NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
654044 | 7afq | 28014 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 HA PRO 8 HA PRO 8 56.226 42.397 26.900 2 HB2 PRO 8 HB2 PRO 8 54.531 40.522 26.610 3 HB3 PRO 8 HB3 PRO 8 56.028 40.120 26.791 4 HG2 PRO 8 HG2 PRO 8 54.034 40.112 28.829 5 HG3 PRO 8 HG3 PRO 8 55.076 38.983 28.560 6 HD2 PRO 8 HD2 PRO 8 55.564 40.741 30.384 7 HD3 PRO 8 HD3 PRO 8 56.751 40.111 29.592 8 H GLN 9 H GLN 9 55.478 44.568 27.215 9 HA GLN 9 HA GLN 9 53.137 45.192 28.203 10 HB2 GLN 9 HB2 GLN 9 53.637 47.389 27.482 11 HB3 GLN 9 HB3 GLN 9 54.815 46.781 28.304 12 HG2 GLN 9 HG2 GLN 9 55.986 46.360 26.272 13 HG3 GLN 9 HG3 GLN 9 54.822 47.027 25.479 14 HE21 GLN 9 HE21 GLN 9 57.244 47.876 27.784 15 HE22 GLN 9 HE22 GLN 9 57.364 49.312 27.408 16 H ARG 10 H ARG 10 53.893 44.690 24.863 17 HA ARG 10 HA ARG 10 51.560 45.555 23.928 18 HB2 ARG 10 HB2 ARG 10 53.592 44.299 22.410 19 HB3 ARG 10 HB3 ARG 10 52.386 45.073 21.796 20 HG2 ARG 10 HG2 ARG 10 53.320 46.999 23.145 21 HG3 ARG 10 HG3 ARG 10 54.645 46.181 23.053 22 HD2 ARG 10 HD2 ARG 10 53.227 47.161 20.797 23 HD3 ARG 10 HD3 ARG 10 54.557 47.781 21.327 24 HE ARG 10 HE ARG 10 55.103 45.308 20.684 25 HH11 ARG 10 HH11 ARG 10 56.007 44.648 18.770 26 HH12 ARG 10 HH12 ARG 10 55.999 45.555 17.588 27 HH21 ARG 10 HH21 ARG 10 54.423 48.027 18.937 28 HH22 ARG 10 HH22 ARG 10 55.067 47.547 17.683 29 H VAL 11 H VAL 11 52.798 42.332 24.284 30 HA VAL 11 HA VAL 11 50.743 41.006 23.355 31 HB VAL 11 HB VAL 11 52.582 40.034 25.212 32 HG11 VAL 11 HG11 VAL 11 51.957 37.852 24.426 33 HG12 VAL 11 HG12 VAL 11 50.703 38.592 25.047 34 HG13 VAL 11 HG13 VAL 11 50.883 38.523 23.475 35 HG21 VAL 11 HG21 VAL 11 53.750 39.065 23.370 36 HG22 VAL 11 HG22 VAL 11 52.732 39.765 22.378 37 HG23 VAL 11 HG23 VAL 11 53.728 40.643 23.242 38 H ALA 12 H ALA 12 51.241 42.144 26.620 39 HA ALA 12 HA ALA 12 49.066 41.233 27.755 40 HB1 ALA 12 HB1 ALA 12 49.553 42.837 29.428 41 HB2 ALA 12 HB2 ALA 12 50.866 42.048 29.029 42 HB3 ALA 12 HB3 ALA 12 50.616 43.506 28.464 43 H GLN 13 H GLN 13 49.291 44.175 25.900 44 HA GLN 13 HA GLN 13 46.840 45.003 26.319 45 HB2 GLN 13 HB2 GLN 13 48.748 45.771 24.354 46 HB3 GLN 13 HB3 GLN 13 47.331 46.421 24.361 47 HG2 GLN 13 HG2 GLN 13 49.046 46.625 26.602 48 HG3 GLN 13 HG3 GLN 13 49.058 47.706 25.479 49 HE21 GLN 13 HE21 GLN 13 48.559 48.868 27.724 50 HE22 GLN 13 HE22 GLN 13 47.125 49.201 27.950 51 H GLU 14 H GLU 14 48.033 43.058 23.662 52 HA GLU 14 HA GLU 14 45.790 42.741 22.374 53 HB2 GLU 14 HB2 GLU 14 48.094 41.091 22.314 54 HB3 GLU 14 HB3 GLU 14 46.866 40.795 21.400 55 HG2 GLU 14 HG2 GLU 14 47.160 43.004 20.434 56 HG3 GLU 14 HG3 GLU 14 48.496 43.116 21.231 57 H MET 15 H MET 15 47.022 40.773 24.974 58 HA MET 15 HA MET 15 45.158 38.947 25.022 59 HB2 MET 15 HB2 MET 15 47.139 39.579 26.919 60 HB3 MET 15 HB3 MET 15 46.066 38.498 27.251 61 HG2 MET 15 HG2 MET 15 46.782 37.308 25.251 62 HG3 MET 15 HG3 MET 15 47.967 38.317 25.146 63 HE1 MET 15 HE1 MET 15 49.772 35.123 26.096 64 HE2 MET 15 HE2 MET 15 48.523 35.270 25.132 65 HE3 MET 15 HE3 MET 15 49.720 36.303 25.039 66 H GLN 16 H GLN 16 45.277 41.900 26.948 67 HA GLN 16 HA GLN 16 43.137 41.651 28.312 68 HB2 GLN 16 HB2 GLN 16 44.402 43.976 27.293 69 HB3 GLN 16 HB3 GLN 16 43.043 44.161 28.035 70 HG2 GLN 16 HG2 GLN 16 43.945 43.388 30.035 71 HG3 GLN 16 HG3 GLN 16 45.249 42.913 29.323 72 HE21 GLN 16 HE21 GLN 16 46.794 44.545 28.634 73 HE22 GLN 16 HE22 GLN 16 46.766 45.941 29.154 74 H LYS 17 H LYS 17 43.217 42.825 25.024 75 HA LYS 17 HA LYS 17 40.639 43.340 24.709 76 HB2 LYS 17 HB2 LYS 17 42.341 44.438 23.453 77 HB3 LYS 17 HB3 LYS 17 42.711 43.086 22.769 78 HG2 LYS 17 HG2 LYS 17 40.683 43.059 21.608 79 HG3 LYS 17 HG3 LYS 17 40.183 44.316 22.384 80 HD2 LYS 17 HD2 LYS 17 41.776 45.675 21.358 81 HD3 LYS 17 HD3 LYS 17 42.505 44.440 20.746 82 HE2 LYS 17 HE2 LYS 17 39.930 45.287 19.920 83 HE3 LYS 17 HE3 LYS 17 41.230 45.585 19.112 84 HZ1 LYS 17 HZ1 LYS 17 40.394 43.786 18.165 85 HZ2 LYS 17 HZ2 LYS 17 41.455 43.227 18.987 86 HZ3 LYS 17 HZ3 LYS 17 40.073 43.139 19.426 87 H GLU 18 H GLU 18 42.346 40.541 23.563 88 HA GLU 18 HA GLU 18 40.218 39.447 22.412 89 HB2 GLU 18 HB2 GLU 18 42.609 39.111 21.821 90 HB3 GLU 18 HB3 GLU 18 42.560 37.976 22.890 91 HG2 GLU 18 HG2 GLU 18 42.132 36.938 20.893 92 HG3 GLU 18 HG3 GLU 18 40.766 36.958 21.647 93 H ILE 19 H ILE 19 41.678 38.745 25.511 94 HA ILE 19 HA ILE 19 40.173 36.749 26.256 95 HB ILE 19 HB ILE 19 41.602 38.511 27.916 96 HG12 ILE 19 HG12 ILE 19 42.322 35.855 27.139 97 HG13 ILE 19 HG13 ILE 19 42.932 37.114 26.447 98 HG21 ILE 19 HG21 ILE 19 41.355 36.949 29.665 99 HG22 ILE 19 HG22 ILE 19 39.940 37.504 29.218 100 HG23 ILE 19 HG23 ILE 19 40.415 36.071 28.740 101 HD11 ILE 19 HD11 ILE 19 44.465 36.265 28.015 102 HD12 ILE 19 HD12 ILE 19 44.015 37.715 28.468 103 HD13 ILE 19 HD13 ILE 19 43.395 36.437 29.171 104 H ALA 20 H ALA 20 39.591 40.177 26.724 105 HA ALA 20 HA ALA 20 37.354 40.111 28.066 106 HB1 ALA 20 HB1 ALA 20 37.148 42.365 27.318 107 HB2 ALA 20 HB2 ALA 20 38.633 42.094 27.798 108 HB3 ALA 20 HB3 ALA 20 38.290 42.107 26.251 109 H LEU 21 H LEU 21 37.613 39.879 24.607 110 HA LEU 21 HA LEU 21 35.021 39.659 24.090 111 HB2 LEU 21 HB2 LEU 21 36.543 40.410 22.453 112 HB3 LEU 21 HB3 LEU 21 37.245 39.018 22.454 113 HG LEU 21 HG LEU 21 35.306 38.025 21.559 114 HD11 LEU 21 HD11 LEU 21 33.510 39.318 20.778 115 HD12 LEU 21 HD12 LEU 21 33.645 39.457 22.351 116 HD13 LEU 21 HD13 LEU 21 34.173 40.612 21.406 117 HD21 LEU 21 HD21 LEU 21 35.482 39.024 19.384 118 HD22 LEU 21 HD22 LEU 21 36.197 40.277 20.036 119 HD23 LEU 21 HD23 LEU 21 36.924 38.871 20.022 120 H ILE 22 H ILE 22 37.349 37.101 24.588 121 HA ILE 22 HA ILE 22 35.753 35.058 24.069 122 HB ILE 22 HB ILE 22 38.185 35.059 25.462 123 HG12 ILE 22 HG12 ILE 22 37.859 34.139 22.786 124 HG13 ILE 22 HG13 ILE 22 38.240 35.627 23.058 125 HG21 ILE 22 HG21 ILE 22 38.205 32.686 25.122 126 HG22 ILE 22 HG22 ILE 22 36.953 33.096 25.999 127 HG23 ILE 22 HG23 ILE 22 36.770 32.782 24.459 128 HD11 ILE 22 HD11 ILE 22 40.182 34.403 22.566 129 HD12 ILE 22 HD12 ILE 22 40.273 34.938 24.053 130 HD13 ILE 22 HD13 ILE 22 39.888 33.427 23.777 131 H LEU 23 H LEU 23 36.272 36.636 27.117 132 HA LEU 23 HA LEU 23 34.731 35.296 28.675 133 HB2 LEU 23 HB2 LEU 23 35.887 37.837 28.789 134 HB3 LEU 23 HB3 LEU 23 34.605 37.713 29.668 135 HG LEU 23 HG LEU 23 35.568 36.024 30.912 136 HD11 LEU 23 HD11 LEU 23 37.803 35.369 30.701 137 HD12 LEU 23 HD12 LEU 23 36.972 34.981 29.410 138 HD13 LEU 23 HD13 LEU 23 37.926 36.245 29.387 139 HD21 LEU 23 HD21 LEU 23 37.277 37.333 31.996 140 HD22 LEU 23 HD22 LEU 23 37.310 38.290 30.735 141 HD23 LEU 23 HD23 LEU 23 36.023 38.238 31.657 142 H GLN 24 H GLN 24 33.627 37.541 26.347 143 HA GLN 24 HA GLN 24 31.071 37.574 27.111 144 HB2 GLN 24 HB2 GLN 24 32.344 38.724 24.841 145 HB3 GLN 24 HB3 GLN 24 30.814 38.900 25.097 146 HG2 GLN 24 HG2 GLN 24 31.166 40.228 26.923 147 HG3 GLN 24 HG3 GLN 24 32.666 39.813 27.023 148 HE21 GLN 24 HE21 GLN 24 32.204 42.462 27.063 149 HE22 GLN 24 HE22 GLN 24 32.637 43.130 25.804 150 H ARG 25 H ARG 25 32.780 35.688 24.798 151 HA ARG 25 HA ARG 25 30.571 34.776 23.575 152 HB2 ARG 25 HB2 ARG 25 33.293 34.594 22.749 153 HB3 ARG 25 HB3 ARG 25 32.153 33.921 21.926 154 HG2 ARG 25 HG2 ARG 25 32.575 36.709 22.192 155 HG3 ARG 25 HG3 ARG 25 32.641 35.901 20.860 156 HD2 ARG 25 HD2 ARG 25 30.264 36.549 22.250 157 HD3 ARG 25 HD3 ARG 25 30.675 37.125 20.860 158 HE ARG 25 HE ARG 25 30.444 34.656 20.317 159 HH11 ARG 25 HH11 ARG 25 28.715 33.407 19.838 160 HH12 ARG 25 HH12 ARG 25 27.333 33.853 20.174 161 HH21 ARG 25 HH21 ARG 25 28.141 36.626 21.636 162 HH22 ARG 25 HH22 ARG 25 26.992 35.764 21.241 163 H GLU 26 H GLU 26 33.079 33.228 25.363 164 HA GLU 26 HA GLU 26 32.280 30.724 24.765 165 HB2 GLU 26 HB2 GLU 26 34.599 31.354 24.874 166 HB3 GLU 26 HB3 GLU 26 34.438 31.577 26.409 167 HG2 GLU 26 HG2 GLU 26 35.478 29.502 25.864 168 HG3 GLU 26 HG3 GLU 26 34.252 29.342 26.816 169 H ILE 27 H ILE 27 31.489 32.728 27.268 170 HA ILE 27 HA ILE 27 29.778 30.955 28.401 171 HB ILE 27 HB ILE 27 30.137 31.923 30.510 172 HG12 ILE 27 HG12 ILE 27 32.511 33.048 29.490 173 HG13 ILE 27 HG13 ILE 27 31.246 33.890 29.839 174 HG21 ILE 27 HG21 ILE 27 32.027 30.577 31.019 175 HG22 ILE 27 HG22 ILE 27 31.024 29.791 30.077 176 HG23 ILE 27 HG23 ILE 27 32.334 30.443 29.470 177 HD11 ILE 27 HD11 ILE 27 32.798 34.053 31.590 178 HD12 ILE 27 HD12 ILE 27 31.491 33.335 32.124 179 HD13 ILE 27 HD13 ILE 27 32.776 32.480 31.771 180 H LYS 28 H LYS 28 27.690 32.016 29.115 181 HA LYS 28 HA LYS 28 26.900 34.163 27.753 182 HB2 LYS 28 HB2 LYS 28 25.602 32.428 29.513 183 HB3 LYS 28 HB3 LYS 28 24.945 33.828 29.311 184 HG2 LYS 28 HG2 LYS 28 25.436 32.109 27.105 185 HG3 LYS 28 HG3 LYS 28 24.072 32.081 27.862 186 HD2 LYS 28 HD2 LYS 28 23.892 34.482 27.301 187 HD3 LYS 28 HD3 LYS 28 25.056 34.232 26.293 188 HE2 LYS 28 HE2 LYS 28 22.556 32.897 26.102 189 HE3 LYS 28 HE3 LYS 28 22.901 34.158 25.251 190 HZ1 LYS 28 HZ1 LYS 28 23.228 32.283 24.034 191 HZ2 LYS 28 HZ2 LYS 28 24.513 32.941 24.199 192 HZ3 LYS 28 HZ3 LYS 28 24.192 31.766 24.992 193 H ASP 29 H ASP 29 28.182 36.031 28.361 194 HA ASP 29 HA ASP 29 28.271 36.970 30.793 195 HB2 ASP 29 HB2 ASP 29 29.755 37.619 28.924 196 HB3 ASP 29 HB3 ASP 29 28.648 38.651 28.547 197 HA PRO 30 HA PRO 30 24.231 39.236 29.925 198 HB2 PRO 30 HB2 PRO 30 22.906 36.957 28.838 199 HB3 PRO 30 HB3 PRO 30 22.511 38.448 28.604 200 HG2 PRO 30 HG2 PRO 30 23.830 37.345 26.734 201 HG3 PRO 30 HG3 PRO 30 24.270 38.793 27.113 202 HD2 PRO 30 HD2 PRO 30 25.511 36.378 27.967 203 HD3 PRO 30 HD3 PRO 30 26.245 37.676 27.510 204 H ARG 31 H ARG 31 24.662 36.020 31.127 205 HA ARG 31 HA ARG 31 23.025 36.095 33.181 206 HB2 ARG 31 HB2 ARG 31 24.071 34.099 32.263 207 HB3 ARG 31 HB3 ARG 31 25.373 34.509 33.017 208 HG2 ARG 31 HG2 ARG 31 24.385 34.171 35.083 209 HG3 ARG 31 HG3 ARG 31 22.966 34.047 34.448 210 HD2 ARG 31 HD2 ARG 31 23.558 31.898 34.981 211 HD3 ARG 31 HD3 ARG 31 23.675 31.969 33.428 212 HE ARG 31 HE ARG 31 26.084 32.456 34.289 213 HH11 ARG 31 HH11 ARG 31 27.729 30.957 34.491 214 HH12 ARG 31 HH12 ARG 31 27.408 29.512 34.650 215 HH21 ARG 31 HH21 ARG 31 24.208 29.742 34.524 216 HH22 ARG 31 HH22 ARG 31 25.357 28.804 34.669 217 H LEU 32 H LEU 32 25.952 37.658 32.882 218 HA LEU 32 HA LEU 32 26.120 38.573 35.425 219 HB2 LEU 32 HB2 LEU 32 28.178 38.542 33.456 220 HB3 LEU 32 HB3 LEU 32 28.392 38.987 34.935 221 HG LEU 32 HG LEU 32 27.787 36.323 34.223 222 HD11 LEU 32 HD11 LEU 32 30.097 35.871 34.656 223 HD12 LEU 32 HD12 LEU 32 29.967 36.926 33.481 224 HD13 LEU 32 HD13 LEU 32 30.330 37.411 34.945 225 HD21 LEU 32 HD21 LEU 32 28.405 35.722 36.409 226 HD22 LEU 32 HD22 LEU 32 28.648 37.248 36.756 227 HD23 LEU 32 HD23 LEU 32 27.183 36.730 36.442 228 H GLY 33 H GLY 33 24.513 39.758 33.051 229 HA2 GLY 33 HA2 GLY 33 23.620 41.691 32.768 230 HA3 GLY 33 HA3 GLY 33 24.706 42.334 33.685 231 H MET 34 H MET 34 26.076 40.642 31.107 232 HA MET 34 HA MET 34 27.205 41.112 29.390 233 HB2 MET 34 HB2 MET 34 24.907 41.332 28.634 234 HB3 MET 34 HB3 MET 34 25.141 42.873 28.653 235 HG2 MET 34 HG2 MET 34 25.426 42.064 26.481 236 HG3 MET 34 HG3 MET 34 26.760 42.697 26.984 237 HE1 MET 34 HE1 MET 34 28.258 40.139 24.758 238 HE2 MET 34 HE2 MET 34 27.029 41.103 24.493 239 HE3 MET 34 HE3 MET 34 28.321 41.651 25.226 240 H MET 35 H MET 35 28.164 42.572 31.606 241 HA MET 35 HA MET 35 29.750 44.412 30.484 242 HB2 MET 35 HB2 MET 35 27.717 45.562 31.225 243 HB3 MET 35 HB3 MET 35 28.253 45.346 32.673 244 HG2 MET 35 HG2 MET 35 30.242 46.549 32.063 245 HG3 MET 35 HG3 MET 35 29.596 46.849 30.676 246 HE1 MET 35 HE1 MET 35 29.646 50.297 32.099 247 HE2 MET 35 HE2 MET 35 30.756 49.173 32.208 248 HE3 MET 35 HE3 MET 35 30.000 49.410 30.836 249 H THR 36 H THR 36 30.409 41.843 31.603 250 HA THR 36 HA THR 36 32.157 42.349 33.560 251 HB THR 36 HB THR 36 32.147 40.074 31.936 252 HG1 THR 36 HG1 THR 36 30.510 39.421 32.962 253 HG21 THR 36 HG21 THR 36 33.171 38.965 33.749 254 HG22 THR 36 HG22 THR 36 34.058 40.185 33.266 255 HG23 THR 36 HG23 THR 36 33.164 40.321 34.566 256 H THR 37 H THR 37 34.317 43.103 33.232 257 HA THR 37 HA THR 37 35.294 43.585 30.736 258 HB THR 37 HB THR 37 35.356 45.362 32.874 259 HG1 THR 37 HG1 THR 37 33.861 46.572 31.675 260 HG21 THR 37 HG21 THR 37 36.012 47.097 31.394 261 HG22 THR 37 HG22 THR 37 37.089 45.938 31.455 262 HG23 THR 37 HG23 THR 37 36.094 46.030 30.227 263 H VAL 38 H VAL 38 37.687 43.377 30.539 264 HA VAL 38 HA VAL 38 39.072 42.366 32.646 265 HB VAL 38 HB VAL 38 39.894 42.570 29.986 266 HG11 VAL 38 HG11 VAL 38 41.769 41.220 30.552 267 HG12 VAL 38 HG12 VAL 38 41.814 42.593 31.340 268 HG13 VAL 38 HG13 VAL 38 41.332 41.274 32.074 269 HG21 VAL 38 HG21 VAL 38 39.674 40.177 29.949 270 HG22 VAL 38 HG22 VAL 38 39.154 40.222 31.445 271 HG23 VAL 38 HG23 VAL 38 38.280 40.850 30.283 272 H SER 39 H SER 39 40.272 43.710 34.005 273 HA SER 39 HA SER 39 40.844 46.244 33.377 274 HB2 SER 39 HB2 SER 39 41.374 46.498 35.672 275 HB3 SER 39 HB3 SER 39 39.926 45.944 35.496 276 HG SER 39 HG SER 39 41.447 44.860 36.918 277 H GLY 40 H GLY 40 42.700 43.397 33.602 278 HA2 GLY 40 HA2 GLY 40 44.818 44.238 32.391 279 HA3 GLY 40 HA3 GLY 40 45.120 44.286 33.920 280 H VAL 41 H VAL 41 46.617 42.613 32.339 281 HA VAL 41 HA VAL 41 46.229 40.191 33.474 282 HB VAL 41 HB VAL 41 47.236 39.123 31.750 283 HG11 VAL 41 HG11 VAL 41 45.500 39.312 30.105 284 HG12 VAL 41 HG12 VAL 41 44.892 39.270 31.566 285 HG13 VAL 41 HG13 VAL 41 45.021 40.651 30.801 286 HG21 VAL 41 HG21 VAL 41 47.701 40.141 29.667 287 HG22 VAL 41 HG22 VAL 41 47.365 41.551 30.304 288 HG23 VAL 41 HG23 VAL 41 48.619 40.731 30.815 289 H GLU 42 H GLU 42 48.292 39.028 34.103 290 HA GLU 42 HA GLU 42 50.635 40.419 34.244 291 HB2 GLU 42 HB2 GLU 42 49.591 40.722 36.326 292 HB3 GLU 42 HB3 GLU 42 49.427 39.179 36.482 293 HG2 GLU 42 HG2 GLU 42 51.806 38.964 36.578 294 HG3 GLU 42 HG3 GLU 42 51.931 40.517 36.500 295 H MET 43 H MET 43 52.319 39.161 33.403 296 HA MET 43 HA MET 43 51.785 36.568 32.734 297 HB2 MET 43 HB2 MET 43 53.161 38.482 31.140 298 HB3 MET 43 HB3 MET 43 52.932 37.005 30.695 299 HG2 MET 43 HG2 MET 43 50.620 37.357 30.580 300 HG3 MET 43 HG3 MET 43 50.786 38.802 31.140 301 HE1 MET 43 HE1 MET 43 51.863 37.468 27.049 302 HE2 MET 43 HE2 MET 43 52.624 36.958 28.341 303 HE3 MET 43 HE3 MET 43 51.098 36.592 28.124 304 H SER 44 H SER 44 53.434 34.908 32.869 305 HA SER 44 HA SER 44 55.443 35.294 34.507 306 HB2 SER 44 HB2 SER 44 54.445 33.130 34.393 307 HB3 SER 44 HB3 SER 44 54.854 32.992 32.894 308 HG SER 44 HG SER 44 56.522 32.122 33.714 309 H ARG 45 H ARG 45 57.763 35.318 34.108 310 HA ARG 45 HA ARG 45 58.952 36.233 32.022 311 HB2 ARG 45 HB2 ARG 45 59.874 36.119 34.253 312 HB3 ARG 45 HB3 ARG 45 60.035 34.576 34.091 313 HG2 ARG 45 HG2 ARG 45 61.704 34.927 32.427 314 HG3 ARG 45 HG3 ARG 45 61.546 36.469 32.596 315 HD2 ARG 45 HD2 ARG 45 62.288 36.294 34.865 316 HD3 ARG 45 HD3 ARG 45 62.452 34.754 34.690 317 HE ARG 45 HE ARG 45 63.972 36.346 33.070 318 HH11 ARG 45 HH11 ARG 45 66.166 36.093 32.968 319 HH12 ARG 45 HH12 ARG 45 66.858 35.185 33.925 320 HH21 ARG 45 HH21 ARG 45 64.322 34.168 35.570 321 HH22 ARG 45 HH22 ARG 45 65.802 34.081 35.418 322 H ASP 46 H ASP 46 58.209 32.954 32.527 323 HA ASP 46 HA ASP 46 59.408 32.071 30.271 324 HB2 ASP 46 HB2 ASP 46 59.552 30.006 31.207 325 HB3 ASP 46 HB3 ASP 46 60.032 30.998 32.310 326 H LEU 47 H LEU 47 56.489 33.100 30.801 327 HA LEU 47 HA LEU 47 54.547 32.938 30.070 328 HB2 LEU 47 HB2 LEU 47 55.847 31.963 27.742 329 HB3 LEU 47 HB3 LEU 47 54.379 32.488 27.736 330 HG LEU 47 HG LEU 47 56.587 34.150 28.317 331 HD11 LEU 47 HD11 LEU 47 56.258 35.030 26.101 332 HD12 LEU 47 HD12 LEU 47 56.581 33.481 26.018 333 HD13 LEU 47 HD13 LEU 47 55.086 33.987 25.879 334 HD21 LEU 47 HD21 LEU 47 55.139 35.983 28.057 335 HD22 LEU 47 HD22 LEU 47 53.928 34.990 27.820 336 HD23 LEU 47 HD23 LEU 47 54.637 35.052 29.235 337 H ALA 48 H ALA 48 55.429 30.381 31.457 338 HA ALA 48 HA ALA 48 53.843 28.454 30.581 339 HB1 ALA 48 HB1 ALA 48 54.492 27.401 32.597 340 HB2 ALA 48 HB2 ALA 48 55.768 27.977 31.857 341 HB3 ALA 48 HB3 ALA 48 55.148 28.757 33.088 342 H TYR 49 H TYR 49 53.194 31.047 32.681 343 HA TYR 49 HA TYR 49 50.594 30.435 33.012 344 HB2 TYR 49 HB2 TYR 49 52.323 31.070 35.192 345 HB3 TYR 49 HB3 TYR 49 50.776 30.976 35.356 346 HD1 TYR 49 HD1 TYR 49 49.660 28.742 35.175 347 HD2 TYR 49 HD2 TYR 49 53.692 29.074 35.347 348 HE1 TYR 49 HE1 TYR 49 49.824 26.456 35.593 349 HE2 TYR 49 HE2 TYR 49 53.862 26.770 35.702 350 HH TYR 49 HH TYR 49 52.754 24.824 35.947 351 H ALA 50 H ALA 50 49.140 32.206 33.308 352 HA ALA 50 HA ALA 50 50.011 34.730 33.673 353 HB1 ALA 50 HB1 ALA 50 48.626 35.566 31.968 354 HB2 ALA 50 HB2 ALA 50 49.728 34.607 31.359 355 HB3 ALA 50 HB3 ALA 50 48.246 34.086 31.555 356 H LYS 51 H LYS 51 48.672 36.070 34.935 357 HA LYS 51 HA LYS 51 46.358 35.155 36.035 358 HB2 LYS 51 HB2 LYS 51 47.981 37.268 37.006 359 HB3 LYS 51 HB3 LYS 51 46.692 36.758 37.721 360 HG2 LYS 51 HG2 LYS 51 47.771 34.639 38.075 361 HG3 LYS 51 HG3 LYS 51 49.073 35.224 37.447 362 HD2 LYS 51 HD2 LYS 51 49.221 36.793 39.256 363 HD3 LYS 51 HD3 LYS 51 47.948 36.158 39.895 364 HE2 LYS 51 HE2 LYS 51 49.025 34.172 40.331 365 HE3 LYS 51 HE3 LYS 51 50.187 34.502 39.345 366 HZ1 LYS 51 HZ1 LYS 51 50.884 34.768 41.486 367 HZ2 LYS 51 HZ2 LYS 51 50.934 36.065 40.833 368 HZ3 LYS 51 HZ3 LYS 51 49.852 35.758 41.753 369 H VAL 52 H VAL 52 44.358 36.210 35.570 370 HA VAL 52 HA VAL 52 44.308 38.460 34.048 371 HB VAL 52 HB VAL 52 42.358 36.451 33.991 372 HG11 VAL 52 HG11 VAL 52 41.403 37.613 32.123 373 HG12 VAL 52 HG12 VAL 52 41.387 38.527 33.417 374 HG13 VAL 52 HG13 VAL 52 42.489 38.751 32.301 375 HG21 VAL 52 HG21 VAL 52 43.080 35.910 31.792 376 HG22 VAL 52 HG22 VAL 52 44.260 36.956 31.941 377 HG23 VAL 52 HG23 VAL 52 44.236 35.655 32.843 378 H TYR 53 H TYR 53 43.286 40.258 34.981 379 HA TYR 53 HA TYR 53 41.824 40.083 37.259 380 HB2 TYR 53 HB2 TYR 53 43.245 42.312 36.262 381 HB3 TYR 53 HB3 TYR 53 42.469 42.305 37.615 382 HD1 TYR 53 HD1 TYR 53 43.318 40.551 39.385 383 HD2 TYR 53 HD2 TYR 53 45.584 41.839 36.299 384 HE1 TYR 53 HE1 TYR 53 45.225 39.788 40.485 385 HE2 TYR 53 HE2 TYR 53 47.512 41.157 37.429 386 HH TYR 53 HH TYR 53 48.380 40.250 39.335 387 H VAL 54 H VAL 54 39.649 40.647 37.310 388 HA VAL 54 HA VAL 54 38.430 41.551 35.058 389 HB VAL 54 HB VAL 54 37.486 39.387 36.570 390 HG11 VAL 54 HG11 VAL 54 35.959 38.973 34.764 391 HG12 VAL 54 HG12 VAL 54 35.728 40.417 35.372 392 HG13 VAL 54 HG13 VAL 54 36.533 40.247 34.019 393 HG21 VAL 54 HG21 VAL 54 38.082 37.915 34.759 394 HG22 VAL 54 HG22 VAL 54 38.749 39.141 34.013 395 HG23 VAL 54 HG23 VAL 54 39.372 38.603 35.367 396 H THR 55 H THR 55 36.560 42.887 35.402 397 HA THR 55 HA THR 55 35.703 43.485 37.910 398 HB THR 55 HB THR 55 37.087 45.159 37.463 399 HG1 THR 55 HG1 THR 55 35.159 45.868 38.292 400 HG21 THR 55 HG21 THR 55 36.928 46.626 35.639 401 HG22 THR 55 HG22 THR 55 37.283 45.157 35.162 402 HG23 THR 55 HG23 THR 55 35.804 45.703 35.013 403 H PHE 56 H PHE 56 33.455 43.674 38.158 404 HA PHE 56 HA PHE 56 31.939 42.793 36.080 405 HB2 PHE 56 HB2 PHE 56 31.807 42.084 38.841 406 HB3 PHE 56 HB3 PHE 56 30.740 41.590 37.816 407 HD1 PHE 56 HD1 PHE 56 34.213 41.175 38.576 408 HD2 PHE 56 HD2 PHE 56 31.047 39.514 36.680 409 HE1 PHE 56 HE1 PHE 56 35.444 39.227 38.239 410 HE2 PHE 56 HE2 PHE 56 32.274 37.557 36.370 411 HZ PHE 56 HZ PHE 56 34.470 37.404 37.150 412 H LEU 57 H LEU 57 29.808 43.651 35.673 413 HA LEU 57 HA LEU 57 28.626 45.424 37.310 414 HB2 LEU 57 HB2 LEU 57 28.208 45.506 34.997 415 HB3 LEU 57 HB3 LEU 57 27.637 44.056 35.029 416 HG LEU 57 HG LEU 57 25.812 44.797 36.295 417 HD11 LEU 57 HD11 LEU 57 25.370 47.087 36.578 418 HD12 LEU 57 HD12 LEU 57 26.692 46.674 37.347 419 HD13 LEU 57 HD13 LEU 57 26.787 47.429 35.958 420 HD21 LEU 57 HD21 LEU 57 24.717 45.987 34.537 421 HD22 LEU 57 HD22 LEU 57 26.127 46.253 33.864 422 HD23 LEU 57 HD23 LEU 57 25.553 44.780 33.944 423 H ASN 58 H ASN 58 28.748 42.057 37.331 424 HA ASN 58 HA ASN 58 26.667 41.486 38.931 425 HB2 ASN 58 HB2 ASN 58 27.670 40.005 37.281 426 HB3 ASN 58 HB3 ASN 58 28.883 39.852 38.248 427 HD21 ASN 58 HD21 ASN 58 25.512 38.115 39.219 428 HD22 ASN 58 HD22 ASN 58 25.472 39.447 38.556 429 H ASP 59 H ASP 59 29.297 43.098 39.738 430 HA ASP 59 HA ASP 59 30.108 42.504 42.101 431 HB2 ASP 59 HB2 ASP 59 31.197 44.043 40.636 432 HB3 ASP 59 HB3 ASP 59 29.980 45.014 40.733 433 H LYS 60 H LYS 60 27.003 43.557 41.535 434 HA LYS 60 HA LYS 60 26.363 44.738 43.788 435 HB2 LYS 60 HB2 LYS 60 25.099 44.593 41.644 436 HB3 LYS 60 HB3 LYS 60 24.571 43.226 42.178 437 HG2 LYS 60 HG2 LYS 60 23.543 44.407 44.019 438 HG3 LYS 60 HG3 LYS 60 23.975 45.749 43.352 439 HD2 LYS 60 HD2 LYS 60 22.670 45.106 41.393 440 HD3 LYS 60 HD3 LYS 60 22.133 43.892 42.210 441 HE2 LYS 60 HE2 LYS 60 21.168 45.395 43.789 442 HE3 LYS 60 HE3 LYS 60 21.681 46.600 42.941 443 HZ1 LYS 60 HZ1 LYS 60 19.505 46.157 42.428 444 HZ2 LYS 60 HZ2 LYS 60 20.303 45.920 41.238 445 HZ3 LYS 60 HZ3 LYS 60 19.826 44.797 42.027 446 H ASP 61 H ASP 61 27.015 41.468 43.438 447 HA ASP 61 HA ASP 61 26.480 40.918 46.029 448 HB2 ASP 61 HB2 ASP 61 24.648 40.043 44.798 449 HB3 ASP 61 HB3 ASP 61 25.631 39.228 43.903 450 H GLU 62 H GLU 62 28.394 40.467 46.972 451 HA GLU 62 HA GLU 62 30.609 39.782 45.978 452 HB2 GLU 62 HB2 GLU 62 29.826 39.167 48.647 453 HB3 GLU 62 HB3 GLU 62 31.310 39.281 48.182 454 HG2 GLU 62 HG2 GLU 62 31.134 41.232 49.191 455 HG3 GLU 62 HG3 GLU 62 30.711 41.681 47.759 456 H ASP 63 H ASP 63 28.194 37.567 47.070 457 HA ASP 63 HA ASP 63 29.510 35.257 46.899 458 HB2 ASP 63 HB2 ASP 63 27.730 35.520 48.401 459 HB3 ASP 63 HB3 ASP 63 26.755 35.857 47.230 460 H ALA 64 H ALA 64 27.510 36.870 44.613 461 HA ALA 64 HA ALA 64 27.478 35.041 42.714 462 HB1 ALA 64 HB1 ALA 64 26.558 36.767 41.387 463 HB2 ALA 64 HB2 ALA 64 25.812 36.696 42.782 464 HB3 ALA 64 HB3 ALA 64 26.901 37.816 42.524 465 H VAL 65 H VAL 65 29.704 37.725 43.149 466 HA VAL 65 HA VAL 65 31.129 37.386 40.992 467 HB VAL 65 HB VAL 65 31.870 38.644 43.388 468 HG11 VAL 65 HG11 VAL 65 33.686 39.677 42.244 469 HG12 VAL 65 HG12 VAL 65 33.873 38.105 42.272 470 HG13 VAL 65 HG13 VAL 65 33.348 38.817 40.959 471 HG21 VAL 65 HG21 VAL 65 31.493 40.685 42.182 472 HG22 VAL 65 HG22 VAL 65 31.077 39.835 40.912 473 HG23 VAL 65 HG23 VAL 65 30.171 39.814 42.211 474 H LYS 66 H LYS 66 31.666 35.976 44.131 475 HA LYS 66 HA LYS 66 33.848 34.587 43.779 476 HB2 LYS 66 HB2 LYS 66 32.742 34.980 45.888 477 HB3 LYS 66 HB3 LYS 66 31.686 33.904 45.489 478 HG2 LYS 66 HG2 LYS 66 33.121 32.808 46.867 479 HG3 LYS 66 HG3 LYS 66 33.472 32.280 45.443 480 HD2 LYS 66 HD2 LYS 66 35.359 33.635 45.332 481 HD3 LYS 66 HD3 LYS 66 34.958 34.378 46.642 482 HE2 LYS 66 HE2 LYS 66 36.646 32.916 47.223 483 HE3 LYS 66 HE3 LYS 66 35.342 32.355 47.871 484 HZ1 LYS 66 HZ1 LYS 66 36.490 30.688 46.860 485 HZ2 LYS 66 HZ2 LYS 66 35.217 30.836 46.175 486 HZ3 LYS 66 HZ3 LYS 66 36.431 31.358 45.571 487 H ALA 67 H ALA 67 30.627 33.459 43.201 488 HA ALA 67 HA ALA 67 31.140 31.128 42.119 489 HB1 ALA 67 HB1 ALA 67 28.821 31.205 41.555 490 HB2 ALA 67 HB2 ALA 67 29.019 31.648 43.064 491 HB3 ALA 67 HB3 ALA 67 28.785 32.741 41.942 492 H GLY 68 H GLY 68 30.878 34.176 40.525 493 HA2 GLY 68 HA2 GLY 68 30.827 33.501 38.013 494 HA3 GLY 68 HA3 GLY 68 31.266 34.894 38.558 495 H ILE 69 H ILE 69 33.668 34.451 39.851 496 HA ILE 69 HA ILE 69 35.538 33.934 38.122 497 HB ILE 69 HB ILE 69 35.667 34.124 40.910 498 HG12 ILE 69 HG12 ILE 69 35.283 36.185 39.844 499 HG13 ILE 69 HG13 ILE 69 36.612 36.221 40.659 500 HG21 ILE 69 HG21 ILE 69 38.039 34.176 40.821 501 HG22 ILE 69 HG22 ILE 69 37.479 32.771 40.348 502 HG23 ILE 69 HG23 ILE 69 37.969 33.830 39.277 503 HD11 ILE 69 HD11 ILE 69 36.933 37.289 38.596 504 HD12 ILE 69 HD12 ILE 69 37.859 36.005 38.657 505 HD13 ILE 69 HD13 ILE 69 36.510 35.969 37.829 506 H LYS 70 H LYS 70 34.190 31.732 40.479 507 HA LYS 70 HA LYS 70 35.665 29.606 40.080 508 HB2 LYS 70 HB2 LYS 70 34.293 29.928 41.989 509 HB3 LYS 70 HB3 LYS 70 33.020 29.787 41.097 510 HG2 LYS 70 HG2 LYS 70 33.565 27.518 40.666 511 HG3 LYS 70 HG3 LYS 70 34.846 27.655 41.545 512 HD2 LYS 70 HD2 LYS 70 32.232 27.962 42.622 513 HD3 LYS 70 HD3 LYS 70 33.017 26.617 42.717 514 HE2 LYS 70 HE2 LYS 70 34.694 27.711 44.024 515 HE3 LYS 70 HE3 LYS 70 33.861 29.029 43.964 516 HZ1 LYS 70 HZ1 LYS 70 33.463 27.944 45.909 517 HZ2 LYS 70 HZ2 LYS 70 32.222 27.985 45.153 518 HZ3 LYS 70 HZ3 LYS 70 32.997 26.758 45.210 519 H ALA 71 H ALA 71 32.738 30.396 38.408 520 HA ALA 71 HA ALA 71 32.577 28.300 36.827 521 HB1 ALA 71 HB1 ALA 71 30.872 29.589 35.767 522 HB2 ALA 71 HB2 ALA 71 30.674 29.624 37.337 523 HB3 ALA 71 HB3 ALA 71 31.332 30.859 36.595 524 H LEU 72 H LEU 72 34.079 31.341 36.267 525 HA LEU 72 HA LEU 72 34.805 31.130 33.735 526 HB2 LEU 72 HB2 LEU 72 34.553 33.211 34.851 527 HB3 LEU 72 HB3 LEU 72 35.720 32.842 35.819 528 HG LEU 72 HG LEU 72 37.235 32.938 34.022 529 HD11 LEU 72 HD11 LEU 72 36.574 33.849 31.957 530 HD12 LEU 72 HD12 LEU 72 35.805 32.492 32.229 531 HD13 LEU 72 HD13 LEU 72 35.071 33.877 32.456 532 HD21 LEU 72 HD21 LEU 72 37.208 35.322 33.793 533 HD22 LEU 72 HD22 LEU 72 35.723 35.344 34.342 534 HD23 LEU 72 HD23 LEU 72 36.914 34.923 35.297 535 H GLN 73 H GLN 73 36.602 30.327 36.591 536 HA GLN 73 HA GLN 73 38.861 29.577 35.490 537 HB2 GLN 73 HB2 GLN 73 38.587 30.176 37.812 538 HB3 GLN 73 HB3 GLN 73 37.848 28.821 38.040 539 HG2 GLN 73 HG2 GLN 73 40.080 28.627 38.736 540 HG3 GLN 73 HG3 GLN 73 39.808 27.626 37.571 541 HE21 GLN 73 HE21 GLN 73 41.521 27.583 36.109 542 HE22 GLN 73 HE22 GLN 73 42.329 28.760 35.684 543 H GLU 74 H GLU 74 36.080 27.627 36.170 544 HA GLU 74 HA GLU 74 36.879 25.269 35.365 545 HB2 GLU 74 HB2 GLU 74 34.862 25.844 36.615 546 HB3 GLU 74 HB3 GLU 74 34.238 26.322 35.268 547 HG2 GLU 74 HG2 GLU 74 34.296 24.112 34.441 548 HG3 GLU 74 HG3 GLU 74 34.963 23.623 35.763 549 H ALA 75 H ALA 75 35.822 27.823 33.369 550 HA ALA 75 HA ALA 75 35.936 26.494 31.039 551 HB1 ALA 75 HB1 ALA 75 35.098 28.572 30.182 552 HB2 ALA 75 HB2 ALA 75 34.193 28.080 31.385 553 HB3 ALA 75 HB3 ALA 75 35.271 29.217 31.617 554 H SER 76 H SER 76 38.461 27.622 32.668 555 HA SER 76 HA SER 76 39.687 29.309 31.195 556 HB2 SER 76 HB2 SER 76 41.629 28.788 32.509 557 HB3 SER 76 HB3 SER 76 40.379 28.989 33.420 558 HG SER 76 HG SER 76 40.325 26.948 33.814 559 H GLY 77 H GLY 77 39.962 25.893 30.756 560 HA2 GLY 77 HA2 GLY 77 41.996 25.751 29.137 561 HA3 GLY 77 HA3 GLY 77 40.902 24.653 29.306 562 H PHE 78 H PHE 78 38.600 26.017 28.256 563 HA PHE 78 HA PHE 78 38.811 26.087 25.673 564 HB2 PHE 78 HB2 PHE 78 36.821 27.461 27.147 565 HB3 PHE 78 HB3 PHE 78 36.698 27.079 25.639 566 HD1 PHE 78 HD1 PHE 78 35.190 26.321 28.365 567 HD2 PHE 78 HD2 PHE 78 37.198 24.279 25.498 568 HE1 PHE 78 HE1 PHE 78 34.018 24.388 28.925 569 HE2 PHE 78 HE2 PHE 78 36.029 22.340 26.078 570 HZ PHE 78 HZ PHE 78 34.440 22.395 27.792 571 H ILE 79 H ILE 79 38.953 28.760 27.911 572 HA ILE 79 HA ILE 79 39.094 30.769 26.246 573 HB ILE 79 HB ILE 79 39.853 30.723 28.973 574 HG12 ILE 79 HG12 ILE 79 37.372 31.707 27.981 575 HG13 ILE 79 HG13 ILE 79 37.500 30.236 28.483 576 HG21 ILE 79 HG21 ILE 79 39.685 33.097 28.915 577 HG22 ILE 79 HG22 ILE 79 40.804 32.612 27.903 578 HG23 ILE 79 HG23 ILE 79 39.376 33.033 27.363 579 HD11 ILE 79 HD11 ILE 79 36.578 31.562 30.178 580 HD12 ILE 79 HD12 ILE 79 37.981 31.010 30.662 581 HD13 ILE 79 HD13 ILE 79 37.850 32.503 30.151 582 H ARG 80 H ARG 80 41.774 29.064 27.698 583 HA ARG 80 HA ARG 80 43.786 30.274 26.576 584 HB2 ARG 80 HB2 ARG 80 44.225 28.863 28.362 585 HB3 ARG 80 HB3 ARG 80 43.516 27.659 27.668 586 HG2 ARG 80 HG2 ARG 80 45.262 27.444 26.135 587 HG3 ARG 80 HG3 ARG 80 45.933 28.749 26.661 588 HD2 ARG 80 HD2 ARG 80 46.976 26.682 27.359 589 HD3 ARG 80 HD3 ARG 80 46.759 27.741 28.484 590 HE ARG 80 HE ARG 80 45.603 26.268 29.523 591 HH11 ARG 80 HH11 ARG 80 44.385 24.568 30.024 592 HH12 ARG 80 HH12 ARG 80 43.833 23.685 28.959 593 HH21 ARG 80 HH21 ARG 80 45.020 25.205 26.416 594 HH22 ARG 80 HH22 ARG 80 44.199 24.050 26.872 595 H SER 81 H SER 81 42.123 27.479 25.314 596 HA SER 81 HA SER 81 43.616 27.041 23.210 597 HB2 SER 81 HB2 SER 81 41.983 25.498 24.259 598 HB3 SER 81 HB3 SER 81 40.892 26.236 23.424 599 HG SER 81 HG SER 81 41.669 24.498 22.332 600 H LEU 82 H LEU 82 40.724 28.903 23.373 601 HA LEU 82 HA LEU 82 40.522 29.689 20.879 602 HB2 LEU 82 HB2 LEU 82 39.335 30.728 23.250 603 HB3 LEU 82 HB3 LEU 82 38.921 31.231 21.833 604 HG LEU 82 HG LEU 82 38.522 28.547 22.674 605 HD11 LEU 82 HD11 LEU 82 36.224 29.150 22.883 606 HD12 LEU 82 HD12 LEU 82 37.102 30.043 23.854 607 HD13 LEU 82 HD13 LEU 82 36.589 30.637 22.479 608 HD21 LEU 82 HD21 LEU 82 37.186 28.247 20.793 609 HD22 LEU 82 HD22 LEU 82 37.518 29.721 20.319 610 HD23 LEU 82 HD23 LEU 82 38.662 28.628 20.365 611 H LEU 83 H LEU 83 42.071 31.323 23.517 612 HA LEU 83 HA LEU 83 42.762 33.587 22.385 613 HB2 LEU 83 HB2 LEU 83 42.781 33.202 24.724 614 HB3 LEU 83 HB3 LEU 83 43.986 32.227 24.548 615 HG LEU 83 HG LEU 83 45.325 34.062 23.836 616 HD11 LEU 83 HD11 LEU 83 44.545 36.254 24.167 617 HD12 LEU 83 HD12 LEU 83 43.646 35.514 23.092 618 HD13 LEU 83 HD13 LEU 83 43.125 35.685 24.579 619 HD21 LEU 83 HD21 LEU 83 45.586 34.987 26.020 620 HD22 LEU 83 HD22 LEU 83 44.184 34.380 26.435 621 HD23 LEU 83 HD23 LEU 83 45.403 33.418 26.122 622 H GLY 84 H GLY 84 44.641 30.645 22.453 623 HA2 GLY 84 HA2 GLY 84 46.702 31.335 21.052 624 HA3 GLY 84 HA3 GLY 84 46.193 29.871 21.224 625 H LYS 85 H LYS 85 43.699 30.053 19.850 626 HA LYS 85 HA LYS 85 44.221 29.850 17.290 627 HB2 LYS 85 HB2 LYS 85 42.489 28.583 18.289 628 HB3 LYS 85 HB3 LYS 85 41.703 29.885 18.627 629 HG2 LYS 85 HG2 LYS 85 41.155 30.253 16.433 630 HG3 LYS 85 HG3 LYS 85 42.244 29.261 15.921 631 HD2 LYS 85 HD2 LYS 85 40.169 28.259 15.641 632 HD3 LYS 85 HD3 LYS 85 40.971 27.432 16.693 633 HE2 LYS 85 HE2 LYS 85 38.826 27.581 17.495 634 HE3 LYS 85 HE3 LYS 85 39.697 28.475 18.430 635 HZ1 LYS 85 HZ1 LYS 85 37.817 29.585 17.818 636 HZ2 LYS 85 HZ2 LYS 85 38.959 30.304 17.278 637 HZ3 LYS 85 HZ3 LYS 85 38.148 29.471 16.408 638 H ALA 86 H ALA 86 42.707 32.483 18.927 639 HA ALA 86 HA ALA 86 42.157 34.017 16.886 640 HB1 ALA 86 HB1 ALA 86 41.760 35.651 18.571 641 HB2 ALA 86 HB2 ALA 86 41.075 34.281 18.974 642 HB3 ALA 86 HB3 ALA 86 42.449 34.703 19.636 643 H MET 87 H MET 87 45.116 33.760 18.575 644 HA MET 87 HA MET 87 46.275 35.878 17.351 645 HB2 MET 87 HB2 MET 87 47.055 34.489 19.723 646 HB3 MET 87 HB3 MET 87 47.919 35.645 19.134 647 HG2 MET 87 HG2 MET 87 46.086 37.142 19.483 648 HG3 MET 87 HG3 MET 87 45.297 35.979 20.160 649 HE1 MET 87 HE1 MET 87 45.973 38.391 22.975 650 HE2 MET 87 HE2 MET 87 45.727 38.752 21.453 651 HE3 MET 87 HE3 MET 87 44.841 37.644 22.158 652 H ARG 88 H ARG 88 46.281 32.737 16.581 653 HA ARG 88 HA ARG 88 47.601 31.229 15.827 654 HB2 ARG 88 HB2 ARG 88 48.491 33.398 14.262 655 HB3 ARG 88 HB3 ARG 88 48.873 31.920 13.941 656 HG2 ARG 88 HG2 ARG 88 46.552 31.416 13.580 657 HG3 ARG 88 HG3 ARG 88 46.195 32.908 13.861 658 HD2 ARG 88 HD2 ARG 88 47.466 33.591 11.979 659 HD3 ARG 88 HD3 ARG 88 47.899 32.117 11.717 660 HE ARG 88 HE ARG 88 45.433 33.130 11.127 661 HH11 ARG 88 HH11 ARG 88 44.215 32.092 9.523 662 HH12 ARG 88 HH12 ARG 88 44.541 30.687 9.150 663 HH21 ARG 88 HH21 ARG 88 47.082 30.276 11.038 664 HH22 ARG 88 HH22 ARG 88 46.191 29.646 10.026 665 H LEU 89 H LEU 89 48.497 31.640 18.296 666 HA LEU 89 HA LEU 89 50.997 32.638 18.504 667 HB2 LEU 89 HB2 LEU 89 49.081 33.209 19.946 668 HB3 LEU 89 HB3 LEU 89 49.319 31.827 20.627 669 HG LEU 89 HG LEU 89 51.482 32.566 21.274 670 HD11 LEU 89 HD11 LEU 89 51.976 34.880 21.204 671 HD12 LEU 89 HD12 LEU 89 51.811 34.314 19.734 672 HD13 LEU 89 HD13 LEU 89 50.634 35.135 20.403 673 HD21 LEU 89 HD21 LEU 89 50.689 33.976 23.042 674 HD22 LEU 89 HD22 LEU 89 49.337 34.187 22.246 675 HD23 LEU 89 HD23 LEU 89 49.694 32.761 22.835 676 H ARG 90 H ARG 90 52.912 31.455 19.167 677 HA ARG 90 HA ARG 90 52.963 28.898 18.553 678 HB2 ARG 90 HB2 ARG 90 54.995 30.638 19.404 679 HB3 ARG 90 HB3 ARG 90 55.301 29.109 19.439 680 HG2 ARG 90 HG2 ARG 90 56.116 29.855 17.432 681 HG3 ARG 90 HG3 ARG 90 54.854 29.008 17.085 682 HD2 ARG 90 HD2 ARG 90 53.598 30.967 16.732 683 HD3 ARG 90 HD3 ARG 90 54.808 31.848 17.169 684 HE ARG 90 HE ARG 90 54.489 30.801 14.732 685 HH11 ARG 90 HH11 ARG 90 55.983 31.041 13.091 686 HH12 ARG 90 HH12 ARG 90 57.346 31.561 13.391 687 HH21 ARG 90 HH21 ARG 90 57.027 31.919 16.565 688 HH22 ARG 90 HH22 ARG 90 57.951 32.070 15.406 689 H ILE 91 H ILE 91 53.426 30.266 21.741 690 HA ILE 91 HA ILE 91 52.005 28.242 22.785 691 HB ILE 91 HB ILE 91 53.181 28.365 24.803 692 HG12 ILE 91 HG12 ILE 91 55.597 28.955 24.479 693 HG13 ILE 91 HG13 ILE 91 54.986 29.999 23.495 694 HG21 ILE 91 HG21 ILE 91 54.920 26.869 24.023 695 HG22 ILE 91 HG22 ILE 91 53.537 26.533 23.327 696 HG23 ILE 91 HG23 ILE 91 54.636 27.364 22.545 697 HD11 ILE 91 HD11 ILE 91 55.308 30.998 25.589 698 HD12 ILE 91 HD12 ILE 91 53.759 30.971 25.266 699 HD13 ILE 91 HD13 ILE 91 54.377 29.910 26.266 700 H VAL 92 H VAL 92 50.331 28.824 24.190 701 HA VAL 92 HA VAL 92 49.962 31.372 25.093 702 HB VAL 92 HB VAL 92 48.308 30.783 23.727 703 HG11 VAL 92 HG11 VAL 92 46.811 29.002 24.116 704 HG12 VAL 92 HG12 VAL 92 48.274 28.480 23.808 705 HG13 VAL 92 HG13 VAL 92 47.741 28.507 25.299 706 HG21 VAL 92 HG21 VAL 92 46.411 31.161 25.116 707 HG22 VAL 92 HG22 VAL 92 47.316 30.880 26.386 708 HG23 VAL 92 HG23 VAL 92 47.598 32.147 25.478 709 HA PRO 93 HA PRO 93 50.813 29.992 29.122 710 HB2 PRO 93 HB2 PRO 93 49.575 32.287 30.164 711 HB3 PRO 93 HB3 PRO 93 51.045 31.832 30.423 712 HG2 PRO 93 HG2 PRO 93 50.646 33.825 28.849 713 HG3 PRO 93 HG3 PRO 93 51.825 32.858 28.529 714 HD2 PRO 93 HD2 PRO 93 49.257 32.842 27.308 715 HD3 PRO 93 HD3 PRO 93 50.621 32.618 26.587 716 H GLU 94 H GLU 94 49.804 28.849 30.879 717 HA GLU 94 HA GLU 94 47.197 28.251 30.775 718 HB2 GLU 94 HB2 GLU 94 48.877 26.745 31.561 719 HB3 GLU 94 HB3 GLU 94 48.987 27.616 32.850 720 HG2 GLU 94 HG2 GLU 94 47.630 25.826 33.371 721 HG3 GLU 94 HG3 GLU 94 46.719 27.093 33.373 722 H LEU 95 H LEU 95 45.424 29.085 32.025 723 HA LEU 95 HA LEU 95 45.865 31.644 32.773 724 HB2 LEU 95 HB2 LEU 95 43.488 30.625 31.585 725 HB3 LEU 95 HB3 LEU 95 43.698 32.129 31.940 726 HG LEU 95 HG LEU 95 45.119 30.757 29.938 727 HD11 LEU 95 HD11 LEU 95 43.911 32.163 28.402 728 HD12 LEU 95 HD12 LEU 95 42.899 31.294 29.254 729 HD13 LEU 95 HD13 LEU 95 43.148 32.813 29.629 730 HD21 LEU 95 HD21 LEU 95 46.072 32.812 29.271 731 HD22 LEU 95 HD22 LEU 95 45.374 33.524 30.501 732 HD23 LEU 95 HD23 LEU 95 46.511 32.449 30.748 733 H THR 96 H THR 96 45.220 32.489 34.724 734 HA THR 96 HA THR 96 43.518 31.168 36.372 735 HB THR 96 HB THR 96 45.738 32.569 37.371 736 HG1 THR 96 HG1 THR 96 46.630 30.553 37.715 737 HG21 THR 96 HG21 THR 96 45.310 31.442 39.410 738 HG22 THR 96 HG22 THR 96 44.048 32.293 38.973 739 HG23 THR 96 HG23 THR 96 44.066 30.727 38.739 740 H PHE 97 H PHE 97 41.813 32.513 37.284 741 HA PHE 97 HA PHE 97 41.719 35.106 36.482 742 HB2 PHE 97 HB2 PHE 97 39.576 33.248 36.662 743 HB3 PHE 97 HB3 PHE 97 39.331 34.758 36.362 744 HD1 PHE 97 HD1 PHE 97 39.819 35.674 34.134 745 HD2 PHE 97 HD2 PHE 97 40.510 31.761 34.901 746 HE1 PHE 97 HE1 PHE 97 40.184 35.297 31.863 747 HE2 PHE 97 HE2 PHE 97 40.874 31.387 32.630 748 HZ PHE 97 HZ PHE 97 40.735 33.149 31.112 749 H PHE 98 H PHE 98 40.932 36.789 37.771 750 HA PHE 98 HA PHE 98 40.499 36.448 40.411 751 HB2 PHE 98 HB2 PHE 98 42.464 38.238 39.372 752 HB3 PHE 98 HB3 PHE 98 42.104 38.154 40.887 753 HD1 PHE 98 HD1 PHE 98 43.156 36.484 42.316 754 HD2 PHE 98 HD2 PHE 98 43.805 36.401 38.320 755 HE1 PHE 98 HE1 PHE 98 44.856 34.917 42.625 756 HE2 PHE 98 HE2 PHE 98 45.429 34.753 38.625 757 HZ PHE 98 HZ PHE 98 45.975 34.028 40.774 758 H TYR 99 H TYR 99 39.121 38.125 41.407 759 HA TYR 99 HA TYR 99 37.974 39.929 39.789 760 HB2 TYR 99 HB2 TYR 99 36.372 40.302 41.298 761 HB3 TYR 99 HB3 TYR 99 36.526 38.757 41.143 762 HD1 TYR 99 HD1 TYR 99 37.333 41.402 43.403 763 HD2 TYR 99 HD2 TYR 99 36.822 37.392 43.099 764 HE1 TYR 99 HE1 TYR 99 37.426 41.210 45.727 765 HE2 TYR 99 HE2 TYR 99 36.852 37.222 45.432 766 HH TYR 99 HH TYR 99 36.987 38.320 47.408 767 H ASP 100 H ASP 100 38.310 42.169 39.800 768 HA ASP 100 HA ASP 100 39.957 43.437 41.580 769 HB2 ASP 100 HB2 ASP 100 41.176 42.938 39.628 770 HB3 ASP 100 HB3 ASP 100 40.063 43.587 38.749 Start of MODEL 2 1 HA PRO 8 HA PRO 8 55.969 42.119 25.918 2 HB2 PRO 8 HB2 PRO 8 55.187 41.967 28.664 3 HB3 PRO 8 HB3 PRO 8 55.361 40.750 27.704 4 HG2 PRO 8 HG2 PRO 8 57.220 41.138 29.403 5 HG3 PRO 8 HG3 PRO 8 57.665 40.727 27.966 6 HD2 PRO 8 HD2 PRO 8 57.549 43.385 28.988 7 HD3 PRO 8 HD3 PRO 8 58.743 42.759 28.204 8 H GLN 9 H GLN 9 55.447 45.163 26.480 9 HA GLN 9 HA GLN 9 53.034 45.304 27.499 10 HB2 GLN 9 HB2 GLN 9 53.327 47.444 27.669 11 HB3 GLN 9 HB3 GLN 9 54.821 47.021 27.528 12 HG2 GLN 9 HG2 GLN 9 53.325 48.091 25.377 13 HG3 GLN 9 HG3 GLN 9 54.272 48.957 26.263 14 HE21 GLN 9 HE21 GLN 9 55.418 49.562 24.241 15 HE22 GLN 9 HE22 GLN 9 56.395 48.630 23.612 16 H ARG 10 H ARG 10 53.834 45.368 24.136 17 HA ARG 10 HA ARG 10 51.457 45.841 23.163 18 HB2 ARG 10 HB2 ARG 10 53.704 44.625 21.933 19 HB3 ARG 10 HB3 ARG 10 52.382 44.831 21.133 20 HG2 ARG 10 HG2 ARG 10 52.569 47.203 21.503 21 HG3 ARG 10 HG3 ARG 10 53.939 46.960 22.210 22 HD2 ARG 10 HD2 ARG 10 53.532 46.273 19.486 23 HD3 ARG 10 HD3 ARG 10 54.137 47.649 19.899 24 HE ARG 10 HE ARG 10 55.860 46.262 20.924 25 HH11 ARG 10 HH11 ARG 10 57.565 45.137 20.333 26 HH12 ARG 10 HH12 ARG 10 57.638 44.456 19.010 27 HH21 ARG 10 HH21 ARG 10 54.645 45.256 17.993 28 HH22 ARG 10 HH22 ARG 10 55.888 44.533 17.605 29 H VAL 11 H VAL 11 52.873 42.733 23.850 30 HA VAL 11 HA VAL 11 50.893 41.178 23.145 31 HB VAL 11 HB VAL 11 52.942 40.636 24.962 32 HG11 VAL 11 HG11 VAL 11 52.465 38.313 24.715 33 HG12 VAL 11 HG12 VAL 11 51.234 39.069 25.361 34 HG13 VAL 11 HG13 VAL 11 51.208 38.683 23.826 35 HG21 VAL 11 HG21 VAL 11 53.940 39.392 23.152 36 HG22 VAL 11 HG22 VAL 11 52.734 39.823 22.220 37 HG23 VAL 11 HG23 VAL 11 53.761 40.910 22.742 38 H ALA 12 H ALA 12 51.420 42.670 26.253 39 HA ALA 12 HA ALA 12 49.453 41.608 27.589 40 HB1 ALA 12 HB1 ALA 12 49.881 43.372 29.137 41 HB2 ALA 12 HB2 ALA 12 51.245 42.705 28.684 42 HB3 ALA 12 HB3 ALA 12 50.791 44.086 28.054 43 H GLN 13 H GLN 13 49.265 44.477 25.626 44 HA GLN 13 HA GLN 13 46.762 45.114 26.172 45 HB2 GLN 13 HB2 GLN 13 48.485 45.984 24.088 46 HB3 GLN 13 HB3 GLN 13 47.032 46.538 24.209 47 HG2 GLN 13 HG2 GLN 13 48.844 46.856 26.346 48 HG3 GLN 13 HG3 GLN 13 48.812 47.902 25.190 49 HE21 GLN 13 HE21 GLN 13 46.870 46.750 27.769 50 HE22 GLN 13 HE22 GLN 13 45.981 47.940 27.885 51 H GLU 14 H GLU 14 48.061 43.375 23.445 52 HA GLU 14 HA GLU 14 45.868 42.900 22.110 53 HB2 GLU 14 HB2 GLU 14 48.356 41.551 22.017 54 HB3 GLU 14 HB3 GLU 14 47.208 41.231 21.010 55 HG2 GLU 14 HG2 GLU 14 48.066 43.906 21.075 56 HG3 GLU 14 HG3 GLU 14 49.044 42.895 20.400 57 H MET 15 H MET 15 47.276 40.935 24.629 58 HA MET 15 HA MET 15 45.528 39.003 24.585 59 HB2 MET 15 HB2 MET 15 47.493 39.617 26.526 60 HB3 MET 15 HB3 MET 15 46.464 38.482 26.818 61 HG2 MET 15 HG2 MET 15 47.199 37.430 24.747 62 HG3 MET 15 HG3 MET 15 48.358 38.474 24.705 63 HE1 MET 15 HE1 MET 15 50.097 35.164 25.396 64 HE2 MET 15 HE2 MET 15 48.787 35.377 24.531 65 HE3 MET 15 HE3 MET 15 50.006 36.377 24.382 66 H GLN 16 H GLN 16 45.517 41.866 26.671 67 HA GLN 16 HA GLN 16 43.322 41.423 28.005 68 HB2 GLN 16 HB2 GLN 16 44.789 43.215 28.514 69 HB3 GLN 16 HB3 GLN 16 44.375 43.936 27.195 70 HG2 GLN 16 HG2 GLN 16 42.141 44.164 28.071 71 HG3 GLN 16 HG3 GLN 16 42.635 43.543 29.414 72 HE21 GLN 16 HE21 GLN 16 43.303 46.276 27.426 73 HE22 GLN 16 HE22 GLN 16 43.724 47.210 28.507 74 H LYS 17 H LYS 17 43.526 42.795 24.825 75 HA LYS 17 HA LYS 17 41.014 43.341 24.328 76 HB2 LYS 17 HB2 LYS 17 43.115 44.063 23.143 77 HB3 LYS 17 HB3 LYS 17 42.928 42.760 22.306 78 HG2 LYS 17 HG2 LYS 17 41.941 44.236 20.950 79 HG3 LYS 17 HG3 LYS 17 40.694 43.715 21.729 80 HD2 LYS 17 HD2 LYS 17 40.661 45.609 23.090 81 HD3 LYS 17 HD3 LYS 17 42.047 46.079 22.551 82 HE2 LYS 17 HE2 LYS 17 41.076 46.421 20.392 83 HE3 LYS 17 HE3 LYS 17 39.690 45.984 20.956 84 HZ1 LYS 17 HZ1 LYS 17 39.836 48.249 20.911 85 HZ2 LYS 17 HZ2 LYS 17 39.713 47.835 22.298 86 HZ3 LYS 17 HZ3 LYS 17 41.005 48.242 21.773 87 H GLU 18 H GLU 18 42.720 40.427 23.500 88 HA GLU 18 HA GLU 18 40.713 39.234 22.264 89 HB2 GLU 18 HB2 GLU 18 43.221 38.831 22.078 90 HB3 GLU 18 HB3 GLU 18 42.946 37.764 23.181 91 HG2 GLU 18 HG2 GLU 18 42.871 36.680 21.131 92 HG3 GLU 18 HG3 GLU 18 41.428 36.658 21.722 93 H ILE 19 H ILE 19 41.884 38.822 25.482 94 HA ILE 19 HA ILE 19 40.324 36.848 26.288 95 HB ILE 19 HB ILE 19 41.860 38.594 27.834 96 HG12 ILE 19 HG12 ILE 19 42.404 35.858 27.215 97 HG13 ILE 19 HG13 ILE 19 43.058 37.024 26.411 98 HG21 ILE 19 HG21 ILE 19 41.518 37.152 29.662 99 HG22 ILE 19 HG22 ILE 19 40.143 37.786 29.195 100 HG23 ILE 19 HG23 ILE 19 40.505 36.297 28.793 101 HD11 ILE 19 HD11 ILE 19 44.591 36.212 27.992 102 HD12 ILE 19 HD12 ILE 19 44.235 37.714 28.345 103 HD13 ILE 19 HD13 ILE 19 43.572 36.531 29.162 104 H ALA 20 H ALA 20 39.796 40.312 26.479 105 HA ALA 20 HA ALA 20 37.527 40.400 27.706 106 HB1 ALA 20 HB1 ALA 20 37.300 42.513 26.631 107 HB2 ALA 20 HB2 ALA 20 38.773 42.347 27.189 108 HB3 ALA 20 HB3 ALA 20 38.482 42.128 25.649 109 H LEU 21 H LEU 21 37.874 39.802 24.278 110 HA LEU 21 HA LEU 21 35.296 39.629 23.688 111 HB2 LEU 21 HB2 LEU 21 36.891 40.112 22.036 112 HB3 LEU 21 HB3 LEU 21 37.576 38.729 22.260 113 HG LEU 21 HG LEU 21 35.696 37.636 21.358 114 HD11 LEU 21 HD11 LEU 21 33.973 38.820 20.302 115 HD12 LEU 21 HD12 LEU 21 34.000 39.144 21.852 116 HD13 LEU 21 HD13 LEU 21 34.599 40.180 20.816 117 HD21 LEU 21 HD21 LEU 21 36.027 38.327 19.094 118 HD22 LEU 21 HD22 LEU 21 36.725 39.650 19.617 119 HD23 LEU 21 HD23 LEU 21 37.419 38.245 19.845 120 H ILE 22 H ILE 22 37.507 37.036 24.414 121 HA ILE 22 HA ILE 22 35.798 35.037 24.030 122 HB ILE 22 HB ILE 22 38.310 34.970 25.289 123 HG12 ILE 22 HG12 ILE 22 37.869 34.117 22.619 124 HG13 ILE 22 HG13 ILE 22 38.320 35.581 22.916 125 HG21 ILE 22 HG21 ILE 22 38.218 32.601 24.915 126 HG22 ILE 22 HG22 ILE 22 37.014 33.048 25.842 127 HG23 ILE 22 HG23 ILE 22 36.767 32.768 24.303 128 HD11 ILE 22 HD11 ILE 22 40.193 34.288 22.339 129 HD12 ILE 22 HD12 ILE 22 40.348 34.782 23.836 130 HD13 ILE 22 HD13 ILE 22 39.890 33.296 23.535 131 H LEU 23 H LEU 23 36.648 36.643 26.976 132 HA LEU 23 HA LEU 23 35.221 35.274 28.704 133 HB2 LEU 23 HB2 LEU 23 37.101 36.661 29.264 134 HB3 LEU 23 HB3 LEU 23 36.209 37.914 29.007 135 HG LEU 23 HG LEU 23 35.254 36.160 30.929 136 HD11 LEU 23 HD11 LEU 23 36.694 37.062 32.631 137 HD12 LEU 23 HD12 LEU 23 37.556 36.311 31.536 138 HD13 LEU 23 HD13 LEU 23 37.458 37.891 31.519 139 HD21 LEU 23 HD21 LEU 23 34.602 38.134 32.078 140 HD22 LEU 23 HD22 LEU 23 35.343 39.004 30.981 141 HD23 LEU 23 HD23 LEU 23 34.060 38.162 30.591 142 H GLN 24 H GLN 24 34.107 37.813 26.702 143 HA GLN 24 HA GLN 24 31.670 37.979 27.765 144 HB2 GLN 24 HB2 GLN 24 32.744 39.824 26.605 145 HB3 GLN 24 HB3 GLN 24 32.587 39.034 25.270 146 HG2 GLN 24 HG2 GLN 24 30.229 39.184 25.436 147 HG3 GLN 24 HG3 GLN 24 30.361 39.928 26.801 148 HE21 GLN 24 HE21 GLN 24 31.552 42.113 26.650 149 HE22 GLN 24 HE22 GLN 24 31.287 42.954 25.450 150 H ARG 25 H ARG 25 32.868 35.998 25.238 151 HA ARG 25 HA ARG 25 30.428 35.334 24.304 152 HB2 ARG 25 HB2 ARG 25 32.992 35.158 23.045 153 HB3 ARG 25 HB3 ARG 25 31.741 34.523 22.364 154 HG2 ARG 25 HG2 ARG 25 31.830 37.299 22.929 155 HG3 ARG 25 HG3 ARG 25 32.347 36.748 21.565 156 HD2 ARG 25 HD2 ARG 25 29.634 36.422 22.383 157 HD3 ARG 25 HD3 ARG 25 30.079 37.593 21.454 158 HE ARG 25 HE ARG 25 30.835 35.411 20.251 159 HH11 ARG 25 HH11 ARG 25 29.849 34.529 18.500 160 HH12 ARG 25 HH12 ARG 25 28.378 34.666 18.312 161 HH21 ARG 25 HH21 ARG 25 27.771 36.496 20.893 162 HH22 ARG 25 HH22 ARG 25 27.158 35.818 19.716 163 H GLU 26 H GLU 26 33.021 33.501 25.596 164 HA GLU 26 HA GLU 26 31.971 31.096 25.025 165 HB2 GLU 26 HB2 GLU 26 34.320 31.420 24.989 166 HB3 GLU 26 HB3 GLU 26 34.305 31.736 26.516 167 HG2 GLU 26 HG2 GLU 26 35.102 29.562 26.096 168 HG3 GLU 26 HG3 GLU 26 33.865 29.539 27.044 169 H ILE 27 H ILE 27 31.898 32.980 27.878 170 HA ILE 27 HA ILE 27 29.743 31.596 28.791 171 HB ILE 27 HB ILE 27 30.391 32.296 31.000 172 HG12 ILE 27 HG12 ILE 27 33.051 32.155 30.085 173 HG13 ILE 27 HG13 ILE 27 32.340 33.526 30.295 174 HG21 ILE 27 HG21 ILE 27 31.489 30.186 31.342 175 HG22 ILE 27 HG22 ILE 27 30.236 30.004 30.391 176 HG23 ILE 27 HG23 ILE 27 31.695 30.058 29.777 177 HD11 ILE 27 HD11 ILE 27 33.616 33.011 32.200 178 HD12 ILE 27 HD12 ILE 27 32.085 33.055 32.602 179 HD13 ILE 27 HD13 ILE 27 32.808 31.662 32.388 180 H LYS 28 H LYS 28 27.887 33.108 29.019 181 HA LYS 28 HA LYS 28 28.361 35.366 27.601 182 HB2 LYS 28 HB2 LYS 28 25.868 34.159 28.079 183 HB3 LYS 28 HB3 LYS 28 26.112 35.335 27.083 184 HG2 LYS 28 HG2 LYS 28 27.477 33.904 25.740 185 HG3 LYS 28 HG3 LYS 28 27.210 32.729 26.729 186 HD2 LYS 28 HD2 LYS 28 24.867 32.837 26.132 187 HD3 LYS 28 HD3 LYS 28 25.233 33.897 25.048 188 HE2 LYS 28 HE2 LYS 28 26.611 32.294 23.941 189 HE3 LYS 28 HE3 LYS 28 26.258 31.234 25.028 190 HZ1 LYS 28 HZ1 LYS 28 24.971 30.923 23.190 191 HZ2 LYS 28 HZ2 LYS 28 24.097 31.280 24.295 192 HZ3 LYS 28 HZ3 LYS 28 24.427 32.267 23.281 193 H ASP 29 H ASP 29 28.287 37.484 28.252 194 HA ASP 29 HA ASP 29 28.311 38.109 30.824 195 HB2 ASP 29 HB2 ASP 29 29.722 39.132 29.159 196 HB3 ASP 29 HB3 ASP 29 28.471 39.874 28.597 197 HA PRO 30 HA PRO 30 24.132 40.139 30.179 198 HB2 PRO 30 HB2 PRO 30 22.839 37.973 28.844 199 HB3 PRO 30 HB3 PRO 30 22.438 39.477 28.750 200 HG2 PRO 30 HG2 PRO 30 23.821 38.575 26.814 201 HG3 PRO 30 HG3 PRO 30 24.231 39.982 27.344 202 HD2 PRO 30 HD2 PRO 30 25.487 37.511 27.981 203 HD3 PRO 30 HD3 PRO 30 26.210 38.860 27.681 204 H ARG 31 H ARG 31 24.465 36.824 31.127 205 HA ARG 31 HA ARG 31 22.747 36.839 33.120 206 HB2 ARG 31 HB2 ARG 31 23.731 34.854 32.079 207 HB3 ARG 31 HB3 ARG 31 24.993 35.114 32.957 208 HG2 ARG 31 HG2 ARG 31 23.804 34.723 34.919 209 HG3 ARG 31 HG3 ARG 31 22.445 34.715 34.152 210 HD2 ARG 31 HD2 ARG 31 22.904 32.514 34.592 211 HD3 ARG 31 HD3 ARG 31 23.140 32.682 33.060 212 HE ARG 31 HE ARG 31 25.453 32.836 33.598 213 HH11 ARG 31 HH11 ARG 31 27.132 31.913 34.655 214 HH12 ARG 31 HH12 ARG 31 26.896 30.774 35.585 215 HH21 ARG 31 HH21 ARG 31 23.658 30.756 35.415 216 HH22 ARG 31 HH22 ARG 31 24.833 30.085 36.039 217 H LEU 32 H LEU 32 25.913 38.053 33.121 218 HA LEU 32 HA LEU 32 25.976 38.724 35.726 219 HB2 LEU 32 HB2 LEU 32 27.973 39.039 33.710 220 HB3 LEU 32 HB3 LEU 32 28.223 39.390 35.208 221 HG LEU 32 HG LEU 32 27.746 36.745 34.325 222 HD11 LEU 32 HD11 LEU 32 30.105 36.406 34.632 223 HD12 LEU 32 HD12 LEU 32 29.863 37.531 33.545 224 HD13 LEU 32 HD13 LEU 32 30.259 37.933 35.025 225 HD21 LEU 32 HD21 LEU 32 28.496 36.029 36.437 226 HD22 LEU 32 HD22 LEU 32 28.665 37.539 36.885 227 HD23 LEU 32 HD23 LEU 32 27.222 36.955 36.594 228 H GLY 33 H GLY 33 24.422 40.205 33.399 229 HA2 GLY 33 HA2 GLY 33 23.412 42.126 33.466 230 HA3 GLY 33 HA3 GLY 33 24.505 42.677 34.431 231 H MET 34 H MET 34 25.772 41.342 31.590 232 HA MET 34 HA MET 34 26.904 42.057 29.948 233 HB2 MET 34 HB2 MET 34 24.633 42.361 29.220 234 HB3 MET 34 HB3 MET 34 24.832 43.885 29.482 235 HG2 MET 34 HG2 MET 34 25.146 43.415 27.210 236 HG3 MET 34 HG3 MET 34 26.450 44.018 27.816 237 HE1 MET 34 HE1 MET 34 27.750 41.798 25.064 238 HE2 MET 34 HE2 MET 34 26.409 42.641 25.056 239 HE3 MET 34 HE3 MET 34 27.741 43.278 25.628 240 H MET 35 H MET 35 28.037 43.057 32.243 241 HA MET 35 HA MET 35 29.474 45.202 31.509 242 HB2 MET 35 HB2 MET 35 27.455 46.109 32.477 243 HB3 MET 35 HB3 MET 35 27.934 45.526 33.842 244 HG2 MET 35 HG2 MET 35 28.529 47.776 33.749 245 HG3 MET 35 HG3 MET 35 29.831 46.918 33.804 246 HE1 MET 35 HE1 MET 35 28.332 49.197 30.311 247 HE2 MET 35 HE2 MET 35 27.519 47.990 30.935 248 HE3 MET 35 HE3 MET 35 27.768 49.301 31.787 249 H THR 36 H THR 36 30.401 42.657 31.819 250 HA THR 36 HA THR 36 32.064 42.666 33.976 251 HB THR 36 HB THR 36 31.731 40.510 32.235 252 HG1 THR 36 HG1 THR 36 29.891 40.324 33.152 253 HG21 THR 36 HG21 THR 36 32.589 39.179 33.994 254 HG22 THR 36 HG22 THR 36 33.637 40.291 33.581 255 HG23 THR 36 HG23 THR 36 32.755 40.480 34.882 256 H THR 37 H THR 37 34.238 43.340 33.638 257 HA THR 37 HA THR 37 35.199 43.678 31.105 258 HB THR 37 HB THR 37 35.324 45.656 33.070 259 HG1 THR 37 HG1 THR 37 33.866 46.746 31.743 260 HG21 THR 37 HG21 THR 37 36.074 47.161 31.375 261 HG22 THR 37 HG22 THR 37 37.089 45.958 31.549 262 HG23 THR 37 HG23 THR 37 36.068 45.964 30.338 263 H VAL 38 H VAL 38 37.535 43.434 30.813 264 HA VAL 38 HA VAL 38 38.905 42.257 32.814 265 HB VAL 38 HB VAL 38 39.703 42.536 30.142 266 HG11 VAL 38 HG11 VAL 38 41.421 40.948 30.609 267 HG12 VAL 38 HG12 VAL 38 41.614 42.247 31.494 268 HG13 VAL 38 HG13 VAL 38 40.981 40.943 32.130 269 HG21 VAL 38 HG21 VAL 38 39.223 40.196 29.923 270 HG22 VAL 38 HG22 VAL 38 38.711 40.178 31.420 271 HG23 VAL 38 HG23 VAL 38 37.912 40.989 30.319 272 H SER 39 H SER 39 40.131 43.510 34.216 273 HA SER 39 HA SER 39 40.825 46.019 33.661 274 HB2 SER 39 HB2 SER 39 41.122 44.708 36.192 275 HB3 SER 39 HB3 SER 39 41.191 46.254 35.998 276 HG SER 39 HG SER 39 39.209 45.641 36.706 277 H GLY 40 H GLY 40 42.629 43.172 33.663 278 HA2 GLY 40 HA2 GLY 40 44.745 44.171 32.591 279 HA3 GLY 40 HA3 GLY 40 45.053 44.096 34.118 280 H VAL 41 H VAL 41 46.632 42.686 32.400 281 HA VAL 41 HA VAL 41 46.360 40.114 33.154 282 HB VAL 41 HB VAL 41 47.267 39.336 31.215 283 HG11 VAL 41 HG11 VAL 41 45.377 39.668 29.751 284 HG12 VAL 41 HG12 VAL 41 44.898 39.392 31.234 285 HG13 VAL 41 HG13 VAL 41 44.913 40.872 30.669 286 HG21 VAL 41 HG21 VAL 41 47.483 40.666 29.250 287 HG22 VAL 41 HG22 VAL 41 47.143 41.953 30.111 288 HG23 VAL 41 HG23 VAL 41 48.481 41.149 30.382 289 H GLU 42 H GLU 42 48.282 39.059 33.944 290 HA GLU 42 HA GLU 42 50.659 40.369 33.968 291 HB2 GLU 42 HB2 GLU 42 49.439 40.672 36.054 292 HB3 GLU 42 HB3 GLU 42 49.654 39.150 36.314 293 HG2 GLU 42 HG2 GLU 42 51.991 39.454 36.414 294 HG3 GLU 42 HG3 GLU 42 51.841 40.956 36.023 295 H MET 43 H MET 43 52.357 39.122 33.189 296 HA MET 43 HA MET 43 51.874 36.502 32.705 297 HB2 MET 43 HB2 MET 43 53.267 38.326 31.011 298 HB3 MET 43 HB3 MET 43 53.059 36.824 30.650 299 HG2 MET 43 HG2 MET 43 50.725 37.184 30.505 300 HG3 MET 43 HG3 MET 43 50.936 38.687 30.858 301 HE1 MET 43 HE1 MET 43 52.575 40.215 27.826 302 HE2 MET 43 HE2 MET 43 51.900 40.538 29.223 303 HE3 MET 43 HE3 MET 43 53.267 39.739 29.169 304 H SER 44 H SER 44 53.573 34.895 32.938 305 HA SER 44 HA SER 44 55.565 35.403 34.562 306 HB2 SER 44 HB2 SER 44 54.580 33.229 34.493 307 HB3 SER 44 HB3 SER 44 55.046 33.044 33.017 308 HG SER 44 HG SER 44 56.868 32.459 33.708 309 H ARG 45 H ARG 45 57.908 35.415 34.210 310 HA ARG 45 HA ARG 45 59.057 36.459 32.161 311 HB2 ARG 45 HB2 ARG 45 60.052 36.274 34.334 312 HB3 ARG 45 HB3 ARG 45 60.206 34.735 34.131 313 HG2 ARG 45 HG2 ARG 45 61.834 35.090 32.451 314 HG3 ARG 45 HG3 ARG 45 61.637 36.634 32.556 315 HD2 ARG 45 HD2 ARG 45 62.519 36.624 34.744 316 HD3 ARG 45 HD3 ARG 45 62.647 35.071 34.706 317 HE ARG 45 HE ARG 45 64.112 36.074 32.738 318 HH11 ARG 45 HH11 ARG 45 66.360 36.272 32.847 319 HH12 ARG 45 HH12 ARG 45 67.050 36.164 34.162 320 HH21 ARG 45 HH21 ARG 45 64.470 35.750 36.015 321 HH22 ARG 45 HH22 ARG 45 65.955 35.862 35.997 322 H ASP 46 H ASP 46 58.334 33.156 32.436 323 HA ASP 46 HA ASP 46 59.539 32.453 30.136 324 HB2 ASP 46 HB2 ASP 46 59.664 30.321 30.940 325 HB3 ASP 46 HB3 ASP 46 60.046 31.209 32.164 326 H LEU 47 H LEU 47 56.640 33.512 30.642 327 HA LEU 47 HA LEU 47 54.698 33.435 29.879 328 HB2 LEU 47 HB2 LEU 47 55.945 32.465 27.524 329 HB3 LEU 47 HB3 LEU 47 54.527 33.113 27.550 330 HG LEU 47 HG LEU 47 56.872 34.564 28.191 331 HD11 LEU 47 HD11 LEU 47 56.654 35.580 26.031 332 HD12 LEU 47 HD12 LEU 47 56.857 34.017 25.875 333 HD13 LEU 47 HD13 LEU 47 55.411 34.646 25.733 334 HD21 LEU 47 HD21 LEU 47 55.574 36.519 28.008 335 HD22 LEU 47 HD22 LEU 47 54.291 35.634 27.728 336 HD23 LEU 47 HD23 LEU 47 54.997 35.580 29.145 337 H ALA 48 H ALA 48 55.416 30.908 31.302 338 HA ALA 48 HA ALA 48 53.838 28.999 30.259 339 HB1 ALA 48 HB1 ALA 48 54.738 27.745 32.080 340 HB2 ALA 48 HB2 ALA 48 55.914 28.441 31.280 341 HB3 ALA 48 HB3 ALA 48 55.407 29.065 32.645 342 H TYR 49 H TYR 49 53.283 31.297 32.666 343 HA TYR 49 HA TYR 49 50.726 30.514 33.101 344 HB2 TYR 49 HB2 TYR 49 52.515 31.174 35.208 345 HB3 TYR 49 HB3 TYR 49 50.991 30.925 35.429 346 HD1 TYR 49 HD1 TYR 49 50.083 28.594 35.255 347 HD2 TYR 49 HD2 TYR 49 54.062 29.323 35.202 348 HE1 TYR 49 HE1 TYR 49 50.500 26.321 35.633 349 HE2 TYR 49 HE2 TYR 49 54.491 27.054 35.583 350 HH TYR 49 HH TYR 49 53.592 24.989 35.930 351 H ALA 50 H ALA 50 49.197 32.268 33.432 352 HA ALA 50 HA ALA 50 50.036 34.779 33.841 353 HB1 ALA 50 HB1 ALA 50 48.672 35.618 32.070 354 HB2 ALA 50 HB2 ALA 50 49.802 34.669 31.492 355 HB3 ALA 50 HB3 ALA 50 48.321 34.130 31.655 356 H LYS 51 H LYS 51 48.781 36.099 35.114 357 HA LYS 51 HA LYS 51 46.441 35.276 36.175 358 HB2 LYS 51 HB2 LYS 51 48.029 37.461 37.055 359 HB3 LYS 51 HB3 LYS 51 46.777 36.921 37.814 360 HG2 LYS 51 HG2 LYS 51 48.009 34.830 38.126 361 HG3 LYS 51 HG3 LYS 51 49.272 35.579 37.602 362 HD2 LYS 51 HD2 LYS 51 47.876 36.299 39.963 363 HD3 LYS 51 HD3 LYS 51 49.233 35.529 39.962 364 HE2 LYS 51 HE2 LYS 51 49.114 38.170 38.953 365 HE3 LYS 51 HE3 LYS 51 49.334 37.927 40.478 366 HZ1 LYS 51 HZ1 LYS 51 51.294 38.187 39.189 367 HZ2 LYS 51 HZ2 LYS 51 51.320 37.048 40.090 368 HZ3 LYS 51 HZ3 LYS 51 51.071 36.848 38.673 369 H VAL 52 H VAL 52 44.443 36.330 35.698 370 HA VAL 52 HA VAL 52 44.387 38.609 34.211 371 HB VAL 52 HB VAL 52 42.408 36.605 34.138 372 HG11 VAL 52 HG11 VAL 52 41.471 37.792 32.298 373 HG12 VAL 52 HG12 VAL 52 41.483 38.699 33.597 374 HG13 VAL 52 HG13 VAL 52 42.581 38.910 32.475 375 HG21 VAL 52 HG21 VAL 52 43.140 36.070 31.940 376 HG22 VAL 52 HG22 VAL 52 44.323 37.111 32.096 377 HG23 VAL 52 HG23 VAL 52 44.295 35.804 32.991 378 H TYR 53 H TYR 53 43.368 40.397 35.186 379 HA TYR 53 HA TYR 53 41.865 40.157 37.433 380 HB2 TYR 53 HB2 TYR 53 43.043 42.545 36.492 381 HB3 TYR 53 HB3 TYR 53 42.432 42.330 37.910 382 HD1 TYR 53 HD1 TYR 53 43.697 40.428 39.338 383 HD2 TYR 53 HD2 TYR 53 45.404 42.593 36.376 384 HE1 TYR 53 HE1 TYR 53 45.814 39.837 40.121 385 HE2 TYR 53 HE2 TYR 53 47.518 42.035 37.184 386 HH TYR 53 HH TYR 53 48.712 40.970 38.805 387 H VAL 54 H VAL 54 39.653 40.651 37.419 388 HA VAL 54 HA VAL 54 38.416 41.643 35.207 389 HB VAL 54 HB VAL 54 37.483 39.417 36.632 390 HG11 VAL 54 HG11 VAL 54 35.942 39.063 34.843 391 HG12 VAL 54 HG12 VAL 54 35.710 40.476 35.521 392 HG13 VAL 54 HG13 VAL 54 36.488 40.375 34.145 393 HG21 VAL 54 HG21 VAL 54 38.066 38.025 34.767 394 HG22 VAL 54 HG22 VAL 54 38.734 39.282 34.072 395 HG23 VAL 54 HG23 VAL 54 39.356 38.687 35.402 396 H THR 55 H THR 55 36.408 42.886 35.693 397 HA THR 55 HA THR 55 35.732 43.299 38.286 398 HB THR 55 HB THR 55 37.156 45.018 37.562 399 HG1 THR 55 HG1 THR 55 35.889 45.684 39.120 400 HG21 THR 55 HG21 THR 55 36.426 46.716 36.162 401 HG22 THR 55 HG22 THR 55 36.582 45.346 35.381 402 HG23 THR 55 HG23 THR 55 35.144 45.858 35.805 403 H PHE 56 H PHE 56 33.564 43.567 38.806 404 HA PHE 56 HA PHE 56 31.804 42.808 36.886 405 HB2 PHE 56 HB2 PHE 56 31.971 41.899 39.571 406 HB3 PHE 56 HB3 PHE 56 30.766 41.529 38.654 407 HD1 PHE 56 HD1 PHE 56 34.304 40.974 38.876 408 HD2 PHE 56 HD2 PHE 56 30.839 39.529 37.355 409 HE1 PHE 56 HE1 PHE 56 35.400 39.014 38.237 410 HE2 PHE 56 HE2 PHE 56 31.933 37.564 36.743 411 HZ PHE 56 HZ PHE 56 34.215 37.308 37.169 412 H LEU 57 H LEU 57 29.807 43.882 36.640 413 HA LEU 57 HA LEU 57 28.716 45.513 38.496 414 HB2 LEU 57 HB2 LEU 57 28.400 45.853 36.162 415 HB3 LEU 57 HB3 LEU 57 27.638 44.495 36.080 416 HG LEU 57 HG LEU 57 26.563 46.302 37.868 417 HD11 LEU 57 HD11 LEU 57 25.431 47.580 36.182 418 HD12 LEU 57 HD12 LEU 57 26.998 47.772 36.059 419 HD13 LEU 57 HD13 LEU 57 26.241 46.792 35.071 420 HD21 LEU 57 HD21 LEU 57 24.465 45.563 37.038 421 HD22 LEU 57 HD22 LEU 57 25.218 44.704 35.942 422 HD23 LEU 57 HD23 LEU 57 25.358 44.331 37.475 423 H ASN 58 H ASN 58 28.627 42.179 38.042 424 HA ASN 58 HA ASN 58 26.467 41.528 39.482 425 HB2 ASN 58 HB2 ASN 58 27.570 40.275 37.626 426 HB3 ASN 58 HB3 ASN 58 28.560 39.775 38.721 427 HD21 ASN 58 HD21 ASN 58 24.872 38.501 38.744 428 HD22 ASN 58 HD22 ASN 58 25.179 39.882 38.278 429 H ASP 59 H ASP 59 29.135 42.775 40.590 430 HA ASP 59 HA ASP 59 29.851 41.721 42.832 431 HB2 ASP 59 HB2 ASP 59 31.036 43.452 41.657 432 HB3 ASP 59 HB3 ASP 59 29.850 44.437 41.894 433 H LYS 60 H LYS 60 26.858 43.112 42.354 434 HA LYS 60 HA LYS 60 26.236 44.027 44.742 435 HB2 LYS 60 HB2 LYS 60 25.054 44.577 42.699 436 HB3 LYS 60 HB3 LYS 60 24.471 43.130 42.674 437 HG2 LYS 60 HG2 LYS 60 23.195 43.555 44.590 438 HG3 LYS 60 HG3 LYS 60 23.874 44.947 44.777 439 HD2 LYS 60 HD2 LYS 60 22.825 45.748 42.790 440 HD3 LYS 60 HD3 LYS 60 22.186 44.346 42.546 441 HE2 LYS 60 HE2 LYS 60 20.844 44.547 44.444 442 HE3 LYS 60 HE3 LYS 60 21.607 45.825 44.907 443 HZ1 LYS 60 HZ1 LYS 60 19.630 46.400 43.953 444 HZ2 LYS 60 HZ2 LYS 60 20.699 46.945 43.133 445 HZ3 LYS 60 HZ3 LYS 60 19.988 45.753 42.702 446 H ASP 61 H ASP 61 26.442 40.754 43.910 447 HA ASP 61 HA ASP 61 26.111 40.176 46.534 448 HB2 ASP 61 HB2 ASP 61 24.170 39.346 45.485 449 HB3 ASP 61 HB3 ASP 61 25.040 38.544 44.469 450 H GLU 62 H GLU 62 27.930 39.265 47.443 451 HA GLU 62 HA GLU 62 30.122 38.778 46.151 452 HB2 GLU 62 HB2 GLU 62 29.553 37.957 48.809 453 HB3 GLU 62 HB3 GLU 62 30.993 38.063 48.221 454 HG2 GLU 62 HG2 GLU 62 30.856 39.918 49.475 455 HG3 GLU 62 HG3 GLU 62 30.597 40.473 48.040 456 H ASP 63 H ASP 63 27.726 36.514 47.086 457 HA ASP 63 HA ASP 63 28.960 34.251 46.467 458 HB2 ASP 63 HB2 ASP 63 27.176 34.402 48.088 459 HB3 ASP 63 HB3 ASP 63 26.177 34.666 46.921 460 H ALA 64 H ALA 64 26.997 36.272 44.525 461 HA ALA 64 HA ALA 64 26.746 34.745 42.392 462 HB1 ALA 64 HB1 ALA 64 25.982 36.727 41.361 463 HB2 ALA 64 HB2 ALA 64 25.262 36.531 42.758 464 HB3 ALA 64 HB3 ALA 64 26.457 37.561 42.621 465 H VAL 65 H VAL 65 29.157 37.205 43.053 466 HA VAL 65 HA VAL 65 30.650 36.911 40.942 467 HB VAL 65 HB VAL 65 31.471 37.817 43.457 468 HG11 VAL 65 HG11 VAL 65 33.383 38.760 42.408 469 HG12 VAL 65 HG12 VAL 65 33.396 37.182 42.267 470 HG13 VAL 65 HG13 VAL 65 32.952 38.083 41.043 471 HG21 VAL 65 HG21 VAL 65 31.318 39.996 42.476 472 HG22 VAL 65 HG22 VAL 65 30.821 39.334 41.127 473 HG23 VAL 65 HG23 VAL 65 29.911 39.272 42.422 474 H LYS 66 H LYS 66 30.916 35.141 43.957 475 HA LYS 66 HA LYS 66 32.881 33.507 43.463 476 HB2 LYS 66 HB2 LYS 66 32.043 33.744 45.617 477 HB3 LYS 66 HB3 LYS 66 30.633 33.248 45.173 478 HG2 LYS 66 HG2 LYS 66 31.575 31.520 46.341 479 HG3 LYS 66 HG3 LYS 66 31.542 31.062 44.850 480 HD2 LYS 66 HD2 LYS 66 33.849 31.604 44.631 481 HD3 LYS 66 HD3 LYS 66 33.882 32.070 46.119 482 HE2 LYS 66 HE2 LYS 66 33.270 29.837 46.801 483 HE3 LYS 66 HE3 LYS 66 33.333 29.386 45.309 484 HZ1 LYS 66 HZ1 LYS 66 35.294 28.911 46.350 485 HZ2 LYS 66 HZ2 LYS 66 35.561 29.887 45.307 486 HZ3 LYS 66 HZ3 LYS 66 35.502 30.307 46.696 487 H ALA 67 H ALA 67 29.553 32.880 42.657 488 HA ALA 67 HA ALA 67 29.823 30.541 41.527 489 HB1 ALA 67 HB1 ALA 67 27.623 30.950 40.722 490 HB2 ALA 67 HB2 ALA 67 27.718 31.325 42.257 491 HB3 ALA 67 HB3 ALA 67 27.754 32.466 41.159 492 H GLY 68 H GLY 68 30.086 33.628 40.030 493 HA2 GLY 68 HA2 GLY 68 30.326 32.961 37.508 494 HA3 GLY 68 HA3 GLY 68 30.682 34.350 38.121 495 H ILE 69 H ILE 69 32.851 33.756 39.810 496 HA ILE 69 HA ILE 69 35.004 33.411 38.356 497 HB ILE 69 HB ILE 69 34.623 33.419 41.125 498 HG12 ILE 69 HG12 ILE 69 34.409 35.538 40.075 499 HG13 ILE 69 HG13 ILE 69 35.498 35.540 41.192 500 HG21 ILE 69 HG21 ILE 69 36.971 33.485 41.474 501 HG22 ILE 69 HG22 ILE 69 36.530 32.110 40.822 502 HG23 ILE 69 HG23 ILE 69 37.190 33.236 39.925 503 HD11 ILE 69 HD11 ILE 69 36.277 36.737 39.339 504 HD12 ILE 69 HD12 ILE 69 37.196 35.464 39.552 505 HD13 ILE 69 HD13 ILE 69 36.091 35.462 38.418 506 H LYS 70 H LYS 70 33.370 31.006 40.311 507 HA LYS 70 HA LYS 70 34.945 28.971 39.892 508 HB2 LYS 70 HB2 LYS 70 33.226 29.092 41.595 509 HB3 LYS 70 HB3 LYS 70 32.168 28.818 40.482 510 HG2 LYS 70 HG2 LYS 70 33.071 26.682 40.088 511 HG3 LYS 70 HG3 LYS 70 34.237 26.958 41.085 512 HD2 LYS 70 HD2 LYS 70 32.596 27.070 42.871 513 HD3 LYS 70 HD3 LYS 70 31.512 26.618 41.844 514 HE2 LYS 70 HE2 LYS 70 32.729 24.589 41.469 515 HE3 LYS 70 HE3 LYS 70 33.789 25.040 42.522 516 HZ1 LYS 70 HZ1 LYS 70 32.300 23.628 43.469 517 HZ2 LYS 70 HZ2 LYS 70 32.174 24.920 44.120 518 HZ3 LYS 70 HZ3 LYS 70 31.186 24.502 43.141 519 H ALA 71 H ALA 71 32.315 29.951 37.877 520 HA ALA 71 HA ALA 71 32.434 28.030 36.072 521 HB1 ALA 71 HB1 ALA 71 30.903 29.443 34.907 522 HB2 ALA 71 HB2 ALA 71 30.455 29.298 36.420 523 HB3 ALA 71 HB3 ALA 71 31.207 30.606 35.939 524 H LEU 72 H LEU 72 33.836 31.181 35.958 525 HA LEU 72 HA LEU 72 34.984 31.168 33.594 526 HB2 LEU 72 HB2 LEU 72 34.553 33.158 34.736 527 HB3 LEU 72 HB3 LEU 72 35.436 32.706 35.938 528 HG LEU 72 HG LEU 72 37.352 32.954 34.654 529 HD11 LEU 72 HD11 LEU 72 37.337 33.990 32.542 530 HD12 LEU 72 HD12 LEU 72 36.587 32.597 32.493 531 HD13 LEU 72 HD13 LEU 72 35.754 33.943 32.543 532 HD21 LEU 72 HD21 LEU 72 37.321 35.357 34.530 533 HD22 LEU 72 HD22 LEU 72 35.742 35.319 34.646 534 HD23 LEU 72 HD23 LEU 72 36.637 34.866 35.871 535 H GLN 73 H GLN 73 36.369 30.149 36.606 536 HA GLN 73 HA GLN 73 38.767 29.535 35.648 537 HB2 GLN 73 HB2 GLN 73 38.259 30.152 37.958 538 HB3 GLN 73 HB3 GLN 73 37.757 28.688 38.147 539 HG2 GLN 73 HG2 GLN 73 39.982 28.893 38.901 540 HG3 GLN 73 HG3 GLN 73 39.897 27.845 37.750 541 HE21 GLN 73 HE21 GLN 73 41.391 28.131 36.056 542 HE22 GLN 73 HE22 GLN 73 42.078 29.407 35.713 543 H GLU 74 H GLU 74 36.012 27.465 36.109 544 HA GLU 74 HA GLU 74 37.011 25.186 35.316 545 HB2 GLU 74 HB2 GLU 74 34.856 25.479 36.383 546 HB3 GLU 74 HB3 GLU 74 34.313 26.082 35.052 547 HG2 GLU 74 HG2 GLU 74 34.534 24.037 33.964 548 HG3 GLU 74 HG3 GLU 74 35.275 23.419 35.190 549 H ALA 75 H ALA 75 35.802 27.727 33.320 550 HA ALA 75 HA ALA 75 36.084 26.508 30.976 551 HB1 ALA 75 HB1 ALA 75 35.229 28.621 30.178 552 HB2 ALA 75 HB2 ALA 75 34.315 28.083 31.355 553 HB3 ALA 75 HB3 ALA 75 35.387 29.215 31.638 554 H SER 76 H SER 76 38.551 27.648 32.677 555 HA SER 76 HA SER 76 39.744 29.386 31.248 556 HB2 SER 76 HB2 SER 76 41.666 28.958 32.593 557 HB3 SER 76 HB3 SER 76 40.392 29.099 33.482 558 HG SER 76 HG SER 76 40.449 27.062 33.908 559 H GLY 77 H GLY 77 40.082 25.989 30.802 560 HA2 GLY 77 HA2 GLY 77 42.103 25.900 29.129 561 HA3 GLY 77 HA3 GLY 77 41.092 24.744 29.400 562 H PHE 78 H PHE 78 38.678 26.025 28.434 563 HA PHE 78 HA PHE 78 38.715 25.894 25.824 564 HB2 PHE 78 HB2 PHE 78 36.705 27.217 27.288 565 HB3 PHE 78 HB3 PHE 78 36.537 26.583 25.874 566 HD1 PHE 78 HD1 PHE 78 35.161 26.133 28.679 567 HD2 PHE 78 HD2 PHE 78 37.435 23.854 26.232 568 HE1 PHE 78 HE1 PHE 78 34.337 24.205 29.721 569 HE2 PHE 78 HE2 PHE 78 36.604 21.925 27.256 570 HZ PHE 78 HZ PHE 78 35.080 22.101 29.020 571 H ILE 79 H ILE 79 38.778 28.690 27.879 572 HA ILE 79 HA ILE 79 38.892 30.631 26.145 573 HB ILE 79 HB ILE 79 39.720 30.638 28.847 574 HG12 ILE 79 HG12 ILE 79 37.284 31.732 27.861 575 HG13 ILE 79 HG13 ILE 79 37.342 30.272 28.406 576 HG21 ILE 79 HG21 ILE 79 39.678 32.997 28.777 577 HG22 ILE 79 HG22 ILE 79 40.766 32.435 27.773 578 HG23 ILE 79 HG23 ILE 79 39.368 32.940 27.226 579 HD11 ILE 79 HD11 ILE 79 36.508 31.695 30.078 580 HD12 ILE 79 HD12 ILE 79 37.887 31.085 30.563 581 HD13 ILE 79 HD13 ILE 79 37.828 32.568 30.009 582 H ARG 80 H ARG 80 41.595 28.998 27.651 583 HA ARG 80 HA ARG 80 43.649 30.136 26.513 584 HB2 ARG 80 HB2 ARG 80 43.929 28.796 28.385 585 HB3 ARG 80 HB3 ARG 80 43.309 27.565 27.658 586 HG2 ARG 80 HG2 ARG 80 45.200 27.277 26.356 587 HG3 ARG 80 HG3 ARG 80 45.783 28.654 26.800 588 HD2 ARG 80 HD2 ARG 80 46.865 26.805 27.852 589 HD3 ARG 80 HD3 ARG 80 46.340 27.863 28.871 590 HE ARG 80 HE ARG 80 45.019 26.345 29.720 591 HH11 ARG 80 HH11 ARG 80 44.229 24.329 30.119 592 HH12 ARG 80 HH12 ARG 80 44.268 23.280 29.062 593 HH21 ARG 80 HH21 ARG 80 45.706 24.960 26.772 594 HH22 ARG 80 HH22 ARG 80 45.117 23.643 27.142 595 H SER 81 H SER 81 41.986 27.364 25.247 596 HA SER 81 HA SER 81 43.423 26.975 23.085 597 HB2 SER 81 HB2 SER 81 41.975 25.334 24.073 598 HB3 SER 81 HB3 SER 81 40.742 26.164 23.602 599 HG SER 81 HG SER 81 41.164 24.534 22.215 600 H LEU 82 H LEU 82 40.515 28.835 23.356 601 HA LEU 82 HA LEU 82 40.262 29.615 20.862 602 HB2 LEU 82 HB2 LEU 82 39.159 30.669 23.264 603 HB3 LEU 82 HB3 LEU 82 38.758 31.243 21.870 604 HG LEU 82 HG LEU 82 38.267 28.557 22.560 605 HD11 LEU 82 HD11 LEU 82 35.997 29.177 22.992 606 HD12 LEU 82 HD12 LEU 82 36.970 29.927 23.991 607 HD13 LEU 82 HD13 LEU 82 36.381 30.692 22.736 608 HD21 LEU 82 HD21 LEU 82 36.727 28.496 20.780 609 HD22 LEU 82 HD22 LEU 82 37.105 29.991 20.415 610 HD23 LEU 82 HD23 LEU 82 38.182 28.839 20.253 611 H LEU 83 H LEU 83 41.970 31.170 23.443 612 HA LEU 83 HA LEU 83 42.730 33.419 22.297 613 HB2 LEU 83 HB2 LEU 83 42.720 33.141 24.631 614 HB3 LEU 83 HB3 LEU 83 43.783 32.006 24.525 615 HG LEU 83 HG LEU 83 45.379 33.597 23.802 616 HD11 LEU 83 HD11 LEU 83 44.947 35.891 24.031 617 HD12 LEU 83 HD12 LEU 83 43.991 35.253 22.942 618 HD13 LEU 83 HD13 LEU 83 43.440 35.565 24.393 619 HD21 LEU 83 HD21 LEU 83 45.710 34.598 25.957 620 HD22 LEU 83 HD22 LEU 83 44.225 34.208 26.349 621 HD23 LEU 83 HD23 LEU 83 45.310 33.075 26.123 622 H GLY 84 H GLY 84 44.565 30.459 22.548 623 HA2 GLY 84 HA2 GLY 84 46.682 31.082 21.201 624 HA3 GLY 84 HA3 GLY 84 46.168 29.626 21.418 625 H LYS 85 H LYS 85 43.709 29.810 19.964 626 HA LYS 85 HA LYS 85 44.347 29.486 17.417 627 HB2 LYS 85 HB2 LYS 85 42.635 28.232 18.572 628 HB3 LYS 85 HB3 LYS 85 41.746 29.512 18.559 629 HG2 LYS 85 HG2 LYS 85 41.431 29.411 16.305 630 HG3 LYS 85 HG3 LYS 85 42.658 28.471 16.096 631 HD2 LYS 85 HD2 LYS 85 40.837 27.113 15.830 632 HD3 LYS 85 HD3 LYS 85 41.422 26.724 17.224 633 HE2 LYS 85 HE2 LYS 85 39.760 28.218 18.205 634 HE3 LYS 85 HE3 LYS 85 39.100 28.288 16.794 635 HZ1 LYS 85 HZ1 LYS 85 38.096 26.674 18.046 636 HZ2 LYS 85 HZ2 LYS 85 38.736 26.029 16.912 637 HZ3 LYS 85 HZ3 LYS 85 39.351 25.964 18.227 638 H ALA 86 H ALA 86 42.718 32.159 18.901 639 HA ALA 86 HA ALA 86 42.273 33.601 16.752 640 HB1 ALA 86 HB1 ALA 86 41.866 35.335 18.305 641 HB2 ALA 86 HB2 ALA 86 41.128 34.012 18.769 642 HB3 ALA 86 HB3 ALA 86 42.486 34.445 19.458 643 H MET 87 H MET 87 45.044 33.662 18.834 644 HA MET 87 HA MET 87 46.360 35.527 17.473 645 HB2 MET 87 HB2 MET 87 47.131 34.040 19.789 646 HB3 MET 87 HB3 MET 87 48.057 35.140 19.186 647 HG2 MET 87 HG2 MET 87 46.230 36.720 19.558 648 HG3 MET 87 HG3 MET 87 45.527 35.601 20.385 649 HE1 MET 87 HE1 MET 87 46.695 38.361 22.782 650 HE2 MET 87 HE2 MET 87 46.377 38.560 21.244 651 HE3 MET 87 HE3 MET 87 45.411 37.687 22.145 652 H ARG 88 H ARG 88 46.208 32.325 16.750 653 HA ARG 88 HA ARG 88 47.443 30.798 15.868 654 HB2 ARG 88 HB2 ARG 88 48.299 32.888 14.205 655 HB3 ARG 88 HB3 ARG 88 48.428 31.372 13.864 656 HG2 ARG 88 HG2 ARG 88 46.039 31.186 13.882 657 HG3 ARG 88 HG3 ARG 88 45.937 32.717 14.162 658 HD2 ARG 88 HD2 ARG 88 45.580 32.622 11.940 659 HD3 ARG 88 HD3 ARG 88 47.082 33.035 12.009 660 HE ARG 88 HE ARG 88 46.641 30.364 11.754 661 HH11 ARG 88 HH11 ARG 88 47.365 29.253 9.961 662 HH12 ARG 88 HH12 ARG 88 47.982 29.997 8.827 663 HH21 ARG 88 HH21 ARG 88 47.633 32.979 9.982 664 HH22 ARG 88 HH22 ARG 88 48.138 32.172 8.837 665 H LEU 89 H LEU 89 48.438 30.949 18.179 666 HA LEU 89 HA LEU 89 51.051 31.758 18.382 667 HB2 LEU 89 HB2 LEU 89 49.425 32.996 19.612 668 HB3 LEU 89 HB3 LEU 89 48.942 31.680 20.296 669 HG LEU 89 HG LEU 89 51.059 31.552 21.391 670 HD11 LEU 89 HD11 LEU 89 52.388 33.490 21.498 671 HD12 LEU 89 HD12 LEU 89 52.321 32.960 20.008 672 HD13 LEU 89 HD13 LEU 89 51.437 34.198 20.448 673 HD21 LEU 89 HD21 LEU 89 50.462 33.224 23.014 674 HD22 LEU 89 HD22 LEU 89 49.491 33.887 21.954 675 HD23 LEU 89 HD23 LEU 89 49.161 32.454 22.542 676 H ARG 90 H ARG 90 52.687 30.345 19.125 677 HA ARG 90 HA ARG 90 52.031 27.759 19.380 678 HB2 ARG 90 HB2 ARG 90 54.558 28.912 18.804 679 HB3 ARG 90 HB3 ARG 90 54.449 27.393 19.145 680 HG2 ARG 90 HG2 ARG 90 52.986 27.091 17.260 681 HG3 ARG 90 HG3 ARG 90 53.143 28.602 16.908 682 HD2 ARG 90 HD2 ARG 90 55.434 28.306 16.454 683 HD3 ARG 90 HD3 ARG 90 55.370 26.825 16.936 684 HE ARG 90 HE ARG 90 53.701 26.945 14.958 685 HH11 ARG 90 HH11 ARG 90 54.086 26.366 12.879 686 HH12 ARG 90 HH12 ARG 90 55.470 26.386 12.328 687 HH21 ARG 90 HH21 ARG 90 56.989 27.347 15.003 688 HH22 ARG 90 HH22 ARG 90 57.178 26.963 13.575 689 H ILE 91 H ILE 91 53.201 30.117 21.558 690 HA ILE 91 HA ILE 91 52.899 28.360 23.618 691 HB ILE 91 HB ILE 91 54.390 29.821 24.849 692 HG12 ILE 91 HG12 ILE 91 55.642 30.528 22.447 693 HG13 ILE 91 HG13 ILE 91 54.538 31.462 23.033 694 HG21 ILE 91 HG21 ILE 91 56.291 28.532 24.157 695 HG22 ILE 91 HG22 ILE 91 55.016 27.605 24.305 696 HG23 ILE 91 HG23 ILE 91 55.489 28.078 22.870 697 HD11 ILE 91 HD11 ILE 91 56.651 32.201 23.755 698 HD12 ILE 91 HD12 ILE 91 55.809 31.739 25.013 699 HD13 ILE 91 HD13 ILE 91 56.929 30.790 24.418 700 H VAL 92 H VAL 92 50.874 28.714 24.488 701 HA VAL 92 HA VAL 92 50.080 31.190 25.300 702 HB VAL 92 HB VAL 92 48.622 30.062 23.905 703 HG11 VAL 92 HG11 VAL 92 47.230 28.336 24.747 704 HG12 VAL 92 HG12 VAL 92 48.737 27.864 24.638 705 HG13 VAL 92 HG13 VAL 92 48.135 28.270 26.044 706 HG21 VAL 92 HG21 VAL 92 46.633 30.620 25.136 707 HG22 VAL 92 HG22 VAL 92 47.512 30.740 26.448 708 HG23 VAL 92 HG23 VAL 92 47.719 31.767 25.259 709 HA PRO 93 HA PRO 93 50.895 29.953 29.426 710 HB2 PRO 93 HB2 PRO 93 49.631 32.160 30.478 711 HB3 PRO 93 HB3 PRO 93 51.164 31.877 30.521 712 HG2 PRO 93 HG2 PRO 93 50.225 33.794 29.029 713 HG3 PRO 93 HG3 PRO 93 51.554 33.078 28.636 714 HD2 PRO 93 HD2 PRO 93 48.972 32.535 27.583 715 HD3 PRO 93 HD3 PRO 93 50.309 32.566 26.780 716 H GLU 94 H GLU 94 49.793 28.859 31.220 717 HA GLU 94 HA GLU 94 47.206 28.293 31.045 718 HB2 GLU 94 HB2 GLU 94 48.688 26.778 32.047 719 HB3 GLU 94 HB3 GLU 94 48.912 27.776 33.224 720 HG2 GLU 94 HG2 GLU 94 47.421 26.288 34.060 721 HG3 GLU 94 HG3 GLU 94 46.549 27.541 33.741 722 H LEU 95 H LEU 95 45.386 29.295 32.033 723 HA LEU 95 HA LEU 95 45.799 31.855 32.820 724 HB2 LEU 95 HB2 LEU 95 43.443 30.798 31.632 725 HB3 LEU 95 HB3 LEU 95 43.683 32.315 31.899 726 HG LEU 95 HG LEU 95 45.086 30.810 29.969 727 HD11 LEU 95 HD11 LEU 95 43.872 32.121 28.367 728 HD12 LEU 95 HD12 LEU 95 42.862 31.311 29.279 729 HD13 LEU 95 HD13 LEU 95 43.120 32.849 29.556 730 HD21 LEU 95 HD21 LEU 95 46.061 32.815 29.209 731 HD22 LEU 95 HD22 LEU 95 45.361 33.597 30.395 732 HD23 LEU 95 HD23 LEU 95 46.486 32.528 30.706 733 H THR 96 H THR 96 45.182 32.637 34.828 734 HA THR 96 HA THR 96 43.294 31.389 36.332 735 HB THR 96 HB THR 96 45.509 32.622 37.522 736 HG1 THR 96 HG1 THR 96 46.329 30.577 37.790 737 HG21 THR 96 HG21 THR 96 44.924 31.376 39.457 738 HG22 THR 96 HG22 THR 96 43.716 32.296 39.003 739 HG23 THR 96 HG23 THR 96 43.704 30.748 38.667 740 H PHE 97 H PHE 97 41.653 32.780 37.205 741 HA PHE 97 HA PHE 97 41.734 35.405 36.527 742 HB2 PHE 97 HB2 PHE 97 39.448 33.701 36.533 743 HB3 PHE 97 HB3 PHE 97 39.377 35.214 36.158 744 HD1 PHE 97 HD1 PHE 97 39.934 35.953 33.898 745 HD2 PHE 97 HD2 PHE 97 40.442 32.072 34.922 746 HE1 PHE 97 HE1 PHE 97 40.301 35.404 31.666 747 HE2 PHE 97 HE2 PHE 97 40.839 31.527 32.691 748 HZ PHE 97 HZ PHE 97 40.780 33.209 31.051 749 H PHE 98 H PHE 98 41.055 37.043 37.943 750 HA PHE 98 HA PHE 98 40.249 36.524 40.470 751 HB2 PHE 98 HB2 PHE 98 42.447 38.235 39.869 752 HB3 PHE 98 HB3 PHE 98 41.926 37.962 41.313 753 HD1 PHE 98 HD1 PHE 98 42.499 35.845 42.458 754 HD2 PHE 98 HD2 PHE 98 43.952 36.640 38.760 755 HE1 PHE 98 HE1 PHE 98 44.073 34.134 42.698 756 HE2 PHE 98 HE2 PHE 98 45.479 34.887 38.985 757 HZ PHE 98 HZ PHE 98 45.554 33.651 40.967 758 H TYR 99 H TYR 99 39.151 38.380 41.588 759 HA TYR 99 HA TYR 99 38.038 40.166 39.908 760 HB2 TYR 99 HB2 TYR 99 36.201 40.311 41.308 761 HB3 TYR 99 HB3 TYR 99 36.429 38.830 40.874 762 HD1 TYR 99 HD1 TYR 99 36.569 40.972 43.680 763 HD2 TYR 99 HD2 TYR 99 36.904 37.121 42.504 764 HE1 TYR 99 HE1 TYR 99 36.481 40.284 45.919 765 HE2 TYR 99 HE2 TYR 99 36.879 36.424 44.736 766 HH TYR 99 HH TYR 99 36.637 37.053 46.907 767 H ASP 100 H ASP 100 38.207 42.375 40.048 768 HA ASP 100 HA ASP 100 39.310 43.641 42.200 769 HB2 ASP 100 HB2 ASP 100 40.827 43.720 40.429 770 HB3 ASP 100 HB3 ASP 100 39.722 44.228 39.455 Start of MODEL 3 1 HA PRO 8 HA PRO 8 56.774 44.804 26.109 2 HB2 PRO 8 HB2 PRO 8 55.483 42.413 25.307 3 HB3 PRO 8 HB3 PRO 8 56.320 43.364 24.397 4 HG2 PRO 8 HG2 PRO 8 57.451 41.211 25.163 5 HG3 PRO 8 HG3 PRO 8 58.331 42.500 25.144 6 HD2 PRO 8 HD2 PRO 8 57.082 41.342 27.419 7 HD3 PRO 8 HD3 PRO 8 58.515 41.956 27.366 8 H GLN 9 H GLN 9 55.306 46.354 26.574 9 HA GLN 9 HA GLN 9 53.073 45.945 27.997 10 HB2 GLN 9 HB2 GLN 9 54.426 47.886 28.257 11 HB3 GLN 9 HB3 GLN 9 54.015 48.342 26.822 12 HG2 GLN 9 HG2 GLN 9 51.983 48.022 28.757 13 HG3 GLN 9 HG3 GLN 9 52.820 49.339 28.773 14 HE21 GLN 9 HE21 GLN 9 50.395 50.067 28.400 15 HE22 GLN 9 HE22 GLN 9 50.004 50.313 26.984 16 H ARG 10 H ARG 10 53.540 46.425 24.604 17 HA ARG 10 HA ARG 10 51.077 46.920 23.876 18 HB2 ARG 10 HB2 ARG 10 53.326 46.112 22.328 19 HB3 ARG 10 HB3 ARG 10 51.967 46.465 21.649 20 HG2 ARG 10 HG2 ARG 10 52.124 48.683 22.338 21 HG3 ARG 10 HG3 ARG 10 53.370 48.365 23.221 22 HD2 ARG 10 HD2 ARG 10 54.707 48.059 21.333 23 HD3 ARG 10 HD3 ARG 10 53.468 48.157 20.389 24 HE ARG 10 HE ARG 10 53.510 50.442 21.570 25 HH11 ARG 10 HH11 ARG 10 54.363 52.327 20.755 26 HH12 ARG 10 HH12 ARG 10 55.548 52.285 19.853 27 HH21 ARG 10 HH21 ARG 10 55.927 49.113 19.722 28 HH22 ARG 10 HH22 ARG 10 56.453 50.426 19.253 29 H VAL 11 H VAL 11 52.687 43.905 24.097 30 HA VAL 11 HA VAL 11 50.909 42.308 23.046 31 HB VAL 11 HB VAL 11 52.939 41.657 24.896 32 HG11 VAL 11 HG11 VAL 11 52.763 39.410 24.091 33 HG12 VAL 11 HG12 VAL 11 51.387 39.876 24.721 34 HG13 VAL 11 HG13 VAL 11 51.570 39.858 23.149 35 HG21 VAL 11 HG21 VAL 11 54.271 40.986 23.046 36 HG22 VAL 11 HG22 VAL 11 53.130 41.474 22.064 37 HG23 VAL 11 HG23 VAL 11 53.921 42.527 22.944 38 H ALA 12 H ALA 12 51.319 43.233 26.394 39 HA ALA 12 HA ALA 12 49.400 41.845 27.487 40 HB1 ALA 12 HB1 ALA 12 49.658 43.334 29.305 41 HB2 ALA 12 HB2 ALA 12 51.076 42.847 28.792 42 HB3 ALA 12 HB3 ALA 12 50.539 44.283 28.393 43 H GLN 13 H GLN 13 49.048 44.890 25.862 44 HA GLN 13 HA GLN 13 46.552 45.298 26.537 45 HB2 GLN 13 HB2 GLN 13 47.792 46.528 24.318 46 HB3 GLN 13 HB3 GLN 13 46.528 47.068 25.055 47 HG2 GLN 13 HG2 GLN 13 49.202 47.326 25.871 48 HG3 GLN 13 HG3 GLN 13 48.131 48.457 25.780 49 HE21 GLN 13 HE21 GLN 13 49.729 46.666 27.964 50 HE22 GLN 13 HE22 GLN 13 48.878 46.874 29.169 51 H GLU 14 H GLU 14 47.793 43.663 23.699 52 HA GLU 14 HA GLU 14 45.530 43.114 22.533 53 HB2 GLU 14 HB2 GLU 14 47.934 41.601 22.384 54 HB3 GLU 14 HB3 GLU 14 46.708 41.307 21.463 55 HG2 GLU 14 HG2 GLU 14 47.001 43.539 20.535 56 HG3 GLU 14 HG3 GLU 14 48.354 43.609 21.308 57 H MET 15 H MET 15 47.205 41.280 24.984 58 HA MET 15 HA MET 15 45.727 39.151 25.140 59 HB2 MET 15 HB2 MET 15 47.513 40.234 27.048 60 HB3 MET 15 HB3 MET 15 46.789 38.875 27.298 61 HG2 MET 15 HG2 MET 15 48.463 39.236 25.048 62 HG3 MET 15 HG3 MET 15 49.045 38.718 26.399 63 HE1 MET 15 HE1 MET 15 49.482 35.585 24.479 64 HE2 MET 15 HE2 MET 15 49.797 37.078 24.056 65 HE3 MET 15 HE3 MET 15 50.146 36.579 25.517 66 H GLN 16 H GLN 16 45.355 42.067 27.080 67 HA GLN 16 HA GLN 16 43.289 41.482 28.448 68 HB2 GLN 16 HB2 GLN 16 43.997 44.008 27.354 69 HB3 GLN 16 HB3 GLN 16 42.758 43.880 28.292 70 HG2 GLN 16 HG2 GLN 16 44.128 43.382 30.118 71 HG3 GLN 16 HG3 GLN 16 45.390 43.327 29.202 72 HE21 GLN 16 HE21 GLN 16 46.426 45.119 30.379 73 HE22 GLN 16 HE22 GLN 16 45.972 46.527 30.216 74 H LYS 17 H LYS 17 43.223 42.849 25.241 75 HA LYS 17 HA LYS 17 40.659 43.283 24.923 76 HB2 LYS 17 HB2 LYS 17 42.578 44.298 23.726 77 HB3 LYS 17 HB3 LYS 17 42.603 43.011 22.846 78 HG2 LYS 17 HG2 LYS 17 41.472 44.586 21.620 79 HG3 LYS 17 HG3 LYS 17 40.393 43.556 22.076 80 HD2 LYS 17 HD2 LYS 17 39.507 44.987 23.619 81 HD3 LYS 17 HD3 LYS 17 40.801 45.854 23.682 82 HE2 LYS 17 HE2 LYS 17 40.351 46.581 21.421 83 HE3 LYS 17 HE3 LYS 17 38.991 45.821 21.489 84 HZ1 LYS 17 HZ1 LYS 17 38.687 48.012 22.011 85 HZ2 LYS 17 HZ2 LYS 17 38.355 47.220 23.183 86 HZ3 LYS 17 HZ3 LYS 17 39.622 47.927 23.119 87 H GLU 18 H GLU 18 42.453 40.623 23.698 88 HA GLU 18 HA GLU 18 40.514 39.398 22.379 89 HB2 GLU 18 HB2 GLU 18 42.997 39.332 22.036 90 HB3 GLU 18 HB3 GLU 18 42.959 38.180 23.088 91 HG2 GLU 18 HG2 GLU 18 42.929 37.107 21.093 92 HG3 GLU 18 HG3 GLU 18 41.458 36.997 21.600 93 H ILE 19 H ILE 19 41.786 38.787 25.546 94 HA ILE 19 HA ILE 19 40.329 36.674 26.172 95 HB ILE 19 HB ILE 19 41.804 38.375 27.868 96 HG12 ILE 19 HG12 ILE 19 42.461 35.735 27.024 97 HG13 ILE 19 HG13 ILE 19 43.087 37.002 26.362 98 HG21 ILE 19 HG21 ILE 19 41.529 36.787 29.599 99 HG22 ILE 19 HG22 ILE 19 40.124 37.381 29.174 100 HG23 ILE 19 HG23 ILE 19 40.562 35.946 28.669 101 HD11 ILE 19 HD11 ILE 19 44.625 36.075 27.880 102 HD12 ILE 19 HD12 ILE 19 44.211 37.517 28.386 103 HD13 ILE 19 HD13 ILE 19 43.576 36.231 29.057 104 H ALA 20 H ALA 20 39.701 40.061 26.781 105 HA ALA 20 HA ALA 20 37.510 39.910 28.167 106 HB1 ALA 20 HB1 ALA 20 37.248 42.181 27.567 107 HB2 ALA 20 HB2 ALA 20 38.744 41.905 28.010 108 HB3 ALA 20 HB3 ALA 20 38.381 42.015 26.472 109 H LEU 21 H LEU 21 37.775 39.849 24.716 110 HA LEU 21 HA LEU 21 35.195 39.674 24.098 111 HB2 LEU 21 HB2 LEU 21 36.820 40.438 22.558 112 HB3 LEU 21 HB3 LEU 21 37.499 39.034 22.567 113 HG LEU 21 HG LEU 21 35.649 38.093 21.515 114 HD11 LEU 21 HD11 LEU 21 33.865 39.399 20.705 115 HD12 LEU 21 HD12 LEU 21 33.915 39.459 22.287 116 HD13 LEU 21 HD13 LEU 21 34.471 40.670 21.431 117 HD21 LEU 21 HD21 LEU 21 35.913 39.203 19.393 118 HD22 LEU 21 HD22 LEU 21 36.573 40.435 20.139 119 HD23 LEU 21 HD23 LEU 21 37.325 39.041 20.091 120 H ILE 22 H ILE 22 37.465 37.051 24.643 121 HA ILE 22 HA ILE 22 35.812 35.078 24.187 122 HB ILE 22 HB ILE 22 38.183 34.981 25.702 123 HG12 ILE 22 HG12 ILE 22 37.912 33.964 23.067 124 HG13 ILE 22 HG13 ILE 22 38.354 35.443 23.287 125 HG21 ILE 22 HG21 ILE 22 38.058 32.607 25.459 126 HG22 ILE 22 HG22 ILE 22 36.794 33.135 26.254 127 HG23 ILE 22 HG23 ILE 22 36.667 32.767 24.719 128 HD11 ILE 22 HD11 ILE 22 40.255 34.110 22.913 129 HD12 ILE 22 HD12 ILE 22 40.327 34.706 24.378 130 HD13 ILE 22 HD13 ILE 22 39.878 33.203 24.155 131 H LEU 23 H LEU 23 36.238 36.794 27.172 132 HA LEU 23 HA LEU 23 34.646 35.509 28.754 133 HB2 LEU 23 HB2 LEU 23 35.827 38.018 28.821 134 HB3 LEU 23 HB3 LEU 23 34.478 37.983 29.603 135 HG LEU 23 HG LEU 23 35.337 36.200 30.930 136 HD11 LEU 23 HD11 LEU 23 37.631 35.748 30.956 137 HD12 LEU 23 HD12 LEU 23 37.002 35.369 29.553 138 HD13 LEU 23 HD13 LEU 23 37.828 36.710 29.713 139 HD21 LEU 23 HD21 LEU 23 36.759 37.592 32.271 140 HD22 LEU 23 HD22 LEU 23 36.883 38.604 31.058 141 HD23 LEU 23 HD23 LEU 23 35.491 38.411 31.790 142 H GLN 24 H GLN 24 33.592 37.601 26.246 143 HA GLN 24 HA GLN 24 30.997 37.386 26.845 144 HB2 GLN 24 HB2 GLN 24 32.207 38.655 24.587 145 HB3 GLN 24 HB3 GLN 24 30.675 38.727 24.873 146 HG2 GLN 24 HG2 GLN 24 31.124 39.933 26.887 147 HG3 GLN 24 HG3 GLN 24 32.649 39.888 26.561 148 HE21 GLN 24 HE21 GLN 24 31.860 42.346 26.914 149 HE22 GLN 24 HE22 GLN 24 31.646 43.117 25.657 150 H ARG 25 H ARG 25 33.039 35.727 24.594 151 HA ARG 25 HA ARG 25 31.062 34.636 23.212 152 HB2 ARG 25 HB2 ARG 25 33.869 34.370 22.796 153 HB3 ARG 25 HB3 ARG 25 32.844 33.647 21.870 154 HG2 ARG 25 HG2 ARG 25 33.254 36.447 21.985 155 HG3 ARG 25 HG3 ARG 25 33.596 35.535 20.766 156 HD2 ARG 25 HD2 ARG 25 30.980 36.264 21.554 157 HD3 ARG 25 HD3 ARG 25 31.701 36.774 20.268 158 HE ARG 25 HE ARG 25 30.476 34.368 20.508 159 HH11 ARG 25 HH11 ARG 25 29.898 33.235 18.661 160 HH12 ARG 25 HH12 ARG 25 30.593 33.510 17.373 161 HH21 ARG 25 HH21 ARG 25 32.476 35.900 18.336 162 HH22 ARG 25 HH22 ARG 25 32.073 35.039 17.189 163 H GLU 26 H GLU 26 33.403 33.130 25.336 164 HA GLU 26 HA GLU 26 32.472 30.658 24.986 165 HB2 GLU 26 HB2 GLU 26 34.757 30.953 25.359 166 HB3 GLU 26 HB3 GLU 26 34.469 31.559 26.766 167 HG2 GLU 26 HG2 GLU 26 35.246 29.408 27.057 168 HG3 GLU 26 HG3 GLU 26 33.767 29.459 27.549 169 H ILE 27 H ILE 27 31.788 33.029 27.362 170 HA ILE 27 HA ILE 27 29.896 31.525 28.587 171 HB ILE 27 HB ILE 27 30.484 32.322 30.696 172 HG12 ILE 27 HG12 ILE 27 32.865 33.336 29.588 173 HG13 ILE 27 HG13 ILE 27 31.688 34.237 30.072 174 HG21 ILE 27 HG21 ILE 27 32.296 30.836 31.043 175 HG22 ILE 27 HG22 ILE 27 31.190 30.165 30.129 176 HG23 ILE 27 HG23 ILE 27 32.510 30.749 29.476 177 HD11 ILE 27 HD11 ILE 27 33.360 34.186 31.717 178 HD12 ILE 27 HD12 ILE 27 32.045 33.524 32.300 179 HD13 ILE 27 HD13 ILE 27 33.240 32.609 31.807 180 H LYS 28 H LYS 28 28.050 32.726 29.566 181 HA LYS 28 HA LYS 28 27.313 34.746 27.988 182 HB2 LYS 28 HB2 LYS 28 25.710 33.298 29.839 183 HB3 LYS 28 HB3 LYS 28 25.122 34.378 28.880 184 HG2 LYS 28 HG2 LYS 28 26.195 31.883 28.027 185 HG3 LYS 28 HG3 LYS 28 24.680 32.254 27.985 186 HD2 LYS 28 HD2 LYS 28 25.095 33.856 26.301 187 HD3 LYS 28 HD3 LYS 28 26.625 33.559 26.373 188 HE2 LYS 28 HE2 LYS 28 26.125 31.278 25.678 189 HE3 LYS 28 HE3 LYS 28 24.657 31.738 25.420 190 HZ1 LYS 28 HZ1 LYS 28 25.867 31.873 23.494 191 HZ2 LYS 28 HZ2 LYS 28 25.451 33.216 23.861 192 HZ3 LYS 28 HZ3 LYS 28 26.818 32.788 24.101 193 H ASP 29 H ASP 29 27.772 36.853 28.440 194 HA ASP 29 HA ASP 29 28.036 37.727 30.926 195 HB2 ASP 29 HB2 ASP 29 29.358 38.433 28.862 196 HB3 ASP 29 HB3 ASP 29 28.257 39.534 28.768 197 HA PRO 30 HA PRO 30 24.065 40.067 30.178 198 HB2 PRO 30 HB2 PRO 30 22.494 37.956 29.096 199 HB3 PRO 30 HB3 PRO 30 22.313 39.479 28.808 200 HG2 PRO 30 HG2 PRO 30 23.493 38.115 27.018 201 HG3 PRO 30 HG3 PRO 30 24.082 39.527 27.323 202 HD2 PRO 30 HD2 PRO 30 25.077 37.044 28.282 203 HD3 PRO 30 HD3 PRO 30 25.932 38.248 27.781 204 H ARG 31 H ARG 31 24.266 36.908 31.499 205 HA ARG 31 HA ARG 31 22.601 37.237 33.532 206 HB2 ARG 31 HB2 ARG 31 23.453 35.095 32.717 207 HB3 ARG 31 HB3 ARG 31 24.798 35.426 33.433 208 HG2 ARG 31 HG2 ARG 31 23.791 35.311 35.534 209 HG3 ARG 31 HG3 ARG 31 22.369 35.226 34.901 210 HD2 ARG 31 HD2 ARG 31 22.988 33.085 35.613 211 HD3 ARG 31 HD3 ARG 31 22.854 33.066 34.060 212 HE ARG 31 HE ARG 31 25.309 33.170 35.319 213 HH11 ARG 31 HH11 ARG 31 27.090 32.394 34.182 214 HH12 ARG 31 HH12 ARG 31 26.881 31.587 32.947 215 HH21 ARG 31 HH21 ARG 31 23.724 31.774 32.744 216 HH22 ARG 31 HH22 ARG 31 24.967 31.233 32.126 217 H LEU 32 H LEU 32 25.653 38.492 33.141 218 HA LEU 32 HA LEU 32 26.026 39.390 35.659 219 HB2 LEU 32 HB2 LEU 32 27.971 39.225 33.588 220 HB3 LEU 32 HB3 LEU 32 28.291 39.621 35.061 221 HG LEU 32 HG LEU 32 27.486 37.022 34.301 222 HD11 LEU 32 HD11 LEU 32 29.756 36.402 34.703 223 HD12 LEU 32 HD12 LEU 32 29.689 37.496 33.560 224 HD13 LEU 32 HD13 LEU 32 30.095 37.912 35.034 225 HD21 LEU 32 HD21 LEU 32 28.083 36.318 36.471 226 HD22 LEU 32 HD22 LEU 32 28.424 37.816 36.856 227 HD23 LEU 32 HD23 LEU 32 26.928 37.399 36.545 228 H GLY 33 H GLY 33 24.321 40.721 33.492 229 HA2 GLY 33 HA2 GLY 33 23.592 42.736 33.266 230 HA3 GLY 33 HA3 GLY 33 24.838 43.278 34.033 231 H MET 34 H MET 34 25.876 41.437 31.451 232 HA MET 34 HA MET 34 27.014 41.785 29.670 233 HB2 MET 34 HB2 MET 34 24.742 42.283 28.983 234 HB3 MET 34 HB3 MET 34 25.127 43.791 29.080 235 HG2 MET 34 HG2 MET 34 25.185 43.098 26.865 236 HG3 MET 34 HG3 MET 34 26.599 43.584 27.306 237 HE1 MET 34 HE1 MET 34 28.945 41.032 26.545 238 HE2 MET 34 HE2 MET 34 28.550 42.535 26.238 239 HE3 MET 34 HE3 MET 34 28.688 42.043 27.737 240 H MET 35 H MET 35 28.048 43.150 32.000 241 HA MET 35 HA MET 35 29.674 45.007 30.941 242 HB2 MET 35 HB2 MET 35 28.010 45.630 33.132 243 HB3 MET 35 HB3 MET 35 29.259 46.494 32.780 244 HG2 MET 35 HG2 MET 35 28.254 46.851 30.595 245 HG3 MET 35 HG3 MET 35 26.955 46.205 31.167 246 HE1 MET 35 HE1 MET 35 25.835 49.739 30.742 247 HE2 MET 35 HE2 MET 35 26.774 48.892 29.788 248 HE3 MET 35 HE3 MET 35 25.490 48.224 30.434 249 H THR 36 H THR 36 30.475 42.383 31.685 250 HA THR 36 HA THR 36 32.284 42.747 33.649 251 HB THR 36 HB THR 36 32.118 40.437 32.082 252 HG1 THR 36 HG1 THR 36 30.337 40.009 32.967 253 HG21 THR 36 HG21 THR 36 32.996 39.327 33.995 254 HG22 THR 36 HG22 THR 36 33.969 40.488 33.534 255 HG23 THR 36 HG23 THR 36 33.005 40.708 34.771 256 H THR 37 H THR 37 34.449 43.432 33.243 257 HA THR 37 HA THR 37 35.506 43.254 30.766 258 HB THR 37 HB THR 37 36.475 45.374 31.006 259 HG1 THR 37 HG1 THR 37 35.489 46.784 32.380 260 HG21 THR 37 HG21 THR 37 34.563 46.614 30.295 261 HG22 THR 37 HG22 THR 37 34.645 45.212 29.561 262 HG23 THR 37 HG23 THR 37 33.643 45.415 30.770 263 H VAL 38 H VAL 38 37.952 43.407 30.639 264 HA VAL 38 HA VAL 38 39.253 42.250 32.721 265 HB VAL 38 HB VAL 38 40.047 42.431 30.059 266 HG11 VAL 38 HG11 VAL 38 41.903 41.036 30.577 267 HG12 VAL 38 HG12 VAL 38 42.005 42.413 31.351 268 HG13 VAL 38 HG13 VAL 38 41.514 41.113 32.110 269 HG21 VAL 38 HG21 VAL 38 39.780 40.031 30.049 270 HG22 VAL 38 HG22 VAL 38 39.299 40.101 31.556 271 HG23 VAL 38 HG23 VAL 38 38.409 40.734 30.410 272 H SER 39 H SER 39 40.280 43.666 34.158 273 HA SER 39 HA SER 39 40.965 46.150 33.442 274 HB2 SER 39 HB2 SER 39 41.268 46.477 35.815 275 HB3 SER 39 HB3 SER 39 39.813 46.058 35.439 276 HG SER 39 HG SER 39 40.716 44.875 37.115 277 H GLY 40 H GLY 40 42.830 43.385 33.733 278 HA2 GLY 40 HA2 GLY 40 44.927 44.354 32.619 279 HA3 GLY 40 HA3 GLY 40 45.219 44.382 34.151 280 H VAL 41 H VAL 41 46.848 42.849 32.576 281 HA VAL 41 HA VAL 41 46.506 40.356 33.509 282 HB VAL 41 HB VAL 41 47.523 39.427 31.659 283 HG11 VAL 41 HG11 VAL 41 45.725 39.667 30.086 284 HG12 VAL 41 HG12 VAL 41 45.166 39.487 31.557 285 HG13 VAL 41 HG13 VAL 41 45.214 40.926 30.900 286 HG21 VAL 41 HG21 VAL 41 47.874 40.644 29.652 287 HG22 VAL 41 HG22 VAL 41 47.493 41.978 30.417 288 HG23 VAL 41 HG23 VAL 41 48.803 41.183 30.817 289 H GLU 42 H GLU 42 48.435 39.182 34.268 290 HA GLU 42 HA GLU 42 50.882 40.360 34.103 291 HB2 GLU 42 HB2 GLU 42 50.018 40.583 36.327 292 HB3 GLU 42 HB3 GLU 42 50.041 39.029 36.445 293 HG2 GLU 42 HG2 GLU 42 52.427 39.085 36.089 294 HG3 GLU 42 HG3 GLU 42 52.362 40.643 36.112 295 H MET 43 H MET 43 52.202 39.027 32.818 296 HA MET 43 HA MET 43 51.643 36.400 32.534 297 HB2 MET 43 HB2 MET 43 52.947 38.011 30.612 298 HB3 MET 43 HB3 MET 43 52.571 36.512 30.393 299 HG2 MET 43 HG2 MET 43 50.230 37.293 30.815 300 HG3 MET 43 HG3 MET 43 50.798 38.701 30.463 301 HE1 MET 43 HE1 MET 43 51.945 38.323 26.846 302 HE2 MET 43 HE2 MET 43 51.857 39.342 28.056 303 HE3 MET 43 HE3 MET 43 52.830 38.095 28.139 304 H SER 44 H SER 44 53.353 34.755 32.517 305 HA SER 44 HA SER 44 55.297 35.047 34.253 306 HB2 SER 44 HB2 SER 44 54.212 32.954 33.880 307 HB3 SER 44 HB3 SER 44 54.858 32.876 32.463 308 HG SER 44 HG SER 44 56.472 32.048 33.377 309 H ARG 45 H ARG 45 57.673 34.870 33.912 310 HA ARG 45 HA ARG 45 58.721 36.344 31.999 311 HB2 ARG 45 HB2 ARG 45 59.581 35.980 34.262 312 HB3 ARG 45 HB3 ARG 45 60.117 34.604 33.759 313 HG2 ARG 45 HG2 ARG 45 61.579 35.692 32.261 314 HG3 ARG 45 HG3 ARG 45 61.005 37.080 32.680 315 HD2 ARG 45 HD2 ARG 45 61.912 36.898 34.809 316 HD3 ARG 45 HD3 ARG 45 62.286 35.402 34.577 317 HE ARG 45 HE ARG 45 63.759 37.501 33.732 318 HH11 ARG 45 HH11 ARG 45 65.659 37.227 32.621 319 HH12 ARG 45 HH12 ARG 45 66.086 35.874 32.169 320 HH21 ARG 45 HH21 ARG 45 63.501 34.248 33.238 321 HH22 ARG 45 HH22 ARG 45 64.807 34.106 32.535 322 H ASP 46 H ASP 46 58.232 33.025 31.984 323 HA ASP 46 HA ASP 46 59.445 32.544 29.636 324 HB2 ASP 46 HB2 ASP 46 59.243 30.260 30.250 325 HB3 ASP 46 HB3 ASP 46 60.074 31.053 31.304 326 H LEU 47 H LEU 47 56.477 33.518 30.257 327 HA LEU 47 HA LEU 47 54.533 33.405 29.531 328 HB2 LEU 47 HB2 LEU 47 55.716 32.674 27.062 329 HB3 LEU 47 HB3 LEU 47 54.286 33.281 27.200 330 HG LEU 47 HG LEU 47 56.623 34.724 27.847 331 HD11 LEU 47 HD11 LEU 47 56.299 35.925 25.809 332 HD12 LEU 47 HD12 LEU 47 56.534 34.388 25.506 333 HD13 LEU 47 HD13 LEU 47 55.069 34.988 25.469 334 HD21 LEU 47 HD21 LEU 47 55.269 36.656 27.881 335 HD22 LEU 47 HD22 LEU 47 53.997 35.757 27.592 336 HD23 LEU 47 HD23 LEU 47 54.772 35.613 28.964 337 H ALA 48 H ALA 48 55.435 30.809 30.714 338 HA ALA 48 HA ALA 48 53.863 28.917 29.706 339 HB1 ALA 48 HB1 ALA 48 54.580 27.727 31.663 340 HB2 ALA 48 HB2 ALA 48 55.834 28.383 30.949 341 HB3 ALA 48 HB3 ALA 48 55.207 29.064 32.234 342 H TYR 49 H TYR 49 53.147 31.324 31.981 343 HA TYR 49 HA TYR 49 50.592 30.557 32.396 344 HB2 TYR 49 HB2 TYR 49 52.380 31.161 34.533 345 HB3 TYR 49 HB3 TYR 49 50.854 30.928 34.748 346 HD1 TYR 49 HD1 TYR 49 49.920 28.635 34.621 347 HD2 TYR 49 HD2 TYR 49 53.910 29.269 34.367 348 HE1 TYR 49 HE1 TYR 49 50.295 26.347 34.884 349 HE2 TYR 49 HE2 TYR 49 54.287 26.980 34.602 350 HH TYR 49 HH TYR 49 53.371 24.925 34.876 351 H ALA 50 H ALA 50 49.092 32.322 32.907 352 HA ALA 50 HA ALA 50 49.980 34.808 33.341 353 HB1 ALA 50 HB1 ALA 50 48.518 35.724 31.712 354 HB2 ALA 50 HB2 ALA 50 49.599 34.792 31.024 355 HB3 ALA 50 HB3 ALA 50 48.126 34.257 31.259 356 H LYS 51 H LYS 51 48.779 36.088 34.753 357 HA LYS 51 HA LYS 51 46.446 35.247 35.828 358 HB2 LYS 51 HB2 LYS 51 48.167 37.288 36.782 359 HB3 LYS 51 HB3 LYS 51 46.862 36.849 37.514 360 HG2 LYS 51 HG2 LYS 51 47.841 34.670 37.851 361 HG3 LYS 51 HG3 LYS 51 49.167 35.204 37.226 362 HD2 LYS 51 HD2 LYS 51 48.057 36.326 39.579 363 HD3 LYS 51 HD3 LYS 51 49.153 35.218 39.633 364 HE2 LYS 51 HE2 LYS 51 49.666 37.725 38.423 365 HE3 LYS 51 HE3 LYS 51 49.975 37.477 39.931 366 HZ1 LYS 51 HZ1 LYS 51 51.836 37.163 38.616 367 HZ2 LYS 51 HZ2 LYS 51 51.531 35.940 39.339 368 HZ3 LYS 51 HZ3 LYS 51 51.194 36.053 37.931 369 H VAL 52 H VAL 52 44.474 36.332 35.445 370 HA VAL 52 HA VAL 52 44.387 38.633 34.013 371 HB VAL 52 HB VAL 52 42.437 36.617 33.923 372 HG11 VAL 52 HG11 VAL 52 41.487 37.792 32.081 373 HG12 VAL 52 HG12 VAL 52 41.481 38.691 33.386 374 HG13 VAL 52 HG13 VAL 52 42.577 38.925 32.267 375 HG21 VAL 52 HG21 VAL 52 43.158 36.105 31.703 376 HG22 VAL 52 HG22 VAL 52 44.340 37.145 31.867 377 HG23 VAL 52 HG23 VAL 52 44.316 35.828 32.746 378 H TYR 53 H TYR 53 43.385 40.391 35.106 379 HA TYR 53 HA TYR 53 41.810 40.024 37.252 380 HB2 TYR 53 HB2 TYR 53 42.887 42.453 36.296 381 HB3 TYR 53 HB3 TYR 53 42.048 42.335 37.605 382 HD1 TYR 53 HD1 TYR 53 43.040 40.832 39.484 383 HD2 TYR 53 HD2 TYR 53 45.230 42.261 36.390 384 HE1 TYR 53 HE1 TYR 53 45.002 40.351 40.658 385 HE2 TYR 