NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
599345 | 2myg | 25451 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H1 GLY 1 16.744 32.857 44.055 2 H2 GLY 1 H2 GLY 1 17.633 33.895 43.123 3 H3 GLY 1 H3 GLY 1 18.165 32.350 43.397 4 HA2 GLY 1 HA2 GLY 1 16.297 31.435 42.219 5 HA3 GLY 1 HA3 GLY 1 15.750 33.097 41.892 6 H ALA 2 H ALA 2 17.082 30.611 40.364 7 HA ALA 2 HA ALA 2 19.235 32.117 38.977 8 HB1 ALA 2 HB1 ALA 2 18.651 29.137 38.945 9 HB2 ALA 2 HB2 ALA 2 20.100 29.977 38.327 10 HB3 ALA 2 HB3 ALA 2 19.777 29.944 40.062 11 H MET 3 H MET 3 19.361 32.185 36.677 12 HA MET 3 HA MET 3 16.925 32.838 35.476 13 HB2 MET 3 HB2 MET 3 19.198 33.687 34.898 14 HB3 MET 3 HB3 MET 3 19.486 32.195 33.988 15 HG2 MET 3 HG2 MET 3 17.449 32.722 32.605 16 HG3 MET 3 HG3 MET 3 17.268 34.231 33.500 17 HE1 MET 3 HE1 MET 3 20.467 36.245 32.292 18 HE2 MET 3 HE2 MET 3 19.161 36.153 33.495 19 HE3 MET 3 HE3 MET 3 20.575 35.082 33.626 20 HA PRO 4 HA PRO 4 15.536 28.756 34.397 21 HB2 PRO 4 HB2 PRO 4 13.033 29.235 33.476 22 HB3 PRO 4 HB3 PRO 4 13.537 29.619 35.145 23 HG2 PRO 4 HG2 PRO 4 13.503 31.504 32.762 24 HG3 PRO 4 HG3 PRO 4 12.721 31.740 34.361 25 HD2 PRO 4 HD2 PRO 4 15.179 32.771 33.806 26 HD3 PRO 4 HD3 PRO 4 14.789 32.113 35.423 27 H SER 5 H SER 5 17.416 29.577 32.581 28 HA SER 5 HA SER 5 16.690 27.784 30.388 29 HB2 SER 5 HB2 SER 5 17.930 29.089 28.699 30 HB3 SER 5 HB3 SER 5 16.543 30.003 29.195 31 HG SER 5 HG SER 5 18.033 31.483 29.580 32 H ILE 6 H ILE 6 19.118 27.757 29.106 33 HA ILE 6 HA ILE 6 20.791 26.178 30.748 34 HB ILE 6 HB ILE 6 22.518 26.629 28.965 35 HG12 ILE 6 HG12 ILE 6 20.298 27.807 27.350 36 HG13 ILE 6 HG13 ILE 6 21.416 28.856 28.233 37 HG21 ILE 6 HG21 ILE 6 21.320 24.623 28.970 38 HG22 ILE 6 HG22 ILE 6 19.871 25.400 28.339 39 HG23 ILE 6 HG23 ILE 6 21.312 25.223 27.308 40 HD11 ILE 6 HD11 ILE 6 22.107 28.659 25.942 41 HD12 ILE 6 HD12 ILE 6 23.301 27.837 26.961 42 HD13 ILE 6 HD13 ILE 6 22.116 26.888 26.019 43 H ALA 7 H ALA 7 20.591 29.672 30.718 44 HA ALA 7 HA ALA 7 23.320 30.345 31.169 45 HB1 ALA 7 HB1 ALA 7 21.592 31.966 30.540 46 HB2 ALA 7 HB2 ALA 7 20.729 31.678 32.064 47 HB3 ALA 7 HB3 ALA 7 22.338 32.430 32.081 48 H SER 8 H SER 8 20.756 29.166 33.373 49 HA SER 8 HA SER 8 22.440 29.465 35.775 50 HB2 SER 8 HB2 SER 8 20.608 28.260 36.876 51 HB3 SER 8 HB3 SER 8 20.081 29.688 35.933 52 HG SER 8 HG SER 8 18.971 28.533 34.696 53 H MET 9 H MET 9 21.627 26.871 33.519 54 HA MET 9 HA MET 9 22.838 24.685 34.862 55 HB2 MET 9 HB2 MET 9 22.541 25.085 31.854 56 HB3 MET 9 HB3 MET 9 22.838 23.573 32.699 57 HG2 MET 9 HG2 MET 9 20.694 23.664 33.814 58 HG3 MET 9 HG3 MET 9 20.370 25.279 33.220 59 HE1 MET 9 HE1 MET 9 20.559 21.793 30.159 60 HE2 MET 9 HE2 MET 9 21.972 22.772 30.595 61 HE3 MET 9 HE3 MET 9 21.252 21.655 31.790 62 H ILE 10 H ILE 10 24.356 27.234 32.883 63 HA ILE 10 HA ILE 10 26.884 26.035 32.469 64 HB ILE 10 HB ILE 10 26.568 28.968 33.189 65 HG12 ILE 10 HG12 ILE 10 24.850 28.643 31.616 66 HG13 ILE 10 HG13 ILE 10 26.150 29.522 30.865 67 HG21 ILE 10 HG21 ILE 10 28.481 27.457 31.375 68 HG22 ILE 10 HG22 ILE 10 28.366 29.226 31.461 69 HG23 ILE 10 HG23 ILE 10 28.875 28.305 32.877 70 HD11 ILE 10 HD11 ILE 10 25.596 26.549 30.434 71 HD12 ILE 10 HD12 ILE 10 25.202 27.868 29.315 72 HD13 ILE 10 HD13 ILE 10 26.900 27.490 29.670 73 H LYS 11 H LYS 11 25.521 27.260 35.465 74 HA LYS 11 HA LYS 11 28.152 27.530 36.785 75 HB2 LYS 11 HB2 LYS 11 25.298 28.008 37.725 76 HB3 LYS 11 HB3 LYS 11 26.685 28.112 38.789 77 HG2 LYS 11 HG2 LYS 11 26.219 30.288 38.228 78 HG3 LYS 11 HG3 LYS 11 27.643 29.895 37.264 79 HD2 LYS 11 HD2 LYS 11 26.323 29.771 35.245 80 HD3 LYS 11 HD3 LYS 11 24.800 29.780 36.166 81 HE2 LYS 11 HE2 LYS 11 25.294 32.046 36.978 82 HE3 LYS 11 HE3 LYS 11 26.813 32.068 36.080 83 HZ1 LYS 11 HZ1 LYS 11 25.554 31.924 34.024 84 HZ2 LYS 11 HZ2 LYS 11 24.119 31.827 34.827 85 HZ3 LYS 11 HZ3 LYS 11 25.003 33.196 34.878 86 H GLY 12 H GLY 12 26.538 24.788 36.030 87 HA2 GLY 12 HA2 GLY 12 26.603 23.373 38.554 88 HA3 GLY 12 HA3 GLY 12 26.383 22.681 36.953 89 H ASN 13 H ASN 13 29.025 23.963 36.097 90 HA ASN 13 HA ASN 13 31.036 22.193 37.413 91 HB2 ASN 13 HB2 ASN 13 30.118 22.210 34.507 92 HB3 ASN 13 HB3 ASN 13 31.732 21.685 34.928 93 HD21 ASN 13 HD21 ASN 13 31.979 19.837 36.402 94 HD22 ASN 13 HD22 ASN 13 30.664 18.638 36.394 95 H LYS 14 H LYS 14 33.225 22.632 36.777 96 HA LYS 14 HA LYS 14 33.860 25.458 36.788 97 HB2 LYS 14 HB2 LYS 14 35.198 23.728 37.878 98 HB3 LYS 14 HB3 LYS 14 35.661 23.038 36.315 99 HG2 LYS 14 HG2 LYS 14 36.832 25.014 35.646 100 HG3 LYS 14 HG3 LYS 14 36.180 25.964 36.991 101 HD2 LYS 14 HD2 LYS 14 38.352 23.841 36.993 102 HD3 LYS 14 HD3 LYS 14 38.477 25.553 37.431 103 HE2 LYS 14 HE2 LYS 14 36.979 25.087 39.391 104 HE3 LYS 14 HE3 LYS 14 37.078 23.360 38.979 105 HZ1 LYS 14 HZ1 LYS 14 38.693 23.674 40.590 106 HZ2 LYS 14 HZ2 LYS 14 39.576 23.731 39.214 107 HZ3 LYS 14 HZ3 LYS 14 39.201 25.132 40.017 108 H VAL 15 H VAL 15 34.039 22.986 34.205 109 HA VAL 15 HA VAL 15 33.942 25.216 32.230 110 HB VAL 15 HB VAL 15 35.423 22.628 31.694 111 HG11 VAL 15 HG11 VAL 15 34.568 23.769 29.691 112 HG12 VAL 15 HG12 VAL 15 35.345 25.274 30.206 113 HG13 VAL 15 HG13 VAL 15 36.328 23.858 29.788 114 HG21 VAL 15 HG21 VAL 15 36.735 23.715 33.376 115 HG22 VAL 15 HG22 VAL 15 37.481 24.153 31.836 116 HG23 VAL 15 HG23 VAL 15 36.451 25.318 32.674 117 H VAL 16 H VAL 16 32.373 25.156 30.788 118 HA VAL 16 HA VAL 16 30.739 22.671 30.429 119 HB VAL 16 HB VAL 16 29.694 25.470 30.885 120 HG11 VAL 16 HG11 VAL 16 28.325 24.445 29.126 121 HG12 VAL 16 HG12 VAL 16 28.195 22.941 30.068 122 HG13 VAL 16 HG13 VAL 16 27.434 24.438 30.644 123 HG21 VAL 16 HG21 VAL 16 28.479 24.344 32.756 124 HG22 VAL 16 HG22 VAL 16 29.334 22.838 32.380 125 HG23 VAL 16 HG23 VAL 16 30.229 24.266 32.958 126 H VAL 17 H VAL 17 30.232 22.189 28.333 127 HA VAL 17 HA VAL 17 30.688 24.227 26.178 128 HB VAL 17 HB VAL 17 31.700 21.349 26.296 129 HG11 VAL 17 HG11 VAL 17 31.615 23.205 23.869 130 HG12 VAL 17 HG12 VAL 17 32.551 21.699 23.983 131 HG13 VAL 17 HG13 VAL 17 30.800 21.629 24.028 132 HG21 VAL 17 HG21 VAL 17 33.193 23.010 27.290 133 HG22 VAL 17 HG22 VAL 17 33.850 22.474 25.739 134 HG23 VAL 17 HG23 VAL 17 33.042 24.047 25.856 135 H PHE 18 H PHE 18 29.346 24.068 24.335 136 HA PHE 18 HA PHE 18 27.204 21.967 24.456 137 HB2 PHE 18 HB2 PHE 18 26.946 24.708 23.182 138 HB3 PHE 18 HB3 PHE 18 25.781 23.411 23.097 139 HD1 PHE 18 HD2 PHE 18 24.394 22.813 24.994 140 HD2 PHE 18 HD1 PHE 18 27.287 25.971 25.290 141 HE1 PHE 18 HE2 PHE 18 23.249 23.651 27.040 142 HE2 PHE 18 HE1 PHE 18 26.142 26.832 27.323 143 HZ PHE 18 HZ PHE 18 24.101 25.682 28.175 144 H SER 19 H SER 19 27.158 20.576 22.792 145 HA SER 19 HA SER 19 28.637 21.243 20.279 146 HB2 SER 19 HB2 SER 19 28.807 18.641 21.831 147 HB3 SER 19 HB3 SER 19 29.492 18.907 20.207 148 HG SER 19 HG SER 19 31.008 19.126 21.870 149 H TRP 20 H TRP 20 28.138 20.018 18.442 150 HA TRP 20 HA TRP 20 25.588 18.462 18.430 151 HB2 TRP 20 HB2 TRP 20 26.548 20.633 16.586 152 HB3 TRP 20 HB3 TRP 20 25.864 19.206 15.850 153 HD1 TRP 20 HD1 TRP 20 24.048 20.140 19.032 154 HE1 TRP 20 HE1 TRP 20 21.682 20.898 18.374 155 HE3 TRP 20 HE3 TRP 20 24.788 20.902 14.019 156 HZ2 TRP 20 HZ2 TRP 20 20.334 21.895 16.029 157 HZ3 TRP 20 HZ3 TRP 20 22.952 21.820 12.612 158 HH2 TRP 20 HH2 TRP 20 20.736 22.313 13.602 159 H VAL 21 H VAL 21 25.924 16.407 17.921 160 HA VAL 21 HA VAL 21 28.566 15.519 17.026 161 HB VAL 21 HB VAL 21 27.429 13.196 17.373 162 HG11 VAL 21 HG11 VAL 21 28.158 15.068 19.659 163 HG12 VAL 21 HG12 VAL 21 28.091 13.293 19.752 164 HG13 VAL 21 HG13 VAL 21 29.278 14.081 18.702 165 HG21 VAL 21 HG21 VAL 21 25.704 13.120 19.048 166 HG22 VAL 21 HG22 VAL 21 25.699 14.873 19.255 167 HG23 VAL 21 HG23 VAL 21 25.097 14.145 17.746 168 H THR 22 H THR 22 27.673 14.567 13.683 169 HA THR 22 HA THR 22 29.876 15.128 15.619 170 HB THR 22 HB THR 22 29.992 14.050 12.807 171 HG1 THR 22 HG1 THR 22 30.529 12.120 13.918 172 HG21 THR 22 HG21 THR 22 32.119 15.134 13.461 173 HG22 THR 22 HG22 THR 22 32.290 13.382 13.402 174 HG23 THR 22 HG23 THR 22 32.132 14.196 14.971 175 H CYS 23 H CYS 23 31.186 16.882 15.440 176 HA CYS 23 HA CYS 23 30.884 18.716 13.115 177 HB2 CYS 23 HB2 CYS 23 29.378 19.583 14.802 178 HB3 CYS 23 HB3 CYS 23 30.635 19.489 16.038 179 HG CYS 23 HG CYS 23 30.470 21.340 13.292 180 HA PRO 24 HA PRO 24 35.252 18.129 13.417 181 HB2 PRO 24 HB2 PRO 24 36.189 19.865 11.507 182 HB3 PRO 24 HB3 PRO 24 35.284 18.373 11.125 183 HG2 PRO 24 HG2 PRO 24 34.182 21.193 11.382 184 HG3 PRO 24 HG3 PRO 24 33.941 20.028 10.035 185 HD2 PRO 24 HD2 PRO 24 32.107 20.288 11.998 186 HD3 PRO 24 HD3 PRO 24 32.507 18.671 11.347 187 H TYR 25 H TYR 25 33.844 21.070 14.411 188 HA TYR 25 HA TYR 25 36.331 22.104 15.643 189 HB2 TYR 25 HB2 TYR 25 33.451 23.020 15.883 190 HB3 TYR 25 HB3 TYR 25 34.891 23.966 16.335 191 HD1 TYR 25 HD2 TYR 25 36.671 23.451 13.964 192 HD2 TYR 25 HD1 TYR 25 32.458 24.380 14.176 193 HE1 TYR 25 HE2 TYR 25 36.746 24.354 11.647 194 HE2 TYR 25 HE1 TYR 25 32.546 25.290 11.859 195 HH TYR 25 HH TYR 25 35.515 25.167 9.873 196 H CYS 26 H CYS 26 33.261 20.710 16.700 197 HA CYS 26 HA CYS 26 33.523 21.094 19.487 198 HB2 CYS 26 HB2 CYS 26 32.137 19.204 17.613 199 HB3 CYS 26 HB3 CYS 26 32.067 18.876 19.318 200 HG CYS 26 HG CYS 26 30.877 21.001 20.035 201 H VAL 27 H VAL 27 34.474 18.325 17.493 202 HA VAL 27 HA VAL 27 35.644 16.531 19.203 203 HB VAL 27 HB VAL 27 35.476 16.347 16.960 204 HG11 VAL 27 HG11 VAL 27 37.583 18.074 16.047 205 HG12 VAL 27 HG12 VAL 27 36.389 17.136 15.157 206 HG13 VAL 27 HG13 VAL 27 35.828 18.479 16.156 207 HG21 VAL 27 HG21 VAL 27 38.468 16.156 17.530 208 HG22 VAL 27 HG22 VAL 27 37.273 14.937 18.035 209 HG23 VAL 27 HG23 VAL 27 37.586 15.204 16.313 210 H ARG 28 H ARG 28 37.154 18.968 17.567 211 HA ARG 28 HA ARG 28 39.768 18.958 18.672 212 HB2 ARG 28 HB2 ARG 28 38.760 21.742 18.056 213 HB3 ARG 28 HB3 ARG 28 40.358 21.034 17.833 214 HG2 ARG 28 HG2 ARG 28 39.174 19.509 16.086 215 HG3 ARG 28 HG3 ARG 28 37.867 20.702 16.209 216 HD2 ARG 28 HD2 ARG 28 38.903 21.795 14.552 217 HD3 ARG 28 HD3 ARG 28 40.038 22.337 15.788 218 HE ARG 28 HE ARG 28 41.667 20.959 14.863 219 HH11 ARG 28 HH22 ARG 28 38.558 19.733 13.709 220 HH12 ARG 28 HH21 ARG 28 39.298 18.435 12.842 221 HH21 ARG 28 HH12 ARG 28 42.551 19.443 13.509 222 HH22 ARG 28 HH11 ARG 28 41.520 18.420 12.540 223 H ALA 29 H ALA 29 37.164 21.104 19.833 224 HA ALA 29 HA ALA 29 38.652 22.077 22.093 225 HB1 ALA 29 HB1 ALA 29 35.642 22.002 21.616 226 HB2 ALA 29 HB2 ALA 29 36.493 22.974 22.841 227 HB3 ALA 29 HB3 ALA 29 36.754 23.298 21.113 228 H GLU 30 H GLU 30 36.052 19.523 21.948 229 HA GLU 30 HA GLU 30 36.168 18.861 24.738 230 HB2 GLU 30 HB2 GLU 30 35.487 17.130 22.319 231 HB3 GLU 30 HB3 GLU 30 35.162 16.707 24.002 232 HG2 GLU 30 HG2 GLU 30 33.591 18.603 24.212 233 HG3 GLU 30 HG3 GLU 30 33.904 19.090 22.537 234 H LYS 31 H LYS 31 38.195 17.713 22.098 235 HA LYS 31 HA LYS 31 39.515 15.683 23.632 236 HB2 LYS 31 HB2 LYS 31 39.613 15.657 21.196 237 HB3 LYS 31 HB3 LYS 31 40.188 17.319 21.165 238 HG2 LYS 31 HG2 LYS 31 42.358 16.435 22.311 239 HG3 LYS 31 HG3 LYS 31 41.736 14.833 21.928 240 HD2 LYS 31 HD2 LYS 31 43.236 15.541 20.193 241 HD3 LYS 31 HD3 LYS 31 41.587 15.560 19.523 242 HE2 LYS 31 HE2 LYS 31 41.467 17.902 19.489 243 HE3 LYS 31 HE3 LYS 31 42.714 18.109 20.736 244 HZ1 LYS 31 HZ1 LYS 31 43.125 17.378 17.908 245 HZ2 LYS 31 HZ2 LYS 31 43.693 18.706 18.714 246 HZ3 LYS 31 HZ3 LYS 31 44.317 17.215 19.016 247 H LEU 32 H LEU 32 40.438 18.986 22.773 248 HA LEU 32 HA LEU 32 42.933 19.129 24.107 249 HB2 LEU 32 HB2 LEU 32 42.218 20.571 22.289 250 HB3 LEU 32 HB3 LEU 32 40.844 21.121 23.259 251 HG LEU 32 HG LEU 32 42.215 22.450 24.685 252 HD11 LEU 32 HD11 LEU 32 44.667 22.629 24.372 253 HD12 LEU 32 HD12 LEU 32 44.169 21.022 24.919 254 HD13 LEU 32 HD13 LEU 32 44.614 21.275 23.217 255 HD21 LEU 32 HD21 LEU 32 43.194 22.767 21.819 256 HD22 LEU 32 HD22 LEU 32 41.630 23.342 22.418 257 HD23 LEU 32 HD23 LEU 32 43.124 24.034 23.083 258 H LEU 33 H LEU 33 39.641 20.013 25.189 259 HA LEU 33 HA LEU 33 40.437 21.249 27.606 260 HB2 LEU 33 HB2 LEU 33 37.859 19.850 26.726 261 HB3 LEU 33 HB3 LEU 33 37.956 20.720 28.246 262 HG LEU 33 HG LEU 33 38.533 22.024 25.563 263 HD11 LEU 33 HD11 LEU 33 36.177 21.299 25.670 264 HD12 LEU 33 HD12 LEU 33 35.978 22.358 27.095 265 HD13 LEU 33 HD13 LEU 33 36.422 23.042 25.530 266 HD21 LEU 33 HD21 LEU 33 38.135 24.140 26.804 267 HD22 LEU 33 HD22 LEU 33 38.031 23.205 28.304 268 HD23 LEU 33 HD23 LEU 33 39.554 23.259 27.375 269 H HIS 34 H HIS 34 39.559 17.827 26.982 270 HA HIS 34 HA HIS 34 40.191 16.912 29.654 271 HB2 HIS 34 HB2 HIS 34 39.786 15.583 26.968 272 HB3 HIS 34 HB3 HIS 34 40.465 14.682 28.317 273 HD1 HIS 34 HD1 HIS 34 38.860 14.198 30.428 274 HD2 HIS 34 HD2 HIS 34 37.127 16.125 27.115 275 HE1 HIS 34 HE1 HIS 34 36.341 14.062 30.761 276 H ALA 35 H ALA 35 42.143 17.358 26.654 277 HA ALA 35 HA ALA 35 44.377 15.849 27.615 278 HB1 ALA 35 HB1 ALA 35 45.529 16.819 25.674 279 HB2 ALA 35 HB2 ALA 35 43.895 16.317 25.231 280 HB3 ALA 35 HB3 ALA 35 44.265 18.040 25.500 281 H ARG 36 H ARG 36 43.504 19.207 28.059 282 HA ARG 36 HA ARG 36 46.062 19.844 29.486 283 HB2 ARG 36 HB2 ARG 36 43.962 21.610 28.169 284 HB3 ARG 36 HB3 ARG 36 45.363 22.173 29.067 285 HG2 ARG 36 HG2 ARG 36 45.551 20.458 26.577 286 HG3 ARG 36 HG3 ARG 36 45.600 22.226 26.570 287 HD2 ARG 36 HD2 ARG 36 47.681 22.259 27.796 288 HD3 ARG 36 HD3 ARG 36 47.571 20.520 28.118 289 HE ARG 36 HE ARG 36 48.352 20.038 25.996 290 HH11 ARG 36 HH12 ARG 36 47.561 23.518 25.802 291 HH12 ARG 36 HH11 ARG 36 47.724 23.388 24.039 292 HH21 ARG 36 HH22 ARG 36 48.814 20.198 23.994 293 HH22 ARG 36 HH21 ARG 36 48.767 21.756 23.141 294 H THR 37 H THR 37 43.497 18.663 30.492 295 HA THR 37 HA THR 37 42.437 18.389 32.466 296 HB THR 37 HB THR 37 43.949 20.291 34.070 297 HG1 THR 37 HG1 THR 37 45.578 18.157 33.717 298 HG21 THR 37 HG21 THR 37 44.236 18.350 35.553 299 HG22 THR 37 HG22 THR 37 43.677 17.245 34.272 300 HG23 THR 37 HG23 THR 37 42.556 18.414 34.990 301 H LYS 38 H LYS 38 41.435 20.511 30.772 302 HA LYS 38 HA LYS 38 40.256 22.487 32.675 303 HB2 LYS 38 HB2 LYS 38 39.823 21.817 29.744 304 HB3 LYS 38 HB3 LYS 38 38.677 22.727 30.685 305 HG2 LYS 38 HG2 LYS 38 40.031 24.284 29.455 306 HG3 LYS 38 HG3 LYS 38 40.446 24.467 31.134 307 HD2 LYS 38 HD2 LYS 38 42.210 22.568 29.621 308 HD3 LYS 38 HD3 LYS 38 42.214 24.218 29.011 309 HE2 LYS 38 HE2 LYS 38 42.641 25.029 31.381 310 HE3 LYS 38 HE3 LYS 38 42.836 23.323 31.835 311 HZ1 LYS 38 HZ1 LYS 38 44.757 23.167 30.500 312 HZ2 LYS 38 HZ2 LYS 38 44.586 24.631 29.778 313 HZ3 LYS 38 HZ3 LYS 38 44.975 24.493 31.367 314 H ASP 39 H ASP 39 39.128 21.504 34.187 315 HA ASP 39 HA ASP 39 37.896 19.117 33.810 316 HB2 ASP 39 HB2 ASP 39 38.558 20.176 36.032 317 HB3 ASP 39 HB3 ASP 39 37.022 21.012 36.007 318 H ILE 40 H ILE 40 36.481 18.688 32.381 319 HA ILE 40 HA ILE 40 34.450 20.714 31.710 320 HB ILE 40 HB ILE 40 36.425 20.447 30.319 321 HG12 ILE 40 HG12 ILE 40 33.740 20.769 29.440 322 HG13 ILE 40 HG13 ILE 40 35.224 21.474 28.872 323 HG21 ILE 40 HG21 ILE 40 35.355 17.722 29.503 324 HG22 ILE 40 HG22 ILE 40 36.791 18.544 28.862 325 HG23 ILE 40 HG23 ILE 40 36.763 18.008 30.531 326 HD11 ILE 40 HD11 ILE 40 33.953 20.415 27.067 327 HD12 ILE 40 HD12 ILE 40 35.533 19.649 27.258 328 HD13 ILE 40 HD13 ILE 40 34.061 18.846 27.875 329 H THR 41 H THR 41 32.470 20.450 31.234 330 HA THR 41 HA THR 41 31.193 17.755 30.898 331 HB THR 41 HB THR 41 30.333 20.235 32.415 332 HG1 THR 41 HG1 THR 41 29.854 18.635 33.950 333 HG21 THR 41 HG21 THR 41 28.508 17.998 31.461 334 HG22 THR 41 HG22 THR 41 28.387 19.746 31.096 335 HG23 THR 41 HG23 THR 41 28.117 19.175 32.740 336 H VAL 42 H VAL 42 30.154 17.564 28.885 337 HA VAL 42 HA VAL 42 29.429 20.077 27.492 338 HB VAL 42 HB VAL 42 31.064 19.424 26.199 339 HG11 VAL 42 HG11 VAL 42 30.622 16.542 26.686 340 HG12 VAL 42 HG12 VAL 42 31.758 17.234 25.489 341 HG13 VAL 42 HG13 VAL 42 31.962 17.646 27.180 342 HG21 VAL 42 HG21 VAL 42 30.304 18.483 24.103 343 HG22 VAL 42 HG22 VAL 42 28.859 17.832 24.890 344 HG23 VAL 42 HG23 VAL 42 29.097 19.593 24.759 345 H HIS 43 H HIS 43 27.490 20.378 26.705 346 HA HIS 43 HA HIS 43 25.462 18.220 27.032 347 HB2 HIS 43 HB2 HIS 43 25.109 20.484 28.140 348 HB3 HIS 43 HB3 HIS 43 24.977 21.164 26.544 349 HD1 HIS 43 HD1 HIS 43 22.587 20.973 25.458 350 HD2 HIS 43 HD2 HIS 43 23.242 18.361 28.680 351 HE1 HIS 43 HE1 HIS 43 20.380 19.766 25.860 352 H TYR 44 H TYR 44 24.637 17.220 25.320 353 HA TYR 44 HA TYR 44 25.343 18.178 22.614 354 HB2 TYR 44 HB2 TYR 44 24.277 15.557 23.665 355 HB3 TYR 44 HB3 TYR 44 24.565 15.872 21.958 356 HD1 TYR 44 HD1 TYR 44 26.990 16.752 21.322 357 HD2 TYR 44 HD2 TYR 44 26.046 14.808 25.058 358 HE1 TYR 44 HE1 TYR 44 29.428 16.379 21.751 359 HE2 TYR 44 HE2 TYR 44 28.472 14.472 25.485 360 HH TYR 44 HH TYR 44 31.025 15.620 23.265 361 H VAL 45 H VAL 45 24.011 19.916 22.283 362 HA VAL 45 HA VAL 45 21.106 19.674 22.563 363 HB VAL 45 HB VAL 45 20.939 21.886 21.500 364 HG11 VAL 45 HG11 VAL 45 21.128 21.663 23.958 365 HG12 VAL 45 HG12 VAL 45 22.915 21.737 23.803 366 HG13 VAL 45 HG13 VAL 45 21.900 23.135 23.389 367 HG21 VAL 45 HG21 VAL 45 24.000 21.822 21.494 368 HG22 VAL 45 HG22 VAL 45 22.926 21.972 20.085 369 HG23 VAL 45 HG23 VAL 45 22.996 23.265 21.268 370 H ASP 46 H ASP 46 22.944 18.094 20.492 371 HA ASP 46 HA ASP 46 20.906 17.982 18.326 372 HB2 ASP 46 HB2 ASP 46 23.349 17.756 17.782 373 HB3 ASP 46 HB3 ASP 46 23.392 16.279 18.744 374 H LYS 47 H LYS 47 21.901 16.284 21.296 375 HA LYS 47 HA LYS 47 20.209 13.925 20.858 376 HB2 LYS 47 HB2 LYS 47 21.682 15.009 23.307 377 HB3 LYS 47 HB3 LYS 47 20.756 13.530 23.315 378 HG2 LYS 47 HG2 LYS 47 22.974 13.840 21.272 379 HG3 LYS 47 HG3 LYS 47 23.373 13.516 22.961 380 HD2 LYS 47 HD2 LYS 47 22.073 11.511 23.015 381 HD3 LYS 47 HD3 LYS 47 21.462 11.769 21.371 382 HE2 LYS 47 HE2 LYS 47 24.449 11.691 21.852 383 HE3 LYS 47 HE3 LYS 47 23.560 10.163 21.902 384 HZ1 LYS 47 HZ1 LYS 47 24.462 10.867 19.665 385 HZ2 LYS 47 HZ2 LYS 47 22.883 10.409 19.699 386 HZ3 LYS 47 HZ3 LYS 47 23.250 11.995 19.602 387 H MET 48 H MET 48 20.092 16.800 22.966 388 HA MET 48 HA MET 48 17.440 16.223 23.970 389 HB2 MET 48 HB2 MET 48 19.222 17.572 25.146 390 HB3 MET 48 HB3 MET 48 18.924 18.879 23.990 391 HG2 MET 48 HG2 MET 48 16.486 18.836 24.747 392 HG3 MET 48 HG3 MET 48 16.974 17.680 25.991 393 HE1 MET 48 HE1 MET 48 15.433 19.872 27.136 394 HE2 MET 48 HE2 MET 48 16.435 18.842 28.179 395 HE3 MET 48 HE3 MET 48 16.475 20.608 28.374 396 H SER 49 H SER 49 15.522 16.528 22.982 397 HA SER 49 HA SER 49 15.192 17.647 20.390 398 HB2 SER 49 HB2 SER 49 13.035 17.360 22.502 399 HB3 SER 49 HB3 SER 49 12.837 17.331 20.741 400 HG SER 49 HG SER 49 14.063 15.404 20.697 401 H GLU 50 H GLU 50 14.511 19.097 23.594 402 HA GLU 50 HA GLU 50 13.702 21.668 22.622 403 HB2 GLU 50 HB2 GLU 50 13.494 20.510 25.000 404 HB3 GLU 50 HB3 GLU 50 15.100 21.173 25.258 405 HG2 GLU 50 HG2 GLU 50 13.784 22.785 26.219 406 HG3 GLU 50 HG3 GLU 50 13.987 23.481 24.622 407 H GLY 51 H GLY 51 16.832 20.260 22.490 408 HA2 GLY 51 HA2 GLY 51 18.657 22.164 23.250 409 HA3 GLY 51 HA3 GLY 51 18.856 21.020 21.928 410 H GLU 52 H GLU 52 16.638 22.367 20.342 411 HA GLU 52 HA GLU 52 18.311 24.347 18.954 412 HB2 GLU 52 HB2 GLU 52 15.388 23.572 18.670 413 HB3 GLU 52 HB3 GLU 52 16.208 24.752 17.646 414 HG2 GLU 52 HG2 GLU 52 17.812 23.010 16.907 415 HG3 GLU 52 HG3 GLU 52 16.986 21.816 17.920 416 H GLN 53 H GLN 53 15.705 24.494 21.390 417 HA GLN 53 HA GLN 53 15.445 27.396 21.307 418 HB2 GLN 53 HB2 GLN 53 13.784 25.510 22.207 419 HB3 GLN 53 HB3 GLN 53 14.699 25.745 23.698 420 HG2 GLN 53 HG2 GLN 53 13.079 27.354 23.967 421 HG3 GLN 53 HG3 GLN 53 14.281 28.339 23.166 422 HE21 GLN 53 HE21 GLN 53 11.093 27.033 22.995 423 HE22 GLN 53 HE22 GLN 53 10.666 27.637 21.398 424 H LEU 54 H LEU 54 17.386 25.046 23.214 425 HA LEU 54 HA LEU 54 18.517 27.095 24.937 426 HB2 LEU 54 HB2 LEU 54 19.549 24.291 24.292 427 HB3 LEU 54 HB3 LEU 54 20.211 25.395 25.492 428 HG LEU 54 HG LEU 54 19.002 23.943 26.777 429 HD11 LEU 54 HD11 LEU 54 16.870 26.044 26.293 430 HD12 LEU 54 HD12 LEU 54 17.272 25.193 27.803 431 HD13 LEU 54 HD13 LEU 54 18.394 26.398 27.122 432 HD21 LEU 54 HD21 LEU 54 16.748 23.170 26.467 433 HD22 LEU 54 HD22 LEU 54 16.585 24.100 24.972 434 HD23 LEU 54 HD23 LEU 54 17.739 22.742 25.078 435 H ARG 55 H ARG 55 19.591 25.676 21.809 436 HA ARG 55 HA ARG 55 21.998 27.195 21.573 437 HB2 ARG 55 HB2 ARG 55 21.473 25.092 20.470 438 HB3 ARG 55 HB3 ARG 55 20.053 25.793 19.684 439 HG2 ARG 55 HG2 ARG 55 21.317 27.151 18.325 440 HG3 ARG 55 HG3 ARG 55 22.859 26.820 19.178 441 HD2 ARG 55 HD2 ARG 55 22.541 24.367 18.598 442 HD3 ARG 55 HD3 ARG 55 21.198 24.805 17.571 443 HE ARG 55 HE ARG 55 24.076 25.641 17.188 444 HH11 ARG 55 HH22 ARG 55 20.913 25.383 15.601 445 HH12 ARG 55 HH21 ARG 55 21.712 25.314 14.027 446 HH21 ARG 55 HH12 ARG 55 24.888 25.415 15.143 447 HH22 ARG 55 HH11 ARG 55 23.765 25.331 13.791 448 H GLY 56 H GLY 56 18.579 27.869 20.824 449 HA2 GLY 56 HA2 GLY 56 18.836 30.515 19.810 450 HA3 GLY 56 HA3 GLY 56 17.485 29.883 20.761 451 H GLU 57 H GLU 57 18.759 29.443 23.377 452 HA GLU 57 HA GLU 57 19.063 32.196 24.195 453 HB2 GLU 57 HB2 GLU 57 19.494 29.569 25.666 454 HB3 GLU 57 HB3 GLU 57 19.736 31.149 26.393 455 HG2 GLU 57 HG2 GLU 57 17.105 29.869 25.618 456 HG3 GLU 57 HG3 GLU 57 17.647 30.561 27.082 457 H ILE 58 H ILE 58 21.466 29.813 23.171 458 HA ILE 58 HA ILE 58 23.743 31.417 24.028 459 HB ILE 58 HB ILE 58 23.660 29.500 21.667 460 HG12 ILE 58 HG12 ILE 58 24.571 28.886 24.516 461 HG13 ILE 58 HG13 ILE 58 23.024 28.380 23.830 462 HG21 ILE 58 HG21 ILE 58 26.106 29.430 21.954 463 HG22 ILE 58 HG22 ILE 58 25.598 31.083 21.695 464 HG23 ILE 58 HG23 ILE 58 25.999 30.539 23.342 465 HD11 ILE 58 HD11 ILE 58 25.766 27.434 22.980 466 HD12 ILE 58 HD12 ILE 58 24.436 26.505 23.685 467 HD13 ILE 58 HD13 ILE 58 24.289 27.132 22.034 468 H TYR 59 H TYR 59 21.877 31.233 20.913 469 HA TYR 59 HA TYR 59 23.414 33.208 19.607 470 HB2 TYR 59 HB2 TYR 59 21.577 31.597 18.680 471 HB3 TYR 59 HB3 TYR 59 20.467 32.924 19.007 472 HD1 TYR 59 HD1 TYR 59 20.926 35.219 17.840 473 HD2 TYR 59 HD2 TYR 59 23.113 31.635 16.934 474 HE1 TYR 59 HE1 TYR 59 21.869 36.307 15.805 475 HE2 TYR 59 HE2 TYR 59 24.065 32.718 14.892 476 HH TYR 59 HH TYR 59 23.521 36.162 14.148 477 H GLN 60 H GLN 60 20.410 33.636 21.532 478 HA GLN 60 HA GLN 60 20.183 36.451 21.172 479 HB2 GLN 60 HB2 GLN 60 19.299 34.572 23.398 480 HB3 GLN 60 HB3 GLN 60 18.879 36.288 23.384 481 HG2 GLN 60 HG2 GLN 60 18.122 34.300 21.197 482 HG3 GLN 60 HG3 GLN 60 17.074 34.807 22.514 483 HE21 GLN 60 HE21 GLN 60 16.006 35.196 20.077 484 HE22 GLN 60 HE22 GLN 60 16.097 36.924 19.669 485 H ALA 61 H ALA 61 22.181 34.637 23.519 486 HA ALA 61 HA ALA 61 23.000 37.090 24.889 487 HB1 ALA 61 HB1 ALA 61 23.864 34.193 25.146 488 HB2 ALA 61 HB2 ALA 61 24.365 35.523 26.219 489 HB3 ALA 61 HB3 ALA 61 22.661 35.053 26.131 490 H TYR 62 H TYR 62 24.589 34.852 22.537 491 HA TYR 62 HA TYR 62 26.975 36.649 22.553 492 HB2 TYR 62 HB2 TYR 62 26.967 33.647 22.228 493 HB3 TYR 62 HB3 TYR 62 28.369 34.703 22.379 494 HD1 TYR 62 HD1 TYR 62 28.512 36.179 24.566 495 HD2 TYR 62 HD2 TYR 62 26.023 32.688 24.167 496 HE1 TYR 62 HE1 TYR 62 28.274 36.068 27.042 497 HE2 TYR 62 HE2 TYR 62 25.812 32.550 26.640 498 HH TYR 62 HH TYR 62 27.304 34.999 28.812 499 H LYS 63 H LYS 63 24.555 35.813 20.453 500 HA LYS 63 HA LYS 63 24.244 35.772 18.256 501 HB2 LYS 63 HB2 LYS 63 26.462 37.829 18.421 502 HB3 LYS 63 HB3 LYS 63 25.565 37.546 16.940 503 HG2 LYS 63 HG2 LYS 63 24.245 38.380 19.549 504 HG3 LYS 63 HG3 LYS 63 24.765 39.478 18.268 505 HD2 LYS 63 HD2 LYS 63 23.312 38.000 16.688 506 HD3 LYS 63 HD3 LYS 63 22.539 37.408 18.161 507 HE2 LYS 63 HE2 LYS 63 22.823 40.360 17.439 508 HE3 LYS 63 HE3 LYS 63 21.443 39.382 16.924 509 HZ1 LYS 63 HZ1 LYS 63 21.063 40.625 19.029 510 HZ2 LYS 63 HZ2 LYS 63 20.847 39.003 19.173 511 HZ3 LYS 63 HZ3 LYS 63 22.208 39.736 19.769 512 H HIS 64 H HIS 64 25.758 33.583 19.006 513 HA HIS 64 HA HIS 64 26.621 32.779 16.294 514 HB2 HIS 64 HB2 HIS 64 28.099 31.902 18.803 515 HB3 HIS 64 HB3 HIS 64 28.402 31.372 17.153 516 HD1 HIS 64 HD1 HIS 64 29.629 33.257 15.497 517 HD2 HIS 64 HD2 HIS 64 29.395 34.011 19.636 518 HE1 HIS 64 HE1 HIS 64 31.342 35.064 15.997 519 H GLU 65 H GLU 65 26.170 30.540 15.861 520 HA GLU 65 HA GLU 65 24.274 29.230 17.791 521 HB2 GLU 65 HB2 GLU 65 23.283 28.081 15.904 522 HB3 GLU 65 HB3 GLU 65 23.137 29.818 15.746 523 HG2 GLU 65 HG2 GLU 65 24.945 29.881 14.092 524 HG3 GLU 65 HG3 GLU 65 25.235 28.148 14.304 525 H THR 66 H THR 66 27.183 28.747 15.864 526 HA THR 66 HA THR 66 27.975 26.562 17.701 527 HB THR 66 HB THR 66 28.236 26.237 14.698 528 HG1 THR 66 HG1 THR 66 26.724 24.738 14.754 529 HG21 THR 66 HG21 THR 66 28.795 23.866 15.289 530 HG22 THR 66 HG22 THR 66 28.795 24.319 17.005 531 HG23 THR 66 HG23 THR 66 29.994 25.013 15.878 532 H VAL 67 H VAL 67 30.166 26.498 17.972 533 HA VAL 67 HA VAL 67 32.036 28.052 16.347 534 HB VAL 67 HB VAL 67 31.600 28.797 19.254 535 HG11 VAL 67 HG11 VAL 67 33.814 29.647 17.339 536 HG12 VAL 67 HG12 VAL 67 33.486 30.383 18.919 537 HG13 VAL 67 HG13 VAL 67 34.022 28.705 18.835 538 HG21 VAL 67 HG21 VAL 67 31.371 31.093 18.370 539 HG22 VAL 67 HG22 VAL 67 31.382 30.432 16.726 540 HG23 VAL 67 HG23 VAL 67 30.085 30.004 17.866 541 HA PRO 68 HA PRO 68 30.538 25.604 19.248 542 HB2 PRO 68 HB2 PRO 68 31.352 24.203 21.399 543 HB3 PRO 68 HB3 PRO 68 31.278 23.476 19.769 544 HG2 PRO 68 HG2 PRO 68 33.709 24.713 21.130 545 HG3 PRO 68 HG3 PRO 68 33.568 23.063 20.444 546 HD2 PRO 68 HD2 PRO 68 34.605 25.063 18.970 547 HD3 PRO 68 HD3 PRO 68 33.478 23.898 18.224 548 H ALA 69 H ALA 69 29.676 26.190 21.385 549 HA ALA 69 HA ALA 69 30.953 28.634 22.464 550 HB1 ALA 69 HB1 ALA 69 28.801 28.927 23.630 551 HB2 ALA 69 HB2 ALA 69 28.547 28.672 21.894 552 HB3 ALA 69 HB3 ALA 69 28.244 27.349 23.044 553 H ILE 70 H ILE 70 32.121 28.670 24.241 554 HA ILE 70 HA ILE 70 32.318 26.271 26.006 555 HB ILE 70 HB ILE 70 34.490 28.150 25.000 556 HG12 ILE 70 HG12 ILE 70 34.511 25.207 24.336 557 HG13 ILE 70 HG13 ILE 70 33.508 26.268 23.362 558 HG21 ILE 70 HG21 ILE 70 36.076 26.529 26.073 559 HG22 ILE 70 HG22 ILE 70 35.052 27.370 27.231 560 HG23 ILE 70 HG23 ILE 70 34.683 25.689 26.787 561 HD11 ILE 70 HD11 ILE 70 36.485 26.702 23.792 562 HD12 ILE 70 HD12 ILE 70 35.728 25.986 22.356 563 HD13 ILE 70 HD13 ILE 70 35.409 27.678 22.772 564 H PHE 71 H PHE 71 32.359 26.684 28.205 565 HA PHE 71 HA PHE 71 32.415 29.530 29.071 566 HB2 PHE 71 HB2 PHE 71 30.440 27.388 29.910 567 HB3 PHE 71 HB3 PHE 71 30.577 28.986 30.631 568 HD1 PHE 71 HD1 PHE 71 29.589 27.136 27.549 569 HD2 PHE 71 HD2 PHE 71 29.623 30.937 29.583 570 HE1 PHE 71 HE1 PHE 71 28.013 28.061 25.864 571 HE2 PHE 71 HE2 PHE 71 28.024 31.836 27.928 572 HZ PHE 71 HZ PHE 71 27.221 30.412 26.053 573 H ILE 72 H ILE 72 33.264 29.987 31.048 574 HA ILE 72 HA ILE 72 34.171 27.747 32.787 575 HB ILE 72 HB ILE 72 35.935 30.102 32.012 576 HG12 ILE 72 HG12 ILE 72 36.032 27.127 31.373 577 HG13 ILE 72 HG13 ILE 72 35.902 28.462 30.234 578 HG21 ILE 72 HG21 ILE 72 37.614 29.058 33.498 579 HG22 ILE 72 HG22 ILE 72 36.189 29.474 34.417 580 HG23 ILE 72 HG23 ILE 72 36.457 27.783 33.943 581 HD11 ILE 72 HD11 ILE 72 38.227 29.172 30.875 582 HD12 ILE 72 HD12 ILE 72 38.364 27.676 31.840 583 HD13 ILE 72 HD13 ILE 72 38.104 27.577 30.095 584 H ASN 73 H ASN 73 33.348 27.987 34.741 585 HA ASN 73 HA ASN 73 32.078 28.824 36.413 586 HB2 ASN 73 HB2 ASN 73 34.135 31.055 36.286 587 HB3 ASN 73 HB3 ASN 73 33.033 30.787 37.634 588 HD21 ASN 73 HD21 ASN 73 35.899 30.776 37.728 589 HD22 ASN 73 HD22 ASN 73 36.398 29.160 38.198 590 H GLY 74 H GLY 74 30.774 29.340 33.986 591 HA2 GLY 74 HA2 GLY 74 29.016 30.620 33.160 592 HA3 GLY 74 HA3 GLY 74 29.039 31.549 34.650 593 H ASN 75 H ASN 75 32.064 31.704 32.983 594 HA ASN 75 HA ASN 75 31.413 34.288 31.632 595 HB2 ASN 75 HB2 ASN 75 34.115 32.921 32.041 596 HB3 ASN 75 HB3 ASN 75 33.859 34.525 31.413 597 HD21 ASN 75 HD21 ASN 75 33.915 32.606 34.278 598 HD22 ASN 75 HD22 ASN 75 34.027 33.996 35.364 599 H PHE 76 H PHE 76 31.787 34.491 29.350 600 HA PHE 76 HA PHE 76 31.613 31.940 27.849 601 HB2 PHE 76 HB2 PHE 76 29.869 33.484 27.405 602 HB3 PHE 76 HB3 PHE 76 30.991 34.821 27.185 603 HD1 PHE 76 HD1 PHE 76 30.140 31.459 25.693 604 HD2 PHE 76 HD2 PHE 76 31.710 35.418 25.029 605 HE1 PHE 76 HE1 PHE 76 30.292 30.998 23.260 606 HE2 PHE 76 HE2 PHE 76 31.870 34.948 22.599 607 HZ PHE 76 HZ PHE 76 31.161 32.739 21.708 608 H ILE 77 H ILE 77 32.974 31.182 26.428 609 HA ILE 77 HA ILE 77 35.144 32.824 25.248 610 HB ILE 77 HB ILE 77 35.416 29.957 26.242 611 HG12 ILE 77 HG12 ILE 77 36.855 32.478 27.182 612 HG13 ILE 77 HG13 ILE 77 35.580 31.639 28.067 613 HG21 ILE 77 HG21 ILE 77 37.442 31.712 24.769 614 HG22 ILE 77 HG22 ILE 77 37.755 30.087 25.409 615 HG23 ILE 77 HG23 ILE 77 36.620 30.284 24.097 616 HD11 ILE 77 HD11 ILE 77 37.033 29.593 28.165 617 HD12 ILE 77 HD12 ILE 77 38.364 30.579 27.505 618 HD13 ILE 77 HD13 ILE 77 37.635 31.005 29.058 619 H GLY 78 H GLY 78 35.186 32.673 23.078 620 HA2 GLY 78 HA2 GLY 78 34.033 30.236 21.761 621 HA3 GLY 78 HA3 GLY 78 33.669 31.840 21.128 622 H GLY 79 H GLY 79 35.572 29.256 20.690 623 HA2 GLY 79 HA2 GLY 79 36.577 29.473 18.404 624 HA3 GLY 79 HA3 GLY 79 37.589 30.742 19.089 625 H CYS 80 H CYS 80 37.971 27.778 17.983 626 HA CYS 80 HA CYS 80 39.244 26.344 20.133 627 HB2 CYS 80 HB2 CYS 80 39.634 26.193 17.110 628 HB3 CYS 80 HB3 CYS 80 40.318 25.049 18.282 629 HG CYS 80 HG CYS 80 37.157 25.801 17.659 630 H SER 81 H SER 81 40.636 28.547 17.636 631 HA SER 81 HA SER 81 43.294 28.437 18.773 632 HB2 SER 81 HB2 SER 81 42.110 30.567 16.957 633 HB3 SER 81 HB3 SER 81 43.828 30.286 17.304 634 HG SER 81 HG SER 81 43.256 28.003 16.605 635 H ASP 82 H ASP 82 40.531 30.551 19.348 636 HA ASP 82 HA ASP 82 41.669 32.467 21.076 637 HB2 ASP 82 HB2 ASP 82 39.266 32.071 19.993 638 HB3 ASP 82 HB3 ASP 82 38.902 31.281 21.504 639 H LEU 83 H LEU 83 40.284 29.273 21.796 640 HA LEU 83 HA LEU 83 40.684 29.243 24.630 641 HB2 LEU 83 HB2 LEU 83 39.069 27.811 23.386 642 HB3 LEU 83 HB3 LEU 83 40.388 27.039 22.538 643 HG LEU 83 HG LEU 83 41.244 26.139 24.695 644 HD11 LEU 83 HD11 LEU 83 39.681 26.075 26.635 645 HD12 LEU 83 HD12 LEU 83 40.226 27.720 26.285 646 HD13 LEU 83 HD13 LEU 83 38.600 27.205 25.787 647 HD21 LEU 83 HD21 LEU 83 39.617 24.354 24.850 648 HD22 LEU 83 HD22 LEU 83 38.373 25.361 24.070 649 HD23 LEU 83 HD23 LEU 83 39.800 24.830 23.157 650 H GLU 84 H GLU 84 42.600 27.839 21.919 651 HA GLU 84 HA GLU 84 44.711 26.796 23.570 652 HB2 GLU 84 HB2 GLU 84 44.710 27.672 20.643 653 HB3 GLU 84 HB3 GLU 84 46.098 26.965 21.485 654 HG2 GLU 84 HG2 GLU 84 44.786 24.966 22.024 655 HG3 GLU 84 HG3 GLU 84 43.454 25.569 21.026 656 H ALA 85 H ALA 85 44.222 30.031 22.111 657 HA ALA 85 HA ALA 85 46.803 31.063 22.612 658 HB1 ALA 85 HB1 ALA 85 45.606 33.282 22.490 659 HB2 ALA 85 HB2 ALA 85 45.204 32.188 21.156 660 HB3 ALA 85 HB3 ALA 85 44.053 32.411 22.483 661 H LEU 86 H LEU 86 43.936 30.983 24.781 662 HA LEU 86 HA LEU 86 45.326 32.365 26.948 663 HB2 LEU 86 HB2 LEU 86 42.789 30.665 26.866 664 HB3 LEU 86 HB3 LEU 86 43.353 31.525 28.297 665 HG LEU 86 HG LEU 86 42.582 32.863 25.667 666 HD11 LEU 86 HD11 LEU 86 40.605 33.637 26.918 667 HD12 LEU 86 HD12 LEU 86 40.649 31.873 26.817 668 HD13 LEU 86 HD13 LEU 86 41.109 32.688 28.332 669 HD21 LEU 86 HD21 LEU 86 42.641 34.951 26.987 670 HD22 LEU 86 HD22 LEU 86 43.252 34.065 28.392 671 HD23 LEU 86 HD23 LEU 86 44.238 34.216 26.917 672 H ASP 87 H ASP 87 44.970 28.976 25.999 673 HA ASP 87 HA ASP 87 46.146 27.849 28.368 674 HB2 ASP 87 HB2 ASP 87 44.790 26.671 26.555 675 HB3 ASP 87 HB3 ASP 87 46.270 26.611 25.609 676 H LYS 88 H LYS 88 47.535 29.053 25.338 677 HA LYS 88 HA LYS 88 50.323 28.534 25.974 678 HB2 LYS 88 HB2 LYS 88 48.819 30.062 