NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
629442 | 5mti | 34085 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H GLY 1 H1 GLY 1 42.946 41.849 43.789 2 HA2 GLY 1 HA2 GLY 1 44.694 41.143 42.311 3 HA3 GLY 1 HA3 GLY 1 44.353 42.881 42.130 4 H ALA 2 H ALA 2 46.680 42.652 41.186 5 HA ALA 2 HA ALA 2 48.753 42.579 43.297 6 HB1 ALA 2 HB1 ALA 2 48.920 42.657 40.281 7 HB2 ALA 2 HB2 ALA 2 50.321 42.651 41.384 8 HB3 ALA 2 HB3 ALA 2 49.199 41.276 41.352 9 H ALA 3 H ALA 3 47.982 44.865 40.618 10 HA ALA 3 HA ALA 3 48.472 47.144 42.432 11 HB1 ALA 3 HB1 ALA 3 50.284 46.509 40.070 12 HB2 ALA 3 HB2 ALA 3 50.277 48.044 40.964 13 HB3 ALA 3 HB3 ALA 3 50.737 46.545 41.784 14 H ALA 4 H ALA 4 47.627 49.068 41.793 15 HA ALA 4 HA ALA 4 45.443 48.936 39.976 16 HB1 ALA 4 HB1 ALA 4 45.017 51.228 40.735 17 HB2 ALA 4 HB2 ALA 4 45.431 50.177 42.097 18 HB3 ALA 4 HB3 ALA 4 46.641 51.311 41.452 19 H GLY 5 H GLY 5 44.887 50.180 38.213 20 HA2 GLY 5 HA2 GLY 5 45.103 51.453 36.312 21 HA3 GLY 5 HA3 GLY 5 46.724 51.921 36.801 22 H VAL 6 H VAL 6 46.702 51.743 34.358 23 HA VAL 6 HA VAL 6 47.593 49.061 33.400 24 HB VAL 6 HB VAL 6 45.302 49.621 32.698 25 HG11 VAL 6 HG11 VAL 6 44.817 51.355 31.070 26 HG12 VAL 6 HG12 VAL 6 45.395 52.066 32.570 27 HG13 VAL 6 HG13 VAL 6 46.481 51.962 31.163 28 HG21 VAL 6 HG21 VAL 6 47.243 49.627 30.355 29 HG22 VAL 6 HG22 VAL 6 46.655 48.196 31.245 30 HG23 VAL 6 HG23 VAL 6 45.530 49.182 30.314 31 H SER 7 H SER 7 49.284 49.044 31.878 32 HA SER 7 HA SER 7 50.095 51.455 30.574 33 HB2 SER 7 HB2 SER 7 52.297 51.795 31.283 34 HB3 SER 7 HB3 SER 7 51.312 51.748 32.747 35 HG SER 7 HG SER 7 53.206 50.586 32.986 36 H ALA 8 H ALA 8 51.455 51.118 28.761 37 HA ALA 8 HA ALA 8 52.336 48.347 28.185 38 HB1 ALA 8 HB1 ALA 8 50.645 50.088 26.341 39 HB2 ALA 8 HB2 ALA 8 51.328 48.493 25.941 40 HB3 ALA 8 HB3 ALA 8 50.085 48.642 27.200 41 H ALA 9 H ALA 9 54.129 48.164 26.855 42 HA ALA 9 HA ALA 9 55.290 50.595 25.612 43 HB1 ALA 9 HB1 ALA 9 56.757 48.867 27.653 44 HB2 ALA 9 HB2 ALA 9 57.485 50.148 26.661 45 HB3 ALA 9 HB3 ALA 9 56.255 50.558 27.872 46 H GLY 10 H GLY 10 55.493 50.001 23.541 47 HA2 GLY 10 HA2 GLY 10 56.457 48.905 21.740 48 HA3 GLY 10 HA3 GLY 10 57.127 47.685 22.822 49 H ILE 11 H ILE 11 56.487 45.821 21.865 50 HA ILE 11 HA ILE 11 53.633 45.136 21.823 51 HB ILE 11 HB ILE 11 53.855 45.960 19.597 52 HG12 ILE 11 HG12 ILE 11 53.435 44.010 18.173 53 HG13 ILE 11 HG13 ILE 11 54.037 42.923 19.420 54 HG21 ILE 11 HG21 ILE 11 55.488 45.190 17.950 55 HG22 ILE 11 HG22 ILE 11 56.296 45.953 19.317 56 HG23 ILE 11 HG23 ILE 11 56.290 44.186 19.166 57 HD11 ILE 11 HD11 ILE 11 51.652 44.783 19.779 58 HD12 ILE 11 HD12 ILE 11 51.536 43.083 19.268 59 HD13 ILE 11 HD13 ILE 11 52.156 43.476 20.871 60 H GLU 12 H GLU 12 53.308 43.122 22.510 61 HA GLU 12 HA GLU 12 55.497 41.089 22.479 62 HB2 GLU 12 HB2 GLU 12 53.886 42.039 24.883 63 HB3 GLU 12 HB3 GLU 12 54.819 40.559 24.886 64 HG2 GLU 12 HG2 GLU 12 55.958 43.368 24.532 65 HG3 GLU 12 HG3 GLU 12 55.986 42.412 26.003 66 HA PRO 13 HA PRO 13 52.287 38.228 21.252 67 HB2 PRO 13 HB2 PRO 13 52.749 35.982 22.799 68 HB3 PRO 13 HB3 PRO 13 53.758 36.454 21.398 69 HG2 PRO 13 HG2 PRO 13 54.262 37.080 24.324 70 HG3 PRO 13 HG3 PRO 13 55.386 36.346 23.136 71 HD2 PRO 13 HD2 PRO 13 55.497 38.977 23.623 72 HD3 PRO 13 HD3 PRO 13 55.579 38.422 21.932 73 H ASP 14 H ASP 14 50.232 37.506 21.892 74 HA ASP 14 HA ASP 14 49.003 39.226 23.818 75 HB2 ASP 14 HB2 ASP 14 47.885 36.765 22.431 76 HB3 ASP 14 HB3 ASP 14 46.933 37.999 23.257 77 H LEU 15 H LEU 15 50.307 36.064 24.210 78 HA LEU 15 HA LEU 15 49.180 35.049 26.549 79 HB2 LEU 15 HB2 LEU 15 51.417 34.587 24.944 80 HB3 LEU 15 HB3 LEU 15 52.177 35.181 26.396 81 HG LEU 15 HG LEU 15 52.154 32.789 26.372 82 HD11 LEU 15 HD11 LEU 15 50.084 33.725 28.392 83 HD12 LEU 15 HD12 LEU 15 51.860 33.808 28.553 84 HD13 LEU 15 HD13 LEU 15 51.043 32.232 28.469 85 HD21 LEU 15 HD21 LEU 15 50.153 31.416 26.323 86 HD22 LEU 15 HD22 LEU 15 50.254 32.413 24.871 87 HD23 LEU 15 HD23 LEU 15 49.122 32.858 26.164 88 H THR 16 H THR 16 51.397 37.825 26.210 89 HA THR 16 HA THR 16 51.738 38.360 29.042 90 HB THR 16 HB THR 16 52.590 40.548 28.319 91 HG1 THR 16 HG1 THR 16 52.083 39.625 25.671 92 HG21 THR 16 HG21 THR 16 54.534 39.784 27.116 93 HG22 THR 16 HG22 THR 16 53.703 38.312 26.572 94 HG23 THR 16 HG23 THR 16 54.077 38.549 28.296 95 H ALA 17 H ALA 17 49.306 39.453 26.672 96 HA ALA 17 HA ALA 17 48.090 41.411 28.418 97 HB1 ALA 17 HB1 ALA 17 47.886 41.497 25.963 98 HB2 ALA 17 HB2 ALA 17 46.946 39.988 25.988 99 HB3 ALA 17 HB3 ALA 17 46.308 41.444 26.767 100 H ILE 18 H ILE 18 47.486 37.951 27.673 101 HA ILE 18 HA ILE 18 45.275 37.573 29.453 102 HB ILE 18 HB ILE 18 47.444 35.502 28.875 103 HG12 ILE 18 HG12 ILE 18 44.820 35.978 27.360 104 HG13 ILE 18 HG13 ILE 18 46.402 36.443 26.760 105 HG21 ILE 18 HG21 ILE 18 45.938 34.964 30.776 106 HG22 ILE 18 HG22 ILE 18 44.522 35.234 29.747 107 HG23 ILE 18 HG23 ILE 18 45.631 33.888 29.426 108 HD11 ILE 18 HD11 ILE 18 45.398 33.625 27.197 109 HD12 ILE 18 HD12 ILE 18 45.907 34.400 25.692 110 HD13 ILE 18 HD13 ILE 18 47.117 34.011 26.934 111 H TRP 19 H TRP 19 48.821 37.186 30.129 112 HA TRP 19 HA TRP 19 48.482 36.630 32.897 113 HB2 TRP 19 HB2 TRP 19 50.762 37.814 31.268 114 HB3 TRP 19 HB3 TRP 19 50.868 37.705 33.021 115 HD1 TRP 19 HD1 TRP 19 51.433 35.660 30.014 116 HE1 TRP 19 HE1 TRP 19 51.712 33.190 30.581 117 HE3 TRP 19 HE3 TRP 19 50.150 35.819 34.957 118 HZ2 TRP 19 HZ2 TRP 19 51.811 31.567 32.978 119 HZ3 TRP 19 HZ3 TRP 19 50.305 33.789 36.345 120 HH2 TRP 19 HH2 TRP 19 51.174 31.652 35.393 121 H GLN 20 H GLN 20 49.041 39.931 31.407 122 HA GLN 20 HA GLN 20 49.037 41.097 34.017 123 HB2 GLN 20 HB2 GLN 20 49.122 43.214 32.932 124 HB3 GLN 20 HB3 GLN 20 50.085 42.082 31.976 125 HG2 GLN 20 HG2 GLN 20 48.062 41.768 30.495 126 HG3 GLN 20 HG3 GLN 20 47.251 43.046 31.386 127 HE21 GLN 20 HE21 GLN 20 47.121 43.784 29.046 128 HE22 GLN 20 HE22 GLN 20 48.417 44.858 28.554 129 H ALA 21 H ALA 21 46.327 40.463 31.735 130 HA ALA 21 HA ALA 21 44.402 41.897 33.333 131 HB1 ALA 21 HB1 ALA 21 44.049 39.660 31.296 132 HB2 ALA 21 HB2 ALA 21 42.769 40.723 31.924 133 HB3 ALA 21 HB3 ALA 21 44.089 41.409 30.963 134 H LEU 22 H LEU 22 45.472 38.467 33.359 135 HA LEU 22 HA LEU 22 43.472 37.722 35.359 136 HB2 LEU 22 HB2 LEU 22 45.831 36.250 34.122 137 HB3 LEU 22 HB3 LEU 22 44.761 35.542 35.312 138 HG LEU 22 HG LEU 22 44.034 36.411 32.482 139 HD11 LEU 22 HD11 LEU 22 45.081 34.182 32.797 140 HD12 LEU 22 HD12 LEU 22 43.410 34.060 32.238 141 HD13 LEU 22 HD13 LEU 22 43.790 33.753 33.946 142 HD21 LEU 22 HD21 LEU 22 42.171 35.586 34.723 143 HD22 LEU 22 HD22 LEU 22 41.735 35.547 33.000 144 HD23 LEU 22 HD23 LEU 22 42.121 37.086 33.762 145 H PHE 23 H PHE 23 46.849 38.761 35.553 146 HA PHE 23 HA PHE 23 46.829 38.279 38.467 147 HB2 PHE 23 HB2 PHE 23 48.798 37.887 36.765 148 HB3 PHE 23 HB3 PHE 23 49.079 39.618 37.014 149 HD1 PHE 23 HD1 PHE 23 50.096 40.337 39.155 150 HD2 PHE 23 HD2 PHE 23 48.850 36.250 38.622 151 HE1 PHE 23 HE1 PHE 23 51.406 39.680 41.157 152 HE2 PHE 23 HE2 PHE 23 50.122 35.605 40.640 153 HZ PHE 23 HZ PHE 23 51.441 37.305 41.895 154 H ALA 24 H ALA 24 45.736 40.781 36.500 155 HA ALA 24 HA ALA 24 45.094 42.903 36.845 156 HB1 ALA 24 HB1 ALA 24 44.856 41.961 39.724 157 HB2 ALA 24 HB2 ALA 24 44.058 43.380 39.018 158 HB3 ALA 24 HB3 ALA 24 43.648 41.755 38.436 159 H LEU 25 H LEU 25 47.536 43.158 36.280 160 HA LEU 25 HA LEU 25 48.346 45.483 37.890 161 HB2 LEU 25 HB2 LEU 25 50.817 44.768 37.589 162 HB3 LEU 25 HB3 LEU 25 49.866 44.127 38.901 163 HG LEU 25 HG LEU 25 49.607 41.987 37.762 164 HD11 LEU 25 HD11 LEU 25 49.551 42.668 35.421 165 HD12 LEU 25 HD12 LEU 25 50.835 41.488 35.687 166 HD13 LEU 25 HD13 LEU 25 51.239 43.213 35.511 167 HD21 LEU 25 HD21 LEU 25 52.484 42.976 37.667 168 HD22 LEU 25 HD22 LEU 25 51.972 41.284 37.787 169 HD23 LEU 25 HD23 LEU 25 51.647 42.403 39.125 170 HA PRO 26 HA PRO 26 49.533 47.271 33.932 171 HB2 PRO 26 HB2 PRO 26 51.441 49.074 34.670 172 HB3 PRO 26 HB3 PRO 26 49.701 49.309 35.005 173 HG2 PRO 26 HG2 PRO 26 51.823 48.232 36.882 174 HG3 PRO 26 HG3 PRO 26 50.592 49.493 37.203 175 HD2 PRO 26 HD2 PRO 26 50.239 46.902 37.934 176 HD3 PRO 26 HD3 PRO 26 48.872 47.913 37.392 177 H ALA 27 H ALA 27 50.288 45.367 33.130 178 HA ALA 27 HA ALA 27 51.672 44.127 31.922 179 HB1 ALA 27 HB1 ALA 27 53.798 46.225 32.392 180 HB2 ALA 27 HB2 ALA 27 53.657 45.111 31.017 181 HB3 ALA 27 HB3 ALA 27 52.449 46.389 31.255 182 H VAL 28 H VAL 28 53.165 42.521 31.744 183 HA VAL 28 HA VAL 28 54.572 41.748 34.267 184 HB VAL 28 HB VAL 28 54.602 39.441 33.334 185 HG11 VAL 28 HG11 VAL 28 52.996 40.270 35.071 186 HG12 VAL 28 HG12 VAL 28 51.812 40.558 33.771 187 HG13 VAL 28 HG13 VAL 28 52.401 38.914 34.117 188 HG21 VAL 28 HG21 VAL 28 54.115 39.952 30.940 189 HG22 VAL 28 HG22 VAL 28 53.018 38.760 31.647 190 HG23 VAL 28 HG23 VAL 28 52.464 40.427 31.400 191 H GLY 29 H GLY 29 56.669 41.199 34.338 192 HA2 GLY 29 HA2 GLY 29 58.409 42.216 32.235 193 HA3 GLY 29 HA3 GLY 29 58.900 41.525 33.761 194 H ARG 30 H ARG 30 59.353 41.158 30.657 195 HA ARG 30 HA ARG 30 58.570 38.666 29.726 196 HB2 ARG 30 HB2 ARG 30 59.838 40.821 28.689 197 HB3 ARG 30 HB3 ARG 30 61.237 39.769 28.867 198 HG2 ARG 30 HG2 ARG 30 59.939 38.033 27.476 199 HG3 ARG 30 HG3 ARG 30 58.726 39.307 27.221 200 HD2 ARG 30 HD2 ARG 30 60.904 40.736 26.551 201 HD3 ARG 30 HD3 ARG 30 61.584 39.137 26.257 202 HE ARG 30 HE ARG 30 59.151 40.311 24.926 203 HH11 ARG 30 HH11 ARG 30 61.867 38.036 24.537 204 HH12 ARG 30 HH12 ARG 30 61.231 37.613 22.957 205 HH21 ARG 30 HH21 ARG 30 58.693 39.869 22.989 206 HH22 ARG 30 HH22 ARG 30 59.803 38.958 21.944 207 H HIS 31 H HIS 31 61.366 39.207 31.792 208 HA HIS 31 HA HIS 31 62.661 36.684 31.105 209 HB2 HIS 31 HB2 HIS 31 63.896 38.744 31.620 210 HB3 HIS 31 HB3 HIS 31 63.222 38.766 33.243 211 HD1 HIS 31 HD1 HIS 31 65.309 38.349 34.713 212 HD2 HIS 31 HD2 HIS 31 64.866 35.658 31.514 213 HE1 HIS 31 HE1 HIS 31 67.129 36.592 35.004 214 H GLN 32 H GLN 32 59.960 37.201 33.033 215 HA GLN 32 HA GLN 32 60.794 35.357 35.155 216 HB2 GLN 32 HB2 GLN 32 59.684 37.550 35.563 217 HB3 GLN 32 HB3 GLN 32 58.191 36.885 34.897 218 HG2 GLN 32 HG2 GLN 32 58.268 36.881 37.393 219 HG3 GLN 32 HG3 GLN 32 58.097 35.253 36.744 220 HE21 GLN 32 HE21 GLN 32 60.479 37.514 38.218 221 HE22 GLN 32 HE22 GLN 32 61.617 36.226 38.632 222 H ASP 33 H ASP 33 59.584 33.572 35.870 223 HA ASP 33 HA ASP 33 58.577 31.942 33.590 224 HB2 ASP 33 HB2 ASP 33 59.827 31.050 36.215 225 HB3 ASP 33 HB3 ASP 33 59.414 30.050 34.826 226 H PHE 34 H PHE 34 56.835 30.508 33.852 227 HA PHE 34 HA PHE 34 54.519 31.351 34.979 228 HB2 PHE 34 HB2 PHE 34 54.698 29.607 33.348 229 HB3 PHE 34 HB3 PHE 34 55.350 28.449 34.507 230 HD1 PHE 34 HD1 PHE 34 53.782 27.940 36.633 231 HD2 PHE 34 HD2 PHE 34 52.429 29.479 32.842 232 HE1 PHE 34 HE1 PHE 34 51.477 27.197 37.151 233 HE2 PHE 34 HE2 PHE 34 50.114 28.768 33.386 234 HZ PHE 34 HZ PHE 34 49.638 27.615 35.531 235 H PHE 35 H PHE 35 56.803 29.231 36.843 236 HA PHE 35 HA PHE 35 54.982 28.776 38.991 237 HB2 PHE 35 HB2 PHE 35 57.034 27.467 38.554 238 HB3 PHE 35 HB3 PHE 35 58.023 28.851 39.015 239 HD1 PHE 35 HD1 PHE 35 58.654 29.100 41.312 240 HD2 PHE 35 HD2 PHE 35 55.334 26.539 40.292 241 HE1 PHE 35 HE1 PHE 35 58.533 28.316 43.663 242 HE2 PHE 35 HE2 PHE 35 55.196 25.782 42.651 243 HZ PHE 35 HZ PHE 35 56.797 26.661 44.339 244 H ALA 36 H ALA 36 57.066 31.549 38.347 245 HA ALA 36 HA ALA 36 56.445 32.802 40.973 246 HB1 ALA 36 HB1 ALA 36 57.979 34.556 40.145 247 HB2 ALA 36 HB2 ALA 36 58.738 32.950 40.109 248 HB3 ALA 36 HB3 ALA 36 58.129 33.675 38.606 249 H LEU 37 H LEU 37 55.870 33.287 37.464 250 HA LEU 37 HA LEU 37 54.316 35.645 37.564 251 HB2 LEU 37 HB2 LEU 37 54.427 33.273 35.703 252 HB3 LEU 37 HB3 LEU 37 53.312 34.567 35.381 253 HG LEU 37 HG LEU 37 56.328 34.886 35.555 254 HD11 LEU 37 HD11 LEU 37 54.411 34.868 33.203 255 HD12 LEU 37 HD12 LEU 37 55.599 33.604 33.605 256 HD13 LEU 37 HD13 LEU 37 56.159 35.210 33.123 257 HD21 LEU 37 HD21 LEU 37 54.132 36.863 34.792 258 HD22 LEU 37 HD22 LEU 37 55.862 37.119 34.487 259 HD23 LEU 37 HD23 LEU 37 55.272 37.014 36.147 260 H GLY 38 H GLY 38 53.294 32.286 38.085 261 HA2 GLY 38 HA2 GLY 38 50.456 32.856 38.205 262 HA3 GLY 38 HA3 GLY 38 51.276 31.403 38.792 263 H GLY 39 H GLY 39 52.978 33.355 40.581 264 HA2 GLY 39 HA2 GLY 39 52.916 34.230 42.696 265 HA3 GLY 39 HA3 GLY 39 51.208 34.581 42.446 266 H ASP 40 H ASP 40 50.027 32.098 42.299 267 HA ASP 40 HA ASP 40 50.842 30.511 44.656 268 HB2 ASP 40 HB2 ASP 40 48.640 32.394 44.648 269 HB3 ASP 40 HB3 ASP 40 47.956 30.781 44.634 270 H SER 41 H SER 41 49.988 28.312 44.631 271 HA SER 41 HA SER 41 49.927 27.146 42.044 272 HB2 SER 41 HB2 SER 41 49.308 25.058 43.275 273 HB3 SER 41 HB3 SER 41 50.680 25.918 44.007 274 HG SER 41 HG SER 41 49.171 25.313 45.592 275 H GLN 42 H GLN 42 47.132 27.798 44.208 276 HA GLN 42 HA GLN 42 45.218 26.686 42.333 277 HB2 GLN 42 HB2 GLN 42 44.793 28.742 44.533 278 HB3 GLN 42 HB3 GLN 42 43.520 27.889 43.649 279 HG2 GLN 42 HG2 GLN 42 44.497 25.714 44.509 280 HG3 GLN 42 HG3 GLN 42 45.592 26.677 45.517 281 HE21 GLN 42 HE21 GLN 42 42.140 25.915 44.915 282 HE22 GLN 42 HE22 GLN 42 41.583 26.514 46.479 283 H LEU 43 H LEU 43 46.855 29.750 42.507 284 HA LEU 43 HA LEU 43 45.075 31.176 40.692 285 HB2 LEU 43 HB2 LEU 43 46.517 32.015 42.708 286 HB3 LEU 43 HB3 LEU 43 47.834 32.037 41.556 287 HG LEU 43 HG LEU 43 45.213 33.588 41.416 288 HD11 LEU 43 HD11 LEU 43 48.070 34.523 41.912 289 HD12 LEU 43 HD12 LEU 43 46.791 34.366 43.139 290 HD13 LEU 43 HD13 LEU 43 46.622 35.551 41.840 291 HD21 LEU 43 HD21 LEU 43 47.577 33.666 39.500 292 HD22 LEU 43 HD22 LEU 43 46.321 34.928 39.590 293 HD23 LEU 43 HD23 LEU 43 45.876 33.288 39.116 294 H GLY 44 H GLY 44 48.267 29.523 40.482 295 HA2 GLY 44 HA2 GLY 44 48.686 29.884 37.660 296 HA3 GLY 44 HA3 GLY 44 49.329 28.576 38.664 297 H LEU 45 H LEU 45 47.019 27.246 39.498 298 HA LEU 45 HA LEU 45 46.095 25.797 37.196 299 HB2 LEU 45 HB2 LEU 45 45.358 25.963 40.111 300 HB3 LEU 45 HB3 LEU 45 44.204 25.217 39.025 301 HG LEU 45 HG LEU 45 45.718 23.512 38.346 302 HD11 LEU 45 HD11 LEU 45 47.887 24.686 40.108 303 HD12 LEU 45 HD12 LEU 45 47.889 24.712 38.321 304 HD13 LEU 45 HD13 LEU 45 47.956 23.182 39.193 305 HD21 LEU 45 HD21 LEU 45 46.044 22.350 40.471 306 HD22 LEU 45 HD22 LEU 45 44.521 23.254 40.515 307 HD23 LEU 45 HD23 LEU 45 45.947 23.885 41.364 308 H ARG 46 H ARG 46 44.554 28.484 38.954 309 HA ARG 46 HA ARG 46 42.178 28.801 37.383 310 HB2 ARG 46 HB2 ARG 46 42.634 29.829 39.577 311 HB3 ARG 46 HB3 ARG 46 43.939 30.763 38.887 312 HG2 ARG 46 HG2 ARG 46 42.189 31.963 37.473 313 HG3 ARG 46 HG3 ARG 46 40.976 31.165 38.495 314 HD2 ARG 46 HD2 ARG 46 43.256 32.998 39.399 315 HD3 ARG 46 HD3 ARG 46 41.555 33.420 39.377 316 HE ARG 46 HE ARG 46 42.972 31.809 41.400 317 HH11 ARG 46 HH11 ARG 46 39.762 32.653 40.237 318 HH12 ARG 46 HH12 ARG 46 39.027 31.950 41.671 319 HH21 ARG 46 HH21 ARG 46 41.984 31.169 43.183 320 HH22 ARG 46 HH22 ARG 46 40.246 31.300 43.367 321 H MET 47 H MET 47 45.411 30.290 36.991 322 HA MET 47 HA MET 47 44.789 31.761 34.640 323 HB2 MET 47 HB2 MET 47 46.735 32.115 36.166 324 HB3 MET 47 HB3 MET 47 47.508 30.669 35.507 325 HG2 MET 47 HG2 MET 47 46.604 33.004 33.797 326 HG3 MET 47 HG3 MET 47 48.168 32.979 34.585 327 HE1 MET 47 HE1 MET 47 48.637 33.740 32.137 328 HE2 MET 47 HE2 MET 47 48.896 32.619 30.784 329 HE3 MET 47 HE3 MET 47 47.246 33.111 31.235 330 H LEU 48 H LEU 48 46.191 28.477 35.004 331 HA LEU 48 HA LEU 48 46.432 27.790 32.294 332 HB2 LEU 48 HB2 LEU 48 47.233 26.556 34.358 333 HB3 LEU 48 HB3 LEU 48 45.599 26.002 34.628 334 HG LEU 48 HG LEU 48 46.955 24.266 33.709 335 HD11 LEU 48 HD11 LEU 48 45.165 25.053 31.387 336 HD12 LEU 48 HD12 LEU 48 44.562 24.349 32.912 337 HD13 LEU 48 HD13 LEU 48 45.695 23.451 31.886 338 HD21 LEU 48 HD21 LEU 48 47.973 24.350 31.533 339 HD22 LEU 48 HD22 LEU 48 48.593 25.662 32.547 340 HD23 LEU 48 HD23 LEU 48 47.401 26.015 31.266 341 H ALA 49 H ALA 49 43.567 27.145 34.431 342 HA ALA 49 HA ALA 49 41.953 26.092 32.332 343 HB1 ALA 49 HB1 ALA 49 41.158 27.464 34.943 344 HB2 ALA 49 HB2 ALA 49 40.102 26.448 33.941 345 HB3 ALA 49 HB3 ALA 49 41.529 25.738 34.728 346 H GLN 50 H GLN 50 42.104 29.470 33.598 347 HA GLN 50 HA GLN 50 40.051 30.377 31.780 348 HB2 GLN 50 HB2 GLN 50 42.044 31.887 33.500 349 HB3 GLN 50 HB3 GLN 50 40.754 32.648 32.553 350 HG2 GLN 50 HG2 GLN 50 39.037 31.349 33.770 351 HG3 GLN 50 HG3 GLN 50 40.277 30.521 34.703 352 HE21 GLN 50 HE21 GLN 50 38.794 31.466 36.514 353 HE22 GLN 50 HE22 GLN 50 39.235 33.062 37.053 354 H LEU 51 H LEU 51 43.646 30.300 31.450 355 HA LEU 51 HA LEU 51 43.647 31.701 28.922 356 HB2 LEU 51 HB2 LEU 51 45.646 31.421 30.243 357 HB3 LEU 51 HB3 LEU 51 45.584 29.667 30.102 358 HG LEU 51 HG LEU 51 45.692 31.314 27.558 359 HD11 LEU 51 HD11 LEU 51 47.416 32.364 28.866 360 HD12 LEU 51 HD12 LEU 51 48.198 31.266 27.722 361 HD13 LEU 51 HD13 LEU 51 48.022 30.791 29.425 362 HD21 LEU 51 HD21 LEU 51 45.557 28.847 27.331 363 HD22 LEU 51 HD22 LEU 51 46.964 28.663 28.382 364 HD23 LEU 51 HD23 LEU 51 47.123 29.430 26.787 365 H ARG 52 H ARG 52 43.265 28.216 29.772 366 HA ARG 52 HA ARG 52 43.017 27.287 27.096 367 HB2 ARG 52 HB2 ARG 52 43.339 25.960 29.207 368 HB3 ARG 52 HB3 ARG 52 41.621 26.161 29.549 369 HG2 ARG 52 HG2 ARG 52 40.999 24.884 27.589 370 HG3 ARG 52 HG3 ARG 52 42.645 24.940 26.948 371 HD2 ARG 52 HD2 ARG 52 42.198 22.742 27.924 372 HD3 ARG 52 HD3 ARG 52 43.471 23.593 28.814 373 HE ARG 52 HE ARG 52 40.703 23.860 29.851 374 HH11 ARG 52 HH11 ARG 52 43.839 22.244 30.474 375 HH12 ARG 52 HH12 ARG 52 43.397 22.140 32.177 376 HH21 ARG 52 HH21 ARG 52 40.401 23.684 31.883 377 HH22 ARG 52 HH22 ARG 52 41.597 22.880 32.946 378 H GLU 53 H GLU 53 40.564 28.692 29.229 379 HA GLU 53 HA GLU 53 38.508 28.569 27.161 380 HB2 GLU 53 HB2 GLU 53 38.673 30.161 29.735 381 HB3 GLU 53 HB3 GLU 53 37.269 30.124 28.653 382 HG2 GLU 53 HG2 GLU 53 37.169 27.642 28.863 383 HG3 GLU 53 HG3 GLU 53 38.500 27.682 30.021 384 H ARG 54 H ARG 54 40.836 31.193 27.979 385 HA ARG 54 HA ARG 54 39.641 33.056 26.071 386 HB2 ARG 54 HB2 ARG 54 42.346 33.050 27.461 387 HB3 ARG 54 HB3 ARG 54 41.771 34.358 26.446 388 HG2 ARG 54 HG2 ARG 54 40.548 33.572 29.117 389 HG3 ARG 54 HG3 ARG 54 41.572 34.946 28.762 390 HD2 ARG 54 HD2 ARG 54 39.516 35.938 28.790 391 HD3 ARG 54 HD3 ARG 54 39.697 35.628 27.068 392 HE ARG 54 HE ARG 54 38.118 33.953 29.022 393 HH11 ARG 54 HH11 ARG 54 38.231 35.361 25.785 394 HH12 ARG 54 HH12 ARG 54 36.909 34.377 25.229 395 HH21 ARG 54 HH21 ARG 54 36.398 32.800 28.261 396 HH22 ARG 54 HH22 ARG 54 36.007 32.838 26.569 397 H HIS 55 H HIS 55 42.151 30.684 25.754 398 HA HIS 55 HA HIS 55 42.795 31.634 22.990 399 HB2 HIS 55 HB2 HIS 55 44.415 32.018 24.910 400 HB3 HIS 55 HB3 HIS 55 44.600 30.285 25.038 401 HD1 HIS 55 HD1 HIS 55 44.726 30.262 21.560 402 HD2 HIS 55 HD2 HIS 55 47.107 32.142 24.466 403 HE1 HIS 55 HE1 HIS 55 46.957 30.727 20.450 404 H GLY 56 H GLY 56 41.500 28.907 24.701 405 HA2 GLY 56 HA2 GLY 56 40.761 26.883 23.862 406 HA3 GLY 56 HA3 GLY 56 41.431 27.288 22.287 407 H VAL 57 H VAL 57 43.472 27.316 25.142 408 HA VAL 57 HA VAL 57 45.124 25.101 23.985 409 HB VAL 57 HB VAL 57 45.723 28.007 24.553 410 HG11 VAL 57 HG11 VAL 57 47.578 26.872 25.661 411 HG12 VAL 57 HG12 VAL 57 47.838 25.850 24.228 412 HG13 VAL 57 HG13 VAL 57 48.092 27.613 24.150 413 HG21 VAL 57 HG21 VAL 57 46.355 26.176 22.193 414 HG22 VAL 57 HG22 VAL 57 45.016 27.333 22.259 415 HG23 VAL 57 HG23 VAL 57 46.680 27.919 22.286 416 H ASP 58 H ASP 58 46.052 23.730 25.387 417 HA ASP 58 HA ASP 58 46.013 24.161 28.317 418 HB2 ASP 58 HB2 ASP 58 46.595 21.882 26.430 419 HB3 ASP 58 HB3 ASP 58 47.470 21.908 27.948 420 H LEU 59 H LEU 59 47.886 24.457 29.535 421 HA LEU 59 HA LEU 59 50.484 24.697 28.070 422 HB2 LEU 59 HB2 LEU 59 50.015 25.865 30.802 423 HB3 LEU 59 HB3 LEU 59 51.377 26.070 29.728 424 HG LEU 59 HG LEU 59 48.584 27.177 29.206 425 HD11 LEU 59 HD11 LEU 59 49.696 29.356 29.772 426 HD12 LEU 59 HD12 LEU 59 51.121 28.449 30.315 427 HD13 LEU 59 HD13 LEU 59 49.560 28.244 31.141 428 HD21 LEU 59 HD21 LEU 59 49.930 26.827 27.135 429 HD22 LEU 59 HD22 LEU 59 51.251 27.776 27.863 430 HD23 LEU 59 HD23 LEU 59 49.689 28.542 27.492 431 HA PRO 60 HA PRO 60 50.510 20.789 30.441 432 HB2 PRO 60 HB2 PRO 60 52.331 19.386 28.941 433 HB3 PRO 60 HB3 PRO 60 50.615 19.588 28.468 434 HG2 PRO 60 HG2 PRO 60 52.996 21.228 27.543 435 HG3 PRO 60 HG3 PRO 60 51.717 20.469 26.538 436 HD2 PRO 60 HD2 PRO 60 51.598 23.077 27.252 437 HD3 PRO 60 HD3 PRO 60 50.113 22.083 27.201 438 H LEU 61 H LEU 61 51.735 20.108 32.029 439 HA LEU 61 HA LEU 61 53.687 21.624 33.192 440 HB2 LEU 61 HB2 LEU 61 52.500 18.987 33.619 441 HB3 LEU 61 HB3 LEU 61 54.201 18.927 33.987 442 HG LEU 61 HG LEU 61 53.032 19.406 35.994 443 HD11 LEU 61 HD11 LEU 61 54.144 21.310 36.794 444 HD12 LEU 61 HD12 LEU 61 54.114 22.132 35.228 445 HD13 LEU 61 HD13 LEU 61 55.176 20.734 35.474 446 HD21 LEU 61 HD21 LEU 61 51.654 21.418 36.326 447 HD22 LEU 61 HD22 LEU 61 50.958 20.352 35.096 448 HD23 LEU 61 HD23 LEU 61 51.807 21.825 34.601 449 H ARG 62 H ARG 62 54.227 19.187 30.734 450 HA ARG 62 HA ARG 62 57.038 19.053 30.587 451 HB2 ARG 62 HB2 ARG 62 54.920 19.309 28.414 452 HB3 ARG 62 HB3 ARG 62 56.640 19.136 28.058 453 HG2 ARG 62 HG2 ARG 62 56.746 16.951 29.073 454 HG3 ARG 62 HG3 ARG 62 55.094 17.096 29.690 455 HD2 ARG 62 HD2 ARG 62 55.129 15.716 27.651 456 HD3 ARG 62 HD3 ARG 62 54.202 17.185 27.404 457 HE ARG 62 HE ARG 62 56.159 18.158 26.215 458 HH11 ARG 62 HH11 ARG 62 56.556 14.702 26.639 459 HH12 ARG 62 HH12 ARG 62 57.518 14.593 25.200 460 HH21 ARG 62 HH21 ARG 62 57.401 17.980 24.624 461 HH22 ARG 62 HH22 ARG 62 57.833 16.449 23.893 462 H CYS 63 H CYS 63 55.123 21.572 28.822 463 HA CYS 63 HA CYS 63 57.565 23.083 28.337 464 HB2 CYS 63 HB2 CYS 63 54.728 23.952 27.736 465 HB3 CYS 63 HB3 CYS 63 56.223 24.663 27.142 466 HG CYS 63 HG CYS 63 57.078 22.556 25.816 467 H LEU 64 H LEU 64 55.104 23.162 30.862 468 HA LEU 64 HA LEU 64 56.060 25.693 31.984 469 HB2 LEU 64 HB2 LEU 64 54.724 23.391 33.417 470 HB3 LEU 64 HB3 LEU 64 54.979 25.004 34.052 471 HG LEU 64 HG LEU 64 52.993 24.123 31.965 472 HD11 LEU 64 HD11 LEU 64 52.434 24.058 34.401 473 HD12 LEU 64 HD12 LEU 64 51.427 25.201 33.492 474 HD13 LEU 64 HD13 LEU 64 52.779 25.799 34.478 475 HD21 LEU 64 HD21 LEU 64 52.381 26.548 31.756 476 HD22 LEU 64 HD22 LEU 64 53.888 26.063 30.958 477 HD23 LEU 64 HD23 LEU 64 53.941 26.946 32.509 478 H TYR 65 H TYR 65 57.329 22.438 32.074 479 HA TYR 65 HA TYR 65 59.281 23.179 34.183 480 HB2 TYR 65 HB2 TYR 65 58.282 20.976 34.164 481 HB3 TYR 65 HB3 TYR 65 58.959 20.632 32.574 482 HD1 TYR 65 HD1 TYR 65 59.786 21.350 36.142 483 HD2 TYR 65 HD2 TYR 65 61.228 19.866 32.353 484 HE1 TYR 65 HE1 TYR 65 61.872 20.555 37.249 485 HE2 TYR 65 HE2 TYR 65 63.316 19.083 33.463 486 HH TYR 65 HH TYR 65 63.957 19.646 36.939 487 H GLU 66 H GLU 66 59.431 22.270 30.711 488 HA GLU 66 HA GLU 66 62.268 22.977 30.636 489 HB2 GLU 66 HB2 GLU 66 62.351 21.846 28.580 490 HB3 GLU 66 HB3 GLU 66 61.319 20.907 29.658 491 HG2 GLU 66 HG2 GLU 66 59.336 22.073 28.493 492 HG3 GLU 66 HG3 GLU 66 60.480 22.657 27.314 493 H ALA 67 H ALA 67 59.426 24.816 29.851 494 HA ALA 67 HA ALA 67 61.123 26.987 28.860 495 HB1 ALA 67 HB1 ALA 67 58.892 25.828 27.137 496 HB2 ALA 67 HB2 ALA 67 59.885 27.247 26.749 497 HB3 ALA 67 HB3 ALA 67 60.633 25.647 26.822 498 HA PRO 68 HA PRO 68 56.983 28.071 31.052 499 HB2 PRO 68 HB2 PRO 68 57.783 28.836 33.567 500 HB3 PRO 68 HB3 PRO 68 57.371 27.179 33.119 501 HG2 PRO 68 HG2 PRO 68 60.116 28.539 33.141 502 HG3 PRO 68 HG3 PRO 68 59.669 26.977 33.935 503 HD2 PRO 68 HD2 PRO 68 60.890 26.994 31.539 504 HD3 PRO 68 HD3 PRO 68 59.532 25.867 31.855 505 H THR 69 H THR 69 59.873 29.754 30.393 506 HA THR 69 HA THR 69 59.151 32.331 31.509 507 HB THR 69 HB THR 69 61.180 32.250 29.338 508 HG1 THR 69 HG1 THR 69 61.646 30.893 31.787 509 HG21 THR 69 HG21 THR 69 62.483 33.444 31.038 510 HG22 THR 69 HG22 THR 69 61.264 33.034 32.276 511 HG23 THR 69 HG23 THR 69 60.848 34.135 30.949 512 H VAL 70 H VAL 70 57.910 33.892 30.548 513 HA VAL 70 HA VAL 70 56.023 32.860 28.907 514 HB VAL 70 HB VAL 70 55.316 35.365 28.435 515 HG11 VAL 70 HG11 VAL 70 54.364 35.379 30.747 516 HG12 VAL 70 HG12 VAL 70 54.132 33.862 29.857 517 HG13 VAL 70 HG13 VAL 70 55.380 33.957 31.107 518 HG21 VAL 70 HG21 VAL 70 56.132 36.966 30.035 519 HG22 VAL 70 HG22 VAL 70 57.236 35.792 30.766 520 HG23 VAL 70 HG23 VAL 70 57.520 36.369 29.105 521 H ALA 71 H ALA 71 58.764 34.641 27.458 522 HA ALA 71 HA ALA 71 57.498 34.830 24.835 523 HB1 ALA 71 HB1 ALA 71 59.764 35.397 24.096 524 HB2 ALA 71 HB2 ALA 71 59.376 36.291 25.578 525 HB3 ALA 71 HB3 ALA 71 60.449 34.874 25.634 526 H ARG 72 H ARG 72 59.729 32.603 26.415 527 HA ARG 72 HA ARG 72 60.128 30.746 24.204 528 HB2 ARG 72 HB2 ARG 72 60.661 30.593 27.213 529 HB3 ARG 72 HB3 ARG 72 61.178 29.376 26.049 530 HG2 ARG 72 HG2 ARG 72 62.661 30.881 24.948 531 HG3 ARG 72 HG3 ARG 72 61.984 32.307 25.741 532 HD2 ARG 72 HD2 ARG 72 62.900 31.625 27.887 533 HD3 ARG 72 HD3 ARG 72 63.489 30.106 27.181 534 HE ARG 72 HE ARG 72 64.493 32.400 25.728 535 HH11 ARG 72 HH11 ARG 72 65.120 30.765 28.809 536 HH12 ARG 72 HH12 ARG 72 66.831 31.180 28.684 537 HH21 ARG 72 HH21 ARG 72 66.721 32.556 25.631 538 HH22 ARG 72 HH22 ARG 72 67.634 32.220 27.091 539 H LEU 73 H LEU 73 57.996 30.845 27.024 540 HA LEU 73 HA LEU 73 56.598 28.401 26.668 541 HB2 LEU 73 HB2 LEU 73 56.537 29.962 28.650 542 HB3 LEU 73 HB3 LEU 73 55.606 31.083 27.686 543 HG LEU 73 HG LEU 73 54.150 28.683 27.419 544 HD11 LEU 73 HD11 LEU 73 55.049 29.007 30.305 545 HD12 LEU 73 HD12 LEU 73 55.492 27.647 29.241 546 HD13 LEU 73 HD13 LEU 73 53.797 27.899 29.696 547 HD21 LEU 73 HD21 LEU 73 53.745 30.950 29.406 548 HD22 LEU 73 HD22 LEU 73 52.501 29.815 28.824 549 HD23 LEU 73 HD23 LEU 73 53.251 30.956 27.693 550 H ALA 74 H ALA 74 55.750 31.732 25.437 551 HA ALA 74 HA ALA 74 53.502 30.823 23.955 552 HB1 ALA 74 HB1 ALA 74 53.870 33.151 24.604 553 HB2 ALA 74 HB2 ALA 74 55.291 33.255 23.546 554 HB3 ALA 74 HB3 ALA 74 53.675 33.030 22.841 555 H GLU 75 H GLU 75 56.963 31.019 23.051 556 HA GLU 75 HA GLU 75 56.568 30.420 20.277 557 HB2 GLU 75 HB2 GLU 75 58.612 31.478 21.389 558 HB3 GLU 75 HB3 GLU 75 59.075 29.842 21.887 559 HG2 GLU 75 HG2 GLU 75 58.868 29.202 19.400 560 HG3 GLU 75 HG3 GLU 75 58.714 30.931 19.061 561 H THR 76 H THR 76 57.317 28.324 23.082 562 HA THR 76 HA THR 76 57.440 25.855 21.583 563 HB THR 76 HB THR 76 57.029 24.789 23.907 564 HG1 THR 76 HG1 THR 76 57.596 27.398 24.789 565 HG21 THR 76 HG21 THR 76 59.335 26.767 23.525 566 HG22 THR 76 HG22 THR 76 59.272 25.110 22.885 567 HG23 THR 76 HG23 THR 76 59.317 25.370 24.634 568 H ILE 77 H ILE 77 54.773 27.340 23.501 569 HA ILE 77 HA ILE 77 52.934 25.252 22.841 570 HB ILE 77 HB ILE 77 52.441 28.092 23.759 571 HG12 ILE 77 HG12 ILE 77 53.812 26.678 25.329 572 HG13 ILE 77 HG13 ILE 77 52.284 27.208 25.973 573 HG21 ILE 77 HG21 ILE 77 50.259 27.169 24.601 574 HG22 ILE 77 HG22 ILE 77 50.352 27.312 22.839 575 HG23 ILE 77 HG23 ILE 77 50.520 25.722 23.618 576 HD11 ILE 77 HD11 ILE 77 51.349 24.931 25.644 577 HD12 ILE 77 HD12 ILE 77 52.891 24.410 24.918 578 HD13 ILE 77 HD13 ILE 77 52.827 24.911 26.615 579 H VAL 78 H VAL 78 53.734 28.236 20.981 580 HA VAL 78 HA VAL 78 51.812 27.580 18.870 581 HB VAL 78 HB VAL 78 54.288 29.289 18.941 582 HG11 VAL 78 HG11 VAL 78 52.462 28.801 16.539 583 HG12 VAL 78 HG12 VAL 78 53.642 30.116 16.669 584 HG13 VAL 78 HG13 VAL 78 54.205 28.449 16.621 585 HG21 VAL 78 HG21 VAL 78 51.337 29.871 18.503 586 HG22 VAL 78 HG22 VAL 78 52.218 30.125 20.016 587 HG23 VAL 78 HG23 VAL 78 52.619 31.087 18.588 588 H ARG 79 H ARG 79 55.347 26.753 19.179 589 HA ARG 79 HA ARG 79 55.387 25.393 16.655 590 HB2 ARG 79 HB2 ARG 79 57.449 26.182 17.617 591 HB3 ARG 79 HB3 ARG 79 57.201 25.250 19.090 592 HG2 ARG 79 HG2 ARG 79 58.911 24.207 17.710 593 HG3 ARG 79 HG3 ARG 79 57.527 23.133 17.881 594 HD2 ARG 79 HD2 ARG 79 56.763 24.100 15.558 595 HD3 ARG 79 HD3 ARG 79 58.393 24.779 15.457 596 HE ARG 79 HE ARG 79 58.534 21.985 16.109 597 HH11 ARG 79 HH11 ARG 79 57.963 24.068 13.306 598 HH12 ARG 79 HH12 ARG 79 58.525 22.846 12.204 599 HH21 ARG 79 HH21 ARG 79 58.887 20.391 14.591 600 HH22 ARG 79 HH22 ARG 79 59.247 20.910 12.958 601 H LEU 80 H LEU 80 54.823 24.091 19.912 602 HA LEU 80 HA LEU 80 54.487 21.368 18.858 603 HB2 LEU 80 HB2 LEU 80 54.334 22.503 21.679 604 HB3 LEU 80 HB3 LEU 80 54.024 20.831 21.249 605 HG LEU 80 HG LEU 80 56.402 20.863 20.145 606 HD11 LEU 80 HD11 LEU 80 56.758 23.101 22.172 607 HD12 LEU 80 HD12 LEU 80 56.948 23.256 20.408 608 HD13 LEU 80 HD13 LEU 80 58.052 22.231 21.323 609 HD21 LEU 80 HD21 LEU 80 56.026 20.989 23.186 610 HD22 LEU 80 HD22 LEU 80 57.373 20.200 22.339 611 HD23 LEU 80 HD23 LEU 80 55.729 19.562 22.172 612 H ALA 81 H ALA 81 52.496 24.008 18.887 613 HA ALA 81 HA ALA 81 50.301 24.361 18.544 614 HB1 ALA 81 HB1 ALA 81 50.699 21.831 16.914 615 HB2 ALA 81 HB2 ALA 81 49.542 23.139 16.593 616 HB3 ALA 81 HB3 ALA 81 51.281 23.452 16.468 617 H ALA 82 H ALA 82 50.204 23.523 21.009 618 HA ALA 82 HA ALA 82 49.244 21.153 21.853 619 HB1 ALA 82 HB1 ALA 82 50.022 22.935 23.304 620 HB2 ALA 82 HB2 ALA 82 48.566 23.897 22.960 621 HB3 ALA 82 HB3 ALA 82 48.437 22.369 23.851 622 HA PRO 83 HA PRO 83 45.038 21.164 20.104 623 HB2 PRO 83 HB2 PRO 83 44.519 18.498 20.131 624 HB3 PRO 83 HB3 PRO 83 45.699 19.238 19.014 625 HG2 PRO 83 HG2 PRO 83 46.267 17.920 21.699 626 HG3 PRO 83 HG3 PRO 83 47.038 17.565 20.119 627 HD2 PRO 83 HD2 PRO 83 48.179 19.260 21.896 628 HD3 PRO 83 HD3 PRO 83 48.246 19.588 20.148 629 H ALA 84 H ALA 84 45.907 20.648 23.323 630 HA ALA 84 HA ALA 84 44.838 20.711 25.250 631 HB1 ALA 84 HB1 ALA 84 42.880 22.462 23.723 632 HB2 ALA 84 HB2 ALA 84 43.299 22.563 25.449 633 HB3 ALA 84 HB3 ALA 84 44.511 22.949 24.210 634 HA PRO 85 HA PRO 85 41.447 17.582 24.376 635 HB2 PRO 85 HB2 PRO 85 42.619 15.251 25.100 636 HB3 PRO 85 HB3 PRO 85 42.984 16.042 23.542 637 HG2 PRO 85 HG2 PRO 85 44.528 16.303 26.142 638 HG3 PRO 85 HG3 PRO 85 45.166 15.809 24.542 639 HD2 PRO 85 HD2 PRO 85 45.315 18.394 25.379 640 HD3 PRO 85 HD3 PRO 85 44.957 18.007 23.680 641 H SER 86 H SER 86 42.388 19.225 26.900 642 HA SER 86 HA SER 86 41.515 17.747 29.212 643 HB2 SER 86 HB2 SER 86 41.731 20.721 28.642 644 HB3 SER 86 HB3 SER 86 41.337 20.039 30.225 645 HG SER 86 HG SER 86 43.755 20.152 28.890 646 H GLY 87 H GLY 87 39.713 18.452 30.567 647 HA2 GLY 87 HA2 GLY 87 37.167 19.127 29.173 648 HA3 GLY 87 HA3 GLY 87 37.331 18.456 30.798 649 H ASP 88 H ASP 88 36.155 20.256 31.715 650 HA ASP 88 HA ASP 88 37.876 22.660 31.997 651 HB2 ASP 88 HB2 ASP 88 36.163 24.159 31.632 652 HB3 ASP 88 HB3 ASP 88 35.746 22.917 30.463 653 H GLN 89 H GLN 89 37.384 24.058 33.787 654 HA GLN 89 HA GLN 89 35.936 22.878 36.076 655 HB2 GLN 89 HB2 GLN 89 37.650 23.553 37.635 656 HB3 GLN 89 HB3 GLN 89 38.313 22.430 36.450 657 HG2 GLN 89 HG2 GLN 89 39.205 24.450 35.162 658 HG3 GLN 89 HG3 GLN 89 38.689 25.468 36.511 659 HE21 GLN 89 HE21 GLN 89 40.616 22.558 35.707 660 HE22 GLN 89 HE22 GLN 89 41.775 22.807 37.019 661 H ASP 90 H ASP 90 35.199 24.493 37.603 662 HA ASP 90 HA ASP 90 35.284 27.322 36.643 663 HB2 ASP 90 HB2 ASP 90 33.011 25.956 38.112 664 HB3 ASP 90 HB3 ASP 90 33.133 27.682 37.753 665 H ASP 91 H ASP 91 35.594 28.897 38.116 666 HA ASP 91 HA ASP 91 36.634 28.106 40.823 667 HB2 ASP 91 HB2 ASP 91 38.277 29.827 40.601 668 HB3 ASP 91 HB3 ASP 91 38.340 28.811 39.189 669 H ALA 92 H ALA 92 34.489 30.345 39.113 670 HA ALA 92 HA ALA 92 34.411 32.349 41.115 671 HB1 ALA 92 HB1 ALA 92 32.408 33.126 39.864 672 HB2 ALA 92 HB2 ALA 92 33.788 32.773 38.814 673 HB3 ALA 92 HB3 ALA 92 32.437 31.621 38.918 674 H SER 93 H SER 93 33.595 32.353 43.084 675 HA SER 93 HA SER 93 31.857 30.423 44.239 676 HB2 SER 93 HB2 SER 93 32.376 33.332 44.971 677 HB3 SER 93 HB3 SER 93 31.513 32.177 46.001 678 HG SER 93 HG SER 93 33.817 32.421 46.422 679 H GLU 94 H GLU 94 29.685 30.184 44.323 680 HA GLU 94 HA GLU 94 27.841 31.791 42.822 681 HB2 GLU 94 HB2 GLU 94 26.101 30.552 43.988 682 HB3 GLU 94 HB3 GLU 94 27.373 29.478 43.413 683 HG2 GLU 94 HG2 GLU 94 28.333 29.507 45.770 684 HG3 GLU 94 HG3 GLU 94 26.918 30.438 46.269 685 H TYR 95 H TYR 95 26.124 33.172 43.643 686 HA TYR 95 HA TYR 95 26.981 34.827 45.979 687 HB2 TYR 95 HB2 TYR 95 25.595 36.601 44.984 688 HB3 TYR 95 HB3 TYR 95 26.956 36.102 44.000 689 HD1 TYR 95 HD1 TYR 95 23.247 35.751 44.377 690 HD2 TYR 95 HD2 TYR 95 26.671 35.311 41.782 691 HE1 TYR 95 HE1 TYR 95 21.729 35.397 42.436 692 HE2 TYR 95 HE2 TYR 95 25.163 34.999 39.844 693 HH TYR 95 HH TYR 95 23.022 35.129 39.107 694 H GLU 96 H GLU 96 25.281 35.816 47.236 695 HA GLU 96 HA GLU 96 23.790 33.663 48.396 696 HB2 GLU 96 HB2 GLU 96 25.080 35.866 49.342 697 HB3 GLU 96 HB3 GLU 96 23.425 36.452 49.413 698 HG2 GLU 96 HG2 GLU 96 24.564 33.947 50.718 699 HG3 GLU 96 HG3 GLU 96 24.119 35.456 51.526 700 H GLU 97 H GLU 97 21.601 33.408 48.787 701 HA GLU 97 HA GLU 97 19.690 34.916 47.042 702 HB2 GLU 97 HB2 GLU 97 20.039 31.895 47.238 703 HB3 GLU 97 HB3 GLU 97 18.712 32.710 46.403 704 HG2 GLU 97 HG2 GLU 97 20.321 33.794 44.865 705 HG3 GLU 97 HG3 GLU 97 21.656 32.967 45.669 706 H GLY 98 H GLY 98 20.205 33.764 50.250 707 HA2 GLY 98 HA2 GLY 98 17.555 34.460 51.089 708 HA3 GLY 98 HA3 GLY 98 17.633 32.717 50.888 709 H VAL 99 H VAL 99 20.698 33.557 52.027 710 HA VAL 99 HA VAL 99 19.976 32.675 54.735 711 HB VAL 99 HB VAL 99 22.152 32.116 53.290 712 HG11 VAL 99 HG11 VAL 99 23.270 34.247 55.149 713 HG12 VAL 99 HG12 VAL 99 24.128 33.245 53.965 714 HG13 VAL 99 HG13 VAL 99 23.029 34.517 53.420 715 HG21 VAL 99 HG21 VAL 99 23.209 31.395 55.363 716 HG22 VAL 99 HG22 VAL 99 22.116 32.418 56.307 717 HG23 VAL 99 HG23 VAL 99 21.480 31.044 55.377 718 H ILE 100 H ILE 100 20.725 35.720 53.157 719 HA ILE 100 HA ILE 100 20.657 37.116 55.793 720 HB ILE 100 HB ILE 100 21.281 39.138 54.624 721 HG12 ILE 100 HG12 ILE 100 21.621 37.474 52.106 722 HG13 ILE 100 HG13 ILE 100 20.277 38.583 52.389 723 HG21 ILE 100 HG21 ILE 100 23.180 36.843 53.993 724 HG22 ILE 100 HG22 ILE 100 23.598 38.542 54.287 725 HG23 ILE 100 HG23 ILE 100 22.953 37.560 55.601 726 HD11 ILE 100 HD11 ILE 100 21.910 39.694 51.017 727 HD12 ILE 100 HD12 ILE 100 21.911 40.466 52.615 728 HD13 ILE 100 HD13 ILE 100 23.214 39.341 52.160 729 H ARG 101 H ARG 101 19.325 38.867 56.194 730 HA ARG 101 HA ARG 101 16.544 38.616 55.393 731 HB2 ARG 101 HB2 ARG 101 17.418 39.244 57.676 732 HB3 ARG 101 HB3 ARG 101 18.008 40.766 56.994 733 HG2 ARG 101 HG2 ARG 101 15.614 41.269 56.290 734 HG3 ARG 101 HG3 ARG 101 15.132 39.801 57.167 735 HD2 ARG 101 HD2 ARG 101 16.092 40.759 59.258 736 HD3 ARG 101 HD3 ARG 101 16.608 42.192 58.349 737 HE ARG 101 HE ARG 101 13.727 41.468 58.320 738 HH11 ARG 101 HH11 ARG 101 16.111 43.697 59.686 739 HH12 ARG 101 HH12 ARG 101 14.904 44.925 59.916 740 HH21 ARG 101 HH21 ARG 101 12.306 42.961 58.709 741 HH22 ARG 101 HH22 ARG 101 12.756 44.522 59.372 Start of MODEL 2 1 H GLY 1 H1 GLY 1 43.569 48.034 34.636 2 HA2 GLY 1 HA2 GLY 1 42.329 47.269 36.541 3 HA3 GLY 1 HA3 GLY 1 42.424 45.629 35.886 4 H ALA 2 H ALA 2 45.417 46.605 38.223 5 HA ALA 2 HA ALA 2 42.508 47.308 38.419 6 HB1 ALA 2 HB1 ALA 2 42.862 47.016 40.837 7 HB2 ALA 2 HB2 ALA 2 43.186 45.541 39.920 8 HB3 ALA 2 HB3 ALA 2 44.541 46.524 40.530 9 H ALA 3 H ALA 3 45.787 48.593 38.816 10 HA ALA 3 HA ALA 3 44.722 51.231 39.721 11 HB1 ALA 3 HB1 ALA 3 46.357 50.144 41.171 12 HB2 ALA 3 HB2 ALA 3 47.506 50.017 39.834 13 HB3 ALA 3 HB3 ALA 3 47.037 51.613 40.451 14 H ALA 4 H ALA 4 46.137 53.118 38.920 15 HA ALA 4 HA ALA 4 45.755 53.291 36.079 16 HB1 ALA 4 HB1 ALA 4 46.261 55.642 36.419 17 HB2 ALA 4 HB2 ALA 4 45.228 55.048 37.726 18 HB3 ALA 4 HB3 ALA 4 46.962 55.300 38.018 19 H GLY 5 H GLY 5 48.030 51.441 36.845 20 HA2 GLY 5 HA2 GLY 5 50.538 52.758 36.200 21 HA3 GLY 5 HA3 GLY 5 50.280 51.046 36.522 22 H VAL 6 H VAL 6 48.513 52.673 33.926 23 HA VAL 6 HA VAL 6 49.327 50.679 32.036 24 HB VAL 6 HB VAL 6 48.101 52.010 30.364 25 HG11 VAL 6 HG11 VAL 6 46.595 51.642 32.989 26 HG12 VAL 6 HG12 VAL 6 45.898 51.707 31.360 27 HG13 VAL 6 HG13 VAL 6 46.955 50.362 31.805 28 HG21 VAL 6 HG21 VAL 6 47.543 53.973 32.636 29 HG22 VAL 6 HG22 VAL 6 48.544 54.303 31.201 30 HG23 VAL 6 HG23 VAL 6 46.817 53.987 31.018 31 H SER 7 H SER 7 50.540 50.789 30.132 32 HA SER 7 HA SER 7 52.203 53.086 29.437 33 HB2 SER 7 HB2 SER 7 53.352 50.669 30.885 34 HB3 SER 7 HB3 SER 7 54.353 51.641 29.792 35 HG SER 7 HG SER 7 52.800 52.904 31.748 36 H ALA 8 H ALA 8 53.902 52.357 27.754 37 HA ALA 8 HA ALA 8 52.844 50.178 25.999 38 HB1 ALA 8 HB1 ALA 8 52.566 52.424 25.043 39 HB2 ALA 8 HB2 ALA 8 54.310 52.723 25.215 40 HB3 ALA 8 HB3 ALA 8 53.724 51.454 24.113 41 H ALA 9 H ALA 9 54.100 48.516 25.625 42 HA ALA 9 HA ALA 9 57.036 48.715 25.410 43 HB1 ALA 9 HB1 ALA 9 55.645 46.864 27.401 44 HB2 ALA 9 HB2 ALA 9 57.365 46.800 26.958 45 HB3 ALA 9 HB3 ALA 9 56.713 48.217 27.787 46 H GLY 10 H GLY 10 56.124 48.519 23.170 47 HA2 GLY 10 HA2 GLY 10 55.835 47.277 21.231 48 HA3 GLY 10 HA3 GLY 10 56.293 45.843 22.145 49 H ILE 11 H ILE 11 54.795 44.536 21.172 50 HA ILE 11 HA ILE 11 51.921 44.943 21.940 51 HB ILE 11 HB ILE 11 51.366 43.345 20.108 52 HG12 ILE 11 HG12 ILE 11 54.015 44.085 18.809 53 HG13 ILE 11 HG13 ILE 11 53.853 42.585 19.707 54 HG21 ILE 11 HG21 ILE 11 51.364 45.112 18.391 55 HG22 ILE 11 HG22 ILE 11 50.964 45.763 19.984 56 HG23 ILE 11 HG23 ILE 11 52.587 46.017 19.297 57 HD11 ILE 11 HD11 ILE 11 52.283 43.344 17.254 58 HD12 ILE 11 HD12 ILE 11 53.492 42.058 17.436 59 HD13 ILE 11 HD13 ILE 11 51.939 41.918 18.272 60 H GLU 12 H GLU 12 54.399 42.451 21.448 61 HA GLU 12 HA GLU 12 54.781 40.430 22.302 62 HB2 GLU 12 HB2 GLU 12 53.627 41.684 24.810 63 HB3 GLU 12 HB3 GLU 12 54.669 40.269 24.771 64 HG2 GLU 12 HG2 GLU 12 55.461 43.071 23.850 65 HG3 GLU 12 HG3 GLU 12 55.932 42.298 25.345 66 HA PRO 13 HA PRO 13 51.751 37.477 21.868 67 HB2 PRO 13 HB2 PRO 13 52.557 36.000 24.372 68 HB3 PRO 13 HB3 PRO 13 52.355 35.374 22.704 69 HG2 PRO 13 HG2 PRO 13 54.834 35.861 23.647 70 HG3 PRO 13 HG3 PRO 13 54.400 36.395 21.989 71 HD2 PRO 13 HD2 PRO 13 54.437 38.032 24.540 72 HD3 PRO 13 HD3 PRO 13 55.139 38.424 22.941 73 H ASP 14 H ASP 14 49.627 36.902 22.279 74 HA ASP 14 HA ASP 14 48.010 38.421 24.033 75 HB2 ASP 14 HB2 ASP 14 47.463 37.194 21.897 76 HB3 ASP 14 HB3 ASP 14 47.351 35.702 22.829 77 H LEU 15 H LEU 15 49.507 35.253 24.501 78 HA LEU 15 HA LEU 15 48.502 34.275 26.883 79 HB2 LEU 15 HB2 LEU 15 50.645 33.737 25.348 80 HB3 LEU 15 HB3 LEU 15 51.489 34.741 26.489 81 HG LEU 15 HG LEU 15 51.929 32.649 27.303 82 HD11 LEU 15 HD11 LEU 15 49.342 33.140 28.801 83 HD12 LEU 15 HD12 LEU 15 50.912 33.889 29.173 84 HD13 LEU 15 HD13 LEU 15 50.719 32.140 29.298 85 HD21 LEU 15 HD21 LEU 15 49.104 31.825 26.604 86 HD22 LEU 15 HD22 LEU 15 50.343 30.767 27.333 87 HD23 LEU 15 HD23 LEU 15 50.575 31.419 25.703 88 H THR 16 H THR 16 50.592 37.122 26.437 89 HA THR 16 HA THR 16 50.954 37.485 29.354 90 HB THR 16 HB THR 16 52.440 39.278 28.873 91 HG1 THR 16 HG1 THR 16 51.649 38.985 26.161 92 HG21 THR 16 HG21 THR 16 53.026 37.031 26.902 93 HG22 THR 16 HG22 THR 16 53.312 36.967 28.656 94 HG23 THR 16 HG23 THR 16 54.193 38.134 27.659 95 H ALA 17 H ALA 17 48.938 38.809 26.838 96 HA ALA 17 HA ALA 17 47.999 41.126 28.326 97 HB1 ALA 17 HB1 ALA 17 46.332 41.206 26.503 98 HB2 ALA 17 HB2 ALA 17 47.970 41.005 25.873 99 HB3 ALA 17 HB3 ALA 17 46.864 39.616 25.930 100 H ILE 18 H ILE 18 46.742 37.814 27.699 101 HA ILE 18 HA ILE 18 44.434 38.008 29.385 102 HB ILE 18 HB ILE 18 46.095 35.591 28.558 103 HG12 ILE 18 HG12 ILE 18 43.397 36.503 27.465 104 HG13 ILE 18 HG13 ILE 18 44.912 37.009 26.735 105 HG21 ILE 18 HG21 ILE 18 44.064 34.251 29.183 106 HG22 ILE 18 HG22 ILE 18 44.768 35.048 30.577 107 HG23 ILE 18 HG23 ILE 18 43.317 35.728 29.832 108 HD11 ILE 18 HD11 ILE 18 45.516 34.653 26.299 109 HD12 ILE 18 HD12 ILE 18 43.936 34.142 26.955 110 HD13 ILE 18 HD13 ILE 18 44.012 35.140 25.503 111 H TRP 19 H TRP 19 47.731 36.636 30.142 112 HA TRP 19 HA TRP 19 47.007 36.196 32.867 113 HB2 TRP 19 HB2 TRP 19 49.687 36.314 31.481 114 HB3 TRP 19 HB3 TRP 19 49.497 35.967 33.193 115 HD1 TRP 19 HD1 TRP 19 46.671 34.355 31.485 116 HE1 TRP 19 HE1 TRP 19 47.005 31.841 31.323 117 HE3 TRP 19 HE3 TRP 19 51.690 34.173 32.465 118 HZ2 TRP 19 HZ2 TRP 19 49.200 29.965 31.492 119 HZ3 TRP 19 HZ3 TRP 19 52.891 31.999 32.394 120 HH2 TRP 19 HH2 TRP 19 51.658 29.891 31.938 121 H GLN 20 H GLN 20 48.592 39.165 31.471 122 HA GLN 20 HA GLN 20 48.815 40.309 34.097 123 HB2 GLN 20 HB2 GLN 20 49.421 42.331 33.131 124 HB3 GLN 20 HB3 GLN 20 50.032 41.107 32.028 125 HG2 GLN 20 HG2 GLN 20 47.880 41.511 30.664 126 HG3 GLN 20 HG3 GLN 20 47.598 42.925 31.686 127 HE21 GLN 20 HE21 GLN 20 50.154 41.409 29.672 128 HE22 GLN 20 HE22 GLN 20 50.745 42.937 29.005 129 H ALA 21 H ALA 21 46.079 40.380 31.720 130 HA ALA 21 HA ALA 21 44.528 42.212 33.291 131 HB1 ALA 21 HB1 ALA 21 42.673 41.485 31.844 132 HB2 ALA 21 HB2 ALA 21 44.137 41.819 30.911 133 HB3 ALA 21 HB3 ALA 21 43.659 40.134 31.239 134 H LEU 22 H LEU 22 44.802 38.645 33.466 135 HA LEU 22 HA LEU 22 42.647 38.423 35.432 136 HB2 LEU 22 HB2 LEU 22 44.870 36.475 34.720 137 HB3 LEU 22 HB3 LEU 22 43.472 36.113 35.716 138 HG LEU 22 HG LEU 22 43.268 36.950 32.786 139 HD11 LEU 22 HD11 LEU 22 42.793 34.632 32.336 140 HD12 LEU 22 HD12 LEU 22 42.946 34.227 34.067 141 HD13 LEU 22 HD13 LEU 22 44.372 34.750 33.126 142 HD21 LEU 22 HD21 LEU 22 41.241 37.529 33.949 143 HD22 LEU 22 HD22 LEU 22 41.186 35.938 34.742 144 HD23 LEU 22 HD23 LEU 22 40.967 36.086 32.981 145 H PHE 23 H PHE 23 46.231 38.545 35.689 146 HA PHE 23 HA PHE 23 46.126 38.265 38.571 147 HB2 PHE 23 HB2 PHE 23 47.889 37.360 37.004 148 HB3 PHE 23 HB3 PHE 23 48.460 39.007 36.788 149 HD1 PHE 23 HD1 PHE 23 50.612 37.789 37.329 150 HD2 PHE 23 HD2 PHE 23 47.495 38.268 40.280 151 HE1 PHE 23 HE1 PHE 23 52.246 37.358 39.140 152 HE2 PHE 23 HE2 PHE 23 49.127 37.837 42.071 153 HZ PHE 23 HZ PHE 23 51.514 37.398 41.514 154 H ALA 24 H ALA 24 45.731 40.978 36.531 155 HA ALA 24 HA ALA 24 45.269 43.114 36.912 156 HB1 ALA 24 HB1 ALA 24 44.828 42.315 39.804 157 HB2 ALA 24 HB2 ALA 24 44.151 43.718 38.954 158 HB3 ALA 24 HB3 ALA 24 43.669 42.087 38.474 159 H LEU 25 H LEU 25 47.909 42.671 36.714 160 HA LEU 25 HA LEU 25 49.138 44.814 38.365 161 HB2 LEU 25 HB2 LEU 25 51.321 43.541 38.072 162 HB3 LEU 25 HB3 LEU 25 50.162 42.935 39.227 163 HG LEU 25 HG LEU 25 49.629 41.042 37.954 164 HD11 LEU 25 HD11 LEU 25 49.425 41.961 35.677 165 HD12 LEU 25 HD12 LEU 25 50.470 40.552 35.724 166 HD13 LEU 25 HD13 LEU 25 51.190 42.178 35.600 167 HD21 LEU 25 HD21 LEU 25 52.609 41.590 37.570 168 HD22 LEU 25 HD22 LEU 25 51.839 39.998 37.609 169 HD23 LEU 25 HD23 LEU 25 51.852 41.004 39.064 170 HA PRO 26 HA PRO 26 50.102 47.063 34.904 171 HB2 PRO 26 HB2 PRO 26 53.049 47.191 35.505 172 HB3 PRO 26 HB3 PRO 26 51.887 48.518 35.210 173 HG2 PRO 26 HG2 PRO 26 52.680 47.926 37.732 174 HG3 PRO 26 HG3 PRO 26 50.962 48.299 37.393 175 HD2 PRO 26 HD2 PRO 26 52.273 45.592 37.707 176 HD3 PRO 26 HD3 PRO 26 50.744 46.195 38.410 177 H ALA 27 H ALA 27 52.772 44.647 35.073 178 HA ALA 27 HA ALA 27 52.359 43.749 32.321 179 HB1 ALA 27 HB1 ALA 27 54.658 44.316 31.601 180 HB2 ALA 27 HB2 ALA 27 53.771 45.789 32.011 181 HB3 ALA 27 HB3 ALA 27 54.961 45.131 33.151 182 H VAL 28 H VAL 28 53.965 41.933 31.813 183 HA VAL 28 HA VAL 28 54.968 40.530 34.258 184 HB VAL 28 HB VAL 28 54.060 38.406 33.453 185 HG11 VAL 28 HG11 VAL 28 52.821 39.763 35.111 186 HG12 VAL 28 HG12 VAL 28 51.851 40.446 33.786 187 HG13 VAL 28 HG13 VAL 28 51.780 38.706 34.139 188 HG21 VAL 28 HG21 VAL 28 52.312 38.267 31.765 189 HG22 VAL 28 HG22 VAL 28 52.458 39.999 31.411 190 HG23 VAL 28 HG23 VAL 28 53.795 38.893 31.029 191 H GLY 29 H GLY 29 56.551 39.016 34.043 192 HA2 GLY 29 HA2 GLY 29 57.531 37.232 33.021 193 HA3 GLY 29 HA3 GLY 29 56.991 37.818 31.451 194 H ARG 30 H ARG 30 58.650 40.351 32.674 195 HA ARG 30 HA ARG 30 60.664 40.374 30.759 196 HB2 ARG 30 HB2 ARG 30 59.795 42.277 32.117 197 HB3 ARG 30 HB3 ARG 30 60.707 41.687 33.516 198 HG2 ARG 30 HG2 ARG 30 62.839 42.039 32.282 199 HG3 ARG 30 HG3 ARG 30 61.910 42.550 30.849 200 HD2 ARG 30 HD2 ARG 30 60.868 44.317 32.279 201 HD3 ARG 30 HD3 ARG 30 62.038 43.932 33.557 202 HE ARG 30 HE ARG 30 63.688 44.382 31.454 203 HH11 ARG 30 HH11 ARG 30 60.966 46.268 32.630 204 HH12 ARG 30 HH12 ARG 30 61.467 47.710 31.793 205 HH21 ARG 30 HH21 ARG 30 64.400 46.367 30.546 206 HH22 ARG 30 HH22 ARG 30 63.431 47.793 30.850 207 H HIS 31 H HIS 31 60.928 38.986 34.020 208 HA HIS 31 HA HIS 31 63.360 37.572 33.106 209 HB2 HIS 31 HB2 HIS 31 64.023 39.762 34.259 210 HB3 HIS 31 HB3 HIS 31 63.380 39.071 35.745 211 HD1 HIS 31 HD1 HIS 31 64.685 36.556 36.382 212 HD2 HIS 31 HD2 HIS 31 66.533 39.315 33.792 213 HE1 HIS 31 HE1 HIS 31 67.161 36.015 36.424 214 H GLN 32 H GLN 32 60.654 37.683 35.378 215 HA GLN 32 HA GLN 32 61.626 35.360 36.819 216 HB2 GLN 32 HB2 GLN 32 59.373 37.267 36.972 217 HB3 GLN 32 HB3 GLN 32 58.997 35.640 37.552 218 HG2 GLN 32 HG2 GLN 32 59.743 36.883 39.437 219 HG3 GLN 32 HG3 GLN 32 61.007 35.728 39.049 220 HE21 GLN 32 HE21 GLN 32 63.049 36.549 38.147 221 HE22 GLN 32 HE22 GLN 32 63.458 38.230 38.411 222 H ASP 33 H ASP 33 61.208 33.321 36.680 223 HA ASP 33 HA ASP 33 59.713 32.115 34.513 224 HB2 ASP 33 HB2 ASP 33 60.628 30.769 37.073 225 HB3 ASP 33 HB3 ASP 33 60.409 30.045 35.485 226 H PHE 34 H PHE 34 57.826 30.755 34.784 227 HA PHE 34 HA PHE 34 55.625 31.686 36.075 228 HB2 PHE 34 HB2 PHE 34 55.692 29.986 34.309 229 HB3 PHE 34 HB3 PHE 34 56.212 28.759 35.446 230 HD1 PHE 34 HD1 PHE 34 53.435 31.029 34.454 231 HD2 PHE 34 HD2 PHE 34 54.578 27.743 37.003 232 HE1 PHE 34 HE1 PHE 34 51.045 30.565 34.923 233 HE2 PHE 34 HE2 PHE 34 52.188 27.284 37.475 234 HZ PHE 34 HZ PHE 34 50.419 28.668 36.405 235 H PHE 35 H PHE 35 58.047 29.759 37.740 236 HA PHE 35 HA PHE 35 56.577 28.987 40.046 237 HB2 PHE 35 HB2 PHE 35 59.497 29.758 40.079 238 HB3 PHE 35 HB3 PHE 35 58.689 28.493 40.995 239 HD1 PHE 35 HD1 PHE 35 57.256 26.902 38.989 240 HD2 PHE 35 HD2 PHE 35 61.127 28.799 38.713 241 HE1 PHE 35 HE1 PHE 35 57.871 25.382 37.143 242 HE2 PHE 35 HE2 PHE 35 61.756 27.239 36.892 243 HZ PHE 35 HZ PHE 35 60.132 25.535 36.095 244 H ALA 36 H ALA 36 57.789 32.131 39.144 245 HA ALA 36 HA ALA 36 56.709 33.276 41.702 246 HB1 ALA 36 HB1 ALA 36 59.080 33.820 41.340 247 HB2 ALA 36 HB2 ALA 36 58.693 34.427 39.710 248 HB3 ALA 36 HB3 ALA 36 58.058 35.261 41.146 249 H LEU 37 H LEU 37 56.751 33.517 38.131 250 HA LEU 37 HA LEU 37 55.162 35.828 37.965 251 HB2 LEU 37 HB2 LEU 37 56.710 34.514 36.214 252 HB3 LEU 37 HB3 LEU 37 55.182 33.749 35.773 253 HG LEU 37 HG LEU 37 54.260 36.173 35.524 254 HD11 LEU 37 HD11 LEU 37 55.855 37.905 35.189 255 HD12 LEU 37 HD12 LEU 37 57.237 36.769 35.303 256 HD13 LEU 37 HD13 LEU 37 56.274 37.187 36.726 257 HD21 LEU 37 HD21 LEU 37 56.411 35.112 33.652 258 HD22 LEU 37 HD22 LEU 37 55.202 36.354 33.243 259 HD23 LEU 37 HD23 LEU 37 54.680 34.710 33.618 260 H GLY 38 H GLY 38 54.078 32.569 38.478 261 HA2 GLY 38 HA2 GLY 38 51.300 33.078 37.622 262 HA3 GLY 38 HA3 GLY 38 51.901 31.664 38.501 263 H GLY 39 H GLY 39 53.100 34.034 40.372 264 HA2 GLY 39 HA2 GLY 39 52.505 35.079 42.325 265 HA3 GLY 39 HA3 GLY 39 50.807 34.999 41.836 266 H ASP 40 H ASP 40 50.218 32.394 41.701 267 HA ASP 40 HA ASP 40 51.251 30.763 43.892 268 HB2 ASP 40 HB2 ASP 40 49.414 32.370 44.881 269 HB3 ASP 40 HB3 ASP 40 48.279 31.473 43.886 270 H SER 41 H SER 41 50.616 28.449 43.470 271 HA SER 41 HA SER 41 49.775 27.785 40.859 272 HB2 SER 41 HB2 SER 41 49.312 26.119 43.354 273 HB3 SER 41 HB3 SER 41 49.184 25.565 41.683 274 HG SER 41 HG SER 41 51.191 25.049 42.212 275 H GLN 42 H GLN 42 47.671 28.685 43.607 276 HA GLN 42 HA GLN 42 45.193 27.840 42.538 277 HB2 GLN 42 HB2 GLN 42 45.757 28.829 44.821 278 HB3 GLN 42 HB3 GLN 42 45.724 30.424 44.085 279 HG2 GLN 42 HG2 GLN 42 43.421 28.433 44.217 280 HG3 GLN 42 HG3 GLN 42 43.653 29.783 45.314 281 HE21 GLN 42 HE21 GLN 42 42.401 28.815 42.254 282 HE22 GLN 42 HE22 GLN 42 41.792 30.365 41.733 283 H LEU 43 H LEU 43 46.894 30.969 42.096 284 HA LEU 43 HA LEU 43 45.071 31.936 40.055 285 HB2 LEU 43 HB2 LEU 43 47.803 32.864 41.000 286 HB3 LEU 43 HB3 LEU 43 46.876 33.683 39.747 287 HG LEU 43 HG LEU 43 46.066 33.360 42.667 288 HD11 LEU 43 HD11 LEU 43 46.752 35.811 40.991 289 HD12 LEU 43 HD12 LEU 43 47.837 35.046 42.175 290 HD13 LEU 43 HD13 LEU 43 46.324 35.799 42.715 291 HD21 LEU 43 HD21 LEU 43 44.200 34.926 42.071 292 HD22 LEU 43 HD22 LEU 43 44.016 33.334 41.343 293 HD23 LEU 43 HD23 LEU 43 44.598 34.706 40.351 294 H GLY 44 H GLY 44 48.104 30.105 39.987 295 HA2 GLY 44 HA2 GLY 44 48.656 30.135 37.211 296 HA3 GLY 44 HA3 GLY 44 48.987 28.805 38.328 297 H LEU 45 H LEU 45 46.567 27.875 39.075 298 HA LEU 45 HA LEU 45 45.470 26.432 36.853 299 HB2 LEU 45 HB2 LEU 45 44.797 26.840 39.762 300 HB3 LEU 45 HB3 LEU 45 43.520 26.247 38.705 301 HG LEU 45 HG LEU 45 44.899 24.341 38.027 302 HD11 LEU 45 HD11 LEU 45 47.191 25.336 38.478 303 HD12 LEU 45 HD12 LEU 45 46.924 23.722 39.128 304 HD13 LEU 45 HD13 LEU 45 46.875 25.117 40.215 305 HD21 LEU 45 HD21 LEU 45 44.691 24.637 41.056 306 HD22 LEU 45 HD22 LEU 45 44.730 23.117 40.141 307 HD23 LEU 45 HD23 LEU 45 43.344 24.208 39.984 308 H ARG 46 H ARG 46 44.234 29.342 38.604 309 HA ARG 46 HA ARG 46 41.898 29.785 37.029 310 HB2 ARG 46 HB2 ARG 46 42.435 30.992 39.120 311 HB3 ARG 46 HB3 ARG 46 43.773 31.804 38.328 312 HG2 ARG 46 HG2 ARG 46 42.279 32.982 36.802 313 HG3 ARG 46 HG3 ARG 46 40.871 32.145 37.474 314 HD2 ARG 46 HD2 ARG 46 42.745 33.835 39.188 315 HD3 ARG 46 HD3 ARG 46 41.403 34.544 38.292 316 HE ARG 46 HE ARG 46 40.668 32.242 39.974 317 HH11 ARG 46 HH11 ARG 46 40.977 35.771 40.107 318 HH12 ARG 46 HH12 ARG 46 39.733 35.829 41.363 319 HH21 ARG 46 HH21 ARG 46 38.978 32.533 41.258 320 HH22 ARG 46 HH22 ARG 46 38.497 34.153 41.780 321 H MET 47 H MET 47 45.191 31.108 36.482 322 HA MET 47 HA MET 47 44.306 32.466 34.116 323 HB2 MET 47 HB2 MET 47 46.435 33.393 33.942 324 HB3 MET 47 HB3 MET 47 46.053 33.305 35.648 325 HG2 MET 47 HG2 MET 47 47.505 31.272 35.829 326 HG3 MET 47 HG3 MET 47 47.886 31.412 34.126 327 HE1 MET 47 HE1 MET 47 47.615 34.232 36.980 328 HE2 MET 47 HE2 MET 47 48.518 32.906 37.749 329 HE3 MET 47 HE3 MET 47 49.332 34.434 37.371 330 H LEU 48 H LEU 48 45.831 29.267 34.525 331 HA LEU 48 HA LEU 48 46.062 28.844 31.670 332 HB2 LEU 48 HB2 LEU 48 47.212 27.454 33.361 333 HB3 LEU 48 HB3 LEU 48 45.674 26.806 33.904 334 HG LEU 48 HG LEU 48 47.043 25.339 32.420 335 HD11 LEU 48 HD11 LEU 48 44.584 24.981 32.615 336 HD12 LEU 48 HD12 LEU 48 45.354 24.340 31.154 337 HD13 LEU 48 HD13 LEU 48 44.397 25.813 31.050 338 HD21 LEU 48 HD21 LEU 48 46.208 27.179 30.141 339 HD22 LEU 48 HD22 LEU 48 47.120 25.676 30.016 340 HD23 LEU 48 HD23 LEU 48 47.849 27.078 30.827 341 H ALA 49 H ALA 49 43.418 28.079 34.039 342 HA ALA 49 HA ALA 49 41.711 26.837 32.195 343 HB1 ALA 49 HB1 ALA 49 39.963 27.352 33.903 344 HB2 ALA 49 HB2 ALA 49 41.465 26.814 34.667 345 HB3 ALA 49 HB3 ALA 49 41.039 28.532 34.658 346 H GLN 50 H GLN 50 41.825 30.303 33.081 347 HA GLN 50 HA GLN 50 39.794 31.070 31.148 348 HB2 GLN 50 HB2 GLN 50 41.728 32.601 32.895 349 HB3 GLN 50 HB3 GLN 50 40.604 33.388 31.778 350 HG2 GLN 50 HG2 GLN 50 38.728 32.044 32.917 351 HG3 GLN 50 HG3 GLN 50 39.909 31.584 34.147 352 HE21 GLN 50 HE21 GLN 50 38.502 34.469 32.530 353 HE22 GLN 50 HE22 GLN 50 38.571 35.481 33.987 354 H LEU 51 H LEU 51 43.432 31.029 30.979 355 HA LEU 51 HA LEU 51 43.535 32.058 28.302 356 HB2 LEU 51 HB2 LEU 51 45.507 31.802 29.690 357 HB3 LEU 51 HB3 LEU 51 45.233 30.060 29.824 358 HG LEU 51 HG LEU 51 45.666 29.841 27.377 359 HD11 LEU 51 HD11 LEU 51 45.194 32.151 26.669 360 HD12 LEU 51 HD12 LEU 51 46.824 31.671 26.212 361 HD13 LEU 51 HD13 LEU 51 46.581 32.736 27.618 362 HD21 LEU 51 HD21 LEU 51 47.374 29.411 29.122 363 HD22 LEU 51 HD22 LEU 51 47.906 31.104 28.997 364 HD23 LEU 51 HD23 LEU 51 48.072 30.005 27.614 365 H ARG 52 H ARG 52 42.757 28.775 29.513 366 HA ARG 52 HA ARG 52 42.703 27.532 26.941 367 HB2 ARG 52 HB2 ARG 52 42.960 26.339 29.070 368 HB3 ARG 52 HB3 ARG 52 41.285 26.678 29.491 369 HG2 ARG 52 HG2 ARG 52 40.457 25.352 27.640 370 HG3 ARG 52 HG3 ARG 52 42.099 25.137 26.992 371 HD2 ARG 52 HD2 ARG 52 42.702 24.040 29.232 372 HD3 ARG 52 HD3 ARG 52 40.987 24.074 29.617 373 HE ARG 52 HE ARG 52 40.544 22.487 27.851 374 HH11 ARG 52 HH11 ARG 52 43.974 23.135 27.853 375 HH12 ARG 52 HH12 ARG 52 44.391 21.422 27.716 376 HH21 ARG 52 HH21 ARG 52 41.140 20.435 27.238 377 HH22 ARG 52 HH22 ARG 52 42.829 20.127 26.837 378 H GLU 53 H GLU 53 39.970 28.828 28.907 379 HA GLU 53 HA GLU 53 38.229 28.431 26.585 380 HB2 GLU 53 HB2 GLU 53 36.389 29.331 27.824 381 HB3 GLU 53 HB3 GLU 53 37.225 27.987 28.568 382 HG2 GLU 53 HG2 GLU 53 36.733 29.295 30.366 383 HG3 GLU 53 HG3 GLU 53 38.415 29.707 30.057 384 H ARG 54 H ARG 54 40.189 31.213 27.425 385 HA ARG 54 HA ARG 54 38.928 32.853 25.327 386 HB2 ARG 54 HB2 ARG 54 41.571 33.097 26.814 387 HB3 ARG 54 HB3 ARG 54 41.035 34.239 25.574 388 HG2 ARG 54 HG2 ARG 54 39.031 34.799 26.866 389 HG3 ARG 54 HG3 ARG 54 39.478 33.615 28.100 390 HD2 ARG 54 HD2 ARG 54 41.612 34.900 28.468 391 HD3 ARG 54 HD3 ARG 54 40.964 36.169 27.403 392 HE ARG 54 HE ARG 54 39.200 35.299 29.591 393 HH11 ARG 54 HH11 ARG 54 41.674 37.812 28.882 394 HH12 ARG 54 HH12 ARG 54 41.203 38.607 30.368 395 HH21 ARG 54 HH21 ARG 54 38.462 36.789 30.990 396 HH22 ARG 54 HH22 ARG 54 39.554 38.094 31.462 397 H HIS 55 H HIS 55 41.831 30.798 25.416 398 HA HIS 55 HA HIS 55 42.337 31.483 22.554 399 HB2 HIS 55 HB2 HIS 55 43.644 32.518 24.561 400 HB3 HIS 55 HB3 HIS 55 44.437 30.957 24.663 401 HD1 HIS 55 HD1 HIS 55 44.723 34.250 22.907 402 HD2 HIS 55 HD2 HIS 55 45.898 30.233 22.348 403 HE1 HIS 55 HE1 HIS 55 46.532 34.268 21.147 404 H GLY 56 H GLY 56 41.617 28.741 24.441 405 HA2 GLY 56 HA2 GLY 56 41.536 26.520 23.792 406 HA3 GLY 56 HA3 GLY 56 42.138 26.992 22.202 407 H VAL 57 H VAL 57 43.486 26.916 25.552 408 HA VAL 57 HA VAL 57 46.039 25.838 24.426 409 HB VAL 57 HB VAL 57 45.581 27.705 26.761 410 HG11 VAL 57 HG11 VAL 57 48.149 26.433 25.737 411 HG12 VAL 57 HG12 VAL 57 48.114 27.855 26.793 412 HG13 VAL 57 HG13 VAL 57 47.468 26.326 27.376 413 HG21 VAL 57 HG21 VAL 57 45.430 28.796 24.536 414 HG22 VAL 57 HG22 VAL 57 46.906 29.293 25.368 415 HG23 VAL 57 HG23 VAL 57 46.989 28.088 24.075 416 H ASP 58 H ASP 58 47.028 24.176 25.240 417 HA ASP 58 HA ASP 58 46.267 23.104 27.906 418 HB2 ASP 58 HB2 ASP 58 45.813 21.540 25.912 419 HB3 ASP 58 HB3 ASP 58 47.561 21.469 25.690 420 H LEU 59 H LEU 59 47.896 23.025 29.380 421 HA LEU 59 HA LEU 59 50.618 23.865 28.497 422 HB2 LEU 59 HB2 LEU 59 49.626 25.685 29.633 423 HB3 LEU 59 HB3 LEU 59 49.130 24.661 30.991 424 HG LEU 59 HG LEU 59 51.396 24.372 31.737 425 HD11 LEU 59 HD11 LEU 59 52.598 24.155 29.587 426 HD12 LEU 59 HD12 LEU 59 53.343 25.343 30.624 427 HD13 LEU 59 HD13 LEU 59 52.330 25.880 29.259 428 HD21 LEU 59 HD21 LEU 59 50.979 27.271 30.918 429 HD22 LEU 59 HD22 LEU 59 52.025 26.680 32.228 430 HD23 LEU 59 HD23 LEU 59 50.273 26.476 32.344 431 HA PRO 60 HA PRO 60 51.189 19.768 30.417 432 HB2 PRO 60 HB2 PRO 60 53.191 18.897 28.789 433 HB3 PRO 60 HB3 PRO 60 51.461 18.807 28.361 434 HG2 PRO 60 HG2 PRO 60 53.477 20.924 27.555 435 HG3 PRO 60 HG3 PRO 60 52.325 20.034 26.506 436 HD2 PRO 60 HD2 PRO 60 51.760 22.503 27.465 437 HD3 PRO 60 HD3 PRO 60 50.485 21.260 27.313 438 H LEU 61 H LEU 61 52.675 19.098 31.832 439 HA LEU 61 HA LEU 61 54.208 21.068 33.207 440 HB2 LEU 61 HB2 LEU 61 54.312 18.038 33.497 441 HB3 LEU 61 HB3 LEU 61 54.871 19.237 34.642 442 HG LEU 61 HG LEU 61 52.943 18.491 35.599 443 HD11 LEU 61 HD11 LEU 61 51.342 20.280 35.621 444 HD12 LEU 61 HD12 LEU 61 51.857 20.857 34.024 445 HD13 LEU 61 HD13 LEU 61 52.955 20.985 35.411 446 HD21 LEU 61 HD21 LEU 61 52.081 17.197 33.639 447 HD22 LEU 61 HD22 LEU 61 51.304 18.688 33.049 448 HD23 LEU 61 HD23 LEU 61 50.849 18.007 34.614 449 H ARG 62 H ARG 62 55.050 18.728 30.730 450 HA ARG 62 HA ARG 62 57.920 18.970 30.984 451 HB2 ARG 62 HB2 ARG 62 58.026 17.967 28.740 452 HB3 ARG 62 HB3 ARG 62 57.089 17.046 29.906 453 HG2 ARG 62 HG2 ARG 62 54.999 17.746 28.865 454 HG3 ARG 62 HG3 ARG 62 55.855 18.851 27.789 455 HD2 ARG 62 HD2 ARG 62 55.496 17.059 26.405 456 HD3 ARG 62 HD3 ARG 62 57.125 16.707 26.987 457 HE ARG 62 HE ARG 62 55.234 15.415 28.710 458 HH11 ARG 62 HH11 ARG 62 56.418 15.117 25.404 459 HH12 ARG 62 HH12 ARG 62 55.891 13.460 25.292 460 HH21 ARG 62 HH21 ARG 62 54.419 13.387 28.393 461 HH22 ARG 62 HH22 ARG 62 54.567 12.614 26.837 462 H CYS 63 H CYS 63 55.607 20.882 29.041 463 HA CYS 63 HA CYS 63 57.647 22.624 27.882 464 HB2 CYS 63 HB2 CYS 63 55.572 22.590 26.731 465 HB3 CYS 63 HB3 CYS 63 54.650 22.867 28.238 466 HG CYS 63 HG CYS 63 56.575 24.916 26.450 467 H LEU 64 H LEU 64 55.541 22.756 30.775 468 HA LEU 64 HA LEU 64 56.658 25.193 31.839 469 HB2 LEU 64 HB2 LEU 64 54.477 23.936 32.302 470 HB3 LEU 64 HB3 LEU 64 55.400 22.914 33.365 471 HG LEU 64 HG LEU 64 55.985 24.819 34.814 472 HD11 LEU 64 HD11 LEU 64 56.012 26.691 33.254 473 HD12 LEU 64 HD12 LEU 64 54.757 26.985 34.452 474 HD13 LEU 64 HD13 LEU 64 54.302 26.420 32.841 475 HD21 LEU 64 HD21 LEU 64 53.908 23.529 35.218 476 HD22 LEU 64 HD22 LEU 64 53.003 24.661 34.189 477 HD23 LEU 64 HD23 LEU 64 53.735 25.218 35.711 478 H TYR 65 H TYR 65 57.937 21.949 31.909 479 HA TYR 65 HA TYR 65 60.022 22.522 33.881 480 HB2 TYR 65 HB2 TYR 65 59.148 20.261 33.576 481 HB3 TYR 65 HB3 TYR 65 59.662 20.250 31.900 482 HD1 TYR 65 HD1 TYR 65 62.007 19.946 31.271 483 HD2 TYR 65 HD2 TYR 65 60.790 20.077 35.410 484 HE1 TYR 65 HE1 TYR 65 64.262 19.166 31.967 485 HE2 TYR 65 HE2 TYR 65 63.040 19.288 36.095 486 HH TYR 65 HH TYR 65 65.179 18.824 35.401 487 H GLU 66 H GLU 66 59.848 22.476 30.292 488 HA GLU 66 HA GLU 66 62.747 23.201 30.199 489 HB2 GLU 66 HB2 GLU 66 62.752 22.587 27.942 490 HB3 GLU 66 HB3 GLU 66 61.837 21.363 28.812 491 HG2 GLU 66 HG2 GLU 66 59.714 22.476 28.044 492 HG3 GLU 66 HG3 GLU 66 60.667 23.649 27.140 493 H ALA 67 H ALA 67 59.790 24.945 29.890 494 HA ALA 67 HA ALA 67 61.241 27.384 29.049 495 HB1 ALA 67 HB1 ALA 67 59.601 27.746 27.218 496 HB2 ALA 67 HB2 ALA 67 60.533 26.261 26.961 497 HB3 ALA 67 HB3 ALA 67 58.861 26.173 27.565 498 HA PRO 68 HA PRO 68 57.634 28.151 32.014 499 HB2 PRO 68 HB2 PRO 68 58.866 28.658 34.405 500 HB3 PRO 68 HB3 PRO 68 58.425 27.027 33.852 501 HG2 PRO 68 HG2 PRO 68 61.117 28.394 33.644 502 HG3 PRO 68 HG3 PRO 68 60.768 26.742 34.218 503 HD2 PRO 68 HD2 PRO 68 61.582 27.229 31.657 504 HD3 PRO 68 HD3 PRO 68 60.424 25.928 32.068 505 H THR 69 H THR 69 59.943 29.871 30.469 506 HA THR 69 HA THR 69 59.308 32.522 31.608 507 HB THR 69 HB THR 69 60.685 32.939 29.227 508 HG1 THR 69 HG1 THR 69 61.933 30.817 30.602 509 HG21 THR 69 HG21 THR 69 61.140 34.123 31.297 510 HG22 THR 69 HG22 THR 69 62.636 33.411 30.677 511 HG23 THR 69 HG23 THR 69 61.789 32.654 32.048 512 H VAL 70 H VAL 70 57.688 33.742 30.833 513 HA VAL 70 HA VAL 70 55.640 32.291 29.636 514 HB VAL 70 HB VAL 70 55.390 34.156 31.212 515 HG11 VAL 70 HG11 VAL 70 55.664 36.015 28.811 516 HG12 VAL 70 HG12 VAL 70 55.240 36.462 30.474 517 HG13 VAL 70 HG13 VAL 70 56.857 35.839 30.109 518 HG21 VAL 70 HG21 VAL 70 53.449 33.235 29.990 519 HG22 VAL 70 HG22 VAL 70 53.252 34.947 30.397 520 HG23 VAL 70 HG23 VAL 70 53.655 34.471 28.734 521 H ALA 71 H ALA 71 57.822 34.491 27.881 522 HA ALA 71 HA ALA 71 56.174 34.489 25.465 523 HB1 ALA 71 HB1 ALA 71 57.727 36.339 26.058 524 HB2 ALA 71 HB2 ALA 71 59.106 35.232 25.860 525 HB3 ALA 71 HB3 ALA 71 58.085 35.639 24.471 526 H ARG 72 H ARG 72 58.872 32.515 26.693 527 HA ARG 72 HA ARG 72 59.131 30.973 24.177 528 HB2 ARG 72 HB2 ARG 72 60.429 30.820 26.918 529 HB3 ARG 72 HB3 ARG 72 60.452 29.424 25.842 530 HG2 ARG 72 HG2 ARG 72 62.468 30.585 25.469 531 HG3 ARG 72 HG3 ARG 72 61.467 30.770 24.038 532 HD2 ARG 72 HD2 ARG 72 60.884 33.086 24.747 533 HD3 ARG 72 HD3 ARG 72 61.821 32.856 26.232 534 HE ARG 72 HE ARG 72 63.804 33.172 25.040 535 HH11 ARG 72 HH11 ARG 72 61.248 32.873 22.579 536 HH12 ARG 72 HH12 ARG 72 62.448 33.146 21.321 537 HH21 ARG 72 HH21 ARG 72 65.095 33.513 23.361 538 HH22 ARG 72 HH22 ARG 72 64.458 33.505 21.715 539 H LEU 73 H LEU 73 57.523 30.537 27.322 540 HA LEU 73 HA LEU 73 56.374 27.999 26.878 541 HB2 LEU 73 HB2 LEU 73 56.388 29.474 28.930 542 HB3 LEU 73 HB3 LEU 73 55.123 30.429 28.240 543 HG LEU 73 HG LEU 73 54.428 27.555 28.195 544 HD11 LEU 73 HD11 LEU 73 55.062 28.852 30.881 545 HD12 LEU 73 HD12 LEU 73 55.738 27.344 30.216 546 HD13 LEU 73 HD13 LEU 73 54.042 27.419 30.686 547 HD21 LEU 73 HD21 LEU 73 53.120 29.966 29.522 548 HD22 LEU 73 HD22 LEU 73 52.359 28.398 29.172 549 HD23 LEU 73 HD23 LEU 73 52.858 29.457 27.841 550 H ALA 74 H ALA 74 54.918 31.227 26.125 551 HA ALA 74 HA ALA 74 52.679 30.293 24.696 552 HB1 ALA 74 HB1 ALA 74 52.601 32.565 23.788 553 HB2 ALA 74 HB2 ALA 74 53.116 32.630 25.488 554 HB3 ALA 74 HB3 ALA 74 54.311 32.830 24.201 555 H GLU 75 H GLU 75 55.973 31.081 23.423 556 HA GLU 75 HA GLU 75 55.011 30.596 20.723 557 HB2 GLU 75 HB2 GLU 75 56.704 32.294 21.480 558 HB3 GLU 75 HB3 GLU 75 57.911 30.990 21.491 559 HG2 GLU 75 HG2 GLU 75 57.620 30.711 19.086 560 HG3 GLU 75 HG3 GLU 75 56.131 31.679 19.131 561 H THR 76 H THR 76 56.780 28.581 23.019 562 HA THR 76 HA THR 76 57.269 26.379 21.177 563 HB THR 76 HB THR 76 57.285 24.920 23.241 564 HG1 THR 76 HG1 THR 76 57.217 27.381 24.598 565 HG21 THR 76 HG21 THR 76 59.406 25.894 24.116 566 HG22 THR 76 HG22 THR 76 59.111 27.365 23.160 567 HG23 THR 76 HG23 THR 76 59.368 25.808 22.346 568 H ILE 77 H ILE 77 54.587 27.015 23.527 569 HA ILE 77 HA ILE 77 53.037 24.779 22.703 570 HB ILE 77 HB ILE 77 52.252 27.423 23.962 571 HG12 ILE 77 HG12 ILE 77 53.720 25.991 25.340 572 HG13 ILE 77 HG13 ILE 77 52.126 26.174 26.041 573 HG21 ILE 77 HG21 ILE 77 50.210 26.664 22.957 574 HG22 ILE 77 HG22 ILE 77 50.492 24.993 23.483 575 HG23 ILE 77 HG23 ILE 77 50.136 26.253 24.672 576 HD11 ILE 77 HD11 ILE 77 53.171 23.706 24.573 577 HD12 ILE 77 HD12 ILE 77 52.986 23.912 26.314 578 HD13 ILE 77 HD13 ILE 77 51.548 23.871 25.286 579 H VAL 78 H VAL 78 53.171 28.032 21.231 580 HA VAL 78 HA VAL 78 51.185 27.469 19.206 581 HB VAL 78 HB VAL 78 53.428 29.485 19.397 582 HG11 VAL 78 HG11 VAL 78 52.414 30.628 17.423 583 HG12 VAL 78 HG12 VAL 78 53.198 29.114 16.993 584 HG13 VAL 78 HG13 VAL 78 51.425 29.187 17.118 585 HG21 VAL 78 HG21 VAL 78 51.351 29.753 20.810 586 HG22 VAL 78 HG22 VAL 78 51.586 31.056 19.637 587 HG23 VAL 78 HG23 VAL 78 50.391 29.775 19.318 588 H ARG 79 H ARG 79 54.832 27.353 18.843 589 HA ARG 79 HA ARG 79 54.509 26.411 16.159 590 HB2 ARG 79 HB2 ARG 79 56.867 26.215 16.014 591 HB3 ARG 79 HB3 ARG 79 56.461 27.660 16.941 592 HG2 ARG 79 HG2 ARG 79 57.005 26.444 19.043 593 HG3 ARG 79 HG3 ARG 79 57.373 24.993 18.133 594 HD2 ARG 79 HD2 ARG 79 59.353 26.306 18.904 595 HD3 ARG 79 HD3 ARG 79 59.320 25.905 17.187 596 HE ARG 79 HE ARG 79 58.254 28.388 17.102 597 HH11 ARG 79 HH11 ARG 79 61.238 27.358 18.648 598 HH12 ARG 79 HH12 ARG 79 61.923 28.963 18.514 599 HH21 ARG 79 HH21 ARG 79 59.165 30.257 16.925 600 HH22 ARG 79 HH22 ARG 79 60.684 30.648 17.745 601 H LEU 80 H LEU 80 54.793 24.546 19.102 602 HA LEU 80 HA LEU 80 55.292 22.007 17.773 603 HB2 LEU 80 HB2 LEU 80 54.245 22.720 20.536 604 HB3 LEU 80 HB3 LEU 80 54.701 21.091 20.040 605 HG LEU 80 HG LEU 80 56.673 23.428 19.976 606 HD11 LEU 80 HD11 LEU 80 57.573 22.594 22.066 607 HD12 LEU 80 HD12 LEU 80 56.302 21.350 22.162 608 HD13 LEU 80 HD13 LEU 80 55.886 23.077 22.287 609 HD21 LEU 80 HD21 LEU 80 58.363 21.641 20.011 610 HD22 LEU 80 HD22 LEU 80 57.326 21.501 18.589 611 HD23 LEU 80 HD23 LEU 80 57.084 20.416 19.978 612 H ALA 81 H ALA 81 52.414 23.873 18.308 613 HA ALA 81 HA ALA 81 50.197 23.487 17.980 614 HB1 ALA 81 HB1 ALA 81 51.424 22.286 15.478 615 HB2 ALA 81 HB2 ALA 81 49.800 22.995 15.626 616 HB3 ALA 81 HB3 ALA 81 51.233 24.023 15.821 617 H ALA 82 H ALA 82 50.583 21.696 19.839 618 HA ALA 82 HA ALA 82 49.458 19.085 18.898 619 HB1 ALA 82 HB1 ALA 82 51.868 18.973 19.290 620 HB2 ALA 82 HB2 ALA 82 51.664 19.667 20.913 621 HB3 ALA 82 HB3 ALA 82 51.002 18.067 20.539 622 HA PRO 83 HA PRO 83 46.516 20.719 22.078 623 HB2 PRO 83 HB2 PRO 83 44.725 18.880 20.494 624 HB3 PRO 83 HB3 PRO 83 44.361 20.490 21.179 625 HG2 PRO 83 HG2 PRO 83 44.884 20.246 18.542 626 HG3 PRO 83 HG3 PRO 83 45.632 21.589 19.472 627 HD2 PRO 83 HD2 PRO 83 46.867 18.927 18.698 628 HD3 PRO 83 HD3 PRO 83 47.542 20.575 18.543 629 H ALA 84 H ALA 84 45.065 19.591 23.667 630 HA ALA 84 HA ALA 84 45.376 16.727 23.964 631 HB1 ALA 84 HB1 ALA 84 47.453 17.319 24.967 632 HB2 ALA 84 HB2 ALA 84 46.678 18.572 25.955 633 HB3 ALA 84 HB3 ALA 84 46.331 16.864 26.266 634 HA PRO 85 HA PRO 85 41.326 17.596 25.746 635 HB2 PRO 85 HB2 PRO 85 41.502 14.743 26.642 636 HB3 PRO 85 HB3 PRO 85 40.195 15.542 25.716 637 HG2 PRO 85 HG2 PRO 85 41.925 13.848 24.496 638 HG3 PRO 85 HG3 PRO 85 41.488 15.391 23.692 639 HD2 PRO 85 HD2 PRO 85 43.936 14.814 25.350 640 HD3 PRO 85 HD3 PRO 85 43.797 15.545 23.716 641 H SER 86 H SER 86 40.205 17.404 27.838 642 HA SER 86 HA SER 86 39.970 17.425 30.094 643 HB2 SER 86 HB2 SER 86 41.850 15.061 29.817 644 HB3 SER 86 HB3 SER 86 40.777 15.361 31.190 645 HG SER 86 HG SER 86 39.009 15.161 29.892 646 H GLY 87 H GLY 87 42.015 19.304 29.361 647 HA2 GLY 87 HA2 GLY 87 44.065 19.291 31.485 648 HA3 GLY 87 HA3 GLY 87 43.763 20.567 30.293 649 H ASP 88 H ASP 88 42.257 18.939 33.060 650 HA ASP 88 HA ASP 88 40.420 21.228 33.428 651 HB2 ASP 88 HB2 ASP 88 40.171 18.339 34.294 652 HB3 ASP 88 HB3 ASP 88 38.935 19.576 34.492 653 H GLN 89 H GLN 89 39.754 21.923 35.559 654 HA GLN 89 HA GLN 89 41.331 21.429 37.943 655 HB2 GLN 89 HB2 GLN 89 42.486 23.561 38.004 656 HB3 GLN 89 HB3 GLN 89 43.008 22.656 36.609 657 HG2 GLN 89 HG2 GLN 89 41.064 24.986 36.534 658 HG3 GLN 89 HG3 GLN 89 42.780 25.057 36.157 659 HE21 GLN 89 HE21 GLN 89 43.543 23.513 34.380 660 HE22 GLN 89 HE22 GLN 89 42.424 23.204 33.052 661 H ASP 90 H ASP 90 40.707 22.727 39.741 662 HA ASP 90 HA ASP 90 38.205 24.345 39.453 663 HB2 ASP 90 HB2 ASP 90 38.121 22.276 40.828 664 HB3 ASP 90 HB3 ASP 90 39.367 22.941 41.879 665 H ASP 91 H ASP 91 37.970 26.313 40.575 666 HA ASP 91 HA ASP 91 40.498 27.791 41.143 667 HB2 ASP 91 HB2 ASP 91 39.294 28.476 39.167 668 HB3 ASP 91 HB3 ASP 91 37.799 28.648 40.090 669 H ALA 92 H ALA 92 37.895 26.521 42.967 670 HA ALA 92 HA ALA 92 36.817 27.173 44.897 671 HB1 ALA 92 HB1 ALA 92 39.710 27.802 45.586 672 HB2 ALA 92 HB2 ALA 92 38.415 27.404 46.737 673 HB3 ALA 92 HB3 ALA 92 38.958 26.193 45.557 674 H SER 93 H SER 93 36.161 29.092 43.285 675 HA SER 93 HA SER 93 37.452 31.502 43.280 676 HB2 SER 93 HB2 SER 93 34.528 31.009 42.684 677 HB3 SER 93 HB3 SER 93 35.526 32.324 42.011 678 HG SER 93 HG SER 93 36.836 30.693 41.041 679 H GLU 94 H GLU 94 36.801 33.692 43.797 680 HA GLU 94 HA GLU 94 36.403 33.924 46.619 681 HB2 GLU 94 HB2 GLU 94 36.587 36.337 46.322 682 HB3 GLU 94 HB3 GLU 94 37.915 35.434 45.620 683 HG2 GLU 94 HG2 GLU 94 35.590 36.466 43.937 684 HG3 GLU 94 HG3 GLU 94 37.000 37.444 44.314 685 H TYR 95 H TYR 95 34.861 34.725 47.882 686 HA TYR 95 HA TYR 95 32.089 34.878 46.762 687 HB2 TYR 95 HB2 TYR 95 32.793 32.797 47.984 688 HB3 TYR 95 HB3 TYR 95 33.079 33.771 49.416 689 HD1 TYR 95 HD1 TYR 95 31.199 34.542 50.798 690 HD2 TYR 95 HD2 TYR 95 30.520 32.435 47.103 691 HE1 TYR 95 HE1 TYR 95 28.818 34.211 51.414 692 HE2 TYR 95 HE2 TYR 95 28.147 32.102 47.726 693 HH TYR 95 HH TYR 95 26.525 32.488 49.264 694 H GLU 96 H GLU 96 30.540 36.169 47.949 695 HA GLU 96 HA GLU 96 31.538 37.991 50.039 696 HB2 GLU 96 HB2 GLU 96 30.671 40.005 49.009 697 HB3 GLU 96 HB3 GLU 96 31.936 39.281 48.026 698 HG2 GLU 96 HG2 GLU 96 30.100 38.274 46.570 699 HG3 GLU 96 HG3 GLU 96 28.939 39.239 47.496 700 H GLU 97 H GLU 97 29.902 38.878 51.375 701 HA GLU 97 HA GLU 97 27.274 37.481 51.234 702 HB2 GLU 97 HB2 GLU 97 29.255 36.219 52.483 703 HB3 GLU 97 HB3 GLU 97 28.830 37.309 53.799 704 HG2 GLU 97 HG2 GLU 97 26.429 36.490 53.589 705 HG3 GLU 97 HG3 GLU 97 26.961 35.376 52.332 706 H GLY 98 H GLY 98 27.867 40.227 50.864 707 HA2 GLY 98 HA2 GLY 98 27.410 41.832 53.211 708 HA3 GLY 98 HA3 GLY 98 27.411 42.370 51.528 709 H VAL 99 H VAL 99 25.186 39.844 52.211 710 HA VAL 99 HA VAL 99 22.790 41.475 51.939 711 HB VAL 99 HB VAL 99 22.955 39.185 51.102 712 HG11 VAL 99 HG11 VAL 99 24.319 38.115 52.838 713 HG12 VAL 99 HG12 VAL 99 22.999 38.303 54.008 714 HG13 VAL 99 HG13 VAL 99 22.801 37.246 52.598 715 HG21 VAL 99 HG21 VAL 99 20.789 38.381 51.787 716 HG22 VAL 99 HG22 VAL 99 20.795 39.417 53.221 717 HG23 VAL 99 HG23 VAL 99 20.747 40.134 51.589 718 H ILE 100 H ILE 100 21.158 41.753 53.629 719 HA ILE 100 HA ILE 100 21.991 41.411 56.423 720 HB ILE 100 HB ILE 100 23.087 43.516 55.718 721 HG12 ILE 100 HG12 ILE 100 20.907 43.956 57.790 722 HG13 ILE 100 HG13 ILE 100 22.395 43.042 58.059 723 HG21 ILE 100 HG21 ILE 100 20.311 44.738 55.455 724 HG22 ILE 100 HG22 ILE 100 21.876 45.524 55.188 725 HG23 ILE 100 HG23 ILE 100 21.333 44.271 54.076 726 HD11 ILE 100 HD11 ILE 100 22.670 45.258 58.964 727 HD12 ILE 100 HD12 ILE 100 23.731 45.089 57.551 728 HD13 ILE 100 HD13 ILE 100 22.211 46.012 57.430 729 H ARG 101 H ARG 101 20.351 41.305 57.857 730 HA ARG 101 HA ARG 101 17.716 40.729 56.765 731 HB2 ARG 101 HB2 ARG 101 18.711 40.606 59.634 732 HB3 ARG 101 HB3 ARG 101 17.247 39.857 59.008 733 HG2 ARG 101 HG2 ARG 101 18.501 38.244 57.733 734 HG3 ARG 101 HG3 ARG 101 20.019 39.124 57.979 735 HD2 ARG 101 HD2 ARG 101 19.824 38.727 60.448 736 HD3 ARG 101 HD3 ARG 101 18.426 37.708 60.130 737 HE ARG 101 HE ARG 101 19.814 36.014 59.363 738 HH11 ARG 101 HH11 ARG 101 21.823 38.919 59.563 739 HH12 ARG 101 HH12 ARG 101 23.283 37.945 59.593 740 HH21 ARG 101 HH21 ARG 101 21.653 34.959 59.185 741 HH22 ARG 101 HH22 ARG 101 23.211 35.755 59.344 Start of MODEL 3 1 H GLY 1 H1 GLY 1 68.075 34.389 44.286 2 HA2 GLY 1 HA2 GLY 1 66.265 35.905 44.134 3 HA3 GLY 1 HA3 GLY 1 67.628 36.656 44.994 4 H ALA 2 H ALA 2 65.513 38.008 43.682 5 HA ALA 2 HA ALA 2 64.982 39.672 42.371 6 HB1 ALA 2 HB1 ALA 2 67.936 40.106 41.906 7 HB2 ALA 2 HB2 ALA 2 66.633 41.275 41.628 8 HB3 ALA 2 HB3 ALA 2 66.976 40.716 43.276 9 H ALA 3 H ALA 3 64.294 40.231 40.410 10 HA ALA 3 HA ALA 3 64.290 38.298 38.300 11 HB1 ALA 3 HB1 ALA 3 63.353 41.200 38.411 12 HB2 ALA 3 HB2 ALA 3 62.887 40.010 37.186 13 HB3 ALA 3 HB3 ALA 3 62.396 39.779 38.871 14 H ALA 4 H ALA 4 65.947 37.884 37.033 15 HA ALA 4 HA ALA 4 67.760 40.040 36.045 16 HB1 ALA 4 HB1 ALA 4 68.663 38.819 38.019 17 HB2 ALA 4 HB2 ALA 4 68.533 37.299 37.103 18 HB3 ALA 4 HB3 ALA 4 69.636 38.580 36.559 19 H GLY 5 H GLY 5 65.453 38.319 34.780 20 HA2 GLY 5 HA2 GLY 5 66.613 36.640 32.781 21 HA3 GLY 5 HA3 GLY 5 64.988 37.339 32.784 22 H VAL 6 H VAL 6 66.810 36.958 30.533 23 HA VAL 6 HA VAL 6 67.248 39.763 29.587 24 HB VAL 6 HB VAL 6 69.262 37.498 29.259 25 HG11 VAL 6 HG11 VAL 6 69.434 39.124 27.449 26 HG12 VAL 6 HG12 VAL 6 69.393 40.472 28.612 27 HG13 VAL 6 HG13 VAL 6 70.780 39.364 28.550 28 HG21 VAL 6 HG21 VAL 6 70.732 38.781 30.790 29 HG22 VAL 6 HG22 VAL 6 69.384 39.881 31.149 30 HG23 VAL 6 HG23 VAL 6 69.307 38.163 31.608 31 H SER 7 H SER 7 67.074 40.077 27.391 32 HA SER 7 HA SER 7 66.365 39.875 25.290 33 HB2 SER 7 HB2 SER 7 67.868 37.861 25.165 34 HB3 SER 7 HB3 SER 7 66.431 36.856 25.407 35 HG SER 7 HG SER 7 67.330 37.827 23.190 36 H ALA 8 H ALA 8 64.431 40.285 24.521 37 HA ALA 8 HA ALA 8 62.104 38.672 25.407 38 HB1 ALA 8 HB1 ALA 8 62.230 40.689 26.825 39 HB2 ALA 8 HB2 ALA 8 62.269 41.714 25.375 40 HB3 ALA 8 HB3 ALA 8 60.821 40.759 25.751 41 H ALA 9 H ALA 9 60.392 38.514 24.048 42 HA ALA 9 HA ALA 9 60.872 38.479 21.255 43 HB1 ALA 9 HB1 ALA 9 58.440 37.904 21.162 44 HB2 ALA 9 HB2 ALA 9 59.308 36.978 22.398 45 HB3 ALA 9 HB3 ALA 9 58.281 38.353 22.869 46 H GLY 10 H GLY 10 59.954 39.667 19.527 47 HA2 GLY 10 HA2 GLY 10 59.739 42.507 19.772 48 HA3 GLY 10 HA3 GLY 10 59.339 41.528 18.360 49 H ILE 11 H ILE 11 57.219 40.022 19.964 50 HA ILE 11 HA ILE 11 55.032 42.030 19.873 51 HB ILE 11 HB ILE 11 53.535 40.125 20.147 52 HG12 ILE 11 HG12 ILE 11 55.968 38.292 20.058 53 HG13 ILE 11 HG13 ILE 11 55.092 38.686 21.531 54 HG21 ILE 11 HG21 ILE 11 55.537 39.625 17.916 55 HG22 ILE 11 HG22 ILE 11 53.821 39.184 17.949 56 HG23 ILE 11 HG23 ILE 11 54.286 40.885 17.907 57 HD11 ILE 11 HD11 ILE 11 53.935 37.222 19.134 58 HD12 ILE 11 HD12 ILE 11 54.345 36.548 20.720 59 HD13 ILE 11 HD13 ILE 11 53.019 37.714 20.578 60 H GLU 12 H GLU 12 53.359 42.000 21.592 61 HA GLU 12 HA GLU 12 54.335 41.127 24.279 62 HB2 GLU 12 HB2 GLU 12 53.138 43.218 24.372 63 HB3 GLU 12 HB3 GLU 12 51.749 42.508 23.533 64 HG2 GLU 12 HG2 GLU 12 51.378 40.943 25.392 65 HG3 GLU 12 HG3 GLU 12 52.878 41.456 26.161 66 HA PRO 13 HA PRO 13 52.640 37.130 22.967 67 HB2 PRO 13 HB2 PRO 13 52.886 36.625 25.935 68 HB3 PRO 13 HB3 PRO 13 53.328 35.550 24.571 69 HG2 PRO 13 HG2 PRO 13 55.252 36.939 25.865 70 HG3 PRO 13 HG3 PRO 13 55.268 36.863 24.072 71 HD2 PRO 13 HD2 PRO 13 54.262 39.099 25.852 72 HD3 PRO 13 HD3 PRO 13 55.268 39.182 24.377 73 H ASP 14 H ASP 14 50.665 35.956 23.164 74 HA ASP 14 HA ASP 14 48.350 37.502 24.048 75 HB2 ASP 14 HB2 ASP 14 48.818 34.740 22.926 76 HB3 ASP 14 HB3 ASP 14 47.291 35.076 23.739 77 H LEU 15 H LEU 15 50.228 34.878 25.435 78 HA LEU 15 HA LEU 15 48.460 34.218 27.590 79 HB2 LEU 15 HB2 LEU 15 51.456 33.750 27.191 80 HB3 LEU 15 HB3 LEU 15 50.523 33.143 28.552 81 HG LEU 15 HG LEU 15 49.033 31.921 26.926 82 HD11 LEU 15 HD11 LEU 15 49.396 32.917 24.797 83 HD12 LEU 15 HD12 LEU 15 50.120 31.320 24.713 84 HD13 LEU 15 HD13 LEU 15 51.160 32.739 24.931 85 HD21 LEU 15 HD21 LEU 15 50.646 30.074 26.635 86 HD22 LEU 15 HD22 LEU 15 50.796 30.814 28.233 87 HD23 LEU 15 HD23 LEU 15 51.987 31.187 26.974 88 H THR 16 H THR 16 51.338 36.413 27.473 89 HA THR 16 HA THR 16 51.141 37.064 30.302 90 HB THR 16 HB THR 16 52.646 38.930 29.831 91 HG1 THR 16 HG1 THR 16 52.798 39.691 27.962 92 HG21 THR 16 HG21 THR 16 53.636 36.699 30.146 93 HG22 THR 16 HG22 THR 16 54.593 37.699 29.038 94 HG23 THR 16 HG23 THR 16 53.559 36.408 28.390 95 H ALA 17 H ALA 17 49.843 38.538 27.319 96 HA ALA 17 HA ALA 17 48.653 40.792 28.539 97 HB1 ALA 17 HB1 ALA 17 48.971 40.517 26.128 98 HB2 ALA 17 HB2 ALA 17 47.763 39.212 26.095 99 HB3 ALA 17 HB3 ALA 17 47.283 40.869 26.504 100 H ILE 18 H ILE 18 47.157 37.535 27.931 101 HA ILE 18 HA ILE 18 44.714 38.147 29.316 102 HB ILE 18 HB ILE 18 46.110 35.532 28.673 103 HG12 ILE 18 HG12 ILE 18 43.488 36.724 27.646 104 HG13 ILE 18 HG13 ILE 18 45.035 37.081 26.904 105 HG21 ILE 18 HG21 ILE 18 44.741 35.112 30.713 106 HG22 ILE 18 HG22 ILE 18 43.342 35.869 29.931 107 HG23 ILE 18 HG23 ILE 18 44.013 34.353 29.309 108 HD11 ILE 18 HD11 ILE 18 43.897 35.353 25.644 109 HD12 ILE 18 HD12 ILE 18 45.382 34.707 26.360 110 HD13 ILE 18 HD13 ILE 18 43.792 34.311 27.070 111 H TRP 19 H TRP 19 47.771 36.658 30.561 112 HA TRP 19 HA TRP 19 46.720 36.270 33.187 113 HB2 TRP 19 HB2 TRP 19 49.574 36.460 32.188 114 HB3 TRP 19 HB3 TRP 19 49.111 35.967 33.810 115 HD1 TRP 19 HD1 TRP 19 46.576 34.390 31.785 116 HE1 TRP 19 HE1 TRP 19 47.082 31.946 31.312 117 HE3 TRP 19 HE3 TRP 19 51.569 34.397 32.891 118 HZ2 TRP 19 HZ2 TRP 19 49.402 30.219 31.252 119 HZ3 TRP 19 HZ3 TRP 19 52.913 32.328 32.586 120 HH2 TRP 19 HH2 TRP 19 51.844 30.241 31.767 121 H GLN 20 H GLN 20 48.649 39.084 31.931 122 HA GLN 20 HA GLN 20 48.553 40.374 34.508 123 HB2 GLN 20 HB2 GLN 20 49.552 42.237 33.514 124 HB3 GLN 20 HB3 GLN 20 50.197 40.839 32.679 125 HG2 GLN 20 HG2 GLN 20 48.221 41.378 30.967 126 HG3 GLN 20 HG3 GLN 20 48.315 42.975 31.692 127 HE21 GLN 20 HE21 GLN 20 48.730 43.285 29.250 128 HE22 GLN 20 HE22 GLN 20 50.398 43.145 28.688 129 H ALA 21 H ALA 21 46.267 40.385 31.707 130 HA ALA 21 HA ALA 21 44.491 42.313 32.882 131 HB1 ALA 21 HB1 ALA 21 43.938 40.068 30.902 132 HB2 ALA 21 HB2 ALA 21 42.878 41.450 31.250 133 HB3 ALA 21 HB3 ALA 21 44.457 41.720 30.507 134 H LEU 22 H LEU 22 44.805 38.796 33.478 135 HA LEU 22 HA LEU 22 42.372 38.702 35.128 136 HB2 LEU 22 HB2 LEU 22 44.637 36.742 34.636 137 HB3 LEU 22 HB3 LEU 22 43.268 36.406 35.696 138 HG LEU 22 HG LEU 22 43.077 36.923 32.700 139 HD11 LEU 22 HD11 LEU 22 42.525 34.578 32.565 140 HD12 LEU 22 HD12 LEU 22 42.625 34.399 34.344 141 HD13 LEU 22 HD13 LEU 22 44.086 34.744 33.369 142 HD21 LEU 22 HD21 LEU 22 40.916 36.174 34.696 143 HD22 LEU 22 HD22 LEU 22 40.759 36.194 32.918 144 HD23 LEU 22 HD23 LEU 22 41.033 37.699 33.780 145 H PHE 23 H PHE 23 45.853 38.979 35.824 146 HA PHE 23 HA PHE 23 45.356 38.888 38.704 147 HB2 PHE 23 HB2 PHE 23 47.262 37.779 37.615 148 HB3 PHE 23 HB3 PHE 23 47.874 39.333 37.100 149 HD1 PHE 23 HD1 PHE 23 50.019 39.212 38.145 150 HD2 PHE 23 HD2 PHE 23 46.501 38.461 40.528 151 HE1 PHE 23 HE1 PHE 23 51.401 39.233 40.202 152 HE2 PHE 23 HE2 PHE 23 47.893 38.479 42.576 153 HZ PHE 23 HZ PHE 23 50.346 38.858 42.417 154 H ALA 24 H ALA 24 44.504 41.214 36.777 155 HA ALA 24 HA ALA 24 44.036 43.395 36.956 156 HB1 ALA 24 HB1 ALA 24 43.249 44.106 39.117 157 HB2 ALA 24 HB2 ALA 24 42.927 42.370 38.948 158 HB3 ALA 24 HB3 ALA 24 44.282 42.918 39.945 159 H LEU 25 H LEU 25 46.795 43.040 36.415 160 HA LEU 25 HA LEU 25 47.806 45.622 37.435 161 HB2 LEU 25 HB2 LEU 25 49.888 44.826 38.086 162 HB3 LEU 25 HB3 LEU 25 48.756 43.677 38.763 163 HG LEU 25 HG LEU 25 50.498 43.269 36.280 164 HD11 LEU 25 HD11 LEU 25 51.709 43.086 38.458 165 HD12 LEU 25 HD12 LEU 25 51.594 41.540 37.588 166 HD13 LEU 25 HD13 LEU 25 50.533 41.865 38.982 167 HD21 LEU 25 HD21 LEU 25 48.537 41.407 37.625 168 HD22 LEU 25 HD22 LEU 25 49.731 40.901 36.405 169 HD23 LEU 25 HD23 LEU 25 48.452 42.029 35.966 170 HA PRO 26 HA PRO 26 48.849 46.413 33.255 171 HB2 PRO 26 HB2 PRO 26 51.393 47.739 34.165 172 HB3 PRO 26 HB3 PRO 26 50.088 48.387 33.116 173 HG2 PRO 26 HG2 PRO 26 50.267 49.138 35.699 174 HG3 PRO 26 HG3 PRO 26 48.660 48.722 35.014 175 HD2 PRO 26 HD2 PRO 26 50.535 46.985 36.651 176 HD3 PRO 26 HD3 PRO 26 48.793 47.288 36.884 177 H ALA 27 H ALA 27 51.474 44.757 34.980 178 HA ALA 27 HA ALA 27 52.162 43.286 32.531 179 HB1 ALA 27 HB1 ALA 27 54.253 44.979 33.964 180 HB2 ALA 27 HB2 ALA 27 54.561 43.836 32.641 181 HB3 ALA 27 HB3 ALA 27 53.595 45.290 32.343 182 H VAL 28 H VAL 28 52.856 41.242 32.931 183 HA VAL 28 HA VAL 28 53.315 40.371 35.738 184 HB VAL 28 HB VAL 28 53.263 38.046 34.757 185 HG11 VAL 28 HG11 VAL 28 51.419 38.938 36.025 186 HG12 VAL 28 HG12 VAL 28 50.778 39.763 34.595 187 HG13 VAL 28 HG13 VAL 28 50.799 37.988 34.668 188 HG21 VAL 28 HG21 VAL 28 53.618 38.624 32.363 189 HG22 VAL 28 HG22 VAL 28 52.151 37.669 32.639 190 HG23 VAL 28 HG23 VAL 28 52.021 39.407 32.328 191 H GLY 29 H GLY 29 54.999 39.129 36.384 192 HA2 GLY 29 HA2 GLY 29 57.281 38.380 34.826 193 HA3 GLY 29 HA3 GLY 29 57.605 39.896 35.662 194 H ARG 30 H ARG 30 56.865 39.808 38.051 195 HA ARG 30 HA ARG 30 57.713 39.468 40.058 196 HB2 ARG 30 HB2 ARG 30 55.745 37.852 39.916 197 HB3 ARG 30 HB3 ARG 30 56.932 36.552 39.903 198 HG2 ARG 30 HG2 ARG 30 56.909 38.729 42.047 199 HG3 ARG 30 HG3 ARG 30 55.853 37.328 42.154 200 HD2 ARG 30 HD2 ARG 30 57.663 35.800 42.319 201 HD3 ARG 30 HD3 ARG 30 58.871 37.036 41.950 202 HE ARG 30 HE ARG 30 57.596 38.007 44.215 203 HH11 ARG 30 HH11 ARG 30 59.483 35.058 43.497 204 HH12 ARG 30 HH12 ARG 30 59.869 34.902 45.209 205 HH21 ARG 30 HH21 ARG 30 58.340 37.627 46.351 206 HH22 ARG 30 HH22 ARG 30 59.340 36.203 46.620 207 H HIS 31 H HIS 31 58.929 36.745 38.165 208 HA HIS 31 HA HIS 31 61.658 37.558 38.819 209 HB2 HIS 31 HB2 HIS 31 61.289 35.797 40.442 210 HB3 HIS 31 HB3 HIS 31 60.686 34.695 39.206 211 HD1 HIS 31 HD1 HIS 31 62.522 33.016 38.471 212 HD2 HIS 31 HD2 HIS 31 64.005 36.674 39.929 213 HE1 HIS 31 HE1 HIS 31 65.068 32.820 38.450 214 H GLN 32 H GLN 32 60.546 34.625 37.144 215 HA GLN 32 HA GLN 32 59.878 35.958 34.710 216 HB2 GLN 32 HB2 GLN 32 62.592 35.727 34.906 217 HB3 GLN 32 HB3 GLN 32 62.217 34.164 34.178 218 HG2 GLN 32 HG2 GLN 32 60.828 35.529 32.451 219 HG3 GLN 32 HG3 GLN 32 61.600 36.958 33.126 220 HE21 GLN 32 HE21 GLN 32 61.896 36.367 30.447 221 HE22 GLN 32 HE22 GLN 32 63.531 35.846 30.124 222 H ASP 33 H ASP 33 60.521 32.945 36.424 223 HA ASP 33 HA ASP 33 59.299 31.222 34.443 224 HB2 ASP 33 HB2 ASP 33 59.736 29.472 36.216 225 HB3 ASP 33 HB3 ASP 33 61.131 30.288 35.529 226 H PHE 34 H PHE 34 57.401 30.137 34.514 227 HA PHE 34 HA PHE 34 55.101 31.397 35.349 228 HB2 PHE 34 HB2 PHE 34 55.024 29.749 33.640 229 HB3 PHE 34 HB3 PHE 34 55.719 28.495 34.646 230 HD1 PHE 34 HD1 PHE 34 54.296 26.927 35.728 231 HD2 PHE 34 HD2 PHE 34 52.657 30.688 34.408 232 HE1 PHE 34 HE1 PHE 34 52.015 26.119 36.257 233 HE2 PHE 34 HE2 PHE 34 50.372 29.874 34.928 234 HZ PHE 34 HZ PHE 34 50.047 27.584 35.852 235 H PHE 35 H PHE 35 56.865 29.024 37.286 236 HA PHE 35 HA PHE 35 55.010 28.444 39.318 237 HB2 PHE 35 HB2 PHE 35 58.001 28.898 39.475 238 HB3 PHE 35 HB3 PHE 35 57.065 27.969 40.631 239 HD1 PHE 35 HD1 PHE 35 59.156 27.746 37.788 240 HD2 PHE 35 HD2 PHE 35 55.673 25.930 39.577 241 HE1 PHE 35 HE1 PHE 35 59.588 25.659 36.516 242 HE2 PHE 35 HE2 PHE 35 56.110 23.850 38.301 243 HZ PHE 35 HZ PHE 35 58.073 23.704 36.778 244 H ALA 36 H ALA 36 56.983 31.328 38.873 245 HA ALA 36 HA ALA 36 55.956 32.541 41.410 246 HB1 ALA 36 HB1 ALA 36 57.944 33.983 41.194 247 HB2 ALA 36 HB2 ALA 36 58.389 32.268 41.272 248 HB3 ALA 36 HB3 ALA 36 58.418 33.129 39.713 249 H LEU 37 H LEU 37 56.387 33.055 37.920 250 HA LEU 37 HA LEU 37 55.593 35.754 37.768 251 HB2 LEU 37 HB2 LEU 37 56.892 34.516 36.120 252 HB3 LEU 37 HB3 LEU 37 55.504 33.536 35.686 253 HG LEU 37 HG LEU 37 55.223 36.533 35.457 254 HD11 LEU 37 HD11 LEU 37 56.725 34.830 33.429 255 HD12 LEU 37 HD12 LEU 37 57.453 36.054 34.475 256 HD13 LEU 37 HD13 LEU 37 56.280 36.551 33.256 257 HD21 LEU 37 HD21 LEU 37 53.304 35.091 34.823 258 HD22 LEU 37 HD22 LEU 37 54.341 34.197 33.692 259 HD23 LEU 37 HD23 LEU 37 53.965 35.908 33.406 260 H GLY 38 H GLY 38 53.603 32.870 38.023 261 HA2 GLY 38 HA2 GLY 38 51.098 34.068 37.186 262 HA3 GLY 38 HA3 GLY 38 51.317 32.597 38.144 263 H GLY 39 H GLY 39 53.017 34.867 39.848 264 HA2 GLY 39 HA2 GLY 39 52.567 36.340 41.599 265 HA3 GLY 39 HA3 GLY 39 50.838 36.258 41.233 266 H ASP 40 H ASP 40 50.395 33.540 41.362 267 HA ASP 40 HA ASP 40 51.452 32.350 43.836 268 HB2 ASP 40 HB2 ASP 40 49.315 33.778 44.328 269 HB3 ASP 40 HB3 ASP 40 48.439 32.551 43.410 270 H SER 41 H SER 41 50.939 29.934 43.840 271 HA SER 41 HA SER 41 50.837 28.753 41.176 272 HB2 SER 41 HB2 SER 41 50.621 26.624 42.411 273 HB3 SER 41 HB3 SER 41 51.953 27.620 43.029 274 HG SER 41 HG SER 41 50.783 26.817 44.746 275 H GLN 42 H GLN 42 48.370 29.343 43.663 276 HA GLN 42 HA GLN 42 46.177 27.999 42.383 277 HB2 GLN 42 HB2 GLN 42 46.286 30.456 44.173 278 HB3 GLN 42 HB3 GLN 42 44.808 29.537 43.829 279 HG2 GLN 42 HG2 GLN 42 45.699 27.629 45.067 280 HG3 GLN 42 HG3 GLN 42 47.281 28.426 45.177 281 HE21 GLN 42 HE21 GLN 42 47.464 30.449 46.387 282 HE22 GLN 42 HE22 GLN 42 46.415 30.670 47.791 283 H LEU 43 H LEU 43 47.535 31.263 42.024 284 HA LEU 43 HA LEU 43 45.500 32.188 40.145 285 HB2 LEU 43 HB2 LEU 43 48.173 33.261 41.079 286 HB3 LEU 43 HB3 LEU 43 47.246 34.044 39.804 287 HG LEU 43 HG LEU 43 46.165 33.577 42.612 288 HD11 LEU 43 HD11 LEU 43 47.423 36.017 41.305 289 HD12 LEU 43 HD12 LEU 43 48.075 35.105 42.675 290 HD13 LEU 43 HD13 LEU 43 46.579 36.033 42.872 291 HD21 LEU 43 HD21 LEU 43 44.359 33.853 40.975 292 HD22 LEU 43 HD22 LEU 43 45.178 35.265 40.264 293 HD23 LEU 43 HD23 LEU 43 44.519 35.336 41.910 294 H GLY 44 H GLY 44 48.857 30.891 39.815 295 HA2 GLY 44 HA2 GLY 44 49.076 31.005 37.002 296 HA3 GLY 44 HA3 GLY 44 49.778 29.747 38.038 297 H LEU 45 H LEU 45 47.677 28.343 39.001 298 HA LEU 45 HA LEU 45 46.677 26.810 36.819 299 HB2 LEU 45 HB2 LEU 45 46.186 26.918 39.776 300 HB3 LEU 45 HB3 LEU 45 44.935 26.175 38.794 301 HG LEU 45 HG LEU 45 46.557 24.619 37.788 302 HD11 LEU 45 HD11 LEU 45 48.665 25.882 38.023 303 HD12 LEU 45 HD12 LEU 45 48.774 24.310 38.817 304 HD13 LEU 45 HD13 LEU 45 48.540 25.770 39.795 305 HD21 LEU 45 HD21 LEU 45 45.260 23.982 39.781 306 HD22 LEU 45 HD22 LEU 45 46.541 24.636 40.827 307 HD23 LEU 45 HD23 LEU 45 46.860 23.226 39.795 308 H ARG 46 H ARG 46 44.858 29.297 38.747 309 HA ARG 46 HA ARG 46 42.447 29.189 37.203 310 HB2 ARG 46 HB2 ARG 46 42.372 30.393 39.247 311 HB3 ARG 46 HB3 ARG 46 43.773 31.386 38.831 312 HG2 ARG 46 HG2 ARG 46 42.537 32.641 37.184 313 HG3 ARG 46 HG3 ARG 46 41.143 31.554 37.309 314 HD2 ARG 46 HD2 ARG 46 40.673 32.350 39.543 315 HD3 ARG 46 HD3 ARG 46 42.178 33.274 39.599 316 HE ARG 46 HE ARG 46 41.183 34.977 38.362 317 HH11 ARG 46 HH11 ARG 46 38.985 32.234 38.198 318 HH12 ARG 46 HH12 ARG 46 37.771 33.173 37.373 319 HH21 ARG 46 HH21 ARG 46 39.653 36.086 37.404 320 HH22 ARG 46 HH22 ARG 46 38.123 35.346 36.944 321 H MET 47 H MET 47 45.367 31.151 36.625 322 HA MET 47 HA MET 47 44.130 32.556 34.427 323 HB2 MET 47 HB2 MET 47 47.012 32.417 35.381 324 HB3 MET 47 HB3 MET 47 46.426 33.450 34.072 325 HG2 MET 47 HG2 MET 47 44.746 34.445 35.632 326 HG3 MET 47 HG3 MET 47 45.523 33.614 36.958 327 HE1 MET 47 HE1 MET 47 49.071 35.339 37.028 328 HE2 MET 47 HE2 MET 47 48.074 34.005 37.643 329 HE3 MET 47 HE3 MET 47 48.734 33.935 35.991 330 H LEU 48 H LEU 48 46.206 29.635 34.555 331 HA LEU 48 HA LEU 48 46.234 29.307 31.690 332 HB2 LEU 48 HB2 LEU 48 47.665 28.026 33.237 333 HB3 LEU 48 HB3 LEU 48 46.264 27.197 33.886 334 HG LEU 48 HG LEU 48 47.673 25.934 32.243 335 HD11 LEU 48 HD11 LEU 48 45.992 24.761 31.097 336 HD12 LEU 48 HD12 LEU 48 44.854 26.103 31.152 337 HD13 LEU 48 HD13 LEU 48 45.300 25.249 32.643 338 HD21 LEU 48 HD21 LEU 48 48.081 27.814 30.651 339 HD22 LEU 48 HD22 LEU 48 46.386 27.684 30.108 340 HD23 LEU 48 HD23 LEU 48 47.491 26.344 29.860 341 H ALA 49 H ALA 49 43.866 28.212 34.223 342 HA ALA 49 HA ALA 49 42.231 26.828 32.464 343 HB1 ALA 49 HB1 ALA 49 42.086 26.750 34.943 344 HB2 ALA 49 HB2 ALA 49 41.321 28.351 34.947 345 HB3 ALA 49 HB3 ALA 49 40.502 26.978 34.183 346 H GLN 50 H GLN 50 41.884 30.333 33.336 347 HA GLN 50 HA GLN 50 39.752 30.733 31.392 348 HB2 GLN 50 HB2 GLN 50 41.454 32.662 32.978 349 HB3 GLN 50 HB3 GLN 50 40.314 33.191 31.727 350 HG2 GLN 50 HG2 GLN 50 38.651 31.593 33.081 351 HG3 GLN 50 HG3 GLN 50 39.761 31.913 34.402 352 HE21 GLN 50 HE21 GLN 50 37.524 32.787 35.223 353 HE22 GLN 50 HE22 GLN 50 37.218 34.470 34.902 354 H LEU 51 H LEU 51 43.340 31.194 31.123 355 HA LEU 51 HA LEU 51 43.354 32.263 28.481 356 HB2 LEU 51 HB2 LEU 51 45.380 32.108 29.753 357 HB3 LEU 51 HB3 LEU 51 45.154 30.385 30.022 358 HG LEU 51 HG LEU 51 45.605 29.918 27.628 359 HD11 LEU 51 HD11 LEU 51 46.701 31.665 26.275 360 HD12 LEU 51 HD12 LEU 51 46.377 32.866 27.545 361 HD13 LEU 51 HD13 LEU 51 45.032 32.118 26.655 362 HD21 LEU 51 HD21 LEU 51 47.984 30.166 27.846 363 HD22 LEU 51 HD22 LEU 51 47.332 29.837 29.445 364 HD23 LEU 51 HD23 LEU 51 47.807 31.496 29.016 365 H ARG 52 H ARG 52 43.172 28.825 29.527 366 HA ARG 52 HA ARG 52 42.954 27.727 26.914 367 HB2 ARG 52 HB2 ARG 52 43.567 26.509 28.992 368 HB3 ARG 52 HB3 ARG 52 41.900 26.632 29.543 369 HG2 ARG 52 HG2 ARG 52 41.108 25.232 27.715 370 HG3 ARG 52 HG3 ARG 52 42.678 25.320 26.899 371 HD2 ARG 52 HD2 ARG 52 42.367 23.153 28.050 372 