53 HE2 TYR 53 47.203 41.836 37.587 386 HH TYR 53 HH TYR 53 48.099 41.018 39.461 387 H VAL 54 H VAL 54 39.577 40.433 37.261 388 HA VAL 54 HA VAL 54 38.306 41.327 35.007 389 HB VAL 54 HB VAL 54 37.440 39.162 36.550 390 HG11 VAL 54 HG11 VAL 54 35.860 38.771 34.793 391 HG12 VAL 54 HG12 VAL 54 35.650 40.210 35.419 392 HG13 VAL 54 HG13 VAL 54 36.412 40.050 34.041 393 HG21 VAL 54 HG21 VAL 54 38.003 37.701 34.738 394 HG22 VAL 54 HG22 VAL 54 38.642 38.930 33.971 395 HG23 VAL 54 HG23 VAL 54 39.302 38.405 35.311 396 H THR 55 H THR 55 36.559 42.765 35.428 397 HA THR 55 HA THR 55 35.784 43.304 37.978 398 HB THR 55 HB THR 55 37.302 44.888 37.204 399 HG1 THR 55 HG1 THR 55 36.063 45.661 38.742 400 HG21 THR 55 HG21 THR 55 36.654 46.611 35.777 401 HG22 THR 55 HG22 THR 55 36.759 45.225 35.018 402 HG23 THR 55 HG23 THR 55 35.340 45.801 35.424 403 H PHE 56 H PHE 56 33.606 43.582 38.358 404 HA PHE 56 HA PHE 56 31.872 42.843 36.387 405 HB2 PHE 56 HB2 PHE 56 31.887 42.045 39.103 406 HB3 PHE 56 HB3 PHE 56 30.742 41.663 38.115 407 HD1 PHE 56 HD1 PHE 56 34.243 41.030 38.596 408 HD2 PHE 56 HD2 PHE 56 30.822 39.591 36.982 409 HE1 PHE 56 HE1 PHE 56 35.311 39.016 38.159 410 HE2 PHE 56 HE2 PHE 56 31.882 37.536 36.599 411 HZ PHE 56 HZ PHE 56 34.135 37.255 37.158 412 H LEU 57 H LEU 57 29.947 44.115 36.076 413 HA LEU 57 HA LEU 57 29.027 45.895 37.833 414 HB2 LEU 57 HB2 LEU 57 28.472 46.010 35.527 415 HB3 LEU 57 HB3 LEU 57 27.692 44.666 35.647 416 HG LEU 57 HG LEU 57 26.140 45.706 37.079 417 HD11 LEU 57 HD11 LEU 57 26.087 48.060 37.284 418 HD12 LEU 57 HD12 LEU 57 27.413 47.477 37.926 419 HD13 LEU 57 HD13 LEU 57 27.456 48.150 36.492 420 HD21 LEU 57 HD21 LEU 57 25.035 46.992 35.374 421 HD22 LEU 57 HD22 LEU 57 26.386 47.020 34.547 422 HD23 LEU 57 HD23 LEU 57 25.614 45.653 34.756 423 H ASN 58 H ASN 58 28.761 42.541 37.726 424 HA ASN 58 HA ASN 58 26.618 42.104 39.280 425 HB2 ASN 58 HB2 ASN 58 27.423 40.695 37.446 426 HB3 ASN 58 HB3 ASN 58 28.593 40.264 38.382 427 HD21 ASN 58 HD21 ASN 58 25.009 38.884 39.075 428 HD22 ASN 58 HD22 ASN 58 25.158 40.226 38.446 429 H ASP 59 H ASP 59 29.375 43.279 40.239 430 HA ASP 59 HA ASP 59 30.085 42.397 42.558 431 HB2 ASP 59 HB2 ASP 59 31.260 44.011 41.222 432 HB3 ASP 59 HB3 ASP 59 30.115 45.041 41.466 433 H LYS 60 H LYS 60 27.085 43.621 42.009 434 HA LYS 60 HA LYS 60 26.375 44.845 44.208 435 HB2 LYS 60 HB2 LYS 60 25.250 44.849 42.020 436 HB3 LYS 60 HB3 LYS 60 24.671 43.451 42.397 437 HG2 LYS 60 HG2 LYS 60 23.438 44.440 44.173 438 HG3 LYS 60 HG3 LYS 60 24.016 45.838 43.795 439 HD2 LYS 60 HD2 LYS 60 22.970 45.650 41.631 440 HD3 LYS 60 HD3 LYS 60 22.337 44.297 42.077 441 HE2 LYS 60 HE2 LYS 60 20.633 45.732 42.435 442 HE3 LYS 60 HE3 LYS 60 21.231 45.593 43.868 443 HZ1 LYS 60 HZ1 LYS 60 20.908 47.781 43.367 444 HZ2 LYS 60 HZ2 LYS 60 22.334 47.567 43.541 445 HZ3 LYS 60 HZ3 LYS 60 21.778 47.697 42.205 446 H ASP 61 H ASP 61 26.741 41.474 43.856 447 HA ASP 61 HA ASP 61 26.721 41.347 46.550 448 HB2 ASP 61 HB2 ASP 61 24.646 40.355 45.727 449 HB3 ASP 61 HB3 ASP 61 25.515 39.236 45.075 450 H GLU 62 H GLU 62 28.715 40.499 47.320 451 HA GLU 62 HA GLU 62 30.663 39.723 45.880 452 HB2 GLU 62 HB2 GLU 62 30.255 38.982 48.606 453 HB3 GLU 62 HB3 GLU 62 31.644 38.893 47.904 454 HG2 GLU 62 HG2 GLU 62 32.030 40.798 48.881 455 HG3 GLU 62 HG3 GLU 62 31.239 41.413 47.687 456 H ASP 63 H ASP 63 28.226 37.701 47.175 457 HA ASP 63 HA ASP 63 29.117 35.265 46.815 458 HB2 ASP 63 HB2 ASP 63 27.304 35.875 48.255 459 HB3 ASP 63 HB3 ASP 63 26.467 36.319 47.016 460 H ALA 64 H ALA 64 27.397 37.242 44.576 461 HA ALA 64 HA ALA 64 27.069 35.472 42.637 462 HB1 ALA 64 HB1 ALA 64 26.260 37.370 41.456 463 HB2 ALA 64 HB2 ALA 64 25.593 37.308 42.892 464 HB3 ALA 64 HB3 ALA 64 26.788 38.310 42.616 465 H VAL 65 H VAL 65 29.552 37.835 43.070 466 HA VAL 65 HA VAL 65 30.891 37.482 40.861 467 HB VAL 65 HB VAL 65 31.874 38.464 43.311 468 HG11 VAL 65 HG11 VAL 65 33.681 39.427 42.124 469 HG12 VAL 65 HG12 VAL 65 33.712 37.849 41.995 470 HG13 VAL 65 HG13 VAL 65 33.167 38.730 40.798 471 HG21 VAL 65 HG21 VAL 65 31.599 40.629 42.325 472 HG22 VAL 65 HG22 VAL 65 31.016 39.943 41.022 473 HG23 VAL 65 HG23 VAL 65 30.208 39.875 42.383 474 H LYS 66 H LYS 66 31.336 35.846 43.920 475 HA LYS 66 HA LYS 66 33.354 34.266 43.393 476 HB2 LYS 66 HB2 LYS 66 32.647 34.639 45.585 477 HB3 LYS 66 HB3 LYS 66 31.266 33.977 45.287 478 HG2 LYS 66 HG2 LYS 66 32.138 31.875 45.272 479 HG3 LYS 66 HG3 LYS 66 33.588 32.388 45.010 480 HD2 LYS 66 HD2 LYS 66 33.252 31.582 47.253 481 HD3 LYS 66 HD3 LYS 66 33.875 33.010 47.195 482 HE2 LYS 66 HE2 LYS 66 31.758 33.961 47.649 483 HE3 LYS 66 HE3 LYS 66 31.119 32.539 47.680 484 HZ1 LYS 66 HZ1 LYS 66 31.554 33.244 49.793 485 HZ2 LYS 66 HZ2 LYS 66 32.374 32.073 49.532 486 HZ3 LYS 66 HZ3 LYS 66 32.969 33.398 49.504 487 H ALA 67 H ALA 67 30.012 33.460 42.838 488 HA ALA 67 HA ALA 67 30.321 31.101 41.788 489 HB1 ALA 67 HB1 ALA 67 28.116 31.406 40.986 490 HB2 ALA 67 HB2 ALA 67 28.209 31.845 42.505 491 HB3 ALA 67 HB3 ALA 67 28.197 32.941 41.362 492 H GLY 68 H GLY 68 30.353 34.131 40.087 493 HA2 GLY 68 HA2 GLY 68 30.653 33.370 37.630 494 HA3 GLY 68 HA3 GLY 68 31.052 34.772 38.185 495 H ILE 69 H ILE 69 33.252 34.208 39.848 496 HA ILE 69 HA ILE 69 35.328 33.757 38.342 497 HB ILE 69 HB ILE 69 35.089 33.863 41.128 498 HG12 ILE 69 HG12 ILE 69 34.893 35.961 40.016 499 HG13 ILE 69 HG13 ILE 69 36.075 35.974 41.033 500 HG21 ILE 69 HG21 ILE 69 37.435 33.894 41.399 501 HG22 ILE 69 HG22 ILE 69 36.940 32.502 40.826 502 HG23 ILE 69 HG23 ILE 69 37.601 33.568 39.858 503 HD11 ILE 69 HD11 ILE 69 36.728 37.045 39.065 504 HD12 ILE 69 HD12 ILE 69 37.615 35.748 39.264 505 HD13 ILE 69 HD13 ILE 69 36.415 35.735 38.231 506 H LYS 70 H LYS 70 33.734 31.444 40.442 507 HA LYS 70 HA LYS 70 35.292 29.391 40.089 508 HB2 LYS 70 HB2 LYS 70 33.640 29.495 41.837 509 HB3 LYS 70 HB3 LYS 70 32.522 29.285 40.771 510 HG2 LYS 70 HG2 LYS 70 33.422 27.162 40.230 511 HG3 LYS 70 HG3 LYS 70 34.562 27.373 41.273 512 HD2 LYS 70 HD2 LYS 70 31.838 27.026 41.968 513 HD3 LYS 70 HD3 LYS 70 32.923 25.916 42.119 514 HE2 LYS 70 HE2 LYS 70 34.042 27.441 43.694 515 HE3 LYS 70 HE3 LYS 70 32.711 28.255 43.699 516 HZ1 LYS 70 HZ1 LYS 70 32.719 26.764 45.407 517 HZ2 LYS 70 HZ2 LYS 70 31.643 26.404 44.499 518 HZ3 LYS 70 HZ3 LYS 70 32.883 25.646 44.495 519 H ALA 71 H ALA 71 32.518 30.210 38.169 520 HA ALA 71 HA ALA 71 32.549 28.168 36.501 521 HB1 ALA 71 HB1 ALA 71 30.936 29.457 35.336 522 HB2 ALA 71 HB2 ALA 71 30.593 29.437 36.882 523 HB3 ALA 71 HB3 ALA 71 31.289 30.707 36.242 524 H LEU 72 H LEU 72 34.009 31.278 36.121 525 HA LEU 72 HA LEU 72 34.987 31.067 33.682 526 HB2 LEU 72 HB2 LEU 72 34.607 33.161 34.665 527 HB3 LEU 72 HB3 LEU 72 35.572 32.824 35.844 528 HG LEU 72 HG LEU 72 37.399 32.954 34.425 529 HD11 LEU 72 HD11 LEU 72 37.227 33.743 32.213 530 HD12 LEU 72 HD12 LEU 72 36.486 32.352 32.371 531 HD13 LEU 72 HD13 LEU 72 35.649 33.695 32.330 532 HD21 LEU 72 HD21 LEU 72 37.322 35.330 34.026 533 HD22 LEU 72 HD22 LEU 72 35.752 35.291 34.234 534 HD23 LEU 72 HD23 LEU 72 36.719 34.996 35.453 535 H GLN 73 H GLN 73 36.579 30.290 36.689 536 HA GLN 73 HA GLN 73 38.897 29.549 35.622 537 HB2 GLN 73 HB2 GLN 73 38.613 30.291 37.896 538 HB3 GLN 73 HB3 GLN 73 37.989 28.897 38.213 539 HG2 GLN 73 HG2 GLN 73 40.227 28.826 38.848 540 HG3 GLN 73 HG3 GLN 73 40.050 27.848 37.646 541 HE21 GLN 73 HE21 GLN 73 41.573 28.097 35.988 542 HE22 GLN 73 HE22 GLN 73 42.335 29.343 35.695 543 H GLU 74 H GLU 74 36.097 27.587 36.318 544 HA GLU 74 HA GLU 74 37.072 25.311 35.500 545 HB2 GLU 74 HB2 GLU 74 34.387 26.138 35.825 546 HB3 GLU 74 HB3 GLU 74 34.673 24.742 35.190 547 HG2 GLU 74 HG2 GLU 74 35.908 24.154 37.179 548 HG3 GLU 74 HG3 GLU 74 35.459 25.506 37.813 549 H ALA 75 H ALA 75 36.244 27.905 33.531 550 HA ALA 75 HA ALA 75 36.227 26.519 31.226 551 HB1 ALA 75 HB1 ALA 75 35.447 28.588 30.285 552 HB2 ALA 75 HB2 ALA 75 34.506 28.135 31.477 553 HB3 ALA 75 HB3 ALA 75 35.590 29.266 31.710 554 H SER 76 H SER 76 38.780 27.621 32.826 555 HA SER 76 HA SER 76 39.987 29.234 31.291 556 HB2 SER 76 HB2 SER 76 41.891 28.893 32.679 557 HB3 SER 76 HB3 SER 76 40.628 28.894 33.595 558 HG SER 76 HG SER 76 40.819 26.843 33.880 559 H GLY 77 H GLY 77 40.250 25.830 30.906 560 HA2 GLY 77 HA2 GLY 77 42.326 25.663 29.316 561 HA3 GLY 77 HA3 GLY 77 41.248 24.555 29.518 562 H PHE 78 H PHE 78 38.926 25.708 28.501 563 HA PHE 78 HA PHE 78 39.071 25.575 25.920 564 HB2 PHE 78 HB2 PHE 78 36.902 26.876 27.154 565 HB3 PHE 78 HB3 PHE 78 36.854 26.009 25.859 566 HD1 PHE 78 HD1 PHE 78 35.910 25.974 29.035 567 HD2 PHE 78 HD2 PHE 78 37.479 23.409 26.339 568 HE1 PHE 78 HE1 PHE 78 35.212 24.178 30.358 569 HE2 PHE 78 HE2 PHE 78 36.726 21.600 27.626 570 HZ PHE 78 HZ PHE 78 35.603 21.991 29.641 571 H ILE 79 H ILE 79 38.982 28.401 27.928 572 HA ILE 79 HA ILE 79 38.958 30.343 26.194 573 HB ILE 79 HB ILE 79 39.758 30.362 28.904 574 HG12 ILE 79 HG12 ILE 79 37.309 31.305 27.796 575 HG13 ILE 79 HG13 ILE 79 37.431 29.898 28.460 576 HG21 ILE 79 HG21 ILE 79 39.648 32.712 28.883 577 HG22 ILE 79 HG22 ILE 79 40.777 32.204 27.895 578 HG23 ILE 79 HG23 ILE 79 39.381 32.684 27.323 579 HD11 ILE 79 HD11 ILE 79 36.441 31.390 29.971 580 HD12 ILE 79 HD12 ILE 79 37.831 30.909 30.558 581 HD13 ILE 79 HD13 ILE 79 37.708 32.337 29.885 582 H ARG 80 H ARG 80 41.790 28.871 27.632 583 HA ARG 80 HA ARG 80 43.698 30.150 26.391 584 HB2 ARG 80 HB2 ARG 80 44.328 28.935 28.203 585 HB3 ARG 80 HB3 ARG 80 43.596 27.652 27.701 586 HG2 ARG 80 HG2 ARG 80 45.243 27.259 26.103 587 HG3 ARG 80 HG3 ARG 80 45.913 28.638 26.390 588 HD2 ARG 80 HD2 ARG 80 47.121 26.816 27.357 589 HD3 ARG 80 HD3 ARG 80 46.757 27.913 28.404 590 HE ARG 80 HE ARG 80 45.579 26.431 29.487 591 HH11 ARG 80 HH11 ARG 80 44.748 24.492 30.041 592 HH12 ARG 80 HH12 ARG 80 44.543 23.435 29.011 593 HH21 ARG 80 HH21 ARG 80 45.741 24.995 26.496 594 HH22 ARG 80 HH22 ARG 80 45.116 23.725 26.962 595 H SER 81 H SER 81 42.127 27.267 25.238 596 HA SER 81 HA SER 81 43.504 26.968 23.025 597 HB2 SER 81 HB2 SER 81 42.129 25.258 24.123 598 HB3 SER 81 HB3 SER 81 40.904 25.908 23.408 599 HG SER 81 HG SER 81 41.757 24.294 22.185 600 H LEU 82 H LEU 82 40.530 28.730 23.439 601 HA LEU 82 HA LEU 82 40.164 29.538 20.998 602 HB2 LEU 82 HB2 LEU 82 39.232 30.665 23.446 603 HB3 LEU 82 HB3 LEU 82 38.783 31.257 22.075 604 HG LEU 82 HG LEU 82 38.109 28.673 22.985 605 HD11 LEU 82 HD11 LEU 82 35.880 29.560 23.132 606 HD12 LEU 82 HD12 LEU 82 36.857 30.393 24.059 607 HD13 LEU 82 HD13 LEU 82 36.426 30.964 22.646 608 HD21 LEU 82 HD21 LEU 82 36.708 28.412 21.140 609 HD22 LEU 82 HD22 LEU 82 37.226 29.790 20.557 610 HD23 LEU 82 HD23 LEU 82 38.217 28.561 20.682 611 H LEU 83 H LEU 83 42.022 31.083 23.476 612 HA LEU 83 HA LEU 83 42.650 33.360 22.318 613 HB2 LEU 83 HB2 LEU 83 42.747 33.008 24.658 614 HB3 LEU 83 HB3 LEU 83 43.917 31.995 24.455 615 HG LEU 83 HG LEU 83 45.284 33.773 23.690 616 HD11 LEU 83 HD11 LEU 83 44.619 35.994 24.020 617 HD12 LEU 83 HD12 LEU 83 43.672 35.285 22.967 618 HD13 LEU 83 HD13 LEU 83 43.181 35.496 24.459 619 HD21 LEU 83 HD21 LEU 83 45.645 34.707 25.849 620 HD22 LEU 83 HD22 LEU 83 44.242 34.142 26.316 621 HD23 LEU 83 HD23 LEU 83 45.420 33.144 25.966 622 H GLY 84 H GLY 84 44.509 30.424 22.412 623 HA2 GLY 84 HA2 GLY 84 46.568 31.037 20.963 624 HA3 GLY 84 HA3 GLY 84 46.042 29.586 21.187 625 H LYS 85 H LYS 85 43.491 29.847 19.853 626 HA LYS 85 HA LYS 85 43.979 29.694 17.244 627 HB2 LYS 85 HB2 LYS 85 42.294 28.390 18.339 628 HB3 LYS 85 HB3 LYS 85 41.481 29.693 18.615 629 HG2 LYS 85 HG2 LYS 85 40.922 29.950 16.413 630 HG3 LYS 85 HG3 LYS 85 42.066 29.006 15.930 631 HD2 LYS 85 HD2 LYS 85 40.036 27.887 15.690 632 HD3 LYS 85 HD3 LYS 85 40.904 27.130 16.743 633 HE2 LYS 85 HE2 LYS 85 38.718 27.198 17.526 634 HE3 LYS 85 HE3 LYS 85 39.597 28.051 18.491 635 HZ1 LYS 85 HZ1 LYS 85 37.706 29.192 17.944 636 HZ2 LYS 85 HZ2 LYS 85 38.843 29.934 17.426 637 HZ3 LYS 85 HZ3 LYS 85 38.024 29.138 16.527 638 H ALA 86 H ALA 86 42.519 32.299 19.006 639 HA ALA 86 HA ALA 86 41.885 33.788 16.931 640 HB1 ALA 86 HB1 ALA 86 41.318 35.402 18.616 641 HB2 ALA 86 HB2 ALA 86 40.705 33.990 18.988 642 HB3 ALA 86 HB3 ALA 86 42.025 34.492 19.703 643 H MET 87 H MET 87 44.748 33.927 18.852 644 HA MET 87 HA MET 87 45.822 35.938 17.466 645 HB2 MET 87 HB2 MET 87 46.799 34.601 19.771 646 HB3 MET 87 HB3 MET 87 47.647 35.697 19.056 647 HG2 MET 87 HG2 MET 87 45.727 37.197 19.491 648 HG3 MET 87 HG3 MET 87 45.270 36.113 20.516 649 HE1 MET 87 HE1 MET 87 46.456 38.782 22.873 650 HE2 MET 87 HE2 MET 87 45.653 38.958 21.519 651 HE3 MET 87 HE3 MET 87 45.265 37.798 22.525 652 H ARG 88 H ARG 88 45.713 32.863 16.560 653 HA ARG 88 HA ARG 88 46.909 31.382 15.578 654 HB2 ARG 88 HB2 ARG 88 47.842 33.684 14.209 655 HB3 ARG 88 HB3 ARG 88 48.112 32.238 13.691 656 HG2 ARG 88 HG2 ARG 88 45.822 31.893 13.299 657 HG3 ARG 88 HG3 ARG 88 45.466 33.257 13.967 658 HD2 ARG 88 HD2 ARG 88 45.381 33.539 11.647 659 HD3 ARG 88 HD3 ARG 88 46.544 34.417 12.202 660 HE ARG 88 HE ARG 88 47.144 31.967 11.114 661 HH11 ARG 88 HH11 ARG 88 48.748 31.797 9.604 662 HH12 ARG 88 HH12 ARG 88 49.460 33.016 9.125 663 HH21 ARG 88 HH21 ARG 88 47.875 35.196 10.847 664 HH22 ARG 88 HH22 ARG 88 48.955 34.981 9.844 665 H LEU 89 H LEU 89 47.987 31.497 18.023 666 HA LEU 89 HA LEU 89 50.537 32.420 18.110 667 HB2 LEU 89 HB2 LEU 89 48.763 33.213 19.579 668 HB3 LEU 89 HB3 LEU 89 48.763 31.801 20.240 669 HG LEU 89 HG LEU 89 50.990 32.208 20.968 670 HD11 LEU 89 HD11 LEU 89 51.777 34.430 21.040 671 HD12 LEU 89 HD12 LEU 89 51.607 33.956 19.538 672 HD13 LEU 89 HD13 LEU 89 50.518 34.896 20.200 673 HD21 LEU 89 HD21 LEU 89 50.293 33.644 22.781 674 HD22 LEU 89 HD22 LEU 89 49.015 34.054 21.939 675 HD23 LEU 89 HD23 LEU 89 49.165 32.574 22.480 676 H ARG 90 H ARG 90 52.386 31.272 18.741 677 HA ARG 90 HA ARG 90 52.344 28.611 18.376 678 HB2 ARG 90 HB2 ARG 90 53.935 30.107 17.298 679 HB3 ARG 90 HB3 ARG 90 54.621 30.280 18.688 680 HG2 ARG 90 HG2 ARG 90 55.408 28.121 18.674 681 HG3 ARG 90 HG3 ARG 90 54.477 27.720 17.489 682 HD2 ARG 90 HD2 ARG 90 56.592 27.995 16.568 683 HD3 ARG 90 HD3 ARG 90 55.739 29.194 16.048 684 HE ARG 90 HE ARG 90 57.224 29.723 18.259 685 HH11 ARG 90 HH11 ARG 90 58.809 31.242 18.276 686 HH12 ARG 90 HH12 ARG 90 59.214 31.922 17.015 687 HH21 ARG 90 HH21 ARG 90 57.228 30.393 15.003 688 HH22 ARG 90 HH22 ARG 90 58.294 31.428 15.112 689 H ILE 91 H ILE 91 53.100 30.531 21.130 690 HA ILE 91 HA ILE 91 52.580 28.440 22.743 691 HB ILE 91 HB ILE 91 54.044 29.404 24.378 692 HG12 ILE 91 HG12 ILE 91 55.628 30.479 22.339 693 HG13 ILE 91 HG13 ILE 91 54.524 31.378 22.975 694 HG21 ILE 91 HG21 ILE 91 55.905 28.119 23.573 695 HG22 ILE 91 HG22 ILE 91 54.551 27.317 23.393 696 HG23 ILE 91 HG23 ILE 91 55.212 28.045 22.151 697 HD11 ILE 91 HD11 ILE 91 56.572 31.755 24.083 698 HD12 ILE 91 HD12 ILE 91 55.539 31.134 25.110 699 HD13 ILE 91 HD13 ILE 91 56.660 30.221 24.463 700 H VAL 92 H VAL 92 50.651 28.823 23.854 701 HA VAL 92 HA VAL 92 49.908 31.312 24.643 702 HB VAL 92 HB VAL 92 48.407 30.297 23.231 703 HG11 VAL 92 HG11 VAL 92 47.078 28.466 23.884 704 HG12 VAL 92 HG12 VAL 92 48.599 28.054 23.738 705 HG13 VAL 92 HG13 VAL 92 47.979 28.294 25.174 706 HG21 VAL 92 HG21 VAL 92 46.422 30.717 24.475 707 HG22 VAL 92 HG22 VAL 92 47.286 30.745 25.803 708 HG23 VAL 92 HG23 VAL 92 47.490 31.864 24.701 709 HA PRO 93 HA PRO 93 50.671 30.179 28.763 710 HB2 PRO 93 HB2 PRO 93 49.445 32.491 29.734 711 HB3 PRO 93 HB3 PRO 93 50.954 32.120 29.879 712 HG2 PRO 93 HG2 PRO 93 50.275 34.009 28.267 713 HG3 PRO 93 HG3 PRO 93 51.516 33.128 27.925 714 HD2 PRO 93 HD2 PRO 93 48.897 32.829 26.873 715 HD3 PRO 93 HD3 PRO 93 50.231 32.713 26.074 716 H GLU 94 H GLU 94 49.677 29.157 30.592 717 HA GLU 94 HA GLU 94 47.060 28.546 30.568 718 HB2 GLU 94 HB2 GLU 94 48.771 27.012 31.227 719 HB3 GLU 94 HB3 GLU 94 49.031 27.892 32.488 720 HG2 GLU 94 HG2 GLU 94 47.755 26.367 33.438 721 HG3 GLU 94 HG3 GLU 94 46.621 27.346 33.003 722 H LEU 95 H LEU 95 45.374 29.394 31.919 723 HA LEU 95 HA LEU 95 45.882 31.919 32.727 724 HB2 LEU 95 HB2 LEU 95 43.423 30.959 31.642 725 HB3 LEU 95 HB3 LEU 95 43.740 32.464 31.901 726 HG LEU 95 HG LEU 95 44.998 30.922 29.899 727 HD11 LEU 95 HD11 LEU 95 43.747 32.219 28.330 728 HD12 LEU 95 HD12 LEU 95 42.768 31.423 29.286 729 HD13 LEU 95 HD13 LEU 95 43.038 32.964 29.534 730 HD21 LEU 95 HD21 LEU 95 45.955 32.916 29.074 731 HD22 LEU 95 HD22 LEU 95 45.323 33.710 30.291 732 HD23 LEU 95 HD23 LEU 95 46.452 32.629 30.550 733 H THR 96 H THR 96 45.370 32.674 34.777 734 HA THR 96 HA THR 96 43.530 31.416 36.314 735 HB THR 96 HB THR 96 45.833 32.673 37.296 736 HG1 THR 96 HG1 THR 96 46.319 30.570 37.948 737 HG21 THR 96 HG21 THR 96 45.221 31.897 39.465 738 HG22 THR 96 HG22 THR 96 44.113 32.879 38.902 739 HG23 THR 96 HG23 THR 96 43.878 31.313 38.862 740 H PHE 97 H PHE 97 41.864 32.741 37.255 741 HA PHE 97 HA PHE 97 41.769 35.346 36.505 742 HB2 PHE 97 HB2 PHE 97 39.576 33.548 36.728 743 HB3 PHE 97 HB3 PHE 97 39.405 35.051 36.350 744 HD1 PHE 97 HD1 PHE 97 40.000 35.840 34.084 745 HD2 PHE 97 HD2 PHE 97 40.394 31.928 35.030 746 HE1 PHE 97 HE1 PHE 97 40.290 35.322 31.828 747 HE2 PHE 97 HE2 PHE 97 40.742 31.420 32.782 748 HZ PHE 97 HZ PHE 97 40.673 33.108 31.175 749 H PHE 98 H PHE 98 41.199 36.991 37.920 750 HA PHE 98 HA PHE 98 40.595 36.544 40.531 751 HB2 PHE 98 HB2 PHE 98 42.610 38.295 39.560 752 HB3 PHE 98 HB3 PHE 98 42.117 38.352 41.038 753 HD1 PHE 98 HD1 PHE 98 42.951 36.757 42.677 754 HD2 PHE 98 HD2 PHE 98 44.068 36.429 38.807 755 HE1 PHE 98 HE1 PHE 98 44.657 35.280 43.301 756 HE2 PHE 98 HE2 PHE 98 45.729 34.915 39.410 757 HZ PHE 98 HZ PHE 98 46.018 34.316 41.646 758 H TYR 99 H TYR 99 39.244 38.181 41.568 759 HA TYR 99 HA TYR 99 37.816 39.787 39.950 760 HB2 TYR 99 HB2 TYR 99 36.237 39.902 41.668 761 HB3 TYR 99 HB3 TYR 99 36.498 38.423 41.247 762 HD1 TYR 99 HD1 TYR 99 36.354 40.506 43.971 763 HD2 TYR 99 HD2 TYR 99 37.980 36.983 42.805 764 HE1 TYR 99 HE1 TYR 99 36.678 39.915 46.206 765 HE2 TYR 99 HE2 TYR 99 38.362 36.422 45.046 766 HH TYR 99 HH TYR 99 38.078 37.001 47.211 767 H ASP 100 H ASP 100 37.791 42.061 39.996 768 HA ASP 100 HA ASP 100 39.389 43.468 41.707 769 HB2 ASP 100 HB2 ASP 100 40.661 42.963 39.774 770 HB3 ASP 100 HB3 ASP 100 39.519 43.498 38.857 Start of MODEL 4 1 HA PRO 8 HA PRO 8 57.253 43.557 25.904 2 HB2 PRO 8 HB2 PRO 8 56.495 41.133 26.058 3 HB3 PRO 8 HB3 PRO 8 58.011 41.415 25.835 4 HG2 PRO 8 HG2 PRO 8 56.770 40.761 28.309 5 HG3 PRO 8 HG3 PRO 8 58.129 40.202 27.782 6 HD2 PRO 8 HD2 PRO 8 58.100 42.173 29.464 7 HD3 PRO 8 HD3 PRO 8 59.277 42.022 28.453 8 H GLN 9 H GLN 9 55.953 45.332 27.118 9 HA GLN 9 HA GLN 9 53.554 44.916 28.086 10 HB2 GLN 9 HB2 GLN 9 54.812 46.859 28.533 11 HB3 GLN 9 HB3 GLN 9 54.726 47.273 27.032 12 HG2 GLN 9 HG2 GLN 9 52.308 47.082 28.454 13 HG3 GLN 9 HG3 GLN 9 53.191 48.342 28.712 14 HE21 GLN 9 HE21 GLN 9 51.049 49.298 27.869 15 HE22 GLN 9 HE22 GLN 9 50.964 49.602 26.414 16 H ARG 10 H ARG 10 54.411 45.069 24.790 17 HA ARG 10 HA ARG 10 52.171 45.631 23.630 18 HB2 ARG 10 HB2 ARG 10 54.368 44.065 22.709 19 HB3 ARG 10 HB3 ARG 10 53.154 44.323 21.765 20 HG2 ARG 10 HG2 ARG 10 53.614 46.603 21.670 21 HG3 ARG 10 HG3 ARG 10 54.668 46.490 22.813 22 HD2 ARG 10 HD2 ARG 10 55.046 45.313 20.253 23 HD3 ARG 10 HD3 ARG 10 55.694 46.673 20.660 24 HE ARG 10 HE ARG 10 56.486 44.238 21.620 25 HH11 ARG 10 HH11 ARG 10 58.373 43.968 22.662 26 HH12 ARG 10 HH12 ARG 10 59.332 45.096 22.816 27 HH21 ARG 10 HH21 ARG 10 57.591 47.396 21.463 28 HH22 ARG 10 HH22 ARG 10 58.884 47.067 22.127 29 H VAL 11 H VAL 11 53.238 42.493 24.614 30 HA VAL 11 HA VAL 11 51.316 40.967 23.753 31 HB VAL 11 HB VAL 11 52.922 40.387 25.979 32 HG11 VAL 11 HG11 VAL 11 52.621 38.085 25.322 33 HG12 VAL 11 HG12 VAL 11 51.218 38.767 25.600 34 HG13 VAL 11 HG13 VAL 11 51.723 38.571 24.111 35 HG21 VAL 11 HG21 VAL 11 54.531 39.367 24.576 36 HG22 VAL 11 HG22 VAL 11 53.732 39.882 23.309 37 HG23 VAL 11 HG23 VAL 11 54.429 40.919 24.281 38 H ALA 12 H ALA 12 51.609 42.518 26.858 39 HA ALA 12 HA ALA 12 49.496 41.504 28.051 40 HB1 ALA 12 HB1 ALA 12 49.979 43.160 29.690 41 HB2 ALA 12 HB2 ALA 12 51.313 42.417 29.269 42 HB3 ALA 12 HB3 ALA 12 50.986 43.852 28.683 43 H GLN 13 H GLN 13 49.617 44.401 26.141 44 HA GLN 13 HA GLN 13 47.095 45.095 26.550 45 HB2 GLN 13 HB2 GLN 13 48.957 46.070 24.655 46 HB3 GLN 13 HB3 GLN 13 47.501 46.626 24.713 47 HG2 GLN 13 HG2 GLN 13 49.375 46.875 26.829 48 HG3 GLN 13 HG3 GLN 13 48.978 48.047 25.878 49 HE21 GLN 13 HE21 GLN 13 48.710 48.357 28.619 50 HE22 GLN 13 HE22 GLN 13 47.277 48.433 29.017 51 H GLU 14 H GLU 14 48.496 43.223 23.971 52 HA GLU 14 HA GLU 14 46.370 42.927 22.483 53 HB2 GLU 14 HB2 GLU 14 48.755 41.395 22.654 54 HB3 GLU 14 HB3 GLU 14 47.632 40.966 21.661 55 HG2 GLU 14 HG2 GLU 14 48.657 43.587 21.445 56 HG3 GLU 14 HG3 GLU 14 49.482 42.425 20.811 57 H MET 15 H MET 15 47.461 40.910 25.075 58 HA MET 15 HA MET 15 45.719 38.992 25.028 59 HB2 MET 15 HB2 MET 15 47.422 39.897 27.107 60 HB3 MET 15 HB3 MET 15 46.494 38.662 27.326 61 HG2 MET 15 HG2 MET 15 48.337 38.624 25.185 62 HG3 MET 15 HG3 MET 15 48.835 38.237 26.611 63 HE1 MET 15 HE1 MET 15 48.835 34.922 24.681 64 HE2 MET 15 HE2 MET 15 49.140 36.353 24.075 65 HE3 MET 15 HE3 MET 15 49.765 35.932 25.469 66 H GLN 16 H GLN 16 45.479 41.975 26.875 67 HA GLN 16 HA GLN 16 43.328 41.586 28.174 68 HB2 GLN 16 HB2 GLN 16 44.473 43.977 27.216 69 HB3 GLN 16 HB3 GLN 16 43.041 44.077 27.825 70 HG2 GLN 16 HG2 GLN 16 43.852 43.271 29.899 71 HG3 GLN 16 HG3 GLN 16 45.283 43.128 29.294 72 HE21 GLN 16 HE21 GLN 16 46.650 44.894 29.562 73 HE22 GLN 16 HE22 GLN 16 46.221 46.288 29.864 74 H LYS 17 H LYS 17 43.401 43.008 24.970 75 HA LYS 17 HA LYS 17 40.825 43.405 24.614 76 HB2 LYS 17 HB2 LYS 17 42.484 44.628 23.453 77 HB3 LYS 17 HB3 LYS 17 42.956 43.330 22.729 78 HG2 LYS 17 HG2 LYS 17 40.935 43.243 21.509 79 HG3 LYS 17 HG3 LYS 17 40.400 44.493 22.273 80 HD2 LYS 17 HD2 LYS 17 41.977 45.880 21.259 81 HD3 LYS 17 HD3 LYS 17 42.739 44.658 20.662 82 HE2 LYS 17 HE2 LYS 17 40.711 44.185 19.373 83 HE3 LYS 17 HE3 LYS 17 40.203 45.594 19.811 84 HZ1 LYS 17 HZ1 LYS 17 41.219 45.728 17.779 85 HZ2 LYS 17 HZ2 LYS 17 41.992 46.519 18.720 86 HZ3 LYS 17 HZ3 LYS 17 42.466 45.207 18.313 87 H GLU 18 H GLU 18 42.658 40.691 23.557 88 HA GLU 18 HA GLU 18 40.763 39.447 22.204 89 HB2 GLU 18 HB2 GLU 18 43.217 39.191 21.968 90 HB3 GLU 18 HB3 GLU 18 43.148 38.257 23.214 91 HG2 GLU 18 HG2 GLU 18 43.113 36.774 21.541 92 HG3 GLU 18 HG3 GLU 18 41.596 36.885 21.886 93 H ILE 19 H ILE 19 41.861 38.862 25.455 94 HA ILE 19 HA ILE 19 40.349 36.791 26.031 95 HB ILE 19 HB ILE 19 41.802 38.474 27.764 96 HG12 ILE 19 HG12 ILE 19 42.463 35.806 26.971 97 HG13 ILE 19 HG13 ILE 19 43.095 37.051 26.275 98 HG21 ILE 19 HG21 ILE 19 41.495 36.889 29.497 99 HG22 ILE 19 HG22 ILE 19 40.102 37.496 29.053 100 HG23 ILE 19 HG23 ILE 19 40.532 36.056 28.556 101 HD11 ILE 19 HD11 ILE 19 44.617 36.166 27.820 102 HD12 ILE 19 HD12 ILE 19 44.206 37.624 28.279 103 HD13 ILE 19 HD13 ILE 19 43.565 36.361 28.987 104 H ALA 20 H ALA 20 39.837 40.164 26.682 105 HA ALA 20 HA ALA 20 37.611 40.180 27.979 106 HB1 ALA 20 HB1 ALA 20 37.474 42.429 27.200 107 HB2 ALA 20 HB2 ALA 20 38.955 42.117 27.670 108 HB3 ALA 20 HB3 ALA 20 38.597 42.118 26.127 109 H LEU 21 H LEU 21 37.901 39.934 24.528 110 HA LEU 21 HA LEU 21 35.295 39.736 24.006 111 HB2 LEU 21 HB2 LEU 21 36.871 40.564 22.425 112 HB3 LEU 21 HB3 LEU 21 37.519 39.148 22.345 113 HG LEU 21 HG LEU 21 35.615 38.281 21.362 114 HD11 LEU 21 HD11 LEU 21 33.777 39.604 20.711 115 HD12 LEU 21 HD12 LEU 21 33.915 39.581 22.288 116 HD13 LEU 21 HD13 LEU 21 34.408 40.843 21.468 117 HD21 LEU 21 HD21 LEU 21 35.733 39.498 19.293 118 HD22 LEU 21 HD22 LEU 21 36.444 40.688 20.059 119 HD23 LEU 21 HD23 LEU 21 37.187 39.300 19.889 120 H ILE 22 H ILE 22 37.566 37.111 24.479 121 HA ILE 22 HA ILE 22 35.936 35.173 23.844 122 HB ILE 22 HB ILE 22 38.245 34.999 25.447 123 HG12 ILE 22 HG12 ILE 22 38.044 34.174 22.725 124 HG13 ILE 22 HG13 ILE 22 38.496 35.625 23.072 125 HG21 ILE 22 HG21 ILE 22 38.216 32.656 25.082 126 HG22 ILE 22 HG22 ILE 22 36.916 33.102 25.870 127 HG23 ILE 22 HG23 ILE 22 36.836 32.799 24.318 128 HD11 ILE 22 HD11 ILE 22 40.387 34.304 22.635 129 HD12 ILE 22 HD12 ILE 22 40.430 34.780 24.145 130 HD13 ILE 22 HD13 ILE 22 39.971 33.306 23.793 131 H LEU 23 H LEU 23 36.293 36.653 26.934 132 HA LEU 23 HA LEU 23 34.661 35.299 28.424 133 HB2 LEU 23 HB2 LEU 23 35.907 37.799 28.617 134 HB3 LEU 23 HB3 LEU 23 34.653 37.631 29.527 135 HG LEU 23 HG LEU 23 35.633 35.870 30.653 136 HD11 LEU 23 HD11 LEU 23 37.838 35.154 30.321 137 HD12 LEU 23 HD12 LEU 23 36.941 34.853 29.051 138 HD13 LEU 23 HD13 LEU 23 37.936 36.086 29.045 139 HD21 LEU 23 HD21 LEU 23 37.437 37.056 31.727 140 HD22 LEU 23 HD22 LEU 23 37.449 38.079 30.518 141 HD23 LEU 23 HD23 LEU 23 36.203 38.021 31.494 142 H GLN 24 H GLN 24 33.728 37.627 26.128 143 HA GLN 24 HA GLN 24 31.117 37.542 26.703 144 HB2 GLN 24 HB2 GLN 24 32.559 38.952 24.658 145 HB3 GLN 24 HB3 GLN 24 31.011 39.088 24.790 146 HG2 GLN 24 HG2 GLN 24 31.204 40.176 26.833 147 HG3 GLN 24 HG3 GLN 24 32.726 39.852 26.920 148 HE21 GLN 24 HE21 GLN 24 31.699 42.445 27.132 149 HE22 GLN 24 HE22 GLN 24 32.230 43.284 26.022 150 H ARG 25 H ARG 25 33.030 35.781 24.521 151 HA ARG 25 HA ARG 25 31.063 35.196 22.815 152 HB2 ARG 25 HB2 ARG 25 33.882 34.902 22.553 153 HB3 ARG 25 HB3 ARG 25 32.940 34.275 21.480 154 HG2 ARG 25 HG2 ARG 25 33.189 37.059 21.951 155 HG3 ARG 25 HG3 ARG 25 33.796 36.321 20.717 156 HD2 ARG 25 HD2 ARG 25 31.067 36.886 21.134 157 HD3 ARG 25 HD3 ARG 25 31.943 37.401 19.952 158 HE ARG 25 HE ARG 25 31.153 34.780 20.119 159 HH11 ARG 25 HH11 ARG 25 30.192 33.839 18.405 160 HH12 ARG 25 HH12 ARG 25 30.359 34.412 17.040 161 HH21 ARG 25 HH21 ARG 25 31.989 37.066 17.888 162 HH22 ARG 25 HH22 ARG 25 31.419 36.315 16.735 163 H GLU 26 H GLU 26 33.109 33.210 24.806 164 HA GLU 26 HA GLU 26 31.912 30.932 23.947 165 HB2 GLU 26 HB2 GLU 26 34.308 30.996 23.976 166 HB3 GLU 26 HB3 GLU 26 34.266 31.143 25.528 167 HG2 GLU 26 HG2 GLU 26 34.733 28.930 25.103 168 HG3 GLU 26 HG3 GLU 26 33.285 28.968 25.683 169 H ILE 27 H ILE 27 32.134 32.706 26.854 170 HA ILE 27 HA ILE 27 30.229 31.209 28.092 171 HB ILE 27 HB ILE 27 30.980 31.955 30.133 172 HG12 ILE 27 HG12 ILE 27 33.218 33.073 28.855 173 HG13 ILE 27 HG13 ILE 27 32.055 33.924 29.452 174 HG21 ILE 27 HG21 ILE 27 32.845 30.509 30.263 175 HG22 ILE 27 HG22 ILE 27 31.680 29.840 29.426 176 HG23 ILE 27 HG23 ILE 27 32.922 30.481 28.681 177 HD11 ILE 27 HD11 ILE 27 33.856 33.903 30.954 178 HD12 ILE 27 HD12 ILE 27 32.615 33.186 31.628 179 HD13 ILE 27 HD13 ILE 27 33.797 32.322 31.022 180 H LYS 28 H LYS 28 28.372 32.303 29.077 181 HA LYS 28 HA LYS 28 27.526 34.194 27.322 182 HB2 LYS 28 HB2 LYS 28 25.985 32.472 28.969 183 HB3 LYS 28 HB3 LYS 28 25.377 33.420 27.890 184 HG2 LYS 28 HG2 LYS 28 26.301 32.159 26.154 185 HG3 LYS 28 HG3 LYS 28 27.153 31.318 27.154 186 HD2 LYS 28 HD2 LYS 28 25.111 30.377 28.026 187 HD3 LYS 28 HD3 LYS 28 24.325 31.138 26.915 188 HE2 LYS 28 HE2 LYS 28 25.498 29.933 25.234 189 HE3 LYS 28 HE3 LYS 28 26.338 29.204 26.326 190 HZ1 LYS 28 HZ1 LYS 28 24.633 27.876 25.638 191 HZ2 LYS 28 HZ2 LYS 28 24.425 28.185 27.043 192 HZ3 LYS 28 HZ3 LYS 28 23.642 28.865 26.025 193 H ASP 29 H ASP 29 28.164 36.231 28.084 194 HA ASP 29 HA ASP 29 28.188 36.833 30.628 195 HB2 ASP 29 HB2 ASP 29 29.677 37.731 28.823 196 HB3 ASP 29 HB3 ASP 29 28.576 38.822 28.652 197 HA PRO 30 HA PRO 30 24.222 39.260 30.041 198 HB2 PRO 30 HB2 PRO 30 22.697 37.125 28.934 199 HB3 PRO 30 HB3 PRO 30 22.428 38.649 28.735 200 HG2 PRO 30 HG2 PRO 30 23.598 37.466 26.817 201 HG3 PRO 30 HG3 PRO 30 24.163 38.868 27.200 202 HD2 PRO 30 HD2 PRO 30 25.228 36.351 27.995 203 HD3 PRO 30 HD3 PRO 30 26.050 37.587 27.516 204 H ARG 31 H ARG 31 24.515 36.044 31.188 205 HA ARG 31 HA ARG 31 23.004 36.123 33.324 206 HB2 ARG 31 HB2 ARG 31 23.954 34.114 32.411 207 HB3 ARG 31 HB3 ARG 31 25.363 34.575 32.895 208 HG2 ARG 31 HG2 ARG 31 24.794 34.275 35.110 209 HG3 ARG 31 HG3 ARG 31 23.283 34.113 34.762 210 HD2 ARG 31 HD2 ARG 31 23.998 31.992 35.205 211 HD3 ARG 31 HD3 ARG 31 23.838 32.034 33.654 212 HE ARG 31 HE ARG 31 26.290 32.549 33.877 213 HH11 ARG 31 HH11 ARG 31 28.066 31.208 34.082 214 HH12 ARG 31 HH12 ARG 31 27.904 29.846 34.663 215 HH21 ARG 31 HH21 ARG 31 24.751 29.984 35.259 216 HH22 ARG 31 HH22 ARG 31 25.968 29.129 35.352 217 H LEU 32 H LEU 32 25.972 37.606 32.923 218 HA LEU 32 HA LEU 32 26.200 38.629 35.422 219 HB2 LEU 32 HB2 LEU 32 28.171 38.334 33.404 220 HB3 LEU 32 HB3 LEU 32 28.462 39.031 34.768 221 HG LEU 32 HG LEU 32 27.773 36.301 34.609 222 HD11 LEU 32 HD11 LEU 32 30.077 35.804 34.905 223 HD12 LEU 32 HD12 LEU 32 29.862 36.607 33.557 224 HD13 LEU 32 HD13 LEU 32 30.407 37.352 34.843 225 HD21 LEU 32 HD21 LEU 32 28.619 36.141 36.816 226 HD22 LEU 32 HD22 LEU 32 28.930 37.694 36.800 227 HD23 LEU 32 HD23 LEU 32 27.431 37.187 36.761 228 H GLY 33 H GLY 33 24.540 39.721 33.051 229 HA2 GLY 33 HA2 GLY 33 23.651 41.655 32.719 230 HA3 GLY 33 HA3 GLY 33 24.779 42.326 33.560 231 H MET 34 H MET 34 26.012 40.495 30.996 232 HA MET 34 HA MET 34 27.297 40.952 29.348 233 HB2 MET 34 HB2 MET 34 25.074 41.314 28.457 234 HB3 MET 34 HB3 MET 34 25.354 42.842 28.590 235 HG2 MET 34 HG2 MET 34 25.754 42.214 26.395 236 HG3 MET 34 HG3 MET 34 27.100 42.683 27.027 237 HE1 MET 34 HE1 MET 34 28.762 40.357 24.806 238 HE2 MET 34 HE2 MET 34 27.696 41.495 24.530 239 HE3 MET 34 HE3 MET 34 28.868 41.741 25.567 240 H MET 35 H MET 35 28.033 42.337 31.761 241 HA MET 35 HA MET 35 29.776 44.178 30.857 242 HB2 MET 35 HB2 MET 35 27.718 45.336 31.429 243 HB3 MET 35 HB3 MET 35 28.038 44.994 32.917 244 HG2 MET 35 HG2 MET 35 28.783 47.184 32.328 245 HG3 MET 35 HG3 MET 35 29.940 46.308 32.900 246 HE1 MET 35 HE1 MET 35 31.766 48.540 30.502 247 HE2 MET 35 HE2 MET 35 30.531 48.915 31.420 248 HE3 MET 35 HE3 MET 35 31.705 48.024 31.998 249 H THR 36 H THR 36 30.399 41.616 31.768 250 HA THR 36 HA THR 36 32.133 42.052 33.784 251 HB THR 36 HB THR 36 32.112 39.829 32.097 252 HG1 THR 36 HG1 THR 36 30.403 39.250 33.034 253 HG21 THR 36 HG21 THR 36 33.132 38.670 33.892 254 HG22 THR 36 HG22 THR 36 34.021 39.905 33.452 255 HG23 THR 36 HG23 THR 36 33.114 40.003 34.747 256 H THR 37 H THR 37 34.250 42.887 33.456 257 HA THR 37 HA THR 37 35.271 43.210 30.941 258 HB THR 37 HB THR 37 35.084 45.186 32.918 259 HG1 THR 37 HG1 THR 37 33.895 46.224 31.307 260 HG21 THR 37 HG21 THR 37 36.127 46.743 31.487 261 HG22 THR 37 HG22 THR 37 37.120 45.569 31.868 262 HG23 THR 37 HG23 THR 37 36.412 45.580 30.451 263 H VAL 38 H VAL 38 37.619 43.011 30.732 264 HA VAL 38 HA VAL 38 39.071 42.176 32.843 265 HB VAL 38 HB VAL 38 39.812 42.343 30.154 266 HG11 VAL 38 HG11 VAL 38 41.799 41.144 30.693 267 HG12 VAL 38 HG12 VAL 38 41.775 42.546 31.428 268 HG13 VAL 38 HG13 VAL 38 41.414 41.226 32.227 269 HG21 VAL 38 HG21 VAL 38 39.769 39.953 30.176 270 HG22 VAL 38 HG22 VAL 38 39.279 39.996 31.682 271 HG23 VAL 38 HG23 VAL 38 38.340 40.539 30.528 272 H SER 39 H SER 39 39.952 43.812 34.200 273 HA SER 39 HA SER 39 40.393 46.272 33.315 274 HB2 SER 39 HB2 SER 39 40.703 46.859 35.591 275 HB3 SER 39 HB3 SER 39 39.396 46.016 35.467 276 HG SER 39 HG SER 39 41.043 45.391 37.013 277 H GLY 40 H GLY 40 42.483 43.688 33.805 278 HA2 GLY 40 HA2 GLY 40 44.585 44.701 32.682 279 HA3 GLY 40 HA3 GLY 40 44.802 44.773 34.224 280 H VAL 41 H VAL 41 46.583 43.223 32.901 281 HA VAL 41 HA VAL 41 46.147 40.709 33.773 282 HB VAL 41 HB VAL 41 47.349 39.797 32.027 283 HG11 VAL 41 HG11 VAL 41 45.674 39.974 30.335 284 HG12 VAL 41 HG12 VAL 41 45.014 39.782 31.761 285 HG13 VAL 41 HG13 VAL 41 45.063 41.219 31.099 286 HG21 VAL 41 HG21 VAL 41 47.820 41.034 30.059 287 HG22 VAL 41 HG22 VAL 41 47.336 42.351 30.793 288 HG23 VAL 41 HG23 VAL 41 48.637 41.598 31.294 289 H GLU 42 H GLU 42 48.170 39.497 34.555 290 HA GLU 42 HA GLU 42 50.530 40.845 34.306 291 HB2 GLU 42 HB2 GLU 42 49.869 40.749 36.615 292 HB3 GLU 42 HB3 GLU 42 50.049 39.202 36.548 293 HG2 GLU 42 HG2 GLU 42 52.336 39.446 36.061 294 HG3 GLU 42 HG3 GLU 42 52.182 40.996 35.979 295 H MET 43 H MET 43 51.859 39.800 32.826 296 HA MET 43 HA MET 43 51.320 37.290 32.017 297 HB2 MET 43 HB2 MET 43 52.943 39.267 30.755 298 HB3 MET 43 HB3 MET 43 52.575 37.909 30.084 299 HG2 MET 43 HG2 MET 43 50.736 40.001 30.589 300 HG3 MET 43 HG3 MET 43 51.272 39.620 29.176 301 HE1 MET 43 HE1 MET 43 49.593 36.300 28.424 302 HE2 MET 43 HE2 MET 43 50.590 37.388 27.848 303 HE3 MET 43 HE3 MET 43 51.013 36.506 29.094 304 H SER 44 H SER 44 52.784 35.488 32.251 305 HA SER 44 HA SER 44 55.103 35.713 33.527 306 HB2 SER 44 HB2 SER 44 53.691 33.701 33.394 307 HB3 SER 44 HB3 SER 44 54.340 33.457 31.997 308 HG SER 44 HG SER 44 55.907 32.654 32.959 309 H ARG 45 H ARG 45 57.295 35.713 32.671 310 HA ARG 45 HA ARG 45 57.783 36.855 30.336 311 HB2 ARG 45 HB2 ARG 45 59.101 37.094 32.376 312 HB3 ARG 45 HB3 ARG 45 59.688 35.679 32.086 313 HG2 ARG 45 HG2 ARG 45 60.654 36.481 30.071 314 HG3 ARG 45 HG3 ARG 45 60.043 37.892 30.331 315 HD2 ARG 45 HD2 ARG 45 61.994 36.708 32.029 316 HD3 ARG 45 HD3 ARG 45 62.336 37.810 30.980 317 HE ARG 45 HE ARG 45 60.679 39.053 32.394 318 HH11 ARG 45 HH11 ARG 45 60.889 40.197 34.244 319 HH12 ARG 45 HH12 ARG 45 61.967 39.874 35.221 320 HH21 ARG 45 HH21 ARG 45 63.316 37.440 33.617 321 HH22 ARG 45 HH22 ARG 45 63.387 38.260 34.858 322 H ASP 46 H ASP 46 58.038 33.596 31.271 323 HA ASP 46 HA ASP 46 58.839 32.613 28.941 324 HB2 ASP 46 HB2 ASP 46 58.682 30.518 30.042 325 HB3 ASP 46 HB3 ASP 46 59.530 31.513 30.893 326 H LEU 47 H LEU 47 55.921 33.709 29.629 327 HA LEU 47 HA LEU 47 53.895 33.493 29.080 328 HB2 LEU 47 HB2 LEU 47 55.060 32.625 26.658 329 HB3 LEU 47 HB3 LEU 47 53.566 33.053 26.777 330 HG LEU 47 HG LEU 47 55.639 34.868 27.357 331 HD11 LEU 47 HD11 LEU 47 55.393 35.783 25.174 332 HD12 LEU 47 HD12 LEU 47 55.882 34.279 25.087 333 HD13 LEU 47 HD13 LEU 47 54.361 34.634 24.823 334 HD21 LEU 47 HD21 LEU 47 54.003 36.565 27.014 335 HD22 LEU 47 HD22 LEU 47 52.923 35.447 26.710 336 HD23 LEU 47 HD23 LEU 47 53.538 35.581 28.164 337 H ALA 48 H ALA 48 54.967 31.063 30.485 338 HA ALA 48 HA ALA 48 53.413 29.040 29.776 339 HB1 ALA 48 HB1 ALA 48 54.270 28.046 31.763 340 HB2 ALA 48 HB2 ALA 48 55.457 28.650 30.906 341 HB3 ALA 48 HB3 ALA 48 54.913 29.436 32.169 342 H TYR 49 H TYR 49 52.855 31.609 31.945 343 HA TYR 49 HA TYR 49 50.352 30.834 32.611 344 HB2 TYR 49 HB2 TYR 49 51.984 31.930 34.633 345 HB3 TYR 49 HB3 TYR 49 50.689 31.086 34.840 346 HD1 TYR 49 HD1 TYR 49 51.020 28.527 33.917 347 HD2 TYR 49 HD2 TYR 49 53.940 30.908 35.417 348 HE1 TYR 49 HE1 TYR 49 52.416 26.673 34.176 349 HE2 TYR 49 HE2 TYR 49 55.274 29.031 35.791 350 HH TYR 49 HH TYR 49 55.527 26.805 35.486 351 H ALA 50 H ALA 50 48.821 32.623 33.059 352 HA ALA 50 HA ALA 50 49.752 35.142 33.295 353 HB1 ALA 50 HB1 ALA 50 48.172 35.992 31.759 354 HB2 ALA 50 HB2 ALA 50 49.179 35.013 31.027 355 HB3 ALA 50 HB3 ALA 50 47.726 34.512 31.412 356 H LYS 51 H LYS 51 48.724 36.408 34.853 357 HA LYS 51 HA LYS 51 46.481 35.665 36.107 358 HB2 LYS 51 HB2 LYS 51 47.934 38.029 36.636 359 HB3 LYS 51 HB3 LYS 51 46.843 37.416 37.565 360 HG2 LYS 51 HG2 LYS 51 48.313 35.579 38.019 361 HG3 LYS 51 HG3 LYS 51 49.412 36.278 37.161 362 HD2 LYS 51 HD2 LYS 51 49.331 38.156 38.698 363 HD3 LYS 51 HD3 LYS 51 48.357 37.330 39.593 364 HE2 LYS 51 HE2 LYS 51 50.351 36.937 40.575 365 HE3 LYS 51 HE3 LYS 51 50.139 35.645 39.728 366 HZ1 LYS 51 HZ1 LYS 51 52.237 36.429 39.415 367 HZ2 LYS 51 HZ2 LYS 51 51.539 36.527 38.144 368 HZ3 LYS 51 HZ3 LYS 51 51.748 37.717 38.951 369 H VAL 52 H VAL 52 44.393 36.579 35.577 370 HA VAL 52 HA VAL 52 44.199 38.809 34.038 371 HB VAL 52 HB VAL 52 42.308 36.760 34.097 372 HG11 VAL 52 HG11 VAL 52 41.297 37.861 32.221 373 HG12 VAL 52 HG12 VAL 52 41.309 38.814 33.487 374 HG13 VAL 52 HG13 VAL 52 42.382 39.009 32.337 375 HG21 VAL 52 HG21 VAL 52 42.980 36.180 31.872 376 HG22 VAL 52 HG22 VAL 52 44.142 37.252 31.964 377 HG23 VAL 52 HG23 VAL 52 44.174 35.966 32.889 378 H TYR 53 H TYR 53 43.335 40.598 35.171 379 HA TYR 53 HA TYR 53 41.872 40.334 37.415 380 HB2 TYR 53 HB2 TYR 53 43.004 42.666 36.300 381 HB3 TYR 53 HB3 TYR 53 42.155 42.680 37.609 382 HD1 TYR 53 HD1 TYR 53 43.121 41.146 39.551 383 HD2 TYR 53 HD2 TYR 53 45.344 42.647 36.526 384 HE1 TYR 53 HE1 TYR 53 45.051 40.890 40.844 385 HE2 TYR 53 HE2 TYR 53 47.274 42.392 37.815 386 HH TYR 53 HH TYR 53 48.148 41.797 39.812 387 H VAL 54 H VAL 54 39.616 40.664 37.448 388 HA VAL 54 HA VAL 54 38.289 41.456 35.217 389 HB VAL 54 HB VAL 54 37.519 39.262 36.773 390 HG11 VAL 54 HG11 VAL 54 36.006 38.740 34.972 391 HG12 VAL 54 HG12 VAL 54 35.694 40.177 35.560 392 HG13 VAL 54 HG13 VAL 54 36.506 40.034 34.208 393 HG21 VAL 54 HG21 VAL 54 38.198 37.802 34.987 394 HG22 VAL 54 HG22 VAL 54 38.784 39.054 34.215 395 HG23 VAL 54 HG23 VAL 54 39.445 38.580 35.573 396 H THR 55 H THR 55 36.331 42.623 35.579 397 HA THR 55 HA THR 55 35.600 43.342 38.095 398 HB THR 55 HB THR 55 37.102 44.890 37.307 399 HG1 THR 55 HG1 THR 55 35.837 45.908 38.624 400 HG21 THR 55 HG21 THR 55 36.564 46.495 35.694 401 HG22 THR 55 HG22 THR 55 36.731 45.054 35.058 402 HG23 THR 55 HG23 THR 55 35.283 45.649 35.304 403 H PHE 56 H PHE 56 33.383 43.563 38.430 404 HA PHE 56 HA PHE 56 31.777 42.660 36.436 405 HB2 PHE 56 HB2 PHE 56 31.814 41.848 39.166 406 HB3 PHE 56 HB3 PHE 56 30.687 41.391 38.191 407 HD1 PHE 56 HD1 PHE 56 34.206 40.976 38.716 408 HD2 PHE 56 HD2 PHE 56 30.941 39.363 36.955 409 HE1 PHE 56 HE1 PHE 56 35.412 39.029 38.287 410 HE2 PHE 56 HE2 PHE 56 32.141 37.397 36.561 411 HZ PHE 56 HZ PHE 56 34.365 37.223 37.239 412 H LEU 57 H LEU 57 29.756 43.682 36.036 413 HA LEU 57 HA LEU 57 28.530 45.428 37.616 414 HB2 LEU 57 HB2 LEU 57 27.969 45.301 35.374 415 HB3 LEU 57 HB3 LEU 57 27.603 43.791 35.501 416 HG LEU 57 HG LEU 57 26.057 45.606 36.948 417 HD11 LEU 57 HD11 LEU 57 24.620 45.929 35.035 418 HD12 LEU 57 HD12 LEU 57 26.069 46.488 34.722 419 HD13 LEU 57 HD13 LEU 57 25.628 45.074 34.163 420 HD21 LEU 57 HD21 LEU 57 24.272 44.101 36.562 421 HD22 LEU 57 HD22 LEU 57 25.233 43.203 35.680 422 HD23 LEU 57 HD23 LEU 57 25.492 43.348 37.235 423 H ASN 58 H ASN 58 28.652 42.065 37.782 424 HA ASN 58 HA ASN 58 26.622 41.517 39.449 425 HB2 ASN 58 HB2 ASN 58 27.482 40.108 37.624 426 HB3 ASN 58 HB3 ASN 58 28.728 39.831 38.520 427 HD21 ASN 58 HD21 ASN 58 25.348 38.061 39.348 428 HD22 ASN 58 HD22 ASN 58 25.325 39.381 38.658 429 H ASP 59 H ASP 59 29.404 42.909 40.220 430 HA ASP 59 HA ASP 59 30.290 42.001 42.458 431 HB2 ASP 59 HB2 ASP 59 31.424 43.630 41.154 432 HB3 ASP 59 HB3 ASP 59 30.271 44.653 41.392 433 H LYS 60 H LYS 60 27.279 43.368 42.160 434 HA LYS 60 HA LYS 60 26.874 44.430 44.546 435 HB2 LYS 60 HB2 LYS 60 25.601 44.768 42.409 436 HB3 LYS 60 HB3 LYS 60 24.769 43.536 42.877 437 HG2 LYS 60 HG2 LYS 60 24.076 44.688 44.815 438 HG3 LYS 60 HG3 LYS 60 24.996 45.895 44.460 439 HD2 LYS 60 HD2 LYS 60 23.656 46.355 42.533 440 HD3 LYS 60 HD3 LYS 60 22.740 45.141 42.878 441 HE2 LYS 60 HE2 LYS 60 22.240 46.208 44.993 442 HE3 LYS 60 HE3 LYS 60 23.023 47.461 44.495 443 HZ1 LYS 60 HZ1 LYS 60 20.797 47.735 44.126 444 HZ2 LYS 60 HZ2 LYS 60 21.465 47.708 42.836 445 HZ3 LYS 60 HZ3 LYS 60 20.736 46.541 43.301 446 H ASP 61 H ASP 61 27.038 41.138 43.937 447 HA ASP 61 HA ASP 61 26.814 40.739 46.605 448 HB2 ASP 61 HB2 ASP 61 24.844 39.814 45.581 449 HB3 ASP 61 HB3 ASP 61 25.760 38.816 44.808 450 H GLU 62 H GLU 62 28.703 39.823 47.470 451 HA GLU 62 HA GLU 62 30.825 39.434 46.054 452 HB2 GLU 62 HB2 GLU 62 30.461 38.629 48.764 453 HB3 GLU 62 HB3 GLU 62 31.861 38.763 48.091 454 HG2 GLU 62 HG2 GLU 62 31.830 40.679 49.192 455 HG3 GLU 62 HG3 GLU 62 31.221 41.173 47.844 456 H ASP 63 H ASP 63 28.776 36.969 47.328 457 HA ASP 63 HA ASP 63 30.135 34.832 46.627 458 HB2 ASP 63 HB2 ASP 63 28.547 34.805 48.409 459 HB3 ASP 63 HB3 ASP 63 27.397 34.958 47.368 460 H ALA 64 H ALA 64 27.828 36.640 44.851 461 HA ALA 64 HA ALA 64 27.439 35.037 42.792 462 HB1 ALA 64 HB1 ALA 64 26.544 36.929 41.752 463 HB2 ALA 64 HB2 ALA 64 25.955 36.776 43.214 464 HB3 ALA 64 HB3 ALA 64 27.097 37.835 42.927 465 H VAL 65 H VAL 65 29.821 37.608 43.128 466 HA VAL 65 HA VAL 65 31.086 37.145 40.879 467 HB VAL 65 HB VAL 65 32.020 38.539 43.132 468 HG11 VAL 65 HG11 VAL 65 33.821 39.358 41.824 469 HG12 VAL 65 HG12 VAL 65 33.929 37.784 41.969 470 HG13 VAL 65 HG13 VAL 65 33.374 38.420 40.629 471 HG21 VAL 65 HG21 VAL 65 31.649 40.461 41.726 472 HG22 VAL 65 HG22 VAL 65 31.176 39.497 40.561 473 HG23 VAL 65 HG23 VAL 65 30.302 39.640 41.874 474 H LYS 66 H LYS 66 31.723 35.717 44.022 475 HA LYS 66 HA LYS 66 33.870 34.311 43.434 476 HB2 LYS 66 HB2 LYS 66 33.137 34.791 45.652 477 HB3 LYS 66 HB3 LYS 66 31.977 33.765 45.463 478 HG2 LYS 66 HG2 LYS 66 33.732 32.818 46.711 479 HG3 LYS 66 HG3 LYS 66 33.468 31.989 45.416 480 HD2 LYS 66 HD2 LYS 66 35.388 32.780 44.404 481 HD3 LYS 66 HD3 LYS 66 35.553 33.919 45.456 482 HE2 LYS 66 HE2 LYS 66 36.155 32.394 47.120 483 HE3 LYS 66 HE3 LYS 66 35.779 31.184 46.211 484 HZ1 LYS 66 HZ1 LYS 66 38.029 31.483 46.217 485 HZ2 LYS 66 HZ2 LYS 66 37.550 31.713 44.865 486 HZ3 LYS 66 HZ3 LYS 66 37.900 32.840 45.712 487 H ALA 67 H ALA 67 30.569 33.311 43.056 488 HA ALA 67 HA ALA 67 30.982 30.988 41.928 489 HB1 ALA 67 HB1 ALA 67 28.692 31.152 41.332 490 HB2 ALA 67 HB2 ALA 67 28.888 31.536 42.856 491 HB3 ALA 67 HB3 ALA 67 28.697 32.674 41.771 492 H GLY 68 H GLY 68 30.761 34.085 40.389 493 HA2 GLY 68 HA2 GLY 68 30.854 33.469 37.867 494 HA3 GLY 68 HA3 GLY 68 31.313 34.834 38.466 495 H ILE 69 H ILE 69 33.572 34.166 39.932 496 HA ILE 69 HA ILE 69 35.624 33.763 38.371 497 HB ILE 69 HB ILE 69 35.392 33.825 41.149 498 HG12 ILE 69 HG12 ILE 69 35.151 35.929 40.122 499 HG13 ILE 69 HG13 ILE 69 36.320 35.920 41.154 500 HG21 ILE 69 HG21 ILE 69 37.771 33.877 41.374 501 HG22 ILE 69 HG22 ILE 69 37.281 32.494 40.777 502 HG23 ILE 69 HG23 ILE 69 37.901 33.594 39.821 503 HD11 ILE 69 HD11 ILE 69 36.967 37.125 39.254 504 HD12 ILE 69 HD12 ILE 69 37.893 35.848 39.389 505 HD13 ILE 69 HD13 ILE 69 36.706 35.857 38.341 506 H LYS 70 H LYS 70 34.081 31.400 40.479 507 HA LYS 70 HA LYS 70 35.573 29.322 39.894 508 HB2 LYS 70 HB2 LYS 70 32.996 29.483 41.055 509 HB3 LYS 70 HB3 LYS 70 33.615 28.085 40.751 510 HG2 LYS 70 HG2 LYS 70 35.449 28.567 42.167 511 HG3 LYS 70 HG3 LYS 70 34.880 29.993 42.440 512 HD2 LYS 70 HD2 LYS 70 33.591 27.623 43.334 513 HD3 LYS 70 HD3 LYS 70 34.468 28.515 44.264 514 HE2 LYS 70 HE2 LYS 70 32.906 30.332 43.844 515 HE3 LYS 70 HE3 LYS 70 31.987 29.298 43.123 516 HZ1 LYS 70 HZ1 LYS 70 31.321 29.569 45.272 517 HZ2 LYS 70 HZ2 LYS 70 31.762 28.195 45.110 518 HZ3 LYS 70 HZ3 LYS 70 32.619 29.158 45.780 519 H ALA 71 H ALA 71 32.597 30.223 38.301 520 HA ALA 71 HA ALA 71 32.516 28.295 36.521 521 HB1 ALA 71 HB1 ALA 71 30.858 29.666 35.500 522 HB2 ALA 71 HB2 ALA 71 30.600 29.579 37.061 523 HB3 ALA 71 HB3 ALA 71 31.284 30.867 36.440 524 H LEU 72 H LEU 72 34.131 31.302 36.259 525 HA LEU 72 HA LEU 72 34.995 31.215 33.748 526 HB2 LEU 72 HB2 LEU 72 34.671 33.228 34.916 527 HB3 LEU 72 HB3 LEU 72 35.716 32.796 35.991 528 HG LEU 72 HG LEU 72 37.432 33.027 34.441 529 HD11 LEU 72 HD11 LEU 72 37.073 34.018 32.345 530 HD12 LEU 72 HD12 LEU 72 36.320 32.628 32.437 531 HD13 LEU 72 HD13 LEU 72 35.511 33.979 32.601 532 HD21 LEU 72 HD21 LEU 72 37.345 35.430 34.305 533 HD22 LEU 72 HD22 LEU 72 35.796 35.374 34.630 534 HD23 LEU 72 HD23 LEU 72 36.852 34.953 35.732 535 H GLN 73 H GLN 73 36.643 30.260 36.653 536 HA GLN 73 HA GLN 73 38.863 29.393 35.524 537 HB2 GLN 73 HB2 GLN 73 38.554 30.088 37.867 538 HB3 GLN 73 HB3 GLN 73 38.020 28.644 38.112 539 HG2 GLN 73 HG2 GLN 73 40.227 28.587 38.718 540 HG3 GLN 73 HG3 GLN 73 40.147 27.792 37.379 541 HE21 GLN 73 HE21 GLN 73 41.730 28.349 35.882 542 HE22 GLN 73 HE22 GLN 73 42.417 29.668 35.795 543 H GLU 74 H GLU 74 35.973 27.629 36.234 544 HA GLU 74 HA GLU 74 36.767 25.255 35.413 545 HB2 GLU 74 HB2 GLU 74 34.168 26.231 36.022 546 HB3 GLU 74 HB3 GLU 74 34.354 24.775 35.496 547 HG2 GLU 74 HG2 GLU 74 35.772 24.302 37.375 548 HG3 GLU 74 HG3 GLU 74 35.515 25.743 37.912 549 H ALA 75 H ALA 75 35.975 27.827 33.495 550 HA ALA 75 HA ALA 75 35.800 26.425 31.175 551 HB1 ALA 75 HB1 ALA 75 34.980 28.497 30.298 552 HB2 ALA 75 HB2 ALA 75 34.095 28.050 31.532 553 HB3 ALA 75 HB3 ALA 75 35.199 29.171 31.714 554 H SER 76 H SER 76 38.383 27.404 32.733 555 HA SER 76 HA SER 76 39.637 29.111 31.267 556 HB2 SER 76 HB2 SER 76 41.484 28.666 32.679 557 HB3 SER 76 HB3 SER 76 40.209 28.609 33.576 558 HG SER 76 HG SER 76 40.419 26.565 33.758 559 H GLY 77 H GLY 77 39.811 25.700 30.847 560 HA2 GLY 77 HA2 GLY 77 41.801 25.508 29.154 561 HA3 GLY 77 HA3 GLY 77 40.744 24.400 29.449 562 H PHE 78 H PHE 78 38.385 25.865 28.543 563 HA PHE 78 HA PHE 78 38.403 25.706 25.913 564 HB2 PHE 78 HB2 PHE 78 36.434 27.016 27.468 565 HB3 PHE 78 HB3 PHE 78 36.225 26.502 26.011 566 HD1 PHE 78 HD1 PHE 78 34.805 25.861 28.716 567 HD2 PHE 78 HD2 PHE 78 37.176 23.726 26.215 568 HE1 PHE 78 HE1 PHE 78 33.926 23.882 29.565 569 HE2 PHE 78 HE2 PHE 78 36.328 21.750 27.115 570 HZ PHE 78 HZ PHE 78 34.714 21.823 28.795 571 H ILE 79 H ILE 79 38.589 28.481 27.976 572 HA ILE 79 HA ILE 79 38.682 30.438 26.238 573 HB ILE 79 HB ILE 79 39.517 30.402 28.927 574 HG12 ILE 79 HG12 ILE 79 37.122 31.595 27.949 575 HG13 ILE 79 HG13 ILE 79 37.121 30.119 28.452 576 HG21 ILE 79 HG21 ILE 79 39.531 32.769 28.889 577 HG22 ILE 79 HG22 ILE 79 40.610 32.195 27.882 578 HG23 ILE 79 HG23 ILE 79 39.227 32.740 27.335 579 HD11 ILE 79 HD11 ILE 79 36.328 31.527 30.161 580 HD12 ILE 79 HD12 ILE 79 37.680 30.852 30.637 581 HD13 ILE 79 HD13 ILE 79 37.681 32.351 30.126 582 H ARG 80 H ARG 80 41.379 28.751 27.709 583 HA ARG 80 HA ARG 80 43.407 29.927 26.561 584 HB2 ARG 80 HB2 ARG 80 43.731 28.587 28.444 585 HB3 ARG 80 HB3 ARG 80 43.126 27.344 27.723 586 HG2 ARG 80 HG2 ARG 80 45.012 27.219 26.310 587 HG3 ARG 80 HG3 ARG 80 45.612 28.494 26.979 588 HD2 ARG 80 HD2 ARG 80 46.617 26.471 27.756 589 HD3 ARG 80 HD3 ARG 80 46.099 27.380 28.912 590 HE ARG 80 HE ARG 80 44.938 25.689 29.575 591 HH11 ARG 80 HH11 ARG 80 43.919 23.716 29.610 592 HH12 ARG 80 HH12 ARG 80 43.580 23.032 28.331 593 HH21 ARG 80 HH21 ARG 80 44.816 25.158 26.300 594 HH22 ARG 80 HH22 ARG 80 44.096 23.860 26.428 595 H SER 81 H SER 81 41.803 27.073 25.368 596 HA SER 81 HA SER 81 43.324 26.672 23.263 597 HB2 SER 81 HB2 SER 81 41.876 25.021 24.264 598 HB3 SER 81 HB3 SER 81 40.674 25.731 23.570 599 HG SER 81 HG SER 81 41.429 24.089 22.339 600 H LEU 82 H LEU 82 40.348 28.470 23.424 601 HA LEU 82 HA LEU 82 40.224 29.232 20.919 602 HB2 LEU 82 HB2 LEU 82 38.831 30.162 23.211 603 HB3 LEU 82 HB3 LEU 82 38.532 30.752 21.798 604 HG LEU 82 HG LEU 82 38.217 28.006 22.342 605 HD11 LEU 82 HD11 LEU 82 35.871 28.428 22.547 606 HD12 LEU 82 HD12 LEU 82 36.667 29.221 23.662 607 HD13 LEU 82 HD13 LEU 82 36.153 29.976 22.368 608 HD21 LEU 82 HD21 LEU 82 36.874 27.899 20.412 609 HD22 LEU 82 HD22 LEU 82 37.140 29.439 20.152 610 HD23 LEU 82 HD23 LEU 82 38.331 28.401 20.047 611 H LEU 83 H LEU 83 41.781 30.845 23.533 612 HA LEU 83 HA LEU 83 42.487 33.126 22.395 613 HB2 LEU 83 HB2 LEU 83 42.514 32.786 24.724 614 HB3 LEU 83 HB3 LEU 83 43.625 31.702 24.567 615 HG LEU 83 HG LEU 83 45.158 33.377 23.907 616 HD11 LEU 83 HD11 LEU 83 44.628 35.638 24.122 617 HD12 LEU 83 HD12 LEU 83 43.718 34.961 23.017 618 HD13 LEU 83 HD13 LEU 83 43.128 35.254 24.457 619 HD21 LEU 83 HD21 LEU 83 45.402 34.343 26.070 620 HD22 LEU 83 HD22 LEU 83 43.928 33.892 26.427 621 HD23 LEU 83 HD23 LEU 83 45.057 32.803 26.204 622 H GLY 84 H GLY 84 44.339 30.171 22.489 623 HA2 GLY 84 HA2 GLY 84 46.370 30.816 21.014 624 HA3 GLY 84 HA3 GLY 84 45.864 29.357 21.239 625 H LYS 85 H LYS 85 43.303 29.605 19.935 626 HA LYS 85 HA LYS 85 43.748 29.330 17.342 627 HB2 LYS 85 HB2 LYS 85 42.081 28.093 18.500 628 HB3 LYS 85 HB3 LYS 85 41.307 29.412 18.805 629 HG2 LYS 85 HG2 LYS 85 40.208 28.304 17.106 630 HG3 LYS 85 HG3 LYS 85 40.770 29.640 16.531 631 HD2 LYS 85 HD2 LYS 85 42.510 28.494 15.461 632 HD3 LYS 85 HD3 LYS 85 42.067 27.152 16.118 633 HE2 LYS 85 HE2 LYS 85 40.353 28.546 14.336 634 HE3 LYS 85 HE3 LYS 85 41.332 27.450 13.814 635 HZ1 LYS 85 HZ1 LYS 85 39.275 26.563 14.151 636 HZ2 LYS 85 HZ2 LYS 85 40.198 25.917 15.069 637 HZ3 LYS 85 HZ3 LYS 85 39.286 26.939 15.554 638 H ALA 86 H ALA 86 42.387 32.008 19.043 639 HA ALA 86 HA ALA 86 41.706 33.502 16.975 640 HB1 ALA 86 HB1 ALA 86 41.337 35.136 18.662 641 HB2 ALA 86 HB2 ALA 86 40.689 33.761 19.107 642 HB3 ALA 86 HB3 ALA 86 42.080 34.215 19.714 643 H MET 87 H MET 87 44.600 33.613 18.883 644 HA MET 87 HA MET 87 45.719 35.625 17.573 645 HB2 MET 87 HB2 MET 87 46.664 34.007 19.725 646 HB3 MET 87 HB3 MET 87 47.567 35.132 19.131 647 HG2 MET 87 HG2 MET 87 45.920 36.748 19.799 648 HG3 MET 87 HG3 MET 87 45.110 35.601 20.478 649 HE1 MET 87 HE1 MET 87 46.739 37.890 23.202 650 HE2 MET 87 HE2 MET 87 46.442 38.350 21.717 651 HE3 MET 87 HE3 MET 87 45.347 37.547 22.531 652 H ARG 88 H ARG 88 45.587 32.652 16.382 653 HA ARG 88 HA ARG 88 46.750 31.217 15.318 654 HB2 ARG 88 HB2 ARG 88 47.897 33.470 14.075 655 HB3 ARG 88 HB3 ARG 88 47.882 32.034 13.466 656 HG2 ARG 88 HG2 ARG 88 45.486 32.174 13.304 657 HG3 ARG 88 HG3 ARG 88 45.565 33.646 13.810 658 HD2 ARG 88 HD2 ARG 88 45.439 33.783 11.512 659 HD3 ARG 88 HD3 ARG 88 46.899 34.189 11.880 660 HE ARG 88 HE ARG 88 46.745 31.579 11.334 661 HH11 ARG 88 HH11 ARG 88 47.631 30.654 9.559 662 HH12 ARG 88 HH12 ARG 88 48.046 31.489 8.397 663 HH21 ARG 88 HH21 ARG 88 47.160 34.345 9.580 664 HH22 ARG 88 HH22 ARG 88 47.770 33.656 8.409 665 H LEU 89 H LEU 89 47.773 31.148 17.752 666 HA LEU 89 HA LEU 89 50.398 31.909 17.965 667 HB2 LEU 89 HB2 LEU 89 48.908 33.042 19.351 668 HB3 LEU 89 HB3 LEU 89 48.217 31.711 19.776 669 HG LEU 89 HG LEU 89 50.120 31.168 21.075 670 HD11 LEU 89 HD11 LEU 89 51.727 32.823 21.515 671 HD12 LEU 89 HD12 LEU 89 51.741 32.451 19.976 672 HD13 LEU 89 HD13 LEU 89 51.030 33.779 20.462 673 HD21 LEU 89 HD21 LEU 89 49.623 32.744 22.796 674 HD22 LEU 89 HD22 LEU 89 48.904 33.667 21.730 675 HD23 LEU 89 HD23 LEU 89 48.279 32.262 22.110 676 H ARG 90 H ARG 90 52.067 30.563 18.573 677 HA ARG 90 HA ARG 90 51.776 27.931 18.449 678 HB2 ARG 90 HB2 ARG 90 54.117 29.445 19.015 679 HB3 ARG 90 HB3 ARG 90 54.151 27.898 18.823 680 HG2 ARG 90 HG2 ARG 90 53.566 28.099 16.564 681 HG3 ARG 90 HG3 ARG 90 53.285 29.625 16.727 682 HD2 ARG 90 HD2 ARG 90 55.679 29.853 17.296 683 HD3 ARG 90 HD3 ARG 90 55.851 28.402 16.752 684 HE ARG 90 HE ARG 90 54.675 29.737 14.846 685 HH11 ARG 90 HH11 ARG 90 55.579 30.679 13.116 686 HH12 ARG 90 HH12 ARG 90 57.039 30.975 13.085 687 HH21 ARG 90 HH21 ARG 90 57.777 29.847 16.007 688 HH22 ARG 90 HH22 ARG 90 58.330 30.488 14.781 689 H ILE 91 H ILE 91 52.569 29.963 21.129 690 HA ILE 91 HA ILE 91 51.965 28.046 22.936 691 HB ILE 91 HB ILE 91 53.659 29.006 24.342 692 HG12 ILE 91 HG12 ILE 91 55.109 29.992 22.176 693 HG13 ILE 91 HG13 ILE 91 54.020 30.930 22.783 694 HG21 ILE 91 HG21 ILE 91 55.397 27.666 23.327 695 HG22 ILE 91 HG22 ILE 91 54.017 26.890 23.296 696 HG23 ILE 91 HG23 ILE 91 54.546 27.615 21.992 697 HD11 ILE 91 HD11 ILE 91 56.096 31.374 23.817 698 HD12 ILE 91 HD12 ILE 91 55.087 30.817 24.905 699 HD13 ILE 91 HD13 ILE 91 56.193 29.865 24.289 700 H VAL 92 H VAL 92 50.174 28.548 24.086 701 HA VAL 92 HA VAL 92 49.512 31.103 24.748 702 HB VAL 92 HB VAL 92 47.965 29.989 23.471 703 HG11 VAL 92 HG11 VAL 92 46.613 28.276 24.356 704 HG12 VAL 92 HG12 VAL 92 48.117 27.807 24.198 705 HG13 VAL 92 HG13 VAL 92 47.560 28.211 25.624 706 HG21 VAL 92 HG21 VAL 92 46.035 30.572 24.740 707 HG22 VAL 92 HG22 VAL 92 46.949 30.707 26.026 708 HG23 VAL 92 HG23 VAL 92 47.134 31.711 24.814 709 HA PRO 93 HA PRO 93 50.369 30.204 28.913 710 HB2 PRO 93 HB2 PRO 93 49.002 32.473 29.792 711 HB3 PRO 93 HB3 PRO 93 50.533 32.212 29.944 712 HG2 PRO 93 HG2 PRO 93 49.708 33.985 28.271 713 HG3 PRO 93 HG3 PRO 93 51.020 33.199 27.970 714 HD2 PRO 93 HD2 PRO 93 48.451 32.665 26.881 715 HD3 PRO 93 HD3 PRO 93 49.808 32.602 26.117 716 H GLU 94 H GLU 94 49.405 29.143 30.727 717 HA GLU 94 HA GLU 94 46.781 28.581 30.787 718 HB2 GLU 94 HB2 GLU 94 48.511 27.067 31.532 719 HB3 GLU 94 HB3 GLU 94 48.664 27.970 32.794 720 HG2 GLU 94 HG2 GLU 94 47.281 26.318 33.510 721 HG3 GLU 94 HG3 GLU 94 46.304 27.507 33.262 722 H LEU 95 H LEU 95 45.149 29.647 31.985 723 HA LEU 95 HA LEU 95 45.773 32.134 32.855 724 HB2 LEU 95 HB2 LEU 95 43.222 31.253 31.968 725 HB3 LEU 95 HB3 LEU 95 43.629 32.743 32.181 726 HG LEU 95 HG LEU 95 44.626 31.119 30.121 727 HD11 LEU 95 HD11 LEU 95 43.338 32.471 28.620 728 HD12 LEU 95 HD12 LEU 95 42.393 31.736 29.657 729 HD13 LEU 95 HD13 LEU 95 42.759 33.263 29.864 730 HD21 LEU 95 HD21 LEU 95 45.613 33.052 29.165 731 HD22 LEU 95 HD22 LEU 95 45.144 33.894 30.422 732 HD23 LEU 95 HD23 LEU 95 46.229 32.752 30.593 733 H THR 96 H THR 96 45.273 32.929 34.925 734 HA THR 96 HA THR 96 43.478 31.619 36.471 735 HB THR 96 HB THR 96 45.679 32.909 37.587 736 HG1 THR 96 HG1 THR 96 46.343 30.809 38.032 737 HG21 THR 96 HG21 THR 96 45.027 31.844 39.620 738 HG22 THR 96 HG22 THR 96 43.856 32.772 39.096 739 HG23 THR 96 HG23 THR 96 43.786 31.206 38.871 740 H PHE 97 H PHE 97 41.760 32.920 37.275 741 HA PHE 97 HA PHE 97 41.676 35.535 36.552 742 HB2 PHE 97 HB2 PHE 97 39.476 33.778 36.847 743 HB3 PHE 97 HB3 PHE 97 39.358 35.252 36.353 744 HD1 PHE 97 HD1 PHE 97 40.004 35.843 34.028 745 HD2 PHE 97 HD2 PHE 97 40.236 32.005 35.306 746 HE1 PHE 97 HE1 PHE 97 40.249 35.123 31.829 747 HE2 PHE 97 HE2 PHE 97 40.451 31.286 33.103 748 HZ PHE 97 HZ PHE 97 40.475 32.839 31.358 749 H PHE 98 H PHE 98 41.186 37.196 37.965 750 HA PHE 98 HA PHE 98 40.767 36.748 40.605 751 HB2 PHE 98 HB2 PHE 98 42.800 38.450 39.571 752 HB3 PHE 98 HB3 PHE 98 42.471 38.338 41.092 753 HD1 PHE 98 HD1 PHE 98 43.146 36.275 42.351 754 HD2 PHE 98 HD2 PHE 98 44.238 36.797 38.494 755 HE1 PHE 98 HE1 PHE 98 44.734 34.573 42.569 756 HE2 PHE 98 HE2 PHE 98 45.830 35.114 38.717 757 HZ PHE 98 HZ PHE 98 46.107 34.022 40.760 758 H TYR 99 H TYR 99 39.790 38.655 41.771 759 HA TYR 99 HA TYR 99 38.212 40.190 40.231 760 HB2 TYR 99 HB2 TYR 99 36.860 40.521 41.974 761 HB3 TYR 99 HB3 TYR 99 37.247 39.012 42.052 762 HD1 TYR 99 HD1 TYR 99 37.850 42.128 43.614 763 HD2 TYR 99 HD2 TYR 99 38.234 38.124 44.100 764 HE1 TYR 99 HE1 TYR 99 38.618 42.464 45.793 765 HE2 TYR 99 HE2 TYR 99 39.068 38.466 46.261 766 HH TYR 99 HH TYR 99 39.677 40.009 47.832 767 H ASP 100 H ASP 100 38.438 42.419 39.830 768 HA ASP 100 HA ASP 100 39.914 44.004 41.513 769 HB2 ASP 100 HB2 ASP 100 41.181 43.652 39.592 770 HB3 ASP 100 HB3 ASP 100 40.000 44.152 38.705 Start of MODEL 5 1 HA PRO 8 HA PRO 8 56.792 43.558 25.538 2 HB2 PRO 8 HB2 PRO 8 55.619 41.396 24.786 3 HB3 PRO 8 HB3 PRO 8 57.157 41.528 24.564 4 HG2 PRO 8 HG2 PRO 8 55.885 40.142 26.710 5 HG3 PRO 8 HG3 PRO 8 57.103 39.631 25.882 6 HD2 PRO 8 HD2 PRO 8 57.542 40.749 28.162 7 HD3 PRO 8 HD3 PRO 8 58.587 40.938 27.020 8 H GLN 9 H GLN 9 55.550 45.153 26.527 9 HA GLN 9 HA GLN 9 53.291 44.676 27.892 10 HB2 GLN 9 HB2 GLN 9 54.804 46.384 28.555 11 HB3 GLN 9 HB3 GLN 9 54.539 47.134 27.213 12 HG2 GLN 9 HG2 GLN 9 52.403 46.698 29.012 13 HG3 GLN 9 HG3 GLN 9 53.330 47.937 29.208 14 HE21 GLN 9 HE21 GLN 9 50.660 48.339 28.790 15 HE22 GLN 9 HE22 GLN 9 50.415 49.002 27.479 16 H ARG 10 H ARG 10 53.812 45.767 24.648 17 HA ARG 10 HA ARG 10 51.377 46.399 23.990 18 HB2 ARG 10 HB2 ARG 10 53.436 45.458 22.287 19 HB3 ARG 10 HB3 ARG 10 52.085 46.002 21.730 20 HG2 ARG 10 HG2 ARG 10 52.586 48.154 22.578 21 HG3 ARG 10 HG3 ARG 10 53.924 47.616 23.174 22 HD2 ARG 10 HD2 ARG 10 53.400 47.690 20.377 23 HD3 ARG 10 HD3 ARG 10 54.275 48.759 21.102 24 HE ARG 10 HE ARG 10 55.810 47.007 21.541 25 HH11 ARG 10 HH11 ARG 10 57.091 45.508 20.551 26 HH12 ARG 10 HH12 ARG 10 56.698 44.939 19.232 27 HH21 ARG 10 HH21 ARG 10 53.922 46.450 18.851 28 HH22 ARG 10 HH22 ARG 10 54.880 45.478 18.254 29 H VAL 11 H VAL 11 52.907 43.283 23.831 30 HA VAL 11 HA VAL 11 50.983 41.806 22.910 31 HB VAL 11 HB VAL 11 53.121 40.927 24.514 32 HG11 VAL 11 HG11 VAL 11 52.848 38.793 23.521 33 HG12 VAL 11 HG12 VAL 11 51.537 39.214 24.304 34 HG13 VAL 11 HG13 VAL 11 51.591 39.338 22.726 35 HG21 VAL 11 HG21 VAL 11 54.284 40.435 22.476 36 HG22 VAL 11 HG22 VAL 11 53.078 41.056 21.660 37 HG23 VAL 11 HG23 VAL 11 53.976 41.986 22.573 38 H ALA 12 H ALA 12 51.653 42.535 26.283 39 HA ALA 12 HA ALA 12 49.755 41.144 27.419 40 HB1 ALA 12 HB1 ALA 12 50.104 42.580 29.270 41 HB2 ALA 12 HB2 ALA 12 51.495 42.095 28.689 42 HB3 ALA 12 HB3 ALA 12 50.958 43.547 28.352 43 H GLN 13 H GLN 13 49.403 44.353 26.093 44 HA GLN 13 HA GLN 13 46.819 44.599 26.619 45 HB2 GLN 13 HB2 GLN 13 48.471 46.218 25.000 46 HB3 GLN 13 HB3 GLN 13 46.969 46.558 25.255 47 HG2 GLN 13 HG2 GLN 13 48.939 46.466 27.302 48 HG3 GLN 13 HG3 GLN 13 48.361 47.791 26.719 49 HE21 GLN 13 HE21 GLN 13 48.237 46.885 29.500 50 HE22 GLN 13 HE22 GLN 13 46.802 46.883 29.901 51 H GLU 14 H GLU 14 48.270 43.304 23.739 52 HA GLU 14 HA GLU 14 46.142 42.916 22.342 53 HB2 GLU 14 HB2 GLU 14 48.522 41.388 22.316 54 HB3 GLU 14 HB3 GLU 14 47.341 41.024 21.364 55 HG2 GLU 14 HG2 GLU 14 47.511 43.181 20.358 56 HG3 GLU 14 HG3 GLU 14 48.722 43.506 21.285 57 H MET 15 H MET 15 47.508 40.769 24.765 58 HA MET 15 HA MET 15 45.807 38.802 24.777 59 HB2 MET 15 HB2 MET 15 47.556 39.679 26.820 60 HB3 MET 15 HB3 MET 15 46.703 38.384 26.981 61 HG2 MET 15 HG2 MET 15 48.548 38.618 24.856 62 HG3 MET 15 HG3 MET 15 49.015 38.083 26.244 63 HE1 MET 15 HE1 MET 15 49.248 34.988 24.066 64 HE2 MET 15 HE2 MET 15 49.567 36.480 23.641 65 HE3 MET 15 HE3 MET 15 50.061 35.933 25.043 66 H GLN 16 H GLN 16 45.653 41.724 26.708 67 HA GLN 16 HA GLN 16 43.511 41.308 28.103 68 HB2 GLN 16 HB2 GLN 16 45.012 43.079 28.544 69 HB3 GLN 16 HB3 GLN 16 44.520 43.813 27.258 70 HG2 GLN 16 HG2 GLN 16 42.620 43.278 29.264 71 HG3 GLN 16 HG3 GLN 16 43.587 44.481 29.488 72 HE21 GLN 16 HE21 GLN 16 40.879 44.943 29.366 73 HE22 GLN 16 HE22 GLN 16 40.538 45.742 28.155 74 H LYS 17 H LYS 17 43.522 42.867 24.956 75 HA LYS 17 HA LYS 17 40.929 43.172 24.726 76 HB2 LYS 17 HB2 LYS 17 42.620 44.424 23.488 77 HB3 LYS 17 HB3 LYS 17 42.769 43.181 22.558 78 HG2 LYS 17 HG2 LYS 17 40.560 43.409 21.806 79 HG3 LYS 17 HG3 LYS 17 40.283 44.538 22.846 80 HD2 LYS 17 HD2 LYS 17 41.958 45.877 21.641 81 HD3 LYS 17 HD3 LYS 17 41.885 44.801 20.515 82 HE2 LYS 17 HE2 LYS 17 39.537 45.253 20.264 83 HE3 LYS 17 HE3 LYS 17 39.650 46.368 21.349 84 HZ1 LYS 17 HZ1 LYS 17 39.759 47.282 19.276 85 HZ2 LYS 17 HZ2 LYS 17 41.029 47.522 19.940 86 HZ3 LYS 17 HZ3 LYS 17 40.923 46.482 18.931 87 H GLU 18 H GLU 18 42.840 40.509 23.673 88 HA GLU 18 HA GLU 18 41.021 39.261 22.222 89 HB2 GLU 18 HB2 GLU 18 43.564 39.066 22.293 90 HB3 GLU 18 HB3 GLU 18 43.223 37.856 23.216 91 HG2 GLU 18 HG2 GLU 18 43.469 37.057 21.042 92 HG3 GLU 18 HG3 GLU 18 41.977 36.864 21.454 93 H ILE 19 H ILE 19 41.956 38.736 25.496 94 HA ILE 19 HA ILE 19 40.327 36.746 26.136 95 HB ILE 19 HB ILE 19 41.826 38.464 27.791 96 HG12 ILE 19 HG12 ILE 19 42.393 35.736 27.197 97 HG13 ILE 19 HG13 ILE 19 43.078 36.902 26.422 98 HG21 ILE 19 HG21 ILE 19 41.386 37.015 29.599 99 HG22 ILE 19 HG22 ILE 19 40.041 37.663 29.072 100 HG23 ILE 19 HG23 ILE 19 40.409 36.174 28.680 101 HD11 ILE 19 HD11 ILE 19 44.545 36.091 28.064 102 HD12 ILE 19 HD12 ILE 19 44.173 37.592 28.403 103 HD13 ILE 19 HD13 ILE 19 43.478 36.408 29.191 104 H ALA 20 H ALA 20 39.936 40.198 26.530 105 HA ALA 20 HA ALA 20 37.660 40.336 27.720 106 HB1 ALA 20 HB1 ALA 20 37.564 42.531 26.841 107 HB2 ALA 20 HB2 ALA 20 39.011 42.231 27.410 108 HB3 ALA 20 HB3 ALA 20 38.748 42.175 25.850 109 H LEU 21 H LEU 21 38.049 39.814 24.294 110 HA LEU 21 HA LEU 21 35.486 39.770 23.655 111 HB2 LEU 21 HB2 LEU 21 37.272 40.096 22.065 112 HB3 LEU 21 HB3 LEU 21 37.602 38.577 22.187 113 HG LEU 21 HG LEU 21 35.363 38.113 21.407 114 HD11 LEU 21 HD11 LEU 21 34.197 39.805 20.247 115 HD12 LEU 21 HD12 LEU 21 34.348 40.189 21.777 116 HD13 LEU 21 HD13 LEU 21 35.292 40.858 20.696 117 HD21 LEU 21 HD21 LEU 21 35.910 38.493 19.115 118 HD22 LEU 21 HD22 LEU 21 37.052 39.492 19.569 119 HD23 LEU 21 HD23 LEU 21 37.176 37.946 19.893 120 H ILE 22 H ILE 22 37.529 37.037 24.468 121 HA ILE 22 HA ILE 22 35.827 35.146 23.918 122 HB ILE 22 HB ILE 22 38.071 34.941 25.609 123 HG12 ILE 22 HG12 ILE 22 38.045 34.019 22.926 124 HG13 ILE 22 HG13 ILE 22 38.481 35.484 23.236 125 HG21 ILE 22 HG21 ILE 22 37.920 32.572 25.257 126 HG22 ILE 22 HG22 ILE 22 36.602 33.099 25.960 127 HG23 ILE 22 HG23 ILE 22 36.604 32.796 24.406 128 HD11 ILE 22 HD11 ILE 22 40.382 34.135 23.012 129 HD12 ILE 22 HD12 ILE 22 40.312 34.684 24.496 130 HD13 ILE 22 HD13 ILE 22 39.869 33.197 24.181 131 H LEU 23 H LEU 23 36.134 36.821 26.940 132 HA LEU 23 HA LEU 23 34.520 35.482 28.445 133 HB2 LEU 23 HB2 LEU 23 35.636 38.042 28.566 134 HB3 LEU 23 HB3 LEU 23 34.328 37.895 29.403 135 HG LEU 23 HG LEU 23 35.310 36.164 30.644 136 HD11 LEU 23 HD11 LEU 23 37.621 35.702 30.514 137 HD12 LEU 23 HD12 LEU 23 36.900 35.326 29.156 138 HD13 LEU 23 HD13 LEU 23 37.734 36.667 29.265 139 HD21 LEU 23 HD21 LEU 23 36.843 37.539 31.887 140 HD22 LEU 23 HD22 LEU 23 36.881 38.557 30.674 141 HD23 LEU 23 HD23 LEU 23 35.548 38.369 31.508 142 H GLN 24 H GLN 24 33.504 37.694 26.037 143 HA GLN 24 HA GLN 24 30.913 37.626 26.618 144 HB2 GLN 24 HB2 GLN 24 32.178 38.727 24.295 145 HB3 GLN 24 HB3 GLN 24 30.684 38.989 24.655 146 HG2 GLN 24 HG2 GLN 24 31.352 40.241 26.552 147 HG3 GLN 24 HG3 GLN 24 32.849 39.968 26.210 148 HE21 GLN 24 HE21 GLN 24 33.092 42.372 26.134 149 HE22 GLN 24 HE22 GLN 24 32.725 43.124 24.902 150 H ARG 25 H ARG 25 32.850 35.739 24.583 151 HA ARG 25 HA ARG 25 30.948 34.857 22.913 152 HB2 ARG 25 HB2 ARG 25 33.766 34.448 22.797 153 HB3 ARG 25 HB3 ARG 25 32.799 33.901 21.703 154 HG2 ARG 25 HG2 ARG 25 33.043 36.686 22.181 155 HG3 ARG 25 HG3 ARG 25 33.939 35.970 21.124 156 HD2 ARG 25 HD2 ARG 25 31.118 35.932 20.864 157 HD3 ARG 25 HD3 ARG 25 31.953 37.094 20.242 158 HE ARG 25 HE ARG 25 32.803 34.708 19.372 159 HH11 ARG 25 HH11 ARG 25 32.766 34.228 17.240 160 HH12 ARG 25 HH12 ARG 25 31.750 34.844 16.342 161 HH21 ARG 25 HH21 ARG 25 30.345 36.762 18.491 162 HH22 ARG 25 HH22 ARG 25 30.341 36.319 17.069 163 H GLU 26 H GLU 26 32.976 33.299 25.240 164 HA GLU 26 HA GLU 26 32.031 30.810 24.753 165 HB2 GLU 26 HB2 GLU 26 34.398 31.254 24.934 166 HB3 GLU 26 HB3 GLU 26 34.183 31.655 26.426 167 HG2 GLU 26 HG2 GLU 26 35.103 29.490 26.250 168 HG3 GLU 26 HG3 GLU 26 33.750 29.461 27.026 169 H ILE 27 H ILE 27 31.170 33.096 26.899 170 HA ILE 27 HA ILE 27 29.699 31.500 28.539 171 HB ILE 27 HB ILE 27 31.017 33.767 29.515 172 HG12 ILE 27 HG12 ILE 27 32.047 31.156 29.866 173 HG13 ILE 27 HG13 ILE 27 32.736 32.267 29.016 174 HG21 ILE 27 HG21 ILE 27 30.476 32.859 31.672 175 HG22 ILE 27 HG22 ILE 27 29.161 33.091 30.820 176 HG23 ILE 27 HG23 ILE 27 29.770 31.636 30.955 177 HD11 ILE 27 HD11 ILE 27 33.845 32.054 31.070 178 HD12 ILE 27 HD12 ILE 27 33.200 33.497 30.981 179 HD13 ILE 27 HD13 ILE 27 32.499 32.369 31.844 180 H LYS 28 H LYS 28 27.504 32.414 29.017 181 HA LYS 28 HA LYS 28 26.571 34.579 27.766 182 HB2 LYS 28 HB2 LYS 28 25.410 32.869 29.670 183 HB3 LYS 28 HB3 LYS 28 24.695 34.210 29.323 184 HG2 LYS 28 HG2 LYS 28 24.489 33.567 27.070 185 HG3 LYS 28 HG3 LYS 28 25.317 32.273 27.335 186 HD2 LYS 28 HD2 LYS 28 23.551 31.426 28.702 187 HD3 LYS 28 HD3 LYS 28 22.720 32.717 28.423 188 HE2 LYS 28 HE2 LYS 28 22.806 32.177 26.057 189 HE3 LYS 28 HE3 LYS 28 23.470 30.818 26.436 190 HZ1 LYS 28 HZ1 LYS 28 21.244 30.541 26.133 191 HZ2 LYS 28 HZ2 LYS 28 21.549 30.245 27.523 192 HZ3 LYS 28 HZ3 LYS 28 20.931 31.511 27.170 193 H ASP 29 H ASP 29 27.672 36.556 28.309 194 HA ASP 29 HA ASP 29 28.319 37.140 30.821 195 HB2 ASP 29 HB2 ASP 29 29.638 37.779 28.844 196 HB3 ASP 29 HB3 ASP 29 28.638 38.965 28.686 197 HA PRO 30 HA PRO 30 24.565 39.898 30.875 198 HB2 PRO 30 HB2 PRO 30 22.705 38.000 29.856 199 HB3 PRO 30 HB3 PRO 30 22.570 39.552 29.784 200 HG2 PRO 30 HG2 PRO 30 23.372 38.407 27.660 201 HG3 PRO 30 HG3 PRO 30 24.117 39.719 28.052 202 HD2 PRO 30 HD2 PRO 30 25.003 37.065 28.572 203 HD3 PRO 30 HD3 PRO 30 25.879 38.233 28.023 204 H ARG 31 H ARG 31 24.830 36.607 31.728 205 HA ARG 31 HA ARG 31 23.493 36.497 33.967 206 HB2 ARG 31 HB2 ARG 31 24.532 34.645 32.693 207 HB3 ARG 31 HB3 ARG 31 25.860 35.010 33.425 208 HG2 ARG 31 HG2 ARG 31 24.951 34.434 35.494 209 HG3 ARG 31 HG3 ARG 31 23.535 34.248 34.867 210 HD2 ARG 31 HD2 ARG 31 24.373 32.125 35.131 211 HD3 ARG 31 HD3 ARG 31 24.397 32.397 33.596 212 HE ARG 31 HE ARG 31 26.701 32.750 35.035 213 HH11 ARG 31 HH11 ARG 31 28.615 31.998 34.262 214 HH12 ARG 31 HH12 ARG 31 28.643 31.077 33.091 215 HH21 ARG 31 HH21 ARG 31 25.494 30.959 32.508 216 HH22 ARG 31 HH22 ARG 31 26.834 30.475 32.075 217 H LEU 32 H LEU 32 26.451 38.018 33.515 218 HA LEU 32 HA LEU 32 26.763 38.798 36.083 219 HB2 LEU 32 HB2 LEU 32 28.665 38.780 33.969 220 HB3 LEU 32 HB3 LEU 32 28.997 39.311 35.397 221 HG LEU 32 HG LEU 32 28.410 36.602 34.880 222 HD11 LEU 32 HD11 LEU 32 30.760 36.237 35.128 223 HD12 LEU 32 HD12 LEU 32 30.492 37.222 33.917 224 HD13 LEU 32 HD13 LEU 32 30.967 37.796 35.315 225 HD21 LEU 32 HD21 LEU 32 29.228 36.124 37.030 226 HD22 LEU 32 HD22 LEU 32 29.444 37.671 37.288 227 HD23 LEU 32 HD23 LEU 32 27.979 37.094 37.118 228 H GLY 33 H GLY 33 25.017 40.104 33.889 229 HA2 GLY 33 HA2 GLY 33 24.146 42.047 33.710 230 HA3 GLY 33 HA3 GLY 33 25.298 42.650 34.571 231 H MET 34 H MET 34 26.445 40.996 31.868 232 HA MET 34 HA MET 34 27.488 41.489 30.080 233 HB2 MET 34 HB2 MET 34 25.132 41.823 29.512 234 HB3 MET 34 HB3 MET 34 25.447 43.350 29.542 235 HG2 MET 34 HG2 MET 34 25.532 42.626 27.349 236 HG3 MET 34 HG3 MET 34 26.955 43.102 27.771 237 HE1 MET 34 HE1 MET 34 27.955 40.431 25.322 238 HE2 MET 34 HE2 MET 34 26.804 41.510 25.182 239 HE3 MET 34 HE3 MET 34 28.215 41.927 25.768 240 H MET 35 H MET 35 28.749 42.679 32.192 241 HA MET 35 HA MET 35 30.142 44.746 31.209 242 HB2 MET 35 HB2 MET 35 28.125 45.667 32.262 243 HB3 MET 35 HB3 MET 35 28.798 45.287 33.616 244 HG2 MET 35 HG2 MET 35 30.688 46.649 32.963 245 HG3 MET 35 HG3 MET 35 29.846 47.137 31.744 246 HE1 MET 35 HE1 MET 35 29.877 50.316 33.616 247 HE2 MET 35 HE2 MET 35 31.058 49.293 33.353 248 HE3 MET 35 HE3 MET 35 30.037 49.638 32.194 249 H THR 36 H THR 36 31.079 42.237 31.730 250 HA THR 36 HA THR 36 32.529 42.130 34.022 251 HB THR 36 HB THR 36 32.275 40.175 32.031 252 HG1 THR 36 HG1 THR 36 30.490 39.629 32.923 253 HG21 THR 36 HG21 THR 36 32.904 38.571 33.614 254 HG22 THR 36 HG22 THR 36 34.051 39.642 33.397 255 HG23 THR 36 HG23 THR 36 33.122 39.725 34.677 256 H THR 37 H THR 37 34.212 43.711 33.646 257 HA THR 37 HA THR 37 35.364 43.865 31.204 258 HB THR 37 HB THR 37 35.515 45.755 33.286 259 HG1 THR 37 HG1 THR 37 33.922 46.807 32.104 260 HG21 THR 37 HG21 THR 37 36.123 47.364 31.679 261 HG22 THR 37 HG22 THR 37 37.184 46.188 31.723 262 HG23 THR 37 HG23 THR 37 36.107 46.240 30.563 263 H VAL 38 H VAL 38 37.641 43.507 30.808 264 HA VAL 38 HA VAL 38 39.115 42.409 32.761 265 HB VAL 38 HB VAL 38 39.874 42.688 30.092 266 HG11 VAL 38 HG11 VAL 38 41.543 41.053 30.573 267 HG12 VAL 38 HG12 VAL 38 41.756 42.344 31.467 268 HG13 VAL 38 HG13 VAL 38 41.082 41.053 32.089 269 HG21 VAL 38 HG21 VAL 38 39.346 40.380 29.818 270 HG22 VAL 38 HG22 VAL 38 38.796 40.346 31.303 271 HG23 VAL 38 HG23 VAL 38 38.049 41.205 30.203 272 H SER 39 H SER 39 40.147 43.858 34.176 273 HA SER 39 HA SER 39 40.799 46.352 33.495 274 HB2 SER 39 HB2 SER 39 40.961 46.716 35.830 275 HB3 SER 39 HB3 SER 39 39.585 46.060 35.496 276 HG SER 39 HG SER 39 40.683 45.068 37.165 277 H GLY 40 H GLY 40 42.617 43.659 33.530 278 HA2 GLY 40 HA2 GLY 40 44.712 44.601 32.472 279 HA3 GLY 40 HA3 GLY 40 45.055 44.566 33.993 280 H VAL 41 H VAL 41 46.497 42.959 32.208 281 HA VAL 41 HA VAL 41 46.186 40.522 33.345 282 HB VAL 41 HB VAL 41 47.007 39.431 31.548 283 HG11 VAL 41 HG11 VAL 41 45.178 39.651 30.027 284 HG12 VAL 41 HG12 VAL 41 44.670 39.625 31.528 285 HG13 VAL 41 HG13 VAL 41 44.771 41.001 30.749 286 HG21 VAL 41 HG21 VAL 41 47.357 40.451 29.434 287 HG22 VAL 41 HG22 VAL 41 47.103 41.866 30.097 288 HG23 VAL 41 HG23 VAL 41 48.368 41.010 30.515 289 H GLU 42 H GLU 42 48.209 39.446 34.054 290 HA GLU 42 HA GLU 42 50.592 40.681 33.580 291 HB2 GLU 42 HB2 GLU 42 50.013 41.163 35.812 292 HB3 GLU 42 HB3 GLU 42 49.905 39.637 36.118 293 HG2 GLU 42 HG2 GLU 42 52.218 39.349 35.762 294 HG3 GLU 42 HG3 GLU 42 52.363 40.826 35.282 295 H MET 43 H MET 43 51.789 39.340 32.280 296 HA MET 43 HA MET 43 51.575 36.667 32.303 297 HB2 MET 43 HB2 MET 43 53.164 38.265 30.591 298 HB3 MET 43 HB3 MET 43 52.985 36.725 30.426 299 HG2 MET 43 HG2 MET 43 50.620 37.136 30.079 300 HG3 MET 43 HG3 MET 43 50.958 38.658 30.019 301 HE1 MET 43 HE1 MET 43 52.999 39.038 26.840 302 HE2 MET 43 HE2 MET 43 52.343 39.835 28.043 303 HE3 MET 43 HE3 MET 43 53.555 38.851 28.312 304 H SER 44 H SER 44 53.198 35.225 33.094 305 HA SER 44 HA SER 44 54.963 36.016 34.887 306 HB2 SER 44 HB2 SER 44 53.958 33.846 34.901 307 HB3 SER 44 HB3 SER 44 54.774 33.477 33.625 308 HG SER 44 HG SER 44 56.307 32.996 34.856 309 H ARG 45 H ARG 45 57.364 35.927 34.750 310 HA ARG 45 HA ARG 45 58.482 37.132 32.766 311 HB2 ARG 45 HB2 ARG 45 59.365 37.027 35.008 312 HB3 ARG 45 HB3 ARG 45 59.818 35.560 34.731 313 HG2 ARG 45 HG2 ARG 45 60.857 37.474 32.975 314 HG3 ARG 45 HG3 ARG 45 61.421 37.536 34.428 315 HD2 ARG 45 HD2 ARG 45 62.319 35.384 34.235 316 HD3 ARG 45 HD3 ARG 45 61.610 35.166 32.863 317 HE ARG 45 HE ARG 45 63.128 37.205 32.437 318 HH11 ARG 45 HH11 ARG 45 65.147 37.250 31.572 319 HH12 ARG 45 HH12 ARG 45 66.048 36.071 31.699 320 HH21 ARG 45 HH21 ARG 45 64.053 34.151 33.337 321 HH22 ARG 45 HH22 ARG 45 65.410 34.257 32.731 322 H ASP 46 H ASP 46 58.189 33.776 33.098 323 HA ASP 46 HA ASP 46 59.643 33.080 30.954 324 HB2 ASP 46 HB2 ASP 46 59.451 30.902 31.795 325 HB3 ASP 46 HB3 ASP 46 59.891 31.830 32.969 326 H LEU 47 H LEU 47 56.599 34.013 31.068 327 HA LEU 47 HA LEU 47 54.772 33.790 30.173 328 HB2 LEU 47 HB2 LEU 47 56.397 33.445 27.892 329 HB3 LEU 47 HB3 LEU 47 54.852 33.617 27.760 330 HG LEU 47 HG LEU 47 55.297 35.726 29.044 331 HD11 LEU 47 HD11 LEU 47 57.320 36.776 28.378 332 HD12 LEU 47 HD12 LEU 47 57.628 35.477 29.230 333 HD13 LEU 47 HD13 LEU 47 57.761 35.439 27.652 334 HD21 LEU 47 HD21 LEU 47 55.382 36.922 26.960 335 HD22 LEU 47 HD22 LEU 47 55.762 35.572 26.224 336 HD23 LEU 47 HD23 LEU 47 54.326 35.745 26.870 337 H ALA 48 H ALA 48 55.622 31.177 31.339 338 HA ALA 48 HA ALA 48 54.265 29.320 30.001 339 HB1 ALA 48 HB1 ALA 48 54.788 27.972 31.898 340 HB2 ALA 48 HB2 ALA 48 56.094 28.708 31.383 341 HB3 ALA 48 HB3 ALA 48 55.322 29.258 32.652 342 H TYR 49 H TYR 49 53.343 31.375 32.572 343 HA TYR 49 HA TYR 49 50.725 30.659 32.581 344 HB2 TYR 49 HB2 TYR 49 52.150 31.179 34.972 345 HB3 TYR 49 HB3 TYR 49 50.670 30.691 34.896 346 HD1 TYR 49 HD1 TYR 49 50.938 28.306 33.189 347 HD2 TYR 49 HD2 TYR 49 53.199 29.513 36.302 348 HE1 TYR 49 HE1 TYR 49 51.643 26.113 33.514 349 HE2 TYR 49 HE2 TYR 49 53.976 27.342 36.585 350 HH TYR 49 HH TYR 49 53.955 25.203 35.821 351 H ALA 50 H ALA 50 49.186 32.432 33.106 352 HA ALA 50 HA ALA 50 50.106 34.899 33.549 353 HB1 ALA 50 HB1 ALA 50 48.808 35.817 31.754 354 HB2 ALA 50 HB2 ALA 50 49.916 34.837 31.189 355 HB3 ALA 50 HB3 ALA 50 48.415 34.348 31.311 356 H LYS 51 H LYS 51 48.846 36.292 34.779 357 HA LYS 51 HA LYS 51 46.539 35.511 35.919 358 HB2 LYS 51 HB2 LYS 51 48.061 37.816 36.571 359 HB3 LYS 51 HB3 LYS 51 46.885 37.260 37.431 360 HG2 LYS 51 HG2 LYS 51 48.205 35.352 37.987 361 HG3 LYS 51 HG3 LYS 51 49.385 35.932 37.148 362 HD2 LYS 51 HD2 LYS 51 49.432 37.831 38.664 363 HD3 LYS 51 HD3 LYS 51 48.389 37.087 39.552 364 HE2 LYS 51 HE2 LYS 51 49.927 35.323 39.906 365 HE3 LYS 51 HE3 LYS 51 50.966 36.033 38.986 366 HZ1 LYS 51 HZ1 LYS 51 51.435 36.458 41.164 367 HZ2 LYS 51 HZ2 LYS 51 51.098 37.717 40.522 368 HZ3 LYS 51 HZ3 LYS 51 50.129 37.056 41.379 369 H VAL 52 H VAL 52 44.494 36.462 35.421 370 HA VAL 52 HA VAL 52 44.284 38.695 33.876 371 HB VAL 52 HB VAL 52 42.406 36.616 33.954 372 HG11 VAL 52 HG11 VAL 52 41.329 37.720 32.135 373 HG12 VAL 52 HG12 VAL 52 41.360 38.653 33.415 374 HG13 VAL 52 HG13 VAL 52 42.393 38.889 32.238 375 HG21 VAL 52 HG21 VAL 52 43.043 36.064 31.724 376 HG22 VAL 52 HG22 VAL 52 44.189 37.154 31.797 377 HG23 VAL 52 HG23 VAL 52 44.261 35.867 32.717 378 H TYR 53 H TYR 53 43.321 40.479 34.937 379 HA TYR 53 HA TYR 53 41.895 40.180 37.210 380 HB2 TYR 53 HB2 TYR 53 43.048 42.595 36.298 381 HB3 TYR 53 HB3 TYR 53 42.447 42.366 37.718 382 HD1 TYR 53 HD1 TYR 53 43.704 40.468 39.129 383 HD2 TYR 53 HD2 TYR 53 45.387 42.577 36.103 384 HE1 TYR 53 HE1 TYR 53 45.834 39.881 39.901 385 HE2 TYR 53 HE2 TYR 53 47.509 42.044 36.910 386 HH TYR 53 HH TYR 53 48.713 41.025 38.510 387 H VAL 54 H VAL 54 39.666 40.738 37.295 388 HA VAL 54 HA VAL 54 38.458 41.946 35.178 389 HB VAL 54 HB VAL 54 37.500 39.647 36.469 390 HG11 VAL 54 HG11 VAL 54 35.817 39.516 34.779 391 HG12 VAL 54 HG12 VAL 54 35.690 40.863 35.602 392 HG13 VAL 54 HG13 VAL 54 36.360 40.872 34.166 393 HG21 VAL 54 HG21 VAL 54 37.890 38.421 34.451 394 HG22 VAL 54 HG22 VAL 54 38.554 39.714 33.823 395 HG23 VAL 54 HG23 VAL 54 39.248 38.981 35.043 396 H THR 55 H THR 55 36.780 43.459 35.747 397 HA THR 55 HA THR 55 36.057 43.780 38.360 398 HB THR 55 HB THR 55 37.536 45.409 37.660 399 HG1 THR 55 HG1 THR 55 36.288 46.034 39.274 400 HG21 THR 55 HG21 THR 55 36.873 47.207 36.337 401 HG22 THR 55 HG22 THR 55 36.967 45.864 35.503 402 HG23 THR 55 HG23 THR 55 35.555 46.418 35.954 403 H PHE 56 H PHE 56 33.842 43.848 38.839 404 HA PHE 56 HA PHE 56 32.256 43.008 36.811 405 HB2 PHE 56 HB2 PHE 56 32.321 42.189 39.525 406 HB3 PHE 56 HB3 PHE 56 31.151 41.759 38.588 407 HD1 PHE 56 HD1 PHE 56 34.717 41.349 38.807 408 HD2 PHE 56 HD2 PHE 56 31.273 39.659 37.534 409 HE1 PHE 56 HE1 PHE 56 35.858 39.382 38.322 410 HE2 PHE 56 HE2 PHE 56 32.412 37.666 37.107 411 HZ PHE 56 HZ PHE 56 34.714 37.531 37.486 412 H LEU 57 H LEU 57 30.118 43.865 36.477 413 HA LEU 57 HA LEU 57 28.930 45.573 38.194 414 HB2 LEU 57 HB2 LEU 57 28.558 45.716 35.864 415 HB3 LEU 57 HB3 LEU 57 27.905 44.300 35.883 416 HG LEU 57 HG LEU 57 26.124 45.142 37.165 417 HD11 LEU 57 HD11 LEU 57 25.850 47.463 37.453 418 HD12 LEU 57 HD12 LEU 57 27.152 46.965 38.204 419 HD13 LEU 57 HD13 LEU 57 27.277 47.705 36.809 420 HD21 LEU 57 HD21 LEU 57 25.104 46.386 35.403 421 HD22 LEU 57 HD22 LEU 57 26.525 46.574 34.732 422 HD23 LEU 57 HD23 LEU 57 25.870 45.135 34.809 423 H ASN 58 H ASN 58 29.030 42.211 38.069 424 HA ASN 58 HA ASN 58 26.868 41.612 39.555 425 HB2 ASN 58 HB2 ASN 58 27.997 40.245 37.804 426 HB3 ASN 58 HB3 ASN 58 28.981 39.843 38.946 427 HD21 ASN 58 HD21 ASN 58 25.291 38.549 39.155 428 HD22 ASN 58 HD22 ASN 58 25.556 39.928 38.657 429 H ASP 59 H ASP 59 29.513 43.046 40.523 430 HA ASP 59 HA ASP 59 30.347 42.129 42.798 431 HB2 ASP 59 HB2 ASP 59 31.560 43.723 41.545 432 HB3 ASP 59 HB3 ASP 59 30.366 44.727 41.592 433 H LYS 60 H LYS 60 27.302 43.395 42.420 434 HA LYS 60 HA LYS 60 26.841 44.427 44.810 435 HB2 LYS 60 HB2 LYS 60 25.508 44.906 42.897 436 HB3 LYS 60 HB3 LYS 60 24.993 43.435 42.891 437 HG2 LYS 60 HG2 LYS 60 23.702 43.768 44.770 438 HG3 LYS 60 HG3 LYS 60 24.448 45.087 45.136 439 HD2 LYS 60 HD2 LYS 60 23.462 46.180 43.265 440 HD3 LYS 60 HD3 LYS 60 22.737 44.857 42.866 441 HE2 LYS 60 HE2 LYS 60 21.483 44.931 44.882 442 HE3 LYS 60 HE3 LYS 60 22.213 46.246 45.292 443 HZ1 LYS 60 HZ1 LYS 60 20.198 46.735 44.351 444 HZ2 LYS 60 HZ2 LYS 60 21.237 47.286 43.498 445 HZ3 LYS 60 HZ3 LYS 60 20.556 46.060 43.115 446 H ASP 61 H ASP 61 26.990 41.105 44.073 447 HA ASP 61 HA ASP 61 26.647 40.520 46.689 448 HB2 ASP 61 HB2 ASP 61 24.654 39.894 45.443 449 HB3 ASP 61 HB3 ASP 61 25.521 38.818 44.720 450 H GLU 62 H GLU 62 28.419 39.579 47.585 451 HA GLU 62 HA GLU 62 30.555 39.039 46.323 452 HB2 GLU 62 HB2 GLU 62 30.084 38.016 48.944 453 HB3 GLU 62 HB3 GLU 62 31.488 38.374 48.364 454 HG2 GLU 62 HG2 GLU 62 31.179 40.080 49.761 455 HG3 GLU 62 HG3 GLU 62 30.686 40.723 48.429 456 H ASP 63 H ASP 63 28.155 36.809 47.292 457 HA ASP 63 HA ASP 63 29.301 34.482 46.754 458 HB2 ASP 63 HB2 ASP 63 27.626 34.550 48.368 459 HB3 ASP 63 HB3 ASP 63 26.630 35.233 47.381 460 H ALA 64 H ALA 64 27.289 36.465 44.766 461 HA ALA 64 HA ALA 64 27.074 34.845 42.690 462 HB1 ALA 64 HB1 ALA 64 26.235 36.732 41.584 463 HB2 ALA 64 HB2 ALA 64 25.535 36.573 42.997 464 HB3 ALA 64 HB3 ALA 64 26.686 37.643 42.798 465 H VAL 65 H VAL 65 29.444 37.343 43.292 466 HA VAL 65 HA VAL 65 30.895 37.076 41.166 467 HB VAL 65 HB VAL 65 31.767 38.018 43.660 468 HG11 VAL 65 HG11 VAL 65 33.596 39.056 42.564 469 HG12 VAL 65 HG12 VAL 65 33.675 37.481 42.405 470 HG13 VAL 65 HG13 VAL 65 33.153 38.373 41.204 471 HG21 VAL 65 HG21 VAL 65 31.477 40.207 42.698 472 HG22 VAL 65 HG22 VAL 65 30.959 39.529 41.364 473 HG23 VAL 65 HG23 VAL 65 30.101 39.422 42.692 474 H LYS 66 H LYS 66 31.256 35.382 44.210 475 HA LYS 66 HA LYS 66 33.359 33.897 43.790 476 HB2 LYS 66 HB2 LYS 66 32.222 34.213 45.905 477 HB3 LYS 66 HB3 LYS 66 31.166 33.170 45.427 478 HG2 LYS 66 HG2 LYS 66 32.523 31.851 46.643 479 HG3 LYS 66 HG3 LYS 66 33.104 31.610 45.215 480 HD2 LYS 66 HD2 LYS 66 34.983 32.057 46.376 481 HD3 LYS 66 HD3 LYS 66 34.681 33.453 45.749 482 HE2 LYS 66 HE2 LYS 66 33.528 34.036 47.813 483 HE3 LYS 66 HE3 LYS 66 34.067 32.707 48.425 484 HZ1 LYS 66 HZ1 LYS 66 35.445 34.431 48.969 485 HZ2 LYS 66 HZ2 LYS 66 36.195 33.501 48.141 486 HZ3 LYS 66 HZ3 LYS 66 35.692 34.739 47.571 487 H ALA 67 H ALA 67 30.101 33.026 43.010 488 HA ALA 67 HA ALA 67 30.533 30.722 41.828 489 HB1 ALA 67 HB1 ALA 67 28.251 30.942 41.177 490 HB2 ALA 67 HB2 ALA 67 28.408 31.278 42.717 491 HB3 ALA 67 HB3 ALA 67 28.267 32.450 41.661 492 H GLY 68 H GLY 68 30.449 33.862 40.384 493 HA2 GLY 68 HA2 GLY 68 30.602 33.252 37.844 494 HA3 GLY 68 HA3 GLY 68 30.952 34.641 38.461 495 H ILE 69 H ILE 69 33.261 34.078 39.994 496 HA ILE 69 HA ILE 69 35.287 33.700 38.384 497 HB ILE 69 HB ILE 69 35.167 33.752 41.176 498 HG12 ILE 69 HG12 ILE 69 34.905 35.852 40.115 499 HG13 ILE 69 HG13 ILE 69 36.101 35.845 41.116 500 HG21 ILE 69 HG21 ILE 69 37.538 33.763 41.302 501 HG22 ILE 69 HG22 ILE 69 37.005 32.390 40.719 502 HG23 ILE 69 HG23 ILE 69 37.605 33.486 39.744 503 HD11 ILE 69 HD11 ILE 69 36.732 36.975 39.157 504 HD12 ILE 69 HD12 ILE 69 37.629 35.679 39.312 505 HD13 ILE 69 HD13 ILE 69 36.414 35.686 38.294 506 H LYS 70 H LYS 70 33.737 31.314 40.417 507 HA LYS 70 HA LYS 70 35.183 29.224 39.855 508 HB2 LYS 70 HB2 LYS 70 33.510 29.357 41.611 509 HB3 LYS 70 HB3 LYS 70 32.420 29.158 40.515 510 HG2 LYS 70 HG2 LYS 70 33.444 27.023 39.981 511 HG3 LYS 70 HG3 LYS 70 34.384 27.216 41.211 512 HD2 LYS 70 HD2 LYS 70 31.584 26.825 41.325 513 HD3 LYS 70 HD3 LYS 70 32.658 25.847 41.892 514 HE2 LYS 70 HE2 LYS 70 32.137 28.397 43.033 515 HE3 LYS 70 HE3 LYS 70 31.575 27.070 43.628 516 HZ1 LYS 70 HZ1 LYS 70 33.448 27.695 44.749 517 HZ2 LYS 70 HZ2 LYS 70 33.722 26.431 44.089 518 HZ3 LYS 70 HZ3 LYS 70 34.245 27.668 43.535 519 H ALA 71 H ALA 71 32.361 30.264 38.085 520 HA ALA 71 HA ALA 71 32.328 28.391 36.256 521 HB1 ALA 71 HB1 ALA 71 30.788 29.825 35.159 522 HB2 ALA 71 HB2 ALA 71 30.422 29.712 36.697 523 HB3 ALA 71 HB3 ALA 71 31.177 30.993 36.155 524 H LEU 72 H LEU 72 33.992 31.408 36.151 525 HA LEU 72 HA LEU 72 34.941 31.347 33.683 526 HB2 LEU 72 HB2 LEU 72 34.592 33.365 34.898 527 HB3 LEU 72 HB3 LEU 72 35.668 32.931 35.940 528 HG LEU 72 HG LEU 72 37.348 33.170 34.340 529 HD11 LEU 72 HD11 LEU 72 36.920 34.134 32.236 530 HD12 LEU 72 HD12 LEU 72 36.173 32.745 32.367 531 HD13 LEU 72 HD13 LEU 72 35.367 34.096 32.542 532 HD21 LEU 72 HD21 LEU 72 37.263 35.562 34.170 533 HD22 LEU 72 HD22 LEU 72 35.724 35.517 34.540 534 HD23 LEU 72 HD23 LEU 72 36.808 35.108 35.617 535 H GLN 73 H GLN 73 36.542 30.421 36.645 536 HA GLN 73 HA GLN 73 38.818 29.640 35.521 537 HB2 GLN 73 HB2 GLN 73 38.576 30.379 37.822 538 HB3 GLN 73 HB3 GLN 73 37.975 28.974 38.135 539 HG2 GLN 73 HG2 GLN 73 40.216 28.888 38.720 540 HG3 GLN 73 HG3 GLN 73 40.041 27.961 37.478 541 HE21 GLN 73 HE21 GLN 73 41.295 28.455 35.591 542 HE22 GLN 73 HE22 GLN 73 42.196 29.637 35.485 543 H GLU 74 H GLU 74 35.996 27.728 36.229 544 HA GLU 74 HA GLU 74 37.012 25.470 35.312 545 HB2 GLU 74 HB2 GLU 74 34.929 25.911 36.816 546 HB3 GLU 74 HB3 GLU 74 34.246 25.536 35.465 547 HG2 GLU 74 HG2 GLU 74 35.351 23.480 35.404 548 HG3 GLU 74 HG3 GLU 74 36.233 23.870 36.629 549 H ALA 75 H ALA 75 35.741 28.002 33.528 550 HA ALA 75 HA ALA 75 35.656 26.703 31.194 551 HB1 ALA 75 HB1 ALA 75 35.063 28.854 30.336 552 HB2 ALA 75 HB2 ALA 75 34.118 28.473 31.549 553 HB3 ALA 75 HB3 ALA 75 35.320 29.481 31.767 554 H SER 76 H SER 76 38.305 27.722 32.839 555 HA SER 76 HA SER 76 39.451 29.350 31.211 556 HB2 SER 76 HB2 SER 76 41.284 29.307 32.644 557 HB3 SER 76 HB3 SER 76 40.017 29.214 33.547 558 HG SER 76 HG SER 76 40.465 27.244 33.993 559 H GLY 77 H GLY 77 39.908 25.923 31.181 560 HA2 GLY 77 HA2 GLY 77 41.954 25.705 29.582 561 HA3 GLY 77 HA3 GLY 77 40.894 24.590 29.838 562 H PHE 78 H PHE 78 38.575 25.966 28.724 563 HA PHE 78 HA PHE 78 38.796 25.738 26.105 564 HB2 PHE 78 HB2 PHE 78 36.655 26.785 27.635 565 HB3 PHE 78 HB3 PHE 78 36.556 26.575 26.094 566 HD1 PHE 78 HD1 PHE 78 36.428 24.878 29.170 567 HD2 PHE 78 HD2 PHE 78 36.406 24.287 25.157 568 HE1 PHE 78 HE1 PHE 78 35.800 22.648 29.497 569 HE2 PHE 78 HE2 PHE 78 35.740 22.071 25.497 570 HZ PHE 78 HZ PHE 78 35.462 21.255 27.661 571 H ILE 79 H ILE 79 38.602 28.602 28.098 572 HA ILE 79 HA ILE 79 38.720 30.462 26.288 573 HB ILE 79 HB ILE 79 39.470 30.621 29.013 574 HG12 ILE 79 HG12 ILE 79 37.019 31.500 27.864 575 HG13 ILE 79 HG13 ILE 79 37.145 30.111 28.560 576 HG21 ILE 79 HG21 ILE 79 39.342 32.960 28.866 577 HG22 ILE 79 HG22 ILE 79 40.483 32.409 27.917 578 HG23 ILE 79 HG23 ILE 79 39.089 32.847 27.307 579 HD11 ILE 79 HD11 ILE 79 36.157 31.640 30.044 580 HD12 ILE 79 HD12 ILE 79 37.549 31.176 30.638 581 HD13 ILE 79 HD13 ILE 79 37.421 32.587 29.930 582 H ARG 80 H ARG 80 41.417 28.916 27.849 583 HA ARG 80 HA ARG 80 43.432 30.140 26.683 584 HB2 ARG 80 HB2 ARG 80 43.565 28.999 28.765 585 HB3 ARG 80 HB3 ARG 80 43.369 27.644 28.019 586 HG2 ARG 80 HG2 ARG 80 45.576 29.087 27.127 587 HG3 ARG 80 HG3 ARG 80 45.711 28.588 28.599 588 HD2 ARG 80 HD2 ARG 80 45.134 26.807 26.463 589 HD3 ARG 80 HD3 ARG 80 46.590 27.032 26.973 590 HE ARG 80 HE ARG 80 45.342 26.262 29.081 591 HH11 ARG 80 HH11 ARG 80 45.276 24.188 29.885 592 HH12 ARG 80 HH12 ARG 80 45.326 23.027 28.954 593 HH21 ARG 80 HH21 ARG 80 45.634 24.619 26.214 594 HH22 ARG 80 HH22 ARG 80 45.532 23.273 26.846 595 H SER 81 H SER 81 41.938 27.187 25.619 596 HA SER 81 HA SER 81 43.366 26.764 23.474 597 HB2 SER 81 HB2 SER 81 41.910 25.099 24.322 598 HB3 SER 81 HB3 SER 81 40.672 25.971 23.952 599 HG SER 81 HG SER 81 41.055 24.461 22.411 600 H LEU 82 H LEU 82 40.446 28.624 23.672 601 HA LEU 82 HA LEU 82 40.220 29.401 21.196 602 HB2 LEU 82 HB2 LEU 82 39.068 30.449 23.577 603 HB3 LEU 82 HB3 LEU 82 38.676 31.011 22.176 604 HG LEU 82 HG LEU 82 38.266 28.287 22.771 605 HD11 LEU 82 HD11 LEU 82 36.018 28.803 23.354 606 HD12 LEU 82 HD12 LEU 82 37.017 29.519 24.352 607 HD13 LEU 82 HD13 LEU 82 36.340 30.344 23.182 608 HD21 LEU 82 HD21 LEU 82 36.667 28.325 21.040 609 HD22 LEU 82 HD22 LEU 82 36.977 29.858 20.794 610 HD23 LEU 82 HD23 LEU 82 38.084 28.767 20.490 611 H LEU 83 H LEU 83 41.920 30.974 23.745 612 HA LEU 83 HA LEU 83 42.706 33.187 22.557 613 HB2 LEU 83 HB2 LEU 83 42.688 32.905 24.899 614 HB3 LEU 83 HB3 LEU 83 43.817 31.836 24.780 615 HG LEU 83 HG LEU 83 45.308 33.519 24.019 616 HD11 LEU 83 HD11 LEU 83 44.736 35.787 24.184 617 HD12 LEU 83 HD12 LEU 83 43.814 35.063 23.120 618 HD13 LEU 83 HD13 LEU 83 43.253 35.384 24.566 619 HD21 LEU 83 HD21 LEU 83 45.584 34.557 26.144 620 HD22 LEU 83 HD22 LEU 83 44.128 34.085 26.551 621 HD23 LEU 83 HD23 LEU 83 45.275 33.015 26.330 622 H GLY 84 H GLY 84 44.458 30.153 22.777 623 HA2 GLY 84 HA2 GLY 84 46.541 30.680 21.339 624 HA3 GLY 84 HA3 GLY 84 45.949 29.252 21.541 625 H LYS 85 H LYS 85 43.473 29.529 20.202 626 HA LYS 85 HA LYS 85 43.877 29.377 17.608 627 HB2 LYS 85 HB2 LYS 85 42.102 28.296 18.959 628 HB3 LYS 85 HB3 LYS 85 41.331 29.646 18.832 629 HG2 LYS 85 HG2 LYS 85 41.242 29.405 16.479 630 HG3 LYS 85 HG3 LYS 85 42.084 28.095 16.564 631 HD2 LYS 85 HD2 LYS 85 40.263 27.163 17.914 632 HD3 LYS 85 HD3 LYS 85 39.418 28.403 17.485 633 HE2 LYS 85 HE2 LYS 85 39.617 27.755 15.204 634 HE3 LYS 85 HE3 LYS 85 40.475 26.522 15.625 635 HZ1 LYS 85 HZ1 LYS 85 38.327 25.897 15.280 636 HZ2 LYS 85 HZ2 LYS 85 38.641 25.675 16.682 637 HZ3 LYS 85 HZ3 LYS 85 37.842 26.823 16.290 638 H ALA 86 H ALA 86 42.644 32.071 19.394 639 HA ALA 86 HA ALA 86 42.124 33.676 17.383 640 HB1 ALA 86 HB1 ALA 86 41.849 35.305 19.091 641 HB2 ALA 86 HB2 ALA 86 41.073 33.978 19.473 642 HB3 ALA 86 HB3 ALA 86 42.475 34.296 20.139 643 H MET 87 H MET 87 45.026 33.446 19.288 644 HA MET 87 HA MET 87 46.371 35.372 18.060 645 HB2 MET 87 HB2 MET 87 47.271 33.407 19.905 646 HB3 MET 87 HB3 MET 87 48.216 34.525 19.367 647 HG2 MET 87 HG2 MET 87 45.929 35.041 20.964 648 HG3 MET 87 HG3 MET 87 47.387 35.065 21.517 649 HE1 MET 87 HE1 MET 87 46.463 38.683 21.920 650 HE2 MET 87 HE2 MET 87 45.553 37.414 22.185 651 HE3 MET 87 HE3 MET 87 47.065 37.418 22.660 652 H ARG 88 H ARG 88 45.817 32.239 17.103 653 HA ARG 88 HA ARG 88 46.616 30.716 15.907 654 HB2 ARG 88 HB2 ARG 88 47.429 32.828 14.224 655 HB3 ARG 88 HB3 ARG 88 47.337 31.340 13.763 656 HG2 ARG 88 HG2 ARG 88 44.964 31.416 14.282 657 HG3 ARG 88 HG3 ARG 88 45.117 32.950 14.512 658 HD2 ARG 88 HD2 ARG 88 44.330 32.740 12.372 659 HD3 ARG 88 HD3 ARG 88 45.823 33.160 12.215 660 HE ARG 88 HE ARG 88 46.267 31.175 11.330 661 HH11 ARG 88 HH11 ARG 88 45.757 29.216 10.375 662 HH12 ARG 88 HH12 ARG 88 44.438 28.577 10.643 663 HH21 ARG 88 HH21 ARG 88 43.223 30.795 12.597 664 HH22 ARG 88 HH22 ARG 88 42.974 29.489 11.925 665 H LEU 89 H LEU 89 48.146 30.634 17.985 666 HA LEU 89 HA LEU 89 50.818 30.726 17.388 667 HB2 LEU 89 HB2 LEU 89 50.068 32.671 18.556 668 HB3 LEU 89 HB3 LEU 89 49.547 31.759 19.708 669 HG LEU 89 HG LEU 89 51.734 31.174 20.264 670 HD11 LEU 89 HD11 LEU 89 53.584 32.261 19.299 671 HD12 LEU 89 HD12 LEU 89 52.815 31.403 18.213 672 HD13 LEU 89 HD13 LEU 89 52.618 32.973 18.267 673 HD21 LEU 89 HD21 LEU 89 52.399 33.295 21.144 674 HD22 LEU 89 HD22 LEU 89 51.375 34.003 20.165 675 HD23 LEU 89 HD23 LEU 89 50.841 33.086 21.341 676 H ARG 90 H ARG 90 52.152 29.085 18.122 677 HA ARG 90 HA ARG 90 51.150 26.813 19.094 678 HB2 ARG 90 HB2 ARG 90 52.812 26.882 17.360 679 HB3 ARG 90 HB3 ARG 90 53.831 27.472 18.383 680 HG2 ARG 90 HG2 ARG 90 53.960 25.466 19.524 681 HG3 ARG 90 HG3 ARG 90 52.761 24.874 18.721 682 HD2 ARG 90 HD2 ARG 90 54.025 24.659 16.806 683 HD3 ARG 90 HD3 ARG 90 55.159 25.567 17.374 684 HE ARG 90 HE ARG 90 54.953 22.938 17.810 685 HH11 ARG 90 HH11 ARG 90 56.245 21.790 19.153 686 HH12 ARG 90 HH12 ARG 90 57.236 22.482 20.024 687 HH21 ARG 90 HH21 ARG 90 56.447 25.513 19.244 688 HH22 ARG 90 HH22 ARG 90 57.355 24.677 20.077 689 H ILE 91 H ILE 91 52.380 29.352 20.777 690 HA ILE 91 HA ILE 91 52.516 28.021 23.138 691 HB ILE 91 HB ILE 91 54.200 29.714 23.719 692 HG12 ILE 91 HG12 ILE 91 54.865 29.854 20.994 693 HG13 ILE 91 HG13 ILE 91 53.913 30.923 21.612 694 HG21 ILE 91 HG21 ILE 91 55.981 28.295 22.933 695 HG22 ILE 91 HG22 ILE 91 54.799 27.419 23.522 696 HG23 ILE 91 HG23 ILE 91 54.958 27.586 21.954 697 HD11 ILE 91 HD11 ILE 91 56.108 31.762 21.575 698 HD12 ILE 91 HD12 ILE 91 55.636 31.626 23.081 699 HD13 ILE 91 HD13 ILE 91 56.603 30.541 22.453 700 H VAL 92 H VAL 92 50.534 28.595 24.069 701 HA VAL 92 HA VAL 92 50.065 31.189 24.765 702 HB VAL 92 HB VAL 92 48.390 30.313 23.511 703 HG11 VAL 92 HG11 VAL 92 46.852 28.720 24.389 704 HG12 VAL 92 HG12 VAL 92 48.283 28.083 24.157 705 HG13 VAL 92 HG13 VAL 92 47.827 28.496 25.617 706 HG21 VAL 92 HG21 VAL 92 46.541 31.016 24.850 707 HG22 VAL 92 HG22 VAL 92 47.495 31.011 26.115 708 HG23 VAL 92 HG23 VAL 92 47.747 32.040 24.938 709 HA PRO 93 HA PRO 93 50.952 30.089 28.898 710 HB2 PRO 93 HB2 PRO 93 49.766 32.405 29.892 711 HB3 PRO 93 HB3 PRO 93 51.274 32.024 30.011 712 HG2 PRO 93 HG2 PRO 93 50.564 33.931 28.406 713 HG3 PRO 93 HG3 PRO 93 51.816 33.068 28.064 714 HD2 PRO 93 HD2 PRO 93 49.215 32.764 26.981 715 HD3 PRO 93 HD3 PRO 93 50.562 32.626 26.207 716 H GLU 94 H GLU 94 49.851 29.049 30.730 717 HA GLU 94 HA GLU 94 47.245 28.542 30.512 718 HB2 GLU 94 HB2 GLU 94 48.716 26.938 31.434 719 HB3 GLU 94 HB3 GLU 94 48.874 27.839 32.698 720 HG2 GLU 94 HG2 GLU 94 47.382 26.185 33.253 721 HG3 GLU 94 HG3 GLU 94 46.566 27.512 33.190 722 H LEU 95 H LEU 95 45.457 29.463 31.688 723 HA LEU 95 HA LEU 95 45.911 31.968 32.561 724 HB2 LEU 95 HB2 LEU 95 43.452 30.881 31.620 725 HB3 LEU 95 HB3 LEU 95 43.647 32.387 31.972 726 HG LEU 95 HG LEU 95 44.923 31.106 29.805 727 HD11 LEU 95 HD11 LEU 95 43.468 32.401 28.415 728 HD12 LEU 95 HD12 LEU 95 42.621 31.458 29.363 729 HD13 LEU 95 HD13 LEU 95 42.783 32.994 29.713 730 HD21 LEU 95 HD21 LEU 95 45.657 33.221 29.076 731 HD22 LEU 95 HD22 LEU 95 45.035 33.877 30.377 732 HD23 LEU 95 HD23 LEU 95 46.262 32.882 30.500 733 H THR 96 H THR 96 45.515 32.749 34.591 734 HA THR 96 HA THR 96 43.960 31.437 36.383 735 HB THR 96 HB THR 96 45.990 33.184 37.184 736 HG1 THR 96 HG1 THR 96 47.300 31.453 37.534 737 HG21 THR 96 HG21 THR 96 45.876 31.974 39.259 738 HG22 THR 96 HG22 THR 96 44.455 32.565 38.884 739 HG23 THR 96 HG23 THR 96 44.770 31.035 38.622 740 H PHE 97 H PHE 97 42.090 32.642 37.068 741 HA PHE 97 HA PHE 97 41.839 35.234 36.306 742 HB2 PHE 97 HB2 PHE 97 39.846 33.238 36.588 743 HB3 PHE 97 HB3 PHE 97 39.456 34.735 36.391 744 HD1 PHE 97 HD1 PHE 97 39.842 35.840 34.195 745 HD2 PHE 97 HD2 PHE 97 40.622 31.893 34.682 746 HE1 PHE 97 HE1 PHE 97 39.985 35.583 31.874 747 HE2 PHE 97 HE2 PHE 97 40.793 31.646 32.360 748 HZ PHE 97 HZ PHE 97 40.487 33.498 30.964 749 H PHE 98 H PHE 98 41.138 36.895 37.660 750 HA PHE 98 HA PHE 98 40.706 36.542 40.290 751 HB2 PHE 98 HB2 PHE 98 42.743 38.234 39.245 752 HB3 PHE 98 HB3 PHE 98 42.328 38.257 40.748 753 HD1 PHE 98 HD1 PHE 98 42.747 36.139 42.124 754 HD2 PHE 98 HD2 PHE 98 44.502 36.749 38.533 755 HE1 PHE 98 HE1 PHE 98 44.304 34.475 42.610 756 HE2 PHE 98 HE2 PHE 98 46.057 35.086 39.018 757 HZ PHE 98 HZ PHE 98 45.992 33.960 41.065 758 H TYR 99 H TYR 99 39.427 38.179 41.350 759 HA TYR 99 HA TYR 99 38.100 39.920 39.790 760 HB2 TYR 99 HB2 TYR 99 36.405 39.950 41.278 761 HB3 TYR 99 HB3 TYR 99 36.796 38.448 41.118 762 HD1 TYR 99 HD1 TYR 99 36.265 40.895 43.457 763 HD2 TYR 99 HD2 TYR 99 38.270 37.413 42.971 764 HE1 TYR 99 HE1 TYR 99 36.523 40.723 45.763 765 HE2 TYR 99 HE2 TYR 99 38.633 37.302 45.274 766 HH TYR 99 HH TYR 99 38.257 38.256 47.294 767 H ASP 100 H ASP 100 38.065 42.181 40.028 768 HA ASP 100 HA ASP 100 39.841 43.470 41.662 769 HB2 ASP 100 HB2 ASP 100 