23.835 679 HB3 LYS 88 HB3 LYS 88 50.518 30.396 24.072 680 HG2 LYS 88 HG2 LYS 88 50.442 28.787 22.369 681 HG3 LYS 88 HG3 LYS 88 51.033 27.956 23.809 682 HD2 LYS 88 HD2 LYS 88 48.766 26.975 24.172 683 HD3 LYS 88 HD3 LYS 88 48.194 27.887 22.763 684 HE2 LYS 88 HE2 LYS 88 48.541 25.565 22.199 685 HE3 LYS 88 HE3 LYS 88 49.522 26.661 21.230 686 HZ1 LYS 88 HZ1 LYS 88 50.665 25.368 23.623 687 HZ2 LYS 88 HZ2 LYS 88 50.599 24.556 22.198 688 HZ3 LYS 88 HZ3 LYS 88 51.463 25.957 22.322 689 H GLU 89 H GLU 89 48.298 31.455 26.418 690 HA GLU 89 HA GLU 89 50.527 33.020 27.458 691 HB2 GLU 89 HB2 GLU 89 47.515 33.477 27.497 692 HB3 GLU 89 HB3 GLU 89 48.697 34.616 28.143 693 HG2 GLU 89 HG2 GLU 89 49.801 34.702 25.905 694 HG3 GLU 89 HG3 GLU 89 48.479 33.771 25.233 695 H GLY 90 H GLY 90 48.861 30.513 28.927 696 HA2 GLY 90 HA2 GLY 90 49.310 29.628 31.044 697 HA3 GLY 90 HA3 GLY 90 50.105 31.126 31.505 698 H LYS 91 H LYS 91 46.962 31.736 30.243 699 HA LYS 91 HA LYS 91 46.083 32.600 32.951 700 HB2 LYS 91 HB2 LYS 91 45.468 33.334 30.072 701 HB3 LYS 91 HB3 LYS 91 44.353 33.759 31.354 702 HG2 LYS 91 HG2 LYS 91 46.111 34.972 32.577 703 HG3 LYS 91 HG3 LYS 91 47.294 34.566 31.327 704 HD2 LYS 91 HD2 LYS 91 44.739 36.165 30.812 705 HD3 LYS 91 HD3 LYS 91 46.312 36.889 31.171 706 HE2 LYS 91 HE2 LYS 91 47.313 35.782 29.211 707 HE3 LYS 91 HE3 LYS 91 45.755 35.037 28.812 708 HZ1 LYS 91 HZ1 LYS 91 46.295 37.949 28.865 709 HZ2 LYS 91 HZ2 LYS 91 46.145 36.986 27.515 710 HZ3 LYS 91 HZ3 LYS 91 44.850 37.265 28.502 711 H LEU 92 H LEU 92 45.427 30.061 30.749 712 HA LEU 92 HA LEU 92 42.664 29.600 31.727 713 HB2 LEU 92 HB2 LEU 92 43.646 29.281 29.296 714 HB3 LEU 92 HB3 LEU 92 44.406 27.837 29.950 715 HG LEU 92 HG LEU 92 42.091 26.983 30.542 716 HD11 LEU 92 HD11 LEU 92 40.196 28.082 29.288 717 HD12 LEU 92 HD12 LEU 92 40.809 29.067 30.624 718 HD13 LEU 92 HD13 LEU 92 41.257 29.455 28.946 719 HD21 LEU 92 HD21 LEU 92 41.525 26.417 28.213 720 HD22 LEU 92 HD22 LEU 92 42.570 27.722 27.622 721 HD23 LEU 92 HD23 LEU 92 43.280 26.334 28.458 722 H ASP 93 H ASP 93 45.910 28.265 32.192 723 HA ASP 93 HA ASP 93 45.029 26.222 34.052 724 HB2 ASP 93 HB2 ASP 93 47.719 27.497 33.534 725 HB3 ASP 93 HB3 ASP 93 47.396 26.130 34.602 726 H GLY 94 H GLY 94 45.737 29.660 34.408 727 HA2 GLY 94 HA2 GLY 94 45.630 29.711 37.301 728 HA3 GLY 94 HA3 GLY 94 45.310 31.063 36.198 729 H LEU 95 H LEU 95 43.178 29.719 34.733 730 HA LEU 95 HA LEU 95 40.942 30.305 36.489 731 HB2 LEU 95 HB2 LEU 95 41.222 29.459 33.594 732 HB3 LEU 95 HB3 LEU 95 39.657 29.516 34.376 733 HG LEU 95 HG LEU 95 41.519 31.921 34.264 734 HD11 LEU 95 HD11 LEU 95 40.893 31.240 31.984 735 HD12 LEU 95 HD12 LEU 95 39.174 31.194 32.453 736 HD13 LEU 95 HD13 LEU 95 40.065 32.732 32.442 737 HD21 LEU 95 HD21 LEU 95 39.436 33.190 34.710 738 HD22 LEU 95 HD22 LEU 95 38.539 31.663 34.874 739 HD23 LEU 95 HD23 LEU 95 39.820 32.094 36.034 740 H LEU 96 H LEU 96 42.527 27.346 35.524 741 HA LEU 96 HA LEU 96 40.569 25.509 36.666 742 HB2 LEU 96 HB2 LEU 96 43.597 25.165 36.693 743 HB3 LEU 96 HB3 LEU 96 42.413 23.859 36.784 744 HG LEU 96 HG LEU 96 42.987 25.547 34.359 745 HD11 LEU 96 HD11 LEU 96 43.865 23.414 33.504 746 HD12 LEU 96 HD12 LEU 96 44.679 23.838 35.001 747 HD13 LEU 96 HD13 LEU 96 43.410 22.601 35.011 748 HD21 LEU 96 HD21 LEU 96 40.990 23.299 34.748 749 HD22 LEU 96 HD22 LEU 96 40.591 25.013 34.460 750 HD23 LEU 96 HD23 LEU 96 41.426 24.108 33.214 751 H SER 97 H SER 97 41.911 28.005 38.406 752 HA SER 97 HA SER 97 41.854 26.559 41.000 753 HB2 SER 97 HB2 SER 97 43.489 28.424 40.550 754 HB3 SER 97 HB3 SER 97 42.109 29.535 40.489 755 HG SER 97 HG SER 97 43.142 28.008 42.657 Start of MODEL 2 1 H1 GLY 1 H1 GLY 1 10.657 21.126 34.216 2 H2 GLY 1 H2 GLY 1 9.656 20.007 34.895 3 H3 GLY 1 H3 GLY 1 11.085 19.532 34.233 4 HA2 GLY 1 HA2 GLY 1 10.789 21.227 36.620 5 HA3 GLY 1 HA3 GLY 1 11.252 19.514 36.606 6 H ALA 2 H ALA 2 12.599 22.213 37.319 7 HA ALA 2 HA ALA 2 14.618 23.120 37.419 8 HB1 ALA 2 HB1 ALA 2 15.707 20.495 36.380 9 HB2 ALA 2 HB2 ALA 2 16.549 21.706 37.365 10 HB3 ALA 2 HB3 ALA 2 15.193 20.801 38.053 11 H MET 3 H MET 3 16.597 23.862 36.396 12 HA MET 3 HA MET 3 17.603 25.175 34.860 13 HB2 MET 3 HB2 MET 3 17.482 22.502 33.445 14 HB3 MET 3 HB3 MET 3 18.610 23.815 33.067 15 HG2 MET 3 HG2 MET 3 19.444 23.744 35.415 16 HG3 MET 3 HG3 MET 3 18.399 22.358 35.728 17 HE1 MET 3 HE1 MET 3 21.541 22.525 36.275 18 HE2 MET 3 HE2 MET 3 20.524 21.122 36.680 19 HE3 MET 3 HE3 MET 3 22.032 20.890 35.766 20 HA PRO 4 HA PRO 4 14.249 26.546 31.992 21 HB2 PRO 4 HB2 PRO 4 15.042 29.205 33.137 22 HB3 PRO 4 HB3 PRO 4 13.406 28.559 32.809 23 HG2 PRO 4 HG2 PRO 4 14.363 28.696 35.348 24 HG3 PRO 4 HG3 PRO 4 13.442 27.256 34.805 25 HD2 PRO 4 HD2 PRO 4 16.457 27.608 34.956 26 HD3 PRO 4 HD3 PRO 4 15.447 26.272 35.579 27 H SER 5 H SER 5 17.593 27.403 32.442 28 HA SER 5 HA SER 5 17.957 27.587 29.565 29 HB2 SER 5 HB2 SER 5 19.478 29.600 29.764 30 HB3 SER 5 HB3 SER 5 17.758 29.949 29.828 31 HG SER 5 HG SER 5 19.134 31.002 31.489 32 H ILE 6 H ILE 6 20.163 27.369 28.939 33 HA ILE 6 HA ILE 6 21.607 25.388 30.302 34 HB ILE 6 HB ILE 6 23.307 25.683 28.659 35 HG12 ILE 6 HG12 ILE 6 22.097 28.405 28.186 36 HG13 ILE 6 HG13 ILE 6 23.766 28.011 28.521 37 HG21 ILE 6 HG21 ILE 6 20.784 26.145 27.252 38 HG22 ILE 6 HG22 ILE 6 22.179 25.129 26.816 39 HG23 ILE 6 HG23 ILE 6 21.135 24.640 28.156 40 HD11 ILE 6 HD11 ILE 6 23.921 26.936 26.248 41 HD12 ILE 6 HD12 ILE 6 22.253 27.461 25.930 42 HD13 ILE 6 HD13 ILE 6 23.521 28.669 26.211 43 H ALA 7 H ALA 7 21.821 28.844 30.730 44 HA ALA 7 HA ALA 7 24.284 29.254 31.921 45 HB1 ALA 7 HB1 ALA 7 21.586 30.430 32.708 46 HB2 ALA 7 HB2 ALA 7 23.187 31.149 32.992 47 HB3 ALA 7 HB3 ALA 7 22.590 30.966 31.340 48 H SER 8 H SER 8 21.405 27.687 33.426 49 HA SER 8 HA SER 8 22.408 27.723 36.120 50 HB2 SER 8 HB2 SER 8 20.057 27.358 35.634 51 HB3 SER 8 HB3 SER 8 20.427 25.879 34.721 52 HG SER 8 HG SER 8 20.012 26.147 37.346 53 H MET 9 H MET 9 22.952 25.448 33.422 54 HA MET 9 HA MET 9 24.234 23.327 34.909 55 HB2 MET 9 HB2 MET 9 24.798 24.146 32.024 56 HB3 MET 9 HB3 MET 9 25.045 22.570 32.765 57 HG2 MET 9 HG2 MET 9 22.599 22.315 33.018 58 HG3 MET 9 HG3 MET 9 22.347 23.884 32.253 59 HE1 MET 9 HE1 MET 9 20.658 22.825 30.544 60 HE2 MET 9 HE2 MET 9 21.026 21.407 29.537 61 HE3 MET 9 HE3 MET 9 20.897 21.236 31.302 62 H ILE 10 H ILE 10 25.355 26.340 33.457 63 HA ILE 10 HA ILE 10 28.178 25.834 33.633 64 HB ILE 10 HB ILE 10 27.139 28.597 33.372 65 HG12 ILE 10 HG12 ILE 10 26.704 26.253 31.504 66 HG13 ILE 10 HG13 ILE 10 25.631 27.588 31.974 67 HG21 ILE 10 HG21 ILE 10 29.606 27.989 33.438 68 HG22 ILE 10 HG22 ILE 10 29.362 27.023 31.983 69 HG23 ILE 10 HG23 ILE 10 29.086 28.778 31.945 70 HD11 ILE 10 HD11 ILE 10 27.093 29.071 30.594 71 HD12 ILE 10 HD12 ILE 10 27.888 27.558 30.050 72 HD13 ILE 10 HD13 ILE 10 26.142 27.828 29.723 73 H LYS 11 H LYS 11 25.814 26.894 35.830 74 HA LYS 11 HA LYS 11 27.654 27.832 37.950 75 HB2 LYS 11 HB2 LYS 11 24.663 27.574 37.887 76 HB3 LYS 11 HB3 LYS 11 25.631 28.275 39.192 77 HG2 LYS 11 HG2 LYS 11 26.506 30.018 37.673 78 HG3 LYS 11 HG3 LYS 11 25.610 29.319 36.316 79 HD2 LYS 11 HD2 LYS 11 23.502 29.575 37.610 80 HD3 LYS 11 HD3 LYS 11 24.442 30.367 38.888 81 HE2 LYS 11 HE2 LYS 11 23.327 32.043 37.509 82 HE3 LYS 11 HE3 LYS 11 25.086 32.165 37.287 83 HZ1 LYS 11 HZ1 LYS 11 24.803 30.901 35.210 84 HZ2 LYS 11 HZ2 LYS 11 23.159 30.845 35.459 85 HZ3 LYS 11 HZ3 LYS 11 23.920 32.275 35.184 86 H GLY 12 H GLY 12 26.562 24.850 36.852 87 HA2 GLY 12 HA2 GLY 12 26.687 23.506 39.503 88 HA3 GLY 12 HA3 GLY 12 26.110 22.825 37.975 89 H ASN 13 H ASN 13 28.254 23.501 36.272 90 HA ASN 13 HA ASN 13 30.506 21.794 37.340 91 HB2 ASN 13 HB2 ASN 13 29.378 22.176 34.533 92 HB3 ASN 13 HB3 ASN 13 30.904 21.366 34.860 93 HD21 ASN 13 HD21 ASN 13 30.785 19.548 36.493 94 HD22 ASN 13 HD22 ASN 13 29.407 18.462 36.320 95 H LYS 14 H LYS 14 32.630 22.255 36.645 96 HA LYS 14 HA LYS 14 33.311 25.088 36.768 97 HB2 LYS 14 HB2 LYS 14 34.744 23.200 37.586 98 HB3 LYS 14 HB3 LYS 14 35.040 22.735 35.934 99 HG2 LYS 14 HG2 LYS 14 36.887 24.013 36.064 100 HG3 LYS 14 HG3 LYS 14 35.762 25.330 35.677 101 HD2 LYS 14 HD2 LYS 14 37.187 26.022 37.449 102 HD3 LYS 14 HD3 LYS 14 35.507 25.830 38.025 103 HE2 LYS 14 HE2 LYS 14 36.211 23.547 38.923 104 HE3 LYS 14 HE3 LYS 14 37.880 23.994 38.531 105 HZ1 LYS 14 HZ1 LYS 14 36.084 25.476 40.382 106 HZ2 LYS 14 HZ2 LYS 14 37.312 24.497 40.830 107 HZ3 LYS 14 HZ3 LYS 14 37.655 25.882 40.063 108 H VAL 15 H VAL 15 33.488 22.677 34.123 109 HA VAL 15 HA VAL 15 33.482 24.920 32.158 110 HB VAL 15 HB VAL 15 34.999 22.315 31.871 111 HG11 VAL 15 HG11 VAL 15 34.302 23.267 29.717 112 HG12 VAL 15 HG12 VAL 15 34.993 24.833 30.171 113 HG13 VAL 15 HG13 VAL 15 36.042 23.419 29.964 114 HG21 VAL 15 HG21 VAL 15 35.779 25.060 32.876 115 HG22 VAL 15 HG22 VAL 15 36.203 23.461 33.520 116 HG23 VAL 15 HG23 VAL 15 36.948 24.059 32.033 117 H VAL 16 H VAL 16 31.996 24.923 30.652 118 HA VAL 16 HA VAL 16 30.405 22.454 30.176 119 HB VAL 16 HB VAL 16 29.177 25.181 30.632 120 HG11 VAL 16 HG11 VAL 16 27.043 23.913 30.569 121 HG12 VAL 16 HG12 VAL 16 27.882 23.809 29.014 122 HG13 VAL 16 HG13 VAL 16 27.925 22.434 30.146 123 HG21 VAL 16 HG21 VAL 16 29.855 24.228 32.783 124 HG22 VAL 16 HG22 VAL 16 28.119 23.926 32.605 125 HG23 VAL 16 HG23 VAL 16 29.267 22.621 32.296 126 H VAL 17 H VAL 17 30.137 21.964 28.076 127 HA VAL 17 HA VAL 17 30.680 24.084 26.023 128 HB VAL 17 HB VAL 17 31.634 21.202 26.148 129 HG11 VAL 17 HG11 VAL 17 31.002 21.691 23.817 130 HG12 VAL 17 HG12 VAL 17 31.926 23.210 23.865 131 HG13 VAL 17 HG13 VAL 17 32.753 21.637 23.979 132 HG21 VAL 17 HG21 VAL 17 33.024 22.703 27.443 133 HG22 VAL 17 HG22 VAL 17 33.861 22.267 25.948 134 HG23 VAL 17 HG23 VAL 17 33.089 23.858 26.096 135 H PHE 18 H PHE 18 29.357 24.212 24.283 136 HA PHE 18 HA PHE 18 27.049 22.292 24.166 137 HB2 PHE 18 HB2 PHE 18 27.089 25.206 23.327 138 HB3 PHE 18 HB3 PHE 18 25.706 24.119 23.321 139 HD1 PHE 18 HD2 PHE 18 24.960 23.105 25.587 140 HD2 PHE 18 HD1 PHE 18 27.611 26.478 25.261 141 HE1 PHE 18 HE2 PHE 18 24.508 23.696 27.967 142 HE2 PHE 18 HE1 PHE 18 27.083 27.119 27.604 143 HZ PHE 18 HZ PHE 18 25.518 25.744 28.946 144 H SER 19 H SER 19 27.079 21.014 22.495 145 HA SER 19 HA SER 19 28.557 21.722 19.986 146 HB2 SER 19 HB2 SER 19 28.843 19.297 21.801 147 HB3 SER 19 HB3 SER 19 29.509 19.385 20.159 148 HG SER 19 HG SER 19 31.052 20.003 21.643 149 H TRP 20 H TRP 20 28.359 19.972 18.294 150 HA TRP 20 HA TRP 20 25.638 18.707 18.275 151 HB2 TRP 20 HB2 TRP 20 26.975 20.358 16.143 152 HB3 TRP 20 HB3 TRP 20 26.017 18.973 15.678 153 HD1 TRP 20 HD1 TRP 20 24.364 20.660 18.583 154 HE1 TRP 20 HE1 TRP 20 22.187 21.752 17.725 155 HE3 TRP 20 HE3 TRP 20 25.267 20.554 13.544 156 HZ2 TRP 20 HZ2 TRP 20 21.152 22.756 15.262 157 HZ3 TRP 20 HZ3 TRP 20 23.704 21.672 11.967 158 HH2 TRP 20 HH2 TRP 20 21.644 22.773 12.812 159 H VAL 21 H VAL 21 25.560 16.602 17.625 160 HA VAL 21 HA VAL 21 28.113 15.138 17.624 161 HB VAL 21 HB VAL 21 26.481 13.127 17.314 162 HG11 VAL 21 HG11 VAL 21 26.311 12.903 19.711 163 HG12 VAL 21 HG12 VAL 21 27.885 13.584 19.288 164 HG13 VAL 21 HG13 VAL 21 26.604 14.634 19.930 165 HG21 VAL 21 HG21 VAL 21 24.560 15.088 18.645 166 HG22 VAL 21 HG22 VAL 21 24.397 14.520 16.967 167 HG23 VAL 21 HG23 VAL 21 24.303 13.371 18.306 168 H THR 22 H THR 22 28.238 14.397 14.105 169 HA THR 22 HA THR 22 29.773 15.103 16.580 170 HB THR 22 HB THR 22 31.680 13.950 15.481 171 HG1 THR 22 HG1 THR 22 31.282 12.495 13.905 172 HG21 THR 22 HG21 THR 22 30.454 12.881 17.302 173 HG22 THR 22 HG22 THR 22 30.935 11.676 16.103 174 HG23 THR 22 HG23 THR 22 29.249 12.246 16.170 175 H CYS 23 H CYS 23 31.438 16.617 16.436 176 HA CYS 23 HA CYS 23 31.209 18.405 14.052 177 HB2 CYS 23 HB2 CYS 23 29.928 19.406 15.701 178 HB3 CYS 23 HB3 CYS 23 31.052 19.001 16.996 179 HG CYS 23 HG CYS 23 30.782 21.664 16.135 180 HA PRO 24 HA PRO 24 35.556 17.563 13.978 181 HB2 PRO 24 HB2 PRO 24 36.367 19.093 11.873 182 HB3 PRO 24 HB3 PRO 24 35.320 17.652 11.684 183 HG2 PRO 24 HG2 PRO 24 34.464 20.560 11.855 184 HG3 PRO 24 HG3 PRO 24 33.991 19.324 10.643 185 HD2 PRO 24 HD2 PRO 24 32.427 19.904 12.796 186 HD3 PRO 24 HD3 PRO 24 32.558 18.242 12.153 187 H TYR 25 H TYR 25 34.290 20.633 14.836 188 HA TYR 25 HA TYR 25 36.862 21.540 15.990 189 HB2 TYR 25 HB2 TYR 25 34.045 22.655 16.142 190 HB3 TYR 25 HB3 TYR 25 35.452 23.400 16.871 191 HD1 TYR 25 HD2 TYR 25 37.578 23.332 14.927 192 HD2 TYR 25 HD1 TYR 25 33.356 23.985 14.287 193 HE1 TYR 25 HE2 TYR 25 38.083 24.694 12.897 194 HE2 TYR 25 HE1 TYR 25 33.872 25.301 12.241 195 HH TYR 25 HH TYR 25 35.503 26.248 10.944 196 H CYS 26 H CYS 26 33.771 20.117 17.160 197 HA CYS 26 HA CYS 26 34.312 20.521 19.914 198 HB2 CYS 26 HB2 CYS 26 32.158 20.078 19.115 199 HB3 CYS 26 HB3 CYS 26 32.547 18.490 18.463 200 HG CYS 26 HG CYS 26 33.071 17.286 20.673 201 H VAL 27 H VAL 27 35.227 17.782 17.879 202 HA VAL 27 HA VAL 27 36.564 16.086 19.614 203 HB VAL 27 HB VAL 27 36.296 15.853 17.352 204 HG11 VAL 27 HG11 VAL 27 38.445 17.533 16.399 205 HG12 VAL 27 HG12 VAL 27 37.225 16.596 15.527 206 HG13 VAL 27 HG13 VAL 27 36.700 17.971 16.483 207 HG21 VAL 27 HG21 VAL 27 38.080 14.458 18.449 208 HG22 VAL 27 HG22 VAL 27 38.444 14.715 16.737 209 HG23 VAL 27 HG23 VAL 27 39.269 15.682 17.982 210 H ARG 28 H ARG 28 37.903 18.511 17.868 211 HA ARG 28 HA ARG 28 40.507 18.801 18.992 212 HB2 ARG 28 HB2 ARG 28 39.183 21.371 18.143 213 HB3 ARG 28 HB3 ARG 28 40.877 20.914 18.061 214 HG2 ARG 28 HG2 ARG 28 40.157 19.176 16.293 215 HG3 ARG 28 HG3 ARG 28 38.579 20.022 16.342 216 HD2 ARG 28 HD2 ARG 28 39.779 22.162 15.844 217 HD3 ARG 28 HD3 ARG 28 41.259 21.215 15.592 218 HE ARG 28 HE ARG 28 39.157 20.110 14.002 219 HH11 ARG 28 HH22 ARG 28 41.047 23.065 14.095 220 HH12 ARG 28 HH21 ARG 28 40.571 23.520 12.473 221 HH21 ARG 28 HH12 ARG 28 39.062 20.455 11.851 222 HH22 ARG 28 HH11 ARG 28 39.360 22.085 11.240 223 H ALA 29 H ALA 29 37.623 20.560 20.041 224 HA ALA 29 HA ALA 29 38.899 21.972 22.202 225 HB1 ALA 29 HB1 ALA 29 36.796 22.724 21.154 226 HB2 ALA 29 HB2 ALA 29 35.960 21.277 21.765 227 HB3 ALA 29 HB3 ALA 29 36.600 22.482 22.903 228 H GLU 30 H GLU 30 36.854 18.934 22.246 229 HA GLU 30 HA GLU 30 37.131 18.411 25.042 230 HB2 GLU 30 HB2 GLU 30 36.870 16.527 22.665 231 HB3 GLU 30 HB3 GLU 30 36.862 15.996 24.344 232 HG2 GLU 30 HG2 GLU 30 34.834 17.460 24.739 233 HG3 GLU 30 HG3 GLU 30 34.735 17.703 22.979 234 H LYS 31 H LYS 31 39.345 17.598 22.417 235 HA LYS 31 HA LYS 31 41.089 16.025 23.974 236 HB2 LYS 31 HB2 LYS 31 41.164 15.901 21.591 237 HB3 LYS 31 HB3 LYS 31 41.268 17.634 21.403 238 HG2 LYS 31 HG2 LYS 31 43.643 17.557 22.240 239 HG3 LYS 31 HG3 LYS 31 43.497 15.794 22.360 240 HD2 LYS 31 HD2 LYS 31 44.591 16.362 20.267 241 HD3 LYS 31 HD3 LYS 31 42.972 15.711 19.918 242 HE2 LYS 31 HE2 LYS 31 42.090 17.938 19.552 243 HE3 LYS 31 HE3 LYS 31 43.602 18.692 20.071 244 HZ1 LYS 31 HZ1 LYS 31 44.676 17.792 18.113 245 HZ2 LYS 31 HZ2 LYS 31 43.343 16.962 17.658 246 HZ3 LYS 31 HZ3 LYS 31 43.365 18.617 17.633 247 H LEU 32 H LEU 32 41.248 19.485 23.203 248 HA LEU 32 HA LEU 32 43.605 20.078 24.753 249 HB2 LEU 32 HB2 LEU 32 42.450 21.348 22.824 250 HB3 LEU 32 HB3 LEU 32 41.335 21.923 24.051 251 HG LEU 32 HG LEU 32 43.021 23.552 23.420 252 HD11 LEU 32 HD11 LEU 32 42.140 23.560 25.781 253 HD12 LEU 32 HD12 LEU 32 43.675 22.792 26.269 254 HD13 LEU 32 HD13 LEU 32 43.684 24.389 25.513 255 HD21 LEU 32 HD21 LEU 32 45.383 23.343 23.967 256 HD22 LEU 32 HD22 LEU 32 45.132 21.712 24.608 257 HD23 LEU 32 HD23 LEU 32 44.889 22.041 22.875 258 H LEU 33 H LEU 33 40.109 20.286 25.502 259 HA LEU 33 HA LEU 33 40.402 21.488 28.058 260 HB2 LEU 33 HB2 LEU 33 38.209 19.697 26.921 261 HB3 LEU 33 HB3 LEU 33 38.043 20.559 28.444 262 HG LEU 33 HG LEU 33 38.542 21.914 25.786 263 HD11 LEU 33 HD11 LEU 33 36.349 20.811 25.791 264 HD12 LEU 33 HD12 LEU 33 35.903 21.845 27.178 265 HD13 LEU 33 HD13 LEU 33 36.309 22.568 25.618 266 HD21 LEU 33 HD21 LEU 33 37.610 23.102 28.390 267 HD22 LEU 33 HD22 LEU 33 39.243 23.304 27.697 268 HD23 LEU 33 HD23 LEU 33 37.837 23.976 26.868 269 H HIS 34 H HIS 34 40.267 17.993 27.197 270 HA HIS 34 HA HIS 34 40.844 17.125 29.909 271 HB2 HIS 34 HB2 HIS 34 40.805 15.876 27.168 272 HB3 HIS 34 HB3 HIS 34 41.600 15.027 28.494 273 HD1 HIS 34 HD1 HIS 34 40.058 13.685 30.103 274 HD2 HIS 34 HD2 HIS 34 38.051 16.378 27.567 275 HE1 HIS 34 HE1 HIS 34 37.573 13.244 30.422 276 H ALA 35 H ALA 35 43.006 18.074 27.156 277 HA ALA 35 HA ALA 35 45.365 16.950 28.360 278 HB1 ALA 35 HB1 ALA 35 45.153 17.423 25.952 279 HB2 ALA 35 HB2 ALA 35 45.080 19.170 26.292 280 HB3 ALA 35 HB3 ALA 35 46.554 18.250 26.646 281 H ARG 36 H ARG 36 43.822 20.060 28.775 282 HA ARG 36 HA ARG 36 45.928 20.996 30.674 283 HB2 ARG 36 HB2 ARG 36 44.046 22.293 28.741 284 HB3 ARG 36 HB3 ARG 36 44.466 23.212 30.164 285 HG2 ARG 36 HG2 ARG 36 46.574 22.024 28.318 286 HG3 ARG 36 HG3 ARG 36 45.942 23.671 28.159 287 HD2 ARG 36 HD2 ARG 36 46.680 24.194 30.467 288 HD3 ARG 36 HD3 ARG 36 47.326 22.570 30.642 289 HE ARG 36 HE ARG 36 48.381 24.752 28.888 290 HH11 ARG 36 HH22 ARG 36 49.075 21.600 30.419 291 HH12 ARG 36 HH21 ARG 36 50.715 21.675 29.778 292 HH21 ARG 36 HH12 ARG 36 50.581 24.689 28.395 293 HH22 ARG 36 HH11 ARG 36 51.471 23.204 28.720 294 H THR 37 H THR 37 43.556 19.260 31.131 295 HA THR 37 HA THR 37 42.364 18.585 32.923 296 HB THR 37 HB THR 37 43.464 20.570 34.808 297 HG1 THR 37 HG1 THR 37 44.986 18.581 33.437 298 HG21 THR 37 HG21 THR 37 43.475 17.508 34.736 299 HG22 THR 37 HG22 THR 37 42.257 18.493 35.549 300 HG23 THR 37 HG23 THR 37 43.935 18.525 36.119 301 H LYS 38 H LYS 38 40.929 20.392 31.416 302 HA LYS 38 HA LYS 38 39.321 22.026 33.322 303 HB2 LYS 38 HB2 LYS 38 39.011 21.293 30.391 304 HB3 LYS 38 HB3 LYS 38 37.708 21.958 31.350 305 HG2 LYS 38 HG2 LYS 38 38.739 23.763 30.154 306 HG3 LYS 38 HG3 LYS 38 39.079 23.975 31.842 307 HD2 LYS 38 HD2 LYS 38 41.172 22.562 30.213 308 HD3 LYS 38 HD3 LYS 38 40.905 24.259 29.869 309 HE2 LYS 38 HE2 LYS 38 41.643 23.095 32.581 310 HE3 LYS 38 HE3 LYS 38 42.713 23.958 31.488 311 HZ1 LYS 38 HZ1 LYS 38 42.044 25.547 33.025 312 HZ2 LYS 38 HZ2 LYS 38 41.096 25.881 31.755 313 HZ3 LYS 38 HZ3 LYS 38 40.465 25.063 33.048 314 H ASP 39 H ASP 39 38.468 20.800 34.833 315 HA ASP 39 HA ASP 39 37.029 18.379 34.469 316 HB2 ASP 39 HB2 ASP 39 37.636 19.350 36.666 317 HB3 ASP 39 HB3 ASP 39 36.477 20.657 36.416 318 H ILE 40 H ILE 40 35.799 18.174 32.811 319 HA ILE 40 HA ILE 40 34.073 20.387 31.878 320 HB ILE 40 HB ILE 40 36.192 19.973 30.739 321 HG12 ILE 40 HG12 ILE 40 33.697 20.461 29.475 322 HG13 ILE 40 HG13 ILE 40 35.299 21.053 29.117 323 HG21 ILE 40 HG21 ILE 40 36.632 18.052 29.350 324 HG22 ILE 40 HG22 ILE 40 36.325 17.524 30.995 325 HG23 ILE 40 HG23 ILE 40 35.064 17.326 29.771 326 HD11 ILE 40 HD11 ILE 40 34.207 20.038 27.144 327 HD12 ILE 40 HD12 ILE 40 35.734 19.234 27.555 328 HD13 ILE 40 HD13 ILE 40 34.160 18.475 27.954 329 H THR 41 H THR 41 32.119 20.225 31.198 330 HA THR 41 HA THR 41 30.765 17.594 30.700 331 HB THR 41 HB THR 41 29.779 20.160 31.986 332 HG1 THR 41 HG1 THR 41 29.176 18.714 33.577 333 HG21 THR 41 HG21 THR 41 28.003 19.505 30.425 334 HG22 THR 41 HG22 THR 41 27.532 19.140 32.075 335 HG23 THR 41 HG23 THR 41 28.079 17.825 31.006 336 H VAL 42 H VAL 42 30.520 17.402 28.476 337 HA VAL 42 HA VAL 42 29.526 19.818 27.053 338 HB VAL 42 HB VAL 42 31.218 19.261 25.783 339 HG11 VAL 42 HG11 VAL 42 32.173 17.550 26.807 340 HG12 VAL 42 HG12 VAL 42 30.896 16.378 26.317 341 HG13 VAL 42 HG13 VAL 42 32.018 17.089 25.116 342 HG21 VAL 42 HG21 VAL 42 30.600 18.290 23.716 343 HG22 VAL 42 HG22 VAL 42 29.143 17.574 24.443 344 HG23 VAL 42 HG23 VAL 42 29.318 19.347 24.323 345 H HIS 43 H HIS 43 27.720 20.028 26.124 346 HA HIS 43 HA HIS 43 25.560 18.004 26.467 347 HB2 HIS 43 HB2 HIS 43 25.412 20.163 27.764 348 HB3 HIS 43 HB3 HIS 43 25.454 21.032 26.256 349 HD1 HIS 43 HD1 HIS 43 23.146 17.962 26.255 350 HD2 HIS 43 HD2 HIS 43 23.056 22.096 27.077 351 HE1 HIS 43 HE1 HIS 43 20.694 18.638 26.363 352 H TYR 44 H TYR 44 24.716 17.194 24.617 353 HA TYR 44 HA TYR 44 25.508 18.427 22.032 354 HB2 TYR 44 HB2 TYR 44 24.635 15.609 22.716 355 HB3 TYR 44 HB3 TYR 44 24.899 16.218 21.084 356 HD1 TYR 44 HD1 TYR 44 27.130 17.271 20.458 357 HD2 TYR 44 HD2 TYR 44 26.576 14.850 23.981 358 HE1 TYR 44 HE1 TYR 44 29.601 16.877 20.582 359 HE2 TYR 44 HE2 TYR 44 29.052 14.552 24.152 360 HH TYR 44 HH TYR 44 31.078 14.960 23.190 361 H VAL 45 H VAL 45 23.985 20.112 22.111 362 HA VAL 45 HA VAL 45 21.221 19.734 22.621 363 HB VAL 45 HB VAL 45 20.853 21.952 21.652 364 HG11 VAL 45 HG11 VAL 45 22.217 23.207 23.224 365 HG12 VAL 45 HG12 VAL 45 21.670 21.707 23.977 366 HG13 VAL 45 HG13 VAL 45 23.347 21.844 23.394 367 HG21 VAL 45 HG21 VAL 45 23.801 21.870 20.863 368 HG22 VAL 45 HG22 VAL 45 22.399 21.934 19.765 369 HG23 VAL 45 HG23 VAL 45 22.753 23.296 20.831 370 H ASP 46 H ASP 46 22.902 18.934 19.705 371 HA ASP 46 HA ASP 46 20.695 18.876 17.877 372 HB2 ASP 46 HB2 ASP 46 23.179 18.553 17.345 373 HB3 ASP 46 HB3 ASP 46 23.036 16.926 17.989 374 H LYS 47 H LYS 47 21.486 16.801 20.587 375 HA LYS 47 HA LYS 47 19.814 14.502 19.835 376 HB2 LYS 47 HB2 LYS 47 21.035 15.302 22.500 377 HB3 LYS 47 HB3 LYS 47 20.261 13.783 22.116 378 HG2 LYS 47 HG2 LYS 47 22.102 13.827 20.097 379 HG3 LYS 47 HG3 LYS 47 22.962 14.762 21.327 380 HD2 LYS 47 HD2 LYS 47 22.382 12.840 22.959 381 HD3 LYS 47 HD3 LYS 47 21.787 11.984 21.522 382 HE2 LYS 47 HE2 LYS 47 24.179 12.509 20.546 383 HE3 LYS 47 HE3 LYS 47 24.640 12.816 22.220 384 HZ1 LYS 47 HZ1 LYS 47 24.126 10.544 22.773 385 HZ2 LYS 47 HZ2 LYS 47 23.374 10.286 21.328 386 HZ3 LYS 47 HZ3 LYS 47 24.998 10.499 21.384 387 H MET 48 H MET 48 19.142 17.663 21.074 388 HA MET 48 HA MET 48 16.873 16.715 22.745 389 HB2 MET 48 HB2 MET 48 18.840 17.976 23.729 390 HB3 MET 48 HB3 MET 48 18.296 19.391 22.822 391 HG2 MET 48 HG2 MET 48 16.061 19.163 24.012 392 HG3 MET 48 HG3 MET 48 16.781 17.877 24.989 393 HE1 MET 48 HE1 MET 48 16.414 19.293 27.490 394 HE2 MET 48 HE2 MET 48 16.361 21.057 27.329 395 HE3 MET 48 HE3 MET 48 15.342 20.036 26.296 396 H SER 49 H SER 49 14.851 17.173 22.293 397 HA SER 49 HA SER 49 13.750 18.331 20.001 398 HB2 SER 49 HB2 SER 49 11.689 18.503 21.469 399 HB3 SER 49 HB3 SER 49 12.490 16.919 21.534 400 HG SER 49 HG SER 49 12.011 17.717 23.662 401 H GLU 50 H GLU 50 14.399 19.808 23.090 402 HA GLU 50 HA GLU 50 13.583 22.490 22.468 403 HB2 GLU 50 HB2 GLU 50 14.035 20.874 24.731 404 HB3 GLU 50 HB3 GLU 50 15.291 22.087 24.862 405 HG2 GLU 50 HG2 GLU 50 13.744 23.814 25.214 406 HG3 GLU 50 HG3 GLU 50 12.455 22.982 24.328 407 H GLY 51 H GLY 51 16.509 21.026 21.633 408 HA2 GLY 51 HA2 GLY 51 18.518 22.703 22.490 409 HA3 GLY 51 HA3 GLY 51 18.529 21.844 20.943 410 H GLU 52 H GLU 52 16.199 23.680 19.973 411 HA GLU 52 HA GLU 52 17.937 25.759 18.836 412 HB2 GLU 52 HB2 GLU 52 14.953 25.278 18.587 413 HB3 GLU 52 HB3 GLU 52 15.808 26.597 17.834 414 HG2 GLU 52 HG2 GLU 52 15.371 24.587 16.348 415 HG3 GLU 52 HG3 GLU 52 16.983 25.286 16.374 416 H GLN 53 H GLN 53 15.707 25.499 21.510 417 HA GLN 53 HA GLN 53 15.497 28.334 22.134 418 HB2 GLN 53 HB2 GLN 53 13.967 26.307 22.809 419 HB3 GLN 53 HB3 GLN 53 15.146 26.082 24.104 420 HG2 GLN 53 HG2 GLN 53 13.395 27.497 24.912 421 HG3 GLN 53 HG3 GLN 53 14.833 28.493 24.746 422 HE21 GLN 53 HE21 GLN 53 13.795 30.493 24.443 423 HE22 GLN 53 HE22 GLN 53 12.701 30.824 23.105 424 H LEU 54 H LEU 54 17.586 25.599 23.269 425 HA LEU 54 HA LEU 54 19.118 27.294 25.054 426 HB2 LEU 54 HB2 LEU 54 19.827 24.579 23.859 427 HB3 LEU 54 HB3 LEU 54 20.718 25.391 25.121 428 HG LEU 54 HG LEU 54 19.551 23.998 26.436 429 HD11 LEU 54 HD11 LEU 54 18.687 26.309 27.104 430 HD12 LEU 54 HD12 LEU 54 17.233 25.946 26.165 431 HD13 LEU 54 HD13 LEU 54 17.671 24.938 27.551 432 HD21 LEU 54 HD21 LEU 54 17.341 23.090 26.026 433 HD22 LEU 54 HD22 LEU 54 17.190 24.082 24.567 434 HD23 LEU 54 HD23 LEU 54 18.443 22.813 24.673 435 H ARG 55 H ARG 55 19.616 26.274 21.664 436 HA ARG 55 HA ARG 55 22.008 27.811 21.177 437 HB2 ARG 55 HB2 ARG 55 19.695 26.980 19.381 438 HB3 ARG 55 HB3 ARG 55 21.122 27.815 18.785 439 HG2 ARG 55 HG2 ARG 55 22.583 25.986 19.391 440 HG3 ARG 55 HG3 ARG 55 21.336 25.209 20.338 441 HD2 ARG 55 HD2 ARG 55 21.517 23.941 18.364 442 HD3 ARG 55 HD3 ARG 55 20.005 24.833 18.244 443 HE ARG 55 HE ARG 55 22.523 25.798 16.897 444 HH11 ARG 55 HH12 ARG 55 19.202 24.627 16.394 445 HH12 ARG 55 HH11 ARG 55 19.131 25.468 14.856 446 HH21 ARG 55 HH22 ARG 55 22.437 26.367 14.833 447 HH22 ARG 55 HH21 ARG 55 20.956 26.264 13.907 448 H GLY 56 H GLY 56 18.579 28.814 21.270 449 HA2 GLY 56 HA2 GLY 56 18.946 31.546 20.512 450 HA3 GLY 56 HA3 GLY 56 17.624 30.882 21.478 451 H GLU 57 H GLU 57 19.010 30.010 23.796 452 HA GLU 57 HA GLU 57 19.543 32.402 25.284 453 HB2 GLU 57 HB2 GLU 57 20.275 29.510 25.793 454 HB3 GLU 57 HB3 GLU 57 20.730 30.798 26.885 455 HG2 GLU 57 HG2 GLU 57 17.866 29.957 26.224 456 HG3 GLU 57 HG3 GLU 57 18.784 29.696 27.660 457 H ILE 58 H ILE 58 21.812 30.305 23.458 458 HA ILE 58 HA ILE 58 24.166 31.887 24.152 459 HB ILE 58 HB ILE 58 23.767 30.141 21.693 460 HG12 ILE 58 HG12 ILE 58 24.995 29.335 24.369 461 HG13 ILE 58 HG13 ILE 58 23.392 28.860 23.824 462 HG21 ILE 58 HG21 ILE 58 26.367 30.898 23.103 463 HG22 ILE 58 HG22 ILE 58 26.169 30.072 21.543 464 HG23 ILE 58 HG23 ILE 58 25.736 31.762 21.684 465 HD11 ILE 58 HD11 ILE 58 24.857 27.024 23.431 466 HD12 ILE 58 HD12 ILE 58 24.394 27.700 21.857 467 HD13 ILE 58 HD13 ILE 58 26.005 28.028 22.537 468 H TYR 59 H TYR 59 21.931 31.850 21.325 469 HA TYR 59 HA TYR 59 23.295 33.753 19.837 470 HB2 TYR 59 HB2 TYR 59 21.335 32.128 19.244 471 HB3 TYR 59 HB3 TYR 59 20.311 33.516 19.573 472 HD1 TYR 59 HD1 TYR 59 20.738 35.673 18.196 473 HD2 TYR 59 HD2 TYR 59 22.647 31.925 17.342 474 HE1 TYR 59 HE1 TYR 59 21.274 36.467 15.897 475 HE2 TYR 59 HE2 TYR 59 23.194 32.694 15.045 476 HH TYR 59 HH TYR 59 22.939 34.387 13.510 477 H GLN 60 H GLN 60 20.534 34.410 22.077 478 HA GLN 60 HA GLN 60 20.313 37.168 21.439 479 HB2 GLN 60 HB2 GLN 60 19.662 35.588 23.953 480 HB3 GLN 60 HB3 GLN 60 19.312 37.312 23.824 481 HG2 GLN 60 HG2 GLN 60 18.239 35.241 21.858 482 HG3 GLN 60 HG3 GLN 60 17.389 35.767 23.301 483 HE21 GLN 60 HE21 GLN 60 15.848 36.177 21.321 484 HE22 GLN 60 HE22 GLN 60 15.851 37.856 20.778 485 H ALA 61 H ALA 61 22.528 35.590 23.739 486 HA ALA 61 HA ALA 61 23.648 38.157 24.623 487 HB1 ALA 61 HB1 ALA 61 24.518 35.283 25.083 488 HB2 ALA 61 HB2 ALA 61 25.179 36.714 25.907 489 HB3 ALA 61 HB3 ALA 61 23.481 36.261 26.151 490 H TYR 62 H TYR 62 24.740 35.535 22.409 491 HA TYR 62 HA TYR 62 27.263 37.060 21.942 492 HB2 TYR 62 HB2 TYR 62 26.791 34.077 21.818 493 HB3 TYR 62 HB3 TYR 62 28.336 34.904 21.735 494 HD1 TYR 62 HD1 TYR 62 28.689 36.662 23.843 495 HD2 TYR 62 HD2 TYR 62 26.315 33.069 23.878 496 HE1 TYR 62 HE1 TYR 62 28.850 36.580 26.319 497 HE2 TYR 62 HE2 TYR 62 26.523 32.963 26.368 498 HH TYR 62 HH TYR 62 28.252 35.481 28.222 499 H LYS 63 H LYS 63 24.500 36.366 20.223 500 HA LYS 63 HA LYS 63 23.877 35.982 18.131 501 HB2 LYS 63 HB2 LYS 63 26.231 37.775 17.510 502 HB3 LYS 63 HB3 LYS 63 24.982 37.371 16.341 503 HG2 LYS 63 HG2 LYS 63 24.472 38.843 18.955 504 HG3 LYS 63 HG3 LYS 63 24.702 39.594 17.373 505 HD2 LYS 63 HD2 LYS 63 22.718 38.283 16.523 506 HD3 LYS 63 HD3 LYS 63 22.424 37.747 18.198 507 HE2 LYS 63 HE2 LYS 63 22.287 40.151 18.892 508 HE3 LYS 63 HE3 LYS 63 22.505 40.629 17.200 509 HZ1 LYS 63 HZ1 LYS 63 20.162 40.590 17.742 510 HZ2 LYS 63 HZ2 LYS 63 20.454 39.413 16.671 511 HZ3 LYS 63 HZ3 LYS 63 20.226 39.018 18.239 512 H HIS 64 H HIS 64 25.368 33.888 19.129 513 HA HIS 64 HA HIS 64 26.082 32.509 16.602 514 HB2 HIS 64 HB2 HIS 64 27.615 32.288 19.229 515 HB3 HIS 64 HB3 HIS 64 27.812 31.220 17.840 516 HD1 HIS 64 HD1 HIS 64 28.503 32.732 15.452 517 HD2 HIS 64 HD2 HIS 64 29.405 34.191 19.296 518 HE1 HIS 64 HE1 HIS 64 30.332 34.481 15.144 519 H GLU 65 H GLU 65 25.496 30.340 16.578 520 HA GLU 65 HA GLU 65 23.762 29.363 18.827 521 HB2 GLU 65 HB2 GLU 65 22.558 28.043 17.031 522 HB3 GLU 65 HB3 GLU 65 22.241 29.753 17.165 523 HG2 GLU 65 HG2 GLU 65 22.268 29.231 14.871 524 HG3 GLU 65 HG3 GLU 65 23.681 30.209 15.193 525 H THR 66 H THR 66 26.279 28.461 16.482 526 HA THR 66 HA THR 66 27.223 26.430 18.400 527 HB THR 66 HB THR 66 27.647 24.788 16.560 528 HG1 THR 66 HG1 THR 66 25.541 26.145 15.230 529 HG21 THR 66 HG21 THR 66 25.840 24.389 18.214 530 HG22 THR 66 HG22 THR 66 25.525 23.662 16.628 531 HG23 THR 66 HG23 THR 66 24.685 25.151 17.100 532 H VAL 67 H VAL 67 29.407 25.983 18.134 533 HA VAL 67 HA VAL 67 31.015 27.449 16.177 534 HB VAL 67 HB VAL 67 31.126 28.215 19.112 535 HG11 VAL 67 HG11 VAL 67 33.090 28.889 16.883 536 HG12 VAL 67 HG12 VAL 67 33.046 29.674 18.474 537 HG13 VAL 67 HG13 VAL 67 33.446 27.962 18.359 538 HG21 VAL 67 HG21 VAL 67 30.668 29.854 16.605 539 HG22 VAL 67 HG22 VAL 67 29.513 29.542 17.921 540 HG23 VAL 67 HG23 VAL 67 30.936 30.526 18.228 541 HA PRO 68 HA PRO 68 29.922 25.010 19.250 542 HB2 PRO 68 HB2 PRO 68 31.062 23.533 21.196 543 HB3 PRO 68 HB3 PRO 68 30.621 22.831 19.608 544 HG2 PRO 68 HG2 PRO 68 33.340 23.872 20.489 545 HG3 PRO 68 HG3 PRO 68 32.942 22.267 19.794 546 HD2 PRO 68 HD2 PRO 68 33.828 24.271 18.222 547 HD3 PRO 68 HD3 PRO 68 32.517 23.189 17.657 548 H ALA 69 H ALA 69 29.487 25.726 21.450 549 HA ALA 69 HA ALA 69 31.122 28.128 22.109 550 HB1 ALA 69 HB1 ALA 69 28.328 27.310 22.993 551 HB2 ALA 69 HB2 ALA 69 29.136 28.853 23.344 552 HB3 ALA 69 HB3 ALA 69 28.712 28.440 21.674 553 H ILE 70 H ILE 70 32.231 28.352 24.011 554 HA ILE 70 HA ILE 70 32.354 25.977 25.826 555 HB ILE 70 HB ILE 70 34.575 27.716 24.688 556 HG12 ILE 70 HG12 ILE 70 34.367 24.725 24.258 557 HG13 ILE 70 HG13 ILE 70 33.516 25.828 23.188 558 HG21 ILE 70 HG21 ILE 70 36.150 26.181 25.863 559 HG22 ILE 70 HG22 ILE 70 35.147 27.096 26.980 560 HG23 ILE 70 HG23 ILE 70 34.771 25.392 26.652 561 HD11 ILE 70 HD11 ILE 70 35.665 25.243 22.226 562 HD12 ILE 70 HD12 ILE 70 35.601 26.977 22.593 563 HD13 ILE 70 HD13 ILE 70 36.517 25.877 23.645 564 H PHE 71 H PHE 71 32.234 26.424 27.985 565 HA PHE 71 HA PHE 71 32.593 29.254 28.848 566 HB2 PHE 71 HB2 PHE 71 30.373 27.323 29.582 567 HB3 PHE 71 HB3 PHE 71 30.691 28.838 30.407 568 HD1 PHE 71 HD2 PHE 71 29.708 27.385 27.107 569 HD2 PHE 71 HD1 PHE 71 29.861 30.918 29.577 570 HE1 PHE 71 HE2 PHE 71 28.283 28.604 25.473 571 HE2 PHE 71 HE1 PHE 71 28.410 32.108 27.959 572 HZ PHE 71 HZ PHE 71 27.639 30.952 25.888 573 H ILE 72 H ILE 72 33.585 29.628 30.755 574 HA ILE 72 HA ILE 72 34.099 27.326 32.587 575 HB ILE 72 HB ILE 72 36.136 29.503 31.992 576 HG12 ILE 72 HG12 ILE 72 35.967 26.564 31.222 577 HG13 ILE 72 HG13 ILE 72 36.152 27.947 30.162 578 HG21 ILE 72 HG21 ILE 72 37.537 28.157 33.620 579 HG22 ILE 72 HG22 ILE 72 36.130 28.849 34.373 580 HG23 ILE 72 HG23 ILE 72 36.134 27.127 33.936 581 HD11 ILE 72 HD11 ILE 72 38.225 26.729 30.231 582 HD12 ILE 72 HD12 ILE 72 38.474 28.274 31.059 583 HD13 ILE 72 HD13 ILE 72 38.291 26.769 31.994 584 H ASN 73 H ASN 73 33.225 27.670 34.503 585 HA ASN 73 HA ASN 73 31.966 28.665 36.086 586 HB2 ASN 73 HB2 ASN 73 34.466 30.375 36.104 587 HB3 ASN 73 HB3 ASN 73 33.228 30.489 37.343 588 HD21 ASN 73 HD21 ASN 73 36.033 29.609 37.630 589 HD22 ASN 73 HD22 ASN 73 35.870 28.101 38.483 590 H GLY 74 H GLY 74 30.754 29.345 33.840 591 HA2 GLY 74 HA2 GLY 74 29.014 30.688 33.108 592 HA3 GLY 74 HA3 GLY 74 29.447 31.872 34.336 593 H ASN 75 H ASN 75 32.325 31.646 32.809 594 HA ASN 75 HA ASN 75 31.790 34.033 31.142 595 HB2 ASN 75 HB2 ASN 75 34.308 32.733 32.259 596 HB3 ASN 75 HB3 ASN 75 34.378 34.041 31.118 597 HD21 ASN 75 HD21 ASN 75 33.633 33.224 34.418 598 HD22 ASN 75 HD22 ASN 75 33.594 34.911 34.918 599 H PHE 76 H PHE 76 32.245 34.223 28.966 600 HA PHE 76 HA PHE 76 32.014 31.704 27.488 601 HB2 PHE 76 HB2 PHE 76 30.328 33.379 27.172 602 HB3 PHE 76 HB3 PHE 76 31.526 34.607 26.802 603 HD1 PHE 76 HD1 PHE 76 