HD3 ARG 52 HD3 ARG 52 43.756 24.081 28.649 373 HE ARG 52 HE ARG 52 41.283 24.475 30.191 374 HH11 ARG 52 HH11 ARG 52 44.211 22.493 30.080 375 HH12 ARG 52 HH12 ARG 52 44.156 22.298 31.832 376 HH21 ARG 52 HH21 ARG 52 41.320 24.160 32.241 377 HH22 ARG 52 HH22 ARG 52 42.654 23.339 33.041 378 H GLU 53 H GLU 53 40.348 28.632 29.217 379 HA GLU 53 HA GLU 53 38.193 27.920 27.470 380 HB2 GLU 53 HB2 GLU 53 38.373 29.863 29.810 381 HB3 GLU 53 HB3 GLU 53 36.898 29.613 28.883 382 HG2 GLU 53 HG2 GLU 53 37.141 27.119 29.339 383 HG3 GLU 53 HG3 GLU 53 38.360 27.544 30.537 384 H ARG 54 H ARG 54 40.053 30.968 27.576 385 HA ARG 54 HA ARG 54 38.197 32.259 25.655 386 HB2 ARG 54 HB2 ARG 54 40.808 33.140 26.961 387 HB3 ARG 54 HB3 ARG 54 39.892 34.136 25.841 388 HG2 ARG 54 HG2 ARG 54 38.849 33.155 28.534 389 HG3 ARG 54 HG3 ARG 54 39.509 34.749 28.170 390 HD2 ARG 54 HD2 ARG 54 37.663 34.938 26.372 391 HD3 ARG 54 HD3 ARG 54 36.937 33.511 27.139 392 HE ARG 54 HE ARG 54 37.603 35.765 28.939 393 HH11 ARG 54 HH11 ARG 54 34.934 34.130 27.257 394 HH12 ARG 54 HH12 ARG 54 33.791 35.204 28.034 395 HH21 ARG 54 HH21 ARG 54 36.011 37.141 29.635 396 HH22 ARG 54 HH22 ARG 54 34.360 36.555 29.604 397 H HIS 55 H HIS 55 41.327 30.690 25.480 398 HA HIS 55 HA HIS 55 41.721 31.795 22.731 399 HB2 HIS 55 HB2 HIS 55 42.983 32.613 24.849 400 HB3 HIS 55 HB3 HIS 55 43.826 31.068 24.779 401 HD1 HIS 55 HD1 HIS 55 43.167 33.794 22.027 402 HD2 HIS 55 HD2 HIS 55 46.173 31.540 23.931 403 HE1 HIS 55 HE1 HIS 55 45.369 34.481 20.962 404 H GLY 56 H GLY 56 41.492 28.718 24.351 405 HA2 GLY 56 HA2 GLY 56 41.869 26.575 23.573 406 HA3 GLY 56 HA3 GLY 56 42.183 27.236 21.966 407 H VAL 57 H VAL 57 43.837 27.551 25.145 408 HA VAL 57 HA VAL 57 46.357 26.411 24.042 409 HB VAL 57 HB VAL 57 45.997 29.160 25.279 410 HG11 VAL 57 HG11 VAL 57 48.458 29.360 25.397 411 HG12 VAL 57 HG12 VAL 57 47.859 28.147 26.530 412 HG13 VAL 57 HG13 VAL 57 48.609 27.636 25.009 413 HG21 VAL 57 HG21 VAL 57 45.910 29.071 22.831 414 HG22 VAL 57 HG22 VAL 57 47.450 29.794 23.320 415 HG23 VAL 57 HG23 VAL 57 47.405 28.112 22.781 416 H ASP 58 H ASP 58 47.193 24.955 25.345 417 HA ASP 58 HA ASP 58 46.474 24.928 28.243 418 HB2 ASP 58 HB2 ASP 58 45.699 23.079 26.498 419 HB3 ASP 58 HB3 ASP 58 47.328 22.459 26.756 420 H LEU 59 H LEU 59 48.080 23.757 29.606 421 HA LEU 59 HA LEU 59 50.908 24.385 28.865 422 HB2 LEU 59 HB2 LEU 59 49.791 26.140 30.253 423 HB3 LEU 59 HB3 LEU 59 49.669 24.975 31.573 424 HG LEU 59 HG LEU 59 52.231 25.909 30.225 425 HD11 LEU 59 HD11 LEU 59 51.085 27.734 31.429 426 HD12 LEU 59 HD12 LEU 59 52.577 27.271 32.260 427 HD13 LEU 59 HD13 LEU 59 51.011 26.728 32.893 428 HD21 LEU 59 HD21 LEU 59 51.825 24.283 32.768 429 HD22 LEU 59 HD22 LEU 59 53.353 25.042 32.286 430 HD23 LEU 59 HD23 LEU 59 52.674 23.771 31.284 431 HA PRO 60 HA PRO 60 51.004 20.149 30.576 432 HB2 PRO 60 HB2 PRO 60 52.324 18.869 28.617 433 HB3 PRO 60 HB3 PRO 60 50.593 19.278 28.474 434 HG2 PRO 60 HG2 PRO 60 52.946 20.855 27.361 435 HG3 PRO 60 HG3 PRO 60 51.475 20.309 26.491 436 HD2 PRO 60 HD2 PRO 60 51.678 22.820 27.565 437 HD3 PRO 60 HD3 PRO 60 50.135 21.929 27.547 438 H LEU 61 H LEU 61 52.706 18.990 31.477 439 HA LEU 61 HA LEU 61 54.808 20.589 32.533 440 HB2 LEU 61 HB2 LEU 61 54.419 17.575 32.621 441 HB3 LEU 61 HB3 LEU 61 55.538 18.493 33.626 442 HG LEU 61 HG LEU 61 52.499 18.745 33.684 443 HD11 LEU 61 HD11 LEU 61 54.462 17.570 35.698 444 HD12 LEU 61 HD12 LEU 61 53.332 16.653 34.673 445 HD13 LEU 61 HD13 LEU 61 52.706 17.740 35.916 446 HD21 LEU 61 HD21 LEU 61 53.488 20.905 34.281 447 HD22 LEU 61 HD22 LEU 61 54.617 20.100 35.407 448 HD23 LEU 61 HD23 LEU 61 52.869 20.111 35.723 449 H ARG 62 H ARG 62 54.807 18.545 29.684 450 HA ARG 62 HA ARG 62 57.634 18.419 29.242 451 HB2 ARG 62 HB2 ARG 62 57.060 17.986 26.880 452 HB3 ARG 62 HB3 ARG 62 56.108 17.028 27.978 453 HG2 ARG 62 HG2 ARG 62 54.132 18.258 27.526 454 HG3 ARG 62 HG3 ARG 62 55.012 19.595 26.764 455 HD2 ARG 62 HD2 ARG 62 55.753 18.081 24.950 456 HD3 ARG 62 HD3 ARG 62 54.861 16.778 25.703 457 HE ARG 62 HE ARG 62 52.864 17.690 24.798 458 HH11 ARG 62 HH11 ARG 62 55.439 20.070 24.394 459 HH12 ARG 62 HH12 ARG 62 54.448 21.068 23.361 460 HH21 ARG 62 HH21 ARG 62 51.591 19.189 23.736 461 HH22 ARG 62 HH22 ARG 62 52.375 20.536 22.924 462 H CYS 63 H CYS 63 55.302 20.976 28.356 463 HA CYS 63 HA CYS 63 57.379 22.567 27.090 464 HB2 CYS 63 HB2 CYS 63 55.792 24.067 26.462 465 HB3 CYS 63 HB3 CYS 63 54.924 22.538 26.416 466 HG CYS 63 HG CYS 63 53.847 22.878 28.890 467 H LEU 64 H LEU 64 55.675 22.565 30.228 468 HA LEU 64 HA LEU 64 56.999 24.802 31.394 469 HB2 LEU 64 HB2 LEU 64 55.062 23.374 32.242 470 HB3 LEU 64 HB3 LEU 64 56.246 22.204 32.776 471 HG LEU 64 HG LEU 64 57.285 23.816 34.301 472 HD11 LEU 64 HD11 LEU 64 56.271 25.948 34.848 473 HD12 LEU 64 HD12 LEU 64 55.034 25.744 33.589 474 HD13 LEU 64 HD13 LEU 64 56.737 25.970 33.153 475 HD21 LEU 64 HD21 LEU 64 54.263 23.552 34.595 476 HD22 LEU 64 HD22 LEU 64 55.383 23.981 35.899 477 HD23 LEU 64 HD23 LEU 64 55.503 22.392 35.136 478 H TYR 65 H TYR 65 58.079 21.372 31.183 479 HA TYR 65 HA TYR 65 60.495 21.748 32.650 480 HB2 TYR 65 HB2 TYR 65 59.625 19.548 32.398 481 HB3 TYR 65 HB3 TYR 65 59.675 19.657 30.639 482 HD1 TYR 65 HD1 TYR 65 61.135 17.954 29.970 483 HD2 TYR 65 HD2 TYR 65 62.364 20.615 33.142 484 HE1 TYR 65 HE1 TYR 65 63.399 16.935 29.954 485 HE2 TYR 65 HE2 TYR 65 64.645 19.630 33.072 486 HH TYR 65 HH TYR 65 65.392 16.801 31.037 487 H GLU 66 H GLU 66 59.842 21.882 29.081 488 HA GLU 66 HA GLU 66 62.703 22.350 28.581 489 HB2 GLU 66 HB2 GLU 66 62.272 22.445 26.329 490 HB3 GLU 66 HB3 GLU 66 61.149 21.243 26.959 491 HG2 GLU 66 HG2 GLU 66 59.363 23.018 26.945 492 HG3 GLU 66 HG3 GLU 66 60.490 24.097 26.118 493 H ALA 67 H ALA 67 59.963 24.445 29.092 494 HA ALA 67 HA ALA 67 61.658 26.875 29.065 495 HB1 ALA 67 HB1 ALA 67 59.181 26.321 27.379 496 HB2 ALA 67 HB2 ALA 67 59.861 27.927 27.662 497 HB3 ALA 67 HB3 ALA 67 60.821 26.700 26.799 498 HA PRO 68 HA PRO 68 58.608 26.869 32.569 499 HB2 PRO 68 HB2 PRO 68 60.227 27.835 34.536 500 HB3 PRO 68 HB3 PRO 68 60.229 26.117 34.047 501 HG2 PRO 68 HG2 PRO 68 62.112 28.326 33.143 502 HG3 PRO 68 HG3 PRO 68 62.546 26.693 33.742 503 HD2 PRO 68 HD2 PRO 68 62.382 27.309 31.078 504 HD3 PRO 68 HD3 PRO 68 61.935 25.691 31.689 505 H THR 69 H THR 69 60.624 29.200 31.027 506 HA THR 69 HA THR 69 59.564 31.609 32.212 507 HB THR 69 HB THR 69 60.915 31.709 29.560 508 HG1 THR 69 HG1 THR 69 62.407 30.934 31.843 509 HG21 THR 69 HG21 THR 69 60.548 33.699 31.001 510 HG22 THR 69 HG22 THR 69 62.269 33.374 30.685 511 HG23 THR 69 HG23 THR 69 61.556 32.939 32.262 512 H VAL 70 H VAL 70 57.939 32.916 31.479 513 HA VAL 70 HA VAL 70 55.881 31.625 30.150 514 HB VAL 70 HB VAL 70 55.595 33.427 31.754 515 HG11 VAL 70 HG11 VAL 70 57.260 35.073 30.896 516 HG12 VAL 70 HG12 VAL 70 56.210 35.389 29.497 517 HG13 VAL 70 HG13 VAL 70 55.657 35.779 31.126 518 HG21 VAL 70 HG21 VAL 70 54.114 34.061 29.175 519 HG22 VAL 70 HG22 VAL 70 53.733 32.704 30.246 520 HG23 VAL 70 HG23 VAL 70 53.580 34.367 30.840 521 H ALA 71 H ALA 71 58.138 33.915 28.516 522 HA ALA 71 HA ALA 71 56.417 33.911 26.143 523 HB1 ALA 71 HB1 ALA 71 58.022 35.440 25.205 524 HB2 ALA 71 HB2 ALA 71 57.642 35.927 26.861 525 HB3 ALA 71 HB3 ALA 71 59.176 35.113 26.502 526 H ARG 72 H ARG 72 59.543 32.385 27.046 527 HA ARG 72 HA ARG 72 59.965 30.846 24.654 528 HB2 ARG 72 HB2 ARG 72 60.585 30.290 27.590 529 HB3 ARG 72 HB3 ARG 72 61.119 29.238 26.277 530 HG2 ARG 72 HG2 ARG 72 62.554 30.893 25.347 531 HG3 ARG 72 HG3 ARG 72 61.867 32.168 26.352 532 HD2 ARG 72 HD2 ARG 72 64.049 31.512 27.209 533 HD3 ARG 72 HD3 ARG 72 62.778 31.154 28.373 534 HE ARG 72 HE ARG 72 63.693 28.947 26.585 535 HH11 ARG 72 HH11 ARG 72 63.624 30.145 29.932 536 HH12 ARG 72 HH12 ARG 72 64.514 28.734 30.471 537 HH21 ARG 72 HH21 ARG 72 64.739 27.150 27.551 538 HH22 ARG 72 HH22 ARG 72 64.930 27.155 29.290 539 H LEU 73 H LEU 73 57.970 30.121 27.515 540 HA LEU 73 HA LEU 73 56.965 27.587 26.711 541 HB2 LEU 73 HB2 LEU 73 56.897 28.611 28.955 542 HB3 LEU 73 HB3 LEU 73 55.655 29.726 28.444 543 HG LEU 73 HG LEU 73 55.187 26.783 28.084 544 HD11 LEU 73 HD11 LEU 73 54.338 26.579 30.364 545 HD12 LEU 73 HD12 LEU 73 54.792 28.266 30.718 546 HD13 LEU 73 HD13 LEU 73 56.033 27.033 30.402 547 HD21 LEU 73 HD21 LEU 73 53.469 28.383 27.235 548 HD22 LEU 73 HD22 LEU 73 53.356 29.112 28.844 549 HD23 LEU 73 HD23 LEU 73 52.842 27.431 28.575 550 H ALA 74 H ALA 74 55.578 30.879 26.262 551 HA ALA 74 HA ALA 74 53.356 30.084 24.711 552 HB1 ALA 74 HB1 ALA 74 53.275 32.458 24.056 553 HB2 ALA 74 HB2 ALA 74 53.632 32.290 25.791 554 HB3 ALA 74 HB3 ALA 74 54.926 32.704 24.648 555 H GLU 75 H GLU 75 56.742 30.730 23.663 556 HA GLU 75 HA GLU 75 56.173 30.401 20.850 557 HB2 GLU 75 HB2 GLU 75 58.770 29.909 22.365 558 HB3 GLU 75 HB3 GLU 75 58.586 29.817 20.617 559 HG2 GLU 75 HG2 GLU 75 58.232 32.261 22.354 560 HG3 GLU 75 HG3 GLU 75 59.529 31.945 21.220 561 H THR 76 H THR 76 57.426 27.888 23.216 562 HA THR 76 HA THR 76 57.254 25.869 21.178 563 HB THR 76 HB THR 76 58.552 25.333 23.103 564 HG1 THR 76 HG1 THR 76 57.757 23.343 23.628 565 HG21 THR 76 HG21 THR 76 57.458 26.538 24.876 566 HG22 THR 76 HG22 THR 76 57.627 24.843 25.311 567 HG23 THR 76 HG23 THR 76 56.045 25.472 24.785 568 H ILE 77 H ILE 77 54.656 26.941 23.437 569 HA ILE 77 HA ILE 77 52.853 24.886 22.443 570 HB ILE 77 HB ILE 77 52.393 27.313 24.188 571 HG12 ILE 77 HG12 ILE 77 53.757 25.469 25.177 572 HG13 ILE 77 HG13 ILE 77 52.241 25.739 26.009 573 HG21 ILE 77 HG21 ILE 77 50.255 26.947 23.180 574 HG22 ILE 77 HG22 ILE 77 50.411 25.180 23.295 575 HG23 ILE 77 HG23 ILE 77 50.203 26.145 24.760 576 HD11 ILE 77 HD11 ILE 77 51.252 23.736 25.041 577 HD12 ILE 77 HD12 ILE 77 52.666 23.476 23.994 578 HD13 ILE 77 HD13 ILE 77 52.818 23.321 25.735 579 H VAL 78 H VAL 78 53.329 28.308 21.386 580 HA VAL 78 HA VAL 78 51.115 28.041 19.472 581 HB VAL 78 HB VAL 78 53.384 30.037 19.709 582 HG11 VAL 78 HG11 VAL 78 52.124 31.422 18.075 583 HG12 VAL 78 HG12 VAL 78 52.791 29.971 17.340 584 HG13 VAL 78 HG13 VAL 78 51.054 30.045 17.741 585 HG21 VAL 78 HG21 VAL 78 51.519 31.541 20.375 586 HG22 VAL 78 HG22 VAL 78 50.362 30.216 20.159 587 HG23 VAL 78 HG23 VAL 78 51.575 30.138 21.447 588 H ARG 79 H ARG 79 54.599 27.412 19.358 589 HA ARG 79 HA ARG 79 54.640 27.115 16.474 590 HB2 ARG 79 HB2 ARG 79 56.353 28.248 17.939 591 HB3 ARG 79 HB3 ARG 79 56.816 26.666 18.558 592 HG2 ARG 79 HG2 ARG 79 58.398 27.334 16.917 593 HG3 ARG 79 HG3 ARG 79 57.481 25.990 16.258 594 HD2 ARG 79 HD2 ARG 79 56.102 27.577 14.924 595 HD3 ARG 79 HD3 ARG 79 56.864 28.957 15.723 596 HE ARG 79 HE ARG 79 57.848 27.506 13.440 597 HH11 ARG 79 HH11 ARG 79 59.094 29.435 16.149 598 HH12 ARG 79 HH12 ARG 79 60.574 29.722 15.251 599 HH21 ARG 79 HH21 ARG 79 59.645 28.022 12.473 600 HH22 ARG 79 HH22 ARG 79 60.916 28.904 13.329 601 H LEU 80 H LEU 80 54.881 24.745 19.129 602 HA LEU 80 HA LEU 80 54.936 22.566 17.065 603 HB2 LEU 80 HB2 LEU 80 55.802 22.396 19.972 604 HB3 LEU 80 HB3 LEU 80 55.791 21.100 18.794 605 HG LEU 80 HG LEU 80 57.343 22.843 17.413 606 HD11 LEU 80 HD11 LEU 80 57.323 24.560 19.225 607 HD12 LEU 80 HD12 LEU 80 58.943 23.910 18.952 608 HD13 LEU 80 HD13 LEU 80 57.997 23.369 20.351 609 HD21 LEU 80 HD21 LEU 80 57.938 20.527 17.964 610 HD22 LEU 80 HD22 LEU 80 58.299 20.994 19.637 611 HD23 LEU 80 HD23 LEU 80 59.294 21.612 18.298 612 H ALA 81 H ALA 81 52.794 24.133 19.006 613 HA ALA 81 HA ALA 81 50.684 23.866 19.596 614 HB1 ALA 81 HB1 ALA 81 49.238 22.505 18.273 615 HB2 ALA 81 HB2 ALA 81 50.514 23.153 17.237 616 HB3 ALA 81 HB3 ALA 81 50.581 21.461 17.772 617 H ALA 82 H ALA 82 48.966 22.568 20.570 618 HA ALA 82 HA ALA 82 49.686 20.171 22.082 619 HB1 ALA 82 HB1 ALA 82 48.998 22.805 23.467 620 HB2 ALA 82 HB2 ALA 82 49.016 21.216 24.263 621 HB3 ALA 82 HB3 ALA 82 50.508 21.891 23.597 622 HA PRO 83 HA PRO 83 45.440 21.027 20.273 623 HB2 PRO 83 HB2 PRO 83 45.145 18.927 18.542 624 HB3 PRO 83 HB3 PRO 83 46.055 20.409 18.143 625 HG2 PRO 83 HG2 PRO 83 47.170 17.779 19.180 626 HG3 PRO 83 HG3 PRO 83 47.721 18.739 17.765 627 HD2 PRO 83 HD2 PRO 83 48.960 18.980 20.151 628 HD3 PRO 83 HD3 PRO 83 48.648 20.414 19.135 629 H ALA 84 H ALA 84 46.660 17.983 21.680 630 HA ALA 84 HA ALA 84 44.069 17.593 23.043 631 HB1 ALA 84 HB1 ALA 84 43.849 16.322 20.951 632 HB2 ALA 84 HB2 ALA 84 45.352 15.447 21.306 633 HB3 ALA 84 HB3 ALA 84 43.925 15.249 22.352 634 HA PRO 85 HA PRO 85 47.749 16.961 25.782 635 HB2 PRO 85 HB2 PRO 85 46.023 18.512 27.680 636 HB3 PRO 85 HB3 PRO 85 47.771 18.696 27.333 637 HG2 PRO 85 HG2 PRO 85 45.964 20.466 26.347 638 HG3 PRO 85 HG3 PRO 85 47.324 19.893 25.323 639 HD2 PRO 85 HD2 PRO 85 44.460 18.887 25.394 640 HD3 PRO 85 HD3 PRO 85 45.456 19.369 23.992 641 H SER 86 H SER 86 47.801 16.129 28.113 642 HA SER 86 HA SER 86 47.438 14.435 29.562 643 HB2 SER 86 HB2 SER 86 44.650 15.615 29.437 644 HB3 SER 86 HB3 SER 86 45.216 14.519 30.705 645 HG SER 86 HG SER 86 45.348 16.848 31.088 646 H GLY 87 H GLY 87 46.878 13.571 26.639 647 HA2 GLY 87 HA2 GLY 87 45.045 11.251 27.090 648 HA3 GLY 87 HA3 GLY 87 45.488 11.961 25.537 649 H ASP 88 H ASP 88 48.404 12.166 26.214 650 HA ASP 88 HA ASP 88 49.191 9.490 25.652 651 HB2 ASP 88 HB2 ASP 88 50.606 11.388 25.041 652 HB3 ASP 88 HB3 ASP 88 50.921 11.717 26.755 653 H GLN 89 H GLN 89 50.455 8.003 26.956 654 HA GLN 89 HA GLN 89 49.046 7.729 29.578 655 HB2 GLN 89 HB2 GLN 89 49.867 5.640 27.533 656 HB3 GLN 89 HB3 GLN 89 48.947 5.344 29.006 657 HG2 GLN 89 HG2 GLN 89 47.936 7.118 26.757 658 HG3 GLN 89 HG3 GLN 89 47.615 5.413 26.870 659 HE21 GLN 89 HE21 GLN 89 46.572 8.519 27.930 660 HE22 GLN 89 HE22 GLN 89 45.390 7.968 29.102 661 H ASP 90 H ASP 90 50.041 6.709 31.345 662 HA ASP 90 HA ASP 90 52.879 5.876 31.072 663 HB2 ASP 90 HB2 ASP 90 52.674 8.280 31.951 664 HB3 ASP 90 HB3 ASP 90 51.951 7.578 33.404 665 H ASP 91 H ASP 91 53.572 4.246 32.461 666 HA ASP 91 HA ASP 91 51.509 3.058 34.249 667 HB2 ASP 91 HB2 ASP 91 51.603 1.969 31.988 668 HB3 ASP 91 HB3 ASP 91 53.246 1.441 32.384 669 H ALA 92 H ALA 92 54.014 4.689 34.784 670 HA ALA 92 HA ALA 92 55.620 4.742 36.410 671 HB1 ALA 92 HB1 ALA 92 53.404 3.212 37.779 672 HB2 ALA 92 HB2 ALA 92 54.632 4.224 38.574 673 HB3 ALA 92 HB3 ALA 92 53.442 4.953 37.476 674 H SER 93 H SER 93 56.489 2.757 34.696 675 HA SER 93 HA SER 93 56.694 0.167 35.852 676 HB2 SER 93 HB2 SER 93 56.610 0.623 33.441 677 HB3 SER 93 HB3 SER 93 58.181 1.434 33.525 678 HG SER 93 HG SER 93 57.693 -1.303 34.168 679 H GLU 94 H GLU 94 58.789 2.885 36.440 680 HA GLU 94 HA GLU 94 61.157 1.195 36.843 681 HB2 GLU 94 HB2 GLU 94 60.858 4.178 37.217 682 HB3 GLU 94 HB3 GLU 94 62.357 3.247 37.201 683 HG2 GLU 94 HG2 GLU 94 61.552 2.396 34.850 684 HG3 GLU 94 HG3 GLU 94 60.429 3.758 34.900 685 H TYR 95 H TYR 95 59.196 0.328 38.473 686 HA TYR 95 HA TYR 95 59.692 1.188 41.246 687 HB2 TYR 95 HB2 TYR 95 57.439 0.484 40.237 688 HB3 TYR 95 HB3 TYR 95 58.046 -1.162 40.250 689 HD1 TYR 95 HD1 TYR 95 58.359 -2.360 42.423 690 HD2 TYR 95 HD2 TYR 95 56.842 1.677 42.260 691 HE1 TYR 95 HE1 TYR 95 57.614 -2.528 44.799 692 HE2 TYR 95 HE2 TYR 95 56.090 1.491 44.619 693 HH TYR 95 HH TYR 95 56.040 0.198 46.491 694 H GLU 96 H GLU 96 60.666 -0.147 42.845 695 HA GLU 96 HA GLU 96 62.384 -1.348 43.658 696 HB2 GLU 96 HB2 GLU 96 60.563 -3.022 43.367 697 HB3 GLU 96 HB3 GLU 96 61.346 -3.549 41.875 698 HG2 GLU 96 HG2 GLU 96 63.419 -4.092 43.264 699 HG3 GLU 96 HG3 GLU 96 62.521 -3.620 44.702 700 H GLU 97 H GLU 97 63.519 0.348 42.075 701 HA GLU 97 HA GLU 97 65.406 -0.993 40.222 702 HB2 GLU 97 HB2 GLU 97 64.206 1.206 39.762 703 HB3 GLU 97 HB3 GLU 97 65.255 1.936 40.983 704 HG2 GLU 97 HG2 GLU 97 67.245 1.160 39.604 705 HG3 GLU 97 HG3 GLU 97 66.103 0.570 38.390 706 H GLY 98 H GLY 98 65.396 0.146 43.570 707 HA2 GLY 98 HA2 GLY 98 68.224 0.783 43.642 708 HA3 GLY 98 HA3 GLY 98 67.070 0.842 44.969 709 H VAL 99 H VAL 99 67.084 -2.283 43.605 710 HA VAL 99 HA VAL 99 68.504 -3.276 46.009 711 HB VAL 99 HB VAL 99 67.339 -5.407 45.612 712 HG11 VAL 99 HG11 VAL 99 65.485 -2.993 45.785 713 HG12 VAL 99 HG12 VAL 99 65.142 -4.641 46.347 714 HG13 VAL 99 HG13 VAL 99 66.414 -3.693 47.130 715 HG21 VAL 99 HG21 VAL 99 66.932 -5.268 43.174 716 HG22 VAL 99 HG22 VAL 99 65.437 -5.528 44.074 717 HG23 VAL 99 HG23 VAL 99 65.809 -3.916 43.431 718 H ILE 100 H ILE 100 70.016 -4.894 46.062 719 HA ILE 100 HA ILE 100 71.295 -5.787 43.555 720 HB ILE 100 HB ILE 100 72.101 -3.480 44.145 721 HG12 ILE 100 HG12 ILE 100 74.496 -3.863 43.896 722 HG13 ILE 100 HG13 ILE 100 74.296 -5.574 44.235 723 HG21 ILE 100 HG21 ILE 100 73.441 -4.803 46.538 724 HG22 ILE 100 HG22 ILE 100 73.580 -3.113 46.019 725 HG23 ILE 100 HG23 ILE 100 72.036 -3.718 46.622 726 HD11 ILE 100 HD11 ILE 100 72.961 -4.127 41.901 727 HD12 ILE 100 HD12 ILE 100 74.502 -4.997 41.796 728 HD13 ILE 100 HD13 ILE 100 73.015 -5.885 42.171 729 H ARG 101 H ARG 101 72.844 -7.425 43.753 730 HA ARG 101 HA ARG 101 73.020 -8.936 46.337 731 HB2 ARG 101 HB2 ARG 101 72.855 -9.847 43.441 732 HB3 ARG 101 HB3 ARG 101 73.456 -10.900 44.728 733 HG2 ARG 101 HG2 ARG 101 71.376 -10.774 45.941 734 HG3 ARG 101 HG3 ARG 101 70.713 -9.564 44.858 735 HD2 ARG 101 HD2 ARG 101 71.595 -12.274 43.816 736 HD3 ARG 101 HD3 ARG 101 70.010 -12.049 44.569 737 HE ARG 101 HE ARG 101 70.061 -10.008 42.770 738 HH11 ARG 101 HH11 ARG 101 70.914 -13.383 42.114 739 HH12 ARG 101 HH12 ARG 101 69.986 -13.351 40.624 740 HH21 ARG 101 HH21 ARG 101 68.859 -10.174 40.922 741 HH22 ARG 101 HH22 ARG 101 69.086 -11.564 39.874 Start of MODEL 4 1 H GLY 1 H1 GLY 1 51.328 66.685 40.009 2 HA2 GLY 1 HA2 GLY 1 48.901 65.143 40.625 3 HA3 GLY 1 HA3 GLY 1 49.166 66.206 39.233 4 H ALA 2 H ALA 2 48.286 63.731 38.733 5 HA ALA 2 HA ALA 2 50.615 62.424 37.389 6 HB1 ALA 2 HB1 ALA 2 48.274 61.029 38.755 7 HB2 ALA 2 HB2 ALA 2 49.602 60.245 37.876 8 HB3 ALA 2 HB3 ALA 2 49.932 61.120 39.384 9 H ALA 3 H ALA 3 47.100 63.019 37.337 10 HA ALA 3 HA ALA 3 45.525 63.075 35.774 11 HB1 ALA 3 HB1 ALA 3 47.825 64.015 34.042 12 HB2 ALA 3 HB2 ALA 3 46.103 64.241 33.686 13 HB3 ALA 3 HB3 ALA 3 46.809 65.005 35.121 14 H ALA 4 H ALA 4 47.654 60.572 35.404 15 HA ALA 4 HA ALA 4 45.727 59.089 33.776 16 HB1 ALA 4 HB1 ALA 4 47.426 58.224 32.241 17 HB2 ALA 4 HB2 ALA 4 47.418 59.994 32.126 18 HB3 ALA 4 HB3 ALA 4 48.693 59.175 33.042 19 H GLY 5 H GLY 5 46.140 56.763 33.926 20 HA2 GLY 5 HA2 GLY 5 47.216 55.885 36.529 21 HA3 GLY 5 HA3 GLY 5 46.306 54.935 35.363 22 H VAL 6 H VAL 6 48.136 53.537 36.224 23 HA VAL 6 HA VAL 6 50.778 53.919 35.119 24 HB VAL 6 HB VAL 6 50.398 52.951 37.306 25 HG11 VAL 6 HG11 VAL 6 49.395 50.444 35.911 26 HG12 VAL 6 HG12 VAL 6 49.593 50.732 37.659 27 HG13 VAL 6 HG13 VAL 6 48.356 51.599 36.764 28 HG21 VAL 6 HG21 VAL 6 52.043 51.195 37.238 29 HG22 VAL 6 HG22 VAL 6 51.815 50.952 35.501 30 HG23 VAL 6 HG23 VAL 6 52.514 52.474 36.112 31 H SER 7 H SER 7 51.934 52.734 33.613 32 HA SER 7 HA SER 7 50.573 50.765 31.921 33 HB2 SER 7 HB2 SER 7 51.173 52.208 29.833 34 HB3 SER 7 HB3 SER 7 49.703 52.538 30.736 35 HG SER 7 HG SER 7 52.155 53.986 30.943 36 H ALA 8 H ALA 8 51.843 49.712 30.387 37 HA ALA 8 HA ALA 8 54.660 50.590 30.037 38 HB1 ALA 8 HB1 ALA 8 53.793 47.676 30.075 39 HB2 ALA 8 HB2 ALA 8 55.427 48.294 29.783 40 HB3 ALA 8 HB3 ALA 8 54.694 48.481 31.386 41 H ALA 9 H ALA 9 55.470 49.953 27.836 42 HA ALA 9 HA ALA 9 53.316 49.638 25.797 43 HB1 ALA 9 HB1 ALA 9 53.652 52.070 26.294 44 HB2 ALA 9 HB2 ALA 9 55.352 51.887 25.805 45 HB3 ALA 9 HB3 ALA 9 54.053 51.641 24.625 46 H GLY 10 H GLY 10 54.425 49.785 23.521 47 HA2 GLY 10 HA2 GLY 10 56.011 48.866 22.028 48 HA3 GLY 10 HA3 GLY 10 56.806 48.007 23.349 49 H ILE 11 H ILE 11 56.217 46.656 21.066 50 HA ILE 11 HA ILE 11 53.798 45.031 21.634 51 HB ILE 11 HB ILE 11 53.995 45.737 19.359 52 HG12 ILE 11 HG12 ILE 11 53.886 43.591 18.168 53 HG13 ILE 11 HG13 ILE 11 54.591 42.750 19.544 54 HG21 ILE 11 HG21 ILE 11 56.408 46.045 19.109 55 HG22 ILE 11 HG22 ILE 11 56.667 44.292 19.245 56 HG23 ILE 11 HG23 ILE 11 55.792 44.970 17.861 57 HD11 ILE 11 HD11 ILE 11 51.943 44.271 19.593 58 HD12 ILE 11 HD12 ILE 11 52.114 42.521 19.375 59 HD13 ILE 11 HD13 ILE 11 52.585 43.264 20.905 60 H GLU 12 H GLU 12 53.827 42.972 22.320 61 HA GLU 12 HA GLU 12 56.247 41.398 22.426 62 HB2 GLU 12 HB2 GLU 12 56.330 41.039 24.781 63 HB3 GLU 12 HB3 GLU 12 56.435 42.763 24.519 64 HG2 GLU 12 HG2 GLU 12 53.780 41.438 25.149 65 HG3 GLU 12 HG3 GLU 12 54.942 41.774 26.423 66 HA PRO 13 HA PRO 13 53.574 38.119 21.706 67 HB2 PRO 13 HB2 PRO 13 54.615 36.559 24.078 68 HB3 PRO 13 HB3 PRO 13 54.392 36.014 22.383 69 HG2 PRO 13 HG2 PRO 13 56.852 36.725 23.254 70 HG3 PRO 13 HG3 PRO 13 56.290 37.291 21.652 71 HD2 PRO 13 HD2 PRO 13 56.320 38.796 24.276 72 HD3 PRO 13 HD3 PRO 13 56.819 39.346 22.647 73 H ASP 14 H ASP 14 51.494 37.508 21.987 74 HA ASP 14 HA ASP 14 49.971 39.115 23.714 75 HB2 ASP 14 HB2 ASP 14 49.261 36.684 22.052 76 HB3 ASP 14 HB3 ASP 14 48.041 37.537 22.991 77 H LEU 15 H LEU 15 51.055 35.809 24.430 78 HA LEU 15 HA LEU 15 49.184 35.334 26.543 79 HB2 LEU 15 HB2 LEU 15 51.826 34.180 25.751 80 HB3 LEU 15 HB3 LEU 15 51.384 34.024 27.446 81 HG LEU 15 HG LEU 15 49.175 33.039 26.780 82 HD11 LEU 15 HD11 LEU 15 48.956 32.095 24.500 83 HD12 LEU 15 HD12 LEU 15 50.462 32.897 24.010 84 HD13 LEU 15 HD13 LEU 15 49.029 33.854 24.443 85 HD21 LEU 15 HD21 LEU 15 50.077 30.828 26.256 86 HD22 LEU 15 HD22 LEU 15 51.068 31.633 27.482 87 HD23 LEU 15 HD23 LEU 15 51.633 31.548 25.800 88 H THR 16 H THR 16 52.078 37.404 26.539 89 HA THR 16 HA THR 16 52.125 37.909 29.382 90 HB THR 16 HB THR 16 53.217 40.004 28.865 91 HG1 THR 16 HG1 THR 16 52.761 39.472 26.123 92 HG21 THR 16 HG21 THR 16 55.132 39.277 27.556 93 HG22 THR 16 HG22 THR 16 54.232 37.882 26.923 94 HG23 THR 16 HG23 THR 16 54.625 37.984 28.656 95 H ALA 17 H ALA 17 50.168 39.347 26.743 96 HA ALA 17 HA ALA 17 48.880 41.336 28.362 97 HB1 ALA 17 HB1 ALA 17 47.450 41.663 26.457 98 HB2 ALA 17 HB2 ALA 17 49.114 41.444 25.885 99 HB3 ALA 17 HB3 ALA 17 47.937 40.121 25.739 100 H ILE 18 H ILE 18 48.040 37.986 27.403 101 HA ILE 18 HA ILE 18 45.519 37.807 28.770 102 HB ILE 18 HB ILE 18 47.556 35.594 28.260 103 HG12 ILE 18 HG12 ILE 18 45.113 36.453 26.630 104 HG13 ILE 18 HG13 ILE 18 46.771 36.811 26.188 105 HG21 ILE 18 HG21 ILE 18 44.575 35.461 28.927 106 HG22 ILE 18 HG22 ILE 18 45.597 34.073 28.494 107 HG23 ILE 18 HG23 ILE 18 45.911 34.942 29.979 108 HD11 ILE 18 HD11 ILE 18 47.200 34.282 26.178 109 HD12 ILE 18 HD12 ILE 18 45.425 34.117 26.206 110 HD13 ILE 18 HD13 ILE 18 46.209 34.964 24.868 111 H TRP 19 H TRP 19 48.869 37.110 29.949 112 HA TRP 19 HA TRP 19 47.940 36.293 32.547 113 HB2 TRP 19 HB2 TRP 19 50.674 37.250 31.663 114 HB3 TRP 19 HB3 TRP 19 50.311 36.433 33.171 115 HD1 TRP 19 HD1 TRP 19 52.242 35.521 30.655 116 HE1 TRP 19 HE1 TRP 19 51.922 33.221 29.558 117 HE3 TRP 19 HE3 TRP 19 47.509 34.356 32.348 118 HZ2 TRP 19 HZ2 TRP 19 50.083 31.038 29.696 119 HZ3 TRP 19 HZ3 TRP 19 46.498 32.203 31.770 120 HH2 TRP 19 HH2 TRP 19 47.792 30.492 30.544 121 H GLN 20 H GLN 20 49.284 39.459 31.476 122 HA GLN 20 HA GLN 20 48.816 40.589 34.075 123 HB2 GLN 20 HB2 GLN 20 49.317 42.724 33.078 124 HB3 GLN 20 HB3 GLN 20 50.404 41.501 32.456 125 HG2 GLN 20 HG2 GLN 20 49.951 42.514 30.480 126 HG3 GLN 20 HG3 GLN 20 48.679 41.319 30.491 127 HE21 GLN 20 HE21 GLN 20 46.655 42.093 30.014 128 HE22 GLN 20 HE22 GLN 20 46.095 43.681 30.557 129 H ALA 21 H ALA 21 46.582 40.107 31.304 130 HA ALA 21 HA ALA 21 44.511 41.795 32.367 131 HB1 ALA 21 HB1 ALA 21 43.029 40.461 30.880 132 HB2 ALA 21 HB2 ALA 21 44.475 41.057 30.045 133 HB3 ALA 21 HB3 ALA 21 44.364 39.353 30.545 134 H LEU 22 H LEU 22 45.241 38.311 32.839 135 HA LEU 22 HA LEU 22 42.911 37.846 34.515 136 HB2 LEU 22 HB2 LEU 22 45.414 36.226 33.917 137 HB3 LEU 22 HB3 LEU 22 44.080 35.654 34.867 138 HG LEU 22 HG LEU 22 43.884 36.473 31.920 139 HD11 LEU 22 HD11 LEU 22 43.836 33.731 33.228 140 HD12 LEU 22 HD12 LEU 22 45.153 34.403 32.250 141 HD13 LEU 22 HD13 LEU 22 43.589 34.067 31.495 142 HD21 LEU 22 HD21 LEU 22 41.665 35.402 31.949 143 HD22 LEU 22 HD22 LEU 22 41.720 36.824 32.985 144 HD23 LEU 22 HD23 LEU 22 41.798 35.205 33.707 145 H PHE 23 H PHE 23 46.426 38.125 35.202 146 HA PHE 23 HA PHE 23 46.116 37.939 38.060 147 HB2 PHE 23 HB2 PHE 23 48.276 39.027 36.266 148 HB3 PHE 23 HB3 PHE 23 48.502 38.790 38.002 149 HD1 PHE 23 HD1 PHE 23 47.193 35.919 38.080 150 HD2 PHE 23 HD2 PHE 23 50.179 37.828 35.625 151 HE1 PHE 23 HE1 PHE 23 48.301 33.732 37.681 152 HE2 PHE 23 HE2 PHE 23 51.274 35.634 35.244 153 HZ PHE 23 HZ PHE 23 50.313 33.577 36.253 154 H ALA 24 H ALA 24 45.236 40.452 36.016 155 HA ALA 24 HA ALA 24 44.699 42.600 36.169 156 HB1 ALA 24 HB1 ALA 24 43.522 43.279 38.180 157 HB2 ALA 24 HB2 ALA 24 43.158 41.589 37.794 158 HB3 ALA 24 HB3 ALA 24 44.293 41.978 39.110 159 H LEU 25 H LEU 25 47.631 42.000 36.757 160 HA LEU 25 HA LEU 25 48.422 44.212 38.490 161 HB2 LEU 25 HB2 LEU 25 50.752 43.193 38.193 162 HB3 LEU 25 HB3 LEU 25 49.521 42.342 39.097 163 HG LEU 25 HG LEU 25 49.115 40.893 37.087 164 HD11 LEU 25 HD11 LEU 25 51.777 41.983 36.147 165 HD12 LEU 25 HD12 LEU 25 50.222 42.329 35.360 166 HD13 LEU 25 HD13 LEU 25 50.843 40.668 35.415 167 HD21 LEU 25 HD21 LEU 25 51.890 40.875 38.334 168 HD22 LEU 25 HD22 LEU 25 51.103 39.493 37.541 169 HD23 LEU 25 HD23 LEU 25 50.427 40.156 39.035 170 HA PRO 26 HA PRO 26 49.346 47.207 35.552 171 HB2 PRO 26 HB2 PRO 26 51.244 48.746 36.733 172 HB3 PRO 26 HB3 PRO 26 49.607 48.516 37.429 173 HG2 PRO 26 HG2 PRO 26 52.124 47.001 38.186 174 HG3 PRO 26 HG3 PRO 26 50.993 47.889 39.261 175 HD2 PRO 26 HD2 PRO 26 50.722 45.238 38.866 176 HD3 PRO 26 HD3 PRO 26 49.284 46.295 38.950 177 H ALA 27 H ALA 27 50.032 45.857 33.904 178 HA ALA 27 HA ALA 27 51.306 44.852 32.353 179 HB1 ALA 27 HB1 ALA 27 53.377 45.858 31.609 180 HB2 ALA 27 HB2 ALA 27 52.182 47.120 31.965 181 HB3 ALA 27 HB3 ALA 27 53.510 46.800 33.105 182 H VAL 28 H VAL 28 53.383 43.544 31.934 183 HA VAL 28 HA VAL 28 54.261 42.196 34.444 184 HB VAL 28 HB VAL 28 52.261 41.090 33.508 185 HG11 VAL 28 HG11 VAL 28 54.082 40.226 31.226 186 HG12 VAL 28 HG12 VAL 28 52.428 39.663 31.541 187 HG13 VAL 28 HG13 VAL 28 52.710 41.350 31.083 188 HG21 VAL 28 HG21 VAL 28 53.012 38.844 33.806 189 HG22 VAL 28 HG22 VAL 28 54.693 39.304 33.494 190 HG23 VAL 28 HG23 VAL 28 53.857 39.895 34.954 191 H GLY 29 H GLY 29 56.128 40.963 34.368 192 HA2 GLY 29 HA2 GLY 29 58.225 41.872 32.559 193 HA3 GLY 29 HA3 GLY 29 58.368 40.710 33.870 194 H ARG 30 H ARG 30 59.729 40.264 31.641 195 HA ARG 30 HA ARG 30 58.399 37.938 30.295 196 HB2 ARG 30 HB2 ARG 30 58.613 39.919 28.815 197 HB3 ARG 30 HB3 ARG 30 60.358 39.938 29.105 198 HG2 ARG 30 HG2 ARG 30 60.584 37.730 28.016 199 HG3 ARG 30 HG3 ARG 30 58.825 37.648 27.788 200 HD2 ARG 30 HD2 ARG 30 58.884 39.595 26.328 201 HD3 ARG 30 HD3 ARG 30 60.607 39.853 26.670 202 HE ARG 30 HE ARG 30 60.750 37.378 25.676 203 HH11 ARG 30 HH11 ARG 30 59.339 40.289 24.283 204 HH12 ARG 30 HH12 ARG 30 59.312 39.566 22.682 205 HH21 ARG 30 HH21 ARG 30 60.827 36.664 23.633 206 HH22 ARG 30 HH22 ARG 30 60.153 37.640 22.321 207 H HIS 31 H HIS 31 61.273 39.153 31.884 208 HA HIS 31 HA HIS 31 62.993 36.959 31.096 209 HB2 HIS 31 HB2 HIS 31 63.661 39.354 31.521 210 HB3 HIS 31 HB3 HIS 31 63.373 39.086 33.241 211 HD1 HIS 31 HD1 HIS 31 65.611 38.484 34.480 212 HD2 HIS 31 HD2 HIS 31 65.526 37.438 30.401 213 HE1 HIS 31 HE1 HIS 31 67.828 37.330 33.990 214 H GLN 32 H GLN 32 60.647 37.207 33.613 215 HA GLN 32 HA GLN 32 62.011 35.237 35.343 216 HB2 GLN 32 HB2 GLN 32 61.294 37.306 36.324 217 HB3 GLN 32 HB3 GLN 32 59.630 37.040 35.804 218 HG2 GLN 32 HG2 GLN 32 59.388 35.142 37.316 219 HG3 GLN 32 HG3 GLN 32 61.115 35.171 37.687 220 HE21 GLN 32 HE21 GLN 32 60.337 35.192 39.935 221 HE22 GLN 32 HE22 GLN 32 59.951 36.740 40.654 222 H ASP 33 H ASP 33 61.118 33.403 36.192 223 HA ASP 33 HA ASP 33 59.576 31.804 34.401 224 HB2 ASP 33 HB2 ASP 33 59.771 30.058 36.073 225 HB3 ASP 33 HB3 ASP 33 61.313 30.822 35.707 226 H PHE 34 H PHE 34 57.572 31.318 34.235 227 HA PHE 34 HA PHE 34 55.547 32.915 35.078 228 HB2 PHE 34 HB2 PHE 34 55.601 31.392 33.129 229 HB3 PHE 34 HB3 PHE 34 55.415 29.990 34.175 230 HD1 PHE 34 HD1 PHE 34 53.324 29.045 33.770 231 HD2 PHE 34 HD2 PHE 34 53.632 33.341 33.950 232 HE1 PHE 34 HE1 PHE 34 50.877 29.240 33.403 233 HE2 PHE 34 HE2 PHE 34 51.186 33.527 33.592 234 HZ PHE 34 HZ PHE 34 49.818 31.486 33.287 235 H PHE 35 H PHE 35 56.454 29.887 36.720 236 HA PHE 35 HA PHE 35 54.177 29.644 38.424 237 HB2 PHE 35 HB2 PHE 35 55.830 27.874 37.920 238 HB3 PHE 35 HB3 PHE 35 57.066 28.782 38.781 239 HD1 PHE 35 HD1 PHE 35 57.237 28.717 41.201 240 HD2 PHE 35 HD2 PHE 35 53.955 26.778 39.174 241 HE1 PHE 35 HE1 PHE 35 56.659 27.505 43.288 242 HE2 PHE 35 HE2 PHE 35 53.402 25.550 41.258 243 HZ PHE 35 HZ PHE 35 54.744 25.922 43.321 244 H ALA 36 H ALA 36 57.180 31.524 38.832 245 HA ALA 36 HA ALA 36 56.446 32.416 41.553 246 HB1 ALA 36 HB1 ALA 36 58.581 33.617 41.370 247 HB2 ALA 36 HB2 ALA 36 58.779 31.908 40.903 248 HB3 ALA 36 HB3 ALA 36 58.692 33.170 39.649 249 H LEU 37 H LEU 37 56.598 33.689 38.232 250 HA LEU 37 HA LEU 37 56.009 36.393 38.638 251 HB2 LEU 37 HB2 LEU 37 56.660 35.047 36.517 252 HB3 LEU 37 HB3 LEU 37 54.966 34.589 36.418 253 HG LEU 37 HG LEU 37 54.438 37.113 36.260 254 HD11 LEU 37 HD11 LEU 37 56.299 38.504 35.417 255 HD12 LEU 37 HD12 LEU 37 57.416 37.139 35.605 256 HD13 LEU 37 HD13 LEU 37 56.695 37.910 37.039 257 HD21 LEU 37 HD21 LEU 37 54.314 35.597 34.344 258 HD22 LEU 37 HD22 LEU 37 56.082 35.672 34.127 259 HD23 LEU 37 HD23 LEU 37 55.086 37.102 33.826 260 H GLY 38 H GLY 38 53.802 33.642 38.377 261 HA2 GLY 38 HA2 GLY 38 51.346 35.211 38.564 262 HA3 GLY 38 HA3 GLY 38 51.493 33.448 38.593 263 H GLY 39 H GLY 39 53.518 34.163 40.978 264 HA2 GLY 39 HA2 GLY 39 53.525 34.520 43.205 265 HA3 GLY 39 HA3 GLY 39 51.969 35.335 43.034 266 H ASP 40 H ASP 40 50.687 32.732 42.042 267 HA ASP 40 HA ASP 40 50.800 31.000 44.445 268 HB2 ASP 40 HB2 ASP 40 49.057 32.768 44.829 269 HB3 ASP 40 HB3 ASP 40 48.209 32.202 43.387 270 H SER 41 H SER 41 50.589 28.813 43.903 271 HA SER 41 HA SER 41 50.333 28.029 41.120 272 HB2 SER 41 HB2 SER 41 50.318 25.729 41.946 273 HB3 SER 41 HB3 SER 41 51.635 26.677 42.654 274 HG SER 41 HG SER 41 49.642 25.347 43.866 275 H GLN 42 H GLN 42 47.872 28.515 43.627 276 HA GLN 42 HA GLN 42 45.793 27.236 42.021 277 HB2 GLN 42 HB2 GLN 42 45.781 29.113 44.379 278 HB3 GLN 42 HB3 GLN 42 44.284 28.762 43.484 279 HG2 GLN 42 HG2 GLN 42 44.704 26.317 43.818 280 HG3 GLN 42 HG3 GLN 42 46.135 26.733 44.772 281 HE21 GLN 42 HE21 GLN 42 44.144 25.142 45.846 282 HE22 GLN 42 HE22 GLN 42 43.469 26.038 47.204 283 H LEU 43 H LEU 43 47.272 30.484 41.992 284 HA LEU 43 HA LEU 43 45.437 31.435 39.928 285 HB2 LEU 43 HB2 LEU 43 48.112 32.462 40.938 286 HB3 LEU 43 HB3 LEU 43 47.361 33.081 39.487 287 HG LEU 43 HG LEU 43 46.108 33.194 42.241 288 HD11 LEU 43 HD11 LEU 43 48.016 34.735 41.955 289 HD12 LEU 43 HD12 LEU 43 46.472 35.608 42.040 290 HD13 LEU 43 HD13 LEU 43 47.264 35.376 40.469 291 HD21 LEU 43 HD21 LEU 43 45.188 34.277 39.529 292 HD22 LEU 43 HD22 LEU 43 44.521 34.795 41.090 293 HD23 LEU 43 HD23 LEU 43 44.345 33.119 40.603 294 H GLY 44 H GLY 44 48.566 29.669 39.924 295 HA2 GLY 44 HA2 GLY 44 48.936 29.516 37.111 296 HA3 GLY 44 HA3 GLY 44 49.403 28.271 38.275 297 H LEU 45 H LEU 45 47.091 27.224 39.190 298 HA LEU 45 HA LEU 45 45.935 25.629 37.132 299 HB2 LEU 45 HB2 LEU 45 45.209 26.326 39.979 300 HB3 LEU 45 HB3 LEU 45 43.972 25.602 38.967 301 HG LEU 45 HG LEU 45 45.358 23.662 38.507 302 HD11 LEU 45 HD11 LEU 45 47.371 23.164 39.784 303 HD12 LEU 45 HD12 LEU 45 47.314 24.753 40.565 304 HD13 LEU 45 HD13 LEU 45 47.641 24.620 38.821 305 HD21 LEU 45 HD21 LEU 45 45.146 22.682 40.742 306 HD22 LEU 45 HD22 LEU 45 43.762 23.721 40.398 307 HD23 LEU 45 HD23 LEU 45 45.055 24.296 41.473 308 H ARG 46 H ARG 46 44.656 28.639 38.584 309 HA ARG 46 HA ARG 46 42.309 28.889 36.952 310 HB2 ARG 46 HB2 ARG 46 42.771 30.027 39.119 311 HB3 ARG 46 HB3 ARG 46 44.018 30.989 38.327 312 HG2 ARG 46 HG2 ARG 46 42.221 31.925 36.812 313 HG3 ARG 46 HG3 ARG 46 41.017 31.127 37.842 314 HD2 ARG 46 HD2 ARG 46 43.152 33.099 38.776 315 HD3 ARG 46 HD3 ARG 46 41.514 33.564 38.428 316 HE ARG 46 HE ARG 46 41.578 31.419 40.403 317 HH11 ARG 46 HH11 ARG 46 41.992 34.892 40.125 318 HH12 ARG 46 HH12 ARG 46 41.412 35.165 41.754 319 HH21 ARG 46 HH21 ARG 46 41.120 31.794 42.480 320 HH22 ARG 46 HH22 ARG 46 41.221 33.408 43.147 321 H MET 47 H MET 47 45.666 29.985 36.396 322 HA MET 47 HA MET 47 45.129 31.447 33.983 323 HB2 MET 47 HB2 MET 47 47.663 30.123 35.049 324 HB3 MET 47 HB3 MET 47 47.596 30.955 33.531 325 HG2 MET 47 HG2 MET 47 47.609 32.077 36.270 326 HG3 MET 47 HG3 MET 47 48.447 32.572 34.834 327 HE1 MET 47 HE1 MET 47 44.647 34.343 36.580 328 HE2 MET 47 HE2 MET 47 44.652 32.587 36.360 329 HE3 MET 47 HE3 MET 47 45.903 33.361 37.355 330 H LEU 48 H LEU 48 46.111 28.006 34.486 331 HA LEU 48 HA LEU 48 45.972 27.274 31.709 332 HB2 LEU 48 HB2 LEU 48 46.979 25.794 33.290 333 HB3 LEU 48 HB3 LEU 48 45.542 25.744 34.292 334 HG LEU 48 HG LEU 48 44.340 24.389 32.701 335 HD11 LEU 48 HD11 LEU 48 46.763 24.606 30.874 336 HD12 LEU 48 HD12 LEU 48 45.142 25.222 30.527 337 HD13 LEU 48 HD13 LEU 48 45.409 23.485 30.652 338 HD21 LEU 48 HD21 LEU 48 45.750 22.377 32.772 339 HD22 LEU 48 HD22 LEU 48 45.926 23.298 34.275 340 HD23 LEU 48 HD23 LEU 48 47.195 23.369 33.037 341 H ALA 49 H ALA 49 43.383 27.214 34.231 342 HA ALA 49 HA ALA 49 41.310 26.295 32.584 343 HB1 ALA 49 HB1 ALA 49 39.828 27.304 34.317 344 HB2 ALA 49 HB2 ALA 49 41.211 26.469 35.047 345 HB3 ALA 49 HB3 ALA 49 41.186 28.238 34.939 346 H GLN 50 H GLN 50 42.101 29.738 33.248 347 HA GLN 50 HA GLN 50 40.046 30.635 31.415 348 HB2 GLN 50 HB2 GLN 50 42.153 32.158 32.970 349 HB3 GLN 50 HB3 GLN 50 40.871 32.898 31.993 350 HG2 GLN 50 HG2 GLN 50 39.176 31.611 33.390 351 HG3 GLN 50 HG3 GLN 50 40.497 31.136 34.461 352 HE21 GLN 50 HE21 GLN 50 38.441 33.837 33.402 353 HE22 GLN 50 HE22 GLN 50 39.060 34.974 34.601 354 H LEU 51 H LEU 51 43.618 30.235 30.996 355 HA LEU 51 HA LEU 51 43.651 31.521 28.405 356 HB2 LEU 51 HB2 LEU 51 45.726 30.981 29.583 357 HB3 LEU 51 HB3 LEU 51 45.344 29.255 29.531 358 HG LEU 51 HG LEU 51 45.418 29.405 26.986 359 HD11 LEU 51 HD11 LEU 51 46.638 31.288 25.985 360 HD12 LEU 51 HD12 LEU 51 46.714 32.098 27.565 361 HD13 LEU 51 HD13 LEU 51 45.150 31.853 26.754 362 HD21 LEU 51 HD21 LEU 51 48.020 30.159 28.331 363 HD22 LEU 51 HD22 LEU 51 47.800 29.282 26.814 364 HD23 LEU 51 HD23 LEU 51 47.298 28.528 28.335 365 H ARG 52 H ARG 52 43.025 28.120 29.434 366 HA ARG 52 HA ARG 52 42.594 27.078 26.821 367 HB2 ARG 52 HB2 ARG 52 43.008 25.819 28.929 368 HB3 ARG 52 HB3 ARG 52 41.353 26.178 29.449 369 HG2 ARG 52 HG2 ARG 52 40.474 24.907 27.511 370 HG3 ARG 52 HG3 ARG 52 42.115 24.697 26.893 371 HD2 ARG 52 HD2 ARG 52 41.537 22.657 28.010 372 HD3 ARG 52 HD3 ARG 52 42.739 23.479 28.994 373 HE ARG 52 HE ARG 52 41.164 23.767 30.711 374 HH11 ARG 52 HH11 ARG 52 39.407 22.569 27.879 375 HH12 ARG 52 HH12 ARG 52 37.975 22.332 28.891 376 HH21 ARG 52 HH21 ARG 52 39.274 23.499 31.741 377 HH22 ARG 52 HH22 ARG 52 37.878 22.839 30.869 378 H GLU 53 H GLU 53 40.238 28.512 29.123 379 HA GLU 53 HA GLU 53 38.010 28.343 27.294 380 HB2 GLU 53 HB2 GLU 53 38.571 30.005 29.774 381 HB3 GLU 53 HB3 GLU 53 37.078 30.149 28.848 382 HG2 GLU 53 HG2 GLU 53 36.630 27.741 29.134 383 HG3 GLU 53 HG3 GLU 53 38.091 27.570 30.106 384 H ARG 54 H ARG 54 40.493 30.896 27.577 385 HA ARG 54 HA ARG 54 38.934 32.717 25.809 386 HB2 ARG 54 HB2 ARG 54 41.593 32.977 27.258 387 HB3 ARG 54 HB3 ARG 54 40.905 34.237 26.238 388 HG2 ARG 54 HG2 ARG 54 38.979 34.532 27.658 389 HG3 ARG 54 HG3 ARG 54 39.387 33.115 28.622 390 HD2 ARG 54 HD2 ARG 54 40.030 34.996 29.899 391 HD3 ARG 54 HD3 ARG 54 41.511 34.240 29.336 392 HE ARG 54 HE ARG 54 41.614 36.028 27.549 393 HH11 ARG 54 HH11 ARG 54 39.675 36.865 30.397 394 HH12 ARG 54 HH12 ARG 54 40.015 38.558 30.177 395 HH21 ARG 54 HH21 ARG 54 41.894 38.061 27.310 396 HH22 ARG 54 HH22 ARG 54 41.267 39.253 28.431 397 H HIS 55 H HIS 55 41.653 30.564 25.474 398 HA HIS 55 HA HIS 55 42.183 31.597 22.718 399 HB2 HIS 55 HB2 HIS 55 43.670 32.347 24.661 400 HB3 HIS 55 HB3 HIS 55 44.240 30.693 24.742 401 HD1 HIS 55 HD1 HIS 55 44.326 33.783 22.374 402 HD2 HIS 55 HD2 HIS 55 46.130 30.022 23.000 403 HE1 HIS 55 HE1 HIS 55 46.384 33.705 20.886 404 H GLY 56 H GLY 56 41.326 28.764 24.424 405 HA2 GLY 56 HA2 GLY 56 40.961 26.643 23.681 406 HA3 GLY 56 HA3 GLY 56 41.210 27.261 22.047 407 H VAL 57 H VAL 57 43.450 26.744 24.832 408 HA VAL 57 HA VAL 57 45.098 24.842 23.262 409 HB VAL 57 HB VAL 57 47.179 26.030 23.954 410 HG11 VAL 57 HG11 VAL 57 46.323 26.187 21.680 411 HG12 VAL 57 HG12 VAL 57 45.399 27.646 22.118 412 HG13 VAL 57 HG13 VAL 57 47.177 27.657 22.172 413 HG21 VAL 57 HG21 VAL 57 46.284 27.446 25.760 414 HG22 VAL 57 HG22 VAL 57 47.129 28.397 24.532 415 HG23 VAL 57 HG23 VAL 57 45.352 28.387 24.575 416 H ASP 58 H ASP 58 46.810 23.854 24.577 417 HA ASP 58 HA ASP 58 45.948 23.403 27.392 418 HB2 ASP 58 HB2 ASP 58 45.910 21.487 25.746 419 HB3 ASP 58 HB3 ASP 58 47.651 21.661 25.562 420 H LEU 59 H LEU 59 47.676 23.093 28.967 421 HA LEU 59 HA LEU 59 50.319 24.327 28.277 422 HB2 LEU 59 HB2 LEU 59 48.930 24.566 30.964 423 HB3 LEU 59 HB3 LEU 59 50.557 25.080 30.587 424 HG LEU 59 HG LEU 59 48.014 26.285 29.414 425 HD11 LEU 59 HD11 LEU 59 48.636 28.244 30.742 426 HD12 LEU 59 HD12 LEU 59 50.089 27.412 31.346 427 HD13 LEU 59 HD13 LEU 59 48.474 26.836 31.800 428 HD21 LEU 59 HD21 LEU 59 49.738 26.482 27.752 429 HD22 LEU 59 HD22 LEU 59 50.962 26.917 28.971 430 HD23 LEU 59 HD23 LEU 59 49.652 28.045 28.570 431 HA PRO 60 HA PRO 60 51.182 20.032 29.566 432 HB2 PRO 60 HB2 PRO 60 53.682 20.604 28.019 433 HB3 PRO 60 HB3 PRO 60 52.646 19.153 27.980 434 HG2 PRO 60 HG2 PRO 60 52.580 20.970 25.957 435 HG3 PRO 60 HG3 PRO 60 51.064 20.228 26.551 436 HD2 PRO 60 HD2 PRO 60 52.235 22.925 27.272 437 HD3 PRO 60 HD3 PRO 60 50.557 22.506 26.807 438 H LEU 61 H LEU 61 52.061 19.714 31.556 439 HA LEU 61 HA LEU 61 53.788 21.512 32.922 440 HB2 LEU 61 HB2 LEU 61 52.882 18.654 33.296 441 HB3 LEU 61 HB3 LEU 61 54.143 19.283 34.332 442 HG LEU 61 HG LEU 61 51.498 20.739 33.980 443 HD11 LEU 61 HD11 LEU 61 52.229 18.743 36.153 444 HD12 LEU 61 HD12 LEU 61 51.003 18.519 34.885 445 HD13 LEU 61 HD13 LEU 61 50.784 19.766 36.118 446 HD21 LEU 61 HD21 LEU 61 53.664 20.854 36.133 447 HD22 LEU 61 HD22 LEU 61 52.127 21.737 36.177 448 HD23 LEU 61 HD23 LEU 61 53.316 22.117 34.936 449 H ARG 62 H ARG 62 54.580 18.894 30.690 450 HA ARG 62 HA ARG 62 57.416 18.959 30.813 451 HB2 ARG 62 HB2 ARG 62 56.174 17.444 29.337 452 HB3 ARG 62 HB3 ARG 62 55.552 18.811 28.399 453 HG2 ARG 62 HG2 ARG 62 57.900 19.394 27.743 454 HG3 ARG 62 HG3 ARG 62 58.485 18.004 28.662 455 HD2 ARG 62 HD2 ARG 62 58.422 17.415 26.338 456 HD3 ARG 62 HD3 ARG 62 57.170 16.502 27.170 457 HE ARG 62 HE ARG 62 55.588 17.503 25.821 458 HH11 ARG 62 HH11 ARG 62 58.442 19.628 25.542 459 HH12 ARG 62 HH12 ARG 62 57.739 20.433 24.172 460 HH21 ARG 62 HH21 ARG 62 54.826 18.591 24.216 461 HH22 ARG 62 HH22 ARG 62 55.766 19.841 23.407 462 H CYS 63 H CYS 63 55.308 21.186 28.888 463 HA CYS 63 HA CYS 63 57.487 22.869 28.061 464 HB2 CYS 63 HB2 CYS 63 54.486 23.440 28.085 465 HB3 CYS 63 HB3 CYS 63 55.734 24.393 27.288 466 HG CYS 63 HG CYS 63 56.622 22.563 25.705 467 H LEU 64 H LEU 64 55.336 23.008 30.876 468 HA LEU 64 HA LEU 64 56.271 25.510 31.952 469 HB2 LEU 64 HB2 LEU 64 54.377 23.631 32.630 470 HB3 LEU 64 HB3 LEU 64 55.618 23.257 33.792 471 HG LEU 64 HG LEU 64 54.116 24.672 34.883 472 HD11 LEU 64 HD11 LEU 64 56.311 26.592 34.018 473 HD12 LEU 64 HD12 LEU 64 56.460 25.365 35.295 474 HD13 LEU 64 HD13 LEU 64 55.296 26.691 35.472 475 HD21 LEU 64 HD21 LEU 64 52.973 25.437 32.828 476 HD22 LEU 64 HD22 LEU 64 54.270 26.638 32.591 477 HD23 LEU 64 HD23 LEU 64 53.217 26.714 34.026 478 H TYR 65 H TYR 65 57.600 22.145 32.287 479 HA TYR 65 HA TYR 65 59.792 23.048 33.967 480 HB2 TYR 65 HB2 TYR 65 58.834 20.720 33.923 481 HB3 TYR 65 HB3 TYR 65 59.678 20.464 32.400 482 HD1 TYR 65 HD1 TYR 65 62.234 20.574 32.363 483 HD2 TYR 65 HD2 TYR 65 59.979 20.746 36.039 484 HE1 TYR 65 HE1 TYR 65 64.300 20.092 33.646 485 HE2 TYR 65 HE2 TYR 65 62.059 20.244 37.325 486 HH TYR 65 HH TYR 65 65.219 19.708 35.738 487 H GLU 66 H GLU 66 59.632 22.223 30.441 488 HA GLU 66 HA GLU 66 62.474 22.844 30.195 489 HB2 GLU 66 HB2 GLU 66 62.380 22.064 28.011 490 HB3 GLU 66 HB3 GLU 66 61.408 20.969 28.987 491 HG2 GLU 66 HG2 GLU 66 59.357 21.937 28.063 492 HG3 GLU 66 HG3 GLU 66 60.271 23.177 27.200 493 H ALA 67 H ALA 67 59.627 24.799 29.752 494 HA ALA 67 HA ALA 67 61.335 27.033 28.831 495 HB1 ALA 67 HB1 ALA 67 60.400 25.978 26.798 496 HB2 ALA 67 HB2 ALA 67 58.758 26.172 27.456 497 HB3 ALA 67 HB3 ALA 67 59.737 27.599 27.061 498 HA PRO 68 HA PRO 68 58.141 27.835 32.244 499 HB2 PRO 68 HB2 PRO 68 59.818 28.898 34.166 500 HB3 PRO 68 HB3 PRO 68 59.505 27.164 33.965 501 HG2 PRO 68 HG2 PRO 68 61.818 28.803 32.848 502 HG3 PRO 68 HG3 PRO 68 61.910 27.252 33.746 503 HD2 PRO 68 HD2 PRO 68 62.012 27.276 31.054 504 HD3 PRO 68 HD3 PRO 68 61.046 26.032 31.902 505 H THR 69 H THR 69 60.363 29.897 30.560 506 HA THR 69 HA THR 69 59.429 32.372 31.827 507 HB THR 69 HB THR 69 61.153 32.696 29.471 508 HG1 THR 69 HG1 THR 69 62.944 31.883 31.007 509 HG21 THR 69 HG21 THR 69 62.403 34.081 30.980 510 HG22 THR 69 HG22 THR 69 61.722 33.266 32.412 511 HG23 THR 69 HG23 THR 69 60.702 34.315 31.419 512 H VAL 70 H VAL 70 57.952 33.759 31.001 513 HA VAL 70 HA VAL 70 55.906 32.536 29.704 514 HB VAL 70 HB VAL 70 54.867 34.838 29.365 515 HG11 VAL 70 HG11 VAL 70 54.537 35.183 31.740 516 HG12 VAL 70 HG12 VAL 70 54.475 33.460 31.339 517 HG13 VAL 70 HG13 VAL 70 55.926 34.136 32.120 518 HG21 VAL 70 HG21 VAL 70 56.964 36.170 29.134 519 HG22 VAL 70 HG22 VAL 70 55.923 36.750 30.443 520 HG23 VAL 70 HG23 VAL 70 57.365 35.805 30.828 521 H ALA 71 H ALA 71 58.299 34.420 27.821 522 HA ALA 71 HA ALA 71 56.555 34.404 25.439 523 HB1 ALA 71 HB1 ALA 71 59.467 35.170 25.836 524 HB2 ALA 71 HB2 ALA 71 58.524 35.435 24.361 525 HB3 ALA 71 HB3 ALA 71 58.073 36.283 25.859 526 H ARG 72 H ARG 72 59.242 32.498 26.731 527 HA ARG 72 HA ARG 72 59.549 30.825 24.316 528 HB2 ARG 72 HB2 ARG 72 60.621 30.447 27.146 529 HB3 ARG 72 HB3 ARG 72 61.018 29.487 25.712 530 HG2 ARG 72 HG2 ARG 72 61.811 31.656 24.609 531 HG3 ARG 72 HG3 ARG 72 61.616 32.438 26.176 532 HD2 ARG 72 HD2 ARG 72 63.911 31.873 25.973 533 HD3 ARG 72 HD3 ARG 72 63.217 30.777 27.159 534 HE ARG 72 HE ARG 72 64.135 30.146 24.387 535 HH11 ARG 72 HH11 ARG 72 62.882 28.737 27.410 536 HH12 ARG 72 HH12 ARG 72 63.128 27.123 26.735 537 HH21 ARG 72 HH21 ARG 72 64.391 27.992 23.775 538 HH22 ARG 72 HH22 ARG 72 63.925 26.748 24.928 539 H LEU 73 H LEU 73 57.974 30.528 27.510 540 HA LEU 73 HA LEU 73 56.656 28.070 27.111 541 HB2 LEU 73 HB2 LEU 73 56.583 29.524 29.180 542 HB3 LEU 73 HB3 LEU 73 55.483 30.592 28.359 543 HG LEU 73 HG LEU 73 54.476 27.875 28.070 544 HD11 LEU 73 HD11 LEU 73 55.005 28.660 30.963 545 HD12 LEU 73 HD12 LEU 73 55.790 27.326 30.092 546 HD13 LEU 73 HD13 LEU 73 54.051 27.266 30.389 547 HD21 LEU 73 HD21 LEU 73 52.507 28.817 29.154 548 HD22 LEU 73 HD22 LEU 73 53.156 29.970 27.970 549 HD23 LEU 73 HD23 LEU 73 53.443 30.219 29.712 550 H ALA 74 H ALA 74 55.430 31.380 26.184 551 HA ALA 74 HA ALA 74 53.245 30.489 24.659 552 HB1 ALA 74 HB1 ALA 74 53.736 32.836 25.389 553 HB2 ALA 74 HB2 ALA 74 54.985 32.928 24.114 554 HB3 ALA 74 HB3 ALA 74 53.286 32.709 23.670 555 H GLU 75 H GLU 75 56.669 30.758 23.596 556 HA GLU 75 HA GLU 75 56.115 30.181 20.839 557 HB2 GLU 75 HB2 GLU 75 58.288 31.082 21.782 558 HB3 GLU 75 HB3 GLU 75 58.666 29.436 22.330 559 HG2 GLU 75 HG2 GLU 75 58.485 28.621 19.998 560 HG3 GLU 75 HG3 GLU 75 57.964 30.240 19.494 561 H THR 76 H THR 76 56.929 27.943 23.567 562 HA THR 76 HA THR 76 56.641 25.546 22.025 563 HB THR 76 HB THR 76 56.297 24.316 24.062 564 HG1 THR 76 HG1 THR 76 55.905 26.849 25.213 565 HG21 THR 76 HG21 THR 76 58.338 24.812 25.238 566 HG22 THR 76 HG22 THR 76 58.414 26.442 24.540 567 HG23 THR 76 HG23 THR 76 58.596 25.021 23.500 568 H ILE 77 H ILE 77 54.161 27.247 24.023 569 HA ILE 77 HA ILE 77 52.128 25.362 23.449 570 HB ILE 77 HB ILE 77 51.740 28.285 24.181 571 HG12 ILE 77 HG12 ILE 77 53.078 27.377 25.932 572 HG13 ILE 77 HG13 ILE 77 51.454 27.431 26.510 573 HG21 ILE 77 HG21 ILE 77 49.874 25.878 24.404 574 HG22 ILE 77 HG22 ILE 77 49.573 27.447 25.166 575 HG23 ILE 77 HG23 ILE 77 49.637 27.320 23.407 576 HD11 ILE 77 HD11 ILE 77 52.502 25.383 27.245 577 HD12 ILE 77 HD12 ILE 77 51.295 24.931 26.027 578 HD13 ILE 77 HD13 ILE 77 53.019 24.971 25.605 579 H VAL 78 H VAL 78 53.071 28.317 21.597 580 HA VAL 78 HA VAL 78 50.827 27.987 19.740 581 HB VAL 78 HB VAL 78 53.231 29.828 19.727 582 HG11 VAL 78 HG11 VAL 78 52.634 29.505 17.381 583 HG12 VAL 78 HG12 VAL 78 50.911 29.727 17.753 584 HG13 VAL 78 HG13 VAL 78 52.053 31.080 17.922 585 HG21 VAL 78 HG21 VAL 78 51.445 30.266 21.434 586 HG22 VAL 78 HG22 VAL 78 51.482 31.529 20.199 587 HG23 VAL 78 HG23 VAL 78 50.230 30.278 20.143 588 H ARG 79 H ARG 79 54.332 27.031 19.584 589 HA ARG 79 HA ARG 79 53.934 26.076 16.860 590 HB2 ARG 79 HB2 ARG 79 56.082 25.245 16.844 591 HB3 ARG 79 HB3 ARG 79 56.161 26.737 17.775 592 HG2 ARG 79 HG2 ARG 79 56.209 25.388 19.873 593 HG3 ARG 79 HG3 ARG 79 56.163 23.902 18.931 594 HD2 ARG 79 HD2 ARG 79 58.350 26.000 18.592 595 HD3 ARG 79 HD3 ARG 79 58.450 24.676 19.751 596 HE ARG 79 HE ARG 79 58.484 23.059 18.010 597 HH11 ARG 79 HH11 ARG 79 58.726 26.322 16.581 598 HH12 ARG 79 HH12 ARG 79 58.927 25.581 15.007 599 HH21 ARG 79 HH21 ARG 79 59.110 22.370 15.939 600 HH22 ARG 79 HH22 ARG 79 59.510 23.599 14.768 601 H LEU 80 H LEU 80 53.399 24.578 19.983 602 HA LEU 80 HA LEU 80 52.871 21.923 18.805 603 HB2 LEU 80 HB2 LEU 80 52.519 23.017 21.615 604 HB3 LEU 80 HB3 LEU 80 52.328 21.330 21.158 605 HG LEU 80 HG LEU 80 54.966 22.836 20.813 606 HD11 LEU 80 HD11 LEU 80 54.289 22.803 23.183 607 HD12 LEU 80 HD12 LEU 80 55.676 21.758 22.884 608 HD13 LEU 80 HD13 LEU 80 54.037 21.052 23.096 609 HD21 LEU 80 HD21 LEU 80 54.743 20.784 19.443 610 HD22 LEU 80 HD22 LEU 80 54.354 19.862 20.914 611 HD23 LEU 80 HD23 LEU 80 55.952 20.612 20.719 612 H ALA 81 H ALA 81 50.936 24.538 20.268 613 HA ALA 81 HA ALA 81 48.728 24.832 20.591 614 HB1 ALA 81 HB1 ALA 81 47.708 25.488 18.477 615 HB2 ALA 81 HB2 ALA 81 49.402 25.977 18.550 616 HB3 ALA 81 HB3 ALA 81 48.931 24.559 17.578 617 H ALA 82 H ALA 82 48.096 22.962 21.803 618 HA ALA 82 HA ALA 82 47.169 20.556 20.720 619 HB1 ALA 82 HB1 ALA 82 47.611 20.899 23.105 620 HB2 ALA 82 HB2 ALA 82 46.216 21.998 23.220 621 HB3 ALA 82 HB3 ALA 82 45.967 20.278 22.858 622 HA PRO 83 HA PRO 83 43.584 22.107 18.616 623 HB2 PRO 83 HB2 PRO 83 42.512 19.810 17.608 624 HB3 PRO 83 HB3 PRO 83 44.049 20.523 17.025 625 HG2 PRO 83 HG2 PRO 83 43.668 18.281 19.028 626 HG3 PRO 83 HG3 PRO 83 44.785 18.334 17.627 627 HD2 PRO 83 HD2 PRO 83 45.588 18.929 20.173 628 HD3 PRO 83 HD3 PRO 83 46.260 19.784 18.749 629 H ALA 84 H ALA 84 41.805 22.856 19.387 630 HA ALA 84 HA ALA 84 39.944 23.206 20.636 631 HB1 ALA 84 HB1 ALA 84 38.130 21.734 19.742 632 HB2 ALA 84 HB2 ALA 84 39.251 22.316 18.506 633 HB3 ALA 84 HB3 ALA 84 39.382 20.652 19.096 634 HA PRO 85 HA PRO 85 40.770 20.035 24.040 635 HB2 PRO 85 HB2 PRO 85 42.273 21.395 25.830 636 HB3 PRO 85 HB3 PRO 85 42.963 20.832 24.284 637 HG2 PRO 85 HG2 PRO 85 41.862 23.600 24.879 638 HG3 PRO 85 HG3 PRO 85 43.463 23.157 24.195 639 HD2 PRO 85 HD2 PRO 85 41.333 23.823 22.614 640 HD3 PRO 85 HD3 PRO 85 42.552 22.605 22.143 641 H SER 86 H SER 86 38.329 20.648 23.920 642 HA SER 86 HA SER 86 36.371 21.476 24.728 643 HB2 SER 86 HB2 SER 86 37.733 20.887 27.367 644 HB3 SER 86 HB3 SER 86 35.998 21.217 27.163 645 HG SER 86 HG SER 86 37.546 19.030 26.335 646 H GLY 87 H GLY 87 38.099 23.517 23.936 647 HA2 GLY 87 HA2 GLY 87 36.904 25.865 25.138 648 HA3 GLY 87 HA3 GLY 87 38.632 25.722 25.491 649 H ASP 88 H ASP 88 37.698 27.875 24.003 650 HA ASP 88 HA ASP 88 38.330 27.264 21.139 651 HB2 ASP 88 HB2 ASP 88 35.984 28.771 22.355 652 HB3 ASP 88 HB3 ASP 88 36.444 28.927 20.664 653 H GLN 89 H GLN 89 38.937 28.990 19.779 654 HA GLN 89 HA GLN 89 40.674 30.910 21.176 655 HB2 GLN 89 HB2 GLN 89 41.618 31.422 18.977 656 HB3 GLN 89 HB3 GLN 89 41.751 29.750 19.463 657 HG2 GLN 89 HG2 GLN 89 41.314 29.975 17.082 658 HG3 GLN 89 HG3 GLN 89 40.060 29.050 17.889 659 HE21 GLN 89 HE21 GLN 89 40.708 32.503 16.750 660 HE22 GLN 89 HE22 GLN 89 39.018 32.711 16.323 661 H ASP 90 H ASP 90 40.924 33.113 20.241 662 HA ASP 90 HA ASP 90 38.511 34.435 19.252 663 HB2 ASP 90 HB2 ASP 90 38.413 34.270 21.861 664 HB3 ASP 90 HB3 ASP 90 39.770 35.383 21.853 665 H ASP 91 H ASP 91 39.077 36.254 18.056 666 HA ASP 91 HA ASP 91 41.917 37.029 17.769 667 HB2 ASP 91 HB2 ASP 91 39.339 38.053 16.531 668 HB3 ASP 91 HB3 ASP 91 40.901 38.818 16.266 669 H ALA 92 H ALA 92 39.440 37.734 19.934 670 HA ALA 92 HA ALA 92 39.358 38.976 21.801 671 HB1 ALA 92 HB1 ALA 92 41.570 38.011 22.143 672 HB2 ALA 92 HB2 ALA 92 42.325 39.407 21.335 673 HB3 ALA 92 HB3 ALA 92 41.459 39.632 22.854 674 H SER 93 H SER 93 38.134 40.285 19.957 675 HA SER 93 HA SER 93 39.089 43.069 19.763 676 HB2 SER 93 HB2 SER 93 36.621 41.842 18.512 677 HB3 SER 93 HB3 SER 93 37.480 43.313 18.033 678 HG SER 93 HG SER 93 39.357 41.730 17.769 679 H GLU 94 H GLU 94 36.908 41.418 21.842 680 HA GLU 94 HA GLU 94 35.604 44.006 22.639 681 HB2 GLU 94 HB2 GLU 94 34.384 41.226 22.716 682 HB3 GLU 94 HB3 GLU 94 33.657 42.726 23.314 683 HG2 GLU 94 HG2 GLU 94 33.843 43.648 20.951 684 HG3 GLU 94 HG3 GLU 94 34.306 42.026 20.421 685 H TYR 95 H TYR 95 37.386 44.397 24.108 686 HA TYR 95 HA TYR 95 37.651 42.410 26.331 687 HB2 TYR 95 HB2 TYR 95 40.035 42.918 26.382 688 HB3 TYR 95 HB3 TYR 95 39.506 42.166 24.892 689 HD1 TYR 95 HD1 TYR 95 39.307 43.514 22.783 690 HD2 TYR 95 HD2 TYR 95 41.198 45.050 26.336 691 HE1 TYR 95 HE1 TYR 95 40.394 45.290 21.429 692 HE2 TYR 95 HE2 TYR 95 42.343 46.793 24.962 693 HH TYR 95 HH TYR 95 41.749 47.151 21.449 694 H GLU 96 H GLU 96 37.860 43.029 28.372 695 HA GLU 96 HA GLU 96 36.841 45.704 29.036 696 HB2 GLU 96 HB2 GLU 96 37.438 43.324 30.835 697 HB3 GLU 96 HB3 GLU 96 36.509 44.766 31.259 698 HG2 GLU 96 HG2 GLU 96 34.839 44.166 29.481 699 HG3 GLU 96 HG3 GLU 96 35.714 42.644 29.223 700 H GLU 97 H GLU 97 39.730 45.174 28.231 701 HA GLU 97 HA GLU 97 41.231 45.840 30.725 702 HB2 GLU 97 HB2 GLU 97 41.448 43.877 28.553 703 HB3 GLU 97 HB3 GLU 97 42.934 44.764 28.726 704 HG2 GLU 97 HG2 GLU 97 41.491 43.414 31.048 705 HG3 GLU 97 HG3 GLU 97 42.728 42.637 30.063 706 H GLY 98 H GLY 98 40.372 47.410 27.886 707 HA2 GLY 98 HA2 GLY 98 42.896 48.680 27.187 708 HA3 GLY 98 HA3 GLY 98 41.294 49.049 26.541 709 H VAL 99 H VAL 99 41.634 49.121 29.982 710 HA VAL 99 HA VAL 99 41.148 50.654 31.501 711 HB VAL 99 HB VAL 99 42.691 52.468 31.855 712 HG11 VAL 99 HG11 VAL 99 44.072 49.934 30.891 713 HG12 VAL 99 HG12 VAL 99 44.700 51.120 32.051 714 HG13 VAL 99 HG13 VAL 99 43.278 50.155 32.466 715 HG21 VAL 99 HG21 VAL 99 44.013 51.768 29.206 716 HG22 VAL 99 HG22 VAL 99 43.013 53.209 29.468 717 HG23 VAL 99 HG23 VAL 99 44.512 52.997 30.385 718 H ILE 100 H ILE 100 39.445 50.852 29.182 719 HA ILE 100 HA ILE 100 38.247 53.513 29.795 720 HB ILE 100 HB ILE 100 37.312 53.608 27.541 721 HG12 ILE 100 HG12 ILE 100 39.151 51.276 26.837 722 HG13 ILE 100 HG13 ILE 100 37.396 51.177 26.991 723 HG21 ILE 100 HG21 ILE 100 39.429 54.780 28.193 724 HG22 ILE 100 HG22 ILE 100 40.351 53.449 27.472 725 HG23 ILE 100 HG23 ILE 100 39.299 54.462 26.463 726 HD11 ILE 100 HD11 ILE 100 38.920 52.792 24.912 727 HD12 ILE 100 HD12 ILE 100 37.958 51.328 24.658 728 HD13 ILE 100 HD13 ILE 100 37.152 52.834 25.139 729 H ARG 101 H ARG 101 35.988 53.644 29.740 730 HA ARG 101 HA ARG 101 34.339 51.192 29.925 731 HB2 ARG 101 HB2 ARG 101 33.626 51.824 32.251 732 HB3 ARG 101 HB3 ARG 101 35.270 51.206 32.118 733 HG2 ARG 101 HG2 ARG 101 36.196 53.489 32.251 734 HG3 ARG 101 HG3 ARG 101 34.569 54.165 32.325 735 HD2 ARG 101 HD2 ARG 101 35.828 52.294 34.368 736 HD3 ARG 101 HD3 ARG 101 35.712 54.047 34.530 737 HE ARG 101 HE ARG 101 33.663 52.115 35.122 738 HH11 ARG 101 HH11 ARG 101 33.916 55.436 33.982 739 HH12 ARG 101 HH12 ARG 101 32.306 55.780 34.547 740 HH21 ARG 101 HH21 ARG 101 31.805 52.720 35.971 741 HH22 ARG 101 HH22 ARG 101 31.282 54.396 35.871 Start of MODEL 5 1 H GLY 1 H1 GLY 1 52.577 47.709 40.393 2 HA2 GLY 1 HA2 GLY 1 52.207 49.295 38.617 3 HA3 GLY 1 HA3 GLY 1 52.349 50.590 39.833 4 H ALA 2 H ALA 2 54.040 51.142 38.123 5 HA ALA 2 HA ALA 2 56.159 51.471 37.495 6 HB1 ALA 2 HB1 ALA 2 57.043 50.224 40.116 7 HB2 ALA 2 HB2 ALA 2 57.922 51.381 39.099 8 HB3 ALA 2 HB3 ALA 2 56.454 51.889 39.947 9 H ALA 3 H ALA 3 58.440 50.325 37.208 10 HA ALA 3 HA ALA 3 59.572 48.881 35.944 11 HB1 ALA 3 HB1 ALA 3 59.652 46.577 36.698 12 HB2 ALA 3 HB2 ALA 3 59.500 47.668 38.085 13 HB3 ALA 3 HB3 ALA 3 58.086 46.754 37.513 14 H ALA 4 H ALA 4 56.656 49.482 34.954 15 HA ALA 4 HA ALA 4 56.058 47.311 33.114 16 HB1 ALA 4 HB1 ALA 4 55.047 50.185 33.262 17 HB2 ALA 4 HB2 ALA 4 54.328 48.875 32.305 18 HB3 ALA 4 HB3 ALA 4 54.310 48.792 34.076 19 H GLY 5 H GLY 5 58.154 50.061 33.017 20 HA2 GLY 5 HA2 GLY 5 58.114 50.776 30.320 21 HA3 GLY 5 HA3 GLY 5 59.406 51.115 31.466 22 H VAL 6 H VAL 6 58.979 47.777 30.958 23 HA VAL 6 HA VAL 6 61.367 47.559 29.233 24 HB VAL 6 HB VAL 6 61.174 46.241 31.276 25 HG11 VAL 6 HG11 VAL 6 58.821 45.756 31.396 26 HG12 VAL 6 HG12 VAL 6 58.880 44.787 29.915 27 HG13 VAL 6 HG13 VAL 6 59.732 44.245 31.378 28 HG21 VAL 6 HG21 VAL 6 62.663 45.504 29.519 29 HG22 VAL 6 HG22 VAL 6 61.985 44.139 30.412 30 HG23 VAL 6 HG23 VAL 6 61.386 44.511 28.793 31 H SER 7 H SER 7 59.178 48.834 28.051 32 HA SER 7 HA SER 7 57.271 47.305 26.756 33 HB2 SER 7 HB2 SER 7 58.481 49.941 25.848 34 HB3 SER 7 HB3 SER 7 56.938 49.262 25.298 35 HG SER 7 HG SER 7 56.050 49.573 27.232 36 H ALA 8 H ALA 8 56.919 46.445 24.796 37 HA ALA 8 HA ALA 8 59.172 45.125 23.656 38 HB1 ALA 8 HB1 ALA 8 57.027 44.048 24.210 39 HB2 ALA 8 HB2 ALA 8 56.210 45.029 22.967 40 HB3 ALA 8 HB3 ALA 8 57.420 43.832 22.495 41 H ALA 9 H ALA 9 59.476 44.656 21.451 42 HA ALA 9 HA ALA 9 58.762 46.748 19.446 43 HB1 ALA 9 HB1 ALA 9 60.931 44.611 19.375 44 HB2 ALA 9 HB2 ALA 9 60.475 45.651 18.014 45 HB3 ALA 9 HB3 ALA 9 61.168 46.365 19.485 46 H GLY 10 H GLY 10 57.486 46.123 17.731 47 HA2 GLY 10 HA2 GLY 10 55.883 44.877 16.596 48 HA3 GLY 10 HA3 GLY 10 56.407 43.419 17.432 49 H ILE 11 H ILE 11 54.282 42.831 17.888 50 HA ILE 11 HA ILE 11 52.641 44.539 19.701 51 HB ILE 11 HB ILE 11 50.836 42.951 19.270 52 HG12 ILE 11 HG12 ILE 11 52.673 41.656 17.205 53 HG13 ILE 11 HG13 ILE 11 52.237 40.939 18.758 54 HG21 ILE 11 HG21 ILE 11 50.297 43.778 17.058 55 HG22 ILE 11 HG22 ILE 11 51.171 45.036 17.931 56 HG23 ILE 11 HG23 ILE 11 52.009 44.075 16.691 57 HD11 ILE 11 HD11 ILE 11 50.837 39.957 17.093 58 HD12 ILE 11 HD12 ILE 11 49.830 41.023 18.087 59 HD13 ILE 11 HD13 ILE 11 50.350 41.537 16.459 60 H GLU 12 H GLU 12 54.640 41.734 19.692 61 HA GLU 12 HA GLU 12 55.360 40.292 21.198 62 HB2 GLU 12 HB2 GLU 12 55.322 42.494 22.637 63 HB3 GLU 12 HB3 GLU 12 54.004 41.706 23.486 64 HG2 GLU 12 HG2 GLU 12 55.984 41.356 24.730 65 HG3 GLU 12 HG3 GLU 12 55.572 39.807 24.027 66 HA PRO 13 HA PRO 13 52.234 37.233 21.220 67 HB2 PRO 13 HB2 PRO 13 53.676 35.966 23.552 68 HB3 PRO 13 HB3 PRO 13 53.022 35.195 22.070 69 HG2 PRO 13 HG2 PRO 13 55.651 35.740 22.197 70 HG3 PRO 13 HG3 PRO 13 54.744 36.178 20.710 71 HD2 PRO 13 HD2 PRO 13 55.515 37.947 23.031 72 HD3 PRO 13 HD3 PRO 13 55.700 38.254 21.283 73 H ASP 14 H ASP 14 50.181 37.064 22.001 74 HA ASP 14 HA ASP 14 49.397 38.969 23.976 75 HB2 ASP 14 HB2 ASP 14 47.914 36.896 22.351 76 HB3 ASP 14 HB3 ASP 14 47.088 37.845 23.586 77 H LEU 15 H LEU 15 50.178 35.584 24.477 78 HA LEU 15 HA LEU 15 48.861 35.172 26.936 79 HB2 LEU 15 HB2 LEU 15 50.342 33.556 25.578 80 HB3 LEU 15 HB3 LEU 15 51.730 34.360 26.321 81 HG LEU 15 HG LEU 15 50.854 33.691 28.574 82 HD11 LEU 15 HD11 LEU 15 48.461 33.415 28.151 83 HD12 LEU 15 HD12 LEU 15 49.118 31.841 28.604 84 HD13 LEU 15 HD13 LEU 15 48.785 32.190 26.901 85 HD21 LEU 15 HD21 LEU 15 52.529 32.308 27.510 86 HD22 LEU 15 HD22 LEU 15 51.279 31.433 26.589 87 HD23 LEU 15 HD23 LEU 15 51.371 31.287 28.359 88 H THR 16 H THR 16 51.620 37.262 26.213 89 HA THR 16 HA THR 16 52.421 37.817 28.928 90 HB THR 16 HB THR 16 53.408 39.893 28.058 91 HG1 THR 16 HG1 THR 16 52.451 39.134 25.519 92 HG21 THR 16 HG21 THR 16 54.694 37.813 27.785 93 HG22 THR 16 HG22 THR 16 54.998 38.957 26.470 94 HG23 THR 16 HG23 THR 16 53.952 37.546 26.191 95 H ALA 17 H ALA 17 50.008 39.369 26.802 96 HA ALA 17 HA ALA 17 49.212 41.420 28.637 97 HB1 ALA 17 HB1 ALA 17 47.328 41.715 27.118 98 HB2 ALA 17 HB2 ALA 17 48.853 41.564 26.227 99 HB3 ALA 17 HB3 ALA 17 47.717 40.195 26.293 100 H ILE 18 H ILE 18 47.918 38.157 27.903 101 HA ILE 18 HA ILE 18 45.764 38.187 29.787 102 HB ILE 18 HB ILE 18 47.378 35.876 28.641 103 HG12 ILE 18 HG12 ILE 18 44.634 36.983 27.870 104 HG13 ILE 18 HG13 ILE 18 46.117 37.340 27.005 105 HG21 ILE 18 HG21 ILE 18 44.720 35.806 30.145 106 HG22 ILE 18 HG22 ILE 18 45.461 34.425 29.311 107 HG23 ILE 18 HG23 ILE 18 46.259 35.121 30.707 108 HD11 ILE 18 HD11 ILE 18 44.989 35.656 25.771 109 HD12 ILE 18 HD12 ILE 18 46.398 34.884 26.524 110 HD13 ILE 18 HD13 ILE 18 44.764 34.632 27.193 111 H TRP 19 H TRP 19 49.228 37.186 30.270 112 HA TRP 19 HA TRP 19 48.729 36.369 33.000 113 HB2 TRP 19 HB2 TRP 19 51.246 36.906 31.416 114 HB3 TRP 19 HB3 TRP 19 51.268 36.490 33.125 115 HD1 TRP 19 HD1 TRP 19 48.764 34.715 30.853 116 HE1 TRP 19 HE1 TRP 19 49.365 32.240 30.690 117 HE3 TRP 19 HE3 TRP 19 53.282 34.780 33.277 118 HZ2 TRP 19 HZ2 TRP 19 51.605 30.550 31.253 119 HZ3 TRP 19 HZ3 TRP 19 54.638 32.701 33.418 120 HH2 TRP 19 HH2 TRP 19 53.830 30.597 32.369 121 H GLN 20 H GLN 20 49.924 39.527 31.617 122 HA GLN 20 HA GLN 20 50.095 40.626 34.292 123 HB2 GLN 20 HB2 GLN 20 50.281 42.794 33.315 124 HB3 GLN 20 HB3 GLN 20 51.354 41.662 32.498 125 HG2 GLN 20 HG2 GLN 20 49.952 41.621 30.568 126 HG3 GLN 20 HG3 GLN 20 48.626 42.430 31.395 127 HE21 GLN 20 HE21 GLN 20 51.641 42.931 29.621 128 HE22 GLN 20 HE22 GLN 20 51.724 44.656 29.888 129 H ALA 21 H ALA 21 47.299 40.256 32.115 130 HA ALA 21 HA ALA 21 45.539 41.908 33.669 131 HB1 ALA 21 HB1 ALA 21 43.750 40.703 32.499 132 HB2 ALA 21 HB2 ALA 21 45.027 41.182 31.378 133 HB3 ALA 21 HB3 ALA 21 44.909 39.498 31.912 134 H LEU 22 H LEU 22 46.149 38.362 33.795 135 HA LEU 22 HA LEU 22 44.258 37.922 35.944 136 HB2 LEU 22 HB2 LEU 22 46.461 36.247 34.679 137 HB3 LEU 22 HB3 LEU 22 45.406 35.635 35.947 138 HG LEU 22 HG LEU 22 44.363 36.680 33.270 139 HD11 LEU 22 HD11 LEU 22 44.850 33.849 34.250 140 HD12 LEU 22 HD12 LEU 22 45.790 34.684 32.995 141 HD13 LEU 22 HD13 LEU 22 44.094 34.290 32.697 142 HD21 LEU 22 HD21 LEU 22 43.065 35.123 35.562 143 HD22 LEU 22 HD22 LEU 22 42.322 35.381 33.976 144 HD23 LEU 22 HD23 LEU 22 42.646 36.761 35.011 145 H PHE 23 H PHE 23 47.822 38.206 35.848 146 HA PHE 23 HA PHE 23 47.934 37.700 38.745 147 HB2 PHE 23 HB2 PHE 23 50.174 38.018 36.753 148 HB3 PHE 23 HB3 PHE 23 50.304 37.387 38.375 149 HD1 PHE 23 HD1 PHE 23 51.288 36.068 35.830 150 HD2 PHE 23 HD2 PHE 23 47.573 35.619 37.975 151 HE1 PHE 23 HE1 PHE 23 50.998 33.792 34.881 152 HE2 PHE 23 HE2 PHE 23 47.274 33.376 36.987 153 HZ PHE 23 HZ PHE 23 48.991 32.451 35.447 154 H ALA 24 H ALA 24 47.257 40.446 37.244 155 HA ALA 24 HA ALA 24 47.486 42.633 37.589 156 HB1 ALA 24 HB1 ALA 24 48.142 41.831 40.436 157 HB2 ALA 24 HB2 ALA 24 47.538 43.403 39.894 158 HB3 ALA 24 HB3 ALA 24 46.519 41.962 39.728 159 H LEU 25 H LEU 25 50.108 41.054 37.025 160 HA LEU 25 HA LEU 25 52.310 42.551 37.938 161 HB2 LEU 25 HB2 LEU 25 51.911 41.079 35.305 162 HB3 LEU 25 HB3 LEU 25 53.471 41.577 35.916 163 HG LEU 25 HG LEU 25 51.680 39.655 37.463 164 HD11 LEU 25 HD11 LEU 25 53.005 37.855 36.484 165 HD12 LEU 25 HD12 LEU 25 53.940 39.045 35.553 166 HD13 LEU 25 HD13 LEU 25 52.228 38.779 35.174 167 HD21 LEU 25 HD21 LEU 25 54.680 40.222 37.521 168 HD22 LEU 25 HD22 LEU 25 53.831 39.010 38.503 169 HD23 LEU 25 HD23 LEU 25 53.510 40.732 38.762 170 HA PRO 26 HA PRO 26 52.254 46.130 35.187 171 HB2 PRO 26 HB2 PRO 26 54.843 46.944 35.308 172 HB3 PRO 26 HB3 PRO 26 53.717 47.072 36.690 173 HG2 PRO 26 HG2 PRO 26 55.822 44.956 36.161 174 HG3 PRO 26 HG3 PRO 26 55.483 45.824 37.691 175 HD2 PRO 26 HD2 PRO 26 54.492 43.320 37.148 176 HD3 PRO 26 HD3 PRO 26 53.616 44.513 38.147 177 H ALA 27 H ALA 27 54.889 43.740 34.591 178 HA ALA 27 HA ALA 27 54.198 43.542 31.772 179 HB1 ALA 27 HB1 ALA 27 56.460 44.216 30.956 180 HB2 ALA 27 HB2 ALA 27 55.584 45.568 31.678 181 HB3 ALA 27 HB3 ALA 27 56.876 44.760 32.598 182 H VAL 28 H VAL 28 55.024 41.737 30.779 183 HA VAL 28 HA VAL 28 57.090 40.033 32.066 184 HB VAL 28 HB VAL 28 55.772 37.994 31.463 185 HG11 VAL 28 HG11 VAL 28 54.364 38.012 33.444 186 HG12 VAL 28 HG12 VAL 28 55.935 38.781 33.789 187 HG13 VAL 28 HG13 VAL 28 54.484 39.781 33.539 188 HG21 VAL 28 HG21 VAL 28 53.368 39.868 31.393 189 HG22 VAL 28 HG22 VAL 28 54.094 39.087 29.971 190 HG23 VAL 28 HG23 VAL 28 53.361 38.102 31.255 191 H GLY 29 H GLY 29 57.960 38.360 30.604 192 HA2 GLY 29 HA2 GLY 29 57.709 38.451 27.776 193 HA3 GLY 29 HA3 GLY 29 58.953 39.605 28.251 194 H ARG 30 H ARG 30 60.901 38.866 29.070 195 HA ARG 30 HA ARG 30 61.532 35.961 28.620 196 HB2 ARG 30 HB2 ARG 30 62.827 38.405 27.368 197 HB3 ARG 30 HB3 ARG 30 63.464 36.767 27.228 198 HG2 ARG 30 HG2 ARG 30 61.471 36.023 26.046 199 HG3 ARG 30 HG3 ARG 30 60.707 37.603 26.260 200 HD2 ARG 30 HD2 ARG 30 62.589 38.639 24.944 201 HD3 ARG 30 HD3 ARG 30 63.186 37.020 24.605 202 HE ARG 30 HE ARG 30 61.449 36.722 23.037 203 HH11 ARG 30 HH11 ARG 30 60.672 39.593 24.954 204 HH12 ARG 30 HH12 ARG 30 59.410 40.052 23.832 205 HH21 ARG 30 HH21 ARG 30 59.746 37.301 21.816 206 HH22 ARG 30 HH22 ARG 30 58.832 38.776 22.196 207 H HIS 31 H HIS 31 61.780 38.171 31.022 208 HA HIS 31 HA HIS 31 64.466 37.152 31.874 209 HB2 HIS 31 HB2 HIS 31 63.282 39.820 31.930 210 HB3 HIS 31 HB3 HIS 31 63.775 39.312 33.534 211 HD1 HIS 31 HD1 HIS 31 66.498 37.795 32.913 212 HD2 HIS 31 HD2 HIS 31 65.195 41.423 31.203 213 HE1 HIS 31 HE1 HIS 31 68.595 39.064 32.241 214 H GLN 32 H GLN 32 61.109 37.448 33.047 215 HA GLN 32 HA GLN 32 61.927 35.751 35.367 216 HB2 GLN 32 HB2 GLN 32 61.074 38.198 35.682 217 HB3 GLN 32 HB3 GLN 32 59.477 37.513 35.399 218 HG2 GLN 32 HG2 GLN 32 59.803 35.959 37.309 219 HG3 GLN 32 HG3 GLN 32 61.487 36.464 37.435 220 HE21 GLN 32 HE21 GLN 32 61.002 36.787 39.690 221 HE22 GLN 32 HE22 GLN 32 60.277 38.318 40.187 222 H ASP 33 H ASP 33 60.492 34.162 36.172 223 HA ASP 33 HA ASP 33 59.181 32.719 33.909 224 HB2 ASP 33 HB2 ASP 33 60.817 31.618 36.215 225 HB3 ASP 33 HB3 ASP 33 60.265 30.749 34.800 226 H PHE 34 H PHE 34 57.559 31.093 34.400 227 HA PHE 34 HA PHE 34 55.489 31.946 36.029 228 HB2 PHE 34 HB2 PHE 34 55.239 30.404 34.183 229 HB3 PHE 34 HB3 PHE 34 56.088 29.141 35.062 230 HD1 PHE 34 HD1 PHE 34 54.947 27.824 36.788 231 HD2 PHE 34 HD2 PHE 34 52.948 31.190 34.975 232 HE1 PHE 34 HE1 PHE 34 52.796 27.078 37.756 233 HE2 PHE 34 HE2 PHE 34 50.801 30.435 35.938 234 HZ PHE 34 HZ PHE 34 50.719 28.373 37.333 235 H PHE 35 H PHE 35 58.108 29.807 37.165 236 HA PHE 35 HA PHE 35 56.783 28.887 39.521 237 HB2 PHE 35 HB2 PHE 35 59.747 29.330 39.052 238 HB3 PHE 35 HB3 PHE 35 59.027 28.300 40.285 239 HD1 PHE 35 HD1 PHE 35 57.127 26.593 39.173 240 HD2 PHE 35 HD2 PHE 35 60.662 28.127 37.237 241 HE1 PHE 35 HE1 PHE 35 57.033 24.735 37.538 242 HE2 PHE 35 HE2 PHE 35 60.568 26.247 35.610 243 HZ PHE 35 HZ PHE 35 58.739 24.572 35.736 244 H ALA 36 H ALA 36 58.330 31.966 38.820 245 HA ALA 36 HA ALA 36 57.596 33.043 41.502 246 HB1 ALA 36 HB1 ALA 36 59.758 33.739 40.650 247 HB2 ALA 36 HB2 ALA 36 59.064 34.167 39.074 248 HB3 ALA 36 HB3 ALA 36 58.650 35.115 40.503 249 H LEU 37 H LEU 37 56.987 33.741 38.017 250 HA LEU 37 HA LEU 37 55.228 35.880 38.493 251 HB2 LEU 37 HB2 LEU 37 55.542 34.080 36.058 252 HB3 LEU 37 HB3 LEU 37 54.576 35.540 36.062 253 HG LEU 37 HG LEU 37 57.589 35.426 36.512 254 HD11 LEU 37 HD11 LEU 37 57.567 36.584 34.279 255 HD12 LEU 37 HD12 LEU 37 55.827 36.282 34.178 256 HD13 LEU 37 HD13 LEU 37 56.963 34.919 34.222 257 HD21 LEU 37 HD21 LEU 37 57.429 37.920 36.220 258 HD22 LEU 37 HD22 LEU 37 56.708 37.341 37.720 259 HD23 LEU 37 HD23 LEU 37 55.670 37.783 36.347 260 H GLY 38 H GLY 38 54.374 32.458 38.312 261 HA2 GLY 38 HA2 GLY 38 51.537 32.833 37.845 262 HA3 GLY 38 HA3 GLY 38 52.328 31.395 38.517 263 H GLY 39 H GLY 39 53.564 32.879 40.757 264 HA2 GLY 39 HA2 GLY 39 53.213 33.686 42.854 265 HA3 GLY 39 HA3 GLY 39 51.721 34.408 42.267 266 H ASP 40 H ASP 40 50.286 31.973 41.682 267 HA ASP 40 HA ASP 40 50.036 30.577 44.296 268 HB2 ASP 40 HB2 ASP 40 48.517 32.805 43.865 269 HB3 ASP 40 HB3 ASP 40 47.554 31.646 42.980 270 H SER 41 H SER 41 48.844 28.602 44.195 271 HA SER 41 HA SER 41 48.685 27.178 41.645 272 HB2 SER 41 HB2 SER 41 47.531 25.465 42.987 273 HB3 SER 41 HB3 SER 41 49.027 26.002 43.783 274 HG SER 41 HG SER 41 47.309 25.924 45.258 275 H GLN 42 H GLN 42 46.328 28.858 43.738 276 HA GLN 42 HA GLN 42 44.004 28.383 42.179 277 HB2 GLN 42 HB2 GLN 42 44.784 30.842 43.818 278 HB3 GLN 42 HB3 GLN 42 43.167 30.524 43.205 279 HG2 GLN 42 HG2 GLN 42 44.668 28.754 45.178 280 HG3 GLN 42 HG3 GLN 42 43.435 29.935 45.590 281 HE21 GLN 42 HE21 GLN 42 43.077 27.350 46.421 282 HE22 GLN 42 HE22 GLN 42 41.750 26.637 45.492 283 H LEU 43 H LEU 43 46.483 30.900 41.792 284 HA LEU 43 HA LEU 43 45.276 32.260 39.554 285 HB2 LEU 43 HB2 LEU 43 47.986 32.205 40.874 286 HB3 LEU 43 HB3 LEU 43 47.877 32.812 39.247 287 HG LEU 43 HG LEU 43 46.320 34.524 39.845 288 HD11 LEU 43 HD11 LEU 43 46.403 33.582 42.725 289 HD12 LEU 43 HD12 LEU 43 45.004 33.452 41.630 290 HD13 LEU 43 HD13 LEU 43 45.625 35.032 42.091 291 HD21 LEU 43 HD21 LEU 43 48.608 34.457 41.837 292 HD22 LEU 43 HD22 LEU 43 47.728 35.903 41.296 293 HD23 LEU 43 HD23 LEU 43 48.715 34.984 40.146 294 H GLY 44 H GLY 44 47.775 29.656 39.746 295 HA2 GLY 44 HA2 GLY 44 48.124 29.259 36.961 296 HA3 GLY 44 HA3 GLY 44 48.331 28.024 38.215 297 H LEU 45 H LEU 45 45.788 27.585 39.152 298 HA LEU 45 HA LEU 45 44.579 26.005 37.090 299 HB2 LEU 45 HB2 LEU 45 43.864 26.738 39.927 300 HB3 LEU 45 HB3 LEU 45 42.600 26.102 38.885 301 HG LEU 45 HG LEU 45 43.952 24.098 38.378 302 HD11 LEU 45 HD11 LEU 45 45.819 25.089 40.575 303 HD12 LEU 45 HD12 LEU 45 46.237 24.939 38.857 304 HD13 LEU 45 HD13 LEU 45 45.861 23.496 39.801 305 HD21 LEU 45 HD21 LEU 45 43.478 24.625 41.341 306 HD22 LEU 45 HD22 LEU 45 43.620 23.023 40.566 307 HD23 LEU 45 HD23 LEU 45 42.264 24.081 40.163 308 H ARG 46 H ARG 46 43.390 29.148 38.492 309 HA ARG 46 HA ARG 46 41.151 29.186 36.666 310 HB2 ARG 46 HB2 ARG 46 40.562 31.252 37.567 311 HB3 ARG 46 HB3 ARG 46 41.292 30.352 38.881 312 HG2 ARG 46 HG2 ARG 46 43.416 31.680 38.508 313 HG3 ARG 46 HG3 ARG 46 42.598 32.577 37.231 314 HD2 ARG 46 HD2 ARG 46 42.618 33.838 39.314 315 HD3 ARG 46 HD3 ARG 46 40.968 33.468 38.795 316 HE ARG 46 HE ARG 46 41.337 31.430 40.498 317 HH11 ARG 46 HH11 ARG 46 42.208 34.809 41.115 318 HH12 ARG 46 HH12 ARG 46 41.949 34.545 42.838 319 HH21 ARG 46 HH21 ARG 46 40.910 31.357 42.609 320 HH22 ARG 46 HH22 ARG 46 41.276 32.761 43.626 321 H MET 47 H MET 47 44.419 30.469 36.364 322 HA MET 47 HA MET 47 44.072 31.852 33.877 323 HB2 MET 47 HB2 MET 47 46.113 32.063 35.264 324 HB3 MET 47 HB3 MET 47 46.480 30.362 35.009 325 HG2 MET 47 HG2 MET 47 46.229 31.452 32.398 326 HG3 MET 47 HG3 MET 47 47.038 32.689 33.339 327 HE1 MET 47 HE1 MET 47 48.720 28.440 32.524 328 HE2 MET 47 HE2 MET 47 47.389 28.653 33.672 329 HE3 MET 47 HE3 MET 47 47.151 29.042 31.949 330 H LEU 48 H LEU 48 44.972 28.389 34.553 331 HA LEU 48 HA LEU 48 45.093 27.708 31.798 332 HB2 LEU 48 HB2 LEU 48 45.985 26.349 33.698 333 HB3 LEU 48 HB3 LEU 48 44.348 25.895 34.142 334 HG LEU 48 HG LEU 48 45.646 24.195 32.894 335 HD11 LEU 48 HD11 LEU 48 43.148 24.125 32.818 336 HD12 LEU 48 HD12 LEU 48 43.988 23.331 31.471 337 HD13 LEU 48 HD13 LEU 48 43.237 24.894 31.212 338 HD21 LEU 48 HD21 LEU 48 46.826 25.743 31.328 339 HD22 LEU 48 HD22 LEU 48 45.292 25.964 30.438 340 HD23 LEU 48 HD23 LEU 48 46.042 24.377 30.517 341 H ALA 49 H ALA 49 42.341 27.421 34.096 342 HA ALA 49 HA ALA 49 40.547 26.278 32.299 343 HB1 ALA 49 HB1 ALA 49 39.989 28.178 34.636 344 HB2 ALA 49 HB2 ALA 49 38.855 26.994 33.965 345 HB3 ALA 49 HB3 ALA 49 40.319 26.438 34.772 346 H GLN 50 H GLN 50 40.882 29.834 33.031 347 HA GLN 50 HA GLN 50 38.979 30.533 30.981 348 HB2 GLN 50 HB2 GLN 50 39.379 32.772 31.449 349 HB3 GLN 50 HB3 GLN 50 39.497 31.920 32.971 350 HG2 GLN 50 HG2 GLN 50 41.344 33.149 33.299 351 HG3 GLN 50 HG3 GLN 50 42.160 32.010 32.242 352 HE21 GLN 50 HE21 GLN 50 42.356 32.717 29.848 353 HE22 GLN 50 HE22 GLN 50 42.262 34.456 29.526 354 H LEU 51 H LEU 51 42.487 29.975 30.813 355 HA LEU 51 HA LEU 51 42.740 31.035 28.114 356 HB2 LEU 51 HB2 LEU 51 44.613 30.888 29.740 357 HB3 LEU 51 HB3 LEU 51 44.492 29.123 29.692 358 HG LEU 51 HG LEU 51 45.075 29.190 27.242 359 HD11 LEU 51 HD11 LEU 51 45.641 32.136 27.810 360 HD12 LEU 51 HD12 LEU 51 44.394 31.510 26.707 361 HD13 LEU 51 HD13 LEU 51 46.099 31.250 26.339 362 HD21 LEU 51 HD21 LEU 51 47.047 30.502 29.154 363 HD22 LEU 51 HD22 LEU 51 47.460 29.699 27.619 364 HD23 LEU 51 HD23 LEU 51 46.775 28.756 28.951 365 H ARG 52 H ARG 52 41.950 27.811 29.466 366 HA ARG 52 HA ARG 52 41.876 26.384 26.974 367 HB2 ARG 52 HB2 ARG 52 41.844 25.280 29.179 368 HB3 ARG 52 HB3 ARG 52 40.248 25.955 29.514 369 HG2 ARG 52 HG2 ARG 52 39.305 24.735 27.571 370 HG3 ARG 52 HG3 ARG 52 40.908 24.058 27.219 371 HD2 ARG 52 HD2 ARG 52 40.902 22.886 29.383 372 HD3 ARG 52 HD3 ARG 52 39.365 23.651 29.817 373 HE ARG 52 HE ARG 52 38.860 22.383 27.382 374 HH11 ARG 52 HH11 ARG 52 39.685 21.277 30.620 375 HH12 ARG 52 HH12 ARG 52 39.097 19.655 30.251 376 HH21 ARG 52 HH21 ARG 52 37.869 20.562 27.167 377 HH22 ARG 52 HH22 ARG 52 37.798 19.369 28.458 378 H GLU 53 H GLU 53 39.298 28.177 28.739 379 HA GLU 53 HA GLU 53 37.398 27.879 26.588 380 HB2 GLU 53 HB2 GLU 53 37.596 29.877 28.860 381 HB3 GLU 53 HB3 GLU 53 36.240 29.837 27.712 382 HG2 GLU 53 HG2 GLU 53 35.749 27.515 28.259 383 HG3 GLU 53 HG3 GLU 53 37.137 27.418 29.345 384 H ARG 54 H ARG 54 39.637 30.615 27.241 385 HA ARG 54 HA ARG 54 38.819 32.215 24.998 386 HB2 ARG 54 HB2 ARG 54 41.296 32.130 26.750 387 HB3 ARG 54 HB3 ARG 54 41.141 33.293 25.460 388 HG2 ARG 54 HG2 ARG 54 38.875 33.078 27.459 389 HG3 ARG 54 HG3 ARG 54 40.365 33.867 27.953 390 HD2 ARG 54 HD2 ARG 54 38.830 34.681 25.450 391 HD3 ARG 54 HD3 ARG 54 38.565 35.391 27.041 392 HE ARG 54 HE ARG 54 40.819 36.241 27.086 393 HH11 ARG 54 HH11 ARG 54 39.995 35.045 23.828 394 HH12 ARG 54 HH12 ARG 54 41.365 35.901 23.165 395 HH21 ARG 54 HH21 ARG 54 42.389 37.402 25.994 396 HH22 ARG 54 HH22 ARG 54 42.679 37.034 24.299 397 H HIS 55 H HIS 55 41.395 29.791 25.226 398 HA HIS 55 HA HIS 55 42.158 30.338 22.387 399 HB2 HIS 55 HB2 HIS 55 43.501 31.275 24.409 400 HB3 HIS 55 HB3 HIS 55 44.066 29.626 24.626 401 HD1 HIS 55 HD1 HIS 55 44.994 28.766 21.805 402 HD2 HIS 55 HD2 HIS 55 45.275 32.694 23.282 403 HE1 HIS 55 HE1 HIS 55 46.892 29.887 20.528 404 H GLY 56 H GLY 56 41.205 27.762 24.523 405 HA2 GLY 56 HA2 GLY 56 40.923 25.530 24.081 406 HA3 GLY 56 HA3 GLY 56 41.461 25.812 22.424 407 H VAL 57 H VAL 57 43.059 25.969 25.631 408 HA VAL 57 HA VAL 57 45.426 24.503 24.530 409 HB VAL 57 HB VAL 57 45.146 27.074 26.111 410 HG11 VAL 57 HG11 VAL 57 47.747 25.589 25.609 411 HG12 VAL 57 HG12 VAL 57 47.609 27.270 26.159 412 HG13 VAL 57 HG13 VAL 57 47.019 25.976 27.192 413 HG21 VAL 57 HG21 VAL 57 45.016 27.234 23.637 414 HG22 VAL 57 HG22 VAL 57 46.468 28.018 24.254 415 HG23 VAL 57 HG23 VAL 57 46.578 26.413 23.498 416 H ASP 58 H ASP 58 46.745 23.361 25.931 417 HA ASP 58 HA ASP 58 45.927 22.914 28.774 418 HB2 ASP 58 HB2 ASP 58 47.355 21.088 26.806 419 HB3 ASP 58 HB3 ASP 58 47.595 20.924 28.533 420 H LEU 59 H LEU 59 47.729 22.874 30.262 421 HA LEU 59 HA LEU 59 50.284 24.065 29.247 422 HB2 LEU 59 HB2 LEU 59 49.253 25.524 30.849 423 HB3 LEU 59 HB3 LEU 59 49.049 24.204 32.006 424 HG LEU 59 HG LEU 59 51.468 24.022 32.321 425 HD11 LEU 59 HD11 LEU 59 51.705 26.229 30.227 426 HD12 LEU 59 HD12 LEU 59 52.328 24.567 30.091 427 HD13 LEU 59 HD13 LEU 59 53.019 25.657 31.277 428 HD21 LEU 59 HD21 LEU 59 50.215 25.704 33.637 429 HD22 LEU 59 HD22 LEU 59 50.578 26.935 32.404 430 HD23 LEU 59 HD23 LEU 59 51.886 26.204 33.353 431 HA PRO 60 HA PRO 60 51.453 19.752 30.219 432 HB2 PRO 60 HB2 PRO 60 53.791 20.424 28.485 433 HB3 PRO 60 HB3 PRO 60 52.690 19.023 28.402 434 HG2 PRO 60 HG2 PRO 60 52.558 21.032 26.567 435 HG3 PRO 60 HG3 PRO 60 51.081 20.215 27.181 436 HD2 PRO 60 HD2 PRO 60 52.251 22.859 28.075 437 HD3 PRO 60 HD3 PRO 60 50.566 22.429 27.670 438 H LEU 61 H LEU 61 52.617 19.328 32.064 439 HA LEU 61 HA LEU 61 54.167 21.339 33.415 440 HB2 LEU 61 HB2 LEU 61 53.932 18.322 33.768 441 HB3 LEU 61 HB3 LEU 61 54.889 19.340 34.840 442 HG LEU 61 HG LEU 61 51.882 19.627 34.403 443 HD11 LEU 61 HD11 LEU 61 53.497 18.551 36.748 444 HD12 LEU 61 HD12 LEU 61 52.514 17.582 35.634 445 HD13 LEU 61 HD13 LEU 61 51.735 18.757 36.709 446 HD21 LEU 61 HD21 LEU 61 52.799 21.803 35.005 447 HD22 LEU 61 HD22 LEU 61 53.825 21.072 36.262 448 HD23 LEU 61 HD23 LEU 61 52.066 21.114 36.443 449 H ARG 62 H ARG 62 55.120 18.935 31.031 450 HA ARG 62 HA ARG 62 57.988 19.395 31.462 451 HB2 ARG 62 HB2 ARG 62 56.389 17.837 29.414 452 HB3 ARG 62 HB3 ARG 62 58.089 18.179 29.186 453 HG2 ARG 62 HG2 ARG 62 57.967 16.030 30.109 454 HG3 ARG 62 HG3 ARG 62 58.665 17.087 31.329 455 HD2 ARG 62 HD2 ARG 62 56.629 17.045 32.638 456 HD3 ARG 62 HD3 ARG 62 55.729 16.318 31.302 457 HE ARG 62 HE ARG 62 56.734 14.219 31.654 458 HH11 ARG 62 HH11 ARG 62 57.990 16.404 34.174 459 HH12 ARG 62 HH12 ARG 62 58.446 15.002 35.132 460 HH21 ARG 62 HH21 ARG 62 57.429 12.679 32.908 461 HH22 ARG 62 HH22 ARG 62 58.197 13.039 34.466 462 H CYS 63 H CYS 63 55.542 20.854 29.302 463 HA CYS 63 HA CYS 63 57.347 22.557 27.796 464 HB2 CYS 63 HB2 CYS 63 55.096 22.574 26.931 465 HB3 CYS 63 HB3 CYS 63 54.417 22.720 28.559 466 HG CYS 63 HG CYS 63 56.073 24.981 26.759 467 H LEU 64 H LEU 64 55.519 23.012 30.830 468 HA LEU 64 HA LEU 64 56.593 25.504 31.580 469 HB2 LEU 64 HB2 LEU 64 54.577 24.183 32.456 470 HB3 LEU 64 HB3 LEU 64 55.704 23.225 33.390 471 HG LEU 64 HG LEU 64 56.451 25.251 34.621 472 HD11 LEU 64 HD11 LEU 64 54.976 27.282 34.417 473 HD12 LEU 64 HD12 LEU 64 54.292 26.605 32.942 474 HD13 LEU 64 HD13 LEU 64 56.021 27.028 33.025 475 HD21 LEU 64 HD21 LEU 64 54.641 23.819 35.490 476 HD22 LEU 64 HD22 LEU 64 53.437 24.783 34.609 477 HD23 LEU 64 HD23 LEU 64 54.379 25.508 35.929 478 H TYR 65 H TYR 65 57.862 22.220 32.312 479 HA TYR 65 HA TYR 65 60.022 23.188 33.939 480 HB2 TYR 65 HB2 TYR 65 59.048 20.920 34.052 481 HB3 TYR 65 HB3 TYR 65 59.722 20.549 32.469 482 HD1 TYR 65 HD1 TYR 65 62.199 20.392 32.162 483 HD2 TYR 65 HD2 TYR 65 60.384 20.853 36.051 484 HE1 TYR 65 HE1 TYR 65 64.318 19.685 33.230 485 HE2 TYR 65 HE2 TYR 65 62.508 20.097 37.123 486 HH TYR 65 HH TYR 65 65.406 19.284 35.171 487 H GLU 66 H GLU 66 59.833 22.557 30.388 488 HA GLU 66 HA GLU 66 62.732 23.027 30.139 489 HB2 GLU 66 HB2 GLU 66 62.534 22.692 27.831 490 HB3 GLU 66 HB3 GLU 66 61.598 21.449 28.648 491 HG2 GLU 66 HG2 GLU 66 59.507 22.662 28.082 492 HG3 GLU 66 HG3 GLU 66 60.445 23.931 27.295 493 H ALA 67 H ALA 67 59.812 24.995 29.655 494 HA ALA 67 HA ALA 67 61.497 27.399 29.165 495 HB1 ALA 67 HB1 ALA 67 60.976 26.331 27.014 496 HB2 ALA 67 HB2 ALA 67 59.243 26.339 27.410 497 HB3 ALA 67 HB3 ALA 67 60.109 27.869 27.174 498 HA PRO 68 HA PRO 68 57.780 28.240 31.920 499 HB2 PRO 68 HB2 PRO 68 58.961 29.114 34.201 500 HB3 PRO 68 HB3 PRO 68 58.888 27.393 33.808 501 HG2 PRO 68 HG2 PRO 68 61.172 29.310 33.179 502 HG3 PRO 68 HG3 PRO 68 61.272 27.765 34.087 503 HD2 PRO 68 HD2 PRO 68 61.834 27.873 31.445 504 HD3 PRO 68 HD3 PRO 68 60.899 26.499 32.107 505 H THR 69 H THR 69 60.157 30.193 30.479 506 HA THR 69 HA THR 69 59.318 32.745 31.673 507 HB THR 69 HB THR 69 61.016 32.792 29.233 508 HG1 THR 69 HG1 THR 69 61.997 31.723 31.690 509 HG21 THR 69 HG21 THR 69 61.432 33.873 32.045 510 HG22 THR 69 HG22 THR 69 60.554 34.751 30.765 511 HG23 THR 69 HG23 THR 69 62.276 34.374 30.569 512 H VAL 70 H VAL 70 57.871 34.207 30.764 513 HA VAL 70 HA VAL 70 55.787 32.936 29.587 514 HB VAL 70 HB VAL 70 56.122 35.956 29.372 515 HG11 VAL 70 HG11 VAL 70 54.109 35.094 28.201 516 HG12 VAL 70 HG12 VAL 70 53.660 34.160 29.644 517 HG13 VAL 70 HG13 VAL 70 53.646 35.931 29.684 518 HG21 VAL 70 HG21 VAL 70 54.885 35.830 31.633 519 HG22 VAL 70 HG22 VAL 70 55.399 34.131 31.664 520 HG23 VAL 70 HG23 VAL 70 56.606 35.422 31.644 521 H ALA 71 H ALA 71 57.874 35.179 27.651 522 HA ALA 71 HA ALA 71 56.344 34.739 25.247 523 HB1 ALA 71 HB1 ALA 71 58.237 35.845 24.134 524 HB2 ALA 71 HB2 ALA 71 57.780 36.716 25.613 525 HB3 ALA 71 HB3 ALA 71 59.219 35.668 25.602 526 H ARG 72 H ARG 72 58.974 32.895 26.734 527 HA ARG 72 HA ARG 72 59.593 31.332 24.308 528 HB2 ARG 72 HB2 ARG 72 60.461 31.164 27.225 529 HB3 ARG 72 HB3 ARG 72 60.778 29.859 26.093 530 HG2 ARG 72 HG2 ARG 72 62.694 31.326 26.321 531 HG3 ARG 72 HG3 ARG 72 62.096 31.265 24.659 532 HD2 ARG 72 HD2 ARG 72 61.020 33.471 24.951 533 HD3 ARG 72 HD3 ARG 72 61.539 33.501 26.644 534 HE ARG 72 HE ARG 72 63.781 33.829 25.984 535 HH11 ARG 72 HH11 ARG 72 61.799 33.607 23.006 536 HH12 ARG 72 HH12 ARG 72 62.978 34.603 22.179 537 HH21 ARG 72 HH21 ARG 72 65.182 34.975 24.669 538 HH22 ARG 72 HH22 ARG 72 64.733 35.232 22.983 539 H LEU 73 H LEU 73 57.787 30.819 27.327 540 HA LEU 73 HA LEU 73 56.753 28.242 26.800 541 HB2 LEU 73 HB2 LEU 73 56.654 29.646 28.914 542 HB3 LEU 73 HB3 LEU 73 55.375 30.587 28.219 543 HG LEU 73 HG LEU 73 54.898 27.651 28.087 544 HD11 LEU 73 HD11 LEU 73 54.972 29.059 30.786 545 HD12 LEU 73 HD12 LEU 73 55.994 27.700 30.263 546 HD13 LEU 73 HD13 LEU 73 54.263 27.455 30.468 547 HD21 LEU 73 HD21 LEU 73 53.236 29.956 29.170 548 HD22 LEU 73 HD22 LEU 73 52.661 28.313 28.801 549 HD23 LEU 73 HD23 LEU 73 53.198 29.379 27.491 550 H ALA 74 H ALA 74 55.251 31.447 26.109 551 HA ALA 74 HA ALA 74 53.049 30.557 24.607 552 HB1 ALA 74 HB1 ALA 74 54.680 33.110 24.254 553 HB2 ALA 74 HB2 ALA 74 52.995 32.845 23.748 554 HB3 ALA 74 HB3 ALA 74 53.416 32.848 25.472 555 H GLU 75 H GLU 75 56.398 31.282 23.417 556 HA GLU 75 HA GLU 75 55.821 30.726 20.651 557 HB2 GLU 75 HB2 GLU 75 58.363 30.759 22.288 558 HB3 GLU 75 HB3 GLU 75 58.355 30.132 20.638 559 HG2 GLU 75 HG2 GLU 75 57.415 32.303 19.846 560 HG3 GLU 75 HG3 GLU 75 57.621 32.955 21.472 561 H THR 76 H THR 76 56.882 28.484 23.302 562 HA THR 76 HA THR 76 57.015 26.215 21.529 563 HB THR 76 HB THR 76 56.878 24.745 23.413 564 HG1 THR 76 HG1 THR 76 56.087 26.999 24.842 565 HG21 THR 76 HG21 THR 76 59.053 25.715 22.891 566 HG22 THR 76 HG22 THR 76 58.873 25.416 24.628 567 HG23 THR 76 HG23 THR 76 58.734 27.063 23.999 568 H ILE 77 H ILE 77 54.254 27.353 23.578 569 HA ILE 77 HA ILE 77 52.568 25.198 22.730 570 HB ILE 77 HB ILE 77 51.871 27.919 23.879 571 HG12 ILE 77 HG12 ILE 77 53.249 26.587 25.410 572 HG13 ILE 77 HG13 ILE 77 51.617 26.748 26.011 573 HG21 ILE 77 HG21 ILE 77 50.090 25.474 23.480 574 HG22 ILE 77 HG22 ILE 77 49.700 26.834 24.552 575 HG23 ILE 77 HG23 ILE 77 49.861 27.104 22.816 576 HD11 ILE 77 HD11 ILE 77 52.803 24.253 24.718 577 HD12 ILE 77 HD12 ILE 77 52.439 24.513 26.429 578 HD13 ILE 77 HD13 ILE 77 51.114 24.411 25.268 579 H VAL 78 H VAL 78 53.145 28.441 21.309 580 HA VAL 78 HA VAL 78 51.110 28.231 19.263 581 HB VAL 78 HB VAL 78 53.523 30.016 19.616 582 HG11 VAL 78 HG11 VAL 78 53.264 29.861 17.187 583 HG12 VAL 78 HG12 VAL 78 51.510 30.138 17.331 584 HG13 VAL 78 HG13 VAL 78 52.667 31.413 17.760 585 HG21 VAL 78 HG21 VAL 78 51.785 31.729 19.968 586 HG22 VAL 78 HG22 VAL 78 50.510 30.553 19.596 587 HG23 VAL 78 HG23 VAL 78 51.488 30.374 21.061 588 H ARG 79 H ARG 79 54.607 27.382 19.257 589 HA ARG 79 HA ARG 79 54.449 26.558 16.447 590 HB2 ARG 79 HB2 ARG 79 56.736 26.447 16.439 591 HB3 ARG 79 HB3 ARG 79 56.391 27.748 17.554 592 HG2 ARG 79 HG2 ARG 79 57.904 26.715 18.893 593 HG3 ARG 79 HG3 ARG 79 56.557 25.676 19.338 594 HD2 ARG 79 HD2 ARG 79 58.407 24.252 18.827 595 HD3 ARG 79 HD3 ARG 79 57.272 24.092 17.481 596 HE ARG 79 HE ARG 79 59.653 25.929 17.402 597 HH11 ARG 79 HH11 ARG 79 58.035 23.231 15.819 598 HH12 ARG 79 HH12 ARG 79 58.892 23.532 14.320 599 HH21 ARG 79 HH21 ARG 79 60.745 26.146 15.650 600 HH22 ARG 79 HH22 ARG 79 60.531 25.075 14.272 601 H LEU 80 H LEU 80 54.183 24.830 19.477 602 HA LEU 80 HA LEU 80 54.163 22.177 18.231 603 HB2 LEU 80 HB2 LEU 80 53.079 23.288 20.854 604 HB3 LEU 80 HB3 LEU 80 52.968 21.595 20.413 605 HG LEU 80 HG LEU 80 55.639 23.042 20.666 606 HD11 LEU 80 HD11 LEU 80 54.458 23.003 22.836 607 HD12 LEU 80 HD12 LEU 80 55.824 21.875 22.834 608 HD13 LEU 80 HD13 LEU 80 54.167 21.259 22.658 609 HD21 LEU 80 HD21 LEU 80 56.539 20.770 20.826 610 HD22 LEU 80 HD22 LEU 80 55.737 21.018 19.275 611 HD23 LEU 80 HD23 LEU 80 54.918 20.090 20.556 612 H ALA 81 H ALA 81 52.094 24.811 18.058 613 HA ALA 81 HA ALA 81 50.134 25.308 17.206 614 HB1 ALA 81 HB1 ALA 81 49.212 23.955 15.435 615 HB2 ALA 81 HB2 ALA 81 50.979 23.978 15.325 616 HB3 ALA 81 HB3 ALA 81 50.145 22.550 15.984 617 H ALA 82 H ALA 82 49.931 22.192 18.896 618 HA ALA 82 HA ALA 82 48.449 21.301 20.294 619 HB1 ALA 82 HB1 ALA 82 47.236 22.759 21.828 620 HB2 ALA 82 HB2 ALA 82 48.817 23.449 21.476 621 HB3 ALA 82 HB3 ALA 82 47.367 24.111 20.698 622 HA PRO 83 HA PRO 83 44.983 19.868 18.350 623 HB2 PRO 83 HB2 PRO 83 43.131 20.250 20.691 624 HB3 PRO 83 HB3 PRO 83 43.463 18.769 19.738 625 HG2 PRO 83 HG2 PRO 83 44.649 19.094 22.142 626 HG3 PRO 83 HG3 PRO 83 45.626 18.516 20.750 627 HD2 PRO 83 HD2 PRO 83 45.392 21.344 21.830 628 HD3 PRO 83 HD3 PRO 83 46.858 20.404 21.444 629 H ALA 84 H ALA 84 44.506 23.128 19.140 630 HA ALA 84 HA ALA 84 42.609 23.453 16.924 631 HB1 ALA 84 HB1 ALA 84 40.976 24.726 18.298 632 HB2 ALA 84 HB2 ALA 84 41.061 23.020 18.772 633 HB3 ALA 84 HB3 ALA 84 41.861 24.256 19.767 634 HA PRO 85 HA PRO 85 46.072 26.500 17.373 635 HB2 PRO 85 HB2 PRO 85 45.541 26.664 14.398 636 HB3 PRO 85 HB3 PRO 85 47.105 26.704 15.274 637 HG2 PRO 85 HG2 PRO 85 46.286 24.408 14.107 638 HG3 PRO 85 HG3 PRO 85 46.961 24.357 15.768 639 HD2 PRO 85 HD2 PRO 85 44.060 24.332 14.928 640 HD3 PRO 85 HD3 PRO 85 44.898 23.313 16.134 641 H SER 86 H SER 86 45.544 28.410 18.221 642 HA SER 86 HA SER 86 43.339 30.067 17.050 643 HB2 SER 86 HB2 SER 86 43.771 29.274 19.942 644 HB3 SER 86 HB3 SER 86 42.527 30.388 19.361 645 HG SER 86 HG SER 86 42.813 27.613 18.815 646 H GLY 87 H GLY 87 43.158 32.269 17.946 647 HA2 GLY 87 HA2 GLY 87 45.020 33.491 19.598 648 HA3 GLY 87 HA3 GLY 87 45.675 33.709 17.973 649 H ASP 88 H ASP 88 44.666 35.640 19.937 650 HA ASP 88 HA ASP 88 42.212 36.808 18.995 651 HB2 ASP 88 HB2 ASP 88 44.542 37.971 20.582 652 HB3 ASP 88 HB3 ASP 88 43.013 38.797 20.321 653 H GLN 89 H GLN 89 41.986 38.938 18.045 654 HA GLN 89 HA GLN 89 44.055 39.577 15.975 655 HB2 GLN 89 HB2 GLN 89 42.214 40.344 14.553 656 HB3 GLN 89 HB3 GLN 89 42.200 38.615 14.897 657 HG2 GLN 89 HG2 GLN 89 40.408 39.048 16.635 658 HG3 GLN 89 HG3 GLN 89 40.394 40.749 16.127 659 HE21 GLN 89 HE21 GLN 89 40.098 37.408 14.832 660 HE22 GLN 89 HE22 GLN 89 38.912 37.839 13.601 661 H ASP 90 H ASP 90 44.656 41.714 15.666 662 HA ASP 90 HA ASP 90 43.330 43.830 17.248 663 HB2 ASP 90 HB2 ASP 90 44.988 42.729 18.758 664 HB3 ASP 90 HB3 ASP 90 46.271 43.141 17.625 665 H ASP 91 H ASP 91 43.416 45.761 16.355 666 HA ASP 91 HA ASP 91 44.401 46.162 13.644 667 HB2 ASP 91 HB2 ASP 91 43.132 47.940 15.769 668 HB3 ASP 91 HB3 ASP 91 43.663 48.553 14.200 669 H ALA 92 H ALA 92 45.463 46.953 16.877 670 HA ALA 92 HA ALA 92 47.218 47.919 17.854 671 HB1 ALA 92 HB1 ALA 92 48.751 46.811 15.492 672 HB2 ALA 92 HB2 ALA 92 49.382 47.168 17.112 673 HB3 ALA 92 HB3 ALA 92 48.189 45.878 16.898 674 H SER 93 H SER 93 46.575 49.283 14.816 675 HA SER 93 HA SER 93 47.042 51.148 13.687 676 HB2 SER 93 HB2 SER 93 47.804 52.328 16.364 677 HB3 SER 93 HB3 SER 93 47.659 53.244 14.854 678 HG SER 93 HG SER 93 45.788 53.120 16.321 679 H GLU 94 H GLU 94 48.695 52.466 12.704 680 HA GLU 94 HA GLU 94 50.821 50.863 11.956 681 HB2 GLU 94 HB2 GLU 94 51.642 52.726 10.690 682 HB3 GLU 94 HB3 GLU 94 49.883 52.675 10.603 683 HG2 GLU 94 HG2 GLU 94 49.805 54.505 12.332 684 HG3 GLU 94 HG3 GLU 94 51.571 54.589 12.258 685 H TYR 95 H TYR 95 52.928 50.528 12.465 686 HA TYR 95 HA TYR 95 54.228 52.206 14.566 687 HB2 TYR 95 HB2 TYR 95 54.511 49.802 14.864 688 HB3 TYR 95 HB3 TYR 95 55.138 49.640 13.226 689 HD1 TYR 95 HD1 TYR 95 57.356 50.703 12.606 690 HD2 TYR 95 HD2 TYR 95 55.940 50.527 16.682 691 HE1 TYR 95 HE1 TYR 95 59.663 51.096 13.435 692 HE2 TYR 95 HE2 TYR 95 58.265 50.858 17.497 693 HH TYR 95 HH TYR 95 60.485 50.869 16.866 694 H GLU 96 H GLU 96 55.408 53.864 13.924 695 HA GLU 96 HA GLU 96 55.885 54.207 11.003 696 HB2 GLU 96 HB2 GLU 96 54.161 55.557 12.170 697 HB3 GLU 96 HB3 GLU 96 55.427 56.215 13.213 698 HG2 GLU 96 HG2 GLU 96 56.529 57.209 11.248 699 HG3 GLU 96 HG3 GLU 96 55.294 56.515 10.190 700 H GLU 97 H GLU 97 57.983 53.678 10.546 701 HA GLU 97 HA GLU 97 60.082 55.286 11.975 702 HB2 GLU 97 HB2 GLU 97 60.331 52.792 12.232 703 HB3 GLU 97 HB3 GLU 97 60.546 52.688 10.481 704 HG2 GLU 97 HG2 GLU 97 62.475 54.370 10.761 705 HG3 GLU 97 HG3 GLU 97 62.291 54.163 12.499 706 H GLY 98 H GLY 98 58.976 54.011 8.821 707 HA2 GLY 98 HA2 GLY 98 60.803 55.644 7.242 708 HA3 GLY 98 HA3 GLY 98 59.492 54.625 6.647 709 H VAL 99 H VAL 99 59.855 57.573 8.638 710 HA VAL 99 HA VAL 99 57.320 58.688 8.056 711 HB VAL 99 HB VAL 99 58.278 60.830 8.944 712 HG11 VAL 99 HG11 VAL 99 58.599 59.961 11.237 713 HG12 VAL 99 HG12 VAL 99 57.209 59.238 10.416 714 HG13 VAL 99 HG13 VAL 99 58.722 58.313 10.597 715 HG21 VAL 99 HG21 VAL 99 60.816 59.234 9.435 716 HG22 VAL 99 HG22 VAL 99 60.641 60.560 8.256 717 HG23 VAL 99 HG23 VAL 99 60.445 60.874 9.984 718 H ILE 100 H ILE 100 56.602 60.386 6.841 719 HA ILE 100 HA ILE 100 58.209 61.287 4.511 720 HB ILE 100 HB ILE 100 56.983 59.153 4.041 721 HG12 ILE 100 HG12 ILE 100 56.092 61.461 2.293 722 HG13 ILE 100 HG13 ILE 100 57.725 60.772 2.316 723 HG21 ILE 100 HG21 ILE 100 54.452 60.843 4.186 724 HG22 ILE 100 HG22 ILE 100 54.569 59.142 3.707 725 HG23 ILE 100 HG23 ILE 100 54.931 59.607 5.367 726 HD11 ILE 100 HD11 ILE 100 56.497 59.842 0.456 727 HD12 ILE 100 HD12 ILE 100 56.830 58.568 1.643 728 HD13 ILE 100 HD13 ILE 100 55.204 59.277 1.525 729 H ARG 101 H ARG 101 57.315 63.178 3.391 730 HA ARG 101 HA ARG 101 56.110 65.037 5.412 731 HB2 ARG 101 HB2 ARG 101 58.150 65.460 3.189 732 HB3 ARG 101 HB3 ARG 101 57.412 66.757 4.131 733 HG2 ARG 101 HG2 ARG 101 58.294 65.811 6.213 734 HG3 ARG 101 HG3 ARG 101 59.024 64.479 5.339 735 HD2 ARG 101 HD2 ARG 101 60.627 66.295 5.973 736 HD3 ARG 101 HD3 ARG 101 60.596 65.898 4.262 737 HE ARG 101 HE ARG 101 59.117 68.256 5.378 738 HH11 ARG 101 HH11 ARG 101 61.380 67.041 2.922 739 HH12 ARG 101 HH12 ARG 101 61.555 68.673 2.275 740 HH21 ARG 101 HH21 ARG 101 59.301 70.189 4.233 741 HH22 ARG 101 HH22 ARG 101 60.448 