 103 HA LEU 103 2.551 -0.985 7.464 839 1HB LEU 103 HB2 LEU 103 1.229 -1.901 4.896 840 2HB LEU 103 HB3 LEU 103 0.353 -1.137 6.221 841 HG LEU 103 HG LEU 103 2.771 0.129 4.914 842 1HD1 LEU 103 HD11 LEU 103 0.377 -0.324 3.629 843 2HD1 LEU 103 HD12 LEU 103 0.118 1.269 4.339 844 3HD1 LEU 103 HD13 LEU 103 1.483 0.998 3.257 845 1HD2 LEU 103 HD21 LEU 103 1.433 0.683 7.279 846 2HD2 LEU 103 HD22 LEU 103 2.437 1.824 6.382 847 3HD2 LEU 103 HD23 LEU 103 0.690 1.800 6.133 848 H VAL 104 H VAL 104 1.900 -4.042 5.706 849 HA VAL 104 HA VAL 104 0.169 -5.169 7.651 850 HB VAL 104 HB VAL 104 2.086 -6.469 5.701 851 1HG1 VAL 104 HG11 VAL 104 0.154 -7.649 7.687 852 2HG1 VAL 104 HG12 VAL 104 0.479 -8.479 6.164 853 3HG1 VAL 104 HG13 VAL 104 1.795 -8.167 7.296 854 1HG2 VAL 104 HG21 VAL 104 -0.361 -5.146 5.370 855 2HG2 VAL 104 HG22 VAL 104 0.411 -6.218 4.203 856 3HG2 VAL 104 HG23 VAL 104 -0.778 -6.859 5.336 857 H ARG 105 H ARG 105 3.597 -4.680 7.688 858 HA ARG 105 HA ARG 105 4.224 -6.710 9.656 859 1HB ARG 105 HB2 ARG 105 5.656 -4.799 8.110 860 2HB ARG 105 HB3 ARG 105 6.036 -4.486 9.804 861 1HG ARG 105 HG2 ARG 105 7.552 -6.179 8.711 862 2HG ARG 105 HG3 ARG 105 6.719 -6.780 10.144 863 1HD ARG 105 HD2 ARG 105 5.326 -8.167 8.927 864 2HD ARG 105 HD3 ARG 105 5.384 -7.140 7.494 865 HE ARG 105 HE ARG 105 7.333 -8.296 6.800 866 1HH1 ARG 105 HH11 ARG 105 5.901 -10.357 8.760 867 2HH1 ARG 105 HH12 ARG 105 7.310 -11.023 9.517 868 1HH2 ARG 105 HH21 ARG 105 9.435 -8.547 8.340 869 2HH2 ARG 105 HH22 ARG 105 9.311 -9.999 9.278 870 H GLN 106 H GLN 106 3.486 -3.229 9.817 871 HA GLN 106 HA GLN 106 3.577 -3.340 12.775 872 1HB GLN 106 HB2 GLN 106 4.335 -1.373 11.106 873 2HB GLN 106 HB3 GLN 106 2.653 -0.895 11.342 874 1HG GLN 106 HG2 GLN 106 2.956 -0.887 13.766 875 2HG GLN 106 HG3 GLN 106 4.611 -1.470 13.585 876 1HE2 GLN 106 HE21 GLN 106 2.601 1.368 13.552 877 2HE2 GLN 106 HE22 GLN 106 3.820 2.479 13.150 878 H GLY 107 H GLY 107 1.454 -4.617 10.915 879 1HA GLY 107 HA2 GLY 107 -0.889 -4.845 10.873 880 2HA GLY 107 HA3 GLY 107 -0.762 -4.506 12.601 881 H LEU 108 H LEU 108 -0.329 -2.539 9.635 882 HA LEU 108 HA LEU 108 -2.125 -0.508 10.900 883 1HB LEU 108 HB2 LEU 108 0.304 -0.261 9.140 884 2HB LEU 108 HB3 LEU 108 -0.903 1.025 9.162 885 HG LEU 108 HG LEU 108 0.420 -0.091 11.649 886 1HD1 LEU 108 HD11 LEU 108 1.963 1.126 10.021 887 2HD1 LEU 108 HD12 LEU 108 0.979 2.561 10.302 888 3HD1 LEU 108 HD13 LEU 108 1.859 1.822 11.638 889 1HD2 LEU 108 HD21 LEU 108 -1.495 2.165 11.058 890 2HD2 LEU 108 HD22 LEU 108 -1.636 0.894 12.271 891 3HD2 LEU 108 HD23 LEU 108 -0.472 2.199 12.493 892 H ALA 109 H ALA 109 -1.543 -2.513 8.114 893 HA ALA 109 HA ALA 109 -3.989 -1.344 6.845 894 1HB ALA 109 HB1 ALA 109 -1.687 -0.991 5.674 895 2HB ALA 109 HB2 ALA 109 -1.817 -2.701 5.261 896 3HB ALA 109 HB3 ALA 109 -3.045 -1.564 4.704 897 H LYS 110 H LYS 110 -4.781 -3.113 5.103 898 HA LYS 110 HA LYS 110 -4.558 -5.832 6.292 899 1HB LYS 110 HB2 LYS 110 -7.138 -4.334 5.756 900 2HB LYS 110 HB3 LYS 110 -7.058 -6.069 6.067 901 1HG LYS 110 HG2 LYS 110 -6.361 -5.773 8.283 902 2HG LYS 110 HG3 LYS 110 -5.765 -4.141 7.978 903 1HD LYS 110 HD2 LYS 110 -8.667 -4.593 7.522 904 2HD LYS 110 HD3 LYS 110 -8.124 -4.621 9.199 905 1HE LYS 110 HE2 LYS 110 -7.385 -2.407 9.138 906 2HE LYS 110 HE3 LYS 110 -7.207 -2.411 7.383 907 1HZ LYS 110 HZ1 LYS 110 -9.879 -2.955 7.999 908 2HZ LYS 110 HZ2 LYS 110 -9.413 -1.595 8.896 909 3HZ LYS 110 HZ3 LYS 110 -9.239 -1.596 7.207 910 H VAL 111 H VAL 111 -5.149 -7.525 4.774 911 HA VAL 111 HA VAL 111 -4.572 -6.775 1.999 912 HB VAL 111 HB VAL 111 -5.276 -9.481 3.176 913 1HG1 VAL 111 HG11 VAL 111 -5.406 -8.925 0.597 914 2HG1 VAL 111 HG12 VAL 111 -3.649 -9.020 0.698 915 3HG1 VAL 111 HG13 VAL 111 -4.634 -10.413 1.142 916 1HG2 VAL 111 HG21 VAL 111 -3.171 -8.136 4.006 917 2HG2 VAL 111 HG22 VAL 111 -2.996 -9.834 3.564 918 3HG2 VAL 111 HG23 VAL 111 -2.506 -8.574 2.433 919 H ALA 112 H ALA 112 -6.053 -6.717 0.324 920 HA ALA 112 HA ALA 112 -8.635 -7.963 0.396 921 1HB ALA 112 HB1 ALA 112 -8.832 -6.031 2.113 922 2HB ALA 112 HB2 ALA 112 -8.804 -4.968 0.706 923 3HB ALA 112 HB3 ALA 112 -10.087 -6.165 0.882 924 H TYR 113 H TYR 113 -10.094 -6.722 -1.387 925 HA TYR 113 HA TYR 113 -10.249 -6.177 -3.664 926 1HB TYR 113 HB2 TYR 113 -7.648 -4.742 -3.045 927 2HB TYR 113 HB3 TYR 113 -8.617 -4.508 -4.500 928 HD1 TYR 113 HD1 TYR 113 -11.149 -3.914 -4.106 929 HD2 TYR 113 HD2 TYR 113 -8.051 -3.396 -1.175 930 HE1 TYR 113 HE1 TYR 113 -12.560 -2.267 -2.907 931 HE2 TYR 113 HE2 TYR 113 -9.463 -1.747 0.025 932 HH TYR 113 HH TYR 113 -11.867 -0.159 -1.190 933 H VAL 114 H VAL 114 -9.739 -8.604 -3.848 934 HA VAL 114 HA VAL 114 -7.046 -9.072 -5.035 935 HB VAL 114 HB VAL 114 -9.167 -11.103 -4.276 936 1HG1 VAL 114 HG11 VAL 114 -7.260 -11.587 -6.002 937 2HG1 VAL 114 HG12 VAL 114 -6.212 -11.591 -4.583 938 3HG1 VAL 114 HG13 VAL 114 -7.544 -12.742 -4.700 939 1HG2 VAL 114 HG21 VAL 114 -7.335 -9.552 -2.648 940 2HG2 VAL 114 HG22 VAL 114 -8.562 -10.712 -2.137 941 3HG2 VAL 114 HG23 VAL 114 -6.940 -11.267 -2.553 942 H TYR 115 H TYR 115 -7.340 -8.257 -7.134 943 HA TYR 115 HA TYR 115 -9.500 -9.563 -8.739 944 1HB TYR 115 HB2 TYR 115 -8.040 -6.955 -9.268 945 2HB TYR 115 HB3 TYR 115 -9.327 -7.636 -10.262 946 HD1 TYR 115 HD1 TYR 115 -8.518 -6.140 -6.975 947 HD2 TYR 115 HD2 TYR 115 -11.639 -7.542 -9.573 948 HE1 TYR 115 HE1 TYR 115 -10.215 -5.075 -5.511 949 HE2 TYR 115 HE2 TYR 115 -13.335 -6.477 -8.109 950 HH TYR 115 HH TYR 115 -12.397 -4.407 -5.416 951 H LYS 116 H LYS 116 -8.807 -10.966 -10.289 952 HA LYS 116 HA LYS 116 -5.913 -11.259 -10.737 953 1HB LYS 116 HB2 LYS 116 -8.048 -12.812 -12.188 954 2HB LYS 116 HB3 LYS 116 -6.426 -13.330 -11.724 955 1HG LYS 116 HG2 LYS 116 -7.278 -12.941 -9.281 956 2HG LYS 116 HG3 LYS 116 -8.880 -13.053 -10.010 957 1HD LYS 116 HD2 LYS 116 -7.064 -15.154 -10.940 958 2HD LYS 116 HD3 LYS 116 -7.337 -15.204 -9.197 959 1HE LYS 116 HE2 LYS 116 -9.663 -14.852 -11.069 960 2HE LYS 116 HE3 LYS 116 -9.003 -16.462 -10.780 961 1HZ LYS 116 HZ1 LYS 116 -9.175 -15.421 -8.293 962 2HZ LYS 116 HZ2 LYS 116 -10.553 -14.774 -9.040 963 3HZ LYS 116 HZ3 LYS 116 -10.321 -16.457 -8.999 964 HA PRO 117 HA PRO 117 -4.805 -12.306 -12.157 965 1HB PRO 117 HB2 PRO 117 -2.668 -11.707 -13.747 966 2HB PRO 117 HB3 PRO 117 -4.001 -12.745 -14.279 967 1HG PRO 117 HG2 PRO 117 -3.351 -9.975 -15.093 968 2HG PRO 117 HG3 PRO 117 -4.295 -11.205 -15.946 969 1HD PRO 117 HD2 PRO 117 -5.303 -8.990 -14.429 970 2HD PRO 117 HD3 PRO 117 -6.243 -10.288 -15.198 971 H ASN 118 H ASN 118 -5.236 -9.331 -11.381 972 HA ASN 118 HA ASN 118 -2.543 -8.402 -10.714 973 1HB ASN 118 HB2 ASN 118 -5.335 -7.406 -10.212 974 2HB ASN 118 HB3 ASN 118 -3.984 -6.719 -9.311 975 1HD2 ASN 118 HD21 ASN 118 -5.709 -5.541 -11.556 976 2HD2 ASN 118 HD22 ASN 118 -4.585 -5.008 -12.710 977 H ASN 119 H ASN 119 -2.054 -10.492 -9.520 978 HA ASN 119 HA ASN 119 -2.346 -10.037 -6.665 979 1HB ASN 119 HB2 ASN 119 -3.592 -12.027 -6.099 980 2HB ASN 119 HB3 ASN 119 -4.537 -11.133 -7.289 981 1HD2 ASN 119 HD21 ASN 119 -5.405 -12.520 -8.824 982 2HD2 ASN 119 HD22 ASN 119 -4.640 -13.908 -9.435 983 H THR 120 H THR 120 -0.285 -10.512 -8.787 984 HA THR 120 HA THR 120 0.896 -13.055 -8.661 985 HB THR 120 HB THR 120 1.603 -10.903 -9.967 986 HG1 THR 120 HG1 THR 120 3.091 -13.022 -9.000 987 1HG2 THR 120 HG21 THR 120 3.316 -10.667 -7.479 988 2HG2 THR 120 HG22 THR 120 3.542 -9.747 -8.965 989 3HG2 THR 120 HG23 THR 120 2.087 -9.515 -7.999 990 H HIS 121 H HIS 121 1.399 -10.300 -6.459 991 HA HIS 121 HA HIS 121 2.766 -12.153 -4.567 992 1HB HIS 121 HB2 HIS 121 2.623 -9.123 -4.628 993 2HB HIS 121 HB3 HIS 121 3.496 -10.068 -3.421 994 HD1 HIS 121 HD1 HIS 121 4.597 -12.235 -5.453 995 HD2 HIS 121 HD2 HIS 121 4.909 -8.106 -5.931 996 HE1 HIS 121 HE1 HIS 121 6.556 -11.840 -7.010 997 H GLU 122 H GLU 122 0.080 -12.624 -4.658 998 HA GLU 122 HA GLU 122 -1.245 -11.004 -2.577 999 1HB GLU 122 HB2 GLU 122 -2.467 -11.880 -4.607 1000 2HB GLU 122 HB3 GLU 122 -2.267 -13.505 -3.949 1001 1HG GLU 122 HG2 GLU 122 -3.275 -11.735 -1.902 1002 2HG GLU 122 HG3 GLU 122 -4.309 -11.655 -3.328 1003 H GLN 123 H GLN 123 -0.332 -14.438 -3.032 1004 HA GLN 123 HA GLN 123 -1.045 -15.346 -0.454 1005 1HB GLN 123 HB2 GLN 123 0.636 -16.278 -2.653 1006 2HB GLN 123 HB3 GLN 123 1.280 -16.750 -1.080 1007 1HG GLN 123 HG2 GLN 123 -0.245 -18.485 -1.777 1008 2HG GLN 123 HG3 GLN 123 -1.029 -17.583 -0.481 1009 1HE2 GLN 123 HE21 GLN 123 -1.904 -19.026 -3.224 1010 2HE2 GLN 123 HE22 GLN 123 -3.057 -17.934 -3.824 1011 H LEU 124 H LEU 124 1.696 -13.440 -1.505 1012 HA LEU 124 HA LEU 124 3.323 -13.855 0.842 1013 1HB LEU 124 HB2 LEU 124 4.359 -12.996 -1.163 1014 2HB LEU 124 HB3 LEU 124 3.244 -11.631 -1.213 1015 HG LEU 124 HG LEU 124 4.166 -10.734 0.849 1016 1HD1 LEU 124 HD11 LEU 124 5.468 -13.418 0.928 1017 2HD1 LEU 124 HD12 LEU 124 6.382 -12.057 1.576 1018 3HD1 LEU 124 HD13 LEU 124 4.799 -12.454 2.245 1019 1HD2 LEU 124 HD21 LEU 124 5.364 -10.489 -1.461 1020 2HD2 LEU 124 HD22 LEU 124 6.229 -9.993 -0.006 1021 3HD2 LEU 124 HD23 LEU 124 6.583 -11.550 -0.755 1022 H LEU 125 H LEU 125 1.287 -11.070 -0.141 1023 HA LEU 125 HA LEU 125 1.501 -9.733 2.382 1024 1HB LEU 125 HB2 LEU 125 -0.668 -9.551 0.269 1025 2HB LEU 125 HB3 LEU 125 -0.439 -8.407 1.594 1026 HG LEU 125 HG LEU 125 1.797 -9.049 -0.327 1027 1HD1 LEU 125 HD11 LEU 125 -0.382 -6.957 -0.596 1028 2HD1 LEU 125 HD12 LEU 125 1.124 -6.934 -1.515 1029 3HD1 LEU 125 HD13 LEU 125 -0.017 -8.262 -1.727 1030 1HD2 LEU 125 HD21 LEU 125 1.273 -7.182 1.901 1031 2HD2 LEU 125 HD22 LEU 125 2.808 -7.794 1.284 1032 3HD2 LEU 125 HD23 LEU 125 2.013 -6.437 0.483 1033 H ARG 126 H ARG 126 -0.402 -12.436 1.360 1034 HA ARG 126 HA ARG 126 -2.502 -12.128 3.345 1035 1HB ARG 126 HB2 ARG 126 -2.347 -13.631 1.136 1036 2HB ARG 126 HB3 ARG 126 -1.770 -14.827 2.296 1037 1HG ARG 126 HG2 ARG 126 -3.896 -15.209 2.927 1038 2HG ARG 126 HG3 ARG 126 -4.011 -13.538 3.479 1039 1HD ARG 126 HD2 ARG 126 -4.596 -12.843 1.160 1040 2HD ARG 126 HD3 ARG 126 -4.566 -14.537 0.670 1041 HE ARG 126 HE ARG 126 -6.581 -13.310 2.484 1042 1HH1 ARG 126 HH11 ARG 126 -7.160 -14.585 -0.225 1043 2HH1 ARG 126 HH12 ARG 126 -7.805 -16.117 0.259 1044 1HH2 ARG 126 HH21 ARG 126 -6.629 -15.886 3.512 1045 2HH2 ARG 126 HH22 ARG 126 -7.503 -16.854 2.374 1046 H LYS 127 H LYS 127 0.479 -14.075 3.129 1047 HA LYS 127 HA LYS 127 0.207 -15.314 5.695 1048 1HB LYS 127 HB2 LYS 127 1.795 -16.281 4.212 1049 2HB LYS 127 HB3 LYS 127 2.580 -14.730 3.919 1050 1HG LYS 127 HG2 LYS 127 3.960 -15.038 5.670 1051 2HG LYS 127 HG3 LYS 127 2.593 -15.323 6.748 1052 1HD LYS 127 HD2 LYS 127 3.479 -17.421 6.890 1053 2HD LYS 127 HD3 LYS 127 2.623 -17.665 5.365 1054 1HE LYS 127 HE2 LYS 127 4.674 -16.954 4.140 1055 2HE LYS 127 HE3 LYS 127 5.522 -16.831 5.682 1056 1HZ LYS 127 HZ1 LYS 127 4.295 -19.313 5.645 1057 2HZ LYS 127 HZ2 LYS 127 5.014 -19.125 4.116 1058 3HZ LYS 127 HZ3 LYS 127 5.954 -18.981 5.524 1059 H SER 128 H SER 128 2.297 -12.587 4.725 1060 HA SER 128 HA SER 128 3.157 -11.806 7.273 1061 1HB SER 128 HB2 SER 128 2.408 -9.914 5.026 1062 2HB SER 128 HB3 SER 128 3.546 -9.599 6.333 1063 HG SER 128 HG SER 128 3.848 -11.048 4.012 1064 H GLU 129 H GLU 129 0.095 -11.088 5.639 1065 HA GLU 129 HA GLU 129 -0.893 -9.195 7.539 1066 1HB GLU 129 HB2 GLU 129 -1.999 -9.492 5.386 1067 2HB GLU 129 HB3 GLU 129 -2.376 -11.170 5.778 1068 1HG GLU 129 HG2 GLU 129 -3.614 -10.222 7.833 1069 2HG GLU 129 HG3 GLU 129 -3.509 -8.662 7.018 1070 H ALA 130 H ALA 130 -1.211 -12.743 7.355 1071 HA ALA 130 HA ALA 130 -2.826 -13.029 9.698 1072 1HB ALA 130 HB1 ALA 130 -2.103 -14.770 7.834 1073 2HB ALA 130 HB2 ALA 130 -0.798 -15.114 8.968 1074 3HB ALA 130 HB3 ALA 130 -2.477 -15.316 9.467 1075 H GLN 131 H GLN 131 0.588 -12.476 9.241 1076 HA GLN 131 HA GLN 131 1.433 -13.337 11.867 1077 1HB GLN 131 HB2 GLN 131 2.998 -13.018 9.950 1078 2HB GLN 131 HB3 GLN 131 2.709 -11.281 10.034 1079 1HG GLN 131 HG2 GLN 131 3.970 -11.026 11.923 1080 2HG GLN 131 HG3 GLN 131 3.473 -12.583 12.587 1081 1HE2 GLN 131 HE21 GLN 131 5.181 -14.039 12.675 1082 2HE2 GLN 131 HE22 GLN 131 6.470 -14.106 11.571 1083 H ALA 132 H ALA 132 0.513 -10.184 10.485 1084 HA ALA 132 HA ALA 132 0.895 -8.732 12.953 1085 1HB ALA 132 HB1 ALA 132 0.004 -8.164 10.254 1086 2HB ALA 132 HB2 ALA 132 -1.059 -7.392 11.431 1087 3HB ALA 132 HB3 ALA 132 0.672 -7.060 11.456 1088 H LYS 133 H LYS 133 -1.734 -10.597 11.572 1089 HA LYS 133 HA LYS 133 -3.865 -9.610 13.196 1090 1HB LYS 133 HB2 LYS 133 -3.527 -11.641 11.273 1091 2HB LYS 133 HB3 LYS 133 -4.089 -12.461 12.731 1092 1HG LYS 133 HG2 LYS 133 -5.936 -10.793 12.912 1093 2HG LYS 133 HG3 LYS 133 -5.410 -10.089 11.384 1094 1HD LYS 133 HD2 LYS 133 -6.100 -13.021 11.649 1095 2HD LYS 133 HD3 LYS 133 -7.309 -11.803 11.242 1096 1HE LYS 133 HE2 LYS 133 -6.486 -11.501 9.138 1097 2HE LYS 133 HE3 LYS 133 -4.811 -11.661 9.665 1098 1HZ LYS 133 HZ1 LYS 133 -5.803 -14.137 10.069 1099 2HZ LYS 133 HZ2 LYS 133 -6.619 -13.661 8.657 1100 3HZ LYS 133 HZ3 LYS 133 -4.923 -13.654 8.698 1101 H LYS 134 H LYS 134 -1.738 -12.455 13.687 1102 HA LYS 134 HA LYS 134 -2.758 -12.981 16.337 1103 1HB LYS 134 HB2 LYS 134 -0.432 -13.930 14.701 1104 2HB LYS 134 HB3 LYS 134 -0.435 -14.251 16.433 1105 1HG LYS 134 HG2 LYS 134 -2.858 -14.872 14.756 1106 2HG LYS 134 HG3 LYS 134 -1.519 -16.015 14.862 1107 1HD LYS 134 HD2 LYS 134 -1.771 -16.249 17.221 1108 2HD LYS 134 HD3 LYS 134 -2.835 -14.846 17.320 1109 1HE LYS 134 HE2 LYS 134 -4.116 -16.495 15.485 1110 2HE LYS 134 HE3 LYS 134 -3.484 -17.626 16.683 1111 1HZ LYS 134 HZ1 LYS 134 -4.444 -16.011 18.381 1112 2HZ LYS 134 HZ2 LYS 134 -5.325 -15.351 17.091 1113 3HZ LYS 134 HZ3 LYS 134 -5.540 -16.981 17.520 1114 H GLU 135 H GLU 135 -0.389 -10.812 15.034 1115 HA GLU 135 HA GLU 135 1.056 -10.413 17.533 1116 1HB GLU 135 HB2 GLU 135 0.947 -8.859 14.937 1117 2HB GLU 135 HB3 GLU 135 1.958 -8.383 16.302 1118 1HG GLU 135 HG2 GLU 135 2.314 -11.194 15.772 1119 2HG GLU 135 HG3 GLU 135 2.574 -10.276 14.289 1120 H LYS 136 H LYS 136 -1.909 -9.277 16.202 1121 HA LYS 136 HA LYS 136 -3.437 -7.652 16.938 1122 1HB LYS 136 HB2 LYS 136 -2.083 -7.774 19.627 1123 2HB LYS 136 HB3 LYS 136 -3.798 -7.602 19.260 1124 1HG LYS 136 HG2 LYS 136 -2.824 -10.063 18.116 1125 2HG LYS 136 HG3 LYS 136 -2.394 -9.997 19.826 1126 1HD LYS 136 HD2 LYS 136 -5.116 -9.050 19.297 1127 2HD LYS 136 HD3 LYS 136 -4.867 -10.731 18.824 1128 1HE LYS 136 HE2 LYS 136 -4.952 -11.359 20.979 1129 2HE LYS 136 HE3 LYS 136 -3.573 -10.319 21.340 1130 1HZ LYS 136 HZ1 LYS 136 -5.352 -8.462 21.284 1131 2HZ LYS 136 HZ2 LYS 136 -6.446 -9.733 21.553 1132 3HZ LYS 136 HZ3 LYS 136 -5.204 -9.435 22.669 1133 H LEU 137 H LEU 137 -1.700 -6.329 15.541 1134 HA LEU 137 HA LEU 137 -0.505 -4.217 17.281 1135 1HB LEU 137 HB2 LEU 137 0.482 -5.618 15.020 1136 2HB LEU 137 HB3 LEU 137 0.226 -3.947 14.514 1137 HG LEU 137 HG LEU 137 1.470 -4.283 17.179 1138 1HD1 LEU 137 HD11 LEU 137 2.680 -5.343 14.652 1139 2HD1 LEU 137 HD12 LEU 137 3.729 -4.508 15.799 1140 3HD1 LEU 137 HD13 LEU 137 2.834 -5.943 16.304 1141 1HD2 LEU 137 HD21 LEU 137 1.306 -2.372 14.996 1142 2HD2 LEU 137 HD22 LEU 137 1.786 -2.106 16.672 1143 3HD2 LEU 137 HD23 LEU 137 2.982 -2.628 15.484 1144 H ASN 138 H ASN 138 -1.678 -2.391 17.433 1145 HA ASN 138 HA ASN 138 -3.139 -0.648 16.888 1146 1HB ASN 138 HB2 ASN 138 -2.122 -1.397 14.136 1147 2HB ASN 138 HB3 ASN 138 -3.148 0.004 14.441 1148 1HD2 ASN 138 HD21 ASN 138 0.101 -1.051 14.377 1149 2HD2 ASN 138 HD22 ASN 138 0.793 0.267 15.192 1150 H ILE 139 H ILE 139 -3.973 -1.961 13.782 1151 HA ILE 139 HA ILE 139 -6.739 -2.039 14.294 1152 HB ILE 139 HB ILE 139 -5.148 -3.704 12.323 1153 1HG1 ILE 139 HG12 ILE 139 -6.723 -1.332 11.486 1154 2HG1 ILE 139 HG13 ILE 139 -5.279 -0.990 12.440 1155 1HG2 ILE 139 HG21 ILE 139 -7.620 -4.318 12.949 1156 2HG2 ILE 139 HG22 ILE 139 -8.021 -2.881 12.010 1157 3HG2 ILE 139 HG23 ILE 139 -7.158 -4.218 11.249 1158 1HD1 ILE 139 HD11 ILE 139 -4.740 -3.028 10.447 1159 2HD1 ILE 139 HD12 ILE 139 -5.371 -1.563 9.694 1160 3HD1 ILE 139 HD13 ILE 139 -3.929 -1.484 10.706 1161 H TRP 140 H TRP 140 -4.637 -4.923 13.976 1162 HA TRP 140 HA TRP 140 -6.585 -6.692 15.128 1163 1HB TRP 140 HB2 TRP 140 -3.598 -7.151 15.135 1164 2HB TRP 140 HB3 TRP 140 -4.884 -8.354 15.040 1165 HD1 TRP 140 HD1 TRP 140 -2.701 -6.202 12.925 1166 HE1 TRP 140 HE1 TRP 140 -3.354 -6.444 10.443 1167 HE3 TRP 140 HE3 TRP 140 -7.116 -8.719 13.419 1168 HZ2 TRP 140 HZ2 TRP 140 -5.471 -7.559 8.874 1169 HZ3 TRP 140 HZ3 TRP 140 -8.430 -9.358 11.417 1170 HH2 TRP 140 HH2 TRP 140 -7.613 -8.781 9.147 1171 H SER 141 H SER 141 -4.723 -4.287 16.554 1172 HA SER 141 HA SER 141 -4.275 -5.660 19.110 1173 1HB SER 141 HB2 SER 141 -2.697 -3.928 18.375 1174 2HB SER 141 HB3 SER 141 -3.998 -2.743 18.320 1175 HG SER 141 HG SER 141 -3.555 -4.199 20.676 1176 H GLU 142 H GLU 142 -6.344 -6.227 19.882 1177 HA GLU 142 HA GLU 142 -8.177 -3.926 20.429 1178 1HB GLU 142 HB2 GLU 142 -9.049 -6.811 20.406 1179 2HB GLU 142 HB3 GLU 142 -10.028 -5.361 20.186 1180 1HG GLU 142 HG2 GLU 142 -8.389 -5.033 18.098 1181 2HG GLU 142 HG3 GLU 142 -8.290 -6.790 18.225 1182 H ASP 143 H ASP 143 -7.819 -7.229 21.764 1183 HA ASP 143 HA ASP 143 -7.627 -7.936 23.994 1184 1HB ASP 143 HB2 ASP 143 -5.529 -6.779 24.073 1185 2HB ASP 143 HB3 ASP 143 -6.326 -5.207 24.155 1186 H ASN 144 H ASN 144 -8.484 -7.414 26.239 1187 HA ASN 144 HA ASN 144 -10.936 -5.736 25.961 1188 1HB ASN 144 HB2 ASN 144 -10.940 -8.289 26.618 1189 2HB ASN 144 HB3 ASN 144 -10.504 -7.675 28.214 1190 1HD2 ASN 144 HD21 ASN 144 -12.007 -5.796 29.005 1191 2HD2 ASN 144 HD22 ASN 144 -13.659 -5.947 28.643 1192 H ALA 145 H ALA 145 -9.307 -3.900 26.365 1193 HA ALA 145 HA ALA 145 -8.724 -3.632 29.283 1194 1HB ALA 145 HB1 ALA 145 -7.243 -2.961 26.892 1195 2HB ALA 145 HB2 ALA 145 -7.520 -1.510 27.857 1196 3HB ALA 145 HB3 ALA 145 -6.712 -2.904 28.574 1197 H ASP 146 H ASP 146 -10.550 -2.329 26.623 1198 HA ASP 146 HA ASP 146 -12.259 -0.807 28.345 1199 1HB ASP 146 HB2 ASP 146 -9.868 0.502 27.890 1200 2HB ASP 146 HB3 ASP 146 -10.916 1.175 26.641 1201 H SER 147 H SER 147 -14.125 -1.101 27.227 1202 HA SER 147 HA SER 147 -14.652 0.018 24.686 1203 1HB SER 147 HB2 SER 147 -13.057 -2.228 24.389 1204 2HB SER 147 HB3 SER 147 -14.679 -2.863 24.135 1205 HG SER 147 HG SER 147 -13.519 -0.608 22.849 1206 H GLY 148 H GLY 148 -16.857 0.081 24.481 1207 1HA GLY 148 HA2 GLY 148 -19.088 -0.810 24.608 1208 2HA GLY 148 HA3 GLY 148 -18.487 -2.090 25.665 1209 H GLN 149 H GLN 149 -17.942 -1.480 27.905 1210 HA GLN 149 HA GLN 149 -19.459 0.940 28.799 1211 1HB GLN 149 HB2 GLN 149 -19.987 -0.297 30.864 1212 2HB GLN 149 HB3 GLN 149 -20.581 -1.166 29.449 1213 1HG GLN 149 HG2 GLN 149 -18.133 -2.260 29.598 1214 2HG GLN 149 HG3 GLN 149 -18.352 -1.860 31.301 1215 1HE2 GLN 149 HE21 GLN 149 -18.305 -4.590 30.329 1216 2HE2 GLN 149 HE22 GLN 149 -19.845 -5.257 30.590 1217 HN3 PTP 150 H3 PTP 150 -8.649 -2.999 -8.124 1218 1H5M PTP 150 H51 PTP 150 -6.474 -0.499 -4.120 1219 2H5M PTP 150 H52 PTP 150 -6.264 -2.263 -4.235 1220 3H5M PTP 150 H53 PTP 150 -7.519 -1.583 -3.171 1221 H6 PTP 150 H6 PTP 150 -9.188 0.012 -4.417 1222 H1* PTP 150 H1' PTP 150 -11.449 0.405 -7.277 1223 2H2* PTP 150 H2' PTP 150 -11.969 -1.076 -4.694 1224 H3* PTP 150 H3' PTP 150 -13.199 0.769 -3.797 1225 H4* PTP 150 H4' PTP 150 -11.783 2.897 -4.731 1226 2H5* PTP 150 H5' PTP 150 -10.868 0.530 -2.995 Start of MODEL 26 1 1H ALA 1 H1 ALA 1 11.817 -17.157 -20.180 2 2H ALA 1 H2 ALA 1 13.456 -17.411 -19.810 3 3H ALA 1 H3 ALA 1 12.429 -18.737 -20.061 4 HA ALA 1 HA ALA 1 11.502 -16.966 -17.996 5 1HB ALA 1 HB1 ALA 1 11.240 -19.651 -18.784 6 2HB ALA 1 HB2 ALA 1 12.116 -19.705 -17.254 7 3HB ALA 1 HB3 ALA 1 10.548 -18.903 -17.344 8 H THR 2 H THR 2 13.937 -15.961 -18.306 9 HA THR 2 HA THR 2 15.639 -17.307 -16.247 10 HB THR 2 HB THR 2 17.071 -15.291 -17.710 11 HG1 THR 2 HG1 THR 2 16.751 -15.913 -19.749 12 1HG2 THR 2 HG21 THR 2 17.209 -18.272 -17.327 13 2HG2 THR 2 HG22 THR 2 18.314 -17.463 -18.439 14 3HG2 THR 2 HG23 THR 2 18.306 -17.028 -16.730 15 H SER 3 H SER 3 13.466 -14.883 -16.523 16 HA SER 3 HA SER 3 14.578 -12.519 -15.581 17 1HB SER 3 HB2 SER 3 12.014 -13.835 -14.642 18 2HB SER 3 HB3 SER 3 12.433 -12.147 -14.371 19 HG SER 3 HG SER 3 11.417 -13.344 -16.570 20 H THR 4 H THR 4 15.119 -11.712 -13.494 21 HA THR 4 HA THR 4 15.795 -13.854 -11.530 22 HB THR 4 HB THR 4 16.868 -11.023 -11.730 23 HG1 THR 4 HG1 THR 4 18.696 -12.862 -12.213 24 1HG2 THR 4 HG21 THR 4 17.076 -13.148 -9.742 25 2HG2 THR 4 HG22 THR 4 18.655 -12.649 -10.346 26 3HG2 THR 4 HG23 THR 4 17.569 -11.459 -9.631 27 H LYS 5 H LYS 5 13.659 -11.262 -12.082 28 HA LYS 5 HA LYS 5 12.755 -11.429 -9.253 29 1HB LYS 5 HB2 LYS 5 13.243 -8.854 -10.784 30 2HB LYS 5 HB3 LYS 5 12.413 -8.953 -9.230 31 1HG LYS 5 HG2 LYS 5 14.913 -10.398 -9.107 32 2HG LYS 5 HG3 LYS 5 15.195 -8.748 -9.662 33 1HD LYS 5 HD2 LYS 5 14.367 -7.800 -7.706 34 2HD LYS 5 HD3 LYS 5 13.359 -9.199 -7.334 35 1HE LYS 5 HE2 LYS 5 15.068 -9.501 -5.794 36 2HE LYS 5 HE3 LYS 5 15.701 -10.428 -7.156 37 1HZ LYS 5 HZ1 LYS 5 16.798 -8.277 -7.857 38 2HZ LYS 5 HZ2 LYS 5 16.435 -7.692 -6.305 39 3HZ LYS 5 HZ3 LYS 5 17.444 -9.044 -6.486 40 H LYS 6 H LYS 6 11.639 -12.698 -11.529 41 HA LYS 6 HA LYS 6 9.649 -12.853 -12.777 42 1HB LYS 6 HB2 LYS 6 8.816 -13.159 -10.477 43 2HB LYS 6 HB3 LYS 6 8.639 -11.414 -10.302 44 1HG LYS 6 HG2 LYS 6 6.736 -11.354 -11.556 45 2HG LYS 6 HG3 LYS 6 7.327 -12.573 -12.685 46 1HD LYS 6 HD2 LYS 6 6.659 -13.402 -9.882 47 2HD LYS 6 HD3 LYS 6 5.345 -13.147 -11.031 48 1HE LYS 6 HE2 LYS 6 7.698 -14.788 -11.891 49 2HE LYS 6 HE3 LYS 6 6.501 -15.521 -10.823 50 1HZ LYS 6 HZ1 LYS 6 4.841 -14.515 -12.519 51 2HZ LYS 6 HZ2 LYS 6 6.177 -14.517 -13.566 52 3HZ LYS 6 HZ3 LYS 6 5.634 -15.973 -12.880 53 H LEU 7 H LEU 7 8.264 -9.977 -11.390 54 HA LEU 7 HA LEU 7 8.148 -8.738 -14.025 55 1HB LEU 7 HB2 LEU 7 7.305 -7.793 -11.271 56 2HB LEU 7 HB3 LEU 7 7.065 -6.843 -12.738 57 HG LEU 7 HG LEU 7 6.146 -9.660 -12.865 58 1HD1 LEU 7 HD11 LEU 7 5.536 -8.455 -10.538 59 2HD1 LEU 7 HD12 LEU 7 4.263 -7.767 -11.546 60 3HD1 LEU 7 HD13 LEU 7 4.402 -9.517 -11.374 61 1HD2 LEU 7 HD21 LEU 7 5.669 -7.088 -14.122 62 2HD2 LEU 7 HD22 LEU 7 5.230 -8.699 -14.691 63 3HD2 LEU 7 HD23 LEU 7 4.148 -7.821 -13.609 64 H HIS 8 H HIS 8 8.653 -6.110 -13.746 65 HA HIS 8 HA HIS 8 11.506 -6.022 -12.856 66 1HB HIS 8 HB2 HIS 8 11.338 -3.973 -14.627 67 2HB HIS 8 HB3 HIS 8 11.839 -5.601 -15.075 68 HD1 HIS 8 HD1 HIS 8 10.307 -6.914 -16.614 69 HD2 HIS 8 HD2 HIS 8 8.536 -3.404 -15.228 70 HE1 HIS 8 HE1 HIS 8 8.151 -6.638 -17.913 71 H LYS 9 H LYS 9 12.145 -4.258 -11.616 72 HA LYS 9 HA LYS 9 9.925 -2.533 -10.634 73 1HB LYS 9 HB2 LYS 9 12.667 -2.764 -9.397 74 2HB LYS 9 HB3 LYS 9 11.159 -2.260 -8.633 75 1HG LYS 9 HG2 LYS 9 10.263 -4.533 -8.849 76 2HG LYS 9 HG3 LYS 9 11.733 -5.049 -9.676 77 1HD LYS 9 HD2 LYS 9 12.587 -5.554 -7.653 78 2HD LYS 9 HD3 LYS 9 12.635 -3.822 -7.323 79 1HE LYS 9 HE2 LYS 9 11.285 -4.427 -5.571 80 2HE LYS 9 HE3 LYS 9 10.029 -4.293 -6.803 81 1HZ LYS 9 HZ1 LYS 9 10.720 -6.755 -7.260 82 2HZ LYS 9 HZ2 LYS 9 11.263 -6.692 -5.654 83 3HZ LYS 9 HZ3 LYS 9 9.631 -6.379 -6.011 84 H GLU 10 H GLU 10 9.876 -0.463 -11.355 85 HA GLU 10 HA GLU 10 12.368 0.665 -12.547 86 1HB GLU 10 HB2 GLU 10 9.502 0.868 -13.181 87 2HB GLU 10 HB3 GLU 10 10.331 2.425 -13.165 88 1HG GLU 10 HG2 GLU 10 11.028 1.915 -15.254 89 2HG GLU 10 HG3 GLU 10 12.122 0.765 -14.484 90 HA PRO 11 HA PRO 11 12.626 3.690 -9.366 91 1HB PRO 11 HB2 PRO 11 13.621 5.818 -10.755 92 2HB PRO 11 HB3 PRO 11 14.570 4.369 -10.389 93 1HG PRO 11 HG2 PRO 11 13.348 5.219 -12.969 94 2HG PRO 11 HG3 PRO 11 14.798 4.246 -12.678 95 1HD PRO 11 HD2 PRO 11 12.268 3.245 -13.418 96 2HD PRO 11 HD3 PRO 11 13.618 2.287 -12.772 97 H ALA 12 H ALA 12 11.803 5.789 -8.626 98 HA ALA 12 HA ALA 12 9.725 7.078 -10.289 99 1HB ALA 12 HB1 ALA 12 9.182 5.533 -7.765 100 2HB ALA 12 HB2 ALA 12 8.188 6.933 -8.168 101 3HB ALA 12 HB3 ALA 12 8.263 5.557 -9.269 102 H THR 13 H THR 13 8.678 8.889 -8.682 103 HA THR 13 HA THR 13 10.955 10.082 -7.154 104 HB THR 13 HB THR 13 9.026 11.698 -8.831 105 HG1 THR 13 HG1 THR 13 10.358 10.186 -10.054 106 1HG2 THR 13 HG21 THR 13 11.712 12.257 -7.548 107 2HG2 THR 13 HG22 THR 13 10.883 13.371 -8.634 108 3HG2 THR 13 HG23 THR 13 10.156 12.945 -7.085 109 H LEU 14 H LEU 14 10.378 10.844 -5.152 110 HA LEU 14 HA LEU 14 7.596 10.470 -4.293 111 1HB LEU 14 HB2 LEU 14 9.758 9.976 -2.928 112 2HB LEU 14 HB3 LEU 14 9.770 11.713 -2.616 113 HG LEU 14 HG LEU 14 8.576 10.425 -0.841 114 1HD1 LEU 14 HD11 LEU 14 7.989 12.814 -1.570 115 2HD1 LEU 14 HD12 LEU 14 6.620 12.101 -2.425 116 3HD1 LEU 14 HD13 LEU 14 6.746 11.940 -0.673 117 1HD2 LEU 14 HD21 LEU 14 7.548 9.015 -3.015 118 2HD2 LEU 14 HD22 LEU 14 6.999 8.881 -1.344 119 3HD2 LEU 14 HD23 LEU 14 6.181 9.978 -2.457 120 H ILE 15 H ILE 15 6.476 12.114 -5.457 121 HA ILE 15 HA ILE 15 7.325 14.890 -5.362 122 HB ILE 15 HB ILE 15 4.716 13.575 -6.161 123 1HG1 ILE 15 HG12 ILE 15 7.026 14.795 -7.703 124 2HG1 ILE 15 HG13 ILE 15 6.552 13.096 -7.678 125 1HG2 ILE 15 HG21 ILE 15 5.581 16.473 -6.189 126 2HG2 ILE 15 HG22 ILE 15 4.287 15.862 -7.220 127 3HG2 ILE 15 HG23 ILE 15 4.127 15.785 -5.466 128 1HD1 ILE 15 HD11 ILE 15 4.224 14.056 -8.483 129 2HD1 ILE 15 HD12 ILE 15 5.209 15.417 -9.019 130 3HD1 ILE 15 HD13 ILE 15 5.527 13.799 -9.643 131 H LYS 16 H LYS 16 4.317 13.414 -4.085 132 HA LYS 16 HA LYS 16 4.732 14.692 -1.481 133 1HB LYS 16 HB2 LYS 16 3.804 16.515 -2.981 134 2HB LYS 16 HB3 LYS 16 2.341 15.541 -3.136 135 1HG LYS 16 HG2 LYS 16 2.835 15.581 -0.391 136 2HG LYS 16 HG3 LYS 16 3.209 17.222 -0.918 137 1HD LYS 16 HD2 LYS 16 0.691 15.844 -1.837 138 2HD LYS 16 HD3 LYS 16 0.750 16.680 -0.285 139 1HE LYS 16 HE2 LYS 16 0.923 18.757 -1.253 140 2HE LYS 16 HE3 LYS 16 1.819 18.148 -2.645 141 1HZ LYS 16 HZ1 LYS 16 -0.289 17.069 -3.369 142 2HZ LYS 16 HZ2 LYS 16 -1.093 17.917 -2.136 143 3HZ LYS 16 HZ3 LYS 16 -0.330 18.767 -3.389 144 H ALA 17 H ALA 17 4.101 13.081 -0.142 145 HA ALA 17 HA ALA 17 2.154 11.075 -1.027 146 1HB ALA 17 HB1 ALA 17 4.119 10.409 0.310 147 2HB ALA 17 HB2 ALA 17 3.562 11.427 1.637 148 3HB ALA 17 HB3 ALA 17 2.622 10.015 1.153 149 H ILE 18 H ILE 18 0.052 10.857 -0.257 150 HA ILE 18 HA ILE 18 -0.959 13.140 1.387 151 HB ILE 18 HB ILE 18 -2.454 11.285 -0.494 152 1HG1 ILE 18 HG12 ILE 18 -1.605 14.188 -0.761 153 2HG1 ILE 18 HG13 ILE 18 -0.960 12.829 -1.686 154 1HG2 ILE 18 HG21 ILE 18 -3.468 12.656 1.659 155 2HG2 ILE 18 HG22 ILE 18 -3.660 13.835 0.362 156 3HG2 ILE 18 HG23 ILE 18 -4.391 12.237 0.217 157 1HD1 ILE 18 HD11 ILE 18 -3.816 12.777 -1.888 158 2HD1 ILE 18 HD12 ILE 18 -3.265 14.410 -2.265 159 3HD1 ILE 18 HD13 ILE 18 -2.634 13.034 -3.171 160 H ASP 19 H ASP 19 -1.955 9.753 0.777 161 HA ASP 19 HA ASP 19 -2.493 9.518 3.705 162 1HB ASP 19 HB2 ASP 19 -3.540 7.785 1.445 163 2HB ASP 19 HB3 ASP 19 -4.050 7.735 3.134 164 H GLY 20 H GLY 20 -2.474 6.787 4.000 165 1HA GLY 20 HA2 GLY 20 0.398 6.219 3.875 166 2HA GLY 20 HA3 GLY 20 -0.831 5.188 4.612 167 H ASP 21 H ASP 21 -2.457 5.409 2.059 168 HA ASP 21 HA ASP 21 -0.833 3.473 0.453 169 1HB ASP 21 HB2 ASP 21 -3.830 3.594 0.911 170 2HB ASP 21 HB3 ASP 21 -3.048 2.514 -0.244 171 H THR 22 H THR 22 -1.606 6.565 0.392 172 HA THR 22 HA THR 22 -2.007 6.570 -2.564 173 HB THR 22 HB THR 22 -3.419 8.329 -0.535 174 HG1 THR 22 HG1 THR 22 -5.153 7.216 -1.093 175 1HG2 THR 22 HG21 THR 22 -2.525 9.085 -3.049 176 2HG2 THR 22 HG22 THR 22 -4.189 8.583 -3.346 177 3HG2 THR 22 HG23 THR 22 -3.846 9.840 -2.159 178 H VAL 23 H VAL 23 -0.149 7.447 -3.356 179 HA VAL 23 HA VAL 23 0.821 9.975 -2.139 180 HB VAL 23 HB VAL 23 3.103 9.210 -1.996 181 1HG1 VAL 23 HG11 VAL 23 1.359 8.529 -0.202 182 2HG1 VAL 23 HG12 VAL 23 1.504 6.908 -0.881 183 3HG1 VAL 23 HG13 VAL 23 2.917 7.703 -0.187 184 1HG2 VAL 23 HG21 VAL 23 2.016 6.985 -3.642 185 2HG2 VAL 23 HG22 VAL 23 3.604 7.749 -3.693 186 3HG2 VAL 23 HG23 VAL 23 3.246 6.542 -2.458 187 H LYS 24 H LYS 24 1.567 11.399 -3.679 188 HA LYS 24 HA LYS 24 1.286 10.586 -6.496 189 1HB LYS 24 HB2 LYS 24 2.150 13.279 -5.410 190 2HB LYS 24 HB3 LYS 24 1.483 12.928 -7.005 191 1HG LYS 24 HG2 LYS 24 -0.309 11.953 -4.966 192 2HG LYS 24 HG3 LYS 24 0.054 13.655 -4.679 193 1HD LYS 24 HD2 LYS 24 -0.490 14.134 -7.068 194 2HD LYS 24 HD3 LYS 24 -0.968 12.447 -7.265 195 1HE LYS 24 HE2 LYS 24 -3.031 13.263 -6.705 196 2HE LYS 24 HE3 LYS 24 -2.412 13.079 -5.063 197 1HZ LYS 24 HZ1 LYS 24 -1.842 15.559 -6.522 198 2HZ LYS 24 HZ2 LYS 24 -3.391 15.341 -5.868 199 3HZ LYS 24 HZ3 LYS 24 -2.030 15.305 -4.854 200 H LEU 25 H LEU 25 3.000 9.988 -7.746 201 HA LEU 25 HA LEU 25 5.722 10.884 -6.923 202 1HB LEU 25 HB2 LEU 25 5.333 8.103 -7.980 203 2HB LEU 25 HB3 LEU 25 6.615 8.734 -6.947 204 HG LEU 25 HG LEU 25 3.736 8.452 -6.054 205 1HD1 LEU 25 HD11 LEU 25 5.152 6.302 -6.644 206 2HD1 LEU 25 HD12 LEU 25 5.956 6.666 -5.117 207 3HD1 LEU 25 HD13 LEU 25 4.219 6.364 -5.149 208 1HD2 LEU 25 HD21 LEU 25 5.833 9.940 -5.020 209 2HD2 LEU 25 HD22 LEU 25 4.425 9.395 -4.109 210 3HD2 LEU 25 HD23 LEU 25 5.911 8.447 -4.084 211 H MET 26 H MET 26 7.320 10.499 -8.765 212 HA MET 26 HA MET 26 5.955 11.144 -11.332 213 1HB MET 26 HB2 MET 26 7.897 12.543 -10.129 214 2HB MET 26 HB3 MET 26 8.910 11.408 -11.021 215 1HG MET 26 HG2 MET 26 6.988 12.163 -12.883 216 2HG MET 26 HG3 MET 26 7.333 13.659 -12.015 217 1HE MET 26 HE1 MET 26 8.567 15.034 -12.509 218 2HE MET 26 HE2 MET 26 10.324 14.898 -12.540 219 3HE MET 26 HE3 MET 26 9.419 15.060 -14.051 220 H TYR 27 H TYR 27 6.256 9.849 -13.127 221 HA TYR 27 HA TYR 27 8.251 7.653 -12.979 222 1HB TYR 27 HB2 TYR 27 6.146 6.704 -12.110 223 2HB TYR 27 HB3 TYR 27 5.301 7.239 -13.562 224 HD1 TYR 27 HD1 TYR 27 7.837 4.904 -12.226 225 HD2 TYR 27 HD2 TYR 27 5.580 6.099 -15.679 226 HE1 TYR 27 HE1 TYR 27 8.518 2.823 -13.392 227 HE2 TYR 27 HE2 TYR 27 6.261 4.020 -16.845 228 HH TYR 27 HH TYR 27 7.017 1.689 -16.152 229 H LYS 28 H LYS 28 9.391 7.823 -14.849 230 HA LYS 28 HA LYS 28 9.890 8.268 -17.100 231 1HB LYS 28 HB2 LYS 28 7.159 7.064 -17.115 232 2HB LYS 28 HB3 LYS 28 7.709 7.836 -18.602 233 1HG LYS 28 HG2 LYS 28 8.281 5.392 -18.472 234 2HG LYS 28 HG3 LYS 28 9.688 6.437 -18.667 235 1HD LYS 28 HD2 LYS 28 10.285 6.241 -16.372 236 2HD LYS 28 HD3 LYS 28 8.718 5.548 -15.947 237 1HE LYS 28 HE2 LYS 28 9.497 3.479 -16.350 238 2HE LYS 28 HE3 LYS 28 9.911 3.938 -18.001 239 1HZ LYS 28 HZ1 LYS 28 11.878 5.113 -16.660 240 2HZ LYS 28 HZ2 LYS 28 11.593 3.786 -15.638 241 3HZ LYS 28 HZ3 LYS 28 11.986 3.535 -17.272 242 H GLY 29 H GLY 29 8.883 10.446 -15.376 243 1HA GLY 29 HA2 GLY 29 8.472 12.741 -15.726 244 2HA GLY 29 HA3 GLY 29 8.429 12.418 -17.462 245 H GLN 30 H GLN 30 6.437 10.839 -14.997 246 HA GLN 30 HA GLN 30 4.059 12.298 -16.039 247 1HB GLN 30 HB2 GLN 30 4.389 10.036 -17.175 248 2HB GLN 30 HB3 GLN 30 4.073 9.307 -15.599 249 1HG GLN 30 HG2 GLN 30 1.868 9.481 -16.009 250 2HG GLN 30 HG3 GLN 30 2.043 11.237 -15.998 251 1HE2 GLN 30 HE21 GLN 30 0.514 9.173 -17.830 252 2HE2 GLN 30 HE22 GLN 30 0.895 9.714 -19.393 253 HA PRO 31 HA PRO 31 3.669 12.364 -11.532 254 1HB PRO 31 HB2 PRO 31 1.904 14.450 -11.508 255 2HB PRO 31 HB3 PRO 31 3.653 14.672 -11.696 256 1HG PRO 31 HG2 PRO 31 1.499 14.808 -13.765 257 2HG PRO 31 HG3 PRO 31 3.013 15.721 -13.653 258 1HD PRO 31 HD2 PRO 31 2.600 13.528 -15.327 259 2HD PRO 31 HD3 PRO 31 4.192 14.131 -14.816 260 H MET 32 H MET 32 2.310 10.888 -10.570 261 HA MET 32 HA MET 32 -0.580 10.980 -11.185 262 1HB MET 32 HB2 MET 32 1.198 8.966 -12.254 263 2HB MET 32 HB3 MET 32 0.034 8.226 -11.154 264 1HG MET 32 HG2 MET 32 -1.824 9.196 -12.369 265 2HG MET 32 HG3 MET 32 -0.727 10.135 -13.382 266 1HE MET 32 HE1 MET 32 -1.191 6.824 -11.863 267 2HE MET 32 HE2 MET 32 -1.149 5.613 -13.152 268 3HE MET 32 HE3 MET 32 0.352 6.274 -12.510 269 H THR 33 H THR 33 -1.695 9.221 -9.712 270 HA THR 33 HA THR 33 -0.387 9.417 -7.034 271 HB THR 33 HB THR 33 -3.263 8.668 -7.324 272 HG1 THR 33 HG1 THR 33 -2.105 11.101 -8.064 273 1HG2 THR 33 HG21 THR 33 -2.017 8.895 -5.135 274 2HG2 THR 33 HG22 THR 33 -1.868 10.618 -5.478 275 3HG2 THR 33 HG23 THR 33 -3.463 9.895 -5.266 276 H PHE 34 H PHE 34 0.777 7.520 -6.831 277 HA PHE 34 HA PHE 34 -0.275 4.981 -7.829 278 1HB PHE 34 HB2 PHE 34 2.197 5.834 -6.343 279 2HB PHE 34 HB3 PHE 34 1.784 4.122 -6.459 280 HD1 PHE 34 HD1 PHE 34 2.676 7.156 -8.378 281 HD2 PHE 34 HD2 PHE 34 1.890 2.936 -8.567 282 HE1 PHE 34 HE1 PHE 34 3.592 7.088 -10.681 283 HE2 PHE 34 HE2 PHE 34 2.806 2.869 -10.870 284 HZ PHE 34 HZ PHE 34 3.656 4.944 -11.927 285 H ARG 35 H ARG 35 -1.162 3.320 -6.585 286 HA ARG 35 HA ARG 35 -1.659 3.972 -3.706 287 1HB ARG 35 HB2 ARG 35 -3.513 3.257 -5.878 288 2HB ARG 35 HB3 ARG 35 -3.728 2.299 -4.412 289 1HG ARG 35 HG2 ARG 35 -3.346 4.940 -3.520 290 2HG ARG 35 HG3 ARG 35 -4.439 5.067 -4.900 291 1HD ARG 35 HD2 ARG 35 -5.699 4.714 -2.805 292 2HD ARG 35 HD3 ARG 35 -5.904 3.351 -3.905 293 HE ARG 35 HE ARG 35 -3.709 2.964 -2.029 294 1HH1 ARG 35 HH11 ARG 35 -6.518 3.628 -0.743 295 2HH1 ARG 35 HH12 ARG 35 -7.030 2.018 -0.356 296 1HH2 ARG 35 HH21 ARG 35 -4.617 0.493 -2.323 297 2HH2 ARG 35 HH22 ARG 35 -5.956 0.244 -1.252 298 H LEU 36 H LEU 36 -1.604 2.179 -2.260 299 HA LEU 36 HA LEU 36 0.173 0.034 -3.045 300 1HB LEU 36 HB2 LEU 36 -1.521 0.400 -0.554 301 2HB LEU 36 HB3 LEU 36 -0.269 -0.828 -0.751 302 HG LEU 36 HG LEU 36 0.211 2.155 -0.994 303 1HD1 LEU 36 HD11 LEU 36 -0.283 0.723 1.331 304 2HD1 LEU 36 HD12 LEU 36 1.478 0.722 1.223 305 3HD1 LEU 36 HD13 LEU 36 0.596 2.249 1.235 306 1HD2 LEU 36 HD21 LEU 36 1.711 -0.127 -1.803 307 2HD2 LEU 36 HD22 LEU 36 2.221 1.561 -1.821 308 3HD2 LEU 36 HD23 LEU 36 2.526 0.563 -0.399 309 H LEU 37 H LEU 37 -0.366 -1.952 -3.851 310 HA LEU 37 HA LEU 37 -3.227 -2.524 -4.304 311 1HB LEU 37 HB2 LEU 37 -0.639 -3.669 -5.329 312 2HB LEU 37 HB3 LEU 37 -2.149 -4.556 -5.535 313 HG LEU 37 HG LEU 37 -1.898 -1.657 -6.336 314 1HD1 LEU 37 HD11 LEU 37 -0.219 -3.344 -7.451 315 2HD1 LEU 37 HD12 LEU 37 -1.654 -3.918 -8.301 316 3HD1 LEU 37 HD13 LEU 37 -1.143 -2.240 -8.470 317 1HD2 LEU 37 HD21 LEU 37 -4.036 -3.452 -6.157 318 2HD2 LEU 37 HD22 LEU 37 -4.029 -1.926 -7.043 319 3HD2 LEU 37 HD23 LEU 37 -3.630 -3.430 -7.873 320 H LEU 38 H LEU 38 -4.056 -4.730 -3.865 321 HA LEU 38 HA LEU 38 -4.538 -6.453 -2.356 322 1HB LEU 38 HB2 LEU 38 -1.514 -6.405 -2.248 323 2HB LEU 38 HB3 LEU 38 -2.487 -7.629 -1.431 324 HG LEU 38 HG LEU 38 -2.797 -7.029 -4.377 325 1HD1 LEU 38 HD11 LEU 38 -0.453 -7.741 -3.850 326 2HD1 LEU 38 HD12 LEU 38 -1.105 -9.205 -3.113 327 3HD1 LEU 38 HD13 LEU 38 -1.326 -8.911 -4.839 328 1HD2 LEU 38 HD21 LEU 38 -4.118 -8.708 -2.448 329 2HD2 LEU 38 HD22 LEU 38 -4.494 -8.496 -4.158 330 3HD2 LEU 38 HD23 LEU 38 -3.334 -9.726 -3.656 331 H VAL 39 H VAL 39 -4.013 -3.533 -1.363 332 HA VAL 39 HA VAL 39 -4.150 -4.300 1.506 333 HB VAL 39 HB VAL 39 -2.541 -2.677 2.194 334 1HG1 VAL 39 HG11 VAL 39 -1.851 -4.858 0.700 335 2HG1 VAL 39 HG12 VAL 39 -1.033 -3.570 -0.185 336 3HG1 VAL 39 HG13 VAL 39 -0.689 -3.820 1.527 337 1HG2 VAL 39 HG21 VAL 39 -3.270 -0.955 0.497 338 2HG2 VAL 39 HG22 VAL 39 -1.523 -1.074 0.696 339 3HG2 VAL 39 HG23 VAL 39 -2.303 -1.813 -0.703 340 H ASP 40 H ASP 40 -5.636 -3.100 2.636 341 HA ASP 40 HA ASP 40 -6.867 -0.781 1.200 342 1HB ASP 40 HB2 ASP 40 -8.459 -2.599 1.217 343 2HB ASP 40 HB3 ASP 40 -8.166 -2.905 2.928 344 H THR 41 H THR 41 -6.714 1.105 2.319 345 HA THR 41 HA THR 41 -5.686 1.041 5.076 346 HB THR 41 HB THR 41 -4.727 2.685 3.572 347 HG1 THR 41 HG1 THR 41 -4.852 4.291 4.964 348 1HG2 THR 41 HG21 THR 41 -7.409 2.862 2.636 349 2HG2 THR 41 HG22 THR 41 -6.935 4.466 3.195 350 3HG2 THR 41 HG23 THR 41 -5.974 3.640 1.968 351 HA PRO 42 HA PRO 42 -9.647 1.586 6.961 352 1HB PRO 42 HB2 PRO 42 -8.765 2.453 9.395 353 2HB PRO 42 HB3 PRO 42 -8.611 0.771 8.858 354 1HG PRO 42 HG2 PRO 42 -6.523 2.897 9.026 355 2HG PRO 42 HG3 PRO 42 -6.365 1.145 9.238 356 1HD PRO 42 HD2 PRO 42 -5.661 2.563 6.923 357 2HD PRO 42 HD3 PRO 42 -5.933 0.809 7.012 358 H GLU 43 H GLU 43 -9.840 3.553 5.353 359 HA GLU 43 HA GLU 43 -10.528 5.776 5.061 360 1HB GLU 43 HB2 GLU 43 -11.592 5.030 7.437 361 2HB GLU 43 HB3 GLU 43 -10.546 6.343 7.977 362 1HG GLU 43 HG2 GLU 43 -12.326 6.724 5.582 363 2HG GLU 43 HG3 GLU 43 -12.982 6.908 7.210 364 H THR 44 H THR 44 -9.533 7.822 4.925 365 HA THR 44 HA THR 44 -7.530 8.861 6.610 366 HB THR 44 HB THR 44 -6.155 6.935 6.058 367 HG1 THR 44 HG1 THR 44 -4.419 8.052 5.395 368 1HG2 THR 44 HG21 THR 44 -6.826 7.674 3.202 369 2HG2 THR 44 HG22 THR 44 -5.532 6.556 3.635 370 3HG2 THR 44 HG23 THR 44 -7.205 6.167 4.037 371 H LYS 45 H LYS 45 -9.704 9.703 4.879 372 HA LYS 45 HA LYS 45 -8.329 11.230 2.735 373 1HB LYS 45 HB2 LYS 45 -11.227 10.697 3.398 374 2HB LYS 45 HB3 LYS 45 -10.759 11.935 2.232 375 1HG LYS 45 HG2 LYS 45 -9.373 9.386 1.811 376 2HG LYS 45 HG3 LYS 45 -11.123 9.254 1.652 377 1HD LYS 45 HD2 LYS 45 -10.913 10.111 -0.422 378 2HD LYS 45 HD3 LYS 45 -10.466 11.640 0.337 379 1HE LYS 45 HE2 LYS 45 -8.661 11.161 -1.124 380 2HE LYS 45 HE3 LYS 45 -8.080 10.671 0.467 381 1HZ LYS 45 HZ1 LYS 45 -9.497 8.679 -1.133 382 2HZ LYS 45 HZ2 LYS 45 -7.921 9.091 -1.615 383 3HZ LYS 45 HZ3 LYS 45 -8.204 8.481 -0.054 384 H HIS 46 H HIS 46 -9.969 11.671 5.816 385 HA HIS 46 HA HIS 46 -9.163 14.546 5.716 386 1HB HIS 46 HB2 HIS 46 -11.814 13.572 5.737 387 2HB HIS 46 HB3 HIS 46 -11.498 14.154 7.371 388 HD1 HIS 46 HD1 HIS 46 -13.352 15.632 5.239 389 HD2 HIS 46 HD2 HIS 46 -9.407 16.632 6.143 390 HE1 HIS 46 HE1 HIS 46 -13.061 18.061 4.584 391 HA PRO 47 HA PRO 47 -7.304 12.731 9.465 392 1HB PRO 47 HB2 PRO 47 -5.169 14.440 9.447 393 2HB PRO 47 HB3 PRO 47 -5.233 12.967 8.461 394 1HG PRO 47 HG2 PRO 47 -5.664 15.813 7.635 395 2HG PRO 47 HG3 PRO 47 -4.900 14.486 6.743 396 1HD PRO 47 HD2 PRO 47 -7.494 15.363 6.302 397 2HD PRO 47 HD3 PRO 47 -6.909 13.733 5.899 398 H LYS 48 H LYS 48 -9.270 13.797 10.482 399 HA LYS 48 HA LYS 48 -8.472 15.806 12.378 400 1HB LYS 48 HB2 LYS 48 -10.349 17.439 11.457 401 2HB LYS 48 HB3 LYS 48 -8.701 17.526 10.832 402 1HG LYS 48 HG2 LYS 48 -9.377 16.918 8.769 403 2HG LYS 48 HG3 LYS 48 -10.247 15.523 9.403 404 1HD LYS 48 HD2 LYS 48 -11.808 17.050 8.287 405 2HD LYS 48 HD3 LYS 48 -12.142 16.998 10.018 406 1HE LYS 48 HE2 LYS 48 -10.677 19.052 10.261 407 2HE LYS 48 HE3 LYS 48 -10.649 19.152 8.500 408 1HZ LYS 48 HZ1 LYS 48 -13.157 19.081 8.649 409 2HZ LYS 48 HZ2 LYS 48 -12.977 19.389 10.309 410 3HZ LYS 48 HZ3 LYS 48 -12.410 20.513 9.174 411 H LYS 49 H LYS 49 -11.577 15.231 10.688 412 HA LYS 49 HA LYS 49 -13.140 15.108 13.045 413 1HB LYS 49 HB2 LYS 49 -14.772 13.816 11.604 414 2HB LYS 49 HB3 LYS 49 -14.230 15.342 10.904 415 1HG LYS 49 HG2 LYS 49 -12.944 14.307 9.287 416 2HG LYS 49 HG3 LYS 49 -12.648 12.883 10.284 417 1HD LYS 49 HD2 LYS 49 -14.655 11.887 9.707 418 2HD LYS 49 HD3 LYS 49 -15.456 13.431 9.410 419 1HE LYS 49 HE2 LYS 49 -13.960 13.714 7.390 420 2HE