30.821 31.108 25.499 604 HD2 PHE 76 HD2 PHE 76 31.460 35.276 24.580 605 HE1 PHE 76 HE1 PHE 76 30.686 30.607 23.077 606 HE2 PHE 76 HE2 PHE 76 31.300 34.767 22.161 607 HZ PHE 76 HZ PHE 76 30.917 32.429 21.401 608 H ILE 77 H ILE 77 33.277 30.864 26.063 609 HA ILE 77 HA ILE 77 35.566 32.250 24.768 610 HB ILE 77 HB ILE 77 35.514 29.438 25.943 611 HG12 ILE 77 HG12 ILE 77 37.297 31.779 26.738 612 HG13 ILE 77 HG13 ILE 77 35.884 31.244 27.645 613 HG21 ILE 77 HG21 ILE 77 37.780 30.814 24.432 614 HG22 ILE 77 HG22 ILE 77 37.823 29.185 25.134 615 HG23 ILE 77 HG23 ILE 77 36.763 29.509 23.781 616 HD11 ILE 77 HD11 ILE 77 36.934 29.002 27.964 617 HD12 ILE 77 HD12 ILE 77 38.427 29.641 27.235 618 HD13 ILE 77 HD13 ILE 77 37.801 30.347 28.729 619 H GLY 78 H GLY 78 35.647 31.756 22.481 620 HA2 GLY 78 HA2 GLY 78 34.051 29.416 21.570 621 HA3 GLY 78 HA3 GLY 78 33.550 30.975 20.935 622 H GLY 79 H GLY 79 35.218 28.326 20.274 623 HA2 GLY 79 HA2 GLY 79 36.159 28.110 17.985 624 HA3 GLY 79 HA3 GLY 79 37.102 29.566 18.305 625 H CYS 80 H CYS 80 37.962 26.750 17.669 626 HA CYS 80 HA CYS 80 39.171 25.558 20.019 627 HB2 CYS 80 HB2 CYS 80 39.864 25.335 17.046 628 HB3 CYS 80 HB3 CYS 80 40.431 24.247 18.326 629 HG CYS 80 HG CYS 80 38.105 23.379 19.075 630 H SER 81 H SER 81 40.264 27.765 17.486 631 HA SER 81 HA SER 81 42.925 28.222 18.339 632 HB2 SER 81 HB2 SER 81 41.699 28.814 16.146 633 HB3 SER 81 HB3 SER 81 41.104 30.245 16.995 634 HG SER 81 HG SER 81 43.738 29.494 16.293 635 H ASP 82 H ASP 82 39.880 29.776 19.335 636 HA ASP 82 HA ASP 82 40.950 31.980 20.811 637 HB2 ASP 82 HB2 ASP 82 38.592 31.507 19.849 638 HB3 ASP 82 HB3 ASP 82 38.286 30.559 21.279 639 H LEU 83 H LEU 83 39.826 28.797 21.733 640 HA LEU 83 HA LEU 83 40.291 28.921 24.570 641 HB2 LEU 83 HB2 LEU 83 38.816 27.263 23.563 642 HB3 LEU 83 HB3 LEU 83 40.118 26.645 22.553 643 HG LEU 83 HG LEU 83 41.307 25.813 24.556 644 HD11 LEU 83 HD11 LEU 83 40.083 25.642 26.708 645 HD12 LEU 83 HD12 LEU 83 40.418 27.325 26.284 646 HD13 LEU 83 HD13 LEU 83 38.783 26.664 26.048 647 HD21 LEU 83 HD21 LEU 83 39.794 24.347 23.279 648 HD22 LEU 83 HD22 LEU 83 39.828 23.922 24.993 649 HD23 LEU 83 HD23 LEU 83 38.443 24.816 24.334 650 H GLU 84 H GLU 84 42.355 27.655 21.899 651 HA GLU 84 HA GLU 84 44.595 27.053 23.629 652 HB2 GLU 84 HB2 GLU 84 44.318 27.328 20.622 653 HB3 GLU 84 HB3 GLU 84 45.846 26.901 21.434 654 HG2 GLU 84 HG2 GLU 84 44.893 24.943 22.424 655 HG3 GLU 84 HG3 GLU 84 43.269 25.362 21.885 656 H ALA 85 H ALA 85 43.648 30.031 21.941 657 HA ALA 85 HA ALA 85 46.080 31.472 22.265 658 HB1 ALA 85 HB1 ALA 85 43.206 32.479 22.224 659 HB2 ALA 85 HB2 ALA 85 44.663 33.462 21.982 660 HB3 ALA 85 HB3 ALA 85 44.248 32.203 20.811 661 H LEU 86 H LEU 86 43.411 30.923 24.560 662 HA LEU 86 HA LEU 86 44.528 32.575 26.670 663 HB2 LEU 86 HB2 LEU 86 42.392 30.420 26.565 664 HB3 LEU 86 HB3 LEU 86 42.896 31.134 28.093 665 HG LEU 86 HG LEU 86 41.890 32.813 25.761 666 HD11 LEU 86 HD11 LEU 86 40.379 31.778 28.198 667 HD12 LEU 86 HD12 LEU 86 39.768 32.955 27.015 668 HD13 LEU 86 HD13 LEU 86 40.116 31.299 26.500 669 HD21 LEU 86 HD21 LEU 86 43.238 34.088 27.394 670 HD22 LEU 86 HD22 LEU 86 41.544 34.508 27.545 671 HD23 LEU 86 HD23 LEU 86 42.268 33.417 28.734 672 H ASP 87 H ASP 87 45.052 29.206 25.711 673 HA ASP 87 HA ASP 87 46.619 28.544 28.089 674 HB2 ASP 87 HB2 ASP 87 45.661 26.826 26.569 675 HB3 ASP 87 HB3 ASP 87 46.777 27.334 25.314 676 H LYS 88 H LYS 88 47.370 29.865 24.879 677 HA LYS 88 HA LYS 88 50.196 30.110 25.267 678 HB2 LYS 88 HB2 LYS 88 48.480 32.047 23.683 679 HB3 LYS 88 HB3 LYS 88 50.193 31.792 23.539 680 HG2 LYS 88 HG2 LYS 88 47.941 30.285 22.382 681 HG3 LYS 88 HG3 LYS 88 49.526 30.635 21.735 682 HD2 LYS 88 HD2 LYS 88 50.424 28.761 23.242 683 HD3 LYS 88 HD3 LYS 88 48.728 28.349 23.584 684 HE2 LYS 88 HE2 LYS 88 48.304 28.282 21.100 685 HE3 LYS 88 HE3 LYS 88 50.034 28.523 20.819 686 HZ1 LYS 88 HZ1 LYS 88 49.282 26.183 20.742 687 HZ2 LYS 88 HZ2 LYS 88 50.469 26.390 21.869 688 HZ3 LYS 88 HZ3 LYS 88 48.897 26.237 22.323 689 H GLU 89 H GLU 89 47.607 32.321 26.242 690 HA GLU 89 HA GLU 89 49.465 34.188 27.533 691 HB2 GLU 89 HB2 GLU 89 46.428 33.939 27.655 692 HB3 GLU 89 HB3 GLU 89 47.374 35.205 28.431 693 HG2 GLU 89 HG2 GLU 89 48.304 35.784 26.121 694 HG3 GLU 89 HG3 GLU 89 47.010 34.777 25.462 695 H GLY 90 H GLY 90 48.705 31.107 28.504 696 HA2 GLY 90 HA2 GLY 90 49.046 30.031 30.499 697 HA3 GLY 90 HA3 GLY 90 49.656 31.553 31.167 698 H LYS 91 H LYS 91 46.483 31.858 29.904 699 HA LYS 91 HA LYS 91 45.421 32.308 32.637 700 HB2 LYS 91 HB2 LYS 91 44.794 33.293 29.840 701 HB3 LYS 91 HB3 LYS 91 43.535 33.297 31.060 702 HG2 LYS 91 HG2 LYS 91 44.979 34.622 32.590 703 HG3 LYS 91 HG3 LYS 91 46.231 34.691 31.347 704 HD2 LYS 91 HD2 LYS 91 43.406 35.811 31.012 705 HD3 LYS 91 HD3 LYS 91 44.801 36.761 31.549 706 HE2 LYS 91 HE2 LYS 91 45.996 36.254 29.456 707 HE3 LYS 91 HE3 LYS 91 44.627 35.280 28.893 708 HZ1 LYS 91 HZ1 LYS 91 44.664 38.221 29.277 709 HZ2 LYS 91 HZ2 LYS 91 44.493 37.375 27.895 710 HZ3 LYS 91 HZ3 LYS 91 43.279 37.356 28.993 711 H LEU 92 H LEU 92 45.303 29.867 30.214 712 HA LEU 92 HA LEU 92 42.702 28.837 31.112 713 HB2 LEU 92 HB2 LEU 92 43.815 28.514 28.794 714 HB3 LEU 92 HB3 LEU 92 44.895 27.373 29.578 715 HG LEU 92 HG LEU 92 42.939 25.978 30.237 716 HD11 LEU 92 HD11 LEU 92 40.736 26.429 29.071 717 HD12 LEU 92 HD12 LEU 92 41.120 27.635 30.308 718 HD13 LEU 92 HD13 LEU 92 41.365 28.009 28.593 719 HD21 LEU 92 HD21 LEU 92 42.446 25.127 27.979 720 HD22 LEU 92 HD22 LEU 92 43.070 26.628 27.264 721 HD23 LEU 92 HD23 LEU 92 44.160 25.535 28.138 722 H ASP 93 H ASP 93 46.063 28.339 32.015 723 HA ASP 93 HA ASP 93 45.471 26.437 34.131 724 HB2 ASP 93 HB2 ASP 93 47.716 28.408 33.594 725 HB3 ASP 93 HB3 ASP 93 47.624 27.484 35.076 726 H GLY 94 H GLY 94 45.602 30.046 34.017 727 HA2 GLY 94 HA2 GLY 94 44.867 30.557 36.691 728 HA3 GLY 94 HA3 GLY 94 44.536 31.629 35.326 729 H LEU 95 H LEU 95 42.795 29.858 33.931 730 HA LEU 95 HA LEU 95 40.287 30.170 35.281 731 HB2 LEU 95 HB2 LEU 95 41.181 29.046 32.630 732 HB3 LEU 95 HB3 LEU 95 39.512 28.903 33.129 733 HG LEU 95 HG LEU 95 40.906 31.606 33.116 734 HD11 LEU 95 HD11 LEU 95 41.024 30.653 30.828 735 HD12 LEU 95 HD12 LEU 95 39.261 30.394 30.854 736 HD13 LEU 95 HD13 LEU 95 39.928 32.035 30.929 737 HD21 LEU 95 HD21 LEU 95 38.616 32.467 32.937 738 HD22 LEU 95 HD22 LEU 95 37.964 30.816 32.944 739 HD23 LEU 95 HD23 LEU 95 38.777 31.469 34.382 740 H LEU 96 H LEU 96 42.486 27.477 35.309 741 HA LEU 96 HA LEU 96 40.653 25.392 36.106 742 HB2 LEU 96 HB2 LEU 96 43.442 25.917 37.209 743 HB3 LEU 96 HB3 LEU 96 42.535 24.413 37.390 744 HG LEU 96 HG LEU 96 43.249 25.380 34.633 745 HD11 LEU 96 HD11 LEU 96 45.184 23.862 34.755 746 HD12 LEU 96 HD12 LEU 96 45.344 25.118 35.999 747 HD13 LEU 96 HD13 LEU 96 44.821 23.490 36.457 748 HD21 LEU 96 HD21 LEU 96 42.532 22.708 35.920 749 HD22 LEU 96 HD22 LEU 96 41.508 23.664 34.832 750 HD23 LEU 96 HD23 LEU 96 43.007 22.927 34.248 751 H SER 97 H SER 97 41.656 28.201 37.985 752 HA SER 97 HA SER 97 41.165 27.458 40.609 753 HB2 SER 97 HB2 SER 97 40.614 30.043 39.132 754 HB3 SER 97 HB3 SER 97 40.265 29.868 40.862 755 HG SER 97 HG SER 97 42.808 29.356 39.639 Start of MODEL 3 1 H1 GLY 1 H1 GLY 1 12.256 38.777 35.940 2 H2 GLY 1 H2 GLY 1 13.642 39.457 36.482 3 H3 GLY 1 H3 GLY 1 12.424 39.155 37.542 4 HA2 GLY 1 HA2 GLY 1 14.239 37.537 37.726 5 HA3 GLY 1 HA3 GLY 1 12.668 36.820 37.321 6 H ALA 2 H ALA 2 13.326 35.056 36.202 7 HA ALA 2 HA ALA 2 13.984 35.373 33.426 8 HB1 ALA 2 HB1 ALA 2 16.303 35.522 34.320 9 HB2 ALA 2 HB2 ALA 2 16.061 34.007 35.213 10 HB3 ALA 2 HB3 ALA 2 16.063 34.007 33.437 11 H MET 3 H MET 3 13.351 33.498 32.260 12 HA MET 3 HA MET 3 12.092 31.290 33.762 13 HB2 MET 3 HB2 MET 3 12.333 31.882 30.787 14 HB3 MET 3 HB3 MET 3 11.557 30.438 31.453 15 HG2 MET 3 HG2 MET 3 10.024 31.888 32.778 16 HG3 MET 3 HG3 MET 3 10.728 33.312 32.004 17 HE1 MET 3 HE1 MET 3 7.619 32.541 32.167 18 HE2 MET 3 HE2 MET 3 8.212 34.041 31.413 19 HE3 MET 3 HE3 MET 3 7.080 32.987 30.535 20 HA PRO 4 HA PRO 4 15.655 28.859 34.070 21 HB2 PRO 4 HB2 PRO 4 14.757 26.251 34.023 22 HB3 PRO 4 HB3 PRO 4 14.482 27.388 35.378 23 HG2 PRO 4 HG2 PRO 4 12.606 26.748 33.078 24 HG3 PRO 4 HG3 PRO 4 12.232 26.783 34.834 25 HD2 PRO 4 HD2 PRO 4 11.668 28.900 33.257 26 HD3 PRO 4 HD3 PRO 4 12.337 29.157 34.898 27 H SER 5 H SER 5 17.321 28.202 32.822 28 HA SER 5 HA SER 5 16.963 26.708 30.315 29 HB2 SER 5 HB2 SER 5 17.960 29.590 30.318 30 HB3 SER 5 HB3 SER 5 18.050 28.498 28.919 31 HG SER 5 HG SER 5 15.567 28.609 30.045 32 H ILE 6 H ILE 6 19.390 27.184 29.120 33 HA ILE 6 HA ILE 6 21.068 25.425 30.552 34 HB ILE 6 HB ILE 6 22.730 25.812 28.840 35 HG12 ILE 6 HG12 ILE 6 20.889 27.975 27.847 36 HG13 ILE 6 HG13 ILE 6 22.510 28.219 28.450 37 HG21 ILE 6 HG21 ILE 6 20.013 25.357 27.784 38 HG22 ILE 6 HG22 ILE 6 21.544 24.870 27.017 39 HG23 ILE 6 HG23 ILE 6 21.053 24.172 28.559 40 HD11 ILE 6 HD11 ILE 6 23.384 26.986 26.447 41 HD12 ILE 6 HD12 ILE 6 21.722 26.862 25.843 42 HD13 ILE 6 HD13 ILE 6 22.469 28.447 26.056 43 H ALA 7 H ALA 7 20.880 28.909 30.708 44 HA ALA 7 HA ALA 7 23.335 29.717 31.658 45 HB1 ALA 7 HB1 ALA 7 20.536 30.554 32.540 46 HB2 ALA 7 HB2 ALA 7 22.021 31.488 32.833 47 HB3 ALA 7 HB3 ALA 7 21.464 31.209 31.176 48 H SER 8 H SER 8 20.889 27.892 33.553 49 HA SER 8 HA SER 8 22.340 28.127 36.113 50 HB2 SER 8 HB2 SER 8 20.128 26.319 35.081 51 HB3 SER 8 HB3 SER 8 20.784 26.234 36.742 52 HG SER 8 HG SER 8 19.045 27.559 36.795 53 H MET 9 H MET 9 22.455 25.829 33.415 54 HA MET 9 HA MET 9 23.828 23.709 34.771 55 HB2 MET 9 HB2 MET 9 23.947 24.448 31.818 56 HB3 MET 9 HB3 MET 9 24.376 22.905 32.549 57 HG2 MET 9 HG2 MET 9 22.067 22.511 33.224 58 HG3 MET 9 HG3 MET 9 21.579 24.107 32.679 59 HE1 MET 9 HE1 MET 9 23.319 20.841 31.443 60 HE2 MET 9 HE2 MET 9 22.890 20.787 29.725 61 HE3 MET 9 HE3 MET 9 24.073 21.984 30.297 62 H ILE 10 H ILE 10 24.947 26.701 33.286 63 HA ILE 10 HA ILE 10 27.692 26.174 33.008 64 HB ILE 10 HB ILE 10 26.687 28.885 33.906 65 HG12 ILE 10 HG12 ILE 10 25.094 28.208 32.183 66 HG13 ILE 10 HG13 ILE 10 26.133 29.507 31.642 67 HG21 ILE 10 HG21 ILE 10 28.922 27.919 32.081 68 HG22 ILE 10 HG22 ILE 10 28.442 29.621 32.253 69 HG23 ILE 10 HG23 ILE 10 29.078 28.723 33.642 70 HD11 ILE 10 HD11 ILE 10 27.464 27.880 30.295 71 HD12 ILE 10 HD12 ILE 10 26.381 26.575 30.840 72 HD13 ILE 10 HD13 ILE 10 25.749 27.910 29.855 73 H LYS 11 H LYS 11 25.876 26.800 35.984 74 HA LYS 11 HA LYS 11 28.193 27.644 37.534 75 HB2 LYS 11 HB2 LYS 11 25.294 27.050 38.219 76 HB3 LYS 11 HB3 LYS 11 26.511 27.730 39.328 77 HG2 LYS 11 HG2 LYS 11 26.852 29.623 37.674 78 HG3 LYS 11 HG3 LYS 11 25.491 28.975 36.727 79 HD2 LYS 11 HD2 LYS 11 24.054 29.132 38.730 80 HD3 LYS 11 HD3 LYS 11 25.427 29.853 39.621 81 HE2 LYS 11 HE2 LYS 11 25.474 31.591 37.677 82 HE3 LYS 11 HE3 LYS 11 23.858 31.004 37.273 83 HZ1 LYS 11 HZ1 LYS 11 23.812 32.957 38.705 84 HZ2 LYS 11 HZ2 LYS 11 23.140 31.704 39.533 85 HZ3 LYS 11 HZ3 LYS 11 24.651 32.226 39.881 86 H GLY 12 H GLY 12 27.152 24.549 36.601 87 HA2 GLY 12 HA2 GLY 12 27.598 23.182 39.111 88 HA3 GLY 12 HA3 GLY 12 27.259 22.452 37.548 89 H ASN 13 H ASN 13 29.705 23.919 36.406 90 HA ASN 13 HA ASN 13 31.919 22.195 37.454 91 HB2 ASN 13 HB2 ASN 13 30.842 22.468 34.607 92 HB3 ASN 13 HB3 ASN 13 32.473 21.933 34.916 93 HD21 ASN 13 HD21 ASN 13 32.823 19.977 36.155 94 HD22 ASN 13 HD22 ASN 13 31.627 18.692 35.973 95 H LYS 14 H LYS 14 34.051 22.911 36.718 96 HA LYS 14 HA LYS 14 34.411 25.793 36.885 97 HB2 LYS 14 HB2 LYS 14 36.045 23.866 37.517 98 HB3 LYS 14 HB3 LYS 14 36.420 23.815 35.793 99 HG2 LYS 14 HG2 LYS 14 38.111 25.166 36.554 100 HG3 LYS 14 HG3 LYS 14 36.936 26.336 35.982 101 HD2 LYS 14 HD2 LYS 14 37.536 27.266 37.989 102 HD3 LYS 14 HD3 LYS 14 36.127 26.328 38.511 103 HE2 LYS 14 HE2 LYS 14 37.615 24.552 39.375 104 HE3 LYS 14 HE3 LYS 14 39.018 25.360 38.671 105 HZ1 LYS 14 HZ1 LYS 14 38.457 27.312 40.146 106 HZ2 LYS 14 HZ2 LYS 14 37.384 26.349 40.938 107 HZ3 LYS 14 HZ3 LYS 14 38.984 25.984 40.951 108 H VAL 15 H VAL 15 34.310 23.504 34.174 109 HA VAL 15 HA VAL 15 33.850 25.770 32.307 110 HB VAL 15 HB VAL 15 35.395 23.239 31.660 111 HG11 VAL 15 HG11 VAL 15 35.884 24.386 29.509 112 HG12 VAL 15 HG12 VAL 15 34.170 24.033 29.689 113 HG13 VAL 15 HG13 VAL 15 34.764 25.684 29.951 114 HG21 VAL 15 HG21 VAL 15 36.245 26.100 32.220 115 HG22 VAL 15 HG22 VAL 15 36.855 24.603 32.945 116 HG23 VAL 15 HG23 VAL 15 37.245 25.002 31.260 117 H VAL 16 H VAL 16 32.175 25.612 30.916 118 HA VAL 16 HA VAL 16 30.765 23.008 30.603 119 HB VAL 16 HB VAL 16 29.392 25.631 31.252 120 HG11 VAL 16 HG11 VAL 16 28.056 24.474 29.544 121 HG12 VAL 16 HG12 VAL 16 28.207 22.937 30.426 122 HG13 VAL 16 HG13 VAL 16 27.284 24.287 31.119 123 HG21 VAL 16 HG21 VAL 16 28.459 24.170 33.129 124 HG22 VAL 16 HG22 VAL 16 29.598 22.915 32.638 125 HG23 VAL 16 HG23 VAL 16 30.189 24.479 33.250 126 H VAL 17 H VAL 17 30.151 22.535 28.537 127 HA VAL 17 HA VAL 17 30.528 24.633 26.426 128 HB VAL 17 HB VAL 17 31.634 21.803 26.573 129 HG11 VAL 17 HG11 VAL 17 30.781 22.054 24.267 130 HG12 VAL 17 HG12 VAL 17 31.568 23.649 24.142 131 HG13 VAL 17 HG13 VAL 17 32.534 22.162 24.277 132 HG21 VAL 17 HG21 VAL 17 32.900 24.533 26.159 133 HG22 VAL 17 HG22 VAL 17 33.041 23.500 27.598 134 HG23 VAL 17 HG23 VAL 17 33.753 22.984 26.066 135 H PHE 18 H PHE 18 29.246 24.494 24.584 136 HA PHE 18 HA PHE 18 27.120 22.369 24.591 137 HB2 PHE 18 HB2 PHE 18 26.820 25.162 23.448 138 HB3 PHE 18 HB3 PHE 18 25.612 23.894 23.503 139 HD1 PHE 18 HD2 PHE 18 24.664 23.152 25.710 140 HD2 PHE 18 HD1 PHE 18 27.244 26.582 25.363 141 HE1 PHE 18 HE2 PHE 18 23.932 23.929 27.957 142 HE2 PHE 18 HE1 PHE 18 26.466 27.387 27.583 143 HZ PHE 18 HZ PHE 18 24.779 26.099 28.847 144 H SER 19 H SER 19 27.299 20.994 22.960 145 HA SER 19 HA SER 19 28.750 21.782 20.460 146 HB2 SER 19 HB2 SER 19 28.935 19.196 22.039 147 HB3 SER 19 HB3 SER 19 29.534 19.378 20.375 148 HG SER 19 HG SER 19 31.164 19.678 21.853 149 H TRP 20 H TRP 20 28.321 20.438 18.598 150 HA TRP 20 HA TRP 20 25.618 19.191 18.495 151 HB2 TRP 20 HB2 TRP 20 26.608 21.534 16.953 152 HB3 TRP 20 HB3 TRP 20 26.030 20.229 15.949 153 HD1 TRP 20 HD1 TRP 20 24.283 21.009 19.255 154 HE1 TRP 20 HE1 TRP 20 21.826 21.576 18.742 155 HE3 TRP 20 HE3 TRP 20 24.554 21.332 14.154 156 HZ2 TRP 20 HZ2 TRP 20 20.252 22.309 16.458 157 HZ3 TRP 20 HZ3 TRP 20 22.540 21.930 12.828 158 HH2 TRP 20 HH2 TRP 20 20.388 22.416 13.966 159 H VAL 21 H VAL 21 25.699 17.191 17.757 160 HA VAL 21 HA VAL 21 28.199 16.180 16.637 161 HB VAL 21 HB VAL 21 27.042 13.936 16.710 162 HG11 VAL 21 HG11 VAL 21 28.773 14.695 18.303 163 HG12 VAL 21 HG12 VAL 21 27.530 15.463 19.309 164 HG13 VAL 21 HG13 VAL 21 27.552 13.698 19.103 165 HG21 VAL 21 HG21 VAL 21 25.166 15.345 18.642 166 HG22 VAL 21 HG22 VAL 21 24.693 14.821 17.010 167 HG23 VAL 21 HG23 VAL 21 25.206 13.626 18.200 168 H THR 22 H THR 22 27.138 15.684 13.226 169 HA THR 22 HA THR 22 29.408 15.876 15.183 170 HB THR 22 HB THR 22 29.454 15.067 12.289 171 HG1 THR 22 HG1 THR 22 28.663 13.356 13.274 172 HG21 THR 22 HG21 THR 22 31.603 15.040 14.458 173 HG22 THR 22 HG22 THR 22 31.597 16.057 12.995 174 HG23 THR 22 HG23 THR 22 31.754 14.322 12.843 175 H CYS 23 H CYS 23 30.679 17.590 15.224 176 HA CYS 23 HA CYS 23 30.676 19.552 12.974 177 HB2 CYS 23 HB2 CYS 23 29.162 20.418 14.672 178 HB3 CYS 23 HB3 CYS 23 30.413 20.248 15.915 179 HG CYS 23 HG CYS 23 29.989 22.819 14.987 180 HA PRO 24 HA PRO 24 34.952 18.300 13.690 181 HB2 PRO 24 HB2 PRO 24 35.410 20.243 11.429 182 HB3 PRO 24 HB3 PRO 24 36.132 18.624 11.688 183 HG2 PRO 24 HG2 PRO 24 34.086 18.901 9.969 184 HG3 PRO 24 HG3 PRO 24 34.069 17.538 11.138 185 HD2 PRO 24 HD2 PRO 24 32.611 20.192 11.332 186 HD3 PRO 24 HD3 PRO 24 32.001 18.536 11.628 187 H TYR 25 H TYR 25 33.743 21.370 14.363 188 HA TYR 25 HA TYR 25 36.245 22.437 15.538 189 HB2 TYR 25 HB2 TYR 25 33.329 23.243 15.842 190 HB3 TYR 25 HB3 TYR 25 34.714 24.177 16.408 191 HD1 TYR 25 HD1 TYR 25 36.555 23.910 13.990 192 HD2 TYR 25 HD2 TYR 25 32.343 24.812 14.352 193 HE1 TYR 25 HE1 TYR 25 36.638 25.199 11.870 194 HE2 TYR 25 HE2 TYR 25 32.438 26.080 12.221 195 HH TYR 25 HH TYR 25 35.449 26.633 10.426 196 H CYS 26 H CYS 26 33.242 20.913 16.659 197 HA CYS 26 HA CYS 26 33.472 21.550 19.409 198 HB2 CYS 26 HB2 CYS 26 32.107 19.482 17.707 199 HB3 CYS 26 HB3 CYS 26 32.073 19.306 19.432 200 HG CYS 26 HG CYS 26 30.865 21.454 19.987 201 H VAL 27 H VAL 27 34.437 18.653 17.684 202 HA VAL 27 HA VAL 27 35.726 17.031 19.493 203 HB VAL 27 HB VAL 27 35.356 16.787 17.216 204 HG11 VAL 27 HG11 VAL 27 35.862 18.790 16.299 205 HG12 VAL 27 HG12 VAL 27 37.599 18.288 16.220 206 HG13 VAL 27 HG13 VAL 27 36.354 17.372 15.362 207 HG21 VAL 27 HG21 VAL 27 37.304 15.372 16.614 208 HG22 VAL 27 HG22 VAL 27 38.312 16.286 17.757 209 HG23 VAL 27 HG23 VAL 27 36.998 15.246 18.357 210 H ARG 28 H ARG 28 37.078 19.418 17.613 211 HA ARG 28 HA ARG 28 39.743 19.490 18.607 212 HB2 ARG 28 HB2 ARG 28 38.616 22.215 17.901 213 HB3 ARG 28 HB3 ARG 28 40.240 21.588 17.674 214 HG2 ARG 28 HG2 ARG 28 39.150 19.952 15.963 215 HG3 ARG 28 HG3 ARG 28 37.753 21.042 16.105 216 HD2 ARG 28 HD2 ARG 28 38.617 22.253 14.465 217 HD3 ARG 28 HD3 ARG 28 39.795 22.834 15.636 218 HE ARG 28 HE ARG 28 41.447 21.597 14.532 219 HH11 ARG 28 HH12 ARG 28 38.356 20.259 13.371 220 HH12 ARG 28 HH11 ARG 28 39.246 19.408 12.097 221 HH21 ARG 28 HH22 ARG 28 42.318 20.400 13.001 222 HH22 ARG 28 HH21 ARG 28 41.288 19.447 11.912 223 H ALA 29 H ALA 29 37.123 21.568 19.888 224 HA ALA 29 HA ALA 29 38.723 22.513 22.120 225 HB1 ALA 29 HB1 ALA 29 36.592 23.346 23.011 226 HB2 ALA 29 HB2 ALA 29 36.810 23.806 21.302 227 HB3 ALA 29 HB3 ALA 29 35.705 22.477 21.737 228 H GLU 30 H GLU 30 36.155 19.955 21.927 229 HA GLU 30 HA GLU 30 36.182 19.250 24.691 230 HB2 GLU 30 HB2 GLU 30 35.589 17.593 22.199 231 HB3 GLU 30 HB3 GLU 30 35.268 17.064 23.853 232 HG2 GLU 30 HG2 GLU 30 33.674 18.902 24.190 233 HG3 GLU 30 HG3 GLU 30 33.999 19.542 22.579 234 H LYS 31 H LYS 31 38.243 18.055 22.098 235 HA LYS 31 HA LYS 31 39.518 16.054 23.653 236 HB2 LYS 31 HB2 LYS 31 39.488 16.179 21.169 237 HB3 LYS 31 HB3 LYS 31 40.406 17.688 21.216 238 HG2 LYS 31 HG2 LYS 31 42.355 16.390 22.192 239 HG3 LYS 31 HG3 LYS 31 41.385 14.923 21.994 240 HD2 LYS 31 HD2 LYS 31 42.760 15.039 20.065 241 HD3 LYS 31 HD3 LYS 31 41.174 15.535 19.508 242 HE2 LYS 31 HE2 LYS 31 41.872 17.617 18.949 243 HE3 LYS 31 HE3 LYS 31 42.766 17.842 20.470 244 HZ1 LYS 31 HZ1 LYS 31 44.561 16.508 19.558 245 HZ2 LYS 31 HZ2 LYS 31 43.778 16.283 18.144 246 HZ3 LYS 31 HZ3 LYS 31 44.286 17.785 18.560 247 H LEU 32 H LEU 32 40.349 19.414 23.035 248 HA LEU 32 HA LEU 32 42.873 19.541 24.397 249 HB2 LEU 32 HB2 LEU 32 41.870 21.028 22.623 250 HB3 LEU 32 HB3 LEU 32 40.773 21.625 23.874 251 HG LEU 32 HG LEU 32 42.615 23.131 23.255 252 HD11 LEU 32 HD11 LEU 32 41.528 23.299 25.513 253 HD12 LEU 32 HD12 LEU 32 42.912 22.391 26.175 254 HD13 LEU 32 HD13 LEU 32 43.169 23.957 25.400 255 HD21 LEU 32 HD21 LEU 32 44.337 21.406 22.907 256 HD22 LEU 32 HD22 LEU 32 44.870 22.722 23.979 257 HD23 LEU 32 HD23 LEU 32 44.429 21.140 24.658 258 H LEU 33 H LEU 33 39.523 20.262 25.429 259 HA LEU 33 HA LEU 33 40.160 21.328 27.962 260 HB2 LEU 33 HB2 LEU 33 37.689 19.847 26.938 261 HB3 LEU 33 HB3 LEU 33 37.721 20.659 28.498 262 HG LEU 33 HG LEU 33 38.258 22.093 25.871 263 HD11 LEU 33 HD11 LEU 33 36.119 22.987 25.836 264 HD12 LEU 33 HD12 LEU 33 35.933 21.236 25.968 265 HD13 LEU 33 HD13 LEU 33 35.693 22.278 27.398 266 HD21 LEU 33 HD21 LEU 33 39.207 23.293 27.769 267 HD22 LEU 33 HD22 LEU 33 37.765 24.135 27.194 268 HD23 LEU 33 HD23 LEU 33 37.663 23.129 28.652 269 H HIS 34 H HIS 34 39.454 17.967 27.090 270 HA HIS 34 HA HIS 34 39.927 16.855 29.717 271 HB2 HIS 34 HB2 HIS 34 39.637 15.720 26.913 272 HB3 HIS 34 HB3 HIS 34 40.103 14.708 28.274 273 HD1 HIS 34 HD1 HIS 34 38.295 14.512 30.327 274 HD2 HIS 34 HD2 HIS 34 36.998 16.109 26.660 275 HE1 HIS 34 HE1 HIS 34 35.744 14.442 30.374 276 H ALA 35 H ALA 35 42.091 17.511 26.862 277 HA ALA 35 HA ALA 35 44.226 15.854 27.964 278 HB1 ALA 35 HB1 ALA 35 44.276 18.095 25.894 279 HB2 ALA 35 HB2 ALA 35 45.592 16.950 26.225 280 HB3 ALA 35 HB3 ALA 35 44.056 16.362 25.569 281 H ARG 36 H ARG 36 43.280 19.186 28.328 282 HA ARG 36 HA ARG 36 45.716 19.876 29.890 283 HB2 ARG 36 HB2 ARG 36 43.789 21.607 28.359 284 HB3 ARG 36 HB3 ARG 36 45.238 22.098 29.234 285 HG2 ARG 36 HG2 ARG 36 45.242 20.205 26.840 286 HG3 ARG 36 HG3 ARG 36 45.457 21.939 26.720 287 HD2 ARG 36 HD2 ARG 36 47.566 21.851 27.936 288 HD3 ARG 36 HD3 ARG 36 47.304 20.158 28.356 289 HE ARG 36 HE ARG 36 48.404 19.620 26.429 290 HH11 ARG 36 HH22 ARG 36 47.132 22.827 25.722 291 HH12 ARG 36 HH21 ARG 36 47.243 22.513 23.977 292 HH21 ARG 36 HH12 ARG 36 48.753 19.481 24.244 293 HH22 ARG 36 HH11 ARG 36 48.464 20.892 23.263 294 H THR 37 H THR 37 43.174 18.771 30.878 295 HA THR 37 HA THR 37 42.617 18.371 33.020 296 HB THR 37 HB THR 37 43.636 20.793 34.264 297 HG1 THR 37 HG1 THR 37 45.462 20.716 33.274 298 HG21 THR 37 HG21 THR 37 42.901 18.818 35.605 299 HG22 THR 37 HG22 THR 37 44.604 19.192 35.900 300 HG23 THR 37 HG23 THR 37 44.163 17.834 34.840 301 H LYS 38 H LYS 38 40.903 20.182 31.313 302 HA LYS 38 HA LYS 38 39.740 22.034 33.300 303 HB2 LYS 38 HB2 LYS 38 39.132 21.375 30.433 304 HB3 LYS 38 HB3 LYS 38 37.903 22.124 31.423 305 HG2 LYS 38 HG2 LYS 38 39.196 23.842 30.187 306 HG3 LYS 38 HG3 LYS 38 39.175 24.020 31.924 307 HD2 LYS 38 HD2 LYS 38 41.264 24.658 31.362 308 HD3 LYS 38 HD3 LYS 38 41.507 23.049 31.991 309 HE2 LYS 38 HE2 LYS 38 41.897 22.130 29.810 310 HE3 LYS 38 HE3 LYS 38 41.361 23.642 29.019 311 HZ1 LYS 38 HZ1 LYS 38 43.273 24.730 30.288 312 HZ2 LYS 38 HZ2 LYS 38 43.784 23.289 30.712 313 HZ3 LYS 38 HZ3 LYS 38 43.808 23.727 29.133 314 H ASP 39 H ASP 39 38.711 21.287 34.925 315 HA ASP 39 HA ASP 39 36.892 19.108 34.956 316 HB2 ASP 39 HB2 ASP 39 37.524 20.372 37.041 317 HB3 ASP 39 HB3 ASP 39 36.613 21.747 36.473 318 H ILE 40 H ILE 40 35.608 18.835 33.335 319 HA ILE 40 HA ILE 40 34.078 21.108 32.194 320 HB ILE 40 HB ILE 40 36.155 20.444 31.025 321 HG12 ILE 40 HG12 ILE 40 33.616 21.148 29.922 322 HG13 ILE 40 HG13 ILE 40 35.231 21.603 29.449 323 HG21 ILE 40 HG21 ILE 40 36.291 18.446 29.667 324 HG22 ILE 40 HG22 ILE 40 36.052 18.012 31.350 325 HG23 ILE 40 HG23 ILE 40 34.695 17.902 30.224 326 HD11 ILE 40 HD11 ILE 40 33.792 19.112 28.461 327 HD12 ILE 40 HD12 ILE 40 33.902 20.651 27.595 328 HD13 ILE 40 HD13 ILE 40 35.374 19.719 27.897 329 H THR 41 H THR 41 32.091 20.869 31.404 330 HA THR 41 HA THR 41 30.925 18.157 30.998 331 HB THR 41 HB THR 41 29.841 20.368 32.691 332 HG1 THR 41 HG1 THR 41 29.897 18.816 33.979 333 HG21 THR 41 HG21 THR 41 27.538 19.482 32.505 334 HG22 THR 41 HG22 THR 41 28.023 18.599 31.033 335 HG23 THR 41 HG23 THR 41 28.082 20.386 31.094 336 H VAL 42 H VAL 42 30.625 18.040 28.820 337 HA VAL 42 HA VAL 42 29.531 20.406 27.415 338 HB VAL 42 HB VAL 42 31.206 19.869 26.073 339 HG11 VAL 42 HG11 VAL 42 32.201 18.164 27.191 340 HG12 VAL 42 HG12 VAL 42 30.956 16.967 26.678 341 HG13 VAL 42 HG13 VAL 42 32.077 17.692 25.498 342 HG21 VAL 42 HG21 VAL 42 29.190 19.769 24.691 343 HG22 VAL 42 HG22 VAL 42 30.502 18.768 24.060 344 HG23 VAL 42 HG23 VAL 42 29.150 17.998 24.901 345 H HIS 43 H HIS 43 27.592 20.523 26.687 346 HA HIS 43 HA HIS 43 25.728 18.209 26.943 347 HB2 HIS 43 HB2 HIS 43 25.248 20.368 28.165 348 HB3 HIS 43 HB3 HIS 43 25.153 21.172 26.620 349 HD1 HIS 43 HD1 HIS 43 23.449 17.715 26.871 350 HD2 HIS 43 HD2 HIS 43 22.571 21.829 27.182 351 HE1 HIS 43 HE1 HIS 43 20.924 17.916 26.911 352 H TYR 44 H TYR 44 24.982 17.262 25.135 353 HA TYR 44 HA TYR 44 25.640 18.443 22.504 354 HB2 TYR 44 HB2 TYR 44 24.621 15.700 23.257 355 HB3 TYR 44 HB3 TYR 44 25.053 16.233 21.626 356 HD1 TYR 44 HD2 TYR 44 27.472 17.309 21.380 357 HD2 TYR 44 HD1 TYR 44 26.281 14.661 24.575 358 HE1 TYR 44 HE2 TYR 44 29.860 16.904 21.937 359 HE2 TYR 44 HE1 TYR 44 28.675 14.223 25.094 360 HH TYR 44 HH TYR 44 31.354 15.854 23.378 361 H VAL 45 H VAL 45 24.211 20.165 22.579 362 HA VAL 45 HA VAL 45 21.354 19.827 22.695 363 HB VAL 45 HB VAL 45 21.198 22.160 21.893 364 HG11 VAL 45 HG11 VAL 45 22.009 23.172 23.926 365 HG12 VAL 45 HG12 VAL 45 21.331 21.589 24.300 366 HG13 VAL 45 HG13 VAL 45 23.101 21.799 24.221 367 HG21 VAL 45 HG21 VAL 45 23.174 22.466 20.545 368 HG22 VAL 45 HG22 VAL 45 23.246 23.565 21.908 369 HG23 VAL 45 HG23 VAL 45 24.245 22.101 21.919 370 H ASP 46 H ASP 46 23.088 18.426 20.503 371 HA ASP 46 HA ASP 46 21.034 18.617 18.331 372 HB2 ASP 46 HB2 ASP 46 23.465 18.714 17.683 373 HB3 ASP 46 HB3 ASP 46 23.680 17.110 18.359 374 H LYS 47 H LYS 47 22.535 16.405 20.708 375 HA LYS 47 HA LYS 47 21.010 14.021 19.988 376 HB2 LYS 47 HB2 LYS 47 22.551 14.770 22.514 377 HB3 LYS 47 HB3 LYS 47 21.855 13.192 22.220 378 HG2 LYS 47 HG2 LYS 47 23.836 14.306 20.237 379 HG3 LYS 47 HG3 LYS 47 24.421 13.700 21.774 380 HD2 LYS 47 HD2 LYS 47 22.750 12.004 19.877 381 HD3 LYS 47 HD3 LYS 47 24.519 12.082 19.874 382 HE2 LYS 47 HE2 LYS 47 24.469 11.449 22.344 383 HE3 LYS 47 HE3 LYS 47 22.750 11.085 22.140 384 HZ1 LYS 47 HZ1 LYS 47 24.989 9.775 20.663 385 HZ2 LYS 47 HZ2 LYS 47 24.081 9.094 21.843 386 HZ3 LYS 47 HZ3 LYS 47 23.419 9.478 20.382 387 H MET 48 H MET 48 20.683 16.642 22.367 388 HA MET 48 HA MET 48 18.127 15.519 23.362 389 HB2 MET 48 HB2 MET 48 19.896 16.340 24.887 390 HB3 MET 48 HB3 MET 48 19.694 17.972 24.250 391 HG2 MET 48 HG2 MET 48 17.432 16.349 25.489 392 HG3 MET 48 HG3 MET 48 18.507 17.355 26.450 393 HE1 MET 48 HE1 MET 48 17.571 20.956 25.647 394 HE2 MET 48 HE2 MET 48 18.408 19.831 26.730 395 HE3 MET 48 HE3 MET 48 18.982 20.045 25.063 396 H SER 49 H SER 49 16.297 15.980 22.311 397 HA SER 49 HA SER 49 16.242 17.532 19.998 398 HB2 SER 49 HB2 SER 49 14.786 15.570 20.611 399 HB3 SER 49 HB3 SER 49 13.786 16.688 21.556 400 HG SER 49 HG SER 49 12.937 16.504 19.534 401 H GLU 50 H GLU 50 15.274 18.678 23.230 402 HA GLU 50 HA GLU 50 14.026 21.124 22.232 403 HB2 GLU 50 HB2 GLU 50 13.618 19.989 24.510 404 HB3 GLU 50 HB3 GLU 50 15.160 20.689 25.021 405 HG2 GLU 50 HG2 GLU 50 14.316 22.947 24.664 406 HG3 GLU 50 HG3 GLU 50 12.826 22.313 23.967 407 H GLY 51 H GLY 51 17.257 20.079 22.503 408 HA2 GLY 51 HA2 GLY 51 18.780 22.226 23.231 409 HA3 GLY 51 HA3 GLY 51 19.222 21.029 22.019 410 H GLU 52 H GLU 52 17.018 22.034 20.111 411 HA GLU 52 HA GLU 52 18.545 24.128 18.767 412 HB2 GLU 52 HB2 GLU 52 15.847 22.852 18.412 413 HB3 GLU 52 HB3 GLU 52 16.095 24.421 17.663 414 HG2 GLU 52 HG2 GLU 52 18.129 22.231 17.203 415 HG3 GLU 52 HG3 GLU 52 16.606 22.233 16.323 416 H GLN 53 H GLN 53 15.853 24.221 21.127 417 HA GLN 53 HA GLN 53 15.479 27.102 20.871 418 HB2 GLN 53 HB2 GLN 53 13.707 25.413 21.468 419 HB3 GLN 53 HB3 GLN 53 14.469 25.242 23.058 420 HG2 GLN 53 HG2 GLN 53 14.037 27.593 23.561 421 HG3 GLN 53 HG3 GLN 53 13.520 27.902 21.902 422 HE21 GLN 53 HE21 GLN 53 11.677 28.825 23.330 423 HE22 GLN 53 HE22 GLN 53 10.315 27.734 23.487 424 H LEU 54 H LEU 54 17.356 24.960 23.004 425 HA LEU 54 HA LEU 54 18.322 27.109 24.721 426 HB2 LEU 54 HB2 LEU 54 19.375 24.285 24.257 427 HB3 LEU 54 HB3 LEU 54 20.016 25.416 25.442 428 HG LEU 54 HG LEU 54 18.664 23.924 26.620 429 HD11 LEU 54 HD11 LEU 54 18.395 26.478 27.050 430 HD12 LEU 54 HD12 LEU 54 16.783 26.282 26.353 431 HD13 LEU 54 HD13 LEU 54 17.246 25.355 27.802 432 HD21 LEU 54 HD21 LEU 54 17.266 23.063 24.770 433 HD22 LEU 54 HD22 LEU 54 16.396 23.365 26.276 434 HD23 LEU 54 HD23 LEU 54 16.219 24.493 24.931 435 H ARG 55 H ARG 55 19.559 25.590 21.735 436 HA ARG 55 HA ARG 55 21.909 27.217 21.417 437 HB2 ARG 55 HB2 ARG 55 21.664 25.153 20.309 438 HB3 ARG 55 HB3 ARG 55 20.049 25.541 19.726 439 HG2 ARG 55 HG2 ARG 55 20.799 26.976 18.086 440 HG3 ARG 55 HG3 ARG 55 22.492 26.940 18.654 441 HD2 ARG 55 HD2 ARG 55 22.714 24.586 18.113 442 HD3 ARG 55 HD3 ARG 55 20.977 24.406 17.895 443 HE ARG 55 HE ARG 55 21.051 25.627 15.842 444 HH11 ARG 55 HH12 ARG 55 24.307 24.587 16.823 445 HH12 ARG 55 HH11 ARG 55 24.811 24.583 15.152 446 HH21 ARG 55 HH22 ARG 55 21.822 25.732 13.923 447 HH22 ARG 55 HH21 ARG 55 23.511 25.386 13.569 448 H GLY 56 H GLY 56 18.461 27.766 20.704 449 HA2 GLY 56 HA2 GLY 56 18.661 30.413 19.661 450 HA3 GLY 56 HA3 GLY 56 17.310 29.751 20.582 451 H GLU 57 H GLU 57 18.772 29.314 23.164 452 HA GLU 57 HA GLU 57 18.771 32.004 24.207 453 HB2 GLU 57 HB2 GLU 57 19.947 29.484 25.428 454 HB3 GLU 57 HB3 GLU 57 19.924 31.036 26.207 455 HG2 GLU 57 HG2 GLU 57 17.543 29.305 25.508 456 HG3 GLU 57 HG3 GLU 57 18.151 29.824 27.076 457 H ILE 58 H ILE 58 21.359 29.926 22.938 458 HA ILE 58 HA ILE 58 23.515 31.756 23.568 459 HB ILE 58 HB ILE 58 23.434 29.634 21.388 460 HG12 ILE 58 HG12 ILE 58 24.424 29.369 24.266 461 HG13 ILE 58 HG13 ILE 58 22.924 28.681 23.648 462 HG21 ILE 58 HG21 ILE 58 25.294 31.338 21.216 463 HG22 ILE 58 HG22 ILE 58 25.851 30.816 22.820 464 HG23 ILE 58 HG23 ILE 58 25.844 29.692 21.443 465 HD11 ILE 58 HD11 ILE 58 24.236 27.315 22.009 466 HD12 ILE 58 HD12 ILE 58 25.720 27.865 22.823 467 HD13 ILE 58 HD13 ILE 58 24.519 26.925 23.717 468 H TYR 59 H TYR 59 21.583 31.208 20.539 469 HA TYR 59 HA TYR 59 22.992 33.152 19.062 470 HB2 TYR 59 HB2 TYR 59 21.344 31.322 18.264 471 HB3 TYR 59 HB3 TYR 59 20.108 32.564 18.454 472 HD1 TYR 59 HD2 TYR 59 20.537 34.855 17.207 473 HD2 TYR 59 HD1 TYR 59 22.796 31.303 16.459 474 HE1 TYR 59 HE2 TYR 59 21.357 35.836 15.076 475 HE2 TYR 59 HE1 TYR 59 23.640 32.234 14.329 476 HH TYR 59 HH TYR 59 22.747 35.599 13.305 477 H GLN 60 H GLN 60 19.899 33.641 20.891 478 HA GLN 60 HA GLN 60 19.590 36.334 19.990 479 HB2 GLN 60 HB2 GLN 60 18.584 35.003 22.523 480 HB3 GLN 60 HB3 GLN 60 18.064 36.586 21.937 481 HG2 GLN 60 HG2 GLN 60 17.696 33.969 20.400 482 HG3 GLN 60 HG3 GLN 60 16.478 34.752 21.392 483 HE21 GLN 60 HE21 GLN 60 15.736 36.996 20.686 484 HE22 GLN 60 HE22 GLN 60 15.819 37.343 18.961 485 H ALA 61 H ALA 61 21.608 35.081 22.644 486 HA ALA 61 HA ALA 61 22.280 37.788 23.594 487 HB1 ALA 61 HB1 ALA 61 23.723 36.540 25.168 488 HB2 ALA 61 HB2 ALA 61 22.044 35.967 25.187 489 HB3 ALA 61 HB3 ALA 61 23.294 35.022 24.349 490 H TYR 62 H TYR 62 24.000 35.193 21.760 491 HA TYR 62 HA TYR 62 26.352 37.010 21.493 492 HB2 TYR 62 HB2 TYR 62 26.280 33.996 21.345 493 HB3 TYR 62 HB3 TYR 62 27.697 35.029 21.454 494 HD1 TYR 62 HD2 TYR 62 27.883 36.566 23.609 495 HD2 TYR 62 HD1 TYR 62 25.380 33.077 23.314 496 HE1 TYR 62 HE2 TYR 62 27.762 36.431 26.098 497 HE2 TYR 62 HE1 TYR 62 25.233 32.959 25.796 498 HH TYR 62 HH TYR 62 25.810 33.936 27.780 499 H LYS 63 H LYS 63 23.870 36.022 19.531 500 HA LYS 63 HA LYS 63 23.531 35.453 17.426 501 HB2 LYS 63 HB2 LYS 63 25.109 38.015 17.212 502 HB3 LYS 63 HB3 LYS 63 24.300 37.249 15.840 503 HG2 LYS 63 HG2 LYS 63 22.679 38.657 16.482 504 HG3 LYS 63 HG3 LYS 63 22.162 37.195 17.279 505 HD2 LYS 63 HD2 LYS 63 23.075 38.144 19.447 506 HD3 LYS 63 HD3 LYS 63 23.517 39.617 18.554 507 HE2 LYS 63 HE2 LYS 63 21.067 39.759 17.809 508 HE3 LYS 63 HE3 LYS 63 20.731 38.429 18.923 509 HZ1 LYS 63 HZ1 LYS 63 21.610 41.173 19.622 510 HZ2 LYS 63 HZ2 LYS 63 20.252 40.382 20.114 511 HZ3 LYS 63 HZ3 LYS 63 21.723 39.950 20.693 512 H HIS 64 H HIS 64 25.376 33.809 18.389 513 HA HIS 64 HA HIS 64 26.174 32.561 15.835 514 HB2 HIS 64 HB2 HIS 64 27.745 32.396 18.452 515 HB3 HIS 64 HB3 HIS 64 27.979 31.343 17.065 516 HD1 HIS 64 HD1 HIS 64 28.446 35.095 17.930 517 HD2 HIS 64 HD2 HIS 64 29.778 32.039 15.367 518 HE1 HIS 64 HE1 HIS 64 30.550 35.978 16.773 519 H GLU 65 H GLU 65 25.721 30.229 15.923 520 HA GLU 65 HA GLU 65 23.781 29.505 18.090 521 HB2 GLU 65 HB2 GLU 65 23.298 27.605 16.374 522 HB3 GLU 65 HB3 GLU 65 22.559 29.179 16.246 523 HG2 GLU 65 HG2 GLU 65 23.192 28.314 14.066 524 HG3 GLU 65 HG3 GLU 65 23.977 29.842 14.438 525 H THR 66 H THR 66 26.639 28.174 16.399 526 HA THR 66 HA THR 66 27.579 26.973 18.935 527 HB THR 66 HB THR 66 26.999 25.159 16.581 528 HG1 THR 66 HG1 THR 66 25.472 25.923 18.605 529 