70.261 2.900 Start of MODEL 6 1 H GLY 1 H1 GLY 1 47.093 58.801 27.324 2 HA2 GLY 1 HA2 GLY 1 44.880 57.263 28.483 3 HA3 GLY 1 HA3 GLY 1 44.879 58.124 26.926 4 H ALA 2 H ALA 2 44.191 55.398 27.274 5 HA ALA 2 HA ALA 2 45.967 54.182 25.319 6 HB1 ALA 2 HB1 ALA 2 47.181 53.616 27.390 7 HB2 ALA 2 HB2 ALA 2 45.695 52.969 28.109 8 HB3 ALA 2 HB3 ALA 2 46.433 52.164 26.708 9 H ALA 3 H ALA 3 45.057 52.407 24.275 10 HA ALA 3 HA ALA 3 42.220 51.679 24.836 11 HB1 ALA 3 HB1 ALA 3 42.778 52.292 22.517 12 HB2 ALA 3 HB2 ALA 3 44.022 51.031 22.474 13 HB3 ALA 3 HB3 ALA 3 42.319 50.583 22.643 14 H ALA 4 H ALA 4 41.735 49.362 24.881 15 HA ALA 4 HA ALA 4 43.946 47.634 25.924 16 HB1 ALA 4 HB1 ALA 4 42.581 47.060 27.882 17 HB2 ALA 4 HB2 ALA 4 42.911 48.799 27.838 18 HB3 ALA 4 HB3 ALA 4 41.310 48.188 27.356 19 H GLY 5 H GLY 5 40.915 47.846 24.194 20 HA2 GLY 5 HA2 GLY 5 40.453 44.945 24.131 21 HA3 GLY 5 HA3 GLY 5 39.517 46.190 23.307 22 H VAL 6 H VAL 6 40.830 43.604 22.434 23 HA VAL 6 HA VAL 6 42.741 44.509 20.351 24 HB VAL 6 HB VAL 6 42.053 41.693 21.260 25 HG11 VAL 6 HG11 VAL 6 43.009 41.687 18.994 26 HG12 VAL 6 HG12 VAL 6 44.349 42.734 19.536 27 HG13 VAL 6 HG13 VAL 6 44.183 41.083 20.151 28 HG21 VAL 6 HG21 VAL 6 44.286 41.771 22.382 29 HG22 VAL 6 HG22 VAL 6 44.392 43.498 22.004 30 HG23 VAL 6 HG23 VAL 6 43.132 42.892 23.101 31 H SER 7 H SER 7 42.415 44.305 18.241 32 HA SER 7 HA SER 7 40.246 42.656 17.091 33 HB2 SER 7 HB2 SER 7 40.554 45.633 16.557 34 HB3 SER 7 HB3 SER 7 39.705 44.522 15.464 35 HG SER 7 HG SER 7 38.321 43.959 17.128 36 H ALA 8 H ALA 8 42.150 41.387 16.830 37 HA ALA 8 HA ALA 8 44.067 40.582 16.051 38 HB1 ALA 8 HB1 ALA 8 42.684 40.467 14.009 39 HB2 ALA 8 HB2 ALA 8 43.387 42.007 13.468 40 HB3 ALA 8 HB3 ALA 8 44.416 40.579 13.663 41 H ALA 9 H ALA 9 46.252 41.059 14.830 42 HA ALA 9 HA ALA 9 48.276 41.963 15.071 43 HB1 ALA 9 HB1 ALA 9 46.774 44.469 14.256 44 HB2 ALA 9 HB2 ALA 9 48.495 44.121 13.972 45 HB3 ALA 9 HB3 ALA 9 47.252 43.142 13.173 46 H GLY 10 H GLY 10 47.163 41.801 17.682 47 HA2 GLY 10 HA2 GLY 10 48.138 44.175 19.169 48 HA3 GLY 10 HA3 GLY 10 47.461 42.705 19.862 49 H ILE 11 H ILE 11 49.961 44.104 20.605 50 HA ILE 11 HA ILE 11 52.062 42.244 19.609 51 HB ILE 11 HB ILE 11 53.710 43.854 20.234 52 HG12 ILE 11 HG12 ILE 11 51.458 45.759 20.981 53 HG13 ILE 11 HG13 ILE 11 52.503 44.935 22.140 54 HG21 ILE 11 HG21 ILE 11 51.524 45.113 18.526 55 HG22 ILE 11 HG22 ILE 11 53.270 45.390 18.411 56 HG23 ILE 11 HG23 ILE 11 52.608 43.810 17.987 57 HD11 ILE 11 HD11 ILE 11 54.490 46.059 21.131 58 HD12 ILE 11 HD12 ILE 11 53.400 46.965 20.051 59 HD13 ILE 11 HD13 ILE 11 53.302 47.197 21.798 60 H GLU 12 H GLU 12 53.653 41.422 20.852 61 HA GLU 12 HA GLU 12 54.331 39.891 22.302 62 HB2 GLU 12 HB2 GLU 12 52.779 41.321 24.477 63 HB3 GLU 12 HB3 GLU 12 53.936 40.043 24.734 64 HG2 GLU 12 HG2 GLU 12 54.581 42.768 23.534 65 HG3 GLU 12 HG3 GLU 12 54.895 42.258 25.183 66 HA PRO 13 HA PRO 13 51.324 36.748 22.003 67 HB2 PRO 13 HB2 PRO 13 52.141 34.811 23.782 68 HB3 PRO 13 HB3 PRO 13 52.947 35.156 22.222 69 HG2 PRO 13 HG2 PRO 13 53.704 36.169 24.977 70 HG3 PRO 13 HG3 PRO 13 54.772 35.464 23.719 71 HD2 PRO 13 HD2 PRO 13 54.574 38.135 24.033 72 HD3 PRO 13 HD3 PRO 13 54.660 37.430 22.397 73 H ASP 14 H ASP 14 49.414 36.097 22.812 74 HA ASP 14 HA ASP 14 48.054 37.836 24.491 75 HB2 ASP 14 HB2 ASP 14 47.287 34.975 23.803 76 HB3 ASP 14 HB3 ASP 14 46.186 36.225 24.367 77 H LEU 15 H LEU 15 49.720 34.897 25.409 78 HA LEU 15 HA LEU 15 48.727 34.286 27.962 79 HB2 LEU 15 HB2 LEU 15 51.555 34.239 26.764 80 HB3 LEU 15 HB3 LEU 15 51.226 33.784 28.437 81 HG LEU 15 HG LEU 15 49.545 32.107 27.551 82 HD11 LEU 15 HD11 LEU 15 49.976 31.266 25.230 83 HD12 LEU 15 HD12 LEU 15 50.936 32.724 24.916 84 HD13 LEU 15 HD13 LEU 15 49.202 32.841 25.267 85 HD21 LEU 15 HD21 LEU 15 52.485 31.773 26.886 86 HD22 LEU 15 HD22 LEU 15 51.299 30.455 27.005 87 HD23 LEU 15 HD23 LEU 15 51.689 31.426 28.432 88 H THR 16 H THR 16 51.007 36.880 27.072 89 HA THR 16 HA THR 16 51.406 37.835 29.775 90 HB THR 16 HB THR 16 52.444 39.781 28.796 91 HG1 THR 16 HG1 THR 16 51.572 38.788 26.268 92 HG21 THR 16 HG21 THR 16 53.767 37.674 28.799 93 HG22 THR 16 HG22 THR 16 54.218 38.777 27.488 94 HG23 THR 16 HG23 THR 16 53.226 37.345 27.138 95 H ALA 17 H ALA 17 49.196 38.905 27.160 96 HA ALA 17 HA ALA 17 48.126 41.137 28.586 97 HB1 ALA 17 HB1 ALA 17 48.112 40.875 26.129 98 HB2 ALA 17 HB2 ALA 17 46.965 39.523 26.278 99 HB3 ALA 17 HB3 ALA 17 46.490 41.160 26.769 100 H ILE 18 H ILE 18 46.964 37.779 28.188 101 HA ILE 18 HA ILE 18 44.574 38.071 29.749 102 HB ILE 18 HB ILE 18 46.263 35.655 29.006 103 HG12 ILE 18 HG12 ILE 18 43.529 36.537 27.948 104 HG13 ILE 18 HG13 ILE 18 45.027 37.046 27.190 105 HG21 ILE 18 HG21 ILE 18 44.252 34.290 29.648 106 HG22 ILE 18 HG22 ILE 18 45.005 35.072 31.024 107 HG23 ILE 18 HG23 ILE 18 43.513 35.750 30.329 108 HD11 ILE 18 HD11 ILE 18 44.145 35.181 25.965 109 HD12 ILE 18 HD12 ILE 18 45.644 34.678 26.767 110 HD13 ILE 18 HD13 ILE 18 44.064 34.176 27.417 111 H TRP 19 H TRP 19 47.918 36.943 30.714 112 HA TRP 19 HA TRP 19 47.065 36.615 33.454 113 HB2 TRP 19 HB2 TRP 19 49.767 36.644 32.115 114 HB3 TRP 19 HB3 TRP 19 49.592 36.590 33.861 115 HD1 TRP 19 HD1 TRP 19 47.451 34.600 31.320 116 HE1 TRP 19 HE1 TRP 19 47.437 32.141 32.030 117 HE3 TRP 19 HE3 TRP 19 50.970 34.818 35.036 118 HZ2 TRP 19 HZ2 TRP 19 48.780 30.472 33.962 119 HZ3 TRP 19 HZ3 TRP 19 51.623 32.749 36.252 120 HH2 TRP 19 HH2 TRP 19 50.504 30.595 35.763 121 H GLN 20 H GLN 20 48.633 39.454 31.824 122 HA GLN 20 HA GLN 20 48.805 40.896 34.314 123 HB2 GLN 20 HB2 GLN 20 49.594 42.703 33.102 124 HB3 GLN 20 HB3 GLN 20 50.134 41.290 32.194 125 HG2 GLN 20 HG2 GLN 20 47.984 41.675 30.779 126 HG3 GLN 20 HG3 GLN 20 47.957 43.271 31.506 127 HE21 GLN 20 HE21 GLN 20 48.032 43.744 29.139 128 HE22 GLN 20 HE22 GLN 20 49.593 43.867 28.349 129 H ALA 21 H ALA 21 46.110 40.546 31.979 130 HA ALA 21 HA ALA 21 44.424 42.469 33.339 131 HB1 ALA 21 HB1 ALA 21 42.609 41.341 32.111 132 HB2 ALA 21 HB2 ALA 21 43.971 41.779 31.073 133 HB3 ALA 21 HB3 ALA 21 43.749 40.086 31.580 134 H LEU 22 H LEU 22 44.762 38.877 33.724 135 HA LEU 22 HA LEU 22 42.638 38.709 35.671 136 HB2 LEU 22 HB2 LEU 22 44.910 36.838 34.920 137 HB3 LEU 22 HB3 LEU 22 43.611 36.401 36.014 138 HG LEU 22 HG LEU 22 43.052 37.264 33.147 139 HD11 LEU 22 HD11 LEU 22 43.154 34.455 34.274 140 HD12 LEU 22 HD12 LEU 22 44.489 35.179 33.340 141 HD13 LEU 22 HD13 LEU 22 42.907 34.953 32.582 142 HD21 LEU 22 HD21 LEU 22 41.396 35.859 35.284 143 HD22 LEU 22 HD22 LEU 22 40.926 36.022 33.585 144 HD23 LEU 22 HD23 LEU 22 41.104 37.466 34.583 145 H PHE 23 H PHE 23 46.146 39.125 36.002 146 HA PHE 23 HA PHE 23 45.903 39.048 38.913 147 HB2 PHE 23 HB2 PHE 23 47.795 38.086 37.434 148 HB3 PHE 23 HB3 PHE 23 48.395 39.723 37.361 149 HD1 PHE 23 HD1 PHE 23 50.247 37.872 38.181 150 HD2 PHE 23 HD2 PHE 23 47.116 39.498 40.677 151 HE1 PHE 23 HE1 PHE 23 51.564 37.338 40.210 152 HE2 PHE 23 HE2 PHE 23 48.449 38.992 42.676 153 HZ PHE 23 HZ PHE 23 50.670 37.905 42.457 154 H ALA 24 H ALA 24 45.096 41.344 36.734 155 HA ALA 24 HA ALA 24 44.798 43.585 36.733 156 HB1 ALA 24 HB1 ALA 24 43.631 44.328 38.744 157 HB2 ALA 24 HB2 ALA 24 43.173 42.670 38.328 158 HB3 ALA 24 HB3 ALA 24 44.303 42.973 39.670 159 H LEU 25 H LEU 25 47.429 43.410 36.506 160 HA LEU 25 HA LEU 25 48.547 45.436 38.365 161 HB2 LEU 25 HB2 LEU 25 50.630 44.122 38.521 162 HB3 LEU 25 HB3 LEU 25 49.225 43.340 39.211 163 HG LEU 25 HG LEU 25 49.063 41.854 37.220 164 HD11 LEU 25 HD11 LEU 25 50.157 43.043 35.435 165 HD12 LEU 25 HD12 LEU 25 51.119 41.621 35.788 166 HD13 LEU 25 HD13 LEU 25 51.657 43.206 36.385 167 HD21 LEU 25 HD21 LEU 25 51.043 40.495 37.822 168 HD22 LEU 25 HD22 LEU 25 50.260 41.167 39.254 169 HD23 LEU 25 HD23 LEU 25 51.762 41.894 38.640 170 HA PRO 26 HA PRO 26 50.417 47.443 34.938 171 HB2 PRO 26 HB2 PRO 26 52.931 47.836 36.542 172 HB3 PRO 26 HB3 PRO 26 51.886 49.031 35.727 173 HG2 PRO 26 HG2 PRO 26 51.771 48.712 38.409 174 HG3 PRO 26 HG3 PRO 26 50.255 48.890 37.472 175 HD2 PRO 26 HD2 PRO 26 51.619 46.320 38.365 176 HD3 PRO 26 HD3 PRO 26 49.937 46.856 38.649 177 H ALA 27 H ALA 27 50.460 45.628 33.649 178 HA ALA 27 HA ALA 27 51.121 44.163 32.179 179 HB1 ALA 27 HB1 ALA 27 53.015 44.717 30.808 180 HB2 ALA 27 HB2 ALA 27 52.163 46.184 31.312 181 HB3 ALA 27 HB3 ALA 27 53.694 45.730 32.092 182 H VAL 28 H VAL 28 52.161 42.338 31.483 183 HA VAL 28 HA VAL 28 54.040 40.976 33.381 184 HB VAL 28 HB VAL 28 52.097 39.872 31.352 185 HG11 VAL 28 HG11 VAL 28 53.024 37.613 31.858 186 HG12 VAL 28 HG12 VAL 28 54.169 38.617 30.966 187 HG13 VAL 28 HG13 VAL 28 54.381 38.377 32.709 188 HG21 VAL 28 HG21 VAL 28 52.611 39.133 34.272 189 HG22 VAL 28 HG22 VAL 28 51.369 40.277 33.761 190 HG23 VAL 28 HG23 VAL 28 51.269 38.588 33.241 191 H GLY 29 H GLY 29 56.092 40.832 32.814 192 HA2 GLY 29 HA2 GLY 29 57.028 40.705 30.059 193 HA3 GLY 29 HA3 GLY 29 57.185 42.332 30.722 194 H ARG 30 H ARG 30 57.711 40.500 33.411 195 HA ARG 30 HA ARG 30 60.599 40.773 33.364 196 HB2 ARG 30 HB2 ARG 30 58.641 39.281 35.177 197 HB3 ARG 30 HB3 ARG 30 60.369 39.352 35.500 198 HG2 ARG 30 HG2 ARG 30 58.803 41.927 35.110 199 HG3 ARG 30 HG3 ARG 30 58.780 41.086 36.657 200 HD2 ARG 30 HD2 ARG 30 61.161 41.249 36.919 201 HD3 ARG 30 HD3 ARG 30 61.386 41.741 35.239 202 HE ARG 30 HE ARG 30 60.803 43.912 35.732 203 HH11 ARG 30 HH11 ARG 30 59.754 42.023 38.547 204 HH12 ARG 30 HH12 ARG 30 59.395 43.505 39.412 205 HH21 ARG 30 HH21 ARG 30 60.860 45.592 37.147 206 HH22 ARG 30 HH22 ARG 30 60.215 45.373 38.756 207 H HIS 31 H HIS 31 62.218 39.163 33.263 208 HA HIS 31 HA HIS 31 61.504 36.733 31.747 209 HB2 HIS 31 HB2 HIS 31 63.552 38.143 31.298 210 HB3 HIS 31 HB3 HIS 31 64.227 37.514 32.796 211 HD1 HIS 31 HD1 HIS 31 64.728 34.740 32.751 212 HD2 HIS 31 HD2 HIS 31 63.484 36.579 29.167 213 HE1 HIS 31 HE1 HIS 31 65.146 33.058 30.896 214 H GLN 32 H GLN 32 60.004 36.326 33.617 215 HA GLN 32 HA GLN 32 61.257 34.937 35.944 216 HB2 GLN 32 HB2 GLN 32 60.296 37.174 36.400 217 HB3 GLN 32 HB3 GLN 32 58.742 36.637 35.766 218 HG2 GLN 32 HG2 GLN 32 58.630 34.926 37.607 219 HG3 GLN 32 HG3 GLN 32 60.169 35.533 38.224 220 HE21 GLN 32 HE21 GLN 32 58.679 35.781 40.207 221 HE22 GLN 32 HE22 GLN 32 57.651 37.220 40.287 222 H ASP 33 H ASP 33 60.484 33.001 36.533 223 HA ASP 33 HA ASP 33 59.165 31.443 34.544 224 HB2 ASP 33 HB2 ASP 33 59.971 30.720 37.387 225 HB3 ASP 33 HB3 ASP 33 59.635 29.594 36.074 226 H PHE 34 H PHE 34 57.246 30.420 34.480 227 HA PHE 34 HA PHE 34 54.886 31.345 35.434 228 HB2 PHE 34 HB2 PHE 34 55.282 29.654 33.667 229 HB3 PHE 34 HB3 PHE 34 55.712 28.460 34.871 230 HD1 PHE 34 HD1 PHE 34 53.025 29.968 32.985 231 HD2 PHE 34 HD2 PHE 34 53.901 27.573 36.469 232 HE1 PHE 34 HE1 PHE 34 50.706 29.100 32.983 233 HE2 PHE 34 HE2 PHE 34 51.573 26.748 36.486 234 HZ PHE 34 HZ PHE 34 49.967 27.497 34.741 235 H PHE 35 H PHE 35 56.841 28.937 37.243 236 HA PHE 35 HA PHE 35 55.015 28.223 39.255 237 HB2 PHE 35 HB2 PHE 35 57.233 27.200 38.823 238 HB3 PHE 35 HB3 PHE 35 58.034 28.636 39.432 239 HD1 PHE 35 HD1 PHE 35 58.254 29.016 41.842 240 HD2 PHE 35 HD2 PHE 35 55.950 25.692 40.336 241 HE1 PHE 35 HE1 PHE 35 58.156 28.040 44.128 242 HE2 PHE 35 HE2 PHE 35 55.869 24.718 42.620 243 HZ PHE 35 HZ PHE 35 56.953 25.899 44.517 244 H ALA 36 H ALA 36 56.973 31.175 39.022 245 HA ALA 36 HA ALA 36 55.894 32.155 41.639 246 HB1 ALA 36 HB1 ALA 36 58.391 32.946 40.103 247 HB2 ALA 36 HB2 ALA 36 57.861 33.613 41.665 248 HB3 ALA 36 HB3 ALA 36 58.332 31.905 41.550 249 H LEU 37 H LEU 37 56.167 32.889 38.185 250 HA LEU 37 HA LEU 37 55.396 35.569 38.113 251 HB2 LEU 37 HB2 LEU 37 56.223 34.124 36.221 252 HB3 LEU 37 HB3 LEU 37 54.637 33.351 36.190 253 HG LEU 37 HG LEU 37 53.629 35.632 35.652 254 HD11 LEU 37 HD11 LEU 37 55.136 37.345 34.748 255 HD12 LEU 37 HD12 LEU 37 56.551 36.349 35.139 256 HD13 LEU 37 HD13 LEU 37 55.545 37.038 36.437 257 HD21 LEU 37 HD21 LEU 37 54.376 35.551 33.287 258 HD22 LEU 37 HD22 LEU 37 53.969 33.953 33.933 259 HD23 LEU 37 HD23 LEU 37 55.673 34.429 33.754 260 H GLY 38 H GLY 38 53.413 32.724 38.662 261 HA2 GLY 38 HA2 GLY 38 50.837 34.057 38.291 262 HA3 GLY 38 HA3 GLY 38 51.116 32.424 38.906 263 H GLY 39 H GLY 39 53.057 34.316 40.815 264 HA2 GLY 39 HA2 GLY 39 52.925 35.237 42.907 265 HA3 GLY 39 HA3 GLY 39 51.210 35.529 42.627 266 H ASP 40 H ASP 40 50.120 33.088 42.430 267 HA ASP 40 HA ASP 40 50.674 31.502 44.902 268 HB2 ASP 40 HB2 ASP 40 48.233 33.191 44.173 269 HB3 ASP 40 HB3 ASP 40 48.080 31.774 45.204 270 H SER 41 H SER 41 50.107 29.288 44.610 271 HA SER 41 HA SER 41 49.997 28.446 41.879 272 HB2 SER 41 HB2 SER 41 49.777 26.155 42.785 273 HB3 SER 41 HB3 SER 41 51.098 27.071 43.535 274 HG SER 41 HG SER 41 49.598 25.788 44.898 275 H GLN 42 H GLN 42 47.289 28.762 44.168 276 HA GLN 42 HA GLN 42 45.377 27.532 42.337 277 HB2 GLN 42 HB2 GLN 42 45.038 29.375 44.730 278 HB3 GLN 42 HB3 GLN 42 43.690 28.665 43.818 279 HG2 GLN 42 HG2 GLN 42 44.572 26.400 44.343 280 HG3 GLN 42 HG3 GLN 42 45.869 27.148 45.285 281 HE21 GLN 42 HE21 GLN 42 44.596 25.439 46.734 282 HE22 GLN 42 HE22 GLN 42 43.485 26.202 47.860 283 H LEU 43 H LEU 43 46.666 30.823 42.728 284 HA LEU 43 HA LEU 43 44.751 32.052 40.885 285 HB2 LEU 43 HB2 LEU 43 46.170 33.203 42.761 286 HB3 LEU 43 HB3 LEU 43 47.518 33.083 41.630 287 HG LEU 43 HG LEU 43 45.976 34.258 39.939 288 HD11 LEU 43 HD11 LEU 43 44.206 35.686 40.895 289 HD12 LEU 43 HD12 LEU 43 44.516 35.007 42.512 290 HD13 LEU 43 HD13 LEU 43 43.843 33.993 41.218 291 HD21 LEU 43 HD21 LEU 43 47.862 35.426 40.962 292 HD22 LEU 43 HD22 LEU 43 46.850 35.864 42.358 293 HD23 LEU 43 HD23 LEU 43 46.484 36.493 40.724 294 H GLY 44 H GLY 44 48.069 30.667 40.631 295 HA2 GLY 44 HA2 GLY 44 48.476 31.024 37.838 296 HA3 GLY 44 HA3 GLY 44 49.147 29.715 38.827 297 H LEU 45 H LEU 45 46.916 28.248 39.566 298 HA LEU 45 HA LEU 45 46.086 26.853 37.209 299 HB2 LEU 45 HB2 LEU 45 44.995 26.975 40.044 300 HB3 LEU 45 HB3 LEU 45 44.251 25.956 38.821 301 HG LEU 45 HG LEU 45 47.182 25.730 39.606 302 HD11 LEU 45 HD11 LEU 45 45.848 25.180 41.528 303 HD12 LEU 45 HD12 LEU 45 46.369 23.658 40.794 304 HD13 LEU 45 HD13 LEU 45 44.710 24.218 40.545 305 HD21 LEU 45 HD21 LEU 45 45.338 23.965 37.952 306 HD22 LEU 45 HD22 LEU 45 46.962 23.498 38.515 307 HD23 LEU 45 HD23 LEU 45 46.779 24.827 37.381 308 H ARG 46 H ARG 46 44.370 29.434 38.986 309 HA ARG 46 HA ARG 46 41.981 29.468 37.370 310 HB2 ARG 46 HB2 ARG 46 42.158 30.496 39.563 311 HB3 ARG 46 HB3 ARG 46 43.389 31.622 38.999 312 HG2 ARG 46 HG2 ARG 46 41.761 32.692 37.496 313 HG3 ARG 46 HG3 ARG 46 40.512 31.546 38.012 314 HD2 ARG 46 HD2 ARG 46 42.044 33.413 39.888 315 HD3 ARG 46 HD3 ARG 46 40.528 33.855 39.158 316 HE ARG 46 HE ARG 46 40.897 32.211 41.485 317 HH11 ARG 46 HH11 ARG 46 38.653 32.365 38.735 318 HH12 ARG 46 HH12 ARG 46 37.348 31.746 39.714 319 HH21 ARG 46 HH21 ARG 46 39.151 31.440 42.604 320 HH22 ARG 46 HH22 ARG 46 37.667 31.114 41.739 321 H MET 47 H MET 47 45.030 31.333 37.078 322 HA MET 47 HA MET 47 44.188 32.632 34.652 323 HB2 MET 47 HB2 MET 47 46.943 32.371 35.908 324 HB3 MET 47 HB3 MET 47 46.525 33.406 34.529 325 HG2 MET 47 HG2 MET 47 44.791 34.518 35.925 326 HG3 MET 47 HG3 MET 47 45.398 33.674 37.330 327 HE1 MET 47 HE1 MET 47 48.932 35.238 37.864 328 HE2 MET 47 HE2 MET 47 47.718 34.086 38.457 329 HE3 MET 47 HE3 MET 47 48.605 33.746 36.953 330 H LEU 48 H LEU 48 45.979 29.585 35.157 331 HA LEU 48 HA LEU 48 46.426 29.073 32.355 332 HB2 LEU 48 HB2 LEU 48 47.616 27.745 33.896 333 HB3 LEU 48 HB3 LEU 48 46.161 27.307 34.793 334 HG LEU 48 HG LEU 48 45.416 25.847 32.975 335 HD11 LEU 48 HD11 LEU 48 46.380 26.961 30.980 336 HD12 LEU 48 HD12 LEU 48 46.930 25.297 31.086 337 HD13 LEU 48 HD13 LEU 48 48.010 26.620 31.583 338 HD21 LEU 48 HD21 LEU 48 48.324 25.401 33.778 339 HD22 LEU 48 HD22 LEU 48 47.194 24.157 33.217 340 HD23 LEU 48 HD23 LEU 48 46.893 24.981 34.747 341 H ALA 49 H ALA 49 43.579 28.196 34.480 342 HA ALA 49 HA ALA 49 42.163 26.923 32.353 343 HB1 ALA 49 HB1 ALA 49 40.175 27.272 33.807 344 HB2 ALA 49 HB2 ALA 49 41.568 26.618 34.686 345 HB3 ALA 49 HB3 ALA 49 41.136 28.342 34.847 346 H GLN 50 H GLN 50 41.964 30.349 33.454 347 HA GLN 50 HA GLN 50 40.108 31.218 31.461 348 HB2 GLN 50 HB2 GLN 50 42.281 32.610 33.054 349 HB3 GLN 50 HB3 GLN 50 41.252 33.488 31.915 350 HG2 GLN 50 HG2 GLN 50 40.150 31.857 34.245 351 HG3 GLN 50 HG3 GLN 50 40.497 33.579 34.331 352 HE21 GLN 50 HE21 GLN 50 37.959 31.472 33.838 353 HE22 GLN 50 HE22 GLN 50 36.976 32.480 32.764 354 H LEU 51 H LEU 51 43.745 31.286 31.354 355 HA LEU 51 HA LEU 51 44.015 32.264 28.701 356 HB2 LEU 51 HB2 LEU 51 45.918 32.103 30.148 357 HB3 LEU 51 HB3 LEU 51 45.640 30.382 30.437 358 HG LEU 51 HG LEU 51 46.286 29.850 28.113 359 HD11 LEU 51 HD11 LEU 51 45.726 32.001 27.019 360 HD12 LEU 51 HD12 LEU 51 47.405 31.549 26.741 361 HD13 LEU 51 HD13 LEU 51 47.009 32.808 27.942 362 HD21 LEU 51 HD21 LEU 51 47.895 29.795 29.983 363 HD22 LEU 51 HD22 LEU 51 48.350 31.482 29.637 364 HD23 LEU 51 HD23 LEU 51 48.655 30.192 28.444 365 H ARG 52 H ARG 52 43.680 28.881 29.832 366 HA ARG 52 HA ARG 52 43.950 27.650 27.323 367 HB2 ARG 52 HB2 ARG 52 44.016 26.516 29.545 368 HB3 ARG 52 HB3 ARG 52 42.258 26.669 29.693 369 HG2 ARG 52 HG2 ARG 52 43.455 25.439 27.222 370 HG3 ARG 52 HG3 ARG 52 43.448 24.505 28.713 371 HD2 ARG 52 HD2 ARG 52 41.109 24.338 28.751 372 HD3 ARG 52 HD3 ARG 52 40.906 25.598 27.529 373 HE ARG 52 HE ARG 52 42.346 23.013 26.990 374 HH11 ARG 52 HH11 ARG 52 39.862 25.167 25.887 375 HH12 ARG 52 HH12 ARG 52 40.138 24.843 24.202 376 HH21 ARG 52 HH21 ARG 52 42.718 22.615 24.921 377 HH22 ARG 52 HH22 ARG 52 41.724 23.343 23.654 378 H GLU 53 H GLU 53 40.961 28.678 28.978 379 HA GLU 53 HA GLU 53 39.332 27.764 26.835 380 HB2 GLU 53 HB2 GLU 53 38.799 29.760 29.093 381 HB3 GLU 53 HB3 GLU 53 37.554 29.239 27.949 382 HG2 GLU 53 HG2 GLU 53 37.835 26.911 28.628 383 HG3 GLU 53 HG3 GLU 53 39.127 27.337 29.746 384 H ARG 54 H ARG 54 40.782 30.951 27.533 385 HA ARG 54 HA ARG 54 39.501 32.503 25.458 386 HB2 ARG 54 HB2 ARG 54 42.064 32.762 27.075 387 HB3 ARG 54 HB3 ARG 54 41.612 33.974 25.904 388 HG2 ARG 54 HG2 ARG 54 39.653 33.179 28.093 389 HG3 ARG 54 HG3 ARG 54 40.913 34.375 28.381 390 HD2 ARG 54 HD2 ARG 54 38.868 34.613 26.127 391 HD3 ARG 54 HD3 ARG 54 38.647 35.291 27.736 392 HE ARG 54 HE ARG 54 40.456 36.798 27.430 393 HH11 ARG 54 HH11 ARG 54 39.578 35.273 24.349 394 HH12 ARG 54 HH12 ARG 54 40.698 36.275 23.477 395 HH21 ARG 54 HH21 ARG 54 41.767 38.082 26.201 396 HH22 ARG 54 HH22 ARG 54 41.937 37.755 24.490 397 H HIS 55 H HIS 55 42.432 30.562 25.436 398 HA HIS 55 HA HIS 55 43.135 31.585 22.720 399 HB2 HIS 55 HB2 HIS 55 44.473 32.030 24.831 400 HB3 HIS 55 HB3 HIS 55 44.893 30.339 24.853 401 HD1 HIS 55 HD1 HIS 55 45.374 30.559 21.419 402 HD2 HIS 55 HD2 HIS 55 46.974 32.788 24.591 403 HE1 HIS 55 HE1 HIS 55 47.548 31.576 20.557 404 H GLY 56 H GLY 56 42.066 28.666 24.250 405 HA2 GLY 56 HA2 GLY 56 41.573 26.621 23.323 406 HA3 GLY 56 HA3 GLY 56 42.210 27.156 21.763 407 H VAL 57 H VAL 57 43.942 27.085 24.889 408 HA VAL 57 HA VAL 57 45.944 25.171 23.758 409 HB VAL 57 HB VAL 57 46.514 28.010 24.695 410 HG11 VAL 57 HG11 VAL 57 48.285 26.586 25.582 411 HG12 VAL 57 HG12 VAL 57 48.408 25.722 24.035 412 HG13 VAL 57 HG13 VAL 57 48.908 27.428 24.165 413 HG21 VAL 57 HG21 VAL 57 47.530 28.254 22.454 414 HG22 VAL 57 HG22 VAL 57 47.061 26.589 22.044 415 HG23 VAL 57 HG23 VAL 57 45.829 27.833 22.312 416 H ASP 58 H ASP 58 46.222 23.646 25.143 417 HA ASP 58 HA ASP 58 46.024 23.981 28.084 418 HB2 ASP 58 HB2 ASP 58 46.570 21.556 26.330 419 HB3 ASP 58 HB3 ASP 58 46.298 21.520 28.075 420 H LEU 59 H LEU 59 47.873 23.785 29.475 421 HA LEU 59 HA LEU 59 50.511 23.992 28.104 422 HB2 LEU 59 HB2 LEU 59 49.416 24.932 30.736 423 HB3 LEU 59 HB3 LEU 59 51.131 24.587 30.593 424 HG LEU 59 HG LEU 59 51.382 26.105 28.731 425 HD11 LEU 59 HD11 LEU 59 49.636 27.782 28.180 426 HD12 LEU 59 HD12 LEU 59 48.469 26.879 29.168 427 HD13 LEU 59 HD13 LEU 59 49.172 26.151 27.711 428 HD21 LEU 59 HD21 LEU 59 51.761 26.909 31.020 429 HD22 LEU 59 HD22 LEU 59 50.067 27.417 31.138 430 HD23 LEU 59 HD23 LEU 59 51.160 28.205 29.981 431 HA PRO 60 HA PRO 60 51.147 19.728 29.671 432 HB2 PRO 60 HB2 PRO 60 53.325 19.134 28.049 433 HB3 PRO 60 HB3 PRO 60 51.624 18.888 27.585 434 HG2 PRO 60 HG2 PRO 60 53.414 21.183 26.873 435 HG3 PRO 60 HG3 PRO 60 52.256 20.292 25.840 436 HD2 PRO 60 HD2 PRO 60 51.639 22.701 26.932 437 HD3 PRO 60 HD3 PRO 60 50.414 21.415 26.746 438 H LEU 61 H LEU 61 52.476 19.177 31.346 439 HA LEU 61 HA LEU 61 54.342 21.065 32.410 440 HB2 LEU 61 HB2 LEU 61 53.855 18.156 33.092 441 HB3 LEU 61 HB3 LEU 61 54.997 19.189 33.950 442 HG LEU 61 HG LEU 61 51.983 19.569 33.812 443 HD11 LEU 61 HD11 LEU 61 52.862 17.831 35.369 444 HD12 LEU 61 HD12 LEU 61 52.136 19.188 36.223 445 HD13 LEU 61 HD13 LEU 61 53.903 19.053 36.131 446 HD21 LEU 61 HD21 LEU 61 52.373 21.439 35.447 447 HD22 LEU 61 HD22 LEU 61 52.908 21.812 33.821 448 HD23 LEU 61 HD23 LEU 61 54.106 21.365 35.068 449 H ARG 62 H ARG 62 54.886 18.614 30.000 450 HA ARG 62 HA ARG 62 57.770 18.676 30.121 451 HB2 ARG 62 HB2 ARG 62 56.517 16.996 28.819 452 HB3 ARG 62 HB3 ARG 62 55.925 18.245 27.735 453 HG2 ARG 62 HG2 ARG 62 58.172 18.667 26.909 454 HG3 ARG 62 HG3 ARG 62 58.885 17.684 28.209 455 HD2 ARG 62 HD2 ARG 62 57.902 15.654 27.318 456 HD3 ARG 62 HD3 ARG 62 56.971 16.584 26.138 457 HE ARG 62 HE ARG 62 59.928 16.865 26.061 458 HH11 ARG 62 HH11 ARG 62 57.267 15.021 24.614 459 HH12 ARG 62 HH12 ARG 62 58.212 14.743 23.174 460 HH21 ARG 62 HH21 ARG 62 60.951 16.493 24.119 461 HH22 ARG 62 HH22 ARG 62 60.205 15.362 22.988 462 H CYS 63 H CYS 63 55.601 20.713 27.993 463 HA CYS 63 HA CYS 63 57.675 22.510 27.305 464 HB2 CYS 63 HB2 CYS 63 56.112 23.873 26.325 465 HB3 CYS 63 HB3 CYS 63 55.354 22.291 26.229 466 HG CYS 63 HG CYS 63 53.879 22.701 28.465 467 H LEU 64 H LEU 64 55.534 22.577 30.116 468 HA LEU 64 HA LEU 64 56.347 25.085 31.179 469 HB2 LEU 64 HB2 LEU 64 54.493 23.203 31.822 470 HB3 LEU 64 HB3 LEU 64 55.718 22.774 32.991 471 HG LEU 64 HG LEU 64 54.141 24.126 34.074 472 HD11 LEU 64 HD11 LEU 64 56.385 26.081 33.450 473 HD12 LEU 64 HD12 LEU 64 56.486 24.744 34.628 474 HD13 LEU 64 HD13 LEU 64 55.325 26.050 34.874 475 HD21 LEU 64 HD21 LEU 64 54.433 26.201 31.876 476 HD22 LEU 64 HD22 LEU 64 53.361 26.283 33.291 477 HD23 LEU 64 HD23 LEU 64 53.091 25.043 32.056 478 H TYR 65 H TYR 65 57.812 21.819 31.526 479 HA TYR 65 HA TYR 65 59.880 22.684 33.341 480 HB2 TYR 65 HB2 TYR 65 59.055 20.413 33.285 481 HB3 TYR 65 HB3 TYR 65 59.600 20.208 31.620 482 HD1 TYR 65 HD1 TYR 65 60.778 20.924 35.098 483 HD2 TYR 65 HD2 TYR 65 61.836 19.518 31.160 484 HE1 TYR 65 HE1 TYR 65 62.999 20.232 35.945 485 HE2 TYR 65 HE2 TYR 65 64.059 18.796 32.023 486 HH TYR 65 HH TYR 65 65.024 19.312 35.425 487 H GLU 66 H GLU 66 59.863 22.196 29.771 488 HA GLU 66 HA GLU 66 62.702 22.988 29.683 489 HB2 GLU 66 HB2 GLU 66 62.755 22.302 27.455 490 HB3 GLU 66 HB3 GLU 66 61.969 21.084 28.450 491 HG2 GLU 66 HG2 GLU 66 59.748 21.930 27.526 492 HG3 GLU 66 HG3 GLU 66 60.667 22.974 26.450 493 H ALA 67 H ALA 67 59.718 24.681 29.229 494 HA ALA 67 HA ALA 67 61.219 27.157 28.598 495 HB1 ALA 67 HB1 ALA 67 58.758 26.152 27.120 496 HB2 ALA 67 HB2 ALA 67 59.553 27.715 26.874 497 HB3 ALA 67 HB3 ALA 67 60.416 26.222 26.470 498 HA PRO 68 HA PRO 68 57.960 27.528 32.010 499 HB2 PRO 68 HB2 PRO 68 59.621 28.517 34.029 500 HB3 PRO 68 HB3 PRO 68 59.194 26.817 33.767 501 HG2 PRO 68 HG2 PRO 68 61.664 28.300 32.857 502 HG3 PRO 68 HG3 PRO 68 61.557 26.672 33.588 503 HD2 PRO 68 HD2 PRO 68 61.831 27.023 30.914 504 HD3 PRO 68 HD3 PRO 68 60.792 25.726 31.574 505 H THR 69 H THR 69 59.915 29.786 30.360 506 HA THR 69 HA THR 69 58.631 32.161 31.601 507 HB THR 69 HB THR 69 60.223 32.998 29.434 508 HG1 THR 69 HG1 THR 69 61.802 31.328 31.051 509 HG21 THR 69 HG21 THR 69 61.791 33.792 31.216 510 HG22 THR 69 HG22 THR 69 60.869 32.853 32.413 511 HG23 THR 69 HG23 THR 69 60.107 34.207 31.546 512 H VAL 70 H VAL 70 56.904 33.154 30.665 513 HA VAL 70 HA VAL 70 55.409 31.467 28.991 514 HB VAL 70 HB VAL 70 53.642 33.101 28.956 515 HG11 VAL 70 HG11 VAL 70 54.959 32.965 31.688 516 HG12 VAL 70 HG12 VAL 70 53.243 33.262 31.340 517 HG13 VAL 70 HG13 VAL 70 53.966 31.692 30.944 518 HG21 VAL 70 HG21 VAL 70 53.788 35.272 30.050 519 HG22 VAL 70 HG22 VAL 70 55.523 35.063 30.314 520 HG23 VAL 70 HG23 VAL 70 54.885 35.211 28.663 521 H ALA 71 H ALA 71 57.389 34.189 27.872 522 HA ALA 71 HA ALA 71 56.207 34.312 25.236 523 HB1 ALA 71 HB1 ALA 71 59.016 34.995 26.212 524 HB2 ALA 71 HB2 ALA 71 58.307 35.485 24.658 525 HB3 ALA 71 HB3 ALA 71 57.622 36.100 26.177 526 H ARG 72 H ARG 72 58.801 32.361 26.641 527 HA ARG 72 HA ARG 72 59.655 31.014 24.204 528 HB2 ARG 72 HB2 ARG 72 59.995 30.042 27.077 529 HB3 ARG 72 HB3 ARG 72 60.962 29.633 25.665 530 HG2 ARG 72 HG2 ARG 72 61.702 32.090 25.613 531 HG3 ARG 72 HG3 ARG 72 60.867 32.289 27.151 532 HD2 ARG 72 HD2 ARG 72 63.162 31.888 27.694 533 HD3 ARG 72 HD3 ARG 72 62.255 30.444 28.117 534 HE ARG 72 HE ARG 72 63.557 29.238 26.699 535 HH11 ARG 72 HH11 ARG 72 63.981 32.587 25.689 536 HH12 ARG 72 HH12 ARG 72 64.833 32.102 24.227 537 HH21 ARG 72 HH21 ARG 72 64.833 28.761 24.956 538 HH22 ARG 72 HH22 ARG 72 65.566 30.095 24.051 539 H LEU 73 H LEU 73 57.479 30.214 26.902 540 HA LEU 73 HA LEU 73 56.618 27.669 25.969 541 HB2 LEU 73 HB2 LEU 73 56.294 28.706 28.221 542 HB3 LEU 73 HB3 LEU 73 55.017 29.710 27.577 543 HG LEU 73 HG LEU 73 54.795 26.771 27.049 544 HD11 LEU 73 HD11 LEU 73 53.783 26.342 29.266 545 HD12 LEU 73 HD12 LEU 73 54.252 27.975 29.799 546 HD13 LEU 73 HD13 LEU 73 55.490 26.762 29.400 547 HD21 LEU 73 HD21 LEU 73 53.093 28.576 26.328 548 HD22 LEU 73 HD22 LEU 73 52.702 28.742 28.045 549 HD23 LEU 73 HD23 LEU 73 52.458 27.193 27.199 550 H ALA 74 H ALA 74 55.099 30.914 25.469 551 HA ALA 74 HA ALA 74 53.004 30.060 23.783 552 HB1 ALA 74 HB1 ALA 74 52.928 32.414 23.080 553 HB2 ALA 74 HB2 ALA 74 53.180 32.308 24.837 554 HB3 ALA 74 HB3 ALA 74 54.544 32.694 23.760 555 H GLU 75 H GLU 75 56.394 30.976 22.943 556 HA GLU 75 HA GLU 75 55.982 30.778 20.099 557 HB2 GLU 75 HB2 GLU 75 57.883 31.972 21.210 558 HB3 GLU 75 HB3 GLU 75 58.595 30.409 21.640 559 HG2 GLU 75 HG2 GLU 75 58.774 29.840 19.241 560 HG3 GLU 75 HG3 GLU 75 57.903 31.328 18.827 561 H THR 76 H THR 76 57.315 28.404 22.436 562 HA THR 76 HA THR 76 57.690 26.363 20.422 563 HB THR 76 HB THR 76 57.982 24.810 22.365 564 HG1 THR 76 HG1 THR 76 57.851 27.213 23.866 565 HG21 THR 76 HG21 THR 76 59.618 27.383 22.404 566 HG22 THR 76 HG22 THR 76 59.888 25.981 21.346 567 HG23 THR 76 HG23 THR 76 60.094 25.814 23.097 568 H ILE 77 H ILE 77 54.892 27.056 22.548 569 HA ILE 77 HA ILE 77 53.523 24.643 21.625 570 HB ILE 77 HB ILE 77 52.583 27.021 23.243 571 HG12 ILE 77 HG12 ILE 77 54.182 25.533 24.416 572 HG13 ILE 77 HG13 ILE 77 52.580 25.458 25.116 573 HG21 ILE 77 HG21 ILE 77 51.048 24.547 22.361 574 HG22 ILE 77 HG22 ILE 77 50.614 25.486 23.790 575 HG23 ILE 77 HG23 ILE 77 50.585 26.252 22.193 576 HD11 ILE 77 HD11 ILE 77 53.855 23.348 23.311 577 HD12 ILE 77 HD12 ILE 77 53.538 23.230 25.040 578 HD13 ILE 77 HD13 ILE 77 52.182 23.276 23.922 579 H VAL 78 H VAL 78 53.523 28.046 20.481 580 HA VAL 78 HA VAL 78 51.566 27.508 18.395 581 HB VAL 78 HB VAL 78 53.727 29.617 18.685 582 HG11 VAL 78 HG11 VAL 78 51.652 29.332 16.469 583 HG12 VAL 78 HG12 VAL 78 52.560 30.813 16.809 584 HG13 VAL 78 HG13 VAL 78 53.420 29.363 16.276 585 HG21 VAL 78 HG21 VAL 78 51.687 29.732 20.186 586 HG22 VAL 78 HG22 VAL 78 51.821 31.100 19.078 587 HG23 VAL 78 HG23 VAL 78 50.671 29.788 18.736 588 H ARG 79 H ARG 79 55.112 27.008 18.588 589 HA ARG 79 HA ARG 79 55.361 26.066 15.868 590 HB2 ARG 79 HB2 ARG 79 57.278 26.926 17.077 591 HB3 ARG 79 HB3 ARG 79 57.105 25.692 18.318 592 HG2 ARG 79 HG2 ARG 79 58.939 25.069 16.892 593 HG3 ARG 79 HG3 ARG 79 57.634 23.926 16.630 594 HD2 ARG 79 HD2 ARG 79 56.979 25.364 14.579 595 HD3 ARG 79 HD3 ARG 79 58.546 26.146 14.858 596 HE ARG 79 HE ARG 79 59.661 24.275 14.097 597 HH11 ARG 79 HH11 ARG 79 56.268 23.268 14.463 598 HH12 ARG 79 HH12 ARG 79 56.569 21.831 13.495 599 HH21 ARG 79 HH21 ARG 79 59.851 22.383 12.946 600 HH22 ARG 79 HH22 ARG 79 58.428 21.385 12.684 601 H LEU 80 H LEU 80 54.970 24.267 18.912 602 HA LEU 80 HA LEU 80 55.047 21.722 17.386 603 HB2 LEU 80 HB2 LEU 80 55.600 22.285 20.317 604 HB3 LEU 80 HB3 LEU 80 55.859 20.755 19.492 605 HG LEU 80 HG LEU 80 57.272 23.333 18.700 606 HD11 LEU 80 HD11 LEU 80 59.229 22.629 19.772 607 HD12 LEU 80 HD12 LEU 80 58.453 21.133 20.363 608 HD13 LEU 80 HD13 LEU 80 57.923 22.728 20.965 609 HD21 LEU 80 HD21 LEU 80 57.219 21.613 16.910 610 HD22 LEU 80 HD22 LEU 80 57.885 20.421 18.046 611 HD23 LEU 80 HD23 LEU 80 58.851 21.826 17.551 612 H ALA 81 H ALA 81 52.673 23.523 19.103 613 HA ALA 81 HA ALA 81 50.608 23.045 19.880 614 HB1 ALA 81 HB1 ALA 81 49.217 21.944 18.214 615 HB2 ALA 81 HB2 ALA 81 50.429 22.972 17.431 616 HB3 ALA 81 HB3 ALA 81 50.650 21.209 17.460 617 H ALA 82 H ALA 82 52.200 21.782 21.592 618 HA ALA 82 HA ALA 82 52.058 18.970 21.555 619 HB1 ALA 82 HB1 ALA 82 52.944 20.877 23.739 620 HB2 ALA 82 HB2 ALA 82 53.306 19.145 23.675 621 HB3 ALA 82 HB3 ALA 82 53.944 20.235 22.425 622 HA PRO 83 HA PRO 83 48.445 18.320 24.217 623 HB2 PRO 83 HB2 PRO 83 48.242 15.656 24.134 624 HB3 PRO 83 HB3 PRO 83 47.992 16.656 22.665 625 HG2 PRO 83 HG2 PRO 83 50.509 15.208 23.516 626 HG3 PRO 83 HG3 PRO 83 49.698 15.142 21.917 627 HD2 PRO 83 HD2 PRO 83 51.804 16.841 22.471 628 HD3 PRO 83 HD3 PRO 83 50.499 17.260 21.320 629 H ALA 84 H ALA 84 47.963 17.622 26.297 630 HA ALA 84 HA ALA 84 50.323 17.357 28.096 631 HB1 ALA 84 HB1 ALA 84 47.647 18.775 28.412 632 HB2 ALA 84 HB2 ALA 84 48.979 18.792 29.585 633 HB3 ALA 84 HB3 ALA 84 49.188 19.537 27.985 634 HA PRO 85 HA PRO 85 48.092 13.594 29.416 635 HB2 PRO 85 HB2 PRO 85 50.806 12.820 30.402 636 HB3 PRO 85 HB3 PRO 85 49.640 11.875 29.433 637 HG2 PRO 85 HG2 PRO 85 51.855 12.948 28.284 638 HG3 PRO 85 HG3 PRO 85 50.277 13.003 27.433 639 HD2 PRO 85 HD2 PRO 85 51.571 15.172 29.115 640 HD3 PRO 85 HD3 PRO 85 50.880 15.281 27.470 641 H SER 86 H SER 86 49.729 15.991 31.303 642 HA SER 86 HA SER 86 49.962 14.776 33.792 643 HB2 SER 86 HB2 SER 86 49.316 17.687 33.228 644 HB3 SER 86 HB3 SER 86 49.891 17.048 34.783 645 HG SER 86 HG SER 86 51.778 16.344 33.788 646 H GLY 87 H GLY 87 47.089 16.463 32.584 647 HA2 GLY 87 HA2 GLY 87 44.853 15.863 33.012 648 HA3 GLY 87 HA3 GLY 87 45.325 15.003 34.469 649 H ASP 88 H ASP 88 43.538 17.459 33.564 650 HA ASP 88 HA ASP 88 44.655 19.748 34.767 651 HB2 ASP 88 HB2 ASP 88 42.660 20.893 34.246 652 HB3 ASP 88 HB3 ASP 88 42.967 19.754 32.941 653 H GLN 89 H GLN 89 44.071 21.041 36.529 654 HA GLN 89 HA GLN 89 43.146 19.497 38.928 655 HB2 GLN 89 HB2 GLN 89 45.039 21.816 38.567 656 HB3 GLN 89 HB3 GLN 89 44.442 21.298 40.144 657 HG2 GLN 89 HG2 GLN 89 45.518 19.154 39.965 658 HG3 GLN 89 HG3 GLN 89 45.898 19.406 38.253 659 HE21 GLN 89 HE21 GLN 89 47.597 20.812 37.662 660 HE22 GLN 89 HE22 GLN 89 48.757 21.383 38.866 661 H ASP 90 H ASP 90 41.237 20.034 39.758 662 HA ASP 90 HA ASP 90 40.515 22.819 40.178 663 HB2 ASP 90 HB2 ASP 90 39.660 22.505 37.876 664 HB3 ASP 90 HB3 ASP 90 38.757 21.081 38.398 665 H ASP 91 H ASP 91 39.980 22.755 42.258 666 HA ASP 91 HA ASP 91 38.247 20.570 43.373 667 HB2 ASP 91 HB2 ASP 91 40.265 22.465 44.643 668 HB3 ASP 91 HB3 ASP 91 39.154 21.472 45.575 669 H ALA 92 H ALA 92 37.981 23.732 42.260 670 HA ALA 92 HA ALA 92 36.822 25.597 42.694 671 HB1 ALA 92 HB1 ALA 92 34.727 23.626 43.652 672 HB2 ALA 92 HB2 ALA 92 34.439 25.274 43.066 673 HB3 ALA 92 HB3 ALA 92 35.073 24.043 41.956 674 H SER 93 H SER 93 37.816 23.997 45.449 675 HA SER 93 HA SER 93 37.842 24.301 47.674 676 HB2 SER 93 HB2 SER 93 37.774 27.192 46.801 677 HB3 SER 93 HB3 SER 93 37.788 26.740 48.511 678 HG SER 93 HG SER 93 39.792 26.545 46.638 679 H GLU 94 H GLU 94 36.641 25.422 49.609 680 HA GLU 94 HA GLU 94 33.770 25.922 49.127 681 HB2 GLU 94 HB2 GLU 94 33.174 24.393 51.061 682 HB3 GLU 94 HB3 GLU 94 33.542 23.641 49.514 683 HG2 GLU 94 HG2 GLU 94 35.795 23.000 50.305 684 HG3 GLU 94 HG3 GLU 94 35.479 23.774 51.861 685 H TYR 95 H TYR 95 33.716 27.970 49.838 686 HA TYR 95 HA TYR 95 35.350 28.763 52.216 687 HB2 TYR 95 HB2 TYR 95 34.231 30.399 49.916 688 HB3 TYR 95 HB3 TYR 95 35.266 31.001 51.197 689 HD1 TYR 95 HD1 TYR 95 37.423 28.989 51.400 690 HD2 TYR 95 HD2 TYR 95 35.455 30.646 47.937 691 HE1 TYR 95 HE1 TYR 95 39.514 28.737 50.097 692 HE2 TYR 95 HE2 TYR 95 37.551 30.348 46.624 693 HH TYR 95 HH TYR 95 40.524 29.018 48.090 694 H GLU 96 H GLU 96 32.121 28.294 51.359 695 HA GLU 96 HA GLU 96 30.117 28.830 52.167 696 HB2 GLU 96 HB2 GLU 96 31.613 28.447 54.406 697 HB3 GLU 96 HB3 GLU 96 30.997 30.064 54.703 698 HG2 GLU 96 HG2 GLU 96 29.285 27.637 53.983 699 HG3 GLU 96 HG3 GLU 96 29.628 28.159 55.631 700 H GLU 97 H GLU 97 28.556 30.529 52.516 701 HA GLU 97 HA GLU 97 29.492 33.133 51.361 702 HB2 GLU 97 HB2 GLU 97 27.039 31.435 50.771 703 HB3 GLU 97 HB3 GLU 97 27.235 33.091 50.238 704 HG2 GLU 97 HG2 GLU 97 27.843 31.819 48.384 705 HG3 GLU 97 HG3 GLU 97 29.348 32.445 49.035 706 H GLY 98 H GLY 98 28.326 31.956 54.218 707 HA2 GLY 98 HA2 GLY 98 27.500 33.024 56.073 708 HA3 GLY 98 HA3 GLY 98 27.283 34.517 55.164 709 H VAL 99 H VAL 99 25.899 31.783 53.643 710 HA VAL 99 HA VAL 99 23.126 32.692 54.029 711 HB VAL 99 HB VAL 99 24.418 30.432 52.452 712 HG11 VAL 99 HG11 VAL 99 22.163 29.669 52.956 713 HG12 VAL 99 HG12 VAL 99 21.491 31.256 52.500 714 HG13 VAL 99 HG13 VAL 99 22.225 30.204 51.284 715 HG21 VAL 99 HG21 VAL 99 23.812 31.796 50.496 716 HG22 VAL 99 HG22 VAL 99 23.081 33.022 51.544 717 HG23 VAL 99 HG23 VAL 99 24.838 32.733 51.581 718 H ILE 100 H ILE 100 21.542 31.659 55.277 719 HA ILE 100 HA ILE 100 22.661 30.158 57.486 720 HB ILE 100 HB ILE 100 20.586 30.414 58.595 721 HG12 ILE 100 HG12 ILE 100 19.361 31.348 55.965 722 HG13 ILE 100 HG13 ILE 100 19.023 29.835 56.796 723 HG21 ILE 100 HG21 ILE 100 20.477 32.809 58.704 724 HG22 ILE 100 HG22 ILE 100 22.146 32.369 58.350 725 HG23 ILE 100 HG23 ILE 100 21.098 32.988 57.053 726 HD11 ILE 100 HD11 ILE 100 18.329 32.609 57.817 727 HD12 ILE 100 HD12 ILE 100 17.223 31.361 57.227 728 HD13 ILE 100 HD13 ILE 100 18.114 31.099 58.740 729 H ARG 101 H ARG 101 21.678 28.896 54.604 730 HA ARG 101 HA ARG 101 20.409 26.446 55.749 731 HB2 ARG 101 HB2 ARG 101 20.049 27.741 53.022 732 HB3 ARG 101 HB3 ARG 101 19.307 26.232 53.549 733 HG2 ARG 101 HG2 ARG 101 18.327 27.587 55.520 734 HG3 ARG 101 HG3 ARG 101 18.781 29.029 54.585 735 HD2 ARG 101 HD2 ARG 101 17.441 28.127 52.669 736 HD3 ARG 101 HD3 ARG 101 16.919 26.789 53.693 737 HE ARG 101 HE ARG 101 15.881 28.443 55.223 738 HH11 ARG 101 HH11 ARG 101 16.398 29.511 51.900 739 HH12 ARG 101 HH12 ARG 101 15.187 30.742 52.050 740 HH21 ARG 101 HH21 ARG 101 14.352 30.034 55.279 741 HH22 ARG 101 HH22 ARG 101 14.284 31.198 53.957 Start of MODEL 7 1 H GLY 1 H1 GLY 1 38.463 63.295 34.877 2 HA2 GLY 1 HA2 GLY 1 39.548 65.820 35.908 3 HA3 GLY 1 HA3 GLY 1 40.325 64.225 36.013 4 H ALA 2 H ALA 2 42.159 64.951 34.803 5 HA ALA 2 HA ALA 2 41.632 65.595 31.923 6 HB1 ALA 2 HB1 ALA 2 42.307 67.533 33.297 7 HB2 ALA 2 HB2 ALA 2 43.778 66.670 33.799 8 HB3 ALA 2 HB3 ALA 2 43.542 67.114 32.095 9 H ALA 3 H ALA 3 43.476 63.484 34.056 10 HA ALA 3 HA ALA 3 45.344 62.788 31.853 11 HB1 ALA 3 HB1 ALA 3 46.648 61.736 33.619 12 HB2 ALA 3 HB2 ALA 3 46.279 63.428 34.007 13 HB3 ALA 3 HB3 ALA 3 45.384 62.117 34.811 14 H ALA 4 H ALA 4 45.322 60.975 30.753 15 HA ALA 4 HA ALA 4 44.560 58.404 31.805 16 HB1 ALA 4 HB1 ALA 4 42.814 57.922 30.064 17 HB2 ALA 4 HB2 ALA 4 42.288 59.145 31.227 18 HB3 ALA 4 HB3 ALA 4 42.832 59.637 29.605 19 H GLY 5 H GLY 5 45.452 56.687 30.527 20 HA2 GLY 5 HA2 GLY 5 46.024 56.775 27.811 21 HA3 GLY 5 HA3 GLY 5 47.496 57.365 28.583 22 H VAL 6 H VAL 6 47.792 55.226 27.062 23 HA VAL 6 HA VAL 6 48.224 52.975 28.937 24 HB VAL 6 HB VAL 6 46.081 52.735 27.645 25 HG11 VAL 6 HG11 VAL 6 46.157 52.014 25.308 26 HG12 VAL 6 HG12 VAL 6 46.791 53.656 25.455 27 HG13 VAL 6 HG13 VAL 6 47.901 52.283 25.236 28 HG21 VAL 6 HG21 VAL 6 48.123 50.580 27.048 29 HG22 VAL 6 HG22 VAL 6 47.356 50.852 28.631 30 HG23 VAL 6 HG23 VAL 6 46.358 50.420 27.240 31 H SER 7 H SER 7 49.935 51.652 28.560 32 HA SER 7 HA SER 7 52.150 52.821 27.080 33 HB2 SER 7 HB2 SER 7 51.875 50.540 29.050 34 HB3 SER 7 HB3 SER 7 53.412 50.964 28.287 35 HG SER 7 HG SER 7 53.571 52.644 29.441 36 H ALA 8 H ALA 8 53.810 51.393 26.039 37 HA ALA 8 HA ALA 8 52.584 49.704 23.939 38 HB1 ALA 8 HB1 ALA 8 55.420 50.735 24.324 39 HB2 ALA 8 HB2 ALA 8 54.768 49.966 22.866 40 HB3 ALA 8 HB3 ALA 8 54.137 51.537 23.398 41 H ALA 9 H ALA 9 52.707 47.530 23.894 42 HA ALA 9 HA ALA 9 54.515 46.058 25.762 43 HB1 ALA 9 HB1 ALA 9 51.475 45.850 25.723 44 HB2 ALA 9 HB2 ALA 9 52.589 44.933 26.768 45 HB3 ALA 9 HB3 ALA 9 52.440 46.681 26.964 46 H GLY 10 H GLY 10 54.013 46.196 22.659 47 HA2 GLY 10 HA2 GLY 10 52.963 43.597 21.938 48 HA3 GLY 10 HA3 GLY 10 53.625 44.828 20.859 49 H ILE 11 H ILE 11 56.105 44.485 22.850 50 HA ILE 11 HA ILE 11 57.681 42.752 21.215 51 HB ILE 11 HB ILE 11 59.269 42.923 23.300 52 HG12 ILE 11 HG12 ILE 11 58.972 44.899 24.679 53 HG13 ILE 11 HG13 ILE 11 57.430 45.279 23.931 54 HG21 ILE 11 HG21 ILE 11 59.555 44.064 21.141 55 HG22 ILE 11 HG22 ILE 11 58.454 45.357 21.662 56 HG23 ILE 11 HG23 ILE 11 60.010 45.117 22.486 57 HD11 ILE 11 HD11 ILE 11 58.006 42.858 25.678 58 HD12 ILE 11 HD12 ILE 11 57.138 44.332 26.158 59 HD13 ILE 11 HD13 ILE 11 56.420 43.259 24.965 60 H GLU 12 H GLU 12 55.359 41.819 23.490 61 HA GLU 12 HA GLU 12 56.400 39.039 23.467 62 HB2 GLU 12 HB2 GLU 12 55.311 40.576 25.853 63 HB3 GLU 12 HB3 GLU 12 55.310 38.815 25.772 64 HG2 GLU 12 HG2 GLU 12 57.788 38.861 25.386 65 HG3 GLU 12 HG3 GLU 12 57.766 40.601 25.692 66 HA PRO 13 HA PRO 13 52.474 38.011 21.870 67 HB2 PRO 13 HB2 PRO 13 52.000 35.461 22.810 68 HB3 PRO 13 HB3 PRO 13 53.260 35.850 21.608 69 HG2 PRO 13 HG2 PRO 13 53.608 35.546 24.597 70 HG3 PRO 13 HG3 PRO 13 54.568 34.806 23.267 71 HD2 PRO 13 HD2 PRO 13 55.424 37.035 24.509 72 HD3 PRO 13 HD3 PRO 13 55.613 36.857 22.743 73 H ASP 14 H ASP 14 50.256 37.542 22.276 74 HA ASP 14 HA ASP 14 49.071 39.100 24.274 75 HB2 ASP 14 HB2 ASP 14 48.055 38.606 22.188 76 HB3 ASP 14 HB3 ASP 14 48.006 36.877 22.525 77 H LEU 15 H LEU 15 50.025 35.722 24.644 78 HA LEU 15 HA LEU 15 48.458 35.021 26.922 79 HB2 LEU 15 HB2 LEU 15 51.357 34.351 26.226 80 HB3 LEU 15 HB3 LEU 15 50.493 33.713 27.616 81 HG LEU 15 HG LEU 15 48.734 32.812 25.961 82 HD11 LEU 15 HD11 LEU 15 51.019 33.324 24.013 83 HD12 LEU 15 HD12 LEU 15 49.347 33.922 23.888 84 HD13 LEU 15 HD13 LEU 15 49.679 32.207 23.716 85 HD21 LEU 15 HD21 LEU 15 50.065 30.780 25.563 86 HD22 LEU 15 HD22 LEU 15 50.270 31.394 27.210 87 HD23 LEU 15 HD23 LEU 15 51.542 31.661 26.007 88 H THR 16 H THR 16 51.076 37.356 26.611 89 HA THR 16 HA THR 16 51.478 37.631 29.524 90 HB THR 16 HB THR 16 52.820 39.613 28.984 91 HG1 THR 16 HG1 THR 16 52.273 38.952 26.265 92 HG21 THR 16 HG21 THR 16 53.591 37.234 27.246 93 HG22 THR 16 HG22 THR 16 53.826 37.339 29.009 94 HG23 THR 16 HG23 THR 16 54.661 38.470 27.951 95 H ALA 17 H ALA 17 49.508 39.235 27.062 96 HA ALA 17 HA ALA 17 48.545 41.349 28.800 97 HB1 ALA 17 HB1 ALA 17 47.439 40.208 26.208 98 HB2 ALA 17 HB2 ALA 17 46.977 41.740 26.964 99 HB3 ALA 17 HB3 ALA 17 48.624 41.524 26.335 100 H ILE 18 H ILE 18 47.326 38.122 27.780 101 HA ILE 18 HA ILE 18 44.909 38.092 29.316 102 HB ILE 18 HB ILE 18 46.803 35.818 28.583 103 HG12 ILE 18 HG12 ILE 18 44.171 36.676 27.301 104 HG13 ILE 18 HG13 ILE 18 45.750 37.077 26.659 105 HG21 ILE 18 HG21 ILE 18 45.411 35.134 30.493 106 HG22 ILE 18 HG22 ILE 18 43.955 35.720 29.678 107 HG23 ILE 18 HG23 ILE 18 44.852 34.314 29.055 108 HD11 ILE 18 HD11 ILE 18 46.260 34.608 26.477 109 HD12 ILE 18 HD12 ILE 18 44.540 34.303 26.847 110 HD13 ILE 18 HD13 ILE 18 44.999 35.215 25.408 111 H TRP 19 H TRP 19 48.291 37.132 30.248 112 HA TRP 19 HA TRP 19 47.469 36.428 32.907 113 HB2 TRP 19 HB2 TRP 19 50.193 36.967 31.699 114 HB3 TRP 19 HB3 TRP 19 49.942 36.460 33.364 115 HD1 TRP 19 HD1 TRP 19 47.542 34.649 31.196 116 HE1 TRP 19 HE1 TRP 19 48.308 32.248 30.783 117 HE3 TRP 19 HE3 TRP 19 52.313 35.000 33.007 118 HZ2 TRP 19 HZ2 TRP 19 50.734 30.717 31.009 119 HZ3 TRP 19 HZ3 TRP 19 53.817 33.022 32.932 120 HH2 TRP 19 HH2 TRP 19 53.057 30.902 31.876 121 H GLN 20 H GLN 20 48.937 39.552 31.675 122 HA GLN 20 HA GLN 20 48.981 40.594 34.349 123 HB2 GLN 20 HB2 GLN 20 49.656 42.665 33.372 124 HB3 GLN 20 HB3 GLN 20 50.427 41.364 32.487 125 HG2 GLN 20 HG2 GLN 20 49.756 42.442 30.652 126 HG3 GLN 20 HG3 GLN 20 48.186 41.730 30.960 127 HE21 GLN 20 HE21 GLN 20 47.200 43.360 33.128 128 HE22 GLN 20 HE22 GLN 20 46.894 44.888 32.367 129 H ALA 21 H ALA 21 46.372 40.460 31.875 130 HA ALA 21 HA ALA 21 44.662 42.315 33.312 131 HB1 ALA 21 HB1 ALA 21 42.925 41.454 31.797 132 HB2 ALA 21 HB2 ALA 21 44.408 41.865 30.917 133 HB3 ALA 21 HB3 ALA 21 44.015 40.161 31.257 134 H LEU 22 H LEU 22 44.937 38.715 33.328 135 HA LEU 22 HA LEU 22 42.758 38.343 35.204 136 HB2 LEU 22 HB2 LEU 22 45.058 36.562 34.299 137 HB3 LEU 22 HB3 LEU 22 43.785 36.025 35.386 138 HG LEU 22 HG LEU 22 43.278 36.999 32.534 139 HD11 LEU 22 HD11 LEU 22 44.553 34.871 32.663 140 HD12 LEU 22 HD12 LEU 22 42.921 34.640 32.023 141 HD13 LEU 22 HD13 LEU 22 43.280 34.202 33.713 142 HD21 LEU 22 HD21 LEU 22 41.463 35.702 34.612 143 HD22 LEU 22 HD22 LEU 22 41.065 35.879 32.888 144 HD23 LEU 22 HD23 LEU 22 41.298 37.313 33.879 145 H PHE 23 H PHE 23 46.297 38.609 35.585 146 HA PHE 23 HA PHE 23 46.230 38.160 38.439 147 HB2 PHE 23 HB2 PHE 23 48.082 37.628 36.797 148 HB3 PHE 23 HB3 PHE 23 48.418 39.346 36.692 149 HD1 PHE 23 HD1 PHE 23 48.956 36.259 38.486 150 HD2 PHE 23 HD2 PHE 23 49.283 40.545 38.828 151 HE1 PHE 23 HE1 PHE 23 50.509 35.996 40.387 152 HE2 PHE 23 HE2 PHE 23 50.872 40.273 40.712 153 HZ PHE 23 HZ PHE 23 51.485 37.989 41.490 154 H ALA 24 H ALA 24 45.477 40.911 36.563 155 HA ALA 24 HA ALA 24 45.190 43.106 36.924 156 HB1 ALA 24 HB1 ALA 24 44.504 42.140 39.710 157 HB2 ALA 24 HB2 ALA 24 44.019 43.692 38.992 158 HB3 ALA 24 HB3 ALA 24 43.423 42.169 38.303 159 H LEU 25 H LEU 25 47.619 43.076 36.557 160 HA LEU 25 HA LEU 25 48.652 45.091 38.436 161 HB2 LEU 25 HB2 LEU 25 50.781 44.257 38.674 162 HB3 LEU 25 HB3 LEU 25 49.799 42.822 38.835 163 HG LEU 25 HG LEU 25 51.429 43.697 36.409 164 HD11 LEU 25 HD11 LEU 25 52.725 41.657 36.849 165 HD12 LEU 25 HD12 LEU 25 51.709 41.291 38.250 166 HD13 LEU 25 HD13 LEU 25 52.751 42.728 38.262 167 HD21 LEU 25 HD21 LEU 25 49.424 42.484 35.624 168 HD22 LEU 25 HD22 LEU 25 49.806 41.148 36.718 169 HD23 LEU 25 HD23 LEU 25 50.902 41.542 35.381 170 HA PRO 26 HA PRO 26 49.137 47.551 34.960 171 HB2 PRO 26 HB2 PRO 26 51.936 48.329 35.732 172 HB3 PRO 26 HB3 PRO 26 50.540 49.377 35.372 173 HG2 PRO 26 HG2 PRO 26 51.290 48.961 37.936 174 HG3 PRO 26 HG3 PRO 26 49.547 48.901 37.506 175 HD2 PRO 26 HD2 PRO 26 51.480 46.584 37.852 176 HD3 PRO 26 HD3 PRO 26 49.837 46.798 38.523 177 H ALA 27 H ALA 27 52.259 45.844 35.370 178 HA ALA 27 HA ALA 27 52.146 44.783 32.621 179 HB1 ALA 27 HB1 ALA 27 53.407 46.892 32.383 180 HB2 ALA 27 HB2 ALA 27 54.484 46.419 33.715 181 HB3 ALA 27 HB3 ALA 27 54.492 45.501 32.195 182 H VAL 28 H VAL 28 53.256 42.827 32.394 183 HA VAL 28 HA VAL 28 53.942 41.449 34.935 184 HB VAL 28 HB VAL 28 52.260 40.437 33.475 185 HG11 VAL 28 HG11 VAL 28 52.924 39.194 31.450 186 HG12 VAL 28 HG12 VAL 28 53.083 40.933 31.236 187 HG13 VAL 28 HG13 VAL 28 54.534 39.944 31.509 188 HG21 VAL 28 HG21 VAL 28 53.037 38.162 33.600 189 HG22 VAL 28 HG22 VAL 28 54.721 38.698 33.765 190 HG23 VAL 28 HG23 VAL 28 53.530 39.053 35.043 191 H GLY 29 H GLY 29 55.878 40.365 35.309 192 HA2 GLY 29 HA2 GLY 29 58.211 41.734 34.241 193 HA3 GLY 29 HA3 GLY 29 58.186 40.473 35.472 194 H ARG 30 H ARG 30 59.526 41.092 32.589 195 HA ARG 30 HA ARG 30 59.138 38.340 31.519 196 HB2 ARG 30 HB2 ARG 30 59.681 39.064 29.395 197 HB3 ARG 30 HB3 ARG 30 58.515 40.188 30.093 198 HG2 ARG 30 HG2 ARG 30 60.495 41.743 30.559 199 HG3 ARG 30 HG3 ARG 30 61.505 40.613 29.652 200 HD2 ARG 30 HD2 ARG 30 60.814 42.418 28.234 201 HD3 ARG 30 HD3 ARG 30 60.048 40.931 27.666 202 HE ARG 30 HE ARG 30 57.941 41.638 28.710 203 HH11 ARG 30 HH11 ARG 30 60.086 44.123 27.621 204 HH12 ARG 30 HH12 ARG 30 59.068 45.438 28.148 205 HH21 ARG 30 HH21 ARG 30 56.537 43.292 29.172 206 HH22 ARG 30 HH22 ARG 30 57.018 44.959 28.942 207 H HIS 31 H HIS 31 60.938 37.456 30.211 208 HA HIS 31 HA HIS 31 62.626 36.035 30.427 209 HB2 HIS 31 HB2 HIS 31 63.920 38.231 30.219 210 HB3 HIS 31 HB3 HIS 31 64.241 38.087 31.946 211 HD1 HIS 31 HD1 HIS 31 65.954 36.076 32.650 212 HD2 HIS 31 HD2 HIS 31 65.158 36.542 28.539 213 HE1 HIS 31 HE1 HIS 31 67.752 34.759 31.419 214 H GLN 32 H GLN 32 60.515 36.121 32.411 215 HA GLN 32 HA GLN 32 61.781 34.839 34.795 216 HB2 GLN 32 HB2 GLN 32 59.735 37.073 34.691 217 HB3 GLN 32 HB3 GLN 32 59.959 36.062 36.124 218 HG2 GLN 32 HG2 GLN 32 62.205 36.802 36.455 219 HG3 GLN 32 HG3 GLN 32 62.297 37.538 34.863 220 HE21 GLN 32 HE21 GLN 32 61.402 39.557 34.480 221 HE22 GLN 32 HE22 GLN 32 60.950 40.621 35.808 222 H ASP 33 H ASP 33 60.455 33.442 35.970 223 HA ASP 33 HA ASP 33 59.285 31.581 34.100 224 HB2 ASP 33 HB2 ASP 33 59.556 31.352 37.126 225 HB3 ASP 33 HB3 ASP 33 59.324 30.032 35.987 226 H PHE 34 H PHE 34 57.163 30.728 33.979 227 HA PHE 34 HA PHE 34 54.899 31.911 35.199 228 HB2 PHE 34 HB2 PHE 34 54.793 30.336 33.334 229 HB3 PHE 34 HB3 PHE 34 55.367 29.032 34.352 230 HD1 PHE 34 HD1 PHE 34 53.624 27.458 34.607 231 HD2 PHE 34 HD2 PHE 34 52.650 31.654 34.861 232 HE1 PHE 34 HE1 PHE 34 51.264 26.886 35.056 233 HE2 PHE 34 HE2 PHE 34 50.285 31.069 35.279 234 HZ PHE 34 HZ PHE 34 49.577 28.688 35.370 235 H PHE 35 H PHE 35 57.173 29.612 36.618 236 HA PHE 35 HA PHE 35 55.795 28.893 39.003 237 HB2 PHE 35 HB2 PHE 35 57.840 27.819 38.174 238 HB3 PHE 35 HB3 PHE 35 58.748 29.308 38.386 239 HD1 PHE 35 HD1 PHE 35 56.841 26.685 40.272 240 HD2 PHE 35 HD2 PHE 35 59.832 29.791 40.455 241 HE1 PHE 35 HE1 PHE 35 57.419 26.001 42.587 242 HE2 PHE 35 HE2 PHE 35 60.400 29.105 42.768 243 HZ PHE 35 HZ PHE 35 59.194 27.211 43.841 244 H ALA 36 H ALA 36 57.480 31.923 38.166 245 HA ALA 36 HA ALA 36 57.121 32.995 40.915 246 HB1 ALA 36 HB1 ALA 36 58.480 34.132 38.442 247 HB2 ALA 36 HB2 ALA 36 58.455 34.868 40.060 248 HB3 ALA 36 HB3 ALA 36 59.286 33.320 39.806 249 H LEU 37 H LEU 37 56.148 33.652 37.538 250 HA LEU 37 HA LEU 37 54.607 35.988 38.055 251 HB2 LEU 37 HB2 LEU 37 54.983 34.050 35.779 252 HB3 LEU 37 HB3 LEU 37 53.638 35.168 35.695 253 HG LEU 37 HG LEU 37 55.036 37.088 35.743 254 HD11 LEU 37 HD11 LEU 37 57.475 37.025 35.723 255 HD12 LEU 37 HD12 LEU 37 57.464 35.278 36.026 256 HD13 LEU 37 HD13 LEU 37 56.860 36.415 37.259 257 HD21 LEU 37 HD21 LEU 37 56.251 36.710 33.630 258 HD22 LEU 37 HD22 LEU 37 54.693 35.881 33.609 259 HD23 LEU 37 HD23 LEU 37 56.193 34.959 33.888 260 H GLY 38 H GLY 38 53.641 32.633 38.415 261 HA2 GLY 38 HA2 GLY 38 50.788 33.056 38.124 262 HA3 GLY 38 HA3 GLY 38 51.583 31.674 38.891 263 H GLY 39 H GLY 39 52.982 33.452 40.847 264 HA2 GLY 39 HA2 GLY 39 52.700 34.514 42.882 265 HA3 GLY 39 HA3 GLY 39 51.033 34.883 42.452 266 H ASP 40 H ASP 40 49.758 32.526 42.237 267 HA ASP 40 HA ASP 40 50.359 30.797 44.590 268 HB2 ASP 40 HB2 ASP 40 48.733 32.705 45.197 269 HB3 ASP 40 HB3 ASP 40 47.598 31.973 44.066 270 H SER 41 H SER 41 49.639 28.586 44.250 271 HA SER 41 HA SER 41 49.474 27.814 41.565 272 HB2 SER 41 HB2 SER 41 49.013 25.590 42.321 273 HB3 SER 41 HB3 SER 41 50.195 26.331 43.410 274 HG SER 41 HG SER 41 48.339 25.125 44.317 275 H GLN 42 H GLN 42 46.713 28.560 43.713 276 HA GLN 42 HA GLN 42 44.739 27.558 41.789 277 HB2 GLN 42 HB2 GLN 42 44.586 29.303 44.259 278 HB3 GLN 42 HB3 GLN 42 43.170 28.976 43.260 279 HG2 GLN 42 HG2 GLN 42 44.892 26.829 44.567 280 HG3 GLN 42 HG3 GLN 42 43.375 27.452 45.222 281 HE21 GLN 42 HE21 GLN 42 44.490 24.777 43.697 282 HE22 GLN 42 HE22 GLN 42 43.106 24.442 42.641 283 H LEU 43 H LEU 43 46.348 30.671 42.332 284 HA LEU 43 HA LEU 43 44.716 32.151 40.447 285 HB2 LEU 43 HB2 LEU 43 46.189 33.042 42.351 286 HB3 LEU 43 HB3 LEU 43 47.565 32.731 41.321 287 HG LEU 43 HG LEU 43 46.991 35.053 41.309 288 HD11 LEU 43 HD11 LEU 43 47.748 34.112 39.106 289 HD12 LEU 43 HD12 LEU 43 46.770 35.588 38.985 290 HD13 LEU 43 HD13 LEU 43 46.040 34.031 38.606 291 HD21 LEU 43 HD21 LEU 43 44.241 34.332 40.220 292 HD22 LEU 43 HD22 LEU 43 44.871 35.957 40.534 293 HD23 LEU 43 HD23 LEU 43 44.592 34.849 41.886 294 H GLY 44 H GLY 44 47.882 30.437 40.254 295 HA2 GLY 44 HA2 GLY 44 48.352 30.678 37.468 296 HA3 GLY 44 HA3 GLY 44 48.906 29.355 38.504 297 H LEU 45 H LEU 45 46.468 28.132 39.218 298 HA LEU 45 HA LEU 45 45.845 26.679 36.815 299 HB2 LEU 45 HB2 LEU 45 44.767 26.597 39.647 300 HB3 LEU 45 HB3 LEU 45 44.135 25.551 38.384 301 HG LEU 45 HG LEU 45 47.095 25.601 39.120 302 HD11 LEU 45 HD11 LEU 45 46.640 23.524 40.367 303 HD12 LEU 45 HD12 LEU 45 44.902 23.699 40.042 304 HD13 LEU 45 HD13 LEU 45 45.745 24.886 41.058 305 HD21 LEU 45 HD21 LEU 45 45.422 23.609 37.551 306 HD22 LEU 45 HD22 LEU 45 47.129 23.411 37.998 307 HD23 LEU 45 HD23 LEU 45 46.659 24.688 36.879 308 H ARG 46 H ARG 46 43.896 29.175 38.593 309 HA ARG 46 HA ARG 46 41.771 29.001 36.611 310 HB2 ARG 46 HB2 ARG 46 40.737 30.781 37.586 311 HB3 ARG 46 HB3 ARG 46 41.595 30.059 38.939 312 HG2 ARG 46 HG2 ARG 46 43.353 31.826 38.719 313 HG3 ARG 46 HG3 ARG 46 42.485 32.531 37.349 314 HD2 ARG 46 HD2 ARG 46 42.040 33.834 39.298 315 HD3 ARG 46 HD3 ARG 46 40.557 33.007 38.804 316 HE ARG 46 HE ARG 46 41.288 31.240 40.583 317 HH11 ARG 46 HH11 ARG 46 41.692 34.734 41.195 318 HH12 ARG 46 HH12 ARG 46 41.842 34.366 42.913 319 HH21 ARG 46 HH21 ARG 46 41.384 31.032 42.645 320 HH22 ARG 46 HH22 ARG 46 41.716 32.427 43.687 321 H MET 47 H MET 47 44.803 30.843 36.781 322 HA MET 47 HA MET 47 44.271 32.444 34.481 323 HB2 MET 47 HB2 MET 47 45.922 32.988 36.182 324 HB3 MET 47 HB3 MET 47 46.942 31.626 35.687 325 HG2 MET 47 HG2 MET 47 47.570 32.700 33.697 326 HG3 MET 47 HG3 MET 47 46.116 33.696 33.665 327 HE1 MET 47 HE1 MET 47 48.814 33.115 36.560 328 HE2 MET 47 HE2 MET 47 49.768 33.342 35.068 329 HE3 MET 47 HE3 MET 47 49.800 34.578 36.344 330 H LEU 48 H LEU 48 45.725 29.172 34.774 331 HA LEU 48 HA LEU 48 45.934 28.795 31.924 332 HB2 LEU 48 HB2 LEU 48 47.057 27.332 33.544 333 HB3 LEU 48 HB3 LEU 48 45.517 26.727 34.124 334 HG LEU 48 HG LEU 48 46.834 25.255 32.545 335 HD11 LEU 48 HD11 LEU 48 44.981 24.376 31.285 336 HD12 LEU 48 HD12 LEU 48 44.039 25.832 31.478 337 HD13 LEU 48 HD13 LEU 48 44.415 24.833 32.898 338 HD21 LEU 48 HD21 LEU 48 45.795 27.038 30.313 339 HD22 LEU 48 HD22 LEU 48 46.844 25.624 30.195 340 HD23 LEU 48 HD23 LEU 48 47.448 27.113 30.952 341 H ALA 49 H ALA 49 43.254 27.865 34.226 342 HA ALA 49 HA ALA 49 41.630 26.736 32.262 343 HB1 ALA 49 HB1 ALA 49 41.342 26.555 34.736 344 HB2 ALA 49 HB2 ALA 49 40.696 28.214 34.757 345 HB3 ALA 49 HB3 ALA 49 39.838 26.928 33.887 346 H GLN 50 H GLN 50 41.754 30.163 33.215 347 HA GLN 50 HA GLN 50 39.780 31.081 31.299 348 HB2 GLN 50 HB2 GLN 50 41.903 32.479 32.955 349 HB3 GLN 50 HB3 GLN 50 40.775 33.338 31.908 350 HG2 GLN 50 HG2 GLN 50 39.889 31.548 34.219 351 HG3 GLN 50 HG3 GLN 50 40.127 33.290 34.338 352 HE21 GLN 50 HE21 GLN 50 38.028 30.753 32.983 353 HE22 GLN 50 HE22 GLN 50 36.827 31.867 32.330 354 H LEU 51 H LEU 51 43.445 31.005 31.195 355 HA LEU 51 HA LEU 51 43.660 32.105 28.557 356 HB2 LEU 51 HB2 LEU 51 45.620 31.839 29.893 357 HB3 LEU 51 HB3 LEU 51 45.303 30.119 30.148 358 HG LEU 51 HG LEU 51 45.795 29.660 27.775 359 HD11 LEU 51 HD11 LEU 51 45.310 31.901 26.804 360 HD12 LEU 51 HD12 LEU 51 46.936 31.337 26.409 361 HD13 LEU 51 HD13 LEU 51 46.711 32.566 27.678 362 HD21 LEU 51 HD21 LEU 51 48.033 31.137 29.197 363 HD22 LEU 51 HD22 LEU 51 48.197 29.891 27.944 364 HD23 LEU 51 HD23 LEU 51 47.529 29.458 29.522 365 H ARG 52 H ARG 52 42.852 28.819 29.652 366 HA ARG 52 HA ARG 52 42.829 27.666 27.017 367 HB2 ARG 52 HB2 ARG 52 43.206 26.475 29.201 368 HB3 ARG 52 HB3 ARG 52 41.470 26.618 29.529 369 HG2 ARG 52 HG2 ARG 52 40.989 25.404 27.412 370 HG3 ARG 52 HG3 ARG 52 42.702 25.340 27.052 371 HD2 ARG 52 HD2 ARG 52 43.015 24.114 29.290 372 HD3 ARG 52 HD3 ARG 52 41.250 23.954 29.351 373 HE ARG 52 HE ARG 52 43.106 22.392 27.805 374 HH11 ARG 52 HH11 ARG 52 39.819 23.561 27.633 375 HH12 ARG 52 HH12 ARG 52 39.428 22.537 26.281 376 HH21 ARG 52 HH21 ARG 52 42.648 21.251 26.023 377 HH22 ARG 52 HH22 ARG 52 40.993 21.214 25.399 378 H GLU 53 H GLU 53 40.155 28.820 29.151 379 HA GLU 53 HA GLU 53 38.088 28.395 27.224 380 HB2 GLU 53 HB2 GLU 53 38.375 30.308 29.574 381 HB3 GLU 53 HB3 GLU 53 37.017 30.424 28.461 382 HG2 GLU 53 HG2 GLU 53 36.519 27.980 28.893 383 HG3 GLU 53 HG3 GLU 53 37.716 28.033 30.189 384 H ARG 54 H ARG 54 40.312 31.150 27.659 385 HA ARG 54 HA ARG 54 39.278 32.790 25.530 386 HB2 ARG 54 HB2 ARG 54 41.920 32.600 27.017 387 HB3 ARG 54 HB3 ARG 54 41.714 33.738 25.708 388 HG2 ARG 54 HG2 ARG 54 39.909 34.890 26.844 389 HG3 ARG 54 HG3 ARG 54 39.861 33.670 28.131 390 HD2 ARG 54 HD2 ARG 54 42.189 34.220 28.745 391 HD3 ARG 54 HD3 ARG 54 42.261 35.420 27.449 392 HE ARG 54 HE ARG 54 40.477 35.574 29.871 393 HH11 ARG 54 HH11 ARG 54 41.926 37.430 27.204 394 HH12 ARG 54 HH12 ARG 54 41.709 38.895 28.145 395 HH21 ARG 54 HH21 ARG 54 40.198 37.487 30.796 396 HH22 ARG 54 HH22 ARG 54 40.844 38.945 30.020 397 H HIS 55 H HIS 55 42.007 30.479 25.539 398 HA HIS 55 HA HIS 55 42.391 31.099 22.647 399 HB2 HIS 55 HB2 HIS 55 43.840 32.023 24.669 400 HB3 HIS 55 HB3 HIS 55 44.574 30.433 24.624 401 HD1 HIS 55 HD1 HIS 55 43.774 31.899 21.156 402 HD2 HIS 55 HD2 HIS 55 46.849 31.892 24.051 403 HE1 HIS 55 HE1 HIS 55 45.824 32.789 20.019 404 H GLY 56 H GLY 56 41.639 28.428 24.565 405 HA2 GLY 56 HA2 GLY 56 41.498 26.199 24.044 406 HA3 GLY 56 HA3 GLY 56 42.259 26.517 22.485 407 H VAL 57 H VAL 57 44.098 27.601 25.174 408 HA VAL 57 HA VAL 57 46.218 25.693 24.465 409 HB VAL 57 HB VAL 57 46.159 28.189 26.178 410 HG11 VAL 57 HG11 VAL 57 48.521 26.395 25.504 411 HG12 VAL 57 HG12 VAL 57 48.662 28.046 26.153 412 HG13 VAL 57 HG13 VAL 57 47.902 26.784 27.120 413 HG21 VAL 57 HG21 VAL 57 45.987 28.580 23.738 414 HG22 VAL 57 HG22 VAL 57 47.537 29.144 24.373 415 HG23 VAL 57 HG23 VAL 57 47.450 27.612 23.481 416 H ASP 58 H ASP 58 46.585 23.889 25.502 417 HA ASP 58 HA ASP 58 46.179 23.639 28.450 418 HB2 ASP 58 HB2 ASP 58 47.098 21.631 26.345 419 HB3 ASP 58 HB3 ASP 58 47.017 21.326 28.080 420 H LEU 59 H LEU 59 48.104 23.350 29.782 421 HA LEU 59 HA LEU 59 50.704 24.104 28.481 422 HB2 LEU 59 HB2 LEU 59 49.597 25.033 31.140 423 HB3 LEU 59 HB3 LEU 59 51.287 25.172 30.668 424 HG LEU 59 HG LEU 59 48.944 26.544 29.300 425 HD11 LEU 59 HD11 LEU 59 49.670 27.472 31.514 426 HD12 LEU 59 HD12 LEU 59 49.972 28.583 30.166 427 HD13 LEU 59 HD13 LEU 59 51.311 27.650 30.874 428 HD21 LEU 59 HD21 LEU 59 50.724 27.785 28.036 429 HD22 LEU 59 HD22 LEU 59 50.540 26.099 27.573 430 HD23 LEU 59 HD23 LEU 59 51.904 26.577 28.609 431 HA PRO 60 HA PRO 60 51.338 20.087 30.395 432 HB2 PRO 60 HB2 PRO 60 53.541 19.842 28.414 433 HB3 PRO 60 HB3 PRO 60 52.212 18.698 28.787 434 HG2 PRO 60 HG2 PRO 60 52.182 20.177 26.501 435 HG3 PRO 60 HG3 PRO 60 50.681 19.874 27.436 436 HD2 PRO 60 HD2 PRO 60 52.460 22.327 27.493 437 HD3 PRO 60 HD3 PRO 60 50.680 22.214 27.362 438 H LEU 61 H LEU 61 52.872 19.236 31.831 439 HA LEU 61 HA LEU 61 54.670 20.995 33.156 440 HB2 LEU 61 HB2 LEU 61 54.529 17.954 33.169 441 HB3 LEU 61 HB3 LEU 61 55.448 18.923 34.313 442 HG LEU 61 HG LEU 61 52.415 18.951 34.020 443 HD11 LEU 61 HD11 LEU 61 54.234 17.833 36.183 444 HD12 LEU 61 HD12 LEU 61 53.304 16.881 35.002 445 HD13 LEU 61 HD13 LEU 61 52.456 17.851 36.218 446 HD21 LEU 61 HD21 LEU 61 53.171 21.149 34.799 447 HD22 LEU 61 HD22 LEU 61 54.217 20.380 36.024 448 HD23 LEU 61 HD23 LEU 61 52.449 20.255 36.132 449 H ARG 62 H ARG 62 55.281 18.773 30.482 450 HA ARG 62 HA ARG 62 58.205 18.915 30.596 451 HB2 ARG 62 HB2 ARG 62 56.184 17.936 28.599 452 HB3 ARG 62 HB3 ARG 62 57.758 18.405 27.976 453 HG2 ARG 62 HG2 ARG 62 57.804 16.081 28.346 454 HG3 ARG 62 HG3 ARG 62 58.872 16.829 29.536 455 HD2 ARG 62 HD2 ARG 62 57.247 16.461 31.316 456 HD3 ARG 62 HD3 ARG 62 55.997 16.057 30.134 457 HE ARG 62 HE ARG 62 56.725 13.900 30.036 458 HH11 ARG 62 HH11 ARG 62 59.253 15.633 31.807 459 HH12 ARG 62 HH12 ARG 62 60.232 14.162 31.877 460 HH21 ARG 62 HH21 ARG 62 58.218 12.241 30.004 461 HH22 ARG 62 HH22 ARG 62 59.657 12.395 31.025 462 H CYS 63 H CYS 63 55.813 20.691 28.606 463 HA CYS 63 HA CYS 63 57.560 22.583 27.402 464 HB2 CYS 63 HB2 CYS 63 55.261 22.368 26.689 465 HB3 CYS 63 HB3 CYS 63 54.662 22.737 28.313 466 HG CYS 63 HG CYS 63 56.301 24.758 26.206 467 H LEU 64 H LEU 64 55.831 22.762 30.535 468 HA LEU 64 HA LEU 64 56.920 25.229 31.397 469 HB2 LEU 64 HB2 LEU 64 54.895 23.985 32.180 470 HB3 LEU 64 HB3 LEU 64 55.925 22.842 32.983 471 HG LEU 64 HG LEU 64 56.747 24.442 34.571 472 HD11 LEU 64 HD11 LEU 64 56.905 26.484 33.249 473 HD12 LEU 64 HD12 LEU 64 55.896 26.766 34.662 474 HD13 LEU 64 HD13 LEU 64 55.140 26.539 33.056 475 HD21 LEU 64 HD21 LEU 64 54.663 24.994 35.742 476 HD22 LEU 64 HD22 LEU 64 54.566 23.381 35.026 477 HD23 LEU 64 HD23 LEU 64 53.731 24.740 34.245 478 H TYR 65 H TYR 65 58.303 21.936 31.708 479 HA TYR 65 HA TYR 65 60.459 22.748 33.475 480 HB2 TYR 65 HB2 TYR 65 59.619 20.372 33.045 481 HB3 TYR 65 HB3 TYR 65 60.486 20.419 31.526 482 HD1 TYR 65 HD1 TYR 65 60.699 19.869 35.089 483 HD2 TYR 65 HD2 TYR 65 63.066 20.804 31.597 484 HE1 TYR 65 HE1 TYR 65 62.753 19.140 36.280 485 HE2 TYR 65 HE2 TYR 65 65.120 20.103 32.811 486 HH TYR 65 HH TYR 65 66.012 19.347 34.811 487 H GLU 66 H GLU 66 60.120 22.445 29.911 488 HA GLU 66 HA GLU 66 62.956 23.084 29.551 489 HB2 GLU 66 HB2 GLU 66 62.728 22.573 27.306 490 HB3 GLU 66 HB3 GLU 66 61.798 21.372 28.193 491 HG2 GLU 66 HG2 GLU 66 59.706 22.532 27.573 492 HG3 GLU 66 HG3 GLU 66 60.620 23.772 26.715 493 H ALA 67 H ALA 67 59.941 24.910 29.078 494 HA ALA 67 HA ALA 67 61.535 27.371 28.520 495 HB1 ALA 67 HB1 ALA 67 59.919 27.870 26.707 496 HB2 ALA 67 HB2 ALA 67 60.840 26.390 26.384 497 HB3 ALA 67 HB3 ALA 67 59.155 26.290 26.951 498 HA PRO 68 HA PRO 68 58.088 27.920 31.708 499 HB2 PRO 68 HB2 PRO 68 59.577 28.959 33.793 500 HB3 PRO 68 HB3 PRO 68 59.325 27.218 33.519 501 HG2 PRO 68 HG2 PRO 68 61.655 28.929 32.600 502 HG3 PRO 68 HG3 PRO 68 61.729 27.373 33.496 503 HD2 PRO 68 HD2 PRO 68 62.033 27.429 30.826 504 HD3 PRO 68 HD3 PRO 68 61.017 26.160 31.571 505 H THR 69 H THR 69 60.262 30.113 30.115 506 HA THR 69 HA THR 69 59.021 32.525 31.305 507 HB THR 69 HB THR 69 60.518 33.802 29.825 508 HG1 THR 69 HG1 THR 69 61.941 32.913 28.610 509 HG21 THR 69 HG21 THR 69 61.986 31.677 31.452 510 HG22 THR 69 HG22 THR 69 61.253 33.142 32.120 511 HG23 THR 69 HG23 THR 69 62.605 33.274 30.982 512 H VAL 70 H VAL 70 57.574 33.880 30.305 513 HA VAL 70 HA VAL 70 55.618 32.348 29.118 514 HB VAL 70 HB VAL 70 55.541 35.382 28.946 515 HG11 VAL 70 HG11 VAL 70 53.598 34.205 27.971 516 HG12 VAL 70 HG12 VAL 70 53.407 33.255 29.462 517 HG13 VAL 70 HG13 VAL 70 53.129 35.005 29.473 518 HG21 VAL 70 HG21 VAL 70 56.290 35.022 31.180 519 HG22 VAL 70 HG22 VAL 70 54.547 35.221 31.292 520 HG23 VAL 70 HG23 VAL 70 55.263 33.588 31.371 521 H ALA 71 H ALA 71 57.667 34.692 27.304 522 HA ALA 71 HA ALA 71 56.164 34.446 24.847 523 HB1 ALA 71 HB1 ALA 71 57.673 36.348 25.429 524 HB2 ALA 71 HB2 ALA 71 59.065 35.247 25.349 525 HB3 ALA 71 HB3 ALA 71 58.121 35.595 23.883 526 H ARG 72 H ARG 72 58.723 32.592 26.307 527 HA ARG 72 HA ARG 72 59.485 31.101 23.886 528 HB2 ARG 72 HB2 ARG 72 60.963 32.074 25.714 529 HB3 ARG 72 HB3 ARG 72 60.362 30.808 26.786 530 HG2 ARG 72 HG2 ARG 72 61.409 29.096 25.461 531 HG3 ARG 72 HG3 ARG 72 61.770 30.234 24.138 532 HD2 ARG 72 HD2 ARG 72 63.383 31.400 25.380 533 HD3 ARG 72 HD3 ARG 72 62.723 30.873 26.933 534 HE ARG 72 HE ARG 72 63.728 28.635 25.380 535 HH11 ARG 72 HH11 ARG 72 64.934 31.265 27.382 536 HH12 ARG 72 HH12 ARG 72 66.209 30.249 28.045 537 HH21 ARG 72 HH21 ARG 72 65.179 27.455 26.401 538 HH22 ARG 72 HH22 ARG 72 66.255 28.097 27.603 539 H LEU 73 H LEU 73 57.904 30.442 27.006 540 HA LEU 73 HA LEU 73 56.818 27.879 26.636 541 HB2 LEU 73 HB2 LEU 73 56.639 29.492 28.625 542 HB3 LEU 73 HB3 LEU 73 55.489 30.406 27.724 543 HG LEU 73 HG LEU 73 54.383 27.823 27.632 544 HD11 LEU 73 HD11 LEU 73 54.364 27.055 29.981 545 HD12 LEU 73 HD12 LEU 73 55.493 28.365 30.423 546 HD13 LEU 73 HD13 LEU 73 56.016 27.054 29.349 547 HD21 LEU 73 HD21 LEU 73 53.180 29.938 27.945 548 HD22 LEU 73 HD22 LEU 73 53.871 30.112 29.575 549 HD23 LEU 73 HD23 LEU 73 52.747 28.784 29.221 550 H ALA 74 H ALA 74 55.232 31.022 25.720 551 HA ALA 74 HA ALA 74 53.132 29.983 24.183 552 HB1 ALA 74 HB1 ALA 74 53.377 32.327 24.922 553 HB2 ALA 74 HB2 ALA 74 54.704 32.553 23.767 554 HB3 ALA 74 HB3 ALA 74 53.063 32.217 23.173 555 H GLU 75 H GLU 75 56.484 30.811 23.052 556 HA GLU 75 HA GLU 75 56.005 30.192 20.324 557 HB2 GLU 75 HB2 GLU 75 57.979 31.398 21.301 558 HB3 GLU 75 HB3 GLU 75 58.652 29.837 21.782 559 HG2 GLU 75 HG2 GLU 75 58.583 29.135 19.370 560 HG3 GLU 75 HG3 GLU 75 57.976 30.747 18.951 561 H THR 76 H THR 76 57.252 28.000 22.906 562 HA THR 76 HA THR 76 57.394 25.646 21.253 563 HB THR 76 HB THR 76 57.399 24.346 23.322 564 HG1 THR 76 HG1 THR 76 56.671 26.767 24.529 565 HG21 THR 76 HG21 THR 76 59.179 26.801 23.455 566 HG22 THR 76 HG22 THR 76 59.521 25.241 22.686 567 HG23 THR 76 HG23 THR 76 59.367 25.334 24.441 568 H ILE 77 H ILE 77 54.764 26.863 23.337 569 HA ILE 77 HA ILE 77 52.941 24.720 22.981 570 HB ILE 77 HB ILE 77 52.698 27.657 23.678 571 HG12 ILE 77 HG12 ILE 77 53.723 26.177 25.349 572 HG13 ILE 77 HG13 ILE 77 52.228 26.891 25.911 573 HG21 ILE 77 HG21 ILE 77 50.554 27.235 22.644 574 HG22 ILE 77 HG22 ILE 77 50.330 25.764 23.610 575 HG23 ILE 77 HG23 ILE 77 50.378 27.359 24.388 576 HD11 ILE 77 HD11 ILE 77 52.381 24.588 26.648 577 HD12 ILE 77 HD12 ILE 77 51.071 24.693 25.466 578 HD13 ILE 77 HD13 ILE 77 52.643 24.001 25.003 579 H VAL 78 H VAL 78 53.301 27.716 21.044 580 HA VAL 78 HA VAL 78 51.203 26.965 19.171 581 HB VAL 78 HB VAL 78 53.414 29.048 19.057 582 HG11 VAL 78 HG11 VAL 78 52.118 30.080 17.212 583 HG12 VAL 78 HG12 VAL 78 52.780 28.517 16.739 584 HG13 VAL 78 HG13 VAL 78 51.058 28.653 17.160 585 HG21 VAL 78 HG21 VAL 78 51.626 29.421 20.773 586 HG22 VAL 78 HG22 VAL 78 51.560 30.610 19.472 587 HG23 VAL 78 HG23 VAL 78 50.399 29.264 19.505 588 H ARG 79 H ARG 79 54.789 26.623 19.141 589 HA ARG 79 HA ARG 79 54.946 25.668 16.453 590 HB2 ARG 79 HB2 ARG 79 56.884 26.526 17.625 591 HB3 ARG 79 HB3 ARG 79 56.766 25.279 18.858 592 HG2 ARG 79 HG2 ARG 79 58.579 24.779 17.339 593 HG3 ARG 79 HG3 ARG 79 57.336 23.538 17.171 594 HD2 ARG 79 HD2 ARG 79 56.504 24.664 15.105 595 HD3 ARG 79 HD3 ARG 79 57.739 25.927 15.321 596 HE ARG 79 HE ARG 79 59.061 23.418 15.315 597 HH11 ARG 79 HH11 ARG 79 57.388 25.390 12.902 598 HH12 ARG 79 HH12 ARG 79 58.301 24.622 11.614 599 HH21 ARG 79 HH21 ARG 79 60.208 22.729 13.760 600 HH22 ARG 79 HH22 ARG 79 59.984 23.266 12.093 601 H LEU 80 H LEU 80 54.747 23.789 19.520 602 HA LEU 80 HA LEU 80 54.495 21.280 17.997 603 HB2 LEU 80 HB2 LEU 80 54.686 21.854 20.976 604 HB3 LEU 80 HB3 LEU 80 54.449 20.260 20.279 605 HG LEU 80 HG LEU 80 56.598 20.732 18.876 606 HD11 LEU 80 HD11 LEU 80 57.049 22.651 21.203 607 HD12 LEU 80 HD12 LEU 80 56.962 23.101 19.492 608 HD13 LEU 80 HD13 LEU 80 58.277 22.083 20.048 609 HD21 LEU 80 HD21 LEU 80 57.987 19.844 20.716 610 HD22 LEU 80 HD22 LEU 80 56.419 19.044 20.647 611 HD23 LEU 80 HD23 LEU 80 56.712 20.279 21.889 612 H ALA 81 H ALA 81 52.241 23.562 18.568 613 HA ALA 81 HA ALA 81 50.080 22.511 19.816 614 HB1 ALA 81 HB1 ALA 81 50.100 24.129 17.242 615 HB2 ALA 81 HB2 ALA 81 48.722 23.982 18.354 616 HB3 ALA 81 HB3 ALA 81 50.202 24.786 18.885 617 H ALA 82 H ALA 82 48.292 21.309 19.408 618 HA ALA 82 HA ALA 82 48.474 19.172 17.489 619 HB1 ALA 82 HB1 ALA 82 47.626 18.888 19.793 620 HB2 ALA 82 HB2 ALA 82 46.263 19.956 19.431 621 HB3 ALA 82 HB3 ALA 82 46.413 18.395 18.603 622 HA PRO 83 HA PRO 83 46.101 20.498 13.967 623 HB2 PRO 83 HB2 PRO 83 44.365 18.093 14.624 624 HB3 PRO 83 HB3 PRO 83 44.917 18.660 13.029 625 HG2 PRO 83 HG2 PRO 83 46.275 16.689 14.237 626 HG3 PRO 83 HG3 PRO 83 47.187 18.054 13.508 627 HD2 PRO 83 HD2 PRO 83 46.496 17.594 16.405 628 HD3 PRO 83 HD3 PRO 83 48.025 18.164 15.676 629 H ALA 84 H ALA 84 44.643 21.962 13.594 630 HA ALA 84 HA ALA 84 42.986 23.443 13.708 631 HB1 ALA 84 HB1 ALA 84 41.780 21.564 12.817 632 HB2 ALA 84 HB2 ALA 84 41.355 21.004 14.443 633 HB3 ALA 84 HB3 ALA 84 40.715 22.545 13.842 634 HA PRO 85 HA PRO 85 43.301 24.534 18.217 635 HB2 PRO 85 HB2 PRO 85 43.930 27.142 16.842 636 HB3 PRO 85 HB3 PRO 85 44.669 26.442 18.311 637 HG2 PRO 85 HG2 PRO 85 45.967 26.354 15.946 638 HG3 PRO 85 HG3 PRO 85 45.968 24.914 17.025 639 HD2 PRO 85 HD2 PRO 85 44.233 25.458 14.597 640 HD3 PRO 85 HD3 PRO 85 45.128 23.974 15.044 641 H SER 86 H SER 86 41.766 25.735 19.432 642 HA SER 86 HA SER 86 39.703 27.317 18.010 643 HB2 SER 86 HB2 SER 86 39.013 24.885 17.886 644 HB3 SER 86 HB3 SER 86 38.894 24.899 19.658 645 HG SER 86 HG SER 86 36.900 25.357 18.736 646 H GLY 87 H GLY 87 38.765 28.907 19.265 647 HA2 GLY 87 HA2 GLY 87 38.849 28.940 22.160 648 HA3 GLY 87 HA3 GLY 87 40.115 29.921 21.413 649 H ASP 88 H ASP 88 38.908 31.595 22.629 650 HA ASP 88 HA ASP 88 36.515 32.648 21.229 651 HB2 ASP 88 HB2 ASP 88 36.187 31.823 23.568 652 HB3 ASP 88 HB3 ASP 88 37.368 33.010 24.111 653 H GLN 89 H GLN 89 39.764 33.405 22.211 654 HA GLN 89 HA GLN 89 39.662 35.898 20.680 655 HB2 GLN 89 HB2 GLN 89 40.762 37.242 22.423 656 HB3 GLN 89 HB3 GLN 89 39.148 36.728 22.874 657 HG2 GLN 89 HG2 GLN 89 40.014 36.187 24.835 658 HG3 GLN 89 HG3 GLN 89 40.637 34.751 24.035 659 HE21 GLN 89 HE21 GLN 89 42.966 35.221 22.956 660 HE22 GLN 89 HE22 GLN 89 44.038 36.322 23.836 661 H ASP 90 H ASP 90 41.411 36.067 19.439 662 HA ASP 90 HA ASP 90 43.892 34.518 20.059 663 HB2 ASP 90 HB2 ASP 90 42.241 34.397 17.497 664 HB3 ASP 90 HB3 ASP 90 43.874 33.769 17.677 665 H ASP 91 H ASP 91 45.716 35.661 19.554 666 HA ASP 91 HA ASP 91 47.118 37.277 18.851 667 HB2 ASP 91 HB2 ASP 91 46.420 36.434 16.596 668 HB3 ASP 91 HB3 ASP 91 45.255 37.755 16.514 669 H ALA 92 H ALA 92 44.964 37.726 20.647 670 HA ALA 92 HA ALA 92 43.556 40.121 20.074 671 HB1 ALA 92 HB1 ALA 92 43.686 38.586 22.694 672 HB2 ALA 92 HB2 ALA 92 42.379 39.650 22.136 673 HB3 ALA 92 HB3 ALA 92 42.695 38.125 21.290 674 H SER 93 H SER 93 46.513 40.477 20.511 675 HA SER 93 HA SER 93 46.356 43.067 21.847 676 HB2 SER 93 HB2 SER 93 48.299 40.942 22.851 677 HB3 SER 93 HB3 SER 93 48.378 42.670 23.240 678 HG SER 93 HG SER 93 46.479 40.731 23.997 679 H GLU 94 H GLU 94 48.214 44.359 21.440 680 HA GLU 94 HA GLU 94 49.068 44.498 18.817 681 HB2 GLU 94 HB2 GLU 94 50.561 46.281 19.639 682 HB3 GLU 94 HB3 GLU 94 48.944 46.366 20.327 683 HG2 GLU 94 HG2 GLU 94 49.970 45.080 22.379 684 HG3 GLU 94 HG3 GLU 94 51.512 45.490 21.651 685 H TYR 95 H TYR 95 51.172 44.633 17.877 686 HA TYR 95 HA TYR 95 53.297 42.807 18.835 687 HB2 TYR 95 HB2 TYR 95 51.823 41.367 17.518 688 HB3 TYR 95 HB3 TYR 95 51.778 42.543 16.215 689 HD1 TYR 95 HD1 TYR 95 53.468 42.592 14.513 690 HD2 TYR 95 HD2 TYR 95 54.016 40.174 18.038 691 HE1 TYR 95 HE1 TYR 95 55.501 41.565 13.505 692 HE2 TYR 95 HE2 TYR 95 56.057 39.159 17.027 693 HH TYR 95 HH TYR 95 57.462 39.096 15.169 694 H GLU 96 H GLU 96 55.335 43.214 17.862 695 HA GLU 96 HA GLU 96 55.564 45.086 15.654 696 HB2 GLU 96 HB2 GLU 96 57.341 46.447 16.652 697 HB3 GLU 96 HB3 GLU 96 55.784 46.696 17.433 698 HG2 GLU 96 HG2 GLU 96 56.502 45.298 19.351 699 HG3 GLU 96 HG3 GLU 96 58.048 44.985 18.553 700 H GLU 97 H GLU 97 57.418 44.725 14.399 701 HA GLU 97 HA GLU 97 58.634 42.082 14.738 702 HB2 GLU 97 HB2 GLU 97 57.849 42.978 12.538 703 HB3 GLU 97 HB3 GLU 97 59.065 44.246 12.647 704 HG2 GLU 97 HG2 GLU 97 60.023 42.695 11.211 705 HG3 GLU 97 HG3 GLU 97 60.827 42.350 12.732 706 H GLY 98 H GLY 98 59.788 45.492 14.711 707 HA2 GLY 98 HA2 GLY 98 61.535 46.488 15.838 708 HA3 GLY 98 HA3 GLY 98 61.961 44.951 16.587 709 H VAL 99 H VAL 99 61.750 44.918 13.133 710 HA VAL 99 HA VAL 99 63.257 44.189 11.601 711 HB VAL 99 HB VAL 99 65.091 46.416 12.503 712 HG11 VAL 99 HG11 VAL 99 65.531 46.622 10.101 713 HG12 VAL 99 HG12 VAL 99 65.829 44.950 10.584 714 HG13 VAL 99 HG13 VAL 99 64.328 45.369 9.739 715 HG21 VAL 99 HG21 VAL 99 62.865 47.422 12.465 716 HG22 VAL 99 HG22 VAL 99 63.769 47.926 11.043 717 HG23 VAL 99 HG23 VAL 99 62.526 46.671 10.885 718 H ILE 100 H ILE 100 63.305 42.528 13.589 719 HA ILE 100 HA ILE 100 65.639 42.381 15.147 720 HB ILE 100 HB ILE 100 63.357 41.642 15.746 721 HG12 ILE 100 HG12 ILE 100 65.484 39.531 16.173 722 HG13 ILE 100 HG13 ILE 100 65.385 41.063 17.044 723 HG21 ILE 100 HG21 ILE 100 63.969 39.126 14.130 724 HG22 ILE 100 HG22 ILE 100 62.541 39.422 15.112 725 HG23 ILE 100 HG23 ILE 100 62.801 40.379 13.659 726 HD11 ILE 100 HD11 ILE 100 64.432 39.334 18.424 727 HD12 ILE 100 HD12 ILE 100 63.122 40.410 17.896 728 HD13 ILE 100 HD13 ILE 100 63.341 38.811 17.142 729 H ARG 101 H ARG 101 67.432 41.052 15.196 730 HA ARG 101 HA ARG 101 67.974 39.187 12.933 731 HB2 ARG 101 HB2 ARG 101 69.843 41.376 13.940 732 HB3 ARG 101 HB3 ARG 101 70.286 40.118 12.792 733 HG2 ARG 101 HG2 ARG 101 68.158 42.249 12.286 734 HG3 ARG 101 HG3 ARG 101 69.825 42.322 11.737 735 HD2 ARG 101 HD2 ARG 101 69.526 40.327 10.353 736 HD3 ARG 101 HD3 ARG 101 67.879 40.109 10.939 737 HE ARG 101 HE ARG 101 68.804 41.951 8.880 738 HH11 ARG 101 HH11 ARG 101 66.071 41.175 10.968 739 HH12 ARG 101 HH12 ARG 101 64.972 42.063 9.937 740 HH21 ARG 101 HH21 ARG 101 67.377 43.292 7.847 741 HH22 ARG 101 HH22 ARG 101 65.675 43.150 8.211 Start of MODEL 8 1 H GLY 1 H1 GLY 1 53.097 61.340 43.106 2 HA2 GLY 1 HA2 GLY 1 51.492 58.990 43.870 3 HA3 GLY 1 HA3 GLY 1 50.827 60.492 43.194 4 H ALA 2 H ALA 2 50.007 59.051 41.459 5 HA ALA 2 HA ALA 2 51.996 58.800 39.259 6 HB1 ALA 2 HB1 ALA 2 51.863 56.598 40.396 7 HB2 ALA 2 HB2 ALA 2 50.106 56.569 40.115 8 HB3 ALA 2 HB3 ALA 2 51.232 56.534 38.739 9 H ALA 3 H ALA 3 51.209 58.960 37.178 10 HA ALA 3 HA ALA 3 48.368 59.809 36.820 11 HB1 ALA 3 HB1 ALA 3 49.188 60.975 34.825 12 HB2 ALA 3 HB2 ALA 3 50.030 61.523 36.288 13 HB3 ALA 3 HB3 ALA 3 50.840 60.412 35.158 14 H ALA 4 H ALA 4 47.026 58.601 35.683 15 HA ALA 4 HA ALA 4 47.590 55.934 35.112 16 HB1 ALA 4 HB1 ALA 4 45.264 57.678 34.197 17 HB2 ALA 4 HB2 ALA 4 45.273 55.904 34.247 18 HB3 ALA 4 HB3 ALA 4 45.392 56.827 35.755 19 H GLY 5 H GLY 5 47.915 54.679 33.289 20 HA2 GLY 5 HA2 GLY 5 47.452 55.504 30.601 21 HA3 GLY 5 HA3 GLY 5 49.154 55.763 30.968 22 H VAL 6 H VAL 6 49.030 54.246 29.042 23 HA VAL 6 HA VAL 6 49.749 52.375 28.077 24 HB VAL 6 HB VAL 6 50.288 51.242 30.827 25 HG11 VAL 6 HG11 VAL 6 50.419 49.519 29.058 26 HG12 VAL 6 HG12 VAL 6 51.514 50.566 28.121 27 HG13 VAL 6 HG13 VAL 6 52.014 49.909 29.685 28 HG21 VAL 6 HG21 VAL 6 52.612 52.068 30.392 29 HG22 VAL 6 HG22 VAL 6 51.988 52.978 28.996 30 HG23 VAL 6 HG23 VAL 6 51.447 53.365 30.643 31 H SER 7 H SER 7 48.820 50.762 27.023 32 HA SER 7 HA SER 7 46.345 49.547 28.184 33 HB2 SER 7 HB2 SER 7 46.207 50.861 26.026 34 HB3 SER 7 HB3 SER 7 47.143 49.552 25.265 35 HG SER 7 HG SER 7 45.352 48.454 25.202 36 H ALA 8 H ALA 8 45.901 47.280 27.788 37 HA ALA 8 HA ALA 8 48.124 45.731 28.656 38 HB1 ALA 8 HB1 ALA 8 45.327 44.857 27.826 39 HB2 ALA 8 HB2 ALA 8 46.485 43.904 28.766 40 HB3 ALA 8 HB3 ALA 8 45.827 45.406 29.443 41 H ALA 9 H ALA 9 46.992 46.156 25.315 42 HA ALA 9 HA ALA 9 48.521 43.775 24.451 43 HB1 ALA 9 HB1 ALA 9 46.332 44.474 23.357 44 HB2 ALA 9 HB2 ALA 9 47.244 45.835 22.652 45 HB3 ALA 9 HB3 ALA 9 47.703 44.175 22.270 46 H GLY 10 H GLY 10 50.318 43.887 23.034 47 HA2 GLY 10 HA2 GLY 10 51.823 46.419 22.727 48 HA3 GLY 10 HA3 GLY 10 52.523 45.193 23.790 49 H ILE 11 H ILE 11 54.294 44.606 22.545 50 HA ILE 11 HA ILE 11 53.750 43.488 19.819 51 HB ILE 11 HB ILE 11 56.133 43.462 19.446 52 HG12 ILE 11 HG12 ILE 11 56.465 44.937 22.094 53 HG13 ILE 11 HG13 ILE 11 56.872 43.238 21.838 54 HG21 ILE 11 HG21 ILE 11 54.679 45.407 18.824 55 HG22 ILE 11 HG22 ILE 11 55.193 46.229 20.313 56 HG23 ILE 11 HG23 ILE 11 56.374 45.835 19.051 57 HD11 ILE 11 HD11 ILE 11 58.501 43.911 20.069 58 HD12 ILE 11 HD12 ILE 11 58.189 45.617 20.480 59 HD13 ILE 11 HD13 ILE 11 58.891 44.525 21.685 60 H GLU 12 H GLU 12 54.436 42.555 23.074 61 HA GLU 12 HA GLU 12 55.362 39.871 22.594 62 HB2 GLU 12 HB2 GLU 12 53.863 41.008 24.987 63 HB3 GLU 12 HB3 GLU 12 54.864 39.565 24.956 64 HG2 GLU 12 HG2 GLU 12 56.510 40.850 25.726 65 HG3 GLU 12 HG3 GLU 12 56.680 41.460 24.088 66 HA PRO 13 HA PRO 13 51.603 37.786 21.484 67 HB2 PRO 13 HB2 PRO 13 51.684 35.402 22.902 68 HB3 PRO 13 HB3 PRO 13 52.640 35.761 21.433 69 HG2 PRO 13 HG2 PRO 13 53.495 36.015 24.333 70 HG3 PRO 13 HG3 PRO 13 54.387 35.253 22.974 71 HD2 PRO 13 HD2 PRO 13 54.972 37.751 23.756 72 HD3 PRO 13 HD3 PRO 13 54.913 37.355 22.015 73 H ASP 14 H ASP 14 49.438 37.441 22.120 74 HA ASP 14 HA ASP 14 48.477 39.050 24.221 75 HB2 ASP 14 HB2 ASP 14 47.302 38.584 22.203 76 HB3 ASP 14 HB3 ASP 14 47.165 36.866 22.577 77 H LEU 15 H LEU 15 49.409 35.705 24.422 78 HA LEU 15 HA LEU 15 48.311 34.828 26.839 79 HB2 LEU 15 HB2 LEU 15 50.272 34.005 25.122 80 HB3 LEU 15 HB3 LEU 15 51.289 34.588 26.422 81 HG LEU 15 HG LEU 15 49.085 32.484 26.643 82 HD11 LEU 15 HD11 LEU 15 50.913 30.876 26.855 83 HD12 LEU 15 HD12 LEU 15 52.115 32.175 26.692 84 HD13 LEU 15 HD13 LEU 15 51.054 31.754 25.325 85 HD21 LEU 15 HD21 LEU 15 49.357 33.527 28.815 86 HD22 LEU 15 HD22 LEU 15 51.126 33.427 28.702 87 HD23 LEU 15 HD23 LEU 15 50.151 31.953 28.852 88 H THR 16 H THR 16 50.731 37.455 26.349 89 HA THR 16 HA THR 16 51.340 37.619 29.222 90 HB THR 16 HB THR 16 52.584 39.573 28.797 91 HG1 THR 16 HG1 THR 16 52.541 40.720 27.087 92 HG21 THR 16 HG21 THR 16 54.276 38.819 27.231 93 HG22 THR 16 HG22 THR 16 53.147 37.650 26.509 94 HG23 THR 16 HG23 THR 16 53.698 37.451 28.191 95 H ALA 17 H ALA 17 49.115 39.278 27.008 96 HA ALA 17 HA ALA 17 48.233 41.297 28.856 97 HB1 ALA 17 HB1 ALA 17 47.950 41.458 26.420 98 HB2 ALA 17 HB2 ALA 17 46.842 40.075 26.445 99 HB3 ALA 17 HB3 ALA 17 46.397 41.588 27.265 100 H ILE 18 H ILE 18 47.027 38.024 28.025 101 HA ILE 18 HA ILE 18 44.900 37.901 29.953 102 HB ILE 18 HB ILE 18 46.609 35.688 28.747 103 HG12 ILE 18 HG12 ILE 18 43.808 36.619 27.949 104 HG13 ILE 18 HG13 ILE 18 45.273 37.131 27.124 105 HG21 ILE 18 HG21 ILE 18 45.486 34.878 30.802 106 HG22 ILE 18 HG22 ILE 18 43.931 35.502 30.212 107 HG23 ILE 18 HG23 ILE 18 44.745 34.154 29.388 108 HD11 ILE 18 HD11 ILE 18 44.360 35.375 25.829 109 HD12 ILE 18 HD12 ILE 18 45.799 34.721 26.631 110 HD13 ILE 18 HD13 ILE 18 44.168 34.315 27.229 111 H TRP 19 H TRP 19 48.427 37.150 30.269 112 HA TRP 19 HA TRP 19 48.041 36.142 32.980 113 HB2 TRP 19 HB2 TRP 19 50.439 36.641 31.239 114 HB3 TRP 19 HB3 TRP 19 50.627 36.375 32.962 115 HD1 TRP 19 HD1 TRP 19 47.841 34.358 31.465 116 HE1 TRP 19 HE1 TRP 19 48.470 31.876 31.436 117 HE3 TRP 19 HE3 TRP 19 52.852 34.757 32.492 118 HZ2 TRP 19 HZ2 TRP 19 50.819 30.270 31.763 119 HZ3 TRP 19 HZ3 TRP 19 54.247 32.699 32.680 120 HH2 TRP 19 HH2 TRP 19 53.249 30.466 32.295 121 H GLN 20 H GLN 20 49.170 39.360 31.746 122 HA GLN 20 HA GLN 20 49.407 40.369 34.440 123 HB2 GLN 20 HB2 GLN 20 49.529 42.584 33.504 124 HB3 GLN 20 HB3 GLN 20 50.521 41.469 32.602 125 HG2 GLN 20 HG2 GLN 20 49.669 42.535 30.829 126 HG3 GLN 20 HG3 GLN 20 48.471 41.300 31.006 127 HE21 GLN 20 HE21 GLN 20 46.370 41.944 31.037 128 HE22 GLN 20 HE22 GLN 20 45.845 43.539 31.585 129 H ALA 21 H ALA 21 46.543 40.036 32.299 130 HA ALA 21 HA ALA 21 44.789 41.547 33.983 131 HB1 ALA 21 HB1 ALA 21 43.012 40.269 32.788 132 HB2 ALA 21 HB2 ALA 21 44.206 40.986 31.692 133 HB3 ALA 21 HB3 ALA 21 44.253 39.247 32.057 134 H LEU 22 H LEU 22 45.513 38.023 33.954 135 HA LEU 22 HA LEU 22 43.714 37.429 36.141 136 HB2 LEU 22 HB2 LEU 22 45.918 35.923 34.685 137 HB3 LEU 22 HB3 LEU 22 45.007 35.207 35.987 138 HG LEU 22 HG LEU 22 43.799 36.252 33.373 139 HD11 LEU 22 HD11 LEU 22 45.190 34.196 33.164 140 HD12 LEU 22 HD12 LEU 22 43.471 33.885 32.858 141 HD13 LEU 22 HD13 LEU 22 44.187 33.442 34.430 142 HD21 LEU 22 HD21 LEU 22 42.101 36.403 35.117 143 HD22 LEU 22 HD22 LEU 22 42.502 34.776 35.710 144 HD23 LEU 22 HD23 LEU 22 41.756 35.004 34.112 145 H PHE 23 H PHE 23 47.295 37.717 35.949 146 HA PHE 23 HA PHE 23 47.586 37.252 38.792 147 HB2 PHE 23 HB2 PHE 23 49.511 38.348 36.746 148 HB3 PHE 23 HB3 PHE 23 49.973 37.798 38.342 149 HD1 PHE 23 HD1 PHE 23 51.192 36.927 35.739 150 HD2 PHE 23 HD2 PHE 23 47.980 35.216 38.038 151 HE1 PHE 23 HE1 PHE 23 51.610 34.721 34.694 152 HE2 PHE 23 HE2 PHE 23 48.362 33.023 36.943 153 HZ PHE 23 HZ PHE 23 50.159 32.785 35.229 154 H ALA 24 H ALA 24 46.265 39.865 37.328 155 HA ALA 24 HA ALA 24 45.983 42.045 37.723 156 HB1 ALA 24 HB1 ALA 24 46.439 41.214 40.607 157 HB2 ALA 24 HB2 ALA 24 45.579 42.663 40.046 158 HB3 ALA 24 HB3 ALA 24 44.923 41.060 39.691 159 H LEU 25 H LEU 25 48.742 41.280 37.084 160 HA LEU 25 HA LEU 25 50.516 43.120 38.486 161 HB2 LEU 25 HB2 LEU 25 50.772 41.377 36.006 162 HB3 LEU 25 HB3 LEU 25 52.067 42.430 36.541 163 HG LEU 25 HG LEU 25 50.923 40.246 38.318 164 HD11 LEU 25 HD11 LEU 25 52.971 38.981 37.663 165 HD12 LEU 25 HD12 LEU 25 53.327 40.233 36.443 166 HD13 LEU 25 HD13 LEU 25 51.860 39.241 36.310 167 HD21 LEU 25 HD21 LEU 25 53.537 41.832 38.410 168 HD22 LEU 25 HD22 LEU 25 53.062 40.528 39.519 169 HD23 LEU 25 HD23 LEU 25 52.158 42.044 39.513 170 HA PRO 26 HA PRO 26 49.962 46.604 35.673 171 HB2 PRO 26 HB2 PRO 26 52.333 47.910 35.883 172 HB3 PRO 26 HB3 PRO 26 51.173 47.801 37.244 173 HG2 PRO 26 HG2 PRO 26 53.611 46.057 36.758 174 HG3 PRO 26 HG3 PRO 26 53.161 46.926 38.260 175 HD2 PRO 26 HD2 PRO 26 52.544 44.302 37.878 176 HD3 PRO 26 HD3 PRO 26 51.439 45.403 38.753 177 H ALA 27 H ALA 27 52.598 44.305 35.293 178 HA ALA 27 HA ALA 27 52.450 44.367 32.368 179 HB1 ALA 27 HB1 ALA 27 54.893 44.745 32.150 180 HB2 ALA 27 HB2 ALA 27 54.113 46.132 32.934 181 HB3 ALA 27 HB3 ALA 27 55.029 44.962 33.908 182 H VAL 28 H VAL 28 53.422 42.502 31.427 183 HA VAL 28 HA VAL 28 54.782 40.470 33.080 184 HB VAL 28 HB VAL 28 52.242 39.889 31.498 185 HG11 VAL 28 HG11 VAL 28 54.373 37.908 32.411 186 HG12 VAL 28 HG12 VAL 28 52.733 37.460 31.886 187 HG13 VAL 28 HG13 VAL 28 53.841 38.203 30.740 188 HG21 VAL 28 HG21 VAL 28 51.983 40.345 33.940 189 HG22 VAL 28 HG22 VAL 28 51.602 38.665 33.546 190 HG23 VAL 28 HG23 VAL 28 53.164 39.072 34.284 191 H GLY 29 H GLY 29 56.681 40.110 31.981 192 HA2 GLY 29 HA2 GLY 29 56.712 39.160 29.281 193 HA3 GLY 29 HA3 GLY 29 57.044 40.887 29.270 194 H ARG 30 H ARG 30 59.061 40.981 28.722 195 HA ARG 30 HA ARG 30 61.290 40.545 28.481 196 HB2 ARG 30 HB2 ARG 30 60.834 42.120 30.522 197 HB3 ARG 30 HB3 ARG 30 61.364 40.778 31.506 198 HG2 ARG 30 HG2 ARG 30 63.263 42.160 31.195 199 HG3 ARG 30 HG3 ARG 30 63.543 40.804 30.097 200 HD2 ARG 30 HD2 ARG 30 62.737 42.192 28.192 201 HD3 ARG 30 HD3 ARG 30 62.412 43.524 29.321 202 HE ARG 30 HE ARG 30 65.172 42.472 29.285 203 HH11 ARG 30 HH11 ARG 30 63.127 44.824 27.635 204 HH12 ARG 30 HH12 ARG 30 64.521 45.841 27.327 205 HH21 ARG 30 HH21 ARG 30 66.824 43.967 28.939 206 HH22 ARG 30 HH22 ARG 30 66.429 45.417 28.043 207 H HIS 31 H HIS 31 62.609 39.204 31.129 208 HA HIS 31 HA HIS 31 62.219 36.405 30.195 209 HB2 HIS 31 HB2 HIS 31 64.692 37.920 30.944 210 HB3 HIS 31 HB3 HIS 31 64.607 36.213 31.346 211 HD1 HIS 31 HD1 HIS 31 63.978 38.282 28.072 212 HD2 HIS 31 HD2 HIS 31 65.164 34.513 29.531 213 HE1 HIS 31 HE1 HIS 31 64.737 36.949 26.058 214 H GLN 32 H GLN 32 60.430 37.687 32.044 215 HA GLN 32 HA GLN 32 61.088 36.467 34.641 216 HB2 GLN 32 HB2 GLN 32 58.703 38.049 33.648 217 HB3 GLN 32 HB3 GLN 32 58.813 37.346 35.268 218 HG2 GLN 32 HG2 GLN 32 60.924 39.267 34.206 219 HG3 GLN 32 HG3 GLN 32 59.467 39.792 35.040 220 HE21 GLN 32 HE21 GLN 32 59.441 39.774 37.288 221 HE22 GLN 32 HE22 GLN 32 60.709 39.011 38.252 222 H ASP 33 H ASP 33 60.163 34.801 35.605 223 HA ASP 33 HA ASP 33 59.037 32.753 33.801 224 HB2 ASP 33 HB2 ASP 33 60.202 31.195 35.281 225 HB3 ASP 33 HB3 ASP 33 61.294 32.403 34.611 226 H PHE 34 H PHE 34 57.453 31.328 34.379 227 HA PHE 34 HA PHE 34 55.313 32.225 35.875 228 HB2 PHE 34 HB2 PHE 34 55.104 30.626 34.117 229 HB3 PHE 34 HB3 PHE 34 56.024 29.409 35.000 230 HD1 PHE 34 HD1 PHE 34 52.862 31.443 35.098 231 HD2 PHE 34 HD2 PHE 34 54.944 27.960 36.572 232 HE1 PHE 34 HE1 PHE 34 50.789 30.673 36.231 233 HE2 PHE 34 HE2 PHE 34 52.869 27.200 37.691 234 HZ PHE 34 HZ PHE 34 50.788 28.547 37.513 235 H PHE 35 H PHE 35 58.023 30.360 37.239 236 HA PHE 35 HA PHE 35 56.733 29.545 39.666 237 HB2 PHE 35 HB2 PHE 35 58.914 28.732 38.710 238 HB3 PHE 35 HB3 PHE 35 59.649 30.241 39.214 239 HD1 PHE 35 HD1 PHE 35 58.661 26.905 40.224 240 HD2 PHE 35 HD2 PHE 35 59.863 30.781 41.684 241 HE1 PHE 35 HE1 PHE 35 59.345 25.885 42.384 242 HE2 PHE 35 HE2 PHE 35 60.504 29.765 43.854 243 HZ PHE 35 HZ PHE 35 60.277 27.309 44.196 244 H ALA 36 H ALA 36 57.976 32.686 38.643 245 HA ALA 36 HA ALA 36 57.356 33.875 41.316 246 HB1 ALA 36 HB1 ALA 36 59.561 34.376 40.358 247 HB2 ALA 36 HB2 ALA 36 58.786 34.991 38.878 248 HB3 ALA 36 HB3 ALA 36 58.542 35.831 40.427 249 H LEU 37 H LEU 37 56.683 34.415 37.816 250 HA LEU 37 HA LEU 37 54.866 36.548 38.117 251 HB2 LEU 37 HB2 LEU 37 54.989 34.325 36.028 252 HB3 LEU 37 HB3 LEU 37 53.967 35.731 35.858 253 HG LEU 37 HG LEU 37 57.014 35.837 35.999 254 HD11 LEU 37 HD11 LEU 37 56.778 36.323 33.553 255 HD12 LEU 37 HD12 LEU 37 55.044 35.970 33.674 256 HD13 LEU 37 HD13 LEU 37 56.244 34.695 33.981 257 HD21 LEU 37 HD21 LEU 37 56.645 38.131 35.043 258 HD22 LEU 37 HD22 LEU 37 56.070 37.967 36.708 259 HD23 LEU 37 HD23 LEU 37 54.912 37.950 35.355 260 H GLY 38 H GLY 38 54.176 33.057 38.259 261 HA2 GLY 38 HA2 GLY 38 51.350 33.317 37.919 262 HA3 GLY 38 HA3 GLY 38 52.190 31.905 38.570 263 H GLY 39 H GLY 39 53.319 33.510 40.829 264 HA2 GLY 39 HA2 GLY 39 52.910 34.450 42.840 265 HA3 GLY 39 HA3 GLY 39 51.344 34.971 42.246 266 H ASP 40 H ASP 40 50.090 32.452 41.848 267 HA ASP 40 HA ASP 40 50.063 31.096 44.474 268 HB2 ASP 40 HB2 ASP 40 48.512 33.256 44.324 269 HB3 ASP 40 HB3 ASP 40 47.450 32.182 43.419 270 H SER 41 H SER 41 49.383 28.929 44.374 271 HA SER 41 HA SER 41 48.941 27.617 41.891 272 HB2 SER 41 HB2 SER 41 48.157 25.696 43.301 273 HB3 SER 41 HB3 SER 41 49.734 26.360 43.736 274 HG SER 41 HG SER 41 47.313 26.388 45.144 275 H GLN 42 H GLN 42 46.469 29.088 44.050 276 HA GLN 42 HA GLN 42 44.228 27.904 42.642 277 HB2 GLN 42 HB2 GLN 42 44.419 30.537 44.180 278 HB3 GLN 42 HB3 GLN 42 42.930 29.787 43.580 279 HG2 GLN 42 HG2 GLN 42 43.541 27.731 44.971 280 HG3 GLN 42 HG3 GLN 42 44.817 28.709 45.705 281 HE21 GLN 42 HE21 GLN 42 43.220 27.800 47.527 282 HE22 GLN 42 HE22 GLN 42 41.960 28.945 48.012 283 H LEU 43 H LEU 43 46.205 30.802 42.107 284 HA LEU 43 HA LEU 43 44.706 31.699 39.800 285 HB2 LEU 43 HB2 LEU 43 46.721 32.785 41.480 286 HB3 LEU 43 HB3 LEU 43 47.490 32.624 39.922 287 HG LEU 43 HG LEU 43 46.594 34.808 40.120 288 HD11 LEU 43 HD11 LEU 43 44.620 33.294 38.344 289 HD12 LEU 43 HD12 LEU 43 46.262 33.732 37.870 290 HD13 LEU 43 HD13 LEU 43 45.062 34.989 38.245 291 HD21 LEU 43 HD21 LEU 43 44.225 35.310 40.509 292 HD22 LEU 43 HD22 LEU 43 44.931 34.432 41.874 293 HD23 LEU 43 HD23 LEU 43 43.871 33.585 40.729 294 H GLY 44 H GLY 44 47.366 29.442 40.309 295 HA2 GLY 44 HA2 GLY 44 48.237 29.147 37.585 296 HA3 GLY 44 HA3 GLY 44 48.396 27.946 38.876 297 H LEU 45 H LEU 45 45.945 27.158 39.527 298 HA LEU 45 HA LEU 45 44.880 25.637 37.337 299 HB2 LEU 45 HB2 LEU 45 43.934 26.372 40.120 300 HB3 LEU 45 HB3 LEU 45 42.792 25.660 38.990 301 HG LEU 45 HG LEU 45 44.174 23.680 38.691 302 HD11 LEU 45 HD11 LEU 45 46.027 24.873 40.795 303 HD12 LEU 45 HD12 LEU 45 46.445 24.540 39.096 304 HD13 LEU 45 HD13 LEU 45 46.082 23.207 40.190 305 HD21 LEU 45 HD21 LEU 45 42.473 23.746 40.479 306 HD22 LEU 45 HD22 LEU 45 43.687 24.362 41.623 307 HD23 LEU 45 HD23 LEU 45 43.846 22.731 40.938 308 H ARG 46 H ARG 46 43.783 28.773 38.718 309 HA ARG 46 HA ARG 46 41.595 29.216 36.951 310 HB2 ARG 46 HB2 ARG 46 42.162 30.520 39.028 311 HB3 ARG 46 HB3 ARG 46 43.454 31.312 38.122 312 HG2 ARG 46 HG2 ARG 46 41.806 32.250 36.541 313 HG3 ARG 46 HG3 ARG 46 40.498 31.421 37.393 314 HD2 ARG 46 HD2 ARG 46 42.345 33.524 38.601 315 HD3 ARG 46 HD3 ARG 46 40.725 33.837 37.984 316 HE ARG 46 HE ARG 46 40.354 31.811 39.851 317 HH11 ARG 46 HH11 ARG 46 41.492 35.139 39.930 318 HH12 ARG 46 HH12 ARG 46 41.144 35.320 41.636 319 HH21 ARG 46 HH21 ARG 46 39.920 32.107 42.049 320 HH22 ARG 46 HH22 ARG 46 40.308 33.630 42.798 321 H MET 47 H MET 47 45.046 30.232 36.487 322 HA MET 47 HA MET 47 44.395 31.411 33.952 323 HB2 MET 47 HB2 MET 47 46.622 32.027 33.716 324 HB3 MET 47 HB3 MET 47 46.313 32.103 35.442 325 HG2 MET 47 HG2 MET 47 48.421 31.115 35.299 326 HG3 MET 47 HG3 MET 47 47.354 29.747 35.551 327 HE1 MET 47 HE1 MET 47 49.664 27.748 33.294 328 HE2 MET 47 HE2 MET 47 49.988 28.711 34.749 329 HE3 MET 47 HE3 MET 47 48.511 27.724 34.646 330 H LEU 48 H LEU 48 45.561 28.110 34.740 331 HA LEU 48 HA LEU 48 45.866 27.393 31.978 332 HB2 LEU 48 HB2 LEU 48 46.742 26.013 33.804 333 HB3 LEU 48 HB3 LEU 48 45.106 25.692 34.384 334 HG LEU 48 HG LEU 48 44.582 24.464 32.292 335 HD11 LEU 48 HD11 LEU 48 46.439 23.841 30.740 336 HD12 LEU 48 HD12 LEU 48 47.496 25.004 31.573 337 HD13 LEU 48 HD13 LEU 48 46.063 25.559 30.665 338 HD21 LEU 48 HD21 LEU 48 47.158 23.529 33.624 339 HD22 LEU 48 HD22 LEU 48 46.014 22.520 32.717 340 HD23 LEU 48 HD23 LEU 48 45.511 23.266 34.239 341 H ALA 49 H ALA 49 42.982 27.090 34.163 342 HA ALA 49 HA ALA 49 41.288 26.071 32.097 343 HB1 ALA 49 HB1 ALA 49 39.468 26.631 33.664 344 HB2 ALA 49 HB2 ALA 49 40.813 25.812 34.469 345 HB3 ALA 49 HB3 ALA 49 40.597 27.577 34.653 346 H GLN 50 H GLN 50 41.747 29.492 33.185 347 HA GLN 50 HA GLN 50 39.821 30.487 31.272 348 HB2 GLN 50 HB2 GLN 50 41.956 31.872 32.945 349 HB3 GLN 50 HB3 GLN 50 40.904 32.732 31.830 350 HG2 GLN 50 HG2 GLN 50 40.013 31.135 34.259 351 HG3 GLN 50 HG3 GLN 50 39.958 32.889 34.053 352 HE21 GLN 50 HE21 GLN 50 38.689 33.529 31.868 353 HE22 GLN 50 HE22 GLN 50 37.204 32.597 31.591 354 H LEU 51 H LEU 51 43.420 30.128 31.036 355 HA LEU 51 HA LEU 51 43.500 31.437 28.472 356 HB2 LEU 51 HB2 LEU 51 45.480 31.022 29.918 357 HB3 LEU 51 HB3 LEU 51 45.310 29.284 29.631 358 HG LEU 51 HG LEU 51 45.717 29.692 27.197 359 HD11 LEU 51 HD11 LEU 51 45.043 32.067 27.031 360 HD12 LEU 51 HD12 LEU 51 46.702 31.833 26.482 361 HD13 LEU 51 HD13 LEU 51 46.394 32.531 28.090 362 HD21 LEU 51 HD21 LEU 51 47.869 30.774 29.066 363 HD22 LEU 51 HD22 LEU 51 48.128 30.107 27.436 364 HD23 LEU 51 HD23 LEU 51 47.540 29.060 28.740 365 H ARG 52 H ARG 52 42.924 27.995 29.433 366 HA ARG 52 HA ARG 52 42.663 27.054 26.750 367 HB2 ARG 52 HB2 ARG 52 42.962 25.668 28.839 368 HB3 ARG 52 HB3 ARG 52 41.240 25.905 29.182 369 HG2 ARG 52 HG2 ARG 52 40.635 24.869 27.028 370 HG3 ARG 52 HG3 ARG 52 42.332 24.783 26.551 371 HD2 ARG 52 HD2 ARG 52 42.810 23.269 28.400 372 HD3 ARG 52 HD3 ARG 52 41.097 23.279 28.890 373 HE ARG 52 HE ARG 52 40.733 22.486 26.402 374 HH11 ARG 52 