40.659 43.134 39.431 770 HB3 ASP 100 HB3 ASP 100 39.414 43.901 38.887 Start of MODEL 6 1 HA PRO 8 HA PRO 8 56.412 43.417 26.476 2 HB2 PRO 8 HB2 PRO 8 55.317 41.209 25.802 3 HB3 PRO 8 HB3 PRO 8 56.852 41.211 26.078 4 HG2 PRO 8 HG2 PRO 8 54.822 40.433 27.936 5 HG3 PRO 8 HG3 PRO 8 56.129 39.641 27.629 6 HD2 PRO 8 HD2 PRO 8 56.107 41.192 29.667 7 HD3 PRO 8 HD3 PRO 8 57.429 41.063 28.849 8 H GLN 9 H GLN 9 55.108 45.240 27.110 9 HA GLN 9 HA GLN 9 52.560 45.020 27.796 10 HB2 GLN 9 HB2 GLN 9 54.080 46.736 28.577 11 HB3 GLN 9 HB3 GLN 9 54.019 47.374 27.155 12 HG2 GLN 9 HG2 GLN 9 51.605 47.087 28.558 13 HG3 GLN 9 HG3 GLN 9 52.542 48.262 28.968 14 HE21 GLN 9 HE21 GLN 9 50.195 49.069 28.222 15 HE22 GLN 9 HE22 GLN 9 50.177 49.704 26.875 16 H ARG 10 H ARG 10 53.863 45.589 24.651 17 HA ARG 10 HA ARG 10 51.705 46.303 23.391 18 HB2 ARG 10 HB2 ARG 10 53.941 44.943 22.288 19 HB3 ARG 10 HB3 ARG 10 52.853 45.646 21.419 20 HG2 ARG 10 HG2 ARG 10 53.581 47.769 22.216 21 HG3 ARG 10 HG3 ARG 10 54.662 47.069 23.097 22 HD2 ARG 10 HD2 ARG 10 54.672 46.711 20.285 23 HD3 ARG 10 HD3 ARG 10 55.437 47.913 20.919 24 HE ARG 10 HE ARG 10 56.590 46.078 22.120 25 HH11 ARG 10 HH11 ARG 10 58.176 44.560 21.587 26 HH12 ARG 10 HH12 ARG 10 58.390 44.205 20.156 27 HH21 ARG 10 HH21 ARG 10 56.151 46.054 18.849 28 HH22 ARG 10 HH22 ARG 10 57.230 45.060 18.591 29 H VAL 11 H VAL 11 52.969 43.120 23.874 30 HA VAL 11 HA VAL 11 51.102 41.625 22.833 31 HB VAL 11 HB VAL 11 52.904 40.885 24.866 32 HG11 VAL 11 HG11 VAL 11 52.557 38.632 24.170 33 HG12 VAL 11 HG12 VAL 11 51.197 39.272 24.668 34 HG13 VAL 11 HG13 VAL 11 51.488 39.138 23.117 35 HG21 VAL 11 HG21 VAL 11 54.289 39.976 23.154 36 HG22 VAL 11 HG22 VAL 11 53.280 40.530 22.065 37 HG23 VAL 11 HG23 VAL 11 54.117 41.539 22.955 38 H ALA 12 H ALA 12 51.393 42.788 26.132 39 HA ALA 12 HA ALA 12 49.335 41.628 27.196 40 HB1 ALA 12 HB1 ALA 12 49.599 43.239 28.929 41 HB2 ALA 12 HB2 ALA 12 51.003 42.618 28.537 42 HB3 ALA 12 HB3 ALA 12 50.594 44.052 28.005 43 H GLN 13 H GLN 13 49.209 44.598 25.378 44 HA GLN 13 HA GLN 13 46.697 45.165 25.869 45 HB2 GLN 13 HB2 GLN 13 48.294 46.147 23.754 46 HB3 GLN 13 HB3 GLN 13 46.867 46.697 24.055 47 HG2 GLN 13 HG2 GLN 13 49.137 47.075 25.696 48 HG3 GLN 13 HG3 GLN 13 48.408 48.197 24.895 49 HE21 GLN 13 HE21 GLN 13 46.375 49.076 25.832 50 HE22 GLN 13 HE22 GLN 13 46.043 48.855 27.267 51 H GLU 14 H GLU 14 48.023 43.292 23.204 52 HA GLU 14 HA GLU 14 45.727 42.813 22.006 53 HB2 GLU 14 HB2 GLU 14 48.176 41.442 21.647 54 HB3 GLU 14 HB3 GLU 14 46.910 41.091 20.807 55 HG2 GLU 14 HG2 GLU 14 47.047 43.623 20.308 56 HG3 GLU 14 HG3 GLU 14 48.563 43.329 20.520 57 H MET 15 H MET 15 47.340 40.976 24.464 58 HA MET 15 HA MET 15 45.784 38.916 24.711 59 HB2 MET 15 HB2 MET 15 47.475 40.145 26.619 60 HB3 MET 15 HB3 MET 15 46.695 38.840 26.965 61 HG2 MET 15 HG2 MET 15 48.459 38.785 24.771 62 HG3 MET 15 HG3 MET 15 49.066 38.662 26.203 63 HE1 MET 15 HE1 MET 15 49.649 35.114 25.339 64 HE2 MET 15 HE2 MET 15 50.004 36.434 24.538 65 HE3 MET 15 HE3 MET 15 50.234 36.372 26.103 66 H GLN 16 H GLN 16 45.447 42.001 26.390 67 HA GLN 16 HA GLN 16 43.353 41.454 27.813 68 HB2 GLN 16 HB2 GLN 16 44.471 43.936 27.054 69 HB3 GLN 16 HB3 GLN 16 43.109 43.936 27.815 70 HG2 GLN 16 HG2 GLN 16 44.058 43.061 29.721 71 HG3 GLN 16 HG3 GLN 16 45.350 42.629 28.964 72 HE21 GLN 16 HE21 GLN 16 46.944 44.263 28.478 73 HE22 GLN 16 HE22 GLN 16 46.935 45.610 29.117 74 H LYS 17 H LYS 17 43.370 42.934 24.655 75 HA LYS 17 HA LYS 17 40.835 43.257 24.131 76 HB2 LYS 17 HB2 LYS 17 42.456 44.214 22.793 77 HB3 LYS 17 HB3 LYS 17 43.059 42.820 22.441 78 HG2 LYS 17 HG2 LYS 17 41.951 43.628 20.576 79 HG3 LYS 17 HG3 LYS 17 41.210 42.347 21.065 80 HD2 LYS 17 HD2 LYS 17 39.415 43.522 21.810 81 HD3 LYS 17 HD3 LYS 17 40.221 44.853 21.912 82 HE2 LYS 17 HE2 LYS 17 38.867 45.073 20.051 83 HE3 LYS 17 HE3 LYS 17 40.323 44.931 19.510 84 HZ1 LYS 17 HZ1 LYS 17 38.925 43.586 18.346 85 HZ2 LYS 17 HZ2 LYS 17 39.881 42.744 19.046 86 HZ3 LYS 17 HZ3 LYS 17 38.525 42.875 19.549 87 H GLU 18 H GLU 18 42.607 40.345 23.413 88 HA GLU 18 HA GLU 18 40.554 39.055 22.378 89 HB2 GLU 18 HB2 GLU 18 43.077 38.674 22.148 90 HB3 GLU 18 HB3 GLU 18 42.784 37.594 23.235 91 HG2 GLU 18 HG2 GLU 18 42.569 36.455 21.264 92 HG3 GLU 18 HG3 GLU 18 41.096 36.680 21.723 93 H ILE 19 H ILE 19 41.874 38.829 25.579 94 HA ILE 19 HA ILE 19 40.332 36.879 26.494 95 HB ILE 19 HB ILE 19 41.889 38.688 27.954 96 HG12 ILE 19 HG12 ILE 19 42.537 35.958 27.403 97 HG13 ILE 19 HG13 ILE 19 43.107 37.117 26.529 98 HG21 ILE 19 HG21 ILE 19 41.659 37.183 29.809 99 HG22 ILE 19 HG22 ILE 19 40.239 37.744 29.386 100 HG23 ILE 19 HG23 ILE 19 40.678 36.288 28.945 101 HD11 ILE 19 HD11 ILE 19 44.733 36.435 28.078 102 HD12 ILE 19 HD12 ILE 19 44.324 37.934 28.386 103 HD13 ILE 19 HD13 ILE 19 43.745 36.758 29.273 104 H ALA 20 H ALA 20 39.831 40.356 26.681 105 HA ALA 20 HA ALA 20 37.582 40.373 27.995 106 HB1 ALA 20 HB1 ALA 20 37.370 42.584 27.169 107 HB2 ALA 20 HB2 ALA 20 38.838 42.342 27.708 108 HB3 ALA 20 HB3 ALA 20 38.551 42.308 26.152 109 H LEU 21 H LEU 21 37.978 40.004 24.556 110 HA LEU 21 HA LEU 21 35.449 39.979 23.802 111 HB2 LEU 21 HB2 LEU 21 37.175 40.409 22.288 112 HB3 LEU 21 HB3 LEU 21 37.762 38.982 22.515 113 HG LEU 21 HG LEU 21 35.902 38.031 21.481 114 HD11 LEU 21 HD11 LEU 21 34.305 39.330 20.344 115 HD12 LEU 21 HD12 LEU 21 34.246 39.612 21.901 116 HD13 LEU 21 HD13 LEU 21 34.963 40.644 20.937 117 HD21 LEU 21 HD21 LEU 21 36.402 38.777 19.248 118 HD22 LEU 21 HD22 LEU 21 37.130 40.045 19.854 119 HD23 LEU 21 HD23 LEU 21 37.743 38.600 20.071 120 H ILE 22 H ILE 22 37.466 37.233 24.578 121 HA ILE 22 HA ILE 22 35.682 35.341 24.160 122 HB ILE 22 HB ILE 22 38.162 35.180 25.468 123 HG12 ILE 22 HG12 ILE 22 37.549 34.200 22.859 124 HG13 ILE 22 HG13 ILE 22 38.155 35.623 23.055 125 HG21 ILE 22 HG21 ILE 22 38.004 32.834 25.309 126 HG22 ILE 22 HG22 ILE 22 36.843 33.403 26.223 127 HG23 ILE 22 HG23 ILE 22 36.539 32.978 24.728 128 HD11 ILE 22 HD11 ILE 22 39.861 34.126 22.450 129 HD12 ILE 22 HD12 ILE 22 40.149 34.669 23.909 130 HD13 ILE 22 HD13 ILE 22 39.534 33.224 23.710 131 H LEU 23 H LEU 23 36.487 36.915 27.177 132 HA LEU 23 HA LEU 23 34.893 35.576 28.764 133 HB2 LEU 23 HB2 LEU 23 36.387 37.907 29.078 134 HB3 LEU 23 HB3 LEU 23 35.195 37.760 30.073 135 HG LEU 23 HG LEU 23 36.064 35.794 30.903 136 HD11 LEU 23 HD11 LEU 23 38.161 34.930 30.339 137 HD12 LEU 23 HD12 LEU 23 37.154 34.852 29.120 138 HD13 LEU 23 HD13 LEU 23 38.263 35.982 29.160 139 HD21 LEU 23 HD21 LEU 23 38.022 36.682 31.977 140 HD22 LEU 23 HD22 LEU 23 38.048 37.849 30.906 141 HD23 LEU 23 HD23 LEU 23 36.862 37.760 31.952 142 H GLN 24 H GLN 24 34.015 38.235 26.774 143 HA GLN 24 HA GLN 24 31.523 38.474 27.746 144 HB2 GLN 24 HB2 GLN 24 32.721 40.373 26.882 145 HB3 GLN 24 HB3 GLN 24 32.619 39.751 25.456 146 HG2 GLN 24 HG2 GLN 24 30.298 40.008 25.441 147 HG3 GLN 24 HG3 GLN 24 30.292 40.433 26.942 148 HE21 GLN 24 HE21 GLN 24 31.101 42.635 27.465 149 HE22 GLN 24 HE22 GLN 24 31.128 43.702 26.426 150 H ARG 25 H ARG 25 32.785 36.752 25.019 151 HA ARG 25 HA ARG 25 30.344 36.195 24.109 152 HB2 ARG 25 HB2 ARG 25 32.836 36.066 22.711 153 HB3 ARG 25 HB3 ARG 25 31.525 35.567 22.031 154 HG2 ARG 25 HG2 ARG 25 32.138 38.250 22.665 155 HG3 ARG 25 HG3 ARG 25 31.920 37.681 21.230 156 HD2 ARG 25 HD2 ARG 25 29.887 38.274 23.110 157 HD3 ARG 25 HD3 ARG 25 30.032 38.896 21.687 158 HE ARG 25 HE ARG 25 28.971 36.430 22.196 159 HH11 ARG 25 HH11 ARG 25 27.600 35.478 20.729 160 HH12 ARG 25 HH12 ARG 25 27.493 36.028 19.348 161 HH21 ARG 25 HH21 ARG 25 29.522 38.467 19.654 162 HH22 ARG 25 HH22 ARG 25 28.599 37.747 18.732 163 H GLU 26 H GLU 26 32.767 34.281 25.425 164 HA GLU 26 HA GLU 26 31.626 31.914 24.694 165 HB2 GLU 26 HB2 GLU 26 33.932 31.916 24.677 166 HB3 GLU 26 HB3 GLU 26 33.985 32.383 26.164 167 HG2 GLU 26 HG2 GLU 26 34.454 30.165 26.201 168 HG3 GLU 26 HG3 GLU 26 33.024 30.307 26.808 169 H ILE 27 H ILE 27 32.382 33.341 27.822 170 HA ILE 27 HA ILE 27 30.792 31.723 29.264 171 HB ILE 27 HB ILE 27 31.402 32.980 31.103 172 HG12 ILE 27 HG12 ILE 27 32.950 34.645 29.459 173 HG13 ILE 27 HG13 ILE 27 31.589 35.083 30.083 174 HG21 ILE 27 HG21 ILE 27 33.677 32.381 31.135 175 HG22 ILE 27 HG22 ILE 27 32.790 31.209 30.545 176 HG23 ILE 27 HG23 ILE 27 33.622 32.140 29.571 177 HD11 ILE 27 HD11 ILE 27 33.341 35.932 31.358 178 HD12 ILE 27 HD12 ILE 27 32.507 34.911 32.236 179 HD13 ILE 27 HD13 ILE 27 33.889 34.465 31.603 180 H LYS 28 H LYS 28 28.839 32.501 30.590 181 HA LYS 28 HA LYS 28 27.140 33.903 29.030 182 HB2 LYS 28 HB2 LYS 28 26.585 32.693 31.522 183 HB3 LYS 28 HB3 LYS 28 25.493 33.296 30.586 184 HG2 LYS 28 HG2 LYS 28 25.976 31.607 28.985 185 HG3 LYS 28 HG3 LYS 28 27.000 30.982 29.983 186 HD2 LYS 28 HD2 LYS 28 25.217 30.580 31.504 187 HD3 LYS 28 HD3 LYS 28 24.216 31.123 30.437 188 HE2 LYS 28 HE2 LYS 28 24.756 29.338 29.006 189 HE3 LYS 28 HE3 LYS 28 25.786 28.803 30.047 190 HZ1 LYS 28 HZ1 LYS 28 23.822 27.674 30.241 191 HZ2 LYS 28 HZ2 LYS 28 24.047 28.401 31.479 192 HZ3 LYS 28 HZ3 LYS 28 23.088 28.900 30.509 193 H ASP 29 H ASP 29 28.134 36.106 29.177 194 HA ASP 29 HA ASP 29 28.467 37.428 31.441 195 HB2 ASP 29 HB2 ASP 29 29.455 37.941 29.244 196 HB3 ASP 29 HB3 ASP 29 28.195 38.839 29.057 197 HA PRO 30 HA PRO 30 24.107 39.319 30.710 198 HB2 PRO 30 HB2 PRO 30 22.928 36.761 30.135 199 HB3 PRO 30 HB3 PRO 30 22.356 38.139 29.681 200 HG2 PRO 30 HG2 PRO 30 23.607 36.793 27.952 201 HG3 PRO 30 HG3 PRO 30 23.854 38.333 27.967 202 HD2 PRO 30 HD2 PRO 30 25.588 36.343 28.930 203 HD3 PRO 30 HD3 PRO 30 25.995 37.713 28.303 204 H ARG 31 H ARG 31 24.463 36.118 32.036 205 HA ARG 31 HA ARG 31 23.039 36.474 34.247 206 HB2 ARG 31 HB2 ARG 31 23.639 34.351 33.168 207 HB3 ARG 31 HB3 ARG 31 25.042 34.499 33.834 208 HG2 ARG 31 HG2 ARG 31 24.231 34.099 35.920 209 HG3 ARG 31 HG3 ARG 31 22.775 34.500 35.525 210 HD2 ARG 31 HD2 ARG 31 22.779 32.191 35.754 211 HD3 ARG 31 HD3 ARG 31 22.601 32.482 34.233 212 HE ARG 31 HE ARG 31 25.187 32.122 34.796 213 HH11 ARG 31 HH11 ARG 31 26.329 30.324 34.191 214 HH12 ARG 31 HH12 ARG 31 25.615 29.088 33.764 215 HH21 ARG 31 HH21 ARG 31 22.611 30.173 34.100 216 HH22 ARG 31 HH22 ARG 31 23.439 28.998 33.711 217 H LEU 32 H LEU 32 26.104 37.629 33.723 218 HA LEU 32 HA LEU 32 26.456 38.545 36.230 219 HB2 LEU 32 HB2 LEU 32 28.363 38.394 34.114 220 HB3 LEU 32 HB3 LEU 32 28.707 38.993 35.513 221 HG LEU 32 HG LEU 32 28.033 36.269 35.161 222 HD11 LEU 32 HD11 LEU 32 30.378 35.833 35.404 223 HD12 LEU 32 HD12 LEU 32 30.134 36.752 34.137 224 HD13 LEU 32 HD13 LEU 32 30.644 37.391 35.493 225 HD21 LEU 32 HD21 LEU 32 28.868 35.923 37.341 226 HD22 LEU 32 HD22 LEU 32 29.156 37.474 37.474 227 HD23 LEU 32 HD23 LEU 32 27.665 36.950 37.379 228 H GLY 33 H GLY 33 24.753 39.784 33.966 229 HA2 GLY 33 HA2 GLY 33 23.840 41.750 33.866 230 HA3 GLY 33 HA3 GLY 33 25.087 42.376 34.563 231 H MET 34 H MET 34 25.980 40.584 31.872 232 HA MET 34 HA MET 34 27.085 40.979 30.123 233 HB2 MET 34 HB2 MET 34 24.763 41.295 29.432 234 HB3 MET 34 HB3 MET 34 25.085 42.820 29.386 235 HG2 MET 34 HG2 MET 34 25.309 41.974 27.238 236 HG3 MET 34 HG3 MET 34 26.713 42.446 27.724 237 HE1 MET 34 HE1 MET 34 27.581 39.647 25.355 238 HE2 MET 34 HE2 MET 34 26.398 40.690 25.212 239 HE3 MET 34 HE3 MET 34 27.828 41.175 25.687 240 H MET 35 H MET 35 28.356 42.227 32.131 241 HA MET 35 HA MET 35 29.698 44.305 31.154 242 HB2 MET 35 HB2 MET 35 27.616 45.211 32.095 243 HB3 MET 35 HB3 MET 35 28.221 44.876 33.492 244 HG2 MET 35 HG2 MET 35 29.540 46.611 33.468 245 HG3 MET 35 HG3 MET 35 29.962 46.372 31.985 246 HE1 MET 35 HE1 MET 35 27.470 48.154 29.864 247 HE2 MET 35 HE2 MET 35 28.877 47.427 29.877 248 HE3 MET 35 HE3 MET 35 27.560 46.608 30.198 249 H THR 36 H THR 36 30.601 41.711 32.075 250 HA THR 36 HA THR 36 32.342 42.332 34.023 251 HB THR 36 HB THR 36 32.360 39.858 32.772 252 HG1 THR 36 HG1 THR 36 30.393 39.856 33.509 253 HG21 THR 36 HG21 THR 36 33.180 39.030 34.829 254 HG22 THR 36 HG22 THR 36 34.128 40.162 34.256 255 HG23 THR 36 HG23 THR 36 33.115 40.496 35.426 256 H THR 37 H THR 37 34.580 42.877 33.599 257 HA THR 37 HA THR 37 35.502 42.776 31.066 258 HB THR 37 HB THR 37 35.906 45.107 32.560 259 HG1 THR 37 HG1 THR 37 34.205 46.021 31.425 260 HG21 THR 37 HG21 THR 37 36.282 46.172 30.450 261 HG22 THR 37 HG22 THR 37 37.276 44.954 30.644 262 HG23 THR 37 HG23 THR 37 35.995 44.791 29.726 263 H VAL 38 H VAL 38 37.918 42.750 30.828 264 HA VAL 38 HA VAL 38 39.411 42.009 32.940 265 HB VAL 38 HB VAL 38 40.163 42.311 30.274 266 HG11 VAL 38 HG11 VAL 38 42.175 41.150 30.790 267 HG12 VAL 38 HG12 VAL 38 42.091 42.517 31.583 268 HG13 VAL 38 HG13 VAL 38 41.763 41.154 32.318 269 HG21 VAL 38 HG21 VAL 38 40.216 39.924 30.175 270 HG22 VAL 38 HG22 VAL 38 39.685 39.873 31.666 271 HG23 VAL 38 HG23 VAL 38 38.759 40.441 30.513 272 H SER 39 H SER 39 40.347 43.636 34.286 273 HA SER 39 HA SER 39 40.735 46.124 33.418 274 HB2 SER 39 HB2 SER 39 41.217 46.681 35.632 275 HB3 SER 39 HB3 SER 39 39.841 45.953 35.544 276 HG SER 39 HG SER 39 41.193 45.185 37.144 277 H GLY 40 H GLY 40 42.833 43.478 33.949 278 HA2 GLY 40 HA2 GLY 40 44.784 44.392 32.483 279 HA3 GLY 40 HA3 GLY 40 45.188 44.509 33.985 280 H VAL 41 H VAL 41 46.781 42.905 32.475 281 HA VAL 41 HA VAL 41 46.472 40.415 33.502 282 HB VAL 41 HB VAL 41 47.515 39.474 31.668 283 HG11 VAL 41 HG11 VAL 41 45.675 39.614 30.135 284 HG12 VAL 41 HG12 VAL 41 45.155 39.454 31.622 285 HG13 VAL 41 HG13 VAL 41 45.142 40.877 30.927 286 HG21 VAL 41 HG21 VAL 41 47.815 40.624 29.638 287 HG22 VAL 41 HG22 VAL 41 47.414 41.974 30.363 288 HG23 VAL 41 HG23 VAL 41 48.742 41.217 30.778 289 H GLU 42 H GLU 42 48.520 39.253 34.049 290 HA GLU 42 HA GLU 42 50.907 40.520 33.925 291 HB2 GLU 42 HB2 GLU 42 49.905 40.936 36.105 292 HB3 GLU 42 HB3 GLU 42 50.023 39.405 36.376 293 HG2 GLU 42 HG2 GLU 42 52.392 39.565 36.211 294 HG3 GLU 42 HG3 GLU 42 52.265 41.100 35.962 295 H MET 43 H MET 43 52.417 39.107 32.986 296 HA MET 43 HA MET 43 51.759 36.489 32.733 297 HB2 MET 43 HB2 MET 43 52.988 38.059 30.699 298 HB3 MET 43 HB3 MET 43 52.553 36.574 30.510 299 HG2 MET 43 HG2 MET 43 50.271 37.237 30.774 300 HG3 MET 43 HG3 MET 43 50.734 38.722 30.889 301 HE1 MET 43 HE1 MET 43 51.917 39.663 27.442 302 HE2 MET 43 HE2 MET 43 51.600 40.218 28.892 303 HE3 MET 43 HE3 MET 43 52.795 39.202 28.677 304 H SER 44 H SER 44 53.336 34.812 32.761 305 HA SER 44 HA SER 44 55.666 35.143 33.939 306 HB2 SER 44 HB2 SER 44 54.355 33.110 34.104 307 HB3 SER 44 HB3 SER 44 54.660 32.817 32.603 308 HG SER 44 HG SER 44 56.309 31.866 33.316 309 H ARG 45 H ARG 45 57.870 34.791 33.043 310 HA ARG 45 HA ARG 45 58.406 35.934 30.729 311 HB2 ARG 45 HB2 ARG 45 59.822 35.970 32.727 312 HB3 ARG 45 HB3 ARG 45 60.220 34.495 32.412 313 HG2 ARG 45 HG2 ARG 45 61.361 35.124 30.505 314 HG3 ARG 45 HG3 ARG 45 60.781 36.570 30.570 315 HD2 ARG 45 HD2 ARG 45 62.031 36.771 32.709 316 HD3 ARG 45 HD3 ARG 45 62.818 35.514 32.226 317 HE ARG 45 HE ARG 45 63.427 36.846 30.330 318 HH11 ARG 45 HH11 ARG 45 64.238 38.855 29.714 319 HH12 ARG 45 HH12 ARG 45 64.492 39.888 30.757 320 HH21 ARG 45 HH21 ARG 45 63.264 38.403 33.264 321 HH22 ARG 45 HH22 ARG 45 63.942 39.633 32.767 322 H ASP 46 H ASP 46 58.107 32.651 31.371 323 HA ASP 46 HA ASP 46 58.836 31.752 28.953 324 HB2 ASP 46 HB2 ASP 46 58.607 29.630 29.918 325 HB3 ASP 46 HB3 ASP 46 59.480 30.508 30.867 326 H LEU 47 H LEU 47 56.079 33.115 29.810 327 HA LEU 47 HA LEU 47 54.011 33.031 29.455 328 HB2 LEU 47 HB2 LEU 47 54.836 32.176 26.902 329 HB3 LEU 47 HB3 LEU 47 53.389 32.672 27.210 330 HG LEU 47 HG LEU 47 55.657 34.326 27.460 331 HD11 LEU 47 HD11 LEU 47 54.914 35.372 25.429 332 HD12 LEU 47 HD12 LEU 47 55.227 33.843 25.164 333 HD13 LEU 47 HD13 LEU 47 53.729 34.326 25.343 334 HD21 LEU 47 HD21 LEU 47 54.161 36.156 27.604 335 HD22 LEU 47 HD22 LEU 47 52.938 35.151 27.539 336 HD23 LEU 47 HD23 LEU 47 53.904 35.142 28.794 337 H ALA 48 H ALA 48 54.923 30.584 30.850 338 HA ALA 48 HA ALA 48 53.287 28.615 30.088 339 HB1 ALA 48 HB1 ALA 48 54.239 27.461 31.923 340 HB2 ALA 48 HB2 ALA 48 55.382 28.068 31.010 341 HB3 ALA 48 HB3 ALA 48 54.983 28.789 32.362 342 H TYR 49 H TYR 49 53.028 31.067 32.429 343 HA TYR 49 HA TYR 49 50.471 30.499 33.061 344 HB2 TYR 49 HB2 TYR 49 52.485 31.070 34.986 345 HB3 TYR 49 HB3 TYR 49 50.969 31.076 35.354 346 HD1 TYR 49 HD1 TYR 49 49.691 28.868 35.163 347 HD2 TYR 49 HD2 TYR 49 53.738 29.012 35.123 348 HE1 TYR 49 HE1 TYR 49 49.786 26.595 35.694 349 HE2 TYR 49 HE2 TYR 49 53.834 26.735 35.654 350 HH TYR 49 HH TYR 49 52.648 24.872 36.166 351 H ALA 50 H ALA 50 49.096 32.356 33.460 352 HA ALA 50 HA ALA 50 50.130 34.809 33.829 353 HB1 ALA 50 HB1 ALA 50 48.686 35.763 32.203 354 HB2 ALA 50 HB2 ALA 50 49.693 34.754 31.515 355 HB3 ALA 50 HB3 ALA 50 48.200 34.311 31.799 356 H LYS 51 H LYS 51 49.068 36.134 35.296 357 HA LYS 51 HA LYS 51 46.735 35.474 36.444 358 HB2 LYS 51 HB2 LYS 51 48.393 37.689 37.053 359 HB3 LYS 51 HB3 LYS 51 47.137 37.286 37.884 360 HG2 LYS 51 HG2 LYS 51 48.252 35.244 38.506 361 HG3 LYS 51 HG3 LYS 51 49.524 35.740 37.752 362 HD2 LYS 51 HD2 LYS 51 48.455 37.135 39.991 363 HD3 LYS 51 HD3 LYS 51 49.639 36.128 40.129 364 HE2 LYS 51 HE2 LYS 51 50.991 37.511 38.751 365 HE3 LYS 51 HE3 LYS 51 49.804 38.505 38.568 366 HZ1 LYS 51 HZ1 LYS 51 51.344 39.185 40.166 367 HZ2 LYS 51 HZ2 LYS 51 49.995 39.139 40.705 368 HZ3 LYS 51 HZ3 LYS 51 50.939 38.081 41.019 369 H VAL 52 H VAL 52 44.722 36.436 35.875 370 HA VAL 52 HA VAL 52 44.622 38.632 34.266 371 HB VAL 52 HB VAL 52 42.689 36.629 34.315 372 HG11 VAL 52 HG11 VAL 52 41.730 37.736 32.416 373 HG12 VAL 52 HG12 VAL 52 41.735 38.694 33.677 374 HG13 VAL 52 HG13 VAL 52 42.832 38.867 32.547 375 HG21 VAL 52 HG21 VAL 52 43.377 36.021 32.116 376 HG22 VAL 52 HG22 VAL 52 44.559 37.071 32.216 377 HG23 VAL 52 HG23 VAL 52 44.550 35.795 33.155 378 H TYR 53 H TYR 53 43.739 40.458 35.256 379 HA TYR 53 HA TYR 53 42.282 40.369 37.541 380 HB2 TYR 53 HB2 TYR 53 43.467 42.651 36.382 381 HB3 TYR 53 HB3 TYR 53 42.884 42.566 37.826 382 HD1 TYR 53 HD1 TYR 53 44.151 40.468 39.178 383 HD2 TYR 53 HD2 TYR 53 45.830 42.891 36.399 384 HE1 TYR 53 HE1 TYR 53 46.264 39.875 39.938 385 HE2 TYR 53 HE2 TYR 53 47.955 42.330 37.192 386 HH TYR 53 HH TYR 53 49.156 41.088 38.697 387 H VAL 54 H VAL 54 40.051 40.738 37.548 388 HA VAL 54 HA VAL 54 38.758 41.532 35.287 389 HB VAL 54 HB VAL 54 37.970 39.364 36.865 390 HG11 VAL 54 HG11 VAL 54 36.405 38.811 35.147 391 HG12 VAL 54 HG12 VAL 54 36.106 40.245 35.750 392 HG13 VAL 54 HG13 VAL 54 36.850 40.110 34.359 393 HG21 VAL 54 HG21 VAL 54 38.577 37.898 35.047 394 HG22 VAL 54 HG22 VAL 54 39.150 39.151 34.265 395 HG23 VAL 54 HG23 VAL 54 39.848 38.663 35.600 396 H THR 55 H THR 55 36.778 42.791 35.674 397 HA THR 55 HA THR 55 36.084 43.380 38.229 398 HB THR 55 HB THR 55 37.395 45.084 37.418 399 HG1 THR 55 HG1 THR 55 35.990 45.793 38.847 400 HG21 THR 55 HG21 THR 55 36.644 46.599 35.807 401 HG22 THR 55 HG22 THR 55 36.904 45.170 35.173 402 HG23 THR 55 HG23 THR 55 35.424 45.641 35.488 403 H PHE 56 H PHE 56 33.914 43.496 38.727 404 HA PHE 56 HA PHE 56 32.134 42.608 36.875 405 HB2 PHE 56 HB2 PHE 56 32.389 41.940 39.629 406 HB3 PHE 56 HB3 PHE 56 31.087 41.580 38.848 407 HD1 PHE 56 HD1 PHE 56 34.615 40.862 38.570 408 HD2 PHE 56 HD2 PHE 56 30.882 39.399 38.048 409 HE1 PHE 56 HE1 PHE 56 35.510 38.771 38.053 410 HE2 PHE 56 HE2 PHE 56 31.768 37.294 37.591 411 HZ PHE 56 HZ PHE 56 34.083 36.974 37.578 412 H LEU 57 H LEU 57 30.256 43.895 36.481 413 HA LEU 57 HA LEU 57 29.290 45.761 38.096 414 HB2 LEU 57 HB2 LEU 57 28.789 45.655 35.767 415 HB3 LEU 57 HB3 LEU 57 27.995 44.334 36.005 416 HG LEU 57 HG LEU 57 26.420 45.547 37.301 417 HD11 LEU 57 HD11 LEU 57 26.398 47.914 37.211 418 HD12 LEU 57 HD12 LEU 57 27.713 47.403 37.931 419 HD13 LEU 57 HD13 LEU 57 27.772 47.887 36.425 420 HD21 LEU 57 HD21 LEU 57 25.335 46.605 35.468 421 HD22 LEU 57 HD22 LEU 57 26.682 46.523 34.640 422 HD23 LEU 57 HD23 LEU 57 25.907 45.197 35.026 423 H ASN 58 H ASN 58 28.994 42.396 38.246 424 HA ASN 58 HA ASN 58 26.699 42.183 39.604 425 HB2 ASN 58 HB2 ASN 58 28.059 40.591 37.991 426 HB3 ASN 58 HB3 ASN 58 28.269 39.916 39.382 427 HD21 ASN 58 HD21 ASN 58 24.590 40.059 38.034 428 HD22 ASN 58 HD22 ASN 58 25.472 41.247 37.857 429 H ASP 59 H ASP 59 29.238 43.355 40.858 430 HA ASP 59 HA ASP 59 30.007 42.163 43.007 431 HB2 ASP 59 HB2 ASP 59 31.167 43.969 41.904 432 HB3 ASP 59 HB3 ASP 59 30.024 44.949 42.307 433 H LYS 60 H LYS 60 27.047 43.681 42.720 434 HA LYS 60 HA LYS 60 26.502 44.316 45.221 435 HB2 LYS 60 HB2 LYS 60 25.334 45.232 43.366 436 HB3 LYS 60 HB3 LYS 60 24.701 43.834 43.082 437 HG2 LYS 60 HG2 LYS 60 23.387 43.962 44.997 438 HG3 LYS 60 HG3 LYS 60 24.141 45.236 45.487 439 HD2 LYS 60 HD2 LYS 60 23.207 46.539 43.794 440 HD3 LYS 60 HD3 LYS 60 22.653 45.281 43.058 441 HE2 LYS 60 HE2 LYS 60 20.858 46.325 44.093 442 HE3 LYS 60 HE3 LYS 60 21.076 44.956 44.808 443 HZ1 LYS 60 HZ1 LYS 60 20.770 46.595 46.334 444 HZ2 LYS 60 HZ2 LYS 60 22.114 46.069 46.503 445 HZ3 LYS 60 HZ3 LYS 60 21.912 47.344 45.837 446 H ASP 61 H ASP 61 26.609 41.158 44.031 447 HA ASP 61 HA ASP 61 26.411 40.425 46.630 448 HB2 ASP 61 HB2 ASP 61 24.476 39.597 45.506 449 HB3 ASP 61 HB3 ASP 61 25.402 38.765 44.568 450 H GLU 62 H GLU 62 28.342 39.624 47.403 451 HA GLU 62 HA GLU 62 30.460 39.111 46.043 452 HB2 GLU 62 HB2 GLU 62 29.950 38.197 48.689 453 HB3 GLU 62 HB3 GLU 62 31.376 38.328 48.071 454 HG2 GLU 62 HG2 GLU 62 31.439 40.227 49.160 455 HG3 GLU 62 HG3 GLU 62 30.660 40.787 47.930 456 H ASP 63 H ASP 63 28.030 36.840 46.951 457 HA ASP 63 HA ASP 63 29.202 34.594 46.275 458 HB2 ASP 63 HB2 ASP 63 27.368 34.585 47.748 459 HB3 ASP 63 HB3 ASP 63 26.439 35.150 46.630 460 H ALA 64 H ALA 64 27.300 36.739 44.344 461 HA ALA 64 HA ALA 64 27.121 35.264 42.147 462 HB1 ALA 64 HB1 ALA 64 26.285 37.236 41.182 463 HB2 ALA 64 HB2 ALA 64 25.565 36.964 42.566 464 HB3 ALA 64 HB3 ALA 64 26.714 38.048 42.472 465 H VAL 65 H VAL 65 29.511 37.643 43.009 466 HA VAL 65 HA VAL 65 31.041 37.451 40.897 467 HB VAL 65 HB VAL 65 31.811 38.272 43.466 468 HG11 VAL 65 HG11 VAL 65 33.722 39.285 42.472 469 HG12 VAL 65 HG12 VAL 65 33.757 37.716 42.256 470 HG13 VAL 65 HG13 VAL 65 33.307 38.669 41.073 471 HG21 VAL 65 HG21 VAL 65 31.622 40.496 42.583 472 HG22 VAL 65 HG22 VAL 65 31.146 39.889 41.200 473 HG23 VAL 65 HG23 VAL 65 30.228 39.751 42.483 474 H LYS 66 H LYS 66 31.254 35.625 43.882 475 HA LYS 66 HA LYS 66 33.306 34.080 43.439 476 HB2 LYS 66 HB2 LYS 66 32.307 34.321 45.569 477 HB3 LYS 66 HB3 LYS 66 31.030 33.581 45.066 478 HG2 LYS 66 HG2 LYS 66 32.196 32.071 46.346 479 HG3 LYS 66 HG3 LYS 66 32.301 31.571 44.872 480 HD2 LYS 66 HD2 LYS 66 34.491 32.503 44.720 481 HD3 LYS 66 HD3 LYS 66 34.385 32.978 46.202 482 HE2 LYS 66 HE2 LYS 66 34.093 30.644 46.841 483 HE3 LYS 66 HE3 LYS 66 34.426 30.254 45.368 484 HZ1 LYS 66 HZ1 LYS 66 36.312 30.150 46.647 485 HZ2 LYS 66 HZ2 LYS 66 36.504 31.186 45.646 486 HZ3 LYS 66 HZ3 LYS 66 36.195 31.549 47.019 487 H ALA 67 H ALA 67 30.026 33.298 42.646 488 HA ALA 67 HA ALA 67 30.398 30.993 41.463 489 HB1 ALA 67 HB1 ALA 67 28.131 31.309 40.794 490 HB2 ALA 67 HB2 ALA 67 28.286 31.651 42.332 491 HB3 ALA 67 HB3 ALA 67 28.209 32.818 41.265 492 H GLY 68 H GLY 68 30.431 34.136 40.021 493 HA2 GLY 68 HA2 GLY 68 30.673 33.543 37.498 494 HA3 GLY 68 HA3 GLY 68 31.093 34.896 38.149 495 H ILE 69 H ILE 69 33.264 34.245 39.754 496 HA ILE 69 HA ILE 69 35.381 33.811 38.288 497 HB ILE 69 HB ILE 69 35.021 33.800 41.065 498 HG12 ILE 69 HG12 ILE 69 34.928 35.950 40.063 499 HG13 ILE 69 HG13 ILE 69 36.036 35.873 41.157 500 HG21 ILE 69 HG21 ILE 69 37.369 33.738 41.422 501 HG22 ILE 69 HG22 ILE 69 36.854 32.395 40.759 502 HG23 ILE 69 HG23 ILE 69 37.578 33.489 39.872 503 HD11 ILE 69 HD11 ILE 69 36.857 37.044 39.298 504 HD12 ILE 69 HD12 ILE 69 37.700 35.714 39.479 505 HD13 ILE 69 HD13 ILE 69 36.575 35.793 38.368 506 H LYS 70 H LYS 70 33.692 31.460 40.263 507 HA LYS 70 HA LYS 70 35.193 29.365 39.848 508 HB2 LYS 70 HB2 LYS 70 33.480 29.586 41.569 509 HB3 LYS 70 HB3 LYS 70 32.435 29.219 40.471 510 HG2 LYS 70 HG2 LYS 70 33.502 27.129 40.143 511 HG3 LYS 70 HG3 LYS 70 34.565 27.497 41.222 512 HD2 LYS 70 HD2 LYS 70 33.085 26.121 42.306 513 HD3 LYS 70 HD3 LYS 70 32.775 27.545 42.860 514 HE2 LYS 70 HE2 LYS 70 30.969 27.740 41.324 515 HE3 LYS 70 HE3 LYS 70 31.273 26.305 40.793 516 HZ1 LYS 70 HZ1 LYS 70 29.600 26.229 42.331 517 HZ2 LYS 70 HZ2 LYS 70 30.730 25.483 42.859 518 HZ3 LYS 70 HZ3 LYS 70 30.448 26.820 43.354 519 H ALA 71 H ALA 71 32.442 30.323 37.959 520 HA ALA 71 HA ALA 71 32.415 28.389 36.209 521 HB1 ALA 71 HB1 ALA 71 30.903 29.833 35.044 522 HB2 ALA 71 HB2 ALA 71 30.516 29.769 36.578 523 HB3 ALA 71 HB3 ALA 71 31.310 31.018 36.015 524 H LEU 72 H LEU 72 33.990 31.429 35.973 525 HA LEU 72 HA LEU 72 35.058 31.356 33.563 526 HB2 LEU 72 HB2 LEU 72 34.761 33.360 34.683 527 HB3 LEU 72 HB3 LEU 72 35.593 32.858 35.903 528 HG LEU 72 HG LEU 72 37.565 33.030 34.671 529 HD11 LEU 72 HD11 LEU 72 37.599 33.958 32.518 530 HD12 LEU 72 HD12 LEU 72 36.780 32.602 32.514 531 HD13 LEU 72 HD13 LEU 72 36.016 33.988 32.506 532 HD21 LEU 72 HD21 LEU 72 37.587 35.419 34.497 533 HD22 LEU 72 HD22 LEU 72 36.004 35.424 34.538 534 HD23 LEU 72 HD23 LEU 72 36.828 34.986 35.818 535 H GLN 73 H GLN 73 36.497 30.311 36.546 536 HA GLN 73 HA GLN 73 38.767 29.437 35.493 537 HB2 GLN 73 HB2 GLN 73 38.362 30.164 37.823 538 HB3 GLN 73 HB3 GLN 73 37.881 28.699 38.060 539 HG2 GLN 73 HG2 GLN 73 40.094 28.797 38.715 540 HG3 GLN 73 HG3 GLN 73 40.039 27.904 37.438 541 HE21 GLN 73 HE21 GLN 73 41.332 28.541 35.641 542 HE22 GLN 73 HE22 GLN 73 42.070 29.833 35.561 543 H GLU 74 H GLU 74 35.847 27.672 36.107 544 HA GLU 74 HA GLU 74 36.613 25.251 35.419 545 HB2 GLU 74 HB2 GLU 74 34.598 25.752 36.630 546 HB3 GLU 74 HB3 GLU 74 34.008 26.425 35.352 547 HG2 GLU 74 HG2 GLU 74 33.954 24.333 34.254 548 HG3 GLU 74 HG3 GLU 74 34.593 23.648 35.501 549 H ALA 75 H ALA 75 35.582 27.774 33.353 550 HA ALA 75 HA ALA 75 35.731 26.429 31.042 551 HB1 ALA 75 HB1 ALA 75 34.991 28.525 30.160 552 HB2 ALA 75 HB2 ALA 75 34.049 28.084 31.354 553 HB3 ALA 75 HB3 ALA 75 35.169 29.178 31.592 554 H SER 76 H SER 76 38.249 27.564 32.745 555 HA SER 76 HA SER 76 39.455 29.180 31.160 556 HB2 SER 76 HB2 SER 76 41.298 29.042 32.625 557 HB3 SER 76 HB3 SER 76 39.981 29.198 33.444 558 HG SER 76 HG SER 76 40.060 27.117 33.926 559 H GLY 77 H GLY 77 39.836 25.768 31.075 560 HA2 GLY 77 HA2 GLY 77 41.871 25.512 29.452 561 HA3 GLY 77 HA3 GLY 77 40.771 24.433 29.688 562 H PHE 78 H PHE 78 38.474 25.650 28.557 563 HA PHE 78 HA PHE 78 38.754 25.551 25.953 564 HB2 PHE 78 HB2 PHE 78 36.534 26.501 27.426 565 HB3 PHE 78 HB3 PHE 78 36.492 26.286 25.882 566 HD1 PHE 78 HD1 PHE 78 35.516 24.809 28.717 567 HD2 PHE 78 HD2 PHE 78 37.159 23.785 25.161 568 HE1 PHE 78 HE1 PHE 78 34.865 22.582 29.056 569 HE2 PHE 78 HE2 PHE 78 36.491 21.576 25.487 570 HZ PHE 78 HZ PHE 78 35.354 20.974 27.434 571 H ILE 79 H ILE 79 38.581 28.342 28.003 572 HA ILE 79 HA ILE 79 38.711 30.312 26.285 573 HB ILE 79 HB ILE 79 39.461 30.254 28.990 574 HG12 ILE 79 HG12 ILE 79 37.132 31.460 27.869 575 HG13 ILE 79 HG13 ILE 79 37.095 30.006 28.427 576 HG21 ILE 79 HG21 ILE 79 39.537 32.611 28.981 577 HG22 ILE 79 HG22 ILE 79 40.648 32.020 28.020 578 HG23 ILE 79 HG23 ILE 79 39.309 32.609 27.414 579 HD11 ILE 79 HD11 ILE 79 36.219 31.478 30.028 580 HD12 ILE 79 HD12 ILE 79 37.538 30.817 30.604 581 HD13 ILE 79 HD13 ILE 79 37.576 32.295 30.036 582 H ARG 80 H ARG 80 41.435 28.724 27.789 583 HA ARG 80 HA ARG 80 43.437 29.864 26.550 584 HB2 ARG 80 HB2 ARG 80 43.975 28.750 28.437 585 HB3 ARG 80 HB3 ARG 80 43.159 27.485 28.027 586 HG2 ARG 80 HG2 ARG 80 44.813 26.779 26.598 587 HG3 ARG 80 HG3 ARG 80 45.565 28.141 26.702 588 HD2 ARG 80 HD2 ARG 80 46.603 26.340 27.909 589 HD3 ARG 80 HD3 ARG 80 46.420 27.648 28.737 590 HE ARG 80 HE ARG 80 45.223 26.521 30.152 591 HH11 ARG 80 HH11 ARG 80 44.364 24.785 31.151 592 HH12 ARG 80 HH12 ARG 80 43.860 23.633 30.353 593 HH21 ARG 80 HH21 ARG 80 44.680 24.691 27.442 594 HH22 ARG 80 HH22 ARG 80 44.044 23.581 28.203 595 H SER 81 H SER 81 41.795 27.010 25.464 596 HA SER 81 HA SER 81 43.133 26.460 23.312 597 HB2 SER 81 HB2 SER 81 41.549 24.956 24.239 598 HB3 SER 81 HB3 SER 81 40.389 25.903 23.803 599 HG SER 81 HG SER 81 40.701 24.314 22.317 600 H LEU 82 H LEU 82 40.309 28.507 23.458 601 HA LEU 82 HA LEU 82 40.170 29.231 20.955 602 HB2 LEU 82 HB2 LEU 82 39.025 30.396 23.295 603 HB3 LEU 82 HB3 LEU 82 38.679 30.937 21.873 604 HG LEU 82 HG LEU 82 38.111 28.267 22.583 605 HD11 LEU 82 HD11 LEU 82 35.858 28.956 23.016 606 HD12 LEU 82 HD12 LEU 82 36.848 29.688 24.012 607 HD13 LEU 82 HD13 LEU 82 36.283 30.458 22.749 608 HD21 LEU 82 HD21 LEU 82 36.568 28.279 20.800 609 HD22 LEU 82 HD22 LEU 82 36.971 29.775 20.472 610 HD23 LEU 82 HD23 LEU 82 38.024 28.609 20.272 611 H LEU 83 H LEU 83 41.792 30.827 23.553 612 HA LEU 83 HA LEU 83 42.429 33.114 22.481 613 HB2 LEU 83 HB2 LEU 83 42.398 32.632 24.838 614 HB3 LEU 83 HB3 LEU 83 43.663 31.738 24.652 615 HG LEU 83 HG LEU 83 44.878 33.703 24.008 616 HD11 LEU 83 HD11 LEU 83 43.929 35.806 24.554 617 HD12 LEU 83 HD12 LEU 83 43.049 35.087 23.451 618 HD13 LEU 83 HD13 LEU 83 42.581 35.084 24.964 619 HD21 LEU 83 HD21 LEU 83 45.155 34.507 26.225 620 HD22 LEU 83 HD22 LEU 83 43.821 33.768 26.651 621 HD23 LEU 83 HD23 LEU 83 45.093 32.925 26.229 622 H GLY 84 H GLY 84 44.367 30.246 22.573 623 HA2 GLY 84 HA2 GLY 84 46.564 31.038 21.452 624 HA3 GLY 84 HA3 GLY 84 46.068 29.560 21.470 625 H LYS 85 H LYS 85 43.773 29.702 19.850 626 HA LYS 85 HA LYS 85 44.608 29.870 17.338 627 HB2 LYS 85 HB2 LYS 85 43.017 28.255 18.022 628 HB3 LYS 85 HB3 LYS 85 42.009 29.388 18.388 629 HG2 LYS 85 HG2 LYS 85 41.594 29.879 16.186 630 HG3 LYS 85 HG3 LYS 85 42.879 29.141 15.701 631 HD2 LYS 85 HD2 LYS 85 41.942 27.052 16.211 632 HD3 LYS 85 HD3 LYS 85 40.710 27.729 16.886 633 HE2 LYS 85 HE2 LYS 85 39.883 28.427 14.836 634 HE3 LYS 85 HE3 LYS 85 41.191 27.996 14.107 635 HZ1 LYS 85 HZ1 LYS 85 39.584 26.398 13.832 636 HZ2 LYS 85 HZ2 LYS 85 40.676 25.810 14.589 637 HZ3 LYS 85 HZ3 LYS 85 39.456 26.212 15.267 638 H ALA 86 H ALA 86 42.772 32.130 19.130 639 HA ALA 86 HA ALA 86 41.907 33.660 17.207 640 HB1 ALA 86 HB1 ALA 86 41.349 35.139 19.006 641 HB2 ALA 86 HB2 ALA 86 40.907 33.660 19.360 642 HB3 ALA 86 HB3 ALA 86 42.234 34.261 19.982 643 H MET 87 H MET 87 44.860 34.031 18.948 644 HA MET 87 HA MET 87 45.661 36.137 17.470 645 HB2 MET 87 HB2 MET 87 46.588 35.222 19.985 646 HB3 MET 87 HB3 MET 87 47.436 36.254 19.180 647 HG2 MET 87 HG2 MET 87 45.589 37.772 19.224 648 HG3 MET 87 HG3 MET 87 44.783 36.745 20.078 649 HE1 MET 87 HE1 MET 87 46.296 36.742 23.461 650 HE2 MET 87 HE2 MET 87 45.047 36.299 22.593 651 HE3 MET 87 HE3 MET 87 46.479 35.697 22.285 652 H ARG 88 H ARG 88 45.933 33.123 16.713 653 HA ARG 88 HA ARG 88 47.216 31.747 15.784 654 HB2 ARG 88 HB2 ARG 88 48.536 33.883 14.513 655 HB3 ARG 88 HB3 ARG 88 48.350 32.443 13.943 656 HG2 ARG 88 HG2 ARG 88 45.998 32.869 13.720 657 HG3 ARG 88 HG3 ARG 88 46.237 34.330 14.209 658 HD2 ARG 88 HD2 ARG 88 46.218 34.660 12.017 659 HD3 ARG 88 HD3 ARG 88 47.752 34.509 12.254 660 HE ARG 88 HE ARG 88 46.188 32.561 11.136 661 HH11 ARG 88 HH11 ARG 88 46.988 31.300 9.536 662 HH12 ARG 88 HH12 ARG 88 48.460 31.179 9.341 663 HH21 ARG 88 HH21 ARG 88 49.415 33.288 11.539 664 HH22 ARG 88 HH22 ARG 88 49.856 32.322 10.495 665 H LEU 89 H LEU 89 48.037 32.025 18.359 666 HA LEU 89 HA LEU 89 50.571 32.865 18.720 667 HB2 LEU 89 HB2 LEU 89 48.824 33.506 20.194 668 HB3 LEU 89 HB3 LEU 89 48.575 32.009 20.557 669 HG LEU 89 HG LEU 89 50.661 31.918 21.636 670 HD11 LEU 89 HD11 LEU 89 51.910 33.846 22.060 671 HD12 LEU 89 HD12 LEU 89 51.856 33.549 20.505 672 HD13 LEU 89 HD13 LEU 89 50.936 34.678 21.129 673 HD21 LEU 89 HD21 LEU 89 50.025 33.277 23.512 674 HD22 LEU 89 HD22 LEU 89 48.993 34.043 22.587 675 HD23 LEU 89 HD23 LEU 89 48.757 32.518 22.943 676 H ARG 90 H ARG 90 52.436 31.681 19.102 677 HA ARG 90 HA ARG 90 52.469 29.079 18.640 678 HB2 ARG 90 HB2 ARG 90 54.615 30.841 19.282 679 HB3 ARG 90 HB3 ARG 90 54.876 29.333 18.986 680 HG2 ARG 90 HG2 ARG 90 54.143 29.604 16.758 681 HG3 ARG 90 HG3 ARG 90 53.753 31.088 17.040 682 HD2 ARG 90 HD2 ARG 90 56.104 31.548 17.470 683 HD3 ARG 90 HD3 ARG 90 56.427 30.101 16.987 684 HE ARG 90 HE ARG 90 55.892 30.701 14.875 685 HH11 ARG 90 HH11 ARG 90 55.717 32.066 13.223 686 HH12 ARG 90 HH12 ARG 90 55.634 33.537 13.441 687 HH21 ARG 90 HH21 ARG 90 55.676 33.471 16.677 688 HH22 ARG 90 HH22 ARG 90 55.610 34.375 15.495 689 H ILE 91 H ILE 91 52.969 30.788 21.589 690 HA ILE 91 HA ILE 91 52.762 28.535 23.096 691 HB ILE 91 HB ILE 91 54.314 29.548 24.638 692 HG12 ILE 91 HG12 ILE 91 55.217 31.093 22.467 693 HG13 ILE 91 HG13 ILE 91 54.458 31.688 23.692 694 HG21 ILE 91 HG21 ILE 91 56.173 28.538 23.508 695 HG22 ILE 91 HG22 ILE 91 54.893 27.613 23.391 696 HG23 ILE 91 HG23 ILE 91 55.328 28.521 22.168 697 HD11 ILE 91 HD11 ILE 91 56.758 32.055 23.947 698 HD12 ILE 91 HD12 ILE 91 56.258 31.102 25.107 699 HD13 ILE 91 HD13 ILE 91 57.028 30.497 23.863 700 H VAL 92 H VAL 92 50.932 28.614 24.380 701 HA VAL 92 HA VAL 92 49.854 30.973 25.162 702 HB VAL 92 HB VAL 92 48.541 29.726 23.733 703 HG11 VAL 92 HG11 VAL 92 47.346 27.823 24.461 704 HG12 VAL 92 HG12 VAL 92 48.901 27.539 24.372 705 HG13 VAL 92 HG13 VAL 92 48.224 27.804 25.778 706 HG21 VAL 92 HG21 VAL 92 46.470 29.996 24.919 707 HG22 VAL 92 HG22 VAL 92 47.295 30.184 26.259 708 HG23 VAL 92 HG23 VAL 92 47.404 31.262 25.103 709 HA PRO 93 HA PRO 93 50.519 29.863 29.317 710 HB2 PRO 93 HB2 PRO 93 49.232 32.115 30.283 711 HB3 PRO 93 HB3 PRO 93 50.765 31.837 30.371 712 HG2 PRO 93 HG2 PRO 93 49.845 33.686 28.793 713 HG3 PRO 93 HG3 PRO 93 51.197 32.976 28.476 714 HD2 PRO 93 HD2 PRO 93 48.673 32.388 27.333 715 HD3 PRO 93 HD3 PRO 93 50.046 32.399 26.593 716 H GLU 94 H GLU 94 49.441 28.804 31.046 717 HA GLU 94 HA GLU 94 46.795 28.416 31.113 718 HB2 GLU 94 HB2 GLU 94 48.313 26.806 31.956 719 HB3 GLU 94 HB3 GLU 94 48.754 27.807 33.067 720 HG2 GLU 94 HG2 GLU 94 47.330 26.413 34.135 721 HG3 GLU 94 HG3 GLU 94 46.484 27.704 33.918 722 H LEU 95 H LEU 95 45.210 29.660 32.172 723 HA LEU 95 HA LEU 95 45.940 32.100 33.101 724 HB2 LEU 95 HB2 LEU 95 43.379 31.403 32.101 725 HB3 LEU 95 HB3 LEU 95 43.884 32.858 32.343 726 HG LEU 95 HG LEU 95 44.867 31.186 30.286 727 HD11 LEU 95 HD11 LEU 95 43.693 32.623 28.776 728 HD12 LEU 95 HD12 LEU 95 42.677 31.942 29.783 729 HD13 LEU 95 HD13 LEU 95 43.135 33.440 30.014 730 HD21 LEU 95 HD21 LEU 95 45.993 33.067 29.417 731 HD22 LEU 95 HD22 LEU 95 45.502 33.923 30.656 732 HD23 LEU 95 HD23 LEU 95 46.520 32.729 30.873 733 H THR 96 H THR 96 45.587 32.712 35.249 734 HA THR 96 HA THR 96 43.679 31.499 36.757 735 HB THR 96 HB THR 96 46.036 32.622 37.752 736 HG1 THR 96 HG1 THR 96 46.445 30.482 38.300 737 HG21 THR 96 HG21 THR 96 45.381 31.804 39.876 738 HG22 THR 96 HG22 THR 96 44.320 32.852 39.342 739 HG23 THR 96 HG23 THR 96 44.016 31.301 39.249 740 H PHE 97 H PHE 97 41.927 32.832 37.318 741 HA PHE 97 HA PHE 97 41.987 35.464 36.713 742 HB2 PHE 97 HB2 PHE 97 39.733 33.753 36.885 743 HB3 PHE 97 HB3 PHE 97 39.628 35.265 36.517 744 HD1 PHE 97 HD1 PHE 97 40.210 36.036 34.254 745 HD2 PHE 97 HD2 PHE 97 40.531 32.114 35.204 746 HE1 PHE 97 HE1 PHE 97 40.467 35.508 31.997 747 HE2 PHE 97 HE2 PHE 97 40.817 31.592 32.949 748 HZ PHE 97 HZ PHE 97 40.783 33.283 31.342 749 H PHE 98 H PHE 98 41.359 37.129 38.078 750 HA PHE 98 HA PHE 98 40.886 36.757 40.710 751 HB2 PHE 98 HB2 PHE 98 42.856 38.497 39.603 752 HB3 PHE 98 HB3 PHE 98 42.455 38.553 41.109 753 HD1 PHE 98 HD1 PHE 98 43.410 36.977 42.701 754 HD2 PHE 98 HD2 PHE 98 44.239 36.610 38.756 755 HE1 PHE 98 HE1 PHE 98 45.108 35.463 43.198 756 HE2 PHE 98 HE2 PHE 98 45.911 35.063 39.251 757 HZ PHE 98 HZ PHE 98 46.330 34.472 41.470 758 H TYR 99 H TYR 99 39.800 38.700 41.762 759 HA TYR 99 HA TYR 99 38.345 40.228 40.067 760 HB2 TYR 99 HB2 TYR 99 36.590 40.226 41.507 761 HB3 TYR 99 HB3 TYR 99 37.016 38.740 41.295 762 HD1 TYR 99 HD1 TYR 99 36.538 41.189 43.688 763 HD2 TYR 99 HD2 TYR 99 38.202 37.538 43.178 764 HE1 TYR 99 HE1 TYR 99 36.561 40.878 45.999 765 HE2 TYR 99 HE2 TYR 99 38.281 37.246 45.500 766 HH TYR 99 HH TYR 99 37.829 38.175 47.536 767 H ASP 100 H ASP 100 38.145 42.430 40.180 768 HA ASP 100 HA ASP 100 39.627 44.000 41.852 769 HB2 ASP 100 HB2 ASP 100 40.820 43.669 39.847 770 HB3 ASP 100 HB3 ASP 100 39.568 44.083 39.013 Start of MODEL 7 1 HA PRO 8 HA PRO 8 56.471 42.539 24.622 2 HB2 PRO 8 HB2 PRO 8 55.366 40.355 25.299 3 HB3 PRO 8 HB3 PRO 8 56.854 40.266 24.842 4 HG2 PRO 8 HG2 PRO 8 55.930 40.337 27.539 5 HG3 PRO 8 HG3 PRO 8 57.022 39.380 26.970 6 HD2 PRO 8 HD2 PRO 8 57.702 41.579 28.187 7 HD3 PRO 8 HD3 PRO 8 58.640 40.945 27.115 8 H GLN 9 H GLN 9 55.855 44.652 26.268 9 HA GLN 9 HA GLN 9 53.637 44.449 27.636 10 HB2 GLN 9 HB2 GLN 9 55.240 46.177 27.991 11 HB3 GLN 9 HB3 GLN 9 54.842 46.817 26.627 12 HG2 GLN 9 HG2 GLN 9 52.853 46.546 28.603 13 HG3 GLN 9 HG3 GLN 9 53.845 47.743 28.718 14 HE21 GLN 9 HE21 GLN 9 51.192 48.324 28.482 15 HE22 GLN 9 HE22 GLN 9 50.908 48.991 27.180 16 H ARG 10 H ARG 10 53.863 45.237 24.262 17 HA ARG 10 HA ARG 10 51.378 45.891 23.815 18 HB2 ARG 10 HB2 ARG 10 53.237 44.798 21.961 19 HB3 ARG 10 HB3 ARG 10 51.881 45.428 21.520 20 HG2 ARG 10 HG2 ARG 10 52.598 47.559 22.189 21 HG3 ARG 10 HG3 ARG 10 53.908 46.963 22.789 22 HD2 ARG 10 HD2 ARG 10 54.450 46.199 20.515 23 HD3 ARG 10 HD3 ARG 10 53.281 47.105 20.020 24 HE ARG 10 HE ARG 10 54.554 48.879 21.096 25 HH11 ARG 10 HH11 ARG 10 56.557 49.890 20.895 26 HH12 ARG 10 HH12 ARG 10 57.619 49.256 20.065 27 HH21 ARG 10 HH21 ARG 10 56.109 46.571 19.283 28 HH22 ARG 10 HH22 ARG 10 57.363 47.364 19.146 29 H VAL 11 H VAL 11 52.771 42.728 23.901 30 HA VAL 11 HA VAL 11 50.770 41.288 23.045 31 HB VAL 11 HB VAL 11 52.797 40.368 24.731 32 HG11 VAL 11 HG11 VAL 11 52.334 38.214 23.788 33 HG12 VAL 11 HG12 VAL 11 51.045 38.788 24.508 34 HG13 VAL 11 HG13 VAL 11 51.169 38.859 22.930 35 HG21 VAL 11 HG21 VAL 11 53.981 39.669 22.787 36 HG22 VAL 11 HG22 VAL 11 52.876 40.355 21.884 37 HG23 VAL 11 HG23 VAL 11 53.814 41.244 22.798 38 H ALA 12 H ALA 12 51.460 42.328 26.322 39 HA ALA 12 HA ALA 12 49.443 41.152 27.515 40 HB1 ALA 12 HB1 ALA 12 49.959 42.623 29.313 41 HB2 ALA 12 HB2 ALA 12 51.281 41.950 28.758 42 HB3 ALA 12 HB3 ALA 12 50.920 43.438 28.354 43 H GLN 13 H GLN 13 49.387 44.240 25.929 44 HA GLN 13 HA GLN 13 46.929 44.907 26.546 45 HB2 GLN 13 HB2 GLN 13 48.538 45.918 24.439 46 HB3 GLN 13 HB3 GLN 13 47.174 46.557 24.837 47 HG2 GLN 13 HG2 GLN 13 49.426 46.529 26.562 48 HG3 GLN 13 HG3 GLN 13 49.021 47.773 25.713 49 HE21 GLN 13 HE21 GLN 13 46.842 48.791 26.311 50 HE22 GLN 13 HE22 GLN 13 46.377 48.707 27.724 51 H GLU 14 H GLU 14 48.103 43.299 23.690 52 HA GLU 14 HA GLU 14 45.845 43.047 22.396 53 HB2 GLU 14 HB2 GLU 14 48.325 41.708 22.051 54 HB3 GLU 14 HB3 GLU 14 47.110 41.329 21.150 55 HG2 GLU 14 HG2 GLU 14 47.077 43.656 20.402 56 HG3 GLU 14 HG3 GLU 14 48.444 43.837 21.130 57 H MET 15 H MET 15 47.323 40.788 24.623 58 HA MET 15 HA MET 15 45.520 38.896 24.453 59 HB2 MET 15 HB2 MET 15 47.512 39.295 26.410 60 HB3 MET 15 HB3 MET 15 46.474 38.144 26.583 61 HG2 MET 15 HG2 MET 15 47.189 37.294 24.421 62 HG3 MET 15 HG3 MET 15 48.341 38.346 24.452 63 HE1 MET 15 HE1 MET 15 50.181 35.056 24.814 64 HE2 MET 15 HE2 MET 15 48.875 35.326 23.960 65 HE3 MET 15 HE3 MET 15 50.063 36.373 23.941 66 H GLN 16 H GLN 16 45.587 41.633 26.687 67 HA GLN 16 HA GLN 16 43.406 41.089 28.013 68 HB2 GLN 16 HB2 GLN 16 44.912 42.773 28.709 69 HB3 GLN 16 HB3 GLN 16 44.482 43.661 27.503 70 HG2 GLN 16 HG2 GLN 16 42.523 42.914 29.385 71 HG3 GLN 16 HG3 GLN 16 43.466 44.108 29.732 72 HE21 GLN 16 HE21 GLN 16 40.856 44.755 29.660 73 HE22 GLN 16 HE22 GLN 16 40.501 45.547 28.450 74 H LYS 17 H LYS 17 43.541 42.725 24.938 75 HA LYS 17 HA LYS 17 41.010 43.252 24.593 76 HB2 LYS 17 HB2 LYS 17 42.702 44.284 23.280 77 HB3 LYS 17 HB3 LYS 17 43.028 42.917 22.606 78 HG2 LYS 17 HG2 LYS 17 40.863 42.892 21.604 79 HG3 LYS 17 HG3 LYS 17 40.535 44.259 22.281 80 HD2 LYS 17 HD2 LYS 17 42.173 45.340 20.956 81 HD3 LYS 17 HD3 LYS 17 42.589 43.976 20.324 82 HE2 LYS 17 HE2 LYS 17 40.468 43.733 19.342 83 HE3 LYS 17 HE3 LYS 17 39.951 45.013 20.069 84 HZ1 LYS 17 HZ1 LYS 17 40.460 45.495 17.911 85 HZ2 LYS 17 HZ2 LYS 17 41.356 46.257 18.763 86 HZ3 LYS 17 HZ3 LYS 17 41.837 45.065 18.085 87 H GLU 18 H GLU 18 42.640 40.404 23.515 88 HA GLU 18 HA GLU 18 40.579 39.248 22.331 89 HB2 GLU 18 HB2 GLU 18 43.120 38.855 22.145 90 HB3 GLU 18 HB3 GLU 18 42.748 37.657 23.072 91 HG2 GLU 18 HG2 GLU 18 42.604 36.720 21.027 92 HG3 GLU 18 HG3 GLU 18 41.109 37.033 21.336 93 H ILE 19 H ILE 19 41.868 38.771 25.526 94 HA ILE 19 HA ILE 19 40.298 36.808 26.349 95 HB ILE 19 HB ILE 19 41.931 38.544 27.824 96 HG12 ILE 19 HG12 ILE 19 42.357 35.760 27.317 97 HG13 ILE 19 HG13 ILE 19 42.992 36.851 26.401 98 HG21 ILE 19 HG21 ILE 19 41.625 37.177 29.722 99 HG22 ILE 19 HG22 ILE 19 40.253 37.844 29.293 100 HG23 ILE 19 HG23 ILE 19 40.546 36.330 28.932 101 HD11 ILE 19 HD11 ILE 19 44.600 36.084 27.929 102 HD12 ILE 19 HD12 ILE 19 44.315 37.617 28.208 103 HD13 ILE 19 HD13 ILE 19 43.670 36.510 29.139 104 H ALA 20 H ALA 20 39.871 40.272 26.731 105 HA ALA 20 HA ALA 20 37.608 40.302 28.002 106 HB1 ALA 20 HB1 ALA 20 37.453 42.529 27.197 107 HB2 ALA 20 HB2 ALA 20 38.917 42.245 27.731 108 HB3 ALA 20 HB3 ALA 20 38.625 42.231 26.174 109 H LEU 21 H LEU 21 37.997 39.986 24.582 110 HA LEU 21 HA LEU 21 35.474 39.980 23.813 111 HB2 LEU 21 HB2 LEU 21 37.388 40.414 22.391 112 HB3 LEU 21 HB3 LEU 21 37.743 38.897 22.469 113 HG LEU 21 HG LEU 21 35.624 38.438 21.402 114 HD11 LEU 21 HD11 LEU 21 34.582 40.194 20.226 115 HD12 LEU 21 HD12 LEU 21 34.549 40.486 21.782 116 HD13 LEU 21 HD13 LEU 21 35.607 41.222 20.860 117 HD21 LEU 21 HD21 LEU 21 36.444 38.954 19.223 118 HD22 LEU 21 HD22 LEU 21 37.498 39.947 19.867 119 HD23 LEU 21 HD23 LEU 21 37.621 38.388 20.121 120 H ILE 22 H ILE 22 37.505 37.238 24.553 121 HA ILE 22 HA ILE 22 35.736 35.340 24.089 122 HB ILE 22 HB ILE 22 38.141 35.146 25.505 123 HG12 ILE 22 HG12 ILE 22 37.714 34.143 22.879 124 HG13 ILE 22 HG13 ILE 22 38.238 35.598 23.078 125 HG21 ILE 22 HG21 ILE 22 37.903 32.775 25.274 126 HG22 ILE 22 HG22 ILE 22 36.701 33.358 26.124 127 HG23 ILE 22 HG23 ILE 22 36.487 32.994 24.598 128 HD11 ILE 22 HD11 ILE 22 40.052 34.171 22.636 129 HD12 ILE 22 HD12 ILE 22 40.208 34.762 24.097 130 HD13 ILE 22 HD13 ILE 22 39.676 33.285 23.894 131 H LEU 23 H LEU 23 36.344 37.012 27.096 132 HA LEU 23 HA LEU 23 34.708 35.685 28.638 133 HB2 LEU 23 HB2 LEU 23 36.094 38.089 28.914 134 HB3 LEU 23 HB3 LEU 23 34.810 38.008 29.795 135 HG LEU 23 HG LEU 23 35.625 36.047 30.789 136 HD11 LEU 23 HD11 LEU 23 37.882 35.387 30.541 137 HD12 LEU 23 HD12 LEU 23 37.099 35.237 29.171 138 HD13 LEU 23 HD13 LEU 23 38.061 36.475 29.403 139 HD21 LEU 23 HD21 LEU 23 37.320 37.105 32.131 140 HD22 LEU 23 HD22 LEU 23 37.431 38.252 31.044 141 HD23 LEU 23 HD23 LEU 23 36.107 38.096 31.898 142 H GLN 24 H GLN 24 33.830 38.209 26.472 143 HA GLN 24 HA GLN 24 31.291 38.427 27.210 144 HB2 GLN 24 HB2 GLN 24 32.724 39.413 24.951 145 HB3 GLN 24 HB3 GLN 24 31.186 39.652 25.054 146 HG2 GLN 24 HG2 GLN 24 31.424 40.960 26.941 147 HG3 GLN 24 HG3 GLN 24 32.909 40.521 27.130 148 HE21 GLN 24 HE21 GLN 24 32.113 43.202 27.060 149 HE22 GLN 24 HE22 GLN 24 32.775 43.881 25.911 150 H ARG 25 H ARG 25 32.782 36.238 25.084 151 HA ARG 25 HA ARG 25 30.534 35.422 23.853 152 HB2 ARG 25 HB2 ARG 25 33.273 34.993 23.167 153 HB3 ARG 25 HB3 ARG 25 32.135 34.288 22.370 154 HG2 ARG 25 HG2 ARG 25 31.276 36.405 21.714 155 HG3 ARG 25 HG3 ARG 25 32.406 37.115 22.521 156 HD2 ARG 25 HD2 ARG 25 34.033 36.132 21.046 157 HD3 ARG 25 HD3 ARG 25 32.872 35.508 20.213 158 HE ARG 25 HE ARG 25 32.713 38.199 20.424 159 HH11 ARG 25 HH11 ARG 25 32.663 39.472 18.672 160 HH12 ARG 25 HH12 ARG 25 33.190 39.002 17.360 161 HH21 ARG 25 HH21 ARG 25 33.994 36.018 18.257 162 HH22 ARG 25 HH22 ARG 25 33.970 36.975 17.118 163 H GLU 26 H GLU 26 32.647 33.999 26.109 164 HA GLU 26 HA GLU 26 31.732 31.479 25.734 165 HB2 GLU 26 HB2 GLU 26 34.101 31.869 25.670 166 HB3 GLU 26 HB3 GLU 26 34.046 32.308 27.165 167 HG2 GLU 26 HG2 GLU 26 34.854 30.080 26.877 168 HG3 GLU 26 HG3 GLU 26 33.665 30.169 27.882 169 H ILE 27 H ILE 27 31.322 33.815 28.143 170 HA ILE 27 HA ILE 27 29.691 32.182 29.553 171 HB ILE 27 HB ILE 27 30.233 33.233 31.560 172 HG12 ILE 27 HG12 ILE 27 32.493 34.366 30.324 173 HG13 ILE 27 HG13 ILE 27 31.223 35.194 30.688 174 HG21 ILE 27 HG21 ILE 27 32.201 31.979 31.970 175 HG22 ILE 27 HG22 ILE 27 31.143 31.118 31.165 176 HG23 ILE 27 HG23 ILE 27 32.375 31.767 30.410 177 HD11 ILE 27 HD11 ILE 27 32.856 35.495 32.365 178 HD12 ILE 27 HD12 ILE 27 31.596 34.775 32.999 179 HD13 ILE 27 HD13 ILE 27 32.886 33.934 32.630 180 H LYS 28 H LYS 28 27.702 33.269 30.452 181 HA LYS 28 HA LYS 28 26.728 35.126 28.793 182 HB2 LYS 28 HB2 LYS 28 25.404 33.703 30.852 183 HB3 LYS 28 HB3 LYS 28 24.663 34.715 29.925 184 HG2 LYS 28 HG2 LYS 28 25.339 33.346 28.027 185 HG3 LYS 28 HG3 LYS 28 25.871 32.289 29.042 186 HD2 LYS 28 HD2 LYS 28 23.635 31.978 29.856 187 HD3 LYS 28 HD3 LYS 28 23.122 32.992 28.788 188 HE2 LYS 28 HE2 LYS 28 24.121 31.520 27.092 189 HE3 LYS 28 HE3 LYS 28 24.297 30.464 28.226 190 HZ1 LYS 28 HZ1 LYS 28 22.378 30.071 27.085 191 HZ2 LYS 28 HZ2 LYS 28 22.026 30.409 28.454 192 HZ3 LYS 28 HZ3 LYS 28 21.862 31.393 27.397 193 H ASP 29 H ASP 29 27.575 37.146 29.073 194 HA ASP 29 HA ASP 29 27.941 38.441 31.292 195 HB2 ASP 29 HB2 ASP 29 28.797 38.911 28.924 196 HB3 ASP 29 HB3 ASP 29 27.606 39.919 28.914 197 HA PRO 30 HA PRO 30 23.653 40.319 30.784 198 HB2 PRO 30 HB2 PRO 30 22.161 38.033 30.017 199 HB3 PRO 30 HB3 PRO 30 21.881 39.503 29.577 200 HG2 PRO 30 HG2 PRO 30 22.989 37.905 27.893 201 HG3 PRO 30 HG3 PRO 30 23.399 39.409 27.871 202 HD2 PRO 30 HD2 PRO 30 24.864 37.280 29.000 203 HD3 PRO 30 HD3 PRO 30 25.452 38.550 28.312 204 H ARG 31 H ARG 31 24.057 37.106 31.976 205 HA ARG 31 HA ARG 31 22.620 37.372 34.215 206 HB2 ARG 31 HB2 ARG 31 22.904 35.284 33.072 207 HB3 ARG 31 HB3 ARG 31 24.381 35.261 33.571 208 HG2 ARG 31 HG2 ARG 31 23.690 35.040 35.797 209 HG3 ARG 31 HG3 ARG 31 22.199 35.265 35.401 210 HD2 ARG 31 HD2 ARG 31 22.521 32.967 35.767 211 HD3 ARG 31 HD3 ARG 31 22.175 33.174 34.261 212 HE ARG 31 HE ARG 31 24.812 33.186 34.611 213 HH11 ARG 31 HH11 ARG 31 26.083 31.736 33.663 214 HH12 ARG 31 HH12 ARG 31 25.617 30.343 33.413 215 HH21 ARG 31 HH21 ARG 31 22.586 30.733 34.487 216 HH22 ARG 31 HH22 ARG 31 23.536 29.745 33.903 217 H LEU 32 H LEU 32 25.782 38.234 33.580 218 HA LEU 32 HA LEU 32 26.440 38.909 36.100 219 HB2 LEU 32 HB2 LEU 32 27.983 39.067 33.727 220 HB3 LEU 32 HB3 LEU 32 28.532 39.520 35.115 221 HG LEU 32 HG LEU 32 27.866 36.850 34.511 222 HD11 LEU 32 HD11 LEU 32 30.223 36.436 34.472 223 HD12 LEU 32 HD12 LEU 32 29.841 37.494 33.357 224 HD13 LEU 32 HD13 LEU 32 30.485 37.978 34.720 225 HD21 LEU 32 HD21 LEU 32 28.941 36.263 36.532 226 HD22 LEU 32 HD22 LEU 32 29.194 37.797 36.834 227 HD23 LEU 32 HD23 LEU 32 27.717 37.226 36.821 228 H GLY 33 H GLY 33 24.325 40.424 34.410 229 HA2 GLY 33 HA2 GLY 33 23.417 42.346 34.794 230 HA3 GLY 33 HA3 GLY 33 24.731 42.840 35.471 231 H MET 34 H MET 34 25.322 41.686 32.389 232 HA MET 34 HA MET 34 25.874 42.421 30.518 233 HB2 MET 34 HB2 MET 34 23.475 43.152 30.726 234 HB3 MET 34 HB3 MET 34 24.080 44.590 30.749 235 HG2 MET 34 HG2 MET 34 23.410 44.116 28.591 236 HG3 MET 34 HG3 MET 34 24.961 44.274 28.600 237 HE1 MET 34 HE1 MET 34 23.772 41.637 25.955 238 HE2 MET 34 HE2 MET 34 22.828 42.747 26.578 239 HE3 MET 34 HE3 MET 34 24.281 43.131 26.081 240 H MET 35 H MET 35 27.415 43.633 32.824 241 HA MET 35 HA MET 35 29.185 44.883 31.285 242 HB2 MET 35 HB2 MET 35 27.703 46.654 32.044 243 HB3 MET 35 HB3 MET 35 28.202 46.377 33.495 244 HG2 MET 35 HG2 MET 35 29.402 48.190 32.626 245 HG3 MET 35 HG3 MET 35 30.393 47.017 32.896 246 HE1 MET 35 HE1 MET 35 31.970 48.733 29.910 247 HE2 MET 35 HE2 MET 35 31.208 49.422 31.116 248 HE3 MET 35 HE3 MET 35 32.228 48.243 31.394 249 H THR 36 H THR 36 30.268 42.779 31.871 250 HA THR 36 HA THR 36 31.905 43.083 34.012 251 HB THR 36 HB THR 36 32.073 40.835 32.397 252 HG1 THR 36 HG1 THR 36 30.119 40.444 32.935 253 HG21 THR 36 HG21 THR 36 32.746 39.715 34.377 254 HG22 THR 36 HG22 THR 36 33.685 40.958 34.089 255 HG23 THR 36 HG23 THR 36 32.549 41.063 35.186 256 H THR 37 H THR 37 34.307 43.301 33.663 257 HA THR 37 HA THR 37 35.235 43.846 31.178 258 HB THR 37 HB THR 37 35.487 45.736 33.223 259 HG1 THR 37 HG1 THR 37 33.975 46.954 32.063 260 HG21 THR 37 HG21 THR 37 36.136 47.312 31.550 261 HG22 THR 37 HG22 THR 37 37.128 46.078 31.582 262 HG23 THR 37 HG23 THR 37 36.013 46.168 30.462 263 H VAL 38 H VAL 38 37.621 43.624 30.980 264 HA VAL 38 HA VAL 38 38.976 42.496 33.036 265 HB VAL 38 HB VAL 38 39.814 42.663 30.380 266 HG11 VAL 38 HG11 VAL 38 41.428 41.010 30.915 267 HG12 VAL 38 HG12 VAL 38 41.657 42.321 31.773 268 HG13 VAL 38 HG13 VAL 38 40.952 41.061 32.425 269 HG21 VAL 38 HG21 VAL 38 39.260 40.346 30.166 270 HG22 VAL 38 HG22 VAL 38 38.666 40.375 31.634 271 HG23 VAL 38 HG23 VAL 38 37.966 41.204 30.480 272 H SER 39 H SER 39 40.363 43.826 34.334 273 HA SER 39 HA SER 39 40.930 46.315 33.568 274 HB2 SER 39 HB2 SER 39 41.541 46.778 35.717 275 HB3 SER 39 HB3 SER 39 40.220 45.952 35.794 276 HG SER 39 HG SER 39 41.725 45.209 37.204 277 H GLY 40 H GLY 40 42.799 43.485 33.639 278 HA2 GLY 40 HA2 GLY 40 44.644 44.170 32.020 279 HA3 GLY 40 HA3 GLY 40 45.237 44.452 33.434 280 H VAL 41 H VAL 41 46.475 42.538 31.840 281 HA VAL 41 HA VAL 41 46.267 40.287 33.305 282 HB VAL 41 HB VAL 41 46.755 38.918 31.646 283 HG11 VAL 41 HG11 VAL 41 44.826 39.162 30.207 284 HG12 VAL 41 HG12 VAL 41 44.440 39.425 31.720 285 HG13 VAL 41 HG13 VAL 41 44.661 40.646 30.735 286 HG21 VAL 41 HG21 VAL 41 47.001 39.523 29.357 287 HG22 VAL 41 HG22 VAL 41 46.977 41.048 29.783 288 HG23 VAL 41 HG23 VAL 41 48.172 40.117 30.242 289 H GLU 42 H GLU 42 48.300 39.222 33.954 290 HA GLU 42 HA GLU 42 50.640 40.415 33.282 291 HB2 GLU 42 HB2 GLU 42 50.214 41.022 35.498 292 HB3 GLU 42 HB3 GLU 42 50.064 39.524 35.906 293 HG2 GLU 42 HG2 GLU 42 52.291 39.124 35.708 294 HG3 GLU 42 HG3 GLU 42 52.518 40.375 34.804 295 H MET 43 H MET 43 52.042 39.063 32.192 296 HA MET 43 HA MET 43 51.691 36.413 32.136 297 HB2 MET 43 HB2 MET 43 53.373 37.986 30.475 298 HB3 MET 43 HB3 MET 43 53.145 36.458 30.264 299 HG2 MET 43 HG2 MET 43 50.833 36.911 29.798 300 HG3 MET 43 HG3 MET 43 51.141 38.437 29.904 301 HE1 MET 43 HE1 MET 43 53.370 39.140 26.886 302 HE2 MET 43 HE2 MET 43 52.634 39.819 28.113 303 HE3 MET 43 HE3 MET 43 53.844 38.828 28.365 304 H SER 44 H SER 44 53.243 34.856 32.875 305 HA SER 44 HA SER 44 55.239 35.457 34.448 306 HB2 SER 44 HB2 SER 44 54.113 33.377 34.686 307 HB3 SER 44 HB3 SER 44 54.644 32.920 33.294 308 HG SER 44 HG SER 44 55.933 32.177 34.903 309 H ARG 45 H ARG 45 57.589 35.086 34.054 310 HA ARG 45 HA ARG 45 58.646 36.108 31.933 311 HB2 ARG 45 HB2 ARG 45 59.686 36.042 34.088 312 HB3 ARG 45 HB3 ARG 45 59.940 34.514 33.900 313 HG2 ARG 45 HG2 ARG 45 61.463 34.943 32.152 314 HG3 ARG 45 HG3 ARG 45 61.146 36.469 32.214 315 HD2 ARG 45 HD2 ARG 45 62.069 36.566 34.408 316 HD3 ARG 45 HD3 ARG 45 62.398 35.044 34.332 317 HE ARG 45 HE ARG 45 63.797 36.998 33.073 318 HH11 ARG 45 HH11 ARG 45 65.887 36.559 32.320 319 HH12 ARG 45 HH12 ARG 45 66.308 35.145 32.122 320 HH21 ARG 45 HH21 ARG 45 63.641 33.704 33.165 321 HH22 ARG 45 HH22 ARG 45 65.007 33.488 32.612 322 H ASP 46 H ASP 46 58.135 32.743 32.397 323 HA ASP 46 HA ASP 46 59.339 32.034 30.110 324 HB2 ASP 46 HB2 ASP 46 59.531 29.959 30.928 325 HB3 ASP 46 HB3 ASP 46 59.576 30.780 32.253 326 H LEU 47 H LEU 47 56.401 33.111 30.474 327 HA LEU 47 HA LEU 47 54.505 33.046 29.596 328 HB2 LEU 47 HB2 LEU 47 55.859 32.066 27.304 329 HB3 LEU 47 HB3 LEU 47 54.472 32.780 27.266 330 HG LEU 47 HG LEU 47 56.843 34.112 28.030 331 HD11 LEU 47 HD11 LEU 47 56.801 35.143 25.869 332 HD12 LEU 47 HD12 LEU 47 56.943 33.573 25.719 333 HD13 LEU 47 HD13 LEU 47 55.537 34.267 25.493 334 HD21 LEU 47 HD21 LEU 47 55.650 36.131 27.774 335 HD22 LEU 47 HD22 LEU 47 54.343 35.305 27.426 336 HD23 LEU 47 HD23 LEU 47 54.968 35.223 28.879 337 H ALA 48 H ALA 48 55.167 30.459 31.009 338 HA ALA 48 HA ALA 48 53.419 28.724 29.999 339 HB1 ALA 48 HB1 ALA 48 53.944 27.429 31.914 340 HB2 ALA 48 HB2 ALA 48 55.268 27.894 31.182 341 HB3 ALA 48 HB3 ALA 48 54.782 28.642 32.490 342 H TYR 49 H TYR 49 52.986 31.225 32.283 343 HA TYR 49 HA TYR 49 50.394 30.656 32.690 344 HB2 TYR 49 HB2 TYR 49 52.138 31.205 34.875 345 HB3 TYR 49 HB3 TYR 49 50.602 30.981 35.031 346 HD1 TYR 49 HD1 TYR 49 49.663 28.666 34.805 347 HD2 TYR 49 HD2 TYR 49 53.646 29.327 34.834 348 HE1 TYR 49 HE1 TYR 49 50.040 26.369 34.961 349 HE2 TYR 49 HE2 TYR 49 54.036 27.031 34.929 350 HH TYR 49 HH TYR 49 53.115 24.957 34.868 351 H ALA 50 H ALA 50 48.978 32.456 33.190 352 HA ALA 50 HA ALA 50 49.957 34.917 33.557 353 HB1 ALA 50 HB1 ALA 50 48.510 35.849 31.929 354 HB2 ALA 50 HB2 ALA 50 49.549 34.868 31.248 355 HB3 ALA 50 HB3 ALA 50 48.062 34.391 31.508 356 H LYS 51 H LYS 51 48.806 36.282 34.920 357 HA LYS 51 HA LYS 51 46.578 35.502 36.238 358 HB2 LYS 51 HB2 LYS 51 48.274 37.707 36.807 359 HB3 LYS 51 HB3 LYS 51 47.072 37.283 37.705 360 HG2 LYS 51 HG2 LYS 51 48.198 35.210 38.158 361 HG3 LYS 51 HG3 LYS 51 49.422 35.727 37.343 362 HD2 LYS 51 HD2 LYS 51 48.537 36.845 39.794 363 HD3 LYS 51 HD3 LYS 51 49.825 35.981 39.636 364 HE2 LYS 51 HE2 LYS 51 49.700 38.480 38.338 365 HE3 LYS 51 HE3 LYS 51 50.087 38.432 39.847 366 HZ1 LYS 51 HZ1 LYS 51 51.905 38.457 38.395 367 HZ2 LYS 51 HZ2 LYS 51 51.971 37.362 39.348 368 HZ3 LYS 51 HZ3 LYS 51 51.568 37.107 37.975 369 H VAL 52 H VAL 52 44.505 36.424 35.753 370 HA VAL 52 HA VAL 52 44.300 38.606 34.140 371 HB VAL 52 HB VAL 52 42.476 36.479 34.213 372 HG11 VAL 52 HG11 VAL 52 41.354 37.526 32.389 373 HG12 VAL 52 HG12 VAL 52 41.332 38.459 33.669 374 HG13 VAL 52 HG13 VAL 52 42.356 38.748 32.496 375 HG21 VAL 52 HG21 VAL 52 43.162 35.947 31.991 376 HG22 VAL 52 HG22 VAL 52 44.259 37.085 32.075 377 HG23 VAL 52 HG23 VAL 52 44.374 35.804 32.999 378 H TYR 53 H TYR 53 43.323 40.421 35.131 379 HA TYR 53 HA TYR 53 41.826 40.157 37.379 380 HB2 TYR 53 HB2 TYR 53 43.164 42.456 36.395 381 HB3 TYR 53 HB3 TYR 53 42.321 42.464 37.707 382 HD1 TYR 53 HD1 TYR 53 43.150 41.134 39.700 383 HD2 TYR 53 HD2 TYR 53 45.480 41.799 36.457 384 HE1 TYR 53 HE1 TYR 53 45.045 40.497 40.922 385 HE2 TYR 53 HE2 TYR 53 47.376 41.216 37.688 386 HH TYR 53 HH TYR 53 48.182 40.529 39.697 387 H VAL 54 H VAL 54 39.617 40.549 37.408 388 HA VAL 54 HA VAL 54 38.360 41.635 35.247 389 HB VAL 54 HB VAL 54 37.441 39.347 36.600 390 HG11 VAL 54 HG11 VAL 54 35.879 39.089 34.809 391 HG12 VAL 54 HG12 VAL 54 35.666 40.477 35.541 392 HG13 VAL 54 HG13 VAL 54 36.435 40.421 34.159 393 HG21 VAL 54 HG21 VAL 54 38.029 38.034 34.685 394 HG22 VAL 54 HG22 VAL 54 38.682 39.321 34.029 395 HG23 VAL 54 HG23 VAL 54 39.320 38.686 35.332 396 H THR 55 H THR 55 36.493 42.949 35.761 397 HA THR 55 HA THR 55 35.821 43.426 38.358 398 HB THR 55 HB THR 55 37.287 45.037 37.576 399 HG1 THR 55 HG1 THR 55 36.085 45.809 39.122 400 HG21 THR 55 HG21 THR 55 36.597 46.753 36.154 401 HG22 THR 55 HG22 THR 55 36.703 45.368 35.394 402 HG23 THR 55 HG23 THR 55 35.286 45.930 35.823 403 H PHE 56 H PHE 56 33.624 43.744 38.832 404 HA PHE 56 HA PHE 56 31.905 42.893 36.918 405 HB2 PHE 56 HB2 PHE 56 32.076 42.057 39.631 406 HB3 PHE 56 HB3 PHE 56 30.850 41.679 38.744 407 HD1 PHE 56 HD1 PHE 56 34.376 41.083 38.947 408 HD2 PHE 56 HD2 PHE 56 30.903 39.681 37.426 409 HE1 PHE 56 HE1 PHE 56 35.460 39.131 38.288 410 HE2 PHE 56 HE2 PHE 56 31.988 37.708 36.799 411 HZ PHE 56 HZ PHE 56 34.268 37.441 37.211 412 H LEU 57 H LEU 57 29.939 44.059 36.585 413 HA LEU 57 HA LEU 57 28.890 45.746 38.336 414 HB2 LEU 57 HB2 LEU 57 28.388 45.600 35.911 415 HB3 LEU 57 HB3 LEU 57 27.403 44.453 36.296 416 HG LEU 57 HG LEU 57 26.330 46.091 37.778 417 HD11 LEU 57 HD11 LEU 57 26.598 48.360 37.153 418 HD12 LEU 57 HD12 LEU 57 27.975 47.770 37.667 419 HD13 LEU 57 HD13 LEU 57 27.713 47.935 36.114 420 HD21 LEU 57 HD21 LEU 57 24.967 46.928 36.030 421 HD22 LEU 57 HD22 LEU 57 26.055 46.467 34.975 422 HD23 LEU 57 HD23 LEU 57 25.251 45.386 35.808 423 H ASN 58 H ASN 58 28.781 42.385 38.181 424 HA ASN 58 HA ASN 58 26.610 41.799 39.623 425 HB2 ASN 58 HB2 ASN 58 27.642 40.477 37.812 426 HB3 ASN 58 HB3 ASN 58 28.728 40.065 38.853 427 HD21 ASN 58 HD21 ASN 58 25.125 38.570 39.267 428 HD22 ASN 58 HD22 ASN 58 25.275 39.980 38.813 429 H ASP 59 H ASP 59 29.377 42.989 40.705 430 HA ASP 59 HA ASP 59 29.888 42.116 43.070 431 HB2 ASP 59 HB2 ASP 59 31.249 43.676 41.874 432 HB3 ASP 59 HB3 ASP 59 30.102 44.732 41.913 433 H LYS 60 H LYS 60 26.988 43.566 42.279 434 HA LYS 60 HA LYS 60 26.113 44.465 44.602 435 HB2 LYS 60 HB2 LYS 60 25.114 44.905 42.440 436 HB3 LYS 60 HB3 LYS 60 24.577 43.441 42.435 437 HG2 LYS 60 HG2 LYS 60 23.240 43.935 44.340 438 HG3 LYS 60 HG3 LYS 60 23.760 45.405 44.315 439 HD2 LYS 60 HD2 LYS 60 22.378 44.377 42.075 440 HD3 LYS 60 HD3 LYS 60 21.568 44.974 43.267 441 HE2 LYS 60 HE2 LYS 60 22.595 47.088 42.889 442 HE3 LYS 60 HE3 LYS 60 23.367 46.486 41.675 443 HZ1 LYS 60 HZ1 LYS 60 21.492 47.543 40.959 444 HZ2 LYS 60 HZ2 LYS 60 21.361 46.131 40.644 445 HZ3 LYS 60 HZ3 LYS 60 20.642 46.692 41.775 446 H ASP 61 H ASP 61 26.539 41.208 43.729 447 HA ASP 61 HA ASP 61 26.069 40.512 46.289 448 HB2 ASP 61 HB2 ASP 61 24.239 39.630 45.127 449 HB3 ASP 61 HB3 ASP 61 25.191 38.910 44.123 450 H GLU 62 H GLU 62 27.874 39.786 47.273 451 HA GLU 62 HA GLU 62 30.176 39.342 46.178 452 HB2 GLU 62 HB2 GLU 62 29.196 38.771 48.785 453 HB3 GLU 62 HB3 GLU 62 30.688 38.496 48.428 454 HG2 GLU 62 HG2 GLU 62 30.546 40.482 49.611 455 HG3 GLU 62 HG3 GLU 62 31.092 40.778 48.180 456 H ASP 63 H ASP 63 27.824 36.952 47.073 457 HA ASP 63 HA ASP 63 29.294 34.790 46.664 458 HB2 ASP 63 HB2 ASP 63 27.375 34.932 48.176 459 HB3 ASP 63 HB3 ASP 63 26.458 34.874 46.916 460 H ALA 64 H ALA 64 27.230 36.462 44.511 461 HA ALA 64 HA ALA 64 27.182 34.793 42.488 462 HB1 ALA 64 HB1 ALA 64 26.282 36.621 41.312 463 HB2 ALA 64 HB2 ALA 64 25.537 36.448 42.698 464 HB3 ALA 64 HB3 ALA 64 26.637 37.575 42.525 465 H VAL 65 H VAL 65 29.435 37.423 43.120 466 HA VAL 65 HA VAL 65 30.923 37.115 40.993 467 HB VAL 65 HB VAL 65 31.700 38.304 43.403 468 HG11 VAL 65 HG11 VAL 65 33.445 39.382 42.172 469 HG12 VAL 65 HG12 VAL 65 33.632 37.810 42.128 470 HG13 VAL 65 HG13 VAL 65 33.017 38.570 40.882 471 HG21 VAL 65 HG21 VAL 65 31.258 40.385 42.312 472 HG22 VAL 65 HG22 VAL 65 30.770 39.590 41.031 473 HG23 VAL 65 HG23 VAL 65 29.940 39.509 42.378 474 H LYS 66 H LYS 66 31.347 35.643 44.139 475 HA LYS 66 HA LYS 66 33.529 34.239 43.820 476 HB2 LYS 66 HB2 LYS 66 32.505 34.643 45.910 477 HB3 LYS 66 HB3 LYS 66 31.328 33.699 45.514 478 HG2 LYS 66 HG2 LYS 66 32.825 31.839 45.526 479 HG3 LYS 66 HG3 LYS 66 33.993 32.786 45.938 480 HD2 LYS 66 HD2 LYS 66 32.954 33.258 47.990 481 HD3 LYS 66 HD3 LYS 66 31.684 32.457 47.568 482 HE2 LYS 66 HE2 LYS 66 32.754 31.059 48.993 483 HE3 LYS 66 HE3 LYS 66 33.057 30.456 47.587 484 HZ1 LYS 66 HZ1 LYS 66 34.952 30.555 48.818 485 HZ2 LYS 66 HZ2 LYS 66 35.116 31.432 47.672 486 HZ3 LYS 66 HZ3 LYS 66 34.834 31.993 48.982 487 H ALA 67 H ALA 67 30.325 33.141 43.072 488 HA ALA 67 HA ALA 67 30.937 30.836 41.969 489 HB1 ALA 67 HB1 ALA 67 28.631 30.843 41.348 490 HB2 ALA 67 HB2 ALA 67 28.783 31.234 42.876 491 HB3 ALA 67 HB3 ALA 67 28.530 32.360 41.791 492 H GLY 68 H GLY 68 30.619 33.915 40.422 493 HA2 GLY 68 HA2 GLY 68 30.694 33.266 37.896 494 HA3 GLY 68 HA3 GLY 68 31.082 34.662 38.473 495 H ILE 69 H ILE 69 33.390 34.215 39.903 496 HA ILE 69 HA ILE 69 35.416 33.782 38.357 497 HB ILE 69 HB ILE 69 35.252 33.794 41.141 498 HG12 ILE 69 HG12 ILE 69 34.944 35.923 40.120 499 HG13 ILE 69 HG13 ILE 69 36.138 35.936 41.123 500 HG21 ILE 69 HG21 ILE 69 37.600 33.899 41.339 501 HG22 ILE 69 HG22 ILE 69 37.127 32.512 40.740 502 HG23 ILE 69 HG23 ILE 69 37.723 33.626 39.784 503 HD11 ILE 69 HD11 ILE 69 36.730 37.124 39.193 504 HD12 ILE 69 HD12 ILE 69 37.670 35.856 39.322 505 HD13 ILE 69 HD13 ILE 69 36.458 35.843 38.303 506 H LYS 70 H LYS 70 33.811 31.414 40.374 507 HA LYS 70 HA LYS 70 35.355 29.352 39.874 508 HB2 LYS 70 HB2 LYS 70 33.817 29.441 41.719 509 HB3 LYS 70 HB3 LYS 70 32.655 29.174 40.714 510 HG2 LYS 70 HG2 LYS 70 33.526 27.073 40.175 511 HG3 LYS 70 HG3 LYS 70 34.808 27.347 41.020 512 HD2 LYS 70 HD2 LYS 70 32.238 26.983 42.169 513 HD3 LYS 70 HD3 LYS 70 33.337 25.877 42.154 514 HE2 LYS 70 HE2 LYS 70 34.713 27.589 43.383 515 HE3 LYS 70 HE3 LYS 70 33.329 28.226 43.720 516 HZ1 LYS 70 HZ1 LYS 70 33.955 26.800 45.373 517 HZ2 LYS 70 HZ2 LYS 70 32.746 26.276 44.762 518 HZ3 LYS 70 HZ3 LYS 70 34.034 25.683 44.448 519 H ALA 71 H ALA 71 32.501 30.218 38.122 520 HA ALA 71 HA ALA 71 32.426 28.259 36.382 521 HB1 ALA 71 HB1 ALA 71 30.850 29.673 35.289 522 HB2 ALA 71 HB2 ALA 71 30.543 29.631 36.842 523 HB3 ALA 71 HB3 ALA 71 31.298 30.876 36.218 524 H LEU 72 H LEU 72 33.912 31.338 36.038 525 HA LEU 72 HA LEU 72 34.903 31.214 33.602 526 HB2 LEU 72 HB2 LEU 72 34.500 33.255 34.715 527 HB3 LEU 72 HB3 LEU 72 35.488 32.859 35.856 528 HG LEU 72 HG LEU 72 37.300 33.103 34.413 529 HD11 LEU 72 HD11 LEU 72 37.055 33.975 32.245 530 HD12 LEU 72 HD12 LEU 72 36.333 32.570 32.358 531 HD13 LEU 72 HD13 LEU 72 35.481 33.904 32.398 532 HD21 LEU 72 HD21 LEU 72 37.169 35.480 34.168 533 HD22 LEU 72 HD22 LEU 72 35.604 35.402 34.392 534 HD23 LEU 72 HD23 LEU 72 36.592 35.050 35.578 535 H GLN 73 H GLN 73 36.457 30.331 36.578 536 HA GLN 73 HA GLN 73 38.791 29.649 35.516 537 HB2 GLN 73 HB2 GLN 73 38.465 30.324 37.820 538 HB3 GLN 73 HB3 GLN 73 37.799 28.939 38.083 539 HG2 GLN 73 HG2 GLN 73 39.968 28.709 38.800 540 HG3 GLN 73 HG3 GLN 73 39.891 27.891 37.476 541 HE21 GLN 73 HE21 GLN 73 41.498 28.378 35.947 542 HE22 GLN 73 HE22 GLN 73 42.249 29.662 35.862 543 H GLU 74 H GLU 74 35.996 27.622 36.109 544 HA GLU 74 HA GLU 74 37.010 25.346 35.359 545 HB2 GLU 74 HB2 GLU 74 34.329 26.225 35.378 546 HB3 GLU 74 HB3 GLU 74 34.660 24.819 34.789 547 HG2 GLU 74 HG2 GLU 74 35.681 24.365 37.014 548 HG3 GLU 74 HG3 GLU 74 34.844 25.588 37.497 549 H ALA 75 H ALA 75 35.869 27.879 33.326 550 HA ALA 75 HA ALA 75 36.079 26.620 30.997 551 HB1 ALA 75 HB1 ALA 75 35.367 28.735 30.137 552 HB2 ALA 75 HB2 ALA 75 34.401 28.265 31.300 553 HB3 ALA 75 HB3 ALA 75 35.512 29.356 31.587 554 H SER 76 H SER 76 38.566 27.806 32.746 555 HA SER 76 HA SER 76 39.837 29.417 31.233 556 HB2 SER 76 HB2 SER 76 41.729 29.014 32.667 557 HB3 SER 76 HB3 SER 76 40.434 29.297 33.490 558 HG SER 76 HG SER 76 40.379 27.332 34.101 559 H GLY 77 H GLY 77 40.384 25.977 31.135 560 HA2 GLY 77 HA2 GLY 77 42.429 25.861 29.529 561 HA3 GLY 77 HA3 GLY 77 41.439 24.688 29.807 562 H PHE 78 H PHE 78 39.068 26.039 28.665 563 HA PHE 78 HA PHE 78 39.344 25.723 26.038 564 HB2 PHE 78 HB2 PHE 78 37.060 26.665 27.417 565 HB3 PHE 78 HB3 PHE 78 37.058 26.154 25.944 566 HD1 PHE 78 HD1 PHE 78 36.025 25.190 28.926 567 HD2 PHE 78 HD2 PHE 78 38.086 23.606 25.817 568 HE1 PHE 78 HE1 PHE 78 35.481 23.045 29.658 569 HE2 PHE 78 HE2 PHE 78 37.575 21.451 26.578 570 HZ PHE 78 HZ PHE 78 36.255 21.183 28.493 571 H ILE 79 H ILE 79 38.976 28.583 27.999 572 HA ILE 79 HA ILE 79 38.982 30.461 26.191 573 HB ILE 79 HB ILE 79 39.740 30.628 28.893 574 HG12 ILE 79 HG12 ILE 79 37.277 31.474 27.745 575 HG13 ILE 79 HG13 ILE 79 37.425 30.084 28.436 576 HG21 ILE 79 HG21 ILE 79 39.560 32.967 28.752 577 HG22 ILE 79 HG22 ILE 79 40.720 32.440 27.811 578 HG23 ILE 79 HG23 ILE 79 39.322 32.851 27.191 579 HD11 ILE 79 HD11 ILE 79 36.398 31.583 29.911 580 HD12 ILE 79 HD12 ILE 79 37.794 31.143 30.514 581 HD13 ILE 79 HD13 ILE 79 37.645 32.555 29.813 582 H ARG 80 H ARG 80 41.764 29.080 27.774 583 HA ARG 80 HA ARG 80 43.779 30.182 26.559 584 HB2 ARG 80 HB2 ARG 80 44.258 28.930 28.411 585 HB3 ARG 80 HB3 ARG 80 43.412 27.719 27.912 586 HG2 ARG 80 HG2 ARG 80 45.062 27.017 26.502 587 HG3 ARG 80 HG3 ARG 80 45.829 28.370 26.614 588 HD2 ARG 80 HD2 ARG 80 46.898 26.624 27.822 589 HD3 ARG 80 HD3 ARG 80 46.597 27.865 28.717 590 HE ARG 80 HE ARG 80 45.021 26.674 29.807 591 HH11 ARG 80 HH11 ARG 80 44.790 24.760 30.957 592 HH12 ARG 80 HH12 ARG 80 44.972 23.462 30.249 593 HH21 ARG 80 HH21 ARG 80 45.971 24.591 27.421 594 HH22 ARG 80 HH22 ARG 80 45.657 23.360 28.200 595 H SER 81 H SER 81 42.091 27.394 25.390 596 HA SER 81 HA SER 81 43.472 26.943 23.212 597 HB2 SER 81 HB2 SER 81 41.930 25.419 24.393 598 HB3 SER 81 HB3 SER 81 40.777 26.149 23.639 599 HG SER 81 HG SER 81 41.422 24.376 22.552 600 H LEU 82 H LEU 82 40.510 28.714 23.462 601 HA LEU 82 HA LEU 82 40.148 29.442 21.007 602 HB2 LEU 82 HB2 LEU 82 39.225 30.606 23.437 603 HB3 LEU 82 HB3 LEU 82 38.750 31.163 22.060 604 HG LEU 82 HG LEU 82 38.178 28.527 22.889 605 HD11 LEU 82 HD11 LEU 82 35.974 29.306 23.381 606 HD12 LEU 82 HD12 LEU 82 37.031 30.064 24.285 607 HD13 LEU 82 HD13 LEU 82 36.425 30.776 23.007 608 HD21 LEU 82 HD21 LEU 82 36.578 28.469 21.167 609 HD22 LEU 82 HD22 LEU 82 37.008 29.928 20.726 610 HD23 LEU 82 HD23 LEU 82 38.022 28.722 20.569 611 H LEU 83 H LEU 83 41.957 31.103 23.417 612 HA LEU 83 HA LEU 83 42.656 33.309 22.169 613 HB2 LEU 83 HB2 LEU 83 42.669 33.106 24.527 614 HB3 LEU 83 HB3 LEU 83 43.757 31.992 24.443 615 HG LEU 83 HG LEU 83 45.318 33.600 23.675 616 HD11 LEU 83 HD11 LEU 83 44.830 35.885 23.835 617 HD12 LEU 83 HD12 LEU 83 43.884 35.193 22.769 618 HD13 LEU 83 HD13 LEU 83 43.332 35.535 24.214 619 HD21 LEU 83 HD21 LEU 83 45.605 34.662 25.797 620 HD22 LEU 83 HD22 LEU 83 44.125 34.256 26.186 621 HD23 LEU 83 HD23 LEU 83 45.232 33.137 26.004 622 H GLY 84 H GLY 84 44.524 30.377 22.497 623 HA2 GLY 84 HA2 GLY 84 46.629 30.967 21.103 624 HA3 GLY 84 HA3 GLY 84 46.126 29.516 21.374 625 H LYS 85 H LYS 85 43.647 29.584 19.942 626 HA LYS 85 HA LYS 85 44.212 29.322 17.378 627 HB2 LYS 85 HB2 LYS 85 42.432 28.157 18.615 628 HB3 LYS 85 HB3 LYS 85 41.591 29.463 18.474 629 HG2 LYS 85 HG2 LYS 85 41.708 29.287 16.096 630 HG3 LYS 85 HG3 LYS 85 42.558 27.986 16.231 631 HD2 LYS 85 HD2 LYS 85 40.478 27.189 15.827 632 HD3 LYS 85 HD3 LYS 85 40.626 27.000 17.368 633 HE2 LYS 85 HE2 LYS 85 39.353 28.903 17.791 634 HE3 LYS 85 HE3 LYS 85 39.357 29.297 16.283 635 HZ1 LYS 85 HZ1 LYS 85 37.376 28.319 16.828 636 HZ2 LYS 85 HZ2 LYS 85 38.043 27.468 15.857 637 HZ3 LYS 85 HZ3 LYS 85 38.039 27.102 17.263 638 H ALA 86 H ALA 86 42.610 31.965 18.946 639 HA ALA 86 HA ALA 86 42.015 33.417 16.886 640 HB1 ALA 86 HB1 ALA 86 41.708 35.163 18.484 641 HB2 ALA 86 HB2 ALA 86 41.030 33.827 18.998 642 HB3 ALA 86 HB3 ALA 86 42.435 34.276 19.575 643 H MET 87 H MET 87 44.986 33.459 18.659 644 HA MET 87 HA MET 87 46.093 35.411 17.198 645 HB2 MET 87 HB2 MET 87 47.058 34.075 19.527 646 HB3 MET 87 HB3 MET 87 47.896 35.184 18.821 647 HG2 MET 87 HG2 MET 87 45.990 36.687 19.233 648 HG3 MET 87 HG3 MET 87 45.443 35.585 20.191 649 HE1 MET 87 HE1 MET 87 46.497 38.452 22.428 650 HE2 MET 87 HE2 MET 87 45.967 38.569 20.940 651 HE3 MET 87 HE3 MET 87 45.266 37.575 21.955 652 H ARG 88 H ARG 88 46.040 32.204 16.623 653 HA ARG 88 HA ARG 88 47.239 30.692 15.742 654 HB2 ARG 88 HB2 ARG 88 48.011 32.792 14.020 655 HB3 ARG 88 HB3 ARG 88 48.332 31.296 13.716 656 HG2 ARG 88 HG2 ARG 88 46.031 30.805 13.579 657 HG3 ARG 88 HG3 ARG 88 45.679 32.278 13.955 658 HD2 ARG 88 HD2 ARG 88 45.441 32.129 11.666 659 HD3 ARG 88 HD3 ARG 88 46.702 33.013 11.916 660 HE ARG 88 HE ARG 88 47.636 30.617 11.568 661 HH11 ARG 88 HH11 ARG 88 48.300 29.714 9.565 662 HH12 ARG 88 HH12 ARG 88 47.872 30.375 8.300 663 HH21 ARG 88 HH21 ARG 88 46.109 32.724 9.515 664 HH22 ARG 88 HH22 ARG 88 46.627 32.085 8.273 665 H LEU 89 H LEU 89 48.357 30.841 18.024 666 HA LEU 89 HA LEU 89 51.041 31.420 17.965 667 HB2 LEU 89 HB2 LEU 89 49.538 32.926 19.194 668 HB3 LEU 89 HB3 LEU 89 49.224 31.731 20.145 669 HG LEU 89 HG LEU 89 51.492 31.745 20.839 670 HD11 LEU 89 HD11 LEU 89 52.823 33.621 20.400 671 HD12 LEU 89 HD12 LEU 89 52.491 32.856 19.053 672 HD13 LEU 89 HD13 LEU 89 51.708 34.180 19.424 673 HD21 LEU 89 HD21 LEU 89 51.203 33.697 22.223 674 HD22 LEU 89 HD22 LEU 89 50.059 34.198 21.250 675 HD23 LEU 89 HD23 LEU 89 49.836 32.903 22.133 676 H ARG 90 H ARG 90 52.560 29.928 18.732 677 HA ARG 90 HA ARG 90 51.795 27.393 19.187 678 HB2 ARG 90 HB2 ARG 90 53.546 27.814 17.649 679 HB3 ARG 90 HB3 ARG 90 54.419 28.402 18.801 680 HG2 ARG 90 HG2 ARG 90 54.617 26.279 19.785 681 HG3 ARG 90 HG3 ARG 90 53.648 25.669 18.726 682 HD2 ARG 90 HD2 ARG 90 56.153 26.747 17.956 683 HD3 ARG 90 HD3 ARG 90 56.009 25.239 18.328 684 HE ARG 90 HE ARG 90 54.352 25.997 16.343 685 HH11 ARG 90 HH11 ARG 90 54.374 25.092 14.391 686 HH12 ARG 90 HH12 ARG 90 55.582 24.378 13.889 687 HH21 ARG 90 HH21 ARG 90 57.409 24.721 16.528 688 HH22 ARG 90 HH22 ARG 90 57.368 24.161 15.148 689 H ILE 91 H ILE 91 53.025 29.797 21.287 690 HA ILE 91 HA ILE 91 52.453 28.194 23.382 691 HB ILE 91 HB ILE 91 54.027 29.615 24.645 692 HG12 ILE 91 HG12 ILE 91 55.425 29.894 22.233 693 HG13 ILE 91 HG13 ILE 91 54.507 31.040 22.758 694 HG21 ILE 91 HG21 ILE 91 55.756 28.019 24.246 695 HG22 ILE 91 HG22 ILE 91 54.355 27.294 24.380 696 HG23 ILE 91 HG23 ILE 91 54.988 27.536 22.948 697 HD11 ILE 91 HD11 ILE 91 56.732 31.464 23.406 698 HD12 ILE 91 HD12 ILE 91 55.852 31.243 24.704 699 HD13 ILE 91 HD13 ILE 91 56.785 30.079 24.171 700 H VAL 92 H VAL 92 50.467 28.828 24.176 701 HA VAL 92 HA VAL 92 49.937 31.405 24.885 702 HB VAL 92 HB VAL 92 48.403 30.662 23.406 703 HG11 VAL 92 HG11 VAL 92 46.895 28.904 23.824 704 HG12 VAL 92 HG12 VAL 92 48.384 28.378 23.690 705 HG13 VAL 92 HG13 VAL 92 47.723 28.529 25.121 706 HG21 VAL 92 HG21 VAL 92 46.397 31.109 24.613 707 HG22 VAL 92 HG22 VAL 92 47.202 30.938 25.966 708 HG23 VAL 92 HG23 VAL 92 47.536 32.142 24.992 709 HA PRO 93 HA PRO 93 50.518 30.196 28.986 710 HB2 PRO 93 HB2 PRO 93 49.393 32.570 29.959 711 HB3 PRO 93 HB3 PRO 93 50.867 32.102 30.161 712 HG2 PRO 93 HG2 PRO 93 50.399 34.046 28.526 713 HG3 PRO 93 HG3 PRO 93 51.569 33.066 28.203 714 HD2 PRO 93 HD2 PRO 93 48.952 32.984 27.108 715 HD3 PRO 93 HD3 PRO 93 50.286 32.771 26.329 716 H GLU 94 H GLU 94 49.468 29.307 30.876 717 HA GLU 94 HA GLU 94 46.855 28.819 30.762 718 HB2 GLU 94 HB2 GLU 94 48.105 27.041 31.445 719 HB3 GLU 94 HB3 GLU 94 48.810 27.881 32.554 720 HG2 GLU 94 HG2 GLU 94 47.343 26.511 33.652 721 HG3 GLU 94 HG3 GLU 94 46.737 27.944 33.760 722 H LEU 95 H LEU 95 45.182 29.618 32.099 723 HA LEU 95 HA LEU 95 45.638 32.129 32.989 724 HB2 LEU 95 HB2 LEU 95 43.189 31.093 31.990 725 HB3 LEU 95 HB3 LEU 95 43.454 32.600 32.292 726 HG LEU 95 HG LEU 95 44.674 31.180 30.181 727 HD11 LEU 95 HD11 LEU 95 43.304 32.511 28.742 728 HD12 LEU 95 HD12 LEU 95 42.399 31.650 29.715 729 HD13 LEU 95 HD13 LEU 95 42.649 33.185 30.016 730 HD21 LEU 95 HD21 LEU 95 45.540 33.213 29.383 731 HD22 LEU 95 HD22 LEU 95 44.962 33.952 30.659 732 HD23 LEU 95 HD23 LEU 95 46.120 32.884 30.819 733 H THR 96 H THR 96 45.355 32.686 35.141 734 HA THR 96 HA THR 96 43.392 31.486 36.599 735 HB THR 96 HB THR 96 45.736 32.528 37.685 736 HG1 THR 96 HG1 THR 96 45.980 30.369 38.276 737 HG21 THR 96 HG21 THR 96 44.967 31.786 39.799 738 HG22 THR 96 HG22 THR 96 43.984 32.881 39.214 739 HG23 THR 96 HG23 THR 96 43.598 31.348 39.136 740 H PHE 97 H PHE 97 41.743 32.800 37.405 741 HA PHE 97 HA PHE 97 41.698 35.411 36.673 742 HB2 PHE 97 HB2 PHE 97 39.528 33.592 36.922 743 HB3 PHE 97 HB3 PHE 97 39.311 35.103 36.603 744 HD1 PHE 97 HD1 PHE 97 39.839 35.985 34.351 745 HD2 PHE 97 HD2 PHE 97 40.321 32.053 35.150 746 HE1 PHE 97 HE1 PHE 97 39.980 35.534 32.064 747 HE2 PHE 97 HE2 PHE 97 40.492 31.610 32.864 748 HZ PHE 97 HZ PHE 97 40.325 33.350 31.326 749 H PHE 98 H PHE 98 41.129 37.073 37.989 750 HA PHE 98 HA PHE 98 40.793 36.765 40.680 751 HB2 PHE 98 HB2 PHE 98 42.640 38.519 39.432 752 HB3 PHE 98 HB3 PHE 98 42.376 38.501 40.969 753 HD1 PHE 98 HD1 PHE 98 43.217 36.566 42.333 754 HD2 PHE 98 HD2 PHE 98 44.155 36.920 38.419 755 HE1 PHE 98 HE1 PHE 98 44.818 34.886 42.569 756 HE2 PHE 98 HE2 PHE 98 45.751 35.238 38.644 757 HZ PHE 98 HZ PHE 98 46.083 34.219 40.712 758 H TYR 99 H TYR 99 39.416 38.318 41.695 759 HA TYR 99 HA TYR 99 37.870 39.901 40.158 760 HB2 TYR 99 HB2 TYR 99 36.420 40.007 41.948 761 HB3 TYR 99 HB3 TYR 99 36.657 38.533 41.498 762 HD1 TYR 99 HD1 TYR 99 37.022 40.730 44.194 763 HD2 TYR 99 HD2 TYR 99 37.911 36.960 42.983 764 HE1 TYR 99 HE1 TYR 99 37.566 40.147 46.389 765 HE2 TYR 99 HE2 TYR 99 38.455 36.390 45.191 766 HH TYR 99 HH TYR 99 38.631 37.101 47.344 767 H ASP 100 H ASP 100 38.099 42.143 40.048 768 HA ASP 100 HA ASP 100 39.704 43.540 41.790 769 HB2 ASP 100 HB2 ASP 100 40.759 43.121 39.707 770 HB3 ASP 100 HB3 ASP 100 39.572 43.819 38.977 Start of MODEL 8 1 HA PRO 8 HA PRO 8 55.909 44.109 26.694 2 HB2 PRO 8 HB2 PRO 8 54.740 41.854 26.415 3 HB3 PRO 8 HB3 PRO 8 56.277 41.842 26.680 4 HG2 PRO 8 HG2 PRO 8 54.238 41.422 28.620 5 HG3 PRO 8 HG3 PRO 8 55.547 40.587 28.466 6 HD2 PRO 8 HD2 PRO 8 55.451 42.484 30.218 7 HD3 PRO 8 HD3 PRO 8 56.810 42.135 29.536 8 H GLN 9 H GLN 9 54.609 46.064 27.182 9 HA GLN 9 HA GLN 9 52.140 46.014 28.069 10 HB2 GLN 9 HB2 GLN 9 53.485 47.877 28.430 11 HB3 GLN 9 HB3 GLN 9 53.686 48.081 26.897 12 HG2 GLN 9 HG2 GLN 9 51.050 48.352 27.812 13 HG3 GLN 9 HG3 GLN 9 52.022 49.503 28.216 14 HE21 GLN 9 HE21 GLN 9 53.341 50.281 26.101 15 HE22 GLN 9 HE22 GLN 9 52.463 50.655 24.958 16 H ARG 10 H ARG 10 53.178 46.155 24.728 17 HA ARG 10 HA ARG 10 50.786 46.643 23.751 18 HB2 ARG 10 HB2 ARG 10 53.020 45.742 22.281 19 HB3 ARG 10 HB3 ARG 10 51.707 46.272 21.627 20 HG2 ARG 10 HG2 ARG 10 52.172 48.403 22.782 21 HG3 ARG 10 HG3 ARG 10 53.600 47.837 23.047 22 HD2 ARG 10 HD2 ARG 10 52.541 48.270 20.448 23 HD3 ARG 10 HD3 ARG 10 53.582 49.216 21.121 24 HE ARG 10 HE ARG 10 55.173 47.596 20.834 25 HH11 ARG 10 HH11 ARG 10 56.148 46.204 19.374 26 HH12 ARG 10 HH12 ARG 10 55.315 45.480 18.373 27 HH21 ARG 10 HH21 ARG 10 52.473 46.706 19.079 28 HH22 ARG 10 HH22 ARG 10 53.226 45.763 18.206 29 H VAL 11 H VAL 11 52.446 43.594 24.016 30 HA VAL 11 HA VAL 11 50.580 42.012 23.073 31 HB VAL 11 HB VAL 11 52.772 41.374 24.694 32 HG11 VAL 11 HG11 VAL 11 52.443 39.075 24.152 33 HG12 VAL 11 HG12 VAL 11 51.202 39.633 24.962 34 HG13 VAL 11 HG13 VAL 11 51.109 39.459 23.390 35 HG21 VAL 11 HG21 VAL 11 53.709 40.475 22.662 36 HG22 VAL 11 HG22 VAL 11 52.399 40.917 21.888 37 HG23 VAL 11 HG23 VAL 11 53.380 42.013 22.475 38 H ALA 12 H ALA 12 51.153 42.965 26.417 39 HA ALA 12 HA ALA 12 49.295 41.554 27.584 40 HB1 ALA 12 HB1 ALA 12 49.619 43.041 29.399 41 HB2 ALA 12 HB2 ALA 12 51.018 42.573 28.821 42 HB3 ALA 12 HB3 ALA 12 50.448 44.004 28.452 43 H GLN 13 H GLN 13 48.859 44.680 26.126 44 HA GLN 13 HA GLN 13 46.305 45.011 26.722 45 HB2 GLN 13 HB2 GLN 13 48.037 46.342 24.916 46 HB3 GLN 13 HB3 GLN 13 46.523 46.719 24.948 47 HG2 GLN 13 HG2 GLN 13 48.011 46.867 27.342 48 HG3 GLN 13 HG3 GLN 13 48.081 48.062 26.343 49 HE21 GLN 13 HE21 GLN 13 46.718 49.725 26.953 50 HE22 GLN 13 HE22 GLN 13 45.374 49.567 27.575 51 H GLU 14 H GLU 14 47.703 43.637 23.835 52 HA GLU 14 HA GLU 14 45.532 43.163 22.497 53 HB2 GLU 14 HB2 GLU 14 48.063 41.913 22.336 54 HB3 GLU 14 HB3 GLU 14 46.901 41.415 21.424 55 HG2 GLU 14 HG2 GLU 14 46.749 43.533 20.422 56 HG3 GLU 14 HG3 GLU 14 47.861 44.078 21.370 57 H MET 15 H MET 15 47.074 41.062 24.795 58 HA MET 15 HA MET 15 45.466 39.022 24.805 59 HB2 MET 15 HB2 MET 15 47.277 39.923 26.803 60 HB3 MET 15 HB3 MET 15 46.494 38.585 26.970 61 HG2 MET 15 HG2 MET 15 48.244 38.961 24.785 62 HG3 MET 15 HG3 MET 15 48.778 38.397 26.137 63 HE1 MET 15 HE1 MET 15 49.242 35.280 24.261 64 HE2 MET 15 HE2 MET 15 49.638 36.768 23.888 65 HE3 MET 15 HE3 MET 15 49.847 36.241 25.367 66 H GLN 16 H GLN 16 45.352 41.810 26.932 67 HA GLN 16 HA GLN 16 43.277 41.301 28.409 68 HB2 GLN 16 HB2 GLN 16 44.710 43.042 28.919 69 HB3 GLN 16 HB3 GLN 16 44.387 43.763 27.574 70 HG2 GLN 16 HG2 GLN 16 42.345 43.522 29.491 71 HG3 GLN 16 HG3 GLN 16 43.400 44.657 29.660 72 HE21 GLN 16 HE21 GLN 16 43.578 46.081 27.499 73 HE22 GLN 16 HE22 GLN 16 42.272 46.476 26.901 74 H LYS 17 H LYS 17 43.149 42.957 25.361 75 HA LYS 17 HA LYS 17 40.516 43.279 25.221 76 HB2 LYS 17 HB2 LYS 17 42.142 44.719 24.183 77 HB3 LYS 17 HB3 LYS 17 42.466 43.578 23.172 78 HG2 LYS 17 HG2 LYS 17 41.073 45.094 22.104 79 HG3 LYS 17 HG3 LYS 17 40.286 43.756 22.261 80 HD2 LYS 17 HD2 LYS 17 39.110 44.662 24.116 81 HD3 LYS 17 HD3 LYS 17 39.899 45.999 23.966 82 HE2 LYS 17 HE2 LYS 17 38.874 46.506 21.964 83 HE3 LYS 17 HE3 LYS 17 38.378 45.040 21.765 84 HZ1 LYS 17 HZ1 LYS 17 36.662 46.362 22.431 85 HZ2 LYS 17 HZ2 LYS 17 36.896 45.369 23.467 86 HZ3 LYS 17 HZ3 LYS 17 37.357 46.734 23.651 87 H GLU 18 H GLU 18 42.367 40.761 23.701 88 HA GLU 18 HA GLU 18 40.321 39.621 22.472 89 HB2 GLU 18 HB2 GLU 18 42.675 39.386 21.854 90 HB3 GLU 18 HB3 GLU 18 42.812 38.384 23.042 91 HG2 GLU 18 HG2 GLU 18 42.459 36.897 21.446 92 HG3 GLU 18 HG3 GLU 18 40.967 37.156 21.816 93 H ILE 19 H ILE 19 41.761 38.865 25.565 94 HA ILE 19 HA ILE 19 40.292 36.808 26.237 95 HB ILE 19 HB ILE 19 41.766 38.525 27.909 96 HG12 ILE 19 HG12 ILE 19 42.374 35.828 27.218 97 HG13 ILE 19 HG13 ILE 19 42.979 37.023 26.420 98 HG21 ILE 19 HG21 ILE 19 41.451 36.986 29.680 99 HG22 ILE 19 HG22 ILE 19 40.060 37.596 29.233 100 HG23 ILE 19 HG23 ILE 19 40.473 36.140 28.764 101 HD11 ILE 19 HD11 ILE 19 44.563 36.234 27.962 102 HD12 ILE 19 HD12 ILE 19 44.171 37.720 28.344 103 HD13 ILE 19 HD13 ILE 19 43.556 36.505 29.153 104 H ALA 20 H ALA 20 39.655 40.215 26.808 105 HA ALA 20 HA ALA 20 37.383 40.035 28.041 106 HB1 ALA 20 HB1 ALA 20 37.078 42.289 27.380 107 HB2 ALA 20 HB2 ALA 20 38.547 42.076 27.934 108 HB3 ALA 20 HB3 ALA 20 38.292 42.150 26.372 109 H LEU 21 H LEU 21 37.824 39.919 24.577 110 HA LEU 21 HA LEU 21 35.314 39.879 23.844 111 HB2 LEU 21 HB2 LEU 21 37.152 40.344 22.366 112 HB3 LEU 21 HB3 LEU 21 37.519 38.829 22.395 113 HG LEU 21 HG LEU 21 35.501 38.302 21.323 114 HD11 LEU 21 HD11 LEU 21 34.099 39.944 20.420 115 HD12 LEU 21 HD12 LEU 21 34.117 40.035 22.001 116 HD13 LEU 21 HD13 LEU 21 34.957 41.065 21.140 117 HD21 LEU 21 HD21 LEU 21 36.082 39.256 19.178 118 HD22 LEU 21 HD22 LEU 21 36.997 40.315 19.919 119 HD23 LEU 21 HD23 LEU 21 37.394 38.782 19.927 120 H ILE 22 H ILE 22 37.386 37.138 24.431 121 HA ILE 22 HA ILE 22 35.645 35.221 23.884 122 HB ILE 22 HB ILE 22 38.111 35.024 25.233 123 HG12 ILE 22 HG12 ILE 22 37.677 34.282 22.526 124 HG13 ILE 22 HG13 ILE 22 38.199 35.706 22.889 125 HG21 ILE 22 HG21 ILE 22 38.014 32.687 24.826 126 HG22 ILE 22 HG22 ILE 22 36.801 33.136 25.741 127 HG23 ILE 22 HG23 ILE 22 36.571 32.867 24.197 128 HD11 ILE 22 HD11 ILE 22 40.012 34.349 22.257 129 HD12 ILE 22 HD12 ILE 22 40.186 34.766 23.776 130 HD13 ILE 22 HD13 ILE 22 39.657 33.319 23.407 131 H LEU 23 H LEU 23 36.436 36.635 26.935 132 HA LEU 23 HA LEU 23 34.929 35.268 28.603 133 HB2 LEU 23 HB2 LEU 23 36.852 36.560 29.188 134 HB3 LEU 23 HB3 LEU 23 36.056 37.860 28.857 135 HG LEU 23 HG LEU 23 35.069 36.262 30.896 136 HD11 LEU 23 HD11 LEU 23 36.515 37.350 32.491 137 HD12 LEU 23 HD12 LEU 23 37.380 36.518 31.459 138 HD13 LEU 23 HD13 LEU 23 37.246 38.087 31.294 139 HD21 LEU 23 HD21 LEU 23 34.406 38.330 31.888 140 HD22 LEU 23 HD22 LEU 23 35.117 39.110 30.707 141 HD23 LEU 23 HD23 LEU 23 33.838 38.224 30.413 142 H GLN 24 H GLN 24 34.005 37.948 26.680 143 HA GLN 24 HA GLN 24 31.520 38.143 27.692 144 HB2 GLN 24 HB2 GLN 24 32.865 39.616 25.642 145 HB3 GLN 24 HB3 GLN 24 31.378 39.920 25.999 146 HG2 GLN 24 HG2 GLN 24 31.949 40.702 28.099 147 HG3 GLN 24 HG3 GLN 24 33.396 40.134 27.982 148 HE21 GLN 24 HE21 GLN 24 33.805 42.545 28.622 149 HE22 GLN 24 HE22 GLN 24 33.949 43.540 27.523 150 H ARG 25 H ARG 25 32.750 36.494 24.959 151 HA ARG 25 HA ARG 25 30.351 36.095 23.829 152 HB2 ARG 25 HB2 ARG 25 32.992 35.639 22.869 153 HB3 ARG 25 HB3 ARG 25 31.787 35.043 22.080 154 HG2 ARG 25 HG2 ARG 25 32.125 37.833 22.440 155 HG3 ARG 25 HG3 ARG 25 32.612 37.094 21.157 156 HD2 ARG 25 HD2 ARG 25 29.881 37.348 21.887 157 HD3 ARG 25 HD3 ARG 25 30.560 38.186 20.760 158 HE ARG 25 HE ARG 25 30.125 35.482 20.531 159 HH11 ARG 25 HH11 ARG 25 29.601 34.569 18.598 160 HH12 ARG 25 HH12 ARG 25 29.572 35.395 17.359 161 HH21 ARG 25 HH21 ARG 25 30.348 38.226 18.680 162 HH22 ARG 25 HH22 ARG 25 30.009 37.529 17.408 163 H GLU 26 H GLU 26 32.754 33.849 25.049 164 HA GLU 26 HA GLU 26 31.363 31.717 24.194 165 HB2 GLU 26 HB2 GLU 26 33.710 31.788 23.904 166 HB3 GLU 26 HB3 GLU 26 33.897 31.745 25.452 167 HG2 GLU 26 HG2 GLU 26 34.324 29.631 24.794 168 HG3 GLU 26 HG3 GLU 26 32.903 29.547 25.430 169 H ILE 27 H ILE 27 31.711 33.119 27.256 170 HA ILE 27 HA ILE 27 30.034 31.343 28.442 171 HB ILE 27 HB ILE 27 30.915 31.996 30.511 172 HG12 ILE 27 HG12 ILE 27 32.996 33.336 29.182 173 HG13 ILE 27 HG13 ILE 27 31.819 34.083 29.882 174 HG21 ILE 27 HG21 ILE 27 32.895 30.676 30.332 175 HG22 ILE 27 HG22 ILE 27 31.705 29.993 29.543 176 HG23 ILE 27 HG23 ILE 27 32.818 30.798 28.754 177 HD11 ILE 27 HD11 ILE 27 33.687 34.061 31.310 178 HD12 ILE 27 HD12 ILE 27 32.515 33.236 31.983 179 HD13 ILE 27 HD13 ILE 27 33.710 32.478 31.274 180 H LYS 28 H LYS 28 28.225 32.186 29.716 181 HA LYS 28 HA LYS 28 26.929 34.101 28.480 182 HB2 LYS 28 HB2 LYS 28 26.211 32.458 30.678 183 HB3 LYS 28 HB3 LYS 28 25.219 33.538 30.149 184 HG2 LYS 28 HG2 LYS 28 26.139 31.430 28.488 185 HG3 LYS 28 HG3 LYS 28 24.809 31.313 29.293 186 HD2 LYS 28 HD2 LYS 28 23.948 33.197 28.038 187 HD3 LYS 28 HD3 LYS 28 25.243 33.163 27.169 188 HE2 LYS 28 HE2 LYS 28 24.705 30.909 26.509 189 HE3 LYS 28 HE3 LYS 28 23.375 31.010 27.318 190 HZ1 LYS 28 HZ1 LYS 28 22.991 31.470 25.128 191 HZ2 LYS 28 HZ2 LYS 28 22.699 32.668 25.897 192 HZ3 LYS 28 HZ3 LYS 28 23.937 32.572 25.142 193 H ASP 29 H ASP 29 27.595 36.216 28.682 194 HA ASP 29 HA ASP 29 28.266 37.339 30.989 195 HB2 ASP 29 HB2 ASP 29 29.165 37.864 28.712 196 HB3 ASP 29 HB3 ASP 29 27.923 38.799 28.585 197 HA PRO 30 HA PRO 30 24.068 39.406 30.792 198 HB2 PRO 30 HB2 PRO 30 22.399 37.288 29.984 199 HB3 PRO 30 HB3 PRO 30 22.214 38.800 29.649 200 HG2 PRO 30 HG2 PRO 30 23.131 37.282 27.803 201 HG3 PRO 30 HG3 PRO 30 23.718 38.724 27.911 202 HD2 PRO 30 HD2 PRO 30 24.903 36.346 28.884 203 HD3 PRO 30 HD3 PRO 30 25.639 37.527 28.180 204 H ARG 31 H ARG 31 24.523 36.213 31.956 205 HA ARG 31 HA ARG 31 23.246 36.215 34.219 206 HB2 ARG 31 HB2 ARG 31 24.271 34.280 33.198 207 HB3 ARG 31 HB3 ARG 31 25.670 34.837 33.604 208 HG2 ARG 31 HG2 ARG 31 25.301 34.448 35.827 209 HG3 ARG 31 HG3 ARG 31 23.762 34.302 35.622 210 HD2 ARG 31 HD2 ARG 31 24.477 32.181 35.994 211 HD3 ARG 31 HD3 ARG 31 24.200 32.224 34.460 212 HE ARG 31 HE ARG 31 26.772 32.732 34.812 213 HH11 ARG 31 HH11 ARG 31 28.367 31.177 34.448 214 HH12 ARG 31 HH12 ARG 31 28.009 29.730 34.463 215 HH21 ARG 31 HH21 ARG 31 24.868 30.044 35.081 216 HH22 ARG 31 HH22 ARG 31 25.964 29.065 34.833 217 H LEU 32 H LEU 32 26.033 37.950 33.554 218 HA LEU 32 HA LEU 32 26.492 38.817 36.071 219 HB2 LEU 32 HB2 LEU 32 28.202 38.822 33.797 220 HB3 LEU 32 HB3 LEU 32 28.619 39.490 35.144 221 HG LEU 32 HG LEU 32 28.165 36.701 34.928 222 HD11 LEU 32 HD11 LEU 32 30.540 36.506 34.926 223 HD12 LEU 32 HD12 LEU 32 30.075 37.361 33.676 224 HD13 LEU 32 HD13 LEU 32 30.659 38.085 34.958 225 HD21 LEU 32 HD21 LEU 32 29.219 36.504 37.001 226 HD22 LEU 32 HD22 LEU 32 29.376 38.078 37.074 227 HD23 LEU 32 HD23 LEU 32 27.936 37.423 37.129 228 H GLY 33 H GLY 33 24.407 39.974 34.167 229 HA2 GLY 33 HA2 GLY 33 23.466 41.906 33.958 230 HA3 GLY 33 HA3 GLY 33 24.688 42.579 34.655 231 H MET 34 H MET 34 25.689 40.773 32.019 232 HA MET 34 HA MET 34 26.471 41.081 30.115 233 HB2 MET 34 HB2 MET 34 24.032 41.655 29.850 234 HB3 MET 34 HB3 MET 34 24.594 43.069 29.502 235 HG2 MET 34 HG2 MET 34 25.733 42.226 27.665 236 HG3 MET 34 HG3 MET 34 25.361 40.764 28.058 237 HE1 MET 34 HE1 MET 34 22.754 43.772 26.130 238 HE2 MET 34 HE2 MET 34 23.427 44.033 27.539 239 HE3 MET 34 HE3 MET 34 24.332 43.836 26.254 240 H MET 35 H MET 35 27.756 42.713 32.150 241 HA MET 35 HA MET 35 29.131 44.593 30.793 242 HB2 MET 35 HB2 MET 35 27.124 45.647 31.613 243 HB3 MET 35 HB3 MET 35 27.623 45.359 33.062 244 HG2 MET 35 HG2 MET 35 29.417 46.796 32.805 245 HG3 MET 35 HG3 MET 35 29.130 46.957 31.281 246 HE1 MET 35 HE1 MET 35 26.303 49.338 30.955 247 HE2 MET 35 HE2 MET 35 27.541 48.692 30.208 248 HE3 MET 35 HE3 MET 35 26.347 47.775 30.702 249 H THR 36 H THR 36 30.555 42.624 31.264 250 HA THR 36 HA THR 36 32.061 42.888 33.508 251 HB THR 36 HB THR 36 32.113 40.608 31.869 252 HG1 THR 36 HG1 THR 36 30.277 40.071 32.572 253 HG21 THR 36 HG21 THR 36 32.877 39.464 33.813 254 HG22 THR 36 HG22 THR 36 33.833 40.679 33.472 255 HG23 THR 36 HG23 THR 36 32.764 40.814 34.633 256 H THR 37 H THR 37 34.296 43.503 33.226 257 HA THR 37 HA THR 37 35.388 43.677 30.744 258 HB THR 37 HB THR 37 35.887 45.603 32.696 259 HG1 THR 37 HG1 THR 37 34.447 46.949 31.647 260 HG21 THR 37 HG21 THR 37 36.562 47.029 30.873 261 HG22 THR 37 HG22 THR 37 37.421 45.698 30.895 262 HG23 THR 37 HG23 THR 37 36.225 45.853 29.867 263 H VAL 38 H VAL 38 37.846 43.532 30.679 264 HA VAL 38 HA VAL 38 39.094 42.389 32.809 265 HB VAL 38 HB VAL 38 39.997 42.485 30.163 266 HG11 VAL 38 HG11 VAL 38 41.658 40.902 30.783 267 HG12 VAL 38 HG12 VAL 38 41.838 42.252 31.592 268 HG13 VAL 38 HG13 VAL 38 41.163 40.997 32.284 269 HG21 VAL 38 HG21 VAL 38 39.510 40.128 30.067 270 HG22 VAL 38 HG22 VAL 38 38.920 40.214 31.535 271 HG23 VAL 38 HG23 VAL 38 38.188 40.956 30.343 272 H SER 39 H SER 39 40.433 43.659 34.121 273 HA SER 39 HA SER 39 41.041 46.157 33.632 274 HB2 SER 39 HB2 SER 39 42.055 44.521 35.745 275 HB3 SER 39 HB3 SER 39 42.176 46.076 35.733 276 HG SER 39 HG SER 39 40.496 45.590 36.943 277 H GLY 40 H GLY 40 42.920 43.284 33.389 278 HA2 GLY 40 HA2 GLY 40 44.615 43.833 31.628 279 HA3 GLY 40 HA3 GLY 40 45.298 44.357 32.929 280 H VAL 41 H VAL 41 46.859 42.581 32.019 281 HA VAL 41 HA VAL 41 46.505 40.230 33.277 282 HB VAL 41 HB VAL 41 47.455 39.030 31.585 283 HG11 VAL 41 HG11 VAL 41 45.702 39.147 29.946 284 HG12 VAL 41 HG12 VAL 41 45.106 39.203 31.412 285 HG13 VAL 41 HG13 VAL 41 45.250 40.533 30.564 286 HG21 VAL 41 HG21 VAL 41 47.901 39.939 29.430 287 HG22 VAL 41 HG22 VAL 41 47.583 41.383 29.995 288 HG23 VAL 41 HG23 VAL 41 48.843 40.584 30.527 289 H GLU 42 H GLU 42 48.446 39.102 34.043 290 HA GLU 42 HA GLU 42 50.900 40.291 33.883 291 HB2 GLU 42 HB2 GLU 42 50.070 40.860 35.976 292 HB3 GLU 42 HB3 GLU 42 49.676 39.379 36.263 293 HG2 GLU 42 HG2 GLU 42 51.898 38.757 36.483 294 HG3 GLU 42 HG3 GLU 42 52.386 40.146 35.969 295 H MET 43 H MET 43 52.169 38.931 32.701 296 HA MET 43 HA MET 43 51.636 36.304 32.499 297 HB2 MET 43 HB2 MET 43 53.099 37.879 30.646 298 HB3 MET 43 HB3 MET 43 52.722 36.384 30.413 299 HG2 MET 43 HG2 MET 43 50.412 37.015 30.397 300 HG3 MET 43 HG3 MET 43 50.848 38.507 30.512 301 HE1 MET 43 HE1 MET 43 52.529 39.274 27.212 302 HE2 MET 43 HE2 MET 43 52.073 39.894 28.597 303 HE3 MET 43 HE3 MET 43 53.229 38.812 28.556 304 H SER 44 H SER 44 53.227 34.644 32.697 305 HA SER 44 HA SER 44 55.091 35.018 34.547 306 HB2 SER 44 HB2 SER 44 53.710 33.055 34.430 307 HB3 SER 44 HB3 SER 44 54.407 32.660 33.092 308 HG SER 44 HG SER 44 55.646 31.636 34.321 309 H ARG 45 H ARG 45 57.402 34.514 34.502 310 HA ARG 45 HA ARG 45 58.895 35.432 32.614 311 HB2 ARG 45 HB2 ARG 45 59.710 35.085 34.831 312 HB3 ARG 45 HB3 ARG 45 59.609 33.540 34.641 313 HG2 ARG 45 HG2 ARG 45 61.314 33.662 32.959 314 HG3 ARG 45 HG3 ARG 45 61.440 35.195 33.221 315 HD2 ARG 45 HD2 ARG 45 62.367 34.836 35.313 316 HD3 ARG 45 HD3 ARG 45 62.033 33.313 35.258 317 HE ARG 45 HE ARG 45 63.684 33.966 33.264 318 HH11 ARG 45 HH11 ARG 45 65.806 33.237 33.181 319 HH12 ARG 45 HH12 ARG 45 66.483 32.808 34.436 320 HH21 ARG 45 HH21 ARG 45 64.100 33.274 36.478 321 HH22 ARG 45 HH22 ARG 45 65.511 32.828 36.310 322 H ASP 46 H ASP 46 57.928 32.174 32.960 323 HA ASP 46 HA ASP 46 59.178 31.181 30.805 324 HB2 ASP 46 HB2 ASP 46 58.419 29.088 31.707 325 HB3 ASP 46 HB3 ASP 46 59.280 29.873 32.743 326 H LEU 47 H LEU 47 56.349 32.697 30.924 327 HA LEU 47 HA LEU 47 54.437 32.679 30.035 328 HB2 LEU 47 HB2 LEU 47 55.862 31.766 27.779 329 HB3 LEU 47 HB3 LEU 47 54.426 32.368 27.702 330 HG LEU 47 HG LEU 47 56.644 33.882 28.594 331 HD11 LEU 47 HD11 LEU 47 56.644 34.938 26.461 332 HD12 LEU 47 HD12 LEU 47 56.928 33.388 26.303 333 HD13 LEU 47 HD13 LEU 47 55.486 33.965 25.994 334 HD21 LEU 47 HD21 LEU 47 55.284 35.792 28.296 335 HD22 LEU 47 HD22 LEU 47 54.081 34.859 27.863 336 HD23 LEU 47 HD23 LEU 47 54.627 34.807 29.348 337 H ALA 48 H ALA 48 55.011 30.131 31.485 338 HA ALA 48 HA ALA 48 53.372 28.300 30.444 339 HB1 ALA 48 HB1 ALA 48 53.929 27.076 32.396 340 HB2 ALA 48 HB2 ALA 48 55.248 27.598 31.691 341 HB3 ALA 48 HB3 ALA 48 54.685 28.344 32.969 342 H TYR 49 H TYR 49 52.903 30.767 32.751 343 HA TYR 49 HA TYR 49 50.256 30.365 32.916 344 HB2 TYR 49 HB2 TYR 49 51.983 30.924 35.087 345 HB3 TYR 49 HB3 TYR 49 50.474 31.301 35.203 346 HD1 TYR 49 HD1 TYR 49 48.758 29.504 35.324 347 HD2 TYR 49 HD2 TYR 49 52.718 28.640 35.443 348 HE1 TYR 49 HE1 TYR 49 48.269 27.386 36.203 349 HE2 TYR 49 HE2 TYR 49 52.226 26.544 36.355 350 HH TYR 49 HH TYR 49 50.643 25.127 37.081 351 H ALA 50 H ALA 50 48.883 32.299 33.058 352 HA ALA 50 HA ALA 50 49.984 34.727 33.442 353 HB1 ALA 50 HB1 ALA 50 48.703 35.697 31.717 354 HB2 ALA 50 HB2 ALA 50 49.716 34.638 31.117 355 HB3 ALA 50 HB3 ALA 50 48.189 34.260 31.297 356 H LYS 51 H LYS 51 48.880 36.030 34.871 357 HA LYS 51 HA LYS 51 46.529 35.367 36.019 358 HB2 LYS 51 HB2 LYS 51 48.420 37.351 36.719 359 HB3 LYS 51 HB3 LYS 51 47.095 37.137 37.514 360 HG2 LYS 51 HG2 LYS 51 47.799 35.001 38.202 361 HG3 LYS 51 HG3 LYS 51 49.075 35.102 37.310 362 HD2 LYS 51 HD2 LYS 51 48.776 37.018 39.363 363 HD3 LYS 51 HD3 LYS 51 49.271 35.596 39.773 364 HE2 LYS 51 HE2 LYS 51 51.143 35.808 38.333 365 HE3 LYS 51 HE3 LYS 51 50.634 37.202 37.853 366 HZ1 LYS 51 HZ1 LYS 51 52.268 37.007 39.692 367 HZ2 LYS 51 HZ2 LYS 51 51.362 38.142 39.634 368 HZ3 LYS 51 HZ3 LYS 51 51.061 37.015 40.502 369 H VAL 52 H VAL 52 44.552 36.398 35.585 370 HA VAL 52 HA VAL 52 44.428 38.601 34.020 371 HB VAL 52 HB VAL 52 42.489 36.589 34.053 372 HG11 VAL 52 HG11 VAL 52 41.545 37.688 32.152 373 HG12 VAL 52 HG12 VAL 52 41.552 38.652 33.409 374 HG13 VAL 52 HG13 VAL 52 42.651 38.814 32.279 375 HG21 VAL 52 HG21 VAL 52 43.186 35.955 31.867 376 HG22 VAL 52 HG22 VAL 52 44.378 36.992 31.966 377 HG23 VAL 52 HG23 VAL 52 44.350 35.727 32.917 378 H TYR 53 H TYR 53 43.347 40.404 34.964 379 HA TYR 53 HA TYR 53 41.918 40.149 37.291 380 HB2 TYR 53 HB2 TYR 53 43.296 42.451 36.382 381 HB3 TYR 53 HB3 TYR 53 42.618 42.311 37.778 382 HD1 TYR 53 HD1 TYR 53 43.660 40.671 39.460 383 HD2 TYR 53 HD2 TYR 53 45.616 41.813 36.100 384 HE1 TYR 53 HE1 TYR 53 45.652 39.853 40.345 385 HE2 TYR 53 HE2 TYR 53 47.622 41.007 37.004 386 HH