HG21 THR 66 HG21 THR 66 27.610 23.334 18.149 530 HG22 THR 66 HG22 THR 66 28.101 24.533 19.355 531 HG23 THR 66 HG23 THR 66 28.985 24.383 17.805 532 H VAL 67 H VAL 67 29.742 26.820 18.929 533 HA VAL 67 HA VAL 67 31.265 27.419 16.441 534 HB VAL 67 HB VAL 67 31.570 28.845 19.101 535 HG11 VAL 67 HG11 VAL 67 33.142 29.177 16.515 536 HG12 VAL 67 HG12 VAL 67 33.223 30.267 17.913 537 HG13 VAL 67 HG13 VAL 67 33.787 28.605 18.074 538 HG21 VAL 67 HG21 VAL 67 29.657 29.709 17.909 539 HG22 VAL 67 HG22 VAL 67 30.983 30.860 17.764 540 HG23 VAL 67 HG23 VAL 67 30.588 29.796 16.397 541 HA PRO 68 HA PRO 68 30.226 25.367 19.713 542 HB2 PRO 68 HB2 PRO 68 31.321 24.347 21.967 543 HB3 PRO 68 HB3 PRO 68 31.114 23.370 20.492 544 HG2 PRO 68 HG2 PRO 68 33.608 24.859 21.400 545 HG3 PRO 68 HG3 PRO 68 33.469 23.132 20.942 546 HD2 PRO 68 HD2 PRO 68 34.281 24.981 19.143 547 HD3 PRO 68 HD3 PRO 68 33.159 23.688 18.639 548 H ALA 69 H ALA 69 29.516 26.169 21.817 549 HA ALA 69 HA ALA 69 30.764 28.791 22.502 550 HB1 ALA 69 HB1 ALA 69 28.353 28.807 21.979 551 HB2 ALA 69 HB2 ALA 69 28.065 27.586 23.243 552 HB3 ALA 69 HB3 ALA 69 28.643 29.208 23.683 553 H ILE 70 H ILE 70 31.914 29.011 24.325 554 HA ILE 70 HA ILE 70 32.175 26.673 26.168 555 HB ILE 70 HB ILE 70 34.295 28.564 25.080 556 HG12 ILE 70 HG12 ILE 70 34.324 25.597 24.504 557 HG13 ILE 70 HG13 ILE 70 33.348 26.648 23.495 558 HG21 ILE 70 HG21 ILE 70 35.928 27.038 26.197 559 HG22 ILE 70 HG22 ILE 70 34.879 27.867 27.340 560 HG23 ILE 70 HG23 ILE 70 34.573 26.162 26.936 561 HD11 ILE 70 HD11 ILE 70 35.549 26.317 22.494 562 HD12 ILE 70 HD12 ILE 70 35.282 28.019 22.893 563 HD13 ILE 70 HD13 ILE 70 36.332 27.020 23.922 564 H PHE 71 H PHE 71 32.072 27.132 28.323 565 HA PHE 71 HA PHE 71 32.181 29.993 29.157 566 HB2 PHE 71 HB2 PHE 71 30.198 27.863 29.996 567 HB3 PHE 71 HB3 PHE 71 30.366 29.439 30.758 568 HD1 PHE 71 HD2 PHE 71 29.375 27.690 27.625 569 HD2 PHE 71 HD1 PHE 71 29.471 31.455 29.727 570 HE1 PHE 71 HE2 PHE 71 27.865 28.691 25.924 571 HE2 PHE 71 HE1 PHE 71 27.925 32.430 28.049 572 HZ PHE 71 HZ PHE 71 27.118 31.037 26.139 573 H ILE 72 H ILE 72 33.446 30.438 30.842 574 HA ILE 72 HA ILE 72 34.505 28.217 32.564 575 HB ILE 72 HB ILE 72 36.058 30.600 31.467 576 HG12 ILE 72 HG12 ILE 72 35.885 27.680 30.652 577 HG13 ILE 72 HG13 ILE 72 35.834 29.119 29.647 578 HG21 ILE 72 HG21 ILE 72 36.930 28.262 33.253 579 HG22 ILE 72 HG22 ILE 72 38.002 29.525 32.603 580 HG23 ILE 72 HG23 ILE 72 36.771 29.958 33.758 581 HD11 ILE 72 HD11 ILE 72 37.901 27.958 29.236 582 HD12 ILE 72 HD12 ILE 72 38.302 29.446 30.121 583 HD13 ILE 72 HD13 ILE 72 38.280 27.874 30.964 584 H ASN 73 H ASN 73 34.051 28.541 34.656 585 HA ASN 73 HA ASN 73 33.125 29.530 36.498 586 HB2 ASN 73 HB2 ASN 73 35.105 31.743 35.837 587 HB3 ASN 73 HB3 ASN 73 34.398 31.423 37.415 588 HD21 ASN 73 HD21 ASN 73 37.293 31.329 36.375 589 HD22 ASN 73 HD22 ASN 73 37.819 29.719 36.869 590 H GLY 74 H GLY 74 31.391 29.766 34.454 591 HA2 GLY 74 HA2 GLY 74 29.436 30.855 33.862 592 HA3 GLY 74 HA3 GLY 74 29.764 32.069 35.060 593 H ASN 75 H ASN 75 32.453 32.179 33.033 594 HA ASN 75 HA ASN 75 31.330 34.521 31.560 595 HB2 ASN 75 HB2 ASN 75 34.116 33.719 32.483 596 HB3 ASN 75 HB3 ASN 75 33.839 35.037 31.393 597 HD21 ASN 75 HD21 ASN 75 33.046 33.942 34.714 598 HD22 ASN 75 HD22 ASN 75 32.855 35.602 35.236 599 H PHE 76 H PHE 76 31.783 34.877 29.323 600 HA PHE 76 HA PHE 76 31.643 32.337 27.858 601 HB2 PHE 76 HB2 PHE 76 29.881 33.937 27.553 602 HB3 PHE 76 HB3 PHE 76 31.023 35.211 27.153 603 HD1 PHE 76 HD1 PHE 76 30.250 31.708 25.923 604 HD2 PHE 76 HD2 PHE 76 31.147 35.805 24.910 605 HE1 PHE 76 HE1 PHE 76 30.099 31.155 23.513 606 HE2 PHE 76 HE2 PHE 76 30.995 35.241 22.499 607 HZ PHE 76 HZ PHE 76 30.467 32.917 21.796 608 H ILE 77 H ILE 77 32.867 31.585 26.317 609 HA ILE 77 HA ILE 77 34.998 33.127 24.973 610 HB ILE 77 HB ILE 77 35.297 30.346 26.176 611 HG12 ILE 77 HG12 ILE 77 36.792 32.946 26.721 612 HG13 ILE 77 HG13 ILE 77 35.650 32.147 27.804 613 HG21 ILE 77 HG21 ILE 77 37.546 30.259 25.164 614 HG22 ILE 77 HG22 ILE 77 36.338 30.396 23.914 615 HG23 ILE 77 HG23 ILE 77 37.279 31.832 24.389 616 HD11 ILE 77 HD11 ILE 77 38.412 31.171 27.044 617 HD12 ILE 77 HD12 ILE 77 37.800 31.632 28.637 618 HD13 ILE 77 HD13 ILE 77 37.203 30.150 27.860 619 H GLY 78 H GLY 78 35.048 32.711 22.723 620 HA2 GLY 78 HA2 GLY 78 34.011 30.073 21.864 621 HA3 GLY 78 HA3 GLY 78 33.259 31.451 21.081 622 H GLY 79 H GLY 79 35.584 29.194 20.817 623 HA2 GLY 79 HA2 GLY 79 36.318 29.406 18.289 624 HA3 GLY 79 HA3 GLY 79 37.417 30.607 18.985 625 H CYS 80 H CYS 80 37.815 27.827 17.719 626 HA CYS 80 HA CYS 80 38.615 25.995 19.817 627 HB2 CYS 80 HB2 CYS 80 39.255 26.064 16.829 628 HB3 CYS 80 HB3 CYS 80 39.641 24.733 17.926 629 HG CYS 80 HG CYS 80 36.700 25.944 16.969 630 H SER 81 H SER 81 40.395 28.288 17.759 631 HA SER 81 HA SER 81 42.999 27.716 18.986 632 HB2 SER 81 HB2 SER 81 42.128 29.913 17.077 633 HB3 SER 81 HB3 SER 81 43.790 29.606 17.630 634 HG SER 81 HG SER 81 42.468 28.382 15.648 635 H ASP 82 H ASP 82 40.400 30.109 19.390 636 HA ASP 82 HA ASP 82 41.741 31.918 21.083 637 HB2 ASP 82 HB2 ASP 82 39.282 31.793 19.996 638 HB3 ASP 82 HB3 ASP 82 38.843 31.259 21.601 639 H LEU 83 H LEU 83 40.113 28.942 21.854 640 HA LEU 83 HA LEU 83 40.476 28.920 24.720 641 HB2 LEU 83 HB2 LEU 83 38.783 27.572 23.571 642 HB3 LEU 83 HB3 LEU 83 40.018 26.760 22.620 643 HG LEU 83 HG LEU 83 40.932 25.705 24.662 644 HD11 LEU 83 HD11 LEU 83 38.521 26.955 26.053 645 HD12 LEU 83 HD12 LEU 83 39.602 25.726 26.752 646 HD13 LEU 83 HD13 LEU 83 40.226 27.334 26.377 647 HD21 LEU 83 HD21 LEU 83 39.248 24.572 23.263 648 HD22 LEU 83 HD22 LEU 83 39.135 24.095 24.960 649 HD23 LEU 83 HD23 LEU 83 37.953 25.238 24.282 650 H GLU 84 H GLU 84 42.420 27.520 22.025 651 HA GLU 84 HA GLU 84 44.413 26.297 23.759 652 HB2 GLU 84 HB2 GLU 84 44.510 27.098 20.816 653 HB3 GLU 84 HB3 GLU 84 45.828 26.293 21.678 654 HG2 GLU 84 HG2 GLU 84 44.392 24.376 22.177 655 HG3 GLU 84 HG3 GLU 84 43.053 25.129 21.313 656 H ALA 85 H ALA 85 44.070 29.513 22.267 657 HA ALA 85 HA ALA 85 46.709 30.357 22.640 658 HB1 ALA 85 HB1 ALA 85 45.702 32.653 22.390 659 HB2 ALA 85 HB2 ALA 85 45.034 31.503 21.219 660 HB3 ALA 85 HB3 ALA 85 44.084 31.959 22.645 661 H LEU 86 H LEU 86 43.984 30.496 24.949 662 HA LEU 86 HA LEU 86 45.453 31.851 27.074 663 HB2 LEU 86 HB2 LEU 86 42.998 30.042 27.105 664 HB3 LEU 86 HB3 LEU 86 43.619 30.906 28.511 665 HG LEU 86 HG LEU 86 42.580 32.247 25.987 666 HD11 LEU 86 HD11 LEU 86 41.332 31.903 28.753 667 HD12 LEU 86 HD12 LEU 86 40.635 32.804 27.393 668 HD13 LEU 86 HD13 LEU 86 40.834 31.055 27.268 669 HD21 LEU 86 HD21 LEU 86 44.215 33.677 27.152 670 HD22 LEU 86 HD22 LEU 86 42.583 34.294 27.401 671 HD23 LEU 86 HD23 LEU 86 43.382 33.394 28.704 672 H ASP 87 H ASP 87 45.006 28.477 26.110 673 HA ASP 87 HA ASP 87 46.106 27.266 28.467 674 HB2 ASP 87 HB2 ASP 87 44.640 26.235 26.613 675 HB3 ASP 87 HB3 ASP 87 46.117 26.081 25.674 676 H LYS 88 H LYS 88 47.523 28.144 25.330 677 HA LYS 88 HA LYS 88 50.284 27.498 25.978 678 HB2 LYS 88 HB2 LYS 88 48.838 28.897 23.720 679 HB3 LYS 88 HB3 LYS 88 50.577 29.049 23.848 680 HG2 LYS 88 HG2 LYS 88 49.861 27.268 22.303 681 HG3 LYS 88 HG3 LYS 88 50.946 26.696 23.571 682 HD2 LYS 88 HD2 LYS 88 49.239 25.473 24.668 683 HD3 LYS 88 HD3 LYS 88 47.973 26.443 23.924 684 HE2 LYS 88 HE2 LYS 88 47.772 24.415 22.908 685 HE3 LYS 88 HE3 LYS 88 48.481 25.503 21.720 686 HZ1 LYS 88 HZ1 LYS 88 49.491 23.192 21.863 687 HZ2 LYS 88 HZ2 LYS 88 50.576 24.423 21.976 688 HZ3 LYS 88 HZ3 LYS 88 50.114 23.595 23.319 689 H GLU 89 H GLU 89 48.365 30.413 26.499 690 HA GLU 89 HA GLU 89 50.686 32.028 27.311 691 HB2 GLU 89 HB2 GLU 89 47.661 32.306 27.580 692 HB3 GLU 89 HB3 GLU 89 48.737 33.329 28.501 693 HG2 GLU 89 HG2 GLU 89 49.828 34.048 26.340 694 HG3 GLU 89 HG3 GLU 89 48.482 33.279 25.496 695 H GLY 90 H GLY 90 49.305 29.319 28.796 696 HA2 GLY 90 HA2 GLY 90 49.679 28.481 30.938 697 HA3 GLY 90 HA3 GLY 90 50.693 29.892 31.266 698 H LYS 91 H LYS 91 47.613 30.853 30.155 699 HA LYS 91 HA LYS 91 46.904 31.870 32.876 700 HB2 LYS 91 HB2 LYS 91 46.554 32.739 30.015 701 HB3 LYS 91 HB3 LYS 91 45.262 33.163 31.127 702 HG2 LYS 91 HG2 LYS 91 46.646 34.455 32.520 703 HG3 LYS 91 HG3 LYS 91 48.133 33.774 31.852 704 HD2 LYS 91 HD2 LYS 91 47.638 36.129 31.115 705 HD3 LYS 91 HD3 LYS 91 47.930 34.957 29.832 706 HE2 LYS 91 HE2 LYS 91 45.450 34.754 29.490 707 HE3 LYS 91 HE3 LYS 91 45.211 36.052 30.672 708 HZ1 LYS 91 HZ1 LYS 91 46.397 37.549 29.217 709 HZ2 LYS 91 HZ2 LYS 91 46.858 36.344 28.208 710 HZ3 LYS 91 HZ3 LYS 91 45.282 36.778 28.294 711 H LEU 92 H LEU 92 45.828 29.460 30.627 712 HA LEU 92 HA LEU 92 43.098 29.393 31.652 713 HB2 LEU 92 HB2 LEU 92 43.847 28.680 29.360 714 HB3 LEU 92 HB3 LEU 92 44.647 27.295 30.098 715 HG LEU 92 HG LEU 92 42.562 26.354 30.798 716 HD11 LEU 92 HD11 LEU 92 41.191 28.259 31.405 717 HD12 LEU 92 HD12 LEU 92 41.214 28.865 29.727 718 HD13 LEU 92 HD13 LEU 92 40.374 27.353 30.136 719 HD21 LEU 92 HD21 LEU 92 42.301 27.420 27.952 720 HD22 LEU 92 HD22 LEU 92 43.267 26.026 28.426 721 HD23 LEU 92 HD23 LEU 92 41.499 25.977 28.595 722 H ASP 93 H ASP 93 46.165 27.827 32.393 723 HA ASP 93 HA ASP 93 45.289 26.106 34.523 724 HB2 ASP 93 HB2 ASP 93 47.897 27.530 33.853 725 HB3 ASP 93 HB3 ASP 93 47.699 26.507 35.266 726 H GLY 94 H GLY 94 45.976 29.590 34.424 727 HA2 GLY 94 HA2 GLY 94 45.726 30.105 37.272 728 HA3 GLY 94 HA3 GLY 94 45.625 31.276 35.949 729 H LEU 95 H LEU 95 43.445 29.966 34.525 730 HA LEU 95 HA LEU 95 41.131 30.847 36.052 731 HB2 LEU 95 HB2 LEU 95 41.511 29.424 33.396 732 HB3 LEU 95 HB3 LEU 95 39.931 29.818 34.042 733 HG LEU 95 HG LEU 95 42.083 31.907 33.484 734 HD11 LEU 95 HD11 LEU 95 39.693 31.087 31.779 735 HD12 LEU 95 HD12 LEU 95 40.764 32.468 31.476 736 HD13 LEU 95 HD13 LEU 95 41.408 30.828 31.378 737 HD21 LEU 95 HD21 LEU 95 39.091 32.157 33.976 738 HD22 LEU 95 HD22 LEU 95 40.381 32.662 35.096 739 HD23 LEU 95 HD23 LEU 95 40.188 33.486 33.548 740 H LEU 96 H LEU 96 42.664 27.700 35.502 741 HA LEU 96 HA LEU 96 40.651 26.174 36.965 742 HB2 LEU 96 HB2 LEU 96 43.559 25.578 36.272 743 HB3 LEU 96 HB3 LEU 96 42.483 24.416 37.018 744 HG LEU 96 HG LEU 96 42.239 25.491 34.195 745 HD11 LEU 96 HD11 LEU 96 43.970 23.749 34.780 746 HD12 LEU 96 HD12 LEU 96 42.673 22.713 35.403 747 HD13 LEU 96 HD13 LEU 96 42.741 23.137 33.687 748 HD21 LEU 96 HD21 LEU 96 39.977 25.258 35.070 749 HD22 LEU 96 HD22 LEU 96 40.352 23.941 33.976 750 HD23 LEU 96 HD23 LEU 96 40.368 23.644 35.730 751 H SER 97 H SER 97 42.908 28.440 38.120 752 HA SER 97 HA SER 97 43.578 27.018 40.621 753 HB2 SER 97 HB2 SER 97 44.324 29.796 39.633 754 HB3 SER 97 HB3 SER 97 44.908 29.043 41.115 755 HG SER 97 HG SER 97 45.210 27.955 38.482 Start of MODEL 4 1 H1 GLY 1 H1 GLY 1 15.096 37.090 27.111 2 H2 GLY 1 H2 GLY 1 14.907 37.992 28.474 3 H3 GLY 1 H3 GLY 1 13.641 37.121 27.883 4 HA2 GLY 1 HA2 GLY 1 14.624 35.061 28.397 5 HA3 GLY 1 HA3 GLY 1 16.140 35.884 28.798 6 H ALA 2 H ALA 2 12.671 35.801 29.792 7 HA ALA 2 HA ALA 2 13.178 37.028 32.345 8 HB1 ALA 2 HB1 ALA 2 10.781 35.469 31.294 9 HB2 ALA 2 HB2 ALA 2 10.803 36.503 32.738 10 HB3 ALA 2 HB3 ALA 2 11.057 37.222 31.140 11 H MET 3 H MET 3 13.834 33.841 31.385 12 HA MET 3 HA MET 3 14.498 33.199 34.157 13 HB2 MET 3 HB2 MET 3 13.604 30.858 33.969 14 HB3 MET 3 HB3 MET 3 12.412 32.132 34.092 15 HG2 MET 3 HG2 MET 3 11.643 30.493 32.558 16 HG3 MET 3 HG3 MET 3 11.968 31.974 31.672 17 HE1 MET 3 HE1 MET 3 12.629 29.021 29.133 18 HE2 MET 3 HE2 MET 3 11.478 28.967 30.482 19 HE3 MET 3 HE3 MET 3 11.630 30.444 29.500 20 HA PRO 4 HA PRO 4 18.233 32.347 32.482 21 HB2 PRO 4 HB2 PRO 4 19.488 30.651 34.236 22 HB3 PRO 4 HB3 PRO 4 18.902 32.282 34.684 23 HG2 PRO 4 HG2 PRO 4 17.519 29.605 35.076 24 HG3 PRO 4 HG3 PRO 4 17.790 30.899 36.291 25 HD2 PRO 4 HD2 PRO 4 15.452 30.680 34.965 26 HD3 PRO 4 HD3 PRO 4 16.158 32.286 35.317 27 H SER 5 H SER 5 16.443 29.308 32.518 28 HA SER 5 HA SER 5 16.812 27.272 31.568 29 HB2 SER 5 HB2 SER 5 17.533 29.164 29.347 30 HB3 SER 5 HB3 SER 5 17.444 27.419 29.082 31 HG SER 5 HG SER 5 15.449 28.905 28.892 32 H ILE 6 H ILE 6 19.534 27.987 29.609 33 HA ILE 6 HA ILE 6 20.902 25.709 30.671 34 HB ILE 6 HB ILE 6 22.500 25.999 29.041 35 HG12 ILE 6 HG12 ILE 6 21.640 28.869 28.661 36 HG13 ILE 6 HG13 ILE 6 23.211 28.302 29.195 37 HG21 ILE 6 HG21 ILE 6 20.110 25.445 28.459 38 HG22 ILE 6 HG22 ILE 6 19.991 27.074 27.746 39 HG23 ILE 6 HG23 ILE 6 21.188 25.910 27.135 40 HD11 ILE 6 HD11 ILE 6 23.621 27.304 26.956 41 HD12 ILE 6 HD12 ILE 6 22.041 27.835 26.406 42 HD13 ILE 6 HD13 ILE 6 23.269 29.036 26.846 43 H ALA 7 H ALA 7 21.159 29.075 31.390 44 HA ALA 7 HA ALA 7 23.850 29.346 32.092 45 HB1 ALA 7 HB1 ALA 7 22.284 31.201 31.824 46 HB2 ALA 7 HB2 ALA 7 21.442 30.732 33.313 47 HB3 ALA 7 HB3 ALA 7 23.121 31.307 33.382 48 H SER 8 H SER 8 21.200 28.120 34.172 49 HA SER 8 HA SER 8 22.583 27.904 36.618 50 HB2 SER 8 HB2 SER 8 20.447 26.070 35.481 51 HB3 SER 8 HB3 SER 8 20.877 26.259 37.198 52 HG SER 8 HG SER 8 19.090 27.521 36.639 53 H MET 9 H MET 9 22.641 25.640 33.830 54 HA MET 9 HA MET 9 24.127 23.547 35.175 55 HB2 MET 9 HB2 MET 9 24.194 24.169 32.196 56 HB3 MET 9 HB3 MET 9 24.491 22.633 33.006 57 HG2 MET 9 HG2 MET 9 22.024 22.779 33.782 58 HG3 MET 9 HG3 MET 9 21.843 24.050 32.588 59 HE1 MET 9 HE1 MET 9 22.334 22.185 29.189 60 HE2 MET 9 HE2 MET 9 21.850 23.695 29.988 61 HE3 MET 9 HE3 MET 9 23.542 23.142 30.076 62 H ILE 10 H ILE 10 25.001 26.539 33.532 63 HA ILE 10 HA ILE 10 27.830 26.030 33.293 64 HB ILE 10 HB ILE 10 26.718 28.776 33.123 65 HG12 ILE 10 HG12 ILE 10 26.319 26.393 31.271 66 HG13 ILE 10 HG13 ILE 10 25.131 27.565 31.871 67 HG21 ILE 10 HG21 ILE 10 29.223 28.193 32.962 68 HG22 ILE 10 HG22 ILE 10 28.834 27.235 31.542 69 HG23 ILE 10 HG23 ILE 10 28.549 28.988 31.538 70 HD11 ILE 10 HD11 ILE 10 25.485 27.951 29.581 71 HD12 ILE 10 HD12 ILE 10 26.243 29.297 30.490 72 HD13 ILE 10 HD13 ILE 10 27.256 27.973 29.825 73 H LYS 11 H LYS 11 25.754 27.265 35.790 74 HA LYS 11 HA LYS 11 28.007 27.935 37.639 75 HB2 LYS 11 HB2 LYS 11 24.992 28.252 37.830 76 HB3 LYS 11 HB3 LYS 11 26.020 28.304 39.245 77 HG2 LYS 11 HG2 LYS 11 25.828 30.524 38.774 78 HG3 LYS 11 HG3 LYS 11 27.389 30.126 38.099 79 HD2 LYS 11 HD2 LYS 11 26.272 31.641 36.607 80 HD3 LYS 11 HD3 LYS 11 26.349 30.069 35.823 81 HE2 LYS 11 HE2 LYS 11 24.184 30.855 35.356 82 HE3 LYS 11 HE3 LYS 11 23.958 29.664 36.630 83 HZ1 LYS 11 HZ1 LYS 11 22.645 31.540 37.123 84 HZ2 LYS 11 HZ2 LYS 11 23.852 31.572 38.215 85 HZ3 LYS 11 HZ3 LYS 11 23.869 32.619 36.935 86 H GLY 12 H GLY 12 26.676 25.105 36.572 87 HA2 GLY 12 HA2 GLY 12 26.647 23.683 39.177 88 HA3 GLY 12 HA3 GLY 12 26.101 23.087 37.613 89 H ASN 13 H ASN 13 28.569 23.731 36.152 90 HA ASN 13 HA ASN 13 30.681 22.113 37.535 91 HB2 ASN 13 HB2 ASN 13 29.560 21.754 34.734 92 HB3 ASN 13 HB3 ASN 13 31.238 21.410 35.047 93 HD21 ASN 13 HD21 ASN 13 31.834 19.815 36.617 94 HD22 ASN 13 HD22 ASN 13 30.754 18.452 36.856 95 H LYS 14 H LYS 14 32.840 22.484 36.691 96 HA LYS 14 HA LYS 14 33.424 25.330 36.701 97 HB2 LYS 14 HB2 LYS 14 34.852 23.627 37.761 98 HB3 LYS 14 HB3 LYS 14 35.212 22.923 36.183 99 HG2 LYS 14 HG2 LYS 14 36.298 24.997 35.442 100 HG3 LYS 14 HG3 LYS 14 35.936 25.783 36.982 101 HD2 LYS 14 HD2 LYS 14 37.668 23.292 36.643 102 HD3 LYS 14 HD3 LYS 14 38.302 24.946 36.665 103 HE2 LYS 14 HE2 LYS 14 37.550 25.300 38.941 104 HE3 LYS 14 HE3 LYS 14 36.723 23.715 38.944 105 HZ1 LYS 14 HZ1 LYS 14 38.808 23.410 40.011 106 HZ2 LYS 14 HZ2 LYS 14 38.994 22.747 38.516 107 HZ3 LYS 14 HZ3 LYS 14 39.630 24.224 38.884 108 H VAL 15 H VAL 15 33.525 22.839 34.156 109 HA VAL 15 HA VAL 15 33.637 24.993 32.093 110 HB VAL 15 HB VAL 15 34.997 22.316 31.750 111 HG11 VAL 15 HG11 VAL 15 34.408 23.531 29.687 112 HG12 VAL 15 HG12 VAL 15 35.280 24.956 30.276 113 HG13 VAL 15 HG13 VAL 15 36.155 23.450 29.931 114 HG21 VAL 15 HG21 VAL 15 36.169 23.390 33.592 115 HG22 VAL 15 HG22 VAL 15 37.126 23.481 32.131 116 HG23 VAL 15 HG23 VAL 15 36.247 24.923 32.692 117 H VAL 16 H VAL 16 32.101 24.934 30.611 118 HA VAL 16 HA VAL 16 30.525 22.436 30.156 119 HB VAL 16 HB VAL 16 29.279 25.149 30.677 120 HG11 VAL 16 HG11 VAL 16 27.995 23.879 28.999 121 HG12 VAL 16 HG12 VAL 16 28.025 22.440 30.047 122 HG13 VAL 16 HG13 VAL 16 27.137 23.897 30.540 123 HG21 VAL 16 HG21 VAL 16 29.310 22.567 32.304 124 HG22 VAL 16 HG22 VAL 16 29.948 24.150 32.800 125 HG23 VAL 16 HG23 VAL 16 28.207 23.917 32.615 126 H VAL 17 H VAL 17 30.139 22.074 28.015 127 HA VAL 17 HA VAL 17 30.613 24.308 26.065 128 HB VAL 17 HB VAL 17 31.714 21.481 25.929 129 HG11 VAL 17 HG11 VAL 17 31.956 23.714 23.876 130 HG12 VAL 17 HG12 VAL 17 32.798 22.147 23.834 131 HG13 VAL 17 HG13 VAL 17 31.048 22.201 23.672 132 HG21 VAL 17 HG21 VAL 17 33.906 22.625 25.848 133 HG22 VAL 17 HG22 VAL 17 33.081 24.160 26.193 134 HG23 VAL 17 HG23 VAL 17 33.061 22.844 27.382 135 H PHE 18 H PHE 18 29.356 24.316 24.196 136 HA PHE 18 HA PHE 18 27.098 22.343 24.113 137 HB2 PHE 18 HB2 PHE 18 27.000 25.292 23.443 138 HB3 PHE 18 HB3 PHE 18 25.693 24.145 23.223 139 HD1 PHE 18 HD1 PHE 18 27.736 25.950 25.744 140 HD2 PHE 18 HD2 PHE 18 24.286 23.458 25.088 141 HE1 PHE 18 HE1 PHE 18 26.877 26.553 27.984 142 HE2 PHE 18 HE2 PHE 18 23.420 24.064 27.334 143 HZ PHE 18 HZ PHE 18 24.684 25.674 28.764 144 H SER 19 H SER 19 27.030 21.180 22.342 145 HA SER 19 HA SER 19 28.528 21.970 19.869 146 HB2 SER 19 HB2 SER 19 28.952 19.488 21.571 147 HB3 SER 19 HB3 SER 19 29.705 19.797 19.996 148 HG SER 19 HG SER 19 31.100 20.403 21.596 149 H TRP 20 H TRP 20 28.485 20.197 18.178 150 HA TRP 20 HA TRP 20 25.838 18.770 18.096 151 HB2 TRP 20 HB2 TRP 20 27.291 20.286 15.926 152 HB3 TRP 20 HB3 TRP 20 26.190 18.983 15.555 153 HD1 TRP 20 HD1 TRP 20 24.434 20.523 18.284 154 HE1 TRP 20 HE1 TRP 20 22.541 22.036 17.385 155 HE3 TRP 20 HE3 TRP 20 26.071 21.166 13.471 156 HZ2 TRP 20 HZ2 TRP 20 21.962 23.518 15.011 157 HZ3 TRP 20 HZ3 TRP 20 24.846 22.682 11.928 158 HH2 TRP 20 HH2 TRP 20 22.806 23.867 12.685 159 H VAL 21 H VAL 21 25.810 16.674 17.518 160 HA VAL 21 HA VAL 21 28.362 15.228 17.286 161 HB VAL 21 HB VAL 21 26.693 13.228 17.001 162 HG11 VAL 21 HG11 VAL 21 26.812 12.825 19.380 163 HG12 VAL 21 HG12 VAL 21 28.328 13.526 18.823 164 HG13 VAL 21 HG13 VAL 21 27.160 14.538 19.699 165 HG21 VAL 21 HG21 VAL 21 24.660 13.407 18.278 166 HG22 VAL 21 HG22 VAL 21 24.968 15.104 18.682 167 HG23 VAL 21 HG23 VAL 21 24.602 14.626 17.003 168 H THR 22 H THR 22 28.134 14.659 13.737 169 HA THR 22 HA THR 22 29.904 15.105 16.123 170 HB THR 22 HB THR 22 31.571 13.740 15.030 171 HG1 THR 22 HG1 THR 22 31.103 12.553 13.274 172 HG21 THR 22 HG21 THR 22 30.580 11.572 15.474 173 HG22 THR 22 HG22 THR 22 28.938 12.221 15.296 174 HG23 THR 22 HG23 THR 22 29.962 12.721 16.661 175 H CYS 23 H CYS 23 31.701 16.400 15.913 176 HA CYS 23 HA CYS 23 31.506 18.328 13.627 177 HB2 CYS 23 HB2 CYS 23 30.258 19.191 15.501 178 HB3 CYS 23 HB3 CYS 23 31.615 18.891 16.593 179 HG CYS 23 HG CYS 23 31.206 21.040 14.137 180 HA PRO 24 HA PRO 24 35.935 17.574 13.555 181 HB2 PRO 24 HB2 PRO 24 35.867 20.082 11.863 182 HB3 PRO 24 HB3 PRO 24 36.777 18.564 11.586 183 HG2 PRO 24 HG2 PRO 24 34.485 19.008 10.232 184 HG3 PRO 24 HG3 PRO 24 34.773 17.394 10.967 185 HD2 PRO 24 HD2 PRO 24 33.104 19.685 12.054 186 HD3 PRO 24 HD3 PRO 24 32.713 17.940 11.948 187 H TYR 25 H TYR 25 34.538 20.589 14.678 188 HA TYR 25 HA TYR 25 37.046 21.392 16.010 189 HB2 TYR 25 HB2 TYR 25 34.275 22.608 16.077 190 HB3 TYR 25 HB3 TYR 25 35.727 23.311 16.772 191 HD1 TYR 25 HD1 TYR 25 37.822 23.162 14.844 192 HD2 TYR 25 HD2 TYR 25 33.594 23.671 14.113 193 HE1 TYR 25 HE1 TYR 25 38.319 24.236 12.646 194 HE2 TYR 25 HE2 TYR 25 34.098 24.713 11.920 195 HH TYR 25 HH TYR 25 35.691 25.439 10.520 196 H CYS 26 H CYS 26 33.882 20.088 17.062 197 HA CYS 26 HA CYS 26 34.397 20.461 19.826 198 HB2 CYS 26 HB2 CYS 26 32.220 20.082 18.909 199 HB3 CYS 26 HB3 CYS 26 32.540 18.392 18.544 200 HG CYS 26 HG CYS 26 33.039 17.634 20.974 201 H VAL 27 H VAL 27 35.270 17.713 17.792 202 HA VAL 27 HA VAL 27 36.416 15.916 19.572 203 HB VAL 27 HB VAL 27 36.253 15.809 17.255 204 HG11 VAL 27 HG11 VAL 27 36.911 17.884 16.536 205 HG12 VAL 27 HG12 VAL 27 38.628 17.323 16.590 206 HG13 VAL 27 HG13 VAL 27 37.444 16.515 15.553 207 HG21 VAL 27 HG21 VAL 27 39.130 15.283 18.133 208 HG22 VAL 27 HG22 VAL 27 37.762 14.196 18.467 209 HG23 VAL 27 HG23 VAL 27 38.302 14.449 16.799 210 H ARG 28 H ARG 28 37.918 18.369 17.970 211 HA ARG 28 HA ARG 28 40.477 18.587 19.222 212 HB2 ARG 28 HB2 ARG 28 39.117 21.182 18.405 213 HB3 ARG 28 HB3 ARG 28 40.824 20.822 18.530 214 HG2 ARG 28 HG2 ARG 28 40.467 19.157 16.599 215 HG3 ARG 28 HG3 ARG 28 38.874 19.948 16.422 216 HD2 ARG 28 HD2 ARG 28 40.026 22.160 16.285 217 HD3 ARG 28 HD3 ARG 28 41.586 21.317 16.289 218 HE ARG 28 HE ARG 28 40.118 20.156 14.200 219 HH11 ARG 28 HH12 ARG 28 41.414 23.365 14.908 220 HH12 ARG 28 HH11 ARG 28 41.496 23.754 13.195 221 HH21 ARG 28 HH22 ARG 28 40.109 20.855 12.060 222 HH22 ARG 28 HH21 ARG 28 40.912 22.335 11.652 223 H ALA 29 H ALA 29 37.595 20.438 20.166 224 HA ALA 29 HA ALA 29 38.810 21.683 22.439 225 HB1 ALA 29 HB1 ALA 29 35.861 21.187 21.856 226 HB2 ALA 29 HB2 ALA 29 36.529 22.323 23.052 227 HB3 ALA 29 HB3 ALA 29 36.819 22.588 21.319 228 H GLU 30 H GLU 30 36.582 18.772 22.365 229 HA GLU 30 HA GLU 30 36.720 18.275 25.190 230 HB2 GLU 30 HB2 GLU 30 36.353 16.404 22.813 231 HB3 GLU 30 HB3 GLU 30 36.313 15.866 24.488 232 HG2 GLU 30 HG2 GLU 30 34.437 17.702 24.761 233 HG3 GLU 30 HG3 GLU 30 34.279 17.543 22.995 234 H LYS 31 H LYS 31 38.953 17.318 22.649 235 HA LYS 31 HA LYS 31 40.421 15.477 24.248 236 HB2 LYS 31 HB2 LYS 31 40.485 15.396 21.810 237 HB3 LYS 31 HB3 LYS 31 40.947 17.091 21.709 238 HG2 LYS 31 HG2 LYS 31 43.202 16.480 22.693 239 HG3 LYS 31 HG3 LYS 31 42.679 14.785 22.632 240 HD2 LYS 31 HD2 LYS 31 44.027 15.280 20.689 241 HD3 LYS 31 HD3 LYS 31 42.348 15.013 20.176 242 HE2 LYS 31 HE2 LYS 31 41.973 17.386 19.892 243 HE3 LYS 31 HE3 LYS 31 43.524 17.799 20.630 244 HZ1 LYS 31 HZ1 LYS 31 43.637 17.893 18.198 245 HZ2 LYS 31 HZ2 LYS 31 44.623 16.699 18.747 246 HZ3 LYS 31 HZ3 LYS 31 43.176 16.322 18.061 247 H LEU 32 H LEU 32 40.947 18.841 23.438 248 HA LEU 32 HA LEU 32 43.374 19.302 24.902 249 HB2 LEU 32 HB2 LEU 32 42.584 20.435 22.907 250 HB3 LEU 32 HB3 LEU 32 41.156 20.997 23.775 251 HG LEU 32 HG LEU 32 42.312 22.687 24.894 252 HD11 LEU 32 HD11 LEU 32 44.938 21.368 24.092 253 HD12 LEU 32 HD12 LEU 32 44.774 22.963 24.876 254 HD13 LEU 32 HD13 LEU 32 44.256 21.501 25.727 255 HD21 LEU 32 HD21 LEU 32 43.498 23.865 23.056 256 HD22 LEU 32 HD22 LEU 32 43.592 22.318 22.140 257 HD23 LEU 32 HD23 LEU 32 42.024 23.069 22.463 258 H LEU 33 H LEU 33 39.898 19.853 25.666 259 HA LEU 33 HA LEU 33 40.414 21.211 28.127 260 HB2 LEU 33 HB2 LEU 33 37.958 19.750 27.089 261 HB3 LEU 33 HB3 LEU 33 37.957 20.672 28.589 262 HG LEU 33 HG LEU 33 38.618 21.845 25.861 263 HD11 LEU 33 HD11 LEU 33 36.261 21.173 25.974 264 HD12 LEU 33 HD12 LEU 33 36.061 22.285 27.362 265 HD13 LEU 33 HD13 LEU 33 36.524 22.906 25.776 266 HD21 LEU 33 HD21 LEU 33 38.259 24.039 26.962 267 HD22 LEU 33 HD22 LEU 33 38.071 23.215 28.513 268 HD23 LEU 33 HD23 LEU 33 39.634 23.176 27.652 269 H HIS 34 H HIS 34 39.817 17.733 27.467 270 HA HIS 34 HA HIS 34 40.279 16.860 30.186 271 HB2 HIS 34 HB2 HIS 34 40.311 15.550 27.460 272 HB3 HIS 34 HB3 HIS 34 40.994 14.713 28.842 273 HD1 HIS 34 HD1 HIS 34 39.367 13.602 30.536 274 HD2 HIS 34 HD2 HIS 34 37.531 16.022 27.630 275 HE1 HIS 34 HE1 HIS 34 36.866 13.110 30.673 276 H ALA 35 H ALA 35 42.534 17.491 27.407 277 HA ALA 35 HA ALA 35 44.781 16.314 28.772 278 HB1 ALA 35 HB1 ALA 35 44.571 16.421 26.342 279 HB2 ALA 35 HB2 ALA 35 44.594 18.202 26.398 280 HB3 ALA 35 HB3 ALA 35 46.027 17.274 26.852 281 H ARG 36 H ARG 36 43.378 19.401 29.090 282 HA ARG 36 HA ARG 36 45.720 20.466 30.630 283 HB2 ARG 36 HB2 ARG 36 43.447 21.853 29.149 284 HB3 ARG 36 HB3 ARG 36 44.579 22.635 30.233 285 HG2 ARG 36 HG2 ARG 36 45.346 21.258 27.648 286 HG3 ARG 36 HG3 ARG 36 45.203 23.005 27.911 287 HD2 ARG 36 HD2 ARG 36 46.977 22.596 29.818 288 HD3 ARG 36 HD3 ARG 36 47.240 21.062 28.965 289 HE ARG 36 HE ARG 36 47.389 23.618 27.434 290 HH11 ARG 36 HH22 ARG 36 49.287 21.001 28.856 291 HH12 ARG 36 HH21 ARG 36 50.736 21.559 28.049 292 HH21 ARG 36 HH12 ARG 36 49.074 24.135 26.409 293 HH22 ARG 36 HH11 ARG 36 50.573 23.221 26.454 294 H THR 37 H THR 37 43.219 18.821 31.419 295 HA THR 37 HA THR 37 42.035 18.411 33.346 296 HB THR 37 HB THR 37 43.258 20.607 34.891 297 HG1 THR 37 HG1 THR 37 44.724 18.302 34.082 298 HG21 THR 37 HG21 THR 37 42.938 17.644 35.520 299 HG22 THR 37 HG22 THR 37 41.841 18.926 36.058 300 HG23 THR 37 HG23 THR 37 43.507 18.886 36.651 301 H LYS 38 H LYS 38 41.136 20.550 31.449 302 HA LYS 38 HA LYS 38 39.663 22.505 33.155 303 HB2 LYS 38 HB2 LYS 38 40.122 22.033 30.255 304 HB3 LYS 38 HB3 LYS 38 38.454 22.343 30.655 305 HG2 LYS 38 HG2 LYS 38 39.788 24.378 29.963 306 HG3 LYS 38 HG3 LYS 38 38.912 24.537 31.470 307 HD2 LYS 38 HD2 LYS 38 41.057 25.597 31.655 308 HD3 LYS 38 HD3 LYS 38 40.956 24.245 32.763 309 HE2 LYS 38 HE2 LYS 38 42.243 22.839 31.105 310 HE3 LYS 38 HE3 LYS 38 42.371 24.264 30.065 311 HZ1 LYS 38 HZ1 LYS 38 44.320 24.455 31.237 312 HZ2 LYS 38 HZ2 LYS 38 43.383 25.278 32.283 313 HZ3 LYS 38 HZ3 LYS 38 43.754 23.671 32.550 314 H ASP 39 H ASP 39 38.400 21.515 34.428 315 HA ASP 39 HA ASP 39 37.384 19.031 33.983 316 HB2 ASP 39 HB2 ASP 39 37.962 20.197 36.161 317 HB3 ASP 39 HB3 ASP 39 36.430 21.034 36.073 318 H ILE 40 H ILE 40 36.057 18.542 32.478 319 HA ILE 40 HA ILE 40 33.994 20.471 31.687 320 HB ILE 40 HB ILE 40 36.078 20.297 30.449 321 HG12 ILE 40 HG12 ILE 40 33.487 20.470 29.290 322 HG13 ILE 40 HG13 ILE 40 34.998 21.239 28.864 323 HG21 ILE 40 HG21 ILE 40 35.242 17.495 29.633 324 HG22 ILE 40 HG22 ILE 40 36.644 18.404 29.016 325 HG23 ILE 40 HG23 ILE 40 36.590 17.943 30.693 326 HD11 ILE 40 HD11 ILE 40 35.572 19.428 27.340 327 HD12 ILE 40 HD12 ILE 40 34.075 18.556 27.789 328 HD13 ILE 40 HD13 ILE 40 33.989 20.119 26.955 329 H THR 41 H THR 41 32.053 20.109 31.039 330 HA THR 41 HA THR 41 31.158 17.374 30.242 331 HB THR 41 HB THR 41 29.939 19.243 32.230 332 HG1 THR 41 HG1 THR 41 29.264 17.317 33.064 333 HG21 THR 41 HG21 THR 41 28.181 17.710 30.278 334 HG22 THR 41 HG22 THR 41 28.213 19.479 30.560 335 HG23 THR 41 HG23 THR 41 27.651 18.389 31.833 336 H VAL 42 H VAL 42 30.322 17.379 28.144 337 HA VAL 42 HA VAL 42 29.399 19.996 27.094 338 HB VAL 42 HB VAL 42 31.079 19.619 25.757 339 HG11 VAL 42 HG11 VAL 42 31.853 17.649 24.688 340 HG12 VAL 42 HG12 VAL 42 31.987 17.658 26.442 341 HG13 VAL 42 HG13 VAL 42 30.681 16.698 25.652 342 HG21 VAL 42 HG21 VAL 42 29.084 19.914 24.327 343 HG22 VAL 42 HG22 VAL 42 30.368 19.005 23.528 344 HG23 VAL 42 HG23 VAL 42 28.963 18.144 24.171 345 H HIS 43 H HIS 43 27.537 20.367 26.436 346 HA HIS 43 HA HIS 43 25.448 18.265 26.442 347 HB2 HIS 43 HB2 HIS 43 25.206 20.473 27.721 348 HB3 HIS 43 HB3 HIS 43 25.059 21.254 26.163 349 HD1 HIS 43 HD1 HIS 43 23.049 19.080 28.588 350 HD2 HIS 43 HD2 HIS 43 22.952 20.328 24.570 351 HE1 HIS 43 HE1 HIS 43 20.710 18.600 27.748 352 H TYR 44 H TYR 44 25.334 17.228 24.508 353 HA TYR 44 HA TYR 44 25.851 18.653 21.984 354 HB2 TYR 44 HB2 TYR 44 25.090 15.803 22.662 355 HB3 TYR 44 HB3 TYR 44 25.177 16.423 21.012 356 HD1 TYR 44 HD2 TYR 44 27.246 17.372 20.081 357 HD2 TYR 44 HD1 TYR 44 27.219 15.268 23.835 358 HE1 TYR 44 HE2 TYR 44 29.717 17.072 19.920 359 HE2 TYR 44 HE1 TYR 44 29.714 15.047 23.721 360 HH TYR 44 HH TYR 44 31.667 15.527 22.462 361 H VAL 45 H VAL 45 24.354 20.266 21.735 362 HA VAL 45 HA VAL 45 21.590 19.970 22.472 363 HB VAL 45 HB VAL 45 21.155 22.092 21.337 364 HG11 VAL 45 HG11 VAL 45 22.643 23.505 22.706 365 HG12 VAL 45 HG12 VAL 45 22.018 22.135 23.625 366 HG13 VAL 45 HG13 VAL 45 23.696 22.111 23.032 367 HG21 VAL 45 HG21 VAL 45 22.610 21.916 19.402 368 HG22 VAL 45 HG22 VAL 45 22.929 23.396 20.297 369 HG23 VAL 45 HG23 VAL 45 24.061 22.032 20.435 370 H ASP 46 H ASP 46 23.178 18.871 19.622 371 HA ASP 46 HA ASP 46 20.892 18.773 17.877 372 HB2 ASP 46 HB2 ASP 46 23.392 18.439 17.319 373 HB3 ASP 46 HB3 ASP 46 23.200 16.791 17.915 374 H LYS 47 H LYS 47 21.581 16.967 20.764 375 HA LYS 47 HA LYS 47 20.379 14.442 19.938 376 HB2 LYS 47 HB2 LYS 47 21.374 15.378 22.614 377 HB3 LYS 47 HB3 LYS 47 20.819 13.757 22.207 378 HG2 LYS 47 HG2 LYS 47 22.542 13.948 20.184 379 HG3 LYS 47 HG3 LYS 47 23.274 15.201 21.196 380 HD2 LYS 47 HD2 LYS 47 23.249 13.502 23.094 381 HD3 LYS 47 HD3 LYS 47 22.656 12.334 21.886 382 HE2 LYS 47 HE2 LYS 47 24.755 12.596 20.587 383 HE3 LYS 47 HE3 LYS 47 25.325 13.826 21.722 384 HZ1 LYS 47 HZ1 LYS 47 25.362 12.170 23.463 385 HZ2 LYS 47 HZ2 LYS 47 24.766 11.007 22.463 386 HZ3 LYS 47 HZ3 LYS 47 26.266 11.634 22.221 387 H MET 48 H MET 48 18.894 17.319 21.187 388 HA MET 48 HA MET 48 16.312 15.941 21.231 389 HB2 MET 48 HB2 MET 48 15.623 16.704 23.427 390 HB3 MET 48 HB3 MET 48 16.991 15.610 23.563 391 HG2 MET 48 HG2 MET 48 18.479 17.336 24.172 392 HG3 MET 48 HG3 MET 48 17.440 18.610 23.530 393 HE1 MET 48 HE1 MET 48 18.056 19.933 25.719 394 HE2 MET 48 HE2 MET 48 17.603 19.418 27.360 395 HE3 MET 48 HE3 MET 48 18.884 18.558 26.478 396 H SER 49 H SER 49 14.464 17.386 21.378 397 HA SER 49 HA SER 49 14.688 19.621 19.648 398 HB2 SER 49 HB2 SER 49 12.399 18.802 21.472 399 HB3 SER 49 HB3 SER 49 12.306 19.981 20.146 400 HG SER 49 HG SER 49 12.899 17.204 20.009 401 H GLU 50 H GLU 50 14.522 19.640 23.262 402 HA GLU 50 HA GLU 50 14.234 22.450 23.523 403 HB2 GLU 50 HB2 GLU 50 14.525 20.331 25.268 404 HB3 GLU 50 HB3 GLU 50 16.042 21.197 25.529 405 HG2 GLU 50 HG2 GLU 50 14.960 23.160 26.281 406 HG3 GLU 50 HG3 GLU 50 13.419 22.720 25.546 407 H GLY 51 H GLY 51 16.988 20.691 22.363 408 HA2 GLY 51 HA2 GLY 51 19.174 22.335 22.892 409 HA3 GLY 51 HA3 GLY 51 18.917 21.363 21.445 410 H GLU 52 H GLU 52 16.478 23.016 20.570 411 HA GLU 52 HA GLU 52 17.860 25.023 19.038 412 HB2 GLU 52 HB2 GLU 52 15.996 23.722 18.178 413 HB3 GLU 52 HB3 GLU 52 15.036 24.055 19.607 414 HG2 GLU 52 HG2 GLU 52 14.058 25.275 17.972 415 HG3 GLU 52 HG3 GLU 52 14.904 26.419 19.000 416 H GLN 53 H GLN 53 15.835 24.973 22.004 417 HA GLN 53 HA GLN 53 15.729 27.878 22.284 418 HB2 GLN 53 HB2 GLN 53 13.937 26.314 23.036 419 HB3 GLN 53 HB3 GLN 53 15.040 25.664 24.258 420 HG2 GLN 53 HG2 GLN 53 15.225 27.945 25.264 421 HG3 GLN 53 HG3 GLN 53 14.079 28.557 24.067 422 HE21 GLN 53 HE21 GLN 53 13.937 28.369 27.082 423 HE22 GLN 53 HE22 GLN 53 12.523 27.352 27.405 424 H LEU 54 H LEU 54 17.677 25.216 23.700 425 HA LEU 54 HA LEU 54 19.266 26.845 25.470 426 HB2 LEU 54 HB2 LEU 54 19.928 24.274 23.989 427 HB3 LEU 54 HB3 LEU 54 20.976 24.993 25.151 428 HG LEU 54 HG LEU 54 20.049 23.974 26.850 429 HD11 LEU 54 HD11 LEU 54 17.195 24.528 25.997 430 HD12 LEU 54 HD12 LEU 54 17.773 23.942 27.570 431 HD13 LEU 54 HD13 LEU 54 18.158 25.576 27.076 432 HD21 LEU 54 HD21 LEU 54 18.308 22.456 24.997 433 HD22 LEU 54 HD22 LEU 54 20.048 22.171 25.263 434 HD23 LEU 54 HD23 LEU 54 18.899 21.995 26.594 435 H ARG 55 H ARG 55 19.710 25.980 21.999 436 HA ARG 55 HA ARG 55 22.074 27.529 21.514 437 HB2 ARG 55 HB2 ARG 55 21.448 25.680 20.173 438 HB3 ARG 55 HB3 ARG 55 19.802 26.276 19.961 439 HG2 ARG 55 HG2 ARG 55 20.408 27.906 18.444 440 HG3 ARG 55 HG3 ARG 55 22.167 27.603 18.638 441 HD2 ARG 55 HD2 ARG 55 21.920 25.323 17.793 442 HD3 ARG 55 HD3 ARG 55 20.183 25.409 17.849 443 HE ARG 55 HE ARG 55 20.132 26.801 15.906 444 HH11 ARG 55 HH12 ARG 55 23.560 26.162 16.646 445 HH12 ARG 55 HH11 ARG 55 23.960 26.400 14.963 446 HH21 ARG 55 HH22 ARG 55 20.922 26.931 13.768 447 HH22 ARG 55 HH21 ARG 55 22.680 26.945 13.551 448 H GLY 56 H GLY 56 18.609 28.372 21.456 449 HA2 GLY 56 HA2 GLY 56 18.821 31.064 20.561 450 HA3 GLY 56 HA3 GLY 56 17.573 30.418 21.632 451 H GLU 57 H GLU 57 19.169 29.762 23.942 452 HA GLU 57 HA GLU 57 19.482 32.288 25.249 453 HB2 GLU 57 HB2 GLU 57 20.692 