LYS 49 HE3 LYS 49 -13.424 12.052 7.638 421 1HZ LYS 49 HZ1 LYS 49 -16.150 11.925 7.766 422 2HZ LYS 49 HZ2 LYS 49 -15.854 13.018 6.499 423 3HZ LYS 49 HZ3 LYS 49 -15.185 11.461 6.448 424 H GLY 50 H GLY 50 -11.034 12.750 11.594 425 1HA GLY 50 HA2 GLY 50 -10.230 10.761 12.607 426 2HA GLY 50 HA3 GLY 50 -11.395 10.992 13.912 427 H VAL 51 H VAL 51 -11.605 8.551 13.432 428 HA VAL 51 HA VAL 51 -13.986 8.203 11.729 429 HB VAL 51 HB VAL 51 -11.409 6.672 11.273 430 1HG1 VAL 51 HG11 VAL 51 -14.211 6.228 10.203 431 2HG1 VAL 51 HG12 VAL 51 -12.768 5.458 9.544 432 3HG1 VAL 51 HG13 VAL 51 -13.271 5.116 11.198 433 1HG2 VAL 51 HG21 VAL 51 -13.062 8.600 9.630 434 2HG2 VAL 51 HG22 VAL 51 -11.354 8.721 10.055 435 3HG2 VAL 51 HG23 VAL 51 -11.889 7.508 8.892 436 H GLU 52 H GLU 52 -11.748 5.713 12.862 437 HA GLU 52 HA GLU 52 -13.806 4.926 14.887 438 1HB GLU 52 HB2 GLU 52 -12.196 3.282 12.953 439 2HB GLU 52 HB3 GLU 52 -12.728 2.570 14.476 440 1HG GLU 52 HG2 GLU 52 -15.036 2.980 13.962 441 2HG GLU 52 HG3 GLU 52 -14.610 3.983 12.574 442 H LYS 53 H LYS 53 -10.368 4.247 14.106 443 HA LYS 53 HA LYS 53 -9.549 5.219 16.748 444 1HB LYS 53 HB2 LYS 53 -10.248 3.004 17.403 445 2HB LYS 53 HB3 LYS 53 -9.412 2.278 16.031 446 1HG LYS 53 HG2 LYS 53 -7.592 2.051 17.335 447 2HG LYS 53 HG3 LYS 53 -7.468 3.811 17.387 448 1HD LYS 53 HD2 LYS 53 -7.644 3.344 19.652 449 2HD LYS 53 HD3 LYS 53 -9.347 3.556 19.242 450 1HE LYS 53 HE2 LYS 53 -8.243 0.825 18.863 451 2HE LYS 53 HE3 LYS 53 -8.411 1.371 20.531 452 1HZ LYS 53 HZ1 LYS 53 -10.710 2.114 19.116 453 2HZ LYS 53 HZ2 LYS 53 -10.412 0.471 18.801 454 3HZ LYS 53 HZ3 LYS 53 -10.575 1.010 20.400 455 H TYR 54 H TYR 54 -8.403 3.067 14.112 456 HA TYR 54 HA TYR 54 -5.823 4.554 14.160 457 1HB TYR 54 HB2 TYR 54 -6.539 1.977 12.728 458 2HB TYR 54 HB3 TYR 54 -4.926 2.675 12.876 459 HD1 TYR 54 HD1 TYR 54 -3.953 3.001 15.219 460 HD2 TYR 54 HD2 TYR 54 -7.425 0.597 14.435 461 HE1 TYR 54 HE1 TYR 54 -3.663 1.868 17.406 462 HE2 TYR 54 HE2 TYR 54 -7.135 -0.536 16.622 463 HH TYR 54 HH TYR 54 -6.048 -0.465 18.597 464 H GLY 55 H GLY 55 -7.960 5.975 13.059 465 1HA GLY 55 HA2 GLY 55 -8.215 5.632 10.217 466 2HA GLY 55 HA3 GLY 55 -8.599 7.110 11.103 467 HA PRO 56 HA PRO 56 -4.875 8.947 9.635 468 1HB PRO 56 HB2 PRO 56 -4.308 10.639 11.703 469 2HB PRO 56 HB3 PRO 56 -5.677 10.883 10.604 470 1HG PRO 56 HG2 PRO 56 -5.674 9.939 13.422 471 2HG PRO 56 HG3 PRO 56 -6.939 10.788 12.520 472 1HD PRO 56 HD2 PRO 56 -6.855 8.009 13.077 473 2HD PRO 56 HD3 PRO 56 -7.959 8.827 11.951 474 H GLU 57 H GLU 57 -3.627 6.853 9.859 475 HA GLU 57 HA GLU 57 -1.404 7.218 11.774 476 1HB GLU 57 HB2 GLU 57 -3.344 5.642 12.665 477 2HB GLU 57 HB3 GLU 57 -2.580 4.468 11.593 478 1HG GLU 57 HG2 GLU 57 -0.774 6.043 13.361 479 2HG GLU 57 HG3 GLU 57 -1.779 4.817 14.136 480 H ALA 58 H ALA 58 -2.707 4.835 9.428 481 HA ALA 58 HA ALA 58 -0.209 3.886 8.509 482 1HB ALA 58 HB1 ALA 58 -2.789 3.294 7.915 483 2HB ALA 58 HB2 ALA 58 -2.338 4.189 6.465 484 3HB ALA 58 HB3 ALA 58 -1.425 2.755 6.935 485 H SER 59 H SER 59 -1.943 6.836 7.745 486 HA SER 59 HA SER 59 -0.505 7.540 5.371 487 1HB SER 59 HB2 SER 59 -2.395 8.866 5.704 488 2HB SER 59 HB3 SER 59 -2.084 9.052 7.428 489 HG SER 59 HG SER 59 -1.183 10.516 5.287 490 H ALA 60 H ALA 60 0.152 8.057 8.816 491 HA ALA 60 HA ALA 60 2.495 9.707 8.326 492 1HB ALA 60 HB1 ALA 60 0.966 8.853 10.596 493 2HB ALA 60 HB2 ALA 60 2.662 8.463 10.883 494 3HB ALA 60 HB3 ALA 60 2.187 10.122 10.516 495 H PHE 61 H PHE 61 1.873 6.272 8.756 496 HA PHE 61 HA PHE 61 4.556 5.427 9.232 497 1HB PHE 61 HB2 PHE 61 2.619 3.927 9.519 498 2HB PHE 61 HB3 PHE 61 2.328 3.967 7.780 499 HD1 PHE 61 HD1 PHE 61 3.866 2.868 6.212 500 HD2 PHE 61 HD2 PHE 61 4.503 2.700 10.458 501 HE1 PHE 61 HE1 PHE 61 5.502 1.031 5.893 502 HE2 PHE 61 HE2 PHE 61 6.138 0.861 10.138 503 HZ PHE 61 HZ PHE 61 6.637 0.028 7.857 504 H THR 62 H THR 62 2.732 5.660 6.177 505 HA THR 62 HA THR 62 5.002 4.972 4.532 506 HB THR 62 HB THR 62 2.544 6.550 3.720 507 HG1 THR 62 HG1 THR 62 1.580 4.780 4.307 508 1HG2 THR 62 HG21 THR 62 4.863 5.633 2.324 509 2HG2 THR 62 HG22 THR 62 3.478 4.694 1.767 510 3HG2 THR 62 HG23 THR 62 3.447 6.454 1.669 511 H LYS 63 H LYS 63 3.629 8.015 5.686 512 HA LYS 63 HA LYS 63 4.973 9.875 4.101 513 1HB LYS 63 HB2 LYS 63 3.418 10.073 6.303 514 2HB LYS 63 HB3 LYS 63 4.991 10.434 7.018 515 1HG LYS 63 HG2 LYS 63 4.798 12.532 6.222 516 2HG LYS 63 HG3 LYS 63 4.918 11.867 4.592 517 1HD LYS 63 HD2 LYS 63 2.582 11.774 4.321 518 2HD LYS 63 HD3 LYS 63 2.286 11.861 6.058 519 1HE LYS 63 HE2 LYS 63 2.039 14.089 5.855 520 2HE LYS 63 HE3 LYS 63 3.738 14.195 5.396 521 1HZ LYS 63 HZ1 LYS 63 3.029 13.674 3.090 522 2HZ LYS 63 HZ2 LYS 63 1.414 13.813 3.594 523 3HZ LYS 63 HZ3 LYS 63 2.441 15.160 3.669 524 H LYS 64 H LYS 64 6.201 8.676 7.233 525 HA LYS 64 HA LYS 64 8.844 9.731 6.819 526 1HB LYS 64 HB2 LYS 64 7.500 7.976 8.788 527 2HB LYS 64 HB3 LYS 64 9.238 7.723 8.618 528 1HG LYS 64 HG2 LYS 64 9.419 9.464 10.066 529 2HG LYS 64 HG3 LYS 64 9.082 10.462 8.651 530 1HD LYS 64 HD2 LYS 64 6.680 10.410 9.164 531 2HD LYS 64 HD3 LYS 64 6.988 9.373 10.557 532 1HE LYS 64 HE2 LYS 64 6.730 11.825 11.118 533 2HE LYS 64 HE3 LYS 64 8.245 11.106 11.664 534 1HZ LYS 64 HZ1 LYS 64 8.349 12.168 8.990 535 2HZ LYS 64 HZ2 LYS 64 8.040 13.344 10.175 536 3HZ LYS 64 HZ3 LYS 64 9.429 12.374 10.281 537 H MET 65 H MET 65 7.344 6.620 6.089 538 HA MET 65 HA MET 65 9.654 5.083 5.586 539 1HB MET 65 HB2 MET 65 6.877 4.809 5.165 540 2HB MET 65 HB3 MET 65 7.637 4.533 3.598 541 1HG MET 65 HG2 MET 65 8.280 3.122 6.202 542 2HG MET 65 HG3 MET 65 7.533 2.413 4.770 543 1HE MET 65 HE1 MET 65 9.457 1.242 6.235 544 2HE MET 65 HE2 MET 65 10.385 0.493 4.938 545 3HE MET 65 HE3 MET 65 11.177 1.593 6.075 546 H VAL 66 H VAL 66 7.696 6.396 2.924 547 HA VAL 66 HA VAL 66 9.783 6.264 1.008 548 HB VAL 66 HB VAL 66 8.360 7.905 -0.286 549 1HG1 VAL 66 HG11 VAL 66 7.557 5.284 0.808 550 2HG1 VAL 66 HG12 VAL 66 6.228 6.239 0.149 551 3HG1 VAL 66 HG13 VAL 66 7.613 5.835 -0.866 552 1HG2 VAL 66 HG21 VAL 66 7.549 8.881 2.041 553 2HG2 VAL 66 HG22 VAL 66 6.461 8.868 0.654 554 3HG2 VAL 66 HG23 VAL 66 6.321 7.624 1.895 555 H GLU 67 H GLU 67 8.955 8.806 3.314 556 HA GLU 67 HA GLU 67 10.460 10.922 2.151 557 1HB GLU 67 HB2 GLU 67 9.424 10.281 4.862 558 2HB GLU 67 HB3 GLU 67 10.739 11.453 4.785 559 1HG GLU 67 HG2 GLU 67 9.240 12.423 2.790 560 2HG GLU 67 HG3 GLU 67 7.958 11.657 3.729 561 H ASN 68 H ASN 68 11.440 8.232 4.218 562 HA ASN 68 HA ASN 68 14.262 9.188 4.022 563 1HB ASN 68 HB2 ASN 68 12.840 7.371 5.969 564 2HB ASN 68 HB3 ASN 68 14.600 7.391 5.846 565 1HD2 ASN 68 HD21 ASN 68 11.777 9.468 6.569 566 2HD2 ASN 68 HD22 ASN 68 12.655 10.631 7.441 567 H ALA 69 H ALA 69 12.249 7.272 2.343 568 HA ALA 69 HA ALA 69 13.675 4.785 2.146 569 1HB ALA 69 HB1 ALA 69 11.805 6.211 0.236 570 2HB ALA 69 HB2 ALA 69 12.451 4.598 -0.068 571 3HB ALA 69 HB3 ALA 69 11.412 4.883 1.329 572 H LYS 70 H LYS 70 15.752 4.638 1.465 573 HA LYS 70 HA LYS 70 17.046 6.712 -0.079 574 1HB LYS 70 HB2 LYS 70 17.978 3.862 0.362 575 2HB LYS 70 HB3 LYS 70 18.980 5.249 -0.064 576 1HG LYS 70 HG2 LYS 70 17.340 5.075 2.478 577 2HG LYS 70 HG3 LYS 70 19.052 4.659 2.383 578 1HD LYS 70 HD2 LYS 70 19.587 6.927 1.623 579 2HD LYS 70 HD3 LYS 70 17.876 7.355 1.648 580 1HE LYS 70 HE2 LYS 70 18.929 6.201 4.164 581 2HE LYS 70 HE3 LYS 70 19.561 7.792 3.739 582 1HZ LYS 70 HZ1 LYS 70 16.896 7.977 3.220 583 2HZ LYS 70 HZ2 LYS 70 16.949 7.054 4.644 584 3HZ LYS 70 HZ3 LYS 70 17.684 8.582 4.597 585 H LYS 71 H LYS 71 15.109 4.000 -0.926 586 HA LYS 71 HA LYS 71 15.706 4.520 -3.790 587 1HB LYS 71 HB2 LYS 71 15.392 1.684 -2.825 588 2HB LYS 71 HB3 LYS 71 16.109 2.269 -4.328 589 1HG LYS 71 HG2 LYS 71 18.046 3.105 -3.176 590 2HG LYS 71 HG3 LYS 71 17.298 2.832 -1.602 591 1HD LYS 71 HD2 LYS 71 17.138 0.341 -2.412 592 2HD LYS 71 HD3 LYS 71 18.406 0.822 -3.541 593 1HE LYS 71 HE2 LYS 71 18.699 1.547 -0.647 594 2HE LYS 71 HE3 LYS 71 19.041 -0.109 -1.150 595 1HZ LYS 71 HZ1 LYS 71 20.185 1.888 -2.875 596 2HZ LYS 71 HZ2 LYS 71 20.783 1.948 -1.285 597 3HZ LYS 71 HZ3 LYS 71 20.899 0.512 -2.185 598 H ILE 72 H ILE 72 13.807 4.817 -4.848 599 HA ILE 72 HA ILE 72 11.362 3.520 -3.705 600 HB ILE 72 HB ILE 72 11.551 6.202 -5.113 601 1HG1 ILE 72 HG12 ILE 72 10.550 6.306 -2.417 602 2HG1 ILE 72 HG13 ILE 72 12.110 5.481 -2.419 603 1HG2 ILE 72 HG21 ILE 72 9.244 4.771 -3.758 604 2HG2 ILE 72 HG22 ILE 72 9.185 6.416 -4.390 605 3HG2 ILE 72 HG23 ILE 72 9.412 5.057 -5.489 606 1HD1 ILE 72 HD11 ILE 72 12.158 7.784 -4.184 607 2HD1 ILE 72 HD12 ILE 72 11.680 8.253 -2.552 608 3HD1 ILE 72 HD13 ILE 72 13.206 7.410 -2.816 609 H GLU 73 H GLU 73 11.110 1.804 -5.104 610 HA GLU 73 HA GLU 73 10.938 2.482 -8.013 611 1HB GLU 73 HB2 GLU 73 11.762 -0.240 -7.010 612 2HB GLU 73 HB3 GLU 73 12.017 0.469 -8.606 613 1HG GLU 73 HG2 GLU 73 13.362 2.276 -7.152 614 2HG GLU 73 HG3 GLU 73 13.545 0.889 -6.078 615 H VAL 74 H VAL 74 9.047 1.857 -8.978 616 HA VAL 74 HA VAL 74 7.096 0.381 -7.288 617 HB VAL 74 HB VAL 74 5.430 1.184 -8.961 618 1HG1 VAL 74 HG11 VAL 74 6.690 2.610 -6.964 619 2HG1 VAL 74 HG12 VAL 74 6.839 3.694 -8.348 620 3HG1 VAL 74 HG13 VAL 74 5.247 3.142 -7.826 621 1HG2 VAL 74 HG21 VAL 74 7.289 1.284 -10.783 622 2HG2 VAL 74 HG22 VAL 74 6.046 2.534 -10.794 623 3HG2 VAL 74 HG23 VAL 74 7.638 2.880 -10.120 624 H GLU 75 H GLU 75 5.759 -1.298 -8.385 625 HA GLU 75 HA GLU 75 7.143 -2.573 -10.698 626 1HB GLU 75 HB2 GLU 75 7.915 -3.727 -8.670 627 2HB GLU 75 HB3 GLU 75 6.243 -3.992 -8.172 628 1HG GLU 75 HG2 GLU 75 5.821 -5.426 -10.051 629 2HG GLU 75 HG3 GLU 75 7.356 -4.990 -10.803 630 H PHE 76 H PHE 76 5.445 -2.007 -12.106 631 HA PHE 76 HA PHE 76 2.665 -2.283 -11.494 632 1HB PHE 76 HB2 PHE 76 4.112 -2.349 -14.158 633 2HB PHE 76 HB3 PHE 76 2.361 -2.233 -13.978 634 HD1 PHE 76 HD1 PHE 76 1.346 -0.242 -12.852 635 HD2 PHE 76 HD2 PHE 76 5.535 -0.456 -13.781 636 HE1 PHE 76 HE1 PHE 76 1.538 2.213 -12.551 637 HE2 PHE 76 HE2 PHE 76 5.726 1.998 -13.481 638 HZ PHE 76 HZ PHE 76 3.728 3.332 -12.866 639 H ASP 77 H ASP 77 1.298 -4.040 -11.649 640 HA ASP 77 HA ASP 77 2.564 -6.681 -11.969 641 1HB ASP 77 HB2 ASP 77 0.525 -5.750 -10.371 642 2HB ASP 77 HB3 ASP 77 -0.362 -6.573 -11.654 643 H LYS 78 H LYS 78 0.544 -8.187 -13.101 644 HA LYS 78 HA LYS 78 0.703 -7.298 -15.914 645 1HB LYS 78 HB2 LYS 78 -0.017 -9.549 -16.470 646 2HB LYS 78 HB3 LYS 78 1.247 -9.660 -15.245 647 1HG LYS 78 HG2 LYS 78 -1.410 -9.396 -14.059 648 2HG LYS 78 HG3 LYS 78 -1.277 -10.822 -15.088 649 1HD LYS 78 HD2 LYS 78 1.078 -10.410 -13.388 650 2HD LYS 78 HD3 LYS 78 -0.407 -10.668 -12.471 651 1HE LYS 78 HE2 LYS 78 -0.686 -12.812 -13.258 652 2HE LYS 78 HE3 LYS 78 0.073 -12.454 -14.809 653 1HZ LYS 78 HZ1 LYS 78 2.066 -12.091 -12.986 654 2HZ LYS 78 HZ2 LYS 78 1.245 -13.454 -12.401 655 3HZ LYS 78 HZ3 LYS 78 1.861 -13.451 -13.983 656 H GLY 79 H GLY 79 -1.399 -6.796 -13.405 657 1HA GLY 79 HA2 GLY 79 -3.899 -7.153 -14.903 658 2HA GLY 79 HA3 GLY 79 -3.749 -6.473 -13.282 659 H GLN 80 H GLN 80 -5.211 -4.755 -14.029 660 HA GLN 80 HA GLN 80 -4.605 -3.005 -16.198 661 1HB GLN 80 HB2 GLN 80 -6.031 -2.310 -13.612 662 2HB GLN 80 HB3 GLN 80 -6.164 -1.452 -15.149 663 1HG GLN 80 HG2 GLN 80 -6.691 -4.287 -15.496 664 2HG GLN 80 HG3 GLN 80 -7.764 -3.589 -14.283 665 1HE2 GLN 80 HE21 GLN 80 -9.285 -4.186 -16.304 666 2HE2 GLN 80 HE22 GLN 80 -9.558 -2.908 -17.387 667 H ARG 81 H ARG 81 -3.421 -1.066 -16.266 668 HA ARG 81 HA ARG 81 -1.335 -0.812 -14.202 669 1HB ARG 81 HB2 ARG 81 -0.833 -0.619 -16.665 670 2HB ARG 81 HB3 ARG 81 -1.766 0.879 -16.681 671 1HG ARG 81 HG2 ARG 81 -0.106 1.310 -14.548 672 2HG ARG 81 HG3 ARG 81 0.934 0.358 -15.607 673 1HD ARG 81 HD2 ARG 81 -0.363 3.020 -16.137 674 2HD ARG 81 HD3 ARG 81 1.322 2.548 -16.349 675 HE ARG 81 HE ARG 81 0.287 1.001 -18.221 676 1HH1 ARG 81 HH11 ARG 81 0.060 4.335 -17.616 677 2HH1 ARG 81 HH12 ARG 81 -0.928 4.679 -18.997 678 1HH2 ARG 81 HH21 ARG 81 -1.343 1.346 -19.862 679 2HH2 ARG 81 HH22 ARG 81 -1.718 2.987 -20.270 680 H THR 82 H THR 82 -4.428 0.442 -14.756 681 HA THR 82 HA THR 82 -3.941 2.544 -12.721 682 HB THR 82 HB THR 82 -5.468 4.066 -14.167 683 HG1 THR 82 HG1 THR 82 -5.991 2.472 -15.692 684 1HG2 THR 82 HG21 THR 82 -2.595 3.414 -14.845 685 2HG2 THR 82 HG22 THR 82 -3.449 4.795 -15.537 686 3HG2 THR 82 HG23 THR 82 -3.194 4.698 -13.794 687 H ASP 83 H ASP 83 -6.012 3.301 -11.751 688 HA ASP 83 HA ASP 83 -8.024 1.105 -11.803 689 1HB ASP 83 HB2 ASP 83 -6.918 2.792 -9.731 690 2HB ASP 83 HB3 ASP 83 -8.672 2.950 -9.772 691 H LYS 84 H LYS 84 -10.246 2.453 -10.869 692 HA LYS 84 HA LYS 84 -11.176 3.756 -13.293 693 1HB LYS 84 HB2 LYS 84 -13.301 4.013 -12.069 694 2HB LYS 84 HB3 LYS 84 -12.678 2.372 -11.898 695 1HG LYS 84 HG2 LYS 84 -11.494 3.445 -9.757 696 2HG LYS 84 HG3 LYS 84 -12.863 4.550 -9.864 697 1HD LYS 84 HD2 LYS 84 -13.915 1.958 -10.278 698 2HD LYS 84 HD3 LYS 84 -12.812 1.828 -8.907 699 1HE LYS 84 HE2 LYS 84 -14.203 4.235 -8.500 700 2HE LYS 84 HE3 LYS 84 -15.425 3.083 -9.037 701 1HZ LYS 84 HZ1 LYS 84 -14.164 1.544 -7.349 702 2HZ LYS 84 HZ2 LYS 84 -13.743 3.032 -6.643 703 3HZ LYS 84 HZ3 LYS 84 -15.377 2.614 -6.827 704 H TYR 85 H TYR 85 -9.777 4.839 -10.310 705 HA TYR 85 HA TYR 85 -10.763 7.596 -10.671 706 1HB TYR 85 HB2 TYR 85 -8.802 6.452 -8.660 707 2HB TYR 85 HB3 TYR 85 -9.489 8.076 -8.617 708 HD1 TYR 85 HD1 TYR 85 -12.100 8.234 -8.644 709 HD2 TYR 85 HD2 TYR 85 -9.911 4.696 -7.575 710 HE1 TYR 85 HE1 TYR 85 -14.093 7.360 -7.455 711 HE2 TYR 85 HE2 TYR 85 -11.904 3.822 -6.386 712 HH TYR 85 HH TYR 85 -14.579 5.747 -5.622 713 H GLY 86 H GLY 86 -8.480 5.826 -12.199 714 1HA GLY 86 HA2 GLY 86 -6.780 6.550 -13.668 715 2HA GLY 86 HA3 GLY 86 -7.064 8.202 -13.121 716 H ARG 87 H ARG 87 -6.399 5.579 -10.875 717 HA ARG 87 HA ARG 87 -3.904 7.002 -10.099 718 1HB ARG 87 HB2 ARG 87 -5.045 4.675 -8.580 719 2HB ARG 87 HB3 ARG 87 -4.147 6.068 -7.973 720 1HG ARG 87 HG2 ARG 87 -6.148 7.489 -8.707 721 2HG ARG 87 HG3 ARG 87 -7.023 5.969 -8.894 722 1HD ARG 87 HD2 ARG 87 -5.547 6.373 -6.338 723 2HD ARG 87 HD3 ARG 87 -7.012 7.325 -6.577 724 HE ARG 87 HE ARG 87 -7.469 4.545 -7.220 725 1HH1 ARG 87 HH11 ARG 87 -6.664 6.506 -4.523 726 2HH1 ARG 87 HH12 ARG 87 -7.794 5.745 -3.454 727 1HH2 ARG 87 HH21 ARG 87 -9.121 3.678 -5.901 728 2HH2 ARG 87 HH22 ARG 87 -9.186 4.144 -4.234 729 H GLY 88 H GLY 88 -1.917 5.797 -9.864 730 1HA GLY 88 HA2 GLY 88 -1.661 3.641 -11.836 731 2HA GLY 88 HA3 GLY 88 -0.342 4.365 -10.918 732 H LEU 89 H LEU 89 -1.682 1.490 -11.360 733 HA LEU 89 HA LEU 89 -1.727 0.725 -8.479 734 1HB LEU 89 HB2 LEU 89 -2.499 -0.971 -10.868 735 2HB LEU 89 HB3 LEU 89 -2.836 -1.296 -9.166 736 HG LEU 89 HG LEU 89 -3.956 0.971 -10.837 737 1HD1 LEU 89 HD11 LEU 89 -4.848 -1.699 -10.169 738 2HD1 LEU 89 HD12 LEU 89 -5.959 -0.502 -9.504 739 3HD1 LEU 89 HD13 LEU 89 -5.604 -0.512 -11.231 740 1HD2 LEU 89 HD21 LEU 89 -3.389 1.666 -8.501 741 2HD2 LEU 89 HD22 LEU 89 -5.125 1.679 -8.812 742 3HD2 LEU 89 HD23 LEU 89 -4.403 0.354 -7.898 743 H ALA 90 H ALA 90 0.161 -0.038 -7.704 744 HA ALA 90 HA ALA 90 1.644 -2.128 -9.033 745 1HB ALA 90 HB1 ALA 90 2.327 0.599 -9.697 746 2HB ALA 90 HB2 ALA 90 3.667 -0.161 -8.837 747 3HB ALA 90 HB3 ALA 90 3.034 -0.897 -10.310 748 H TYR 91 H TYR 91 3.543 -2.787 -7.715 749 HA TYR 91 HA TYR 91 3.037 -2.288 -4.864 750 1HB TYR 91 HB2 TYR 91 5.298 -3.909 -6.056 751 2HB TYR 91 HB3 TYR 91 4.586 -4.063 -4.450 752 HD1 TYR 91 HD1 TYR 91 2.172 -4.833 -4.245 753 HD2 TYR 91 HD2 TYR 91 4.389 -5.066 -7.916 754 HE1 TYR 91 HE1 TYR 91 0.541 -6.482 -5.125 755 HE2 TYR 91 HE2 TYR 91 2.759 -6.714 -8.796 756 HH TYR 91 HH TYR 91 0.980 -8.501 -7.327 757 H ILE 92 H ILE 92 4.065 -0.689 -3.747 758 HA ILE 92 HA ILE 92 6.343 0.691 -5.032 759 HB ILE 92 HB ILE 92 4.836 1.313 -2.472 760 1HG1 ILE 92 HG12 ILE 92 4.694 2.566 -5.235 761 2HG1 ILE 92 HG13 ILE 92 3.471 1.502 -4.539 762 1HG2 ILE 92 HG21 ILE 92 6.889 2.892 -4.052 763 2HG2 ILE 92 HG22 ILE 92 5.953 3.531 -2.701 764 3HG2 ILE 92 HG23 ILE 92 7.106 2.224 -2.435 765 1HD1 ILE 92 HD11 ILE 92 4.347 3.986 -3.078 766 2HD1 ILE 92 HD12 ILE 92 3.121 4.074 -4.343 767 3HD1 ILE 92 HD13 ILE 92 2.842 3.081 -2.913 768 H TYR 93 H TYR 93 8.441 0.510 -4.318 769 HA TYR 93 HA TYR 93 8.880 -1.131 -1.853 770 1HB TYR 93 HB2 TYR 93 10.522 -1.034 -4.402 771 2HB TYR 93 HB3 TYR 93 10.987 -1.910 -2.943 772 HD1 TYR 93 HD1 TYR 93 9.748 -3.896 -2.207 773 HD2 TYR 93 HD2 TYR 93 8.680 -1.800 -5.802 774 HE1 TYR 93 HE1 TYR 93 8.356 -5.822 -2.916 775 HE2 TYR 93 HE2 TYR 93 7.287 -3.726 -6.510 776 HH TYR 93 HH TYR 93 7.295 -6.285 -5.995 777 H ALA 94 H ALA 94 10.193 -0.235 -0.324 778 HA ALA 94 HA ALA 94 11.732 2.215 -1.087 779 1HB ALA 94 HB1 ALA 94 9.604 1.929 0.825 780 2HB ALA 94 HB2 ALA 94 11.096 2.315 1.682 781 3HB ALA 94 HB3 ALA 94 10.513 3.380 0.404 782 H ASP 95 H ASP 95 13.875 2.099 -0.554 783 HA ASP 95 HA ASP 95 15.862 1.331 0.443 784 1HB ASP 95 HB2 ASP 95 14.063 0.030 2.508 785 2HB ASP 95 HB3 ASP 95 15.761 0.470 2.693 786 H GLY 96 H GLY 96 14.020 -0.329 -1.386 787 1HA GLY 96 HA2 GLY 96 14.433 -2.378 -2.503 788 2HA GLY 96 HA3 GLY 96 15.671 -2.746 -1.299 789 H LYS 97 H LYS 97 12.643 -1.755 -0.025 790 HA LYS 97 HA LYS 97 11.982 -4.612 0.581 791 1HB LYS 97 HB2 LYS 97 12.510 -2.437 2.347 792 2HB LYS 97 HB3 LYS 97 10.793 -2.816 2.476 793 1HG LYS 97 HG2 LYS 97 11.226 -5.080 3.062 794 2HG LYS 97 HG3 LYS 97 12.914 -4.966 2.559 795 1HD LYS 97 HD2 LYS 97 12.768 -2.963 4.424 796 2HD LYS 97 HD3 LYS 97 11.653 -4.153 5.098 797 1HE LYS 97 HE2 LYS 97 13.736 -5.749 4.312 798 2HE LYS 97 HE3 LYS 97 14.584 -4.281 4.798 799 1HZ LYS 97 HZ1 LYS 97 13.221 -4.361 6.879 800 2HZ LYS 97 HZ2 LYS 97 12.722 -5.919 6.419 801 3HZ LYS 97 HZ3 LYS 97 14.362 -5.610 6.717 802 H MET 98 H MET 98 9.598 -4.934 1.028 803 HA MET 98 HA MET 98 8.040 -3.473 -1.014 804 1HB MET 98 HB2 MET 98 7.933 -5.973 -0.838 805 2HB MET 98 HB3 MET 98 7.192 -5.788 0.754 806 1HG MET 98 HG2 MET 98 5.384 -4.411 -0.316 807 2HG MET 98 HG3 MET 98 6.083 -4.797 -1.889 808 1HE MET 98 HE1 MET 98 5.004 -5.959 -3.155 809 2HE MET 98 HE2 MET 98 5.844 -7.501 -3.008 810 3HE MET 98 HE3 MET 98 4.077 -7.443 -2.943 811 H VAL 99 H VAL 99 7.277 -1.533 -0.257 812 HA VAL 99 HA VAL 99 6.777 -0.823 2.419 813 HB VAL 99 HB VAL 99 5.216 0.154 0.010 814 1HG1 VAL 99 HG11 VAL 99 4.478 0.773 2.383 815 2HG1 VAL 99 HG12 VAL 99 6.003 1.648 2.519 816 3HG1 VAL 99 HG13 VAL 99 4.819 2.122 1.300 817 1HG2 VAL 99 HG21 VAL 99 7.977 0.181 0.330 818 2HG2 VAL 99 HG22 VAL 99 7.053 1.270 -0.706 819 3HG2 VAL 99 HG23 VAL 99 7.484 1.765 0.932 820 H ASN 100 H ASN 100 4.649 -2.415 0.074 821 HA ASN 100 HA ASN 100 2.229 -2.327 1.533 822 1HB ASN 100 HB2 ASN 100 3.281 -4.581 -0.207 823 2HB ASN 100 HB3 ASN 100 1.595 -4.340 0.253 824 1HD2 ASN 100 HD21 ASN 100 0.538 -3.578 -1.594 825 2HD2 ASN 100 HD22 ASN 100 1.110 -2.328 -2.589 826 H GLU 101 H GLU 101 4.778 -4.841 1.593 827 HA GLU 101 HA GLU 101 3.563 -6.427 3.636 828 1HB GLU 101 HB2 GLU 101 5.604 -6.921 2.056 829 2HB GLU 101 HB3 GLU 101 6.549 -6.210 3.365 830 1HG GLU 101 HG2 GLU 101 5.145 -7.830 4.885 831 2HG GLU 101 HG3 GLU 101 4.883 -8.709 3.379 832 H ALA 102 H ALA 102 5.474 -3.499 3.760 833 HA ALA 102 HA ALA 102 6.259 -3.661 6.514 834 1HB ALA 102 HB1 ALA 102 6.768 -1.920 4.463 835 2HB ALA 102 HB2 ALA 102 5.669 -0.969 5.460 836 3HB ALA 102 HB3 ALA 102 7.163 -1.602 6.152 837 H LEU 103 H LEU 103 3.497 -2.046 4.945 838 HA LEU 103 HA LEU 103 2.300 -1.120 7.374 839 1HB LEU 103 HB2 LEU 103 1.046 -1.778 4.692 840 2HB LEU 103 HB3 LEU 103 0.222 -0.924 5.997 841 HG LEU 103 HG LEU 103 2.861 0.194 5.339 842 1HD1 LEU 103 HD11 LEU 103 1.638 -0.650 3.116 843 2HD1 LEU 103 HD12 LEU 103 0.730 0.844 3.348 844 3HD1 LEU 103 HD13 LEU 103 2.484 0.896 3.172 845 1HD2 LEU 103 HD21 LEU 103 0.735 1.035 6.738 846 2HD2 LEU 103 HD22 LEU 103 1.810 2.168 5.918 847 3HD2 LEU 103 HD23 LEU 103 0.285 1.699 5.167 848 H VAL 104 H VAL 104 1.696 -4.055 5.421 849 HA VAL 104 HA VAL 104 -0.338 -5.114 7.127 850 HB VAL 104 HB VAL 104 1.628 -6.743 5.502 851 1HG1 VAL 104 HG11 VAL 104 -0.207 -7.689 7.158 852 2HG1 VAL 104 HG12 VAL 104 -1.300 -7.299 5.830 853 3HG1 VAL 104 HG13 VAL 104 0.030 -8.429 5.574 854 1HG2 VAL 104 HG21 VAL 104 0.022 -4.649 4.555 855 2HG2 VAL 104 HG22 VAL 104 0.744 -5.934 3.585 856 3HG2 VAL 104 HG23 VAL 104 -0.899 -6.111 4.200 857 H ARG 105 H ARG 105 3.149 -5.080 7.367 858 HA ARG 105 HA ARG 105 3.317 -7.205 9.339 859 1HB ARG 105 HB2 ARG 105 5.203 -6.248 7.820 860 2HB ARG 105 HB3 ARG 105 5.348 -4.998 9.056 861 1HG ARG 105 HG2 ARG 105 5.391 -7.027 10.718 862 2HG ARG 105 HG3 ARG 105 5.854 -7.951 9.288 863 1HD ARG 105 HD2 ARG 105 7.291 -5.385 9.739 864 2HD ARG 105 HD3 ARG 105 7.661 -6.705 10.848 865 HE ARG 105 HE ARG 105 7.713 -7.566 8.074 866 1HH1 ARG 105 HH11 ARG 105 9.492 -7.758 10.777 867 2HH1 ARG 105 HH12 ARG 105 11.024 -7.361 10.076 868 1HH2 ARG 105 HH21 ARG 105 9.668 -6.278 7.073 869 2HH2 ARG 105 HH22 ARG 105 11.124 -6.520 7.978 870 H GLN 106 H GLN 106 2.812 -3.728 9.431 871 HA GLN 106 HA GLN 106 3.133 -3.655 12.362 872 1HB GLN 106 HB2 GLN 106 3.805 -1.746 10.811 873 2HB GLN 106 HB3 GLN 106 2.081 -1.451 10.573 874 1HG GLN 106 HG2 GLN 106 2.103 -0.219 12.460 875 2HG GLN 106 HG3 GLN 106 2.420 -1.705 13.357 876 1HE2 GLN 106 HE21 GLN 106 4.502 -1.971 14.268 877 2HE2 GLN 106 HE22 GLN 106 5.773 -0.867 14.053 878 H GLY 107 H GLY 107 0.731 -4.619 10.259 879 1HA GLY 107 HA2 GLY 107 -1.511 -5.185 10.681 880 2HA GLY 107 HA3 GLY 107 -1.256 -4.708 12.360 881 H LEU 108 H LEU 108 -0.584 -2.528 9.690 882 HA LEU 108 HA LEU 108 -2.685 -0.717 10.752 883 1HB LEU 108 HB2 LEU 108 -0.500 -0.190 8.713 884 2HB LEU 108 HB3 LEU 108 -1.566 1.021 9.426 885 HG LEU 108 HG LEU 108 0.226 -0.759 11.092 886 1HD1 LEU 108 HD11 LEU 108 0.828 1.691 9.536 887 2HD1 LEU 108 HD12 LEU 108 1.387 1.696 11.208 888 3HD1 LEU 108 HD13 LEU 108 1.914 0.425 10.106 889 1HD2 LEU 108 HD21 LEU 108 -1.812 0.434 12.079 890 2HD2 LEU 108 HD22 LEU 108 -0.265 0.788 12.849 891 3HD2 LEU 108 HD23 LEU 108 -0.976 1.946 11.725 892 H ALA 109 H ALA 109 -1.606 -2.133 7.657 893 HA ALA 109 HA ALA 109 -4.224 -1.345 6.469 894 1HB ALA 109 HB1 ALA 109 -1.680 -1.153 5.439 895 2HB ALA 109 HB2 ALA 109 -2.244 -2.666 4.731 896 3HB ALA 109 HB3 ALA 109 -3.153 -1.178 4.470 897 H LYS 110 H LYS 110 -5.582 -2.949 5.545 898 HA LYS 110 HA LYS 110 -4.963 -5.722 6.467 899 1HB LYS 110 HB2 LYS 110 -7.597 -4.358 5.844 900 2HB LYS 110 HB3 LYS 110 -7.444 -6.077 6.212 901 1HG LYS 110 HG2 LYS 110 -6.689 -5.651 8.421 902 2HG LYS 110 HG3 LYS 110 -6.348 -3.958 8.063 903 1HD LYS 110 HD2 LYS 110 -8.391 -3.516 8.926 904 2HD LYS 110 HD3 LYS 110 -9.041 -4.208 7.439 905 1HE LYS 110 HE2 LYS 110 -9.224 -6.393 8.454 906 2HE LYS 110 HE3 LYS 110 -8.365 -5.848 9.895 907 1HZ LYS 110 HZ1 LYS 110 -10.449 -4.086 9.570 908 2HZ LYS 110 HZ2 LYS 110 -11.122 -5.610 9.251 909 3HZ LYS 110 HZ3 LYS 110 -10.335 -5.323 10.729 910 H VAL 111 H VAL 111 -4.533 -7.220 4.921 911 HA VAL 111 HA VAL 111 -4.274 -6.641 2.182 912 HB VAL 111 HB VAL 111 -4.950 -9.338 3.400 913 1HG1 VAL 111 HG11 VAL 111 -4.631 -8.531 0.717 914 2HG1 VAL 111 HG12 VAL 111 -3.122 -9.331 1.156 915 3HG1 VAL 111 HG13 VAL 111 -4.657 -10.183 1.334 916 1HG2 VAL 111 HG21 VAL 111 -2.904 -7.879 4.251 917 2HG2 VAL 111 HG22 VAL 111 -2.701 -9.602 3.937 918 3HG2 VAL 111 HG23 VAL 111 -2.170 -8.421 2.740 919 H ALA 112 H ALA 112 -5.770 -6.311 0.599 920 HA ALA 112 HA ALA 112 -8.275 -7.774 0.507 921 1HB ALA 112 HB1 ALA 112 -8.336 -5.576 2.173 922 2HB ALA 112 HB2 ALA 112 -8.915 -4.908 0.646 923 3HB ALA 112 HB3 ALA 112 -9.744 -6.282 1.380 924 H TYR 113 H TYR 113 -9.743 -6.551 -1.258 925 HA TYR 113 HA TYR 113 -9.896 -5.911 -3.507 926 1HB TYR 113 HB2 TYR 113 -7.406 -4.386 -2.697 927 2HB TYR 113 HB3 TYR 113 -8.200 -4.199 -4.261 928 HD1 TYR 113 HD1 TYR 113 -10.983 -4.157 -3.827 929 HD2 TYR 113 HD2 TYR 113 -7.903 -2.627 -1.255 930 HE1 TYR 113 HE1 TYR 113 -12.612 -2.585 -2.814 931 HE2 TYR 113 HE2 TYR 113 -9.532 -1.054 -0.241 932 HH TYR 113 HH TYR 113 -11.763 0.051 -1.047 933 H VAL 114 H VAL 114 -8.657 -8.416 -2.927 934 HA VAL 114 HA VAL 114 -6.310 -8.595 -4.714 935 HB VAL 114 HB VAL 114 -7.768 -10.858 -3.324 936 1HG1 VAL 114 HG11 VAL 114 -5.760 -10.877 -5.217 937 2HG1 VAL 114 HG12 VAL 114 -4.854 -10.943 -3.706 938 3HG1 VAL 114 HG13 VAL 114 -6.070 -12.171 -4.058 939 1HG2 VAL 114 HG21 VAL 114 -6.215 -8.681 -2.204 940 2HG2 VAL 114 HG22 VAL 114 -7.049 -9.992 -1.369 941 3HG2 VAL 114 HG23 VAL 114 -5.396 -10.221 -1.941 942 H TYR 115 H TYR 115 -7.249 -8.139 -6.764 943 HA TYR 115 HA TYR 115 -9.202 -10.197 -7.714 944 1HB TYR 115 HB2 TYR 115 -8.815 -7.391 -8.798 945 2HB TYR 115 HB3 TYR 115 -10.066 -8.543 -9.268 946 HD1 TYR 115 HD1 TYR 115 -11.170 -9.642 -6.922 947 HD2 TYR 115 HD2 TYR 115 -9.670 -5.658 -7.499 948 HE1 TYR 115 HE1 TYR 115 -12.613 -8.832 -5.075 949 HE2 TYR 115 HE2 TYR 115 -11.114 -4.848 -5.650 950 HH TYR 115 HH TYR 115 -12.340 -6.575 -3.386 951 H LYS 116 H LYS 116 -8.192 -11.630 -9.027 952 HA LYS 116 HA LYS 116 -5.601 -11.290 -10.136 953 1HB LYS 116 HB2 LYS 116 -6.264 -13.213 -11.639 954 2HB LYS 116 HB3 LYS 116 -6.538 -13.511 -9.922 955 1HG LYS 116 HG2 LYS 116 -8.911 -12.368 -10.607 956 2HG LYS 116 HG3 LYS 116 -8.499 -13.184 -12.116 957 1HD LYS 116 HD2 LYS 116 -8.038 -15.266 -10.721 958 2HD LYS 116 HD3 LYS 116 -8.791 -14.417 -9.369 959 1HE LYS 116 HE2 LYS 116 -10.080 -15.071 -12.033 960 2HE LYS 116 HE3 LYS 116 -10.479 -15.780 -10.468 961 1HZ LYS 116 HZ1 LYS 116 -10.938 -13.399 -9.754 962 2HZ LYS 116 HZ2 LYS 116 -10.942 -13.017 -11.409 963 3HZ LYS 116 HZ3 LYS 116 -12.068 -14.128 -10.788 964 HA PRO 117 HA PRO 117 -4.646 -12.175 -11.860 965 1HB PRO 117 HB2 PRO 117 -2.855 -11.216 -13.683 966 2HB PRO 117 HB3 PRO 117 -4.158 -12.337 -14.111 967 1HG PRO 117 HG2 PRO 117 -3.905 -9.446 -14.707 968 2HG PRO 117 HG3 PRO 117 -4.838 -10.691 -15.551 969 1HD PRO 117 HD2 PRO 117 -5.836 -8.756 -13.700 970 2HD PRO 117 HD3 PRO 117 -6.734 -10.105 -14.430 971 H ASN 118 H ASN 118 -5.162 -9.177 -10.896 972 HA ASN 118 HA ASN 118 -2.404 -8.280 -10.412 973 1HB ASN 118 HB2 ASN 118 -5.137 -7.187 -9.976 974 2HB ASN 118 HB3 ASN 118 -3.885 -6.645 -8.856 975 1HD2 ASN 118 HD21 ASN 118 -5.066 -4.859 -10.782 976 2HD2 ASN 118 HD22 ASN 118 -3.868 -4.428 -11.904 977 H ASN 119 H ASN 119 -2.130 -10.543 -9.283 978 HA ASN 119 HA ASN 119 -2.232 -10.019 -6.390 979 1HB ASN 119 HB2 ASN 119 -3.312 -12.247 -5.937 980 2HB ASN 119 HB3 ASN 119 -4.393 -11.073 -6.688 981 1HD2 ASN 119 HD21 ASN 119 -5.337 -13.494 -7.160 982 2HD2 ASN 119 HD22 ASN 119 -4.912 -14.103 -8.687 983 H THR 120 H THR 120 -0.297 -10.604 -8.709 984 HA THR 120 HA THR 120 0.906 -13.141 -8.407 985 HB THR 120 HB THR 120 2.307 -10.496 -8.908 986 HG1 THR 120 HG1 THR 120 0.841 -12.275 -10.502 987 1HG2 THR 120 HG21 THR 120 3.622 -12.678 -8.309 988 2HG2 THR 120 HG22 THR 120 3.165 -13.186 -9.935 989 3HG2 THR 120 HG23 THR 120 4.128 -11.726 -9.705 990 H HIS 121 H HIS 121 1.131 -10.262 -6.390 991 HA HIS 121 HA HIS 121 2.993 -11.740 -4.576 992 1HB HIS 121 HB2 HIS 121 2.455 -8.796 -4.991 993 2HB HIS 121 HB3 HIS 121 3.277 -9.393 -3.550 994 HD1 HIS 121 HD1 HIS 121 4.388 -11.747 -5.816 995 HD2 HIS 121 HD2 HIS 121 5.222 -7.680 -5.444 996 HE1 HIS 121 HE1 HIS 121 6.584 -11.353 -7.015 997 H GLU 122 H GLU 122 0.339 -12.527 -4.507 998 HA GLU 122 HA GLU 122 -0.993 -11.052 -2.324 999 1HB GLU 122 HB2 GLU 122 -2.483 -11.819 -4.023 1000 2HB GLU 122 HB3 GLU 122 -1.765 -13.429 -4.026 1001 1HG GLU 122 HG2 GLU 122 -2.970 -12.378 -1.487 1002 2HG GLU 122 HG3 GLU 122 -4.034 -13.002 -2.748 1003 H GLN 123 H GLN 123 0.675 -14.125 -2.871 1004 HA GLN 123 HA GLN 123 0.014 -15.343 -0.369 1005 1HB GLN 123 HB2 GLN 123 1.936 -15.796 -2.543 1006 2HB GLN 123 HB3 GLN 123 2.537 -16.293 -0.960 1007 1HG GLN 123 HG2 GLN 123 1.194 -18.097 -0.958 1008 2HG GLN 123 HG3 GLN 123 -0.223 -17.090 -1.256 1009 1HE2 GLN 123 HE21 GLN 123 -0.629 -19.260 -2.615 1010 2HE2 GLN 123 HE22 GLN 123 -0.136 -19.187 -4.238 1011 H LEU 124 H LEU 124 2.714 -13.224 -1.324 1012 HA LEU 124 HA LEU 124 4.189 -13.343 1.088 1013 1HB LEU 124 HB2 LEU 124 4.790 -12.158 -1.120 1014 2HB LEU 124 HB3 LEU 124 3.841 -10.803 -0.509 1015 HG LEU 124 HG LEU 124 5.259 -10.891 1.591 1016 1HD1 LEU 124 HD11 LEU 124 6.037 -13.315 0.793 1017 2HD1 LEU 124 HD12 LEU 124 7.307 -12.381 0.002 1018 3HD1 LEU 124 HD13 LEU 124 7.099 -12.283 1.751 1019 1HD2 LEU 124 HD21 LEU 124 5.710 -9.673 -0.863 1020 2HD2 LEU 124 HD22 LEU 124 6.538 -9.280 0.643 1021 3HD2 LEU 124 HD23 LEU 124 7.265 -10.418 -0.491 1022 H LEU 125 H LEU 125 1.783 -10.843 0.168 1023 HA LEU 125 HA LEU 125 1.679 -9.661 2.771 1024 1HB LEU 125 HB2 LEU 125 -0.493 -9.713 0.653 1025 2HB LEU 125 HB3 LEU 125 -0.362 -8.564 1.985 1026 HG LEU 125 HG LEU 125 1.900 -8.906 0.026 1027 1HD1 LEU 125 HD11 LEU 125 -0.346 -8.396 -1.124 1028 2HD1 LEU 125 HD12 LEU 125 -0.292 -6.849 -0.280 1029 3HD1 LEU 125 HD13 LEU 125 0.977 -7.270 -1.430 1030 1HD2 LEU 125 HD21 LEU 125 1.707 -7.523 2.359 1031 2HD2 LEU 125 HD22 LEU 125 2.739 -7.022 1.019 1032 3HD2 LEU 125 HD23 LEU 125 1.143 -6.298 1.223 1033 H ARG 126 H ARG 126 0.210 -12.523 1.449 1034 HA ARG 126 HA ARG 126 -2.010 -12.777 3.224 1035 1HB ARG 126 HB2 ARG 126 -1.076 -14.240 1.135 1036 2HB ARG 126 HB3 ARG 126 -0.579 -15.263 2.482 1037 1HG ARG 126 HG2 ARG 126 -3.057 -14.751 3.317 1038 2HG ARG 126 HG3 ARG 126 -3.329 -14.505 1.592 1039 1HD ARG 126 HD2 ARG 126 -3.258 -16.721 1.190 1040 2HD ARG 126 HD3 ARG 126 -1.734 -16.885 2.061 1041 HE ARG 126 HE ARG 126 -3.044 -17.181 4.134 1042 1HH1 ARG 126 HH11 ARG 126 -5.280 -16.157 1.894 1043 2HH1 ARG 126 HH12 ARG 126 -6.429 -17.422 2.180 1044 1HH2 ARG 126 HH21 ARG 126 -4.292 -19.273 4.188 1045 2HH2 ARG 126 HH22 ARG 126 -5.869 -19.185 3.479 1046 H LYS 127 H LYS 127 1.273 -14.207 3.482 1047 HA LYS 127 HA LYS 127 0.858 -15.277 6.101 1048 1HB LYS 127 HB2 LYS 127 3.177 -15.733 6.130 1049 2HB LYS 127 HB3 LYS 127 2.762 -15.780 4.416 1050 1HG LYS 127 HG2 LYS 127 3.540 -13.467 4.144 1051 2HG LYS 127 HG3 LYS 127 3.909 -13.373 5.865 1052 1HD LYS 127 HD2 LYS 127 5.416 -15.432 5.459 1053 2HD LYS 127 HD3 LYS 127 5.266 -15.038 3.746 1054 1HE LYS 127 HE2 LYS 127 6.266 -12.890 4.053 1055 2HE LYS 127 HE3 LYS 127 6.127 -13.000 5.808 1056 1HZ LYS 127 HZ1 LYS 127 7.575 -15.113 5.457 1057 2HZ LYS 127 HZ2 LYS 127 8.011 -14.348 4.004 1058 3HZ LYS 127 HZ3 LYS 127 8.303 -13.578 5.486 1059 H SER 128 H SER 128 2.111 -12.153 4.989 1060 HA SER 128 HA SER 128 2.917 -11.155 7.533 1061 1HB SER 128 HB2 SER 128 1.687 -9.340 5.484 1062 2HB SER 128 HB3 SER 128 3.104 -9.077 6.497 1063 HG SER 128 HG SER 128 4.305 -10.176 5.121 1064 H GLU 129 H GLU 129 -0.236 -11.482 6.047 1065 HA GLU 129 HA GLU 129 -1.596 -9.706 7.907 1066 1HB GLU 129 HB2 GLU 129 -2.612 -10.161 5.743 1067 2HB GLU 129 HB3 GLU 129 -2.628 -11.893 6.075 1068 1HG GLU 129 HG2 GLU 129 -4.851 -10.936 6.484 1069 2HG GLU 129 HG3 GLU 129 -4.142 -11.495 7.999 1070 H ALA 130 H ALA 130 -1.636 -13.273 7.531 1071 HA ALA 130 HA ALA 130 -3.017 -13.930 9.862 1072 1HB ALA 130 HB1 ALA 130 -0.857 -15.282 8.298 1073 2HB ALA 130 HB2 ALA 130 -1.295 -15.956 9.866 1074 3HB ALA 130 HB3 ALA 130 -2.513 -15.805 8.601 1075 H GLN 131 H GLN 131 0.412 -13.100 9.521 1076 HA GLN 131 HA GLN 131 1.130 -13.641 12.246 1077 1HB GLN 131 HB2 GLN 131 2.852 -13.365 10.538 1078 2HB GLN 131 HB3 GLN 131 2.326 -11.709 10.236 1079 1HG GLN 131 HG2 GLN 131 2.761 -11.862 13.014 1080 2HG GLN 131 HG3 GLN 131 4.128 -12.699 12.274 1081 1HE2 GLN 131 HE21 GLN 131 5.411 -11.457 10.647 1082 2HE2 GLN 131 HE22 GLN 131 5.409 -9.760 10.692 1083 H ALA 132 H ALA 132 -0.073 -10.739 10.592 1084 HA ALA 132 HA ALA 132 0.149 -8.959 12.817 1085 1HB ALA 132 HB1 ALA 132 -1.389 -9.023 10.263 1086 2HB ALA 132 HB2 ALA 132 -1.969 -7.929 11.518 1087 3HB ALA 132 HB3 ALA 132 -0.324 -7.771 10.901 1088 H LYS 133 H LYS 133 -2.282 -11.351 11.917 1089 HA LYS 133 HA LYS 133 -4.259 -10.476 13.843 1090 1HB LYS 133 HB2 LYS 133 -3.982 -12.585 11.879 1091 2HB LYS 133 HB3 LYS 133 -4.598 -13.241 13.396 1092 1HG LYS 133 HG2 LYS 133 -6.269 -11.325 13.412 1093 2HG LYS 133 HG3 LYS 133 -5.761 -10.977 11.759 1094 1HD LYS 133 HD2 LYS 133 -6.605 -13.760 12.533 1095 2HD LYS 133 HD3 LYS 133 -7.815 -12.543 12.128 1096 1HE LYS 133 HE2 LYS 133 -5.936 -12.258 10.108 1097 2HE LYS 133 HE3 LYS 133 -5.985 -14.001 10.368 1098 1HZ LYS 133 HZ1 LYS 133 -8.603 -12.981 10.436 1099 2HZ LYS 133 HZ2 LYS 133 -7.843 -12.420 9.028 1100 3HZ LYS 133 HZ3 LYS 133 -7.925 -14.087 9.339 1101 H LYS 134 H LYS 134 -1.546 -12.736 13.902 1102 HA LYS 134 HA LYS 134 -2.209 -13.729 16.574 1103 1HB LYS 134 HB2 LYS 134 -0.134 -14.235 14.526 1104 2HB LYS 134 HB3 LYS 134 0.413 -14.404 16.194 1105 1HG LYS 134 HG2 LYS 134 -2.196 -15.650 15.404 1106 2HG LYS 134 HG3 LYS 134 -0.695 -16.455 14.939 1107 1HD LYS 134 HD2 LYS 134 0.017 -16.182 17.394 1108 2HD LYS 134 HD3 LYS 134 -1.673 -15.794 17.720 1109 1HE LYS 134 HE2 LYS 134 -2.324 -17.955 16.633 1110 2HE LYS 134 HE3 LYS 134 -0.612 -18.352 16.488 1111 1HZ LYS 134 HZ1 LYS 134 -0.466 -18.017 18.942 1112 2HZ LYS 134 HZ2 LYS 134 -2.162 -17.922 18.978 1113 3HZ LYS 134 HZ3 LYS 134 -1.400 -19.350 18.465 1114 H GLU 135 H GLU 135 -0.632 -10.987 15.263 1115 HA GLU 135 HA GLU 135 0.921 -10.507 17.745 1116 1HB GLU 135 HB2 GLU 135 0.811 -9.098 15.068 1117 2HB GLU 135 HB3 GLU 135 1.712 -8.464 16.447 1118 1HG GLU 135 HG2 GLU 135 2.358 -11.235 16.165 1119 2HG GLU 135 HG3 GLU 135 2.532 -10.469 14.586 1120 H LYS 136 H LYS 136 -2.119 -9.779 16.395 1121 HA LYS 136 HA LYS 136 -3.748 -8.157 16.938 1122 1HB LYS 136 HB2 LYS 136 -2.447 -9.062 19.462 1123 2HB LYS 136 HB3 LYS 136 -3.482 -7.639 19.570 1124 1HG LYS 136 HG2 LYS 136 -5.329 -8.916 19.439 1125 2HG LYS 136 HG3 LYS 136 -4.760 -9.639 17.934 1126 1HD LYS 136 HD2 LYS 136 -3.630 -10.524 20.584 1127 2HD LYS 136 HD3 LYS 136 -5.140 -11.205 19.976 1128 1HE LYS 136 HE2 LYS 136 -4.104 -12.345 18.283 1129 2HE LYS 136 HE3 LYS 136 -2.890 -11.089 18.041 1130 1HZ LYS 136 HZ1 LYS 136 -2.811 -12.562 20.560 1131 2HZ LYS 136 HZ2 LYS 136 -2.317 -13.394 19.163 1132 3HZ LYS 136 HZ3 LYS 136 -1.535 -11.958 19.614 1133 H LEU 137 H LEU 137 -2.108 -6.716 15.592 1134 HA LEU 137 HA LEU 137 -0.995 -4.567 17.329 1135 1HB LEU 137 HB2 LEU 137 0.096 -5.864 15.147 1136 2HB LEU 137 HB3 LEU 137 -0.505 -4.363 14.442 1137 HG LEU 137 HG LEU 137 1.191 -4.457 16.949 1138 1HD1 LEU 137 HD11 LEU 137 1.915 -4.609 14.089 1139 2HD1 LEU 137 HD12 LEU 137 2.769 -3.362 14.997 1140 3HD1 LEU 137 HD13 LEU 137 2.858 -5.046 15.514 1141 1HD2 LEU 137 HD21 LEU 137 -0.416 -2.465 16.041 1142 2HD2 LEU 137 HD22 LEU 137 1.085 -2.169 16.918 1143 3HD2 LEU 137 HD23 LEU 137 1.064 -2.094 15.156 1144 H ASN 138 H ASN 138 -2.022 -2.644 17.438 1145 HA ASN 138 HA ASN 138 -3.724 -1.061 17.100 1146 1HB ASN 138 HB2 ASN 138 -2.745 -1.573 14.279 1147 2HB ASN 138 HB3 ASN 138 -3.799 -0.232 14.726 1148 1HD2 ASN 138 HD21 ASN 138 -0.654 -0.757 14.056 1149 2HD2 ASN 138 HD22 ASN 138 0.082 0.339 15.123 1150 H ILE 139 H ILE 139 -4.471 -2.302 13.933 1151 HA ILE 139 HA ILE 139 -7.243 -2.520 14.434 1152 HB ILE 139 HB ILE 139 -5.537 -3.907 12.349 1153 1HG1 ILE 139 HG12 ILE 139 -7.320 -1.772 11.487 1154 2HG1 ILE 139 HG13 ILE 139 -6.191 -1.206 12.719 1155 1HG2 ILE 139 HG21 ILE 139 -8.370 -4.131 13.016 1156 2HG2 ILE 139 HG22 ILE 139 -8.123 -3.567 11.363 1157 3HG2 ILE 139 HG23 ILE 139 -7.406 -5.090 11.893 1158 1HD1 ILE 139 HD11 ILE 139 -4.905 -2.938 10.746 1159 2HD1 ILE 139 HD12 ILE 139 -5.622 -1.502 10.014 1160 3HD1 ILE 139 HD13 ILE 139 -4.432 -1.334 11.306 1161 H TRP 140 H TRP 140 -4.935 -5.241 14.043 1162 HA TRP 140 HA TRP 140 -6.855 -7.176 14.995 1163 1HB TRP 140 HB2 TRP 140 -3.841 -7.461 14.898 1164 2HB TRP 140 HB3 TRP 140 -5.034 -8.759 14.891 1165 HD1 TRP 140 HD1 TRP 140 -3.131 -6.526 12.625 1166 HE1 TRP 140 HE1 TRP 140 -3.958 -6.795 10.199 1167 HE3 TRP 140 HE3 TRP 140 -7.413 -9.192 13.440 1168 HZ2 TRP 140 HZ2 TRP 140 -6.148 -7.979 8.790 1169 HZ3 TRP 140 HZ3 TRP 140 -8.850 -9.874 11.538 1170 HH2 TRP 140 HH2 TRP 140 -8.222 -9.271 9.216 1171 H SER 141 H SER 141 -5.283 -4.785 16.668 1172 HA SER 141 HA SER 141 -4.781 -6.391 19.099 1173 1HB SER 141 HB2 SER 141 -3.447 -4.274 18.196 1174 2HB SER 141 HB3 SER 141 -4.691 -3.397 19.081 1175 HG SER 141 HG SER 141 -2.967 -3.842 20.453 1176 H GLU 142 H GLU 142 -7.369 -6.734 18.584 1177 HA GLU 142 HA GLU 142 -9.068 -4.638 19.675 1178 1HB GLU 142 HB2 GLU 142 -9.822 -7.552 19.406 1179 2HB GLU 142 HB3 GLU 142 -10.871 -6.137 19.306 1180 1HG GLU 142 HG2 GLU 142 -9.230 -5.517 17.296 1181 2HG GLU 142 HG3 GLU 142 -9.014 -7.267 17.257 1182 H ASP 143 H ASP 143 -10.413 -4.995 21.650 1183 HA ASP 143 HA ASP 143 -8.720 -5.909 23.859 1184 1HB ASP 143 HB2 ASP 143 -11.277 -4.410 23.568 1185 2HB ASP 143 HB3 ASP 143 -11.051 -5.308 25.070 1186 H ASN 144 H ASN 144 -10.445 -7.034 25.659 1187 HA ASN 144 HA ASN 144 -11.399 -9.100 26.235 1188 1HB ASN 144 HB2 ASN 144 -13.084 -8.062 24.482 1189 2HB ASN 144 HB3 ASN 144 -12.485 -9.363 23.452 1190 1HD2 ASN 144 HD21 ASN 144 -14.167 -10.896 23.535 1191 2HD2 ASN 144 HD22 ASN 144 -14.801 -11.538 24.973 1192 H ALA 145 H ALA 145 -11.587 -11.499 25.248 1193 HA ALA 145 HA ALA 145 -10.262 -13.362 24.682 1194 1HB ALA 145 HB1 ALA 145 -9.690 -11.489 22.366 1195 2HB ALA 145 HB2 ALA 145 -9.264 -13.201 22.386 1196 3HB ALA 145 HB3 ALA 145 -10.958 -12.712 22.443 1197 H ASP 146 H ASP 146 -9.004 -11.143 26.309 1198 HA ASP 146 HA ASP 146 -6.152 -11.637 25.559 1199 1HB ASP 146 HB2 ASP 146 -5.762 -9.622 27.121 1200 2HB ASP 146 HB3 ASP 146 -6.505 -9.290 25.557 1201 H SER 147 H SER 147 -8.066 -13.329 27.214 1202 HA SER 147 HA SER 147 -7.980 -14.569 29.207 1203 1HB SER 147 HB2 SER 147 -5.906 -15.463 28.731 1204 2HB SER 147 HB3 SER 147 -5.148 -13.883 28.560 1205 HG SER 147 HG SER 147 -4.672 -15.218 30.519 1206 H GLY 148 H GLY 148 -9.186 -13.440 30.711 1207 1HA GLY 148 HA2 GLY 148 -7.831 -12.107 32.860 1208 2HA GLY 148 HA3 GLY 148 -8.600 -10.911 31.815 1209 H GLN 149 H GLN 149 -10.722 -10.479 32.206 1210 HA GLN 149 HA GLN 149 -12.863 -10.658 33.147 1211 1HB GLN 149 HB2 GLN 149 -12.300 -13.633 32.969 1212 2HB GLN 149 HB3 GLN 149 -13.887 -12.876 33.119 1213 1HG GLN 149 HG2 GLN 149 -13.684 -11.845 30.952 1214 2HG GLN 149 HG3 GLN 149 -11.990 -12.323 30.822 1215 1HE2 GLN 149 HE21 GLN 149 -15.191 -13.290 30.075 1216 2HE2 GLN 149 HE22 GLN 149 -14.853 -14.900 29.653 1217 HN3 PTP 150 H3 PTP 150 -9.670 -3.376 -8.530 1218 1H5M PTP 150 H51 PTP 150 -6.554 -2.365 -5.268 1219 2H5M PTP 150 H52 PTP 150 -7.674 -2.101 -3.911 1220 3H5M PTP 150 H53 PTP 150 -7.029 -0.711 -4.816 1221 H6 PTP 150 H6 PTP 150 -9.604 -0.307 -4.833 1222 H1* PTP 150 H1' PTP 150 -12.336 -0.001 -7.260 1223 2H2* PTP 150 H2' PTP 150 -12.381 -1.494 -4.655 1224 H3* PTP 150 H3' PTP 150 -13.303 0.328 -3.443 1225 H4* PTP 150 H4' PTP 150 -12.189 2.506 -4.650 1226 2H5* PTP 150 H5' PTP 150 -10.957 0.150 -3.131 Start of MODEL 27 1 1H