TYR 53 HH TYR 53 48.659 40.082 38.834 387 H VAL 54 H VAL 54 39.705 40.704 37.333 388 HA VAL 54 HA VAL 54 38.502 41.578 35.059 389 HB VAL 54 HB VAL 54 37.615 39.355 36.537 390 HG11 VAL 54 HG11 VAL 54 36.112 38.867 34.737 391 HG12 VAL 54 HG12 VAL 54 35.802 40.290 35.361 392 HG13 VAL 54 HG13 VAL 54 36.604 40.179 34.000 393 HG21 VAL 54 HG21 VAL 54 38.307 37.939 34.706 394 HG22 VAL 54 HG22 VAL 54 38.914 39.212 33.986 395 HG23 VAL 54 HG23 VAL 54 39.554 38.687 35.336 396 H THR 55 H THR 55 36.441 42.758 35.367 397 HA THR 55 HA THR 55 35.716 43.396 37.882 398 HB THR 55 HB THR 55 37.248 45.016 37.161 399 HG1 THR 55 HG1 THR 55 35.958 45.947 38.519 400 HG21 THR 55 HG21 THR 55 36.725 46.616 35.564 401 HG22 THR 55 HG22 THR 55 36.863 45.177 34.917 402 HG23 THR 55 HG23 THR 55 35.427 45.793 35.178 403 H PHE 56 H PHE 56 33.554 43.816 38.321 404 HA PHE 56 HA PHE 56 31.828 42.939 36.415 405 HB2 PHE 56 HB2 PHE 56 31.894 42.231 39.179 406 HB3 PHE 56 HB3 PHE 56 30.790 41.714 38.208 407 HD1 PHE 56 HD1 PHE 56 34.274 41.346 38.900 408 HD2 PHE 56 HD2 PHE 56 31.150 39.715 36.903 409 HE1 PHE 56 HE1 PHE 56 35.563 39.466 38.416 410 HE2 PHE 56 HE2 PHE 56 32.416 37.799 36.502 411 HZ PHE 56 HZ PHE 56 34.626 37.672 37.232 412 H LEU 57 H LEU 57 29.769 43.921 36.135 413 HA LEU 57 HA LEU 57 28.757 45.765 37.787 414 HB2 LEU 57 HB2 LEU 57 28.232 45.730 35.446 415 HB3 LEU 57 HB3 LEU 57 27.510 44.360 35.637 416 HG LEU 57 HG LEU 57 25.910 45.407 36.999 417 HD11 LEU 57 HD11 LEU 57 25.730 47.775 37.044 418 HD12 LEU 57 HD12 LEU 57 27.078 47.305 37.730 419 HD13 LEU 57 HD13 LEU 57 27.099 47.880 36.254 420 HD21 LEU 57 HD21 LEU 57 24.728 46.538 35.249 421 HD22 LEU 57 HD22 LEU 57 26.063 46.574 34.397 422 HD23 LEU 57 HD23 LEU 57 25.357 45.190 34.708 423 H ASN 58 H ASN 58 28.594 42.361 37.852 424 HA ASN 58 HA ASN 58 26.506 42.128 39.503 425 HB2 ASN 58 HB2 ASN 58 27.050 40.456 37.839 426 HB3 ASN 58 HB3 ASN 58 28.281 40.053 38.707 427 HD21 ASN 58 HD21 ASN 58 24.959 39.363 40.634 428 HD22 ASN 58 HD22 ASN 58 25.268 40.737 40.148 429 H ASP 59 H ASP 59 29.125 43.452 40.400 430 HA ASP 59 HA ASP 59 30.012 42.535 42.656 431 HB2 ASP 59 HB2 ASP 59 30.875 44.407 41.319 432 HB3 ASP 59 HB3 ASP 59 29.688 45.270 41.846 433 H LYS 60 H LYS 60 26.952 43.722 42.127 434 HA LYS 60 HA LYS 60 26.065 44.402 44.529 435 HB2 LYS 60 HB2 LYS 60 25.205 44.967 42.246 436 HB3 LYS 60 HB3 LYS 60 24.472 43.592 42.326 437 HG2 LYS 60 HG2 LYS 60 23.111 44.332 44.070 438 HG3 LYS 60 HG3 LYS 60 23.966 45.621 44.263 439 HD2 LYS 60 HD2 LYS 60 23.269 46.409 42.117 440 HD3 LYS 60 HD3 LYS 60 22.420 45.116 41.915 441 HE2 LYS 60 HE2 LYS 60 21.033 45.729 43.740 442 HE3 LYS 60 HE3 LYS 60 21.892 47.010 43.971 443 HZ1 LYS 60 HZ1 LYS 60 20.024 47.526 42.787 444 HZ2 LYS 60 HZ2 LYS 60 21.178 47.790 41.944 445 HZ3 LYS 60 HZ3 LYS 60 20.377 46.595 41.729 446 H ASP 61 H ASP 61 26.667 41.231 43.539 447 HA ASP 61 HA ASP 61 26.333 40.721 46.139 448 HB2 ASP 61 HB2 ASP 61 24.482 39.622 45.243 449 HB3 ASP 61 HB3 ASP 61 25.392 38.840 44.247 450 H GLU 62 H GLU 62 28.254 40.146 47.030 451 HA GLU 62 HA GLU 62 30.446 39.576 45.877 452 HB2 GLU 62 HB2 GLU 62 30.091 38.792 48.576 453 HB3 GLU 62 HB3 GLU 62 31.366 39.449 47.965 454 HG2 GLU 62 HG2 GLU 62 30.606 41.084 49.308 455 HG3 GLU 62 HG3 GLU 62 30.066 41.548 47.921 456 H ASP 63 H ASP 63 28.157 37.264 47.004 457 HA ASP 63 HA ASP 63 29.544 35.002 46.724 458 HB2 ASP 63 HB2 ASP 63 27.823 35.099 48.301 459 HB3 ASP 63 HB3 ASP 63 26.786 35.479 47.200 460 H ALA 64 H ALA 64 27.347 36.586 44.578 461 HA ALA 64 HA ALA 64 27.261 34.805 42.653 462 HB1 ALA 64 HB1 ALA 64 26.213 36.551 41.437 463 HB2 ALA 64 HB2 ALA 64 25.572 36.437 42.882 464 HB3 ALA 64 HB3 ALA 64 26.626 37.578 42.571 465 H VAL 65 H VAL 65 29.443 37.503 43.038 466 HA VAL 65 HA VAL 65 30.848 37.229 40.861 467 HB VAL 65 HB VAL 65 31.655 38.426 43.277 468 HG11 VAL 65 HG11 VAL 65 33.430 39.459 42.084 469 HG12 VAL 65 HG12 VAL 65 33.599 37.885 42.056 470 HG13 VAL 65 HG13 VAL 65 33.025 38.642 40.789 471 HG21 VAL 65 HG21 VAL 65 31.223 40.485 42.132 472 HG22 VAL 65 HG22 VAL 65 30.774 39.663 40.855 473 HG23 VAL 65 HG23 VAL 65 29.906 39.606 42.178 474 H LYS 66 H LYS 66 31.458 35.758 43.982 475 HA LYS 66 HA LYS 66 33.629 34.389 43.472 476 HB2 LYS 66 HB2 LYS 66 32.963 34.783 45.658 477 HB3 LYS 66 HB3 LYS 66 31.642 33.983 45.441 478 HG2 LYS 66 HG2 LYS 66 33.121 32.714 46.715 479 HG3 LYS 66 HG3 LYS 66 32.816 31.973 45.378 480 HD2 LYS 66 HD2 LYS 66 35.093 31.793 45.815 481 HD3 LYS 66 HD3 LYS 66 34.909 32.632 44.513 482 HE2 LYS 66 HE2 LYS 66 35.240 34.628 45.745 483 HE3 LYS 66 HE3 LYS 66 35.410 33.797 47.053 484 HZ1 LYS 66 HZ1 LYS 66 37.441 34.304 46.182 485 HZ2 LYS 66 HZ2 LYS 66 37.284 32.860 46.151 486 HZ3 LYS 66 HZ3 LYS 66 37.125 33.634 44.932 487 H ALA 67 H ALA 67 30.375 33.242 43.025 488 HA ALA 67 HA ALA 67 30.932 30.860 42.040 489 HB1 ALA 67 HB1 ALA 67 28.625 30.851 41.477 490 HB2 ALA 67 HB2 ALA 67 28.813 31.347 42.970 491 HB3 ALA 67 HB3 ALA 67 28.543 32.396 41.814 492 H GLY 68 H GLY 68 30.476 33.829 40.314 493 HA2 GLY 68 HA2 GLY 68 30.631 33.026 37.849 494 HA3 GLY 68 HA3 GLY 68 30.902 34.482 38.340 495 H ILE 69 H ILE 69 33.273 34.142 39.865 496 HA ILE 69 HA ILE 69 35.296 33.839 38.253 497 HB ILE 69 HB ILE 69 35.169 33.990 41.038 498 HG12 ILE 69 HG12 ILE 69 34.815 36.029 39.853 499 HG13 ILE 69 HG13 ILE 69 35.949 36.131 40.918 500 HG21 ILE 69 HG21 ILE 69 37.529 34.131 41.184 501 HG22 ILE 69 HG22 ILE 69 37.073 32.708 40.659 502 HG23 ILE 69 HG23 ILE 69 37.627 33.788 39.641 503 HD11 ILE 69 HD11 ILE 69 36.617 37.232 38.959 504 HD12 ILE 69 HD12 ILE 69 37.581 36.001 39.209 505 HD13 ILE 69 HD13 ILE 69 36.428 35.898 38.127 506 H LYS 70 H LYS 70 33.952 31.440 40.422 507 HA LYS 70 HA LYS 70 35.639 29.489 39.968 508 HB2 LYS 70 HB2 LYS 70 34.016 29.622 41.804 509 HB3 LYS 70 HB3 LYS 70 32.957 29.079 40.795 510 HG2 LYS 70 HG2 LYS 70 34.275 27.099 40.513 511 HG3 LYS 70 HG3 LYS 70 35.286 27.637 41.572 512 HD2 LYS 70 HD2 LYS 70 33.339 27.678 43.129 513 HD3 LYS 70 HD3 LYS 70 32.638 26.753 42.088 514 HE2 LYS 70 HE2 LYS 70 34.325 25.126 42.355 515 HE3 LYS 70 HE3 LYS 70 35.099 26.063 43.333 516 HZ1 LYS 70 HZ1 LYS 70 33.913 24.525 44.501 517 HZ2 LYS 70 HZ2 LYS 70 33.382 25.840 44.819 518 HZ3 LYS 70 HZ3 LYS 70 32.661 24.967 43.909 519 H ALA 71 H ALA 71 32.740 30.179 38.186 520 HA ALA 71 HA ALA 71 32.810 28.180 36.466 521 HB1 ALA 71 HB1 ALA 71 31.195 29.454 35.300 522 HB2 ALA 71 HB2 ALA 71 30.829 29.399 36.841 523 HB3 ALA 71 HB3 ALA 71 31.507 30.696 36.232 524 H LEU 72 H LEU 72 34.047 31.390 36.028 525 HA LEU 72 HA LEU 72 35.128 31.238 33.644 526 HB2 LEU 72 HB2 LEU 72 34.673 33.285 34.672 527 HB3 LEU 72 HB3 LEU 72 35.606 32.935 35.872 528 HG LEU 72 HG LEU 72 37.486 33.166 34.495 529 HD11 LEU 72 HD11 LEU 72 37.323 34.065 32.329 530 HD12 LEU 72 HD12 LEU 72 36.603 32.656 32.399 531 HD13 LEU 72 HD13 LEU 72 35.745 33.986 32.421 532 HD21 LEU 72 HD21 LEU 72 37.359 35.554 34.264 533 HD22 LEU 72 HD22 LEU 72 35.786 35.470 34.433 534 HD23 LEU 72 HD23 LEU 72 36.733 35.112 35.651 535 H GLN 73 H GLN 73 36.641 30.413 36.645 536 HA GLN 73 HA GLN 73 39.046 29.866 35.708 537 HB2 GLN 73 HB2 GLN 73 38.596 30.504 37.988 538 HB3 GLN 73 HB3 GLN 73 37.968 29.096 38.219 539 HG2 GLN 73 HG2 GLN 73 40.161 29.105 39.058 540 HG3 GLN 73 HG3 GLN 73 40.071 28.073 37.893 541 HE21 GLN 73 HE21 GLN 73 41.388 28.430 36.014 542 HE22 GLN 73 HE22 GLN 73 42.279 29.611 35.839 543 H GLU 74 H GLU 74 36.369 27.688 36.170 544 HA GLU 74 HA GLU 74 37.577 25.467 35.380 545 HB2 GLU 74 HB2 GLU 74 35.590 25.394 36.678 546 HB3 GLU 74 HB3 GLU 74 34.792 26.059 35.515 547 HG2 GLU 74 HG2 GLU 74 34.982 24.190 34.187 548 HG3 GLU 74 HG3 GLU 74 36.089 23.575 35.099 549 H ALA 75 H ALA 75 35.904 27.828 33.484 550 HA ALA 75 HA ALA 75 36.035 26.622 31.143 551 HB1 ALA 75 HB1 ALA 75 35.178 28.706 30.355 552 HB2 ALA 75 HB2 ALA 75 34.341 28.213 31.606 553 HB3 ALA 75 HB3 ALA 75 35.440 29.339 31.783 554 H SER 76 H SER 76 38.566 27.980 32.704 555 HA SER 76 HA SER 76 39.843 29.423 31.037 556 HB2 SER 76 HB2 SER 76 41.750 29.034 32.430 557 HB3 SER 76 HB3 SER 76 40.497 29.304 33.319 558 HG SER 76 HG SER 76 40.402 27.265 33.814 559 H GLY 77 H GLY 77 39.982 25.971 30.982 560 HA2 GLY 77 HA2 GLY 77 41.991 25.581 29.355 561 HA3 GLY 77 HA3 GLY 77 40.871 24.542 29.670 562 H PHE 78 H PHE 78 38.677 26.176 28.549 563 HA PHE 78 HA PHE 78 38.850 25.782 25.899 564 HB2 PHE 78 HB2 PHE 78 36.648 26.934 27.225 565 HB3 PHE 78 HB3 PHE 78 36.621 26.211 25.842 566 HD1 PHE 78 HD1 PHE 78 35.512 25.708 28.898 567 HD2 PHE 78 HD2 PHE 78 37.616 23.643 26.139 568 HE1 PHE 78 HE1 PHE 78 35.072 23.719 30.052 569 HE2 PHE 78 HE2 PHE 78 37.173 21.655 27.279 570 HZ PHE 78 HZ PHE 78 35.911 21.698 29.248 571 H ILE 79 H ILE 79 38.709 28.626 27.905 572 HA ILE 79 HA ILE 79 38.826 30.525 26.126 573 HB ILE 79 HB ILE 79 39.647 30.619 28.821 574 HG12 ILE 79 HG12 ILE 79 37.188 31.578 27.753 575 HG13 ILE 79 HG13 ILE 79 37.297 30.189 28.453 576 HG21 ILE 79 HG21 ILE 79 39.570 32.973 28.688 577 HG22 ILE 79 HG22 ILE 79 40.671 32.401 27.703 578 HG23 ILE 79 HG23 ILE 79 39.268 32.870 27.137 579 HD11 ILE 79 HD11 ILE 79 36.401 31.747 29.948 580 HD12 ILE 79 HD12 ILE 79 37.797 31.246 30.500 581 HD13 ILE 79 HD13 ILE 79 37.686 32.658 29.789 582 H ARG 80 H ARG 80 41.561 28.944 27.645 583 HA ARG 80 HA ARG 80 43.574 30.107 26.490 584 HB2 ARG 80 HB2 ARG 80 43.914 28.725 28.347 585 HB3 ARG 80 HB3 ARG 80 43.332 27.491 27.592 586 HG2 ARG 80 HG2 ARG 80 45.246 27.450 26.179 587 HG3 ARG 80 HG3 ARG 80 45.828 28.688 26.929 588 HD2 ARG 80 HD2 ARG 80 46.860 26.731 27.724 589 HD3 ARG 80 HD3 ARG 80 46.097 27.432 28.890 590 HE ARG 80 HE ARG 80 44.893 25.627 29.103 591 HH11 ARG 80 HH11 ARG 80 43.938 23.717 28.705 592 HH12 ARG 80 HH12 ARG 80 44.114 23.041 27.389 593 HH21 ARG 80 HH21 ARG 80 45.963 25.262 25.987 594 HH22 ARG 80 HH22 ARG 80 45.296 23.944 25.799 595 H SER 81 H SER 81 41.890 27.321 25.328 596 HA SER 81 HA SER 81 43.304 26.791 23.210 597 HB2 SER 81 HB2 SER 81 40.624 26.022 23.779 598 HB3 SER 81 HB3 SER 81 41.468 25.375 22.638 599 HG SER 81 HG SER 81 41.792 25.035 25.214 600 H LEU 82 H LEU 82 40.406 28.685 23.340 601 HA LEU 82 HA LEU 82 40.252 29.405 20.840 602 HB2 LEU 82 HB2 LEU 82 39.043 30.500 23.182 603 HB3 LEU 82 HB3 LEU 82 38.719 31.096 21.778 604 HG LEU 82 HG LEU 82 38.125 28.408 22.434 605 HD11 LEU 82 HD11 LEU 82 35.852 29.126 22.691 606 HD12 LEU 82 HD12 LEU 82 36.776 29.876 23.737 607 HD13 LEU 82 HD13 LEU 82 36.310 30.618 22.417 608 HD21 LEU 82 HD21 LEU 82 36.732 28.381 20.540 609 HD22 LEU 82 HD22 LEU 82 37.162 29.869 20.209 610 HD23 LEU 82 HD23 LEU 82 38.225 28.700 20.119 611 H LEU 83 H LEU 83 41.872 30.997 23.443 612 HA LEU 83 HA LEU 83 42.512 33.289 22.323 613 HB2 LEU 83 HB2 LEU 83 42.458 33.044 24.665 614 HB3 LEU 83 HB3 LEU 83 43.604 31.988 24.604 615 HG LEU 83 HG LEU 83 45.078 33.704 23.859 616 HD11 LEU 83 HD11 LEU 83 44.455 35.948 24.108 617 HD12 LEU 83 HD12 LEU 83 43.550 35.242 23.018 618 HD13 LEU 83 HD13 LEU 83 42.982 35.496 24.475 619 HD21 LEU 83 HD21 LEU 83 45.341 34.674 26.025 620 HD22 LEU 83 HD22 LEU 83 43.897 34.158 26.418 621 HD23 LEU 83 HD23 LEU 83 45.065 33.120 26.159 622 H GLY 84 H GLY 84 44.504 30.440 22.654 623 HA2 GLY 84 HA2 GLY 84 46.643 31.160 21.379 624 HA3 GLY 84 HA3 GLY 84 46.176 29.682 21.545 625 H LYS 85 H LYS 85 43.761 29.774 20.023 626 HA LYS 85 HA LYS 85 44.430 29.644 17.483 627 HB2 LYS 85 HB2 LYS 85 42.649 28.383 18.491 628 HB3 LYS 85 HB3 LYS 85 41.790 29.685 18.489 629 HG2 LYS 85 HG2 LYS 85 41.592 29.697 16.226 630 HG3 LYS 85 HG3 LYS 85 42.843 28.787 16.028 631 HD2 LYS 85 HD2 LYS 85 41.009 27.486 15.529 632 HD3 LYS 85 HD3 LYS 85 41.591 26.930 16.866 633 HE2 LYS 85 HE2 LYS 85 39.893 27.988 18.095 634 HE3 LYS 85 HE3 LYS 85 39.353 28.685 16.809 635 HZ1 LYS 85 HZ1 LYS 85 38.112 26.840 17.274 636 HZ2 LYS 85 HZ2 LYS 85 38.777 26.626 16.000 637 HZ3 LYS 85 HZ3 LYS 85 39.279 25.977 17.199 638 H ALA 86 H ALA 86 42.615 32.200 19.035 639 HA ALA 86 HA ALA 86 42.331 33.793 16.954 640 HB1 ALA 86 HB1 ALA 86 41.781 35.437 18.497 641 HB2 ALA 86 HB2 ALA 86 41.033 34.087 18.852 642 HB3 ALA 86 HB3 ALA 86 42.317 34.519 19.671 643 H MET 87 H MET 87 44.815 33.934 19.418 644 HA MET 87 HA MET 87 46.249 35.891 18.420 645 HB2 MET 87 HB2 MET 87 46.910 33.952 20.367 646 HB3 MET 87 HB3 MET 87 48.000 34.963 19.897 647 HG2 MET 87 HG2 MET 87 45.612 35.669 21.227 648 HG3 MET 87 HG3 MET 87 47.041 35.776 21.841 649 HE1 MET 87 HE1 MET 87 45.925 39.403 21.487 650 HE2 MET 87 HE2 MET 87 45.000 38.159 21.808 651 HE3 MET 87 HE3 MET 87 46.404 38.307 22.524 652 H ARG 88 H ARG 88 46.231 32.577 17.551 653 HA ARG 88 HA ARG 88 47.408 31.325 16.201 654 HB2 ARG 88 HB2 ARG 88 48.233 33.723 15.023 655 HB3 ARG 88 HB3 ARG 88 48.482 32.312 14.406 656 HG2 ARG 88 HG2 ARG 88 46.165 32.012 14.117 657 HG3 ARG 88 HG3 ARG 88 45.892 33.399 14.776 658 HD2 ARG 88 HD2 ARG 88 45.781 33.589 12.441 659 HD3 ARG 88 HD3 ARG 88 46.923 34.496 12.993 660 HE ARG 88 HE ARG 88 47.994 32.189 12.329 661 HH11 ARG 88 HH11 ARG 88 49.174 31.888 10.423 662 HH12 ARG 88 HH12 ARG 88 49.008 32.835 9.285 663 HH21 ARG 88 HH21 ARG 88 46.780 34.795 10.719 664 HH22 ARG 88 HH22 ARG 88 47.558 34.594 9.464 665 H LEU 89 H LEU 89 48.477 31.961 18.839 666 HA LEU 89 HA LEU 89 51.220 31.863 18.509 667 HB2 LEU 89 HB2 LEU 89 50.454 33.687 19.797 668 HB3 LEU 89 HB3 LEU 89 49.737 32.703 20.772 669 HG LEU 89 HG LEU 89 51.889 31.853 21.382 670 HD11 LEU 89 HD11 LEU 89 53.776 33.150 20.864 671 HD12 LEU 89 HD12 LEU 89 53.118 32.578 19.541 672 HD13 LEU 89 HD13 LEU 89 52.875 34.086 19.958 673 HD21 LEU 89 HD21 LEU 89 52.396 33.612 22.847 674 HD22 LEU 89 HD22 LEU 89 51.441 34.568 22.022 675 HD23 LEU 89 HD23 LEU 89 50.836 33.344 22.825 676 H ARG 90 H ARG 90 52.142 29.796 18.826 677 HA ARG 90 HA ARG 90 50.808 27.683 19.674 678 HB2 ARG 90 HB2 ARG 90 53.625 27.859 19.468 679 HB3 ARG 90 HB3 ARG 90 52.814 26.528 19.478 680 HG2 ARG 90 HG2 ARG 90 51.904 27.056 17.369 681 HG3 ARG 90 HG3 ARG 90 52.693 28.402 17.360 682 HD2 ARG 90 HD2 ARG 90 54.731 27.191 17.330 683 HD3 ARG 90 HD3 ARG 90 53.925 25.856 17.296 684 HE ARG 90 HE ARG 90 53.195 27.268 15.206 685 HH11 ARG 90 HH11 ARG 90 53.953 26.854 13.115 686 HH12 ARG 90 HH12 ARG 90 55.213 26.084 12.918 687 HH21 ARG 90 HH21 ARG 90 55.885 25.590 16.106 688 HH22 ARG 90 HH22 ARG 90 56.382 25.320 14.727 689 H ILE 91 H ILE 91 52.989 29.754 21.452 690 HA ILE 91 HA ILE 91 52.883 28.210 23.696 691 HB ILE 91 HB ILE 91 54.463 29.942 24.493 692 HG12 ILE 91 HG12 ILE 91 54.765 30.366 21.725 693 HG13 ILE 91 HG13 ILE 91 54.161 31.420 22.703 694 HG21 ILE 91 HG21 ILE 91 56.271 28.705 23.648 695 HG22 ILE 91 HG22 ILE 91 55.130 27.739 24.171 696 HG23 ILE 91 HG23 ILE 91 55.296 28.001 22.618 697 HD11 ILE 91 HD11 ILE 91 56.375 31.962 22.242 698 HD12 ILE 91 HD12 ILE 91 56.233 31.623 23.782 699 HD13 ILE 91 HD13 ILE 91 56.847 30.552 22.789 700 H VAL 92 H VAL 92 50.338 28.971 23.634 701 HA VAL 92 HA VAL 92 49.917 31.262 24.965 702 HB VAL 92 HB VAL 92 48.366 30.582 23.429 703 HG11 VAL 92 HG11 VAL 92 46.785 28.896 23.892 704 HG12 VAL 92 HG12 VAL 92 48.244 28.299 23.740 705 HG13 VAL 92 HG13 VAL 92 47.616 28.499 25.180 706 HG21 VAL 92 HG21 VAL 92 46.403 31.125 24.656 707 HG22 VAL 92 HG22 VAL 92 47.216 30.923 26.000 708 HG23 VAL 92 HG23 VAL 92 47.595 32.104 25.015 709 HA PRO 93 HA PRO 93 50.486 29.677 28.934 710 HB2 PRO 93 HB2 PRO 93 49.442 31.965 30.141 711 HB3 PRO 93 HB3 PRO 93 50.918 31.472 30.228 712 HG2 PRO 93 HG2 PRO 93 50.405 33.557 28.793 713 HG3 PRO 93 HG3 PRO 93 51.533 32.591 28.315 714 HD2 PRO 93 HD2 PRO 93 48.835 32.594 27.416 715 HD3 PRO 93 HD3 PRO 93 50.102 32.501 26.513 716 H GLU 94 H GLU 94 49.474 28.771 30.849 717 HA GLU 94 HA GLU 94 46.870 28.235 30.942 718 HB2 GLU 94 HB2 GLU 94 48.581 26.805 31.819 719 HB3 GLU 94 HB3 GLU 94 48.834 27.854 32.944 720 HG2 GLU 94 HG2 GLU 94 47.543 26.344 33.983 721 HG3 GLU 94 HG3 GLU 94 46.515 27.462 33.629 722 H LEU 95 H LEU 95 45.178 29.380 32.033 723 HA LEU 95 HA LEU 95 45.790 31.907 32.779 724 HB2 LEU 95 HB2 LEU 95 43.291 31.018 31.771 725 HB3 LEU 95 HB3 LEU 95 43.671 32.513 32.007 726 HG LEU 95 HG LEU 95 44.837 30.894 30.007 727 HD11 LEU 95 HD11 LEU 95 43.616 32.246 28.442 728 HD12 LEU 95 HD12 LEU 95 42.613 31.509 29.421 729 HD13 LEU 95 HD13 LEU 95 42.969 33.035 29.652 730 HD21 LEU 95 HD21 LEU 95 45.871 32.833 29.154 731 HD22 LEU 95 HD22 LEU 95 45.290 33.667 30.368 732 HD23 LEU 95 HD23 LEU 95 46.372 32.540 30.628 733 H THR 96 H THR 96 45.306 32.797 34.771 734 HA THR 96 HA THR 96 43.693 31.495 36.512 735 HB THR 96 HB THR 96 45.927 32.942 37.353 736 HG1 THR 96 HG1 THR 96 46.888 30.985 37.716 737 HG21 THR 96 HG21 THR 96 45.607 31.787 39.440 738 HG22 THR 96 HG22 THR 96 44.304 32.604 39.061 739 HG23 THR 96 HG23 THR 96 44.359 31.041 38.812 740 H PHE 97 H PHE 97 41.923 32.795 37.247 741 HA PHE 97 HA PHE 97 41.845 35.414 36.534 742 HB2 PHE 97 HB2 PHE 97 39.704 33.544 36.666 743 HB3 PHE 97 HB3 PHE 97 39.465 35.053 36.354 744 HD1 PHE 97 HD1 PHE 97 39.929 35.940 34.123 745 HD2 PHE 97 HD2 PHE 97 40.667 32.043 34.934 746 HE1 PHE 97 HE1 PHE 97 40.164 35.521 31.841 747 HE2 PHE 97 HE2 PHE 97 40.907 31.628 32.639 748 HZ PHE 97 HZ PHE 97 40.685 33.363 31.101 749 H PHE 98 H PHE 98 41.205 37.078 37.897 750 HA PHE 98 HA PHE 98 40.473 36.633 40.447 751 HB2 PHE 98 HB2 PHE 98 42.700 38.246 39.707 752 HB3 PHE 98 HB3 PHE 98 42.134 38.227 41.160 753 HD1 PHE 98 HD1 PHE 98 42.295 36.033 42.472 754 HD2 PHE 98 HD2 PHE 98 44.403 36.672 39.072 755 HE1 PHE 98 HE1 PHE 98 43.682 34.228 42.991 756 HE2 PHE 98 HE2 PHE 98 45.835 34.909 39.645 757 HZ PHE 98 HZ PHE 98 45.460 33.671 41.581 758 H TYR 99 H TYR 99 39.343 38.422 41.538 759 HA TYR 99 HA TYR 99 38.010 40.076 39.907 760 HB2 TYR 99 HB2 TYR 99 36.472 40.369 41.582 761 HB3 TYR 99 HB3 TYR 99 36.666 38.851 41.283 762 HD1 TYR 99 HD1 TYR 99 37.140 41.302 43.738 763 HD2 TYR 99 HD2 TYR 99 37.477 37.334 43.096 764 HE1 TYR 99 HE1 TYR 99 37.253 40.944 46.048 765 HE2 TYR 99 HE2 TYR 99 37.630 36.961 45.396 766 HH TYR 99 HH TYR 99 37.536 37.888 47.462 767 H ASP 100 H ASP 100 38.044 42.320 39.814 768 HA ASP 100 HA ASP 100 39.518 43.829 41.534 769 HB2 ASP 100 HB2 ASP 100 40.770 43.427 39.571 770 HB3 ASP 100 HB3 ASP 100 39.593 43.972 38.704 Start of MODEL 9 1 HA PRO 8 HA PRO 8 55.906 43.097 25.110 2 HB2 PRO 8 HB2 PRO 8 55.683 42.526 27.906 3 HB3 PRO 8 HB3 PRO 8 55.785 41.462 26.771 4 HG2 PRO 8 HG2 PRO 8 57.895 41.904 28.134 5 HG3 PRO 8 HG3 PRO 8 58.078 41.692 26.600 6 HD2 PRO 8 HD2 PRO 8 57.992 44.182 27.958 7 HD3 PRO 8 HD3 PRO 8 58.973 43.791 26.810 8 H GLN 9 H GLN 9 55.166 45.845 26.741 9 HA GLN 9 HA GLN 9 52.826 45.540 27.741 10 HB2 GLN 9 HB2 GLN 9 54.313 47.532 27.851 11 HB3 GLN 9 HB3 GLN 9 53.585 48.008 26.556 12 HG2 GLN 9 HG2 GLN 9 52.024 47.427 28.828 13 HG3 GLN 9 HG3 GLN 9 52.749 48.807 28.770 14 HE21 GLN 9 HE21 GLN 9 50.183 49.050 29.052 15 HE22 GLN 9 HE22 GLN 9 49.481 49.497 27.816 16 H ARG 10 H ARG 10 53.272 46.332 24.365 17 HA ARG 10 HA ARG 10 50.741 46.540 23.699 18 HB2 ARG 10 HB2 ARG 10 52.714 47.325 22.423 19 HB3 ARG 10 HB3 ARG 10 52.738 45.891 21.812 20 HG2 ARG 10 HG2 ARG 10 50.530 46.222 20.975 21 HG3 ARG 10 HG3 ARG 10 50.530 47.666 21.564 22 HD2 ARG 10 HD2 ARG 10 51.078 47.987 19.363 23 HD3 ARG 10 HD3 ARG 10 52.443 48.140 20.100 24 HE ARG 10 HE ARG 10 51.909 45.639 19.207 25 HH11 ARG 10 HH11 ARG 10 53.141 44.627 17.764 26 HH12 ARG 10 HH12 ARG 10 54.243 45.337 17.057 27 HH21 ARG 10 HH21 ARG 10 53.902 48.200 18.411 28 HH22 ARG 10 HH22 ARG 10 54.681 47.399 17.426 29 H VAL 11 H VAL 11 52.617 43.620 23.765 30 HA VAL 11 HA VAL 11 50.872 41.994 22.759 31 HB VAL 11 HB VAL 11 52.763 41.198 24.667 32 HG11 VAL 11 HG11 VAL 11 52.637 39.046 23.637 33 HG12 VAL 11 HG12 VAL 11 51.221 39.479 24.197 34 HG13 VAL 11 HG13 VAL 11 51.534 39.604 22.650 35 HG21 VAL 11 HG21 VAL 11 54.258 40.661 22.899 36 HG22 VAL 11 HG22 VAL 11 53.234 41.286 21.866 37 HG23 VAL 11 HG23 VAL 11 53.956 42.215 22.926 38 H ALA 12 H ALA 12 51.338 42.903 26.105 39 HA ALA 12 HA ALA 12 49.455 41.491 27.252 40 HB1 ALA 12 HB1 ALA 12 49.809 42.934 29.088 41 HB2 ALA 12 HB2 ALA 12 51.199 42.448 28.506 42 HB3 ALA 12 HB3 ALA 12 50.660 43.897 28.163 43 H GLN 13 H GLN 13 49.088 44.642 25.801 44 HA GLN 13 HA GLN 13 46.545 45.007 26.368 45 HB2 GLN 13 HB2 GLN 13 48.180 46.275 24.420 46 HB3 GLN 13 HB3 GLN 13 46.702 46.717 24.645 47 HG2 GLN 13 HG2 GLN 13 48.657 46.887 26.693 48 HG3 GLN 13 HG3 GLN 13 48.296 48.104 25.788 49 HE21 GLN 13 HE21 GLN 13 47.832 47.311 28.731 50 HE22 GLN 13 HE22 GLN 13 46.471 47.844 29.024 51 H GLU 14 H GLU 14 47.926 43.659 23.446 52 HA GLU 14 HA GLU 14 45.737 43.168 22.128 53 HB2 GLU 14 HB2 GLU 14 48.304 41.996 21.864 54 HB3 GLU 14 HB3 GLU 14 47.133 41.521 20.949 55 HG2 GLU 14 HG2 GLU 14 46.922 43.815 20.179 56 HG3 GLU 14 HG3 GLU 14 48.236 44.138 20.955 57 H MET 15 H MET 15 47.242 41.115 24.503 58 HA MET 15 HA MET 15 45.549 39.099 24.365 59 HB2 MET 15 HB2 MET 15 47.543 39.678 26.290 60 HB3 MET 15 HB3 MET 15 46.617 38.434 26.460 61 HG2 MET 15 HG2 MET 15 47.381 37.667 24.288 62 HG3 MET 15 HG3 MET 15 48.417 38.833 24.295 63 HE1 MET 15 HE1 MET 15 50.503 35.660 24.525 64 HE2 MET 15 HE2 MET 15 49.114 35.815 23.780 65 HE3 MET 15 HE3 MET 15 50.217 36.943 23.641 66 H GLN 16 H GLN 16 45.487 41.820 26.599 67 HA GLN 16 HA GLN 16 43.409 41.266 28.004 68 HB2 GLN 16 HB2 GLN 16 44.540 43.751 27.293 69 HB3 GLN 16 HB3 GLN 16 43.172 43.764 28.043 70 HG2 GLN 16 HG2 GLN 16 44.085 42.842 29.940 71 HG3 GLN 16 HG3 GLN 16 45.369 42.383 29.185 72 HE21 GLN 16 HE21 GLN 16 47.042 43.954 28.797 73 HE22 GLN 16 HE22 GLN 16 47.093 45.263 29.505 74 H LYS 17 H LYS 17 43.335 42.982 24.961 75 HA LYS 17 HA LYS 17 40.825 43.348 24.522 76 HB2 LYS 17 HB2 LYS 17 42.580 44.353 23.258 77 HB3 LYS 17 HB3 LYS 17 42.932 42.966 22.638 78 HG2 LYS 17 HG2 LYS 17 40.718 43.003 21.583 79 HG3 LYS 17 HG3 LYS 17 40.612 44.493 22.028 80 HD2 LYS 17 HD2 LYS 17 42.569 45.002 20.762 81 HD3 LYS 17 HD3 LYS 17 42.654 43.513 20.305 82 HE2 LYS 17 HE2 LYS 17 41.699 44.593 18.539 83 HE3 LYS 17 HE3 LYS 17 40.520 43.816 19.200 84 HZ1 LYS 17 HZ1 LYS 17 39.901 45.963 18.782 85 HZ2 LYS 17 HZ2 LYS 17 39.880 45.762 20.220 86 HZ3 LYS 17 HZ3 LYS 17 40.978 46.487 19.605 87 H GLU 18 H GLU 18 42.597 40.530 23.556 88 HA GLU 18 HA GLU 18 40.638 39.331 22.263 89 HB2 GLU 18 HB2 GLU 18 43.166 39.054 22.092 90 HB3 GLU 18 HB3 GLU 18 42.899 37.876 23.079 91 HG2 GLU 18 HG2 GLU 18 42.902 37.000 20.927 92 HG3 GLU 18 HG3 GLU 18 41.449 36.874 21.480 93 H ILE 19 H ILE 19 41.813 38.760 25.461 94 HA ILE 19 HA ILE 19 40.307 36.721 26.157 95 HB ILE 19 HB ILE 19 41.750 38.517 27.773 96 HG12 ILE 19 HG12 ILE 19 42.460 35.814 27.174 97 HG13 ILE 19 HG13 ILE 19 43.030 37.000 26.336 98 HG21 ILE 19 HG21 ILE 19 41.479 37.015 29.585 99 HG22 ILE 19 HG22 ILE 19 40.072 37.571 29.118 100 HG23 ILE 19 HG23 ILE 19 40.530 36.117 28.690 101 HD11 ILE 19 HD11 ILE 19 44.635 36.323 27.922 102 HD12 ILE 19 HD12 ILE 19 44.190 37.807 28.246 103 HD13 ILE 19 HD13 ILE 19 43.611 36.603 29.097 104 H ALA 20 H ALA 20 39.747 40.144 26.607 105 HA ALA 20 HA ALA 20 37.519 40.116 27.935 106 HB1 ALA 20 HB1 ALA 20 37.333 42.368 27.223 107 HB2 ALA 20 HB2 ALA 20 38.809 42.074 27.715 108 HB3 ALA 20 HB3 ALA 20 38.485 42.121 26.165 109 H LEU 21 H LEU 21 37.827 39.851 24.500 110 HA LEU 21 HA LEU 21 35.250 39.732 23.866 111 HB2 LEU 21 HB2 LEU 21 36.891 40.342 22.284 112 HB3 LEU 21 HB3 LEU 21 37.534 38.925 22.383 113 HG LEU 21 HG LEU 21 35.682 37.966 21.385 114 HD11 LEU 21 HD11 LEU 21 33.914 39.260 20.481 115 HD12 LEU 21 HD12 LEU 21 33.960 39.409 22.056 116 HD13 LEU 21 HD13 LEU 21 34.544 40.557 21.135 117 HD21 LEU 21 HD21 LEU 21 35.924 38.922 19.188 118 HD22 LEU 21 HD22 LEU 21 36.623 40.185 19.838 119 HD23 LEU 21 HD23 LEU 21 37.342 38.775 19.878 120 H ILE 22 H ILE 22 37.397 37.047 24.554 121 HA ILE 22 HA ILE 22 35.720 35.107 24.036 122 HB ILE 22 HB ILE 22 37.996 34.970 25.694 123 HG12 ILE 22 HG12 ILE 22 37.919 34.003 23.028 124 HG13 ILE 22 HG13 ILE 22 38.358 35.472 23.310 125 HG21 ILE 22 HG21 ILE 22 37.868 32.595 25.388 126 HG22 ILE 22 HG22 ILE 22 36.554 33.117 26.101 127 HG23 ILE 22 HG23 ILE 22 36.536 32.787 24.552 128 HD11 ILE 22 HD11 ILE 22 40.264 34.122 23.066 129 HD12 ILE 22 HD12 ILE 22 40.223 34.691 24.544 130 HD13 ILE 22 HD13 ILE 22 39.777 33.199 24.257 131 H LEU 23 H LEU 23 36.116 36.790 27.032 132 HA LEU 23 HA LEU 23 34.548 35.500 28.618 133 HB2 LEU 23 HB2 LEU 23 35.696 38.038 28.660 134 HB3 LEU 23 HB3 LEU 23 34.396 37.947 29.516 135 HG LEU 23 HG LEU 23 35.388 36.181 30.766 136 HD11 LEU 23 HD11 LEU 23 37.704 35.812 30.671 137 HD12 LEU 23 HD12 LEU 23 37.018 35.419 29.299 138 HD13 LEU 23 HD13 LEU 23 37.801 36.789 29.429 139 HD21 LEU 23 HD21 LEU 23 36.828 37.611 32.049 140 HD22 LEU 23 HD22 LEU 23 36.846 38.641 30.847 141 HD23 LEU 23 HD23 LEU 23 35.505 38.385 31.650 142 H GLN 24 H GLN 24 33.448 37.738 26.241 143 HA GLN 24 HA GLN 24 30.881 37.540 26.894 144 HB2 GLN 24 HB2 GLN 24 32.174 38.879 24.723 145 HB3 GLN 24 HB3 GLN 24 30.618 38.850 24.797 146 HG2 GLN 24 HG2 GLN 24 30.701 40.038 26.852 147 HG3 GLN 24 HG3 GLN 24 32.257 40.080 26.759 148 HE21 GLN 24 HE21 GLN 24 31.537 42.496 26.963 149 HE22 GLN 24 HE22 GLN 24 31.389 43.263 25.694 150 H ARG 25 H ARG 25 32.807 35.773 24.696 151 HA ARG 25 HA ARG 25 30.816 35.093 23.013 152 HB2 ARG 25 HB2 ARG 25 33.636 34.885 22.730 153 HB3 ARG 25 HB3 ARG 25 32.686 34.264 21.661 154 HG2 ARG 25 HG2 ARG 25 32.515 37.040 22.211 155 HG3 ARG 25 HG3 ARG 25 33.587 36.533 21.198 156 HD2 ARG 25 HD2 ARG 25 30.824 36.039 20.771 157 HD3 ARG 25 HD3 ARG 25 31.519 37.305 20.178 158 HE ARG 25 HE ARG 25 32.942 35.423 19.207 159 HH11 ARG 25 HH11 ARG 25 32.662 34.164 17.414 160 HH12 ARG 25 HH12 ARG 25 31.325 34.063 16.765 161 HH21 ARG 25 HH21 ARG 25 29.679 35.919 18.768 162 HH22 ARG 25 HH22 ARG 25 29.604 35.073 17.544 163 H GLU 26 H GLU 26 33.007 33.212 24.972 164 HA GLU 26 HA GLU 26 31.956 30.869 24.145 165 HB2 GLU 26 HB2 GLU 26 34.320 31.138 24.327 166 HB3 GLU 26 HB3 GLU 26 34.165 31.330 25.867 167 HG2 GLU 26 HG2 GLU 26 34.931 29.205 25.554 168 HG3 GLU 26 HG3 GLU 26 33.462 29.074 26.061 169 H ILE 27 H ILE 27 31.524 32.745 26.868 170 HA ILE 27 HA ILE 27 29.866 31.006 28.128 171 HB ILE 27 HB ILE 27 30.585 31.733 30.190 172 HG12 ILE 27 HG12 ILE 27 32.547 33.281 28.900 173 HG13 ILE 27 HG13 ILE 27 31.372 33.847 29.755 174 HG21 ILE 27 HG21 ILE 27 32.662 30.564 30.240 175 HG22 ILE 27 HG22 ILE 27 31.599 29.770 29.375 176 HG23 ILE 27 HG23 ILE 27 32.721 30.629 28.659 177 HD11 ILE 27 HD11 ILE 27 33.358 33.943 30.999 178 HD12 ILE 27 HD12 ILE 27 32.350 32.951 31.714 179 HD13 ILE 27 HD13 ILE 27 33.543 32.377 30.846 180 H LYS 28 H LYS 28 27.924 32.024 29.193 181 HA LYS 28 HA LYS 28 27.015 34.159 27.889 182 HB2 LYS 28 HB2 LYS 28 25.787 32.454 29.789 183 HB3 LYS 28 HB3 LYS 28 25.038 33.740 29.324 184 HG2 LYS 28 HG2 LYS 28 25.747 31.674 27.516 185 HG3 LYS 28 HG3 LYS 28 24.335 31.753 28.175 186 HD2 LYS 28 HD2 LYS 28 24.423 34.086 27.064 187 HD3 LYS 28 HD3 LYS 28 25.301 33.282 26.055 188 HE2 LYS 28 HE2 LYS 28 22.646 32.515 26.718 189 HE3 LYS 28 HE3 LYS 28 22.984 33.332 25.432 190 HZ1 LYS 28 HZ1 LYS 28 22.760 31.140 24.927 191 HZ2 LYS 28 HZ2 LYS 28 24.134 31.527 24.652 192 HZ3 LYS 28 HZ3 LYS 28 23.819 30.766 25.850 193 H ASP 29 H ASP 29 28.104 36.078 28.511 194 HA ASP 29 HA ASP 29 28.075 36.991 30.984 195 HB2 ASP 29 HB2 ASP 29 29.694 37.604 29.171 196 HB3 ASP 29 HB3 ASP 29 28.637 38.680 28.777 197 HA PRO 30 HA PRO 30 24.286 39.461 29.688 198 HB2 PRO 30 HB2 PRO 30 22.771 37.256 28.706 199 HB3 PRO 30 HB3 PRO 30 22.610 38.745 28.271 200 HG2 PRO 30 HG2 PRO 30 23.910 37.236 26.684 201 HG3 PRO 30 HG3 PRO 30 24.486 38.668 26.906 202 HD2 PRO 30 HD2 PRO 30 25.373 36.282 28.161 203 HD3 PRO 30 HD3 PRO 30 26.278 37.428 27.615 204 H ARG 31 H ARG 31 24.261 36.369 31.167 205 HA ARG 31 HA ARG 31 22.466 36.708 33.028 206 HB2 ARG 31 HB2 ARG 31 23.671 34.630 32.374 207 HB3 ARG 31 HB3 ARG 31 24.780 35.094 33.367 208 HG2 ARG 31 HG2 ARG 31 23.105 35.055 35.131 209 HG3 ARG 31 HG3 ARG 31 22.122 34.402 34.113 210 HD2 ARG 31 HD2 ARG 31 23.028 32.664 35.345 211 HD3 ARG 31 HD3 ARG 31 23.622 32.538 33.909 212 HE ARG 31 HE ARG 31 25.615 32.893 34.751 213 HH11 ARG 31 HH11 ARG 31 27.184 33.570 36.201 214 HH12 ARG 31 HH12 ARG 31 26.785 34.039 37.558 215 HH21 ARG 31 HH21 ARG 31 23.605 33.835 37.203 216 HH22 ARG 31 HH22 ARG 31 24.705 34.193 38.141 217 H LEU 32 H LEU 32 25.565 38.016 32.953 218 HA LEU 32 HA LEU 32 25.598 39.050 35.450 219 HB2 LEU 32 HB2 LEU 32 27.755 38.638 33.628 220 HB3 LEU 32 HB3 LEU 32 27.955 39.291 35.030 221 HG LEU 32 HG LEU 32 27.108 36.625 34.730 222 HD11 LEU 32 HD11 LEU 32 29.356 36.002 35.267 223 HD12 LEU 32 HD12 LEU 32 29.336 36.850 33.929 224 HD13 LEU 32 HD13 LEU 32 29.758 37.534 35.294 225 HD21 LEU 32 HD21 LEU 32 27.677 36.341 37.002 226 HD22 LEU 32 HD22 LEU 32 28.073 37.871 37.088 227 HD23 LEU 32 HD23 LEU 32 26.564 37.457 36.850 228 H GLY 33 H GLY 33 24.323 40.264 32.861 229 HA2 GLY 33 HA2 GLY 33 23.619 42.279 32.503 230 HA3 GLY 33 HA3 GLY 33 24.754 42.846 33.411 231 H MET 34 H MET 34 25.987 40.860 31.000 232 HA MET 34 HA MET 34 27.377 41.126 29.395 233 HB2 MET 34 HB2 MET 34 25.177 41.534 28.413 234 HB3 MET 34 HB3 MET 34 25.604 43.033 28.353 235 HG2 MET 34 HG2 MET 34 26.037 42.132 26.281 236 HG3 MET 34 HG3 MET 34 27.417 42.447 26.935 237 HE1 MET 34 HE1 MET 34 28.039 39.403 24.721 238 HE2 MET 34 HE2 MET 34 26.988 40.557 24.450 239 HE3 MET 34 HE3 MET 34 28.445 40.917 24.957 240 H MET 35 H MET 35 28.366 42.421 31.553 241 HA MET 35 HA MET 35 29.918 44.456 30.766 242 HB2 MET 35 HB2 MET 35 27.774 45.412 31.448 243 HB3 MET 35 HB3 MET 35 28.132 44.971 32.900 244 HG2 MET 35 HG2 MET 35 28.613 47.248 32.541 245 HG3 MET 35 HG3 MET 35 29.874 46.460 33.013 246 HE1 MET 35 HE1 MET 35 29.272 47.812 28.809 247 HE2 MET 35 HE2 MET 35 28.468 46.604 29.444 248 HE3 MET 35 HE3 MET 35 28.227 48.078 29.969 249 H THR 36 H THR 36 30.422 41.725 31.788 250 HA THR 36 HA THR 36 32.203 42.196 33.745 251 HB THR 36 HB THR 36 32.018 39.788 32.342 252 HG1 THR 36 HG1 THR 36 30.261 39.387 33.265 253 HG21 THR 36 HG21 THR 36 32.857 38.800 34.332 254 HG22 THR 36 HG22 THR 36 33.859 39.901 33.792 255 HG23 THR 36 HG23 THR 36 32.898 40.232 35.007 256 H THR 37 H THR 37 34.482 42.594 33.363 257 HA THR 37 HA THR 37 35.351 42.851 30.816 258 HB THR 37 HB THR 37 35.414 45.017 32.597 259 HG1 THR 37 HG1 THR 37 33.746 45.874 31.351 260 HG21 THR 37 HG21 THR 37 35.865 46.412 30.733 261 HG22 THR 37 HG22 THR 37 36.986 45.307 30.897 262 HG23 THR 37 HG23 THR 37 35.858 45.133 29.799 263 H VAL 38 H VAL 38 37.765 42.908 30.587 264 HA VAL 38 HA VAL 38 39.191 42.034 32.707 265 HB VAL 38 HB VAL 38 40.053 42.325 30.066 266 HG11 VAL 38 HG11 VAL 38 41.986 41.061 30.659 267 HG12 VAL 38 HG12 VAL 38 41.936 42.418 31.473 268 HG13 VAL 38 HG13 VAL 38 41.504 41.062 32.168 269 HG21 VAL 38 HG21 VAL 38 39.975 39.939 29.944 270 HG22 VAL 38 HG22 VAL 38 39.398 39.902 31.418 271 HG23 VAL 38 HG23 VAL 38 38.536 40.527 30.247 272 H SER 39 H SER 39 40.230 43.547 34.091 273 HA SER 39 HA SER 39 40.635 46.079 33.358 274 HB2 SER 39 HB2 SER 39 41.108 46.467 35.659 275 HB3 SER 39 HB3 SER 39 39.680 45.879 35.441 276 HG SER 39 HG SER 39 40.957 44.870 37.024 277 H GLY 40 H GLY 40 42.764 43.458 34.027 278 HA2 GLY 40 HA2 GLY 40 44.891 44.496 32.870 279 HA3 GLY 40 HA3 GLY 40 45.048 44.550 34.420 280 H VAL 41 H VAL 41 46.882 43.051 33.047 281 HA VAL 41 HA VAL 41 46.495 40.531 33.857 282 HB VAL 41 HB VAL 41 47.675 39.688 31.984 283 HG11 VAL 41 HG11 VAL 41 45.852 39.816 30.447 284 HG12 VAL 41 HG12 VAL 41 45.325 39.550 31.916 285 HG13 VAL 41 HG13 VAL 41 45.243 41.005 31.297 286 HG21 VAL 41 HG21 VAL 41 47.950 40.985 30.044 287 HG22 VAL 41 HG22 VAL 41 47.459 42.261 30.842 288 HG23 VAL 41 HG23 VAL 41 48.820 41.554 31.239 289 H GLU 42 H GLU 42 48.493 39.235 34.406 290 HA GLU 42 HA GLU 42 50.914 40.407 34.037 291 HB2 GLU 42 HB2 GLU 42 50.553 40.580 36.352 292 HB3 GLU 42 HB3 GLU 42 50.232 39.057 36.445 293 HG2 GLU 42 HG2 GLU 42 52.420 38.468 36.064 294 HG3 GLU 42 HG3 GLU 42 52.787 39.894 35.548 295 H MET 43 H MET 43 52.382 39.074 32.913 296 HA MET 43 HA MET 43 51.740 36.534 32.273 297 HB2 MET 43 HB2 MET 43 53.476 38.244 30.807 298 HB3 MET 43 HB3 MET 43 52.996 36.844 30.317 299 HG2 MET 43 HG2 MET 43 50.740 37.726 30.290 300 HG3 MET 43 HG3 MET 43 51.349 39.136 30.563 301 HE1 MET 43 HE1 MET 43 53.296 39.907 27.361 302 HE2 MET 43 HE2 MET 43 52.913 40.485 28.785 303 HE3 MET 43 HE3 MET 43 53.879 39.235 28.672 304 H SER 44 H SER 44 53.296 34.764 32.505 305 HA SER 44 HA SER 44 55.211 34.987 34.311 306 HB2 SER 44 HB2 SER 44 53.961 32.963 34.029 307 HB3 SER 44 HB3 SER 44 54.647 32.746 32.645 308 HG SER 44 HG SER 44 56.159 31.860 33.648 309 H ARG 45 H ARG 45 57.535 34.714 34.080 310 HA ARG 45 HA ARG 45 58.872 35.845 32.134 311 HB2 ARG 45 HB2 ARG 45 59.587 35.606 34.428 312 HB3 ARG 45 HB3 ARG 45 59.828 34.088 34.164 313 HG2 ARG 45 HG2 ARG 45 61.605 34.610 32.698 314 HG3 ARG 45 HG3 ARG 45 61.350 36.133 32.916 315 HD2 ARG 45 HD2 ARG 45 61.903 35.898 35.224 316 HD3 ARG 45 HD3 ARG 45 62.151 34.373 35.011 317 HE ARG 45 HE ARG 45 64.119 34.836 34.104 318 HH11 ARG 45 HH11 ARG 45 65.849 36.158 33.470 319 HH12 ARG 45 HH12 ARG 45 65.722 37.638 33.580 320 HH21 ARG 45 HH21 ARG 45 62.749 37.813 34.659 321 HH22 ARG 45 HH22 ARG 45 63.958 38.583 34.258 322 H ASP 46 H ASP 46 58.195 32.524 32.419 323 HA ASP 46 HA ASP 46 59.455 31.787 30.182 324 HB2 ASP 46 HB2 ASP 46 59.020 29.576 30.921 325 HB3 ASP 46 HB3 ASP 46 59.706 30.378 32.070 326 H LEU 47 H LEU 47 56.551 33.027 30.470 327 HA LEU 47 HA LEU 47 54.589 32.905 29.765 328 HB2 LEU 47 HB2 LEU 47 55.885 32.192 27.359 329 HB3 LEU 47 HB3 LEU 47 54.398 32.659 27.411 330 HG LEU 47 HG LEU 47 56.562 34.334 28.129 331 HD11 LEU 47 HD11 LEU 47 56.149 35.468 26.065 332 HD12 LEU 47 HD12 LEU 47 56.524 33.954 25.787 333 HD13 LEU 47 HD13 LEU 47 55.010 34.416 25.735 334 HD21 LEU 47 HD21 LEU 47 55.038 36.133 28.113 335 HD22 LEU 47 HD22 LEU 47 53.860 35.123 27.799 336 HD23 LEU 47 HD23 LEU 47 54.608 35.058 29.193 337 H ALA 48 H ALA 48 55.309 30.356 31.090 338 HA ALA 48 HA ALA 48 53.690 28.505 30.052 339 HB1 ALA 48 HB1 ALA 48 54.256 27.292 32.007 340 HB2 ALA 48 HB2 ALA 48 55.569 27.847 31.315 341 HB3 ALA 48 HB3 ALA 48 54.975 28.578 32.588 342 H TYR 49 H TYR 49 53.112 30.971 32.328 343 HA TYR 49 HA TYR 49 50.479 30.443 32.579 344 HB2 TYR 49 HB2 TYR 49 52.304 30.662 34.722 345 HB3 TYR 49 HB3 TYR 49 50.837 31.129 34.973 346 HD1 TYR 49 HD1 TYR 49 49.043 29.515 35.225 347 HD2 TYR 49 HD2 TYR 49 52.822 28.238 34.505 348 HE1 TYR 49 HE1 TYR 49 48.413 27.348 35.789 349 HE2 TYR 49 HE2 TYR 49 52.158 26.041 34.940 350 HH TYR 49 HH TYR 49 50.460 24.661 35.567 351 H ALA 50 H ALA 50 49.083 32.243 33.133 352 HA ALA 50 HA ALA 50 50.012 34.751 33.348 353 HB1 ALA 50 HB1 ALA 50 48.439 35.540 31.768 354 HB2 ALA 50 HB2 ALA 50 49.462 34.552 31.070 355 HB3 ALA 50 HB3 ALA 50 48.011 34.047 31.458 356 H LYS 51 H LYS 51 48.792 36.151 34.695 357 HA LYS 51 HA LYS 51 46.564 35.300 36.001 358 HB2 LYS 51 HB2 LYS 51 48.356 37.322 36.846 359 HB3 LYS 51 HB3 LYS 51 47.091 36.893 37.650 360 HG2 LYS 51 HG2 LYS 51 48.090 34.688 37.864 361 HG3 LYS 51 HG3 LYS 51 49.397 35.288 37.259 362 HD2 LYS 51 HD2 LYS 51 48.294 36.197 39.717 363 HD3 LYS 51 HD3 LYS 51 49.457 35.159 39.653 364 HE2 LYS 51 HE2 LYS 51 49.849 37.720 38.535 365 HE3 LYS 51 HE3 LYS 51 50.050 37.526 40.068 366 HZ1 LYS 51 HZ1 LYS 51 52.004 37.336 38.805 367 HZ2 LYS 51 HZ2 LYS 51 51.799 36.208 39.697 368 HZ3 LYS 51 HZ3 LYS 51 51.515 36.074 38.278 369 H VAL 52 H VAL 52 44.582 36.364 35.640 370 HA VAL 52 HA VAL 52 44.446 38.644 34.183 371 HB VAL 52 HB VAL 52 42.508 36.626 34.127 372 HG11 VAL 52 HG11 VAL 52 41.581 37.776 32.247 373 HG12 VAL 52 HG12 VAL 52 41.575 38.703 33.531 374 HG13 VAL 52 HG13 VAL 52 42.685 38.899 32.418 375 HG21 VAL 52 HG21 VAL 52 43.230 36.067 31.910 376 HG22 VAL 52 HG22 VAL 52 44.418 37.103 32.057 377 HG23 VAL 52 HG23 VAL 52 44.387 35.802 32.958 378 H TYR 53 H TYR 53 43.351 40.390 35.140 379 HA TYR 53 HA TYR 53 41.844 40.112 37.383 380 HB2 TYR 53 HB2 TYR 53 43.165 42.435 36.445 381 HB3 TYR 53 HB3 TYR 53 42.326 42.386 37.758 382 HD1 TYR 53 HD1 TYR 53 43.111 40.853 39.630 383 HD2 TYR 53 HD2 TYR 53 45.513 41.809 36.510 384 HE1 TYR 53 HE1 TYR 53 44.946 39.965 40.760 385 HE2 TYR 53 HE2 TYR 53 47.349 40.921 37.641 386 HH TYR 53 HH TYR 53 48.073 39.889 39.532 387 H VAL 54 H VAL 54 39.638 40.556 37.354 388 HA VAL 54 HA VAL 54 38.446 41.427 35.081 389 HB VAL 54 HB VAL 54 37.586 39.179 36.525 390 HG11 VAL 54 HG11 VAL 54 36.079 38.733 34.737 391 HG12 VAL 54 HG12 VAL 54 35.767 40.138 35.397 392 HG13 VAL 54 HG13 VAL 54 36.556 40.065 34.026 393 HG21 VAL 54 HG21 VAL 54 38.292 37.826 34.652 394 HG22 VAL 54 HG22 VAL 54 38.871 39.128 33.960 395 HG23 VAL 54 HG23 VAL 54 39.531 38.576 35.289 396 H THR 55 H THR 55 36.538 42.710 35.414 397 HA THR 55 HA THR 55 35.703 43.316 37.929 398 HB THR 55 HB THR 55 37.106 44.969 37.136 399 HG1 THR 55 HG1 THR 55 35.671 45.776 38.459 400 HG21 THR 55 HG21 THR 55 36.504 46.456 35.452 401 HG22 THR 55 HG22 THR 55 36.766 45.002 34.880 402 HG23 THR 55 HG23 THR 55 35.282 45.519 35.079 403 H PHE 56 H PHE 56 33.516 43.506 38.319 404 HA PHE 56 HA PHE 56 31.795 42.606 36.414 405 HB2 PHE 56 HB2 PHE 56 31.936 41.942 39.167 406 HB3 PHE 56 HB3 PHE 56 30.665 41.598 38.333 407 HD1 PHE 56 HD1 PHE 56 34.188 40.822 38.206 408 HD2 PHE 56 HD2 PHE 56 30.465 39.403 37.530 409 HE1 PHE 56 HE1 PHE 56 35.080 38.721 37.727 410 HE2 PHE 56 HE2 PHE 56 31.356 37.281 37.113 411 HZ PHE 56 HZ PHE 56 33.663 36.943 37.209 412 H LEU 57 H LEU 57 29.814 43.736 36.060 413 HA LEU 57 HA LEU 57 28.864 45.683 37.610 414 HB2 LEU 57 HB2 LEU 57 28.377 45.577 35.296 415 HB3 LEU 57 HB3 LEU 57 27.599 44.244 35.519 416 HG LEU 57 HG LEU 57 25.976 45.390 36.764 417 HD11 LEU 57 HD11 LEU 57 25.914 47.733 36.839 418 HD12 LEU 57 HD12 LEU 57 27.196 47.185 37.590 419 HD13 LEU 57 HD13 LEU 57 27.330 47.787 36.131 420 HD21 LEU 57 HD21 LEU 57 24.981 46.555 34.925 421 HD22 LEU 57 HD22 LEU 57 26.376 46.531 34.176 422 HD23 LEU 57 HD23 LEU 57 25.591 45.179 34.432 423 H ASN 58 H ASN 58 28.485 42.305 37.756 424 HA ASN 58 HA ASN 58 26.420 42.171 39.457 425 HB2 ASN 58 HB2 ASN 58 27.263 40.521 37.651 426 HB3 ASN 58 HB3 ASN 58 27.838 39.850 38.936 427 HD21 ASN 58 HD21 ASN 58 23.937 39.998 38.505 428 HD22 ASN 58 HD22 ASN 58 24.763 41.171 38.100 429 H ASP 59 H ASP 59 29.237 43.235 40.221 430 HA ASP 59 HA ASP 59 30.005 42.322 42.526 431 HB2 ASP 59 HB2 ASP 59 31.293 43.830 41.213 432 HB3 ASP 59 HB3 ASP 59 30.217 44.941 41.405 433 H LYS 60 H LYS 60 27.082 43.750 42.043 434 HA LYS 60 HA LYS 60 26.457 44.782 44.391 435 HB2 LYS 60 HB2 LYS 60 25.304 45.071 42.238 436 HB3 LYS 60 HB3 LYS 60 24.694 43.653 42.455 437 HG2 LYS 60 HG2 LYS 60 23.495 44.447 44.341 438 HG3 LYS 60 HG3 LYS 60 24.117 45.864 44.146 439 HD2 LYS 60 HD2 LYS 60 23.043 45.986 41.986 440 HD3 LYS 60 HD3 LYS 60 22.347 44.624 42.288 441 HE2 LYS 60 HE2 LYS 60 21.303 45.691 44.217 442 HE3 LYS 60 HE3 LYS 60 21.854 47.049 43.687 443 HZ1 LYS 60 HZ1 LYS 60 19.723 46.728 42.942 444 HZ2 LYS 60 HZ2 LYS 60 20.604 46.754 41.787 445 HZ3 LYS 60 HZ3 LYS 60 20.091 45.487 42.281 446 H ASP 61 H ASP 61 26.836 41.492 43.720 447 HA ASP 61 HA ASP 61 26.312 40.871 46.290 448 HB2 ASP 61 HB2 ASP 61 24.454 40.168 44.902 449 HB3 ASP 61 HB3 ASP 61 25.428 39.166 44.211 450 H GLU 62 H GLU 62 28.231 40.173 47.230 451 HA GLU 62 HA GLU 62 30.339 39.497 45.957 452 HB2 GLU 62 HB2 GLU 62 29.930 38.706 48.659 453 HB3 GLU 62 HB3 GLU 62 31.312 39.036 48.017 454 HG2 GLU 62 HG2 GLU 62 31.065 40.880 49.202 455 HG3 GLU 62 HG3 GLU 62 30.368 41.371 47.897 456 H ASP 63 H ASP 63 27.887 37.364 47.041 457 HA ASP 63 HA ASP 63 29.089 35.014 46.806 458 HB2 ASP 63 HB2 ASP 63 27.081 35.561 48.144 459 HB3 ASP 63 HB3 ASP 63 26.277 35.456 46.812 460 H ALA 64 H ALA 64 27.315 36.827 44.499 461 HA ALA 64 HA ALA 64 27.258 35.095 42.525 462 HB1 ALA 64 HB1 ALA 64 26.509 36.937 41.242 463 HB2 ALA 64 HB2 ALA 64 25.686 36.837 42.591 464 HB3 ALA 64 HB3 ALA 64 26.847 37.904 42.449 465 H VAL 65 H VAL 65 29.539 37.622 43.194 466 HA VAL 65 HA VAL 65 31.161 37.395 41.180 467 HB VAL 65 HB VAL 65 31.762 38.343 43.746 468 HG11 VAL 65 HG11 VAL 65 33.677 39.423 42.842 469 HG12 VAL 65 HG12 VAL 65 33.804 37.851 42.700 470 HG13 VAL 65 HG13 VAL 65 33.392 38.727 41.448 471 HG21 VAL 65 HG21 VAL 65 31.545 40.534 42.768 472 HG22 VAL 65 HG22 VAL 65 31.170 39.857 41.387 473 HG23 VAL 65 HG23 VAL 65 30.188 39.731 42.622 474 H LYS 66 H LYS 66 31.379 35.710 44.240 475 HA LYS 66 HA LYS 66 33.532 34.288 43.898 476 HB2 LYS 66 HB2 LYS 66 32.318 34.627 45.985 477 HB3 LYS 66 HB3 LYS 66 31.323 33.523 45.510 478 HG2 LYS 66 HG2 LYS 66 33.265 32.018 45.376 479 HG3 LYS 66 HG3 LYS 66 34.056 33.110 46.161 480 HD2 LYS 66 HD2 LYS 66 32.360 32.940 47.911 481 HD3 LYS 66 HD3 LYS 66 31.802 31.691 47.163 482 HE2 LYS 66 HE2 LYS 66 34.034 30.704 47.394 483 HE3 LYS 66 HE3 LYS 66 34.369 31.874 48.370 484 HZ1 LYS 66 HZ1 LYS 66 33.690 30.051 49.543 485 HZ2 LYS 66 HZ2 LYS 66 32.723 31.112 49.763 486 HZ3 LYS 66 HZ3 LYS 66 32.410 30.022 48.854 487 H ALA 67 H ALA 67 30.314 33.250 43.091 488 HA ALA 67 HA ALA 67 30.922 30.930 42.003 489 HB1 ALA 67 HB1 ALA 67 28.662 30.983 41.279 490 HB2 ALA 67 HB2 ALA 67 28.747 31.386 42.808 491 HB3 ALA 67 HB3 ALA 67 28.569 32.506 41.703 492 H GLY 68 H GLY 68 30.650 34.018 40.467 493 HA2 GLY 68 HA2 GLY 68 30.810 33.388 37.947 494 HA3 GLY 68 HA3 GLY 68 31.140 34.792 38.541 495 H ILE 69 H ILE 69 33.460 34.322 40.033 496 HA ILE 69 HA ILE 69 35.482 34.012 38.416 497 HB ILE 69 HB ILE 69 35.387 34.112 41.202 498 HG12 ILE 69 HG12 ILE 69 35.005 36.185 40.145 499 HG13 ILE 69 HG13 ILE 69 36.268 36.258 41.059 500 HG21 ILE 69 HG21 ILE 69 37.749 34.272 41.323 501 HG22 ILE 69 HG22 ILE 69 37.299 32.856 40.776 502 HG23 ILE 69 HG23 ILE 69 37.832 33.960 39.773 503 HD11 ILE 69 HD11 ILE 69 36.697 37.381 39.044 504 HD12 ILE 69 HD12 ILE 69 37.669 36.136 39.152 505 HD13 ILE 69 HD13 ILE 69 36.388 36.060 38.225 506 H LYS 70 H LYS 70 34.128 31.633 40.622 507 HA LYS 70 HA LYS 70 35.746 29.632 40.145 508 HB2 LYS 70 HB2 LYS 70 34.180 29.749 41.989 509 HB3 LYS 70 HB3 LYS 70 33.053 29.351 40.987 510 HG2 LYS 70 HG2 LYS 70 34.128 27.286 40.562 511 HG3 LYS 70 HG3 LYS 70 35.305 27.687 41.504 512 HD2 LYS 70 HD2 LYS 70 32.658 27.215 42.418 513 HD3 LYS 70 HD3 LYS 70 33.816 26.184 42.576 514 HE2 LYS 70 HE2 LYS 70 33.762 28.676 43.924 515 HE3 LYS 70 HE3 LYS 70 33.383 27.325 44.604 516 HZ1 LYS 70 HZ1 LYS 70 35.508 27.888 45.119 517 HZ2 LYS 70 HZ2 LYS 70 35.542 26.653 44.352 518 HZ3 LYS 70 HZ3 LYS 70 35.895 27.912 43.718 519 H ALA 71 H ALA 71 32.828 30.374 38.407 520 HA ALA 71 HA ALA 71 32.877 28.426 36.653 521 HB1 ALA 71 HB1 ALA 71 31.286 29.755 35.492 522 HB2 ALA 71 HB2 ALA 71 30.914 29.695 37.030 523 HB3 ALA 71 HB3 ALA 71 31.626 30.980 36.436 524 H LEU 72 H LEU 72 34.435 31.516 36.432 525 HA LEU 72 HA LEU 72 35.352 31.362 33.953 526 HB2 LEU 72 HB2 LEU 72 34.951 33.407 35.199 527 HB3 LEU 72 HB3 LEU 72 36.240 33.095 36.021 528 HG LEU 72 HG LEU 72 37.518 33.263 34.045 529 HD11 LEU 72 HD11 LEU 72 36.554 34.216 32.103 530 HD12 LEU 72 HD12 LEU 72 35.861 32.830 32.430 531 HD13 LEU 72 HD13 LEU 72 35.134 34.187 32.802 532 HD21 LEU 72 HD21 LEU 72 37.370 35.657 33.875 533 HD22 LEU 72 HD22 LEU 72 35.965 35.607 34.604 534 HD23 LEU 72 HD23 LEU 72 37.282 35.223 35.395 535 H GLN 73 H GLN 73 36.927 30.433 36.891 536 HA GLN 73 HA GLN 73 39.225 29.657 35.850 537 HB2 GLN 73 HB2 GLN 73 38.815 30.205 38.196 538 HB3 GLN 73 HB3 GLN 73 38.169 28.792 38.335 539 HG2 GLN 73 HG2 GLN 73 40.388 28.663 39.073 540 HG3 GLN 73 HG3 GLN 73 40.244 27.774 37.800 541 HE21 GLN 73 HE21 GLN 73 42.009 28.012 36.438 542 HE22 GLN 73 HE22 GLN 73 42.754 29.277 36.186 543 H GLU 74 H GLU 74 36.325 27.808 36.286 544 HA GLU 74 HA GLU 74 37.189 25.536 35.267 545 HB2 GLU 74 HB2 GLU 74 34.536 26.466 35.686 546 HB3 GLU 74 HB3 GLU 74 34.804 25.044 35.105 547 HG2 GLU 74 HG2 GLU 74 36.106 24.605 37.133 548 HG3 GLU 74 HG3 GLU 74 35.496 25.920 37.709 549 H ALA 75 H ALA 75 36.019 28.292 33.601 550 HA ALA 75 HA ALA 75 35.871 27.202 31.195 551 HB1 ALA 75 HB1 ALA 75 35.457 29.466 30.505 552 HB2 ALA 75 HB2 ALA 75 34.521 29.087 31.725 553 HB3 ALA 75 HB3 ALA 75 35.821 29.959 31.964 554 H SER 76 H SER 76 38.627 27.857 32.785 555 HA SER 76 HA SER 76 40.056 29.361 31.311 556 HB2 SER 76 HB2 SER 76 41.933 28.507 32.554 557 HB3 SER 76 HB3 SER 76 40.756 28.878 33.508 558 HG SER 76 HG SER 76 40.455 26.878 33.925 559 H GLY 77 H GLY 77 39.874 25.936 30.814 560 HA2 GLY 77 HA2 GLY 77 41.772 25.614 29.043 561 HA3 GLY 77 HA3 GLY 77 40.623 24.600 29.337 562 H PHE 78 H PHE 78 38.381 26.220 28.492 563 HA PHE 78 HA PHE 78 38.382 26.144 25.859 564 HB2 PHE 78 HB2 PHE 78 36.476 27.447 27.504 565 HB3 PHE 78 HB3 PHE 78 36.245 27.092 26.003 566 HD1 PHE 78 HD1 PHE 78 35.749 25.922 29.189 567 HD2 PHE 78 HD2 PHE 78 36.102 24.580 25.379 568 HE1 PHE 78 HE1 PHE 78 34.752 23.900 29.804 569 HE2 PHE 78 HE2 PHE 78 35.093 22.572 26.007 570 HZ PHE 78 HZ PHE 78 34.423 22.225 28.212 571 H ILE 79 H ILE 79 38.751 28.849 28.031 572 HA ILE 79 HA ILE 79 38.931 30.807 26.322 573 HB ILE 79 HB ILE 79 39.895 30.757 28.970 574 HG12 ILE 79 HG12 ILE 79 37.477 31.983 28.126 575 HG13 ILE 79 HG13 ILE 79 37.486 30.522 28.670 576 HG21 ILE 79 HG21 ILE 79 39.959 33.134 28.866 577 HG22 ILE 79 HG22 ILE 79 40.951 32.515 27.798 578 HG23 ILE 79 HG23 ILE 79 39.540 33.071 27.340 579 HD11 ILE 79 HD11 ILE 79 36.842 31.991 30.391 580 HD12 ILE 79 HD12 ILE 79 38.211 31.303 30.790 581 HD13 ILE 79 HD13 ILE 79 38.203 32.787 30.236 582 H ARG 80 H ARG 80 41.541 28.928 27.662 583 HA ARG 80 HA ARG 80 43.623 29.966 26.470 584 HB2 ARG 80 HB2 ARG 80 43.896 28.614 28.337 585 HB3 ARG 80 HB3 ARG 80 43.221 27.406 27.618 586 HG2 ARG 80 HG2 ARG 80 45.041 27.041 26.290 587 HG3 ARG 80 HG3 ARG 80 45.638 28.449 26.597 588 HD2 ARG 80 HD2 ARG 80 46.806 26.678 27.695 589 HD3 ARG 80 HD3 ARG 80 46.352 27.808 28.669 590 HE ARG 80 HE ARG 80 45.121 26.345 29.731 591 HH11 ARG 80 HH11 ARG 80 44.380 24.354 30.310 592 HH12 ARG 80 HH12 ARG 80 44.292 23.264 29.300 593 HH21 ARG 80 HH21 ARG 80 45.542 24.821 26.808 594 HH22 ARG 80 HH22 ARG 80 44.961 23.533 27.280 595 H SER 81 H SER 81 41.735 27.305 25.298 596 HA SER 81 HA SER 81 42.942 26.728 23.096 597 HB2 SER 81 HB2 SER 81 41.279 25.306 23.844 598 HB3 SER 81 HB3 SER 81 40.214 26.446 23.821 599 HG SER 81 HG SER 81 40.018 25.158 22.078 600 H LEU 82 H LEU 82 40.331 28.997 23.389 601 HA LEU 82 HA LEU 82 40.230 29.830 20.891 602 HB2 LEU 82 HB2 LEU 82 39.015 30.818 23.266 603 HB3 LEU 82 HB3 LEU 82 38.724 31.485 21.887 604 HG LEU 82 HG LEU 82 38.097 28.780 22.413 605 HD11 LEU 82 HD11 LEU 82 35.821 29.519 22.631 606 HD12 LEU 82 HD12 LEU 82 36.722 30.220 23.729 607 HD13 LEU 82 HD13 LEU 82 36.305 31.013 22.422 608 HD21 LEU 82 HD21 LEU 82 36.747 28.836 20.494 609 HD22 LEU 82 HD22 LEU 82 37.197 30.331 20.227 610 HD23 LEU 82 HD23 LEU 82 38.253 29.155 20.120 611 H LEU 83 H LEU 83 41.924 31.209 23.547 612 HA LEU 83 HA LEU 83 42.770 33.469 22.469 613 HB2 LEU 83 HB2 LEU 83 42.742 33.091 24.798 614 HB3 LEU 83 HB3 LEU 83 43.826 31.982 24.639 615 HG LEU 83 HG LEU 83 45.383 33.615 23.943 616 HD11 LEU 83 HD11 LEU 83 44.906 35.907 24.189 617 HD12 LEU 83 HD12 LEU 83 43.957 35.259 23.099 618 HD13 LEU 83 HD13 LEU 83 43.407 35.551 24.556 619 HD21 LEU 83 HD21 LEU 83 45.708 34.590 26.096 620 HD22 LEU 83 HD22 LEU 83 44.235 34.167 26.496 621 HD23 LEU 83 HD23 LEU 83 45.337 33.058 26.244 622 H GLY 84 H GLY 84 44.449 30.395 22.563 623 HA2 GLY 84 HA2 GLY 84 46.560 31.021 21.168 624 HA3 GLY 84 HA3 GLY 84 46.033 29.570 21.389 625 H LYS 85 H LYS 85 43.460 29.980 20.006 626 HA LYS 85 HA LYS 85 43.976 29.650 17.424 627 HB2 LYS 85 HB2 LYS 85 42.057 28.804 18.793 628 HB3 LYS 85 HB3 LYS 85 41.385 30.153 18.393 629 HG2 LYS 85 HG2 LYS 85 40.610 28.724 16.827 630 HG3 LYS 85 HG3 LYS 85 41.727 29.503 16.066 631 HD2 LYS 85 HD2 LYS 85 41.946 27.240 15.540 632 HD3 LYS 85 HD3 LYS 85 43.210 27.664 16.350 633 HE2 LYS 85 HE2 LYS 85 42.312 26.695 18.312 634 HE3 LYS 85 HE3 LYS 85 40.999 26.331 17.553 635 HZ1 LYS 85 HZ1 LYS 85 42.343 24.515 17.702 636 HZ2 LYS 85 HZ2 LYS 85 42.200 24.852 16.296 637 HZ3 LYS 85 HZ3 LYS 85 43.423 25.192 17.003 638 H ALA 86 H ALA 86 42.640 32.408 19.062 639 HA ALA 86 HA ALA 86 42.368 34.019 17.020 640 HB1 ALA 86 HB1 ALA 86 41.964 35.650 18.718 641 HB2 ALA 86 HB2 ALA 86 41.140 34.332 19.027 642 HB3 ALA 86 HB3 ALA 86 42.486 34.627 19.808 643 H MET 87 H MET 87 45.094 33.686 19.122 644 HA MET 87 HA MET 87 46.582 35.633 18.058 645 HB2 MET 87 HB2 MET 87 47.228 33.643 19.987 646 HB3 MET 87 HB3 MET 87 48.257 34.734 19.558 647 HG2 MET 87 HG2 MET 87 45.779 35.436 20.735 648 HG3 MET 87 HG3 MET 87 47.053 35.220 21.609 649 HE1 MET 87 HE1 MET 87 46.102 38.977 21.597 650 HE2 MET 87 HE2 MET 87 45.093 37.791 21.308 651 HE3 MET 87 HE3 MET 87 46.118 37.682 22.510 652 H ARG 88 H ARG 88 45.928 32.732 16.770 653 HA ARG 88 HA ARG 88 46.790 31.171 15.592 654 HB2 ARG 88 HB2 ARG 88 46.662 33.198 14.150 655 HB3 ARG 88 HB3 ARG 88 48.221 33.143 14.196 656 HG2 ARG 88 HG2 ARG 88 48.038 30.831 13.372 657 HG3 ARG 88 HG3 ARG 88 46.535 31.133 13.090 658 HD2 ARG 88 HD2 ARG 88 48.727 32.399 11.806 659 HD3 ARG 88 HD3 ARG 88 47.689 31.473 11.101 660 HE ARG 88 HE ARG 88 46.228 33.403 11.848 661 HH11 ARG 88 HH11 ARG 88 45.902 35.440 11.004 662 HH12 ARG 88 HH12 ARG 88 46.786 35.949 9.918 663 HH21 ARG 88 HH21 ARG 88 48.852 33.496 9.828 664 HH22 ARG 88 HH22 ARG 88 48.503 34.816 9.233 665 H LEU 89 H LEU 89 47.991 30.807 17.869 666 HA LEU 89 HA LEU 89 50.718 31.076 17.759 667 HB2 LEU 89 HB2 LEU 89 49.658 32.671 19.153 668 HB3 LEU 89 HB3 LEU 89 48.899 31.534 19.903 669 HG LEU 89 HG LEU 89 50.943 30.801 20.833 670 HD11 LEU 89 HD11 LEU 89 52.863 32.135 20.697 671 HD12 LEU 89 HD12 LEU 89 52.464 31.597 19.263 672 HD13 LEU 89 HD13 LEU 89 52.124 33.089 19.671 673 HD21 LEU 89 HD21 LEU 89 51.150 32.638 22.366 674 HD22 LEU 89 HD22 LEU 89 50.355 33.556 21.349 675 HD23 LEU 89 HD23 LEU 89 49.619 32.354 22.074 676 H ARG 90 H ARG 90 52.059 29.441 18.308 677 HA ARG 90 HA ARG 90 51.250 26.955 18.295 678 HB2 ARG 90 HB2 ARG 90 53.856 27.992 18.811 679 HB3 ARG 90 HB3 ARG 90 53.594 26.471 18.588 680 HG2 ARG 90 HG2 ARG 90 52.992 26.857 16.349 681 HG3 ARG 90 HG3 ARG 90 53.094 28.399 16.556 682 HD2 ARG 90 HD2 ARG 90 55.447 28.191 16.928 683 HD3 ARG 90 HD3 ARG 90 55.342 26.650 16.708 684 HE ARG 90 HE ARG 90 54.438 27.655 14.515 685 HH11 ARG 90 HH11 ARG 90 55.567 28.026 12.628 686 HH12 ARG 90 HH12 ARG 90 57.042 28.227 12.676 687 HH21 ARG 90 HH21 ARG 90 57.477 27.941 15.821 688 HH22 ARG 90 HH22 ARG 90 58.136 28.178 14.506 689 H ILE 91 H ILE 91 52.498 28.806 20.901 690 HA ILE 91 HA ILE 91 51.705 27.094 22.838 691 HB ILE 91 HB ILE 91 53.694 28.004 23.981 692 HG12 ILE 91 HG12 ILE 91 55.673 27.934 22.708 693 HG13 ILE 91 HG13 ILE 91 54.816 27.895 21.405 694 HG21 ILE 91 HG21 ILE 91 54.800 25.875 23.389 695 HG22 ILE 91 HG22 ILE 91 53.260 25.636 23.667 696 HG23 ILE 91 HG23 ILE 91 53.790 25.736 22.178 697 HD11 ILE 91 HD11 ILE 91 55.632 30.057 21.738 698 HD12 ILE 91 HD12 ILE 91 54.051 30.085 21.828 699 HD13 ILE 91 HD13 ILE 91 54.920 30.125 23.151 700 H VAL 92 H VAL 92 50.151 27.979 24.043 701 HA VAL 92 HA VAL 92 49.992 30.629 24.677 702 HB VAL 92 HB VAL 92 48.248 29.964 23.414 703 HG11 VAL 92 HG11 VAL 92 46.651 28.355 24.126 704 HG12 VAL 92 HG12 VAL 92 48.069 27.695 23.875 705 HG13 VAL 92 HG13 VAL 92 47.589 28.004 25.352 706 HG21 VAL 92 HG21 VAL 92 46.410 30.661 24.733 707 HG22 VAL 92 HG22 VAL 92 47.319 30.532 26.024 708 HG23 VAL 92 HG23 VAL 92 47.659 31.616 24.921 709 HA PRO 93 HA PRO 93 50.714 29.662 28.864 710 HB2 PRO 93 HB2 PRO 93 49.602 32.080 29.701 711 HB3 PRO 93 HB3 PRO 93 51.080 31.629 29.907 712 HG2 PRO 93 HG2 PRO 93 50.560 33.477 28.182 713 HG3 PRO 93 HG3 PRO 93 51.755 32.510 27.919 714 HD2 PRO 93 HD2 PRO 93 49.156 32.320 26.803 715 HD3 PRO 93 HD3 PRO 93 50.503 32.066 26.058 716 H GLU 94 H GLU 94 49.643 28.895 30.778 717 HA GLU 94 HA GLU 94 47.003 28.365 30.728 718 HB2 GLU 94 HB2 GLU 94 48.528 26.708 31.397 719 HB3 GLU 94 HB3 GLU 94 48.978 27.599 32.595 720 HG2 GLU 94 HG2 GLU 94 47.559 25.977 33.425 721 HG3 GLU 94 HG3 GLU 94 46.837 27.352 33.578 722 H LEU 95 H LEU 95 45.367 29.113 32.257 723 HA LEU 95 HA LEU 95 45.839 31.728 32.789 724 HB2 LEU 95 HB2 LEU 95 43.394 30.680 31.767 725 HB3 LEU 95 HB3 LEU 95 43.684 32.201 31.953 726 HG LEU 95 HG LEU 95 44.961 30.569 30.044 727 HD11 LEU 95 HD11 LEU 95 43.722 31.827 28.406 728 HD12 LEU 95 HD12 LEU 95 42.729 31.085 29.393 729 HD13 LEU 95 HD13 LEU 95 43.025 32.629 29.581 730 HD21 LEU 95 HD21 LEU 95 45.937 32.498 29.108 731 HD22 LEU 95 HD22 LEU 95 45.325 33.364 30.284 732 HD23 LEU 95 HD23 LEU 95 46.437 32.280 30.595 733 H THR 96 H THR 96 45.354 32.636 34.766 734 HA THR 96 HA THR 96 43.722 31.399 36.550 735 HB THR 96 HB THR 96 45.974 32.893 37.242 736 HG1 THR 96 HG1 THR 96 46.879 30.906 37.782 737 HG21 THR 96 HG21 THR 96 45.754 31.989 39.436 738 HG22 THR 96 HG22 THR 96 44.463 32.814 39.035 739 HG23 THR 96 HG23 THR 96 44.443 31.232 38.969 740 H PHE 97 H PHE 97 42.068 32.778 37.540 741 HA PHE 97 HA PHE 97 41.912 35.355 36.687 742 HB2 PHE 97 HB2 PHE 97 39.750 33.519 36.869 743 HB3 PHE 97 HB3 PHE 97 39.561 35.014 36.466 744 HD1 PHE 97 HD1 PHE 97 40.092 35.770 34.178 745 HD2 PHE 97 HD2 PHE 97 40.654 31.898 35.234 746 HE1 PHE 97 HE1 PHE 97 40.364 35.188 31.927 747 HE2 PHE 97 HE2 PHE 97 40.953 31.338 32.988 748 HZ PHE 97 HZ PHE 97 40.806 32.975 31.341 749 H PHE 98 H PHE 98 41.193 37.015 38.079 750 HA PHE 98 HA PHE 98 40.360 36.512 40.596 751 HB2 PHE 98 HB2 PHE 98 42.447 38.367 40.024 752 HB3 PHE 98 HB3 PHE 98 41.901 38.086 41.457 753 HD1 PHE 98 HD1 PHE 98 42.417 35.845 42.532 754 HD2 PHE 98 HD2 PHE 98 44.280 37.072 39.158 755 HE1 PHE 98 HE1 PHE 98 44.085 34.243 42.870 756 HE2 PHE 98 HE2 PHE 98 45.925 35.458 39.471 757 HZ PHE 98 HZ PHE 98 45.851 34.063 41.338 758 H TYR 99 H TYR 99 39.089 38.298 41.618 759 HA TYR 99 HA TYR 99 37.844 39.921 39.899 760 HB2 TYR 99 HB2 TYR 99 36.143 40.147 41.389 761 HB3 TYR 99 HB3 TYR 99 36.478 38.626 41.293 762 HD1 TYR 99 HD1 TYR 99 36.515 41.370 43.481 763 HD2 TYR 99 HD2 TYR 99 37.428 37.441 43.243 764 HE1 TYR 99 HE1 TYR 99 36.525 41.242 45.810 765 HE2 TYR 99 HE2 TYR 99 37.582 37.339 45.581 766 HH TYR 99 HH TYR 99 37.266 38.432 47.541 767 H ASP 100 H ASP 100 37.850 42.183 39.854 768 HA ASP 100 HA ASP 100 39.251 43.702 41.629 769 HB2 ASP 100 HB2 ASP 100 40.658 43.328 39.801 770 HB3 ASP 100 HB3 ASP 100 39.518 43.693 38.801 Start of MODEL 10 1 HA PRO 8 HA PRO 8 56.957 44.102 25.481 2 HB2 PRO 8 HB2 PRO 8 55.747 41.586 25.065 3 HB3 PRO 8 HB3 PRO 8 56.637 42.367 24.049 4 HG2 PRO 8 HG2 PRO 8 57.706 40.375 25.227 5 HG3 PRO 8 HG3 PRO 8 58.598 41.638 25.027 6 HD2 PRO 8 HD2 PRO 8 57.166 40.956 27.395 7 HD3 PRO 8 HD3 PRO 8 58.654 41.419 27.328 8 H GLN 9 H GLN 9 55.607 45.735 26.141 9 HA GLN 9 HA GLN 9 53.462 45.318 27.640 10 HB2 GLN 9 HB2 GLN 9 54.874 47.243 27.869 11 HB3 GLN 9 HB3 GLN 9 54.387 47.748 26.476 12 HG2 GLN 9 HG2 GLN 9 52.443 47.437 28.478 13 HG3 GLN 9 HG3 GLN 9 53.375 48.683 28.582 14 HE21 GLN 9 HE21 GLN 9 50.857 49.389 28.412 15 HE22 GLN 9 HE22 GLN 9 50.480 49.921 27.073 16 H ARG 10 H ARG 10 53.627 45.848 24.237 17 HA ARG 10 HA ARG 10 51.064 46.362 23.853 18 HB2 ARG 10 HB2 ARG 10 52.881 45.699 21.796 19 HB3 ARG 10 HB3 ARG 10 51.491 46.370 21.576 20 HG2 ARG 10 HG2 ARG 10 52.314 48.295 22.805 21 HG3 ARG 10 HG3 ARG 10 53.727 47.633 22.796 22 HD2 ARG 10 HD2 ARG 10 53.751 47.729 20.403 23 HD3 ARG 10 HD3 ARG 10 52.343 48.400 20.418 24 HE ARG 10 HE ARG 10 53.278 50.308 21.182 25 HH11 ARG 10 HH11 ARG 10 54.971 51.772 21.346 26 HH12 ARG 10 HH12 ARG 10 56.371 51.313 21.128 27 HH21 ARG 10 HH21 ARG 10 55.766 48.204 20.615 28 HH22 ARG 10 HH22 ARG 10 56.833 49.239 20.703 29 H VAL 11 H VAL 11 52.823 43.367 23.617 30 HA VAL 11 HA VAL 11 51.026 41.711 22.847 31 HB VAL 11 HB VAL 11 53.006 41.117 24.734 32 HG11 VAL 11 HG11 VAL 11 52.790 38.829 24.009 33 HG12 VAL 11 HG12 VAL 11 51.418 39.349 24.606 34 HG13 VAL 11 HG13 VAL 11 51.619 39.270 23.037 35 HG21 VAL 11 HG21 VAL 11 54.340 40.297 22.937 36 HG22 VAL 11 HG22 VAL 11 53.228 40.778 21.917 37 HG23 VAL 11 HG23 VAL 11 54.048 41.843 22.755 38 H ALA 12 H ALA 12 51.546 42.810 26.144 39 HA ALA 12 HA ALA 12 49.608 41.507 27.348 40 HB1 ALA 12 HB1 ALA 12 50.120 42.961 29.162 41 HB2 ALA 12 HB2 ALA 12 51.454 42.369 28.548 42 HB3 ALA 12 HB3 ALA 12 51.006 43.845 28.191 43 H GLN 13 H GLN 13 49.292 44.560 25.751 44 HA GLN 13 HA GLN 13 46.812 45.012 26.522 45 HB2 GLN 13 HB2 GLN 13 48.034 46.219 24.279 46 HB3 GLN 13 HB3 GLN 13 46.768 46.764 25.010 47 HG2 GLN 13 HG2 GLN 13 49.437 47.103 25.753 48 HG3 GLN 13 HG3 GLN 13 48.307 48.178 25.747 49 HE21 GLN 13 HE21 GLN 13 50.027 46.224 27.752 50 HE22 GLN 13 HE22 GLN 13 49.276 46.421 29.023 51 H GLU 14 H GLU 14 47.996 43.583 23.565 52 HA GLU 14 HA GLU 14 45.753 43.114 22.321 53 HB2 GLU 14 HB2 GLU 14 48.302 41.886 22.015 54 HB3 GLU 14 HB3 GLU 14 47.116 41.514 21.072 55 HG2 GLU 14 HG2 GLU 14 47.045 43.705 20.219 56 HG3 GLU 14 HG3 GLU 14 48.122 44.173 21.246 57 H MET 15 H MET 15 47.350 41.054 24.622 58 HA MET 15 HA MET 15 45.773 38.978 24.643 59 HB2 MET 15 HB2 MET 15 47.507 39.950 26.651 60 HB3 MET 15 HB3 MET 15 46.706 38.626 26.851 61 HG2 MET 15 HG2 MET 15 48.466 38.887 24.652 62 HG3 MET 15 HG3 MET 15 49.019 38.414 26.032 63 HE1 MET 15 HE1 MET 15 49.399 35.261 24.077 64 HE2 MET 15 HE2 MET 15 49.672 36.747 23.601 65 HE3 MET 15 HE3 MET 15 50.130 36.281 25.044 66 H GLN 16 H GLN 16 45.441 41.849 26.681 67 HA GLN 16 HA GLN 16 43.315 41.215 27.981 68 HB2 GLN 16 HB2 GLN 16 44.232 43.795 27.220 69 HB3 GLN 16 HB3 GLN 16 42.940 43.656 28.084 70 HG2 GLN 16 HG2 GLN 16 44.148 42.855 29.896 71 HG3 GLN 16 HG3 GLN 16 45.437 42.694 29.033 72 HE21 GLN 16 HE21 GLN 16 46.893 44.395 29.213 73 HE22 GLN 16 HE22 GLN 16 46.557 45.809 29.537 74 H LYS 17 H LYS 17 43.386 42.806 24.868 75 HA LYS 17 HA LYS 17 40.889 43.351 24.448 76 HB2 LYS 17 HB2 LYS 17 42.630 44.306 23.169 77 HB3 LYS 17 HB3 LYS 17 43.018 42.906 22.602 78 HG2 LYS 17 HG2 LYS 17 40.982 42.828 21.369 79 HG3 LYS 17 HG3 LYS 17 40.567 44.212 21.953 80 HD2 LYS 17 HD2 LYS 17 42.414 45.235 20.861 81 HD3 LYS 17 HD3 LYS 17 42.845 43.850 20.286 82 HE2 LYS 17 HE2 LYS 17 41.010 43.744 18.898 83 HE3 LYS 17 HE3 LYS 17 40.283 44.894 19.661 84 HZ1 LYS 17 HZ1 LYS 17 41.179 45.687 17.723 85 HZ2 LYS 17 HZ2 LYS 17 41.840 46.356 18.831 86 HZ3 LYS 17 HZ3 LYS 17 42.517 45.284 18.121 87 H GLU 18 H GLU 18 42.468 40.461 23.354 88 HA GLU 18 HA GLU 18 40.303 39.387 22.226 89 HB2 GLU 18 HB2 GLU 18 42.692 39.019 21.627 90 HB3 GLU 18 HB3 GLU 18 42.670 37.941 22.755 91 HG2 GLU 18 HG2 GLU 18 42.247 36.802 20.792 92 HG3 GLU 18 HG3 GLU 18 40.898 36.809 21.573 93 H ILE 19 H ILE 19 41.759 38.763 25.329 94 HA ILE 19 HA ILE 19 40.239 36.801 26.161 95 HB ILE 19 HB ILE 19 41.748 38.624 27.684 96 HG12 ILE 19 HG12 ILE 19 42.358 35.885 27.130 97 HG13 ILE 19 HG13 ILE 19 42.974 37.047 26.291 98 HG21 ILE 19 HG21 ILE 19 41.496 37.195 29.550 99 HG22 ILE 19 HG22 ILE 19 40.089 37.765 29.100 100 HG23 ILE 19 HG23 ILE 19 40.505 36.286 28.713 101 HD11 ILE 19 HD11 ILE 19 44.543 36.305 27.865 102 HD12 ILE 19 HD12 ILE 19 44.158 37.807 28.189 103 HD13 ILE 19 HD13 ILE 19 43.534 36.628 29.041 104 H ALA 20 H ALA 20 39.651 40.245 26.478 105 HA ALA 20 HA ALA 20 37.496 40.186 27.937 106 HB1 ALA 20 HB1 ALA 20 37.226 42.435 27.225 107 HB2 ALA 20 HB2 ALA 20 38.729 42.178 27.655 108 HB3 ALA 20 HB3 ALA 20 38.339 42.211 26.121 109 H LEU 21 H LEU 21 37.635 39.974 24.451 110 HA LEU 21 HA LEU 21 35.024 39.890 24.026 111 HB2 LEU 21 HB2 LEU 21 36.549 40.460 22.303 112 HB3 LEU 21 HB3 LEU 21 37.100 39.002 22.307 113 HG LEU 21 HG LEU 21 35.077 38.186 21.535 114 HD11 LEU 21 HD11 LEU 21 33.293 39.594 20.853 115 HD12 LEU 21 HD12 LEU 21 33.534 39.711 22.414 116 HD13 LEU 21 HD13 LEU 21 34.070 40.841 21.443 117 HD21 LEU 21 HD21 LEU 21 35.093 39.162 19.333 118 HD22 LEU 21 HD22 LEU 21 35.957 40.363 19.897 119 HD23 LEU 21 HD23 LEU 21 36.574 38.906 19.832 120 H ILE 22 H ILE 22 37.220 37.213 24.480 121 HA ILE 22 HA ILE 22 35.548 35.229 24.148 122 HB ILE 22 HB ILE 22 37.985 35.210 25.529 123 HG12 ILE 22 HG12 ILE 22 37.628 34.170 22.918 124 HG13 ILE 22 HG13 ILE 22 38.073 35.650 23.124 125 HG21 ILE 22 HG21 ILE 22 37.912 32.828 25.328 126 HG22 ILE 22 HG22 ILE 22 36.684 33.342 26.188 127 HG23 ILE 22 HG23 ILE 22 36.476 32.943 24.669 128 HD11 ILE 22 HD11 ILE 22 39.955 34.323 22.681 129 HD12 ILE 22 HD12 ILE 22 40.077 34.917 24.143 130 HD13 ILE 22 HD13 ILE 22 39.624 33.414 23.934 131 H LEU 23 H LEU 23 36.248 36.901 27.132 132 HA LEU 23 HA LEU 23 34.763 35.544 28.791 133 HB2 LEU 23 HB2 LEU 23 36.159 37.952 28.948 134 HB3 LEU 23 HB3 LEU 23 34.966 37.856 29.946 135 HG LEU 23 HG LEU 23 35.879 35.976 30.930 136 HD11 LEU 23 HD11 LEU 23 38.010 35.143 30.417 137 HD12 LEU 23 HD12 LEU 23 37.018 34.961 29.197 138 HD13 LEU 23 HD13 LEU 23 38.085 36.130 29.181 139 HD21 LEU 23 HD21 LEU 23 37.813 37.001 31.936 140 HD22 LEU 23 HD22 LEU 23 37.818 38.076 30.774 141 HD23 LEU 23 HD23 LEU 23 36.631 38.048 31.821 142 H GLN 24 H GLN 24 33.705 38.093 26.722 143 HA GLN 24 HA GLN 24 31.229 38.122 27.675 144 HB2 GLN 24 HB2 GLN 24 32.355 39.590 25.528 145 HB3 GLN 24 HB3 GLN 24 30.843 39.721 25.888 146 HG2 GLN 24 HG2 GLN 24 31.802 40.297 28.187 147 HG3 GLN 24 HG3 GLN 24 33.023 40.748 27.327 148 HE21 GLN 24 HE21 GLN 24 30.242 41.870 28.545 149 HE22 GLN 24 HE22 GLN 24 29.990 43.057 27.680 150 H ARG 25 H ARG 25 32.580 36.270 25.183 151 HA ARG 25 HA ARG 25 30.209 35.555 24.134 152 HB2 ARG 25 HB2 ARG 25 32.852 35.245 23.085 153 HB3 ARG 25 HB3 ARG 25 31.633 34.610 22.347 154 HG2 ARG 25 HG2 ARG 25 32.097 37.394 22.610 155 HG3 ARG 25 HG3 ARG 25 32.202 36.596 21.274 156 HD2 ARG 25 HD2 ARG 25 29.782 37.206 22.615 157 HD3 ARG 25 HD3 ARG 25 30.215 37.793 21.237 158 HE ARG 25 HE ARG 25 30.046 35.422 20.567 159 HH11 ARG 25 HH11 ARG 25 28.365 33.954 20.207 160 HH12 ARG 25 HH12 ARG 25 27.011 34.246 20.753 161 HH21 ARG 25 HH21 ARG 25 27.656 36.934 22.303 162 HH22 ARG 25 HH22 ARG 25 26.606 35.939 21.944 163 H GLU 26 H GLU 26 32.760 33.740 25.587 164 HA GLU 26 HA GLU 26 31.749 31.343 24.814 165 HB2 GLU 26 HB2 GLU 26 34.057 31.820 24.503 166 HB3 GLU 26 HB3 GLU 26 34.231 31.934 26.049 167 HG2 GLU 26 HG2 GLU 26 35.049 29.864 25.329 168 HG3 GLU 26 HG3 GLU 26 33.853 29.633 26.304 169 H ILE 27 H ILE 27 31.841 32.986 27.761 170 HA ILE 27 HA ILE 27 30.227 31.153 28.954 171 HB ILE 27 HB ILE 27 30.767 32.186 31.016 172 HG12 ILE 27 HG12 ILE 27 33.026 33.283 29.748 173 HG13 ILE 27 HG13 ILE 27 31.769 34.145 30.081 174 HG21 ILE 27 HG21 ILE 27 32.732 30.870 31.274 175 HG22 ILE 27 HG22 ILE 27 31.639 30.061 30.462 176 HG23 ILE 27 HG23 ILE 27 32.846 30.746 29.699 177 HD11 ILE 27 HD11 ILE 27 33.382 34.437 31.763 178 HD12 ILE 27 HD12 ILE 27 32.097 33.756 32.392 179 HD13 ILE 27 HD13 ILE 27 33.373 32.880 32.055 180 H LYS 28 H LYS 28 28.172 32.060 29.975 181 HA LYS 28 HA LYS 28 27.015 33.830 28.357 182 HB2 LYS 28 HB2 LYS 28 25.864 32.415 30.526 183 HB3 LYS 28 HB3 LYS 28 25.028 33.289 29.542 184 HG2 LYS 28 HG2 LYS 28 26.335 30.873 28.851 185 HG3 LYS 28 HG3 LYS 28 24.789 31.059 28.933 186 HD2 LYS 28 HD2 LYS 28 24.931 32.563 27.045 187 HD3 LYS 28 HD3 LYS 28 26.444 32.201 26.922 188 HE2 LYS 28 HE2 LYS 28 25.869 29.925 26.503 189 HE3 LYS 28 HE3 LYS 28 24.356 30.279 26.638 190 HZ1 LYS 28 HZ1 LYS 28 24.954 30.242 24.438 191 HZ2 LYS 28 HZ2 LYS 28 24.553 31.598 24.771 192 HZ3 LYS 28 HZ3 LYS 28 25.963 31.267 24.646 193 H ASP 29 H ASP 29 27.738 35.945 28.600 194 HA ASP 29 HA ASP 29 27.988 37.167 30.910 195 HB2 ASP 29 HB2 ASP 29 29.196 37.669 28.768 196 HB3 ASP 29 HB3 ASP 29 28.016 38.662 28.533 197 HA PRO 30 HA PRO 30 23.761 39.043 29.981 198 HB2 PRO 30 HB2 PRO 30 22.493 36.600 29.215 199 HB3 PRO 30 HB3 PRO 30 22.036 38.035 28.808 200 HG2 PRO 30 HG2 PRO 30 23.368 36.752 27.060 201 HG3 PRO 30 HG3 PRO 30 23.743 38.254 27.238 202 HD2 PRO 30 HD2 PRO 30 25.116 36.032 28.342 203 HD3 PRO 30 HD3 PRO 30 25.770 37.303 27.718 204 H ARG 31 H ARG 31 24.367 36.061 31.601 205 HA ARG 31 HA ARG 31 22.780 36.558 33.647 206 HB2 ARG 31 HB2 ARG 31 24.791 34.560 33.347 207 HB3 ARG 31 HB3 ARG 31 23.979 34.665 34.674 208 HG2 ARG 31 HG2 ARG 31 21.974 34.354 33.232 209 HG3 ARG 31 HG3 ARG 31 22.984 33.828 32.166 210 HD2 ARG 31 HD2 ARG 31 22.674 32.647 34.738 211 HD3 ARG 31 HD3 ARG 31 22.074 32.030 33.437 212 HE ARG 31 HE ARG 31 24.748 32.253 33.292 213 HH11 ARG 31 HH11 ARG 31 26.023 30.495 33.073 214 HH12 ARG 31 HH12 ARG 31 25.551 29.150 33.506 215 HH21 ARG 31 HH21 ARG 31 22.589 30.038 34.476 216 HH22 ARG 31 HH22 ARG 31 23.515 28.880 34.337 217 H LEU 32 H LEU 32 25.888 37.678 33.101 218 HA LEU 32 HA LEU 32 26.291 38.627 35.599 219 HB2 LEU 32 HB2 LEU 32 28.194 38.530 33.517 220 HB3 LEU 32 HB3 LEU 32 28.500 39.026 34.963 221 HG LEU 32 HG LEU 32 27.916 36.371 34.259 222 HD11 LEU 32 HD11 LEU 32 30.186 35.937 34.958 223 HD12 LEU 32 HD12 LEU 32 30.172 37.002 33.786 224 HD13 LEU 32 HD13 LEU 32 30.356 37.477 35.286 225 HD21 LEU 32 HD21 LEU 32 28.341 35.705 36.490 226 HD22 LEU 32 HD22 LEU 32 28.492 37.226 36.904 227 HD23 LEU 32 HD23 LEU 32 27.088 36.671 36.426 228 H GLY 33 H GLY 33 24.467 39.815 33.401 229 HA2 GLY 33 HA2 GLY 33 23.572 41.742 33.145 230 HA3 GLY 33 HA3 GLY 33 24.701 42.382 34.010 231 H MET 34 H MET 34 25.811 40.665 31.312 232 HA MET 34 HA MET 34 26.784 41.084 29.472 233 HB2 MET 34 HB2 MET 34 24.409 41.527 29.045 234 HB3 MET 34 HB3 MET 34 24.794 43.038 29.046 235 HG2 MET 34 HG2 MET 34 24.641 42.343 26.867 236 HG3 MET 34 HG3 MET 34 26.128 42.717 27.151 237 HE1 MET 34 HE1 MET 34 28.173 39.965 26.223 238 HE2 MET 34 HE2 MET 34 27.877 41.494 25.935 239 HE3 MET 34 HE3 MET 34 28.110 40.999 27.421 240 H MET 35 H MET 35 28.036 42.447 31.641 241 HA MET 35 HA MET 35 29.574 44.266 30.408 242 HB2 MET 35 HB2 MET 35 27.688 45.470 31.371 243 HB3 MET 35 HB3 MET 35 28.250 45.086 32.774 244 HG2 MET 35 HG2 MET 35 30.333 46.205 31.983 245 HG3 MET 35 HG3 MET 35 29.397 46.880 30.934 246 HE1 MET 35 HE1 MET 35 30.072 49.832 33.131 247 HE2 MET 35 HE2 MET 35 31.085 48.714 32.648 248 HE3 MET 35 HE3 MET 35 30.030 49.317 31.634 249 H THR 36 H THR 36 30.625 41.854 31.061 250 HA THR 36 HA THR 36 32.256 42.203 33.188 251 HB THR 36 HB THR 36 32.191 39.999 31.460 252 HG1 THR 36 HG1 THR 36 30.438 39.748 32.592 253 HG21 THR 36 HG21 THR 36 33.381 38.808 33.093 254 HG22 THR 36 HG22 THR 36 34.229 40.043 32.583 255 HG23 THR 36 HG23 THR 36 33.477 40.119 33.975 256 H THR 37 H THR 37 34.511 42.697 33.052 257 HA THR 37 HA THR 37 35.625 43.480 30.710 258 HB THR 37 HB THR 37 35.194 45.102 32.973 259 HG1 THR 37 HG1 THR 37 34.282 46.472 31.462 260 HG21 THR 37 HG21 THR 37 36.466 46.868 32.061 261 HG22 THR 37 HG22 THR 37 37.374 45.611 32.380 262 HG23 THR 37 HG23 THR 37 36.928 45.909 30.890 263 H VAL 38 H VAL 38 37.990 43.204 30.627 264 HA VAL 38 HA VAL 38 39.286 42.203 32.778 265 HB VAL 38 HB VAL 38 40.221 42.533 30.157 266 HG11 VAL 38 HG11 VAL 38 42.096 41.197 30.728 267 HG12 VAL 38 HG12 VAL 38 42.077 42.532 31.580 268 HG13 VAL 38 HG13 VAL 38 41.599 41.169 32.231 269 HG21 VAL 38 HG21 VAL 38 40.076 40.131 29.977 270 HG22 VAL 38 HG22 VAL 38 39.478 40.080 31.443 271 HG23 VAL 38 HG23 VAL 38 38.648 40.750 30.272 272 H SER 39 H SER 39 40.400 43.681 34.235 273 HA SER 39 HA SER 39 40.840 46.200 33.460 274 HB2 SER 39 HB2 SER 39 41.097 46.795 35.632 275 HB3 SER 39 HB3 SER 39 39.891 45.809 35.605 276 HG SER 39 HG SER 39 41.322 45.361 37.222 277 H GLY 40 H GLY 40 42.886 43.542 33.901 278 HA2 GLY 40 HA2 GLY 40 44.942 44.466 32.620 279 HA3 GLY 40 HA3 GLY 40 45.247 44.605 34.144 280 H VAL 41 H VAL 41 46.928 42.976 32.785 281 HA VAL 41 HA VAL 41 46.464 40.484 33.713 282 HB VAL 41 HB VAL 41 47.686 39.588 31.912 283 HG11 VAL 41 HG11 VAL 41 45.910 39.728 30.295 284 HG12 VAL 41 HG12 VAL 41 45.323 39.509 31.750 285 HG13 VAL 41 HG13 VAL 41 45.307 40.953 31.097 286 HG21 VAL 41 HG21 VAL 41 48.047 40.808 29.936 287 HG22 VAL 41 HG22 VAL 41 47.566 42.123 30.676 288 HG23 VAL 41 HG23 VAL 41 48.895 41.397 31.137 289 H GLU 42 H GLU 42 48.403 39.277 34.528 290 HA GLU 42 HA GLU 42 50.867 40.452 34.338 291 HB2 GLU 42 HB2 GLU 42 50.126 40.789 36.537 292 HB3 GLU 42 HB3 GLU 42 49.891 39.256 36.701 293 HG2 GLU 42 HG2 GLU 42 52.196 38.842 36.560 294 HG3 GLU 42 HG3 GLU 42 52.475 40.347 36.255 295 H MET 43 H MET 43 52.059 39.121 32.982 296 HA MET 43 HA MET 43 51.446 36.495 32.692 297 HB2 MET 43 HB2 MET 43 52.467 38.194 30.658 298 HB3 MET 43 HB3 MET 43 52.076 36.702 30.435 299 HG2 MET 43 HG2 MET 43 49.799 37.328 31.015 300 HG3 MET 43 HG3 MET 43 50.263 38.814 30.940 301 HE1 MET 43 HE1 MET 43 51.276 39.131 27.228 302 HE2 MET 43 HE2 MET 43 51.301 39.899 28.611 303 HE3 MET 43 HE3 MET 43 52.225 38.632 28.392 304 H SER 44 H SER 44 53.031 34.942 33.027 305 HA SER 44 HA SER 44 55.446 35.565 33.968 306 HB2 SER 44 HB2 SER 44 54.294 33.807 34.935 307 HB3 SER 44 HB3 SER 44 54.222 33.055 33.571 308 HG SER 44 HG SER 44 55.889 32.316 34.785 309 H ARG 45 H ARG 45 57.572 34.786 33.051 310 HA ARG 45 HA ARG 45 57.825 36.256 30.901 311 HB2 ARG 45 HB2 ARG 45 59.427 36.215 32.662 312 HB3 ARG 45 HB3 ARG 45 59.835 34.767 32.252 313 HG2 ARG 45 HG2 ARG 45 60.812 35.514 30.283 314 HG3 ARG 45 HG3 ARG 45 60.201 36.939 30.457 315 HD2 ARG 45 HD2 ARG 45 61.599 37.325 32.337 316 HD3 ARG 45 HD3 ARG 45 62.187 35.886 32.209 317 HE ARG 45 HE ARG 45 62.619 37.294 29.967 318 HH11 ARG 45 HH11 ARG 45 64.653 37.951 29.346 319 HH12 ARG 45 HH12 ARG 45 65.766 37.963 30.335 320 HH21 ARG 45 HH21 ARG 45 64.149 36.897 32.871 321 HH22 ARG 45 HH22 ARG 45 65.476 37.354 32.373 322 H ASP 46 H ASP 46 58.013 32.827 30.946 323 HA ASP 46 HA ASP 46 58.610 32.669 28.348 324 HB2 ASP 46 HB2 ASP 46 59.112 30.453 28.657 325 HB3 ASP 46 HB3 ASP 46 59.761 31.224 29.847 326 H LEU 47 H LEU 47 55.802 33.328 29.356 327 HA LEU 47 HA LEU 47 53.758 33.069 28.904 328 HB2 LEU 47 HB2 LEU 47 54.718 32.523 26.312 329 HB3 LEU 47 HB3 LEU 47 53.248 32.939 26.628 330 HG LEU 47 HG LEU 47 55.476 34.617 26.991 331 HD11 LEU 47 HD11 LEU 47 54.581 35.864 25.130 332 HD12 LEU 47 HD12 LEU 47 54.902 34.379 24.684 333 HD13 LEU 47 HD13 LEU 47 53.411 34.802 25.009 334 HD21 LEU 47 HD21 LEU 47 54.001 36.405 27.410 335 HD22 LEU 47 HD22 LEU 47 52.778 35.400 27.342 336 HD23 LEU 47 HD23 LEU 47 53.840 35.277 28.511 337 H ALA 48 H ALA 48 54.546 30.913 30.313 338 HA ALA 48 HA ALA 48 53.014 28.841 29.503 339 HB1 ALA 48 HB1 ALA 48 54.141 27.636 31.205 340 HB2 ALA 48 HB2 ALA 48 55.193 28.258 30.197 341 HB3 ALA 48 HB3 ALA 48 54.936 28.948 31.600 342 H TYR 49 H TYR 49 52.936 31.309 31.884 343 HA TYR 49 HA TYR 49 50.473 30.609 32.745 344 HB2 TYR 49 HB2 TYR 49 52.636 31.093 34.545 345 HB3 TYR 49 HB3 TYR 49 51.158 31.044 35.039 346 HD1 TYR 49 HD1 TYR 49 49.917 28.879 35.008 347 HD2 TYR 49 HD2 TYR 49 53.860 29.032 34.115 348 HE1 TYR 49 HE1 TYR 49 50.005 26.541 35.028 349 HE2 TYR 49 HE2 TYR 49 53.943 26.686 34.047 350 HH TYR 49 HH TYR 49 52.771 24.762 34.218 351 H ALA 50 H ALA 50 49.083 32.313 33.421 352 HA ALA 50 HA ALA 50 49.938 34.842 33.596 353 HB1 ALA 50 HB1 ALA 50 48.241 35.635 32.148 354 HB2 ALA 50 HB2 ALA 50 49.246 34.697 31.361 355 HB3 ALA 50 HB3 ALA 50 47.836 34.140 31.820 356 H LYS 51 H LYS 51 48.880 36.104 35.190 357 HA LYS 51 HA LYS 51 46.536 35.373 36.284 358 HB2 LYS 51 HB2 LYS 51 48.066 37.670 36.919 359 HB3 LYS 51 HB3 LYS 51 46.798 37.222 37.708 360 HG2 LYS 51 HG2 LYS 51 48.049 35.236 38.396 361 HG3 LYS 51 HG3 LYS 51 49.319 35.905 37.787 362 HD2 LYS 51 HD2 LYS 51 48.992 37.799 39.233 363 HD3 LYS 51 HD3 LYS 51 47.758 37.086 39.867 364 HE2 LYS 51 HE2 LYS 51 49.197 35.388 40.738 365 HE3 LYS 51 HE3 LYS 51 50.426 36.125 40.124 366 HZ1 LYS 51 HZ1 LYS 51 50.187 36.695 42.308 367 HZ2 LYS 51 HZ2 LYS 51 49.992 37.890 41.506 368 HZ3 LYS 51 HZ3 LYS 51 48.846 37.204 42.078 369 H VAL 52 H VAL 52 44.528 36.323 35.571 370 HA VAL 52 HA VAL 52 44.485 38.621 34.114 371 HB VAL 52 HB VAL 52 42.550 36.623 33.970 372 HG11 VAL 52 HG11 VAL 52 41.691 37.815 32.081 373 HG12 VAL 52 HG12 VAL 52 41.641 38.714 33.384 374 HG13 VAL 52 HG13 VAL 52 42.789 38.931 32.316 375 HG21 VAL 52 HG21 VAL 52 43.329 36.087 31.779 376 HG22 VAL 52 HG22 VAL 52 44.526 37.105 31.978 377 HG23 VAL 52 HG23 VAL 52 44.445 35.795 32.865 378 H TYR 53 H TYR 53 43.641 40.393 35.257 379 HA TYR 53 HA TYR 53 42.008 40.085 37.389 380 HB2 TYR 53 HB2 TYR 53 43.525 42.308 36.570 381 HB3 TYR 53 HB3 TYR 53 42.457 42.431 37.699 382 HD1 TYR 53 HD1 TYR 53 42.834 41.305 39.888 383 HD2 TYR 53 HD2 TYR 53 45.738 41.388 37.071 384 HE1 TYR 53 HE1 TYR 53 44.404 40.627 41.488 385 HE2 TYR 53 HE2 TYR 53 47.310 40.711 38.657 386 HH TYR 53 HH TYR 53 47.683 40.148 40.848 387 H VAL 54 H VAL 54 39.800 40.521 37.299 388 HA VAL 54 HA VAL 54 38.647 41.490 35.022 389 HB VAL 54 HB VAL 54 37.724 39.237 36.431 390 HG11 VAL 54 HG11 VAL 54 36.255 38.829 34.590 391 HG12 VAL 54 HG12 VAL 54 35.955 40.239 35.245 392 HG13 VAL 54 HG13 VAL 54 36.786 40.151 33.899 393 HG21 VAL 54 HG21 VAL 54 38.443 37.876 34.584 394 HG22 VAL 54 HG22 VAL 54 39.070 39.165 33.910 395 HG23 VAL 54 HG23 VAL 54 39.680 38.598 35.257 396 H THR 55 H THR 55 36.738 42.769 35.350 397 HA THR 55 HA THR 55 35.831 43.279 37.871 398 HB THR 55 HB THR 55 37.262 44.956 37.190 399 HG1 THR 55 HG1 THR 55 35.822 45.719 38.551 400 HG21 THR 55 HG21 THR 55 36.650 46.577 35.642 401 HG22 THR 55 HG22 THR 55 36.914 45.179 34.945 402 HG23 THR 55 HG23 THR 55 35.430 45.674 35.193 403 H PHE 56 H PHE 56 33.638 43.296 38.160 404 HA PHE 56 HA PHE 56 32.035 42.574 36.082 405 HB2 PHE 56 HB2 PHE 56 31.924 41.649 38.768 406 HB3 PHE 56 HB3 PHE 56 30.926 41.191 37.660 407 HD1 PHE 56 HD1 PHE 56 34.242 40.736 38.795 408 HD2 PHE 56 HD2 PHE 56 31.566 39.472 36.044 409 HE1 PHE 56 HE1 PHE 56 35.601 38.895 38.325 410 HE2 PHE 56 HE2 PHE 56 32.928 37.630 35.575 411 HZ PHE 56 HZ PHE 56 34.935 37.331 36.727 412 H LEU 57 H LEU 57 29.986 43.642 35.790 413 HA LEU 57 HA LEU 57 29.006 45.469 37.445 414 HB2 LEU 57 HB2 LEU 57 28.427 45.351 35.124 415 HB3 LEU 57 HB3 LEU 57 27.695 43.999 35.384 416 HG LEU 57 HG LEU 57 26.124 45.127 36.741 417 HD11 LEU 57 HD11 LEU 57 25.981 47.475 36.715 418 HD12 LEU 57 HD12 LEU 57 27.337 47.011 37.389 419 HD13 LEU 57 HD13 LEU 57 27.336 47.542 35.897 420 HD21 LEU 57 HD21 LEU 57 24.962 46.189 34.915 421 HD22 LEU 57 HD22 LEU 57 26.308 46.182 34.079 422 HD23 LEU 57 HD23 LEU 57 25.588 44.817 34.431 423 H ASN 58 H ASN 58 28.995 42.141 37.690 424 HA ASN 58 HA ASN 58 26.805 41.695 39.163 425 HB2 ASN 58 HB2 ASN 58 27.981 40.220 37.472 426 HB3 ASN 58 HB3 ASN 58 28.811 39.768 38.712 427 HD21 ASN 58 HD21 ASN 58 25.024 38.819 38.566 428 HD22 ASN 58 HD22 ASN 58 25.490 40.100 37.965 429 H ASP 59 H ASP 59 29.451 43.082 40.131 430 HA ASP 59 HA ASP 59 30.195 42.301 42.469 431 HB2 ASP 59 HB2 ASP 59 31.267 43.958 41.060 432 HB3 ASP 59 HB3 ASP 59 30.095 44.942 41.359 433 H LYS 60 H LYS 60 27.177 43.591 41.883 434 HA LYS 60 HA LYS 60 26.529 44.577 44.237 435 HB2 LYS 60 HB2 LYS 60 25.377 45.051 42.167 436 HB3 LYS 60 HB3 LYS 60 24.795 43.603 42.195 437 HG2 LYS 60 HG2 LYS 60 23.492 44.093 44.068 438 HG3 LYS 60 HG3 LYS 60 24.193 45.473 44.253 439 HD2 LYS 60 HD2 LYS 60 23.219 46.247 42.234 440 HD3 LYS 60 HD3 LYS 60 22.532 44.862 42.029 441 HE2 LYS 60 HE2 LYS 60 21.273 45.205 44.024 442 HE3 LYS 60 HE3 LYS 60 21.944 46.602 44.199 443 HZ1 LYS 60 HZ1 LYS 60 19.906 46.831 43.227 444 HZ2 LYS 60 HZ2 LYS 60 20.911 47.278 42.277 445 HZ3 LYS 60 HZ3 LYS 60 20.285 45.977 42.114 446 H ASP 61 H ASP 61 26.773 41.261 43.499 447 HA ASP 61 HA ASP 61 26.378 40.753 46.122 448 HB2 ASP 61 HB2 ASP 61 24.438 39.997 44.903 449 HB3 ASP 61 HB3 ASP 61 25.354 38.949 44.200 450 H GLU 62 H GLU 62 28.286 40.069 46.964 451 HA GLU 62 HA GLU 62 30.401 39.387 45.753 452 HB2 GLU 62 HB2 GLU 62 29.941 38.580 48.440 453 HB3 GLU 62 HB3 GLU 62 31.336 38.912 47.827 454 HG2 GLU 62 HG2 GLU 62 30.961 40.672 49.170 455 HG3 GLU 62 HG3 GLU 62 30.596 41.246 47.768 456 H ASP 63 H ASP 63 28.006 37.178 46.904 457 HA ASP 63 HA ASP 63 29.299 34.893 46.672 458 HB2 ASP 63 HB2 ASP 63 27.353 35.214 48.069 459 HB3 ASP 63 HB3 ASP 63 26.479 35.213 46.778 460 H ALA 64 H ALA 64 27.277 36.535 44.443 461 HA ALA 64 HA ALA 64 27.201 34.806 42.438 462 HB1 ALA 64 HB1 ALA 64 26.169 36.600 41.320 463 HB2 ALA 64 HB2 ALA 64 25.513 36.414 42.749 464 HB3 ALA 64 HB3 ALA 64 26.567 37.571 42.506 465 H VAL 65 H VAL 65 29.400 37.473 42.940 466 HA VAL 65 HA VAL 65 30.871 37.155 40.822 467 HB VAL 65 HB VAL 65 31.693 38.287 43.257 468 HG11 VAL 65 HG11 VAL 65 33.506 39.281 42.079 469 HG12 VAL 65 HG12 VAL 65 33.619 37.703 42.028 470 HG13 VAL 65 HG13 VAL 65 33.073 38.498 40.773 471 HG21 VAL 65 HG21 VAL 65 31.350 40.382 42.173 472 HG22 VAL 65 HG22 VAL 65 30.856 39.614 40.879 473 HG23 VAL 65 HG23 VAL 65 29.999 39.556 42.209 474 H LYS 66 H LYS 66 31.255 35.636 43.966 475 HA LYS 66 HA LYS 66 33.461 34.259 43.533 476 HB2 LYS 66 HB2 LYS 66 32.577 34.792 45.705 477 HB3 LYS 66 HB3 LYS 66 31.470 33.718 45.481 478 HG2 LYS 66 HG2 LYS 66 33.051 31.998 45.454 479 HG3 LYS 66 HG3 LYS 66 34.229 33.020 45.442 480 HD2 LYS 66 HD2 LYS 66 33.721 33.686 47.651 481 HD3 LYS 66 HD3 LYS 66 32.461 32.768 47.664 482 HE2 LYS 66 HE2 LYS 66 33.841 30.839 47.446 483 HE3 LYS 66 HE3 LYS 66 35.110 31.743 47.377 484 HZ1 LYS 66 HZ1 LYS 66 34.850 30.924 49.468 485 HZ2 LYS 66 HZ2 LYS 66 34.717 32.370 49.530 486 HZ3 LYS 66 HZ3 LYS 66 33.534 31.528 49.594 487 H ALA 67 H ALA 67 30.230 33.182 42.971 488 HA ALA 67 HA ALA 67 30.768 30.827 41.949 489 HB1 ALA 67 HB1 ALA 67 28.478 30.934 41.237 490 HB2 ALA 67 HB2 ALA 67 28.591 31.375 42.754 491 HB3 ALA 67 HB3 ALA 67 28.445 32.471 41.621 492 H GLY 68 H GLY 68 30.631 33.871 40.318 493 HA2 GLY 68 HA2 GLY 68 30.872 33.146 37.827 494 HA3 GLY 68 HA3 GLY 68 31.193 34.563 38.393 495 H ILE 69 H ILE 69 33.438 34.034 40.044 496 HA ILE 69 HA ILE 69 35.545 33.710 38.541 497 HB ILE 69 HB ILE 69 35.245 33.756 41.303 498 HG12 ILE 69 HG12 ILE 69 35.118 35.854 40.184 499 HG13 ILE 69 HG13 ILE 69 36.242 35.849 41.266 500 HG21 ILE 69 HG21 ILE 69 37.571 33.756 41.668 501 HG22 ILE 69 HG22 ILE 69 37.071 32.371 41.083 502 HG23 ILE 69 HG23 ILE 69 37.793 33.418 40.137 503 HD11 ILE 69 HD11 ILE 69 37.027 36.920 39.332 504 HD12 ILE 69 HD12 ILE 69 37.885 35.612 39.576 505 HD13 ILE 69 HD13 ILE 69 36.744 35.617 38.477 506 H LYS 70 H LYS 70 34.000 31.282 40.543 507 HA LYS 70 HA LYS 70 35.470 29.201 39.948 508 HB2 LYS 70 HB2 LYS 70 33.974 29.175 41.763 509 HB3 LYS 70 HB3 LYS 70 32.762 29.223 40.781 510 HG2 LYS 70 HG2 LYS 70 33.274 27.082 39.965 511 HG3 LYS 70 HG3 LYS 70 34.593 27.043 40.796 512 HD2 LYS 70 HD2 LYS 70 33.323 27.002 42.826 513 HD3 LYS 70 HD3 LYS 70 31.999 27.064 42.004 514 HE2 LYS 70 HE2 LYS 70 32.621 24.993 40.929 515 HE3 LYS 70 HE3 LYS 70 33.867 24.916 41.863 516 HZ1 LYS 70 HZ1 LYS 70 32.181 23.655 42.707 517 HZ2 LYS 70 HZ2 LYS 70 32.453 24.730 43.647 518 HZ3 LYS 70 HZ3 LYS 70 31.292 24.802 42.776 519 H ALA 71 H ALA 71 32.614 30.228 38.233 520 HA ALA 71 HA ALA 71 32.486 28.418 36.390 521 HB1 ALA 71 HB1 ALA 71 31.114 30.025 35.257 522 HB2 ALA 71 HB2 ALA 71 30.719 29.968 36.790 523 HB3 ALA 71 HB3 ALA 71 31.631 31.145 36.250 524 H LEU 72 H LEU 72 34.291 31.323 36.282 525 HA LEU 72 HA LEU 72 35.257 31.279 33.803 526 HB2 LEU 72 HB2 LEU 72 34.858 33.266 35.038 527 HB3 LEU 72 HB3 LEU 72 35.895 32.816 36.113 528 HG LEU 72 HG LEU 72 37.637 33.126 34.622 529 HD11 LEU 72 HD11 LEU 72 37.324 34.078 32.500 530 HD12 LEU 72 HD12 LEU 72 36.614 32.666 32.586 531 HD13 LEU 72 HD13 LEU 72 35.756 33.992 32.700 532 HD21 LEU 72 HD21 LEU 72 37.494 35.521 34.439 533 HD22 LEU 72 HD22 LEU 72 35.937 35.430 34.716 534 HD23 LEU 72 HD23 LEU 72 36.968 35.055 35.858 535 H GLN 73 H GLN 73 36.748 30.207 36.759 536 HA GLN 73 HA GLN 73 39.018 29.409 35.660 537 HB2 GLN 73 HB2 GLN 73 38.619 29.943 38.037 538 HB3 GLN 73 HB3 GLN 73 38.085 28.483 38.160 539 HG2 GLN 73 HG2 GLN 73 40.340 28.504 38.814 540 HG3 GLN 73 HG3 GLN 73 40.211 27.633 37.527 541 HE21 GLN 73 HE21 GLN 73 41.893 28.033 36.096 542 HE22 GLN 73 HE22 GLN 73 42.518 29.359 35.832 543 H GLU 74 H GLU 74 36.113 27.590 36.220 544 HA GLU 74 HA GLU 74 36.908 25.252 35.312 545 HB2 GLU 74 HB2 GLU 74 34.298 26.252 35.796 546 HB3 GLU 74 HB3 GLU 74 34.508 24.803 35.256 547 HG2 GLU 74 HG2 GLU 74 35.803 24.306 37.216 548 HG3 GLU 74 HG3 GLU 74 35.469 25.728 37.764 549 H ALA 75 H ALA 75 36.019 27.972 33.521 550 HA ALA 75 HA ALA 75 35.925 26.718 31.132 551 HB1 ALA 75 HB1 ALA 75 35.149 28.865 30.364 552 HB2 ALA 75 HB2 ALA 75 34.245 28.364 31.565 553 HB3 ALA 75 HB3 ALA 75 35.371 29.448 31.820 554 H SER 76 H SER 76 38.494 27.775 32.781 555 HA SER 76 HA SER 76 39.727 29.431 31.274 556 HB2 SER 76 HB2 SER 76 41.654 28.956 32.640 557 HB3 SER 76 HB3 SER 76 40.395 29.131 33.543 558 HG SER 76 HG SER 76 40.351 27.079 33.897 559 H GLY 77 H GLY 77 39.913 26.018 30.880 560 HA2 GLY 77 HA2 GLY 77 41.951 25.795 29.246 561 HA3 GLY 77 HA3 GLY 77 40.841 24.721 29.456 562 H PHE 78 H PHE 78 38.539 26.007 28.456 563 HA PHE 78 HA PHE 78 38.657 26.059 25.874 564 HB2 PHE 78 HB2 PHE 78 36.633 27.194 27.513 565 HB3 PHE 78 HB3 PHE 78 36.464 27.002 25.975 566 HD1 PHE 78 HD1 PHE 78 36.386 25.273 29.033 567 HD2 PHE 78 HD2 PHE 78 36.037 24.766 25.038 568 HE1 PHE 78 HE1 PHE 78 35.538 23.136 29.390 569 HE2 PHE 78 HE2 PHE 78 35.140 22.635 25.395 570 HZ PHE 78 HZ PHE 78 34.901 21.820 27.566 571 H ILE 79 H ILE 79 38.775 28.784 28.050 572 HA ILE 79 HA ILE 79 38.779 30.759 26.324 573 HB ILE 79 HB ILE 79 39.599 30.749 29.030 574 HG12 ILE 79 HG12 ILE 79 37.140 31.799 28.050 575 HG13 ILE 79 HG13 ILE 79 37.228 30.315 28.519 576 HG21 ILE 79 HG21 ILE 79 39.473 33.108 29.009 577 HG22 ILE 79 HG22 ILE 79 40.584 32.609 27.996 578 HG23 ILE 79 HG23 ILE 79 39.169 33.074 27.454 579 HD11 ILE 79 HD11 ILE 79 36.348 31.629 30.257 580 HD12 ILE 79 HD12 ILE 79 37.736 31.026 30.721 581 HD13 ILE 79 HD13 ILE 79 37.647 32.534 30.244 582 H ARG 80 H ARG 80 41.570 29.229 27.783 583 HA ARG 80 HA ARG 80 43.482 30.434 26.430 584 HB2 ARG 80 HB2 ARG 80 43.893 29.335 28.466 585 HB3 ARG 80 HB3 ARG 80 43.441 27.975 27.853 586 HG2 ARG 80 HG2 ARG 80 45.659 29.060 26.578 587 HG3 ARG 80 HG3 ARG 80 45.931 28.670 28.063 588 HD2 ARG 80 HD2 ARG 80 44.939 26.804 26.154 589 HD3 ARG 80 HD3 ARG 80 46.448 26.882 26.542 590 HE ARG 80 HE ARG 80 45.604 26.353 28.772 591 HH11 ARG 80 HH11 ARG 80 44.577 24.786 29.858 592 HH12 ARG 80 HH12 ARG 80 43.975 23.630 29.135 593 HH21 ARG 80 HH21 ARG 80 44.541 24.663 26.128 594 HH22 ARG 80 HH22 ARG 80 43.954 23.556 26.935 595 H SER 81 H SER 81 41.800 27.562 25.516 596 HA SER 81 HA SER 81 43.148 26.912 23.401 597 HB2 SER 81 HB2 SER 81 41.531 25.461 24.415 598 HB3 SER 81 HB3 SER 81 40.391 26.364 23.853 599 HG SER 81 HG SER 81 40.787 24.679 22.511 600 H LEU 82 H LEU 82 40.330 28.971 23.502 601 HA LEU 82 HA LEU 82 40.225 29.656 20.975 602 HB2 LEU 82 HB2 LEU 82 39.007 30.826 23.257 603 HB3 LEU 82 HB3 LEU 82 38.732 31.386 21.827 604 HG LEU 82 HG LEU 82 37.988 28.797 22.674 605 HD11 LEU 82 HD11 LEU 82 35.750 29.667 22.551 606 HD12 LEU 82 HD12 LEU 82 36.600 30.522 23.576 607 HD13 LEU 82 HD13 LEU 82 36.338 31.071 22.115 608 HD21 LEU 82 HD21 LEU 82 36.807 28.548 20.666 609 HD22 LEU 82 HD22 LEU 82 37.355 29.950 20.172 610 HD23 LEU 82 HD23 LEU 82 38.352 28.736 20.375 611 H LEU 83 H LEU 83 41.834 31.294 23.579 612 HA LEU 83 HA LEU 83 42.664 33.465 22.365 613 HB2 LEU 83 HB2 LEU 83 42.652 33.186 24.725 614 HB3 LEU 83 HB3 LEU 83 43.774 32.111 24.604 615 HG LEU 83 HG LEU 83 45.267 33.802 23.839 616 HD11 LEU 83 HD11 LEU 83 44.690 36.056 24.063 617 HD12 LEU 83 HD12 LEU 83 43.750 35.353 23.001 618 HD13 LEU 83 HD13 LEU 83 43.216 35.639 24.464 619 HD21 LEU 83 HD21 LEU 83 45.585 34.776 25.986 620 HD22 LEU 83 HD22 LEU 83 44.136 34.297 26.409 621 HD23 LEU 83 HD23 LEU 83 45.274 33.230 26.137 622 H GLY 84 H GLY 84 44.432 30.492 22.696 623 HA2 GLY 84 HA2 GLY 84 46.559 31.017 21.284 624 HA3 GLY 84 HA3 GLY 84 46.037 29.582 21.603 625 H LYS 85 H LYS 85 43.531 29.743 20.153 626 HA LYS 85 HA LYS 85 44.117 29.328 17.601 627 HB2 LYS 85 HB2 LYS 85 42.364 28.170 18.697 628 HB3 LYS 85 HB3 LYS 85 41.597 29.512 18.909 629 HG2 LYS 85 HG2 LYS 85 41.307 29.719 16.543 630 HG3 LYS 85 HG3 LYS 85 42.069 28.376 16.333 631 HD2 LYS 85 HD2 LYS 85 40.381 27.189 17.473 632 HD3 LYS 85 HD3 LYS 85 39.650 28.518 17.833 633 HE2 LYS 85 HE2 LYS 85 39.169 28.891 15.539 634 HE3 LYS 85 HE3 LYS 85 39.934 27.587 15.156 635 HZ1 LYS 85 HZ1 LYS 85 37.700 27.173 15.280 636 HZ2 LYS 85 HZ2 LYS 85 38.361 26.390 16.310 637 HZ3 LYS 85 HZ3 LYS 85 37.648 27.606 16.666 638 H ALA 86 H ALA 86 42.583 32.082 19.006 639 HA ALA 86 HA ALA 86 42.086 33.479 16.877 640 HB1 ALA 86 HB1 ALA 86 41.778 35.255 18.409 641 HB2 ALA 86 HB2 ALA 86 41.055 33.951 18.942 642 HB3 ALA 86 HB3 ALA 86 42.453 34.385 19.547 643 H MET 87 H MET 87 44.964 33.520 18.800 644 HA MET 87 HA MET 87 46.320 35.169 17.180 645 HB2 MET 87 HB2 MET 87 47.107 34.090 19.685 646 HB3 MET 87 HB3 MET 87 47.975 35.116 18.894 647 HG2 MET 87 HG2 MET 87 46.141 36.692 19.106 648 HG3 MET 87 HG3 MET 87 45.458 35.680 20.074 649 HE1 MET 87 HE1 MET 87 46.290 38.423 22.474 650 HE2 MET 87 HE2 MET 87 45.760 38.554 20.988 651 HE3 MET 87 HE3 MET 87 45.142 37.463 21.956 652 H ARG 88 H ARG 88 45.873 32.081 16.689 653 HA ARG 88 HA ARG 88 46.820 30.426 15.763 654 HB2 ARG 88 HB2 ARG 88 48.075 32.378 14.143 655 HB3 ARG 88 HB3 ARG 88 47.805 30.902 13.715 656 HG2 ARG 88 HG2 ARG 88 45.439 31.351 13.818 657 HG3 ARG 88 HG3 ARG 88 45.765 32.845 14.127 658 HD2 ARG 88 HD2 ARG 88 45.307 32.819 11.893 659 HD3 ARG 88 HD3 ARG 88 46.857 32.963 11.963 660 HE ARG 88 HE ARG 88 46.539 30.431 11.784 661 HH11 ARG 88 HH11 ARG 88 46.500 29.155 10.038 662 HH12 ARG 88 HH12 ARG 88 46.090 29.686 8.708 663 HH21 ARG 88 HH21 ARG 88 45.481 32.729 9.618 664 HH22 ARG 88 HH22 ARG 88 45.488 31.794 8.458 665 H LEU 89 H LEU 89 48.056 30.427 18.093 666 HA LEU 89 HA LEU 89 50.667 31.248 17.965 667 HB2 LEU 89 HB2 LEU 89 48.820 32.349 19.318 668 HB3 LEU 89 HB3 LEU 89 49.066 31.175 20.315 669 HG LEU 89 HG LEU 89 51.305 31.957 20.602 670 HD11 LEU 89 HD11 LEU 89 51.826 34.149 19.872 671 HD12 LEU 89 HD12 LEU 89 51.518 33.229 18.621 672 HD13 LEU 89 HD13 LEU 89 50.421 34.240 19.150 673 HD21 LEU 89 HD21 LEU 89 50.666 33.773 22.012 674 HD22 LEU 89 HD22 LEU 89 49.263 33.836 21.280 675 HD23 LEU 89 HD23 LEU 89 49.632 32.584 22.176 676 H ARG 90 H ARG 90 52.432 30.036 18.744 677 HA ARG 90 HA ARG 90 51.944 27.453 19.330 678 HB2 ARG 90 HB2 ARG 90 54.346 28.536 18.270 679 HB3 ARG 90 HB3 ARG 90 54.207 27.026 18.634 680 HG2 ARG 90 HG2 ARG 90 52.306 26.970 17.064 681 HG3 ARG 90 HG3 ARG 90 52.787 28.369 16.570 682 HD2 ARG 90 HD2 ARG 90 54.833 27.412 15.836 683 HD3 ARG 90 HD3 ARG 90 54.362 26.013 16.341 684 HE ARG 90 HE ARG 90 52.929 27.287 14.364 685 HH11 ARG 90 HH11 ARG 90 51.992 26.053 12.780 686 HH12 ARG 90 HH12 ARG 90 52.502 24.681 12.500 687 HH21 ARG 90 HH21 ARG 90 54.659 24.524 14.898 688 HH22 ARG 90 HH22 ARG 90 54.075 23.777 13.749 689 H ILE 91 H ILE 91 52.998 29.994 21.179 690 HA ILE 91 HA ILE 91 52.895 28.380 23.348 691 HB ILE 91 HB ILE 91 54.366 29.989 24.430 692 HG12 ILE 91 HG12 ILE 91 55.491 30.383 21.880 693 HG13 ILE 91 HG13 ILE 91 54.545 31.442 22.525 694 HG21 ILE 91 HG21 ILE 91 56.275 28.631 23.918 695 HG22 ILE 91 HG22 ILE 91 55.001 27.726 24.177 696 HG23 ILE 91 HG23 ILE 91 55.481 28.013 22.695 697 HD11 ILE 91 HD11 ILE 91 56.769 32.090 22.841 698 HD12 ILE 91 HD12 ILE 91 56.110 31.806 24.254 699 HD13 ILE 91 HD13 ILE 91 57.071 30.732 23.599 700 H VAL 92 H VAL 92 50.879 28.860 24.248 701 HA VAL 92 HA VAL 92 50.136 31.408 24.848 702 HB VAL 92 HB VAL 92 48.692 30.375 23.407 703 HG11 VAL 92 HG11 VAL 92 47.154 28.707 24.146 704 HG12 VAL 92 HG12 VAL 92 48.639 28.158 24.112 705 HG13 VAL 92 HG13 VAL 92 47.982 28.580 25.491 706 HG21 VAL 92 HG21 VAL 92 46.649 30.990 24.489 707 HG22 VAL 92 HG22 VAL 92 47.441 31.086 25.858 708 HG23 VAL 92 HG23 VAL 92 47.766 32.097 24.683 709 HA PRO 93 HA PRO 93 50.613 30.195 29.024 710 HB2 PRO 93 HB2 PRO 93 49.914 32.323 30.345 711 HB3 PRO 93 HB3 PRO 93 51.288 32.305 29.607 712 HG2 PRO 93 HG2 PRO 93 48.908 33.539 28.701 713 HG3 PRO 93 HG3 PRO 93 50.359 34.075 28.513 714 HD2 PRO 93 HD2 PRO 93 49.128 32.828 26.585 715 HD3 PRO 93 HD3 PRO 93 50.685 32.873 26.650 716 H GLU 94 H GLU 94 49.496 29.268 30.752 717 HA GLU 94 HA GLU 94 46.888 28.759 30.598 718 HB2 GLU 94 HB2 GLU 94 48.623 27.195 31.349 719 HB3 GLU 94 HB3 GLU 94 48.654 27.999 32.685 720 HG2 GLU 94 HG2 GLU 94 47.309 26.271 33.196 721 HG3 GLU 94 HG3 GLU 94 46.285 27.414 32.925 722 H LEU 95 H LEU 95 45.185 29.676 31.848 723 HA LEU 95 HA LEU 95 45.761 32.101 32.896 724 HB2 LEU 95 HB2 LEU 95 43.255 31.316 31.791 725 HB3 LEU 95 HB3 LEU 95 43.683 32.787 32.081 726 HG LEU 95 HG LEU 95 44.772 31.215 30.021 727 HD11 LEU 95 HD11 LEU 95 43.577 32.643 28.517 728 HD12 LEU 95 HD12 LEU 95 42.569 31.891 29.480 729 HD13 LEU 95 HD13 LEU 95 42.955 33.401 29.760 730 HD21 LEU 95 HD21 LEU 95 45.835 33.151 29.203 731 HD22 LEU 95 HD22 LEU 95 45.303 33.959 30.456 732 HD23 LEU 95 HD23 LEU 95 46.358 32.796 30.654 733 H THR 96 H THR 96 45.654 32.358 35.125 734 HA THR 96 HA THR 96 43.568 31.297 36.500 735 HB THR 96 HB THR 96 45.829 32.478 37.593 736 HG1 THR 96 HG1 THR 96 46.201 30.348 38.255 737 HG21 THR 96 HG21 THR 96 45.080 31.682 39.723 738 HG22 THR 96 HG22 THR 96 44.030 32.705 39.122 739 HG23 THR 96 HG23 THR 96 43.755 31.148 39.041 740 H PHE 97 H PHE 97 41.906 32.666 37.335 741 HA PHE 97 HA PHE 97 41.895 35.278 36.594 742 HB2 PHE 97 HB2 PHE 97 39.689 33.514 36.784 743 HB3 PHE 97 HB3 PHE 97 39.525 35.032 36.463 744 HD1 PHE 97 HD1 PHE 97 40.096 35.901 34.230 745 HD2 PHE 97 HD2 PHE 97 40.548 31.964 35.039 746 HE1 PHE 97 HE1 PHE 97 40.370 35.462 31.948 747 HE2 PHE 97 HE2 PHE 97 40.821 31.525 32.770 748 HZ PHE 97 HZ PHE 97 40.733 33.273 31.217 749 H PHE 98 H PHE 98 41.107 36.943 37.854 750 HA PHE 98 HA PHE 98 40.909 36.745 40.550 751 HB2 PHE 98 HB2 PHE 98 42.781 38.426 39.218 752 HB3 PHE 98 HB3 PHE 98 42.554 38.444 40.760 753 HD1 PHE 98 HD1 PHE 98 43.724 36.870 42.190 754 HD2 PHE 98 HD2 PHE 98 44.026 36.506 38.171 755 HE1 PHE 98 HE1 PHE 98 45.332 35.193 42.459 756 HE2 PHE 98 HE2 PHE 98 45.633 34.843 38.454 757 HZ PHE 98 HZ PHE 98 46.279 34.168 40.587 758 H TYR 99 H TYR 99 39.685 38.583 41.528 759 HA TYR 99 HA TYR 99 38.220 40.049 39.795 760 HB2 TYR 99 HB2 TYR 99 36.473 40.108 41.207 761 HB3 TYR 99 HB3 TYR 99 36.938 38.620 41.154 762 HD1 TYR 99 HD1 TYR 99 36.286 41.217 43.334 763 HD2 TYR 99 HD2 TYR 99 38.297 37.721 43.098 764 HE1 TYR 99 HE1 TYR 99 36.520 41.192 45.651 765 HE2 TYR 99 HE2 TYR 99 38.640 37.746 45.399 766 HH TYR 99 HH TYR 99 38.252 38.809 47.349 767 H ASP 100 H ASP 100 38.037 42.294 39.841 768 HA ASP 100 HA ASP 100 39.430 43.849 41.606 769 HB2 ASP 100 HB2 ASP 100 40.710 43.492 39.624 770 HB3 ASP 100 HB3 ASP 