HH11 ARG 52 43.355 21.291 28.472 375 HH12 ARG 52 HH12 ARG 52 43.374 19.784 27.576 376 HH21 ARG 52 HH21 ARG 52 41.128 20.759 25.217 377 HH22 ARG 52 HH22 ARG 52 42.494 19.708 25.593 378 H GLU 53 H GLU 53 40.153 28.361 28.944 379 HA GLU 53 HA GLU 53 38.034 28.012 27.001 380 HB2 GLU 53 HB2 GLU 53 38.239 29.677 29.526 381 HB3 GLU 53 HB3 GLU 53 36.819 29.695 28.466 382 HG2 GLU 53 HG2 GLU 53 36.585 27.247 28.682 383 HG3 GLU 53 HG3 GLU 53 37.965 27.199 29.774 384 H ARG 54 H ARG 54 39.959 30.950 27.828 385 HA ARG 54 HA ARG 54 38.534 32.619 25.921 386 HB2 ARG 54 HB2 ARG 54 41.189 33.042 27.359 387 HB3 ARG 54 HB3 ARG 54 40.324 34.269 26.463 388 HG2 ARG 54 HG2 ARG 54 39.325 32.959 29.022 389 HG3 ARG 54 HG3 ARG 54 40.084 34.541 28.847 390 HD2 ARG 54 HD2 ARG 54 38.136 35.159 27.302 391 HD3 ARG 54 HD3 ARG 54 37.375 33.650 27.843 392 HE ARG 54 HE ARG 54 38.250 35.162 30.107 393 HH11 ARG 54 HH11 ARG 54 35.654 35.300 27.734 394 HH12 ARG 54 HH12 ARG 54 34.674 36.334 28.757 395 HH21 ARG 54 HH21 ARG 54 36.951 36.465 31.347 396 HH22 ARG 54 HH22 ARG 54 35.397 36.962 30.733 397 H HIS 55 H HIS 55 41.652 30.912 25.759 398 HA HIS 55 HA HIS 55 42.148 32.035 23.038 399 HB2 HIS 55 HB2 HIS 55 43.609 32.613 24.992 400 HB3 HIS 55 HB3 HIS 55 44.086 30.931 25.091 401 HD1 HIS 55 HD1 HIS 55 44.701 30.574 21.891 402 HD2 HIS 55 HD2 HIS 55 46.016 33.525 24.563 403 HE1 HIS 55 HE1 HIS 55 46.960 31.396 21.003 404 H GLY 56 H GLY 56 41.298 29.011 24.529 405 HA2 GLY 56 HA2 GLY 56 40.887 26.981 23.524 406 HA3 GLY 56 HA3 GLY 56 41.259 27.717 21.969 407 H VAL 57 H VAL 57 43.497 27.355 24.748 408 HA VAL 57 HA VAL 57 45.230 25.553 23.132 409 HB VAL 57 HB VAL 57 47.237 26.845 23.804 410 HG11 VAL 57 HG11 VAL 57 47.044 28.554 22.082 411 HG12 VAL 57 HG12 VAL 57 46.348 27.010 21.566 412 HG13 VAL 57 HG13 VAL 57 45.276 28.344 22.054 413 HG21 VAL 57 HG21 VAL 57 45.280 29.041 24.573 414 HG22 VAL 57 HG22 VAL 57 46.347 28.140 25.676 415 HG23 VAL 57 HG23 VAL 57 47.041 29.205 24.443 416 H ASP 58 H ASP 58 47.020 24.641 24.377 417 HA ASP 58 HA ASP 58 46.156 23.955 27.133 418 HB2 ASP 58 HB2 ASP 58 45.155 22.431 25.485 419 HB3 ASP 58 HB3 ASP 58 46.735 22.116 24.773 420 H LEU 59 H LEU 59 47.794 23.730 28.537 421 HA LEU 59 HA LEU 59 50.604 24.085 27.563 422 HB2 LEU 59 HB2 LEU 59 49.039 25.195 29.888 423 HB3 LEU 59 HB3 LEU 59 50.784 25.052 29.980 424 HG LEU 59 HG LEU 59 51.129 26.553 28.147 425 HD11 LEU 59 HD11 LEU 59 49.258 27.858 27.137 426 HD12 LEU 59 HD12 LEU 59 48.099 26.736 27.894 427 HD13 LEU 59 HD13 LEU 59 49.254 26.166 26.662 428 HD21 LEU 59 HD21 LEU 59 50.832 27.484 30.401 429 HD22 LEU 59 HD22 LEU 59 49.078 27.610 30.144 430 HD23 LEU 59 HD23 LEU 59 50.194 28.609 29.192 431 HA PRO 60 HA PRO 60 50.987 20.107 29.744 432 HB2 PRO 60 HB2 PRO 60 53.570 20.091 28.209 433 HB3 PRO 60 HB3 PRO 60 52.390 18.767 28.459 434 HG2 PRO 60 HG2 PRO 60 52.451 20.053 26.087 435 HG3 PRO 60 HG3 PRO 60 50.871 19.710 26.868 436 HD2 PRO 60 HD2 PRO 60 52.505 22.270 27.006 437 HD3 PRO 60 HD3 PRO 60 50.784 22.066 26.546 438 H LEU 61 H LEU 61 52.045 19.666 31.639 439 HA LEU 61 HA LEU 61 53.579 21.715 32.937 440 HB2 LEU 61 HB2 LEU 61 53.148 18.785 33.627 441 HB3 LEU 61 HB3 LEU 61 53.928 19.957 34.690 442 HG LEU 61 HG LEU 61 51.054 20.171 33.680 443 HD11 LEU 61 HD11 LEU 61 52.140 19.406 36.410 444 HD12 LEU 61 HD12 LEU 61 51.356 18.323 35.240 445 HD13 LEU 61 HD13 LEU 61 50.425 19.624 35.983 446 HD21 LEU 61 HD21 LEU 61 52.598 21.849 35.701 447 HD22 LEU 61 HD22 LEU 61 50.839 21.912 35.467 448 HD23 LEU 61 HD23 LEU 61 51.908 22.405 34.157 449 H ARG 62 H ARG 62 54.637 19.013 30.904 450 HA ARG 62 HA ARG 62 57.434 19.318 31.582 451 HB2 ARG 62 HB2 ARG 62 57.952 17.905 29.763 452 HB3 ARG 62 HB3 ARG 62 56.486 17.297 30.502 453 HG2 ARG 62 HG2 ARG 62 55.138 18.153 28.676 454 HG3 ARG 62 HG3 ARG 62 56.528 19.042 28.004 455 HD2 ARG 62 HD2 ARG 62 57.716 17.044 27.491 456 HD3 ARG 62 HD3 ARG 62 56.520 16.046 28.336 457 HE ARG 62 HE ARG 62 55.172 17.572 26.344 458 HH11 ARG 62 HH11 ARG 62 57.637 15.061 26.282 459 HH12 ARG 62 HH12 ARG 62 57.070 14.424 24.763 460 HH21 ARG 62 HH21 ARG 62 54.569 16.781 24.420 461 HH22 ARG 62 HH22 ARG 62 55.342 15.385 23.711 462 H CYS 63 H CYS 63 55.407 21.041 29.239 463 HA CYS 63 HA CYS 63 57.522 22.629 28.027 464 HB2 CYS 63 HB2 CYS 63 55.434 22.493 26.830 465 HB3 CYS 63 HB3 CYS 63 54.506 22.913 28.268 466 HG CYS 63 HG CYS 63 56.511 24.848 26.431 467 H LEU 64 H LEU 64 55.217 23.154 30.692 468 HA LEU 64 HA LEU 64 56.199 25.679 31.584 469 HB2 LEU 64 HB2 LEU 64 54.034 24.312 32.107 470 HB3 LEU 64 HB3 LEU 64 54.992 23.521 33.343 471 HG LEU 64 HG LEU 64 55.457 25.780 34.385 472 HD11 LEU 64 HD11 LEU 64 53.361 26.694 32.371 473 HD12 LEU 64 HD12 LEU 64 55.033 27.294 32.526 474 HD13 LEU 64 HD13 LEU 64 53.857 27.620 33.800 475 HD21 LEU 64 HD21 LEU 64 53.718 24.264 35.222 476 HD22 LEU 64 HD22 LEU 64 52.535 24.984 34.103 477 HD23 LEU 64 HD23 LEU 64 53.249 25.956 35.410 478 H TYR 65 H TYR 65 57.292 22.429 32.362 479 HA TYR 65 HA TYR 65 59.185 23.130 34.419 480 HB2 TYR 65 HB2 TYR 65 58.329 20.941 34.421 481 HB3 TYR 65 HB3 TYR 65 58.577 20.739 32.705 482 HD1 TYR 65 HD1 TYR 65 60.506 19.789 31.776 483 HD2 TYR 65 HD2 TYR 65 60.393 20.843 35.963 484 HE1 TYR 65 HE1 TYR 65 62.560 18.445 32.171 485 HE2 TYR 65 HE2 TYR 65 62.454 19.482 36.347 486 HH TYR 65 HH TYR 65 64.095 18.215 35.391 487 H GLU 66 H GLU 66 59.540 22.598 30.840 488 HA GLU 66 HA GLU 66 62.436 23.137 31.112 489 HB2 GLU 66 HB2 GLU 66 62.690 22.670 28.860 490 HB3 GLU 66 HB3 GLU 66 61.585 21.471 29.507 491 HG2 GLU 66 HG2 GLU 66 59.679 22.546 28.416 492 HG3 GLU 66 HG3 GLU 66 60.670 23.914 27.915 493 H ALA 67 H ALA 67 59.645 25.005 30.069 494 HA ALA 67 HA ALA 67 61.321 27.442 29.679 495 HB1 ALA 67 HB1 ALA 67 59.969 27.849 27.637 496 HB2 ALA 67 HB2 ALA 67 60.928 26.359 27.517 497 HB3 ALA 67 HB3 ALA 67 59.182 26.276 27.847 498 HA PRO 68 HA PRO 68 57.526 28.333 32.296 499 HB2 PRO 68 HB2 PRO 68 58.718 29.413 34.500 500 HB3 PRO 68 HB3 PRO 68 58.560 27.651 34.259 501 HG2 PRO 68 HG2 PRO 68 60.950 29.427 33.563 502 HG3 PRO 68 HG3 PRO 68 60.962 27.941 34.556 503 HD2 PRO 68 HD2 PRO 68 61.581 27.860 31.926 504 HD3 PRO 68 HD3 PRO 68 60.593 26.560 32.665 505 H THR 69 H THR 69 60.072 30.124 30.828 506 HA THR 69 HA THR 69 59.146 32.789 31.548 507 HB THR 69 HB THR 69 60.777 32.750 29.148 508 HG1 THR 69 HG1 THR 69 62.503 31.871 30.942 509 HG21 THR 69 HG21 THR 69 60.634 34.593 30.761 510 HG22 THR 69 HG22 THR 69 62.308 34.038 30.573 511 HG23 THR 69 HG23 THR 69 61.368 33.581 32.017 512 H VAL 70 H VAL 70 57.655 33.987 30.530 513 HA VAL 70 HA VAL 70 55.707 32.630 29.113 514 HB VAL 70 HB VAL 70 55.841 35.633 28.796 515 HG11 VAL 70 HG11 VAL 70 53.616 33.640 29.456 516 HG12 VAL 70 HG12 VAL 70 53.400 35.387 29.261 517 HG13 VAL 70 HG13 VAL 70 53.895 34.404 27.876 518 HG21 VAL 70 HG21 VAL 70 54.803 35.792 31.090 519 HG22 VAL 70 HG22 VAL 70 55.351 34.125 31.376 520 HG23 VAL 70 HG23 VAL 70 56.528 35.426 31.084 521 H ALA 71 H ALA 71 58.202 34.741 27.652 522 HA ALA 71 HA ALA 71 57.263 34.661 24.970 523 HB1 ALA 71 HB1 ALA 71 59.579 35.227 24.406 524 HB2 ALA 71 HB2 ALA 71 59.091 36.119 25.858 525 HB3 ALA 71 HB3 ALA 71 60.144 34.690 26.000 526 H ARG 72 H ARG 72 59.549 32.442 26.605 527 HA ARG 72 HA ARG 72 59.903 30.703 24.312 528 HB2 ARG 72 HB2 ARG 72 60.584 30.437 27.271 529 HB3 ARG 72 HB3 ARG 72 60.991 29.204 26.067 530 HG2 ARG 72 HG2 ARG 72 62.432 30.659 24.859 531 HG3 ARG 72 HG3 ARG 72 61.921 32.091 25.775 532 HD2 ARG 72 HD2 ARG 72 62.963 31.318 27.773 533 HD3 ARG 72 HD3 ARG 72 63.166 29.695 27.133 534 HE ARG 72 HE ARG 72 64.672 32.103 26.136 535 HH11 ARG 72 HH11 ARG 72 64.774 28.569 26.641 536 HH12 ARG 72 HH12 ARG 72 66.480 28.593 26.211 537 HH21 ARG 72 HH21 ARG 72 66.691 31.915 25.615 538 HH22 ARG 72 HH22 ARG 72 67.497 30.336 25.660 539 H LEU 73 H LEU 73 57.792 30.601 27.152 540 HA LEU 73 HA LEU 73 56.576 28.066 26.673 541 HB2 LEU 73 HB2 LEU 73 56.492 29.448 28.743 542 HB3 LEU 73 HB3 LEU 73 55.388 30.556 27.970 543 HG LEU 73 HG LEU 73 54.604 27.670 27.850 544 HD11 LEU 73 HD11 LEU 73 53.702 27.671 30.134 545 HD12 LEU 73 HD12 LEU 73 54.494 29.237 30.454 546 HD13 LEU 73 HD13 LEU 73 55.467 27.784 30.129 547 HD21 LEU 73 HD21 LEU 73 52.384 28.587 28.312 548 HD22 LEU 73 HD22 LEU 73 53.130 29.467 26.974 549 HD23 LEU 73 HD23 LEU 73 53.071 30.198 28.590 550 H ALA 74 H ALA 74 55.457 31.391 25.718 551 HA ALA 74 HA ALA 74 53.262 30.519 24.163 552 HB1 ALA 74 HB1 ALA 74 55.059 32.955 23.781 553 HB2 ALA 74 HB2 ALA 74 53.434 32.747 23.099 554 HB3 ALA 74 HB3 ALA 74 53.650 32.860 24.861 555 H GLU 75 H GLU 75 56.725 30.874 23.203 556 HA GLU 75 HA GLU 75 56.151 30.271 20.421 557 HB2 GLU 75 HB2 GLU 75 58.710 30.514 22.023 558 HB3 GLU 75 HB3 GLU 75 58.692 30.002 20.324 559 HG2 GLU 75 HG2 GLU 75 57.423 32.067 19.733 560 HG3 GLU 75 HG3 GLU 75 57.524 32.591 21.411 561 H THR 76 H THR 76 57.076 28.194 23.183 562 HA THR 76 HA THR 76 57.398 25.842 21.497 563 HB THR 76 HB THR 76 57.123 24.543 23.648 564 HG1 THR 76 HG1 THR 76 57.457 27.090 24.817 565 HG21 THR 76 HG21 THR 76 59.250 26.698 23.494 566 HG22 THR 76 HG22 THR 76 59.328 25.085 22.766 567 HG23 THR 76 HG23 THR 76 59.332 25.257 24.531 568 H ILE 77 H ILE 77 54.624 27.064 23.485 569 HA ILE 77 HA ILE 77 52.886 24.944 22.611 570 HB ILE 77 HB ILE 77 52.177 27.700 23.652 571 HG12 ILE 77 HG12 ILE 77 53.472 26.471 25.308 572 HG13 ILE 77 HG13 ILE 77 51.806 26.532 25.808 573 HG21 ILE 77 HG21 ILE 77 50.421 25.222 23.286 574 HG22 ILE 77 HG22 ILE 77 49.979 26.621 24.277 575 HG23 ILE 77 HG23 ILE 77 50.212 26.819 22.542 576 HD11 ILE 77 HD11 ILE 77 53.276 24.129 24.659 577 HD12 ILE 77 HD12 ILE 77 52.700 24.378 26.312 578 HD13 ILE 77 HD13 ILE 77 51.528 24.152 25.004 579 H VAL 78 H VAL 78 53.699 28.048 21.012 580 HA VAL 78 HA VAL 78 51.950 27.597 18.756 581 HB VAL 78 HB VAL 78 54.497 29.186 19.077 582 HG11 VAL 78 HG11 VAL 78 52.807 28.893 16.557 583 HG12 VAL 78 HG12 VAL 78 53.993 30.171 16.836 584 HG13 VAL 78 HG13 VAL 78 54.533 28.502 16.726 585 HG21 VAL 78 HG21 VAL 78 52.320 30.001 20.085 586 HG22 VAL 78 HG22 VAL 78 52.976 31.075 18.841 587 HG23 VAL 78 HG23 VAL 78 51.619 29.992 18.464 588 H ARG 79 H ARG 79 55.466 26.622 19.109 589 HA ARG 79 HA ARG 79 55.387 25.379 16.514 590 HB2 ARG 79 HB2 ARG 79 57.596 24.877 16.764 591 HB3 ARG 79 HB3 ARG 79 57.427 26.264 17.831 592 HG2 ARG 79 HG2 ARG 79 57.193 24.555 19.752 593 HG3 ARG 79 HG3 ARG 79 57.677 23.322 18.580 594 HD2 ARG 79 HD2 ARG 79 59.763 24.679 18.128 595 HD3 ARG 79 HD3 ARG 79 59.266 25.760 19.443 596 HE ARG 79 HE ARG 79 59.483 22.866 20.085 597 HH11 ARG 79 HH11 ARG 79 61.188 25.966 20.330 598 HH12 ARG 79 HH12 ARG 79 62.501 25.185 21.190 599 HH21 ARG 79 HH21 ARG 79 60.845 22.201 21.602 600 HH22 ARG 79 HH22 ARG 79 61.994 23.316 22.295 601 H LEU 80 H LEU 80 54.526 24.100 19.609 602 HA LEU 80 HA LEU 80 54.412 21.309 18.669 603 HB2 LEU 80 HB2 LEU 80 53.544 22.662 21.252 604 HB3 LEU 80 HB3 LEU 80 53.495 20.927 20.968 605 HG LEU 80 HG LEU 80 56.057 22.600 20.935 606 HD11 LEU 80 HD11 LEU 80 54.967 20.698 23.037 607 HD12 LEU 80 HD12 LEU 80 55.056 22.474 23.174 608 HD13 LEU 80 HD13 LEU 80 56.541 21.521 23.074 609 HD21 LEU 80 HD21 LEU 80 55.596 19.618 20.703 610 HD22 LEU 80 HD22 LEU 80 57.157 20.361 21.082 611 HD23 LEU 80 HD23 LEU 80 56.388 20.692 19.531 612 H ALA 81 H ALA 81 52.142 23.967 19.188 613 HA ALA 81 HA ALA 81 50.061 24.379 18.633 614 HB1 ALA 81 HB1 ALA 81 50.422 22.311 16.450 615 HB2 ALA 81 HB2 ALA 81 49.279 23.670 16.467 616 HB3 ALA 81 HB3 ALA 81 51.021 23.984 16.402 617 H ALA 82 H ALA 82 47.823 23.767 18.357 618 HA ALA 82 HA ALA 82 46.959 21.156 19.378 619 HB1 ALA 82 HB1 ALA 82 45.542 22.193 21.126 620 HB2 ALA 82 HB2 ALA 82 47.255 22.534 21.420 621 HB3 ALA 82 HB3 ALA 82 46.203 23.792 20.727 622 HA PRO 83 HA PRO 83 43.799 21.938 16.399 623 HB2 PRO 83 HB2 PRO 83 41.701 20.653 18.094 624 HB3 PRO 83 HB3 PRO 83 42.299 20.201 16.470 625 HG2 PRO 83 HG2 PRO 83 42.984 18.757 18.681 626 HG3 PRO 83 HG3 PRO 83 44.183 19.080 17.385 627 HD2 PRO 83 HD2 PRO 83 43.796 20.596 19.990 628 HD3 PRO 83 HD3 PRO 83 45.298 19.928 19.286 629 H ALA 84 H ALA 84 42.616 23.644 15.800 630 HA ALA 84 HA ALA 84 41.544 25.610 15.827 631 HB1 ALA 84 HB1 ALA 84 39.597 23.937 17.423 632 HB2 ALA 84 HB2 ALA 84 39.200 25.434 16.555 633 HB3 ALA 84 HB3 ALA 84 39.750 24.012 15.651 634 HA PRO 85 HA PRO 85 42.508 27.610 19.879 635 HB2 PRO 85 HB2 PRO 85 44.935 28.675 19.444 636 HB3 PRO 85 HB3 PRO 85 44.765 26.928 19.812 637 HG2 PRO 85 HG2 PRO 85 45.054 28.225 17.082 638 HG3 PRO 85 HG3 PRO 85 45.987 26.849 17.755 639 HD2 PRO 85 HD2 PRO 85 43.741 26.553 16.152 640 HD3 PRO 85 HD3 PRO 85 44.233 25.366 17.387 641 H SER 86 H SER 86 42.768 29.949 20.168 642 HA SER 86 HA SER 86 42.486 32.130 19.815 643 HB2 SER 86 HB2 SER 86 43.497 31.524 17.025 644 HB3 SER 86 HB3 SER 86 43.335 33.142 17.721 645 HG SER 86 HG SER 86 44.782 32.658 19.294 646 H GLY 87 H GLY 87 41.282 33.860 19.091 647 HA2 GLY 87 HA2 GLY 87 39.309 33.749 17.008 648 HA3 GLY 87 HA3 GLY 87 38.574 33.417 18.580 649 H ASP 88 H ASP 88 38.753 35.047 20.267 650 HA ASP 88 HA ASP 88 38.464 37.693 19.045 651 HB2 ASP 88 HB2 ASP 88 36.729 36.679 20.524 652 HB3 ASP 88 HB3 ASP 88 37.848 36.848 21.883 653 H GLN 89 H GLN 89 39.643 39.484 19.349 654 HA GLN 89 HA GLN 89 41.801 39.686 21.385 655 HB2 GLN 89 HB2 GLN 89 42.012 40.263 18.393 656 HB3 GLN 89 HB3 GLN 89 43.257 40.627 19.573 657 HG2 GLN 89 HG2 GLN 89 42.337 37.801 18.952 658 HG3 GLN 89 HG3 GLN 89 43.674 38.594 18.155 659 HE21 GLN 89 HE21 GLN 89 42.514 37.647 21.393 660 HE22 GLN 89 HE22 GLN 89 44.118 37.496 22.095 661 H ASP 90 H ASP 90 41.889 41.730 22.310 662 HA ASP 90 HA ASP 90 40.567 44.022 20.939 663 HB2 ASP 90 HB2 ASP 90 38.773 43.138 22.290 664 HB3 ASP 90 HB3 ASP 90 39.815 43.026 23.705 665 H ASP 91 H ASP 91 41.552 45.870 21.131 666 HA ASP 91 HA ASP 91 42.828 46.686 23.619 667 HB2 ASP 91 HB2 ASP 91 44.630 45.643 22.126 668 HB3 ASP 91 HB3 ASP 91 44.368 46.986 21.020 669 H ALA 92 H ALA 92 40.353 47.396 22.554 670 HA ALA 92 HA ALA 92 40.333 49.812 21.050 671 HB1 ALA 92 HB1 ALA 92 38.444 48.267 21.200 672 HB2 ALA 92 HB2 ALA 92 38.274 48.601 22.938 673 HB3 ALA 92 HB3 ALA 92 37.961 49.882 21.750 674 H SER 93 H SER 93 41.417 49.492 24.236 675 HA SER 93 HA SER 93 40.868 51.938 25.521 676 HB2 SER 93 HB2 SER 93 42.356 50.094 26.361 677 HB3 SER 93 HB3 SER 93 43.541 50.587 25.113 678 HG SER 93 HG SER 93 43.874 51.531 27.317 679 H GLU 94 H GLU 94 43.155 51.280 22.849 680 HA GLU 94 HA GLU 94 44.401 52.580 21.510 681 HB2 GLU 94 HB2 GLU 94 41.834 54.157 21.559 682 HB3 GLU 94 HB3 GLU 94 43.123 54.445 20.383 683 HG2 GLU 94 HG2 GLU 94 42.001 51.644 20.764 684 HG3 GLU 94 HG3 GLU 94 41.157 52.837 19.763 685 H TYR 95 H TYR 95 45.594 52.822 23.664 686 HA TYR 95 HA TYR 95 45.932 55.512 24.691 687 HB2 TYR 95 HB2 TYR 95 46.405 53.398 25.943 688 HB3 TYR 95 HB3 TYR 95 47.766 53.088 24.869 689 HD1 TYR 95 HD1 TYR 95 46.372 55.705 27.184 690 HD2 TYR 95 HD2 TYR 95 49.916 53.893 25.518 691 HE1 TYR 95 HE1 TYR 95 47.779 57.148 28.628 692 HE2 TYR 95 HE2 TYR 95 51.331 55.324 26.982 693 HH TYR 95 HH TYR 95 49.888 57.740 29.229 694 H GLU 96 H GLU 96 47.331 53.751 22.031 695 HA GLU 96 HA GLU 96 49.035 56.107 21.278 696 HB2 GLU 96 HB2 GLU 96 49.480 53.133 20.926 697 HB3 GLU 96 HB3 GLU 96 50.336 54.321 19.952 698 HG2 GLU 96 HG2 GLU 96 50.403 54.569 22.979 699 HG3 GLU 96 HG3 GLU 96 51.415 53.383 22.166 700 H GLU 97 H GLU 97 48.507 57.126 19.503 701 HA GLU 97 HA GLU 97 46.639 55.919 17.484 702 HB2 GLU 97 HB2 GLU 97 46.458 58.555 18.993 703 HB3 GLU 97 HB3 GLU 97 45.494 58.185 17.571 704 HG2 GLU 97 HG2 GLU 97 44.466 56.262 18.714 705 HG3 GLU 97 HG3 GLU 97 45.415 56.614 20.166 706 H GLY 98 H GLY 98 49.618 57.563 17.804 707 HA2 GLY 98 HA2 GLY 98 51.015 58.454 16.194 708 HA3 GLY 98 HA3 GLY 98 49.832 58.037 14.951 709 H VAL 99 H VAL 99 48.483 59.959 17.401 710 HA VAL 99 HA VAL 99 47.992 62.248 15.725 711 HB VAL 99 HB VAL 99 47.015 63.217 17.815 712 HG11 VAL 99 HG11 VAL 99 45.145 61.625 17.960 713 HG12 VAL 99 HG12 VAL 99 45.643 61.891 16.282 714 HG13 VAL 99 HG13 VAL 99 46.111 60.398 17.111 715 HG21 VAL 99 HG21 VAL 99 48.489 62.130 19.481 716 HG22 VAL 99 HG22 VAL 99 46.774 61.869 19.813 717 HG23 VAL 99 HG23 VAL 99 47.734 60.564 19.111 718 H ILE 100 H ILE 100 48.367 64.490 16.457 719 HA ILE 100 HA ILE 100 51.176 64.900 17.407 720 HB ILE 100 HB ILE 100 51.192 66.971 16.106 721 HG12 ILE 100 HG12 ILE 100 48.532 66.036 14.943 722 HG13 ILE 100 HG13 ILE 100 48.759 67.423 16.013 723 HG21 ILE 100 HG21 ILE 100 51.623 65.911 13.979 724 HG22 ILE 100 HG22 ILE 100 52.092 64.794 15.257 725 HG23 ILE 100 HG23 ILE 100 50.567 64.541 14.379 726 HD11 ILE 100 HD11 ILE 100 50.243 68.455 14.257 727 HD12 ILE 100 HD12 ILE 100 49.801 67.114 13.170 728 HD13 ILE 100 HD13 ILE 100 48.557 68.223 13.760 729 H ARG 101 H ARG 101 51.642 66.892 18.542 730 HA ARG 101 HA ARG 101 49.533 67.803 20.411 731 HB2 ARG 101 HB2 ARG 101 51.621 66.860 21.338 732 HB3 ARG 101 HB3 ARG 101 52.587 68.042 20.438 733 HG2 ARG 101 HG2 ARG 101 51.710 69.873 21.726 734 HG3 ARG 101 HG3 ARG 101 50.419 68.843 22.354 735 HD2 ARG 101 HD2 ARG 101 52.080 69.241 24.103 736 HD3 ARG 101 HD3 ARG 101 52.007 67.541 23.675 737 HE ARG 101 HE ARG 101 54.141 67.619 22.727 738 HH11 ARG 101 HH11 ARG 101 53.368 70.800 23.963 739 HH12 ARG 101 HH12 ARG 101 55.039 71.241 24.142 740 HH21 ARG 101 HH21 ARG 101 56.213 68.360 22.668 741 HH22 ARG 101 HH22 ARG 101 56.612 69.903 23.395 Start of MODEL 9 1 H GLY 1 H1 GLY 1 53.526 70.473 21.050 2 HA2 GLY 1 HA2 GLY 1 51.642 71.169 22.398 3 HA3 GLY 1 HA3 GLY 1 50.634 70.066 21.441 4 H ALA 2 H ALA 2 50.059 68.770 23.209 5 HA ALA 2 HA ALA 2 52.217 67.498 24.801 6 HB1 ALA 2 HB1 ALA 2 50.420 67.067 26.410 7 HB2 ALA 2 HB2 ALA 2 50.483 68.775 25.952 8 HB3 ALA 2 HB3 ALA 2 49.225 67.721 25.270 9 H ALA 3 H ALA 3 50.154 66.601 22.252 10 HA ALA 3 HA ALA 3 49.675 64.799 21.121 11 HB1 ALA 3 HB1 ALA 3 52.051 63.464 22.419 12 HB2 ALA 3 HB2 ALA 3 51.312 63.075 20.857 13 HB3 ALA 3 HB3 ALA 3 52.140 64.627 21.080 14 H ALA 4 H ALA 4 48.192 63.296 21.037 15 HA ALA 4 HA ALA 4 47.327 61.824 23.461 16 HB1 ALA 4 HB1 ALA 4 45.696 63.140 22.137 17 HB2 ALA 4 HB2 ALA 4 46.042 62.131 20.717 18 HB3 ALA 4 HB3 ALA 4 45.296 61.413 22.160 19 H GLY 5 H GLY 5 46.521 59.515 23.046 20 HA2 GLY 5 HA2 GLY 5 48.716 57.875 22.077 21 HA3 GLY 5 HA3 GLY 5 47.192 57.308 22.752 22 H VAL 6 H VAL 6 49.056 57.471 19.955 23 HA VAL 6 HA VAL 6 46.736 57.129 18.109 24 HB VAL 6 HB VAL 6 48.227 57.905 16.340 25 HG11 VAL 6 HG11 VAL 6 48.201 60.270 16.897 26 HG12 VAL 6 HG12 VAL 6 46.715 59.490 17.464 27 HG13 VAL 6 HG13 VAL 6 48.004 59.901 18.618 28 HG21 VAL 6 HG21 VAL 6 50.333 59.022 16.807 29 HG22 VAL 6 HG22 VAL 6 50.200 58.637 18.527 30 HG23 VAL 6 HG23 VAL 6 50.427 57.335 17.335 31 H SER 7 H SER 7 49.148 55.249 19.545 32 HA SER 7 HA SER 7 48.269 53.023 17.891 33 HB2 SER 7 HB2 SER 7 51.132 54.001 17.724 34 HB3 SER 7 HB3 SER 7 50.761 52.277 17.542 35 HG SER 7 HG SER 7 49.251 54.161 16.139 36 H ALA 8 H ALA 8 48.748 51.006 18.710 37 HA ALA 8 HA ALA 8 50.218 50.752 21.293 38 HB1 ALA 8 HB1 ALA 8 48.472 49.103 21.971 39 HB2 ALA 8 HB2 ALA 8 47.814 50.743 21.785 40 HB3 ALA 8 HB3 ALA 8 47.537 49.516 20.528 41 H ALA 9 H ALA 9 52.032 50.128 20.005 42 HA ALA 9 HA ALA 9 52.113 48.182 18.018 43 HB1 ALA 9 HB1 ALA 9 54.212 48.958 20.087 44 HB2 ALA 9 HB2 ALA 9 54.531 48.017 18.621 45 HB3 ALA 9 HB3 ALA 9 53.961 49.686 18.480 46 H GLY 10 H GLY 10 52.393 46.000 17.892 47 HA2 GLY 10 HA2 GLY 10 51.369 44.389 20.096 48 HA3 GLY 10 HA3 GLY 10 51.780 43.836 18.476 49 H ILE 11 H ILE 11 52.477 43.071 21.458 50 HA ILE 11 HA ILE 11 55.045 41.972 20.658 51 HB ILE 11 HB ILE 11 55.597 44.174 21.709 52 HG12 ILE 11 HG12 ILE 11 57.379 43.385 23.174 53 HG13 ILE 11 HG13 ILE 11 56.658 41.781 23.245 54 HG21 ILE 11 HG21 ILE 11 53.798 44.253 23.418 55 HG22 ILE 11 HG22 ILE 11 54.634 42.980 24.332 56 HG23 ILE 11 HG23 ILE 11 55.410 44.557 24.075 57 HD11 ILE 11 HD11 ILE 11 57.504 43.108 20.633 58 HD12 ILE 11 HD12 ILE 11 58.580 42.077 21.584 59 HD13 ILE 11 HD13 ILE 11 57.105 41.395 20.897 60 H GLU 12 H GLU 12 55.478 40.025 21.472 61 HA GLU 12 HA GLU 12 54.993 37.955 22.045 62 HB2 GLU 12 HB2 GLU 12 54.161 39.321 24.590 63 HB3 GLU 12 HB3 GLU 12 53.818 37.615 24.354 64 HG2 GLU 12 HG2 GLU 12 55.862 37.701 25.511 65 HG3 GLU 12 HG3 GLU 12 56.206 37.169 23.882 66 HA PRO 13 HA PRO 13 50.878 36.714 20.846 67 HB2 PRO 13 HB2 PRO 13 51.428 34.240 22.461 68 HB3 PRO 13 HB3 PRO 13 50.802 34.378 20.788 69 HG2 PRO 13 HG2 PRO 13 53.386 33.702 21.169 70 HG3 PRO 13 HG3 PRO 13 52.969 34.935 19.936 71 HD2 PRO 13 HD2 PRO 13 53.915 35.403 22.788 72 HD3 PRO 13 HD3 PRO 13 54.519 36.111 21.258 73 H ASP 14 H ASP 14 48.789 36.442 21.713 74 HA ASP 14 HA ASP 14 48.314 38.176 23.821 75 HB2 ASP 14 HB2 ASP 14 46.400 36.190 22.555 76 HB3 ASP 14 HB3 ASP 14 45.940 37.635 23.454 77 H LEU 15 H LEU 15 48.939 34.839 24.224 78 HA LEU 15 HA LEU 15 47.646 34.119 26.643 79 HB2 LEU 15 HB2 LEU 15 50.519 33.636 25.681 80 HB3 LEU 15 HB3 LEU 15 49.812 32.904 27.107 81 HG LEU 15 HG LEU 15 48.038 31.863 25.557 82 HD11 LEU 15 HD11 LEU 15 48.424 33.128 23.478 83 HD12 LEU 15 HD12 LEU 15 48.789 31.432 23.237 84 HD13 LEU 15 HD13 LEU 15 50.120 32.581 23.449 85 HD21 LEU 15 HD21 LEU 15 49.553 30.007 24.985 86 HD22 LEU 15 HD22 LEU 15 49.869 30.603 26.615 87 HD23 LEU 15 HD23 LEU 15 50.960 31.050 25.286 88 H THR 16 H THR 16 50.456 36.213 26.070 89 HA THR 16 HA THR 16 51.076 36.720 28.860 90 HB THR 16 HB THR 16 52.399 38.628 27.995 91 HG1 THR 16 HG1 THR 16 51.626 37.683 25.413 92 HG21 THR 16 HG21 THR 16 54.054 37.332 26.788 93 HG22 THR 16 HG22 THR 16 52.883 36.027 26.485 94 HG23 THR 16 HG23 THR 16 53.418 36.412 28.144 95 H ALA 17 H ALA 17 49.066 38.475 26.470 96 HA ALA 17 HA ALA 17 48.442 40.752 28.054 97 HB1 ALA 17 HB1 ALA 17 46.640 41.087 26.485 98 HB2 ALA 17 HB2 ALA 17 48.096 40.568 25.619 99 HB3 ALA 17 HB3 ALA 17 46.765 39.422 25.897 100 H ILE 18 H ILE 18 46.795 37.597 27.673 101 HA ILE 18 HA ILE 18 44.692 38.043 29.565 102 HB ILE 18 HB ILE 18 46.009 35.453 28.667 103 HG12 ILE 18 HG12 ILE 18 43.339 36.606 27.751 104 HG13 ILE 18 HG13 ILE 18 44.832 36.971 26.905 105 HG21 ILE 18 HG21 ILE 18 44.802 35.075 30.781 106 HG22 ILE 18 HG22 ILE 18 43.379 35.930 30.153 107 HG23 ILE 18 HG23 ILE 18 43.877 34.378 29.464 108 HD11 ILE 18 HD11 ILE 18 45.237 34.560 26.511 109 HD12 ILE 18 HD12 ILE 18 43.671 34.186 27.260 110 HD13 ILE 18 HD13 ILE 18 43.730 35.153 25.778 111 H TRP 19 H TRP 19 47.963 36.489 30.079 112 HA TRP 19 HA TRP 19 47.383 36.114 32.878 113 HB2 TRP 19 HB2 TRP 19 49.818 35.778 31.169 114 HB3 TRP 19 HB3 TRP 19 50.002 35.843 32.918 115 HD1 TRP 19 HD1 TRP 19 47.029 34.154 31.166 116 HE1 TRP 19 HE1 TRP 19 46.838 31.741 31.995 117 HE3 TRP 19 HE3 TRP 19 51.375 33.889 33.866 118 HZ2 TRP 19 HZ2 TRP 19 48.374 29.920 33.610 119 HZ3 TRP 19 HZ3 TRP 19 51.963 31.798 35.069 120 HH2 TRP 19 HH2 TRP 19 50.458 29.824 34.962 121 H GLN 20 H GLN 20 49.017 38.879 31.260 122 HA GLN 20 HA GLN 20 49.585 40.167 33.772 123 HB2 GLN 20 HB2 GLN 20 49.905 42.216 32.574 124 HB3 GLN 20 HB3 GLN 20 50.679 40.908 31.687 125 HG2 GLN 20 HG2 GLN 20 48.964 40.905 30.040 126 HG3 GLN 20 HG3 GLN 20 47.921 41.976 30.963 127 HE21 GLN 20 HE21 GLN 20 51.053 41.925 29.127 128 HE22 GLN 20 HE22 GLN 20 50.926 43.656 28.823 129 H ALA 21 H ALA 21 46.612 40.167 31.689 130 HA ALA 21 HA ALA 21 45.221 42.079 33.306 131 HB1 ALA 21 HB1 ALA 21 44.130 39.859 31.523 132 HB2 ALA 21 HB2 ALA 21 43.243 41.289 32.094 133 HB3 ALA 21 HB3 ALA 21 44.618 41.482 30.990 134 H LEU 22 H LEU 22 45.370 38.498 33.537 135 HA LEU 22 HA LEU 22 43.405 38.369 35.675 136 HB2 LEU 22 HB2 LEU 22 45.375 36.334 34.570 137 HB3 LEU 22 HB3 LEU 22 44.172 35.983 35.812 138 HG LEU 22 HG LEU 22 43.510 36.872 32.972 139 HD11 LEU 22 HD11 LEU 22 44.491 34.582 33.164 140 HD12 LEU 22 HD12 LEU 22 42.791 34.562 32.667 141 HD13 LEU 22 HD13 LEU 22 43.230 34.173 34.349 142 HD21 LEU 22 HD21 LEU 22 41.210 36.182 33.564 143 HD22 LEU 22 HD22 LEU 22 41.735 37.571 34.503 144 HD23 LEU 22 HD23 LEU 22 41.712 35.958 35.256 145 H PHE 23 H PHE 23 46.973 38.611 35.665 146 HA PHE 23 HA PHE 23 46.907 38.543 38.620 147 HB2 PHE 23 HB2 PHE 23 48.756 37.573 37.193 148 HB3 PHE 23 HB3 PHE 23 49.262 39.218 36.854 149 HD1 PHE 23 HD1 PHE 23 48.853 36.600 39.454 150 HD2 PHE 23 HD2 PHE 23 50.401 40.540 38.623 151 HE1 PHE 23 HE1 PHE 23 50.108 36.571 41.600 152 HE2 PHE 23 HE2 PHE 23 51.654 40.501 40.758 153 HZ PHE 23 HZ PHE 23 51.505 38.512 42.258 154 H ALA 24 H ALA 24 46.399 40.892 36.223 155 HA ALA 24 HA ALA 24 46.041 43.056 36.135 156 HB1 ALA 24 HB1 ALA 24 44.355 42.504 37.791 157 HB2 ALA 24 HB2 ALA 24 45.500 42.863 39.107 158 HB3 ALA 24 HB3 ALA 24 44.961 44.153 38.011 159 H LEU 25 H LEU 25 48.557 42.786 35.789 160 HA LEU 25 HA LEU 25 49.744 45.170 37.123 161 HB2 LEU 25 HB2 LEU 25 51.845 44.274 37.354 162 HB3 LEU 25 HB3 LEU 25 50.814 42.954 37.862 163 HG LEU 25 HG LEU 25 52.208 43.244 35.158 164 HD11 LEU 25 HD11 LEU 25 52.674 41.278 37.429 165 HD12 LEU 25 HD12 LEU 25 53.729 42.652 37.003 166 HD13 LEU 25 HD13 LEU 25 53.503 41.308 35.864 167 HD21 LEU 25 HD21 LEU 25 50.134 41.994 34.861 168 HD22 LEU 25 HD22 LEU 25 50.534 40.949 36.240 169 HD23 LEU 25 HD23 LEU 25 51.519 40.900 34.765 170 HA PRO 26 HA PRO 26 50.036 46.905 33.230 171 HB2 PRO 26 HB2 PRO 26 52.931 47.638 33.428 172 HB3 PRO 26 HB3 PRO 26 51.518 48.691 33.171 173 HG2 PRO 26 HG2 PRO 26 52.740 48.573 35.598 174 HG3 PRO 26 HG3 PRO 26 50.953 48.655 35.468 175 HD2 PRO 26 HD2 PRO 26 52.697 46.214 35.917 176 HD3 PRO 26 HD3 PRO 26 51.203 46.704 36.767 177 H ALA 27 H ALA 27 53.015 44.885 33.530 178 HA ALA 27 HA ALA 27 52.299 43.561 31.007 179 HB1 ALA 27 HB1 ALA 27 54.967 44.966 31.392 180 HB2 ALA 27 HB2 ALA 27 54.524 43.930 30.013 181 HB3 ALA 27 HB3 ALA 27 53.699 45.476 30.282 182 H VAL 28 H VAL 28 53.405 41.556 30.646 183 HA VAL 28 HA VAL 28 54.246 40.211 33.158 184 HB VAL 28 HB VAL 28 52.899 39.392 30.653 185 HG11 VAL 28 HG11 VAL 28 54.920 37.489 31.888 186 HG12 VAL 28 HG12 VAL 28 53.535 36.991 30.893 187 HG13 VAL 28 HG13 VAL 28 54.784 38.007 30.190 188 HG21 VAL 28 HG21 VAL 28 51.746 37.911 32.165 189 HG22 VAL 28 HG22 VAL 28 52.977 38.148 33.424 190 HG23 VAL 28 HG23 VAL 28 51.907 39.480 32.964 191 H GLY 29 H GLY 29 56.275 39.734 33.648 192 HA2 GLY 29 HA2 GLY 29 58.313 38.941 31.857 193 HA3 GLY 29 HA3 GLY 29 58.456 40.684 32.053 194 H ARG 30 H ARG 30 57.969 41.139 34.709 195 HA ARG 30 HA ARG 30 60.634 40.503 35.658 196 HB2 ARG 30 HB2 ARG 30 58.381 42.124 36.905 197 HB3 ARG 30 HB3 ARG 30 60.017 41.996 37.557 198 HG2 ARG 30 HG2 ARG 30 60.945 42.909 35.442 199 HG3 ARG 30 HG3 ARG 30 59.311 43.092 34.805 200 HD2 ARG 30 HD2 ARG 30 60.264 45.203 35.669 201 HD3 ARG 30 HD3 ARG 30 58.745 44.764 36.424 202 HE ARG 30 HE ARG 30 61.496 44.551 37.631 203 HH11 ARG 30 HH11 ARG 30 58.024 44.510 38.194 204 HH12 ARG 30 HH12 ARG 30 58.211 44.803 39.904 205 HH21 ARG 30 HH21 ARG 30 61.639 44.959 39.803 206 HH22 ARG 30 HH22 ARG 30 60.198 45.208 40.778 207 H HIS 31 H HIS 31 57.554 39.036 36.495 208 HA HIS 31 HA HIS 31 58.637 37.872 38.974 209 HB2 HIS 31 HB2 HIS 31 56.130 37.435 37.356 210 HB3 HIS 31 HB3 HIS 31 56.599 36.350 38.644 211 HD1 HIS 31 HD1 HIS 31 54.494 37.046 40.104 212 HD2 HIS 31 HD2 HIS 31 57.137 40.174 39.157 213 HE1 HIS 31 HE1 HIS 31 53.828 39.003 41.573 214 H GLN 32 H GLN 32 58.800 37.129 35.621 215 HA GLN 32 HA GLN 32 60.074 35.832 34.381 216 HB2 GLN 32 HB2 GLN 32 61.605 37.178 35.690 217 HB3 GLN 32 HB3 GLN 32 61.774 35.879 36.872 218 HG2 GLN 32 HG2 GLN 32 62.835 34.436 35.227 219 HG3 GLN 32 HG3 GLN 32 62.525 35.608 33.939 220 HE21 GLN 32 HE21 GLN 32 65.034 34.772 34.139 221 HE22 GLN 32 HE22 GLN 32 66.059 36.028 34.844 222 H ASP 33 H ASP 33 59.101 33.967 37.215 223 HA ASP 33 HA ASP 33 59.317 31.557 35.457 224 HB2 ASP 33 HB2 ASP 33 59.611 31.409 38.474 225 HB3 ASP 33 HB3 ASP 33 59.868 30.140 37.285 226 H PHE 34 H PHE 34 57.582 30.115 35.559 227 HA PHE 34 HA PHE 34 55.017 30.953 35.807 228 HB2 PHE 34 HB2 PHE 34 55.291 28.911 34.789 229 HB3 PHE 34 HB3 PHE 34 56.320 28.255 36.043 230 HD1 PHE 34 HD1 PHE 34 52.756 29.169 35.312 231 HD2 PHE 34 HD2 PHE 34 55.452 26.940 37.830 232 HE1 PHE 34 HE1 PHE 34 50.819 28.027 36.391 233 HE2 PHE 34 HE2 PHE 34 53.517 25.826 38.917 234 HZ PHE 34 HZ PHE 34 51.201 26.373 38.204 235 H PHE 35 H PHE 35 56.746 29.445 38.599 236 HA PHE 35 HA PHE 35 54.493 29.427 40.300 237 HB2 PHE 35 HB2 PHE 35 56.741 28.227 40.483 238 HB3 PHE 35 HB3 PHE 35 57.379 29.694 41.210 239 HD1 PHE 35 HD1 PHE 35 54.760 27.034 41.518 240 HD2 PHE 35 HD2 PHE 35 57.029 30.072 43.583 241 HE1 PHE 35 HE1 PHE 35 53.948 26.164 43.692 242 HE2 PHE 35 HE2 PHE 35 56.175 29.217 45.760 243 HZ PHE 35 HZ PHE 35 54.653 27.254 45.819 244 H ALA 36 H ALA 36 56.327 32.176 39.349 245 HA ALA 36 HA ALA 36 54.934 33.883 41.376 246 HB1 ALA 36 HB1 ALA 36 57.375 33.995 41.507 247 HB2 ALA 36 HB2 ALA 36 57.461 34.406 39.781 248 HB3 ALA 36 HB3 ALA 36 56.698 35.530 40.936 249 H LEU 37 H LEU 37 55.589 33.465 37.871 250 HA LEU 37 HA LEU 37 54.125 35.747 36.927 251 HB2 LEU 37 HB2 LEU 37 54.939 33.091 35.707 252 HB3 LEU 37 HB3 LEU 37 54.030 34.270 34.783 253 HG LEU 37 HG LEU 37 56.690 34.959 36.092 254 HD11 LEU 37 HD11 LEU 37 57.769 34.612 33.939 255 HD12 LEU 37 HD12 LEU 37 56.249 34.132 33.196 256 HD13 LEU 37 HD13 LEU 37 56.995 33.093 34.423 257 HD21 LEU 37 HD21 LEU 37 55.225 36.862 35.377 258 HD22 LEU 37 HD22 LEU 37 55.153 36.181 33.755 259 HD23 LEU 37 HD23 LEU 37 56.700 36.768 34.402 260 H GLY 38 H GLY 38 53.091 32.557 37.909 261 HA2 GLY 38 HA2 GLY 38 50.210 33.247 37.483 262 HA3 GLY 38 HA3 GLY 38 50.865 31.640 37.809 263 H GLY 39 H GLY 39 52.495 33.743 39.825 264 HA2 GLY 39 HA2 GLY 39 52.413 34.417 41.987 265 HA3 GLY 39 HA3 GLY 39 50.661 34.370 41.870 266 H ASP 40 H ASP 40 50.551 31.439 41.448 267 HA ASP 40 HA ASP 40 51.835 30.084 43.694 268 HB2 ASP 40 HB2 ASP 40 49.660 31.305 44.614 269 HB3 ASP 40 HB3 ASP 40 48.800 30.161 43.610 270 H SER 41 H SER 41 50.936 27.621 43.666 271 HA SER 41 HA SER 41 50.593 26.707 40.916 272 HB2 SER 41 HB2 SER 41 50.114 24.519 41.925 273 HB3 SER 41 HB3 SER 41 51.652 25.216 42.471 274 HG SER 41 HG SER 41 49.971 24.256 44.042 275 H GLN 42 H GLN 42 48.264 27.137 43.680 276 HA GLN 42 HA GLN 42 45.980 26.259 42.146 277 HB2 GLN 42 HB2 GLN 42 46.049 28.301 44.413 278 HB3 GLN 42 HB3 GLN 42 44.623 27.469 43.794 279 HG2 GLN 42 HG2 GLN 42 45.657 25.289 44.537 280 HG3 GLN 42 HG3 GLN 42 46.957 26.240 45.274 281 HE21 GLN 42 HE21 GLN 42 43.592 25.251 45.603 282 HE22 GLN 42 HE22 GLN 42 43.347 26.074 47.162 283 H LEU 43 H LEU 43 47.390 29.463 42.680 284 HA LEU 43 HA LEU 43 45.430 30.960 41.224 285 HB2 LEU 43 HB2 LEU 43 47.115 31.542 43.139 286 HB3 LEU 43 HB3 LEU 43 48.254 31.847 41.852 287 HG LEU 43 HG LEU 43 45.656 33.224 42.532 288 HD11 LEU 43 HD11 LEU 43 47.054 35.174 42.931 289 HD12 LEU 43 HD12 LEU 43 48.491 34.286 42.380 290 HD13 LEU 43 HD13 LEU 43 47.654 33.794 43.868 291 HD21 LEU 43 HD21 LEU 43 45.786 33.264 40.057 292 HD22 LEU 43 HD22 LEU 43 47.446 33.869 40.151 293 HD23 LEU 43 HD23 LEU 43 46.096 34.871 40.719 294 H GLY 44 H GLY 44 48.635 29.577 40.298 295 HA2 GLY 44 HA2 GLY 44 48.652 30.445 37.585 296 HA3 GLY 44 HA3 GLY 44 49.500 29.047 38.268 297 H LEU 45 H LEU 45 47.296 27.435 39.092 298 HA LEU 45 HA LEU 45 46.308 26.376 36.600 299 HB2 LEU 45 HB2 LEU 45 45.552 25.842 39.489 300 HB3 LEU 45 HB3 LEU 45 44.857 24.967 38.125 301 HG LEU 45 HG LEU 45 47.845 25.002 38.710 302 HD11 LEU 45 HD11 LEU 45 47.506 22.753 39.608 303 HD12 LEU 45 HD12 LEU 45 45.751 22.875 39.336 304 HD13 LEU 45 HD13 LEU 45 46.555 23.920 40.531 305 HD21 LEU 45 HD21 LEU 45 47.401 24.480 36.382 306 HD22 LEU 45 HD22 LEU 45 46.148 23.298 36.843 307 HD23 LEU 45 HD23 LEU 45 47.858 23.010 37.236 308 H ARG 46 H ARG 46 44.758 28.552 38.984 309 HA ARG 46 HA ARG 46 42.226 28.913 37.648 310 HB2 ARG 46 HB2 ARG 46 42.430 29.855 39.790 311 HB3 ARG 46 HB3 ARG 46 43.985 30.579 39.461 312 HG2 ARG 46 HG2 ARG 46 42.772 32.197 37.862 313 HG3 ARG 46 HG3 ARG 46 41.278 31.604 38.571 314 HD2 ARG 46 HD2 ARG 46 43.597 32.871 40.093 315 HD3 ARG 46 HD3 ARG 46 42.193 33.745 39.477 316 HE ARG 46 HE ARG 46 41.581 31.505 41.302 317 HH11 ARG 46 HH11 ARG 46 42.204 34.985 41.125 318 HH12 ARG 46 HH12 ARG 46 41.257 35.282 42.569 319 HH21 ARG 46 HH21 ARG 46 40.518 32.035 43.250 320 HH22 ARG 46 HH22 ARG 46 40.532 33.685 43.796 321 H MET 47 H MET 47 45.341 30.621 37.164 322 HA MET 47 HA MET 47 44.305 32.223 35.010 323 HB2 MET 47 HB2 MET 47 47.128 31.654 35.979 324 HB3 MET 47 HB3 MET 47 46.738 32.781 34.666 325 HG2 MET 47 HG2 MET 47 45.386 34.148 36.092 326 HG3 MET 47 HG3 MET 47 45.500 33.010 37.421 327 HE1 MET 47 HE1 MET 47 48.556 34.150 35.137 328 HE2 MET 47 HE2 MET 47 47.535 35.608 35.218 329 HE3 MET 47 HE3 MET 47 49.116 35.567 36.034 330 H LEU 48 H LEU 48 45.948 29.061 34.978 331 HA LEU 48 HA LEU 48 46.023 28.767 32.109 332 HB2 LEU 48 HB2 LEU 48 47.308 27.241 33.349 333 HB3 LEU 48 HB3 LEU 48 45.994 26.880 34.459 334 HG LEU 48 HG LEU 48 44.810 25.565 32.792 335 HD11 LEU 48 HD11 LEU 48 45.803 24.949 30.642 336 HD12 LEU 48 HD12 LEU 48 47.141 26.074 30.913 337 HD13 LEU 48 HD13 LEU 48 45.505 26.686 30.669 338 HD21 LEU 48 HD21 LEU 48 46.440 23.729 32.585 339 HD22 LEU 48 HD22 LEU 48 46.458 24.457 34.194 340 HD23 LEU 48 HD23 LEU 48 47.754 24.836 33.036 341 H ALA 49 H ALA 49 43.477 27.679 34.493 342 HA ALA 49 HA ALA 49 41.735 26.655 32.532 343 HB1 ALA 49 HB1 ALA 49 41.524 26.226 34.947 344 HB2 ALA 49 HB2 ALA 49 41.081 27.924 35.231 345 HB3 ALA 49 HB3 ALA 49 40.003 26.869 34.292 346 H GLN 50 H GLN 50 41.747 29.987 33.918 347 HA GLN 50 HA GLN 50 39.663 30.918 32.174 348 HB2 GLN 50 HB2 GLN 50 41.771 32.379 33.798 349 HB3 GLN 50 HB3 GLN 50 40.532 33.198 32.832 350 HG2 GLN 50 HG2 GLN 50 38.770 31.879 34.088 351 HG3 GLN 50 HG3 GLN 50 40.046 31.269 35.147 352 HE21 GLN 50 HE21 GLN 50 39.626 32.318 37.113 353 HE22 GLN 50 HE22 GLN 50 39.541 34.080 37.251 354 H LEU 51 H LEU 51 43.292 31.019 31.695 355 HA LEU 51 HA LEU 51 43.088 32.352 29.160 356 HB2 LEU 51 HB2 LEU 51 45.143 32.192 30.391 357 HB3 LEU 51 HB3 LEU 51 45.171 30.434 30.276 358 HG LEU 51 HG LEU 51 45.197 32.112 27.743 359 HD11 LEU 51 HD11 LEU 51 46.958 33.084 29.101 360 HD12 LEU 51 HD12 LEU 51 47.688 32.063 27.867 361 HD13 LEU 51 HD13 LEU 51 47.579 31.468 29.525 362 HD21 LEU 51 HD21 LEU 51 45.055 29.669 27.390 363 HD22 LEU 51 HD22 LEU 51 46.398 29.403 28.508 364 HD23 LEU 51 HD23 LEU 51 46.666 30.224 26.962 365 H ARG 52 H ARG 52 42.844 28.883 29.971 366 HA ARG 52 HA ARG 52 42.661 27.946 27.274 367 HB2 ARG 52 HB2 ARG 52 43.188 26.658 29.384 368 HB3 ARG 52 HB3 ARG 52 41.462 26.665 29.764 369 HG2 ARG 52 HG2 ARG 52 40.971 25.411 27.707 370 HG3 ARG 52 HG3 ARG 52 42.623 25.610 27.154 371 HD2 ARG 52 HD2 ARG 52 42.499 23.380 28.039 372 HD3 ARG 52 HD3 ARG 52 43.369 24.319 29.261 373 HE ARG 52 HE ARG 52 40.426 24.169 29.545 374 HH11 ARG 52 HH11 ARG 52 43.343 22.491 30.769 375 HH12 ARG 52 HH12 ARG 52 42.454 22.115 32.240 376 HH21 ARG 52 HH21 ARG 52 39.536 23.528 31.220 377 HH22 ARG 52 HH22 ARG 52 40.363 22.563 32.449 378 H GLU 53 H GLU 53 40.163 29.101 29.534 379 HA GLU 53 HA GLU 53 38.016 28.665 27.636 380 HB2 GLU 53 HB2 GLU 53 38.237 30.412 30.125 381 HB3 GLU 53 HB3 GLU 53 36.787 30.340 29.121 382 HG2 GLU 53 HG2 GLU 53 36.718 27.852 29.442 383 HG3 GLU 53 HG3 GLU 53 38.049 27.995 30.596 384 H ARG 54 H ARG 54 40.164 31.459 28.174 385 HA ARG 54 HA ARG 54 38.728 33.216 26.304 386 HB2 ARG 54 HB2 ARG 54 41.511 33.344 27.530 387 HB3 ARG 54 HB3 ARG 54 40.826 34.614 26.534 388 HG2 ARG 54 HG2 ARG 54 39.742 33.766 29.245 389 HG3 ARG 54 HG3 ARG 54 40.813 35.112 28.931 390 HD2 ARG 54 HD2 ARG 54 38.702 36.089 29.154 391 HD3 ARG 54 HD3 ARG 54 39.012 36.088 27.421 392 HE ARG 54 HE ARG 54 37.087 34.835 27.169 393 HH11 ARG 54 HH11 ARG 54 38.010 34.272 30.575 394 HH12 ARG 54 HH12 ARG 54 36.621 33.189 30.731 395 HH21 ARG 54 HH21 ARG 54 35.427 33.626 27.621 396 HH22 ARG 54 HH22 ARG 54 35.246 32.876 29.216 397 H HIS 55 H HIS 55 41.437 31.007 25.998 398 HA HIS 55 HA HIS 55 41.871 31.879 23.173 399 HB2 HIS 55 HB2 HIS 55 43.421 32.557 25.178 400 HB3 HIS 55 HB3 HIS 55 44.041 30.921 25.050 401 HD1 HIS 55 HD1 HIS 55 44.045 30.883 21.778 402 HD2 HIS 55 HD2 HIS 55 45.501 33.898 24.312 403 HE1 HIS 55 HE1 HIS 55 45.684 32.264 20.383 404 H GLY 56 H GLY 56 41.021 29.070 24.947 405 HA2 GLY 56 HA2 GLY 56 40.703 26.917 24.259 406 HA3 GLY 56 HA3 GLY 56 41.027 27.459 22.618 407 H VAL 57 H VAL 57 43.569 27.769 25.042 408 HA VAL 57 HA VAL 57 45.031 25.437 23.909 409 HB VAL 57 HB VAL 57 47.116 26.799 23.880 410 HG11 VAL 57 HG11 VAL 57 45.890 26.255 21.843 411 HG12 VAL 57 HG12 VAL 57 44.931 27.744 22.003 412 HG13 VAL 57 HG13 VAL 57 46.686 27.833 21.734 413 HG21 VAL 57 HG21 VAL 57 46.384 28.679 25.315 414 HG22 VAL 57 HG22 VAL 57 47.019 29.220 23.755 415 HG23 VAL 57 HG23 VAL 57 45.268 29.212 24.032 416 H ASP 58 H ASP 58 46.859 24.732 25.041 417 HA ASP 58 HA ASP 58 46.290 24.609 27.909 418 HB2 ASP 58 HB2 ASP 58 46.408 22.617 26.367 419 HB3 ASP 58 HB3 ASP 58 48.125 22.945 26.136 420 H LEU 59 H LEU 59 48.037 24.454 29.471 421 HA LEU 59 HA LEU 59 50.694 25.591 28.701 422 HB2 LEU 59 HB2 LEU 59 49.285 26.024 31.364 423 HB3 LEU 59 HB3 LEU 59 51.018 26.064 31.158 424 HG LEU 59 HG LEU 59 50.729 27.875 29.415 425 HD11 LEU 59 HD11 LEU 59 48.772 29.304 29.554 426 HD12 LEU 59 HD12 LEU 59 47.991 28.200 30.703 427 HD13 LEU 59 HD13 LEU 59 48.278 27.701 29.017 428 HD21 LEU 59 HD21 LEU 59 50.528 29.622 31.166 429 HD22 LEU 59 HD22 LEU 59 51.578 28.289 31.665 430 HD23 LEU 59 HD23 LEU 59 49.922 28.391 32.298 431 HA PRO 60 HA PRO 60 50.785 21.113 29.679 432 HB2 PRO 60 HB2 PRO 60 53.212 21.185 27.926 433 HB3 PRO 60 HB3 PRO 60 51.816 20.065 27.898 434 HG2 PRO 60 HG2 PRO 60 52.073 21.999 26.022 435 HG3 PRO 60 HG3 PRO 60 50.472 21.622 26.729 436 HD2 PRO 60 HD2 PRO 60 52.363 23.856 27.534 437 HD3 PRO 60 HD3 PRO 60 50.616 23.925 27.173 438 H LEU 61 H LEU 61 51.887 20.114 31.319 439 HA LEU 61 HA LEU 61 53.644 21.586 32.990 440 HB2 LEU 61 HB2 LEU 61 52.980 18.634 32.758 441 HB3 LEU 61 HB3 LEU 61 54.005 19.267 34.041 442 HG LEU 61 HG LEU 61 51.176 20.296 33.582 443 HD11 LEU 61 HD11 LEU 61 51.114 17.866 34.008 444 HD12 LEU 61 HD12 LEU 61 50.488 18.787 35.384 445 HD13 LEU 61 HD13 LEU 61 52.126 18.091 35.451 446 HD21 LEU 61 HD21 LEU 61 52.613 21.757 34.959 447 HD22 LEU 61 HD22 LEU 61 53.062 20.378 35.984 448 HD23 LEU 61 HD23 LEU 61 51.388 20.968 35.958 449 H ARG 62 H ARG 62 54.451 19.279 30.428 450 HA ARG 62 HA ARG 62 57.278 19.054 30.862 451 HB2 ARG 62 HB2 ARG 62 55.968 17.568 29.426 452 HB3 ARG 62 HB3 ARG 62 55.532 18.910 28.370 453 HG2 ARG 62 HG2 ARG 62 57.927 19.140 27.691 454 HG3 ARG 62 HG3 ARG 62 58.340 17.811 28.779 455 HD2 ARG 62 HD2 ARG 62 58.178 17.018 26.490 456 HD3 ARG 62 HD3 ARG 62 56.903 16.277 27.476 457 HE ARG 62 HE ARG 62 55.886 18.635 26.208 458 HH11 ARG 62 HH11 ARG 62 56.788 15.348 25.248 459 HH12 ARG 62 HH12 ARG 62 55.578 15.373 23.968 460 HH21 ARG 62 HH21 ARG 62 54.583 18.556 24.387 461 HH22 ARG 62 HH22 ARG 62 54.461 17.044 23.509 462 H CYS 63 H CYS 63 55.542 21.234 28.608 463 HA CYS 63 HA CYS 63 57.731 22.905 27.911 464 HB2 CYS 63 HB2 CYS 63 55.731 22.966 26.605 465 HB3 CYS 63 HB3 CYS 63 54.729 23.383 28.028 466 HG CYS 63 HG CYS 63 57.228 25.093 26.696 467 H LEU 64 H LEU 64 55.404 23.224 30.624 468 HA LEU 64 HA LEU 64 56.515 25.578 31.759 469 HB2 LEU 64 HB2 LEU 64 54.312 24.099 32.166 470 HB3 LEU 64 HB3 LEU 64 55.299 23.368 33.415 471 HG LEU 64 HG LEU 64 55.625 25.721 34.377 472 HD11 LEU 64 HD11 LEU 64 53.856 27.379 33.664 473 HD12 LEU 64 HD12 LEU 64 53.452 26.319 32.305 474 HD13 LEU 64 HD13 LEU 64 55.055 27.079 32.403 475 HD21 LEU 64 HD21 LEU 64 53.330 25.735 35.336 476 HD22 LEU 64 HD22 LEU 64 54.025 24.110 35.303 477 HD23 LEU 64 HD23 LEU 64 52.806 24.583 34.092 478 H TYR 65 H TYR 65 57.548 22.187 32.122 479 HA TYR 65 HA TYR 65 59.471 22.737 34.209 480 HB2 TYR 65 HB2 TYR 65 58.398 20.465 33.426 481 HB3 TYR 65 HB3 TYR 65 59.765 20.403 32.328 482 HD1 TYR 65 HD1 TYR 65 62.149 20.522 33.358 483 HD2 TYR 65 HD2 TYR 65 58.582 20.028 35.732 484 HE1 TYR 65 HE1 TYR 65 63.532 19.877 35.327 485 HE2 TYR 65 HE2 TYR 65 59.952 19.367 37.674 486 HH TYR 65 HH TYR 65 62.053 18.995 38.481 487 H GLU 66 H GLU 66 59.759 22.505 30.629 488 HA GLU 66 HA GLU 66 62.649 23.090 30.828 489 HB2 GLU 66 HB2 GLU 66 62.812 22.718 28.505 490 HB3 GLU 66 HB3 GLU 66 61.859 21.444 29.258 491 HG2 GLU 66 HG2 GLU 66 59.783 22.514 28.409 492 HG3 GLU 66 HG3 GLU 66 60.754 23.752 27.609 493 H ALA 67 H ALA 67 59.811 25.031 30.102 494 HA ALA 67 HA ALA 67 61.493 27.475 29.870 495 HB1 ALA 67 HB1 ALA 67 61.093 26.618 27.603 496 HB2 ALA 67 HB2 ALA 67 59.346 26.545 27.921 497 HB3 ALA 67 HB3 ALA 67 60.171 28.114 27.882 498 HA PRO 68 HA PRO 68 57.750 28.034 32.601 499 HB2 PRO 68 HB2 PRO 68 58.962 29.036 34.859 500 HB3 PRO 68 HB3 PRO 68 58.832 27.298 34.482 501 HG2 PRO 68 HG2 PRO 68 61.165 29.166 33.941 502 HG3 PRO 68 HG3 PRO 68 61.196 27.553 34.724 503 HD2 PRO 68 HD2 PRO 68 61.787 27.874 32.089 504 HD3 PRO 68 HD3 PRO 68 60.883 26.442 32.670 505 H THR 69 H THR 69 59.681 30.176 30.912 506 HA THR 69 HA THR 69 58.451 32.672 31.899 507 HB THR 69 HB THR 69 59.584 33.505 29.674 508 HG1 THR 69 HG1 THR 69 61.384 32.301 29.147 509 HG21 THR 69 HG21 THR 69 60.382 34.064 31.955 510 HG22 THR 69 HG22 THR 69 61.717 33.822 30.820 511 HG23 THR 69 HG23 THR 69 61.303 32.543 31.982 512 H VAL 70 H VAL 70 56.501 33.362 31.197 513 HA VAL 70 HA VAL 70 54.825 31.816 29.508 514 HB VAL 70 HB VAL 70 54.543 34.774 30.149 515 HG11 VAL 70 HG11 VAL 70 52.448 32.749 29.215 516 HG12 VAL 70 HG12 VAL 70 52.113 34.413 29.741 517 HG13 VAL 70 HG13 VAL 70 53.041 34.120 28.268 518 HG21 VAL 70 HG21 VAL 70 53.035 34.091 31.922 519 HG22 VAL 70 HG22 VAL 70 53.211 32.374 31.488 520 HG23 VAL 70 HG23 VAL 70 54.572 33.259 32.179 521 H ALA 71 H ALA 71 56.964 34.535 28.597 522 HA ALA 71 HA ALA 71 56.093 34.883 25.910 523 HB1 ALA 71 HB1 ALA 71 58.405 35.790 25.601 524 HB2 ALA 71 HB2 ALA 71 57.635 36.403 27.078 525 HB3 ALA 71 HB3 ALA 71 58.862 35.118 27.180 526 H ARG 72 H ARG 72 58.518 32.624 27.235 527 HA ARG 72 HA ARG 72 59.231 31.482 24.630 528 HB2 ARG 72 HB2 ARG 72 60.762 31.945 26.594 529 HB3 ARG 72 HB3 ARG 72 59.965 30.610 27.439 530 HG2 ARG 72 HG2 ARG 72 60.760 29.029 25.761 531 HG3 ARG 72 HG3 ARG 72 61.451 30.346 24.786 532 HD2 ARG 72 HD2 ARG 72 63.169 30.775 26.295 533 HD3 ARG 72 HD3 ARG 72 62.227 30.216 27.678 534 HE ARG 72 HE ARG 72 63.085 28.172 25.676 535 HH11 ARG 72 HH11 ARG 72 63.842 29.531 28.853 536 HH12 ARG 72 HH12 ARG 72 64.396 27.979 29.427 537 HH21 ARG 72 HH21 ARG 72 64.034 26.403 26.412 538 HH22 ARG 72 HH22 ARG 72 64.742 26.355 28.032 539 H LEU 73 H LEU 73 57.242 30.533 27.421 540 HA LEU 73 HA LEU 73 56.374 27.991 26.462 541 HB2 LEU 73 HB2 LEU 73 55.953 28.916 28.665 542 HB3 LEU 73 HB3 LEU 73 54.858 30.123 28.026 543 HG LEU 73 HG LEU 73 54.212 27.309 27.274 544 HD11 LEU 73 HD11 LEU 73 53.777 28.299 30.120 545 HD12 LEU 73 HD12 LEU 73 54.868 26.983 29.629 546 HD13 LEU 73 HD13 LEU 73 53.125 26.796 29.415 547 HD21 LEU 73 HD21 LEU 73 51.947 28.018 27.562 548 HD22 LEU 73 HD22 LEU 73 52.784 29.261 26.650 549 HD23 LEU 73 HD23 LEU 73 52.455 29.522 28.375 550 H ALA 74 H ALA 74 54.963 31.298 25.849 551 HA ALA 74 HA ALA 74 53.098 30.382 23.933 552 HB1 ALA 74 HB1 ALA 74 53.072 32.616 25.010 553 HB2 ALA 74 HB2 ALA 74 54.491 33.090 24.048 554 HB3 ALA 74 HB3 ALA 74 52.956 32.701 23.244 555 H GLU 75 H GLU 75 56.562 31.347 23.472 556 HA GLU 75 HA GLU 75 56.442 31.052 20.588 557 HB2 GLU 75 HB2 GLU 75 58.857 30.873 22.440 558 HB3 GLU 75 HB3 GLU 75 58.929 30.727 20.688 559 HG2 GLU 75 HG2 GLU 75 57.541 33.039 20.819 560 HG3 GLU 75 HG3 GLU 75 58.433 33.145 22.346 561 H THR 76 H THR 76 57.076 28.627 23.126 562 HA THR 76 HA THR 76 57.744 26.570 21.130 563 HB THR 76 HB THR 76 57.756 25.013 23.102 564 HG1 THR 76 HG1 THR 76 57.666 27.409 24.581 565 HG21 THR 76 HG21 THR 76 59.871 25.930 24.015 566 HG22 THR 76 HG22 THR 76 59.527 27.502 23.259 567 HG23 THR 76 HG23 THR 76 59.818 26.077 22.250 568 H ILE 77 H ILE 77 54.880 27.328 23.124 569 HA ILE 77 HA ILE 77 53.342 25.105 22.134 570 HB ILE 77 HB ILE 77 52.517 27.701 23.469 571 HG12 ILE 77 HG12 ILE 77 53.909 26.263 24.906 572 HG13 ILE 77 HG13 ILE 77 52.263 26.334 25.491 573 HG21 ILE 77 HG21 ILE 77 50.821 25.258 22.834 574 HG22 ILE 77 HG22 ILE 77 50.370 26.510 24.011 575 HG23 ILE 77 HG23 ILE 77 50.557 26.933 22.306 576 HD11 ILE 77 HD11 ILE 77 53.339 24.100 25.645 577 HD12 ILE 77 HD12 ILE 77 51.844 24.068 24.683 578 HD13 ILE 77 HD13 ILE 77 53.448 24.001 23.903 579 H VAL 78 H VAL 78 53.843 28.377 20.758 580 HA VAL 78 HA VAL 78 52.116 27.696 18.479 581 HB VAL 78 HB VAL 78 54.251 29.818 18.762 582 HG11 VAL 78 HG11 VAL 78 53.964 29.234 16.364 583 HG12 VAL 78 HG12 VAL 78 52.204 29.367 16.533 584 HG13 VAL 78 HG13 VAL 78 53.235 30.800 16.710 585 HG21 VAL 78 HG21 VAL 78 52.331 31.353 18.877 586 HG22 VAL 78 HG22 VAL 78 51.198 29.992 18.724 587 HG23 VAL 78 HG23 VAL 78 52.206 30.160 20.172 588 H ARG 79 H ARG 79 55.744 27.610 18.897 589 HA ARG 79 HA ARG 79 56.258 26.664 16.280 590 HB2 ARG 79 HB2 ARG 79 57.959 27.684 17.695 591 HB3 ARG 79 HB3 ARG 79 57.821 26.382 18.864 592 HG2 ARG 79 HG2 ARG 79 59.847 26.069 17.746 593 HG3 ARG 79 HG3 ARG 79 58.805 24.788 17.164 594 HD2 ARG 79 HD2 ARG 79 59.399 27.417 15.719 595 HD3 ARG 79 HD3 ARG 79 60.269 25.905 15.438 596 HE ARG 79 HE ARG 79 57.787 25.054 14.913 597 HH11 ARG 79 HH11 ARG 79 59.248 28.085 13.771 598 HH12 ARG 79 HH12 ARG 79 57.948 28.286 12.620 599 HH21 ARG 79 HH21 ARG 79 56.640 25.164 13.051 600 HH22 ARG 79 HH22 ARG 79 56.696 26.610 12.065 601 H LEU 80 H LEU 80 55.534 24.732 19.146 602 HA LEU 80 HA LEU 80 55.751 22.213 17.571 603 HB2 LEU 80 HB2 LEU 80 55.614 22.649 20.576 604 HB3 LEU 80 HB3 LEU 80 55.628 21.103 19.754 605 HG LEU 80 HG LEU 80 57.888 21.918 18.680 606 HD11 LEU 80 HD11 LEU 80 57.915 24.218 19.608 607 HD12 LEU 80 HD12 LEU 80 59.260 23.262 20.220 608 HD13 LEU 80 HD13 LEU 80 57.841 23.555 21.250 609 HD21 LEU 80 HD21 LEU 80 57.638 21.121 21.622 610 HD22 LEU 80 HD22 LEU 80 59.088 20.922 20.611 611 HD23 LEU 80 HD23 LEU 80 57.619 20.009 20.240 612 H ALA 81 H ALA 81 53.411 24.395 18.004 613 HA ALA 81 HA ALA 81 51.213 24.551 18.054 614 HB1 ALA 81 HB1 ALA 81 51.494 23.318 15.982 615 HB2 ALA 81 HB2 ALA 81 51.276 21.774 16.838 616 HB3 ALA 81 HB3 ALA 81 49.940 22.941 16.743 617 H ALA 82 H ALA 82 52.311 21.876 19.966 618 HA ALA 82 HA ALA 82 51.439 20.568 21.580 619 HB1 ALA 82 HB1 ALA 82 51.536 22.707 22.766 620 HB2 ALA 82 HB2 ALA 82 49.843 23.035 22.330 621 HB3 ALA 82 HB3 ALA 82 50.252 21.654 23.375 622 HA PRO 83 HA PRO 83 48.426 20.037 18.273 623 HB2 PRO 83 HB2 PRO 83 48.845 17.096 18.853 624 HB3 PRO 83 HB3 PRO 83 48.598 17.909 17.271 625 HG2 PRO 83 HG2 PRO 83 51.112 17.381 18.065 626 HG3 PRO 83 HG3 PRO 83 50.730 19.006 17.413 627 HD2 PRO 83 HD2 PRO 83 51.023 18.167 20.305 628 HD3 PRO 83 HD3 PRO 83 51.630 19.622 19.478 629 H ALA 84 H ALA 84 47.753 17.857 21.112 630 HA ALA 84 HA ALA 84 44.934 18.795 20.965 631 HB1 ALA 84 HB1 ALA 84 44.067 16.528 21.173 632 HB2 ALA 84 HB2 ALA 84 44.941 16.787 19.654 633 HB3 ALA 84 HB3 ALA 84 45.707 15.873 20.962 634 HA PRO 85 HA PRO 85 45.876 19.091 25.386 635 HB2 PRO 85 HB2 PRO 85 42.990 19.928 25.476 636 HB3 PRO 85 HB3 PRO 85 44.418 20.708 26.228 637 HG2 PRO 85 HG2 PRO 85 43.308 21.746 23.976 638 HG3 PRO 85 HG3 PRO 85 45.093 21.645 24.133 639 HD2 PRO 85 HD2 PRO 85 43.232 19.770 22.662 640 HD3 PRO 85 HD3 PRO 85 44.777 20.511 22.132 641 H SER 86 H SER 86 45.205 18.036 27.356 642 HA SER 86 HA SER 86 44.027 15.391 27.015 643 HB2 SER 86 HB2 SER 86 44.790 16.937 29.518 644 HB3 SER 86 HB3 SER 86 44.254 15.248 29.481 645 HG SER 86 HG SER 86 46.470 15.362 29.503 646 H GLY 87 H GLY 87 42.124 14.592 27.899 647 HA2 GLY 87 HA2 GLY 87 39.877 16.506 27.936 648 HA3 GLY 87 HA3 GLY 87 39.785 14.754 27.704 649 H ASP 88 H ASP 88 41.673 16.205 30.271 650 HA ASP 88 HA ASP 88 40.012 14.748 32.207 651 HB2 ASP 88 HB2 ASP 88 42.414 14.174 31.998 652 HB3 ASP 88 HB3 ASP 88 42.816 15.786 32.604 653 H GLN 89 H GLN 89 39.550 15.686 34.296 654 HA GLN 89 HA GLN 89 38.536 18.413 34.145 655 HB2 GLN 89 HB2 GLN 89 37.576 17.862 36.363 656 HB3 GLN 89 HB3 GLN 89 37.126 16.755 35.073 657 HG2 GLN 89 HG2 GLN 89 38.629 15.040 35.881 658 HG3 GLN 89 HG3 GLN 89 39.363 16.161 37.050 659 HE21 GLN 89 HE21 GLN 89 36.322 14.392 36.258 660 HE22 GLN 89 HE22 GLN 89 35.561 14.810 37.792 661 H ASP 90 H ASP 90 38.758 19.968 36.004 662 HA ASP 90 HA ASP 90 41.550 20.056 37.069 663 HB2 ASP 90 HB2 ASP 90 40.239 22.594 36.176 664 HB3 ASP 90 HB3 ASP 90 41.942 22.190 36.300 665 H ASP 91 H ASP 91 41.791 20.815 39.130 666 HA ASP 91 HA ASP 91 39.390 21.741 40.602 667 HB2 ASP 91 HB2 ASP 91 40.420 21.141 42.563 668 HB3 ASP 91 HB3 ASP 91 40.832 19.882 41.406 669 H ALA 92 H ALA 92 42.131 23.193 39.164 670 HA ALA 92 HA ALA 92 42.920 25.333 39.127 671 HB1 ALA 92 HB1 ALA 92 39.952 25.831 39.465 672 HB2 ALA 92 HB2 ALA 92 41.132 26.954 38.736 673 HB3 ALA 92 HB3 ALA 92 40.783 25.391 37.967 674 H SER 93 H SER 93 40.702 27.051 41.059 675 HA SER 93 HA SER 93 42.332 26.862 43.524 676 HB2 SER 93 HB2 SER 93 42.545 29.250 43.729 677 HB3 SER 93 HB3 SER 93 43.213 28.785 42.170 678 HG SER 93 HG SER 93 40.664 29.914 42.726 679 H GLU 94 H GLU 94 41.325 27.952 45.352 680 HA GLU 94 HA GLU 94 38.454 28.101 45.622 681 HB2 GLU 94 HB2 GLU 94 38.998 29.512 47.571 682 HB3 GLU 94 HB3 GLU 94 39.925 28.012 47.549 683 HG2 GLU 94 HG2 GLU 94 41.909 29.268 46.646 684 HG3 GLU 94 HG3 GLU 94 40.961 30.757 46.701 685 H TYR 95 H TYR 95 37.198 30.129 45.733 686 HA TYR 95 HA TYR 95 38.304 32.483 44.302 687 HB2 TYR 95 HB2 TYR 95 35.832 30.916 43.495 688 HB3 TYR 95 HB3 TYR 95 36.016 32.613 43.124 689 HD1 TYR 95 HD1 TYR 95 36.963 29.233 42.100 690 HD2 TYR 95 HD2 TYR 95 37.825 33.433 41.642 691 HE1 TYR 95 HE1 TYR 95 37.980 28.787 39.866 692 HE2 TYR 95 HE2 TYR 95 38.848 32.984 39.430 693 HH TYR 95 HH TYR 95 38.891 29.724 37.938 694 H GLU 96 H GLU 96 37.699 34.358 45.159 695 HA GLU 96 HA GLU 96 35.623 34.515 47.282 696 HB2 GLU 96 HB2 GLU 96 37.786 36.399 46.273 697 HB3 GLU 96 HB3 GLU 96 36.478 36.948 47.317 698 HG2 GLU 96 HG2 GLU 96 37.114 35.306 49.045 699 HG3 GLU 96 HG3 GLU 96 38.445 34.741 48.026 700 H GLU 97 H GLU 97 33.906 36.057 47.214 701 HA GLU 97 HA GLU 97 32.795 36.492 44.527 702 HB2 GLU 97 HB2 GLU 97 30.782 37.109 45.605 703 HB3 GLU 97 HB3 GLU 97 31.347 35.589 46.264 704 HG2 GLU 97 HG2 GLU 97 31.957 38.179 47.732 705 HG3 GLU 97 HG3 GLU 97 30.347 37.488 47.782 706 H GLY 98 H GLY 98 34.889 38.254 46.431 707 HA2 GLY 98 HA2 GLY 98 35.892 40.296 45.887 708 HA3 GLY 98 HA3 GLY 98 34.653 40.597 44.664 709 H VAL 99 H VAL 99 33.729 39.805 47.943 710 HA VAL 99 HA VAL 99 32.299 40.842 49.361 711 HB VAL 99 HB VAL 99 34.169 43.210 49.329 712 HG11 VAL 99 HG11 VAL 99 33.841 43.084 51.772 713 HG12 VAL 99 HG12 VAL 99 32.277 43.210 50.982 714 HG13 VAL 99 HG13 VAL 99 32.826 41.636 51.588 715 HG21 VAL 99 HG21 VAL 99 35.681 41.289 49.215 716 HG22 VAL 99 HG22 VAL 99 35.668 41.934 50.848 717 HG23 VAL 99 HG23 VAL 99 34.760 40.451 50.488 718 H ILE 100 H ILE 100 31.318 41.166 46.746 719 HA ILE 100 HA ILE 100 30.397 43.890 46.435 720 HB ILE 100 HB ILE 100 30.857 42.526 44.506 721 HG12 ILE 100 HG12 ILE 100 27.899 43.268 44.636 722 HG13 ILE 100 HG13 ILE 100 29.224 44.420 44.456 723 HG21 ILE 100 HG21 ILE 100 30.071 40.302 45.403 724 HG22 ILE 100 HG22 ILE 100 28.399 40.852 45.170 725 HG23 ILE 100 HG23 ILE 100 29.489 40.664 43.784 726 HD11 ILE 100 HD11 ILE 100 28.465 42.255 42.466 727 HD12 ILE 100 HD12 ILE 100 28.260 44.003 42.290 728 HD13 ILE 100 HD13 ILE 100 29.895 43.311 42.332 729 H ARG 101 H ARG 101 28.671 44.878 47.165 730 HA ARG 101 HA ARG 101 26.447 43.368 48.493 731 HB2 ARG 101 HB2 ARG 101 27.965 45.745 49.640 732 HB3 ARG 101 HB3 ARG 101 26.498 45.030 50.319 733 HG2 ARG 101 HG2 ARG 101 27.802 42.868 50.606 734 HG3 ARG 101 HG3 ARG 101 29.246 43.739 50.068 735 HD2 ARG 101 HD2 ARG 101 29.343 43.796 52.422 736 HD3 ARG 101 HD3 ARG 101 28.832 45.412 51.942 737 HE ARG 101 HE ARG 101 26.988 43.242 52.920 738 HH11 ARG 101 HH11 ARG 101 27.617 46.735 52.861 739 HH12 ARG 101 HH12 ARG 101 26.470 46.992 54.160 740 HH21 ARG 101 HH21 ARG 101 25.549 43.712 54.486 741 HH22 ARG 101 HH22 ARG 101 25.322 45.350 55.009 Start of MODEL 10 1 H GLY 1 H1 GLY 1 41.892 44.356 34.803 2 HA2 GLY 1 HA2 GLY 1 42.252 45.424 32.646 3 HA3 GLY 1 HA3 GLY 1 40.935 46.534 33.079 4 H ALA 2 H ALA 2 43.228 47.690 32.516 5 HA ALA 2 HA ALA 2 44.361 48.738 35.030 6 HB1 ALA 2 HB1 ALA 2 45.605 46.633 34.570 7 HB2 ALA 2 HB2 ALA 2 46.054 47.249 32.966 8 HB3 ALA 2 HB3 ALA 2 46.658 48.044 34.435 9 H ALA 3 H ALA 3 46.307 50.276 34.388 10 HA ALA 3 HA ALA 3 45.523 51.917 32.006 11 HB1 ALA 3 HB1 ALA 3 46.998 52.722 34.547 12 HB2 ALA 3 HB2 ALA 3 46.516 53.792 33.211 13 HB3 ALA 3 HB3 ALA 3 45.277 53.011 34.209 14 H ALA 4 H ALA 4 48.247 50.274 33.601 15 HA ALA 4 HA ALA 4 50.310 51.387 31.988 16 HB1 ALA 4 HB1 ALA 4 51.675 49.551 32.942 17 HB2 ALA 4 HB2 ALA 4 50.706 50.377 34.175 18 HB3 ALA 4 HB3 ALA 4 50.192 48.791 33.567 19 H GLY 5 H GLY 5 51.514 50.584 30.306 20 HA2 GLY 5 HA2 GLY 5 50.980 48.159 28.851 21 HA3 GLY 5 HA3 GLY 5 50.231 49.545 28.053 22 H VAL 6 H VAL 6 51.783 48.833 26.332 23 HA VAL 6 HA VAL 6 54.563 49.897 26.725 24 HB VAL 6 HB VAL 6 53.747 47.371 25.245 25 HG11 VAL 6 HG11 VAL 6 56.475 48.638 25.681 26 HG12 VAL 6 HG12 VAL 6 56.212 47.015 25.040 27 HG13 VAL 6 HG13 VAL 6 55.655 48.407 24.120 28 HG21 VAL 6 HG21 VAL 6 53.727 47.016 27.683 29 HG22 VAL 6 HG22 VAL 6 55.133 46.222 26.975 30 HG23 VAL 6 HG23 VAL 6 55.331 47.767 27.826 31 H SER 7 H SER 7 55.332 51.251 25.221 32 HA SER 7 HA SER 7 53.608 52.457 23.326 33 HB2 SER 7 HB2 SER 7 56.640 52.574 23.534 34 HB3 SER 7 HB3 SER 7 55.637 53.648 22.544 35 HG SER 7 HG SER 7 56.252 53.956 25.057 36 H ALA 8 H ALA 8 56.361 50.202 22.626 37 HA ALA 8 HA ALA 8 55.608 50.065 19.819 38 HB1 ALA 8 HB1 ALA 8 57.374 48.324 19.716 39 HB2 ALA 8 HB2 ALA 8 57.923 49.841 20.450 40 HB3 ALA 8 HB3 ALA 8 57.559 48.439 21.482 41 H ALA 9 H ALA 9 54.482 48.547 18.745 42 HA ALA 9 HA ALA 9 52.584 46.914 20.204 43 HB1 ALA 9 HB1 ALA 9 53.122 47.229 17.225 44 HB2 ALA 9 HB2 ALA 9 51.710 46.430 17.942 45 HB3 ALA 9 HB3 ALA 9 51.964 48.169 18.196 46 H GLY 10 H GLY 10 52.580 44.753 20.611 47 HA2 GLY 10 HA2 GLY 10 52.893 42.515 20.348 48 HA3 GLY 10 HA3 GLY 10 53.599 42.848 18.769 49 H ILE 11 H ILE 11 55.244 44.271 21.468 50 HA ILE 11 HA ILE 11 57.730 43.233 20.890 51 HB ILE 11 HB ILE 11 58.483 43.991 23.043 52 HG12 ILE 11 HG12 ILE 11 56.821 43.246 24.615 53 HG13 ILE 11 HG13 ILE 11 57.091 44.955 24.759 54 HG21 ILE 11 HG21 ILE 11 56.461 45.915 21.844 55 HG22 ILE 11 HG22 ILE 11 57.839 46.332 22.875 56 HG23 ILE 11 HG23 ILE 11 58.115 45.621 21.278 57 HD11 ILE 11 HD11 ILE 11 54.926 45.357 23.506 58 HD12 ILE 11 HD12 ILE 11 54.630 43.601 23.601 59 HD13 ILE 11 HD13 ILE 11 54.765 44.556 25.076 60 H GLU 12 H GLU 12 55.337 41.694 22.933 61 HA GLU 12 HA GLU 12 56.847 39.175 22.812 62 HB2 GLU 12 HB2 GLU 12 55.426 40.147 25.323 63 HB3 GLU 12 HB3 GLU 12 56.186 38.576 25.124 64 HG2 GLU 12 HG2 GLU 12 57.672 41.234 25.154 65 HG3 GLU 12 HG3 GLU 12 57.436 40.178 26.531 66 HA PRO 13 HA PRO 13 52.872 37.601 21.590 67 HB2 PRO 13 HB2 PRO 13 53.250 35.396 23.623 68 HB3 PRO 13 HB3 PRO 13 52.735 35.273 21.908 69 HG2 PRO 13 HG2 PRO 13 55.290 34.711 22.538 70 HG3 PRO 13 HG3 PRO 13 54.949 35.775 21.133 71 HD2 PRO 13 HD2 PRO 13 55.715 36.597 23.951 72 HD3 PRO 13 HD3 PRO 13 56.396 37.141 22.387 73 H ASP 14 H ASP 14 50.689 37.360 22.165 74 HA ASP 14 HA ASP 14 49.798 39.203 24.097 75 HB2 ASP 14 HB2 ASP 14 48.767 38.439 21.924 76 HB3 ASP 14 HB3 ASP 14 48.142 37.025 22.772 77 H LEU 15 H LEU 15 50.304 35.733 24.493 78 HA LEU 15 HA LEU 15 48.926 35.179 26.846 79 HB2 LEU 15 HB2 LEU 15 50.464 33.649 25.545 80 HB3 LEU 15 HB3 LEU 15 51.839 34.494 26.257 81 HG LEU 15 HG LEU 15 51.070 33.762 28.541 82 HD11 LEU 15 HD11 LEU 15 48.680 33.445 28.179 83 HD12 LEU 15 HD12 LEU 15 49.387 31.892 28.619 84 HD13 LEU 15 HD13 LEU 15 48.997 32.224 26.918 85 HD21 LEU 15 HD21 LEU 15 51.632 31.377 28.286 86 HD22 LEU 15 HD22 LEU 15 52.743 32.435 27.425 87 HD23 LEU 15 HD23 LEU 15 51.493 31.538 26.517 88 H THR 16 H THR 16 51.647 37.394 26.486 89 HA THR 16 HA THR 16 52.215 37.624 29.363 90 HB THR 16 HB THR 16 53.425 39.685 28.784 91 HG1 THR 16 HG1 THR 16 52.783 39.060 26.080 92 HG21 THR 16 HG21 THR 16 54.568 37.499 28.617 93 HG22 THR 16 HG22 THR 16 55.212 38.692 27.485 94 HG23 THR 16 HG23 THR 16 54.138 37.399 26.895 95 H ALA 17 H ALA 17 50.151 39.382 27.071 96 HA ALA 17 HA ALA 17 49.270 41.374 28.966 97 HB1 ALA 17 HB1 ALA 17 47.725 41.973 27.186 98 HB2 ALA 17 HB2 ALA 17 49.354 41.747 26.534 99 HB3 ALA 17 HB3 ALA 17 48.110 40.492 26.295 100 H ILE 18 H ILE 18 48.027 38.224 27.869 101 HA ILE 18 HA ILE 18 45.566 38.226 29.359 102 HB ILE 18 HB ILE 18 47.372 35.919 28.530 103 HG12 ILE 18 HG12 ILE 18 44.820 36.951 27.212 104 HG13 ILE 18 HG13 ILE 18 46.431 37.355 26.655 105 HG21 ILE 18 HG21 ILE 18 45.382 34.479 28.842 106 HG22 ILE 18 HG22 ILE 18 45.858 35.216 30.357 107 HG23 ILE 18 HG23 ILE 18 44.468 35.867 29.468 108 HD11 ILE 18 HD11 ILE 18 45.860 35.612 25.248 109 HD12 ILE 18 HD12 ILE 18 46.814 34.772 26.475 110 HD13 ILE 18 HD13 ILE 18 45.039 34.696 26.522 111 H TRP 19 H TRP 19 48.852 36.950 30.272 112 HA TRP 19 HA TRP 19 47.968 36.260 32.921 113 HB2 TRP 19 HB2 TRP 19 50.714 36.558 31.687 114 HB3 TRP 19 HB3 TRP 19 50.447 36.066 33.354 115 HD1 TRP 19 HD1 TRP 19 47.760 34.447 31.506 116 HE1 TRP 19 HE1 TRP 19 48.282 31.986 31.064 117 HE3 TRP 19 HE3 TRP 19 52.766 34.494 32.488 118 HZ2 TRP 19 HZ2 TRP 19 50.572 30.244 31.128 119 HZ3 TRP 19 HZ3 TRP 19 54.109 32.401 32.310 120 HH2 TRP 19 HH2 TRP 19 53.010 30.271 31.653 121 H GLN 20 H GLN 20 49.654 39.270 31.761 122 HA GLN 20 HA GLN 20 49.771 40.331 34.421 123 HB2 GLN 20 HB2 GLN 20 50.560 42.294 33.520 124 HB3 GLN 20 HB3 GLN 20 51.034 41.092 32.328 125 HG2 GLN 20 HG2 GLN 20 48.902 41.767 31.056 126 HG3 GLN 20 HG3 GLN 20 48.823 43.156 32.128 127 HE21 GLN 20 HE21 GLN 20 48.973 43.811 29.573 128 HE22 GLN 20 HE22 GLN 20 50.625 44.171 29.029 129 H ALA 21 H ALA 21 47.137 40.461 31.954 130 HA ALA 21 HA ALA 21 45.491 42.144 33.589 131 HB1 ALA 21 HB1 ALA 21 43.714 41.495 32.010 132 HB2 ALA 21 HB2 ALA 21 45.204 41.975 31.185 133 HB3 ALA 21 HB3 ALA 21 44.771 40.247 31.321 134 H LEU 22 H LEU 22 45.639 38.542 33.340 135 HA LEU 22 HA LEU 22 43.358 38.180 35.104 136 HB2 LEU 22 HB2 LEU 22 45.501 36.299 34.052 137 HB3 LEU 22 HB3 LEU 22 44.217 35.772 35.132 138 HG LEU 22 HG LEU 22 43.758 36.960 32.361 139 HD11 LEU 22 HD11 LEU 22 44.802 34.686 32.397 140 HD12 LEU 22 HD12 LEU 22 43.158 34.680 31.736 141 HD13 LEU 22 HD13 LEU 22 43.448 34.106 33.392 142 HD21 LEU 22 HD21 LEU 22 41.434 36.095 32.682 143 HD22 LEU 22 HD22 LEU 22 41.815 37.418 33.778 144 HD23 LEU 22 HD23 LEU 22 41.815 35.744 34.381 145 H PHE 23 H PHE 23 46.865 38.366 35.696 146 HA PHE 23 HA PHE 23 46.364 37.919 38.562 147 HB2 PHE 23 HB2 PHE 23 48.316 36.894 37.344 148 HB3 PHE 23 HB3 PHE 23 48.960 38.524 37.142 149 HD1 PHE 23 HD1 PHE 23 47.320 37.355 40.345 150 HD2 PHE 23 HD2 PHE 23 51.026 37.987 38.230 151 HE1 PHE 23 HE1 PHE 23 48.561 37.150 42.461 152 HE2 PHE 23 HE2 PHE 23 52.268 37.795 40.367 153 HZ PHE 23 HZ PHE 23 51.036 37.392 42.491 154 H ALA 24 H ALA 24 46.009 40.484 36.569 155 HA ALA 24 HA ALA 24 45.818 42.698 36.750 156 HB1 ALA 24 HB1 ALA 24 44.495 43.419 38.661 157 HB2 ALA 24 HB2 ALA 24 43.947 41.845 38.058 158 HB3 ALA 24 HB3 ALA 24 44.922 41.930 39.542 159 H LEU 25 H LEU 25 48.360 42.360 36.716 160 HA LEU 25 HA LEU 25 49.311 44.525 38.484 161 HB2 LEU 25 HB2 LEU 25 51.582 43.486 38.583 162 HB3 LEU 25 HB3 LEU 25 50.318 42.749 39.541 163 HG LEU 25 HG LEU 25 50.150 40.862 37.991 164 HD11 LEU 25 HD11 LEU 25 50.762 41.863 35.854 165 HD12 LEU 25 HD12 LEU 25 51.868 40.545 36.231 166 HD13 LEU 25 HD13 LEU 25 52.401 42.228 36.449 167 HD21 LEU 25 HD21 LEU 25 52.378 39.894 38.455 168 HD22 LEU 25 HD22 LEU 25 51.773 40.797 39.855 169 HD23 LEU 25 HD23 LEU 25 53.018 41.502 38.805 170 HA PRO 26 HA PRO 26 50.121 46.919 35.244 171 HB2 PRO 26 HB2 PRO 26 52.990 47.447 36.043 172 HB3 PRO 26 HB3 PRO 26 51.683 48.621 35.706 173 HG2 PRO 26 HG2 PRO 26 52.348 48.049 38.255 174 HG3 PRO 26 HG3 PRO 26 50.620 48.146 37.796 175 HD2 PRO 26 HD2 PRO 26 52.354 45.684 38.100 176 HD3 PRO 26 HD3 PRO 26 50.714 45.990 38.730 177 H ALA 27 H ALA 27 53.011 44.792 35.409 178 HA ALA 27 HA ALA 27 53.109 44.677 32.439 179 HB1 ALA 27 HB1 ALA 27 54.420 46.647 33.188 180 HB2 ALA 27 HB2 ALA 27 55.359 45.608 34.266 181 HB3 ALA 27 HB3 ALA 27 55.472 45.399 32.507 182 H VAL 28 H VAL 28 53.513 42.707 31.710 183 HA VAL 28 HA VAL 28 55.429 40.926 33.162 184 HB VAL 28 HB VAL 28 52.970 40.119 31.581 185 HG11 VAL 28 HG11 VAL 28 54.741 38.593 30.925 186 HG12 VAL 28 HG12 VAL 28 55.238 38.371 32.617 187 HG13 VAL 28 HG13 VAL 28 53.661 37.770 32.051 188 HG21 VAL 28 HG21 VAL 28 52.361 38.960 33.670 189 HG22 VAL 28 HG22 VAL 28 53.869 39.522 34.439 190 HG23 VAL 28 HG23 VAL 28 52.616 40.682 33.984 191 H GLY 29 H GLY 29 57.225 40.574 32.097 192 HA2 GLY 29 HA2 GLY 29 57.741 39.989 29.456 193 HA3 GLY 29 HA3 GLY 29 57.589 41.745 29.433 194 H ARG 30 H ARG 30 58.948 41.162 32.421 195 HA ARG 30 HA ARG 30 61.643 41.789 31.386 196 HB2 ARG 30 HB2 ARG 30 62.222 42.429 33.635 197 HB3 ARG 30 HB3 ARG 30 60.774 43.249 33.063 198 HG2 ARG 30 HG2 ARG 30 59.351 41.799 34.425 199 HG3 ARG 30 HG3 ARG 30 60.763 40.873 34.962 200 HD2 ARG 30 HD2 ARG 30 61.660 43.070 35.911 201 HD3 ARG 30 HD3 ARG 30 60.051 43.746 35.627 202 HE ARG 30 HE ARG 30 60.842 41.675 37.617 203 HH11 ARG 30 HH11 ARG 30 57.978 43.300 36.241 204 HH12 ARG 30 HH12 ARG 30 57.063 42.769 37.663 205 HH21 ARG 30 HH21 ARG 30 59.541 41.078 39.149 206 HH22 ARG 30 HH22 ARG 30 57.835 41.552 39.144 207 H HIS 31 H HIS 31 61.253 39.405 30.532 208 HA HIS 31 HA HIS 31 61.743 37.202 30.517 209 HB2 HIS 31 HB2 HIS 31 63.961 38.486 30.413 210 HB3 HIS 31 HB3 HIS 31 64.292 37.829 32.008 211 HD1 HIS 31 HD1 HIS 31 64.230 34.891 31.943 212 HD2 HIS 31 HD2 HIS 31 64.370 37.060 28.337 213 HE1 HIS 31 HE1 HIS 31 64.908 33.238 30.142 214 H GLN 32 H GLN 32 59.845 37.142 32.084 215 HA GLN 32 HA GLN 32 60.537 36.153 34.808 216 HB2 GLN 32 HB2 GLN 32 57.987 37.201 33.565 217 HB3 GLN 32 HB3 GLN 32 58.109 36.612 35.233 218 HG2 GLN 32 HG2 GLN 32 59.549 38.423 35.864 219 HG3 GLN 32 HG3 GLN 32 59.851 38.869 34.186 220 HE21 GLN 32 HE21 GLN 32 57.498 39.152 36.849 221 HE22 GLN 32 HE22 GLN 32 56.495 40.297 35.963 222 H ASP 33 H ASP 33 60.195 34.135 35.487 223 HA ASP 33 HA ASP 33 59.172 32.112 33.620 224 HB2 ASP 33 HB2 ASP 33 60.514 31.917 36.326 225 HB3 ASP 33 HB3 ASP 33 59.853 30.524 35.473 226 H PHE 34 H PHE 34 57.541 30.622 33.965 227 HA PHE 34 HA PHE 34 55.124 31.535 35.085 228 HB2 PHE 34 HB2 PHE 34 55.188 29.936 33.326 229 HB3 PHE 34 HB3 PHE 34 56.047 28.757 34.313 230 HD1 PHE 34 HD1 PHE 34 54.747 27.002 35.224 231 HD2 PHE 34 HD2 PHE 34 52.852 30.801 34.440 232 HE1 PHE 34 HE1 PHE 34 52.566 26.068 35.932 233 HE2 PHE 34 HE2 PHE 34 50.679 29.861 35.148 234 HZ PHE 34 HZ PHE 34 50.527 27.492 35.904 235 H PHE 35 H PHE 35 57.724 29.989 36.811 236 HA PHE 35 HA PHE 35 56.327 29.072 39.122 237 HB2 PHE 35 HB2 PHE 35 59.106 30.285 38.936 238 HB3 PHE 35 HB3 PHE 35 58.489 29.263 40.232 239 HD1 PHE 35 HD1 PHE 35 60.558 29.184 37.435 240 HD2 PHE 35 HD2 PHE 35 57.347 26.951 39.259 241 HE1 PHE 35 HE1 PHE 35 61.252 27.156 36.190 242 HE2 PHE 35 HE2 PHE 35 58.058 24.922 38.029 243 HZ PHE 35 HZ PHE 35 60.003 25.021 36.485 244 H ALA 36 H ALA 36 57.472 32.370 38.274 245 HA ALA 36 HA ALA 36 56.393 33.464 40.813 246 HB1 ALA 36 HB1 ALA 36 57.795 34.769 38.442 247 HB2 ALA 36 HB2 ALA 36 57.370 35.566 39.973 248 HB3 ALA 36 HB3 ALA 36 58.563 34.254 39.960 249 H LEU 37 H LEU 37 55.761 33.590 37.302 250 HA LEU 37 HA LEU 37 53.734 35.598 37.425 251 HB2 LEU 37 HB2 LEU 37 54.346 33.471 35.342 252 HB3 LEU 37 HB3 LEU 37 53.215 34.778 35.081 253 HG LEU 37 HG LEU 37 56.193 35.151 35.652 254 HD11 LEU 37 HD11 LEU 37 56.344 35.742 33.289 255 HD12 LEU 37 HD12 LEU 37 54.612 35.493 33.075 256 HD13 LEU 37 HD13 LEU 37 55.687 34.116 33.454 257 HD21 LEU 37 HD21 LEU 37 55.722 37.494 34.854 258 HD22 LEU 37 HD22 LEU 37 54.983 37.119 36.407 259 HD23 LEU 37 HD23 LEU 37 53.986 37.126 34.932 260 H GLY 38 H GLY 38 53.439 32.174 38.081 261 HA2 GLY 38 HA2 GLY 38 50.634 31.890 37.585 262 HA3 GLY 38 HA3 GLY 38 51.604 30.924 38.709 263 H GLY 39 H GLY 39 52.292 33.513 40.212 264 HA2 GLY 39 HA2 GLY 39 51.522 34.951 41.805 265 HA3 GLY 39 HA3 GLY 39 49.908 34.781 41.103 266 H ASP 40 H ASP 40 49.285 32.171 41.624 267 HA ASP 40 HA ASP 40 49.907 31.369 44.349 268 HB2 ASP 40 HB2 ASP 40 47.900 32.987 44.561 269 HB3 ASP 40 HB3 ASP 40 46.962 31.780 43.660 270 H SER 41 H SER 41 48.684 29.087 44.764 271 HA SER 41 HA SER 41 48.796 27.478 42.330 272 HB2 SER 41 HB2 SER 41 47.759 25.728 43.769 273 HB3 SER 41 HB3 SER 41 49.301 26.358 44.360 274 HG SER 41 HG SER 41 47.830 26.157 46.006 275 H GLN 42 H GLN 42 46.165 28.932 44.280 276 HA GLN 42 HA GLN 42 44.035 27.932 42.672 277 HB2 GLN 42 HB2 GLN 42 44.174 29.142 45.035 278 HB3 GLN 42 HB3 GLN 42 43.925 30.598 44.105 279 HG2 GLN 42 HG2 GLN 42 42.085 28.149 44.012 280 HG3 GLN 42 HG3 GLN 42 41.848 29.533 45.076 281 HE21 GLN 42 HE21 GLN 42 41.094 28.318 41.929 282 HE22 GLN 42 HE22 GLN 42 40.417 29.853 41.372 283 H LEU 43 H LEU 43 45.870 30.996 42.483 284 HA LEU 43 HA LEU 43 44.413 32.080 40.266 285 HB2 LEU 43 HB2 LEU 43 45.883 33.185 42.103 286 HB3 LEU 43 HB3 LEU 43 47.246 32.793 41.086 287 HG LEU 43 HG LEU 43 46.537 35.116 40.958 288 HD11 LEU 43 HD11 LEU 43 45.975 33.790 38.291 289 HD12 LEU 43 HD12 LEU 43 47.586 34.163 38.956 290 HD13 LEU 43 HD13 LEU 43 46.453 35.468 38.573 291 HD21 LEU 43 HD21 LEU 43 44.455 35.846 39.990 292 HD22 LEU 43 HD22 LEU 43 44.109 34.769 41.353 293 HD23 LEU 43 HD23 LEU 43 43.950 34.176 39.682 294 H GLY 44 H GLY 44 47.419 30.101 40.433 295 HA2 GLY 44 HA2 GLY 44 48.015 29.981 37.658 296 HA3 GLY 44 HA3 GLY 44 48.399 28.756 38.876 297 H LEU 45 H LEU 45 46.054 27.715 39.678 298 HA LEU 45 HA LEU 45 45.146 26.002 37.601 299 HB2 LEU 45 HB2 LEU 45 43.950 26.820 40.274 300 HB3 LEU 45 HB3 LEU 45 43.210 25.595 39.256 301 HG LEU 45 HG LEU 45 46.079 25.352 40.259 302 HD11 LEU 45 HD11 LEU 45 43.526 24.180 41.442 303 HD12 LEU 45 HD12 LEU 45 44.513 25.460 42.178 304 HD13 LEU 45 HD13 LEU 45 45.186 23.837 41.979 305 HD21 LEU 45 HD21 LEU 45 45.733 22.966 39.813 306 HD22 LEU 45 HD22 LEU 45 45.559 23.916 38.330 307 HD23 LEU 45 HD23 LEU 45 44.115 23.302 39.167 308 H ARG 46 H ARG 46 43.627 28.956 38.917 309 HA ARG 46 HA ARG 46 41.331 29.104 37.258 310 HB2 ARG 46 HB2 ARG 46 41.710 30.477 39.279 311 HB3 ARG 46 HB3 ARG 46 43.036 31.317 38.479 312 HG2 ARG 46 HG2 ARG 46 41.304 32.108 36.730 313 HG3 ARG 46 HG3 ARG 46 40.073 31.509 37.841 314 HD2 ARG 46 HD2 ARG 46 42.184 33.634 38.392 315 HD3 ARG 46 HD3 ARG 46 40.466 33.920 38.118 316 HE ARG 46 HE ARG 46 40.602 32.171 40.312 317 HH11 ARG 46 HH11 ARG 46 41.391 35.564 39.668 318 HH12 ARG 46 HH12 ARG 46 41.132 35.953 41.371 319 HH21 ARG 46 HH21 ARG 46 40.644 32.790 42.438 320 HH22 ARG 46 HH22 ARG 46 40.787 34.512 42.811 321 H MET 47 H MET 47 44.539 30.715 36.688 322 HA MET 47 HA MET 47 43.634 31.774 34.190 323 HB2 MET 47 HB2 MET 47 45.835 32.511 33.756 324 HB3 MET 47 HB3 MET 47 45.509 32.753 35.470 325 HG2 MET 47 HG2 MET 47 46.901 30.838 36.043 326 HG3 MET 47 HG3 MET 47 47.083 30.397 34.349 327 HE1 MET 47 HE1 MET 47 49.194 33.974 36.359 328 HE2 MET 47 HE2 MET 47 47.431 33.932 36.181 329 HE3 MET 47 HE3 MET 47 48.250 32.740 37.222 330 H LEU 48 H LEU 48 45.410 28.736 34.897 331 HA LEU 48 HA LEU 48 45.816 28.044 32.150 332 HB2 LEU 48 HB2 LEU 48 46.936 27.067 34.221 333 HB3 LEU 48 HB3 LEU 48 45.476 26.144 34.512 334 HG LEU 48 HG LEU 48 47.194 24.797 33.518 335 HD11 LEU 48 HD11 LEU 48 44.832 24.312 32.799 336 HD12 LEU 48 HD12 LEU 48 46.117 23.703 31.739 337 HD13 LEU 48 HD13 LEU 48 45.207 25.137 31.261 338 HD21 LEU 48 HD21 LEU 48 48.117 25.147 31.306 339 HD22 LEU 48 HD22 LEU 48 48.423 26.576 32.306 340 HD23 LEU 48 HD23 LEU 48 47.142 26.606 31.069 341 H ALA 49 H ALA 49 43.189 27.058 34.448 342 HA ALA 49 HA ALA 49 41.811 25.520 32.500 343 HB1 ALA 49 HB1 ALA 49 40.797 26.860 35.043 344 HB2 ALA 49 HB2 ALA 49 39.926 25.624 34.110 345 HB3 ALA 49 HB3 ALA 49 41.458 25.215 34.891 346 H GLN 50 H GLN 50 41.174 28.941 33.591 347 HA GLN 50 HA GLN 50 38.994 29.331 31.795 348 HB2 GLN 50 HB2 GLN 50 40.892 31.328 33.095 349 HB3 GLN 50 HB3 GLN 50 39.535 31.800 32.071 350 HG2 GLN 50 HG2 GLN 50 37.980 30.515 33.580 351 HG3 GLN 50 HG3 GLN 50 39.332 30.207 34.662 352 HE21 GLN 50 HE21 GLN 50 37.430 31.342 36.011 353 HE22 GLN 50 HE22 GLN 50 37.735 33.061 36.224 354 H LEU 51 H LEU 51 42.540 29.943 31.238 355 HA LEU 51 HA LEU 51 42.058 30.990 28.602 356 HB2 LEU 51 HB2 LEU 51 44.075 31.473 29.919 357 HB3 LEU 51 HB3 LEU 51 44.563 29.771 29.817 358 HG LEU 51 HG LEU 51 44.778 29.991 27.354 359 HD11 LEU 51 HD11 LEU 51 44.098 32.917 27.856 360 HD12 LEU 51 HD12 LEU 51 43.165 31.779 26.886 361 HD13 LEU 51 HD13 LEU 51 44.768 32.271 26.339 362 HD21 LEU 51 HD21 LEU 51 46.776 31.393 27.353 363 HD22 LEU 51 HD22 LEU 51 46.720 30.389 28.811 364 HD23 LEU 51 HD23 LEU 51 46.300 32.117 28.906 365 H ARG 52 H ARG 52 42.786 27.648 29.743 366 HA ARG 52 HA ARG 52 42.959 26.439 27.156 367 HB2 ARG 52 HB2 ARG 52 43.663 25.381 29.258 368 HB3 ARG 52 HB3 ARG 52 41.988 25.310 29.814 369 HG2 ARG 52 HG2 ARG 52 41.399 23.728 28.072 370 HG3 ARG 52 HG3 ARG 52 42.953 23.943 27.261 371 HD2 ARG 52 HD2 ARG 52 43.029 21.862 28.499 372 HD3 ARG 52 HD3 ARG 52 44.134 23.035 29.231 373 HE ARG 52 HE ARG 52 41.410 22.886 30.378 374 HH11 ARG 52 HH11 ARG 52 44.662 21.590 30.699 375 HH12 ARG 52 HH12 ARG 52 44.442 21.242 32.392 376 HH21 ARG 52 HH21 ARG 52 41.234 22.471 32.564 377 HH22 ARG 52 HH22 ARG 52 42.586 21.720 33.401 378 H GLU 53 H GLU 53 40.182 27.074 29.232 379 HA GLU 53 HA GLU 53 38.188 25.920 27.484 380 HB2 GLU 53 HB2 GLU 53 38.085 27.826 29.850 381 HB3 GLU 53 HB3 GLU 53 36.668 27.133 29.090 382 HG2 GLU 53 HG2 GLU 53 38.839 25.288 30.124 383 HG3 GLU 53 HG3 GLU 53 37.690 26.012 31.233 384 H ARG 54 H ARG 54 39.525 29.206 27.746 385 HA ARG 54 HA ARG 54 37.539 30.355 25.884 386 HB2 ARG 54 HB2 ARG 54 39.973 31.428 27.354 387 HB3 ARG 54 HB3 ARG 54 39.072 32.404 26.203 388 HG2 ARG 54 HG2 ARG 54 37.105 32.421 27.486 389 HG3 ARG 54 HG3 ARG 54 37.621 31.054 28.483 390 HD2 ARG 54 HD2 ARG 54 39.387 32.449 29.519 391 HD3 ARG 54 HD3 ARG 54 38.968 33.786 28.456 392 HE ARG 54 HE ARG 54 37.367 34.421 29.939 393 HH11 ARG 54 HH11 ARG 54 37.331 30.946 30.261 394 HH12 ARG 54 HH12 ARG 54 36.262 31.032 31.642 395 HH21 ARG 54 HH21 ARG 54 36.484 34.415 31.963 396 HH22 ARG 54 HH22 ARG 54 35.811 32.941 32.604 397 H HIS 55 H HIS 55 41.007 29.587 25.713 398 HA HIS 55 HA HIS 55 41.098 30.507 22.882 399 HB2 HIS 55 HB2 HIS 55 42.343 31.728 24.687 400 HB3 HIS 55 HB3 HIS 55 43.292 30.275 24.962 401 HD1 HIS 55 HD1 HIS 55 42.584 32.505 21.803 402 HD2 HIS 55 HD2 HIS 55 45.615 30.435 23.869 403 HE1 HIS 55 HE1 HIS 55 44.743 32.927 20.533 404 H GLY 56 H GLY 56 41.386 27.526 24.662 405 HA2 GLY 56 HA2 GLY 56 41.725 25.404 23.788 406 HA3 GLY 56 HA3 GLY 56 41.949 26.123 22.192 407 H VAL 57 H VAL 57 43.764 26.228 25.293 408 HA VAL 57 HA VAL 57 46.191 25.088 24.043 409 HB VAL 57 HB VAL 57 47.614 26.845 25.051 410 HG11 VAL 57 HG11 VAL 57 45.685 27.966 22.978 411 HG12 VAL 57 HG12 VAL 57 47.331 28.535 23.325 412 HG13 VAL 57 HG13 VAL 57 47.086 26.926 22.647 413 HG21 VAL 57 HG21 VAL 57 46.712 29.038 25.643 414 HG22 VAL 57 HG22 VAL 57 45.051 28.460 25.390 415 HG23 VAL 57 HG23 VAL 57 46.043 27.802 26.709 416 H ASP 58 H ASP 58 47.688 24.249 25.571 417 HA ASP 58 HA ASP 58 46.963 24.305 28.448 418 HB2 ASP 58 HB2 ASP 58 46.226 22.152 27.154 419 HB3 ASP 58 HB3 ASP 58 47.936 21.746 27.153 420 H LEU 59 H LEU 59 48.932 23.590 29.764 421 HA LEU 59 HA LEU 59 51.476 24.562 28.510 422 HB2 LEU 59 HB2 LEU 59 50.324 26.132 30.085 423 HB3 LEU 59 HB3 LEU 59 50.580 24.976 31.384 424 HG LEU 59 HG LEU 59 52.765 26.342 29.747 425 HD11 LEU 59 HD11 LEU 59 51.495 27.894 31.195 426 HD12 LEU 59 HD12 LEU 59 53.141 27.668 31.801 427 HD13 LEU 59 HD13 LEU 59 51.789 26.842 32.596 428 HD21 LEU 59 HD21 LEU 59 52.956 24.566 32.221 429 HD22 LEU 59 HD22 LEU 59 54.266 25.604 31.641 430 HD23 LEU 59 HD23 LEU 59 53.705 24.288 30.625 431 HA PRO 60 HA PRO 60 52.192 20.256 29.934 432 HB2 PRO 60 HB2 PRO 60 54.181 20.175 27.718 433 HB3 PRO 60 HB3 PRO 60 52.828 19.055 28.086 434 HG2 PRO 60 HG2 PRO 60 52.697 20.779 25.994 435 HG3 PRO 60 HG3 PRO 60 51.256 20.409 27.005 436 HD2 PRO 60 HD2 PRO 60 53.136 22.776 27.198 437 HD3 PRO 60 HD3 PRO 60 51.354 22.742 27.164 438 H LEU 61 H LEU 61 53.914 19.199 31.011 439 HA LEU 61 HA LEU 61 55.800 20.909 32.314 440 HB2 LEU 61 HB2 LEU 61 56.507 18.942 33.494 441 HB3 LEU 61 HB3 LEU 61 54.766 18.980 33.337 442 HG LEU 61 HG LEU 61 55.133 17.339 31.318 443 HD11 LEU 61 HD11 LEU 61 57.017 15.855 31.557 444 HD12 LEU 61 HD12 LEU 61 57.668 16.809 32.909 445 HD13 LEU 61 HD13 LEU 61 57.633 17.469 31.266 446 HD21 LEU 61 HD21 LEU 61 54.001 16.744 33.416 447 HD22 LEU 61 HD22 LEU 61 55.574 16.478 34.205 448 HD23 LEU 61 HD23 LEU 61 55.048 15.426 32.870 449 H ARG 62 H ARG 62 56.066 19.013 29.395 450 HA ARG 62 HA ARG 62 58.957 19.103 29.100 451 HB2 ARG 62 HB2 ARG 62 56.649 18.693 27.136 452 HB3 ARG 62 HB3 ARG 62 58.324 18.794 26.609 453 HG2 ARG 62 HG2 ARG 62 58.968 16.925 28.001 454 HG3 ARG 62 HG3 ARG 62 57.340 16.779 28.672 455 HD2 ARG 62 HD2 ARG 62 56.413 16.044 26.619 456 HD3 ARG 62 HD3 ARG 62 57.774 16.682 25.676 457 HE ARG 62 HE ARG 62 58.957 14.827 27.340 458 HH11 ARG 62 HH11 ARG 62 56.527 14.439 24.782 459 HH12 ARG 62 HH12 ARG 62 56.977 12.733 24.670 460 HH21 ARG 62 HH21 ARG 62 59.409 12.819 26.998 461 HH22 ARG 62 HH22 ARG 62 58.439 11.850 25.884 462 H CYS 63 H CYS 63 56.361 21.209 27.947 463 HA CYS 63 HA CYS 63 57.944 23.238 26.679 464 HB2 CYS 63 HB2 CYS 63 55.639 23.205 26.205 465 HB3 CYS 63 HB3 CYS 63 55.189 23.089 27.913 466 HG CYS 63 HG CYS 63 56.599 25.641 26.355 467 H LEU 64 H LEU 64 56.626 23.012 30.022 468 HA LEU 64 HA LEU 64 57.830 25.332 31.043 469 HB2 LEU 64 HB2 LEU 64 56.008 23.858 31.977 470 HB3 LEU 64 HB3 LEU 64 57.228 22.726 32.463 471 HG LEU 64 HG LEU 64 58.267 24.354 33.992 472 HD11 LEU 64 HD11 LEU 64 57.094 26.445 34.579 473 HD12 LEU 64 HD12 LEU 64 55.956 26.189 33.230 474 HD13 LEU 64 HD13 LEU 64 57.678 26.484 32.920 475 HD21 LEU 64 HD21 LEU 64 56.496 22.840 34.803 476 HD22 LEU 64 HD22 LEU 64 55.272 24.068 34.428 477 HD23 LEU 64 HD23 LEU 64 56.499 24.389 35.673 478 H TYR 65 H TYR 65 59.293 22.038 30.807 479 HA TYR 65 HA TYR 65 61.751 22.843 32.138 480 HB2 TYR 65 HB2 TYR 65 61.131 20.518 32.038 481 HB3 TYR 65 HB3 TYR 65 61.115 20.536 30.278 482 HD1 TYR 65 HD1 TYR 65 63.396 21.187 33.208 483 HD2 TYR 65 HD2 TYR 65 63.069 19.935 29.091 484 HE1 TYR 65 HE1 TYR 65 65.843 20.710 33.154 485 HE2 TYR 65 HE2 TYR 65 65.500 19.441 29.056 486 HH TYR 65 HH TYR 65 67.605 20.060 31.895 487 H GLU 66 H GLU 66 60.782 22.720 28.669 488 HA GLU 66 HA GLU 66 63.530 23.429 27.883 489 HB2 GLU 66 HB2 GLU 66 62.933 23.080 25.663 490 HB3 GLU 66 HB3 GLU 66 62.132 21.831 26.611 491 HG2 GLU 66 HG2 GLU 66 60.025 23.218 26.508 492 HG3 GLU 66 HG3 GLU 66 60.853 24.334 25.428 493 H ALA 67 H ALA 67 60.695 25.240 28.555 494 HA ALA 67 HA ALA 67 62.038 27.809 28.038 495 HB1 ALA 67 HB1 ALA 67 60.114 28.513 26.602 496 HB2 ALA 67 HB2 ALA 67 61.108 27.263 25.843 497 HB3 ALA 67 HB3 ALA 67 59.537 26.840 26.567 498 HA PRO 68 HA PRO 68 59.073 27.571 31.690 499 HB2 PRO 68 HB2 PRO 68 60.650 28.711 33.622 500 HB3 PRO 68 HB3 PRO 68 60.804 26.996 33.158 501 HG2 PRO 68 HG2 PRO 68 62.398 29.373 32.086 502 HG3 PRO 68 HG3 PRO 68 63.047 27.847 32.780 503 HD2 PRO 68 HD2 PRO 68 62.810 28.120 30.116 504 HD3 PRO 68 HD3 PRO 68 62.336 26.576 30.886 505 H THR 69 H THR 69 60.729 30.111 30.090 506 HA THR 69 HA THR 69 59.501 32.306 31.599 507 HB THR 69 HB THR 69 61.288 32.682 29.212 508 HG1 THR 69 HG1 THR 69 62.048 31.980 31.859 509 HG21 THR 69 HG21 THR 69 61.306 34.055 31.912 510 HG22 THR 69 HG22 THR 69 60.197 34.573 30.632 511 HG23 THR 69 HG23 THR 69 61.936 34.647 30.358 512 H VAL 70 H VAL 70 57.924 33.614 30.905 513 HA VAL 70 HA VAL 70 55.961 32.446 29.461 514 HB VAL 70 HB VAL 70 55.573 34.147 31.052 515 HG11 VAL 70 HG11 VAL 70 57.363 35.733 30.570 516 HG12 VAL 70 HG12 VAL 70 56.582 36.198 29.042 517 HG13 VAL 70 HG13 VAL 70 55.805 36.541 30.601 518 HG21 VAL 70 HG21 VAL 70 53.772 33.683 29.438 519 HG22 VAL 70 HG22 VAL 70 53.718 35.339 30.055 520 HG23 VAL 70 HG23 VAL 70 54.331 35.026 28.420 521 H ALA 71 H ALA 71 58.214 34.757 27.805 522 HA ALA 71 HA ALA 71 56.583 34.726 25.399 523 HB1 ALA 71 HB1 ALA 71 59.484 35.571 25.766 524 HB2 ALA 71 HB2 ALA 71 58.414 35.981 24.416 525 HB3 ALA 71 HB3 ALA 71 58.063 36.609 26.036 526 H ARG 72 H ARG 72 59.490 32.902 26.408 527 HA ARG 72 HA ARG 72 59.774 31.444 23.871 528 HB2 ARG 72 HB2 ARG 72 60.860 30.817 26.658 529 HB3 ARG 72 HB3 ARG 72 61.313 29.995 25.155 530 HG2 ARG 72 HG2 ARG 72 62.197 32.158 24.259 531 HG3 ARG 72 HG3 ARG 72 61.762 32.918 25.794 532 HD2 ARG 72 HD2 ARG 72 64.093 32.459 25.894 533 HD3 ARG 72 HD3 ARG 72 63.274 31.350 26.990 534 HE ARG 72 HE ARG 72 64.003 30.517 24.203 535 HH11 ARG 72 HH11 ARG 72 64.281 29.763 27.654 536 HH12 ARG 72 HH12 ARG 72 65.315 28.397 27.324 537 HH21 ARG 72 HH21 ARG 72 65.390 28.843 23.922 538 HH22 ARG 72 HH22 ARG 72 65.757 27.800 25.290 539 H LEU 73 H LEU 73 58.269 30.832 27.014 540 HA LEU 73 HA LEU 73 57.186 28.266 26.604 541 HB2 LEU 73 HB2 LEU 73 57.250 29.631 28.702 542 HB3 LEU 73 HB3 LEU 73 56.006 30.656 28.068 543 HG LEU 73 HG LEU 73 55.024 27.961 27.835 544 HD11 LEU 73 HD11 LEU 73 56.079 28.594 30.634 545 HD12 LEU 73 HD12 LEU 73 56.636 27.275 29.583 546 HD13 LEU 73 HD13 LEU 73 54.999 27.248 30.201 547 HD21 LEU 73 HD21 LEU 73 53.681 29.977 28.064 548 HD22 LEU 73 HD22 LEU 73 54.291 30.220 29.715 549 HD23 LEU 73 HD23 LEU 73 53.279 28.804 29.331 550 H ALA 74 H ALA 74 55.577 31.470 26.013 551 HA ALA 74 HA ALA 74 53.313 30.535 24.670 552 HB1 ALA 74 HB1 ALA 74 53.632 32.849 25.438 553 HB2 ALA 74 HB2 ALA 74 54.883 33.104 24.213 554 HB3 ALA 74 HB3 ALA 74 53.199 32.807 23.719 555 H GLU 75 H GLU 75 56.575 31.288 23.242 556 HA GLU 75 HA GLU 75 55.744 30.746 20.551 557 HB2 GLU 75 HB2 GLU 75 58.006 31.791 21.344 558 HB3 GLU 75 HB3 GLU 75 58.556 30.109 21.479 559 HG2 GLU 75 HG2 GLU 75 57.506 29.901 19.040 560 HG3 GLU 75 HG3 GLU 75 57.643 31.650 19.025 561 H THR 76 H THR 76 57.050 28.497 23.050 562 HA THR 76 HA THR 76 56.932 26.198 21.329 563 HB THR 76 HB THR 76 57.085 24.797 23.304 564 HG1 THR 76 HG1 THR 76 56.504 27.186 24.588 565 HG21 THR 76 HG21 THR 76 59.032 27.131 23.264 566 HG22 THR 76 HG22 THR 76 59.133 25.645 22.297 567 HG23 THR 76 HG23 THR 76 59.292 25.566 24.056 568 H ILE 77 H ILE 77 54.453 27.495 23.608 569 HA ILE 77 HA ILE 77 52.600 25.334 23.161 570 HB ILE 77 HB ILE 77 52.112 28.203 24.057 571 HG12 ILE 77 HG12 ILE 77 53.472 27.201 25.726 572 HG13 ILE 77 HG13 ILE 77 51.843 27.102 26.337 573 HG21 ILE 77 HG21 ILE 77 49.984 27.272 23.264 574 HG22 ILE 77 HG22 ILE 77 50.231 25.812 24.244 575 HG23 ILE 77 HG23 ILE 77 49.980 27.372 25.023 576 HD11 ILE 77 HD11 ILE 77 52.897 25.039 26.835 577 HD12 ILE 77 HD12 ILE 77 51.818 24.665 25.477 578 HD13 ILE 77 HD13 ILE 77 53.560 24.861 25.204 579 H VAL 78 H VAL 78 53.083 28.399 21.406 580 HA VAL 78 HA VAL 78 50.910 27.941 19.536 581 HB VAL 78 HB VAL 78 53.362 29.734 19.434 582 HG11 VAL 78 HG11 VAL 78 52.701 29.307 17.103 583 HG12 VAL 78 HG12 VAL 78 51.000 29.643 17.505 584 HG13 VAL 78 HG13 VAL 78 52.218 30.930 17.579 585 HG21 VAL 78 HG21 VAL 78 51.724 31.523 19.853 586 HG22 VAL 78 HG22 VAL 78 50.395 30.342 19.853 587 HG23 VAL 78 HG23 VAL 78 51.612 30.315 21.136 588 H ARG 79 H ARG 79 54.480 27.342 19.304 589 HA ARG 79 HA ARG 79 54.192 26.380 16.606 590 HB2 ARG 79 HB2 ARG 79 56.457 26.271 16.439 591 HB3 ARG 79 HB3 ARG 79 56.201 27.554 17.604 592 HG2 ARG 79 HG2 ARG 79 56.618 25.673 19.388 593 HG3 ARG 79 HG3 ARG 79 57.283 24.752 18.038 594 HD2 ARG 79 HD2 ARG 79 58.827 26.675 17.540 595 HD3 ARG 79 HD3 ARG 79 58.207 27.509 18.973 596 HE ARG 79 HE ARG 79 59.226 24.884 19.679 597 HH11 ARG 79 HH11 ARG 79 60.450 28.135 18.909 598 HH12 ARG 79 HH12 ARG 79 62.019 27.722 19.567 599 HH21 ARG 79 HH21 ARG 79 61.134 24.591 20.604 600 HH22 ARG 79 HH22 ARG 79 62.392 25.823 20.527 601 H LEU 80 H LEU 80 54.241 24.627 19.665 602 HA LEU 80 HA LEU 80 54.378 22.034 18.253 603 HB2 LEU 80 HB2 LEU 80 54.023 22.622 21.208 604 HB3 LEU 80 HB3 LEU 80 54.408 21.066 20.472 605 HG LEU 80 HG LEU 80 56.217 23.526 20.481 606 HD11 LEU 80 HD11 LEU 80 56.012 22.374 22.644 607 HD12 LEU 80 HD12 LEU 80 57.630 22.187 21.936 608 HD13 LEU 80 HD13 LEU 80 56.470 20.837 21.857 609 HD21 LEU 80 HD21 LEU 80 56.531 22.231 18.394 610 HD22 LEU 80 HD22 LEU 80 56.792 20.762 19.368 611 HD23 LEU 80 HD23 LEU 80 57.905 22.151 19.467 612 H ALA 81 H ALA 81 51.868 24.033 19.612 613 HA ALA 81 HA ALA 81 49.667 24.002 19.567 614 HB1 ALA 81 HB1 ALA 81 50.072 22.349 17.066 615 HB2 ALA 81 HB2 ALA 81 48.640 23.311 17.483 616 HB3 ALA 81 HB3 ALA 81 50.188 24.120 17.200 617 H ALA 82 H ALA 82 47.869 23.221 20.407 618 HA ALA 82 HA ALA 82 47.802 20.692 21.690 619 HB1 ALA 82 HB1 ALA 82 45.482 21.364 22.273 620 HB2 ALA 82 HB2 ALA 82 46.617 22.708 22.482 621 HB3 ALA 82 HB3 ALA 82 45.549 22.654 21.057 622 HA PRO 83 HA PRO 83 46.203 17.976 18.554 623 HB2 PRO 83 HB2 PRO 83 44.909 16.051 19.990 624 HB3 PRO 83 HB3 PRO 83 46.674 16.308 20.096 625 HG2 PRO 83 HG2 PRO 83 44.537 17.423 21.943 626 HG3 PRO 83 HG3 PRO 83 46.007 16.499 22.398 627 HD2 PRO 83 HD2 PRO 83 46.014 19.192 22.456 628 HD3 PRO 83 HD3 PRO 83 47.424 18.292 21.836 629 H ALA 84 H ALA 84 44.055 19.914 20.361 630 HA ALA 84 HA ALA 84 42.212 19.916 18.102 631 HB1 ALA 84 HB1 ALA 84 40.193 19.727 19.467 632 HB2 ALA 84 HB2 ALA 84 41.173 18.252 19.606 633 HB3 ALA 84 HB3 ALA 84 41.166 19.446 20.923 634 HA PRO 85 HA PRO 85 42.603 24.301 19.415 635 HB2 PRO 85 HB2 PRO 85 40.655 24.569 17.128 636 HB3 PRO 85 HB3 PRO 85 42.098 25.559 17.490 637 HG2 PRO 85 HG2 PRO 85 42.164 23.707 15.511 638 HG3 PRO 85 HG3 PRO 85 43.556 23.865 16.630 639 HD2 PRO 85 HD2 PRO 85 41.286 21.854 16.735 640 HD3 PRO 85 HD3 PRO 85 43.051 21.580 16.896 641 H SER 86 H SER 86 41.037 25.792 20.386 642 HA SER 86 HA SER 86 38.200 24.908 20.516 643 HB2 SER 86 HB2 SER 86 39.566 25.911 23.016 644 HB3 SER 86 HB3 SER 86 37.933 25.287 22.836 645 HG SER 86 HG SER 86 38.923 23.210 22.304 646 H GLY 87 H GLY 87 36.796 26.550 20.257 647 HA2 GLY 87 HA2 GLY 87 37.468 29.339 20.865 648 HA3 GLY 87 HA3 GLY 87 37.443 28.963 19.137 649 H ASP 88 H ASP 88 35.107 26.945 20.159 650 HA ASP 88 HA ASP 88 32.927 28.985 20.205 651 HB2 ASP 88 HB2 ASP 88 32.799 27.563 18.244 652 HB3 ASP 88 HB3 ASP 88 33.000 26.114 19.236 653 H GLN 89 H GLN 89 31.733 29.094 22.082 654 HA GLN 89 HA GLN 89 31.485 26.715 23.804 655 HB2 GLN 89 HB2 GLN 89 32.174 27.952 25.861 656 HB3 GLN 89 HB3 GLN 89 33.454 27.526 24.749 657 HG2 GLN 89 HG2 GLN 89 33.901 29.701 25.621 658 HG3 GLN 89 HG3 GLN 89 33.550 29.843 23.908 659 HE21 GLN 89 HE21 GLN 89 32.911 32.020 23.947 660 HE22 GLN 89 HE22 GLN 89 31.446 32.546 24.769 661 H ASP 90 H ASP 90 30.037 26.875 25.527 662 HA ASP 90 HA ASP 90 28.017 29.061 25.480 663 HB2 ASP 90 HB2 ASP 90 27.065 27.141 24.296 664 HB3 ASP 90 HB3 ASP 90 27.460 26.084 25.653 665 H ASP 91 H ASP 91 30.184 29.213 27.022 666 HA ASP 91 HA ASP 91 29.334 28.567 29.834 667 HB2 ASP 91 HB2 ASP 91 31.551 27.784 29.427 668 HB3 ASP 91 HB3 ASP 91 31.990 29.244 28.534 669 H ALA 92 H ALA 92 30.281 31.162 27.613 670 HA ALA 92 HA ALA 92 30.605 33.116 29.620 671 HB1 ALA 92 HB1 ALA 92 30.452 33.468 26.617 672 HB2 ALA 92 HB2 ALA 92 31.319 34.502 27.778 673 HB3 ALA 92 HB3 ALA 92 31.868 32.850 27.478 674 H SER 93 H SER 93 27.846 32.190 29.614 675 HA SER 93 HA SER 93 25.993 34.236 28.812 676 HB2 SER 93 HB2 SER 93 25.829 32.324 31.175 677 HB3 SER 93 HB3 SER 93 24.491 33.094 30.307 678 HG SER 93 HG SER 93 24.995 30.830 29.752 679 H GLU 94 H GLU 94 24.943 35.856 30.211 680 HA GLU 94 HA GLU 94 26.795 36.956 32.258 681 HB2 GLU 94 HB2 GLU 94 25.745 39.083 31.900 682 HB3 GLU 94 HB3 GLU 94 26.379 38.403 30.408 683 HG2 GLU 94 HG2 GLU 94 24.076 37.718 29.746 684 HG3 GLU 94 HG3 GLU 94 23.442 38.458 31.221 685 H TYR 95 H TYR 95 26.313 37.411 34.328 686 HA TYR 95 HA TYR 95 23.535 37.141 35.323 687 HB2 TYR 95 HB2 TYR 95 24.671 34.923 35.534 688 HB3 TYR 95 HB3 TYR 95 25.841 35.661 36.614 689 HD1 TYR 95 HD1 TYR 95 22.167 35.073 36.123 690 HD2 TYR 95 HD2 TYR 95 25.319 35.824 38.971 691 HE1 TYR 95 HE1 TYR 95 20.592 34.624 37.992 692 HE2 TYR 95 HE2 TYR 95 23.738 35.377 40.841 693 HH TYR 95 HH TYR 95 21.560 34.857 41.430 694 H GLU 96 H GLU 96 23.485 39.374 35.560 695 HA GLU 96 HA GLU 96 24.477 40.253 38.192 696 HB2 GLU 96 HB2 GLU 96 26.182 41.034 36.533 697 HB3 GLU 96 HB3 GLU 96 24.910 41.865 35.653 698 HG2 GLU 96 HG2 GLU 96 25.925 43.548 36.873 699 HG3 GLU 96 HG3 GLU 96 24.481 43.191 37.816 700 H GLU 97 H GLU 97 22.788 40.981 39.266 701 HA GLU 97 HA GLU 97 20.463 42.260 37.862 702 HB2 GLU 97 HB2 GLU 97 19.961 40.123 38.972 703 HB3 GLU 97 HB3 GLU 97 20.691 40.708 40.459 704 HG2 GLU 97 HG2 GLU 97 18.385 40.817 40.817 705 HG3 GLU 97 HG3 GLU 97 18.898 42.479 40.582 706 H GLY 98 H GLY 98 22.505 42.414 40.812 707 HA2 GLY 98 HA2 GLY 98 21.339 44.875 41.765 708 HA3 GLY 98 HA3 GLY 98 22.737 44.026 42.426 709 H VAL 99 H VAL 99 24.322 44.168 39.987 710 HA VAL 99 HA VAL 99 25.863 45.347 38.911 711 HB VAL 99 HB VAL 99 23.832 47.577 38.751 712 HG11 VAL 99 HG11 VAL 99 26.094 48.267 37.995 713 HG12 VAL 99 HG12 VAL 99 26.181 46.847 36.944 714 HG13 VAL 99 HG13 VAL 99 24.986 48.125 36.630 715 HG21 VAL 99 HG21 VAL 99 23.192 46.564 36.599 716 HG22 VAL 99 HG22 VAL 99 24.313 45.242 36.844 717 HG23 VAL 99 HG23 VAL 99 22.890 45.417 37.900 718 H ILE 100 H ILE 100 24.637 47.544 41.492 719 HA ILE 100 HA ILE 100 27.413 48.194 42.176 720 HB ILE 100 HB ILE 100 26.762 49.771 40.360 721 HG12 ILE 100 HG12 ILE 100 27.256 51.259 42.963 722 HG13 ILE 100 HG13 ILE 100 28.477 50.246 42.187 723 HG21 ILE 100 HG21 ILE 100 24.868 51.031 42.387 724 HG22 ILE 100 HG22 ILE 100 25.175 51.561 40.725 725 HG23 ILE 100 HG23 ILE 100 24.347 50.030 41.019 726 HD11 ILE 100 HD11 ILE 100 28.800 52.580 41.564 727 HD12 ILE 100 HD12 ILE 100 28.368 51.619 40.140 728 HD13 ILE 100 HD13 ILE 100 27.160 52.673 40.905 729 H ARG 101 H ARG 101 27.740 49.019 44.219 730 HA ARG 101 HA ARG 101 25.461 48.939 46.163 731 HB2 ARG 101 HB2 ARG 101 28.052 47.354 46.304 732 HB3 ARG 101 HB3 ARG 101 26.822 47.466 47.568 733 HG2 ARG 101 HG2 ARG 101 25.139 46.495 45.924 734 HG3 ARG 101 HG3 ARG 101 26.458 46.262 44.779 735 HD2 ARG 101 HD2 ARG 101 25.969 44.187 45.930 736 HD3 ARG 101 HD3 ARG 101 27.601 44.756 46.316 737 HE ARG 101 HE ARG 101 25.572 45.615 48.228 738 HH11 ARG 101 HH11 ARG 101 27.484 42.774 47.448 739 HH12 ARG 101 HH12 ARG 101 27.647 42.334 49.144 740 HH21 ARG 101 HH21 ARG 101 25.906 45.050 50.319 741 HH22 ARG 101 HH22 ARG 101 26.505 43.427 50.666 Start of MODEL 11 