29.596 25.906 454 HB3 GLU 57 HB3 GLU 57 20.929 31.029 26.886 455 HG2 GLU 57 HG2 GLU 57 18.317 29.567 26.400 456 HG3 GLU 57 HG3 GLU 57 19.244 29.746 27.879 457 H ILE 58 H ILE 58 21.891 30.240 23.611 458 HA ILE 58 HA ILE 58 24.180 31.902 24.197 459 HB ILE 58 HB ILE 58 23.767 29.839 21.993 460 HG12 ILE 58 HG12 ILE 58 25.071 29.486 24.734 461 HG13 ILE 58 HG13 ILE 58 23.439 28.964 24.341 462 HG21 ILE 58 HG21 ILE 58 26.383 30.914 23.152 463 HG22 ILE 58 HG22 ILE 58 26.207 29.705 21.861 464 HG23 ILE 58 HG23 ILE 58 25.715 31.358 21.565 465 HD11 ILE 58 HD11 ILE 58 24.825 27.052 24.224 466 HD12 ILE 58 HD12 ILE 58 24.355 27.461 22.564 467 HD13 ILE 58 HD13 ILE 58 25.990 27.850 23.158 468 H TYR 59 H TYR 59 22.009 31.659 21.315 469 HA TYR 59 HA TYR 59 23.453 33.594 19.825 470 HB2 TYR 59 HB2 TYR 59 21.655 31.881 19.060 471 HB3 TYR 59 HB3 TYR 59 20.491 33.149 19.430 472 HD1 TYR 59 HD1 TYR 59 20.690 35.396 18.177 473 HD2 TYR 59 HD2 TYR 59 23.107 31.975 17.213 474 HE1 TYR 59 HE1 TYR 59 21.383 36.486 16.047 475 HE2 TYR 59 HE2 TYR 59 23.815 33.058 15.069 476 HH TYR 59 HH TYR 59 23.561 34.879 13.694 477 H GLN 60 H GLN 60 20.709 34.048 22.092 478 HA GLN 60 HA GLN 60 20.229 36.802 21.552 479 HB2 GLN 60 HB2 GLN 60 19.917 35.078 24.030 480 HB3 GLN 60 HB3 GLN 60 19.374 36.760 23.975 481 HG2 GLN 60 HG2 GLN 60 17.737 36.314 22.299 482 HG3 GLN 60 HG3 GLN 60 18.423 34.743 21.909 483 HE21 GLN 60 HE21 GLN 60 16.181 33.903 22.263 484 HE22 GLN 60 HE22 GLN 60 15.737 33.532 23.927 485 H ALA 61 H ALA 61 22.561 35.343 23.898 486 HA ALA 61 HA ALA 61 23.500 37.978 24.730 487 HB1 ALA 61 HB1 ALA 61 23.336 36.136 26.304 488 HB2 ALA 61 HB2 ALA 61 24.456 35.155 25.338 489 HB3 ALA 61 HB3 ALA 61 25.033 36.631 26.144 490 H TYR 62 H TYR 62 24.839 35.416 22.592 491 HA TYR 62 HA TYR 62 27.289 37.076 22.194 492 HB2 TYR 62 HB2 TYR 62 26.970 34.098 21.873 493 HB3 TYR 62 HB3 TYR 62 28.467 35.030 21.854 494 HD1 TYR 62 HD2 TYR 62 28.867 36.576 24.003 495 HD2 TYR 62 HD1 TYR 62 26.293 33.122 23.898 496 HE1 TYR 62 HE2 TYR 62 28.881 36.481 26.493 497 HE2 TYR 62 HE1 TYR 62 26.309 33.027 26.378 498 HH TYR 62 HH TYR 62 26.892 34.102 28.271 499 H LYS 63 H LYS 63 24.527 36.283 20.433 500 HA LYS 63 HA LYS 63 23.994 35.816 18.316 501 HB2 LYS 63 HB2 LYS 63 25.884 38.166 18.002 502 HB3 LYS 63 HB3 LYS 63 24.852 37.549 16.712 503 HG2 LYS 63 HG2 LYS 63 23.650 39.289 17.620 504 HG3 LYS 63 HG3 LYS 63 22.845 37.849 18.206 505 HD2 LYS 63 HD2 LYS 63 23.858 38.255 20.465 506 HD3 LYS 63 HD3 LYS 63 24.702 39.678 19.810 507 HE2 LYS 63 HE2 LYS 63 22.479 40.662 19.216 508 HE3 LYS 63 HE3 LYS 63 21.680 39.232 19.885 509 HZ1 LYS 63 HZ1 LYS 63 23.305 41.180 21.431 510 HZ2 LYS 63 HZ2 LYS 63 21.673 40.974 21.513 511 HZ3 LYS 63 HZ3 LYS 63 22.625 39.787 22.054 512 H HIS 64 H HIS 64 25.591 33.904 19.140 513 HA HIS 64 HA HIS 64 26.919 32.963 16.648 514 HB2 HIS 64 HB2 HIS 64 27.892 32.724 19.518 515 HB3 HIS 64 HB3 HIS 64 28.333 31.542 18.289 516 HD1 HIS 64 HD1 HIS 64 28.694 35.396 18.746 517 HD2 HIS 64 HD2 HIS 64 30.380 32.067 16.798 518 HE1 HIS 64 HE1 HIS 64 30.793 36.238 17.559 519 H GLU 65 H GLU 65 26.494 30.861 16.118 520 HA GLU 65 HA GLU 65 24.251 29.534 17.593 521 HB2 GLU 65 HB2 GLU 65 23.361 28.816 15.472 522 HB3 GLU 65 HB3 GLU 65 23.465 30.536 15.588 523 HG2 GLU 65 HG2 GLU 65 24.036 30.032 13.389 524 HG3 GLU 65 HG3 GLU 65 25.524 30.525 14.186 525 H THR 66 H THR 66 27.263 28.938 15.839 526 HA THR 66 HA THR 66 27.844 26.676 17.614 527 HB THR 66 HB THR 66 28.621 25.177 15.873 528 HG1 THR 66 HG1 THR 66 27.341 26.939 14.049 529 HG21 THR 66 HG21 THR 66 26.293 24.870 16.767 530 HG22 THR 66 HG22 THR 66 26.641 24.115 15.207 531 HG23 THR 66 HG23 THR 66 25.722 25.620 15.257 532 H VAL 67 H VAL 67 30.041 26.220 17.710 533 HA VAL 67 HA VAL 67 31.902 27.514 15.978 534 HB VAL 67 HB VAL 67 32.999 28.251 18.531 535 HG11 VAL 67 HG11 VAL 67 32.236 29.887 16.097 536 HG12 VAL 67 HG12 VAL 67 33.356 30.371 17.388 537 HG13 VAL 67 HG13 VAL 67 33.760 29.008 16.335 538 HG21 VAL 67 HG21 VAL 67 30.461 29.802 17.882 539 HG22 VAL 67 HG22 VAL 67 30.661 28.730 19.288 540 HG23 VAL 67 HG23 VAL 67 31.663 30.174 19.127 541 HA PRO 68 HA PRO 68 30.345 25.242 18.916 542 HB2 PRO 68 HB2 PRO 68 31.111 23.784 21.060 543 HB3 PRO 68 HB3 PRO 68 30.903 23.064 19.436 544 HG2 PRO 68 HG2 PRO 68 33.482 24.050 20.718 545 HG3 PRO 68 HG3 PRO 68 33.153 22.437 19.997 546 HD2 PRO 68 HD2 PRO 68 34.341 24.373 18.538 547 HD3 PRO 68 HD3 PRO 68 33.087 23.328 17.805 548 H ALA 69 H ALA 69 29.614 25.800 21.169 549 HA ALA 69 HA ALA 69 30.942 28.326 22.003 550 HB1 ALA 69 HB1 ALA 69 28.780 28.684 23.211 551 HB2 ALA 69 HB2 ALA 69 28.560 28.418 21.468 552 HB3 ALA 69 HB3 ALA 69 28.221 27.110 22.623 553 H ILE 70 H ILE 70 32.140 28.496 23.826 554 HA ILE 70 HA ILE 70 32.276 26.146 25.669 555 HB ILE 70 HB ILE 70 34.444 27.941 24.519 556 HG12 ILE 70 HG12 ILE 70 34.384 24.926 24.235 557 HG13 ILE 70 HG13 ILE 70 33.424 25.906 23.141 558 HG21 ILE 70 HG21 ILE 70 36.078 26.502 25.736 559 HG22 ILE 70 HG22 ILE 70 35.070 27.460 26.811 560 HG23 ILE 70 HG23 ILE 70 34.733 25.729 26.594 561 HD11 ILE 70 HD11 ILE 70 35.391 27.146 22.391 562 HD12 ILE 70 HD12 ILE 70 36.423 26.208 23.488 563 HD13 ILE 70 HD13 ILE 70 35.590 25.401 22.148 564 H PHE 71 H PHE 71 32.230 26.523 27.841 565 HA PHE 71 HA PHE 71 32.402 29.342 28.763 566 HB2 PHE 71 HB2 PHE 71 30.340 27.265 29.559 567 HB3 PHE 71 HB3 PHE 71 30.556 28.833 30.319 568 HD1 PHE 71 HD2 PHE 71 29.625 27.196 27.076 569 HD2 PHE 71 HD1 PHE 71 29.443 30.757 29.502 570 HE1 PHE 71 HE2 PHE 71 27.962 28.190 25.511 571 HE2 PHE 71 HE1 PHE 71 27.735 31.705 27.977 572 HZ PHE 71 HZ PHE 71 27.003 30.423 25.973 573 H ILE 72 H ILE 72 33.242 29.734 30.732 574 HA ILE 72 HA ILE 72 34.038 27.471 32.504 575 HB ILE 72 HB ILE 72 35.777 29.864 31.776 576 HG12 ILE 72 HG12 ILE 72 36.066 26.843 31.401 577 HG13 ILE 72 HG13 ILE 72 35.912 28.054 30.134 578 HG21 ILE 72 HG21 ILE 72 36.207 27.720 33.925 579 HG22 ILE 72 HG22 ILE 72 37.396 28.956 33.450 580 HG23 ILE 72 HG23 ILE 72 35.909 29.449 34.211 581 HD11 ILE 72 HD11 ILE 72 38.181 27.305 30.178 582 HD12 ILE 72 HD12 ILE 72 38.159 28.967 30.797 583 HD13 ILE 72 HD13 ILE 72 38.339 27.585 31.913 584 H ASN 73 H ASN 73 33.215 27.742 34.508 585 HA ASN 73 HA ASN 73 31.911 28.649 36.170 586 HB2 ASN 73 HB2 ASN 73 34.091 30.725 35.900 587 HB3 ASN 73 HB3 ASN 73 33.086 30.518 37.327 588 HD21 ASN 73 HD21 ASN 73 36.064 30.177 36.776 589 HD22 ASN 73 HD22 ASN 73 36.407 28.613 37.540 590 H GLY 74 H GLY 74 30.591 29.275 33.773 591 HA2 GLY 74 HA2 GLY 74 28.644 30.499 33.258 592 HA3 GLY 74 HA3 GLY 74 29.014 31.623 34.556 593 H ASN 75 H ASN 75 31.829 31.579 32.779 594 HA ASN 75 HA ASN 75 31.112 34.007 31.208 595 HB2 ASN 75 HB2 ASN 75 33.752 32.847 32.186 596 HB3 ASN 75 HB3 ASN 75 33.629 34.289 31.223 597 HD21 ASN 75 HD21 ASN 75 34.348 33.498 34.204 598 HD22 ASN 75 HD22 ASN 75 33.668 34.866 35.059 599 H PHE 76 H PHE 76 31.535 34.163 28.993 600 HA PHE 76 HA PHE 76 31.703 31.596 27.546 601 HB2 PHE 76 HB2 PHE 76 29.772 32.925 27.159 602 HB3 PHE 76 HB3 PHE 76 30.730 34.370 26.869 603 HD1 PHE 76 HD2 PHE 76 30.162 30.923 25.454 604 HD2 PHE 76 HD1 PHE 76 31.298 35.010 24.689 605 HE1 PHE 76 HE2 PHE 76 30.203 30.470 23.014 606 HE2 PHE 76 HE1 PHE 76 31.329 34.551 22.253 607 HZ PHE 76 HZ PHE 76 30.762 32.282 21.407 608 H ILE 77 H ILE 77 33.048 31.000 26.033 609 HA ILE 77 HA ILE 77 34.884 32.894 24.672 610 HB ILE 77 HB ILE 77 35.568 30.117 25.711 611 HG12 ILE 77 HG12 ILE 77 35.811 31.839 27.444 612 HG13 ILE 77 HG13 ILE 77 37.347 31.139 26.984 613 HG21 ILE 77 HG21 ILE 77 37.170 31.893 23.833 614 HG22 ILE 77 HG22 ILE 77 37.836 30.492 24.693 615 HG23 ILE 77 HG23 ILE 77 36.547 30.263 23.512 616 HD11 ILE 77 HD11 ILE 77 37.943 33.144 25.694 617 HD12 ILE 77 HD12 ILE 77 36.351 33.861 26.020 618 HD13 ILE 77 HD13 ILE 77 37.484 33.585 27.346 619 H GLY 78 H GLY 78 34.670 32.772 22.483 620 HA2 GLY 78 HA2 GLY 78 33.338 30.319 21.323 621 HA3 GLY 78 HA3 GLY 78 33.224 31.933 20.648 622 H GLY 79 H GLY 79 34.826 29.050 20.504 623 HA2 GLY 79 HA2 GLY 79 35.704 28.607 18.229 624 HA3 GLY 79 HA3 GLY 79 36.707 30.041 18.406 625 H CYS 80 H CYS 80 37.275 26.999 18.110 626 HA CYS 80 HA CYS 80 38.621 26.214 20.529 627 HB2 CYS 80 HB2 CYS 80 37.811 24.701 18.676 628 HB3 CYS 80 HB3 CYS 80 39.200 25.222 17.713 629 HG CYS 80 HG CYS 80 41.046 24.530 19.472 630 H SER 81 H SER 81 39.842 27.925 17.584 631 HA SER 81 HA SER 81 42.518 28.260 18.470 632 HB2 SER 81 HB2 SER 81 40.886 30.299 16.928 633 HB3 SER 81 HB3 SER 81 42.644 30.147 16.971 634 HG SER 81 HG SER 81 41.856 29.231 15.097 635 H ASP 82 H ASP 82 39.574 30.019 19.398 636 HA ASP 82 HA ASP 82 40.867 32.191 20.788 637 HB2 ASP 82 HB2 ASP 82 38.434 31.776 19.760 638 HB3 ASP 82 HB3 ASP 82 38.023 31.280 21.374 639 H LEU 83 H LEU 83 39.503 29.116 21.770 640 HA LEU 83 HA LEU 83 40.126 29.213 24.595 641 HB2 LEU 83 HB2 LEU 83 38.506 27.628 23.727 642 HB3 LEU 83 HB3 LEU 83 39.671 26.970 22.591 643 HG LEU 83 HG LEU 83 41.021 26.065 24.484 644 HD11 LEU 83 HD11 LEU 83 40.279 27.561 26.295 645 HD12 LEU 83 HD12 LEU 83 38.622 26.931 26.160 646 HD13 LEU 83 HD13 LEU 83 39.945 25.875 26.708 647 HD21 LEU 83 HD21 LEU 83 39.349 24.704 23.250 648 HD22 LEU 83 HD22 LEU 83 39.606 24.179 24.917 649 HD23 LEU 83 HD23 LEU 83 38.145 25.101 24.498 650 H GLU 84 H GLU 84 41.924 27.841 21.797 651 HA GLU 84 HA GLU 84 44.242 26.970 23.224 652 HB2 GLU 84 HB2 GLU 84 43.815 27.874 20.342 653 HB3 GLU 84 HB3 GLU 84 45.353 27.245 20.937 654 HG2 GLU 84 HG2 GLU 84 44.470 25.110 21.404 655 HG3 GLU 84 HG3 GLU 84 42.802 25.630 21.237 656 H ALA 85 H ALA 85 43.376 30.193 21.922 657 HA ALA 85 HA ALA 85 45.923 31.399 22.246 658 HB1 ALA 85 HB1 ALA 85 44.124 32.402 20.902 659 HB2 ALA 85 HB2 ALA 85 43.122 32.626 22.348 660 HB3 ALA 85 HB3 ALA 85 44.633 33.529 22.168 661 H LEU 86 H LEU 86 43.269 30.997 24.613 662 HA LEU 86 HA LEU 86 44.529 32.526 26.747 663 HB2 LEU 86 HB2 LEU 86 42.442 30.294 26.732 664 HB3 LEU 86 HB3 LEU 86 42.978 31.099 28.198 665 HG LEU 86 HG LEU 86 41.600 32.511 25.882 666 HD11 LEU 86 HD11 LEU 86 40.105 30.939 27.018 667 HD12 LEU 86 HD12 LEU 86 40.575 31.598 28.606 668 HD13 LEU 86 HD13 LEU 86 39.685 32.603 27.448 669 HD21 LEU 86 HD21 LEU 86 41.319 34.339 27.569 670 HD22 LEU 86 HD22 LEU 86 42.350 33.443 28.697 671 HD23 LEU 86 HD23 LEU 86 43.013 34.069 27.159 672 H ASP 87 H ASP 87 44.778 29.164 25.630 673 HA ASP 87 HA ASP 87 46.265 28.219 27.904 674 HB2 ASP 87 HB2 ASP 87 45.043 26.806 26.192 675 HB3 ASP 87 HB3 ASP 87 46.388 27.076 25.098 676 H LYS 88 H LYS 88 47.258 29.605 24.779 677 HA LYS 88 HA LYS 88 50.108 29.539 25.356 678 HB2 LYS 88 HB2 LYS 88 48.445 31.012 23.280 679 HB3 LYS 88 HB3 LYS 88 50.163 31.320 23.488 680 HG2 LYS 88 HG2 LYS 88 50.098 29.813 21.768 681 HG3 LYS 88 HG3 LYS 88 50.605 28.843 23.156 682 HD2 LYS 88 HD2 LYS 88 48.287 27.965 23.377 683 HD3 LYS 88 HD3 LYS 88 47.775 29.011 22.038 684 HE2 LYS 88 HE2 LYS 88 49.731 26.689 21.860 685 HE3 LYS 88 HE3 LYS 88 48.049 26.721 21.305 686 HZ1 LYS 88 HZ1 LYS 88 48.728 28.600 19.822 687 HZ2 LYS 88 HZ2 LYS 88 50.316 28.239 20.181 688 HZ3 LYS 88 HZ3 LYS 88 49.362 27.131 19.438 689 H GLU 89 H GLU 89 47.647 31.999 26.121 690 HA GLU 89 HA GLU 89 49.687 33.888 27.085 691 HB2 GLU 89 HB2 GLU 89 46.656 33.802 27.426 692 HB3 GLU 89 HB3 GLU 89 47.684 35.012 28.187 693 HG2 GLU 89 HG2 GLU 89 48.581 35.553 25.847 694 HG3 GLU 89 HG3 GLU 89 47.207 34.637 25.231 695 H GLY 90 H GLY 90 48.700 30.937 28.372 696 HA2 GLY 90 HA2 GLY 90 49.376 30.006 30.408 697 HA3 GLY 90 HA3 GLY 90 49.955 31.588 30.930 698 H LYS 91 H LYS 91 46.747 31.922 29.835 699 HA LYS 91 HA LYS 91 45.805 32.311 32.615 700 HB2 LYS 91 HB2 LYS 91 44.900 33.163 29.835 701 HB3 LYS 91 HB3 LYS 91 43.883 33.336 31.251 702 HG2 LYS 91 HG2 LYS 91 45.802 34.628 32.359 703 HG3 LYS 91 HG3 LYS 91 46.555 34.695 30.758 704 HD2 LYS 91 HD2 LYS 91 43.759 35.711 31.475 705 HD3 LYS 91 HD3 LYS 91 45.197 36.724 31.313 706 HE2 LYS 91 HE2 LYS 91 45.417 36.164 28.951 707 HE3 LYS 91 HE3 LYS 91 44.088 34.999 29.050 708 HZ1 LYS 91 HZ1 LYS 91 42.549 36.750 29.429 709 HZ2 LYS 91 HZ2 LYS 91 43.716 37.872 29.657 710 HZ3 LYS 91 HZ3 LYS 91 43.469 37.234 28.165 711 H LEU 92 H LEU 92 45.432 29.903 30.129 712 HA LEU 92 HA LEU 92 42.797 29.037 31.158 713 HB2 LEU 92 HB2 LEU 92 43.697 28.803 28.730 714 HB3 LEU 92 HB3 LEU 92 44.746 27.536 29.361 715 HG LEU 92 HG LEU 92 42.713 26.326 30.151 716 HD11 LEU 92 HD11 LEU 92 40.517 26.902 29.098 717 HD12 LEU 92 HD12 LEU 92 41.049 28.126 30.253 718 HD13 LEU 92 HD13 LEU 92 41.229 28.417 28.511 719 HD21 LEU 92 HD21 LEU 92 42.074 25.472 27.932 720 HD22 LEU 92 HD22 LEU 92 42.806 26.901 27.171 721 HD23 LEU 92 HD23 LEU 92 43.823 25.730 28.042 722 H ASP 93 H ASP 93 46.134 28.367 31.776 723 HA ASP 93 HA ASP 93 45.686 26.281 33.768 724 HB2 ASP 93 HB2 ASP 93 47.915 28.267 33.162 725 HB3 ASP 93 HB3 ASP 93 47.936 27.241 34.585 726 H GLY 94 H GLY 94 46.105 29.881 33.965 727 HA2 GLY 94 HA2 GLY 94 45.609 30.183 36.706 728 HA3 GLY 94 HA3 GLY 94 45.217 31.390 35.476 729 H LEU 95 H LEU 95 43.207 30.058 34.069 730 HA LEU 95 HA LEU 95 40.911 30.556 35.640 731 HB2 LEU 95 HB2 LEU 95 41.398 29.328 32.926 732 HB3 LEU 95 HB3 LEU 95 39.775 29.364 33.587 733 HG LEU 95 HG LEU 95 41.446 31.897 33.387 734 HD11 LEU 95 HD11 LEU 95 40.247 32.406 31.317 735 HD12 LEU 95 HD12 LEU 95 41.196 30.926 31.127 736 HD13 LEU 95 HD13 LEU 95 39.432 30.830 31.366 737 HD21 LEU 95 HD21 LEU 95 39.241 33.001 33.444 738 HD22 LEU 95 HD22 LEU 95 38.437 31.425 33.599 739 HD23 LEU 95 HD23 LEU 95 39.490 32.033 34.894 740 H LEU 96 H LEU 96 42.647 27.527 35.290 741 HA LEU 96 HA LEU 96 40.671 25.721 36.327 742 HB2 LEU 96 HB2 LEU 96 43.662 25.841 36.891 743 HB3 LEU 96 HB3 LEU 96 42.627 24.507 37.360 744 HG LEU 96 HG LEU 96 42.899 25.291 34.453 745 HD11 LEU 96 HD11 LEU 96 44.502 23.268 36.096 746 HD12 LEU 96 HD12 LEU 96 44.578 23.416 34.335 747 HD13 LEU 96 HD13 LEU 96 45.147 24.741 35.369 748 HD21 LEU 96 HD21 LEU 96 42.084 22.743 35.920 749 HD22 LEU 96 HD22 LEU 96 40.979 23.840 35.079 750 HD23 LEU 96 HD23 LEU 96 42.204 22.924 34.169 751 H SER 97 H SER 97 42.305 28.316 38.009 752 HA SER 97 HA SER 97 41.237 27.420 40.665 753 HB2 SER 97 HB2 SER 97 43.565 29.288 40.118 754 HB3 SER 97 HB3 SER 97 42.947 28.787 41.701 755 HG SER 97 HG SER 97 44.372 27.324 39.760 Start of MODEL 5 1 H1 GLY 1 H1 GLY 1 8.641 33.988 30.949 2 H2 GLY 1 H2 GLY 1 7.760 33.856 32.335 3 H3 GLY 1 H3 GLY 1 7.900 32.565 31.334 4 HA2 GLY 1 HA2 GLY 1 10.151 33.803 32.779 5 HA3 GLY 1 HA3 GLY 1 9.307 32.317 33.278 6 H ALA 2 H ALA 2 11.877 33.551 31.388 7 HA ALA 2 HA ALA 2 12.270 30.882 30.092 8 HB1 ALA 2 HB1 ALA 2 12.471 33.612 28.750 9 HB2 ALA 2 HB2 ALA 2 12.823 32.045 27.994 10 HB3 ALA 2 HB3 ALA 2 11.171 32.425 28.509 11 H MET 3 H MET 3 13.810 33.605 31.698 12 HA MET 3 HA MET 3 16.457 33.185 30.855 13 HB2 MET 3 HB2 MET 3 15.774 35.161 31.988 14 HB3 MET 3 HB3 MET 3 15.378 34.300 33.469 15 HG2 MET 3 HG2 MET 3 18.186 34.257 32.331 16 HG3 MET 3 HG3 MET 3 17.606 35.615 33.292 17 HE1 MET 3 HE1 MET 3 19.799 35.177 34.833 18 HE2 MET 3 HE2 MET 3 20.101 33.631 35.657 19 HE3 MET 3 HE3 MET 3 20.196 33.723 33.888 20 HA PRO 4 HA PRO 4 17.176 30.023 34.403 21 HB2 PRO 4 HB2 PRO 4 14.463 28.744 34.694 22 HB3 PRO 4 HB3 PRO 4 15.718 29.042 35.939 23 HG2 PRO 4 HG2 PRO 4 13.575 30.669 35.781 24 HG3 PRO 4 HG3 PRO 4 15.210 31.395 35.962 25 HD2 PRO 4 HD2 PRO 4 13.639 30.956 33.392 26 HD3 PRO 4 HD3 PRO 4 14.379 32.458 34.006 27 H SER 5 H SER 5 16.903 29.675 31.446 28 HA SER 5 HA SER 5 16.747 26.758 31.071 29 HB2 SER 5 HB2 SER 5 17.300 29.020 29.150 30 HB3 SER 5 HB3 SER 5 17.416 27.324 28.682 31 HG SER 5 HG SER 5 15.325 28.695 28.546 32 H ILE 6 H ILE 6 19.392 28.180 29.362 33 HA ILE 6 HA ILE 6 20.993 26.049 30.475 34 HB ILE 6 HB ILE 6 22.560 26.377 28.929 35 HG12 ILE 6 HG12 ILE 6 21.600 29.151 28.333 36 HG13 ILE 6 HG13 ILE 6 23.158 28.706 28.997 37 HG21 ILE 6 HG21 ILE 6 20.260 25.643 28.256 38 HG22 ILE 6 HG22 ILE 6 20.082 27.223 27.441 39 HG23 ILE 6 HG23 ILE 6 21.377 26.098 26.962 40 HD11 ILE 6 HD11 ILE 6 22.247 27.929 26.172 41 HD12 ILE 6 HD12 ILE 6 23.254 29.333 26.578 42 HD13 ILE 6 HD13 ILE 6 23.839 27.695 26.884 43 H ALA 7 H ALA 7 20.693 29.374 31.078 44 HA ALA 7 HA ALA 7 23.225 30.167 31.983 45 HB1 ALA 7 HB1 ALA 7 21.315 31.692 31.667 46 HB2 ALA 7 HB2 ALA 7 20.501 30.997 33.090 47 HB3 ALA 7 HB3 ALA 7 22.022 31.895 33.278 48 H SER 8 H SER 8 20.758 28.388 33.879 49 HA SER 8 HA SER 8 22.236 28.408 36.348 50 HB2 SER 8 HB2 SER 8 19.940 26.692 35.374 51 HB3 SER 8 HB3 SER 8 20.585 26.690 37.038 52 HG SER 8 HG SER 8 18.949 28.178 37.001 53 H MET 9 H MET 9 22.337 26.228 33.555 54 HA MET 9 HA MET 9 23.727 24.022 34.749 55 HB2 MET 9 HB2 MET 9 24.159 25.078 31.924 56 HB3 MET 9 HB3 MET 9 24.424 23.451 32.515 57 HG2 MET 9 HG2 MET 9 21.998 23.128 32.785 58 HG3 MET 9 HG3 MET 9 21.705 24.785 32.256 59 HE1 MET 9 HE1 MET 9 19.999 23.970 30.312 60 HE2 MET 9 HE2 MET 9 20.388 22.607 29.239 61 HE3 MET 9 HE3 MET 9 20.253 22.351 30.995 62 H ILE 10 H ILE 10 24.840 27.165 33.453 63 HA ILE 10 HA ILE 10 27.596 26.526 33.326 64 HB ILE 10 HB ILE 10 26.675 29.361 33.795 65 HG12 ILE 10 HG12 ILE 10 25.027 28.556 32.200 66 HG13 ILE 10 HG13 ILE 10 26.146 29.656 31.437 67 HG21 ILE 10 HG21 ILE 10 28.440 29.794 32.084 68 HG22 ILE 10 HG22 ILE 10 29.054 28.995 33.538 69 HG23 ILE 10 HG23 ILE 10 28.813 28.051 32.071 70 HD11 ILE 10 HD11 ILE 10 27.307 27.769 30.331 71 HD12 ILE 10 HD12 ILE 10 26.228 26.616 31.147 72 HD13 ILE 10 HD13 ILE 10 25.576 27.762 29.967 73 H LYS 11 H LYS 11 25.676 27.365 36.081 74 HA LYS 11 HA LYS 11 28.035 27.939 37.809 75 HB2 LYS 11 HB2 LYS 11 25.047 27.875 38.432 76 HB3 LYS 11 HB3 LYS 11 26.317 28.243 39.581 77 HG2 LYS 11 HG2 LYS 11 25.595 30.334 39.027 78 HG3 LYS 11 HG3 LYS 11 27.020 30.170 37.995 79 HD2 LYS 11 HD2 LYS 11 25.600 29.752 36.047 80 HD3 LYS 11 HD3 LYS 11 24.157 29.645 37.080 81 HE2 LYS 11 HE2 LYS 11 24.510 32.025 37.734 82 HE3 LYS 11 HE3 LYS 11 25.871 32.123 36.605 83 HZ1 LYS 11 HZ1 LYS 11 23.797 32.916 35.567 84 HZ2 LYS 11 HZ2 LYS 11 24.350 31.585 34.811 85 HZ3 LYS 11 HZ3 LYS 11 23.069 31.469 35.845 86 H GLY 12 H GLY 12 26.368 25.153 36.789 87 HA2 GLY 12 HA2 GLY 12 26.534 23.577 39.214 88 HA3 GLY 12 HA3 GLY 12 26.210 22.999 37.576 89 H ASN 13 H ASN 13 28.728 24.047 36.438 90 HA ASN 13 HA ASN 13 30.836 22.453 37.806 91 HB2 ASN 13 HB2 ASN 13 29.829 22.125 34.944 92 HB3 ASN 13 HB3 ASN 13 31.422 21.577 35.457 93 HD21 ASN 13 HD21 ASN 13 27.973 20.872 35.662 94 HD22 ASN 13 HD22 ASN 13 28.223 19.341 36.510 95 H LYS 14 H LYS 14 32.983 22.839 37.054 96 HA LYS 14 HA LYS 14 33.698 25.596 36.904 97 HB2 LYS 14 HB2 LYS 14 35.105 23.662 37.761 98 HB3 LYS 14 HB3 LYS 14 35.360 23.182 36.094 99 HG2 LYS 14 HG2 LYS 14 37.281 24.379 36.364 100 HG3 LYS 14 HG3 LYS 14 36.238 25.683 35.797 101 HD2 LYS 14 HD2 LYS 14 37.362 26.600 37.645 102 HD3 LYS 14 HD3 LYS 14 35.749 26.167 38.257 103 HE2 LYS 14 HE2 LYS 14 37.050 23.882 38.874 104 HE3 LYS 14 HE3 LYS 14 38.457 24.969 38.810 105 HZ1 LYS 14 HZ1 LYS 14 36.040 25.391 40.477 106 HZ2 LYS 14 HZ2 LYS 14 37.481 24.874 41.061 107 HZ3 LYS 14 HZ3 LYS 14 37.334 26.393 40.426 108 H VAL 15 H VAL 15 33.793 23.123 34.277 109 HA VAL 15 HA VAL 15 33.586 25.341 32.292 110 HB VAL 15 HB VAL 15 35.054 22.724 31.879 111 HG11 VAL 15 HG11 VAL 15 35.838 23.810 29.794 112 HG12 VAL 15 HG12 VAL 15 34.093 23.554 29.790 113 HG13 VAL 15 HG13 VAL 15 34.737 25.171 30.097 114 HG21 VAL 15 HG21 VAL 15 35.981 25.529 32.528 115 HG22 VAL 15 HG22 VAL 15 36.413 24.012 33.335 116 HG23 VAL 15 HG23 VAL 15 37.040 24.373 31.715 117 H VAL 16 H VAL 16 31.992 25.303 30.865 118 HA VAL 16 HA VAL 16 30.401 22.809 30.531 119 HB VAL 16 HB VAL 16 29.188 25.558 30.880 120 HG11 VAL 16 HG11 VAL 16 27.868 24.202 29.299 121 HG12 VAL 16 HG12 VAL 16 27.918 22.819 30.420 122 HG13 VAL 16 HG13 VAL 16 27.036 24.295 30.854 123 HG21 VAL 16 HG21 VAL 16 29.224 23.069 32.650 124 HG22 VAL 16 HG22 VAL 16 29.879 24.674 33.050 125 HG23 VAL 16 HG23 VAL 16 28.135 24.438 32.900 126 H VAL 17 H VAL 17 29.963 22.250 28.444 127 HA VAL 17 HA VAL 17 30.565 24.232 26.282 128 HB VAL 17 HB VAL 17 31.586 21.373 26.525 129 HG11 VAL 17 HG11 VAL 17 31.769 23.215 24.102 130 HG12 VAL 17 HG12 VAL 17 32.646 21.685 24.321 131 HG13 VAL 17 HG13 VAL 17 30.898 21.665 24.181 132 HG21 VAL 17 HG21 VAL 17 32.949 23.046 27.663 133 HG22 VAL 17 HG22 VAL 17 33.755 22.517 26.181 134 HG23 VAL 17 HG23 VAL 17 32.926 24.080 26.216 135 H PHE 18 H PHE 18 29.435 24.139 24.394 136 HA PHE 18 HA PHE 18 27.208 22.140 24.195 137 HB2 PHE 18 HB2 PHE 18 27.121 25.023 23.267 138 HB3 PHE 18 HB3 PHE 18 25.851 23.829 23.089 139 HD1 PHE 18 HD2 PHE 18 27.604 26.072 25.460 140 HD2 PHE 18 HD1 PHE 18 24.420 23.201 24.992 141 HE1 PHE 18 HE2 PHE 18 26.613 26.806 27.617 142 HE2 PHE 18 HE1 PHE 18 23.428 23.957 27.144 143 HZ PHE 18 HZ PHE 18 24.508 25.809 28.426 144 H SER 19 H SER 19 27.487 20.814 22.504 145 HA SER 19 HA SER 19 28.955 21.717 20.057 146 HB2 SER 19 HB2 SER 19 29.462 19.036 21.391 147 HB3 SER 19 HB3 SER 19 30.246 19.704 19.989 148 HG SER 19 HG SER 19 31.339 19.809 22.106 149 H TRP 20 H TRP 20 28.926 20.044 18.320 150 HA TRP 20 HA TRP 20 26.478 18.346 18.168 151 HB2 TRP 20 HB2 TRP 20 27.791 20.013 15.987 152 HB3 TRP 20 HB3 TRP 20 26.875 18.567 15.626 153 HD1 TRP 20 HD1 TRP 20 24.869 20.007 18.223 154 HE1 TRP 20 HE1 TRP 20 22.860 21.306 17.221 155 HE3 TRP 20 HE3 TRP 20 26.518 20.533 13.405 156 HZ2 TRP 20 HZ2 TRP 20 22.056 22.330 14.693 157 HZ3 TRP 20 HZ3 TRP 20 25.078 21.627 11.703 158 HH2 TRP 20 HH2 TRP 20 22.845 22.519 12.327 159 H VAL 21 H VAL 21 27.018 16.247 17.991 160 HA VAL 21 HA VAL 21 29.791 15.462 17.319 161 HB VAL 21 HB VAL 21 28.993 13.115 17.883 162 HG11 VAL 21 HG11 VAL 21 30.587 14.396 19.214 163 HG12 VAL 21 HG12 VAL 21 29.262 15.256 20.026 164 HG13 VAL 21 HG13 VAL 21 29.481 13.509 20.273 165 HG21 VAL 21 HG21 VAL 21 27.222 12.903 19.521 166 HG22 VAL 21 HG22 VAL 21 26.867 14.638 19.460 167 HG23 VAL 21 HG23 VAL 21 26.537 13.598 18.050 168 H THR 22 H THR 22 28.972 14.178 14.068 169 HA THR 22 HA THR 22 31.095 15.206 15.881 170 HB THR 22 HB THR 22 32.605 14.599 13.996 171 HG1 THR 22 HG1 THR 22 31.921 13.566 12.352 172 HG21 THR 22 HG21 THR 22 32.618 12.194 14.532 173 HG22 THR 22 HG22 THR 22 31.006 12.339 15.272 174 HG23 THR 22 HG23 THR 22 32.399 13.181 15.983 175 H CYS 23 H CYS 23 32.229 17.016 15.436 176 HA CYS 23 HA CYS 23 31.522 18.671 13.088 177 HB2 CYS 23 HB2 CYS 23 30.024 19.509 14.812 178 HB3 CYS 23 HB3 CYS 23 31.337 19.561 15.987 179 HG CYS 23 HG CYS 23 30.739 21.405 13.312 180 HA PRO 24 HA PRO 24 35.879 18.436 13.077 181 HB2 PRO 24 HB2 PRO 24 35.912 21.122 11.686 182 HB3 PRO 24 HB3 PRO 24 36.761 19.610 11.232 183 HG2 PRO 24 HG2 PRO 24 34.493 20.331 9.939 184 HG3 PRO 24 HG3 PRO 24 34.728 18.625 10.434 185 HD2 PRO 24 HD2 PRO 24 33.101 20.777 11.806 186 HD3 PRO 24 HD3 PRO 24 32.683 19.073 11.469 187 H TYR 25 H TYR 25 34.544 21.331 14.472 188 HA TYR 25 HA TYR 25 36.999 22.014 15.960 189 HB2 TYR 25 HB2 TYR 25 34.145 23.054 16.041 190 HB3 TYR 25 HB3 TYR 25 35.517 23.774 16.868 191 HD1 TYR 25 HD2 TYR 25 37.705 23.724 14.861 192 HD2 TYR 25 HD1 TYR 25 33.499 24.584 14.319 193 HE1 TYR 25 HE2 TYR 25 38.221 25.042 12.823 194 HE2 TYR 25 HE1 TYR 25 34.039 25.862 12.249 195 HH TYR 25 HH TYR 25 37.389 26.129 11.000 196 H CYS 26 H CYS 26 34.028 20.332 16.602 197 HA CYS 26 HA CYS 26 33.967 20.473 19.463 198 HB2 CYS 26 HB2 CYS 26 32.066 19.900 18.233 199 HB3 CYS 26 HB3 CYS 26 32.827 18.560 17.393 200 HG CYS 26 HG CYS 26 32.371 18.575 20.690 201 H VAL 27 H VAL 27 35.379 17.992 17.320 202 HA VAL 27 HA VAL 27 36.613 16.291 19.149 203 HB VAL 27 HB VAL 27 36.520 16.171 16.812 204 HG11 VAL 27 HG11 VAL 27 37.750 16.937 15.158 205 HG12 VAL 27 HG12 VAL 27 37.100 18.285 16.102 206 HG13 VAL 27 HG13 VAL 27 38.838 17.810 16.249 207 HG21 VAL 27 HG21 VAL 27 38.610 14.899 16.450 208 HG22 VAL 27 HG22 VAL 27 39.405 15.837 17.734 209 HG23 VAL 27 HG23 VAL 27 38.107 14.698 18.140 210 H ARG 28 H ARG 28 37.980 18.821 17.565 211 HA ARG 28 HA ARG 28 40.467 19.102 18.846 212 HB2 ARG 28 HB2 ARG 28 38.970 21.580 17.848 213 HB3 ARG 28 HB3 ARG 28 40.687 21.450 18.206 214 HG2 ARG 28 HG2 ARG 28 40.575 19.527 16.362 215 HG3 ARG 28 HG3 ARG 28 39.113 20.424 15.898 216 HD2 ARG 28 HD2 ARG 28 40.940 21.254 14.566 217 HD3 ARG 28 HD3 ARG 28 40.431 22.503 15.707 218 HE ARG 28 HE ARG 28 42.788 20.688 16.157 219 HH11 ARG 28 HH12 ARG 28 41.642 24.059 16.376 220 HH12 ARG 28 HH11 ARG 28 42.953 24.383 17.524 221 HH21 ARG 28 HH22 ARG 28 44.238 21.252 17.511 222 HH22 ARG 28 HH21 ARG 28 44.259 22.868 18.215 223 H ALA 29 H ALA 29 37.633 21.026 19.806 224 HA ALA 29 HA ALA 29 38.966 22.204 22.077 225 HB1 ALA 29 HB1 ALA 29 37.021 23.286 21.058 226 HB2 ALA 29 HB2 ALA 29 35.989 21.909 21.516 227 HB3 ALA 29 HB3 ALA 29 36.727 22.925 22.780 228 H GLU 30 H GLU 30 36.587 19.444 21.929 229 HA GLU 30 HA GLU 30 36.672 19.069 24.789 230 HB2 GLU 30 HB2 GLU 30 35.756 17.209 22.565 231 HB3 GLU 30 HB3 GLU 30 35.514 16.937 24.301 232 HG2 GLU 30 HG2 GLU 30 34.212 19.012 24.503 233 HG3 GLU 30 HG3 GLU 30 34.482 19.394 22.799 234 H LYS 31 H LYS 31 38.665 17.753 22.238 235 HA LYS 31 HA LYS 31 40.065 15.891 23.875 236 HB2 LYS 31 HB2 LYS 31 40.163 15.888 21.413 237 HB3 LYS 31 HB3 LYS 31 40.823 17.523 21.418 238 HG2 LYS 31 HG2 LYS 31 42.919 16.542 22.543 239 HG3 LYS 31 HG3 LYS 31 42.216 14.950 22.222 240 HD2 LYS 31 HD2 LYS 31 43.666 15.418 20.363 241 HD3 LYS 31 HD3 LYS 31 42.026 15.625 19.778 242 HE2 LYS 31 HE2 LYS 31 43.215 17.460 18.881 243 HE3 LYS 31 HE3 LYS 31 42.293 18.156 20.210 244 HZ1 LYS 31 HZ1 LYS 31 45.153 17.378 20.395 245 HZ2 LYS 31 HZ2 LYS 31 44.579 18.926 20.217 246 HZ3 LYS 31 HZ3 LYS 31 44.284 18.088 21.578 247 H LEU 32 H LEU 32 40.765 19.298 23.096 248 HA LEU 32 HA LEU 32 43.135 19.639 24.635 249 HB2 LEU 32 HB2 LEU 32 42.017 21.046 22.789 250 HB3 LEU 32 HB3 LEU 32 41.011 21.689 24.081 251 HG LEU 32 HG LEU 32 42.731 23.206 23.456 252 HD11 LEU 32 HD11 LEU 32 43.589 22.171 26.161 253 HD12 LEU 32 HD12 LEU 32 43.740 23.811 25.521 254 HD13 LEU 32 HD13 LEU 32 42.130 23.154 25.876 255 HD21 LEU 32 HD21 LEU 32 44.826 21.165 24.259 256 HD22 LEU 32 HD22 LEU 32 44.382 21.578 22.596 257 HD23 LEU 32 HD23 LEU 32 45.099 22.815 23.630 258 H LEU 33 H LEU 33 39.694 20.194 25.506 259 HA LEU 33 HA LEU 33 40.213 21.275 28.090 260 HB2 LEU 33 HB2 LEU 33 37.776 19.782 26.985 261 HB3 LEU 33 HB3 LEU 33 37.768 20.644 28.519 262 HG LEU 33 HG LEU 33 38.273 21.959 25.824 263 HD11 LEU 33 HD11 LEU 33 35.969 21.165 26.034 264 HD12 LEU 33 HD12 LEU 33 35.792 22.246 27.446 265 HD13 LEU 33 HD13 LEU 33 36.162 22.912 25.854 266 HD21 LEU 33 HD21 LEU 33 39.333 23.253 27.614 267 HD22 LEU 33 HD22 LEU 33 37.864 24.082 27.089 268 HD23 LEU 33 HD23 LEU 33 37.840 23.141 28.586 269 H HIS 34 H HIS 34 39.489 17.879 27.194 270 HA HIS 34 HA HIS 34 40.007 16.865 29.854 271 HB2 HIS 34 HB2 HIS 34 39.796 15.617 27.100 272 HB3 HIS 34 HB3 HIS 34 40.260 14.679 28.517 273 HD1 HIS 34 HD1 HIS 34 38.414 14.635 30.573 274 HD2 HIS 34 HD2 HIS 34 37.140 16.027 26.820 275 HE1 HIS 34 HE1 HIS 34 35.858 14.514 30.586 276 H ALA 35 H ALA 35 42.177 17.567 27.058 277 HA ALA 35 HA ALA 35 44.408 16.129 28.216 278 HB1 ALA 35 HB1 ALA 35 44.339 18.274 26.064 279 HB2 ALA 35 HB2 ALA 35 45.703 17.200 26.429 280 HB3 ALA 35 HB3 ALA 35 44.194 16.519 25.809 281 H ARG 36 H ARG 36 43.131 19.288 28.849 282 HA ARG 36 HA ARG 36 45.574 20.107 30.395 283 HB2 ARG 36 HB2 ARG 36 43.405 21.561 28.900 284 HB3 ARG 36 HB3 ARG 36 44.141 22.343 30.275 285 HG2 ARG 36 HG2 ARG 36 45.122 23.032 28.191 286 HG3 ARG 36 HG3 ARG 36 46.275 22.429 29.385 287 HD2 ARG 36 HD2 ARG 36 46.693 20.450 28.154 288 HD3 ARG 36 HD3 ARG 36 45.277 20.701 27.105 289 HE ARG 36 HE ARG 36 46.912 22.986 26.824 290 HH11 ARG 36 HH22 ARG 36 47.515 19.610 26.009 291 HH12 ARG 36 HH21 ARG 36 47.728 20.039 24.314 292 HH21 ARG 36 HH12 ARG 36 47.621 23.440 24.965 293 HH22 ARG 36 HH11 ARG 36 48.107 22.234 23.782 294 H THR 37 H THR 37 42.920 18.502 31.184 295 HA THR 37 HA THR 37 42.010 17.927 33.198 296 HB THR 37 HB THR 37 43.345 20.096 34.736 297 HG1 THR 37 HG1 THR 37 45.269 19.367 34.339 298 HG21 THR 37 HG21 THR 37 43.729 18.241 36.398 299 HG22 THR 37 HG22 THR 37 42.876 17.135 35.305 300 HG23 THR 37 HG23 THR 37 42.020 18.490 36.043 301 H LYS 38 H LYS 38 40.808 20.086 31.456 302 HA LYS 38 HA LYS 38 39.599 21.979 33.422 303 HB2 LYS 38 HB2 LYS 38 38.829 21.270 30.559 304 HB3 LYS 38 HB3 LYS 38 37.947 22.337 31.604 305 HG2 LYS 38 HG2 LYS 38 40.318 22.840 29.931 306 HG3 LYS 38 HG3 LYS 38 39.042 23.914 30.432 307 HD2 LYS 38 HD2 LYS 38 40.843 24.963 31.326 308 HD3 LYS 38 HD3 LYS 38 40.346 24.028 32.726 309 HE2 LYS 38 HE2 LYS 38 42.056 22.366 32.312 310 HE3 LYS 38 HE3 LYS 38 42.316 22.943 30.676 311 HZ1 LYS 38 HZ1 LYS 38 43.753 24.536 31.398 312 HZ2 LYS 38 HZ2 LYS 38 42.960 24.863 32.788 313 HZ3 LYS 38 HZ3 LYS 38 43.950 23.552 32.652 314 H ASP 39 H ASP 39 38.452 20.982 34.969 315 HA ASP 39 HA ASP 39 36.774 18.762 34.607 316 HB2 ASP 39 HB2 ASP 39 37.311 19.693 36.829 317 HB3 ASP 39 HB3 ASP 39 36.342 21.119 36.480 318 H ILE 40 H ILE 40 35.593 18.594 32.947 319 HA ILE 40 HA ILE 40 33.925 20.828 31.979 320 HB ILE 40 HB ILE 40 35.996 20.289 30.784 321 HG12 ILE 40 HG12 ILE 40 33.433 20.817 29.657 322 HG13 ILE 40 HG13 ILE 40 35.027 21.378 29.217 323 HG21 ILE 40 HG21 ILE 40 36.299 18.309 29.442 324 HG22 ILE 40 HG22 ILE 40 36.050 17.841 31.112 325 HG23 ILE 40 HG23 ILE 40 34.729 17.656 29.951 326 HD11 ILE 40 HD11 ILE 40 33.765 18.822 28.150 327 HD12 ILE 40 HD12 ILE 40 33.852 20.374 27.309 328 HD13 ILE 40 HD13 ILE 40 35.347 19.510 27.672 329 H THR 41 H THR 41 31.904 20.650 31.575 330 HA THR 41 HA THR 41 30.531 17.991 31.292 331 HB THR 41 HB THR 41 29.758 20.555 32.697 332 HG1 THR 41 HG1 THR 41 30.704 18.826 33.832 333 HG21 THR 41 HG21 THR 41 27.459 19.625 32.954 334 HG22 THR 41 HG22 THR 41 27.827 18.425 31.695 335 HG23 THR 41 HG23 THR 41 27.802 20.160 31.306 336 H VAL 42 H VAL 42 29.786 17.663 29.242 337 HA VAL 42 HA VAL 42 29.121 20.066 27.640 338 HB VAL 42 HB VAL 42 31.048 19.485 26.743 339 HG11 VAL 42 HG11 VAL 42 31.890 17.451 25.993 340 HG12 VAL 42 HG12 VAL 42 31.649 17.523 27.727 341 HG13 VAL 42 HG13 VAL 42 30.494 16.578 26.718 342 HG21 VAL 42 HG21 VAL 42 29.111 18.023 24.928 343 HG22 VAL 42 HG22 VAL 42 29.329 19.789 24.984 344 HG23 VAL 42 HG23 VAL 42 30.654 18.756 24.465 345 H HIS 43 H HIS 43 27.518 20.219 26.377 346 HA HIS 43 HA HIS 43 25.400 18.131 26.469 347 HB2 HIS 43 HB2 HIS 43 25.039 20.320 27.674 348 HB3 HIS 43 HB3 HIS 43 25.123 21.137 26.136 349 HD1 HIS 43 HD1 HIS 43 22.665 19.560 28.397 350 HD2 HIS 43 HD2 HIS 43 23.187 19.868 24.235 351 HE1 HIS 43 HE1 HIS 43 20.496 18.834 27.352 352 H TYR 44 H TYR 44 24.826 17.208 24.601 353 HA TYR 44 HA TYR 44 25.824 18.339 22.043 354 HB2 TYR 44 HB2 TYR 44 24.826 15.586 22.774 355 HB3 TYR 44 HB3 TYR 44 25.438 16.056 21.191 356 HD1 TYR 44 HD2 TYR 44 27.855 17.424 21.419 357 HD2 TYR 44 HD1 TYR 44 26.334 14.371 24.069 358 HE1 TYR 44 HE2 TYR 44 30.159 16.994 22.229 359 HE2 TYR 44 HE1 TYR 44 28.636 13.938 24.880 360 HH TYR 44 HH TYR 44 31.479 15.810 23.749 361 H VAL 45 H VAL 45 24.476 19.695 21.079 362 HA VAL 45 HA VAL 45 21.673 19.669 21.915 363 HB VAL 45 HB VAL 45 21.524 21.911 20.882 364 HG11 VAL 45 HG11 VAL 45 23.791 21.592 22.876 365 HG12 VAL 45 HG12 VAL 45 22.830 23.053 22.570 366 HG13 VAL 45 HG13 VAL 45 22.043 21.632 23.256 367 HG21 VAL 45 HG21 VAL 45 23.608 23.096 20.291 368 HG22 VAL 45 HG22 VAL 45 24.536 21.603 20.448 369 HG23 VAL 45 HG23 VAL 45 23.295 21.758 19.186 370 H ASP 46 H ASP 46 22.970 18.201 19.172 371 HA ASP 46 HA ASP 46 20.373 18.562 17.733 372 HB2 ASP 46 HB2 ASP 46 22.690 18.663 16.569 373 HB3 ASP 46 HB3 ASP 46 22.682 16.914 16.728 374 H LYS 47 H LYS 47 21.575 16.651 20.181 375 HA LYS 47 HA LYS 47 20.288 14.086 19.492 376 HB2 LYS 47 HB2 LYS 47 21.346 15.080 22.164 377 HB3 LYS 47 HB3 LYS 47 21.016 13.413 21.734 378 HG2 LYS 47 HG2 LYS 