100 39.542 44.089 38.781 Start of MODEL 11 1 HA PRO 8 HA PRO 8 56.268 44.641 25.696 2 HB2 PRO 8 HB2 PRO 8 55.418 42.228 25.739 3 HB3 PRO 8 HB3 PRO 8 56.931 42.481 25.452 4 HG2 PRO 8 HG2 PRO 8 55.797 41.738 27.952 5 HG3 PRO 8 HG3 PRO 8 57.105 41.163 27.327 6 HD2 PRO 8 HD2 PRO 8 57.257 43.036 29.106 7 HD3 PRO 8 HD3 PRO 8 58.350 42.933 27.998 8 H GLN 9 H GLN 9 55.062 46.315 27.291 9 HA GLN 9 HA GLN 9 52.691 45.785 28.261 10 HB2 GLN 9 HB2 GLN 9 54.092 47.631 28.942 11 HB3 GLN 9 HB3 GLN 9 53.842 48.310 27.561 12 HG2 GLN 9 HG2 GLN 9 51.624 47.796 29.233 13 HG3 GLN 9 HG3 GLN 9 52.485 49.066 29.512 14 HE21 GLN 9 HE21 GLN 9 49.829 49.318 28.902 15 HE22 GLN 9 HE22 GLN 9 49.655 50.031 27.606 16 H ARG 10 H ARG 10 53.435 46.885 25.050 17 HA ARG 10 HA ARG 10 51.012 47.474 24.246 18 HB2 ARG 10 HB2 ARG 10 53.231 46.788 22.635 19 HB3 ARG 10 HB3 ARG 10 51.911 47.390 22.063 20 HG2 ARG 10 HG2 ARG 10 52.307 49.402 23.286 21 HG3 ARG 10 HG3 ARG 10 53.636 48.799 23.836 22 HD2 ARG 10 HD2 ARG 10 53.213 49.355 21.082 23 HD3 ARG 10 HD3 ARG 10 54.038 50.287 22.021 24 HE ARG 10 HE ARG 10 55.030 47.785 21.856 25 HH11 ARG 10 HH11 ARG 10 57.007 47.362 20.980 26 HH12 ARG 10 HH12 ARG 10 57.742 48.423 20.236 27 HH21 ARG 10 HH21 ARG 10 55.595 50.774 20.507 28 HH22 ARG 10 HH22 ARG 10 56.928 50.392 19.962 29 H VAL 11 H VAL 11 52.663 44.455 24.111 30 HA VAL 11 HA VAL 11 50.817 42.988 22.949 31 HB VAL 11 HB VAL 11 52.964 42.005 24.476 32 HG11 VAL 11 HG11 VAL 11 52.732 40.025 23.169 33 HG12 VAL 11 HG12 VAL 11 51.388 40.325 23.952 34 HG13 VAL 11 HG13 VAL 11 51.505 40.687 22.414 35 HG21 VAL 11 HG21 VAL 11 54.207 41.804 22.451 36 HG22 VAL 11 HG22 VAL 11 53.021 42.501 21.668 37 HG23 VAL 11 HG23 VAL 11 53.859 43.322 22.731 38 H ALA 12 H ALA 12 51.393 43.547 26.340 39 HA ALA 12 HA ALA 12 49.596 42.000 27.414 40 HB1 ALA 12 HB1 ALA 12 49.871 43.393 29.309 41 HB2 ALA 12 HB2 ALA 12 51.285 43.014 28.703 42 HB3 ALA 12 HB3 ALA 12 50.657 44.440 28.417 43 H GLN 13 H GLN 13 49.008 45.133 26.043 44 HA GLN 13 HA GLN 13 46.424 45.229 26.582 45 HB2 GLN 13 HB2 GLN 13 47.969 46.782 24.786 46 HB3 GLN 13 HB3 GLN 13 46.434 47.017 24.922 47 HG2 GLN 13 HG2 GLN 13 48.213 47.302 27.120 48 HG3 GLN 13 HG3 GLN 13 47.736 48.522 26.274 49 HE21 GLN 13 HE21 GLN 13 47.241 48.117 29.090 50 HE22 GLN 13 HE22 GLN 13 45.768 48.121 29.313 51 H GLU 14 H GLU 14 47.977 43.880 23.770 52 HA GLU 14 HA GLU 14 45.849 43.300 22.379 53 HB2 GLU 14 HB2 GLU 14 48.374 41.991 22.209 54 HB3 GLU 14 HB3 GLU 14 47.258 41.843 21.131 55 HG2 GLU 14 HG2 GLU 14 47.471 44.287 20.829 56 HG3 GLU 14 HG3 GLU 14 48.813 44.153 21.612 57 H MET 15 H MET 15 47.425 41.404 24.818 58 HA MET 15 HA MET 15 46.014 39.232 24.836 59 HB2 MET 15 HB2 MET 15 47.662 40.440 26.778 60 HB3 MET 15 HB3 MET 15 46.803 39.214 27.214 61 HG2 MET 15 HG2 MET 15 48.567 38.991 25.019 62 HG3 MET 15 HG3 MET 15 49.091 38.736 26.464 63 HE1 MET 15 HE1 MET 15 49.116 35.256 24.961 64 HE2 MET 15 HE2 MET 15 49.449 36.617 24.222 65 HE3 MET 15 HE3 MET 15 50.009 36.350 25.678 66 H GLN 16 H GLN 16 45.413 42.124 26.766 67 HA GLN 16 HA GLN 16 43.251 41.406 27.972 68 HB2 GLN 16 HB2 GLN 16 44.213 43.994 27.330 69 HB3 GLN 16 HB3 GLN 16 42.848 43.850 28.070 70 HG2 GLN 16 HG2 GLN 16 43.859 42.945 29.952 71 HG3 GLN 16 HG3 GLN 16 45.199 42.706 29.193 72 HE21 GLN 16 HE21 GLN 16 46.689 44.441 29.027 73 HE22 GLN 16 HE22 GLN 16 46.490 45.773 29.664 74 H LYS 17 H LYS 17 43.437 43.001 24.884 75 HA LYS 17 HA LYS 17 40.938 43.324 24.270 76 HB2 LYS 17 HB2 LYS 17 42.754 44.354 23.105 77 HB3 LYS 17 HB3 LYS 17 43.111 42.975 22.470 78 HG2 LYS 17 HG2 LYS 17 41.028 42.960 21.320 79 HG3 LYS 17 HG3 LYS 17 40.659 44.331 21.963 80 HD2 LYS 17 HD2 LYS 17 42.527 45.335 20.813 81 HD3 LYS 17 HD3 LYS 17 42.801 43.968 20.114 82 HE2 LYS 17 HE2 LYS 17 40.682 44.046 19.073 83 HE3 LYS 17 HE3 LYS 17 40.348 45.376 19.817 84 HZ1 LYS 17 HZ1 LYS 17 41.034 45.819 17.698 85 HZ2 LYS 17 HZ2 LYS 17 42.000 46.402 18.613 86 HZ3 LYS 17 HZ3 LYS 17 42.312 45.163 17.920 87 H GLU 18 H GLU 18 42.857 40.540 23.401 88 HA GLU 18 HA GLU 18 40.941 39.260 22.130 89 HB2 GLU 18 HB2 GLU 18 43.452 38.984 21.988 90 HB3 GLU 18 HB3 GLU 18 43.195 37.867 23.046 91 HG2 GLU 18 HG2 GLU 18 43.162 36.787 21.021 92 HG3 GLU 18 HG3 GLU 18 41.671 36.828 21.478 93 H ILE 19 H ILE 19 42.115 38.790 25.388 94 HA ILE 19 HA ILE 19 40.668 36.740 26.119 95 HB ILE 19 HB ILE 19 41.967 38.675 27.701 96 HG12 ILE 19 HG12 ILE 19 42.702 35.932 27.285 97 HG13 ILE 19 HG13 ILE 19 43.306 37.067 26.403 98 HG21 ILE 19 HG21 ILE 19 41.674 37.327 29.598 99 HG22 ILE 19 HG22 ILE 19 40.274 37.822 29.048 100 HG23 ILE 19 HG23 ILE 19 40.763 36.344 28.755 101 HD11 ILE 19 HD11 ILE 19 44.857 36.456 28.057 102 HD12 ILE 19 HD12 ILE 19 44.420 37.960 28.293 103 HD13 ILE 19 HD13 ILE 19 43.806 36.807 29.188 104 H ALA 20 H ALA 20 39.847 40.126 26.438 105 HA ALA 20 HA ALA 20 37.543 39.931 27.604 106 HB1 ALA 20 HB1 ALA 20 37.229 42.151 26.821 107 HB2 ALA 20 HB2 ALA 20 38.682 41.991 27.429 108 HB3 ALA 20 HB3 ALA 20 38.476 41.979 25.859 109 H LEU 21 H LEU 21 38.110 39.678 24.184 110 HA LEU 21 HA LEU 21 35.603 39.318 23.458 111 HB2 LEU 21 HB2 LEU 21 37.221 40.117 21.926 112 HB3 LEU 21 HB3 LEU 21 37.937 38.731 21.963 113 HG LEU 21 HG LEU 21 36.113 37.713 20.968 114 HD11 LEU 21 HD11 LEU 21 34.273 38.917 20.107 115 HD12 LEU 21 HD12 LEU 21 34.322 39.020 21.686 116 HD13 LEU 21 HD13 LEU 21 34.825 40.230 20.798 117 HD21 LEU 21 HD21 LEU 21 36.268 38.751 18.798 118 HD22 LEU 21 HD22 LEU 21 36.917 40.024 19.481 119 HD23 LEU 21 HD23 LEU 21 37.703 38.650 19.461 120 H ILE 22 H ILE 22 38.004 36.807 24.108 121 HA ILE 22 HA ILE 22 36.539 34.758 23.491 122 HB ILE 22 HB ILE 22 38.641 34.704 25.321 123 HG12 ILE 22 HG12 ILE 22 39.708 35.362 23.476 124 HG13 ILE 22 HG13 ILE 22 40.013 33.834 23.557 125 HG21 ILE 22 HG21 ILE 22 38.747 32.334 24.804 126 HG22 ILE 22 HG22 ILE 22 37.336 32.704 25.423 127 HG23 ILE 22 HG23 ILE 22 37.489 32.515 23.858 128 HD11 ILE 22 HD11 ILE 22 39.562 34.423 21.348 129 HD12 ILE 22 HD12 ILE 22 38.446 33.419 21.851 130 HD13 ILE 22 HD13 ILE 22 38.136 34.970 21.769 131 H LEU 23 H LEU 23 36.675 36.355 26.593 132 HA LEU 23 HA LEU 23 34.978 34.931 27.961 133 HB2 LEU 23 HB2 LEU 23 36.063 37.490 28.291 134 HB3 LEU 23 HB3 LEU 23 34.736 37.243 29.071 135 HG LEU 23 HG LEU 23 35.721 35.461 30.213 136 HD11 LEU 23 HD11 LEU 23 38.020 35.031 30.161 137 HD12 LEU 23 HD12 LEU 23 37.347 34.718 28.762 138 HD13 LEU 23 HD13 LEU 23 38.173 36.055 28.964 139 HD21 LEU 23 HD21 LEU 23 37.200 36.769 31.593 140 HD22 LEU 23 HD22 LEU 23 37.247 37.869 30.455 141 HD23 LEU 23 HD23 LEU 23 35.898 37.597 31.237 142 H GLN 24 H GLN 24 34.170 37.538 25.791 143 HA GLN 24 HA GLN 24 31.565 37.502 26.159 144 HB2 GLN 24 HB2 GLN 24 33.175 38.773 24.180 145 HB3 GLN 24 HB3 GLN 24 31.621 38.885 24.102 146 HG2 GLN 24 HG2 GLN 24 31.549 39.992 26.160 147 HG3 GLN 24 HG3 GLN 24 33.079 39.776 26.366 148 HE21 GLN 24 HE21 GLN 24 32.745 42.233 26.729 149 HE22 GLN 24 HE22 GLN 24 32.975 43.120 25.554 150 H ARG 25 H ARG 25 33.428 35.496 24.175 151 HA ARG 25 HA ARG 25 31.476 34.644 22.559 152 HB2 ARG 25 HB2 ARG 25 34.230 33.899 22.693 153 HB3 ARG 25 HB3 ARG 25 33.271 33.267 21.638 154 HG2 ARG 25 HG2 ARG 25 33.765 36.052 21.653 155 HG3 ARG 25 HG3 ARG 25 34.675 35.087 20.832 156 HD2 ARG 25 HD2 ARG 25 31.894 35.295 20.303 157 HD3 ARG 25 HD3 ARG 25 32.935 36.168 19.536 158 HE ARG 25 HE ARG 25 33.414 33.522 19.260 159 HH11 ARG 25 HH11 ARG 25 33.414 32.651 17.223 160 HH12 ARG 25 HH12 ARG 25 32.650 33.302 16.123 161 HH21 ARG 25 HH21 ARG 25 31.608 35.864 17.749 162 HH22 ARG 25 HH22 ARG 25 31.597 35.175 16.429 163 H GLU 26 H GLU 26 33.217 33.082 25.131 164 HA GLU 26 HA GLU 26 32.046 30.683 24.769 165 HB2 GLU 26 HB2 GLU 26 34.377 30.793 25.133 166 HB3 GLU 26 HB3 GLU 26 34.135 31.434 26.533 167 HG2 GLU 26 HG2 GLU 26 34.745 29.195 26.794 168 HG3 GLU 26 HG3 GLU 26 33.311 29.411 27.367 169 H ILE 27 H ILE 27 31.570 33.121 27.121 170 HA ILE 27 HA ILE 27 29.547 31.751 28.272 171 HB ILE 27 HB ILE 27 30.028 32.685 30.372 172 HG12 ILE 27 HG12 ILE 27 32.547 33.458 29.391 173 HG13 ILE 27 HG13 ILE 27 31.402 34.467 29.712 174 HG21 ILE 27 HG21 ILE 27 31.717 31.098 30.922 175 HG22 ILE 27 HG22 ILE 27 30.623 30.442 29.983 176 HG23 ILE 27 HG23 ILE 27 32.013 30.900 29.378 177 HD11 ILE 27 HD11 ILE 27 32.931 34.434 31.488 178 HD12 ILE 27 HD12 ILE 27 31.531 33.905 32.005 179 HD13 ILE 27 HD13 ILE 27 32.694 32.880 31.680 180 H LYS 28 H LYS 28 27.678 33.040 29.054 181 HA LYS 28 HA LYS 28 27.190 35.327 27.694 182 HB2 LYS 28 HB2 LYS 28 25.358 33.635 29.029 183 HB3 LYS 28 HB3 LYS 28 24.929 34.903 28.229 184 HG2 LYS 28 HG2 LYS 28 26.016 32.561 27.055 185 HG3 LYS 28 HG3 LYS 28 24.522 32.995 26.939 186 HD2 LYS 28 HD2 LYS 28 25.254 34.938 25.684 187 HD3 LYS 28 HD3 LYS 28 26.697 34.346 25.694 188 HE2 LYS 28 HE2 LYS 28 25.843 32.418 24.502 189 HE3 LYS 28 HE3 LYS 28 24.472 33.151 24.384 190 HZ1 LYS 28 HZ1 LYS 28 25.706 33.499 22.512 191 HZ2 LYS 28 HZ2 LYS 28 25.508 34.780 23.167 192 HZ3 LYS 28 HZ3 LYS 28 26.786 34.098 23.278 193 H ASP 29 H ASP 29 27.593 37.307 28.629 194 HA ASP 29 HA ASP 29 28.002 37.572 31.180 195 HB2 ASP 29 HB2 ASP 29 29.053 38.882 29.326 196 HB3 ASP 29 HB3 ASP 29 27.825 39.832 29.476 197 HA PRO 30 HA PRO 30 23.743 39.579 31.573 198 HB2 PRO 30 HB2 PRO 30 22.393 37.377 30.377 199 HB3 PRO 30 HB3 PRO 30 21.854 38.835 30.486 200 HG2 PRO 30 HG2 PRO 30 22.826 38.183 28.233 201 HG3 PRO 30 HG3 PRO 30 23.238 39.589 28.765 202 HD2 PRO 30 HD2 PRO 30 24.786 37.207 28.930 203 HD3 PRO 30 HD3 PRO 30 25.321 38.628 28.575 204 H ARG 31 H ARG 31 24.794 36.396 32.174 205 HA ARG 31 HA ARG 31 23.572 35.871 34.420 206 HB2 ARG 31 HB2 ARG 31 26.082 34.931 33.464 207 HB3 ARG 31 HB3 ARG 31 25.411 34.332 34.737 208 HG2 ARG 31 HG2 ARG 31 23.705 33.379 33.502 209 HG3 ARG 31 HG3 ARG 31 24.075 34.208 32.235 210 HD2 ARG 31 HD2 ARG 31 24.808 31.995 31.955 211 HD3 ARG 31 HD3 ARG 31 26.040 32.951 31.942 212 HE ARG 31 HE ARG 31 25.600 31.939 34.389 213 HH11 ARG 31 HH11 ARG 31 27.037 30.504 35.333 214 HH12 ARG 31 HH12 ARG 31 28.065 29.827 34.494 215 HH21 ARG 31 HH21 ARG 31 27.277 31.094 31.659 216 HH22 ARG 31 HH22 ARG 31 28.203 30.169 32.371 217 H LEU 32 H LEU 32 26.352 37.809 33.956 218 HA LEU 32 HA LEU 32 26.619 38.569 36.549 219 HB2 LEU 32 HB2 LEU 32 28.505 38.773 34.437 220 HB3 LEU 32 HB3 LEU 32 28.792 39.270 35.887 221 HG LEU 32 HG LEU 32 28.434 36.540 35.234 222 HD11 LEU 32 HD11 LEU 32 30.778 36.319 35.558 223 HD12 LEU 32 HD12 LEU 32 30.485 37.339 34.382 224 HD13 LEU 32 HD13 LEU 32 30.877 37.878 35.819 225 HD21 LEU 32 HD21 LEU 32 29.185 36.028 37.398 226 HD22 LEU 32 HD22 LEU 32 29.264 37.574 37.732 227 HD23 LEU 32 HD23 LEU 32 27.860 36.892 37.465 228 H GLY 33 H GLY 33 24.719 39.758 34.401 229 HA2 GLY 33 HA2 GLY 33 23.633 41.619 34.432 230 HA3 GLY 33 HA3 GLY 33 24.764 42.270 35.287 231 H MET 34 H MET 34 25.961 40.985 32.412 232 HA MET 34 HA MET 34 26.738 41.722 30.566 233 HB2 MET 34 HB2 MET 34 24.358 41.691 30.209 234 HB3 MET 34 HB3 MET 34 24.359 43.231 30.453 235 HG2 MET 34 HG2 MET 34 24.255 42.882 28.186 236 HG3 MET 34 HG3 MET 34 25.628 43.551 28.500 237 HE1 MET 34 HE1 MET 34 28.224 41.482 27.143 238 HE2 MET 34 HE2 MET 34 27.611 42.942 27.127 239 HE3 MET 34 HE3 MET 34 27.983 42.255 28.505 240 H MET 35 H MET 35 27.974 42.994 32.683 241 HA MET 35 HA MET 35 29.288 44.994 31.510 242 HB2 MET 35 HB2 MET 35 27.393 46.085 32.512 243 HB3 MET 35 HB3 MET 35 27.990 45.702 33.901 244 HG2 MET 35 HG2 MET 35 28.592 47.884 33.454 245 HG3 MET 35 HG3 MET 35 29.892 47.024 33.455 246 HE1 MET 35 HE1 MET 35 30.921 49.590 30.943 247 HE2 MET 35 HE2 MET 35 30.141 49.794 32.307 248 HE3 MET 35 HE3 MET 35 31.364 48.789 32.236 249 H THR 36 H THR 36 30.300 42.506 32.174 250 HA THR 36 HA THR 36 32.098 42.861 34.171 251 HB THR 36 HB THR 36 31.912 40.563 32.589 252 HG1 THR 36 HG1 THR 36 30.155 40.157 33.573 253 HG21 THR 36 HG21 THR 36 32.880 39.434 34.440 254 HG22 THR 36 HG22 THR 36 33.829 40.603 33.950 255 HG23 THR 36 HG23 THR 36 32.924 40.802 35.235 256 H THR 37 H THR 37 34.355 43.345 33.719 257 HA THR 37 HA THR 37 35.155 43.680 31.141 258 HB THR 37 HB THR 37 35.536 45.642 33.101 259 HG1 THR 37 HG1 THR 37 33.949 46.818 32.018 260 HG21 THR 37 HG21 THR 37 36.086 47.153 31.346 261 HG22 THR 37 HG22 THR 37 37.078 45.919 31.366 262 HG23 THR 37 HG23 THR 37 35.904 45.973 30.306 263 H VAL 38 H VAL 38 37.528 43.412 30.783 264 HA VAL 38 HA VAL 38 38.952 42.269 32.770 265 HB VAL 38 HB VAL 38 39.721 42.592 30.104 266 HG11 VAL 38 HG11 VAL 38 41.457 41.021 30.539 267 HG12 VAL 38 HG12 VAL 38 41.638 42.313 31.435 268 HG13 VAL 38 HG13 VAL 38 41.028 40.994 32.063 269 HG21 VAL 38 HG21 VAL 38 39.289 40.246 29.850 270 HG22 VAL 38 HG22 VAL 38 38.770 40.198 31.345 271 HG23 VAL 38 HG23 VAL 38 37.962 41.011 30.253 272 H SER 39 H SER 39 40.069 43.672 34.214 273 HA SER 39 HA SER 39 40.686 46.163 33.524 274 HB2 SER 39 HB2 SER 39 41.026 46.574 35.787 275 HB3 SER 39 HB3 SER 39 39.709 45.746 35.667 276 HG SER 39 HG SER 39 41.290 45.037 37.176 277 H GLY 40 H GLY 40 42.579 43.368 33.646 278 HA2 GLY 40 HA2 GLY 40 44.751 44.414 32.678 279 HA3 GLY 40 HA3 GLY 40 44.954 44.243 34.215 280 H VAL 41 H VAL 41 46.554 42.874 32.357 281 HA VAL 41 HA VAL 41 46.307 40.352 33.315 282 HB VAL 41 HB VAL 41 47.376 39.455 31.494 283 HG11 VAL 41 HG11 VAL 41 45.555 39.548 29.962 284 HG12 VAL 41 HG12 VAL 41 45.035 39.365 31.448 285 HG13 VAL 41 HG13 VAL 41 44.976 40.790 30.757 286 HG21 VAL 41 HG21 VAL 41 47.673 40.633 29.478 287 HG22 VAL 41 HG22 VAL 41 47.239 41.968 30.212 288 HG23 VAL 41 HG23 VAL 41 48.577 41.232 30.633 289 H GLU 42 H GLU 42 48.334 39.334 34.062 290 HA GLU 42 HA GLU 42 50.646 40.765 34.094 291 HB2 GLU 42 HB2 GLU 42 49.530 41.050 36.188 292 HB3 GLU 42 HB3 GLU 42 49.593 39.507 36.403 293 HG2 GLU 42 HG2 GLU 42 51.986 39.637 36.362 294 HG3 GLU 42 HG3 GLU 42 51.875 41.190 36.254 295 H MET 43 H MET 43 52.353 39.604 33.264 296 HA MET 43 HA MET 43 51.801 37.111 32.411 297 HB2 MET 43 HB2 MET 43 53.627 38.933 31.211 298 HB3 MET 43 HB3 MET 43 53.153 37.599 30.557 299 HG2 MET 43 HG2 MET 43 51.447 39.833 30.970 300 HG3 MET 43 HG3 MET 43 52.072 39.477 29.586 301 HE1 MET 43 HE1 MET 43 50.168 36.669 28.180 302 HE2 MET 43 HE2 MET 43 51.106 37.901 27.846 303 HE3 MET 43 HE3 MET 43 51.642 36.721 28.757 304 H SER 44 H SER 44 53.177 35.310 32.773 305 HA SER 44 HA SER 44 55.246 35.410 34.425 306 HB2 SER 44 HB2 SER 44 53.780 33.518 34.262 307 HB3 SER 44 HB3 SER 44 54.319 33.244 32.825 308 HG SER 44 HG SER 44 55.965 32.341 33.624 309 H ARG 45 H ARG 45 57.523 35.055 33.986 310 HA ARG 45 HA ARG 45 58.580 36.148 31.853 311 HB2 ARG 45 HB2 ARG 45 59.648 36.219 33.978 312 HB3 ARG 45 HB3 ARG 45 59.809 34.669 33.970 313 HG2 ARG 45 HG2 ARG 45 61.445 34.750 32.349 314 HG3 ARG 45 HG3 ARG 45 61.122 36.237 32.008 315 HD2 ARG 45 HD2 ARG 45 62.131 36.991 33.943 316 HD3 ARG 45 HD3 ARG 45 62.211 35.550 34.534 317 HE ARG 45 HE ARG 45 64.064 35.226 33.422 318 HH11 ARG 45 HH11 ARG 45 65.661 35.458 31.990 319 HH12 ARG 45 HH12 ARG 45 65.740 36.663 31.119 320 HH21 ARG 45 HH21 ARG 45 63.004 38.075 32.060 321 HH22 ARG 45 HH22 ARG 45 64.184 38.198 31.160 322 H ASP 46 H ASP 46 57.815 32.917 32.188 323 HA ASP 46 HA ASP 46 59.097 32.043 29.999 324 HB2 ASP 46 HB2 ASP 46 58.359 29.889 30.754 325 HB3 ASP 46 HB3 ASP 46 59.198 30.610 31.853 326 H LEU 47 H LEU 47 56.260 33.505 30.263 327 HA LEU 47 HA LEU 47 54.308 33.532 29.477 328 HB2 LEU 47 HB2 LEU 47 55.680 32.854 27.102 329 HB3 LEU 47 HB3 LEU 47 54.224 33.412 27.112 330 HG LEU 47 HG LEU 47 56.419 34.902 28.068 331 HD11 LEU 47 HD11 LEU 47 56.301 36.162 26.031 332 HD12 LEU 47 HD12 LEU 47 56.623 34.644 25.714 333 HD13 LEU 47 HD13 LEU 47 55.152 35.198 25.522 334 HD21 LEU 47 HD21 LEU 47 55.002 36.807 27.971 335 HD22 LEU 47 HD22 LEU 47 53.808 35.881 27.497 336 HD23 LEU 47 HD23 LEU 47 54.401 35.723 28.958 337 H ALA 48 H ALA 48 54.974 30.867 30.647 338 HA ALA 48 HA ALA 48 53.232 29.167 29.509 339 HB1 ALA 48 HB1 ALA 48 54.111 27.628 31.089 340 HB2 ALA 48 HB2 ALA 48 55.292 28.298 30.273 341 HB3 ALA 48 HB3 ALA 48 54.962 28.793 31.740 342 H TYR 49 H TYR 49 52.937 31.445 31.901 343 HA TYR 49 HA TYR 49 50.477 30.714 32.733 344 HB2 TYR 49 HB2 TYR 49 52.353 31.574 34.666 345 HB3 TYR 49 HB3 TYR 49 50.966 30.924 34.958 346 HD1 TYR 49 HD1 TYR 49 50.706 28.452 34.903 347 HD2 TYR 49 HD2 TYR 49 54.323 30.166 34.278 348 HE1 TYR 49 HE1 TYR 49 51.740 26.378 35.160 349 HE2 TYR 49 HE2 TYR 49 55.355 28.098 34.564 350 HH TYR 49 HH TYR 49 55.077 25.878 34.937 351 H ALA 50 H ALA 50 49.029 32.545 33.126 352 HA ALA 50 HA ALA 50 50.035 34.993 33.585 353 HB1 ALA 50 HB1 ALA 50 48.604 36.015 31.995 354 HB2 ALA 50 HB2 ALA 50 49.625 35.048 31.269 355 HB3 ALA 50 HB3 ALA 50 48.130 34.584 31.512 356 H LYS 51 H LYS 51 48.895 36.253 35.081 357 HA LYS 51 HA LYS 51 46.544 35.437 36.171 358 HB2 LYS 51 HB2 LYS 51 48.196 37.581 36.986 359 HB3 LYS 51 HB3 LYS 51 46.918 37.125 37.755 360 HG2 LYS 51 HG2 LYS 51 47.974 35.033 38.241 361 HG3 LYS 51 HG3 LYS 51 49.258 35.522 37.504 362 HD2 LYS 51 HD2 LYS 51 48.274 36.822 39.835 363 HD3 LYS 51 HD3 LYS 51 49.402 35.749 39.902 364 HE2 LYS 51 HE2 LYS 51 50.799 37.133 38.568 365 HE3 LYS 51 HE3 LYS 51 49.670 38.206 38.499 366 HZ1 LYS 51 HZ1 LYS 51 51.187 38.749 40.090 367 HZ2 LYS 51 HZ2 LYS 51 49.904 38.527 40.736 368 HZ3 LYS 51 HZ3 LYS 51 50.941 37.512 40.813 369 H VAL 52 H VAL 52 44.535 36.388 35.663 370 HA VAL 52 HA VAL 52 44.398 38.612 34.101 371 HB VAL 52 HB VAL 52 42.478 36.569 34.121 372 HG11 VAL 52 HG11 VAL 52 41.528 37.675 32.224 373 HG12 VAL 52 HG12 VAL 52 41.522 38.633 33.487 374 HG13 VAL 52 HG13 VAL 52 42.623 38.812 32.363 375 HG21 VAL 52 HG21 VAL 52 43.210 35.946 31.946 376 HG22 VAL 52 HG22 VAL 52 44.384 37.004 32.053 377 HG23 VAL 52 HG23 VAL 52 44.368 35.739 33.006 378 H TYR 53 H TYR 53 43.420 40.406 35.034 379 HA TYR 53 HA TYR 53 41.992 40.258 37.351 380 HB2 TYR 53 HB2 TYR 53 43.296 42.525 36.314 381 HB3 TYR 53 HB3 TYR 53 42.638 42.428 37.724 382 HD1 TYR 53 HD1 TYR 53 43.703 40.160 38.986 383 HD2 TYR 53 HD2 TYR 53 45.663 42.695 36.513 384 HE1 TYR 53 HE1 TYR 53 45.731 39.398 39.827 385 HE2 TYR 53 HE2 TYR 53 47.696 42.017 37.440 386 HH TYR 53 HH TYR 53 48.743 40.618 38.911 387 H VAL 54 H VAL 54 39.799 40.697 37.369 388 HA VAL 54 HA VAL 54 38.527 41.692 35.171 389 HB VAL 54 HB VAL 54 37.657 39.453 36.606 390 HG11 VAL 54 HG11 VAL 54 36.010 39.150 34.896 391 HG12 VAL 54 HG12 VAL 54 35.816 40.546 35.620 392 HG13 VAL 54 HG13 VAL 54 36.518 40.480 34.202 393 HG21 VAL 54 HG21 VAL 54 38.162 38.116 34.664 394 HG22 VAL 54 HG22 VAL 54 38.772 39.400 33.968 395 HG23 VAL 54 HG23 VAL 54 39.480 38.779 35.242 396 H THR 55 H THR 55 36.662 43.034 35.676 397 HA THR 55 HA THR 55 36.088 43.630 38.277 398 HB THR 55 HB THR 55 37.631 45.142 37.380 399 HG1 THR 55 HG1 THR 55 36.555 45.965 38.994 400 HG21 THR 55 HG21 THR 55 36.956 46.873 35.979 401 HG22 THR 55 HG22 THR 55 36.939 45.477 35.231 402 HG23 THR 55 HG23 THR 55 35.583 46.124 35.733 403 H PHE 56 H PHE 56 33.961 44.049 38.839 404 HA PHE 56 HA PHE 56 32.146 43.103 37.052 405 HB2 PHE 56 HB2 PHE 56 32.442 42.512 39.823 406 HB3 PHE 56 HB3 PHE 56 31.139 42.109 39.064 407 HD1 PHE 56 HD1 PHE 56 34.684 41.414 38.745 408 HD2 PHE 56 HD2 PHE 56 30.951 39.888 38.383 409 HE1 PHE 56 HE1 PHE 56 35.582 39.310 38.309 410 HE2 PHE 56 HE2 PHE 56 31.863 37.774 38.015 411 HZ PHE 56 HZ PHE 56 34.171 37.489 37.956 412 H LEU 57 H LEU 57 30.080 44.071 36.823 413 HA LEU 57 HA LEU 57 29.120 45.940 38.500 414 HB2 LEU 57 HB2 LEU 57 28.607 46.129 36.234 415 HB3 LEU 57 HB3 LEU 57 27.958 44.710 36.232 416 HG LEU 57 HG LEU 57 26.801 46.516 37.976 417 HD11 LEU 57 HD11 LEU 57 25.482 47.586 36.302 418 HD12 LEU 57 HD12 LEU 57 27.016 47.917 36.093 419 HD13 LEU 57 HD13 LEU 57 26.310 46.825 35.188 420 HD21 LEU 57 HD21 LEU 57 24.751 45.511 37.252 421 HD22 LEU 57 HD22 LEU 57 25.559 44.687 36.166 422 HD23 LEU 57 HD23 LEU 57 25.780 44.398 37.708 423 H ASN 58 H ASN 58 28.894 42.543 38.436 424 HA ASN 58 HA ASN 58 26.905 42.295 40.202 425 HB2 ASN 58 HB2 ASN 58 27.306 40.655 38.502 426 HB3 ASN 58 HB3 ASN 58 28.594 40.226 39.268 427 HD21 ASN 58 HD21 ASN 58 25.449 39.686 41.490 428 HD22 ASN 58 HD22 ASN 58 25.729 41.022 40.894 429 H ASP 59 H ASP 59 29.532 43.657 40.926 430 HA ASP 59 HA ASP 59 30.588 42.884 43.162 431 HB2 ASP 59 HB2 ASP 59 31.388 44.633 41.741 432 HB3 ASP 59 HB3 ASP 59 30.113 45.475 42.053 433 H LYS 60 H LYS 60 27.396 43.717 42.842 434 HA LYS 60 HA LYS 60 26.762 44.564 45.253 435 HB2 LYS 60 HB2 LYS 60 25.524 44.675 43.037 436 HB3 LYS 60 HB3 LYS 60 24.916 43.316 43.500 437 HG2 LYS 60 HG2 LYS 60 23.904 44.352 45.353 438 HG3 LYS 60 HG3 LYS 60 24.598 45.706 45.011 439 HD2 LYS 60 HD2 LYS 60 23.373 45.645 42.879 440 HD3 LYS 60 HD3 LYS 60 22.532 44.482 43.491 441 HE2 LYS 60 HE2 LYS 60 21.811 45.941 45.251 442 HE3 LYS 60 HE3 LYS 60 22.634 47.104 44.616 443 HZ1 LYS 60 HZ1 LYS 60 20.461 47.244 43.970 444 HZ2 LYS 60 HZ2 LYS 60 21.270 47.001 42.787 445 HZ3 LYS 60 HZ3 LYS 60 20.503 45.918 43.378 446 H ASP 61 H ASP 61 27.496 41.379 44.539 447 HA ASP 61 HA ASP 61 26.983 40.571 47.055 448 HB2 ASP 61 HB2 ASP 61 25.032 39.929 45.846 449 HB3 ASP 61 HB3 ASP 61 25.920 39.115 44.855 450 H GLU 62 H GLU 62 29.065 39.940 47.755 451 HA GLU 62 HA GLU 62 31.026 39.267 46.297 452 HB2 GLU 62 HB2 GLU 62 30.715 38.595 49.054 453 HB3 GLU 62 HB3 GLU 62 32.093 38.528 48.327 454 HG2 GLU 62 HG2 GLU 62 32.426 40.495 49.202 455 HG3 GLU 62 HG3 GLU 62 31.583 41.021 48.001 456 H ASP 63 H ASP 63 28.762 37.040 47.567 457 HA ASP 63 HA ASP 63 29.913 34.729 47.009 458 HB2 ASP 63 HB2 ASP 63 28.270 34.953 48.696 459 HB3 ASP 63 HB3 ASP 63 27.196 35.249 47.605 460 H ALA 64 H ALA 64 27.659 36.558 45.079 461 HA ALA 64 HA ALA 64 27.472 34.888 43.046 462 HB1 ALA 64 HB1 ALA 64 26.428 36.723 41.964 463 HB2 ALA 64 HB2 ALA 64 25.823 36.537 43.415 464 HB3 ALA 64 HB3 ALA 64 26.891 37.674 43.142 465 H VAL 65 H VAL 65 29.736 37.502 43.502 466 HA VAL 65 HA VAL 65 31.070 37.352 41.277 467 HB VAL 65 HB VAL 65 32.034 38.240 43.759 468 HG11 VAL 65 HG11 VAL 65 33.755 39.381 42.571 469 HG12 VAL 65 HG12 VAL 65 33.877 37.818 42.344 470 HG13 VAL 65 HG13 VAL 65 33.237 38.734 41.221 471 HG21 VAL 65 HG21 VAL 65 31.611 40.438 42.903 472 HG22 VAL 65 HG22 VAL 65 31.043 39.792 41.573 473 HG23 VAL 65 HG23 VAL 65 30.267 39.600 42.940 474 H LYS 66 H LYS 66 31.688 35.561 44.222 475 HA LYS 66 HA LYS 66 33.714 34.059 43.513 476 HB2 LYS 66 HB2 LYS 66 33.066 34.350 45.754 477 HB3 LYS 66 HB3 LYS 66 31.729 33.595 45.482 478 HG2 LYS 66 HG2 LYS 66 33.106 32.158 46.626 479 HG3 LYS 66 HG3 LYS 66 32.931 31.581 45.187 480 HD2 LYS 66 HD2 LYS 66 35.062 32.308 44.572 481 HD3 LYS 66 HD3 LYS 66 35.228 33.087 45.911 482 HE2 LYS 66 HE2 LYS 66 35.237 31.026 47.108 483 HE3 LYS 66 HE3 LYS 66 35.078 30.249 45.765 484 HZ1 LYS 66 HZ1 LYS 66 37.270 30.299 46.382 485 HZ2 LYS 66 HZ2 LYS 66 37.138 31.029 45.132 486 HZ3 LYS 66 HZ3 LYS 66 37.287 31.753 46.383 487 H ALA 67 H ALA 67 30.364 33.234 43.116 488 HA ALA 67 HA ALA 67 30.636 30.915 41.916 489 HB1 ALA 67 HB1 ALA 67 28.333 31.213 41.391 490 HB2 ALA 67 HB2 ALA 67 28.590 31.574 42.912 491 HB3 ALA 67 HB3 ALA 67 28.436 32.730 41.840 492 H GLY 68 H GLY 68 30.536 34.034 40.407 493 HA2 GLY 68 HA2 GLY 68 30.604 33.390 37.888 494 HA3 GLY 68 HA3 GLY 68 31.062 34.759 38.478 495 H ILE 69 H ILE 69 33.340 34.120 39.944 496 HA ILE 69 HA ILE 69 35.340 33.665 38.318 497 HB ILE 69 HB ILE 69 35.237 33.672 41.112 498 HG12 ILE 69 HG12 ILE 69 34.988 35.807 40.160 499 HG13 ILE 69 HG13 ILE 69 36.247 35.750 41.078 500 HG21 ILE 69 HG21 ILE 69 37.628 33.655 41.193 501 HG22 ILE 69 HG22 ILE 69 37.076 32.305 40.578 502 HG23 ILE 69 HG23 ILE 69 37.661 33.428 39.627 503 HD11 ILE 69 HD11 ILE 69 36.758 36.952 39.131 504 HD12 ILE 69 HD12 ILE 69 37.648 35.642 39.173 505 HD13 ILE 69 HD13 ILE 69 36.370 35.702 38.239 506 H LYS 70 H LYS 70 33.721 31.302 40.357 507 HA LYS 70 HA LYS 70 35.145 29.204 39.764 508 HB2 LYS 70 HB2 LYS 70 33.642 29.241 41.611 509 HB3 LYS 70 HB3 LYS 70 32.432 29.233 40.626 510 HG2 LYS 70 HG2 LYS 70 32.982 27.065 39.889 511 HG3 LYS 70 HG3 LYS 70 34.296 27.077 40.730 512 HD2 LYS 70 HD2 LYS 70 32.998 27.078 42.729 513 HD3 LYS 70 HD3 LYS 70 31.696 27.020 41.873 514 HE2 LYS 70 HE2 LYS 70 32.240 24.903 41.060 515 HE3 LYS 70 HE3 LYS 70 33.671 24.982 41.676 516 HZ1 LYS 70 HZ1 LYS 70 32.324 23.706 42.994 517 HZ2 LYS 70 HZ2 LYS 70 32.723 24.876 43.759 518 HZ3 LYS 70 HZ3 LYS 70 31.390 24.802 43.184 519 H ALA 71 H ALA 71 32.325 30.273 38.050 520 HA ALA 71 HA ALA 71 32.157 28.372 36.244 521 HB1 ALA 71 HB1 ALA 71 30.662 29.864 35.182 522 HB2 ALA 71 HB2 ALA 71 30.336 29.787 36.730 523 HB3 ALA 71 HB3 ALA 71 31.138 31.023 36.150 524 H LEU 72 H LEU 72 33.857 31.348 36.049 525 HA LEU 72 HA LEU 72 34.812 31.263 33.594 526 HB2 LEU 72 HB2 LEU 72 34.505 33.275 34.792 527 HB3 LEU 72 HB3 LEU 72 35.538 32.810 35.865 528 HG LEU 72 HG LEU 72 37.270 33.028 34.318 529 HD11 LEU 72 HD11 LEU 72 36.922 34.038 32.225 530 HD12 LEU 72 HD12 LEU 72 36.142 32.662 32.313 531 HD13 LEU 72 HD13 LEU 72 35.360 34.029 32.488 532 HD21 LEU 72 HD21 LEU 72 37.255 35.419 34.197 533 HD22 LEU 72 HD22 LEU 72 35.707 35.410 34.530 534 HD23 LEU 72 HD23 LEU 72 36.754 34.945 35.623 535 H GLN 73 H GLN 73 36.382 30.259 36.536 536 HA GLN 73 HA GLN 73 38.672 29.494 35.435 537 HB2 GLN 73 HB2 GLN 73 38.325 30.165 37.770 538 HB3 GLN 73 HB3 GLN 73 37.800 28.715 38.005 539 HG2 GLN 73 HG2 GLN 73 40.016 28.701 38.624 540 HG3 GLN 73 HG3 GLN 73 39.928 27.867 37.309 541 HE21 GLN 73 HE21 GLN 73 41.502 28.393 35.783 542 HE22 GLN 73 HE22 GLN 73 42.179 29.713 35.650 543 H GLU 74 H GLU 74 35.830 27.592 36.094 544 HA GLU 74 HA GLU 74 36.696 25.249 35.258 545 HB2 GLU 74 HB2 GLU 74 34.743 25.646 36.660 546 HB3 GLU 74 HB3 GLU 74 33.988 26.108 35.375 547 HG2 GLU 74 HG2 GLU 74 33.985 23.992 34.491 548 HG3 GLU 74 HG3 GLU 74 35.071 23.495 35.493 549 H ALA 75 H ALA 75 35.621 27.869 33.362 550 HA ALA 75 HA ALA 75 35.671 26.588 31.013 551 HB1 ALA 75 HB1 ALA 75 35.052 28.735 30.166 552 HB2 ALA 75 HB2 ALA 75 34.079 28.312 31.342 553 HB3 ALA 75 HB3 ALA 75 35.248 29.346 31.613 554 H SER 76 H SER 76 38.289 27.510 32.702 555 HA SER 76 HA SER 76 39.530 29.151 31.153 556 HB2 SER 76 HB2 SER 76 41.390 28.874 32.601 557 HB3 SER 76 HB3 SER 76 40.095 28.982 33.462 558 HG SER 76 HG SER 76 40.206 26.949 33.905 559 H GLY 77 H GLY 77 39.733 25.741 30.851 560 HA2 GLY 77 HA2 GLY 77 41.796 25.519 29.225 561 HA3 GLY 77 HA3 GLY 77 40.696 24.435 29.446 562 H PHE 78 H PHE 78 38.407 25.797 28.475 563 HA PHE 78 HA PHE 78 38.506 25.777 25.844 564 HB2 PHE 78 HB2 PHE 78 36.442 26.784 27.501 565 HB3 PHE 78 HB3 PHE 78 36.277 26.535 25.970 566 HD1 PHE 78 HD1 PHE 78 36.073 24.995 29.065 567 HD2 PHE 78 HD2 PHE 78 36.347 24.122 25.128 568 HE1 PHE 78 HE1 PHE 78 35.423 22.795 29.508 569 HE2 PHE 78 HE2 PHE 78 35.727 21.923 25.565 570 HZ PHE 78 HZ PHE 78 35.239 21.256 27.751 571 H ILE 79 H ILE 79 38.608 28.491 28.009 572 HA ILE 79 HA ILE 79 38.737 30.439 26.236 573 HB ILE 79 HB ILE 79 39.371 30.463 28.981 574 HG12 ILE 79 HG12 ILE 79 37.057 31.621 27.803 575 HG13 ILE 79 HG13 ILE 79 37.029 30.147 28.311 576 HG21 ILE 79 HG21 ILE 79 39.382 32.817 28.901 577 HG22 ILE 79 HG22 ILE 79 40.539 32.228 27.993 578 HG23 ILE 79 HG23 ILE 79 39.202 32.760 27.328 579 HD11 ILE 79 HD11 ILE 79 36.101 31.551 29.940 580 HD12 ILE 79 HD12 ILE 79 37.418 30.888 30.519 581 HD13 ILE 79 HD13 ILE 79 37.445 32.385 30.003 582 H ARG 80 H ARG 80 41.411 28.786 27.774 583 HA ARG 80 HA ARG 80 43.421 30.094 26.714 584 HB2 ARG 80 HB2 ARG 80 43.576 28.659 28.628 585 HB3 ARG 80 HB3 ARG 80 43.318 27.424 27.711 586 HG2 ARG 80 HG2 ARG 80 45.445 27.894 26.629 587 HG3 ARG 80 HG3 ARG 80 45.706 28.960 27.736 588 HD2 ARG 80 HD2 ARG 80 46.776 27.048 28.472 589 HD3 ARG 80 HD3 ARG 80 45.523 27.192 29.390 590 HE ARG 80 HE ARG 80 45.536 25.490 27.234 591 HH11 ARG 80 HH11 ARG 80 44.190 23.808 27.177 592 HH12 ARG 80 HH12 ARG 80 43.655 23.222 28.439 593 HH21 ARG 80 HH21 ARG 80 44.805 25.443 30.479 594 HH22 ARG 80 HH22 ARG 80 44.018 24.182 30.384 595 H SER 81 H SER 81 41.921 27.237 25.465 596 HA SER 81 HA SER 81 43.477 26.860 23.389 597 HB2 SER 81 HB2 SER 81 41.810 25.308 22.701 598 HB3 SER 81 HB3 SER 81 42.400 25.014 24.115 599 HG SER 81 HG SER 81 40.614 25.709 25.002 600 H LEU 82 H LEU 82 40.379 28.460 23.480 601 HA LEU 82 HA LEU 82 40.229 29.230 20.999 602 HB2 LEU 82 HB2 LEU 82 38.932 30.222 23.316 603 HB3 LEU 82 HB3 LEU 82 38.632 30.847 21.918 604 HG LEU 82 HG LEU 82 38.070 28.146 22.543 605 HD11 LEU 82 HD11 LEU 82 35.772 28.832 22.617 606 HD12 LEU 82 HD12 LEU 82 36.604 29.622 23.709 607 HD13 LEU 82 HD13 LEU 82 36.225 30.324 22.342 608 HD21 LEU 82 HD21 LEU 82 36.815 28.061 20.552 609 HD22 LEU 82 HD22 LEU 82 37.242 29.549 20.224 610 HD23 LEU 82 HD23 LEU 82 38.329 28.397 20.232 611 H LEU 83 H LEU 83 41.817 30.885 23.606 612 HA LEU 83 HA LEU 83 42.453 33.152 22.427 613 HB2 LEU 83 HB2 LEU 83 42.468 32.937 24.765 614 HB3 LEU 83 HB3 LEU 83 43.588 31.855 24.684 615 HG LEU 83 HG LEU 83 45.096 33.510 23.888 616 HD11 LEU 83 HD11 LEU 83 44.533 35.787 24.057 617 HD12 LEU 83 HD12 LEU 83 43.594 35.066 23.005 618 HD13 LEU 83 HD13 LEU 83 43.054 35.387 24.459 619 HD21 LEU 83 HD21 LEU 83 45.392 34.578 26.005 620 HD22 LEU 83 HD22 LEU 83 43.934 34.125 26.424 621 HD23 LEU 83 HD23 LEU 83 45.072 33.043 26.216 622 H GLY 84 H GLY 84 44.414 30.301 22.736 623 HA2 GLY 84 HA2 GLY 84 46.507 30.944 21.358 624 HA3 GLY 84 HA3 GLY 84 46.034 29.480 21.612 625 H LYS 85 H LYS 85 43.567 29.542 20.129 626 HA LYS 85 HA LYS 85 44.203 29.365 17.572 627 HB2 LYS 85 HB2 LYS 85 42.507 28.006 18.555 628 HB3 LYS 85 HB3 LYS 85 41.622 29.272 18.767 629 HG2 LYS 85 HG2 LYS 85 41.256 29.525 16.513 630 HG3 LYS 85 HG3 LYS 85 42.434 28.573 16.143 631 HD2 LYS 85 HD2 LYS 85 40.441 27.451 15.738 632 HD3 LYS 85 HD3 LYS 85 41.194 26.713 16.888 633 HE2 LYS 85 HE2 LYS 85 38.939 26.833 17.436 634 HE3 LYS 85 HE3 LYS 85 39.747 27.665 18.479 635 HZ1 LYS 85 HZ1 LYS 85 37.941 28.828 17.787 636 HZ2 LYS 85 HZ2 LYS 85 39.130 29.553 17.373 637 HZ3 LYS 85 HZ3 LYS 85 38.376 28.779 16.401 638 H ALA 86 H ALA 86 42.606 31.953 19.245 639 HA ALA 86 HA ALA 86 41.910 33.350 17.076 640 HB1 ALA 86 HB1 ALA 86 41.288 35.020 18.562 641 HB2 ALA 86 HB2 ALA 86 40.697 33.625 19.027 642 HB3 ALA 86 HB3 ALA 86 41.974 34.224 19.747 643 H MET 87 H MET 87 44.445 33.990 19.417 644 HA MET 87 HA MET 87 45.626 35.969 18.153 645 HB2 MET 87 HB2 MET 87 46.767 34.353 20.176 646 HB3 MET 87 HB3 MET 87 47.417 35.679 19.673 647 HG2 MET 87 HG2 MET 87 45.248 36.691 20.393 648 HG3 MET 87 HG3 MET 87 45.147 35.416 21.285 649 HE1 MET 87 HE1 MET 87 48.091 38.684 21.713 650 HE2 MET 87 HE2 MET 87 48.004 37.803 20.400 651 HE3 MET 87 HE3 MET 87 46.785 38.725 20.818 652 H ARG 88 H ARG 88 45.908 32.606 17.644 653 HA ARG 88 HA ARG 88 47.127 31.329 16.379 654 HB2 ARG 88 HB2 ARG 88 47.413 33.691 14.905 655 HB3 ARG 88 HB3 ARG 88 48.077 32.362 14.429 656 HG2 ARG 88 HG2 ARG 88 45.323 32.263 14.877 657 HG3 ARG 88 HG3 ARG 88 45.783 33.035 13.602 658 HD2 ARG 88 HD2 ARG 88 45.369 30.909 12.906 659 HD3 ARG 88 HD3 ARG 88 46.921 31.062 12.879 660 HE ARG 88 HE ARG 88 47.064 29.664 14.632 661 HH11 ARG 88 HH11 ARG 88 46.287 27.864 15.763 662 HH12 ARG 88 HH12 ARG 88 44.840 27.517 15.707 663 HH21 ARG 88 HH21 ARG 88 43.912 29.979 13.722 664 HH22 ARG 88 HH22 ARG 88 43.402 28.796 14.471 665 H LEU 89 H LEU 89 48.358 32.218 18.807 666 HA LEU 89 HA LEU 89 51.027 32.567 18.245 667 HB2 LEU 89 HB2 LEU 89 49.595 32.930 20.649 668 HB3 LEU 89 HB3 LEU 89 51.154 32.974 20.620 669 HG LEU 89 HG LEU 89 49.445 34.856 19.407 670 HD11 LEU 89 HD11 LEU 89 50.425 36.409 20.870 671 HD12 LEU 89 HD12 LEU 89 49.737 35.241 21.687 672 HD13 LEU 89 HD13 LEU 89 51.309 35.253 21.495 673 HD21 LEU 89 HD21 LEU 89 51.342 35.995 18.624 674 HD22 LEU 89 HD22 LEU 89 52.261 34.824 19.165 675 HD23 LEU 89 HD23 LEU 89 51.254 34.554 17.972 676 H ARG 90 H ARG 90 52.529 30.832 18.561 677 HA ARG 90 HA ARG 90 51.718 28.342 18.810 678 HB2 ARG 90 HB2 ARG 90 54.363 29.287 19.114 679 HB3 ARG 90 HB3 ARG 90 53.999 27.781 18.933 680 HG2 ARG 90 HG2 ARG 90 53.147 28.323 16.748 681 HG3 ARG 90 HG3 ARG 90 53.711 29.765 16.938 682 HD2 ARG 90 HD2 ARG 90 55.215 28.427 15.701 683 HD3 ARG 90 HD3 ARG 90 55.890 28.972 16.997 684 HE ARG 90 HE ARG 90 55.893 26.903 17.845 685 HH11 ARG 90 HH11 ARG 90 55.923 24.657 17.611 686 HH12 ARG 90 HH12 ARG 90 55.350 24.024 16.390 687 HH21 ARG 90 HH21 ARG 90 54.418 26.809 14.895 688 HH22 ARG 90 HH22 ARG 90 54.440 25.326 14.747 689 H ILE 91 H ILE 91 53.037 30.466 21.246 690 HA ILE 91 HA ILE 91 52.484 28.685 23.270 691 HB ILE 91 HB ILE 91 53.868 30.143 24.603 692 HG12 ILE 91 HG12 ILE 91 54.793 31.085 22.118 693 HG13 ILE 91 HG13 ILE 91 53.977 31.949 23.127 694 HG21 ILE 91 HG21 ILE 91 55.833 29.026 23.965 695 HG22 ILE 91 HG22 ILE 91 54.611 28.020 24.022 696 HG23 ILE 91 HG23 ILE 91 55.124 28.563 22.626 697 HD11 ILE 91 HD11 ILE 91 56.235 32.480 23.294 698 HD12 ILE 91 HD12 ILE 91 55.747 31.849 24.663 699 HD13 ILE 91 HD13 ILE 91 56.576 30.972 23.638 700 H VAL 92 H VAL 92 50.633 29.049 24.553 701 HA VAL 92 HA VAL 92 49.634 31.614 24.818 702 HB VAL 92 HB VAL 92 48.116 30.755 23.525 703 HG11 VAL 92 HG11 VAL 92 47.131 28.636 23.735 704 HG12 VAL 92 HG12 VAL 92 48.693 28.527 23.491 705 HG13 VAL 92 HG13 VAL 92 48.102 28.324 24.946 706 HG21 VAL 92 HG21 VAL 92 46.154 30.574 24.801 707 HG22 VAL 92 HG22 VAL 92 47.038 30.440 26.109 708 HG23 VAL 92 HG23 VAL 92 47.047 31.791 25.283 709 HA PRO 93 HA PRO 93 50.551 30.504 28.977 710 HB2 PRO 93 HB2 PRO 93 49.330 32.766 30.056 711 HB3 PRO 93 HB3 PRO 93 50.850 32.427 30.125 712 HG2 PRO 93 HG2 PRO 93 50.034 34.350 28.591 713 HG3 PRO 93 HG3 PRO 93 51.309 33.541 28.200 714 HD2 PRO 93 HD2 PRO 93 48.702 33.179 27.166 715 HD3 PRO 93 HD3 PRO 93 50.037 33.100 26.365 716 H GLU 94 H GLU 94 49.617 29.426 30.786 717 HA GLU 94 HA GLU 94 47.060 28.751 30.850 718 HB2 GLU 94 HB2 GLU 94 48.774 27.326 31.687 719 HB3 GLU 94 HB3 GLU 94 49.052 28.347 32.833 720 HG2 GLU 94 HG2 GLU 94 47.773 26.776 33.844 721 HG3 GLU 94 HG3 GLU 94 46.765 27.938 33.588 722 H LEU 95 H LEU 95 45.325 29.916 31.727 723 HA LEU 95 HA LEU 95 45.812 32.280 32.878 724 HB2 LEU 95 HB2 LEU 95 43.341 31.409 31.788 725 HB3 LEU 95 HB3 LEU 95 43.667 32.884 32.179 726 HG LEU 95 HG LEU 95 44.816 31.525 29.987 727 HD11 LEU 95 HD11 LEU 95 43.571 33.067 28.632 728 HD12 LEU 95 HD12 LEU 95 42.585 32.222 29.540 729 HD13 LEU 95 HD13 LEU 95 42.963 33.706 29.948 730 HD21 LEU 95 HD21 LEU 95 45.843 33.543 29.335 731 HD22 LEU 95 HD22 LEU 95 45.304 34.233 30.656 732 HD23 LEU 95 HD23 LEU 95 46.381 33.076 30.750 733 H THR 96 H THR 96 45.433 32.790 35.019 734 HA THR 96 HA THR 96 43.500 31.481 36.414 735 HB THR 96 HB THR 96 45.751 32.639 37.588 736 HG1 THR 96 HG1 THR 96 46.261 30.502 38.030 737 HG21 THR 96 HG21 THR 96 44.987 31.613 39.610 738 HG22 THR 96 HG22 THR 96 43.894 32.625 39.074 739 HG23 THR 96 HG23 THR 96 43.716 31.070 38.839 740 H PHE 97 H PHE 97 41.741 32.773 37.086 741 HA PHE 97 HA PHE 97 41.747 35.414 36.516 742 HB2 PHE 97 HB2 PHE 97 39.525 33.654 36.669 743 HB3 PHE 97 HB3 PHE 97 39.387 35.168 36.317 744 HD1 PHE 97 HD1 PHE 97 39.935 35.972 34.054 745 HD2 PHE 97 HD2 PHE 97 40.344 32.047 34.964 746 HE1 PHE 97 HE1 PHE 97 40.186 35.472 31.792 747 HE2 PHE 97 HE2 PHE 97 40.595 31.549 32.701 748 HZ PHE 97 HZ PHE 97 40.544 33.268 31.119 749 H PHE 98 H PHE 98 41.213 37.032 37.985 750 HA PHE 98 HA PHE 98 40.446 36.499 40.518 751 HB2 PHE 98 HB2 PHE 98 42.578 38.280 39.926 752 HB3 PHE 98 HB3 PHE 98 42.084 37.946 41.366 753 HD1 PHE 98 HD1 PHE 98 42.962 36.035 42.560 754 HD2 PHE 98 HD2 PHE 98 43.979 36.617 38.695 755 HE1 PHE 98 HE1 PHE 98 44.658 34.443 42.771 756 HE2 PHE 98 HE2 PHE 98 45.652 35.007 38.887 757 HZ PHE 98 HZ PHE 98 46.003 33.924 40.928 758 H TYR 99 H TYR 99 39.239 38.281 41.577 759 HA TYR 99 HA TYR 99 38.127 40.084 39.928 760 HB2 TYR 99 HB2 TYR 99 36.320 40.161 41.206 761 HB3 TYR 99 HB3 TYR 99 36.700 38.649 41.175 762 HD1 TYR 99 HD1 TYR 99 35.900 41.214 43.276 763 HD2 TYR 99 HD2 TYR 99 37.951 37.715 43.273 764 HE1 TYR 99 HE1 TYR 99 35.648 41.060 45.593 765 HE2 TYR 99 HE2 TYR 99 37.749 37.602 45.596 766 HH TYR 99 HH TYR 99 36.818 38.502 47.454 767 H ASP 100 H ASP 100 38.211 42.300 40.068 768 HA ASP 100 HA ASP 100 39.848 43.614 41.830 769 HB2 ASP 100 HB2 ASP 100 40.996 43.212 39.815 770 HB3 ASP 100 HB3 ASP 100 39.817 43.830 39.002 Start of MODEL 12 1 HA PRO 8 HA PRO 8 56.112 43.272 26.563 2 HB2 PRO 8 HB2 PRO 8 54.792 41.075 26.724 3 HB3 PRO 8 HB3 PRO 8 56.348 40.970 26.682 4 HG2 PRO 8 HG2 PRO 8 54.732 40.902 29.038 5 HG3 PRO 8 HG3 PRO 8 55.890 39.916 28.698 6 HD2 PRO 8 HD2 PRO 8 56.384 41.927 30.222 7 HD3 PRO 8 HD3 PRO 8 57.501 41.413 29.264 8 H GLN 9 H GLN 9 55.069 45.291 28.031 9 HA GLN 9 HA GLN 9 52.575 45.258 28.674 10 HB2 GLN 9 HB2 GLN 9 54.184 46.984 29.230 11 HB3 GLN 9 HB3 GLN 9 54.003 47.549 27.788 12 HG2 GLN 9 HG2 GLN 9 51.717 47.401 29.419 13 HG3 GLN 9 HG3 GLN 9 52.718 48.565 29.692 14 HE21 GLN 9 HE21 GLN 9 50.707 49.871 29.209 15 HE22 GLN 9 HE22 GLN 9 50.453 50.286 27.800 16 H ARG 10 H ARG 10 53.749 45.945 25.468 17 HA ARG 10 HA ARG 10 51.451 46.686 24.443 18 HB2 ARG 10 HB2 ARG 10 53.784 45.973 23.013 19 HB3 ARG 10 HB3 ARG 10 52.534 46.614 22.336 20 HG2 ARG 10 HG2 ARG 10 52.885 48.572 23.743 21 HG3 ARG 10 HG3 ARG 10 54.239 47.939 24.189 22 HD2 ARG 10 HD2 ARG 10 54.806 47.882 21.776 23 HD3 ARG 10 HD3 ARG 10 53.612 48.867 21.584 24 HE ARG 10 HE ARG 10 55.980 49.498 22.724 25 HH11 ARG 10 HH11 ARG 10 56.523 51.508 23.377 26 HH12 ARG 10 HH12 ARG 10 55.553 52.631 23.249 27 HH21 ARG 10 HH21 ARG 10 53.066 50.937 22.081 28 HH22 ARG 10 HH22 ARG 10 53.516 52.298 22.485 29 H VAL 11 H VAL 11 53.003 43.605 24.299 30 HA VAL 11 HA VAL 11 51.246 42.207 22.960 31 HB VAL 11 HB VAL 11 53.148 41.296 24.830 32 HG11 VAL 11 HG11 VAL 11 52.972 39.137 23.865 33 HG12 VAL 11 HG12 VAL 11 51.590 39.579 24.502 34 HG13 VAL 11 HG13 VAL 11 51.803 39.664 22.934 35 HG21 VAL 11 HG21 VAL 11 54.513 40.753 22.946 36 HG22 VAL 11 HG22 VAL 11 53.407 41.363 21.991 37 HG23 VAL 11 HG23 VAL 11 54.208 42.307 22.979 38 H ALA 12 H ALA 12 51.429 42.705 26.402 39 HA ALA 12 HA ALA 12 49.425 41.261 27.200 40 HB1 ALA 12 HB1 ALA 12 49.682 42.476 29.215 41 HB2 ALA 12 HB2 ALA 12 51.095 41.996 28.684 42 HB3 ALA 12 HB3 ALA 12 50.637 43.496 28.470 43 H GLN 13 H GLN 13 49.235 44.654 26.316 44 HA GLN 13 HA GLN 13 46.659 44.950 26.729 45 HB2 GLN 13 HB2 GLN 13 48.427 46.533 25.156 46 HB3 GLN 13 HB3 GLN 13 46.947 46.962 25.400 47 HG2 GLN 13 HG2 GLN 13 48.789 46.700 27.531 48 HG3 GLN 13 HG3 GLN 13 48.552 48.066 26.816 49 HE21 GLN 13 HE21 GLN 13 47.816 46.772 29.553 50 HE22 GLN 13 HE22 GLN 13 46.488 47.375 29.856 51 H GLU 14 H GLU 14 48.276 44.023 23.784 52 HA GLU 14 HA GLU 14 46.257 43.878 22.150 53 HB2 GLU 14 HB2 GLU 14 48.842 42.746 22.102 54 HB3 GLU 14 HB3 GLU 14 47.815 42.205 21.060 55 HG2 GLU 14 HG2 GLU 14 47.565 44.410 20.191 56 HG3 GLU 14 HG3 GLU 14 48.639 44.917 21.203 57 H MET 15 H MET 15 47.443 41.368 24.257 58 HA MET 15 HA MET 15 45.712 39.497 23.621 59 HB2 MET 15 HB2 MET 15 47.526 39.651 25.780 60 HB3 MET 15 HB3 MET 15 46.555 38.440 25.644 61 HG2 MET 15 HG2 MET 15 47.503 37.977 23.492 62 HG3 MET 15 HG3 MET 15 48.533 39.123 23.731 63 HE1 MET 15 HE1 MET 15 50.689 36.013 23.752 64 HE2 MET 15 HE2 MET 15 49.394 36.270 22.876 65 HE3 MET 15 HE3 MET 15 50.466 37.421 23.062 66 H GLN 16 H GLN 16 45.577 41.827 26.234 67 HA GLN 16 HA GLN 16 43.523 41.038 27.555 68 HB2 GLN 16 HB2 GLN 16 45.028 42.877 28.147 69 HB3 GLN 16 HB3 GLN 16 44.227 43.775 27.155 70 HG2 GLN 16 HG2 GLN 16 42.258 43.105 28.600 71 HG3 GLN 16 HG3 GLN 16 43.363 42.843 29.668 72 HE21 GLN 16 HE21 GLN 16 44.906 44.842 29.990 73 HE22 GLN 16 HE22 GLN 16 44.283 46.195 29.956 74 H LYS 17 H LYS 17 43.404 43.111 24.751 75 HA LYS 17 HA LYS 17 40.810 43.544 24.620 76 HB2 LYS 17 HB2 LYS 17 42.403 44.954 23.537 77 HB3 LYS 17 HB3 LYS 17 42.788 43.792 22.571 78 HG2 LYS 17 HG2 LYS 17 40.719 43.871 21.521 79 HG3 LYS 17 HG3 LYS 17 40.141 44.821 22.614 80 HD2 LYS 17 HD2 LYS 17 41.586 46.569 21.831 81 HD3 LYS 17 HD3 LYS 17 42.102 45.617 20.708 82 HE2 LYS 17 HE2 LYS 17 39.861 45.456 19.851 83 HE3 LYS 17 HE3 LYS 17 39.389 46.465 20.942 84 HZ1 LYS 17 HZ1 LYS 17 39.782 47.555 18.987 85 HZ2 LYS 17 HZ2 LYS 17 40.725 48.050 19.978 86 HZ3 LYS 17 HZ3 LYS 17 41.166 47.109 18.962 87 H GLU 18 H GLU 18 42.548 40.964 23.098 88 HA GLU 18 HA GLU 18 40.444 39.843 21.913 89 HB2 GLU 18 HB2 GLU 18 42.849 39.602 21.308 90 HB3 GLU 18 HB3 GLU 18 42.884 38.494 22.405 91 HG2 GLU 18 HG2 GLU 18 42.528 37.433 20.374 92 HG3 GLU 18 HG3 GLU 18 41.224 37.271 21.215 93 H ILE 19 H ILE 19 41.853 39.185 24.993 94 HA ILE 19 HA ILE 19 40.484 37.082 25.752 95 HB ILE 19 HB ILE 19 41.935 38.957 27.262 96 HG12 ILE 19 HG12 ILE 19 42.636 36.223 26.791 97 HG13 ILE 19 HG13 ILE 19 43.120 37.339 25.816 98 HG21 ILE 19 HG21 ILE 19 41.787 37.556 29.157 99 HG22 ILE 19 HG22 ILE 19 40.353 38.085 28.747 100 HG23 ILE 19 HG23 ILE 19 40.789 36.609 28.373 101 HD11 ILE 19 HD11 ILE 19 44.846 36.813 27.317 102 HD12 ILE 19 HD12 ILE 19 44.401 38.315 27.548 103 HD13 ILE 19 HD13 ILE 19 43.909 37.182 28.539 104 H ALA 20 H ALA 20 39.736 40.444 26.299 105 HA ALA 20 HA ALA 20 37.517 40.245 27.637 106 HB1 ALA 20 HB1 ALA 20 37.196 42.492 26.969 107 HB2 ALA 20 HB2 ALA 20 38.692 42.277 27.443 108 HB3 ALA 20 HB3 ALA 20 38.351 42.331 25.897 109 H LEU 21 H LEU 21 37.800 40.132 24.177 110 HA LEU 21 HA LEU 21 35.237 39.863 23.593 111 HB2 LEU 21 HB2 LEU 21 36.770 40.644 21.996 112 HB3 LEU 21 HB3 LEU 21 37.534 39.285 22.035 113 HG LEU 21 HG LEU 21 35.680 38.214 21.057 114 HD11 LEU 21 HD11 LEU 21 33.896 39.448 20.156 115 HD12 LEU 21 HD12 LEU 21 33.933 39.602 21.733 116 HD13 LEU 21 HD13 LEU 21 34.483 40.766 20.809 117 HD21 LEU 21 HD21 LEU 21 35.961 39.168 18.879 118 HD22 LEU 21 HD22 LEU 21 36.613 40.450 19.541 119 HD23 LEU 21 HD23 LEU 21 37.364 39.057 19.603 120 H ILE 22 H ILE 22 37.610 37.330 23.986 121 HA ILE 22 HA ILE 22 36.117 35.243 23.485 122 HB ILE 22 HB ILE 22 38.521 35.406 24.936 123 HG12 ILE 22 HG12 ILE 22 38.198 34.322 22.316 124 HG13 ILE 22 HG13 ILE 22 38.529 35.834 22.507 125 HG21 ILE 22 HG21 ILE 22 38.724 33.063 24.795 126 HG22 ILE 22 HG22 ILE 22 37.452 33.457 25.653 127 HG23 ILE 22 HG23 ILE 22 37.278 32.982 24.152 128 HD11 ILE 22 HD11 ILE 22 40.506 34.659 22.023 129 HD12 ILE 22 HD12 ILE 22 40.613 35.269 23.481 130 HD13 ILE 22 HD13 ILE 22 40.278 33.733 23.288 131 H LEU 23 H LEU 23 36.498 36.784 26.577 132 HA LEU 23 HA LEU 23 35.036 35.241 28.058 133 HB2 LEU 23 HB2 LEU 23 36.149 37.755 28.392 134 HB3 LEU 23 HB3 LEU 23 34.874 37.526 29.260 135 HG LEU 23 HG LEU 23 35.872 35.645 30.235 136 HD11 LEU 23 HD11 LEU 23 38.159 35.177 29.995 137 HD12 LEU 23 HD12 LEU 23 37.387 34.965 28.629 138 HD13 LEU 23 HD13 LEU 23 38.251 36.273 28.855 139 HD21 LEU 23 HD21 LEU 23 37.469 36.836 31.592 140 HD22 LEU 23 HD22 LEU 23 37.473 38.002 30.520 141 HD23 LEU 23 HD23 LEU 23 36.168 37.714 31.371 142 H GLN 24 H GLN 24 33.808 37.688 25.958 143 HA GLN 24 HA GLN 24 31.287 37.453 26.707 144 HB2 GLN 24 HB2 GLN 24 32.464 38.852 24.535 145 HB3 GLN 24 HB3 GLN 24 30.911 38.800 24.677 146 HG2 GLN 24 HG2 GLN 24 30.997 39.983 26.690 147 HG3 GLN 24 HG3 GLN 24 32.554 39.900 26.719 148 HE21 GLN 24 HE21 GLN 24 31.353 42.378 26.895 149 HE22 GLN 24 HE22 GLN 24 31.619 43.190 25.674 150 H ARG 25 H ARG 25 33.067 35.617 24.462 151 HA ARG 25 HA ARG 25 30.923 34.647 23.192 152 HB2 ARG 25 HB2 ARG 25 33.605 33.987 22.540 153 HB3 ARG 25 HB3 ARG 25 32.375 33.713 21.623 154 HG2 ARG 25 HG2 ARG 25 33.782 36.104 21.908 155 HG3 ARG 25 HG3 ARG 25 33.321 35.424 20.582 156 HD2 ARG 25 HD2 ARG 25 31.616 36.956 22.248 157 HD3 ARG 25 HD3 ARG 25 32.200 37.459 20.892 158 HE ARG 25 HE ARG 25 30.847 35.427 20.169 159 HH11 ARG 25 HH11 ARG 25 28.704 35.379 19.486 160 HH12 ARG 25 HH12 ARG 25 27.738 36.382 20.015 161 HH21 ARG 25 HH21 ARG 25 29.742 38.031 21.884 162 HH22 ARG 25 HH22 ARG 25 28.337 37.918 21.404 163 H GLU 26 H GLU 26 33.129 33.300 25.450 164 HA GLU 26 HA GLU 26 32.321 30.762 25.086 165 HB2 GLU 26 HB2 GLU 26 34.660 31.212 25.148 166 HB3 GLU 26 HB3 GLU 26 34.518 31.731 26.612 167 HG2 GLU 26 HG2 GLU 26 35.470 29.578 26.534 168 HG3 GLU 26 HG3 GLU 26 34.188 29.610 27.421 169 H ILE 27 H ILE 27 31.615 33.061 27.427 170 HA ILE 27 HA ILE 27 30.002 31.388 28.792 171 HB ILE 27 HB ILE 27 30.578 32.334 30.880 172 HG12 ILE 27 HG12 ILE 27 32.804 33.526 29.625 173 HG13 ILE 27 HG13 ILE 27 31.577 34.327 30.158 174 HG21 ILE 27 HG21 ILE 27 32.514 31.016 31.212 175 HG22 ILE 27 HG22 ILE 27 31.437 30.220 30.367 176 HG23 ILE 27 HG23 ILE 27 32.680 30.882 29.643 177 HD11 ILE 27 HD11 ILE 27 33.330 34.452 31.726 178 HD12 ILE 27 HD12 ILE 27 32.108 33.684 32.381 179 HD13 ILE 27 HD13 ILE 27 33.355 32.872 31.838 180 H LYS 28 H LYS 28 28.107 32.483 29.880 181 HA LYS 28 HA LYS 28 27.042 34.387 28.252 182 HB2 LYS 28 HB2 LYS 28 25.800 32.505 29.994 183 HB3 LYS 28 HB3 LYS 28 24.976 33.533 29.159 184 HG2 LYS 28 HG2 LYS 28 25.606 32.530 27.155 185 HG3 LYS 28 HG3 LYS 28 26.673 31.647 27.872 186 HD2 LYS 28 HD2 LYS 28 24.881 30.427 28.929 187 HD3 LYS 28 HD3 LYS 28 23.864 31.252 28.083 188 HE2 LYS 28 HE2 LYS 28 24.801 30.423 26.076 189 HE3 LYS 28 HE3 LYS 28 25.914 29.679 26.874 190 HZ1 LYS 28 HZ1 LYS 28 24.307 28.231 26.246 191 HZ2 LYS 28 HZ2 LYS 28 24.320 28.287 27.697 192 HZ3 LYS 28 HZ3 LYS 28 23.282 28.980 26.953 193 H ASP 29 H ASP 29 27.609 36.432 28.876 194 HA ASP 29 HA ASP 29 27.781 37.199 31.400 195 HB2 ASP 29 HB2 ASP 29 29.277 37.912 29.552 196 HB3 ASP 29 HB3 ASP 29 28.143 38.895 29.131 197 HA PRO 30 HA PRO 30 23.856 39.681 30.595 198 HB2 PRO 30 HB2 PRO 30 22.369 37.528 29.478 199 HB3 PRO 30 HB3 PRO 30 22.111 39.047 29.239 200 HG2 PRO 30 HG2 PRO 30 23.347 37.825 27.390 201 HG3 PRO 30 HG3 PRO 30 23.898 39.233 27.765 202 HD2 PRO 30 HD2 PRO 30 24.932 36.730 28.645 203 HD3 PRO 30 HD3 PRO 30 25.772 37.963 28.192 204 H ARG 31 H ARG 31 24.100 36.484 31.786 205 HA ARG 31 HA ARG 31 22.452 36.538 33.788 206 HB2 ARG 31 HB2 ARG 31 23.723 34.613 32.866 207 HB3 ARG 31 HB3 ARG 31 24.895 35.079 33.784 208 HG2 ARG 31 HG2 ARG 31 23.513 34.731 35.701 209 HG3 ARG 31 HG3 ARG 31 22.366 34.230 34.771 210 HD2 ARG 31 HD2 ARG 31 23.278 32.272 35.405 211 HD3 ARG 31 HD3 ARG 31 23.982 32.491 34.032 212 HE ARG 31 HE ARG 31 25.909 32.999 35.131 213 HH11 ARG 31 HH11 ARG 31 27.310 32.347 36.825 214 HH12 ARG 31 HH12 ARG 31 26.733 32.014 38.158 215 HH21 ARG 31 HH21 ARG 31 23.663 32.359 37.481 216 HH22 ARG 31 HH22 ARG 31 24.667 32.021 38.527 217 H LEU 32 H LEU 32 25.527 37.956 33.650 218 HA LEU 32 HA LEU 32 25.522 38.942 36.179 219 HB2 LEU 32 HB2 LEU 32 27.780 38.681 34.503 220 HB3 LEU 32 HB3 LEU 32 27.826 39.187 35.977 221 HG LEU 32 HG LEU 32 27.258 36.552 35.189 222 HD11 LEU 32 HD11 LEU 32 29.304 35.994 36.326 223 HD12 LEU 32 HD12 LEU 32 29.586 37.036 35.167 224 HD13 LEU 32 HD13 LEU 32 29.503 37.527 36.671 225 HD21 LEU 32 HD21 LEU 32 27.195 35.904 37.465 226 HD22 LEU 32 HD22 LEU 32 27.337 37.424 37.888 227 HD23 LEU 32 HD23 LEU 32 26.030 36.928 37.142 228 H GLY 33 H GLY 33 24.176 40.121 33.679 229 HA2 GLY 33 HA2 GLY 33 23.297 42.088 33.485 230 HA3 GLY 33 HA3 GLY 33 24.429 42.692 34.372 231 H MET 34 H MET 34 25.822 41.013 31.832 232 HA MET 34 HA MET 34 26.926 41.457 30.095 233 HB2 MET 34 HB2 MET 34 24.619 41.769 29.350 234 HB3 MET 34 HB3 MET 34 24.916 43.300 29.372 235 HG2 MET 34 HG2 MET 34 25.086 42.464 27.197 236 HG3 MET 34 HG3 MET 34 26.440 43.096 27.646 237 HE1 MET 34 HE1 MET 34 27.240 40.245 25.180 238 HE2 MET 34 HE2 MET 34 25.895 41.081 25.200 239 HE3 MET 34 HE3 MET 34 27.287 41.819 25.352 240 H MET 35 H MET 35 27.618 43.157 32.405 241 HA MET 35 HA MET 35 29.325 44.910 31.259 242 HB2 MET 35 HB2 MET 35 27.580 45.527 33.386 243 HB3 MET 35 HB3 MET 35 28.873 46.370 33.163 244 HG2 MET 35 HG2 MET 35 28.078 46.954 30.981 245 HG3 MET 35 HG3 MET 35 26.762 46.171 31.273 246 HE1 MET 35 HE1 MET 35 27.867 49.862 33.533 247 HE2 MET 35 HE2 MET 35 28.512 48.443 33.813 248 HE3 MET 35 HE3 MET 35 28.819 49.199 32.455 249 H THR 36 H THR 36 30.057 42.285 32.086 250 HA THR 36 HA THR 36 31.882 42.637 34.046 251 HB THR 36 HB THR 36 31.629 40.344 32.482 252 HG1 THR 36 HG1 THR 36 29.964 39.871 33.580 253 HG21 THR 36 HG21 THR 36 32.646 39.203 34.278 254 HG22 THR 36 HG22 THR 36 33.599 40.340 33.724 255 HG23 THR 36 HG23 THR 36 32.777 40.574 35.058 256 H THR 37 H THR 37 34.142 43.027 33.669 257 HA THR 37 HA THR 37 35.077 43.498 31.147 258 HB THR 37 HB THR 37 34.944 45.412 33.193 259 HG1 THR 37 HG1 THR 37 33.768 46.496 31.572 260 HG21 THR 37 HG21 THR 37 35.992 47.012 31.817 261 HG22 THR 37 HG22 THR 37 36.980 45.815 32.140 262 HG23 THR 37 HG23 THR 37 36.258 45.889 30.732 263 H VAL 38 H VAL 38 37.422 43.376 30.908 264 HA VAL 38 HA VAL 38 38.838 42.219 32.892 265 HB VAL 38 HB VAL 38 39.592 42.621 30.238 266 HG11 VAL 38 HG11 VAL 38 41.465 41.231 30.634 267 HG12 VAL 38 HG12 VAL 38 41.544 42.542 31.518 268 HG13 VAL 38 HG13 VAL 38 41.082 41.174 32.170 269 HG21 VAL 38 HG21 VAL 38 39.358 40.234 30.025 270 HG22 VAL 38 HG22 VAL 38 38.877 40.168 31.533 271 HG23 VAL 38 HG23 VAL 38 37.977 40.886 30.446 272 H SER 39 H SER 39 40.045 43.496 34.325 273 HA SER 39 HA SER 39 40.599 46.051 33.871 274 HB2 SER 39 HB2 SER 39 40.935 44.451 36.213 275 HB3 SER 39 HB3 SER 39 41.453 45.922 36.200 276 HG SER 39 HG SER 39 39.493 46.012 37.007 277 H GLY 40 H GLY 40 42.463 43.301 33.490 278 HA2 GLY 40 HA2 GLY 40 44.458 44.231 32.266 279 HA3 GLY 40 HA3 GLY 40 44.911 44.316 33.756 280 H VAL 41 H VAL 41 46.385 42.733 32.054 281 HA VAL 41 HA VAL 41 46.214 40.273 33.154 282 HB VAL 41 HB VAL 41 46.945 39.223 31.298 283 HG11 VAL 41 HG11 VAL 41 45.031 39.448 29.875 284 HG12 VAL 41 HG12 VAL 41 44.605 39.394 31.400 285 HG13 VAL 41 HG13 VAL 41 44.654 40.783 30.639 286 HG21 VAL 41 HG21 VAL 41 47.165 40.255 29.181 287 HG22 VAL 41 HG22 VAL 41 46.940 41.663 29.868 288 HG23 VAL 41 HG23 VAL 41 48.231 40.813 30.211 289 H GLU 42 H GLU 42 48.228 39.144 33.615 290 HA GLU 42 HA GLU 42 50.618 40.445 33.544 291 HB2 GLU 42 HB2 GLU 42 49.668 40.802 35.692 292 HB3 GLU 42 HB3 GLU 42 49.518 39.261 35.880 293 HG2 GLU 42 HG2 GLU 42 51.334 39.907 37.119 294 HG3 GLU 42 HG3 GLU 42 51.884 39.058 35.932 295 H MET 43 H MET 43 52.374 39.052 32.915 296 HA MET 43 HA MET 43 51.825 36.422 32.560 297 HB2 MET 43 HB2 MET 43 53.375 38.044 30.810 298 HB3 MET 43 HB3 MET 43 53.238 36.503 30.614 299 HG2 MET 43 HG2 MET 43 50.825 36.914 30.404 300 HG3 MET 43 HG3 MET 43 51.205 38.417 30.231 301 HE1 MET 43 HE1 MET 43 53.200 38.475 26.966 302 HE2 MET 43 HE2 MET 43 52.643 39.389 28.133 303 HE3 MET 43 HE3 MET 43 53.793 38.340 28.429 304 H SER 44 H SER 44 53.375 34.810 33.092 305 HA SER 44 HA SER 44 55.494 35.291 34.602 306 HB2 SER 44 HB2 SER 44 54.291 33.245 34.752 307 HB3 SER 44 HB3 SER 44 54.701 32.886 33.291 308 HG SER 44 HG SER 44 56.499 32.227 33.986 309 H ARG 45 H ARG 45 57.773 35.098 34.097 310 HA ARG 45 HA ARG 45 58.720 35.938 31.798 311 HB2 ARG 45 HB2 ARG 45 59.762 36.131 34.011 312 HB3 ARG 45 HB3 ARG 45 60.193 34.639 33.868 313 HG2 ARG 45 HG2 ARG 45 61.591 35.175 32.053 314 HG3 ARG 45 HG3 ARG 45 61.096 36.654 32.072 315 HD2 ARG 45 HD2 ARG 45 62.026 36.803 34.348 316 HD3 ARG 45 HD3 ARG 45 62.724 35.437 34.066 317 HE ARG 45 HE ARG 45 63.365 37.778 32.790 318 HH11 ARG 45 HH11 ARG 45 65.349 38.190 32.111 319 HH12 ARG 45 HH12 ARG 45 66.355 37.102 31.962 320 HH21 ARG 45 HH21 ARG 45 64.489 34.667 33.041 321 HH22 ARG 45 HH22 ARG 45 65.843 35.003 32.518 322 H ASP 46 H ASP 46 58.310 32.706 32.781 323 HA ASP 46 HA ASP 46 59.557 31.567 30.728 324 HB2 ASP 46 HB2 ASP 46 59.125 29.547 31.856 325 HB3 ASP 46 HB3 ASP 46 59.753 30.564 32.858 326 H LEU 47 H LEU 47 56.646 32.835 30.685 327 HA LEU 47 HA LEU 47 54.777 32.653 29.769 328 HB2 LEU 47 HB2 LEU 47 56.350 31.593 27.650 329 HB3 LEU 47 HB3 LEU 47 54.893 32.110 27.440 330 HG LEU 47 HG LEU 47 56.998 33.798 28.276 331 HD11 LEU 47 HD11 LEU 47 56.993 34.661 26.031 332 HD12 LEU 47 HD12 LEU 47 57.341 33.115 26.014 333 HD13 LEU 47 HD13 LEU 47 55.879 33.603 25.645 334 HD21 LEU 47 HD21 LEU 47 55.581 35.624 27.770 335 HD22 LEU 47 HD22 LEU 47 54.425 34.612 27.388 336 HD23 LEU 47 HD23 LEU 47 54.924 34.715 28.887 337 H ALA 48 H ALA 48 55.320 30.307 31.461 338 HA ALA 48 HA ALA 48 53.600 28.433 30.533 339 HB1 ALA 48 HB1 ALA 48 54.345 27.221 32.424 340 HB2 ALA 48 HB2 ALA 48 55.588 27.710 31.575 341 HB3 ALA 48 HB3 ALA 48 55.181 28.481 32.897 342 H TYR 49 H TYR 49 53.232 31.088 32.588 343 HA TYR 49 HA TYR 49 50.699 30.462 33.250 344 HB2 TYR 49 HB2 TYR 49 52.566 31.354 35.220 345 HB3 TYR 49 HB3 TYR 49 51.070 31.036 35.525 346 HD1 TYR 49 HD1 TYR 49 50.323 28.696 35.754 347 HD2 TYR 49 HD2 TYR 49 54.215 29.541 35.055 348 HE1 TYR 49 HE1 TYR 49 50.885 26.465 36.164 349 HE2 TYR 49 HE2 TYR 49 54.771 27.298 35.347 350 HH TYR 49 HH TYR 49 54.015 25.229 35.813 351 H ALA 50 H ALA 50 49.205 32.224 33.441 352 HA ALA 50 HA ALA 50 50.018 34.770 33.562 353 HB1 ALA 50 HB1 ALA 50 48.597 35.426 31.776 354 HB2 ALA 50 HB2 ALA 50 49.725 34.443 31.254 355 HB3 ALA 50 HB3 ALA 50 48.257 33.902 31.504 356 H LYS 51 H LYS 51 48.635 36.239 34.661 357 HA LYS 51 HA LYS 51 46.424 35.361 35.891 358 HB2 LYS 51 HB2 LYS 51 47.707 37.789 36.562 359 HB3 LYS 51 HB3 LYS 51 46.654 37.044 37.438 360 HG2 LYS 51 HG2 LYS 51 48.315 35.301 37.795 361 HG3 LYS 51 HG3 LYS 51 49.354 36.231 37.097 362 HD2 LYS 51 HD2 LYS 51 48.069 36.781 39.572 363 HD3 LYS 51 HD3 LYS 51 49.599 36.536 39.390 364 HE2 LYS 51 HE2 LYS 51 49.762 38.598 38.185 365 HE3 LYS 51 HE3 LYS 51 48.243 38.849 38.437 366 HZ1 LYS 51 HZ1 LYS 51 49.171 39.960 40.046 367 HZ2 LYS 51 HZ2 LYS 51 48.876 38.720 40.746 368 HZ3 LYS 51 HZ3 LYS 51 50.224 38.986 40.277 369 H VAL 52 H VAL 52 44.330 36.328 35.404 370 HA VAL 52 HA VAL 52 44.170 38.635 33.968 371 HB VAL 52 HB VAL 52 42.240 36.603 33.952 372 HG11 VAL 52 HG11 VAL 52 41.178 37.808 32.184 373 HG12 VAL 52 HG12 VAL 52 41.230 38.680 33.505 374 HG13 VAL 52 HG13 VAL 52 42.265 38.950 32.337 375 HG21 VAL 52 HG21 VAL 52 42.836 36.136 31.699 376 HG22 VAL 52 HG22 VAL 52 44.017 37.184 31.814 377 HG23 VAL 52 HG23 VAL 52 44.051 35.856 32.676 378 H TYR 53 H TYR 53 43.231 40.404 35.074 379 HA TYR 53 HA TYR 53 41.819 40.079 37.353 380 HB2 TYR 53 HB2 TYR 53 42.650 42.581 36.355 381 HB3 TYR 53 HB3 TYR 53 42.256 42.263 37.830 382 HD1 TYR 53 HD1 TYR 53 43.967 40.402 38.921 383 HD2 TYR 53 HD2 TYR 53 44.899 43.063 36.018 384 HE1 TYR 53 HE1 TYR 53 46.227 40.182 39.453 385 HE2 TYR 53 HE2 TYR 53 47.164 42.838 36.532 386 HH TYR 53 HH TYR 53 48.698 41.890 37.865 387 H VAL 54 H VAL 54 39.529 40.511 37.466 388 HA VAL 54 HA VAL 54 38.203 41.447 35.278 389 HB VAL 54 HB VAL 54 37.335 39.255 36.787 390 HG11 VAL 54 HG11 VAL 54 35.728 38.859 35.057 391 HG12 VAL 54 HG12 VAL 54 35.513 40.286 35.710 392 HG13 VAL 54 HG13 VAL 54 36.246 40.156 34.312 393 HG21 VAL 54 HG21 VAL 54 37.867 37.829 34.923 394 HG22 VAL 54 HG22 VAL 54 38.493 39.078 34.177 395 HG23 VAL 54 HG23 VAL 54 39.175 38.516 35.492 396 H THR 55 H THR 55 36.324 42.761 35.711 397 HA THR 55 HA THR 55 35.632 43.369 38.259 398 HB THR 55 HB THR 55 37.086 44.975 37.390 399 HG1 THR 55 HG1 THR 55 35.837 45.794 38.895 400 HG21 THR 55 HG21 THR 55 36.375 46.599 35.877 401 HG22 THR 55 HG22 THR 55 36.502 45.177 35.194 402 HG23 THR 55 HG23 THR 55 35.076 45.740 35.590 403 H PHE 56 H PHE 56 33.412 43.727 38.676 404 HA PHE 56 HA PHE 56 31.682 42.889 36.753 405 HB2 PHE 56 HB2 PHE 56 31.700 42.136 39.498 406 HB3 PHE 56 HB3 PHE 56 30.561 41.707 38.522 407 HD1 PHE 56 HD1 PHE 56 34.058 41.166 39.087 408 HD2 PHE 56 HD2 PHE 56 30.777 39.682 37.238 409 HE1 PHE 56 HE1 PHE 56 35.235 39.233 38.561 410 HE2 PHE 56 HE2 PHE 56 31.944 37.719 36.770 411 HZ PHE 56 HZ PHE 56 34.179 37.490 37.417 412 H LEU 57 H LEU 57 29.735 44.075 36.393 413 HA LEU 57 HA LEU 57 28.745 45.914 38.036 414 HB2 LEU 57 HB2 LEU 57 28.111 45.900 35.785 415 HB3 LEU 57 HB3 LEU 57 27.525 44.461 35.923 416 HG LEU 57 HG LEU 57 25.821 45.282 37.301 417 HD11 LEU 57 HD11 LEU 57 25.435 47.604 37.517 418 HD12 LEU 57 HD12 LEU 57 26.812 47.200 38.189 419 HD13 LEU 57 HD13 LEU 57 26.798 47.887 36.762 420 HD21 LEU 57 HD21 LEU 57 24.564 46.417 35.610 421 HD22 LEU 57 HD22 LEU 57 25.900 46.629 34.787 422 HD23 LEU 57 HD23 LEU 57 25.320 45.170 34.993 423 H ASN 58 H ASN 58 28.367 42.516 38.019 424 HA ASN 58 HA ASN 58 26.423 42.301 39.864 425 HB2 ASN 58 HB2 ASN 58 27.027 40.778 37.887 426 HB3 ASN 58 HB3 ASN 58 27.769 40.017 39.028 427 HD21 ASN 58 HD21 ASN 58 23.852 40.134 39.082 428 HD22 ASN 58 HD22 ASN 58 24.608 41.235 38.423 429 H ASP 59 H ASP 59 29.192 43.387 40.555 430 HA ASP 59 HA ASP 59 30.207 42.277 42.659 431 HB2 ASP 59 HB2 ASP 59 31.254 44.040 41.467 432 HB3 ASP 59 HB3 ASP 59 30.110 45.019 41.873 433 H LYS 60 H LYS 60 27.143 43.512 42.582 434 HA LYS 60 HA LYS 60 26.776 44.532 44.954 435 HB2 LYS 60 HB2 LYS 60 25.350 44.688 42.895 436 HB3 LYS 60 HB3 LYS 60 24.693 43.369 43.403 437 HG2 LYS 60 HG2 LYS 60 24.526 45.086 45.458 438 HG3 LYS 60 HG3 LYS 60 24.084 45.895 44.200 439 HD2 LYS 60 HD2 LYS 60 22.463 44.177 43.728 440 HD3 LYS 60 HD3 LYS 60 22.854 43.486 45.071 441 HE2 LYS 60 HE2 LYS 60 20.952 44.693 45.544 442 HE3 LYS 60 HE3 LYS 60 22.113 45.469 46.240 443 HZ1 LYS 60 HZ1 LYS 60 20.781 46.898 45.085 444 HZ2 LYS 60 HZ2 LYS 60 22.111 46.935 44.501 445 HZ3 LYS 60 HZ3 LYS 60 21.046 46.205 43.834 446 H ASP 61 H ASP 61 27.054 41.252 44.329 447 HA ASP 61 HA ASP 61 26.978 40.708 46.978 448 HB2 ASP 61 HB2 ASP 61 24.921 39.925 46.027 449 HB3 ASP 61 HB3 ASP 61 25.744 38.987 45.091 450 H GLU 62 H GLU 62 29.039 40.056 47.566 451 HA GLU 62 HA GLU 62 30.961 39.530 45.953 452 HB2 GLU 62 HB2 GLU 62 31.075 38.732 48.681 453 HB3 GLU 62 HB3 GLU 62 32.301 39.147 47.811 454 HG2 GLU 62 HG2 GLU 62 32.069 40.928 49.140 455 HG3 GLU 62 HG3 GLU 62 31.346 41.415 47.847 456 H ASP 63 H ASP 63 28.900 37.275 47.426 457 HA ASP 63 HA ASP 63 30.021 34.963 46.843 458 HB2 ASP 63 HB2 ASP 63 28.441 35.218 48.603 459 HB3 ASP 63 HB3 ASP 63 27.356 35.687 47.586 460 H ALA 64 H ALA 64 27.808 36.826 44.961 461 HA ALA 64 HA ALA 64 27.461 35.125 42.980 462 HB1 ALA 64 HB1 ALA 64 26.496 36.977 41.870 463 HB2 ALA 64 HB2 ALA 64 25.906 36.852 43.334 464 HB3 ALA 64 HB3 ALA 64 27.021 37.933 43.019 465 H VAL 65 H VAL 65 29.848 37.609 43.370 466 HA VAL 65 HA VAL 65 31.101 37.400 41.089 467 HB VAL 65 HB VAL 65 32.091 38.432 43.507 468 HG11 VAL 65 HG11 VAL 65 33.854 39.429 42.286 469 HG12 VAL 65 HG12 VAL 65 33.939 37.850 42.185 470 HG13 VAL 65 HG13 VAL 65 33.353 38.689 40.977 471 HG21 VAL 65 HG21 VAL 65 31.708 40.563 42.496 472 HG22 VAL 65 HG22 VAL 65 31.148 39.834 41.206 473 HG23 VAL 65 HG23 VAL 65 30.353 39.745 42.573 474 H LYS 66 H LYS 66 31.889 35.713 44.095 475 HA LYS 66 HA LYS 66 33.989 34.400 43.246 476 HB2 LYS 66 HB2 LYS 66 33.614 34.634 45.530 477 HB3 LYS 66 HB3 LYS 66 32.296 33.805 45.434 478 HG2 LYS 66 HG2 LYS 66 33.984 32.464 46.351 479 HG3 LYS 66 HG3 LYS 66 33.514 31.844 45.000 480 HD2 LYS 66 HD2 LYS 66 35.437 32.641 43.913 481 HD3 LYS 66 HD3 LYS 66 35.882 33.408 45.196 482 HE2 LYS 66 HE2 LYS 66 36.169 31.330 46.334 483 HE3 LYS 66 HE3 LYS 66 35.731 30.566 45.048 484 HZ1 LYS 66 HZ1 LYS 66 37.995 30.620 45.190 485 HZ2 LYS 66 HZ2 LYS 66 37.601 31.361 44.004 486 HZ3 LYS 66 HZ3 LYS 66 38.010 32.074 45.203 487 H ALA 67 H ALA 67 30.689 33.266 43.162 488 HA ALA 67 HA ALA 67 31.110 30.955 41.989 489 HB1 ALA 67 HB1 ALA 67 28.766 31.020 41.601 490 HB2 ALA 67 HB2 ALA 67 29.076 31.441 43.096 491 HB3 ALA 67 HB3 ALA 67 28.749 32.550 42.014 492 H GLY 68 H GLY 68 30.661 34.036 40.458 493 HA2 GLY 68 HA2 GLY 68 30.643 33.379 37.935 494 HA3 GLY 68 HA3 GLY 68 31.038 34.781 38.492 495 H ILE 69 H ILE 69 33.451 34.328 39.819 496 HA ILE 69 HA ILE 69 35.362 33.970 38.102 497 HB ILE 69 HB ILE 69 35.439 33.970 40.891 498 HG12 ILE 69 HG12 ILE 69 35.029 36.102 39.923 499 HG13 ILE 69 HG13 ILE 69 36.294 36.113 40.835 500 HG21 ILE 69 HG21 ILE 69 37.821 34.112 40.854 501 HG22 ILE 69 HG22 ILE 69 37.318 32.723 40.280 502 HG23 ILE 69 HG23 ILE 69 37.788 33.866 39.289 503 HD11 ILE 69 HD11 ILE 69 36.733 37.333 38.876 504 HD12 ILE 69 HD12 ILE 69 37.690 36.072 38.920 505 HD13 ILE 69 HD13 ILE 69 36.405 36.059 37.993 506 H LYS 70 H LYS 70 34.072 31.565 40.310 507 HA LYS 70 HA LYS 70 35.554 29.515 39.681 508 HB2 LYS 70 HB2 LYS 70 34.180 29.609 41.636 509 HB3 LYS 70 HB3 LYS 70 32.923 29.408 40.735 510 HG2 LYS 70 HG2 LYS 70 33.737 27.258 40.088 511 HG3 LYS 70 HG3 LYS 70 34.985 27.460 41.001 512 HD2 LYS 70 HD2 LYS 70 33.506 27.560 42.910 513 HD3 LYS 70 HD3 LYS 70 32.316 27.216 41.962 514 HE2 LYS 70 HE2 LYS 70 33.387 25.145 41.406 515 HE3 LYS 70 HE3 LYS 70 34.531 25.484 42.411 516 HZ1 LYS 70 HZ1 LYS 70 33.011 24.115 43.393 517 HZ2 LYS 70 HZ2 LYS 70 33.000 25.382 44.104 518 HZ3 LYS 70 HZ3 LYS 70 31.936 25.066 43.168 519 H ALA 71 H ALA 71 32.548 30.376 38.134 520 HA ALA 71 HA ALA 71 32.442 28.415 36.389 521 HB1 ALA 71 HB1 ALA 71 30.771 29.755 35.370 522 HB2 ALA 71 HB2 ALA 71 30.532 29.690 36.934 523 HB3 ALA 71 HB3 ALA 71 31.198 30.973 36.288 524 H LEU 72 H LEU 72 33.987 31.464 36.012 525 HA LEU 72 HA LEU 72 34.908 31.252 33.527 526 HB2 LEU 72 HB2 LEU 72 34.575 33.344 34.535 527 HB3 LEU 72 HB3 LEU 72 35.524 32.969 35.713 528 HG LEU 72 HG LEU 72 37.369 33.087 34.292 529 HD11 LEU 72 HD11 LEU 72 37.222 33.935 32.119 530 HD12 LEU 72 HD12 LEU 72 36.448 32.558 32.235 531 HD13 LEU 72 HD13 LEU 72 35.642 33.922 32.226 532 HD21 LEU 72 HD21 LEU 72 37.320 35.479 33.995 533 HD22 LEU 72 HD22 LEU 72 35.748 35.451 34.194 534 HD23 LEU 72 HD23 LEU 72 36.705 35.097 35.405 535 H GLN 73 H GLN 73 36.462 30.357 36.492 536 HA GLN 73 HA GLN 73 38.758 29.523 35.476 537 HB2 GLN 73 HB2 GLN 73 38.373 30.253 37.762 538 HB3 GLN 73 HB3 GLN 73 37.722 28.859 38.018 539 HG2 GLN 73 HG2 GLN 73 39.903 28.769 38.786 540 HG3 GLN 73 HG3 GLN 73 39.793 27.806 37.565 541 HE21 GLN 73 HE21 GLN 73 41.384 28.061 35.959 542 HE22 GLN 73 HE22 GLN 73 42.230 29.273 35.773 543 H GLU 74 H GLU 74 35.861 27.703 36.101 544 HA GLU 74 HA GLU 74 36.664 25.363 35.269 545 HB2 GLU 74 HB2 GLU 74 34.050 26.439 35.612 546 HB3 GLU 74 HB3 GLU 74 34.215 24.993 35.053 547 HG2 GLU 74 HG2 GLU 74 35.310 24.345 37.067 548 HG3 GLU 74 HG3 GLU 74 35.125 25.790 37.627 549 H ALA 75 H ALA 75 35.837 28.037 33.382 550 HA ALA 75 HA ALA 75 35.722 26.770 31.022 551 HB1 ALA 75 HB1 ALA 75 35.181 28.948 30.184 552 HB2 ALA 75 HB2 ALA 75 34.204 28.560 31.368 553 HB3 ALA 75 HB3 ALA 75 35.414 29.547 31.631 554 H SER 76 H SER 76 38.354 27.609 32.705 555 HA SER 76 HA SER 76 39.670 29.265 31.263 556 HB2 SER 76 HB2 SER 76 41.495 28.859 32.670 557 HB3 SER 76 HB3 SER 76 40.214 28.826 33.558 558 HG SER 76 HG SER 76 40.424 26.775 33.806 559 H GLY 77 H GLY 77 39.959 25.833 30.918 560 HA2 GLY 77 HA2 GLY 77 41.962 25.707 29.240 561 HA3 GLY 77 HA3 GLY 77 40.938 24.562 29.513 562 H PHE 78 H PHE 78 38.536 25.781 28.520 563 HA PHE 78 HA PHE 78 38.603 25.604 25.924 564 HB2 PHE 78 HB2 PHE 78 36.587 26.830 27.501 565 HB3 PHE 78 HB3 PHE 78 36.391 26.461 25.998 566 HD1 PHE 78 HD1 PHE 78 35.808 25.305 29.134 567 HD2 PHE 78 HD2 PHE 78 36.622 23.895 25.427 568 HE1 PHE 78 HE1 PHE 78 34.898 23.233 29.719 569 HE2 PHE 78 HE2 PHE 78 35.636 21.854 25.995 570 HZ PHE 78 HZ PHE 78 34.776 21.522 28.134 571 H ILE 79 H ILE 79 38.650 28.452 27.894 572 HA ILE 79 HA ILE 79 38.809 30.370 26.106 573 HB ILE 79 HB ILE 79 39.480 30.384 28.849 574 HG12 ILE 79 HG12 ILE 79 37.192 31.563 27.625 575 HG13 ILE 79 HG13 ILE 79 37.136 30.132 28.242 576 HG21 ILE 79 HG21 ILE 79 39.581 32.729 28.799 577 HG22 ILE 79 HG22 ILE 79 40.713 32.107 27.884 578 HG23 ILE 79 HG23 ILE 79 39.401 32.701 27.226 579 HD11 ILE 79 HD11 ILE 79 36.212 31.668 29.749 580 HD12 ILE 79 HD12 ILE 79 37.512 31.031 30.394 581 HD13 ILE 79 HD13 ILE 79 37.569 32.484 29.767 582 H ARG 80 H ARG 80 41.431 28.665 27.643 583 HA ARG 80 HA ARG 80 43.479 29.847 26.524 584 HB2 ARG 80 HB2 ARG 80 43.801 28.545 28.434 585 HB3 ARG 80 HB3 ARG 80 43.286 27.268 27.702 586 HG2 ARG 80 HG2 ARG 80 45.180 27.092 26.448 587 HG3 ARG 80 HG3 ARG 80 45.614 28.556 26.764 588 HD2 ARG 80 HD2 ARG 80 46.959 26.939 27.893 589 HD3 ARG 80 HD3 ARG 80 46.343 27.989 28.866 590 HE ARG 80 HE ARG 80 45.305 26.376 29.886 591 HH11 ARG 80 HH11 ARG 80 44.773 24.340 30.453 592 HH12 ARG 80 HH12 ARG 80 44.797 23.235 29.453 593 HH21 ARG 80 HH21 ARG 80 45.865 24.967 26.947 594 HH22 ARG 80 HH22 ARG 80 45.440 23.607 27.384 595 H SER 81 H SER 81 41.764 27.094 25.247 596 HA SER 81 HA SER 81 43.169 26.733 23.087 597 HB2 SER 81 HB2 SER 81 41.510 25.169 23.961 598 HB3 SER 81 HB3 SER 81 40.417 26.057 23.292 599 HG SER 81 HG SER 81 41.057 24.449 21.929 600 H LEU 82 H LEU 82 40.345 28.759 23.426 601 HA LEU 82 HA LEU 82 40.149 29.647 20.974 602 HB2 LEU 82 HB2 LEU 82 39.137 30.695 23.407 603 HB3 LEU 82 HB3 LEU 82 38.825 31.398 22.051 604 HG LEU 82 HG LEU 82 38.025 28.738 22.572 605 HD11 LEU 82 HD11 LEU 82 35.837 29.605 22.947 606 HD12 LEU 82 HD12 LEU 82 36.848 30.209 24.007 607 HD13 LEU 82 HD13 LEU 82 36.401 31.073 22.757 608 HD21 LEU 82 HD21 LEU 82 36.587 28.966 20.716 609 HD22 LEU 82 HD22 LEU 82 37.133 30.433 20.480 610 HD23 LEU 82 HD23 LEU 82 38.090 29.189 20.272 611 H LEU 83 H LEU 83 41.954 31.008 23.608 612 HA LEU 83 HA LEU 83 42.860 33.210 22.482 613 HB2 LEU 83 HB2 LEU 83 42.675 32.944 24.824 614 HB3 LEU 83 HB3 LEU 83 43.773 31.838 24.788 615 HG LEU 83 HG LEU 83 45.370 33.449 24.120 616 HD11 LEU 83 HD11 LEU 83 44.876 35.743 24.187 617 HD12 LEU 83 HD12 LEU 83 44.010 35.024 23.073 618 HD13 LEU 83 HD13 LEU 83 43.355 35.404 24.464 619 HD21 LEU 83 HD21 LEU 83 45.525 34.553 26.234 620 HD22 LEU 83 HD22 LEU 83 44.026 34.146 26.542 621 HD23 LEU 83 HD23 LEU 83 45.147 33.031 26.446 622 H GLY 84 H GLY 84 44.461 30.138 22.767 623 HA2 GLY 84 HA2 GLY 84 46.693 30.600 21.540 624 HA3 GLY 84 HA3 GLY 84 46.035 29.193 21.685 625 H LYS 85 H LYS 85 43.668 29.687 20.125 626 HA LYS 85 HA LYS 85 44.381 29.578 17.561 627 HB2 LYS 85 HB2 LYS 85 42.557 28.315 18.495 628 HB3 LYS 85 HB3 LYS 85 41.751 29.644 18.627 629 HG2 LYS 85 HG2 LYS 85 41.501 29.853 16.369 630 HG3 LYS 85 HG3 LYS 85 42.669 28.863 16.070 631 HD2 LYS 85 HD2 LYS 85 40.733 27.727 15.569 632 HD3 LYS 85 HD3 LYS 85 41.295 27.064 16.863 633 HE2 LYS 85 HE2 LYS 85 39.749 28.336 18.168 634 HE3 LYS 85 HE3 LYS 85 39.169 28.954 16.858 635 HZ1 LYS 85 HZ1 LYS 85 37.890 27.204 17.528 636 HZ2 LYS 85 HZ2 LYS 85 38.479 26.868 16.243 637 HZ3 LYS 85 HZ3 LYS 85 39.018 26.291 17.462 638 H ALA 86 H ALA 86 43.031 32.200 19.320 639 HA ALA 86 HA ALA 86 42.709 33.902 17.324 640 HB1 ALA 86 HB1 ALA 86 42.324 35.456 19.083 641 HB2 ALA 86 HB2 ALA 86 41.499 34.129 19.347 642 HB3 ALA 86 HB3 ALA 86 42.852 34.389 20.129 643 H MET 87 H MET 87 45.362 33.568 19.501 644 HA MET 87 HA MET 87 46.885 35.471 18.404 645 HB2 MET 87 HB2 MET 87 47.338 33.823 20.695 646 HB3 MET 87 HB3 MET 87 48.410 34.851 20.217 647 HG2 MET 87 HG2 MET 87 45.799 35.669 20.971 648 HG3 MET 87 HG3 MET 87 46.978 35.670 21.992 649 HE1 MET 87 HE1 MET 87 45.759 39.267 20.656 650 HE2 MET 87 HE2 MET 87 44.943 37.938 20.376 651 HE3 MET 87 HE3 MET 87 45.462 38.254 21.837 652 H ARG 88 H ARG 88 46.579 32.253 17.700 653 HA ARG 88 HA ARG 88 47.551 30.838 16.435 654 HB2 ARG 88 HB2 ARG 88 48.489 33.116 15.047 655 HB3 ARG 88 HB3 ARG 88 48.276 31.705 14.417 656 HG2 ARG 88 HG2 ARG 88 45.947 31.934 14.593 657 HG3 ARG 88 HG3 ARG 88 46.109 33.292 15.343 658 HD2 ARG 88 HD2 ARG 88 45.555 33.764 13.142 659 HD3 ARG 88 HD3 ARG 88 47.013 34.265 13.381 660 HE ARG 88 HE ARG 88 47.470 31.985 12.427 661 HH11 ARG 88 HH11 ARG 88 47.612 31.213 10.440 662 HH12 ARG 88 HH12 ARG 88 46.937 31.885 9.295 663 HH21 ARG 88 HH21 ARG 88 45.583 34.299 10.975 664 HH22 ARG 88 HH22 ARG 88 45.729 33.717 9.613 665 H LEU 89 H LEU 89 48.903 30.698 18.670 666 HA LEU 89 HA LEU 89 51.587 31.054 18.298 667 HB2 LEU 89 HB2 LEU 89 50.673 32.847 19.535 668 HB3 LEU 89 HB3 LEU 89 50.006 31.845 20.527 669 HG LEU 89 HG LEU 89 52.103 31.263 21.372 670 HD11 LEU 89 HD11 LEU 89 54.033 32.472 20.807 671 HD12 LEU 89 HD12 LEU 89 53.483 31.684 19.547 672 HD13 LEU 89 HD13 LEU 89 53.219 33.240 19.686 673 HD21 LEU 89 HD21 LEU 89 52.518 33.331 22.504 674 HD22 LEU 89 HD22 LEU 89 51.635 34.082 21.423 675 HD23 LEU 89 HD23 LEU 89 50.960 33.059 22.427 676 H ARG 90 H ARG 90 53.024 29.498 19.072 677 HA ARG 90 HA ARG 90 52.053 27.092 19.632 678 HB2 ARG 90 HB2 ARG 90 54.146 26.286 19.064 679 HB3 ARG 90 HB3 ARG 90 53.822 27.408 18.031 680 HG2 ARG 90 HG2 ARG 90 55.170 28.914 19.415 681 HG3 ARG 90 HG3 ARG 90 55.641 27.651 20.199 682 HD2 ARG 90 HD2 ARG 90 56.495 26.719 18.167 683 HD3 ARG 90 HD3 ARG 90 56.042 27.996 17.397 684 HE ARG 90 HE ARG 90 58.194 27.890 19.079 685 HH11 ARG 90 HH11 ARG 90 59.883 29.292 18.620 686 HH12 ARG 90 HH12 ARG 90 59.602 30.590 17.949 687 HH21 ARG 90 HH21 ARG 90 56.484 30.182 17.410 688 HH22 ARG 90 HH22 ARG 90 57.641 31.105 17.250 689 H ILE 91 H ILE 91 53.045 29.300 21.851 690 HA ILE 91 HA ILE 91 52.325 27.545 23.751 691 HB ILE 91 HB ILE 91 54.575 27.664 23.992 692 HG12 ILE 91 HG12 ILE 91 54.846 28.190 26.313 693 HG13 ILE 91 HG13 ILE 91 53.355 28.648 26.326 694 HG21 ILE 91 HG21 ILE 91 55.600 29.730 24.787 695 HG22 ILE 91 HG22 ILE 91 54.974 29.926 23.346 696 HG23 ILE 91 HG23 ILE 91 54.195 30.441 24.624 697 HD11 ILE 91 HD11 ILE 91 53.509 26.469 27.174 698 HD12 ILE 91 HD12 ILE 91 52.661 26.441 25.838 699 HD13 ILE 91 HD13 ILE 91 54.174 25.976 25.824 700 H VAL 92 H VAL 92 50.339 28.346 24.481 701 HA VAL 92 HA VAL 92 49.996 30.946 25.206 702 HB VAL 92 HB VAL 92 48.421 30.300 23.774 703 HG11 VAL 92 HG11 VAL 92 46.779 28.660 24.215 704 HG12 VAL 92 HG12 VAL 92 48.219 28.020 24.063 705 HG13 VAL 92 HG13 VAL 92 47.592 28.224 25.503 706 HG21 VAL 92 HG21 VAL 92 46.450 30.883 25.016 707 HG22 VAL 92 HG22 VAL 92 47.264 30.657 26.356 708 HG23 VAL 92 HG23 VAL 92 47.659 31.839 25.379 709 HA PRO 93 HA PRO 93 50.789 29.669 29.276 710 HB2 PRO 93 HB2 PRO 93 49.793 32.112 30.264 711 HB3 PRO 93 HB3 PRO 93 51.230 31.547 30.487 712 HG2 PRO 93 HG2 PRO 93 50.922 33.495 28.839 713 HG3 PRO 93 HG3 PRO 93 52.008 32.421 28.522 714 HD2 PRO 93 HD2 PRO 93 49.410 32.572 27.398 715 HD3 PRO 93 HD3 PRO 93 50.723 32.192 26.646 716 H GLU 94 H GLU 94 49.770 28.789 31.208 717 HA GLU 94 HA GLU 94 47.164 28.300 31.090 718 HB2 GLU 94 HB2 GLU 94 48.674 26.696 31.966 719 HB3 GLU 94 HB3 GLU 94 48.942 27.629 33.187 720 HG2 GLU 94 HG2 GLU 94 47.445 26.012 33.893 721 HG3 GLU 94 HG3 GLU 94 46.670 27.365 33.870 722 H LEU 95 H LEU 95 45.415 29.100 32.399 723 HA LEU 95 HA LEU 95 45.795 31.704 33.003 724 HB2 LEU 95 HB2 LEU 95 43.393 30.535 32.041 725 HB3 LEU 95 HB3 LEU 95 43.612 32.068 32.231 726 HG LEU 95 HG LEU 95 44.939 30.515 30.285 727 HD11 LEU 95 HD11 LEU 95 43.606 31.698 28.678 728 HD12 LEU 95 HD12 LEU 95 42.672 30.899 29.678 729 HD13 LEU 95 HD13 LEU 95 42.881 32.458 29.865 730 HD21 LEU 95 HD21 LEU 95 45.787 32.527 29.367 731 HD22 LEU 95 HD22 LEU 95 45.124 33.336 30.556 732 HD23 LEU 95 HD23 LEU 95 46.312 32.329 30.848 733 H THR 96 H THR 96 45.312 32.603 34.982 734 HA THR 96 HA THR 96 43.606 31.392 36.703 735 HB THR 96 HB THR 96 45.853 32.856 37.523 736 HG1 THR 96 HG1 THR 96 46.587 30.863 38.230 737 HG21 THR 96 HG21 THR 96 45.376 32.087 39.729 738 HG22 THR 96 HG22 THR 96 44.162 32.933 39.168 739 HG23 THR 96 HG23 THR 96 44.087 31.352 39.175 740 H PHE 97 H PHE 97 41.811 32.699 37.274 741 HA PHE 97 HA PHE 97 41.734 35.317 36.563 742 HB2 PHE 97 HB2 PHE 97 39.576 33.485 36.821 743 HB3 PHE 97 HB3 PHE 97 39.367 34.984 36.445 744 HD1 PHE 97 HD1 PHE 97 39.902 35.784 34.173 745 HD2 PHE 97 HD2 PHE 97 40.377 31.875 35.129 746 HE1 PHE 97 HE1 PHE 97 40.144 35.252 31.907 747 HE2 PHE 97 HE2 PHE 97 40.611 31.358 32.863 748 HZ PHE 97 HZ PHE 97 40.506 33.047 31.260 749 H PHE 98 H PHE 98 41.206 36.993 37.965 750 HA PHE 98 HA PHE 98 40.616 36.569 40.569 751 HB2 PHE 98 HB2 PHE 98 42.624 38.343 39.612 752 HB3 PHE 98 HB3 PHE 98 42.187 38.300 41.108 753 HD1 PHE 98 HD1 PHE 98 42.875 36.384 42.551 754 HD2 PHE 98 HD2 PHE 98 44.241 36.739 38.748 755 HE1 PHE 98 HE1 PHE 98 44.569 34.841 43.009 756 HE2 PHE 98 HE2 PHE 98 45.930 35.194 39.220 757 HZ PHE 98 HZ PHE 98 46.106 34.263 41.349 758 H TYR 99 H TYR 99 39.627 38.492 41.687 759 HA TYR 99 HA TYR 99 38.069 40.040 40.118 760 HB2 TYR 99 HB2 TYR 99 36.613 40.269 41.893 761 HB3 TYR 99 HB3 TYR 99 36.850 38.754 41.608 762 HD1 TYR 99 HD1 TYR 99 37.042 41.171 44.079 763 HD2 TYR 99 HD2 TYR 99 38.327 37.436 43.196 764 HE1 TYR 99 HE1 TYR 99 37.558 40.809 46.331 765 HE2 TYR 99 HE2 TYR 99 38.941 37.112 45.425 766 HH TYR 99 HH TYR 99 38.976 37.961 47.507 767 H ASP 100 H ASP 100 38.119 42.279 40.032 768 HA ASP 100 HA ASP 100 39.644 43.802 41.692 769 HB2 ASP 100 HB2 ASP 100 40.901 43.583 39.748 770 HB3 ASP 100 HB3 ASP 100 39.661 43.888 38.853 Start of MODEL 13 1 HA PRO 8 HA PRO 8 56.145 42.290 26.296 2 HB2 PRO 8 HB2 PRO 8 54.576 40.377 26.980 3 HB3 PRO 8 HB3 PRO 8 56.086 40.037 26.792 4 HG2 PRO 8 HG2 PRO 8 54.786 40.566 29.276 5 HG3 PRO 8 HG3 PRO 8 55.781 39.399 28.993 6 HD2 PRO 8 HD2 PRO 8 56.664 41.562 30.090 7 HD3 PRO 8 HD3 PRO 8 57.603 40.745 29.152 8 H GLN 9 H GLN 9 55.499 44.649 27.559 9 HA GLN 9 HA GLN 9 53.027 44.921 28.348 10 HB2 GLN 9 HB2 GLN 9 54.893 46.377 28.895 11 HB3 GLN 9 HB3 GLN 9 54.825 46.946 27.445 12 HG2 GLN 9 HG2 GLN 9 52.577 47.231 29.098 13 HG3 GLN 9 HG3 GLN 9 53.765 48.223 29.284 14 HE21 GLN 9 HE21 GLN 9 51.624 49.531 28.733 15 HE22 GLN 9 HE22 GLN 9 51.517 49.996 27.322 16 H ARG 10 H ARG 10 54.096 45.194 25.091 17 HA ARG 10 HA ARG 10 51.855 46.140 24.075 18 HB2 ARG 10 HB2 ARG 10 53.965 44.915 22.640 19 HB3 ARG 10 HB3 ARG 10 52.810 45.716 21.966 20 HG2 ARG 10 HG2 ARG 10 53.613 47.711 23.068 21 HG3 ARG 10 HG3 ARG 10 54.820 46.888 23.611 22 HD2 ARG 10 HD2 ARG 10 54.342 47.297 20.834 23 HD3 ARG 10 HD3 ARG 10 55.413 48.096 21.638 24 HE ARG 10 HE ARG 10 55.656 45.438 21.003 25 HH11 ARG 10 HH11 ARG 10 57.646 44.569 20.647 26 HH12 ARG 10 HH12 ARG 10 58.870 45.312 21.057 27 HH21 ARG 10 HH21 ARG 10 57.446 47.970 22.165 28 HH22 ARG 10 HH22 ARG 10 58.754 47.294 21.941 29 H VAL 11 H VAL 11 53.007 42.900 24.398 30 HA VAL 11 HA VAL 11 51.128 41.540 23.200 31 HB VAL 11 HB VAL 11 52.719 40.623 25.337 32 HG11 VAL 11 HG11 VAL 11 52.310 38.435 24.521 33 HG12 VAL 11 HG12 VAL 11 50.951 39.136 24.934 34 HG13 VAL 11 HG13 VAL 11 51.361 39.041 23.408 35 HG21 VAL 11 HG21 VAL 11 54.203 39.722 23.712 36 HG22 VAL 11 HG22 VAL 11 53.327 40.378 22.567 37 HG23 VAL 11 HG23 VAL 11 54.128 41.297 23.577 38 H ALA 12 H ALA 12 51.282 42.587 26.516 39 HA ALA 12 HA ALA 12 49.053 41.673 27.457 40 HB1 ALA 12 HB1 ALA 12 49.365 43.269 29.170 41 HB2 ALA 12 HB2 ALA 12 50.716 42.497 28.880 42 HB3 ALA 12 HB3 ALA 12 50.502 43.958 28.309 43 H GLN 13 H GLN 13 49.330 44.551 25.507 44 HA GLN 13 HA GLN 13 46.880 45.384 25.822 45 HB2 GLN 13 HB2 GLN 13 48.421 45.951 23.515 46 HB3 GLN 13 HB3 GLN 13 47.195 46.788 23.995 47 HG2 GLN 13 HG2 GLN 13 49.785 46.833 25.118 48 HG3 GLN 13 HG3 GLN 13 49.019 48.050 24.513 49 HE21 GLN 13 HE21 GLN 13 49.799 46.736 27.360 50 HE22 GLN 13 HE22 GLN 13 48.809 47.390 28.261 51 H GLU 14 H GLU 14 48.196 43.341 23.294 52 HA GLU 14 HA GLU 14 46.120 42.988 21.810 53 HB2 GLU 14 HB2 GLU 14 48.333 41.220 22.093 54 HB3 GLU 14 HB3 GLU 14 47.260 41.025 20.980 55 HG2 GLU 14 HG2 GLU 14 47.969 43.193 20.099 56 HG3 GLU 14 HG3 GLU 14 49.190 43.088 21.065 57 H MET 15 H MET 15 47.160 41.093 24.519 58 HA MET 15 HA MET 15 45.351 39.186 24.424 59 HB2 MET 15 HB2 MET 15 47.298 39.764 26.399 60 HB3 MET 15 HB3 MET 15 46.275 38.607 26.617 61 HG2 MET 15 HG2 MET 15 47.074 37.628 24.548 62 HG3 MET 15 HG3 MET 15 48.203 38.704 24.538 63 HE1 MET 15 HE1 MET 15 50.122 35.509 25.229 64 HE2 MET 15 HE2 MET 15 48.854 35.677 24.294 65 HE3 MET 15 HE3 MET 15 50.012 36.756 24.259 66 H GLN 16 H GLN 16 45.365 42.100 26.417 67 HA GLN 16 HA GLN 16 43.266 41.665 27.835 68 HB2 GLN 16 HB2 GLN 16 44.466 44.081 27.017 69 HB3 GLN 16 HB3 GLN 16 43.075 44.176 27.714 70 HG2 GLN 16 HG2 GLN 16 43.918 43.208 29.668 71 HG3 GLN 16 HG3 GLN 16 45.275 42.883 28.970 72 HE21 GLN 16 HE21 GLN 16 46.792 44.643 28.618 73 HE22 GLN 16 HE22 GLN 16 46.667 45.945 29.329 74 H LYS 17 H LYS 17 43.253 43.043 24.623 75 HA LYS 17 HA LYS 17 40.672 43.424 24.319 76 HB2 LYS 17 HB2 LYS 17 42.325 44.519 23.007 77 HB3 LYS 17 HB3 LYS 17 42.667 43.163 22.318 78 HG2 LYS 17 HG2 LYS 17 40.526 43.109 21.315 79 HG3 LYS 17 HG3 LYS 17 40.135 44.431 22.045 80 HD2 LYS 17 HD2 LYS 17 41.745 45.640 20.819 81 HD3 LYS 17 HD3 LYS 17 42.284 44.327 20.172 82 HE2 LYS 17 HE2 LYS 17 40.063 44.067 19.161 83 HE3 LYS 17 HE3 LYS 17 39.780 45.534 19.606 84 HZ1 LYS 17 HZ1 LYS 17 40.572 45.507 17.475 85 HZ2 LYS 17 HZ2 LYS 17 41.534 46.213 18.304 86 HZ3 LYS 17 HZ3 LYS 17 41.798 44.846 17.888 87 H GLU 18 H GLU 18 42.460 40.621 23.225 88 HA GLU 18 HA GLU 18 40.362 39.437 22.123 89 HB2 GLU 18 HB2 GLU 18 42.681 39.063 21.492 90 HB3 GLU 18 HB3 GLU 18 42.814 38.172 22.763 91 HG2 GLU 18 HG2 GLU 18 42.439 36.709 21.034 92 HG3 GLU 18 HG3 GLU 18 41.114 36.720 21.855 93 H ILE 19 H ILE 19 41.806 38.881 25.241 94 HA ILE 19 HA ILE 19 40.343 36.867 26.080 95 HB ILE 19 HB ILE 19 41.838 38.688 27.604 96 HG12 ILE 19 HG12 ILE 19 42.524 35.994 26.948 97 HG13 ILE 19 HG13 ILE 19 43.087 37.206 26.143 98 HG21 ILE 19 HG21 ILE 19 41.649 37.198 29.434 99 HG22 ILE 19 HG22 ILE 19 40.220 37.745 29.022 100 HG23 ILE 19 HG23 ILE 19 40.667 36.291 28.586 101 HD11 ILE 19 HD11 ILE 19 44.707 36.465 27.675 102 HD12 ILE 19 HD12 ILE 19 44.275 37.941 28.057 103 HD13 ILE 19 HD13 ILE 19 43.702 36.711 28.874 104 H ALA 20 H ALA 20 39.692 40.282 26.427 105 HA ALA 20 HA ALA 20 37.488 40.159 27.814 106 HB1 ALA 20 HB1 ALA 20 37.197 42.395 27.129 107 HB2 ALA 20 HB2 ALA 20 38.684 42.160 27.622 108 HB3 ALA 20 HB3 ALA 20 38.363 42.217 26.072 109 H LEU 21 H LEU 21 37.724 39.917 24.340 110 HA LEU 21 HA LEU 21 35.147 39.684 23.896 111 HB2 LEU 21 HB2 LEU 21 36.649 40.349 22.169 112 HB3 LEU 21 HB3 LEU 21 37.228 38.903 22.134 113 HG LEU 21 HG LEU 21 35.127 38.083 21.459 114 HD11 LEU 21 HD11 LEU 21 33.428 39.547 20.711 115 HD12 LEU 21 HD12 LEU 21 33.684 39.733 22.262 116 HD13 LEU 21 HD13 LEU 21 34.278 40.778 21.231 117 HD21 LEU 21 HD21 LEU 21 35.198 38.911 19.217 118 HD22 LEU 21 HD22 LEU 21 36.130 40.095 19.706 119 HD23 LEU 21 HD23 LEU 21 36.661 38.603 19.738 120 H ILE 22 H ILE 22 37.486 37.117 24.362 121 HA ILE 22 HA ILE 22 35.934 35.062 23.921 122 HB ILE 22 HB ILE 22 38.294 35.107 25.450 123 HG12 ILE 22 HG12 ILE 22 38.102 34.108 22.796 124 HG13 ILE 22 HG13 ILE 22 38.514 35.589 23.056 125 HG21 ILE 22 HG21 ILE 22 38.286 32.712 25.192 126 HG22 ILE 22 HG22 ILE 22 36.984 33.169 25.970 127 HG23 ILE 22 HG23 ILE 22 36.902 32.812 24.430 128 HD11 ILE 22 HD11 ILE 22 40.444 34.294 22.698 129 HD12 ILE 22 HD12 ILE 22 40.473 34.861 24.175 130 HD13 ILE 22 HD13 ILE 22 40.055 33.357 23.912 131 H LEU 23 H LEU 23 36.454 36.708 26.964 132 HA LEU 23 HA LEU 23 34.958 35.387 28.569 133 HB2 LEU 23 HB2 LEU 23 36.110 37.895 28.635 134 HB3 LEU 23 HB3 LEU 23 34.737 37.919 29.372 135 HG LEU 23 HG LEU 23 35.519 36.117 30.741 136 HD11 LEU 23 HD11 LEU 23 37.838 35.709 30.857 137 HD12 LEU 23 HD12 LEU 23 37.282 35.328 29.424 138 HD13 LEU 23 HD13 LEU 23 38.064 36.690 29.635 139 HD21 LEU 23 HD21 LEU 23 36.841 37.521 32.159 140 HD22 LEU 23 HD22 LEU 23 37.014 38.542 30.961 141 HD23 LEU 23 HD23 LEU 23 35.589 38.323 31.615 142 H GLN 24 H GLN 24 33.795 37.647 26.221 143 HA GLN 24 HA GLN 24 31.251 37.619 27.047 144 HB2 GLN 24 HB2 GLN 24 32.454 39.560 26.049 145 HB3 GLN 24 HB3 GLN 24 32.190 38.869 24.676 146 HG2 GLN 24 HG2 GLN 24 29.771 38.939 25.579 147 HG3 GLN 24 HG3 GLN 24 30.339 40.214 26.275 148 HE21 GLN 24 HE21 GLN 24 31.369 41.873 24.750 149 HE22 GLN 24 HE22 GLN 24 30.852 41.990 23.358 150 H ARG 25 H ARG 25 32.900 35.900 24.581 151 HA ARG 25 HA ARG 25 30.655 35.008 23.420 152 HB2 ARG 25 HB2 ARG 25 33.301 35.173 22.350 153 HB3 ARG 25 HB3 ARG 25 32.197 34.397 21.569 154 HG2 ARG 25 HG2 ARG 25 30.916 36.490 21.553 155 HG3 ARG 25 HG3 ARG 25 32.212 37.195 22.056 156 HD2 ARG 25 HD2 ARG 25 32.096 37.492 19.744 157 HD3 ARG 25 HD3 ARG 25 33.327 36.582 20.039 158 HE ARG 25 HE ARG 25 32.344 34.947 18.956 159 HH11 ARG 25 HH11 ARG 25 30.774 33.806 17.859 160 HH12 ARG 25 HH12 ARG 25 29.417 34.395 17.682 161 HH21 ARG 25 HH21 ARG 25 29.856 37.100 19.332 162 HH22 ARG 25 HH22 ARG 25 28.889 36.297 18.533 163 H GLU 26 H GLU 26 33.063 33.436 25.195 164 HA GLU 26 HA GLU 26 32.160 30.961 24.573 165 HB2 GLU 26 HB2 GLU 26 34.476 31.194 24.550 166 HB3 GLU 26 HB3 GLU 26 34.470 31.737 26.012 167 HG2 GLU 26 HG2 GLU 26 35.278 29.534 25.922 168 HG3 GLU 26 HG3 GLU 26 34.050 29.650 26.876 169 H ILE 27 H ILE 27 31.779 33.082 27.193 170 HA ILE 27 HA ILE 27 30.153 31.353 28.493 171 HB ILE 27 HB ILE 27 30.777 32.027 30.551 172 HG12 ILE 27 HG12 ILE 27 32.833 33.671 29.547 173 HG13 ILE 27 HG13 ILE 27 31.469 34.247 30.033 174 HG21 ILE 27 HG21 ILE 27 32.946 31.039 30.659 175 HG22 ILE 27 HG22 ILE 27 31.989 30.192 29.725 176 HG23 ILE 27 HG23 ILE 27 33.062 31.165 29.085 177 HD11 ILE 27 HD11 ILE 27 33.059 34.462 31.742 178 HD12 ILE 27 HD12 ILE 27 31.913 33.482 32.225 179 HD13 ILE 27 HD13 ILE 27 33.298 32.896 31.731 180 H LYS 28 H LYS 28 28.262 32.362 29.644 181 HA LYS 28 HA LYS 28 27.220 34.421 28.275 182 HB2 LYS 28 HB2 LYS 28 26.045 32.570 30.034 183 HB3 LYS 28 HB3 LYS 28 25.252 33.860 29.664 184 HG2 LYS 28 HG2 LYS 28 24.481 32.294 28.209 185 HG3 LYS 28 HG3 LYS 28 25.413 33.196 27.343 186 HD2 LYS 28 HD2 LYS 28 27.128 31.567 27.436 187 HD3 LYS 28 HD3 LYS 28 26.264 30.681 28.385 188 HE2 LYS 28 HE2 LYS 28 24.608 30.557 26.593 189 HE3 LYS 28 HE3 LYS 28 25.665 31.225 25.659 190 HZ1 LYS 28 HZ1 LYS 28 25.757 28.963 25.450 191 HZ2 LYS 28 HZ2 LYS 28 27.026 29.415 25.996 192 HZ3 LYS 28 HZ3 LYS 28 26.041 28.794 26.866 193 H ASP 29 H ASP 29 27.696 36.542 28.871 194 HA ASP 29 HA ASP 29 28.194 37.254 31.385 195 HB2 ASP 29 HB2 ASP 29 29.319 38.211 29.449 196 HB3 ASP 29 HB3 ASP 29 28.023 39.040 29.191 197 HA PRO 30 HA PRO 30 23.919 39.159 31.373 198 HB2 PRO 30 HB2 PRO 30 22.487 37.001 30.222 199 HB3 PRO 30 HB3 PRO 30 22.094 38.509 30.160 200 HG2 PRO 30 HG2 PRO 30 23.172 37.514 28.076 201 HG3 PRO 30 HG3 PRO 30 23.614 38.955 28.478 202 HD2 PRO 30 HD2 PRO 30 25.037 36.548 29.003 203 HD3 PRO 30 HD3 PRO 30 25.659 37.909 28.559 204 H ARG 31 H ARG 31 24.714 35.951 32.148 205 HA ARG 31 HA ARG 31 23.383 35.454 34.331 206 HB2 ARG 31 HB2 ARG 31 24.766 33.874 33.172 207 HB3 ARG 31 HB3 ARG 31 26.035 34.686 33.575 208 HG2 ARG 31 HG2 ARG 31 25.769 34.048 35.821 209 HG3 ARG 31 HG3 ARG 31 24.438 33.312 35.477 210 HD2 ARG 31 HD2 ARG 31 26.084 31.680 35.615 211 HD3 ARG 31 HD3 ARG 31 25.664 31.768 34.116 212 HE ARG 31 HE ARG 31 27.803 33.306 34.542 213 HH11 ARG 31 HH11 ARG 31 29.851 32.739 33.809 214 HH12 ARG 31 HH12 ARG 31 30.128 31.334 33.401 215 HH21 ARG 31 HH21 ARG 31 27.242 30.094 33.994 216 HH22 ARG 31 HH22 ARG 31 28.619 29.805 33.506 217 H LEU 32 H LEU 32 26.124 37.481 34.089 218 HA LEU 32 HA LEU 32 26.028 38.347 36.652 219 HB2 LEU 32 HB2 LEU 32 28.210 38.465 34.847 220 HB3 LEU 32 HB3 LEU 32 28.257 39.111 36.265 221 HG LEU 32 HG LEU 32 28.058 36.325 35.835 222 HD11 LEU 32 HD11 LEU 32 30.340 36.258 36.580 223 HD12 LEU 32 HD12 LEU 32 30.223 37.164 35.285 224 HD13 LEU 32 HD13 LEU 32 30.324 37.835 36.716 225 HD21 LEU 32 HD21 LEU 32 28.480 36.026 38.136 226 HD22 LEU 32 HD22 LEU 32 28.475 37.597 38.336 227 HD23 LEU 32 HD23 LEU 32 27.142 36.846 37.926 228 H GLY 33 H GLY 33 24.424 39.396 34.219 229 HA2 GLY 33 HA2 GLY 33 23.264 41.229 34.108 230 HA3 GLY 33 HA3 GLY 33 24.358 41.981 34.926 231 H MET 34 H MET 34 25.749 40.465 32.267 232 HA MET 34 HA MET 34 26.700 41.086 30.463 233 HB2 MET 34 HB2 MET 34 24.431 41.027 29.769 234 HB3 MET 34 HB3 MET 34 24.347 42.565 30.012 235 HG2 MET 34 HG2 MET 34 24.603 42.169 27.749 236 HG3 MET 34 HG3 MET 34 25.839 42.963 28.272 237 HE1 MET 34 HE1 MET 34 27.436 41.105 25.451 238 HE2 MET 34 HE2 MET 34 26.009 41.789 25.489 239 HE3 MET 34 HE3 MET 34 27.257 42.528 26.124 240 H MET 35 H MET 35 27.920 42.314 32.514 241 HA MET 35 HA MET 35 29.123 44.430 31.475 242 HB2 MET 35 HB2 MET 35 27.162 45.400 32.497 243 HB3 MET 35 HB3 MET 35 27.721 44.948 33.881 244 HG2 MET 35 HG2 MET 35 28.153 47.240 33.422 245 HG3 MET 35 HG3 MET 35 29.444 46.444 33.786 246 HE1 MET 35 HE1 MET 35 28.383 47.988 29.759 247 HE2 MET 35 HE2 MET 35 27.520 46.879 30.488 248 HE3 MET 35 HE3 MET 35 27.620 48.336 31.102 249 H THR 36 H THR 36 30.393 42.104 31.951 250 HA THR 36 HA THR 36 32.034 42.479 34.092 251 HB THR 36 HB THR 36 31.729 39.978 32.894 252 HG1 THR 36 HG1 THR 36 29.813 40.038 33.686 253 HG21 THR 36 HG21 THR 36 32.458 39.096 34.957 254 HG22 THR 36 HG22 THR 36 33.535 40.092 34.361 255 HG23 THR 36 HG23 THR 36 32.578 40.569 35.529 256 H THR 37 H THR 37 34.346 42.739 33.674 257 HA THR 37 HA THR 37 35.155 42.850 31.084 258 HB THR 37 HB THR 37 35.273 45.159 32.678 259 HG1 THR 37 HG1 THR 37 33.509 45.869 31.467 260 HG21 THR 37 HG21 THR 37 35.592 46.388 30.672 261 HG22 THR 37 HG22 THR 37 36.731 45.303 30.850 262 HG23 THR 37 HG23 THR 37 35.532 45.035 29.852 263 H VAL 38 H VAL 38 37.594 43.177 30.795 264 HA VAL 38 HA VAL 38 39.076 42.224 32.839 265 HB VAL 38 HB VAL 38 39.841 42.572 30.157 266 HG11 VAL 38 HG11 VAL 38 41.785 41.285 30.603 267 HG12 VAL 38 HG12 VAL 38 41.785 42.620 31.455 268 HG13 VAL 38 HG13 VAL 38 41.387 41.247 32.135 269 HG21 VAL 38 HG21 VAL 38 39.745 40.184 29.976 270 HG22 VAL 38 HG22 VAL 38 39.237 40.112 31.474 271 HG23 VAL 38 HG23 VAL 38 38.324 40.770 30.359 272 H SER 39 H SER 39 40.169 43.629 34.248 273 HA SER 39 HA SER 39 40.669 46.155 33.566 274 HB2 SER 39 HB2 SER 39 41.055 46.588 35.816 275 HB3 SER 39 HB3 SER 39 39.730 45.771 35.706 276 HG SER 39 HG SER 39 41.267 45.045 37.225 277 H GLY 40 H GLY 40 42.652 43.420 33.787 278 HA2 GLY 40 HA2 GLY 40 44.751 44.417 32.645 279 HA3 GLY 40 HA3 GLY 40 45.032 44.386 34.179 280 H VAL 41 H VAL 41 46.608 42.846 32.506 281 HA VAL 41 HA VAL 41 46.252 40.336 33.410 282 HB VAL 41 HB VAL 41 47.119 39.387 31.510 283 HG11 VAL 41 HG11 VAL 41 45.257 39.694 30.037 284 HG12 VAL 41 HG12 VAL 41 44.770 39.530 31.536 285 HG13 VAL 41 HG13 VAL 41 44.834 40.969 30.876 286 HG21 VAL 41 HG21 VAL 41 47.421 40.602 29.483 287 HG22 VAL 41 HG22 VAL 41 47.132 41.947 30.269 288 HG23 VAL 41 HG23 VAL 41 48.428 41.099 30.600 289 H GLU 42 H GLU 42 48.272 39.112 33.971 290 HA GLU 42 HA GLU 42 50.669 40.266 33.457 291 HB2 GLU 42 HB2 GLU 42 50.157 40.717 35.761 292 HB3 GLU 42 HB3 GLU 42 50.095 39.181 36.025 293 HG2 GLU 42 HG2 GLU 42 52.460 39.166 35.206 294 HG3 GLU 42 HG3 GLU 42 52.425 40.699 35.491 295 H MET 43 H MET 43 51.914 38.806 32.230 296 HA MET 43 HA MET 43 51.584 36.162 32.408 297 HB2 MET 43 HB2 MET 43 53.236 37.612 30.599 298 HB3 MET 43 HB3 MET 43 53.078 36.062 30.536 299 HG2 MET 43 HG2 MET 43 50.689 36.468 30.128 300 HG3 MET 43 HG3 MET 43 51.078 37.957 29.882 301 HE1 MET 43 HE1 MET 43 53.196 37.930 26.760 302 HE2 MET 43 HE2 MET 43 52.471 38.863 27.815 303 HE3 MET 43 HE3 MET 43 53.688 37.956 28.265 304 H SER 44 H SER 44 53.110 34.665 33.251 305 HA SER 44 HA SER 44 55.178 35.396 34.737 306 HB2 SER 44 HB2 SER 44 53.788 33.434 35.154 307 HB3 SER 44 HB3 SER 44 54.540 32.736 33.980 308 HG SER 44 HG SER 44 55.518 32.303 35.903 309 H ARG 45 H ARG 45 57.490 34.724 34.366 310 HA ARG 45 HA ARG 45 58.355 35.801 32.169 311 HB2 ARG 45 HB2 ARG 45 59.459 35.791 34.366 312 HB3 ARG 45 HB3 ARG 45 59.955 34.351 34.036 313 HG2 ARG 45 HG2 ARG 45 61.307 35.161 32.290 314 HG3 ARG 45 HG3 ARG 45 60.719 36.596 32.454 315 HD2 ARG 45 HD2 ARG 45 61.711 36.776 34.597 316 HD3 ARG 45 HD3 ARG 45 62.261 35.323 34.478 317 HE ARG 45 HE ARG 45 63.285 36.593 32.457 318 HH11 ARG 45 HH11 ARG 45 65.386 37.387 32.370 319 HH12 ARG 45 HH12 ARG 45 66.057 37.828 33.625 320 HH21 ARG 45 HH21 ARG 45 63.718 37.156 35.698 321 HH22 ARG 45 HH22 ARG 45 65.098 37.695 35.539 322 H ASP 46 H ASP 46 58.003 32.435 32.602 323 HA ASP 46 HA ASP 46 59.329 31.761 30.389 324 HB2 ASP 46 HB2 ASP 46 58.990 29.551 31.043 325 HB3 ASP 46 HB3 ASP 46 59.491 30.345 32.289 326 H LEU 47 H LEU 47 56.440 32.998 30.517 327 HA LEU 47 HA LEU 47 54.609 33.053 29.526 328 HB2 LEU 47 HB2 LEU 47 55.967 32.056 27.260 329 HB3 LEU 47 HB3 LEU 47 54.650 32.890 27.221 330 HG LEU 47 HG LEU 47 57.146 33.938 28.008 331 HD11 LEU 47 HD11 LEU 47 57.085 35.156 25.945 332 HD12 LEU 47 HD12 LEU 47 57.058 33.598 25.660 333 HD13 LEU 47 HD13 LEU 47 55.719 34.441 25.583 334 HD21 LEU 47 HD21 LEU 47 56.173 36.080 27.997 335 HD22 LEU 47 HD22 LEU 47 54.764 35.429 27.685 336 HD23 LEU 47 HD23 LEU 47 55.473 35.154 29.074 337 H ALA 48 H ALA 48 55.101 30.474 30.957 338 HA ALA 48 HA ALA 48 53.437 28.732 29.776 339 HB1 ALA 48 HB1 ALA 48 54.105 27.269 31.515 340 HB2 ALA 48 HB2 ALA 48 55.376 27.853 30.773 341 HB3 ALA 48 HB3 ALA 48 54.936 28.445 32.174 342 H TYR 49 H TYR 49 53.075 30.997 32.322 343 HA TYR 49 HA TYR 49 50.481 30.377 32.766 344 HB2 TYR 49 HB2 TYR 49 52.415 30.650 34.826 345 HB3 TYR 49 HB3 TYR 49 50.889 30.707 35.139 346 HD1 TYR 49 HD1 TYR 49 49.590 28.671 35.305 347 HD2 TYR 49 HD2 TYR 49 53.471 28.476 34.190 348 HE1 TYR 49 HE1 TYR 49 49.533 26.355 35.548 349 HE2 TYR 49 HE2 TYR 49 53.434 26.160 34.436 350 HH TYR 49 HH TYR 49 52.194 24.323 34.995 351 H ALA 50 H ALA 50 49.066 32.139 33.311 352 HA ALA 50 HA ALA 50 49.995 34.615 33.753 353 HB1 ALA 50 HB1 ALA 50 48.647 35.532 32.013 354 HB2 ALA 50 HB2 ALA 50 49.733 34.554 31.403 355 HB3 ALA 50 HB3 ALA 50 48.237 34.067 31.577 356 H LYS 51 H LYS 51 48.732 35.990 35.002 357 HA LYS 51 HA LYS 51 46.358 35.247 36.026 358 HB2 LYS 51 HB2 LYS 51 48.073 37.370 36.801 359 HB3 LYS 51 HB3 LYS 51 46.689 37.138 37.479 360 HG2 LYS 51 HG2 LYS 51 47.478 34.986 38.234 361 HG3 LYS 51 HG3 LYS 51 48.884 35.339 37.658 362 HD2 LYS 51 HD2 LYS 51 47.663 36.862 39.734 363 HD3 LYS 51 HD3 LYS 51 48.725 35.758 40.025 364 HE2 LYS 51 HE2 LYS 51 50.399 36.996 38.956 365 HE3 LYS 51 HE3 LYS 51 49.357 38.035 38.438 366 HZ1 LYS 51 HZ1 LYS 51 50.638 38.468 40.492 367 HZ2 LYS 51 HZ2 LYS 51 49.300 39.015 40.349 368 HZ3 LYS 51 HZ3 LYS 51 49.510 37.802 41.119 369 H VAL 52 H VAL 52 44.381 36.220 35.455 370 HA VAL 52 HA VAL 52 44.306 38.505 33.991 371 HB VAL 52 HB VAL 52 42.360 36.492 33.908 372 HG11 VAL 52 HG11 VAL 52 41.344 37.693 32.127 373 HG12 VAL 52 HG12 VAL 52 41.347 38.554 33.457 374 HG13 VAL 52 HG13 VAL 52 42.411 38.847 32.320 375 HG21 VAL 52 HG21 VAL 52 43.057 36.067 31.656 376 HG22 VAL 52 HG22 VAL 52 44.214 37.134 31.834 377 HG23 VAL 52 HG23 VAL 52 44.242 35.788 32.670 378 H TYR 53 H TYR 53 43.319 40.286 35.014 379 HA TYR 53 HA TYR 53 41.882 40.037 37.299 380 HB2 TYR 53 HB2 TYR 53 43.064 42.398 36.308 381 HB3 TYR 53 HB3 TYR 53 42.419 42.242 37.719 382 HD1 TYR 53 HD1 TYR 53 43.574 40.123 39.045 383 HD2 TYR 53 HD2 TYR 53 45.431 42.519 36.361 384 HE1 TYR 53 HE1 TYR 53 45.649 39.463 39.895 385 HE2 TYR 53 HE2 TYR 53 47.501 41.903 37.237 386 HH TYR 53 HH TYR 53 48.611 40.620 38.743 