ALA 1 H1 ALA 1 7.230 -12.014 -26.299 2 2H ALA 1 H2 ALA 1 7.647 -11.025 -27.618 3 3H ALA 1 H3 ALA 1 6.254 -11.989 -27.690 4 HA ALA 1 HA ALA 1 7.370 -13.836 -28.246 5 1HB ALA 1 HB1 ALA 1 9.056 -11.481 -28.967 6 2HB ALA 1 HB2 ALA 1 9.758 -13.083 -29.193 7 3HB ALA 1 HB3 ALA 1 8.259 -12.655 -30.016 8 H THR 2 H THR 2 10.317 -12.160 -27.208 9 HA THR 2 HA THR 2 10.628 -14.205 -25.051 10 HB THR 2 HB THR 2 13.065 -14.285 -25.630 11 HG1 THR 2 HG1 THR 2 13.782 -12.947 -27.059 12 1HG2 THR 2 HG21 THR 2 11.032 -15.064 -27.729 13 2HG2 THR 2 HG22 THR 2 12.720 -15.568 -27.798 14 3HG2 THR 2 HG23 THR 2 11.702 -16.077 -26.450 15 H SER 3 H SER 3 9.923 -12.473 -23.605 16 HA SER 3 HA SER 3 12.097 -10.477 -23.114 17 1HB SER 3 HB2 SER 3 10.322 -8.910 -22.330 18 2HB SER 3 HB3 SER 3 10.157 -9.312 -24.037 19 HG SER 3 HG SER 3 8.250 -10.018 -23.544 20 H THR 4 H THR 4 11.349 -9.480 -20.712 21 HA THR 4 HA THR 4 11.994 -11.591 -18.884 22 HB THR 4 HB THR 4 10.632 -9.051 -18.016 23 HG1 THR 4 HG1 THR 4 13.065 -8.420 -18.110 24 1HG2 THR 4 HG21 THR 4 12.108 -11.170 -16.789 25 2HG2 THR 4 HG22 THR 4 13.045 -9.684 -16.637 26 3HG2 THR 4 HG23 THR 4 11.393 -9.751 -16.023 27 H LYS 5 H LYS 5 10.652 -12.669 -17.363 28 HA LYS 5 HA LYS 5 7.716 -12.434 -17.896 29 1HB LYS 5 HB2 LYS 5 9.477 -14.725 -18.117 30 2HB LYS 5 HB3 LYS 5 8.225 -15.022 -16.910 31 1HG LYS 5 HG2 LYS 5 7.547 -13.857 -19.608 32 2HG LYS 5 HG3 LYS 5 7.671 -15.601 -19.371 33 1HD LYS 5 HD2 LYS 5 6.117 -14.970 -17.250 34 2HD LYS 5 HD3 LYS 5 5.624 -13.697 -18.368 35 1HE LYS 5 HE2 LYS 5 5.482 -16.687 -18.777 36 2HE LYS 5 HE3 LYS 5 4.162 -15.520 -18.820 37 1HZ LYS 5 HZ1 LYS 5 5.807 -14.554 -20.700 38 2HZ LYS 5 HZ2 LYS 5 6.071 -16.221 -20.872 39 3HZ LYS 5 HZ3 LYS 5 4.500 -15.592 -21.017 40 H LYS 6 H LYS 6 9.663 -11.347 -15.762 41 HA LYS 6 HA LYS 6 8.062 -12.311 -13.428 42 1HB LYS 6 HB2 LYS 6 10.975 -12.275 -13.817 43 2HB LYS 6 HB3 LYS 6 10.455 -11.488 -12.325 44 1HG LYS 6 HG2 LYS 6 9.039 -13.532 -11.853 45 2HG LYS 6 HG3 LYS 6 9.832 -14.313 -13.222 46 1HD LYS 6 HD2 LYS 6 11.154 -14.996 -11.407 47 2HD LYS 6 HD3 LYS 6 12.044 -13.607 -12.032 48 1HE LYS 6 HE2 LYS 6 11.291 -12.192 -10.303 49 2HE LYS 6 HE3 LYS 6 9.955 -13.265 -9.887 50 1HZ LYS 6 HZ1 LYS 6 12.269 -14.754 -9.621 51 2HZ LYS 6 HZ2 LYS 6 12.602 -13.257 -8.895 52 3HZ LYS 6 HZ3 LYS 6 11.268 -14.173 -8.376 53 H LEU 7 H LEU 7 7.029 -10.197 -14.597 54 HA LEU 7 HA LEU 7 6.636 -7.877 -14.492 55 1HB LEU 7 HB2 LEU 7 7.315 -8.655 -11.649 56 2HB LEU 7 HB3 LEU 7 6.666 -7.075 -12.086 57 HG LEU 7 HG LEU 7 5.336 -9.736 -12.664 58 1HD1 LEU 7 HD11 LEU 7 5.355 -8.026 -10.336 59 2HD1 LEU 7 HD12 LEU 7 3.738 -8.071 -11.035 60 3HD1 LEU 7 HD13 LEU 7 4.536 -9.571 -10.566 61 1HD2 LEU 7 HD21 LEU 7 4.934 -7.004 -13.644 62 2HD2 LEU 7 HD22 LEU 7 4.269 -8.520 -14.251 63 3HD2 LEU 7 HD23 LEU 7 3.480 -7.684 -12.914 64 H HIS 8 H HIS 8 7.774 -5.860 -12.962 65 HA HIS 8 HA HIS 8 10.689 -5.994 -13.118 66 1HB HIS 8 HB2 HIS 8 9.860 -5.586 -15.512 67 2HB HIS 8 HB3 HIS 8 9.313 -4.010 -14.939 68 HD1 HIS 8 HD1 HIS 8 11.007 -2.251 -15.392 69 HD2 HIS 8 HD2 HIS 8 12.813 -5.911 -14.542 70 HE1 HIS 8 HE1 HIS 8 13.507 -1.861 -15.509 71 H LYS 9 H LYS 9 11.655 -4.210 -12.025 72 HA LYS 9 HA LYS 9 9.686 -2.471 -10.594 73 1HB LYS 9 HB2 LYS 9 12.484 -3.224 -9.701 74 2HB LYS 9 HB3 LYS 9 11.263 -2.371 -8.756 75 1HG LYS 9 HG2 LYS 9 9.812 -4.522 -9.306 76 2HG LYS 9 HG3 LYS 9 11.399 -5.267 -9.502 77 1HD LYS 9 HD2 LYS 9 10.452 -3.755 -7.051 78 2HD LYS 9 HD3 LYS 9 10.610 -5.507 -7.180 79 1HE LYS 9 HE2 LYS 9 13.023 -3.965 -7.931 80 2HE LYS 9 HE3 LYS 9 12.579 -3.884 -6.226 81 1HZ LYS 9 HZ1 LYS 9 12.409 -6.358 -6.292 82 2HZ LYS 9 HZ2 LYS 9 13.102 -6.314 -7.842 83 3HZ LYS 9 HZ3 LYS 9 13.982 -5.753 -6.504 84 H GLU 10 H GLU 10 9.836 -0.311 -10.970 85 HA GLU 10 HA GLU 10 12.374 0.709 -12.186 86 1HB GLU 10 HB2 GLU 10 9.529 1.598 -12.768 87 2HB GLU 10 HB3 GLU 10 10.984 2.329 -13.446 88 1HG GLU 10 HG2 GLU 10 10.672 0.845 -15.141 89 2HG GLU 10 HG3 GLU 10 11.400 -0.313 -14.026 90 HA PRO 11 HA PRO 11 12.428 3.639 -8.905 91 1HB PRO 11 HB2 PRO 11 13.754 5.689 -10.135 92 2HB PRO 11 HB3 PRO 11 14.543 4.186 -9.629 93 1HG PRO 11 HG2 PRO 11 13.705 5.053 -12.366 94 2HG PRO 11 HG3 PRO 11 15.099 4.076 -11.875 95 1HD PRO 11 HD2 PRO 11 12.756 3.037 -12.959 96 2HD PRO 11 HD3 PRO 11 13.908 2.110 -11.974 97 H ALA 12 H ALA 12 11.666 5.832 -8.311 98 HA ALA 12 HA ALA 12 9.877 7.160 -10.263 99 1HB ALA 12 HB1 ALA 12 8.625 5.337 -8.895 100 2HB ALA 12 HB2 ALA 12 8.788 6.457 -7.542 101 3HB ALA 12 HB3 ALA 12 7.906 6.944 -8.989 102 H THR 13 H THR 13 8.683 9.017 -8.694 103 HA THR 13 HA THR 13 10.932 10.254 -7.155 104 HB THR 13 HB THR 13 8.975 11.928 -8.707 105 HG1 THR 13 HG1 THR 13 11.089 10.380 -9.666 106 1HG2 THR 13 HG21 THR 13 10.487 12.988 -7.071 107 2HG2 THR 13 HG22 THR 13 11.876 12.280 -7.897 108 3HG2 THR 13 HG23 THR 13 10.883 13.487 -8.715 109 H LEU 14 H LEU 14 10.351 11.026 -5.162 110 HA LEU 14 HA LEU 14 7.598 10.571 -4.262 111 1HB LEU 14 HB2 LEU 14 9.387 10.014 -2.725 112 2HB LEU 14 HB3 LEU 14 10.064 11.637 -2.857 113 HG LEU 14 HG LEU 14 7.801 12.482 -1.987 114 1HD1 LEU 14 HD11 LEU 14 7.586 9.545 -1.251 115 2HD1 LEU 14 HD12 LEU 14 6.524 10.822 -0.658 116 3HD1 LEU 14 HD13 LEU 14 6.536 10.411 -2.373 117 1HD2 LEU 14 HD21 LEU 14 10.117 11.509 -0.669 118 2HD2 LEU 14 HD22 LEU 14 8.962 12.700 -0.069 119 3HD2 LEU 14 HD23 LEU 14 8.735 10.989 0.297 120 H ILE 15 H ILE 15 6.402 12.150 -5.454 121 HA ILE 15 HA ILE 15 7.139 14.965 -5.360 122 HB ILE 15 HB ILE 15 4.480 13.705 -6.100 123 1HG1 ILE 15 HG12 ILE 15 6.991 14.279 -7.694 124 2HG1 ILE 15 HG13 ILE 15 6.140 12.742 -7.531 125 1HG2 ILE 15 HG21 ILE 15 5.177 16.378 -5.707 126 2HG2 ILE 15 HG22 ILE 15 5.312 16.157 -7.452 127 3HG2 ILE 15 HG23 ILE 15 3.794 15.793 -6.633 128 1HD1 ILE 15 HD11 ILE 15 4.126 13.970 -8.593 129 2HD1 ILE 15 HD12 ILE 15 5.301 15.194 -9.075 130 3HD1 ILE 15 HD13 ILE 15 5.469 13.535 -9.652 131 H LYS 16 H LYS 16 4.443 13.092 -3.901 132 HA LYS 16 HA LYS 16 4.675 14.486 -1.386 133 1HB LYS 16 HB2 LYS 16 3.624 16.211 -3.013 134 2HB LYS 16 HB3 LYS 16 2.179 15.203 -2.921 135 1HG LYS 16 HG2 LYS 16 2.469 15.363 -0.356 136 2HG LYS 16 HG3 LYS 16 3.555 16.710 -0.700 137 1HD LYS 16 HD2 LYS 16 1.417 17.325 -2.297 138 2HD LYS 16 HD3 LYS 16 0.616 16.561 -0.923 139 1HE LYS 16 HE2 LYS 16 1.235 18.218 0.536 140 2HE LYS 16 HE3 LYS 16 2.771 18.507 -0.282 141 1HZ LYS 16 HZ1 LYS 16 0.136 19.268 -1.410 142 2HZ LYS 16 HZ2 LYS 16 1.117 20.327 -0.520 143 3HZ LYS 16 HZ3 LYS 16 1.671 19.698 -1.998 144 H ALA 17 H ALA 17 4.117 12.839 -0.056 145 HA ALA 17 HA ALA 17 2.244 10.761 -0.940 146 1HB ALA 17 HB1 ALA 17 4.280 10.273 0.458 147 2HB ALA 17 HB2 ALA 17 3.512 11.139 1.788 148 3HB ALA 17 HB3 ALA 17 2.780 9.664 1.158 149 H ILE 18 H ILE 18 0.287 10.229 0.322 150 HA ILE 18 HA ILE 18 -0.826 12.618 1.736 151 HB ILE 18 HB ILE 18 -2.290 10.731 -0.133 152 1HG1 ILE 18 HG12 ILE 18 -1.411 13.625 -0.395 153 2HG1 ILE 18 HG13 ILE 18 -0.856 12.262 -1.366 154 1HG2 ILE 18 HG21 ILE 18 -3.403 11.946 1.987 155 2HG2 ILE 18 HG22 ILE 18 -3.449 13.296 0.854 156 3HG2 ILE 18 HG23 ILE 18 -4.255 11.780 0.453 157 1HD1 ILE 18 HD11 ILE 18 -3.774 12.530 -1.344 158 2HD1 ILE 18 HD12 ILE 18 -2.957 13.939 -2.019 159 3HD1 ILE 18 HD13 ILE 18 -2.673 12.341 -2.708 160 H ASP 19 H ASP 19 -1.733 9.184 1.192 161 HA ASP 19 HA ASP 19 -2.300 9.029 4.122 162 1HB ASP 19 HB2 ASP 19 -3.373 7.403 1.798 163 2HB ASP 19 HB3 ASP 19 -3.713 7.047 3.492 164 H GLY 20 H GLY 20 -2.283 6.282 4.448 165 1HA GLY 20 HA2 GLY 20 0.605 5.745 4.385 166 2HA GLY 20 HA3 GLY 20 -0.616 4.748 5.174 167 H ASP 21 H ASP 21 -1.786 5.380 2.150 168 HA ASP 21 HA ASP 21 -0.267 3.248 0.774 169 1HB ASP 21 HB2 ASP 21 -2.317 1.963 0.269 170 2HB ASP 21 HB3 ASP 21 -2.024 2.030 2.007 171 H THR 22 H THR 22 -0.954 6.204 0.506 172 HA THR 22 HA THR 22 -1.618 6.066 -2.373 173 HB THR 22 HB THR 22 -3.162 7.826 -0.440 174 HG1 THR 22 HG1 THR 22 -4.665 6.355 -0.527 175 1HG2 THR 22 HG21 THR 22 -2.616 8.653 -2.828 176 2HG2 THR 22 HG22 THR 22 -3.717 7.388 -3.370 177 3HG2 THR 22 HG23 THR 22 -4.305 8.678 -2.322 178 H VAL 23 H VAL 23 0.220 7.040 -3.131 179 HA VAL 23 HA VAL 23 0.817 9.769 -2.102 180 HB VAL 23 HB VAL 23 3.144 9.333 -1.833 181 1HG1 VAL 23 HG11 VAL 23 1.327 8.186 -0.217 182 2HG1 VAL 23 HG12 VAL 23 2.157 6.730 -0.769 183 3HG1 VAL 23 HG13 VAL 23 3.062 8.006 0.045 184 1HG2 VAL 23 HG21 VAL 23 2.498 6.956 -3.510 185 2HG2 VAL 23 HG22 VAL 23 3.918 8.002 -3.543 186 3HG2 VAL 23 HG23 VAL 23 3.772 6.752 -2.307 187 H LYS 24 H LYS 24 1.510 11.180 -3.717 188 HA LYS 24 HA LYS 24 1.264 10.170 -6.480 189 1HB LYS 24 HB2 LYS 24 1.969 13.014 -5.887 190 2HB LYS 24 HB3 LYS 24 0.873 12.361 -7.106 191 1HG LYS 24 HG2 LYS 24 -0.447 11.585 -4.889 192 2HG LYS 24 HG3 LYS 24 0.354 13.021 -4.252 193 1HD LYS 24 HD2 LYS 24 -1.259 12.987 -6.816 194 2HD LYS 24 HD3 LYS 24 -1.905 13.490 -5.254 195 1HE LYS 24 HE2 LYS 24 -0.795 15.476 -5.292 196 2HE LYS 24 HE3 LYS 24 0.656 14.761 -5.996 197 1HZ LYS 24 HZ1 LYS 24 -1.851 15.280 -7.499 198 2HZ LYS 24 HZ2 LYS 24 -0.509 16.322 -7.492 199 3HZ LYS 24 HZ3 LYS 24 -0.370 14.757 -8.139 200 H LEU 25 H LEU 25 3.053 9.490 -7.554 201 HA LEU 25 HA LEU 25 5.658 10.794 -6.874 202 1HB LEU 25 HB2 LEU 25 5.427 7.940 -7.833 203 2HB LEU 25 HB3 LEU 25 6.793 8.721 -7.040 204 HG LEU 25 HG LEU 25 4.613 9.000 -5.266 205 1HD1 LEU 25 HD11 LEU 25 3.906 6.953 -6.897 206 2HD1 LEU 25 HD12 LEU 25 4.887 6.077 -5.722 207 3HD1 LEU 25 HD13 LEU 25 3.488 7.006 -5.184 208 1HD2 LEU 25 HD21 LEU 25 7.295 8.075 -5.314 209 2HD2 LEU 25 HD22 LEU 25 6.309 8.427 -3.895 210 3HD2 LEU 25 HD23 LEU 25 6.338 6.797 -4.567 211 H MET 26 H MET 26 7.116 11.049 -8.667 212 HA MET 26 HA MET 26 5.735 11.407 -11.230 213 1HB MET 26 HB2 MET 26 7.557 12.944 -10.214 214 2HB MET 26 HB3 MET 26 8.702 11.722 -10.770 215 1HG MET 26 HG2 MET 26 8.007 11.995 -13.056 216 2HG MET 26 HG3 MET 26 6.641 13.002 -12.579 217 1HE MET 26 HE1 MET 26 7.421 14.073 -14.466 218 2HE MET 26 HE2 MET 26 7.763 15.750 -14.019 219 3HE MET 26 HE3 MET 26 9.017 14.760 -14.762 220 H TYR 27 H TYR 27 5.917 10.046 -12.990 221 HA TYR 27 HA TYR 27 7.955 7.876 -12.877 222 1HB TYR 27 HB2 TYR 27 5.843 6.968 -11.952 223 2HB TYR 27 HB3 TYR 27 5.002 7.443 -13.428 224 HD1 TYR 27 HD1 TYR 27 7.693 5.265 -12.069 225 HD2 TYR 27 HD2 TYR 27 5.147 6.133 -15.419 226 HE1 TYR 27 HE1 TYR 27 8.388 3.143 -13.149 227 HE2 TYR 27 HE2 TYR 27 5.842 4.012 -16.498 228 HH TYR 27 HH TYR 27 6.840 1.621 -15.377 229 H LYS 28 H LYS 28 9.087 8.126 -14.739 230 HA LYS 28 HA LYS 28 9.548 8.460 -17.014 231 1HB LYS 28 HB2 LYS 28 6.663 7.563 -17.176 232 2HB LYS 28 HB3 LYS 28 7.681 7.828 -18.593 233 1HG LYS 28 HG2 LYS 28 8.103 5.821 -16.368 234 2HG LYS 28 HG3 LYS 28 7.836 5.496 -18.078 235 1HD LYS 28 HD2 LYS 28 9.995 6.905 -18.446 236 2HD LYS 28 HD3 LYS 28 10.295 6.585 -16.738 237 1HE LYS 28 HE2 LYS 28 10.947 4.476 -17.179 238 2HE LYS 28 HE3 LYS 28 9.472 4.160 -18.093 239 1HZ LYS 28 HZ1 LYS 28 11.781 5.659 -19.193 240 2HZ LYS 28 HZ2 LYS 28 11.578 3.985 -19.390 241 3HZ LYS 28 HZ3 LYS 28 10.437 5.063 -20.041 242 H GLY 29 H GLY 29 8.564 10.700 -15.343 243 1HA GLY 29 HA2 GLY 29 8.225 12.994 -15.807 244 2HA GLY 29 HA3 GLY 29 8.067 12.586 -17.516 245 H GLN 30 H GLN 30 6.149 10.874 -15.171 246 HA GLN 30 HA GLN 30 3.784 12.563 -15.838 247 1HB GLN 30 HB2 GLN 30 3.623 10.724 -17.379 248 2HB GLN 30 HB3 GLN 30 4.012 9.557 -16.115 249 1HG GLN 30 HG2 GLN 30 1.928 10.195 -14.917 250 2HG GLN 30 HG3 GLN 30 1.526 11.289 -16.241 251 1HE2 GLN 30 HE21 GLN 30 2.738 7.882 -16.098 252 2HE2 GLN 30 HE22 GLN 30 1.558 7.269 -17.154 253 HA PRO 31 HA PRO 31 3.796 11.950 -11.334 254 1HB PRO 31 HB2 PRO 31 2.330 14.207 -10.840 255 2HB PRO 31 HB3 PRO 31 4.081 14.234 -11.122 256 1HG PRO 31 HG2 PRO 31 1.855 14.940 -12.999 257 2HG PRO 31 HG3 PRO 31 3.453 15.684 -12.821 258 1HD PRO 31 HD2 PRO 31 2.809 13.896 -14.829 259 2HD PRO 31 HD3 PRO 31 4.461 14.159 -14.228 260 H MET 32 H MET 32 2.331 10.481 -10.551 261 HA MET 32 HA MET 32 -0.563 11.010 -10.969 262 1HB MET 32 HB2 MET 32 0.944 8.896 -12.243 263 2HB MET 32 HB3 MET 32 -0.268 8.210 -11.159 264 1HG MET 32 HG2 MET 32 -2.049 9.248 -12.289 265 2HG MET 32 HG3 MET 32 -0.996 10.446 -13.043 266 1HE MET 32 HE1 MET 32 0.084 6.862 -12.579 267 2HE MET 32 HE2 MET 32 -1.642 6.559 -12.767 268 3HE MET 32 HE3 MET 32 -0.501 5.987 -13.992 269 H THR 33 H THR 33 -1.860 9.396 -9.537 270 HA THR 33 HA THR 33 -0.469 9.261 -6.908 271 HB THR 33 HB THR 33 -3.208 8.590 -6.629 272 HG1 THR 33 HG1 THR 33 -3.590 9.476 -8.649 273 1HG2 THR 33 HG21 THR 33 -1.515 9.988 -5.214 274 2HG2 THR 33 HG22 THR 33 -2.098 11.347 -6.175 275 3HG2 THR 33 HG23 THR 33 -3.224 10.426 -5.177 276 H PHE 34 H PHE 34 0.298 7.300 -6.316 277 HA PHE 34 HA PHE 34 -0.840 4.874 -7.604 278 1HB PHE 34 HB2 PHE 34 1.744 5.471 -6.167 279 2HB PHE 34 HB3 PHE 34 1.211 3.809 -6.421 280 HD1 PHE 34 HD1 PHE 34 2.349 6.906 -8.058 281 HD2 PHE 34 HD2 PHE 34 1.087 2.844 -8.659 282 HE1 PHE 34 HE1 PHE 34 3.207 6.984 -10.382 283 HE2 PHE 34 HE2 PHE 34 1.943 2.923 -10.985 284 HZ PHE 34 HZ PHE 34 3.003 4.993 -11.848 285 H ARG 35 H ARG 35 -1.750 3.210 -6.371 286 HA ARG 35 HA ARG 35 -2.047 3.759 -3.443 287 1HB ARG 35 HB2 ARG 35 -4.165 4.176 -4.663 288 2HB ARG 35 HB3 ARG 35 -4.108 2.535 -5.307 289 1HG ARG 35 HG2 ARG 35 -5.045 1.730 -3.427 290 2HG ARG 35 HG3 ARG 35 -3.751 2.434 -2.456 291 1HD ARG 35 HD2 ARG 35 -4.940 4.599 -2.435 292 2HD ARG 35 HD3 ARG 35 -6.237 3.894 -3.401 293 HE ARG 35 HE ARG 35 -5.781 2.365 -0.989 294 1HH1 ARG 35 HH11 ARG 35 -7.326 5.097 -2.422 295 2HH1 ARG 35 HH12 ARG 35 -8.473 5.286 -1.138 296 1HH2 ARG 35 HH21 ARG 35 -7.206 2.663 0.742 297 2HH2 ARG 35 HH22 ARG 35 -8.403 3.912 0.653 298 H LEU 36 H LEU 36 -1.384 2.088 -2.166 299 HA LEU 36 HA LEU 36 0.030 -0.131 -3.060 300 1HB LEU 36 HB2 LEU 36 -1.733 -0.051 -0.595 301 2HB LEU 36 HB3 LEU 36 -0.363 -1.129 -0.859 302 HG LEU 36 HG LEU 36 -0.324 1.874 -0.509 303 1HD1 LEU 36 HD11 LEU 36 0.622 -0.528 0.994 304 2HD1 LEU 36 HD12 LEU 36 1.600 0.937 1.084 305 3HD1 LEU 36 HD13 LEU 36 -0.086 0.968 1.603 306 1HD2 LEU 36 HD21 LEU 36 1.721 0.019 -1.720 307 2HD2 LEU 36 HD22 LEU 36 1.187 1.597 -2.298 308 3HD2 LEU 36 HD23 LEU 36 2.224 1.483 -0.877 309 H LEU 37 H LEU 37 -0.488 -2.120 -3.885 310 HA LEU 37 HA LEU 37 -3.319 -2.594 -4.585 311 1HB LEU 37 HB2 LEU 37 -0.673 -3.586 -5.511 312 2HB LEU 37 HB3 LEU 37 -2.028 -4.706 -5.648 313 HG LEU 37 HG LEU 37 -2.362 -1.874 -6.583 314 1HD1 LEU 37 HD11 LEU 37 -0.250 -2.752 -7.597 315 2HD1 LEU 37 HD12 LEU 37 -1.163 -4.119 -8.233 316 3HD1 LEU 37 HD13 LEU 37 -1.520 -2.484 -8.790 317 1HD2 LEU 37 HD21 LEU 37 -3.595 -4.570 -7.063 318 2HD2 LEU 37 HD22 LEU 37 -4.383 -3.032 -6.713 319 3HD2 LEU 37 HD23 LEU 37 -3.718 -3.337 -8.318 320 H LEU 38 H LEU 38 -4.343 -4.658 -4.154 321 HA LEU 38 HA LEU 38 -4.989 -6.397 -2.729 322 1HB LEU 38 HB2 LEU 38 -1.982 -6.604 -2.683 323 2HB LEU 38 HB3 LEU 38 -2.996 -7.722 -1.769 324 HG LEU 38 HG LEU 38 -3.648 -7.225 -4.650 325 1HD1 LEU 38 HD11 LEU 38 -1.170 -8.446 -3.622 326 2HD1 LEU 38 HD12 LEU 38 -2.065 -9.470 -4.745 327 3HD1 LEU 38 HD13 LEU 38 -1.546 -7.859 -5.242 328 1HD2 LEU 38 HD21 LEU 38 -4.986 -8.641 -2.950 329 2HD2 LEU 38 HD22 LEU 38 -4.615 -9.385 -4.505 330 3HD2 LEU 38 HD23 LEU 38 -3.667 -9.805 -3.079 331 H VAL 39 H VAL 39 -4.264 -3.580 -1.583 332 HA VAL 39 HA VAL 39 -4.652 -4.434 1.217 333 HB VAL 39 HB VAL 39 -2.805 -3.211 2.116 334 1HG1 VAL 39 HG11 VAL 39 -2.251 -5.438 1.176 335 2HG1 VAL 39 HG12 VAL 39 -1.844 -4.675 -0.359 336 3HG1 VAL 39 HG13 VAL 39 -0.882 -4.331 1.077 337 1HG2 VAL 39 HG21 VAL 39 -2.300 -2.258 -0.722 338 2HG2 VAL 39 HG22 VAL 39 -2.941 -1.274 0.595 339 3HG2 VAL 39 HG23 VAL 39 -1.290 -1.888 0.676 340 H ASP 40 H ASP 40 -5.195 -2.510 2.614 341 HA ASP 40 HA ASP 40 -6.053 -0.093 1.152 342 1HB ASP 40 HB2 ASP 40 -7.924 -1.845 1.039 343 2HB ASP 40 HB3 ASP 40 -8.076 -1.639 2.784 344 H THR 41 H THR 41 -6.047 1.696 2.497 345 HA THR 41 HA THR 41 -4.928 1.343 5.174 346 HB THR 41 HB THR 41 -4.147 3.240 3.919 347 HG1 THR 41 HG1 THR 41 -4.834 4.944 5.302 348 1HG2 THR 41 HG21 THR 41 -7.090 3.764 3.525 349 2HG2 THR 41 HG22 THR 41 -5.892 5.039 3.303 350 3HG2 THR 41 HG23 THR 41 -5.832 3.589 2.301 351 HA PRO 42 HA PRO 42 -8.768 1.401 7.349 352 1HB PRO 42 HB2 PRO 42 -7.818 2.145 9.798 353 2HB PRO 42 HB3 PRO 42 -7.541 0.538 9.104 354 1HG PRO 42 HG2 PRO 42 -5.654 2.832 9.360 355 2HG PRO 42 HG3 PRO 42 -5.321 1.092 9.378 356 1HD PRO 42 HD2 PRO 42 -4.923 2.807 7.186 357 2HD PRO 42 HD3 PRO 42 -4.981 1.033 7.115 358 H GLU 43 H GLU 43 -9.217 3.472 5.920 359 HA GLU 43 HA GLU 43 -10.118 5.637 5.852 360 1HB GLU 43 HB2 GLU 43 -11.342 4.763 7.877 361 2HB GLU 43 HB3 GLU 43 -10.065 5.454 8.877 362 1HG GLU 43 HG2 GLU 43 -11.725 7.137 8.836 363 2HG GLU 43 HG3 GLU 43 -10.552 7.666 7.628 364 H THR 44 H THR 44 -9.218 7.689 5.710 365 HA THR 44 HA THR 44 -7.135 8.608 7.512 366 HB THR 44 HB THR 44 -5.509 8.801 5.426 367 HG1 THR 44 HG1 THR 44 -5.818 6.608 4.369 368 1HG2 THR 44 HG21 THR 44 -5.367 7.443 7.672 369 2HG2 THR 44 HG22 THR 44 -5.713 6.061 6.633 370 3HG2 THR 44 HG23 THR 44 -4.278 7.046 6.341 371 H LYS 45 H LYS 45 -9.540 9.767 6.805 372 HA LYS 45 HA LYS 45 -8.701 11.976 4.967 373 1HB LYS 45 HB2 LYS 45 -11.337 10.597 5.383 374 2HB LYS 45 HB3 LYS 45 -11.316 12.282 4.860 375 1HG LYS 45 HG2 LYS 45 -9.387 10.968 3.277 376 2HG LYS 45 HG3 LYS 45 -10.790 9.900 3.310 377 1HD LYS 45 HD2 LYS 45 -11.646 12.643 3.008 378 2HD LYS 45 HD3 LYS 45 -10.469 12.235 1.759 379 1HE LYS 45 HE2 LYS 45 -12.284 11.361 0.689 380 2HE LYS 45 HE3 LYS 45 -11.999 9.983 1.753 381 1HZ LYS 45 HZ1 LYS 45 -13.600 12.205 2.782 382 2HZ LYS 45 HZ2 LYS 45 -14.322 11.171 1.641 383 3HZ LYS 45 HZ3 LYS 45 -13.722 10.544 3.102 384 H HIS 46 H HIS 46 -8.052 11.962 7.751 385 HA HIS 46 HA HIS 46 -10.008 13.891 8.909 386 1HB HIS 46 HB2 HIS 46 -8.074 11.940 10.028 387 2HB HIS 46 HB3 HIS 46 -8.215 13.465 10.903 388 HD1 HIS 46 HD1 HIS 46 -9.889 10.250 10.430 389 HD2 HIS 46 HD2 HIS 46 -11.032 14.073 11.637 390 HE1 HIS 46 HE1 HIS 46 -12.138 10.000 11.567 391 HA PRO 47 HA PRO 47 -7.270 17.303 8.443 392 1HB PRO 47 HB2 PRO 47 -7.790 18.701 10.734 393 2HB PRO 47 HB3 PRO 47 -8.944 18.580 9.394 394 1HG PRO 47 HG2 PRO 47 -8.940 17.142 12.018 395 2HG PRO 47 HG3 PRO 47 -10.310 17.718 11.052 396 1HD PRO 47 HD2 PRO 47 -9.451 15.075 11.129 397 2HD PRO 47 HD3 PRO 47 -10.401 15.785 9.806 398 H LYS 48 H LYS 48 -5.633 18.676 9.975 399 HA LYS 48 HA LYS 48 -3.494 16.938 10.657 400 1HB LYS 48 HB2 LYS 48 -2.621 19.000 11.920 401 2HB LYS 48 HB3 LYS 48 -2.944 19.207 10.199 402 1HG LYS 48 HG2 LYS 48 -5.368 19.708 11.647 403 2HG LYS 48 HG3 LYS 48 -4.073 20.663 12.369 404 1HD LYS 48 HD2 LYS 48 -3.455 21.314 9.949 405 2HD LYS 48 HD3 LYS 48 -5.044 20.687 9.512 406 1HE LYS 48 HE2 LYS 48 -6.172 22.358 10.648 407 2HE LYS 48 HE3 LYS 48 -4.866 22.594 11.809 408 1HZ LYS 48 HZ1 LYS 48 -4.393 23.225 8.981 409 2HZ LYS 48 HZ2 LYS 48 -5.279 24.320 9.925 410 3HZ LYS 48 HZ3 LYS 48 -3.693 23.906 10.371 411 H LYS 49 H LYS 49 -6.331 17.760 12.414 412 HA LYS 49 HA LYS 49 -5.346 17.469 15.090 413 1HB LYS 49 HB2 LYS 49 -8.083 16.987 13.882 414 2HB LYS 49 HB3 LYS 49 -7.759 16.897 15.614 415 1HG LYS 49 HG2 LYS 49 -6.901 19.229 15.552 416 2HG LYS 49 HG3 LYS 49 -7.307 19.314 13.838 417 1HD LYS 49 HD2 LYS 49 -9.155 20.302 14.981 418 2HD LYS 49 HD3 LYS 49 -9.694 18.686 14.519 419 1HE LYS 49 HE2 LYS 49 -8.439 18.353 17.010 420 2HE LYS 49 HE3 LYS 49 -9.399 19.824 17.172 421 1HZ LYS 49 HZ1 LYS 49 -11.117 18.261 15.890 422 2HZ LYS 49 HZ2 LYS 49 -10.260 17.081 16.756 423 3HZ LYS 49 HZ3 LYS 49 -11.028 18.351 17.585 424 H GLY 50 H GLY 50 -6.826 15.106 12.850 425 1HA GLY 50 HA2 GLY 50 -6.249 12.797 12.688 426 2HA GLY 50 HA3 GLY 50 -5.271 12.965 14.146 427 H VAL 51 H VAL 51 -6.419 10.908 14.749 428 HA VAL 51 HA VAL 51 -9.002 11.571 16.094 429 HB VAL 51 HB VAL 51 -8.468 8.834 14.955 430 1HG1 VAL 51 HG11 VAL 51 -10.597 10.196 16.365 431 2HG1 VAL 51 HG12 VAL 51 -11.176 9.604 14.809 432 3HG1 VAL 51 HG13 VAL 51 -10.452 8.485 15.964 433 1HG2 VAL 51 HG21 VAL 51 -9.558 11.275 13.538 434 2HG2 VAL 51 HG22 VAL 51 -8.256 10.209 13.013 435 3HG2 VAL 51 HG23 VAL 51 -9.922 9.634 13.004 436 H GLU 52 H GLU 52 -9.470 9.834 17.836 437 HA GLU 52 HA GLU 52 -6.973 9.460 19.377 438 1HB GLU 52 HB2 GLU 52 -9.862 9.639 19.992 439 2HB GLU 52 HB3 GLU 52 -8.961 8.489 20.979 440 1HG GLU 52 HG2 GLU 52 -7.271 10.309 21.420 441 2HG GLU 52 HG3 GLU 52 -8.360 11.435 20.607 442 H LYS 53 H LYS 53 -7.295 7.789 17.067 443 HA LYS 53 HA LYS 53 -7.299 5.145 18.427 444 1HB LYS 53 HB2 LYS 53 -9.394 6.015 16.749 445 2HB LYS 53 HB3 LYS 53 -8.429 4.904 15.775 446 1HG LYS 53 HG2 LYS 53 -8.491 3.316 17.780 447 2HG LYS 53 HG3 LYS 53 -9.741 4.369 18.445 448 1HD LYS 53 HD2 LYS 53 -9.936 3.216 15.658 449 2HD LYS 53 HD3 LYS 53 -10.557 2.362 17.072 450 1HE LYS 53 HE2 LYS 53 -12.436 3.564 16.346 451 2HE LYS 53 HE3 LYS 53 -11.768 4.619 17.592 452 1HZ LYS 53 HZ1 LYS 53 -10.480 5.220 15.196 453 2HZ LYS 53 HZ2 LYS 53 -12.145 5.158 14.863 454 3HZ LYS 53 HZ3 LYS 53 -11.555 6.194 16.074 455 H TYR 54 H TYR 54 -7.148 6.044 14.986 456 HA TYR 54 HA TYR 54 -4.243 5.397 14.992 457 1HB TYR 54 HB2 TYR 54 -6.205 4.234 12.992 458 2HB TYR 54 HB3 TYR 54 -4.477 3.898 13.100 459 HD1 TYR 54 HD1 TYR 54 -3.790 3.295 15.720 460 HD2 TYR 54 HD2 TYR 54 -7.552 2.522 13.795 461 HE1 TYR 54 HE1 TYR 54 -4.245 1.472 17.338 462 HE2 TYR 54 HE2 TYR 54 -8.007 0.700 15.414 463 HH TYR 54 HH TYR 54 -7.359 -0.094 17.514 464 H GLY 55 H GLY 55 -5.937 7.865 14.676 465 1HA GLY 55 HA2 GLY 55 -6.238 8.807 12.090 466 2HA GLY 55 HA3 GLY 55 -5.658 9.832 13.403 467 HA PRO 56 HA PRO 56 -1.783 10.063 11.315 468 1HB PRO 56 HB2 PRO 56 -0.285 10.986 13.403 469 2HB PRO 56 HB3 PRO 56 -1.477 11.986 12.556 470 1HG PRO 56 HG2 PRO 56 -1.654 10.716 15.243 471 2HG PRO 56 HG3 PRO 56 -2.419 12.196 14.644 472 1HD PRO 56 HD2 PRO 56 -3.673 9.684 14.923 473 2HD PRO 56 HD3 PRO 56 -4.308 11.071 14.013 474 H GLU 57 H GLU 57 -1.727 7.589 11.223 475 HA GLU 57 HA GLU 57 0.574 6.621 12.840 476 1HB GLU 57 HB2 GLU 57 -2.034 5.863 13.427 477 2HB GLU 57 HB3 GLU 57 -1.448 4.546 12.409 478 1HG GLU 57 HG2 GLU 57 -0.806 3.906 14.592 479 2HG GLU 57 HG3 GLU 57 0.664 4.595 13.902 480 H ALA 58 H ALA 58 -1.717 5.155 10.512 481 HA ALA 58 HA ALA 58 0.374 3.803 9.073 482 1HB ALA 58 HB1 ALA 58 -2.279 3.463 9.156 483 2HB ALA 58 HB2 ALA 58 -2.197 4.464 7.706 484 3HB ALA 58 HB3 ALA 58 -1.323 2.934 7.772 485 H SER 59 H SER 59 -1.329 6.873 8.569 486 HA SER 59 HA SER 59 -0.245 7.457 5.986 487 1HB SER 59 HB2 SER 59 -0.821 9.813 6.530 488 2HB SER 59 HB3 SER 59 -2.139 8.709 6.914 489 HG SER 59 HG SER 59 -1.984 9.423 8.874 490 H ALA 60 H ALA 60 0.902 8.275 9.266 491 HA ALA 60 HA ALA 60 3.226 9.714 8.324 492 1HB ALA 60 HB1 ALA 60 2.352 8.584 10.971 493 2HB ALA 60 HB2 ALA 60 3.998 9.186 10.771 494 3HB ALA 60 HB3 ALA 60 2.627 10.266 10.520 495 H PHE 61 H PHE 61 2.480 6.362 8.706 496 HA PHE 61 HA PHE 61 5.187 5.408 9.048 497 1HB PHE 61 HB2 PHE 61 3.303 3.980 9.639 498 2HB PHE 61 HB3 PHE 61 2.707 4.033 7.980 499 HD1 PHE 61 HD1 PHE 61 4.102 3.032 6.129 500 HD2 PHE 61 HD2 PHE 61 5.038 2.479 10.284 501 HE1 PHE 61 HE1 PHE 61 5.558 1.110 5.545 502 HE2 PHE 61 HE2 PHE 61 6.492 0.558 9.701 503 HZ PHE 61 HZ PHE 61 6.753 -0.127 7.331 504 H THR 62 H THR 62 3.035 5.253 6.205 505 HA THR 62 HA THR 62 5.201 4.622 4.402 506 HB THR 62 HB THR 62 2.400 5.656 3.880 507 HG1 THR 62 HG1 THR 62 3.546 3.078 3.616 508 1HG2 THR 62 HG21 THR 62 4.691 5.137 2.100 509 2HG2 THR 62 HG22 THR 62 3.191 4.349 1.612 510 3HG2 THR 62 HG23 THR 62 3.241 6.100 1.818 511 H LYS 63 H LYS 63 3.843 7.600 5.614 512 HA LYS 63 HA LYS 63 4.867 9.310 3.522 513 1HB LYS 63 HB2 LYS 63 3.044 9.934 5.156 514 2HB LYS 63 HB3 LYS 63 4.293 10.074 6.395 515 1HG LYS 63 HG2 LYS 63 5.207 11.975 5.459 516 2HG LYS 63 HG3 LYS 63 4.734 11.523 3.821 517 1HD LYS 63 HD2 LYS 63 2.476 12.188 4.175 518 2HD LYS 63 HD3 LYS 63 2.697 12.277 5.923 519 1HE LYS 63 HE2 LYS 63 4.579 14.043 5.198 520 2HE LYS 63 HE3 LYS 63 3.506 14.218 3.808 521 1HZ LYS 63 HZ1 LYS 63 2.648 14.411 6.644 522 2HZ LYS 63 HZ2 LYS 63 2.956 15.741 5.632 523 3HZ LYS 63 HZ3 LYS 63 1.679 14.677 5.277 524 H LYS 64 H LYS 64 5.950 9.083 6.917 525 HA LYS 64 HA LYS 64 8.488 10.309 6.405 526 1HB LYS 64 HB2 LYS 64 7.077 9.319 8.657 527 2HB LYS 64 HB3 LYS 64 8.637 8.496 8.639 528 1HG LYS 64 HG2 LYS 64 9.703 10.366 9.294 529 2HG LYS 64 HG3 LYS 64 8.972 11.296 7.986 530 1HD LYS 64 HD2 LYS 64 8.220 12.327 10.003 531 2HD LYS 64 HD3 LYS 64 6.854 11.377 9.417 532 1HE LYS 64 HE2 LYS 64 8.676 9.857 11.148 533 2HE LYS 64 HE3 LYS 64 7.909 11.221 11.960 534 1HZ LYS 64 HZ1 LYS 64 5.935 10.036 10.447 535 2HZ LYS 64 HZ2 LYS 64 6.775 8.748 11.163 536 3HZ LYS 64 HZ3 LYS 64 6.108 9.972 12.136 537 H MET 65 H MET 65 7.332 7.071 5.959 538 HA MET 65 HA MET 65 9.904 5.753 6.043 539 1HB MET 65 HB2 MET 65 7.941 4.397 6.322 540 2HB MET 65 HB3 MET 65 7.250 4.983 4.810 541 1HG MET 65 HG2 MET 65 8.447 3.516 3.567 542 2HG MET 65 HG3 MET 65 9.925 3.821 4.481 543 1HE MET 65 HE1 MET 65 10.881 2.480 6.182 544 2HE MET 65 HE2 MET 65 9.690 3.144 7.298 545 3HE MET 65 HE3 MET 65 10.023 1.414 7.303 546 H VAL 66 H VAL 66 7.815 6.662 3.291 547 HA VAL 66 HA VAL 66 9.848 6.092 1.326 548 HB VAL 66 HB VAL 66 8.352 7.216 -0.254 549 1HG1 VAL 66 HG11 VAL 66 6.931 5.549 1.842 550 2HG1 VAL 66 HG12 VAL 66 6.249 5.938 0.264 551 3HG1 VAL 66 HG13 VAL 66 7.714 4.963 0.375 552 1HG2 VAL 66 HG21 VAL 66 7.309 8.397 2.279 553 2HG2 VAL 66 HG22 VAL 66 7.487 9.134 0.686 554 3HG2 VAL 66 HG23 VAL 66 6.131 8.054 1.012 555 H GLU 67 H GLU 67 9.083 8.885 3.278 556 HA GLU 67 HA GLU 67 10.478 10.832 1.682 557 1HB GLU 67 HB2 GLU 67 9.609 10.715 4.565 558 2HB GLU 67 HB3 GLU 67 10.571 12.064 3.961 559 1HG GLU 67 HG2 GLU 67 8.642 11.833 2.015 560 2HG GLU 67 HG3 GLU 67 7.741 11.414 3.473 561 H ASN 68 H ASN 68 11.463 8.695 4.327 562 HA ASN 68 HA ASN 68 14.221 9.769 4.188 563 1HB ASN 68 HB2 ASN 68 12.759 7.915 6.051 564 2HB ASN 68 HB3 ASN 68 14.523 7.918 6.020 565 1HD2 ASN 68 HD21 ASN 68 11.766 9.556 7.268 566 2HD2 ASN 68 HD22 ASN 68 12.576 10.911 7.893 567 H ALA 69 H ALA 69 12.352 7.296 2.791 568 HA ALA 69 HA ALA 69 14.285 5.204 2.550 569 1HB ALA 69 HB1 ALA 69 11.664 5.651 1.674 570 2HB ALA 69 HB2 ALA 69 12.602 5.482 0.190 571 3HB ALA 69 HB3 ALA 69 12.623 4.198 1.398 572 H LYS 70 H LYS 70 16.026 4.975 1.184 573 HA LYS 70 HA LYS 70 16.795 7.332 -0.414 574 1HB LYS 70 HB2 LYS 70 18.378 4.777 -0.274 575 2HB LYS 70 HB3 LYS 70 18.960 6.434 -0.443 576 1HG LYS 70 HG2 LYS 70 17.693 6.625 1.946 577 2HG LYS 70 HG3 LYS 70 18.204 4.937 2.003 578 1HD LYS 70 HD2 LYS 70 20.028 6.142 2.926 579 2HD LYS 70 HD3 LYS 70 20.517 5.796 1.266 580 1HE LYS 70 HE2 LYS 70 19.979 8.011 0.545 581 2HE LYS 70 HE3 LYS 70 19.132 8.368 2.051 582 1HZ LYS 70 HZ1 LYS 70 21.938 7.564 2.216 583 2HZ LYS 70 HZ2 LYS 70 21.599 9.130 1.649 584 3HZ LYS 70 HZ3 LYS 70 21.062 8.650 3.185 585 H LYS 71 H LYS 71 15.262 4.304 -0.907 586 HA LYS 71 HA LYS 71 15.528 4.699 -3.851 587 1HB LYS 71 HB2 LYS 71 15.731 2.046 -2.393 588 2HB LYS 71 HB3 LYS 71 15.707 2.249 -4.146 589 1HG LYS 71 HG2 LYS 71 17.691 4.007 -3.064 590 2HG LYS 71 HG3 LYS 71 17.956 2.394 -2.400 591 1HD LYS 71 HD2 LYS 71 18.568 1.535 -4.414 592 2HD LYS 71 HD3 LYS 71 17.314 2.425 -5.277 593 1HE LYS 71 HE2 LYS 71 19.678 3.122 -5.853 594 2HE LYS 71 HE3 LYS 71 18.641 4.434 -5.291 595 1HZ LYS 71 HZ1 LYS 71 20.357 2.906 -3.432 596 2HZ LYS 71 HZ2 LYS 71 20.945 4.254 -4.276 597 3HZ LYS 71 HZ3 LYS 71 19.641 4.429 -3.201 598 H ILE 72 H ILE 72 13.535 4.875 -4.728 599 HA ILE 72 HA ILE 72 11.288 3.380 -3.441 600 HB ILE 72 HB ILE 72 11.157 6.175 -4.616 601 1HG1 ILE 72 HG12 ILE 72 10.530 5.648 -1.761 602 2HG1 ILE 72 HG13 ILE 72 12.233 5.525 -2.205 603 1HG2 ILE 72 HG21 ILE 72 9.139 4.229 -3.548 604 2HG2 ILE 72 HG22 ILE 72 8.875 5.954 -3.295 605 3HG2 ILE 72 HG23 ILE 72 9.018 5.315 -4.932 606 1HD1 ILE 72 HD11 ILE 72 11.473 7.816 -3.522 607 2HD1 ILE 72 HD12 ILE 72 10.501 7.903 -2.053 608 3HD1 ILE 72 HD13 ILE 72 12.257 7.782 -1.942 609 H GLU 73 H GLU 73 10.970 1.781 -4.960 610 HA GLU 73 HA GLU 73 10.603 2.689 -7.789 611 1HB GLU 73 HB2 GLU 73 11.810 0.103 -6.767 612 2HB GLU 73 HB3 GLU 73 11.406 0.406 -8.456 613 1HG GLU 73 HG2 GLU 73 13.257 1.661 -8.770 614 2HG GLU 73 HG3 GLU 73 12.968 2.582 -7.294 615 H VAL 74 H VAL 74 8.756 1.959 -8.814 616 HA VAL 74 HA VAL 74 6.798 0.523 -7.114 617 HB VAL 74 HB VAL 74 5.177 1.179 -8.887 618 1HG1 VAL 74 HG11 VAL 74 5.719 2.688 -6.958 619 2HG1 VAL 74 HG12 VAL 74 6.914 3.492 -7.975 620 3HG1 VAL 74 HG13 VAL 74 5.204 3.563 -8.400 621 1HG2 VAL 74 HG21 VAL 74 7.313 1.252 -10.549 622 2HG2 VAL 74 HG22 VAL 74 5.815 2.126 -10.878 623 3HG2 VAL 74 HG23 VAL 74 7.187 2.966 -10.155 624 H GLU 75 H GLU 75 5.636 -1.338 -7.992 625 HA GLU 75 HA GLU 75 7.138 -2.744 -10.165 626 1HB GLU 75 HB2 GLU 75 7.593 -3.702 -7.895 627 2HB GLU 75 HB3 GLU 75 5.868 -4.035 -7.732 628 1HG GLU 75 HG2 GLU 75 5.898 -5.711 -9.332 629 2HG GLU 75 HG3 GLU 75 7.279 -5.019 -10.182 630 H PHE 76 H PHE 76 5.466 -1.875 -11.611 631 HA PHE 76 HA PHE 76 2.689 -2.194 -11.327 632 1HB PHE 76 HB2 PHE 76 4.436 -2.339 -13.796 633 2HB PHE 76 HB3 PHE 76 2.674 -2.328 -13.864 634 HD1 PHE 76 HD1 PHE 76 1.402 -0.366 -12.949 635 HD2 PHE 76 HD2 PHE 76 5.678 -0.345 -13.345 636 HE1 PHE 76 HE1 PHE 76 1.410 2.105 -12.734 637 HE2 PHE 76 HE2 PHE 76 5.687 2.125 -13.131 638 HZ PHE 76 HZ PHE 76 3.553 3.350 -12.826 639 H ASP 77 H ASP 77 1.276 -3.914 -11.624 640 HA ASP 77 HA ASP 77 2.429 -6.596 -11.514 641 1HB ASP 77 HB2 ASP 77 0.096 -5.487 -10.579 642 2HB ASP 77 HB3 ASP 77 -0.470 -6.364 -12.001 643 H LYS 78 H LYS 78 0.519 -8.033 -13.041 644 HA LYS 78 HA LYS 78 1.519 -7.404 -15.768 645 1HB LYS 78 HB2 LYS 78 0.825 -9.697 -16.326 646 2HB LYS 78 HB3 LYS 78 1.869 -9.698 -14.904 647 1HG LYS 78 HG2 LYS 78 -0.924 -9.350 -14.168 648 2HG LYS 78 HG3 LYS 78 -0.679 -10.837 -15.085 649 1HD LYS 78 HD2 LYS 78 1.212 -10.129 -12.857 650 2HD LYS 78 HD3 LYS 78 -0.343 -10.873 -12.484 651 1HE LYS 78 HE2 LYS 78 0.411 -12.524 -14.451 652 2HE LYS 78 HE3 LYS 78 2.013 -12.019 -13.913 653 1HZ LYS 78 HZ1 LYS 78 0.691 -12.493 -11.595 654 2HZ LYS 78 HZ2 LYS 78 0.099 -13.715 -12.611 655 3HZ LYS 78 HZ3 LYS 78 1.771 -13.566 -12.351 656 H GLY 79 H GLY 79 -1.271 -7.053 -13.862 657 1HA GLY 79 HA2 GLY 79 -3.219 -7.335 -16.019 658 2HA GLY 79 HA3 GLY 79 -3.540 -6.675 -14.415 659 H GLN 80 H GLN 80 -4.346 -4.649 -14.718 660 HA GLN 80 HA GLN 80 -3.355 -2.972 -16.929 661 1HB GLN 80 HB2 GLN 80 -5.410 -2.399 -14.768 662 2HB GLN 80 HB3 GLN 80 -5.081 -1.375 -16.167 663 1HG GLN 80 HG2 GLN 80 -6.666 -2.575 -17.243 664 2HG GLN 80 HG3 GLN 80 -5.485 -3.884 -17.289 665 1HE2 GLN 80 HE21 GLN 80 -7.763 -2.489 -14.845 666 2HE2 GLN 80 HE22 GLN 80 -8.311 -3.997 -14.290 667 H ARG 81 H ARG 81 -2.781 -0.629 -16.362 668 HA ARG 81 HA ARG 81 -0.961 -0.661 -13.996 669 1HB ARG 81 HB2 ARG 81 -0.940 1.276 -16.327 670 2HB ARG 81 HB3 ARG 81 0.323 1.042 -15.119 671 1HG ARG 81 HG2 ARG 81 1.189 -0.732 -16.221 672 2HG ARG 81 HG3 ARG 81 -0.404 -1.447 -16.475 673 1HD ARG 81 HD2 ARG 81 -0.652 0.542 -18.214 674 2HD ARG 81 HD3 ARG 81 1.111 0.471 -18.205 675 HE ARG 81 HE ARG 81 0.011 -2.169 -18.534 676 1HH1 ARG 81 HH11 ARG 81 2.036 -0.111 -20.025 677 2HH1 ARG 81 HH12 ARG 81 1.486 -0.381 -21.644 678 1HH2 ARG 81 HH21 ARG 81 -1.350 -2.123 -20.675 679 2HH2 ARG 81 HH22 ARG 81 -0.430 -1.519 -22.012 680 H THR 82 H THR 82 -3.979 0.427 -14.860 681 HA THR 82 HA THR 82 -3.899 2.482 -12.726 682 HB THR 82 HB THR 82 -5.545 3.696 -14.550 683 HG1 THR 82 HG1 THR 82 -5.059 2.793 -16.385 684 1HG2 THR 82 HG21 THR 82 -2.609 4.028 -13.941 685 2HG2 THR 82 HG22 THR 82 -3.471 5.151 -14.992 686 3HG2 THR 82 HG23 THR 82 -3.969 4.958 -13.311 687 H ASP 83 H ASP 83 -6.117 3.024 -11.973 688 HA ASP 83 HA ASP 83 -7.949 0.708 -12.411 689 1HB ASP 83 HB2 ASP 83 -7.001 1.614 -10.055 690 2HB ASP 83 HB3 ASP 83 -8.442 2.618 -10.188 691 H LYS 84 H LYS 84 -10.284 1.862 -11.436 692 HA LYS 84 HA LYS 84 -11.147 3.379 -13.765 693 1HB LYS 84 HB2 LYS 84 -13.347 3.340 -12.733 694 2HB LYS 84 HB3 LYS 84 -12.612 1.747 -12.549 695 1HG LYS 84 HG2 LYS 84 -11.944 2.281 -10.259 696 2HG LYS 84 HG3 LYS 84 -12.572 3.920 -10.433 697 1HD LYS 84 HD2 LYS 84 -14.663 3.240 -9.949 698 2HD LYS 84 HD3 LYS 84 -14.588 1.975 -11.177 699 1HE LYS 84 HE2 LYS 84 -13.426 0.489 -9.615 700 2HE LYS 84 HE3 LYS 84 -13.410 1.758 -8.390 701 1HZ LYS 84 HZ1 LYS 84 -15.889 0.669 -9.600 702 2HZ LYS 84 HZ2 LYS 84 -15.231 0.108 -8.141 703 3HZ LYS 84 HZ3 LYS 84 -15.767 1.715 -8.267 704 H TYR 85 H TYR 85 -9.881 4.175 -10.661 705 HA TYR 85 HA TYR 85 -11.051 6.866 -10.610 706 1HB TYR 85 HB2 TYR 85 -9.075 5.379 -8.887 707 2HB TYR 85 HB3 TYR 85 -9.318 7.115 -8.691 708 HD1 TYR 85 HD1 TYR 85 -11.139 3.854 -8.793 709 HD2 TYR 85 HD2 TYR 85 -11.175 7.946 -7.490 710 HE1 TYR 85 HE1 TYR 85 -13.200 3.419 -7.485 711 HE2 TYR 85 HE2 TYR 85 -13.235 7.511 -6.180 712 HH TYR 85 HH TYR 85 -14.693 5.983 -5.504 713 H GLY 86 H GLY 86 -8.606 5.436 -12.369 714 1HA GLY 86 HA2 GLY 86 -7.129 6.510 -13.884 715 2HA GLY 86 HA3 GLY 86 -7.540 8.055 -13.140 716 H ARG 87 H ARG 87 -6.709 5.655 -10.864 717 HA ARG 87 HA ARG 87 -4.128 7.041 -10.389 718 1HB ARG 87 HB2 ARG 87 -5.369 4.896 -8.658 719 2HB ARG 87 HB3 ARG 87 -4.194 6.126 -8.193 720 1HG ARG 87 HG2 ARG 87 -5.782 7.808 -8.096 721 2HG ARG 87 HG3 ARG 87 -6.828 7.033 -9.285 722 1HD ARG 87 HD2 ARG 87 -6.456 6.280 -6.380 723 2HD ARG 87 HD3 ARG 87 -7.940 6.792 -7.183 724 HE ARG 87 HE ARG 87 -7.411 4.551 -8.576 725 1HH1 ARG 87 HH11 ARG 87 -5.678 4.279 -5.877 726 2HH1 ARG 87 HH12 ARG 87 -6.643 3.079 -5.086 727 1HH2 ARG 87 HH21 ARG 87 -9.312 3.401 -7.276 728 2HH2 ARG 87 HH22 ARG 87 -8.699 2.578 -5.880 729 H GLY 88 H GLY 88 -2.174 5.751 -10.020 730 1HA GLY 88 HA2 GLY 88 -2.065 3.432 -11.846 731 2HA GLY 88 HA3 GLY 88 -0.675 4.249 -11.128 732 H LEU 89 H LEU 89 -1.558 1.331 -11.170 733 HA LEU 89 HA LEU 89 -1.545 0.910 -8.207 734 1HB LEU 89 HB2 LEU 89 -2.480 -1.099 -10.266 735 2HB LEU 89 HB3 LEU 89 -2.762 -1.118 -8.525 736 HG LEU 89 HG LEU 89 -3.763 1.138 -10.262 737 1HD1 LEU 89 HD11 LEU 89 -4.807 -1.625 -9.946 738 2HD1 LEU 89 HD12 LEU 89 -5.991 -0.328 -9.783 739 3HD1 LEU 89 HD13 LEU 89 -5.043 -0.475 -11.264 740 1HD2 LEU 89 HD21 LEU 89 -4.533 0.026 -7.544 741 2HD2 LEU 89 HD22 LEU 89 -3.708 1.553 -7.856 742 3HD2 LEU 89 HD23 LEU 89 -5.383 1.337 -8.362 743 H ALA 90 H ALA 90 0.298 -0.007 -7.435 744 HA ALA 90 HA ALA 90 1.723 -2.085 -8.852 745 1HB ALA 90 HB1 ALA 90 2.485 0.696 -9.328 746 2HB ALA 90 HB2 ALA 90 3.818 -0.261 -8.681 747 3HB ALA 90 HB3 ALA 90 3.008 -0.766 -10.164 748 H TYR 91 H TYR 91 3.440 -2.963 -7.538 749 HA TYR 91 HA TYR 91 3.063 -2.452 -4.685 750 1HB TYR 91 HB2 TYR 91 5.176 -4.209 -5.955 751 2HB TYR 91 HB3 TYR 91 4.484 -4.345 -4.338 752 HD1 TYR 91 HD1 TYR 91 2.143 -5.109 -4.027 753 HD2 TYR 91 HD2 TYR 91 4.018 -5.064 -7.891 754 HE1 TYR 91 HE1 TYR 91 0.362 -6.594 -4.908 755 HE2 TYR 91 HE2 TYR 91 2.238 -6.549 -8.772 756 HH TYR 91 HH TYR 91 -0.075 -8.085 -6.680 757 H ILE 92 H ILE 92 4.053 -0.712 -3.778 758 HA ILE 92 HA ILE 92 6.414 0.507 -4.966 759 HB ILE 92 HB ILE 92 5.250 1.029 -2.219 760 1HG1 ILE 92 HG12 ILE 92 4.444 2.084 -4.944 761 2HG1 ILE 92 HG13 ILE 92 3.425 1.232 -3.783 762 1HG2 ILE 92 HG21 ILE 92 7.548 1.961 -3.091 763 2HG2 ILE 92 HG22 ILE 92 6.532 3.036 -4.052 764 3HG2 ILE 92 HG23 ILE 92 6.417 3.053 -2.292 765 1HD1 ILE 92 HD11 ILE 92 3.935 3.155 -2.161 766 2HD1 ILE 92 HD12 ILE 92 4.565 4.022 -3.562 767 3HD1 ILE 92 HD13 ILE 92 2.872 3.532 -3.518 768 H TYR 93 H TYR 93 8.527 0.556 -4.048 769 HA TYR 93 HA TYR 93 9.030 -1.439 -1.883 770 1HB TYR 93 HB2 TYR 93 10.351 -1.197 -4.577 771 2HB TYR 93 HB3 TYR 93 11.244 -1.856 -3.206 772 HD1 TYR 93 HD1 TYR 93 8.310 -2.327 -5.411 773 HD2 TYR 93 HD2 TYR 93 10.686 -4.007 -2.250 774 HE1 TYR 93 HE1 TYR 93 7.178 -4.511 -5.720 775 HE2 TYR 93 HE2 TYR 93 9.553 -6.192 -2.560 776 HH TYR 93 HH TYR 93 8.044 -7.133 -5.102 777 H ALA 94 H ALA 94 10.042 -0.439 -0.224 778 HA ALA 94 HA ALA 94 11.806 1.893 -0.860 779 1HB ALA 94 HB1 ALA 94 9.615 2.446 0.314 780 2HB ALA 94 HB2 ALA 94 10.225 1.536 1.696 781 3HB ALA 94 HB3 ALA 94 11.074 2.981 1.148 782 H ASP 95 H ASP 95 13.845 1.805 0.017 783 HA ASP 95 HA ASP 95 15.679 0.997 1.233 784 1HB ASP 95 HB2 ASP 95 13.584 -0.372 2.950 785 2HB ASP 95 HB3 ASP 95 15.272 -0.099 3.376 786 H GLY 96 H GLY 96 13.929 -0.660 -0.820 787 1HA GLY 96 HA2 GLY 96 14.659 -2.584 -2.038 788 2HA GLY 96 HA3 GLY 96 15.704 -3.014 -0.685 789 H LYS 97 H LYS 97 12.766 -2.255 0.634 790 HA LYS 97 HA LYS 97 11.918 -5.122 0.560 791 1HB LYS 97 HB2 LYS 97 12.663 -3.701 2.766 792 2HB LYS 97 HB3 LYS 97 10.924 -3.408 2.756 793 1HG LYS 97 HG2 LYS 97 10.403 -5.645 3.062 794 2HG LYS 97 HG3 LYS 97 11.896 -6.203 2.305 795 1HD LYS 97 HD2 LYS 97 12.330 -6.635 4.557 796 2HD LYS 97 HD3 LYS 97 13.042 -5.033 4.362 797 1HE LYS 97 HE2 LYS 97 11.748 -4.692 6.261 798 2HE LYS 97 HE3 LYS 97 10.605 -4.224 5.003 799 1HZ LYS 97 HZ1 LYS 97 9.784 -6.546 5.033 800 2HZ LYS 97 HZ2 LYS 97 10.777 -6.847 6.378 801 3HZ LYS 97 HZ3 LYS 97 9.516 -5.713 6.486 802 H MET 98 H MET 98 9.557 -5.471 0.731 803 HA MET 98 HA MET 98 8.105 -3.696 -1.050 804 1HB MET 98 HB2 MET 98 7.720 -6.151 -0.982 805 2HB MET 98 HB3 MET 98 7.076 -5.987 0.652 806 1HG MET 98 HG2 MET 98 5.062 -5.655 -0.314 807 2HG MET 98 HG3 MET 98 5.671 -4.073 -0.801 808 1HE MET 98 HE1 MET 98 6.048 -7.714 -1.438 809 2HE MET 98 HE2 MET 98 4.453 -7.615 -2.197 810 3HE MET 98 HE3 MET 98 5.877 -7.970 -3.173 811 H VAL 99 H VAL 99 7.121 -1.846 -0.412 812 HA VAL 99 HA VAL 99 6.875 -1.074 2.340 813 HB VAL 99 HB VAL 99 5.263 0.077 0.054 814 1HG1 VAL 99 HG11 VAL 99 4.959 0.776 2.519 815 2HG1 VAL 99 HG12 VAL 99 6.564 1.491 2.384 816 3HG1 VAL 99 HG13 VAL 99 5.255 2.064 1.351 817 1HG2 VAL 99 HG21 VAL 99 8.123 -0.149 0.275 818 2HG2 VAL 99 HG22 VAL 99 7.179 0.656 -0.980 819 3HG2 VAL 99 HG23 VAL 99 7.665 1.544 0.465 820 H ASN 100 H ASN 100 4.534 -2.376 -0.005 821 HA ASN 100 HA ASN 100 2.191 -2.147 1.550 822 1HB ASN 100 HB2 ASN 100 2.916 -4.487 -0.238 823 2HB ASN 100 HB3 ASN 100 1.292 -3.957 0.201 824 1HD2 ASN 100 HD21 ASN 100 1.145 -3.813 -2.310 825 2HD2 ASN 100 HD22 ASN 100 1.623 -2.348 -3.020 826 H GLU 101 H GLU 101 4.586 -4.800 1.496 827 HA GLU 101 HA GLU 101 3.274 -6.370 3.509 828 1HB GLU 101 HB2 GLU 101 5.211 -6.997 1.857 829 2HB GLU 101 HB3 GLU 101 6.257 -6.390 3.141 830 1HG GLU 101 HG2 GLU 101 4.882 -7.915 4.714 831 2HG GLU 101 HG3 GLU 101 4.322 -8.702 3.237 832 H ALA 102 H ALA 102 5.513 -3.668 3.648 833 HA ALA 102 HA ALA 102 6.298 -3.962 6.386 834 1HB ALA 102 HB1 ALA 102 7.385 -2.424 4.717 835 2HB ALA 102 HB2 ALA 102 5.976 -1.370 4.850 836 3HB ALA 102 HB3 ALA 102 7.005 -1.647 6.255 837 H LEU 103 H LEU 103 3.660 -2.123 4.872 838 HA LEU 103 HA LEU 103 2.600 -0.995 7.255 839 1HB LEU 103 HB2 LEU 103 