1 H GLY 1 H1 GLY 1 69.974 47.543 36.530 2 HA2 GLY 1 HA2 GLY 1 70.915 45.369 36.199 3 HA3 GLY 1 HA3 GLY 1 69.312 44.806 35.673 4 H ALA 2 H ALA 2 69.297 44.537 33.497 5 HA ALA 2 HA ALA 2 71.173 45.710 31.741 6 HB1 ALA 2 HB1 ALA 2 68.466 44.442 31.146 7 HB2 ALA 2 HB2 ALA 2 69.794 44.669 29.989 8 HB3 ALA 2 HB3 ALA 2 70.003 43.575 31.370 9 H ALA 3 H ALA 3 68.205 47.173 32.875 10 HA ALA 3 HA ALA 3 67.042 49.018 32.335 11 HB1 ALA 3 HB1 ALA 3 69.773 50.028 31.521 12 HB2 ALA 3 HB2 ALA 3 68.382 51.012 32.038 13 HB3 ALA 3 HB3 ALA 3 69.159 49.902 33.189 14 H ALA 4 H ALA 4 67.016 47.131 30.300 15 HA ALA 4 HA ALA 4 67.808 48.135 27.780 16 HB1 ALA 4 HB1 ALA 4 66.021 45.768 28.462 17 HB2 ALA 4 HB2 ALA 4 66.890 46.025 26.929 18 HB3 ALA 4 HB3 ALA 4 67.799 45.768 28.425 19 H GLY 5 H GLY 5 64.568 48.414 29.268 20 HA2 GLY 5 HA2 GLY 5 62.653 49.446 28.489 21 HA3 GLY 5 HA3 GLY 5 63.689 50.358 27.391 22 H VAL 6 H VAL 6 63.063 50.142 25.279 23 HA VAL 6 HA VAL 6 61.595 47.757 24.363 24 HB VAL 6 HB VAL 6 61.068 50.157 23.762 25 HG11 VAL 6 HG11 VAL 6 63.383 50.876 23.134 26 HG12 VAL 6 HG12 VAL 6 63.299 49.815 21.709 27 HG13 VAL 6 HG13 VAL 6 62.181 51.177 21.872 28 HG21 VAL 6 HG21 VAL 6 61.355 48.275 21.398 29 HG22 VAL 6 HG22 VAL 6 60.072 48.186 22.626 30 HG23 VAL 6 HG23 VAL 6 60.214 49.615 21.595 31 H SER 7 H SER 7 64.910 48.565 24.532 32 HA SER 7 HA SER 7 65.782 47.432 22.027 33 HB2 SER 7 HB2 SER 7 67.391 48.189 24.487 34 HB3 SER 7 HB3 SER 7 68.027 47.890 22.863 35 HG SER 7 HG SER 7 67.229 49.699 22.139 36 H ALA 8 H ALA 8 67.175 45.647 21.692 37 HA ALA 8 HA ALA 8 67.487 43.455 21.599 38 HB1 ALA 8 HB1 ALA 8 69.142 44.094 23.295 39 HB2 ALA 8 HB2 ALA 8 67.994 43.687 24.587 40 HB3 ALA 8 HB3 ALA 8 68.602 42.421 23.497 41 H ALA 9 H ALA 9 64.599 44.348 22.589 42 HA ALA 9 HA ALA 9 63.535 41.963 23.844 43 HB1 ALA 9 HB1 ALA 9 62.590 44.225 24.185 44 HB2 ALA 9 HB2 ALA 9 62.142 44.290 22.471 45 HB3 ALA 9 HB3 ALA 9 61.385 43.095 23.543 46 H GLY 10 H GLY 10 61.723 40.739 22.885 47 HA2 GLY 10 HA2 GLY 10 62.271 39.919 20.043 48 HA3 GLY 10 HA3 GLY 10 61.817 38.841 21.356 49 H ILE 11 H ILE 11 59.969 38.033 20.547 50 HA ILE 11 HA ILE 11 57.894 39.483 19.237 51 HB ILE 11 HB ILE 11 56.530 37.510 19.540 52 HG12 ILE 11 HG12 ILE 11 58.727 36.270 21.261 53 HG13 ILE 11 HG13 ILE 11 57.249 36.962 21.924 54 HG21 ILE 11 HG21 ILE 11 58.369 37.614 17.827 55 HG22 ILE 11 HG22 ILE 11 59.376 36.629 18.906 56 HG23 ILE 11 HG23 ILE 11 57.860 35.979 18.263 57 HD11 ILE 11 HD11 ILE 11 56.959 34.588 21.758 58 HD12 ILE 11 HD12 ILE 11 55.884 35.379 20.588 59 HD13 ILE 11 HD13 ILE 11 57.383 34.588 20.037 60 H GLU 12 H GLU 12 55.798 39.963 19.891 61 HA GLU 12 HA GLU 12 55.225 40.394 22.807 62 HB2 GLU 12 HB2 GLU 12 54.107 41.661 20.288 63 HB3 GLU 12 HB3 GLU 12 53.414 41.890 21.889 64 HG2 GLU 12 HG2 GLU 12 56.305 42.619 21.241 65 HG3 GLU 12 HG3 GLU 12 54.957 43.720 20.995 66 HA PRO 13 HA PRO 13 52.556 36.805 21.748 67 HB2 PRO 13 HB2 PRO 13 52.553 36.563 24.743 68 HB3 PRO 13 HB3 PRO 13 52.768 35.288 23.507 69 HG2 PRO 13 HG2 PRO 13 54.899 36.220 24.892 70 HG3 PRO 13 HG3 PRO 13 55.034 35.947 23.121 71 HD2 PRO 13 HD2 PRO 13 54.472 38.552 24.572 72 HD3 PRO 13 HD3 PRO 13 55.677 38.211 23.303 73 H ASP 14 H ASP 14 50.363 36.157 22.414 74 HA ASP 14 HA ASP 14 48.593 38.259 23.578 75 HB2 ASP 14 HB2 ASP 14 48.097 35.458 22.488 76 HB3 ASP 14 HB3 ASP 14 46.859 36.449 23.257 77 H LEU 15 H LEU 15 50.088 35.121 24.359 78 HA LEU 15 HA LEU 15 48.793 34.493 26.738 79 HB2 LEU 15 HB2 LEU 15 51.683 34.128 25.842 80 HB3 LEU 15 HB3 LEU 15 51.120 33.463 27.362 81 HG LEU 15 HG LEU 15 49.649 32.856 24.756 82 HD11 LEU 15 HD11 LEU 15 51.937 32.147 24.424 83 HD12 LEU 15 HD12 LEU 15 50.900 30.741 24.662 84 HD13 LEU 15 HD13 LEU 15 51.945 31.294 25.996 85 HD21 LEU 15 HD21 LEU 15 48.447 32.323 26.859 86 HD22 LEU 15 HD22 LEU 15 49.837 31.359 27.407 87 HD23 LEU 15 HD23 LEU 15 48.908 30.865 25.976 88 H THR 16 H THR 16 51.597 36.731 26.476 89 HA THR 16 HA THR 16 51.716 37.280 29.292 90 HB THR 16 HB THR 16 53.093 39.256 28.538 91 HG1 THR 16 HG1 THR 16 53.634 39.345 26.417 92 HG21 THR 16 HG21 THR 16 54.046 37.004 29.024 93 HG22 THR 16 HG22 THR 16 54.965 37.899 27.801 94 HG23 THR 16 HG23 THR 16 53.883 36.578 27.307 95 H ALA 17 H ALA 17 49.694 38.691 26.739 96 HA ALA 17 HA ALA 17 48.881 40.967 28.389 97 HB1 ALA 17 HB1 ALA 17 47.619 39.794 25.874 98 HB2 ALA 17 HB2 ALA 17 47.264 41.370 26.614 99 HB3 ALA 17 HB3 ALA 17 48.863 41.066 25.920 100 H ILE 18 H ILE 18 47.452 37.794 27.499 101 HA ILE 18 HA ILE 18 45.141 37.916 29.201 102 HB ILE 18 HB ILE 18 46.801 35.545 28.253 103 HG12 ILE 18 HG12 ILE 18 44.145 36.638 27.208 104 HG13 ILE 18 HG13 ILE 18 45.702 37.008 26.482 105 HG21 ILE 18 HG21 ILE 18 44.810 34.150 28.801 106 HG22 ILE 18 HG22 ILE 18 45.464 34.899 30.247 107 HG23 ILE 18 HG23 ILE 18 44.007 35.574 29.494 108 HD11 ILE 18 HD11 ILE 18 46.070 34.564 26.062 109 HD12 ILE 18 HD12 ILE 18 44.392 34.276 26.595 110 HD13 ILE 18 HD13 ILE 18 44.710 35.288 25.181 111 H TRP 19 H TRP 19 48.494 36.760 29.909 112 HA TRP 19 HA TRP 19 47.908 36.153 32.654 113 HB2 TRP 19 HB2 TRP 19 50.479 36.620 31.140 114 HB3 TRP 19 HB3 TRP 19 50.444 36.319 32.866 115 HD1 TRP 19 HD1 TRP 19 47.927 34.286 30.913 116 HE1 TRP 19 HE1 TRP 19 48.636 31.820 30.923 117 HE3 TRP 19 HE3 TRP 19 52.660 34.809 32.777 118 HZ2 TRP 19 HZ2 TRP 19 50.969 30.285 31.579 119 HZ3 TRP 19 HZ3 TRP 19 54.099 32.816 33.106 120 HH2 TRP 19 HH2 TRP 19 53.270 30.545 32.494 121 H GLN 20 H GLN 20 49.310 39.237 31.239 122 HA GLN 20 HA GLN 20 49.568 40.355 33.857 123 HB2 GLN 20 HB2 GLN 20 50.215 42.327 32.885 124 HB3 GLN 20 HB3 GLN 20 50.646 41.127 31.678 125 HG2 GLN 20 HG2 GLN 20 48.267 41.770 30.671 126 HG3 GLN 20 HG3 GLN 20 48.483 43.219 31.635 127 HE21 GLN 20 HE21 GLN 20 48.249 44.076 29.351 128 HE22 GLN 20 HE22 GLN 20 49.683 44.110 28.309 129 H ALA 21 H ALA 21 46.761 40.306 31.632 130 HA ALA 21 HA ALA 21 45.005 41.898 33.241 131 HB1 ALA 21 HB1 ALA 21 43.261 40.826 31.895 132 HB2 ALA 21 HB2 ALA 21 44.625 41.325 30.880 133 HB3 ALA 21 HB3 ALA 21 44.419 39.615 31.311 134 H LEU 22 H LEU 22 45.525 38.328 33.174 135 HA LEU 22 HA LEU 22 43.565 37.759 35.153 136 HB2 LEU 22 HB2 LEU 22 44.380 36.355 33.272 137 HB3 LEU 22 HB3 LEU 22 45.874 36.045 34.136 138 HG LEU 22 HG LEU 22 43.147 35.322 35.299 139 HD11 LEU 22 HD11 LEU 22 44.834 33.637 33.382 140 HD12 LEU 22 HD12 LEU 22 43.263 34.366 33.022 141 HD13 LEU 22 HD13 LEU 22 43.372 33.109 34.258 142 HD21 LEU 22 HD21 LEU 22 45.943 34.136 35.635 143 HD22 LEU 22 HD22 LEU 22 44.462 33.465 36.345 144 HD23 LEU 22 HD23 LEU 22 45.032 35.045 36.858 145 H PHE 23 H PHE 23 47.034 38.340 35.383 146 HA PHE 23 HA PHE 23 47.181 37.614 38.178 147 HB2 PHE 23 HB2 PHE 23 49.152 39.057 36.392 148 HB3 PHE 23 HB3 PHE 23 49.497 38.490 38.002 149 HD1 PHE 23 HD1 PHE 23 47.537 35.871 36.517 150 HD2 PHE 23 HD2 PHE 23 51.454 37.672 36.406 151 HE1 PHE 23 HE1 PHE 23 48.429 33.865 35.409 152 HE2 PHE 23 HE2 PHE 23 52.351 35.611 35.359 153 HZ PHE 23 HZ PHE 23 50.838 33.703 34.860 154 H ALA 24 H ALA 24 45.991 40.380 36.658 155 HA ALA 24 HA ALA 24 45.543 42.482 37.172 156 HB1 ALA 24 HB1 ALA 24 45.905 41.857 40.099 157 HB2 ALA 24 HB2 ALA 24 44.941 43.144 39.366 158 HB3 ALA 24 HB3 ALA 24 44.450 41.455 39.147 159 H LEU 25 H LEU 25 48.242 41.867 36.475 160 HA LEU 25 HA LEU 25 49.936 43.900 37.800 161 HB2 LEU 25 HB2 LEU 25 50.283 41.938 35.500 162 HB3 LEU 25 HB3 LEU 25 51.514 43.128 35.875 163 HG LEU 25 HG LEU 25 50.534 41.057 37.889 164 HD11 LEU 25 HD11 LEU 25 52.653 39.900 37.387 165 HD12 LEU 25 HD12 LEU 25 53.015 41.093 36.121 166 HD13 LEU 25 HD13 LEU 25 51.619 39.997 35.950 167 HD21 LEU 25 HD21 LEU 25 51.579 43.043 38.947 168 HD22 LEU 25 HD22 LEU 25 52.969 42.908 37.848 169 HD23 LEU 25 HD23 LEU 25 52.654 41.650 39.054 170 HA PRO 26 HA PRO 26 49.158 47.046 34.619 171 HB2 PRO 26 HB2 PRO 26 51.526 48.374 34.433 172 HB3 PRO 26 HB3 PRO 26 50.454 48.497 35.860 173 HG2 PRO 26 HG2 PRO 26 52.907 46.742 35.522 174 HG3 PRO 26 HG3 PRO 26 52.472 47.797 36.899 175 HD2 PRO 26 HD2 PRO 26 51.962 45.106 36.896 176 HD3 PRO 26 HD3 PRO 26 50.870 46.273 37.689 177 H ALA 27 H ALA 27 52.146 45.095 34.297 178 HA ALA 27 HA ALA 27 51.578 44.438 31.509 179 HB1 ALA 27 HB1 ALA 27 53.787 45.302 30.742 180 HB2 ALA 27 HB2 ALA 27 52.712 46.606 31.272 181 HB3 ALA 27 HB3 ALA 27 54.034 46.057 32.327 182 H VAL 28 H VAL 28 52.768 42.625 30.782 183 HA VAL 28 HA VAL 28 54.868 41.417 32.532 184 HB VAL 28 HB VAL 28 52.525 39.982 31.236 185 HG11 VAL 28 HG11 VAL 28 54.444 38.595 30.758 186 HG12 VAL 28 HG12 VAL 28 55.029 38.740 32.432 187 HG13 VAL 28 HG13 VAL 28 53.525 37.861 32.067 188 HG21 VAL 28 HG21 VAL 28 52.109 39.129 33.491 189 HG22 VAL 28 HG22 VAL 28 53.581 39.927 34.095 190 HG23 VAL 28 HG23 VAL 28 52.195 40.894 33.566 191 H GLY 29 H GLY 29 56.593 40.627 31.499 192 HA2 GLY 29 HA2 GLY 29 56.778 39.649 28.847 193 HA3 GLY 29 HA3 GLY 29 57.321 41.324 28.841 194 H ARG 30 H ARG 30 59.344 40.340 28.148 195 HA ARG 30 HA ARG 30 61.482 39.636 28.338 196 HB2 ARG 30 HB2 ARG 30 61.139 40.887 31.086 197 HB3 ARG 30 HB3 ARG 30 62.700 40.440 30.425 198 HG2 ARG 30 HG2 ARG 30 60.829 42.450 29.123 199 HG3 ARG 30 HG3 ARG 30 62.190 42.822 30.182 200 HD2 ARG 30 HD2 ARG 30 63.714 41.637 28.548 201 HD3 ARG 30 HD3 ARG 30 62.328 41.499 27.442 202 HE ARG 30 HE ARG 30 62.571 44.204 28.275 203 HH11 ARG 30 HH11 ARG 30 64.847 42.133 26.576 204 HH12 ARG 30 HH12 ARG 30 65.417 43.504 25.650 205 HH21 ARG 30 HH21 ARG 30 63.355 45.804 26.950 206 HH22 ARG 30 HH22 ARG 30 64.654 45.405 25.847 207 H HIS 31 H HIS 31 63.143 38.641 30.165 208 HA HIS 31 HA HIS 31 62.389 35.835 30.005 209 HB2 HIS 31 HB2 HIS 31 64.550 36.907 29.236 210 HB3 HIS 31 HB3 HIS 31 65.022 37.028 30.931 211 HD1 HIS 31 HD1 HIS 31 65.429 34.550 32.153 212 HD2 HIS 31 HD2 HIS 31 64.791 34.634 27.998 213 HE1 HIS 31 HE1 HIS 31 66.240 32.308 31.258 214 H GLN 32 H GLN 32 60.664 36.590 31.692 215 HA GLN 32 HA GLN 32 61.591 36.087 34.495 216 HB2 GLN 32 HB2 GLN 32 59.380 37.827 33.352 217 HB3 GLN 32 HB3 GLN 32 59.532 37.426 35.077 218 HG2 GLN 32 HG2 GLN 32 61.750 38.524 35.143 219 HG3 GLN 32 HG3 GLN 32 61.625 38.896 33.422 220 HE21 GLN 32 HE21 GLN 32 61.842 41.176 33.945 221 HE22 GLN 32 HE22 GLN 32 60.430 42.063 34.501 222 H ASP 33 H ASP 33 60.433 34.668 35.775 223 HA ASP 33 HA ASP 33 59.126 32.601 34.166 224 HB2 ASP 33 HB2 ASP 33 59.908 31.061 35.807 225 HB3 ASP 33 HB3 ASP 33 61.228 32.137 35.369 226 H PHE 34 H PHE 34 57.229 31.595 34.526 227 HA PHE 34 HA PHE 34 55.090 32.718 35.909 228 HB2 PHE 34 HB2 PHE 34 54.707 31.041 34.273 229 HB3 PHE 34 HB3 PHE 34 55.714 29.856 35.096 230 HD1 PHE 34 HD1 PHE 34 52.462 31.710 35.347 231 HD2 PHE 34 HD2 PHE 34 54.854 28.425 36.807 232 HE1 PHE 34 HE1 PHE 34 50.568 30.947 36.763 233 HE2 PHE 34 HE2 PHE 34 52.966 27.690 38.238 234 HZ PHE 34 HZ PHE 34 50.859 28.982 38.271 235 H PHE 35 H PHE 35 57.369 30.291 37.315 236 HA PHE 35 HA PHE 35 55.749 29.798 39.616 237 HB2 PHE 35 HB2 PHE 35 58.716 29.402 39.159 238 HB3 PHE 35 HB3 PHE 35 57.818 28.750 40.526 239 HD1 PHE 35 HD1 PHE 35 55.666 27.297 39.910 240 HD2 PHE 35 HD2 PHE 35 58.977 28.038 37.247 241 HE1 PHE 35 HE1 PHE 35 55.016 25.327 38.549 242 HE2 PHE 35 HE2 PHE 35 58.339 26.057 35.907 243 HZ PHE 35 HZ PHE 35 56.342 24.705 36.543 244 H ALA 36 H ALA 36 57.636 32.532 38.884 245 HA ALA 36 HA ALA 36 57.304 33.627 41.641 246 HB1 ALA 36 HB1 ALA 36 58.737 34.624 39.156 247 HB2 ALA 36 HB2 ALA 36 58.687 35.454 40.723 248 HB3 ALA 36 HB3 ALA 36 59.505 33.884 40.586 249 H LEU 37 H LEU 37 56.546 34.373 38.198 250 HA LEU 37 HA LEU 37 55.161 36.774 38.834 251 HB2 LEU 37 HB2 LEU 37 55.782 35.155 36.379 252 HB3 LEU 37 HB3 LEU 37 54.417 36.208 36.222 253 HG LEU 37 HG LEU 37 55.755 38.166 36.847 254 HD11 LEU 37 HD11 LEU 37 57.478 37.152 38.292 255 HD12 LEU 37 HD12 LEU 37 58.213 38.028 36.952 256 HD13 LEU 37 HD13 LEU 37 58.129 36.249 36.904 257 HD21 LEU 37 HD21 LEU 37 57.093 38.250 34.793 258 HD22 LEU 37 HD22 LEU 37 55.540 37.464 34.486 259 HD23 LEU 37 HD23 LEU 37 57.015 36.480 34.639 260 H GLY 38 H GLY 38 53.954 33.589 38.171 261 HA2 GLY 38 HA2 GLY 38 51.114 34.422 38.712 262 HA3 GLY 38 HA3 GLY 38 51.636 32.873 38.037 263 H GLY 39 H GLY 39 53.848 32.505 39.854 264 HA2 GLY 39 HA2 GLY 39 54.574 32.252 41.998 265 HA3 GLY 39 HA3 GLY 39 53.127 33.055 42.572 266 H ASP 40 H ASP 40 51.141 31.259 41.607 267 HA ASP 40 HA ASP 40 51.486 29.054 43.612 268 HB2 ASP 40 HB2 ASP 40 50.015 31.196 44.018 269 HB3 ASP 40 HB3 ASP 40 48.864 30.411 42.962 270 H SER 41 H SER 41 50.608 27.051 43.220 271 HA SER 41 HA SER 41 50.003 26.235 40.505 272 HB2 SER 41 HB2 SER 41 49.290 24.089 41.667 273 HB3 SER 41 HB3 SER 41 50.978 24.580 41.880 274 HG SER 41 HG SER 41 50.589 25.239 43.904 275 H GLN 42 H GLN 42 47.984 27.373 43.199 276 HA GLN 42 HA GLN 42 45.420 26.633 42.048 277 HB2 GLN 42 HB2 GLN 42 46.301 28.955 43.817 278 HB3 GLN 42 HB3 GLN 42 44.602 28.598 43.425 279 HG2 GLN 42 HG2 GLN 42 44.833 26.390 44.496 280 HG3 GLN 42 HG3 GLN 42 46.541 26.737 44.811 281 HE21 GLN 42 HE21 GLN 42 45.259 26.008 46.916 282 HE22 GLN 42 HE22 GLN 42 44.896 27.347 47.992 283 H LEU 43 H LEU 43 47.600 29.386 41.610 284 HA LEU 43 HA LEU 43 45.845 30.832 39.794 285 HB2 LEU 43 HB2 LEU 43 47.388 31.879 41.410 286 HB3 LEU 43 HB3 LEU 43 48.766 31.212 40.562 287 HG LEU 43 HG LEU 43 48.344 33.613 40.203 288 HD11 LEU 43 HD11 LEU 43 49.496 32.056 38.515 289 HD12 LEU 43 HD12 LEU 43 49.000 33.678 38.013 290 HD13 LEU 43 HD13 LEU 43 48.040 32.275 37.516 291 HD21 LEU 43 HD21 LEU 43 46.585 34.419 38.755 292 HD22 LEU 43 HD22 LEU 43 45.882 33.587 40.156 293 HD23 LEU 43 HD23 LEU 43 45.920 32.787 38.561 294 H GLY 44 H GLY 44 48.577 28.559 39.496 295 HA2 GLY 44 HA2 GLY 44 48.921 28.529 36.683 296 HA3 GLY 44 HA3 GLY 44 49.241 27.196 37.790 297 H LEU 45 H LEU 45 46.972 26.258 38.690 298 HA LEU 45 HA LEU 45 45.640 24.917 36.572 299 HB2 LEU 45 HB2 LEU 45 44.878 25.485 39.469 300 HB3 LEU 45 HB3 LEU 45 43.924 24.440 38.435 301 HG LEU 45 HG LEU 45 46.846 23.926 39.154 302 HD11 LEU 45 HD11 LEU 45 45.339 23.748 41.094 303 HD12 LEU 45 HD12 LEU 45 45.919 22.152 40.598 304 HD13 LEU 45 HD13 LEU 45 44.268 22.663 40.179 305 HD21 LEU 45 HD21 LEU 45 44.810 22.188 37.708 306 HD22 LEU 45 HD22 LEU 45 46.394 21.645 38.287 307 HD23 LEU 45 HD23 LEU 45 46.302 22.865 37.020 308 H ARG 46 H ARG 46 44.615 27.843 38.410 309 HA ARG 46 HA ARG 46 42.222 28.326 36.922 310 HB2 ARG 46 HB2 ARG 46 42.536 29.397 38.991 311 HB3 ARG 46 HB3 ARG 46 44.084 30.113 38.513 312 HG2 ARG 46 HG2 ARG 46 43.082 31.719 37.118 313 HG3 ARG 46 HG3 ARG 46 41.536 30.868 37.071 314 HD2 ARG 46 HD2 ARG 46 41.122 31.370 39.426 315 HD3 ARG 46 HD3 ARG 46 42.742 32.063 39.597 316 HE ARG 46 HE ARG 46 41.952 34.049 38.825 317 HH11 ARG 46 HH11 ARG 46 39.521 31.634 37.804 318 HH12 ARG 46 HH12 ARG 46 38.499 32.940 37.214 319 HH21 ARG 46 HH21 ARG 46 40.643 35.484 37.723 320 HH22 ARG 46 HH22 ARG 46 39.089 34.898 37.106 321 H MET 47 H MET 47 45.537 29.670 36.275 322 HA MET 47 HA MET 47 44.525 31.180 34.060 323 HB2 MET 47 HB2 MET 47 46.744 31.819 33.537 324 HB3 MET 47 HB3 MET 47 46.523 31.843 35.280 325 HG2 MET 47 HG2 MET 47 48.647 30.983 35.006 326 HG3 MET 47 HG3 MET 47 47.658 29.571 35.330 327 HE1 MET 47 HE1 MET 47 50.479 28.095 33.132 328 HE2 MET 47 HE2 MET 47 50.533 29.273 34.452 329 HE3 MET 47 HE3 MET 47 49.463 27.854 34.564 330 H LEU 48 H LEU 48 45.875 27.882 34.183 331 HA LEU 48 HA LEU 48 45.729 27.399 31.359 332 HB2 LEU 48 HB2 LEU 48 46.934 25.911 32.785 333 HB3 LEU 48 HB3 LEU 48 45.544 25.656 33.834 334 HG LEU 48 HG LEU 48 44.388 24.358 32.128 335 HD11 LEU 48 HD11 LEU 48 45.494 23.667 30.046 336 HD12 LEU 48 HD12 LEU 48 46.853 24.751 30.391 337 HD13 LEU 48 HD13 LEU 48 45.241 25.416 30.042 338 HD21 LEU 48 HD21 LEU 48 45.872 22.430 32.127 339 HD22 LEU 48 HD22 LEU 48 45.996 23.271 33.677 340 HD23 LEU 48 HD23 LEU 48 47.279 23.457 32.463 341 H ALA 49 H ALA 49 43.248 26.739 33.935 342 HA ALA 49 HA ALA 49 41.272 25.795 32.149 343 HB1 ALA 49 HB1 ALA 49 41.232 25.442 34.575 344 HB2 ALA 49 HB2 ALA 49 40.982 27.180 34.853 345 HB3 ALA 49 HB3 ALA 49 39.728 26.215 34.048 346 H GLN 50 H GLN 50 41.810 29.138 33.298 347 HA GLN 50 HA GLN 50 39.599 30.330 31.869 348 HB2 GLN 50 HB2 GLN 50 42.153 31.472 33.061 349 HB3 GLN 50 HB3 GLN 50 40.887 32.468 32.351 350 HG2 GLN 50 HG2 GLN 50 40.426 30.597 34.717 351 HG3 GLN 50 HG3 GLN 50 40.807 32.311 34.855 352 HE21 GLN 50 HE21 GLN 50 38.246 30.051 34.531 353 HE22 GLN 50 HE22 GLN 50 36.981 31.230 34.236 354 H LEU 51 H LEU 51 43.145 30.079 31.061 355 HA LEU 51 HA LEU 51 42.986 31.471 28.579 356 HB2 LEU 51 HB2 LEU 51 45.094 30.972 29.666 357 HB3 LEU 51 HB3 LEU 51 44.771 29.230 29.585 358 HG LEU 51 HG LEU 51 44.944 29.283 27.113 359 HD11 LEU 51 HD11 LEU 51 44.398 31.656 26.686 360 HD12 LEU 51 HD12 LEU 51 45.979 31.232 26.017 361 HD13 LEU 51 HD13 LEU 51 45.880 32.155 27.534 362 HD21 LEU 51 HD21 LEU 51 46.850 28.695 28.561 363 HD22 LEU 51 HD22 LEU 51 47.360 30.399 28.586 364 HD23 LEU 51 HD23 LEU 51 47.366 29.473 27.063 365 H ARG 52 H ARG 52 42.536 27.961 29.315 366 HA ARG 52 HA ARG 52 42.009 27.295 26.583 367 HB2 ARG 52 HB2 ARG 52 42.719 25.780 28.521 368 HB3 ARG 52 HB3 ARG 52 41.015 25.699 28.960 369 HG2 ARG 52 HG2 ARG 52 40.421 24.638 26.904 370 HG3 ARG 52 HG3 ARG 52 41.880 25.159 26.088 371 HD2 ARG 52 HD2 ARG 52 41.959 22.749 26.562 372 HD3 ARG 52 HD3 ARG 52 43.263 23.629 27.383 373 HE ARG 52 HE ARG 52 40.821 23.247 28.974 374 HH11 ARG 52 HH11 ARG 52 43.979 21.682 28.370 375 HH12 ARG 52 HH12 ARG 52 43.968 21.082 30.011 376 HH21 ARG 52 HH21 ARG 52 40.922 22.389 30.847 377 HH22 ARG 52 HH22 ARG 52 42.354 21.480 31.378 378 H GLU 53 H GLU 53 39.750 28.194 29.230 379 HA GLU 53 HA GLU 53 37.402 28.032 27.563 380 HB2 GLU 53 HB2 GLU 53 38.082 29.459 30.138 381 HB3 GLU 53 HB3 GLU 53 36.594 29.870 29.283 382 HG2 GLU 53 HG2 GLU 53 35.832 27.561 29.312 383 HG3 GLU 53 HG3 GLU 53 37.353 27.027 30.023 384 H ARG 54 H ARG 54 39.705 30.752 27.958 385 HA ARG 54 HA ARG 54 38.076 32.569 26.352 386 HB2 ARG 54 HB2 ARG 54 40.941 32.640 27.379 387 HB3 ARG 54 HB3 ARG 54 40.250 33.956 26.450 388 HG2 ARG 54 HG2 ARG 54 39.039 33.007 29.083 389 HG3 ARG 54 HG3 ARG 54 40.298 34.233 28.944 390 HD2 ARG 54 HD2 ARG 54 38.708 35.484 27.359 391 HD3 ARG 54 HD3 ARG 54 37.441 34.383 27.936 392 HE ARG 54 HE ARG 54 38.428 35.236 30.284 393 HH11 ARG 54 HH11 ARG 54 37.775 37.373 27.500 394 HH12 ARG 54 HH12 ARG 54 37.733 38.751 28.562 395 HH21 ARG 54 HH21 ARG 54 38.272 37.089 31.464 396 HH22 ARG 54 HH22 ARG 54 38.154 38.622 30.601 397 H HIS 55 H HIS 55 40.705 30.394 25.627 398 HA HIS 55 HA HIS 55 40.976 31.527 22.881 399 HB2 HIS 55 HB2 HIS 55 42.657 31.971 24.831 400 HB3 HIS 55 HB3 HIS 55 43.187 30.320 24.555 401 HD1 HIS 55 HD1 HIS 55 43.082 30.580 21.269 402 HD2 HIS 55 HD2 HIS 55 44.950 33.056 24.102 403 HE1 HIS 55 HE1 HIS 55 45.014 31.731 20.055 404 H GLY 56 H GLY 56 40.325 28.535 24.519 405 HA2 GLY 56 HA2 GLY 56 40.214 26.364 23.804 406 HA3 GLY 56 HA3 GLY 56 40.387 26.924 22.140 407 H VAL 57 H VAL 57 42.793 27.590 24.622 408 HA VAL 57 HA VAL 57 44.861 26.111 23.045 409 HB VAL 57 HB VAL 57 44.904 28.687 24.629 410 HG11 VAL 57 HG11 VAL 57 47.341 28.847 24.267 411 HG12 VAL 57 HG12 VAL 57 46.935 27.553 25.396 412 HG13 VAL 57 HG13 VAL 57 47.371 27.162 23.718 413 HG21 VAL 57 HG21 VAL 57 45.906 27.950 21.844 414 HG22 VAL 57 HG22 VAL 57 44.334 28.685 22.186 415 HG23 VAL 57 HG23 VAL 57 45.830 29.574 22.545 416 H ASP 58 H ASP 58 46.257 24.740 24.006 417 HA ASP 58 HA ASP 58 45.719 24.007 26.839 418 HB2 ASP 58 HB2 ASP 58 45.733 22.373 24.720 419 HB3 ASP 58 HB3 ASP 58 47.462 22.359 25.028 420 H LEU 59 H LEU 59 47.376 23.878 28.347 421 HA LEU 59 HA LEU 59 50.100 24.732 27.527 422 HB2 LEU 59 HB2 LEU 59 48.628 26.537 28.660 423 HB3 LEU 59 HB3 LEU 59 48.877 25.625 30.145 424 HG LEU 59 HG LEU 59 51.053 26.825 28.388 425 HD11 LEU 59 HD11 LEU 59 49.877 27.690 31.043 426 HD12 LEU 59 HD12 LEU 59 49.739 28.534 29.489 427 HD13 LEU 59 HD13 LEU 59 51.318 28.406 30.283 428 HD21 LEU 59 HD21 LEU 59 51.996 24.914 29.586 429 HD22 LEU 59 HD22 LEU 59 51.251 25.459 31.107 430 HD23 LEU 59 HD23 LEU 59 52.553 26.399 30.337 431 HA PRO 60 HA PRO 60 50.434 20.834 29.813 432 HB2 PRO 60 HB2 PRO 60 52.732 19.835 28.744 433 HB3 PRO 60 HB3 PRO 60 51.164 19.832 27.879 434 HG2 PRO 60 HG2 PRO 60 53.434 21.802 27.629 435 HG3 PRO 60 HG3 PRO 60 52.517 21.010 26.311 436 HD2 PRO 60 HD2 PRO 60 51.985 23.545 27.233 437 HD3 PRO 60 HD3 PRO 60 50.701 22.476 26.588 438 H LEU 61 H LEU 61 51.322 20.345 31.693 439 HA LEU 61 HA LEU 61 52.790 22.268 33.195 440 HB2 LEU 61 HB2 LEU 61 52.061 19.351 33.645 441 HB3 LEU 61 HB3 LEU 61 53.008 20.250 34.812 442 HG LEU 61 HG LEU 61 50.689 20.122 35.463 443 HD11 LEU 61 HD11 LEU 61 52.061 22.092 36.130 444 HD12 LEU 61 HD12 LEU 61 50.325 22.431 36.055 445 HD13 LEU 61 HD13 LEU 61 51.381 22.996 34.754 446 HD21 LEU 61 HD21 LEU 61 49.964 21.862 33.073 447 HD22 LEU 61 HD22 LEU 61 48.898 21.306 34.365 448 HD23 LEU 61 HD23 LEU 61 49.587 20.127 33.241 449 H ARG 62 H ARG 62 53.955 19.600 31.237 450 HA ARG 62 HA ARG 62 56.719 19.582 32.063 451 HB2 ARG 62 HB2 ARG 62 55.283 18.983 29.454 452 HB3 ARG 62 HB3 ARG 62 57.036 18.835 29.626 453 HG2 ARG 62 HG2 ARG 62 56.890 17.087 31.210 454 HG3 ARG 62 HG3 ARG 62 55.196 17.413 31.577 455 HD2 ARG 62 HD2 ARG 62 55.394 15.424 30.193 456 HD3 ARG 62 HD3 ARG 62 54.512 16.692 29.336 457 HE ARG 62 HE ARG 62 57.160 17.047 28.540 458 HH11 ARG 62 HH11 ARG 62 55.020 14.237 28.337 459 HH12 ARG 62 HH12 ARG 62 55.929 13.620 26.961 460 HH21 ARG 62 HH21 ARG 62 58.147 16.232 26.928 461 HH22 ARG 62 HH22 ARG 62 57.782 14.621 26.315 462 H CYS 63 H CYS 63 55.244 21.397 29.288 463 HA CYS 63 HA CYS 63 57.634 22.898 28.814 464 HB2 CYS 63 HB2 CYS 63 54.781 23.606 27.985 465 HB3 CYS 63 HB3 CYS 63 56.273 24.344 27.402 466 HG CYS 63 HG CYS 63 57.398 22.128 26.519 467 H LEU 64 H LEU 64 54.826 23.564 30.918 468 HA LEU 64 HA LEU 64 55.690 26.139 31.801 469 HB2 LEU 64 HB2 LEU 64 53.474 24.939 32.244 470 HB3 LEU 64 HB3 LEU 64 54.312 23.999 33.465 471 HG LEU 64 HG LEU 64 54.900 26.135 34.676 472 HD11 LEU 64 HD11 LEU 64 53.038 27.348 32.590 473 HD12 LEU 64 HD12 LEU 64 54.732 27.800 32.935 474 HD13 LEU 64 HD13 LEU 64 53.467 28.136 34.115 475 HD21 LEU 64 HD21 LEU 64 52.653 26.484 35.589 476 HD22 LEU 64 HD22 LEU 64 52.996 24.769 35.365 477 HD23 LEU 64 HD23 LEU 64 51.939 25.619 34.208 478 H TYR 65 H TYR 65 56.563 22.874 33.055 479 HA TYR 65 HA TYR 65 58.192 23.890 35.203 480 HB2 TYR 65 HB2 TYR 65 57.069 21.745 35.302 481 HB3 TYR 65 HB3 TYR 65 57.941 21.167 33.885 482 HD1 TYR 65 HD1 TYR 65 58.449 22.399 37.390 483 HD2 TYR 65 HD2 TYR 65 60.001 20.037 34.126 484 HE1 TYR 65 HE1 TYR 65 60.288 21.591 38.854 485 HE2 TYR 65 HE2 TYR 65 61.820 19.180 35.629 486 HH TYR 65 HH TYR 65 62.256 20.453 38.925 487 H GLU 66 H GLU 66 58.976 22.863 31.889 488 HA GLU 66 HA GLU 66 61.873 23.118 32.479 489 HB2 GLU 66 HB2 GLU 66 62.316 21.859 30.576 490 HB3 GLU 66 HB3 GLU 66 60.946 21.105 31.380 491 HG2 GLU 66 HG2 GLU 66 59.474 22.422 29.696 492 HG3 GLU 66 HG3 GLU 66 60.960 22.762 28.830 493 H ALA 67 H ALA 67 59.451 25.032 30.827 494 HA ALA 67 HA ALA 67 61.541 27.071 30.319 495 HB1 ALA 67 HB1 ALA 67 60.648 27.487 28.070 496 HB2 ALA 67 HB2 ALA 67 61.225 25.815 28.213 497 HB3 ALA 67 HB3 ALA 67 59.482 26.160 28.268 498 HA PRO 68 HA PRO 68 57.509 28.587 32.325 499 HB2 PRO 68 HB2 PRO 68 58.542 29.661 34.651 500 HB3 PRO 68 HB3 PRO 68 58.018 27.984 34.483 501 HG2 PRO 68 HG2 PRO 68 60.827 29.119 34.187 502 HG3 PRO 68 HG3 PRO 68 60.314 27.696 35.149 503 HD2 PRO 68 HD2 PRO 68 61.384 27.393 32.685 504 HD3 PRO 68 HD3 PRO 68 60.008 26.381 33.202 505 H THR 69 H THR 69 60.288 30.069 31.036 506 HA THR 69 HA THR 69 59.781 32.781 31.988 507 HB THR 69 HB THR 69 61.627 33.270 30.214 508 HG1 THR 69 HG1 THR 69 62.348 30.596 30.641 509 HG21 THR 69 HG21 THR 69 62.118 31.590 32.720 510 HG22 THR 69 HG22 THR 69 62.043 33.358 32.624 511 HG23 THR 69 HG23 THR 69 63.371 32.486 31.844 512 H VAL 70 H VAL 70 58.324 34.139 31.125 513 HA VAL 70 HA VAL 70 56.433 32.960 29.613 514 HB VAL 70 HB VAL 70 55.291 35.107 29.275 515 HG11 VAL 70 HG11 VAL 70 54.850 35.520 31.579 516 HG12 VAL 70 HG12 VAL 70 55.086 33.789 31.308 517 HG13 VAL 70 HG13 VAL 70 56.380 34.741 32.078 518 HG21 VAL 70 HG21 VAL 70 56.164 37.140 30.341 519 HG22 VAL 70 HG22 VAL 70 57.728 36.361 30.606 520 HG23 VAL 70 HG23 VAL 70 57.138 36.667 28.946 521 H ALA 71 H ALA 71 58.862 35.027 27.974 522 HA ALA 71 HA ALA 71 57.450 34.918 25.434 523 HB1 ALA 71 HB1 ALA 71 60.377 35.480 26.077 524 HB2 ALA 71 HB2 ALA 71 59.565 35.779 24.527 525 HB3 ALA 71 HB3 ALA 71 59.073 36.686 25.969 526 H ARG 72 H ARG 72 59.985 32.926 26.922 527 HA ARG 72 HA ARG 72 60.426 31.167 24.624 528 HB2 ARG 72 HB2 ARG 72 61.154 31.032 27.587 529 HB3 ARG 72 HB3 ARG 72 61.655 29.825 26.419 530 HG2 ARG 72 HG2 ARG 72 62.862 31.550 25.104 531 HG3 ARG 72 HG3 ARG 72 62.316 32.800 26.230 532 HD2 ARG 72 HD2 ARG 72 64.605 32.224 26.725 533 HD3 ARG 72 HD3 ARG 72 63.550 31.748 28.062 534 HE ARG 72 HE ARG 72 64.021 29.576 26.167 535 HH11 ARG 72 HH11 ARG 72 65.401 31.067 29.070 536 HH12 ARG 72 HH12 ARG 72 66.147 29.524 29.504 537 HH21 ARG 72 HH21 ARG 72 65.090 27.848 26.756 538 HH22 ARG 72 HH22 ARG 72 66.000 27.828 28.280 539 H LEU 73 H LEU 73 58.466 31.059 27.576 540 HA LEU 73 HA LEU 73 57.183 28.564 27.167 541 HB2 LEU 73 HB2 LEU 73 57.110 30.018 29.191 542 HB3 LEU 73 HB3 LEU 73 56.011 31.106 28.382 543 HG LEU 73 HG LEU 73 55.209 28.224 28.382 544 HD11 LEU 73 HD11 LEU 73 55.098 29.955 30.880 545 HD12 LEU 73 HD12 LEU 73 55.996 28.433 30.657 546 HD13 LEU 73 HD13 LEU 73 54.226 28.415 30.644 547 HD21 LEU 73 HD21 LEU 73 53.750 29.999 27.383 548 HD22 LEU 73 HD22 LEU 73 53.659 30.787 28.971 549 HD23 LEU 73 HD23 LEU 73 52.976 29.164 28.728 550 H ALA 74 H ALA 74 56.136 31.885 26.081 551 HA ALA 74 HA ALA 74 53.896 30.995 24.617 552 HB1 ALA 74 HB1 ALA 74 54.084 33.160 23.441 553 HB2 ALA 74 HB2 ALA 74 54.328 33.354 25.191 554 HB3 ALA 74 HB3 ALA 74 55.722 33.382 24.083 555 H GLU 75 H GLU 75 57.322 31.196 23.566 556 HA GLU 75 HA GLU 75 56.749 30.261 20.880 557 HB2 GLU 75 HB2 GLU 75 59.278 30.223 22.538 558 HB3 GLU 75 HB3 GLU 75 59.219 29.636 20.881 559 HG2 GLU 75 HG2 GLU 75 58.230 32.441 21.503 560 HG3 GLU 75 HG3 GLU 75 59.952 32.106 21.416 561 H THR 76 H THR 76 57.378 28.372 23.930 562 HA THR 76 HA THR 76 57.155 25.823 22.592 563 HB THR 76 HB THR 76 56.557 24.733 24.564 564 HG1 THR 76 HG1 THR 76 55.942 27.275 25.581 565 HG21 THR 76 HG21 THR 76 58.492 26.845 25.496 566 HG22 THR 76 HG22 THR 76 58.917 25.571 24.324 567 HG23 THR 76 HG23 THR 76 58.392 25.143 25.964 568 H ILE 77 H ILE 77 54.538 27.813 24.070 569 HA ILE 77 HA ILE 77 52.544 25.861 23.445 570 HB ILE 77 HB ILE 77 52.176 28.796 24.126 571 HG12 ILE 77 HG12 ILE 77 53.390 27.836 25.941 572 HG13 ILE 77 HG13 ILE 77 51.728 27.920 26.446 573 HG21 ILE 77 HG21 ILE 77 50.227 26.446 24.166 574 HG22 ILE 77 HG22 ILE 77 49.931 27.977 25.007 575 HG23 ILE 77 HG23 ILE 77 50.097 27.967 23.256 576 HD11 ILE 77 HD11 ILE 77 52.729 25.821 27.169 577 HD12 ILE 77 HD12 ILE 77 51.499 25.461 25.933 578 HD13 ILE 77 HD13 ILE 77 53.230 25.418 25.532 579 H VAL 78 H VAL 78 53.752 28.627 21.605 580 HA VAL 78 HA VAL 78 51.818 28.368 19.448 581 HB VAL 78 HB VAL 78 54.458 29.832 19.697 582 HG11 VAL 78 HG11 VAL 78 52.499 29.835 17.361 583 HG12 VAL 78 HG12 VAL 78 53.792 31.025 17.628 584 HG13 VAL 78 HG13 VAL 78 54.213 29.341 17.326 585 HG21 VAL 78 HG21 VAL 78 52.485 30.714 21.002 586 HG22 VAL 78 HG22 VAL 78 53.001 31.818 19.725 587 HG23 VAL 78 HG23 VAL 78 51.558 30.803 19.496 588 H ARG 79 H ARG 79 55.239 27.060 19.840 589 HA ARG 79 HA ARG 79 55.032 25.718 17.268 590 HB2 ARG 79 HB2 ARG 79 57.044 24.642 17.698 591 HB3 ARG 79 HB3 ARG 79 57.195 26.248 18.411 592 HG2 ARG 79 HG2 ARG 79 56.767 25.270 20.637 593 HG3 ARG 79 HG3 ARG 79 56.657 23.657 19.936 594 HD2 ARG 79 HD2 ARG 79 58.988 23.746 19.232 595 HD3 ARG 79 HD3 ARG 79 59.085 25.452 19.666 596 HE ARG 79 HE ARG 79 59.575 24.910 21.807 597 HH11 ARG 79 HH11 ARG 79 58.216 21.913 20.442 598 HH12 ARG 79 HH12 ARG 79 58.596 21.068 21.939 599 HH21 ARG 79 HH21 ARG 79 60.158 23.570 23.508 600 HH22 ARG 79 HH22 ARG 79 59.599 21.911 23.508 601 H LEU 80 H LEU 80 53.806 24.885 20.387 602 HA LEU 80 HA LEU 80 52.983 22.185 19.507 603 HB2 LEU 80 HB2 LEU 80 52.741 23.604 22.175 604 HB3 LEU 80 HB3 LEU 80 52.311 21.924 21.887 605 HG LEU 80 HG LEU 80 55.142 22.980 21.458 606 HD11 LEU 80 HD11 LEU 80 54.486 23.284 23.807 607 HD12 LEU 80 HD12 LEU 80 55.725 22.042 23.598 608 HD13 LEU 80 HD13 LEU 80 54.034 21.565 23.901 609 HD21 LEU 80 HD21 LEU 80 54.117 20.153 21.853 610 HD22 LEU 80 HD22 LEU 80 55.805 20.657 21.618 611 HD23 LEU 80 HD23 LEU 80 54.648 20.860 20.301 612 H ALA 81 H ALA 81 51.659 24.923 18.555 613 HA ALA 81 HA ALA 81 49.022 24.843 19.628 614 HB1 ALA 81 HB1 ALA 81 50.063 26.840 18.651 615 HB2 ALA 81 HB2 ALA 81 50.035 26.089 17.042 616 HB3 ALA 81 HB3 ALA 81 48.515 26.476 17.877 617 H ALA 82 H ALA 82 50.353 23.035 16.880 618 HA ALA 82 HA ALA 82 47.872 21.402 17.050 619 HB1 ALA 82 HB1 ALA 82 49.120 22.265 14.414 620 HB2 ALA 82 HB2 ALA 82 47.836 21.058 14.614 621 HB3 ALA 82 HB3 ALA 82 47.549 22.745 15.070 622 HA PRO 83 HA PRO 83 51.282 18.314 16.279 623 HB2 PRO 83 HB2 PRO 83 53.935 19.134 15.870 624 HB3 PRO 83 HB3 PRO 83 52.759 18.646 14.630 625 HG2 PRO 83 HG2 PRO 83 53.818 21.310 15.059 626 HG3 PRO 83 HG3 PRO 83 52.656 20.744 13.829 627 HD2 PRO 83 HD2 PRO 83 52.146 22.109 16.416 628 HD3 PRO 83 HD3 PRO 83 51.143 22.016 14.941 629 H ALA 84 H ALA 84 50.849 17.928 18.436 630 HA ALA 84 HA ALA 84 52.708 18.988 20.520 631 HB1 ALA 84 HB1 ALA 84 50.638 20.247 20.517 632 HB2 ALA 84 HB2 ALA 84 49.680 18.766 20.609 633 HB3 ALA 84 HB3 ALA 84 50.728 19.243 21.973 634 HA PRO 85 HA PRO 85 52.429 14.356 20.723 635 HB2 PRO 85 HB2 PRO 85 55.039 13.661 20.443 636 HB3 PRO 85 HB3 PRO 85 54.054 14.220 19.061 637 HG2 PRO 85 HG2 PRO 85 55.949 15.869 20.770 638 HG3 PRO 85 HG3 PRO 85 55.885 15.752 18.979 639 HD2 PRO 85 HD2 PRO 85 54.648 17.762 20.371 640 HD3 PRO 85 HD3 PRO 85 53.983 17.090 18.856 641 H SER 86 H SER 86 53.186 16.616 22.923 642 HA SER 86 HA SER 86 54.818 15.298 24.873 643 HB2 SER 86 HB2 SER 86 54.044 17.362 26.233 644 HB3 SER 86 HB3 SER 86 54.971 17.615 24.751 645 HG SER 86 HG SER 86 52.183 17.964 25.153 646 H GLY 87 H GLY 87 52.461 13.693 24.191 647 HA2 GLY 87 HA2 GLY 87 50.859 13.606 26.690 648 HA3 GLY 87 HA3 GLY 87 50.587 12.689 25.205 649 H ASP 88 H ASP 88 53.833 12.370 25.650 650 HA ASP 88 HA ASP 88 53.483 9.644 26.509 651 HB2 ASP 88 HB2 ASP 88 55.739 9.347 25.844 652 HB3 ASP 88 HB3 ASP 88 55.017 10.438 24.677 653 H GLN 89 H GLN 89 53.792 8.771 28.558 654 HA GLN 89 HA GLN 89 55.225 10.420 30.626 655 HB2 GLN 89 HB2 GLN 89 52.872 8.527 30.909 656 HB3 GLN 89 HB3 GLN 89 53.745 9.284 32.249 657 HG2 GLN 89 HG2 GLN 89 53.121 11.537 31.413 658 HG3 GLN 89 HG3 GLN 89 52.223 10.799 30.076 659 HE21 GLN 89 HE21 GLN 89 50.281 9.549 30.547 660 HE22 GLN 89 HE22 GLN 89 49.579 9.599 32.162 661 H ASP 90 H ASP 90 54.681 7.122 29.392 662 HA ASP 90 HA ASP 90 57.451 6.526 29.839 663 HB2 ASP 90 HB2 ASP 90 57.192 4.487 31.181 664 HB3 ASP 90 HB3 ASP 90 56.849 5.945 32.087 665 H ASP 91 H ASP 91 58.185 4.915 28.537 666 HA ASP 91 HA ASP 91 56.232 3.405 26.827 667 HB2 ASP 91 HB2 ASP 91 57.301 5.418 25.740 668 HB3 ASP 91 HB3 ASP 91 58.863 4.635 25.968 669 H ALA 92 H ALA 92 58.961 3.262 28.932 670 HA ALA 92 HA ALA 92 59.980 0.662 28.146 671 HB1 ALA 92 HB1 ALA 92 60.169 2.247 30.742 672 HB2 ALA 92 HB2 ALA 92 61.124 0.811 30.321 673 HB3 ALA 92 HB3 ALA 92 61.319 2.311 29.394 674 H SER 93 H SER 93 59.052 -1.289 28.514 675 HA SER 93 HA SER 93 56.910 -1.646 30.518 676 HB2 SER 93 HB2 SER 93 58.288 -3.628 28.669 677 HB3 SER 93 HB3 SER 93 56.868 -3.956 29.677 678 HG SER 93 HG SER 93 55.721 -2.375 28.516 679 H GLU 94 H GLU 94 57.035 -3.537 31.930 680 HA GLU 94 HA GLU 94 57.796 -4.840 33.558 681 HB2 GLU 94 HB2 GLU 94 60.413 -4.955 32.032 682 HB3 GLU 94 HB3 GLU 94 59.794 -6.137 33.169 683 HG2 GLU 94 HG2 GLU 94 58.751 -5.522 30.396 684 HG3 GLU 94 HG3 GLU 94 59.404 -7.036 31.013 685 H TYR 95 H TYR 95 59.726 -5.408 35.069 686 HA TYR 95 HA TYR 95 60.591 -5.016 37.035 687 HB2 TYR 95 HB2 TYR 95 62.252 -3.692 35.881 688 HB3 TYR 95 HB3 TYR 95 61.263 -2.254 36.048 689 HD1 TYR 95 HD1 TYR 95 63.447 -4.628 37.829 690 HD2 TYR 95 HD2 TYR 95 61.020 -1.074 38.156 691 HE1 TYR 95 HE1 TYR 95 64.637 -4.006 39.926 692 HE2 TYR 95 HE2 TYR 95 62.185 -0.475 40.270 693 HH TYR 95 HH TYR 95 64.944 -2.417 41.506 694 H GLU 96 H GLU 96 59.742 -4.871 38.952 695 HA GLU 96 HA GLU 96 58.029 -2.640 39.801 696 HB2 GLU 96 HB2 GLU 96 56.479 -4.279 38.687 697 HB3 GLU 96 HB3 GLU 96 57.027 -5.524 39.817 698 HG2 GLU 96 HG2 GLU 96 56.250 -4.049 41.705 699 HG3 GLU 96 HG3 GLU 96 55.615 -2.914 40.510 700 H GLU 97 H GLU 97 57.972 -2.455 42.131 701 HA GLU 97 HA GLU 97 60.309 -3.774 43.387 702 HB2 GLU 97 HB2 GLU 97 58.695 -1.372 44.274 703 HB3 GLU 97 HB3 GLU 97 60.195 -1.965 44.992 704 HG2 GLU 97 HG2 GLU 97 61.370 -1.616 42.812 705 HG3 GLU 97 HG3 GLU 97 59.898 -0.880 42.157 706 H GLY 98 H GLY 98 57.133 -4.532 43.281 707 HA2 GLY 98 HA2 GLY 98 55.908 -6.108 44.383 708 HA3 GLY 98 HA3 GLY 98 57.442 -6.646 45.076 709 H VAL 99 H VAL 99 55.599 -3.613 45.652 710 HA VAL 99 HA VAL 99 55.973 -3.922 48.544 711 HB VAL 99 HB VAL 99 54.980 -1.772 48.792 712 HG11 VAL 99 HG11 VAL 99 56.563 -0.428 47.528 713 HG12 VAL 99 HG12 VAL 99 57.347 -1.908 48.092 714 HG13 VAL 99 HG13 VAL 99 56.854 -1.752 46.390 715 HG21 VAL 99 HG21 VAL 99 54.123 -0.429 46.967 716 HG22 VAL 99 HG22 VAL 99 54.401 -1.740 45.815 717 HG23 VAL 99 HG23 VAL 99 53.177 -1.910 47.095 718 H ILE 100 H ILE 100 54.126 -3.485 50.049 719 HA ILE 100 HA ILE 100 52.698 -5.778 50.200 720 HB ILE 100 HB ILE 100 53.224 -4.337 52.050 721 HG12 ILE 100 HG12 ILE 100 50.228 -4.846 52.050 722 HG13 ILE 100 HG13 ILE 100 51.440 -6.122 52.185 723 HG21 ILE 100 HG21 ILE 100 50.878 -2.570 51.243 724 HG22 ILE 100 HG22 ILE 100 51.916 -2.373 52.670 725 HG23 ILE 100 HG23 ILE 100 52.592 -2.136 51.063 726 HD11 ILE 100 HD11 ILE 100 50.949 -3.868 54.150 727 HD12 ILE 100 HD12 ILE 100 50.746 -5.615 54.390 728 HD13 ILE 100 HD13 ILE 100 52.372 -4.937 54.214 729 H ARG 101 H ARG 101 50.846 -6.643 49.799 730 HA ARG 101 HA ARG 101 49.072 -7.303 48.621 731 HB2 ARG 101 HB2 ARG 101 48.111 -4.447 48.685 732 HB3 ARG 101 HB3 ARG 101 47.182 -5.844 48.140 733 HG2 ARG 101 HG2 ARG 101 47.424 -6.899 50.375 734 HG3 ARG 101 HG3 ARG 101 48.332 -5.486 50.944 735 HD2 ARG 101 HD2 ARG 101 46.392 -4.034 50.494 736 HD3 ARG 101 HD3 ARG 101 45.484 -5.445 49.906 737 HE ARG 101 HE ARG 101 46.477 -5.896 52.579 738 HH11 ARG 101 HH11 ARG 101 43.912 -4.110 50.965 739 HH12 ARG 101 HH12 ARG 101 42.859 -4.278 52.362 740 HH21 ARG 101 HH21 ARG 101 45.165 -6.062 54.199 741 HH22 ARG 101 HH22 ARG 101 43.560 -5.360 54.185 Start of MODEL 12 1 H GLY 1 H1 GLY 1 48.203 52.022 22.525 2 HA2 GLY 1 HA2 GLY 1 45.363 52.233 23.227 3 HA3 GLY 1 HA3 GLY 1 46.588 51.309 24.113 4 H ALA 2 H ALA 2 46.253 54.905 25.500 5 HA ALA 2 HA ALA 2 44.208 54.376 26.201 6 HB1 ALA 2 HB1 ALA 2 43.700 55.036 23.870 7 HB2 ALA 2 HB2 ALA 2 43.700 53.331 23.399 8 HB3 ALA 2 HB3 ALA 2 42.515 53.922 24.568 9 H ALA 3 H ALA 3 45.291 52.882 27.651 10 HA ALA 3 HA ALA 3 45.671 50.955 28.710 11 HB1 ALA 3 HB1 ALA 3 43.159 50.956 28.782 12 HB2 ALA 3 HB2 ALA 3 43.172 49.840 27.397 13 HB3 ALA 3 HB3 ALA 3 43.912 49.366 28.940 14 H ALA 4 H ALA 4 45.095 48.176 27.610 15 HA ALA 4 HA ALA 4 47.305 48.057 25.599 16 HB1 ALA 4 HB1 ALA 4 47.461 45.719 26.202 17 HB2 ALA 4 HB2 ALA 4 47.541 46.711 27.663 18 HB3 ALA 4 HB3 ALA 4 46.038 45.849 27.258 19 H GLY 5 H GLY 5 46.953 46.506 23.745 20 HA2 GLY 5 HA2 GLY 5 44.382 45.530 23.021 21 HA3 GLY 5 HA3 GLY 5 44.512 47.164 22.386 22 H VAL 6 H VAL 6 47.536 45.340 22.304 23 HA VAL 6 HA VAL 6 47.494 45.380 19.423 24 HB VAL 6 HB VAL 6 49.542 45.612 20.829 25 HG11 VAL 6 HG11 VAL 6 50.757 43.671 21.584 26 HG12 VAL 6 HG12 VAL 6 49.163 43.645 22.348 27 HG13 VAL 6 HG13 VAL 6 49.507 42.570 20.981 28 HG21 VAL 6 HG21 VAL 6 51.010 44.494 19.249 29 HG22 VAL 6 HG22 VAL 6 49.693 43.469 18.668 30 HG23 VAL 6 HG23 VAL 6 49.646 45.229 18.393 31 H SER 7 H SER 7 47.310 43.733 17.922 32 HA SER 7 HA SER 7 46.258 41.106 18.856 33 HB2 SER 7 HB2 SER 7 44.330 41.314 17.452 34 HB3 SER 7 HB3 SER 7 44.401 42.740 18.487 35 HG SER 7 HG SER 7 45.349 43.882 16.724 36 H ALA 8 H ALA 8 46.219 39.431 17.277 37 HA ALA 8 HA ALA 8 47.376 38.070 15.874 38 HB1 ALA 8 HB1 ALA 8 45.694 39.050 14.408 39 HB2 ALA 8 HB2 ALA 8 46.800 40.375 13.990 40 HB3 ALA 8 HB3 ALA 8 47.174 38.707 13.501 41 H ALA 9 H ALA 9 49.211 39.279 17.493 42 HA ALA 9 HA ALA 9 51.169 40.836 16.139 43 HB1 ALA 9 HB1 ALA 9 50.668 40.972 18.555 44 HB2 ALA 9 HB2 ALA 9 51.364 39.351 18.792 45 HB3 ALA 9 HB3 ALA 9 52.389 40.695 18.248 46 H GLY 10 H GLY 10 53.227 40.437 15.464 47 HA2 GLY 10 HA2 GLY 10 53.937 37.739 14.519 48 HA3 GLY 10 HA3 GLY 10 54.812 39.249 14.238 49 H ILE 11 H ILE 11 54.682 39.818 17.246 50 HA ILE 11 HA ILE 11 56.453 37.711 18.347 51 HB ILE 11 HB ILE 11 57.765 39.686 17.419 52 HG12 ILE 11 HG12 ILE 11 58.071 39.006 20.364 53 HG13 ILE 11 HG13 ILE 11 58.673 38.067 18.993 54 HG21 ILE 11 HG21 ILE 11 56.736 41.176 19.874 55 HG22 ILE 11 HG22 ILE 11 57.850 41.772 18.633 56 HG23 ILE 11 HG23 ILE 11 56.165 41.472 18.219 57 HD11 ILE 11 HD11 ILE 11 59.600 40.836 19.808 58 HD12 ILE 11 HD12 ILE 11 60.487 39.312 19.951 59 HD13 ILE 11 HD13 ILE 11 60.133 39.969 18.341 60 H GLU 12 H GLU 12 56.216 37.346 20.530 61 HA GLU 12 HA GLU 12 55.025 37.074 22.467 62 HB2 GLU 12 HB2 GLU 12 55.237 40.088 22.337 63 HB3 GLU 12 HB3 GLU 12 54.620 39.211 23.747 64 HG2 GLU 12 HG2 GLU 12 56.693 37.990 24.007 65 HG3 GLU 12 HG3 GLU 12 57.352 38.667 22.518 66 HA PRO 13 HA PRO 13 50.833 37.456 20.610 67 HB2 PRO 13 HB2 PRO 13 50.727 34.571 21.445 68 HB3 PRO 13 HB3 PRO 13 50.168 35.341 19.927 69 HG2 PRO 13 HG2 PRO 13 52.451 33.922 19.954 70 HG3 PRO 13 HG3 PRO 13 52.398 35.499 19.092 71 HD2 PRO 13 HD2 PRO 13 53.421 34.947 21.897 72 HD3 PRO 13 HD3 PRO 13 54.214 35.816 20.553 73 H ASP 14 H ASP 14 48.663 36.570 21.480 74 HA ASP 14 HA ASP 14 47.968 38.135 23.610 75 HB2 ASP 14 HB2 ASP 14 46.466 35.639 22.750 76 HB3 ASP 14 HB3 ASP 14 45.785 37.052 23.533 77 H LEU 15 H LEU 15 49.206 34.876 24.001 78 HA LEU 15 HA LEU 15 48.118 34.129 26.518 79 HB2 LEU 15 HB2 LEU 15 50.975 33.694 25.506 80 HB3 LEU 15 HB3 LEU 15 50.218 32.901 26.871 81 HG LEU 15 HG LEU 15 48.450 32.048 25.104 82 HD11 LEU 15 HD11 LEU 15 49.311 33.308 23.130 83 HD12 LEU 15 HD12 LEU 15 49.487 31.579 22.900 84 HD13 LEU 15 HD13 LEU 15 50.901 32.553 23.340 85 HD21 LEU 15 HD21 LEU 15 51.308 30.991 25.259 86 HD22 LEU 15 HD22 LEU 15 49.897 30.070 24.698 87 HD23 LEU 15 HD23 LEU 15 49.987 30.609 26.381 88 H THR 16 H THR 16 50.823 36.301 25.734 89 HA THR 16 HA THR 16 51.769 36.801 28.396 90 HB THR 16 HB THR 16 52.802 38.812 27.440 91 HG1 THR 16 HG1 THR 16 51.626 38.114 24.947 92 HG21 THR 16 HG21 THR 16 53.930 36.648 27.053 93 HG22 THR 16 HG22 THR 16 54.183 37.758 25.702 94 HG23 THR 16 HG23 THR 16 53.025 36.424 25.537 95 H ALA 17 H ALA 17 49.376 38.527 26.408 96 HA ALA 17 HA ALA 17 48.723 40.553 28.304 97 HB1 ALA 17 HB1 ALA 17 47.197 39.420 25.927 98 HB2 ALA 17 HB2 ALA 17 46.818 40.929 26.769 99 HB3 ALA 17 HB3 ALA 17 48.360 40.766 25.919 100 H ILE 18 H ILE 18 47.219 37.343 27.661 101 HA ILE 18 HA ILE 18 45.090 37.604 29.581 102 HB ILE 18 HB ILE 18 46.545 35.169 28.485 103 HG12 ILE 18 HG12 ILE 18 43.752 36.265 27.893 104 HG13 ILE 18 HG13 ILE 18 45.167 36.606 26.905 105 HG21 ILE 18 HG21 ILE 18 45.585 34.543 30.678 106 HG22 ILE 18 HG22 ILE 18 44.021 35.240 30.205 107 HG23 ILE 18 HG23 ILE 18 44.665 33.801 29.390 108 HD11 ILE 18 HD11 ILE 18 43.874 33.889 27.315 109 HD12 ILE 18 HD12 ILE 18 43.989 34.841 25.832 110 HD13 ILE 18 HD13 ILE 18 45.456 34.130 26.535 111 H TRP 19 H TRP 19 48.439 36.290 29.951 112 HA TRP 19 HA TRP 19 48.084 35.599 32.720 113 HB2 TRP 19 HB2 TRP 19 50.570 36.197 31.061 114 HB3 TRP 19 HB3 TRP 19 50.612 35.649 32.727 115 HD1 TRP 19 HD1 TRP 19 48.217 34.001 30.201 116 HE1 TRP 19 HE1 TRP 19 48.973 31.597 29.786 117 HE3 TRP 19 HE3 TRP 19 52.601 34.067 32.828 118 HZ2 TRP 19 HZ2 TRP 19 51.166 29.885 30.535 119 HZ3 TRP 19 HZ3 TRP 19 54.038 32.055 32.905 120 HH2 TRP 19 HH2 TRP 19 53.311 29.944 31.808 121 H GLN 20 H GLN 20 49.601 38.581 31.262 122 HA GLN 20 HA GLN 20 50.003 39.661 33.907 123 HB2 GLN 20 HB2 GLN 20 50.879 41.581 32.911 124 HB3 GLN 20 HB3 GLN 20 51.404 40.190 31.982 125 HG2 GLN 20 HG2 GLN 20 49.453 40.795 30.366 126 HG3 GLN 20 HG3 GLN 20 49.409 42.347 31.208 127 HE21 GLN 20 HE21 GLN 20 50.176 41.908 28.352 128 HE22 GLN 20 HE22 GLN 20 51.887 42.292 28.236 129 H ALA 21 H ALA 21 47.188 39.912 31.715 130 HA ALA 21 HA ALA 21 45.824 41.878 33.327 131 HB1 ALA 21 HB1 ALA 21 45.115 41.342 31.076 132 HB2 ALA 21 HB2 ALA 21 44.750 39.659 31.549 133 HB3 ALA 21 HB3 ALA 21 43.814 41.008 32.225 134 H LEU 22 H LEU 22 45.814 38.242 33.490 135 HA LEU 22 HA LEU 22 43.911 38.212 35.666 136 HB2 LEU 22 HB2 LEU 22 45.805 36.125 34.516 137 HB3 LEU 22 HB3 LEU 22 44.716 35.770 35.804 138 HG LEU 22 HG LEU 22 43.820 36.804 33.059 139 HD11 LEU 22 HD11 LEU 22 43.481 34.036 34.223 140 HD12 LEU 22 HD12 LEU 22 44.793 34.467 33.089 141 HD13 LEU 22 HD13 LEU 22 43.101 34.575 32.575 142 HD21 LEU 22 HD21 LEU 22 42.193 35.731 35.407 143 HD22 LEU 22 HD22 LEU 22 41.557 36.043 33.777 144 HD23 LEU 22 HD23 LEU 22 42.151 37.380 34.753 145 H PHE 23 H PHE 23 47.465 37.971 35.574 146 HA PHE 23 HA PHE 23 47.609 37.822 38.485 147 HB2 PHE 23 HB2 PHE 23 49.707 38.124 36.340 148 HB3 PHE 23 HB3 PHE 23 50.076 37.890 38.037 149 HD1 PHE 23 HD1 PHE 23 47.848 35.667 38.496 150 HD2 PHE 23 HD2 PHE 23 50.854 36.272 35.461 151 HE1 PHE 23 HE1 PHE 23 47.853 33.239 37.999 152 HE2 PHE 23 HE2 PHE 23 50.862 33.831 34.992 153 HZ PHE 23 HZ PHE 23 49.371 32.318 36.277 154 H ALA 24 H ALA 24 46.767 40.332 36.640 155 HA ALA 24 HA ALA 24 46.694 42.544 36.811 156 HB1 ALA 24 HB1 ALA 24 46.994 41.970 39.763 157 HB2 ALA 24 HB2 ALA 24 46.187 43.373 39.020 158 HB3 ALA 24 HB3 ALA 24 45.513 41.748 38.815 159 H LEU 25 H LEU 25 49.540 41.494 36.570 160 HA LEU 25 HA LEU 25 51.083 43.709 37.763 161 HB2 LEU 25 HB2 LEU 25 53.051 42.331 37.329 162 HB3 LEU 25 HB3 LEU 25 51.819 41.538 38.282 163 HG LEU 25 HG LEU 25 51.089 40.397 36.023 164 HD11 LEU 25 HD11 LEU 25 52.593 41.726 34.510 165 HD12 LEU 25 HD12 LEU 25 52.932 39.997 34.465 166 HD13 LEU 25 HD13 LEU 25 53.994 41.079 35.384 167 HD21 LEU 25 HD21 LEU 25 53.712 39.688 37.397 168 HD22 LEU 25 HD22 LEU 25 52.706 38.590 36.424 169 HD23 LEU 25 HD23 LEU 25 52.091 39.235 37.954 170 HA PRO 26 HA PRO 26 51.418 45.894 34.037 171 HB2 PRO 26 HB2 PRO 26 53.571 47.515 34.373 172 HB3 PRO 26 HB3 PRO 26 52.110 47.603 35.401 173 HG2 PRO 26 HG2 PRO 26 54.701 46.127 35.980 174 HG3 PRO 26 HG3 PRO 26 53.830 47.277 37.046 175 HD2 PRO 26 HD2 PRO 26 53.503 44.590 37.298 176 HD3 PRO 26 HD3 PRO 26 52.129 45.709 37.504 177 H ALA 27 H ALA 27 54.418 44.022 34.606 178 HA ALA 27 HA ALA 27 55.004 44.146 31.677 179 HB1 ALA 27 HB1 ALA 27 56.935 44.686 33.973 180 HB2 ALA 27 HB2 ALA 27 57.340 44.675 32.240 181 HB3 ALA 27 HB3 ALA 27 56.238 45.903 32.895 182 H VAL 28 H VAL 28 55.514 42.238 30.745 183 HA VAL 28 HA VAL 28 56.529 39.973 32.384 184 HB VAL 28 HB VAL 28 53.915 40.236 32.243 185 HG11 VAL 28 HG11 VAL 28 53.815 40.378 29.730 186 HG12 VAL 28 HG12 VAL 28 54.335 38.684 29.655 187 HG13 VAL 28 HG13 VAL 28 52.806 39.109 30.437 188 HG21 VAL 28 HG21 VAL 28 55.223 37.557 31.711 189 HG22 VAL 28 HG22 VAL 28 55.040 38.344 33.294 190 HG23 VAL 28 HG23 VAL 28 53.606 37.833 32.385 191 H GLY 29 H GLY 29 57.476 38.271 31.300 192 HA2 GLY 29 HA2 GLY 29 56.846 36.793 29.567 193 HA3 GLY 29 HA3 GLY 29 56.933 38.084 28.377 194 H ARG 30 H ARG 30 59.764 38.806 29.534 195 HA ARG 30 HA ARG 30 61.113 36.806 27.736 196 HB2 ARG 30 HB2 ARG 30 62.285 39.446 28.659 197 HB3 ARG 30 HB3 ARG 30 62.838 38.381 27.386 198 HG2 ARG 30 HG2 ARG 30 61.736 39.813 25.993 199 HG3 ARG 30 HG3 ARG 30 60.305 38.885 26.458 200 HD2 ARG 30 HD2 ARG 30 60.287 40.595 28.510 201 HD3 ARG 30 HD3 ARG 30 61.286 41.581 27.438 202 HE ARG 30 HE ARG 30 59.034 40.877 25.902 203 HH11 ARG 30 HH11 ARG 30 59.720 42.792 28.785 204 HH12 ARG 30 HH12 ARG 30 58.113 43.496 28.780 205 HH21 ARG 30 HH21 ARG 30 57.055 41.964 25.959 206 HH22 ARG 30 HH22 ARG 30 56.787 43.174 27.223 207 H HIS 31 H HIS 31 61.010 37.820 31.032 208 HA HIS 31 HA HIS 31 62.948 35.813 31.915 209 HB2 HIS 31 HB2 HIS 31 64.237 37.921 31.472 210 HB3 HIS 31 HB3 HIS 31 63.154 38.792 32.560 211 HD1 HIS 31 HD1 HIS 31 63.848 38.726 35.094 212 HD2 HIS 31 HD2 HIS 31 65.659 35.793 32.677 213 HE1 HIS 31 HE1 HIS 31 65.606 37.572 36.551 214 H GLN 32 H GLN 32 62.701 35.429 34.129 215 HA GLN 32 HA GLN 32 61.679 35.002 36.047 216 HB2 GLN 32 HB2 GLN 32 60.890 37.465 36.022 217 HB3 GLN 32 HB3 GLN 32 59.321 36.805 35.549 218 HG2 GLN 32 HG2 GLN 32 59.276 35.383 37.573 219 HG3 GLN 32 HG3 GLN 32 60.897 35.930 38.009 220 HE21 GLN 32 HE21 GLN 32 59.836 36.499 40.065 221 HE22 GLN 32 HE22 GLN 32 59.124 38.091 40.185 222 H ASP 33 H ASP 33 60.559 33.266 36.576 223 HA ASP 33 HA ASP 33 59.328 31.791 34.377 224 HB2 ASP 33 HB2 ASP 33 59.671 29.860 35.917 225 HB3 ASP 33 HB3 ASP 33 61.139 30.775 35.585 226 H PHE 34 H PHE 34 57.335 30.797 34.306 227 HA PHE 34 HA PHE 34 55.034 31.732 35.437 228 HB2 PHE 34 HB2 PHE 34 54.866 30.160 33.715 229 HB3 PHE 34 HB3 PHE 34 55.792 28.934 34.567 230 HD1 PHE 34 HD1 PHE 34 52.478 30.718 34.553 231 HD2 PHE 34 HD2 PHE 34 54.754 27.398 36.105 232 HE1 PHE 34 HE1 PHE 34 50.410 29.734 35.481 233 HE2 PHE 34 HE2 PHE 34 52.678 26.433 37.060 234 HZ PHE 34 HZ PHE 34 50.502 27.590 36.741 235 H PHE 35 H PHE 35 57.043 29.198 36.988 236 HA PHE 35 HA PHE 35 55.180 28.478 38.979 237 HB2 PHE 35 HB2 PHE 35 58.214 28.366 39.086 238 HB3 PHE 35 HB3 PHE 35 57.115 27.464 40.116 239 HD1 PHE 35 HD1 PHE 35 58.797 27.608 36.883 240 HD2 PHE 35 HD2 PHE 35 55.622 25.687 39.082 241 HE1 PHE 35 HE1 PHE 35 58.752 25.759 35.214 242 HE2 PHE 35 HE2 PHE 35 55.595 23.834 37.427 243 HZ PHE 35 HZ PHE 35 57.173 23.865 35.500 244 H ALA 36 H ALA 36 57.656 31.059 39.023 245 HA ALA 36 HA ALA 36 56.850 32.043 41.656 246 HB1 ALA 36 HB1 ALA 36 58.561 33.192 39.423 247 HB2 ALA 36 HB2 ALA 36 58.383 33.891 41.047 248 HB3 ALA 36 HB3 ALA 36 59.132 32.290 40.850 249 H LEU 37 H LEU 37 56.317 33.079 38.257 250 HA LEU 37 HA LEU 37 55.061 35.558 38.665 251 HB2 LEU 37 HB2 LEU 37 54.822 33.439 36.529 252 HB3 LEU 37 HB3 LEU 37 53.926 34.917 36.380 253 HG LEU 37 HG LEU 37 56.970 34.790 36.544 254 HD11 LEU 37 HD11 LEU 37 55.098 35.246 34.174 255 HD12 LEU 37 HD12 LEU 37 56.081 33.789 34.456 256 HD13 LEU 37 HD13 LEU 37 56.869 35.335 34.144 257 HD21 LEU 37 HD21 LEU 37 55.085 37.090 35.907 258 HD22 LEU 37 HD22 LEU 37 56.857 37.112 35.749 259 HD23 LEU 37 HD23 LEU 37 56.124 36.928 37.346 260 H GLY 38 H GLY 38 53.583 32.342 38.746 261 HA2 GLY 38 HA2 GLY 38 50.879 33.245 38.569 262 HA3 GLY 38 HA3 GLY 38 51.392 31.670 39.210 263 H GLY 39 H GLY 39 52.967 32.954 41.392 264 HA2 GLY 39 HA2 GLY 39 52.847 33.974 43.435 265 HA3 GLY 39 HA3 GLY 39 51.398 34.815 42.885 266 H ASP 40 H ASP 40 49.817 32.383 42.493 267 HA ASP 40 HA ASP 40 49.640 31.020 45.116 268 HB2 ASP 40 HB2 ASP 40 48.247 33.219 45.065 269 HB3 ASP 40 HB3 ASP 40 47.217 32.394 43.901 270 H SER 41 H SER 41 48.692 28.888 44.833 271 HA SER 41 HA SER 41 48.458 27.897 42.116 272 HB2 SER 41 HB2 SER 41 47.639 25.802 43.204 273 HB3 SER 41 HB3 SER 41 49.241 26.373 43.685 274 HG SER 41 HG SER 41 48.487 26.078 45.566 275 H GLN 42 H GLN 42 46.098 29.328 44.308 276 HA GLN 42 HA GLN 42 43.712 28.557 42.836 277 HB2 GLN 42 HB2 GLN 42 44.420 30.989 44.522 278 HB3 GLN 42 HB3 GLN 42 42.794 30.650 43.923 279 HG2 GLN 42 HG2 GLN 42 42.704 28.614 45.298 280 HG3 GLN 42 HG3 GLN 42 44.397 28.864 45.760 281 HE21 GLN 42 HE21 GLN 42 44.975 30.813 46.997 282 HE22 GLN 42 HE22 GLN 42 43.737 31.543 48.025 283 H LEU 43 H LEU 43 46.073 31.226 42.540 284 HA LEU 43 HA LEU 43 44.748 32.498 40.292 285 HB2 LEU 43 HB2 LEU 43 47.530 32.795 41.443 286 HB3 LEU 43 HB3 LEU 43 46.956 33.662 40.029 287 HG LEU 43 HG LEU 43 45.922 33.957 42.871 288 HD11 LEU 43 HD11 LEU 43 48.005 35.171 42.184 289 HD12 LEU 43 HD12 LEU 43 46.640 36.256 42.536 290 HD13 LEU 43 HD13 LEU 43 47.064 35.908 40.850 291 HD21 LEU 43 HD21 LEU 43 44.811 35.083 40.263 292 HD22 LEU 43 HD22 LEU 43 44.496 35.812 41.855 293 HD23 LEU 43 HD23 LEU 43 43.962 34.169 41.570 294 H GLY 44 H GLY 44 47.414 30.122 40.596 295 HA2 GLY 44 HA2 GLY 44 48.006 29.815 37.833 296 HA3 GLY 44 HA3 GLY 44 48.176 28.561 39.072 297 H LEU 45 H LEU 45 45.577 28.035 39.836 298 HA LEU 45 HA LEU 45 44.556 26.471 37.677 299 HB2 LEU 45 HB2 LEU 45 43.466 27.250 40.404 300 HB3 LEU 45 HB3 LEU 45 42.565 26.205 39.314 301 HG LEU 45 HG LEU 45 45.392 25.545 40.241 302 HD11 LEU 45 HD11 LEU 45 43.871 25.643 42.170 303 HD12 LEU 45 HD12 LEU 45 44.325 23.972 41.809 304 HD13 LEU 45 HD13 LEU 45 42.716 24.577 41.339 305 HD21 LEU 45 HD21 LEU 45 44.707 24.366 38.177 306 HD22 LEU 45 HD22 LEU 45 43.211 23.832 38.969 307 HD23 LEU 45 HD23 LEU 45 44.799 23.259 39.542 308 H ARG 46 H ARG 46 43.263 29.615 39.000 309 HA ARG 46 HA ARG 46 41.180 29.649 36.961 310 HB2 ARG 46 HB2 ARG 46 40.625 31.832 37.648 311 HB3 ARG 46 HB3 ARG 46 41.052 30.907 39.091 312 HG2 ARG 46 HG2 ARG 46 43.381 31.929 38.858 313 HG3 ARG 46 HG3 ARG 46 42.719 33.015 37.643 314 HD2 ARG 46 HD2 ARG 46 42.877 34.088 39.799 315 HD3 ARG 46 HD3 ARG 46 41.235 34.029 39.311 316 HE ARG 46 HE ARG 46 41.860 31.706 40.931 317 HH11 ARG 46 HH11 ARG 46 41.288 35.169 41.369 318 HH12 ARG 46 HH12 ARG 46 40.590 34.911 42.948 319 HH21 ARG 46 HH21 ARG 46 40.938 31.505 42.920 320 HH22 ARG 46 HH22 ARG 46 40.689 32.947 43.900 321 H MET 47 H MET 47 44.533 30.830 36.933 322 HA MET 47 HA MET 47 44.329 32.173 34.406 323 HB2 MET 47 HB2 MET 47 46.197 32.538 35.974 324 HB3 MET 47 HB3 MET 47 46.766 30.892 35.691 325 HG2 MET 47 HG2 MET 47 46.437 32.197 33.125 326 HG3 MET 47 HG3 MET 47 47.251 33.312 34.199 327 HE1 MET 47 HE1 MET 47 47.365 29.785 32.480 328 HE2 MET 47 HE2 MET 47 48.981 29.191 32.925 329 HE3 MET 47 HE3 MET 47 47.699 29.252 34.150 330 H LEU 48 H LEU 48 45.220 28.762 35.198 331 HA LEU 48 HA LEU 48 45.555 27.977 32.478 332 HB2 LEU 48 HB2 LEU 48 46.367 26.662 34.362 333 HB3 LEU 48 HB3 LEU 48 44.719 26.410 34.948 334 HG LEU 48 HG LEU 48 44.197 25.073 32.943 335 HD11 LEU 48 HD11 LEU 48 46.065 24.312 31.466 336 HD12 LEU 48 HD12 LEU 48 47.115 25.538 32.220 337 HD13 LEU 48 HD13 LEU 48 45.689 26.024 31.265 338 HD21 LEU 48 HD21 LEU 48 46.744 24.195 34.361 339 HD22 LEU 48 HD22 LEU 48 45.587 23.134 33.519 340 HD23 LEU 48 HD23 LEU 48 45.080 23.996 34.977 341 H ALA 49 H ALA 49 42.596 27.812 34.554 342 HA ALA 49 HA ALA 49 40.873 26.782 32.587 343 HB1 ALA 49 HB1 ALA 49 40.308 28.664 34.918 344 HB2 ALA 49 HB2 ALA 49 39.057 27.844 33.964 345 HB3 ALA 49 HB3 ALA 49 40.212 26.885 34.894 346 H GLN 50 H GLN 50 41.468 30.299 33.266 347 HA GLN 50 HA GLN 50 39.740 31.097 31.068 348 HB2 GLN 50 HB2 GLN 50 41.568 32.663 32.873 349 HB3 GLN 50 HB3 GLN 50 40.727 33.382 31.498 350 HG2 GLN 50 HG2 GLN 50 38.742 31.865 32.897 351 HG3 GLN 50 HG3 GLN 50 39.676 32.707 34.126 352 HE21 GLN 50 HE21 GLN 50 37.881 33.326 30.971 353 HE22 GLN 50 HE22 GLN 50 37.364 34.916 31.508 354 H LEU 51 H LEU 51 43.324 30.711 31.298 355 HA LEU 51 HA LEU 51 43.899 31.699 28.673 356 HB2 LEU 51 HB2 LEU 51 45.611 31.176 30.345 357 HB3 LEU 51 HB3 LEU 51 45.141 29.470 30.334 358 HG LEU 51 HG LEU 51 45.909 29.326 27.949 359 HD11 LEU 51 HD11 LEU 51 45.778 31.688 27.296 360 HD12 LEU 51 HD12 LEU 51 47.432 31.099 27.118 361 HD13 LEU 51 HD13 LEU 51 47.000 32.122 28.513 362 HD21 LEU 51 HD21 LEU 51 48.351 29.421 28.563 363 HD22 LEU 51 HD22 LEU 51 47.328 28.526 29.694 364 HD23 LEU 51 HD23 LEU 51 47.861 30.156 30.118 365 H ARG 52 H ARG 52 42.804 28.474 29.799 366 HA ARG 52 HA ARG 52 42.813 27.293 27.208 367 HB2 ARG 52 HB2 ARG 52 42.927 26.065 29.342 368 HB3 ARG 52 HB3 ARG 52 41.239 26.475 29.674 369 HG2 ARG 52 HG2 ARG 52 40.493 25.341 27.717 370 HG3 ARG 52 HG3 ARG 52 42.144 25.024 27.142 371 HD2 ARG 52 HD2 ARG 52 42.618 23.531 28.988 372 HD3 ARG 52 HD3 ARG 52 41.097 23.946 29.780 373 HE ARG 52 HE ARG 52 39.856 22.781 28.098 374 HH11 ARG 52 HH11 ARG 52 43.296 22.020 27.746 375 HH12 ARG 52 HH12 ARG 52 42.956 20.898 26.446 376 HH21 ARG 52 HH21 ARG 52 39.549 21.081 26.872 377 HH22 ARG 52 HH22 ARG 52 40.867 20.434 25.900 378 H GLU 53 H GLU 53 39.981 28.586 29.028 379 HA GLU 53 HA GLU 53 38.302 28.185 26.680 380 HB2 GLU 53 HB2 GLU 53 36.484 29.065 27.959 381 HB3 GLU 53 HB3 GLU 53 37.407 27.878 28.860 382 HG2 GLU 53 HG2 GLU 53 37.242 29.364 30.546 383 HG3 GLU 53 HG3 GLU 53 38.660 30.020 29.750 384 H ARG 54 H ARG 54 40.220 30.970 27.634 385 HA ARG 54 HA ARG 54 38.951 32.711 25.623 386 HB2 ARG 54 HB2 ARG 54 41.641 32.926 27.041 387 HB3 ARG 54 HB3 ARG 54 40.977 34.167 26.000 388 HG2 ARG 54 HG2 ARG 54 39.382 33.269 28.402 389 HG3 ARG 54 HG3 ARG 54 40.765 34.313 28.633 390 HD2 ARG 54 HD2 ARG 54 38.556 35.499 28.489 391 HD3 ARG 54 HD3 ARG 54 39.825 36.090 27.421 392 HE ARG 54 HE ARG 54 38.498 35.639 25.618 393 HH11 ARG 54 HH11 ARG 54 37.172 33.426 28.147 394 HH12 ARG 54 HH12 ARG 54 35.764 33.213 27.145 395 HH21 ARG 54 HH21 ARG 54 36.859 34.965 24.471 396 HH22 ARG 54 HH22 ARG 54 35.606 33.939 25.210 397 H HIS 55 H HIS 55 42.001 30.881 25.785 398 HA HIS 55 HA HIS 55 42.556 31.732 23.004 399 HB2 HIS 55 HB2 HIS 55 43.985 32.173 25.165 400 HB3 HIS 55 HB3 HIS 55 44.527 30.524 24.942 401 HD1 HIS 55 HD1 HIS 55 45.058 30.428 21.867 402 HD2 HIS 55 HD2 HIS 55 45.933 33.688 24.364 403 HE1 HIS 55 HE1 HIS 55 46.919 31.738 20.703 404 H GLY 56 H GLY 56 41.501 28.833 24.542 405 HA2 GLY 56 HA2 GLY 56 41.277 26.689 23.723 406 HA3 GLY 56 HA3 GLY 56 42.036 27.191 22.197 407 H VAL 57 H VAL 57 43.534 27.584 25.391 408 HA VAL 57 HA VAL 57 45.872 26.077 24.305 409 HB VAL 57 HB VAL 57 45.682 28.688 25.784 410 HG11 VAL 57 HG11 VAL 57 48.170 28.727 25.906 411 HG12 VAL 57 HG12 VAL 57 47.464 27.523 26.987 412 HG13 VAL 57 HG13 VAL 57 48.188 27.007 25.452 413 HG21 VAL 57 HG21 VAL 57 47.206 27.816 23.290 414 HG22 VAL 57 HG22 VAL 57 45.635 28.628 23.281 415 HG23 VAL 57 HG23 VAL 57 47.057 29.473 23.917 416 H ASP 58 H ASP 58 47.078 24.753 25.536 417 HA ASP 58 HA ASP 58 46.231 24.293 28.361 418 HB2 ASP 58 HB2 ASP 58 45.306 22.679 26.507 419 HB3 ASP 58 HB3 ASP 58 46.922 21.983 26.549 420 H LEU 59 H LEU 59 47.805 23.382 29.746 421 HA LEU 59 HA LEU 59 50.503 24.353 28.988 422 HB2 LEU 59 HB2 LEU 59 48.884 25.574 30.559 423 HB3 LEU 59 HB3 LEU 59 49.162 24.278 31.706 424 HG LEU 59 HG LEU 59 51.686 24.883 31.523 425 HD11 LEU 59 HD11 LEU 59 52.026 27.309 30.858 426 HD12 LEU 59 HD12 LEU 59 50.398 27.309 30.175 427 HD13 LEU 59 HD13 LEU 59 51.648 26.244 29.493 428 HD21 LEU 59 HD21 LEU 59 49.710 26.926 32.635 429 HD22 LEU 59 HD22 LEU 59 51.419 26.771 33.103 430 HD23 LEU 59 HD23 LEU 59 50.286 25.465 33.467 431 HA PRO 60 HA PRO 60 51.432 19.925 30.146 432 HB2 PRO 60 HB2 PRO 60 53.304 19.426 28.195 433 HB3 PRO 60 HB3 PRO 60 51.540 19.233 27.964 434 HG2 PRO 60 HG2 PRO 60 53.276 21.613 27.235 435 HG3 PRO 60 HG3 PRO 60 52.075 20.770 26.203 436 HD2 PRO 60 HD2 PRO 60 51.455 23.045 27.539 437 HD3 PRO 60 HD3 PRO 60 50.266 21.714 27.393 438 H LEU 61 H LEU 61 52.998 19.335 31.502 439 HA LEU 61 HA LEU 61 54.615 21.398 32.652 440 HB2 LEU 61 HB2 LEU 61 54.537 18.432 33.283 441 HB3 LEU 61 HB3 LEU 61 55.248 19.695 34.286 442 HG LEU 61 HG LEU 61 52.292 19.334 33.633 443 HD11 LEU 61 HD11 LEU 61 53.823 19.214 36.264 444 HD12 LEU 61 HD12 LEU 61 53.256 17.818 35.327 445 HD13 LEU 61 HD13 LEU 61 52.080 18.940 36.028 446 HD21 LEU 61 HD21 LEU 61 53.623 21.526 35.282 447 HD22 LEU 61 HD22 LEU 61 51.879 21.196 35.226 448 HD23 LEU 61 HD23 LEU 61 52.701 21.747 33.770 449 H ARG 62 H ARG 62 55.411 18.923 30.305 450 HA ARG 62 HA ARG 62 58.279 19.069 30.493 451 HB2 ARG 62 HB2 ARG 62 57.272 17.306 29.216 452 HB3 ARG 62 HB3 ARG 62 56.325 18.435 28.249 453 HG2 ARG 62 HG2 ARG 62 58.153 17.487 26.956 454 HG3 ARG 62 HG3 ARG 62 58.323 19.229 27.105 455 HD2 ARG 62 HD2 ARG 62 59.952 18.786 29.050 456 HD3 ARG 62 HD3 ARG 62 59.899 17.085 28.591 457 HE ARG 62 HE ARG 62 61.168 19.352 27.156 458 HH11 ARG 62 HH11 ARG 62 60.160 15.989 26.681 459 HH12 ARG 62 HH12 ARG 62 61.162 15.912 25.224 460 HH21 ARG 62 HH21 ARG 62 62.237 19.125 25.400 461 HH22 ARG 62 HH22 ARG 62 62.306 17.566 24.540 462 H CYS 63 H CYS 63 56.043 20.880 28.343 463 HA CYS 63 HA CYS 63 58.088 22.614 27.317 464 HB2 CYS 63 HB2 CYS 63 55.099 23.120 27.389 465 HB3 CYS 63 HB3 CYS 63 56.290 23.849 26.306 466 HG CYS 63 HG CYS 63 57.096 21.440 25.290 467 H LEU 64 H LEU 64 55.783 22.921 30.024 468 HA LEU 64 HA LEU 64 56.446 25.563 30.849 469 HB2 LEU 64 HB2 LEU 64 54.545 23.968 31.550 470 HB3 LEU 64 HB3 LEU 64 55.716 23.216 32.628 471 HG LEU 64 HG LEU 64 56.029 25.410 33.796 472 HD11 LEU 64 HD11 LEU 64 54.180 27.116 33.400 473 HD12 LEU 64 HD12 LEU 64 53.817 26.258 31.898 474 HD13 LEU 64 HD13 LEU 64 55.406 27.028 32.138 475 HD21 LEU 64 HD21 LEU 64 53.162 24.388 33.623 476 HD22 LEU 64 HD22 LEU 64 53.867 25.322 34.959 477 HD23 LEU 64 HD23 LEU 64 54.465 23.699 34.624 478 H TYR 65 H TYR 65 58.012 22.429 31.740 479 HA TYR 65 HA TYR 65 59.941 23.629 33.525 480 HB2 TYR 65 HB2 TYR 65 59.829 21.320 33.810 481 HB3 TYR 65 HB3 TYR 65 59.698 21.000 32.082 482 HD1 TYR 65 HD1 TYR 65 62.169 22.380 34.576 483 HD2 TYR 65 HD2 TYR 65 61.550 20.328 30.833 484 HE1 TYR 65 HE1 TYR 65 64.625 22.325 34.199 485 HE2 TYR 65 HE2 TYR 65 64.013 20.268 30.464 486 HH TYR 65 HH TYR 65 66.320 21.665 32.830 487 H GLU 66 H GLU 66 60.119 22.799 29.998 488 HA GLU 66 HA GLU 66 62.889 23.721 30.057 489 HB2 GLU 66 HB2 GLU 66 63.150 23.049 27.833 490 HB3 GLU 66 HB3 GLU 66 62.259 21.810 28.715 491 HG2 GLU 66 HG2 GLU 66 60.160 22.585 27.655 492 HG3 GLU 66 HG3 GLU 66 61.048 23.836 26.783 493 H ALA 67 H ALA 67 59.925 25.333 29.285 494 HA ALA 67 HA ALA 67 61.401 27.838 28.746 495 HB1 ALA 67 HB1 ALA 67 59.869 28.264 26.829 496 HB2 ALA 67 HB2 ALA 67 60.900 26.843 26.563 497 HB3 ALA 67 HB3 ALA 67 59.193 26.640 27.024 498 HA PRO 68 HA PRO 68 57.761 28.453 31.608 499 HB2 PRO 68 HB2 PRO 68 58.989 29.344 33.871 500 HB3 PRO 68 HB3 PRO 68 58.843 27.621 33.480 501 HG2 PRO 68 HG2 PRO 68 61.204 29.463 32.945 502 HG3 PRO 68 HG3 PRO 68 61.221 27.847 33.726 503 HD2 PRO 68 HD2 PRO 68 61.804 28.138 31.089 504 HD3 PRO 68 HD3 PRO 68 60.843 26.750 31.671 505 H THR 69 H THR 69 60.013 30.584 30.171 506 HA THR 69 HA THR 69 58.902 33.058 31.342 507 HB THR 69 HB THR 69 60.401 34.135 29.535 508 HG1 THR 69 HG1 THR 69 61.715 32.989 28.465 509 HG21 THR 69 HG21 THR 69 62.457 33.740 30.863 510 HG22 THR 69 HG22 THR 69 61.660 32.395 31.704 511 HG23 THR 69 HG23 THR 69 61.056 34.052 31.900 512 H VAL 70 H VAL 70 57.299 34.304 30.392 513 HA VAL 70 HA VAL 70 55.496 32.677 29.023 514 HB VAL 70 HB VAL 70 55.064 35.665 29.010 515 HG11 VAL 70 HG11 VAL 70 53.226 33.260 29.387 516 HG12 VAL 70 HG12 VAL 70 52.719 34.955 29.471 517 HG13 VAL 70 HG13 VAL 70 53.313 34.294 27.946 518 HG21 VAL 70 HG21 VAL 70 55.818 35.274 31.261 519 HG22 VAL 70 HG22 VAL 70 54.062 35.328 31.314 520 HG23 VAL 70 HG23 VAL 70 54.909 33.761 31.368 521 H ALA 71 H ALA 71 57.647 35.028 27.477 522 HA ALA 71 HA ALA 71 56.374 35.026 24.876 523 HB1 ALA 71 HB1 ALA 71 58.020 36.740 25.684 524 HB2 ALA 71 HB2 ALA 71 59.287 35.486 25.687 525 HB3 ALA 71 HB3 ALA 71 58.525 35.980 24.161 526 H ARG 72 H ARG 72 58.889 33.066 26.408 527 HA ARG 72 HA ARG 72 59.527 31.470 24.041 528 HB2 ARG 72 HB2 ARG 72 61.029 32.380 25.901 529 HB3 ARG 72 HB3 ARG 72 60.378 31.108 26.940 530 HG2 ARG 72 HG2 ARG 72 61.393 29.400 25.590 531 HG3 ARG 72 HG3 ARG 72 61.749 30.542 24.282 532 HD2 ARG 72 HD2 ARG 72 63.356 31.731 25.604 533 HD3 ARG 72 HD3 ARG 72 62.855 30.962 27.088 534 HE ARG 72 HE ARG 72 64.722 29.968 25.029 535 HH11 ARG 72 HH11 ARG 72 63.101 28.993 27.957 536 HH12 ARG 72 HH12 ARG 72 63.555 27.318 27.769 537 HH21 ARG 72 HH21 ARG 72 65.267 27.843 24.812 538 HH22 ARG 72 HH22 ARG 72 64.993 26.751 26.153 539 H LEU 73 H LEU 73 57.643 31.074 27.001 540 HA LEU 73 HA LEU 73 56.670 28.426 26.556 541 HB2 LEU 73 HB2 LEU 73 56.430 29.836 28.632 542 HB3 LEU 73 HB3 LEU 73 55.233 30.803 27.806 543 HG LEU 73 HG LEU 73 54.647 27.917 27.527 544 HD11 LEU 73 HD11 LEU 73 54.761 29.036 30.340 545 HD12 LEU 73 HD12 LEU 73 55.781 27.748 29.670 546 HD13 LEU 73 HD13 LEU 73 54.046 27.477 29.836 547 HD21 LEU 73 HD21 LEU 73 52.438 28.632 28.311 548 HD22 LEU 73 HD22 LEU 73 53.037 29.742 27.062 549 HD23 LEU 73 HD23 LEU 73 53.095 30.222 28.769 550 H ALA 74 H ALA 74 55.374 31.670 25.505 551 HA ALA 74 HA ALA 74 53.306 30.528 23.906 552 HB1 ALA 74 HB1 ALA 74 53.274 32.838 24.639 553 HB2 ALA 74 HB2 ALA 74 54.724 33.212 23.682 554 HB3 ALA 74 HB3 ALA 74 53.216 32.766 22.859 555 H GLU 75 H GLU 75 56.765 31.167 23.083 556 HA GLU 75 HA GLU 75 56.534 30.483 20.291 557 HB2 GLU 75 HB2 GLU 75 58.854 30.199 22.245 558 HB3 GLU 75 HB3 GLU 75 58.938 29.652 20.580 559 HG2 GLU 75 HG2 GLU 75 58.426 31.974 19.810 560 HG3 GLU 75 HG3 GLU 75 58.499 32.510 21.492 561 H THR 76 H THR 76 57.324 28.383 23.117 562 HA THR 76 HA THR 76 57.356 25.978 21.550 563 HB THR 76 HB THR 76 57.199 24.798 23.775 564 HG1 THR 76 HG1 THR 76 57.563 27.354 24.876 565 HG21 THR 76 HG21 THR 76 59.359 25.441 22.751 566 HG22 THR 76 HG22 THR 76 59.417 25.538 24.522 567 HG23 THR 76 HG23 THR 76 59.278 27.025 23.550 568 H ILE 77 H ILE 77 54.750 27.213 23.716 569 HA ILE 77 HA ILE 77 52.992 25.047 23.097 570 HB ILE 77 HB ILE 77 52.400 27.784 24.267 571 HG12 ILE 77 HG12 ILE 77 53.961 26.502 25.667 572 HG13 ILE 77 HG13 ILE 77 52.395 26.638 26.436 573 HG21 ILE 77 HG21 ILE 77 50.622 25.321 24.088 574 HG22 ILE 77 HG22 ILE 77 50.363 26.619 25.250 575 HG23 ILE 77 HG23 ILE 77 50.275 26.962 23.517 576 HD11 ILE 77 HD11 ILE 77 53.561 24.173 25.071 577 HD12 ILE 77 HD12 ILE 77 53.277 24.432 26.799 578 HD13 ILE 77 HD13 ILE 77 51.899 24.270 25.701 579 H VAL 78 H VAL 78 53.393 28.192 21.383 580 HA VAL 78 HA VAL 78 51.151 27.527 19.592 581 HB VAL 78 HB VAL 78 53.283 29.663 19.312 582 HG11 VAL 78 HG11 VAL 78 50.731 29.180 17.718 583 HG12 VAL 78 HG12 VAL 78 51.713 30.655 17.651 584 HG13 VAL 78 HG13 VAL 78 52.399 29.130 17.099 585 HG21 VAL 78 HG21 VAL 78 50.333 29.859 20.108 586 HG22 VAL 78 HG22 VAL 78 51.688 30.005 21.242 587 HG23 VAL 78 HG23 VAL 78 51.481 31.205 19.965 588 H ARG 79 H ARG 79 54.787 27.293 19.300 589 HA ARG 79 HA ARG 79 54.459 26.359 16.571 590 HB2 ARG 79 HB2 ARG 79 56.680 26.574 16.288 591 HB3 ARG 79 HB3 ARG 79 56.371 27.745 17.541 592 HG2 ARG 79 HG2 ARG 79 58.348 26.781 18.216 593 HG3 ARG 79 HG3 ARG 79 57.193 25.888 19.209 594 HD2 ARG 79 HD2 ARG 79 57.463 23.904 17.937 595 HD3 ARG 79 HD3 ARG 79 58.050 24.787 16.532 596 HE ARG 79 HE ARG 79 59.706 24.637 19.037 597 HH11 ARG 79 HH11 ARG 79 59.497 23.751 15.620 598 HH12 ARG 79 HH12 ARG 79 61.250 23.759 15.488 599 HH21 ARG 79 HH21 ARG 79 61.840 24.434 18.751 600 HH22 ARG 79 HH22 ARG 79 62.483 24.093 17.137 601 H LEU 80 H LEU 80 54.780 24.601 19.596 602 HA LEU 80 HA LEU 80 55.298 22.057 18.222 603 HB2 LEU 80 HB2 LEU 80 54.466 22.662 21.084 604 HB3 LEU 80 HB3 LEU 80 54.922 21.076 20.485 605 HG LEU 80 HG LEU 80 56.814 23.477 20.421 606 HD11 LEU 80 HD11 LEU 80 57.909 22.486 22.351 607 HD12 LEU 80 HD12 LEU 80 56.709 21.177 22.408 608 HD13 LEU 80 HD13 LEU 80 56.221 22.852 22.742 609 HD21 LEU 80 HD21 LEU 80 57.374 21.705 18.792 610 HD22 LEU 80 HD22 LEU 80 57.312 20.492 20.088 611 HD23 LEU 80 HD23 LEU 80 58.546 21.774 20.110 612 H ALA 81 H ALA 81 52.444 23.905 19.000 613 HA ALA 81 HA ALA 81 50.539 21.756 18.673 614 HB1 ALA 81 HB1 ALA 81 50.252 24.768 18.274 615 HB2 ALA 81 HB2 ALA 81 48.927 23.601 18.379 616 HB3 ALA 81 HB3 ALA 81 49.962 23.886 19.787 617 H ALA 82 H ALA 82 49.601 20.972 16.820 618 HA ALA 82 HA ALA 82 50.940 21.659 14.282 619 HB1 ALA 82 HB1 ALA 82 50.936 19.397 14.644 620 HB2 ALA 82 HB2 ALA 82 49.242 19.333 15.133 621 HB3 ALA 82 HB3 ALA 82 49.671 19.665 13.435 622 HA PRO 83 HA PRO 83 46.889 23.191 12.614 623 HB2 PRO 83 HB2 PRO 83 44.429 22.392 13.419 624 HB3 PRO 83 HB3 PRO 83 45.498 21.319 12.474 625 HG2 PRO 83 HG2 PRO 83 45.125 21.386 15.491 626 HG3 PRO 83 HG3 PRO 83 45.004 19.969 14.398 627 HD2 PRO 83 HD2 PRO 83 47.304 20.608 15.728 628 HD3 PRO 83 HD3 PRO 83 47.305 19.867 14.091 629 H ALA 84 H ALA 84 45.680 25.108 12.950 630 HA ALA 84 HA ALA 84 44.826 25.825 15.637 631 HB1 ALA 84 HB1 ALA 84 47.162 26.723 15.513 632 HB2 ALA 84 HB2 ALA 84 46.682 27.695 14.101 633 HB3 ALA 84 HB3 ALA 84 45.950 28.004 15.691 634 HA PRO 85 HA PRO 85 41.831 27.486 12.495 635 HB2 PRO 85 HB2 PRO 85 39.916 25.594 12.422 636 HB3 PRO 85 HB3 PRO 85 41.439 25.393 11.496 637 HG2 PRO 85 HG2 PRO 85 40.749 24.223 14.202 638 HG3 PRO 85 HG3 PRO 85 41.444 23.381 12.780 639 HD2 PRO 85 HD2 PRO 85 42.953 24.382 14.876 640 HD3 PRO 85 HD3 PRO 85 43.559 24.259 13.200 641 H SER 86 H SER 86 39.779 28.465 13.111 642 HA SER 86 HA SER 86 39.317 28.910 15.911 643 HB2 SER 86 HB2 SER 86 37.572 29.373 13.470 644 HB3 SER 86 HB3 SER 86 37.105 29.834 15.120 645 HG SER 86 HG SER 86 38.114 31.586 14.261 646 H GLY 87 H GLY 87 37.765 28.127 17.311 647 HA2 GLY 87 HA2 GLY 87 35.670 26.351 16.920 648 HA3 GLY 87 HA3 GLY 87 37.082 25.306 17.022 649 H ASP 88 H ASP 88 38.251 27.380 19.054 650 HA ASP 88 HA ASP 88 37.327 25.928 21.384 651 HB2 ASP 88 HB2 ASP 88 39.249 28.276 21.193 652 HB3 ASP 88 HB3 ASP 88 39.033 27.201 22.574 653 H GLN 89 H GLN 89 36.206 26.660 23.190 654 HA GLN 89 HA GLN 89 34.618 29.157 22.823 655 HB2 GLN 89 HB2 GLN 89 32.559 27.802 23.236 656 HB3 GLN 89 HB3 GLN 89 33.385 27.555 21.710 657 HG2 GLN 89 HG2 GLN 89 32.601 25.456 22.389 658 HG3 GLN 89 HG3 GLN 89 34.338 25.402 22.589 659 HE21 GLN 89 HE21 GLN 89 35.176 25.157 24.760 660 HE22 GLN 89 HE22 GLN 89 34.104 24.803 26.106 661 H ASP 90 H ASP 90 33.204 29.734 24.581 662 HA ASP 90 HA ASP 90 34.882 30.181 26.852 663 HB2 ASP 90 HB2 ASP 90 31.916 30.795 26.660 664 HB3 ASP 90 HB3 ASP 90 33.089 31.524 27.745 665 H ASP 91 H ASP 91 34.611 29.715 29.007 666 HA ASP 91 HA ASP 91 32.765 27.493 29.802 667 HB2 ASP 91 HB2 ASP 91 35.272 26.901 29.563 668 HB3 ASP 91 HB3 ASP 91 35.526 27.912 30.986 669 H ALA 92 H ALA 92 34.120 30.648 30.488 670 HA ALA 92 HA ALA 92 32.346 30.916 32.880 671 HB1 ALA 92 HB1 ALA 92 34.730 32.596 32.004 672 HB2 ALA 92 HB2 ALA 92 33.718 32.883 33.436 673 HB3 ALA 92 HB3 ALA 92 34.711 31.415 33.332 674 H SER 93 H SER 93 30.793 32.537 32.908 675 HA SER 93 HA SER 93 29.805 33.420 30.309 676 HB2 SER 93 HB2 SER 93 28.768 34.004 33.099 677 HB3 SER 93 HB3 SER 93 27.902 34.260 31.567 678 HG SER 93 HG SER 93 27.540 32.244 32.844 679 H GLU 94 H GLU 94 29.195 35.608 29.795 680 HA GLU 94 HA GLU 94 31.076 37.636 30.901 681 HB2 GLU 94 HB2 GLU 94 31.382 38.520 28.661 682 HB3 GLU 94 HB3 GLU 94 31.943 36.854 28.812 683 HG2 GLU 94 HG2 GLU 94 29.853 36.055 27.707 684 HG3 GLU 94 HG3 GLU 94 29.328 37.738 27.521 685 H TYR 95 H TYR 95 30.518 39.851 30.685 686 HA TYR 95 HA TYR 95 27.579 40.394 30.709 687 HB2 TYR 95 HB2 TYR 95 29.538 41.030 32.944 688 HB3 TYR 95 HB3 TYR 95 27.833 41.466 32.905 689 HD1 TYR 95 HD1 TYR 95 26.059 39.696 33.050 690 HD2 TYR 95 HD2 TYR 95 30.250 38.781 33.534 691 HE1 TYR 95 HE1 TYR 95 25.466 37.456 33.932 692 HE2 TYR 95 HE2 TYR 95 29.646 36.509 34.385 693 HH TYR 95 HH TYR 95 26.240 35.441 34.677 694 H GLU 96 H GLU 96 26.950 42.544 30.466 695 HA GLU 96 HA GLU 96 29.028 44.492 29.513 696 HB2 GLU 96 HB2 GLU 96 27.848 43.483 27.652 697 HB3 GLU 96 HB3 GLU 96 26.293 43.767 28.433 698 HG2 GLU 96 HG2 GLU 96 26.501 45.287 26.644 699 HG3 GLU 96 HG3 GLU 96 26.564 46.209 28.132 700 H GLU 97 H GLU 97 28.731 46.628 29.983 701 HA GLU 97 HA GLU 97 26.231 47.453 31.416 702 HB2 GLU 97 HB2 GLU 97 29.014 48.523 32.020 703 HB3 GLU 97 HB3 GLU 97 27.494 49.205 32.576 704 HG2 GLU 97 HG2 GLU 97 28.010 48.005 34.421 705 HG3 GLU 97 HG3 GLU 97 27.054 46.808 33.574 706 H GLY 98 H GLY 98 28.410 47.982 28.754 707 HA2 GLY 98 HA2 GLY 98 28.089 49.241 26.870 708 HA3 GLY 98 HA3 GLY 98 26.500 49.706 27.484 709 H VAL 99 H VAL 99 29.540 50.397 29.176 710 HA VAL 99 HA VAL 99 30.537 52.286 29.867 711 HB VAL 99 HB VAL 99 29.898 53.413 27.133 712 HG11 VAL 99 HG11 VAL 99 32.145 53.987 29.125 713 HG12 VAL 99 HG12 VAL 99 32.044 54.623 27.469 714 HG13 VAL 99 HG13 VAL 99 30.847 55.109 28.661 715 HG21 VAL 99 HG21 VAL 99 32.132 52.468 26.528 716 HG22 VAL 99 HG22 VAL 99 32.208 51.656 28.105 717 HG23 VAL 99 HG23 VAL 99 30.972 51.205 26.910 718 H ILE 100 H ILE 100 28.806 52.343 31.435 719 HA ILE 100 HA ILE 100 27.478 54.977 31.458 720 HB ILE 100 HB ILE 100 25.817 53.351 30.587 721 HG12 ILE 100 HG12 ILE 100 25.039 54.416 33.332 722 HG13 ILE 100 HG13 ILE 100 25.207 55.426 31.899 723 HG21 ILE 100 HG21 ILE 100 25.837 52.117 33.379 724 HG22 ILE 100 HG22 ILE 100 24.876 51.630 31.977 725 HG23 ILE 100 HG23 ILE 100 26.627 51.383 31.976 726 HD11 ILE 100 HD11 ILE 100 22.874 54.909 32.215 727 HD12 ILE 100 HD12 ILE 100 23.440 54.067 30.757 728 HD13 ILE 100 HD13 ILE 100 23.198 53.170 32.277 729 H ARG 101 H ARG 101 27.289 55.925 33.441 730 HA ARG 101 HA ARG 101 28.855 54.626 35.623 731 HB2 ARG 101 HB2 ARG 101 28.209 57.547 35.104 732 HB3 ARG 101 HB3 ARG 101 29.146 56.923 36.472 733 HG2 ARG 101 HG2 ARG 101 30.783 55.908 34.869 734 HG3 ARG 101 HG3 ARG 101 29.873 56.593 33.520 735 HD2 ARG 101 HD2 ARG 101 31.748 58.016 33.890 736 HD3 ARG 101 HD3 ARG 101 30.303 58.882 34.404 737 HE ARG 101 HE ARG 101 31.015 58.808 36.628 738 HH11 ARG 101 HH11 ARG 101 33.138 56.615 34.868 739 HH12 ARG 101 HH12 ARG 101 34.269 56.558 36.190 740 HH21 ARG 101 HH21 ARG 101 32.580 58.851 38.121 741 HH22 ARG 101 HH22 ARG 101 34.013 57.848 37.939 Start of MODEL 13 1 H GLY 1 H1 GLY 1 53.239 63.605 41.336 2 HA2 GLY 1 HA2 GLY 1 51.047 61.893 42.309 3 HA3 GLY 1 HA3 GLY 1 51.127 62.743 40.750 4 H ALA 2 H ALA 2 51.474 61.323 39.145 5 HA ALA 2 HA ALA 2 52.214 59.641 37.902 6 HB1 ALA 2 HB1 ALA 2 54.603 59.269 37.808 7 HB2 ALA 2 HB2 ALA 2 54.267 60.987 38.090 8 HB3 ALA 2 HB3 ALA 2 54.813 59.955 39.431 9 H ALA 3 H ALA 3 50.938 58.776 40.534 10 HA ALA 3 HA ALA 3 52.147 56.175 41.106 11 HB1 ALA 3 HB1 ALA 3 50.211 55.907 42.589 12 HB2 ALA 3 HB2 ALA 3 50.975 57.488 42.834 13 HB3 ALA 3 HB3 ALA 3 49.466 57.373 41.908 14 H ALA 4 H ALA 4 51.583 54.213 40.298 15 HA ALA 4 HA ALA 4 51.090 52.800 38.581 16 HB1 ALA 4 HB1 ALA 4 48.261 53.796 39.086 17 HB2 ALA 4 HB2 ALA 4 48.759 52.198 38.483 18 HB3 ALA 4 HB3 ALA 4 49.162 52.677 40.130 19 H GLY 5 H GLY 5 48.645 53.303 36.727 20 HA2 GLY 5 HA2 GLY 5 48.075 54.444 34.821 21 HA3 GLY 5 HA3 GLY 5 49.245 55.704 35.225 22 H VAL 6 H VAL 6 50.346 52.353 34.932 23 HA VAL 6 HA VAL 6 51.875 53.029 32.491 24 HB VAL 6 HB VAL 6 51.885 50.468 34.112 25 HG11 VAL 6 HG11 VAL 6 52.725 50.121 31.828 26 HG12 VAL 6 HG12 VAL 6 53.765 51.561 31.962 27 HG13 VAL 6 HG13 VAL 6 54.085 50.127 32.951 28 HG21 VAL 6 HG21 VAL 6 53.761 52.877 34.188 29 HG22 VAL 6 HG22 VAL 6 52.697 52.333 35.503 30 HG23 VAL 6 HG23 VAL 6 54.051 51.324 35.005 31 H SER 7 H SER 7 51.281 52.522 30.510 32 HA SER 7 HA SER 7 48.877 50.863 30.014 33 HB2 SER 7 HB2 SER 7 48.854 51.833 27.834 34 HB3 SER 7 HB3 SER 7 48.994 53.107 29.052 35 HG SER 7 HG SER 7 51.241 53.227 28.566 36 H ALA 8 H ALA 8 48.878 49.369 28.154 37 HA ALA 8 HA ALA 8 51.014 47.451 28.248 38 HB1 ALA 8 HB1 ALA 8 49.747 46.335 26.479 39 HB2 ALA 8 HB2 ALA 8 48.662 46.877 27.771 40 HB3 ALA 8 HB3 ALA 8 48.751 47.786 26.243 41 H ALA 9 H ALA 9 52.670 47.044 26.840 42 HA ALA 9 HA ALA 9 53.448 49.262 24.995 43 HB1 ALA 9 HB1 ALA 9 55.759 48.563 25.565 44 HB2 ALA 9 HB2 ALA 9 54.827 49.142 26.963 45 HB3 ALA 9 HB3 ALA 9 55.110 47.402 26.728 46 H GLY 10 H GLY 10 53.886 48.900 22.955 47 HA2 GLY 10 HA2 GLY 10 54.245 47.863 20.929 48 HA3 GLY 10 HA3 GLY 10 55.084 46.613 21.837 49 H ILE 11 H ILE 11 54.421 44.863 20.831 50 HA ILE 11 HA ILE 11 51.647 44.019 21.378 51 HB ILE 11 HB ILE 11 51.864 44.279 18.933 52 HG12 ILE 11 HG12 ILE 11 51.072 42.104 18.205 53 HG13 ILE 11 HG13 ILE 11 51.684 41.325 19.656 54 HG21 ILE 11 HG21 ILE 11 53.318 42.827 17.601 55 HG22 ILE 11 HG22 ILE 11 54.291 43.833 18.679 56 HG23 ILE 11 HG23 ILE 11 54.021 42.122 19.068 57 HD11 ILE 11 HD11 ILE 11 49.237 41.697 19.726 58 HD12 ILE 11 HD12 ILE 11 50.030 42.573 21.033 59 HD13 ILE 11 HD13 ILE 11 49.488 43.448 19.582 60 H GLU 12 H GLU 12 51.477 41.784 22.022 61 HA GLU 12 HA GLU 12 53.972 40.424 22.755 62 HB2 GLU 12 HB2 GLU 12 53.464 40.239 25.075 63 HB3 GLU 12 HB3 GLU 12 53.407 41.944 24.651 64 HG2 GLU 12 HG2 GLU 12 50.876 41.724 24.475 65 HG3 GLU 12 HG3 GLU 12 51.032 40.097 25.137 66 HA PRO 13 HA PRO 13 51.701 36.746 21.789 67 HB2 PRO 13 HB2 PRO 13 52.763 35.524 24.327 68 HB3 PRO 13 HB3 PRO 13 52.788 34.872 22.660 69 HG2 PRO 13 HG2 PRO 13 55.030 35.954 23.734 70 HG3 PRO 13 HG3 PRO 13 54.577 36.323 22.035 71 HD2 PRO 13 HD2 PRO 13 54.109 38.004 24.509 72 HD3 PRO 13 HD3 PRO 13 54.755 38.487 22.908 73 H ASP 14 H ASP 14 49.649 35.992 22.146 74 HA ASP 14 HA ASP 14 47.934 37.444 23.760 75 HB2 ASP 14 HB2 ASP 14 47.576 34.664 22.588 76 HB3 ASP 14 HB3 ASP 14 46.253 35.680 23.178 77 H LEU 15 H LEU 15 49.599 34.485 24.698 78 HA LEU 15 HA LEU 15 48.069 33.909 27.079 79 HB2 LEU 15 HB2 LEU 15 50.948 33.240 26.308 80 HB3 LEU 15 HB3 LEU 15 50.143 32.694 27.770 81 HG LEU 15 HG LEU 15 48.410 31.534 26.351 82 HD11 LEU 15 HD11 LEU 15 48.654 32.563 24.162 83 HD12 LEU 15 HD12 LEU 15 49.150 30.886 24.034 84 HD13 LEU 15 HD13 LEU 15 50.390 32.152 24.111 85 HD21 LEU 15 HD21 LEU 15 50.262 30.341 27.429 86 HD22 LEU 15 HD22 LEU 15 51.323 30.688 26.047 87 HD23 LEU 15 HD23 LEU 15 49.911 29.624 25.854 88 H THR 16 H THR 16 51.116 35.823 26.587 89 HA THR 16 HA THR 16 51.239 36.630 29.343 90 HB THR 16 HB THR 16 52.993 38.044 28.875 91 HG1 THR 16 HG1 THR 16 52.391 39.371 27.244 92 HG21 THR 16 HG21 THR 16 54.546 36.747 27.660 93 HG22 THR 16 HG22 THR 16 53.307 36.106 26.564 94 HG23 THR 16 HG23 THR 16 53.361 35.569 28.248 95 H ALA 17 H ALA 17 49.623 38.081 26.516 96 HA ALA 17 HA ALA 17 48.749 40.476 27.768 97 HB1 ALA 17 HB1 ALA 17 47.377 38.812 25.619 98 HB2 ALA 17 HB2 ALA 17 47.039 40.505 26.004 99 HB3 ALA 17 HB3 ALA 17 48.625 40.045 25.355 100 H ILE 18 H ILE 18 46.970 37.334 27.520 101 HA ILE 18 HA ILE 18 44.774 38.105 29.196 102 HB ILE 18 HB ILE 18 45.961 35.412 28.459 103 HG12 ILE 18 HG12 ILE 18 43.355 36.742 27.551 104 HG13 ILE 18 HG13 ILE 18 44.866 36.950 26.682 105 HG21 ILE 18 HG21 ILE 18 44.777 35.052 30.550 106 HG22 ILE 18 HG22 ILE 18 43.372 35.976 29.970 107 HG23 ILE 18 HG23 ILE 18 43.793 34.406 29.251 108 HD11 ILE 18 HD11 ILE 18 43.611 35.254 25.569 109 HD12 ILE 18 HD12 ILE 18 45.009 34.483 26.338 110 HD13 ILE 18 HD13 ILE 18 43.386 34.325 27.058 111 H TRP 19 H TRP 19 47.987 36.741 30.016 112 HA TRP 19 HA TRP 19 47.231 36.416 32.796 113 HB2 TRP 19 HB2 TRP 19 49.885 36.281 31.365 114 HB3 TRP 19 HB3 TRP 19 49.699 36.026 33.090 115 HD1 TRP 19 HD1 TRP 19 46.822 34.362 32.604 116 HE1 TRP 19 HE1 TRP 19 46.906 31.947 31.790 117 HE3 TRP 19 HE3 TRP 19 51.556 34.329 30.662 118 HZ2 TRP 19 HZ2 TRP 19 48.855 30.146 30.674 119 HZ3 TRP 19 HZ3 TRP 19 52.498 32.224 29.709 120 HH2 TRP 19 HH2 TRP 19 51.170 30.132 29.753 121 H GLN 20 H GLN 20 49.051 39.071 31.130 122 HA GLN 20 HA GLN 20 49.280 40.490 33.622 123 HB2 GLN 20 HB2 GLN 20 49.833 42.497 32.312 124 HB3 GLN 20 HB3 GLN 20 50.766 41.094 31.875 125 HG2 GLN 20 HG2 GLN 20 50.361 41.730 29.767 126 HG3 GLN 20 HG3 GLN 20 48.925 40.811 30.005 127 HE21 GLN 20 HE21 GLN 20 47.010 41.772 29.546 128 HE22 GLN 20 HE22 GLN 20 46.803 43.523 29.481 129 H ALA 21 H ALA 21 46.585 40.200 31.325 130 HA ALA 21 HA ALA 21 44.989 42.273 32.560 131 HB1 ALA 21 HB1 ALA 21 44.593 41.431 30.292 132 HB2 ALA 21 HB2 ALA 21 44.206 39.821 30.935 133 HB3 ALA 21 HB3 ALA 21 43.167 41.200 31.316 134 H LEU 22 H LEU 22 45.272 38.725 33.251 135 HA LEU 22 HA LEU 22 43.207 38.812 35.304 136 HB2 LEU 22 HB2 LEU 22 45.293 36.712 34.610 137 HB3 LEU 22 HB3 LEU 22 44.080 36.531 35.827 138 HG LEU 22 HG LEU 22 43.204 37.219 33.003 139 HD11 LEU 22 HD11 LEU 22 44.594 35.147 32.912 140 HD12 LEU 22 HD12 LEU 22 42.891 34.888 32.499 141 HD13 LEU 22 HD13 LEU 22 43.486 34.400 34.093 142 HD21 LEU 22 HD21 LEU 22 41.826 35.726 35.287 143 HD22 LEU 22 HD22 LEU 22 41.128 36.108 33.702 144 HD23 LEU 22 HD23 LEU 22 41.523 37.415 34.822 145 H PHE 23 H PHE 23 46.766 38.883 35.401 146 HA PHE 23 HA PHE 23 46.776 38.958 38.333 147 HB2 PHE 23 HB2 PHE 23 48.963 39.106 36.267 148 HB3 PHE 23 HB3 PHE 23 49.248 38.972 38.008 149 HD1 PHE 23 HD1 PHE 23 49.869 37.198 35.323 150 HD2 PHE 23 HD2 PHE 23 47.359 36.821 38.801 151 HE1 PHE 23 HE1 PHE 23 49.889 34.728 35.062 152 HE2 PHE 23 HE2 PHE 23 47.381 34.354 38.526 153 HZ PHE 23 HZ PHE 23 48.626 33.303 36.658 154 H ALA 24 H ALA 24 46.273 41.319 36.034 155 HA ALA 24 HA ALA 24 46.118 43.538 36.044 156 HB1 ALA 24 HB1 ALA 24 45.726 43.045 39.003 157 HB2 ALA 24 HB2 ALA 24 45.118 44.442 38.094 158 HB3 ALA 24 HB3 ALA 24 44.519 42.821 37.723 159 H LEU 25 H LEU 25 48.974 42.563 36.772 160 HA LEU 25 HA LEU 25 50.223 44.943 37.862 161 HB2 LEU 25 HB2 LEU 25 52.263 43.760 37.642 162 HB3 LEU 25 HB3 LEU 25 51.069 42.626 38.234 163 HG LEU 25 HG LEU 25 52.111 42.809 35.359 164 HD11 LEU 25 HD11 LEU 25 53.136 40.633 35.853 165 HD12 LEU 25 HD12 LEU 25 52.546 40.718 37.528 166 HD13 LEU 25 HD13 LEU 25 53.747 41.890 36.934 167 HD21 LEU 25 HD21 LEU 25 50.955 40.539 35.156 168 HD22 LEU 25 HD22 LEU 25 49.886 41.941 35.197 169 HD23 LEU 25 HD23 LEU 25 50.123 40.942 36.664 170 HA PRO 26 HA PRO 26 51.040 47.386 34.256 171 HB2 PRO 26 HB2 PRO 26 53.958 47.100 35.047 172 HB3 PRO 26 HB3 PRO 26 53.112 48.561 34.457 173 HG2 PRO 26 HG2 PRO 26 53.481 48.255 37.090 174 HG3 PRO 26 HG3 PRO 26 51.833 48.683 36.514 175 HD2 PRO 26 HD2 PRO 26 52.906 45.958 37.282 176 HD3 PRO 26 HD3 PRO 26 51.356 46.728 37.725 177 H ALA 27 H ALA 27 53.463 44.728 34.489 178 HA ALA 27 HA ALA 27 52.714 43.708 31.856 179 HB1 ALA 27 HB1 ALA 27 54.376 45.450 31.223 180 HB2 ALA 27 HB2 ALA 27 55.555 44.736 32.340 181 HB3 ALA 27 HB3 ALA 27 55.006 43.827 30.915 182 H VAL 28 H VAL 28 53.392 41.523 31.554 183 HA VAL 28 HA VAL 28 54.614 40.198 33.953 184 HB VAL 28 HB VAL 28 52.211 39.682 33.536 185 HG11 VAL 28 HG11 VAL 28 53.165 38.041 31.171 186 HG12 VAL 28 HG12 VAL 28 51.519 38.167 31.815 187 HG13 VAL 28 HG13 VAL 28 52.276 39.562 31.028 188 HG21 VAL 28 HG21 VAL 28 54.118 37.326 33.375 189 HG22 VAL 28 HG22 VAL 28 53.649 38.203 34.853 190 HG23 VAL 28 HG23 VAL 28 52.438 37.287 33.946 191 H GLY 29 H GLY 29 56.467 39.023 33.680 192 HA2 GLY 29 HA2 GLY 29 57.461 37.735 31.416 193 HA3 GLY 29 HA3 GLY 29 57.884 39.433 31.205 194 H ARG 30 H ARG 30 60.002 39.435 31.521 195 HA ARG 30 HA ARG 30 62.107 39.217 32.373 196 HB2 ARG 30 HB2 ARG 30 60.797 38.853 35.087 197 HB3 ARG 30 HB3 ARG 30 62.463 39.290 34.788 198 HG2 ARG 30 HG2 ARG 30 60.050 41.034 34.102 199 HG3 ARG 30 HG3 ARG 30 61.082 41.171 35.511 200 HD2 ARG 30 HD2 ARG 30 61.868 42.823 34.136 201 HD3 ARG 30 HD3 ARG 30 63.055 41.545 33.937 202 HE ARG 30 HE ARG 30 61.416 41.072 31.800 203 HH11 ARG 30 HH11 ARG 30 62.637 44.214 32.828 204 HH12 ARG 30 HH12 ARG 30 63.010 44.638 31.161 205 HH21 ARG 30 HH21 ARG 30 61.737 41.803 29.809 206 HH22 ARG 30 HH22 ARG 30 62.401 43.409 29.523 207 H HIS 31 H HIS 31 63.529 37.620 33.882 208 HA HIS 31 HA HIS 31 63.280 35.038 32.665 209 HB2 HIS 31 HB2 HIS 31 65.293 34.540 33.600 210 HB3 HIS 31 HB3 HIS 31 65.383 36.283 33.479 211 HD1 HIS 31 HD1 HIS 31 66.452 33.801 35.733 212 HD2 HIS 31 HD2 HIS 31 64.178 37.320 36.174 213 HE1 HIS 31 HE1 HIS 31 66.641 34.477 38.185 214 H GLN 32 H GLN 32 61.348 36.172 34.990 215 HA GLN 32 HA GLN 32 61.400 34.186 37.041 216 HB2 GLN 32 HB2 GLN 32 59.318 36.230 36.181 217 HB3 GLN 32 HB3 GLN 32 59.201 35.238 37.649 218 HG2 GLN 32 HG2 GLN 32 61.420 36.294 38.374 219 HG3 GLN 32 HG3 GLN 32 61.230 37.427 37.029 220 HE21 GLN 32 HE21 GLN 32 59.627 36.185 39.975 221 HE22 GLN 32 HE22 GLN 32 58.657 37.616 40.283 222 H ASP 33 H ASP 33 60.141 32.406 37.341 223 HA ASP 33 HA ASP 33 59.106 31.070 34.980 224 HB2 ASP 33 HB2 ASP 33 59.002 30.179 37.887 225 HB3 ASP 33 HB3 ASP 33 58.896 29.156 36.460 226 H PHE 34 H PHE 34 56.958 30.567 34.477 227 HA PHE 34 HA PHE 34 54.860 32.193 35.207 228 HB2 PHE 34 HB2 PHE 34 54.726 30.879 33.278 229 HB3 PHE 34 HB3 PHE 34 54.942 29.358 34.140 230 HD1 PHE 34 HD1 PHE 34 52.542 32.248 33.776 231 HD2 PHE 34 HD2 PHE 34 53.041 28.080 34.767 232 HE1 PHE 34 HE1 PHE 34 50.081 31.980 33.900 233 HE2 PHE 34 HE2 PHE 34 50.575 27.823 34.898 234 HZ PHE 34 HZ PHE 34 49.092 29.770 34.471 235 H PHE 35 H PHE 35 55.655 29.143 36.897 236 HA PHE 35 HA PHE 35 53.415 29.020 38.629 237 HB2 PHE 35 HB2 PHE 35 55.072 27.238 38.130 238 HB3 PHE 35 HB3 PHE 35 56.296 28.116 39.030 239 HD1 PHE 35 HD1 PHE 35 56.297 28.120 41.487 240 HD2 PHE 35 HD2 PHE 35 53.229 26.061 39.260 241 HE1 PHE 35 HE1 PHE 35 55.666 26.852 43.525 242 HE2 PHE 35 HE2 PHE 35 52.606 24.788 41.305 243 HZ PHE 35 HZ PHE 35 53.840 25.175 43.430 244 H ALA 36 H ALA 36 56.313 31.030 38.874 245 HA ALA 36 HA ALA 36 55.632 31.987 41.600 246 HB1 ALA 36 HB1 ALA 36 57.975 31.456 41.055 247 HB2 ALA 36 HB2 ALA 36 57.932 32.615 39.703 248 HB3 ALA 36 HB3 ALA 36 57.774 33.193 41.373 249 H LEU 37 H LEU 37 55.732 33.115 38.210 250 HA LEU 37 HA LEU 37 54.991 35.834 38.650 251 HB2 LEU 37 HB2 LEU 37 54.734 33.910 36.344 252 HB3 LEU 37 HB3 LEU 37 54.074 35.519 36.207 253 HG LEU 37 HG LEU 37 57.000 34.929 36.834 254 HD11 LEU 37 HD11 LEU 37 57.372 35.682 34.502 255 HD12 LEU 37 HD12 LEU 37 55.619 35.733 34.238 256 HD13 LEU 37 HD13 LEU 37 56.434 34.187 34.589 257 HD21 LEU 37 HD21 LEU 37 56.400 37.142 37.670 258 HD22 LEU 37 HD22 LEU 37 55.516 37.517 36.174 259 HD23 LEU 37 HD23 LEU 37 57.279 37.355 36.160 260 H GLY 38 H GLY 38 52.981 32.914 38.525 261 HA2 GLY 38 HA2 GLY 38 50.475 34.347 38.500 262 HA3 GLY 38 HA3 GLY 38 50.706 32.652 38.950 263 H GLY 39 H GLY 39 52.732 33.998 41.051 264 HA2 GLY 39 HA2 GLY 39 52.720 34.850 43.171 265 HA3 GLY 39 HA3 GLY 39 51.086 35.458 42.904 266 H ASP 40 H ASP 40 49.886 32.835 42.430 267 HA ASP 40 HA ASP 40 50.624 31.091 44.712 268 HB2 ASP 40 HB2 ASP 40 47.817 32.141 44.151 269 HB3 ASP 40 HB3 ASP 40 48.089 30.619 44.973 270 H SER 41 H SER 41 50.360 28.846 44.174 271 HA SER 41 HA SER 41 50.176 28.150 41.400 272 HB2 SER 41 HB2 SER 41 50.098 25.840 42.206 273 HB3 SER 41 HB3 SER 41 51.361 26.780 43.015 274 HG SER 41 HG SER 41 50.157 25.459 44.394 275 H GLN 42 H GLN 42 47.657 28.275 43.918 276 HA GLN 42 HA GLN 42 45.608 27.202 42.210 277 HB2 GLN 42 HB2 GLN 42 45.433 29.032 44.632 278 HB3 GLN 42 HB3 GLN 42 44.026 28.347 43.819 279 HG2 GLN 42 HG2 GLN 42 46.263 26.713 45.090 280 HG3 GLN 42 HG3 GLN 42 44.719 27.075 45.841 281 HE21 GLN 42 HE21 GLN 42 45.412 24.471 45.672 282 HE22 GLN 42 HE22 GLN 42 44.376 23.671 44.494 283 H LEU 43 H LEU 43 46.964 30.501 42.429 284 HA LEU 43 HA LEU 43 44.943 31.591 40.595 285 HB2 LEU 43 HB2 LEU 43 47.409 32.629 41.939 286 HB3 LEU 43 HB3 LEU 43 47.150 33.190 40.314 287 HG LEU 43 HG LEU 43 44.687 33.699 41.084 288 HD11 LEU 43 HD11 LEU 43 44.908 32.622 43.322 289 HD12 LEU 43 HD12 LEU 43 44.516 34.346 43.437 290 HD13 LEU 43 HD13 LEU 43 46.173 33.802 43.744 291 HD21 LEU 43 HD21 LEU 43 46.285 35.402 40.359 292 HD22 LEU 43 HD22 LEU 43 47.071 35.362 41.957 293 HD23 LEU 43 HD23 LEU 43 45.397 35.951 41.780 294 H GLY 44 H GLY 44 48.241 30.169 40.254 295 HA2 GLY 44 HA2 GLY 44 48.540 30.459 37.454 296 HA3 GLY 44 HA3 GLY 44 49.183 29.121 38.420 297 H LEU 45 H LEU 45 47.010 27.736 39.248 298 HA LEU 45 HA LEU 45 45.950 26.455 36.888 299 HB2 LEU 45 HB2 LEU 45 45.584 26.144 39.862 300 HB3 LEU 45 HB3 LEU 45 44.384 25.439 38.789 301 HG LEU 45 HG LEU 45 46.114 24.162 37.591 302 HD11 LEU 45 HD11 LEU 45 48.028 25.156 39.742 303 HD12 LEU 45 HD12 LEU 45 48.125 25.534 38.003 304 HD13 LEU 45 HD13 LEU 45 48.357 23.875 38.561 305 HD21 LEU 45 HD21 LEU 45 46.559 22.552 39.428 306 HD22 LEU 45 HD22 LEU 45 44.896 23.134 39.430 307 HD23 LEU 45 HD23 LEU 45 46.060 23.777 40.615 308 H ARG 46 H ARG 46 44.508 28.981 38.989 309 HA ARG 46 HA ARG 46 41.891 29.015 37.785 310 HB2 ARG 46 HB2 ARG 46 42.525 30.255 39.855 311 HB3 ARG 46 HB3 ARG 46 43.537 31.323 38.885 312 HG2 ARG 46 HG2 ARG 46 41.428 31.972 37.592 313 HG3 ARG 46 HG3 ARG 46 40.505 31.128 38.831 314 HD2 ARG 46 HD2 ARG 46 42.447 33.441 39.252 315 HD3 ARG 46 HD3 ARG 46 40.695 33.569 39.242 316 HE ARG 46 HE ARG 46 41.298 31.707 41.262 317 HH11 ARG 46 HH11 ARG 46 41.704 35.163 40.716 318 HH12 ARG 46 HH12 ARG 46 41.960 35.482 42.409 319 HH21 ARG 46 HH21 ARG 46 41.765 32.214 43.404 320 HH22 ARG 46 HH22 ARG 46 41.988 33.883 43.872 321 H MET 47 H MET 47 44.825 30.906 36.935 322 HA MET 47 HA MET 47 43.525 32.059 34.647 323 HB2 MET 47 HB2 MET 47 46.517 31.960 35.156 324 HB3 MET 47 HB3 MET 47 45.630 33.056 34.107 325 HG2 MET 47 HG2 MET 47 46.035 33.136 37.023 326 HG3 MET 47 HG3 MET 47 45.950 34.438 35.862 327 HE1 MET 47 HE1 MET 47 44.979 35.832 37.785 328 HE2 MET 47 HE2 MET 47 43.450 35.500 38.625 329 HE3 MET 47 HE3 MET 47 44.863 34.460 38.907 330 H LEU 48 H LEU 48 45.623 29.176 34.945 331 HA LEU 48 HA LEU 48 45.813 28.722 32.103 332 HB2 LEU 48 HB2 LEU 48 47.345 27.642 33.627 333 HB3 LEU 48 HB3 LEU 48 46.020 26.864 34.498 334 HG LEU 48 HG LEU 48 45.513 25.438 32.581 335 HD11 LEU 48 HD11 LEU 48 46.080 26.889 30.686 336 HD12 LEU 48 HD12 LEU 48 47.014 25.407 30.599 337 HD13 LEU 48 HD13 LEU 48 47.786 26.909 31.179 338 HD21 LEU 48 HD21 LEU 48 48.494 25.499 33.215 339 HD22 LEU 48 HD22 LEU 48 47.583 24.118 32.563 340 HD23 LEU 48 HD23 LEU 48 47.229 24.713 34.190 341 H ALA 49 H ALA 49 43.452 27.452 34.577 342 HA ALA 49 HA ALA 49 41.975 25.962 32.641 343 HB1 ALA 49 HB1 ALA 49 41.020 27.155 35.265 344 HB2 ALA 49 HB2 ALA 49 40.297 25.795 34.381 345 HB3 ALA 49 HB3 ALA 49 41.902 25.608 35.101 346 H GLN 50 H GLN 50 41.463 29.333 33.867 347 HA GLN 50 HA GLN 50 39.174 29.783 32.181 348 HB2 GLN 50 HB2 GLN 50 41.078 31.722 33.559 349 HB3 GLN 50 HB3 GLN 50 39.655 32.217 32.618 350 HG2 GLN 50 HG2 GLN 50 38.243 30.701 34.035 351 HG3 GLN 50 HG3 GLN 50 39.624 30.408 35.079 352 HE21 GLN 50 HE21 GLN 50 37.364 31.294 36.186 353 HE22 GLN 50 HE22 GLN 50 37.491 32.986 36.664 354 H LEU 51 H LEU 51 42.693 30.399 31.537 355 HA LEU 51 HA LEU 51 42.336 31.443 28.905 356 HB2 LEU 51 HB2 LEU 51 44.469 31.546 29.999 357 HB3 LEU 51 HB3 LEU 51 44.511 29.794 30.230 358 HG LEU 51 HG LEU 51 44.725 29.482 27.776 359 HD11 LEU 51 HD11 LEU 51 45.396 31.399 26.375 360 HD12 LEU 51 HD12 LEU 51 45.126 32.504 27.742 361 HD13 LEU 51 HD13 LEU 51 43.760 31.640 27.000 362 HD21 LEU 51 HD21 LEU 51 46.858 31.259 29.017 363 HD22 LEU 51 HD22 LEU 51 47.068 30.117 27.668 364 HD23 LEU 51 HD23 LEU 51 46.681 29.505 29.280 365 H ARG 52 H ARG 52 42.563 28.007 30.005 366 HA ARG 52 HA ARG 52 42.367 26.910 27.376 367 HB2 ARG 52 HB2 ARG 52 43.245 25.759 29.419 368 HB3 ARG 52 HB3 ARG 52 41.577 25.564 29.988 369 HG2 ARG 52 HG2 ARG 52 41.018 24.287 27.977 370 HG3 ARG 52 HG3 ARG 52 42.624 24.557 27.294 371 HD2 ARG 52 HD2 ARG 52 43.580 23.442 29.354 372 HD3 ARG 52 HD3 ARG 52 41.943 22.904 29.764 373 HE ARG 52 HE ARG 52 43.747 21.824 27.734 374 HH11 ARG 52 HH11 ARG 52 40.260 21.930 28.404 375 HH12 