47 23.174 15.139 20.455 379 HG3 LYS 47 HG3 LYS 47 23.397 14.093 21.830 380 HD2 LYS 47 HD2 LYS 47 22.500 13.094 19.092 381 HD3 LYS 47 HD3 LYS 47 24.186 13.164 19.616 382 HE2 LYS 47 HE2 LYS 47 23.688 11.648 21.518 383 HE3 LYS 47 HE3 LYS 47 21.996 11.564 20.994 384 HZ1 LYS 47 HZ1 LYS 47 22.907 10.717 18.816 385 HZ2 LYS 47 HZ2 LYS 47 24.358 10.520 19.530 386 HZ3 LYS 47 HZ3 LYS 47 23.049 9.681 20.072 387 H MET 48 H MET 48 19.302 16.998 21.034 388 HA MET 48 HA MET 48 16.598 15.883 21.380 389 HB2 MET 48 HB2 MET 48 16.294 16.371 23.626 390 HB3 MET 48 HB3 MET 48 17.899 15.664 23.580 391 HG2 MET 48 HG2 MET 48 18.839 18.034 23.548 392 HG3 MET 48 HG3 MET 48 17.185 18.609 23.805 393 HE1 MET 48 HE1 MET 48 18.715 19.884 25.548 394 HE2 MET 48 HE2 MET 48 17.103 19.708 26.288 395 HE3 MET 48 HE3 MET 48 18.530 19.411 27.252 396 H SER 49 H SER 49 14.871 17.312 21.439 397 HA SER 49 HA SER 49 15.054 19.403 19.531 398 HB2 SER 49 HB2 SER 49 12.857 18.649 21.469 399 HB3 SER 49 HB3 SER 49 12.649 19.667 20.021 400 HG SER 49 HG SER 49 12.408 17.119 20.035 401 H GLU 50 H GLU 50 14.852 19.598 23.068 402 HA GLU 50 HA GLU 50 14.660 22.438 23.293 403 HB2 GLU 50 HB2 GLU 50 15.540 20.134 24.974 404 HB3 GLU 50 HB3 GLU 50 16.119 21.736 25.485 405 HG2 GLU 50 HG2 GLU 50 13.765 22.524 25.584 406 HG3 GLU 50 HG3 GLU 50 13.208 20.914 25.102 407 H GLY 51 H GLY 51 17.428 20.506 22.204 408 HA2 GLY 51 HA2 GLY 51 19.598 22.166 22.908 409 HA3 GLY 51 HA3 GLY 51 19.451 21.143 21.484 410 H GLU 52 H GLU 52 17.094 22.633 20.455 411 HA GLU 52 HA GLU 52 18.438 24.794 19.017 412 HB2 GLU 52 HB2 GLU 52 15.512 23.949 19.177 413 HB3 GLU 52 HB3 GLU 52 16.191 25.114 18.031 414 HG2 GLU 52 HG2 GLU 52 17.572 23.405 16.996 415 HG3 GLU 52 HG3 GLU 52 17.123 22.210 18.213 416 H GLN 53 H GLN 53 16.277 24.581 21.823 417 HA GLN 53 HA GLN 53 15.844 27.466 22.075 418 HB2 GLN 53 HB2 GLN 53 15.357 25.167 24.028 419 HB3 GLN 53 HB3 GLN 53 14.864 26.835 24.253 420 HG2 GLN 53 HG2 GLN 53 13.521 26.659 22.100 421 HG3 GLN 53 HG3 GLN 53 13.909 24.934 22.055 422 HE21 GLN 53 HE21 GLN 53 12.482 27.434 24.177 423 HE22 GLN 53 HE22 GLN 53 11.305 26.342 24.935 424 H LEU 54 H LEU 54 18.037 25.024 23.482 425 HA LEU 54 HA LEU 54 19.500 26.828 25.194 426 HB2 LEU 54 HB2 LEU 54 20.351 24.236 23.858 427 HB3 LEU 54 HB3 LEU 54 21.310 25.086 25.014 428 HG LEU 54 HG LEU 54 20.400 24.103 26.731 429 HD11 LEU 54 HD11 LEU 54 18.127 23.977 27.414 430 HD12 LEU 54 HD12 LEU 54 18.393 25.591 26.761 431 HD13 LEU 54 HD13 LEU 54 17.540 24.370 25.787 432 HD21 LEU 54 HD21 LEU 54 18.787 22.362 24.947 433 HD22 LEU 54 HD22 LEU 54 20.541 22.206 25.240 434 HD23 LEU 54 HD23 LEU 54 19.392 22.037 26.574 435 H ARG 55 H ARG 55 20.064 25.831 21.759 436 HA ARG 55 HA ARG 55 22.307 27.551 21.272 437 HB2 ARG 55 HB2 ARG 55 20.106 26.447 19.491 438 HB3 ARG 55 HB3 ARG 55 21.364 27.513 18.857 439 HG2 ARG 55 HG2 ARG 55 23.105 25.992 19.344 440 HG3 ARG 55 HG3 ARG 55 22.108 25.028 20.423 441 HD2 ARG 55 HD2 ARG 55 22.505 23.864 18.299 442 HD3 ARG 55 HD3 ARG 55 20.799 24.175 18.577 443 HE ARG 55 HE ARG 55 20.732 25.708 16.811 444 HH11 ARG 55 HH22 ARG 55 24.104 24.515 16.980 445 HH12 ARG 55 HH21 ARG 55 24.254 24.799 15.258 446 HH21 ARG 55 HH12 ARG 55 21.222 26.133 14.706 447 HH22 ARG 55 HH11 ARG 55 22.822 25.722 14.122 448 H GLY 56 H GLY 56 18.814 28.322 21.128 449 HA2 GLY 56 HA2 GLY 56 19.060 31.071 20.407 450 HA3 GLY 56 HA3 GLY 56 17.753 30.358 21.359 451 H GLU 57 H GLU 57 19.396 29.549 23.666 452 HA GLU 57 HA GLU 57 19.618 32.075 25.105 453 HB2 GLU 57 HB2 GLU 57 20.509 29.282 25.796 454 HB3 GLU 57 HB3 GLU 57 20.717 30.679 26.841 455 HG2 GLU 57 HG2 GLU 57 18.076 29.468 25.931 456 HG3 GLU 57 HG3 GLU 57 18.819 29.426 27.511 457 H ILE 58 H ILE 58 22.045 29.989 23.457 458 HA ILE 58 HA ILE 58 24.304 31.647 24.251 459 HB ILE 58 HB ILE 58 24.078 29.882 21.786 460 HG12 ILE 58 HG12 ILE 58 25.194 29.056 24.509 461 HG13 ILE 58 HG13 ILE 58 23.577 28.639 23.970 462 HG21 ILE 58 HG21 ILE 58 26.031 31.504 21.890 463 HG22 ILE 58 HG22 ILE 58 26.552 30.708 23.386 464 HG23 ILE 58 HG23 ILE 58 26.508 29.817 21.847 465 HD11 ILE 58 HD11 ILE 58 24.513 27.448 21.999 466 HD12 ILE 58 HD12 ILE 58 26.141 27.724 22.650 467 HD13 ILE 58 HD13 ILE 58 24.972 26.758 23.564 468 H TYR 59 H TYR 59 22.169 31.569 21.364 469 HA TYR 59 HA TYR 59 23.525 33.553 19.941 470 HB2 TYR 59 HB2 TYR 59 21.598 31.863 19.282 471 HB3 TYR 59 HB3 TYR 59 20.547 33.237 19.594 472 HD1 TYR 59 HD2 TYR 59 20.852 35.361 18.179 473 HD2 TYR 59 HD1 TYR 59 23.096 31.748 17.495 474 HE1 TYR 59 HE2 TYR 59 21.513 36.188 15.911 475 HE2 TYR 59 HE1 TYR 59 23.810 32.574 15.277 476 HH TYR 59 HH TYR 59 22.674 35.730 13.951 477 H GLN 60 H GLN 60 20.753 34.007 22.163 478 HA GLN 60 HA GLN 60 20.261 36.714 21.579 479 HB2 GLN 60 HB2 GLN 60 19.936 34.965 24.041 480 HB3 GLN 60 HB3 GLN 60 19.463 36.665 24.114 481 HG2 GLN 60 HG2 GLN 60 17.772 36.374 22.454 482 HG3 GLN 60 HG3 GLN 60 18.362 34.768 22.010 483 HE21 GLN 60 HE21 GLN 60 18.205 33.065 23.663 484 HE22 GLN 60 HE22 GLN 60 16.982 33.163 24.942 485 H ALA 61 H ALA 61 22.620 35.368 23.926 486 HA ALA 61 HA ALA 61 23.523 38.034 24.749 487 HB1 ALA 61 HB1 ALA 61 23.385 36.234 26.368 488 HB2 ALA 61 HB2 ALA 61 24.491 35.231 25.410 489 HB3 ALA 61 HB3 ALA 61 25.074 36.730 26.173 490 H TYR 62 H TYR 62 24.893 35.410 22.686 491 HA TYR 62 HA TYR 62 27.323 37.102 22.273 492 HB2 TYR 62 HB2 TYR 62 27.084 34.098 22.032 493 HB3 TYR 62 HB3 TYR 62 28.555 35.067 22.099 494 HD1 TYR 62 HD1 TYR 62 28.712 36.667 24.278 495 HD2 TYR 62 HD2 TYR 62 26.386 33.050 24.011 496 HE1 TYR 62 HE1 TYR 62 28.533 36.598 26.753 497 HE2 TYR 62 HE2 TYR 62 26.189 32.992 26.493 498 HH TYR 62 HH TYR 62 27.528 35.628 28.501 499 H LYS 63 H LYS 63 24.644 36.121 20.516 500 HA LYS 63 HA LYS 63 24.102 35.765 18.392 501 HB2 LYS 63 HB2 LYS 63 26.320 37.725 17.716 502 HB3 LYS 63 HB3 LYS 63 24.899 37.373 16.733 503 HG2 LYS 63 HG2 LYS 63 24.825 38.612 19.518 504 HG3 LYS 63 HG3 LYS 63 24.788 39.525 18.025 505 HD2 LYS 63 HD2 LYS 63 22.607 38.958 17.519 506 HD3 LYS 63 HD3 LYS 63 22.674 37.407 18.339 507 HE2 LYS 63 HE2 LYS 63 21.185 39.010 19.477 508 HE3 LYS 63 HE3 LYS 63 22.480 38.404 20.516 509 HZ1 LYS 63 HZ1 LYS 63 22.655 41.002 19.099 510 HZ2 LYS 63 HZ2 LYS 63 22.103 40.851 20.654 511 HZ3 LYS 63 HZ3 LYS 63 23.633 40.435 20.314 512 H HIS 64 H HIS 64 25.699 33.822 19.390 513 HA HIS 64 HA HIS 64 26.637 32.522 16.897 514 HB2 HIS 64 HB2 HIS 64 28.011 32.397 19.620 515 HB3 HIS 64 HB3 HIS 64 28.303 31.260 18.308 516 HD1 HIS 64 HD1 HIS 64 29.497 32.302 16.049 517 HD2 HIS 64 HD2 HIS 64 29.410 34.643 19.552 518 HE1 HIS 64 HE1 HIS 64 31.307 34.095 15.779 519 H GLU 65 H GLU 65 26.140 30.280 16.866 520 HA GLU 65 HA GLU 65 24.199 29.343 18.956 521 HB2 GLU 65 HB2 GLU 65 23.453 27.858 16.917 522 HB3 GLU 65 HB3 GLU 65 22.831 29.478 17.186 523 HG2 GLU 65 HG2 GLU 65 23.250 29.028 14.844 524 HG3 GLU 65 HG3 GLU 65 24.099 30.434 15.444 525 H THR 66 H THR 66 26.815 28.268 16.753 526 HA THR 66 HA THR 66 27.853 26.517 18.885 527 HB THR 66 HB THR 66 26.958 25.284 16.265 528 HG1 THR 66 HG1 THR 66 25.711 25.663 18.560 529 HG21 THR 66 HG21 THR 66 27.599 23.125 17.319 530 HG22 THR 66 HG22 THR 66 28.315 24.007 18.683 531 HG23 THR 66 HG23 THR 66 29.003 24.157 17.039 532 H VAL 67 H VAL 67 29.990 26.133 18.644 533 HA VAL 67 HA VAL 67 31.455 26.916 16.233 534 HB VAL 67 HB VAL 67 32.794 28.216 18.457 535 HG11 VAL 67 HG11 VAL 67 32.848 30.086 16.895 536 HG12 VAL 67 HG12 VAL 67 33.237 28.572 16.070 537 HG13 VAL 67 HG13 VAL 67 31.628 29.296 15.871 538 HG21 VAL 67 HG21 VAL 67 31.378 30.143 18.810 539 HG22 VAL 67 HG22 VAL 67 30.076 29.432 17.845 540 HG23 VAL 67 HG23 VAL 67 30.553 28.700 19.404 541 HA PRO 68 HA PRO 68 30.448 24.806 19.441 542 HB2 PRO 68 HB2 PRO 68 31.527 23.701 21.651 543 HB3 PRO 68 HB3 PRO 68 31.335 22.792 20.123 544 HG2 PRO 68 HG2 PRO 68 33.818 24.231 21.125 545 HG3 PRO 68 HG3 PRO 68 33.676 22.526 20.579 546 HD2 PRO 68 HD2 PRO 68 34.501 24.465 18.889 547 HD3 PRO 68 HD3 PRO 68 33.400 23.177 18.320 548 H ALA 69 H ALA 69 29.826 25.536 21.687 549 HA ALA 69 HA ALA 69 31.069 28.184 22.330 550 HB1 ALA 69 HB1 ALA 69 28.368 27.000 23.070 551 HB2 ALA 69 HB2 ALA 69 28.958 28.597 23.556 552 HB3 ALA 69 HB3 ALA 69 28.665 28.250 21.838 553 H ILE 70 H ILE 70 32.076 28.514 24.284 554 HA ILE 70 HA ILE 70 32.163 26.263 26.245 555 HB ILE 70 HB ILE 70 34.507 27.983 25.356 556 HG12 ILE 70 HG12 ILE 70 35.225 25.412 24.646 557 HG13 ILE 70 HG13 ILE 70 33.524 25.401 24.233 558 HG21 ILE 70 HG21 ILE 70 34.765 27.247 27.653 559 HG22 ILE 70 HG22 ILE 70 34.389 25.571 27.207 560 HG23 ILE 70 HG23 ILE 70 35.877 26.350 26.632 561 HD11 ILE 70 HD11 ILE 70 35.624 27.406 23.265 562 HD12 ILE 70 HD12 ILE 70 34.888 26.107 22.310 563 HD13 ILE 70 HD13 ILE 70 33.904 27.483 22.844 564 H PHE 71 H PHE 71 32.040 26.813 28.351 565 HA PHE 71 HA PHE 71 32.234 29.695 29.119 566 HB2 PHE 71 HB2 PHE 71 30.195 27.644 30.036 567 HB3 PHE 71 HB3 PHE 71 30.391 29.269 30.693 568 HD1 PHE 71 HD2 PHE 71 29.471 27.373 27.594 569 HD2 PHE 71 HD1 PHE 71 29.289 31.138 29.693 570 HE1 PHE 71 HE2 PHE 71 27.883 28.254 25.896 571 HE2 PHE 71 HE1 PHE 71 27.652 31.976 28.040 572 HZ PHE 71 HZ PHE 71 26.944 30.518 26.128 573 H ILE 72 H ILE 72 33.451 30.078 30.929 574 HA ILE 72 HA ILE 72 34.206 27.794 32.701 575 HB ILE 72 HB ILE 72 36.159 29.904 31.692 576 HG12 ILE 72 HG12 ILE 72 35.783 27.005 30.841 577 HG13 ILE 72 HG13 ILE 72 35.635 28.438 29.837 578 HG21 ILE 72 HG21 ILE 72 36.442 27.448 33.507 579 HG22 ILE 72 HG22 ILE 72 37.819 28.365 32.878 580 HG23 ILE 72 HG23 ILE 72 36.673 29.138 33.956 581 HD11 ILE 72 HD11 ILE 72 38.096 28.867 30.179 582 HD12 ILE 72 HD12 ILE 72 38.192 27.265 30.961 583 HD13 ILE 72 HD13 ILE 72 37.688 27.397 29.271 584 H ASN 73 H ASN 73 33.795 28.270 34.793 585 HA ASN 73 HA ASN 73 32.966 29.411 36.563 586 HB2 ASN 73 HB2 ASN 73 35.221 31.328 35.823 587 HB3 ASN 73 HB3 ASN 73 34.347 31.369 37.349 588 HD21 ASN 73 HD21 ASN 73 37.183 30.947 37.256 589 HD22 ASN 73 HD22 ASN 73 37.414 29.313 37.849 590 H GLY 74 H GLY 74 31.380 29.801 34.313 591 HA2 GLY 74 HA2 GLY 74 29.482 31.091 33.778 592 HA3 GLY 74 HA3 GLY 74 29.989 32.311 34.906 593 H ASN 75 H ASN 75 32.686 31.991 33.003 594 HA ASN 75 HA ASN 75 31.943 34.335 31.374 595 HB2 ASN 75 HB2 ASN 75 34.596 33.162 32.236 596 HB3 ASN 75 HB3 ASN 75 34.449 34.506 31.141 597 HD21 ASN 75 HD21 ASN 75 35.833 34.893 33.521 598 HD22 ASN 75 HD22 ASN 75 34.843 35.909 34.566 599 H PHE 76 H PHE 76 31.579 34.251 29.256 600 HA PHE 76 HA PHE 76 31.730 31.776 27.784 601 HB2 PHE 76 HB2 PHE 76 29.869 33.223 27.452 602 HB3 PHE 76 HB3 PHE 76 30.897 34.602 27.102 603 HD1 PHE 76 HD2 PHE 76 30.071 31.171 25.773 604 HD2 PHE 76 HD1 PHE 76 31.397 35.173 24.872 605 HE1 PHE 76 HE2 PHE 76 29.976 30.666 23.345 606 HE2 PHE 76 HE1 PHE 76 31.304 34.661 22.447 607 HZ PHE 76 HZ PHE 76 30.582 32.409 21.677 608 H ILE 77 H ILE 77 32.960 31.092 26.190 609 HA ILE 77 HA ILE 77 34.935 32.805 24.791 610 HB ILE 77 HB ILE 77 35.411 29.961 25.759 611 HG12 ILE 77 HG12 ILE 77 37.137 32.308 26.585 612 HG13 ILE 77 HG13 ILE 77 35.701 31.899 27.511 613 HG21 ILE 77 HG21 ILE 77 36.459 30.303 23.566 614 HG22 ILE 77 HG22 ILE 77 37.205 31.817 24.126 615 HG23 ILE 77 HG23 ILE 77 37.713 30.259 24.792 616 HD11 ILE 77 HD11 ILE 77 37.951 29.929 26.995 617 HD12 ILE 77 HD12 ILE 77 37.659 30.839 28.491 618 HD13 ILE 77 HD13 ILE 77 36.476 29.642 27.929 619 H GLY 78 H GLY 78 34.732 32.537 22.541 620 HA2 GLY 78 HA2 GLY 78 33.335 30.042 21.564 621 HA3 GLY 78 HA3 GLY 78 32.924 31.622 20.930 622 H GLY 79 H GLY 79 34.643 28.928 20.422 623 HA2 GLY 79 HA2 GLY 79 35.424 28.671 18.050 624 HA3 GLY 79 HA3 GLY 79 36.458 30.070 18.345 625 H CYS 80 H CYS 80 36.950 26.969 17.882 626 HA CYS 80 HA CYS 80 38.227 26.092 20.340 627 HB2 CYS 80 HB2 CYS 80 37.460 24.512 18.569 628 HB3 CYS 80 HB3 CYS 80 38.765 25.104 17.511 629 HG CYS 80 HG CYS 80 40.685 24.709 19.392 630 H SER 81 H SER 81 39.530 27.649 17.384 631 HA SER 81 HA SER 81 42.242 27.890 18.210 632 HB2 SER 81 HB2 SER 81 42.212 29.820 16.582 633 HB3 SER 81 HB3 SER 81 41.601 28.282 15.944 634 HG SER 81 HG SER 81 40.344 30.185 15.447 635 H ASP 82 H ASP 82 39.409 29.856 18.956 636 HA ASP 82 HA ASP 82 40.725 32.022 20.282 637 HB2 ASP 82 HB2 ASP 82 38.253 31.574 19.315 638 HB3 ASP 82 HB3 ASP 82 37.899 31.162 20.972 639 H LEU 83 H LEU 83 39.338 29.001 21.419 640 HA LEU 83 HA LEU 83 39.879 29.307 24.241 641 HB2 LEU 83 HB2 LEU 83 38.170 27.788 23.419 642 HB3 LEU 83 HB3 LEU 83 39.333 26.935 22.421 643 HG LEU 83 HG LEU 83 40.496 26.105 24.459 644 HD11 LEU 83 HD11 LEU 83 39.299 26.221 26.632 645 HD12 LEU 83 HD12 LEU 83 39.826 27.820 26.095 646 HD13 LEU 83 HD13 LEU 83 38.120 27.349 25.919 647 HD21 LEU 83 HD21 LEU 83 38.786 24.786 23.260 648 HD22 LEU 83 HD22 LEU 83 38.832 24.424 24.986 649 HD23 LEU 83 HD23 LEU 83 37.533 25.453 24.330 650 H GLU 84 H GLU 84 41.698 27.534 21.649 651 HA GLU 84 HA GLU 84 43.849 26.723 23.373 652 HB2 GLU 84 HB2 GLU 84 43.779 27.185 20.366 653 HB3 GLU 84 HB3 GLU 84 45.161 26.501 21.247 654 HG2 GLU 84 HG2 GLU 84 43.787 24.663 22.080 655 HG3 GLU 84 HG3 GLU 84 42.392 25.246 21.167 656 H ALA 85 H ALA 85 43.270 29.777 21.670 657 HA ALA 85 HA ALA 85 45.848 30.925 21.954 658 HB1 ALA 85 HB1 ALA 85 44.069 31.877 20.560 659 HB2 ALA 85 HB2 ALA 85 43.086 32.211 21.982 660 HB3 ALA 85 HB3 ALA 85 44.618 33.075 21.748 661 H LEU 86 H LEU 86 43.158 30.721 24.318 662 HA LEU 86 HA LEU 86 44.466 32.246 26.403 663 HB2 LEU 86 HB2 LEU 86 42.257 30.158 26.561 664 HB3 LEU 86 HB3 LEU 86 42.742 31.231 27.863 665 HG LEU 86 HG LEU 86 41.552 32.125 25.209 666 HD11 LEU 86 HD11 LEU 86 39.571 32.673 26.536 667 HD12 LEU 86 HD12 LEU 86 39.956 30.947 26.633 668 HD13 LEU 86 HD13 LEU 86 40.343 32.024 27.999 669 HD21 LEU 86 HD21 LEU 86 41.335 34.323 26.282 670 HD22 LEU 86 HD22 LEU 86 42.177 33.730 27.730 671 HD23 LEU 86 HD23 LEU 86 43.029 33.866 26.161 672 H ASP 87 H ASP 87 44.522 28.834 25.469 673 HA ASP 87 HA ASP 87 45.879 27.879 27.824 674 HB2 ASP 87 HB2 ASP 87 44.647 26.462 26.134 675 HB3 ASP 87 HB3 ASP 87 46.022 26.671 25.048 676 H LYS 88 H LYS 88 47.099 28.955 24.646 677 HA LYS 88 HA LYS 88 49.930 28.842 25.309 678 HB2 LYS 88 HB2 LYS 88 48.265 30.183 23.153 679 HB3 LYS 88 HB3 LYS 88 49.958 30.607 23.352 680 HG2 LYS 88 HG2 LYS 88 49.741 28.963 21.624 681 HG3 LYS 88 HG3 LYS 88 50.674 28.317 22.969 682 HD2 LYS 88 HD2 LYS 88 48.799 26.911 23.679 683 HD3 LYS 88 HD3 LYS 88 47.728 27.738 22.544 684 HE2 LYS 88 HE2 LYS 88 48.258 25.642 21.560 685 HE3 LYS 88 HE3 LYS 88 49.053 26.909 20.624 686 HZ1 LYS 88 HZ1 LYS 88 50.479 25.016 21.013 687 HZ2 LYS 88 HZ2 LYS 88 51.144 26.324 21.777 688 HZ3 LYS 88 HZ3 LYS 88 50.353 25.176 22.647 689 H GLU 89 H GLU 89 47.486 31.367 25.769 690 HA GLU 89 HA GLU 89 49.438 33.331 26.727 691 HB2 GLU 89 HB2 GLU 89 46.416 33.315 26.517 692 HB3 GLU 89 HB3 GLU 89 47.324 34.668 27.192 693 HG2 GLU 89 HG2 GLU 89 48.459 35.125 25.166 694 HG3 GLU 89 HG3 GLU 89 47.988 33.600 24.437 695 H GLY 90 H GLY 90 48.446 30.612 28.290 696 HA2 GLY 90 HA2 GLY 90 48.916 29.990 30.471 697 HA3 GLY 90 HA3 GLY 90 49.411 31.644 30.818 698 H LYS 91 H LYS 91 46.231 31.565 29.581 699 HA LYS 91 HA LYS 91 45.170 32.466 32.206 700 HB2 LYS 91 HB2 LYS 91 44.469 32.802 29.272 701 HB3 LYS 91 HB3 LYS 91 43.217 33.017 30.480 702 HG2 LYS 91 HG2 LYS 91 44.532 34.718 31.644 703 HG3 LYS 91 HG3 LYS 91 45.855 34.539 30.489 704 HD2 LYS 91 HD2 LYS 91 43.028 35.410 29.702 705 HD3 LYS 91 HD3 LYS 91 44.307 36.537 30.159 706 HE2 LYS 91 HE2 LYS 91 45.763 35.586 28.352 707 HE3 LYS 91 HE3 LYS 91 44.400 34.598 27.813 708 HZ1 LYS 91 HZ1 LYS 91 44.568 37.561 27.816 709 HZ2 LYS 91 HZ2 LYS 91 44.513 36.570 26.509 710 HZ3 LYS 91 HZ3 LYS 91 43.185 36.781 27.470 711 H LEU 92 H LEU 92 45.058 29.620 30.289 712 HA LEU 92 HA LEU 92 42.435 28.747 31.405 713 HB2 LEU 92 HB2 LEU 92 43.177 28.598 28.903 714 HB3 LEU 92 HB3 LEU 92 44.353 27.410 29.426 715 HG LEU 92 HG LEU 92 42.497 25.948 30.227 716 HD11 LEU 92 HD11 LEU 92 40.721 27.611 30.600 717 HD12 LEU 92 HD12 LEU 92 40.736 28.042 28.876 718 HD13 LEU 92 HD13 LEU 92 40.189 26.436 29.390 719 HD21 LEU 92 HD21 LEU 92 43.458 25.600 28.015 720 HD22 LEU 92 HD22 LEU 92 41.723 25.267 27.980 721 HD23 LEU 92 HD23 LEU 92 42.343 26.793 27.309 722 H ASP 93 H ASP 93 45.844 28.071 31.721 723 HA ASP 93 HA ASP 93 45.501 26.030 33.794 724 HB2 ASP 93 HB2 ASP 93 47.753 27.898 32.969 725 HB3 ASP 93 HB3 ASP 93 47.839 26.831 34.361 726 H GLY 94 H GLY 94 45.852 29.589 33.731 727 HA2 GLY 94 HA2 GLY 94 45.776 30.046 36.524 728 HA3 GLY 94 HA3 GLY 94 45.272 31.191 35.266 729 H LEU 95 H LEU 95 43.067 29.649 34.221 730 HA LEU 95 HA LEU 95 41.020 30.340 36.118 731 HB2 LEU 95 HB2 LEU 95 41.098 28.916 33.456 732 HB3 LEU 95 HB3 LEU 95 39.611 28.911 34.401 733 HG LEU 95 HG LEU 95 41.059 31.514 33.779 734 HD11 LEU 95 HD11 LEU 95 39.558 31.845 31.885 735 HD12 LEU 95 HD12 LEU 95 40.535 30.393 31.628 736 HD13 LEU 95 HD13 LEU 95 38.835 30.249 32.129 737 HD21 LEU 95 HD21 LEU 95 39.337 31.616 35.553 738 HD22 LEU 95 HD22 LEU 95 38.844 32.512 34.117 739 HD23 LEU 95 HD23 LEU 95 38.146 30.913 34.443 740 H LEU 96 H LEU 96 42.728 27.311 35.585 741 HA LEU 96 HA LEU 96 41.080 25.940 37.658 742 HB2 LEU 96 HB2 LEU 96 43.581 25.014 36.193 743 HB3 LEU 96 HB3 LEU 96 42.649 24.002 37.286 744 HG LEU 96 HG LEU 96 41.805 25.058 34.602 745 HD11 LEU 96 HD11 LEU 96 41.549 22.593 34.238 746 HD12 LEU 96 HD12 LEU 96 43.197 22.982 34.770 747 HD13 LEU 96 HD13 LEU 96 42.028 22.291 35.898 748 HD21 LEU 96 HD21 LEU 96 39.629 23.836 34.971 749 HD22 LEU 96 HD22 LEU 96 40.056 23.680 36.683 750 HD23 LEU 96 HD23 LEU 96 39.788 25.284 35.965 751 H SER 97 H SER 97 42.999 28.342 38.253 752 HA SER 97 HA SER 97 44.649 27.045 40.380 753 HB2 SER 97 HB2 SER 97 46.093 28.858 40.436 754 HB3 SER 97 HB3 SER 97 45.822 28.456 38.735 755 HG SER 97 HG SER 97 44.269 30.168 38.677 Start of MODEL 6 1 H1 GLY 1 H1 GLY 1 18.065 36.317 34.416 2 H2 GLY 1 H2 GLY 1 17.384 34.823 34.467 3 H3 GLY 1 H3 GLY 1 17.479 35.728 35.840 4 HA2 GLY 1 HA2 GLY 1 16.011 37.392 34.847 5 HA3 GLY 1 HA3 GLY 1 15.843 36.297 33.459 6 H ALA 2 H ALA 2 13.557 36.798 34.300 7 HA ALA 2 HA ALA 2 12.462 35.663 36.635 8 HB1 ALA 2 HB1 ALA 2 11.224 36.249 33.906 9 HB2 ALA 2 HB2 ALA 2 10.323 36.000 35.410 10 HB3 ALA 2 HB3 ALA 2 11.404 37.400 35.249 11 H MET 3 H MET 3 13.198 34.036 33.574 12 HA MET 3 HA MET 3 12.122 31.500 34.734 13 HB2 MET 3 HB2 MET 3 12.245 32.175 31.771 14 HB3 MET 3 HB3 MET 3 11.723 30.656 32.499 15 HG2 MET 3 HG2 MET 3 9.699 31.639 32.080 16 HG3 MET 3 HG3 MET 3 9.956 32.120 33.756 17 HE1 MET 3 HE1 MET 3 8.160 33.999 33.674 18 HE2 MET 3 HE2 MET 3 8.024 35.201 32.371 19 HE3 MET 3 HE3 MET 3 7.747 33.481 32.023 20 HA PRO 4 HA PRO 4 16.381 30.464 34.534 21 HB2 PRO 4 HB2 PRO 4 16.407 27.837 35.161 22 HB3 PRO 4 HB3 PRO 4 15.841 29.092 36.310 23 HG2 PRO 4 HG2 PRO 4 14.162 27.359 34.486 24 HG3 PRO 4 HG3 PRO 4 13.926 27.643 36.235 25 HD2 PRO 4 HD2 PRO 4 12.562 29.051 34.327 26 HD3 PRO 4 HD3 PRO 4 13.063 29.787 35.878 27 H SER 5 H SER 5 17.991 29.586 33.269 28 HA SER 5 HA SER 5 17.352 27.859 30.983 29 HB2 SER 5 HB2 SER 5 18.333 29.323 29.325 30 HB3 SER 5 HB3 SER 5 16.955 30.112 30.002 31 HG SER 5 HG SER 5 18.711 31.558 29.908 32 H ILE 6 H ILE 6 19.835 28.436 29.659 33 HA ILE 6 HA ILE 6 21.324 26.345 30.741 34 HB ILE 6 HB ILE 6 22.832 26.602 29.050 35 HG12 ILE 6 HG12 ILE 6 22.035 29.481 28.684 36 HG13 ILE 6 HG13 ILE 6 23.608 28.885 29.183 37 HG21 ILE 6 HG21 ILE 6 20.451 26.066 28.522 38 HG22 ILE 6 HG22 ILE 6 20.277 27.718 27.872 39 HG23 ILE 6 HG23 ILE 6 21.451 26.598 27.162 40 HD11 ILE 6 HD11 ILE 6 23.956 27.896 26.940 41 HD12 ILE 6 HD12 ILE 6 22.363 28.432 26.416 42 HD13 ILE 6 HD13 ILE 6 23.608 29.626 26.828 43 H ALA 7 H ALA 7 21.637 29.715 31.451 44 HA ALA 7 HA ALA 7 24.224 29.940 32.463 45 HB1 ALA 7 HB1 ALA 7 23.327 31.762 33.841 46 HB2 ALA 7 HB2 ALA 7 22.588 31.788 32.231 47 HB3 ALA 7 HB3 ALA 7 21.674 31.155 33.619 48 H SER 8 H SER 8 21.394 28.477 34.159 49 HA SER 8 HA SER 8 22.746 28.078 36.664 50 HB2 SER 8 HB2 SER 8 20.341 26.747 35.371 51 HB3 SER 8 HB3 SER 8 20.979 26.222 36.939 52 HG SER 8 HG SER 8 19.881 28.743 36.225 53 H MET 9 H MET 9 22.733 26.138 33.680 54 HA MET 9 HA MET 9 23.917 23.726 34.742 55 HB2 MET 9 HB2 MET 9 24.352 24.849 31.949 56 HB3 MET 9 HB3 MET 9 24.381 23.178 32.454 57 HG2 MET 9 HG2 MET 9 21.958 23.168 32.761 58 HG3 MET 9 HG3 MET 9 21.873 24.886 32.376 59 HE1 MET 9 HE1 MET 9 20.138 22.612 30.821 60 HE2 MET 9 HE2 MET 9 20.008 24.364 30.547 61 HE3 MET 9 HE3 MET 9 20.259 23.256 29.177 62 H ILE 10 H ILE 10 25.182 26.822 33.617 63 HA ILE 10 HA ILE 10 27.966 26.045 33.473 64 HB ILE 10 HB ILE 10 27.096 28.889 33.475 65 HG12 ILE 10 HG12 ILE 10 26.462 26.708 31.462 66 HG13 ILE 10 HG13 ILE 10 25.486 28.071 32.050 67 HG21 ILE 10 HG21 ILE 10 29.540 28.147 33.393 68 HG22 ILE 10 HG22 ILE 10 29.178 27.316 31.883 69 HG23 ILE 10 HG23 ILE 10 29.001 29.085 32.003 70 HD11 ILE 10 HD11 ILE 10 26.000 28.409 29.780 71 HD12 ILE 10 HD12 ILE 10 26.948 29.584 30.744 72 HD13 ILE 10 HD13 ILE 10 27.727 28.102 30.096 73 H LYS 11 H LYS 11 25.887 27.311 35.930 74 HA LYS 11 HA LYS 11 28.022 27.705 37.950 75 HB2 LYS 11 HB2 LYS 11 25.018 27.879 38.015 76 HB3 LYS 11 HB3 LYS 11 26.070 28.113 39.430 77 HG2 LYS 11 HG2 LYS 11 27.284 29.904 38.268 78 HG3 LYS 11 HG3 LYS 11 26.271 29.707 36.818 79 HD2 LYS 11 HD2 LYS 11 24.277 30.152 38.192 80 HD3 LYS 11 HD3 LYS 11 25.333 30.485 39.587 81 HE2 LYS 11 HE2 LYS 11 25.416 31.955 36.908 82 HE3 LYS 11 HE3 LYS 11 24.533 32.547 38.322 83 HZ1 LYS 11 HZ1 LYS 11 26.591 32.693 39.539 84 HZ2 LYS 11 HZ2 LYS 11 27.474 32.070 38.290 85 HZ3 LYS 11 HZ3 LYS 11 26.782 33.531 38.120 86 H GLY 12 H GLY 12 26.300 25.036 36.667 87 HA2 GLY 12 HA2 GLY 12 26.318 23.381 39.092 88 HA3 GLY 12 HA3 GLY 12 25.834 22.894 37.464 89 H ASN 13 H ASN 13 28.097 23.514 35.991 90 HA ASN 13 HA ASN 13 30.295 21.762 37.069 91 HB2 ASN 13 HB2 ASN 13 29.341 22.471 34.265 92 HB3 ASN 13 HB3 ASN 13 30.885 21.690 34.547 93 HD21 ASN 13 HD21 ASN 13 30.730 19.596 35.938 94 HD22 ASN 13 HD22 ASN 13 29.348 18.560 35.499 95 H LYS 14 H LYS 14 32.429 22.276 36.451 96 HA LYS 14 HA LYS 14 33.164 25.107 36.674 97 HB2 LYS 14 HB2 LYS 14 34.446 23.293 37.692 98 HB3 LYS 14 HB3 LYS 14 34.810 22.619 36.100 99 HG2 LYS 14 HG2 LYS 14 36.083 24.523 35.427 100 HG3 LYS 14 HG3 LYS 14 35.584 25.471 36.838 101 HD2 LYS 14 HD2 LYS 14 37.323 22.936 36.894 102 HD3 LYS 14 HD3 LYS 14 37.949 24.597 36.901 103 HE2 LYS 14 HE2 LYS 14 36.726 25.058 38.999 104 HE3 LYS 14 HE3 LYS 14 36.148 23.366 39.014 105 HZ1 LYS 14 HZ1 LYS 14 38.380 22.619 39.283 106 HZ2 LYS 14 HZ2 LYS 14 39.014 24.126 39.126 107 HZ3 LYS 14 HZ3 LYS 14 38.080 23.776 40.425 108 H VAL 15 H VAL 15 33.303 22.689 34.009 109 HA VAL 15 HA VAL 15 33.351 24.953 32.061 110 HB VAL 15 HB VAL 15 34.799 22.327 31.671 111 HG11 VAL 15 HG11 VAL 15 34.055 23.325 29.567 112 HG12 VAL 15 HG12 VAL 15 34.730 24.892 30.036 113 HG13 VAL 15 HG13 VAL 15 35.801 23.507 29.743 114 HG21 VAL 15 HG21 VAL 15 36.084 23.420 33.304 115 HG22 VAL 15 HG22 VAL 15 36.834 23.938 31.787 116 HG23 VAL 15 HG23 VAL 15 35.746 25.032 32.645 117 H VAL 16 H VAL 16 31.852 24.992 30.554 118 HA VAL 16 HA VAL 16 30.193 22.564 30.004 119 HB VAL 16 HB VAL 16 29.063 25.352 30.427 120 HG11 VAL 16 HG11 VAL 16 27.720 22.660 29.893 121 HG12 VAL 16 HG12 VAL 16 26.878 24.172 30.289 122 HG13 VAL 16 HG13 VAL 16 27.763 24.043 28.764 123 HG21 VAL 16 HG21 VAL 16 29.634 24.377 32.595 124 HG22 VAL 16 HG22 VAL 16 27.890 24.203 32.357 125 HG23 VAL 16 HG23 VAL 16 28.949 22.810 32.096 126 H VAL 17 H VAL 17 29.939 22.169 27.863 127 HA VAL 17 HA VAL 17 30.560 24.331 25.879 128 HB VAL 17 HB VAL 17 31.439 21.420 25.946 129 HG11 VAL 17 HG11 VAL 17 30.932 22.043 23.614 130 HG12 VAL 17 HG12 VAL 17 31.934 23.506 23.783 131 HG13 VAL 17 HG13 VAL 17 32.665 21.881 23.861 132 HG21 VAL 17 HG21 VAL 17 32.958 24.028 26.136 133 HG22 VAL 17 HG22 VAL 17 32.834 22.756 27.365 134 HG23 VAL 17 HG23 VAL 17 33.722 22.446 25.872 135 H PHE 18 H PHE 18 29.359 24.332 23.927 136 HA PHE 18 HA PHE 18 27.014 22.443 23.784 137 HB2 PHE 18 HB2 PHE 18 27.039 25.371 23.027 138 HB3 PHE 18 HB3 PHE 18 25.701 24.254 22.841 139 HD1 PHE 18 HD1 PHE 18 27.703 26.209 25.261 140 HD2 PHE 18 HD2 PHE 18 24.332 23.570 24.774 141 HE1 PHE 18 HE1 PHE 18 26.845 26.890 27.492 142 HE2 PHE 18 HE2 PHE 18 23.485 24.245 27.013 143 HZ PHE 18 HZ PHE 18 24.716 25.968 28.340 144 H SER 19 H SER 19 26.962 21.262 21.973 145 HA SER 19 HA SER 19 28.712 21.914 19.625 146 HB2 SER 19 HB2 SER 19 28.794 19.466 21.414 147 HB3 SER 19 HB3 SER 19 29.676 19.646 19.884 148 HG SER 19 HG SER 19 31.066 20.305 21.382 149 H TRP 20 H TRP 20 28.613 20.125 17.888 150 HA TRP 20 HA TRP 20 26.000 18.648 17.847 151 HB2 TRP 20 HB2 TRP 20 27.358 19.872 15.427 152 HB3 TRP 20 HB3 TRP 20 25.978 18.798 15.397 153 HD1 TRP 20 HD1 TRP 20 24.189 20.190 17.606 154 HE1 TRP 20 HE1 TRP 20 22.930 22.334 16.950 155 HE3 TRP 20 HE3 TRP 20 27.101 21.741 13.689 156 HZ2 TRP 20 HZ2 TRP 20 23.376 24.643 15.292 157 HZ3 TRP 20 HZ3 TRP 20 26.710 23.995 12.658 158 HH2 TRP 20 HH2 TRP 20 24.887 25.444 13.468 159 H VAL 21 H VAL 21 26.130 16.471 17.276 160 HA VAL 21 HA VAL 21 28.816 15.316 17.099 161 HB VAL 21 HB VAL 21 26.185 13.862 16.807 162 HG11 VAL 21 HG11 VAL 21 28.150 12.578 16.024 163 HG12 VAL 21 HG12 VAL 21 28.992 12.902 17.552 164 HG13 VAL 21 HG13 VAL 21 27.524 11.899 17.521 165 HG21 VAL 21 HG21 VAL 21 27.876 14.357 19.294 166 HG22 VAL 21 HG22 VAL 21 26.208 14.921 19.013 167 HG23 VAL 21 HG23 VAL 21 26.541 13.200 19.199 168 H THR 22 H THR 22 28.896 14.758 13.504 169 HA THR 22 HA THR 22 30.452 15.038 16.062 170 HB THR 22 HB THR 22 31.507 13.894 13.478 171 HG1 THR 22 HG1 THR 22 31.075 11.858 14.819 172 HG21 THR 22 HG21 THR 22 32.230 13.461 16.416 173 HG22 THR 22 HG22 THR 22 33.135 14.466 15.262 174 HG23 THR 22 HG23 THR 22 33.038 12.717 15.015 175 H CYS 23 H CYS 23 31.825 16.825 16.230 176 HA CYS 23 HA CYS 23 31.652 18.726 13.928 177 HB2 CYS 23 HB2 CYS 23 31.172 18.961 16.801 178 HB3 CYS 23 HB3 CYS 23 32.268 20.209 16.181 179 HG CYS 23 HG CYS 23 29.444 19.320 14.718 180 HA PRO 24 HA PRO 24 36.042 17.993 13.649 181 HB2 PRO 24 HB2 PRO 24 36.703 19.763 11.641 182 HB3 PRO 24 HB3 PRO 24 35.869 18.201 11.380 183 HG2 PRO 24 HG2 PRO 24 34.632 20.953 11.673 184 HG3 PRO 24 HG3 PRO 24 34.316 19.731 10.394 185 HD2 PRO 24 HD2 PRO 24 32.668 19.957 12.511 186 HD3 PRO 24 HD3 PRO 24 33.116 18.337 11.900 187 H TYR 25 H TYR 25 34.720 21.116 14.597 188 HA TYR 25 HA TYR 25 37.281 21.819 15.907 189 HB2 TYR 25 HB2 TYR 25 34.549 23.131 15.995 190 HB3 TYR 25 HB3 TYR 25 35.998 23.731 16.782 191 HD1 TYR 25 HD2 TYR 25 38.191 23.710 15.076 192 HD2 TYR 25 HD1 TYR 25 34.060 24.286 13.953 193 HE1 TYR 25 HE2 TYR 25 38.905 24.971 13.055 194 HE2 TYR 25 HE1 TYR 25 34.793 25.514 11.909 195 HH TYR 25 HH TYR 25 38.240 26.168 11.218 196 H CYS 26 H CYS 26 34.056 20.571 16.902 197 HA CYS 26 HA CYS 26 34.534 20.764 19.683 198 HB2 CYS 26 HB2 CYS 26 32.393 20.427 18.647 199 HB3 CYS 26 HB3 CYS 26 32.800 18.756 18.198 200 HG CYS 26 HG CYS 26 33.194 17.812 20.545 201 H VAL 27 H VAL 27 35.395 18.111 17.465 202 HA VAL 27 HA VAL 27 36.491 16.195 19.138 203 HB VAL 27 HB VAL 27 36.358 16.193 16.826 204 HG11 VAL 27 HG11 VAL 27 38.764 17.705 16.242 205 HG12 VAL 27 HG12 VAL 27 37.574 16.954 15.164 206 HG13 VAL 27 HG13 VAL 27 37.057 18.292 16.197 207 HG21 VAL 27 HG21 VAL 27 38.402 14.847 16.315 208 HG22 VAL 27 HG22 VAL 27 39.236 15.615 17.684 209 HG23 VAL 27 HG23 VAL 27 37.860 14.518 17.968 210 H ARG 28 H ARG 28 38.062 18.678 17.692 211 HA ARG 28 HA ARG 28 40.618 18.776 18.996 212 HB2 ARG 28 HB2 ARG 28 39.265 21.391 18.214 213 HB3 ARG 28 HB3 ARG 28 40.968 21.084 18.489 214 HG2 ARG 28 HG2 ARG 28 40.827 19.488 16.470 215 HG3 ARG 28 HG3 ARG 28 39.262 20.292 16.137 216 HD2 ARG 28 HD2 ARG 28 40.341 22.486 16.146 217 HD3 ARG 28 HD3 ARG 28 41.908 21.746 16.509 218 HE ARG 28 HE ARG 28 41.346 20.448 14.243 219 HH11 ARG 28 HH22 ARG 28 41.170 23.919 14.881 220 HH12 ARG 28 HH21 ARG 28 41.433 24.295 13.203 221 HH21 ARG 28 HH12 ARG 28 41.773 21.071 12.137 222 HH22 ARG 28 HH11 ARG 28 41.401 22.715 11.668 223 H ALA 29 H ALA 29 37.789 20.712 19.924 224 HA ALA 29 HA ALA 29 38.942 21.798 22.290 225 HB1 ALA 29 HB1 ALA 29 36.000 21.351 21.634 226 HB2 ALA 29 HB2 ALA 29 36.654 22.440 22.879 227 HB3 ALA 29 HB3 ALA 29 36.976 22.764 21.161 228 H GLU 30 H GLU 30 36.706 18.920 22.018 229 HA GLU 30 HA GLU 30 36.809 18.221 24.796 230 HB2 GLU 30 HB2 GLU 30 36.351 16.597 22.254 231 HB3 GLU 30 HB3 GLU 30 36.384 15.879 23.848 232 HG2 GLU 30 HG2 GLU 30 34.577 17.747 24.427 233 HG3 GLU 30 HG3 GLU 30 34.310 17.727 22.674 234 H LYS 31 H LYS 31 39.097 17.449 22.215 235 HA LYS 31 HA LYS 31 40.541 15.509 23.760 236 HB2 LYS 31 HB2 LYS 31 40.742 15.490 21.347 237 HB3 LYS 31 HB3 LYS 31 41.078 17.216 21.303 238 HG2 LYS 31 HG2 LYS 31 43.339 16.730 22.402 239 HG3 LYS 31 HG3 LYS 31 42.964 15.011 22.175 240 HD2 LYS 31 HD2 LYS 31 44.341 15.784 20.361 241 HD3 LYS 31 HD3 LYS 31 42.704 15.438 19.756 242 HE2 LYS 31 HE2 LYS 31 42.176 17.652 19.391 243 HE3 LYS 31 HE3 LYS 31 43.360 18.280 20.565 244 HZ1 LYS 31 HZ1 LYS 31 45.130 17.619 19.008 245 HZ2 LYS 31 HZ2 LYS 31 44.026 17.111 17.911 246 HZ3 LYS 31 HZ3 LYS 31 44.106 18.701 18.324 247 H LEU 32 H LEU 32 41.000 18.926 23.130 248 HA LEU 32 HA LEU 32 43.404 19.311 24.658 249 HB2 LEU 32 HB2 LEU 32 42.700 20.614 22.735 250 HB3 LEU 32 HB3 LEU 32 41.223 21.086 23.574 251 HG LEU 32 HG LEU 32 42.325 22.626 24.970 252 HD11 LEU 32 HD11 LEU 32 44.309 21.399 25.657 253 HD12 LEU 32 HD12 LEU 32 44.984 21.485 24.011 254 HD13 LEU 32 HD13 LEU 32 44.783 22.962 24.990 255 HD21 LEU 32 HD21 LEU 32 43.620 22.670 22.205 256 HD22 LEU 32 HD22 LEU 32 42.011 23.290 22.602 257 HD23 LEU 32 HD23 LEU 32 43.442 24.077 23.297 258 H LEU 33 H LEU 33 39.927 19.914 25.412 259 HA LEU 33 HA LEU 33 40.404 21.082 27.962 260 HB2 LEU 33 HB2 LEU 33 38.006 19.557 26.824 261 HB3 LEU 33 HB3 LEU 33 37.943 20.404 28.365 262 HG LEU 33 HG LEU 33 38.614 21.755 25.736 263 HD11 LEU 33 HD11 LEU 33 35.935 21.944 27.051 264 HD12 LEU 33 HD12 LEU 33 36.468 22.643 25.523 265 HD13 LEU 33 HD13 LEU 33 36.313 20.888 25.661 266 HD21 LEU 33 HD21 LEU 33 38.002 23.840 26.974 267 HD22 LEU 33 HD22 LEU 33 37.797 22.874 28.444 268 HD23 LEU 33 HD23 LEU 33 39.403 23.031 27.686 269 H HIS 34 H HIS 34 39.909 17.679 27.038 270 HA HIS 34 HA HIS 34 40.233 16.601 29.704 271 HB2 HIS 34 HB2 HIS 34 40.345 15.444 26.900 272 HB3 HIS 34 HB3 HIS 34 40.662 14.480 28.336 273 HD1 HIS 34 HD1 HIS 34 38.595 13.030 28.742 274 HD2 HIS 34 HD2 HIS 34 37.675 16.920 27.450 275 HE1 HIS 34 HE1 HIS 34 36.050 13.202 28.725 276 H ALA 35 H ALA 35 42.587 17.482 27.090 277 HA ALA 35 HA ALA 35 44.820 16.174 28.425 278 HB1 ALA 35 HB1 ALA 35 44.808 18.390 26.327 279 HB2 ALA 35 HB2 ALA 35 46.165 17.326 26.742 280 HB3 ALA 35 HB3 ALA 35 44.726 16.653 25.982 281 H ARG 36 H ARG 36 43.273 19.220 28.853 282 HA ARG 36 HA ARG 36 45.489 20.355 30.529 283 HB2 ARG 36 HB2 ARG 36 43.466 21.400 28.622 284 HB3 ARG 36 HB3 ARG 36 43.709 22.394 29.993 285 HG2 ARG 36 HG2 ARG 36 45.055 23.127 28.157 286 HG3 ARG 36 HG3 ARG 36 46.008 22.757 29.597 287 HD2 ARG 36 HD2 ARG 36 46.974 20.835 28.617 288 HD3 ARG 36 HD3 ARG 36 45.776 20.790 27.305 289 HE ARG 36 HE ARG 36 47.049 23.314 27.184 290 HH11 ARG 36 HH22 ARG 36 48.297 20.014 26.845 291 HH12 ARG 36 HH21 ARG 36 49.310 20.481 25.511 292 HH21 ARG 36 HH12 ARG 36 48.397 23.803 25.583 293 HH22 ARG 36 HH11 ARG 36 49.418 22.571 24.846 294 H THR 37 H THR 37 43.069 18.523 31.236 295 HA THR 37 HA THR 37 41.969 18.030 33.168 296 HB THR 37 HB THR 37 43.095 20.206 34.787 297 HG1 THR 37 HG1 THR 37 45.100 18.958 34.986 298 HG21 THR 37 HG21 THR 37 43.591 18.361 36.385 299 HG22 THR 37 HG22 THR 37 43.084 17.167 35.166 300 HG23 THR 37 HG23 THR 37 41.909 18.305 35.855 301 H LYS 38 H LYS 38 40.802 20.135 31.392 302 HA LYS 38 HA LYS 38 39.342 21.928 33.265 303 HB2 LYS 38 HB2 LYS 38 39.240 