1.254 -1.794 4.661 840 2HB LEU 103 HB3 LEU 103 0.439 -0.896 5.942 841 HG LEU 103 HG LEU 103 3.085 0.123 5.005 842 1HD1 LEU 103 HD11 LEU 103 1.029 -0.432 3.163 843 2HD1 LEU 103 HD12 LEU 103 0.917 1.297 3.485 844 3HD1 LEU 103 HD13 LEU 103 2.431 0.605 2.905 845 1HD2 LEU 103 HD21 LEU 103 1.757 1.140 6.879 846 2HD2 LEU 103 HD22 LEU 103 2.057 2.260 5.549 847 3HD2 LEU 103 HD23 LEU 103 0.476 1.497 5.720 848 H VAL 104 H VAL 104 1.706 -4.023 5.566 849 HA VAL 104 HA VAL 104 -0.252 -4.861 7.458 850 HB VAL 104 HB VAL 104 1.552 -6.415 5.588 851 1HG1 VAL 104 HG11 VAL 104 -0.709 -7.411 7.350 852 2HG1 VAL 104 HG12 VAL 104 0.028 -8.343 6.047 853 3HG1 VAL 104 HG13 VAL 104 0.987 -7.884 7.454 854 1HG2 VAL 104 HG21 VAL 104 -0.805 -4.889 5.245 855 2HG2 VAL 104 HG22 VAL 104 -0.046 -5.957 4.063 856 3HG2 VAL 104 HG23 VAL 104 -1.300 -6.578 5.137 857 H ARG 105 H ARG 105 3.237 -4.924 7.542 858 HA ARG 105 HA ARG 105 3.531 -6.907 9.609 859 1HB ARG 105 HB2 ARG 105 5.384 -6.073 8.119 860 2HB ARG 105 HB3 ARG 105 5.362 -4.561 9.028 861 1HG ARG 105 HG2 ARG 105 6.757 -5.514 10.517 862 2HG ARG 105 HG3 ARG 105 5.445 -6.604 10.967 863 1HD ARG 105 HD2 ARG 105 6.595 -8.332 10.103 864 2HD ARG 105 HD3 ARG 105 6.541 -7.561 8.519 865 HE ARG 105 HE ARG 105 8.620 -6.395 10.144 866 1HH1 ARG 105 HH11 ARG 105 7.719 -9.025 8.100 867 2HH1 ARG 105 HH12 ARG 105 9.352 -9.502 7.775 868 1HH2 ARG 105 HH21 ARG 105 10.755 -7.069 9.806 869 2HH2 ARG 105 HH22 ARG 105 11.068 -8.397 8.740 870 H GLN 106 H GLN 106 3.213 -3.363 9.661 871 HA GLN 106 HA GLN 106 3.279 -3.343 12.608 872 1HB GLN 106 HB2 GLN 106 4.207 -1.513 10.995 873 2HB GLN 106 HB3 GLN 106 2.526 -0.992 10.881 874 1HG GLN 106 HG2 GLN 106 2.600 -0.038 12.922 875 2HG GLN 106 HG3 GLN 106 3.287 -1.495 13.643 876 1HE2 GLN 106 HE21 GLN 106 4.720 0.033 14.901 877 2HE2 GLN 106 HE22 GLN 106 6.105 0.664 14.151 878 H GLY 107 H GLY 107 1.055 -4.542 10.747 879 1HA GLY 107 HA2 GLY 107 -1.294 -4.663 10.763 880 2HA GLY 107 HA3 GLY 107 -1.124 -4.303 12.482 881 H LEU 108 H LEU 108 -0.548 -2.364 9.526 882 HA LEU 108 HA LEU 108 -2.293 -0.259 10.740 883 1HB LEU 108 HB2 LEU 108 0.047 0.001 8.827 884 2HB LEU 108 HB3 LEU 108 -0.982 1.342 9.332 885 HG LEU 108 HG LEU 108 0.778 -0.372 11.103 886 1HD1 LEU 108 HD11 LEU 108 1.162 2.093 9.710 887 2HD1 LEU 108 HD12 LEU 108 1.090 2.451 11.435 888 3HD1 LEU 108 HD13 LEU 108 2.269 1.290 10.824 889 1HD2 LEU 108 HD21 LEU 108 -1.495 1.489 11.708 890 2HD2 LEU 108 HD22 LEU 108 -1.048 -0.021 12.502 891 3HD2 LEU 108 HD23 LEU 108 -0.118 1.446 12.808 892 H ALA 109 H ALA 109 -1.990 -2.479 8.189 893 HA ALA 109 HA ALA 109 -4.299 -1.213 6.820 894 1HB ALA 109 HB1 ALA 109 -1.791 -2.153 5.395 895 2HB ALA 109 HB2 ALA 109 -3.265 -1.591 4.608 896 3HB ALA 109 HB3 ALA 109 -2.301 -0.474 5.575 897 H LYS 110 H LYS 110 -5.381 -2.805 5.338 898 HA LYS 110 HA LYS 110 -4.846 -5.615 6.220 899 1HB LYS 110 HB2 LYS 110 -7.246 -6.035 6.160 900 2HB LYS 110 HB3 LYS 110 -6.933 -4.650 7.208 901 1HG LYS 110 HG2 LYS 110 -8.052 -3.229 5.848 902 2HG LYS 110 HG3 LYS 110 -7.310 -3.906 4.397 903 1HD LYS 110 HD2 LYS 110 -8.956 -5.526 4.143 904 2HD LYS 110 HD3 LYS 110 -9.368 -5.525 5.858 905 1HE LYS 110 HE2 LYS 110 -11.036 -4.408 4.216 906 2HE LYS 110 HE3 LYS 110 -10.607 -3.524 5.682 907 1HZ LYS 110 HZ1 LYS 110 -9.171 -3.166 3.117 908 2HZ LYS 110 HZ2 LYS 110 -10.516 -2.225 3.553 909 3HZ LYS 110 HZ3 LYS 110 -9.108 -2.176 4.496 910 H VAL 111 H VAL 111 -5.378 -7.260 4.611 911 HA VAL 111 HA VAL 111 -4.797 -6.329 1.887 912 HB VAL 111 HB VAL 111 -5.293 -9.119 2.970 913 1HG1 VAL 111 HG11 VAL 111 -5.288 -8.180 0.315 914 2HG1 VAL 111 HG12 VAL 111 -3.707 -8.924 0.554 915 3HG1 VAL 111 HG13 VAL 111 -5.174 -9.859 0.845 916 1HG2 VAL 111 HG21 VAL 111 -3.240 -7.681 3.733 917 2HG2 VAL 111 HG22 VAL 111 -2.965 -9.334 3.185 918 3HG2 VAL 111 HG23 VAL 111 -2.644 -7.980 2.101 919 H ALA 112 H ALA 112 -6.248 -6.335 0.175 920 HA ALA 112 HA ALA 112 -8.826 -7.668 0.330 921 1HB ALA 112 HB1 ALA 112 -8.591 -4.966 1.349 922 2HB ALA 112 HB2 ALA 112 -9.656 -5.002 -0.057 923 3HB ALA 112 HB3 ALA 112 -10.001 -6.027 1.336 924 H TYR 113 H TYR 113 -10.257 -6.547 -1.590 925 HA TYR 113 HA TYR 113 -10.370 -6.431 -3.938 926 1HB TYR 113 HB2 TYR 113 -8.010 -4.622 -3.346 927 2HB TYR 113 HB3 TYR 113 -8.802 -4.724 -4.919 928 HD1 TYR 113 HD1 TYR 113 -11.557 -4.730 -4.592 929 HD2 TYR 113 HD2 TYR 113 -8.665 -2.790 -2.077 930 HE1 TYR 113 HE1 TYR 113 -13.295 -3.136 -3.821 931 HE2 TYR 113 HE2 TYR 113 -10.403 -1.196 -1.307 932 HH TYR 113 HH TYR 113 -13.788 -1.579 -2.240 933 H VAL 114 H VAL 114 -9.747 -8.708 -4.174 934 HA VAL 114 HA VAL 114 -6.924 -9.047 -5.106 935 HB VAL 114 HB VAL 114 -8.852 -11.133 -4.039 936 1HG1 VAL 114 HG11 VAL 114 -5.998 -11.266 -5.040 937 2HG1 VAL 114 HG12 VAL 114 -6.713 -12.524 -4.033 938 3HG1 VAL 114 HG13 VAL 114 -7.390 -12.178 -5.624 939 1HG2 VAL 114 HG21 VAL 114 -7.960 -9.539 -2.333 940 2HG2 VAL 114 HG22 VAL 114 -7.379 -11.186 -2.091 941 3HG2 VAL 114 HG23 VAL 114 -6.323 -9.977 -2.822 942 H TYR 115 H TYR 115 -7.463 -8.347 -7.264 943 HA TYR 115 HA TYR 115 -9.293 -10.198 -8.735 944 1HB TYR 115 HB2 TYR 115 -8.307 -7.461 -9.593 945 2HB TYR 115 HB3 TYR 115 -9.535 -8.438 -10.397 946 HD1 TYR 115 HD1 TYR 115 -11.703 -8.936 -9.205 947 HD2 TYR 115 HD2 TYR 115 -8.845 -6.099 -7.712 948 HE1 TYR 115 HE1 TYR 115 -13.446 -7.949 -7.744 949 HE2 TYR 115 HE2 TYR 115 -10.589 -5.112 -6.250 950 HH TYR 115 HH TYR 115 -13.142 -4.976 -6.270 951 H LYS 116 H LYS 116 -8.268 -11.681 -9.978 952 HA LYS 116 HA LYS 116 -5.400 -11.384 -10.560 953 1HB LYS 116 HB2 LYS 116 -5.521 -13.659 -11.360 954 2HB LYS 116 HB3 LYS 116 -6.484 -13.573 -9.884 955 1HG LYS 116 HG2 LYS 116 -8.514 -13.184 -11.340 956 2HG LYS 116 HG3 LYS 116 -7.499 -13.551 -12.736 957 1HD LYS 116 HD2 LYS 116 -7.704 -15.760 -12.366 958 2HD LYS 116 HD3 LYS 116 -7.130 -15.570 -10.708 959 1HE LYS 116 HE2 LYS 116 -9.812 -14.538 -10.918 960 2HE LYS 116 HE3 LYS 116 -9.762 -16.183 -11.556 961 1HZ LYS 116 HZ1 LYS 116 -8.222 -15.917 -9.172 962 2HZ LYS 116 HZ2 LYS 116 -9.836 -15.463 -8.917 963 3HZ LYS 116 HZ3 LYS 116 -9.475 -17.006 -9.531 964 HA PRO 117 HA PRO 117 -4.158 -12.565 -12.002 965 1HB PRO 117 HB2 PRO 117 -2.235 -11.664 -13.717 966 2HB PRO 117 HB3 PRO 117 -3.332 -12.998 -14.112 967 1HG PRO 117 HG2 PRO 117 -3.354 -10.187 -15.094 968 2HG PRO 117 HG3 PRO 117 -3.910 -11.664 -15.896 969 1HD PRO 117 HD2 PRO 117 -5.554 -9.754 -14.626 970 2HD PRO 117 HD3 PRO 117 -6.044 -11.388 -15.124 971 H ASN 118 H ASN 118 -5.138 -9.612 -11.483 972 HA ASN 118 HA ASN 118 -2.590 -8.272 -10.876 973 1HB ASN 118 HB2 ASN 118 -5.455 -7.524 -10.932 974 2HB ASN 118 HB3 ASN 118 -4.488 -6.723 -9.693 975 1HD2 ASN 118 HD21 ASN 118 -5.156 -4.845 -11.345 976 2HD2 ASN 118 HD22 ASN 118 -4.016 -4.524 -12.561 977 H ASN 119 H ASN 119 -2.400 -10.494 -9.464 978 HA ASN 119 HA ASN 119 -2.714 -9.574 -6.681 979 1HB ASN 119 HB2 ASN 119 -3.855 -11.627 -5.955 980 2HB ASN 119 HB3 ASN 119 -4.835 -10.773 -7.147 981 1HD2 ASN 119 HD21 ASN 119 -5.861 -12.889 -7.693 982 2HD2 ASN 119 HD22 ASN 119 -5.034 -13.998 -8.677 983 H THR 120 H THR 120 -0.534 -10.262 -8.636 984 HA THR 120 HA THR 120 0.700 -12.729 -8.086 985 HB THR 120 HB THR 120 2.031 -10.034 -8.502 986 HG1 THR 120 HG1 THR 120 1.800 -10.439 -10.588 987 1HG2 THR 120 HG21 THR 120 3.528 -11.782 -7.553 988 2HG2 THR 120 HG22 THR 120 3.108 -12.837 -8.901 989 3HG2 THR 120 HG23 THR 120 3.979 -11.332 -9.197 990 H HIS 121 H HIS 121 0.703 -9.740 -6.182 991 HA HIS 121 HA HIS 121 2.467 -10.980 -4.156 992 1HB HIS 121 HB2 HIS 121 1.165 -8.244 -4.292 993 2HB HIS 121 HB3 HIS 121 2.279 -8.765 -3.027 994 HD1 HIS 121 HD1 HIS 121 3.894 -6.816 -3.907 995 HD2 HIS 121 HD2 HIS 121 3.252 -9.944 -6.581 996 HE1 HIS 121 HE1 HIS 121 5.700 -6.628 -5.673 997 H GLU 122 H GLU 122 -0.032 -12.285 -4.515 998 HA GLU 122 HA GLU 122 -1.763 -11.370 -2.302 999 1HB GLU 122 HB2 GLU 122 -2.834 -12.174 -4.358 1000 2HB GLU 122 HB3 GLU 122 -2.013 -13.726 -4.196 1001 1HG GLU 122 HG2 GLU 122 -3.596 -12.783 -1.854 1002 2HG GLU 122 HG3 GLU 122 -4.500 -13.332 -3.267 1003 H GLN 123 H GLN 123 0.735 -13.705 -2.904 1004 HA GLN 123 HA GLN 123 0.017 -15.429 -0.654 1005 1HB GLN 123 HB2 GLN 123 2.597 -15.238 -2.239 1006 2HB GLN 123 HB3 GLN 123 2.172 -16.533 -1.120 1007 1HG GLN 123 HG2 GLN 123 0.305 -15.861 -3.374 1008 2HG GLN 123 HG3 GLN 123 1.731 -16.849 -3.693 1009 1HE2 GLN 123 HE21 GLN 123 -0.782 -18.050 -3.993 1010 2HE2 GLN 123 HE22 GLN 123 -1.043 -19.157 -2.732 1011 H LEU 124 H LEU 124 2.878 -13.356 -1.270 1012 HA LEU 124 HA LEU 124 3.940 -13.380 1.317 1013 1HB LEU 124 HB2 LEU 124 5.115 -12.321 -0.535 1014 2HB LEU 124 HB3 LEU 124 3.859 -11.088 -0.665 1015 HG LEU 124 HG LEU 124 4.383 -10.448 1.731 1016 1HD1 LEU 124 HD11 LEU 124 5.731 -12.800 1.820 1017 2HD1 LEU 124 HD12 LEU 124 7.060 -11.700 1.451 1018 3HD1 LEU 124 HD13 LEU 124 6.081 -11.446 2.896 1019 1HD2 LEU 124 HD21 LEU 124 5.782 -9.871 -0.703 1020 2HD2 LEU 124 HD22 LEU 124 5.542 -8.820 0.693 1021 3HD2 LEU 124 HD23 LEU 124 6.950 -9.878 0.617 1022 H LEU 125 H LEU 125 1.241 -11.476 0.061 1023 HA LEU 125 HA LEU 125 0.993 -9.783 2.389 1024 1HB LEU 125 HB2 LEU 125 -0.917 -10.527 0.164 1025 2HB LEU 125 HB3 LEU 125 -1.355 -9.411 1.459 1026 HG LEU 125 HG LEU 125 1.018 -9.084 -0.402 1027 1HD1 LEU 125 HD11 LEU 125 -1.532 -8.711 -1.137 1028 2HD1 LEU 125 HD12 LEU 125 -1.278 -7.177 -0.304 1029 3HD1 LEU 125 HD13 LEU 125 -0.246 -7.624 -1.663 1030 1HD2 LEU 125 HD21 LEU 125 0.375 -7.957 2.166 1031 2HD2 LEU 125 HD22 LEU 125 1.769 -7.623 1.139 1032 3HD2 LEU 125 HD23 LEU 125 0.287 -6.688 0.945 1033 H ARG 126 H ARG 126 -0.715 -12.753 1.352 1034 HA ARG 126 HA ARG 126 -2.451 -12.921 3.599 1035 1HB ARG 126 HB2 ARG 126 -1.429 -14.814 1.545 1036 2HB ARG 126 HB3 ARG 126 -2.079 -15.532 3.020 1037 1HG ARG 126 HG2 ARG 126 -4.208 -14.590 2.692 1038 2HG ARG 126 HG3 ARG 126 -3.598 -13.372 1.572 1039 1HD ARG 126 HD2 ARG 126 -4.702 -14.980 0.206 1040 2HD ARG 126 HD3 ARG 126 -2.981 -15.318 0.026 1041 HE ARG 126 HE ARG 126 -3.328 -17.165 1.722 1042 1HH1 ARG 126 HH11 ARG 126 -4.814 -17.550 -0.972 1043 2HH1 ARG 126 HH12 ARG 126 -6.325 -18.178 -0.401 1044 1HH2 ARG 126 HH21 ARG 126 -5.783 -17.220 2.887 1045 2HH2 ARG 126 HH22 ARG 126 -6.873 -17.989 1.782 1046 H LYS 127 H LYS 127 0.945 -13.543 3.282 1047 HA LYS 127 HA LYS 127 1.155 -15.209 5.666 1048 1HB LYS 127 HB2 LYS 127 2.863 -15.465 3.991 1049 2HB LYS 127 HB3 LYS 127 3.201 -13.734 3.993 1050 1HG LYS 127 HG2 LYS 127 4.727 -14.051 5.612 1051 2HG LYS 127 HG3 LYS 127 3.450 -14.638 6.679 1052 1HD LYS 127 HD2 LYS 127 3.934 -16.847 6.273 1053 2HD LYS 127 HD3 LYS 127 4.464 -16.537 4.619 1054 1HE LYS 127 HE2 LYS 127 6.618 -16.270 5.252 1055 2HE LYS 127 HE3 LYS 127 6.172 -15.237 6.610 1056 1HZ LYS 127 HZ1 LYS 127 5.429 -17.997 6.951 1057 2HZ LYS 127 HZ2 LYS 127 7.103 -17.763 6.818 1058 3HZ LYS 127 HZ3 LYS 127 6.225 -16.946 8.022 1059 H SER 128 H SER 128 2.695 -12.056 5.054 1060 HA SER 128 HA SER 128 3.082 -11.351 7.742 1061 1HB SER 128 HB2 SER 128 2.389 -9.418 5.514 1062 2HB SER 128 HB3 SER 128 3.284 -9.053 6.985 1063 HG SER 128 HG SER 128 4.923 -10.416 6.276 1064 H GLU 129 H GLU 129 0.135 -11.457 5.931 1065 HA GLU 129 HA GLU 129 -1.352 -9.618 7.625 1066 1HB GLU 129 HB2 GLU 129 -2.027 -10.183 5.282 1067 2HB GLU 129 HB3 GLU 129 -2.406 -11.819 5.823 1068 1HG GLU 129 HG2 GLU 129 -4.470 -10.591 5.857 1069 2HG GLU 129 HG3 GLU 129 -3.961 -10.777 7.537 1070 H ALA 130 H ALA 130 -1.143 -13.182 7.387 1071 HA ALA 130 HA ALA 130 -2.922 -13.693 9.575 1072 1HB ALA 130 HB1 ALA 130 -0.664 -15.336 8.401 1073 2HB ALA 130 HB2 ALA 130 -1.774 -15.940 9.632 1074 3HB ALA 130 HB3 ALA 130 -2.384 -15.482 8.042 1075 H GLN 131 H GLN 131 0.544 -13.066 9.396 1076 HA GLN 131 HA GLN 131 1.132 -13.746 12.135 1077 1HB GLN 131 HB2 GLN 131 2.746 -13.304 10.110 1078 2HB GLN 131 HB3 GLN 131 2.634 -11.621 10.625 1079 1HG GLN 131 HG2 GLN 131 4.330 -12.165 12.037 1080 2HG GLN 131 HG3 GLN 131 3.056 -12.891 13.017 1081 1HE2 GLN 131 HE21 GLN 131 5.873 -13.829 12.791 1082 2HE2 GLN 131 HE22 GLN 131 5.792 -15.416 12.195 1083 H ALA 132 H ALA 132 0.423 -10.653 10.504 1084 HA ALA 132 HA ALA 132 0.551 -9.037 12.859 1085 1HB ALA 132 HB1 ALA 132 0.417 -8.353 10.337 1086 2HB ALA 132 HB2 ALA 132 -1.328 -8.438 10.585 1087 3HB ALA 132 HB3 ALA 132 -0.354 -7.320 11.542 1088 H LYS 133 H LYS 133 -1.958 -11.105 11.534 1089 HA LYS 133 HA LYS 133 -4.153 -10.037 13.046 1090 1HB LYS 133 HB2 LYS 133 -3.585 -12.578 11.582 1091 2HB LYS 133 HB3 LYS 133 -4.908 -12.588 12.749 1092 1HG LYS 133 HG2 LYS 133 -5.794 -10.502 11.619 1093 2HG LYS 133 HG3 LYS 133 -4.586 -10.756 10.360 1094 1HD LYS 133 HD2 LYS 133 -5.541 -13.109 10.101 1095 2HD LYS 133 HD3 LYS 133 -6.883 -12.574 11.113 1096 1HE LYS 133 HE2 LYS 133 -6.889 -10.542 9.377 1097 2HE LYS 133 HE3 LYS 133 -6.165 -11.762 8.331 1098 1HZ LYS 133 HZ1 LYS 133 -8.064 -13.239 9.098 1099 2HZ LYS 133 HZ2 LYS 133 -8.799 -11.819 9.671 1100 3HZ LYS 133 HZ3 LYS 133 -8.448 -11.990 8.017 1101 H LYS 134 H LYS 134 -1.877 -12.712 13.692 1102 HA LYS 134 HA LYS 134 -3.016 -13.210 16.334 1103 1HB LYS 134 HB2 LYS 134 -0.825 -14.322 14.673 1104 2HB LYS 134 HB3 LYS 134 -0.576 -14.415 16.417 1105 1HG LYS 134 HG2 LYS 134 -3.267 -15.188 15.392 1106 2HG LYS 134 HG3 LYS 134 -1.935 -16.300 15.074 1107 1HD LYS 134 HD2 LYS 134 -2.015 -15.236 17.827 1108 2HD LYS 134 HD3 LYS 134 -3.380 -16.265 17.397 1109 1HE LYS 134 HE2 LYS 134 -2.035 -18.128 17.022 1110 2HE LYS 134 HE3 LYS 134 -0.606 -17.152 16.679 1111 1HZ LYS 134 HZ1 LYS 134 -1.609 -16.734 19.323 1112 2HZ LYS 134 HZ2 LYS 134 -1.191 -18.357 19.051 1113 3HZ LYS 134 HZ3 LYS 134 -0.040 -17.136 18.812 1114 H GLU 135 H GLU 135 -0.856 -10.928 15.025 1115 HA GLU 135 HA GLU 135 0.642 -10.528 17.532 1116 1HB GLU 135 HB2 GLU 135 0.620 -8.900 14.971 1117 2HB GLU 135 HB3 GLU 135 1.762 -8.714 16.303 1118 1HG GLU 135 HG2 GLU 135 1.567 -11.480 15.356 1119 2HG GLU 135 HG3 GLU 135 2.115 -10.365 14.104 1120 H LYS 136 H LYS 136 -2.233 -9.355 16.007 1121 HA LYS 136 HA LYS 136 -3.697 -7.602 16.579 1122 1HB LYS 136 HB2 LYS 136 -2.745 -7.696 19.404 1123 2HB LYS 136 HB3 LYS 136 -4.391 -7.729 18.774 1124 1HG LYS 136 HG2 LYS 136 -4.035 -10.059 18.002 1125 2HG LYS 136 HG3 LYS 136 -2.409 -10.024 18.684 1126 1HD LYS 136 HD2 LYS 136 -3.503 -10.936 20.488 1127 2HD LYS 136 HD3 LYS 136 -3.777 -9.232 20.855 1128 1HE LYS 136 HE2 LYS 136 -5.879 -9.627 19.242 1129 2HE LYS 136 HE3 LYS 136 -5.684 -11.281 19.823 1130 1HZ LYS 136 HZ1 LYS 136 -5.750 -10.450 22.093 1131 2HZ LYS 136 HZ2 LYS 136 -5.950 -8.861 21.526 1132 3HZ LYS 136 HZ3 LYS 136 -7.161 -10.023 21.254 1133 H LEU 137 H LEU 137 -1.803 -6.327 15.403 1134 HA LEU 137 HA LEU 137 -0.491 -4.449 17.298 1135 1HB LEU 137 HB2 LEU 137 0.279 -5.628 14.820 1136 2HB LEU 137 HB3 LEU 137 0.154 -3.887 14.564 1137 HG LEU 137 HG LEU 137 1.421 -4.473 17.110 1138 1HD1 LEU 137 HD11 LEU 137 2.649 -5.635 14.594 1139 2HD1 LEU 137 HD12 LEU 137 3.545 -5.356 16.087 1140 3HD1 LEU 137 HD13 LEU 137 2.212 -6.511 16.061 1141 1HD2 LEU 137 HD21 LEU 137 2.192 -3.008 14.572 1142 2HD2 LEU 137 HD22 LEU 137 1.605 -2.307 16.080 1143 3HD2 LEU 137 HD23 LEU 137 3.210 -3.036 16.012 1144 H ASN 138 H ASN 138 -1.767 -2.738 17.802 1145 HA ASN 138 HA ASN 138 -3.133 -0.858 17.521 1146 1HB ASN 138 HB2 ASN 138 -2.163 -1.137 14.660 1147 2HB ASN 138 HB3 ASN 138 -3.004 0.272 15.308 1148 1HD2 ASN 138 HD21 ASN 138 -0.028 -0.397 14.408 1149 2HD2 ASN 138 HD22 ASN 138 0.888 0.318 15.644 1150 H ILE 139 H ILE 139 -3.864 -1.691 14.214 1151 HA ILE 139 HA ILE 139 -6.653 -1.708 14.555 1152 HB ILE 139 HB ILE 139 -5.009 -3.237 12.516 1153 1HG1 ILE 139 HG12 ILE 139 -6.378 -0.561 12.187 1154 2HG1 ILE 139 HG13 ILE 139 -4.707 -0.692 12.739 1155 1HG2 ILE 139 HG21 ILE 139 -7.928 -2.434 12.597 1156 2HG2 ILE 139 HG22 ILE 139 -7.110 -3.026 11.152 1157 3HG2 ILE 139 HG23 ILE 139 -7.280 -4.072 12.561 1158 1HD1 ILE 139 HD11 ILE 139 -5.119 -2.388 10.438 1159 2HD1 ILE 139 HD12 ILE 139 -5.626 -0.741 10.070 1160 3HD1 ILE 139 HD13 ILE 139 -3.986 -1.052 10.638 1161 H TRP 140 H TRP 140 -4.727 -4.645 13.914 1162 HA TRP 140 HA TRP 140 -6.779 -6.430 14.799 1163 1HB TRP 140 HB2 TRP 140 -3.807 -6.999 14.753 1164 2HB TRP 140 HB3 TRP 140 -5.126 -8.156 14.573 1165 HD1 TRP 140 HD1 TRP 140 -2.961 -5.816 12.629 1166 HE1 TRP 140 HE1 TRP 140 -3.671 -5.811 10.151 1167 HE3 TRP 140 HE3 TRP 140 -7.377 -8.356 12.973 1168 HZ2 TRP 140 HZ2 TRP 140 -5.829 -6.757 8.529 1169 HZ3 TRP 140 HZ3 TRP 140 -8.740 -8.788 10.947 1170 HH2 TRP 140 HH2 TRP 140 -7.973 -7.991 8.728 1171 H SER 141 H SER 141 -4.798 -4.364 16.595 1172 HA SER 141 HA SER 141 -4.058 -5.823 18.869 1173 1HB SER 141 HB2 SER 141 -3.600 -3.392 18.544 1174 2HB SER 141 HB3 SER 141 -5.299 -3.052 18.861 1175 HG SER 141 HG SER 141 -3.529 -4.407 20.626 1176 H GLU 142 H GLU 142 -7.234 -5.020 17.722 1177 HA GLU 142 HA GLU 142 -8.452 -5.884 20.297 1178 1HB GLU 142 HB2 GLU 142 -9.781 -4.759 17.810 1179 2HB GLU 142 HB3 GLU 142 -10.552 -5.034 19.373 1180 1HG GLU 142 HG2 GLU 142 -8.564 -3.496 20.238 1181 2HG GLU 142 HG3 GLU 142 -8.596 -2.917 18.572 1182 H ASP 143 H ASP 143 -10.895 -6.817 18.965 1183 HA ASP 143 HA ASP 143 -10.267 -8.923 17.108 1184 1HB ASP 143 HB2 ASP 143 -9.309 -9.607 19.506 1185 2HB ASP 143 HB3 ASP 143 -10.988 -10.084 19.765 1186 H ASN 144 H ASN 144 -12.171 -8.430 16.041 1187 HA ASN 144 HA ASN 144 -14.483 -8.329 15.644 1188 1HB ASN 144 HB2 ASN 144 -13.943 -10.668 17.118 1189 2HB ASN 144 HB3 ASN 144 -15.358 -9.944 17.884 1190 1HD2 ASN 144 HD21 ASN 144 -16.176 -12.148 16.751 1191 2HD2 ASN 144 HD22 ASN 144 -16.836 -11.935 15.201 1192 H ALA 145 H ALA 145 -16.690 -8.170 17.180 1193 HA ALA 145 HA ALA 145 -16.091 -6.197 19.335 1194 1HB ALA 145 HB1 ALA 145 -16.704 -5.121 17.068 1195 2HB ALA 145 HB2 ALA 145 -18.325 -5.758 17.350 1196 3HB ALA 145 HB3 ALA 145 -17.622 -4.601 18.482 1197 H ASP 146 H ASP 146 -16.736 -7.671 20.938 1198 HA ASP 146 HA ASP 146 -19.647 -8.042 21.177 1199 1HB ASP 146 HB2 ASP 146 -17.808 -10.207 20.428 1200 2HB ASP 146 HB3 ASP 146 -18.773 -10.576 21.859 1201 H SER 147 H SER 147 -20.195 -8.875 23.386 1202 HA SER 147 HA SER 147 -19.831 -9.022 25.714 1203 1HB SER 147 HB2 SER 147 -16.930 -8.428 25.530 1204 2HB SER 147 HB3 SER 147 -17.767 -9.674 26.453 1205 HG SER 147 HG SER 147 -16.836 -10.805 24.867 1206 H GLY 148 H GLY 148 -20.214 -6.518 24.101 1207 1HA GLY 148 HA2 GLY 148 -18.718 -4.476 25.599 1208 2HA GLY 148 HA3 GLY 148 -19.915 -4.168 24.341 1209 H GLN 149 H GLN 149 -19.485 -3.428 27.391 1210 HA GLN 149 HA GLN 149 -21.902 -4.388 28.671 1211 1HB GLN 149 HB2 GLN 149 -19.703 -2.517 29.315 1212 2HB GLN 149 HB3 GLN 149 -21.254 -2.122 30.055 1213 1HG GLN 149 HG2 GLN 149 -21.349 -4.625 30.712 1214 2HG GLN 149 HG3 GLN 149 -19.622 -4.639 30.352 1215 1HE2 GLN 149 HE21 GLN 149 -18.194 -3.552 31.823 1216 2HE2 GLN 149 HE22 GLN 149 -18.728 -2.862 33.278 1217 HN3 PTP 150 H3 PTP 150 -9.311 -3.924 -8.279 1218 1H5M PTP 150 H51 PTP 150 -6.666 -1.573 -4.994 1219 2H5M PTP 150 H52 PTP 150 -7.648 -2.609 -3.932 1220 3H5M PTP 150 H53 PTP 150 -7.963 -0.860 -4.007 1221 H6 PTP 150 H6 PTP 150 -9.829 -0.304 -5.161 1222 H1* PTP 150 H1' PTP 150 -12.034 -0.352 -8.077 1223 2H2* PTP 150 H2' PTP 150 -12.663 -1.490 -5.366 1224 H3* PTP 150 H3' PTP 150 -13.778 0.475 -4.637 1225 H4* PTP 150 H4' PTP 150 -12.390 2.473 -5.885 1226 2H5* PTP 150 H5' PTP 150 -11.568 0.396 -3.790 Start of MODEL 28 1 1H ALA 1 H1 ALA 1 13.959 -23.711 -22.330 2 2H ALA 1 H2 ALA 1 15.047 -23.853 -21.033 3 3H ALA 1 H3 ALA 1 13.379 -23.966 -20.753 4 HA ALA 1 HA ALA 1 14.524 -21.522 -21.939 5 1HB ALA 1 HB1 ALA 1 11.946 -22.444 -21.161 6 2HB ALA 1 HB2 ALA 1 12.403 -21.162 -20.039 7 3HB ALA 1 HB3 ALA 1 12.384 -20.849 -21.775 8 H THR 2 H THR 2 15.242 -19.856 -20.486 9 HA THR 2 HA THR 2 16.053 -20.897 -17.800 10 HB THR 2 HB THR 2 17.892 -20.420 -19.525 11 HG1 THR 2 HG1 THR 2 18.287 -20.503 -17.289 12 1HG2 THR 2 HG21 THR 2 16.475 -18.028 -19.787 13 2HG2 THR 2 HG22 THR 2 17.920 -17.582 -18.882 14 3HG2 THR 2 HG23 THR 2 18.072 -18.374 -20.451 15 H SER 3 H SER 3 13.534 -19.603 -18.304 16 HA SER 3 HA SER 3 13.641 -16.797 -17.681 17 1HB SER 3 HB2 SER 3 11.556 -17.350 -18.503 18 2HB SER 3 HB3 SER 3 11.539 -18.917 -17.701 19 HG SER 3 HG SER 3 10.835 -18.001 -15.895 20 H THR 4 H THR 4 12.566 -15.982 -15.551 21 HA THR 4 HA THR 4 13.099 -17.657 -13.195 22 HB THR 4 HB THR 4 15.323 -16.826 -13.473 23 HG1 THR 4 HG1 THR 4 15.477 -15.400 -11.687 24 1HG2 THR 4 HG21 THR 4 13.902 -14.513 -14.559 25 2HG2 THR 4 HG22 THR 4 15.214 -14.054 -13.473 26 3HG2 THR 4 HG23 THR 4 15.544 -15.070 -14.876 27 H LYS 5 H LYS 5 10.741 -16.416 -14.290 28 HA LYS 5 HA LYS 5 9.018 -14.899 -13.730 29 1HB LYS 5 HB2 LYS 5 8.350 -15.106 -11.408 30 2HB LYS 5 HB3 LYS 5 8.975 -16.665 -11.944 31 1HG LYS 5 HG2 LYS 5 11.001 -16.395 -10.774 32 2HG LYS 5 HG3 LYS 5 10.788 -14.652 -10.624 33 1HD LYS 5 HD2 LYS 5 9.976 -15.074 -8.558 34 2HD LYS 5 HD3 LYS 5 8.532 -15.675 -9.374 35 1HE LYS 5 HE2 LYS 5 9.313 -17.391 -7.846 36 2HE LYS 5 HE3 LYS 5 9.618 -17.935 -9.496 37 1HZ LYS 5 HZ1 LYS 5 11.645 -16.528 -7.854 38 2HZ LYS 5 HZ2 LYS 5 11.507 -18.221 -7.903 39 3HZ LYS 5 HZ3 LYS 5 11.886 -17.356 -9.316 40 H LYS 6 H LYS 6 8.991 -13.373 -11.184 41 HA LYS 6 HA LYS 6 9.817 -11.357 -10.279 42 1HB LYS 6 HB2 LYS 6 12.109 -12.518 -11.114 43 2HB LYS 6 HB3 LYS 6 12.059 -11.144 -12.219 44 1HG LYS 6 HG2 LYS 6 12.588 -9.693 -10.575 45 2HG LYS 6 HG3 LYS 6 11.356 -10.362 -9.503 46 1HD LYS 6 HD2 LYS 6 12.989 -12.334 -9.165 47 2HD LYS 6 HD3 LYS 6 14.208 -11.276 -9.876 48 1HE LYS 6 HE2 LYS 6 14.391 -10.885 -7.548 49 2HE LYS 6 HE3 LYS 6 13.434 -9.526 -8.140 50 1HZ LYS 6 HZ1 LYS 6 11.877 -11.846 -7.432 51 2HZ LYS 6 HZ2 LYS 6 12.713 -11.161 -6.124 52 3HZ LYS 6 HZ3 LYS 6 11.638 -10.211 -7.035 53 H LEU 7 H LEU 7 8.686 -9.571 -10.814 54 HA LEU 7 HA LEU 7 7.962 -9.029 -13.591 55 1HB LEU 7 HB2 LEU 7 7.413 -7.616 -10.971 56 2HB LEU 7 HB3 LEU 7 6.862 -6.980 -12.519 57 HG LEU 7 HG LEU 7 6.263 -9.836 -12.107 58 1HD1 LEU 7 HD11 LEU 7 5.553 -7.814 -10.088 59 2HD1 LEU 7 HD12 LEU 7 4.169 -8.706 -10.721 60 3HD1 LEU 7 HD13 LEU 7 5.513 -9.573 -9.979 61 1HD2 LEU 7 HD21 LEU 7 5.406 -7.712 -13.708 62 2HD2 LEU 7 HD22 LEU 7 4.652 -9.302 -13.605 63 3HD2 LEU 7 HD23 LEU 7 4.063 -7.980 -12.597 64 H HIS 8 H HIS 8 8.052 -6.225 -13.690 65 HA HIS 8 HA HIS 8 11.003 -5.767 -13.786 66 1HB HIS 8 HB2 HIS 8 9.249 -5.604 -15.848 67 2HB HIS 8 HB3 HIS 8 9.171 -3.946 -15.251 68 HD1 HIS 8 HD1 HIS 8 10.553 -2.868 -17.117 69 HD2 HIS 8 HD2 HIS 8 12.542 -6.008 -15.229 70 HE1 HIS 8 HE1 HIS 8 12.949 -2.794 -17.936 71 H LYS 9 H LYS 9 11.759 -4.361 -12.278 72 HA LYS 9 HA LYS 9 9.814 -2.571 -10.919 73 1HB LYS 9 HB2 LYS 9 12.704 -3.003 -10.150 74 2HB LYS 9 HB3 LYS 9 11.380 -2.427 -9.137 75 1HG LYS 9 HG2 LYS 9 10.279 -4.633 -9.326 76 2HG LYS 9 HG3 LYS 9 11.619 -5.211 -10.317 77 1HD LYS 9 HD2 LYS 9 12.198 -5.957 -8.162 78 2HD LYS 9 HD3 LYS 9 13.119 -4.461 -8.328 79 1HE LYS 9 HE2 LYS 9 12.011 -4.478 -6.156 80 2HE LYS 9 HE3 LYS 9 11.273 -3.241 -7.173 81 1HZ LYS 9 HZ1 LYS 9 10.141 -5.941 -7.230 82 2HZ LYS 9 HZ2 LYS 9 9.822 -4.970 -5.871 83 3HZ LYS 9 HZ3 LYS 9 9.370 -4.438 -7.417 84 H GLU 10 H GLU 10 9.752 -0.455 -11.459 85 HA GLU 10 HA GLU 10 12.087 0.677 -12.943 86 1HB GLU 10 HB2 GLU 10 9.198 0.875 -13.296 87 2HB GLU 10 HB3 GLU 10 9.952 2.466 -13.181 88 1HG GLU 10 HG2 GLU 10 10.125 1.976 -15.472 89 2HG GLU 10 HG3 GLU 10 11.704 1.496 -14.849 90 HA PRO 11 HA PRO 11 12.783 3.622 -9.750 91 1HB PRO 11 HB2 PRO 11 13.412 5.860 -11.183 92 2HB PRO 11 HB3 PRO 11 14.477 4.448 -11.075 93 1HG PRO 11 HG2 PRO 11 12.725 5.324 -13.328 94 2HG PRO 11 HG3 PRO 11 14.278 4.474 -13.376 95 1HD PRO 11 HD2 PRO 11 11.775 3.267 -13.713 96 2HD PRO 11 HD3 PRO 11 13.276 2.412 -13.294 97 H ALA 12 H ALA 12 12.067 5.759 -8.853 98 HA ALA 12 HA ALA 12 9.728 7.065 -10.011 99 1HB ALA 12 HB1 ALA 12 9.191 4.804 -8.505 100 2HB ALA 12 HB2 ALA 12 9.037 6.104 -7.323 101 3HB ALA 12 HB3 ALA 12 8.060 6.126 -8.791 102 H THR 13 H THR 13 9.042 8.919 -8.599 103 HA THR 13 HA THR 13 11.240 9.698 -6.719 104 HB THR 13 HB THR 13 9.657 11.666 -8.375 105 HG1 THR 13 HG1 THR 13 11.251 11.549 -9.893 106 1HG2 THR 13 HG21 THR 13 10.880 12.514 -6.408 107 2HG2 THR 13 HG22 THR 13 12.363 11.777 -7.013 108 3HG2 THR 13 HG23 THR 13 11.608 13.098 -7.905 109 H LEU 14 H LEU 14 10.565 11.122 -4.962 110 HA LEU 14 HA LEU 14 7.812 10.509 -4.081 111 1HB LEU 14 HB2 LEU 14 9.997 10.389 -2.643 112 2HB LEU 14 HB3 LEU 14 9.786 12.135 -2.498 113 HG LEU 14 HG LEU 14 8.693 10.887 -0.636 114 1HD1 LEU 14 HD11 LEU 14 7.782 13.061 -1.911 115 2HD1 LEU 14 HD12 LEU 14 6.427 11.981 -2.240 116 3HD1 LEU 14 HD13 LEU 14 6.894 12.329 -0.575 117 1HD2 LEU 14 HD21 LEU 14 8.068 9.006 -2.426 118 2HD2 LEU 14 HD22 LEU 14 7.079 9.267 -0.989 119 3HD2 LEU 14 HD23 LEU 14 6.583 9.951 -2.537 120 H ILE 15 H ILE 15 6.518 11.902 -5.342 121 HA ILE 15 HA ILE 15 7.119 14.738 -5.600 122 HB ILE 15 HB ILE 15 4.442 13.384 -6.019 123 1HG1 ILE 15 HG12 ILE 15 6.748 13.679 -7.973 124 2HG1 ILE 15 HG13 ILE 15 6.237 12.164 -7.225 125 1HG2 ILE 15 HG21 ILE 15 5.335 16.054 -6.250 126 2HG2 ILE 15 HG22 ILE 15 5.200 15.444 -7.900 127 3HG2 ILE 15 HG23 ILE 15 3.806 15.389 -6.821 128 1HD1 ILE 15 HD11 ILE 15 4.318 13.878 -8.804 129 2HD1 ILE 15 HD12 ILE 15 5.326 12.657 -9.581 130 3HD1 ILE 15 HD13 ILE 15 4.151 12.181 -8.354 131 H LYS 16 H LYS 16 4.367 13.079 -4.015 132 HA LYS 16 HA LYS 16 4.686 14.624 -1.576 133 1HB LYS 16 HB2 LYS 16 3.444 16.026 -3.557 134 2HB LYS 16 HB3 LYS 16 2.062 15.235 -2.799 135 1HG LYS 16 HG2 LYS 16 2.177 16.600 -1.011 136 2HG LYS 16 HG3 LYS 16 3.890 16.248 -0.789 137 1HD LYS 16 HD2 LYS 16 3.722 18.606 -1.217 138 2HD LYS 16 HD3 LYS 16 4.359 17.866 -2.687 139 1HE LYS 16 HE2 LYS 16 1.992 17.767 -3.560 140 2HE LYS 16 HE3 LYS 16 1.502 18.724 -2.162 141 1HZ LYS 16 HZ1 LYS 16 3.402 20.274 -2.946 142 2HZ LYS 16 HZ2 LYS 16 3.191 19.497 -4.442 143 3HZ LYS 16 HZ3 LYS 16 1.897 20.333 -3.732 144 H ALA 17 H ALA 17 4.246 12.953 -0.204 145 HA ALA 17 HA ALA 17 2.535 10.749 -0.844 146 1HB ALA 17 HB1 ALA 17 3.772 11.791 1.691 147 2HB ALA 17 HB2 ALA 17 2.585 10.489 1.767 148 3HB ALA 17 HB3 ALA 17 4.075 10.271 0.850 149 H ILE 18 H ILE 18 0.439 10.245 0.121 150 HA ILE 18 HA ILE 18 -1.110 12.703 0.839 151 HB ILE 18 HB ILE 18 -2.055 10.252 -0.680 152 1HG1 ILE 18 HG12 ILE 18 -1.648 13.124 -1.578 153 2HG1 ILE 18 HG13 ILE 18 -0.591 11.773 -1.991 154 1HG2 ILE 18 HG21 ILE 18 -3.686 11.492 0.897 155 2HG2 ILE 18 HG22 ILE 18 -3.563 12.831 -0.245 156 3HG2 ILE 18 HG23 ILE 18 -4.189 11.270 -0.779 157 1HD1 ILE 18 HD11 ILE 18 -3.464 11.327 -2.539 158 2HD1 ILE 18 HD12 ILE 18 -2.698 12.570 -3.529 159 3HD1 ILE 18 HD13 ILE 18 -2.054 10.929 -3.522 160 H ASP 19 H ASP 19 -1.983 9.252 0.906 161 HA ASP 19 HA ASP 19 -2.579 9.595 3.813 162 1HB ASP 19 HB2 ASP 19 -3.656 7.371 2.088 163 2HB ASP 19 HB3 ASP 19 -4.325 8.032 3.581 164 H GLY 20 H GLY 20 -2.865 6.606 3.992 165 1HA GLY 20 HA2 GLY 20 -0.013 6.064 4.526 166 2HA GLY 20 HA3 GLY 20 -1.370 5.067 5.048 167 H ASP 21 H ASP 21 -2.402 5.308 2.141 168 HA ASP 21 HA ASP 21 -0.497 3.334 0.944 169 1HB ASP 21 HB2 ASP 21 -2.472 2.146 0.014 170 2HB ASP 21 HB3 ASP 21 -2.479 2.152 1.779 171 H THR 22 H THR 22 -1.948 6.317 0.611 172 HA THR 22 HA THR 22 -1.871 6.152 -2.375 173 HB THR 22 HB THR 22 -3.149 8.379 -0.787 174 HG1 THR 22 HG1 THR 22 -4.807 7.156 -0.404 175 1HG2 THR 22 HG21 THR 22 -2.740 7.796 -3.544 176 2HG2 THR 22 HG22 THR 22 -4.468 7.646 -3.220 177 3HG2 THR 22 HG23 THR 22 -3.626 9.149 -2.840 178 H VAL 23 H VAL 23 0.013 6.955 -3.171 179 HA VAL 23 HA VAL 23 1.065 9.480 -2.002 180 HB VAL 23 HB VAL 23 3.362 8.586 -2.020 181 1HG1 VAL 23 HG11 VAL 23 1.424 8.105 -0.143 182 2HG1 VAL 23 HG12 VAL 23 2.014 6.474 -0.460 183 3HG1 VAL 23 HG13 VAL 23 3.133 7.728 0.075 184 1HG2 VAL 23 HG21 VAL 23 1.932 6.101 -2.975 185 2HG2 VAL 23 HG22 VAL 23 3.306 6.921 -3.715 186 3HG2 VAL 23 HG23 VAL 23 3.520 6.020 -2.215 187 H LYS 24 H LYS 24 1.864 10.862 -3.568 188 HA LYS 24 HA LYS 24 1.587 9.959 -6.375 189 1HB LYS 24 HB2 LYS 24 2.125 12.707 -5.204 190 2HB LYS 24 HB3 LYS 24 1.843 12.366 -6.912 191 1HG LYS 24 HG2 LYS 24 -0.307 11.126 -5.747 192 2HG LYS 24 HG3 LYS 24 -0.084 12.516 -4.685 193 1HD LYS 24 HD2 LYS 24 0.242 13.591 -7.227 194 2HD LYS 24 HD3 LYS 24 -1.064 12.424 -7.440 195 1HE LYS 24 HE2 LYS 24 -2.312 14.224 -6.718 196 2HE LYS 24 HE3 LYS 24 -1.903 13.526 -5.150 197 1HZ LYS 24 HZ1 LYS 24 0.233 15.050 -5.597 198 2HZ LYS 24 HZ2 LYS 24 -0.953 15.965 -6.398 199 3HZ LYS 24 HZ3 LYS 24 -1.142 15.588 -4.755 200 H LEU 25 H LEU 25 3.361 9.260 -7.466 201 HA LEU 25 HA LEU 25 6.023 10.343 -6.629 202 1HB LEU 25 HB2 LEU 25 5.831 7.648 -7.911 203 2HB LEU 25 HB3 LEU 25 6.995 8.245 -6.731 204 HG LEU 25 HG LEU 25 4.085 7.710 -6.087 205 1HD1 LEU 25 HD11 LEU 25 6.428 5.924 -6.261 206 2HD1 LEU 25 HD12 LEU 25 5.547 5.825 -4.737 207 3HD1 LEU 25 HD13 LEU 25 4.710 5.527 -6.261 208 1HD2 LEU 25 HD21 LEU 25 5.750 9.317 -4.750 209 2HD2 LEU 25 HD22 LEU 25 4.623 8.257 -3.903 210 3HD2 LEU 25 HD23 LEU 25 6.310 7.780 -4.090 211 H MET 26 H MET 26 7.637 10.329 -8.416 212 HA MET 26 HA MET 26 6.321 11.071 -10.967 213 1HB MET 26 HB2 MET 26 8.314 12.303 -9.611 214 2HB MET 26 HB3 MET 26 9.272 11.269 -10.672 215 1HG MET 26 HG2 MET 26 8.683 12.426 -12.541 216 2HG MET 26 HG3 MET 26 7.021 12.647 -11.997 217 1HE MET 26 HE1 MET 26 6.348 14.477 -12.343 218 2HE MET 26 HE2 MET 26 6.281 15.336 -10.799 219 3HE MET 26 HE3 MET 26 7.065 16.079 -12.191 220 H TYR 27 H TYR 27 6.181 9.544 -12.531 221 HA TYR 27 HA TYR 27 8.334 7.470 -12.651 222 1HB TYR 27 HB2 TYR 27 6.374 6.348 -11.842 223 2HB TYR 27 HB3 TYR 27 5.345 7.157 -13.023 224 HD1 TYR 27 HD1 TYR 27 7.894 4.538 -12.519 225 HD2 TYR 27 HD2 TYR 27 5.312 6.470 -15.357 226 HE1 TYR 27 HE1 TYR 27 8.306 2.707 -14.140 227 HE2 TYR 27 HE2 TYR 27 5.724 4.639 -16.978 228 HH TYR 27 HH TYR 27 8.075 2.741 -17.049 229 H LYS 28 H LYS 28 9.468 7.807 -14.494 230 HA LYS 28 HA LYS 28 9.916 8.168 -16.769 231 1HB LYS 28 HB2 LYS 28 7.118 7.248 -16.713 232 2HB LYS 28 HB3 LYS 28 7.530 8.234 -18.117 233 1HG LYS 28 HG2 LYS 28 7.949 5.795 -18.484 234 2HG LYS 28 HG3 LYS 28 9.405 6.777 -18.650 235 1HD LYS 28 HD2 LYS 28 9.309 6.156 -15.929 236 2HD LYS 28 HD3 LYS 28 8.822 4.663 -16.733 237 1HE LYS 28 HE2 LYS 28 11.197 6.198 -17.750 238 2HE LYS 28 HE3 LYS 28 11.372 5.133 -16.356 239 1HZ LYS 28 HZ1 LYS 28 10.049 3.525 -17.959 240 2HZ LYS 28 HZ2 LYS 28 10.808 4.474 -19.141 241 3HZ LYS 28 HZ3 LYS 28 11.743 3.640 -17.995 242 H GLY 29 H GLY 29 8.806 10.314 -14.770 243 1HA GLY 29 HA2 GLY 29 9.029 12.693 -15.097 244 2HA GLY 29 HA3 GLY 29 8.751 12.454 -16.822 245 H GLN 30 H GLN 30 6.455 10.569 -15.601 246 HA GLN 30 HA GLN 30 4.458 12.778 -15.627 247 1HB GLN 30 HB2 GLN 30 4.465 10.576 -17.152 248 2HB GLN 30 HB3 GLN 30 3.621 9.919 -15.749 249 1HG GLN 30 HG2 GLN 30 2.722 12.594 -16.679 250 2HG GLN 30 HG3 GLN 30 2.348 11.235 -17.740 251 1HE2 GLN 30 HE21 GLN 30 0.439 12.812 -16.057 252 2HE2 GLN 30 HE22 GLN 30 -0.297 11.686 -15.020 253 HA PRO 31 HA PRO 31 4.089 11.919 -11.228 254 1HB PRO 31 HB2 PRO 31 2.392 14.001 -10.721 255 2HB PRO 31 HB3 PRO 31 4.139 14.212 -10.934 256 1HG PRO 31 HG2 PRO 31 1.920 14.809 -12.843 257 2HG PRO 31 HG3 PRO 31 3.466 15.643 -12.617 258 1HD PRO 31 HD2 PRO 31 2.921 13.835 -14.672 259 2HD PRO 31 HD3 PRO 31 4.549 14.283 -14.118 260 H MET 32 H MET 32 2.690 10.399 -10.408 261 HA MET 32 HA MET 32 -0.194 10.588 -11.100 262 1HB MET 32 HB2 MET 32 1.638 8.610 -12.142 263 2HB MET 32 HB3 MET 32 0.418 7.833 -11.133 264 1HG MET 32 HG2 MET 32 -1.358 8.611 -12.458 265 2HG MET 32 HG3 MET 32 -0.387 9.902 -13.168 266 1HE MET 32 HE1 MET 32 -0.143 6.076 -12.547 267 2HE MET 32 HE2 MET 32 -1.670 6.347 -13.383 268 3HE MET 32 HE3 MET 32 -0.378 5.432 -14.171 269 H THR 33 H THR 33 -1.548 9.347 -9.609 270 HA THR 33 HA THR 33 -0.293 9.150 -6.928 271 HB THR 33 HB THR 33 -3.229 8.854 -7.591 272 HG1 THR 33 HG1 THR 33 -2.237 10.840 -8.395 273 1HG2 THR 33 HG21 THR 33 -1.560 9.185 -5.160 274 2HG2 THR 33 HG22 THR 33 -3.066 10.101 -5.198 275 3HG2 THR 33 HG23 THR 33 -3.098 8.347 -5.366 276 H PHE 34 H PHE 34 0.517 7.150 -6.464 277 HA PHE 34 HA PHE 34 -0.723 4.759 -7.689 278 1HB PHE 34 HB2 PHE 34 1.818 5.256 -6.141 279 2HB PHE 34 HB3 PHE 34 1.233 3.618 -6.441 280 HD1 PHE 34 HD1 PHE 34 1.055 2.742 -8.742 281 HD2 PHE 34 HD2 PHE 34 2.679 6.635 -7.936 282 HE1 PHE 34 HE1 PHE 34 2.013 2.816 -11.029 283 HE2 PHE 34 HE2 PHE 34 3.639 6.709 -10.222 284 HZ PHE 34 HZ PHE 34 3.305 4.799 -11.767 285 H ARG 35 H ARG 35 -1.521 3.010 -6.406 286 HA ARG 35 HA ARG 35 -2.070 3.709 -3.549 287 1HB ARG 35 HB2 ARG 35 -3.924 2.834 -5.723 288 2HB ARG 35 HB3 ARG 35 -4.216 2.211 -4.100 289 1HG ARG 35 HG2 ARG 35 -3.624 5.084 -4.139 290 2HG ARG 35 HG3 ARG 35 -5.081 4.662 -5.039 291 1HD ARG 35 HD2 ARG 35 -5.756 3.265 -3.001 292 2HD ARG 35 HD3 ARG 35 -4.460 4.093 -2.138 293 HE ARG 35 HE ARG 35 -6.028 6.098 -3.355 294 1HH1 ARG 35 HH11 ARG 35 -6.010 3.799 -0.803 295 2HH1 ARG 35 HH12 ARG 35 -7.373 4.489 0.016 296 1HH2 ARG 35 HH21 ARG 35 -7.939 6.904 -2.406 297 2HH2 ARG 35 HH22 ARG 35 -8.464 6.247 -0.893 298 H LEU 36 H LEU 36 -1.449 2.120 -2.144 299 HA LEU 36 HA LEU 36 0.088 -0.091 -2.837 300 1HB LEU 36 HB2 LEU 36 -1.846 0.019 -0.502 301 2HB LEU 36 HB3 LEU 36 -0.415 -1.006 -0.632 302 HG LEU 36 HG LEU 36 -0.456 2.023 -0.543 303 1HD1 LEU 36 HD11 LEU 36 -0.739 0.535 1.586 304 2HD1 LEU 36 HD12 LEU 36 0.969 0.168 1.352 305 3HD1 LEU 36 HD13 LEU 36 0.452 1.835 1.612 306 1HD2 LEU 36 HD21 LEU 36 1.507 0.110 -1.560 307 2HD2 LEU 36 HD22 LEU 36 1.478 1.867 -1.709 308 3HD2 LEU 36 HD23 LEU 36 2.166 1.115 -0.269 309 H LEU 37 H LEU 37 -0.329 -2.031 -3.774 310 HA LEU 37 HA LEU 37 -3.121 -2.655 -4.499 311 1HB LEU 37 HB2 LEU 37 -0.424 -3.416 -5.463 312 2HB LEU 37 HB3 LEU 37 -1.661 -4.667 -5.587 313 HG LEU 37 HG LEU 37 -2.140 -1.843 -6.549 314 1HD1 LEU 37 HD11 LEU 37 -0.146 -2.961 -7.677 315 2HD1 LEU 37 HD12 LEU 37 -1.275 -4.180 -8.268 316 3HD1 LEU 37 HD13 LEU 37 -1.463 -2.495 -8.754 317 1HD2 LEU 37 HD21 LEU 37 -3.648 -4.328 -6.397 318 2HD2 LEU 37 HD22 LEU 37 -4.213 -2.705 -6.798 319 3HD2 LEU 37 HD23 LEU 37 -3.546 -3.743 -8.058 320 H LEU 38 H LEU 38 -4.169 -4.589 -3.926 321 HA LEU 38 HA LEU 38 -4.671 -6.470 -2.626 322 1HB LEU 38 HB2 LEU 38 -1.693 -6.609 -2.103 323 2HB LEU 38 HB3 LEU 38 -2.863 -7.922 -1.961 324 HG LEU 38 HG LEU 38 -2.285 -6.445 -4.543 325 1HD1 LEU 38 HD11 LEU 38 -0.482 -8.042 -3.337 326 2HD1 LEU 38 HD12 LEU 38 -1.459 -9.276 -4.133 327 3HD1 LEU 38 HD13 LEU 38 -0.691 -8.007 -5.088 328 1HD2 LEU 38 HD21 LEU 38 -4.244 -8.434 -3.664 329 2HD2 LEU 38 HD22 LEU 38 -4.221 -7.461 -5.134 330 3HD2 LEU 38 HD23 LEU 38 -3.320 -8.975 -5.065 331 H VAL 39 H VAL 39 -3.780 -3.608 -1.421 332 HA VAL 39 HA VAL 39 -4.327 -4.523 1.352 333 HB VAL 39 HB VAL 39 -2.508 -3.351 2.318 334 1HG1 VAL 39 HG11 VAL 39 -1.880 -5.469 1.147 335 2HG1 VAL 39 HG12 VAL 39 -1.432 -4.515 -0.268 336 3HG1 VAL 39 HG13 VAL 39 -0.547 -4.318 1.245 337 1HG2 VAL 39 HG21 VAL 39 -2.762 -1.310 0.901 338 2HG2 VAL 39 HG22 VAL 39 -1.078 -1.807 1.072 339 3HG2 VAL 39 HG23 VAL 39 -1.954 -2.158 -0.418 340 H ASP 40 H ASP 40 -4.760 -2.505 2.776 341 HA ASP 40 HA ASP 40 -5.612 -0.079 1.424 342 1HB ASP 40 HB2 ASP 40 -7.468 -1.560 0.768 343 2HB ASP 40 HB3 ASP 40 -7.737 -1.984 2.458 344 H THR 41 H THR 41 -5.278 1.479 2.927 345 HA THR 41 HA THR 41 -4.868 0.796 5.718 346 HB THR 41 HB THR 41 -4.552 3.231 6.017 347 HG1 THR 41 HG1 THR 41 -4.630 4.242 3.708 348 1HG2 THR 41 HG21 THR 41 -3.028 1.495 4.431 349 2HG2 THR 41 HG22 THR 41 -3.105 2.999 3.513 350 3HG2 THR 41 HG23 THR 41 -2.482 3.004 5.163 351 HA PRO 42 HA PRO 42 -9.007 1.355 7.138 352 1HB PRO 42 HB2 PRO 42 -8.445 1.727 9.785 353 2HB PRO 42 HB3 PRO 42 -8.308 0.153 8.983 354 1HG PRO 42 HG2 PRO 42 -6.155 2.033 9.825 355 2HG PRO 42 HG3 PRO 42 -6.124 0.267 9.703 356 1HD PRO 42 HD2 PRO 42 -5.030 2.058 7.827 357 2HD PRO 42 HD3 PRO 42 -5.356 0.333 7.547 358 H GLU 43 H GLU 43 -8.787 3.585 5.880 359 HA GLU 43 HA GLU 43 -9.918 5.636 7.476 360 1HB GLU 43 HB2 GLU 43 -7.203 5.456 7.972 361 2HB GLU 43 HB3 GLU 43 -7.291 6.721 6.745 362 1HG GLU 43 HG2 GLU 43 -9.400 7.349 8.423 363 2HG GLU 43 HG3 GLU 43 -8.161 6.781 9.543 364 H THR 44 H THR 44 -8.614 7.850 6.011 365 HA THR 44 HA THR 44 -9.062 9.010 4.016 366 HB THR 44 HB THR 44 -8.092 8.046 2.106 367 HG1 THR 44 HG1 THR 44 -8.256 5.417 2.954 368 1HG2 THR 44 HG21 THR 44 -6.713 7.916 4.376 369 2HG2 THR 44 HG22 THR 44 -6.809 6.184 4.061 370 3HG2 THR 44 HG23 THR 44 -6.062 7.256 2.875 371 H LYS 45 H LYS 45 -11.261 7.322 5.324 372 HA LYS 45 HA LYS 45 -12.936 6.682 2.963 373 1HB LYS 45 HB2 LYS 45 -13.227 6.225 5.934 374 2HB LYS 45 HB3 LYS 45 -14.586 6.001 4.832 375 1HG LYS 45 HG2 LYS 45 -13.741 4.071 4.001 376 2HG LYS 45 HG3 LYS 45 -12.109 4.733 3.895 377 1HD LYS 45 HD2 LYS 45 -11.546 4.063 6.033 378 2HD LYS 45 HD3 LYS 45 -13.210 4.160 6.614 379 1HE LYS 45 HE2 LYS 45 -13.765 2.063 5.800 380 2HE LYS 45 HE3 LYS 45 -12.556 2.127 4.518 381 1HZ LYS 45 HZ1 LYS 45 -11.934 1.879 7.410 382 2HZ LYS 45 HZ2 LYS 45 -11.977 0.578 6.319 383 3HZ LYS 45 HZ3 LYS 45 -10.827 1.813 6.127 384 H HIS 46 H HIS 46 -13.895 8.212 6.039 385 HA HIS 46 HA HIS 46 -15.818 9.899 4.732 386 1HB HIS 46 HB2 HIS 46 -14.665 9.727 7.500 387 2HB HIS 46 HB3 HIS 46 -15.661 11.111 7.056 388 HD1 HIS 46 HD1 HIS 46 -16.468 8.716 9.066 389 HD2 HIS 46 HD2 HIS 46 -17.759 9.197 5.132 390 HE1 HIS 46 HE1 HIS 46 -18.645 7.435 8.865 391 HA PRO 47 HA PRO 47 -12.804 12.986 3.497 392 1HB PRO 47 HB2 PRO 47 -14.560 14.460 2.011 393 2HB PRO 47 HB3 PRO 47 -13.852 12.939 1.441 394 1HG PRO 47 HG2 PRO 47 -16.610 13.480 2.419 395 2HG PRO 47 HG3 PRO 47 -16.044 12.269 1.258 396 1HD PRO 47 HD2 PRO 47 -16.687 11.794 3.967 397 2HD PRO 47 HD3 PRO 47 -15.812 10.685 2.889 398 H LYS 48 H LYS 48 -15.984 13.688 4.907 399 HA LYS 48 HA LYS 48 -15.732 16.433 5.428 400 1HB LYS 48 HB2 LYS 48 -16.971 14.268 7.151 401 2HB LYS 48 HB3 LYS 48 -17.196 15.997 7.420 402 1HG LYS 48 HG2 LYS 48 -18.419 16.279 5.444 403 2HG LYS 48 HG3 LYS 48 -17.760 14.817 4.712 404 1HD LYS 48 HD2 LYS 48 -19.221 14.311 7.208 405 2HD LYS 48 HD3 LYS 48 -20.228 15.000 5.934 406 1HE LYS 48 HE2 LYS 48 -18.866 13.172 4.483 407 2HE LYS 48 HE3 LYS 48 -18.866 12.361 6.050 408 1HZ LYS 48 HZ1 LYS 48 -21.397 13.244 5.866 409 2HZ LYS 48 HZ2 LYS 48 -21.056 12.885 4.245 410 3HZ LYS 48 HZ3 LYS 48 -20.889 11.682 5.432 411 H LYS 49 H LYS 49 -15.483 14.406 8.293 412 HA LYS 49 HA LYS 49 -13.112 16.005 9.107 413 1HB LYS 49 HB2 LYS 49 -15.410 15.165 10.478 414 2HB LYS 49 HB3 LYS 49 -14.113 14.149 11.108 415 1HG LYS 49 HG2 LYS 49 -13.407 15.878 12.360 416 2HG LYS 49 HG3 LYS 49 -13.057 16.773 10.881 417 1HD LYS 49 HD2 LYS 49 -15.196 17.795 10.859 418 2HD LYS 49 HD3 LYS 49 -15.848 16.642 12.025 419 1HE LYS 49 HE2 LYS 49 -15.457 18.428 13.440 420 2HE LYS 49 HE3 LYS 49 -13.891 17.625 