ARG 52 HH12 ARG 52 40.030 20.591 27.291 376 HH21 ARG 52 HH21 ARG 52 43.324 20.226 26.531 377 HH22 ARG 52 HH22 ARG 52 41.669 19.636 26.299 378 H GLU 53 H GLU 53 39.802 27.440 29.818 379 HA GLU 53 HA GLU 53 37.718 26.406 28.099 380 HB2 GLU 53 HB2 GLU 53 37.659 28.038 30.656 381 HB3 GLU 53 HB3 GLU 53 36.225 27.339 29.911 382 HG2 GLU 53 HG2 GLU 53 38.536 25.468 30.451 383 HG3 GLU 53 HG3 GLU 53 37.686 26.074 31.831 384 H ARG 54 H ARG 54 39.027 29.672 28.508 385 HA ARG 54 HA ARG 54 36.934 30.942 26.871 386 HB2 ARG 54 HB2 ARG 54 39.642 31.871 27.914 387 HB3 ARG 54 HB3 ARG 54 38.637 32.857 26.872 388 HG2 ARG 54 HG2 ARG 54 36.896 33.073 28.451 389 HG3 ARG 54 HG3 ARG 54 37.506 31.760 29.456 390 HD2 ARG 54 HD2 ARG 54 37.886 33.992 30.454 391 HD3 ARG 54 HD3 ARG 54 39.369 33.063 30.225 392 HE ARG 54 HE ARG 54 39.041 34.745 27.945 393 HH11 ARG 54 HH11 ARG 54 39.553 35.392 31.384 394 HH12 ARG 54 HH12 ARG 54 40.445 36.829 30.986 395 HH21 ARG 54 HH21 ARG 54 40.209 36.447 27.612 396 HH22 ARG 54 HH22 ARG 54 40.968 37.335 28.953 397 H HIS 55 H HIS 55 40.217 29.717 26.281 398 HA HIS 55 HA HIS 55 40.053 30.650 23.446 399 HB2 HIS 55 HB2 HIS 55 41.448 31.807 25.392 400 HB3 HIS 55 HB3 HIS 55 42.571 30.494 25.102 401 HD1 HIS 55 HD1 HIS 55 43.181 30.375 22.220 402 HD2 HIS 55 HD2 HIS 55 42.129 33.954 24.153 403 HE1 HIS 55 HE1 HIS 55 44.279 32.265 20.885 404 H GLY 56 H GLY 56 40.329 27.722 25.161 405 HA2 GLY 56 HA2 GLY 56 40.655 25.603 24.396 406 HA3 GLY 56 HA3 GLY 56 41.036 26.229 22.791 407 H VAL 57 H VAL 57 43.018 27.351 25.482 408 HA VAL 57 HA VAL 57 45.324 26.135 24.034 409 HB VAL 57 HB VAL 57 45.265 28.547 25.866 410 HG11 VAL 57 HG11 VAL 57 47.551 28.980 24.987 411 HG12 VAL 57 HG12 VAL 57 47.486 27.501 25.941 412 HG13 VAL 57 HG13 VAL 57 47.520 27.407 24.161 413 HG21 VAL 57 HG21 VAL 57 45.516 28.339 22.834 414 HG22 VAL 57 HG22 VAL 57 44.145 29.009 23.740 415 HG23 VAL 57 HG23 VAL 57 45.703 29.831 23.787 416 H ASP 58 H ASP 58 46.891 24.946 25.029 417 HA ASP 58 HA ASP 58 46.231 23.924 27.756 418 HB2 ASP 58 HB2 ASP 58 45.686 22.662 25.425 419 HB3 ASP 58 HB3 ASP 58 47.353 22.139 25.609 420 H LEU 59 H LEU 59 47.924 23.710 29.169 421 HA LEU 59 HA LEU 59 50.649 24.449 28.185 422 HB2 LEU 59 HB2 LEU 59 49.365 26.099 29.498 423 HB3 LEU 59 HB3 LEU 59 49.381 25.001 30.878 424 HG LEU 59 HG LEU 59 51.884 26.107 29.549 425 HD11 LEU 59 HD11 LEU 59 51.943 27.738 31.405 426 HD12 LEU 59 HD12 LEU 59 50.414 27.092 32.035 427 HD13 LEU 59 HD13 LEU 59 50.459 27.918 30.465 428 HD21 LEU 59 HD21 LEU 59 52.924 25.631 31.801 429 HD22 LEU 59 HD22 LEU 59 52.491 24.191 30.890 430 HD23 LEU 59 HD23 LEU 59 51.453 24.730 32.231 431 HA PRO 60 HA PRO 60 51.230 20.270 29.958 432 HB2 PRO 60 HB2 PRO 60 53.086 19.310 28.271 433 HB3 PRO 60 HB3 PRO 60 51.399 19.503 27.779 434 HG2 PRO 60 HG2 PRO 60 53.687 21.434 27.288 435 HG3 PRO 60 HG3 PRO 60 52.544 20.768 26.082 436 HD2 PRO 60 HD2 PRO 60 52.118 23.185 27.232 437 HD3 PRO 60 HD3 PRO 60 50.760 22.083 26.898 438 H LEU 61 H LEU 61 52.560 19.584 31.529 439 HA LEU 61 HA LEU 61 54.361 21.407 32.679 440 HB2 LEU 61 HB2 LEU 61 54.731 19.854 34.402 441 HB3 LEU 61 HB3 LEU 61 53.060 19.791 33.915 442 HG LEU 61 HG LEU 61 53.754 17.682 32.516 443 HD11 LEU 61 HD11 LEU 61 56.040 17.844 34.541 444 HD12 LEU 61 HD12 LEU 61 56.208 17.861 32.768 445 HD13 LEU 61 HD13 LEU 61 55.613 16.420 33.570 446 HD21 LEU 61 HD21 LEU 61 52.316 17.580 34.469 447 HD22 LEU 61 HD22 LEU 61 53.728 17.643 35.555 448 HD23 LEU 61 HD23 LEU 61 53.462 16.239 34.489 449 H ARG 62 H ARG 62 55.058 19.080 30.185 450 HA ARG 62 HA ARG 62 57.939 19.195 30.413 451 HB2 ARG 62 HB2 ARG 62 58.017 18.186 28.249 452 HB3 ARG 62 HB3 ARG 62 56.726 17.441 29.181 453 HG2 ARG 62 HG2 ARG 62 55.107 18.930 27.969 454 HG3 ARG 62 HG3 ARG 62 56.420 19.479 26.931 455 HD2 ARG 62 HD2 ARG 62 56.529 17.532 25.772 456 HD3 ARG 62 HD3 ARG 62 56.165 16.530 27.164 457 HE ARG 62 HE ARG 62 54.180 18.002 25.471 458 HH11 ARG 62 HH11 ARG 62 54.764 15.349 27.738 459 HH12 ARG 62 HH12 ARG 62 53.088 14.924 27.807 460 HH21 ARG 62 HH21 ARG 62 52.097 17.313 25.523 461 HH22 ARG 62 HH22 ARG 62 51.667 15.856 26.417 462 H CYS 63 H CYS 63 55.608 21.344 28.728 463 HA CYS 63 HA CYS 63 57.738 22.975 27.590 464 HB2 CYS 63 HB2 CYS 63 56.197 24.390 26.721 465 HB3 CYS 63 HB3 CYS 63 55.351 22.851 26.669 466 HG CYS 63 HG CYS 63 53.980 23.300 28.926 467 H LEU 64 H LEU 64 55.728 23.018 30.516 468 HA LEU 64 HA LEU 64 56.880 25.383 31.668 469 HB2 LEU 64 HB2 LEU 64 54.788 24.104 32.303 470 HB3 LEU 64 HB3 LEU 64 55.815 22.952 33.139 471 HG LEU 64 HG LEU 64 56.584 24.622 34.715 472 HD11 LEU 64 HD11 LEU 64 55.536 26.882 34.807 473 HD12 LEU 64 HD12 LEU 64 54.815 26.599 33.202 474 HD13 LEU 64 HD13 LEU 64 56.581 26.684 33.407 475 HD21 LEU 64 HD21 LEU 64 54.463 23.408 35.147 476 HD22 LEU 64 HD22 LEU 64 53.553 24.726 34.381 477 HD23 LEU 64 HD23 LEU 64 54.466 25.015 35.881 478 H TYR 65 H TYR 65 58.043 22.035 31.646 479 HA TYR 65 HA TYR 65 60.262 22.430 33.455 480 HB2 TYR 65 HB2 TYR 65 59.238 20.248 32.989 481 HB3 TYR 65 HB3 TYR 65 59.711 20.350 31.309 482 HD1 TYR 65 HD1 TYR 65 62.154 20.190 30.653 483 HD2 TYR 65 HD2 TYR 65 60.704 19.368 34.635 484 HE1 TYR 65 HE1 TYR 65 64.200 18.865 31.125 485 HE2 TYR 65 HE2 TYR 65 62.731 18.019 35.090 486 HH TYR 65 HH TYR 65 64.757 17.371 34.339 487 H GLU 66 H GLU 66 59.956 22.592 29.865 488 HA GLU 66 HA GLU 66 62.870 23.090 29.676 489 HB2 GLU 66 HB2 GLU 66 62.739 22.658 27.404 490 HB3 GLU 66 HB3 GLU 66 61.684 21.487 28.194 491 HG2 GLU 66 HG2 GLU 66 59.757 23.085 27.624 492 HG3 GLU 66 HG3 GLU 66 60.886 23.949 26.585 493 H ALA 67 H ALA 67 59.959 25.075 29.313 494 HA ALA 67 HA ALA 67 61.665 27.481 29.045 495 HB1 ALA 67 HB1 ALA 67 59.406 26.715 27.154 496 HB2 ALA 67 HB2 ALA 67 60.277 28.262 27.153 497 HB3 ALA 67 HB3 ALA 67 61.140 26.763 26.757 498 HA PRO 68 HA PRO 68 58.054 27.794 32.008 499 HB2 PRO 68 HB2 PRO 68 59.412 28.723 34.240 500 HB3 PRO 68 HB3 PRO 68 59.191 27.013 33.829 501 HG2 PRO 68 HG2 PRO 68 61.564 28.801 33.237 502 HG3 PRO 68 HG3 PRO 68 61.574 27.144 33.929 503 HD2 PRO 68 HD2 PRO 68 62.055 27.569 31.300 504 HD3 PRO 68 HD3 PRO 68 61.076 26.170 31.834 505 H THR 69 H THR 69 60.137 30.193 30.693 506 HA THR 69 HA THR 69 58.892 32.475 32.075 507 HB THR 69 HB THR 69 60.261 33.751 30.258 508 HG1 THR 69 HG1 THR 69 61.686 32.765 29.232 509 HG21 THR 69 HG21 THR 69 61.484 32.094 32.503 510 HG22 THR 69 HG22 THR 69 60.970 33.777 32.541 511 HG23 THR 69 HG23 THR 69 62.390 33.327 31.583 512 H VAL 70 H VAL 70 57.242 33.737 31.297 513 HA VAL 70 HA VAL 70 55.342 32.195 29.961 514 HB VAL 70 HB VAL 70 53.922 34.262 29.854 515 HG11 VAL 70 HG11 VAL 70 53.555 34.386 32.209 516 HG12 VAL 70 HG12 VAL 70 53.845 32.718 31.707 517 HG13 VAL 70 HG13 VAL 70 55.136 33.619 32.541 518 HG21 VAL 70 HG21 VAL 70 54.598 36.265 31.036 519 HG22 VAL 70 HG22 VAL 70 56.196 35.596 31.377 520 HG23 VAL 70 HG23 VAL 70 55.730 35.997 29.712 521 H ALA 71 H ALA 71 57.277 34.755 28.354 522 HA ALA 71 HA ALA 71 55.676 34.544 25.900 523 HB1 ALA 71 HB1 ALA 71 57.384 36.059 24.993 524 HB2 ALA 71 HB2 ALA 71 56.765 36.643 26.545 525 HB3 ALA 71 HB3 ALA 71 58.363 35.858 26.466 526 H ARG 72 H ARG 72 58.609 33.075 27.176 527 HA ARG 72 HA ARG 72 59.479 31.826 24.691 528 HB2 ARG 72 HB2 ARG 72 60.752 32.479 26.923 529 HB3 ARG 72 HB3 ARG 72 60.245 30.883 27.478 530 HG2 ARG 72 HG2 ARG 72 61.457 29.818 25.632 531 HG3 ARG 72 HG3 ARG 72 61.692 31.396 24.855 532 HD2 ARG 72 HD2 ARG 72 63.773 30.888 25.880 533 HD3 ARG 72 HD3 ARG 72 63.005 32.164 26.822 534 HE ARG 72 HE ARG 72 62.725 30.721 28.637 535 HH11 ARG 72 HH11 ARG 72 63.950 28.747 25.949 536 HH12 ARG 72 HH12 ARG 72 64.664 27.610 27.083 537 HH21 ARG 72 HH21 ARG 72 63.637 29.206 29.914 538 HH22 ARG 72 HH22 ARG 72 64.469 27.836 29.212 539 H LEU 73 H LEU 73 57.729 30.770 27.579 540 HA LEU 73 HA LEU 73 56.926 28.183 26.826 541 HB2 LEU 73 HB2 LEU 73 56.587 29.377 29.025 542 HB3 LEU 73 HB3 LEU 73 55.306 30.309 28.316 543 HG LEU 73 HG LEU 73 55.113 27.330 28.060 544 HD11 LEU 73 HD11 LEU 73 54.136 27.106 30.292 545 HD12 LEU 73 HD12 LEU 73 54.504 28.815 30.651 546 HD13 LEU 73 HD13 LEU 73 55.816 27.637 30.400 547 HD21 LEU 73 HD21 LEU 73 53.104 29.541 28.677 548 HD22 LEU 73 HD22 LEU 73 52.706 27.826 28.428 549 HD23 LEU 73 HD23 LEU 73 53.346 28.775 27.097 550 H ALA 74 H ALA 74 55.126 31.306 26.246 551 HA ALA 74 HA ALA 74 53.182 30.249 24.531 552 HB1 ALA 74 HB1 ALA 74 54.487 33.000 24.378 553 HB2 ALA 74 HB2 ALA 74 52.907 32.547 23.726 554 HB3 ALA 74 HB3 ALA 74 53.170 32.545 25.485 555 H GLU 75 H GLU 75 56.506 31.294 23.648 556 HA GLU 75 HA GLU 75 56.196 30.931 20.838 557 HB2 GLU 75 HB2 GLU 75 58.093 32.130 22.052 558 HB3 GLU 75 HB3 GLU 75 58.782 30.542 22.402 559 HG2 GLU 75 HG2 GLU 75 58.839 30.060 19.959 560 HG3 GLU 75 HG3 GLU 75 58.113 31.639 19.657 561 H THR 76 H THR 76 57.291 28.569 23.363 562 HA THR 76 HA THR 76 57.542 26.375 21.512 563 HB THR 76 HB THR 76 57.402 24.844 23.329 564 HG1 THR 76 HG1 THR 76 56.417 27.032 24.779 565 HG21 THR 76 HG21 THR 76 59.049 27.245 24.184 566 HG22 THR 76 HG22 THR 76 59.537 26.012 23.002 567 HG23 THR 76 HG23 THR 76 59.263 25.560 24.693 568 H ILE 77 H ILE 77 54.690 27.505 23.391 569 HA ILE 77 HA ILE 77 52.935 25.413 22.564 570 HB ILE 77 HB ILE 77 52.308 28.283 23.348 571 HG12 ILE 77 HG12 ILE 77 53.429 27.075 25.168 572 HG13 ILE 77 HG13 ILE 77 51.766 27.436 25.555 573 HG21 ILE 77 HG21 ILE 77 50.025 27.376 23.940 574 HG22 ILE 77 HG22 ILE 77 50.360 27.492 22.215 575 HG23 ILE 77 HG23 ILE 77 50.426 25.909 23.028 576 HD11 ILE 77 HD11 ILE 77 52.385 25.240 26.344 577 HD12 ILE 77 HD12 ILE 77 51.172 25.073 25.075 578 HD13 ILE 77 HD13 ILE 77 52.884 24.723 24.722 579 H VAL 78 H VAL 78 53.706 28.523 20.976 580 HA VAL 78 HA VAL 78 51.812 28.157 18.799 581 HB VAL 78 HB VAL 78 54.117 30.068 19.283 582 HG11 VAL 78 HG11 VAL 78 52.180 30.057 16.931 583 HG12 VAL 78 HG12 VAL 78 53.256 31.401 17.371 584 HG13 VAL 78 HG13 VAL 78 53.949 29.871 16.840 585 HG21 VAL 78 HG21 VAL 78 52.018 30.346 20.646 586 HG22 VAL 78 HG22 VAL 78 52.304 31.701 19.552 587 HG23 VAL 78 HG23 VAL 78 51.086 30.474 19.142 588 H ARG 79 H ARG 79 55.393 27.616 19.013 589 HA ARG 79 HA ARG 79 55.437 26.779 16.221 590 HB2 ARG 79 HB2 ARG 79 57.750 26.612 16.405 591 HB3 ARG 79 HB3 ARG 79 57.270 27.984 17.400 592 HG2 ARG 79 HG2 ARG 79 57.334 26.239 19.377 593 HG3 ARG 79 HG3 ARG 79 58.287 25.255 18.267 594 HD2 ARG 79 HD2 ARG 79 58.904 28.111 19.121 595 HD3 ARG 79 HD3 ARG 79 59.701 26.695 19.767 596 HE ARG 79 HE ARG 79 59.972 27.854 17.028 597 HH11 ARG 79 HH11 ARG 79 61.164 25.417 19.278 598 HH12 ARG 79 HH12 ARG 79 62.674 25.254 18.404 599 HH21 ARG 79 HH21 ARG 79 61.672 27.230 15.766 600 HH22 ARG 79 HH22 ARG 79 62.810 26.047 16.375 601 H LEU 80 H LEU 80 55.085 24.966 19.208 602 HA LEU 80 HA LEU 80 55.272 22.371 17.808 603 HB2 LEU 80 HB2 LEU 80 54.296 23.104 20.593 604 HB3 LEU 80 HB3 LEU 80 54.508 21.466 19.995 605 HG LEU 80 HG LEU 80 56.809 23.468 20.220 606 HD11 LEU 80 HD11 LEU 80 55.845 22.954 22.441 607 HD12 LEU 80 HD12 LEU 80 57.467 22.262 22.226 608 HD13 LEU 80 HD13 LEU 80 56.033 21.215 22.108 609 HD21 LEU 80 HD21 LEU 80 58.214 21.451 20.070 610 HD22 LEU 80 HD22 LEU 80 57.224 21.645 18.621 611 HD23 LEU 80 HD23 LEU 80 56.766 20.443 19.850 612 H ALA 81 H ALA 81 52.742 24.675 18.674 613 HA ALA 81 HA ALA 81 50.556 24.813 18.224 614 HB1 ALA 81 HB1 ALA 81 50.000 24.534 15.920 615 HB2 ALA 81 HB2 ALA 81 51.683 25.064 16.026 616 HB3 ALA 81 HB3 ALA 81 51.321 23.360 15.685 617 H ALA 82 H ALA 82 51.076 22.433 19.847 618 HA ALA 82 HA ALA 82 49.019 20.551 18.863 619 HB1 ALA 82 HB1 ALA 82 51.396 20.024 20.651 620 HB2 ALA 82 HB2 ALA 82 50.301 18.821 19.943 621 HB3 ALA 82 HB3 ALA 82 51.348 19.777 18.890 622 HA PRO 83 HA PRO 83 47.569 21.589 23.295 623 HB2 PRO 83 HB2 PRO 83 45.882 23.732 23.182 624 HB3 PRO 83 HB3 PRO 83 47.647 23.900 23.432 625 HG2 PRO 83 HG2 PRO 83 46.097 24.171 20.851 626 HG3 PRO 83 HG3 PRO 83 47.342 25.271 21.511 627 HD2 PRO 83 HD2 PRO 83 47.897 23.362 19.641 628 HD3 PRO 83 HD3 PRO 83 49.080 23.828 20.903 629 H ALA 84 H ALA 84 46.198 21.182 20.188 630 HA ALA 84 HA ALA 84 44.415 20.136 19.363 631 HB1 ALA 84 HB1 ALA 84 43.855 18.045 20.410 632 HB2 ALA 84 HB2 ALA 84 45.569 18.356 20.670 633 HB3 ALA 84 HB3 ALA 84 44.418 18.621 21.994 634 HA PRO 85 HA PRO 85 41.621 22.894 21.999 635 HB2 PRO 85 HB2 PRO 85 40.814 24.710 20.109 636 HB3 PRO 85 HB3 PRO 85 42.354 24.838 21.009 637 HG2 PRO 85 HG2 PRO 85 41.919 23.671 18.244 638 HG3 PRO 85 HG3 PRO 85 43.152 24.863 18.765 639 HD2 PRO 85 HD2 PRO 85 43.727 22.218 18.580 640 HD3 PRO 85 HD3 PRO 85 44.399 23.205 19.905 641 H SER 86 H SER 86 39.515 22.527 22.353 642 HA SER 86 HA SER 86 37.958 20.737 20.737 643 HB2 SER 86 HB2 SER 86 36.899 22.649 22.853 644 HB3 SER 86 HB3 SER 86 36.141 21.172 22.251 645 HG SER 86 HG SER 86 38.583 21.391 23.715 646 H GLY 87 H GLY 87 38.180 24.245 20.876 647 HA2 GLY 87 HA2 GLY 87 37.891 24.856 18.299 648 HA3 GLY 87 HA3 GLY 87 36.190 24.663 18.714 649 H ASP 88 H ASP 88 37.887 26.002 21.394 650 HA ASP 88 HA ASP 88 36.138 28.257 21.147 651 HB2 ASP 88 HB2 ASP 88 38.049 27.332 23.313 652 HB3 ASP 88 HB3 ASP 88 37.066 28.782 23.462 653 H GLN 89 H GLN 89 36.548 30.435 21.742 654 HA GLN 89 HA GLN 89 39.096 31.661 21.045 655 HB2 GLN 89 HB2 GLN 89 38.128 33.040 19.253 656 HB3 GLN 89 HB3 GLN 89 38.158 31.339 18.833 657 HG2 GLN 89 HG2 GLN 89 35.666 32.776 19.820 658 HG3 GLN 89 HG3 GLN 89 36.092 32.584 18.127 659 HE21 GLN 89 HE21 GLN 89 36.410 30.292 17.333 660 HE22 GLN 89 HE22 GLN 89 35.378 29.051 18.045 661 H ASP 90 H ASP 90 39.272 33.808 21.667 662 HA ASP 90 HA ASP 90 37.025 35.109 23.091 663 HB2 ASP 90 HB2 ASP 90 37.794 33.610 24.780 664 HB3 ASP 90 HB3 ASP 90 39.497 33.949 24.429 665 H ASP 91 H ASP 91 37.257 37.265 23.410 666 HA ASP 91 HA ASP 91 39.765 38.618 22.513 667 HB2 ASP 91 HB2 ASP 91 38.442 40.380 21.591 668 HB3 ASP 91 HB3 ASP 91 37.928 38.842 20.921 669 H ALA 92 H ALA 92 38.248 37.870 25.259 670 HA ALA 92 HA ALA 92 38.361 38.512 27.360 671 HB1 ALA 92 HB1 ALA 92 40.715 38.800 26.816 672 HB2 ALA 92 HB2 ALA 92 40.434 40.504 26.429 673 HB3 ALA 92 HB3 ALA 92 40.182 39.934 28.082 674 H SER 93 H SER 93 37.502 39.812 28.978 675 HA SER 93 HA SER 93 35.998 42.227 28.085 676 HB2 SER 93 HB2 SER 93 35.866 40.624 30.650 677 HB3 SER 93 HB3 SER 93 34.990 42.139 30.326 678 HG SER 93 HG SER 93 33.592 40.693 29.674 679 H GLU 94 H GLU 94 36.544 44.228 28.632 680 HA GLU 94 HA GLU 94 39.283 44.537 29.586 681 HB2 GLU 94 HB2 GLU 94 39.150 46.754 28.502 682 HB3 GLU 94 HB3 GLU 94 38.753 45.413 27.438 683 HG2 GLU 94 HG2 GLU 94 36.289 45.918 27.875 684 HG3 GLU 94 HG3 GLU 94 36.832 47.380 28.712 685 H TYR 95 H TYR 95 40.094 46.073 30.945 686 HA TYR 95 HA TYR 95 38.306 47.530 32.821 687 HB2 TYR 95 HB2 TYR 95 38.747 45.663 34.168 688 HB3 TYR 95 HB3 TYR 95 40.362 45.438 33.519 689 HD1 TYR 95 HD1 TYR 95 38.360 47.343 35.998 690 HD2 TYR 95 HD2 TYR 95 42.272 46.701 34.310 691 HE1 TYR 95 HE1 TYR 95 39.378 48.719 37.808 692 HE2 TYR 95 HE2 TYR 95 43.278 48.088 36.117 693 HH TYR 95 HH TYR 95 41.327 49.745 38.598 694 H GLU 96 H GLU 96 39.045 49.538 33.377 695 HA GLU 96 HA GLU 96 41.848 50.309 32.917 696 HB2 GLU 96 HB2 GLU 96 40.815 50.485 30.665 697 HB3 GLU 96 HB3 GLU 96 39.588 51.579 31.312 698 HG2 GLU 96 HG2 GLU 96 41.345 53.240 31.858 699 HG3 GLU 96 HG3 GLU 96 42.592 52.115 31.307 700 H GLU 97 H GLU 97 42.514 51.832 34.250 701 HA GLU 97 HA GLU 97 40.593 53.840 35.362 702 HB2 GLU 97 HB2 GLU 97 42.678 52.237 36.878 703 HB3 GLU 97 HB3 GLU 97 42.131 53.826 37.420 704 HG2 GLU 97 HG2 GLU 97 39.756 52.963 37.346 705 HG3 GLU 97 HG3 GLU 97 40.400 51.351 37.052 706 H GLY 98 H GLY 98 43.925 53.158 34.294 707 HA2 GLY 98 HA2 GLY 98 44.885 55.839 34.881 708 HA3 GLY 98 HA3 GLY 98 45.746 54.538 34.059 709 H VAL 99 H VAL 99 43.487 54.387 32.083 710 HA VAL 99 HA VAL 99 43.011 54.912 30.007 711 HB VAL 99 HB VAL 99 42.196 56.992 29.379 712 HG11 VAL 99 HG11 VAL 99 40.584 57.396 31.136 713 HG12 VAL 99 HG12 VAL 99 40.894 55.659 31.017 714 HG13 VAL 99 HG13 VAL 99 41.612 56.602 32.338 715 HG21 VAL 99 HG21 VAL 99 42.375 59.053 30.541 716 HG22 VAL 99 HG22 VAL 99 43.261 58.322 31.881 717 HG23 VAL 99 HG23 VAL 99 44.031 58.479 30.287 718 H ILE 100 H ILE 100 43.499 55.452 27.927 719 HA ILE 100 HA ILE 100 46.351 56.204 27.449 720 HB ILE 100 HB ILE 100 46.440 54.518 25.685 721 HG12 ILE 100 HG12 ILE 100 43.769 53.503 26.737 722 HG13 ILE 100 HG13 ILE 100 43.997 54.355 25.208 723 HG21 ILE 100 HG21 ILE 100 46.792 52.637 27.162 724 HG22 ILE 100 HG22 ILE 100 47.293 54.133 27.964 725 HG23 ILE 100 HG23 ILE 100 45.758 53.362 28.407 726 HD11 ILE 100 HD11 ILE 100 45.588 52.531 24.491 727 HD12 ILE 100 HD12 ILE 100 45.093 51.626 25.946 728 HD13 ILE 100 HD13 ILE 100 43.900 52.034 24.702 729 H ARG 101 H ARG 101 46.928 56.827 25.399 730 HA ARG 101 HA ARG 101 46.881 58.415 23.735 731 HB2 ARG 101 HB2 ARG 101 44.567 56.614 22.916 732 HB3 ARG 101 HB3 ARG 101 45.386 57.771 21.860 733 HG2 ARG 101 HG2 ARG 101 47.573 56.613 22.392 734 HG3 ARG 101 HG3 ARG 101 46.641 55.343 23.195 735 HD2 ARG 101 HD2 ARG 101 46.257 56.177 20.289 736 HD3 ARG 101 HD3 ARG 101 47.358 54.905 20.789 737 HE ARG 101 HE ARG 101 44.425 54.801 20.690 738 HH11 ARG 101 HH11 ARG 101 47.276 53.150 21.973 739 HH12 ARG 101 HH12 ARG 101 46.490 51.588 21.897 740 HH21 ARG 101 HH21 ARG 101 43.496 52.769 20.705 741 HH22 ARG 101 HH22 ARG 101 44.451 51.374 21.133 Start of MODEL 14 1 H GLY 1 H1 GLY 1 32.760 45.497 37.825 2 HA2 GLY 1 HA2 GLY 1 33.204 42.919 36.471 3 HA3 GLY 1 HA3 GLY 1 32.116 44.208 35.899 4 H ALA 2 H ALA 2 33.729 43.699 34.028 5 HA ALA 2 HA ALA 2 35.750 45.846 33.970 6 HB1 ALA 2 HB1 ALA 2 37.471 44.322 33.104 7 HB2 ALA 2 HB2 ALA 2 36.937 43.784 34.710 8 HB3 ALA 2 HB3 ALA 2 36.357 42.949 33.251 9 H ALA 3 H ALA 3 36.357 46.456 31.793 10 HA ALA 3 HA ALA 3 34.291 46.184 29.812 11 HB1 ALA 3 HB1 ALA 3 35.709 48.181 30.055 12 HB2 ALA 3 HB2 ALA 3 37.141 47.236 29.586 13 HB3 ALA 3 HB3 ALA 3 35.827 47.501 28.418 14 H ALA 4 H ALA 4 34.094 44.840 28.101 15 HA ALA 4 HA ALA 4 36.264 43.006 27.284 16 HB1 ALA 4 HB1 ALA 4 33.512 42.075 28.219 17 HB2 ALA 4 HB2 ALA 4 34.771 41.046 27.501 18 HB3 ALA 4 HB3 ALA 4 35.046 41.809 29.078 19 H GLY 5 H GLY 5 35.625 41.804 25.255 20 HA2 GLY 5 HA2 GLY 5 34.877 41.775 23.085 21 HA3 GLY 5 HA3 GLY 5 33.485 42.746 23.558 22 H VAL 6 H VAL 6 36.154 44.471 24.488 23 HA VAL 6 HA VAL 6 36.019 46.229 22.124 24 HB VAL 6 HB VAL 6 37.027 47.945 23.618 25 HG11 VAL 6 HG11 VAL 6 35.002 48.414 24.858 26 HG12 VAL 6 HG12 VAL 6 34.580 47.779 23.261 27 HG13 VAL 6 HG13 VAL 6 34.458 46.735 24.694 28 HG21 VAL 6 HG21 VAL 6 37.073 47.629 26.023 29 HG22 VAL 6 HG22 VAL 6 36.512 45.956 25.878 30 HG23 VAL 6 HG23 VAL 6 38.118 46.419 25.272 31 H SER 7 H SER 7 37.885 47.352 21.343 32 HA SER 7 HA SER 7 40.518 45.980 21.736 33 HB2 SER 7 HB2 SER 7 41.052 46.808 19.449 34 HB3 SER 7 HB3 SER 7 39.781 45.575 19.525 35 HG SER 7 HG SER 7 39.221 47.236 18.142 36 H ALA 8 H ALA 8 42.420 47.269 21.710 37 HA ALA 8 HA ALA 8 42.080 50.180 22.254 38 HB1 ALA 8 HB1 ALA 8 43.802 48.253 23.865 39 HB2 ALA 8 HB2 ALA 8 43.566 49.983 24.168 40 HB3 ALA 8 HB3 ALA 8 42.216 48.855 24.392 41 H ALA 9 H ALA 9 44.207 51.332 22.194 42 HA ALA 9 HA ALA 9 45.591 51.128 19.812 43 HB1 ALA 9 HB1 ALA 9 46.529 52.207 22.498 44 HB2 ALA 9 HB2 ALA 9 47.278 52.576 20.933 45 HB3 ALA 9 HB3 ALA 9 45.602 53.064 21.252 46 H GLY 10 H GLY 10 46.913 49.736 18.937 47 HA2 GLY 10 HA2 GLY 10 48.572 48.197 18.557 48 HA3 GLY 10 HA3 GLY 10 49.166 48.475 20.188 49 H ILE 11 H ILE 11 49.596 46.061 19.566 50 HA ILE 11 HA ILE 11 47.781 44.589 21.314 51 HB ILE 11 HB ILE 11 47.158 44.182 18.787 52 HG12 ILE 11 HG12 ILE 11 46.583 41.817 19.188 53 HG13 ILE 11 HG13 ILE 11 47.532 41.825 20.673 54 HG21 ILE 11 HG21 ILE 11 48.337 42.426 17.649 55 HG22 ILE 11 HG22 ILE 11 49.517 43.678 18.077 56 HG23 ILE 11 HG23 ILE 11 49.437 42.171 19.009 57 HD11 ILE 11 HD11 ILE 11 45.991 43.458 21.680 58 HD12 ILE 11 HD12 ILE 11 45.152 43.657 20.121 59 HD13 ILE 11 HD13 ILE 11 45.062 42.119 20.996 60 H GLU 12 H GLU 12 48.739 42.690 22.273 61 HA GLU 12 HA GLU 12 51.602 42.256 21.851 62 HB2 GLU 12 HB2 GLU 12 52.172 42.465 24.231 63 HB3 GLU 12 HB3 GLU 12 51.630 43.967 23.513 64 HG2 GLU 12 HG2 GLU 12 49.289 43.380 24.566 65 HG3 GLU 12 HG3 GLU 12 50.197 42.206 25.528 66 HA PRO 13 HA PRO 13 50.823 38.179 21.833 67 HB2 PRO 13 HB2 PRO 13 52.716 37.590 24.117 68 HB3 PRO 13 HB3 PRO 13 52.585 36.783 22.520 69 HG2 PRO 13 HG2 PRO 13 54.488 38.659 22.902 70 HG3 PRO 13 HG3 PRO 13 53.508 38.697 21.399 71 HD2 PRO 13 HD2 PRO 13 53.171 40.355 23.907 72 HD3 PRO 13 HD3 PRO 13 53.129 40.868 22.196 73 H ASP 14 H ASP 14 49.253 36.838 22.360 74 HA ASP 14 HA ASP 14 47.323 37.563 24.204 75 HB2 ASP 14 HB2 ASP 14 47.759 34.805 22.982 76 HB3 ASP 14 HB3 ASP 14 46.256 35.390 23.698 77 H LEU 15 H LEU 15 49.806 35.017 24.653 78 HA LEU 15 HA LEU 15 48.930 34.008 27.145 79 HB2 LEU 15 HB2 LEU 15 50.711 33.114 25.592 80 HB3 LEU 15 HB3 LEU 15 51.798 34.372 26.136 81 HG LEU 15 HG LEU 15 52.278 32.187 27.092 82 HD11 LEU 15 HD11 LEU 15 51.307 33.966 29.348 83 HD12 LEU 15 HD12 LEU 15 52.804 34.238 28.423 84 HD13 LEU 15 HD13 LEU 15 52.592 32.761 29.381 85 HD21 LEU 15 HD21 LEU 15 50.003 31.263 27.155 86 HD22 LEU 15 HD22 LEU 15 49.591 32.360 28.495 87 HD23 LEU 15 HD23 LEU 15 50.825 31.102 28.718 88 H THR 16 H THR 16 51.277 36.675 26.549 89 HA THR 16 HA THR 16 51.481 37.367 29.348 90 HB THR 16 HB THR 16 52.575 39.464 28.545 91 HG1 THR 16 HG1 THR 16 51.512 38.780 26.170 92 HG21 THR 16 HG21 THR 16 53.853 37.402 29.029 93 HG22 THR 16 HG22 THR 16 54.585 38.356 27.727 94 HG23 THR 16 HG23 THR 16 53.663 36.888 27.336 95 H ALA 17 H ALA 17 49.345 38.601 26.762 96 HA ALA 17 HA ALA 17 48.346 40.831 28.278 97 HB1 ALA 17 HB1 ALA 17 46.590 40.859 26.552 98 HB2 ALA 17 HB2 ALA 17 48.189 40.628 25.817 99 HB3 ALA 17 HB3 ALA 17 47.086 39.246 25.996 100 H ILE 18 H ILE 18 47.158 37.457 27.884 101 HA ILE 18 HA ILE 18 44.870 37.803 29.622 102 HB ILE 18 HB ILE 18 46.330 35.344 28.600 103 HG12 ILE 18 HG12 ILE 18 43.588 36.479 27.870 104 HG13 ILE 18 HG13 ILE 18 45.043 36.908 26.987 105 HG21 ILE 18 HG21 ILE 18 44.331 34.049 29.365 106 HG22 ILE 18 HG22 ILE 18 45.217 34.731 30.718 107 HG23 ILE 18 HG23 ILE 18 43.713 35.503 30.175 108 HD11 ILE 18 HD11 ILE 18 43.903 35.211 25.764 109 HD12 ILE 18 HD12 ILE 18 45.387 34.496 26.425 110 HD13 ILE 18 HD13 ILE 18 43.803 34.150 27.178 111 H TRP 19 H TRP 19 48.217 36.530 30.207 112 HA TRP 19 HA TRP 19 47.727 35.921 32.956 113 HB2 TRP 19 HB2 TRP 19 50.270 36.516 31.422 114 HB3 TRP 19 HB3 TRP 19 50.256 36.138 33.135 115 HD1 TRP 19 HD1 TRP 19 47.889 34.138 30.922 116 HE1 TRP 19 HE1 TRP 19 48.693 31.715 30.793 117 HE3 TRP 19 HE3 TRP 19 52.436 34.648 33.229 118 HZ2 TRP 19 HZ2 TRP 19 51.038 30.205 31.469 119 HZ3 TRP 19 HZ3 TRP 19 53.943 32.686 33.452 120 HH2 TRP 19 HH2 TRP 19 53.265 30.469 32.553 121 H GLN 20 H GLN 20 49.026 38.997 31.510 122 HA GLN 20 HA GLN 20 49.266 40.197 34.119 123 HB2 GLN 20 HB2 GLN 20 49.952 42.158 33.034 124 HB3 GLN 20 HB3 GLN 20 50.525 40.831 32.032 125 HG2 GLN 20 HG2 GLN 20 48.334 41.219 30.668 126 HG3 GLN 20 HG3 GLN 20 48.221 42.745 31.539 127 HE21 GLN 20 HE21 GLN 20 48.248 43.421 29.188 128 HE22 GLN 20 HE22 GLN 20 49.830 43.609 28.393 129 H ALA 21 H ALA 21 46.549 40.235 31.711 130 HA ALA 21 HA ALA 21 44.919 42.034 33.226 131 HB1 ALA 21 HB1 ALA 21 43.084 41.068 31.918 132 HB2 ALA 21 HB2 ALA 21 44.488 41.389 30.886 133 HB3 ALA 21 HB3 ALA 21 44.121 39.724 31.399 134 H LEU 22 H LEU 22 45.258 38.464 33.422 135 HA LEU 22 HA LEU 22 43.198 38.103 35.393 136 HB2 LEU 22 HB2 LEU 22 43.945 36.543 33.663 137 HB3 LEU 22 HB3 LEU 22 45.488 36.311 34.471 138 HG LEU 22 HG LEU 22 42.856 35.680 35.871 139 HD11 LEU 22 HD11 LEU 22 43.090 33.378 34.957 140 HD12 LEU 22 HD12 LEU 22 44.407 33.948 33.888 141 HD13 LEU 22 HD13 LEU 22 42.761 34.572 33.703 142 HD21 LEU 22 HD21 LEU 22 44.252 33.930 36.964 143 HD22 LEU 22 HD22 LEU 22 44.888 35.547 37.267 144 HD23 LEU 22 HD23 LEU 22 45.669 34.501 36.062 145 H PHE 23 H PHE 23 46.762 38.458 35.619 146 HA PHE 23 HA PHE 23 46.730 38.308 38.513 147 HB2 PHE 23 HB2 PHE 23 48.647 37.737 36.826 148 HB3 PHE 23 HB3 PHE 23 49.035 39.453 36.963 149 HD1 PHE 23 HD1 PHE 23 48.964 36.150 38.532 150 HD2 PHE 23 HD2 PHE 23 49.819 40.313 39.252 151 HE1 PHE 23 HE1 PHE 23 50.144 35.548 40.604 152 HE2 PHE 23 HE2 PHE 23 51.040 39.705 41.318 153 HZ PHE 23 HZ PHE 23 51.218 37.317 42.002 154 H ALA 24 H ALA 24 45.556 40.670 36.523 155 HA ALA 24 HA ALA 24 44.867 42.768 36.763 156 HB1 ALA 24 HB1 ALA 24 44.863 42.018 39.700 157 HB2 ALA 24 HB2 ALA 24 43.984 43.382 38.979 158 HB3 ALA 24 HB3 ALA 24 43.576 41.726 38.513 159 H LEU 25 H LEU 25 47.419 42.895 36.132 160 HA LEU 25 HA LEU 25 48.199 45.454 37.366 161 HB2 LEU 25 HB2 LEU 25 50.631 44.703 37.361 162 HB3 LEU 25 HB3 LEU 25 49.591 44.137 38.649 163 HG LEU 25 HG LEU 25 49.475 41.917 37.720 164 HD11 LEU 25 HD11 LEU 25 50.855 41.253 35.768 165 HD12 LEU 25 HD12 LEU 25 51.125 42.975 35.408 166 HD13 LEU 25 HD13 LEU 25 49.490 42.279 35.341 167 HD21 LEU 25 HD21 LEU 25 51.439 42.479 39.111 168 HD22 LEU 25 HD22 LEU 25 52.336 42.958 37.653 169 HD23 LEU 25 HD23 LEU 25 51.853 41.269 37.879 170 HA PRO 26 HA PRO 26 48.867 46.841 33.318 171 HB2 PRO 26 HB2 PRO 26 51.628 47.831 34.070 172 HB3 PRO 26 HB3 PRO 26 50.319 48.694 33.209 173 HG2 PRO 26 HG2 PRO 26 50.716 49.168 35.828 174 HG3 PRO 26 HG3 PRO 26 49.040 48.907 35.235 175 HD2 PRO 26 HD2 PRO 26 50.896 46.918 36.571 176 HD3 PRO 26 HD3 PRO 26 49.187 47.266 36.931 177 H ALA 27 H ALA 27 51.877 45.230 34.468 178 HA ALA 27 HA ALA 27 52.103 43.795 31.887 179 HB1 ALA 27 HB1 ALA 27 54.270 45.638 32.975 180 HB2 ALA 27 HB2 ALA 27 54.387 44.617 31.535 181 HB3 ALA 27 HB3 ALA 27 53.245 45.975 31.562 182 H VAL 28 H VAL 28 53.217 41.956 31.899 183 HA VAL 28 HA VAL 28 54.834 41.158 34.282 184 HB VAL 28 HB VAL 28 54.593 38.828 33.606 185 HG11 VAL 28 HG11 VAL 28 52.348 38.462 34.458 186 HG12 VAL 28 HG12 VAL 28 53.087 39.817 35.327 187 HG13 VAL 28 HG13 VAL 28 51.881 40.125 34.055 188 HG21 VAL 28 HG21 VAL 28 52.793 38.105 32.084 189 HG22 VAL 28 HG22 VAL 28 52.492 39.791 31.623 190 HG23 VAL 28 HG23 VAL 28 54.043 39.019 31.227 191 H GLY 29 H GLY 29 56.926 40.369 33.890 192 HA2 GLY 29 HA2 GLY 29 58.234 41.469 31.560 193 HA3 GLY 29 HA3 GLY 29 58.970 40.509 32.842 194 H ARG 30 H ARG 30 58.883 40.500 29.699 195 HA ARG 30 HA ARG 30 57.750 37.965 28.918 196 HB2 ARG 30 HB2 ARG 30 59.701 39.899 27.652 197 HB3 ARG 30 HB3 ARG 30 59.366 38.342 26.889 198 HG2 ARG 30 HG2 ARG 30 57.000 38.789 26.736 199 HG3 ARG 30 HG3 ARG 30 57.152 40.289 27.660 200 HD2 ARG 30 HD2 ARG 30 58.539 39.796 24.985 201 HD3 ARG 30 HD3 ARG 30 56.957 40.561 25.136 202 HE ARG 30 HE ARG 30 59.577 41.718 25.867 203 HH11 ARG 30 HH11 ARG 30 56.055 42.130 26.266 204 HH12 ARG 30 HH12 ARG 30 56.310 43.839 26.627 205 HH21 ARG 30 HH21 ARG 30 59.644 43.908 26.387 206 HH22 ARG 30 HH22 ARG 30 58.139 44.738 26.718 207 H HIS 31 H HIS 31 60.678 38.627 30.569 208 HA HIS 31 HA HIS 31 61.550 35.826 30.156 209 HB2 HIS 31 HB2 HIS 31 62.994 38.249 29.618 210 HB3 HIS 31 HB3 HIS 31 63.819 37.355 30.879 211 HD1 HIS 31 HD1 HIS 31 65.603 35.905 29.792 212 HD2 HIS 31 HD2 HIS 31 62.082 36.191 27.527 213 HE1 HIS 31 HE1 HIS 31 65.898 34.312 27.820 214 H GLN 32 H GLN 32 59.743 37.029 32.248 215 HA GLN 32 HA GLN 32 61.120 35.992 34.680 216 HB2 GLN 32 HB2 GLN 32 58.389 37.219 34.219 217 HB3 GLN 32 HB3 GLN 32 58.895 36.482 35.753 218 HG2 GLN 32 HG2 GLN 32 60.819 38.099 35.813 219 HG3 GLN 32 HG3 GLN 32 60.131 38.908 34.399 220 HE21 GLN 32 HE21 GLN 32 59.654 38.204 37.878 221 HE22 GLN 32 HE22 GLN 32 58.604 39.576 38.126 222 H ASP 33 H ASP 33 60.214 34.210 35.863 223 HA ASP 33 HA ASP 33 59.304 32.062 34.018 224 HB2 ASP 33 HB2 ASP 33 60.620 31.861 36.741 225 HB3 ASP 33 HB3 ASP 33 60.260 30.533 35.642 226 H PHE 34 H PHE 34 57.565 30.674 34.508 227 HA PHE 34 HA PHE 34 55.333 31.759 35.812 228 HB2 PHE 34 HB2 PHE 34 55.103 30.078 34.161 229 HB3 PHE 34 HB3 PHE 34 55.988 28.881 35.098 230 HD1 PHE 34 HD1 PHE 34 52.879 31.023 35.135 231 HD2 PHE 34 HD2 PHE 34 54.818 27.498 36.694 232 HE1 PHE 34 HE1 PHE 34 50.749 30.312 36.168 233 HE2 PHE 34 HE2 PHE 34 52.681 26.814 37.747 234 HZ PHE 34 HZ PHE 34 50.648 28.193 37.478 235 H PHE 35 H PHE 35 57.886 29.872 37.284 236 HA PHE 35 HA PHE 35 56.768 29.240 39.790 237 HB2 PHE 35 HB2 PHE 35 59.622 30.059 39.168 238 HB3 PHE 35 HB3 PHE 35 59.086 29.057 40.509 239 HD1 PHE 35 HD1 PHE 35 60.749 28.853 37.508 240 HD2 PHE 35 HD2 PHE 35 57.437 26.984 39.554 241 HE1 PHE 35 HE1 PHE 35 60.981 26.849 36.071 242 HE2 PHE 35 HE2 PHE 35 57.649 25.004 38.075 243 HZ PHE 35 HZ PHE 35 59.411 24.941 36.314 244 H ALA 36 H ALA 36 57.641 32.404 38.598 245 HA ALA 36 HA ALA 36 57.047 33.585 41.295 246 HB1 ALA 36 HB1 ALA 36 58.376 34.776 38.836 247 HB2 ALA 36 HB2 ALA 36 58.056 35.626 40.361 248 HB3 ALA 36 HB3 ALA 36 59.203 34.266 40.332 249 H LEU 37 H LEU 37 56.284 33.784 37.792 250 HA LEU 37 HA LEU 37 54.503 35.966 38.022 251 HB2 LEU 37 HB2 LEU 37 54.699 33.753 35.936 252 HB3 LEU 37 HB3 LEU 37 53.720 35.181 35.721 253 HG LEU 37 HG LEU 37 56.754 35.224 36.055 254 HD11 LEU 37 HD11 LEU 37 56.714 35.754 33.626 255 HD12 LEU 37 HD12 LEU 37 54.958 35.510 33.611 256 HD13 LEU 37 HD13 LEU 37 56.059 34.154 33.981 257 HD21 LEU 37 HD21 LEU 37 56.435 37.567 35.131 258 HD22 LEU 37 HD22 LEU 37 55.876 37.329 36.789 259 HD23 LEU 37 HD23 LEU 37 54.701 37.386 35.457 260 H GLY 38 H GLY 38 53.795 32.578 38.553 261 HA2 GLY 38 HA2 GLY 38 50.907 32.899 38.142 262 HA3 GLY 38 HA3 GLY 38 51.729 31.463 38.775 263 H GLY 39 H GLY 39 52.991 33.307 40.916 264 HA2 GLY 39 HA2 GLY 39 52.643 34.237 42.930 265 HA3 GLY 39 HA3 GLY 39 51.051 34.718 42.379 266 H ASP 40 H ASP 40 49.934 32.022 42.171 267 HA ASP 40 HA ASP 40 50.172 30.745 44.809 268 HB2 ASP 40 HB2 ASP 40 48.377 32.711 44.803 269 HB3 ASP 40 HB3 ASP 40 47.395 31.568 43.897 270 H SER 41 H SER 41 49.211 28.537 44.762 271 HA SER 41 HA SER 41 49.118 27.301 42.128 272 HB2 SER 41 HB2 SER 41 48.369 25.305 43.345 273 HB3 SER 41 HB3 SER 41 49.803 26.029 44.099 274 HG SER 41 HG SER 41 47.861 25.346 45.415 275 H GLN 42 H GLN 42 46.633 28.547 44.299 276 HA GLN 42 HA GLN 42 44.314 27.557 42.898 277 HB2 GLN 42 HB2 GLN 42 44.859 29.967 44.655 278 HB3 GLN 42 HB3 GLN 42 43.227 29.520 44.130 279 HG2 GLN 42 HG2 GLN 42 43.414 27.416 45.392 280 HG3 GLN 42 HG3 GLN 42 45.125 27.763 45.717 281 HE21 GLN 42 HE21 GLN 42 45.683 29.646 47.034 282 HE22 GLN 42 HE22 GLN 42 44.585 29.957 48.389 283 H LEU 43 H LEU 43 46.191 30.585 42.664 284 HA LEU 43 HA LEU 43 44.626 31.674 40.519 285 HB2 LEU 43 HB2 LEU 43 46.002 32.905 42.270 286 HB3 LEU 43 HB3 LEU 43 47.434 32.495 41.351 287 HG LEU 43 HG LEU 43 46.517 34.812 41.078 288 HD11 LEU 43 HD11 LEU 43 47.975 33.847 39.322 289 HD12 LEU 43 HD12 LEU 43 46.836 35.059 38.723 290 HD13 LEU 43 HD13 LEU 43 46.530 33.341 38.427 291 HD21 LEU 43 HD21 LEU 43 44.584 35.276 39.724 292 HD22 LEU 43 HD22 LEU 43 44.093 34.217 41.057 293 HD23 LEU 43 HD23 LEU 43 44.306 33.561 39.409 294 H GLY 44 H GLY 44 47.655 29.732 40.609 295 HA2 GLY 44 HA2 GLY 44 48.229 29.684 37.833 296 HA3 GLY 44 HA3 GLY 44 48.592 28.400 38.994 297 H LEU 45 H LEU 45 46.113 27.444 39.727 298 HA LEU 45 HA LEU 45 45.103 25.972 37.490 299 HB2 LEU 45 HB2 LEU 45 44.075 26.596 40.272 300 HB3 LEU 45 HB3 LEU 45 43.037 25.746 39.136 301 HG LEU 45 HG LEU 45 45.821 24.737 39.834 302 HD11 LEU 45 HD11 LEU 45 44.612 23.160 41.340 303 HD12 LEU 45 HD12 LEU 45 43.108 24.065 41.064 304 HD13 LEU 45 HD13 LEU 45 44.491 24.847 41.872 305 HD21 LEU 45 HD21 LEU 45 44.780 23.813 37.739 306 HD22 LEU 45 HD22 LEU 45 43.356 23.336 38.681 307 HD23 LEU 45 HD23 LEU 45 44.940 22.596 39.007 308 H ARG 46 H ARG 46 43.825 28.977 38.994 309 HA ARG 46 HA ARG 46 41.592 29.300 37.179 310 HB2 ARG 46 HB2 ARG 46 41.662 30.474 39.296 311 HB3 ARG 46 HB3 ARG 46 43.181 31.267 38.870 312 HG2 ARG 46 HG2 ARG 46 42.084 32.569 37.127 313 HG3 ARG 46 HG3 ARG 46 40.547 31.725 37.416 314 HD2 ARG 46 HD2 ARG 46 40.175 32.819 39.441 315 HD3 ARG 46 HD3 ARG 46 41.902 33.085 39.731 316 HE ARG 46 HE ARG 46 40.833 34.571 37.442 317 HH11 ARG 46 HH11 ARG 46 41.171 34.805 40.946 318 HH12 ARG 46 HH12 ARG 46 41.582 36.522 40.835 319 HH21 ARG 46 HH21 ARG 46 41.004 36.767 37.491 320 HH22 ARG 46 HH22 ARG 46 41.431 37.576 38.979 321 H MET 47 H MET 47 44.971 30.348 36.972 322 HA MET 47 HA MET 47 44.736 31.916 34.620 323 HB2 MET 47 HB2 MET 47 46.571 32.050 36.246 324 HB3 MET 47 HB3 MET 47 47.141 30.451 35.759 325 HG2 MET 47 HG2 MET 47 47.625 31.290 33.513 326 HG3 MET 47 HG3 MET 47 46.988 32.884 33.938 327 HE1 MET 47 HE1 MET 47 48.088 33.827 36.623 328 HE2 MET 47 HE2 MET 47 49.703 34.434 36.210 329 HE3 MET 47 HE3 MET 47 48.336 34.743 35.116 330 H LEU 48 H LEU 48 45.660 28.451 34.995 331 HA LEU 48 HA LEU 48 45.732 27.827 32.206 332 HB2 LEU 48 HB2 LEU 48 46.574 26.257 33.806 333 HB3 LEU 48 HB3 LEU 48 45.056 26.230 34.697 334 HG LEU 48 HG LEU 48 43.928 25.064 32.834 335 HD11 LEU 48 HD11 LEU 48 45.220 24.113 30.976 336 HD12 LEU 48 HD12 LEU 48 46.676 24.966 31.526 337 HD13 LEU 48 HD13 LEU 48 45.278 25.872 30.909 338 HD21 LEU 48 HD21 LEU 48 46.509 23.715 33.698 339 HD22 LEU 48 HD22 LEU 48 45.013 22.922 33.136 340 HD23 LEU 48 HD23 LEU 48 45.013 23.823 34.659 341 H ALA 49 H ALA 49 42.930 27.536 34.481 342 HA ALA 49 HA ALA 49 41.090 26.613 32.556 343 HB1 ALA 49 HB1 ALA 49 40.657 28.237 35.118 344 HB2 ALA 49 HB2 ALA 49 39.381 27.382 34.237 345 HB3 ALA 49 HB3 ALA 49 40.707 26.465 34.975 346 H GLN 50 H GLN 50 41.612 30.033 33.596 347 HA GLN 50 HA GLN 50 39.602 30.998 31.739 348 HB2 GLN 50 HB2 GLN 50 41.667 32.444 33.408 349 HB3 GLN 50 HB3 GLN 50 40.411 33.242 32.450 350 HG2 GLN 50 HG2 GLN 50 38.658 32.035 33.741 351 HG3 GLN 50 HG3 GLN 50 39.889 31.276 34.736 352 HE21 GLN 50 HE21 GLN 50 38.090 32.521 36.203 353 HE22 GLN 50 HE22 GLN 50 38.622 34.125 36.705 354 H LEU 51 H LEU 51 43.219 30.694 31.489 355 HA LEU 51 HA LEU 51 43.329 32.017 28.915 356 HB2 LEU 51 HB2 LEU 51 45.320 31.666 30.168 357 HB3 LEU 51 HB3 LEU 51 45.045 29.908 30.252 358 HG LEU 51 HG LEU 51 45.417 29.752 27.786 359 HD11 LEU 51 HD11 LEU 51 46.291 32.662 28.073 360 HD12 LEU 51 HD12 LEU 51 44.905 32.066 27.130 361 HD13 LEU 51 HD13 LEU 51 46.550 31.632 26.648 362 HD21 LEU 51 HD21 LEU 51 47.214 29.288 29.392 363 HD22 LEU 51 HD22 LEU 51 47.662 31.011 29.400 364 HD23 LEU 51 HD23 LEU 51 47.856 30.038 27.927 365 H ARG 52 H ARG 52 42.749 28.559 29.825 366 HA ARG 52 HA ARG 52 42.509 27.764 27.091 367 HB2 ARG 52 HB2 ARG 52 42.972 26.274 29.115 368 HB3 ARG 52 HB3 ARG 52 41.226 26.284 29.411 369 HG2 ARG 52 HG2 ARG 52 40.798 25.449 27.167 370 HG3 ARG 52 HG3 ARG 52 42.497 25.571 26.718 371 HD2 ARG 52 HD2 ARG 52 43.093 23.778 28.231 372 HD3 ARG 52 HD3 ARG 52 41.418 23.661 28.821 373 HE ARG 52 HE ARG 52 41.228 23.413 26.050 374 HH11 ARG 52 HH11 ARG 52 42.919 21.477 28.466 375 HH12 ARG 52 HH12 ARG 52 42.855 20.058 27.439 376 HH21 ARG 52 HH21 ARG 52 41.213 21.650 24.875 377 HH22 ARG 52 HH22 ARG 52 42.014 20.189 25.395 378 H GLU 53 H GLU 53 40.028 28.806 29.415 379 HA GLU 53 HA GLU 53 37.855 28.413 27.539 380 HB2 GLU 53 HB2 GLU 53 38.080 29.868 30.188 381 HB3 GLU 53 HB3 GLU 53 36.569 29.777 29.272 382 HG2 GLU 53 HG2 GLU 53 36.470 27.398 29.401 383 HG3 GLU 53 HG3 GLU 53 38.127 27.258 29.969 384 H ARG 54 H ARG 54 39.906 31.266 28.155 385 HA ARG 54 HA ARG 54 38.294 32.978 26.351 386 HB2 ARG 54 HB2 ARG 54 41.030 33.364 27.632 387 HB3 ARG 54 HB3 ARG 54 40.192 34.581 26.677 388 HG2 ARG 54 HG2 ARG 54 38.402 34.800 28.289 389 HG3 ARG 54 HG3 ARG 54 39.001 33.437 29.239 390 HD2 ARG 54 HD2 ARG 54 41.167 34.715 29.571 391 HD3 ARG 54 HD3 ARG 54 40.391 36.110 28.796 392 HE ARG 54 HE ARG 54 38.780 35.122 30.986 393 HH11 ARG 54 HH11 ARG 54 41.622 37.177 30.400 394 HH12 ARG 54 HH12 ARG 54 41.539 37.782 32.039 395 HH21 ARG 54 HH21 ARG 54 38.699 36.336 32.933 396 HH22 ARG 54 HH22 ARG 54 40.053 37.394 33.296 397 H HIS 55 H HIS 55 41.267 31.064 26.097 398 HA HIS 55 HA HIS 55 41.569 31.952 23.270 399 HB2 HIS 55 HB2 HIS 55 43.095 32.907 25.231 400 HB3 HIS 55 HB3 HIS 55 43.892 31.368 25.094 401 HD1 HIS 55 HD1 HIS 55 42.664 33.754 22.238 402 HD2 HIS 55 HD2 HIS 55 46.068 31.762 23.701 403 HE1 HIS 55 HE1 HIS 55 44.499 34.091 20.503 404 H GLY 56 H GLY 56 41.009 29.073 24.933 405 HA2 GLY 56 HA2 GLY 56 41.146 26.888 24.232 406 HA3 GLY 56 HA3 GLY 56 41.655 27.470 22.650 407 H VAL 57 H VAL 57 43.650 28.339 25.388 408 HA VAL 57 HA VAL 57 45.808 26.590 24.285 409 HB VAL 57 HB VAL 57 45.943 29.355 25.479 410 HG11 VAL 57 HG11 VAL 57 48.276 27.499 24.823 411 HG12 VAL 57 HG12 VAL 57 48.404 29.237 25.174 412 HG13 VAL 57 HG13 VAL 57 47.858 28.127 26.430 413 HG21 VAL 57 HG21 VAL 57 46.819 28.117 22.824 414 HG22 VAL 57 HG22 VAL 57 45.442 29.206 23.066 415 HG23 VAL 57 HG23 VAL 57 47.094 29.799 23.296 416 H ASP 58 H ASP 58 47.091 25.439 25.475 417 HA ASP 58 HA ASP 58 46.151 24.601 28.148 418 HB2 ASP 58 HB2 ASP 58 46.545 23.168 25.919 419 HB3 ASP 58 HB3 ASP 58 48.212 23.163 26.471 420 H LEU 59 H LEU 59 47.922 23.866 29.674 421 HA LEU 59 HA LEU 59 50.444 25.442 29.453 422 HB2 LEU 59 HB2 LEU 59 48.860 26.564 31.038 423 HB3 LEU 59 HB3 LEU 59 48.893 25.118 32.043 424 HG LEU 59 HG LEU 59 51.346 25.425 32.399 425 HD11 LEU 59 HD11 LEU 59 50.912 27.940 30.740 426 HD12 LEU 59 HD12 LEU 59 52.039 26.608 30.403 427 HD13 LEU 59 HD13 LEU 59 52.325 27.668 31.787 428 HD21 LEU 59 HD21 LEU 59 51.159 27.392 33.857 429 HD22 LEU 59 HD22 LEU 59 49.707 26.395 33.971 430 HD23 LEU 59 HD23 LEU 59 49.673 27.900 33.021 431 HA PRO 60 HA PRO 60 50.855 20.922 29.958 432 HB2 PRO 60 HB2 PRO 60 52.986 21.054 27.875 433 HB3 PRO 60 HB3 PRO 60 51.531 20.013 27.953 434 HG2 PRO 60 HG2 PRO 60 51.654 22.117 26.229 435 HG3 PRO 60 HG3 PRO 60 50.139 21.741 27.120 436 HD2 PRO 60 HD2 PRO 60 52.290 23.752 27.881 437 HD3 PRO 60 HD3 PRO 60 50.540 24.011 27.696 438 H LEU 61 H LEU 61 52.136 19.767 31.312 439 HA LEU 61 HA LEU 61 54.156 21.126 32.787 440 HB2 LEU 61 HB2 LEU 61 53.365 18.187 32.688 441 HB3 LEU 61 HB3 LEU 61 54.453 18.877 33.891 442 HG LEU 61 HG LEU 61 51.544 19.717 33.496 443 HD11 LEU 61 HD11 LEU 61 52.836 18.100 35.721 444 HD12 LEU 61 HD12 LEU 61 51.819 17.426 34.425 445 HD13 LEU 61 HD13 LEU 61 51.125 18.560 35.597 446 HD21 LEU 61 HD21 LEU 61 51.861 20.874 35.679 447 HD22 LEU 61 HD22 LEU 61 52.856 21.583 34.423 448 HD23 LEU 61 HD23 LEU 61 53.594 20.497 35.625 449 H ARG 62 H ARG 62 54.556 18.953 30.009 450 HA ARG 62 HA ARG 62 57.463 18.785 30.233 451 HB2 ARG 62 HB2 ARG 62 55.426 18.229 28.073 452 HB3 ARG 62 HB3 ARG 62 57.084 18.524 27.573 453 HG2 ARG 62 HG2 ARG 62 56.782 16.162 27.811 454 HG3 ARG 62 HG3 ARG 62 57.917 16.738 29.030 455 HD2 ARG 62 HD2 ARG 62 56.083 16.679 30.732 456 HD3 ARG 62 HD3 ARG 62 54.986 16.045 29.505 457 HE ARG 62 HE ARG 62 57.187 14.647 30.883 458 HH11 ARG 62 HH11 ARG 62 54.923 14.399 28.176 459 HH12 ARG 62 HH12 ARG 62 54.991 12.662 28.186 460 HH21 ARG 62 HH21 ARG 62 57.358 12.460 30.687 461 HH22 ARG 62 HH22 ARG 62 56.387 11.597 29.509 462 H CYS 63 H CYS 63 55.350 21.128 28.592 463 HA CYS 63 HA CYS 63 57.481 22.748 27.480 464 HB2 CYS 63 HB2 CYS 63 55.268 22.827 26.520 465 HB3 CYS 63 HB3 CYS 63 54.548 23.285 28.080 466 HG CYS 63 HG CYS 63 56.733 25.018 26.222 467 H LEU 64 H LEU 64 55.493 23.023 30.462 468 HA LEU 64 HA LEU 64 56.796 25.283 31.589 469 HB2 LEU 64 HB2 LEU 64 54.608 23.951 32.187 470 HB3 LEU 64 HB3 LEU 64 55.669 22.967 33.184 471 HG LEU 64 HG LEU 64 56.380 25.083 34.398 472 HD11 LEU 64 HD11 LEU 64 54.791 27.038 34.145 473 HD12 LEU 64 HD12 LEU 64 54.149 26.277 32.685 474 HD13 LEU 64 HD13 LEU 64 55.844 26.812 32.752 475 HD21 LEU 64 HD21 LEU 64 53.393 24.454 34.337 476 HD22 LEU 64 HD22 LEU 64 54.256 25.287 35.643 477 HD23 LEU 64 HD23 LEU 64 54.628 23.596 35.290 478 H TYR 65 H TYR 65 57.666 21.801 31.802 479 HA TYR 65 HA TYR 65 59.861 22.165 33.604 480 HB2 TYR 65 HB2 TYR 65 58.808 19.987 33.195 481 HB3 TYR 65 HB3 TYR 65 59.330 20.010 31.521 482 HD1 TYR 65 HD1 TYR 65 60.671 20.183 35.023 483 HD2 TYR 65 HD2 TYR 65 61.363 18.941 30.956 484 HE1 TYR 65 HE1 TYR 65 62.809 19.116 35.718 485 HE2 TYR 65 HE2 TYR 65 63.487 17.845 31.655 486 HH TYR 65 HH TYR 65 64.970 17.547 33.332 487 H GLU 66 H GLU 66 59.749 22.111 29.994 488 HA GLU 66 HA GLU 66 62.678 22.503 29.911 489 HB2 GLU 66 HB2 GLU 66 62.577 21.953 27.652 490 HB3 GLU 66 HB3 GLU 66 61.449 20.870 28.469 491 HG2 GLU 66 HG2 GLU 66 59.597 22.497 27.746 492 HG3 GLU 66 HG3 GLU 66 60.802 23.307 26.750 493 H ALA 67 H ALA 67 59.980 24.604 29.708 494 HA ALA 67 HA ALA 67 61.616 26.928 28.885 495 HB1 ALA 67 HB1 ALA 67 60.814 25.902 26.803 496 HB2 ALA 67 HB2 ALA 67 59.153 25.847 27.434 497 HB3 ALA 67 HB3 ALA 67 59.920 27.400 27.096 498 HA PRO 68 HA PRO 68 58.172 27.463 32.180 499 HB2 PRO 68 HB2 PRO 68 59.650 28.403 34.291 500 HB3 PRO 68 HB3 PRO 68 59.520 26.667 33.915 501 HG2 PRO 68 HG2 PRO 68 61.701 28.601 33.030 502 HG3 PRO 68 HG3 PRO 68 61.909 27.025 33.880 503 HD2 PRO 68 HD2 PRO 68 62.141 27.153 31.206 504 HD3 PRO 68 HD3 PRO 68 61.235 25.798 31.954 505 H THR 69 H THR 69 60.389 29.550 30.667 506 HA THR 69 HA THR 69 59.475 32.042 31.943 507 HB THR 69 HB THR 69 61.397 32.039 29.645 508 HG1 THR 69 HG1 THR 69 62.117 31.209 32.262 509 HG21 THR 69 HG21 THR 69 60.706 34.056 30.988 510 HG22 THR 69 HG22 THR 69 62.468 33.747 30.969 511 HG23 THR 69 HG23 THR 69 61.492 33.324 32.395 512 H VAL 70 H VAL 70 58.040 33.470 30.985 513 HA VAL 70 HA VAL 70 56.252 32.252 29.281 514 HB VAL 70 HB VAL 70 55.116 34.450 28.981 515 HG11 VAL 70 HG11 VAL 70 54.635 32.933 30.810 516 HG12 VAL 70 HG12 VAL 70 55.944 33.635 31.780 517 HG13 VAL 70 HG13 VAL 70 54.518 34.615 31.347 518 HG21 VAL 70 HG21 VAL 70 55.877 36.373 30.296 519 HG22 VAL 70 HG22 VAL 70 57.376 35.533 30.719 520 HG23 VAL 70 HG23 VAL 70 57.034 35.958 29.022 521 H ALA 71 H ALA 71 58.780 34.503 28.003 522 HA ALA 71 HA ALA 71 57.738 34.460 25.330 523 HB1 ALA 71 HB1 ALA 71 60.615 34.693 26.316 524 HB2 ALA 71 HB2 ALA 71 60.040 35.074 24.678 525 HB3 ALA 71 HB3 ALA 71 59.471 36.033 26.054 526 H ARG 72 H ARG 72 59.967 32.200 26.992 527 HA ARG 72 HA ARG 72 60.469 30.487 24.691 528 HB2 ARG 72 HB2 ARG 72 60.642 29.719 27.641 529 HB3 ARG 72 HB3 ARG 72 61.449 28.959 26.267 530 HG2 ARG 72 HG2 ARG 72 62.779 31.055 25.936 531 HG3 ARG 72 HG3 ARG 72 62.010 31.748 27.363 532 HD2 ARG 72 HD2 ARG 72 64.118 30.917 28.076 533 HD3 ARG 72 HD3 ARG 72 62.873 29.845 28.735 534 HE ARG 72 HE ARG 72 64.161 29.067 26.171 535 HH11 ARG 72 HH11 ARG 72 64.407 28.613 29.650 536 HH12 ARG 72 HH12 ARG 72 65.072 27.022 29.488 537 HH21 ARG 72 HH21 ARG 72 65.122 27.079 26.050 538 HH22 ARG 72 HH22 ARG 72 65.400 26.158 27.510 539 H LEU 73 H LEU 73 58.220 30.353 27.429 540 HA LEU 73 HA LEU 73 56.858 27.957 26.857 541 HB2 LEU 73 HB2 LEU 73 56.771 29.545 28.891 542 HB3 LEU 73 HB3 LEU 73 55.683 30.539 27.960 543 HG LEU 73 HG LEU 73 54.452 28.055 27.732 544 HD11 LEU 73 HD11 LEU 73 55.568 28.300 30.562 545 HD12 LEU 73 HD12 LEU 73 56.072 27.088 29.371 546 HD13 LEU 73 HD13 LEU 73 54.411 27.076 29.984 547 HD21 LEU 73 HD21 LEU 73 54.022 30.148 29.903 548 HD22 LEU 73 HD22 LEU 73 52.842 28.937 29.350 549 HD23 LEU 73 HD23 LEU 73 53.376 30.211 28.245 550 H ALA 74 H ALA 74 55.952 31.319 25.837 551 HA ALA 74 HA ALA 74 53.714 30.426 24.280 552 HB1 ALA 74 HB1 ALA 74 53.572 32.762 23.635 553 HB2 ALA 74 HB2 ALA 74 53.965 32.654 25.358 554 HB3 ALA 74 HB3 ALA 74 55.240 33.062 24.185 555 H GLU 75 H GLU 75 57.130 31.122 23.395 556 HA GLU 75 HA GLU 75 56.643 30.864 20.540 557 HB2 GLU 75 HB2 GLU 75 59.175 30.784 22.213 558 HB3 GLU 75 HB3 GLU 75 59.180 30.604 20.464 559 HG2 GLU 75 HG2 GLU 75 57.972 33.035 21.852 560 HG3 GLU 75 HG3 GLU 75 59.650 32.939 21.324 561 H THR 76 H THR 76 57.609 28.503 23.075 562 HA THR 76 HA THR 76 57.884 26.307 21.187 563 HB THR 76 HB THR 76 57.621 24.825 23.217 564 HG1 THR 76 HG1 THR 76 57.879 27.229 24.640 565 HG21 THR 76 HG21 THR 76 59.820 25.485 24.183 566 HG22 THR 76 HG22 THR 76 59.750 27.015 23.277 567 HG23 THR 76 HG23 THR 76 59.842 25.470 22.410 568 H ILE 77 H ILE 77 55.149 27.400 23.272 569 HA ILE 77 HA ILE 77 53.318 25.410 22.404 570 HB ILE 77 HB ILE 77 53.026 28.194 23.535 571 HG12 ILE 77 HG12 ILE 77 53.797 26.265 24.961 572 HG13 ILE 77 HG13 ILE 77 52.372 27.106 25.544 573 HG21 ILE 77 HG21 ILE 77 50.593 27.769 23.904 574 HG22 ILE 77 HG22 ILE 77 51.033 28.102 22.231 575 HG23 ILE 77 HG23 ILE 77 50.686 26.432 22.737 576 HD11 ILE 77 HD11 ILE 77 52.265 24.453 24.031 577 HD12 ILE 77 HD12 ILE 77 52.285 24.628 25.787 578 HD13 ILE 77 HD13 ILE 77 50.921 25.274 24.861 579 H VAL 78 H VAL 78 54.083 28.547 20.804 580 HA VAL 78 HA VAL 78 52.158 27.967 18.664 581 HB VAL 78 HB VAL 78 54.297 30.101 18.838 582 HG11 VAL 78 HG11 VAL 78 51.957 29.793 16.888 583 HG12 VAL 78 HG12 VAL 78 53.053 31.187 16.998 584 HG13 VAL 78 HG13 VAL 78 53.673 29.633 16.466 585 HG21 VAL 78 HG21 VAL 78 51.255 30.225 19.192 586 HG22 VAL 78 HG22 VAL 78 52.424 30.319 20.516 587 HG23 VAL 78 HG23 VAL 78 52.383 31.592 19.295 588 H ARG 79 H ARG 79 55.732 27.606 18.934 589 HA ARG 79 HA ARG 79 56.290 26.695 16.296 590 HB2 ARG 79 HB2 ARG 79 58.036 27.218 17.892 591 HB3 ARG 79 HB3 ARG 79 57.434 26.032 19.032 592 HG2 ARG 79 HG2 ARG 79 59.419 25.215 18.168 593 HG3 ARG 79 HG3 ARG 79 58.177 24.190 17.502 594 HD2 ARG 79 HD2 ARG 79 59.220 26.559 15.935 595 HD3 ARG 79 HD3 ARG 79 60.170 25.067 16.065 596 HE ARG 79 HE ARG 79 57.565 24.323 15.237 597 HH11 ARG 79 HH11 ARG 79 60.260 26.172 13.903 598 HH12 ARG 79 HH12 ARG 79 59.943 25.555 12.285 599 HH21 ARG 79 HH21 ARG 79 57.417 23.454 13.175 600 HH22 ARG 79 HH22 ARG 79 58.346 24.152 11.886 601 H LEU 80 H LEU 80 55.410 24.823 19.166 602 HA LEU 80 HA LEU 80 55.264 22.319 17.616 603 HB2 LEU 80 HB2 LEU 80 55.138 22.808 20.617 604 HB3 LEU 80 HB3 LEU 80 55.309 21.246 19.825 605 HG LEU 80 HG LEU 80 57.385 23.473 19.657 606 HD11 LEU 80 HD11 LEU 80 58.720 22.125 21.164 607 HD12 LEU 80 HD12 LEU 80 57.404 20.934 21.321 608 HD13 LEU 80 HD13 LEU 80 57.197 22.591 21.938 609 HD21 LEU 80 HD21 LEU 80 57.516 20.533 18.848 610 HD22 LEU 80 HD22 LEU 80 58.847 21.706 18.780 611 HD23 LEU 80 HD23 LEU 80 57.451 21.906 17.721 612 H ALA 81 H ALA 81 53.091 24.664 18.125 613 HA ALA 81 HA ALA 81 50.866 24.857 18.078 614 HB1 ALA 81 HB1 ALA 81 51.389 23.883 15.910 615 HB2 ALA 81 HB2 ALA 81 51.144 22.249 16.565 616 HB3 ALA 81 HB3 ALA 81 49.779 23.383 16.448 617 H ALA 82 H ALA 82 51.523 24.048 20.559 618 HA ALA 82 HA ALA 82 50.764 23.160 22.521 619 HB1 ALA 82 HB1 ALA 82 49.018 24.791 21.674 620 HB2 ALA 82 HB2 ALA 82 48.057 23.400 21.148 621 HB3 ALA 82 HB3 ALA 82 48.420 23.654 22.866 622 HA PRO 83 HA PRO 83 49.785 18.791 22.573 623 HB2 PRO 83 HB2 PRO 83 47.172 19.153 24.042 624 HB3 PRO 83 HB3 PRO 83 48.530 18.036 24.400 625 HG2 PRO 83 HG2 PRO 83 48.289 20.302 25.823 626 HG3 PRO 83 HG3 PRO 83 49.903 19.864 25.174 627 HD2 PRO 83 HD2 PRO 83 47.852 21.757 23.969 628 HD3 PRO 83 HD3 PRO 83 49.591 22.056 24.293 629 H ALA 84 H ALA 84 48.414 20.360 20.311 630 HA ALA 84 HA ALA 84 46.948 20.164 18.627 631 HB1 ALA 84 HB1 ALA 84 48.416 18.372 18.049 632 HB2 ALA 84 HB2 ALA 84 47.516 17.229 19.051 633 HB3 ALA 84 HB3 ALA 84 46.769 17.936 17.598 634 HA PRO 85 HA PRO 85 43.072 19.420 21.085 635 HB2 PRO 85 HB2 PRO 85 42.174 21.968 21.380 636 HB3 PRO 85 HB3 PRO 85 43.457 21.274 22.412 637 HG2 PRO 85 HG2 PRO 85 43.813 22.961 19.907 638 HG3 PRO 85 HG3 PRO 85 44.520 23.244 21.532 639 HD2 PRO 85 HD2 PRO 85 45.909 21.949 19.591 640 HD3 PRO 85 HD3 PRO 85 46.018 21.446 21.303 641 H SER 86 H SER 86 43.783 19.821 17.966 642 HA SER 86 HA SER 86 42.660 19.823 16.007 643 HB2 SER 86 HB2 SER 86 40.411 18.755 17.746 644 HB3 SER 86 HB3 SER 86 40.429 18.730 15.976 645 HG SER 86 HG SER 86 41.513 17.039 16.068 646 H GLY 87 H GLY 87 42.839 22.383 16.952 647 HA2 GLY 87 HA2 GLY 87 41.213 23.807 15.271 648 HA3 GLY 87 HA3 GLY 87 40.319 23.802 16.790 649 H ASP 88 H ASP 88 41.261 26.160 15.669 650 HA ASP 88 HA ASP 88 43.017 27.080 17.869 651 HB2 ASP 88 HB2 ASP 88 43.545 27.478 14.903 652 HB3 ASP 88 HB3 ASP 88 44.138 28.627 16.107 653 H GLN 89 H GLN 89 42.386 28.995 18.769 654 HA GLN 89 HA GLN 89 40.320 30.612 17.356 655 HB2 GLN 89 HB2 GLN 89 39.231 31.096 19.402 656 HB3 GLN 89 HB3 GLN 89 39.276 29.366 19.094 657 HG2 GLN 89 HG2 GLN 89 41.207 29.178 20.692 658 HG3 GLN 89 HG3 GLN 89 41.040 30.914 21.039 659 HE21 GLN 89 HE21 GLN 89 39.166 27.804 21.045 660 HE22 GLN 89 HE22 GLN 89 38.229 28.282 22.443 661 H ASP 90 H ASP 90 40.283 32.832 17.683 662 HA ASP 90 HA ASP 90 42.201 34.245 19.364 663 HB2 ASP 90 HB2 ASP 90 43.714 33.892 17.521 664 HB3 ASP 90 HB3 ASP 90 42.462 34.247 16.329 665 H ASP 91 H ASP 91 41.004 35.874 20.194 666 HA ASP 91 HA ASP 91 38.777 37.032 18.555 667 HB2 ASP 91 HB2 ASP 91 38.309 35.413 20.499 668 HB3 ASP 91 HB3 ASP 91 38.832 36.714 21.567 669 H ALA 92 H ALA 92 41.692 37.946 20.036 670 HA ALA 92 HA ALA 92 40.861 40.666 20.765 671 HB1 ALA 92 HB1 ALA 92 42.475 39.388 22.119 672 HB2 ALA 92 HB2 ALA 92 43.590 39.323 20.736 673 HB3 ALA 92 HB3 ALA 92 43.189 40.878 21.482 674 H SER 93 H SER 93 41.641 42.598 19.832 675 HA SER 93 HA SER 93 43.124 42.542 17.270 676 HB2 SER 93 HB2 SER 93 40.432 43.955 17.521 677 HB3 SER 93 HB3 SER 93 41.524 43.996 16.127 678 HG SER 93 HG SER 93 39.940 41.906 17.131 679 H GLU 94 H GLU 94 43.976 44.623 16.653 680 HA GLU 94 HA GLU 94 44.307 46.548 18.859 681 HB2 GLU 94 HB2 GLU 94 45.911 47.623 17.498 682 HB3 GLU 94 HB3 GLU 94 46.214 45.886 17.436 683 HG2 GLU 94 HG2 GLU 94 45.010 45.801 15.217 684 HG3 GLU 94 HG3 GLU 94 44.837 47.563 15.294 685 H TYR 95 H TYR 95 43.799 48.679 18.796 686 HA TYR 95 HA TYR 95 42.120 49.816 16.622 687 HB2 TYR 95 HB2 TYR 95 40.698 49.387 18.577 688 HB3 TYR 95 HB3 TYR 95 41.815 50.253 19.621 689 HD1 TYR 95 HD1 TYR 95 40.054 50.901 16.337 690 HD2 TYR 95 HD2 TYR 95 41.043 52.368 20.276 691 HE1 TYR 95 HE1 TYR 95 39.110 53.115 15.745 692 HE2 TYR 95 HE2 TYR 95 40.044 54.562 19.696 693 HH TYR 95 HH TYR 95 38.790 55.262 16.408 694 H GLU 96 H GLU 96 42.340 52.529 17.638 695 HA GLU 96 HA GLU 96 45.266 52.990 17.719 696 HB2 GLU 96 HB2 GLU 96 44.487 53.055 15.354 697 HB3 GLU 96 HB3 GLU 96 43.347 54.337 15.776 698 HG2 GLU 96 HG2 GLU 96 45.348 55.270 14.731 699 HG3 GLU 96 HG3 GLU 96 45.244 55.822 16.399 700 H GLU 97 H GLU 97 45.962 54.573 18.933 701 HA GLU 97 HA GLU 97 44.228 56.849 19.678 702 HB2 GLU 97 HB2 GLU 97 43.985 55.036 21.423 703 HB3 GLU 97 HB3 GLU 97 45.691 55.271 21.829 704 HG2 GLU 97 HG2 GLU 97 45.279 57.476 22.666 705 HG3 GLU 97 HG3 GLU 97 43.693 57.558 21.878 706 H GLY 98 H GLY 98 47.140 55.822 18.475 707 HA2 GLY 98 HA2 GLY 98 48.993 57.715 19.673 708 HA3 GLY 98 HA3 GLY 98 49.232 56.755 18.213 709 H VAL 99 H VAL 99 48.628 57.586 16.188 710 HA VAL 99 HA VAL 99 48.538 59.190 14.620 711 HB VAL 99 HB VAL 99 46.414 60.681 16.174 712 HG11 VAL 99 HG11 VAL 99 47.056 61.585 13.949 713 HG12 VAL 99 HG12 VAL 99 46.809 59.984 13.223 714 HG13 VAL 99 HG13 VAL 99 45.439 60.895 13.889 715 HG21 VAL 99 HG21 VAL 99 44.742 59.102 15.204 716 HG22 VAL 99 HG22 VAL 99 46.066 58.034 14.694 717 HG23 VAL 99 HG23 VAL 99 45.755 58.336 16.422 718 H ILE 100 H ILE 100 50.560 59.478 16.420 719 HA ILE 100 HA ILE 100 51.294 62.321 16.238 720 HB ILE 100 HB ILE 100 50.173 61.920 18.461 721 HG12 ILE 100 HG12 ILE 100 53.096 62.743 18.644 722 HG13 ILE 100 HG13 ILE 100 51.782 63.751 18.034 723 HG21 ILE 100 HG21 ILE 100 51.242 60.646 20.207 724 HG22 ILE 100 HG22 ILE 100 51.041 59.580 18.821 725 HG23 ILE 100 HG23 ILE 100 52.636 60.273 19.177 726 HD11 ILE 100 HD11 ILE 100 52.235 64.373 20.312 727 HD12 ILE 100 HD12 ILE 100 50.653 63.567 20.269 728 HD13 ILE 100 HD13 ILE 100 52.088 62.703 20.874 729 H ARG 101 H ARG 101 53.575 62.631 16.380 730 HA ARG 101 HA ARG 101 55.606 62.247 15.470 731 HB2 ARG 101 HB2 ARG 101 55.636 59.641 17.021 732 HB3 ARG 101 HB3 ARG 101 57.022 60.561 16.454 733 HG2 ARG 101 HG2 ARG 101 55.074 61.329 18.664 734 HG3 ARG 101 HG3 ARG 101 56.754 60.860 18.846 735 HD2 ARG 101 HD2 ARG 101 55.767 63.382 17.461 736 HD3 ARG 101 HD3 ARG 101 56.407 63.302 19.101 737 HE ARG 101 HE ARG 101 58.506 62.289 17.782 738 HH11 ARG 101 HH11 ARG 101 56.728 65.251 17.283 739 HH12 ARG 101 HH12 ARG 101 58.047 65.999 16.407 740 HH21 ARG 101 HH21 ARG 101 60.100 63.230 16.582 741 HH22 ARG 101 HH22 ARG 101 59.836 64.804 15.877 Start of MODEL 15 1 H GLY 1 H1 GLY 1 62.237 40.327 45.580 2 HA2 GLY 1 HA2 GLY 1 62.994 38.096 43.825 3 HA3 GLY 1 HA3 GLY 1 61.504 39.059 43.733 4 H ALA 2 H ALA 2 61.807 39.928 41.715 5 HA ALA 2 HA ALA 2 63.907 42.005 41.399 6 HB1 ALA 2 HB1 ALA 2 63.444 39.667 39.492 7 HB2 ALA 2 HB2 ALA 2 64.498 41.059 39.163 8 HB3 ALA 2 HB3 ALA 2 64.877 39.963 40.495 9 H ALA 3 H ALA 3 63.579 43.144 39.186 10 HA ALA 3 HA ALA 3 60.811 43.114 38.179 11 HB1 ALA 3 HB1 ALA 3 62.198 45.673 39.072 12 HB2 ALA 3 HB2 ALA 3 60.637 45.571 38.226 13 HB3 ALA 3 HB3 ALA 3 60.800 44.910 39.860 14 H ALA 4 H ALA 4 60.594 43.542 36.095 15 HA ALA 4 HA ALA 4 62.897 44.404 34.436 16 HB1 ALA 4 HB1 ALA 4 62.942 41.979 34.477 17 HB2 ALA 4 HB2 ALA 4 61.229 41.894 34.015 18 HB3 ALA 4 HB3 ALA 4 62.439 42.534 32.882 19 H GLY 5 H GLY 5 62.359 45.172 32.343 20 HA2 GLY 5 HA2 GLY 5 59.925 46.808 32.266 21 HA3 GLY 5 HA3 GLY 5 61.312 46.889 31.190 22 H VAL 6 H VAL 6 59.205 47.233 29.845 23 HA VAL 6 HA VAL 6 57.947 44.674 28.981 24 HB VAL 6 HB VAL 6 56.113 45.994 28.184 25 HG11 VAL 6 HG11 VAL 6 56.185 45.292 30.576 26 HG12 VAL 6 HG12 VAL 6 56.784 46.906 30.994 27 HG13 VAL 6 HG13 VAL 6 55.178 46.719 30.265 28 HG21 VAL 6 HG21 VAL 6 55.887 48.390 28.561 29 HG22 VAL 6 HG22 VAL 6 57.528 48.476 29.227 30 HG23 VAL 6 HG23 VAL 6 57.270 48.086 27.508 31 H SER 7 H SER 7 60.079 47.124 27.782 32 HA SER 7 HA SER 7 60.961 47.571 25.709 33 HB2 SER 7 HB2 SER 7 61.202 44.557 25.894 34 HB3 SER 7 HB3 SER 7 62.210 45.619 24.890 35 HG SER 7 HG SER 7 63.256 45.225 26.821 36 H ALA 8 H ALA 8 58.373 47.879 25.109 37 HA ALA 8 HA ALA 8 57.051 45.828 23.900 38 HB1 ALA 8 HB1 ALA 8 55.339 47.501 23.327 39 HB2 ALA 8 HB2 ALA 8 56.007 47.782 24.945 40 HB3 ALA 8 HB3 ALA 8 56.522 48.805 23.584 41 H ALA 9 H ALA 9 56.608 44.976 21.997 42 HA ALA 9 HA ALA 9 57.190 46.248 19.447 43 HB1 ALA 9 HB1 ALA 9 59.453 45.461 20.055 44 HB2 ALA 9 HB2 ALA 9 58.820 43.818 20.319 45 HB3 ALA 9 HB3 ALA 9 58.815 44.532 18.694 46 H GLY 10 H GLY 10 56.371 45.041 17.640 47 HA2 GLY 10 HA2 GLY 10 53.828 43.966 18.167 48 HA3 GLY 10 HA3 GLY 10 54.656 43.941 16.608 49 H ILE 11 H ILE 11 56.846 42.213 17.848 50 HA ILE 11 HA ILE 11 55.906 39.647 17.092 51 HB ILE 11 HB ILE 11 58.033 38.818 18.053 52 HG12 ILE 11 HG12 ILE 11 58.592 41.711 18.867 53 HG13 ILE 11 HG13 ILE 11 58.130 40.442 20.002 54 HG21 ILE 11 HG21 ILE 11 59.457 39.886 16.433 55 HG22 ILE 11 HG22 ILE 11 57.833 39.802 15.750 56 HG23 ILE 11 HG23 ILE 11 58.445 41.339 16.398 57 HD11 ILE 11 HD11 ILE 11 60.517 40.719 20.065 58 HD12 ILE 11 HD12 ILE 11 60.132 39.132 19.373 59 HD13 ILE 11 HD13 ILE 11 60.654 40.471 18.317 60 H GLU 12 H GLU 12 55.529 41.212 20.168 61 HA GLU 12 HA GLU 12 55.817 38.902 21.811 62 HB2 GLU 12 HB2 GLU 12 56.178 41.282 22.462 63 HB3 GLU 12 HB3 GLU 12 54.423 41.501 22.484 64 HG2 GLU 12 HG2 GLU 12 54.302 39.612 24.185 65 HG3 GLU 12 HG3 GLU 12 56.070 39.584 24.203 66 HA PRO 13 HA PRO 13 51.662 37.157 21.190 67 HB2 PRO 13 HB2 PRO 13 52.426 35.675 23.708 68 HB3 PRO 13 HB3 PRO 13 51.698 35.028 22.203 69 HG2 PRO 13 HG2 PRO 13 54.322 34.679 22.639 70 HG3 PRO 13 HG3 PRO 13 53.776 35.241 21.024 71 HD2 PRO 13 HD2 PRO 13 54.846 36.906 23.332 72 HD3 PRO 13 HD3 PRO 13 55.312 36.915 21.602 73 H ASP 14 H ASP 14 49.615 36.682 22.546 74 HA ASP 14 HA ASP 14 48.894 39.025 24.131 75 HB2 ASP 14 HB2 ASP 14 47.481 36.423 23.484 76 HB3 ASP 14 HB3 ASP 14 46.754 37.700 24.453 77 H LEU 15 H LEU 15 50.241 35.954 24.992 78 HA LEU 15 HA LEU 15 49.188 35.368 27.488 79 HB2 LEU 15 HB2 LEU 15 52.030 35.103 26.409 80 HB3 LEU 15 HB3 LEU 15 51.610 34.560 28.018 81 HG LEU 15 HG LEU 15 51.670 32.704 26.546 82 HD11 LEU 15 HD11 LEU 15 50.018 32.705 28.392 83 HD12 LEU 15 HD12 LEU 15 49.599 31.653 27.031 84 HD13 LEU 15 HD13 LEU 15 48.758 33.201 27.229 85 HD21 LEU 15 HD21 LEU 15 49.361 33.873 24.950 86 HD22 LEU 15 HD22 LEU 15 50.203 32.339 24.691 87 HD23 LEU 15 HD23 LEU 15 51.061 33.854 24.412 88 H THR 16 H THR 16 51.544 37.946 26.813 89 HA THR 16 HA THR 16 52.278 38.380 29.593 90 HB THR 16 HB THR 16 53.152 40.571 28.765 91 HG1 THR 16 HG1 THR 16 53.071 40.813 26.443 92 HG21 THR 16 HG21 THR 16 54.919 39.683 27.393 93 HG22 THR 16 HG22 THR 16 53.930 38.297 26.887 94 HG23 THR 16 HG23 THR 16 54.499 38.427 28.566 95 H ALA 17 H ALA 17 49.847 39.860 27.432 96 HA ALA 17 HA ALA 17 48.876 41.775 29.361 97 HB1 ALA 17 HB1 ALA 17 47.645 40.677 26.806 98 HB2 ALA 17 HB2 ALA 17 47.119 42.130 27.687 99 HB3 ALA 17 HB3 ALA 17 48.717 42.091 26.946 100 H ILE 18 H ILE 18 47.870 38.493 28.367 101 HA ILE 18 HA ILE 18 45.548 38.336 30.060 102 HB ILE 18 HB ILE 18 47.319 36.173 28.863 103 HG12 ILE 18 HG12 ILE 18 44.576 37.202 27.990 104 HG13 ILE 18 HG13 ILE 18 46.079 37.770 27.283 105 HG21 ILE 18 HG21 ILE 18 44.550 35.915 30.133 106 HG22 ILE 18 HG22 ILE 18 45.416 34.622 29.282 107 HG23 ILE 18 HG23 ILE 18 46.056 35.246 30.793 108 HD11 ILE 18 HD11 ILE 18 44.937 34.978 27.084 109 HD12 ILE 18 HD12 ILE 18 45.219 36.147 25.795 110 HD13 ILE 18 HD13 ILE 18 46.607 35.392 26.602 111 H TRP 19 H TRP 19 48.963 37.238 30.660 112 HA TRP 19 HA TRP 19 48.339 36.353 33.334 113 HB2 TRP 19 HB2 TRP 19 50.977 36.977 31.966 114 HB3 TRP 19 HB3 TRP 19 50.832 36.300 33.577 115 HD1 TRP 19 HD1 TRP 19 48.263 34.648 31.524 116 HE1 TRP 19 HE1 TRP 19 49.027 32.339 30.736 117 HE3 TRP 19 HE3 TRP 19 53.236 35.019 32.627 118 HZ2 TRP 19 HZ2 TRP 19 51.490 30.853 30.545 119 HZ3 TRP 19 HZ3 TRP 19 54.769 33.102 32.197 120 HH2 TRP 19 HH2 TRP 19 53.914 31.044 31.110 121 H GLN 20 H GLN 20 49.552 39.559 32.143 122 HA GLN 20 HA GLN 20 49.848 40.494 34.866 123 HB2 GLN 20 HB2 GLN 20 50.230 42.660 34.053 124 HB3 GLN 20 HB3 GLN 20 50.987 41.542 32.941 125 HG2 GLN 20 HG2 GLN 20 48.839 41.857 31.517 126 HG3 GLN 20 HG3 GLN 20 48.539 43.277 32.524 127 HE21 GLN 20 HE21 GLN 20 51.207 41.720 30.677 128 HE22 GLN 20 HE22 GLN 20 51.928 43.230 30.108 129 H ALA 21 H ALA 21 47.044 40.562 32.580 130 HA ALA 21 HA ALA 21 45.329 41.965 34.390 131 HB1 ALA 21 HB1 ALA 21 43.519 41.025 32.988 132 HB2 ALA 21 HB2 ALA 21 44.835 41.694 32.012 133 HB3 ALA 21 HB3 ALA 21 44.683 39.932 32.208 134 H LEU 22 H LEU 22 45.924 38.415 34.046 135 HA LEU 22 HA LEU 22 43.926 37.854 36.102 136 HB2 LEU 22 HB2 LEU 22 45.674 36.030 34.430 137 HB3 LEU 22 HB3 LEU 22 44.463 35.478 35.573 138 HG LEU 22 HG LEU 22 43.907 37.148 33.073 139 HD11 LEU 22 HD11 LEU 22 42.754 35.172 32.256 140 HD12 LEU 22 HD12 LEU 22 43.073 34.314 33.773 141 HD13 LEU 22 HD13 LEU 22 44.413 34.734 32.666 142 HD21 LEU 22 HD21 LEU 22 41.497 36.693 33.579 143 HD22 LEU 22 HD22 LEU 22 42.251 37.783 34.742 144 HD23 LEU 22 HD23 LEU 22 41.980 36.076 35.168 145 H PHE 23 H PHE 23 47.439 38.179 36.245 146 HA PHE 23 HA PHE 23 47.189 37.499 39.122 147 HB2 PHE 23 HB2 PHE 23 49.182 36.746 37.819 148 HB3 PHE 23 HB3 PHE 23 49.643 38.431 37.644 149 HD1 PHE 23 HD1 PHE 23 48.282 37.700 40.992 150 HD2 PHE 23 HD2 PHE 23 51.821 37.461 38.531 151 HE1 PHE 23 HE1 PHE 23 49.682 37.594 43.010 152 HE2 PHE 23 HE2 PHE 23 53.222 37.385 40.567 153 HZ PHE 23 HZ PHE 23 52.161 37.475 42.816 154 H ALA 24 H ALA 24 46.061 39.892 37.423 155 HA ALA 24 HA ALA 24 45.423 42.002 37.755 156 HB1 ALA 24 HB1 ALA 24 44.213 40.679 39.440 157 HB2 ALA 24 HB2 ALA 24 45.466 41.060 40.642 158 HB3 ALA 24 HB3 ALA 24 44.462 42.352 39.962 159 H LEU 25 H LEU 25 48.230 42.024 37.434 160 HA LEU 25 HA LEU 25 49.045 44.276 39.201 161 HB2 LEU 25 HB2 LEU 25 51.385 43.457 39.021 162 HB3 LEU 25 HB3 LEU 25 50.266 42.490 39.959 163 HG LEU 25 HG LEU 25 50.110 40.839 38.093 164 HD11 LEU 25 HD11 LEU 25 52.417 42.434 36.914 165 HD12 LEU 25 HD12 LEU 25 50.805 42.266 36.196 166 HD13 LEU 25 HD13 LEU 25 51.829 40.849 36.346 167 HD21 LEU 25 HD21 LEU 25 52.340 39.886 38.524 168 HD22 LEU 25 HD22 LEU 25 51.644 40.545 40.001 169 HD23 LEU 25 HD23 LEU 25 52.907 41.453 39.144 170 HA PRO 26 HA PRO 26 49.244 46.907 36.056 171 HB2 PRO 26 HB2 PRO 26 52.004 47.913 36.725 172 HB3 PRO 26 HB3 PRO 26 50.483 48.826 36.513 173 HG2 PRO 26 HG2 PRO 26 51.361 48.272 39.007 174 HG3 PRO 26 HG3 PRO 26 49.625 48.033 38.610 175 HD2 PRO 26 HD2 PRO 26 51.836 45.956 38.688 176 HD3 PRO 26 HD3 PRO 26 50.222 45.907 39.438 177 H ALA 27 H ALA 27 52.407 45.202 35.871 178 HA ALA 27 HA ALA 27 52.012 44.853 32.980 179 HB1 ALA 27 HB1 ALA 27 54.271 45.763 32.447 180 HB2 ALA 27 HB2 ALA 27 53.181 47.016 33.068 181 HB3 ALA 27 HB3 ALA 27 54.429 46.320 34.124 182 H VAL 28 H VAL 28 53.285 43.189 32.074 183 HA VAL 28 HA VAL 28 54.719 41.381 33.972 184 HB VAL 28 HB VAL 28 53.176 40.910 31.462 185 HG11 VAL 28 HG11 VAL 28 54.259 38.703 31.081 186 HG12 VAL 28 HG12 VAL 28 55.270 40.073 30.617 187 HG13 VAL 28 HG13 VAL 28 55.590 39.193 32.141 188 HG21 VAL 28 HG21 VAL 28 52.367 39.013 32.642 189 HG22 VAL 28 HG22 VAL 28 53.737 39.018 33.769 190 HG23 VAL 28 HG23 VAL 28 52.508 40.277 33.883 191 H GLY 29 H GLY 29 56.858 41.087 33.821 192 HA2 GLY 29 HA2 GLY 29 58.411 43.052 32.320 193 HA3 GLY 29 HA3 GLY 29 59.009 41.879 33.494 194 H ARG 30 H ARG 30 57.172 40.594 30.929 195 HA ARG 30 HA ARG 30 57.590 38.881 29.493 196 HB2 ARG 30 HB2 ARG 30 58.421 39.730 27.397 197 HB3 ARG 30 HB3 ARG 30 57.362 40.884 28.183 198 HG2 ARG 30 HG2 ARG 30 59.016 42.454 28.478 199 HG3 ARG 30 HG3 ARG 30 60.262 41.238 28.781 200 HD2 ARG 30 HD2 ARG 30 60.801 42.380 26.785 201 HD3 ARG 30 HD3 ARG 30 60.419 40.681 26.447 202 HE ARG 30 HE ARG 30 58.027 42.064 25.945 203 HH11 ARG 30 HH11 ARG 30 61.294 42.251 24.587 204 HH12 ARG 30 HH12 ARG 30 60.679 42.895 23.083 205 HH21 ARG 30 HH21 ARG 30 57.388 42.776 24.105 206 HH22 ARG 30 HH22 ARG 30 58.535 43.275 22.832 207 H HIS 31 H HIS 31 59.909 38.893 31.576 208 HA HIS 31 HA HIS 31 61.804 37.244 29.947 209 HB2 HIS 31 HB2 HIS 31 62.549 39.530 30.502 210 HB3 HIS 31 HB3 HIS 31 62.356 39.189 32.209 211 HD1 HIS 31 HD1 HIS 31 63.987 36.170 31.476 212 HD2 HIS 31 HD2 HIS 31 65.123 40.200 31.173 213 HE1 HIS 31 HE1 HIS 31 66.529 36.206 31.638 214 H GLN 32 H GLN 32 60.040 37.296 33.000 215 HA GLN 32 HA GLN 32 61.625 34.983 33.951 216 HB2 GLN 32 HB2 GLN 32 59.910 37.076 35.180 217 HB3 GLN 32 HB3 GLN 32 60.070 35.549 36.047 218 HG2 GLN 32 HG2 GLN 32 61.756 37.028 36.885 219 HG3 GLN 32 HG3 GLN 32 62.550 35.762 35.960 220 HE21 GLN 32 HE21 GLN 32 64.352 36.717 34.989 221 HE22 GLN 32 HE22 GLN 32 64.281 38.248 34.132 222 H ASP 33 H ASP 33 60.308 33.527 35.451 223 HA ASP 33 HA ASP 33 59.024 31.813 33.509 224 HB2 ASP 33 HB2 ASP 33 59.571 30.054 35.205 225 HB3 ASP 33 HB3 ASP 33 60.946 30.961 34.574 226 H PHE 34 H PHE 34 57.223 30.573 33.709 227 HA PHE 34 HA PHE 34 54.908 31.689 34.825 228 HB2 PHE 34 HB2 PHE 34 54.909 30.074 33.005 229 HB3 PHE 34 HB3 PHE 34 55.514 28.817 34.069 230 HD1 PHE 34 HD1 PHE 34 53.951 27.276 34.916 231 HD2 PHE 34 HD2 PHE 34 52.616 31.259 33.926 232 HE1 PHE 34 HE1 PHE 34 51.625 26.649 35.499 233 HE2 PHE 34 HE2 PHE 34 50.296 30.623 34.498 234 HZ PHE 34 HZ PHE 34 49.788 28.316 35.282 235 H PHE 35 H PHE 35 57.177 29.522 36.512 236 HA PHE 35 HA PHE 35 55.479 28.714 38.637 237 HB2 PHE 35 HB2 PHE 35 58.446 29.334 38.780 238 HB3 PHE 35 HB3 PHE 35 57.529 28.413 39.942 239 HD1 PHE 35 HD1 PHE 35 59.456 28.226 36.900 240 HD2 PHE 35 HD2 PHE 35 56.420 26.216 39.213 241 HE1 PHE 35 HE1 PHE 35 59.995 26.092 35.756 242 HE2 PHE 35 HE2 PHE 35 56.965 24.084 38.069 243 HZ PHE 35 HZ PHE 35 58.763 24.014 36.360 244 H ALA 36 H ALA 36 57.223 31.797 38.141 245 HA ALA 36 HA ALA 36 56.098 32.951 40.641 246 HB1 ALA 36 HB1 ALA 36 57.948 34.103 38.506 247 HB2 ALA 36 HB2 ALA 36 57.428 34.928 39.990 248 HB3 ALA 36 HB3 ALA 36 58.429 33.477 40.094 249 H LEU 37 H LEU 37 56.000 33.581 37.075 250 HA LEU 37 HA LEU 37 54.263 35.799 37.297 251 HB2 LEU 37 HB2 LEU 37 55.119 34.002 35.020 252 HB3 LEU 37 HB3 LEU 37 53.804 35.146 34.779 253 HG LEU 37 HG LEU 37 55.213 37.026 35.419 254 HD11 LEU 37 HD11 LEU 37 56.848 36.001 36.919 255 HD12 LEU 37 HD12 LEU 37 57.666 36.755 35.553 256 HD13 LEU 37 HD13 LEU 37 57.469 34.995 35.586 257 HD21 LEU 37 HD21 LEU 37 55.061 36.398 33.059 258 HD22 LEU 37 HD22 LEU 37 56.424 35.265 33.256 259 HD23 LEU 37 HD23 LEU 37 56.674 37.014 33.429 260 H GLY 38 H GLY 38 53.350 32.439 37.345 261 HA2 GLY 38 HA2 GLY 38 50.530 32.824 36.814 262 HA3 GLY 38 HA3 GLY 38 51.281 31.432 37.583 263 H GLY 39 H GLY 39 52.433 33.734 39.534 264 HA2 GLY 39 HA2 GLY 39 51.914 34.848 41.413 265 HA3 GLY 39 HA3 GLY 39 50.229 34.876 40.892 266 H ASP 40 H ASP 40 49.759 32.058 40.999 267 HA ASP 40 HA ASP 40 50.435 30.993 43.633 268 HB2 ASP 40 HB2 ASP 40 48.440 32.642 43.938 269 HB3 ASP 40 HB3 ASP 40 47.489 31.472 43.033 270 H SER 41 H SER 41 49.263 28.754 43.863 271 HA SER 41 HA SER 41 49.081 27.198 41.408 272 HB2 SER 41 HB2 SER 41 47.670 26.707 44.035 273 HB3 SER 41 HB3 SER 41 47.991 25.530 42.759 274 HG SER 41 HG SER 41 49.967 26.876 44.353 275 H GLN 42 H GLN 42 46.641 28.799 43.550 276 HA GLN 42 HA GLN 42 44.320 28.054 42.092 277 HB2 GLN 42 HB2 GLN 42 44.938 30.473 43.828 278 HB3 GLN 42 HB3 GLN 42 43.309 30.077 43.251 279 HG2 GLN 42 HG2 GLN 42 43.377 27.974 44.534 280 HG3 GLN 42 HG3 GLN 42 45.049 28.322 44.993 281 HE21 GLN 42 HE21 GLN 42 45.420 29.712 46.797 282 HE22 GLN 42 HE22 GLN 42 44.086 30.519 47.627 283 H LEU 43 H LEU 43 46.362 30.949 41.795 284 HA LEU 43 HA LEU 43 44.786 32.167 39.679 285 HB2 LEU 43 HB2 LEU 43 47.557 32.724 40.786 286 HB3 LEU 43 HB3 LEU 43 46.770 33.715 39.559 287 HG LEU 43 HG LEU 43 45.802 33.292 42.420 288 HD11 LEU 43 HD11 LEU 43 47.817 34.709 42.209 289 HD12 LEU 43 HD12 LEU 43 46.403 35.665 42.678 290 HD13 LEU 43 HD13 LEU 43 46.980 35.712 41.001 291 HD21 LEU 43 HD21 LEU 43 44.669 35.001 40.161 292 HD22 LEU 43 HD22 LEU 43 44.206 35.132 41.875 293 HD23 LEU 43 HD23 LEU 43 43.856 33.649 40.992 294 H GLY 44 H GLY 44 47.772 30.160 39.726 295 HA2 GLY 44 HA2 GLY 44 48.338 30.276 36.931 296 HA3 GLY 44 HA3 GLY 44 48.761 28.964 38.039 297 H LEU 45 H LEU 45 46.352 27.962 38.847 298 HA LEU 45 HA LEU 45 45.382 26.429 36.654 299 HB2 LEU 45 HB2 LEU 45 44.470 26.866 39.510 300 HB3 LEU 45 HB3 LEU 45 43.348 26.164 38.357 301 HG LEU 45 HG LEU 45 45.114 24.432 37.768 302 HD11 LEU 45 HD11 LEU 45 46.778 23.916 39.445 303 HD12 LEU 45 HD12 LEU 45 46.317 25.307 40.430 304 HD13 LEU 45 HD13 LEU 45 47.085 25.548 38.840 305 HD21 LEU 45 HD21 LEU 45 43.149 23.932 39.122 306 HD22 LEU 45 HD22 LEU 45 43.993 24.504 40.592 307 HD23 LEU 45 HD23 LEU 45 44.557 23.055 39.732 308 H ARG 46 H ARG 46 43.931 29.314 38.266 309 HA ARG 46 HA ARG 46 41.630 29.526 36.598 310 HB2 ARG 46 HB2 ARG 46 41.817 30.809 38.648 311 HB3 ARG 46 HB3 ARG 46 43.258 31.647 38.056 312 HG2 ARG 46 HG2 ARG 46 41.918 32.731 36.274 313 HG3 ARG 46 HG3 ARG 46 40.465 31.894 36.853 314 HD2 ARG 46 HD2 ARG 46 40.592 33.096 38.971 315 HD3 ARG 46 HD3 ARG 46 42.173 33.777 38.532 316 HE ARG 46 HE ARG 46 40.132 34.411 36.566 317 HH11 ARG 46 HH11 ARG 46 41.436 35.524 39.656 318 HH12 ARG 46 HH12 ARG 46 40.989 37.178 39.304 319 HH21 ARG 46 HH21 ARG 46 39.330 36.547 36.437 320 HH22 ARG 46 HH22 ARG 46 39.872 37.688 37.675 321 H MET 47 H MET 47 44.863 31.094 36.121 322 HA MET 47 HA MET 47 43.901 32.319 33.711 323 HB2 MET 47 HB2 MET 47 46.044 33.225 33.366 324 HB3 MET 47 HB3 MET 47 45.659 33.313 35.084 325 HG2 MET 47 HG2 MET 47 47.146 31.349 35.475 326 HG3 MET 47 HG3 MET 47 47.507 31.294 33.752 327 HE1 MET 47 HE1 MET 47 48.909 34.660 36.638 328 HE2 MET 47 HE2 MET 47 47.210 34.580 36.137 329 HE3 MET 47 HE3 MET 47 47.914 33.269 37.112 330 H LEU 48 H LEU 48 45.687 29.235 34.175 331 HA LEU 48 HA LEU 48 45.804 28.712 31.334 332 HB2 LEU 48 HB2 LEU 48 47.093 27.457 33.027 333 HB3 LEU 48 HB3 LEU 48 45.619 26.759 33.669 334 HG LEU 48 HG LEU 48 47.027 25.304 32.194 335 HD11 LEU 48 HD11 LEU 48 44.252 25.528 31.010 336 HD12 LEU 48 HD12 LEU 48 44.632 24.752 32.563 337 HD13 LEU 48 HD13 LEU 48 45.324 24.134 31.062 338 HD21 LEU 48 HD21 LEU 48 47.598 27.021 30.464 339 HD22 LEU 48 HD22 LEU 48 45.924 26.922 29.864 340 HD23 LEU 48 HD23 LEU 48 46.973 25.505 29.789 341 H ALA 49 H ALA 49 43.267 28.050 33.827 342 HA ALA 49 HA ALA 49 41.643 26.560 32.106 343 HB1 ALA 49 HB1 ALA 49 41.396 26.607 34.573 344 HB2 ALA 49 HB2 ALA 49 40.792 28.271 34.491 345 HB3 ALA 49 HB3 ALA 49 39.858 26.951 33.762 346 H GLN 50 H GLN 50 41.470 30.074 32.845 347 HA GLN 50 HA GLN 50 39.334 30.684 31.005 348 HB2 GLN 50 HB2 GLN 50 41.528 32.407 32.244 349 HB3 GLN 50 HB3 GLN 50 40.228 33.031 31.220 350 HG2 GLN 50 HG2 GLN 50 38.557 32.008 32.824 351 HG3 GLN 50 HG3 GLN 50 39.894 31.628 33.911 352 HE21 GLN 50 HE21 GLN 50 38.302 34.340 32.199 353 HE22 GLN 50 HE22 GLN 50 38.653 35.524 33.484 354 H LEU 51 H LEU 51 42.948 30.760 30.610 355 HA LEU 51 HA LEU 51 42.886 31.618 27.894 356 HB2 LEU 51 HB2 LEU 51 44.874 31.644 29.355 357 HB3 LEU 51 HB3 LEU 51 44.875 29.874 29.384 358 HG LEU 51 HG LEU 51 45.271 29.889 26.894 359 HD11 LEU 51 HD11 LEU 51 46.135 31.943 25.859 360 HD12 LEU 51 HD12 LEU 51 45.779 32.854 27.340 361 HD13 LEU 51 HD13 LEU 51 44.457 32.174 26.361 362 HD21 LEU 51 HD21 LEU 51 47.632 30.473 27.096 363 HD22 LEU 51 HD22 LEU 51 47.086 29.585 28.529 364 HD23 LEU 51 HD23 LEU 51 47.310 31.349 28.611 365 H ARG 52 H ARG 52 42.479 28.307 29.262 366 HA ARG 52 HA ARG 52 42.374 27.062 26.646 367 HB2 ARG 52 HB2 ARG 52 42.882 25.868 28.795 368 HB3 ARG 52 HB3 ARG 52 41.171 26.030 29.234 369 HG2 ARG 52 HG2 ARG 52 40.562 24.818 27.109 370 HG3 ARG 52 HG3 ARG 52 42.279 24.652 26.743 371 HD2 ARG 52 HD2 ARG 52 42.536 23.384 28.922 372 HD3 ARG 52 HD3 ARG 52 40.783 23.484 29.118 373 HE ARG 52 HE ARG 52 40.469 21.911 27.384 374 HH11 ARG 52 HH11 ARG 52 43.888 22.811 27.399 375 HH12 ARG 52 HH12 ARG 52 44.336 21.275 26.697 376 HH21 ARG 52 HH21 ARG 52 41.084 20.332 26.063 377 HH22 ARG 52 HH22 ARG 52 42.795 20.093 25.665 378 H GLU 53 H GLU 53 39.817 28.232 28.852 379 HA GLU 53 HA GLU 53 37.606 27.524 27.190 380 HB2 GLU 53 HB2 GLU 53 37.978 29.655 29.324 381 HB3 GLU 53 HB3 GLU 53 36.420 29.332 28.548 382 HG2 GLU 53 HG2 GLU 53 36.352 27.073 29.365 383 HG3 GLU 53 HG3 GLU 53 37.998 27.139 29.949 384 H ARG 54 H ARG 54 39.740 30.336 27.025 385 HA ARG 54 HA ARG 54 38.199 31.581 24.807 386 HB2 ARG 54 HB2 ARG 54 40.807 32.314 26.184 387 HB3 ARG 54 HB3 ARG 54 40.027 33.270 24.929 388 HG2 ARG 54 HG2 ARG 54 38.060 33.653 26.411 389 HG3 ARG 54 HG3 ARG 54 38.840 32.698 27.689 390 HD2 ARG 54 HD2 ARG 54 40.860 34.234 27.445 391 HD3 ARG 54 HD3 ARG 54 39.851 35.263 26.411 392 HE ARG 54 HE ARG 54 38.346 35.135 28.685 393 HH11 ARG 54 HH11 ARG 54 41.697 36.091 28.134 394 HH12 ARG 54 HH12 ARG 54 41.681 37.062 29.613 395 HH21 ARG 54 HH21 ARG 54 38.440 36.595 30.286 396 HH22 ARG 54 HH22 ARG 54 39.973 37.319 30.752 397 H HIS 55 H HIS 55 41.275 29.832 25.170 398 HA HIS 55 HA HIS 55 41.853 30.191 22.261 399 HB2 HIS 55 HB2 HIS 55 42.970 31.598 24.226 400 HB3 HIS 55 HB3 HIS 55 43.980 30.180 24.393 401 HD1 HIS 55 HD1 HIS 55 43.705 33.336 22.506 402 HD2 HIS 55 HD2 HIS 55 45.543 29.574 22.111 403 HE1 HIS 55 HE1 HIS 55 45.619 33.653 20.865 404 H GLY 56 H GLY 56 41.220 27.669 24.381 405 HA2 GLY 56 HA2 GLY 56 41.405 25.408 24.079 406 HA3 GLY 56 HA3 GLY 56 42.117 25.721 22.500 407 H VAL 57 H VAL 57 43.806 26.962 25.263 408 HA VAL 57 HA VAL 57 46.204 25.549 24.535 409 HB VAL 57 HB VAL 57 45.536 27.655 26.600 410 HG11 VAL 57 HG11 VAL 57 48.281 26.564 25.889 411 HG12 VAL 57 HG12 VAL 57 48.018 28.135 26.660 412 HG13 VAL 57 HG13 VAL 57 47.530 26.668 27.498 413 HG21 VAL 57 HG21 VAL 57 46.717 29.146 25.007 414 HG22 VAL 57 HG22 VAL 57 47.045 27.765 23.946 415 HG23 VAL 57 HG23 VAL 57 45.384 28.324 24.201 416 H ASP 58 H ASP 58 47.675 24.478 25.847 417 HA ASP 58 HA ASP 58 46.758 23.091 28.322 418 HB2 ASP 58 HB2 ASP 58 48.623 22.097 26.112 419 HB3 ASP 58 HB3 ASP 58 48.440 21.320 27.681 420 H LEU 59 H LEU 59 48.594 22.686 29.876 421 HA LEU 59 HA LEU 59 50.976 24.436 29.408 422 HB2 LEU 59 HB2 LEU 59 49.208 25.312 31.063 423 HB3 LEU 59 HB3 LEU 59 49.758 24.065 32.147 424 HG LEU 59 HG LEU 59 50.815 26.112 32.733 425 HD11 LEU 59 HD11 LEU 59 52.977 24.636 31.176 426 HD12 LEU 59 HD12 LEU 59 52.388 24.186 32.796 427 HD13 LEU 59 HD13 LEU 59 53.188 25.742 32.543 428 HD21 LEU 59 HD21 LEU 59 50.468 27.309 30.596 429 HD22 LEU 59 HD22 LEU 59 51.825 26.420 29.879 430 HD23 LEU 59 HD23 LEU 59 52.102 27.526 31.241 431 HA PRO 60 HA PRO 60 52.291 20.173 30.188 432 HB2 PRO 60 HB2 PRO 60 54.165 20.440 27.928 433 HB3 PRO 60 HB3 PRO 60 52.828 19.276 28.201 434 HG2 PRO 60 HG2 PRO 60 52.648 21.273 26.323 435 HG3 PRO 60 HG3 PRO 60 51.230 20.714 27.272 436 HD2 PRO 60 HD2 PRO 60 53.059 23.067 27.871 437 HD3 PRO 60 HD3 PRO 60 51.279 23.034 27.744 438 H LEU 61 H LEU 61 53.954 19.309 31.321 439 HA LEU 61 HA LEU 61 55.816 21.007 32.646 440 HB2 LEU 61 HB2 LEU 61 55.379 18.023 32.507 441 HB3 LEU 61 HB3 LEU 61 56.857 18.652 33.221 442 HG LEU 61 HG LEU 61 55.562 20.028 34.815 443 HD11 LEU 61 HD11 LEU 61 53.413 20.300 33.657 444 HD12 LEU 61 HD12 LEU 61 53.167 19.487 35.205 445 HD13 LEU 61 HD13 LEU 61 53.140 18.540 33.708 446 HD21 LEU 61 HD21 LEU 61 54.861 17.067 34.837 447 HD22 LEU 61 HD22 LEU 61 54.890 18.158 36.242 448 HD23 LEU 61 HD23 LEU 61 56.396 17.774 35.394 449 H ARG 62 H ARG 62 56.248 18.991 29.739 450 HA ARG 62 HA ARG 62 59.114 19.328 29.585 451 HB2 ARG 62 HB2 ARG 62 58.107 17.610 28.238 452 HB3 ARG 62 HB3 ARG 62 57.075 18.783 27.392 453 HG2 ARG 62 HG2 ARG 62 59.034 19.850 26.383 454 HG3 ARG 62 HG3 ARG 62 60.134 18.819 27.317 455 HD2 ARG 62 HD2 ARG 62 59.666 16.936 26.011 456 HD3 ARG 62 HD3 ARG 62 58.078 17.558 25.529 457 HE ARG 62 HE ARG 62 60.306 19.197 24.537 458 HH11 ARG 62 HH11 ARG 62 58.371 16.323 23.796 459 HH12 ARG 62 HH12 ARG 62 58.492 16.662 22.070 460 HH21 ARG 62 HH21 ARG 62 60.372 19.415 22.224 461 HH22 ARG 62 HH22 ARG 62 59.591 18.169 21.272 462 H CYS 63 H CYS 63 56.472 21.281 28.056 463 HA CYS 63 HA CYS 63 58.206 23.259 26.936 464 HB2 CYS 63 HB2 CYS 63 55.380 23.659 28.000 465 HB3 CYS 63 HB3 CYS 63 56.240 24.665 26.845 466 HG CYS 63 HG CYS 63 54.653 23.473 25.334 467 H LEU 64 H LEU 64 56.756 22.958 30.153 468 HA LEU 64 HA LEU 64 57.848 25.386 31.243 469 HB2 LEU 64 HB2 LEU 64 55.815 24.020 31.889 470 HB3 LEU 64 HB3 LEU 64 56.889 22.860 32.607 471 HG LEU 64 HG LEU 64 57.690 24.488 34.253 472 HD11 LEU 64 HD11 LEU 64 56.482 26.626 34.569 473 HD12 LEU 64 HD12 LEU 64 55.643 26.376 33.013 474 HD13 LEU 64 HD13 LEU 64 57.406 26.605 33.073 475 HD21 LEU 64 HD21 LEU 64 55.610 24.624 35.564 476 HD22 LEU 64 HD22 LEU 64 55.778 23.049 34.773 477 HD23 LEU 64 HD23 LEU 64 54.658 24.263 34.105 478 H TYR 65 H TYR 65 59.293 22.224 30.802 479 HA TYR 65 HA TYR 65 61.652 22.909 32.447 480 HB2 TYR 65 HB2 TYR 65 60.889 20.578 32.287 481 HB3 TYR 65 HB3 TYR 65 61.129 20.598 30.541 482 HD1 TYR 65 HD1 TYR 65 63.345 20.332 29.574 483 HD2 TYR 65 HD2 TYR 65 62.855 20.921 33.818 484 HE1 TYR 65 HE1 TYR 65 65.791 19.951 29.921 485 HE2 TYR 65 HE2 TYR 65 65.272 20.516 34.164 486 HH TYR 65 HH TYR 65 67.236 20.079 33.198 487 H GLU 66 H GLU 66 60.834 22.826 28.975 488 HA GLU 66 HA GLU 66 63.647 23.559 28.352 489 HB2 GLU 66 HB2 GLU 66 63.286 22.980 26.140 490 HB3 GLU 66 HB3 GLU 66 62.576 21.719 27.137 491 HG2 GLU 66 HG2 GLU 66 60.308 22.560 26.612 492 HG3 GLU 66 HG3 GLU 66 60.999 23.922 25.741 493 H ALA 67 H ALA 67 60.665 25.207 28.652 494 HA ALA 67 HA ALA 67 61.917 27.790 28.014 495 HB1 ALA 67 HB1 ALA 67 60.068 28.312 26.437 496 HB2 ALA 67 HB2 ALA 67 61.076 26.978 25.837 497 HB3 ALA 67 HB3 ALA 67 59.485 26.650 26.569 498 HA PRO 68 HA PRO 68 58.703 27.610 31.528 499 HB2 PRO 68 HB2 PRO 68 60.291 28.731 33.513 500 HB3 PRO 68 HB3 PRO 68 60.163 26.990 33.205 501 HG2 PRO 68 HG2 PRO 68 62.250 28.928 32.168 502 HG3 PRO 68 HG3 PRO 68 62.521 27.335 32.952 503 HD2 PRO 68 HD2 PRO 68 62.581 27.537 30.279 504 HD3 PRO 68 HD3 PRO 68 61.726 26.165 31.038 505 H THR 69 H THR 69 60.671 30.053 30.045 506 HA THR 69 HA THR 69 59.575 32.337 31.488 507 HB THR 69 HB THR 69 61.147 33.586 29.929 508 HG1 THR 69 HG1 THR 69 61.982 32.614 28.428 509 HG21 THR 69 HG21 THR 69 61.802 32.886 32.225 510 HG22 THR 69 HG22 THR 69 63.159 32.825 31.091 511 HG23 THR 69 HG23 THR 69 62.347 31.323 31.585 512 H VAL 70 H VAL 70 58.088 33.771 30.814 513 HA VAL 70 HA VAL 70 55.948 32.785 29.549 514 HB VAL 70 HB VAL 70 55.843 34.698 30.945 515 HG11 VAL 70 HG11 VAL 70 57.799 35.996 30.199 516 HG12 VAL 70 HG12 VAL 70 56.929 36.452 28.717 517 HG13 VAL 70 HG13 VAL 70 56.329 36.969 30.306 518 HG21 VAL 70 HG21 VAL 70 53.953 34.286 29.359 519 HG22 VAL 70 HG22 VAL 70 54.092 35.966 29.899 520 HG23 VAL 70 HG23 VAL 70 54.640 35.512 28.273 521 H ALA 71 H ALA 71 58.216 34.814 27.616 522 HA ALA 71 HA ALA 71 56.497 34.821 25.270 523 HB1 ALA 71 HB1 ALA 71 58.198 36.575 25.832 524 HB2 ALA 71 HB2 ALA 71 59.490 35.372 25.589 525 HB3 ALA 71 HB3 ALA 71 58.475 35.872 24.228 526 H ARG 72 H ARG 72 59.391 33.067 26.216 527 HA ARG 72 HA ARG 72 59.713 31.445 23.844 528 HB2 ARG 72 HB2 ARG 72 61.386 32.274 25.601 529 HB3 ARG 72 HB3 ARG 72 60.781 31.005 26.665 530 HG2 ARG 72 HG2 ARG 72 61.625 29.291 25.167 531 HG3 ARG 72 HG3 ARG 72 61.991 30.480 23.907 532 HD2 ARG 72 HD2 ARG 72 63.749 31.441 25.110 533 HD3 ARG 72 HD3 ARG 72 63.167 30.849 26.673 534 HE ARG 72 HE ARG 72 63.890 28.677 24.847 535 HH11 ARG 72 HH11 ARG 72 65.646 31.156 26.632 536 HH12 ARG 72 HH12 ARG 72 67.073 30.151 26.706 537 HH21 ARG 72 HH21 ARG 72 65.631 27.404 25.234 538 HH22 ARG 72 HH22 ARG 72 67.014 28.065 26.081 539 H LEU 73 H LEU 73 58.186 30.945 27.023 540 HA LEU 73 HA LEU 73 57.267 28.306 26.687 541 HB2 LEU 73 HB2 LEU 73 57.176 29.720 28.774 542 HB3 LEU 73 HB3 LEU 73 55.803 30.565 28.126 543 HG LEU 73 HG LEU 73 55.534 27.597 28.005 544 HD11 LEU 73 HD11 LEU 73 55.594 28.970 30.717 545 HD12 LEU 73 HD12 LEU 73 56.677 27.684 30.141 546 HD13 LEU 73 HD13 LEU 73 54.969 27.329 30.392 547 HD21 LEU 73 HD21 LEU 73 53.277 28.093 28.780 548 HD22 LEU 73 HD22 LEU 73 53.697 29.200 27.465 549 HD23 LEU 73 HD23 LEU 73 53.731 29.774 29.137 550 H ALA 74 H ALA 74 55.534 31.407 25.910 551 HA ALA 74 HA ALA 74 53.296 30.225 24.674 552 HB1 ALA 74 HB1 ALA 74 53.542 32.598 25.332 553 HB2 ALA 74 HB2 ALA 74 54.674 32.850 23.993 554 HB3 ALA 74 HB3 ALA 74 52.983 32.422 23.649 555 H GLU 75 H GLU 75 56.497 30.996 23.213 556 HA GLU 75 HA GLU 75 55.759 30.078 20.554 557 HB2 GLU 75 HB2 GLU 75 58.362 30.593 21.980 558 HB3 GLU 75 HB3 GLU 75 58.378 29.726 20.433 559 HG2 GLU 75 HG2 GLU 75 57.191 31.575 19.353 560 HG3 GLU 75 HG3 GLU 75 56.983 32.367 20.917 561 H THR 76 H THR 76 57.246 28.210 23.284 562 HA THR 76 HA THR 76 57.128 25.713 21.855 563 HB THR 76 HB THR 76 57.334 24.584 24.021 564 HG1 THR 76 HG1 THR 76 56.608 27.073 24.973 565 HG21 THR 76 HG21 THR 76 59.187 26.994 23.938 566 HG22 THR 76 HG22 THR 76 59.316 25.647 22.807 567 HG23 THR 76 HG23 THR 76 59.521 25.356 24.542 568 H ILE 77 H ILE 77 54.565 27.410 23.615 569 HA ILE 77 HA ILE 77 52.743 25.127 23.595 570 HB ILE 77 HB ILE 77 52.310 28.108 23.977 571 HG12 ILE 77 HG12 ILE 77 53.429 27.182 25.886 572 HG13 ILE 77 HG13 ILE 77 51.761 27.449 26.321 573 HG21 ILE 77 HG21 ILE 77 50.027 27.574 24.750 574 HG22 ILE 77 HG22 ILE 77 50.240 27.271 23.035 575 HG23 ILE 77 HG23 ILE 77 50.222 25.902 24.170 576 HD11 ILE 77 HD11 ILE 77 53.139 24.796 25.762 577 HD12 ILE 77 HD12 ILE 77 52.450 25.381 27.282 578 HD13 ILE 77 HD13 ILE 77 51.376 24.948 25.938 579 H VAL 78 H VAL 78 53.230 27.919 21.350 580 HA VAL 78 HA VAL 78 51.220 27.007 19.481 581 HB VAL 78 HB VAL 78 53.670 28.736 19.048 582 HG11 VAL 78 HG11 VAL 78 52.557 29.438 16.939 583 HG12 VAL 78 HG12 VAL 78 53.010 27.737 16.884 584 HG13 VAL 78 HG13 VAL 78 51.317 28.186 17.172 585 HG21 VAL 78 HG21 VAL 78 51.897 30.512 18.923 586 HG22 VAL 78 HG22 VAL 78 50.681 29.304 19.365 587 HG23 VAL 78 HG23 VAL 78 51.960 29.744 20.515 588 H ARG 79 H ARG 79 54.694 26.214 19.782 589 HA ARG 79 HA ARG 79 54.745 24.471 17.521 590 HB2 ARG 79 HB2 ARG 79 56.750 25.478 18.563 591 HB3 ARG 79 HB3 ARG 79 56.468 24.550 20.024 592 HG2 ARG 79 HG2 ARG 79 58.234 23.498 18.904 593 HG3 ARG 79 HG3 ARG 79 56.862 22.424 18.705 594 HD2 ARG 79 HD2 ARG 79 57.844 24.399 16.608 595 HD3 ARG 79 HD3 ARG 79 58.345 22.718 16.713 596 HE ARG 79 HE ARG 79 56.070 21.992 16.214 597 HH11 ARG 79 HH11 ARG 79 56.666 25.379 15.379 598 HH12 ARG 79 HH12 ARG 79 55.508 25.308 14.083 599 HH21 ARG 79 HH21 ARG 79 54.434 22.129 14.837 600 HH22 ARG 79 HH22 ARG 79 54.107 23.598 13.949 601 H LEU 80 H LEU 80 54.444 23.572 20.982 602 HA LEU 80 HA LEU 80 54.292 20.744 20.146 603 HB2 LEU 80 HB2 LEU 80 54.825 22.031 22.847 604 HB3 LEU 80 HB3 LEU 80 54.901 20.311 22.516 605 HG LEU 80 HG LEU 80 56.713 22.376 21.191 606 HD11 LEU 80 HD11 LEU 80 57.183 20.479 23.524 607 HD12 LEU 80 HD12 LEU 80 57.232 22.262 23.532 608 HD13 LEU 80 HD13 LEU 80 58.462 21.352 22.653 609 HD21 LEU 80 HD21 LEU 80 56.420 20.321 19.825 610 HD22 LEU 80 HD22 LEU 80 56.829 19.327 21.237 611 HD23 LEU 80 HD23 LEU 80 58.038 20.405 20.513 612 H ALA 81 H ALA 81 52.030 23.035 21.593 613 HA ALA 81 HA ALA 81 50.336 20.851 22.627 614 HB1 ALA 81 HB1 ALA 81 48.854 22.563 23.355 615 HB2 ALA 81 HB2 ALA 81 50.497 23.060 23.783 616 HB3 ALA 81 HB3 ALA 81 49.678 23.799 22.386 617 H ALA 82 H ALA 82 48.353 20.190 21.710 618 HA ALA 82 HA ALA 82 48.191 20.657 18.757 619 HB1 ALA 82 HB1 ALA 82 49.654 18.755 19.253 620 HB2 ALA 82 HB2 ALA 82 48.375 18.000 20.230 621 HB3 ALA 82 HB3 ALA 82 48.159 18.204 18.480 622 HA PRO 83 HA PRO 83 43.773 20.520 19.352 623 HB2 PRO 83 HB2 PRO 83 42.867 19.903 16.873 624 HB3 PRO 83 HB3 PRO 83 43.610 21.483 17.261 625 HG2 PRO 83 HG2 PRO 83 44.919 19.074 15.968 626 HG3 PRO 83 HG3 PRO 83 45.006 20.788 15.457 627 HD2 PRO 83 HD2 PRO 83 46.932 19.568 16.986 628 HD3 PRO 83 HD3 PRO 83 46.546 21.311 17.148 629 H ALA 84 H ALA 84 42.051 19.023 19.529 630 HA ALA 84 HA ALA 84 42.439 16.176 19.208 631 HB1 ALA 84 HB1 ALA 84 44.009 16.717 21.107 632 HB2 ALA 84 HB2 ALA 84 42.643 17.330 22.031 633 HB3 ALA 84 HB3 ALA 84 42.694 15.618 21.573 634 HA PRO 85 HA PRO 85 38.009 16.659 19.851 635 HB2 PRO 85 HB2 PRO 85 38.093 13.722 20.504 636 HB3 PRO 85 HB3 PRO 85 36.964 14.643 19.453 637 HG2 PRO 85 HG2 PRO 85 38.945 13.261 18.290 638 HG3 PRO 85 HG3 PRO 85 38.690 14.977 17.788 639 HD2 PRO 85 HD2 PRO 85 40.692 13.958 19.828 640 HD3 PRO 85 HD3 PRO 85 40.957 14.989 18.383 641 H SER 86 H SER 86 37.293 17.717 21.612 642 HA SER 86 HA SER 86 38.326 17.050 24.270 643 HB2 SER 86 HB2 SER 86 37.415 19.204 24.917 644 HB3 SER 86 HB3 SER 86 38.399 19.349 23.454 645 HG SER 86 HG SER 86 36.368 20.474 23.459 646 H GLY 87 H GLY 87 36.991 17.180 26.180 647 HA2 GLY 87 HA2 GLY 87 34.104 16.487 25.870 648 HA3 GLY 87 HA3 GLY 87 35.113 15.498 26.922 649 H ASP 88 H ASP 88 36.671 18.077 27.740 650 HA ASP 88 HA ASP 88 34.848 19.136 29.770 651 HB2 ASP 88 HB2 ASP 88 37.602 19.950 28.804 652 HB3 ASP 88 HB3 ASP 88 36.666 20.907 29.943 653 H GLN 89 H GLN 89 33.913 21.169 29.815 654 HA GLN 89 HA GLN 89 33.555 22.752 27.366 655 HB2 GLN 89 HB2 GLN 89 31.153 22.225 27.169 656 HB3 GLN 89 HB3 GLN 89 32.209 20.865 26.827 657 HG2 GLN 89 HG2 GLN 89 31.771 20.180 29.344 658 HG3 GLN 89 HG3 GLN 89 30.415 21.303 29.233 659 HE21 GLN 89 HE21 GLN 89 31.927 18.495 27.486 660 HE22 GLN 89 HE22 GLN 89 30.391 17.746 27.143 661 H ASP 90 H ASP 90 32.410 24.687 27.690 662 HA ASP 90 HA ASP 90 31.455 25.304 30.450 663 HB2 ASP 90 HB2 ASP 90 32.541 27.407 30.496 664 HB3 ASP 90 HB3 ASP 90 33.756 26.171 30.185 665 H ASP 91 H ASP 91 29.800 26.638 30.687 666 HA ASP 91 HA ASP 91 28.601 28.036 28.340 667 HB2 ASP 91 HB2 ASP 91 26.489 27.411 28.791 668 HB3 ASP 91 HB3 ASP 91 27.316 25.934 29.245 669 H ALA 92 H ALA 92 29.946 28.348 31.432 670 HA ALA 92 HA ALA 92 28.381 30.522 32.456 671 HB1 ALA 92 HB1 ALA 92 29.557 28.923 33.884 672 HB2 ALA 92 HB2 ALA 92 31.123 29.425 33.209 673 HB3 ALA 92 HB3 ALA 92 30.166 30.553 34.192 674 H SER 93 H SER 93 29.285 32.572 33.119 675 HA SER 93 HA SER 93 30.801 33.949 30.958 676 HB2 SER 93 HB2 SER 93 29.132 35.088 33.226 677 HB3 SER 93 HB3 SER 93 29.849 35.990 31.878 678 HG SER 93 HG SER 93 28.582 34.638 30.466 679 H GLU 94 H GLU 94 32.405 35.572 31.528 680 HA GLU 94 HA GLU 94 34.041 34.746 33.877 681 HB2 GLU 94 HB2 GLU 94 35.897 35.918 32.821 682 HB3 GLU 94 HB3 GLU 94 35.251 34.601 31.845 683 HG2 GLU 94 HG2 GLU 94 34.193 36.131 30.313 684 HG3 GLU 94 HG3 GLU 94 34.528 37.521 31.354 685 H TYR 95 H TYR 95 34.599 36.089 35.545 686 HA TYR 95 HA TYR 95 33.902 38.945 35.456 687 HB2 TYR 95 HB2 TYR 95 32.431 38.898 37.384 688 HB3 TYR 95 HB3 TYR 95 31.758 38.044 36.025 689 HD1 TYR 95 HD1 TYR 95 32.074 35.413 36.001 690 HD2 TYR 95 HD2 TYR 95 32.292 37.891 39.533 691 HE1 TYR 95 HE1 TYR 95 31.389 33.502 37.376 692 HE2 TYR 95 HE2 TYR 95 31.527 35.957 40.913 693 HH TYR 95 HH TYR 95 30.629 32.845 39.359 694 H GLU 96 H GLU 96 34.562 40.168 37.269 695 HA GLU 96 HA GLU 96 36.717 38.986 38.935 696 HB2 GLU 96 HB2 GLU 96 38.379 40.484 38.108 697 HB3 GLU 96 HB3 GLU 96 37.723 39.561 36.781 698 HG2 GLU 96 HG2 GLU 96 37.801 41.590 35.764 699 HG3 GLU 96 HG3 GLU 96 36.178 41.719 36.427 700 H GLU 97 H GLU 97 37.626 40.543 40.524 701 HA GLU 97 HA GLU 97 35.656 42.611 41.370 702 HB2 GLU 97 HB2 GLU 97 35.484 40.237 42.449 703 HB3 GLU 97 HB3 GLU 97 36.949 40.693 43.320 704 HG2 GLU 97 HG2 GLU 97 35.712 42.708 44.199 705 HG3 GLU 97 HG3 GLU 97 34.285 42.195 43.302 706 H GLY 98 H GLY 98 38.277 42.840 39.979 707 HA2 GLY 98 HA2 GLY 98 40.259 43.790 41.868 708 HA3 GLY 98 HA3 GLY 98 40.305 43.907 40.103 709 H VAL 99 H VAL 99 38.371 45.198 42.781 710 HA VAL 99 HA VAL 99 38.396 47.964 41.619 711 HB VAL 99 HB VAL 99 36.508 46.620 43.590 712 HG11 VAL 99 HG11 VAL 99 36.431 49.471 42.508 713 HG12 VAL 99 HG12 VAL 99 35.131 48.678 43.417 714 HG13 VAL 99 HG13 VAL 99 36.674 48.989 44.205 715 HG21 VAL 99 HG21 VAL 99 34.822 46.952 41.808 716 HG22 VAL 99 HG22 VAL 99 36.073 47.626 40.742 717 HG23 VAL 99 HG23 VAL 99 36.140 45.922 41.246 718 H ILE 100 H ILE 100 39.316 49.639 42.762 719 HA ILE 100 HA ILE 100 39.855 49.313 45.642 720 HB ILE 100 HB ILE 100 41.877 48.548 44.332 721 HG12 ILE 100 HG12 ILE 100 42.398 50.914 46.164 722 HG13 ILE 100 HG13 ILE 100 41.896 49.312 46.718 723 HG21 ILE 100 HG21 ILE 100 43.344 50.167 43.294 724 HG22 ILE 100 HG22 ILE 100 41.758 50.292 42.533 725 HG23 ILE 100 HG23 ILE 100 42.268 51.510 43.717 726 HD11 ILE 100 HD11 ILE 100 43.945 48.329 45.679 727 HD12 ILE 100 HD12 ILE 100 44.487 49.974 45.261 728 HD13 ILE 100 HD13 ILE 100 44.287 49.510 46.957 729 H ARG 101 H ARG 101 40.136 51.238 46.796 730 HA ARG 101 HA ARG 101 38.727 53.561 45.701 731 HB2 ARG 101 HB2 ARG 101 38.396 52.390 47.995 732 HB3 ARG 101 HB3 ARG 101 39.842 53.269 48.508 733 HG2 ARG 101 HG2 ARG 101 38.642 55.409 47.784 734 HG3 ARG 101 HG3 ARG 101 37.205 54.420 47.504 735 HD2 ARG 101 HD2 ARG 101 38.654 54.939 50.124 736 HD3 ARG 101 HD3 ARG 101 37.024 55.444 49.701 737 HE ARG 101 HE ARG 101 37.852 52.945 50.860 738 HH11 ARG 101 HH11 ARG 101 35.285 54.235 48.776 739 HH12 ARG 101 HH12 ARG 101 34.246 52.877 49.173 740 HH21 ARG 101 HH21 ARG 101 36.353 51.306 51.278 741 HH22 ARG 101 HH22 ARG 101 34.796 51.377 50.468 Start of MODEL 16 1 H GLY 1 H1 GLY 1 47.825 48.178 44.376 2 