387 H VAL 54 H VAL 54 39.679 40.493 37.399 388 HA VAL 54 HA VAL 54 38.353 41.357 35.183 389 HB VAL 54 HB VAL 54 37.568 39.176 36.775 390 HG11 VAL 54 HG11 VAL 54 35.871 38.723 35.150 391 HG12 VAL 54 HG12 VAL 54 35.661 40.153 35.797 392 HG13 VAL 54 HG13 VAL 54 36.310 40.022 34.358 393 HG21 VAL 54 HG21 VAL 54 38.042 37.750 34.892 394 HG22 VAL 54 HG22 VAL 54 38.586 39.012 34.104 395 HG23 VAL 54 HG23 VAL 54 39.359 38.482 35.381 396 H THR 55 H THR 55 36.474 42.675 35.612 397 HA THR 55 HA THR 55 35.840 43.324 38.163 398 HB THR 55 HB THR 55 37.305 44.890 37.212 399 HG1 THR 55 HG1 THR 55 36.235 45.719 38.825 400 HG21 THR 55 HG21 THR 55 36.501 46.561 35.788 401 HG22 THR 55 HG22 THR 55 36.542 45.151 35.067 402 HG23 THR 55 HG23 THR 55 35.166 45.731 35.593 403 H PHE 56 H PHE 56 33.705 43.827 38.648 404 HA PHE 56 HA PHE 56 31.832 42.806 36.976 405 HB2 PHE 56 HB2 PHE 56 32.111 42.437 39.793 406 HB3 PHE 56 HB3 PHE 56 30.858 41.925 39.018 407 HD1 PHE 56 HD1 PHE 56 34.425 41.335 38.849 408 HD2 PHE 56 HD2 PHE 56 30.773 39.618 38.692 409 HE1 PHE 56 HE1 PHE 56 35.423 39.230 38.670 410 HE2 PHE 56 HE2 PHE 56 31.762 37.514 38.637 411 HZ PHE 56 HZ PHE 56 34.092 37.317 38.617 412 H LEU 57 H LEU 57 29.791 43.942 36.770 413 HA LEU 57 HA LEU 57 29.016 45.943 38.382 414 HB2 LEU 57 HB2 LEU 57 28.283 45.854 36.141 415 HB3 LEU 57 HB3 LEU 57 27.609 44.472 36.397 416 HG LEU 57 HG LEU 57 26.018 45.494 37.788 417 HD11 LEU 57 HD11 LEU 57 25.818 47.840 37.911 418 HD12 LEU 57 HD12 LEU 57 27.187 47.362 38.549 419 HD13 LEU 57 HD13 LEU 57 27.167 47.987 37.095 420 HD21 LEU 57 HD21 LEU 57 24.798 46.622 36.071 421 HD22 LEU 57 HD22 LEU 57 26.121 46.696 35.203 422 HD23 LEU 57 HD23 LEU 57 25.446 45.294 35.501 423 H ASN 58 H ASN 58 28.717 42.576 38.632 424 HA ASN 58 HA ASN 58 26.676 42.490 40.362 425 HB2 ASN 58 HB2 ASN 58 27.352 40.804 38.592 426 HB3 ASN 58 HB3 ASN 58 28.216 40.214 39.748 427 HD21 ASN 58 HD21 ASN 58 25.400 38.239 39.962 428 HD22 ASN 58 HD22 ASN 58 26.716 38.315 39.269 429 H ASP 59 H ASP 59 29.491 43.542 41.091 430 HA ASP 59 HA ASP 59 30.386 42.487 43.268 431 HB2 ASP 59 HB2 ASP 59 31.592 44.084 41.958 432 HB3 ASP 59 HB3 ASP 59 30.571 45.191 42.360 433 H LYS 60 H LYS 60 27.471 44.088 43.088 434 HA LYS 60 HA LYS 60 27.078 44.908 45.567 435 HB2 LYS 60 HB2 LYS 60 25.752 45.587 43.695 436 HB3 LYS 60 HB3 LYS 60 25.211 44.130 43.552 437 HG2 LYS 60 HG2 LYS 60 24.072 44.369 45.642 438 HG3 LYS 60 HG3 LYS 60 24.577 45.841 45.735 439 HD2 LYS 60 HD2 LYS 60 23.292 46.476 43.903 440 HD3 LYS 60 HD3 LYS 60 22.939 44.993 43.575 441 HE2 LYS 60 HE2 LYS 60 21.048 45.639 44.614 442 HE3 LYS 60 HE3 LYS 60 21.813 44.977 45.800 443 HZ1 LYS 60 HZ1 LYS 60 21.013 47.005 46.422 444 HZ2 LYS 60 HZ2 LYS 60 22.464 47.061 46.473 445 HZ3 LYS 60 HZ3 LYS 60 21.752 47.677 45.366 446 H ASP 61 H ASP 61 27.176 41.679 44.534 447 HA ASP 61 HA ASP 61 26.721 40.781 47.048 448 HB2 ASP 61 HB2 ASP 61 24.774 40.334 45.717 449 HB3 ASP 61 HB3 ASP 61 25.650 39.420 44.807 450 H GLU 62 H GLU 62 28.714 40.116 47.739 451 HA GLU 62 HA GLU 62 30.739 39.421 46.350 452 HB2 GLU 62 HB2 GLU 62 30.306 38.759 49.092 453 HB3 GLU 62 HB3 GLU 62 31.714 38.739 48.421 454 HG2 GLU 62 HG2 GLU 62 31.861 40.695 49.440 455 HG3 GLU 62 HG3 GLU 62 31.287 41.190 48.077 456 H ASP 63 H ASP 63 28.397 37.251 47.574 457 HA ASP 63 HA ASP 63 29.486 34.917 46.998 458 HB2 ASP 63 HB2 ASP 63 27.807 35.124 48.659 459 HB3 ASP 63 HB3 ASP 63 26.799 35.690 47.611 460 H ALA 64 H ALA 64 27.513 36.886 44.971 461 HA ALA 64 HA ALA 64 27.300 35.183 42.944 462 HB1 ALA 64 HB1 ALA 64 26.433 37.058 41.793 463 HB2 ALA 64 HB2 ALA 64 25.731 36.919 43.206 464 HB3 ALA 64 HB3 ALA 64 26.876 37.994 42.991 465 H VAL 65 H VAL 65 29.661 37.669 43.528 466 HA VAL 65 HA VAL 65 31.129 37.435 41.386 467 HB VAL 65 HB VAL 65 31.920 38.353 43.908 468 HG11 VAL 65 HG11 VAL 65 33.762 39.438 42.874 469 HG12 VAL 65 HG12 VAL 65 33.870 37.867 42.703 470 HG13 VAL 65 HG13 VAL 65 33.366 38.762 41.497 471 HG21 VAL 65 HG21 VAL 65 31.636 40.558 42.977 472 HG22 VAL 65 HG22 VAL 65 31.149 39.899 41.622 473 HG23 VAL 65 HG23 VAL 65 30.268 39.762 42.931 474 H LYS 66 H LYS 66 31.455 35.692 44.381 475 HA LYS 66 HA LYS 66 33.489 34.150 43.991 476 HB2 LYS 66 HB2 LYS 66 32.319 34.390 46.074 477 HB3 LYS 66 HB3 LYS 66 31.137 33.556 45.490 478 HG2 LYS 66 HG2 LYS 66 32.211 31.988 46.688 479 HG3 LYS 66 HG3 LYS 66 32.793 31.717 45.268 480 HD2 LYS 66 HD2 LYS 66 34.669 31.747 46.500 481 HD3 LYS 66 HD3 LYS 66 34.653 33.208 45.955 482 HE2 LYS 66 HE2 LYS 66 33.832 34.037 47.964 483 HE3 LYS 66 HE3 LYS 66 33.515 32.603 48.490 484 HZ1 LYS 66 HZ1 LYS 66 35.449 33.364 49.418 485 HZ2 LYS 66 HZ2 LYS 66 35.767 32.204 48.602 486 HZ3 LYS 66 HZ3 LYS 66 36.063 33.539 48.112 487 H ALA 67 H ALA 67 30.229 33.359 43.079 488 HA ALA 67 HA ALA 67 30.659 31.031 41.954 489 HB1 ALA 67 HB1 ALA 67 28.419 31.304 41.188 490 HB2 ALA 67 HB2 ALA 67 28.511 31.682 42.723 491 HB3 ALA 67 HB3 ALA 67 28.464 32.825 41.628 492 H GLY 68 H GLY 68 30.487 34.133 40.426 493 HA2 GLY 68 HA2 GLY 68 30.704 33.584 37.918 494 HA3 GLY 68 HA3 GLY 68 31.174 34.923 38.566 495 H ILE 69 H ILE 69 33.422 34.260 40.043 496 HA ILE 69 HA ILE 69 35.394 33.855 38.426 497 HB ILE 69 HB ILE 69 35.338 33.775 41.201 498 HG12 ILE 69 HG12 ILE 69 35.069 35.948 40.350 499 HG13 ILE 69 HG13 ILE 69 36.367 35.867 41.212 500 HG21 ILE 69 HG21 ILE 69 37.723 33.806 41.277 501 HG22 ILE 69 HG22 ILE 69 37.185 32.456 40.649 502 HG23 ILE 69 HG23 ILE 69 37.752 33.597 39.708 503 HD11 ILE 69 HD11 ILE 69 36.794 37.130 39.277 504 HD12 ILE 69 HD12 ILE 69 37.688 35.824 39.242 505 HD13 ILE 69 HD13 ILE 69 36.370 35.905 38.367 506 H LYS 70 H LYS 70 33.881 31.380 40.450 507 HA LYS 70 HA LYS 70 35.501 29.416 39.779 508 HB2 LYS 70 HB2 LYS 70 34.123 29.368 41.753 509 HB3 LYS 70 HB3 LYS 70 32.904 29.037 40.838 510 HG2 LYS 70 HG2 LYS 70 33.910 27.012 40.156 511 HG3 LYS 70 HG3 LYS 70 35.213 27.363 40.937 512 HD2 LYS 70 HD2 LYS 70 33.942 27.204 42.999 513 HD3 LYS 70 HD3 LYS 70 32.731 26.689 42.162 514 HE2 LYS 70 HE2 LYS 70 34.014 24.818 41.455 515 HE3 LYS 70 HE3 LYS 70 35.230 25.335 42.284 516 HZ1 LYS 70 HZ1 LYS 70 34.113 23.738 43.450 517 HZ2 LYS 70 HZ2 LYS 70 34.011 24.986 44.187 518 HZ3 LYS 70 HZ3 LYS 70 32.879 24.505 43.414 519 H ALA 71 H ALA 71 32.490 30.290 38.297 520 HA ALA 71 HA ALA 71 32.285 28.355 36.540 521 HB1 ALA 71 HB1 ALA 71 30.614 29.741 35.576 522 HB2 ALA 71 HB2 ALA 71 30.417 29.664 37.145 523 HB3 ALA 71 HB3 ALA 71 31.091 30.940 36.495 524 H LEU 72 H LEU 72 33.872 31.379 36.176 525 HA LEU 72 HA LEU 72 34.734 31.215 33.686 526 HB2 LEU 72 HB2 LEU 72 34.456 33.294 34.727 527 HB3 LEU 72 HB3 LEU 72 35.430 32.892 35.876 528 HG LEU 72 HG LEU 72 37.230 33.007 34.427 529 HD11 LEU 72 HD11 LEU 72 37.048 33.885 32.254 530 HD12 LEU 72 HD12 LEU 72 36.268 32.512 32.373 531 HD13 LEU 72 HD13 LEU 72 35.471 33.881 32.394 532 HD21 LEU 72 HD21 LEU 72 37.230 35.390 34.123 533 HD22 LEU 72 HD22 LEU 72 35.665 35.399 34.367 534 HD23 LEU 72 HD23 LEU 72 36.648 35.020 35.549 535 H GLN 73 H GLN 73 36.370 30.344 36.638 536 HA GLN 73 HA GLN 73 38.694 29.661 35.592 537 HB2 GLN 73 HB2 GLN 73 38.343 30.246 37.913 538 HB3 GLN 73 HB3 GLN 73 37.684 28.847 38.117 539 HG2 GLN 73 HG2 GLN 73 39.878 28.679 38.843 540 HG3 GLN 73 HG3 GLN 73 39.754 27.805 37.557 541 HE21 GLN 73 HE21 GLN 73 41.324 28.184 35.953 542 HE22 GLN 73 HE22 GLN 73 42.121 29.435 35.812 543 H GLU 74 H GLU 74 35.915 27.633 36.152 544 HA GLU 74 HA GLU 74 36.968 25.405 35.223 545 HB2 GLU 74 HB2 GLU 74 34.253 26.050 35.747 546 HB3 GLU 74 HB3 GLU 74 34.639 24.651 35.177 547 HG2 GLU 74 HG2 GLU 74 36.032 24.294 37.110 548 HG3 GLU 74 HG3 GLU 74 35.526 25.651 37.690 549 H ALA 75 H ALA 75 35.827 28.001 33.408 550 HA ALA 75 HA ALA 75 35.881 26.738 31.048 551 HB1 ALA 75 HB1 ALA 75 35.189 28.865 30.205 552 HB2 ALA 75 HB2 ALA 75 34.219 28.392 31.365 553 HB3 ALA 75 HB3 ALA 75 35.338 29.473 31.660 554 H SER 76 H SER 76 38.421 27.759 32.776 555 HA SER 76 HA SER 76 39.702 29.412 31.312 556 HB2 SER 76 HB2 SER 76 41.609 28.917 32.692 557 HB3 SER 76 HB3 SER 76 40.335 29.152 33.560 558 HG SER 76 HG SER 76 40.249 27.119 34.006 559 H GLY 77 H GLY 77 40.055 25.971 30.963 560 HA2 GLY 77 HA2 GLY 77 42.140 25.905 29.372 561 HA3 GLY 77 HA3 GLY 77 41.125 24.738 29.574 562 H PHE 78 H PHE 78 38.759 26.019 28.504 563 HA PHE 78 HA PHE 78 38.983 25.958 25.898 564 HB2 PHE 78 HB2 PHE 78 36.861 26.883 27.503 565 HB3 PHE 78 HB3 PHE 78 36.771 26.949 25.948 566 HD1 PHE 78 HD1 PHE 78 36.459 24.769 28.666 567 HD2 PHE 78 HD2 PHE 78 36.657 24.840 24.632 568 HE1 PHE 78 HE1 PHE 78 35.595 22.606 28.594 569 HE2 PHE 78 HE2 PHE 78 35.790 22.682 24.548 570 HZ PHE 78 HZ PHE 78 35.253 21.554 26.526 571 H ILE 79 H ILE 79 39.024 28.718 28.031 572 HA ILE 79 HA ILE 79 39.172 30.668 26.262 573 HB ILE 79 HB ILE 79 39.881 30.740 28.999 574 HG12 ILE 79 HG12 ILE 79 37.456 31.663 27.854 575 HG13 ILE 79 HG13 ILE 79 37.566 30.262 28.532 576 HG21 ILE 79 HG21 ILE 79 39.791 33.091 28.837 577 HG22 ILE 79 HG22 ILE 79 40.920 32.524 27.882 578 HG23 ILE 79 HG23 ILE 79 39.525 32.971 27.280 579 HD11 ILE 79 HD11 ILE 79 36.593 31.781 30.032 580 HD12 ILE 79 HD12 ILE 79 37.980 31.292 30.621 581 HD13 ILE 79 HD13 ILE 79 37.869 32.714 29.932 582 H ARG 80 H ARG 80 41.813 28.980 27.798 583 HA ARG 80 HA ARG 80 43.899 30.105 26.673 584 HB2 ARG 80 HB2 ARG 80 44.061 28.764 28.580 585 HB3 ARG 80 HB3 ARG 80 43.596 27.517 27.767 586 HG2 ARG 80 HG2 ARG 80 46.034 28.764 27.110 587 HG3 ARG 80 HG3 ARG 80 45.993 27.723 28.269 588 HD2 ARG 80 HD2 ARG 80 45.524 27.133 25.536 589 HD3 ARG 80 HD3 ARG 80 46.744 26.632 26.368 590 HE ARG 80 HE ARG 80 44.985 25.449 27.616 591 HH11 ARG 80 HH11 ARG 80 43.640 23.756 27.340 592 HH12 ARG 80 HH12 ARG 80 43.360 23.222 25.978 593 HH21 ARG 80 HH21 ARG 80 45.052 25.369 24.294 594 HH22 ARG 80 HH22 ARG 80 44.183 24.162 24.205 595 H SER 81 H SER 81 42.154 27.357 25.432 596 HA SER 81 HA SER 81 43.564 26.962 23.285 597 HB2 SER 81 HB2 SER 81 41.998 25.341 24.169 598 HB3 SER 81 HB3 SER 81 40.832 26.206 23.599 599 HG SER 81 HG SER 81 41.457 24.674 22.137 600 H LEU 82 H LEU 82 40.631 28.829 23.538 601 HA LEU 82 HA LEU 82 40.375 29.595 21.047 602 HB2 LEU 82 HB2 LEU 82 39.237 30.611 23.447 603 HB3 LEU 82 HB3 LEU 82 38.854 31.225 22.065 604 HG LEU 82 HG LEU 82 38.382 28.508 22.643 605 HD11 LEU 82 HD11 LEU 82 36.118 29.102 23.081 606 HD12 LEU 82 HD12 LEU 82 37.079 29.821 24.114 607 HD13 LEU 82 HD13 LEU 82 36.495 30.627 22.882 608 HD21 LEU 82 HD21 LEU 82 36.866 28.534 20.839 609 HD22 LEU 82 HD22 LEU 82 37.227 30.052 20.565 610 HD23 LEU 82 HD23 LEU 82 38.319 28.927 20.345 611 H LEU 83 H LEU 83 42.122 31.186 23.564 612 HA LEU 83 HA LEU 83 42.839 33.396 22.321 613 HB2 LEU 83 HB2 LEU 83 42.869 33.166 24.683 614 HB3 LEU 83 HB3 LEU 83 44.008 32.106 24.568 615 HG LEU 83 HG LEU 83 45.458 33.785 23.745 616 HD11 LEU 83 HD11 LEU 83 44.876 36.050 23.908 617 HD12 LEU 83 HD12 LEU 83 43.938 35.309 22.870 618 HD13 LEU 83 HD13 LEU 83 43.406 35.638 24.325 619 HD21 LEU 83 HD21 LEU 83 45.782 34.858 25.849 620 HD22 LEU 83 HD22 LEU 83 44.343 34.373 26.302 621 HD23 LEU 83 HD23 LEU 83 45.497 33.315 26.063 622 H GLY 84 H GLY 84 44.652 30.432 22.609 623 HA2 GLY 84 HA2 GLY 84 46.770 30.985 21.215 624 HA3 GLY 84 HA3 GLY 84 46.235 29.544 21.475 625 H LYS 85 H LYS 85 43.803 29.640 20.063 626 HA LYS 85 HA LYS 85 44.305 29.332 17.486 627 HB2 LYS 85 HB2 LYS 85 42.682 28.059 18.680 628 HB3 LYS 85 HB3 LYS 85 41.852 29.355 18.937 629 HG2 LYS 85 HG2 LYS 85 41.161 29.457 16.741 630 HG3 LYS 85 HG3 LYS 85 42.224 28.408 16.289 631 HD2 LYS 85 HD2 LYS 85 41.120 26.696 17.433 632 HD3 LYS 85 HD3 LYS 85 40.159 27.714 18.121 633 HE2 LYS 85 HE2 LYS 85 38.909 27.990 16.243 634 HE3 LYS 85 HE3 LYS 85 40.053 27.493 15.305 635 HZ1 LYS 85 HZ1 LYS 85 38.459 25.881 15.513 636 HZ2 LYS 85 HZ2 LYS 85 39.694 25.368 16.082 637 HZ3 LYS 85 HZ3 LYS 85 38.629 25.831 16.955 638 H ALA 86 H ALA 86 42.741 32.001 19.048 639 HA ALA 86 HA ALA 86 42.104 33.410 16.941 640 HB1 ALA 86 HB1 ALA 86 41.801 35.159 18.509 641 HB2 ALA 86 HB2 ALA 86 41.138 33.827 19.052 642 HB3 ALA 86 HB3 ALA 86 42.544 34.294 19.609 643 H MET 87 H MET 87 45.010 33.605 18.822 644 HA MET 87 HA MET 87 46.161 35.457 17.288 645 HB2 MET 87 HB2 MET 87 47.092 34.220 19.683 646 HB3 MET 87 HB3 MET 87 47.943 35.297 18.940 647 HG2 MET 87 HG2 MET 87 46.091 36.841 19.241 648 HG3 MET 87 HG3 MET 87 45.420 35.773 20.158 649 HE1 MET 87 HE1 MET 87 46.317 38.592 22.482 650 HE2 MET 87 HE2 MET 87 45.909 38.711 20.956 651 HE3 MET 87 HE3 MET 87 45.129 37.715 21.908 652 H ARG 88 H ARG 88 46.065 32.259 16.713 653 HA ARG 88 HA ARG 88 47.286 30.702 15.858 654 HB2 ARG 88 HB2 ARG 88 47.925 32.788 14.106 655 HB3 ARG 88 HB3 ARG 88 48.297 31.301 13.821 656 HG2 ARG 88 HG2 ARG 88 46.042 30.705 13.692 657 HG3 ARG 88 HG3 ARG 88 45.602 32.131 14.147 658 HD2 ARG 88 HD2 ARG 88 45.254 31.944 11.849 659 HD3 ARG 88 HD3 ARG 88 46.336 33.038 12.100 660 HE ARG 88 HE ARG 88 47.729 30.929 11.610 661 HH11 ARG 88 HH11 ARG 88 48.670 30.500 9.661 662 HH12 ARG 88 HH12 ARG 88 47.965 30.833 8.391 663 HH21 ARG 88 HH21 ARG 88 45.380 32.241 9.657 664 HH22 ARG 88 HH22 ARG 88 46.052 31.846 8.388 665 H LEU 89 H LEU 89 48.451 30.955 18.138 666 HA LEU 89 HA LEU 89 50.929 32.111 18.175 667 HB2 LEU 89 HB2 LEU 89 49.297 33.167 19.485 668 HB3 LEU 89 HB3 LEU 89 48.899 31.808 20.141 669 HG LEU 89 HG LEU 89 50.922 31.797 21.338 670 HD11 LEU 89 HD11 LEU 89 52.274 33.718 21.426 671 HD12 LEU 89 HD12 LEU 89 52.271 33.117 19.960 672 HD13 LEU 89 HD13 LEU 89 51.388 34.388 20.297 673 HD21 LEU 89 HD21 LEU 89 50.299 33.560 22.850 674 HD22 LEU 89 HD22 LEU 89 49.378 34.181 21.722 675 HD23 LEU 89 HD23 LEU 89 49.005 32.785 22.369 676 H ARG 90 H ARG 90 52.789 31.059 18.906 677 HA ARG 90 HA ARG 90 52.785 28.403 18.923 678 HB2 ARG 90 HB2 ARG 90 54.962 30.231 19.002 679 HB3 ARG 90 HB3 ARG 90 55.217 28.694 19.083 680 HG2 ARG 90 HG2 ARG 90 54.328 28.385 16.940 681 HG3 ARG 90 HG3 ARG 90 53.902 29.883 16.864 682 HD2 ARG 90 HD2 ARG 90 56.129 30.564 16.725 683 HD3 ARG 90 HD3 ARG 90 56.626 29.107 16.971 684 HE ARG 90 HE ARG 90 55.545 28.638 14.851 685 HH11 ARG 90 HH11 ARG 90 55.841 29.078 12.688 686 HH12 ARG 90 HH12 ARG 90 56.542 30.325 12.271 687 HH21 ARG 90 HH21 ARG 90 57.127 31.565 15.124 688 HH22 ARG 90 HH22 ARG 90 57.270 31.733 13.651 689 H ILE 91 H ILE 91 53.307 30.635 21.505 690 HA ILE 91 HA ILE 91 52.863 28.661 23.313 691 HB ILE 91 HB ILE 91 54.313 30.073 24.766 692 HG12 ILE 91 HG12 ILE 91 56.394 30.603 23.778 693 HG13 ILE 91 HG13 ILE 91 55.747 30.405 22.373 694 HG21 ILE 91 HG21 ILE 91 56.049 28.379 24.375 695 HG22 ILE 91 HG22 ILE 91 54.617 27.702 24.418 696 HG23 ILE 91 HG23 ILE 91 55.313 27.996 23.026 697 HD11 ILE 91 HD11 ILE 91 55.866 32.680 22.863 698 HD12 ILE 91 HD12 ILE 91 54.344 32.257 22.745 699 HD13 ILE 91 HD13 ILE 91 55.001 32.458 24.171 700 H VAL 92 H VAL 92 50.888 29.008 24.208 701 HA VAL 92 HA VAL 92 50.065 31.459 25.062 702 HB VAL 92 HB VAL 92 48.692 30.562 23.508 703 HG11 VAL 92 HG11 VAL 92 47.228 28.761 23.971 704 HG12 VAL 92 HG12 VAL 92 48.737 28.288 23.894 705 HG13 VAL 92 HG13 VAL 92 48.038 28.479 25.303 706 HG21 VAL 92 HG21 VAL 92 46.614 30.958 24.629 707 HG22 VAL 92 HG22 VAL 92 47.384 30.902 26.012 708 HG23 VAL 92 HG23 VAL 92 47.686 32.069 24.986 709 HA PRO 93 HA PRO 93 50.664 29.988 29.105 710 HB2 PRO 93 HB2 PRO 93 49.961 32.009 30.542 711 HB3 PRO 93 HB3 PRO 93 51.327 32.033 29.793 712 HG2 PRO 93 HG2 PRO 93 48.946 33.326 28.995 713 HG3 PRO 93 HG3 PRO 93 50.400 33.868 28.830 714 HD2 PRO 93 HD2 PRO 93 49.155 32.754 26.830 715 HD3 PRO 93 HD3 PRO 93 50.713 32.770 26.895 716 H GLU 94 H GLU 94 49.609 29.043 30.847 717 HA GLU 94 HA GLU 94 47.010 28.405 30.773 718 HB2 GLU 94 HB2 GLU 94 48.674 26.831 31.363 719 HB3 GLU 94 HB3 GLU 94 49.073 27.707 32.589 720 HG2 GLU 94 HG2 GLU 94 47.772 25.874 33.271 721 HG3 GLU 94 HG3 GLU 94 47.075 27.212 33.664 722 H LEU 95 H LEU 95 45.315 29.107 32.257 723 HA LEU 95 HA LEU 95 45.772 31.698 32.954 724 HB2 LEU 95 HB2 LEU 95 43.398 30.691 31.749 725 HB3 LEU 95 HB3 LEU 95 43.634 32.198 32.072 726 HG LEU 95 HG LEU 95 45.043 30.760 30.108 727 HD11 LEU 95 HD11 LEU 95 43.871 32.110 28.513 728 HD12 LEU 95 HD12 LEU 95 42.849 31.265 29.379 729 HD13 LEU 95 HD13 LEU 95 43.083 32.797 29.705 730 HD21 LEU 95 HD21 LEU 95 46.009 32.784 29.384 731 HD22 LEU 95 HD22 LEU 95 45.316 33.533 30.596 732 HD23 LEU 95 HD23 LEU 95 46.442 32.452 30.872 733 H THR 96 H THR 96 45.314 32.435 34.984 734 HA THR 96 HA THR 96 43.371 31.281 36.468 735 HB THR 96 HB THR 96 45.654 32.464 37.576 736 HG1 THR 96 HG1 THR 96 46.116 30.347 38.155 737 HG21 THR 96 HG21 THR 96 44.925 31.575 39.668 738 HG22 THR 96 HG22 THR 96 43.839 32.574 39.093 739 HG23 THR 96 HG23 THR 96 43.626 31.010 38.959 740 H PHE 97 H PHE 97 41.701 32.629 37.237 741 HA PHE 97 HA PHE 97 41.691 35.256 36.531 742 HB2 PHE 97 HB2 PHE 97 39.489 33.485 36.718 743 HB3 PHE 97 HB3 PHE 97 39.337 34.997 36.365 744 HD1 PHE 97 HD1 PHE 97 39.839 35.803 34.117 745 HD2 PHE 97 HD2 PHE 97 40.406 31.909 35.026 746 HE1 PHE 97 HE1 PHE 97 40.204 35.326 31.846 747 HE2 PHE 97 HE2 PHE 97 40.773 31.431 32.768 748 HZ PHE 97 HZ PHE 97 40.689 33.147 31.185 749 H PHE 98 H PHE 98 41.213 36.897 37.976 750 HA PHE 98 HA PHE 98 40.504 36.444 40.541 751 HB2 PHE 98 HB2 PHE 98 42.823 37.862 39.723 752 HB3 PHE 98 HB3 PHE 98 42.250 38.025 41.164 753 HD1 PHE 98 HD1 PHE 98 42.122 35.861 42.612 754 HD2 PHE 98 HD2 PHE 98 44.480 36.174 39.324 755 HE1 PHE 98 HE1 PHE 98 43.328 33.987 43.293 756 HE2 PHE 98 HE2 PHE 98 45.718 34.334 40.054 757 HZ PHE 98 HZ PHE 98 45.135 33.230 42.019 758 H TYR 99 H TYR 99 39.534 38.322 41.676 759 HA TYR 99 HA TYR 99 38.142 39.938 40.030 760 HB2 TYR 99 HB2 TYR 99 36.442 39.978 41.429 761 HB3 TYR 99 HB3 TYR 99 36.916 38.492 41.454 762 HD1 TYR 99 HD1 TYR 99 35.943 41.025 43.460 763 HD2 TYR 99 HD2 TYR 99 38.436 37.832 43.532 764 HE1 TYR 99 HE1 TYR 99 35.835 40.986 45.794 765 HE2 TYR 99 HE2 TYR 99 38.355 37.824 45.858 766 HH TYR 99 HH TYR 99 37.429 38.737 47.739 767 H ASP 100 H ASP 100 38.159 42.197 40.034 768 HA ASP 100 HA ASP 100 39.707 43.620 41.785 769 HB2 ASP 100 HB2 ASP 100 40.948 43.103 39.807 770 HB3 ASP 100 HB3 ASP 100 39.840 43.790 38.950 Start of MODEL 14 1 HA PRO 8 HA PRO 8 55.334 44.405 26.320 2 HB2 PRO 8 HB2 PRO 8 54.005 42.297 27.633 3 HB3 PRO 8 HB3 PRO 8 54.878 42.173 26.346 4 HG2 PRO 8 HG2 PRO 8 55.865 41.288 28.534 5 HG3 PRO 8 HG3 PRO 8 56.836 42.006 27.546 6 HD2 PRO 8 HD2 PRO 8 55.551 43.206 29.799 7 HD3 PRO 8 HD3 PRO 8 57.066 43.322 29.443 8 H GLN 9 H GLN 9 54.307 46.633 27.307 9 HA GLN 9 HA GLN 9 51.866 46.614 28.253 10 HB2 GLN 9 HB2 GLN 9 53.284 48.420 28.635 11 HB3 GLN 9 HB3 GLN 9 53.391 48.710 27.106 12 HG2 GLN 9 HG2 GLN 9 50.807 48.948 28.132 13 HG3 GLN 9 HG3 GLN 9 51.801 50.031 28.652 14 HE21 GLN 9 HE21 GLN 9 49.570 50.634 27.078 15 HE22 GLN 9 HE22 GLN 9 50.024 51.293 25.820 16 H ARG 10 H ARG 10 52.698 46.991 24.887 17 HA ARG 10 HA ARG 10 50.204 47.254 24.017 18 HB2 ARG 10 HB2 ARG 10 52.623 46.827 22.595 19 HB3 ARG 10 HB3 ARG 10 51.265 46.928 21.836 20 HG2 ARG 10 HG2 ARG 10 50.948 49.138 22.601 21 HG3 ARG 10 HG3 ARG 10 52.213 49.040 23.507 22 HD2 ARG 10 HD2 ARG 10 52.393 48.942 20.672 23 HD3 ARG 10 HD3 ARG 10 52.588 50.272 21.464 24 HE ARG 10 HE ARG 10 54.493 49.272 22.428 25 HH11 ARG 10 HH11 ARG 10 56.503 48.406 21.885 26 HH12 ARG 10 HH12 ARG 10 56.665 47.664 20.603 27 HH21 ARG 10 HH21 ARG 10 53.697 47.980 19.479 28 HH22 ARG 10 HH22 ARG 10 55.053 47.419 19.223 29 H VAL 11 H VAL 11 52.077 44.420 24.427 30 HA VAL 11 HA VAL 11 50.515 42.643 23.305 31 HB VAL 11 HB VAL 11 52.314 42.082 25.386 32 HG11 VAL 11 HG11 VAL 11 52.494 39.918 24.357 33 HG12 VAL 11 HG12 VAL 11 50.990 40.212 24.757 34 HG13 VAL 11 HG13 VAL 11 51.456 40.377 23.253 35 HG21 VAL 11 HG21 VAL 11 54.029 41.709 23.798 36 HG22 VAL 11 HG22 VAL 11 53.064 42.224 22.654 37 HG23 VAL 11 HG23 VAL 11 53.567 43.223 23.775 38 H ALA 12 H ALA 12 50.660 43.601 26.655 39 HA ALA 12 HA ALA 12 48.666 42.262 27.638 40 HB1 ALA 12 HB1 ALA 12 48.804 43.824 29.422 41 HB2 ALA 12 HB2 ALA 12 50.253 43.326 29.022 42 HB3 ALA 12 HB3 ALA 12 49.740 44.742 28.533 43 H GLN 13 H GLN 13 48.424 45.309 25.982 44 HA GLN 13 HA GLN 13 45.819 45.675 26.281 45 HB2 GLN 13 HB2 GLN 13 47.737 46.892 24.595 46 HB3 GLN 13 HB3 GLN 13 46.232 47.270 24.444 47 HG2 GLN 13 HG2 GLN 13 47.582 47.605 26.930 48 HG3 GLN 13 HG3 GLN 13 47.525 48.766 25.890 49 HE21 GLN 13 HE21 GLN 13 46.452 49.209 28.380 50 HE22 GLN 13 HE22 GLN 13 44.973 49.358 28.300 51 H GLU 14 H GLU 14 47.412 44.057 23.611 52 HA GLU 14 HA GLU 14 45.279 43.429 22.248 53 HB2 GLU 14 HB2 GLU 14 47.832 42.203 22.270 54 HB3 GLU 14 HB3 GLU 14 46.698 41.599 21.386 55 HG2 GLU 14 HG2 GLU 14 46.552 43.689 20.214 56 HG3 GLU 14 HG3 GLU 14 47.760 44.213 21.050 57 H MET 15 H MET 15 46.675 41.694 24.906 58 HA MET 15 HA MET 15 45.096 39.614 25.010 59 HB2 MET 15 HB2 MET 15 46.770 40.750 27.008 60 HB3 MET 15 HB3 MET 15 45.968 39.443 27.291 61 HG2 MET 15 HG2 MET 15 47.861 39.572 25.196 62 HG3 MET 15 HG3 MET 15 48.274 39.109 26.626 63 HE1 MET 15 HE1 MET 15 48.584 35.890 24.673 64 HE2 MET 15 HE2 MET 15 48.943 37.352 24.182 65 HE3 MET 15 HE3 MET 15 49.345 36.887 25.641 66 H GLN 16 H GLN 16 44.755 42.626 26.776 67 HA GLN 16 HA GLN 16 42.651 42.188 28.145 68 HB2 GLN 16 HB2 GLN 16 43.715 44.592 27.151 69 HB3 GLN 16 HB3 GLN 16 42.312 44.653 27.830 70 HG2 GLN 16 HG2 GLN 16 43.339 43.793 29.852 71 HG3 GLN 16 HG3 GLN 16 44.726 43.955 29.156 72 HE21 GLN 16 HE21 GLN 16 45.569 45.695 30.469 73 HE22 GLN 16 HE22 GLN 16 44.948 47.047 30.549 74 H LYS 17 H LYS 17 42.676 43.317 24.818 75 HA LYS 17 HA LYS 17 40.085 43.475 24.420 76 HB2 LYS 17 HB2 LYS 17 41.652 44.634 23.057 77 HB3 LYS 17 HB3 LYS 17 42.109 43.275 22.445 78 HG2 LYS 17 HG2 LYS 17 39.981 42.947 21.471 79 HG3 LYS 17 HG3 LYS 17 39.432 44.227 22.174 80 HD2 LYS 17 HD2 LYS 17 40.807 45.601 20.845 81 HD3 LYS 17 HD3 LYS 17 41.490 44.351 20.209 82 HE2 LYS 17 HE2 LYS 17 39.933 45.146 18.670 83 HE3 LYS 17 HE3 LYS 17 39.426 43.758 19.169 84 HZ1 LYS 17 HZ1 LYS 17 37.732 45.260 19.192 85 HZ2 LYS 17 HZ2 LYS 17 37.983 44.844 20.562 86 HZ3 LYS 17 HZ3 LYS 17 38.455 46.138 20.097 87 H GLU 18 H GLU 18 42.181 40.795 23.630 88 HA GLU 18 HA GLU 18 40.325 39.417 22.349 89 HB2 GLU 18 HB2 GLU 18 42.859 39.313 22.184 90 HB3 GLU 18 HB3 GLU 18 42.701 38.184 23.248 91 HG2 GLU 18 HG2 GLU 18 42.765 37.158 21.157 92 HG3 GLU 18 HG3 GLU 18 41.326 36.957 21.724 93 H ILE 19 H ILE 19 41.483 39.029 25.579 94 HA ILE 19 HA ILE 19 40.076 36.887 26.237 95 HB ILE 19 HB ILE 19 41.405 38.627 27.992 96 HG12 ILE 19 HG12 ILE 19 42.471 36.176 26.989 97 HG13 ILE 19 HG13 ILE 19 42.895 37.557 26.401 98 HG21 ILE 19 HG21 ILE 19 41.340 36.798 29.538 99 HG22 ILE 19 HG22 ILE 19 39.867 37.222 29.139 100 HG23 ILE 19 HG23 ILE 19 40.530 35.945 28.476 101 HD11 ILE 19 HD11 ILE 19 44.534 36.818 27.917 102 HD12 ILE 19 HD12 ILE 19 43.882 38.150 28.473 103 HD13 ILE 19 HD13 ILE 19 43.451 36.747 29.070 104 H ALA 20 H ALA 20 39.339 40.295 26.682 105 HA ALA 20 HA ALA 20 37.059 40.047 27.919 106 HB1 ALA 20 HB1 ALA 20 36.682 42.290 27.293 107 HB2 ALA 20 HB2 ALA 20 38.139 42.113 27.891 108 HB3 ALA 20 HB3 ALA 20 37.933 42.219 26.324 109 H LEU 21 H LEU 21 37.551 39.858 24.474 110 HA LEU 21 HA LEU 21 35.027 39.611 23.754 111 HB2 LEU 21 HB2 LEU 21 36.684 40.220 22.199 112 HB3 LEU 21 HB3 LEU 21 37.362 38.824 22.353 113 HG LEU 21 HG LEU 21 35.525 37.789 21.354 114 HD11 LEU 21 HD11 LEU 21 33.792 39.030 20.345 115 HD12 LEU 21 HD12 LEU 21 33.792 39.253 21.913 116 HD13 LEU 21 HD13 LEU 21 34.398 40.359 20.957 117 HD21 LEU 21 HD21 LEU 21 35.851 38.644 19.129 118 HD22 LEU 21 HD22 LEU 21 36.524 39.939 19.746 119 HD23 LEU 21 HD23 LEU 21 37.242 38.533 19.876 120 H ILE 22 H ILE 22 37.257 37.075 24.663 121 HA ILE 22 HA ILE 22 35.654 35.028 24.240 122 HB ILE 22 HB ILE 22 37.977 35.110 25.842 123 HG12 ILE 22 HG12 ILE 22 37.837 33.921 23.280 124 HG13 ILE 22 HG13 ILE 22 38.233 35.422 23.424 125 HG21 ILE 22 HG21 ILE 22 37.916 32.725 25.785 126 HG22 ILE 22 HG22 ILE 22 36.610 33.279 26.489 127 HG23 ILE 22 HG23 ILE 22 36.550 32.788 24.984 128 HD11 ILE 22 HD11 ILE 22 40.181 34.118 23.223 129 HD12 ILE 22 HD12 ILE 22 40.169 34.806 24.650 130 HD13 ILE 22 HD13 ILE 22 39.767 33.281 24.502 131 H LEU 23 H LEU 23 36.048 36.848 27.200 132 HA LEU 23 HA LEU 23 34.451 35.633 28.782 133 HB2 LEU 23 HB2 LEU 23 35.573 38.168 28.775 134 HB3 LEU 23 HB3 LEU 23 34.195 38.160 29.504 135 HG LEU 23 HG LEU 23 35.064 36.408 30.913 136 HD11 LEU 23 HD11 LEU 23 37.412 36.201 31.095 137 HD12 LEU 23 HD12 LEU 23 36.930 35.757 29.653 138 HD13 LEU 23 HD13 LEU 23 37.585 37.183 29.864 139 HD21 LEU 23 HD21 LEU 23 36.234 37.926 32.339 140 HD22 LEU 23 HD22 LEU 23 36.351 38.945 31.132 141 HD23 LEU 23 HD23 LEU 23 34.933 38.617 31.757 142 H GLN 24 H GLN 24 33.495 37.720 26.240 143 HA GLN 24 HA GLN 24 30.885 37.905 26.839 144 HB2 GLN 24 HB2 GLN 24 32.408 39.553 25.628 145 HB3 GLN 24 HB3 GLN 24 31.954 38.754 24.368 146 HG2 GLN 24 HG2 GLN 24 29.666 39.298 24.909 147 HG3 GLN 24 HG3 GLN 24 30.189 40.194 26.075 148 HE21 GLN 24 HE21 GLN 24 31.607 42.126 25.357 149 HE22 GLN 24 HE22 GLN 24 31.350 42.739 24.024 150 H ARG 25 H ARG 25 32.644 35.858 24.735 151 HA ARG 25 HA ARG 25 30.485 34.966 23.445 152 HB2 ARG 25 HB2 ARG 25 33.242 34.762 22.731 153 HB3 ARG 25 HB3 ARG 25 32.165 33.989 21.910 154 HG2 ARG 25 HG2 ARG 25 32.363 36.811 22.038 155 HG3 ARG 25 HG3 ARG 25 32.740 35.955 20.790 156 HD2 ARG 25 HD2 ARG 25 30.098 36.376 21.722 157 HD3 ARG 25 HD3 ARG 25 30.682 36.964 20.402 158 HE ARG 25 HE ARG 25 30.827 34.474 19.928 159 HH11 ARG 25 HH11 ARG 25 29.369 33.061 19.118 160 HH12 ARG 25 HH12 ARG 25 27.908 33.328 19.225 161 HH21 ARG 25 HH21 ARG 25 28.086 36.113 20.823 162 HH22 ARG 25 HH22 ARG 25 27.153 35.117 20.224 163 H GLU 26 H GLU 26 32.914 33.331 25.315 164 HA GLU 26 HA GLU 26 31.972 30.883 24.685 165 HB2 GLU 26 HB2 GLU 26 34.335 31.340 24.801 166 HB3 GLU 26 HB3 GLU 26 34.190 31.492 26.346 167 HG2 GLU 26 HG2 GLU 26 35.050 29.371 25.824 168 HG3 GLU 26 HG3 GLU 26 33.693 29.226 26.578 169 H ILE 27 H ILE 27 31.369 32.922 27.213 170 HA ILE 27 HA ILE 27 29.876 31.219 28.662 171 HB ILE 27 HB ILE 27 30.715 32.082 30.683 172 HG12 ILE 27 HG12 ILE 27 32.808 33.250 29.199 173 HG13 ILE 27 HG13 ILE 27 31.676 34.066 29.895 174 HG21 ILE 27 HG21 ILE 27 32.646 30.717 30.760 175 HG22 ILE 27 HG22 ILE 27 31.461 29.967 30.025 176 HG23 ILE 27 HG23 ILE 27 32.629 30.621 29.180 177 HD11 ILE 27 HD11 ILE 27 33.612 34.129 31.216 178 HD12 ILE 27 HD12 ILE 27 32.467 33.377 32.013 179 HD13 ILE 27 HD13 ILE 27 33.616 32.548 31.305 180 H LYS 28 H LYS 28 28.129 32.368 29.950 181 HA LYS 28 HA LYS 28 27.016 34.326 28.509 182 HB2 LYS 28 HB2 LYS 28 25.893 33.038 30.759 183 HB3 LYS 28 HB3 LYS 28 25.100 33.941 29.767 184 HG2 LYS 28 HG2 LYS 28 26.161 31.401 29.097 185 HG3 LYS 28 HG3 LYS 28 24.647 31.677 29.346 186 HD2 LYS 28 HD2 LYS 28 24.642 33.105 27.387 187 HD3 LYS 28 HD3 LYS 28 26.113 32.667 27.110 188 HE2 LYS 28 HE2 LYS 28 25.424 30.425 26.849 189 HE3 LYS 28 HE3 LYS 28 23.956 30.819 27.199 190 HZ1 LYS 28 HZ1 LYS 28 24.213 30.688 24.950 191 HZ2 LYS 28 HZ2 LYS 28 23.890 32.064 25.289 192 HZ3 LYS 28 HZ3 LYS 28 25.258 31.698 24.963 193 H ASP 29 H ASP 29 28.195 36.290 28.826 194 HA ASP 29 HA ASP 29 28.362 37.573 31.117 195 HB2 ASP 29 HB2 ASP 29 29.598 38.128 29.100 196 HB3 ASP 29 HB3 ASP 29 28.310 38.849 28.597 197 HA PRO 30 HA PRO 30 24.075 39.355 30.172 198 HB2 PRO 30 HB2 PRO 30 22.839 36.909 29.339 199 HB3 PRO 30 HB3 PRO 30 22.364 38.346 28.962 200 HG2 PRO 30 HG2 PRO 30 23.732 37.137 27.205 201 HG3 PRO 30 HG3 PRO 30 24.093 38.636 27.437 202 HD2 PRO 30 HD2 PRO 30 25.482 36.389 28.487 203 HD3 PRO 30 HD3 PRO 30 26.130 37.686 27.912 204 H ARG 31 H ARG 31 24.388 36.224 31.608 205 HA ARG 31 HA ARG 31 22.834 36.570 33.722 206 HB2 ARG 31 HB2 ARG 31 23.345 34.410 32.962 207 HB3 ARG 31 HB3 ARG 31 24.873 34.667 33.138 208 HG2 ARG 31 HG2 ARG 31 24.769 34.423 35.407 209 HG3 ARG 31 HG3 ARG 31 23.226 34.647 35.441 210 HD2 ARG 31 HD2 ARG 31 23.756 32.355 35.786 211 HD3 ARG 31 HD3 ARG 31 22.835 32.531 34.541 212 HE ARG 31 HE ARG 31 25.508 32.370 34.055 213 HH11 ARG 31 HH11 ARG 31 26.251 30.993 32.496 214 HH12 ARG 31 HH12 ARG 31 25.396 29.864 32.033 215 HH21 ARG 31 HH21 ARG 31 22.781 30.523 33.753 216 HH22 ARG 31 HH22 ARG 31 23.389 29.592 32.761 217 H LEU 32 H LEU 32 25.858 37.870 33.232 218 HA LEU 32 HA LEU 32 26.260 38.458 35.898 219 HB2 LEU 32 HB2 LEU 32 28.136 38.499 33.779 220 HB3 LEU 32 HB3 LEU 32 28.493 38.919 35.238 221 HG LEU 32 HG LEU 32 27.741 36.288 34.556 222 HD11 LEU 32 HD11 LEU 32 29.998 35.683 34.746 223 HD12 LEU 32 HD12 LEU 32 29.803 36.734 33.577 224 HD13 LEU 32 HD13 LEU 32 30.380 37.204 34.975 225 HD21 LEU 32 HD21 LEU 32 28.495 35.685 36.695 226 HD22 LEU 32 HD22 LEU 32 28.812 37.205 37.007 227 HD23 LEU 32 HD23 LEU 32 27.314 36.734 36.801 228 H GLY 33 H GLY 33 24.407 39.926 34.001 229 HA2 GLY 33 HA2 GLY 33 23.683 41.996 34.040 230 HA3 GLY 33 HA3 GLY 33 25.019 42.450 34.704 231 H MET 34 H MET 34 26.027 40.794 32.080 232 HA MET 34 HA MET 34 26.584 41.169 30.047 233 HB2 MET 34 HB2 MET 34 24.294 42.057 29.873 234 HB3 MET 34 HB3 MET 34 24.984 43.455 29.827 235 HG2 MET 34 HG2 MET 34 24.458 42.349 27.682 236 HG3 MET 34 HG3 MET 34 25.801 43.136 27.789 237 HE1 MET 34 HE1 MET 34 26.853 40.296 25.546 238 HE2 MET 34 HE2 MET 34 25.484 41.093 25.528 239 HE3 MET 34 HE3 MET 34 26.850 41.871 25.715 240 H MET 35 H MET 35 27.788 42.808 32.472 241 HA MET 35 HA MET 35 29.548 44.179 30.898 242 HB2 MET 35 HB2 MET 35 28.011 45.704 32.021 243 HB3 MET 35 HB3 MET 35 28.769 45.352 33.338 244 HG2 MET 35 HG2 MET 35 30.776 46.194 32.355 245 HG3 MET 35 HG3 MET 35 29.946 46.636 31.111 246 HE1 MET 35 HE1 MET 35 30.859 49.943 32.758 247 HE2 MET 35 HE2 MET 35 31.747 48.632 32.705 248 HE3 MET 35 HE3 MET 35 30.961 49.109 31.415 249 H THR 36 H THR 36 30.780 41.982 31.360 250 HA THR 36 HA THR 36 32.306 42.181 33.675 251 HB THR 36 HB THR 36 31.889 39.797 32.298 252 HG1 THR 36 HG1 THR 36 30.064 40.095 33.330 253 HG21 THR 36 HG21 THR 36 32.848 38.744 34.117 254 HG22 THR 36 HG22 THR 36 33.878 39.742 33.446 255 HG23 THR 36 HG23 THR 36 33.136 40.151 34.783 256 H THR 37 H THR 37 34.513 42.871 33.279 257 HA THR 37 HA THR 37 35.483 42.530 30.756 258 HB THR 37 HB THR 37 35.722 45.056 31.984 259 HG1 THR 37 HG1 THR 37 34.047 45.665 30.633 260 HG21 THR 37 HG21 THR 37 36.282 45.905 29.899 261 HG22 THR 37 HG22 THR 37 37.306 44.782 30.347 262 HG23 THR 37 HG23 THR 37 36.180 44.449 29.284 263 H VAL 38 H VAL 38 37.769 42.133 30.566 264 HA VAL 38 HA VAL 38 39.244 41.626 32.714 265 HB VAL 38 HB VAL 38 40.015 41.742 30.024 266 HG11 VAL 38 HG11 VAL 38 42.018 40.608 30.600 267 HG12 VAL 38 HG12 VAL 38 41.955 42.026 31.301 268 HG13 VAL 38 HG13 VAL 38 41.623 40.718 32.130 269 HG21 VAL 38 HG21 VAL 38 40.017 39.347 30.112 270 HG22 VAL 38 HG22 VAL 38 39.520 39.422 31.614 271 HG23 VAL 38 HG23 VAL 38 38.575 39.911 30.442 272 H SER 39 H SER 39 40.112 43.293 34.010 273 HA SER 39 HA SER 39 40.514 45.744 33.099 274 HB2 SER 39 HB2 SER 39 41.015 46.309 35.354 275 HB3 SER 39 HB3 SER 39 39.625 45.611 35.243 276 HG SER 39 HG SER 39 41.173 44.815 36.790 277 H GLY 40 H GLY 40 42.660 43.149 33.632 278 HA2 GLY 40 HA2 GLY 40 44.666 44.132 32.300 279 HA3 GLY 40 HA3 GLY 40 44.986 44.261 33.821 280 H VAL 41 H VAL 41 46.673 42.724 32.305 281 HA VAL 41 HA VAL 41 46.412 40.210 33.256 282 HB VAL 41 HB VAL 41 47.400 39.308 31.329 283 HG11 VAL 41 HG11 VAL 41 45.487 39.436 29.910 284 HG12 VAL 41 HG12 VAL 41 45.053 39.227 31.418 285 HG13 VAL 41 HG13 VAL 41 44.964 40.666 30.760 286 HG21 VAL 41 HG21 VAL 41 47.548 40.547 29.320 287 HG22 VAL 41 HG22 VAL 41 47.137 41.854 30.112 288 HG23 VAL 41 HG23 VAL 41 48.515 41.140 30.424 289 H GLU 42 H GLU 42 48.432 39.027 33.814 290 HA GLU 42 HA GLU 42 50.798 40.325 33.834 291 HB2 GLU 42 HB2 GLU 42 49.602 40.769 35.916 292 HB3 GLU 42 HB3 GLU 42 49.700 39.245 36.231 293 HG2 GLU 42 HG2 GLU 42 52.051 39.406 36.362 294 HG3 GLU 42 HG3 GLU 42 51.979 40.920 35.996 295 H MET 43 H MET 43 52.467 39.033 33.099 296 HA MET 43 HA MET 43 51.987 36.406 32.728 297 HB2 MET 43 HB2 MET 43 53.649 38.115 31.175 298 HB3 MET 43 HB3 MET 43 53.485 36.596 30.863 299 HG2 MET 43 HG2 MET 43 52.101 37.521 29.379 300 HG3 MET 43 HG3 MET 43 51.119 37.064 30.502 301 HE1 MET 43 HE1 MET 43 52.198 41.213 29.441 302 HE2 MET 43 HE2 MET 43 53.269 40.172 29.968 303 HE3 MET 43 HE3 MET 43 52.528 39.917 28.592 304 H SER 44 H SER 44 53.492 34.739 33.200 305 HA SER 44 HA SER 44 55.293 35.218 35.141 306 HB2 SER 44 HB2 SER 44 53.592 33.563 35.447 307 HB3 SER 44 HB3 SER 44 54.190 32.746 34.261 308 HG SER 44 HG SER 44 54.865 32.061 36.281 309 H ARG 45 H ARG 45 57.321 33.684 35.220 310 HA ARG 45 HA ARG 45 58.990 35.057 33.776 311 HB2 ARG 45 HB2 ARG 45 59.300 34.297 36.091 312 HB3 ARG 45 HB3 ARG 45 59.626 32.882 35.521 313 HG2 ARG 45 HG2 ARG 45 61.617 33.658 34.558 314 HG3 ARG 45 HG3 ARG 45 61.255 35.137 34.893 315 HD2 ARG 45 HD2 ARG 45 61.428 34.658 37.218 316 HD3 ARG 45 HD3 ARG 45 61.778 33.173 36.888 317 HE ARG 45 HE ARG 45 63.637 34.593 35.737 318 HH11 ARG 45 HH11 ARG 45 65.715 34.869 36.568 319 HH12 ARG 45 HH12 ARG 45 65.932 34.833 38.041 320 HH21 ARG 45 HH21 ARG 45 62.909 34.237 38.941 321 HH22 ARG 45 HH22 ARG 45 64.301 34.466 39.420 322 H ASP 46 H ASP 46 58.146 31.812 33.119 323 HA ASP 46 HA ASP 46 59.681 31.770 30.885 324 HB2 ASP 46 HB2 ASP 46 59.884 29.515 30.984 325 HB3 ASP 46 HB3 ASP 46 60.264 30.063 32.394 326 H LEU 47 H LEU 47 56.849 32.778 31.162 327 HA LEU 47 HA LEU 47 54.979 32.862 30.243 328 HB2 LEU 47 HB2 LEU 47 56.337 32.136 27.887 329 HB3 LEU 47 HB3 LEU 47 54.906 32.758 27.906 330 HG LEU 47 HG LEU 47 57.223 34.139 28.757 331 HD11 LEU 47 HD11 LEU 47 56.937 35.447 26.772 332 HD12 LEU 47 HD12 LEU 47 57.143 33.924 26.389 333 HD13 LEU 47 HD13 LEU 47 55.690 34.553 26.381 334 HD21 LEU 47 HD21 LEU 47 55.894 36.092 28.877 335 HD22 LEU 47 HD22 LEU 47 54.615 35.238 28.499 336 HD23 LEU 47 HD23 LEU 47 55.348 34.997 29.883 337 H ALA 48 H ALA 48 55.442 30.343 31.586 338 HA ALA 48 HA ALA 48 53.825 28.563 30.461 339 HB1 ALA 48 HB1 ALA 48 54.264 27.309 32.436 340 HB2 ALA 48 HB2 ALA 48 55.625 27.793 31.786 341 HB3 ALA 48 HB3 ALA 48 55.032 28.553 33.044 342 H TYR 49 H TYR 49 53.329 31.029 32.804 343 HA TYR 49 HA TYR 49 50.697 30.414 33.069 344 HB2 TYR 49 HB2 TYR 49 52.124 31.339 35.357 345 HB3 TYR 49 HB3 TYR 49 50.764 30.574 35.381 346 HD1 TYR 49 HD1 TYR 49 50.858 28.059 34.780 347 HD2 TYR 49 HD2 TYR 49 54.119 30.120 35.794 348 HE1 TYR 49 HE1 TYR 49 51.971 26.082 35.192 349 HE2 TYR 49 HE2 TYR 49 55.242 28.151 36.219 350 HH TYR 49 HH TYR 49 55.161 25.917 36.259 351 H ALA 50 H ALA 50 49.184 32.266 33.337 352 HA ALA 50 HA ALA 50 50.151 34.713 33.847 353 HB1 ALA 50 HB1 ALA 50 48.845 35.688 32.122 354 HB2 ALA 50 HB2 ALA 50 49.929 34.709 31.510 355 HB3 ALA 50 HB3 ALA 50 48.422 34.240 31.639 356 H LYS 51 H LYS 51 48.905 36.082 35.115 357 HA LYS 51 HA LYS 51 46.552 35.272 36.174 358 HB2 LYS 51 HB2 LYS 51 48.212 37.403 37.041 359 HB3 LYS 51 HB3 LYS 51 46.900 36.983 37.770 360 HG2 LYS 51 HG2 LYS 51 47.898 34.822 38.201 361 HG3 LYS 51 HG3 LYS 51 49.231 35.358 37.596 362 HD2 LYS 51 HD2 LYS 51 48.056 36.528 39.898 363 HD3 LYS 51 HD3 LYS 51 49.168 35.440 40.005 364 HE2 LYS 51 HE2 LYS 51 50.616 36.956 38.752 365 HE3 LYS 51 HE3 LYS 51 49.528 38.052 38.959 366 HZ1 LYS 51 HZ1 LYS 51 51.106 38.203 40.584 367 HZ2 LYS 51 HZ2 LYS 51 49.841 37.862 41.214 368 HZ3 LYS 51 HZ3 LYS 51 50.857 36.840 41.021 369 H VAL 52 H VAL 52 44.569 36.259 35.719 370 HA VAL 52 HA VAL 52 44.435 38.433 34.097 371 HB VAL 52 HB VAL 52 42.510 36.418 34.209 372 HG11 VAL 52 HG11 VAL 52 41.537 37.455 32.286 373 HG12 VAL 52 HG12 VAL 52 41.548 38.456 33.513 374 HG13 VAL 52 HG13 VAL 52 42.635 38.595 32.370 375 HG21 VAL 52 HG21 VAL 52 43.216 35.746 32.016 376 HG22 VAL 52 HG22 VAL 52 44.387 36.810 32.087 377 HG23 VAL 52 HG23 VAL 52 44.393 35.559 33.060 378 H TYR 53 H TYR 53 43.564 40.266 35.133 379 HA TYR 53 HA TYR 53 42.063 40.133 37.402 380 HB2 TYR 53 HB2 TYR 53 43.212 42.422 36.230 381 HB3 TYR 53 HB3 TYR 53 42.564 42.366 37.647 382 HD1 TYR 53 HD1 TYR 53 43.787 40.654 39.321 383 HD2 TYR 53 HD2 TYR 53 45.564 42.405 36.136 384 HE1 TYR 53 HE1 TYR 53 45.886 40.174 40.229 385 HE2 TYR 53 HE2 TYR 53 47.659 41.962 37.063 386 HH TYR 53 HH TYR 53 48.823 41.091 38.811 387 H VAL 54 H VAL 54 39.821 40.544 37.392 388 HA VAL 54 HA VAL 54 38.559 41.268 35.095 389 HB VAL 54 HB VAL 54 37.684 39.196 36.761 390 HG11 VAL 54 HG11 VAL 54 36.139 38.613 35.015 391 HG12 VAL 54 HG12 VAL 54 35.875 40.088 35.529 392 HG13 VAL 54 HG13 VAL 54 36.660 39.851 34.174 393 HG21 VAL 54 HG21 VAL 54 38.294 37.624 35.045 394 HG22 VAL 54 HG22 VAL 54 38.925 38.815 34.213 395 HG23 VAL 54 HG23 VAL 54 39.573 38.381 35.591 396 H THR 55 H THR 55 36.647 42.596 35.411 397 HA THR 55 HA THR 55 35.904 43.358 37.921 398 HB THR 55 HB THR 55 37.435 44.882 37.088 399 HG1 THR 55 HG1 THR 55 36.146 45.865 38.431 400 HG21 THR 55 HG21 THR 55 36.880 46.417 35.425 401 HG22 THR 55 HG22 THR 55 37.011 44.953 34.837 402 HG23 THR 55 HG23 THR 55 35.579 45.578 35.098 403 H PHE 56 H PHE 56 33.714 43.690 38.276 404 HA PHE 56 HA PHE 56 32.022 42.729 36.373 405 HB2 PHE 56 HB2 PHE 56 32.152 42.183 39.149 406 HB3 PHE 56 HB3 PHE 56 30.854 41.852 38.351 407 HD1 PHE 56 HD1 PHE 56 34.348 40.956 38.158 408 HD2 PHE 56 HD2 PHE 56 30.560 39.642 37.682 409 HE1 PHE 56 HE1 PHE 56 35.147 38.789 37.796 410 HE2 PHE 56 HE2 PHE 56 31.353 37.462 37.385 411 HZ PHE 56 HZ PHE 56 33.644 37.040 37.417 412 H LEU 57 H LEU 57 30.032 43.813 35.908 413 HA LEU 57 HA LEU 57 29.025 45.767 37.450 414 HB2 LEU 57 HB2 LEU 57 28.555 45.747 35.158 415 HB3 LEU 57 HB3 LEU 57 27.916 44.329 35.272 416 HG LEU 57 HG LEU 57 26.116 45.198 36.454 417 HD11 LEU 57 HD11 LEU 57 25.791 47.513 36.728 418 HD12 LEU 57 HD12 LEU 57 27.070 47.031 37.526 419 HD13 LEU 57 HD13 LEU 57 27.237 47.777 36.140 420 HD21 LEU 57 HD21 LEU 57 25.118 46.434 34.658 421 HD22 LEU 57 HD22 LEU 57 26.553 46.620 34.012 422 HD23 LEU 57 HD23 LEU 57 25.900 45.179 34.090 423 H ASN 58 H ASN 58 28.748 42.366 37.584 424 HA ASN 58 HA ASN 58 26.742 42.227 39.356 425 HB2 ASN 58 HB2 ASN 58 27.544 40.515 37.621 426 HB3 ASN 58 HB3 ASN 58 28.298 39.963 38.870 427 HD21 ASN 58 HD21 ASN 58 24.390 39.754 38.733 428 HD22 ASN 58 HD22 ASN 58 25.118 40.698 37.840 429 H ASP 59 H ASP 59 29.546 43.426 39.990 430 HA ASP 59 HA ASP 59 30.392 42.654 42.318 431 HB2 ASP 59 HB2 ASP 59 31.475 44.205 40.807 432 HB3 ASP 59 HB3 ASP 59 30.398 45.272 41.174 433 H LYS 60 H LYS 60 27.439 44.011 41.755 434 HA LYS 60 HA LYS 60 26.655 44.919 44.127 435 HB2 LYS 60 HB2 LYS 60 25.755 45.476 41.923 436 HB3 LYS 60 HB3 LYS 60 25.114 44.055 41.887 437 HG2 LYS 60 HG2 LYS 60 23.561 44.592 43.471 438 HG3 LYS 60 HG3 LYS 60 24.363 45.843 43.945 439 HD2 LYS 60 HD2 LYS 60 22.423 46.446 42.690 440 HD3 LYS 60 HD3 LYS 60 23.724 47.068 42.096 441 HE2 LYS 60 HE2 LYS 60 22.537 46.331 40.301 442 HE3 LYS 60 HE3 LYS 60 23.729 45.335 40.439 443 HZ1 LYS 60 HZ1 LYS 60 21.796 44.201 40.128 444 HZ2 LYS 60 HZ2 LYS 60 22.312 43.860 41.445 445 HZ3 LYS 60 HZ3 LYS 60 21.201 44.788 41.317 446 H ASP 61 H ASP 61 27.130 41.687 43.402 447 HA ASP 61 HA ASP 61 26.466 41.105 45.935 448 HB2 ASP 61 HB2 ASP 61 24.636 40.348 44.500 449 HB3 ASP 61 HB3 ASP 61 25.630 39.317 43.883 450 H GLU 62 H GLU 62 28.341 40.316 46.921 451 HA GLU 62 HA GLU 62 30.511 39.764 45.644 452 HB2 GLU 62 HB2 GLU 62 29.988 39.262 48.397 453 HB3 GLU 62 HB3 GLU 62 31.425 39.289 47.792 454 HG2 GLU 62 HG2 GLU 62 31.416 41.322 48.653 455 HG3 GLU 62 HG3 GLU 62 30.840 41.683 47.249 456 H ASP 63 H ASP 63 28.343 37.377 46.963 457 HA ASP 63 HA ASP 63 29.809 35.223 46.530 458 HB2 ASP 63 HB2 ASP 63 28.109 35.200 48.153 459 HB3 ASP 63 HB3 ASP 63 27.027 35.441 47.056 460 H ALA 64 H ALA 64 27.587 36.792 44.426 461 HA ALA 64 HA ALA 64 27.516 35.020 42.467 462 HB1 ALA 64 HB1 ALA 64 26.462 36.746 41.272 463 HB2 ALA 64 HB2 ALA 64 25.803 36.596 42.703 464 HB3 ALA 64 HB3 ALA 64 26.831 37.767 42.424 465 H VAL 65 H VAL 65 29.685 37.732 42.903 466 HA VAL 65 HA VAL 65 31.140 37.450 40.786 467 HB VAL 65 HB VAL 65 31.986 38.521 43.239 468 HG11 VAL 65 HG11 VAL 65 33.765 39.575 42.060 469 HG12 VAL 65 HG12 VAL 65 33.895 38.000 41.962 470 HG13 VAL 65 HG13 VAL 65 33.317 38.825 40.740 471 HG21 VAL 65 HG21 VAL 65 31.612 40.654 42.220 472 HG22 VAL 65 HG22 VAL 65 31.101 39.921 40.912 473 HG23 VAL 65 HG23 VAL 65 30.266 39.820 42.254 474 H LYS 66 H LYS 66 31.599 35.819 43.873 475 HA LYS 66 HA LYS 66 33.736 34.405 43.329 476 HB2 LYS 66 HB2 LYS 66 32.989 34.699 45.533 477 HB3 LYS 66 HB3 LYS 66 31.726 33.833 45.236 478 HG2 LYS 66 HG2 LYS 66 33.267 32.537 46.421 479 HG3 LYS 66 HG3 LYS 66 33.064 31.908 45.008 480 HD2 LYS 66 HD2 LYS 66 35.115 32.650 44.279 481 HD3 LYS 66 HD3 LYS 66 35.274 33.607 45.500 482 HE2 LYS 66 HE2 LYS 66 36.638 31.850 45.992 483 HE3 LYS 66 HE3 LYS 66 35.398 31.641 46.915 484 HZ1 LYS 66 HZ1 LYS 66 35.951 29.695 45.900 485 HZ2 LYS 66 HZ2 LYS 66 34.629 30.081 45.439 486 HZ3 LYS 66 HZ3 LYS 66 35.784 30.277 44.579 487 H ALA 67 H ALA 67 30.450 33.411 42.782 488 HA ALA 67 HA ALA 67 30.870 31.077 41.677 489 HB1 ALA 67 HB1 ALA 67 28.631 31.291 40.934 490 HB2 ALA 67 HB2 ALA 67 28.735 31.707 42.459 491 HB3 ALA 67 HB3 ALA 67 28.648 32.822 41.338 492 H GLY 68 H GLY 68 30.604 34.145 40.034 493 HA2 GLY 68 HA2 GLY 68 30.876 33.460 37.561 494 HA3 GLY 68 HA3 GLY 68 31.232 34.867 38.131 495 H ILE 69 H ILE 69 33.508 34.363 39.697 496 HA ILE 69 HA ILE 69 35.558 33.978 38.129 497 HB ILE 69 HB ILE 69 35.386 34.117 40.906 498 HG12 ILE 69 HG12 ILE 69 35.108 36.190 39.792 499 HG13 ILE 69 HG13 ILE 69 36.320 36.238 40.773 500 HG21 ILE 69 HG21 ILE 69 37.749 34.195 41.102 501 HG22 ILE 69 HG22 ILE 69 37.264 32.786 40.564 502 HG23 ILE 69 HG23 ILE 69 37.869 33.852 39.560 503 HD11 ILE 69 HD11 ILE 69 36.893 37.323 38.772 504 HD12 ILE 69 HD12 ILE 69 37.820 36.051 38.948 505 HD13 ILE 69 HD13 ILE 69 36.590 36.002 37.952 506 H LYS 70 H LYS 70 34.109 31.615 40.282 507 HA LYS 70 HA LYS 70 35.696 29.582 39.797 508 HB2 LYS 70 HB2 LYS 70 34.214 29.723 41.676 509 HB3 LYS 70 HB3 LYS 70 33.013 29.469 40.714 510 HG2 LYS 70 HG2 LYS 70 33.861 27.300 40.213 511 HG3 LYS 70 HG3 LYS 70 35.081 27.554 41.151 512 HD2 LYS 70 HD2 LYS 70 33.595 27.712 43.028 513 HD3 LYS 70 HD3 LYS 70 32.382 27.435 42.086 514 HE2 LYS 70 HE2 LYS 70 33.225 25.269 41.608 515 HE3 LYS 70 HE3 LYS 70 34.473 25.545 42.502 516 HZ1 LYS 70 HZ1 LYS 70 32.917 24.369 43.678 517 HZ2 LYS 70 HZ2 LYS 70 33.080 25.664 44.318 518 HZ3 LYS 70 HZ3 LYS 70 31.917 25.406 43.485 519 H ALA 71 H ALA 71 32.774 30.380 38.115 520 HA ALA 71 HA ALA 71 32.698 28.347 36.442 521 HB1 ALA 71 HB1 ALA 71 31.010 29.658 35.385 522 HB2 ALA 71 HB2 ALA 71 30.770 29.643 36.950 523 HB3 ALA 71 HB3 ALA 71 31.436 30.904 36.264 524 H LEU 72 H LEU 72 34.187 31.418 36.015 525 HA LEU 72 HA LEU 72 35.136 31.206 33.549 526 HB2 LEU 72 HB2 LEU 72 34.777 33.291 34.587 527 HB3 LEU 72 HB3 LEU 72 35.780 32.926 35.725 528 HG LEU 72 HG LEU 72 37.554 33.064 34.233 529 HD11 LEU 72 HD11 LEU 72 37.297 33.933 32.063 530 HD12 LEU 72 HD12 LEU 72 36.542 32.548 32.203 531 HD13 LEU 72 HD13 LEU 72 35.724 33.903 32.246 532 HD21 LEU 72 HD21 LEU 72 37.492 35.446 33.931 533 HD22 LEU 72 HD22 LEU 72 35.932 35.419 34.206 534 HD23 LEU 72 HD23 LEU 72 36.947 35.065 35.369 535 H GLN 73 H GLN 73 36.682 30.377 36.548 536 HA GLN 73 HA GLN 73 38.993 29.544 35.587 537 HB2 GLN 73 HB2 GLN 73 38.530 30.167 37.898 538 HB3 GLN 73 HB3 GLN 73 37.906 28.748 38.070 539 HG2 GLN 73 HG2 GLN 73 40.084 28.587 38.833 540 HG3 GLN 73 HG3 GLN 73 40.035 27.783 37.498 541 HE21 GLN 73 HE21 GLN 73 41.875 28.170 36.271 542 HE22 GLN 73 HE22 GLN 73 42.560 29.485 36.123 543 H GLU 74 H GLU 74 36.108 27.686 36.181 544 HA GLU 74 HA GLU 74 36.986 25.392 35.319 545 HB2 GLU 74 HB2 GLU 74 34.346 26.295 35.789 546 HB3 GLU 74 HB3 GLU 74 34.570 24.874 35.185 547 HG2 GLU 74 HG2 GLU 74 35.839 24.321 37.175 548 HG3 GLU 74 HG3 GLU 74 35.380 25.683 37.780 549 H ALA 75 H ALA 75 36.075 27.998 33.402 550 HA ALA 75 HA ALA 75 35.908 26.629 31.082 551 HB1 ALA 75 HB1 ALA 75 35.296 28.755 30.189 552 HB2 ALA 75 HB2 ALA 75 34.358 28.392 31.413 553 HB3 ALA 75 HB3 ALA 75 35.554 29.413 31.606 554 H SER 76 H SER 76 38.519 27.628 32.719 555 HA SER 76 HA SER 76 39.917 29.081 31.164 556 HB2 SER 76 HB2 SER 76 41.768 28.527 32.599 557 HB3 SER 76 HB3 SER 76 40.505 28.851 33.454 558 HG SER 76 HG SER 76 40.258 26.797 33.871 559 H GLY 77 H GLY 77 39.819 25.664 30.868 560 HA2 GLY 77 HA2 GLY 77 41.959 25.230 29.406 561 HA3 GLY 77 HA3 GLY 77 40.759 24.246 29.563 562 H PHE 78 H PHE 78 38.676 25.790 28.410 563 HA PHE 78 HA PHE 78 39.007 25.674 25.790 564 HB2 PHE 78 HB2 PHE 78 36.814 26.773 27.199 565 HB3 PHE 78 HB3 PHE 78 36.791 26.406 25.684 566 HD1 PHE 78 HD1 PHE 78 36.130 25.133 28.823 567 HD2 PHE 78 HD2 PHE 78 37.017 23.900 25.079 568 HE1 PHE 78 HE1 PHE 78 35.409 22.989 29.366 569 HE2 PHE 78 HE2 PHE 78 36.304 21.741 25.616 570 HZ PHE 78 HZ PHE 78 35.533 21.272 27.773 571 H ILE 79 H ILE 79 38.931 28.370 27.956 572 HA ILE 79 HA ILE 79 39.073 30.372 26.283 573 HB ILE 79 HB ILE 79 39.734 30.325 29.021 574 HG12 ILE 79 HG12 ILE 79 37.362 31.302 27.763 575 HG13 ILE 79 HG13 ILE 79 37.421 29.910 28.464 576 HG21 ILE 79 HG21 ILE 79 39.676 32.666 29.027 577 HG22 ILE 79 HG22 ILE 79 40.842 32.147 28.089 578 HG23 ILE 79 HG23 ILE 79 39.487 32.667 27.454 579 HD11 ILE 79 HD11 ILE 79 36.363 31.447 29.872 580 HD12 ILE 79 HD12 ILE 79 37.707 30.963 30.556 581 HD13 ILE 79 HD13 ILE 79 37.646 32.375 29.845 582 H ARG 80 H ARG 80 41.772 28.683 27.730 583 HA ARG 80 HA ARG 80 43.774 30.017 26.733 584 HB2 ARG 80 HB2 ARG 80 43.922 28.329 28.470 585 HB3 ARG 80 HB3 ARG 80 43.779 27.240 27.362 586 HG2 ARG 80 HG2 ARG 80 45.822 28.003 26.375 587 HG3 ARG 80 HG3 ARG 80 45.971 29.052 27.518 588 HD2 ARG 80 HD2 ARG 80 47.297 27.346 28.222 589 HD3 ARG 80 HD3 ARG 80 46.006 27.156 29.077 590 HE ARG 80 HE ARG 80 45.989 25.702 26.791 591 HH11 ARG 80 HH11 ARG 80 46.259 23.521 26.745 592 HH12 ARG 80 HH12 ARG 80 46.426 22.763 28.016 593 HH21 ARG 80 HH21 ARG 80 46.441 25.218 30.051 594 HH22 ARG 80 HH22 ARG 80 46.532 23.737 29.919 595 H SER 81 H SER 81 42.221 27.277 25.273 596 HA SER 81 HA SER 81 43.596 27.098 23.059 597 HB2 SER 81 HB2 SER 81 42.173 25.358 23.868 598 HB3 SER 81 HB3 SER 81 40.924 26.229 23.529 599 HG SER 81 HG SER 81 41.354 24.815 21.911 600 H LEU 82 H LEU 82 40.634 28.846 23.519 601 HA LEU 82 HA LEU 82 40.245 29.832 21.156 602 HB2 LEU 82 HB2 LEU 82 39.373 30.678 23.728 603 HB3 LEU 82 HB3 LEU 82 38.919 31.472 22.465 604 HG LEU 82 HG LEU 82 38.343 28.714 22.650 605 HD11 LEU 82 HD11 LEU 82 36.228 29.278 23.562 606 HD12 LEU 82 HD12 LEU 82 37.375 29.752 24.546 607 HD13 LEU 82 HD13 LEU 82 36.658 30.802 23.601 608 HD21 LEU 82 HD21 LEU 82 36.619 29.211 21.117 609 HD22 LEU 82 HD22 LEU 82 37.026 30.741 21.156 610 HD23 LEU 82 HD23 LEU 82 38.012 29.675 20.523 611 H LEU 83 H LEU 83 42.071 31.291 23.706 612 HA LEU 83 HA LEU 83 42.679 33.619 22.621 613 HB2 LEU 83 HB2 LEU 83 42.712 33.170 24.964 614 HB3 LEU 83 HB3 LEU 83 43.916 32.203 24.755 615 HG LEU 83 HG LEU 83 45.267 34.035 24.106 616 HD11 LEU 83 HD11 LEU 83 44.516 36.232 24.374 617 HD12 LEU 83 HD12 LEU 83 43.652 35.488 23.275 618 HD13 LEU 83 HD13 LEU 83 43.070 35.696 24.733 619 HD21 LEU 83 HD21 LEU 83 45.468 34.959 26.283 620 HD22 LEU 83 HD22 LEU 83 44.051 34.359 26.660 621 HD23 LEU 83 HD23 LEU 83 45.273 33.390 26.380 622 H GLY 84 H GLY 84 44.574 30.703 22.658 623 HA2 GLY 84 HA2 GLY 84 46.622 31.423 21.265 624 HA3 GLY 84 HA3 GLY 84 46.130 29.953 21.430 625 H LYS 85 H LYS 85 43.680 30.033 20.073 626 HA LYS 85 HA LYS 85 44.125 29.894 17.498 627 HB2 LYS 85 HB2 LYS 85 42.471 28.597 18.622 628 HB3 LYS 85 HB3 LYS 85 41.640 29.890 18.883 629 HG2 LYS 85 HG2 LYS 85 41.110 30.108 16.645 630 HG3 LYS 85 HG3 LYS 85 42.170 29.043 16.227 631 HD2 LYS 85 HD2 LYS 85 40.127 27.978 16.109 632 HD3 LYS 85 HD3 LYS 85 40.860 27.360 17.340 633 HE2 LYS 85 HE2 LYS 85 39.602 28.856 18.762 634 HE3 LYS 85 HE3 LYS 85 38.795 29.308 17.506 635 HZ1 LYS 85 HZ1 LYS 85 37.671 27.666 18.607 636 HZ2 LYS 85 HZ2 LYS 85 38.030 27.162 17.292 637 HZ3 LYS 85 HZ3 LYS 85 38.782 26.741 18.462 638 H ALA 86 H ALA 86 42.579 32.479 19.224 639 HA ALA 86 HA ALA 86 41.828 33.928 17.180 640 HB1 ALA 86 HB1 ALA 86 41.367 35.576 18.820 641 HB2 ALA 86 HB2 ALA 86 40.790 34.175 19.281 642 HB3 ALA 86 HB3 ALA 86 42.148 34.714 19.895 643 H MET 87 H MET 87 44.750 34.209 19.056 644 HA MET 87 HA MET 87 45.722 36.233 17.623 645 HB2 MET 87 HB2 MET 87 46.780 34.861 19.879 646 HB3 MET 87 HB3 MET 87 47.601 35.990 19.183 647 HG2 MET 87 HG2 MET 87 45.740 37.492 19.696 648 HG3 MET 87 HG3 MET 87 45.176 36.358 20.605 649 HE1 MET 87 HE1 MET 87 46.320 38.948 23.087 650 HE2 MET 87 HE2 MET 87 45.699 39.207 21.654 651 HE3 MET 87 HE3 MET 87 45.084 38.091 22.594 652 H ARG 88 H ARG 88 45.858 33.078 16.825 653 HA ARG 88 HA ARG 88 47.215 31.625 16.009 654 HB2 ARG 88 HB2 ARG 88 47.956 33.846 14.432 655 HB3 ARG 88 HB3 ARG 88 48.399 32.390 14.094 656 HG2 ARG 88 HG2 ARG 88 46.212 31.742 13.642 657 HG3 ARG 88 HG3 ARG 88 45.641 33.067 14.233 658 HD2 ARG 88 HD2 ARG 88 45.530 33.211 11.919 659 HD3 ARG 88 HD3 ARG 88 46.549 34.280 12.420 660 HE ARG 88 HE ARG 88 48.008 32.225 11.802 661 HH11 ARG 88 HH11 ARG 88 49.078 31.894 9.907 662 HH12 ARG 88 HH12 ARG 88 48.620 32.557 8.653 663 HH21 ARG 88 HH21 ARG 88 46.145 34.174 9.857 664 HH22 ARG 88 HH22 ARG 88 46.923 33.874 8.623 665 H LEU 89 H LEU 89 48.100 32.090 18.474 666 HA LEU 89 HA LEU 89 50.560 33.189 18.664 667 HB2 LEU 89 HB2 LEU 89 48.888 33.909 20.150 668 HB3 LEU 89 HB3 LEU 89 48.608 32.441 20.596 669 HG LEU 89 HG LEU 89 50.693 32.393 21.713 670 HD11 LEU 89 HD11 LEU 89 51.914 34.367 22.049 671 HD12 LEU 89 HD12 LEU 89 51.880 34.002 20.508 672 HD13 LEU 89 HD13 LEU 89 50.935 35.139 21.073 673 HD21 LEU 89 HD21 LEU 89 50.006 33.832 23.500 674 HD22 LEU 89 HD22 LEU 89 48.993 34.550 22.516 675 HD23 LEU 89 HD23 LEU 89 48.753 33.042 22.938 676 H ARG 90 H ARG 90 52.473 32.211 19.180 677 HA ARG 90 HA ARG 90 52.806 29.603 18.789 678 HB2 ARG 90 HB2 ARG 90 54.310 31.319 17.972 679 HB3 ARG 90 HB3 ARG 90 54.796 31.527 19.439 680 HG2 ARG 90 HG2 ARG 90 55.719 29.381 19.498 681 HG3 ARG 90 HG3 ARG 90 55.099 29.036 18.108 682 HD2 ARG 90 HD2 ARG 90 56.496 30.756 17.124 683 HD3 ARG 90 HD3 ARG 90 57.184 30.939 18.512 684 HE ARG 90 HE ARG 90 57.514 28.428 17.965 685 HH11 ARG 90 HH11 ARG 90 59.243 27.483 16.991 686 HH12 ARG 90 HH12 ARG 90 60.165 28.281 16.136 687 HH21 ARG 90 HH21 ARG 90 58.683 31.123 16.416 688 HH22 ARG 90 HH22 ARG 90 59.837 30.412 15.800 689 H ILE 91 H ILE 91 53.344 31.403 21.726 690 HA ILE 91 HA ILE 91 52.862 29.172 23.174 691 HB ILE 91 HB ILE 91 54.262 30.234 24.857 692 HG12 ILE 91 HG12 ILE 91 56.328 31.089 24.059 693 HG13 ILE 91 HG13 ILE 91 55.669 31.263 22.656 694 HG21 ILE 91 HG21 ILE 91 56.106 28.801 24.055 695 HG22 ILE 91 HG22 ILE 91 54.718 28.052 23.910 696 HG23 ILE 91 HG23 ILE 91 55.384 28.737 22.648 697 HD11 ILE 91 HD11 ILE 91 55.690 33.325 23.770 698 HD12 ILE 91 HD12 ILE 91 54.187 32.882 23.540 699 HD13 ILE 91 HD13 ILE 91 54.857 32.704 24.965 700 H VAL 92 H VAL 92 50.961 29.243 24.249 701 HA VAL 92 HA VAL 92 49.930 31.573 25.227 702 HB VAL 92 HB VAL 92 48.606 30.487 23.705 703 HG11 VAL 92 HG11 VAL 92 47.350 28.589 24.236 704 HG12 VAL 92 HG12 VAL 92 48.895 28.263 24.109 705 HG13 VAL 92 HG13 VAL 92 48.228 28.398 25.539 706 HG21 VAL 92 HG21 VAL 92 46.560 30.738 24.945 707 HG22 VAL 92 HG22 VAL 92 47.409 30.768 26.282 708 HG23 VAL 92 HG23 VAL 92 47.548 31.943 25.229 709 HA PRO 93 HA PRO 93 50.867 30.061 29.234 710 HB2 PRO 93 HB2 PRO 93 49.804 32.389 30.336 711 HB3 PRO 93 HB3 PRO 93 51.268 31.875 30.492 712 HG2 PRO 93 HG2 PRO 93 50.841 33.913 28.989 713 HG3 PRO 93 HG3 PRO 93 51.964 32.913 28.578 714 HD2 PRO 93 HD2 PRO 93 49.302 32.964 27.555 715 HD3 PRO 93 HD3 PRO 93 50.604 32.779 26.715 716 H GLU 94 H GLU 94 49.818 29.163 31.105 717 HA GLU 94 HA GLU 94 47.208 28.526 30.976 718 HB2 GLU 94 HB2 GLU 94 48.684 26.890 31.672 719 HB3 GLU 94 HB3 GLU 94 49.253 27.814 32.790 720 HG2 GLU 94 HG2 GLU 94 47.925 26.258 33.818 721 HG3 GLU 94 HG3 GLU 94 47.210 27.635 33.966 722 H LEU 95 H LEU 95 45.487 29.484 32.052 723 HA LEU 95 HA LEU 95 45.974 31.910 33.110 724 HB2 LEU 95 HB2 LEU 95 43.552 31.019 31.905 725 HB3 LEU 95 HB3 LEU 95 43.847 32.501 32.292 726 HG LEU 95 HG LEU 95 45.105 31.113 30.195 727 HD11 LEU 95 HD11 LEU 95 43.956 32.639 28.740 728 HD12 LEU 95 HD12 LEU 95 42.913 31.809 29.597 729 HD13 LEU 95 HD13 LEU 95 43.267 33.298 30.005 730 HD21 LEU 95 HD21 LEU 95 46.168 33.143 29.573 731 HD22 LEU 95 HD22 LEU 95 45.552 33.842 30.854 732 HD23 LEU 95 HD23 LEU 95 46.630 32.694 31.019 733 H THR 96 H THR 96 45.416 32.573 35.145 734 HA THR 96 HA THR 96 43.392 31.364 36.493 735 HB THR 96 HB THR 96 45.707 32.282 37.735 736 HG1 THR 96 HG1 THR 96 45.914 30.101 38.266 737 HG21 THR 96 HG21 THR 96 44.815 31.418 39.768 738 HG22 THR 96 HG22 THR 96 43.878 32.559 39.197 739 HG23 THR 96 HG23 THR 96 43.482 31.038 39.003 740 H PHE 97 H PHE 97 41.771 32.735 37.322 741 HA PHE 97 HA PHE 97 41.853 35.354 36.609 742 HB2 PHE 97 HB2 PHE 97 39.568 33.652 36.680 743 HB3 PHE 97 HB3 PHE 97 39.514 35.142 36.222 744 HD1 PHE 97 HD1 PHE 97 40.068 35.742 33.942 745 HD2 PHE 97 HD2 PHE 97 40.590 31.929 35.175 746 HE1 PHE 97 HE1 PHE 97 40.386 35.077 31.730 747 HE2 PHE 97 HE2 PHE 97 40.942 31.268 32.954 748 HZ PHE 97 HZ PHE 97 40.869 32.846 31.242 749 H PHE 98 H PHE 98 41.172 37.019 37.999 750 HA PHE 98 HA PHE 98 40.378 36.513 40.538 751 HB2 PHE 98 HB2 PHE 98 42.539 38.263 39.936 752 HB3 PHE 98 HB3 PHE 98 42.026 37.970 41.379 753 HD1 PHE 98 HD1 PHE 98 42.613 35.795 42.481 754 HD2 PHE 98 HD2 PHE 98 44.097 36.762 38.848 755 HE1 PHE 98 HE1 PHE 98 44.193 34.091 42.674 756 HE2 PHE 98 HE2 PHE 98 45.650 35.030 39.029 757 HZ PHE 98 HZ PHE 98 45.725 33.714 40.953 758 H TYR 99 H TYR 99 39.347 38.397 41.660 759 HA TYR 99 HA TYR 99 38.009 40.095 40.072 760 HB2 TYR 99 HB2 TYR 99 36.791 40.611 42.074 761 HB3 TYR 99 HB3 TYR 99 36.598 39.162 41.532 762 HD1 TYR 99 HD1 TYR 99 38.433 40.905 44.068 763 HD2 TYR 99 HD2 TYR 99 36.862 37.325 43.002 764 HE1 TYR 99 HE1 TYR 99 39.045 40.016 46.141 765 HE2 TYR 99 HE2 TYR 99 37.438 36.444 45.094 766 HH TYR 99 HH TYR 99 38.428 36.831 47.095 767 H ASP 100 H ASP 100 38.250 42.310 39.880 768 HA ASP 100 HA ASP 100 39.961 43.770 41.446 769 HB2 ASP 100 HB2 ASP 100 41.033 43.161 39.415 770 HB3 ASP 100 HB3 ASP 100 39.867 43.818 38.612 Start of MODEL 15 1 HA PRO 8 HA PRO 8 55.892 43.851 26.143 2 HB2 PRO 8 HB2 PRO 8 54.707 41.652 26.582 3 HB3 PRO 8 HB3 PRO 8 56.267 41.601 26.579 4 HG2 PRO 8 HG2 PRO 8 54.598 41.738 28.883 5 HG3 PRO 8 HG3 PRO 8 55.835 40.806 28.700 6 HD2 PRO 8 HD2 PRO 8 56.059 43.088 29.953 7 HD3 PRO 8 HD3 PRO 8 57.291 42.439 29.254 8 H GLN 9 H GLN 9 54.872 46.006 27.237 9 HA GLN 9 HA GLN 9 52.448 46.004 28.189 10 HB2 GLN 9 HB2 GLN 9 54.050 47.766 28.461 11 HB3 GLN 9 HB3 GLN 9 53.861 48.143 26.961 12 HG2 GLN 9 HG2 GLN 9 51.678 48.888 27.373 13 HG3 GLN 9 HG3 GLN 9 51.749 48.384 28.847 14 HE21 GLN 9 HE21 GLN 9 51.243 51.125 28.176 15 HE22 GLN 9 HE22 GLN 9 52.332 51.959 28.756 16 H ARG 10 H ARG 10 53.290 46.281 24.833 17 HA ARG 10 HA ARG 10 50.904 46.648 23.835 18 HB2 ARG 10 HB2 ARG 10 53.238 45.609 22.588 19 HB3 ARG 10 HB3 ARG 10 51.931 45.844 21.771 20 HG2 ARG 10 HG2 ARG 10 52.095 48.206 22.310 21 HG3 ARG 10 HG3 ARG 10 53.484 47.917 22.958 22 HD2 ARG 10 HD2 ARG 10 52.941 47.386 20.215 23 HD3 ARG 10 HD3 ARG 10 53.674 48.680 20.682 24 HE ARG 10 HE ARG 10 54.791 46.174 20.770 25 HH11 ARG 10 HH11 ARG 10 57.003 45.976 20.533 26 HH12 ARG 10 HH12 ARG 10 57.873 47.176 20.692 27 HH21 ARG 10 HH21 ARG 10 55.563 49.353 21.185 28 HH22 ARG 10 HH22 ARG 10 57.033 49.145 21.071 29 H VAL 11 H VAL 11 52.577 43.616 24.346 30 HA VAL 11 HA VAL 11 50.851 41.984 23.344 31 HB VAL 11 HB VAL 11 52.546 41.216 25.450 32 HG11 VAL 11 HG11 VAL 11 52.517 39.073 24.406 33 HG12 VAL 11 HG12 VAL 11 51.046 39.526 24.779 34 HG13 VAL 11 HG13 VAL 11 51.559 39.650 23.285 35 HG21 VAL 11 HG21 VAL 11 54.254 40.696 23.902 36 HG22 VAL 11 HG22 VAL 11 53.381 41.330 22.743 37 HG23 VAL 11 HG23 VAL 11 53.951 42.250 23.900 38 H ALA 12 H ALA 12 51.038 43.168 26.607 39 HA ALA 12 HA ALA 12 48.996 41.935 27.687 40 HB1 ALA 12 HB1 ALA 12 49.297 43.520 29.419 41 HB2 ALA 12 HB2 ALA 12 50.692 42.899 29.003 42 HB3 ALA 12 HB3 ALA 12 50.282 44.339 28.489 43 H GLN 13 H GLN 13 48.862 44.874 25.826 44 HA GLN 13 HA GLN 13 46.309 45.385 26.193 45 HB2 GLN 13 HB2 GLN 13 48.081 46.299 24.167 46 HB3 GLN 13 HB3 GLN 13 46.596 46.774 24.205 47 HG2 GLN 13 HG2 GLN 13 46.907 47.945 26.143 48 HG3 GLN 13 HG3 GLN 13 48.245 47.209 26.458 49 HE21 GLN 13 HE21 GLN 13 48.914 49.551 26.756 50 HE22 GLN 13 HE22 GLN 13 49.430 50.305 25.581 51 H GLU 14 H GLU 14 47.840 43.647 23.572 52 HA GLU 14 HA GLU 14 45.768 42.995 22.163 53 HB2 GLU 14 HB2 GLU 14 48.323 41.753 22.280 54 HB3 GLU 14 HB3 GLU 14 47.246 41.262 21.266 55 HG2 GLU 14 HG2 GLU 14 47.289 43.603 20.404 56 HG3 GLU 14 HG3 GLU 14 48.648 43.716 21.162 57 H MET 15 H MET 15 47.175 41.183 24.775 58 HA MET 15 HA MET 15 45.644 39.083 24.828 59 HB2 MET 15 HB2 MET 15 47.288 40.225 26.817 60 HB3 MET 15 HB3 MET 15 46.420 38.977 27.161 61 HG2 MET 15 HG2 MET 15 48.336 38.921 25.082 62 HG3 MET 15 HG3 MET 15 48.691 38.468 26.531 63 HE1 MET 15 HE1 MET 15 48.854 35.157 24.791 64 HE2 MET 15 HE2 MET 15 49.370 36.563 24.276 65 HE3 MET 15 HE3 MET 15 49.609 36.136 25.783 66 H GLN 16 H GLN 16 45.201 42.056 26.682 67 HA GLN 16 HA GLN 16 42.990 41.466 27.863 68 HB2 GLN 16 HB2 GLN 16 44.050 43.987 27.167 69 HB3 GLN 16 HB3 GLN 16 42.646 43.918 27.844 70 HG2 GLN 16 HG2 GLN 16 43.561 43.065 29.806 71 HG3 GLN 16 HG3 GLN 16 44.953 42.877 29.130 72 HE21 GLN 16 HE21 GLN 16 46.310 44.756 28.843 73 HE22 GLN 16 HE22 GLN 16 46.002 46.081 29.449 74 H LYS 17 H LYS 17 43.268 42.904 24.686 75 HA LYS 17 HA LYS 17 40.773 43.327 24.057 76 HB2 LYS 17 HB2 LYS 17 42.584 44.322 22.919 77 HB3 LYS 17 HB3 LYS 17 43.038 42.927 22.390 78 HG2 LYS 17 HG2 LYS 17 42.050 43.992 20.629 79 HG3 LYS 17 HG3 LYS 17 41.081 42.840 21.035 80 HD2 LYS 17 HD2 LYS 17 39.722 44.401 22.209 81 HD3 LYS 17 HD3 LYS 17 40.690 45.552 21.797 82 HE2 LYS 17 HE2 LYS 17 39.139 44.072 19.934 83 HE3 LYS 17 HE3 LYS 17 38.768 45.512 20.407 84 HZ1 LYS 17 HZ1 LYS 17 39.800 45.664 18.422 85 HZ2 LYS 17 HZ2 LYS 17 40.710 46.245 19.394 86 HZ3 LYS 17 HZ3 LYS 17 40.953 44.908 18.879 87 H GLU 18 H GLU 18 42.566 40.465 23.263 88 HA GLU 18 HA GLU 18 40.594 39.173 22.057 89 HB2 GLU 18 HB2 GLU 18 43.159 38.849 22.040 90 HB3 GLU 18 HB3 GLU 18 42.761 37.692 23.007 91 HG2 GLU 18 HG2 GLU 18 42.813 36.709 20.949 92 HG3 GLU 18 HG3 GLU 18 41.293 36.855 21.265 93 H ILE 19 H ILE 19 41.728 38.882 25.327 94 HA ILE 19 HA ILE 19 40.155 36.928 26.151 95 HB ILE 19 HB ILE 19 41.666 38.793 27.638 96 HG12 ILE 19 HG12 ILE 19 42.267 36.031 27.211 97 HG13 ILE 19 HG13 ILE 19 42.905 37.150 26.333 98 HG21 ILE 19 HG21 ILE 19 41.364 37.441 29.558 99 HG22 ILE 19 HG22 ILE 19 39.972 38.006 29.058 100 HG23 ILE 19 HG23 ILE 19 40.380 36.508 28.739 101 HD11 ILE 19 HD11 ILE 19 44.446 36.471 27.968 102 HD12 ILE 19 HD12 ILE 19 44.065 37.988 28.218 103 HD13 ILE 19 HD13 ILE 19 43.418 36.851 29.112 104 H ALA 20 H ALA 20 39.602 40.370 26.234 105 HA ALA 20 HA ALA 20 37.375 40.484 27.554 106 HB1 ALA 20 HB1 ALA 20 37.163 42.630 26.525 107 HB2 ALA 20 HB2 ALA 20 38.645 42.426 27.045 108 HB3 ALA 20 HB3 ALA 20 38.313 42.243 25.507 109 H LEU 21 H LEU 21 37.696 39.832 24.146 110 HA LEU 21 HA LEU 21 35.120 39.603 23.565 111 HB2 LEU 21 HB2 LEU 21 36.688 40.048 21.876 112 HB3 LEU 21 HB3 LEU 21 37.422 38.703 22.165 113 HG LEU 21 HG LEU 21 35.642 37.491 21.341 114 HD11 LEU 21 HD11 LEU 21 33.756 38.486 20.325 115 HD12 LEU 21 HD12 LEU 21 33.811 38.844 21.865 116 HD13 LEU 21 HD13 LEU 21 34.269 39.911 20.787 117 HD21 LEU 21 HD21 LEU 21 35.774 38.184 19.038 118 HD22 LEU 21 HD22 LEU 21 36.368 39.572 19.513 119 HD23 LEU 21 HD23 LEU 21 37.209 38.244 19.706 120 H ILE 22 H ILE 22 37.369 37.068 24.435 121 HA ILE 22 HA ILE 22 35.704 35.046 24.116 122 HB ILE 22 HB ILE 22 38.157 35.067 25.474 123 HG12 ILE 22 HG12 ILE 22 37.758 33.969 22.880 124 HG13 ILE 22 HG13 ILE 22 38.200 35.456 23.041 125 HG21 ILE 22 HG21 ILE 22 38.092 32.683 25.330 126 HG22 ILE 22 HG22 ILE 22 36.869 33.209 26.189 127 HG23 ILE 22 HG23 ILE 22 36.650 32.774 24.682 128 HD11 ILE 22 HD11 ILE 22 40.093 34.122 22.605 129 HD12 ILE 22 HD12 ILE 22 40.232 34.756 24.051 130 HD13 ILE 22 HD13 ILE 22 39.783 33.245 23.887 131 H LEU 23 H LEU 23 36.314 36.850 27.014 132 HA LEU 23 HA LEU 23 34.759 35.556 28.673 133 HB2 LEU 23 HB2 LEU 23 36.124 37.999 28.796 134 HB3 LEU 23 HB3 LEU 23 34.926 37.870 29.787 135 HG LEU 23 HG LEU 23 35.909 36.065 30.828 136 HD11 LEU 23 HD11 LEU 23 38.050 35.260 30.308 137 HD12 LEU 23 HD12 LEU 23 37.050 35.022 29.104 138 HD13 LEU 23 HD13 LEU 23 38.091 36.213 29.043 139 HD21 LEU 23 HD21 LEU 23 37.829 37.171 31.770 140 HD22 LEU 23 HD22 LEU 23 37.800 38.199 30.565 141 HD23 LEU 23 HD23 LEU 23 36.626 38.190 31.627 142 H GLN 24 H GLN 24 33.824 37.931 26.409 143 HA GLN 24 HA GLN 24 31.284 38.214 27.210 144 HB2 GLN 24 HB2 GLN 24 32.597 39.911 26.024 145 HB3 GLN 24 HB3 GLN 24 32.388 39.059 24.734 146 HG2 GLN 24 HG2 GLN 24 30.026 39.385 24.931 147 HG3 GLN 24 HG3 GLN 24 30.273 40.292 26.175 148 HE21 GLN 24 HE21 GLN 24 30.130 42.485 25.636 149 HE22 GLN 24 HE22 GLN 24 30.525 43.079 24.329 150 H ARG 25 H ARG 25 32.717 35.757 25.362 151 HA ARG 25 HA ARG 25 30.294 35.146 24.261 152 HB2 ARG 25 HB2 ARG 25 32.836 34.583 23.100 153 HB3 ARG 25 HB3 ARG 25 31.504 34.095 22.451 154 HG2 ARG 25 HG2 ARG 25 32.231 36.814 22.698 155 HG3 ARG 25 HG3 ARG 25 32.324 36.010 21.366 156 HD2 ARG 25 HD2 ARG 25 29.868 36.575 22.641 157 HD3 ARG 25 HD3 ARG 25 30.420 37.424 21.455 158 HE ARG 25 HE ARG 25 30.012 35.656 20.068 159 HH11 ARG 25 HH11 ARG 25 28.535 34.061 19.448 160 HH12 ARG 25 HH12 ARG 25 27.609 33.471 20.454 161 HH21 ARG 25 HH21 ARG 25 28.640 35.234 23.038 162 HH22 ARG 25 HH22 ARG 25 27.673 34.179 22.625 163 H GLU 26 H GLU 26 32.893 33.460 25.851 164 HA GLU 26 HA GLU 26 31.815 31.021 25.426 165 HB2 GLU 26 HB2 GLU 26 34.173 31.351 25.325 166 HB3 GLU 26 HB3 GLU 26 34.179 31.764 26.828 167 HG2 GLU 26 HG2 GLU 26 35.015 29.574 26.534 168 HG3 GLU 26 HG3 GLU 26 33.797 29.587 27.507 169 H ILE 27 H ILE 27 31.450 33.155 27.917 170 HA ILE 27 HA ILE 27 29.875 31.530 29.424 171 HB ILE 27 HB ILE 27 30.577 32.626 31.372 172 HG12 ILE 27 HG12 ILE 27 32.770 33.654 29.923 173 HG13 ILE 27 HG13 ILE 27 31.544 34.535 30.313 174 HG21 ILE 27 HG21 ILE 27 32.527 31.327 31.667 175 HG22 ILE 27 HG22 ILE 27 31.396 30.476 30.957 176 HG23 ILE 27 HG23 ILE 27 32.588 31.076 30.105 177 HD11 ILE 27 HD11 ILE 27 33.277 34.876 31.872 178 HD12 ILE 27 HD12 ILE 27 32.039 34.226 32.615 179 HD13 ILE 27 HD13 ILE 27 33.285 33.331 32.218 180 H LYS 28 H LYS 28 27.986 32.699 30.447 181 HA LYS 28 HA LYS 28 26.850 34.463 28.805 182 HB2 LYS 28 HB2 LYS 28 25.766 33.365 31.172 183 HB3 LYS 28 HB3 LYS 28 24.941 34.175 30.126 184 HG2 LYS 28 HG2 LYS 28 26.010 31.578 29.701 185 HG3 LYS 28 HG3 LYS 28 24.490 31.917 29.797 186 HD2 LYS 28 HD2 LYS 28 24.630 33.085 27.713 187 HD3 LYS 28 HD3 LYS 28 26.142 32.713 27.615 188 HE2 LYS 28 HE2 LYS 28 25.499 30.374 27.610 189 HE3 LYS 28 HE3 LYS 28 24.009 30.827 27.535 190 HZ1 LYS 28 HZ1 LYS 28 24.799 30.400 25.444 191 HZ2 LYS 28 HZ2 LYS 28 24.464 31.812 25.520 192 HZ3 LYS 28 HZ3 LYS 28 25.852 31.390 25.589 193 H ASP 29 H ASP 29 27.706 36.536 28.811 194 HA ASP 29 HA ASP 29 28.165 37.918 31.032 195 HB2 ASP 29 HB2 ASP 29 29.400 38.123 28.858 196 HB3 ASP 29 HB3 ASP 29 28.269 39.128 28.479 197 HA PRO 30 HA PRO 30 24.083 40.055 30.030 198 HB2 PRO 30 HB2 PRO 30 22.575 37.756 29.331 199 HB3 PRO 30 HB3 PRO 30 22.324 39.213 28.830 200 HG2 PRO 30 HG2 PRO 30 23.500 37.626 27.204 201 HG3 PRO 30 HG3 PRO 30 24.031 39.091 27.259 202 HD2 PRO 30 HD2 PRO 30 25.173 36.834 28.556 203 HD3 PRO 30 HD3 PRO 30 25.954 37.982 27.845 204 H ARG 31 H ARG 31 24.229 36.931 31.508 205 HA ARG 31 HA ARG 31 22.810 37.276 33.659 206 HB2 ARG 31 HB2 ARG 31 23.644 35.161 32.903 207 HB3 ARG 31 HB3 ARG 31 25.095 35.612 33.250 208 HG2 ARG 31 HG2 ARG 31 24.568 35.540 35.567 209 HG3 ARG 31 HG3 ARG 31 23.113 35.097 35.223 210 HD2 ARG 31 HD2 ARG 31 23.956 33.123 34.189 211 HD3 ARG 31 HD3 ARG 31 25.412 33.568 34.523 212 HE ARG 31 HE ARG 31 24.585 33.372 36.844 213 HH11 ARG 31 HH11 ARG 31 24.336 31.611 38.205 214 HH12 ARG 31 HH12 ARG 31 23.897 30.301 37.650 215 HH21 ARG 31 HH21 ARG 31 23.669 31.120 34.579 216 HH22 ARG 31 HH22 ARG 31 23.514 30.019 35.570 217 H LEU 32 H LEU 32 25.852 38.596 33.077 218 HA LEU 32 HA LEU 32 26.217 39.612 35.558 219 HB2 LEU 32 HB2 LEU 32 28.093 39.407 33.426 220 HB3 LEU 32 HB3 LEU 32 28.458 39.956 34.839 221 HG LEU 32 HG LEU 32 27.736 37.256 34.396 222 HD11 LEU 32 HD11 LEU 32 30.066 36.805 34.639 223 HD12 LEU 32 HD12 LEU 32 29.835 37.775 33.408 224 HD13 LEU 32 HD13 LEU 32 30.340 38.358 34.791 225 HD21 LEU 32 HD21 LEU 32 28.501 36.810 36.558 226 HD22 LEU 32 HD22 LEU 32 28.797 38.350 36.774 227 HD23 LEU 32 HD23 LEU 32 27.305 37.846 36.605 228 H GLY 33 H GLY 33 24.476 40.793 33.273 229 HA2 GLY 33 HA2 GLY 33 23.665 42.754 32.929 230 HA3 GLY 33 HA3 GLY 33 24.795 43.376 33.807 231 H MET 34 H MET 34 25.979 41.544 31.202 232 HA MET 34 HA MET 34 27.152 41.930 29.488 233 HB2 MET 34 HB2 MET 34 24.787 43.227 29.057 234 HB3 MET 34 HB3 MET 34 25.930 43.890 28.228 235 HG2 MET 34 HG2 MET 34 25.347 41.122 28.073 236 HG3 MET 34 HG3 MET 34 24.781 42.150 27.046 237 HE1 MET 34 HE1 MET 34 27.789 43.260 25.032 238 HE2 MET 34 HE2 MET 34 26.216 43.391 25.170 239 HE3 MET 34 HE3 MET 34 27.161 43.984 26.293 240 H MET 35 H MET 35 28.178 43.282 31.820 241 HA MET 35 HA MET 35 29.725 45.310 30.896 242 HB2 MET 35 HB2 MET 35 27.606 46.210 31.660 243 HB3 MET 35 HB3 MET 35 28.017 45.762 33.096 244 HG2 MET 35 HG2 MET 35 29.725 47.290 33.193 245 HG3 MET 35 HG3 MET 35 29.667 47.554 31.656 246 HE1 MET 35 HE1 MET 35 28.826 50.952 32.992 247 HE2 MET 35 HE2 MET 35 29.867 49.906 33.569 248 HE3 MET 35 HE3 MET 35 29.762 50.140 32.006 249 H THR 36 H THR 36 30.797 42.931 31.367 250 HA THR 36 HA THR 36 32.215 43.097 33.670 251 HB THR 36 HB THR 36 32.135 40.764 32.115 252 HG1 THR 36 HG1 THR 36 30.209 40.484 32.719 253 HG21 THR 36 HG21 THR 36 32.677 39.665 34.145 254 HG22 THR 36 HG22 THR 36 33.759 40.773 33.815 255 HG23 THR 36 HG23 THR 36 32.638 41.058 34.897 256 H THR 37 H THR 37 34.487 43.554 33.503 257 HA THR 37 HA THR 37 35.661 43.795 31.044 258 HB THR 37 HB THR 37 35.335 45.767 33.013 259 HG1 THR 37 HG1 THR 37 34.658 46.868 31.125 260 HG21 THR 37 HG21 THR 37 36.772 47.283 31.962 261 HG22 THR 37 HG22 THR 37 37.576 46.036 32.517 262 HG23 THR 37 HG23 THR 37 37.244 46.141 30.972 263 H VAL 38 H VAL 38 37.936 43.477 30.890 264 HA VAL 38 HA VAL 38 39.262 42.310 32.935 265 HB VAL 38 HB VAL 38 40.160 42.725 30.339 266 HG11 VAL 38 HG11 VAL 38 41.894 41.158 30.852 267 HG12 VAL 38 HG12 VAL 38 41.997 42.428 31.792 268 HG13 VAL 38 HG13 VAL 38 41.361 41.085 32.342 269 HG21 VAL 38 HG21 VAL 38 39.785 40.395 29.982 270 HG22 VAL 38 HG22 VAL 38 39.167 40.290 31.436 271 HG23 VAL 38 HG23 VAL 38 38.425 41.132 30.319 272 H SER 39 H SER 39 40.201 43.660 34.470 273 HA SER 39 HA SER 39 40.825 46.182 34.101 274 HB2 SER 39 HB2 SER 39 40.958 44.456 36.335 275 HB3 SER 39 HB3 SER 39 41.796 45.768 36.429 276 HG SER 39 HG SER 39 39.948 46.352 37.186 277 H GLY 40 H GLY 40 42.761 43.396 33.897 278 HA2 GLY 40 HA2 GLY 40 44.793 44.334 32.671 279 HA3 GLY 40 HA3 GLY 40 45.177 44.402 34.181 280 H VAL 41 H VAL 41 46.651 42.807 32.555 281 HA VAL 41 HA VAL 41 46.374 40.317 33.570 282 HB VAL 41 HB VAL 41 47.275 39.357 31.700 283 HG11 VAL 41 HG11 VAL 41 45.398 39.567 30.236 284 HG12 VAL 41 HG12 VAL 41 44.924 39.429 31.741 285 HG13 VAL 41 HG13 VAL 41 44.941 40.851 31.043 286 HG21 VAL 41 HG21 VAL 41 47.514 40.531 29.639 287 HG22 VAL 41 HG22 VAL 41 47.173 41.882 30.390 288 HG23 VAL 41 HG23 VAL 41 48.507 41.100 30.733 289 H GLU 42 H GLU 42 48.421 39.192 34.196 290 HA GLU 42 HA GLU 42 50.771 40.427 33.684 291 HB2 GLU 42 HB2 GLU 42 50.278 40.864 35.987 292 HB3 GLU 42 HB3 GLU 42 50.325 39.329 36.262 293 HG2 GLU 42 HG2 GLU 42 52.594 39.264 35.579 294 HG3 GLU 42 HG3 GLU 42 52.551 40.792 35.267 295 H MET 43 H MET 43 52.177 39.099 32.566 296 HA MET 43 HA MET 43 51.716 36.466 32.351 297 HB2 MET 43 HB2 MET 43 53.222 38.075 30.561 298 HB3 MET 43 HB3 MET 43 52.845 36.586 30.291 299 HG2 MET 43 HG2 MET 43 50.531 37.270 30.255 300 HG3 MET 43 HG3 MET 43 51.026 38.748 30.305 301 HE1 MET 43 HE1 MET 43 52.800 39.260 26.974 302 HE2 MET 43 HE2 MET 43 52.362 39.984 28.313 303 HE3 MET 43 HE3 MET 43 53.466 38.850 28.351 304 H SER 44 H SER 44 53.291 34.832 32.639 305 HA SER 44 HA SER 44 55.318 35.189 34.287 306 HB2 SER 44 HB2 SER 44 54.088 33.164 34.221 307 HB3 SER 44 HB3 SER 44 54.585 32.899 32.767 308 HG SER 44 HG SER 44 56.122 31.927 33.638 309 H ARG 45 H ARG 45 57.678 34.972 33.898 310 HA ARG 45 HA ARG 45 58.631 36.296 31.852 311 HB2 ARG 45 HB2 ARG 45 59.857 35.929 33.849 312 HB3 ARG 45 HB3 ARG 45 60.096 34.452 33.411 313 HG2 ARG 45 HG2 ARG 45 61.388 35.194 31.583 314 HG3 ARG 45 HG3 ARG 45 61.134 36.676 31.998 315 HD2 ARG 45 HD2 ARG 45 62.620 34.818 33.531 316 HD3 ARG 45 HD3 ARG 45 63.243 36.018 32.754 317 HE ARG 45 HE ARG 45 61.562 37.021 34.501 318 HH11 ARG 45 HH11 ARG 45 62.216 37.937 36.461 319 HH12 ARG 45 HH12 ARG 45 63.546 37.595 37.037 320 HH21 ARG 45 HH21 ARG 45 64.502 35.536 34.647 321 HH22 ARG 45 HH22 ARG 45 64.930 36.142 35.939 322 H ASP 46 H ASP 46 58.238 32.853 32.105 323 HA ASP 46 HA ASP 46 59.247 32.255 29.708 324 HB2 ASP 46 HB2 ASP 46 58.899 30.022 30.401 325 HB3 ASP 46 HB3 ASP 46 59.628 30.796 31.542 326 H LEU 47 H LEU 47 56.332 33.448 30.244 327 HA LEU 47 HA LEU 47 54.381 33.388 29.590 328 HB2 LEU 47 HB2 LEU 47 55.436 32.543 27.097 329 HB3 LEU 47 HB3 LEU 47 54.019 33.173 27.269 330 HG LEU 47 HG LEU 47 56.413 34.611 27.719 331 HD11 LEU 47 HD11 LEU 47 55.911 35.732 25.660 332 HD12 LEU 47 HD12 LEU 47 56.089 34.181 25.400 333 HD13 LEU 47 HD13 LEU 47 54.637 34.808 25.485 334 HD21 LEU 47 HD21 LEU 47 55.114 36.566 27.800 335 HD22 LEU 47 HD22 LEU 47 53.802 35.693 27.647 336 HD23 LEU 47 HD23 LEU 47 54.686 35.570 28.954 337 H ALA 48 H ALA 48 55.190 30.771 30.845 338 HA ALA 48 HA ALA 48 53.539 28.954 29.815 339 HB1 ALA 48 HB1 ALA 48 54.359 27.577 31.575 340 HB2 ALA 48 HB2 ALA 48 55.564 28.226 30.778 341 HB3 ALA 48 HB3 ALA 48 55.126 28.824 32.177 342 H TYR 49 H TYR 49 53.209 31.090 32.448 343 HA TYR 49 HA TYR 49 50.602 30.481 32.866 344 HB2 TYR 49 HB2 TYR 49 52.468 31.273 34.852 345 HB3 TYR 49 HB3 TYR 49 50.935 31.246 35.135 346 HD1 TYR 49 HD1 TYR 49 49.867 28.796 34.608 347 HD2 TYR 49 HD2 TYR 49 53.653 29.501 35.872 348 HE1 TYR 49 HE1 TYR 49 50.024 26.597 35.382 349 HE2 TYR 49 HE2 TYR 49 53.786 27.315 36.686 350 HH TYR 49 HH TYR 49 52.716 25.321 36.965 351 H ALA 50 H ALA 50 49.105 32.315 33.061 352 HA ALA 50 HA ALA 50 50.051 34.791 33.480 353 HB1 ALA 50 HB1 ALA 50 48.661 35.744 31.814 354 HB2 ALA 50 HB2 ALA 50 49.732 34.778 31.159 355 HB3 ALA 50 HB3 ALA 50 48.237 34.289 31.352 356 H LYS 51 H LYS 51 48.814 36.159 34.767 357 HA LYS 51 HA LYS 51 46.569 35.296 36.025 358 HB2 LYS 51 HB2 LYS 51 48.279 37.456 36.715 359 HB3 LYS 51 HB3 LYS 51 47.054 37.022 37.576 360 HG2 LYS 51 HG2 LYS 51 48.131 34.926 38.032 361 HG3 LYS 51 HG3 LYS 51 49.364 35.388 37.197 362 HD2 LYS 51 HD2 LYS 51 49.824 37.112 38.739 363 HD3 LYS 51 HD3 LYS 51 48.514 36.802 39.525 364 HE2 LYS 51 HE2 LYS 51 49.405 34.645 40.109 365 HE3 LYS 51 HE3 LYS 51 50.732 35.014 39.375 366 HZ1 LYS 51 HZ1 LYS 51 50.933 35.428 41.603 367 HZ2 LYS 51 HZ2 LYS 51 51.045 36.694 40.897 368 HZ3 LYS 51 HZ3 LYS 51 49.810 36.351 41.581 369 H VAL 52 H VAL 52 44.526 36.249 35.623 370 HA VAL 52 HA VAL 52 44.321 38.546 34.178 371 HB VAL 52 HB VAL 52 42.488 36.431 34.075 372 HG11 VAL 52 HG11 VAL 52 41.459 37.583 32.243 373 HG12 VAL 52 HG12 VAL 52 41.406 38.461 33.560 374 HG13 VAL 52 HG13 VAL 52 42.485 38.772 32.443 375 HG21 VAL 52 HG21 VAL 52 43.200 35.986 31.845 376 HG22 VAL 52 HG22 VAL 52 44.330 37.083 32.008 377 HG23 VAL 52 HG23 VAL 52 44.382 35.757 32.874 378 H TYR 53 H TYR 53 43.229 40.261 35.172 379 HA TYR 53 HA TYR 53 41.727 39.891 37.418 380 HB2 TYR 53 HB2 TYR 53 43.173 42.202 36.601 381 HB3 TYR 53 HB3 TYR 53 42.295 42.169 37.890 382 HD1 TYR 53 HD1 TYR 53 43.063 40.881 39.877 383 HD2 TYR 53 HD2 TYR 53 45.414 41.252 36.607 384 HE1 TYR 53 HE1 TYR 53 44.862 39.991 41.078 385 HE2 TYR 53 HE2 TYR 53 47.233 40.399 37.808 386 HH TYR 53 HH TYR 53 47.956 39.547 39.782 387 H VAL 54 H VAL 54 39.520 40.458 37.450 388 HA VAL 54 HA VAL 54 38.375 41.553 35.237 389 HB VAL 54 HB VAL 54 37.374 39.303 36.582 390 HG11 VAL 54 HG11 VAL 54 35.830 39.050 34.771 391 HG12 VAL 54 HG12 VAL 54 35.621 40.443 35.495 392 HG13 VAL 54 HG13 VAL 54 36.407 40.375 34.122 393 HG21 VAL 54 HG21 VAL 54 37.952 37.979 34.661 394 HG22 VAL 54 HG22 VAL 54 38.630 39.257 34.015 395 HG23 VAL 54 HG23 VAL 54 39.250 38.605 35.318 396 H THR 55 H THR 55 36.468 42.884 35.623 397 HA THR 55 HA THR 55 35.693 43.425 38.157 398 HB THR 55 HB THR 55 37.378 44.921 37.551 399 HG1 THR 55 HG1 THR 55 36.163 45.848 38.997 400 HG21 THR 55 HG21 THR 55 36.987 46.728 36.115 401 HG22 THR 55 HG22 THR 55 37.014 45.355 35.327 402 HG23 THR 55 HG23 THR 55 35.630 46.052 35.657 403 H PHE 56 H PHE 56 33.539 43.957 38.518 404 HA PHE 56 HA PHE 56 31.859 43.291 36.494 405 HB2 PHE 56 HB2 PHE 56 31.763 42.454 39.219 406 HB3 PHE 56 HB3 PHE 56 30.631 42.098 38.206 407 HD1 PHE 56 HD1 PHE 56 34.114 41.421 38.753 408 HD2 PHE 56 HD2 PHE 56 30.715 40.010 37.071 409 HE1 PHE 56 HE1 PHE 56 35.164 39.386 38.333 410 HE2 PHE 56 HE2 PHE 56 31.758 37.967 36.678 411 HZ PHE 56 HZ PHE 56 34.002 37.648 37.288 412 H LEU 57 H LEU 57 29.864 44.385 36.156 413 HA LEU 57 HA LEU 57 28.837 46.220 37.798 414 HB2 LEU 57 HB2 LEU 57 28.413 46.233 35.458 415 HB3 LEU 57 HB3 LEU 57 27.662 44.872 35.590 416 HG LEU 57 HG LEU 57 26.038 45.979 36.962 417 HD11 LEU 57 HD11 LEU 57 25.901 48.347 36.859 418 HD12 LEU 57 HD12 LEU 57 27.248 47.902 37.563 419 HD13 LEU 57 HD13 LEU 57 27.265 48.378 36.054 420 HD21 LEU 57 HD21 LEU 57 24.873 46.982 35.145 421 HD22 LEU 57 HD22 LEU 57 26.210 46.961 34.296 422 HD23 LEU 57 HD23 LEU 57 25.505 45.601 34.697 423 H ASN 58 H ASN 58 28.471 42.816 37.621 424 HA ASN 58 HA ASN 58 26.333 42.574 39.237 425 HB2 ASN 58 HB2 ASN 58 26.948 41.128 37.313 426 HB3 ASN 58 HB3 ASN 58 27.897 40.416 38.326 427 HD21 ASN 58 HD21 ASN 58 24.033 39.966 38.734 428 HD22 ASN 58 HD22 ASN 58 24.554 41.182 38.049 429 H ASP 59 H ASP 59 29.085 43.554 40.176 430 HA ASP 59 HA ASP 59 30.041 42.310 42.207 431 HB2 ASP 59 HB2 ASP 59 31.124 44.116 41.062 432 HB3 ASP 59 HB3 ASP 59 30.028 45.102 41.569 433 H LYS 60 H LYS 60 27.058 43.770 42.217 434 HA LYS 60 HA LYS 60 26.750 44.546 44.690 435 HB2 LYS 60 HB2 LYS 60 24.475 44.729 44.094 436 HB3 LYS 60 HB3 LYS 60 25.324 45.256 42.897 437 HG2 LYS 60 HG2 LYS 60 24.982 43.307 41.689 438 HG3 LYS 60 HG3 LYS 60 24.383 42.577 42.930 439 HD2 LYS 60 HD2 LYS 60 22.467 43.956 42.847 440 HD3 LYS 60 HD3 LYS 60 23.074 44.755 41.653 441 HE2 LYS 60 HE2 LYS 60 21.517 43.198 40.827 442 HE3 LYS 60 HE3 LYS 60 22.930 42.854 40.267 443 HZ1 LYS 60 HZ1 LYS 60 21.494 41.183 41.458 444 HZ2 LYS 60 HZ2 LYS 60 22.927 41.004 41.297 445 HZ3 LYS 60 HZ3 LYS 60 22.399 41.561 42.531 446 H ASP 61 H ASP 61 26.956 41.347 43.840 447 HA ASP 61 HA ASP 61 26.450 40.634 46.391 448 HB2 ASP 61 HB2 ASP 61 24.530 40.031 45.002 449 HB3 ASP 61 HB3 ASP 61 25.456 39.001 44.287 450 H GLU 62 H GLU 62 28.233 39.633 47.290 451 HA GLU 62 HA GLU 62 30.370 39.093 45.975 452 HB2 GLU 62 HB2 GLU 62 29.794 38.197 48.619 453 HB3 GLU 62 HB3 GLU 62 31.235 38.219 48.023 454 HG2 GLU 62 HG2 GLU 62 31.440 40.161 49.018 455 HG3 GLU 62 HG3 GLU 62 30.623 40.733 47.820 456 H ASP 63 H ASP 63 27.911 36.852 46.818 457 HA ASP 63 HA ASP 63 29.118 34.539 46.344 458 HB2 ASP 63 HB2 ASP 63 27.172 34.834 47.738 459 HB3 ASP 63 HB3 ASP 63 26.329 35.022 46.439 460 H ALA 64 H ALA 64 27.325 36.567 44.209 461 HA ALA 64 HA ALA 64 27.347 35.055 42.042 462 HB1 ALA 64 HB1 ALA 64 26.544 37.032 40.997 463 HB2 ALA 64 HB2 ALA 64 25.734 36.758 42.331 464 HB3 ALA 64 HB3 ALA 64 26.880 37.852 42.310 465 H VAL 65 H VAL 65 29.602 37.515 42.988 466 HA VAL 65 HA VAL 65 31.217 37.440 40.924 467 HB VAL 65 HB VAL 65 31.791 38.289 43.538 468 HG11 VAL 65 HG11 VAL 65 33.673 39.471 42.649 469 HG12 VAL 65 HG12 VAL 65 33.839 37.912 42.418 470 HG13 VAL 65 HG13 VAL 65 33.371 38.844 41.226 471 HG21 VAL 65 HG21 VAL 65 31.515 40.515 42.703 472 HG22 VAL 65 HG22 VAL 65 31.142 39.916 41.285 473 HG23 VAL 65 HG23 VAL 65 30.178 39.687 42.521 474 H LYS 66 H LYS 66 31.443 35.666 43.907 475 HA LYS 66 HA LYS 66 33.595 34.229 43.583 476 HB2 LYS 66 HB2 LYS 66 32.335 34.552 45.633 477 HB3 LYS 66 HB3 LYS 66 31.318 33.495 45.103 478 HG2 LYS 66 HG2 LYS 66 32.596 32.243 46.445 479 HG3 LYS 66 HG3 LYS 66 33.226 31.937 45.051 480 HD2 LYS 66 HD2 LYS 66 35.023 33.363 45.468 481 HD3 LYS 66 HD3 LYS 66 34.340 33.931 46.749 482 HE2 LYS 66 HE2 LYS 66 34.463 31.697 47.709 483 HE3 LYS 66 HE3 LYS 66 35.322 31.271 46.479 484 HZ1 LYS 66 HZ1 LYS 66 36.669 31.816 48.220 485 HZ2 LYS 66 HZ2 LYS 66 36.918 32.761 47.145 486 HZ3 LYS 66 HZ3 LYS 66 36.118 33.158 48.291 487 H ALA 67 H ALA 67 30.375 33.300 42.760 488 HA ALA 67 HA ALA 67 30.780 31.029 41.559 489 HB1 ALA 67 HB1 ALA 67 28.566 31.367 40.735 490 HB2 ALA 67 HB2 ALA 67 28.622 31.715 42.278 491 HB3 ALA 67 HB3 ALA 67 28.632 32.878 41.204 492 H GLY 68 H GLY 68 30.860 34.191 40.118 493 HA2 GLY 68 HA2 GLY 68 30.978 33.605 37.592 494 HA3 GLY 68 HA3 GLY 68 31.413 34.964 38.222 495 H ILE 69 H ILE 69 33.690 34.381 39.692 496 HA ILE 69 HA ILE 69 35.655 33.891 38.033 497 HB ILE 69 HB ILE 69 35.746 33.909 40.829 498 HG12 ILE 69 HG12 ILE 69 35.188 36.033 40.035 499 HG13 ILE 69 HG13 ILE 69 36.560 36.072 40.778 500 HG21 ILE 69 HG21 ILE 69 38.126 34.140 40.640 501 HG22 ILE 69 HG22 ILE 69 37.648 32.759 40.028 502 HG23 ILE 69 HG23 ILE 69 37.997 33.971 39.070 503 HD11 ILE 69 HD11 ILE 69 36.682 37.393 38.842 504 HD12 ILE 69 HD12 ILE 69 37.694 36.183 38.701 505 HD13 ILE 69 HD13 ILE 69 36.302 36.143 37.948 506 H LYS 70 H LYS 70 34.073 31.631 40.165 507 HA LYS 70 HA LYS 70 35.479 29.464 39.711 508 HB2 LYS 70 HB2 LYS 70 33.998 29.765 41.570 509 HB3 LYS 70 HB3 LYS 70 32.784 29.675 40.595 510 HG2 LYS 70 HG2 LYS 70 33.387 27.394 40.116 511 HG3 LYS 70 HG3 LYS 70 34.519 27.498 41.182 512 HD2 LYS 70 HD2 LYS 70 33.011 27.707 42.913 513 HD3 LYS 70 HD3 LYS 70 31.835 28.020 41.938 514 HE2 LYS 70 HE2 LYS 70 31.445 25.871 42.545 515 HE3 LYS 70 HE3 LYS 70 32.056 25.733 41.117 516 HZ1 LYS 70 HZ1 LYS 70 33.046 24.268 42.532 517 HZ2 LYS 70 HZ2 LYS 70 34.058 25.208 42.082 518 HZ3 LYS 70 HZ3 LYS 70 33.489 25.335 43.413 519 H ALA 71 H ALA 71 32.654 30.470 37.973 520 HA ALA 71 HA ALA 71 32.474 28.464 36.267 521 HB1 ALA 71 HB1 ALA 71 30.904 29.893 35.201 522 HB2 ALA 71 HB2 ALA 71 30.632 29.872 36.761 523 HB3 ALA 71 HB3 ALA 71 31.392 31.097 36.106 524 H LEU 72 H LEU 72 34.168 31.415 35.954 525 HA LEU 72 HA LEU 72 35.137 31.238 33.491 526 HB2 LEU 72 HB2 LEU 72 34.815 33.277 34.624 527 HB3 LEU 72 HB3 LEU 72 35.843 32.846 35.715 528 HG LEU 72 HG LEU 72 37.579 33.030 34.205 529 HD11 LEU 72 HD11 LEU 72 37.279 33.925 32.054 530 HD12 LEU 72 HD12 LEU 72 36.523 32.540 32.191 531 HD13 LEU 72 HD13 LEU 72 35.710 33.898 32.271 532 HD21 LEU 72 HD21 LEU 72 37.519 35.415 33.940 533 HD22 LEU 72 HD22 LEU 72 35.963 35.390 34.235 534 HD23 LEU 72 HD23 LEU 72 36.993 35.016 35.379 535 H GLN 73 H GLN 73 36.590 30.232 36.486 536 HA GLN 73 HA GLN 73 38.892 29.386 35.500 537 HB2 GLN 73 HB2 GLN 73 38.426 30.021 37.825 538 HB3 GLN 73 HB3 GLN 73 37.832 28.590 37.994 539 HG2 GLN 73 HG2 GLN 73 40.015 28.448 38.736 540 HG3 GLN 73 HG3 GLN 73 39.984 27.677 37.382 541 HE21 GLN 73 HE21 GLN 73 41.463 28.316 35.809 542 HE22 GLN 73 HE22 GLN 73 42.238 29.588 35.813 543 H GLU 74 H GLU 74 35.995 27.539 36.128 544 HA GLU 74 HA GLU 74 36.772 25.200 35.364 545 HB2 GLU 74 HB2 GLU 74 34.185 26.358 35.437 546 HB3 GLU 74 HB3 GLU 74 34.340 24.919 34.856 547 HG2 GLU 74 HG2 GLU 74 35.125 24.129 36.936 548 HG3 GLU 74 HG3 GLU 74 35.077 25.573 37.525 549 H ALA 75 H ALA 75 35.874 27.805 33.329 550 HA ALA 75 HA ALA 75 35.956 26.496 30.986 551 HB1 ALA 75 HB1 ALA 75 35.320 28.647 30.131 552 HB2 ALA 75 HB2 ALA 75 34.346 28.227 31.308 553 HB3 ALA 75 HB3 ALA 75 35.513 29.263 31.577 554 H SER 76 H SER 76 38.496 27.531 32.722 555 HA SER 76 HA SER 76 39.754 29.205 31.278 556 HB2 SER 76 HB2 SER 76 41.662 28.746 32.658 557 HB3 SER 76 HB3 SER 76 40.379 28.980 33.512 558 HG SER 76 HG SER 76 40.294 26.932 33.957 559 H GLY 77 H GLY 77 40.258 25.771 30.984 560 HA2 GLY 77 HA2 GLY 77 42.333 25.764 29.387 561 HA3 GLY 77 HA3 GLY 77 41.372 24.558 29.618 562 H PHE 78 H PHE 78 38.961 25.817 28.557 563 HA PHE 78 HA PHE 78 39.184 25.628 25.924 564 HB2 PHE 78 HB2 PHE 78 36.931 26.527 27.395 565 HB3 PHE 78 HB3 PHE 78 36.888 26.081 25.902 566 HD1 PHE 78 HD1 PHE 78 36.633 24.913 29.140 567 HD2 PHE 78 HD2 PHE 78 37.303 23.625 25.367 568 HE1 PHE 78 HE1 PHE 78 36.263 22.704 29.827 569 HE2 PHE 78 HE2 PHE 78 36.934 21.419 26.043 570 HZ PHE 78 HZ PHE 78 36.426 20.961 28.283 571 H ILE 79 H ILE 79 38.848 28.401 27.984 572 HA ILE 79 HA ILE 79 38.879 30.354 26.241 573 HB ILE 79 HB ILE 79 39.547 30.370 28.983 574 HG12 ILE 79 HG12 ILE 79 37.161 31.310 27.719 575 HG13 ILE 79 HG13 ILE 79 37.239 29.902 28.384 576 HG21 ILE 79 HG21 ILE 79 39.447 32.705 28.982 577 HG22 ILE 79 HG22 ILE 79 40.630 32.203 28.055 578 HG23 ILE 79 HG23 ILE 79 39.271 32.698 27.407 579 HD11 ILE 79 HD11 ILE 79 36.162 31.388 29.832 580 HD12 ILE 79 HD12 ILE 79 37.513 30.903 30.502 581 HD13 ILE 79 HD13 ILE 79 37.433 32.333 29.826 582 H ARG 80 H ARG 80 41.620 28.877 27.787 583 HA ARG 80 HA ARG 80 43.633 30.170 26.677 584 HB2 ARG 80 HB2 ARG 80 43.796 28.906 28.676 585 HB3 ARG 80 HB3 ARG 80 43.525 27.597 27.873 586 HG2 ARG 80 HG2 ARG 80 45.782 28.930 26.987 587 HG3 ARG 80 HG3 ARG 80 45.910 28.451 28.465 588 HD2 ARG 80 HD2 ARG 80 45.279 26.664 26.358 589 HD3 ARG 80 HD3 ARG 80 46.740 26.856 26.870 590 HE ARG 80 HE ARG 80 45.866 26.046 28.973 591 HH11 ARG 80 HH11 ARG 80 45.017 24.295 29.880 592 HH12 ARG 80 HH12 ARG 80 44.382 23.228 29.058 593 HH21 ARG 80 HH21 ARG 80 44.672 24.690 26.185 594 HH22 ARG 80 HH22 ARG 80 44.178 23.459 26.862 595 H SER 81 H SER 81 42.074 27.316 25.511 596 HA SER 81 HA SER 81 43.548 26.946 23.373 597 HB2 SER 81 HB2 SER 81 40.958 25.908 23.972 598 HB3 SER 81 HB3 SER 81 41.819 25.376 22.785 599 HG SER 81 HG SER 81 42.317 25.039 25.350 600 H LEU 82 H LEU 82 40.575 28.708 23.634 601 HA LEU 82 HA LEU 82 40.240 29.410 21.126 602 HB2 LEU 82 HB2 LEU 82 39.200 30.477 23.539 603 HB3 LEU 82 HB3 LEU 82 38.824 31.127 22.172 604 HG LEU 82 HG LEU 82 38.215 28.422 22.684 605 HD11 LEU 82 HD11 LEU 82 36.010 29.124 23.292 606 HD12 LEU 82 HD12 LEU 82 37.066 29.740 24.299 607 HD13 LEU 82 HD13 LEU 82 36.461 30.634 23.140 608 HD21 LEU 82 HD21 LEU 82 36.621 28.647 20.962 609 HD22 LEU 82 HD22 LEU 82 37.049 30.159 20.767 610 HD23 LEU 82 HD23 LEU 82 38.066 28.996 20.415 611 H LEU 83 H LEU 83 42.002 31.004 23.616 612 HA LEU 83 HA LEU 83 42.754 33.236 22.408 613 HB2 LEU 83 HB2 LEU 83 42.590 32.971 24.770 614 HB3 LEU 83 HB3 LEU 83 43.757 31.938 24.730 615 HG LEU 83 HG LEU 83 45.236 33.673 24.075 616 HD11 LEU 83 HD11 LEU 83 44.560 35.910 24.243 617 HD12 LEU 83 HD12 LEU 83 43.730 35.168 23.116 618 HD13 LEU 83 HD13 LEU 83 43.076 35.437 24.534 619 HD21 LEU 83 HD21 LEU 83 45.349 34.681 26.226 620 HD22 LEU 83 HD22 LEU 83 43.889 34.155 26.539 621 HD23 LEU 83 HD23 LEU 83 45.083 33.127 26.372 622 H GLY 84 H GLY 84 44.465 30.222 22.654 623 HA2 GLY 84 HA2 GLY 84 46.644 30.801 21.357 624 HA3 GLY 84 HA3 GLY 84 46.066 29.364 21.541 625 H LYS 85 H LYS 85 43.673 29.473 20.085 626 HA LYS 85 HA LYS 85 44.194 29.330 17.518 627 HB2 LYS 85 HB2 LYS 85 42.433 28.151 18.574 628 HB3 LYS 85 HB3 LYS 85 41.707 29.498 18.877 629 HG2 LYS 85 HG2 LYS 85 40.546 28.659 17.134 630 HG3 LYS 85 HG3 LYS 85 41.427 29.764 16.476 631 HD2 LYS 85 HD2 LYS 85 42.812 28.220 15.480 632 HD3 LYS 85 HD3 LYS 85 42.338 27.072 16.425 633 HE2 LYS 85 HE2 LYS 85 40.127 27.247 15.416 634 HE3 LYS 85 HE3 LYS 85 40.723 28.259 14.388 635 HZ1 LYS 85 HZ1 LYS 85 40.679 26.177 13.499 636 HZ2 LYS 85 HZ2 LYS 85 42.067 26.592 13.608 637 HZ3 LYS 85 HZ3 LYS 85 41.511 25.649 14.566 638 H ALA 86 H ALA 86 42.746 32.008 19.175 639 HA ALA 86 HA ALA 86 42.110 33.453 17.083 640 HB1 ALA 86 HB1 ALA 86 41.609 35.118 18.704 641 HB2 ALA 86 HB2 ALA 86 40.988 33.727 19.137 642 HB3 ALA 86 HB3 ALA 86 42.328 34.239 19.809 643 H MET 87 H MET 87 45.036 33.493 18.879 644 HA MET 87 HA MET 87 46.062 35.592 17.474 645 HB2 MET 87 HB2 MET 87 47.184 34.238 19.691 646 HB3 MET 87 HB3 MET 87 47.932 35.392 18.955 647 HG2 MET 87 HG2 MET 87 46.130 36.855 19.554 648 HG3 MET 87 HG3 MET 87 45.533 35.697 20.413 649 HE1 MET 87 HE1 MET 87 46.893 38.377 22.833 650 HE2 MET 87 HE2 MET 87 46.389 38.653 21.357 651 HE3 MET 87 HE3 MET 87 45.557 37.702 22.312 652 H ARG 88 H ARG 88 45.885 32.348 16.998 653 HA ARG 88 HA ARG 88 46.930 30.847 15.811 654 HB2 ARG 88 HB2 ARG 88 47.869 33.043 14.331 655 HB3 ARG 88 HB3 ARG 88 47.871 31.567 13.827 656 HG2 ARG 88 HG2 ARG 88 45.529 31.556 13.763 657 HG3 ARG 88 HG3 ARG 88 45.488 33.000 14.353 658 HD2 ARG 88 HD2 ARG 88 46.525 33.822 12.391 659 HD3 ARG 88 HD3 ARG 88 46.543 32.378 11.801 660 HE ARG 88 HE ARG 88 44.041 32.975 12.314 661 HH11 ARG 88 HH11 ARG 88 42.572 33.614 10.716 662 HH12 ARG 88 HH12 ARG 88 43.069 34.156 9.421 663 HH21 ARG 88 HH21 ARG 88 46.287 33.926 10.098 664 HH22 ARG 88 HH22 ARG 88 45.318 34.345 9.047 665 H LEU 89 H LEU 89 48.247 31.333 18.255 666 HA LEU 89 HA LEU 89 50.953 31.403 17.692 667 HB2 LEU 89 HB2 LEU 89 49.981 33.165 19.085 668 HB3 LEU 89 HB3 LEU 89 49.836 32.075 20.190 669 HG LEU 89 HG LEU 89 52.111 31.861 20.382 670 HD11 LEU 89 HD11 LEU 89 53.611 33.080 19.054 671 HD12 LEU 89 HD12 LEU 89 52.738 32.110 18.158 672 HD13 LEU 89 HD13 LEU 89 52.394 33.655 18.220 673 HD21 LEU 89 HD21 LEU 89 52.710 33.996 21.151 674 HD22 LEU 89 HD22 LEU 89 51.454 34.609 20.406 675 HD23 LEU 89 HD23 LEU 89 51.247 33.626 21.630 676 H ARG 90 H ARG 90 52.200 29.548 18.201 677 HA ARG 90 HA ARG 90 51.101 27.248 18.841 678 HB2 ARG 90 HB2 ARG 90 53.864 27.810 19.057 679 HB3 ARG 90 HB3 ARG 90 53.247 26.389 18.873 680 HG2 ARG 90 HG2 ARG 90 52.645 26.889 16.675 681 HG3 ARG 90 HG3 ARG 90 53.121 28.364 16.850 682 HD2 ARG 90 HD2 ARG 90 55.349 27.610 17.102 683 HD3 ARG 90 HD3 ARG 90 54.870 26.138 16.920 684 HE ARG 90 HE ARG 90 55.092 27.946 14.902 685 HH11 ARG 90 HH11 ARG 90 55.085 27.183 12.774 686 HH12 ARG 90 HH12 ARG 90 54.735 25.764 12.491 687 HH21 ARG 90 HH21 ARG 90 54.213 24.848 15.612 688 HH22 ARG 90 HH22 ARG 90 54.207 24.350 14.208 689 H ILE 91 H ILE 91 52.741 29.538 20.902 690 HA ILE 91 HA ILE 91 52.326 28.020 23.159 691 HB ILE 91 HB ILE 91 53.896 29.593 24.146 692 HG12 ILE 91 HG12 ILE 91 54.563 30.113 21.460 693 HG13 ILE 91 HG13 ILE 91 53.925 31.162 22.423 694 HG21 ILE 91 HG21 ILE 91 55.733 28.287 23.488 695 HG22 ILE 91 HG22 ILE 91 54.485 27.369 23.817 696 HG23 ILE 91 HG23 ILE 91 54.867 27.676 22.311 697 HD11 ILE 91 HD11 ILE 91 56.208 31.560 22.238 698 HD12 ILE 91 HD12 ILE 91 55.869 31.158 23.733 699 HD13 ILE 91 HD13 ILE 91 56.517 30.095 22.755 700 H VAL 92 H VAL 92 50.678 28.619 24.620 701 HA VAL 92 HA VAL 92 49.835 31.236 24.752 702 HB VAL 92 HB VAL 92 48.242 30.444 23.474 703 HG11 VAL 92 HG11 VAL 92 47.029 28.469 23.838 704 HG12 VAL 92 HG12 VAL 92 48.567 28.170 23.609 705 HG13 VAL 92 HG13 VAL 92 47.965 28.143 25.074 706 HG21 VAL 92 HG21 VAL 92 46.277 30.581 24.745 707 HG22 VAL 92 HG22 VAL 92 47.143 30.452 26.065 708 HG23 VAL 92 HG23 VAL 92 47.302 31.724 25.136 709 HA PRO 93 HA PRO 93 50.650 30.284 28.953 710 HB2 PRO 93 HB2 PRO 93 49.396 32.581 29.909 711 HB3 PRO 93 HB3 PRO 93 50.910 32.240 30.046 712 HG2 PRO 93 HG2 PRO 93 50.184 34.115 28.417 713 HG3 PRO 93 HG3 PRO 93 51.443 33.261 28.076 714 HD2 PRO 93 HD2 PRO 93 48.826 32.890 27.037 715 HD3 PRO 93 HD3 PRO 93 50.160 32.779 26.237 716 H GLU 94 H GLU 94 49.689 29.260 30.774 717 HA GLU 94 HA GLU 94 47.083 28.637 30.709 718 HB2 GLU 94 HB2 GLU 94 48.739 27.017 31.258 719 HB3 GLU 94 HB3 GLU 94 49.088 27.825 32.545 720 HG2 GLU 94 HG2 GLU 94 47.741 25.994 33.116 721 HG3 GLU 94 HG3 GLU 94 46.992 27.314 33.476 722 H LEU 95 H LEU 95 45.389 29.291 32.152 723 HA LEU 95 HA LEU 95 45.834 31.851 32.940 724 HB2 LEU 95 HB2 LEU 95 43.416 30.809 31.845 725 HB3 LEU 95 HB3 LEU 95 43.659 32.321 32.143 726 HG LEU 95 HG LEU 95 44.983 30.892 30.098 727 HD11 LEU 95 HD11 LEU 95 43.678 32.182 28.583 728 HD12 LEU 95 HD12 LEU 95 42.735 31.320 29.521 729 HD13 LEU 95 HD13 LEU 95 42.948 32.863 29.813 730 HD21 LEU 95 HD21 LEU 95 45.860 32.951 29.347 731 HD22 LEU 95 HD22 LEU 95 45.193 33.678 30.586 732 HD23 LEU 95 HD23 LEU 95 46.365 32.638 30.814 733 H THR 96 H THR 96 45.498 32.460 35.066 734 HA THR 96 HA THR 96 43.590 31.247 36.585 735 HB THR 96 HB THR 96 45.962 32.325 37.589 736 HG1 THR 96 HG1 THR 96 46.349 30.174 38.111 737 HG21 THR 96 HG21 THR 96 45.319 31.477 39.705 738 HG22 THR 96 HG22 THR 96 44.268 32.548 39.198 739 HG23 THR 96 HG23 THR 96 43.943 31.002 39.083 740 H PHE 97 H PHE 97 41.989 32.571 37.540 741 HA PHE 97 HA PHE 97 41.898 35.159 36.754 742 HB2 PHE 97 HB2 PHE 97 39.748 33.300 36.968 743 HB3 PHE 97 HB3 PHE 97 39.507 34.805 36.641 744 HD1 PHE 97 HD1 PHE 97 40.047 35.693 34.405 745 HD2 PHE 97 HD2 PHE 97 40.580 31.762 35.220 746 HE1 PHE 97 HE1 PHE 97 40.271 35.247 32.119 747 HE2 PHE 97 HE2 PHE 97 40.829 31.328 32.951 748 HZ PHE 97 HZ PHE 97 40.677 33.064 31.393 749 H PHE 98 H PHE 98 41.044 36.816 38.017 750 HA PHE 98 HA PHE 98 40.697 36.515 40.670 751 HB2 PHE 98 HB2 PHE 98 42.547 38.338 39.513 752 HB3 PHE 98 HB3 PHE 98 42.202 38.332 41.034 753 HD1 PHE 98 HD1 PHE 98 43.266 36.756 42.548 754 HD2 PHE 98 HD2 PHE 98 44.036 36.567 38.571 755 HE1 PHE 98 HE1 PHE 98 45.049 35.309 42.955 756 HE2 PHE 98 HE2 PHE 98 45.788 35.081 38.981 757 HZ PHE 98 HZ PHE 98 46.302 34.454 41.181 758 H TYR 99 H TYR 99 39.323 38.219 41.658 759 HA TYR 99 HA TYR 99 37.996 39.881 40.012 760 HB2 TYR 99 HB2 TYR 99 36.399 40.111 41.530 761 HB3 TYR 99 HB3 TYR 99 36.802 38.610 41.665 762 HD1 TYR 99 HD1 TYR 99 37.047 41.726 43.298 763 HD2 TYR 99 HD2 TYR 99 37.619 37.758 43.778 764 HE1 TYR 99 HE1 TYR 99 37.589 42.090 45.539 765 HE2 TYR 99 HE2 TYR 99 38.119 38.096 46.042 766 HH TYR 99 HH TYR 99 38.456 39.630 47.698 767 H ASP 100 H ASP 100 38.224 42.135 39.877 768 HA ASP 100 HA ASP 100 39.812 43.568 41.622 769 HB2 ASP 100 HB2 ASP 100 40.770 43.325 39.465 770 HB3 ASP 100 HB3 ASP 100 39.487 43.947 38.832 Start of MODEL 