13.546 421 1HZ LYS 49 HZ1 LYS 49 -13.392 19.105 11.471 422 2HZ LYS 49 HZ2 LYS 49 -14.635 20.071 12.113 423 3HZ LYS 49 HZ3 LYS 49 -13.253 19.741 13.041 424 H GLY 50 H GLY 50 -14.089 12.748 8.290 425 1HA GLY 50 HA2 GLY 50 -12.569 11.022 7.620 426 2HA GLY 50 HA3 GLY 50 -11.250 11.926 8.366 427 H VAL 51 H VAL 51 -11.069 9.430 9.067 428 HA VAL 51 HA VAL 51 -12.677 8.961 11.520 429 HB VAL 51 HB VAL 51 -10.617 7.052 10.443 430 1HG1 VAL 51 HG11 VAL 51 -12.675 7.064 12.452 431 2HG1 VAL 51 HG12 VAL 51 -13.064 5.847 11.237 432 3HG1 VAL 51 HG13 VAL 51 -11.514 5.791 12.076 433 1HG2 VAL 51 HG21 VAL 51 -13.425 7.504 9.385 434 2HG2 VAL 51 HG22 VAL 51 -11.921 7.677 8.481 435 3HG2 VAL 51 HG23 VAL 51 -12.447 6.083 9.023 436 H GLU 52 H GLU 52 -11.354 7.996 13.401 437 HA GLU 52 HA GLU 52 -8.777 9.497 13.650 438 1HB GLU 52 HB2 GLU 52 -9.287 9.806 16.025 439 2HB GLU 52 HB3 GLU 52 -10.607 10.450 15.048 440 1HG GLU 52 HG2 GLU 52 -11.950 8.482 15.434 441 2HG GLU 52 HG3 GLU 52 -10.601 7.652 16.209 442 H LYS 53 H LYS 53 -10.228 6.461 13.586 443 HA LYS 53 HA LYS 53 -8.533 5.143 15.553 444 1HB LYS 53 HB2 LYS 53 -10.606 4.352 13.600 445 2HB LYS 53 HB3 LYS 53 -9.361 3.136 13.890 446 1HG LYS 53 HG2 LYS 53 -11.129 2.779 15.503 447 2HG LYS 53 HG3 LYS 53 -9.741 3.447 16.362 448 1HD LYS 53 HD2 LYS 53 -10.779 5.735 16.078 449 2HD LYS 53 HD3 LYS 53 -12.224 4.930 15.467 450 1HE LYS 53 HE2 LYS 53 -12.883 4.333 17.543 451 2HE LYS 53 HE3 LYS 53 -11.278 3.733 17.953 452 1HZ LYS 53 HZ1 LYS 53 -12.050 6.599 17.934 453 2HZ LYS 53 HZ2 LYS 53 -11.981 5.633 19.325 454 3HZ LYS 53 HZ3 LYS 53 -10.564 5.953 18.446 455 H TYR 54 H TYR 54 -6.359 5.134 15.187 456 HA TYR 54 HA TYR 54 -4.322 5.051 13.995 457 1HB TYR 54 HB2 TYR 54 -5.646 2.826 12.445 458 2HB TYR 54 HB3 TYR 54 -3.970 2.945 12.985 459 HD1 TYR 54 HD1 TYR 54 -3.519 2.949 15.519 460 HD2 TYR 54 HD2 TYR 54 -7.265 1.754 13.788 461 HE1 TYR 54 HE1 TYR 54 -4.106 1.757 17.612 462 HE2 TYR 54 HE2 TYR 54 -7.852 0.561 15.881 463 HH TYR 54 HH TYR 54 -5.931 -0.448 18.022 464 H GLY 55 H GLY 55 -6.382 6.822 12.838 465 1HA GLY 55 HA2 GLY 55 -6.356 6.497 9.959 466 2HA GLY 55 HA3 GLY 55 -6.845 7.953 10.825 467 HA PRO 56 HA PRO 56 -2.924 9.855 10.139 468 1HB PRO 56 HB2 PRO 56 -2.112 10.713 12.603 469 2HB PRO 56 HB3 PRO 56 -3.481 11.428 11.735 470 1HG PRO 56 HG2 PRO 56 -3.492 9.553 14.055 471 2HG PRO 56 HG3 PRO 56 -4.646 10.828 13.631 472 1HD PRO 56 HD2 PRO 56 -5.029 8.088 13.185 473 2HD PRO 56 HD3 PRO 56 -5.936 9.395 12.393 474 H GLU 57 H GLU 57 -2.975 7.089 12.166 475 HA GLU 57 HA GLU 57 -0.136 6.936 12.731 476 1HB GLU 57 HB2 GLU 57 -2.452 5.480 13.447 477 2HB GLU 57 HB3 GLU 57 -1.393 4.338 12.617 478 1HG GLU 57 HG2 GLU 57 -0.604 4.206 14.814 479 2HG GLU 57 HG3 GLU 57 0.479 5.411 14.113 480 H ALA 58 H ALA 58 -2.252 5.349 10.319 481 HA ALA 58 HA ALA 58 -0.022 4.066 8.973 482 1HB ALA 58 HB1 ALA 58 -2.616 3.516 8.947 483 2HB ALA 58 HB2 ALA 58 -2.615 4.624 7.576 484 3HB ALA 58 HB3 ALA 58 -1.615 3.172 7.537 485 H SER 59 H SER 59 -2.118 6.844 8.146 486 HA SER 59 HA SER 59 -0.966 7.641 5.746 487 1HB SER 59 HB2 SER 59 -2.845 8.739 7.251 488 2HB SER 59 HB3 SER 59 -1.512 9.743 7.815 489 HG SER 59 HG SER 59 -1.091 9.970 5.430 490 H ALA 60 H ALA 60 0.135 8.643 9.005 491 HA ALA 60 HA ALA 60 2.496 9.967 7.981 492 1HB ALA 60 HB1 ALA 60 1.372 10.428 10.212 493 2HB ALA 60 HB2 ALA 60 2.071 8.915 10.789 494 3HB ALA 60 HB3 ALA 60 3.124 10.238 10.286 495 H PHE 61 H PHE 61 1.732 6.699 8.977 496 HA PHE 61 HA PHE 61 4.332 5.694 9.458 497 1HB PHE 61 HB2 PHE 61 2.239 4.408 9.845 498 2HB PHE 61 HB3 PHE 61 2.034 4.261 8.099 499 HD1 PHE 61 HD1 PHE 61 3.987 3.212 6.760 500 HD2 PHE 61 HD2 PHE 61 3.550 2.847 11.017 501 HE1 PHE 61 HE1 PHE 61 5.495 1.243 6.745 502 HE2 PHE 61 HE2 PHE 61 5.057 0.878 11.003 503 HZ PHE 61 HZ PHE 61 6.030 0.076 8.868 504 H THR 62 H THR 62 2.514 5.317 6.411 505 HA THR 62 HA THR 62 4.875 4.631 4.907 506 HB THR 62 HB THR 62 2.206 5.654 3.893 507 HG1 THR 62 HG1 THR 62 3.100 3.215 4.869 508 1HG2 THR 62 HG21 THR 62 4.510 4.187 2.595 509 2HG2 THR 62 HG22 THR 62 2.901 4.274 1.877 510 3HG2 THR 62 HG23 THR 62 3.832 5.750 2.138 511 H LYS 63 H LYS 63 3.408 7.650 5.811 512 HA LYS 63 HA LYS 63 4.422 9.310 3.725 513 1HB LYS 63 HB2 LYS 63 2.734 9.971 5.490 514 2HB LYS 63 HB3 LYS 63 4.080 10.111 6.623 515 1HG LYS 63 HG2 LYS 63 4.989 11.539 4.441 516 2HG LYS 63 HG3 LYS 63 3.267 11.920 4.457 517 1HD LYS 63 HD2 LYS 63 3.397 12.633 6.781 518 2HD LYS 63 HD3 LYS 63 5.087 12.137 6.870 519 1HE LYS 63 HE2 LYS 63 5.784 13.850 5.384 520 2HE LYS 63 HE3 LYS 63 4.134 14.164 4.845 521 1HZ LYS 63 HZ1 LYS 63 3.604 14.943 7.079 522 2HZ LYS 63 HZ2 LYS 63 5.209 14.675 7.566 523 3HZ LYS 63 HZ3 LYS 63 4.860 15.853 6.392 524 H LYS 64 H LYS 64 5.728 9.121 7.040 525 HA LYS 64 HA LYS 64 8.259 10.251 6.292 526 1HB LYS 64 HB2 LYS 64 7.620 8.516 8.698 527 2HB LYS 64 HB3 LYS 64 8.992 9.612 8.532 528 1HG LYS 64 HG2 LYS 64 7.700 11.498 8.818 529 2HG LYS 64 HG3 LYS 64 6.269 10.754 8.101 530 1HD LYS 64 HD2 LYS 64 5.732 10.901 10.397 531 2HD LYS 64 HD3 LYS 64 6.261 9.230 10.195 532 1HE LYS 64 HE2 LYS 64 8.525 10.963 10.725 533 2HE LYS 64 HE3 LYS 64 7.311 11.118 11.994 534 1HZ LYS 64 HZ1 LYS 64 7.409 8.445 11.510 535 2HZ LYS 64 HZ2 LYS 64 9.036 8.917 11.382 536 3HZ LYS 64 HZ3 LYS 64 8.162 9.246 12.802 537 H MET 65 H MET 65 6.984 7.025 6.126 538 HA MET 65 HA MET 65 9.451 5.573 6.189 539 1HB MET 65 HB2 MET 65 7.031 4.667 6.278 540 2HB MET 65 HB3 MET 65 7.073 4.766 4.518 541 1HG MET 65 HG2 MET 65 7.752 2.530 5.175 542 2HG MET 65 HG3 MET 65 9.165 3.380 4.551 543 1HE MET 65 HE1 MET 65 8.069 1.040 6.610 544 2HE MET 65 HE2 MET 65 9.803 0.779 6.456 545 3HE MET 65 HE3 MET 65 9.074 0.973 8.055 546 H VAL 66 H VAL 66 7.480 6.067 3.259 547 HA VAL 66 HA VAL 66 9.678 5.677 1.480 548 HB VAL 66 HB VAL 66 8.136 6.880 -0.185 549 1HG1 VAL 66 HG11 VAL 66 7.773 4.352 1.256 550 2HG1 VAL 66 HG12 VAL 66 6.285 4.942 0.516 551 3HG1 VAL 66 HG13 VAL 66 7.717 4.674 -0.477 552 1HG2 VAL 66 HG21 VAL 66 6.950 7.746 2.214 553 2HG2 VAL 66 HG22 VAL 66 6.313 7.968 0.585 554 3HG2 VAL 66 HG23 VAL 66 5.821 6.570 1.542 555 H GLU 67 H GLU 67 8.488 8.499 3.180 556 HA GLU 67 HA GLU 67 9.766 10.522 1.632 557 1HB GLU 67 HB2 GLU 67 8.817 10.296 4.463 558 2HB GLU 67 HB3 GLU 67 9.860 11.653 4.035 559 1HG GLU 67 HG2 GLU 67 7.730 11.172 2.074 560 2HG GLU 67 HG3 GLU 67 7.120 11.581 3.678 561 H ASN 68 H ASN 68 10.977 8.333 4.107 562 HA ASN 68 HA ASN 68 13.601 9.690 4.143 563 1HB ASN 68 HB2 ASN 68 12.240 7.607 5.760 564 2HB ASN 68 HB3 ASN 68 13.986 7.428 5.593 565 1HD2 ASN 68 HD21 ASN 68 11.584 10.037 6.296 566 2HD2 ASN 68 HD22 ASN 68 12.555 10.815 7.451 567 H ALA 69 H ALA 69 12.020 7.104 2.499 568 HA ALA 69 HA ALA 69 14.299 5.468 1.903 569 1HB ALA 69 HB1 ALA 69 11.881 4.831 1.539 570 2HB ALA 69 HB2 ALA 69 11.870 5.910 0.144 571 3HB ALA 69 HB3 ALA 69 12.931 4.502 0.161 572 H LYS 70 H LYS 70 16.089 6.232 0.888 573 HA LYS 70 HA LYS 70 16.075 8.613 -0.746 574 1HB LYS 70 HB2 LYS 70 18.205 6.458 -0.649 575 2HB LYS 70 HB3 LYS 70 18.415 8.143 -1.124 576 1HG LYS 70 HG2 LYS 70 18.112 8.929 1.083 577 2HG LYS 70 HG3 LYS 70 17.379 7.415 1.612 578 1HD LYS 70 HD2 LYS 70 19.407 6.341 1.822 579 2HD LYS 70 HD3 LYS 70 20.162 7.294 0.543 580 1HE LYS 70 HE2 LYS 70 20.358 9.215 1.991 581 2HE LYS 70 HE3 LYS 70 19.399 8.429 3.246 582 1HZ LYS 70 HZ1 LYS 70 21.945 7.304 2.240 583 2HZ LYS 70 HZ2 LYS 70 21.875 8.373 3.558 584 3HZ LYS 70 HZ3 LYS 70 21.093 6.866 3.639 585 H LYS 71 H LYS 71 15.214 5.385 -1.390 586 HA LYS 71 HA LYS 71 15.321 5.967 -4.317 587 1HB LYS 71 HB2 LYS 71 15.886 3.258 -3.079 588 2HB LYS 71 HB3 LYS 71 15.993 3.687 -4.787 589 1HG LYS 71 HG2 LYS 71 17.844 5.180 -4.370 590 2HG LYS 71 HG3 LYS 71 17.659 5.000 -2.625 591 1HD LYS 71 HD2 LYS 71 17.964 2.440 -4.033 592 2HD LYS 71 HD3 LYS 71 19.363 3.503 -4.197 593 1HE LYS 71 HE2 LYS 71 18.791 3.803 -1.543 594 2HE LYS 71 HE3 LYS 71 18.317 2.124 -1.803 595 1HZ LYS 71 HZ1 LYS 71 20.698 2.464 -3.153 596 2HZ LYS 71 HZ2 LYS 71 20.915 3.243 -1.660 597 3HZ LYS 71 HZ3 LYS 71 20.455 1.608 -1.711 598 H ILE 72 H ILE 72 13.401 5.604 -5.325 599 HA ILE 72 HA ILE 72 11.363 3.954 -3.885 600 HB ILE 72 HB ILE 72 10.943 6.528 -5.437 601 1HG1 ILE 72 HG12 ILE 72 9.814 6.626 -2.853 602 2HG1 ILE 72 HG13 ILE 72 11.413 5.912 -2.644 603 1HG2 ILE 72 HG21 ILE 72 9.160 4.761 -5.747 604 2HG2 ILE 72 HG22 ILE 72 8.889 4.820 -4.006 605 3HG2 ILE 72 HG23 ILE 72 8.587 6.249 -4.994 606 1HD1 ILE 72 HD11 ILE 72 11.819 7.985 -4.474 607 2HD1 ILE 72 HD12 ILE 72 10.694 8.659 -3.294 608 3HD1 ILE 72 HD13 ILE 72 12.244 8.006 -2.763 609 H GLU 73 H GLU 73 11.028 2.155 -5.111 610 HA GLU 73 HA GLU 73 11.027 2.492 -8.086 611 1HB GLU 73 HB2 GLU 73 12.409 0.579 -6.342 612 2HB GLU 73 HB3 GLU 73 11.490 -0.198 -7.632 613 1HG GLU 73 HG2 GLU 73 13.293 0.249 -8.934 614 2HG GLU 73 HG3 GLU 73 12.686 1.904 -8.954 615 H VAL 74 H VAL 74 9.138 1.939 -9.064 616 HA VAL 74 HA VAL 74 7.037 0.648 -7.409 617 HB VAL 74 HB VAL 74 5.503 1.367 -9.215 618 1HG1 VAL 74 HG11 VAL 74 7.316 3.246 -7.785 619 2HG1 VAL 74 HG12 VAL 74 6.309 3.936 -9.058 620 3HG1 VAL 74 HG13 VAL 74 5.561 3.094 -7.702 621 1HG2 VAL 74 HG21 VAL 74 7.901 1.430 -10.715 622 2HG2 VAL 74 HG22 VAL 74 6.282 1.852 -11.274 623 3HG2 VAL 74 HG23 VAL 74 7.341 3.100 -10.619 624 H GLU 75 H GLU 75 5.682 -1.051 -8.540 625 HA GLU 75 HA GLU 75 7.197 -2.554 -10.614 626 1HB GLU 75 HB2 GLU 75 7.849 -3.538 -8.457 627 2HB GLU 75 HB3 GLU 75 6.150 -3.753 -8.032 628 1HG GLU 75 HG2 GLU 75 5.830 -5.287 -9.896 629 2HG GLU 75 HG3 GLU 75 7.478 -5.001 -10.456 630 H PHE 76 H PHE 76 5.502 -1.886 -12.065 631 HA PHE 76 HA PHE 76 2.724 -2.181 -11.606 632 1HB PHE 76 HB2 PHE 76 4.347 -2.396 -14.155 633 2HB PHE 76 HB3 PHE 76 2.583 -2.407 -14.132 634 HD1 PHE 76 HD1 PHE 76 1.414 -0.446 -12.878 635 HD2 PHE 76 HD2 PHE 76 5.503 -0.352 -14.190 636 HE1 PHE 76 HE1 PHE 76 1.397 2.031 -12.754 637 HE2 PHE 76 HE2 PHE 76 5.486 2.125 -14.066 638 HZ PHE 76 HZ PHE 76 3.433 3.316 -13.348 639 H ASP 77 H ASP 77 1.367 -3.949 -11.644 640 HA ASP 77 HA ASP 77 2.604 -6.599 -11.603 641 1HB ASP 77 HB2 ASP 77 0.486 -5.604 -10.290 642 2HB ASP 77 HB3 ASP 77 -0.361 -6.287 -11.678 643 H LYS 78 H LYS 78 0.947 -8.301 -12.834 644 HA LYS 78 HA LYS 78 1.432 -7.747 -15.671 645 1HB LYS 78 HB2 LYS 78 0.591 -10.047 -16.008 646 2HB LYS 78 HB3 LYS 78 1.825 -10.003 -14.748 647 1HG LYS 78 HG2 LYS 78 -0.411 -9.559 -13.262 648 2HG LYS 78 HG3 LYS 78 -1.068 -10.590 -14.534 649 1HD LYS 78 HD2 LYS 78 1.071 -12.050 -14.059 650 2HD LYS 78 HD3 LYS 78 1.060 -11.209 -12.508 651 1HE LYS 78 HE2 LYS 78 -0.408 -12.811 -11.858 652 2HE LYS 78 HE3 LYS 78 -1.589 -11.910 -12.809 653 1HZ LYS 78 HZ1 LYS 78 0.121 -14.105 -13.848 654 2HZ LYS 78 HZ2 LYS 78 -1.513 -14.264 -13.411 655 3HZ LYS 78 HZ3 LYS 78 -1.072 -13.269 -14.716 656 H GLY 79 H GLY 79 -1.233 -7.583 -13.446 657 1HA GLY 79 HA2 GLY 79 -3.341 -7.732 -15.428 658 2HA GLY 79 HA3 GLY 79 -3.516 -7.116 -13.783 659 H GLN 80 H GLN 80 -4.716 -5.272 -14.452 660 HA GLN 80 HA GLN 80 -3.839 -3.477 -16.519 661 1HB GLN 80 HB2 GLN 80 -5.583 -2.880 -14.109 662 2HB GLN 80 HB3 GLN 80 -5.476 -1.915 -15.581 663 1HG GLN 80 HG2 GLN 80 -6.339 -3.793 -16.903 664 2HG GLN 80 HG3 GLN 80 -6.406 -4.798 -15.454 665 1HE2 GLN 80 HE21 GLN 80 -8.811 -4.930 -15.917 666 2HE2 GLN 80 HE22 GLN 80 -9.807 -3.651 -15.413 667 H ARG 81 H ARG 81 -3.105 -1.207 -16.090 668 HA ARG 81 HA ARG 81 -1.170 -1.164 -13.812 669 1HB ARG 81 HB2 ARG 81 -1.045 -0.236 -16.632 670 2HB ARG 81 HB3 ARG 81 -0.303 0.827 -15.435 671 1HG ARG 81 HG2 ARG 81 1.464 -0.615 -15.982 672 2HG ARG 81 HG3 ARG 81 0.794 -1.370 -14.534 673 1HD ARG 81 HD2 ARG 81 -0.239 -3.083 -15.742 674 2HD ARG 81 HD3 ARG 81 -0.262 -2.148 -17.237 675 HE ARG 81 HE ARG 81 1.741 -3.981 -16.647 676 1HH1 ARG 81 HH11 ARG 81 1.287 -0.959 -18.101 677 2HH1 ARG 81 HH12 ARG 81 2.971 -0.658 -18.378 678 1HH2 ARG 81 HH21 ARG 81 4.032 -3.443 -16.604 679 2HH2 ARG 81 HH22 ARG 81 4.524 -2.063 -17.529 680 H THR 82 H THR 82 -4.061 0.152 -14.946 681 HA THR 82 HA THR 82 -3.880 2.338 -12.940 682 HB THR 82 HB THR 82 -5.277 3.671 -14.770 683 HG1 THR 82 HG1 THR 82 -5.163 2.799 -16.657 684 1HG2 THR 82 HG21 THR 82 -2.828 3.943 -13.706 685 2HG2 THR 82 HG22 THR 82 -2.363 3.596 -15.371 686 3HG2 THR 82 HG23 THR 82 -3.403 4.975 -15.016 687 H ASP 83 H ASP 83 -6.082 3.106 -12.311 688 HA ASP 83 HA ASP 83 -8.087 0.926 -12.719 689 1HB ASP 83 HB2 ASP 83 -7.102 1.731 -10.351 690 2HB ASP 83 HB3 ASP 83 -8.425 2.883 -10.503 691 H LYS 84 H LYS 84 -10.332 2.245 -11.809 692 HA LYS 84 HA LYS 84 -11.022 3.846 -14.140 693 1HB LYS 84 HB2 LYS 84 -13.244 3.997 -13.096 694 2HB LYS 84 HB3 LYS 84 -12.656 2.335 -13.044 695 1HG LYS 84 HG2 LYS 84 -11.845 2.729 -10.719 696 2HG LYS 84 HG3 LYS 84 -12.552 4.345 -10.777 697 1HD LYS 84 HD2 LYS 84 -14.572 3.516 -10.246 698 2HD LYS 84 HD3 LYS 84 -14.517 2.432 -11.637 699 1HE LYS 84 HE2 LYS 84 -13.366 0.740 -10.373 700 2HE LYS 84 HE3 LYS 84 -13.117 1.842 -9.018 701 1HZ LYS 84 HZ1 LYS 84 -15.691 1.995 -9.088 702 2HZ LYS 84 HZ2 LYS 84 -15.583 0.512 -9.903 703 3HZ LYS 84 HZ3 LYS 84 -14.945 0.666 -8.336 704 H TYR 85 H TYR 85 -9.684 4.532 -11.066 705 HA TYR 85 HA TYR 85 -10.702 7.298 -11.001 706 1HB TYR 85 HB2 TYR 85 -8.850 5.708 -9.215 707 2HB TYR 85 HB3 TYR 85 -9.121 7.437 -8.989 708 HD1 TYR 85 HD1 TYR 85 -11.000 4.221 -9.415 709 HD2 TYR 85 HD2 TYR 85 -10.945 8.166 -7.716 710 HE1 TYR 85 HE1 TYR 85 -13.123 3.738 -8.228 711 HE2 TYR 85 HE2 TYR 85 -13.069 7.683 -6.528 712 HH TYR 85 HH TYR 85 -14.377 5.833 -5.780 713 H GLY 86 H GLY 86 -8.413 5.772 -12.794 714 1HA GLY 86 HA2 GLY 86 -6.712 6.672 -14.151 715 2HA GLY 86 HA3 GLY 86 -7.101 8.263 -13.495 716 H ARG 87 H ARG 87 -6.403 5.683 -11.271 717 HA ARG 87 HA ARG 87 -3.848 7.069 -10.606 718 1HB ARG 87 HB2 ARG 87 -4.223 5.328 -8.542 719 2HB ARG 87 HB3 ARG 87 -4.828 6.982 -8.547 720 1HG ARG 87 HG2 ARG 87 -6.986 6.205 -9.434 721 2HG ARG 87 HG3 ARG 87 -6.385 4.548 -9.472 722 1HD ARG 87 HD2 ARG 87 -7.262 4.388 -7.384 723 2HD ARG 87 HD3 ARG 87 -5.835 5.294 -6.880 724 HE ARG 87 HE ARG 87 -7.435 7.348 -7.434 725 1HH1 ARG 87 HH11 ARG 87 -9.455 4.848 -7.346 726 2HH1 ARG 87 HH12 ARG 87 -10.233 5.213 -5.842 727 1HH2 ARG 87 HH21 ARG 87 -7.897 7.597 -4.905 728 2HH2 ARG 87 HH22 ARG 87 -9.350 6.766 -4.461 729 H GLY 88 H GLY 88 -1.970 5.716 -10.105 730 1HA GLY 88 HA2 GLY 88 -1.848 3.386 -11.910 731 2HA GLY 88 HA3 GLY 88 -0.472 4.150 -11.111 732 H LEU 89 H LEU 89 -1.653 1.278 -11.218 733 HA LEU 89 HA LEU 89 -1.670 0.840 -8.259 734 1HB LEU 89 HB2 LEU 89 -2.776 -1.057 -10.343 735 2HB LEU 89 HB3 LEU 89 -3.050 -1.081 -8.600 736 HG LEU 89 HG LEU 89 -3.929 1.167 -10.431 737 1HD1 LEU 89 HD11 LEU 89 -5.023 -1.360 -10.322 738 2HD1 LEU 89 HD12 LEU 89 -5.970 -0.491 -9.113 739 3HD1 LEU 89 HD13 LEU 89 -5.903 0.101 -10.773 740 1HD2 LEU 89 HD21 LEU 89 -4.264 0.545 -7.496 741 2HD2 LEU 89 HD22 LEU 89 -3.669 2.030 -8.239 742 3HD2 LEU 89 HD23 LEU 89 -5.382 1.617 -8.339 743 H ALA 90 H ALA 90 0.167 -0.108 -7.538 744 HA ALA 90 HA ALA 90 1.350 -2.389 -8.853 745 1HB ALA 90 HB1 ALA 90 2.123 -0.446 -10.306 746 2HB ALA 90 HB2 ALA 90 3.030 0.129 -8.907 747 3HB ALA 90 HB3 ALA 90 3.413 -1.436 -9.622 748 H TYR 91 H TYR 91 3.597 -2.841 -7.740 749 HA TYR 91 HA TYR 91 3.148 -2.488 -4.847 750 1HB TYR 91 HB2 TYR 91 5.359 -3.990 -6.284 751 2HB TYR 91 HB3 TYR 91 4.934 -4.125 -4.577 752 HD1 TYR 91 HD1 TYR 91 2.645 -5.007 -3.941 753 HD2 TYR 91 HD2 TYR 91 4.183 -5.220 -7.945 754 HE1 TYR 91 HE1 TYR 91 0.957 -6.737 -4.496 755 HE2 TYR 91 HE2 TYR 91 2.497 -6.952 -8.501 756 HH TYR 91 HH TYR 91 -0.164 -7.480 -6.970 757 H ILE 92 H ILE 92 4.205 -0.976 -3.649 758 HA ILE 92 HA ILE 92 6.357 0.589 -4.980 759 HB ILE 92 HB ILE 92 4.878 1.175 -2.396 760 1HG1 ILE 92 HG12 ILE 92 4.403 2.248 -5.197 761 2HG1 ILE 92 HG13 ILE 92 3.361 1.091 -4.367 762 1HG2 ILE 92 HG21 ILE 92 6.969 2.546 -4.018 763 2HG2 ILE 92 HG22 ILE 92 5.702 3.559 -3.327 764 3HG2 ILE 92 HG23 ILE 92 6.708 2.564 -2.274 765 1HD1 ILE 92 HD11 ILE 92 3.647 3.133 -2.510 766 2HD1 ILE 92 HD12 ILE 92 3.540 3.995 -4.045 767 3HD1 ILE 92 HD13 ILE 92 2.253 2.890 -3.562 768 H TYR 93 H TYR 93 8.450 0.360 -4.331 769 HA TYR 93 HA TYR 93 8.942 -1.096 -1.762 770 1HB TYR 93 HB2 TYR 93 10.548 -1.171 -4.334 771 2HB TYR 93 HB3 TYR 93 11.017 -1.963 -2.830 772 HD1 TYR 93 HD1 TYR 93 8.644 -1.978 -5.649 773 HD2 TYR 93 HD2 TYR 93 9.811 -3.917 -1.997 774 HE1 TYR 93 HE1 TYR 93 7.228 -3.929 -6.231 775 HE2 TYR 93 HE2 TYR 93 8.394 -5.868 -2.581 776 HH TYR 93 HH TYR 93 7.509 -6.823 -5.046 777 H ALA 94 H ALA 94 10.251 -0.059 -0.316 778 HA ALA 94 HA ALA 94 11.782 2.314 -1.302 779 1HB ALA 94 HB1 ALA 94 9.740 2.115 0.765 780 2HB ALA 94 HB2 ALA 94 11.256 2.740 1.415 781 3HB ALA 94 HB3 ALA 94 10.475 3.555 0.059 782 H ASP 95 H ASP 95 13.931 2.220 -0.834 783 HA ASP 95 HA ASP 95 15.941 1.580 0.193 784 1HB ASP 95 HB2 ASP 95 14.201 0.442 2.398 785 2HB ASP 95 HB3 ASP 95 15.902 0.893 2.506 786 H GLY 96 H GLY 96 13.910 -0.342 -1.298 787 1HA GLY 96 HA2 GLY 96 14.491 -2.433 -2.317 788 2HA GLY 96 HA3 GLY 96 15.701 -2.683 -1.057 789 H LYS 97 H LYS 97 12.876 -1.650 0.396 790 HA LYS 97 HA LYS 97 12.105 -4.478 0.989 791 1HB LYS 97 HB2 LYS 97 12.988 -2.820 2.831 792 2HB LYS 97 HB3 LYS 97 11.356 -2.157 2.746 793 1HG LYS 97 HG2 LYS 97 10.997 -3.788 4.336 794 2HG LYS 97 HG3 LYS 97 10.708 -4.749 2.887 795 1HD LYS 97 HD2 LYS 97 13.297 -5.173 2.980 796 2HD LYS 97 HD3 LYS 97 13.124 -4.703 4.671 797 1HE LYS 97 HE2 LYS 97 11.398 -6.821 3.370 798 2HE LYS 97 HE3 LYS 97 12.897 -7.193 4.223 799 1HZ LYS 97 HZ1 LYS 97 11.857 -5.833 6.109 800 2HZ LYS 97 HZ2 LYS 97 10.388 -6.073 5.296 801 3HZ LYS 97 HZ3 LYS 97 11.282 -7.409 5.845 802 H MET 98 H MET 98 9.785 -4.885 1.264 803 HA MET 98 HA MET 98 8.192 -3.365 -0.671 804 1HB MET 98 HB2 MET 98 8.030 -5.852 -0.470 805 2HB MET 98 HB3 MET 98 7.349 -5.644 1.145 806 1HG MET 98 HG2 MET 98 5.495 -4.315 0.183 807 2HG MET 98 HG3 MET 98 6.163 -4.565 -1.430 808 1HE MET 98 HE1 MET 98 6.601 -6.589 -2.498 809 2HE MET 98 HE2 MET 98 7.157 -7.750 -1.295 810 3HE MET 98 HE3 MET 98 5.755 -8.128 -2.292 811 H VAL 99 H VAL 99 6.955 -1.638 -0.121 812 HA VAL 99 HA VAL 99 6.720 -0.743 2.606 813 HB VAL 99 HB VAL 99 5.155 0.091 0.143 814 1HG1 VAL 99 HG11 VAL 99 4.887 0.774 2.928 815 2HG1 VAL 99 HG12 VAL 99 5.442 2.188 2.032 816 3HG1 VAL 99 HG13 VAL 99 3.955 1.370 1.554 817 1HG2 VAL 99 HG21 VAL 99 7.890 0.467 0.907 818 2HG2 VAL 99 HG22 VAL 99 7.047 1.138 -0.489 819 3HG2 VAL 99 HG23 VAL 99 7.064 2.020 1.037 820 H ASN 100 H ASN 100 4.445 -2.326 0.361 821 HA ASN 100 HA ASN 100 2.156 -2.300 2.021 822 1HB ASN 100 HB2 ASN 100 3.046 -4.501 0.128 823 2HB ASN 100 HB3 ASN 100 1.406 -4.258 0.731 824 1HD2 ASN 100 HD21 ASN 100 0.883 -4.013 -1.678 825 2HD2 ASN 100 HD22 ASN 100 1.104 -2.487 -2.388 826 H GLU 101 H GLU 101 4.922 -4.528 1.975 827 HA GLU 101 HA GLU 101 3.828 -6.330 3.948 828 1HB GLU 101 HB2 GLU 101 5.709 -6.903 2.388 829 2HB GLU 101 HB3 GLU 101 6.746 -5.810 3.308 830 1HG GLU 101 HG2 GLU 101 5.779 -7.269 5.347 831 2HG GLU 101 HG3 GLU 101 5.656 -8.477 4.068 832 H ALA 102 H ALA 102 5.693 -3.350 4.103 833 HA ALA 102 HA ALA 102 6.454 -3.546 6.862 834 1HB ALA 102 HB1 ALA 102 7.397 -1.918 5.168 835 2HB ALA 102 HB2 ALA 102 5.898 -0.999 5.319 836 3HB ALA 102 HB3 ALA 102 6.958 -1.192 6.715 837 H LEU 103 H LEU 103 3.647 -2.076 5.252 838 HA LEU 103 HA LEU 103 2.434 -1.009 7.607 839 1HB LEU 103 HB2 LEU 103 1.225 -1.973 5.000 840 2HB LEU 103 HB3 LEU 103 0.305 -1.138 6.252 841 HG LEU 103 HG LEU 103 2.837 0.174 5.458 842 1HD1 LEU 103 HD11 LEU 103 1.004 -0.730 3.450 843 2HD1 LEU 103 HD12 LEU 103 0.870 1.024 3.575 844 3HD1 LEU 103 HD13 LEU 103 2.435 0.280 3.246 845 1HD2 LEU 103 HD21 LEU 103 -0.029 1.050 5.929 846 2HD2 LEU 103 HD22 LEU 103 1.331 1.236 7.036 847 3HD2 LEU 103 HD23 LEU 103 1.285 2.158 5.534 848 H VAL 104 H VAL 104 2.050 -4.168 5.992 849 HA VAL 104 HA VAL 104 0.068 -5.190 7.779 850 HB VAL 104 HB VAL 104 2.188 -6.630 6.157 851 1HG1 VAL 104 HG11 VAL 104 -0.245 -7.656 7.645 852 2HG1 VAL 104 HG12 VAL 104 0.630 -8.593 6.434 853 3HG1 VAL 104 HG13 VAL 104 1.438 -8.103 7.923 854 1HG2 VAL 104 HG21 VAL 104 -0.610 -5.665 5.655 855 2HG2 VAL 104 HG22 VAL 104 0.794 -5.621 4.588 856 3HG2 VAL 104 HG23 VAL 104 -0.061 -7.139 4.857 857 H ARG 105 H ARG 105 3.606 -5.141 7.933 858 HA ARG 105 HA ARG 105 3.824 -6.878 10.220 859 1HB ARG 105 HB2 ARG 105 5.605 -5.599 8.494 860 2HB ARG 105 HB3 ARG 105 5.904 -4.837 10.057 861 1HG ARG 105 HG2 ARG 105 5.677 -7.486 10.756 862 2HG ARG 105 HG3 ARG 105 6.458 -7.592 9.178 863 1HD ARG 105 HD2 ARG 105 8.409 -7.020 10.138 864 2HD ARG 105 HD3 ARG 105 7.711 -5.458 10.567 865 HE ARG 105 HE ARG 105 6.774 -6.956 12.597 866 1HH1 ARG 105 HH11 ARG 105 9.833 -6.001 11.506 867 2HH1 ARG 105 HH12 ARG 105 10.717 -6.869 12.717 868 1HH2 ARG 105 HH21 ARG 105 7.915 -8.474 13.986 869 2HH2 ARG 105 HH22 ARG 105 9.630 -8.268 14.124 870 H GLN 106 H GLN 106 3.165 -3.455 9.829 871 HA GLN 106 HA GLN 106 3.428 -3.023 12.754 872 1HB GLN 106 HB2 GLN 106 4.047 -1.398 10.644 873 2HB GLN 106 HB3 GLN 106 2.434 -0.815 11.058 874 1HG GLN 106 HG2 GLN 106 3.681 0.464 12.522 875 2HG GLN 106 HG3 GLN 106 3.416 -0.956 13.533 876 1HE2 GLN 106 HE21 GLN 106 5.779 0.987 13.410 877 2HE2 GLN 106 HE22 GLN 106 7.134 -0.009 13.183 878 H GLY 107 H GLY 107 1.201 -4.507 11.104 879 1HA GLY 107 HA2 GLY 107 -1.152 -4.652 11.150 880 2HA GLY 107 HA3 GLY 107 -0.934 -4.222 12.846 881 H LEU 108 H LEU 108 -0.483 -2.359 9.821 882 HA LEU 108 HA LEU 108 -2.288 -0.290 11.011 883 1HB LEU 108 HB2 LEU 108 0.157 -0.070 9.258 884 2HB LEU 108 HB3 LEU 108 -1.023 1.240 9.339 885 HG LEU 108 HG LEU 108 0.195 0.020 11.822 886 1HD1 LEU 108 HD11 LEU 108 1.910 1.009 10.193 887 2HD1 LEU 108 HD12 LEU 108 1.128 2.564 10.482 888 3HD1 LEU 108 HD13 LEU 108 1.887 1.697 11.817 889 1HD2 LEU 108 HD21 LEU 108 -1.884 1.868 11.331 890 2HD2 LEU 108 HD22 LEU 108 -1.136 1.496 12.885 891 3HD2 LEU 108 HD23 LEU 108 -0.515 2.823 11.902 892 H ALA 109 H ALA 109 -1.605 -2.289 8.227 893 HA ALA 109 HA ALA 109 -4.074 -1.192 6.943 894 1HB ALA 109 HB1 ALA 109 -1.504 -2.096 5.610 895 2HB ALA 109 HB2 ALA 109 -2.997 -1.743 4.741 896 3HB ALA 109 HB3 ALA 109 -2.168 -0.462 5.626 897 H LYS 110 H LYS 110 -5.035 -2.852 5.377 898 HA LYS 110 HA LYS 110 -4.567 -5.628 6.393 899 1HB LYS 110 HB2 LYS 110 -7.208 -4.261 5.795 900 2HB LYS 110 HB3 LYS 110 -7.037 -5.991 6.104 901 1HG LYS 110 HG2 LYS 110 -7.201 -5.540 8.303 902 2HG LYS 110 HG3 LYS 110 -5.642 -4.723 8.191 903 1HD LYS 110 HD2 LYS 110 -6.741 -2.838 8.784 904 2HD LYS 110 HD3 LYS 110 -7.422 -2.857 7.156 905 1HE LYS 110 HE2 LYS 110 -8.931 -4.709 8.676 906 2HE LYS 110 HE3 LYS 110 -8.769 -3.261 9.669 907 1HZ LYS 110 HZ1 LYS 110 -9.463 -1.966 7.682 908 2HZ LYS 110 HZ2 LYS 110 -9.807 -3.433 6.896 909 3HZ LYS 110 HZ3 LYS 110 -10.667 -2.992 8.293 910 H VAL 111 H VAL 111 -5.420 -7.293 4.799 911 HA VAL 111 HA VAL 111 -4.622 -6.474 2.072 912 HB VAL 111 HB VAL 111 -5.201 -9.165 3.337 913 1HG1 VAL 111 HG11 VAL 111 -4.804 -8.347 0.485 914 2HG1 VAL 111 HG12 VAL 111 -4.092 -9.866 1.028 915 3HG1 VAL 111 HG13 VAL 111 -5.834 -9.614 1.153 916 1HG2 VAL 111 HG21 VAL 111 -2.751 -7.609 2.558 917 2HG2 VAL 111 HG22 VAL 111 -3.065 -8.526 4.031 918 3HG2 VAL 111 HG23 VAL 111 -2.699 -9.372 2.526 919 H ALA 112 H ALA 112 -6.116 -6.103 0.477 920 HA ALA 112 HA ALA 112 -8.650 -7.496 0.363 921 1HB ALA 112 HB1 ALA 112 -8.645 -4.601 1.256 922 2HB ALA 112 HB2 ALA 112 -10.075 -5.451 0.673 923 3HB ALA 112 HB3 ALA 112 -9.276 -5.983 2.152 924 H TYR 113 H TYR 113 -10.136 -6.072 -1.286 925 HA TYR 113 HA TYR 113 -10.320 -5.328 -3.501 926 1HB TYR 113 HB2 TYR 113 -7.789 -3.958 -2.589 927 2HB TYR 113 HB3 TYR 113 -8.393 -3.766 -4.235 928 HD1 TYR 113 HD1 TYR 113 -11.287 -3.738 -3.915 929 HD2 TYR 113 HD2 TYR 113 -8.254 -1.961 -1.446 930 HE1 TYR 113 HE1 TYR 113 -12.921 -2.050 -3.121 931 HE2 TYR 113 HE2 TYR 113 -9.888 -0.274 -0.652 932 HH TYR 113 HH TYR 113 -12.980 -0.528 -0.735 933 H VAL 114 H VAL 114 -9.904 -7.748 -3.869 934 HA VAL 114 HA VAL 114 -7.270 -8.220 -5.182 935 HB VAL 114 HB VAL 114 -9.368 -10.313 -4.628 936 1HG1 VAL 114 HG11 VAL 114 -6.366 -10.280 -5.012 937 2HG1 VAL 114 HG12 VAL 114 -7.231 -11.688 -4.395 938 3HG1 VAL 114 HG13 VAL 114 -7.574 -11.084 -6.015 939 1HG2 VAL 114 HG21 VAL 114 -7.570 -8.882 -2.726 940 2HG2 VAL 114 HG22 VAL 114 -9.152 -9.611 -2.444 941 3HG2 VAL 114 HG23 VAL 114 -7.715 -10.630 -2.539 942 H TYR 115 H TYR 115 -7.509 -7.447 -7.278 943 HA TYR 115 HA TYR 115 -9.892 -8.427 -8.797 944 1HB TYR 115 HB2 TYR 115 -8.094 -6.054 -9.380 945 2HB TYR 115 HB3 TYR 115 -9.499 -6.539 -10.330 946 HD1 TYR 115 HD1 TYR 115 -11.787 -6.481 -9.295 947 HD2 TYR 115 HD2 TYR 115 -8.334 -4.840 -7.336 948 HE1 TYR 115 HE1 TYR 115 -13.262 -5.197 -7.770 949 HE2 TYR 115 HE2 TYR 115 -9.810 -3.556 -5.811 950 HH TYR 115 HH TYR 115 -13.081 -3.093 -6.382 951 H LYS 116 H LYS 116 -8.727 -10.478 -9.138 952 HA LYS 116 HA LYS 116 -6.216 -10.879 -10.250 953 1HB LYS 116 HB2 LYS 116 -8.812 -12.269 -10.989 954 2HB LYS 116 HB3 LYS 116 -7.206 -12.885 -11.373 955 1HG LYS 116 HG2 LYS 116 -6.909 -12.410 -8.718 956 2HG LYS 116 HG3 LYS 116 -8.626 -12.806 -8.772 957 1HD LYS 116 HD2 LYS 116 -7.393 -14.862 -8.427 958 2HD LYS 116 HD3 LYS 116 -8.037 -14.879 -10.069 959 1HE LYS 116 HE2 LYS 116 -5.971 -14.889 -10.984 960 2HE LYS 116 HE3 LYS 116 -5.409 -13.604 -9.914 961 1HZ LYS 116 HZ1 LYS 116 -5.841 -16.257 -8.763 962 2HZ LYS 116 HZ2 LYS 116 -4.475 -16.038 -9.745 963 3HZ LYS 116 HZ3 LYS 116 -4.689 -15.075 -8.363 964 HA PRO 117 HA PRO 117 -5.529 -12.381 -11.898 965 1HB PRO 117 HB2 PRO 117 -3.432 -12.033 -13.606 966 2HB PRO 117 HB3 PRO 117 -4.934 -12.847 -14.077 967 1HG PRO 117 HG2 PRO 117 -3.986 -10.100 -14.754 968 2HG PRO 117 HG3 PRO 117 -4.995 -11.208 -15.699 969 1HD PRO 117 HD2 PRO 117 -5.940 -9.022 -14.216 970 2HD PRO 117 HD3 PRO 117 -6.930 -10.376 -14.802 971 H ASN 118 H ASN 118 -5.249 -9.158 -11.410 972 HA ASN 118 HA ASN 118 -2.477 -8.823 -10.720 973 1HB ASN 118 HB2 ASN 118 -5.023 -7.377 -10.032 974 2HB ASN 118 HB3 ASN 118 -3.528 -6.965 -9.191 975 1HD2 ASN 118 HD21 ASN 118 -4.964 -5.229 -11.108 976 2HD2 ASN 118 HD22 ASN 118 -3.894 -4.947 -12.395 977 H ASN 119 H ASN 119 -1.955 -10.752 -9.508 978 HA ASN 119 HA ASN 119 -2.485 -10.483 -6.640 979 1HB ASN 119 HB2 ASN 119 -4.122 -12.196 -8.244 980 2HB ASN 119 HB3 ASN 119 -3.094 -13.208 -7.233 981 1HD2 ASN 119 HD21 ASN 119 -5.131 -13.757 -6.014 982 2HD2 ASN 119 HD22 ASN 119 -5.712 -12.669 -4.848 983 H THR 120 H THR 120 -0.214 -10.620 -8.639 984 HA THR 120 HA THR 120 1.171 -13.104 -8.355 985 HB THR 120 HB THR 120 2.299 -10.314 -8.751 986 HG1 THR 120 HG1 THR 120 2.326 -11.077 -10.957 987 1HG2 THR 120 HG21 THR 120 3.488 -13.071 -9.159 988 2HG2 THR 120 HG22 THR 120 4.210 -11.582 -9.773 989 3HG2 THR 120 HG23 THR 120 4.046 -11.831 -8.035 990 H HIS 121 H HIS 121 0.710 -10.453 -6.158 991 HA HIS 121 HA HIS 121 2.618 -11.780 -4.274 992 1HB HIS 121 HB2 HIS 121 2.146 -8.857 -4.828 993 2HB HIS 121 HB3 HIS 121 2.771 -9.386 -3.266 994 HD1 HIS 121 HD1 HIS 121 4.622 -11.660 -4.128 995 HD2 HIS 121 HD2 HIS 121 4.465 -7.990 -6.099 996 HE1 HIS 121 HE1 HIS 121 6.828 -11.406 -5.347 997 H GLU 122 H GLU 122 -0.289 -12.202 -4.630 998 HA GLU 122 HA GLU 122 -1.527 -10.879 -2.314 999 1HB GLU 122 HB2 GLU 122 -2.931 -11.317 -4.254 1000 2HB GLU 122 HB3 GLU 122 -2.531 -13.034 -4.197 1001 1HG GLU 122 HG2 GLU 122 -3.457 -12.325 -1.609 1002 2HG GLU 122 HG3 GLU 122 -4.594 -11.630 -2.766 1003 H GLN 123 H GLN 123 -0.485 -14.167 -3.218 1004 HA GLN 123 HA GLN 123 -1.263 -15.449 -0.792 1005 1HB GLN 123 HB2 GLN 123 0.221 -16.125 -3.148 1006 2HB GLN 123 HB3 GLN 123 1.158 -16.627 -1.741 1007 1HG GLN 123 HG2 GLN 123 -0.178 -18.446 -1.658 1008 2HG GLN 123 HG3 GLN 123 -1.448 -17.359 -1.091 1009 1HE2 GLN 123 HE21 GLN 123 -3.282 -17.239 -2.398 1010 2HE2 GLN 123 HE22 GLN 123 -3.351 -17.730 -4.021 1011 H LEU 124 H LEU 124 1.770 -13.836 -1.730 1012 HA LEU 124 HA LEU 124 3.216 -14.397 0.662 1013 1HB LEU 124 HB2 LEU 124 3.758 -13.090 -1.690 1014 2HB LEU 124 HB3 LEU 124 3.721 -11.757 -0.537 1015 HG LEU 124 HG LEU 124 5.991 -12.750 -0.745 1016 1HD1 LEU 124 HD11 LEU 124 4.422 -12.718 1.783 1017 2HD1 LEU 124 HD12 LEU 124 6.002 -13.498 1.847 1018 3HD1 LEU 124 HD13 LEU 124 5.870 -11.812 1.347 1019 1HD2 LEU 124 HD21 LEU 124 4.678 -15.136 -0.943 1020 2HD2 LEU 124 HD22 LEU 124 6.389 -14.988 -0.541 1021 3HD2 LEU 124 HD23 LEU 124 5.196 -15.182 0.743 1022 H LEU 125 H LEU 125 1.437 -11.415 -0.237 1023 HA LEU 125 HA LEU 125 1.670 -10.174 2.315 1024 1HB LEU 125 HB2 LEU 125 -0.175 -9.867 -0.027 1025 2HB LEU 125 HB3 LEU 125 -0.584 -9.057 1.485 1026 HG LEU 125 HG LEU 125 2.106 -8.813 0.114 1027 1HD1 LEU 125 HD11 LEU 125 -0.407 -7.154 -0.047 1028 2HD1 LEU 125 HD12 LEU 125 1.178 -6.423 -0.303 1029 3HD1 LEU 125 HD13 LEU 125 0.624 -7.721 -1.361 1030 1HD2 LEU 125 HD21 LEU 125 1.206 -8.200 2.729 1031 2HD2 LEU 125 HD22 LEU 125 2.735 -7.727 1.988 1032 3HD2 LEU 125 HD23 LEU 125 1.335 -6.660 1.879 1033 H ARG 126 H ARG 126 -0.337 -12.777 1.217 1034 HA ARG 126 HA ARG 126 -2.445 -12.513 3.158 1035 1HB ARG 126 HB2 ARG 126 -1.748 -14.322 1.067 1036 2HB ARG 126 HB3 ARG 126 -1.984 -15.271 2.535 1037 1HG ARG 126 HG2 ARG 126 -4.201 -14.565 2.794 1038 2HG ARG 126 HG3 ARG 126 -3.960 -13.125 1.804 1039 1HD ARG 126 HD2 ARG 126 -3.559 -14.719 -0.158 1040 2HD ARG 126 HD3 ARG 126 -4.194 -15.994 0.882 1041 HE ARG 126 HE ARG 126 -5.839 -13.558 0.381 1042 1HH1 ARG 126 HH11 ARG 126 -5.298 -16.359 -1.257 1043 2HH1 ARG 126 HH12 ARG 126 -6.895 -17.010 -1.088 1044 1HH2 ARG 126 HH21 ARG 126 -7.898 -14.645 1.241 1045 2HH2 ARG 126 HH22 ARG 126 -8.366 -16.041 0.329 1046 H LYS 127 H LYS 127 0.150 -14.988 3.104 1047 HA LYS 127 HA LYS 127 -0.108 -15.854 5.746 1048 1HB LYS 127 HB2 LYS 127 2.395 -16.336 5.608 1049 2HB LYS 127 HB3 LYS 127 1.416 -17.017 4.309 1050 1HG LYS 127 HG2 LYS 127 2.000 -15.134 2.849 1051 2HG LYS 127 HG3 LYS 127 2.938 -14.400 4.150 1052 1HD LYS 127 HD2 LYS 127 3.530 -17.203 3.210 1053 2HD LYS 127 HD3 LYS 127 4.213 -15.805 2.378 1054 1HE LYS 127 HE2 LYS 127 5.877 -16.151 3.938 1055 2HE LYS 127 HE3 LYS 127 4.829 -15.087 4.875 1056 1HZ LYS 127 HZ1 LYS 127 3.832 -17.637 5.212 1057 2HZ LYS 127 HZ2 LYS 127 5.514 -17.791 5.360 1058 3HZ LYS 127 HZ3 LYS 127 4.671 -16.704 6.357 1059 H SER 128 H SER 128 1.550 -12.981 4.528 1060 HA SER 128 HA SER 128 2.853 -12.227 6.950 1061 1HB SER 128 HB2 SER 128 1.713 -10.424 4.794 1062 2HB SER 128 HB3 SER 128 2.916 -9.963 5.995 1063 HG SER 128 HG SER 128 3.352 -12.209 4.364 1064 H GLU 129 H GLU 129 -0.400 -11.468 5.705 1065 HA GLU 129 HA GLU 129 -1.172 -9.755 7.860 1066 1HB GLU 129 HB2 GLU 129 -2.474 -9.858 5.794 1067 2HB GLU 129 HB3 GLU 129 -2.859 -11.554 6.093 1068 1HG GLU 129 HG2 GLU 129 -4.688 -10.842 7.203 1069 2HG GLU 129 HG3 GLU 129 -3.598 -10.237 8.452 1070 H ALA 130 H ALA 130 -1.445 -13.273 7.409 1071 HA ALA 130 HA ALA 130 -2.968 -13.918 9.679 1072 1HB ALA 130 HB1 ALA 130 -1.336 -15.318 7.817 1073 2HB ALA 130 HB2 ALA 130 -0.835 -15.822 9.431 1074 3HB ALA 130 HB3 ALA 130 -2.519 -15.995 8.937 1075 H GLN 131 H GLN 131 0.559 -13.478 9.448 1076 HA GLN 131 HA GLN 131 1.098 -13.987 12.210 1077 1HB GLN 131 HB2 GLN 131 2.872 -13.906 10.478 1078 2HB GLN 131 HB3 GLN 131 2.600 -12.170 10.297 1079 1HG GLN 131 HG2 GLN 131 3.146 -11.865 12.710 1080 2HG GLN 131 HG3 GLN 131 3.509 -13.587 12.820 1081 1HE2 GLN 131 HE21 GLN 131 5.695 -12.312 13.467 1082 2HE2 GLN 131 HE22 GLN 131 6.791 -12.113 12.187 1083 H ALA 132 H ALA 132 0.535 -10.937 10.446 1084 HA ALA 132 HA ALA 132 0.778 -9.143 12.596 1085 1HB ALA 132 HB1 ALA 132 -0.541 -9.162 9.973 1086 2HB ALA 132 HB2 ALA 132 -1.359 -8.135 11.151 1087 3HB ALA 132 HB3 ALA 132 0.342 -7.863 10.774 1088 H LYS 133 H LYS 133 -1.800 -11.391 11.812 1089 HA LYS 133 HA LYS 133 -3.774 -10.270 13.597 1090 1HB LYS 133 HB2 LYS 133 -3.575 -12.494 11.800 1091 2HB LYS 133 HB3 LYS 133 -4.136 -13.091 13.362 1092 1HG LYS 133 HG2 LYS 133 -5.689 -10.925 13.217 1093 2HG LYS 133 HG3 LYS 133 -5.441 -11.165 11.487 1094 1HD LYS 133 HD2 LYS 133 -6.098 -13.591 13.074 1095 2HD LYS 133 HD3 LYS 133 -7.398 -12.418 12.860 1096 1HE LYS 133 HE2 LYS 133 -5.839 -13.004 10.418 1097 2HE LYS 133 HE3 LYS 133 -6.785 -14.357 11.040 1098 1HZ LYS 133 HZ1 LYS 133 -7.928 -11.649 10.675 1099 2HZ LYS 133 HZ2 LYS 133 -7.952 -12.822 9.446 1100 3HZ LYS 133 HZ3 LYS 133 -8.756 -13.111 10.915 1101 H LYS 134 H LYS 134 -1.421 -12.940 13.928 1102 HA LYS 134 HA LYS 134 -2.129 -13.517 16.662 1103 1HB LYS 134 HB2 LYS 134 0.487 -14.076 15.236 1104 2HB LYS 134 HB3 LYS 134 -0.142 -14.902 16.659 1105 1HG LYS 134 HG2 LYS 134 -2.228 -15.323 15.065 1106 2HG LYS 134 HG3 LYS 134 -1.006 -15.123 13.808 1107 1HD LYS 134 HD2 LYS 134 0.358 -16.777 15.410 1108 2HD LYS 134 HD3 LYS 134 -1.273 -17.265 15.871 1109 1HE LYS 134 HE2 LYS 134 -1.517 -18.417 13.955 1110 2HE LYS 134 HE3 LYS 134 -1.122 -16.985 13.005 1111 1HZ LYS 134 HZ1 LYS 134 1.256 -17.474 13.490 1112 2HZ LYS 134 HZ2 LYS 134 0.768 -18.954 14.164 1113 3HZ LYS 134 HZ3 LYS 134 0.490 -18.634 12.519 1114 H GLU 135 H GLU 135 -0.302 -11.005 15.200 1115 HA GLU 135 HA GLU 135 1.356 -10.507 17.577 1116 1HB GLU 135 HB2 GLU 135 1.033 -9.185 14.894 1117 2HB GLU 135 HB3 GLU 135 1.857 -8.338 16.206 1118 1HG GLU 135 HG2 GLU 135 3.358 -10.321 16.480 1119 2HG GLU 135 HG3 GLU 135 2.596 -11.049 15.067 1120 H LYS 136 H LYS 136 -1.650 -9.368 16.186 1121 HA LYS 136 HA LYS 136 -3.285 -7.946 17.078 1122 1HB LYS 136 HB2 LYS 136 -1.747 -8.130 19.675 1123 2HB LYS 136 HB3 LYS 136 -3.469 -7.816 19.460 1124 1HG LYS 136 HG2 LYS 136 -2.554 -10.318 18.211 1125 2HG LYS 136 HG3 LYS 136 -2.385 -10.292 19.966 1126 1HD LYS 136 HD2 LYS 136 -4.747 -9.635 20.196 1127 2HD LYS 136 HD3 LYS 136 -4.923 -9.637 18.441 1128 1HE LYS 136 HE2 LYS 136 -3.760 -12.132 19.305 1129 2HE LYS 136 HE3 LYS 136 -5.255 -11.830 20.191 1130 1HZ LYS 136 HZ1 LYS 136 -5.043 -11.555 17.250 1131 2HZ LYS 136 HZ2 LYS 136 -5.509 -13.001 18.008 1132 3HZ LYS 136 HZ3 LYS 136 -6.453 -11.601 18.189 1133 H LEU 137 H LEU 137 -1.635 -6.528 15.623 1134 HA LEU 137 HA LEU 137 -0.529 -4.348 17.327 1135 1HB LEU 137 HB2 LEU 137 0.479 -5.657 15.058 1136 2HB LEU 137 HB3 LEU 137 -0.001 -4.056 14.493 1137 HG LEU 137 HG LEU 137 1.782 -4.630 16.877 1138 1HD1 LEU 137 HD11 LEU 137 2.366 -4.532 14.122 1139 2HD1 LEU 137 HD12 LEU 137 2.902 -2.985 14.777 1140 3HD1 LEU 137 HD13 LEU 137 3.520 -4.492 15.454 1141 1HD2 LEU 137 HD21 LEU 137 0.438 -2.178 15.825 1142 2HD2 LEU 137 HD22 LEU 137 0.821 -2.620 17.489 1143 3HD2 LEU 137 HD23 LEU 137 2.088 -2.007 16.426 1144 H ASN 138 H ASN 138 -2.241 -2.989 17.746 1145 HA ASN 138 HA ASN 138 -3.801 -1.301 17.322 1146 1HB ASN 138 HB2 ASN 138 -2.609 -1.454 14.539 1147 2HB ASN 138 HB3 ASN 138 -3.661 -0.165 15.124 1148 1HD2 ASN 138 HD21 ASN 138 -0.533 -0.564 14.467 1149 2HD2 ASN 138 HD22 ASN 138 0.189 0.306 15.732 1150 H ILE 139 H ILE 139 -4.223 -2.165 13.984 1151 HA ILE 139 HA ILE 139 -6.955 -2.474 14.009 1152 HB ILE 139 HB ILE 139 -4.976 -4.090 12.377 1153 1HG1 ILE 139 HG12 ILE 139 -6.496 -1.877 11.159 1154 2HG1 ILE 139 HG13 ILE 139 -5.375 -1.366 12.422 1155 1HG2 ILE 139 HG21 ILE 139 -7.951 -3.886 12.368 1156 2HG2 ILE 139 HG22 ILE 139 -7.140 -3.903 10.802 1157 3HG2 ILE 139 HG23 ILE 139 -6.916 -5.244 11.925 1158 1HD1 ILE 139 HD11 ILE 139 -3.911 -3.235 10.976 1159 2HD1 ILE 139 HD12 ILE 139 -4.805 -2.358 9.734 1160 3HD1 ILE 139 HD13 ILE 139 -3.759 -1.483 10.851 1161 H TRP 140 H TRP 140 -4.662 -5.194 14.414 1162 HA TRP 140 HA TRP 140 -6.856 -6.979 15.187 1163 1HB TRP 140 HB2 TRP 140 -3.894 -7.538 15.397 1164 2HB TRP 140 HB3 TRP 140 -5.207 -8.699 15.202 1165 HD1 TRP 140 HD1 TRP 140 -2.842 -6.555 13.272 1166 HE1 TRP 140 HE1 TRP 140 -3.334 -6.747 10.748 1167 HE3 TRP 140 HE3 TRP 140 -7.312 -9.012 13.434 1168 HZ2 TRP 140 HZ2 TRP 140 -5.359 -7.806 9.025 1169 HZ3 TRP 140 HZ3 TRP 140 -8.502 -9.602 11.339 1170 HH2 TRP 140 HH2 TRP 140 -7.533 -9.001 9.137 1171 H SER 141 H SER 141 -6.677 -4.766 16.945 1172 HA SER 141 HA SER 141 -5.308 -5.789 19.365 1173 1HB SER 141 HB2 SER 141 -6.738 -3.184 18.788 1174 2HB SER 141 HB3 SER 141 -6.030 -3.591 20.348 1175 HG SER 141 HG SER 141 -4.133 -3.162 19.560 1176 H GLU 142 H GLU 142 -8.517 -4.337 18.767 1177 HA GLU 142 HA GLU 142 -9.735 -5.493 21.064 1178 1HB GLU 142 HB2 GLU 142 -11.887 -5.038 19.738 1179 2HB GLU 142 HB3 GLU 142 -10.850 -3.651 20.056 1180 1HG GLU 142 HG2 GLU 142 -10.136 -3.507 17.855 1181 2HG GLU 142 HG3 GLU 142 -10.404 -5.223 17.548 1182 H ASP 143 H ASP 143 -11.839 -6.968 20.588 1183 HA ASP 143 HA ASP 143 -10.794 -9.352 19.128 1184 1HB ASP 143 HB2 ASP 143 -12.791 -10.386 20.592 1185 2HB ASP 143 HB3 ASP 143 -11.165 -10.190 21.240 1186 H ASN 144 H ASN 144 -12.606 -10.741 18.166 1187 HA ASN 144 HA ASN 144 -14.432 -8.939 16.676 1188 1HB ASN 144 HB2 ASN 144 -14.216 -11.883 16.146 1189 2HB ASN 144 HB3 ASN 144 -14.496 -10.562 15.010 1190 1HD2 ASN 144 HD21 ASN 144 -12.555 -9.033 14.698 1191 2HD2 ASN 144 HD22 ASN 144 -11.002 -9.715 14.763 1192 H ALA 145 H ALA 145 -14.718 -10.161 19.555 1193 HA ALA 145 HA ALA 145 -17.302 -11.574 19.184 1194 1HB ALA 145 HB1 ALA 145 -15.214 -11.847 21.032 1195 2HB ALA 145 HB2 ALA 145 -16.519 -11.089 21.945 1196 3HB ALA 145 HB3 ALA 145 -16.795 -12.623 21.117 1197 H ASP 146 H ASP 146 -15.957 -8.556 20.397 1198 HA ASP 146 HA ASP 146 -18.285 -7.582 21.737 1199 1HB ASP 146 HB2 ASP 146 -17.268 -5.380 21.526 1200 2HB ASP 146 HB3 ASP 146 -15.999 -6.554 21.879 1201 H SER 147 H SER 147 -19.164 -5.293 20.623 1202 HA SER 147 HA SER 147 -19.628 -5.268 17.822 1203 1HB SER 147 HB2 SER 147 -20.978 -7.385 18.984 1204 2HB SER 147 HB3 SER 147 -22.205 -6.122 18.941 1205 HG SER 147 HG SER 147 -21.088 -7.555 16.910 1206 H GLY 148 H GLY 148 -21.565 -3.805 17.289 1207 1HA GLY 148 HA2 GLY 148 -23.172 -2.325 18.871 1208 2HA GLY 148 HA3 GLY 148 -21.605 -1.621 19.274 1209 H GLN 149 H GLN 149 -22.567 0.374 18.313 1210 HA GLN 149 HA GLN 149 -22.934 1.857 16.522 1211 1HB GLN 149 HB2 GLN 149 -20.386 0.703 16.348 1212 2HB GLN 149 HB3 GLN 149 -21.027 0.619 14.707 1213 1HG GLN 149 HG2 GLN 149 -21.693 3.064 14.975 1214 2HG GLN 149 HG3 GLN 149 -20.724 3.074 16.448 1215 1HE2 GLN 149 HE21 GLN 149 -20.151 4.587 13.958 1216 2HE2 GLN 149 HE22 GLN 149 -18.639 4.042 13.410 1217 HN3 PTP 150 H3 PTP 150 -7.858 -2.894 -7.728 1218 1H5M PTP 150 H51 PTP 150 -6.641 -0.740 -3.568 1219 2H5M PTP 150 H52 PTP 150 -7.295 0.887 -3.874 1220 3H5M PTP 150 H53 PTP 150 -5.847 0.331 -4.749 1221 H6 PTP 150 H6 PTP 150 -9.192 0.901 -5.099 1222 H1* PTP 150 H1' PTP 150 -11.280 -0.011 -7.978 1223 2H2* PTP 150 H2' PTP 150 -11.677 -0.734 -5.084 1224 H3* PTP 150 H3' PTP 150 -13.174 1.073 -4.697 1225 H4* PTP 150 H4' PTP 150 -12.177 3.044 -6.301 1226 2H5* PTP 150 H5' PTP 150 -10.989 1.549 -3.909 Start of MODEL 29 1 1H ALA 1 H1 ALA 1 2.761 -22.083 -12.436 2 2H ALA 1 H2 ALA 1 2.217 -21.580 -13.964 3 3H ALA 1 H3 ALA 1 3.434 -22.755 -13.843 4 HA ALA 1 HA ALA 1 4.875 -21.076 -12.748 5 1HB ALA 1 HB1 ALA 1 3.845 -20.719 -15.565 6 2HB ALA 1 HB2 ALA 1 5.170 -19.739 -14.936 7 3HB ALA 1 HB3 ALA 1 5.341 -21.492 -15.036 8 H THR 2 H THR 2 2.405 -20.363 -11.561 9 HA THR 2 HA THR 2 2.027 -17.511 -12.332 10 HB THR 2 HB THR 2 0.390 -18.784 -10.186 11 HG1 THR 2 HG1 THR 2 0.416 -19.517 -12.901 12 1HG2 THR 2 HG21 THR 2 -0.086 -16.896 -12.500 13 2HG2 THR 2 HG22 THR 2 -1.388 -17.520 -11.487 14 3HG2 THR 2 HG23 THR 2 -0.121 -16.519 -10.777 15 H SER 3 H SER 3 4.458 -18.210 -11.022 16 HA SER 3 HA SER 3 4.584 -16.273 -8.970 17 1HB SER 3 HB2 SER 3 3.825 -19.019 -8.072 18 2HB SER 3 HB3 SER 3 4.983 -18.128 -7.089 19 HG SER 3 HG SER 3 3.481 -16.448 -6.943 20 H THR 4 H THR 4 6.680 -16.648 -7.587 21 HA THR 4 HA THR 4 8.991 -17.056 -7.571 22 HB THR 4 HB THR 4 8.513 -19.314 -9.515 23 HG1 THR 4 HG1 THR 4 8.185 -19.460 -6.710 24 1HG2 THR 4 HG21 THR 4 10.816 -18.508 -8.561 25 2HG2 THR 4 HG22 THR 4 10.285 -19.320 -7.089 26 3HG2 THR 4 HG23 THR 4 10.450 -20.233 -8.589 27 H LYS 5 H LYS 5 8.326 -15.014 -9.171 28 HA LYS 5 HA LYS 5 10.214 -15.320 -11.430 29 1HB LYS 5 HB2 LYS 5 8.643 -14.325 -13.035 30 2HB LYS 5 HB3 LYS 5 7.975 -15.820 -12.376 31 1HG LYS 5 HG2 LYS 5 6.610 -14.551 -10.794 32 2HG LYS 5 HG3 LYS 5 7.324 -13.039 -11.356 33 1HD LYS 5 HD2 LYS 5 6.087 -14.820 -13.406 34 2HD LYS 5 HD3 LYS 5 4.999 -13.938 -12.332 35 1HE LYS 5 HE2 LYS 5 7.130 -12.208 -13.261 36 2HE LYS 5 HE3 LYS 5 6.284 -12.936 -14.628 37 1HZ LYS 5 HZ1 LYS 5 4.958 -11.565 -12.352 38 2HZ LYS 5 HZ2 LYS 5 5.257 -10.857 -13.867 39 3HZ LYS 5 HZ3 LYS 5 4.200 -12.178 -13.743 40 H LYS 6 H LYS 6 11.462 -13.508 -11.616 41 HA LYS 6 HA LYS 6 11.040 -11.310 -9.749 42 1HB LYS 6 HB2 LYS 6 13.205 -12.348 -11.296 43 2HB LYS 6 HB3 LYS 6 13.005 -10.647 -11.717 44 1HG LYS 6 HG2 LYS 6 14.103 -10.145 -9.814 45 2HG LYS 6 HG3 LYS 6 12.690 -10.730 -8.935 46 1HD LYS 6 HD2 LYS 6 14.400 -12.907 -9.881 47 2HD LYS 6 HD3 LYS 6 15.244 -11.809 -8.788 48 1HE LYS 6 HE2 LYS 6 13.154 -12.005 -7.282 49 2HE LYS 6 HE3 LYS 6 12.738 -13.407 -8.268 50 1HZ LYS 6 HZ1 LYS 6 15.459 -13.221 -7.209 51 2HZ LYS 6 HZ2 LYS 6 14.216 -13.634 -6.132 52 3HZ LYS 6 HZ3 LYS 6 14.502 -14.593 -7.504 53 H LEU 7 H LEU 7 9.329 -9.981 -10.257 54 HA LEU 7 HA LEU 7 8.457 -9.369 -12.914 55 1HB LEU 7 HB2 LEU 7 7.875 -8.444 -10.179 56 2HB LEU 7 HB3 LEU 7 7.667 -7.198 -11.409 57 HG LEU 7 HG LEU 7 6.554 -9.927 -11.937 58 1HD1 LEU 7 HD11 LEU 7 5.522 -7.918 -9.952 59 2HD1 LEU 7 HD12 LEU 7 4.385 -8.905 -10.872 60 3HD1 LEU 7 HD13 LEU 7 5.578 -9.677 -9.825 61 1HD2 LEU 7 HD21 LEU 7 5.780 -7.074 -12.615 62 2HD2 LEU 7 HD22 LEU 7 6.432 -8.289 -13.714 63 3HD2 LEU 7 HD23 LEU 7 4.808 -8.479 -13.054 64 H HIS 8 H HIS 8 8.330 -6.571 -13.030 65 HA HIS 8 HA HIS 8 11.218 -5.893 -13.401 66 1HB HIS 8 HB2 HIS 8 9.357 -5.910 -15.333 67 2HB HIS 8 HB3 HIS 8 9.066 -4.286 -14.707 68 HD1 HIS 8 HD1 HIS 8 11.642 -3.054 -14.200 69 HD2 HIS 8 HD2 HIS 8 11.222 -5.753 -17.350 70 HE1 HIS 8 HE1 HIS 8 13.552 -2.593 -15.799 71 H LYS 9 H LYS 9 12.004 -4.361 -12.038 72 HA LYS 9 HA LYS 9 10.028 -2.661 -10.584 73 1HB LYS 9 HB2 LYS 9 12.868 -3.453 -9.875 74 2HB LYS 9 HB3 LYS 9 11.871 -2.353 -8.922 75 1HG LYS 9 HG2 LYS 9 10.288 -4.653 -9.428 76 2HG LYS 9 HG3 LYS 9 11.874 -5.229 -8.911 77 1HD LYS 9 HD2 LYS 9 11.123 -2.985 -7.282 78 2HD LYS 9 HD3 LYS 9 9.804 -4.157 -7.287 79 1HE LYS 9 HE2 LYS 9 12.667 -5.014 -6.861 80 2HE LYS 9 HE3 LYS 9 11.656 -4.478 -5.518 81 1HZ LYS 9 HZ1 LYS 9 9.981 -6.160 -6.499 82 2HZ LYS 9 HZ2 LYS 9 11.346 -6.838 -7.249 83 3HZ LYS 9 HZ3 LYS 9 11.270 -6.731 -5.556 84 H GLU 10 H GLU 10 9.953 -0.558 -11.157 85 HA GLU 10 HA GLU 10 12.346 0.612 -12.518 86 1HB GLU 10 HB2 GLU 10 9.393 1.222 -12.790 87 2HB GLU 10 HB3 GLU 10 10.651 2.278 -13.433 88 1HG GLU 10 HG2 GLU 10 11.348 -0.320 -14.269 89 2HG GLU 10 HG3 GLU 10 9.610 -0.183 -14.541 90 HA PRO 11 HA PRO 11 12.695 3.545 -9.257 91 1HB PRO 11 HB2 PRO 11 13.652 5.702 -10.637 92 2HB PRO 11 HB3 PRO 11 14.619 4.254 -10.307 93 1HG PRO 11 HG2 PRO 11 13.270 5.087 -12.844 94 2HG PRO 11 HG3 PRO 11 14.801 4.226 -12.617 95 1HD PRO 11 HD2 PRO 11 12.409 3.001 -13.325 96 2HD PRO 11 HD3 PRO 11 13.774 2.167 -12.552 97 H ALA 12 H ALA 12 11.909 5.704 -8.527 98 HA ALA 12 HA ALA 12 9.782 6.972 -10.123 99 1HB ALA 12 HB1 ALA 12 9.196 5.010 -8.088 100 2HB ALA 12 HB2 ALA 12 8.581 6.586 -7.591 101 3HB ALA 12 HB3 ALA 12 8.076 5.888 -9.129 102 H THR 13 H THR 13 8.816 8.857 -8.721 103 HA THR 13 HA THR 13 10.989 9.935 -6.967 104 HB THR 13 HB THR 13 9.318 11.793 -8.616 105 HG1 THR 13 HG1 THR 13 10.147 10.129 -10.017 106 1HG2 THR 13 HG21 THR 13 11.570 11.938 -6.887 107 2HG2 THR 13 HG22 THR 13 12.130 12.346 -8.508 108 3HG2 THR 13 HG23 THR 13 10.805 13.254 -7.779 109 H LEU 14 H LEU 14 10.018 9.725 -4.973 110 HA LEU 14 HA LEU 14 7.250 9.922 -4.414 111 1HB LEU 14 HB2 LEU 14 9.077 9.082 -2.858 112 2HB LEU 14 HB3 LEU 14 9.463 10.771 -2.529 113 HG LEU 14 HG LEU 14 7.875 9.696 -0.870 114 1HD1 LEU 14 HD11 LEU 14 8.017 12.242 -1.737 115 2HD1 LEU 14 HD12 LEU 14 6.349 11.886 -2.187 116 3HD1 LEU 14 HD13 LEU 14 6.863 11.725 -0.508 117 1HD2 LEU 14 HD21 LEU 14 6.640 8.424 -2.693 118 2HD2 LEU 14 HD22 LEU 14 5.607 9.265 -1.537 119 3HD2 LEU 14 HD23 LEU 14 5.882 9.953 -3.137 120 H ILE 15 H ILE 15 6.073 11.676 -5.067 121 HA ILE 15 HA ILE 15 7.235 14.379 -4.946 122 HB ILE 15 HB ILE 15 4.484 13.413 -5.788 123 1HG1 ILE 15 HG12 ILE 15 6.527 14.569 -7.646 124 2HG1 ILE 15 HG13 ILE 15 6.752 12.906 -7.102 125 1HG2 ILE 15 HG21 ILE 15 4.564 15.782 -4.958 126 2HG2 ILE 15 HG22 ILE 15 5.786 16.125 -6.182 127 3HG2 ILE 15 HG23 ILE 15 4.157 15.656 -6.668 128 1HD1 ILE 15 HD11 ILE 15 4.215 12.649 -7.738 129 2HD1 ILE 15 HD12 ILE 15 4.517 14.074 -8.732 130 3HD1 ILE 15 HD13 ILE 15 5.440 12.597 -9.007 131 H LYS 16 H LYS 16 4.239 12.873 -3.650 132 HA LYS 16 HA LYS 16 4.688 14.013 -1.020 133 1HB LYS 16 HB2 LYS 16 3.955 16.032 -2.320 134 2HB LYS 16 HB3 LYS 16 2.434 15.207 -2.662 135 1HG LYS 16 HG2 LYS 16 1.703 16.145 -0.730 136 2HG LYS 16 HG3 LYS 16 2.665 14.901 0.068 137 1HD LYS 16 HD2 LYS 16 3.642 16.719 1.063 138 2HD LYS 16 HD3 LYS 16 4.604 16.717 -0.416 139 1HE LYS 16 HE2 LYS 16 1.984 18.175 -0.389 140 2HE LYS 16 HE3 LYS 16 3.392 18.927 0.360 141 1HZ LYS 16 HZ1 LYS 16 3.321 17.866 -2.411 142 2HZ LYS 16 HZ2 LYS 16 3.133 19.503 -2.001 143 3HZ LYS 16 HZ3 LYS 16 4.600 18.714 -1.684 144 H ALA 17 H ALA 17 3.539 12.815 0.440 145 HA ALA 17 HA ALA 17 1.733 10.742 -0.622 146 1HB ALA 17 HB1 ALA 17 2.859 11.293 2.136 147 2HB ALA 17 HB2 ALA 17 1.729 9.982 1.800 148 3HB ALA 17 HB3 ALA 17 3.316 9.997 1.032 149 H ILE 18 H ILE 18 -0.466 10.559 -0.035 150 HA ILE 18 HA ILE 18 -1.646 13.035 1.159 151 HB ILE 18 HB ILE 18 -2.959 11.039 -0.711 152 1HG1 ILE 18 HG12 ILE 18 -1.833 13.806 -1.254 153 2HG1 ILE 18 HG13 ILE 18 -1.157 12.287 -1.842 154 1HG2 ILE 18 HG21 ILE 18 -4.030 12.997 1.022 155 2HG2 ILE 18 HG22 ILE 18 -4.122 13.681 -0.601 156 3HG2 ILE 18 HG23 ILE 18 -4.877 12.126 -0.256 157 1HD1 ILE 18 HD11 ILE 18 -4.022 12.634 -2.434 158 2HD1 ILE 18 HD12 ILE 18 -2.973 13.813 -3.223 159 3HD1 ILE 18 HD13 ILE 18 -2.714 12.087 -3.484 160 H ASP 19 H ASP 19 -2.042 9.495 0.930 161 HA ASP 19 HA ASP 19 -3.192 9.568 3.685 162 1HB ASP 19 HB2 ASP 19 -4.174 7.634 1.588 163 2HB ASP 19 HB3 ASP 19 -4.944 8.093 3.108 164 H GLY 20 H GLY 20 -3.407 6.933 4.226 165 1HA GLY 20 HA2 GLY 20 -0.615 6.088 4.359 166 2HA GLY 20 HA3 GLY 20 -1.991 5.230 5.054 167 H ASP 21 H ASP 21 -3.141 5.660 2.125 168 HA ASP 21 HA ASP 21 -1.687 3.333 0.935 169 1HB ASP 21 HB2 ASP 21 -4.351 3.382 1.858 170 2HB ASP 21 HB3 ASP 21 -4.455 3.459 0.098 171 H THR 22 H THR 22 -2.289 6.525 0.578 172 HA THR 22 HA THR 22 -2.297 6.309 -2.407 173 HB THR 22 HB THR 22 -3.584 8.412 -0.641 174 HG1 THR 22 HG1 THR 22 -5.416 7.699 -1.933 175 1HG2 THR 22 HG21 THR 22 -2.616 8.509 -3.418 176 2HG2 THR 22 HG22 THR 22 -4.307 8.976 -3.234 177 3HG2 THR 22 HG23 THR 22 -3.055 9.829 -2.331 178 H VAL 23 H VAL 23 -0.361 6.965 -3.206 179 HA VAL 23 HA VAL 23 1.007 9.254 -1.869 180 HB VAL 23 HB VAL 23 3.172 8.101 -2.064 181 1HG1 VAL 23 HG11 VAL 23 0.916 6.979 -0.478 182 2HG1 VAL 23 HG12 VAL 23 2.392 6.016 -0.539 183 3HG1 VAL 23 HG13 VAL 23 2.444 7.670 0.071 184 1HG2 VAL 23 HG21 VAL 23 1.428 6.018 -3.351 185 2HG2 VAL 23 HG22 VAL 23 3.002 6.625 -3.868 186 3HG2 VAL 23 HG23 VAL 23 2.889 5.516 -2.501 187 H LYS 24 H LYS 24 1.402 10.790 -3.395 188 HA LYS 24 HA LYS 24 1.226 10.079 -6.243 189 1HB LYS 24 HB2 LYS 24 1.741 12.740 -4.880 190 2HB LYS 24 HB3 LYS 24 1.457 12.520 -6.607 191 1HG LYS 24 HG2 LYS 24 -0.741 11.384 -5.953 192 2HG LYS 24 HG3 LYS 24 -0.467 12.016 -4.329 193 1HD LYS 24 HD2 LYS 24 -0.849 14.191 -4.961 194 2HD LYS 24 HD3 LYS 24 -0.192 13.946 -6.580 195 1HE LYS 24 HE2 LYS 24 -2.200 12.784 -7.284 196 2HE LYS 24 HE3 LYS 24 -2.842 12.813 -5.642 197 1HZ LYS 24 HZ1 LYS 24 -2.095 15.363 -6.863 198 2HZ LYS 24 HZ2 LYS 24 -3.513 14.615 -7.416 199 3HZ LYS 24 HZ3 LYS 24 -3.347 15.008 -5.772 200 H LEU 25 H LEU 25 3.009 9.398 -7.323 201 HA LEU 25 HA LEU 25 5.665 10.463 -6.437 202 1HB LEU 25 HB2 LEU 25 5.507 7.886 -7.937 203 2HB LEU 25 HB3 LEU 25 6.631 8.381 -6.673 204 HG LEU 25 HG LEU 25 3.706 7.795 -6.150 205 1HD1 LEU 25 HD11 LEU 25 6.140 6.004 -5.901 206 2HD1 LEU 25 HD12 LEU 25 4.571 5.643 -5.181 207 3HD1 LEU 25 HD13 LEU 25 4.735 5.743 -6.934 208 1HD2 LEU 25 HD21 LEU 25 6.129 8.435 -4.492 209 2HD2 LEU 25 HD22 LEU 25 4.488 9.066 -4.352 210 3HD2 LEU 25 HD23 LEU 25 4.855 7.430 -3.804 211 H MET 26 H MET 26 7.270 9.896 -8.475 212 HA MET 26 HA MET 26 5.893 11.018 -10.883 213 1HB MET 26 HB2 MET 26 7.680 12.436 -9.552 214 2HB MET 26 HB3 MET 26 8.832 11.406 -10.403 215 1HG MET 26 HG2 MET 26 7.705 12.022 -12.558 216 2HG MET 26 HG3 MET 26 6.703 13.161 -11.660 217 1HE MET 26 HE1 MET 26 7.161 15.267 -12.525 218 2HE MET 26 HE2 MET 26 8.726 15.947 -12.995 219 3HE MET 26 HE3 MET 26 8.051 14.582 -13.881 220 H TYR 27 H TYR 27 5.676 9.306 -12.252 221 HA TYR 27 HA TYR 27 7.949 7.384 -12.481 222 1HB TYR 27 HB2 TYR 27 5.725 6.421 -11.926 223 2HB TYR 27 HB3 TYR 27 5.076 7.103 -13.417 224 HD1 TYR 27 HD1 TYR 27 7.911 4.958 -12.219 225 HD2 TYR 27 HD2 TYR 27 5.101 5.805 -15.354 226 HE1 TYR 27 HE1 TYR 27 8.719 2.979 -13.478 227 HE2 TYR 27 HE2 TYR 27 5.907 3.826 -16.613 228 HH TYR 27 HH TYR 27 7.159 1.478 -15.742 229 H LYS 28 H LYS 28 8.963 7.106 -14.471 230 HA LYS 28 HA LYS 28 9.728 7.836 -16.577 231 1HB LYS 28 HB2 LYS 28 6.742 7.536 -16.886 232 2HB LYS 28 HB3 LYS 28 7.749 8.032 -18.246 233 1HG LYS 28 HG2 LYS 28 9.084 6.010 -18.064 234 2HG LYS 28 HG3 LYS 28 8.231 5.536 -16.595 235 1HD LYS 28 HD2 LYS 28 6.133 5.333 -17.842 236 2HD LYS 28 HD3 LYS 28 6.934 5.883 -19.315 237 1HE LYS 28 HE2 LYS 28 8.575 3.833 -18.574 238 2HE LYS 28 HE3 LYS 28 7.018 3.236 -18.002 239 1HZ LYS 28 HZ1 LYS 28 6.487 4.288 -20.465 240 2HZ LYS 28 HZ2 LYS 28 7.982 3.510 -20.673 241 3HZ LYS 28 HZ3 LYS 28 6.648 2.638 -20.093 242 H GLY 29 H GLY 29 9.167 9.940 -14.569 243 1HA GLY 29 HA2 GLY 29 9.234 12.289 -14.550 244 2HA GLY 29 HA3 GLY 29 9.386 12.230 -16.307 245 H GLN 30 H GLN 30 6.784 11.107 -14.127 246 HA GLN 30 HA GLN 30 4.975 13.143 -15.275 247 1HB GLN 30 HB2 GLN 30 4.681 11.332 -16.846 248 2HB GLN 30 HB3 GLN 30 4.546 10.156 -15.540 249 1HG GLN 30 HG2 GLN 30 2.518 11.502 -14.737 250 2HG GLN 30 HG3 GLN 30 2.584 12.327 -16.294 251 1HE2 GLN 30 HE21 GLN 30 0.496 11.330 -16.902 252 2HE2 GLN 30 HE22 GLN 30 0.424 9.696 -17.356 253 HA PRO 31 HA PRO 31 3.527 12.952 -11.084 254 1HB PRO 31 HB2 PRO 31 1.353 14.575 -11.418 255 2HB PRO 31 HB3 PRO 31 3.014 15.190 -11.369 256 1HG PRO 31 HG2 PRO 31 1.221 14.784 -13.725 257 2HG PRO 31 HG3 PRO 31 2.451 16.028 -13.448 258 1HD PRO 31 HD2 PRO 31 2.810 13.775 -15.049 259 2HD PRO 31 HD3 PRO 31 4.127 14.733 -14.338 260 H MET 32 H MET 32 2.428 11.194 -10.271 261 HA MET 32 HA MET 32 -0.299 10.627 -11.253 262 1HB MET 32 HB2 MET 32 2.009 9.088 -12.055 263 2HB MET 32 HB3 MET 32 0.926 8.087 -11.088 264 1HG MET 32 HG2 MET 32 -0.508 9.770 -13.006 265 2HG MET 32 HG3 MET 32 0.613 8.652 -13.784 266 1HE MET 32 HE1 MET 32 1.104 6.567 -12.604 267 2HE MET 32 HE2 MET 32 0.132 5.899 -11.294 268 3HE MET 32 HE3 MET 32 -0.117 5.332 -12.943 269 H THR 33 H THR 33 -1.496 9.276 -9.766 270 HA THR 33 HA THR 33 -0.270 9.213 -7.044 271 HB THR 33 HB THR 33 -2.362 10.568 -7.346 272 HG1 THR 33 HG1 THR 33 -1.968 9.705 -5.333 273 1HG2 THR 33 HG21 THR 33 -3.285 8.951 -9.093 274 2HG2 THR 33 HG22 THR 33 -3.731 7.904 -7.745 275 3HG2 THR 33 HG23 THR 33 -4.435 9.515 -7.880 276 H PHE 34 H PHE 34 0.379 7.213 -6.423 277 HA PHE 34 HA PHE 34 -0.766 4.841 -7.771 278 1HB PHE 34 HB2 PHE 34 1.631 5.319 -6.008 279 2HB PHE 34 HB3 PHE 34 1.051 3.682 -6.321 280 HD1 PHE 34 HD1 PHE 34 2.196 6.815 -7.985 281 HD2 PHE 34 HD2 PHE 34 1.508 2.594 -8.378 282 HE1 PHE 34 HE1 PHE 34 3.332 6.836 -10.189 283 HE2 PHE 34 HE2 PHE 34 2.644 2.614 -10.583 284 HZ PHE 34 HZ PHE 34 3.555 4.735 -11.489 285 H ARG 35 H ARG 35 -1.548 3.023 -6.522 286 HA ARG 35 HA ARG 35 -2.466 3.726 -3.766 287 1HB ARG 35 HB2 ARG 35 -4.452 3.955 -5.025 288 2HB ARG 35 HB3 ARG 35 -4.041 2.610 -6.087 289 1HG ARG 35 HG2 ARG 35 -5.807 1.950 -4.506 290 2HG ARG 35 HG3 ARG 35 -4.331 1.037 -4.196 291 1HD ARG 35 HD2 ARG 35 -5.570 2.092 -2.168 292 2HD ARG 35 HD3 ARG 35 -3.819 2.279 -2.264 293 HE ARG 35 HE ARG 35 -4.169 4.592 -2.994 294 1HH1 ARG 35 HH11 ARG 35 -6.356 3.319 -0.850 295 2HH1 ARG 35 HH12 ARG 35 -7.600 4.494 -1.117 296 1HH2 ARG 35 HH21 ARG 35 -6.035 5.912 -3.867 297 2HH2 ARG 35 HH22 ARG 35 -7.417 5.964 -2.824 298 H LEU 36 H LEU 36 -1.731 2.222 -2.338 299 HA LEU 36 HA LEU 36 -0.188 -0.016 -2.975 300 1HB LEU 36 HB2 LEU 36 -2.038 0.282 -0.589 301 2HB LEU 36 HB3 LEU 36 -0.682 -0.840 -0.703 302 HG LEU 36 HG LEU 36 -0.611 2.177 -0.578 303 1HD1 LEU 36 HD11 LEU 36 0.739 -0.063 0.956 304 2HD1 LEU 36 HD12 LEU 36 1.072 1.651 1.201 305 3HD1 LEU 36 HD13 LEU 36 -0.531 1.006 1.552 306 1HD2 LEU 36 HD21 LEU 36 1.437 0.253 -1.679 307 2HD2 LEU 36 HD22 LEU 36 0.902 1.795 -2.349 308 3HD2 LEU 36 HD23 LEU 36 1.938 1.766 -0.922 309 H LEU 37 H LEU 37 -0.644 -1.969 -3.852 310 HA LEU 37 HA LEU 37 -3.465 -2.640 -4.408 311 1HB LEU 37 HB2 LEU 37 -0.803 -3.492 -5.444 312 2HB LEU 37 HB3 LEU 37 -2.119 -4.661 -5.545 313 HG LEU 37 HG LEU 37 -2.388 -1.808 -6.516 314 1HD1 LEU 37 HD11 LEU 37 -1.133 -4.186 -7.769 315 2HD1 LEU 37 HD12 LEU 37 -2.275 -3.304 -8.782 316 3HD1 LEU 37 HD13 LEU 37 -0.877 -2.473 -8.100 317 1HD2 LEU 37 HD21 LEU 37 -3.987 -4.360 -6.788 318 2HD2 LEU 37 HD22 LEU 37 -4.523 -2.798 -6.168 319 3HD2 LEU 37 HD23 LEU 37 -4.212 -3.003 -7.892 320 H LEU 38 H LEU 38 -4.355 -4.727 -3.879 321 HA LEU 38 HA LEU 38 -4.817 -6.484 -2.402 322 1HB LEU 38 HB2 LEU 38 -1.788 -6.576 -2.358 323 2HB LEU 38 HB3 LEU 38 -2.835 -7.829 -1.691 324 HG LEU 38 HG LEU 38 -2.910 -6.902 -4.578 325 1HD1 LEU 38 HD11 LEU 38 -1.283 -8.932 -3.153 326 2HD1 LEU 38 HD12 LEU 38 -2.040 -9.475 -4.651 327 3HD1 LEU 38 HD13 LEU 38 -0.955 -8.085 -4.664 328 1HD2 LEU 38 HD21 LEU 38 -4.174 -9.263 -3.146 329 2HD2 LEU 38 HD22 LEU 38 -5.030 -7.832 -3.719 330 3HD2 LEU 38 HD23 LEU 38 -4.286 -8.936 -4.875 331 H VAL 39 H VAL 39 -4.552 -3.730 -1.281 332 HA VAL 39 HA VAL 39 -4.275 -4.579 1.539 333 HB VAL 39 HB VAL 39 -2.779 -2.752 2.129 334 1HG1 VAL 39 HG11 VAL 39 -1.799 -4.388 -0.227 335 2HG1 VAL 39 HG12 VAL 39 -0.747 -3.476 0.853 336 3HG1 VAL 39 HG13 VAL 39 -1.693 -4.826 1.478 337 1HG2 VAL 39 HG21 VAL 39 -3.724 -1.432 -0.004 338 2HG2 VAL 39 HG22 VAL 39 -2.151 -1.056 0.698 339 3HG2 VAL 39 HG23 VAL 39 -2.255 -2.082 -0.734 340 H ASP 40 H ASP 40 -4.816 -2.488 2.958 341 HA ASP 40 HA ASP 40 -6.690 -0.640 1.666 342 1HB ASP 40 HB2 ASP 40 -8.041 -2.726 2.017 343 2HB ASP 40 HB3 ASP 40 -7.720 -2.592 3.746 344 H THR 41 H THR 41 -6.651 1.263 2.793 345 HA THR 41 HA THR 41 -5.120 1.345 5.307 346 HB THR 41 HB THR 41 -4.605 3.102 3.768 347 HG1 THR 41 HG1 THR 41 -4.646 4.446 5.355 348 1HG2 THR 41 HG21 THR 41 -7.479 2.973 3.267 349 2HG2 THR 41 HG22 THR 41 -6.899 4.631 3.425 350 3HG2 THR 41 HG23 THR 41 -6.184 3.557 2.222 351 HA PRO 42 HA PRO 42 -8.653 1.467 7.943 352 1HB PRO 42 HB2 PRO 42 -7.474 2.628 10.115 353 2HB PRO 42 HB3 PRO 42 -7.153 0.956 9.622 354 1HG PRO 42 HG2 PRO 42 -5.450 3.384 9.276 355 2HG PRO 42 HG3 PRO 42 -4.969 1.699 9.533 356 1HD PRO 42 HD2 PRO 42 -4.953 3.016 7.063 357 2HD PRO 42 HD3 PRO 42 -4.934 1.252 7.283 358 H GLU 43 H GLU 43 -9.169 3.441 9.883 359 HA GLU 43 HA GLU 43 -10.627 5.395 8.546 360 1HB GLU 43 HB2 GLU 43 -10.488 4.866 11.089 361 2HB GLU 43 HB3 GLU 43 -9.197 6.069 11.111 362 1HG GLU 43 HG2 GLU 43 -11.055 7.406 11.536 363 2HG GLU 43 HG3 GLU 43 -10.942 7.531 9.781 364 H THR 44 H THR 44 -10.113 7.203 7.402 365 HA THR 44 HA THR 44 -7.526 8.553 7.872 366 HB THR 44 HB THR 44 -8.306 7.631 5.093 367 HG1 THR 44 HG1 THR 44 -6.607 6.124 5.389 368 1HG2 THR 44 HG21 THR 44 -6.090 9.215 6.304 369 2HG2 THR 44 HG22 THR 44 -5.677 8.121 4.985 370 3HG2 THR 44 HG23 THR 44 -6.872 9.394 4.733 371 H LYS 45 H LYS 45 -10.398 9.195 8.217 372 HA LYS 45 HA LYS 45 -10.656 11.415 6.232 373 1HB LYS 45 HB2 LYS 45 -12.544 9.511 7.301 374 2HB LYS 45 HB3 LYS 45 -13.056 11.151 7.704 375 1HG LYS 45 HG2 LYS 45 -13.934 10.421 5.497 376 2HG LYS 45 HG3 LYS 45 -12.865 11.817 5.354 377 1HD LYS 45 HD2 LYS 45 -11.685 10.627 3.846 378 2HD LYS 45 HD3 LYS 45 -11.149 9.619 5.191 379 1HE LYS 45 HE2 LYS 45 -12.196 7.893 4.187 380 2HE LYS 45 HE3 LYS 45 -13.720 8.684 4.592 381 1HZ LYS 45 HZ1 LYS 45 -13.023 10.053 2.430 382 2HZ LYS 45 HZ2 LYS 45 -12.309 8.558 2.056 383 3HZ LYS 45 HZ3 LYS 45 -13.976 8.652 2.370 384 H HIS 46 H HIS 46 -8.880 12.103 8.048 385 HA HIS 46 HA HIS 46 -9.493 12.951 10.599 386 1HB HIS 46 HB2 HIS 46 -8.086 14.827 8.703 387 2HB HIS 46 HB3 HIS 46 -7.759 14.535 10.408 388 HD1 HIS 46 HD1 HIS 46 -5.907 14.066 7.660 389 HD2 HIS 46 HD2 HIS 46 -7.471 11.236 10.290 390 HE1 HIS 46 HE1 HIS 46 -4.490 11.984 7.397 391 HA PRO 47 HA PRO 47 -12.991 15.624 9.490 392 1HB PRO 47 HB2 PRO 47 -14.186 15.407 11.938 393 2HB PRO 47 HB3 PRO 47 -14.355 14.183 10.668 394 1HG PRO 47 HG2 PRO 47 -12.706 14.106 13.151 395 2HG PRO 47 HG3 PRO 47 -13.482 12.780 12.272 396 1HD PRO 47 HD2 PRO 47 -10.756 13.439 12.143 397 2HD PRO 47 HD3 PRO 47 -11.626 12.413 10.983 398 H LYS 48 H LYS 48 -12.247 15.900 12.965 399 HA LYS 48 HA LYS 48 -11.696 18.797 12.510 400 1HB LYS 48 HB2 LYS 48 -13.533 18.229 14.092 401 2HB LYS 48 HB3 LYS 48 -12.375 17.349 15.090 402 1HG LYS 48 HG2 LYS 48 -11.025 19.495 15.225 403 2HG LYS 48 HG3 LYS 48 -12.398 20.313 14.479 404 1HD LYS 48 HD2 LYS 48 -13.786 19.956 16.326 405 2HD LYS 48 HD3 LYS 48 -12.832 18.589 16.902 406 1HE LYS 48 HE2 LYS 48 -11.001 20.655 16.952 407 2HE LYS 48 HE3 LYS 48 -12.496 21.456 17.437 408 1HZ LYS 48 HZ1 LYS 48 -11.846 18.864 18.638 409 2HZ LYS 48 HZ2 LYS 48 -10.999 20.232 19.176 410 3HZ LYS 48 HZ3 LYS 48 -12.692 20.181 19.298 411 H LYS 49 H LYS 49 -10.502 15.984 14.363 412 HA LYS 49 HA LYS 49 -7.741 16.879 13.950 413 1HB LYS 49 HB2 LYS 49 -8.521 18.191 15.950 414 2HB LYS 49 HB3 LYS 49 -8.815 16.661 16.779 415 1HG LYS 49 HG2 LYS 49 -6.647 17.215 17.486 416 2HG LYS 49 HG3 LYS 49 -6.345 16.116 16.140 417 1HD LYS 49 HD2 LYS 49 -5.954 17.975 14.632 418 2HD LYS 49 HD3 LYS 49 -6.433 19.135 15.873 419 1HE LYS 49 HE2 LYS 49 -4.507 17.856 17.238 420 2HE LYS 49 HE3 LYS 49 -3.901 17.586 15.603 421 1HZ LYS 49 HZ1 LYS 49 -4.783 20.272 16.423 422 2HZ LYS 49 HZ2 LYS 49 -3.238 19.720 16.862 423 3HZ LYS 49 HZ3 LYS 49 -3.664 19.828 15.224 424 H GLY 50 H GLY 50 -8.253 14.675 12.864 425 1HA GLY 50 HA2 GLY 50 -7.431 12.438 12.894 426 2HA GLY 50 HA3 GLY 50 -7.202 12.574 14.638 427 H VAL 51 H VAL 51 -8.279 10.308 14.301 428 HA VAL 51 HA VAL 51 -11.199 10.688 14.762 429 HB VAL 51 HB VAL 51 -10.158 8.326 13.203 430 1HG1 VAL 51 HG11 VAL 51 -12.654 9.089 14.274 431 2HG1 VAL 51 HG12 VAL 51 -12.780 9.349 12.533 432 3HG1 VAL 51 HG13 VAL 51 -12.338 7.761 13.158 433 1HG2 VAL 51 HG21 VAL 51 -10.781 11.113 12.251 434 2HG2 VAL 51 HG22 VAL 51 -9.468 10.042 11.761 435 3HG2 VAL 51 HG23 VAL 51 -11.112 9.732 11.205 436 H GLU 52 H GLU 52 -8.477 9.889 16.196 437 HA GLU 52 HA GLU 52 -7.953 8.571 18.063 438 1HB GLU 52 HB2 GLU 52 -10.944 8.549 17.999 439 2HB GLU 52 HB3 GLU 52 -10.128 7.404 19.064 440 1HG GLU 52 HG2 GLU 52 -8.763 9.394 19.920 441 2HG GLU 52 HG3 GLU 52 -9.925 10.421 19.079 442 H LYS 53 H LYS 53 -10.655 6.486 17.211 443 HA LYS 53 HA LYS 53 -9.293 4.075 17.266 444 1HB LYS 53 HB2 LYS 53 -11.840 4.824 16.600 445 2HB LYS 53 HB3 LYS 53 -11.231 4.253 15.046 446 1HG LYS 53 HG2 LYS 53 -11.599 2.147 15.749 447 2HG LYS 53 HG3 LYS 53 -10.325 2.381 16.947 448 1HD LYS 53 HD2 LYS 53 -13.162 3.302 17.431 449 2HD LYS 53 HD3 LYS 53 -12.624 1.674 17.847 450 1HE LYS 53 HE2 LYS 53 -11.549 2.409 19.688 451 2HE LYS 53 HE3 LYS 53 -10.740 3.687 18.781 452 1HZ LYS 53 HZ1 LYS 53 -13.587 3.896 19.548 453 2HZ LYS 53 HZ2 LYS 53 -12.349 4.383 20.600 454 3HZ LYS 53 HZ3 LYS 53 -12.520 5.137 19.087 455 H TYR 54 H TYR 54 -7.209 4.163 16.355 456 HA TYR 54 HA TYR 54 -5.583 4.289 14.646 457 1HB TYR 54 HB2 TYR 54 -7.771 2.921 13.060 458 2HB TYR 54 HB3 TYR 54 -6.029 2.763 12.836 459 HD1 TYR 54 HD1 TYR 54 -4.675 1.954 14.945 460 HD2 TYR 54 HD2 TYR 54 -8.893 1.360 14.389 461 HE1 TYR 54 HE1 TYR 54 -4.630 0.095 16.587 462 HE2 TYR 54 HE2 TYR 54 -8.848 -0.498 16.031 463 HH TYR 54 HH TYR 54 -5.904 -1.277 17.842 464 H GLY 55 H GLY 55 -6.819 6.737 14.780 465 1HA GLY 55 HA2 GLY 55 -7.974 7.510 12.228 466 2HA GLY 55 HA3 GLY 55 -7.450 8.616 13.497 467 HA PRO 56 HA PRO 56 -3.996 9.497 10.852 468 1HB PRO 56 HB2 PRO 56 -2.676 11.123 12.604 469 2HB PRO 56 HB3 PRO 56 -4.138 11.626 11.737 470 1HG PRO 56 HG2 PRO 56 -3.812 10.858 14.594 471 2HG PRO 56 HG3 PRO 56 -4.979 11.962 13.851 472 1HD PRO 56 HD2 PRO 56 -5.493 9.302 14.653 473 2HD PRO 56 HD3 PRO 56 -6.534 10.302 13.617 474 H GLU 57 H GLU 57 -2.357 8.028 10.518 475 HA GLU 57 HA GLU 57 -0.206 7.634 12.342 476 1HB GLU 57 HB2 GLU 57 -2.143 6.401 13.521 477 2HB GLU 57 HB3 GLU 57 -2.004 5.210 12.226 478 1HG GLU 57 HG2 GLU 57 -0.289 4.252 13.321 479 2HG GLU 57 HG3 GLU 57 0.631 5.747 13.148 480 H ALA 58 H ALA 58 -2.140 5.671 10.043 481 HA ALA 58 HA ALA 58 0.139 4.416 8.840 482 1HB ALA 58 HB1 ALA 58 -2.604 4.153 8.614 483 2HB ALA 58 HB2 ALA 58 -2.152 4.829 7.049 484 3HB ALA 58 HB3 ALA 58 -1.418 3.324 7.604 485 H SER 59 H SER 59 -1.660 7.376 8.049 486 HA SER 59 HA SER 59 -0.419 7.973 5.576 487 1HB SER 59 HB2 SER 59 -1.126 10.244 5.936 488 2HB SER 59 HB3 SER 59 -2.356 9.208 6.652 489 HG SER 59 HG SER 59 -0.299 10.679 7.919 490 H ALA 60 H ALA 60 0.554 9.011 8.863 491 HA ALA 60 HA ALA 60 2.959 10.315 8.020 492 1HB ALA 60 HB1 ALA 60 1.614 10.078 10.398 493 2HB ALA 60 HB2 ALA 60 3.021 9.055 10.685 494 3HB ALA 60 HB3 ALA 60 3.239 10.746 10.237 495 H PHE 61 H PHE 61 2.177 6.968 8.689 496 HA PHE 61 HA PHE 61 4.835 5.970 9.006 497 1HB PHE 61 HB2 PHE 61 2.694 4.712 9.486 498 2HB PHE 61 HB3 PHE 61 2.502 4.507 7.746 499 HD1 PHE 61 HD1 PHE 61 4.136 3.175 6.444 500 HD2 PHE 61 HD2 PHE 61 4.369 3.482 10.723 501 HE1 PHE 61 HE1 PHE 61 5.675 1.231 6.500 502 HE2 PHE 61 HE2 PHE 61 5.908 1.537 10.777 503 HZ PHE 61 HZ PHE 61 6.561 0.412 8.667 504 H THR 62 H THR 62 2.759 5.727 6.110 505 HA THR 62 HA THR 62 4.915 5.019 4.362 506 HB THR 62 HB THR 62 2.217 6.266 3.758 507 HG1 THR 62 HG1 THR 62 1.529 4.289 3.847 508 1HG2 THR 62 HG21 THR 62 4.466 5.328 2.021 509 2HG2 THR 62 HG22 THR 62 2.809 5.051 1.484 510 3HG2 THR 62 HG23 THR 62 3.372 6.693 1.795 511 H LYS 63 H LYS 63 3.839 8.080 5.610 512 HA LYS 63 HA LYS 63 4.991 9.718 3.522 513 1HB LYS 63 HB2 LYS 63 3.290 10.613 5.064 514 2HB LYS 63 HB3 LYS 63 4.397 10.390 6.420 515 1HG LYS 63 HG2 LYS 63 5.905 12.037 5.596 516 2HG LYS 63 HG3 LYS 63 5.132 12.060 4.010 517 1HD LYS 63 HD2 LYS 63 3.000 12.772 5.382 518 2HD LYS 63 HD3 LYS 63 4.186 13.262 6.591 519 1HE LYS 63 HE2 LYS 63 5.271 14.750 5.041 520 2HE LYS 63 HE3 LYS 63 4.320 14.125 3.693 521 1HZ LYS 63 HZ1 LYS 63 2.990 15.314 6.039 522 2HZ LYS 63 HZ2 LYS 63 3.602 16.309 4.806 523 3HZ LYS 63 HZ3 LYS 63 2.412 15.155 4.449 524 H LYS 64 H LYS 64 6.083 9.623 6.905 525 HA LYS 64 HA LYS 64 8.705 10.494 6.438 526 1HB LYS 64 HB2 LYS 64 7.269 9.538 8.640 527 2HB LYS 64 HB3 LYS 64 8.636 8.434 8.497 528 1HG LYS 64 HG2 LYS 64 9.938 10.000 9.453 529 2HG LYS 64 HG3 LYS 64 9.672 11.025 8.043 530 1HD LYS 64 HD2 LYS 64 8.790 12.438 9.619 531 2HD LYS 64 HD3 LYS 64 7.348 11.461 9.342 532 1HE LYS 64 HE2 LYS 64 7.397 10.724 11.466 533 2HE LYS 64 HE3 LYS 64 9.042 10.128 11.249 534 1HZ LYS 64 HZ1 LYS 64 9.326 12.832 11.411 535 2HZ LYS 64 HZ2 LYS 64 8.125 12.499 12.561 536 3HZ LYS 64 HZ3 LYS 64 9.633 11.721 12.659 537 H MET 65 H MET 65 7.309 7.308 5.978 538 HA MET 65 HA MET 65 9.733 5.814 5.771 539 1HB MET 65 HB2 MET 65 7.362 4.894 5.898 540 2HB MET 65 HB3 MET 65 7.208 5.297 4.188 541 1HG MET 65 HG2 MET 65 8.951 3.789 3.573 542 2HG MET 65 HG3 MET 65 9.472 3.596 5.246 543 1HE MET 65 HE1 MET 65 9.582 1.239 4.464 544 2HE MET 65 HE2 MET 65 9.039 1.113 6.136 545 3HE MET 65 HE3 MET 65 8.310 0.096 4.885 546 H VAL 66 H VAL 66 7.654 6.842 3.061 547 HA VAL 66 HA VAL 66 9.682 6.479 1.077 548 HB VAL 66 HB VAL 66 8.202 7.755 -0.402 549 1HG1 VAL 66 HG11 VAL 66 6.668 6.007 1.547 550 2HG1 VAL 66 HG12 VAL 66 6.133 6.439 -0.076 551 3HG1 VAL 66 HG13 VAL 66 7.568 5.437 0.142 552 1HG2 VAL 66 HG21 VAL 66 6.910 8.548 2.217 553 2HG2 VAL 66 HG22 VAL 66 7.566 9.608 0.971 554 3HG2 VAL 66 HG23 VAL 66 6.080 8.707 0.670 555 H GLU 67 H GLU 67 9.344 8.878 3.468 556 HA GLU 67 HA GLU 67 10.601 11.037 1.947 557 1HB GLU 67 HB2 GLU 67 9.677 10.634 4.759 558 2HB GLU 67 HB3 GLU 67 10.890 11.881 4.461 559 1HG GLU 67 HG2 GLU 67 8.807 12.000 2.454 560 2HG GLU 67 HG3 GLU 67 8.111 12.102 4.071 561 H ASN 68 H ASN 68 11.629 8.610 4.311 562 HA ASN 68 HA ASN 68 14.425 9.592 4.070 563 1HB ASN 68 HB2 ASN 68 13.332 7.413 5.872 564 2HB ASN 68 HB3 ASN 68 14.912 8.187 5.985 565 1HD2 ASN 68 HD21 ASN 68 12.366 8.162 7.821 566 2HD2 ASN 68 HD22 ASN 68 12.149 9.805 8.190 567 H ALA 69 H ALA 69 12.428 7.473 2.492 568 HA ALA 69 HA ALA 69 14.106 5.151 2.230 569 1HB ALA 69 HB1 ALA 69 11.562 5.786 1.442 570 2HB ALA 69 HB2 ALA 69 12.427 5.864 -0.093 571 3HB ALA 69 HB3 ALA 69 12.455 4.381 0.861 572 H LYS 70 H LYS 70 16.044 5.056 1.211 573 HA LYS 70 HA LYS 70 16.914 7.275 -0.500 574 1HB LYS 70 HB2 LYS 70 18.408 4.692 -0.018 575 2HB LYS 70 HB3 LYS 70 19.071 6.276 -0.419 576 1HG LYS 70 HG2 LYS 70 17.987 7.059 1.805 577 2HG LYS 70 HG3 LYS 70 17.892 5.340 2.193 578 1HD LYS 70 HD2 LYS 70 20.409 6.880 1.489 579 2HD LYS 70 HD3 LYS 70 19.975 6.264 3.083 580 1HE LYS 70 HE2 LYS 70 20.868 4.263 2.579 581 2HE LYS 70 HE3 LYS 70 19.793 4.117 1.189 582 1HZ LYS 70 HZ1 LYS 70 21.822 5.976 0.608 583 2HZ LYS 70 HZ2 LYS 70 22.540 4.552 1.182 584 3HZ LYS 70 HZ3 LYS 70 21.492 4.493 -0.154 585 H LYS 71 H LYS 71 15.221 4.392 -0.970 586 HA LYS 71 HA LYS 71 15.711 4.576 -3.896 587 1HB LYS 71 HB2 LYS 71 15.733 1.954 -2.369 588 2HB LYS 71 HB3 LYS 71 15.960 2.161 -4.107 589 1HG LYS 71 HG2 LYS 71 18.000 3.487 -3.682 590 2HG LYS 71 HG3 LYS 71 17.780 3.264 -1.945 591 1HD LYS 71 HD2 LYS 71 18.713 1.215 -2.016 592 2HD LYS 71 HD3 LYS 71 17.659 0.721 -3.340 593 1HE LYS 71 HE2 LYS 71 19.274 1.062 -4.883 594 2HE LYS 71 HE3 LYS 71 19.703 2.629 -4.195 595 1HZ LYS 71 HZ1 LYS 71 20.662 1.042 -2.322 596 2HZ LYS 71 HZ2 LYS 71 20.808 -0.010 -3.643 597 3HZ LYS 71 HZ3 LYS 71 21.575 1.506 -3.676 598 H ILE 72 H ILE 72 13.743 4.781 -4.834 599 HA ILE 72 HA ILE 72 11.441 3.327 -3.603 600 HB ILE 72 HB ILE 72 11.379 6.117 -4.791 601 1HG1 ILE 72 HG12 ILE 72 10.632 5.722 -1.973 602 2HG1 ILE 72 HG13 ILE 72 12.328 5.372 -2.305 603 1HG2 ILE 72 HG21 ILE 72 9.301 4.242 -3.676 604 2HG2 ILE 72 HG22 ILE 72 9.063 5.988 -3.591 605 3HG2 ILE 72 HG23 ILE 72 9.247 5.199 -5.157 606 1HD1 ILE 72 HD11 ILE 72 11.249 7.832 -3.566 607 2HD1 ILE 72 HD12 ILE 72 11.403 7.872 -1.810 608 3HD1 ILE 72 HD13 ILE 72 12.818 7.546 -2.812 609 H GLU 73 H GLU 73 11.051 1.752 -5.107 610 HA GLU 73 HA GLU 73 10.824 2.631 -7.958 611 1HB GLU 73 HB2 GLU 73 12.082 0.168 -6.769 612 2HB GLU 73 HB3 GLU 73 11.429 0.130 -8.408 613 1HG GLU 73 HG2 GLU 73 13.027 1.568 -9.228 614 2HG GLU 73 HG3 GLU 73 13.187 2.430 -7.698 615 H VAL 74 H VAL 74 8.964 1.978 -9.011 616 HA VAL 74 HA VAL 74 6.932 0.602 -7.338 617 HB VAL 74 HB VAL 74 5.390 1.334 -9.237 618 1HG1 VAL 74 HG11 VAL 74 6.545 2.787 -7.079 619 2HG1 VAL 74 HG12 VAL 74 6.382 3.904 -8.434 620 3HG1 VAL 74 HG13 VAL 74 4.970 3.038 -7.831 621 1HG2 VAL 74 HG21 VAL 74 7.474 1.604 -10.780 622 2HG2 VAL 74 HG22 VAL 74 6.188 2.805 -10.896 623 3HG2 VAL 74 HG23 VAL 74 7.657 3.172 -9.993 624 H GLU 75 H GLU 75 5.829 -1.269 -8.134 625 HA GLU 75 HA GLU 75 7.159 -2.587 -10.468 626 1HB GLU 75 HB2 GLU 75 7.624 -3.489 -8.042 627 2HB GLU 75 HB3 GLU 75 6.008 -4.181 -8.195 628 1HG GLU 75 HG2 GLU 75 6.675 -5.313 -10.277 629 2HG GLU 75 HG3 GLU 75 8.288 -4.611 -10.148 630 H PHE 76 H PHE 76 5.636 -2.524 -12.059 631 HA PHE 76 HA PHE 76 2.780 -2.595 -11.461 632 1HB PHE 76 HB2 PHE 76 4.317 -2.737 -14.072 633 2HB PHE 76 HB3 PHE 76 2.559 -2.663 -13.964 634 HD1 PHE 76 HD1 PHE 76 1.708 -0.733 -12.250 635 HD2 PHE 76 HD2 PHE 76 5.418 -0.722 -14.417 636 HE1 PHE 76 HE1 PHE 76 1.824 1.736 -12.037 637 HE2 PHE 76 HE2 PHE 76 5.535 1.747 -14.204 638 HZ PHE 76 HZ PHE 76 3.738 2.974 -13.015 639 H ASP 77 H ASP 77 1.432 -4.376 -11.589 640 HA ASP 77 HA ASP 77 2.685 -7.007 -11.596 641 1HB ASP 77 HB2 ASP 77 0.371 -5.969 -10.509 642 2HB ASP 77 HB3 ASP 77 -0.241 -6.929 -11.857 643 H LYS 78 H LYS 78 0.520 -8.403 -12.953 644 HA LYS 78 HA LYS 78 1.400 -7.892 -15.748 645 1HB LYS 78 HB2 LYS 78 0.456 -10.162 -16.185 646 2HB LYS 78 HB3 LYS 78 1.713 -10.178 -14.947 647 1HG LYS 78 HG2 LYS 78 -0.825 -9.663 -13.698 648 2HG LYS 78 HG3 LYS 78 -0.961 -11.102 -14.709 649 1HD LYS 78 HD2 LYS 78 1.503 -11.429 -13.480 650 2HD LYS 78 HD3 LYS 78 0.509 -10.721 -12.205 651 1HE LYS 78 HE2 LYS 78 -1.150 -12.613 -13.447 652 2HE LYS 78 HE3 LYS 78 0.422 -13.402 -13.318 653 1HZ LYS 78 HZ1 LYS 78 -0.749 -11.943 -11.033 654 2HZ LYS 78 HZ2 LYS 78 -1.163 -13.562 -11.344 655 3HZ LYS 78 HZ3 LYS 78 0.452 -13.140 -11.024 656 H GLY 79 H GLY 79 -1.124 -7.047 -13.766 657 1HA GLY 79 HA2 GLY 79 -3.257 -7.400 -15.773 658 2HA GLY 79 HA3 GLY 79 -3.453 -6.687 -14.171 659 H GLN 80 H GLN 80 -4.562 -4.858 -15.083 660 HA GLN 80 HA GLN 80 -3.424 -3.212 -17.147 661 1HB GLN 80 HB2 GLN 80 -5.492 -2.683 -15.002 662 2HB GLN 80 HB3 GLN 80 -5.030 -1.469 -16.195 663 1HG GLN 80 HG2 GLN 80 -5.478 -3.461 -17.895 664 2HG GLN 80 HG3 GLN 80 -6.506 -4.043 -16.585 665 1HE2 GLN 80 HE21 GLN 80 -7.605 -3.134 -19.086 666 2HE2 GLN 80 HE22 GLN 80 -8.492 -1.717 -18.788 667 H ARG 81 H ARG 81 -3.269 -0.657 -16.254 668 HA ARG 81 HA ARG 81 -1.212 -0.739 -14.083 669 1HB ARG 81 HB2 ARG 81 -0.651 -0.283 -16.740 670 2HB ARG 81 HB3 ARG 81 -0.847 1.355 -16.116 671 1HG ARG 81 HG2 ARG 81 0.888 1.103 -14.549 672 2HG ARG 81 HG3 ARG 81 0.823 -0.658 -14.624 673 1HD ARG 81 HD2 ARG 81 2.789 0.067 -15.837 674 2HD ARG 81 HD3 ARG 81 1.608 -0.516 -17.010 675 HE ARG 81 HE ARG 81 1.725 2.402 -16.440 676 1HH1 ARG 81 HH11 ARG 81 3.225 0.060 -18.336 677 2HH1 ARG 81 HH12 ARG 81 2.908 0.836 -19.851 678 1HH2 ARG 81 HH21 ARG 81 0.844 3.263 -18.479 679 2HH2 ARG 81 HH22 ARG 81 1.558 2.648 -19.933 680 H THR 82 H THR 82 -4.147 0.521 -15.107 681 HA THR 82 HA THR 82 -4.049 2.571 -12.988 682 HB THR 82 HB THR 82 -5.298 4.003 -14.968 683 HG1 THR 82 HG1 THR 82 -2.981 3.281 -16.264 684 1HG2 THR 82 HG21 THR 82 -2.562 3.977 -13.769 685 2HG2 THR 82 HG22 THR 82 -2.861 5.060 -15.129 686 3HG2 THR 82 HG23 THR 82 -3.824 5.204 -13.658 687 H ASP 83 H ASP 83 -6.098 2.946 -12.102 688 HA ASP 83 HA ASP 83 -8.232 1.122 -13.065 689 1HB ASP 83 HB2 ASP 83 -7.504 2.364 -10.486 690 2HB ASP 83 HB3 ASP 83 -9.236 2.315 -10.814 691 H LYS 84 H LYS 84 -10.510 2.424 -12.258 692 HA LYS 84 HA LYS 84 -10.919 4.314 -14.391 693 1HB LYS 84 HB2 LYS 84 -13.152 4.664 -13.312 694 2HB LYS 84 HB3 LYS 84 -12.776 2.962 -13.588 695 1HG LYS 84 HG2 LYS 84 -11.725 3.252 -11.115 696 2HG LYS 84 HG3 LYS 84 -13.008 4.459 -11.030 697 1HD LYS 84 HD2 LYS 84 -14.220 2.270 -12.265 698 2HD LYS 84 HD3 LYS 84 -13.209 1.550 -11.012 699 1HE LYS 84 HE2 LYS 84 -14.250 2.854 -9.295 700 2HE LYS 84 HE3 LYS 84 -15.063 3.881 -10.477 701 1HZ LYS 84 HZ1 LYS 84 -15.946 1.493 -11.220 702 2HZ LYS 84 HZ2 LYS 84 -15.742 1.210 -9.560 703 3HZ LYS 84 HZ3 LYS 84 -16.753 2.471 -10.086 704 H TYR 85 H TYR 85 -10.485 4.666 -10.886 705 HA TYR 85 HA TYR 85 -10.956 7.455 -10.706 706 1HB TYR 85 HB2 TYR 85 -9.066 5.678 -9.139 707 2HB TYR 85 HB3 TYR 85 -9.429 7.348 -8.701 708 HD1 TYR 85 HD1 TYR 85 -10.870 3.960 -9.139 709 HD2 TYR 85 HD2 TYR 85 -11.530 7.954 -7.703 710 HE1 TYR 85 HE1 TYR 85 -12.938 3.209 -7.999 711 HE2 TYR 85 HE2 TYR 85 -13.600 7.203 -6.562 712 HH TYR 85 HH TYR 85 -15.302 5.172 -6.995 713 H GLY 86 H GLY 86 -8.414 5.744 -12.250 714 1HA GLY 86 HA2 GLY 86 -6.813 6.757 -13.715 715 2HA GLY 86 HA3 GLY 86 -7.124 8.310 -12.938 716 H ARG 87 H ARG 87 -6.608 5.601 -10.854 717 HA ARG 87 HA ARG 87 -4.014 6.799 -10.033 718 1HB ARG 87 HB2 ARG 87 -5.198 4.509 -8.536 719 2HB ARG 87 HB3 ARG 87 -4.407 5.962 -7.925 720 1HG ARG 87 HG2 ARG 87 -6.412 7.291 -8.573 721 2HG ARG 87 HG3 ARG 87 -7.205 5.800 -9.083 722 1HD ARG 87 HD2 ARG 87 -6.590 4.984 -6.657 723 2HD ARG 87 HD3 ARG 87 -6.492 6.711 -6.313 724 HE ARG 87 HE ARG 87 -8.864 6.899 -6.902 725 1HH1 ARG 87 HH11 ARG 87 -8.316 4.086 -8.398 726 2HH1 ARG 87 HH12 ARG 87 -9.495 3.135 -7.558 727 1HH2 ARG 87 HH21 ARG 87 -10.060 5.524 -5.107 728 2HH2 ARG 87 HH22 ARG 87 -10.482 3.950 -5.694 729 H GLY 88 H GLY 88 -2.089 5.625 -10.108 730 1HA GLY 88 HA2 GLY 88 -2.018 3.367 -11.956 731 2HA GLY 88 HA3 GLY 88 -0.625 4.074 -11.131 732 H LEU 89 H LEU 89 -1.470 1.199 -11.416 733 HA LEU 89 HA LEU 89 -1.679 0.570 -8.497 734 1HB LEU 89 HB2 LEU 89 -2.522 -1.208 -10.802 735 2HB LEU 89 HB3 LEU 89 -2.794 -1.494 -9.082 736 HG LEU 89 HG LEU 89 -3.950 0.787 -10.714 737 1HD1 LEU 89 HD11 LEU 89 -4.868 -1.650 -10.903 738 2HD1 LEU 89 HD12 LEU 89 -5.492 -1.364 -9.278 739 3HD1 LEU 89 HD13 LEU 89 -6.009 -0.336 -10.616 740 1HD2 LEU 89 HD21 LEU 89 -3.521 0.439 -7.866 741 2HD2 LEU 89 HD22 LEU 89 -4.163 1.838 -8.729 742 3HD2 LEU 89 HD23 LEU 89 -5.246 0.539 -8.226 743 H ALA 90 H ALA 90 0.204 -0.194 -7.713 744 HA ALA 90 HA ALA 90 1.655 -2.339 -8.984 745 1HB ALA 90 HB1 ALA 90 2.266 0.115 -10.073 746 2HB ALA 90 HB2 ALA 90 3.492 -0.043 -8.815 747 3HB ALA 90 HB3 ALA 90 3.348 -1.278 -10.066 748 H TYR 91 H TYR 91 3.207 -3.223 -7.538 749 HA TYR 91 HA TYR 91 2.858 -2.478 -4.755 750 1HB TYR 91 HB2 TYR 91 4.993 -4.297 -5.896 751 2HB TYR 91 HB3 TYR 91 4.331 -4.312 -4.262 752 HD1 TYR 91 HD1 TYR 91 1.924 -4.964 -3.903 753 HD2 TYR 91 HD2 TYR 91 3.899 -5.431 -7.688 754 HE1 TYR 91 HE1 TYR 91 0.154 -6.540 -4.631 755 HE2 TYR 91 HE2 TYR 91 2.129 -7.007 -8.417 756 HH TYR 91 HH TYR 91 -0.801 -7.413 -6.672 757 H ILE 92 H ILE 92 3.921 -0.824 -3.776 758 HA ILE 92 HA ILE 92 6.274 0.376 -5.066 759 HB ILE 92 HB ILE 92 5.059 1.113 -2.394 760 1HG1 ILE 92 HG12 ILE 92 4.350 2.293 -5.091 761 2HG1 ILE 92 HG13 ILE 92 3.392 1.023 -4.327 762 1HG2 ILE 92 HG21 ILE 92 7.330 2.010 -3.714 763 2HG2 ILE 92 HG22 ILE 92 6.109 3.201 -4.159 764 3HG2 ILE 92 HG23 ILE 92 6.459 2.890 -2.459 765 1HD1 ILE 92 HD11 ILE 92 3.449 2.635 -2.245 766 2HD1 ILE 92 HD12 ILE 92 3.800 3.867 -3.456 767 3HD1 ILE 92 HD13 ILE 92 2.305 2.936 -3.554 768 H TYR 93 H TYR 93 8.380 0.278 -4.266 769 HA TYR 93 HA TYR 93 8.805 -1.413 -1.836 770 1HB TYR 93 HB2 TYR 93 10.378 -1.497 -4.430 771 2HB TYR 93 HB3 TYR 93 10.792 -2.389 -2.967 772 HD1 TYR 93 HD1 TYR 93 8.346 -2.056 -5.717 773 HD2 TYR 93 HD2 TYR 93 9.508 -4.320 -2.257 774 HE1 TYR 93 HE1 TYR 93 6.780 -3.862 -6.373 775 HE2 TYR 93 HE2 TYR 93 7.942 -6.126 -2.912 776 HH TYR 93 HH TYR 93 6.902 -6.901 -5.244 777 H ALA 94 H ALA 94 10.117 -0.441 -0.356 778 HA ALA 94 HA ALA 94 11.802 1.845 -1.299 779 1HB ALA 94 HB1 ALA 94 9.985 1.554 1.057 780 2HB ALA 94 HB2 ALA 94 11.455 2.508 1.259 781 3HB ALA 94 HB3 ALA 94 10.271 2.959 0.031 782 H ASP 95 H ASP 95 13.941 1.674 -0.823 783 HA ASP 95 HA ASP 95 15.931 0.895 0.134 784 1HB ASP 95 HB2 ASP 95 13.923 0.528 2.278 785 2HB ASP 95 HB3 ASP 95 15.376 -0.461 2.422 786 H GLY 96 H GLY 96 13.716 -0.938 -1.298 787 1HA GLY 96 HA2 GLY 96 14.359 -2.988 -2.440 788 2HA GLY 96 HA3 GLY 96 15.431 -3.362 -1.091 789 H LYS 97 H LYS 97 12.771 -2.298 0.434 790 HA LYS 97 HA LYS 97 11.673 -5.065 0.649 791 1HB LYS 97 HB2 LYS 97 12.608 -3.694 2.680 792 2HB LYS 97 HB3 LYS 97 11.059 -2.855 2.594 793 1HG LYS 97 HG2 LYS 97 10.042 -4.572 3.625 794 2HG LYS 97 HG3 LYS 97 10.589 -5.676 2.362 795 1HD LYS 97 HD2 LYS 97 12.900 -5.293 3.789 796 2HD LYS 97 HD3 LYS 97 11.681 -5.222 5.063 797 1HE LYS 97 HE2 LYS 97 10.989 -7.406 4.715 798 2HE LYS 97 HE3 LYS 97 11.475 -7.401 3.019 799 1HZ LYS 97 HZ1 LYS 97 13.740 -6.982 4.626 800 2HZ LYS 97 HZ2 LYS 97 12.914 -8.342 5.211 801 3HZ LYS 97 HZ3 LYS 97 13.405 -8.284 3.585 802 H MET 98 H MET 98 9.261 -5.166 1.050 803 HA MET 98 HA MET 98 7.899 -3.453 -0.918 804 1HB MET 98 HB2 MET 98 7.469 -5.926 -0.761 805 2HB MET 98 HB3 MET 98 6.737 -5.651 0.820 806 1HG MET 98 HG2 MET 98 4.838 -4.779 -0.074 807 2HG MET 98 HG3 MET 98 5.722 -3.877 -1.304 808 1HE MET 98 HE1 MET 98 4.001 -6.935 -0.147 809 2HE MET 98 HE2 MET 98 4.115 -8.141 -1.426 810 3HE MET 98 HE3 MET 98 5.516 -7.798 -0.402 811 H VAL 99 H VAL 99 7.068 -1.532 -0.279 812 HA VAL 99 HA VAL 99 6.848 -0.634 2.388 813 HB VAL 99 HB VAL 99 5.335 0.210 -0.098 814 1HG1 VAL 99 HG11 VAL 99 4.108 0.802 1.994 815 2HG1 VAL 99 HG12 VAL 99 5.549 1.640 2.569 816 3HG1 VAL 99 HG13 VAL 99 4.704 2.222 1.135 817 1HG2 VAL 99 HG21 VAL 99 7.794 1.218 1.356 818 2HG2 VAL 99 HG22 VAL 99 7.684 0.646 -0.309 819 3HG2 VAL 99 HG23 VAL 99 6.941 2.179 0.148 820 H ASN 100 H ASN 100 4.287 -1.963 0.271 821 HA ASN 100 HA ASN 100 2.120 -1.816 2.035 822 1HB ASN 100 HB2 ASN 100 2.771 -4.134 0.188 823 2HB ASN 100 HB3 ASN 100 1.178 -3.733 0.831 824 1HD2 ASN 100 HD21 ASN 100 0.496 -3.474 -1.493 825 2HD2 ASN 100 HD22 ASN 100 0.859 -2.026 -2.303 826 H GLU 101 H GLU 101 4.434 -4.540 1.744 827 HA GLU 101 HA GLU 101 3.389 -6.068 3.897 828 1HB GLU 101 HB2 GLU 101 5.135 -6.801 2.198 829 2HB GLU 101 HB3 GLU 101 6.318 -5.901 3.148 830 1HG GLU 101 HG2 GLU 101 4.719 -7.562 4.887 831 2HG GLU 101 HG3 GLU 101 5.424 -8.541 3.600 832 H ALA 102 H ALA 102 5.530 -3.284 3.865 833 HA ALA 102 HA ALA 102 6.486 -3.505 6.556 834 1HB ALA 102 HB1 ALA 102 6.701 -1.645 4.411 835 2HB ALA 102 HB2 ALA 102 6.155 -0.751 5.831 836 3HB ALA 102 HB3 ALA 102 7.645 -1.692 5.899 837 H LEU 103 H LEU 103 3.660 -1.866 5.161 838 HA LEU 103 HA LEU 103 2.720 -0.732 7.619 839 1HB LEU 103 HB2 LEU 103 1.172 -1.564 