HA2 GLY 1 HA2 GLY 1 46.790 49.565 42.774 3 HA3 GLY 1 HA3 GLY 1 48.249 49.474 41.767 4 H ALA 2 H ALA 2 45.615 46.711 40.878 5 HA ALA 2 HA ALA 2 43.964 48.098 40.752 6 HB1 ALA 2 HB1 ALA 2 44.086 47.633 43.201 7 HB2 ALA 2 HB2 ALA 2 44.823 49.244 43.409 8 HB3 ALA 2 HB3 ALA 2 43.200 49.092 42.743 9 H ALA 3 H ALA 3 46.035 49.091 39.150 10 HA ALA 3 HA ALA 3 44.974 51.797 38.825 11 HB1 ALA 3 HB1 ALA 3 47.972 51.359 39.199 12 HB2 ALA 3 HB2 ALA 3 47.187 52.878 38.715 13 HB3 ALA 3 HB3 ALA 3 46.891 52.209 40.328 14 H ALA 4 H ALA 4 45.299 52.689 36.746 15 HA ALA 4 HA ALA 4 45.853 51.038 34.450 16 HB1 ALA 4 HB1 ALA 4 45.883 54.062 34.867 17 HB2 ALA 4 HB2 ALA 4 45.839 53.244 33.298 18 HB3 ALA 4 HB3 ALA 4 44.470 53.084 34.405 19 H GLY 5 H GLY 5 47.697 51.652 32.876 20 HA2 GLY 5 HA2 GLY 5 49.981 52.971 33.276 21 HA3 GLY 5 HA3 GLY 5 50.300 51.575 34.296 22 H VAL 6 H VAL 6 51.889 52.294 32.132 23 HA VAL 6 HA VAL 6 51.635 49.914 30.366 24 HB VAL 6 HB VAL 6 50.937 51.888 29.125 25 HG11 VAL 6 HG11 VAL 6 52.495 53.662 28.507 26 HG12 VAL 6 HG12 VAL 6 52.230 53.658 30.256 27 HG13 VAL 6 HG13 VAL 6 53.738 52.997 29.586 28 HG21 VAL 6 HG21 VAL 6 53.656 50.987 28.134 29 HG22 VAL 6 HG22 VAL 6 52.169 50.019 27.998 30 HG23 VAL 6 HG23 VAL 6 52.289 51.582 27.180 31 H SER 7 H SER 7 53.483 48.868 29.833 32 HA SER 7 HA SER 7 55.778 49.152 31.624 33 HB2 SER 7 HB2 SER 7 55.118 47.180 29.402 34 HB3 SER 7 HB3 SER 7 56.521 47.056 30.481 35 HG SER 7 HG SER 7 55.175 46.890 32.233 36 H ALA 8 H ALA 8 58.017 48.869 30.732 37 HA ALA 8 HA ALA 8 58.823 50.956 28.992 38 HB1 ALA 8 HB1 ALA 8 61.017 49.792 29.108 39 HB2 ALA 8 HB2 ALA 8 60.265 49.942 30.704 40 HB3 ALA 8 HB3 ALA 8 60.231 48.386 29.843 41 H ALA 9 H ALA 9 59.892 50.769 26.957 42 HA ALA 9 HA ALA 9 58.197 49.632 24.997 43 HB1 ALA 9 HB1 ALA 9 59.945 50.434 23.395 44 HB2 ALA 9 HB2 ALA 9 59.474 51.647 24.597 45 HB3 ALA 9 HB3 ALA 9 61.012 50.773 24.773 46 H GLY 10 H GLY 10 58.270 47.909 23.659 47 HA2 GLY 10 HA2 GLY 10 60.218 46.351 22.703 48 HA3 GLY 10 HA3 GLY 10 59.968 45.587 24.276 49 H ILE 11 H ILE 11 59.543 44.333 21.760 50 HA ILE 11 HA ILE 11 56.635 44.064 21.401 51 HB ILE 11 HB ILE 11 58.119 43.875 19.458 52 HG12 ILE 11 HG12 ILE 11 57.268 41.804 18.447 53 HG13 ILE 11 HG13 ILE 11 56.748 41.209 20.022 54 HG21 ILE 11 HG21 ILE 11 59.183 41.286 20.667 55 HG22 ILE 11 HG22 ILE 11 59.560 41.963 19.076 56 HG23 ILE 11 HG23 ILE 11 60.092 42.799 20.532 57 HD11 ILE 11 HD11 ILE 11 55.093 43.021 20.183 58 HD12 ILE 11 HD12 ILE 11 55.686 43.722 18.658 59 HD13 ILE 11 HD13 ILE 11 54.892 42.136 18.664 60 H GLU 12 H GLU 12 55.338 42.486 22.273 61 HA GLU 12 HA GLU 12 56.556 40.209 23.719 62 HB2 GLU 12 HB2 GLU 12 54.502 42.056 24.974 63 HB3 GLU 12 HB3 GLU 12 55.133 40.576 25.674 64 HG2 GLU 12 HG2 GLU 12 56.701 43.137 25.167 65 HG3 GLU 12 HG3 GLU 12 56.078 42.582 26.708 66 HA PRO 13 HA PRO 13 52.919 38.202 21.886 67 HB2 PRO 13 HB2 PRO 13 53.397 36.164 24.049 68 HB3 PRO 13 HB3 PRO 13 53.114 35.917 22.295 69 HG2 PRO 13 HG2 PRO 13 55.611 35.700 23.278 70 HG3 PRO 13 HG3 PRO 13 55.343 36.612 21.761 71 HD2 PRO 13 HD2 PRO 13 55.612 37.731 24.580 72 HD3 PRO 13 HD3 PRO 13 56.470 38.216 23.084 73 H ASP 14 H ASP 14 50.674 37.992 22.444 74 HA ASP 14 HA ASP 14 49.910 39.756 24.591 75 HB2 ASP 14 HB2 ASP 14 48.041 38.037 22.945 76 HB3 ASP 14 HB3 ASP 14 47.661 39.516 23.821 77 H LEU 15 H LEU 15 50.382 36.336 24.594 78 HA LEU 15 HA LEU 15 48.949 35.522 26.859 79 HB2 LEU 15 HB2 LEU 15 50.540 34.187 25.373 80 HB3 LEU 15 HB3 LEU 15 51.881 34.936 26.234 81 HG LEU 15 HG LEU 15 51.103 33.879 28.343 82 HD11 LEU 15 HD11 LEU 15 49.379 32.028 28.150 83 HD12 LEU 15 HD12 LEU 15 48.972 32.644 26.538 84 HD13 LEU 15 HD13 LEU 15 48.698 33.650 27.980 85 HD21 LEU 15 HD21 LEU 15 51.454 31.962 26.017 86 HD22 LEU 15 HD22 LEU 15 51.625 31.549 27.738 87 HD23 LEU 15 HD23 LEU 15 52.740 32.706 27.009 88 H THR 16 H THR 16 51.746 37.727 26.694 89 HA THR 16 HA THR 16 52.260 37.847 29.541 90 HB THR 16 HB THR 16 53.461 39.911 29.093 91 HG1 THR 16 HG1 THR 16 52.694 39.663 26.385 92 HG21 THR 16 HG21 THR 16 55.063 39.128 27.400 93 HG22 THR 16 HG22 THR 16 53.989 37.792 26.959 94 HG23 THR 16 HG23 THR 16 54.685 37.883 28.594 95 H ALA 17 H ALA 17 50.066 39.676 27.408 96 HA ALA 17 HA ALA 17 49.169 41.556 29.400 97 HB1 ALA 17 HB1 ALA 17 48.989 41.983 26.989 98 HB2 ALA 17 HB2 ALA 17 47.836 40.637 26.821 99 HB3 ALA 17 HB3 ALA 17 47.409 42.054 27.788 100 H ILE 18 H ILE 18 47.868 38.438 28.159 101 HA ILE 18 HA ILE 18 45.643 38.212 29.933 102 HB ILE 18 HB ILE 18 47.402 35.992 28.805 103 HG12 ILE 18 HG12 ILE 18 44.760 37.095 27.750 104 HG13 ILE 18 HG13 ILE 18 46.335 37.482 27.078 105 HG21 ILE 18 HG21 ILE 18 46.054 35.172 30.710 106 HG22 ILE 18 HG22 ILE 18 44.588 35.866 29.987 107 HG23 ILE 18 HG23 ILE 18 45.436 34.511 29.211 108 HD11 ILE 18 HD11 ILE 18 46.673 35.004 26.620 109 HD12 ILE 18 HD12 ILE 18 44.952 34.787 27.033 110 HD13 ILE 18 HD13 ILE 18 45.415 35.812 25.673 111 H TRP 19 H TRP 19 49.059 37.151 30.439 112 HA TRP 19 HA TRP 19 48.566 36.103 33.066 113 HB2 TRP 19 HB2 TRP 19 51.073 36.933 31.584 114 HB3 TRP 19 HB3 TRP 19 51.112 36.314 33.227 115 HD1 TRP 19 HD1 TRP 19 48.664 34.644 30.852 116 HE1 TRP 19 HE1 TRP 19 49.456 32.274 30.332 117 HE3 TRP 19 HE3 TRP 19 53.311 34.829 32.994 118 HZ2 TRP 19 HZ2 TRP 19 51.836 30.705 30.625 119 HZ3 TRP 19 HZ3 TRP 19 54.814 32.849 32.876 120 HH2 TRP 19 HH2 TRP 19 54.111 30.814 31.651 121 H GLN 20 H GLN 20 49.807 39.401 32.107 122 HA GLN 20 HA GLN 20 49.996 40.125 34.906 123 HB2 GLN 20 HB2 GLN 20 50.512 42.337 34.233 124 HB3 GLN 20 HB3 GLN 20 51.412 41.161 33.287 125 HG2 GLN 20 HG2 GLN 20 49.553 41.544 31.487 126 HG3 GLN 20 HG3 GLN 20 49.193 42.996 32.395 127 HE21 GLN 20 HE21 GLN 20 49.825 43.966 30.224 128 HE22 GLN 20 HE22 GLN 20 51.528 44.410 30.059 129 H ALA 21 H ALA 21 47.290 40.272 32.637 130 HA ALA 21 HA ALA 21 45.543 41.758 34.390 131 HB1 ALA 21 HB1 ALA 21 45.088 41.488 32.008 132 HB2 ALA 21 HB2 ALA 21 44.989 39.724 32.186 133 HB3 ALA 21 HB3 ALA 21 43.778 40.759 32.960 134 H LEU 22 H LEU 22 45.919 38.158 33.915 135 HA LEU 22 HA LEU 22 43.964 37.546 35.938 136 HB2 LEU 22 HB2 LEU 22 46.179 35.900 34.640 137 HB3 LEU 22 HB3 LEU 22 44.991 35.225 35.738 138 HG LEU 22 HG LEU 22 44.342 36.509 33.042 139 HD11 LEU 22 HD11 LEU 22 45.513 34.324 32.914 140 HD12 LEU 22 HD12 LEU 22 43.829 34.206 32.369 141 HD13 LEU 22 HD13 LEU 22 44.280 33.624 33.991 142 HD21 LEU 22 HD21 LEU 22 42.441 36.803 34.537 143 HD22 LEU 22 HD22 LEU 22 42.533 35.101 35.050 144 HD23 LEU 22 HD23 LEU 22 42.102 35.527 33.379 145 H PHE 23 H PHE 23 47.526 37.690 36.038 146 HA PHE 23 HA PHE 23 47.530 36.709 38.774 147 HB2 PHE 23 HB2 PHE 23 49.813 37.567 36.999 148 HB3 PHE 23 HB3 PHE 23 49.954 36.683 38.497 149 HD1 PHE 23 HD1 PHE 23 50.999 35.969 35.669 150 HD2 PHE 23 HD2 PHE 23 47.602 34.691 37.989 151 HE1 PHE 23 HE1 PHE 23 50.985 33.791 34.471 152 HE2 PHE 23 HE2 PHE 23 47.597 32.534 36.792 153 HZ PHE 23 HZ PHE 23 49.260 32.094 34.997 154 H ALA 24 H ALA 24 46.806 39.691 37.819 155 HA ALA 24 HA ALA 24 46.954 41.793 38.569 156 HB1 ALA 24 HB1 ALA 24 46.629 42.060 40.977 157 HB2 ALA 24 HB2 ALA 24 45.699 40.690 40.351 158 HB3 ALA 24 HB3 ALA 24 47.200 40.403 41.259 159 H LEU 25 H LEU 25 49.597 40.529 37.950 160 HA LEU 25 HA LEU 25 51.689 41.338 39.623 161 HB2 LEU 25 HB2 LEU 25 51.431 40.838 36.634 162 HB3 LEU 25 HB3 LEU 25 52.991 41.200 37.338 163 HG LEU 25 HG LEU 25 51.298 38.882 38.340 164 HD11 LEU 25 HD11 LEU 25 53.455 38.973 36.209 165 HD12 LEU 25 HD12 LEU 25 51.742 38.561 35.956 166 HD13 LEU 25 HD13 LEU 25 52.773 37.483 36.901 167 HD21 LEU 25 HD21 LEU 25 53.482 38.052 39.147 168 HD22 LEU 25 HD22 LEU 25 53.110 39.620 39.862 169 HD23 LEU 25 HD23 LEU 25 54.284 39.509 38.533 170 HA PRO 26 HA PRO 26 52.433 45.636 38.416 171 HB2 PRO 26 HB2 PRO 26 55.031 46.008 39.059 172 HB3 PRO 26 HB3 PRO 26 53.813 45.646 40.315 173 HG2 PRO 26 HG2 PRO 26 55.694 43.697 38.950 174 HG3 PRO 26 HG3 PRO 26 55.398 43.895 40.704 175 HD2 PRO 26 HD2 PRO 26 54.129 42.016 39.124 176 HD3 PRO 26 HD3 PRO 26 53.384 42.730 40.576 177 H ALA 27 H ALA 27 52.021 44.092 36.329 178 HA ALA 27 HA ALA 27 52.382 43.446 34.242 179 HB1 ALA 27 HB1 ALA 27 54.722 45.333 34.083 180 HB2 ALA 27 HB2 ALA 27 53.874 44.579 32.737 181 HB3 ALA 27 HB3 ALA 27 53.022 45.748 33.761 182 H VAL 28 H VAL 28 53.566 42.090 32.862 183 HA VAL 28 HA VAL 28 55.342 40.145 34.262 184 HB VAL 28 HB VAL 28 53.766 40.144 31.662 185 HG11 VAL 28 HG11 VAL 28 54.445 37.796 31.330 186 HG12 VAL 28 HG12 VAL 28 55.807 38.886 31.139 187 HG13 VAL 28 HG13 VAL 28 55.651 37.955 32.636 188 HG21 VAL 28 HG21 VAL 28 53.577 38.081 33.873 189 HG22 VAL 28 HG22 VAL 28 52.691 39.604 33.984 190 HG23 VAL 28 HG23 VAL 28 52.404 38.518 32.620 191 H GLY 29 H GLY 29 57.527 40.388 34.059 192 HA2 GLY 29 HA2 GLY 29 58.727 41.785 31.755 193 HA3 GLY 29 HA3 GLY 29 59.562 41.108 33.147 194 H ARG 30 H ARG 30 59.759 40.815 30.087 195 HA ARG 30 HA ARG 30 59.128 38.215 29.218 196 HB2 ARG 30 HB2 ARG 30 59.739 40.175 27.861 197 HB3 ARG 30 HB3 ARG 30 61.412 40.053 28.389 198 HG2 ARG 30 HG2 ARG 30 61.638 37.889 27.199 199 HG3 ARG 30 HG3 ARG 30 59.919 37.948 26.754 200 HD2 ARG 30 HD2 ARG 30 60.412 40.192 25.633 201 HD3 ARG 30 HD3 ARG 30 62.115 39.888 25.949 202 HE ARG 30 HE ARG 30 62.141 38.146 24.359 203 HH11 ARG 30 HH11 ARG 30 58.859 39.554 24.480 204 HH12 ARG 30 HH12 ARG 30 58.571 39.017 22.826 205 HH21 ARG 30 HH21 ARG 30 61.449 37.345 22.371 206 HH22 ARG 30 HH22 ARG 30 59.828 37.774 21.812 207 H HIS 31 H HIS 31 61.761 39.093 31.282 208 HA HIS 31 HA HIS 31 63.158 36.537 30.893 209 HB2 HIS 31 HB2 HIS 31 64.885 37.470 32.251 210 HB3 HIS 31 HB3 HIS 31 64.341 38.751 31.179 211 HD1 HIS 31 HD1 HIS 31 62.844 40.778 32.427 212 HD2 HIS 31 HD2 HIS 31 64.538 37.783 34.865 213 HE1 HIS 31 HE1 HIS 31 62.646 41.600 34.819 214 H GLN 32 H GLN 32 60.462 37.272 32.646 215 HA GLN 32 HA GLN 32 61.313 35.937 35.126 216 HB2 GLN 32 HB2 GLN 32 58.821 37.386 34.288 217 HB3 GLN 32 HB3 GLN 32 59.072 36.689 35.910 218 HG2 GLN 32 HG2 GLN 32 61.152 38.166 36.066 219 HG3 GLN 32 HG3 GLN 32 60.589 38.987 34.603 220 HE21 GLN 32 HE21 GLN 32 59.813 38.291 38.023 221 HE22 GLN 32 HE22 GLN 32 58.683 39.640 38.186 222 H ASP 33 H ASP 33 60.251 34.241 36.086 223 HA ASP 33 HA ASP 33 59.376 32.162 34.178 224 HB2 ASP 33 HB2 ASP 33 60.105 32.028 37.134 225 HB3 ASP 33 HB3 ASP 33 59.827 30.658 36.068 226 H PHE 34 H PHE 34 57.350 31.112 34.239 227 HA PHE 34 HA PHE 34 55.076 32.101 35.543 228 HB2 PHE 34 HB2 PHE 34 54.896 30.521 33.815 229 HB3 PHE 34 HB3 PHE 34 55.752 29.270 34.718 230 HD1 PHE 34 HD1 PHE 34 54.651 28.215 36.737 231 HD2 PHE 34 HD2 PHE 34 52.514 30.940 34.168 232 HE1 PHE 34 HE1 PHE 34 52.520 27.500 37.758 233 HE2 PHE 34 HE2 PHE 34 50.373 30.157 35.139 234 HZ PHE 34 HZ PHE 34 50.373 28.456 36.955 235 H PHE 35 H PHE 35 57.355 29.681 36.878 236 HA PHE 35 HA PHE 35 56.327 29.071 39.312 237 HB2 PHE 35 HB2 PHE 35 58.565 28.448 38.227 238 HB3 PHE 35 HB3 PHE 35 59.212 29.943 38.872 239 HD1 PHE 35 HD1 PHE 35 58.043 26.537 39.624 240 HD2 PHE 35 HD2 PHE 35 59.551 30.198 41.345 241 HE1 PHE 35 HE1 PHE 35 58.534 25.345 41.740 242 HE2 PHE 35 HE2 PHE 35 60.017 29.002 43.470 243 HZ PHE 35 HZ PHE 35 59.521 26.575 43.669 244 H ALA 36 H ALA 36 57.513 32.293 38.481 245 HA ALA 36 HA ALA 36 57.151 33.274 41.286 246 HB1 ALA 36 HB1 ALA 36 58.595 35.095 40.562 247 HB2 ALA 36 HB2 ALA 36 59.376 33.542 40.175 248 HB3 ALA 36 HB3 ALA 36 58.578 34.480 38.892 249 H LEU 37 H LEU 37 56.250 33.823 37.901 250 HA LEU 37 HA LEU 37 54.741 36.242 38.278 251 HB2 LEU 37 HB2 LEU 37 54.821 34.092 36.129 252 HB3 LEU 37 HB3 LEU 37 53.904 35.548 35.922 253 HG LEU 37 HG LEU 37 56.939 35.468 36.324 254 HD11 LEU 37 HD11 LEU 37 57.005 35.976 33.897 255 HD12 LEU 37 HD12 LEU 37 55.239 35.840 33.825 256 HD13 LEU 37 HD13 LEU 37 56.240 34.420 34.207 257 HD21 LEU 37 HD21 LEU 37 56.015 37.640 37.004 258 HD22 LEU 37 HD22 LEU 37 55.135 37.742 35.457 259 HD23 LEU 37 HD23 LEU 37 56.896 37.772 35.479 260 H GLY 38 H GLY 38 53.842 32.816 38.364 261 HA2 GLY 38 HA2 GLY 38 51.048 33.093 37.907 262 HA3 GLY 38 HA3 GLY 38 51.838 31.726 38.704 263 H GLY 39 H GLY 39 52.855 33.335 40.942 264 HA2 GLY 39 HA2 GLY 39 52.282 34.445 42.877 265 HA3 GLY 39 HA3 GLY 39 50.658 34.734 42.246 266 H ASP 40 H ASP 40 49.670 32.220 41.822 267 HA ASP 40 HA ASP 40 49.799 30.691 44.380 268 HB2 ASP 40 HB2 ASP 40 48.050 32.640 44.358 269 HB3 ASP 40 HB3 ASP 40 47.173 31.642 43.203 270 H SER 41 H SER 41 49.158 28.481 44.100 271 HA SER 41 HA SER 41 48.979 27.307 41.450 272 HB2 SER 41 HB2 SER 41 48.242 25.297 42.618 273 HB3 SER 41 HB3 SER 41 49.699 25.982 43.354 274 HG SER 41 HG SER 41 48.472 26.795 45.035 275 H GLN 42 H GLN 42 46.503 28.571 43.707 276 HA GLN 42 HA GLN 42 44.289 27.661 42.093 277 HB2 GLN 42 HB2 GLN 42 44.546 29.915 44.131 278 HB3 GLN 42 HB3 GLN 42 43.034 29.546 43.306 279 HG2 GLN 42 HG2 GLN 42 44.596 27.584 45.036 280 HG3 GLN 42 HG3 GLN 42 43.186 28.508 45.545 281 HE21 GLN 42 HE21 GLN 42 43.017 25.758 45.824 282 HE22 GLN 42 HE22 GLN 42 41.977 25.122 44.563 283 H LEU 43 H LEU 43 46.358 30.540 41.824 284 HA LEU 43 HA LEU 43 44.707 31.693 39.689 285 HB2 LEU 43 HB2 LEU 43 47.504 32.360 40.660 286 HB3 LEU 43 HB3 LEU 43 46.663 33.187 39.358 287 HG LEU 43 HG LEU 43 45.961 33.229 42.309 288 HD11 LEU 43 HD11 LEU 43 46.464 35.449 40.297 289 HD12 LEU 43 HD12 LEU 43 47.720 34.784 41.376 290 HD13 LEU 43 HD13 LEU 43 46.302 35.611 42.056 291 HD21 LEU 43 HD21 LEU 43 44.089 34.732 41.695 292 HD22 LEU 43 HD22 LEU 43 43.823 33.068 41.175 293 HD23 LEU 43 HD23 LEU 43 44.323 34.305 39.985 294 H GLY 44 H GLY 44 47.592 29.600 39.866 295 HA2 GLY 44 HA2 GLY 44 48.172 29.442 37.085 296 HA3 GLY 44 HA3 GLY 44 48.434 28.151 38.278 297 H LEU 45 H LEU 45 45.967 27.374 39.062 298 HA LEU 45 HA LEU 45 44.827 26.026 36.785 299 HB2 LEU 45 HB2 LEU 45 44.203 26.244 39.714 300 HB3 LEU 45 HB3 LEU 45 42.921 25.700 38.642 301 HG LEU 45 HG LEU 45 44.266 23.870 37.785 302 HD11 LEU 45 HD11 LEU 45 46.557 24.739 37.933 303 HD12 LEU 45 HD12 LEU 45 46.421 23.234 38.840 304 HD13 LEU 45 HD13 LEU 45 46.449 24.782 39.708 305 HD21 LEU 45 HD21 LEU 45 44.318 22.509 39.803 306 HD22 LEU 45 HD22 LEU 45 42.921 23.598 39.845 307 HD23 LEU 45 HD23 LEU 45 44.354 23.965 40.827 308 H ARG 46 H ARG 46 43.773 29.044 38.430 309 HA ARG 46 HA ARG 46 41.419 29.480 36.842 310 HB2 ARG 46 HB2 ARG 46 42.053 30.738 38.892 311 HB3 ARG 46 HB3 ARG 46 43.373 31.502 38.003 312 HG2 ARG 46 HG2 ARG 46 41.735 32.585 36.477 313 HG3 ARG 46 HG3 ARG 46 40.411 31.862 37.406 314 HD2 ARG 46 HD2 ARG 46 42.556 33.732 38.512 315 HD3 ARG 46 HD3 ARG 46 40.939 34.249 38.058 316 HE ARG 46 HE ARG 46 40.720 32.087 39.935 317 HH11 ARG 46 HH11 ARG 46 41.770 35.475 40.053 318 HH12 ARG 46 HH12 ARG 46 41.543 35.464 41.794 319 HH21 ARG 46 HH21 ARG 46 40.545 32.260 42.056 320 HH22 ARG 46 HH22 ARG 46 40.943 33.781 42.860 321 H MET 47 H MET 47 44.844 30.242 36.168 322 HA MET 47 HA MET 47 44.304 31.495 33.626 323 HB2 MET 47 HB2 MET 47 46.348 31.842 34.995 324 HB3 MET 47 HB3 MET 47 46.885 30.206 34.614 325 HG2 MET 47 HG2 MET 47 46.197 31.698 32.178 326 HG3 MET 47 HG3 MET 47 47.312 32.604 33.181 327 HE1 MET 47 HE1 MET 47 46.675 29.571 30.976 328 HE2 MET 47 HE2 MET 47 48.236 28.747 30.867 329 HE3 MET 47 HE3 MET 47 47.234 28.533 32.316 330 H LEU 48 H LEU 48 45.205 28.104 34.493 331 HA LEU 48 HA LEU 48 45.198 27.091 31.838 332 HB2 LEU 48 HB2 LEU 48 45.997 25.816 33.791 333 HB3 LEU 48 HB3 LEU 48 44.366 25.770 34.455 334 HG LEU 48 HG LEU 48 43.599 24.399 32.519 335 HD11 LEU 48 HD11 LEU 48 46.540 24.463 31.746 336 HD12 LEU 48 HD12 LEU 48 45.171 25.075 30.777 337 HD13 LEU 48 HD13 LEU 48 45.343 23.338 31.074 338 HD21 LEU 48 HD21 LEU 48 46.028 23.288 33.974 339 HD22 LEU 48 HD22 LEU 48 44.755 22.338 33.177 340 HD23 LEU 48 HD23 LEU 48 44.359 23.323 34.591 341 H ALA 49 H ALA 49 42.480 27.299 34.169 342 HA ALA 49 HA ALA 49 40.388 26.396 32.544 343 HB1 ALA 49 HB1 ALA 49 40.469 28.473 34.782 344 HB2 ALA 49 HB2 ALA 49 38.984 27.794 34.115 345 HB3 ALA 49 HB3 ALA 49 40.156 26.736 34.935 346 H GLN 50 H GLN 50 41.232 29.906 33.062 347 HA GLN 50 HA GLN 50 39.313 30.673 31.059 348 HB2 GLN 50 HB2 GLN 50 41.501 32.300 32.407 349 HB3 GLN 50 HB3 GLN 50 40.259 32.946 31.317 350 HG2 GLN 50 HG2 GLN 50 38.502 31.915 32.854 351 HG3 GLN 50 HG3 GLN 50 39.791 31.559 33.992 352 HE21 GLN 50 HE21 GLN 50 38.218 32.930 35.327 353 HE22 GLN 50 HE22 GLN 50 38.696 34.631 35.413 354 H LEU 51 H LEU 51 42.878 30.177 30.782 355 HA LEU 51 HA LEU 51 42.922 31.225 28.082 356 HB2 LEU 51 HB2 LEU 51 44.912 31.038 29.619 357 HB3 LEU 51 HB3 LEU 51 44.850 29.284 29.394 358 HG LEU 51 HG LEU 51 45.162 29.696 26.903 359 HD11 LEU 51 HD11 LEU 51 46.142 31.854 26.214 360 HD12 LEU 51 HD12 LEU 51 45.841 32.515 27.832 361 HD13 LEU 51 HD13 LEU 51 44.483 32.069 26.773 362 HD21 LEU 51 HD21 LEU 51 47.337 30.705 28.777 363 HD22 LEU 51 HD22 LEU 51 47.582 30.135 27.110 364 HD23 LEU 51 HD23 LEU 51 47.022 29.006 28.352 365 H ARG 52 H ARG 52 42.387 27.906 29.431 366 HA ARG 52 HA ARG 52 42.233 26.669 26.825 367 HB2 ARG 52 HB2 ARG 52 42.571 25.443 28.972 368 HB3 ARG 52 HB3 ARG 52 40.896 25.801 29.408 369 HG2 ARG 52 HG2 ARG 52 40.112 24.612 27.386 370 HG3 ARG 52 HG3 ARG 52 41.763 24.214 26.922 371 HD2 ARG 52 HD2 ARG 52 40.438 23.475 29.524 372 HD3 ARG 52 HD3 ARG 52 40.454 22.398 28.120 373 HE ARG 52 HE ARG 52 43.132 22.862 28.557 374 HH11 ARG 52 HH11 ARG 52 40.544 21.827 30.737 375 HH12 ARG 52 HH12 ARG 52 41.590 20.712 31.585 376 HH21 ARG 52 HH21 ARG 52 44.399 21.230 29.760 377 HH22 ARG 52 HH22 ARG 52 43.605 20.446 31.081 378 H GLU 53 H GLU 53 39.678 28.029 28.956 379 HA GLU 53 HA GLU 53 37.515 27.558 27.147 380 HB2 GLU 53 HB2 GLU 53 37.896 29.592 29.371 381 HB3 GLU 53 HB3 GLU 53 36.400 29.418 28.450 382 HG2 GLU 53 HG2 GLU 53 36.150 27.090 29.168 383 HG3 GLU 53 HG3 GLU 53 37.674 27.143 30.037 384 H ARG 54 H ARG 54 39.637 30.467 27.407 385 HA ARG 54 HA ARG 54 38.216 31.884 25.269 386 HB2 ARG 54 HB2 ARG 54 40.819 32.434 26.761 387 HB3 ARG 54 HB3 ARG 54 40.145 33.487 25.526 388 HG2 ARG 54 HG2 ARG 54 38.105 33.841 26.854 389 HG3 ARG 54 HG3 ARG 54 38.696 32.755 28.110 390 HD2 ARG 54 HD2 ARG 54 39.045 35.124 28.719 391 HD3 ARG 54 HD3 ARG 54 40.567 34.228 28.605 392 HE ARG 54 HE ARG 54 39.766 35.634 26.149 393 HH11 ARG 54 HH11 ARG 54 41.456 36.212 29.158 394 HH12 ARG 54 HH12 ARG 54 42.526 37.374 28.417 395 HH21 ARG 54 HH21 ARG 54 41.255 37.018 25.253 396 HH22 ARG 54 HH22 ARG 54 42.567 37.626 26.216 397 H HIS 55 H HIS 55 41.201 29.984 25.373 398 HA HIS 55 HA HIS 55 41.759 30.746 22.544 399 HB2 HIS 55 HB2 HIS 55 43.127 31.755 24.453 400 HB3 HIS 55 HB3 HIS 55 43.810 30.157 24.686 401 HD1 HIS 55 HD1 HIS 55 43.684 32.932 21.995 402 HD2 HIS 55 HD2 HIS 55 45.835 29.509 23.142 403 HE1 HIS 55 HE1 HIS 55 45.743 32.847 20.498 404 H GLY 56 H GLY 56 41.169 27.974 24.515 405 HA2 GLY 56 HA2 GLY 56 40.884 25.798 23.837 406 HA3 GLY 56 HA3 GLY 56 41.331 26.281 22.201 407 H VAL 57 H VAL 57 43.096 25.997 25.358 408 HA VAL 57 HA VAL 57 45.228 24.381 24.104 409 HB VAL 57 HB VAL 57 47.010 25.996 24.736 410 HG11 VAL 57 HG11 VAL 57 46.217 25.818 22.428 411 HG12 VAL 57 HG12 VAL 57 45.118 27.186 22.718 412 HG13 VAL 57 HG13 VAL 57 46.877 27.402 22.849 413 HG21 VAL 57 HG21 VAL 57 46.512 28.329 25.152 414 HG22 VAL 57 HG22 VAL 57 44.763 28.018 25.083 415 HG23 VAL 57 HG23 VAL 57 45.746 27.341 26.400 416 H ASP 58 H ASP 58 47.201 24.818 26.048 417 HA ASP 58 HA ASP 58 46.072 24.088 28.640 418 HB2 ASP 58 HB2 ASP 58 46.387 22.045 26.991 419 HB3 ASP 58 HB3 ASP 58 48.096 22.234 27.349 420 H LEU 59 H LEU 59 47.909 23.846 30.233 421 HA LEU 59 HA LEU 59 50.365 25.373 29.498 422 HB2 LEU 59 HB2 LEU 59 48.825 26.609 31.088 423 HB3 LEU 59 HB3 LEU 59 49.053 25.304 32.240 424 HG LEU 59 HG LEU 59 51.592 25.785 32.047 425 HD11 LEU 59 HD11 LEU 59 50.528 28.344 30.779 426 HD12 LEU 59 HD12 LEU 59 51.590 27.150 30.004 427 HD13 LEU 59 HD13 LEU 59 52.177 28.104 31.373 428 HD21 LEU 59 HD21 LEU 59 51.489 27.615 33.649 429 HD22 LEU 59 HD22 LEU 59 50.203 26.446 33.989 430 HD23 LEU 59 HD23 LEU 59 49.812 27.980 33.180 431 HA PRO 60 HA PRO 60 50.814 20.885 30.571 432 HB2 PRO 60 HB2 PRO 60 52.439 20.007 28.559 433 HB3 PRO 60 HB3 PRO 60 50.689 20.311 28.323 434 HG2 PRO 60 HG2 PRO 60 52.998 22.198 27.716 435 HG3 PRO 60 HG3 PRO 60 51.646 21.727 26.634 436 HD2 PRO 60 HD2 PRO 60 51.555 24.027 28.084 437 HD3 PRO 60 HD3 PRO 60 50.104 23.013 27.845 438 H LEU 61 H LEU 61 52.270 19.887 31.831 439 HA LEU 61 HA LEU 61 54.256 21.502 33.035 440 HB2 LEU 61 HB2 LEU 61 53.274 18.703 33.347 441 HB3 LEU 61 HB3 LEU 61 54.901 18.996 33.923 442 HG LEU 61 HG LEU 61 53.144 19.212 35.663 443 HD11 LEU 61 HD11 LEU 61 54.802 21.716 35.153 444 HD12 LEU 61 HD12 LEU 61 55.348 20.228 35.962 445 HD13 LEU 61 HD13 LEU 61 54.085 21.227 36.702 446 HD21 LEU 61 HD21 LEU 61 51.408 20.345 34.322 447 HD22 LEU 61 HD22 LEU 61 52.407 21.815 34.262 448 HD23 LEU 61 HD23 LEU 61 51.801 21.229 35.813 449 H ARG 62 H ARG 62 54.631 19.180 30.395 450 HA ARG 62 HA ARG 62 57.456 19.045 30.426 451 HB2 ARG 62 HB2 ARG 62 55.410 18.618 28.287 452 HB3 ARG 62 HB3 ARG 62 57.109 18.801 27.815 453 HG2 ARG 62 HG2 ARG 62 57.767 17.045 29.448 454 HG3 ARG 62 HG3 ARG 62 56.070 16.829 29.889 455 HD2 ARG 62 HD2 ARG 62 56.734 15.074 28.418 456 HD3 ARG 62 HD3 ARG 62 55.558 16.107 27.590 457 HE ARG 62 HE ARG 62 58.168 17.043 26.921 458 HH11 ARG 62 HH11 ARG 62 56.389 14.057 26.372 459 HH12 ARG 62 HH12 ARG 62 57.133 13.858 24.805 460 HH21 ARG 62 HH21 ARG 62 59.095 16.658 25.099 461 HH22 ARG 62 HH22 ARG 62 58.802 15.198 24.159 462 H CYS 63 H CYS 63 55.715 21.278 28.168 463 HA CYS 63 HA CYS 63 58.143 22.781 27.769 464 HB2 CYS 63 HB2 CYS 63 55.261 23.467 27.113 465 HB3 CYS 63 HB3 CYS 63 56.667 24.437 26.639 466 HG CYS 63 HG CYS 63 55.779 21.357 25.815 467 H LEU 64 H LEU 64 55.563 23.148 30.178 468 HA LEU 64 HA LEU 64 56.364 25.722 31.167 469 HB2 LEU 64 HB2 LEU 64 54.234 24.468 31.663 470 HB3 LEU 64 HB3 LEU 64 55.174 23.361 32.659 471 HG LEU 64 HG LEU 64 55.809 25.234 34.175 472 HD11 LEU 64 HD11 LEU 64 53.920 26.842 32.406 473 HD12 LEU 64 HD12 LEU 64 55.649 27.161 32.692 474 HD13 LEU 64 HD13 LEU 64 54.491 27.349 34.004 475 HD21 LEU 64 HD21 LEU 64 53.873 23.848 34.714 476 HD22 LEU 64 HD22 LEU 64 52.819 24.895 33.746 477 HD23 LEU 64 HD23 LEU 64 53.608 25.520 35.213 478 H TYR 65 H TYR 65 57.675 22.427 31.835 479 HA TYR 65 HA TYR 65 59.617 23.560 33.730 480 HB2 TYR 65 HB2 TYR 65 58.626 21.258 33.884 481 HB3 TYR 65 HB3 TYR 65 59.601 20.816 32.485 482 HD1 TYR 65 HD1 TYR 65 62.064 20.595 32.698 483 HD2 TYR 65 HD2 TYR 65 59.620 21.829 36.031 484 HE1 TYR 65 HE1 TYR 65 64.002 20.311 34.227 485 HE2 TYR 65 HE2 TYR 65 61.544 21.516 37.563 486 HH TYR 65 HH TYR 65 64.758 20.488 36.353 487 H GLU 66 H GLU 66 59.657 22.704 30.232 488 HA GLU 66 HA GLU 66 62.544 22.937 30.075 489 HB2 GLU 66 HB2 GLU 66 60.757 23.424 27.678 490 HB3 GLU 66 HB3 GLU 66 62.419 22.837 27.744 491 HG2 GLU 66 HG2 GLU 66 61.210 20.881 29.168 492 HG3 GLU 66 HG3 GLU 66 59.844 21.433 28.179 493 H ALA 67 H ALA 67 59.950 25.261 29.311 494 HA ALA 67 HA ALA 67 61.889 27.515 29.367 495 HB1 ALA 67 HB1 ALA 67 60.938 28.366 27.268 496 HB2 ALA 67 HB2 ALA 67 61.685 26.776 27.030 497 HB3 ALA 67 HB3 ALA 67 59.915 26.921 27.124 498 HA PRO 68 HA PRO 68 57.903 28.299 31.779 499 HB2 PRO 68 HB2 PRO 68 59.199 29.246 34.082 500 HB3 PRO 68 HB3 PRO 68 58.648 27.584 33.810 501 HG2 PRO 68 HG2 PRO 68 61.396 28.767 33.373 502 HG3 PRO 68 HG3 PRO 68 60.978 27.200 34.144 503 HD2 PRO 68 HD2 PRO 68 61.838 27.346 31.586 504 HD3 PRO 68 HD3 PRO 68 60.550 26.184 32.011 505 H THR 69 H THR 69 60.284 30.190 30.352 506 HA THR 69 HA THR 69 59.389 32.783 31.410 507 HB THR 69 HB THR 69 61.136 33.176 29.201 508 HG1 THR 69 HG1 THR 69 62.364 31.469 31.051 509 HG21 THR 69 HG21 THR 69 61.008 34.568 31.193 510 HG22 THR 69 HG22 THR 69 62.670 33.983 30.974 511 HG23 THR 69 HG23 THR 69 61.610 33.247 32.208 512 H VAL 70 H VAL 70 58.183 34.256 30.351 513 HA VAL 70 HA VAL 70 56.097 32.912 29.219 514 HB VAL 70 HB VAL 70 56.286 35.933 29.028 515 HG11 VAL 70 HG11 VAL 70 54.240 34.940 28.054 516 HG12 VAL 70 HG12 VAL 70 53.979 33.989 29.534 517 HG13 VAL 70 HG13 VAL 70 53.852 35.756 29.570 518 HG21 VAL 70 HG21 VAL 70 55.252 35.710 31.411 519 HG22 VAL 70 HG22 VAL 70 55.986 34.102 31.410 520 HG23 VAL 70 HG23 VAL 70 57.004 35.547 31.239 521 H ALA 71 H ALA 71 58.253 35.065 27.240 522 HA ALA 71 HA ALA 71 56.536 34.679 24.929 523 HB1 ALA 71 HB1 ALA 71 59.376 35.755 25.100 524 HB2 ALA 71 HB2 ALA 71 58.284 35.890 23.710 525 HB3 ALA 71 HB3 ALA 71 57.889 36.714 25.228 526 H ARG 72 H ARG 72 59.223 32.939 26.295 527 HA ARG 72 HA ARG 72 59.776 31.254 23.946 528 HB2 ARG 72 HB2 ARG 72 60.618 31.012 26.870 529 HB3 ARG 72 HB3 ARG 72 61.255 30.046 25.530 530 HG2 ARG 72 HG2 ARG 72 62.224 32.003 24.471 531 HG3 ARG 72 HG3 ARG 72 61.415 33.087 25.593 532 HD2 ARG 72 HD2 ARG 72 63.688 32.987 26.221 533 HD3 ARG 72 HD3 ARG 72 62.722 32.221 27.477 534 HE ARG 72 HE ARG 72 64.420 30.811 25.426 535 HH11 ARG 72 HH11 ARG 72 63.028 30.709 28.670 536 HH12 ARG 72 HH12 ARG 72 63.954 29.310 29.066 537 HH21 ARG 72 HH21 ARG 72 65.396 29.030 25.947 538 HH22 ARG 72 HH22 ARG 72 64.985 28.152 27.410 539 H LEU 73 H LEU 73 57.956 30.899 26.987 540 HA LEU 73 HA LEU 73 56.837 28.331 26.466 541 HB2 LEU 73 HB2 LEU 73 56.807 29.592 28.595 542 HB3 LEU 73 HB3 LEU 73 55.621 30.699 27.956 543 HG LEU 73 HG LEU 73 54.904 27.813 27.663 544 HD11 LEU 73 HD11 LEU 73 54.974 29.102 30.413 545 HD12 LEU 73 HD12 LEU 73 55.976 27.746 29.861 546 HD13 LEU 73 HD13 LEU 73 54.222 27.541 29.996 547 HD21 LEU 73 HD21 LEU 73 53.407 30.221 28.778 548 HD22 LEU 73 HD22 LEU 73 52.702 28.641 28.357 549 HD23 LEU 73 HD23 LEU 73 53.354 29.690 27.089 550 H ALA 74 H ALA 74 55.490 31.623 25.740 551 HA ALA 74 HA ALA 74 53.243 30.782 24.296 552 HB1 ALA 74 HB1 ALA 74 53.317 33.007 23.272 553 HB2 ALA 74 HB2 ALA 74 53.747 33.101 24.991 554 HB3 ALA 74 HB3 ALA 74 55.014 33.199 23.745 555 H GLU 75 H GLU 75 56.613 31.240 23.098 556 HA GLU 75 HA GLU 75 56.038 30.714 20.339 557 HB2 GLU 75 HB2 GLU 75 58.147 31.781 21.246 558 HB3 GLU 75 HB3 GLU 75 58.661 30.188 21.813 559 HG2 GLU 75 HG2 GLU 75 58.463 29.361 19.441 560 HG3 GLU 75 HG3 GLU 75 58.047 31.008 18.949 561 H THR 76 H THR 76 57.115 28.526 22.960 562 HA THR 76 HA THR 76 57.296 26.203 21.241 563 HB THR 76 HB THR 76 57.412 24.927 23.437 564 HG1 THR 76 HG1 THR 76 57.737 27.508 24.528 565 HG21 THR 76 HG21 THR 76 59.362 27.226 22.951 566 HG22 THR 76 HG22 THR 76 59.437 25.601 22.234 567 HG23 THR 76 HG23 THR 76 59.673 25.811 23.981 568 H ILE 77 H ILE 77 54.696 27.381 23.423 569 HA ILE 77 HA ILE 77 53.002 25.098 22.863 570 HB ILE 77 HB ILE 77 52.355 27.853 23.956 571 HG12 ILE 77 HG12 ILE 77 53.840 26.588 25.444 572 HG13 ILE 77 HG13 ILE 77 52.243 26.746 26.139 573 HG21 ILE 77 HG21 ILE 77 50.292 26.995 23.070 574 HG22 ILE 77 HG22 ILE 77 50.589 25.382 23.742 575 HG23 ILE 77 HG23 ILE 77 50.246 26.758 24.816 576 HD11 ILE 77 HD11 ILE 77 53.187 24.541 26.553 577 HD12 ILE 77 HD12 ILE 77 51.755 24.376 25.520 578 HD13 ILE 77 HD13 ILE 77 53.393 24.238 24.829 579 H VAL 78 H VAL 78 53.330 28.287 21.172 580 HA VAL 78 HA VAL 78 51.267 27.567 19.240 581 HB VAL 78 HB VAL 78 53.552 29.553 19.060 582 HG11 VAL 78 HG11 VAL 78 52.243 30.515 17.138 583 HG12 VAL 78 HG12 VAL 78 52.945 28.943 16.765 584 HG13 VAL 78 HG13 VAL 78 51.214 29.071 17.149 585 HG21 VAL 78 HG21 VAL 78 51.784 31.208 19.379 586 HG22 VAL 78 HG22 VAL 78 50.536 29.945 19.386 587 HG23 VAL 78 HG23 VAL 78 51.699 30.050 20.716 588 H ARG 79 H ARG 79 54.807 26.955 19.323 589 HA ARG 79 HA ARG 79 54.912 25.817 16.692 590 HB2 ARG 79 HB2 ARG 79 56.916 26.662 17.778 591 HB3 ARG 79 HB3 ARG 79 56.719 25.540 19.113 592 HG2 ARG 79 HG2 ARG 79 58.524 24.779 17.808 593 HG3 ARG 79 HG3 ARG 79 57.226 23.629 17.586 594 HD2 ARG 79 HD2 ARG 79 58.090 25.778 15.605 595 HD3 ARG 79 HD3 ARG 79 58.478 24.046 15.544 596 HE ARG 79 HE ARG 79 55.693 24.161 15.625 597 HH11 ARG 79 HH11 ARG 79 58.132 25.041 13.206 598 HH12 ARG 79 HH12 ARG 79 56.922 24.969 11.952 599 HH21 ARG 79 HH21 ARG 79 54.245 24.597 14.038 600 HH22 ARG 79 HH22 ARG 79 54.821 25.006 12.449 601 H LEU 80 H LEU 80 54.409 24.261 19.855 602 HA LEU 80 HA LEU 80 54.389 21.585 18.552 603 HB2 LEU 80 HB2 LEU 80 54.733 22.420 21.456 604 HB3 LEU 80 HB3 LEU 80 54.908 20.786 20.835 605 HG LEU 80 HG LEU 80 56.673 23.124 19.956 606 HD11 LEU 80 HD11 LEU 80 58.419 22.144 21.317 607 HD12 LEU 80 HD12 LEU 80 57.285 20.912 21.930 608 HD13 LEU 80 HD13 LEU 80 57.032 22.631 22.318 609 HD21 LEU 80 HD21 LEU 80 56.978 20.121 19.573 610 HD22 LEU 80 HD22 LEU 80 58.140 21.364 19.066 611 HD23 LEU 80 HD23 LEU 80 56.554 21.281 18.296 612 H ALA 81 H ALA 81 52.104 23.745 19.725 613 HA ALA 81 HA ALA 81 49.954 23.682 20.223 614 HB1 ALA 81 HB1 ALA 81 49.734 22.717 18.048 615 HB2 ALA 81 HB2 ALA 81 49.968 21.086 18.684 616 HB3 ALA 81 HB3 ALA 81 48.518 22.004 19.120 617 H ALA 82 H ALA 82 48.096 22.597 21.300 618 HA ALA 82 HA ALA 82 48.923 20.931 23.626 619 HB1 ALA 82 HB1 ALA 82 48.105 22.712 25.142 620 HB2 ALA 82 HB2 ALA 82 49.528 23.208 24.216 621 HB3 ALA 82 HB3 ALA 82 47.916 23.802 23.752 622 HA PRO 83 HA PRO 83 44.596 20.022 22.180 623 HB2 PRO 83 HB2 PRO 83 44.726 17.326 21.945 624 HB3 PRO 83 HB3 PRO 83 45.508 18.428 20.783 625 HG2 PRO 83 HG2 PRO 83 46.813 17.087 23.178 626 HG3 PRO 83 HG3 PRO 83 47.345 17.035 21.464 627 HD2 PRO 83 HD2 PRO 83 48.374 18.840 23.217 628 HD3 PRO 83 HD3 PRO 83 48.053 19.284 21.513 629 H ALA 84 H ALA 84 44.898 20.884 24.696 630 HA ALA 84 HA ALA 84 44.648 20.669 26.916 631 HB1 ALA 84 HB1 ALA 84 42.385 21.013 26.032 632 HB2 ALA 84 HB2 ALA 84 42.125 19.254 25.988 633 HB3 ALA 84 HB3 ALA 84 42.345 20.086 27.542 634 HA PRO 85 HA PRO 85 45.854 16.143 27.261 635 HB2 PRO 85 HB2 PRO 85 48.559 16.137 27.288 636 HB3 PRO 85 HB3 PRO 85 47.642 16.391 25.772 637 HG2 PRO 85 HG2 PRO 85 48.819 18.515 27.609 638 HG3 PRO 85 HG3 PRO 85 49.044 18.342 25.835 639 HD2 PRO 85 HD2 PRO 85 47.156 19.978 26.893 640 HD3 PRO 85 HD3 PRO 85 46.891 19.091 25.380 641 H SER 86 H SER 86 46.184 18.800 29.369 642 HA SER 86 HA SER 86 47.164 17.103 31.620 643 HB2 SER 86 HB2 SER 86 46.662 20.072 31.707 644 HB3 SER 86 HB3 SER 86 47.618 19.079 32.814 645 HG SER 86 HG SER 86 48.280 20.300 30.512 646 H GLY 87 H GLY 87 45.910 16.656 33.383 647 HA2 GLY 87 HA2 GLY 87 42.991 16.858 32.992 648 HA3 GLY 87 HA3 GLY 87 43.860 15.765 34.073 649 H ASP 88 H ASP 88 45.093 18.861 34.538 650 HA ASP 88 HA ASP 88 44.176 18.954 37.188 651 HB2 ASP 88 HB2 ASP 88 45.449 21.187 35.573 652 HB3 ASP 88 HB3 ASP 88 45.367 21.087 37.333 653 H GLN 89 H GLN 89 42.700 20.153 38.294 654 HA GLN 89 HA GLN 89 41.274 22.409 37.264 655 HB2 GLN 89 HB2 GLN 89 38.970 21.161 37.662 656 HB3 GLN 89 HB3 GLN 89 39.723 21.249 36.099 657 HG2 GLN 89 HG2 GLN 89 38.758 19.040 36.595 658 HG3 GLN 89 HG3 GLN 89 40.448 18.992 36.138 659 HE21 GLN 89 HE21 GLN 89 41.663 17.583 37.377 660 HE22 GLN 89 HE22 GLN 89 41.347 17.254 39.088 661 H ASP 90 H ASP 90 40.185 23.517 38.881 662 HA ASP 90 HA ASP 90 39.297 22.151 41.278 663 HB2 ASP 90 HB2 ASP 90 41.728 22.876 41.760 664 HB3 ASP 90 HB3 ASP 90 41.140 24.536 41.707 665 H ASP 91 H ASP 91 37.683 23.345 42.369 666 HA ASP 91 HA ASP 91 36.383 25.540 40.864 667 HB2 ASP 91 HB2 ASP 91 35.216 23.501 41.923 668 HB3 ASP 91 HB3 ASP 91 35.509 24.276 43.484 669 H ALA 92 H ALA 92 38.681 25.193 43.255 670 HA ALA 92 HA ALA 92 39.794 26.429 44.719 671 HB1 ALA 92 HB1 ALA 92 38.214 28.889 43.933 672 HB2 ALA 92 HB2 ALA 92 39.744 28.821 44.821 673 HB3 ALA 92 HB3 ALA 92 39.690 28.322 43.124 674 H SER 93 H SER 93 39.639 27.243 46.912 675 HA SER 93 HA SER 93 37.233 26.080 48.226 676 HB2 SER 93 HB2 SER 93 40.037 26.773 49.158 677 HB3 SER 93 HB3 SER 93 38.731 26.362 50.277 678 HG SER 93 HG SER 93 39.781 24.741 48.178 679 H GLU 94 H GLU 94 38.866 29.159 47.861 680 HA GLU 94 HA GLU 94 36.566 30.700 48.725 681 HB2 GLU 94 HB2 GLU 94 37.817 31.946 50.491 682 HB3 GLU 94 HB3 GLU 94 37.383 30.306 50.944 683 HG2 GLU 94 HG2 GLU 94 39.664 29.520 50.620 684 HG3 GLU 94 HG3 GLU 94 40.146 31.067 49.908 685 H TYR 95 H TYR 95 37.178 33.155 48.664 686 HA TYR 95 HA TYR 95 39.128 33.714 46.483 687 HB2 TYR 95 HB2 TYR 95 36.929 33.131 45.546 688 HB3 TYR 95 HB3 TYR 95 36.156 34.319 46.576 689 HD1 TYR 95 HD1 TYR 95 35.221 35.960 45.243 690 HD2 TYR 95 HD2 TYR 95 39.187 34.532 44.294 691 HE1 TYR 95 HE1 TYR 95 35.404 37.661 43.449 692 HE2 TYR 95 HE2 TYR 95 39.366 36.263 42.509 693 HH TYR 95 HH TYR 95 36.681 38.523 41.806 694 H GLU 96 H GLU 96 38.581 36.321 46.032 695 HA GLU 96 HA GLU 96 39.908 37.636 48.270 696 HB2 GLU 96 HB2 GLU 96 39.041 38.478 45.484 697 HB3 GLU 96 HB3 GLU 96 39.740 39.614 46.647 698 HG2 GLU 96 HG2 GLU 96 41.753 38.254 46.867 699 HG3 GLU 96 HG3 GLU 96 41.085 37.018 45.810 700 H GLU 97 H GLU 97 39.229 39.756 49.077 701 HA GLU 97 HA GLU 97 36.343 39.743 49.786 702 HB2 GLU 97 HB2 GLU 97 38.314 39.778 51.512 703 HB3 GLU 97 HB3 GLU 97 38.467 41.478 51.068 704 HG2 GLU 97 HG2 GLU 97 37.036 41.466 52.955 705 HG3 GLU 97 HG3 GLU 97 35.928 41.656 51.603 706 H GLY 98 H GLY 98 38.894 41.884 48.520 707 HA2 GLY 98 HA2 GLY 98 38.829 43.680 47.123 708 HA3 GLY 98 HA3 GLY 98 37.133 43.312 46.795 709 H VAL 99 H VAL 99 36.419 43.734 49.707 710 HA VAL 99 HA VAL 99 35.445 46.324 49.338 711 HB VAL 99 HB VAL 99 35.601 44.882 52.007 712 HG11 VAL 99 HG11 VAL 99 33.567 46.164 52.520 713 HG12 VAL 99 HG12 VAL 99 34.889 47.271 52.177 714 HG13 VAL 99 HG13 VAL 99 33.653 46.982 50.942 715 HG21 VAL 99 HG21 VAL 99 33.282 44.111 51.439 716 HG22 VAL 99 HG22 VAL 99 33.514 44.718 49.785 717 HG23 VAL 99 HG23 VAL 99 34.511 43.389 50.419 718 H ILE 100 H ILE 100 36.095 48.244 49.673 719 HA ILE 100 HA ILE 100 38.232 48.971 51.660 720 HB ILE 100 HB ILE 100 37.549 50.297 49.006 721 HG12 ILE 100 HG12 ILE 100 40.218 49.010 49.687 722 HG13 ILE 100 HG13 ILE 100 38.920 48.053 48.988 723 HG21 ILE 100 HG21 ILE 100 38.278 52.003 50.581 724 HG22 ILE 100 HG22 ILE 100 39.640 50.994 51.124 725 HG23 ILE 100 HG23 ILE 100 39.614 51.688 49.493 726 HD11 ILE 100 HD11 ILE 100 38.771 49.562 47.047 727 HD12 ILE 100 HD12 ILE 100 40.161 50.483 47.669 728 HD13 ILE 100 HD13 ILE 100 40.345 48.777 47.219 729 H ARG 101 H ARG 101 35.098 49.633 50.240 730 HA ARG 101 HA ARG 101 34.178 51.229 52.514 731 HB2 ARG 101 HB2 ARG 101 33.580 53.165 51.230 732 HB3 ARG 101 HB3 ARG 101 35.277 52.849 50.976 733 HG2 ARG 101 HG2 ARG 101 34.680 53.326 48.831 734 HG3 ARG 101 HG3 ARG 101 34.391 51.591 48.794 735 HD2 ARG 101 HD2 ARG 101 31.923 52.177 49.416 736 HD3 ARG 101 HD3 ARG 101 32.370 53.852 49.111 737 HE ARG 101 HE ARG 101 32.430 53.435 46.810 738 HH11 ARG 101 HH11 ARG 101 32.103 50.276 48.418 739 HH12 ARG 101 HH12 ARG 101 31.829 49.526 46.834 740 HH21 ARG 101 HH21 ARG 101 32.026 52.299 44.971 741 HH22 ARG 101 HH22 ARG 101 31.852 50.555 45.065 Start of MODEL 17 1 H GLY 1 H1 GLY 1 39.423 59.961 30.262 2 HA2 GLY 1 HA2 GLY 1 40.976 59.630 32.002 3 HA3 GLY 1 HA3 GLY 1 39.649 58.457 32.121 4 H ALA 2 H ALA 2 41.508 57.540 33.474 5 HA ALA 2 HA ALA 2 43.575 56.139 31.880 6 HB1 ALA 2 HB1 ALA 2 44.344 57.544 33.749 7 HB2 ALA 2 HB2 ALA 2 43.326 56.627 34.874 8 HB3 ALA 2 HB3 ALA 2 44.687 55.837 34.061 9 H ALA 3 H ALA 3 43.496 54.029 31.516 10 HA ALA 3 HA ALA 3 41.315 52.404 32.531 11 HB1 ALA 3 HB1 ALA 3 42.223 52.292 30.266 12 HB2 ALA 3 HB2 ALA 3 43.768 51.690 30.894 13 HB3 ALA 3 HB3 ALA 3 42.277 50.721 31.090 14 H ALA 4 H ALA 4 44.487 53.109 33.711 15 HA ALA 4 HA ALA 4 45.660 52.454 35.526 16 HB1 ALA 4 HB1 ALA 4 43.752 53.710 36.389 17 HB2 ALA 4 HB2 ALA 4 42.845 52.190 36.609 18 HB3 ALA 4 HB3 ALA 4 44.311 52.507 37.555 19 H GLY 5 H GLY 5 45.567 50.331 33.797 20 HA2 GLY 5 HA2 GLY 5 45.934 48.008 35.612 21 HA3 GLY 5 HA3 GLY 5 44.869 47.856 34.207 22 H VAL 6 H VAL 6 45.979 46.643 32.803 23 HA VAL 6 HA VAL 6 48.911 47.066 32.412 24 HB VAL 6 HB VAL 6 49.002 44.720 31.862 25 HG11 VAL 6 HG11 VAL 6 49.248 45.418 34.215 26 HG12 VAL 6 HG12 VAL 6 47.506 45.176 34.479 27 HG13 VAL 6 HG13 VAL 6 48.535 43.804 34.078 28 HG21 VAL 6 HG21 VAL 6 46.007 44.654 32.447 29 HG22 VAL 6 HG22 VAL 6 46.756 44.379 30.879 30 HG23 VAL 6 HG23 VAL 6 47.028 43.251 32.208 31 H SER 7 H SER 7 49.873 46.544 30.354 32 HA SER 7 HA SER 7 48.239 46.140 27.995 33 HB2 SER 7 HB2 SER 7 48.000 48.625 28.373 34 HB3 SER 7 HB3 SER 7 49.750 48.769 28.149 35 HG SER 7 HG SER 7 48.441 49.170 26.297 36 H ALA 8 H ALA 8 49.458 45.509 26.197 37 HA ALA 8 HA ALA 8 52.408 45.733 26.227 38 HB1 ALA 8 HB1 ALA 8 52.697 43.370 25.627 39 HB2 ALA 8 HB2 ALA 8 52.050 43.567 27.263 40 HB3 ALA 8 HB3 ALA 8 50.968 43.083 25.939 41 H ALA 9 H ALA 9 52.304 47.196 24.601 42 HA ALA 9 HA ALA 9 50.515 47.059 22.382 43 HB1 ALA 9 HB1 ALA 9 51.254 49.139 23.419 44 HB2 ALA 9 HB2 ALA 9 52.933 48.825 22.926 45 HB3 ALA 9 HB3 ALA 9 51.681 49.117 21.698 46 H GLY 10 H GLY 10 51.198 44.805 21.759 47 HA2 GLY 10 HA2 GLY 10 51.899 43.453 20.023 48 HA3 GLY 10 HA3 GLY 10 52.634 44.849 19.239 49 H ILE 11 H ILE 11 53.992 44.859 22.230 50 HA ILE 11 HA ILE 11 56.470 43.542 21.442 51 HB ILE 11 HB ILE 11 56.399 45.673 22.684 52 HG12 ILE 11 HG12 ILE 11 57.829 43.395 24.107 53 HG13 ILE 11 HG13 ILE 11 58.380 44.247 22.663 54 HG21 ILE 11 HG21 ILE 11 55.836 45.847 25.013 55 HG22 ILE 11 HG22 ILE 11 54.450 45.131 24.198 56 HG23 ILE 11 HG23 ILE 11 55.544 44.104 25.145 57 HD11 ILE 11 HD11 ILE 11 59.581 45.133 24.544 58 HD12 ILE 11 HD12 ILE 11 58.447 46.382 24.007 59 HD13 ILE 11 HD13 ILE 11 58.094 45.416 25.459 60 H GLU 12 H GLU 12 57.160 41.573 22.006 61 HA GLU 12 HA GLU 12 57.029 39.376 22.490 62 HB2 GLU 12 HB2 GLU 12 56.345 40.745 25.015 63 HB3 GLU 12 HB3 GLU 12 55.699 39.124 24.935 64 HG2 GLU 12 HG2 GLU 12 57.916 39.062 25.914 65 HG3 GLU 12 HG3 GLU 12 57.958 38.257 24.342 66 HA PRO 13 HA PRO 13 53.192 37.599 21.267 67 HB2 PRO 13 HB2 PRO 13 52.934 35.157 22.477 68 HB3 PRO 13 HB3 PRO 13 54.147 35.514 21.209 69 HG2 PRO 13 HG2 PRO 13 54.526 35.517 24.213 70 HG3 PRO 13 HG3 PRO 13 55.573 34.779 22.955 71 HD2 PRO 13 HD2 PRO 13 56.097 37.172 24.086 72 HD3 PRO 13 HD3 PRO 13 56.505 36.838 22.376 73 H ASP 14 H ASP 14 51.037 37.307 21.738 74 HA ASP 14 HA ASP 14 49.892 39.034 23.579 75 HB2 ASP 14 HB2 ASP 14 48.570 36.602 22.302 76 HB3 ASP 14 HB3 ASP 14 47.752 38.032 22.918 77 H LEU 15 H LEU 15 50.533 35.579 24.100 78 HA LEU 15 HA LEU 15 49.067 35.099 26.413 79 HB2 LEU 15 HB2 LEU 15 51.031 33.757 24.976 80 HB3 LEU 15 HB3 LEU 15 51.886 34.147 26.465 81 HG LEU 15 HG LEU 15 49.771 33.169 27.658 82 HD11 LEU 15 HD11 LEU 15 48.550 31.460 26.418 83 HD12 LEU 15 HD12 LEU 15 49.474 31.823 24.943 84 HD13 LEU 15 HD13 LEU 15 48.355 33.019 25.603 85 HD21 LEU 15 HD21 LEU 15 51.545 31.279 26.069 86 HD22 LEU 15 HD22 LEU 15 50.693 30.906 27.576 87 HD23 LEU 15 HD23 LEU 15 52.036 32.073 27.576 88 H THR 16 H THR 16 51.960 37.137 26.146 89 HA THR 16 HA THR 16 52.427 37.488 28.988 90 HB THR 16 HB THR 16 53.544 39.598 28.390 91 HG1 THR 16 HG1 THR 16 52.978 38.888 25.695 92 HG21 THR 16 HG21 THR 16 54.780 37.444 28.263 93 HG22 THR 16 HG22 THR 16 55.400 38.668 27.163 94 HG23 THR 16 HG23 THR 16 54.397 37.336 26.532 95 H ALA 17 H ALA 17 50.367 39.248 26.664 96 HA ALA 17 HA ALA 17 49.443 41.264 28.468 97 HB1 ALA 17 HB1 ALA 17 49.383 41.461 26.015 98 HB2 ALA 17 HB2 ALA 17 48.177 40.164 25.920 99 HB3 ALA 17 HB3 ALA 17 47.774 41.685 26.710 100 H ILE 18 H ILE 18 48.094 38.124 27.416 101 HA ILE 18 HA ILE 18 45.725 38.105 28.993 102 HB ILE 18 HB ILE 18 47.486 35.750 28.196 103 HG12 ILE 18 HG12 ILE 18 44.981 36.890 26.846 104 HG13 ILE 18 HG13 ILE 18 46.618 37.162 26.277 105 HG21 ILE 18 HG21 ILE 18 44.549 35.774 29.037 106 HG22 ILE 18 HG22 ILE 18 45.499 34.350 28.559 107 HG23 ILE 18 HG23 ILE 18 45.880 35.192 30.044 108 HD11 ILE 18 HD11 ILE 18 45.706 35.432 24.930 109 HD12 ILE 18 HD12 ILE 18 46.896 34.673 26.006 110 HD13 ILE 18 HD13 ILE 18 45.158 34.503 26.333 111 H TRP 19 H TRP 19 49.036 36.939 29.913 112 HA TRP 19 HA TRP 19 48.173 36.266 32.578 113 HB2 TRP 19 HB2 TRP 19 50.951 36.664 31.487 114 HB3 TRP 19 HB3 TRP 19 50.554 35.954 33.047 115 HD1 TRP 19 HD1 TRP 19 52.089 34.581 30.555 116 HE1 TRP 19 HE1 TRP 19 51.205 32.448 29.434 117 HE3 TRP 19 HE3 TRP 19 47.246 34.552 32.364 118 HZ2 TRP 19 HZ2 TRP 19 48.773 30.981 29.267 119 HZ3 TRP 19 HZ3 TRP 19 45.668 32.862 31.557 120 HH2 TRP 19 HH2 TRP 19 46.394 31.088 30.051 121 H GLN 20 H GLN 20 49.757 39.312 31.460 122 HA GLN 20 HA GLN 20 49.788 40.235 34.205 123 HB2 GLN 20 HB2 GLN 20 50.208 42.464 33.322 124 HB3 GLN 20 HB3 GLN 20 51.250 41.241 32.623 125 HG2 GLN 20 HG2 GLN 20 49.792 41.178 30.601 126 HG3 GLN 20 HG3 GLN 20 48.864 42.495 31.251 127 HE21 GLN 20 HE21 GLN 20 49.517 43.550 29.197 128 HE22 GLN 20 HE22 GLN 20 51.106 44.342 29.165 129 H ALA 21 H ALA 21 47.219 40.339 31.686 130 HA ALA 21 HA ALA 21 45.393 41.897 33.286 131 HB1 ALA 21 HB1 ALA 21 44.940 39.963 30.987 132 HB2 ALA 21 HB2 ALA 21 43.728 41.078 31.654 133 HB3 ALA 21 HB3 ALA 21 45.190 41.716 30.877 134 H LEU 22 H LEU 22 45.999 38.377 33.163 135 HA LEU 22 HA LEU 22 43.764 37.805 34.951 136 HB2 LEU 22 HB2 LEU 22 44.816 36.422 33.014 137 HB3 LEU 22 HB3 LEU 22 45.928 35.825 34.224 138 HG LEU 22 HG LEU 22 42.875 35.702 34.448 139 HD11 LEU 22 HD11 LEU 22 44.780 33.535 33.490 140 HD12 LEU 22 HD12 LEU 22 43.731 34.509 32.427 141 HD13 LEU 22 HD13 LEU 22 43.003 33.431 33.616 142 HD21 LEU 22 HD21 LEU 22 45.070 34.160 35.908 143 HD22 LEU 22 HD22 LEU 22 43.346 33.764 35.964 144 HD23 LEU 22 HD23 LEU 22 43.899 35.299 36.620 145 H PHE 23 H PHE 23 47.330 37.970 35.376 146 HA PHE 23 HA PHE 23 47.131 36.949 38.102 147 HB2 PHE 23 HB2 PHE 23 49.532 37.987 36.580 148 HB3 PHE 23 HB3 PHE 23 49.571 37.070 38.070 149 HD1 PHE 23 HD1 PHE 23 47.078 35.361 36.254 150 HD2 PHE 23 HD2 PHE 23 51.327 36.071 36.299 151 HE1 PHE 23 HE1 PHE 23 47.425 33.348 34.902 152 HE2 PHE 23 HE2 PHE 23 51.676 33.972 35.016 153 HZ PHE 23 HZ PHE 23 49.710 32.620 34.300 154 H ALA 24 H ALA 24 46.444 39.956 37.095 155 HA ALA 24 HA ALA 24 46.478 42.051 37.860 156 HB1 ALA 24 HB1 ALA 24 46.783 40.763 40.587 157 HB2 ALA 24 HB2 ALA 24 46.163 42.391 40.246 158 HB3 ALA 24 HB3 ALA 24 45.265 40.968 39.695 159 H LEU 25 H LEU 25 49.176 40.848 37.193 160 HA LEU 25 HA LEU 25 51.154 42.184 38.821 161 HB2 LEU 25 HB2 LEU 25 51.175 40.959 36.036 162 HB3 LEU 25 HB3 LEU 25 52.621 41.642 36.767 163 HG LEU 25 HG LEU 25 51.032 39.413 38.107 164 HD11 LEU 25 HD11 LEU 25 53.451 39.264 36.279 165 HD12 LEU 25 HD12 LEU 25 51.824 38.653 35.909 166 HD13 LEU 25 HD13 LEU 25 52.763 37.918 37.226 167 HD21 LEU 25 HD21 LEU 25 53.174 39.047 39.296 168 HD22 LEU 25 HD22 LEU 25 52.575 40.689 39.592 169 HD23 LEU 25 HD23 LEU 25 53.902 40.418 38.443 170 HA PRO 26 HA PRO 26 51.083 46.234 36.853 171 HB2 PRO 26 HB2 PRO 26 54.069 46.234 37.187 172 HB3 PRO 26 HB3 PRO 26 52.894 47.473 37.674 173 HG2 PRO 26 HG2 PRO 26 53.983 45.835 39.536 174 HG3 PRO 26 HG3 PRO 26 52.228 46.213 39.594 175 HD2 PRO 26 HD2 PRO 26 53.578 43.749 38.441 176 HD3 PRO 26 HD3 PRO 26 52.172 43.863 39.543 177 H ALA 27 H ALA 27 53.630 43.922 35.854 178 HA ALA 27 HA ALA 27 52.837 44.147 33.072 179 HB1 ALA 27 HB1 ALA 27 55.666 44.913 33.920 180 HB2 ALA 27 HB2 ALA 27 55.092 44.737 32.247 181 HB3 ALA 27 HB3 ALA 27 54.430 46.018 33.276 182 H VAL 28 H VAL 28 53.655 42.491 31.764 183 HA VAL 28 HA VAL 28 55.496 40.427 32.908 184 HB VAL 28 HB VAL 28 52.958 39.974 31.282 185 HG11 VAL 28 HG11 VAL 28 55.166 37.990 31.972 186 HG12 VAL 28 HG12 VAL 28 53.561 37.554 31.332 187 HG13 VAL 28 HG13 VAL 28 54.679 38.501 30.348 188 HG21 VAL 28 HG21 VAL 28 53.877 38.834 33.947 189 HG22 VAL 28 HG22 VAL 28 52.688 40.114 33.779 190 HG23 VAL 28 HG23 VAL 28 52.324 38.504 33.136 191 H GLY 29 H GLY 29 57.213 40.059 31.649 192 HA2 GLY 29 HA2 GLY 29 57.519 39.496 29.107 193 HA3 GLY 29 HA3 GLY 29 57.383 41.247 28.926 194 H ARG 30 H ARG 30 58.930 41.912 31.358 195 HA ARG 30 HA ARG 30 61.584 41.517 30.084 196 HB2 ARG 30 HB2 ARG 30 60.484 43.801 30.552 197 HB3 ARG 30 HB3 ARG 30 60.963 43.547 32.238 198 HG2 ARG 30 HG2 ARG 30 63.346 43.256 31.464 199 HG3 ARG 30 HG3 ARG 30 62.804 43.541 29.801 200 HD2 ARG 30 HD2 ARG 30 61.937 45.793 30.535 201 HD3 ARG 30 HD3 ARG 30 62.672 45.531 32.116 202 HE ARG 30 HE ARG 30 64.005 46.125 29.555 203 HH11 ARG 30 HH11 ARG 30 64.711 44.945 32.830 204 HH12 ARG 30 HH12 ARG 30 66.393 45.429 32.635 205 HH21 ARG 30 HH21 ARG 30 66.111 46.893 29.673 206 HH22 ARG 30 HH22 ARG 30 67.131 46.274 30.960 207 H HIS 31 H HIS 31 60.233 41.142 33.433 208 HA HIS 31 HA HIS 31 62.695 39.698 34.207 209 HB2 HIS 31 HB2 HIS 31 62.714 41.956 35.177 210 HB3 HIS 31 HB3 HIS 31 61.058 41.765 35.734 211 HD1 HIS 31 HD1 HIS 31 64.523 40.072 36.472 212 HD2 HIS 31 HD2 HIS 31 60.790 41.024 38.195 213 HE1 HIS 31 HE1 HIS 31 64.688 39.449 38.925 214 H GLN 32 H GLN 32 62.282 38.221 35.837 215 HA GLN 32 HA GLN 32 61.315 36.471 36.854 216 HB2 GLN 32 HB2 GLN 32 59.842 38.438 37.665 217 HB3 GLN 32 HB3 GLN 32 58.593 37.771 36.636 218 HG2 GLN 32 HG2 GLN 32 58.526 35.690 37.835 219 HG3 GLN 32 HG3 GLN 32 60.018 36.059 38.708 220 HE21 GLN 32 HE21 GLN 32 59.955 37.592 40.487 221 HE22 GLN 32 HE22 GLN 32 58.385 37.911 41.245 222 H ASP 33 H ASP 33 60.157 34.519 36.567 223 HA ASP 33 HA ASP 33 59.248 33.975 33.776 224 HB2 ASP 33 HB2 ASP 33 60.772 31.978 35.423 225 HB3 ASP 33 HB3 ASP 33 60.525 32.038 33.678 226 H PHE 34 H PHE 34 57.906 31.983 33.605 227 HA PHE 34 HA PHE 34 55.628 32.519 35.056 228 HB2 PHE 34 HB2 PHE 34 55.878 31.548 32.780 229 HB3 PHE 34 HB3 PHE 34 56.161 29.985 33.516 230 HD1 PHE 34 HD1 PHE 34 53.722 32.515 32.557 231 HD2 PHE 34 HD2 PHE 34 54.232 28.908 34.869 232 HE1 PHE 34 HE1 PHE 34 51.263 32.197 32.629 233 HE2 PHE 34 HE2 PHE 34 51.781 28.601 34.928 234 HZ PHE 34 HZ PHE 34 50.289 30.245 33.817 235 H PHE 35 H PHE 35 58.060 30.150 35.998 236 HA PHE 35 HA PHE 35 56.382 28.678 37.843 237 HB2 PHE 35 HB2 PHE 35 58.403 27.751 36.819 238 HB3 PHE 35 HB3 PHE 35 59.399 28.945 37.627 239 HD1 PHE 35 HD1 PHE 35 57.013 26.127 38.261 240 HD2 PHE 35 HD2 PHE 35 60.255 28.499 39.821 241 HE1 PHE 35 HE1 PHE 35 57.190 24.595 40.214 242 HE2 PHE 35 HE2 PHE 35 60.413 26.985 41.788 243 HZ PHE 35 HZ PHE 35 58.882 25.034 41.987 244 H ALA 36 H ALA 36 57.875 31.807 38.098 245 HA ALA 36 HA ALA 36 57.144 31.966 41.008 246 HB1 ALA 36 HB1 ALA 36 58.870 33.700 39.206 247 HB2 ALA 36 HB2 ALA 36 58.541 34.022 40.917 248 HB3 ALA 36 HB3 ALA 36 59.458 32.572 40.448 249 H LEU 37 H LEU 37 56.512 33.292 37.811 250 HA LEU 37 HA LEU 37 55.199 35.660 38.512 251 HB2 LEU 37 HB2 LEU 37 56.162 34.629 36.259 252 HB3 LEU 37 HB3 LEU 37 54.549 33.928 36.105 253 HG LEU 37 HG LEU 37 53.634 36.272 36.082 254 HD11 LEU 37 HD11 LEU 37 55.316 38.074 35.513 255 HD12 LEU 37 HD12 LEU 37 56.615 36.929 35.846 256 HD13 LEU 37 HD13 LEU 37 55.538 37.462 37.157 257 HD21 LEU 37 HD21 LEU 37 54.037 34.916 34.054 258 HD22 LEU 37 HD22 LEU 37 55.705 35.542 33.979 259 HD23 LEU 37 HD23 LEU 37 54.323 36.631 33.758 260 H GLY 38 H GLY 38 53.895 32.445 38.528 261 HA2 GLY 38 HA2 GLY 38 51.099 33.146 38.097 262 HA3 GLY 38 HA3 GLY 38 51.728 31.591 38.649 263 H GLY 39 H GLY 39 53.112 32.790 41.010 264 HA2 GLY 39 HA2 GLY 39 52.783 33.657 43.086 265 HA3 GLY 39 HA3 GLY 39 51.225 34.287 42.599 266 H ASP 40 H ASP 40 49.903 31.824 41.905 267 HA ASP 40 HA ASP 40 49.905 30.133 44.343 268 HB2 ASP 40 HB2 ASP 40 48.362 32.256 44.522 269 HB3 ASP 40 HB3 ASP 40 47.311 31.396 43.411 270 H SER 41 H SER 41 48.863 28.059 44.031 271 HA SER 41 HA SER 41 48.564 27.128 41.267 272 HB2 SER 41 HB2 SER 41 48.047 24.993 42.213 273 HB3 SER 41 HB3 SER 41 49.400 25.681 43.132 274 HG SER 41 HG SER 41 48.119 25.139 44.723 275 H GLN 42 H GLN 42 46.313 28.334 43.728 276 HA GLN 42 HA GLN 42 43.877 27.531 42.353 277 HB2 GLN 42 HB2 GLN 42 44.551 29.810 44.220 278 HB3 GLN 42 HB3 GLN 42 42.892 29.407 43.720 279 HG2 GLN 42 HG2 GLN 42 43.079 27.256 44.888 280 HG3 GLN 42 HG3 GLN 42 44.794 27.582 45.217 281 HE21 GLN 42 HE21 GLN 42 45.329 29.535 46.496 282 HE22 GLN 42 HE22 GLN 42 44.206 30.007 47.775 283 H LEU 43 H LEU 43 45.944 30.456 42.218 284 HA LEU 43 HA LEU 43 44.461 31.794 40.147 285 HB2 LEU 43 HB2 LEU 43 46.040 32.901 41.645 286 HB3 LEU 43 HB3 LEU 43 47.376 31.953 41.027 287 HG LEU 43 HG LEU 43 47.321 34.280 40.264 288 HD11 LEU 43 HD11 LEU 43 46.966 32.732 37.720 289 HD12 LEU 43 HD12 LEU 43 48.235 32.232 38.856 290 HD13 LEU 43 HD13 LEU 43 48.226 33.873 38.232 291 HD21 LEU 43 HD21 LEU 43 45.763 35.083 38.603 292 HD22 LEU 43 HD22 LEU 43 44.880 34.570 40.052 293 HD23 LEU 43 HD23 LEU 43 44.900 33.535 38.602 294 H GLY 44 H GLY 44 47.153 29.422 40.067 295 HA2 GLY 44 HA2 GLY 44 47.453 29.195 37.252 296 HA3 GLY 44 HA3 GLY 44 47.806 27.955 38.449 297 H LEU 45 H LEU 45 45.200 27.418 39.421 298 HA LEU 45 HA LEU 45 44.009 25.762 37.392 299 HB2 LEU 45 HB2 LEU 45 43.204 26.659 40.178 300 HB3 LEU 45 HB3 LEU 45 42.160 25.615 39.231 301 HG LEU 45 HG LEU 45 45.053 24.837 39.767 302 HD11 LEU 45 HD11 LEU 45 42.585 24.288 41.468 303 HD12 LEU 45 HD12 LEU 45 44.024 25.214 41.946 304 HD13 LEU 45 HD13 LEU 45 44.159 23.476 41.654 305 HD21 LEU 45 HD21 LEU 45 44.193 22.577 39.403 306 HD22 LEU 45 HD22 LEU 45 43.832 23.586 37.999 307 HD23 LEU 45 HD23 LEU 45 42.546 23.205 39.164 308 H ARG 46 H ARG 46 42.916 28.863 38.817 309 HA ARG 46 HA ARG 46 40.657 29.412 37.156 310 HB2 ARG 46 HB2 ARG 46 41.284 30.746 39.112 311 HB3 ARG 46 HB3 ARG 46 42.814 31.182 38.380 312 HG2 ARG 46 HG2 ARG 46 41.462 32.390 36.543 313 HG3 ARG 46 HG3 ARG 46 40.054 32.168 37.585 314 HD2 ARG 46 HD2 ARG 46 42.669 33.513 38.403 315 HD3 ARG 46 HD3 ARG 46 41.258 34.392 37.865 316 HE ARG 46 HE ARG 46 41.692 33.127 40.470 317 HH11 ARG 46 HH11 ARG 46 39.100 34.439 38.413 318 HH12 ARG 46 HH12 ARG 46 38.008 34.413 39.788 319 HH21 ARG 46 HH21 ARG 46 40.322 33.382 42.062 320 HH22 ARG 46 HH22 ARG 46 38.783 34.207 41.809 321 H MET 47 H MET 47 44.087 30.233 36.650 322 HA MET 47 HA MET 47 43.883 31.385 34.091 323 HB2 MET 47 HB2 MET 47 45.837 31.775 35.276 324 HB3 MET 47 HB3 MET 47 46.093 30.088 35.683 325 HG2 MET 47 HG2 MET 47 46.243 30.836 32.802 326 HG3 MET 47 HG3 MET 47 47.575 31.302 33.855 327 HE1 MET 47 HE1 MET 47 46.360 28.837 31.481 328 HE2 MET 47 HE2 MET 47 48.041 29.410 31.326 329 HE3 MET 47 HE3 MET 47 47.708 27.686 31.579 330 H LEU 48 H LEU 48 44.603 27.924 34.853 331 HA LEU 48 HA LEU 48 44.758 27.196 32.104 332 HB2 LEU 48 HB2 LEU 48 45.500 25.926 34.311 333 HB3 LEU 48 HB3 LEU 48 43.895 25.237 34.245 334 HG LEU 48 HG LEU 48 45.381 23.695 33.232 335 HD11 LEU 48 HD11 LEU 48 44.678 23.456 30.919 336 HD12 LEU 48 HD12 LEU 48 44.168 25.128 30.833 337 HD13 LEU 48 HD13 LEU 48 43.289 23.984 31.885 338 HD21 LEU 48 HD21 LEU 48 46.976 24.159 31.540 339 HD22 LEU 48 HD22 LEU 48 47.216 25.377 32.798 340 HD23 LEU 48 HD23 LEU 48 46.370 25.814 31.295 341 H ALA 49 H ALA 49 41.999 26.814 34.427 342 HA ALA 49 HA ALA 49 40.280 25.642 32.529 343 HB1 ALA 49 HB1 ALA 49 39.874 25.575 34.936 344 HB2 ALA 49 HB2 ALA 49 39.629 27.339 34.989 345 HB3 ALA 49 HB3 ALA 49 38.474 26.296 34.127 346 H GLN 50 H GLN 50 40.642 29.168 33.315 347 HA GLN 50 HA GLN 50 38.586 29.919 31.409 348 HB2 GLN 50 HB2 GLN 50 40.728 31.562 32.814 349 HB3 GLN 50 HB3 GLN 50 39.468 32.230 31.761 350 HG2 GLN 50 HG2 GLN 50 37.719 31.191 33.189 351 HG3 GLN 50 HG3 GLN 50 38.953 30.618 34.303 352 HE21 GLN 50 HE21 GLN 50 36.791 32.208 35.081 353 HE22 GLN 50 HE22 GLN 50 37.397 33.771 35.611 354 H LEU 51 H LEU 51 42.208 29.760 31.106 355 HA LEU 51 HA LEU 51 42.298 30.737 28.408 356 HB2 LEU 51 HB2 LEU 51 44.280 30.447 29.794 357 HB3 LEU 51 HB3 LEU 51 44.003 28.700 29.895 358 HG LEU 51 HG LEU 51 44.266 28.690 27.324 359 HD11 LEU 51 HD11 LEU 51 45.561 31.379 27.915 360 HD12 LEU 51 HD12 LEU 51 44.122 31.097 26.916 361 HD13 LEU 51 HD13 LEU 51 45.698 30.466 26.403 362 HD21 LEU 51 HD21 LEU 51 46.693 28.524 27.446 363 HD22 LEU 51 HD22 LEU 51 45.921 27.717 28.813 364 HD23 LEU 51 HD23 LEU 51 46.703 29.291 29.033 365 H ARG 52 H ARG 52 41.838 27.390 29.664 366 HA ARG 52 HA ARG 52 41.819 26.321 26.997 367 HB2 ARG 52 HB2 ARG 52 42.602 25.250 29.172 368 HB3 ARG 52 HB3 ARG 52 40.906 24.871 29.490 369 HG2 ARG 52 HG2 ARG 52 40.758 23.527 27.477 370 HG3 ARG 52 HG3 ARG 52 42.268 24.173 26.845 371 HD2 ARG 52 HD2 ARG 52 42.662 21.933 27.675 372 HD3 ARG 52 HD3 ARG 52 43.527 23.098 28.693 373 HE ARG 52 HE ARG 52 41.099 22.822 29.982 374 HH11 ARG 52 HH11 ARG 52 43.635 20.519 29.324 375 HH12 ARG 52 HH12 ARG 52 42.899 19.319 30.342 376 HH21 ARG 52 HH21 ARG 52 40.386 21.467 31.321 377 HH22 ARG 52 HH22 ARG 52 40.990 19.828 31.438 378 H GLU 53 H GLU 53 39.192 27.112 29.243 379 HA GLU 53 HA GLU 53 37.129 26.115 27.476 380 HB2 GLU 53 HB2 GLU 53 37.130 28.123 29.770 381 HB3 GLU 53 HB3 GLU 53 35.694 27.764 28.833 382 HG2 GLU 53 HG2 GLU 53 35.890 25.354 29.377 383 HG3 GLU 53 HG3 GLU 53 37.318 25.686 30.356 384 H ARG 54 H ARG 54 38.665 29.367 27.807 385 HA ARG 54 HA ARG 54 36.798 30.506 25.839 386 HB2 ARG 54 HB2 ARG 54 39.226 31.711 27.212 387 HB3 ARG 54 HB3 ARG 54 37.996 32.600 26.305 388 HG2 ARG 54 HG2 ARG 54 36.230 31.983 27.864 389 HG3 ARG 54 HG3 ARG 54 37.309 30.943 28.787 390 HD2 ARG 54 HD2 ARG 54 38.748 32.939 29.289 391 HD3 ARG 54 HD3 ARG 54 37.510 33.949 28.509 392 HE ARG 54 HE ARG 54 36.338 32.241 30.535 393 HH11 ARG 54 HH11 ARG 54 38.316 35.138 30.301 394 HH12 ARG 54 HH12 ARG 54 37.759 35.759 31.832 395 HH21 ARG 54 HH21 ARG 54 35.488 33.189 32.344 396 HH22 ARG 54 HH22 ARG 54 36.155 34.696 32.929 397 H HIS 55 H HIS 55 40.293 29.851 25.872 398 HA HIS 55 HA HIS 55 40.491 30.721 23.045 399 HB2 HIS 55 HB2 HIS 55 41.883 31.690 24.965 400 HB3 HIS 55 HB3 HIS 55 42.675 30.152 25.076 401 HD1 HIS 55 HD1 HIS 55 41.944 31.530 21.561 402 HD2 HIS 55 HD2 HIS 55 45.055 31.330 24.385 403 HE1 HIS 55 HE1 HIS 55 44.018 32.378 20.390 404 H GLY 56 H GLY 56 40.373 27.771 24.854 405 HA2 GLY 56 HA2 GLY 56 40.441 25.573 24.119 406 HA3 GLY 56 HA3 GLY 56 40.795 26.120 22.490 407 H VAL 57 H VAL 57 42.734 26.878 25.381 408 HA VAL 57 HA VAL 57 45.072 25.419 24.199 409 HB VAL 57 HB VAL 57 45.001 28.239 25.334 410 HG11 VAL 57 HG11 VAL 57 47.320 28.429 24.642 411 HG12 VAL 57 HG12 VAL 57 47.179 27.068 25.760 412 HG13 VAL 57 HG13 VAL 57 47.303 26.772 24.016 413 HG21 VAL 57 HG21 VAL 57 44.053 28.241 23.089 414 HG22 VAL 57 HG22 VAL 57 45.663 28.954 23.059 415 HG23 VAL 57 HG23 VAL 57 45.425 27.301 22.479 416 H ASP 58 H ASP 58 46.374 24.365 25.587 417 HA ASP 58 HA ASP 58 45.889 24.543 28.539 418 HB2 ASP 58 HB2 ASP 58 45.472 22.383 27.138 419 HB3 ASP 58 HB3 ASP 58 47.215 22.221 27.126 420 H LEU 59 H LEU 59 47.909 24.087 29.831 421 HA LEU 59 HA LEU 59 50.360 25.267 28.598 422 HB2 LEU 59 HB2 LEU 59 49.104 26.905 29.945 423 HB3 LEU 59 HB3 LEU 59 49.373 25.921 31.384 424 HG LEU 59 HG LEU 59 51.603 27.052 29.626 425 HD11 LEU 59 HD11 LEU 59 50.270 28.881 30.558 426 HD12 LEU 59 HD12 LEU 59 51.841 28.802 31.361 427 HD13 LEU 59 HD13 LEU 59 50.402 28.170 32.185 428 HD21 LEU 59 HD21 LEU 59 52.488 25.261 31.023 429 HD22 LEU 59 HD22 LEU 59 51.645 25.908 32.454 430 HD23 LEU 59 HD23 LEU 59 52.989 26.795 31.716 431 HA PRO 60 HA PRO 60 51.295 21.179 30.255 432 HB2 PRO 60 HB2 PRO 60 53.552 21.263 28.292 433 HB3 PRO 60 HB3 PRO 60 52.329 19.984 28.581 434 HG2 PRO 60 HG2 PRO 60 52.117 21.596 26.417 435 HG3 PRO 60 HG3 PRO 60 50.659 21.178 27.396 436 HD2 PRO 60 HD2 PRO 60 52.372 23.662 27.598 437 HD3 PRO 60 HD3 PRO 60 50.596 23.522 27.390 438 H LEU 61 H LEU 61 52.653 20.475 31.853 439 HA LEU 61 HA LEU 61 54.494 22.297 33.098 440 HB2 LEU 61 HB2 LEU 61 53.853 19.347 33.477 441 HB3 LEU 61 HB3 LEU 61 55.103 20.144 34.398 442 HG LEU 61 HG LEU 61 53.157 20.019 35.735 443 HD11 LEU 61 HD11 LEU 61 52.897 22.261 36.466 444 HD12 LEU 61 HD12 LEU 61 53.350 22.924 34.886 445 HD13 LEU 61 HD13 LEU 61 54.562 22.088 35.897 446 HD21 LEU 61 HD21 LEU 61 51.410 19.920 33.997 447 HD22 LEU 61 HD22 LEU 61 51.620 21.666 33.690 448 HD23 LEU 61 HD23 LEU 61 51.046 21.100 35.263 449 H ARG 62 H ARG 62 54.984 19.914 30.603 450 HA ARG 62 HA ARG 62 57.909 19.871 30.700 451 HB2 ARG 62 HB2 ARG 62 55.781 19.079 28.699 452 HB3 ARG 62 HB3 ARG 62 57.473 19.159 28.195 453 HG2 ARG 62 HG2 ARG 62 58.180 17.555 29.755 454 HG3 ARG 62 HG3 ARG 62 56.665 17.618 30.681 455 HD2 ARG 62 HD2 ARG 62 56.737 15.585 29.384 456 HD3 ARG 62 HD3 ARG 62 55.468 16.661 28.775 457 HE ARG 62 HE ARG 62 58.108 16.757 27.407 458 HH11 ARG 62 HH11 ARG 62 55.004 15.179 27.381 459 HH12 ARG 62 HH12 ARG 62 55.035 14.934 25.648 460 HH21 ARG 62 HH21 ARG 62 58.042 16.616 25.231 461 HH22 ARG 62 HH22 ARG 62 56.723 15.764 24.445 462 H CYS 63 H CYS 63 55.555 21.821 28.844 463 HA CYS 63 HA CYS 63 57.491 23.477 27.513 464 HB2 CYS 63 HB2 CYS 63 54.600 24.004 28.315 465 HB3 CYS 63 HB3 CYS 63 55.580 25.059 27.308 466 HG CYS 63 HG CYS 63 54.143 23.847 25.615 467 H LEU 64 H LEU 64 55.776 23.851 30.660 468 HA LEU 64 HA LEU 64 57.029 26.253 31.451 469 HB2 LEU 64 HB2 LEU 64 55.041 25.082 32.441 470 HB3 LEU 64 HB3 LEU 64 56.106 23.910 33.177 471 HG LEU 64 HG LEU 64 57.110 25.493 34.653 472 HD11 LEU 64 HD11 LEU 64 57.296 27.491 33.295 473 HD12 LEU 64 HD12 LEU 64 56.398 27.869 34.757 474 HD13 LEU 64 HD13 LEU 64 55.525 27.650 33.215 475 HD21 LEU 64 HD21 LEU 64 54.109 26.017 34.559 476 HD22 LEU 64 HD22 LEU 64 55.184 26.248 35.960 477 HD23 LEU 64 HD23 LEU 64 54.909 24.625 35.325 478 H TYR 65 H TYR 65 58.158 22.899 31.927 479 HA TYR 65 HA TYR 65 60.503 23.582 33.443 480 HB2 TYR 65 HB2 TYR 65 59.686 21.380 33.568 481 HB3 TYR 65 HB3 TYR 65 59.676 21.174 31.819 482 HD1 TYR 65 HD1 TYR 65 61.841 21.295 34.840 483 HD2 TYR 65 HD2 TYR 65 61.676 20.680 30.569 484 HE1 TYR 65 HE1 TYR 65 64.171 20.389 34.864 485 HE2 TYR 65 HE2 TYR 65 63.995 19.827 30.596 486 HH TYR 65 HH TYR 65 65.738 19.225 31.855 487 H GLU 66 H GLU 66 60.033 23.193 29.888 488 HA GLU 66 HA GLU 66 62.945 23.645 29.485 489 HB2 GLU 66 HB2 GLU 66 62.654 23.178 27.213 490 HB3 GLU 66 HB3 GLU 66 61.701 22.011 28.119 491 HG2 GLU 66 HG2 GLU 66 59.639 23.316 27.577 492 HG3 GLU 66 HG3 GLU 66 60.612 24.470 26.667 493 H ALA 67 H ALA 67 60.058 25.550 29.380 494 HA ALA 67 HA ALA 67 61.555 27.975 28.646 495 HB1 ALA 67 HB1 ALA 67 60.766 27.012 26.535 496 HB2 ALA 67 HB2 ALA 67 59.120 26.852 27.196 497 HB3 ALA 67 HB3 ALA 67 59.824 28.456 26.941 498 HA PRO 68 HA PRO 68 58.396 28.828 31.962 499 HB2 PRO 68 HB2 PRO 68 59.975 29.890 33.873 500 HB3 PRO 68 HB3 PRO 68 59.930 28.127 33.628 501 HG2 PRO 68 HG2 PRO 68 61.926 30.111 32.383 502 HG3 PRO 68 HG3 PRO 68 62.311 28.664 33.394 503 HD2 PRO 68 HD2 PRO 68 62.282 28.429 30.708 504 HD3 PRO 68 HD3 PRO 68 61.543 27.154 31.712 505 H THR 69 H THR 69 60.917 30.679 30.277 506 HA THR 69 HA THR 69 59.989 33.250 31.276 507 HB THR 69 HB THR 69 61.895 32.789 28.959 508 HG1 THR 69 HG1 THR 69 62.511 32.962 31.743 509 HG21 THR 69 HG21 THR 69 62.901 34.851 29.888 510 HG22 THR 69 HG22 THR 69 61.632 34.886 31.137 511 HG23 THR 69 HG23 THR 69 61.204 35.111 29.425 512 H VAL 70 H VAL 70 58.424 34.496 30.384 513 HA VAL 70 HA VAL 70 56.494 32.920 29.266 514 HB VAL 70 HB VAL 70 56.370 35.952 29.304 515 HG11 VAL 70 HG11 VAL 70 54.447 34.925 28.129 516 HG12 VAL 70 HG12 VAL 70 54.199 33.809 29.487 517 HG13 VAL 70 HG13 VAL 70 53.951 35.563 29.692 518 HG21 VAL 70 HG21 VAL 70 57.043 35.204 31.523 519 HG22 VAL 70 HG22 VAL 70 55.329 35.590 31.562 520 HG23 VAL 70 HG23 VAL 70 55.839 33.889 31.493 521 H ALA 71 H ALA 71 58.452 35.226 27.381 522 HA ALA 71 HA ALA 71 57.027 35.028 24.935 523 HB1 ALA 71 HB1 ALA 71 59.062 35.872 23.944 524 HB2 ALA 71 HB2 ALA 71 58.912 36.606 25.552 525 HB3 ALA 71 HB3 ALA 71 60.046 35.274 25.296 526 H ARG 72 H ARG 72 59.652 32.947 26.188 527 HA ARG 72 HA ARG 72 59.661 31.110 23.885 528 HB2 ARG 72 HB2 ARG 72 60.968 31.051 26.637 529 HB3 ARG 72 HB3 ARG 72 61.059 29.713 25.498 530 HG2 ARG 72 HG2 ARG 72 63.069 30.994 25.409 531 HG3 ARG 72 HG3 ARG 72 62.230 31.054 23.858 532 HD2 ARG 72 HD2 ARG 72 61.581 33.351 24.197 533 HD3 ARG 72 HD3 ARG 72 61.980 33.269 25.920 534 HE ARG 72 HE ARG 72 64.162 33.695 25.492 535 HH11 ARG 72 HH11 ARG 72 62.792 32.849 22.331 536 HH12 ARG 72 HH12 ARG 72 64.335 33.081 21.539 537 HH21 ARG 72 HH21 ARG 72 66.054 33.889 24.416 538 HH22 ARG 72 HH22 ARG 72 66.126 33.553 22.708 539 H LEU 73 H LEU 73 58.236 31.159 27.168 540 HA LEU 73 HA LEU 73 57.050 28.606 27.129 541 HB2 LEU 73 HB2 LEU 73 57.062 30.290 29.037 542 HB3 LEU 73 HB3 LEU 73 55.740 31.121 28.258 543 HG LEU 73 HG LEU 73 55.320 28.182 28.588 544 HD11 LEU 73 HD11 LEU 73 56.364 28.643 30.743 545 HD12 LEU 73 HD12 LEU 73 54.628 28.408 30.953 546 HD13 LEU 73 HD13 LEU 73 55.309 30.054 30.981 547 HD21 LEU 73 HD21 LEU 73 53.583 30.592 29.277 548 HD22 LEU 73 HD22 LEU 73 53.067 28.897 29.174 549 HD23 LEU 73 HD23 LEU 73 53.565 29.750 27.714 550 H ALA 74 H ALA 74 55.540 31.700 26.026 551 HA ALA 74 HA ALA 74 53.237 30.564 24.835 552 HB1 ALA 74 HB1 ALA 74 54.836 33.022 24.063 553 HB2 ALA 74 HB2 ALA 74 53.141 32.719 23.622 554 HB3 ALA 74 HB3 ALA 74 53.593 32.978 25.329 555 H GLU 75 H GLU 75 56.517 31.102 23.403 556 HA GLU 75 HA GLU 75 55.836 30.219 20.780 557 HB2 GLU 75 HB2 GLU 75 57.985 31.313 21.583 558 HB3 GLU 75 HB3 GLU 75 58.508 29.726 22.162 559 HG2 GLU 75 HG2 GLU 75 58.362 28.834 19.883 560 HG3 GLU 75 HG3 GLU 75 57.650 30.359 19.328 561 H THR 76 H THR 76 56.908 28.234 23.608 562 HA THR 76 HA THR 76 56.597 25.751 22.183 563 HB THR 76 HB THR 76 56.694 24.628 24.364 564 HG1 THR 76 HG1 THR 76 56.322 27.218 25.316 565 HG21 THR 76 HG21 THR 76 58.932 25.355 25.020 566 HG22 THR 76 HG22 THR 76 58.758 26.849 24.076 567 HG23 THR 76 HG23 THR 76 58.794 25.276 23.255 568 H ILE 77 H ILE 77 54.197 27.646 24.035 569 HA ILE 77 HA ILE 77 52.195 25.537 23.919 570 HB ILE 77 HB ILE 77 51.579 28.496 24.160 571 HG12 ILE 77 HG12 ILE 77 53.027 28.190 25.999 572 HG13 ILE 77 HG13 ILE 77 51.423 28.100 26.640 573 HG21 ILE 77 HG21 ILE 77 49.590 27.563 25.427 574 HG22 ILE 77 HG22 ILE 77 49.617 27.142 23.717 575 HG23 ILE 77 HG23 ILE 77 50.082 25.941 24.933 576 HD11 ILE 77 HD11 ILE 77 53.269 25.727 26.120 577 HD12 ILE 77 HD12 ILE 77 52.833 26.416 27.688 578 HD13 ILE 77 HD13 ILE 77 51.592 25.615 26.702 579 H VAL 78 H VAL 78 53.104 28.162 21.673 580 HA VAL 78 HA VAL 78 51.010 27.552 19.738 581 HB VAL 78 HB VAL 78 53.690 28.964 19.500 582 HG11 VAL 78 HG11 VAL 78 53.236 28.069 17.290 583 HG12 VAL 78 HG12 VAL 78 51.546 28.589 17.369 584 HG13 VAL 78 HG13 VAL 78 52.857 29.790 17.289 585 HG21 VAL 78 HG21 VAL 78 52.297 30.957 19.294 586 HG22 VAL 78 HG22 VAL 78 50.814 29.980 19.429 587 HG23 VAL 78 HG23 VAL 78 51.935 30.119 20.802 588 H ARG 79 H ARG 79 54.465 26.646 19.953 589 HA ARG 79 HA ARG 79 54.308 25.179 17.513 590 HB2 ARG 79 HB2 ARG 79 56.239 26.544 18.398 591 HB3 ARG 79 HB3 ARG 79 56.553 25.281 19.576 592 HG2 ARG 79 HG2 ARG 79 58.049 25.162 17.643 593 HG3 ARG 79 HG3 ARG 79 57.091 23.694 17.820 594 HD2 ARG 79 HD2 ARG 79 57.328 24.427 15.448 595 HD3 ARG 79 HD3 ARG 79 55.652 24.329 15.965 596 HE ARG 79 HE ARG 79 57.239 26.884 15.799 597 HH11 ARG 79 HH11 ARG 79 54.163 25.304 15.072 598 HH12 ARG 79 HH12 ARG 79 53.323 26.823 14.977 599 HH21 ARG 79 HH21 ARG 79 56.113 28.760 15.491 600 HH22 ARG 79 HH22 ARG 79 54.444 28.669 14.930 601 H LEU 80 H LEU 80 54.317 24.033 20.852 602 HA LEU 80 HA LEU 80 54.121 21.224 19.828 603 HB2 LEU 80 HB2 LEU 80 54.799 22.155 22.641 604 HB3 LEU 80 HB3 LEU 80 54.651 20.502 22.074 605 HG LEU 80 HG LEU 80 56.480 21.460 20.247 606 HD11 LEU 80 HD11 LEU 80 57.112 22.806 22.912 607 HD12 LEU 80 HD12 LEU 80 56.680 23.642 21.400 608 HD13 LEU 80 HD13 LEU 80 58.183 22.722 21.500 609 HD21 LEU 80 HD21 LEU 80 57.108 20.300 22.990 610 HD22 LEU 80 HD22 LEU 80 58.181 20.322 21.566 611 HD23 LEU 80 HD23 LEU 80 56.677 19.379 21.524 612 H ALA 81 H ALA 81 52.524 23.531 22.022 613 HA ALA 81 HA ALA 81 50.468 23.721 22.870 614 HB1 ALA 81 HB1 ALA 81 49.604 22.043 20.498 615 HB2 ALA 81 HB2 ALA 81 48.578 23.103 21.471 616 HB3 ALA 81 HB3 ALA 81 49.885 23.799 20.490 617 H ALA 82 H ALA 82 50.876 20.288 22.090 618 HA ALA 82 HA ALA 82 50.430 18.380 23.075 619 HB1 ALA 82 HB1 ALA 82 51.769 19.416 24.891 620 HB2 ALA 82 HB2 ALA 82 50.240 19.874 25.680 621 HB3 ALA 82 HB3 ALA 82 50.660 18.169 25.461 622 HA PRO 83 HA PRO 83 46.201 17.747 22.879 623 HB2 PRO 83 HB2 PRO 83 45.845 15.154 23.581 624 HB3 PRO 83 HB3 PRO 83 46.906 15.648 22.232 625 HG2 PRO 83 HG2 PRO 83 47.735 15.032 25.088 626 HG3 PRO 83 HG3 PRO 83 48.411 14.362 23.563 627 HD2 PRO 83 HD2 PRO 83 49.548 16.469 24.827 628 HD3 PRO 83 HD3 PRO 83 49.500 16.369 23.044 629 H ALA 84 H ALA 84 46.037 19.425 24.649 630 HA ALA 84 HA ALA 84 45.275 20.310 26.579 631 HB1 ALA 84 HB1 ALA 84 42.908 19.788 26.995 632 HB2 ALA 84 HB2 ALA 84 43.262 19.929 25.261 633 HB3 ALA 84 HB3 ALA 84 43.053 18.331 25.996 634 HA PRO 85 HA PRO 85 46.751 16.547 28.792 635 HB2 PRO 85 HB2 PRO 85 48.968 18.238 29.901 636 HB3 PRO 85 HB3 PRO 85 49.035 16.586 29.205 637 HG2 PRO 85 HG2 PRO 85 49.873 18.693 27.760 638 HG3 PRO 85 HG3 PRO 85 48.842 17.437 26.981 639 HD2 PRO 85 HD2 PRO 85 47.985 20.086 28.181 640 HD3 PRO 85 HD3 PRO 85 47.628 19.455 26.559 641 H SER 86 H SER 86 46.023 19.620 30.344 642 HA SER 86 HA SER 86 46.225 18.564 33.063 643 HB2 SER 86 HB2 SER 86 45.330 20.623 33.785 644 HB3 SER 86 HB3 SER 86 46.464 20.989 32.476 645 HG SER 86 HG SER 86 44.798 21.288 31.082 646 H GLY 87 H GLY 87 44.325 18.455 34.548 647 HA2 GLY 87 HA2 GLY 87 41.685 17.893 33.487 648 HA3 GLY 87 HA3 GLY 87 42.587 16.406 33.755 649 H ASP 88 H ASP 88 42.614 19.367 35.789 650 HA ASP 88 HA ASP 88 42.218 17.833 38.237 651 HB2 ASP 88 HB2 ASP 88 42.354 20.785 37.563 652 HB3 ASP 88 HB3 ASP 88 41.927 20.236 39.175 653 H GLN 89 H GLN 89 40.430 18.161 39.774 654 HA GLN 89 HA GLN 89 37.857 17.997 38.256 655 HB2 GLN 89 HB2 GLN 89 37.166 16.273 39.711 656 HB3 GLN 89 HB3 GLN 89 38.759 15.908 39.096 657 HG2 GLN 89 HG2 GLN 89 39.192 15.367 41.266 658 HG3 GLN 89 HG3 GLN 89 39.511 17.080 41.442 659 HE21 GLN 89 HE21 GLN 89 38.454 17.980 43.249 660 HE22 GLN 89 HE22 GLN 89 36.920 17.352 43.858 661 H ASP 90 H ASP 90 39.278 20.072 40.415 662 HA ASP 90 HA ASP 90 36.691 21.324 41.018 663 HB2 ASP 90 HB2 ASP 90 37.124 21.598 43.390 664 HB3 ASP 90 HB3 ASP 90 37.059 19.889 42.994 665 H ASP 91 H ASP 91 36.914 23.509 41.777 666 HA ASP 91 HA ASP 91 39.198 24.889 40.483 667 HB2 ASP 91 HB2 ASP 91 36.797 25.377 39.915 668 HB3 ASP 91 HB3 ASP 91 36.585 26.022 41.547 669 H ALA 92 H ALA 92 38.586 23.787 43.499 670 HA ALA 92 HA ALA 92 39.188 24.130 45.585 671 HB1 ALA 92 HB1 ALA 92 41.389 25.117 46.028 672 HB2 ALA 92 HB2 ALA 92 41.391 24.019 44.632 673 HB3 ALA 92 HB3 ALA 92 41.415 25.774 44.378 674 H SER 93 H SER 93 38.473 25.154 47.326 675 HA SER 93 HA SER 93 37.851 28.083 47.161 676 HB2 SER 93 HB2 SER 93 36.110 26.011 48.500 677 HB3 SER 93 HB3 SER 93 35.855 27.768 48.404 678 HG SER 93 HG SER 93 34.918 27.440 46.585 679 H GLU 94 H GLU 94 38.151 29.306 48.872 680 HA GLU 94 HA GLU 94 39.332 28.150 51.355 681 HB2 GLU 94 HB2 GLU 94 40.540 30.239 51.575 682 HB3 GLU 94 HB3 GLU 94 40.919 29.440 50.045 683 HG2 GLU 94 HG2 GLU 94 39.220 31.017 48.949 684 HG3 GLU 94 HG3 GLU 94 39.198 31.910 50.476 685 H TYR 95 H TYR 95 38.383 28.582 53.281 686 HA TYR 95 HA TYR 95 36.625 30.920 53.585 687 HB2 TYR 95 HB2 TYR 95 35.142 29.039 52.788 688 HB3 TYR 95 HB3 TYR 95 35.591 28.133 54.228 689 HD1 TYR 95 HD1 TYR 95 34.164 28.356 56.139 690 HD2 TYR 95 HD2 TYR 95 34.316 31.503 53.195 691 HE1 TYR 95 HE1 TYR 95 32.511 29.676 57.462 692 HE2 TYR 95 HE2 TYR 95 32.644 32.784 54.490 693 HH TYR 95 HH TYR 95 31.415 32.908 56.347 694 H GLU 96 H GLU 96 36.343 31.611 55.691 695 HA GLU 96 HA GLU 96 37.140 32.280 57.651 696 HB2 GLU 96 HB2 GLU 96 38.048 29.467 58.247 697 HB3 GLU 96 HB3 GLU 96 37.818 30.787 59.393 698 HG2 GLU 96 HG2 GLU 96 35.403 30.839 58.941 699 HG3 GLU 96 HG3 GLU 96 35.586 29.567 57.724 700 H GLU 97 H GLU 97 39.035 32.917 58.841 701 HA GLU 97 HA GLU 97 41.543 32.798 57.240 702 HB2 GLU 97 HB2 GLU 97 39.847 34.403 56.328 703 HB3 GLU 97 HB3 GLU 97 39.942 35.310 57.832 704 HG2 GLU 97 HG2 GLU 97 42.198 36.025 57.325 705 HG3 GLU 97 HG3 GLU 97 42.385 34.758 56.101 706 H GLY 98 H GLY 98 40.836 32.007 60.086 707 HA2 GLY 98 HA2 GLY 98 42.118 31.809 61.963 708 HA3 GLY 98 HA3 GLY 98 43.420 32.628 61.087 709 H VAL 99 H VAL 99 40.189 33.728 62.235 710 HA VAL 99 HA VAL 99 41.142 36.335 62.842 711 HB VAL 99 HB VAL 99 38.797 35.636 62.285 712 HG11 VAL 99 HG11 VAL 99 37.240 35.056 64.047 713 HG12 VAL 99 HG12 VAL 99 38.528 33.844 64.012 714 HG13 VAL 99 HG13 VAL 99 38.528 35.086 65.272 715 HG21 VAL 99 HG21 VAL 99 39.458 37.915 63.039 716 HG22 VAL 99 HG22 VAL 99 37.792 37.474 63.381 717 HG23 VAL 99 HG23 VAL 99 38.998 37.465 64.700 718 H ILE 100 H ILE 100 41.496 37.447 64.772 719 HA ILE 100 HA ILE 100 41.965 35.895 67.255 720 HB ILE 100 HB ILE 100 44.030 35.872 65.868 721 HG12 ILE 100 HG12 ILE 100 44.349 37.420 68.464 722 HG13 ILE 100 HG13 ILE 100 44.076 35.678 68.329 723 HG21 ILE 100 HG21 ILE 100 44.265 38.863 66.365 724 HG22 ILE 100 HG22 ILE 100 45.357 37.822 65.433 725 HG23 ILE 100 HG23 ILE 100 43.741 38.152 64.822 726 HD11 ILE 100 HD11 ILE 100 46.210 35.483 67.012 727 HD12 ILE 100 HD12 ILE 100 46.516 37.208 67.332 728 HD13 ILE 100 HD13 ILE 100 46.434 36.061 68.673 729 H ARG 101 H ARG 101 41.904 37.149 69.163 730 HA ARG 101 HA ARG 101 41.142 40.021 68.869 731 HB2 ARG 101 HB2 ARG 101 39.341 39.851 70.388 732 HB3 ARG 101 HB3 ARG 101 39.104 38.705 69.072 733 HG2 ARG 101 HG2 ARG 101 40.119 36.935 70.694 734 HG3 ARG 101 HG3 ARG 101 39.846 38.143 71.958 735 HD2 ARG 101 HD2 ARG 101 37.744 36.887 70.160 736 HD3 ARG 101 HD3 ARG 101 38.047 36.524 71.854 737 HE ARG 101 HE ARG 101 37.302 39.310 71.129 738 HH11 ARG 101 HH11 ARG 101 36.289 36.419 72.853 739 HH12 ARG 101 HH12 ARG 101 34.719 37.108 73.197 740 HH21 ARG 101 HH21 ARG 101 35.474 40.113 71.663 741 HH22 ARG 101 HH22 ARG 101 34.214 39.160 72.454 Start of MODEL 18 1 H GLY 1 H1 GLY 1 56.799 46.805 45.150 2 HA2 GLY 1 HA2 GLY 1 54.735 47.053 44.083 3 HA3 GLY 1 HA3 GLY 1 54.505 47.195 45.836 4 H ALA 2 H ALA 2 52.551 48.333 45.353 5 HA ALA 2 HA ALA 2 51.172 50.055 44.922 6 HB1 ALA 2 HB1 ALA 2 53.513 51.713 45.927 7 HB2 ALA 2 HB2 ALA 2 51.794 52.142 45.997 8 HB3 ALA 2 HB3 ALA 2 52.405 50.772 46.942 9 H ALA 3 H ALA 3 52.923 49.364 42.529 10 HA ALA 3 HA ALA 3 53.193 52.022 41.223 11 HB1 ALA 3 HB1 ALA 3 54.673 49.406 40.807 12 HB2 ALA 3 HB2 ALA 3 54.945 50.896 39.886 13 HB3 ALA 3 HB3 ALA 3 55.279 50.862 41.628 14 H ALA 4 H ALA 4 51.784 52.553 39.681 15 HA ALA 4 HA ALA 4 51.085 50.657 37.584 16 HB1 ALA 4 HB1 ALA 4 48.891 51.695 39.441 17 HB2 ALA 4 HB2 ALA 4 48.627 50.806 37.925 18 HB3 ALA 4 HB3 ALA 4 49.427 50.007 39.288 19 H GLY 5 H GLY 5 50.423 51.547 35.730 20 HA2 GLY 5 HA2 GLY 5 49.067 54.042 35.378 21 HA3 GLY 5 HA3 GLY 5 50.759 54.165 34.858 22 H VAL 6 H VAL 6 49.174 54.477 32.721 23 HA VAL 6 HA VAL 6 49.560 51.943 31.277 24 HB VAL 6 HB VAL 6 47.350 51.591 31.950 25 HG11 VAL 6 HG11 VAL 6 46.588 53.796 32.638 26 HG12 VAL 6 HG12 VAL 6 46.601 54.368 30.958 27 HG13 VAL 6 HG13 VAL 6 45.463 53.111 31.462 28 HG21 VAL 6 HG21 VAL 6 47.928 51.112 29.575 29 HG22 VAL 6 HG22 VAL 6 46.207 51.403 29.827 30 HG23 VAL 6 HG23 VAL 6 47.198 52.670 29.111 31 H SER 7 H SER 7 50.360 52.134 29.399 32 HA SER 7 HA SER 7 49.892 54.545 27.665 33 HB2 SER 7 HB2 SER 7 52.480 52.970 27.910 34 HB3 SER 7 HB3 SER 7 52.179 54.347 26.843 35 HG SER 7 HG SER 7 53.289 55.049 28.632 36 H ALA 8 H ALA 8 50.271 51.057 27.941 37 HA ALA 8 HA ALA 8 50.388 49.344 26.556 38 HB1 ALA 8 HB1 ALA 8 48.621 50.927 24.680 39 HB2 ALA 8 HB2 ALA 8 48.837 49.163 24.738 40 HB3 ALA 8 HB3 ALA 8 48.071 50.003 26.088 41 H ALA 9 H ALA 9 50.452 49.508 23.581 42 HA ALA 9 HA ALA 9 51.989 49.284 21.980 43 HB1 ALA 9 HB1 ALA 9 52.237 51.786 22.280 44 HB2 ALA 9 HB2 ALA 9 53.720 51.438 23.195 45 HB3 ALA 9 HB3 ALA 9 53.588 50.944 21.503 46 H GLY 10 H GLY 10 54.310 48.706 21.455 47 HA2 GLY 10 HA2 GLY 10 55.986 47.127 21.699 48 HA3 GLY 10 HA3 GLY 10 55.697 47.042 23.437 49 H ILE 11 H ILE 11 55.306 45.406 20.515 50 HA ILE 11 HA ILE 11 52.902 43.961 21.098 51 HB ILE 11 HB ILE 11 53.682 44.180 18.830 52 HG12 ILE 11 HG12 ILE 11 53.491 41.872 18.019 53 HG13 ILE 11 HG13 ILE 11 53.775 41.235 19.636 54 HG21 ILE 11 HG21 ILE 11 56.160 44.071 19.238 55 HG22 ILE 11 HG22 ILE 11 56.000 42.326 19.479 56 HG23 ILE 11 HG23 ILE 11 55.610 43.046 17.908 57 HD11 ILE 11 HD11 ILE 11 51.420 42.986 18.825 58 HD12 ILE 11 HD12 ILE 11 51.383 41.219 18.988 59 HD13 ILE 11 HD13 ILE 11 51.644 42.226 20.415 60 H GLU 12 H GLU 12 52.494 42.275 22.307 61 HA GLU 12 HA GLU 12 54.608 40.365 23.088 62 HB2 GLU 12 HB2 GLU 12 52.650 41.751 24.964 63 HB3 GLU 12 HB3 GLU 12 53.320 40.149 25.307 64 HG2 GLU 12 HG2 GLU 12 55.551 40.960 25.392 65 HG3 GLU 12 HG3 GLU 12 55.052 42.590 24.893 66 HA PRO 13 HA PRO 13 51.410 37.486 21.818 67 HB2 PRO 13 HB2 PRO 13 51.999 35.269 23.321 68 HB3 PRO 13 HB3 PRO 13 52.990 35.818 21.937 69 HG2 PRO 13 HG2 PRO 13 53.448 36.392 24.883 70 HG3 PRO 13 HG3 PRO 13 54.624 35.756 23.684 71 HD2 PRO 13 HD2 PRO 13 54.537 38.389 24.288 72 HD3 PRO 13 HD3 PRO 13 54.790 37.860 22.597 73 H ASP 14 H ASP 14 49.506 36.436 22.598 74 HA ASP 14 HA ASP 14 47.984 38.093 24.301 75 HB2 ASP 14 HB2 ASP 14 47.428 35.228 23.408 76 HB3 ASP 14 HB3 ASP 14 46.223 36.377 23.993 77 H LEU 15 H LEU 15 49.815 35.272 25.079 78 HA LEU 15 HA LEU 15 48.926 34.416 27.594 79 HB2 LEU 15 HB2 LEU 15 51.725 34.831 26.422 80 HB3 LEU 15 HB3 LEU 15 51.471 34.150 28.015 81 HG LEU 15 HG LEU 15 51.954 32.427 26.424 82 HD11 LEU 15 HD11 LEU 15 49.070 32.237 27.327 83 HD12 LEU 15 HD12 LEU 15 50.502 31.925 28.339 84 HD13 LEU 15 HD13 LEU 15 50.167 30.895 26.933 85 HD21 LEU 15 HD21 LEU 15 49.336 33.036 24.993 86 HD22 LEU 15 HD22 LEU 15 50.497 31.750 24.629 87 HD23 LEU 15 HD23 LEU 15 50.956 33.435 24.366 88 H THR 16 H THR 16 50.933 37.361 26.866 89 HA THR 16 HA THR 16 51.326 37.850 29.717 90 HB THR 16 HB THR 16 52.411 39.881 29.109 91 HG1 THR 16 HG1 THR 16 52.328 40.753 27.211 92 HG21 THR 16 HG21 THR 16 53.679 37.757 28.665 93 HG22 THR 16 HG22 THR 16 54.183 39.126 27.658 94 HG23 THR 16 HG23 THR 16 53.159 37.852 26.963 95 H ALA 17 H ALA 17 48.999 38.990 27.309 96 HA ALA 17 HA ALA 17 47.878 41.126 28.908 97 HB1 ALA 17 HB1 ALA 17 46.715 39.522 26.589 98 HB2 ALA 17 HB2 ALA 17 46.074 41.045 27.239 99 HB3 ALA 17 HB3 ALA 17 47.660 41.023 26.458 100 H ILE 18 H ILE 18 46.974 37.698 28.324 101 HA ILE 18 HA ILE 18 44.777 37.722 30.207 102 HB ILE 18 HB ILE 18 46.412 35.490 28.961 103 HG12 ILE 18 HG12 ILE 18 43.548 36.475 28.470 104 HG13 ILE 18 HG13 ILE 18 44.927 37.007 27.516 105 HG21 ILE 18 HG21 ILE 18 44.613 33.935 29.722 106 HG22 ILE 18 HG22 ILE 18 45.483 34.635 31.075 107 HG23 ILE 18 HG23 ILE 18 43.875 35.264 30.640 108 HD11 ILE 18 HD11 ILE 18 45.328 34.736 26.720 109 HD12 ILE 18 HD12 ILE 18 43.901 34.156 27.638 110 HD13 ILE 18 HD13 ILE 18 43.702 35.298 26.312 111 H TRP 19 H TRP 19 48.253 36.724 30.615 112 HA TRP 19 HA TRP 19 47.843 35.967 33.340 113 HB2 TRP 19 HB2 TRP 19 50.358 36.736 31.842 114 HB3 TRP 19 HB3 TRP 19 50.347 36.220 33.516 115 HD1 TRP 19 HD1 TRP 19 48.074 34.314 31.116 116 HE1 TRP 19 HE1 TRP 19 48.981 31.943 30.777 117 HE3 TRP 19 HE3 TRP 19 52.550 34.787 33.537 118 HZ2 TRP 19 HZ2 TRP 19 51.427 30.517 31.250 119 HZ3 TRP 19 HZ3 TRP 19 54.178 32.894 33.545 120 HH2 TRP 19 HH2 TRP 19 53.632 30.769 32.386 121 H GLN 20 H GLN 20 48.814 39.184 31.966 122 HA GLN 20 HA GLN 20 49.112 40.319 34.589 123 HB2 GLN 20 HB2 GLN 20 49.405 42.424 33.599 124 HB3 GLN 20 HB3 GLN 20 50.151 41.256 32.517 125 HG2 GLN 20 HG2 GLN 20 47.957 41.336 31.189 126 HG3 GLN 20 HG3 GLN 20 47.507 42.733 32.159 127 HE21 GLN 20 HE21 GLN 20 50.270 41.538 30.167 128 HE22 GLN 20 HE22 GLN 20 50.536 43.080 29.345 129 H ALA 21 H ALA 21 46.235 40.136 32.397 130 HA ALA 21 HA ALA 21 44.544 41.703 34.072 131 HB1 ALA 21 HB1 ALA 21 44.050 41.083 31.731 132 HB2 ALA 21 HB2 ALA 21 43.861 39.384 32.210 133 HB3 ALA 21 HB3 ALA 21 42.728 40.612 32.814 134 H LEU 22 H LEU 22 45.239 38.174 34.142 135 HA LEU 22 HA LEU 22 43.286 37.632 36.215 136 HB2 LEU 22 HB2 LEU 22 45.547 35.981 35.042 137 HB3 LEU 22 HB3 LEU 22 44.338 35.359 36.164 138 HG LEU 22 HG LEU 22 43.678 36.504 33.404 139 HD11 LEU 22 HD11 LEU 22 43.744 33.627 34.377 140 HD12 LEU 22 HD12 LEU 22 44.997 34.381 33.363 141 HD13 LEU 22 HD13 LEU 22 43.355 34.198 32.737 142 HD21 LEU 22 HD21 LEU 22 41.504 35.438 33.721 143 HD22 LEU 22 HD22 LEU 22 41.773 36.716 34.898 144 HD23 LEU 22 HD23 LEU 22 41.947 35.020 35.391 145 H PHE 23 H PHE 23 46.849 38.113 36.281 146 HA PHE 23 HA PHE 23 46.855 37.807 39.191 147 HB2 PHE 23 HB2 PHE 23 48.705 37.044 37.717 148 HB3 PHE 23 HB3 PHE 23 49.041 38.714 37.310 149 HD1 PHE 23 HD1 PHE 23 51.375 38.022 37.908 150 HD2 PHE 23 HD2 PHE 23 48.262 38.141 40.899 151 HE1 PHE 23 HE1 PHE 23 53.082 38.172 39.692 152 HE2 PHE 23 HE2 PHE 23 49.966 38.275 42.665 153 HZ PHE 23 HZ PHE 23 52.389 38.321 42.079 154 H ALA 24 H ALA 24 45.814 40.253 37.203 155 HA ALA 24 HA ALA 24 45.125 42.325 37.458 156 HB1 ALA 24 HB1 ALA 24 44.291 43.029 39.626 157 HB2 ALA 24 HB2 ALA 24 43.941 41.311 39.356 158 HB3 ALA 24 HB3 ALA 24 45.267 41.794 40.442 159 H LEU 25 H LEU 25 48.294 41.805 38.204 160 HA LEU 25 HA LEU 25 49.034 44.544 38.854 161 HB2 LEU 25 HB2 LEU 25 51.320 43.691 37.943 162 HB3 LEU 25 HB3 LEU 25 50.721 43.202 39.514 163 HG LEU 25 HG LEU 25 50.202 40.995 38.739 164 HD11 LEU 25 HD11 LEU 25 50.982 41.952 35.959 165 HD12 LEU 25 HD12 LEU 25 49.378 41.409 36.476 166 HD13 LEU 25 HD13 LEU 25 50.712 40.256 36.428 167 HD21 LEU 25 HD21 LEU 25 52.554 41.475 39.328 168 HD22 LEU 25 HD22 LEU 25 52.892 41.927 37.646 169 HD23 LEU 25 HD23 LEU 25 52.475 40.260 38.041 170 HA PRO 26 HA PRO 26 48.573 46.457 35.044 171 HB2 PRO 26 HB2 PRO 26 50.600 48.282 34.815 172 HB3 PRO 26 HB3 PRO 26 49.276 48.406 36.013 173 HG2 PRO 26 HG2 PRO 26 52.047 47.222 36.429 174 HG3 PRO 26 HG3 PRO 26 51.206 48.446 37.431 175 HD2 PRO 26 HD2 PRO 26 51.154 45.854 38.133 176 HD3 PRO 26 HD3 PRO 26 49.671 46.840 38.275 177 H ALA 27 H ALA 27 51.728 44.905 35.380 178 HA ALA 27 HA ALA 27 51.855 44.221 32.513 179 HB1 ALA 27 HB1 ALA 27 54.175 45.170 32.370 180 HB2 ALA 27 HB2 ALA 27 52.954 46.431 32.628 181 HB3 ALA 27 HB3 ALA 27 53.969 45.882 33.979 182 H VAL 28 H VAL 28 53.523 42.605 32.071 183 HA VAL 28 HA VAL 28 54.777 41.277 34.432 184 HB VAL 28 HB VAL 28 54.373 39.056 33.439 185 HG11 VAL 28 HG11 VAL 28 52.114 38.778 34.265 186 HG12 VAL 28 HG12 VAL 28 53.002 39.906 35.303 187 HG13 VAL 28 HG13 VAL 28 51.815 40.525 34.134 188 HG21 VAL 28 HG21 VAL 28 52.344 40.439 31.640 189 HG22 VAL 28 HG22 VAL 28 53.836 39.628 31.112 190 HG23 VAL 28 HG23 VAL 28 52.537 38.689 31.857 191 H GLY 29 H GLY 29 56.785 40.410 34.140 192 HA2 GLY 29 HA2 GLY 29 58.390 41.304 31.914 193 HA3 GLY 29 HA3 GLY 29 58.904 40.250 33.217 194 H ARG 30 H ARG 30 59.098 40.235 30.119 195 HA ARG 30 HA ARG 30 57.620 37.957 29.122 196 HB2 ARG 30 HB2 ARG 30 60.157 39.312 28.099 197 HB3 ARG 30 HB3 ARG 30 59.206 38.143 27.180 198 HG2 ARG 30 HG2 ARG 30 57.274 39.647 27.130 199 HG3 ARG 30 HG3 ARG 30 58.082 40.781 28.212 200 HD2 ARG 30 HD2 ARG 30 58.333 41.712 26.104 201 HD3 ARG 30 HD3 ARG 30 59.914 41.041 26.489 202 HE ARG 30 HE ARG 30 59.378 39.111 24.986 203 HH11 ARG 30 HH11 ARG 30 57.612 42.106 24.344 204 HH12 ARG 30 HH12 ARG 30 56.949 41.472 22.876 205 HH21 ARG 30 HH21 ARG 30 58.656 38.464 23.132 206 HH22 ARG 30 HH22 ARG 30 57.487 39.409 22.197 207 H HIS 31 H HIS 31 60.760 38.199 30.621 208 HA HIS 31 HA HIS 31 61.271 35.292 30.253 209 HB2 HIS 31 HB2 HIS 31 63.333 37.500 30.132 210 HB3 HIS 31 HB3 HIS 31 63.606 35.779 29.864 211 HD1 HIS 31 HD1 HIS 31 63.732 38.513 27.783 212 HD2 HIS 31 HD2 HIS 31 61.261 35.119 27.780 213 HE1 HIS 31 HE1 HIS 31 62.917 38.222 25.375 214 H GLN 32 H GLN 32 60.190 37.037 32.489 215 HA GLN 32 HA GLN 32 61.659 35.985 34.829 216 HB2 GLN 32 HB2 GLN 32 58.899 37.130 34.375 217 HB3 GLN 32 HB3 GLN 32 59.501 36.641 35.965 218 HG2 GLN 32 HG2 GLN 32 60.664 38.879 34.256 219 HG3 GLN 32 HG3 GLN 32 59.447 39.108 35.494 220 HE21 GLN 32 HE21 GLN 32 59.971 38.550 37.761 221 HE22 GLN 32 HE22 GLN 32 61.648 38.616 38.287 222 H ASP 33 H ASP 33 60.975 34.048 35.898 223 HA ASP 33 HA ASP 33 59.509 32.155 34.151 224 HB2 ASP 33 HB2 ASP 33 60.246 30.402 35.721 225 HB3 ASP 33 HB3 ASP 33 61.529 31.242 34.853 226 H PHE 34 H PHE 34 57.681 31.080 34.589 227 HA PHE 34 HA PHE 34 55.528 32.241 35.806 228 HB2 PHE 34 HB2 PHE 34 55.218 30.435 34.294 229 HB3 PHE 34 HB3 PHE 34 56.199 29.347 35.262 230 HD1 PHE 34 HD1 PHE 34 52.905 31.147 35.215 231 HD2 PHE 34 HD2 PHE 34 55.272 28.042 37.053 232 HE1 PHE 34 HE1 PHE 34 50.943 30.433 36.554 233 HE2 PHE 34 HE2 PHE 34 53.304 27.314 38.360 234 HZ PHE 34 HZ PHE 34 51.154 28.529 38.151 235 H PHE 35 H PHE 35 57.857 30.180 37.509 236 HA PHE 35 HA PHE 35 56.358 29.629 39.848 237 HB2 PHE 35 HB2 PHE 35 59.351 29.991 39.529 238 HB3 PHE 35 HB3 PHE 35 58.537 29.103 40.799 239 HD1 PHE 35 HD1 PHE 35 60.175 28.796 37.653 240 HD2 PHE 35 HD2 PHE 35 56.946 27.108 39.947 241 HE1 PHE 35 HE1 PHE 35 60.379 26.682 36.380 242 HE2 PHE 35 HE2 PHE 35 57.138 24.999 38.656 243 HZ PHE 35 HZ PHE 35 58.854 24.777 36.875 244 H ALA 36 H ALA 36 57.991 32.609 38.900 245 HA ALA 36 HA ALA 36 56.995 33.908 41.421 246 HB1 ALA 36 HB1 ALA 36 59.425 34.140 41.053 247 HB2 ALA 36 HB2 ALA 36 59.119 34.835 39.445 248 HB3 ALA 36 HB3 ALA 36 58.589 35.702 40.904 249 H LEU 37 H LEU 37 57.236 34.215 37.898 250 HA LEU 37 HA LEU 37 55.914 36.661 37.548 251 HB2 LEU 37 HB2 LEU 37 57.537 35.342 36.106 252 HB3 LEU 37 HB3 LEU 37 56.215 34.319 35.600 253 HG LEU 37 HG LEU 37 57.037 36.045 34.014 254 HD11 LEU 37 HD11 LEU 37 54.988 36.727 33.078 255 HD12 LEU 37 HD12 LEU 37 54.098 36.379 34.573 256 HD13 LEU 37 HD13 LEU 37 54.870 35.059 33.646 257 HD21 LEU 37 HD21 LEU 37 57.258 37.861 35.742 258 HD22 LEU 37 HD22 LEU 37 55.493 38.062 35.672 259 HD23 LEU 37 HD23 LEU 37 56.499 38.311 34.219 260 H GLY 38 H GLY 38 54.582 33.422 37.759 261 HA2 GLY 38 HA2 GLY 38 51.929 34.134 36.700 262 HA3 GLY 38 HA3 GLY 38 52.447 32.570 37.337 263 H GLY 39 H GLY 39 53.311 34.837 39.644 264 HA2 GLY 39 HA2 GLY 39 52.410 35.658 41.576 265 HA3 GLY 39 HA3 GLY 39 50.812 35.443 40.876 266 H ASP 40 H ASP 40 50.583 32.674 40.668 267 HA ASP 40 HA ASP 40 51.324 31.394 43.191 268 HB2 ASP 40 HB2 ASP 40 49.172 32.986 43.466 269 HB3 ASP 40 HB3 ASP 40 48.350 31.634 42.729 270 H SER 41 H SER 41 50.612 29.056 43.255 271 HA SER 41 HA SER 41 50.097 27.831 40.635 272 HB2 SER 41 HB2 SER 41 49.814 25.747 41.902 273 HB3 SER 41 HB3 SER 41 51.352 26.552 42.200 274 HG SER 41 HG SER 41 50.422 25.707 44.047 275 H GLN 42 H GLN 42 48.015 29.001 43.246 276 HA GLN 42 HA GLN 42 45.496 28.151 42.260 277 HB2 GLN 42 HB2 GLN 42 45.914 29.166 44.421 278 HB3 GLN 42 HB3 GLN 42 46.514 30.652 43.702 279 HG2 GLN 42 HG2 GLN 42 43.731 29.717 43.154 280 HG3 GLN 42 HG3 GLN 42 44.095 30.525 44.685 281 HE21 GLN 42 HE21 GLN 42 45.400 32.755 44.355 282 HE22 GLN 42 HE22 GLN 42 44.679 33.755 43.106 283 H LEU 43 H LEU 43 47.539 30.942 41.335 284 HA LEU 43 HA LEU 43 45.714 31.838 39.246 285 HB2 LEU 43 HB2 LEU 43 48.478 32.637 40.172 286 HB3 LEU 43 HB3 LEU 43 47.793 33.301 38.696 287 HG LEU 43 HG LEU 43 46.444 33.523 41.417 288 HD11 LEU 43 HD11 LEU 43 47.229 35.865 41.388 289 HD12 LEU 43 HD12 LEU 43 48.163 35.525 39.906 290 HD13 LEU 43 HD13 LEU 43 48.573 34.719 41.433 291 HD21 LEU 43 HD21 LEU 43 44.837 33.780 39.595 292 HD22 LEU 43 HD22 LEU 43 45.939 34.883 38.728 293 HD23 LEU 43 HD23 LEU 43 45.190 35.370 40.257 294 H GLY 44 H GLY 44 48.523 29.685 39.366 295 HA2 GLY 44 HA2 GLY 44 48.862 29.192 36.584 296 HA3 GLY 44 HA3 GLY 44 49.061 28.000 37.881 297 H LEU 45 H LEU 45 46.632 27.582 38.913 298 HA LEU 45 HA LEU 45 45.149 26.094 36.961 299 HB2 LEU 45 HB2 LEU 45 44.642 27.001 39.795 300 HB3 LEU 45 HB3 LEU 45 43.258 26.506 38.831 301 HG LEU 45 HG LEU 45 44.337 24.332 38.352 302 HD11 LEU 45 HD11 LEU 45 46.700 24.889 38.698 303 HD12 LEU 45 HD12 LEU 45 46.209 23.557 39.745 304 HD13 LEU 45 HD13 LEU 45 46.384 25.185 40.428 305 HD21 LEU 45 HD21 LEU 45 44.026 24.998 41.299 306 HD22 LEU 45 HD22 LEU 45 43.960 23.372 40.583 307 HD23 LEU 45 HD23 LEU 45 42.720 24.562 40.169 308 H ARG 46 H ARG 46 44.443 29.361 38.310 309 HA ARG 46 HA ARG 46 42.137 29.837 36.712 310 HB2 ARG 46 HB2 ARG 46 42.836 31.197 38.706 311 HB3 ARG 46 HB3 ARG 46 44.087 31.959 37.716 312 HG2 ARG 46 HG2 ARG 46 42.438 32.949 36.249 313 HG3 ARG 46 HG3 ARG 46 41.134 31.998 36.968 314 HD2 ARG 46 HD2 ARG 46 41.479 33.153 39.124 315 HD3 ARG 46 HD3 ARG 46 42.727 34.173 38.383 316 HE ARG 46 HE ARG 46 40.448 34.516 36.780 317 HH11 ARG 46 HH11 ARG 46 41.110 35.122 40.213 318 HH12 ARG 46 HH12 ARG 46 39.826 36.333 40.242 319 HH21 ARG 46 HH21 ARG 46 38.966 36.101 36.995 320 HH22 ARG 46 HH22 ARG 46 38.662 36.783 38.609 321 H MET 47 H MET 47 45.535 30.789 35.937 322 HA MET 47 HA MET 47 44.748 31.917 33.421 323 HB2 MET 47 HB2 MET 47 47.002 32.260 32.924 324 HB3 MET 47 HB3 MET 47 46.829 32.516 34.653 325 HG2 MET 47 HG2 MET 47 48.824 31.349 34.473 326 HG3 MET 47 HG3 MET 47 47.671 30.103 34.929 327 HE1 MET 47 HE1 MET 47 49.115 28.084 34.277 328 HE2 MET 47 HE2 MET 47 50.079 27.978 32.789 329 HE3 MET 47 HE3 MET 47 50.450 29.232 33.997 330 H LEU 48 H LEU 48 45.776 28.576 34.239 331 HA LEU 48 HA LEU 48 45.836 27.678 31.550 332 HB2 LEU 48 HB2 LEU 48 46.730 26.443 33.504 333 HB3 LEU 48 HB3 LEU 48 45.091 26.191 34.103 334 HG LEU 48 HG LEU 48 44.576 24.842 32.037 335 HD11 LEU 48 HD11 LEU 48 47.560 25.155 31.541 336 HD12 LEU 48 HD12 LEU 48 46.257 25.749 30.472 337 HD13 LEU 48 HD13 LEU 48 46.515 24.009 30.697 338 HD21 LEU 48 HD21 LEU 48 46.981 23.971 33.686 339 HD22 LEU 48 HD22 LEU 48 45.954 22.896 32.717 340 HD23 LEU 48 HD23 LEU 48 45.268 23.754 34.107 341 H ALA 49 H ALA 49 43.068 27.643 33.891 342 HA ALA 49 HA ALA 49 41.206 26.506 32.032 343 HB1 ALA 49 HB1 ALA 49 39.499 27.320 33.625 344 HB2 ALA 49 HB2 ALA 49 40.837 26.521 34.462 345 HB3 ALA 49 HB3 ALA 49 40.728 28.295 34.462 346 H GLN 50 H GLN 50 41.703 29.949 32.937 347 HA GLN 50 HA GLN 50 39.684 30.999 31.213 348 HB2 GLN 50 HB2 GLN 50 42.191 32.271 32.358 349 HB3 GLN 50 HB3 GLN 50 40.861 33.180 31.651 350 HG2 GLN 50 HG2 GLN 50 40.473 31.319 34.050 351 HG3 GLN 50 HG3 GLN 50 40.994 32.982 34.225 352 HE21 GLN 50 HE21 GLN 50 38.687 31.896 35.417 353 HE22 GLN 50 HE22 GLN 50 37.349 32.839 34.763 354 H LEU 51 H LEU 51 43.254 30.629 30.677 355 HA LEU 51 HA LEU 51 43.244 31.796 28.052 356 HB2 LEU 51 HB2 LEU 51 45.256 31.478 29.486 357 HB3 LEU 51 HB3 LEU 51 45.056 29.722 29.321 358 HG LEU 51 HG LEU 51 45.397 29.962 26.838 359 HD11 LEU 51 HD11 LEU 51 46.349 32.748 27.615 360 HD12 LEU 51 HD12 LEU 51 44.959 32.363 26.573 361 HD13 LEU 51 HD13 LEU 51 46.594 31.961 26.037 362 HD21 LEU 51 HD21 LEU 51 47.106 29.197 28.388 363 HD22 LEU 51 HD22 LEU 51 47.618 30.867 28.700 364 HD23 LEU 51 HD23 LEU 51 47.824 30.149 27.077 365 H ARG 52 H ARG 52 42.808 28.352 29.167 366 HA ARG 52 HA ARG 52 42.677 27.360 26.483 367 HB2 ARG 52 HB2 ARG 52 43.058 26.043 28.620 368 HB3 ARG 52 HB3 ARG 52 41.308 26.049 28.859 369 HG2 ARG 52 HG2 ARG 52 40.946 24.845 26.799 370 HG3 ARG 52 HG3 ARG 52 42.589 25.156 26.237 371 HD2 ARG 52 HD2 ARG 52 43.441 23.750 28.172 372 HD3 ARG 52 HD3 ARG 52 41.762 23.246 28.453 373 HE ARG 52 HE ARG 52 42.378 22.852 25.693 374 HH11 ARG 52 HH11 ARG 52 43.456 21.309 28.739 375 HH12 ARG 52 HH12 ARG 52 43.692 