16 1 HA PRO 8 HA PRO 8 55.715 43.730 25.248 2 HB2 PRO 8 HB2 PRO 8 54.607 41.650 26.249 3 HB3 PRO 8 HB3 PRO 8 56.140 41.569 25.973 4 HG2 PRO 8 HG2 PRO 8 54.924 42.165 28.489 5 HG3 PRO 8 HG3 PRO 8 56.084 41.149 28.255 6 HD2 PRO 8 HD2 PRO 8 56.650 43.540 29.037 7 HD3 PRO 8 HD3 PRO 8 57.655 42.783 28.114 8 H GLN 9 H GLN 9 54.792 46.059 26.474 9 HA GLN 9 HA GLN 9 52.392 45.926 27.493 10 HB2 GLN 9 HB2 GLN 9 53.875 47.770 27.860 11 HB3 GLN 9 HB3 GLN 9 53.693 48.205 26.373 12 HG2 GLN 9 HG2 GLN 9 51.467 48.780 26.742 13 HG3 GLN 9 HG3 GLN 9 51.493 48.151 28.170 14 HE21 GLN 9 HE21 GLN 9 50.667 50.760 28.060 15 HE22 GLN 9 HE22 GLN 9 51.685 51.687 28.630 16 H ARG 10 H ARG 10 53.132 46.438 24.105 17 HA ARG 10 HA ARG 10 50.607 46.763 23.375 18 HB2 ARG 10 HB2 ARG 10 52.926 46.484 21.790 19 HB3 ARG 10 HB3 ARG 10 51.521 46.531 21.114 20 HG2 ARG 10 HG2 ARG 10 51.168 48.667 22.266 21 HG3 ARG 10 HG3 ARG 10 52.682 48.633 22.634 22 HD2 ARG 10 HD2 ARG 10 51.852 48.619 19.924 23 HD3 ARG 10 HD3 ARG 10 52.121 49.962 20.668 24 HE ARG 10 HE ARG 10 54.074 48.180 19.969 25 HH11 ARG 10 HH11 ARG 10 56.123 48.973 19.527 26 HH12 ARG 10 HH12 ARG 10 56.510 50.329 20.006 27 HH21 ARG 10 HH21 ARG 10 53.701 51.198 21.293 28 HH22 ARG 10 HH22 ARG 10 55.105 51.622 21.032 29 H VAL 11 H VAL 11 52.453 43.838 23.393 30 HA VAL 11 HA VAL 11 50.653 42.166 22.517 31 HB VAL 11 HB VAL 11 52.892 41.761 24.123 32 HG11 VAL 11 HG11 VAL 11 52.668 39.410 24.002 33 HG12 VAL 11 HG12 VAL 11 51.478 40.049 24.827 34 HG13 VAL 11 HG13 VAL 11 51.247 39.594 23.328 35 HG21 VAL 11 HG21 VAL 11 53.702 40.570 22.169 36 HG22 VAL 11 HG22 VAL 11 52.318 40.854 21.455 37 HG23 VAL 11 HG23 VAL 11 53.302 42.051 21.780 38 H ALA 12 H ALA 12 51.157 43.156 25.851 39 HA ALA 12 HA ALA 12 49.248 41.817 26.999 40 HB1 ALA 12 HB1 ALA 12 49.612 43.325 28.794 41 HB2 ALA 12 HB2 ALA 12 51.000 42.809 28.233 42 HB3 ALA 12 HB3 ALA 12 50.472 44.249 27.837 43 H GLN 13 H GLN 13 48.948 44.983 25.553 44 HA GLN 13 HA GLN 13 46.449 45.439 26.173 45 HB2 GLN 13 HB2 GLN 13 48.193 46.623 24.268 46 HB3 GLN 13 HB3 GLN 13 46.701 47.076 24.295 47 HG2 GLN 13 HG2 GLN 13 48.458 47.364 26.517 48 HG3 GLN 13 HG3 GLN 13 48.066 48.547 25.580 49 HE21 GLN 13 HE21 GLN 13 47.469 47.941 28.475 50 HE22 GLN 13 HE22 GLN 13 46.011 48.195 28.641 51 H GLU 14 H GLU 14 47.666 43.962 23.259 52 HA GLU 14 HA GLU 14 45.430 43.469 22.020 53 HB2 GLU 14 HB2 GLU 14 47.939 42.167 21.830 54 HB3 GLU 14 HB3 GLU 14 46.740 41.722 20.938 55 HG2 GLU 14 HG2 GLU 14 46.670 43.851 19.925 56 HG3 GLU 14 HG3 GLU 14 47.818 44.349 20.855 57 H MET 15 H MET 15 47.006 41.549 24.445 58 HA MET 15 HA MET 15 45.420 39.466 24.468 59 HB2 MET 15 HB2 MET 15 47.733 39.432 25.192 60 HB3 MET 15 HB3 MET 15 47.304 40.211 26.474 61 HG2 MET 15 HG2 MET 15 45.944 38.391 27.133 62 HG3 MET 15 HG3 MET 15 46.359 37.612 25.847 63 HE1 MET 15 HE1 MET 15 49.967 36.595 26.416 64 HE2 MET 15 HE2 MET 15 48.717 36.402 25.463 65 HE3 MET 15 HE3 MET 15 49.427 37.814 25.561 66 H GLN 16 H GLN 16 45.306 42.197 26.671 67 HA GLN 16 HA GLN 16 43.453 41.475 28.274 68 HB2 GLN 16 HB2 GLN 16 44.031 44.091 27.360 69 HB3 GLN 16 HB3 GLN 16 42.906 43.861 28.415 70 HG2 GLN 16 HG2 GLN 16 44.586 43.015 29.929 71 HG3 GLN 16 HG3 GLN 16 45.672 43.431 28.888 72 HE21 GLN 16 HE21 GLN 16 46.627 45.007 30.409 73 HE22 GLN 16 HE22 GLN 16 45.933 46.272 30.780 74 H LYS 17 H LYS 17 42.976 43.081 25.209 75 HA LYS 17 HA LYS 17 40.347 43.216 25.164 76 HB2 LYS 17 HB2 LYS 17 42.039 44.594 23.933 77 HB3 LYS 17 HB3 LYS 17 41.958 43.474 22.851 78 HG2 LYS 17 HG2 LYS 17 40.498 45.064 22.111 79 HG3 LYS 17 HG3 LYS 17 39.574 43.945 22.680 80 HD2 LYS 17 HD2 LYS 17 39.301 45.171 24.697 81 HD3 LYS 17 HD3 LYS 17 40.264 46.277 24.167 82 HE2 LYS 17 HE2 LYS 17 38.711 46.761 22.408 83 HE3 LYS 17 HE3 LYS 17 37.740 45.686 22.985 84 HZ1 LYS 17 HZ1 LYS 17 37.145 47.756 23.732 85 HZ2 LYS 17 HZ2 LYS 17 37.542 46.960 24.883 86 HZ3 LYS 17 HZ3 LYS 17 38.446 47.962 24.345 87 H GLU 18 H GLU 18 42.371 40.823 23.708 88 HA GLU 18 HA GLU 18 40.553 39.508 22.323 89 HB2 GLU 18 HB2 GLU 18 43.075 39.501 22.154 90 HB3 GLU 18 HB3 GLU 18 42.967 38.299 23.142 91 HG2 GLU 18 HG2 GLU 18 43.078 37.306 21.106 92 HG3 GLU 18 HG3 GLU 18 41.568 37.196 21.482 93 H ILE 19 H ILE 19 41.801 38.869 25.505 94 HA ILE 19 HA ILE 19 40.399 36.730 26.153 95 HB ILE 19 HB ILE 19 41.771 38.544 27.807 96 HG12 ILE 19 HG12 ILE 19 42.500 35.895 27.031 97 HG13 ILE 19 HG13 ILE 19 43.154 37.171 26.419 98 HG21 ILE 19 HG21 ILE 19 41.526 37.032 29.599 99 HG22 ILE 19 HG22 ILE 19 40.110 37.564 29.131 100 HG23 ILE 19 HG23 ILE 19 40.596 36.121 28.696 101 HD11 ILE 19 HD11 ILE 19 44.610 36.229 27.999 102 HD12 ILE 19 HD12 ILE 19 44.166 37.665 28.500 103 HD13 ILE 19 HD13 ILE 19 43.501 36.368 29.121 104 H ALA 20 H ALA 20 39.674 40.102 26.746 105 HA ALA 20 HA ALA 20 37.456 39.876 28.039 106 HB1 ALA 20 HB1 ALA 20 37.143 42.165 27.481 107 HB2 ALA 20 HB2 ALA 20 38.626 41.919 27.979 108 HB3 ALA 20 HB3 ALA 20 38.323 42.059 26.430 109 H LEU 21 H LEU 21 37.773 39.793 24.571 110 HA LEU 21 HA LEU 21 35.214 39.774 23.965 111 HB2 LEU 21 HB2 LEU 21 36.873 40.294 22.363 112 HB3 LEU 21 HB3 LEU 21 37.375 38.818 22.403 113 HG LEU 21 HG LEU 21 35.346 38.090 21.507 114 HD11 LEU 21 HD11 LEU 21 33.768 39.591 20.615 115 HD12 LEU 21 HD12 LEU 21 33.873 39.752 22.188 116 HD13 LEU 21 HD13 LEU 21 34.584 40.798 21.235 117 HD21 LEU 21 HD21 LEU 21 35.667 38.955 19.282 118 HD22 LEU 21 HD22 LEU 21 36.571 40.108 19.885 119 HD23 LEU 21 HD23 LEU 21 37.064 38.604 19.940 120 H ILE 22 H ILE 22 37.321 37.042 24.467 121 HA ILE 22 HA ILE 22 35.630 35.074 24.053 122 HB ILE 22 HB ILE 22 38.064 35.014 25.475 123 HG12 ILE 22 HG12 ILE 22 37.748 34.054 22.830 124 HG13 ILE 22 HG13 ILE 22 38.157 35.539 23.078 125 HG21 ILE 22 HG21 ILE 22 37.990 32.650 25.218 126 HG22 ILE 22 HG22 ILE 22 36.746 33.143 26.065 127 HG23 ILE 22 HG23 ILE 22 36.566 32.778 24.535 128 HD11 ILE 22 HD11 ILE 22 40.078 34.263 22.644 129 HD12 ILE 22 HD12 ILE 22 40.157 34.826 24.121 130 HD13 ILE 22 HD13 ILE 22 39.742 33.319 23.870 131 H LEU 23 H LEU 23 36.275 36.688 27.052 132 HA LEU 23 HA LEU 23 34.784 35.365 28.681 133 HB2 LEU 23 HB2 LEU 23 36.085 37.818 28.798 134 HB3 LEU 23 HB3 LEU 23 34.814 37.792 29.700 135 HG LEU 23 HG LEU 23 35.684 35.923 30.854 136 HD11 LEU 23 HD11 LEU 23 37.943 35.291 30.590 137 HD12 LEU 23 HD12 LEU 23 37.133 35.029 29.256 138 HD13 LEU 23 HD13 LEU 23 38.073 36.297 29.375 139 HD21 LEU 23 HD21 LEU 23 37.351 37.112 32.090 140 HD22 LEU 23 HD22 LEU 23 37.428 38.182 30.924 141 HD23 LEU 23 HD23 LEU 23 36.111 38.053 31.793 142 H GLN 24 H GLN 24 33.624 37.757 26.501 143 HA GLN 24 HA GLN 24 31.102 37.712 27.419 144 HB2 GLN 24 HB2 GLN 24 32.155 39.710 26.459 145 HB3 GLN 24 HB3 GLN 24 31.943 39.047 25.063 146 HG2 GLN 24 HG2 GLN 24 29.604 39.067 25.362 147 HG3 GLN 24 HG3 GLN 24 29.766 39.602 26.818 148 HE21 GLN 24 HE21 GLN 24 30.130 41.920 27.107 149 HE22 GLN 24 HE22 GLN 24 30.016 42.885 25.978 150 H ARG 25 H ARG 25 32.696 35.782 25.081 151 HA ARG 25 HA ARG 25 30.308 35.144 23.933 152 HB2 ARG 25 HB2 ARG 25 32.431 35.791 22.657 153 HB3 ARG 25 HB3 ARG 25 32.697 34.256 22.726 154 HG2 ARG 25 HG2 ARG 25 31.671 34.787 20.688 155 HG3 ARG 25 HG3 ARG 25 30.749 33.827 21.501 156 HD2 ARG 25 HD2 ARG 25 29.483 35.687 22.248 157 HD3 ARG 25 HD3 ARG 25 30.396 36.637 21.414 158 HE ARG 25 HE ARG 25 29.317 34.930 19.740 159 HH11 ARG 25 HH11 ARG 25 27.559 35.451 18.416 160 HH12 ARG 25 HH12 ARG 25 26.674 36.597 18.768 161 HH21 ARG 25 HH21 ARG 25 28.253 37.491 21.520 162 HH22 ARG 25 HH22 ARG 25 27.095 37.832 20.648 163 H GLU 26 H GLU 26 32.903 33.262 25.327 164 HA GLU 26 HA GLU 26 31.752 30.916 24.691 165 HB2 GLU 26 HB2 GLU 26 34.102 31.129 24.606 166 HB3 GLU 26 HB3 GLU 26 34.142 31.411 26.139 167 HG2 GLU 26 HG2 GLU 26 34.852 29.244 25.794 168 HG3 GLU 26 HG3 GLU 26 33.507 29.190 26.581 169 H ILE 27 H ILE 27 31.719 32.751 27.511 170 HA ILE 27 HA ILE 27 30.075 31.060 28.870 171 HB ILE 27 HB ILE 27 30.818 32.038 30.862 172 HG12 ILE 27 HG12 ILE 27 32.869 33.270 29.371 173 HG13 ILE 27 HG13 ILE 27 31.701 34.042 30.057 174 HG21 ILE 27 HG21 ILE 27 32.811 30.762 30.995 175 HG22 ILE 27 HG22 ILE 27 31.677 29.940 30.256 176 HG23 ILE 27 HG23 ILE 27 32.824 30.637 29.416 177 HD11 ILE 27 HD11 ILE 27 33.633 34.205 31.388 178 HD12 ILE 27 HD12 ILE 27 32.522 33.412 32.190 179 HD13 ILE 27 HD13 ILE 27 33.707 32.627 31.493 180 H LYS 28 H LYS 28 28.196 32.066 29.979 181 HA LYS 28 HA LYS 28 26.997 33.881 28.383 182 HB2 LYS 28 HB2 LYS 28 25.815 32.401 30.481 183 HB3 LYS 28 HB3 LYS 28 25.023 33.228 29.423 184 HG2 LYS 28 HG2 LYS 28 25.966 31.740 27.723 185 HG3 LYS 28 HG3 LYS 28 26.469 30.840 28.893 186 HD2 LYS 28 HD2 LYS 28 24.208 30.454 29.567 187 HD3 LYS 28 HD3 LYS 28 23.705 31.356 28.398 188 HE2 LYS 28 HE2 LYS 28 24.965 29.801 26.917 189 HE3 LYS 28 HE3 LYS 28 24.966 28.831 28.139 190 HZ1 LYS 28 HZ1 LYS 28 23.204 28.375 26.782 191 HZ2 LYS 28 HZ2 LYS 28 22.681 28.820 28.063 192 HZ3 LYS 28 HZ3 LYS 28 22.681 29.723 26.925 193 H ASP 29 H ASP 29 27.854 35.964 28.806 194 HA ASP 29 HA ASP 29 28.166 36.921 31.245 195 HB2 ASP 29 HB2 ASP 29 29.415 37.575 29.193 196 HB3 ASP 29 HB3 ASP 29 28.270 38.615 29.002 197 HA PRO 30 HA PRO 30 24.064 39.175 30.635 198 HB2 PRO 30 HB2 PRO 30 22.566 36.915 29.719 199 HB3 PRO 30 HB3 PRO 30 22.232 38.409 29.423 200 HG2 PRO 30 HG2 PRO 30 23.397 37.135 27.570 201 HG3 PRO 30 HG3 PRO 30 23.903 38.586 27.834 202 HD2 PRO 30 HD2 PRO 30 25.130 36.185 28.728 203 HD3 PRO 30 HD3 PRO 30 25.864 37.445 28.174 204 H ARG 31 H ARG 31 24.383 36.033 31.957 205 HA ARG 31 HA ARG 31 22.842 36.270 34.096 206 HB2 ARG 31 HB2 ARG 31 23.591 34.196 33.256 207 HB3 ARG 31 HB3 ARG 31 25.057 34.571 33.632 208 HG2 ARG 31 HG2 ARG 31 24.696 34.256 35.845 209 HG3 ARG 31 HG3 ARG 31 23.148 34.372 35.693 210 HD2 ARG 31 HD2 ARG 31 23.866 32.103 36.061 211 HD3 ARG 31 HD3 ARG 31 22.987 32.248 34.780 212 HE ARG 31 HE ARG 31 25.661 32.365 34.316 213 HH11 ARG 31 HH11 ARG 31 26.572 31.044 32.808 214 HH12 ARG 31 HH12 ARG 31 25.920 29.754 32.450 215 HH21 ARG 31 HH21 ARG 31 23.271 30.094 34.259 216 HH22 ARG 31 HH22 ARG 31 23.978 29.196 33.305 217 H LEU 32 H LEU 32 25.936 37.499 33.622 218 HA LEU 32 HA LEU 32 26.211 38.679 36.036 219 HB2 LEU 32 HB2 LEU 32 28.144 38.331 33.985 220 HB3 LEU 32 HB3 LEU 32 28.459 39.027 35.344 221 HG LEU 32 HG LEU 32 27.746 36.295 35.208 222 HD11 LEU 32 HD11 LEU 32 30.068 35.818 35.437 223 HD12 LEU 32 HD12 LEU 32 29.813 36.629 34.101 224 HD13 LEU 32 HD13 LEU 32 30.379 37.370 35.381 225 HD21 LEU 32 HD21 LEU 32 28.604 36.095 37.388 226 HD22 LEU 32 HD22 LEU 32 28.919 37.647 37.404 227 HD23 LEU 32 HD23 LEU 32 27.417 37.143 37.359 228 H GLY 33 H GLY 33 24.493 39.688 33.665 229 HA2 GLY 33 HA2 GLY 33 23.577 41.626 33.379 230 HA3 GLY 33 HA3 GLY 33 24.780 42.311 34.097 231 H MET 34 H MET 34 25.933 40.412 31.646 232 HA MET 34 HA MET 34 27.124 40.711 29.951 233 HB2 MET 34 HB2 MET 34 24.853 40.851 29.065 234 HB3 MET 34 HB3 MET 34 25.165 42.362 28.835 235 HG2 MET 34 HG2 MET 34 26.923 41.837 27.385 236 HG3 MET 34 HG3 MET 34 26.793 40.319 27.714 237 HE1 MET 34 HE1 MET 34 25.909 40.280 24.076 238 HE2 MET 34 HE2 MET 34 27.025 41.137 24.803 239 HE3 MET 34 HE3 MET 34 26.813 39.618 25.196 240 H MET 35 H MET 35 28.054 42.395 32.020 241 HA MET 35 HA MET 35 29.571 44.160 30.672 242 HB2 MET 35 HB2 MET 35 27.541 45.315 31.400 243 HB3 MET 35 HB3 MET 35 28.135 45.226 32.839 244 HG2 MET 35 HG2 MET 35 29.976 46.512 32.212 245 HG3 MET 35 HG3 MET 35 29.514 46.505 30.722 246 HE1 MET 35 HE1 MET 35 26.654 48.909 30.489 247 HE2 MET 35 HE2 MET 35 27.723 48.090 29.654 248 HE3 MET 35 HE3 MET 35 26.624 47.325 30.499 249 H THR 36 H THR 36 30.393 41.749 31.819 250 HA THR 36 HA THR 36 32.180 42.362 33.718 251 HB THR 36 HB THR 36 32.183 40.006 32.228 252 HG1 THR 36 HG1 THR 36 30.452 39.452 33.190 253 HG21 THR 36 HG21 THR 36 33.138 38.988 34.152 254 HG22 THR 36 HG22 THR 36 34.040 40.187 33.646 255 HG23 THR 36 HG23 THR 36 33.087 40.385 34.896 256 H THR 37 H THR 37 34.487 42.751 33.333 257 HA THR 37 HA THR 37 35.429 43.043 30.816 258 HB THR 37 HB THR 37 35.422 45.183 32.636 259 HG1 THR 37 HG1 THR 37 33.995 46.111 31.145 260 HG21 THR 37 HG21 THR 37 36.192 46.611 30.909 261 HG22 THR 37 HG22 THR 37 37.244 45.464 31.207 262 HG23 THR 37 HG23 THR 37 36.294 45.359 29.945 263 H VAL 38 H VAL 38 37.800 42.975 30.606 264 HA VAL 38 HA VAL 38 39.240 42.126 32.712 265 HB VAL 38 HB VAL 38 40.015 42.317 30.036 266 HG11 VAL 38 HG11 VAL 38 41.957 41.051 30.556 267 HG12 VAL 38 HG12 VAL 38 41.965 42.441 31.316 268 HG13 VAL 38 HG13 VAL 38 41.567 41.118 32.089 269 HG21 VAL 38 HG21 VAL 38 39.918 39.913 30.015 270 HG22 VAL 38 HG22 VAL 38 39.406 39.945 31.513 271 HG23 VAL 38 HG23 VAL 38 38.497 40.526 30.353 272 H SER 39 H SER 39 40.325 43.635 34.017 273 HA SER 39 HA SER 39 40.879 46.111 33.183 274 HB2 SER 39 HB2 SER 39 41.311 46.584 35.483 275 HB3 SER 39 HB3 SER 39 39.865 46.042 35.264 276 HG SER 39 HG SER 39 40.991 45.040 36.918 277 H GLY 40 H GLY 40 42.829 43.374 33.661 278 HA2 GLY 40 HA2 GLY 40 44.998 44.448 32.635 279 HA3 GLY 40 HA3 GLY 40 45.162 44.325 34.181 280 H VAL 41 H VAL 41 46.768 42.883 32.223 281 HA VAL 41 HA VAL 41 46.592 40.432 33.323 282 HB VAL 41 HB VAL 41 47.480 39.423 31.463 283 HG11 VAL 41 HG11 VAL 41 45.524 39.467 30.070 284 HG12 VAL 41 HG12 VAL 41 45.134 39.364 31.600 285 HG13 VAL 41 HG13 VAL 41 45.035 40.755 30.851 286 HG21 VAL 41 HG21 VAL 41 47.566 40.450 29.341 287 HG22 VAL 41 HG22 VAL 41 47.235 41.839 30.024 288 HG23 VAL 41 HG23 VAL 41 48.598 41.102 30.349 289 H GLU 42 H GLU 42 48.612 39.373 33.950 290 HA GLU 42 HA GLU 42 50.980 40.515 33.358 291 HB2 GLU 42 HB2 GLU 42 50.422 41.143 35.618 292 HB3 GLU 42 HB3 GLU 42 50.452 39.633 36.008 293 HG2 GLU 42 HG2 GLU 42 52.783 39.563 35.336 294 HG3 GLU 42 HG3 GLU 42 52.726 41.105 35.110 295 H MET 43 H MET 43 52.578 39.029 32.696 296 HA MET 43 HA MET 43 51.991 36.399 32.578 297 HB2 MET 43 HB2 MET 43 53.851 37.816 30.992 298 HB3 MET 43 HB3 MET 43 53.573 36.290 30.835 299 HG2 MET 43 HG2 MET 43 52.350 37.149 29.178 300 HG3 MET 43 HG3 MET 43 51.276 36.902 30.282 301 HE1 MET 43 HE1 MET 43 52.739 40.791 28.790 302 HE2 MET 43 HE2 MET 43 53.713 39.733 29.454 303 HE3 MET 43 HE3 MET 43 52.961 39.380 28.105 304 H SER 44 H SER 44 53.373 34.734 33.422 305 HA SER 44 HA SER 44 55.366 35.174 35.108 306 HB2 SER 44 HB2 SER 44 54.150 33.169 35.194 307 HB3 SER 44 HB3 SER 44 54.609 32.800 33.749 308 HG SER 44 HG SER 44 56.308 32.025 34.535 309 H ARG 45 H ARG 45 57.727 34.970 34.720 310 HA ARG 45 HA ARG 45 58.758 36.015 32.599 311 HB2 ARG 45 HB2 ARG 45 59.851 35.926 34.740 312 HB3 ARG 45 HB3 ARG 45 60.060 34.391 34.565 313 HG2 ARG 45 HG2 ARG 45 61.588 34.738 32.827 314 HG3 ARG 45 HG3 ARG 45 61.284 36.268 32.814 315 HD2 ARG 45 HD2 ARG 45 63.304 36.001 33.877 316 HD3 ARG 45 HD3 ARG 45 62.283 36.462 34.962 317 HE ARG 45 HE ARG 45 63.026 33.813 34.743 318 HH11 ARG 45 HH11 ARG 45 63.480 32.670 36.581 319 HH12 ARG 45 HH12 ARG 45 63.245 33.274 37.923 320 HH21 ARG 45 HH21 ARG 45 62.255 36.169 36.939 321 HH22 ARG 45 HH22 ARG 45 62.529 35.318 38.131 322 H ASP 46 H ASP 46 58.275 32.681 33.065 323 HA ASP 46 HA ASP 46 59.538 31.831 30.888 324 HB2 ASP 46 HB2 ASP 46 58.904 29.661 31.723 325 HB3 ASP 46 HB3 ASP 46 59.704 30.470 32.790 326 H LEU 47 H LEU 47 56.628 33.141 30.958 327 HA LEU 47 HA LEU 47 54.754 33.040 30.075 328 HB2 LEU 47 HB2 LEU 47 56.100 32.029 27.797 329 HB3 LEU 47 HB3 LEU 47 54.709 32.733 27.755 330 HG LEU 47 HG LEU 47 57.115 34.067 28.420 331 HD11 LEU 47 HD11 LEU 47 56.883 35.136 26.288 332 HD12 LEU 47 HD12 LEU 47 56.995 33.569 26.096 333 HD13 LEU 47 HD13 LEU 47 55.580 34.277 26.017 334 HD21 LEU 47 HD21 LEU 47 55.923 36.092 28.325 335 HD22 LEU 47 HD22 LEU 47 54.583 35.286 28.069 336 HD23 LEU 47 HD23 LEU 47 55.332 35.159 29.459 337 H ALA 48 H ALA 48 55.451 30.469 31.517 338 HA ALA 48 HA ALA 48 53.870 28.592 30.492 339 HB1 ALA 48 HB1 ALA 48 54.467 27.412 32.468 340 HB2 ALA 48 HB2 ALA 48 55.770 27.985 31.772 341 HB3 ALA 48 HB3 ALA 48 55.157 28.721 33.034 342 H TYR 49 H TYR 49 53.270 31.116 32.696 343 HA TYR 49 HA TYR 49 50.672 30.496 33.095 344 HB2 TYR 49 HB2 TYR 49 52.472 31.147 35.203 345 HB3 TYR 49 HB3 TYR 49 50.932 31.032 35.418 346 HD1 TYR 49 HD1 TYR 49 49.851 28.758 34.967 347 HD2 TYR 49 HD2 TYR 49 53.835 29.187 35.547 348 HE1 TYR 49 HE1 TYR 49 50.039 26.461 35.308 349 HE2 TYR 49 HE2 TYR 49 54.040 26.879 35.890 350 HH TYR 49 HH TYR 49 52.941 24.870 35.965 351 H ALA 50 H ALA 50 49.211 32.307 33.343 352 HA ALA 50 HA ALA 50 50.155 34.820 33.544 353 HB1 ALA 50 HB1 ALA 50 48.766 35.591 31.800 354 HB2 ALA 50 HB2 ALA 50 49.835 34.564 31.242 355 HB3 ALA 50 HB3 ALA 50 48.341 34.098 31.489 356 H LYS 51 H LYS 51 48.921 36.285 34.689 357 HA LYS 51 HA LYS 51 46.750 35.536 36.147 358 HB2 LYS 51 HB2 LYS 51 48.644 37.587 36.672 359 HB3 LYS 51 HB3 LYS 51 47.442 37.265 37.612 360 HG2 LYS 51 HG2 LYS 51 48.373 35.170 38.153 361 HG3 LYS 51 HG3 LYS 51 49.525 35.386 37.124 362 HD2 LYS 51 HD2 LYS 51 49.263 37.018 39.441 363 HD3 LYS 51 HD3 LYS 51 50.201 35.773 39.414 364 HE2 LYS 51 HE2 LYS 51 51.381 36.854 37.551 365 HE3 LYS 51 HE3 LYS 51 50.570 38.143 37.885 366 HZ1 LYS 51 HZ1 LYS 51 52.490 38.359 38.954 367 HZ2 LYS 51 HZ2 LYS 51 51.561 38.013 40.017 368 HZ3 LYS 51 HZ3 LYS 51 52.464 37.006 39.485 369 H VAL 52 H VAL 52 44.743 36.485 35.685 370 HA VAL 52 HA VAL 52 44.564 38.692 34.102 371 HB VAL 52 HB VAL 52 42.679 36.620 34.150 372 HG11 VAL 52 HG11 VAL 52 41.692 37.673 32.240 373 HG12 VAL 52 HG12 VAL 52 41.668 38.646 33.489 374 HG13 VAL 52 HG13 VAL 52 42.758 38.838 32.357 375 HG21 VAL 52 HG21 VAL 52 43.400 35.993 31.967 376 HG22 VAL 52 HG22 VAL 52 44.556 37.072 32.059 377 HG23 VAL 52 HG23 VAL 52 44.570 35.812 33.020 378 H TYR 53 H TYR 53 43.579 40.491 35.099 379 HA TYR 53 HA TYR 53 42.051 40.296 37.325 380 HB2 TYR 53 HB2 TYR 53 43.279 42.578 36.190 381 HB3 TYR 53 HB3 TYR 53 42.422 42.630 37.492 382 HD1 TYR 53 HD1 TYR 53 43.316 41.690 39.607 383 HD2 TYR 53 HD2 TYR 53 45.609 41.859 36.276 384 HE1 TYR 53 HE1 TYR 53 45.218 41.252 40.897 385 HE2 TYR 53 HE2 TYR 53 47.522 41.428 37.569 386 HH TYR 53 HH TYR 53 48.339 40.985 39.636 387 H VAL 54 H VAL 54 39.826 40.643 37.330 388 HA VAL 54 HA VAL 54 38.517 41.447 35.081 389 HB VAL 54 HB VAL 54 37.739 39.228 36.620 390 HG11 VAL 54 HG11 VAL 54 36.178 38.748 34.875 391 HG12 VAL 54 HG12 VAL 54 35.892 40.174 35.502 392 HG13 VAL 54 HG13 VAL 54 36.653 40.056 34.119 393 HG21 VAL 54 HG21 VAL 54 38.379 37.807 34.806 394 HG22 VAL 54 HG22 VAL 54 38.951 39.073 34.044 395 HG23 VAL 54 HG23 VAL 54 39.637 38.578 35.383 396 H THR 55 H THR 55 36.549 42.677 35.484 397 HA THR 55 HA THR 55 35.744 43.176 38.019 398 HB THR 55 HB THR 55 37.282 44.809 37.388 399 HG1 THR 55 HG1 THR 55 36.078 45.614 38.876 400 HG21 THR 55 HG21 THR 55 36.667 46.578 35.977 401 HG22 THR 55 HG22 THR 55 36.806 45.219 35.175 402 HG23 THR 55 HG23 THR 55 35.371 45.771 35.554 403 H PHE 56 H PHE 56 33.542 43.771 38.337 404 HA PHE 56 HA PHE 56 31.891 42.782 36.425 405 HB2 PHE 56 HB2 PHE 56 31.909 42.164 39.206 406 HB3 PHE 56 HB3 PHE 56 30.764 41.680 38.263 407 HD1 PHE 56 HD1 PHE 56 34.306 41.208 38.671 408 HD2 PHE 56 HD2 PHE 56 30.898 39.526 37.316 409 HE1 PHE 56 HE1 PHE 56 35.454 39.232 38.268 410 HE2 PHE 56 HE2 PHE 56 32.024 37.498 37.024 411 HZ PHE 56 HZ PHE 56 34.317 37.358 37.454 412 H LEU 57 H LEU 57 29.968 43.923 35.896 413 HA LEU 57 HA LEU 57 28.833 45.751 37.454 414 HB2 LEU 57 HB2 LEU 57 28.372 45.682 35.144 415 HB3 LEU 57 HB3 LEU 57 27.769 44.250 35.281 416 HG LEU 57 HG LEU 57 25.962 45.113 36.492 417 HD11 LEU 57 HD11 LEU 57 25.588 47.447 36.649 418 HD12 LEU 57 HD12 LEU 57 26.902 47.041 37.435 419 HD13 LEU 57 HD13 LEU 57 27.010 47.708 36.002 420 HD21 LEU 57 HD21 LEU 57 24.880 46.229 34.677 421 HD22 LEU 57 HD22 LEU 57 26.289 46.421 33.978 422 HD23 LEU 57 HD23 LEU 57 25.681 44.969 34.148 423 H ASN 58 H ASN 58 28.728 42.370 37.692 424 HA ASN 58 HA ASN 58 26.530 42.147 39.205 425 HB2 ASN 58 HB2 ASN 58 27.485 40.502 37.562 426 HB3 ASN 58 HB3 ASN 58 28.355 40.039 38.771 427 HD21 ASN 58 HD21 ASN 58 24.533 39.223 38.763 428 HD22 ASN 58 HD22 ASN 58 25.039 40.336 37.914 429 H ASP 59 H ASP 59 29.198 43.428 40.165 430 HA ASP 59 HA ASP 59 29.958 42.595 42.478 431 HB2 ASP 59 HB2 ASP 59 31.150 44.194 41.179 432 HB3 ASP 59 HB3 ASP 59 29.986 45.219 41.341 433 H LYS 60 H LYS 60 26.957 43.857 41.961 434 HA LYS 60 HA LYS 60 26.236 44.849 44.288 435 HB2 LYS 60 HB2 LYS 60 25.053 45.187 42.234 436 HB3 LYS 60 HB3 LYS 60 24.659 43.678 42.220 437 HG2 LYS 60 HG2 LYS 60 23.262 43.981 44.070 438 HG3 LYS 60 HG3 LYS 60 23.729 45.461 44.218 439 HD2 LYS 60 HD2 LYS 60 22.609 46.104 42.302 440 HD3 LYS 60 HD3 LYS 60 22.389 44.626 41.859 441 HE2 LYS 60 HE2 LYS 60 20.370 45.507 42.677 442 HE3 LYS 60 HE3 LYS 60 20.811 44.303 43.564 443 HZ1 LYS 60 HZ1 LYS 60 20.145 46.067 44.839 444 HZ2 LYS 60 HZ2 LYS 60 21.536 45.768 45.132 445 HZ3 LYS 60 HZ3 LYS 60 21.198 46.907 44.295 446 H ASP 61 H ASP 61 26.712 41.517 43.660 447 HA ASP 61 HA ASP 61 26.320 41.039 46.281 448 HB2 ASP 61 HB2 ASP 61 24.352 40.309 44.886 449 HB3 ASP 61 HB3 ASP 61 25.248 39.071 44.580 450 H GLU 62 H GLU 62 28.099 40.052 47.186 451 HA GLU 62 HA GLU 62 30.242 39.635 45.852 452 HB2 GLU 62 HB2 GLU 62 29.826 38.706 48.521 453 HB3 GLU 62 HB3 GLU 62 31.230 38.975 47.899 454 HG2 GLU 62 HG2 GLU 62 31.084 40.834 49.070 455 HG3 GLU 62 HG3 GLU 62 30.369 41.359 47.786 456 H ASP 63 H ASP 63 28.090 37.200 47.009 457 HA ASP 63 HA ASP 63 29.501 35.026 46.519 458 HB2 ASP 63 HB2 ASP 63 27.776 35.087 48.156 459 HB3 ASP 63 HB3 ASP 63 26.714 35.302 47.033 460 H ALA 64 H ALA 64 27.307 36.702 44.489 461 HA ALA 64 HA ALA 64 27.115 34.967 42.504 462 HB1 ALA 64 HB1 ALA 64 26.058 36.755 41.389 463 HB2 ALA 64 HB2 ALA 64 25.454 36.588 42.843 464 HB3 ALA 64 HB3 ALA 64 26.503 37.737 42.550 465 H VAL 65 H VAL 65 29.328 37.625 42.889 466 HA VAL 65 HA VAL 65 30.693 37.363 40.671 467 HB VAL 65 HB VAL 65 31.532 38.528 43.084 468 HG11 VAL 65 HG11 VAL 65 33.270 39.612 41.867 469 HG12 VAL 65 HG12 VAL 65 33.457 38.040 41.809 470 HG13 VAL 65 HG13 VAL 65 32.843 38.811 40.569 471 HG21 VAL 65 HG21 VAL 65 31.075 40.613 42.001 472 HG22 VAL 65 HG22 VAL 65 30.590 39.821 40.719 473 HG23 VAL 65 HG23 VAL 65 29.761 39.731 42.065 474 H LYS 66 H LYS 66 31.336 35.906 43.776 475 HA LYS 66 HA LYS 66 33.470 34.452 43.297 476 HB2 LYS 66 HB2 LYS 66 32.831 34.851 45.463 477 HB3 LYS 66 HB3 LYS 66 31.412 34.252 45.221 478 HG2 LYS 66 HG2 LYS 66 32.623 32.803 46.552 479 HG3 LYS 66 HG3 LYS 66 32.285 32.091 45.206 480 HD2 LYS 66 HD2 LYS 66 34.457 32.107 44.522 481 HD3 LYS 66 HD3 LYS 66 34.852 33.233 45.527 482 HE2 LYS 66 HE2 LYS 66 34.705 31.803 47.335 483 HE3 LYS 66 HE3 LYS 66 33.947 30.725 46.502 484 HZ1 LYS 66 HZ1 LYS 66 36.106 30.103 46.803 485 HZ2 LYS 66 HZ2 LYS 66 35.890 30.302 45.380 486 HZ3 LYS 66 HZ3 LYS 66 36.597 31.307 46.156 487 H ALA 67 H ALA 67 30.186 33.432 42.761 488 HA ALA 67 HA ALA 67 30.678 31.063 41.762 489 HB1 ALA 67 HB1 ALA 67 28.410 31.153 41.090 490 HB2 ALA 67 HB2 ALA 67 28.548 31.616 42.598 491 HB3 ALA 67 HB3 ALA 67 28.371 32.694 41.451 492 H GLY 68 H GLY 68 30.421 34.077 40.063 493 HA2 GLY 68 HA2 GLY 68 30.682 33.369 37.593 494 HA3 GLY 68 HA3 GLY 68 31.061 34.769 38.163 495 H ILE 69 H ILE 69 33.304 34.317 39.714 496 HA ILE 69 HA ILE 69 35.388 33.915 38.220 497 HB ILE 69 HB ILE 69 35.088 34.010 40.999 498 HG12 ILE 69 HG12 ILE 69 34.910 36.090 39.883 499 HG13 ILE 69 HG13 ILE 69 36.027 36.108 40.972 500 HG21 ILE 69 HG21 ILE 69 37.433 34.052 41.341 501 HG22 ILE 69 HG22 ILE 69 36.959 32.657 40.759 502 HG23 ILE 69 HG23 ILE 69 37.644 33.723 39.807 503 HD11 ILE 69 HD11 ILE 69 36.786 37.215 39.058 504 HD12 ILE 69 HD12 ILE 69 37.680 35.929 39.296 505 HD13 ILE 69 HD13 ILE 69 36.546 35.911 38.191 506 H LYS 70 H LYS 70 33.857 31.600 40.320 507 HA LYS 70 HA LYS 70 35.416 29.524 40.021 508 HB2 LYS 70 HB2 LYS 70 33.769 29.799 41.743 509 HB3 LYS 70 HB3 LYS 70 32.655 29.546 40.680 510 HG2 LYS 70 HG2 LYS 70 33.492 27.335 40.367 511 HG3 LYS 70 HG3 LYS 70 34.550 27.595 41.483 512 HD2 LYS 70 HD2 LYS 70 31.746 27.674 42.006 513 HD3 LYS 70 HD3 LYS 70 32.610 26.411 42.308 514 HE2 LYS 70 HE2 LYS 70 33.868 27.625 43.904 515 HE3 LYS 70 HE3 LYS 70 33.067 28.922 43.571 516 HZ1 LYS 70 HZ1 LYS 70 32.237 27.947 45.432 517 HZ2 LYS 70 HZ2 LYS 70 31.205 27.922 44.409 518 HZ3 LYS 70 HZ3 LYS 70 31.951 26.714 44.719 519 H ALA 71 H ALA 71 32.635 30.250 38.085 520 HA ALA 71 HA ALA 71 32.744 28.158 36.465 521 HB1 ALA 71 HB1 ALA 71 31.029 29.325 35.320 522 HB2 ALA 71 HB2 ALA 71 30.722 29.316 36.874 523 HB3 ALA 71 HB3 ALA 71 31.327 30.612 36.194 524 H LEU 72 H LEU 72 34.022 31.324 36.056 525 HA LEU 72 HA LEU 72 35.057 31.218 33.637 526 HB2 LEU 72 HB2 LEU 72 34.660 33.256 34.696 527 HB3 LEU 72 HB3 LEU 72 35.540 32.848 35.917 528 HG LEU 72 HG LEU 72 37.460 33.052 34.627 529 HD11 LEU 72 HD11 LEU 72 37.399 33.997 32.472 530 HD12 LEU 72 HD12 LEU 72 36.641 32.608 32.492 531 HD13 LEU 72 HD13 LEU 72 35.816 33.960 32.511 532 HD21 LEU 72 HD21 LEU 72 37.446 35.430 34.419 533 HD22 LEU 72 HD22 LEU 72 35.867 35.414 34.543 534 HD23 LEU 72 HD23 LEU 72 36.762 34.994 35.780 535 H GLN 73 H GLN 73 36.617 30.315 36.620 536 HA GLN 73 HA GLN 73 38.925 29.573 35.545 537 HB2 GLN 73 HB2 GLN 73 38.570 30.247 37.858 538 HB3 GLN 73 HB3 GLN 73 37.986 28.823 38.103 539 HG2 GLN 73 HG2 GLN 73 40.205 28.793 38.779 540 HG3 GLN 73 HG3 GLN 73 40.080 27.862 37.535 541 HE21 GLN 73 HE21 GLN 73 41.815 28.107 36.133 542 HE22 GLN 73 HE22 GLN 73 42.519 29.386 35.838 543 H GLU 74 H GLU 74 36.106 27.612 36.138 544 HA GLU 74 HA GLU 74 37.061 25.330 35.322 545 HB2 GLU 74 HB2 GLU 74 34.370 26.259 35.431 546 HB3 GLU 74 HB3 GLU 74 34.667 24.823 34.899 547 HG2 GLU 74 HG2 GLU 74 35.557 24.206 37.004 548 HG3 GLU 74 HG3 GLU 74 35.323 25.651 37.540 549 H ALA 75 H ALA 75 35.987 27.935 33.372 550 HA ALA 75 HA ALA 75 36.076 26.674 31.006 551 HB1 ALA 75 HB1 ALA 75 35.381 28.817 30.193 552 HB2 ALA 75 HB2 ALA 75 34.431 28.356 31.373 553 HB3 ALA 75 HB3 ALA 75 35.574 29.418 31.646 554 H SER 76 H SER 76 38.618 27.632 32.731 555 HA SER 76 HA SER 76 40.001 29.224 31.292 556 HB2 SER 76 HB2 SER 76 41.859 28.587 32.685 557 HB3 SER 76 HB3 SER 76 40.591 28.883 33.544 558 HG SER 76 HG SER 76 40.384 26.856 33.960 559 H GLY 77 H GLY 77 40.138 25.788 30.857 560 HA2 GLY 77 HA2 GLY 77 42.125 25.641 29.149 561 HA3 GLY 77 HA3 GLY 77 41.050 24.535 29.382 562 H PHE 78 H PHE 78 38.707 25.986 28.481 563 HA PHE 78 HA PHE 78 38.791 25.929 25.858 564 HB2 PHE 78 HB2 PHE 78 36.759 26.974 27.528 565 HB3 PHE 78 HB3 PHE 78 36.590 26.849 25.983 566 HD1 PHE 78 HD1 PHE 78 36.050 25.151 28.913 567 HD2 PHE 78 HD2 PHE 78 36.732 24.469 24.980 568 HE1 PHE 78 HE1 PHE 78 35.219 22.974 29.140 569 HE2 PHE 78 HE2 PHE 78 35.915 22.302 25.210 570 HZ PHE 78 HZ PHE 78 35.145 21.559 27.292 571 H ILE 79 H ILE 79 38.880 28.653 28.031 572 HA ILE 79 HA ILE 79 38.936 30.630 26.309 573 HB ILE 79 HB ILE 79 39.737 30.637 29.009 574 HG12 ILE 79 HG12 ILE 79 37.300 31.685 27.999 575 HG13 ILE 79 HG13 ILE 79 37.379 30.218 28.521 576 HG21 ILE 79 HG21 ILE 79 39.645 33.001 28.934 577 HG22 ILE 79 HG22 ILE 79 40.753 32.465 27.938 578 HG23 ILE 79 HG23 ILE 79 39.347 32.935 27.380 579 HD11 ILE 79 HD11 ILE 79 36.497 31.597 30.206 580 HD12 ILE 79 HD12 ILE 79 37.881 31.006 30.698 581 HD13 ILE 79 HD13 ILE 79 37.801 32.496 30.168 582 H ARG 80 H ARG 80 41.691 29.002 27.731 583 HA ARG 80 HA ARG 80 43.640 30.185 26.457 584 HB2 ARG 80 HB2 ARG 80 44.088 28.785 28.295 585 HB3 ARG 80 HB3 ARG 80 43.505 27.550 27.542 586 HG2 ARG 80 HG2 ARG 80 45.299 27.640 25.994 587 HG3 ARG 80 HG3 ARG 80 45.878 28.886 26.732 588 HD2 ARG 80 HD2 ARG 80 47.037 26.854 27.247 589 HD3 ARG 80 HD3 ARG 80 46.573 27.637 28.513 590 HE ARG 80 HE ARG 80 45.617 25.800 29.086 591 HH11 ARG 80 HH11 ARG 80 44.332 24.007 29.090 592 HH12 ARG 80 HH12 ARG 80 43.819 23.465 27.801 593 HH21 ARG 80 HH21 ARG 80 45.025 25.625 25.816 594 HH22 ARG 80 HH22 ARG 80 44.213 24.383 25.941 595 H SER 81 H SER 81 41.882 27.404 25.327 596 HA SER 81 HA SER 81 43.182 26.946 23.115 597 HB2 SER 81 HB2 SER 81 41.684 25.374 24.171 598 HB3 SER 81 HB3 SER 81 40.480 26.228 23.671 599 HG SER 81 HG SER 81 40.900 24.588 22.292 600 H LEU 82 H LEU 82 40.351 28.922 23.464 601 HA LEU 82 HA LEU 82 40.070 29.698 20.984 602 HB2 LEU 82 HB2 LEU 82 39.004 30.741 23.406 603 HB3 LEU 82 HB3 LEU 82 38.626 31.383 22.036 604 HG LEU 82 HG LEU 82 38.005 28.694 22.662 605 HD11 LEU 82 HD11 LEU 82 35.760 29.455 23.017 606 HD12 LEU 82 HD12 LEU 82 36.737 30.168 24.038 607 HD13 LEU 82 HD13 LEU 82 36.237 30.941 22.750 608 HD21 LEU 82 HD21 LEU 82 36.538 28.738 20.818 609 HD22 LEU 82 HD22 LEU 82 36.987 30.223 20.501 610 HD23 LEU 82 HD23 LEU 82 38.020 29.033 20.345 611 H LEU 83 H LEU 83 41.876 31.213 23.519 612 HA LEU 83 HA LEU 83 42.479 33.502 22.375 613 HB2 LEU 83 HB2 LEU 83 42.590 33.176 24.724 614 HB3 LEU 83 HB3 LEU 83 43.753 32.155 24.536 615 HG LEU 83 HG LEU 83 45.123 33.957 23.706 616 HD11 LEU 83 HD11 LEU 83 44.445 36.155 24.084 617 HD12 LEU 83 HD12 LEU 83 43.460 35.446 23.067 618 HD13 LEU 83 HD13 LEU 83 43.034 35.636 24.580 619 HD21 LEU 83 HD21 LEU 83 45.558 34.841 25.863 620 HD22 LEU 83 HD22 LEU 83 44.171 34.269 26.370 621 HD23 LEU 83 HD23 LEU 83 45.334 33.276 25.959 622 H GLY 84 H GLY 84 44.440 30.625 22.547 623 HA2 GLY 84 HA2 GLY 84 46.475 31.430 21.121 624 HA3 GLY 84 HA3 GLY 84 46.150 29.946 21.469 625 H LYS 85 H LYS 85 43.537 29.952 20.028 626 HA LYS 85 HA LYS 85 44.081 29.672 17.442 627 HB2 LYS 85 HB2 LYS 85 42.324 28.510 18.680 628 HB3 LYS 85 HB3 LYS 85 41.515 29.842 18.668 629 HG2 LYS 85 HG2 LYS 85 41.377 29.756 16.311 630 HG3 LYS 85 HG3 LYS 85 42.227 28.449 16.299 631 HD2 LYS 85 HD2 LYS 85 40.041 27.764 16.109 632 HD3 LYS 85 HD3 LYS 85 40.490 27.356 17.546 633 HE2 LYS 85 HE2 LYS 85 38.370 28.254 17.720 634 HE3 LYS 85 HE3 LYS 85 39.346 29.241 18.430 635 HZ1 LYS 85 HZ1 LYS 85 37.922 30.361 17.058 636 HZ2 LYS 85 HZ2 LYS 85 39.283 30.568 16.590 637 HZ3 LYS 85 HZ3 LYS 85 38.409 29.638 15.895 638 H ALA 86 H ALA 86 42.484 32.308 19.056 639 HA ALA 86 HA ALA 86 41.953 33.845 17.014 640 HB1 ALA 86 HB1 ALA 86 41.642 35.517 18.665 641 HB2 ALA 86 HB2 ALA 86 40.944 34.172 19.123 642 HB3 ALA 86 HB3 ALA 86 42.345 34.585 19.734 643 H MET 87 H MET 87 44.817 33.890 18.936 644 HA MET 87 HA MET 87 46.087 35.774 17.564 645 HB2 MET 87 HB2 MET 87 46.928 34.187 19.781 646 HB3 MET 87 HB3 MET 87 47.848 35.292 19.177 647 HG2 MET 87 HG2 MET 87 46.256 36.945 19.787 648 HG3 MET 87 HG3 MET 87 45.346 35.838 20.403 649 HE1 MET 87 HE1 MET 87 46.702 38.016 23.270 650 HE2 MET 87 HE2 MET 87 46.514 38.492 21.771 651 HE3 MET 87 HE3 MET 87 45.384 37.635 22.478 652 H ARG 88 H ARG 88 45.731 32.754 16.561 653 HA ARG 88 HA ARG 88 46.765 31.237 15.473 654 HB2 ARG 88 HB2 ARG 88 47.759 33.495 14.091 655 HB3 ARG 88 HB3 ARG 88 47.811 32.046 13.515 656 HG2 ARG 88 HG2 ARG 88 45.421 31.979 13.483 657 HG3 ARG 88 HG3 ARG 88 45.375 33.432 14.048 658 HD2 ARG 88 HD2 ARG 88 45.064 33.589 11.751 659 HD3 ARG 88 HD3 ARG 88 46.456 34.218 12.065 660 HE ARG 88 HE ARG 88 46.498 31.598 11.323 661 HH11 ARG 88 HH11 ARG 88 47.847 30.929 9.713 662 HH12 ARG 88 HH12 ARG 88 48.378 31.908 8.724 663 HH21 ARG 88 HH21 ARG 88 47.084 34.567 9.986 664 HH22 ARG 88 HH22 ARG 88 47.931 34.032 8.884 665 H LEU 89 H LEU 89 47.925 31.117 17.756 666 HA LEU 89 HA LEU 89 50.509 31.929 17.941 667 HB2 LEU 89 HB2 LEU 89 48.557 32.447 19.453 668 HB3 LEU 89 HB3 LEU 89 48.851 31.037 20.049 669 HG LEU 89 HG LEU 89 50.945 31.776 20.795 670 HD11 LEU 89 HD11 LEU 89 51.527 34.058 20.707 671 HD12 LEU 89 HD12 LEU 89 51.399 33.473 19.240 672 HD13 LEU 89 HD13 LEU 89 50.230 34.353 19.847 673 HD21 LEU 89 HD21 LEU 89 50.095 33.219 22.517 674 HD22 LEU 89 HD22 LEU 89 48.791 33.461 21.651 675 HD23 LEU 89 HD23 LEU 89 49.077 32.031 22.268 676 H ARG 90 H ARG 90 52.188 30.593 19.019 677 HA ARG 90 HA ARG 90 51.952 27.950 18.599 678 HB2 ARG 90 HB2 ARG 90 54.417 29.337 18.848 679 HB3 ARG 90 HB3 ARG 90 54.294 27.828 18.474 680 HG2 ARG 90 HG2 ARG 90 53.104 28.599 16.436 681 HG3 ARG 90 HG3 ARG 90 53.662 30.016 16.776 682 HD2 ARG 90 HD2 ARG 90 55.882 28.895 16.852 683 HD3 ARG 90 HD3 ARG 90 55.183 27.741 16.069 684 HE ARG 90 HE ARG 90 54.737 29.889 14.662 685 HH11 ARG 90 HH11 ARG 90 56.044 30.766 13.063 686 HH12 ARG 90 HH12 ARG 90 57.399 30.196 12.822 687 HH21 ARG 90 HH21 ARG 90 57.448 28.070 15.225 688 HH22 ARG 90 HH22 ARG 90 58.215 28.629 14.078 689 H ILE 91 H ILE 91 52.993 30.041 21.139 690 HA ILE 91 HA ILE 91 52.576 28.172 23.042 691 HB ILE 91 HB ILE 91 54.236 29.002 24.367 692 HG12 ILE 91 HG12 ILE 91 55.962 30.336 22.926 693 HG13 ILE 91 HG13 ILE 91 54.604 31.001 22.543 694 HG21 ILE 91 HG21 ILE 91 56.093 28.053 23.161 695 HG22 ILE 91 HG22 ILE 91 54.803 27.145 23.016 696 HG23 ILE 91 HG23 ILE 91 55.228 28.112 21.837 697 HD11 ILE 91 HD11 ILE 91 55.557 32.164 24.362 698 HD12 ILE 91 HD12 ILE 91 54.194 31.507 24.829 699 HD13 ILE 91 HD13 ILE 91 55.571 30.832 25.218 700 H VAL 92 H VAL 92 50.827 28.643 24.262 701 HA VAL 92 HA VAL 92 50.166 31.175 25.019 702 HB VAL 92 HB VAL 92 48.573 30.170 23.676 703 HG11 VAL 92 HG11 VAL 92 47.195 28.427 24.464 704 HG12 VAL 92 HG12 VAL 92 48.690 27.942 24.266 705 HG13 VAL 92 HG13 VAL 92 48.149 28.266 25.718 706 HG21 VAL 92 HG21 VAL 92 46.659 30.721 24.975 707 HG22 VAL 92 HG22 VAL 92 47.576 30.771 26.265 708 HG23 VAL 92 HG23 VAL 92 47.780 31.831 25.106 709 HA PRO 93 HA PRO 93 50.967 30.019 29.141 710 HB2 PRO 93 HB2 PRO 93 49.727 32.375 30.051 711 HB3 PRO 93 HB3 PRO 93 51.204 31.955 30.319 712 HG2 PRO 93 HG2 PRO 93 50.759 33.856 28.646 713 HG3 PRO 93 HG3 PRO 93 51.953 32.892 28.369 714 HD2 PRO 93 HD2 PRO 93 49.362 32.742 27.201 715 HD3 PRO 93 HD3 PRO 93 50.720 32.556 26.455 716 H GLU 94 H GLU 94 49.907 29.165 31.032 717 HA GLU 94 HA GLU 94 47.296 28.453 30.833 718 HB2 GLU 94 HB2 GLU 94 49.054 26.921 31.455 719 HB3 GLU 94 HB3 GLU 94 49.198 27.710 32.793 720 HG2 GLU 94 HG2 GLU 94 47.887 26.010 33.442 721 HG3 GLU 94 HG3 GLU 94 46.819 27.116 33.179 722 H LEU 95 H LEU 95 45.545 29.292 32.117 723 HA LEU 95 HA LEU 95 46.082 31.795 32.936 724 HB2 LEU 95 HB2 LEU 95 43.569 30.811 31.978 725 HB3 LEU 95 HB3 LEU 95 43.879 32.322 32.206 726 HG LEU 95 HG LEU 95 45.044 30.772 30.153 727 HD11 LEU 95 HD11 LEU 95 43.685 32.075 28.664 728 HD12 LEU 95 HD12 LEU 95 42.766 31.288 29.684 729 HD13 LEU 95 HD13 LEU 95 43.064 32.827 29.912 730 HD21 LEU 95 HD21 LEU 95 45.954 32.755 29.270 731 HD22 LEU 95 HD22 LEU 95 45.389 33.560 30.512 732 HD23 LEU 95 HD23 LEU 95 46.530 32.480 30.719 733 H THR 96 H THR 96 45.564 32.658 34.973 734 HA THR 96 HA THR 96 43.615 31.499 36.460 735 HB THR 96 HB THR 96 45.845 32.744 37.625 736 HG1 THR 96 HG1 THR 96 46.312 30.639 38.257 737 HG21 THR 96 HG21 THR 96 45.054 31.906 39.710 738 HG22 THR 96 HG22 THR 96 43.975 32.871 39.070 739 HG23 THR 96 HG23 THR 96 43.789 31.301 38.975 740 H PHE 97 H PHE 97 41.911 32.835 37.089 741 HA PHE 97 HA PHE 97 41.921 35.484 36.504 742 HB2 PHE 97 HB2 PHE 97 39.678 33.774 36.789 743 HB3 PHE 97 HB3 PHE 97 39.579 35.270 36.361 744 HD1 PHE 97 HD1 PHE 97 40.257 35.939 34.043 745 HD2 PHE 97 HD2 PHE 97 40.253 32.043 35.157 746 HE1 PHE 97 HE1 PHE 97 40.491 35.297 31.811 747 HE2 PHE 97 HE2 PHE 97 40.424 31.412 32.916 748 HZ PHE 97 HZ PHE 97 40.589 33.034 31.246 749 H PHE 98 H PHE 98 41.423 37.111 37.938 750 HA PHE 98 HA PHE 98 40.917 36.674 40.564 751 HB2 PHE 98 HB2 PHE 98 42.877 38.488 39.605 752 HB3 PHE 98 HB3 PHE 98 42.501 38.331 41.111 753 HD1 PHE 98 HD1 PHE 98 43.453 36.510 42.436 754 HD2 PHE 98 HD2 PHE 98 44.289 36.781 38.486 755 HE1 PHE 98 HE1 PHE 98 45.092 34.863 42.672 756 HE2 PHE 98 HE2 PHE 98 45.928 35.135 38.724 757 HZ PHE 98 HZ PHE 98 46.318 34.158 40.808 758 H TYR 99 H TYR 99 39.529 38.318 41.575 759 HA TYR 99 HA TYR 99 38.174 39.948 39.910 760 HB2 TYR 99 HB2 TYR 99 36.458 39.970 41.255 761 HB3 TYR 99 HB3 TYR 99 36.940 38.487 41.272 762 HD1 TYR 99 HD1 TYR 99 35.749 40.854 43.276 763 HD2 TYR 99 HD2 TYR 99 38.520 37.911 43.371 764 HE1 TYR 99 HE1 TYR 99 35.598 40.793 45.602 765 HE2 TYR 99 HE2 TYR 99 38.441 37.909 45.711 766 HH TYR 99 HH TYR 99 37.472 38.777 47.572 767 H ASP 100 H ASP 100 38.152 42.218 39.982 768 HA ASP 100 HA ASP 100 39.843 43.598 41.641 769 HB2 ASP 100 HB2 ASP 100 40.926 43.241 39.592 770 HB3 ASP 100 HB3 ASP 100 39.671 43.730 38.806 Start of MODEL 17 1 HA PRO 8 HA PRO 8 56.743 43.157 25.657 2 HB2 PRO 8 HB2 PRO 8 55.566 40.946 25.158 3 HB3 PRO 8 HB3 PRO 8 57.111 41.015 24.961 4 HG2 PRO 8 HG2 PRO 8 55.751 39.911 27.201 5 HG3 PRO 8 HG3 PRO 8 57.009 39.313 26.499 6 HD2 PRO 8 HD2 PRO 8 57.274 40.734 28.659 7 HD3 PRO 8 HD3 PRO 8 58.428 40.674 27.612 8 H GLN 9 H GLN 9 55.656 44.842 26.974 9 HA GLN 9 HA GLN 9 53.287 44.398 28.115 10 HB2 GLN 9 HB2 GLN 9 55.099 46.134 28.627 11 HB3 GLN 9 HB3 GLN 9 54.192 47.012 27.712 12 HG2 GLN 9 HG2 GLN 9 53.240 45.760 30.074 13 HG3 GLN 9 HG3 GLN 9 53.663 47.260 30.026 14 HE21 GLN 9 HE21 GLN 9 50.990 45.651 30.219 15 HE22 GLN 9 HE22 GLN 9 50.032 46.526 29.487 16 H ARG 10 H ARG 10 54.180 45.804 25.091 17 HA ARG 10 HA ARG 10 51.877 46.728 24.201 18 HB2 ARG 10 HB2 ARG 10 54.196 47.207 23.455 19 HB3 ARG 10 HB3 ARG 10 54.052 45.925 22.578 20 HG2 ARG 10 HG2 ARG 10 52.327 46.931 21.337 21 HG3 ARG 10 HG3 ARG 10 52.370 48.191 22.255 22 HD2 ARG 10 HD2 ARG 10 54.522 47.404 20.548 23 HD3 ARG 10 HD3 ARG 10 53.578 48.608 20.243 24 HE ARG 10 HE ARG 10 54.566 49.457 22.362 25 HH11 ARG 10 HH11 ARG 10 56.637 50.144 23.029 26 HH12 ARG 10 HH12 ARG 10 57.799 49.931 22.123 27 HH21 ARG 10 HH21 ARG 10 56.315 48.303 19.811 28 HH22 ARG 10 HH22 ARG 10 57.613 48.871 20.273 29 H VAL 11 H VAL 11 53.209 43.567 23.728 30 HA VAL 11 HA VAL 11 51.187 42.453 22.459 31 HB VAL 11 HB VAL 11 53.260 41.241 23.901 32 HG11 VAL 11 HG11 VAL 11 52.724 39.180 22.826 33 HG12 VAL 11 HG12 VAL 11 51.518 39.664 23.732 34 HG13 VAL 11 HG13 VAL 11 51.464 39.871 22.162 35 HG21 VAL 11 HG21 VAL 11 54.197 40.742 21.741 36 HG22 VAL 11 HG22 VAL 11 52.982 41.499 21.062 37 HG23 VAL 11 HG23 VAL 11 54.038 42.308 21.921 38 H ALA 12 H ALA 12 51.760 42.589 25.920 39 HA ALA 12 HA ALA 12 49.754 41.152 26.725 40 HB1 ALA 12 HB1 ALA 12 50.172 42.138 28.846 41 HB2 ALA 12 HB2 ALA 12 51.528 41.661 28.181 42 HB3 ALA 12 HB3 ALA 12 51.130 43.193 28.154 43 H GLN 13 H GLN 13 49.595 44.535 25.946 44 HA GLN 13 HA GLN 13 47.124 44.966 26.672 45 HB2 GLN 13 HB2 GLN 13 48.714 46.408 24.806 46 HB3 GLN 13 HB3 GLN 13 47.297 46.910 25.222 47 HG2 GLN 13 HG2 GLN 13 49.509 46.739 26.993 48 HG3 GLN 13 HG3 GLN 13 48.950 48.077 26.419 49 HE21 GLN 13 HE21 GLN 13 46.475 48.383 27.050 50 HE22 GLN 13 HE22 GLN 13 46.129 48.088 28.468 51 H GLU 14 H GLU 14 48.212 43.706 23.596 52 HA GLU 14 HA GLU 14 45.826 43.578 22.497 53 HB2 GLU 14 HB2 GLU 14 48.219 42.284 21.748 54 HB3 GLU 14 HB3 GLU 14 46.893 41.968 20.989 55 HG2 GLU 14 HG2 GLU 14 46.740 44.392 20.549 56 HG3 GLU 14 HG3 GLU 14 48.223 44.478 21.021 57 H MET 15 H MET 15 47.516 41.195 24.407 58 HA MET 15 HA MET 15 45.789 39.247 24.301 59 HB2 MET 15 HB2 MET 15 47.766 39.750 26.250 60 HB3 MET 15 HB3 MET 15 46.853 38.488 26.343 61 HG2 MET 15 HG2 MET 15 47.659 37.800 24.193 62 HG3 MET 15 HG3 MET 15 48.638 39.015 24.201 63 HE1 MET 15 HE1 MET 15 50.840 35.895 24.466 64 HE2 MET 15 HE2 MET 15 49.438 35.982 23.734 65 HE3 MET 15 HE3 MET 15 50.501 37.141 23.550 66 H GLN 16 H GLN 16 45.736 41.918 26.573 67 HA GLN 16 HA GLN 16 43.679 41.297 27.986 68 HB2 GLN 16 HB2 GLN 16 44.989 43.151 28.573 69 HB3 GLN 16 HB3 GLN 16 44.526 43.917 27.297 70 HG2 GLN 16 HG2 GLN 16 42.296 43.950 28.127 71 HG3 GLN 16 HG3 GLN 16 42.760 43.185 29.404 72 HE21 GLN 16 HE21 GLN 16 41.461 45.683 29.441 73 HE22 GLN 16 HE22 GLN 16 42.351 46.679 30.103 74 H LYS 17 H LYS 17 43.531 43.122 24.987 75 HA LYS 17 HA LYS 17 40.955 43.415 24.777 76 HB2 LYS 17 HB2 LYS 17 42.603 44.658 23.515 77 HB3 LYS 17 HB3 LYS 17 42.794 43.405 22.606 78 HG2 LYS 17 HG2 LYS 17 40.463 43.580 21.987 79 HG3 LYS 17 HG3 LYS 17 40.399 44.924 22.775 80 HD2 LYS 17 HD2 LYS 17 42.013 45.869 21.273 81 HD3 LYS 17 HD3 LYS 17 42.042 44.531 20.473 82 HE2 LYS 17 HE2 LYS 17 39.668 44.817 20.048 83 HE3 LYS 17 HE3 LYS 17 39.770 46.232 20.698 84 HZ1 LYS 17 HZ1 LYS 17 39.947 46.397 18.439 85 HZ2 LYS 17 HZ2 LYS 17 41.203 46.840 19.022 86 HZ3 LYS 17 HZ3 LYS 17 41.108 45.522 18.417 87 H GLU 18 H GLU 18 42.808 40.799 23.505 88 HA GLU 18 HA GLU 18 40.908 39.547 22.149 89 HB2 GLU 18 HB2 GLU 18 43.359 39.396 21.836 90 HB3 GLU 18 HB3 GLU 18 43.346 38.378 23.017 91 HG2 GLU 18 HG2 GLU 18 43.286 37.038 21.181 92 HG3 GLU 18 HG3 GLU 18 41.806 37.024 21.672 93 H ILE 19 H ILE 19 42.080 38.929 25.365 94 HA ILE 19 HA ILE 19 40.569 36.839 25.963 95 HB ILE 19 HB ILE 19 42.079 38.494 27.660 96 HG12 ILE 19 HG12 ILE 19 42.734 35.829 26.893 97 HG13 ILE 19 HG13 ILE 19 43.297 37.051 26.105 98 HG21 ILE 19 HG21 ILE 19 41.800 36.853 29.366 99 HG22 ILE 19 HG22 ILE 19 40.396 37.464 28.962 100 HG23 ILE 19 HG23 ILE 19 40.827 36.043 28.415 101 HD11 ILE 19 HD11 ILE 19 44.931 36.280 27.620 102 HD12 ILE 19 HD12 ILE 19 44.505 37.750 28.030 103 HD13 ILE 19 HD13 ILE 19 43.934 36.508 28.829 104 H ALA 20 H ALA 20 40.075 40.226 26.617 105 HA ALA 20 HA ALA 20 37.851 40.192 27.949 106 HB1 ALA 20 HB1 ALA 20 37.684 42.470 27.298 107 HB2 ALA 20 HB2 ALA 20 39.160 42.148 27.772 108 HB3 ALA 20 HB3 ALA 20 38.827 42.240 26.227 109 H LEU 21 H LEU 21 38.122 40.025 24.496 110 HA LEU 21 HA LEU 21 35.535 39.896 23.911 111 HB2 LEU 21 HB2 LEU 21 37.093 40.562 22.302 112 HB3 LEU 21 HB3 LEU 21 37.803 39.175 22.377 113 HG LEU 21 HG LEU 21 35.948 38.141 21.422 114 HD11 LEU 21 HD11 LEU 21 34.148 39.381 20.531 115 HD12 LEU 21 HD12 LEU 21 34.211 39.546 22.105 116 HD13 LEU 21 HD13 LEU 21 34.754 40.700 21.165 117 HD21 LEU 21 HD21 LEU 21 36.154 39.080 19.227 118 HD22 LEU 21 HD22 LEU 21 36.830 40.364 19.860 119 HD23 LEU 21 HD23 LEU 21 37.580 38.970 19.909 120 H ILE 22 H ILE 22 37.708 37.207 24.510 121 HA ILE 22 HA ILE 22 36.029 35.305 23.944 122 HB ILE 22 HB ILE 22 38.293 35.038 25.607 123 HG12 ILE 22 HG12 ILE 22 38.139 34.269 22.875 124 HG13 ILE 22 HG13 ILE 22 38.709 35.662 23.285 125 HG21 ILE 22 HG21 ILE 22 38.117 32.689 25.196 126 HG22 ILE 22 HG22 ILE 22 36.811 33.205 25.927 127 HG23 ILE 22 HG23 ILE 22 36.794 32.943 24.364 128 HD11 ILE 22 HD11 ILE 22 40.486 34.186 22.861 129 HD12 ILE 22 HD12 ILE 22 40.523 34.607 24.387 130 HD13 ILE 22 HD13 ILE 22 39.945 33.194 23.970 131 H LEU 23 H LEU 23 36.347 36.919 27.009 132 HA LEU 23 HA LEU 23 34.737 35.458 28.447 133 HB2 LEU 23 HB2 LEU 23 35.888 37.974 28.818 134 HB3 LEU 23 HB3 LEU 23 34.597 37.729 29.658 135 HG LEU 23 HG LEU 23 35.663 35.764 30.545 136 HD11 LEU 23 HD11 LEU 23 38.014 35.627 30.444 137 HD12 LEU 23 HD12 LEU 23 37.388 35.481 28.997 138 HD13 LEU 23 HD13 LEU 23 38.035 36.855 29.446 139 HD21 LEU 23 HD21 LEU 23 36.936 36.991 32.144 140 HD22 LEU 23 HD22 LEU 23 36.892 38.252 31.189 141 HD23 LEU 23 HD23 LEU 23 35.560 37.723 31.863 142 H GLN 24 H GLN 24 33.797 37.927 26.254 143 HA GLN 24 HA GLN 24 31.195 37.845 26.812 144 HB2 GLN 24 HB2 GLN 24 32.607 39.264 24.781 145 HB3 GLN 24 HB3 GLN 24 31.054 39.350 24.884 146 HG2 GLN 24 HG2 GLN 24 31.298 40.302 27.090 147 HG3 GLN 24 HG3 GLN 24 32.845 40.308 26.883 148 HE21 GLN 24 HE21 GLN 24 31.141 42.641 27.248 149 HE22 GLN 24 HE22 GLN 24 31.343 43.545 26.082 150 H ARG 25 H ARG 25 33.080 36.047 24.649 151 HA ARG 25 HA ARG 25 31.077 35.239 23.065 152 HB2 ARG 25 HB2 ARG 25 33.903 34.947 22.783 153 HB3 ARG 25 HB3 ARG 25 32.939 34.230 21.788 154 HG2 ARG 25 HG2 ARG 25 33.054 37.055 22.052 155 HG3 ARG 25 HG3 ARG 25 33.794 36.284 20.917 156 HD2 ARG 25 HD2 ARG 25 30.983 36.568 21.139 157 HD3 ARG 25 HD3 ARG 25 31.863 37.162 19.997 158 HE ARG 25 HE ARG 25 32.208 34.843 19.399 159 HH11 ARG 25 HH11 ARG 25 31.025 33.271 18.400 160 HH12 ARG 25 HH12 ARG 25 29.556 33.167 18.625 161 HH21 ARG 25 HH21 ARG 25 29.232 35.642 20.632 162 HH22 ARG 25 HH22 ARG 25 28.512 34.547 19.925 163 H GLU 26 H GLU 26 33.230 33.514 25.173 164 HA GLU 26 HA GLU 26 32.162 31.097 24.641 165 HB2 GLU 26 HB2 GLU 26 34.514 31.339 24.839 166 HB3 GLU 26 HB3 GLU 26 34.339 31.745 26.334 167 HG2 GLU 26 HG2 GLU 26 35.055 29.552 26.285 168 HG3 GLU 26 HG3 GLU 26 33.600 29.558 26.847 169 H ILE 27 H ILE 27 31.746 33.325 27.124 170 HA ILE 27 HA ILE 27 29.944 31.817 28.504 171 HB ILE 27 HB ILE 27 31.383 33.984 29.568 172 HG12 ILE 27 HG12 ILE 27 31.924 31.259 30.121 173 HG13 ILE 27 HG13 ILE 27 32.854 32.168 29.261 174 HG21 ILE 27 HG21 ILE 27 30.455 33.319 31.658 175 HG22 ILE 27 HG22 ILE 27 29.302 33.695 30.640 176 HG23 ILE 27 HG23 ILE 27 29.644 32.175 30.922 177 HD11 ILE 27 HD11 ILE 27 33.753 31.950 31.415 178 HD12 ILE 27 HD12 ILE 27 33.370 33.467 31.169 179 HD13 ILE 27 HD13 ILE 27 32.427 32.544 32.042 180 H LYS 28 H LYS 28 27.749 32.729 28.658 181 HA LYS 28 HA LYS 28 27.011 34.923 27.331 182 HB2 LYS 28 HB2 LYS 28 25.564 33.053 28.840 183 HB3 LYS 28 HB3 LYS 28 24.879 34.403 28.468 184 HG2 LYS 28 HG2 LYS 28 26.012 32.836 26.400 185 HG3 LYS 28 HG3 LYS 28 24.576 32.490 26.899 186 HD2 LYS 28 HD2 LYS 28 23.792 34.600 26.226 187 HD3 LYS 28 HD3 LYS 28 25.235 35.039 25.828 188 HE2 LYS 28 HE2 LYS 28 24.172 32.780 24.523 189 HE3 LYS 28 HE3 LYS 28 23.673 34.177 24.043 190 HZ1 LYS 28 HZ1 LYS 28 25.444 33.511 22.799 191 HZ2 LYS 28 HZ2 LYS 28 25.829 34.709 23.526 192 HZ3 LYS 28 HZ3 LYS 28 26.295 33.407 23.973 193 H ASP 29 H ASP 29 27.855 36.846 28.082 194 HA ASP 29 HA ASP 29 28.116 37.522 30.598 195 HB2 ASP 29 HB2 ASP 29 29.314 38.414 28.539 196 HB3 ASP 29 HB3 ASP 29 28.192 39.497 28.582 197 HA PRO 30 HA PRO 30 24.048 39.875 30.105 198 HB2 PRO 30 HB2 PRO 30 22.644 37.811 28.687 199 HB3 PRO 30 HB3 PRO 30 22.303 39.332 28.644 200 HG2 PRO 30 HG2 PRO 30 23.615 38.420 26.663 201 HG3 PRO 30 HG3 PRO 30 24.076 39.805 27.212 202 HD2 PRO 30 HD2 PRO 30 25.268 37.291 27.763 203 HD3 PRO 30 HD3 PRO 30 26.020 38.633 27.508 204 H ARG 31 H ARG 31 24.384 36.590 30.835 205 HA ARG 31 HA ARG 31 22.622 36.425 32.860 206 HB2 ARG 31 HB2 ARG 31 23.281 34.624 31.359 207 HB3 ARG 31 HB3 ARG 31 24.636 34.579 32.129 208 HG2 ARG 31 HG2 ARG 31 23.705 33.666 33.970 209 HG3 ARG 31 HG3 ARG 31 22.278 34.186 33.616 210 HD2 ARG 31 HD2 ARG 31 22.353 31.866 33.242 211 HD3 ARG 31 HD3 ARG 31 22.094 32.588 31.885 212 HE ARG 31 HE ARG 31 24.708 32.116 32.217 213 HH11 ARG 31 HH11 ARG 31 25.808 30.646 31.029 214 HH12 ARG 31 HH12 ARG 31 25.090 29.603 30.244 215 HH21 ARG 31 HH21 ARG 31 22.071 30.479 31.010 216 HH22 ARG 31 HH22 ARG 31 22.885 29.502 30.233 217 H LEU 32 H LEU 32 25.743 37.567 32.828 218 HA LEU 32 HA LEU 32 25.809 38.098 35.489 219 HB2 LEU 32 HB2 LEU 32 27.888 38.111 33.552 220 HB3 LEU 32 HB3 LEU 32 28.117 38.703 34.977 221 HG LEU 32 HG LEU 32 27.462 35.987 34.581 222 HD11 LEU 32 HD11 LEU 32 29.791 35.531 34.927 223 HD12 LEU 32 HD12 LEU 32 29.607 36.445 33.647 224 HD13 LEU 32 HD13 LEU 32 30.066 37.088 35.020 225 HD21 LEU 32 HD21 LEU 32 28.204 35.624 36.783 226 HD22 LEU 32 HD22 LEU 32 28.492 37.174 36.938 227 HD23 LEU 32 HD23 LEU 32 27.004 36.658 36.772 228 H GLY 33 H GLY 33 24.339 39.642 33.209 229 HA2 GLY 33 HA2 GLY 33 23.395 41.586 33.293 230 HA3 GLY 33 HA3 GLY 33 24.480 42.079 34.298 231 H MET 34 H MET 34 25.775 40.874 31.403 232 HA MET 34 HA MET 34 26.839 41.649 29.738 233 HB2 MET 34 HB2 MET 34 24.512 41.984 29.157 234 HB3 MET 34 HB3 MET 34 24.744 43.498 29.450 235 HG2 MET 34 HG2 MET 34 24.871 43.140 27.158 236 HG3 MET 34 HG3 MET 34 26.252 43.652 27.672 237 HE1 MET 34 HE1 MET 34 28.756 41.348 26.547 238 HE2 MET 34 HE2 MET 34 28.291 42.861 26.471 239 HE3 MET 34 HE3 MET 34 28.457 42.153 27.878 240 H MET 35 H MET 35 27.922 42.646 32.098 241 HA MET 35 HA MET 35 29.487 44.660 31.318 242 HB2 MET 35 HB2 MET 35 27.457 45.694 32.192 243 HB3 MET 35 HB3 MET 35 27.928 45.210 33.597 244 HG2 MET 35 HG2 MET 35 28.594 47.415 33.359 245 HG3 MET 35 HG3 MET 35 29.882 46.537 33.402 246 HE1 MET 35 HE1 MET 35 31.236 49.152 31.189 247 HE2 MET 35 HE2 MET 35 30.392 49.289 32.521 248 HE3 MET 35 HE3 MET 35 31.537 48.200 32.419 249 H THR 36 H THR 36 30.113 41.935 32.049 250 HA THR 36 HA THR 36 31.949 42.268 33.970 251 HB THR 36 HB THR 36 31.593 40.065 32.304 252 HG1 THR 36 HG1 THR 36 30.828 39.083 34.162 253 HG21 THR 36 HG21 THR 36 33.058 38.816 33.691 254 HG22 THR 36 HG22 THR 36 33.816 40.014 32.983 255 HG23 THR 36 HG23 THR 36 33.380 40.137 34.501 256 H THR 37 H THR 37 34.305 42.576 33.493 257 HA THR 37 HA THR 37 35.169 42.815 30.962 258 HB THR 37 HB THR 37 35.287 44.898 32.838 259 HG1 THR 37 HG1 THR 37 34.157 46.067 31.285 260 HG21 THR 37 HG21 THR 37 36.380 46.321 31.283 261 HG22 THR 37 HG22 THR 37 37.279 45.077 31.668 262 HG23 THR 37 HG23 THR 37 36.502 45.095 30.289 263 H VAL 38 H VAL 38 37.522 42.445 30.727 264 HA VAL 38 HA VAL 38 39.037 41.845 32.856 265 HB VAL 38 HB VAL 38 39.811 41.956 30.166 266 HG11 VAL 38 HG11 VAL 38 41.786 40.793 30.774 267 HG12 VAL 38 HG12 VAL 38 41.719 42.206 31.488 268 HG13 VAL 38 HG13 VAL 38 41.354 40.893 32.295 269 HG21 VAL 38 HG21 VAL 38 39.799 39.568 30.197 270 HG22 VAL 38 HG22 VAL 38 39.257 39.610 31.685 271 HG23 VAL 38 HG23 VAL 38 38.352 40.139 30.498 272 H SER 39 H SER 39 40.066 43.537 34.049 273 HA SER 39 HA SER 39 40.354 45.996 33.051 274 HB2 SER 39 HB2 SER 39 40.593 46.725 35.227 275 HB3 SER 39 HB3 SER 39 39.429 45.686 35.255 276 HG SER 39 HG SER 39 40.919 45.324 36.841 277 H GLY 40 H GLY 40 42.515 43.485 33.468 278 HA2 GLY 40 HA2 GLY 40 44.560 44.497 32.282 279 HA3 GLY 40 HA3 GLY 40 44.822 44.628 33.814 280 H VAL 41 H VAL 41 46.541 43.043 32.333 281 HA VAL 41 HA VAL 41 46.274 40.575 33.416 282 HB VAL 41 HB VAL 41 47.303 39.590 31.615 283 HG11 VAL 41 HG11 VAL 41 45.489 39.665 30.059 284 HG12 VAL 41 HG12 VAL 41 44.958 39.543 31.547 285 HG13 VAL 41 HG13 VAL 41 44.932 40.944 30.809 286 HG21 VAL 41 HG21 VAL 41 47.592 40.683 29.538 287 HG22 VAL 41 HG22 VAL 41 47.187 42.052 30.225 288 HG23 VAL 41 HG23 VAL 41 48.519 41.313 30.658 289 H GLU 42 H GLU 42 48.344 39.464 34.050 290 HA GLU 42 HA GLU 42 50.691 40.830 33.932 291 HB2 GLU 42 HB2 GLU 42 49.707 41.310 36.049 292 HB3 GLU 42 HB3 GLU 42 49.768 39.788 36.384 293 HG2 GLU 42 HG2 GLU 42 52.112 39.838 36.372 294 HG3 GLU 42 HG3 GLU 42 52.106 41.326 35.905 295 H MET 43 H MET 43 52.500 39.454 33.434 296 HA MET 43 HA MET 43 51.694 37.019 32.571 297 HB2 MET 43 HB2 MET 43 53.648 38.563 31.215 298 HB3 MET 43 HB3 MET 43 52.904 37.325 30.627 299 HG2 MET 43 HG2 MET 43 51.762 39.880 31.014 300 HG3 MET 43 HG3 MET 43 52.056 39.230 29.628 301 HE1 MET 43 HE1 MET 43 49.357 36.768 28.993 302 HE2 MET 43 HE2 MET 43 50.525 37.609 28.333 303 HE3 MET 43 HE3 MET 43 50.859 36.515 29.428 304 H SER 44 H SER 44 53.037 35.132 32.690 305 HA SER 44 HA SER 44 55.148 35.027 34.291 306 HB2 SER 44 HB2 SER 44 53.659 33.160 33.892 307 HB3 SER 44 HB3 SER 44 54.254 33.036 32.456 308 HG SER 44 HG SER 44 55.740 31.949 33.276 309 H ARG 45 H ARG 45 57.433 34.699 33.747 310 HA ARG 45 HA ARG 45 58.427 36.068 31.722 311 HB2 ARG 45 HB2 ARG 45 59.485 35.823 33.881 312 HB3 ARG 45 HB3 ARG 45 59.812 34.341 33.519 313 HG2 ARG 45 HG2 ARG 45 61.754 35.526 33.187 314 HG3 ARG 45 HG3 ARG 45 61.250 35.115 31.770 315 HD2 ARG 45 HD2 ARG 45 60.335 37.324 31.516 316 HD3 ARG 45 HD3 ARG 45 60.996 37.714 32.874 317 HE ARG 45 HE ARG 45 62.786 36.783 31.089 318 HH11 ARG 45 HH11 ARG 45 64.379 38.052 30.220 319 HH12 ARG 45 HH12 ARG 45 64.331 39.532 30.387 320 HH21 ARG 45 HH21 ARG 45 61.609 39.724 32.066 321 HH22 ARG 45 HH22 ARG 45 62.724 40.502 31.457 322 H ASP 46 H ASP 46 57.920 32.727 31.962 323 HA ASP 46 HA ASP 46 59.002 32.017 29.631 324 HB2 ASP 46 HB2 ASP 46 58.453 29.828 30.302 325 HB3 ASP 46 HB3 ASP 46 59.171 30.541 31.491 326 H LEU 47 H LEU 47 56.198 33.457 30.082 327 HA LEU 47 HA LEU 47 54.242 33.556 29.374 328 HB2 LEU 47 HB2 LEU 47 55.875 33.537 27.167 329 HB3 LEU 47 HB3 LEU 47 54.421 33.119 26.791 330 HG LEU 47 HG LEU 47 54.978 35.522 28.169 331 HD11 LEU 47 HD11 LEU 47 54.641 36.666 26.095 332 HD12 LEU 47 HD12 LEU 47 55.871 35.676 25.973 333 HD13 LEU 47 HD13 LEU 47 54.464 35.269 25.370 334 HD21 LEU 47 HD21 LEU 47 52.770 36.186 27.568 335 HD22 LEU 47 HD22 LEU 47 52.557 34.790 26.850 336 HD23 LEU 47 HD23 LEU 47 52.723 34.854 28.424 337 H ALA 48 H ALA 48 54.806 30.833 30.348 338 HA ALA 48 HA ALA 48 52.978 29.287 29.130 339 HB1 ALA 48 HB1 ALA 48 53.793 27.633 30.630 340 HB2 ALA 48 HB2 ALA 48 55.000 28.297 29.850 341 HB3 ALA 48 HB3 ALA 48 54.687 28.731 31.341 342 H TYR 49 H TYR 49 52.748 31.429 31.655 343 HA TYR 49 HA TYR 49 50.235 30.758 32.365 344 HB2 TYR 49 HB2 TYR 49 52.246 31.154 34.331 345 HB3 TYR 49 HB3 TYR 49 50.745 30.894 34.663 346 HD1 TYR 49 HD1 TYR 49 49.780 28.606 34.258 347 HD2 TYR 49 HD2 TYR 49 53.755 29.298 33.938 348 HE1 TYR 49 HE1 TYR 49 50.165 26.300 34.085 349 HE2 TYR 49 HE2 TYR 49 54.141 27.006 33.739 350 HH TYR 49 HH TYR 49 53.213 24.943 33.544 351 H ALA 50 H ALA 50 48.892 32.569 33.119 352 HA ALA 50 HA ALA 50 49.980 34.963 33.566 353 HB1 ALA 50 HB1 ALA 50 48.511 36.090 32.073 354 HB2 ALA 50 HB2 ALA 50 49.480 35.121 31.278 355 HB3 ALA 50 HB3 ALA 50 47.983 34.689 31.560 356 H LYS 51 H LYS 51 48.929 36.290 35.120 357 HA LYS 51 HA LYS 51 46.600 35.584 36.247 358 HB2 LYS 51 HB2 LYS 51 48.230 37.834 36.830 359 HB3 LYS 51 HB3 LYS 51 46.961 37.459 37.655 360 HG2 LYS 51 HG2 LYS 51 48.074 35.446 38.365 361 HG3 LYS 51 HG3 LYS 51 49.357 35.931 37.625 362 HD2 LYS 51 HD2 LYS 51 48.203 37.385 39.784 363 HD3 LYS 51 HD3 LYS 51 49.410 36.418 39.982 364 HE2 LYS 51 HE2 LYS 51 50.797 37.788 38.702 365 HE3 LYS 51 HE3 LYS 51 49.594 38.691 38.292 366 HZ1 LYS 51 HZ1 LYS 51 50.885 39.624 39.966 367 HZ2 LYS 51 HZ2 LYS 51 49.497 39.509 40.381 368 HZ3 LYS 51 HZ3 LYS 51 50.485 38.565 40.876 369 H VAL 52 H VAL 52 44.577 36.507 35.680 370 HA VAL 52 HA VAL 52 44.403 38.688 34.059 371 HB VAL 52 HB VAL 52 42.549 36.584 34.099 372 HG11 VAL 52 HG11 VAL 52 41.569 37.647 32.193 373 HG12 VAL 52 HG12 VAL 52 41.533 38.619 33.444 374 HG13 VAL 52 HG13 VAL 52 42.631 38.815 32.320 375 HG21 VAL 52 HG21 VAL 52 43.314 35.986 31.918 376 HG22 VAL 52 HG22 VAL 52 44.437 37.098 32.021 377 HG23 VAL 52 HG23 VAL 52 44.485 35.834 32.974 378 H TYR 53 H TYR 53 43.295 40.474 34.938 379 HA TYR 53 HA TYR 53 42.004 40.310 37.338 380 HB2 TYR 53 HB2 TYR 53 43.088 42.641 36.196 381 HB3 TYR 53 HB3 TYR 53 42.614 42.477 37.674 382 HD1 TYR 53 HD1 TYR 53 44.098 40.008 38.432 383 HD2 TYR 53 HD2 TYR 53 45.367 43.308 36.457 384 HE1 TYR 53 HE1 TYR 53 46.285 39.558 39.093 385 HE2 TYR 53 HE2 TYR 53 47.549 42.874 37.129 386 HH TYR 53 HH TYR 53 48.933 41.497 38.309 387 H VAL 54 H VAL 54 39.768 40.717 37.454 388 HA VAL 54 HA VAL 54 38.405 41.450 35.221 389 HB VAL 54 HB VAL 54 37.656 39.270 36.816 390 HG11 VAL 54 HG11 VAL 54 36.120 38.674 35.069 391 HG12 VAL 54 HG12 VAL 54 35.791 40.115 35.639 392 HG13 VAL 54 HG13 VAL 54 36.568 39.965 34.267 393 HG21 VAL 54 HG21 VAL 54 38.317 37.796 35.034 394 HG22 VAL 54 HG22 VAL 54 38.876 39.049 34.241 395 HG23 VAL 54 HG23 VAL 54 39.565 38.595 35.593 396 H THR 55 H THR 55 36.428 42.628 35.615 397 HA THR 55 HA THR 55 35.660 43.279 38.149 398 HB THR 55 HB THR 55 36.943 44.966 37.440 399 HG1 THR 55 HG1 THR 55 35.424 46.594 37.639 400 HG21 THR 55 HG21 THR 55 36.407 46.344 35.584 401 HG22 THR 55 HG22 THR 55 36.775 44.876 35.118 402 HG23 THR 55 HG23 THR 55 35.259 45.327 35.188 403 H PHE 56 H PHE 56 33.455 43.326 38.549 404 HA PHE 56 HA PHE 56 31.758 42.416 36.635 405 HB2 PHE 56 HB2 PHE 56 31.954 41.634 39.357 406 HB3 PHE 56 HB3 PHE 56 30.683 41.282 38.525 407 HD1 PHE 56 HD1 PHE 56 34.221 40.608 38.411 408 HD2 PHE 56 HD2 PHE 56 30.553 39.161 37.523 409 HE1 PHE 56 HE1 PHE 56 35.171 38.565 37.839 410 HE2 PHE 56 HE2 PHE 56 31.501 37.099 36.981 411 HZ PHE 56 HZ PHE 56 33.810 36.787 37.156 412 H LEU 57 H LEU 57 29.629 43.342 36.431 413 HA LEU 57 HA LEU 57 28.660 45.192 38.155 414 HB2 LEU 57 HB2 LEU 57 28.156 45.435 35.913 415 HB3 LEU 57 HB3 LEU 57 27.535 44.005 35.861 416 HG LEU 57 HG LEU 57 26.303 45.787 37.593 417 HD11 LEU 57 HD11 LEU 57 25.004 46.782 35.845 418 HD12 LEU 57 HD12 LEU 57 26.537 47.131 35.652 419 HD13 LEU 57 HD13 LEU 57 25.868 45.992 34.778 420 HD21 LEU 57 HD21 LEU 57 24.295 44.733 36.888 421 HD22 LEU 57 HD22 LEU 57 25.123 43.892 35.832 422 HD23 LEU 57 HD23 LEU 57 25.342 43.652 37.383 423 H ASN 58 H ASN 58 28.606 41.848 38.153 424 HA ASN 58 HA ASN 58 26.400 41.366 39.619 425 HB2 ASN 58 HB2 ASN 58 27.404 39.901 37.921 426 HB3 ASN 58 HB3 ASN 58 28.524 39.588 38.960 427 HD21 ASN 58 HD21 ASN 58 24.964 38.151 39.689 428 HD22 ASN 58 HD22 ASN 58 25.088 39.532 39.144 429 H ASP 59 H ASP 59 28.923 42.799 40.639 430 HA ASP 59 HA ASP 59 29.786 42.097 42.953 431 HB2 ASP 59 HB2 ASP 59 30.727 43.769 41.502 432 HB3 ASP 59 HB3 ASP 59 29.463 44.659 41.705 433 H LYS 60 H LYS 60 26.639 43.051 42.481 434 HA LYS 60 HA LYS 60 25.966 43.953 44.870 435 HB2 LYS 60 HB2 LYS 60 24.697 44.204 42.809 436 HB3 LYS 60 HB3 LYS 60 24.282 42.706 42.945 437 HG2 LYS 60 HG2 LYS 60 22.928 43.140 44.749 438 HG3 LYS 60 HG3 LYS 60 23.572 44.539 44.989 439 HD2 LYS 60 HD2 LYS 60 22.606 45.376 43.018 440 HD3 LYS 60 HD3 LYS 60 22.069 43.961 42.643 441 HE2 LYS 60 HE2 LYS 60 20.300 45.244 43.447 442 HE3 LYS 60 HE3 LYS 60 20.531 44.046 44.418 443 HZ1 LYS 60 HZ1 LYS 60 20.281 45.963 45.590 444 HZ2 LYS 60 HZ2 LYS 60 21.625 45.465 45.824 445 HZ3 LYS 60 HZ3 LYS 60 21.411 46.582 44.919 446 H ASP 61 H ASP 61 26.803 40.790 44.223 447 HA ASP 61 HA ASP 61 26.519 40.179 46.829 448 HB2 ASP 61 HB2 ASP 61 24.647 39.120 45.896 449 HB3 ASP 61 HB3 ASP 61 25.518 38.484 44.769 450 H GLU 62 H GLU 62 28.492 39.556 47.687 451 HA GLU 62 HA GLU 62 30.632 39.092 46.360 452 HB2 GLU 62 HB2 GLU 62 30.032 38.511 49.078 453 HB3 GLU 62 HB3 GLU 62 31.441 38.150 48.519 454 HG2 GLU 62 HG2 GLU 62 31.875 40.072 49.518 455 HG3 GLU 62 HG3 GLU 62 31.669 40.551 48.049 456 H ASP 63 H ASP 63 28.380 36.711 47.487 457 HA ASP 63 HA ASP 63 29.779 34.511 46.957 458 HB2 ASP 63 HB2 ASP 63 28.159 34.531 48.663 459 HB3 ASP 63 HB3 ASP 63 27.037 34.784 47.610 460 H ALA 64 H ALA 64 27.370 36.095 45.032 461 HA ALA 64 HA ALA 64 27.373 34.483 42.988 462 HB1 ALA 64 HB1 ALA 64 26.259 36.278 41.881 463 HB2 ALA 64 HB2 ALA 64 25.621 36.037 43.311 464 HB3 ALA 64 HB3 ALA 64 26.631 37.236 43.086 465 H VAL 65 H VAL 65 29.471 37.275 43.429 466 HA VAL 65 HA VAL 65 30.719 37.129 41.138 467 HB VAL 65 HB VAL 65 31.640 38.319 43.500 468 HG11 VAL 65 HG11 VAL 65 33.310 39.428 42.224 469 HG12 VAL 65 HG12 VAL 65 33.537 37.860 42.178 470 HG13 VAL 65 HG13 VAL 65 32.870 38.600 40.947 471 HG21 VAL 65 HG21 VAL 65 31.078 40.362 42.394 472 HG22 VAL 65 HG22 VAL 65 30.589 39.528 41.138 473 HG23 VAL 65 HG23 VAL 65 29.798 39.436 42.508 474 H LYS 66 H LYS 66 31.642 35.595 44.160 475 HA LYS 66 HA LYS 66 33.815 34.332 43.378 476 HB2 LYS 66 HB2 LYS 66 33.274 34.723 45.644 477 HB3 LYS 66 HB3 LYS 66 32.128 33.670 45.539 478 HG2 LYS 66 HG2 LYS 66 33.851 32.564 46.562 479 HG3 LYS 66 HG3 LYS 66 33.812 31.982 45.116 480 HD2 LYS 66 HD2 LYS 66 35.628 33.317 44.470 481 HD3 LYS 66 HD3 LYS 66 35.605 34.075 45.832 482 HE2 LYS 66 HE2 LYS 66 36.270 31.316 45.630 483 HE3 LYS 66 HE3 LYS 66 37.353 32.434 45.728 484 HZ1 LYS 66 HZ1 LYS 66 37.063 31.609 47.780 485 HZ2 LYS 66 HZ2 LYS 66 36.474 32.937 47.825 486 HZ3 LYS 66 HZ3 LYS 66 35.619 31.765 47.732 487 H ALA 67 H ALA 67 30.548 33.170 43.165 488 HA ALA 67 HA ALA 67 30.989 30.842 42.058 489 HB1 ALA 67 HB1 ALA 67 28.654 30.909 41.615 490 HB2 ALA 67 HB2 ALA 67 28.934 31.336 43.115 491 HB3 ALA 67 HB3 ALA 67 28.630 32.439 42.020 492 H GLY 68 H GLY 68 30.598 33.888 40.472 493 HA2 GLY 68 HA2 GLY 68 30.595 33.181 37.964 494 HA3 GLY 68 HA3 GLY 68 30.911 34.610 38.504 495 H ILE 69 H ILE 69 33.308 34.218 39.909 496 HA ILE 69 HA ILE 69 35.347 33.871 38.328 497 HB ILE 69 HB ILE 69 35.150 33.885 41.095 498 HG12 ILE 69 HG12 ILE 69 34.928 36.007 40.076 499 HG13 ILE 69 HG13 ILE 69 36.096 35.984 41.108 500 HG21 ILE 69 HG21 ILE 69 37.522 33.929 41.324 501 HG22 ILE 69 HG22 ILE 69 37.023 32.548 40.729 502 HG23 ILE 69 HG23 ILE 69 37.653 33.642 39.773 503 HD11 ILE 69 HD11 ILE 69 36.768 37.164 39.197 504 HD12 ILE 69 HD12 ILE 69 37.669 35.870 39.344 505 HD13 ILE 69 HD13 ILE 69 36.482 35.894 38.295 506 H LYS 70 H LYS 70 33.910 31.466 40.439 507 HA LYS 70 HA LYS 70 35.394 29.384 39.888 508 HB2 LYS 70 HB2 LYS 70 33.964 29.523 41.778 509 HB3 LYS 70 HB3 LYS 70 32.723 29.425 40.840 510 HG2 LYS 70 HG2 LYS 70 33.301 27.218 40.248 511 HG3 LYS 70 HG3 LYS 70 34.610 27.311 41.089 512 HD2 LYS 70 HD2 LYS 70 32.024 27.406 42.274 513 HD3 LYS 70 HD3 LYS 70 32.884 26.105 42.238 514 HE2 LYS 70 HE2 LYS 70 34.579 27.277 43.520 515 HE3 LYS 70 HE3 LYS 70 33.579 28.463 43.669 516 HZ1 LYS 70 HZ1 LYS 70 33.494 27.137 45.504 517 HZ2 LYS 70 HZ2 LYS 70 32.198 27.082 44.849 518 HZ3 LYS 70 HZ3 LYS 70 33.129 25.976 44.710 519 H ALA 71 H ALA 71 32.515 30.322 38.178 520 HA ALA 71 HA ALA 71 32.469 28.378 36.392 521 HB1 ALA 71 HB1 ALA 71 30.808 29.731 35.372 522 HB2 ALA 71 HB2 ALA 71 30.527 29.612 36.926 523 HB3 ALA 71 HB3 ALA 71 31.194 30.923 36.340 524 H LEU 72 H LEU 72 34.030 31.436 36.193 525 HA LEU 72 HA LEU 72 34.932 31.354 33.704 526 HB2 LEU 72 HB2 LEU 72 34.566 33.374 34.844 527 HB3 LEU 72 HB3 LEU 72 35.599 32.969 35.940 528 HG LEU 72 HG LEU 72 37.341 33.204 34.413 529 HD11 LEU 72 HD11 LEU 72 37.007 34.141 32.291 530 HD12 LEU 72 HD12 LEU 72 36.273 32.742 32.402 531 HD13 LEU 72 HD13 LEU 72 35.440 34.084 32.519 532 HD21 LEU 72 HD21 LEU 72 37.237 35.590 34.227 533 HD22 LEU 72 HD22 LEU 72 35.684 35.528 34.533 534 HD23 LEU 72 HD23 LEU 72 36.728 35.135 35.657 535 H GLN 73 H GLN 73 36.578 30.412 36.608 536 HA GLN 73 HA GLN 73 38.827 29.583 35.480 537 HB2 GLN 73 HB2 GLN 73 38.530 30.289 37.810 538 HB3 GLN 73 HB3 GLN 73 37.960 28.862 38.071 539 HG2 GLN 73 HG2 GLN 73 40.189 28.763 38.657 540 HG3 GLN 73 HG3 GLN 73 40.057 27.932 37.344 541 HE21 GLN 73 HE21 GLN 73 42.025 28.262 36.234 542 HE22 GLN 73 HE22 GLN 73 42.638 29.594 35.965 543 H GLU 74 H GLU 74 35.946 27.807 36.180 544 HA GLU 74 HA GLU 74 36.575 25.374 35.382 545 HB2 GLU 74 HB2 GLU 74 34.656 25.906 36.667 546 HB3 GLU 74 HB3 GLU 74 34.109 26.798 35.510 547 HG2 GLU 74 HG2 GLU 74 32.829 24.986 35.353 548 HG3 GLU 74 HG3 GLU 74 33.881 24.732 34.230 549 H ALA 75 H ALA 75 35.580 28.047 33.424 550 HA ALA 75 HA ALA 75 35.667 26.745 31.101 551 HB1 ALA 75 HB1 ALA 75 34.989 28.892 30.249 552 HB2 ALA 75 HB2 ALA 75 34.045 28.464 31.447 553 HB3 ALA 75 HB3 ALA 75 35.207 29.513 31.689 554 H SER 76 H SER 76 38.265 27.771 32.751 555 HA SER 76 HA SER 76 39.471 29.407 31.172 556 HB2 SER 76 HB2 SER 76 41.289 29.277 32.596 557 HB3 SER 76 HB3 SER 76 40.022 29.186 33.499 558 HG SER 76 HG SER 76 40.413 27.173 33.867 559 H GLY 77 H GLY 77 39.679 25.993 30.970 560 HA2 GLY 77 HA2 GLY 77 41.808 25.675 29.486 561 HA3 GLY 77 HA3 GLY 77 40.675 24.620 29.674 562 H PHE 78 H PHE 78 38.451 25.816 28.475 563 HA PHE 78 HA PHE 78 38.830 25.821 25.861 564 HB2 PHE 78 HB2 PHE 78 36.576 26.274 27.447 565 HB3 PHE 78 HB3 PHE 78 36.505 26.724 25.955 566 HD1 PHE 78 HD1 PHE 78 37.188 23.750 27.854 567 HD2 PHE 78 HD2 PHE 78 35.847 25.135 24.304 568 HE1 PHE 78 HE1 PHE 78 36.704 21.573 27.186 569 HE2 PHE 78 HE2 PHE 78 35.363 22.957 23.636 570 HZ PHE 78 HZ PHE 78 35.795 21.159 25.074 571 H ILE 79 H ILE 79 38.658 28.578 28.013 572 HA ILE 79 HA ILE 79 38.827 30.494 26.242 573 HB ILE 79 HB ILE 79 39.585 30.574 28.951 574 HG12 ILE 79 HG12 ILE 79 37.195 31.621 27.800 575 HG13 ILE 79 HG13 ILE 79 37.228 30.224 28.493 576 HG21 ILE 79 HG21 ILE 79 39.580 32.936 28.803 577 HG22 ILE 79 HG22 ILE 79 40.691 32.329 27.850 578 HG23 ILE 79 HG23 ILE 79 39.317 32.833 27.245 579 HD11 ILE 79 HD11 ILE 79 36.334 31.808 29.973 580 HD12 ILE 79 HD12 ILE 79 37.692 31.253 30.572 581 HD13 ILE 79 HD13 ILE 79 37.658 32.671 29.868 582 H ARG 80 H ARG 80 41.551 28.879 27.754 583 HA ARG 80 HA ARG 80 43.514 30.070 26.450 584 HB2 ARG 80 HB2 ARG 80 43.963 29.050 28.466 585 HB3 ARG 80 HB3 ARG 80 43.441 27.676 27.946 586 HG2 ARG 80 HG2 ARG 80 45.729 28.690 26.701 587 HG3 ARG 80 HG3 ARG 80 45.913 28.120 28.140 588 HD2 ARG 80 HD2 ARG 80 44.953 26.570 25.957 589 HD3 ARG 80 HD3 ARG 80 46.409 26.471 26.508 590 HE ARG 80 HE ARG 80 45.393 25.668 28.525 591 HH11 ARG 80 HH11 ARG 80 44.068 24.092 29.334 592 HH12 ARG 80 HH12 ARG 80 43.224 23.279 28.415 593 HH21 ARG 80 HH21 ARG 80 43.962 24.775 25.670 594 HH22 ARG 80 HH22 ARG 80 43.161 23.675 26.278 595 H SER 81 H SER 81 41.860 27.181 25.513 596 HA SER 81 HA SER 81 43.170 26.586 23.358 597 HB2 SER 81 HB2 SER 81 41.610 25.078 24.310 598 HB3 SER 81 HB3 SER 81 40.435 26.026 23.919 599 HG SER 81 HG SER 81 40.696 24.449 22.427 600 H LEU 82 H LEU 82 40.405 28.674 23.581 601 HA LEU 82 HA LEU 82 40.196 29.425 21.093 602 HB2 LEU 82 HB2 LEU 82 39.147 30.521 23.503 603 HB3 LEU 82 HB3 LEU 82 38.785 31.158 22.126 604 HG LEU 82 HG LEU 82 38.112 28.485 22.735 605 HD11 LEU 82 HD11 LEU 82 35.914 29.294 23.207 606 HD12 LEU 82 HD12 LEU 82 36.953 29.946 24.207 607 HD13 LEU 82 HD13 LEU 82 36.421 30.774 22.967 608 HD21 LEU 82 HD21 LEU 82 36.602 28.594 20.956 609 HD22 LEU 82 HD22 LEU 82 37.076 30.074 20.646 610 HD23 LEU 82 HD23 LEU 82 38.077 28.863 20.446 611 H LEU 83 H LEU 83 42.000 30.980 23.628 612 HA LEU 83 HA LEU 83 42.796 33.139 22.335 613 HB2 LEU 83 HB2 LEU 83 42.838 32.944 24.709 614 HB3 LEU 83 HB3 LEU 83 43.952 31.858 24.600 615 HG LEU 83 HG LEU 83 45.417 33.496 23.695 616 HD11 LEU 83 HD11 LEU 83 44.871 35.779 23.845 617 HD12 LEU 83 HD12 LEU 83 43.883 35.039 22.853 618 HD13 LEU 83 HD13 LEU 83 43.410 35.393 24.322 619 HD21 LEU 83 HD21 LEU 83 45.834 34.596 25.764 620 HD22 LEU 83 HD22 LEU 83 44.405 34.146 26.276 621 HD23 LEU 83 HD23 LEU 83 45.529 33.062 26.015 622 H GLY 84 H GLY 84 44.434 30.096 22.648 623 HA2 GLY 84 HA2 GLY 84 46.568 30.518 21.232 624 HA3 GLY 84 HA3 GLY 84 45.980 29.114 21.568 625 H LYS 85 H LYS 85 43.471 29.379 20.126 626 HA LYS 85 HA LYS 85 44.015 29.020 17.558 627 HB2 LYS 85 HB2 LYS 85 42.230 27.916 18.747 628 HB3 LYS 85 HB3 LYS 85 41.464 29.275 18.777 629 HG2 LYS 85 HG2 LYS 85 41.173 29.263 16.481 630 HG3 LYS 85 HG3 LYS 85 42.189 28.095 16.298 631 HD2 LYS 85 HD2 LYS 85 40.085 27.161 16.077 632 HD3 LYS 85 HD3 LYS 85 40.658 26.631 17.427 633 HE2 LYS 85 HE2 LYS 85 39.406 28.346 18.580 634 HE3 LYS 85 HE3 LYS 85 38.768 28.754 17.217 635 HZ1 LYS 85 HZ1 LYS 85 37.391 27.340 18.330 636 HZ2 LYS 85 HZ2 LYS 85 37.816 26.685 17.105 637 HZ3 LYS 85 HZ3 LYS 85 38.410 26.305 18.375 638 H ALA 86 H ALA 86 42.597 31.778 19.106 639 HA ALA 86 HA ALA 86 42.055 33.218 16.976 640 HB1 ALA 86 HB1 ALA 86 41.603 34.917 18.588 641 HB2 ALA 86 HB2 ALA 86 40.924 33.557 19.033 642 HB3 ALA 86 HB3 ALA 86 42.280 34.022 19.706 643 H MET 87 H MET 87 44.948 33.259 18.865 644 HA MET 87 HA MET 87 46.168 35.014 17.225 645 HB2 MET 87 HB2 MET 87 47.060 33.962 19.712 646 HB3 MET 87 HB3 MET 87 47.933 34.941 18.869 647 HG2 MET 87 HG2 MET 87 46.139 36.572 19.105 648 HG3 MET 87 HG3 MET 87 45.496 35.608 20.149 649 HE1 MET 87 HE1 MET 87 46.686 38.514 22.262 650 HE2 MET 87 HE2 MET 87 46.125 38.581 20.782 651 HE3 MET 87 HE3 MET 87 45.421 37.653 21.855 652 H ARG 88 H ARG 88 45.832 31.820 16.900 653 HA ARG 88 HA ARG 88 46.891 30.115 16.169 654 HB2 ARG 88 HB2 ARG 88 47.888 31.979 14.286 655 HB3 ARG 88 HB3 ARG 88 47.854 30.437 14.057 656 HG2 ARG 88 HG2 ARG 88 45.486 30.476 14.018 657 HG3 ARG 88 HG3 ARG 88 45.494 32.009 14.303 658 HD2 ARG 88 HD2 ARG 88 45.151 31.873 12.058 659 HD3 ARG 88 HD3 ARG 88 46.644 32.303 12.183 660 HE ARG 88 HE ARG 88 45.795 29.858 11.366 661 HH11 ARG 88 HH11 ARG 88 47.028 28.490 10.254 662 HH12 ARG 88 HH12 ARG 88 48.487 28.734 10.083 663 HH21 ARG 88 HH21 ARG 88 48.671 31.517 11.707 664 HH22 ARG 88 HH22 ARG 88 49.455 30.512 10.937 665 H LEU 89 H LEU 89 48.191 30.588 18.447 666 HA LEU 89 HA LEU 89 50.604 31.777 18.166 667 HB2 LEU 89 HB2 LEU 89 48.793 32.276 19.824 668 HB3 LEU 89 HB3 LEU 89 49.369 31.059 20.611 669 HG LEU 89 HG LEU 89 51.371 32.174 20.952 670 HD11 LEU 89 HD11 LEU 89 51.684 34.431 20.325 671 HD12 LEU 89 HD12 LEU 89 51.502 33.528 19.038 672 HD13 LEU 89 HD13 LEU 89 50.295 34.407 19.564 673 HD21 LEU 89 HD21 LEU 89 50.509 33.912 22.393 674 HD22 LEU 89 HD22 LEU 89 49.120 33.822 21.638 675 HD23 LEU 89 HD23 LEU 89 49.615 32.612 22.531 676 H ARG 90 H ARG 90 52.652 31.039 19.146 677 HA ARG 90 HA ARG 90 53.067 28.381 19.011 678 HB2 ARG 90 HB2 ARG 90 54.636 29.782 17.956 679 HB3 ARG 90 HB3 ARG 90 55.016 30.402 19.336 680 HG2 ARG 90 HG2 ARG 90 55.886 28.317 20.053 681 HG3 ARG 90 HG3 ARG 90 55.464 27.663 18.702 682 HD2 ARG 90 HD2 ARG 90 57.034 28.917 17.522 683 HD3 ARG 90 HD3 ARG 90 57.343 29.794 18.773 684 HE ARG 90 HE ARG 90 57.947 27.278 19.325 685 HH11 ARG 90 HH11 ARG 90 60.039 26.520 19.459 686 HH12 ARG 90 HH12 ARG 90 61.152 27.279 18.824 687 HH21 ARG 90 HH21 ARG 90 59.439 29.675 17.576 688 HH22 ARG 90 HH22 ARG 90 60.807 29.105 17.734 689 H ILE 91 H ILE 91 53.427 30.685 21.613 690 HA ILE 91 HA ILE 91 52.908 28.730 23.441 691 HB ILE 91 HB ILE 91 54.184 29.907 25.030 692 HG12 ILE 91 HG12 ILE 91 55.314 31.392 22.928 693 HG13 ILE 91 HG13 ILE 91 54.404 31.993 24.043 694 HG21 ILE 91 HG21 ILE 91 56.236 28.926 24.272 695 HG22 ILE 91 HG22 ILE 91 55.029 27.931 24.027 696 HG23 ILE 91 HG23 ILE 91 55.611 28.782 22.825 697 HD11 ILE 91 HD11 ILE 91 56.656 32.445 24.547 698 HD12 ILE 91 HD12 ILE 91 56.056 31.505 25.672 699 HD13 ILE 91 HD13 ILE 91 56.979 30.894 24.540 700 H VAL 92 H VAL 92 50.865 28.962 24.278 701 HA VAL 92 HA VAL 92 49.772 31.393 24.802 702 HB VAL 92 HB VAL 92 48.563 30.200 23.288 703 HG11 VAL 92 HG11 VAL 92 47.245 28.339 23.847 704 HG12 VAL 92 HG12 VAL 92 48.792 28.002 23.894 705 HG13 VAL 92 HG13 VAL 92 47.995 28.251 25.239 706 HG21 VAL 92 HG21 VAL 92 46.410 30.534 24.313 707 HG22 VAL 92 HG22 VAL 92 47.131 30.664 25.716 708 HG23 VAL 92 HG23 VAL 92 47.371 31.759 24.598 709 HA PRO 93 HA PRO 93 50.333 30.452 28.989 710 HB2 PRO 93 HB2 PRO 93 49.427 32.602 30.143 711 HB3 PRO 93 HB3 PRO 93 50.864 32.571 29.538 712 HG2 PRO 93 HG2 PRO 93 48.571 33.717 28.370 713 HG3 PRO 93 HG3 PRO 93 50.034 34.245 28.260 714 HD2 PRO 93 HD2 PRO 93 48.968 32.890 26.304 715 HD3 PRO 93 HD3 PRO 93 50.514 32.898 26.510 716 H GLU 94 H GLU 94 49.215 29.328 30.551 717 HA GLU 94 HA GLU 94 46.551 28.944 30.486 718 HB2 GLU 94 HB2 GLU 94 48.090 27.188 30.962 719 HB3 GLU 94 HB3 GLU 94 48.441 27.901 32.305 720 HG2 GLU 94 HG2 GLU 94 46.969 26.279 32.899 721 HG3 GLU 94 HG3 GLU 94 46.138 27.597 32.974 722 H LEU 95 H LEU 95 44.990 30.054 31.683 723 HA LEU 95 HA LEU 95 45.800 32.362 32.810 724 HB2 LEU 95 HB2 LEU 95 43.209 31.794 31.784 725 HB3 LEU 95 HB3 LEU 95 43.738 33.220 32.129 726 HG LEU 95 HG LEU 95 44.678 31.680 29.957 727 HD11 LEU 95 HD11 LEU 95 43.543 33.255 28.557 728 HD12 LEU 95 HD12 LEU 95 42.512 32.525 29.512 729 HD13 LEU 95 HD13 LEU 95 43.006 33.991 29.852 730 HD21 LEU 95 HD21 LEU 95 45.852 33.570 29.197 731 HD22 LEU 95 HD22 LEU 95 45.412 34.354 30.501 732 HD23 LEU 95 HD23 LEU 95 46.385 33.109 30.616 733 H THR 96 H THR 96 45.385 32.933 34.960 734 HA THR 96 HA THR 96 43.478 31.632 36.386 735 HB THR 96 HB THR 96 45.766 32.785 37.497 736 HG1 THR 96 HG1 THR 96 46.303 30.666 37.933 737 HG21 THR 96 HG21 THR 96 45.101 31.783 39.562 738 HG22 THR 96 HG22 THR 96 44.000 32.811 39.070 739 HG23 THR 96 HG23 THR 96 43.781 31.256 38.864 740 H PHE 97 H PHE 97 41.714 32.921 37.037 741 HA PHE 97 HA PHE 97 41.733 35.565 36.535 742 HB2 PHE 97 HB2 PHE 97 39.511 33.803 36.741 743 HB3 PHE 97 HB3 PHE 97 39.366 35.317 36.399 744 HD1 PHE 97 HD1 PHE 97 39.999 36.140 34.141 745 HD2 PHE 97 HD2 PHE 97 40.197 32.199 34.996 746 HE1 PHE 97 HE1 PHE 97 40.177 35.662 31.865 747 HE2 PHE 97 HE2 PHE 97 40.407 31.714 32.722 748 HZ PHE 97 HZ PHE 97 40.398 33.444 31.153 749 H PHE 98 H PHE 98 41.238 37.190 37.976 750 HA PHE 98 HA PHE 98 40.636 36.695 40.562 751 HB2 PHE 98 HB2 PHE 98 42.626 38.539 39.694 752 HB3 PHE 98 HB3 PHE 98 42.188 38.408 41.184 753 HD1 PHE 98 HD1 PHE 98 43.313 36.873 42.640 754 HD2 PHE 98 HD2 PHE 98 43.965 36.666 38.649 755 HE1 PHE 98 HE1 PHE 98 45.033 35.338 43.007 756 HE2 PHE 98 HE2 PHE 98 45.678 35.111 39.013 757 HZ PHE 98 HZ PHE 98 46.218 34.453 41.188 758 H TYR 99 H TYR 99 39.381 38.426 41.660 759 HA TYR 99 HA TYR 99 38.064 40.120 40.068 760 HB2 TYR 99 HB2 TYR 99 36.441 40.342 41.555 761 HB3 TYR 99 HB3 TYR 99 36.782 38.822 41.525 762 HD1 TYR 99 HD1 TYR 99 35.273 40.315 43.616 763 HD2 TYR 99 HD2 TYR 99 39.131 39.099 43.557 764 HE1 TYR 99 HE1 TYR 99 35.237 40.087 45.933 765 HE2 TYR 99 HE2 TYR 99 39.090 38.845 45.873 766 HH TYR 99 HH TYR 99 37.835 38.929 47.755 767 H ASP 100 H ASP 100 38.089 42.333 40.049 768 HA ASP 100 HA ASP 100 39.599 43.906 41.703 769 HB2 ASP 100 HB2 ASP 100 40.878 43.636 39.816 770 HB3 ASP 100 HB3 ASP 100 39.645 43.815 38.879 Start of MODEL 18 1 HA PRO 8 HA PRO 8 56.050 43.019 25.410 2 HB2 PRO 8 HB2 PRO 8 54.858 40.906 26.242 3 HB3 PRO 8 HB3 PRO 8 56.372 40.790 25.887 4 HG2 PRO 8 HG2 PRO 8 55.284 41.127 28.496 5 HG3 PRO 8 HG3 PRO 8 56.408 40.124 28.093 6 HD2 PRO 8 HD2 PRO 8 57.054 42.408 29.127 7 HD3 PRO 8 HD3 PRO 8 58.015 41.729 28.104 8 H GLN 9 H GLN 9 55.182 45.221 27.012 9 HA GLN 9 HA GLN 9 52.729 45.029 27.881 10 HB2 GLN 9 HB2 GLN 9 54.138 46.714 28.663 11 HB3 GLN 9 HB3 GLN 9 54.286 47.312 27.230 12 HG2 GLN 9 HG2 GLN 9 51.744 47.353 28.457 13 HG3 GLN 9 HG3 GLN 9 52.773 48.464 28.829 14 HE21 GLN 9 HE21 GLN 9 50.401 49.215 27.690 15 HE22 GLN 9 HE22 GLN 9 50.620 49.793 26.335 16 H ARG 10 H ARG 10 53.588 45.872 24.593 17 HA ARG 10 HA ARG 10 51.154 46.454 23.805 18 HB2 ARG 10 HB2 ARG 10 53.312 45.659 22.160 19 HB3 ARG 10 HB3 ARG 10 51.967 46.203 21.588 20 HG2 ARG 10 HG2 ARG 10 52.444 48.261 22.875 21 HG3 ARG 10 HG3 ARG 10 53.893 47.707 23.026 22 HD2 ARG 10 HD2 ARG 10 52.696 48.552 20.606 23 HD3 ARG 10 HD3 ARG 10 53.944 49.201 21.279 24 HE ARG 10 HE ARG 10 55.223 47.530 20.481 25 HH11 ARG 10 HH11 ARG 10 55.787 46.109 18.919 26 HH12 ARG 10 HH12 ARG 10 54.757 45.534 18.012 27 HH21 ARG 10 HH21 ARG 10 52.181 46.998 19.220 28 HH22 ARG 10 HH22 ARG 10 52.665 46.046 18.181 29 H VAL 11 H VAL 11 52.670 43.353 23.904 30 HA VAL 11 HA VAL 11 50.745 41.893 22.900 31 HB VAL 11 HB VAL 11 52.711 40.952 24.662 32 HG11 VAL 11 HG11 VAL 11 52.373 38.813 23.645 33 HG12 VAL 11 HG12 VAL 11 51.033 39.328 24.313 34 HG13 VAL 11 HG13 VAL 11 51.231 39.442 22.745 35 HG21 VAL 11 HG21 VAL 11 54.015 40.326 22.757 36 HG22 VAL 11 HG22 VAL 11 52.942 41.015 21.819 37 HG23 VAL 11 HG23 VAL 11 53.815 41.897 22.802 38 H ALA 12 H ALA 12 51.303 42.834 26.223 39 HA ALA 12 HA ALA 12 49.441 41.498 27.443 40 HB1 ALA 12 HB1 ALA 12 49.753 43.056 29.196 41 HB2 ALA 12 HB2 ALA 12 51.154 42.560 28.651 42 HB3 ALA 12 HB3 ALA 12 50.593 43.977 28.219 43 H GLN 13 H GLN 13 49.070 44.633 25.948 44 HA GLN 13 HA GLN 13 46.542 45.055 26.391 45 HB2 GLN 13 HB2 GLN 13 48.315 46.091 24.435 46 HB3 GLN 13 HB3 GLN 13 46.822 46.542 24.435 47 HG2 GLN 13 HG2 GLN 13 48.409 46.938 26.743 48 HG3 GLN 13 HG3 GLN 13 48.422 48.005 25.605 49 HE21 GLN 13 HE21 GLN 13 47.635 48.900 27.991 50 HE22 GLN 13 HE22 GLN 13 46.178 49.202 28.033 51 H GLU 14 H GLU 14 47.893 43.403 23.610 52 HA GLU 14 HA GLU 14 45.670 42.885 22.351 53 HB2 GLU 14 HB2 GLU 14 48.207 41.632 22.126 54 HB3 GLU 14 HB3 GLU 14 47.015 41.179 21.227 55 HG2 GLU 14 HG2 GLU 14 46.891 43.493 20.440 56 HG3 GLU 14 HG3 GLU 14 48.261 43.725 21.148 57 H MET 15 H MET 15 47.213 40.983 24.796 58 HA MET 15 HA MET 15 45.632 38.896 24.859 59 HB2 MET 15 HB2 MET 15 47.511 39.857 26.755 60 HB3 MET 15 HB3 MET 15 46.698 38.556 27.034 61 HG2 MET 15 HG2 MET 15 48.323 38.752 24.730 62 HG3 MET 15 HG3 MET 15 48.931 38.254 26.077 63 HE1 MET 15 HE1 MET 15 49.018 35.100 24.053 64 HE2 MET 15 HE2 MET 15 49.303 36.578 23.564 65 HE3 MET 15 HE3 MET 15 49.869 36.082 24.957 66 H GLN 16 H GLN 16 45.457 41.779 26.903 67 HA GLN 16 HA GLN 16 43.446 41.276 28.335 68 HB2 GLN 16 HB2 GLN 16 44.274 43.751 27.271 69 HB3 GLN 16 HB3 GLN 16 42.938 43.712 28.075 70 HG2 GLN 16 HG2 GLN 16 44.185 43.026 30.013 71 HG3 GLN 16 HG3 GLN 16 45.498 43.216 29.193 72 HE21 GLN 16 HE21 GLN 16 46.370 45.076 30.282 73 HE22 GLN 16 HE22 GLN 16 45.678 46.394 30.346 74 H LYS 17 H LYS 17 43.274 42.669 25.120 75 HA LYS 17 HA LYS 17 40.674 43.010 24.974 76 HB2 LYS 17 HB2 LYS 17 42.241 44.326 23.745 77 HB3 LYS 17 HB3 LYS 17 42.592 43.080 22.874 78 HG2 LYS 17 HG2 LYS 17 41.152 44.461 21.659 79 HG3 LYS 17 HG3 LYS 17 40.434 43.104 21.925 80 HD2 LYS 17 HD2 LYS 17 39.192 44.083 23.682 81 HD3 LYS 17 HD3 LYS 17 39.940 45.435 23.476 82 HE2 LYS 17 HE2 LYS 17 38.960 45.711 21.358 83 HE3 LYS 17 HE3 LYS 17 38.312 44.294 21.437 84 HZ1 LYS 17 HZ1 LYS 17 36.782 45.882 21.989 85 HZ2 LYS 17 HZ2 LYS 17 37.004 45.047 23.157 86 HZ3 LYS 17 HZ3 LYS 17 37.608 46.367 23.082 87 H GLU 18 H GLU 18 42.484 40.367 23.595 88 HA GLU 18 HA GLU 18 40.418 39.192 22.454 89 HB2 GLU 18 HB2 GLU 18 42.789 38.949 21.839 90 HB3 GLU 18 HB3 GLU 18 42.867 37.895 22.985 91 HG2 GLU 18 HG2 GLU 18 42.497 36.587 21.199 92 HG3 GLU 18 HG3 GLU 18 41.061 36.711 21.795 93 H ILE 19 H ILE 19 41.859 38.575 25.566 94 HA ILE 19 HA ILE 19 40.360 36.555 26.323 95 HB ILE 19 HB ILE 19 41.809 38.327 27.948 96 HG12 ILE 19 HG12 ILE 19 42.499 35.646 27.273 97 HG13 ILE 19 HG13 ILE 19 43.093 36.864 26.501 98 HG21 ILE 19 HG21 ILE 19 41.542 36.788 29.739 99 HG22 ILE 19 HG22 ILE 19 40.133 37.354 29.287 100 HG23 ILE 19 HG23 ILE 19 40.589 35.908 28.829 101 HD11 ILE 19 HD11 ILE 19 44.670 36.094 28.072 102 HD12 ILE 19 HD12 ILE 19 44.236 37.567 28.462 103 HD13 ILE 19 HD13 ILE 19 43.633 36.330 29.246 104 H ALA 20 H ALA 20 39.811 39.967 26.817 105 HA ALA 20 HA ALA 20 37.579 39.928 28.148 106 HB1 ALA 20 HB1 ALA 20 37.389 42.195 27.454 107 HB2 ALA 20 HB2 ALA 20 38.868 41.902 27.937 108 HB3 ALA 20 HB3 ALA 20 38.538 41.959 26.390 109 H LEU 21 H LEU 21 37.900 39.770 24.691 110 HA LEU 21 HA LEU 21 35.356 39.852 24.024 111 HB2 LEU 21 HB2 LEU 21 37.082 40.359 22.499 112 HB3 LEU 21 HB3 LEU 21 37.586 38.885 22.562 113 HG LEU 21 HG LEU 21 35.585 38.165 21.555 114 HD11 LEU 21 HD11 LEU 21 34.100 39.707 20.575 115 HD12 LEU 21 HD12 LEU 21 34.120 39.886 22.149 116 HD13 LEU 21 HD13 LEU 21 34.913 40.899 21.226 117 HD21 LEU 21 HD21 LEU 21 36.105 39.013 19.373 118 HD22 LEU 21 HD22 LEU 21 36.971 40.158 20.042 119 HD23 LEU 21 HD23 LEU 21 37.441 38.649 20.142 120 H ILE 22 H ILE 22 37.314 36.986 24.520 121 HA ILE 22 HA ILE 22 35.448 35.179 24.042 122 HB ILE 22 HB ILE 22 37.838 34.848 25.499 123 HG12 ILE 22 HG12 ILE 22 37.568 34.033 22.792 124 HG13 ILE 22 HG13 ILE 22 38.072 35.473 23.116 125 HG21 ILE 22 HG21 ILE 22 37.559 32.504 25.067 126 HG22 ILE 22 HG22 ILE 22 36.329 33.051 25.902 127 HG23 ILE 22 HG23 ILE 22 36.187 32.816 24.342 128 HD11 ILE 22 HD11 ILE 22 39.918 34.070 22.717 129 HD12 ILE 22 HD12 ILE 22 39.967 34.573 24.218 130 HD13 ILE 22 HD13 ILE 22 39.455 33.111 23.889 131 H LEU 23 H LEU 23 36.307 36.707 27.013 132 HA LEU 23 HA LEU 23 34.681 35.598 28.764 133 HB2 LEU 23 HB2 LEU 23 36.716 36.792 29.226 134 HB3 LEU 23 HB3 LEU 23 35.955 38.116 28.906 135 HG LEU 23 HG LEU 23 34.914 36.573 30.949 136 HD11 LEU 23 HD11 LEU 23 36.449 37.522 32.564 137 HD12 LEU 23 HD12 LEU 23 37.241 36.634 31.517 138 HD13 LEU 23 HD13 LEU 23 37.236 38.212 31.375 139 HD21 LEU 23 HD21 LEU 23 34.434 38.659 31.991 140 HD22 LEU 23 HD22 LEU 23 35.185 39.403 30.811 141 HD23 LEU 23 HD23 LEU 23 33.837 38.621 30.523 142 H GLN 24 H GLN 24 33.884 38.150 26.608 143 HA GLN 24 HA GLN 24 31.463 38.534 27.547 144 HB2 GLN 24 HB2 GLN 24 32.628 39.340 25.070 145 HB3 GLN 24 HB3 GLN 24 31.134 39.675 25.368 146 HG2 GLN 24 HG2 GLN 24 31.861 41.030 27.211 147 HG3 GLN 24 HG3 GLN 24 33.336 40.770 26.777 148 HE21 GLN 24 HE21 GLN 24 30.521 42.375 25.844 149 HE22 GLN 24 HE22 GLN 24 31.072 43.228 24.754 150 H ARG 25 H ARG 25 32.577 36.461 24.959 151 HA ARG 25 HA ARG 25 30.102 36.118 23.954 152 HB2 ARG 25 HB2 ARG 25 32.582 35.786 22.588 153 HB3 ARG 25 HB3 ARG 25 31.202 35.606 21.885 154 HG2 ARG 25 HG2 ARG 25 32.140 38.094 22.877 155 HG3 ARG 25 HG3 ARG 25 32.176 37.702 21.367 156 HD2 ARG 25 HD2 ARG 25 29.732 38.045 22.768 157 HD3 ARG 25 HD3 ARG 25 30.374 39.194 21.929 158 HE ARG 25 HE ARG 25 30.036 37.125 20.323 159 HH11 ARG 25 HH11 ARG 25 28.466 36.989 18.780 160 HH12 ARG 25 HH12 ARG 25 27.216 37.790 18.902 161 HH21 ARG 25 HH21 ARG 25 27.921 39.327 21.630 162 HH22 ARG 25 HH22 ARG 25 26.896 39.152 20.562 163 H GLU 26 H GLU 26 32.595 33.990 24.933 164 HA GLU 26 HA GLU 26 31.220 31.724 24.340 165 HB2 GLU 26 HB2 GLU 26 33.553 31.699 24.119 166 HB3 GLU 26 HB3 GLU 26 33.714 31.998 25.641 167 HG2 GLU 26 HG2 GLU 26 34.074 29.780 25.457 168 HG3 GLU 26 HG3 GLU 26 32.657 29.898 26.094 169 H ILE 27 H ILE 27 32.370 33.075 27.384 170 HA ILE 27 HA ILE 27 30.798 31.609 29.001 171 HB ILE 27 HB ILE 27 32.469 33.753 29.616 172 HG12 ILE 27 HG12 ILE 27 32.899 31.084 30.356 173 HG13 ILE 27 HG13 ILE 27 33.573 31.735 29.109 174 HG21 ILE 27 HG21 ILE 27 32.034 33.366 31.896 175 HG22 ILE 27 HG22 ILE 27 30.723 33.836 31.140 176 HG23 ILE 27 HG23 ILE 27 30.928 32.306 31.491 177 HD11 ILE 27 HD11 ILE 27 35.069 31.731 30.888 178 HD12 ILE 27 HD12 ILE 27 34.731 33.228 30.497 179 HD13 ILE 27 HD13 ILE 27 34.048 32.566 31.764 180 H LYS 28 H LYS 28 28.960 32.564 30.402 181 HA LYS 28 HA LYS 28 27.276 33.961 28.822 182 HB2 LYS 28 HB2 LYS 28 26.493 33.330 31.427 183 HB3 LYS 28 HB3 LYS 28 25.632 33.235 30.130 184 HG2 LYS 28 HG2 LYS 28 26.544 31.197 29.580 185 HG3 LYS 28 HG3 LYS 28 27.636 31.326 30.687 186 HD2 LYS 28 HD2 LYS 28 25.894 31.191 32.326 187 HD3 LYS 28 HD3 LYS 28 24.891 30.890 31.170 188 HE2 LYS 28 HE2 LYS 28 25.547 28.890 32.181 189 HE3 LYS 28 HE3 LYS 28 25.989 28.889 30.686 190 HZ1 LYS 28 HZ1 LYS 28 27.642 28.267 32.272 191 HZ2 LYS 28 HZ2 LYS 28 28.087 29.210 31.259 192 HZ3 LYS 28 HZ3 LYS 28 27.765 29.678 32.596 193 H ASP 29 H ASP 29 28.131 36.186 28.761 194 HA ASP 29 HA ASP 29 28.672 37.641 30.896 195 HB2 ASP 29 HB2 ASP 29 29.269 38.110 28.533 196 HB3 ASP 29 HB3 ASP 29 27.951 38.942 28.543 197 HA PRO 30 HA PRO 30 24.263 39.368 30.538 198 HB2 PRO 30 HB2 PRO 30 22.834 36.993 29.852 199 HB3 PRO 30 HB3 PRO 30 22.461 38.439 29.404 200 HG2 PRO 30 HG2 PRO 30 23.573 36.976 27.684 201 HG3 PRO 30 HG3 PRO 30 24.045 38.461 27.750 202 HD2 PRO 30 HD2 PRO 30 25.382 36.220 28.843 203 HD3 PRO 30 HD3 PRO 30 26.044 37.429 28.113 204 H ARG 31 H ARG 31 24.741 36.196 31.806 205 HA ARG 31 HA ARG 31 23.121 36.186 33.891 206 HB2 ARG 31 HB2 ARG 31 23.984 34.187 33.466 207 HB3 ARG 31 HB3 ARG 31 25.416 34.750 33.209 208 HG2 ARG 31 HG2 ARG 31 25.468 35.136 35.663 209 HG3 ARG 31 HG3 ARG 31 24.287 34.117 35.705 210 HD2 ARG 31 HD2 ARG 31 26.343 32.995 36.007 211 HD3 ARG 31 HD3 ARG 31 25.618 32.460 34.735 212 HE ARG 31 HE ARG 31 27.250 34.391 33.987 213 HH11 ARG 31 HH11 ARG 31 29.231 33.988 32.974 214 HH12 ARG 31 HH12 ARG 31 29.872 32.649 33.093 215 HH21 ARG 31 HH21 ARG 31 27.542 31.255 34.961 216 HH22 ARG 31 HH22 ARG 31 28.850 30.995 34.295 217 H LEU 32 H LEU 32 26.286 37.607 33.603 218 HA LEU 32 HA LEU 32 26.378 38.441 36.207 219 HB2 LEU 32 HB2 LEU 32 28.407 38.618 34.237 220 HB3 LEU 32 HB3 LEU 32 28.625 38.923 35.751 221 HG LEU 32 HG LEU 32 27.999 36.341 34.814 222 HD11 LEU 32 HD11 LEU 32 30.252 35.758 35.089 223 HD12 LEU 32 HD12 LEU 32 30.099 36.887 33.989 224 HD13 LEU 32 HD13 LEU 32 30.590 37.263 35.447 225 HD21 LEU 32 HD21 LEU 32 28.644 35.585 36.939 226 HD22 LEU 32 HD22 LEU 32 28.904 37.083 37.384 227 HD23 LEU 32 HD23 LEU 32 27.433 36.598 37.054 228 H GLY 33 H GLY 33 24.851 39.782 33.756 229 HA2 GLY 33 HA2 GLY 33 23.912 41.833 33.952 230 HA3 GLY 33 HA3 GLY 33 25.224 42.354 34.615 231 H MET 34 H MET 34 25.750 40.452 31.889 232 HA MET 34 HA MET 34 26.863 40.842 30.077 233 HB2 MET 34 HB2 MET 34 24.442 41.220 29.626 234 HB3 MET 34 HB3 MET 34 24.869 42.705 29.410 235 HG2 MET 34 HG2 MET 34 26.319 42.058 27.673 236 HG3 MET 34 HG3 MET 34 25.967 40.559 27.915 237 HE1 MET 34 HE1 MET 34 24.495 41.038 24.510 238 HE2 MET 34 HE2 MET 34 25.853 41.620 25.081 239 HE3 MET 34 HE3 MET 34 25.436 40.125 25.398 240 H MET 35 H MET 35 28.126 42.276 32.107 241 HA MET 35 HA MET 35 29.505 44.232 30.902 242 HB2 MET 35 HB2 MET 35 27.430 45.196 31.853 243 HB3 MET 35 HB3 MET 35 28.098 44.970 33.245 244 HG2 MET 35 HG2 MET 35 28.511 47.146 32.727 245 HG3 MET 35 HG3 MET 35 29.881 46.416 32.574 246 HE1 MET 35 HE1 MET 35 27.344 47.902 29.250 247 HE2 MET 35 HE2 MET 35 26.890 46.720 30.202 248 HE3 MET 35 HE3 MET 35 27.084 48.178 30.789 249 H THR 36 H THR 36 30.373 41.705 31.945 250 HA THR 36 HA THR 36 32.123 42.288 33.910 251 HB THR 36 HB THR 36 32.166 39.819 32.645 252 HG1 THR 36 HG1 THR 36 30.123 39.844 33.133 253 HG21 THR 36 HG21 THR 36 32.729 38.985 34.787 254 HG22 THR 36 HG22 THR 36 33.739 40.124 34.347 255 HG23 THR 36 HG23 THR 36 32.580 40.447 35.378 256 H THR 37 H THR 37 34.469 42.565 33.541 257 HA THR 37 HA THR 37 35.411 42.458 31.041 258 HB THR 37 HB THR 37 35.739 44.953 32.263 259 HG1 THR 37 HG1 THR 37 33.942 45.690 31.181 260 HG21 THR 37 HG21 THR 37 35.924 45.774 30.012 261 HG22 THR 37 HG22 THR 37 36.968 44.608 30.260 262 HG23 THR 37 HG23 THR 37 35.623 44.314 29.477 263 H VAL 38 H VAL 38 37.798 42.606 30.814 264 HA VAL 38 HA VAL 38 39.267 41.897 32.949 265 HB VAL 38 HB VAL 38 40.026 42.064 30.259 266 HG11 VAL 38 HG11 VAL 38 42.010 40.885 30.803 267 HG12 VAL 38 HG12 VAL 38 41.963 42.283 31.543 268 HG13 VAL 38 HG13 VAL 38 41.612 40.957 32.334 269 HG21 VAL 38 HG21 VAL 38 40.015 39.663 30.265 270 HG22 VAL 38 HG22 VAL 38 39.506 39.690 31.763 271 HG23 VAL 38 HG23 VAL 38 38.575 40.226 30.600 272 H SER 39 H SER 39 40.228 43.552 34.230 273 HA SER 39 HA SER 39 40.715 45.990 33.246 274 HB2 SER 39 HB2 SER 39 40.921 46.702 35.475 275 HB3 SER 39 HB3 SER 39 39.610 45.868 35.346 276 HG SER 39 HG SER 39 41.149 45.336 37.026 277 H GLY 40 H GLY 40 42.725 43.390 33.684 278 HA2 GLY 40 HA2 GLY 40 44.837 44.374 32.588 279 HA3 GLY 40 HA3 GLY 40 45.077 44.444 34.127 280 H VAL 41 H VAL 41 46.722 42.848 32.532 281 HA VAL 41 HA VAL 41 46.418 40.388 33.587 282 HB VAL 41 HB VAL 41 47.415 39.389 31.788 283 HG11 VAL 41 HG11 VAL 41 45.584 39.523 30.226 284 HG12 VAL 41 HG12 VAL 41 45.052 39.411 31.713 285 HG13 VAL 41 HG13 VAL 41 45.069 40.816 30.983 286 HG21 VAL 41 HG21 VAL 41 47.721 40.478 29.709 287 HG22 VAL 41 HG22 VAL 41 47.354 41.855 30.400 288 HG23 VAL 41 HG23 VAL 41 48.670 41.082 30.824 289 H GLU 42 H GLU 42 48.500 39.220 34.130 290 HA GLU 42 HA GLU 42 50.872 40.514 33.831 291 HB2 GLU 42 HB2 GLU 42 50.182 40.814 36.100 292 HB3 GLU 42 HB3 GLU 42 50.163 39.265 36.278 293 HG2 GLU 42 HG2 GLU 42 52.546 39.273 35.696 294 HG3 GLU 42 HG3 GLU 42 52.499 40.828 35.807 295 H MET 43 H MET 43 52.330 39.201 32.689 296 HA MET 43 HA MET 43 51.747 36.584 32.339 297 HB2 MET 43 HB2 MET 43 53.028 38.289 30.434 298 HB3 MET 43 HB3 MET 43 52.584 36.826 30.128 299 HG2 MET 43 HG2 MET 43 50.298 37.532 30.389 300 HG3 MET 43 HG3 MET 43 50.809 38.999 30.520 301 HE1 MET 43 HE1 MET 43 52.280 39.723 27.042 302 HE2 MET 43 HE2 MET 43 52.052 40.346 28.480 303 HE3 MET 43 HE3 MET 43 53.069 39.148 28.289 304 H SER 44 H SER 44 53.364 34.943 32.472 305 HA SER 44 HA SER 44 55.764 35.407 33.466 306 HB2 SER 44 HB2 SER 44 54.611 33.320 33.806 307 HB3 SER 44 HB3 SER 44 54.815 32.981 32.298 308 HG SER 44 HG SER 44 56.657 32.302 32.799 309 H ARG 45 H ARG 45 57.871 35.243 32.393 310 HA ARG 45 HA ARG 45 58.148 36.341 30.031 311 HB2 ARG 45 HB2 ARG 45 59.708 36.469 31.898 312 HB3 ARG 45 HB3 ARG 45 60.183 35.033 31.518 313 HG2 ARG 45 HG2 ARG 45 60.907 35.874 29.381 314 HG3 ARG 45 HG3 ARG 45 60.504 37.311 29.835 315 HD2 ARG 45 HD2 ARG 45 62.072 36.901 31.747 316 HD3 ARG 45 HD3 ARG 45 62.656 35.771 30.845 317 HE ARG 45 HE ARG 45 62.928 38.434 30.368 318 HH11 ARG 45 HH11 ARG 45 64.327 39.208 28.863 319 HH12 ARG 45 HH12 ARG 45 65.043 38.276 27.950 320 HH21 ARG 45 HH21 ARG 45 63.780 35.525 28.983 321 HH22 ARG 45 HH22 ARG 45 64.728 36.150 28.018 322 H ASP 46 H ASP 46 58.379 33.059 30.862 323 HA ASP 46 HA ASP 46 58.999 32.069 28.477 324 HB2 ASP 46 HB2 ASP 46 59.124 30.034 29.595 325 HB3 ASP 46 HB3 ASP 46 59.765 31.082 30.555 326 H LEU 47 H LEU 47 56.122 33.156 29.340 327 HA LEU 47 HA LEU 47 54.076 32.870 28.978 328 HB2 LEU 47 HB2 LEU 47 54.996 31.812 26.509 329 HB3 LEU 47 HB3 LEU 47 53.526 32.280 26.741 330 HG LEU 47 HG LEU 47 55.725 34.048 26.851 331 HD11 LEU 47 HD11 LEU 47 54.991 34.838 24.693 332 HD12 LEU 47 HD12 LEU 47 55.370 33.303 24.606 333 HD13 LEU 47 HD13 LEU 47 53.850 33.739 24.700 334 HD21 LEU 47 HD21 LEU 47 54.182 35.822 26.764 335 HD22 LEU 47 HD22 LEU 47 52.991 34.778 26.795 336 HD23 LEU 47 HD23 LEU 47 53.937 34.937 28.055 337 H ALA 48 H ALA 48 55.185 30.601 30.535 338 HA ALA 48 HA ALA 48 53.586 28.552 30.081 339 HB1 ALA 48 HB1 ALA 48 54.449 27.767 32.173 340 HB2 ALA 48 HB2 ALA 48 55.636 28.241 31.238 341 HB3 ALA 48 HB3 ALA 48 55.123 29.181 32.405 342 H TYR 49 H TYR 49 53.090 31.341 31.974 343 HA TYR 49 HA TYR 49 50.613 30.668 32.752 344 HB2 TYR 49 HB2 TYR 49 52.581 31.503 34.636 345 HB3 TYR 49 HB3 TYR 49 51.081 31.305 35.012 346 HD1 TYR 49 HD1 TYR 49 50.148 28.936 35.023 347 HD2 TYR 49 HD2 TYR 49 54.122 29.674 34.761 348 HE1 TYR 49 HE1 TYR 49 50.593 26.751 35.717 349 HE2 TYR 49 HE2 TYR 49 54.566 27.505 35.491 350 HH TYR 49 HH TYR 49 53.724 25.554 36.205 351 H ALA 50 H ALA 50 49.143 32.453 33.044 352 HA ALA 50 HA ALA 50 50.060 34.942 33.461 353 HB1 ALA 50 HB1 ALA 50 48.565 35.854 31.863 354 HB2 ALA 50 HB2 ALA 50 49.617 34.909 31.150 355 HB3 ALA 50 HB3 ALA 50 48.147 34.389 31.431 356 H LYS 51 H LYS 51 48.899 36.175 34.955 357 HA LYS 51 HA LYS 51 46.578 35.341 36.042 358 HB2 LYS 51 HB2 LYS 51 48.282 37.459 36.865 359 HB3 LYS 51 HB3 LYS 51 46.931 37.159 37.583 360 HG2 LYS 51 HG2 LYS 51 47.739 35.032 38.253 361 HG3 LYS 51 HG3 LYS 51 49.080 35.292 37.500 362 HD2 LYS 51 HD2 LYS 51 49.501 35.746 39.733 363 HD3 LYS 51 HD3 LYS 51 49.528 37.122 38.999 364 HE2 LYS 51 HE2 LYS 51 47.314 37.568 39.730 365 HE3 LYS 51 HE3 LYS 51 47.263 36.180 40.441 366 HZ1 LYS 51 HZ1 LYS 51 47.891 37.300 42.116 367 HZ2 LYS 51 HZ2 LYS 51 49.229 37.217 41.554 368 HZ3 LYS 51 HZ3 LYS 51 48.419 38.403 41.330 369 H VAL 52 H VAL 52 44.559 36.326 35.630 370 HA VAL 52 HA VAL 52 44.359 38.581 34.137 371 HB VAL 52 HB VAL 52 42.475 36.512 34.154 372 HG11 VAL 52 HG11 VAL 52 41.473 37.636 32.295 373 HG12 VAL 52 HG12 VAL 52 41.481 38.569 33.574 374 HG13 VAL 52 HG13 VAL 52 42.557 38.782 32.432 375 HG21 VAL 52 HG21 VAL 52 43.132 35.948 31.945 376 HG22 VAL 52 HG22 VAL 52 44.304 37.009 32.042 377 HG23 VAL 52 HG23 VAL 52 44.323 35.722 32.965 378 H TYR 53 H TYR 53 43.444 40.342 35.209 379 HA TYR 53 HA TYR 53 41.974 40.064 37.473 380 HB2 TYR 53 HB2 TYR 53 43.226 42.408 36.521 381 HB3 TYR 53 HB3 TYR 53 42.473 42.304 37.883 382 HD1 TYR 53 HD1 TYR 53 43.423 40.482 39.530 383 HD2 TYR 53 HD2 TYR 53 45.597 42.156 36.550 384 HE1 TYR 53 HE1 TYR 53 45.388 39.654 40.495 385 HE2 TYR 53 HE2 TYR 53 47.568 41.408 37.564 386 HH TYR 53 HH TYR 53 48.479 40.284 39.273 387 H VAL 54 H VAL 54 39.765 40.571 37.542 