21.377 30.283 304 HB3 LYS 38 HB3 LYS 38 37.877 22.082 31.119 305 HG2 LYS 38 HG2 LYS 38 39.115 23.888 30.201 306 HG3 LYS 38 HG3 LYS 38 39.368 23.959 31.927 307 HD2 LYS 38 HD2 LYS 38 41.470 22.463 30.409 308 HD3 LYS 38 HD3 LYS 38 41.308 24.169 29.975 309 HE2 LYS 38 HE2 LYS 38 41.431 24.733 32.457 310 HE3 LYS 38 HE3 LYS 38 41.852 23.019 32.717 311 HZ1 LYS 38 HZ1 LYS 38 43.570 24.712 30.961 312 HZ2 LYS 38 HZ2 LYS 38 43.789 24.616 32.576 313 HZ3 LYS 38 HZ3 LYS 38 43.886 23.289 31.724 314 H ASP 39 H ASP 39 38.154 20.809 34.683 315 HA ASP 39 HA ASP 39 36.721 18.523 34.157 316 HB2 ASP 39 HB2 ASP 39 37.111 19.597 36.478 317 HB3 ASP 39 HB3 ASP 39 35.755 20.625 36.141 318 H ILE 40 H ILE 40 35.537 18.288 32.461 319 HA ILE 40 HA ILE 40 33.754 20.449 31.563 320 HB ILE 40 HB ILE 40 35.912 20.146 30.522 321 HG12 ILE 40 HG12 ILE 40 33.484 20.598 29.172 322 HG13 ILE 40 HG13 ILE 40 35.096 21.182 28.846 323 HG21 ILE 40 HG21 ILE 40 36.153 17.687 30.739 324 HG22 ILE 40 HG22 ILE 40 34.980 17.464 29.443 325 HG23 ILE 40 HG23 ILE 40 36.530 18.281 29.136 326 HD11 ILE 40 HD11 ILE 40 33.940 18.618 27.686 327 HD12 ILE 40 HD12 ILE 40 34.084 20.172 26.854 328 HD13 ILE 40 HD13 ILE 40 35.551 19.305 27.329 329 H THR 41 H THR 41 31.808 20.292 30.935 330 HA THR 41 HA THR 41 30.509 17.670 30.244 331 HB THR 41 HB THR 41 29.482 20.172 31.622 332 HG1 THR 41 HG1 THR 41 28.868 18.642 33.147 333 HG21 THR 41 HG21 THR 41 27.834 17.913 30.424 334 HG22 THR 41 HG22 THR 41 27.721 19.655 30.062 335 HG23 THR 41 HG23 THR 41 27.236 19.055 31.651 336 H VAL 42 H VAL 42 29.784 17.550 28.082 337 HA VAL 42 HA VAL 42 29.265 20.113 26.702 338 HB VAL 42 HB VAL 42 31.053 19.504 25.621 339 HG11 VAL 42 HG11 VAL 42 30.541 16.614 25.829 340 HG12 VAL 42 HG12 VAL 42 31.834 17.407 24.872 341 HG13 VAL 42 HG13 VAL 42 31.779 17.674 26.607 342 HG21 VAL 42 HG21 VAL 42 30.555 18.729 23.385 343 HG22 VAL 42 HG22 VAL 42 29.029 18.023 23.939 344 HG23 VAL 42 HG23 VAL 42 29.260 19.787 23.964 345 H HIS 43 H HIS 43 27.469 20.509 25.895 346 HA HIS 43 HA HIS 43 25.246 18.573 25.976 347 HB2 HIS 43 HB2 HIS 43 25.545 21.583 25.943 348 HB3 HIS 43 HB3 HIS 43 24.017 20.837 25.579 349 HD1 HIS 43 HD1 HIS 43 25.973 22.007 28.469 350 HD2 HIS 43 HD2 HIS 43 23.121 19.022 27.703 351 HE1 HIS 43 HE1 HIS 43 25.072 21.279 30.746 352 H TYR 44 H TYR 44 24.799 17.507 24.144 353 HA TYR 44 HA TYR 44 25.572 18.645 21.494 354 HB2 TYR 44 HB2 TYR 44 24.876 15.838 22.398 355 HB3 TYR 44 HB3 TYR 44 24.916 16.332 20.716 356 HD1 TYR 44 HD2 TYR 44 26.896 17.342 19.698 357 HD2 TYR 44 HD1 TYR 44 27.075 15.386 23.524 358 HE1 TYR 44 HE2 TYR 44 29.379 17.137 19.468 359 HE2 TYR 44 HE1 TYR 44 29.558 15.172 23.297 360 HH TYR 44 HH TYR 44 31.465 15.652 21.936 361 H VAL 45 H VAL 45 24.166 20.209 21.092 362 HA VAL 45 HA VAL 45 21.354 19.946 21.656 363 HB VAL 45 HB VAL 45 21.054 22.113 20.672 364 HG11 VAL 45 HG11 VAL 45 22.481 23.405 22.122 365 HG12 VAL 45 HG12 VAL 45 22.056 21.901 22.960 366 HG13 VAL 45 HG13 VAL 45 23.667 22.088 22.231 367 HG21 VAL 45 HG21 VAL 45 22.916 23.394 19.697 368 HG22 VAL 45 HG22 VAL 45 23.922 21.931 19.690 369 HG23 VAL 45 HG23 VAL 45 22.427 22.009 18.717 370 H ASP 46 H ASP 46 23.127 18.765 19.003 371 HA ASP 46 HA ASP 46 20.895 18.648 17.124 372 HB2 ASP 46 HB2 ASP 46 22.375 17.738 15.675 373 HB3 ASP 46 HB3 ASP 46 23.498 18.527 16.681 374 H LYS 47 H LYS 47 21.861 16.879 19.916 375 HA LYS 47 HA LYS 47 20.017 14.588 19.397 376 HB2 LYS 47 HB2 LYS 47 21.908 14.987 21.741 377 HB3 LYS 47 HB3 LYS 47 21.135 13.499 21.220 378 HG2 LYS 47 HG2 LYS 47 23.371 14.979 19.779 379 HG3 LYS 47 HG3 LYS 47 23.532 13.512 20.740 380 HD2 LYS 47 HD2 LYS 47 22.126 12.282 19.146 381 HD3 LYS 47 HD3 LYS 47 21.922 13.759 18.166 382 HE2 LYS 47 HE2 LYS 47 24.378 13.893 17.872 383 HE3 LYS 47 HE3 LYS 47 24.565 12.386 18.794 384 HZ1 LYS 47 HZ1 LYS 47 23.114 12.636 16.220 385 HZ2 LYS 47 HZ2 LYS 47 24.567 11.911 16.409 386 HZ3 LYS 47 HZ3 LYS 47 23.212 11.263 17.091 387 H MET 48 H MET 48 20.516 17.337 21.557 388 HA MET 48 HA MET 48 18.616 16.470 23.518 389 HB2 MET 48 HB2 MET 48 20.764 17.712 23.847 390 HB3 MET 48 HB3 MET 48 19.977 19.163 23.216 391 HG2 MET 48 HG2 MET 48 18.410 19.157 25.089 392 HG3 MET 48 HG3 MET 48 19.063 17.608 25.662 393 HE1 MET 48 HE1 MET 48 18.766 20.126 27.575 394 HE2 MET 48 HE2 MET 48 19.482 18.590 28.115 395 HE3 MET 48 HE3 MET 48 20.329 20.126 28.415 396 H SER 49 H SER 49 16.422 16.854 23.711 397 HA SER 49 HA SER 49 14.909 18.240 21.721 398 HB2 SER 49 HB2 SER 49 14.161 17.437 24.553 399 HB3 SER 49 HB3 SER 49 13.012 18.042 23.350 400 HG SER 49 HG SER 49 13.198 16.241 22.194 401 H GLU 50 H GLU 50 16.132 19.382 24.851 402 HA GLU 50 HA GLU 50 14.954 22.024 24.628 403 HB2 GLU 50 HB2 GLU 50 15.864 20.620 26.738 404 HB3 GLU 50 HB3 GLU 50 17.375 21.406 26.308 405 HG2 GLU 50 HG2 GLU 50 16.604 22.917 27.805 406 HG3 GLU 50 HG3 GLU 50 15.829 23.611 26.383 407 H GLY 51 H GLY 51 17.516 20.668 22.928 408 HA2 GLY 51 HA2 GLY 51 19.623 22.440 22.997 409 HA3 GLY 51 HA3 GLY 51 19.127 21.509 21.585 410 H GLU 52 H GLU 52 16.508 23.128 21.319 411 HA GLU 52 HA GLU 52 17.670 25.182 19.585 412 HB2 GLU 52 HB2 GLU 52 15.842 23.740 18.814 413 HB3 GLU 52 HB3 GLU 52 14.968 23.955 20.300 414 HG2 GLU 52 HG2 GLU 52 13.726 25.121 18.871 415 HG3 GLU 52 HG3 GLU 52 14.646 26.366 19.709 416 H GLN 53 H GLN 53 15.919 24.918 22.682 417 HA GLN 53 HA GLN 53 15.597 27.772 23.075 418 HB2 GLN 53 HB2 GLN 53 14.127 25.998 23.987 419 HB3 GLN 53 HB3 GLN 53 15.433 25.454 25.049 420 HG2 GLN 53 HG2 GLN 53 15.359 27.492 26.324 421 HG3 GLN 53 HG3 GLN 53 14.426 28.308 25.063 422 HE21 GLN 53 HE21 GLN 53 12.821 28.908 26.602 423 HE22 GLN 53 HE22 GLN 53 11.552 27.748 26.966 424 H LEU 54 H LEU 54 18.060 25.355 24.010 425 HA LEU 54 HA LEU 54 19.690 27.178 25.556 426 HB2 LEU 54 HB2 LEU 54 20.501 24.699 23.995 427 HB3 LEU 54 HB3 LEU 54 21.537 25.579 25.074 428 HG LEU 54 HG LEU 54 20.898 24.501 26.872 429 HD11 LEU 54 HD11 LEU 54 17.969 24.436 26.117 430 HD12 LEU 54 HD12 LEU 54 18.686 24.070 27.692 431 HD13 LEU 54 HD13 LEU 54 18.713 25.721 27.069 432 HD21 LEU 54 HD21 LEU 54 20.103 22.315 26.677 433 HD22 LEU 54 HD22 LEU 54 19.331 22.648 25.126 434 HD23 LEU 54 HD23 LEU 54 21.110 22.662 25.264 435 H ARG 55 H ARG 55 19.720 26.286 22.049 436 HA ARG 55 HA ARG 55 21.740 28.155 21.232 437 HB2 ARG 55 HB2 ARG 55 19.296 27.022 19.798 438 HB3 ARG 55 HB3 ARG 55 20.407 28.159 19.032 439 HG2 ARG 55 HG2 ARG 55 22.287 26.611 19.471 440 HG3 ARG 55 HG3 ARG 55 21.183 25.416 20.124 441 HD2 ARG 55 HD2 ARG 55 20.970 26.573 17.306 442 HD3 ARG 55 HD3 ARG 55 21.872 25.122 17.718 443 HE ARG 55 HE ARG 55 19.952 23.891 18.124 444 HH11 ARG 55 HH22 ARG 55 19.007 27.055 16.765 445 HH12 ARG 55 HH21 ARG 55 17.440 26.402 16.376 446 HH21 ARG 55 HH12 ARG 55 18.116 23.199 17.342 447 HH22 ARG 55 HH11 ARG 55 16.940 24.349 16.708 448 H GLY 56 H GLY 56 18.265 28.687 21.794 449 HA2 GLY 56 HA2 GLY 56 18.067 31.402 21.094 450 HA3 GLY 56 HA3 GLY 56 17.114 30.586 22.339 451 H GLU 57 H GLU 57 19.554 30.061 24.099 452 HA GLU 57 HA GLU 57 19.827 32.794 25.229 453 HB2 GLU 57 HB2 GLU 57 20.893 30.105 26.111 454 HB3 GLU 57 HB3 GLU 57 21.196 31.623 26.944 455 HG2 GLU 57 HG2 GLU 57 18.524 30.150 26.759 456 HG3 GLU 57 HG3 GLU 57 19.603 30.466 28.080 457 H ILE 58 H ILE 58 21.930 30.414 23.566 458 HA ILE 58 HA ILE 58 24.330 31.985 23.977 459 HB ILE 58 HB ILE 58 23.853 29.916 21.805 460 HG12 ILE 58 HG12 ILE 58 25.152 29.367 24.514 461 HG13 ILE 58 HG13 ILE 58 23.448 29.061 24.216 462 HG21 ILE 58 HG21 ILE 58 26.458 30.805 23.152 463 HG22 ILE 58 HG22 ILE 58 26.289 29.691 21.777 464 HG23 ILE 58 HG23 ILE 58 25.912 31.394 21.578 465 HD11 ILE 58 HD11 ILE 58 24.057 27.544 22.319 466 HD12 ILE 58 HD12 ILE 58 25.763 27.714 22.800 467 HD13 ILE 58 HD13 ILE 58 24.586 27.005 23.921 468 H TYR 59 H TYR 59 22.090 31.656 21.152 469 HA TYR 59 HA TYR 59 23.674 33.348 19.517 470 HB2 TYR 59 HB2 TYR 59 21.844 31.612 18.876 471 HB3 TYR 59 HB3 TYR 59 20.726 32.964 19.013 472 HD1 TYR 59 HD1 TYR 59 21.120 35.022 17.495 473 HD2 TYR 59 HD2 TYR 59 23.378 31.390 17.116 474 HE1 TYR 59 HE1 TYR 59 21.982 35.791 15.290 475 HE2 TYR 59 HE2 TYR 59 24.284 32.162 14.924 476 HH TYR 59 HH TYR 59 23.472 35.379 13.592 477 H GLN 60 H GLN 60 20.865 34.153 21.633 478 HA GLN 60 HA GLN 60 20.539 36.793 20.526 479 HB2 GLN 60 HB2 GLN 60 19.765 35.622 23.226 480 HB3 GLN 60 HB3 GLN 60 19.227 37.199 22.646 481 HG2 GLN 60 HG2 GLN 60 18.632 34.588 21.174 482 HG3 GLN 60 HG3 GLN 60 17.592 35.278 22.410 483 HE21 GLN 60 HE21 GLN 60 16.024 35.072 20.648 484 HE22 GLN 60 HE22 GLN 60 15.885 36.384 19.487 485 H ALA 61 H ALA 61 22.642 35.541 23.094 486 HA ALA 61 HA ALA 61 23.583 38.215 23.868 487 HB1 ALA 61 HB1 ALA 61 23.275 36.482 25.556 488 HB2 ALA 61 HB2 ALA 61 24.398 35.402 24.700 489 HB3 ALA 61 HB3 ALA 61 24.992 36.905 25.434 490 H TYR 62 H TYR 62 24.908 35.435 21.975 491 HA TYR 62 HA TYR 62 27.444 36.975 21.635 492 HB2 TYR 62 HB2 TYR 62 27.072 33.976 21.653 493 HB3 TYR 62 HB3 TYR 62 28.588 34.865 21.653 494 HD1 TYR 62 HD1 TYR 62 28.873 36.617 23.675 495 HD2 TYR 62 HD2 TYR 62 26.296 33.170 23.709 496 HE1 TYR 62 HE1 TYR 62 28.853 36.646 26.165 497 HE2 TYR 62 HE2 TYR 62 26.256 33.212 26.193 498 HH TYR 62 HH TYR 62 26.923 34.293 28.062 499 H LYS 63 H LYS 63 24.848 36.088 19.723 500 HA LYS 63 HA LYS 63 24.482 35.536 17.601 501 HB2 LYS 63 HB2 LYS 63 26.899 37.311 17.086 502 HB3 LYS 63 HB3 LYS 63 25.731 36.841 15.858 503 HG2 LYS 63 HG2 LYS 63 25.071 38.495 18.323 504 HG3 LYS 63 HG3 LYS 63 25.391 39.125 16.706 505 HD2 LYS 63 HD2 LYS 63 23.448 37.798 15.834 506 HD3 LYS 63 HD3 LYS 63 23.071 37.314 17.507 507 HE2 LYS 63 HE2 LYS 63 22.858 39.697 18.142 508 HE3 LYS 63 HE3 LYS 63 23.230 40.180 16.476 509 HZ1 LYS 63 HZ1 LYS 63 21.217 39.049 15.750 510 HZ2 LYS 63 HZ2 LYS 63 20.894 38.512 17.263 511 HZ3 LYS 63 HZ3 LYS 63 20.817 40.109 16.955 512 H HIS 64 H HIS 64 25.848 33.521 18.874 513 HA HIS 64 HA HIS 64 26.823 32.048 16.508 514 HB2 HIS 64 HB2 HIS 64 28.133 31.874 19.252 515 HB3 HIS 64 HB3 HIS 64 28.478 30.836 17.876 516 HD1 HIS 64 HD1 HIS 64 29.543 32.345 15.624 517 HD2 HIS 64 HD2 HIS 64 29.813 33.797 19.567 518 HE1 HIS 64 HE1 HIS 64 31.402 34.086 15.627 519 H GLU 65 H GLU 65 26.199 29.823 16.558 520 HA GLU 65 HA GLU 65 24.489 28.990 18.895 521 HB2 GLU 65 HB2 GLU 65 23.246 27.535 17.469 522 HB3 GLU 65 HB3 GLU 65 23.153 29.193 16.899 523 HG2 GLU 65 HG2 GLU 65 24.956 28.576 15.186 524 HG3 GLU 65 HG3 GLU 65 24.720 26.897 15.672 525 H THR 66 H THR 66 27.014 27.813 16.640 526 HA THR 66 HA THR 66 28.351 26.739 18.941 527 HB THR 66 HB THR 66 26.853 24.795 18.406 528 HG1 THR 66 HG1 THR 66 28.533 24.149 19.491 529 HG21 THR 66 HG21 THR 66 28.654 24.476 15.973 530 HG22 THR 66 HG22 THR 66 26.928 24.900 15.928 531 HG23 THR 66 HG23 THR 66 27.444 23.328 16.575 532 H VAL 67 H VAL 67 30.462 26.298 18.568 533 HA VAL 67 HA VAL 67 31.765 27.070 16.049 534 HB VAL 67 HB VAL 67 32.771 28.489 18.484 535 HG11 VAL 67 HG11 VAL 67 33.993 28.632 16.324 536 HG12 VAL 67 HG12 VAL 67 32.541 29.299 15.560 537 HG13 VAL 67 HG13 VAL 67 33.383 30.205 16.832 538 HG21 VAL 67 HG21 VAL 67 31.403 30.484 18.051 539 HG22 VAL 67 HG22 VAL 67 30.418 29.566 16.899 540 HG23 VAL 67 HG23 VAL 67 30.421 29.142 18.634 541 HA PRO 68 HA PRO 68 30.949 24.965 19.259 542 HB2 PRO 68 HB2 PRO 68 31.962 23.937 21.494 543 HB3 PRO 68 HB3 PRO 68 31.889 23.014 19.980 544 HG2 PRO 68 HG2 PRO 68 34.261 24.603 21.008 545 HG3 PRO 68 HG3 PRO 68 34.230 22.880 20.503 546 HD2 PRO 68 HD2 PRO 68 34.997 24.783 18.764 547 HD3 PRO 68 HD3 PRO 68 33.907 23.473 18.221 548 H ALA 69 H ALA 69 30.020 25.797 21.217 549 HA ALA 69 HA ALA 69 31.152 28.427 22.071 550 HB1 ALA 69 HB1 ALA 69 28.381 27.207 22.450 551 HB2 ALA 69 HB2 ALA 69 28.894 28.808 23.008 552 HB3 ALA 69 HB3 ALA 69 28.819 28.461 21.270 553 H ILE 70 H ILE 70 32.096 28.594 24.040 554 HA ILE 70 HA ILE 70 32.143 26.192 25.821 555 HB ILE 70 HB ILE 70 34.415 27.924 24.785 556 HG12 ILE 70 HG12 ILE 70 34.203 24.928 24.390 557 HG13 ILE 70 HG13 ILE 70 33.488 26.048 23.240 558 HG21 ILE 70 HG21 ILE 70 35.923 26.397 26.098 559 HG22 ILE 70 HG22 ILE 70 34.875 27.358 27.118 560 HG23 ILE 70 HG23 ILE 70 34.490 25.650 26.823 561 HD11 ILE 70 HD11 ILE 70 35.733 25.366 22.519 562 HD12 ILE 70 HD12 ILE 70 35.646 27.113 22.814 563 HD13 ILE 70 HD13 ILE 70 36.426 26.037 23.994 564 H PHE 71 H PHE 71 32.028 26.617 27.982 565 HA PHE 71 HA PHE 71 32.299 29.443 28.880 566 HB2 PHE 71 HB2 PHE 71 30.063 27.512 29.556 567 HB3 PHE 71 HB3 PHE 71 30.312 29.103 30.264 568 HD1 PHE 71 HD2 PHE 71 29.489 27.355 27.059 569 HD2 PHE 71 HD1 PHE 71 29.459 31.074 29.246 570 HE1 PHE 71 HE2 PHE 71 28.051 28.389 25.307 571 HE2 PHE 71 HE1 PHE 71 27.991 32.071 27.521 572 HZ PHE 71 HZ PHE 71 27.277 30.719 25.550 573 H ILE 72 H ILE 72 33.156 29.776 30.860 574 HA ILE 72 HA ILE 72 33.767 27.424 32.595 575 HB ILE 72 HB ILE 72 35.774 29.604 31.899 576 HG12 ILE 72 HG12 ILE 72 35.563 26.670 31.116 577 HG13 ILE 72 HG13 ILE 72 35.566 28.058 30.041 578 HG21 ILE 72 HG21 ILE 72 35.941 28.868 34.260 579 HG22 ILE 72 HG22 ILE 72 35.964 27.169 33.749 580 HG23 ILE 72 HG23 ILE 72 37.302 28.263 33.346 581 HD11 ILE 72 HD11 ILE 72 37.667 26.926 29.859 582 HD12 ILE 72 HD12 ILE 72 37.946 28.494 30.631 583 HD13 ILE 72 HD13 ILE 72 37.954 26.995 31.601 584 H ASN 73 H ASN 73 32.983 27.731 34.568 585 HA ASN 73 HA ASN 73 31.754 28.700 36.218 586 HB2 ASN 73 HB2 ASN 73 34.145 30.572 36.169 587 HB3 ASN 73 HB3 ASN 73 33.033 30.395 37.522 588 HD21 ASN 73 HD21 ASN 73 35.852 29.918 37.581 589 HD22 ASN 73 HD22 ASN 73 36.115 28.203 37.908 590 H GLY 74 H GLY 74 30.670 29.591 33.750 591 HA2 GLY 74 HA2 GLY 74 28.900 31.029 33.185 592 HA3 GLY 74 HA3 GLY 74 29.302 32.075 34.534 593 H ASN 75 H ASN 75 32.214 31.757 32.901 594 HA ASN 75 HA ASN 75 31.806 34.274 31.375 595 HB2 ASN 75 HB2 ASN 75 34.333 32.729 32.109 596 HB3 ASN 75 HB3 ASN 75 34.300 34.258 31.255 597 HD21 ASN 75 HD21 ASN 75 35.838 34.359 33.382 598 HD22 ASN 75 HD22 ASN 75 35.014 35.049 34.780 599 H PHE 76 H PHE 76 32.346 34.435 29.130 600 HA PHE 76 HA PHE 76 31.855 31.884 27.674 601 HB2 PHE 76 HB2 PHE 76 30.164 33.525 27.363 602 HB3 PHE 76 HB3 PHE 76 31.340 34.786 27.023 603 HD1 PHE 76 HD1 PHE 76 30.385 31.378 25.677 604 HD2 PHE 76 HD2 PHE 76 31.678 35.393 24.786 605 HE1 PHE 76 HE1 PHE 76 30.225 30.895 23.256 606 HE2 PHE 76 HE2 PHE 76 31.531 34.902 22.362 607 HZ PHE 76 HZ PHE 76 30.797 32.652 21.589 608 H ILE 77 H ILE 77 33.027 31.073 26.116 609 HA ILE 77 HA ILE 77 35.252 32.515 24.776 610 HB ILE 77 HB ILE 77 35.274 29.665 25.847 611 HG12 ILE 77 HG12 ILE 77 37.231 31.861 26.594 612 HG13 ILE 77 HG13 ILE 77 35.789 31.519 27.541 613 HG21 ILE 77 HG21 ILE 77 37.564 29.492 24.896 614 HG22 ILE 77 HG22 ILE 77 36.385 29.769 23.634 615 HG23 ILE 77 HG23 ILE 77 37.398 31.115 24.205 616 HD11 ILE 77 HD11 ILE 77 36.509 29.192 27.912 617 HD12 ILE 77 HD12 ILE 77 38.030 29.528 27.057 618 HD13 ILE 77 HD13 ILE 77 37.648 30.387 28.557 619 H GLY 78 H GLY 78 35.172 32.122 22.460 620 HA2 GLY 78 HA2 GLY 78 33.403 29.848 21.583 621 HA3 GLY 78 HA3 GLY 78 33.069 31.447 20.949 622 H GLY 79 H GLY 79 34.531 28.618 20.408 623 HA2 GLY 79 HA2 GLY 79 35.434 28.136 18.151 624 HA3 GLY 79 HA3 GLY 79 36.439 29.582 18.312 625 H CYS 80 H CYS 80 37.242 26.695 17.978 626 HA CYS 80 HA CYS 80 38.440 25.863 20.517 627 HB2 CYS 80 HB2 CYS 80 37.878 24.236 18.730 628 HB3 CYS 80 HB3 CYS 80 39.085 24.994 17.669 629 HG CYS 80 HG CYS 80 41.164 24.590 19.212 630 H SER 81 H SER 81 39.560 27.702 17.621 631 HA SER 81 HA SER 81 42.199 28.212 18.524 632 HB2 SER 81 HB2 SER 81 40.369 30.036 16.919 633 HB3 SER 81 HB3 SER 81 42.143 30.136 17.008 634 HG SER 81 HG SER 81 42.277 28.089 16.090 635 H ASP 82 H ASP 82 39.156 29.768 19.496 636 HA ASP 82 HA ASP 82 40.330 31.991 20.899 637 HB2 ASP 82 HB2 ASP 82 37.908 31.465 19.984 638 HB3 ASP 82 HB3 ASP 82 37.641 30.744 21.551 639 H LEU 83 H LEU 83 39.177 28.799 21.882 640 HA LEU 83 HA LEU 83 39.879 28.911 24.675 641 HB2 LEU 83 HB2 LEU 83 38.360 27.229 23.703 642 HB3 LEU 83 HB3 LEU 83 39.631 26.626 22.669 643 HG LEU 83 HG LEU 83 40.927 25.922 24.682 644 HD11 LEU 83 HD11 LEU 83 39.670 25.647 26.815 645 HD12 LEU 83 HD12 LEU 83 39.897 27.349 26.397 646 HD13 LEU 83 HD13 LEU 83 38.321 26.576 26.127 647 HD21 LEU 83 HD21 LEU 83 39.546 24.362 23.349 648 HD22 LEU 83 HD22 LEU 83 39.676 23.901 25.049 649 HD23 LEU 83 HD23 LEU 83 38.181 24.654 24.451 650 H GLU 84 H GLU 84 41.680 27.649 21.844 651 HA GLU 84 HA GLU 84 44.095 26.880 23.153 652 HB2 GLU 84 HB2 GLU 84 43.505 27.908 20.351 653 HB3 GLU 84 HB3 GLU 84 45.104 27.379 20.856 654 HG2 GLU 84 HG2 GLU 84 44.324 25.119 21.227 655 HG3 GLU 84 HG3 GLU 84 42.650 25.571 20.896 656 H ALA 85 H ALA 85 42.974 30.077 22.035 657 HA ALA 85 HA ALA 85 45.504 31.369 22.217 658 HB1 ALA 85 HB1 ALA 85 43.572 32.289 20.961 659 HB2 ALA 85 HB2 ALA 85 42.664 32.508 22.467 660 HB3 ALA 85 HB3 ALA 85 44.136 33.457 22.168 661 H LEU 86 H LEU 86 42.957 30.799 24.707 662 HA LEU 86 HA LEU 86 44.342 32.382 26.730 663 HB2 LEU 86 HB2 LEU 86 42.176 30.248 26.976 664 HB3 LEU 86 HB3 LEU 86 42.716 31.308 28.274 665 HG LEU 86 HG LEU 86 41.346 32.215 25.700 666 HD11 LEU 86 HD11 LEU 86 39.869 31.015 27.240 667 HD12 LEU 86 HD12 LEU 86 40.349 32.094 28.572 668 HD13 LEU 86 HD13 LEU 86 39.458 32.738 27.175 669 HD21 LEU 86 HD21 LEU 86 42.836 33.995 26.501 670 HD22 LEU 86 HD22 LEU 86 41.152 34.415 26.818 671 HD23 LEU 86 HD23 LEU 86 42.162 33.826 28.151 672 H ASP 87 H ASP 87 44.432 29.009 25.735 673 HA ASP 87 HA ASP 87 46.193 28.021 27.819 674 HB2 ASP 87 HB2 ASP 87 44.802 26.649 26.231 675 HB3 ASP 87 HB3 ASP 87 45.905 27.079 24.945 676 H LYS 88 H LYS 88 46.774 29.607 24.710 677 HA LYS 88 HA LYS 88 49.687 29.698 24.949 678 HB2 LYS 88 HB2 LYS 88 47.604 30.832 23.106 679 HB3 LYS 88 HB3 LYS 88 49.112 31.728 23.229 680 HG2 LYS 88 HG2 LYS 88 49.178 30.110 21.404 681 HG3 LYS 88 HG3 LYS 88 50.427 29.824 22.625 682 HD2 LYS 88 HD2 LYS 88 49.190 27.904 23.533 683 HD3 LYS 88 HD3 LYS 88 47.800 28.285 22.519 684 HE2 LYS 88 HE2 LYS 88 49.033 26.466 21.523 685 HE3 LYS 88 HE3 LYS 88 49.071 27.904 20.487 686 HZ1 LYS 88 HZ1 LYS 88 51.278 27.159 22.343 687 HZ2 LYS 88 HZ2 LYS 88 51.298 26.726 20.778 688 HZ3 LYS 88 HZ3 LYS 88 51.341 28.314 21.189 689 H GLU 89 H GLU 89 47.182 32.144 25.669 690 HA GLU 89 HA GLU 89 49.159 34.073 26.513 691 HB2 GLU 89 HB2 GLU 89 46.128 34.028 26.803 692 HB3 GLU 89 HB3 GLU 89 47.164 35.373 27.304 693 HG2 GLU 89 HG2 GLU 89 48.098 35.450 24.981 694 HG3 GLU 89 HG3 GLU 89 46.844 34.357 24.455 695 H GLY 90 H GLY 90 48.062 31.357 28.168 696 HA2 GLY 90 HA2 GLY 90 48.835 30.568 30.195 697 HA3 GLY 90 HA3 GLY 90 49.638 32.115 30.487 698 H LYS 91 H LYS 91 46.141 31.476 29.933 699 HA LYS 91 HA LYS 91 45.491 32.601 32.640 700 HB2 LYS 91 HB2 LYS 91 44.438 33.012 29.822 701 HB3 LYS 91 HB3 LYS 91 43.423 33.282 31.212 702 HG2 LYS 91 HG2 LYS 91 44.999 34.927 32.141 703 HG3 LYS 91 HG3 LYS 91 46.089 34.678 30.773 704 HD2 LYS 91 HD2 LYS 91 43.216 35.696 30.522 705 HD3 LYS 91 HD3 LYS 91 44.643 36.738 30.616 706 HE2 LYS 91 HE2 LYS 91 45.579 35.722 28.598 707 HE3 LYS 91 HE3 LYS 91 44.178 34.645 28.457 708 HZ1 LYS 91 HZ1 LYS 91 44.006 36.604 27.033 709 HZ2 LYS 91 HZ2 LYS 91 42.782 36.623 28.176 710 HZ3 LYS 91 HZ3 LYS 91 44.071 37.606 28.331 711 H LEU 92 H LEU 92 45.131 29.805 30.686 712 HA LEU 92 HA LEU 92 42.414 29.158 31.663 713 HB2 LEU 92 HB2 LEU 92 43.293 28.983 29.258 714 HB3 LEU 92 HB3 LEU 92 44.346 27.725 29.783 715 HG LEU 92 HG LEU 92 42.451 26.286 30.392 716 HD11 LEU 92 HD11 LEU 92 40.711 27.886 30.978 717 HD12 LEU 92 HD12 LEU 92 40.722 28.560 29.331 718 HD13 LEU 92 HD13 LEU 92 40.149 26.906 29.623 719 HD21 LEU 92 HD21 LEU 92 41.660 25.833 28.101 720 HD22 LEU 92 HD22 LEU 92 42.209 27.441 27.577 721 HD23 LEU 92 HD23 LEU 92 43.383 26.220 28.090 722 H ASP 93 H ASP 93 45.692 28.183 32.335 723 HA ASP 93 HA ASP 93 45.153 26.164 34.223 724 HB2 ASP 93 HB2 ASP 93 47.402 26.927 34.828 725 HB3 ASP 93 HB3 ASP 93 47.248 26.555 33.134 726 H GLY 94 H GLY 94 45.406 29.782 34.488 727 HA2 GLY 94 HA2 GLY 94 44.935 29.952 37.311 728 HA3 GLY 94 HA3 GLY 94 44.653 31.227 36.115 729 H LEU 95 H LEU 95 42.777 29.502 34.562 730 HA LEU 95 HA LEU 95 40.331 30.117 36.032 731 HB2 LEU 95 HB2 LEU 95 40.977 28.971 33.316 732 HB3 LEU 95 HB3 LEU 95 39.353 28.852 33.948 733 HG LEU 95 HG LEU 95 40.825 31.506 33.681 734 HD11 LEU 95 HD11 LEU 95 38.722 30.251 31.867 735 HD12 LEU 95 HD12 LEU 95 39.407 31.877 31.706 736 HD13 LEU 95 HD13 LEU 95 40.445 30.474 31.464 737 HD21 LEU 95 HD21 LEU 95 38.515 32.444 33.848 738 HD22 LEU 95 HD22 LEU 95 37.889 30.821 34.186 739 HD23 LEU 95 HD23 LEU 95 38.995 31.622 35.325 740 H LEU 96 H LEU 96 42.222 27.181 35.623 741 HA LEU 96 HA LEU 96 40.238 25.380 36.676 742 HB2 LEU 96 HB2 LEU 96 43.278 25.284 36.846 743 HB3 LEU 96 HB3 LEU 96 42.248 23.984 37.429 744 HG LEU 96 HG LEU 96 42.304 24.886 34.549 745 HD11 LEU 96 HD11 LEU 96 43.411 22.442 36.021 746 HD12 LEU 96 HD12 LEU 96 43.445 22.680 34.274 747 HD13 LEU 96 HD13 LEU 96 44.377 23.752 35.320 748 HD21 LEU 96 HD21 LEU 96 41.062 22.617 34.383 749 HD22 LEU 96 HD22 LEU 96 40.769 22.756 36.098 750 HD23 LEU 96 HD23 LEU 96 40.119 23.989 34.987 751 H SER 97 H SER 97 41.639 27.937 38.461 752 HA SER 97 HA SER 97 41.967 26.727 41.041 753 HB2 SER 97 HB2 SER 97 41.349 29.585 40.213 754 HB3 SER 97 HB3 SER 97 41.690 29.085 41.880 755 HG SER 97 HG SER 97 43.555 29.801 40.864 Start of MODEL 7 1 H1 GLY 1 H1 GLY 1 10.616 28.714 36.923 2 H2 GLY 1 H2 GLY 1 9.819 29.906 37.735 3 H3 GLY 1 H3 GLY 1 10.767 30.284 36.441 4 HA2 GLY 1 HA2 GLY 1 8.313 28.655 36.312 5 HA3 GLY 1 HA3 GLY 1 8.417 30.372 35.885 6 H ALA 2 H ALA 2 7.497 28.572 34.075 7 HA ALA 2 HA ALA 2 7.664 27.742 32.007 8 HB1 ALA 2 HB1 ALA 2 9.855 29.807 31.591 9 HB2 ALA 2 HB2 ALA 2 8.796 29.083 30.356 10 HB3 ALA 2 HB3 ALA 2 8.110 30.154 31.577 11 H MET 3 H MET 3 10.009 27.453 30.270 12 HA MET 3 HA MET 3 11.111 24.932 31.179 13 HB2 MET 3 HB2 MET 3 10.848 25.262 28.850 14 HB3 MET 3 HB3 MET 3 11.685 26.814 28.882 15 HG2 MET 3 HG2 MET 3 13.037 25.037 27.870 16 HG3 MET 3 HG3 MET 3 13.807 25.791 29.256 17 HE1 MET 3 HE1 MET 3 15.619 23.981 29.413 18 HE2 MET 3 HE2 MET 3 15.295 22.233 29.398 19 HE3 MET 3 HE3 MET 3 14.931 23.219 27.965 20 HA PRO 4 HA PRO 4 14.347 27.103 33.546 21 HB2 PRO 4 HB2 PRO 4 15.138 24.404 34.498 22 HB3 PRO 4 HB3 PRO 4 14.662 25.841 35.441 23 HG2 PRO 4 HG2 PRO 4 13.004 23.670 35.198 24 HG3 PRO 4 HG3 PRO 4 12.357 25.346 35.196 25 HD2 PRO 4 HD2 PRO 4 12.987 23.595 32.799 26 HD3 PRO 4 HD3 PRO 4 11.494 24.488 33.178 27 H SER 5 H SER 5 16.116 27.739 32.458 28 HA SER 5 HA SER 5 17.383 25.858 30.550 29 HB2 SER 5 HB2 SER 5 16.816 28.812 30.394 30 HB3 SER 5 HB3 SER 5 17.805 27.938 29.213 31 HG SER 5 HG SER 5 15.417 28.143 28.818 32 H ILE 6 H ILE 6 19.330 26.725 29.531 33 HA ILE 6 HA ILE 6 21.258 25.494 31.031 34 HB ILE 6 HB ILE 6 22.835 26.193 29.220 35 HG12 ILE 6 HG12 ILE 6 20.504 27.398 27.810 36 HG13 ILE 6 HG13 ILE 6 21.577 28.429 28.751 37 HG21 ILE 6 HG21 ILE 6 20.231 24.872 28.624 38 HG22 ILE 6 HG22 ILE 6 21.602 24.902 27.493 39 HG23 ILE 6 HG23 ILE 6 21.768 24.142 29.077 40 HD11 ILE 6 HD11 ILE 6 22.114 28.449 26.357 41 HD12 ILE 6 HD12 ILE 6 23.451 27.815 27.312 42 HD13 ILE 6 HD13 ILE 6 22.404 26.704 26.378 43 H ALA 7 H ALA 7 20.719 28.967 31.043 44 HA ALA 7 HA ALA 7 23.183 29.974 31.881 45 HB1 ALA 7 HB1 ALA 7 20.359 30.616 32.828 46 HB2 ALA 7 HB2 ALA 7 21.783 31.648 33.111 47 HB3 ALA 7 HB3 ALA 7 21.220 31.355 31.455 48 H SER 8 H SER 8 20.822 28.071 33.826 49 HA SER 8 HA SER 8 22.130 28.515 36.378 50 HB2 SER 8 HB2 SER 8 19.807 27.746 36.138 51 HB3 SER 8 HB3 SER 8 20.363 26.230 35.402 52 HG SER 8 HG SER 8 20.984 25.489 37.264 53 H MET 9 H MET 9 22.728 26.137 33.795 54 HA MET 9 HA MET 9 24.423 24.350 35.297 55 HB2 MET 9 HB2 MET 9 24.521 24.911 32.301 56 HB3 MET 9 HB3 MET 9 25.104 23.482 33.150 57 HG2 MET 9 HG2 MET 9 22.763 22.915 33.779 58 HG3 MET 9 HG3 MET 9 22.200 24.335 32.888 59 HE1 MET 9 HE1 MET 9 20.607 23.176 31.288 60 HE2 MET 9 HE2 MET 9 20.951 21.644 30.460 61 HE3 MET 9 HE3 MET 9 20.876 21.690 32.237 62 H ILE 10 H ILE 10 25.004 27.383 33.549 63 HA ILE 10 HA ILE 10 27.843 27.137 33.358 64 HB ILE 10 HB ILE 10 26.488 29.827 33.506 65 HG12 ILE 10 HG12 ILE 10 24.981 28.636 32.039 66 HG13 ILE 10 HG13 ILE 10 25.939 29.782 31.136 67 HG21 ILE 10 HG21 ILE 10 28.905 29.768 33.254 68 HG22 ILE 10 HG22 ILE 10 28.797 28.668 31.881 69 HG23 ILE 10 HG23 ILE 10 28.183 30.331 31.737 70 HD11 ILE 10 HD11 ILE 10 26.401 26.773 31.207 71 HD12 ILE 10 HD12 ILE 10 25.620 27.688 29.909 72 HD13 ILE 10 HD13 ILE 10 27.339 27.940 30.241 73 H LYS 11 H LYS 11 25.792 28.204 36.010 74 HA LYS 11 HA LYS 11 28.148 29.038 37.633 75 HB2 LYS 11 HB2 LYS 11 25.181 29.031 38.320 76 HB3 LYS 11 HB3 LYS 11 26.478 29.626 39.340 77 HG2 LYS 11 HG2 LYS 11 26.223 31.643 38.398 78 HG3 LYS 11 HG3 LYS 11 26.964 30.975 36.942 79 HD2 LYS 11 HD2 LYS 11 24.544 30.196 36.371 80 HD3 LYS 11 HD3 LYS 11 24.028 31.357 37.590 81 HE2 LYS 11 HE2 LYS 11 25.666 31.945 35.072 82 HE3 LYS 11 HE3 LYS 11 23.959 32.336 35.333 83 HZ1 LYS 11 HZ1 LYS 11 24.658 33.802 37.165 84 HZ2 LYS 11 HZ2 LYS 11 26.240 33.503 36.840 85 HZ3 LYS 11 HZ3 LYS 11 25.318 34.281 35.745 86 H GLY 12 H GLY 12 26.639 26.153 36.882 87 HA2 GLY 12 HA2 GLY 12 26.946 24.857 39.528 88 HA3 GLY 12 HA3 GLY 12 26.199 24.190 38.072 89 H ASN 13 H ASN 13 28.527 24.871 36.324 90 HA ASN 13 HA ASN 13 30.539 22.895 37.343 91 HB2 ASN 13 HB2 ASN 13 29.591 23.196 34.484 92 HB3 ASN 13 HB3 ASN 13 30.607 21.937 35.113 93 HD21 ASN 13 HD21 ASN 13 27.332 23.096 34.734 94 HD22 ASN 13 HD22 ASN 13 26.571 21.587 35.236 95 H LYS 14 H LYS 14 32.728 23.173 36.566 96 HA LYS 14 HA LYS 14 33.421 25.988 36.519 97 HB2 LYS 14 HB2 LYS 14 34.706 24.215 37.696 98 HB3 LYS 14 HB3 LYS 14 35.295 23.616 36.146 99 HG2 LYS 14 HG2 LYS 14 36.737 25.409 35.838 100 HG3 LYS 14 HG3 LYS 14 35.641 26.558 36.597 101 HD2 LYS 14 HD2 LYS 14 37.545 26.456 37.997 102 HD3 LYS 14 HD3 LYS 14 36.223 25.652 38.835 103 HE2 LYS 14 HE2 LYS 14 37.234 23.442 37.854 104 HE3 LYS 14 HE3 LYS 14 38.674 24.440 37.530 105 HZ1 LYS 14 HZ1 LYS 14 38.879 23.419 39.677 106 HZ2 LYS 14 HZ2 LYS 14 38.602 25.027 39.953 107 HZ3 LYS 14 HZ3 LYS 14 37.409 23.912 40.158 108 H VAL 15 H VAL 15 33.598 23.491 33.996 109 HA VAL 15 HA VAL 15 33.688 25.698 31.972 110 HB VAL 15 HB VAL 15 35.023 22.992 31.612 111 HG11 VAL 15 HG11 VAL 15 36.043 24.096 29.636 112 HG12 VAL 15 HG12 VAL 15 34.286 24.008 29.507 113 HG13 VAL 15 HG13 VAL 15 35.057 25.542 29.945 114 HG21 VAL 15 HG21 VAL 15 36.354 24.138 33.244 115 HG22 VAL 15 HG22 VAL 15 37.170 24.331 31.689 116 HG23 VAL 15 HG23 VAL 15 36.232 25.676 32.368 117 H VAL 16 H VAL 16 32.013 25.724 30.614 118 HA VAL 16 HA VAL 16 30.381 23.236 30.232 119 HB VAL 16 HB VAL 16 29.209 26.016 30.570 120 HG11 VAL 16 HG11 VAL 16 27.073 24.668 30.716 121 HG12 VAL 16 HG12 VAL 16 27.823 24.598 29.114 122 HG13 VAL 16 HG13 VAL 16 27.985 23.231 30.245 123 HG21 VAL 16 HG21 VAL 16 28.235 25.040 32.674 124 HG22 VAL 16 HG22 VAL 16 29.227 23.593 32.408 125 HG23 VAL 16 HG23 VAL 16 29.993 25.165 32.755 126 H VAL 17 H VAL 17 29.955 22.713 28.154 127 HA VAL 17 HA VAL 17 30.636 24.676 25.994 128 HB VAL 17 HB VAL 17 31.504 21.776 26.333 129 HG11 VAL 17 HG11 VAL 17 31.989 23.640 23.971 130 HG12 VAL 17 HG12 VAL 17 32.724 22.034 24.209 131 HG13 VAL 17 HG13 VAL 17 30.990 22.164 23.946 132 HG21 VAL 17 HG21 VAL 17 33.036 24.406 26.191 133 HG22 VAL 17 HG22 VAL 17 32.898 23.321 27.589 134 HG23 VAL 17 HG23 VAL 17 33.785 22.796 26.157 135 H PHE 18 H PHE 18 29.357 24.710 24.172 136 HA PHE 18 HA PHE 18 27.118 22.708 24.017 137 HB2 PHE 18 HB2 PHE 18 27.029 25.608 23.155 138 HB3 PHE 18 HB3 PHE 18 25.739 24.433 23.014 139 HD1 PHE 18 HD2 PHE 18 24.590 23.548 25.021 140 HD2 PHE 18 HD1 PHE 18 27.482 26.728 25.271 141 HE1 PHE 18 HE2 PHE 18 23.772 24.118 27.303 142 HE2 PHE 18 HE1 PHE 18 26.601 27.353 27.513 143 HZ PHE 18 HZ PHE 18 24.707 26.076 28.488 144 H SER 19 H SER 19 26.935 21.581 22.195 145 HA SER 19 HA SER 19 28.699 22.222 19.853 146 HB2 SER 19 HB2 SER 19 28.542 19.583 21.350 147 HB3 SER 19 HB3 SER 19 29.640 20.019 20.030 148 HG SER 19 HG SER 19 30.846 20.415 21.719 149 H TRP 20 H TRP 20 28.512 20.681 18.013 150 HA TRP 20 HA TRP 20 25.763 19.499 17.689 151 HB2 TRP 20 HB2 TRP 20 27.069 21.666 16.141 152 HB3 TRP 20 HB3 TRP 20 26.463 20.353 15.166 153 HD1 TRP 20 HD1 TRP 20 24.195 21.035 18.125 154 HE1 TRP 20 HE1 TRP 20 22.020 22.102 17.242 155 HE3 TRP 20 HE3 TRP 20 25.762 22.375 13.423 156 HZ2 TRP 20 HZ2 TRP 20 21.079 23.291 14.832 157 HZ3 TRP 20 HZ3 TRP 20 24.217 23.567 11.888 158 HH2 TRP 20 HH2 TRP 20 21.867 24.017 12.567 159 H VAL 21 H VAL 21 25.627 17.514 16.690 160 HA VAL 21 HA VAL 21 28.180 16.097 16.452 161 HB VAL 21 HB VAL 21 26.827 14.059 16.086 162 HG11 VAL 21 HG11 VAL 21 26.377 13.732 18.406 163 HG12 VAL 21 HG12 VAL 21 27.828 14.728 18.267 164 HG13 VAL 21 HG13 VAL 21 26.272 15.475 18.704 165 HG21 VAL 21 HG21 VAL 21 24.476 15.745 17.052 166 HG22 VAL 21 HG22 VAL 21 24.642 15.061 15.422 167 HG23 VAL 21 HG23 VAL 21 24.506 13.991 16.814 168 H THR 22 H THR 22 28.277 15.652 12.894 169 HA THR 22 HA THR 22 29.833 16.059 15.425 170 HB THR 22 HB THR 22 31.642 14.779 14.252 171 HG1 THR 22 HG1 THR 22 29.539 13.630 12.791 172 HG21 THR 22 HG21 THR 22 29.108 13.264 15.009 173 HG22 THR 22 HG22 THR 22 30.425 13.757 16.093 174 HG23 THR 22 HG23 THR 22 30.727 12.551 14.833 175 H CYS 23 H CYS 23 31.562 17.452 15.360 176 HA CYS 23 HA CYS 23 31.722 19.154 12.901 177 HB2 CYS 23 HB2 CYS 23 31.511 19.964 15.806 178 HB3 CYS 23 HB3 CYS 23 32.058 21.046 14.512 179 HG CYS 23 HG CYS 23 29.207 19.406 14.793 180 HA PRO 24 HA PRO 24 36.013 18.000 13.386 181 HB2 PRO 24 HB2 PRO 24 37.134 19.579 11.406 182 HB3 PRO 24 HB3 PRO 24 36.292 18.025 11.143 183 HG2 PRO 24 HG2 PRO 24 35.158 20.822 10.901 184 HG3 PRO 24 HG3 PRO 24 34.976 19.448 9.766 185 HD2 PRO 24 HD2 PRO 24 33.065 20.092 11.558 186 HD3 PRO 24 HD3 PRO 24 33.434 18.376 11.203 187 H TYR 25 H TYR 25 34.845 21.239 14.026 188 HA TYR 25 HA TYR 25 37.257 21.868 15.601 189 HB2 TYR 25 HB2 TYR 25 34.502 23.144 15.455 190 HB3 TYR 25 HB3 TYR 25 35.777 23.720 16.493 191 HD1 TYR 25 HD1 TYR 25 38.170 23.408 14.514 192 HD2 TYR 25 HD2 TYR 25 34.251 25.210 14.215 193 HE1 TYR 25 HE1 TYR 25 39.015 24.967 12.801 194 HE2 TYR 25 HE2 TYR 25 35.119 26.784 12.505 195 HH TYR 25 HH TYR 25 36.919 27.411 11.242 196 H CYS 26 H CYS 26 33.887 20.753 16.562 197 HA CYS 26 HA CYS 26 34.448 21.095 19.280 198 HB2 CYS 26 HB2 CYS 26 32.242 20.732 18.270 199 HB3 CYS 26 HB3 CYS 26 32.571 18.995 18.112 200 HG CYS 26 HG CYS 26 33.269 18.672 20.680 201 H VAL 27 H VAL 27 35.230 18.284 17.317 202 HA VAL 27 HA VAL 27 36.198 16.408 19.139 203 HB VAL 27 HB VAL 27 36.045 16.346 16.810 204 HG11 VAL 27 HG11 VAL 27 37.355 16.900 15.137 205 HG12 VAL 27 HG12 VAL 27 36.901 18.324 16.078 206 HG13 VAL 27 HG13 VAL 27 38.565 17.626 16.215 207 HG21 VAL 27 HG21 VAL 27 38.835 15.514 17.717 208 HG22 VAL 27 HG22 VAL 27 37.355 14.580 18.038 209 HG23 VAL 27 HG23 VAL 27 37.931 14.782 16.375 210 H ARG 28 H ARG 28 37.863 18.783 17.581 211 HA ARG 28 HA ARG 28 40.407 18.798 18.885 212 HB2 ARG 28 HB2 ARG 28 39.192 21.475 18.058 213 HB3 ARG 28 HB3 ARG 28 40.875 21.048 18.276 214 HG2 ARG 28 HG2 ARG 28 40.505 19.321 16.387 215 HG3 ARG 28 HG3 ARG 28 38.981 20.161 16.102 216 HD2 ARG 28 HD2 ARG 28 40.648 21.047 14.568 217 HD3 ARG 28 HD3 ARG 28 40.229 22.296 15.743 218 HE ARG 28 HE ARG 28 42.683 20.558 15.879 219 HH11 ARG 28 HH22 ARG 28 41.438 23.815 16.500 220 HH12 ARG 28 HH21 ARG 28 42.703 24.047 17.714 221 HH21 ARG 28 HH12 ARG 28 44.249 21.099 17.253 222 HH22 ARG 28 HH11 ARG 28 44.226 22.667 18.043 223 H ALA 29 H ALA 29 37.576 20.668 19.906 224 HA ALA 29 HA ALA 29 38.837 21.746 22.289 225 HB1 ALA 29 HB1 ALA 29 36.898 22.826 21.234 226 HB2 ALA 29 HB2 ALA 29 35.880 21.421 21.622 227 HB3 ALA 29 HB3 ALA 29 36.567 22.413 22.926 228 H GLU 30 H GLU 30 36.504 18.976 21.896 