5.145 840 2HB LEU 103 HB3 LEU 103 0.545 -0.540 6.436 841 HG LEU 103 HG LEU 103 3.121 0.416 5.480 842 1HD1 LEU 103 HD11 LEU 103 1.022 -0.304 3.499 843 2HD1 LEU 103 HD12 LEU 103 1.756 1.288 3.321 844 3HD1 LEU 103 HD13 LEU 103 2.767 -0.156 3.286 845 1HD2 LEU 103 HD21 LEU 103 1.211 1.558 6.823 846 2HD2 LEU 103 HD22 LEU 103 2.021 2.506 5.575 847 3HD2 LEU 103 HD23 LEU 103 0.442 1.789 5.253 848 H VAL 104 H VAL 104 1.844 -3.761 5.931 849 HA VAL 104 HA VAL 104 -0.070 -4.706 7.770 850 HB VAL 104 HB VAL 104 1.982 -6.330 6.236 851 1HG1 VAL 104 HG11 VAL 104 0.086 -7.116 8.177 852 2HG1 VAL 104 HG12 VAL 104 -0.607 -7.558 6.616 853 3HG1 VAL 104 HG13 VAL 104 0.982 -8.164 7.079 854 1HG2 VAL 104 HG21 VAL 104 -0.669 -5.097 5.528 855 2HG2 VAL 104 HG22 VAL 104 0.824 -5.128 4.592 856 3HG2 VAL 104 HG23 VAL 104 -0.157 -6.586 4.736 857 H ARG 105 H ARG 105 3.470 -4.874 7.899 858 HA ARG 105 HA ARG 105 3.668 -6.600 10.168 859 1HB ARG 105 HB2 ARG 105 5.607 -6.038 8.748 860 2HB ARG 105 HB3 ARG 105 5.526 -4.363 9.296 861 1HG ARG 105 HG2 ARG 105 6.430 -4.847 11.339 862 2HG ARG 105 HG3 ARG 105 5.620 -6.410 11.440 863 1HD ARG 105 HD2 ARG 105 7.432 -6.616 9.283 864 2HD ARG 105 HD3 ARG 105 8.317 -5.824 10.588 865 HE ARG 105 HE ARG 105 7.082 -7.918 11.874 866 1HH1 ARG 105 HH11 ARG 105 9.527 -7.387 9.557 867 2HH1 ARG 105 HH12 ARG 105 9.985 -9.054 9.437 868 1HH2 ARG 105 HH21 ARG 105 7.436 -10.179 11.501 869 2HH2 ARG 105 HH22 ARG 105 8.802 -10.634 10.539 870 H GLN 106 H GLN 106 3.581 -3.037 9.931 871 HA GLN 106 HA GLN 106 3.669 -2.619 12.784 872 1HB GLN 106 HB2 GLN 106 3.863 -0.994 10.565 873 2HB GLN 106 HB3 GLN 106 2.278 -0.562 11.206 874 1HG GLN 106 HG2 GLN 106 4.886 -0.576 12.751 875 2HG GLN 106 HG3 GLN 106 3.992 0.852 12.231 876 1HE2 GLN 106 HE21 GLN 106 4.538 -0.925 14.946 877 2HE2 GLN 106 HE22 GLN 106 3.059 -0.705 15.750 878 H GLY 107 H GLY 107 1.195 -3.624 10.626 879 1HA GLY 107 HA2 GLY 107 -0.986 -4.353 11.184 880 2HA GLY 107 HA3 GLY 107 -0.721 -3.779 12.830 881 H LEU 108 H LEU 108 -0.314 -1.850 9.889 882 HA LEU 108 HA LEU 108 -2.529 -0.104 10.883 883 1HB LEU 108 HB2 LEU 108 -0.137 0.619 9.161 884 2HB LEU 108 HB3 LEU 108 -1.388 1.740 9.700 885 HG LEU 108 HG LEU 108 0.575 0.218 11.435 886 1HD1 LEU 108 HD11 LEU 108 0.349 2.956 10.380 887 2HD1 LEU 108 HD12 LEU 108 0.617 2.886 12.122 888 3HD1 LEU 108 HD13 LEU 108 1.757 2.110 11.022 889 1HD2 LEU 108 HD21 LEU 108 -1.797 1.944 12.217 890 2HD2 LEU 108 HD22 LEU 108 -1.635 0.211 12.502 891 3HD2 LEU 108 HD23 LEU 108 -0.573 1.345 13.337 892 H ALA 109 H ALA 109 -1.484 -2.123 8.312 893 HA ALA 109 HA ALA 109 -3.829 -1.209 6.708 894 1HB ALA 109 HB1 ALA 109 -0.978 -1.540 5.837 895 2HB ALA 109 HB2 ALA 109 -2.266 -1.919 4.694 896 3HB ALA 109 HB3 ALA 109 -2.148 -0.301 5.383 897 H LYS 110 H LYS 110 -4.962 -2.894 5.696 898 HA LYS 110 HA LYS 110 -3.982 -5.644 6.340 899 1HB LYS 110 HB2 LYS 110 -6.211 -6.344 6.711 900 2HB LYS 110 HB3 LYS 110 -6.114 -4.770 7.498 901 1HG LYS 110 HG2 LYS 110 -7.171 -3.689 5.609 902 2HG LYS 110 HG3 LYS 110 -7.108 -5.179 4.670 903 1HD LYS 110 HD2 LYS 110 -8.577 -4.997 7.305 904 2HD LYS 110 HD3 LYS 110 -9.358 -4.641 5.764 905 1HE LYS 110 HE2 LYS 110 -8.039 -7.048 5.293 906 2HE LYS 110 HE3 LYS 110 -8.668 -7.227 6.931 907 1HZ LYS 110 HZ1 LYS 110 -10.829 -6.348 5.981 908 2HZ LYS 110 HZ2 LYS 110 -10.164 -6.638 4.448 909 3HZ LYS 110 HZ3 LYS 110 -10.385 -7.926 5.534 910 H VAL 111 H VAL 111 -4.626 -7.324 4.752 911 HA VAL 111 HA VAL 111 -4.182 -6.400 2.033 912 HB VAL 111 HB VAL 111 -5.058 -9.153 2.957 913 1HG1 VAL 111 HG11 VAL 111 -4.753 -8.099 0.404 914 2HG1 VAL 111 HG12 VAL 111 -3.210 -8.899 0.701 915 3HG1 VAL 111 HG13 VAL 111 -4.713 -9.813 0.821 916 1HG2 VAL 111 HG21 VAL 111 -2.312 -7.882 2.776 917 2HG2 VAL 111 HG22 VAL 111 -3.077 -8.578 4.205 918 3HG2 VAL 111 HG23 VAL 111 -2.566 -9.624 2.880 919 H ALA 112 H ALA 112 -5.697 -6.359 0.323 920 HA ALA 112 HA ALA 112 -8.405 -7.320 0.614 921 1HB ALA 112 HB1 ALA 112 -8.272 -5.216 2.122 922 2HB ALA 112 HB2 ALA 112 -8.205 -4.311 0.609 923 3HB ALA 112 HB3 ALA 112 -9.606 -5.321 0.972 924 H TYR 113 H TYR 113 -9.812 -6.216 -1.226 925 HA TYR 113 HA TYR 113 -10.061 -5.834 -3.525 926 1HB TYR 113 HB2 TYR 113 -7.254 -4.705 -3.294 927 2HB TYR 113 HB3 TYR 113 -8.384 -4.424 -4.619 928 HD1 TYR 113 HD1 TYR 113 -10.700 -3.412 -3.996 929 HD2 TYR 113 HD2 TYR 113 -7.257 -3.275 -1.430 930 HE1 TYR 113 HE1 TYR 113 -11.713 -1.531 -2.737 931 HE2 TYR 113 HE2 TYR 113 -8.271 -1.393 -0.172 932 HH TYR 113 HH TYR 113 -10.029 0.458 -0.732 933 H VAL 114 H VAL 114 -9.994 -8.203 -3.762 934 HA VAL 114 HA VAL 114 -7.404 -9.247 -4.805 935 HB VAL 114 HB VAL 114 -9.925 -10.747 -4.033 936 1HG1 VAL 114 HG11 VAL 114 -7.123 -11.666 -4.744 937 2HG1 VAL 114 HG12 VAL 114 -8.387 -12.716 -4.105 938 3HG1 VAL 114 HG13 VAL 114 -8.588 -11.952 -5.682 939 1HG2 VAL 114 HG21 VAL 114 -7.788 -9.607 -2.455 940 2HG2 VAL 114 HG22 VAL 114 -9.218 -10.481 -1.908 941 3HG2 VAL 114 HG23 VAL 114 -7.753 -11.366 -2.331 942 H TYR 115 H TYR 115 -7.367 -8.628 -6.961 943 HA TYR 115 HA TYR 115 -9.575 -9.708 -8.649 944 1HB TYR 115 HB2 TYR 115 -8.258 -7.019 -9.117 945 2HB TYR 115 HB3 TYR 115 -9.633 -7.700 -9.986 946 HD1 TYR 115 HD1 TYR 115 -11.842 -7.904 -8.898 947 HD2 TYR 115 HD2 TYR 115 -8.516 -6.051 -6.908 948 HE1 TYR 115 HE1 TYR 115 -13.391 -6.919 -7.229 949 HE2 TYR 115 HE2 TYR 115 -10.064 -5.066 -5.239 950 HH TYR 115 HH TYR 115 -13.017 -4.551 -5.553 951 H LYS 116 H LYS 116 -8.785 -10.923 -10.301 952 HA LYS 116 HA LYS 116 -5.861 -10.988 -10.729 953 1HB LYS 116 HB2 LYS 116 -7.958 -12.661 -12.131 954 2HB LYS 116 HB3 LYS 116 -6.247 -13.029 -11.915 955 1HG LYS 116 HG2 LYS 116 -6.752 -12.939 -9.377 956 2HG LYS 116 HG3 LYS 116 -8.447 -13.065 -9.852 957 1HD LYS 116 HD2 LYS 116 -7.029 -15.007 -11.361 958 2HD LYS 116 HD3 LYS 116 -6.477 -15.153 -9.692 959 1HE LYS 116 HE2 LYS 116 -9.337 -14.759 -9.749 960 2HE LYS 116 HE3 LYS 116 -8.897 -16.122 -10.777 961 1HZ LYS 116 HZ1 LYS 116 -7.425 -16.791 -8.802 962 2HZ LYS 116 HZ2 LYS 116 -8.404 -15.742 -7.896 963 3HZ LYS 116 HZ3 LYS 116 -9.097 -17.071 -8.696 964 HA PRO 117 HA PRO 117 -4.753 -11.973 -12.247 965 1HB PRO 117 HB2 PRO 117 -2.748 -11.312 -13.977 966 2HB PRO 117 HB3 PRO 117 -4.091 -12.377 -14.423 967 1HG PRO 117 HG2 PRO 117 -3.553 -9.606 -15.284 968 2HG PRO 117 HG3 PRO 117 -4.570 -10.839 -16.043 969 1HD PRO 117 HD2 PRO 117 -5.415 -8.627 -14.395 970 2HD PRO 117 HD3 PRO 117 -6.431 -9.875 -15.146 971 H ASN 118 H ASN 118 -5.214 -9.147 -11.236 972 HA ASN 118 HA ASN 118 -2.438 -8.222 -10.751 973 1HB ASN 118 HB2 ASN 118 -5.170 -7.033 -10.372 974 2HB ASN 118 HB3 ASN 118 -3.810 -6.392 -9.448 975 1HD2 ASN 118 HD21 ASN 118 -5.034 -4.736 -11.371 976 2HD2 ASN 118 HD22 ASN 118 -3.984 -4.527 -12.688 977 H ASN 119 H ASN 119 -2.111 -10.287 -9.430 978 HA ASN 119 HA ASN 119 -2.387 -9.632 -6.615 979 1HB ASN 119 HB2 ASN 119 -3.851 -11.377 -5.919 980 2HB ASN 119 HB3 ASN 119 -4.660 -10.609 -7.285 981 1HD2 ASN 119 HD21 ASN 119 -5.127 -13.369 -6.475 982 2HD2 ASN 119 HD22 ASN 119 -4.604 -14.365 -7.747 983 H THR 120 H THR 120 -0.355 -10.438 -8.682 984 HA THR 120 HA THR 120 0.593 -13.063 -8.333 985 HB THR 120 HB THR 120 2.288 -10.553 -8.538 986 HG1 THR 120 HG1 THR 120 1.565 -10.448 -10.487 987 1HG2 THR 120 HG21 THR 120 3.053 -13.190 -8.129 988 2HG2 THR 120 HG22 THR 120 3.187 -12.990 -9.876 989 3HG2 THR 120 HG23 THR 120 4.071 -11.913 -8.796 990 H HIS 121 H HIS 121 0.682 -10.339 -6.141 991 HA HIS 121 HA HIS 121 2.368 -11.910 -4.246 992 1HB HIS 121 HB2 HIS 121 1.563 -8.984 -4.209 993 2HB HIS 121 HB3 HIS 121 2.608 -9.766 -3.023 994 HD1 HIS 121 HD1 HIS 121 3.746 -11.506 -5.712 995 HD2 HIS 121 HD2 HIS 121 4.027 -7.443 -4.826 996 HE1 HIS 121 HE1 HIS 121 5.699 -10.614 -7.056 997 H GLU 122 H GLU 122 -0.187 -12.895 -4.530 998 HA GLU 122 HA GLU 122 -1.948 -11.688 -2.517 999 1HB GLU 122 HB2 GLU 122 -2.826 -12.808 -4.579 1000 2HB GLU 122 HB3 GLU 122 -2.221 -14.342 -3.955 1001 1HG GLU 122 HG2 GLU 122 -3.695 -13.115 -1.856 1002 2HG GLU 122 HG3 GLU 122 -4.680 -12.998 -3.313 1003 H GLN 123 H GLN 123 -0.494 -14.949 -2.863 1004 HA GLN 123 HA GLN 123 -1.017 -15.752 -0.186 1005 1HB GLN 123 HB2 GLN 123 0.369 -16.800 -2.464 1006 2HB GLN 123 HB3 GLN 123 1.411 -16.969 -1.050 1007 1HG GLN 123 HG2 GLN 123 -1.059 -17.699 -0.057 1008 2HG GLN 123 HG3 GLN 123 -1.097 -18.353 -1.695 1009 1HE2 GLN 123 HE21 GLN 123 1.705 -17.973 0.534 1010 2HE2 GLN 123 HE22 GLN 123 2.107 -19.622 0.551 1011 H LEU 124 H LEU 124 1.593 -13.840 -1.570 1012 HA LEU 124 HA LEU 124 3.396 -14.012 0.649 1013 1HB LEU 124 HB2 LEU 124 3.465 -12.822 -1.826 1014 2HB LEU 124 HB3 LEU 124 3.340 -11.426 -0.757 1015 HG LEU 124 HG LEU 124 5.678 -11.862 -0.978 1016 1HD1 LEU 124 HD11 LEU 124 4.686 -11.590 1.388 1017 2HD1 LEU 124 HD12 LEU 124 4.962 -13.322 1.568 1018 3HD1 LEU 124 HD13 LEU 124 6.322 -12.238 1.274 1019 1HD2 LEU 124 HD21 LEU 124 5.134 -14.290 -1.792 1020 2HD2 LEU 124 HD22 LEU 124 6.665 -13.992 -0.968 1021 3HD2 LEU 124 HD23 LEU 124 5.317 -14.717 -0.091 1022 H LEU 125 H LEU 125 1.323 -11.220 -0.225 1023 HA LEU 125 HA LEU 125 1.543 -9.893 2.258 1024 1HB LEU 125 HB2 LEU 125 -0.635 -9.923 0.165 1025 2HB LEU 125 HB3 LEU 125 -0.753 -8.919 1.612 1026 HG LEU 125 HG LEU 125 1.586 -8.858 -0.316 1027 1HD1 LEU 125 HD11 LEU 125 -0.989 -7.865 -0.735 1028 2HD1 LEU 125 HD12 LEU 125 -0.080 -6.469 -0.154 1029 3HD1 LEU 125 HD13 LEU 125 0.473 -7.352 -1.578 1030 1HD2 LEU 125 HD21 LEU 125 0.778 -7.221 2.100 1031 2HD2 LEU 125 HD22 LEU 125 2.274 -8.123 1.857 1032 3HD2 LEU 125 HD23 LEU 125 1.968 -6.656 0.928 1033 H ARG 126 H ARG 126 -0.208 -12.756 1.433 1034 HA ARG 126 HA ARG 126 -2.136 -12.581 3.606 1035 1HB ARG 126 HB2 ARG 126 -1.335 -14.624 1.586 1036 2HB ARG 126 HB3 ARG 126 -2.128 -15.205 3.050 1037 1HG ARG 126 HG2 ARG 126 -3.749 -13.128 2.479 1038 2HG ARG 126 HG3 ARG 126 -3.216 -13.530 0.846 1039 1HD ARG 126 HD2 ARG 126 -4.762 -15.171 0.853 1040 2HD ARG 126 HD3 ARG 126 -3.757 -16.005 2.038 1041 HE ARG 126 HE ARG 126 -6.306 -14.980 2.614 1042 1HH1 ARG 126 HH11 ARG 126 -3.944 -16.301 4.327 1043 2HH1 ARG 126 HH12 ARG 126 -4.015 -15.253 5.704 1044 1HH2 ARG 126 HH21 ARG 126 -6.031 -12.901 4.145 1045 2HH2 ARG 126 HH22 ARG 126 -5.192 -13.326 5.600 1046 H LYS 127 H LYS 127 1.038 -14.098 3.136 1047 HA LYS 127 HA LYS 127 1.048 -15.518 5.639 1048 1HB LYS 127 HB2 LYS 127 2.629 -16.162 3.925 1049 2HB LYS 127 HB3 LYS 127 3.306 -14.533 3.874 1050 1HG LYS 127 HG2 LYS 127 4.802 -15.889 5.196 1051 2HG LYS 127 HG3 LYS 127 3.944 -14.819 6.305 1052 1HD LYS 127 HD2 LYS 127 2.345 -17.148 5.995 1053 2HD LYS 127 HD3 LYS 127 3.999 -17.690 6.282 1054 1HE LYS 127 HE2 LYS 127 3.969 -15.846 8.161 1055 2HE LYS 127 HE3 LYS 127 2.220 -16.030 8.041 1056 1HZ LYS 127 HZ1 LYS 127 2.601 -18.472 8.295 1057 2HZ LYS 127 HZ2 LYS 127 4.219 -18.125 8.676 1058 3HZ LYS 127 HZ3 LYS 127 2.967 -17.549 9.669 1059 H SER 128 H SER 128 2.329 -12.351 4.654 1060 HA SER 128 HA SER 128 3.361 -11.676 7.259 1061 1HB SER 128 HB2 SER 128 2.453 -9.803 5.052 1062 2HB SER 128 HB3 SER 128 3.529 -9.401 6.388 1063 HG SER 128 HG SER 128 5.015 -10.007 5.020 1064 H GLU 129 H GLU 129 0.215 -11.411 5.730 1065 HA GLU 129 HA GLU 129 -0.934 -9.577 7.638 1066 1HB GLU 129 HB2 GLU 129 -1.829 -10.286 5.303 1067 2HB GLU 129 HB3 GLU 129 -2.508 -11.676 6.150 1068 1HG GLU 129 HG2 GLU 129 -2.980 -8.812 7.015 1069 2HG GLU 129 HG3 GLU 129 -4.074 -9.695 5.949 1070 H ALA 130 H ALA 130 -0.741 -13.118 7.435 1071 HA ALA 130 HA ALA 130 -2.390 -13.618 9.743 1072 1HB ALA 130 HB1 ALA 130 -1.876 -15.365 8.065 1073 2HB ALA 130 HB2 ALA 130 -0.181 -15.322 8.546 1074 3HB ALA 130 HB3 ALA 130 -1.408 -15.879 9.685 1075 H GLN 131 H GLN 131 1.025 -12.922 9.277 1076 HA GLN 131 HA GLN 131 1.872 -13.627 11.941 1077 1HB GLN 131 HB2 GLN 131 3.226 -13.012 9.705 1078 2HB GLN 131 HB3 GLN 131 3.248 -11.423 10.472 1079 1HG GLN 131 HG2 GLN 131 5.224 -12.773 11.117 1080 2HG GLN 131 HG3 GLN 131 4.208 -12.400 12.510 1081 1HE2 GLN 131 HE21 GLN 131 3.998 -14.199 13.835 1082 2HE2 GLN 131 HE22 GLN 131 3.879 -15.804 13.296 1083 H ALA 132 H ALA 132 0.627 -10.663 10.457 1084 HA ALA 132 HA ALA 132 1.026 -9.055 12.852 1085 1HB ALA 132 HB1 ALA 132 -0.024 -8.671 10.142 1086 2HB ALA 132 HB2 ALA 132 -0.946 -7.794 11.362 1087 3HB ALA 132 HB3 ALA 132 0.789 -7.519 11.202 1088 H LYS 133 H LYS 133 -1.493 -11.129 11.587 1089 HA LYS 133 HA LYS 133 -3.645 -10.160 13.233 1090 1HB LYS 133 HB2 LYS 133 -3.311 -12.148 11.269 1091 2HB LYS 133 HB3 LYS 133 -3.795 -13.017 12.725 1092 1HG LYS 133 HG2 LYS 133 -5.489 -10.873 12.807 1093 2HG LYS 133 HG3 LYS 133 -5.335 -11.120 11.067 1094 1HD LYS 133 HD2 LYS 133 -5.963 -13.354 13.012 1095 2HD LYS 133 HD3 LYS 133 -7.203 -12.439 12.153 1096 1HE LYS 133 HE2 LYS 133 -6.601 -13.307 10.079 1097 2HE LYS 133 HE3 LYS 133 -4.951 -13.660 10.592 1098 1HZ LYS 133 HZ1 LYS 133 -7.339 -15.068 11.650 1099 2HZ LYS 133 HZ2 LYS 133 -6.408 -15.644 10.351 1100 3HZ LYS 133 HZ3 LYS 133 -5.707 -15.482 11.886 1101 H LYS 134 H LYS 134 -1.399 -12.927 13.645 1102 HA LYS 134 HA LYS 134 -2.350 -13.621 16.262 1103 1HB LYS 134 HB2 LYS 134 0.041 -14.256 14.602 1104 2HB LYS 134 HB3 LYS 134 0.208 -14.485 16.342 1105 1HG LYS 134 HG2 LYS 134 -1.924 -15.703 14.563 1106 2HG LYS 134 HG3 LYS 134 -0.595 -16.560 15.345 1107 1HD LYS 134 HD2 LYS 134 -1.601 -15.515 17.544 1108 2HD LYS 134 HD3 LYS 134 -3.068 -15.380 16.573 1109 1HE LYS 134 HE2 LYS 134 -2.863 -17.814 16.018 1110 2HE LYS 134 HE3 LYS 134 -1.496 -17.912 17.128 1111 1HZ LYS 134 HZ1 LYS 134 -3.005 -17.023 18.874 1112 2HZ LYS 134 HZ2 LYS 134 -4.299 -17.199 17.786 1113 3HZ LYS 134 HZ3 LYS 134 -3.436 -18.564 18.303 1114 H GLU 135 H GLU 135 0.061 -11.349 15.077 1115 HA GLU 135 HA GLU 135 1.163 -10.701 17.673 1116 1HB GLU 135 HB2 GLU 135 1.187 -9.346 14.974 1117 2HB GLU 135 HB3 GLU 135 1.883 -8.565 16.394 1118 1HG GLU 135 HG2 GLU 135 3.102 -10.890 16.694 1119 2HG GLU 135 HG3 GLU 135 2.778 -11.047 14.967 1120 H LYS 136 H LYS 136 -1.743 -9.915 16.028 1121 HA LYS 136 HA LYS 136 -3.427 -8.331 16.458 1122 1HB LYS 136 HB2 LYS 136 -2.430 -9.057 19.223 1123 2HB LYS 136 HB3 LYS 136 -3.869 -8.076 18.949 1124 1HG LYS 136 HG2 LYS 136 -4.333 -10.171 17.254 1125 2HG LYS 136 HG3 LYS 136 -3.469 -10.977 18.563 1126 1HD LYS 136 HD2 LYS 136 -5.295 -9.196 19.793 1127 2HD LYS 136 HD3 LYS 136 -6.190 -10.029 18.522 1128 1HE LYS 136 HE2 LYS 136 -6.417 -11.567 20.238 1129 2HE LYS 136 HE3 LYS 136 -4.925 -12.153 19.501 1130 1HZ LYS 136 HZ1 LYS 136 -4.681 -10.071 21.529 1131 2HZ LYS 136 HZ2 LYS 136 -5.117 -11.622 22.071 1132 3HZ LYS 136 HZ3 LYS 136 -3.673 -11.400 21.208 1133 H LEU 137 H LEU 137 -1.676 -6.807 15.435 1134 HA LEU 137 HA LEU 137 -0.784 -4.783 17.434 1135 1HB LEU 137 HB2 LEU 137 0.481 -5.946 15.191 1136 2HB LEU 137 HB3 LEU 137 0.147 -4.271 14.751 1137 HG LEU 137 HG LEU 137 1.564 -5.190 17.270 1138 1HD1 LEU 137 HD11 LEU 137 2.492 -4.004 14.655 1139 2HD1 LEU 137 HD12 LEU 137 3.439 -3.812 16.131 1140 3HD1 LEU 137 HD13 LEU 137 3.110 -5.425 15.498 1141 1HD2 LEU 137 HD21 LEU 137 0.073 -2.878 16.849 1142 2HD2 LEU 137 HD22 LEU 137 1.324 -3.089 18.075 1143 3HD2 LEU 137 HD23 LEU 137 1.729 -2.369 16.516 1144 H ASN 138 H ASN 138 -2.451 -3.340 17.703 1145 HA ASN 138 HA ASN 138 -3.821 -1.522 17.142 1146 1HB ASN 138 HB2 ASN 138 -2.852 -1.843 14.297 1147 2HB ASN 138 HB3 ASN 138 -3.464 -0.385 15.078 1148 1HD2 ASN 138 HD21 ASN 138 -0.698 -1.164 13.857 1149 2HD2 ASN 138 HD22 ASN 138 0.402 -0.705 15.066 1150 H ILE 139 H ILE 139 -4.695 -1.837 13.999 1151 HA ILE 139 HA ILE 139 -7.327 -2.453 14.284 1152 HB ILE 139 HB ILE 139 -5.636 -3.602 12.049 1153 1HG1 ILE 139 HG12 ILE 139 -6.947 -1.073 11.495 1154 2HG1 ILE 139 HG13 ILE 139 -5.847 -0.915 12.865 1155 1HG2 ILE 139 HG21 ILE 139 -8.324 -3.896 12.547 1156 2HG2 ILE 139 HG22 ILE 139 -8.299 -2.468 11.512 1157 3HG2 ILE 139 HG23 ILE 139 -7.586 -3.978 10.947 1158 1HD1 ILE 139 HD11 ILE 139 -4.286 -2.378 11.221 1159 2HD1 ILE 139 HD12 ILE 139 -5.248 -1.523 10.016 1160 3HD1 ILE 139 HD13 ILE 139 -4.303 -0.615 11.195 1161 H TRP 140 H TRP 140 -4.705 -4.805 14.477 1162 HA TRP 140 HA TRP 140 -6.618 -7.048 14.500 1163 1HB TRP 140 HB2 TRP 140 -3.640 -7.107 15.063 1164 2HB TRP 140 HB3 TRP 140 -4.674 -8.479 14.667 1165 HD1 TRP 140 HD1 TRP 140 -2.582 -5.834 13.109 1166 HE1 TRP 140 HE1 TRP 140 -2.828 -5.902 10.543 1167 HE3 TRP 140 HE3 TRP 140 -6.583 -8.975 12.693 1168 HZ2 TRP 140 HZ2 TRP 140 -4.505 -7.126 8.575 1169 HZ3 TRP 140 HZ3 TRP 140 -7.487 -9.573 10.464 1170 HH2 TRP 140 HH2 TRP 140 -6.453 -8.654 8.408 1171 H SER 141 H SER 141 -7.233 -5.293 16.536 1172 HA SER 141 HA SER 141 -6.132 -6.594 18.991 1173 1HB SER 141 HB2 SER 141 -7.192 -3.871 18.379 1174 2HB SER 141 HB3 SER 141 -7.500 -4.514 19.991 1175 HG SER 141 HG SER 141 -5.177 -3.628 18.857 1176 H GLU 142 H GLU 142 -7.549 -8.460 18.729 1177 HA GLU 142 HA GLU 142 -10.457 -7.984 18.774 1178 1HB GLU 142 HB2 GLU 142 -8.926 -10.594 18.972 1179 2HB GLU 142 HB3 GLU 142 -10.648 -10.411 18.642 1180 1HG GLU 142 HG2 GLU 142 -8.732 -8.966 16.863 1181 2HG GLU 142 HG3 GLU 142 -8.885 -10.712 16.662 1182 H ASP 143 H ASP 143 -11.325 -10.040 20.435 1183 HA ASP 143 HA ASP 143 -10.500 -8.993 23.108 1184 1HB ASP 143 HB2 ASP 143 -12.947 -8.862 22.243 1185 2HB ASP 143 HB3 ASP 143 -12.996 -10.596 22.565 1186 H ASN 144 H ASN 144 -11.130 -11.970 21.280 1187 HA ASN 144 HA ASN 144 -9.202 -13.435 22.879 1188 1HB ASN 144 HB2 ASN 144 -10.900 -15.144 23.679 1189 2HB ASN 144 HB3 ASN 144 -10.980 -13.581 24.494 1190 1HD2 ASN 144 HD21 ASN 144 -13.320 -14.291 24.929 1191 2HD2 ASN 144 HD22 ASN 144 -14.477 -13.985 23.725 1192 H ALA 145 H ALA 145 -8.392 -15.053 21.604 1193 HA ALA 145 HA ALA 145 -10.118 -16.310 19.560 1194 1HB ALA 145 HB1 ALA 145 -7.789 -14.509 18.965 1195 2HB ALA 145 HB2 ALA 145 -8.116 -15.878 17.901 1196 3HB ALA 145 HB3 ALA 145 -9.341 -14.632 18.137 1197 H ASP 146 H ASP 146 -9.597 -18.452 19.397 1198 HA ASP 146 HA ASP 146 -6.969 -19.531 19.470 1199 1HB ASP 146 HB2 ASP 146 -7.761 -18.715 22.005 1200 2HB ASP 146 HB3 ASP 146 -8.133 -20.440 21.997 1201 H SER 147 H SER 147 -7.200 -22.038 20.197 1202 HA SER 147 HA SER 147 -9.267 -23.119 18.464 1203 1HB SER 147 HB2 SER 147 -6.830 -24.035 19.537 1204 2HB SER 147 HB3 SER 147 -8.065 -25.094 20.211 1205 HG SER 147 HG SER 147 -7.760 -24.424 17.464 1206 H GLY 148 H GLY 148 -10.418 -25.224 19.580 1207 1HA GLY 148 HA2 GLY 148 -11.975 -24.056 21.834 1208 2HA GLY 148 HA3 GLY 148 -12.537 -25.350 20.773 1209 H GLN 149 H GLN 149 -11.535 -24.809 23.844 1210 HA GLN 149 HA GLN 149 -9.807 -27.130 24.221 1211 1HB GLN 149 HB2 GLN 149 -9.700 -25.146 25.716 1212 2HB GLN 149 HB3 GLN 149 -11.338 -25.498 26.270 1213 1HG GLN 149 HG2 GLN 149 -10.066 -26.558 27.911 1214 2HG GLN 149 HG3 GLN 149 -10.341 -27.882 26.779 1215 1HE2 GLN 149 HE21 GLN 149 -7.897 -25.918 28.264 1216 2HE2 GLN 149 HE22 GLN 149 -6.573 -26.548 27.409 1217 HN3 PTP 150 H3 PTP 150 -8.283 -4.299 -8.291 1218 1H5M PTP 150 H51 PTP 150 -5.762 -1.413 -5.059 1219 2H5M PTP 150 H52 PTP 150 -6.150 -2.985 -4.321 1220 3H5M PTP 150 H53 PTP 150 -7.050 -1.528 -3.836 1221 H6 PTP 150 H6 PTP 150 -8.789 -0.676 -5.174 1222 H1* PTP 150 H1' PTP 150 -11.270 -1.012 -7.910 1223 2H2* PTP 150 H2' PTP 150 -11.290 -1.486 -4.928 1224 H3* PTP 150 H3' PTP 150 -12.377 0.587 -4.508 1225 H4* PTP 150 H4' PTP 150 -11.330 2.205 -6.462 1226 2H5* PTP 150 H5' PTP 150 -10.039 0.765 -4.083 Start of MODEL 30 1 1H ALA 1 H1 ALA 1 9.319 -21.142 -26.839 2 2H ALA 1 H2 ALA 1 8.361 -20.272 -27.941 3 3H ALA 1 H3 ALA 1 9.027 -19.487 -26.593 4 HA ALA 1 HA ALA 1 6.540 -20.711 -26.791 5 1HB ALA 1 HB1 ALA 1 8.608 -22.268 -25.283 6 2HB ALA 1 HB2 ALA 1 6.982 -22.155 -24.611 7 3HB ALA 1 HB3 ALA 1 7.227 -22.851 -26.212 8 H THR 2 H THR 2 8.863 -20.255 -24.100 9 HA THR 2 HA THR 2 7.010 -18.159 -23.047 10 HB THR 2 HB THR 2 9.133 -19.634 -21.474 11 HG1 THR 2 HG1 THR 2 6.930 -20.633 -20.760 12 1HG2 THR 2 HG21 THR 2 6.890 -17.749 -20.890 13 2HG2 THR 2 HG22 THR 2 7.250 -19.001 -19.701 14 3HG2 THR 2 HG23 THR 2 8.496 -17.842 -20.166 15 H SER 3 H SER 3 7.972 -16.209 -22.205 16 HA SER 3 HA SER 3 10.672 -15.665 -23.367 17 1HB SER 3 HB2 SER 3 8.331 -13.832 -22.794 18 2HB SER 3 HB3 SER 3 9.933 -13.243 -23.229 19 HG SER 3 HG SER 3 8.670 -13.460 -25.082 20 H THR 4 H THR 4 8.696 -14.219 -20.749 21 HA THR 4 HA THR 4 10.727 -14.902 -18.752 22 HB THR 4 HB THR 4 11.936 -13.022 -19.367 23 HG1 THR 4 HG1 THR 4 9.988 -11.632 -17.897 24 1HG2 THR 4 HG21 THR 4 9.268 -11.890 -20.213 25 2HG2 THR 4 HG22 THR 4 10.712 -10.884 -20.106 26 3HG2 THR 4 HG23 THR 4 10.670 -12.249 -21.220 27 H LYS 5 H LYS 5 9.738 -15.064 -16.780 28 HA LYS 5 HA LYS 5 7.030 -13.818 -16.514 29 1HB LYS 5 HB2 LYS 5 7.730 -16.523 -16.369 30 2HB LYS 5 HB3 LYS 5 7.551 -16.027 -14.686 31 1HG LYS 5 HG2 LYS 5 5.311 -15.465 -14.943 32 2HG LYS 5 HG3 LYS 5 5.478 -15.166 -16.674 33 1HD LYS 5 HD2 LYS 5 5.450 -17.456 -17.203 34 2HD LYS 5 HD3 LYS 5 5.878 -17.935 -15.560 35 1HE LYS 5 HE2 LYS 5 3.497 -16.502 -15.260 36 2HE LYS 5 HE3 LYS 5 3.244 -17.471 -16.712 37 1HZ LYS 5 HZ1 LYS 5 3.939 -19.430 -15.479 38 2HZ LYS 5 HZ2 LYS 5 4.170 -18.493 -14.081 39 3HZ LYS 5 HZ3 LYS 5 2.612 -18.687 -14.729 40 H LYS 6 H LYS 6 8.928 -12.118 -15.823 41 HA LYS 6 HA LYS 6 8.990 -12.260 -12.840 42 1HB LYS 6 HB2 LYS 6 11.249 -11.086 -13.014 43 2HB LYS 6 HB3 LYS 6 11.235 -12.783 -13.497 44 1HG LYS 6 HG2 LYS 6 11.229 -12.230 -15.815 45 2HG LYS 6 HG3 LYS 6 10.845 -10.540 -15.485 46 1HD LYS 6 HD2 LYS 6 13.010 -10.090 -14.645 47 2HD LYS 6 HD3 LYS 6 13.378 -11.804 -14.442 48 1HE LYS 6 HE2 LYS 6 13.060 -11.955 -17.015 49 2HE LYS 6 HE3 LYS 6 13.241 -10.201 -16.990 50 1HZ LYS 6 HZ1 LYS 6 15.254 -11.162 -15.390 51 2HZ LYS 6 HZ2 LYS 6 15.227 -12.218 -16.720 52 3HZ LYS 6 HZ3 LYS 6 15.417 -10.547 -16.961 53 H LEU 7 H LEU 7 8.747 -10.230 -11.805 54 HA LEU 7 HA LEU 7 7.365 -8.204 -13.378 55 1HB LEU 7 HB2 LEU 7 8.051 -8.602 -10.493 56 2HB LEU 7 HB3 LEU 7 7.650 -6.972 -11.035 57 HG LEU 7 HG LEU 7 5.918 -9.405 -11.555 58 1HD1 LEU 7 HD11 LEU 7 6.138 -7.559 -9.251 59 2HD1 LEU 7 HD12 LEU 7 4.501 -7.817 -9.853 60 3HD1 LEU 7 HD13 LEU 7 5.473 -9.191 -9.327 61 1HD2 LEU 7 HD21 LEU 7 5.986 -6.964 -12.841 62 2HD2 LEU 7 HD22 LEU 7 4.572 -8.014 -12.747 63 3HD2 LEU 7 HD23 LEU 7 4.769 -6.695 -11.593 64 H HIS 8 H HIS 8 8.079 -5.918 -13.445 65 HA HIS 8 HA HIS 8 11.058 -5.716 -13.504 66 1HB HIS 8 HB2 HIS 8 10.365 -3.679 -15.061 67 2HB HIS 8 HB3 HIS 8 10.473 -5.313 -15.711 68 HD1 HIS 8 HD1 HIS 8 8.401 -6.183 -16.809 69 HD2 HIS 8 HD2 HIS 8 7.562 -3.017 -14.232 70 HE1 HIS 8 HE1 HIS 8 5.933 -5.679 -17.074 71 H LYS 9 H LYS 9 11.739 -4.595 -11.738 72 HA LYS 9 HA LYS 9 9.959 -2.635 -10.450 73 1HB LYS 9 HB2 LYS 9 12.650 -3.823 -9.798 74 2HB LYS 9 HB3 LYS 9 12.072 -2.394 -8.939 75 1HG LYS 9 HG2 LYS 9 9.968 -4.369 -9.112 76 2HG LYS 9 HG3 LYS 9 11.414 -5.081 -8.395 77 1HD LYS 9 HD2 LYS 9 11.032 -2.438 -7.322 78 2HD LYS 9 HD3 LYS 9 9.537 -3.358 -7.146 79 1HE LYS 9 HE2 LYS 9 10.887 -3.786 -5.190 80 2HE LYS 9 HE3 LYS 9 10.908 -5.245 -6.181 81 1HZ LYS 9 HZ1 LYS 9 12.984 -3.251 -6.674 82 2HZ LYS 9 HZ2 LYS 9 13.105 -4.160 -5.244 83 3HZ LYS 9 HZ3 LYS 9 13.066 -4.944 -6.751 84 H GLU 10 H GLU 10 10.016 -0.491 -10.920 85 HA GLU 10 HA GLU 10 12.489 0.585 -12.218 86 1HB GLU 10 HB2 GLU 10 9.578 1.050 -12.844 87 2HB GLU 10 HB3 GLU 10 10.784 2.273 -13.244 88 1HG GLU 10 HG2 GLU 10 11.779 0.968 -14.858 89 2HG GLU 10 HG3 GLU 10 11.392 -0.539 -14.026 90 HA PRO 11 HA PRO 11 12.528 3.661 -9.071 91 1HB PRO 11 HB2 PRO 11 13.561 5.784 -10.442 92 2HB PRO 11 HB3 PRO 11 14.518 4.360 -10.000 93 1HG PRO 11 HG2 PRO 11 13.375 5.115 -12.653 94 2HG PRO 11 HG3 PRO 11 14.872 4.246 -12.280 95 1HD PRO 11 HD2 PRO 11 12.498 3.044 -13.132 96 2HD PRO 11 HD3 PRO 11 13.822 2.204 -12.296 97 H ALA 12 H ALA 12 11.721 5.912 -8.535 98 HA ALA 12 HA ALA 12 9.631 6.993 -10.315 99 1HB ALA 12 HB1 ALA 12 9.083 5.580 -7.727 100 2HB ALA 12 HB2 ALA 12 8.104 6.987 -8.143 101 3HB ALA 12 HB3 ALA 12 8.140 5.588 -9.217 102 H THR 13 H THR 13 8.473 8.832 -8.677 103 HA THR 13 HA THR 13 10.785 10.266 -7.430 104 HB THR 13 HB THR 13 8.538 11.588 -8.971 105 HG1 THR 13 HG1 THR 13 11.134 11.520 -9.942 106 1HG2 THR 13 HG21 THR 13 9.940 12.786 -7.129 107 2HG2 THR 13 HG22 THR 13 11.241 12.735 -8.319 108 3HG2 THR 13 HG23 THR 13 9.738 13.583 -8.690 109 H LEU 14 H LEU 14 10.360 11.209 -5.452 110 HA LEU 14 HA LEU 14 7.748 10.585 -4.228 111 1HB LEU 14 HB2 LEU 14 9.988 10.228 -3.059 112 2HB LEU 14 HB3 LEU 14 10.105 11.983 -2.941 113 HG LEU 14 HG LEU 14 9.115 10.851 -0.904 114 1HD1 LEU 14 HD11 LEU 14 8.612 13.268 -1.901 115 2HD1 LEU 14 HD12 LEU 14 6.994 12.593 -2.095 116 3HD1 LEU 14 HD13 LEU 14 7.734 12.664 -0.496 117 1HD2 LEU 14 HD21 LEU 14 7.811 9.196 -2.380 118 2HD2 LEU 14 HD22 LEU 14 6.934 9.897 -1.019 119 3HD2 LEU 14 HD23 LEU 14 6.668 10.511 -2.650 120 H ILE 15 H ILE 15 6.301 12.082 -5.139 121 HA ILE 15 HA ILE 15 6.998 14.938 -5.177 122 HB ILE 15 HB ILE 15 4.551 13.365 -5.999 123 1HG1 ILE 15 HG12 ILE 15 6.237 15.219 -7.674 124 2HG1 ILE 15 HG13 ILE 15 6.762 13.563 -7.371 125 1HG2 ILE 15 HG21 ILE 15 4.955 16.347 -5.757 126 2HG2 ILE 15 HG22 ILE 15 3.821 15.666 -6.924 127 3HG2 ILE 15 HG23 ILE 15 3.592 15.378 -5.200 128 1HD1 ILE 15 HD11 ILE 15 3.969 14.126 -8.348 129 2HD1 ILE 15 HD12 ILE 15 5.316 14.031 -9.484 130 3HD1 ILE 15 HD13 ILE 15 4.907 12.639 -8.481 131 H LYS 16 H LYS 16 4.100 13.269 -3.876 132 HA LYS 16 HA LYS 16 4.497 14.516 -1.253 133 1HB LYS 16 HB2 LYS 16 3.355 16.177 -3.017 134 2HB LYS 16 HB3 LYS 16 1.916 15.276 -2.539 135 1HG LYS 16 HG2 LYS 16 2.565 15.716 -0.129 136 2HG LYS 16 HG3 LYS 16 3.799 16.820 -0.740 137 1HD LYS 16 HD2 LYS 16 2.184 18.276 -1.689 138 2HD LYS 16 HD3 LYS 16 0.903 17.071 -1.558 139 1HE LYS 16 HE2 LYS 16 0.651 18.765 0.201 140 2HE LYS 16 HE3 LYS 16 1.049 17.202 0.913 141 1HZ LYS 16 HZ1 LYS 16 3.458 18.033 0.711 142 2HZ LYS 16 HZ2 LYS 16 2.764 19.574 0.578 143 3HZ LYS 16 HZ3 LYS 16 2.491 18.638 1.970 144 H ALA 17 H ALA 17 3.808 12.984 0.153 145 HA ALA 17 HA ALA 17 2.129 10.779 -0.713 146 1HB ALA 17 HB1 ALA 17 3.937 10.684 1.087 147 2HB ALA 17 HB2 ALA 17 2.802 11.524 2.143 148 3HB ALA 17 HB3 ALA 17 2.400 9.928 1.511 149 H ILE 18 H ILE 18 -0.034 10.339 -0.001 150 HA ILE 18 HA ILE 18 -1.489 12.769 0.970 151 HB ILE 18 HB ILE 18 -2.564 10.514 -0.751 152 1HG1 ILE 18 HG12 ILE 18 -2.228 13.316 -1.737 153 2HG1 ILE 18 HG13 ILE 18 -0.785 12.306 -1.642 154 1HG2 ILE 18 HG21 ILE 18 -3.840 12.500 0.834 155 2HG2 ILE 18 HG22 ILE 18 -4.036 12.981 -0.852 156 3HG2 ILE 18 HG23 ILE 18 -4.589 11.394 -0.318 157 1HD1 ILE 18 HD11 ILE 18 -3.219 11.088 -2.860 158 2HD1 ILE 18 HD12 ILE 18 -2.369 12.311 -3.807 159 3HD1 ILE 18 HD13 ILE 18 -1.519 10.860 -3.275 160 H ASP 19 H ASP 19 -1.674 9.193 0.935 161 HA ASP 19 HA ASP 19 -2.814 9.369 3.694 162 1HB ASP 19 HB2 ASP 19 -3.462 7.191 1.697 163 2HB ASP 19 HB3 ASP 19 -4.278 7.538 3.222 164 H GLY 20 H GLY 20 -2.776 6.532 4.101 165 1HA GLY 20 HA2 GLY 20 0.111 6.200 4.600 166 2HA GLY 20 HA3 GLY 20 -1.173 5.162 5.220 167 H ASP 21 H ASP 21 -2.296 5.093 2.370 168 HA ASP 21 HA ASP 21 -0.333 3.104 1.298 169 1HB ASP 21 HB2 ASP 21 -3.347 3.048 0.977 170 2HB ASP 21 HB3 ASP 21 -2.205 1.801 0.472 171 H THR 22 H THR 22 -1.877 6.046 0.755 172 HA THR 22 HA THR 22 -1.600 5.759 -2.207 173 HB THR 22 HB THR 22 -3.046 7.972 -0.734 174 HG1 THR 22 HG1 THR 22 -4.688 6.210 -1.886 175 1HG2 THR 22 HG21 THR 22 -3.087 6.927 -3.576 176 2HG2 THR 22 HG22 THR 22 -4.229 8.116 -2.951 177 3HG2 THR 22 HG23 THR 22 -2.510 8.502 -3.031 178 H VAL 23 H VAL 23 -0.109 7.054 -3.256 179 HA VAL 23 HA VAL 23 1.046 9.377 -1.850 180 HB VAL 23 HB VAL 23 3.387 8.484 -2.304 181 1HG1 VAL 23 HG11 VAL 23 2.251 8.518 -0.054 182 2HG1 VAL 23 HG12 VAL 23 1.736 6.856 -0.352 183 3HG1 VAL 23 HG13 VAL 23 3.453 7.239 -0.233 184 1HG2 VAL 23 HG21 VAL 23 2.116 6.561 -3.736 185 2HG2 VAL 23 HG22 VAL 23 3.717 6.334 -3.030 186 3HG2 VAL 23 HG23 VAL 23 2.289 5.724 -2.193 187 H LYS 24 H LYS 24 1.650 10.940 -3.301 188 HA LYS 24 HA LYS 24 1.174 10.400 -6.152 189 1HB LYS 24 HB2 LYS 24 2.042 12.952 -4.758 190 2HB LYS 24 HB3 LYS 24 1.488 12.821 -6.428 191 1HG LYS 24 HG2 LYS 24 -0.672 11.836 -5.501 192 2HG LYS 24 HG3 LYS 24 -0.113 12.342 -3.907 193 1HD LYS 24 HD2 LYS 24 0.203 14.510 -5.786 194 2HD LYS 24 HD3 LYS 24 -1.460 13.923 -5.821 195 1HE LYS 24 HE2 LYS 24 -1.406 14.017 -3.271 196 2HE LYS 24 HE3 LYS 24 0.103 14.915 -3.430 197 1HZ LYS 24 HZ1 LYS 24 -1.219 16.399 -5.007 198 2HZ LYS 24 HZ2 LYS 24 -2.602 15.684 -4.326 199 3HZ LYS 24 HZ3 LYS 24 -1.524 16.549 -3.343 200 H LEU 25 H LEU 25 2.829 9.517 -7.304 201 HA LEU 25 HA LEU 25 5.578 10.570 -6.783 202 1HB LEU 25 HB2 LEU 25 5.243 7.781 -7.799 203 2HB LEU 25 HB3 LEU 25 6.505 8.456 -6.768 204 HG LEU 25 HG LEU 25 3.651 8.065 -5.837 205 1HD1 LEU 25 HD11 LEU 25 5.727 6.107 -6.291 206 2HD1 LEU 25 HD12 LEU 25 5.380 6.229 -4.567 207 3HD1 LEU 25 HD13 LEU 25 4.082 5.860 -5.705 208 1HD2 LEU 25 HD21 LEU 25 6.174 9.103 -4.694 209 2HD2 LEU 25 HD22 LEU 25 4.507 9.438 -4.227 210 3HD2 LEU 25 HD23 LEU 25 5.305 7.971 -3.658 211 H MET 26 H MET 26 6.926 10.703 -8.668 212 HA MET 26 HA MET 26 5.377 11.018 -11.163 213 1HB MET 26 HB2 MET 26 7.354 12.535 -10.110 214 2HB MET 26 HB3 MET 26 8.317 11.472 -11.139 215 1HG MET 26 HG2 MET 26 7.557 12.448 -13.034 216 2HG MET 26 HG3 MET 26 5.889 12.442 -12.463 217 1HE MET 26 HE1 MET 26 9.378 14.108 -12.137 218 2HE MET 26 HE2 MET 26 8.588 14.511 -13.659 219 3HE MET 26 HE3 MET 26 8.924 15.777 -12.469 220 H TYR 27 H TYR 27 5.593 9.667 -12.917 221 HA TYR 27 HA TYR 27 7.657 7.515 -12.751 222 1HB TYR 27 HB2 TYR 27 5.548 6.517 -12.067 223 2HB TYR 27 HB3 TYR 27 4.724 7.213 -13.462 224 HD1 TYR 27 HD1 TYR 27 7.292 4.752 -12.397 225 HD2 TYR 27 HD2 TYR 27 4.870 6.205 -15.634 226 HE1 TYR 27 HE1 TYR 27 7.918 2.773 -13.753 227 HE2 TYR 27 HE2 TYR 27 5.497 4.226 -16.991 228 HH TYR 27 HH TYR 27 6.478 2.203 -16.945 229 H LYS 28 H LYS 28 8.897 7.567 -14.554 230 HA LYS 28 HA LYS 28 9.599 8.201 -16.715 231 1HB LYS 28 HB2 LYS 28 6.922 6.863 -17.072 232 2HB LYS 28 HB3 LYS 28 7.815 7.468 -18.467 233 1HG LYS 28 HG2 LYS 28 9.684 6.070 -16.856 234 2HG LYS 28 HG3 LYS 28 8.252 5.047 -16.974 235 1HD LYS 28 HD2 LYS 28 8.582 6.057 -19.556 236 2HD LYS 28 HD3 LYS 28 10.224 5.696 -19.018 237 1HE LYS 28 HE2 LYS 28 9.818 3.436 -18.837 238 2HE LYS 28 HE3 LYS 28 8.114 3.666 -18.441 239 1HZ LYS 28 HZ1 LYS 28 7.855 4.455 -20.803 240 2HZ LYS 28 HZ2 LYS 28 9.410 3.842 -21.097 241 3HZ LYS 28 HZ3 LYS 28 8.163 2.796 -20.604 242 H GLY 29 H GLY 29 8.536 10.396 -15.271 243 1HA GLY 29 HA2 GLY 29 7.939 12.621 -15.755 244 2HA GLY 29 HA3 GLY 29 7.879 12.176 -17.461 245 H GLN 30 H GLN 30 6.027 10.709 -14.814 246 HA GLN 30 HA GLN 30 3.559 12.026 -15.791 247 1HB GLN 30 HB2 GLN 30 4.091 9.719 -16.965 248 2HB GLN 30 HB3 GLN 30 3.503 9.045 -15.445 249 1HG GLN 30 HG2 GLN 30 1.368 9.470 -16.016 250 2HG GLN 30 HG3 GLN 30 1.747 11.162 -16.336 251 1HE2 GLN 30 HE21 GLN 30 0.050 9.201 -17.935 252 2HE2 GLN 30 HE22 GLN 30 0.714 9.234 -19.497 253 HA PRO 31 HA PRO 31 3.628 11.816 -11.235 254 1HB PRO 31 HB2 PRO 31 2.085 14.061 -10.947 255 2HB PRO 31 HB3 PRO 31 3.838 14.114 -11.208 256 1HG PRO 31 HG2 PRO 31 1.621 14.566 -13.181 257 2HG PRO 31 HG3 PRO 31 3.175 15.407 -13.024 258 1HD PRO 31 HD2 PRO 31 2.712 13.458 -14.905 259 2HD PRO 31 HD3 PRO 31 4.322 13.790 -14.224 260 H MET 32 H MET 32 2.279 10.110 -10.712 261 HA MET 32 HA MET 32 -0.658 10.599 -10.945 262 1HB MET 32 HB2 MET 32 0.947 8.334 -12.002 263 2HB MET 32 HB3 MET 32 -0.547 7.897 -11.174 264 1HG MET 32 HG2 MET 32 -1.885 9.108 -12.683 265 2HG MET 32 HG3 MET 32 -0.528 10.084 -13.247 266 1HE MET 32 HE1 MET 32 -1.555 6.473 -12.642 267 2HE MET 32 HE2 MET 32 -0.773 5.553 -13.924 268 3HE MET 32 HE3 MET 32 0.198 6.302 -12.650 269 H THR 33 H THR 33 -1.879 9.114 -9.404 270 HA THR 33 HA THR 33 -0.365 8.968 -6.852 271 HB THR 33 HB THR 33 -2.378 10.153 -6.525 272 HG1 THR 33 HG1 THR 33 -3.589 7.785 -5.901 273 1HG2 THR 33 HG21 THR 33 -3.584 8.071 -8.350 274 2HG2 THR 33 HG22 THR 33 -4.584 9.136 -7.361 275 3HG2 THR 33 HG23 THR 33 -3.512 9.818 -8.584 276 H PHE 34 H PHE 34 0.408 7.015 -6.238 277 HA PHE 34 HA PHE 34 -0.749 4.574 -7.479 278 1HB PHE 34 HB2 PHE 34 1.845 5.163 -6.048 279 2HB PHE 34 HB3 PHE 34 1.312 3.508 -6.344 280 HD1 PHE 34 HD1 PHE 34 2.379 6.672 -7.928 281 HD2 PHE 34 HD2 PHE 34 1.249 2.580 -8.583 282 HE1 PHE 34 HE1 PHE 34 3.223 6.812 -10.256 283 HE2 PHE 34 HE2 PHE 34 2.093 2.720 -10.911 284 HZ PHE 34 HZ PHE 34 3.079 4.835 -11.747 285 H ARG 35 H ARG 35 -1.756 2.998 -6.238 286 HA ARG 35 HA ARG 35 -1.989 3.589 -3.311 287 1HB ARG 35 HB2 ARG 35 -4.027 2.905 -5.366 288 2HB ARG 35 HB3 ARG 35 -4.218 2.138 -3.788 289 1HG ARG 35 HG2 ARG 35 -3.535 4.890 -3.376 290 2HG ARG 35 HG3 ARG 35 -4.873 4.814 -4.522 291 1HD ARG 35 HD2 ARG 35 -5.700 2.966 -2.721 292 2HD ARG 35 HD3 ARG 35 -4.789 4.040 -1.659 293 HE ARG 35 HE ARG 35 -6.852 5.196 -3.472 294 1HH1 ARG 35 HH11 ARG 35 -6.439 3.842 -0.408 295 2HH1 ARG 35 HH12 ARG 35 -7.153 5.163 0.455 296 1HH2 ARG 35 HH21 ARG 35 -7.413 7.196 -2.342 297 2HH2 ARG 35 HH22 ARG 35 -7.703 7.063 -0.639 298 H LEU 36 H LEU 36 -1.503 1.911 -1.941 299 HA LEU 36 HA LEU 36 -0.011 -0.307 -2.735 300 1HB LEU 36 HB2 LEU 36 -1.903 -0.162 -0.366 301 2HB LEU 36 HB3 LEU 36 -0.576 -1.309 -0.555 302 HG LEU 36 HG LEU 36 -0.389 1.695 -0.257 303 1HD1 LEU 36 HD11 LEU 36 0.446 -0.713 1.344 304 2HD1 LEU 36 HD12 LEU 36 1.291 0.823 1.537 305 3HD1 LEU 36 HD13 LEU 36 -0.436 0.718 1.877 306 1HD2 LEU 36 HD21 LEU 36 1.439 -0.245 -1.548 307 2HD2 LEU 36 HD22 LEU 36 1.341 1.506 -1.738 308 3HD2 LEU 36 HD23 LEU 36 2.195 0.814 -0.357 309 H LEU 37 H LEU 37 -0.488 -2.255 -3.649 310 HA LEU 37 HA LEU 37 -3.289 -2.750 -4.437 311 1HB LEU 37 HB2 LEU 37 -0.613 -3.606 -5.348 312 2HB LEU 37 HB3 LEU 37 -1.866 -4.842 -5.453 313 HG LEU 37 HG LEU 37 -2.115 -2.037 -6.574 314 1HD1 LEU 37 HD11 LEU 37 -0.450 -3.767 -7.637 315 2HD1 LEU 37 HD12 LEU 37 -1.921 -4.551 -8.210 316 3HD1 LEU 37 HD13 LEU 37 -1.567 -2.889 -8.682 317 1HD2 LEU 37 HD21 LEU 37 -4.123 -3.714 -5.823 318 2HD2 LEU 37 HD22 LEU 37 -4.257 -2.582 -7.169 319 3HD2 LEU 37 HD23 LEU 37 -3.847 -4.270 -7.473 320 H LEU 38 H LEU 38 -4.373 -4.738 -3.976 321 HA LEU 38 HA LEU 38 -4.991 -6.563 -2.646 322 1HB LEU 38 HB2 LEU 38 -2.009 -6.726 -2.128 323 2HB LEU 38 HB3 LEU 38 -3.186 -7.998 -1.795 324 HG LEU 38 HG LEU 38 -3.215 -6.910 -4.553 325 1HD1 LEU 38 HD11 LEU 38 -0.955 -8.654 -3.521 326 2HD1 LEU 38 HD12 LEU 38 -1.270 -8.294 -5.218 327 3HD1 LEU 38 HD13 LEU 38 -0.794 -7.002 -4.116 328 1HD2 LEU 38 HD21 LEU 38 -3.247 -9.696 -3.345 329 2HD2 LEU 38 HD22 LEU 38 -4.663 -8.769 -3.841 330 3HD2 LEU 38 HD23 LEU 38 -3.506 -9.328 -5.050 331 H VAL 39 H VAL 39 -4.511 -3.744 -1.476 332 HA VAL 39 HA VAL 39 -4.984 -4.584 1.302 333 HB VAL 39 HB VAL 39 -3.201 -3.320 2.293 334 1HG1 VAL 39 HG11 VAL 39 -2.635 -5.590 1.377 335 2HG1 VAL 39 HG12 VAL 39 -2.027 -4.801 -0.078 336 3HG1 VAL 39 HG13 VAL 39 -1.247 -4.507 1.476 337 1HG2 VAL 39 HG21 VAL 39 -2.638 -2.400 -0.542 338 2HG2 VAL 39 HG22 VAL 39 -3.169 -1.401 0.812 339 3HG2 VAL 39 HG23 VAL 39 -1.555 -2.110 0.819 340 H ASP 40 H ASP 40 -5.703 -2.730 2.644 341 HA ASP 40 HA ASP 40 -6.486 -0.308 1.122 342 1HB ASP 40 HB2 ASP 40 -8.357 -2.036 1.021 343 2HB ASP 40 HB3 ASP 40 -8.496 -1.863 2.771 344 H THR 41 H THR 41 -6.739 1.518 2.479 345 HA THR 41 HA THR 41 -5.498 1.235 5.133 346 HB THR 41 HB THR 41 -5.001 3.457 4.956 347 HG1 THR 41 HG1 THR 41 -7.538 3.859 3.757 348 1HG2 THR 41 HG21 THR 41 -4.859 2.312 2.537 349 2HG2 THR 41 HG22 THR 41 -6.039 3.569 2.168 350 3HG2 THR 41 HG23 THR 41 -4.451 4.008 2.798 351 HA PRO 42 HA PRO 42 -9.184 1.600 7.539 352 1HB PRO 42 HB2 PRO 42 -8.561 3.495 9.405 353 2HB PRO 42 HB3 PRO 42 -7.826 1.883 9.383 354 1HG PRO 42 HG2 PRO 42 -6.656 4.497 8.568 355 2HG PRO 42 HG3 PRO 42 -5.855 3.061 9.223 356 1HD PRO 42 HD2 PRO 42 -5.905 3.824 6.514 357 2HD PRO 42 HD3 PRO 42 -5.436 2.227 7.134 358 H GLU 43 H GLU 43 -10.990 3.090 8.261 359 HA GLU 43 HA GLU 43 -11.941 4.747 6.206 360 1HB GLU 43 HB2 GLU 43 -12.623 4.294 9.042 361 2HB GLU 43 HB3 GLU 43 -13.121 5.864 8.412 362 1HG GLU 43 HG2 GLU 43 -14.866 4.106 8.091 363 2HG GLU 43 HG3 GLU 43 -14.304 4.794 6.566 364 H THR 44 H THR 44 -10.294 5.765 9.218 365 HA THR 44 HA THR 44 -9.231 7.794 9.741 366 HB THR 44 HB THR 44 -8.409 8.668 7.166 367 HG1 THR 44 HG1 THR 44 -8.575 6.892 6.073 368 1HG2 THR 44 HG21 THR 44 -7.300 8.181 9.617 369 2HG2 THR 44 HG22 THR 44 -6.618 6.864 8.663 370 3HG2 THR 44 HG23 THR 44 -6.371 8.537 8.161 371 H LYS 45 H LYS 45 -12.050 7.986 9.237 372 HA LYS 45 HA LYS 45 -12.174 10.697 7.976 373 1HB LYS 45 HB2 LYS 45 -14.244 8.485 8.038 374 2HB LYS 45 HB3 LYS 45 -14.602 10.137 7.534 375 1HG LYS 45 HG2 LYS 45 -13.479 9.920 5.556 376 2HG LYS 45 HG3 LYS 45 -12.227 8.899 6.264 377 1HD LYS 45 HD2 LYS 45 -13.725 7.712 4.610 378 2HD LYS 45 HD3 LYS 45 -13.666 6.965 6.207 379 1HE LYS 45 HE2 LYS 45 -15.886 7.231 6.446 380 2HE LYS 45 HE3 LYS 45 -15.726 8.969 6.192 381 1HZ LYS 45 HZ1 LYS 45 -15.535 7.263 3.836 382 2HZ LYS 45 HZ2 LYS 45 -17.070 7.412 4.548 383 3HZ LYS 45 HZ3 LYS 45 -16.242 8.794 4.011 384 H HIS 46 H HIS 46 -14.900 9.316 9.659 385 HA HIS 46 HA HIS 46 -14.401 10.171 12.303 386 1HB HIS 46 HB2 HIS 46 -14.384 12.395 10.774 387 2HB HIS 46 HB3 HIS 46 -16.116 12.276 11.084 388 HD1 HIS 46 HD1 HIS 46 -13.275 13.825 12.479 389 HD2 HIS 46 HD2 HIS 46 -16.425 11.653 14.134 390 HE1 HIS 46 HE1 HIS 46 -13.347 14.428 14.938 391 HA PRO 47 HA PRO 47 -18.373 8.008 11.782 392 1HB PRO 47 HB2 PRO 47 -17.934 6.279 13.846 393 2HB PRO 47 HB3 PRO 47 -17.285 6.020 12.218 394 1HG PRO 47 HG2 PRO 47 -15.875 6.880 14.689 395 2HG PRO 47 HG3 PRO 47 -15.247 6.017 13.277 396 1HD PRO 47 HD2 PRO 47 -14.933 8.782 13.833 397 2HD PRO 47 HD3 PRO 47 -14.545 7.962 12.305 398 H LYS 48 H LYS 48 -17.997 10.557 13.219 399 HA LYS 48 HA LYS 48 -18.967 11.793 14.965 400 1HB LYS 48 HB2 LYS 48 -20.987 9.534 14.816 401 2HB LYS 48 HB3 LYS 48 -21.257 11.114 15.552 402 1HG LYS 48 HG2 LYS 48 -20.251 11.573 12.931 403 2HG LYS 48 HG3 LYS 48 -21.529 10.364 12.796 404 1HD LYS 48 HD2 LYS 48 -21.956 12.808 14.494 405 2HD LYS 48 HD3 LYS 48 -22.173 12.902 12.745 406 1HE LYS 48 HE2 LYS 48 -24.311 12.366 13.807 407 2HE LYS 48 HE3 LYS 48 -23.754 10.981 12.868 408 1HZ LYS 48 HZ1 LYS 48 -23.138 11.259 15.746 409 2HZ LYS 48 HZ2 LYS 48 -24.580 10.538 15.208 410 3HZ LYS 48 HZ3 LYS 48 -23.079 9.862 14.785 411 H LYS 49 H LYS 49 -16.938 9.900 15.756 412 HA LYS 49 HA LYS 49 -17.787 9.518 18.575 413 1HB LYS 49 HB2 LYS 49 -16.798 7.357 16.718 414 2HB LYS 49 HB3 LYS 49 -16.533 7.243 18.458 415 1HG LYS 49 HG2 LYS 49 -18.935 7.422 18.872 416 2HG LYS 49 HG3 LYS 49 -19.238 7.638 17.148 417 1HD LYS 49 HD2 LYS 49 -17.662 5.237 17.889 418 2HD LYS 49 HD3 LYS 49 -19.356 5.226 18.382 419 1HE LYS 49 HE2 LYS 49 -19.974 5.841 16.022 420 2HE LYS 49 HE3 LYS 49 -18.280 5.629 15.578 421 1HZ LYS 49 HZ1 LYS 49 -19.663 3.479 17.023 422 2HZ LYS 49 HZ2 LYS 49 -19.945 3.665 15.358 423 3HZ LYS 49 HZ3 LYS 49 -18.371 3.382 15.930 424 H GLY 50 H GLY 50 -15.921 11.294 16.987 425 1HA GLY 50 HA2 GLY 50 -13.811 12.253 17.353 426 2HA GLY 50 HA3 GLY 50 -13.759 11.349 18.868 427 H VAL 51 H VAL 51 -11.404 11.538 17.541 428 HA VAL 51 HA VAL 51 -10.981 8.739 16.665 429 HB VAL 51 HB VAL 51 -9.990 11.114 15.060 430 1HG1 VAL 51 HG11 VAL 51 -8.854 8.654 15.265 431 2HG1 VAL 51 HG12 VAL 51 -10.016 8.356 13.972 432 3HG1 VAL 51 HG13 VAL 51 -8.805 9.626 13.793 433 1HG2 VAL 51 HG21 VAL 51 -12.309 9.213 14.691 434 2HG2 VAL 51 HG22 VAL 51 -12.316 10.974 14.612 435 3HG2 VAL 51 HG23 VAL 51 -11.570 10.037 13.319 436 H GLU 52 H GLU 52 -8.859 8.003 17.100 437 HA GLU 52 HA GLU 52 -6.574 9.503 17.654 438 1HB GLU 52 HB2 GLU 52 -6.725 9.404 20.258 439 2HB GLU 52 HB3 GLU 52 -7.546 10.720 19.416 440 1HG GLU 52 HG2 GLU 52 -9.659 9.804 19.752 441 2HG GLU 52 HG3 GLU 52 -9.033 8.162 19.912 442 H LYS 53 H LYS 53 -6.141 7.338 16.616 443 HA LYS 53 HA LYS 53 -4.890 5.559 18.449 444 1HB LYS 53 HB2 LYS 53 -6.497 3.569 17.918 445 2HB LYS 53 HB3 LYS 53 -6.933 4.695 19.201 446 1HG LYS 53 HG2 LYS 53 -7.959 5.836 16.841 447 2HG LYS 53 HG3 LYS 53 -8.330 4.118 16.728 448 1HD LYS 53 HD2 LYS 53 -9.191 4.274 19.122 449 2HD LYS 53 HD3 LYS 53 -9.079 6.026 18.952 450 1HE LYS 53 HE2 LYS 53 -10.441 4.685 16.709 451 2HE LYS 53 HE3 LYS 53 -11.277 4.534 18.255 452 1HZ LYS 53 HZ1 LYS 53 -10.561 7.111 18.277 453 2HZ LYS 53 HZ2 LYS 53 -10.826 6.876 16.618 454 3HZ LYS 53 HZ3 LYS 53 -12.067 6.546 17.732 455 H TYR 54 H TYR 54 -6.808 5.056 15.451 456 HA TYR 54 HA TYR 54 -4.250 4.187 14.162 457 1HB TYR 54 HB2 TYR 54 -7.033 3.232 13.441 458 2HB TYR 54 HB3 TYR 54 -5.497 2.586 12.862 459 HD1 TYR 54 HD1 TYR 54 -3.930 2.619 15.413 460 HD2 TYR 54 HD2 TYR 54 -7.963 1.381 14.606 461 HE1 TYR 54 HE1 TYR 54 -3.846 1.079 17.355 462 HE2 TYR 54 HE2 TYR 54 -7.879 -0.159 16.548 463 HH TYR 54 HH TYR 54 -6.663 -0.467 18.596 464 H GLY 55 H GLY 55 -6.306 6.700 14.260 465 1HA GLY 55 HA2 GLY 55 -7.044 7.182 11.552 466 2HA GLY 55 HA3 GLY 55 -6.787 8.442 12.761 467 HA PRO 56 HA PRO 56 -3.043 9.530 10.702 468 1HB PRO 56 HB2 PRO 56 -1.782 10.796 12.767 469 2HB PRO 56 HB3 PRO 56 -3.190 11.478 11.936 470 1HG PRO 56 HG2 PRO 56 -3.018 10.237 14.632 471 2HG PRO 56 HG3 PRO 56 -4.140 11.465 14.027 472 1HD PRO 56 HD2 PRO 56 -4.694 8.705 14.344 473 2HD PRO 56 HD3 PRO 56 -5.697 9.888 13.475 474 H GLU 57 H GLU 57 -2.781 6.882 11.106 475 HA GLU 57 HA GLU 57 -0.209 6.561 12.604 476 1HB GLU 57 HB2 GLU 57 -2.649 5.085 12.762 477 2HB GLU 57 HB3 GLU 57 -1.427 4.030 12.052 478 1HG GLU 57 HG2 GLU 57 -0.229 5.510 14.200 479 2HG GLU 57 HG3 GLU 57 -1.715 4.762 14.785 480 H ALA 58 H ALA 58 -1.936 4.751 10.040 481 HA ALA 58 HA ALA 58 0.418 3.836 8.747 482 1HB ALA 58 HB1 ALA 58 -2.443 3.880 8.196 483 2HB ALA 58 HB2 ALA 58 -1.496 4.102 6.725 484 3HB ALA 58 HB3 ALA 58 -1.237 2.680 7.735 485 H SER 59 H SER 59 -1.547 6.748 8.165 486 HA SER 59 HA SER 59 -0.308 7.721 5.850 487 1HB SER 59 HB2 SER 59 -0.850 9.676 8.040 488 2HB SER 59 HB3 SER 59 -1.304 9.743 6.339 489 HG SER 59 HG SER 59 -2.979 9.252 8.044 490 H ALA 60 H ALA 60 0.649 8.546 9.209 491 HA ALA 60 HA ALA 60 3.054 9.889 8.473 492 1HB ALA 60 HB1 ALA 60 1.835 9.824 10.761 493 2HB ALA 60 HB2 ALA 60 2.750 8.343 11.046 494 3HB ALA 60 HB3 ALA 60 3.597 9.865 10.771 495 H PHE 61 H PHE 61 2.298 6.494 8.840 496 HA PHE 61 HA PHE 61 4.926 5.456 9.141 497 1HB PHE 61 HB2 PHE 61 2.866 4.098 9.376 498 2HB PHE 61 HB3 PHE 61 2.595 4.234 7.639 499 HD1 PHE 61 HD1 PHE 61 5.195 3.157 10.116 500 HD2 PHE 61 HD2 PHE 61 3.530 2.654 6.189 501 HE1 PHE 61 HE1 PHE 61 6.701 1.227 9.725 502 HE2 PHE 61 HE2 PHE 61 5.035 0.723 5.798 503 HZ PHE 61 HZ PHE 61 6.622 0.009 7.565 504 H THR 62 H THR 62 3.071 5.373 6.095 505 HA THR 62 HA THR 62 5.385 5.020 4.453 506 HB THR 62 HB THR 62 2.892 6.369 3.443 507 HG1 THR 62 HG1 THR 62 3.143 3.595 3.930 508 1HG2 THR 62 HG21 THR 62 5.155 5.388 2.224 509 2HG2 THR 62 HG22 THR 62 4.040 4.029 2.082 510 3HG2 THR 62 HG23 THR 62 3.596 5.606 1.429 511 H LYS 63 H LYS 63 4.146 7.798 6.035 512 HA LYS 63 HA LYS 63 5.059 9.816 4.197 513 1HB LYS 63 HB2 LYS 63 3.476 10.070 6.235 514 2HB LYS 63 HB3 LYS 63 4.955 10.180 7.189 515 1HG LYS 63 HG2 LYS 63 5.384 12.281 6.471 516 2HG LYS 63 HG3 LYS 63 5.030 11.863 4.795 517 1HD LYS 63 HD2 LYS 63 2.652 12.115 5.163 518 2HD LYS 63 HD3 LYS 63 2.897 12.324 6.897 519 1HE LYS 63 HE2 LYS 63 4.418 14.184 5.164 520 2HE LYS 63 HE3 LYS 63 2.668 14.400 5.158 521 1HZ LYS 63 HZ1 LYS 63 2.874 14.275 7.680 522 2HZ LYS 63 HZ2 LYS 63 4.533 14.544 7.443 523 3HZ LYS 63 HZ3 LYS 63 3.404 15.701 6.920 524 H LYS 64 H LYS 64 6.499 8.611 7.232 525 HA LYS 64 HA LYS 64 9.029 9.937 6.743 526 1HB LYS 64 HB2 LYS 64 7.817 8.664 8.916 527 2HB LYS 64 HB3 LYS 64 9.189 7.630 8.517 528 1HG LYS 64 HG2 LYS 64 10.324 9.132 9.822 529 2HG LYS 64 HG3 LYS 64 10.378 10.050 8.317 530 1HD LYS 64 HD2 LYS 64 9.575 11.568 9.983 531 2HD LYS 64 HD3 LYS 64 8.167 11.102 9.029 532 1HE LYS 64 HE2 LYS 64 8.275 9.143 10.988 533 2HE LYS 64 HE3 LYS 64 8.743 10.605 11.857 534 1HZ LYS 64 HZ1 LYS 64 6.657 11.367 10.252 535 2HZ LYS 64 HZ2 LYS 64 6.190 9.848 10.844 536 3HZ LYS 64 HZ3 LYS 64 6.596 11.094 11.927 537 H MET 65 H MET 65 7.677 6.797 5.968 538 HA MET 65 HA MET 65 10.072 5.379 5.413 539 1HB MET 65 HB2 MET 65 7.230 5.097 4.807 540 2HB MET 65 HB3 MET 65 8.253 4.508 3.496 541 1HG MET 65 HG2 MET 65 7.809 2.706 5.109 542 2HG MET 65 HG3 MET 65 9.521 3.129 5.113 543 1HE MET 65 HE1 MET 65 10.196 2.233 6.980 544 2HE MET 65 HE2 MET 65 9.881 2.701 8.649 545 3HE MET 65 HE3 MET 65 8.787 1.586 7.832 546 H VAL 66 H VAL 66 7.942 6.944 3.014 547 HA VAL 66 HA VAL 66 9.940 6.878 0.938 548 HB VAL 66 HB VAL 66 8.392 8.191 -0.353 549 1HG1 VAL 66 HG11 VAL 66 7.709 5.817 0.843 550 2HG1 VAL 66 HG12 VAL 66 6.343 6.842 1.282 551 3HG1 VAL 66 HG13 VAL 66 6.761 6.609 -0.416 552 1HG2 VAL 66 HG21 VAL 66 7.648 9.185 2.327 553 2HG2 VAL 66 HG22 VAL 66 7.590 10.007 0.767 554 3HG2 VAL 66 HG23 VAL 66 6.282 8.923 1.242 555 H GLU 67 H GLU 67 9.212 9.118 3.514 556 HA GLU 67 HA GLU 67 10.543 11.413 2.394 557 1HB GLU 67 HB2 GLU 67 9.529 10.590 5.062 558 2HB GLU 67 HB3 GLU 67 10.793 11.820 5.055 559 1HG GLU 67 HG2 GLU 67 8.952 12.485 2.986 560 2HG GLU 67 HG3 GLU 67 8.012 12.131 4.436 561 H ASN 68 H ASN 68 11.659 8.566 4.114 562 HA ASN 68 HA ASN 68 14.409 9.726 4.203 563 1HB ASN 68 HB2 ASN 68 13.089 7.459 5.702 564 2HB ASN 68 HB3 ASN 68 14.841 7.661 5.675 565 1HD2 ASN 68 HD21 ASN 68 11.925 8.760 7.166 566 2HD2 ASN 68 HD22 ASN 68 12.606 10.029 8.065 567 H ALA 69 H ALA 69 12.452 7.629 2.413 568 HA ALA 69 HA ALA 69 14.312 5.573 1.709 569 1HB ALA 69 HB1 ALA 69 12.046 6.777 0.091 570 2HB ALA 69 HB2 ALA 69 12.876 5.271 -0.297 571 3HB ALA 69 HB3 ALA 69 11.922 5.397 1.182 572 H LYS 70 H LYS 70 16.258 5.902 0.752 573 HA LYS 70 HA LYS 70 16.870 8.375 -0.657 574 1HB LYS 70 HB2 LYS 70 18.470 5.799 -0.559 575 2HB LYS 70 HB3 LYS 70 19.074 7.397 -0.998 576 1HG LYS 70 HG2 LYS 70 18.584 8.228 1.259 577 2HG LYS 70 HG3 LYS 70 17.921 6.655 1.707 578 1HD LYS 70 HD2 LYS 70 19.994 5.655 1.814 579 2HD LYS 70 HD3 LYS 70 20.683 6.709 0.579 580 1HE LYS 70 HE2 LYS 70 20.890 8.531 2.123 581 2HE LYS 70 HE3 LYS 70 19.918 7.697 3.336 582 1HZ LYS 70 HZ1 LYS 70 22.213 6.207 2.433 583 2HZ LYS 70 HZ2 LYS 70 22.609 7.656 3.220 584 3HZ LYS 70 HZ3 LYS 70 21.656 6.495 4.013 585 H LYS 71 H LYS 71 15.662 5.249 -1.531 586 HA LYS 71 HA LYS 71 15.596 6.116 -4.370 587 1HB LYS 71 HB2 LYS 71 16.669 3.446 -3.405 588 2HB LYS 71 HB3 LYS 71 16.316 3.832 -5.090 589 1HG LYS 71 HG2 LYS 71 17.884 5.849 -4.780 590 2HG LYS 71 HG3 LYS 71 18.414 5.058 -3.296 591 1HD LYS 71 HD2 LYS 71 19.680 3.588 -4.440 592 2HD LYS 71 HD3 LYS 71 18.338 3.178 -5.510 593 1HE LYS 71 HE2 LYS 71 19.968 4.116 -6.951 594 2HE LYS 71 HE3 LYS 71 18.819 5.426 -6.677 595 1HZ LYS 71 HZ1 LYS 71 20.433 5.890 -4.675 596 2HZ LYS 71 HZ2 LYS 71 21.550 5.105 -5.685 597 3HZ LYS 71 HZ3 LYS 71 20.749 6.503 -6.224 598 H ILE 72 H ILE 72 13.550 5.837 -5.110 599 HA ILE 72 HA ILE 72 11.841 3.806 -3.728 600 HB ILE 72 HB ILE 72 11.059 6.417 -5.058 601 1HG1 ILE 72 HG12 ILE 72 10.142 6.553 -2.517 602 2HG1 ILE 72 HG13 ILE 72 11.557 5.531 -2.261 603 1HG2 ILE 72 HG21 ILE 72 9.554 4.004 -4.482 604 2HG2 ILE 72 HG22 ILE 72 8.925 5.368 -3.560 605 3HG2 ILE 72 HG23 ILE 72 9.031 5.467 -5.317 606 1HD1 ILE 72 HD11 ILE 72 12.406 7.567 -4.013 607 2HD1 ILE 72 HD12 ILE 72 11.443 8.377 -2.776 608 3HD1 ILE 72 HD13 ILE 72 12.828 7.388 -2.310 609 H GLU 73 H GLU 73 11.094 2.175 -5.010 610 HA GLU 73 HA GLU 73 10.978 2.652 -7.952 611 1HB GLU 73 HB2 GLU 73 12.365 0.413 -6.484 612 2HB GLU 73 HB3 GLU 73 11.786 0.193 -8.135 613 1HG GLU 73 HG2 GLU 73 13.343 1.627 -9.020 614 2HG GLU 73 HG3 GLU 73 13.348 2.666 -7.595 615 H VAL 74 H VAL 74 9.017 2.073 -8.745 616 HA VAL 74 HA VAL 74 7.172 0.551 -7.009 617 HB VAL 74 HB VAL 74 5.475 1.158 -8.705 618 1HG1 VAL 74 HG11 VAL 74 7.177 3.098 -7.278 619 2HG1 VAL 74 HG12 VAL 74 6.232 3.797 -8.593 620 3HG1 VAL 74 HG13 VAL 74 5.420 2.934 -7.287 621 1HG2 VAL 74 HG21 VAL 74 7.487 1.164 -10.490 622 2HG2 VAL 74 HG22 VAL 74 5.999 2.073 -10.752 623 3HG2 VAL 74 HG23 VAL 74 7.434 2.891 -10.135 624 H GLU 75 H GLU 75 5.739 -1.101 -8.281 625 HA GLU 75 HA GLU 75 7.303 -2.563 -10.336 626 1HB GLU 75 HB2 GLU 75 7.889 -3.491 -8.062 627 2HB GLU 75 HB3 GLU 75 6.194 -3.944 -7.878 628 1HG GLU 75 HG2 GLU 75 6.295 -5.538 -9.585 629 2HG GLU 75 HG3 GLU 75 7.702 -4.785 -10.337 630 H PHE 76 H PHE 76 5.608 -1.934 -11.789 631 HA PHE 76 HA PHE 76 2.827 -2.306 -11.307 632 1HB PHE 76 HB2 PHE 76 4.420 -2.346 -13.884 633 2HB PHE 76 HB3 PHE 76 2.657 -2.380 -13.829 634 HD1 PHE 76 HD1 PHE 76 1.375 -0.442 -13.071 635 HD2 PHE 76 HD2 PHE 76 5.666 -0.355 -13.210 636 HE1 PHE 76 HE1 PHE 76 1.332 2.024 -12.816 637 HE2 PHE 76 HE2 PHE 76 5.625 2.112 -12.955 638 HZ PHE 76 HZ PHE 76 3.458 3.302 -12.759 639 H ASP 77 H ASP 77 1.605 -4.143 -11.235 640 HA ASP 77 HA ASP 77 2.866 -6.738 -11.388 641 1HB ASP 77 HB2 ASP 77 0.650 -5.856 -10.145 642 2HB ASP 77 HB3 ASP 77 -0.099 -6.514 -11.600 643 H LYS 78 H LYS 78 1.017 -8.310 -12.778 644 HA LYS 78 HA LYS 78 1.688 -7.553 -15.569 645 1HB LYS 78 HB2 LYS 78 1.226 -9.868 -16.127 646 2HB LYS 78 HB3 LYS 78 2.262 -9.840 -14.700 647 1HG LYS 78 HG2 LYS 78 -0.605 -9.749 -14.060 648 2HG LYS 78 HG3 LYS 78 -0.119 -11.222 -14.898 649 1HD LYS 78 HD2 LYS 78 1.919 -10.989 -13.117 650 2HD LYS 78 HD3 LYS 78 0.604 -10.264 -12.189 651 1HE LYS 78 HE2 LYS 78 -0.315 -12.283 -11.810 652 2HE LYS 78 HE3 LYS 78 -0.332 -12.644 -13.536 653 1HZ LYS 78 HZ1 LYS 78 2.241 -12.773 -12.165 654 2HZ LYS 78 HZ2 LYS 78 1.125 -14.010 -11.834 655 3HZ LYS 78 HZ3 LYS 78 1.637 -13.728 -13.428 656 H GLY 79 H GLY 79 -0.699 -6.682 -13.681 657 1HA GLY 79 HA2 GLY 79 -2.888 -7.355 -15.595 658 2HA GLY 79 HA3 GLY 79 -3.138 -6.825 -13.931 659 H GLN 80 H GLN 80 -4.515 -5.107 -14.696 660 HA GLN 80 HA GLN 80 -3.815 -3.162 -16.626 661 1HB GLN 80 HB2 GLN 80 -5.412 -2.719 -14.086 662 2HB GLN 80 HB3 GLN 80 -5.469 -1.725 -15.542 663 1HG GLN 80 HG2 GLN 80 -5.973 -4.648 -15.861 664 2HG GLN 80 HG3 GLN 80 -7.243 -3.682 -15.108 665 1HE2 GLN 80 HE21 GLN 80 -8.417 -4.280 -17.234 666 2HE2 GLN 80 HE22 GLN 80 -8.162 -3.270 -18.573 667 H ARG 81 H ARG 81 -2.869 -1.060 -16.392 668 HA ARG 81 HA ARG 81 -0.848 -0.932 -14.228 669 1HB ARG 81 HB2 ARG 81 -1.238 0.665 -16.776 670 2HB ARG 81 HB3 ARG 81 0.028 1.007 -15.596 671 1HG ARG 81 HG2 ARG 81 0.564 -1.559 -15.869 672 2HG ARG 81 HG3 ARG 81 -0.283 -1.368 -17.404 673 1HD ARG 81 HD2 ARG 81 1.264 0.734 -17.684 674 2HD ARG 81 HD3 ARG 81 2.267 -0.076 -16.480 675 HE ARG 81 HE ARG 81 2.172 -2.076 -18.128 676 1HH1 ARG 81 HH11 ARG 81 0.516 -0.313 -20.054 677 2HH1 ARG 81 HH12 ARG 81 1.741 0.134 -21.195 678 1HH2 ARG 81 HH21 ARG 81 4.370 -0.836 -19.155 679 2HH2 ARG 81 HH22 ARG 81 3.922 -0.162 -20.686 680 H THR 82 H THR 82 -3.933 0.282 -14.961 681 HA THR 82 HA THR 82 -3.757 2.153 -12.682 682 HB THR 82 HB THR 82 -5.068 3.845 -14.199 683 HG1 THR 82 HG1 THR 82 -4.776 2.023 -15.912 684 1HG2 THR 82 HG21 THR 82 -2.783 4.150 -13.196 685 2HG2 THR 82 HG22 THR 82 -2.102 3.433 -14.656 686 3HG2 THR 82 HG23 THR 82 -2.989 4.955 -14.751 687 H ASP 83 H ASP 83 -5.977 2.843 -11.994 688 HA ASP 83 HA ASP 83 -7.953 0.718 -12.695 689 1HB ASP 83 HB2 ASP 83 -7.097 1.790 -10.210 690 2HB ASP 83 HB3 ASP 83 -8.764 2.312 -10.442 691 H LYS 84 H LYS 84 -10.260 1.998 -11.787 692 HA LYS 84 HA LYS 84 -10.836 3.732 -14.055 693 1HB LYS 84 HB2 LYS 84 -13.103 3.862 -13.079 694 2HB LYS 84 HB3 LYS 84 -12.544 2.192 -13.163 695 1HG LYS 84 HG2 LYS 84 -11.689 2.582 -10.742 696 2HG LYS 84 HG3 LYS 84 -12.767 3.978 -10.746 697 1HD LYS 84 HD2 LYS 84 -14.687 2.667 -10.930 698 2HD LYS 84 HD3 LYS 84 -13.813 1.312 -11.648 699 1HE LYS 84 HE2 LYS 84 -13.253 0.443 -9.625 700 2HE LYS 84 HE3 LYS 84 -12.913 2.029 -8.934 701 1HZ LYS 84 HZ1 LYS 84 -15.699 1.477 -9.531 702 2HZ LYS 84 HZ2 LYS 84 -15.027 0.560 -8.273 703 3HZ LYS 84 HZ3 LYS 84 -15.007 2.257 -8.190 704 H TYR 85 H TYR 85 -9.488 4.248 -11.001 705 HA TYR 85 HA TYR 85 -10.529 7.013 -10.761 706 1HB TYR 85 HB2 TYR 85 -8.857 5.214 -9.016 707 2HB TYR 85 HB3 TYR 85 -8.904 6.953 -8.721 708 HD1 TYR 85 HD1 TYR 85 -11.166 4.018 -9.275 709 HD2 TYR 85 HD2 TYR 85 -10.643 7.869 -7.448 710 HE1 TYR 85 HE1 TYR 85 -13.338 3.759 -8.109 711 HE2 TYR 85 HE2 TYR 85 -12.815 7.611 -6.281 712 HH TYR 85 HH TYR 85 -14.650 6.367 -6.069 713 H GLY 86 H GLY 86 -8.210 5.557 -12.569 714 1HA GLY 86 HA2 GLY 86 -6.436 6.504 -13.800 715 2HA GLY 86 HA3 GLY 86 -6.792 8.050 -13.029 716 H ARG 87 H ARG 87 -6.486 5.630 -10.709 717 HA ARG 87 HA ARG 87 -3.889 6.720 -9.855 718 1HB ARG 87 HB2 ARG 87 -5.608 4.569 -8.581 719 2HB ARG 87 HB3 ARG 87 -4.250 5.404 -7.826 720 1HG ARG 87 HG2 ARG 87 -5.449 7.552 -8.041 721 2HG ARG 87 HG3 ARG 87 -6.812 6.713 -8.783 722 1HD ARG 87 HD2 ARG 87 -5.742 6.227 -5.988 723 2HD ARG 87 HD3 ARG 87 -7.235 7.074 -6.388 724 HE ARG 87 HE ARG 87 -7.359 4.511 -7.596 725 1HH1 ARG 87 HH11 ARG 87 -9.491 5.561 -5.806 726 2HH1 ARG 87 HH12 ARG 87 -9.390 4.501 -4.440 727 1HH2 ARG 87 HH21 ARG 87 -6.239 3.311 -5.265 728 2HH2 ARG 87 HH22 ARG 87 -7.549 3.226 -4.135 729 H GLY 88 H GLY 88 -1.952 5.595 -9.921 730 1HA GLY 88 HA2 GLY 88 -1.802 3.305 -11.712 731 2HA GLY 88 HA3 GLY 88 -0.443 4.041 -10.860 732 H LEU 89 H LEU 89 -1.614 1.159 -11.154 733 HA LEU 89 HA LEU 89 -1.684 0.534 -8.231 734 1HB LEU 89 HB2 LEU 89 -2.609 -1.206 -10.538 735 2HB LEU 89 HB3 LEU 89 -2.832 -1.523 -8.816 736 HG LEU 89 HG LEU 89 -3.925 0.942 -10.188 737 1HD1 LEU 89 HD11 LEU 89 -4.971 -1.842 -10.006 738 2HD1 LEU 89 HD12 LEU 89 -6.120 -0.537 -9.708 739 3HD1 LEU 89 HD13 LEU 89 -5.251 -0.614 -11.241 740 1HD2 LEU 89 HD21 LEU 89 -3.959 -0.222 -7.459 741 2HD2 LEU 89 HD22 LEU 89 -4.083 1.463 -7.964 742 3HD2 LEU 89 HD23 LEU 89 -5.500 0.416 -8.033 743 H ALA 90 H ALA 90 0.207 -0.267 -7.489 744 HA ALA 90 HA ALA 90 1.578 -2.438 -8.806 745 1HB ALA 90 HB1 ALA 90 2.267 -0.412 -10.195 746 2HB ALA 90 HB2 ALA 90 3.102 0.177 -8.757 747 3HB ALA 90 HB3 ALA 90 3.593 -1.345 -9.500 748 H TYR 91 H TYR 91 3.817 -2.763 -7.627 749 HA TYR 91 HA TYR 91 3.264 -2.413 -4.739 750 1HB TYR 91 HB2 TYR 91 5.550 -3.916 -6.038 751 2HB TYR 91 HB3 TYR 91 4.963 -4.083 -4.384 752 HD1 TYR 91 HD1 TYR 91 2.551 -4.900 -4.036 753 HD2 TYR 91 HD2 TYR 91 4.630 -5.210 -7.783 754 HE1 TYR 91 HE1 TYR 91 0.945 -6.637 -4.785 755 HE2 TYR 91 HE2 TYR 91 3.023 -6.944 -8.531 756 HH TYR 91 HH TYR 91 0.728 -7.664 -8.024 757 H ILE 92 H ILE 92 4.125 -0.669 -3.726 758 HA ILE 92 HA ILE 92 6.298 0.849 -4.987 759 HB ILE 92 HB ILE 92 4.963 1.289 -2.300 760 1HG1 ILE 92 HG12 ILE 92 4.319 2.541 -4.988 761 2HG1 ILE 92 HG13 ILE 92 3.368 1.259 -4.239 762 1HG2 ILE 92 HG21 ILE 92 6.881 2.825 -4.015 763 2HG2 ILE 92 HG22 ILE 92 5.693 3.722 -3.070 764 3HG2 ILE 92 HG23 ILE 92 6.840 2.654 -2.260 765 1HD1 ILE 92 HD11 ILE 92 3.823 3.356 -2.318 766 2HD1 ILE 92 HD12 ILE 92 3.146 4.047 -3.792 767 3HD1 ILE 92 HD13 ILE 92 2.291 2.755 -2.952 768 H TYR 93 H TYR 93 8.411 0.998 -4.208 769 HA TYR 93 HA TYR 93 9.092 -0.728 -1.867 770 1HB TYR 93 HB2 TYR 93 10.338 -0.666 -4.611 771 2HB TYR 93 HB3 TYR 93 11.262 -1.204 -3.207 772 HD1 TYR 93 HD1 TYR 93 8.410 -1.937 -5.417 773 HD2 TYR 93 HD2 TYR 93 10.665 -3.243 -2.002 774 HE1 TYR 93 HE1 TYR 93 7.327 -4.164 -5.550 775 HE2 TYR 93 HE2 TYR 93 9.580 -5.468 -2.134 776 HH TYR 93 HH TYR 93 7.547 -6.363 -4.841 777 H ALA 94 H ALA 94 11.025 -0.060 -0.733 778 HA ALA 94 HA ALA 94 12.243 2.518 -1.505 779 1HB ALA 94 HB1 ALA 94 10.088 2.526 0.244 780 2HB ALA 94 HB2 ALA 94 11.482 2.522 1.325 781 3HB ALA 94 HB3 ALA 94 11.307 3.794 0.117 782 H ASP 95 H ASP 95 14.376 2.015 -1.369 783 HA ASP 95 HA ASP 95 16.400 1.202 -0.503 784 1HB ASP 95 HB2 ASP 95 14.697 1.493 1.959 785 2HB ASP 95 HB3 ASP 95 16.282 0.728 2.076 786 H GLY 96 H GLY 96 14.541 -0.640 -1.697 787 1HA GLY 96 HA2 GLY 96 14.380 -2.966 -1.982 788 2HA GLY 96 HA3 GLY 96 15.689 -3.130 -0.811 789 H LYS 97 H LYS 97 12.750 -1.402 -0.010 790 HA LYS 97 HA LYS 97 11.936 -3.713 1.709 791 1HB LYS 97 HB2 LYS 97 12.962 -1.407 2.705 792 2HB LYS 97 HB3 LYS 97 11.254 -0.974 2.623 793 1HG LYS 97 HG2 LYS 97 10.623 -2.607 4.146 794 2HG LYS 97 HG3 LYS 97 12.004 -3.638 3.771 795 1HD LYS 97 HD2 LYS 97 13.167 -2.744 5.474 796 2HD LYS 97 HD3 LYS 97 12.971 -1.132 4.786 797 1HE LYS 97 HE2 LYS 97 10.840 -0.847 5.904 798 2HE LYS 97 HE3 LYS 97 10.866 -2.517 6.469 799 1HZ LYS 97 HZ1 LYS 97 13.044 -0.648 7.151 800 2HZ LYS 97 HZ2 LYS 97 11.616 -0.696 8.070 801 3HZ LYS 97 HZ3 LYS 97 12.591 -2.082 7.935 802 H MET 98 H MET 98 9.976 -4.435 1.046 803 HA MET 98 HA MET 98 8.279 -2.946 -0.739 804 1HB MET 98 HB2 MET 98 8.347 -5.468 -0.510 805 2HB MET 98 HB3 MET 98 7.463 -5.286 1.006 806 1HG MET 98 HG2 MET 98 5.676 -4.054 -0.238 807 2HG MET 98 HG3 MET 98 6.537 -4.391 -1.739 808 1HE MET 98 HE1 MET 98 5.916 -5.647 -3.075 809 2HE MET 98 HE2 MET 98 5.625 -7.389 -2.991 810 3HE MET 98 HE3 MET 98 4.281 -6.260 -2.848 811 H VAL 99 H VAL 99 6.948 -1.296 -0.205 812 HA VAL 99 HA VAL 99 6.502 -0.487 2.519 813 HB VAL 99 HB VAL 99 4.992 0.310 0.011 814 1HG1 VAL 99 HG11 VAL 99 4.562 0.919 2.758 815 2HG1 VAL 99 HG12 VAL 99 5.230 2.365 2.001 816 3HG1 VAL 99 HG13 VAL 99 3.762 1.628 1.356 817 1HG2 VAL 99 HG21 VAL 99 7.694 0.700 0.682 818 2HG2 VAL 99 HG22 VAL 99 6.783 1.558 -0.560 819 3HG2 VAL 99 HG23 VAL 99 6.900 2.227 1.067 820 H ASN 100 H ASN 100 4.582 -2.344 0.193 821 HA ASN 100 HA ASN 100 2.165 -2.394 1.742 822 1HB ASN 100 HB2 ASN 100 3.171 -4.490 -0.208 823 2HB ASN 100 HB3 ASN 100 1.500 -4.240 0.298 824 1HD2 ASN 100 HD21 ASN 100 0.361 -3.190 -1.331 825 2HD2 ASN 100 HD22 ASN 100 0.975 -1.947 -2.309 826 H GLU 101 H GLU 101 5.056 -4.445 1.717 827 HA GLU 101 HA GLU 101 3.926 -6.402 3.547 828 1HB GLU 101 HB2 GLU 101 5.731 -7.065 2.053 829 2HB GLU 101 HB3 GLU 101 6.790 -5.830 2.736 830 1HG GLU 101 HG2 GLU 101 6.796 -6.934 4.890 831 2HG GLU 101 HG3 GLU 101 5.576 -8.089 4.349 832 H ALA 102 H ALA 102 5.848 -3.465 3.873 833 HA ALA 102 HA ALA 102 6.541 -3.839 6.638 834 1HB ALA 102 HB1 ALA 102 7.469 -2.121 4.908 835 2HB ALA 102 HB2 ALA 102 6.099 -1.128 5.405 836 3HB ALA 102 HB3 ALA 102 7.309 -1.618 6.591 837 H LEU 103 H LEU 103 3.809 -2.257 5.021 838 HA LEU 103 HA LEU 103 2.590 -1.244 7.412 839 1HB LEU 103 HB2 LEU 103 1.503 -1.922 4.674 840 2HB LEU 103 HB3 LEU 103 0.472 -1.285 5.957 841 HG LEU 103 HG LEU 103 3.004 0.184 5.548 842 1HD1 LEU 103 HD11 LEU 103 1.327 -0.476 3.294 843 2HD1 LEU 103 HD12 LEU 103 1.233 1.255 3.618 844 3HD1 LEU 103 HD13 LEU 103 2.799 0.496 3.329 845 1HD2 LEU 103 HD21 LEU 103 0.862 0.679 7.010 846 2HD2 LEU 103 HD22 LEU 103 1.695 2.005 6.196 847 3HD2 LEU 103 HD23 LEU 103 0.225 1.325 5.497 848 H VAL 104 H VAL 104 1.993 -4.241 5.541 849 HA VAL 104 HA VAL 104 0.030 -5.251 7.391 850 HB VAL 104 HB VAL 104 1.811 -6.947 5.630 851 1HG1 VAL 104 HG11 VAL 104 -1.008 -7.181 6.712 852 2HG1 VAL 104 HG12 VAL 104 -0.356 -8.252 5.473 853 3HG1 VAL 104 HG13 VAL 104 0.369 -8.219 7.081 854 1HG2 VAL 104 HG21 VAL 104 0.133 -4.778 4.826 855 2HG2 VAL 104 HG22 VAL 104 0.967 -5.944 3.798 856 3HG2 VAL 104 HG23 VAL 104 -0.670 -6.278 4.363 857 H ARG 105 H ARG 105 3.456 -5.026 7.502 858 HA ARG 105 HA ARG 105 3.876 -7.271 9.316 859 1HB ARG 105 HB2 ARG 105 5.508 -5.159 8.059 860 2HB ARG 105 HB3 ARG 105 6.035 -5.613 9.679 861 1HG ARG 105 HG2 ARG 105 5.902 -8.037 8.920 862 2HG ARG 105 HG3 ARG 105 5.691 -7.423 7.279 863 1HD ARG 105 HD2 ARG 105 7.972 -7.516 7.231 864 2HD ARG 105 HD3 ARG 105 7.849 -5.969 8.068 865 HE ARG 105 HE ARG 105 7.966 -7.418 10.215 866 1HH1 ARG 105 HH11 ARG 105 10.498 -6.936 8.413 867 2HH1 ARG 105 HH12 ARG 105 11.240 -8.495 8.545 868 1HH2 ARG 105 HH21 ARG 105 8.416 -10.021 9.859 869 2HH2 ARG 105 HH22 ARG 105 10.059 -10.242 9.362 870 H GLN 106 H GLN 106 3.235 -3.816 9.612 871 HA GLN 106 HA GLN 106 3.517 -4.000 12.565 872 1HB GLN 106 HB2 GLN 106 4.114 -1.983 10.728 873 2HB GLN 106 HB3 GLN 106 2.641 -1.423 11.523 874 1HG GLN 106 HG2 GLN 106 4.418 -2.569 13.483 875 2HG GLN 106 HG3 GLN 106 5.278 -1.344 12.548 876 1HE2 GLN 106 HE21 GLN 106 5.097 -0.255 14.846 877 2HE2 GLN 106 HE22 GLN 106 3.726 0.712 15.103 878 H GLY 107 H GLY 107 1.159 -4.609 10.341 879 1HA GLY 107 HA2 GLY 107 -1.157 -4.919 10.616 880 2HA GLY 107 HA3 GLY 107 -0.948 -4.518 12.322 881 H LEU 108 H LEU 108 -0.521 -2.728 9.246 882 HA LEU 108 HA LEU 108 -2.148 -0.534 10.466 883 1HB LEU 108 HB2 LEU 108 0.053 -0.321 8.386 884 2HB LEU 108 HB3 LEU 108 -0.862 1.027 9.063 885 HG LEU 108 HG LEU 108 0.962 -0.854 10.588 886 1HD1 LEU 108 HD11 LEU 108 1.324 1.710 9.265 887 2HD1 LEU 108 HD12 LEU 108 1.677 1.825 10.989 888 3HD1 LEU 108 HD13 LEU 108 2.532 0.650 9.989 889 1HD2 LEU 108 HD21 LEU 108 -0.737 1.473 11.546 890 2HD2 LEU 108 HD22 LEU 108 -1.012 -0.228 11.923 891 3HD2 LEU 108 HD23 LEU 108 0.427 0.589 12.533 892 H ALA 109 H ALA 109 -1.392 -2.308 7.489 893 HA ALA 109 HA ALA 109 -3.908 -1.216 6.298 894 1HB ALA 109 HB1 ALA 109 -1.638 -0.912 5.101 895 2HB ALA 109 HB2 ALA 109 -1.722 -2.643 4.777 896 3HB ALA 109 HB3 ALA 109 -2.969 -1.567 4.148 897 H LYS 110 H LYS 110 -5.489 -2.679 5.621 898 HA LYS 110 HA LYS 110 -5.089 -5.483 6.527 899 1HB LYS 110 HB2 LYS 110 -7.487 -3.758 5.983 900 2HB LYS 110 HB3 LYS 110 -7.653 -5.512 5.920 901 1HG LYS 110 HG2 LYS 110 -7.327 -5.763 8.173 902 2HG LYS 110 HG3 LYS 110 -6.189 -4.418 8.262 903 1HD LYS 110 HD2 LYS 110 -7.837 -3.095 9.028 904 2HD LYS 110 HD3 LYS 110 -8.716 -3.339 7.518 905 1HE LYS 110 HE2 LYS 110 -9.434 -5.609 8.589 906 2HE LYS 110 HE3 LYS 110 -8.964 -4.847 10.109 907 1HZ LYS 110 HZ1 LYS 110 -10.446 -2.958 8.778 908 2HZ LYS 110 HZ2 LYS 110 -11.283 -4.414 8.522 909 3HZ LYS 110 HZ3 LYS 110 -10.949 -3.890 10.103 910 H VAL 111 H VAL 111 -5.553 -7.255 5.090 911 HA VAL 111 HA VAL 111 -4.820 -6.720 2.321 912 HB VAL 111 HB VAL 111 -5.635 -9.235 3.795 913 1HG1 VAL 111 HG11 VAL 111 -5.261 -8.693 0.886 914 2HG1 VAL 111 HG12 VAL 111 -4.549 -10.175 1.523 915 3HG1 VAL 111 HG13 VAL 111 -6.282 -9.889 1.683 916 1HG2 VAL 111 HG21 VAL 111 -3.365 -8.087 4.161 917 2HG2 VAL 111 HG22 VAL 111 -3.317 -9.783 3.683 918 3HG2 VAL 111 HG23 VAL 111 -3.000 -8.522 2.491 919 H ALA 112 H ALA 112 -6.182 -6.547 0.582 920 HA ALA 112 HA ALA 112 -8.793 -7.670 0.395 921 1HB ALA 112 HB1 ALA 112 -8.731 -5.442 2.097 922 2HB ALA 112 HB2 ALA 112 -9.353 -4.821 0.568 923 3HB ALA 112 HB3 ALA 112 -10.165 -6.165 1.369 924 H TYR 113 H TYR 113 -10.095 -6.133 -1.347 925 HA TYR 113 HA TYR 113 -10.057 -5.555 -3.627 926 1HB TYR 113 HB2 TYR 113 -7.746 -3.970 -2.487 927 2HB TYR 113 HB3 TYR 113 -8.289 -3.789 -4.154 928 HD1 TYR 113 HD1 TYR 113 -11.048 -3.725 -4.271 929 HD2 TYR 113 HD2 TYR 113 -8.582 -2.371 -1.024 930 HE1 TYR 113 HE1 TYR 113 -12.867 -2.219 -3.518 931 HE2 TYR 113 HE2 TYR 113 -10.402 -0.864 -0.271 932 HH TYR 113 HH TYR 113 -12.524 -0.256 -0.566 933 H VAL 114 H VAL 114 -9.323 -7.956 -3.827 934 HA VAL 114 HA VAL 114 -6.589 -8.043 -5.037 935 HB VAL 114 HB VAL 114 -8.251 -10.320 -3.911 936 1HG1 VAL 114 HG11 VAL 114 -6.261 -10.419 -5.827 937 2HG1 VAL 114 HG12 VAL 114 -5.366 -10.683 -4.329 938 3HG1 VAL 114 HG13 VAL 114 -6.706 -11.748 -4.755 939 1HG2 VAL 114 HG21 VAL 114 -6.364 -8.419 -2.719 940 2HG2 VAL 114 HG22 VAL 114 -7.472 -9.541 -1.930 941 3HG2 VAL 114 HG23 VAL 114 -5.888 -10.098 -2.469 942 H TYR 115 H TYR 115 -7.262 -7.386 -7.137 943 HA TYR 115 HA TYR 115 -9.249 -9.161 -8.482 944 1HB TYR 115 HB2 TYR 115 -8.123 -6.520 -9.457 945 2HB TYR 115 HB3 TYR 115 -9.483 -7.409 -10.143 946 HD1 TYR 115 HD1 TYR 115 -8.311 -5.626 -7.088 947 HD2 TYR 115 HD2 TYR 115 -11.677 -7.172 -9.263 948 HE1 TYR 115 HE1 TYR 115 -9.852 -4.477 -5.521 949 HE2 TYR 115 HE2 TYR 115 -13.216 -6.024 -7.695 950 HH TYR 115 HH TYR 115 -12.771 -5.173 -4.973 951 H LYS 116 H LYS 116 -8.588 -10.458 -10.171 952 HA LYS 116 HA LYS 116 -5.688 -10.657 -10.643 953 1HB LYS 116 HB2 LYS 116 -8.091 -12.331 -11.243 954 2HB LYS 116 HB3 LYS 116 -6.674 -12.528 -12.276 955 1HG LYS 116 HG2 LYS 116 -5.736 -12.414 -9.596 956 2HG LYS 116 HG3 LYS 116 -7.099 -13.535 -9.619 957 1HD LYS 116 HD2 LYS 116 -5.691 -14.169 -11.934 958 2HD LYS 116 HD3 LYS 116 -4.424 -13.854 -10.748 959 1HE LYS 116 HE2 LYS 116 -6.199 -15.327 -9.268 960 2HE LYS 116 HE3 LYS 116 -6.383 -16.055 -10.863 961 1HZ LYS 116 HZ1 LYS 116 -3.685 -15.516 -9.842 962 2HZ LYS 116 HZ2 LYS 116 -4.530 -16.869 -9.256 963 3HZ LYS 116 HZ3 LYS 116 -4.209 -16.718 -10.918 964 HA PRO 117 HA PRO 117 -4.716 -11.866 -12.200 965 1HB PRO 117 HB2 PRO 117 -2.643 -11.356 -13.900 966 2HB PRO 117 HB3 PRO 117 -4.059 -12.311 -14.368 967 1HG PRO 117 HG2 PRO 117 -3.312 -9.558 -15.167 968 2HG PRO 117 HG3 PRO 117 -4.345 -10.728 -16.000 969 1HD PRO 117 HD2 PRO 117 -5.197 -8.503 -14.421 970 2HD PRO 117 HD3 PRO 117 -6.222 -9.768 -15.132 971 H ASN 118 H ASN 118 -4.901 -8.815 -11.452 972 HA ASN 118 HA ASN 118 -2.107 -8.159 -10.842 973 1HB ASN 118 HB2 ASN 118 -4.769 -6.838 -10.372 974 2HB ASN 118 HB3 ASN 118 -3.342 -6.279 -9.497 975 1HD2 ASN 118 HD21 ASN 118 -4.889 -4.902 -11.703 976 2HD2 ASN 118 HD22 ASN 118 -3.739 -4.575 -12.909 977 H ASN 119 H ASN 119 -1.815 -10.221 -9.567 978 HA ASN 119 HA ASN 119 -2.096 -9.656 -6.729 979 1HB ASN 119 HB2 ASN 119 -3.503 -11.565 -6.153 980 2HB ASN 119 HB3 ASN 119 -4.370 -10.531 -7.289 981 1HD2 ASN 119 HD21 ASN 119 -4.420 -13.595 -6.773 982 2HD2 ASN 119 HD22 ASN 119 -4.236 -14.261 -8.323 983 H THR 120 H THR 120 0.012 -10.307 -8.678 984 HA THR 120 HA THR 120 0.944 -12.939 -8.630 985 HB THR 120 HB THR 120 2.469 -10.332 -8.431 986 HG1 THR 120 HG1 THR 120 2.961 -11.398 -10.661 987 1HG2 THR 120 HG21 THR 120 3.413 -13.164 -8.413 988 2HG2 THR 120 HG22 THR 120 4.327 -11.998 -9.368 989 3HG2 THR 120 HG23 THR 120 4.112 -11.744 -7.636 990 H HIS 121 H HIS 121 1.165 -10.492 -6.067 991 HA HIS 121 HA HIS 121 2.329 -12.584 -4.278 992 1HB HIS 121 HB2 HIS 121 2.431 -9.569 -4.251 993 2HB HIS 121 HB3 HIS 121 2.772 -10.502 -2.794 994 HD1 HIS 121 HD1 HIS 121 4.449 -12.764 -3.662 995 HD2 HIS 121 HD2 HIS 121 4.860 -9.009 -5.425 996 HE1 HIS 121 HE1 HIS 121 6.763 -12.705 -4.690 997 H GLU 122 H GLU 122 -0.284 -13.025 -4.643 998 HA GLU 122 HA GLU 122 -1.952 -11.501 -2.792 999 1HB GLU 122 HB2 GLU 122 -2.756 -12.718 -4.895 1000 2HB GLU 122 HB3 GLU 122 -2.577 -14.213 -3.978 1001 1HG GLU 122 HG2 GLU 122 -4.074 -12.004 -2.657 1002 2HG GLU 122 HG3 GLU 122 -4.875 -12.816 -4.003 1003 H GLN 123 H GLN 123 -1.275 -15.016 -2.840 1004 HA GLN 123 HA GLN 123 -1.929 -15.505 -0.149 1005 1HB GLN 123 HB2 GLN 123 0.128 -16.860 -1.917 1006 2HB GLN 123 HB3 GLN 123 -0.379 -17.486 -0.348 1007 1HG GLN 123 HG2 GLN 123 -2.770 -17.396 -1.220 1008 2HG GLN 123 HG3 GLN 123 -2.083 -17.095 -2.816 1009 1HE2 GLN 123 HE21 GLN 123 -2.990 -19.237 -3.488 1010 2HE2 GLN 123 HE22 GLN 123 -2.180 -20.663 -3.053 1011 H LEU 124 H LEU 124 0.944 -14.055 -1.510 1012 HA LEU 124 HA LEU 124 2.693 -14.413 0.725 1013 1HB LEU 124 HB2 LEU 124 2.940 -13.310 -1.766 1014 2HB LEU 124 HB3 LEU 124 2.949 -11.869 -0.747 1015 HG LEU 124 HG LEU 124 5.232 -12.606 -0.952 1016 1HD1 LEU 124 HD11 LEU 124 3.953 -12.297 1.466 1017 2HD1 LEU 124 HD12 LEU 124 4.768 -13.846 1.677 1018 3HD1 LEU 124 HD13 LEU 124 5.700 -12.408 1.260 1019 1HD2 LEU 124 HD21 LEU 124 3.986 -15.290 -0.488 1020 2HD2 LEU 124 HD22 LEU 124 5.231 -14.820 -1.645 1021 3HD2 LEU 124 HD23 LEU 124 5.644 -15.034 0.056 1022 H LEU 125 H LEU 125 0.852 -11.482 -0.209 1023 HA LEU 125 HA LEU 125 1.271 -10.134 2.274 1024 1HB LEU 125 HB2 LEU 125 -0.713 -9.845 0.033 1025 2HB LEU 125 HB3 LEU 125 -0.918 -8.907 1.512 1026 HG LEU 125 HG LEU 125 1.696 -8.978 -0.005 1027 1HD1 LEU 125 HD11 LEU 125 -0.323 -8.103 -1.350 1028 2HD1 LEU 125 HD12 LEU 125 -0.366 -6.777 -0.187 1029 3HD1 LEU 125 HD13 LEU 125 1.062 -7.022 -1.192 1030 1HD2 LEU 125 HD21 LEU 125 0.487 -7.305 2.200 1031 2HD2 LEU 125 HD22 LEU 125 2.022 -8.171 2.198 1032 3HD2 LEU 125 HD23 LEU 125 1.835 -6.707 1.233 1033 H ARG 126 H ARG 126 -0.860 -12.712 1.393 1034 HA ARG 126 HA ARG 126 -2.861 -12.238 3.432 1035 1HB ARG 126 HB2 ARG 126 -2.785 -13.861 1.279 1036 2HB ARG 126 HB3 ARG 126 -2.328 -15.021 2.527 1037 1HG ARG 126 HG2 ARG 126 -4.325 -14.271 3.859 1038 2HG ARG 126 HG3 ARG 126 -4.816 -13.291 2.477 1039 1HD ARG 126 HD2 ARG 126 -5.357 -15.130 1.186 1040 2HD ARG 126 HD3 ARG 126 -4.193 -16.176 2.000 1041 HE ARG 126 HE ARG 126 -6.057 -15.626 3.967 1042 1HH1 ARG 126 HH11 ARG 126 -5.559 -17.977 1.748 1043 2HH1 ARG 126 HH12 ARG 126 -7.216 -18.437 1.544 1044 1HH2 ARG 126 HH21 ARG 126 -8.464 -15.705 3.274 1045 2HH2 ARG 126 HH22 ARG 126 -8.861 -17.151 2.407 1046 H LYS 127 H LYS 127 -0.446 -14.889 3.256 1047 HA LYS 127 HA LYS 127 -0.608 -15.759 5.885 1048 1HB LYS 127 HB2 LYS 127 1.569 -16.685 5.636 1049 2HB LYS 127 HB3 LYS 127 0.904 -16.643 4.004 1050 1HG LYS 127 HG2 LYS 127 2.090 -14.536 3.557 1051 2HG LYS 127 HG3 LYS 127 2.734 -14.541 5.199 1052 1HD LYS 127 HD2 LYS 127 4.485 -15.478 3.935 1053 2HD LYS 127 HD3 LYS 127 3.662 -16.892 4.593 1054 1HE LYS 127 HE2 LYS 127 2.243 -16.492 2.297 1055 2HE LYS 127 HE3 LYS 127 3.844 -15.950 1.798 1056 1HZ LYS 127 HZ1 LYS 127 3.436 -18.502 3.233 1057 2HZ LYS 127 HZ2 LYS 127 3.325 -18.400 1.541 1058 3HZ LYS 127 HZ3 LYS 127 4.780 -18.008 2.325 1059 H SER 128 H SER 128 1.256 -12.998 4.658 1060 HA SER 128 HA SER 128 2.478 -12.285 7.138 1061 1HB SER 128 HB2 SER 128 3.010 -10.214 6.112 1062 2HB SER 128 HB3 SER 128 2.951 -11.357 4.773 1063 HG SER 128 HG SER 128 1.756 -9.457 4.333 1064 H GLU 129 H GLU 129 -0.615 -11.308 5.663 1065 HA GLU 129 HA GLU 129 -1.409 -9.490 7.714 1066 1HB GLU 129 HB2 GLU 129 -2.575 -9.623 5.549 1067 2HB GLU 129 HB3 GLU 129 -3.126 -11.254 5.937 1068 1HG GLU 129 HG2 GLU 129 -4.843 -9.468 6.384 1069 2HG GLU 129 HG3 GLU 129 -4.438 -10.439 7.799 1070 H ALA 130 H ALA 130 -1.399 -12.977 7.541 1071 HA ALA 130 HA ALA 130 -3.230 -13.385 9.758 1072 1HB ALA 130 HB1 ALA 130 -2.487 -15.055 7.878 1073 2HB ALA 130 HB2 ALA 130 -1.122 -15.375 8.948 1074 3HB ALA 130 HB3 ALA 130 -2.770 -15.670 9.507 1075 H GLN 131 H GLN 131 0.253 -12.995 9.399 1076 HA GLN 131 HA GLN 131 0.958 -13.806 12.067 1077 1HB GLN 131 HB2 GLN 131 2.666 -13.617 10.325 1078 2HB GLN 131 HB3 GLN 131 2.337 -11.891 10.157 1079 1HG GLN 131 HG2 GLN 131 3.099 -11.466 12.421 1080 2HG GLN 131 HG3 GLN 131 3.279 -13.195 12.725 1081 1HE2 GLN 131 HE21 GLN 131 4.235 -11.390 9.772 1082 2HE2 GLN 131 HE22 GLN 131 5.888 -11.758 9.898 1083 H ALA 132 H ALA 132 0.109 -10.676 10.614 1084 HA ALA 132 HA ALA 132 0.492 -9.170 13.055 1085 1HB ALA 132 HB1 ALA 132 0.145 -8.470 10.455 1086 2HB ALA 132 HB2 ALA 132 -1.487 -8.198 11.067 1087 3HB ALA 132 HB3 ALA 132 -0.119 -7.357 11.798 1088 H LYS 133 H LYS 133 -2.127 -11.047 11.683 1089 HA LYS 133 HA LYS 133 -4.295 -10.013 13.211 1090 1HB LYS 133 HB2 LYS 133 -3.695 -12.597 11.832 1091 2HB LYS 133 HB3 LYS 133 -5.033 -12.571 12.979 1092 1HG LYS 133 HG2 LYS 133 -5.416 -10.241 11.533 1093 2HG LYS 133 HG3 LYS 133 -4.849 -11.379 10.310 1094 1HD LYS 133 HD2 LYS 133 -7.178 -11.781 12.209 1095 2HD LYS 133 HD3 LYS 133 -7.273 -11.541 10.464 1096 1HE LYS 133 HE2 LYS 133 -6.898 -13.729 10.074 1097 2HE LYS 133 HE3 LYS 133 -5.465 -13.718 11.102 1098 1HZ LYS 133 HZ1 LYS 133 -7.339 -13.615 12.952 1099 2HZ LYS 133 HZ2 LYS 133 -8.215 -14.435 11.748 1100 3HZ LYS 133 HZ3 LYS 133 -6.756 -15.081 12.331 1101 H LYS 134 H LYS 134 -2.253 -12.887 13.879 1102 HA LYS 134 HA LYS 134 -3.288 -13.156 16.576 1103 1HB LYS 134 HB2 LYS 134 -1.446 -14.810 16.845 1104 2HB LYS 134 HB3 LYS 134 -2.394 -15.102 15.386 1105 1HG LYS 134 HG2 LYS 134 -0.544 -14.894 14.127 1106 2HG LYS 134 HG3 LYS 134 -0.304 -13.256 14.740 1107 1HD LYS 134 HD2 LYS 134 0.901 -14.131 16.685 1108 2HD LYS 134 HD3 LYS 134 0.610 -15.784 16.145 1109 1HE LYS 134 HE2 LYS 134 1.729 -14.627 13.907 1110 2HE LYS 134 HE3 LYS 134 2.609 -13.841 15.218 1111 1HZ LYS 134 HZ1 LYS 134 2.883 -16.160 16.156 1112 2HZ LYS 134 HZ2 LYS 134 2.377 -16.732 14.641 1113 3HZ LYS 134 HZ3 LYS 134 3.787 -15.791 14.766 1114 H GLU 135 H GLU 135 -0.877 -11.194 15.107 1115 HA GLU 135 HA GLU 135 0.730 -10.817 17.516 1116 1HB GLU 135 HB2 GLU 135 0.797 -9.943 14.735 1117 2HB GLU 135 HB3 GLU 135 1.163 -8.621 15.843 1118 1HG GLU 135 HG2 GLU 135 2.904 -9.947 16.919 1119 2HG GLU 135 HG3 GLU 135 2.494 -11.342 15.921 1120 H LYS 136 H LYS 136 -2.285 -9.679 16.425 1121 HA LYS 136 HA LYS 136 -3.654 -7.890 17.113 1122 1HB LYS 136 HB2 LYS 136 -2.151 -8.268 19.717 1123 2HB LYS 136 HB3 LYS 136 -3.789 -7.645 19.511 1124 1HG LYS 136 HG2 LYS 136 -4.524 -9.818 18.629 1125 2HG LYS 136 HG3 LYS 136 -2.885 -10.449 18.786 1126 1HD LYS 136 HD2 LYS 136 -2.959 -10.128 21.211 1127 2HD LYS 136 HD3 LYS 136 -4.563 -9.406 21.086 1128 1HE LYS 136 HE2 LYS 136 -3.868 -12.234 20.241 1129 2HE LYS 136 HE3 LYS 136 -4.666 -11.800 21.753 1130 1HZ LYS 136 HZ1 LYS 136 -5.968 -10.576 19.559 1131 2HZ LYS 136 HZ2 LYS 136 -5.858 -12.248 19.302 1132 3HZ LYS 136 HZ3 LYS 136 -6.598 -11.654 20.711 1133 H LEU 137 H LEU 137 -1.957 -6.644 15.638 1134 HA LEU 137 HA LEU 137 -0.532 -4.619 17.305 1135 1HB LEU 137 HB2 LEU 137 0.233 -6.059 14.979 1136 2HB LEU 137 HB3 LEU 137 0.048 -4.372 14.500 1137 HG LEU 137 HG LEU 137 1.470 -4.940 17.065 1138 1HD1 LEU 137 HD11 LEU 137 2.242 -6.359 14.855 1139 2HD1 LEU 137 HD12 LEU 137 3.192 -4.885 14.667 1140 3HD1 LEU 137 HD13 LEU 137 3.341 -5.848 16.137 1141 1HD2 LEU 137 HD21 LEU 137 1.022 -2.746 15.281 1142 2HD2 LEU 137 HD22 LEU 137 1.883 -2.739 16.819 1143 3HD2 LEU 137 HD23 LEU 137 2.753 -3.073 15.323 1144 H ASN 138 H ASN 138 -1.305 -2.569 17.340 1145 HA ASN 138 HA ASN 138 -2.856 -0.833 16.981 1146 1HB ASN 138 HB2 ASN 138 -2.002 -1.524 14.154 1147 2HB ASN 138 HB3 ASN 138 -2.845 -0.042 14.609 1148 1HD2 ASN 138 HD21 ASN 138 0.211 -1.179 13.993 1149 2HD2 ASN 138 HD22 ASN 138 1.111 -0.115 14.962 1150 H ILE 139 H ILE 139 -3.737 -2.132 13.864 1151 HA ILE 139 HA ILE 139 -6.515 -2.055 14.362 1152 HB ILE 139 HB ILE 139 -4.912 -3.686 12.376 1153 1HG1 ILE 139 HG12 ILE 139 -6.589 -1.592 11.308 1154 2HG1 ILE 139 HG13 ILE 139 -5.547 -0.935 12.572 1155 1HG2 ILE 139 HG21 ILE 139 -7.822 -3.579 12.960 1156 2HG2 ILE 139 HG22 ILE 139 -7.369 -3.465 11.259 1157 3HG2 ILE 139 HG23 ILE 139 -6.870 -4.863 12.214 1158 1HD1 ILE 139 HD11 ILE 139 -3.921 -2.688 11.075 1159 2HD1 ILE 139 HD12 ILE 139 -4.843 -1.759 9.892 1160 3HD1 ILE 139 HD13 ILE 139 -3.855 -0.926 11.091 1161 H TRP 140 H TRP 140 -4.595 -5.054 13.996 1162 HA TRP 140 HA TRP 140 -6.630 -6.703 15.168 1163 1HB TRP 140 HB2 TRP 140 -3.668 -7.316 15.035 1164 2HB TRP 140 HB3 TRP 140 -5.002 -8.471 15.081 1165 HD1 TRP 140 HD1 TRP 140 -2.893 -6.517 12.728 1166 HE1 TRP 140 HE1 TRP 140 -3.761 -6.784 10.316 1167 HE3 TRP 140 HE3 TRP 140 -7.401 -8.732 13.655 1168 HZ2 TRP 140 HZ2 TRP 140 -6.063 -7.803 8.959 1169 HZ3 TRP 140 HZ3 TRP 140 -8.910 -9.340 11.784 1170 HH2 TRP 140 HH2 TRP 140 -8.248 -8.878 9.440 1171 H SER 141 H SER 141 -4.508 -4.488 16.590 1172 HA SER 141 HA SER 141 -3.798 -5.769 19.023 1173 1HB SER 141 HB2 SER 141 -3.455 -3.248 17.977 1174 2HB SER 141 HB3 SER 141 -4.585 -2.945 19.293 1175 HG SER 141 HG SER 141 -1.944 -3.729 19.347 1176 H GLU 142 H GLU 142 -6.708 -3.924 18.160 1177 HA GLU 142 HA GLU 142 -8.024 -5.074 20.590 1178 1HB GLU 142 HB2 GLU 142 -8.519 -2.445 19.162 1179 2HB GLU 142 HB3 GLU 142 -9.556 -3.082 20.438 1180 1HG GLU 142 HG2 GLU 142 -7.074 -3.299 21.587 1181 2HG GLU 142 HG3 GLU 142 -6.898 -1.825 20.633 1182 H ASP 143 H ASP 143 -10.627 -4.780 20.060 1183 HA ASP 143 HA ASP 143 -11.140 -5.730 17.295 1184 1HB ASP 143 HB2 ASP 143 -10.857 -7.538 19.375 1185 2HB ASP 143 HB3 ASP 143 -12.602 -7.290 19.302 1186 H ASN 144 H ASN 144 -13.849 -6.521 17.900 1187 HA ASN 144 HA ASN 144 -15.054 -4.043 19.019 1188 1HB ASN 144 HB2 ASN 144 -16.680 -4.131 17.015 1189 2HB ASN 144 HB3 ASN 144 -15.064 -3.493 16.711 1190 1HD2 ASN 144 HD21 ASN 144 -13.790 -4.574 15.160 1191 2HD2 ASN 144 HD22 ASN 144 -14.229 -6.039 14.424 1192 H ALA 145 H ALA 145 -14.959 -6.524 20.287 1193 HA ALA 145 HA ALA 145 -17.696 -7.641 19.859 1194 1HB ALA 145 HB1 ALA 145 -15.563 -9.127 19.807 1195 2HB ALA 145 HB2 ALA 145 -15.558 -8.916 21.558 1196 3HB ALA 145 HB3 ALA 145 -16.936 -9.680 20.766 1197 H ASP 146 H ASP 146 -18.359 -8.677 22.222 1198 HA ASP 146 HA ASP 146 -17.719 -7.024 24.507 1199 1HB ASP 146 HB2 ASP 146 -19.915 -5.906 24.718 1200 2HB ASP 146 HB3 ASP 146 -19.078 -5.391 23.254 1201 H SER 147 H SER 147 -19.360 -7.536 26.337 1202 HA SER 147 HA SER 147 -19.562 -10.337 26.675 1203 1HB SER 147 HB2 SER 147 -21.396 -8.325 27.994 1204 2HB SER 147 HB3 SER 147 -20.862 -9.877 28.634 1205 HG SER 147 HG SER 147 -18.670 -8.914 28.416 1206 H GLY 148 H GLY 148 -21.760 -8.052 25.170 1207 1HA GLY 148 HA2 GLY 148 -23.296 -8.947 23.445 1208 2HA GLY 148 HA3 GLY 148 -23.534 -10.358 24.477 1209 H GLN 149 H GLN 149 -23.778 -8.866 26.950 1210 HA GLN 149 HA GLN 149 -26.579 -8.375 26.968 1211 1HB GLN 149 HB2 GLN 149 -24.605 -8.577 28.885 1212 2HB GLN 149 HB3 GLN 149 -25.053 -6.873 28.982 1213 1HG GLN 149 HG2 GLN 149 -27.469 -7.604 29.093 1214 2HG GLN 149 HG3 GLN 149 -26.894 -9.266 29.238 1215 1HE2 GLN 149 HE21 GLN 149 -28.176 -8.830 31.438 1216 2HE2 GLN 149 HE22 GLN 149 -27.221 -8.288 32.732 1217 HN3 PTP 150 H3 PTP 150 -8.621 -3.070 -7.835 1218 1H5M PTP 150 H51 PTP 150 -6.781 0.279 -4.129 1219 2H5M PTP 150 H52 PTP 150 -6.074 -1.337 -4.371 1220 3H5M PTP 150 H53 PTP 150 -7.430 -1.119 -3.239 1221 H6 PTP 150 H6 PTP 150 -9.184 0.600 -4.784 1222 H1* PTP 150 H1' PTP 150 -11.326 0.547 -7.707 1223 2H2* PTP 150 H2' PTP 150 -12.088 -0.761 -5.108 1224 H3* PTP 150 H3' PTP 150 -13.300 1.135 -4.344 1225 H4* PTP 150 H4' PTP 150 -11.872 3.228 -5.360 1226 2H5* PTP 150 H5' PTP 150 -11.052 1.009 -3.401
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