19.813 27.852 376 HH21 ARG 52 HH21 ARG 52 42.998 21.005 24.784 377 HH22 ARG 52 HH22 ARG 52 43.737 19.741 25.757 378 H GLU 53 H GLU 53 40.099 28.583 28.625 379 HA GLU 53 HA GLU 53 37.988 28.136 26.684 380 HB2 GLU 53 HB2 GLU 53 38.160 29.984 29.100 381 HB3 GLU 53 HB3 GLU 53 36.744 29.842 28.063 382 HG2 GLU 53 HG2 GLU 53 37.102 27.219 28.552 383 HG3 GLU 53 HG3 GLU 53 37.845 27.841 30.015 384 H ARG 54 H ARG 54 40.042 31.020 27.234 385 HA ARG 54 HA ARG 54 38.494 32.587 25.251 386 HB2 ARG 54 HB2 ARG 54 40.969 33.225 26.916 387 HB3 ARG 54 HB3 ARG 54 40.090 34.390 25.932 388 HG2 ARG 54 HG2 ARG 54 38.899 32.954 28.346 389 HG3 ARG 54 HG3 ARG 54 39.473 34.616 28.287 390 HD2 ARG 54 HD2 ARG 54 37.728 35.016 26.439 391 HD3 ARG 54 HD3 ARG 54 37.106 33.407 26.802 392 HE ARG 54 HE ARG 54 36.462 34.113 28.989 393 HH11 ARG 54 HH11 ARG 54 38.033 36.873 27.420 394 HH12 ARG 54 HH12 ARG 54 37.526 37.886 28.776 395 HH21 ARG 54 HH21 ARG 54 35.583 35.626 30.318 396 HH22 ARG 54 HH22 ARG 54 36.236 37.266 30.233 397 H HIS 55 H HIS 55 41.493 30.843 25.224 398 HA HIS 55 HA HIS 55 42.094 31.931 22.514 399 HB2 HIS 55 HB2 HIS 55 43.303 32.903 24.574 400 HB3 HIS 55 HB3 HIS 55 44.169 31.383 24.636 401 HD1 HIS 55 HD1 HIS 55 43.775 34.597 22.620 402 HD2 HIS 55 HD2 HIS 55 45.948 30.991 22.513 403 HE1 HIS 55 HE1 HIS 55 45.519 34.850 20.755 404 H GLY 56 H GLY 56 41.473 29.057 24.167 405 HA2 GLY 56 HA2 GLY 56 41.310 26.940 23.339 406 HA3 GLY 56 HA3 GLY 56 41.773 27.581 21.770 407 H VAL 57 H VAL 57 43.834 27.484 24.727 408 HA VAL 57 HA VAL 57 45.643 25.521 23.392 409 HB VAL 57 HB VAL 57 47.607 26.859 24.038 410 HG11 VAL 57 HG11 VAL 57 45.766 28.191 22.034 411 HG12 VAL 57 HG12 VAL 57 47.538 28.330 22.108 412 HG13 VAL 57 HG13 VAL 57 46.789 26.766 21.740 413 HG21 VAL 57 HG21 VAL 57 45.649 29.162 24.407 414 HG22 VAL 57 HG22 VAL 57 46.595 28.368 25.690 415 HG23 VAL 57 HG23 VAL 57 47.424 29.263 24.408 416 H ASP 58 H ASP 58 47.265 24.571 24.721 417 HA ASP 58 HA ASP 58 46.345 24.231 27.530 418 HB2 ASP 58 HB2 ASP 58 45.707 22.409 25.996 419 HB3 ASP 58 HB3 ASP 58 47.392 22.185 25.539 420 H LEU 59 H LEU 59 47.818 24.402 29.102 421 HA LEU 59 HA LEU 59 50.704 24.796 28.398 422 HB2 LEU 59 HB2 LEU 59 48.818 26.350 30.158 423 HB3 LEU 59 HB3 LEU 59 50.544 26.338 30.480 424 HG LEU 59 HG LEU 59 51.065 27.292 28.344 425 HD11 LEU 59 HD11 LEU 59 49.248 28.286 26.915 426 HD12 LEU 59 HD12 LEU 59 48.085 27.228 27.762 427 HD13 LEU 59 HD13 LEU 59 49.414 26.546 26.798 428 HD21 LEU 59 HD21 LEU 59 48.816 28.722 29.835 429 HD22 LEU 59 HD22 LEU 59 50.044 29.505 28.815 430 HD23 LEU 59 HD23 LEU 59 50.516 28.684 30.311 431 HA PRO 60 HA PRO 60 50.347 21.309 31.424 432 HB2 PRO 60 HB2 PRO 60 52.128 19.583 30.271 433 HB3 PRO 60 HB3 PRO 60 50.445 19.799 29.694 434 HG2 PRO 60 HG2 PRO 60 52.941 21.156 28.625 435 HG3 PRO 60 HG3 PRO 60 51.712 20.239 27.703 436 HD2 PRO 60 HD2 PRO 60 51.545 22.902 27.865 437 HD3 PRO 60 HD3 PRO 60 50.070 21.905 28.042 438 H LEU 61 H LEU 61 51.724 20.481 33.017 439 HA LEU 61 HA LEU 61 53.897 22.034 33.992 440 HB2 LEU 61 HB2 LEU 61 53.184 19.121 34.474 441 HB3 LEU 61 HB3 LEU 61 54.334 20.039 35.429 442 HG LEU 61 HG LEU 61 51.341 20.564 35.235 443 HD11 LEU 61 HD11 LEU 61 51.312 19.876 37.552 444 HD12 LEU 61 HD12 LEU 61 53.083 19.698 37.573 445 HD13 LEU 61 HD13 LEU 61 52.083 18.604 36.597 446 HD21 LEU 61 HD21 LEU 61 51.676 22.226 37.018 447 HD22 LEU 61 HD22 LEU 61 52.468 22.720 35.526 448 HD23 LEU 61 HD23 LEU 61 53.437 22.049 36.864 449 H ARG 62 H ARG 62 53.838 19.588 31.559 450 HA ARG 62 HA ARG 62 56.663 19.071 31.224 451 HB2 ARG 62 HB2 ARG 62 54.336 19.015 29.256 452 HB3 ARG 62 HB3 ARG 62 55.958 18.447 28.880 453 HG2 ARG 62 HG2 ARG 62 55.806 16.622 30.386 454 HG3 ARG 62 HG3 ARG 62 54.392 17.291 31.214 455 HD2 ARG 62 HD2 ARG 62 53.037 17.058 29.203 456 HD3 ARG 62 HD3 ARG 62 54.414 16.461 28.293 457 HE ARG 62 HE ARG 62 52.862 15.032 30.408 458 HH11 ARG 62 HH11 ARG 62 55.643 14.749 28.228 459 HH12 ARG 62 HH12 ARG 62 55.529 13.006 28.252 460 HH21 ARG 62 HH21 ARG 62 53.006 12.984 30.601 461 HH22 ARG 62 HH22 ARG 62 54.293 12.054 29.829 462 H CYS 63 H CYS 63 54.508 21.546 29.671 463 HA CYS 63 HA CYS 63 56.751 22.634 28.188 464 HB2 CYS 63 HB2 CYS 63 55.369 24.163 27.205 465 HB3 CYS 63 HB3 CYS 63 54.336 22.749 27.419 466 HG CYS 63 HG CYS 63 53.336 23.673 29.807 467 H LEU 64 H LEU 64 55.164 23.373 31.278 468 HA LEU 64 HA LEU 64 56.733 25.638 32.010 469 HB2 LEU 64 HB2 LEU 64 54.688 24.781 33.114 470 HB3 LEU 64 HB3 LEU 64 55.548 23.367 33.640 471 HG LEU 64 HG LEU 64 56.966 24.587 35.149 472 HD11 LEU 64 HD11 LEU 64 57.219 26.712 33.965 473 HD12 LEU 64 HD12 LEU 64 56.663 26.974 35.605 474 HD13 LEU 64 HD13 LEU 64 55.508 27.106 34.247 475 HD21 LEU 64 HD21 LEU 64 55.282 25.336 36.755 476 HD22 LEU 64 HD22 LEU 64 54.730 23.878 35.925 477 HD23 LEU 64 HD23 LEU 64 54.069 25.461 35.463 478 H TYR 65 H TYR 65 57.429 22.129 32.387 479 HA TYR 65 HA TYR 65 59.934 22.435 33.720 480 HB2 TYR 65 HB2 TYR 65 58.818 20.369 33.823 481 HB3 TYR 65 HB3 TYR 65 58.689 20.236 32.083 482 HD1 TYR 65 HD1 TYR 65 60.235 18.974 30.866 483 HD2 TYR 65 HD2 TYR 65 61.287 20.367 34.814 484 HE1 TYR 65 HE1 TYR 65 62.277 17.588 30.809 485 HE2 TYR 65 HE2 TYR 65 63.354 18.969 34.744 486 HH TYR 65 HH TYR 65 64.141 16.906 31.907 487 H GLU 66 H GLU 66 59.163 22.240 30.194 488 HA GLU 66 HA GLU 66 62.039 22.401 29.561 489 HB2 GLU 66 HB2 GLU 66 61.511 22.075 27.320 490 HB3 GLU 66 HB3 GLU 66 60.424 21.051 28.245 491 HG2 GLU 66 HG2 GLU 66 58.740 23.020 27.996 492 HG3 GLU 66 HG3 GLU 66 59.821 23.639 26.761 493 H ALA 67 H ALA 67 59.402 24.744 29.639 494 HA ALA 67 HA ALA 67 61.283 26.978 29.162 495 HB1 ALA 67 HB1 ALA 67 59.750 27.863 27.431 496 HB2 ALA 67 HB2 ALA 67 60.465 26.314 26.941 497 HB3 ALA 67 HB3 ALA 67 58.786 26.378 27.521 498 HA PRO 68 HA PRO 68 58.136 27.783 32.417 499 HB2 PRO 68 HB2 PRO 68 59.707 28.716 34.437 500 HB3 PRO 68 HB3 PRO 68 59.626 26.987 34.040 501 HG2 PRO 68 HG2 PRO 68 61.706 28.995 33.111 502 HG3 PRO 68 HG3 PRO 68 61.979 27.385 33.856 503 HD2 PRO 68 HD2 PRO 68 62.012 27.765 31.155 504 HD3 PRO 68 HD3 PRO 68 61.365 26.260 31.875 505 H THR 69 H THR 69 60.169 29.901 30.670 506 HA THR 69 HA THR 69 59.218 32.405 31.848 507 HB THR 69 HB THR 69 60.576 33.175 29.644 508 HG1 THR 69 HG1 THR 69 62.068 31.839 29.065 509 HG21 THR 69 HG21 THR 69 61.163 33.565 32.045 510 HG22 THR 69 HG22 THR 69 62.571 33.203 31.034 511 HG23 THR 69 HG23 THR 69 61.897 31.955 32.114 512 H VAL 70 H VAL 70 57.564 33.635 31.125 513 HA VAL 70 HA VAL 70 55.530 32.326 29.802 514 HB VAL 70 HB VAL 70 55.207 34.169 31.333 515 HG11 VAL 70 HG11 VAL 70 55.960 36.051 29.059 516 HG12 VAL 70 HG12 VAL 70 55.279 36.511 30.629 517 HG13 VAL 70 HG13 VAL 70 56.881 35.785 30.560 518 HG21 VAL 70 HG21 VAL 70 53.359 33.452 29.844 519 HG22 VAL 70 HG22 VAL 70 53.245 35.152 30.315 520 HG23 VAL 70 HG23 VAL 70 53.813 34.726 28.687 521 H ALA 71 H ALA 71 57.821 34.558 28.155 522 HA ALA 71 HA ALA 71 56.373 34.357 25.641 523 HB1 ALA 71 HB1 ALA 71 59.218 35.251 26.211 524 HB2 ALA 71 HB2 ALA 71 58.274 35.539 24.734 525 HB3 ALA 71 HB3 ALA 71 57.769 36.287 26.260 526 H ARG 72 H ARG 72 59.034 32.474 27.062 527 HA ARG 72 HA ARG 72 59.679 31.023 24.599 528 HB2 ARG 72 HB2 ARG 72 61.184 31.665 26.577 529 HB3 ARG 72 HB3 ARG 72 60.445 30.326 27.464 530 HG2 ARG 72 HG2 ARG 72 61.381 28.706 25.930 531 HG3 ARG 72 HG3 ARG 72 61.768 29.968 24.757 532 HD2 ARG 72 HD2 ARG 72 63.848 29.489 25.740 533 HD3 ARG 72 HD3 ARG 72 63.301 31.005 26.475 534 HE ARG 72 HE ARG 72 63.492 30.041 28.516 535 HH11 ARG 72 HH11 ARG 72 63.097 27.293 26.325 536 HH12 ARG 72 HH12 ARG 72 63.309 26.172 27.647 537 HH21 ARG 72 HH21 ARG 72 64.154 28.595 29.911 538 HH22 ARG 72 HH22 ARG 72 64.221 26.884 29.498 539 H LEU 73 H LEU 73 57.777 30.488 27.465 540 HA LEU 73 HA LEU 73 56.623 27.941 26.980 541 HB2 LEU 73 HB2 LEU 73 56.553 29.268 29.027 542 HB3 LEU 73 HB3 LEU 73 55.542 30.457 28.286 543 HG LEU 73 HG LEU 73 54.424 27.715 28.059 544 HD11 LEU 73 HD11 LEU 73 53.749 27.535 30.423 545 HD12 LEU 73 HD12 LEU 73 54.763 28.945 30.828 546 HD13 LEU 73 HD13 LEU 73 55.505 27.438 30.253 547 HD21 LEU 73 HD21 LEU 73 52.437 28.917 28.921 548 HD22 LEU 73 HD22 LEU 73 53.149 29.759 27.539 549 HD23 LEU 73 HD23 LEU 73 53.406 30.366 29.193 550 H ALA 74 H ALA 74 55.471 31.280 26.032 551 HA ALA 74 HA ALA 74 53.430 30.360 24.343 552 HB1 ALA 74 HB1 ALA 74 53.755 32.739 25.084 553 HB2 ALA 74 HB2 ALA 74 55.073 32.890 23.910 554 HB3 ALA 74 HB3 ALA 74 53.434 32.566 23.347 555 H GLU 75 H GLU 75 56.927 30.798 23.518 556 HA GLU 75 HA GLU 75 56.646 30.107 20.751 557 HB2 GLU 75 HB2 GLU 75 59.034 29.725 22.599 558 HB3 GLU 75 HB3 GLU 75 59.043 29.360 20.879 559 HG2 GLU 75 HG2 GLU 75 58.390 31.746 20.415 560 HG3 GLU 75 HG3 GLU 75 58.616 32.094 22.129 561 H THR 76 H THR 76 57.258 27.862 23.552 562 HA THR 76 HA THR 76 57.250 25.556 21.787 563 HB THR 76 HB THR 76 58.326 25.374 23.960 564 HG1 THR 76 HG1 THR 76 57.775 23.363 24.255 565 HG21 THR 76 HG21 THR 76 56.917 26.637 25.398 566 HG22 THR 76 HG22 THR 76 57.090 24.996 26.007 567 HG23 THR 76 HG23 THR 76 55.572 25.485 25.203 568 H ILE 77 H ILE 77 54.552 27.265 23.414 569 HA ILE 77 HA ILE 77 52.641 25.223 22.545 570 HB ILE 77 HB ILE 77 52.176 27.989 23.672 571 HG12 ILE 77 HG12 ILE 77 53.251 26.637 25.357 572 HG13 ILE 77 HG13 ILE 77 51.556 26.732 25.750 573 HG21 ILE 77 HG21 ILE 77 49.882 27.141 24.190 574 HG22 ILE 77 HG22 ILE 77 50.173 27.326 22.461 575 HG23 ILE 77 HG23 ILE 77 50.197 25.708 23.197 576 HD11 ILE 77 HD11 ILE 77 52.288 24.497 26.178 577 HD12 ILE 77 HD12 ILE 77 51.308 24.398 24.705 578 HD13 ILE 77 HD13 ILE 77 53.081 24.361 24.605 579 H VAL 78 H VAL 78 53.763 28.268 21.075 580 HA VAL 78 HA VAL 78 51.890 28.139 18.853 581 HB VAL 78 HB VAL 78 54.509 29.601 19.284 582 HG11 VAL 78 HG11 VAL 78 52.658 29.800 16.866 583 HG12 VAL 78 HG12 VAL 78 53.970 30.929 17.258 584 HG13 VAL 78 HG13 VAL 78 54.355 29.258 16.858 585 HG21 VAL 78 HG21 VAL 78 51.624 30.584 18.994 586 HG22 VAL 78 HG22 VAL 78 52.456 30.371 20.543 587 HG23 VAL 78 HG23 VAL 78 53.049 31.568 19.390 588 H ARG 79 H ARG 79 55.235 26.890 19.298 589 HA ARG 79 HA ARG 79 55.205 25.740 16.600 590 HB2 ARG 79 HB2 ARG 79 57.165 26.876 17.373 591 HB3 ARG 79 HB3 ARG 79 57.312 25.799 18.747 592 HG2 ARG 79 HG2 ARG 79 58.910 25.174 17.107 593 HG3 ARG 79 HG3 ARG 79 57.743 23.878 17.206 594 HD2 ARG 79 HD2 ARG 79 57.674 26.066 15.084 595 HD3 ARG 79 HD3 ARG 79 58.668 24.620 14.914 596 HE ARG 79 HE ARG 79 56.067 23.670 15.395 597 HH11 ARG 79 HH11 ARG 79 57.576 25.678 12.904 598 HH12 ARG 79 HH12 ARG 79 56.492 25.019 11.676 599 HH21 ARG 79 HH21 ARG 79 54.800 22.887 13.635 600 HH22 ARG 79 HH22 ARG 79 55.113 23.587 12.050 601 H LEU 80 H LEU 80 55.548 24.210 19.855 602 HA LEU 80 HA LEU 80 55.565 21.596 18.461 603 HB2 LEU 80 HB2 LEU 80 56.411 22.367 21.275 604 HB3 LEU 80 HB3 LEU 80 56.409 20.736 20.647 605 HG LEU 80 HG LEU 80 57.872 22.010 18.692 606 HD11 LEU 80 HD11 LEU 80 57.939 24.107 20.051 607 HD12 LEU 80 HD12 LEU 80 59.541 23.378 19.872 608 HD13 LEU 80 HD13 LEU 80 58.658 23.199 21.395 609 HD21 LEU 80 HD21 LEU 80 58.425 19.868 19.818 610 HD22 LEU 80 HD22 LEU 80 58.967 20.772 21.251 611 HD23 LEU 80 HD23 LEU 80 59.818 20.948 19.704 612 H ALA 81 H ALA 81 53.101 23.306 20.042 613 HA ALA 81 HA ALA 81 51.988 21.005 21.433 614 HB1 ALA 81 HB1 ALA 81 50.172 22.460 22.074 615 HB2 ALA 81 HB2 ALA 81 51.733 23.234 22.357 616 HB3 ALA 81 HB3 ALA 81 50.732 23.717 20.962 617 H ALA 82 H ALA 82 52.394 20.095 18.963 618 HA ALA 82 HA ALA 82 49.808 19.711 17.625 619 HB1 ALA 82 HB1 ALA 82 51.005 17.884 16.487 620 HB2 ALA 82 HB2 ALA 82 51.920 19.398 16.395 621 HB3 ALA 82 HB3 ALA 82 52.411 18.129 17.541 622 HA PRO 83 HA PRO 83 48.556 16.513 20.643 623 HB2 PRO 83 HB2 PRO 83 46.913 14.957 19.090 624 HB3 PRO 83 HB3 PRO 83 46.409 16.519 19.803 625 HG2 PRO 83 HG2 PRO 83 47.348 15.963 16.993 626 HG3 PRO 83 HG3 PRO 83 45.994 16.999 17.528 627 HD2 PRO 83 HD2 PRO 83 48.493 17.966 16.864 628 HD3 PRO 83 HD3 PRO 83 47.429 18.770 18.061 629 H ALA 84 H ALA 84 49.320 14.508 21.078 630 HA ALA 84 HA ALA 84 51.886 13.992 20.283 631 HB1 ALA 84 HB1 ALA 84 50.916 13.383 22.423 632 HB2 ALA 84 HB2 ALA 84 49.902 12.141 21.651 633 HB3 ALA 84 HB3 ALA 84 51.668 11.970 21.673 634 HA PRO 85 HA PRO 85 50.755 11.977 16.428 635 HB2 PRO 85 HB2 PRO 85 53.687 12.114 15.793 636 HB3 PRO 85 HB3 PRO 85 52.285 12.653 14.816 637 HG2 PRO 85 HG2 PRO 85 53.772 14.486 16.117 638 HG3 PRO 85 HG3 PRO 85 51.974 14.598 16.216 639 HD2 PRO 85 HD2 PRO 85 53.838 13.283 18.209 640 HD3 PRO 85 HD3 PRO 85 52.615 14.568 18.476 641 H SER 86 H SER 86 50.965 10.042 15.322 642 HA SER 86 HA SER 86 51.005 7.835 15.097 643 HB2 SER 86 HB2 SER 86 53.395 8.026 14.816 644 HB3 SER 86 HB3 SER 86 53.644 7.889 16.567 645 HG SER 86 HG SER 86 53.767 5.925 15.108 646 H GLY 87 H GLY 87 50.191 6.028 15.943 647 HA2 GLY 87 HA2 GLY 87 49.420 5.970 18.828 648 HA3 GLY 87 HA3 GLY 87 48.707 5.038 17.507 649 H ASP 88 H ASP 88 51.827 4.807 16.721 650 HA ASP 88 HA ASP 88 52.234 2.248 18.077 651 HB2 ASP 88 HB2 ASP 88 53.324 3.617 15.683 652 HB3 ASP 88 HB3 ASP 88 54.529 2.775 16.649 653 H GLN 89 H GLN 89 53.850 1.835 19.639 654 HA GLN 89 HA GLN 89 55.204 4.168 20.835 655 HB2 GLN 89 HB2 GLN 89 54.044 3.947 22.971 656 HB3 GLN 89 HB3 GLN 89 52.998 4.413 21.655 657 HG2 GLN 89 HG2 GLN 89 51.716 2.935 22.902 658 HG3 GLN 89 HG3 GLN 89 52.223 1.979 21.527 659 HE21 GLN 89 HE21 GLN 89 52.656 -0.107 22.195 660 HE22 GLN 89 HE22 GLN 89 53.223 -0.533 23.809 661 H ASP 90 H ASP 90 56.791 3.824 22.311 662 HA ASP 90 HA ASP 90 58.115 1.240 21.914 663 HB2 ASP 90 HB2 ASP 90 60.148 2.393 22.261 664 HB3 ASP 90 HB3 ASP 90 59.141 3.300 21.142 665 H ASP 91 H ASP 91 59.679 0.440 23.538 666 HA ASP 91 HA ASP 91 60.438 -0.266 25.500 667 HB2 ASP 91 HB2 ASP 91 60.537 2.146 26.049 668 HB3 ASP 91 HB3 ASP 91 58.964 2.012 26.840 669 H ALA 92 H ALA 92 57.891 -1.062 24.320 670 HA ALA 92 HA ALA 92 56.059 -1.989 26.322 671 HB1 ALA 92 HB1 ALA 92 56.675 -3.152 23.577 672 HB2 ALA 92 HB2 ALA 92 55.241 -3.492 24.556 673 HB3 ALA 92 HB3 ALA 92 55.502 -1.854 23.922 674 H SER 93 H SER 93 55.757 -4.052 27.219 675 HA SER 93 HA SER 93 58.126 -5.864 27.295 676 HB2 SER 93 HB2 SER 93 56.516 -5.132 29.754 677 HB3 SER 93 HB3 SER 93 58.034 -6.042 29.667 678 HG SER 93 HG SER 93 57.541 -3.296 29.195 679 H GLU 94 H GLU 94 57.688 -7.987 28.119 680 HA GLU 94 HA GLU 94 54.830 -8.876 28.008 681 HB2 GLU 94 HB2 GLU 94 55.808 -11.187 27.866 682 HB3 GLU 94 HB3 GLU 94 56.001 -10.165 26.441 683 HG2 GLU 94 HG2 GLU 94 58.309 -9.745 26.925 684 HG3 GLU 94 HG3 GLU 94 58.192 -10.488 28.531 685 H TYR 95 H TYR 95 54.024 -10.193 29.634 686 HA TYR 95 HA TYR 95 55.116 -9.728 32.345 687 HB2 TYR 95 HB2 TYR 95 52.534 -10.914 31.290 688 HB3 TYR 95 HB3 TYR 95 52.958 -10.865 32.991 689 HD1 TYR 95 HD1 TYR 95 51.781 -8.844 30.129 690 HD2 TYR 95 HD2 TYR 95 53.127 -8.733 34.224 691 HE1 TYR 95 HE1 TYR 95 50.789 -6.565 30.414 692 HE2 TYR 95 HE2 TYR 95 52.103 -6.499 34.507 693 HH TYR 95 HH TYR 95 50.933 -4.789 33.526 694 H GLU 96 H GLU 96 54.959 -11.764 33.865 695 HA GLU 96 HA GLU 96 57.078 -13.424 33.082 696 HB2 GLU 96 HB2 GLU 96 55.038 -14.104 35.226 697 HB3 GLU 96 HB3 GLU 96 56.671 -14.735 35.052 698 HG2 GLU 96 HG2 GLU 96 57.133 -13.192 36.618 699 HG3 GLU 96 HG3 GLU 96 57.326 -12.131 35.221 700 H GLU 97 H GLU 97 57.339 -15.240 31.978 701 HA GLU 97 HA GLU 97 54.946 -16.595 30.785 702 HB2 GLU 97 HB2 GLU 97 56.716 -15.446 29.332 703 HB3 GLU 97 HB3 GLU 97 57.845 -16.691 29.856 704 HG2 GLU 97 HG2 GLU 97 56.254 -18.438 28.948 705 HG3 GLU 97 HG3 GLU 97 55.230 -17.134 28.345 706 H GLY 98 H GLY 98 58.015 -17.222 32.465 707 HA2 GLY 98 HA2 GLY 98 57.814 -20.132 32.209 708 HA3 GLY 98 HA3 GLY 98 59.118 -19.207 32.953 709 H VAL 99 H VAL 99 55.928 -18.491 34.081 710 HA VAL 99 HA VAL 99 56.571 -18.719 36.753 711 HB VAL 99 HB VAL 99 54.118 -18.596 37.214 712 HG11 VAL 99 HG11 VAL 99 53.867 -16.365 36.274 713 HG12 VAL 99 HG12 VAL 99 55.527 -16.596 36.838 714 HG13 VAL 99 HG13 VAL 99 55.158 -16.672 35.097 715 HG21 VAL 99 HG21 VAL 99 52.566 -18.254 35.366 716 HG22 VAL 99 HG22 VAL 99 53.831 -18.564 34.169 717 HG23 VAL 99 HG23 VAL 99 53.278 -19.868 35.243 718 H ILE 100 H ILE 100 56.100 -19.947 38.446 719 HA ILE 100 HA ILE 100 55.491 -22.824 38.054 720 HB ILE 100 HB ILE 100 57.958 -22.296 38.307 721 HG12 ILE 100 HG12 ILE 100 58.443 -23.994 40.083 722 HG13 ILE 100 HG13 ILE 100 56.722 -24.074 40.445 723 HG21 ILE 100 HG21 ILE 100 57.264 -21.622 41.199 724 HG22 ILE 100 HG22 ILE 100 58.870 -21.689 40.468 725 HG23 ILE 100 HG23 ILE 100 57.735 -20.436 39.962 726 HD11 ILE 100 HD11 ILE 100 58.029 -24.690 37.756 727 HD12 ILE 100 HD12 ILE 100 57.476 -25.893 38.925 728 HD13 ILE 100 HD13 ILE 100 56.295 -24.854 38.110 729 H ARG 101 H ARG 101 54.459 -23.874 39.775 730 HA ARG 101 HA ARG 101 52.562 -24.035 40.934 731 HB2 ARG 101 HB2 ARG 101 54.248 -23.707 42.738 732 HB3 ARG 101 HB3 ARG 101 53.749 -22.012 42.846 733 HG2 ARG 101 HG2 ARG 101 51.429 -22.734 43.353 734 HG3 ARG 101 HG3 ARG 101 51.905 -24.428 43.203 735 HD2 ARG 101 HD2 ARG 101 53.158 -22.506 45.204 736 HD3 ARG 101 HD3 ARG 101 51.708 -23.460 45.549 737 HE ARG 101 HE ARG 101 53.808 -25.200 44.645 738 HH11 ARG 101 HH11 ARG 101 52.761 -23.430 47.506 739 HH12 ARG 101 HH12 ARG 101 53.415 -24.633 48.597 740 HH21 ARG 101 HH21 ARG 101 54.731 -26.586 46.095 741 HH22 ARG 101 HH22 ARG 101 54.549 -26.314 47.816 Start of MODEL 19 1 H GLY 1 H1 GLY 1 49.748 55.333 47.170 2 HA2 GLY 1 HA2 GLY 1 52.629 55.891 46.964 3 HA3 GLY 1 HA3 GLY 1 51.749 54.579 46.163 4 H ALA 2 H ALA 2 53.282 56.274 44.707 5 HA ALA 2 HA ALA 2 51.456 58.171 43.295 6 HB1 ALA 2 HB1 ALA 2 54.492 58.210 43.559 7 HB2 ALA 2 HB2 ALA 2 53.478 59.453 42.806 8 HB3 ALA 2 HB3 ALA 2 53.372 59.167 44.550 9 H ALA 3 H ALA 3 52.494 55.130 42.832 10 HA ALA 3 HA ALA 3 52.872 53.726 41.151 11 HB1 ALA 3 HB1 ALA 3 52.194 54.155 38.900 12 HB2 ALA 3 HB2 ALA 3 51.029 54.944 39.981 13 HB3 ALA 3 HB3 ALA 3 52.254 55.907 39.136 14 H ALA 4 H ALA 4 54.440 53.110 39.453 15 HA ALA 4 HA ALA 4 57.055 54.288 40.015 16 HB1 ALA 4 HB1 ALA 4 56.229 52.075 38.094 17 HB2 ALA 4 HB2 ALA 4 57.894 52.501 38.547 18 HB3 ALA 4 HB3 ALA 4 56.787 51.866 39.774 19 H GLY 5 H GLY 5 58.462 55.279 38.550 20 HA2 GLY 5 HA2 GLY 5 57.337 57.324 36.979 21 HA3 GLY 5 HA3 GLY 5 59.032 56.838 36.967 22 H VAL 6 H VAL 6 58.852 54.252 35.861 23 HA VAL 6 HA VAL 6 57.949 54.830 33.079 24 HB VAL 6 HB VAL 6 60.026 53.623 32.378 25 HG11 VAL 6 HG11 VAL 6 61.439 55.593 32.562 26 HG12 VAL 6 HG12 VAL 6 59.768 56.087 32.269 27 HG13 VAL 6 HG13 VAL 6 60.462 56.220 33.901 28 HG21 VAL 6 HG21 VAL 6 61.952 53.533 33.847 29 HG22 VAL 6 HG22 VAL 6 60.999 54.136 35.214 30 HG23 VAL 6 HG23 VAL 6 60.656 52.538 34.519 31 H SER 7 H SER 7 57.187 53.338 31.842 32 HA SER 7 HA SER 7 56.969 50.483 32.737 33 HB2 SER 7 HB2 SER 7 55.059 50.291 31.276 34 HB3 SER 7 HB3 SER 7 54.782 51.640 32.393 35 HG SER 7 HG SER 7 55.295 53.078 30.767 36 H ALA 8 H ALA 8 56.872 48.971 30.726 37 HA ALA 8 HA ALA 8 58.546 49.937 28.478 38 HB1 ALA 8 HB1 ALA 8 59.788 47.805 28.470 39 HB2 ALA 8 HB2 ALA 8 60.068 48.725 29.961 40 HB3 ALA 8 HB3 ALA 8 58.979 47.326 29.974 41 H ALA 9 H ALA 9 58.234 48.793 26.505 42 HA ALA 9 HA ALA 9 56.043 46.888 26.275 43 HB1 ALA 9 HB1 ALA 9 54.769 48.999 26.343 44 HB2 ALA 9 HB2 ALA 9 55.762 49.663 25.027 45 HB3 ALA 9 HB3 ALA 9 54.682 48.281 24.728 46 H GLY 10 H GLY 10 55.929 45.849 24.232 47 HA2 GLY 10 HA2 GLY 10 57.609 46.729 21.984 48 HA3 GLY 10 HA3 GLY 10 58.156 45.240 22.761 49 H ILE 11 H ILE 11 57.778 44.231 20.709 50 HA ILE 11 HA ILE 11 54.964 43.453 20.146 51 HB ILE 11 HB ILE 11 56.218 43.755 18.151 52 HG12 ILE 11 HG12 ILE 11 56.138 41.571 17.068 53 HG13 ILE 11 HG13 ILE 11 56.053 40.749 18.626 54 HG21 ILE 11 HG21 ILE 11 58.317 41.805 19.181 55 HG22 ILE 11 HG22 ILE 11 58.251 42.497 17.562 56 HG23 ILE 11 HG23 ILE 11 58.538 43.557 18.938 57 HD11 ILE 11 HD11 ILE 11 53.830 41.696 19.034 58 HD12 ILE 11 HD12 ILE 11 53.973 42.716 17.582 59 HD13 ILE 11 HD13 ILE 11 53.863 40.951 17.429 60 H GLU 12 H GLU 12 54.101 41.735 21.183 61 HA GLU 12 HA GLU 12 55.866 39.850 22.640 62 HB2 GLU 12 HB2 GLU 12 55.419 42.055 23.947 63 HB3 GLU 12 HB3 GLU 12 53.742 41.533 24.025 64 HG2 GLU 12 HG2 GLU 12 54.641 40.888 26.064 65 HG3 GLU 12 HG3 GLU 12 54.633 39.385 25.156 66 HA PRO 13 HA PRO 13 52.498 37.182 21.498 67 HB2 PRO 13 HB2 PRO 13 52.838 35.042 23.208 68 HB3 PRO 13 HB3 PRO 13 53.792 35.345 21.723 69 HG2 PRO 13 HG2 PRO 13 54.514 36.019 24.581 70 HG3 PRO 13 HG3 PRO 13 55.547 35.302 23.294 71 HD2 PRO 13 HD2 PRO 13 55.672 37.932 23.911 72 HD3 PRO 13 HD3 PRO 13 55.828 37.374 22.230 73 H ASP 14 H ASP 14 50.435 36.632 22.070 74 HA ASP 14 HA ASP 14 49.319 38.593 23.878 75 HB2 ASP 14 HB2 ASP 14 47.962 36.440 22.218 76 HB3 ASP 14 HB3 ASP 14 47.153 37.797 23.009 77 H LEU 15 H LEU 15 50.126 35.272 24.352 78 HA LEU 15 HA LEU 15 48.483 34.651 26.606 79 HB2 LEU 15 HB2 LEU 15 51.385 33.963 25.952 80 HB3 LEU 15 HB3 LEU 15 50.569 33.425 27.415 81 HG LEU 15 HG LEU 15 48.800 32.325 25.980 82 HD11 LEU 15 HD11 LEU 15 49.518 31.679 23.663 83 HD12 LEU 15 HD12 LEU 15 50.820 32.879 23.756 84 HD13 LEU 15 HD13 LEU 15 49.111 33.378 23.801 85 HD21 LEU 15 HD21 LEU 15 51.688 31.402 25.746 86 HD22 LEU 15 HD22 LEU 15 50.264 30.377 25.474 87 HD23 LEU 15 HD23 LEU 15 50.565 31.060 27.078 88 H THR 16 H THR 16 51.310 36.861 26.334 89 HA THR 16 HA THR 16 51.500 37.369 29.184 90 HB THR 16 HB THR 16 52.762 39.349 28.646 91 HG1 THR 16 HG1 THR 16 52.230 38.837 25.906 92 HG21 THR 16 HG21 THR 16 53.574 37.113 26.743 93 HG22 THR 16 HG22 THR 16 53.947 37.206 28.480 94 HG23 THR 16 HG23 THR 16 54.606 38.413 27.378 95 H ALA 17 H ALA 17 49.581 38.893 26.574 96 HA ALA 17 HA ALA 17 48.541 41.046 28.157 97 HB1 ALA 17 HB1 ALA 17 47.424 39.703 25.657 98 HB2 ALA 17 HB2 ALA 17 46.943 41.269 26.313 99 HB3 ALA 17 HB3 ALA 17 48.589 41.047 25.697 100 H ILE 18 H ILE 18 47.302 37.778 27.403 101 HA ILE 18 HA ILE 18 44.890 38.002 28.946 102 HB ILE 18 HB ILE 18 46.451 35.553 28.046 103 HG12 ILE 18 HG12 ILE 18 43.945 36.710 26.759 104 HG13 ILE 18 HG13 ILE 18 45.541 37.225 26.249 105 HG21 ILE 18 HG21 ILE 18 44.937 34.872 29.808 106 HG22 ILE 18 HG22 ILE 18 43.615 35.855 29.139 107 HG23 ILE 18 HG23 ILE 18 44.176 34.405 28.292 108 HD11 ILE 18 HD11 ILE 18 44.867 35.526 24.748 109 HD12 ILE 18 HD12 ILE 18 46.142 34.831 25.765 110 HD13 ILE 18 HD13 ILE 18 44.437 34.412 26.055 111 H TRP 19 H TRP 19 48.145 36.665 29.807 112 HA TRP 19 HA TRP 19 47.475 35.865 32.474 113 HB2 TRP 19 HB2 TRP 19 50.077 36.740 31.177 114 HB3 TRP 19 HB3 TRP 19 49.973 36.310 32.872 115 HD1 TRP 19 HD1 TRP 19 48.202 34.239 30.167 116 HE1 TRP 19 HE1 TRP 19 49.272 31.920 30.049 117 HE3 TRP 19 HE3 TRP 19 52.035 34.945 33.482 118 HZ2 TRP 19 HZ2 TRP 19 51.508 30.533 31.231 119 HZ3 TRP 19 HZ3 TRP 19 53.623 33.102 33.968 120 HH2 TRP 19 HH2 TRP 19 53.375 30.895 32.843 121 H GLN 20 H GLN 20 48.789 39.039 31.290 122 HA GLN 20 HA GLN 20 48.717 40.100 33.969 123 HB2 GLN 20 HB2 GLN 20 49.561 42.092 33.136 124 HB3 GLN 20 HB3 GLN 20 50.255 40.836 32.136 125 HG2 GLN 20 HG2 GLN 20 48.305 41.405 30.490 126 HG3 GLN 20 HG3 GLN 20 48.114 42.878 31.445 127 HE21 GLN 20 HE21 GLN 20 50.471 40.936 29.611 128 HE22 GLN 20 HE22 GLN 20 51.370 42.310 28.974 129 H ALA 21 H ALA 21 46.241 40.130 31.357 130 HA ALA 21 HA ALA 21 44.412 41.844 32.759 131 HB1 ALA 21 HB1 ALA 21 42.703 40.708 31.363 132 HB2 ALA 21 HB2 ALA 21 44.095 41.236 30.409 133 HB3 ALA 21 HB3 ALA 21 43.913 39.522 30.839 134 H LEU 22 H LEU 22 44.845 38.269 32.880 135 HA LEU 22 HA LEU 22 42.677 37.793 34.702 136 HB2 LEU 22 HB2 LEU 22 45.078 36.193 33.722 137 HB3 LEU 22 HB3 LEU 22 43.976 35.527 34.916 138 HG LEU 22 HG LEU 22 43.043 36.489 32.175 139 HD11 LEU 22 HD11 LEU 22 43.596 33.664 33.178 140 HD12 LEU 22 HD12 LEU 22 44.624 34.555 32.045 141 HD13 LEU 22 HD13 LEU 22 42.970 34.116 31.576 142 HD21 LEU 22 HD21 LEU 22 41.750 34.806 34.374 143 HD22 LEU 22 HD22 LEU 22 41.064 35.095 32.757 144 HD23 LEU 22 HD23 LEU 22 41.251 36.433 33.878 145 H PHE 23 H PHE 23 46.136 38.343 35.230 146 HA PHE 23 HA PHE 23 45.725 38.007 38.120 147 HB2 PHE 23 HB2 PHE 23 47.621 36.981 36.758 148 HB3 PHE 23 HB3 PHE 23 48.323 38.578 36.688 149 HD1 PHE 23 HD1 PHE 23 46.834 38.190 39.979 150 HD2 PHE 23 HD2 PHE 23 50.141 36.856 37.543 151 HE1 PHE 23 HE1 PHE 23 48.042 37.483 41.999 152 HE2 PHE 23 HE2 PHE 23 51.341 36.143 39.594 153 HZ PHE 23 HZ PHE 23 50.302 36.469 41.827 154 H ALA 24 H ALA 24 44.973 40.441 36.187 155 HA ALA 24 HA ALA 24 44.776 42.659 36.251 156 HB1 ALA 24 HB1 ALA 24 44.137 43.627 38.412 157 HB2 ALA 24 HB2 ALA 24 43.417 42.022 38.186 158 HB3 ALA 24 HB3 ALA 24 44.819 42.228 39.259 159 H LEU 25 H LEU 25 47.462 41.928 35.818 160 HA LEU 25 HA LEU 25 49.169 43.689 37.478 161 HB2 LEU 25 HB2 LEU 25 49.843 41.677 35.312 162 HB3 LEU 25 HB3 LEU 25 51.026 42.594 36.224 163 HG LEU 25 HG LEU 25 49.096 40.576 37.427 164 HD11 LEU 25 HD11 LEU 25 51.161 39.184 37.637 165 HD12 LEU 25 HD12 LEU 25 52.035 40.391 36.681 166 HD13 LEU 25 HD13 LEU 25 50.694 39.486 35.952 167 HD21 LEU 25 HD21 LEU 25 51.497 42.006 38.628 168 HD22 LEU 25 HD22 LEU 25 50.570 40.707 39.409 169 HD23 LEU 25 HD23 LEU 25 49.797 42.257 39.087 170 HA PRO 26 HA PRO 26 49.591 46.655 34.060 171 HB2 PRO 26 HB2 PRO 26 51.734 48.093 34.898 172 HB3 PRO 26 HB3 PRO 26 50.129 48.208 35.674 173 HG2 PRO 26 HG2 PRO 26 52.485 46.510 36.563 174 HG3 PRO 26 HG3 PRO 26 51.508 47.643 37.553 175 HD2 PRO 26 HD2 PRO 26 51.010 44.966 37.508 176 HD3 PRO 26 HD3 PRO 26 49.677 46.152 37.595 177 H ALA 27 H ALA 27 52.098 44.336 34.989 178 HA ALA 27 HA ALA 27 52.786 43.943 32.180 179 HB1 ALA 27 HB1 ALA 27 55.172 44.413 32.427 180 HB2 ALA 27 HB2 ALA 27 54.264 45.857 32.868 181 HB3 ALA 27 HB3 ALA 27 54.952 44.836 34.141 182 H VAL 28 H VAL 28 54.009 42.003 31.748 183 HA VAL 28 HA VAL 28 54.713 40.290 34.033 184 HB VAL 28 HB VAL 28 52.345 39.787 33.571 185 HG11 VAL 28 HG11 VAL 28 51.623 38.584 31.629 186 HG12 VAL 28 HG12 VAL 28 52.373 40.094 31.079 187 HG13 VAL 28 HG13 VAL 28 53.259 38.563 30.943 188 HG21 VAL 28 HG21 VAL 28 53.825 38.098 34.577 189 HG22 VAL 28 HG22 VAL 28 52.540 37.379 33.596 190 HG23 VAL 28 HG23 VAL 28 54.193 37.458 32.953 191 H GLY 29 H GLY 29 56.553 39.267 33.767 192 HA2 GLY 29 HA2 GLY 29 58.112 37.838 32.719 193 HA3 GLY 29 HA3 GLY 29 57.391 38.160 31.148 194 H ARG 30 H ARG 30 59.648 38.422 30.439 195 HA ARG 30 HA ARG 30 61.646 39.382 30.050 196 HB2 ARG 30 HB2 ARG 30 60.213 42.015 30.521 197 HB3 ARG 30 HB3 ARG 30 61.807 41.812 29.776 198 HG2 ARG 30 HG2 ARG 30 60.785 40.335 28.029 199 HG3 ARG 30 HG3 ARG 30 59.187 40.665 28.721 200 HD2 ARG 30 HD2 ARG 30 59.453 43.061 28.240 201 HD3 ARG 30 HD3 ARG 30 61.063 42.743 27.555 202 HE ARG 30 HE ARG 30 58.698 41.303 26.435 203 HH11 ARG 30 HH11 ARG 30 60.753 44.065 25.862 204 HH12 ARG 30 HH12 ARG 30 60.776 43.821 24.126 205 HH21 ARG 30 HH21 ARG 30 58.531 41.202 24.247 206 HH22 ARG 30 HH22 ARG 30 59.376 42.392 23.262 207 H HIS 31 H HIS 31 60.550 39.270 33.083 208 HA HIS 31 HA HIS 31 63.194 38.616 33.812 209 HB2 HIS 31 HB2 HIS 31 62.784 41.141 34.595 210 HB3 HIS 31 HB3 HIS 31 61.840 40.384 35.872 211 HD1 HIS 31 HD1 HIS 31 65.360 39.704 34.322 212 HD2 HIS 31 HD2 HIS 31 63.376 40.139 38.000 213 HE1 HIS 31 HE1 HIS 31 67.118 39.329 36.133 214 H GLN 32 H GLN 32 63.052 37.415 35.966 215 HA GLN 32 HA GLN 32 62.249 35.755 37.246 216 HB2 GLN 32 HB2 GLN 32 59.447 36.844 36.893 217 HB3 GLN 32 HB3 GLN 32 60.059 35.807 38.172 218 HG2 GLN 32 HG2 GLN 32 61.685 37.786 38.704 219 HG3 GLN 32 HG3 GLN 32 60.599 38.759 37.717 220 HE21 GLN 32 HE21 GLN 32 60.606 36.436 40.461 221 HE22 GLN 32 HE22 GLN 32 59.246 37.190 41.311 222 H ASP 33 H ASP 33 60.642 33.866 37.406 223 HA ASP 33 HA ASP 33 59.871 32.809 34.726 224 HB2 ASP 33 HB2 ASP 33 60.892 31.027 36.939 225 HB3 ASP 33 HB3 ASP 33 60.727 30.683 35.226 226 H PHE 34 H PHE 34 57.903 31.687 34.689 227 HA PHE 34 HA PHE 34 55.723 32.234 36.050 228 HB2 PHE 34 HB2 PHE 34 55.449 30.778 34.242 229 HB3 PHE 34 HB3 PHE 34 56.497 29.533 34.898 230 HD1 PHE 34 HD1 PHE 34 53.164 31.182 35.398 231 HD2 PHE 34 HD2 PHE 34 55.700 27.836 36.391 232 HE1 PHE 34 HE1 PHE 34 51.282 30.112 36.599 233 HE2 PHE 34 HE2 PHE 34 53.837 26.808 37.656 234 HZ PHE 34 HZ PHE 34 51.622 27.927 37.752 235 H PHE 35 H PHE 35 57.825 29.617 37.367 236 HA PHE 35 HA PHE 35 56.012 28.768 39.310 237 HB2 PHE 35 HB2 PHE 35 59.045 28.631 39.305 238 HB3 PHE 35 HB3 PHE 35 58.001 27.740 40.411 239 HD1 PHE 35 HD1 PHE 35 56.270 26.119 39.484 240 HD2 PHE 35 HD2 PHE 35 59.453 27.753 37.073 241 HE1 PHE 35 HE1 PHE 35 55.915 24.332 37.795 242 HE2 PHE 35 HE2 PHE 35 59.078 25.962 35.385 243 HZ PHE 35 HZ PHE 35 57.316 24.259 35.745 244 H ALA 36 H ALA 36 58.120 31.580 39.527 245 HA ALA 36 HA ALA 36 57.007 32.156 42.257 246 HB1 ALA 36 HB1 ALA 36 59.409 33.341 40.824 247 HB2 ALA 36 HB2 ALA 36 58.814 33.789 42.438 248 HB3 ALA 36 HB3 ALA 36 59.451 32.159 42.160 249 H LEU 37 H LEU 37 57.449 33.470 38.963 250 HA LEU 37 HA LEU 37 56.339 36.021 39.250 251 HB2 LEU 37 HB2 LEU 37 57.612 35.160 37.331 252 HB3 LEU 37 HB3 LEU 37 56.325 34.022 36.971 253 HG LEU 37 HG LEU 37 54.819 35.888 36.342 254 HD11 LEU 37 HD11 LEU 37 55.795 38.117 35.972 255 HD12 LEU 37 HD12 LEU 37 57.329 37.583 36.678 256 HD13 LEU 37 HD13 LEU 37 55.869 37.700 37.688 257 HD21 LEU 37 HD21 LEU 37 56.177 34.701 34.652 258 HD22 LEU 37 HD22 LEU 37 57.520 35.834 34.924 259 HD23 LEU 37 HD23 LEU 37 55.993 36.412 34.233 260 H GLY 38 H GLY 38 54.652 32.940 38.951 261 HA2 GLY 38 HA2 GLY 38 51.970 34.111 38.610 262 HA3 GLY 38 HA3 GLY 38 52.389 32.408 38.784 263 H GLY 39 H GLY 39 53.940 33.752 41.361 264 HA2 GLY 39 HA2 GLY 39 53.536 34.083 43.576 265 HA3 GLY 39 HA3 GLY 39 51.861 34.447 43.173 266 H ASP 40 H ASP 40 50.951 31.953 42.240 267 HA ASP 40 HA ASP 40 51.441 29.934 44.351 268 HB2 ASP 40 HB2 ASP 40 49.518 31.772 44.876 269 HB3 ASP 40 HB3 ASP 40 48.569 30.720 43.841 270 H SER 41 H SER 41 50.655 27.806 43.807 271 HA SER 41 HA SER 41 50.252 27.151 41.015 272 HB2 SER 41 HB2 SER 41 49.654 24.905 41.884 273 HB3 SER 41 HB3 SER 41 51.210 25.499 42.487 274 HG SER 41 HG SER 41 49.454 24.530 43.983 275 H GLN 42 H GLN 42 48.001 27.854 43.705 276 HA GLN 42 HA GLN 42 45.585 27.078 42.454 277 HB2 GLN 42 HB2 GLN 42 45.999 27.759 44.833 278 HB3 GLN 42 HB3 GLN 42 46.092 29.443 44.342 279 HG2 GLN 42 HG2 GLN 42 43.696 27.675 43.761 280 HG3 GLN 42 HG3 GLN 42 43.875 28.493 45.298 281 HE21 GLN 42 HE21 GLN 42 41.612 28.994 44.041 282 HE22 GLN 42 HE22 GLN 42 41.617 30.616 43.351 283 H LEU 43 H LEU 43 47.298 30.187 42.361 284 HA LEU 43 HA LEU 43 45.541 31.576 40.581 285 HB2 LEU 43 HB2 LEU 43 47.147 32.595 42.178 286 HB3 LEU 43 HB3 LEU 43 48.494 31.975 41.249 287 HG LEU 43 HG LEU 43 48.112 34.356 40.986 288 HD11 LEU 43 HD11 LEU 43 49.099 32.999 39.066 289 HD12 LEU 43 HD12 LEU 43 48.416 34.578 38.654 290 HD13 LEU 43 HD13 LEU 43 47.510 33.120 38.273 291 HD21 LEU 43 HD21 LEU 43 45.523 33.655 39.536 292 HD22 LEU 43 HD22 LEU 43 46.230 35.270 39.731 293 HD23 LEU 43 HD23 LEU 43 45.640 34.400 41.150 294 H GLY 44 H GLY 44 48.606 29.759 40.049 295 HA2 GLY 44 HA2 GLY 44 48.844 29.987 37.268 296 HA3 GLY 44 HA3 GLY 44 49.338 28.574 38.218 297 H LEU 45 H LEU 45 46.982 27.413 39.032 298 HA LEU 45 HA LEU 45 45.966 26.281 36.574 299 HB2 LEU 45 HB2 LEU 45 45.520 25.818 39.508 300 HB3 LEU 45 HB3 LEU 45 44.278 25.267 38.391 301 HG LEU 45 HG LEU 45 45.917 23.966 37.099 302 HD11 LEU 45 HD11 LEU 45 48.152 23.480 38.053 303 HD12 LEU 45 HD12 LEU 45 47.899 24.738 39.280 304 HD13 LEU 45 HD13 LEU 45 48.013 25.169 37.557 305 HD21 LEU 45 HD21 LEU 45 46.244 22.194 38.772 306 HD22 LEU 45 HD22 LEU 45 44.642 22.928 38.935 307 HD23 LEU 45 HD23 LEU 45 45.932 23.360 40.080 308 H ARG 46 H ARG 46 44.603 28.756 38.757 309 HA ARG 46 HA ARG 46 42.024 28.994 37.441 310 HB2 ARG 46 HB2 ARG 46 42.392 29.905 39.623 311 HB3 ARG 46 HB3 ARG 46 43.744 30.886 39.101 312 HG2 ARG 46 HG2 ARG 46 41.133 31.444 37.739 313 HG3 ARG 46 HG3 ARG 46 41.207 31.799 39.463 314 HD2 ARG 46 HD2 ARG 46 43.258 33.198 39.067 315 HD3 ARG 46 HD3 ARG 46 43.059 32.924 37.337 316 HE ARG 46 HE ARG 46 41.075 34.194 37.311 317 HH11 ARG 46 HH11 ARG 46 42.256 34.128 40.656 318 HH12 ARG 46 HH12 ARG 46 41.338 35.546 41.067 319 HH21 ARG 46 HH21 ARG 46 39.826 35.898 38.008 320 HH22 ARG 46 HH22 ARG 46 39.880 36.349 39.699 321 H MET 47 H MET 47 45.085 30.721 36.949 322 HA MET 47 HA MET 47 44.230 32.298 34.746 323 HB2 MET 47 HB2 MET 47 46.148 32.771 36.220 324 HB3 MET 47 HB3 MET 47 47.021 31.385 35.547 325 HG2 MET 47 HG2 MET 47 47.150 32.466 33.373 326 HG3 MET 47 HG3 MET 47 46.033 33.732 33.890 327 HE1 MET 47 HE1 MET 47 49.125 32.274 36.017 328 HE2 MET 47 HE2 MET 47 49.633 32.215 34.309 329 HE3 MET 47 HE3 MET 47 50.399 33.361 35.430 330 H LEU 48 H LEU 48 45.872 29.089 34.815 331 HA LEU 48 HA LEU 48 46.001 28.670 32.006 332 HB2 LEU 48 HB2 LEU 48 47.206 27.261 33.534 333 HB3 LEU 48 HB3 LEU 48 45.731 26.794 34.375 334 HG LEU 48 HG LEU 48 44.963 25.470 32.486 335 HD11 LEU 48 HD11 LEU 48 46.505 25.056 30.544 336 HD12 LEU 48 HD12 LEU 48 47.474 26.454 31.090 337 HD13 LEU 48 HD13 LEU 48 45.804 26.670 30.546 338 HD21 LEU 48 HD21 LEU 48 47.885 24.904 33.131 339 HD22 LEU 48 HD22 LEU 48 46.689 23.736 32.529 340 HD23 LEU 48 HD23 LEU 48 46.488 24.451 34.138 341 H ALA 49 H ALA 49 43.325 27.733 34.299 342 HA ALA 49 HA ALA 49 41.692 26.551 32.297 343 HB1 ALA 49 HB1 ALA 49 39.858 26.914 33.928 344 HB2 ALA 49 HB2 ALA 49 41.306 26.259 34.706 345 HB3 ALA 49 HB3 ALA 49 40.909 27.984 34.879 346 H GLN 50 H GLN 50 41.628 29.954 33.531 347 HA GLN 50 HA GLN 50 39.586 30.755 31.673 348 HB2 GLN 50 HB2 GLN 50 41.626 32.392 33.216 349 HB3 GLN 50 HB3 GLN 50 40.264 33.052 32.285 350 HG2 GLN 50 HG2 GLN 50 38.701 31.670 33.691 351 HG3 GLN 50 HG3 GLN 50 40.063 31.178 34.690 352 HE21 GLN 50 HE21 GLN 50 38.400 34.157 33.504 353 HE22 GLN 50 HE22 GLN 50 38.692 35.039 35.024 354 H LEU 51 H LEU 51 43.182 30.883 31.338 355 HA LEU 51 HA LEU 51 43.216 32.173 28.783 356 HB2 LEU 51 HB2 LEU 51 45.191 31.988 30.118 357 HB3 LEU 51 HB3 LEU 51 45.050 30.230 30.217 358 HG LEU 51 HG LEU 51 45.631 29.984 27.872 359 HD11 LEU 51 HD11 LEU 51 46.472 31.870 26.539 360 HD12 LEU 51 HD12 LEU 51 46.093 33.001 27.855 361 HD13 LEU 51 HD13 LEU 51 44.791 32.166 26.977 362 HD21 LEU 51 HD21 LEU 51 47.392 29.978 29.564 363 HD22 LEU 51 HD22 LEU 51 47.506 31.751 29.453 364 HD23 LEU 51 HD23 LEU 51 47.993 30.733 28.075 365 H ARG 52 H ARG 52 42.987 28.671 29.619 366 HA ARG 52 HA ARG 52 42.954 27.732 26.931 367 HB2 ARG 52 HB2 ARG 52 43.383 26.376 28.981 368 HB3 ARG 52 HB3 ARG 52 41.660 26.447 29.370 369 HG2 ARG 52 HG2 ARG 52 41.079 25.287 27.325 370 HG3 ARG 52 HG3 ARG 52 42.756 25.365 26.729 371 HD2 ARG 52 HD2 ARG 52 43.497 24.048 28.692 372 HD3 ARG 52 HD3 ARG 52 41.815 23.812 29.186 373 HE ARG 52 HE ARG 52 43.283 22.263 27.313 374 HH11 ARG 52 HH11 ARG 52 39.974 23.348 27.809 375 HH12 ARG 52 HH12 ARG 52 39.360 22.221 26.613 376 HH21 ARG 52 HH21 ARG 52 42.356 20.706 26.013 377 HH22 ARG 52 HH22 ARG 52 40.622 20.653 25.856 378 H GLU 53 H GLU 53 40.305 28.745 29.043 379 HA GLU 53 HA GLU 53 38.237 28.086 27.098 380 HB2 GLU 53 HB2 GLU 53 38.212 29.654 29.688 381 HB3 GLU 53 HB3 GLU 53 36.763 29.178 28.789 382 HG2 GLU 53 HG2 GLU 53 38.821 27.092 29.653 383 HG3 GLU 53 HG3 GLU 53 37.594 27.637 30.740 384 H ARG 54 H ARG 54 39.867 31.157 27.912 385 HA ARG 54 HA ARG 54 38.272 32.751 26.064 386 HB2 ARG 54 HB2 ARG 54 41.038 33.162 27.294 387 HB3 ARG 54 HB3 ARG 54 40.211 34.365 26.301 388 HG2 ARG 54 HG2 ARG 54 38.315 34.465 27.878 389 HG3 ARG 54 HG3 ARG 54 39.089 33.283 28.923 390 HD2 ARG 54 HD2 ARG 54 41.087 34.850 29.088 391 HD3 ARG 54 HD3 ARG 54 40.123 36.048 28.194 392 HE ARG 54 HE ARG 54 38.806 34.934 30.576 393 HH11 ARG 54 HH11 ARG 54 40.903 37.651 29.595 394 HH12 ARG 54 HH12 ARG 54 40.502 38.454 31.113 395 HH21 ARG 54 HH21 ARG 54 38.331 36.102 32.221 396 HH22 ARG 54 HH22 ARG 54 39.146 37.649 32.517 397 H HIS 55 H HIS 55 41.253 30.893 25.698 398 HA HIS 55 HA HIS 55 41.571 31.973 22.933 399 HB2 HIS 55 HB2 HIS 55 42.979 32.675 25.119 400 HB3 HIS 55 HB3 HIS 55 43.916 31.280 24.673 401 HD1 HIS 55 HD1 HIS 55 45.830 31.974 22.828 402 HD2 HIS 55 HD2 HIS 55 42.462 34.501 23.013 403 HE1 HIS 55 HE1 HIS 55 46.367 33.973 21.394 404 H GLY 56 H GLY 56 41.088 28.963 24.409 405 HA2 GLY 56 HA2 GLY 56 41.293 26.819 23.557 406 HA3 GLY 56 HA3 GLY 56 41.931 27.492 22.051 407 H VAL 57 H VAL 57 43.473 28.256 25.099 408 HA VAL 57 HA VAL 57 45.991 27.098 24.032 409 HB VAL 57 HB VAL 57 45.409 29.482 25.754 410 HG11 VAL 57 HG11 VAL 57 48.121 28.201 25.190 411 HG12 VAL 57 HG12 VAL 57 47.891 29.848 25.810 412 HG13 VAL 57 HG13 VAL 57 47.384 28.469 26.784 413 HG21 VAL 57 HG21 VAL 57 46.927 29.101 23.139 414 HG22 VAL 57 HG22 VAL 57 45.286 29.743 23.289 415 HG23 VAL 57 HG23 VAL 57 46.652 30.637 23.979 416 H ASP 58 H ASP 58 46.321 25.156 24.774 417 HA ASP 58 HA ASP 58 45.835 24.483 27.644 418 HB2 ASP 58 HB2 ASP 58 44.750 23.107 25.881 419 HB3 ASP 58 HB3 ASP 58 46.331 22.713 25.213 420 H LEU 59 H LEU 59 47.550 24.074 28.999 421 HA LEU 59 HA LEU 59 50.321 24.229 27.871 422 HB2 LEU 59 HB2 LEU 59 49.131 25.102 30.502 423 HB3 LEU 59 HB3 LEU 59 50.833 24.741 30.355 424 HG LEU 59 HG LEU 59 51.230 26.468 28.773 425 HD11 LEU 59 HD11 LEU 59 49.218 26.596 27.439 426 HD12 LEU 59 HD12 LEU 59 49.492 28.167 28.184 427 HD13 LEU 59 HD13 LEU 59 48.247 27.083 28.846 428 HD21 LEU 59 HD21 LEU 59 51.192 27.010 31.197 429 HD22 LEU 59 HD22 LEU 59 49.499 27.515 31.057 430 HD23 LEU 59 HD23 LEU 59 50.764 28.410 30.201 431 HA PRO 60 HA PRO 60 50.841 20.102 29.741 432 HB2 PRO 60 HB2 PRO 60 53.389 20.253 28.189 433 HB3 PRO 60 HB3 PRO 60 52.195 18.928 28.270 434 HG2 PRO 60 HG2 PRO 60 52.368 20.479 26.052 435 HG3 PRO 60 HG3 PRO 60 50.775 19.959 26.692 436 HD2 PRO 60 HD2 PRO 60 52.208 22.595 27.165 437 HD3 PRO 60 HD3 PRO 60 50.520 22.318 26.631 438 H LEU 61 H LEU 61 52.035 19.693 31.593 439 HA LEU 61 HA LEU 61 53.445 21.806 32.975 440 HB2 LEU 61 HB2 LEU 61 53.227 18.794 33.432 441 HB3 LEU 61 HB3 LEU 61 54.129 19.863 34.483 442 HG LEU 61 HG LEU 61 52.049 19.366 35.503 443 HD11 LEU 61 HD11 LEU 61 52.959 21.657 35.801 444 HD12 LEU 61 HD12 LEU 61 51.205 21.556 36.010 445 HD13 LEU 61 HD13 LEU 61 51.871 22.233 34.512 446 HD21 LEU 61 HD21 LEU 61 50.700 18.880 33.461 447 HD22 LEU 61 HD22 LEU 61 50.536 20.637 33.194 448 HD23 LEU 61 HD23 LEU 61 49.878 19.890 34.657 449 H ARG 62 H ARG 62 54.466 19.133 30.917 450 HA ARG 62 HA ARG 62 57.306 19.314 31.244 451 HB2 ARG 62 HB2 ARG 62 56.059 17.475 30.188 452 HB3 ARG 62 HB3 ARG 62 55.550 18.536 28.872 453 HG2 ARG 62 HG2 ARG 62 57.787 18.705 28.030 454 HG3 ARG 62 HG3 ARG 62 58.470 17.915 29.471 455 HD2 ARG 62 HD2 ARG 62 58.435 16.369 27.603 456 HD3 ARG 62 HD3 ARG 62 57.318 15.809 28.845 457 HE ARG 62 HE ARG 62 56.621 17.065 26.212 458 HH11 ARG 62 HH11 ARG 62 55.344 15.225 28.968 459 HH12 ARG 62 HH12 ARG 62 53.843 14.992 28.114 460 HH21 ARG 62 HH21 ARG 62 54.717 16.974 25.453 461 HH22 ARG 62 HH22 ARG 62 53.369 16.257 26.341 462 H CYS 63 H CYS 63 55.092 21.223 29.222 463 HA CYS 63 HA CYS 63 57.223 22.690 27.895 464 HB2 CYS 63 HB2 CYS 63 54.240 23.221 27.962 465 HB3 CYS 63 HB3 CYS 63 55.428 24.011 26.917 466 HG CYS 63 HG CYS 63 56.356 21.759 25.841 467 H LEU 64 H LEU 64 54.953 23.316 30.576 468 HA LEU 64 HA LEU 64 55.815 25.940 31.357 469 HB2 LEU 64 HB2 LEU 64 53.850 24.424 32.091 470 HB3 LEU 64 HB3 LEU 64 54.990 23.633 33.159 471 HG LEU 64 HG LEU 64 55.410 25.796 34.336 472 HD11 LEU 64 HD11 LEU 64 54.839 27.455 32.672 473 HD12 LEU 64 HD12 LEU 64 53.659 27.601 33.976 474 HD13 LEU 64 HD13 LEU 64 53.201 26.777 32.478 475 HD21 LEU 64 HD21 LEU 64 53.785 24.166 35.166 476 HD22 LEU 64 HD22 LEU 64 52.516 24.859 34.125 477 HD23 LEU 64 HD23 LEU 64 53.197 25.806 35.459 478 H TYR 65 H TYR 65 57.162 22.728 32.134 479 HA TYR 65 HA TYR 65 59.221 23.749 33.867 480 HB2 TYR 65 HB2 TYR 65 58.264 21.480 34.006 481 HB3 TYR 65 HB3 TYR 65 58.952 21.084 32.440 482 HD1 TYR 65 HD1 TYR 65 60.251 22.667 35.640 483 HD2 TYR 65 HD2 TYR 65 60.739 19.598 32.642 484 HE1 TYR 65 HE1 TYR 65 62.269 21.815 36.827 485 HE2 TYR 65 HE2 TYR 65 62.737 18.750 33.840 486 HH TYR 65 HH TYR 65 64.056 18.942 35.665 487 H GLU 66 H GLU 66 59.262 22.798 30.355 488 HA GLU 66 HA GLU 66 62.106 23.481 30.188 489 HB2 GLU 66 HB2 GLU 66 62.084 22.935 27.952 490 HB3 GLU 66 HB3 GLU 66 60.923 21.847 28.697 491 HG2 GLU 66 HG2 GLU 66 59.096 23.371 27.878 492 HG3 GLU 66 HG3 GLU 66 60.304 24.345 27.062 493 H ALA 67 H ALA 67 59.215 25.402 29.861 494 HA ALA 67 HA ALA 67 60.843 27.800 29.200 495 HB1 ALA 67 HB1 ALA 67 58.395 26.754 27.730 496 HB2 ALA 67 HB2 ALA 67 59.157 28.321 27.467 497 HB3 ALA 67 HB3 ALA 67 60.062 26.846 27.100 498 HA PRO 68 HA PRO 68 57.525 28.914 32.225 499 HB2 PRO 68 HB2 PRO 68 58.922 29.475 34.503 500 HB3 PRO 68 HB3 PRO 68 58.338 27.855 34.054 501 HG2 PRO 68 HG2 PRO 68 61.093 29.037 33.692 502 HG3 PRO 68 HG3 PRO 68 60.668 27.403 34.275 503 HD2 PRO 68 HD2 PRO 68 61.429 27.947 31.669 504 HD3 PRO 68 HD3 PRO 68 60.316 26.622 32.120 505 H THR 69 H THR 69 60.096 30.609 30.647 506 HA THR 69 HA THR 69 59.105 33.235 31.556 507 HB THR 69 HB THR 69 60.462 33.795 29.306 508 HG1 THR 69 HG1 THR 69 62.307 32.490 29.265 509 HG21 THR 69 HG21 THR 69 61.724 33.116 32.004 510 HG22 THR 69 HG22 THR 69 60.943 34.652 31.574 511 HG23 THR 69 HG23 THR 69 62.436 34.174 30.763 512 H VAL 70 H VAL 70 57.388 34.269 30.603 513 HA VAL 70 HA VAL 70 55.507 32.559 29.420 514 HB VAL 70 HB VAL 70 55.321 35.591 29.390 515 HG11 VAL 70 HG11 VAL 70 53.479 34.453 28.187 516 HG12 VAL 70 HG12 VAL 70 53.208 33.392 29.587 517 HG13 VAL 70 HG13 VAL 70 52.889 35.132 29.705 518 HG21 VAL 70 HG21 VAL 70 54.189 35.259 31.634 519 HG22 VAL 70 HG22 VAL 70 54.838 33.600 31.622 520 HG23 VAL 70 HG23 VAL 70 55.934 35.002 31.646 521 H ALA 71 H ALA 71 57.558 34.972 27.770 522 HA ALA 71 HA ALA 71 56.367 34.571 25.191 523 HB1 ALA 71 HB1 ALA 71 59.158 35.484 25.991 524 HB2 ALA 71 HB2 ALA 71 58.468 35.612 24.354 525 HB3 ALA 71 HB3 ALA 71 57.739 36.511 25.697 526 H ARG 72 H ARG 72 58.953 32.757 26.866 527 HA ARG 72 HA ARG 72 59.542 31.002 24.576 528 HB2 ARG 72 HB2 ARG 72 60.209 30.869 27.545 529 HB3 ARG 72 HB3 ARG 72 60.556 29.557 26.440 530 HG2 ARG 72 HG2 ARG 72 62.504 30.911 26.882 531 HG3 ARG 72 HG3 ARG 72 62.119 30.787 25.175 532 HD2 ARG 72 HD2 ARG 72 61.069 33.162 26.710 533 HD3 ARG 72 HD3 ARG 72 62.779 33.047 26.407 534 HE ARG 72 HE ARG 72 61.376 32.500 23.939 535 HH11 ARG 72 HH11 ARG 72 61.983 35.305 25.993 536 HH12 ARG 72 HH12 ARG 72 61.669 36.400 24.657 537 HH21 ARG 72 HH21 ARG 72 61.141 33.995 22.302 538 HH22 ARG 72 HH22 ARG 72 61.224 35.701 22.711 539 H LEU 73 H LEU 73 57.431 30.864 27.447 540 HA LEU 73 HA LEU 73 56.357 28.305 27.025 541 HB2 LEU 73 HB2 LEU 73 55.979 29.840 28.974 542 HB3 LEU 73 HB3 LEU 73 54.845 30.759 28.029 543 HG LEU 73 HG LEU 73 54.346 27.816 28.042 544 HD11 LEU 73 HD11 LEU 73 53.863 29.498 30.530 545 HD12 LEU 73 HD12 LEU 73 55.033 28.167 30.365 546 HD13 LEU 73 HD13 LEU 73 53.302 27.828 30.245 547 HD21 LEU 73 HD21 LEU 73 52.546 30.233 28.526 548 HD22 LEU 73 HD22 LEU 73 52.026 28.561 28.209 549 HD23 LEU 73 HD23 LEU 73 52.830 29.481 26.945 550 H ALA 74 H ALA 74 55.068 31.455 25.787 551 HA ALA 74 HA ALA 74 53.123 30.359 24.058 552 HB1 ALA 74 HB1 ALA 74 53.262 32.508 22.883 553 HB2 ALA 74 HB2 ALA 74 53.347 32.752 24.645 554 HB3 ALA 74 HB3 ALA 74 54.823 32.857 23.658 555 H GLU 75 H GLU 75 56.628 30.907 23.380 556 HA GLU 75 HA GLU 75 56.556 30.018 20.667 557 HB2 GLU 75 HB2 GLU 75 58.753 30.037 22.743 558 HB3 GLU 75 HB3 GLU 75 59.017 29.466 21.095 559 HG2 GLU 75 HG2 GLU 75 58.457 31.629 20.192 560 HG3 GLU 75 HG3 GLU 75 57.992 32.215 21.786 561 H THR 76 H THR 76 56.987 28.054 23.667 562 HA THR 76 HA THR 76 57.281 25.534 22.315 563 HB THR 76 HB THR 76 56.645 24.397 24.339 564 HG1 THR 76 HG1 THR 76 55.832 26.932 25.227 565 HG21 THR 76 HG21 THR 76 58.511 26.714 24.923 566 HG22 THR 76 HG22 THR 76 58.943 25.135 24.256 567 HG23 THR 76 HG23 THR 76 58.319 25.243 25.900 568 H ILE 77 H ILE 77 54.330 27.030 23.734 569 HA ILE 77 HA ILE 77 52.604 24.896 22.982 570 HB ILE 77 HB ILE 77 51.953 27.811 23.574 571 HG12 ILE 77 HG12 ILE 77 53.020 26.905 25.520 572 HG13 ILE 77 HG13 ILE 77 51.308 26.957 25.839 573 HG21 ILE 77 HG21 ILE 77 49.681 26.903 24.194 574 HG22 ILE 77 HG22 ILE 77 50.032 26.853 22.470 575 HG23 ILE 77 HG23 ILE 77 50.145 25.371 23.443 576 HD11 ILE 77 HD11 ILE 77 51.214 24.472 25.363 577 HD12 ILE 77 HD12 ILE 77 52.984 24.492 25.182 578 HD13 ILE 77 HD13 ILE 77 52.254 24.925 26.730 579 H VAL 78 H VAL 78 53.558 27.807 21.191 580 HA VAL 78 HA VAL 78 51.812 27.274 18.929 581 HB VAL 78 HB VAL 78 54.221 29.090 19.244 582 HG11 VAL 78 HG11 VAL 78 53.402 30.178 17.151 583 HG12 VAL 78 HG12 VAL 78 54.017 28.554 16.863 584 HG13 VAL 78 HG13 VAL 78 52.261 28.834 16.915 585 HG21 VAL 78 HG21 VAL 78 52.468 30.852 19.238 586 HG22 VAL 78 HG22 VAL 78 51.212 29.601 19.072 587 HG23 VAL 78 HG23 VAL 78 52.165 29.715 20.551 588 H ARG 79 H ARG 79 55.362 26.552 19.491 589 HA ARG 79 HA ARG 79 55.585 25.434 16.845 590 HB2 ARG 79 HB2 ARG 79 57.751 24.831 17.304 591 HB3 ARG 79 HB3 ARG 79 57.513 26.285 18.251 592 HG2 ARG 79 HG2 ARG 79 57.283 24.905 20.301 593 HG3 ARG 79 HG3 ARG 79 57.432 23.432 19.344 594 HD2 ARG 79 HD2 ARG 79 59.532 23.832 20.403 595 HD3 ARG 79 HD3 ARG 79 59.704 24.033 18.675 596 HE ARG 79 HE ARG 79 60.004 26.365 18.927 597 HH11 ARG 79 HH11 ARG 79 59.983 24.810 22.108 598 HH12 ARG 79 HH12 ARG 79 60.691 26.229 22.842 599 HH21 ARG 79 HH21 ARG 79 60.667 28.118 19.963 600 HH22 ARG 79 HH22 ARG 79 61.083 28.036 21.665 601 H LEU 80 H LEU 80 54.694 23.946 19.890 602 HA LEU 80 HA LEU 80 54.596 21.228 18.800 603 HB2 LEU 80 HB2 LEU 80 53.609 22.434 21.414 604 HB3 LEU 80 HB3 LEU 80 53.669 20.711 21.060 605 HG LEU 80 HG LEU 80 56.133 22.520 21.149 606 HD11 LEU 80 HD11 LEU 80 56.621 21.470 23.280 607 HD12 LEU 80 HD12 LEU 80 55.112 20.527 23.201 608 HD13 LEU 80 HD13 LEU 80 55.059 22.300 23.346 609 HD21 LEU 80 HD21 LEU 80 56.506 20.569 19.727 610 HD22 LEU 80 HD22 LEU 80 55.857 19.499 20.989 611 HD23 LEU 80 HD23 LEU 80 57.372 20.382 21.257 612 H ALA 81 H ALA 81 52.570 23.854 18.534 613 HA ALA 81 HA ALA 81 50.622 24.296 17.687 614 HB1 ALA 81 HB1 ALA 81 49.984 23.015 15.720 615 HB2 ALA 81 HB2 ALA 81 51.728 23.290 15.811 616 HB3 ALA 81 HB3 ALA 81 51.059 21.694 16.223 617 H ALA 82 H ALA 82 48.510 24.368 17.774 618 HA ALA 82 HA ALA 82 46.922 22.040 18.484 619 HB1 ALA 82 HB1 ALA 82 45.816 23.223 20.391 620 HB2 ALA 82 HB2 ALA 82 47.533 22.899 20.698 621 HB3 ALA 82 HB3 ALA 82 47.001 24.528 20.223 622 HA PRO 83 HA PRO 83 43.968 24.304 15.879 623 HB2 PRO 83 HB2 PRO 83 41.783 22.734 16.241 624 HB3 PRO 83 HB3 PRO 83 43.266 22.078 15.491 625 HG2 PRO 83 HG2 PRO 83 42.506 21.884 18.422 626 HG3 PRO 83 HG3 PRO 83 42.850 20.537 17.277 627 HD2 PRO 83 HD2 PRO 83 44.825 21.563 18.798 628 HD3 PRO 83 HD3 PRO 83 45.133 21.150 17.094 629 H ALA 84 H ALA 84 41.569 24.953 16.164 630 HA ALA 84 HA ALA 84 39.788 25.937 17.147 631 HB1 ALA 84 HB1 ALA 84 39.651 23.566 17.601 632 HB2 ALA 84 HB2 ALA 84 40.492 23.786 19.154 633 HB3 ALA 84 HB3 ALA 84 38.888 24.495 18.898 634 HA PRO 85 HA PRO 85 41.706 29.015 19.969 635 HB2 PRO 85 HB2 PRO 85 39.694 30.689 18.462 636 HB3 PRO 85 HB3 PRO 85 41.356 31.117 18.971 637 HG2 PRO 85 HG2 PRO 85 40.883 30.422 16.409 638 HG3 PRO 85 HG3 PRO 85 42.307 29.722 17.254 639 HD2 PRO 85 HD2 PRO 85 39.570 28.470 16.837 640 HD3 PRO 85 HD3 PRO 85 41.188 27.769 16.537 641 H SER 86 H SER 86 38.720 27.513 20.050 642 HA SER 86 HA SER 86 36.905 27.524 21.377 643 HB2 SER 86 HB2 SER 86 38.869 27.348 23.027 644 HB3 SER 86 HB3 SER 86 38.472 29.009 23.494 645 HG SER 86 HG SER 86 37.442 27.009 24.535 646 H GLY 87 H GLY 87 36.162 29.593 23.394 647 HA2 GLY 87 HA2 GLY 87 35.829 32.170 22.338 648 HA3 GLY 87 HA3 GLY 87 34.540 31.205 21.614 649 H ASP 88 H ASP 88 35.847 31.016 25.010 650 HA ASP 88 HA ASP 88 33.107 31.079 26.000 651 HB2 ASP 88 HB2 ASP 88 35.163 29.718 26.865 652 HB3 ASP 88 HB3 ASP 88 35.578 31.196 27.738 653 H GLN 89 H GLN 89 32.081 32.669 27.295 654 HA GLN 89 HA GLN 89 32.957 35.417 26.959 655 HB2 GLN 89 HB2 GLN 89 30.637 34.163 28.437 656 HB3 GLN 89 HB3 GLN 89 30.943 35.905 28.336 657 HG2 GLN 89 HG2 GLN 89 30.869 35.798 25.858 658 HG3 GLN 89 HG3 GLN 89 30.572 34.060 25.941 659 HE21 GLN 89 HE21 GLN 89 28.556 34.156 24.906 660 HE22 GLN 89 HE22 GLN 89 27.176 34.874 25.718 661 H ASP 90 H ASP 90 33.340 33.018 29.481 662 HA ASP 90 HA ASP 90 34.268 33.110 31.574 663 HB2 ASP 90 HB2 ASP 90 35.946 32.852 29.721 664 HB3 ASP 90 HB3 ASP 90 36.345 34.563 29.895 665 H ASP 91 H ASP 91 32.473 34.802 32.180 666 HA ASP 91 HA ASP 91 33.388 37.580 32.326 667 HB2 ASP 91 HB2 ASP 91 31.200 36.841 31.368 668 HB3 ASP 91 HB3 ASP 91 30.690 36.343 32.985 669 H ALA 92 H ALA 92 32.622 35.020 34.576 670 HA ALA 92 HA ALA 92 32.965 34.707 36.787 671 HB1 ALA 92 HB1 ALA 92 35.243 35.178 35.836 672 HB2 ALA 92 HB2 ALA 92 35.109 36.832 36.459 673 HB3 ALA 92 HB3 ALA 92 35.098 35.448 37.572 674 H SER 93 H SER 93 33.664 35.936 38.988 675 HA SER 93 HA SER 93 32.441 38.558 39.360 676 HB2 SER 93 HB2 SER 93 30.530 37.023 39.765 677 HB3 SER 93 HB3 SER 93 31.493 36.167 40.990 678 HG SER 93 HG SER 93 29.963 38.193 41.414 679 H GLU 94 H GLU 94 33.136 39.570 41.236 680 HA GLU 94 HA GLU 94 35.543 38.831 42.657 681 HB2 GLU 94 HB2 GLU 94 34.982 40.741 44.059 682 HB3 GLU 94 HB3 GLU 94 34.692 41.132 42.366 683 HG2 GLU 94 HG2 GLU 94 32.187 40.377 42.954 684 HG3 GLU 94 HG3 GLU 94 32.702 40.695 44.605 685 H TYR 95 H TYR 95 32.404 37.608 42.837 686 HA TYR 95 HA TYR 95 31.238 36.203 44.062 687 HB2 TYR 95 HB2 TYR 95 33.413 34.946 44.024 688 HB3 TYR 95 HB3 TYR 95 33.726 35.540 45.651 689 HD1 TYR 95 HD1 TYR 95 32.848 34.298 47.519 690 HD2 TYR 95 HD2 TYR 95 31.221 33.696 43.575 691 HE1 TYR 95 HE1 TYR 95 31.491 32.376 48.355 692 HE2 TYR 95 HE2 TYR 95 29.839 31.810 44.421 693 HH TYR 95 HH TYR 95 29.158 30.652 46.253 694 H GLU 96 H GLU 96 33.151 38.327 46.052 695 HA GLU 96 HA GLU 96 31.661 38.212 48.444 696 HB2 GLU 96 HB2 GLU 96 33.942 39.056 48.172 697 HB3 GLU 96 HB3 GLU 96 33.357 40.422 47.209 698 HG2 GLU 96 HG2 GLU 96 32.286 41.414 49.115 699 HG3 GLU 96 HG3 GLU 96 32.475 39.933 50.071 700 H GLU 97 H GLU 97 30.874 39.775 45.538 701 HA GLU 97 HA GLU 97 28.813 41.594 46.567 702 HB2 GLU 97 HB2 GLU 97 30.099 41.960 44.460 703 HB3 GLU 97 HB3 GLU 97 29.312 40.557 43.737 704 HG2 GLU 97 HG2 GLU 97 27.135 41.655 43.844 705 HG3 GLU 97 HG3 GLU 97 27.802 42.980 44.810 706 H GLY 98 H GLY 98 28.944 38.214 45.683 707 HA2 GLY 98 HA2 GLY 98 26.107 37.838 45.121 708 HA3 GLY 98 HA3 GLY 98 27.361 36.616 45.250 709 H VAL 99 H VAL 99 27.472 38.540 48.001 710 HA VAL 99 HA VAL 99 26.521 36.476 49.751 711 HB VAL 99 HB VAL 99 28.378 38.144 50.135 712 HG11 VAL 99 HG11 VAL 99 26.127 40.014 50.950 713 HG12 VAL 99 HG12 VAL 99 27.859 40.288 51.143 714 HG13 VAL 99 HG13 VAL 99 27.161 40.206 49.517 715 HG21 VAL 99 HG21 VAL 99 26.369 37.875 52.393 716 HG22 VAL 99 HG22 VAL 99 27.634 36.706 51.944 717 HG23 VAL 99 HG23 VAL 99 28.077 38.305 52.542 718 H ILE 100 H ILE 100 24.817 36.628 51.350 719 HA ILE 100 HA ILE 100 22.603 38.525 50.763 720 HB ILE 100 HB ILE 100 22.336 36.159 49.728 721 HG12 ILE 100 HG12 ILE 100 19.964 35.963 50.196 722 HG13 ILE 100 HG13 ILE 100 20.078 37.099 51.532 723 HG21 ILE 100 HG21 ILE 100 21.569 35.387 52.573 724 HG22 ILE 100 HG22 ILE 100 21.597 34.369 51.125 725 HG23 ILE 100 HG23 ILE 100 23.116 34.959 51.819 726 HD11 ILE 100 HD11 ILE 100 20.717 37.753 48.614 727 HD12 ILE 100 HD12 ILE 100 19.172 38.088 49.419 728 HD13 ILE 100 HD13 ILE 100 20.637 38.913 49.965 729 H ARG 101 H ARG 101 21.023 38.702 52.655 730 HA ARG 101 HA ARG 101 22.512 38.667 55.188 731 HB2 ARG 101 HB2 ARG 101 21.483 40.716 54.298 732 HB3 ARG 101 HB3 ARG 101 19.889 39.980 54.402 733 HG2 ARG 101 HG2 ARG 101 20.192 39.746 56.885 734 HG3 ARG 101 HG3 ARG 101 21.835 40.374 56.690 735 HD2 ARG 101 HD2 ARG 101 20.329 42.100 57.545 736 HD3 ARG 101 HD3 ARG 101 20.969 42.539 55.950 737 HE ARG 101 HE ARG 101 18.476 41.244 55.568 738 HH11 ARG 101 HH11 ARG 101 19.558 44.279 57.044 739 HH12 ARG 101 HH12 ARG 101 18.008 45.038 56.663 740 HH21 ARG 101 HH21 ARG 101 16.659 42.452 55.004 741 HH22 ARG 101 HH22 ARG 101 16.511 44.080 55.678 Start of MODEL 20 1 H GLY 1 H1 GLY 1 43.356 46.640 40.748 2 HA2 GLY 1 HA2 GLY 1 41.488 47.769 39.703 3 HA3 GLY 1 HA3 GLY 1 40.940 48.234 41.318 4 H ALA 2 H ALA 2 43.193 48.932 38.748 5 HA ALA 2 HA ALA 2 43.993 51.439 40.075 6 HB1 ALA 2 HB1 ALA 2 46.003 49.343 39.140 7 HB2 ALA 2 HB2 ALA 2 46.399 50.958 39.768 8 HB3 ALA 2 HB3 ALA 2 45.657 49.755 40.828 9 H ALA 3 H ALA 3 45.663 52.555 38.452 10 HA ALA 3 HA ALA 3 44.313 53.415 36.179 11 HB1 ALA 3 HB1 ALA 3 46.479 54.441 35.588 12 HB2 ALA 3 HB2 ALA 3 46.112 54.600 37.318 13 HB3 ALA 3 HB3 ALA 3 47.294 53.391 36.775 14 H ALA 4 H ALA 4 43.853 52.551 34.295 15 HA ALA 4 HA ALA 4 43.486 51.123 32.681 16 HB1 ALA 4 HB1 ALA 4 45.352 50.337 31.332 17 HB2 ALA 4 HB2 ALA 4 45.548 52.040 31.790 18 HB3 ALA 4 HB3 ALA 4 46.496 50.776 32.612 19 H GLY 5 H GLY 5 45.073 49.742 35.407 20 HA2 GLY 5 HA2 GLY 5 44.826 47.705 36.470 21 HA3 GLY 5 HA3 GLY 5 43.781 47.131 35.164 22 H VAL 6 H VAL 6 45.494 47.618 32.996 23 HA VAL 6 HA VAL 6 47.911 45.922 33.318 24 HB VAL 6 HB VAL 6 47.268 44.930 31.109 25 HG11 VAL 6 HG11 VAL 6 46.947 43.743 33.255 26 HG12 VAL 6 HG12 VAL 6 45.296 44.378 33.352 27 HG13 VAL 6 HG13 VAL 6 45.759 43.295 32.015 28 HG21 VAL 6 HG21 VAL 6 45.636 46.490 30.260 29 HG22 VAL 6 HG22 VAL 6 44.911 44.896 30.426 30 HG23 VAL 6 HG23 VAL 6 44.534 46.154 31.611 31 H SER 7 H SER 7 49.510 46.289 31.728 32 HA SER 7 HA SER 7 49.284 47.983 29.474 33 HB2 SER 7 HB2 SER 7 50.600 49.295 31.893 34 HB3 SER 7 HB3 SER 7 51.002 49.750 30.225 35 HG SER 7 HG SER 7 48.315 49.635 31.032 36 H ALA 8 H ALA 8 50.746 47.084 28.130 37 HA ALA 8 HA ALA 8 53.174 45.730 29.146 38 HB1 ALA 8 HB1 ALA 8 51.739 44.627 27.488 39 HB2 ALA 8 HB2 ALA 8 51.962 45.988 26.363 40 HB3 ALA 8 HB3 ALA 8 53.340 44.966 26.805 41 H ALA 9 H ALA 9 52.339 48.728 27.482 42 HA ALA 9 HA ALA 9 53.486 50.397 26.547 43 HB1 ALA 9 HB1 ALA 9 55.304 51.347 27.831 44 HB2 ALA 9 HB2 ALA 9 54.069 50.711 28.927 45 HB3 ALA 9 HB3 ALA 9 55.577 49.805 28.669 46 H GLY 10 H GLY 10 53.816 47.965 25.166 47 HA2 GLY 10 HA2 GLY 10 55.781 48.384 23.248 48 HA3 GLY 10 HA3 GLY 10 56.530 47.332 24.459 49 H ILE 11 H ILE 11 56.309 46.229 22.035 50 HA ILE 11 HA ILE 11 53.741 44.798 21.805 51 HB ILE 11 HB ILE 11 54.531 45.710 19.784 52 HG12 ILE 11 HG12 ILE 11 54.576 43.725 18.310 53 HG13 ILE 11 HG13 ILE 11 54.842 42.677 19.704 54 HG21 ILE 11 HG21 ILE 11 57.061 44.027 19.976 55 HG22 ILE 11 HG22 ILE 11 56.561 45.042 18.616 56 HG23 ILE 11 HG23 ILE 11 56.962 45.781 20.163 57 HD11 ILE 11 HD11 ILE 11 52.390 44.444 19.279 58 HD12 ILE 11 HD12 ILE 11 52.486 42.701 18.957 59 HD13 ILE 11 HD13 ILE 11 52.633 43.291 20.615 60 H GLU 12 H GLU 12 53.437 43.235 23.195 61 HA GLU 12 HA GLU 12 55.602 41.247 23.711 62 HB2 GLU 12 HB2 GLU 12 53.247 42.111 25.407 63 HB3 GLU 12 HB3 GLU 12 54.368 40.813 25.823 64 HG2 GLU 12 HG2 GLU 12 55.272 43.695 25.421 65 HG3 GLU 12 HG3 GLU 12 54.752 43.033 26.966 66 HA PRO 13 HA PRO 13 53.057 38.002 21.970 67 HB2 PRO 13 HB2 PRO 13 53.873 36.339 24.352 68 HB3 PRO 13 HB3 PRO 13 53.948 35.927 22.612 69 HG2 PRO 13 HG2 PRO 13 56.200 36.631 23.944 70 HG3 PRO 13 HG3 PRO 13 55.894 37.274 22.298 71 HD2 PRO 13 HD2 PRO 13 55.406 38.637 24.962 72 HD3 PRO 13 HD3 PRO 13 56.203 39.269 23.488 73 H ASP 14 H ASP 14 50.892 37.432 22.171 74 HA ASP 14 HA ASP 14 49.449 38.981 24.070 75 HB2 ASP 14 HB2 ASP 14 48.511 36.884 22.081 76 HB3 ASP 14 HB3 ASP 14 47.439 37.969 22.978 77 H LEU 15 H LEU 15 50.267 35.559 24.245 78 HA LEU 15 HA LEU 15 48.656 34.760 26.399 79 HB2 LEU 15 HB2 LEU 15 50.312 33.380 25.113 80 HB3 LEU 15 HB3 LEU 15 51.628 34.197 25.962 81 HG LEU 15 HG LEU 15 50.916 33.230 28.093 82 HD11 LEU 15 HD11 LEU 15 49.142 31.446 28.113 83 HD12 LEU 15 HD12 LEU 15 48.664 31.950 26.480 84 HD13 LEU 15 HD13 LEU 15 48.492 33.069 27.853 85 HD21 LEU 15 HD21 LEU 15 51.022 31.157 25.857 86 HD22 LEU 15 HD22 LEU 15 51.381 30.867 27.574 87 HD23 LEU 15 HD23 LEU 15 52.420 31.939 26.628 88 H THR 16 H THR 16 51.512 36.918 26.484 89 HA THR 16 HA THR 16 51.646 37.095 29.389 90 HB THR 16 HB THR 16 53.135 38.927 29.116 91 HG1 THR 16 HG1 THR 16 52.478 38.921 26.353 92 HG21 THR 16 HG21 THR 16 54.033 36.686 28.488 93 HG22 THR 16 HG22 THR 16 54.885 38.045 27.732 94 HG23 THR 16 HG23 THR 16 53.745 37.068 26.780 95 H ALA 17 H ALA 17 49.844 38.844 26.883 96 HA ALA 17 HA ALA 17 48.905 41.003 28.510 97 HB1 ALA 17 HB1 ALA 17 48.886 40.819 25.972 98 HB2 ALA 17 HB2 ALA 17 47.461 39.779 26.131 99 HB3 ALA 17 HB3 ALA 17 47.401 41.437 26.723 100 H ILE 18 H ILE 18 47.559 37.813 27.643 101 HA ILE 18 HA ILE 18 45.189 37.963 29.258 102 HB ILE 18 HB ILE 18 46.774 35.554 28.280 103 HG12 ILE 18 HG12 ILE 18 44.268 36.874 27.134 104 HG13 ILE 18 HG13 ILE 18 45.882 37.170 26.522 105 HG21 ILE 18 HG21 ILE 18 43.924 35.707 29.373 106 HG22 ILE 18 HG22 ILE 18 44.655 34.273 28.624 107 HG23 ILE 18 HG23 ILE 18 45.297 34.879 30.141 108 HD11 ILE 18 HD11 ILE 18 44.384 34.547 26.401 109 HD12 ILE 18 HD12 ILE 18 44.916 35.598 25.076 110 HD13 ILE 18 HD13 ILE 18 46.123 34.715 26.030 111 H TRP 19 H TRP 19 48.473 36.682 30.055 112 HA TRP 19 HA TRP 19 47.799 35.873 32.728 113 HB2 TRP 19 HB2 TRP 19 50.436 36.714 31.464 114 HB3 TRP 19 HB3 TRP 19 50.292 36.221 33.138 115 HD1 TRP 19 HD1 TRP 19 48.517 34.310 30.312 116 HE1 TRP 19 HE1 TRP 19 49.486 31.960 30.159 117 HE3 TRP 19 HE3 TRP 19 52.255 34.730 33.797 118 HZ2 TRP 19 HZ2 TRP 19 51.665 30.470 31.290 119 HZ3 TRP 19 HZ3 TRP 19 53.742 32.790 34.254 120 HH2 TRP 19 HH2 TRP 19 53.480 30.673 32.982 121 H GLN 20 H GLN 20 49.232 39.070 31.596 122 HA GLN 20 HA GLN 20 49.176 40.067 34.266 123 HB2 GLN 20 HB2 GLN 20 49.744 42.170 33.420 124 HB3 GLN 20 HB3 GLN 20 50.605 40.990 32.454 125 HG2 GLN 20 HG2 GLN 20 49.125 41.344 30.585 126 HG3 GLN 20 HG3 GLN 20 48.001 42.303 31.541 127 HE21 GLN 20 HE21 GLN 20 50.771 42.534 29.448 128 HE22 GLN 20 HE22 GLN 20 51.096 44.200 29.854 129 H ALA 21 H ALA 21 46.615 39.992 31.778 130 HA ALA 21 HA ALA 21 44.837 41.745 33.226 131 HB1 ALA 21 HB1 ALA 21 44.730 41.292 30.784 132 HB2 ALA 21 HB2 ALA 21 44.224 39.620 31.133 133 HB3 ALA 21 HB3 ALA 21 43.196 40.996 31.600 134 H LEU 22 H LEU 22 45.183 38.167 33.280 135 HA LEU 22 HA LEU 22 42.982 37.847 35.174 136 HB2 LEU 22 HB2 LEU 22 45.200 36.062 34.109 137 HB3 LEU 22 HB3 LEU 22 44.081 35.490 35.336 138 HG LEU 22 HG LEU 22 43.179 36.567 32.615 139 HD11 LEU 22 HD11 LEU 22 42.832 34.238 31.991 140 HD12 LEU 22 HD12 LEU 22 43.410 33.700 33.582 141 HD13 LEU 22 HD13 LEU 22 44.530 34.478 32.433 142 HD21 LEU 22 HD21 LEU 22 41.398 36.669 34.325 143 HD22 LEU 22 HD22 LEU 22 41.727 34.987 34.793 144 HD23 LEU 22 HD23 LEU 22 41.067 35.366 33.188 145 H PHE 23 H PHE 23 46.463 38.302 35.526 146 HA PHE 23 HA PHE 23 46.285 38.103 38.455 147 HB2 PHE 23 HB2 PHE 23 48.137 37.160 37.092 148 HB3 PHE 23 HB3 PHE 23 48.576 38.780 36.598 149 HD1 PHE 23 HD1 PHE 23 50.858 38.112 37.324 150 HD2 PHE 23 HD2 PHE 23 47.617 38.366 40.164 151 HE1 PHE 23 HE1 PHE 23 52.484 38.183 39.193 152 HE2 PHE 23 HE2 PHE 23 49.248 38.456 42.012 153 HZ PHE 23 HZ PHE 23 51.674 38.356 41.534 154 H ALA 24 H ALA 24 45.428 40.404 36.283 155 HA ALA 24 HA ALA 24 45.062 42.595 36.203 156 HB1 ALA 24 HB1 ALA 24 43.671 43.372 38.039 157 HB2 ALA 24 HB2 ALA 24 43.337 41.661 37.700 158 HB3 ALA 24 HB3 ALA 24 44.340 42.112 39.099 159 H LEU 25 H LEU 25 47.677 42.559 36.195 160 HA LEU 25 HA LEU 25 48.496 44.884 37.859 161 HB2 LEU 25 HB2 LEU 25 50.570 43.987 38.426 162 HB3 LEU 25 HB3 LEU 25 49.435 42.693 38.758 163 HG LEU 25 HG LEU 25 51.304 42.925 36.340 164 HD11 LEU 25 HD11 LEU 25 52.434 40.994 37.290 165 HD12 LEU 25 HD12 LEU 25 51.326 40.993 38.679 166 HD13 LEU 25 HD13 LEU 25 52.460 42.341 38.455 167 HD21 LEU 25 HD21 LEU 25 49.366 40.754 37.174 168 HD22 LEU 25 HD22 LEU 25 50.635 40.534 35.938 169 HD23 LEU 25 HD23 LEU 25 49.334 41.701 35.677 170 HA PRO 26 HA PRO 26 50.145 46.383 33.950 171 HB2 PRO 26 HB2 PRO 26 52.086 48.119 34.672 172 HB3 PRO 26 HB3 PRO 26 50.354 48.443 34.993 173 HG2 PRO 26 HG2 PRO 26 52.415 47.293 36.904 174 HG3 PRO 26 HG3 PRO 26 51.275 48.633 37.203 175 HD2 PRO 26 HD2 PRO 26 50.736 46.085 37.988 176 HD3 PRO 26 HD3 PRO 26 49.453 47.180 37.408 177 H ALA 27 H ALA 27 50.798 44.372 33.325 178 HA ALA 27 HA ALA 27 52.071 42.851 32.392 179 HB1 ALA 27 HB1 ALA 27 54.159 45.012 32.452 180 HB2 ALA 27 HB2 ALA 27 54.290 43.505 31.528 181 HB3 ALA 27 HB3 ALA 27 52.982 44.634 31.180 182 H VAL 28 H VAL 28 53.457 41.178 32.444 183 HA VAL 28 HA VAL 28 54.226 40.389 35.190 184 HB VAL 28 HB VAL 28 54.547 38.129 34.249 185 HG11 VAL 28 HG11 VAL 28 51.791 39.314 33.749 186 HG12 VAL 28 HG12 VAL 28 52.175 37.608 34.065 187 HG13 VAL 28 HG13 VAL 28 52.435 38.819 35.329 188 HG21 VAL 28 HG21 VAL 28 53.714 37.479 32.103 189 HG22 VAL 28 HG22 VAL 28 53.199 39.129 31.724 190 HG23 VAL 28 HG23 VAL 28 54.930 38.740 31.843 191 H GLY 29 H GLY 29 56.229 39.710 35.835 192 HA2 GLY 29 HA2 GLY 29 58.330 41.370 34.954 193 HA3 GLY 29 HA3 GLY 29 58.504 40.028 36.073 194 H ARG 30 H ARG 30 60.537 40.784 34.475 195 HA ARG 30 HA ARG 30 60.869 38.611 32.427 196 HB2 ARG 30 HB2 ARG 30 62.067 41.366 32.710 197 HB3 ARG 30 HB3 ARG 30 62.942 40.097 31.845 198 HG2 ARG 30 HG2 ARG 30 61.096 39.752 30.305 199 HG3 ARG 30 HG3 ARG 30 60.088 40.929 31.168 200 HD2 ARG 30 HD2 ARG 30 61.457 42.770 30.482 201 HD3 ARG 30 HD3 ARG 30 62.794 41.709 30.055 202 HE ARG 30 HE ARG 30 61.996 41.548 27.947 203 HH11 ARG 30 HH11 ARG 30 59.159 42.451 29.826 204 HH12 ARG 30 HH12 ARG 30 58.117 42.140 28.426 205 HH21 ARG 30 HH21 ARG 30 60.635 41.589 26.231 206 HH22 ARG 30 HH22 ARG 30 58.931 41.932 26.493 207 H HIS 31 H HIS 31 62.785 37.373 32.448 208 HA HIS 31 HA HIS 31 64.060 35.854 33.536 209 HB2 HIS 31 HB2 HIS 31 65.238 38.447 34.049 210 HB3 HIS 31 HB3 HIS 31 65.627 37.364 35.369 211 HD1 HIS 31 HD1 HIS 31 67.288 35.324 34.806 212 HD2 HIS 31 HD2 HIS 31 66.165 37.805 31.587 213 HE1 HIS 31 HE1 HIS 31 68.706 34.597 32.814 214 H GLN 32 H GLN 32 61.533 35.943 34.463 215 HA GLN 32 HA GLN 32 61.841 34.763 37.159 216 HB2 GLN 32 HB2 GLN 32 59.835 36.881 36.318 217 HB3 GLN 32 HB3 GLN 32 59.497 35.779 37.656 218 HG2 GLN 32 HG2 GLN 32 61.914 37.641 37.578 219 HG3 GLN 32 HG3 GLN 32 60.350 38.072 38.242 220 HE21 GLN 32 HE21 GLN 32 61.112 38.356 40.379 221 HE22 GLN 32 HE22 GLN 32 61.592 36.959 41.349 222 H ASP 33 H ASP 33 60.800 32.845 37.345 223 HA ASP 33 HA ASP 33 59.515 31.781 34.898 224 HB2 ASP 33 HB2 ASP 33 60.607 30.462 37.414 225 HB3 ASP 33 HB3 ASP 33 59.797 29.593 36.117 226 H PHE 34 H PHE 34 57.570 30.582 34.950 227 HA PHE 34 HA PHE 34 55.290 31.588 35.909 228 HB2 PHE 34 HB2 PHE 34 55.322 29.797 34.347 229 HB3 PHE 34 HB3 PHE 34 56.091 28.690 35.460 230 HD1 PHE 34 HD1 PHE 34 54.716 26.950 36.174 231 HD2 PHE 34 HD2 PHE 34 52.945 30.825 35.503 232 HE1 PHE 34 HE1 PHE 34 52.474 26.012 36.638 233 HE2 PHE 34 HE2 PHE 34 50.706 29.880 35.958 234 HZ PHE 34 HZ PHE 34 50.458 27.455 36.490 235 H PHE 35 H PHE 35 57.238 29.401 37.935 236 HA PHE 35 HA PHE 35 55.355 28.996 40.007 237 HB2 PHE 35 HB2 PHE 35 58.378 28.908 40.231 238 HB3 PHE 35 HB3 PHE 35 57.206 27.966 41.148 239 HD1 PHE 35 HD1 PHE 35 55.510 26.533 39.546 240 HD2 PHE 35 HD2 PHE 35 59.488 27.815 38.471 241 HE1 PHE 35 HE1 PHE 35 55.600 24.796 37.776 242 HE2 PHE 35 HE2 PHE 35 59.576 26.070 36.719 243 HZ PHE 35 HZ PHE 35 57.628 24.557 36.359 244 H ALA 36 H ALA 36 57.332 31.777 39.427 245 HA ALA 36 HA ALA 36 56.399 33.025 41.998 246 HB1 ALA 36 HB1 ALA 36 58.849 33.050 41.696 247 HB2 ALA 36 HB2 ALA 36 58.642 33.803 40.094 248 HB3 ALA 36 HB3 ALA 36 58.164 34.688 41.556 249 H LEU 37 H LEU 37 56.594 33.330 38.472 250 HA LEU 37 HA LEU 37 55.866 35.977 38.216 251 HB2 LEU 37 HB2 LEU 37 56.905 34.262 36.562 252 HB3 LEU 37 HB3 LEU 37 55.246 33.783 36.201 253 HG LEU 37 HG LEU 37 54.849 36.241 35.535 254 HD11 LEU 37 HD11 LEU 37 56.904 37.180 36.664 255 HD12 LEU 37 HD12 LEU 37 56.860 37.494 34.925 256 HD13 LEU 37 HD13 LEU 37 57.896 36.209 35.548 257 HD21 LEU 37 HD21 LEU 37 55.976 35.956 33.349 258 HD22 LEU 37 HD22 LEU 37 55.142 34.490 33.871 259 HD23 LEU 37 HD23 LEU 37 56.910 34.595 34.013 260 H GLY 38 H GLY 38 53.697 33.335 38.741 261 HA2 GLY 38 HA2 GLY 38 51.267 34.820 37.855 262 HA3 GLY 38 HA3 GLY 38 51.339 33.149 38.426 263 H GLY 39 H GLY 39 53.094 34.742 40.683 264 HA2 GLY 39 HA2 GLY 39 52.750 35.597 42.757 265 HA3 GLY 39 HA3 GLY 39 51.123 36.082 42.283 266 H ASP 40 H ASP 40 50.167 33.320 41.694 267 HA ASP 40 HA ASP 40 50.579 31.797 44.192 268 HB2 ASP 40 HB2 ASP 40 48.590 33.524 44.345 269 HB3 ASP 40 HB3 ASP 40 47.743 32.392 43.299 270 H SER 41 H SER 41 50.320 29.550 43.896 271 HA SER 41 HA SER 41 50.180 28.471 41.232 272 HB2 SER 41 HB2 SER 41 50.128 26.303 42.386 273 HB3 SER 41 HB3 SER 41 51.357 27.364 43.105 274 HG SER 41 HG SER 41 50.070 26.339 44.692 275 H GLN 42 H GLN 42 47.659 29.036 43.686 276 HA GLN 42 HA GLN 42 45.558 27.580 42.321 277 HB2 GLN 42 HB2 GLN 42 45.489 29.998 44.178 278 HB3 GLN 42 HB3 GLN 42 44.052 29.197 43.536 279 HG2 GLN 42 HG2 GLN 42 44.838 27.055 44.629 280 HG3 GLN 42 HG3 GLN 42 46.166 27.985 45.344 281 HE21 GLN 42 HE21 GLN 42 45.278 27.373 47.487 282 HE22 GLN 42 HE22 GLN 42 43.895 28.303 48.089 283 H LEU 43 H LEU 43 46.840 30.880 41.983 284 HA LEU 43 HA LEU 43 44.860 31.704 40.040 285 HB2 LEU 43 HB2 LEU 43 46.135 33.194 41.628 286 HB3 LEU 43 HB3 LEU 43 47.570 32.962 40.646 287 HG LEU 43 HG LEU 43 46.307 35.103 40.349 288 HD11 LEU 43 HD11 LEU 43 46.416 33.603 37.724 289 HD12 LEU 43 HD12 LEU 43 47.837 34.275 38.563 290 HD13 LEU 43 HD13 LEU 43 46.537 35.340 38.004 291 HD21 LEU 43 HD21 LEU 43 44.254 33.491 38.830 292 HD22 LEU 43 HD22 LEU 43 44.287 35.243 39.103 293 HD23 LEU 43 HD23 LEU 43 44.025 34.147 40.476 294 H GLY 44 H GLY 44 48.173 30.320 39.865 295 HA2 GLY 44 HA2 GLY 44 48.480 30.292 37.044 296 HA3 GLY 44 HA3 GLY 44 49.149 29.097 38.166 297 H LEU 45 H LEU 45 47.047 27.702 39.119 298 HA LEU 45 HA LEU 45 46.130 25.995 37.019 299 HB2 LEU 45 HB2 LEU 45 45.414 26.421 39.916 300 HB3 LEU 45 HB3 LEU 45 44.216 25.619 38.916 301 HG LEU 45 HG LEU 45 45.866 23.915 38.220 302 HD11 LEU 45 HD11 LEU 45 47.938 23.663 39.523 303 HD12 LEU 45 HD12 LEU 45 47.637 25.200 40.341 304 HD13 LEU 45 HD13 LEU 45 47.958 25.160 38.580 305 HD21 LEU 45 HD21 LEU 45 45.908 22.730 40.392 306 HD22 LEU 45 HD22 LEU 45 44.338 23.496 40.099 307 HD23 LEU 45 HD23 LEU 45 45.497 24.242 41.226 308 H ARG 46 H ARG 46 44.387 28.641 38.668 309 HA ARG 46 HA ARG 46 41.976 28.544 37.134 310 HB2 ARG 46 HB2 ARG 46 42.226 29.692 39.297 311 HB3 ARG 46 HB3 ARG 46 43.367 30.838 38.580 312 HG2 ARG 46 HG2 ARG 46 41.541 31.628 37.033 313 HG3 ARG 46 HG3 ARG 46 40.418 30.549 37.870 314 HD2 ARG 46 HD2 ARG 46 42.052 32.815 39.117 315 HD3 ARG 46 HD3 ARG 46 40.376 32.923 38.622 316 HE ARG 46 HE ARG 46 41.403 31.829 41.098 317 HH11 ARG 46 HH11 ARG 46 38.688 31.307 38.884 318 HH12 ARG 46 HH12 ARG 46 37.725 30.623 40.149 319 HH21 ARG 46 HH21 ARG 46 40.077 31.059 42.630 320 HH22 ARG 46 HH22 ARG 46 38.425 30.635 42.228 321 H MET 47 H MET 47 44.990 30.388 36.569 322 HA MET 47 HA MET 47 44.054 31.868 34.329 323 HB2 MET 47 HB2 MET 47 45.977 32.622 35.480 324 HB3 MET 47 HB3 MET 47 46.814 31.086 35.310 325 HG2 MET 47 HG2 MET 47 46.100 32.844 32.943 326 HG3 MET 47 HG3 MET 47 47.592 33.033 33.853 327 HE1 MET 47 HE1 MET 47 49.632 29.822 33.061 328 HE2 MET 47 HE2 MET 47 49.540 31.342 33.973 329 HE3 MET 47 HE3 MET 47 48.529 29.948 34.438 330 H LEU 48 H LEU 48 45.751 28.698 34.496 331 HA LEU 48 HA LEU 48 45.612 28.252 31.671 332 HB2 LEU 48 HB2 LEU 48 47.109 26.995 33.071 333 HB3 LEU 48 HB3 LEU 48 45.777 26.351 34.033 334 HG LEU 48 HG LEU 48 44.961 25.041 32.158 335 HD11 LEU 48 HD11 LEU 48 47.216 26.244 30.540 336 HD12 LEU 48 HD12 LEU 48 45.487 26.415 30.209 337 HD13 LEU 48 HD13 LEU 48 46.237 24.837 30.057 338 HD21 LEU 48 HD21 LEU 48 46.844 23.503 31.926 339 HD22 LEU 48 HD22 LEU 48 46.747 24.116 33.580 340 HD23 LEU 48 HD23 LEU 48 47.978 24.760 32.475 341 H ALA 49 H ALA 49 43.239 27.345 34.274 342 HA ALA 49 HA ALA 49 41.381 26.108 32.491 343 HB1 ALA 49 HB1 ALA 49 39.772 26.435 34.323 344 HB2 ALA 49 HB2 ALA 49 41.332 25.863 34.945 345 HB3 ALA 49 HB3 ALA 49 40.879 27.574 35.116 346 H GLN 50 H GLN 50 41.729 29.565 33.396 347 HA GLN 50 HA GLN 50 39.441 30.453 31.877 348 HB2 GLN 50 HB2 GLN 50 41.856 31.799 33.110 349 HB3 GLN 50 HB3 GLN 50 40.749 32.714 32.091 350 HG2 GLN 50 HG2 GLN 50 39.720 31.099 34.463 351 HG3 GLN 50 HG3 GLN 50 40.320 32.751 34.633 352 HE21 GLN 50 HE21 GLN 50 37.663 30.794 33.196 353 HE22 GLN 50 HE22 GLN 50 36.750 32.210 32.676 354 H LEU 51 H LEU 51 42.960 30.402 31.021 355 HA LEU 51 HA LEU 51 42.631 31.383 28.360 356 HB2 LEU 51 HB2 LEU 51 44.779 31.213 29.524 357 HB3 LEU 51 HB3 LEU 51 44.628 29.454 29.611 358 HG LEU 51 HG LEU 51 44.664 29.468 27.036 359 HD11 LEU 51 HD11 LEU 51 45.775 32.268 27.502 360 HD12 LEU 51 HD12 LEU 51 44.214 31.910 26.737 361 HD13 LEU 51 HD13 LEU 51 45.715 31.394 25.957 362 HD21 LEU 51 HD21 LEU 51 46.554 28.720 28.356 363 HD22 LEU 51 HD22 LEU 51 47.077 30.394 28.633 364 HD23 LEU 51 HD23 LEU 51 47.146 29.687 26.997 365 H ARG 52 H ARG 52 42.554 28.013 29.616 366 HA ARG 52 HA ARG 52 42.115 26.699 27.154 367 HB2 ARG 52 HB2 ARG 52 42.761 25.607 29.270 368 HB3 ARG 52 HB3 ARG 52 41.141 25.914 29.932 369 HG2 ARG 52 HG2 ARG 52 40.155 24.561 28.084 370 HG3 ARG 52 HG3 ARG 52 41.772 24.312 27.423 371 HD2 ARG 52 HD2 ARG 52 42.460 23.172 29.479 372 HD3 ARG 52 HD3 ARG 52 40.866 23.438 30.204 373 HE ARG 52 HE ARG 52 39.962 22.086 28.211 374 HH11 ARG 52 HH11 ARG 52 43.109 21.360 29.648 375 HH12 ARG 52 HH12 ARG 52 43.084 19.724 29.048 376 HH21 ARG 52 HH21 ARG 52 40.125 20.050 27.350 377 HH22 ARG 52 HH22 ARG 52 41.368 18.960 27.948 378 H GLU 53 H GLU 53 39.644 27.871 29.495 379 HA GLU 53 HA GLU 53 37.482 27.026 27.746 380 HB2 GLU 53 HB2 GLU 53 37.500 28.755 30.225 381 HB3 GLU 53 HB3 GLU 53 36.051 28.164 29.415 382 HG2 GLU 53 HG2 GLU 53 38.228 26.372 30.602 383 HG3 GLU 53 HG3 GLU 53 36.717 26.765 31.390 384 H ARG 54 H ARG 54 39.128 30.152 28.161 385 HA ARG 54 HA ARG 54 37.097 31.534 26.524 386 HB2 ARG 54 HB2 ARG 54 39.647 32.538 27.837 387 HB3 ARG 54 HB3 ARG 54 38.416 33.556 27.090 388 HG2 ARG 54 HG2 ARG 54 36.698 32.870 28.692 389 HG3 ARG 54 HG3 ARG 54 37.776 31.703 29.436 390 HD2 ARG 54 HD2 ARG 54 37.758 33.501 30.907 391 HD3 ARG 54 HD3 ARG 54 39.304 33.610 30.076 392 HE ARG 54 HE ARG 54 38.548 35.559 28.917 393 HH11 ARG 54 HH11 ARG 54 35.916 34.514 31.060 394 HH12 ARG 54 HH12 ARG 54 35.264 36.162 31.000 395 HH21 ARG 54 HH21 ARG 54 37.641 37.442 29.003 396 HH22 ARG 54 HH22 ARG 54 36.216 37.729 30.026 397 H HIS 55 H HIS 55 40.352 30.326 26.017 398 HA HIS 55 HA HIS 55 40.375 31.483 23.254 399 HB2 HIS 55 HB2 HIS 55 41.909 32.487 24.973 400 HB3 HIS 55 HB3 HIS 55 42.685 30.961 25.147 401 HD1 HIS 55 HD1 HIS 55 42.909 30.461 21.828 402 HD2 HIS 55 HD2 HIS 55 44.034 33.780 24.123 403 HE1 HIS 55 HE1 HIS 55 44.753 31.658 20.514 404 H GLY 56 H GLY 56 40.597 28.454 25.082 405 HA2 GLY 56 HA2 GLY 56 40.543 26.304 24.197 406 HA3 GLY 56 HA3 GLY 56 40.606 26.961 22.564 407 H VAL 57 H VAL 57 42.823 26.901 25.439 408 HA VAL 57 HA VAL 57 45.005 25.830 23.752 409 HB VAL 57 HB VAL 57 45.645 28.245 25.443 410 HG11 VAL 57 HG11 VAL 57 46.919 27.030 22.956 411 HG12 VAL 57 HG12 VAL 57 47.509 28.456 23.831 412 HG13 VAL 57 HG13 VAL 57 47.509 26.885 24.626 413 HG21 VAL 57 HG21 VAL 57 43.977 29.172 23.937 414 HG22 VAL 57 HG22 VAL 57 45.582 29.721 23.474 415 HG23 VAL 57 HG23 VAL 57 44.790 28.443 22.531 416 H ASP 58 H ASP 58 46.613 24.768 24.927 417 HA ASP 58 HA ASP 58 46.092 24.392 27.839 418 HB2 ASP 58 HB2 ASP 58 46.012 22.425 26.072 419 HB3 ASP 58 HB3 ASP 58 47.755 22.532 26.152 420 H LEU 59 H LEU 59 48.000 24.069 29.160 421 HA LEU 59 HA LEU 59 50.580 25.158 28.100 422 HB2 LEU 59 HB2 LEU 59 49.435 25.713 30.849 423 HB3 LEU 59 HB3 LEU 59 51.059 26.103 30.309 424 HG LEU 59 HG LEU 59 48.536 27.287 29.069 425 HD11 LEU 59 HD11 LEU 59 49.209 29.339 30.263 426 HD12 LEU 59 HD12 LEU 59 50.540 28.447 31.044 427 HD13 LEU 59 HD13 LEU 59 48.850 28.027 31.389 428 HD21 LEU 59 HD21 LEU 59 50.370 27.280 27.486 429 HD22 LEU 59 HD22 LEU 59 51.482 27.965 28.694 430 HD23 LEU 59 HD23 LEU 59 50.104 28.915 28.075 431 HA PRO 60 HA PRO 60 50.830 20.841 29.395 432 HB2 PRO 60 HB2 PRO 60 53.231 20.806 27.588 433 HB3 PRO 60 HB3 PRO 60 51.860 19.659 27.673 434 HG2 PRO 60 HG2 PRO 60 52.006 21.468 25.676 435 HG3 PRO 60 HG3 PRO 60 50.437 21.102 26.481 436 HD2 PRO 60 HD2 PRO 60 52.314 23.424 26.992 437 HD3 PRO 60 HD3 PRO 60 50.543 23.433 26.747 438 H LEU 61 H LEU 61 52.064 19.697 30.836 439 HA LEU 61 HA LEU 61 53.793 21.085 32.620 440 HB2 LEU 61 HB2 LEU 61 53.179 18.146 32.117 441 HB3 LEU 61 HB3 LEU 61 54.392 18.623 33.285 442 HG LEU 61 HG LEU 61 52.270 18.114 34.344 443 HD11 LEU 61 HD11 LEU 61 53.812 19.729 35.400 444 HD12 LEU 61 HD12 LEU 61 52.117 20.027 35.815 445 HD13 LEU 61 HD13 LEU 61 52.930 21.062 34.630 446 HD21 LEU 61 HD21 LEU 61 50.690 18.860 32.606 447 HD22 LEU 61 HD22 LEU 61 51.098 20.554 32.975 448 HD23 LEU 61 HD23 LEU 61 50.316 19.530 34.198 449 H ARG 62 H ARG 62 54.623 18.917 29.870 450 HA ARG 62 HA ARG 62 57.459 19.080 30.200 451 HB2 ARG 62 HB2 ARG 62 55.682 18.540 27.790 452 HB3 ARG 62 HB3 ARG 62 57.437 18.600 27.656 453 HG2 ARG 62 HG2 ARG 62 57.747 16.846 29.242 454 HG3 ARG 62 HG3 ARG 62 56.036 16.822 29.692 455 HD2 ARG 62 HD2 ARG 62 55.378 15.938 27.574 456 HD3 ARG 62 HD3 ARG 62 56.942 16.313 26.854 457 HE ARG 62 HE ARG 62 57.983 14.579 28.230 458 HH11 ARG 62 HH11 ARG 62 54.492 14.283 28.382 459 HH12 ARG 62 HH12 ARG 62 54.540 12.549 28.156 460 HH21 ARG 62 HH21 ARG 62 57.973 12.382 28.287 461 HH22 ARG 62 HH22 ARG 62 56.447 11.506 28.265 462 H CYS 63 H CYS 63 55.243 21.375 28.575 463 HA CYS 63 HA CYS 63 57.452 22.931 27.511 464 HB2 CYS 63 HB2 CYS 63 54.557 23.810 27.692 465 HB3 CYS 63 HB3 CYS 63 55.845 24.464 26.699 466 HG CYS 63 HG CYS 63 56.324 22.038 25.477 467 H LEU 64 H LEU 64 55.430 23.188 30.465 468 HA LEU 64 HA LEU 64 56.776 25.563 31.521 469 HB2 LEU 64 HB2 LEU 64 55.178 23.275 32.732 470 HB3 LEU 64 HB3 LEU 64 56.098 24.343 33.765 471 HG LEU 64 HG LEU 64 53.852 25.055 33.780 472 HD11 LEU 64 HD11 LEU 64 55.368 27.075 32.097 473 HD12 LEU 64 HD12 LEU 64 55.644 26.798 33.829 474 HD13 LEU 64 HD13 LEU 64 54.067 27.380 33.253 475 HD21 LEU 64 HD21 LEU 64 53.998 25.448 30.772 476 HD22 LEU 64 HD22 LEU 64 52.665 25.926 31.851 477 HD23 LEU 64 HD23 LEU 64 53.053 24.212 31.635 478 H TYR 65 H TYR 65 57.515 22.094 31.690 479 HA TYR 65 HA TYR 65 59.722 22.304 33.477 480 HB2 TYR 65 HB2 TYR 65 58.434 20.276 33.091 481 HB3 TYR 65 HB3 TYR 65 58.940 20.221 31.411 482 HD1 TYR 65 HD1 TYR 65 61.154 19.448 30.756 483 HD2 TYR 65 HD2 TYR 65 59.991 19.728 34.903 484 HE1 TYR 65 HE1 TYR 65 63.122 18.087 31.400 485 HE2 TYR 65 HE2 TYR 65 61.956 18.371 35.546 486 HH TYR 65 HH TYR 65 63.851 17.401 34.852 487 H GLU 66 H GLU 66 59.645 22.446 29.876 488 HA GLU 66 HA GLU 66 62.581 22.879 29.886 489 HB2 GLU 66 HB2 GLU 66 62.568 22.611 27.552 490 HB3 GLU 66 HB3 GLU 66 61.629 21.325 28.288 491 HG2 GLU 66 HG2 GLU 66 59.537 22.708 27.688 492 HG3 GLU 66 HG3 GLU 66 60.601 23.742 26.746 493 H ALA 67 H ALA 67 59.709 24.890 29.524 494 HA ALA 67 HA ALA 67 61.370 27.317 29.248 495 HB1 ALA 67 HB1 ALA 67 60.078 27.957 27.225 496 HB2 ALA 67 HB2 ALA 67 61.025 26.480 26.957 497 HB3 ALA 67 HB3 ALA 67 59.273 26.381 27.246 498 HA PRO 68 HA PRO 68 57.506 28.095 31.784 499 HB2 PRO 68 HB2 PRO 68 58.565 28.769 34.179 500 HB3 PRO 68 HB3 PRO 68 58.477 27.062 33.669 501 HG2 PRO 68 HG2 PRO 68 60.825 28.980 33.365 502 HG3 PRO 68 HG3 PRO 68 60.834 27.365 34.127 503 HD2 PRO 68 HD2 PRO 68 61.567 27.787 31.524 504 HD3 PRO 68 HD3 PRO 68 60.720 26.289 32.015 505 H THR 69 H THR 69 60.145 29.932 30.669 506 HA THR 69 HA THR 69 59.347 32.539 31.721 507 HB THR 69 HB THR 69 61.127 32.863 29.535 508 HG1 THR 69 HG1 THR 69 62.475 31.106 31.143 509 HG21 THR 69 HG21 THR 69 61.678 32.694 32.526 510 HG22 THR 69 HG22 THR 69 61.120 34.117 31.641 511 HG23 THR 69 HG23 THR 69 62.726 33.462 31.302 512 H VAL 70 H VAL 70 57.870 33.848 30.796 513 HA VAL 70 HA VAL 70 56.046 32.539 29.221 514 HB VAL 70 HB VAL 70 54.787 34.679 29.055 515 HG11 VAL 70 HG11 VAL 70 55.792 33.699 31.740 516 HG12 VAL 70 HG12 VAL 70 54.355 34.726 31.491 517 HG13 VAL 70 HG13 VAL 70 54.406 33.096 30.814 518 HG21 VAL 70 HG21 VAL 70 57.079 35.793 30.751 519 HG22 VAL 70 HG22 VAL 70 56.673 36.292 29.094 520 HG23 VAL 70 HG23 VAL 70 55.533 36.582 30.411 521 H ALA 71 H ALA 71 58.522 34.669 27.809 522 HA ALA 71 HA ALA 71 57.144 34.793 25.229 523 HB1 ALA 71 HB1 ALA 71 60.074 35.257 25.933 524 HB2 ALA 71 HB2 ALA 71 59.276 35.683 24.404 525 HB3 ALA 71 HB3 ALA 71 58.793 36.492 25.906 526 H ARG 72 H ARG 72 59.774 32.787 26.566 527 HA ARG 72 HA ARG 72 60.150 31.057 24.271 528 HB2 ARG 72 HB2 ARG 72 60.717 30.615 27.244 529 HB3 ARG 72 HB3 ARG 72 61.191 29.519 25.942 530 HG2 ARG 72 HG2 ARG 72 62.645 31.217 24.957 531 HG3 ARG 72 HG3 ARG 72 62.137 32.403 26.169 532 HD2 ARG 72 HD2 ARG 72 64.318 31.438 26.758 533 HD3 ARG 72 HD3 ARG 72 63.080 31.073 27.962 534 HE ARG 72 HE ARG 72 63.902 29.077 25.861 535 HH11 ARG 72 HH11 ARG 72 63.535 29.716 29.300 536 HH12 ARG 72 HH12 ARG 72 63.612 28.009 29.682 537 HH21 ARG 72 HH21 ARG 72 64.024 27.048 26.409 538 HH22 ARG 72 HH22 ARG 72 63.662 26.511 28.052 539 H LEU 73 H LEU 73 58.194 30.788 27.223 540 HA LEU 73 HA LEU 73 56.862 28.356 26.847 541 HB2 LEU 73 HB2 LEU 73 56.748 29.889 28.850 542 HB3 LEU 73 HB3 LEU 73 55.838 31.006 27.869 543 HG LEU 73 HG LEU 73 54.162 28.932 27.574 544 HD11 LEU 73 HD11 LEU 73 55.575 27.361 28.883 545 HD12 LEU 73 HD12 LEU 73 54.013 27.658 29.680 546 HD13 LEU 73 HD13 LEU 73 55.491 28.462 30.269 547 HD21 LEU 73 HD21 LEU 73 54.321 30.659 30.071 548 HD22 LEU 73 HD22 LEU 73 52.873 29.872 29.400 549 HD23 LEU 73 HD23 LEU 73 53.670 31.171 28.493 550 H ALA 74 H ALA 74 55.560 31.626 25.877 551 HA ALA 74 HA ALA 74 53.337 30.707 24.438 552 HB1 ALA 74 HB1 ALA 74 53.830 33.051 25.144 553 HB2 ALA 74 HB2 ALA 74 55.086 33.145 23.877 554 HB3 ALA 74 HB3 ALA 74 53.384 32.943 23.419 555 H GLU 75 H GLU 75 56.701 31.179 23.315 556 HA GLU 75 HA GLU 75 56.224 30.540 20.566 557 HB2 GLU 75 HB2 GLU 75 58.162 31.764 21.503 558 HB3 GLU 75 HB3 GLU 75 58.734 30.285 22.258 559 HG2 GLU 75 HG2 GLU 75 58.852 29.250 19.945 560 HG3 GLU 75 HG3 GLU 75 58.387 30.846 19.311 561 H THR 76 H THR 76 57.096 28.382 23.362 562 HA THR 76 HA THR 76 57.183 25.967 21.776 563 HB THR 76 HB THR 76 56.760 24.687 23.828 564 HG1 THR 76 HG1 THR 76 56.108 27.167 24.891 565 HG21 THR 76 HG21 THR 76 59.065 25.459 23.305 566 HG22 THR 76 HG22 THR 76 58.756 25.246 25.039 567 HG23 THR 76 HG23 THR 76 58.786 26.877 24.344 568 H ILE 77 H ILE 77 54.446 27.608 23.426 569 HA ILE 77 HA ILE 77 52.568 25.525 22.841 570 HB ILE 77 HB ILE 77 52.003 28.484 23.252 571 HG12 ILE 77 HG12 ILE 77 53.153 27.762 25.216 572 HG13 ILE 77 HG13 ILE 77 51.463 27.853 25.595 573 HG21 ILE 77 HG21 ILE 77 49.774 27.683 24.016 574 HG22 ILE 77 HG22 ILE 77 50.052 27.367 22.304 575 HG23 ILE 77 HG23 ILE 77 50.183 26.044 23.482 576 HD11 ILE 77 HD11 ILE 77 51.321 25.344 25.394 577 HD12 ILE 77 HD12 ILE 77 53.075 25.308 25.092 578 HD13 ILE 77 HD13 ILE 77 52.455 25.898 26.639 579 H VAL 78 H VAL 78 53.417 28.499 20.962 580 HA VAL 78 HA VAL 78 51.573 27.825 18.814 581 HB VAL 78 HB VAL 78 53.929 29.739 18.863 582 HG11 VAL 78 HG11 VAL 78 51.710 29.404 16.784 583 HG12 VAL 78 HG12 VAL 78 52.840 30.772 16.863 584 HG13 VAL 78 HG13 VAL 78 53.452 29.156 16.518 585 HG21 VAL 78 HG21 VAL 78 52.166 31.460 19.032 586 HG22 VAL 78 HG22 VAL 78 50.914 30.197 19.058 587 HG23 VAL 78 HG23 VAL 78 52.076 30.343 20.392 588 H ARG 79 H ARG 79 55.021 27.081 19.347 589 HA ARG 79 HA ARG 79 55.565 25.927 16.775 590 HB2 ARG 79 HB2 ARG 79 57.344 26.649 18.292 591 HB3 ARG 79 HB3 ARG 79 56.780 25.546 19.536 592 HG2 ARG 79 HG2 ARG 79 58.722 24.594 18.719 593 HG3 ARG 79 HG3 ARG 79 57.456 23.604 18.035 594 HD2 ARG 79 HD2 ARG 79 58.939 25.832 16.598 595 HD3 ARG 79 HD3 ARG 79 59.331 24.105 16.496 596 HE ARG 79 HE ARG 79 56.734 24.087 15.692 597 HH11 ARG 79 HH11 ARG 79 59.525 25.898 14.522 598 HH12 ARG 79 HH12 ARG 79 58.770 26.148 12.965 599 HH21 ARG 79 HH21 ARG 79 55.885 24.461 13.695 600 HH22 ARG 79 HH22 ARG 79 56.740 25.488 12.563 601 H LEU 80 H LEU 80 54.476 24.461 19.818 602 HA LEU 80 HA LEU 80 54.439 21.774 18.562 603 HB2 LEU 80 HB2 LEU 80 54.369 22.603 21.484 604 HB3 LEU 80 HB3 LEU 80 54.578 20.974 20.878 605 HG LEU 80 HG LEU 80 56.574 23.232 20.415 606 HD11 LEU 80 HD11 LEU 80 56.691 20.872 22.316 607 HD12 LEU 80 HD12 LEU 80 56.427 22.567 22.779 608 HD13 LEU 80 HD13 LEU 80 57.968 22.086 22.041 609 HD21 LEU 80 HD21 LEU 80 58.098 21.462 19.685 610 HD22 LEU 80 HD22 LEU 80 56.660 21.452 18.656 611 HD23 LEU 80 HD23 LEU 80 56.844 20.236 19.937 612 H ALA 81 H ALA 81 52.168 24.148 19.391 613 HA ALA 81 HA ALA 81 49.917 24.207 19.516 614 HB1 ALA 81 HB1 ALA 81 50.441 23.810 17.161 615 HB2 ALA 81 HB2 ALA 81 50.264 22.057 17.411 616 HB3 ALA 81 HB3 ALA 81 48.859 23.132 17.603 617 H ALA 82 H ALA 82 50.043 23.336 21.762 618 HA ALA 82 HA ALA 82 49.173 20.623 22.288 619 HB1 ALA 82 HB1 ALA 82 49.077 21.389 24.591 620 HB2 ALA 82 HB2 ALA 82 50.584 21.911 23.817 621 HB3 ALA 82 HB3 ALA 82 49.266 23.081 24.076 622 HA PRO 83 HA PRO 83 44.951 21.899 21.277 623 HB2 PRO 83 HB2 PRO 83 43.710 19.493 21.116 624 HB3 PRO 83 HB3 PRO 83 44.932 20.014 19.913 625 HG2 PRO 83 HG2 PRO 83 45.345 18.214 22.325 626 HG3 PRO 83 HG3 PRO 83 45.881 17.946 20.640 627 HD2 PRO 83 HD2 PRO 83 47.509 19.012 22.583 628 HD3 PRO 83 HD3 PRO 83 47.646 19.457 20.856 629 H ALA 84 H ALA 84 43.313 22.589 22.526 630 HA ALA 84 HA ALA 84 42.142 20.941 24.570 631 HB1 ALA 84 HB1 ALA 84 42.401 22.483 26.451 632 HB2 ALA 84 HB2 ALA 84 43.929 21.779 25.967 633 HB3 ALA 84 HB3 ALA 84 43.547 23.465 25.512 634 HA PRO 85 HA PRO 85 39.583 23.996 22.189 635 HB2 PRO 85 HB2 PRO 85 37.661 22.280 21.209 636 HB3 PRO 85 HB3 PRO 85 39.249 22.555 20.427 637 HG2 PRO 85 HG2 PRO 85 38.466 20.322 22.330 638 HG3 PRO 85 HG3 PRO 85 39.309 20.195 20.749 639 HD2 PRO 85 HD2 PRO 85 40.687 20.184 23.069 640 HD3 PRO 85 HD3 PRO 85 41.318 21.051 21.638 641 H SER 86 H SER 86 37.599 24.904 22.592 642 HA SER 86 HA SER 86 35.845 23.874 24.722 643 HB2 SER 86 HB2 SER 86 37.203 26.590 24.958 644 HB3 SER 86 HB3 SER 86 35.936 25.958 26.024 645 HG SER 86 HG SER 86 38.567 25.621 26.159 646 H GLY 87 H GLY 87 33.760 24.414 24.315 647 HA2 GLY 87 HA2 GLY 87 32.771 26.804 23.131 648 HA3 GLY 87 HA3 GLY 87 33.027 25.634 21.835 649 H ASP 88 H ASP 88 32.099 24.062 24.758 650 HA ASP 88 HA ASP 88 29.185 24.245 24.183 651 HB2 ASP 88 HB2 ASP 88 30.302 22.454 22.769 652 HB3 ASP 88 HB3 ASP 88 30.718 21.615 24.266 653 H GLN 89 H GLN 89 31.755 23.339 26.421 654 HA GLN 89 HA GLN 89 29.811 23.039 28.631 655 HB2 GLN 89 HB2 GLN 89 32.827 23.028 28.702 656 HB3 GLN 89 HB3 GLN 89 31.747 22.609 30.031 657 HG2 GLN 89 HG2 GLN 89 30.926 20.639 28.847 658 HG3 GLN 89 HG3 GLN 89 31.870 21.054 27.408 659 HE21 GLN 89 HE21 GLN 89 34.345 21.607 28.114 660 HE22 GLN 89 HE22 GLN 89 35.068 20.318 29.028 661 H ASP 90 H ASP 90 29.948 24.474 30.521 662 HA ASP 90 HA ASP 90 31.520 26.891 30.433 663 HB2 ASP 90 HB2 ASP 90 29.724 27.527 28.838 664 HB3 ASP 90 HB3 ASP 90 28.509 27.174 30.070 665 H ASP 91 H ASP 91 31.372 28.190 32.288 666 HA ASP 91 HA ASP 91 29.962 27.107 34.672 667 HB2 ASP 91 HB2 ASP 91 31.913 27.471 35.992 668 HB3 ASP 91 HB3 ASP 91 32.354 26.507 34.596 669 H ALA 92 H ALA 92 29.605 29.595 32.731 670 HA ALA 92 HA ALA 92 28.952 31.743 32.893 671 HB1 ALA 92 HB1 ALA 92 27.750 30.605 35.441 672 HB2 ALA 92 HB2 ALA 92 27.155 32.041 34.563 673 HB3 ALA 92 HB3 ALA 92 27.091 30.438 33.804 674 H SER 93 H SER 93 31.651 31.414 34.019 675 HA SER 93 HA SER 93 31.754 33.606 36.045 676 HB2 SER 93 HB2 SER 93 33.199 30.956 36.294 677 HB3 SER 93 HB3 SER 93 33.296 32.354 37.388 678 HG SER 93 HG SER 93 30.948 30.847 36.766 679 H GLU 94 H GLU 94 33.733 34.581 36.352 680 HA GLU 94 HA GLU 94 35.859 34.368 34.285 681 HB2 GLU 94 HB2 GLU 94 35.657 36.784 33.794 682 HB3 GLU 94 HB3 GLU 94 34.221 35.885 33.318 683 HG2 GLU 94 HG2 GLU 94 33.089 36.645 35.448 684 HG3 GLU 94 HG3 GLU 94 34.527 37.593 35.832 685 H TYR 95 H TYR 95 37.688 36.021 34.890 686 HA TYR 95 HA TYR 95 37.709 36.613 37.806 687 HB2 TYR 95 HB2 TYR 95 38.768 34.301 37.197 688 HB3 TYR 95 HB3 TYR 95 40.118 35.259 36.603 689 HD1 TYR 95 HD1 TYR 95 41.658 36.314 38.199 690 HD2 TYR 95 HD2 TYR 95 37.987 34.485 39.558 691 HE1 TYR 95 HE1 TYR 95 42.432 36.489 40.553 692 HE2 TYR 95 HE2 TYR 95 38.782 34.640 41.911 693 HH TYR 95 HH TYR 95 41.924 36.153 42.725 694 H GLU 96 H GLU 96 38.753 37.504 34.620 695 HA GLU 96 HA GLU 96 40.519 39.652 35.450 696 HB2 GLU 96 HB2 GLU 96 40.453 38.579 33.227 697 HB3 GLU 96 HB3 GLU 96 38.851 39.246 32.927 698 HG2 GLU 96 HG2 GLU 96 41.056 41.166 33.670 699 HG3 GLU 96 HG3 GLU 96 41.168 40.345 32.108 700 H GLU 97 H GLU 97 39.935 41.689 36.220 701 HA GLU 97 HA GLU 97 37.308 41.539 37.484 702 HB2 GLU 97 HB2 GLU 97 38.105 43.074 39.072 703 HB3 GLU 97 HB3 GLU 97 39.353 41.860 38.815 704 HG2 GLU 97 HG2 GLU 97 40.691 43.413 37.496 705 HG3 GLU 97 HG3 GLU 97 39.406 44.621 37.507 706 H GLY 98 H GLY 98 38.341 43.059 34.751 707 HA2 GLY 98 HA2 GLY 98 36.872 44.631 33.521 708 HA3 GLY 98 HA3 GLY 98 36.572 45.484 35.044 709 H VAL 99 H VAL 99 39.554 44.216 33.471 710 HA VAL 99 HA VAL 99 40.903 46.846 33.866 711 HB VAL 99 HB VAL 99 42.951 45.874 33.300 712 HG11 VAL 99 HG11 VAL 99 41.544 43.807 35.026 713 HG12 VAL 99 HG12 VAL 99 43.265 44.228 35.027 714 HG13 VAL 99 HG13 VAL 99 42.068 45.406 35.594 715 HG21 VAL 99 HG21 VAL 99 41.451 43.386 32.444 716 HG22 VAL 99 HG22 VAL 99 42.487 44.423 31.451 717 HG23 VAL 99 HG23 VAL 99 43.196 43.431 32.726 718 H ILE 100 H ILE 100 41.849 47.993 32.084 719 HA ILE 100 HA ILE 100 39.893 47.868 29.839 720 HB ILE 100 HB ILE 100 39.191 49.185 31.718 721 HG12 ILE 100 HG12 ILE 100 38.513 51.237 30.730 722 HG13 ILE 100 HG13 ILE 100 39.736 51.147 29.475 723 HG21 ILE 100 HG21 ILE 100 40.302 51.322 32.321 724 HG22 ILE 100 HG22 ILE 100 41.258 49.898 32.715 725 HG23 ILE 100 HG23 ILE 100 41.670 50.871 31.283 726 HD11 ILE 100 HD11 ILE 100 38.602 49.199 28.474 727 HD12 ILE 100 HD12 ILE 100 37.435 49.171 29.819 728 HD13 ILE 100 HD13 ILE 100 37.461 50.534 28.683 729 H ARG 101 H ARG 101 43.058 47.560 30.013 730 HA ARG 101 HA ARG 101 43.312 48.641 27.237 731 HB2 ARG 101 HB2 ARG 101 45.515 48.512 29.320 732 HB3 ARG 101 HB3 ARG 101 45.829 48.585 27.582 733 HG2 ARG 101 HG2 ARG 101 44.466 50.671 27.441 734 HG3 ARG 101 HG3 ARG 101 44.301 50.640 29.208 735 HD2 ARG 101 HD2 ARG 101 46.765 50.785 29.435 736 HD3 ARG 101 HD3 ARG 101 46.924 50.818 27.671 737 HE ARG 101 HE ARG 101 45.189 52.911 28.218 738 HH11 ARG 101 HH11 ARG 101 48.600 52.234 28.766 739 HH12 ARG 101 HH12 ARG 101 48.911 53.932 29.110 740 HH21 ARG 101 HH21 ARG 101 45.795 55.058 28.726 741 HH22 ARG 101 HH22 ARG 101 47.524 55.360 28.919
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