388 HA VAL 54 HA VAL 54 38.482 41.400 35.301 389 HB VAL 54 HB VAL 54 37.665 39.216 36.836 390 HG11 VAL 54 HG11 VAL 54 36.090 38.740 35.099 391 HG12 VAL 54 HG12 VAL 54 35.819 40.166 35.733 392 HG13 VAL 54 HG13 VAL 54 36.567 40.047 34.341 393 HG21 VAL 54 HG21 VAL 54 38.264 37.784 35.000 394 HG22 VAL 54 HG22 VAL 54 38.858 39.042 34.244 395 HG23 VAL 54 HG23 VAL 54 39.542 38.522 35.575 396 H THR 55 H THR 55 36.627 42.717 35.662 397 HA THR 55 HA THR 55 35.843 43.320 38.192 398 HB THR 55 HB THR 55 37.159 45.006 37.481 399 HG1 THR 55 HG1 THR 55 35.708 45.917 38.646 400 HG21 THR 55 HG21 THR 55 36.615 46.452 35.713 401 HG22 THR 55 HG22 THR 55 36.949 44.997 35.185 402 HG23 THR 55 HG23 THR 55 35.443 45.474 35.293 403 H PHE 56 H PHE 56 33.633 43.614 38.571 404 HA PHE 56 HA PHE 56 31.922 42.569 36.745 405 HB2 PHE 56 HB2 PHE 56 32.148 42.102 39.522 406 HB3 PHE 56 HB3 PHE 56 30.803 41.782 38.804 407 HD1 PHE 56 HD1 PHE 56 34.263 40.844 38.220 408 HD2 PHE 56 HD2 PHE 56 30.446 39.520 38.472 409 HE1 PHE 56 HE1 PHE 56 34.981 38.662 37.780 410 HE2 PHE 56 HE2 PHE 56 31.175 37.343 38.122 411 HZ PHE 56 HZ PHE 56 33.445 36.909 37.748 412 H LEU 57 H LEU 57 30.024 43.842 36.212 413 HA LEU 57 HA LEU 57 29.017 45.754 37.778 414 HB2 LEU 57 HB2 LEU 57 28.566 45.658 35.448 415 HB3 LEU 57 HB3 LEU 57 27.781 44.327 35.658 416 HG LEU 57 HG LEU 57 26.186 45.507 36.956 417 HD11 LEU 57 HD11 LEU 57 26.120 47.867 36.868 418 HD12 LEU 57 HD12 LEU 57 27.438 47.379 37.597 419 HD13 LEU 57 HD13 LEU 57 27.500 47.868 36.092 420 HD21 LEU 57 HD21 LEU 57 25.114 46.574 35.093 421 HD22 LEU 57 HD22 LEU 57 26.481 46.517 34.295 422 HD23 LEU 57 HD23 LEU 57 25.713 45.177 34.647 423 H ASN 58 H ASN 58 28.656 42.372 37.869 424 HA ASN 58 HA ASN 58 26.553 42.216 39.526 425 HB2 ASN 58 HB2 ASN 58 27.026 40.607 37.766 426 HB3 ASN 58 HB3 ASN 58 28.230 40.103 38.620 427 HD21 ASN 58 HD21 ASN 58 24.877 39.482 40.498 428 HD22 ASN 58 HD22 ASN 58 25.243 40.861 40.073 429 H ASP 59 H ASP 59 29.245 43.373 40.408 430 HA ASP 59 HA ASP 59 30.056 42.467 42.692 431 HB2 ASP 59 HB2 ASP 59 31.211 44.161 41.566 432 HB3 ASP 59 HB3 ASP 59 29.973 45.106 41.628 433 H LYS 60 H LYS 60 27.012 43.596 42.149 434 HA LYS 60 HA LYS 60 26.147 44.557 44.415 435 HB2 LYS 60 HB2 LYS 60 25.156 44.573 42.103 436 HB3 LYS 60 HB3 LYS 60 24.585 43.169 42.469 437 HG2 LYS 60 HG2 LYS 60 23.156 44.051 44.037 438 HG3 LYS 60 HG3 LYS 60 23.908 45.417 44.055 439 HD2 LYS 60 HD2 LYS 60 23.183 45.828 41.805 440 HD3 LYS 60 HD3 LYS 60 22.400 44.479 41.822 441 HE2 LYS 60 HE2 LYS 60 20.952 45.286 43.484 442 HE3 LYS 60 HE3 LYS 60 21.790 46.594 43.622 443 HZ1 LYS 60 HZ1 LYS 60 19.975 46.965 42.309 444 HZ2 LYS 60 HZ2 LYS 60 21.165 47.155 41.498 445 HZ3 LYS 60 HZ3 LYS 60 20.385 45.936 41.369 446 H ASP 61 H ASP 61 26.824 41.295 43.845 447 HA ASP 61 HA ASP 61 26.501 40.814 46.453 448 HB2 ASP 61 HB2 ASP 61 24.542 39.869 45.477 449 HB3 ASP 61 HB3 ASP 61 25.431 38.979 44.556 450 H GLU 62 H GLU 62 28.331 39.820 47.369 451 HA GLU 62 HA GLU 62 30.463 39.444 46.008 452 HB2 GLU 62 HB2 GLU 62 30.080 38.388 48.627 453 HB3 GLU 62 HB3 GLU 62 31.474 38.713 48.008 454 HG2 GLU 62 HG2 GLU 62 31.259 40.443 49.377 455 HG3 GLU 62 HG3 GLU 62 30.689 41.079 48.071 456 H ASP 63 H ASP 63 28.285 36.904 47.007 457 HA ASP 63 HA ASP 63 29.788 34.877 46.211 458 HB2 ASP 63 HB2 ASP 63 28.229 34.623 47.996 459 HB3 ASP 63 HB3 ASP 63 27.067 34.709 46.960 460 H ALA 64 H ALA 64 27.406 36.674 44.499 461 HA ALA 64 HA ALA 64 27.239 35.195 42.323 462 HB1 ALA 64 HB1 ALA 64 26.323 37.138 41.352 463 HB2 ALA 64 HB2 ALA 64 25.653 36.872 42.762 464 HB3 ALA 64 HB3 ALA 64 26.774 37.981 42.615 465 H VAL 65 H VAL 65 29.520 37.747 43.030 466 HA VAL 65 HA VAL 65 31.004 37.589 40.910 467 HB VAL 65 HB VAL 65 31.831 38.448 43.449 468 HG11 VAL 65 HG11 VAL 65 33.630 39.577 42.401 469 HG12 VAL 65 HG12 VAL 65 33.750 38.014 42.175 470 HG13 VAL 65 HG13 VAL 65 33.206 38.943 41.013 471 HG21 VAL 65 HG21 VAL 65 31.474 40.667 42.581 472 HG22 VAL 65 HG22 VAL 65 30.979 40.032 41.217 473 HG23 VAL 65 HG23 VAL 65 30.123 39.842 42.536 474 H LYS 66 H LYS 66 31.382 35.785 43.887 475 HA LYS 66 HA LYS 66 33.522 34.392 43.377 476 HB2 LYS 66 HB2 LYS 66 32.524 34.610 45.545 477 HB3 LYS 66 HB3 LYS 66 31.421 33.600 45.102 478 HG2 LYS 66 HG2 LYS 66 33.016 32.504 46.393 479 HG3 LYS 66 HG3 LYS 66 32.976 31.882 44.964 480 HD2 LYS 66 HD2 LYS 66 35.202 32.132 45.765 481 HD3 LYS 66 HD3 LYS 66 34.996 32.855 44.398 482 HE2 LYS 66 HE2 LYS 66 34.768 34.932 45.505 483 HE3 LYS 66 HE3 LYS 66 34.900 34.227 46.889 484 HZ1 LYS 66 HZ1 LYS 66 36.874 35.144 46.290 485 HZ2 LYS 66 HZ2 LYS 66 37.048 33.704 46.357 486 HZ3 LYS 66 HZ3 LYS 66 36.925 34.361 45.068 487 H ALA 67 H ALA 67 30.252 33.355 42.740 488 HA ALA 67 HA ALA 67 30.712 31.107 41.522 489 HB1 ALA 67 HB1 ALA 67 28.474 31.322 40.782 490 HB2 ALA 67 HB2 ALA 67 28.571 31.662 42.327 491 HB3 ALA 67 HB3 ALA 67 28.467 32.832 41.264 492 H GLY 68 H GLY 68 30.469 34.233 39.984 493 HA2 GLY 68 HA2 GLY 68 30.780 33.584 37.500 494 HA3 GLY 68 HA3 GLY 68 31.099 34.989 38.097 495 H ILE 69 H ILE 69 33.369 34.510 39.690 496 HA ILE 69 HA ILE 69 35.443 34.214 38.143 497 HB ILE 69 HB ILE 69 35.224 34.218 40.938 498 HG12 ILE 69 HG12 ILE 69 34.950 36.335 39.906 499 HG13 ILE 69 HG13 ILE 69 36.111 36.349 40.946 500 HG21 ILE 69 HG21 ILE 69 37.578 34.324 41.194 501 HG22 ILE 69 HG22 ILE 69 37.128 32.937 40.575 502 HG23 ILE 69 HG23 ILE 69 37.739 34.060 39.640 503 HD11 ILE 69 HD11 ILE 69 36.759 37.543 39.038 504 HD12 ILE 69 HD12 ILE 69 37.698 36.278 39.195 505 HD13 ILE 69 HD13 ILE 69 36.519 36.264 38.138 506 H LYS 70 H LYS 70 34.042 31.781 40.239 507 HA LYS 70 HA LYS 70 35.658 29.825 39.724 508 HB2 LYS 70 HB2 LYS 70 33.011 29.839 40.757 509 HB3 LYS 70 HB3 LYS 70 33.731 28.474 40.533 510 HG2 LYS 70 HG2 LYS 70 35.436 29.170 42.084 511 HG3 LYS 70 HG3 LYS 70 34.612 30.465 42.363 512 HD2 LYS 70 HD2 LYS 70 33.781 27.834 43.028 513 HD3 LYS 70 HD3 LYS 70 34.155 28.940 44.063 514 HE2 LYS 70 HE2 LYS 70 32.205 30.183 43.288 515 HE3 LYS 70 HE3 LYS 70 31.794 28.911 42.486 516 HZ1 LYS 70 HZ1 LYS 70 30.762 28.926 44.503 517 HZ2 LYS 70 HZ2 LYS 70 31.651 27.777 44.458 518 HZ3 LYS 70 HZ3 LYS 70 32.033 28.963 45.207 519 H ALA 71 H ALA 71 32.732 30.575 38.025 520 HA ALA 71 HA ALA 71 32.632 28.562 36.350 521 HB1 ALA 71 HB1 ALA 71 30.955 29.892 35.310 522 HB2 ALA 71 HB2 ALA 71 30.720 29.863 36.877 523 HB3 ALA 71 HB3 ALA 71 31.392 31.128 36.200 524 H LEU 72 H LEU 72 34.133 31.626 35.959 525 HA LEU 72 HA LEU 72 35.106 31.429 33.498 526 HB2 LEU 72 HB2 LEU 72 34.722 33.491 34.540 527 HB3 LEU 72 HB3 LEU 72 35.673 33.108 35.717 528 HG LEU 72 HG LEU 72 37.518 33.267 34.278 529 HD11 LEU 72 HD11 LEU 72 37.304 34.212 32.136 530 HD12 LEU 72 HD12 LEU 72 36.526 32.835 32.209 531 HD13 LEU 72 HD13 LEU 72 35.728 34.201 32.292 532 HD21 LEU 72 HD21 LEU 72 37.476 35.656 34.091 533 HD22 LEU 72 HD22 LEU 72 35.908 35.630 34.312 534 HD23 LEU 72 HD23 LEU 72 36.881 35.214 35.491 535 H GLN 73 H GLN 73 36.561 30.511 36.505 536 HA GLN 73 HA GLN 73 38.920 29.753 35.589 537 HB2 GLN 73 HB2 GLN 73 38.470 30.373 37.873 538 HB3 GLN 73 HB3 GLN 73 37.756 28.998 38.055 539 HG2 GLN 73 HG2 GLN 73 39.926 28.812 38.897 540 HG3 GLN 73 HG3 GLN 73 39.803 27.868 37.661 541 HE21 GLN 73 HE21 GLN 73 41.449 28.051 36.133 542 HE22 GLN 73 HE22 GLN 73 42.321 29.242 35.932 543 H GLU 74 H GLU 74 36.066 27.764 36.105 544 HA GLU 74 HA GLU 74 37.128 25.519 35.280 545 HB2 GLU 74 HB2 GLU 74 34.392 26.223 35.571 546 HB3 GLU 74 HB3 GLU 74 34.787 24.803 35.062 547 HG2 GLU 74 HG2 GLU 74 36.032 24.530 37.153 548 HG3 GLU 74 HG3 GLU 74 35.329 25.829 37.653 549 H ALA 75 H ALA 75 35.728 27.999 33.361 550 HA ALA 75 HA ALA 75 35.812 26.724 31.023 551 HB1 ALA 75 HB1 ALA 75 35.062 28.837 30.194 552 HB2 ALA 75 HB2 ALA 75 34.159 28.382 31.414 553 HB3 ALA 75 HB3 ALA 75 35.294 29.467 31.628 554 H SER 76 H SER 76 38.387 27.809 32.639 555 HA SER 76 HA SER 76 39.627 29.452 31.137 556 HB2 SER 76 HB2 SER 76 41.554 28.995 32.467 557 HB3 SER 76 HB3 SER 76 40.299 29.190 33.371 558 HG SER 76 HG SER 76 40.305 27.173 33.838 559 H GLY 77 H GLY 77 39.898 26.035 30.802 560 HA2 GLY 77 HA2 GLY 77 41.907 25.834 29.123 561 HA3 GLY 77 HA3 GLY 77 40.862 24.716 29.426 562 H PHE 78 H PHE 78 38.467 25.950 28.383 563 HA PHE 78 HA PHE 78 38.632 25.882 25.773 564 HB2 PHE 78 HB2 PHE 78 36.571 26.868 27.431 565 HB3 PHE 78 HB3 PHE 78 36.435 26.929 25.878 566 HD1 PHE 78 HD1 PHE 78 36.054 24.842 28.624 567 HD2 PHE 78 HD2 PHE 78 36.267 24.768 24.587 568 HE1 PHE 78 HE1 PHE 78 35.145 22.692 28.611 569 HE2 PHE 78 HE2 PHE 78 35.384 22.615 24.574 570 HZ PHE 78 HZ PHE 78 34.810 21.572 26.580 571 H ILE 79 H ILE 79 38.619 28.666 27.863 572 HA ILE 79 HA ILE 79 38.748 30.624 26.129 573 HB ILE 79 HB ILE 79 39.523 30.640 28.832 574 HG12 ILE 79 HG12 ILE 79 37.119 31.672 27.725 575 HG13 ILE 79 HG13 ILE 79 37.181 30.249 28.361 576 HG21 ILE 79 HG21 ILE 79 39.499 32.995 28.734 577 HG22 ILE 79 HG22 ILE 79 40.606 32.419 27.759 578 HG23 ILE 79 HG23 ILE 79 39.223 32.925 27.177 579 HD11 ILE 79 HD11 ILE 79 36.266 31.757 29.911 580 HD12 ILE 79 HD12 ILE 79 37.635 31.203 30.480 581 HD13 ILE 79 HD13 ILE 79 37.573 32.647 29.835 582 H ARG 80 H ARG 80 41.435 29.005 27.647 583 HA ARG 80 HA ARG 80 43.500 30.107 26.490 584 HB2 ARG 80 HB2 ARG 80 43.770 28.849 28.416 585 HB3 ARG 80 HB3 ARG 80 43.176 27.581 27.730 586 HG2 ARG 80 HG2 ARG 80 45.071 27.196 26.538 587 HG3 ARG 80 HG3 ARG 80 45.597 28.647 26.755 588 HD2 ARG 80 HD2 ARG 80 46.795 26.999 28.011 589 HD3 ARG 80 HD3 ARG 80 46.289 28.195 28.876 590 HE ARG 80 HE ARG 80 45.164 26.769 30.077 591 HH11 ARG 80 HH11 ARG 80 44.097 24.983 30.710 592 HH12 ARG 80 HH12 ARG 80 44.009 23.796 29.816 593 HH21 ARG 80 HH21 ARG 80 45.563 25.031 27.288 594 HH22 ARG 80 HH22 ARG 80 44.868 23.820 27.809 595 H SER 81 H SER 81 41.747 27.379 25.273 596 HA SER 81 HA SER 81 43.251 26.923 23.160 597 HB2 SER 81 HB2 SER 81 41.758 25.305 24.256 598 HB3 SER 81 HB3 SER 81 40.561 26.041 23.579 599 HG SER 81 HG SER 81 41.234 24.351 22.351 600 H LEU 82 H LEU 82 40.344 28.791 23.365 601 HA LEU 82 HA LEU 82 40.158 29.505 20.836 602 HB2 LEU 82 HB2 LEU 82 38.998 30.645 23.163 603 HB3 LEU 82 HB3 LEU 82 38.680 31.205 21.743 604 HG LEU 82 HG LEU 82 38.006 28.598 22.591 605 HD11 LEU 82 HD11 LEU 82 35.748 29.379 22.551 606 HD12 LEU 82 HD12 LEU 82 36.602 30.236 23.574 607 HD13 LEU 82 HD13 LEU 82 36.269 30.816 22.138 608 HD21 LEU 82 HD21 LEU 82 36.793 28.326 20.607 609 HD22 LEU 82 HD22 LEU 82 37.308 29.737 20.105 610 HD23 LEU 82 HD23 LEU 82 38.331 28.543 20.295 611 H LEU 83 H LEU 83 41.766 31.096 23.451 612 HA LEU 83 HA LEU 83 42.627 33.293 22.325 613 HB2 LEU 83 HB2 LEU 83 42.517 32.945 24.665 614 HB3 LEU 83 HB3 LEU 83 43.660 31.890 24.560 615 HG LEU 83 HG LEU 83 45.149 33.638 23.895 616 HD11 LEU 83 HD11 LEU 83 44.518 35.869 24.212 617 HD12 LEU 83 HD12 LEU 83 43.620 35.198 23.093 618 HD13 LEU 83 HD13 LEU 83 43.044 35.402 24.554 619 HD21 LEU 83 HD21 LEU 83 45.403 34.513 26.088 620 HD22 LEU 83 HD22 LEU 83 43.955 33.986 26.457 621 HD23 LEU 83 HD23 LEU 83 45.121 32.955 26.158 622 H GLY 84 H GLY 84 44.371 30.269 22.524 623 HA2 GLY 84 HA2 GLY 84 46.563 30.868 21.293 624 HA3 GLY 84 HA3 GLY 84 45.969 29.429 21.382 625 H LYS 85 H LYS 85 43.658 29.657 19.816 626 HA LYS 85 HA LYS 85 44.370 29.666 17.275 627 HB2 LYS 85 HB2 LYS 85 42.577 28.332 18.248 628 HB3 LYS 85 HB3 LYS 85 41.734 29.637 18.390 629 HG2 LYS 85 HG2 LYS 85 41.449 29.827 16.127 630 HG3 LYS 85 HG3 LYS 85 42.615 28.838 15.822 631 HD2 LYS 85 HD2 LYS 85 40.695 27.636 15.431 632 HD3 LYS 85 HD3 LYS 85 41.278 27.059 16.759 633 HE2 LYS 85 HE2 LYS 85 39.124 27.300 17.339 634 HE3 LYS 85 HE3 LYS 85 39.706 28.639 17.887 635 HZ1 LYS 85 HZ1 LYS 85 37.846 29.049 16.642 636 HZ2 LYS 85 HZ2 LYS 85 38.977 29.675 15.979 637 HZ3 LYS 85 HZ3 LYS 85 38.434 28.428 15.469 638 H ALA 86 H ALA 86 42.766 32.157 19.017 639 HA ALA 86 HA ALA 86 42.450 33.902 17.079 640 HB1 ALA 86 HB1 ALA 86 41.860 35.339 18.884 641 HB2 ALA 86 HB2 ALA 86 41.112 33.950 19.030 642 HB3 ALA 86 HB3 ALA 86 42.394 34.254 19.907 643 H MET 87 H MET 87 45.198 33.320 18.933 644 HA MET 87 HA MET 87 46.598 35.466 18.147 645 HB2 MET 87 HB2 MET 87 47.175 33.497 20.141 646 HB3 MET 87 HB3 MET 87 48.187 34.638 19.811 647 HG2 MET 87 HG2 MET 87 45.613 35.352 20.681 648 HG3 MET 87 HG3 MET 87 46.659 34.918 21.753 649 HE1 MET 87 HE1 MET 87 46.165 38.708 22.131 650 HE2 MET 87 HE2 MET 87 45.083 37.690 21.583 651 HE3 MET 87 HE3 MET 87 45.945 37.318 22.858 652 H ARG 88 H ARG 88 46.257 32.606 16.679 653 HA ARG 88 HA ARG 88 47.345 31.201 15.519 654 HB2 ARG 88 HB2 ARG 88 48.636 33.498 14.499 655 HB3 ARG 88 HB3 ARG 88 48.576 32.128 13.757 656 HG2 ARG 88 HG2 ARG 88 46.198 32.389 13.540 657 HG3 ARG 88 HG3 ARG 88 46.314 33.795 14.203 658 HD2 ARG 88 HD2 ARG 88 46.253 34.237 11.963 659 HD3 ARG 88 HD3 ARG 88 47.746 34.454 12.356 660 HE ARG 88 HE ARG 88 48.302 32.607 11.216 661 HH11 ARG 88 HH11 ARG 88 48.051 31.202 9.531 662 HH12 ARG 88 HH12 ARG 88 46.701 30.956 8.950 663 HH21 ARG 88 HH21 ARG 88 45.003 32.906 10.801 664 HH22 ARG 88 HH22 ARG 88 44.959 31.930 9.676 665 H LEU 89 H LEU 89 48.363 30.644 17.870 666 HA LEU 89 HA LEU 89 50.989 31.364 18.159 667 HB2 LEU 89 HB2 LEU 89 49.418 32.628 19.459 668 HB3 LEU 89 HB3 LEU 89 48.889 31.305 20.094 669 HG LEU 89 HG LEU 89 50.919 31.052 21.226 670 HD11 LEU 89 HD11 LEU 89 52.436 32.840 21.388 671 HD12 LEU 89 HD12 LEU 89 52.370 32.303 19.900 672 HD13 LEU 89 HD13 LEU 89 51.609 33.634 20.296 673 HD21 LEU 89 HD21 LEU 89 50.485 32.822 22.820 674 HD22 LEU 89 HD22 LEU 89 49.605 33.561 21.730 675 HD23 LEU 89 HD23 LEU 89 49.117 32.183 22.342 676 H ARG 90 H ARG 90 52.568 30.012 18.942 677 HA ARG 90 HA ARG 90 52.163 27.383 18.877 678 HB2 ARG 90 HB2 ARG 90 54.536 28.931 19.204 679 HB3 ARG 90 HB3 ARG 90 54.600 27.373 19.235 680 HG2 ARG 90 HG2 ARG 90 53.957 27.221 17.003 681 HG3 ARG 90 HG3 ARG 90 53.567 28.730 16.955 682 HD2 ARG 90 HD2 ARG 90 55.826 29.358 17.135 683 HD3 ARG 90 HD3 ARG 90 56.252 27.867 17.308 684 HE ARG 90 HE ARG 90 55.454 28.974 14.935 685 HH11 ARG 90 HH11 ARG 90 56.089 27.995 13.022 686 HH12 ARG 90 HH12 ARG 90 56.674 26.625 13.054 687 HH21 ARG 90 HH21 ARG 90 56.608 26.127 16.202 688 HH22 ARG 90 HH22 ARG 90 56.974 25.550 14.877 689 H ILE 91 H ILE 91 52.748 29.464 21.533 690 HA ILE 91 HA ILE 91 51.922 27.613 23.288 691 HB ILE 91 HB ILE 91 53.596 28.728 24.782 692 HG12 ILE 91 HG12 ILE 91 55.776 28.732 23.895 693 HG13 ILE 91 HG13 ILE 91 55.177 28.578 22.464 694 HG21 ILE 91 HG21 ILE 91 54.903 26.662 24.557 695 HG22 ILE 91 HG22 ILE 91 53.352 26.344 24.581 696 HG23 ILE 91 HG23 ILE 91 54.134 26.374 23.204 697 HD11 ILE 91 HD11 ILE 91 55.747 30.825 22.833 698 HD12 ILE 91 HD12 ILE 91 54.179 30.720 22.639 699 HD13 ILE 91 HD13 ILE 91 54.787 30.876 24.092 700 H VAL 92 H VAL 92 50.093 28.406 24.257 701 HA VAL 92 HA VAL 92 49.777 31.032 24.916 702 HB VAL 92 HB VAL 92 48.135 30.263 23.584 703 HG11 VAL 92 HG11 VAL 92 46.550 28.635 24.238 704 HG12 VAL 92 HG12 VAL 92 47.994 28.009 24.064 705 HG13 VAL 92 HG13 VAL 92 47.435 28.320 25.513 706 HG21 VAL 92 HG21 VAL 92 46.225 30.925 24.837 707 HG22 VAL 92 HG22 VAL 92 47.092 30.832 26.159 708 HG23 VAL 92 HG23 VAL 92 47.437 31.919 25.061 709 HA PRO 93 HA PRO 93 50.567 30.067 29.052 710 HB2 PRO 93 HB2 PRO 93 49.394 32.447 29.961 711 HB3 PRO 93 HB3 PRO 93 50.891 32.041 30.123 712 HG2 PRO 93 HG2 PRO 93 50.277 33.874 28.425 713 HG3 PRO 93 HG3 PRO 93 51.476 32.928 28.109 714 HD2 PRO 93 HD2 PRO 93 48.845 32.709 27.083 715 HD3 PRO 93 HD3 PRO 93 50.169 32.475 26.292 716 H GLU 94 H GLU 94 49.652 29.067 30.918 717 HA GLU 94 HA GLU 94 47.061 28.489 31.026 718 HB2 GLU 94 HB2 GLU 94 48.638 26.941 31.791 719 HB3 GLU 94 HB3 GLU 94 49.049 27.912 32.941 720 HG2 GLU 94 HG2 GLU 94 47.649 26.310 33.861 721 HG3 GLU 94 HG3 GLU 94 46.886 27.669 33.908 722 H LEU 95 H LEU 95 45.388 29.346 32.360 723 HA LEU 95 HA LEU 95 45.782 31.954 33.010 724 HB2 LEU 95 HB2 LEU 95 43.380 30.838 32.006 725 HB3 LEU 95 HB3 LEU 95 43.616 32.361 32.242 726 HG LEU 95 HG LEU 95 44.900 30.854 30.242 727 HD11 LEU 95 HD11 LEU 95 43.599 32.087 28.670 728 HD12 LEU 95 HD12 LEU 95 42.660 31.261 29.641 729 HD13 LEU 95 HD13 LEU 95 42.867 32.814 29.871 730 HD21 LEU 95 HD21 LEU 95 45.768 32.883 29.382 731 HD22 LEU 95 HD22 LEU 95 45.132 33.659 30.608 732 HD23 LEU 95 HD23 LEU 95 46.305 32.623 30.849 733 H THR 96 H THR 96 45.410 32.701 35.094 734 HA THR 96 HA THR 96 43.613 31.446 36.667 735 HB THR 96 HB THR 96 45.824 32.786 37.718 736 HG1 THR 96 HG1 THR 96 46.556 30.738 38.228 737 HG21 THR 96 HG21 THR 96 45.233 31.756 39.789 738 HG22 THR 96 HG22 THR 96 44.045 32.663 39.266 739 HG23 THR 96 HG23 THR 96 43.983 31.091 39.080 740 H PHE 97 H PHE 97 41.861 32.742 37.422 741 HA PHE 97 HA PHE 97 41.796 35.363 36.735 742 HB2 PHE 97 HB2 PHE 97 39.633 33.537 36.901 743 HB3 PHE 97 HB3 PHE 97 39.438 35.045 36.560 744 HD1 PHE 97 HD1 PHE 97 40.001 35.891 34.317 745 HD2 PHE 97 HD2 PHE 97 40.533 31.974 35.184 746 HE1 PHE 97 HE1 PHE 97 40.201 35.425 32.047 747 HE2 PHE 97 HE2 PHE 97 40.790 31.516 32.914 748 HZ PHE 97 HZ PHE 97 40.625 33.228 31.336 749 H PHE 98 H PHE 98 41.208 37.006 38.130 750 HA PHE 98 HA PHE 98 40.538 36.556 40.697 751 HB2 PHE 98 HB2 PHE 98 42.774 38.129 39.883 752 HB3 PHE 98 HB3 PHE 98 42.217 38.212 41.337 753 HD1 PHE 98 HD1 PHE 98 42.603 36.347 42.925 754 HD2 PHE 98 HD2 PHE 98 44.218 36.264 39.214 755 HE1 PHE 98 HE1 PHE 98 44.074 34.666 43.597 756 HE2 PHE 98 HE2 PHE 98 45.689 34.584 39.887 757 HZ PHE 98 HZ PHE 98 45.619 33.784 42.086 758 H TYR 99 H TYR 99 39.511 38.407 41.849 759 HA TYR 99 HA TYR 99 38.096 40.042 40.274 760 HB2 TYR 99 HB2 TYR 99 36.660 40.379 42.045 761 HB3 TYR 99 HB3 TYR 99 36.827 38.854 41.761 762 HD1 TYR 99 HD1 TYR 99 37.445 41.347 44.125 763 HD2 TYR 99 HD2 TYR 99 37.707 37.362 43.565 764 HE1 TYR 99 HE1 TYR 99 37.676 41.045 46.430 765 HE2 TYR 99 HE2 TYR 99 38.016 37.049 45.863 766 HH TYR 99 HH TYR 99 38.101 38.032 47.910 767 H ASP 100 H ASP 100 38.040 42.291 40.167 768 HA ASP 100 HA ASP 100 39.743 43.878 41.637 769 HB2 ASP 100 HB2 ASP 100 40.663 43.226 39.491 770 HB3 ASP 100 HB3 ASP 100 39.444 43.917 38.807 Start of MODEL 19 1 HA PRO 8 HA PRO 8 56.391 44.158 27.037 2 HB2 PRO 8 HB2 PRO 8 55.391 42.115 25.942 3 HB3 PRO 8 HB3 PRO 8 56.861 42.015 26.452 4 HG2 PRO 8 HG2 PRO 8 54.558 40.982 27.747 5 HG3 PRO 8 HG3 PRO 8 55.957 40.297 27.664 6 HD2 PRO 8 HD2 PRO 8 55.228 41.647 29.783 7 HD3 PRO 8 HD3 PRO 8 56.733 41.414 29.445 8 H GLN 9 H GLN 9 55.072 45.955 27.282 9 HA GLN 9 HA GLN 9 52.651 45.981 28.345 10 HB2 GLN 9 HB2 GLN 9 54.430 47.700 28.331 11 HB3 GLN 9 HB3 GLN 9 53.903 48.078 26.912 12 HG2 GLN 9 HG2 GLN 9 52.387 48.378 29.287 13 HG3 GLN 9 HG3 GLN 9 53.075 49.561 28.537 14 HE21 GLN 9 HE21 GLN 9 52.253 49.623 26.072 15 HE22 GLN 9 HE22 GLN 9 50.774 49.547 25.906 16 H ARG 10 H ARG 10 53.442 46.314 24.955 17 HA ARG 10 HA ARG 10 50.963 46.575 24.107 18 HB2 ARG 10 HB2 ARG 10 53.367 46.220 22.665 19 HB3 ARG 10 HB3 ARG 10 52.001 46.285 21.914 20 HG2 ARG 10 HG2 ARG 10 51.612 48.461 22.870 21 HG3 ARG 10 HG3 ARG 10 53.015 48.397 23.548 22 HD2 ARG 10 HD2 ARG 10 54.108 48.577 21.519 23 HD3 ARG 10 HD3 ARG 10 52.806 48.275 20.716 24 HE ARG 10 HE ARG 10 52.102 50.373 21.087 25 HH11 ARG 10 HH11 ARG 10 52.312 52.486 21.456 26 HH12 ARG 10 HH12 ARG 10 53.583 53.043 21.997 27 HH21 ARG 10 HH21 ARG 10 55.192 50.309 22.351 28 HH22 ARG 10 HH22 ARG 10 55.245 51.788 22.513 29 H VAL 11 H VAL 11 52.810 43.644 24.368 30 HA VAL 11 HA VAL 11 51.061 41.955 23.468 31 HB VAL 11 HB VAL 11 52.957 41.507 25.466 32 HG11 VAL 11 HG11 VAL 11 52.757 39.143 25.046 33 HG12 VAL 11 HG12 VAL 11 51.392 39.739 25.587 34 HG13 VAL 11 HG13 VAL 11 51.572 39.450 24.040 35 HG21 VAL 11 HG21 VAL 11 54.297 40.424 23.789 36 HG22 VAL 11 HG22 VAL 11 53.204 40.806 22.708 37 HG23 VAL 11 HG23 VAL 11 54.046 41.944 23.419 38 H ALA 12 H ALA 12 51.314 43.223 26.727 39 HA ALA 12 HA ALA 12 49.399 41.888 27.882 40 HB1 ALA 12 HB1 ALA 12 49.573 43.518 29.593 41 HB2 ALA 12 HB2 ALA 12 51.013 43.023 29.160 42 HB3 ALA 12 HB3 ALA 12 50.463 44.414 28.639 43 H GLN 13 H GLN 13 49.023 44.894 26.135 44 HA GLN 13 HA GLN 13 46.485 45.267 26.568 45 HB2 GLN 13 HB2 GLN 13 48.100 46.242 24.443 46 HB3 GLN 13 HB3 GLN 13 46.615 46.692 24.603 47 HG2 GLN 13 HG2 GLN 13 47.170 47.635 26.736 48 HG3 GLN 13 HG3 GLN 13 48.662 47.257 26.488 49 HE21 GLN 13 HE21 GLN 13 46.252 49.405 25.464 50 HE22 GLN 13 HE22 GLN 13 47.099 50.333 24.664 51 H GLU 14 H GLU 14 47.973 43.597 23.867 52 HA GLU 14 HA GLU 14 45.807 42.951 22.527 53 HB2 GLU 14 HB2 GLU 14 48.487 42.063 22.367 54 HB3 GLU 14 HB3 GLU 14 47.412 41.293 21.541 55 HG2 GLU 14 HG2 GLU 14 46.818 43.279 20.409 56 HG3 GLU 14 HG3 GLU 14 47.820 44.097 21.280 57 H MET 15 H MET 15 47.339 41.102 25.028 58 HA MET 15 HA MET 15 45.767 39.027 25.088 59 HB2 MET 15 HB2 MET 15 47.401 40.177 27.115 60 HB3 MET 15 HB3 MET 15 46.601 38.868 27.394 61 HG2 MET 15 HG2 MET 15 48.571 38.998 25.367 62 HG3 MET 15 HG3 MET 15 48.916 38.524 26.813 63 HE1 MET 15 HE1 MET 15 49.372 35.170 25.367 64 HE2 MET 15 HE2 MET 15 49.973 36.573 24.941 65 HE3 MET 15 HE3 MET 15 49.876 36.185 26.473 66 H GLN 16 H GLN 16 45.368 42.027 26.887 67 HA GLN 16 HA GLN 16 43.286 41.362 28.293 68 HB2 GLN 16 HB2 GLN 16 44.364 43.908 27.666 69 HB3 GLN 16 HB3 GLN 16 43.028 43.836 28.467 70 HG2 GLN 16 HG2 GLN 16 44.054 42.832 30.271 71 HG3 GLN 16 HG3 GLN 16 45.342 42.524 29.447 72 HE21 GLN 16 HE21 GLN 16 47.005 44.090 29.473 73 HE22 GLN 16 HE22 GLN 16 46.879 45.455 30.055 74 H LYS 17 H LYS 17 43.348 42.945 25.201 75 HA LYS 17 HA LYS 17 40.786 43.416 24.830 76 HB2 LYS 17 HB2 LYS 17 43.002 43.366 23.052 77 HB3 LYS 17 HB3 LYS 17 41.577 43.706 22.518 78 HG2 LYS 17 HG2 LYS 17 41.482 45.642 23.857 79 HG3 LYS 17 HG3 LYS 17 42.825 45.266 24.555 80 HD2 LYS 17 HD2 LYS 17 43.973 45.578 22.472 81 HD3 LYS 17 HD3 LYS 17 42.627 46.001 21.807 82 HE2 LYS 17 HE2 LYS 17 42.507 47.874 23.307 83 HE3 LYS 17 HE3 LYS 17 43.893 47.468 23.896 84 HZ1 LYS 17 HZ1 LYS 17 44.167 49.069 22.295 85 HZ2 LYS 17 HZ2 LYS 17 44.825 47.858 21.835 86 HZ3 LYS 17 HZ3 LYS 17 43.535 48.237 21.286 87 H GLU 18 H GLU 18 42.604 40.694 23.650 88 HA GLU 18 HA GLU 18 40.604 39.533 22.368 89 HB2 GLU 18 HB2 GLU 18 43.135 39.242 22.139 90 HB3 GLU 18 HB3 GLU 18 42.883 38.044 23.104 91 HG2 GLU 18 HG2 GLU 18 42.816 37.116 21.017 92 HG3 GLU 18 HG3 GLU 18 41.322 37.164 21.462 93 H ILE 19 H ILE 19 41.806 38.929 25.568 94 HA ILE 19 HA ILE 19 40.306 36.836 26.174 95 HB ILE 19 HB ILE 19 41.785 38.506 27.878 96 HG12 ILE 19 HG12 ILE 19 42.404 35.842 27.087 97 HG13 ILE 19 HG13 ILE 19 43.029 37.075 26.365 98 HG21 ILE 19 HG21 ILE 19 41.454 36.896 29.594 99 HG22 ILE 19 HG22 ILE 19 40.064 37.513 29.153 100 HG23 ILE 19 HG23 ILE 19 40.493 36.080 28.634 101 HD11 ILE 19 HD11 ILE 19 44.584 36.195 27.894 102 HD12 ILE 19 HD12 ILE 19 44.191 37.661 28.348 103 HD13 ILE 19 HD13 ILE 19 43.557 36.410 29.081 104 H ALA 20 H ALA 20 39.694 40.238 26.736 105 HA ALA 20 HA ALA 20 37.414 40.092 27.967 106 HB1 ALA 20 HB1 ALA 20 37.164 42.356 27.327 107 HB2 ALA 20 HB2 ALA 20 38.626 42.100 27.880 108 HB3 ALA 20 HB3 ALA 20 38.376 42.195 26.319 109 H LEU 21 H LEU 21 37.866 40.009 24.523 110 HA LEU 21 HA LEU 21 35.332 39.855 23.774 111 HB2 LEU 21 HB2 LEU 21 36.978 40.536 22.253 112 HB3 LEU 21 HB3 LEU 21 37.744 39.187 22.422 113 HG LEU 21 HG LEU 21 36.048 38.043 21.330 114 HD11 LEU 21 HD11 LEU 21 34.260 39.141 20.263 115 HD12 LEU 21 HD12 LEU 21 34.173 39.323 21.834 116 HD13 LEU 21 HD13 LEU 21 34.713 40.504 20.928 117 HD21 LEU 21 HD21 LEU 21 36.385 38.958 19.133 118 HD22 LEU 21 HD22 LEU 21 36.934 40.288 19.793 119 HD23 LEU 21 HD23 LEU 21 37.751 38.938 19.933 120 H ILE 22 H ILE 22 37.562 37.203 24.367 121 HA ILE 22 HA ILE 22 35.927 35.243 23.740 122 HB ILE 22 HB ILE 22 38.349 35.159 25.188 123 HG12 ILE 22 HG12 ILE 22 37.962 34.236 22.515 124 HG13 ILE 22 HG13 ILE 22 38.354 35.724 22.767 125 HG21 ILE 22 HG21 ILE 22 38.351 32.806 24.905 126 HG22 ILE 22 HG22 ILE 22 37.101 33.245 25.773 127 HG23 ILE 22 HG23 ILE 22 36.915 32.888 24.241 128 HD11 ILE 22 HD11 ILE 22 40.276 34.489 22.237 129 HD12 ILE 22 HD12 ILE 22 40.405 35.035 23.719 130 HD13 ILE 22 HD13 ILE 22 40.006 33.523 23.462 131 H LEU 23 H LEU 23 36.296 36.732 26.827 132 HA LEU 23 HA LEU 23 34.698 35.345 28.297 133 HB2 LEU 23 HB2 LEU 23 35.842 37.875 28.509 134 HB3 LEU 23 HB3 LEU 23 34.485 37.781 29.273 135 HG LEU 23 HG LEU 23 35.350 35.958 30.529 136 HD11 LEU 23 HD11 LEU 23 37.658 35.506 30.545 137 HD12 LEU 23 HD12 LEU 23 37.039 35.185 29.122 138 HD13 LEU 23 HD13 LEU 23 37.858 36.521 29.347 139 HD21 LEU 23 HD21 LEU 23 36.778 37.307 31.925 140 HD22 LEU 23 HD22 LEU 23 36.908 38.356 30.746 141 HD23 LEU 23 HD23 LEU 23 35.516 38.148 31.471 142 H GLN 24 H GLN 24 33.617 37.589 25.928 143 HA GLN 24 HA GLN 24 31.044 37.313 26.509 144 HB2 GLN 24 HB2 GLN 24 32.261 38.637 24.290 145 HB3 GLN 24 HB3 GLN 24 30.716 38.650 24.500 146 HG2 GLN 24 HG2 GLN 24 31.057 39.867 26.555 147 HG3 GLN 24 HG3 GLN 24 32.578 39.939 26.221 148 HE21 GLN 24 HE21 GLN 24 31.540 42.337 26.523 149 HE22 GLN 24 HE22 GLN 24 31.288 43.063 25.246 150 H ARG 25 H ARG 25 33.047 35.509 24.403 151 HA ARG 25 HA ARG 25 31.048 34.621 22.876 152 HB2 ARG 25 HB2 ARG 25 33.778 33.958 22.481 153 HB3 ARG 25 HB3 ARG 25 32.649 33.706 21.435 154 HG2 ARG 25 HG2 ARG 25 33.921 36.141 21.985 155 HG3 ARG 25 HG3 ARG 25 33.794 35.440 20.597 156 HD2 ARG 25 HD2 ARG 25 31.678 36.822 21.868 157 HD3 ARG 25 HD3 ARG 25 32.489 37.383 20.659 158 HE ARG 25 HE ARG 25 31.355 35.152 19.861 159 HH11 ARG 25 HH11 ARG 25 29.470 35.027 18.700 160 HH12 ARG 25 HH12 ARG 25 28.568 36.208 18.602 161 HH21 ARG 25 HH21 ARG 25 30.267 38.211 20.462 162 HH22 ARG 25 HH22 ARG 25 29.036 38.074 19.635 163 H GLU 26 H GLU 26 33.152 33.099 25.149 164 HA GLU 26 HA GLU 26 32.350 30.581 24.627 165 HB2 GLU 26 HB2 GLU 26 34.639 30.937 24.993 166 HB3 GLU 26 HB3 GLU 26 34.352 31.575 26.386 167 HG2 GLU 26 HG2 GLU 26 35.263 29.418 26.587 168 HG3 GLU 26 HG3 GLU 26 33.892 29.537 27.322 169 H ILE 27 H ILE 27 31.441 32.787 26.965 170 HA ILE 27 HA ILE 27 29.516 31.192 27.995 171 HB ILE 27 HB ILE 27 29.883 32.110 30.155 172 HG12 ILE 27 HG12 ILE 27 32.436 32.873 29.234 173 HG13 ILE 27 HG13 ILE 27 31.303 33.885 29.587 174 HG21 ILE 27 HG21 ILE 27 31.524 30.484 30.737 175 HG22 ILE 27 HG22 ILE 27 30.462 29.863 29.739 176 HG23 ILE 27 HG23 ILE 27 31.883 30.314 29.204 177 HD11 ILE 27 HD11 ILE 27 32.836 33.779 31.360 178 HD12 ILE 27 HD12 ILE 27 31.430 33.251 31.864 179 HD13 ILE 27 HD13 ILE 27 32.580 32.223 31.505 180 H LYS 28 H LYS 28 27.537 32.436 28.606 181 HA LYS 28 HA LYS 28 27.029 34.519 27.035 182 HB2 LYS 28 HB2 LYS 28 25.272 33.279 28.876 183 HB3 LYS 28 HB3 LYS 28 24.818 34.315 27.802 184 HG2 LYS 28 HG2 LYS 28 25.798 31.725 27.173 185 HG3 LYS 28 HG3 LYS 28 24.288 32.115 27.124 186 HD2 LYS 28 HD2 LYS 28 24.722 33.578 25.309 187 HD3 LYS 28 HD3 LYS 28 26.235 33.204 25.364 188 HE2 LYS 28 HE2 LYS 28 25.650 30.922 24.846 189 HE3 LYS 28 HE3 LYS 28 24.161 31.364 24.698 190 HZ1 LYS 28 HZ1 LYS 28 25.170 31.322 22.657 191 HZ2 LYS 28 HZ2 LYS 28 24.787 32.695 22.943 192 HZ3 LYS 28 HZ3 LYS 28 26.174 32.283 23.081 193 H ASP 29 H ASP 29 28.005 36.557 27.706 194 HA ASP 29 HA ASP 29 28.129 37.249 30.228 195 HB2 ASP 29 HB2 ASP 29 29.594 38.110 28.438 196 HB3 ASP 29 HB3 ASP 29 28.486 39.183 28.198 197 HA PRO 30 HA PRO 30 24.116 39.695 29.673 198 HB2 PRO 30 HB2 PRO 30 22.736 37.646 28.258 199 HB3 PRO 30 HB3 PRO 30 22.429 39.174 28.194 200 HG2 PRO 30 HG2 PRO 30 23.739 38.215 26.243 201 HG3 PRO 30 HG3 PRO 30 24.232 39.591 26.789 202 HD2 PRO 30 HD2 PRO 30 25.348 37.042 27.391 203 HD3 PRO 30 HD3 PRO 30 26.147 38.347 27.089 204 H ARG 31 H ARG 31 24.472 36.407 30.438 205 HA ARG 31 HA ARG 31 22.776 36.152 32.443 206 HB2 ARG 31 HB2 ARG 31 23.921 34.418 31.073 207 HB3 ARG 31 HB3 ARG 31 25.109 34.593 32.069 208 HG2 ARG 31 HG2 ARG 31 23.936 33.658 33.795 209 HG3 ARG 31 HG3 ARG 31 22.573 33.821 33.055 210 HD2 ARG 31 HD2 ARG 31 23.277 31.557 32.985 211 HD3 ARG 31 HD3 ARG 31 23.130 32.123 31.539 212 HE ARG 31 HE ARG 31 25.644 32.141 32.600 213 HH11 ARG 31 HH11 ARG 31 27.322 31.335 31.453 214 HH12 ARG 31 HH12 ARG 31 27.088 30.423 30.299 215 HH21 ARG 31 HH21 ARG 31 23.867 30.470 30.334 216 HH22 ARG 31 HH22 ARG 31 25.062 29.914 29.640 217 H LEU 32 H LEU 32 25.763 37.664 32.493 218 HA LEU 32 HA LEU 32 25.687 38.267 35.127 219 HB2 LEU 32 HB2 LEU 32 27.851 38.457 33.281 220 HB3 LEU 32 HB3 LEU 32 27.974 38.992 34.742 221 HG LEU 32 HG LEU 32 27.609 36.258 34.149 222 HD11 LEU 32 HD11 LEU 32 29.934 36.013 34.687 223 HD12 LEU 32 HD12 LEU 32 29.770 36.993 33.454 224 HD13 LEU 32 HD13 LEU 32 30.035 37.578 34.902 225 HD21 LEU 32 HD21 LEU 32 28.194 35.832 36.397 226 HD22 LEU 32 HD22 LEU 32 28.306 37.390 36.658 227 HD23 LEU 32 HD23 LEU 32 26.898 36.741 36.334 228 H GLY 33 H GLY 33 24.360 39.718 32.645 229 HA2 GLY 33 HA2 GLY 33 23.355 41.649 32.621 230 HA3 GLY 33 HA3 GLY 33 24.421 42.224 33.603 231 H MET 34 H MET 34 25.890 40.808 30.926 232 HA MET 34 HA MET 34 27.022 41.446 29.259 233 HB2 MET 34 HB2 MET 34 24.776 41.661 28.435 234 HB3 MET 34 HB3 MET 34 24.873 43.193 28.708 235 HG2 MET 34 HG2 MET 34 25.250 42.633 26.427 236 HG3 MET 34 HG3 MET 34 26.394 43.499 27.038 237 HE1 MET 34 HE1 MET 34 28.692 41.800 24.804 238 HE2 MET 34 HE2 MET 34 27.334 42.569 24.533 239 HE3 MET 34 HE3 MET 34 28.377 43.149 25.573 240 H MET 35 H MET 35 28.031 42.598 31.542 241 HA MET 35 HA MET 35 29.615 44.569 30.665 242 HB2 MET 35 HB2 MET 35 27.705 45.769 31.346 243 HB3 MET 35 HB3 MET 35 27.870 45.192 32.785 244 HG2 MET 35 HG2 MET 35 28.656 47.451 32.468 245 HG3 MET 35 HG3 MET 35 29.615 46.505 33.254 246 HE1 MET 35 HE1 MET 35 30.369 47.693 29.018 247 HE2 MET 35 HE2 MET 35 29.256 46.642 29.422 248 HE3 MET 35 HE3 MET 35 29.091 48.164 29.826 249 H THR 36 H THR 36 30.446 42.059 31.233 250 HA THR 36 HA THR 36 32.089 42.356 33.366 251 HB THR 36 HB THR 36 31.942 39.937 31.999 252 HG1 THR 36 HG1 THR 36 30.030 39.673 32.673 253 HG21 THR 36 HG21 THR 36 32.543 38.974 34.076 254 HG22 THR 36 HG22 THR 36 33.611 40.054 33.630 255 HG23 THR 36 HG23 THR 36 32.531 40.417 34.730 256 H THR 37 H THR 37 34.332 42.817 32.962 257 HA THR 37 HA THR 37 35.416 42.639 30.502 258 HB THR 37 HB THR 37 36.086 44.848 30.496 259 HG1 THR 37 HG1 THR 37 35.202 46.227 31.996 260 HG21 THR 37 HG21 THR 37 34.043 45.965 30.057 261 HG22 THR 37 HG22 THR 37 34.075 44.539 29.369 262 HG23 THR 37 HG23 THR 37 33.263 44.753 30.713 263 H VAL 38 H VAL 38 37.930 43.312 30.559 264 HA VAL 38 HA VAL 38 39.104 42.074 32.689 265 HB VAL 38 HB VAL 38 40.078 42.249 30.066 266 HG11 VAL 38 HG11 VAL 38 41.815 40.735 30.668 267 HG12 VAL 38 HG12 VAL 38 41.928 42.084 31.490 268 HG13 VAL 38 HG13 VAL 38 41.316 40.790 32.170 269 HG21 VAL 38 HG21 VAL 38 39.719 39.878 29.924 270 HG22 VAL 38 HG22 VAL 38 39.100 39.910 31.380 271 HG23 VAL 38 HG23 VAL 38 38.354 40.637 30.187 272 H SER 39 H SER 39 40.000 43.568 34.176 273 HA SER 39 HA SER 39 40.763 45.987 33.359 274 HB2 SER 39 HB2 SER 39 40.706 46.620 35.623 275 HB3 SER 39 HB3 SER 39 39.406 45.810 35.335 276 HG SER 39 HG SER 39 40.776 45.192 37.126 277 H GLY 40 H GLY 40 42.601 43.294 33.787 278 HA2 GLY 40 HA2 GLY 40 44.857 44.340 33.102 279 HA3 GLY 40 HA3 GLY 40 44.893 44.196 34.655 280 H VAL 41 H VAL 41 46.722 42.828 32.995 281 HA VAL 41 HA VAL 41 46.390 40.324 33.934 282 HB VAL 41 HB VAL 41 47.583 39.408 32.173 283 HG11 VAL 41 HG11 VAL 41 45.819 39.444 30.550 284 HG12 VAL 41 HG12 VAL 41 45.241 39.262 32.013 285 HG13 VAL 41 HG13 VAL 41 45.181 40.680 31.309 286 HG21 VAL 41 HG21 VAL 41 47.904 40.557 30.137 287 HG22 VAL 41 HG22 VAL 41 47.413 41.891 30.834 288 HG23 VAL 41 HG23 VAL 41 48.758 41.200 31.305 289 H GLU 42 H GLU 42 48.288 39.271 34.891 290 HA GLU 42 HA GLU 42 50.709 40.509 34.714 291 HB2 GLU 42 HB2 GLU 42 49.963 40.487 36.963 292 HB3 GLU 42 HB3 GLU 42 49.912 38.929 36.919 293 HG2 GLU 42 HG2 GLU 42 52.325 39.051 36.334 294 HG3 GLU 42 HG3 GLU 42 52.254 40.524 36.841 295 H MET 43 H MET 43 52.123 39.325 33.389 296 HA MET 43 HA MET 43 51.691 36.715 32.834 297 HB2 MET 43 HB2 MET 43 53.011 38.640 31.227 298 HB3 MET 43 HB3 MET 43 52.870 37.144 30.812 299 HG2 MET 43 HG2 MET 43 50.508 37.385 30.750 300 HG3 MET 43 HG3 MET 43 50.651 38.883 31.162 301 HE1 MET 43 HE1 MET 43 52.043 40.649 28.178 302 HE2 MET 43 HE2 MET 43 51.397 40.842 29.611 303 HE3 MET 43 HE3 MET 43 52.812 40.145 29.468 304 H SER 44 H SER 44 53.345 35.119 32.920 305 HA SER 44 HA SER 44 55.453 35.419 34.493 306 HB2 SER 44 HB2 SER 44 54.401 33.328 34.342 307 HB3 SER 44 HB3 SER 44 54.677 33.263 32.808 308 HG SER 44 HG SER 44 56.501 32.482 33.223 309 H ARG 45 H ARG 45 57.705 35.498 33.984 310 HA ARG 45 HA ARG 45 58.739 36.662 31.906 311 HB2 ARG 45 HB2 ARG 45 59.708 36.431 34.130 312 HB3 ARG 45 HB3 ARG 45 59.991 34.929 33.817 313 HG2 ARG 45 HG2 ARG 45 61.597 35.546 32.197 314 HG3 ARG 45 HG3 ARG 45 61.287 37.054 32.442 315 HD2 ARG 45 HD2 ARG 45 62.388 35.382 34.464 316 HD3 ARG 45 HD3 ARG 45 63.269 36.326 33.591 317 HE ARG 45 HE ARG 45 61.875 38.071 34.588 318 HH11 ARG 45 HH11 ARG 45 61.550 39.008 36.548 319 HH12 ARG 45 HH12 ARG 45 61.982 38.324 37.800 320 HH21 ARG 45 HH21 ARG 45 63.074 35.605 36.463 321 HH22 ARG 45 HH22 ARG 45 62.877 36.328 37.749 322 H ASP 46 H ASP 46 57.998 33.377 31.973 323 HA ASP 46 HA ASP 46 59.186 32.859 29.608 324 HB2 ASP 46 HB2 ASP 46 59.010 30.588 30.185 325 HB3 ASP 46 HB3 ASP 46 59.747 31.349 31.330 326 H LEU 47 H LEU 47 56.291 33.913 30.260 327 HA LEU 47 HA LEU 47 54.292 33.779 29.634 328 HB2 LEU 47 HB2 LEU 47 55.429 33.230 27.098 329 HB3 LEU 47 HB3 LEU 47 53.975 33.757 27.302 330 HG LEU 47 HG LEU 47 56.266 35.272 27.952 331 HD11 LEU 47 HD11 LEU 47 55.773 36.572 25.997 332 HD12 LEU 47 HD12 LEU 47 56.055 35.068 25.592 333 HD13 LEU 47 HD13 LEU 47 54.565 35.599 25.675 334 HD21 LEU 47 HD21 LEU 47 54.837 37.146 28.166 335 HD22 LEU 47 HD22 LEU 47 53.588 36.214 27.883 336 HD23 LEU 47 HD23 LEU 47 54.435 36.022 29.208 337 H ALA 48 H ALA 48 55.138 31.219 30.789 338 HA ALA 48 HA ALA 48 53.472 29.405 29.690 339 HB1 ALA 48 HB1 ALA 48 54.463 27.923 31.252 340 HB2 ALA 48 HB2 ALA 48 55.585 28.644 30.399 341 HB3 ALA 48 HB3 ALA 48 55.275 29.133 31.872 342 H TYR 49 H TYR 49 53.152 31.635 32.157 343 HA TYR 49 HA TYR 49 50.741 30.744 33.014 344 HB2 TYR 49 HB2 TYR 49 52.734 31.586 34.859 345 HB3 TYR 49 HB3 TYR 49 51.318 31.071 35.259 346 HD1 TYR 49 HD1 TYR 49 50.764 28.620 34.752 347 HD2 TYR 49 HD2 TYR 49 54.572 30.020 34.744 348 HE1 TYR 49 HE1 TYR 49 51.574 26.425 34.789 349 HE2 TYR 49 HE2 TYR 49 55.374 27.823 34.718 350 HH TYR 49 HH TYR 49 54.838 25.609 34.649 351 H ALA 50 H ALA 50 49.165 32.444 33.323 352 HA ALA 50 HA ALA 50 49.980 34.936 33.864 353 HB1 ALA 50 HB1 ALA 50 48.554 35.894 32.239 354 HB2 ALA 50 HB2 ALA 50 49.674 35.014 31.546 355 HB3 ALA 50 HB3 ALA 50 48.205 34.443 31.706 356 H LYS 51 H LYS 51 48.738 36.110 35.292 357 HA LYS 51 HA LYS 51 46.444 35.171 36.401 358 HB2 LYS 51 HB2 LYS 51 48.108 37.235 37.377 359 HB3 LYS 51 HB3 LYS 51 46.888 36.637 38.143 360 HG2 LYS 51 HG2 LYS 51 48.023 34.567 38.370 361 HG3 LYS 51 HG3 LYS 51 49.232 35.127 37.559 362 HD2 LYS 51 HD2 LYS 51 49.605 36.712 39.371 363 HD3 LYS 51 HD3 LYS 51 48.527 35.942 40.192 364 HE2 LYS 51 HE2 LYS 51 49.850 33.940 39.965 365 HE3 LYS 51 HE3 LYS 51 50.954 34.785 39.259 366 HZ1 LYS 51 HZ1 LYS 51 51.469 34.504 41.451 367 HZ2 LYS 51 HZ2 LYS 51 51.259 35.922 41.219 368 HZ3 LYS 51 HZ3 LYS 51 50.230 35.135 41.876 369 H VAL 52 H VAL 52 44.443 36.070 35.740 370 HA VAL 52 HA VAL 52 44.387 38.343 34.240 371 HB VAL 52 HB VAL 52 42.555 36.227 34.058 372 HG11 VAL 52 HG11 VAL 52 41.721 37.329 32.089 373 HG12 VAL 52 HG12 VAL 52 41.559 38.266 33.356 374 HG13 VAL 52 HG13 VAL 52 42.749 38.509 32.338 375 HG21 VAL 52 HG21 VAL 52 43.496 35.694 31.936 376 HG22 VAL 52 HG22 VAL 52 44.596 36.812 32.161 377 HG23 VAL 52 HG23 VAL 52 44.575 35.524 33.083 378 H TYR 53 H TYR 53 43.185 40.101 35.053 379 HA TYR 53 HA TYR 53 41.586 39.802 37.215 380 HB2 TYR 53 HB2 TYR 53 42.961 42.118 36.349 381 HB3 TYR 53 HB3 TYR 53 41.968 42.141 37.551 382 HD1 TYR 53 HD1 TYR 53 42.539 40.976 39.660 383 HD2 TYR 53 HD2 TYR 53 45.223 41.205 36.630 384 HE1 TYR 53 HE1 TYR 53 44.225 40.249 41.100 385 HE2 TYR 53 HE2 TYR 53 46.927 40.511 38.077 386 HH TYR 53 HH TYR 53 47.458 39.890 40.185 387 H VAL 54 H VAL 54 39.386 40.268 37.167 388 HA VAL 54 HA VAL 54 38.219 41.148 34.873 389 HB VAL 54 HB VAL 54 37.353 38.944 36.380 390 HG11 VAL 54 HG11 VAL 54 35.755 38.500 34.672 391 HG12 VAL 54 HG12 VAL 54 35.495 39.914 35.336 392 HG13 VAL 54 HG13 VAL 54 36.212 39.820 33.927 393 HG21 VAL 54 HG21 VAL 54 37.946 37.571 34.494 394 HG22 VAL 54 HG22 VAL 54 38.514 38.859 33.767 395 HG23 VAL 54 HG23 VAL 54 39.224 38.306 35.071 396 H THR 55 H THR 55 36.322 42.462 35.168 397 HA THR 55 HA THR 55 35.534 43.145 37.680 398 HB THR 55 HB THR 55 37.032 44.695 36.887 399 HG1 THR 55 HG1 THR 55 35.730 45.635 38.256 400 HG21 THR 55 HG21 THR 55 36.488 46.313 35.312 401 HG22 THR 55 HG22 THR 55 36.654 44.880 34.657 402 HG23 THR 55 HG23 THR 55 35.208 45.472 34.913 403 H PHE 56 H PHE 56 33.375 43.322 38.065 404 HA PHE 56 HA PHE 56 31.661 42.493 36.133 405 HB2 PHE 56 HB2 PHE 56 31.702 41.845 38.896 406 HB3 PHE 56 HB3 PHE 56 30.533 41.406 37.962 407 HD1 PHE 56 HD1 PHE 56 34.062 40.811 38.323 408 HD2 PHE 56 HD2 PHE 56 30.559 39.232 37.054 409 HE1 PHE 56 HE1 PHE 56 35.103 38.747 38.008 410 HE2 PHE 56 HE2 PHE 56 31.597 37.161 36.767 411 HZ PHE 56 HZ PHE 56 33.874 36.914 37.278 412 H LEU 57 H LEU 57 29.629 43.627 35.840 413 HA LEU 57 HA LEU 57 28.702 45.499 37.511 414 HB2 LEU 57 HB2 LEU 57 28.188 45.506 35.190 415 HB3 LEU 57 HB3 LEU 57 27.412 44.163 35.361 416 HG LEU 57 HG LEU 57 25.827 45.266 36.704 417 HD11 LEU 57 HD11 LEU 57 25.740 47.626 36.770 418 HD12 LEU 57 HD12 LEU 57 27.057 47.099 37.475 419 HD13 LEU 57 HD13 LEU 57 27.126 47.688 36.007 420 HD21 LEU 57 HD21 LEU 57 24.754 46.447 34.907 421 HD22 LEU 57 HD22 LEU 57 26.122 46.441 34.111 422 HD23 LEU 57 HD23 LEU 57 25.356 45.082 34.377 423 H ASN 58 H ASN 58 28.513 42.163 37.601 424 HA ASN 58 HA ASN 58 26.461 41.777 39.315 425 HB2 ASN 58 HB2 ASN 58 27.028 40.282 37.523 426 HB3 ASN 58 HB3 ASN 58 28.380 39.976 38.239 427 HD21 ASN 58 HD21 ASN 58 25.171 38.447 39.881 428 HD22 ASN 58 HD22 ASN 58 25.124 39.854 39.393 429 H ASP 59 H ASP 59 29.215 43.072 40.019 430 HA ASP 59 HA ASP 59 30.134 42.333 42.316 431 HB2 ASP 59 HB2 ASP 59 31.284 43.897 41.040 432 HB3 ASP 59 HB3 ASP 59 30.005 44.766 40.835 433 H LYS 60 H LYS 60 27.087 43.504 41.934 434 HA LYS 60 HA LYS 60 26.489 44.708 44.198 435 HB2 LYS 60 HB2 LYS 60 25.233 44.822 42.123 436 HB3 LYS 60 HB3 LYS 60 24.816 43.332 42.320 437 HG2 LYS 60 HG2 LYS 60 23.496 43.877 44.153 438 HG3 LYS 60 HG3 LYS 60 24.036 45.340 44.162 439 HD2 LYS 60 HD2 LYS 60 22.901 45.852 42.191 440 HD3 LYS 60 HD3 LYS 60 22.545 44.354 41.947 441 HE2 LYS 60 HE2 LYS 60 20.639 45.342 42.799 442 HE3 LYS 60 HE3 LYS 60 21.177 44.389 43.909 443 HZ1 LYS 60 HZ1 LYS 60 20.653 46.409 44.802 444 HZ2 LYS 60 HZ2 LYS 60 22.084 46.208 44.956 445 HZ3 LYS 60 HZ3 LYS 60 21.582 47.096 43.921 446 H ASP 61 H ASP 61 26.939 41.365 43.854 447 HA ASP 61 HA ASP 61 26.865 41.227 46.545 448 HB2 ASP 61 HB2 ASP 61 24.841 40.206 45.564 449 HB3 ASP 61 HB3 ASP 61 25.786 39.053 45.102 450 H GLU 62 H GLU 62 28.795 40.442 47.394 451 HA GLU 62 HA GLU 62 30.827 39.856 45.938 452 HB2 GLU 62 HB2 GLU 62 30.588 39.334 48.725 453 HB3 GLU 62 HB3 GLU 62 31.954 39.375 47.973 454 HG2 GLU 62 HG2 GLU 62 32.074 41.423 48.750 455 HG3 GLU 62 HG3 GLU 62 31.189 41.783 47.517 456 H ASP 63 H ASP 63 28.620 37.618 47.280 457 HA ASP 63 HA ASP 63 29.752 35.305 46.887 458 HB2 ASP 63 HB2 ASP 63 27.910 35.284 48.245 459 HB3 ASP 63 HB3 ASP 63 27.067 36.137 47.250 460 H ALA 64 H ALA 64 27.830 37.115 44.639 461 HA ALA 64 HA ALA 64 27.684 35.344 42.687 462 HB1 ALA 64 HB1 ALA 64 26.750 37.106 41.477 463 HB2 ALA 64 HB2 ALA 64 26.069 37.006 42.904 464 HB3 ALA 64 HB3 ALA 64 27.163 38.116 42.624 465 H VAL 65 H VAL 65 30.014 37.890 43.193 466 HA VAL 65 HA VAL 65 31.498 37.533 41.061 467 HB VAL 65 HB VAL 65 32.280 38.643 43.530 468 HG11 VAL 65 HG11 VAL 65 34.078 39.680 42.375 469 HG12 VAL 65 HG12 VAL 65 34.205 38.105 42.281 470 HG13 VAL 65 HG13 VAL 65 33.645 38.928 41.050 471 HG21 VAL 65 HG21 VAL 65 31.915 40.765 42.484 472 HG22 VAL 65 HG22 VAL 65 31.436 40.018 41.172 473 HG23 VAL 65 HG23 VAL 65 30.570 39.927 42.495 474 H LYS 66 H LYS 66 31.914 36.054 44.200 475 HA LYS 66 HA LYS 66 34.022 34.551 43.811 476 HB2 LYS 66 HB2 LYS 66 33.077 35.077 45.942 477 HB3 LYS 66 HB3 LYS 66 31.861 34.155 45.620 478 HG2 LYS 66 HG2 LYS 66 33.158 32.924 47.033 479 HG3 LYS 66 HG3 LYS 66 33.387 32.272 45.635 480 HD2 LYS 66 HD2 LYS 66 35.434 33.326 45.396 481 HD3 LYS 66 HD3 LYS 66 35.178 34.213 46.654 482 HE2 LYS 66 HE2 LYS 66 36.724 32.539 47.203 483 HE3 LYS 66 HE3 LYS 66 35.438 32.341 48.064 484 HZ1 LYS 66 HZ1 LYS 66 36.106 30.361 47.194 485 HZ2 LYS 66 HZ2 LYS 66 34.802 30.680 46.638 486 HZ3 LYS 66 HZ3 LYS 66 36.000 30.865 45.835 487 H ALA 67 H ALA 67 30.762 33.604 43.190 488 HA ALA 67 HA ALA 67 31.200 31.246 42.136 489 HB1 ALA 67 HB1 ALA 67 28.883 31.425 41.549 490 HB2 ALA 67 HB2 ALA 67 29.087 31.840 43.064 491 HB3 ALA 67 HB3 ALA 67 28.911 32.956 41.953 492 H GLY 68 H GLY 68 30.885 34.291 40.481 493 HA2 GLY 68 HA2 GLY 68 30.907 33.556 38.006 494 HA3 GLY 68 HA3 GLY 68 31.351 34.960 38.521 495 H ILE 69 H ILE 69 33.688 34.349 39.960 496 HA ILE 69 HA ILE 69 35.619 33.808 38.284 497 HB ILE 69 HB ILE 69 35.638 33.939 41.071 498 HG12 ILE 69 HG12 ILE 69 35.347 36.056 40.128 499 HG13 ILE 69 HG13 ILE 69 36.714 36.021 40.877 500 HG21 ILE 69 HG21 ILE 69 38.027 33.959 41.063 501 HG22 ILE 69 HG22 ILE 69 37.466 32.575 40.534 502 HG23 ILE 69 HG23 ILE 69 38.001 33.657 39.509 503 HD11 ILE 69 HD11 ILE 69 36.970 37.147 38.839 504 HD12 ILE 69 HD12 ILE 69 37.854 35.833 38.813 505 HD13 ILE 69 HD13 ILE 69 36.466 35.869 38.052 506 H LYS 70 H LYS 70 34.101 31.572 40.538 507 HA LYS 70 HA LYS 70 35.500 29.434 40.056 508 HB2 LYS 70 HB2 LYS 70 34.102 29.421 41.899 509 HB3 LYS 70 HB3 LYS 70 32.841 29.681 41.019 510 HG2 LYS 70 HG2 LYS 70 32.919 27.521 40.159 511 HG3 LYS 70 HG3 LYS 70 34.296 27.254 40.841 512 HD2 LYS 70 HD2 LYS 70 33.288 27.266 42.971 513 HD3 LYS 70 HD3 LYS 70 31.914 27.658 42.348 514 HE2 LYS 70 HE2 LYS 70 31.778 25.591 41.231 515 HE3 LYS 70 HE3 LYS 70 33.214 25.208 41.703 516 HZ1 LYS 70 HZ1 LYS 70 31.667 24.205 43.020 517 HZ2 LYS 70 HZ2 LYS 70 32.431 25.126 43.844 518 HZ3 LYS 70 HZ3 LYS 70 31.093 25.482 43.404 519 H ALA 71 H ALA 71 32.665 30.400 38.291 520 HA ALA 71 HA ALA 71 32.511 28.363 36.625 521 HB1 ALA 71 HB1 ALA 71 30.875 29.731 35.571 522 HB2 ALA 71 HB2 ALA 71 30.634 29.721 37.136 523 HB3 ALA 71 HB3 ALA 71 31.344 30.961 36.452 524 H LEU 72 H LEU 72 34.093 31.387 36.196 525 HA LEU 72 HA LEU 72 34.947 31.133 33.702 526 HB2 LEU 72 HB2 LEU 72 34.610 33.218 34.842 527 HB3 LEU 72 HB3 LEU 72 35.825 32.885 35.762 528 HG LEU 72 HG LEU 72 37.255 32.992 33.901 529 HD11 LEU 72 HD11 LEU 72 36.480 33.890 31.864 530 HD12 LEU 72 HD12 LEU 72 35.747 32.520 32.173 531 HD13 LEU 72 HD13 LEU 72 35.003 33.894 32.435 532 HD21 LEU 72 HD21 LEU 72 37.176 35.371 33.657 533 HD22 LEU 72 HD22 LEU 72 35.717 35.371 34.273 534 HD23 LEU 72 HD23 LEU 72 36.957 34.977 35.174 535 H GLN 73 H GLN 73 36.551 30.353 36.661 536 HA GLN 73 HA GLN 73 38.868 29.518 35.731 537 HB2 GLN 73 HB2 GLN 73 38.433 30.163 38.009 538 HB3 GLN 73 HB3 GLN 73 37.622 28.844 38.193 539 HG2 GLN 73 HG2 GLN 73 39.745 28.550 39.109 540 HG3 GLN 73 HG3 GLN 73 39.582 27.570 37.907 541 HE21 GLN 73 HE21 GLN 73 41.503 27.416 36.849 542 HE22 GLN 73 HE22 GLN 73 42.418 28.538 36.495 543 H GLU 74 H GLU 74 35.974 27.639 36.199 544 HA GLU 74 HA GLU 74 36.902 25.315 35.387 545 HB2 GLU 74 HB2 GLU 74 34.889 25.628 36.707 546 HB3 GLU 74 HB3 GLU 74 34.173 26.114 35.409 547 HG2 GLU 74 HG2 GLU 74 34.216 24.045 34.471 548 HG3 GLU 74 HG3 GLU 74 35.344 23.548 35.426 549 H ALA 75 H ALA 75 35.812 27.906 33.467 550 HA ALA 75 HA ALA 75 35.873 26.603 31.128 551 HB1 ALA 75 HB1 ALA 75 35.119 28.720 30.280 552 HB2 ALA 75 HB2 ALA 75 34.193 28.254 31.477 553 HB3 ALA 75 HB3 ALA 75 35.314 29.346 31.721 554 H SER 76 H SER 76 38.406 27.784 32.792 555 HA SER 76 HA SER 76 39.579 29.493 31.287 556 HB2 SER 76 HB2 SER 76 41.499 29.134 32.685 557 HB3 SER 76 HB3 SER 76 40.213 29.276 33.553 558 HG SER 76 HG SER 76 40.272 27.240 33.994 559 H GLY 77 H GLY 77 40.140 26.089 31.031 560 HA2 GLY 77 HA2 GLY 77 42.159 26.064 29.369 561 HA3 GLY 77 HA3 GLY 77 41.215 24.857 29.664 562 H PHE 78 H PHE 78 38.753 26.095 28.625 563 HA PHE 78 HA PHE 78 38.901 25.780 26.011 564 HB2 PHE 78 HB2 PHE 78 36.747 26.743 27.587 565 HB3 PHE 78 HB3 PHE 78 36.604 26.447 26.063 566 HD1 PHE 78 HD1 PHE 78 35.785 25.126 28.982 567 HD2 PHE 78 HD2 PHE 78 37.405 23.894 25.486 568 HE1 PHE 78 HE1 PHE 78 35.194 22.915 29.480 569 HE2 PHE 78 HE2 PHE 78 36.754 21.698 25.951 570 HZ PHE 78 HZ PHE 78 35.661 21.206 27.960 571 H ILE 79 H ILE 79 38.771 28.638 27.949 572 HA ILE 79 HA ILE 79 38.809 30.527 26.134 573 HB ILE 79 HB ILE 79 39.592 30.617 28.855 574 HG12 ILE 79 HG12 ILE 79 37.181 31.639 27.742 575 HG13 ILE 79 HG13 ILE 79 37.242 30.209 28.362 576 HG21 ILE 79 HG21 ILE 79 39.564 32.957 28.755 577 HG22 ILE 79 HG22 ILE 79 40.680 32.375 27.794 578 HG23 ILE 79 HG23 ILE 79 39.307 32.886 27.194 579 HD11 ILE 79 HD11 ILE 79 36.325 31.699 29.922 580 HD12 ILE 79 HD12 ILE 79 37.694 31.138 30.488 581 HD13 ILE 79 HD13 ILE 79 37.633 32.591 29.857 582 H ARG 80 H ARG 80 41.541 28.931 27.627 583 HA ARG 80 HA ARG 80 43.524 30.147 26.506 584 HB2 ARG 80 HB2 ARG 80 43.448 28.275 28.275 585 HB3 ARG 80 HB3 ARG 80 43.819 27.390 27.046 586 HG2 ARG 80 HG2 ARG 80 45.642 29.132 26.754 587 HG3 ARG 80 HG3 ARG 80 45.422 29.332 28.286 588 HD2 ARG 80 HD2 ARG 80 46.452 27.038 27.025 589 HD3 ARG 80 HD3 ARG 80 47.139 27.867 28.155 590 HE ARG 80 HE ARG 80 45.642 26.879 29.650 591 HH11 ARG 80 HH11 ARG 80 44.856 24.981 30.416 592 HH12 ARG 80 HH12 ARG 80 44.819 23.771 29.549 593 HH21 ARG 80 HH21 ARG 80 46.020 25.096 26.874 594 HH22 ARG 80 HH22 ARG 80 45.500 23.836 27.475 595 H SER 81 H SER 81 41.907 27.357 25.220 596 HA SER 81 HA SER 81 43.256 26.964 23.042 597 HB2 SER 81 HB2 SER 81 41.803 25.312 23.910 598 HB3 SER 81 HB3 SER 81 40.568 26.217 23.610 599 HG SER 81 HG SER 81 40.876 24.760 22.006 600 H LEU 82 H LEU 82 40.373 28.876 23.366 601 HA LEU 82 HA LEU 82 40.049 29.644 20.891 602 HB2 LEU 82 HB2 LEU 82 39.012 30.671 23.337 603 HB3 LEU 82 HB3 LEU 82 38.617 31.344 21.987 604 HG LEU 82 HG LEU 82 38.056 28.614 22.472 605 HD11 LEU 82 HD11 LEU 82 35.828 29.267 23.024 606 HD12 LEU 82 HD12 LEU 82 36.848 29.909 24.052 607 HD13 LEU 82 HD13 LEU 82 36.249 30.787 22.877 608 HD21 LEU 82 HD21 LEU 82 36.508 28.785 20.718 609 HD22 LEU 82 HD22 LEU 82 36.910 30.303 20.515 610 HD23 LEU 82 HD23 LEU 82 37.960 29.158 20.206 611 H LEU 83 H LEU 83 41.848 31.207 23.380 612 HA LEU 83 HA LEU 83 42.568 33.451 22.207 613 HB2 LEU 83 HB2 LEU 83 42.604 33.126 24.554 614 HB3 LEU 83 HB3 LEU 83 43.733 32.062 24.392 615 HG LEU 83 HG LEU 83 45.183 33.758 23.619 616 HD11 LEU 83 HD11 LEU 83 44.605 36.023 23.911 617 HD12 LEU 83 HD12 LEU 83 43.638 35.342 22.857 618 HD13 LEU 83 HD13 LEU 83 43.144 35.589 24.341 619 HD21 LEU 83 HD21 LEU 83 45.528 34.740 25.774 620 HD22 LEU 83 HD22 LEU 83 44.086 34.251 26.212 621 HD23 LEU 83 HD23 LEU 83 45.230 33.192 25.929 622 H GLY 84 H GLY 84 44.373 30.482 22.428 623 HA2 GLY 84 HA2 GLY 84 46.414 31.037 20.928 624 HA3 GLY 84 HA3 GLY 84 45.908 29.597 21.246 625 H LYS 85 H LYS 85 43.307 29.878 19.891 626 HA LYS 85 HA LYS 85 43.761 29.508 17.325 627 HB2 LYS 85 HB2 LYS 85 41.919 28.481 18.408 628 HB3 LYS 85 HB3 LYS 85 41.247 29.877 18.586 629 HG2 LYS 85 HG2 LYS 85 40.934 30.117 16.315 630 HG3 LYS 85 HG3 LYS 85 41.873 28.913 15.998 631 HD2 LYS 85 HD2 LYS 85 39.833 28.049 15.631 632 HD3 LYS 85 HD3 LYS 85 40.182 27.495 17.047 633 HE2 LYS 85 HE2 LYS 85 38.857 29.194 18.037 634 HE3 LYS 85 HE3 LYS 85 38.508 29.746 16.621 635 HZ1 LYS 85 HZ1 LYS 85 36.839 28.397 17.365 636 HZ2 LYS 85 HZ2 LYS 85 37.420 27.784 16.182 637 HZ3 LYS 85 HZ3 LYS 85 37.745 27.269 17.501 638 H ALA 86 H ALA 86 42.461 32.343 18.887 639 HA ALA 86 HA ALA 86 41.978 33.749 16.719 640 HB1 ALA 86 HB1 ALA 86 41.548 35.501 18.279 641 HB2 ALA 86 HB2 ALA 86 40.828 34.172 18.753 642 HB3 ALA 86 HB3 ALA 86 42.187 34.622 19.431 643 H MET 87 H MET 87 44.716 33.981 18.854 644 HA MET 87 HA MET 87 45.983 35.837 17.465 645 HB2 MET 87 HB2 MET 87 46.764 34.341 19.772 646 HB3 MET 87 HB3 MET 87 47.736 35.391 19.152 647 HG2 MET 87 HG2 MET 87 46.093 37.099 19.630 648 HG3 MET 87 HG3 MET 87 45.255 36.023 20.384 649 HE1 MET 87 HE1 MET 87 46.695 38.338 23.097 650 HE2 MET 87 HE2 MET 87 46.336 38.763 21.614 651 HE3 MET 87 HE3 MET 87 45.343 37.842 22.436 652 H ARG 88 H ARG 88 45.841 32.695 16.719 653 HA ARG 88 HA ARG 88 47.000 31.144 15.832 654 HB2 ARG 88 HB2 ARG 88 48.049 33.208 14.217 655 HB3 ARG 88 HB3 ARG 88 48.001 31.700 13.820 656 HG2 ARG 88 HG2 ARG 88 45.548 31.872 14.018 657 HG3 ARG 88 HG3 ARG 88 45.749 33.417 14.064 658 HD2 ARG 88 HD2 ARG 88 45.298 32.997 11.872 659 HD3 ARG 88 HD3 ARG 88 46.837 33.241 11.892 660 HE ARG 88 HE ARG 88 45.908 30.663 11.956 661 HH11 ARG 88 HH11 ARG 88 46.429 29.231 10.423 662 HH12 ARG 88 HH12 ARG 88 47.522 29.516 9.453 663 HH21 ARG 88 HH21 ARG 88 48.157 32.531 10.400 664 HH22 ARG 88 HH22 ARG 88 48.542 31.460 9.438 665 H LEU 89 H LEU 89 48.046 31.142 18.137 666 HA LEU 89 HA LEU 89 50.591 32.080 18.341 667 HB2 LEU 89 HB2 LEU 89 48.676 32.909 19.683 668 HB3 LEU 89 HB3 LEU 89 48.781 31.559 20.457 669 HG LEU 89 HG LEU 89 50.978 32.200 21.138 670 HD11 LEU 89 HD11 LEU 89 51.565 34.488 21.007 671 HD12 LEU 89 HD12 LEU 89 51.421 33.882 19.551 672 HD13 LEU 89 HD13 LEU 89 50.258 34.769 20.157 673 HD21 LEU 89 HD21 LEU 89 50.161 33.704 22.831 674 HD22 LEU 89 HD22 LEU 89 48.856 33.943 21.967 675 HD23 LEU 89 HD23 LEU 89 49.122 32.526 22.621 676 H ARG 90 H ARG 90 52.349 30.889 19.099 677 HA ARG 90 HA ARG 90 52.176 28.188 19.159 678 HB2 ARG 90 HB2 ARG 90 53.764 29.159 17.692 679 HB3 ARG 90 HB3 ARG 90 54.477 29.836 18.902 680 HG2 ARG 90 HG2 ARG 90 55.211 27.770 19.706 681 HG3 ARG 90 HG3 ARG 90 54.351 27.008 18.651 682 HD2 ARG 90 HD2 ARG 90 56.588 28.612 17.953 683 HD3 ARG 90 HD3 ARG 90 56.652 27.056 18.042 684 HE ARG 90 HE ARG 90 55.096 28.319 16.165 685 HH11 ARG 90 HH11 ARG 90 54.705 27.309 14.236 686 HH12 ARG 90 HH12 ARG 90 55.550 26.154 13.821 687 HH21 ARG 90 HH21 ARG 90 57.330 25.879 16.445 688 HH22 ARG 90 HH22 ARG 90 57.056 25.333 15.086 689 H ILE 91 H ILE 91 53.126 30.575 21.471 690 HA ILE 91 HA ILE 91 52.744 28.728 23.405 691 HB ILE 91 HB ILE 91 54.160 29.951 24.842 692 HG12 ILE 91 HG12 ILE 91 55.313 31.184 22.594 693 HG13 ILE 91 HG13 ILE 91 54.386 31.941 23.594 694 HG21 ILE 91 HG21 ILE 91 56.136 28.847 24.012 695 HG22 ILE 91 HG22 ILE 91 54.883 27.882 23.923 696 HG23 ILE 91 HG23 ILE 91 55.403 28.627 22.626 697 HD11 ILE 91 HD11 ILE 91 56.634 32.394 24.120 698 HD12 ILE 91 HD12 ILE 91 55.971 31.615 25.328 699 HD13 ILE 91 HD13 ILE 91 56.912 30.846 24.314 700 H VAL 92 H VAL 92 50.747 29.059 24.358 701 HA VAL 92 HA VAL 92 49.883 31.537 25.100 702 HB VAL 92 HB VAL 92 48.451 30.410 23.695 703 HG11 VAL 92 HG11 VAL 92 47.079 28.668 24.475 704 HG12 VAL 92 HG12 VAL 92 48.594 28.215 24.374 705 HG13 VAL 92 HG13 VAL 92 47.968 28.578 25.783 706 HG21 VAL 92 HG21 VAL 92 46.463 30.949 24.924 707 HG22 VAL 92 HG22 VAL 92 47.335 31.049 26.242 708 HG23 VAL 92 HG23 VAL 92 47.546 32.095 25.071 709 HA PRO 93 HA PRO 93 50.843 30.436 29.220 710 HB2 PRO 93 HB2 PRO 93 49.416 32.638 30.155 711 HB3 PRO 93 HB3 PRO 93 50.937 32.369 30.368 712 HG2 PRO 93 HG2 PRO 93 50.183 34.236 28.739 713 HG3 PRO 93 HG3 PRO 93 51.521 33.479 28.475 714 HD2 PRO 93 HD2 PRO 93 49.047 33.023 27.195 715 HD3 PRO 93 HD3 PRO 93 50.460 32.931 26.543 716 H GLU 94 H GLU 94 49.811 29.141 30.856 717 HA GLU 94 HA GLU 94 47.232 28.544 30.765 718 HB2 GLU 94 HB2 GLU 94 48.744 27.027 31.684 719 HB3 GLU 94 HB3 GLU 94 49.058 28.017 32.846 720 HG2 GLU 94 HG2 GLU 94 47.593 26.455 33.711 721 HG3 GLU 94 HG3 GLU 94 46.791 27.788 33.608 722 H LEU 95 H LEU 95 45.430 29.587 31.718 723 HA LEU 95 HA LEU 95 45.852 32.061 32.719 724 HB2 LEU 95 HB2 LEU 95 43.512 31.110 31.415 725 HB3 LEU 95 HB3 LEU 95 43.735 32.594 31.836 726 HG LEU 95 HG LEU 95 45.174 31.299 29.788 727 HD11 LEU 95 HD11 LEU 95 43.999 32.730 28.287 728 HD12 LEU 95 HD12 LEU 95 42.981 31.820 29.090 729 HD13 LEU 95 HD13 LEU 95 43.198 33.331 29.514 730 HD21 LEU 95 HD21 LEU 95 46.143 33.369 29.234 731 HD22 LEU 95 HD22 LEU 95 45.431 34.027 30.486 732 HD23 LEU 95 HD23 LEU 95 46.555 32.931 30.699 733 H THR 96 H THR 96 45.426 32.468 34.888 734 HA THR 96 HA THR 96 43.469 31.106 36.225 735 HB THR 96 HB THR 96 45.791 32.147 37.380 736 HG1 THR 96 HG1 THR 96 46.243 29.962 37.685 737 HG21 THR 96 HG21 THR 96 45.128 31.072 39.396 738 HG22 THR 96 HG22 THR 96 44.049 32.150 38.971 739 HG23 THR 96 HG23 THR 96 43.782 30.614 38.697 740 H PHE 97 H PHE 97 41.792 32.355 37.198 741 HA PHE 97 HA PHE 97 41.720 34.978 36.522 742 HB2 PHE 97 HB2 PHE 97 39.608 33.085 36.639 743 HB3 PHE 97 HB3 PHE 97 39.317 34.605 36.450 744 HD1 PHE 97 HD1 PHE 97 39.767 35.702 34.306 745 HD2 PHE 97 HD2 PHE 97 40.577 31.756 34.762 746 HE1 PHE 97 HE1 PHE 97 40.015 35.487 31.994 747 HE2 PHE 97 HE2 PHE 97 40.884 31.565 32.458 748 HZ PHE 97 HZ PHE 97 40.609 33.423 31.067 749 H PHE 98 H PHE 98 41.079 36.631 37.818 750 HA PHE 98 HA PHE 98 40.577 36.365 40.458 751 HB2 PHE 98 HB2 PHE 98 42.621 38.004 39.365 752 HB3 PHE 98 HB3 PHE 98 42.184 38.092 40.859 753 HD1 PHE 98 HD1 PHE 98 43.107 36.537 42.498 754 HD2 PHE 98 HD2 PHE 98 43.952 36.022 38.572 755 HE1 PHE 98 HE1 PHE 98 44.793 35.023 43.064 756 HE2 PHE 98 HE2 PHE 98 45.591 34.465 39.134 757 HZ PHE 98 HZ PHE 98 46.007 33.951 41.378 758 H TYR 99 H TYR 99 39.486 38.357 41.407 759 HA TYR 99 HA TYR 99 38.115 39.841 39.635 760 HB2 TYR 99 HB2 TYR 99 36.354 39.849 40.912 761 HB3 TYR 99 HB3 TYR 99 36.978 38.510 41.411 762 HD1 TYR 99 HD1 TYR 99 36.240 41.791 42.374 763 HD2 TYR 99 HD2 TYR 99 37.969 38.369 43.672 764 HE1 TYR 99 HE1 TYR 99 36.313 42.655 44.550 765 HE2 TYR 99 HE2 TYR 99 38.006 39.207 45.860 766 HH TYR 99 HH TYR 99 37.543 40.986 47.203 767 H ASP 100 H ASP 100 38.172 42.109 39.465 768 HA ASP 100 HA ASP 100 39.267 43.621 41.444 769 HB2 ASP 100 HB2 ASP 100 40.889 43.518 39.797 770 HB3 ASP 100 HB3 ASP 100 39.847 43.858 38.688 Start of MODEL 20 1 HA PRO 8 HA PRO 8 56.236 43.632 25.583 2 HB2 PRO 8 HB2 PRO 8 54.930 41.577 26.338 3 HB3 PRO 8 HB3 PRO 8 56.473 41.425 26.171 4 HG2 PRO 8 HG2 PRO 8 55.083 41.845 28.624 5 HG3 PRO 8 HG3 PRO 8 56.254 40.841 28.393 6 HD2 PRO 8 HD2 PRO 8 56.730 43.173 29.425 7 HD3 PRO 8 HD3 PRO 8 57.831 42.443 28.597 8 H GLN 9 H GLN 9 55.387 45.951 26.466 9 HA GLN 9 HA GLN 9 53.095 46.259 27.632 10 HB2 GLN 9 HB2 GLN 9 54.701 47.986 27.470 11 HB3 GLN 9 HB3 GLN 9 54.557 48.008 25.917 12 HG2 GLN 9 HG2 GLN 9 52.274 48.712 27.386 13 HG3 GLN 9 HG3 GLN 9 53.421 49.767 27.341 14 HE21 GLN 9 HE21 GLN 9 50.864 48.571 25.567 15 HE22 GLN 9 HE22 GLN 9 51.029 49.369 24.319 16 H ARG 10 H ARG 10 53.553 46.039 24.204 17 HA ARG 10 HA ARG 10 51.024 46.574 23.483 18 HB2 ARG 10 HB2 ARG 10 53.034 47.061 22.176 19 HB3 ARG 10 HB3 ARG 10 53.011 45.555 21.771 20 HG2 ARG 10 HG2 ARG 10 50.852 45.853 20.802 21 HG3 ARG 10 HG3 ARG 10 50.885 47.360 21.200 22 HD2 ARG 10 HD2 ARG 10 52.669 46.197 19.319 23 HD3 ARG 10 HD3 ARG 10 51.446 47.075 18.913 24 HE ARG 10 HE ARG 10 52.549 48.907 19.722 25 HH11 ARG 10 HH11 ARG 10 54.413 50.106 19.703 26 HH12 ARG 10 HH12 ARG 10 55.740 49.430 19.665 27 HH21 ARG 10 HH21 ARG 10 54.724 46.392 19.617 28 HH22 ARG 10 HH22 ARG 10 55.921 47.280 19.615 29 H VAL 11 H VAL 11 52.757 43.576 23.716 30 HA VAL 11 HA VAL 11 50.877 41.914 23.074 31 HB VAL 11 HB VAL 11 53.018 41.401 24.809 32 HG11 VAL 11 HG11 VAL 11 52.743 39.078 24.289 33 HG12 VAL 11 HG12 VAL 11 51.443 39.646 24.992 34 HG13 VAL 11 HG13 VAL 11 51.469 39.442 23.421 35 HG21 VAL 11 HG21 VAL 11 54.155 40.470 22.925 36 HG22 VAL 11 HG22 VAL 11 52.936 40.892 22.006 37 HG23 VAL 11 HG23 VAL 11 53.840 42.003 22.682 38 H ALA 12 H ALA 12 51.510 43.217 26.270 39 HA ALA 12 HA ALA 12 49.734 41.870 27.628 40 HB1 ALA 12 HB1 ALA 12 50.192 43.500 29.318 41 HB2 ALA 12 HB2 ALA 12 51.548 42.978 28.689 42 HB3 ALA 12 HB3 ALA 12 50.957 44.378 28.245 43 H GLN 13 H GLN 13 49.227 44.863 25.967 44 HA GLN 13 HA GLN 13 46.684 45.210 26.624 45 HB2 GLN 13 HB2 GLN 13 48.367 46.447 24.700 46 HB3 GLN 13 HB3 GLN 13 46.845 46.789 24.701 47 HG2 GLN 13 HG2 GLN 13 48.394 47.146 27.055 48 HG3 GLN 13 HG3 GLN 13 48.283 48.299 26.012 49 HE21 GLN 13 HE21 GLN 13 47.281 48.273 28.776 50 HE22 GLN 13 HE22 GLN 13 45.833 48.616 28.708 51 H GLU 14 H GLU 14 48.017 43.747 23.739 52 HA GLU 14 HA GLU 14 45.789 43.197 22.529 53 HB2 GLU 14 HB2 GLU 14 48.360 42.038 22.229 54 HB3 GLU 14 HB3 GLU 14 47.174 41.566 21.334 55 HG2 GLU 14 HG2 GLU 14 46.980 43.841 20.510 56 HG3 GLU 14 HG3 GLU 14 48.281 44.191 21.297 57 H MET 15 H MET 15 47.449 41.182 24.833 58 HA MET 15 HA MET 15 45.911 39.092 24.873 59 HB2 MET 15 HB2 MET 15 47.655 40.120 26.857 60 HB3 MET 15 HB3 MET 15 46.866 38.798 27.106 61 HG2 MET 15 HG2 MET 15 48.607 39.017 24.885 62 HG3 MET 15 HG3 MET 15 49.161 38.553 26.267 63 HE1 MET 15 HE1 MET 15 49.474 35.412 24.288 64 HE2 MET 15 HE2 MET 15 49.721 36.899 23.804 65 HE3 MET 15 HE3 MET 15 50.231 36.435 25.229 66 H GLN 16 H GLN 16 45.629 41.947 26.882 67 HA GLN 16 HA GLN 16 43.562 41.398 28.330 68 HB2 GLN 16 HB2 GLN 16 45.078 43.313 28.495 69 HB3 GLN 16 HB3 GLN 16 44.222 43.986 27.379 70 HG2 GLN 16 HG2 GLN 16 42.326 43.828 28.939 71 HG3 GLN 16 HG3 GLN 16 43.378 43.495 30.039 72 HE21 GLN 16 HE21 GLN 16 45.258 45.255 30.137 73 HE22 GLN 16 HE22 GLN 16 44.857 46.677 29.943 74 H LYS 17 H LYS 17 43.469 42.960 25.239 75 HA LYS 17 HA LYS 17 40.888 43.288 24.929 76 HB2 LYS 17 HB2 LYS 17 42.625 44.526 23.791 77 HB3 LYS 17 HB3 LYS 17 42.902 43.264 22.918 78 HG2 LYS 17 HG2 LYS 17 40.721 43.431 21.979 79 HG3 LYS 17 HG3 LYS 17 40.437 44.688 22.857 80 HD2 LYS 17 HD2 LYS 17 42.205 45.855 21.722 81 HD3 LYS 17 HD3 LYS 17 42.429 44.606 20.816 82 HE2 LYS 17 HE2 LYS 17 40.185 44.840 19.998 83 HE3 LYS 17 HE3 LYS 17 40.034 46.138 20.849 84 HZ1 LYS 17 HZ1 LYS 17 40.569 46.668 18.704 85 HZ2 LYS 17 HZ2 LYS 17 41.658 47.108 19.559 86 HZ3 LYS 17 HZ3 LYS 17 41.799 45.898 18.767 87 H GLU 18 H GLU 18 42.795 40.704 23.630 88 HA GLU 18 HA GLU 18 40.887 39.517 22.242 89 HB2 GLU 18 HB2 GLU 18 43.363 39.413 21.925 90 HB3 GLU 18 HB3 GLU 18 43.335 38.295 23.012 91 HG2 GLU 18 HG2 GLU 18 43.348 37.133 21.075 92 HG3 GLU 18 HG3 GLU 18 41.855 37.052 21.521 93 H ILE 19 H ILE 19 42.086 38.812 25.419 94 HA ILE 19 HA ILE 19 40.629 36.704 25.993 95 HB ILE 19 HB ILE 19 42.035 38.442 27.706 96 HG12 ILE 19 HG12 ILE 19 42.726 35.767 26.984 97 HG13 ILE 19 HG13 ILE 19 43.342 36.997 26.252 98 HG21 ILE 19 HG21 ILE 19 41.758 36.887 29.469 99 HG22 ILE 19 HG22 ILE 19 40.353 37.459 29.012 100 HG23 ILE 19 HG23 ILE 19 40.811 36.018 28.543 101 HD11 ILE 19 HD11 ILE 19 44.885 36.161 27.805 102 HD12 ILE 19 HD12 ILE 19 44.467 37.628 28.234 103 HD13 ILE 19 HD13 ILE 19 43.842 36.377 28.977 104 H ALA 20 H ALA 20 39.963 40.078 26.685 105 HA ALA 20 HA ALA 20 37.744 39.846 27.990 106 HB1 ALA 20 HB1 ALA 20 37.413 42.122 27.431 107 HB2 ALA 20 HB2 ALA 20 38.905 41.887 27.905 108 HB3 ALA 20 HB3 ALA 20 38.576 42.019 26.361 109 H LEU 21 H LEU 21 38.065 39.894 24.541 110 HA LEU 21 HA LEU 21 35.506 39.863 23.887 111 HB2 LEU 21 HB2 LEU 21 37.215 40.625 22.419 112 HB3 LEU 21 HB3 LEU 21 37.744 39.164 22.293 113 HG LEU 21 HG LEU 21 35.768 38.522 21.232 114 HD11 LEU 21 HD11 LEU 21 34.173 40.077 20.505 115 HD12 LEU 21 HD12 LEU 21 34.227 40.026 22.087 116 HD13 LEU 21 HD13 LEU 21 34.928 41.214 21.308 117 HD21 LEU 21 HD21 LEU 21 36.152 39.702 19.171 118 HD22 LEU 21 HD22 LEU 21 36.988 40.784 19.971 119 HD23 LEU 21 HD23 LEU 21 37.534 39.303 19.835 120 H ILE 22 H ILE 22 37.635 37.127 24.297 121 HA ILE 22 HA ILE 22 35.932 35.212 23.731 122 HB ILE 22 HB ILE 22 38.267 35.040 25.297 123 HG12 ILE 22 HG12 ILE 22 37.976 34.096 22.635 124 HG13 ILE 22 HG13 ILE 22 38.462 35.555 22.897 125 HG21 ILE 22 HG21 ILE 22 38.126 32.682 25.052 126 HG22 ILE 22 HG22 ILE 22 36.859 33.219 25.837 127 HG23 ILE 22 HG23 ILE 22 36.740 32.846 24.302 128 HD11 ILE 22 HD11 ILE 22 40.325 34.173 22.501 129 HD12 ILE 22 HD12 ILE 22 40.402 34.727 23.982 130 HD13 ILE 22 HD13 ILE 22 39.910 33.246 23.716 131 H LEU 23 H LEU 23 36.582 36.653 26.852 132 HA LEU 23 HA LEU 23 34.903 35.346 28.347 133 HB2 LEU 23 HB2 LEU 23 36.427 37.652 28.694 134 HB3 LEU 23 HB3 LEU 23 35.168 37.588 29.612 135 HG LEU 23 HG LEU 23 35.919 35.579 30.532 136 HD11 LEU 23 HD11 LEU 23 38.092 34.753 30.137 137 HD12 LEU 23 HD12 LEU 23 37.219 34.693 28.817 138 HD13 LEU 23 HD13 LEU 23 38.289 35.845 29.006 139 HD21 LEU 23 HD21 LEU 23 37.764 36.471 31.789 140 HD22 LEU 23 HD22 LEU 23 37.902 37.632 30.720 141 HD23 LEU 23 HD23 LEU 23 36.619 37.556 31.646 142 H GLN 24 H GLN 24 34.132 37.993 26.286 143 HA GLN 24 HA GLN 24 31.654 38.422 27.192 144 HB2 GLN 24 HB2 GLN 24 33.064 40.123 26.192 145 HB3 GLN 24 HB3 GLN 24 32.799 39.446 24.812 146 HG2 GLN 24 HG2 GLN 24 30.510 39.976 24.941 147 HG3 GLN 24 HG3 GLN 24 30.689 40.536 26.386 148 HE21 GLN 24 HE21 GLN 24 31.161 42.763 26.581 149 HE22 GLN 24 HE22 GLN 24 31.568 43.650 25.456 150 H ARG 25 H ARG 25 32.808 36.305 24.760 151 HA ARG 25 HA ARG 25 30.375 35.775 23.737 152 HB2 ARG 25 HB2 ARG 25 32.955 34.975 22.793 153 HB3 ARG 25 HB3 ARG 25 31.646 34.576 22.046 154 HG2 ARG 25 HG2 ARG 25 31.213 36.915 21.654 155 HG3 ARG 25 HG3 ARG 25 32.596 37.245 22.294 156 HD2 ARG 25 HD2 ARG 25 32.217 35.858 19.851 157 HD3 ARG 25 HD3 ARG 25 32.871 37.266 19.991 158 HE ARG 25 HE ARG 25 34.209 35.129 21.079 159 HH11 ARG 25 HH11 ARG 25 36.348 34.901 20.740 160 HH12 ARG 25 HH12 ARG 25 37.028 35.670 19.661 161 HH21 ARG 25 HH21 ARG 25 34.506 37.327 18.598 162 HH22 ARG 25 HH22 ARG 25 35.963 37.076 18.419 163 H GLU 26 H GLU 26 32.794 33.893 25.314 164 HA GLU 26 HA GLU 26 31.506 31.527 25.147 165 HB2 GLU 26 HB2 GLU 26 33.870 31.761 24.772 166 HB3 GLU 26 HB3 GLU 26 34.034 32.053 26.296 167 HG2 GLU 26 HG2 GLU 26 34.632 29.858 25.902 168 HG3 GLU 26 HG3 GLU 26 33.367 29.869 26.814 169 H ILE 27 H ILE 27 31.586 33.891 27.517 170 HA ILE 27 HA ILE 27 29.983 32.477 29.206 171 HB ILE 27 HB ILE 27 31.721 34.502 30.081 172 HG12 ILE 27 HG12 ILE 27 32.086 31.737 30.479 173 HG13 ILE 27 HG13 ILE 27 33.012 32.638 29.606 174 HG21 ILE 27 HG21 ILE 27 30.986 33.868 32.274 175 HG22 ILE 27 HG22 ILE 27 29.751 34.350 31.406 176 HG23 ILE 27 HG23 ILE 27 30.009 32.803 31.625 177 HD11 ILE 27 HD11 ILE 27 34.053 32.217 31.668 178 HD12 ILE 27 HD12 ILE 27 33.762 33.770 31.546 179 HD13 ILE 27 HD13 ILE 27 32.821 32.855 32.433 180 H LYS 28 H LYS 28 27.844 33.349 29.278 181 HA LYS 28 HA LYS 28 27.163 35.361 27.630 182 HB2 LYS 28 HB2 LYS 28 25.662 33.422 28.978 183 HB3 LYS 28 HB3 LYS 28 24.928 34.650 28.357 184 HG2 LYS 28 HG2 LYS 28 24.937 32.712 26.931 185 HG3 LYS 28 HG3 LYS 28 25.430 34.012 26.223 186 HD2 LYS 28 HD2 LYS 28 27.670 33.275 26.392 187 HD3 LYS 28 HD3 LYS 28 27.205 31.995 27.152 188 HE2 LYS 28 HE2 LYS 28 26.070 31.226 25.242 189 HE3 LYS 28 HE3 LYS 28 26.403 32.547 24.481 190 HZ1 LYS 28 HZ1 LYS 28 27.868 30.931 23.857 191 HZ2 LYS 28 HZ2 LYS 28 28.626 31.951 24.561 192 HZ3 LYS 28 HZ3 LYS 28 28.293 30.704 25.228 193 H ASP 29 H ASP 29 27.413 37.464 28.229 194 HA ASP 29 HA ASP 29 27.903 38.072 30.710 195 HB2 ASP 29 HB2 ASP 29 28.773 39.108 28.516 196 HB3 ASP 29 HB3 ASP 29 27.682 40.175 28.838 197 HA PRO 30 HA PRO 30 23.766 40.279 30.939 198 HB2 PRO 30 HB2 PRO 30 22.237 38.047 30.007 199 HB3 PRO 30 HB3 PRO 30 21.786 39.540 29.973 200 HG2 PRO 30 HG2 PRO 30 22.692 38.611 27.793 201 HG3 PRO 30 HG3 PRO 30 23.189 40.038 28.183 202 HD2 PRO 30 HD2 PRO 30 24.603 37.596 28.565 203 HD3 PRO 30 HD3 PRO 30 25.214 38.945 28.075 204 H ARG 31 H ARG 31 24.337 36.995 31.814 205 HA ARG 31 HA ARG 31 23.142 36.880 34.150 206 HB2 ARG 31 HB2 ARG 31 23.938 34.972 32.936 207 HB3 ARG 31 HB3 ARG 31 25.404 35.399 33.259 208 HG2 ARG 31 HG2 ARG 31 25.099 34.960 35.530 209 HG3 ARG 31 HG3 ARG 31 23.569 34.735 35.325 210 HD2 ARG 31 HD2 ARG 31 24.587 32.636 35.537 211 HD3 ARG 31 HD3 ARG 31 24.019 32.751 34.090 212 HE ARG 31 HE ARG 31 26.706 32.997 34.664 213 HH11 ARG 31 HH11 ARG 31 28.189 32.390 33.153 214 HH12 ARG 31 HH12 ARG 31 27.751 31.917 31.810 215 HH21 ARG 31 HH21 ARG 31 24.610 32.169 32.210 216 HH22 ARG 31 HH22 ARG 31 25.700 31.790 31.268 217 H LEU 32 H LEU 32 26.063 38.382 33.436 218 HA LEU 32 HA LEU 32 26.701 39.044 35.978 219 HB2 LEU 32 HB2 LEU 32 28.331 39.218 33.664 220 HB3 LEU 32 HB3 LEU 32 28.826 39.572 35.099 221 HG LEU 32 HG LEU 32 28.125 36.955 34.301 222 HD11 LEU 32 HD11 LEU 32 30.462 36.488 34.376 223 HD12 LEU 32 HD12 LEU 32 30.168 37.624 33.311 224 HD13 LEU 32 HD13 LEU 32 30.740 38.004 34.739 225 HD21 LEU 32 HD21 LEU 32 29.051 36.203 36.345 226 HD22 LEU 32 HD22 LEU 32 29.322 37.704 36.768 227 HD23 LEU 32 HD23 LEU 32 27.835 37.179 36.621 228 H GLY 33 H GLY 33 24.649 40.461 34.125 229 HA2 GLY 33 HA2 GLY 33 23.745 42.415 34.236 230 HA3 GLY 33 HA3 GLY 33 25.006 42.962 34.973 231 H MET 34 H MET 34 25.757 41.541 31.988 232 HA MET 34 HA MET 34 26.602 42.229 30.154 233 HB2 MET 34 HB2 MET 34 24.227 42.535 29.853 234 HB3 MET 34 HB3 MET 34 24.453 44.054 30.124 235 HG2 MET 34 HG2 MET 34 24.275 43.677 27.837 236 HG3 MET 34 HG3 MET 34 25.677 44.276 28.168 237 HE1 MET 34 HE1 MET 34 28.180 42.109 26.798 238 HE2 MET 34 HE2 MET 34 27.629 43.594 26.787 239 HE3 MET 34 HE3 MET 34 27.971 42.886 28.162 240 H MET 35 H MET 35 28.059 43.263 32.278 241 HA MET 35 HA MET 35 29.448 45.283 31.241 242 HB2 MET 35 HB2 MET 35 27.559 46.316 32.420 243 HB3 MET 35 HB3 MET 35 28.254 45.857 33.738 244 HG2 MET 35 HG2 MET 35 30.128 47.202 33.251 245 HG3 MET 35 HG3 MET 35 29.501 47.613 31.883 246 HE1 MET 35 HE1 MET 35 29.562 50.875 33.797 247 HE2 MET 35 HE2 MET 35 30.631 49.708 33.866 248 HE3 MET 35 HE3 MET 35 30.034 50.154 32.468 249 H THR 36 H THR 36 30.315 42.686 31.753 250 HA THR 36 HA THR 36 32.212 42.850 33.661 251 HB THR 36 HB THR 36 32.097 40.749 31.836 252 HG1 THR 36 HG1 THR 36 30.305 40.181 32.627 253 HG21 THR 36 HG21 THR 36 32.952 39.409 33.579 254 HG22 THR 36 HG22 THR 36 33.917 40.629 33.281 255 HG23 THR 36 HG23 THR 36 32.949 40.672 34.534 256 H THR 37 H THR 37 34.491 43.239 33.207 257 HA THR 37 HA THR 37 35.411 43.528 30.692 258 HB THR 37 HB THR 37 35.843 45.599 32.511 259 HG1 THR 37 HG1 THR 37 34.337 46.768 31.338 260 HG21 THR 37 HG21 THR 37 36.498 46.906 30.614 261 HG22 THR 37 HG22 THR 37 37.405 45.613 30.742 262 HG23 THR 37 HG23 THR 37 36.227 45.653 29.684 263 H VAL 38 H VAL 38 37.818 43.227 30.541 264 HA VAL 38 HA VAL 38 39.117 42.219 32.689 265 HB VAL 38 HB VAL 38 40.041 42.404 30.075 266 HG11 VAL 38 HG11 VAL 38 41.803 40.921 30.717 267 HG12 VAL 38 HG12 VAL 38 41.891 42.276 31.531 268 HG13 VAL 38 HG13 VAL 38 41.284 40.982 32.212 269 HG21 VAL 38 HG21 VAL 38 39.714 40.028 29.969 270 HG22 VAL 38 HG22 VAL 38 39.107 40.069 31.431 271 HG23 VAL 38 HG23 VAL 38 38.338 40.765 30.235 272 H SER 39 H SER 39 40.179 43.686 34.088 273 HA SER 39 HA SER 39 40.691 46.204 33.425 274 HB2 SER 39 HB2 SER 39 41.252 46.482 35.719 275 HB3 SER 39 HB3 SER 39 39.816 45.901 35.541 276 HG SER 39 HG SER 39 41.157 44.818 37.017 277 H GLY 40 H GLY 40 42.722 43.484 33.669 278 HA2 GLY 40 HA2 GLY 40 44.664 44.384 32.239 279 HA3 GLY 40 HA3 GLY 40 45.107 44.537 33.728 280 H VAL 41 H VAL 41 46.590 42.845 32.126 281 HA VAL 41 HA VAL 41 46.330 40.500 33.422 282 HB VAL 41 HB VAL 41 47.195 39.281 31.766 283 HG11 VAL 41 HG11 VAL 41 45.458 39.423 30.123 284 HG12 VAL 41 HG12 VAL 41 44.867 39.533 31.588 285 HG13 VAL 41 HG13 VAL 41 45.057 40.838 30.711 286 HG21 VAL 41 HG21 VAL 41 47.687 40.078 29.588 287 HG22 VAL 41 HG22 VAL 41 47.453 41.559 30.100 288 HG23 VAL 41 HG23 VAL 41 48.660 40.705 30.668 289 H GLU 42 H GLU 42 48.352 39.447 34.142 290 HA GLU 42 HA GLU 42 50.743 40.784 33.980 291 HB2 GLU 42 HB2 GLU 42 49.877 41.097 36.138 292 HB3 GLU 42 HB3 GLU 42 49.727 39.554 36.312 293 HG2 GLU 42 HG2 GLU 42 52.116 39.350 36.137 294 HG3 GLU 42 HG3 GLU 42 52.214 40.906 36.100 295 H MET 43 H MET 43 52.176 39.495 32.801 296 HA MET 43 HA MET 43 51.662 36.871 32.419 297 HB2 MET 43 HB2 MET 43 53.196 38.565 30.727 298 HB3 MET 43 HB3 MET 43 52.796 37.100 30.372 299 HG2 MET 43 HG2 MET 43 50.502 37.787 30.336 300 HG3 MET 43 HG3 MET 43 50.971 39.257 30.561 301 HE1 MET 43 HE1 MET 43 52.809 40.124 27.324 302 HE2 MET 43 HE2 MET 43 52.373 40.694 28.736 303 HE3 MET 43 HE3 MET 43 53.456 39.541 28.648 304 H SER 44 H SER 44 53.307 35.225 32.786 305 HA SER 44 HA SER 44 55.441 35.699 34.266 306 HB2 SER 44 HB2 SER 44 54.390 33.557 34.156 307 HB3 SER 44 HB3 SER 44 54.919 33.389 32.699 308 HG SER 44 HG SER 44 56.508 32.549 33.670 309 H ARG 45 H ARG 45 57.734 35.872 33.578 310 HA ARG 45 HA ARG 45 58.233 37.116 31.289 311 HB2 ARG 45 HB2 ARG 45 59.446 37.447 33.353 312 HB3 ARG 45 HB3 ARG 45 60.113 36.053 33.144 313 HG2 ARG 45 HG2 ARG 45 61.248 36.825 31.232 314 HG3 ARG 45 HG3 ARG 45 60.486 38.185 31.287 315 HD2 ARG 45 HD2 ARG 45 62.650 38.490 32.184 316 HD3 ARG 45 HD3 ARG 45 61.601 38.752 33.308 317 HE ARG 45 HE ARG 45 62.525 36.205 33.227 318 HH11 ARG 45 HH11 ARG 45 63.384 35.256 34.955 319 HH12 ARG 45 HH12 ARG 45 63.955 36.067 36.066 320 HH21 ARG 45 HH21 ARG 45 63.210 38.984 34.911 321 HH22 ARG 45 HH22 ARG 45 63.854 38.256 36.039 322 H ASP 46 H ASP 46 58.496 33.846 32.024 323 HA ASP 46 HA ASP 46 59.553 33.012 29.702 324 HB2 ASP 46 HB2 ASP 46 59.692 30.932 30.793 325 HB3 ASP 46 HB3 ASP 46 60.355 32.028 31.685 326 H LEU 47 H LEU 47 56.583 33.882 30.166 327 HA LEU 47 HA LEU 47 54.625 33.483 29.559 328 HB2 LEU 47 HB2 LEU 47 55.964 32.605 27.215 329 HB3 LEU 47 HB3 LEU 47 54.434 32.903 27.239 330 HG LEU 47 HG LEU 47 56.371 34.886 27.742 331 HD11 LEU 47 HD11 LEU 47 55.922 35.694 25.527 332 HD12 LEU 47 HD12 LEU 47 56.491 34.217 25.462 333 HD13 LEU 47 HD13 LEU 47 54.937 34.474 25.300 334 HD21 LEU 47 HD21 LEU 47 54.641 36.481 27.448 335 HD22 LEU 47 HD22 LEU 47 53.601 35.303 27.249 336 HD23 LEU 47 HD23 LEU 47 54.299 35.514 28.655 337 H ALA 48 H ALA 48 55.709 31.124 31.091 338 HA ALA 48 HA ALA 48 54.275 29.037 30.336 339 HB1 ALA 48 HB1 ALA 48 54.975 28.135 32.415 340 HB2 ALA 48 HB2 ALA 48 56.218 28.744 31.645 341 HB3 ALA 48 HB3 ALA 48 55.547 29.552 32.830 342 H TYR 49 H TYR 49 53.458 31.664 32.382 343 HA TYR 49 HA TYR 49 50.913 30.831 32.802 344 HB2 TYR 49 HB2 TYR 49 52.526 31.870 34.911 345 HB3 TYR 49 HB3 TYR 49 51.070 31.342 35.092 346 HD1 TYR 49 HD1 TYR 49 50.668 28.831 34.963 347 HD2 TYR 49 HD2 TYR 49 54.389 30.400 35.139 348 HE1 TYR 49 HE1 TYR 49 51.518 26.734 35.534 349 HE2 TYR 49 HE2 TYR 49 55.241 28.318 35.777 350 HH TYR 49 HH TYR 49 54.773 26.161 36.266 351 H ALA 50 H ALA 50 49.300 32.543 33.036 352 HA ALA 50 HA ALA 50 50.094 35.094 33.345 353 HB1 ALA 50 HB1 ALA 50 48.641 35.859 31.639 354 HB2 ALA 50 HB2 ALA 50 49.759 34.921 31.024 355 HB3 ALA 50 HB3 ALA 50 48.299 34.357 31.265 356 H LYS 51 H LYS 51 48.857 36.329 34.732 357 HA LYS 51 HA LYS 51 46.576 35.411 35.896 358 HB2 LYS 51 HB2 LYS 51 48.266 37.482 36.797 359 HB3 LYS 51 HB3 LYS 51 47.011 36.974 37.570 360 HG2 LYS 51 HG2 LYS 51 48.069 34.850 37.869 361 HG3 LYS 51 HG3 LYS 51 49.331 35.382 37.123 362 HD2 LYS 51 HD2 LYS 51 49.499 37.078 38.900 363 HD3 LYS 51 HD3 LYS 51 48.443 36.238 39.683 364 HE2 LYS 51 HE2 LYS 51 49.949 34.367 39.623 365 HE3 LYS 51 HE3 LYS 51 51.016 35.284 38.948 366 HZ1 LYS 51 HZ1 LYS 51 51.373 35.194 41.195 367 HZ2 LYS 51 HZ2 LYS 51 51.038 36.565 40.848 368 HZ3 LYS 51 HZ3 LYS 51 50.044 35.711 41.476 369 H VAL 52 H VAL 52 44.583 36.412 35.495 370 HA VAL 52 HA VAL 52 44.399 38.644 33.952 371 HB VAL 52 HB VAL 52 42.591 36.529 33.949 372 HG11 VAL 52 HG11 VAL 52 41.552 37.596 32.081 373 HG12 VAL 52 HG12 VAL 52 41.488 38.519 33.366 374 HG13 VAL 52 HG13 VAL 52 42.563 38.806 32.238 375 HG21 VAL 52 HG21 VAL 52 43.320 36.018 31.729 376 HG22 VAL 52 HG22 VAL 52 44.436 37.134 31.861 377 HG23 VAL 52 HG23 VAL 52 44.503 35.837 32.767 378 H TYR 53 H TYR 53 43.439 40.402 34.993 379 HA TYR 53 HA TYR 53 41.922 40.123 37.249 380 HB2 TYR 53 HB2 TYR 53 43.269 42.436 36.348 381 HB3 TYR 53 HB3 TYR 53 42.549 42.300 37.724 382 HD1 TYR 53 HD1 TYR 53 43.602 40.793 39.499 383 HD2 TYR 53 HD2 TYR 53 45.581 41.769 36.109 384 HE1 TYR 53 HE1 TYR 53 45.585 39.983 40.419 385 HE2 TYR 53 HE2 TYR 53 47.565 40.986 37.036 386 HH TYR 53 HH TYR 53 48.612 40.247 38.962 387 H VAL 54 H VAL 54 39.724 40.567 37.206 388 HA VAL 54 HA VAL 54 38.548 41.567 34.953 389 HB VAL 54 HB VAL 54 37.581 39.366 36.382 390 HG11 VAL 54 HG11 VAL 54 36.060 39.038 34.560 391 HG12 VAL 54 HG12 VAL 54 35.836 40.455 35.229 392 HG13 VAL 54 HG13 VAL 54 36.640 40.339 33.869 393 HG21 VAL 54 HG21 VAL 54 38.198 37.960 34.536 394 HG22 VAL 54 HG22 VAL 54 38.884 39.208 33.843 395 HG23 VAL 54 HG23 VAL 54 39.480 38.621 35.189 396 H THR 55 H THR 55 36.726 42.965 35.366 397 HA THR 55 HA THR 55 36.008 43.517 37.929 398 HB THR 55 HB THR 55 37.595 45.046 37.194 399 HG1 THR 55 HG1 THR 55 36.410 45.893 38.703 400 HG21 THR 55 HG21 THR 55 37.035 46.774 35.726 401 HG22 THR 55 HG22 THR 55 37.079 45.376 34.983 402 HG23 THR 55 HG23 THR 55 35.687 46.022 35.374 403 H PHE 56 H PHE 56 33.876 43.831 38.361 404 HA PHE 56 HA PHE 56 32.110 43.108 36.440 405 HB2 PHE 56 HB2 PHE 56 32.233 42.257 39.148 406 HB3 PHE 56 HB3 PHE 56 31.052 41.871 38.206 407 HD1 PHE 56 HD1 PHE 56 34.587 41.287 38.512 408 HD2 PHE 56 HD2 PHE 56 31.128 39.790 37.050 409 HE1 PHE 56 HE1 PHE 56 35.640 39.260 38.090 410 HE2 PHE 56 HE2 PHE 56 32.185 37.762 36.628 411 HZ PHE 56 HZ PHE 56 34.456 37.492 37.143 412 H LEU 57 H LEU 57 29.967 44.102 36.420 413 HA LEU 57 HA LEU 57 29.156 45.837 38.318 414 HB2 LEU 57 HB2 LEU 57 28.482 46.073 36.052 415 HB3 LEU 57 HB3 LEU 57 27.728 44.710 36.144 416 HG LEU 57 HG LEU 57 26.215 45.654 37.680 417 HD11 LEU 57 HD11 LEU 57 26.157 47.989 38.027 418 HD12 LEU 57 HD12 LEU 57 27.510 47.383 38.583 419 HD13 LEU 57 HD13 LEU 57 27.495 48.140 37.192 420 HD21 LEU 57 HD21 LEU 57 25.040 47.010 36.091 421 HD22 LEU 57 HD22 LEU 57 26.359 47.104 35.219 422 HD23 LEU 57 HD23 LEU 57 25.613 45.716 35.380 423 H ASN 58 H ASN 58 29.204 42.542 38.253 424 HA ASN 58 HA ASN 58 26.992 41.890 39.628 425 HB2 ASN 58 HB2 ASN 58 28.063 40.595 37.832 426 HB3 ASN 58 HB3 ASN 58 29.171 40.226 38.866 427 HD21 ASN 58 HD21 ASN 58 25.625 38.632 39.306 428 HD22 ASN 58 HD22 ASN 58 25.739 40.043 38.839 429 H ASP 59 H ASP 59 29.780 43.086 40.797 430 HA ASP 59 HA ASP 59 30.148 41.974 43.103 431 HB2 ASP 59 HB2 ASP 59 31.632 43.668 43.488 432 HB3 ASP 59 HB3 ASP 59 31.659 43.525 41.935 433 H LYS 60 H LYS 60 27.454 43.692 42.433 434 HA LYS 60 HA LYS 60 26.648 44.536 44.797 435 HB2 LYS 60 HB2 LYS 60 25.605 45.111 42.706 436 HB3 LYS 60 HB3 LYS 60 25.030 43.664 42.627 437 HG2 LYS 60 HG2 LYS 60 23.676 44.040 44.499 438 HG3 LYS 60 HG3 LYS 60 24.345 45.426 44.752 439 HD2 LYS 60 HD2 LYS 60 23.421 46.171 42.632 440 HD3 LYS 60 HD3 LYS 60 22.624 44.832 42.568 441 HE2 LYS 60 HE2 LYS 60 22.279 46.701 44.684 442 HE3 LYS 60 HE3 LYS 60 21.317 46.650 43.457 443 HZ1 LYS 60 HZ1 LYS 60 20.433 45.474 45.189 444 HZ2 LYS 60 HZ2 LYS 60 20.693 44.545 44.102 445 HZ3 LYS 60 HZ3 LYS 60 21.588 44.592 45.245 446 H ASP 61 H ASP 61 26.890 41.287 43.753 447 HA ASP 61 HA ASP 61 26.230 40.403 46.242 448 HB2 ASP 61 HB2 ASP 61 24.458 39.892 44.706 449 HB3 ASP 61 HB3 ASP 61 25.465 39.038 43.877 450 H GLU 62 H GLU 62 28.192 39.891 47.138 451 HA GLU 62 HA GLU 62 30.398 39.262 46.045 452 HB2 GLU 62 HB2 GLU 62 29.803 38.335 48.650 453 HB3 GLU 62 HB3 GLU 62 31.212 38.749 48.127 454 HG2 GLU 62 HG2 GLU 62 30.817 40.497 49.408 455 HG3 GLU 62 HG3 GLU 62 30.213 41.056 48.083 456 H ASP 63 H ASP 63 27.981 37.045 47.082 457 HA ASP 63 HA ASP 63 29.104 34.698 46.704 458 HB2 ASP 63 HB2 ASP 63 27.220 35.048 48.129 459 HB3 ASP 63 HB3 ASP 63 26.362 35.495 46.904 460 H ALA 64 H ALA 64 27.268 36.570 44.460 461 HA ALA 64 HA ALA 64 27.246 34.846 42.461 462 HB1 ALA 64 HB1 ALA 64 26.439 36.686 41.215 463 HB2 ALA 64 HB2 ALA 64 25.643 36.564 42.578 464 HB3 ALA 64 HB3 ALA 64 26.785 37.649 42.422 465 H VAL 65 H VAL 65 29.542 37.404 43.119 466 HA VAL 65 HA VAL 65 31.091 37.120 41.040 467 HB VAL 65 HB VAL 65 31.758 38.156 43.539 468 HG11 VAL 65 HG11 VAL 65 33.684 39.136 42.571 469 HG12 VAL 65 HG12 VAL 65 33.774 37.555 42.512 470 HG13 VAL 65 HG13 VAL 65 33.375 38.375 41.217 471 HG21 VAL 65 HG21 VAL 65 31.578 40.290 42.420 472 HG22 VAL 65 HG22 VAL 65 31.191 39.531 41.085 473 HG23 VAL 65 HG23 VAL 65 30.205 39.507 42.324 474 H LYS 66 H LYS 66 31.334 35.420 44.101 475 HA LYS 66 HA LYS 66 33.392 33.855 43.649 476 HB2 LYS 66 HB2 LYS 66 32.525 34.210 45.802 477 HB3 LYS 66 HB3 LYS 66 31.201 33.486 45.408 478 HG2 LYS 66 HG2 LYS 66 32.488 32.049 46.710 479 HG3 LYS 66 HG3 LYS 66 32.323 31.429 45.288 480 HD2 LYS 66 HD2 LYS 66 34.495 31.838 44.734 481 HD3 LYS 66 HD3 LYS 66 34.671 32.886 45.875 482 HE2 LYS 66 HE2 LYS 66 35.794 30.959 46.525 483 HE3 LYS 66 HE3 LYS 66 34.581 31.141 47.489 484 HZ1 LYS 66 HZ1 LYS 66 34.705 28.996 46.789 485 HZ2 LYS 66 HZ2 LYS 66 33.460 29.559 46.293 486 HZ3 LYS 66 HZ3 LYS 66 34.589 29.389 45.395 487 H ALA 67 H ALA 67 30.081 33.074 42.932 488 HA ALA 67 HA ALA 67 30.450 30.743 41.804 489 HB1 ALA 67 HB1 ALA 67 28.211 31.031 41.054 490 HB2 ALA 67 HB2 ALA 67 28.322 31.413 42.587 491 HB3 ALA 67 HB3 ALA 67 28.272 32.554 41.489 492 H GLY 68 H GLY 68 30.591 33.829 40.296 493 HA2 GLY 68 HA2 GLY 68 30.744 33.179 37.758 494 HA3 GLY 68 HA3 GLY 68 31.137 34.561 38.365 495 H ILE 69 H ILE 69 33.359 34.022 39.948 496 HA ILE 69 HA ILE 69 35.440 33.561 38.436 497 HB ILE 69 HB ILE 69 35.203 33.653 41.214 498 HG12 ILE 69 HG12 ILE 69 34.956 35.766 40.199 499 HG13 ILE 69 HG13 ILE 69 36.194 35.767 41.148 500 HG21 ILE 69 HG21 ILE 69 37.576 33.720 41.437 501 HG22 ILE 69 HG22 ILE 69 37.096 32.329 40.852 502 HG23 ILE 69 HG23 ILE 69 37.710 33.424 39.888 503 HD11 ILE 69 HD11 ILE 69 36.727 36.903 39.167 504 HD12 ILE 69 HD12 ILE 69 37.641 35.615 39.280 505 HD13 ILE 69 HD13 ILE 69 36.384 35.613 38.316 506 H LYS 70 H LYS 70 33.823 31.232 40.504 507 HA LYS 70 HA LYS 70 35.313 29.154 40.055 508 HB2 LYS 70 HB2 LYS 70 33.710 29.127 41.791 509 HB3 LYS 70 HB3 LYS 70 32.551 29.172 40.750 510 HG2 LYS 70 HG2 LYS 70 33.149 27.018 39.957 511 HG3 LYS 70 HG3 LYS 70 34.351 26.973 40.950 512 HD2 LYS 70 HD2 LYS 70 31.688 27.096 41.912 513 HD3 LYS 70 HD3 LYS 70 32.377 25.722 41.650 514 HE2 LYS 70 HE2 LYS 70 34.011 26.210 43.283 515 HE3 LYS 70 HE3 LYS 70 33.369 27.611 43.524 516 HZ1 LYS 70 HZ1 LYS 70 32.683 26.154 45.110 517 HZ2 LYS 70 HZ2 LYS 70 31.521 26.563 44.340 518 HZ3 LYS 70 HZ3 LYS 70 32.119 25.257 44.115 519 H ALA 71 H ALA 71 32.562 30.099 38.135 520 HA ALA 71 HA ALA 71 32.585 28.131 36.412 521 HB1 ALA 71 HB1 ALA 71 31.016 29.490 35.243 522 HB2 ALA 71 HB2 ALA 71 30.640 29.430 36.781 523 HB3 ALA 71 HB3 ALA 71 31.375 30.705 36.193 524 H LEU 72 H LEU 72 34.094 31.213 36.156 525 HA LEU 72 HA LEU 72 35.120 31.123 33.731 526 HB2 LEU 72 HB2 LEU 72 34.778 33.153 34.789 527 HB3 LEU 72 HB3 LEU 72 35.670 32.728 35.996 528 HG LEU 72 HG LEU 72 37.568 32.902 34.693 529 HD11 LEU 72 HD11 LEU 72 37.536 33.837 32.536 530 HD12 LEU 72 HD12 LEU 72 36.766 32.452 32.559 531 HD13 LEU 72 HD13 LEU 72 35.953 33.811 32.558 532 HD21 LEU 72 HD21 LEU 72 37.550 35.294 34.449 533 HD22 LEU 72 HD22 LEU 72 35.971 35.273 34.568 534 HD23 LEU 72 HD23 LEU 72 36.866 34.880 35.815 535 H GLN 73 H GLN 73 36.683 30.221 36.727 536 HA GLN 73 HA GLN 73 38.963 29.447 35.634 537 HB2 GLN 73 HB2 GLN 73 38.667 30.169 37.944 538 HB3 GLN 73 HB3 GLN 73 38.149 28.726 38.230 539 HG2 GLN 73 HG2 GLN 73 40.401 28.748 38.777 540 HG3 GLN 73 HG3 GLN 73 40.254 27.846 37.513 541 HE21 GLN 73 HE21 GLN 73 41.778 28.306 35.880 542 HE22 GLN 73 HE22 GLN 73 42.431 29.627 35.662 543 H GLU 74 H GLU 74 36.149 27.549 36.362 544 HA GLU 74 HA GLU 74 37.021 25.169 35.653 545 HB2 GLU 74 HB2 GLU 74 35.058 25.680 37.022 546 HB3 GLU 74 HB3 GLU 74 34.314 26.027 35.696 547 HG2 GLU 74 HG2 GLU 74 34.381 23.827 34.988 548 HG3 GLU 74 HG3 GLU 74 35.370 23.433 36.128 549 H ALA 75 H ALA 75 35.936 27.673 33.627 550 HA ALA 75 HA ALA 75 36.037 26.268 31.334 551 HB1 ALA 75 HB1 ALA 75 35.122 28.292 30.414 552 HB2 ALA 75 HB2 ALA 75 34.233 27.804 31.629 553 HB3 ALA 75 HB3 ALA 75 35.270 28.984 31.832 554 H SER 76 H SER 76 38.516 27.545 32.928 555 HA SER 76 HA SER 76 39.570 29.306 31.392 556 HB2 SER 76 HB2 SER 76 41.530 29.070 32.769 557 HB3 SER 76 HB3 SER 76 40.248 29.182 33.650 558 HG SER 76 HG SER 76 40.391 27.158 34.134 559 H GLY 77 H GLY 77 40.216 25.932 31.164 560 HA2 GLY 77 HA2 GLY 77 42.205 25.910 29.463 561 HA3 GLY 77 HA3 GLY 77 41.276 24.701 29.790 562 H PHE 78 H PHE 78 38.772 25.615 28.861 563 HA PHE 78 HA PHE 78 38.775 25.432 26.252 564 HB2 PHE 78 HB2 PHE 78 36.676 26.284 27.964 565 HB3 PHE 78 HB3 PHE 78 36.453 25.995 26.448 566 HD1 PHE 78 HD1 PHE 78 36.644 24.473 29.568 567 HD2 PHE 78 HD2 PHE 78 36.662 23.603 25.618 568 HE1 PHE 78 HE1 PHE 78 36.259 22.226 30.064 569 HE2 PHE 78 HE2 PHE 78 36.278 21.355 26.115 570 HZ PHE 78 HZ PHE 78 36.114 20.659 28.340 571 H ILE 79 H ILE 79 38.703 28.297 28.175 572 HA ILE 79 HA ILE 79 38.581 30.175 26.315 573 HB ILE 79 HB ILE 79 39.306 30.304 29.032 574 HG12 ILE 79 HG12 ILE 79 36.950 31.372 27.834 575 HG13 ILE 79 HG13 ILE 79 36.962 29.914 28.388 576 HG21 ILE 79 HG21 ILE 79 39.271 32.650 28.940 577 HG22 ILE 79 HG22 ILE 79 40.430 32.076 28.025 578 HG23 ILE 79 HG23 ILE 79 39.082 32.583 27.369 579 HD11 ILE 79 HD11 ILE 79 35.986 31.344 29.973 580 HD12 ILE 79 HD12 ILE 79 37.319 30.738 30.578 581 HD13 ILE 79 HD13 ILE 79 37.307 32.218 30.014 582 H ARG 80 H ARG 80 41.434 28.877 27.865 583 HA ARG 80 HA ARG 80 43.367 30.068 26.588 584 HB2 ARG 80 HB2 ARG 80 43.975 28.948 28.449 585 HB3 ARG 80 HB3 ARG 80 43.199 27.660 28.036 586 HG2 ARG 80 HG2 ARG 80 44.840 27.019 26.590 587 HG3 ARG 80 HG3 ARG 80 45.522 28.421 26.638 588 HD2 ARG 80 HD2 ARG 80 46.733 26.749 27.841 589 HD3 ARG 80 HD3 ARG 80 46.433 28.019 28.695 590 HE ARG 80 HE ARG 80 45.331 26.767 30.085 591 HH11 ARG 80 HH11 ARG 80 44.675 24.955 31.061 592 HH12 ARG 80 HH12 ARG 80 44.299 23.758 30.259 593 HH21 ARG 80 HH21 ARG 80 45.061 24.913 27.346 594 HH22 ARG 80 HH22 ARG 80 44.524 23.731 28.077 595 H SER 81 H SER 81 41.709 27.242 25.527 596 HA SER 81 HA SER 81 43.046 26.698 23.346 597 HB2 SER 81 HB2 SER 81 41.486 25.262 24.621 598 HB3 SER 81 HB3 SER 81 40.349 25.965 23.817 599 HG SER 81 HG SER 81 40.965 24.114 22.843 600 H LEU 82 H LEU 82 40.204 28.649 23.638 601 HA LEU 82 HA LEU 82 39.913 29.347 21.130 602 HB2 LEU 82 HB2 LEU 82 38.869 30.489 23.530 603 HB3 LEU 82 HB3 LEU 82 38.464 31.060 22.137 604 HG LEU 82 HG LEU 82 37.908 28.383 22.835 605 HD11 LEU 82 HD11 LEU 82 35.682 29.072 23.341 606 HD12 LEU 82 HD12 LEU 82 36.707 29.790 24.313 607 HD13 LEU 82 HD13 LEU 82 36.102 30.576 23.078 608 HD21 LEU 82 HD21 LEU 82 36.337 28.420 21.084 609 HD22 LEU 82 HD22 LEU 82 36.744 29.915 20.759 610 HD23 LEU 82 HD23 LEU 82 37.785 28.744 20.531 611 H LEU 83 H LEU 83 41.763 30.899 23.589 612 HA LEU 83 HA LEU 83 42.479 33.117 22.359 613 HB2 LEU 83 HB2 LEU 83 42.555 32.864 24.724 614 HB3 LEU 83 HB3 LEU 83 43.680 31.794 24.576 615 HG LEU 83 HG LEU 83 45.113 33.495 23.689 616 HD11 LEU 83 HD11 LEU 83 44.530 35.752 23.967 617 HD12 LEU 83 HD12 LEU 83 43.527 35.043 22.968 618 HD13 LEU 83 HD13 LEU 83 43.092 35.316 24.465 619 HD21 LEU 83 HD21 LEU 83 45.585 34.473 25.792 620 HD22 LEU 83 HD22 LEU 83 44.180 33.974 26.328 621 HD23 LEU 83 HD23 LEU 83 45.307 32.922 25.961 622 H GLY 84 H GLY 84 44.238 30.135 22.595 623 HA2 GLY 84 HA2 GLY 84 46.334 30.615 21.166 624 HA3 GLY 84 HA3 GLY 84 45.722 29.196 21.380 625 H LYS 85 H LYS 85 43.203 29.590 20.027 626 HA LYS 85 HA LYS 85 43.699 29.442 17.455 627 HB2 LYS 85 HB2 LYS 85 41.831 28.373 18.674 628 HB3 LYS 85 HB3 LYS 85 41.092 29.737 18.515 629 HG2 LYS 85 HG2 LYS 85 41.216 29.565 16.164 630 HG3 LYS 85 HG3 LYS 85 42.039 28.247 16.285 631 HD2 LYS 85 HD2 LYS 85 39.940 27.506 15.821 632 HD3 LYS 85 HD3 LYS 85 40.067 27.259 17.355 633 HE2 LYS 85 HE2 LYS 85 38.942 29.344 17.757 634 HE3 LYS 85 HE3 LYS 85 38.764 29.525 16.219 635 HZ1 LYS 85 HZ1 LYS 85 36.883 28.648 17.124 636 HZ2 LYS 85 HZ2 LYS 85 37.441 27.669 16.207 637 HZ3 LYS 85 HZ3 LYS 85 37.607 27.500 17.641 638 H ALA 86 H ALA 86 42.379 32.133 19.203 639 HA ALA 86 HA ALA 86 41.835 33.701 17.172 640 HB1 ALA 86 HB1 ALA 86 41.503 35.350 18.876 641 HB2 ALA 86 HB2 ALA 86 40.781 33.999 19.279 642 HB3 ALA 86 HB3 ALA 86 42.174 34.376 19.929 643 H MET 87 H MET 87 44.796 33.458 18.880 644 HA MET 87 HA MET 87 46.031 35.322 17.382 645 HB2 MET 87 HB2 MET 87 46.988 33.973 19.708 646 HB3 MET 87 HB3 MET 87 47.843 35.037 18.955 647 HG2 MET 87 HG2 MET 87 46.058 36.632 19.447 648 HG3 MET 87 HG3 MET 87 45.480 35.559 20.419 649 HE1 MET 87 HE1 MET 87 46.802 38.210 22.788 650 HE2 MET 87 HE2 MET 87 46.132 38.449 21.373 651 HE3 MET 87 HE3 MET 87 45.512 37.391 22.374 652 H ARG 88 H ARG 88 45.506 32.265 16.697 653 HA ARG 88 HA ARG 88 46.375 30.598 15.716 654 HB2 ARG 88 HB2 ARG 88 47.543 32.573 14.066 655 HB3 ARG 88 HB3 ARG 88 47.339 31.086 13.642 656 HG2 ARG 88 HG2 ARG 88 44.941 31.437 13.904 657 HG3 ARG 88 HG3 ARG 88 45.244 32.956 14.086 658 HD2 ARG 88 HD2 ARG 88 44.599 32.634 11.877 659 HD3 ARG 88 HD3 ARG 88 46.101 33.050 11.868 660 HE ARG 88 HE ARG 88 46.038 30.429 11.874 661 HH11 ARG 88 HH11 ARG 88 46.502 29.163 10.210 662 HH12 ARG 88 HH12 ARG 88 46.279 29.617 8.808 663 HH21 ARG 88 HH21 ARG 88 45.249 32.608 9.494 664 HH22 ARG 88 HH22 ARG 88 45.536 31.656 8.385 665 H LEU 89 H LEU 89 47.758 30.743 18.042 666 HA LEU 89 HA LEU 89 50.407 31.262 17.707 667 HB2 LEU 89 HB2 LEU 89 49.071 32.693 19.101 668 HB3 LEU 89 HB3 LEU 89 48.734 31.468 20.005 669 HG LEU 89 HG LEU 89 50.985 31.366 20.689 670 HD11 LEU 89 HD11 LEU 89 52.459 33.140 20.216 671 HD12 LEU 89 HD12 LEU 89 52.054 32.396 18.879 672 HD13 LEU 89 HD13 LEU 89 51.379 33.778 19.251 673 HD21 LEU 89 HD21 LEU 89 50.878 33.322 22.075 674 HD22 LEU 89 HD22 LEU 89 49.758 33.915 21.126 675 HD23 LEU 89 HD23 LEU 89 49.453 32.635 22.007 676 H ARG 90 H ARG 90 52.095 29.920 18.368 677 HA ARG 90 HA ARG 90 51.574 27.359 18.793 678 HB2 ARG 90 HB2 ARG 90 54.070 28.682 18.429 679 HB3 ARG 90 HB3 ARG 90 54.011 27.143 18.672 680 HG2 ARG 90 HG2 ARG 90 52.734 26.929 16.620 681 HG3 ARG 90 HG3 ARG 90 52.970 28.448 16.360 682 HD2 ARG 90 HD2 ARG 90 55.332 28.066 16.387 683 HD3 ARG 90 HD3 ARG 90 55.071 26.542 16.591 684 HE ARG 90 HE ARG 90 53.924 27.355 14.316 685 HH11 ARG 90 HH11 ARG 90 54.727 26.645 12.342 686 HH12 ARG 90 HH12 ARG 90 56.146 26.205 12.230 687 HH21 ARG 90 HH21 ARG 90 57.001 26.584 15.282 688 HH22 ARG 90 HH22 ARG 90 57.458 26.170 13.926 689 H ILE 91 H ILE 91 52.641 29.790 20.949 690 HA ILE 91 HA ILE 91 52.760 28.077 23.036 691 HB ILE 91 HB ILE 91 54.211 29.729 24.062 692 HG12 ILE 91 HG12 ILE 91 55.028 30.554 21.500 693 HG13 ILE 91 HG13 ILE 91 53.939 31.368 22.264 694 HG21 ILE 91 HG21 ILE 91 56.167 28.685 23.136 695 HG22 ILE 91 HG22 ILE 91 55.052 27.605 23.447 696 HG23 ILE 91 HG23 ILE 91 55.274 28.108 21.962 697 HD11 ILE 91 HD11 ILE 91 56.039 32.349 22.618 698 HD12 ILE 91 HD12 ILE 91 55.478 31.818 24.001 699 HD13 ILE 91 HD13 ILE 91 56.583 30.991 23.225 700 H VAL 92 H VAL 92 50.884 28.287 24.283 701 HA VAL 92 HA VAL 92 49.954 30.744 25.012 702 HB VAL 92 HB VAL 92 48.458 29.386 23.839 703 HG11 VAL 92 HG11 VAL 92 47.264 27.705 24.983 704 HG12 VAL 92 HG12 VAL 92 48.782 27.302 24.783 705 HG13 VAL 92 HG13 VAL 92 48.282 27.829 26.189 706 HG21 VAL 92 HG21 VAL 92 46.571 30.019 25.161 707 HG22 VAL 92 HG22 VAL 92 47.550 30.338 26.365 708 HG23 VAL 92 HG23 VAL 92 47.608 31.211 25.044 709 HA PRO 93 HA PRO 93 51.110 29.951 29.164 710 HB2 PRO 93 HB2 PRO 93 49.799 32.260 29.973 711 HB3 PRO 93 HB3 PRO 93 51.330 31.991 30.091 712 HG2 PRO 93 HG2 PRO 93 50.474 33.719 28.381 713 HG3 PRO 93 HG3 PRO 93 51.771 32.912 28.071 714 HD2 PRO 93 HD2 PRO 93 49.164 32.346 27.092 715 HD3 PRO 93 HD3 PRO 93 50.492 32.272 26.277 716 H GLU 94 H GLU 94 50.033 29.044 31.071 717 HA GLU 94 HA GLU 94 47.448 28.433 30.940 718 HB2 GLU 94 HB2 GLU 94 48.897 26.964 32.023 719 HB3 GLU 94 HB3 GLU 94 49.231 28.047 33.093 720 HG2 GLU 94 HG2 GLU 94 47.731 26.552 34.042 721 HG3 GLU 94 HG3 GLU 94 47.008 27.927 33.910 722 H LEU 95 H LEU 95 45.625 29.391 31.989 723 HA LEU 95 HA LEU 95 45.929 31.999 32.646 724 HB2 LEU 95 HB2 LEU 95 43.611 30.772 31.572 725 HB3 LEU 95 HB3 LEU 95 43.756 32.306 31.814 726 HG LEU 95 HG LEU 95 45.184 30.860 29.859 727 HD11 LEU 95 HD11 LEU 95 43.884 32.101 28.267 728 HD12 LEU 95 HD12 LEU 95 42.932 31.251 29.206 729 HD13 LEU 95 HD13 LEU 95 43.121 32.802 29.465 730 HD21 LEU 95 HD21 LEU 95 46.036 32.906 29.039 731 HD22 LEU 95 HD22 LEU 95 45.340 33.666 30.242 732 HD23 LEU 95 HD23 LEU 95 46.526 32.654 30.524 733 H THR 96 H THR 96 45.370 32.828 34.642 734 HA THR 96 HA THR 96 43.684 31.492 36.307 735 HB THR 96 HB THR 96 45.949 32.819 37.259 736 HG1 THR 96 HG1 THR 96 46.762 30.757 37.551 737 HG21 THR 96 HG21 THR 96 45.557 31.676 39.295 738 HG22 THR 96 HG22 THR 96 44.306 32.569 38.914 739 HG23 THR 96 HG23 THR 96 44.271 31.006 38.658 740 H PHE 97 H PHE 97 41.960 32.761 37.084 741 HA PHE 97 HA PHE 97 41.869 35.375 36.378 742 HB2 PHE 97 HB2 PHE 97 39.726 33.511 36.447 743 HB3 PHE 97 HB3 PHE 97 39.520 35.016 36.096 744 HD1 PHE 97 HD1 PHE 97 40.057 35.854 33.860 745 HD2 PHE 97 HD2 PHE 97 40.719 31.969 34.772 746 HE1 PHE 97 HE1 PHE 97 40.384 35.377 31.603 747 HE2 PHE 97 HE2 PHE 97 41.075 31.501 32.519 748 HZ PHE 97 HZ PHE 97 40.890 33.195 30.929 749 H PHE 98 H PHE 98 41.043 37.008 37.728 750 HA PHE 98 HA PHE 98 40.412 36.497 40.304 751 HB2 PHE 98 HB2 PHE 98 42.398 38.375 39.518 752 HB3 PHE 98 HB3 PHE 98 41.941 38.171 40.996 753 HD1 PHE 98 HD1 PHE 98 42.616 36.068 42.207 754 HD2 PHE 98 HD2 PHE 98 44.099 36.946 38.547 755 HE1 PHE 98 HE1 PHE 98 44.243 34.435 42.474 756 HE2 PHE 98 HE2 PHE 98 45.724 35.293 38.806 757 HZ PHE 98 HZ PHE 98 45.829 34.055 40.798 758 H TYR 99 H TYR 99 38.929 38.019 41.291 759 HA TYR 99 HA TYR 99 37.756 39.883 39.732 760 HB2 TYR 99 HB2 TYR 99 36.126 40.103 41.301 761 HB3 TYR 99 HB3 TYR 99 36.285 38.603 40.905 762 HD1 TYR 99 HD1 TYR 99 36.671 40.866 43.559 763 HD2 TYR 99 HD2 TYR 99 36.984 36.952 42.597 764 HE1 TYR 99 HE1 TYR 99 36.866 40.333 45.821 765 HE2 TYR 99 HE2 TYR 99 37.177 36.401 44.856 766 HH TYR 99 HH TYR 99 37.238 37.178 46.995 767 H ASP 100 H ASP 100 37.946 42.122 39.883 768 HA ASP 100 HA ASP 100 39.651 43.383 41.634 769 HB2 ASP 100 HB2 ASP 100 40.697 42.722 39.545 770 HB3 ASP 100 HB3 ASP 100 39.669 43.634 38.806
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