229 HA GLU 30 HA GLU 30 36.498 18.213 24.654 230 HB2 GLU 30 HB2 GLU 30 36.080 16.565 22.112 231 HB3 GLU 30 HB3 GLU 30 35.813 15.967 23.748 232 HG2 GLU 30 HG2 GLU 30 34.154 17.888 24.071 233 HG3 GLU 30 HG3 GLU 30 34.229 18.136 22.315 234 H LYS 31 H LYS 31 38.762 17.352 22.136 235 HA LYS 31 HA LYS 31 40.150 15.379 23.706 236 HB2 LYS 31 HB2 LYS 31 40.272 15.295 21.328 237 HB3 LYS 31 HB3 LYS 31 40.728 16.975 21.191 238 HG2 LYS 31 HG2 LYS 31 42.696 15.263 22.655 239 HG3 LYS 31 HG3 LYS 31 42.424 14.821 20.977 240 HD2 LYS 31 HD2 LYS 31 43.329 17.571 21.934 241 HD3 LYS 31 HD3 LYS 31 44.318 16.327 21.162 242 HE2 LYS 31 HE2 LYS 31 42.685 16.457 19.167 243 HE3 LYS 31 HE3 LYS 31 42.025 17.911 19.933 244 HZ1 LYS 31 HZ1 LYS 31 43.767 18.344 18.254 245 HZ2 LYS 31 HZ2 LYS 31 44.106 19.010 19.696 246 HZ3 LYS 31 HZ3 LYS 31 44.880 17.616 19.206 247 H LEU 32 H LEU 32 40.906 18.789 22.992 248 HA LEU 32 HA LEU 32 43.264 18.990 24.594 249 HB2 LEU 32 HB2 LEU 32 42.155 20.529 22.777 250 HB3 LEU 32 HB3 LEU 32 41.266 21.177 24.148 251 HG LEU 32 HG LEU 32 43.086 22.597 23.512 252 HD11 LEU 32 HD11 LEU 32 42.616 22.453 25.956 253 HD12 LEU 32 HD12 LEU 32 43.970 21.301 26.095 254 HD13 LEU 32 HD13 LEU 32 44.269 22.958 25.557 255 HD21 LEU 32 HD21 LEU 32 44.533 20.859 22.472 256 HD22 LEU 32 HD22 LEU 32 45.417 21.974 23.527 257 HD23 LEU 32 HD23 LEU 32 45.032 20.335 24.094 258 H LEU 33 H LEU 33 39.847 19.737 25.376 259 HA LEU 33 HA LEU 33 40.326 20.831 27.934 260 HB2 LEU 33 HB2 LEU 33 37.891 19.441 26.716 261 HB3 LEU 33 HB3 LEU 33 37.814 20.260 28.264 262 HG LEU 33 HG LEU 33 38.624 21.619 25.677 263 HD11 LEU 33 HD11 LEU 33 36.255 20.855 25.603 264 HD12 LEU 33 HD12 LEU 33 35.947 21.963 26.969 265 HD13 LEU 33 HD13 LEU 33 36.522 22.595 25.429 266 HD21 LEU 33 HD21 LEU 33 38.089 23.718 26.916 267 HD22 LEU 33 HD22 LEU 33 37.851 22.753 28.381 268 HD23 LEU 33 HD23 LEU 33 39.457 22.841 27.604 269 H HIS 34 H HIS 34 39.626 17.455 27.056 270 HA HIS 34 HA HIS 34 39.800 16.460 29.783 271 HB2 HIS 34 HB2 HIS 34 39.721 15.138 27.046 272 HB3 HIS 34 HB3 HIS 34 39.823 14.249 28.562 273 HD1 HIS 34 HD1 HIS 34 37.500 13.284 29.100 274 HD2 HIS 34 HD2 HIS 34 37.376 17.134 27.409 275 HE1 HIS 34 HE1 HIS 34 35.049 13.981 29.031 276 H ALA 35 H ALA 35 42.161 16.931 27.094 277 HA ALA 35 HA ALA 35 44.162 15.222 28.335 278 HB1 ALA 35 HB1 ALA 35 44.394 17.358 26.171 279 HB2 ALA 35 HB2 ALA 35 45.618 16.131 26.565 280 HB3 ALA 35 HB3 ALA 35 44.048 15.633 25.913 281 H ARG 36 H ARG 36 43.351 18.589 28.602 282 HA ARG 36 HA ARG 36 45.699 19.198 30.345 283 HB2 ARG 36 HB2 ARG 36 44.033 20.814 28.418 284 HB3 ARG 36 HB3 ARG 36 45.035 21.572 29.630 285 HG2 ARG 36 HG2 ARG 36 46.247 19.566 27.723 286 HG3 ARG 36 HG3 ARG 36 46.110 21.277 27.304 287 HD2 ARG 36 HD2 ARG 36 47.393 20.373 29.905 288 HD3 ARG 36 HD3 ARG 36 48.311 20.520 28.393 289 HE ARG 36 HE ARG 36 47.355 22.944 28.385 290 HH11 ARG 36 HH12 ARG 36 48.388 21.382 31.406 291 HH12 ARG 36 HH11 ARG 36 48.854 22.918 32.069 292 HH21 ARG 36 HH22 ARG 36 47.806 24.676 29.269 293 HH22 ARG 36 HH21 ARG 36 48.321 24.823 30.958 294 H THR 37 H THR 37 43.065 18.154 31.060 295 HA THR 37 HA THR 37 41.875 17.923 32.959 296 HB THR 37 HB THR 37 43.264 19.916 34.583 297 HG1 THR 37 HG1 THR 37 44.666 17.773 33.404 298 HG21 THR 37 HG21 THR 37 42.978 16.879 34.876 299 HG22 THR 37 HG22 THR 37 41.807 18.059 35.487 300 HG23 THR 37 HG23 THR 37 43.438 18.016 36.160 301 H LYS 38 H LYS 38 40.888 19.990 31.164 302 HA LYS 38 HA LYS 38 39.770 22.067 32.966 303 HB2 LYS 38 HB2 LYS 38 39.242 21.300 30.076 304 HB3 LYS 38 HB3 LYS 38 38.152 22.300 31.021 305 HG2 LYS 38 HG2 LYS 38 39.542 23.812 29.809 306 HG3 LYS 38 HG3 LYS 38 40.056 23.904 31.469 307 HD2 LYS 38 HD2 LYS 38 41.665 21.945 29.904 308 HD3 LYS 38 HD3 LYS 38 41.662 23.553 29.184 309 HE2 LYS 38 HE2 LYS 38 42.180 24.443 31.575 310 HE3 LYS 38 HE3 LYS 38 42.519 22.758 31.966 311 HZ1 LYS 38 HZ1 LYS 38 44.519 23.996 31.395 312 HZ2 LYS 38 HZ2 LYS 38 44.300 22.697 30.527 313 HZ3 LYS 38 HZ3 LYS 38 44.061 24.167 29.820 314 H ASP 39 H ASP 39 38.520 21.363 34.497 315 HA ASP 39 HA ASP 39 36.952 19.067 34.411 316 HB2 ASP 39 HB2 ASP 39 37.787 20.438 36.413 317 HB3 ASP 39 HB3 ASP 39 36.390 21.475 36.200 318 H ILE 40 H ILE 40 35.571 18.749 32.873 319 HA ILE 40 HA ILE 40 33.935 21.020 31.886 320 HB ILE 40 HB ILE 40 36.085 20.547 30.792 321 HG12 ILE 40 HG12 ILE 40 33.703 21.225 29.527 322 HG13 ILE 40 HG13 ILE 40 35.347 21.549 29.046 323 HG21 ILE 40 HG21 ILE 40 36.117 18.070 31.066 324 HG22 ILE 40 HG22 ILE 40 34.897 17.920 29.811 325 HG23 ILE 40 HG23 ILE 40 36.499 18.588 29.434 326 HD11 ILE 40 HD11 ILE 40 35.420 19.601 27.593 327 HD12 ILE 40 HD12 ILE 40 33.805 19.080 28.157 328 HD13 ILE 40 HD13 ILE 40 33.991 20.569 27.220 329 H THR 41 H THR 41 32.059 20.943 31.114 330 HA THR 41 HA THR 41 30.512 18.381 30.882 331 HB THR 41 HB THR 41 29.835 21.122 32.028 332 HG1 THR 41 HG1 THR 41 30.901 19.816 33.445 333 HG21 THR 41 HG21 THR 41 27.627 20.107 32.623 334 HG22 THR 41 HG22 THR 41 27.990 18.759 31.516 335 HG23 THR 41 HG23 THR 41 27.842 20.428 30.897 336 H VAL 42 H VAL 42 30.025 18.074 28.691 337 HA VAL 42 HA VAL 42 29.267 20.451 27.117 338 HB VAL 42 HB VAL 42 30.926 19.788 25.913 339 HG11 VAL 42 HG11 VAL 42 31.861 18.198 27.260 340 HG12 VAL 42 HG12 VAL 42 30.684 16.938 26.752 341 HG13 VAL 42 HG13 VAL 42 31.886 17.599 25.608 342 HG21 VAL 42 HG21 VAL 42 29.061 19.491 24.353 343 HG22 VAL 42 HG22 VAL 42 30.428 18.451 23.964 344 HG23 VAL 42 HG23 VAL 42 29.011 17.753 24.766 345 H HIS 43 H HIS 43 27.498 20.713 26.055 346 HA HIS 43 HA HIS 43 25.399 18.586 26.078 347 HB2 HIS 43 HB2 HIS 43 24.926 20.667 27.387 348 HB3 HIS 43 HB3 HIS 43 25.081 21.590 25.919 349 HD1 HIS 43 HD1 HIS 43 23.197 18.344 25.320 350 HD2 HIS 43 HD2 HIS 43 22.427 22.283 26.605 351 HE1 HIS 43 HE1 HIS 43 20.722 18.730 25.003 352 H TYR 44 H TYR 44 25.459 17.579 24.123 353 HA TYR 44 HA TYR 44 25.924 19.098 21.629 354 HB2 TYR 44 HB2 TYR 44 25.627 16.194 22.333 355 HB3 TYR 44 HB3 TYR 44 25.309 16.750 20.696 356 HD1 TYR 44 HD1 TYR 44 26.969 17.733 19.283 357 HD2 TYR 44 HD2 TYR 44 28.009 16.199 23.162 358 HE1 TYR 44 HE1 TYR 44 29.356 17.532 18.558 359 HE2 TYR 44 HE2 TYR 44 30.405 16.094 22.482 360 HH TYR 44 HH TYR 44 31.927 16.336 20.713 361 H VAL 45 H VAL 45 24.229 20.548 21.507 362 HA VAL 45 HA VAL 45 21.528 19.906 22.141 363 HB VAL 45 HB VAL 45 20.919 22.098 21.234 364 HG11 VAL 45 HG11 VAL 45 23.362 22.182 23.032 365 HG12 VAL 45 HG12 VAL 45 22.164 23.480 22.814 366 HG13 VAL 45 HG13 VAL 45 21.658 21.965 23.537 367 HG21 VAL 45 HG21 VAL 45 22.708 23.664 20.490 368 HG22 VAL 45 HG22 VAL 45 23.874 22.337 20.473 369 HG23 VAL 45 HG23 VAL 45 22.478 22.333 19.366 370 H ASP 46 H ASP 46 22.930 18.608 19.552 371 HA ASP 46 HA ASP 46 20.415 18.574 17.915 372 HB2 ASP 46 HB2 ASP 46 22.495 19.198 16.746 373 HB3 ASP 46 HB3 ASP 46 23.216 17.659 17.195 374 H LYS 47 H LYS 47 22.182 16.711 20.237 375 HA LYS 47 HA LYS 47 21.278 14.032 19.404 376 HB2 LYS 47 HB2 LYS 47 22.664 15.025 21.884 377 HB3 LYS 47 HB3 LYS 47 22.110 13.370 21.604 378 HG2 LYS 47 HG2 LYS 47 23.441 13.682 19.277 379 HG3 LYS 47 HG3 LYS 47 24.339 14.851 20.241 380 HD2 LYS 47 HD2 LYS 47 23.856 11.918 20.792 381 HD3 LYS 47 HD3 LYS 47 25.407 12.671 20.362 382 HE2 LYS 47 HE2 LYS 47 25.147 14.060 22.515 383 HE3 LYS 47 HE3 LYS 47 23.841 12.964 22.965 384 HZ1 LYS 47 HZ1 LYS 47 26.666 12.186 22.510 385 HZ2 LYS 47 HZ2 LYS 47 25.846 12.136 23.942 386 HZ3 LYS 47 HZ3 LYS 47 25.446 11.115 22.720 387 H MET 48 H MET 48 20.110 16.545 21.536 388 HA MET 48 HA MET 48 17.950 14.780 22.587 389 HB2 MET 48 HB2 MET 48 19.689 15.237 24.231 390 HB3 MET 48 HB3 MET 48 19.481 16.979 24.026 391 HG2 MET 48 HG2 MET 48 17.173 15.197 24.841 392 HG3 MET 48 HG3 MET 48 18.348 15.733 26.034 393 HE1 MET 48 HE1 MET 48 17.539 19.365 26.774 394 HE2 MET 48 HE2 MET 48 17.906 17.792 27.510 395 HE3 MET 48 HE3 MET 48 18.973 18.462 26.258 396 H SER 49 H SER 49 15.906 15.456 22.416 397 HA SER 49 HA SER 49 15.108 17.016 20.377 398 HB2 SER 49 HB2 SER 49 13.408 16.693 22.875 399 HB3 SER 49 HB3 SER 49 12.859 16.838 21.200 400 HG SER 49 HG SER 49 12.787 14.720 21.926 401 H GLU 50 H GLU 50 15.340 18.241 23.718 402 HA GLU 50 HA GLU 50 14.005 20.730 23.160 403 HB2 GLU 50 HB2 GLU 50 14.480 19.286 25.436 404 HB3 GLU 50 HB3 GLU 50 15.804 20.446 25.551 405 HG2 GLU 50 HG2 GLU 50 14.007 21.350 26.788 406 HG3 GLU 50 HG3 GLU 50 14.051 22.291 25.297 407 H GLY 51 H GLY 51 17.257 19.792 22.585 408 HA2 GLY 51 HA2 GLY 51 18.869 21.893 23.256 409 HA3 GLY 51 HA3 GLY 51 19.065 20.888 21.832 410 H GLU 52 H GLU 52 16.486 22.019 20.634 411 HA GLU 52 HA GLU 52 17.614 24.243 19.159 412 HB2 GLU 52 HB2 GLU 52 14.733 23.343 19.568 413 HB3 GLU 52 HB3 GLU 52 15.241 24.560 18.397 414 HG2 GLU 52 HG2 GLU 52 16.257 21.680 18.363 415 HG3 GLU 52 HG3 GLU 52 14.845 22.245 17.482 416 H GLN 53 H GLN 53 15.633 24.088 22.127 417 HA GLN 53 HA GLN 53 15.213 26.969 22.333 418 HB2 GLN 53 HB2 GLN 53 15.116 24.773 24.456 419 HB3 GLN 53 HB3 GLN 53 14.669 26.456 24.695 420 HG2 GLN 53 HG2 GLN 53 12.906 26.153 22.871 421 HG3 GLN 53 HG3 GLN 53 13.249 24.417 22.943 422 HE21 GLN 53 HE21 GLN 53 11.928 23.257 24.456 423 HE22 GLN 53 HE22 GLN 53 11.219 24.016 25.858 424 H LEU 54 H LEU 54 17.661 24.661 23.604 425 HA LEU 54 HA LEU 54 18.968 26.689 25.213 426 HB2 LEU 54 HB2 LEU 54 20.004 23.941 24.396 427 HB3 LEU 54 HB3 LEU 54 20.675 25.023 25.616 428 HG LEU 54 HG LEU 54 19.568 23.493 26.915 429 HD11 LEU 54 HD11 LEU 54 17.263 25.434 26.515 430 HD12 LEU 54 HD12 LEU 54 17.753 24.590 27.997 431 HD13 LEU 54 HD13 LEU 54 18.757 25.897 27.338 432 HD21 LEU 54 HD21 LEU 54 17.359 22.580 26.630 433 HD22 LEU 54 HD22 LEU 54 17.178 23.431 25.089 434 HD23 LEU 54 HD23 LEU 54 18.433 22.175 25.301 435 H ARG 55 H ARG 55 19.534 25.439 21.940 436 HA ARG 55 HA ARG 55 21.840 26.963 21.220 437 HB2 ARG 55 HB2 ARG 55 21.043 25.068 19.979 438 HB3 ARG 55 HB3 ARG 55 19.412 25.714 19.872 439 HG2 ARG 55 HG2 ARG 55 20.007 27.346 18.325 440 HG3 ARG 55 HG3 ARG 55 21.755 26.980 18.448 441 HD2 ARG 55 HD2 ARG 55 21.378 24.720 17.571 442 HD3 ARG 55 HD3 ARG 55 19.633 24.961 17.575 443 HE ARG 55 HE ARG 55 21.506 26.531 15.812 444 HH11 ARG 55 HH12 ARG 55 18.574 24.456 15.858 445 HH12 ARG 55 HH11 ARG 55 18.344 24.863 14.164 446 HH21 ARG 55 HH22 ARG 55 21.020 26.847 13.796 447 HH22 ARG 55 HH21 ARG 55 19.600 26.070 13.072 448 H GLY 56 H GLY 56 18.341 27.737 21.220 449 HA2 GLY 56 HA2 GLY 56 18.527 30.446 20.340 450 HA3 GLY 56 HA3 GLY 56 17.254 29.752 21.349 451 H GLU 57 H GLU 57 18.942 29.050 23.700 452 HA GLU 57 HA GLU 57 18.927 31.665 24.920 453 HB2 GLU 57 HB2 GLU 57 19.898 28.969 25.902 454 HB3 GLU 57 HB3 GLU 57 20.002 30.436 26.867 455 HG2 GLU 57 HG2 GLU 57 17.505 29.045 25.883 456 HG3 GLU 57 HG3 GLU 57 18.056 29.285 27.531 457 H ILE 58 H ILE 58 21.540 29.752 23.510 458 HA ILE 58 HA ILE 58 23.659 31.557 24.364 459 HB ILE 58 HB ILE 58 23.639 29.823 21.869 460 HG12 ILE 58 HG12 ILE 58 24.803 28.905 24.531 461 HG13 ILE 58 HG13 ILE 58 23.160 28.499 24.058 462 HG21 ILE 58 HG21 ILE 58 26.078 29.897 22.080 463 HG22 ILE 58 HG22 ILE 58 25.471 31.546 22.089 464 HG23 ILE 58 HG23 ILE 58 25.957 30.789 23.615 465 HD11 ILE 58 HD11 ILE 58 25.684 27.686 22.601 466 HD12 ILE 58 HD12 ILE 58 24.483 26.663 23.417 467 HD13 ILE 58 HD13 ILE 58 24.051 27.499 21.922 468 H TYR 59 H TYR 59 21.710 31.217 21.331 469 HA TYR 59 HA TYR 59 23.065 33.306 20.029 470 HB2 TYR 59 HB2 TYR 59 21.576 31.400 19.092 471 HB3 TYR 59 HB3 TYR 59 20.266 32.573 19.227 472 HD1 TYR 59 HD2 TYR 59 20.515 34.814 17.984 473 HD2 TYR 59 HD1 TYR 59 23.271 31.539 17.421 474 HE1 TYR 59 HE2 TYR 59 21.452 35.939 15.975 475 HE2 TYR 59 HE1 TYR 59 24.212 32.664 15.422 476 HH TYR 59 HH TYR 59 23.034 35.900 14.364 477 H GLN 60 H GLN 60 19.991 33.526 21.904 478 HA GLN 60 HA GLN 60 19.490 36.237 21.175 479 HB2 GLN 60 HB2 GLN 60 18.647 34.651 23.626 480 HB3 GLN 60 HB3 GLN 60 18.069 36.282 23.283 481 HG2 GLN 60 HG2 GLN 60 17.681 33.894 21.440 482 HG3 GLN 60 HG3 GLN 60 16.487 34.500 22.572 483 HE21 GLN 60 HE21 GLN 60 15.807 34.225 20.014 484 HE22 GLN 60 HE22 GLN 60 15.601 35.791 19.222 485 H ALA 61 H ALA 61 21.608 34.971 23.742 486 HA ALA 61 HA ALA 61 22.053 37.663 24.865 487 HB1 ALA 61 HB1 ALA 61 23.522 36.427 26.432 488 HB2 ALA 61 HB2 ALA 61 21.877 35.770 26.370 489 HB3 ALA 61 HB3 ALA 61 23.198 34.927 25.533 490 H TYR 62 H TYR 62 23.928 35.289 22.927 491 HA TYR 62 HA TYR 62 26.239 37.176 22.906 492 HB2 TYR 62 HB2 TYR 62 26.255 34.171 22.529 493 HB3 TYR 62 HB3 TYR 62 27.640 35.225 22.786 494 HD1 TYR 62 HD2 TYR 62 27.608 36.648 25.035 495 HD2 TYR 62 HD1 TYR 62 25.346 33.046 24.381 496 HE1 TYR 62 HE2 TYR 62 27.294 36.383 27.496 497 HE2 TYR 62 HE1 TYR 62 25.030 32.780 26.833 498 HH TYR 62 HH TYR 62 25.406 33.704 28.918 499 H LYS 63 H LYS 63 23.864 36.185 20.794 500 HA LYS 63 HA LYS 63 23.594 35.914 18.596 501 HB2 LYS 63 HB2 LYS 63 25.736 38.053 18.412 502 HB3 LYS 63 HB3 LYS 63 24.600 37.649 17.131 503 HG2 LYS 63 HG2 LYS 63 23.782 38.697 19.882 504 HG3 LYS 63 HG3 LYS 63 24.078 39.719 18.494 505 HD2 LYS 63 HD2 LYS 63 21.927 37.553 18.517 506 HD3 LYS 63 HD3 LYS 63 21.669 39.238 18.986 507 HE2 LYS 63 HE2 LYS 63 22.593 39.930 16.721 508 HE3 LYS 63 HE3 LYS 63 22.540 38.232 16.245 509 HZ1 LYS 63 HZ1 LYS 63 20.183 39.835 17.128 510 HZ2 LYS 63 HZ2 LYS 63 20.555 39.435 15.564 511 HZ3 LYS 63 HZ3 LYS 63 20.115 38.281 16.631 512 H HIS 64 H HIS 64 25.190 33.986 19.681 513 HA HIS 64 HA HIS 64 26.551 32.884 17.309 514 HB2 HIS 64 HB2 HIS 64 27.699 33.053 20.157 515 HB3 HIS 64 HB3 HIS 64 28.246 31.860 18.994 516 HD1 HIS 64 HD1 HIS 64 28.360 35.702 19.430 517 HD2 HIS 64 HD2 HIS 64 30.165 32.485 17.405 518 HE1 HIS 64 HE1 HIS 64 30.508 36.620 18.382 519 H GLU 65 H GLU 65 26.749 30.690 17.260 520 HA GLU 65 HA GLU 65 24.313 29.529 18.550 521 HB2 GLU 65 HB2 GLU 65 24.390 30.493 16.078 522 HB3 GLU 65 HB3 GLU 65 25.154 29.042 15.694 523 HG2 GLU 65 HG2 GLU 65 23.247 27.834 16.931 524 HG3 GLU 65 HG3 GLU 65 22.500 29.444 17.041 525 H THR 66 H THR 66 26.663 27.913 16.370 526 HA THR 66 HA THR 66 27.823 26.577 18.739 527 HB THR 66 HB THR 66 28.012 24.408 17.638 528 HG1 THR 66 HG1 THR 66 25.991 25.199 15.837 529 HG21 THR 66 HG21 THR 66 26.161 24.756 19.243 530 HG22 THR 66 HG22 THR 66 25.773 23.567 17.987 531 HG23 THR 66 HG23 THR 66 25.090 25.205 17.899 532 H VAL 67 H VAL 67 29.919 26.102 18.549 533 HA VAL 67 HA VAL 67 31.468 26.750 16.111 534 HB VAL 67 HB VAL 67 31.633 28.265 18.723 535 HG11 VAL 67 HG11 VAL 67 33.957 27.631 18.320 536 HG12 VAL 67 HG12 VAL 67 33.810 28.077 16.603 537 HG13 VAL 67 HG13 VAL 67 33.734 29.320 17.870 538 HG21 VAL 67 HG21 VAL 67 30.234 29.272 17.000 539 HG22 VAL 67 HG22 VAL 67 31.705 30.215 17.202 540 HG23 VAL 67 HG23 VAL 67 31.549 29.126 15.812 541 HA PRO 68 HA PRO 68 30.326 24.841 19.494 542 HB2 PRO 68 HB2 PRO 68 31.379 23.891 21.776 543 HB3 PRO 68 HB3 PRO 68 31.126 22.865 20.333 544 HG2 PRO 68 HG2 PRO 68 33.695 24.280 21.151 545 HG3 PRO 68 HG3 PRO 68 33.465 22.532 20.807 546 HD2 PRO 68 HD2 PRO 68 34.314 24.191 18.864 547 HD3 PRO 68 HD3 PRO 68 33.084 22.957 18.484 548 H ALA 69 H ALA 69 29.621 25.910 21.493 549 HA ALA 69 HA ALA 69 31.012 28.519 21.907 550 HB1 ALA 69 HB1 ALA 69 28.605 28.581 21.328 551 HB2 ALA 69 HB2 ALA 69 28.234 27.589 22.756 552 HB3 ALA 69 HB3 ALA 69 28.900 29.218 22.958 553 H ILE 70 H ILE 70 31.963 29.068 23.854 554 HA ILE 70 HA ILE 70 32.233 26.855 25.851 555 HB ILE 70 HB ILE 70 34.353 28.676 24.656 556 HG12 ILE 70 HG12 ILE 70 34.340 25.653 24.386 557 HG13 ILE 70 HG13 ILE 70 33.441 26.629 23.239 558 HG21 ILE 70 HG21 ILE 70 34.911 28.186 26.985 559 HG22 ILE 70 HG22 ILE 70 34.603 26.453 26.735 560 HG23 ILE 70 HG23 ILE 70 35.974 27.255 25.943 561 HD11 ILE 70 HD11 ILE 70 35.432 27.870 22.583 562 HD12 ILE 70 HD12 ILE 70 36.413 26.957 23.747 563 HD13 ILE 70 HD13 ILE 70 35.663 26.124 22.371 564 H PHE 71 H PHE 71 32.018 27.351 27.916 565 HA PHE 71 HA PHE 71 32.251 30.188 28.808 566 HB2 PHE 71 HB2 PHE 71 30.155 28.147 29.610 567 HB3 PHE 71 HB3 PHE 71 30.353 29.749 30.312 568 HD1 PHE 71 HD2 PHE 71 29.319 27.875 27.278 569 HD2 PHE 71 HD1 PHE 71 29.636 31.763 29.119 570 HE1 PHE 71 HE2 PHE 71 27.904 28.858 25.476 571 HE2 PHE 71 HE1 PHE 71 28.195 32.719 27.336 572 HZ PHE 71 HZ PHE 71 27.333 31.254 25.514 573 H ILE 72 H ILE 72 33.266 30.559 30.695 574 HA ILE 72 HA ILE 72 33.972 28.264 32.468 575 HB ILE 72 HB ILE 72 35.937 30.430 31.625 576 HG12 ILE 72 HG12 ILE 72 35.883 27.444 30.996 577 HG13 ILE 72 HG13 ILE 72 35.579 28.731 29.843 578 HG21 ILE 72 HG21 ILE 72 37.540 29.146 33.042 579 HG22 ILE 72 HG22 ILE 72 36.195 29.719 34.006 580 HG23 ILE 72 HG23 ILE 72 36.245 28.022 33.496 581 HD11 ILE 72 HD11 ILE 72 38.234 28.128 31.176 582 HD12 ILE 72 HD12 ILE 72 37.794 27.936 29.474 583 HD13 ILE 72 HD13 ILE 72 37.911 29.565 30.166 584 H ASN 73 H ASN 73 33.025 28.629 34.309 585 HA ASN 73 HA ASN 73 31.907 29.635 35.998 586 HB2 ASN 73 HB2 ASN 73 34.371 31.400 36.041 587 HB3 ASN 73 HB3 ASN 73 33.228 31.236 37.363 588 HD21 ASN 73 HD21 ASN 73 32.826 28.609 37.457 589 HD22 ASN 73 HD22 ASN 73 34.292 27.911 38.147 590 H GLY 74 H GLY 74 30.836 30.495 33.609 591 HA2 GLY 74 HA2 GLY 74 29.093 32.007 33.081 592 HA3 GLY 74 HA3 GLY 74 29.588 33.040 34.404 593 H ASN 75 H ASN 75 32.421 32.632 32.753 594 HA ASN 75 HA ASN 75 32.094 35.122 31.179 595 HB2 ASN 75 HB2 ASN 75 34.591 33.486 31.749 596 HB3 ASN 75 HB3 ASN 75 34.528 35.114 31.101 597 HD21 ASN 75 HD21 ASN 75 34.616 33.261 33.966 598 HD22 ASN 75 HD22 ASN 75 34.590 34.675 35.037 599 H PHE 76 H PHE 76 32.094 35.161 28.948 600 HA PHE 76 HA PHE 76 31.938 32.591 27.504 601 HB2 PHE 76 HB2 PHE 76 30.135 34.158 27.217 602 HB3 PHE 76 HB3 PHE 76 31.247 35.456 26.818 603 HD1 PHE 76 HD1 PHE 76 30.615 31.931 25.553 604 HD2 PHE 76 HD2 PHE 76 31.236 36.091 24.579 605 HE1 PHE 76 HE1 PHE 76 30.423 31.404 23.143 606 HE2 PHE 76 HE2 PHE 76 31.038 35.554 22.170 607 HZ PHE 76 HZ PHE 76 30.629 33.213 21.442 608 H ILE 77 H ILE 77 33.260 31.853 25.967 609 HA ILE 77 HA ILE 77 35.481 33.522 24.882 610 HB ILE 77 HB ILE 77 35.732 30.599 25.719 611 HG12 ILE 77 HG12 ILE 77 37.627 31.803 27.228 612 HG13 ILE 77 HG13 ILE 77 36.478 33.130 27.184 613 HG21 ILE 77 HG21 ILE 77 37.133 31.169 23.772 614 HG22 ILE 77 HG22 ILE 77 37.806 32.560 24.653 615 HG23 ILE 77 HG23 ILE 77 38.129 30.903 25.192 616 HD11 ILE 77 HD11 ILE 77 34.736 31.550 28.134 617 HD12 ILE 77 HD12 ILE 77 35.960 30.271 28.131 618 HD13 ILE 77 HD13 ILE 77 36.165 31.695 29.169 619 H GLY 78 H GLY 78 35.727 33.325 22.656 620 HA2 GLY 78 HA2 GLY 78 34.121 31.168 21.281 621 HA3 GLY 78 HA3 GLY 78 34.243 32.804 20.669 622 H GLY 79 H GLY 79 35.434 29.764 20.444 623 HA2 GLY 79 HA2 GLY 79 36.462 29.450 18.164 624 HA3 GLY 79 HA3 GLY 79 37.712 30.559 18.715 625 H CYS 80 H CYS 80 37.619 27.527 17.946 626 HA CYS 80 HA CYS 80 38.598 26.178 20.339 627 HB2 CYS 80 HB2 CYS 80 38.745 25.506 17.370 628 HB3 CYS 80 HB3 CYS 80 39.447 24.490 18.648 629 HG CYS 80 HG CYS 80 36.323 25.519 18.290 630 H SER 81 H SER 81 40.243 27.878 17.638 631 HA SER 81 HA SER 81 42.889 27.381 18.723 632 HB2 SER 81 HB2 SER 81 42.020 29.507 16.747 633 HB3 SER 81 HB3 SER 81 43.675 28.976 17.089 634 HG SER 81 HG SER 81 41.554 27.573 15.852 635 H ASP 82 H ASP 82 40.494 29.977 19.153 636 HA ASP 82 HA ASP 82 42.007 31.729 20.788 637 HB2 ASP 82 HB2 ASP 82 39.563 31.803 19.757 638 HB3 ASP 82 HB3 ASP 82 39.046 31.190 21.300 639 H LEU 83 H LEU 83 40.031 28.932 21.695 640 HA LEU 83 HA LEU 83 40.503 28.924 24.518 641 HB2 LEU 83 HB2 LEU 83 38.692 27.649 23.563 642 HB3 LEU 83 HB3 LEU 83 39.773 26.786 22.488 643 HG LEU 83 HG LEU 83 40.827 25.652 24.450 644 HD11 LEU 83 HD11 LEU 83 38.504 26.896 25.986 645 HD12 LEU 83 HD12 LEU 83 39.614 25.647 26.599 646 HD13 LEU 83 HD13 LEU 83 40.226 27.263 26.226 647 HD21 LEU 83 HD21 LEU 83 39.075 24.043 24.759 648 HD22 LEU 83 HD22 LEU 83 37.834 25.208 24.244 649 HD23 LEU 83 HD23 LEU 83 39.041 24.607 23.086 650 H GLU 84 H GLU 84 42.239 27.158 21.881 651 HA GLU 84 HA GLU 84 44.254 26.050 23.614 652 HB2 GLU 84 HB2 GLU 84 44.295 26.693 20.638 653 HB3 GLU 84 HB3 GLU 84 45.590 25.843 21.504 654 HG2 GLU 84 HG2 GLU 84 44.119 24.046 22.131 655 HG3 GLU 84 HG3 GLU 84 42.729 24.825 21.378 656 H ALA 85 H ALA 85 44.033 29.249 22.022 657 HA ALA 85 HA ALA 85 46.736 30.018 22.631 658 HB1 ALA 85 HB1 ALA 85 45.417 31.108 20.876 659 HB2 ALA 85 HB2 ALA 85 44.268 31.723 22.080 660 HB3 ALA 85 HB3 ALA 85 45.947 32.295 22.081 661 H LEU 86 H LEU 86 43.709 30.317 24.553 662 HA LEU 86 HA LEU 86 44.891 31.847 26.711 663 HB2 LEU 86 HB2 LEU 86 42.570 29.868 26.627 664 HB3 LEU 86 HB3 LEU 86 43.033 30.762 28.066 665 HG LEU 86 HG LEU 86 42.042 32.014 25.480 666 HD11 LEU 86 HD11 LEU 86 40.317 30.788 26.744 667 HD12 LEU 86 HD12 LEU 86 40.735 31.697 28.217 668 HD13 LEU 86 HD13 LEU 86 40.042 32.532 26.806 669 HD21 LEU 86 HD21 LEU 86 41.890 34.098 26.842 670 HD22 LEU 86 HD22 LEU 86 42.750 33.280 28.169 671 HD23 LEU 86 HD23 LEU 86 43.551 33.578 26.600 672 H ASP 87 H ASP 87 44.828 28.400 25.933 673 HA ASP 87 HA ASP 87 46.062 27.505 28.370 674 HB2 ASP 87 HB2 ASP 87 44.658 26.204 26.644 675 HB3 ASP 87 HB3 ASP 87 46.152 26.057 25.733 676 H LYS 88 H LYS 88 47.421 28.397 25.178 677 HA LYS 88 HA LYS 88 50.179 27.888 25.883 678 HB2 LYS 88 HB2 LYS 88 49.282 29.982 23.869 679 HB3 LYS 88 HB3 LYS 88 50.810 29.131 23.959 680 HG2 LYS 88 HG2 LYS 88 48.239 28.299 22.748 681 HG3 LYS 88 HG3 LYS 88 49.877 28.147 22.168 682 HD2 LYS 88 HD2 LYS 88 50.266 26.235 23.709 683 HD3 LYS 88 HD3 LYS 88 48.577 26.366 24.282 684 HE2 LYS 88 HE2 LYS 88 47.711 25.996 22.055 685 HE3 LYS 88 HE3 LYS 88 49.327 26.051 21.343 686 HZ1 LYS 88 HZ1 LYS 88 49.887 24.017 22.388 687 HZ2 LYS 88 HZ2 LYS 88 48.499 24.003 23.311 688 HZ3 LYS 88 HZ3 LYS 88 48.428 23.791 21.669 689 H GLU 89 H GLU 89 48.206 30.835 26.102 690 HA GLU 89 HA GLU 89 50.411 32.477 27.078 691 HB2 GLU 89 HB2 GLU 89 47.414 32.938 26.886 692 HB3 GLU 89 HB3 GLU 89 48.559 34.178 27.371 693 HG2 GLU 89 HG2 GLU 89 48.756 32.750 24.680 694 HG3 GLU 89 HG3 GLU 89 47.802 34.200 24.937 695 H GLY 90 H GLY 90 49.075 30.014 28.697 696 HA2 GLY 90 HA2 GLY 90 49.307 29.423 30.924 697 HA3 GLY 90 HA3 GLY 90 49.972 31.020 31.247 698 H LYS 91 H LYS 91 46.892 31.415 29.819 699 HA LYS 91 HA LYS 91 45.916 32.438 32.401 700 HB2 LYS 91 HB2 LYS 91 45.208 32.846 29.463 701 HB3 LYS 91 HB3 LYS 91 44.204 33.444 30.774 702 HG2 LYS 91 HG2 LYS 91 46.247 34.597 31.735 703 HG3 LYS 91 HG3 LYS 91 47.112 34.188 30.257 704 HD2 LYS 91 HD2 LYS 91 44.545 35.830 30.327 705 HD3 LYS 91 HD3 LYS 91 46.160 36.519 30.449 706 HE2 LYS 91 HE2 LYS 91 46.746 35.593 28.221 707 HE3 LYS 91 HE3 LYS 91 45.091 34.965 28.059 708 HZ1 LYS 91 HZ1 LYS 91 45.778 37.835 28.449 709 HZ2 LYS 91 HZ2 LYS 91 45.378 37.195 27.003 710 HZ3 LYS 91 HZ3 LYS 91 44.275 37.247 28.219 711 H LEU 92 H LEU 92 45.404 29.638 30.514 712 HA LEU 92 HA LEU 92 42.722 29.131 31.629 713 HB2 LEU 92 HB2 LEU 92 43.514 28.605 29.252 714 HB3 LEU 92 HB3 LEU 92 44.504 27.329 29.939 715 HG LEU 92 HG LEU 92 42.568 26.114 30.683 716 HD11 LEU 92 HD11 LEU 92 40.903 28.457 29.695 717 HD12 LEU 92 HD12 LEU 92 40.243 26.861 30.112 718 HD13 LEU 92 HD13 LEU 92 41.004 27.836 31.363 719 HD21 LEU 92 HD21 LEU 92 43.169 25.768 28.337 720 HD22 LEU 92 HD22 LEU 92 41.406 25.729 28.474 721 HD23 LEU 92 HD23 LEU 92 42.215 27.171 27.843 722 H ASP 93 H ASP 93 46.054 28.198 32.228 723 HA ASP 93 HA ASP 93 45.525 26.236 34.286 724 HB2 ASP 93 HB2 ASP 93 47.834 28.109 33.649 725 HB3 ASP 93 HB3 ASP 93 47.827 27.116 35.096 726 H GLY 94 H GLY 94 45.862 29.831 34.434 727 HA2 GLY 94 HA2 GLY 94 45.466 30.099 37.251 728 HA3 GLY 94 HA3 GLY 94 45.119 31.333 36.033 729 H LEU 95 H LEU 95 43.098 29.770 34.598 730 HA LEU 95 HA LEU 95 40.766 30.227 36.239 731 HB2 LEU 95 HB2 LEU 95 41.261 29.080 33.476 732 HB3 LEU 95 HB3 LEU 95 39.649 29.118 34.181 733 HG LEU 95 HG LEU 95 41.369 31.612 33.850 734 HD11 LEU 95 HD11 LEU 95 40.882 30.625 31.645 735 HD12 LEU 95 HD12 LEU 95 39.147 30.580 32.044 736 HD13 LEU 95 HD13 LEU 95 39.994 32.133 31.892 737 HD21 LEU 95 HD21 LEU 95 39.584 31.892 35.522 738 HD22 LEU 95 HD22 LEU 95 39.205 32.800 34.063 739 HD23 LEU 95 HD23 LEU 95 38.384 31.255 34.376 740 H LEU 96 H LEU 96 42.690 27.339 35.607 741 HA LEU 96 HA LEU 96 40.863 25.705 37.299 742 HB2 LEU 96 HB2 LEU 96 43.554 25.057 36.032 743 HB3 LEU 96 HB3 LEU 96 42.590 23.907 36.959 744 HG LEU 96 HG LEU 96 41.797 25.164 34.304 745 HD11 LEU 96 HD11 LEU 96 41.840 22.693 33.708 746 HD12 LEU 96 HD12 LEU 96 43.431 23.416 34.067 747 HD13 LEU 96 HD13 LEU 96 42.615 22.390 35.254 748 HD21 LEU 96 HD21 LEU 96 39.758 24.901 35.646 749 HD22 LEU 96 HD22 LEU 96 39.825 23.673 34.402 750 HD23 LEU 96 HD23 LEU 96 40.240 23.233 36.078 751 H SER 97 H SER 97 43.052 28.019 37.914 752 HA SER 97 HA SER 97 44.185 28.806 39.726 753 HB2 SER 97 HB2 SER 97 41.686 27.706 41.029 754 HB3 SER 97 HB3 SER 97 42.756 28.936 41.727 755 HG SER 97 HG SER 97 42.293 29.685 39.229 Start of MODEL 8 1 H1 GLY 1 H1 GLY 1 11.990 37.341 28.397 2 H2 GLY 1 H2 GLY 1 12.675 36.977 26.951 3 H3 GLY 1 H3 GLY 1 12.009 38.464 27.201 4 HA2 GLY 1 HA2 GLY 1 14.362 38.691 27.286 5 HA3 GLY 1 HA3 GLY 1 13.660 38.969 28.886 6 H ALA 2 H ALA 2 15.850 38.457 29.634 7 HA ALA 2 HA ALA 2 17.060 35.911 29.168 8 HB1 ALA 2 HB1 ALA 2 18.696 36.697 30.848 9 HB2 ALA 2 HB2 ALA 2 18.325 37.942 29.645 10 HB3 ALA 2 HB3 ALA 2 17.615 38.041 31.271 11 H MET 3 H MET 3 17.310 34.096 30.381 12 HA MET 3 HA MET 3 15.729 33.657 32.857 13 HB2 MET 3 HB2 MET 3 15.366 32.138 30.230 14 HB3 MET 3 HB3 MET 3 14.730 31.612 31.784 15 HG2 MET 3 HG2 MET 3 13.419 33.713 31.961 16 HG3 MET 3 HG3 MET 3 13.943 34.138 30.325 17 HE1 MET 3 HE1 MET 3 11.426 34.464 29.631 18 HE2 MET 3 HE2 MET 3 10.160 33.235 29.857 19 HE3 MET 3 HE3 MET 3 10.902 34.014 31.271 20 HA PRO 4 HA PRO 4 19.187 31.167 33.865 21 HB2 PRO 4 HB2 PRO 4 18.292 29.431 35.766 22 HB3 PRO 4 HB3 PRO 4 18.328 31.204 35.994 23 HG2 PRO 4 HG2 PRO 4 15.976 29.507 35.079 24 HG3 PRO 4 HG3 PRO 4 16.019 30.708 36.416 25 HD2 PRO 4 HD2 PRO 4 15.120 31.387 33.961 26 HD3 PRO 4 HD3 PRO 4 16.136 32.517 34.904 27 H SER 5 H SER 5 16.838 29.610 32.024 28 HA SER 5 HA SER 5 16.938 27.090 31.643 29 HB2 SER 5 HB2 SER 5 17.680 29.103 29.533 30 HB3 SER 5 HB3 SER 5 17.404 27.419 29.119 31 HG SER 5 HG SER 5 15.349 27.528 29.834 32 H ILE 6 H ILE 6 19.735 28.378 29.939 33 HA ILE 6 HA ILE 6 21.120 25.829 30.499 34 HB ILE 6 HB ILE 6 22.667 26.265 28.887 35 HG12 ILE 6 HG12 ILE 6 21.596 29.060 28.540 36 HG13 ILE 6 HG13 ILE 6 23.211 28.617 29.055 37 HG21 ILE 6 HG21 ILE 6 21.318 26.080 27.018 38 HG22 ILE 6 HG22 ILE 6 20.303 25.545 28.370 39 HG23 ILE 6 HG23 ILE 6 20.065 27.163 27.669 40 HD11 ILE 6 HD11 ILE 6 22.011 28.075 26.286 41 HD12 ILE 6 HD12 ILE 6 23.196 29.330 26.696 42 HD13 ILE 6 HD13 ILE 6 23.630 27.612 26.799 43 H ALA 7 H ALA 7 21.191 29.132 31.440 44 HA ALA 7 HA ALA 7 23.866 29.495 32.262 45 HB1 ALA 7 HB1 ALA 7 22.982 31.344 33.612 46 HB2 ALA 7 HB2 ALA 7 22.217 31.298 32.014 47 HB3 ALA 7 HB3 ALA 7 21.337 30.704 33.442 48 H SER 8 H SER 8 21.142 28.187 34.107 49 HA SER 8 HA SER 8 22.374 27.701 36.605 50 HB2 SER 8 HB2 SER 8 20.534 26.051 36.881 51 HB3 SER 8 HB3 SER 8 19.983 27.616 36.253 52 HG SER 8 HG SER 8 19.615 26.773 34.310 53 H MET 9 H MET 9 22.427 25.707 33.641 54 HA MET 9 HA MET 9 23.917 23.503 34.823 55 HB2 MET 9 HB2 MET 9 23.793 24.193 31.867 56 HB3 MET 9 HB3 MET 9 24.140 22.644 32.626 57 HG2 MET 9 HG2 MET 9 21.761 22.752 33.585 58 HG3 MET 9 HG3 MET 9 21.469 24.072 32.457 59 HE1 MET 9 HE1 MET 9 21.421 23.753 29.762 60 HE2 MET 9 HE2 MET 9 23.107 23.171 29.832 61 HE3 MET 9 HE3 MET 9 21.876 22.233 28.965 62 H ILE 10 H ILE 10 24.809 26.496 33.078 63 HA ILE 10 HA ILE 10 27.571 25.850 32.677 64 HB ILE 10 HB ILE 10 26.654 28.687 32.876 65 HG12 ILE 10 HG12 ILE 10 26.024 26.570 30.810 66 HG13 ILE 10 HG13 ILE 10 25.032 27.881 31.477 67 HG21 ILE 10 HG21 ILE 10 28.473 29.018 31.308 68 HG22 ILE 10 HG22 ILE 10 29.137 28.037 32.607 69 HG23 ILE 10 HG23 ILE 10 28.681 27.267 31.093 70 HD11 ILE 10 HD11 ILE 10 27.224 28.113 29.460 71 HD12 ILE 10 HD12 ILE 10 25.488 28.332 29.181 72 HD13 ILE 10 HD13 ILE 10 26.370 29.507 30.194 73 H LYS 11 H LYS 11 25.841 27.265 35.405 74 HA LYS 11 HA LYS 11 28.320 27.894 36.902 75 HB2 LYS 11 HB2 LYS 11 25.355 28.364 37.304 76 HB3 LYS 11 HB3 LYS 11 26.390 28.298 38.719 77 HG2 LYS 11 HG2 LYS 11 26.330 30.542 38.207 78 HG3 LYS 11 HG3 LYS 11 27.905 30.010 37.648 79 HD2 LYS 11 HD2 LYS 11 27.328 31.296 35.843 80 HD3 LYS 11 HD3 LYS 11 26.568 29.806 35.303 81 HE2 LYS 11 HE2 LYS 11 24.899 31.407 34.981 82 HE3 LYS 11 HE3 LYS 11 24.430 30.678 36.525 83 HZ1 LYS 11 HZ1 LYS 11 25.972 33.213 36.194 84 HZ2 LYS 11 HZ2 LYS 11 24.392 33.148 36.546 85 HZ3 LYS 11 HZ3 LYS 11 25.528 32.605 37.633 86 H GLY 12 H GLY 12 26.642 25.077 36.341 87 HA2 GLY 12 HA2 GLY 12 27.063 23.815 38.938 88 HA3 GLY 12 HA3 GLY 12 26.454 23.057 37.468 89 H ASN 13 H ASN 13 29.012 24.180 36.001 90 HA ASN 13 HA ASN 13 31.038 22.314 37.133 91 HB2 ASN 13 HB2 ASN 13 29.952 22.325 34.293 92 HB3 ASN 13 HB3 ASN 13 31.493 21.585 34.723 93 HD21 ASN 13 HD21 ASN 13 31.399 19.975 36.570 94 HD22 ASN 13 HD22 ASN 13 30.004 18.894 36.568 95 H LYS 14 H LYS 14 33.184 22.632 36.376 96 HA LYS 14 HA LYS 14 33.963 25.414 36.355 97 HB2 LYS 14 HB2 LYS 14 35.209 23.548 37.405 98 HB3 LYS 14 HB3 LYS 14 35.563 22.881 35.810 99 HG2 LYS 14 HG2 LYS 14 36.895 24.828 35.224 100 HG3 LYS 14 HG3 LYS 14 36.457 25.647 36.733 101 HD2 LYS 14 HD2 LYS 14 37.991 22.999 36.565 102 HD3 LYS 14 HD3 LYS 14 38.761 24.583 36.661 103 HE2 LYS 14 HE2 LYS 14 37.650 25.009 38.837 104 HE3 LYS 14 HE3 LYS 14 36.933 23.388 38.781 105 HZ1 LYS 14 HZ1 LYS 14 39.023 23.497 40.084 106 HZ2 LYS 14 HZ2 LYS 14 39.134 22.431 38.854 107 HZ3 LYS 14 HZ3 LYS 14 39.854 23.929 38.755 108 H VAL 15 H VAL 15 33.961 22.962 33.742 109 HA VAL 15 HA VAL 15 33.874 25.182 31.753 110 HB VAL 15 HB VAL 15 35.441 22.620 31.342 111 HG11 VAL 15 HG11 VAL 15 34.484 23.520 29.246 112 HG12 VAL 15 HG12 VAL 15 35.160 25.120 29.620 113 HG13 VAL 15 HG13 VAL 15 36.231 23.742 29.303 114 HG21 VAL 15 HG21 VAL 15 36.707 23.997 32.863 115 HG22 VAL 15 HG22 VAL 15 37.363 24.369 31.263 116 HG23 VAL 15 HG23 VAL 15 36.242 25.490 32.019 117 H VAL 16 H VAL 16 32.367 25.104 30.260 118 HA VAL 16 HA VAL 16 30.759 22.618 29.929 119 HB VAL 16 HB VAL 16 29.656 25.348 30.631 120 HG11 VAL 16 HG11 VAL 16 28.192 24.411 28.918 121 HG12 VAL 16 HG12 VAL 16 28.212 22.829 29.740 122 HG13 VAL 16 HG13 VAL 16 27.420 24.237 30.498 123 HG21 VAL 16 HG21 VAL 16 29.571 22.610 31.971 124 HG22 VAL 16 HG22 VAL 16 30.315 24.097 32.605 125 HG23 VAL 16 HG23 VAL 16 28.563 23.969 32.484 126 H VAL 17 H VAL 17 30.250 22.151 27.882 127 HA VAL 17 HA VAL 17 30.656 24.269 25.791 128 HB VAL 17 HB VAL 17 31.639 21.396 25.797 129 HG11 VAL 17 HG11 VAL 17 32.010 23.457 23.598 130 HG12 VAL 17 HG12 VAL 17 32.650 21.786 23.652 131 HG13 VAL 17 HG13 VAL 17 30.918 22.060 23.522 132 HG21 VAL 17 HG21 VAL 17 33.868 22.480 25.566 133 HG22 VAL 17 HG22 VAL 17 33.093 24.053 25.855 134 HG23 VAL 17 HG23 VAL 17 33.089 22.801 27.115 135 H PHE 18 H PHE 18 29.344 24.240 23.972 136 HA PHE 18 HA PHE 18 27.056 22.283 23.914 137 HB2 PHE 18 HB2 PHE 18 26.960 25.205 23.119 138 HB3 PHE 18 HB3 PHE 18 25.655 24.045 23.000 139 HD1 PHE 18 HD2 PHE 18 27.660 26.132 25.307 140 HD2 PHE 18 HD1 PHE 18 24.344 23.398 24.974 141 HE1 PHE 18 HE2 PHE 18 26.829 26.863 27.521 142 HE2 PHE 18 HE1 PHE 18 23.512 24.142 27.195 143 HZ PHE 18 HZ PHE 18 24.727 25.936 28.441 144 H SER 19 H SER 19 27.046 21.099 22.127 145 HA SER 19 HA SER 19 28.697 21.799 19.733 146 HB2 SER 19 HB2 SER 19 28.970 19.435 21.619 147 HB3 SER 19 HB3 SER 19 29.756 19.543 20.032 148 HG SER 19 HG SER 19 31.199 20.249 21.468 149 H TRP 20 H TRP 20 28.747 19.974 18.111 150 HA TRP 20 HA TRP 20 26.197 18.384 18.073 151 HB2 TRP 20 HB2 TRP 20 27.781 19.421 15.720 152 HB3 TRP 20 HB3 TRP 20 26.386 18.357 15.628 153 HD1 TRP 20 HD1 TRP 20 24.641 20.233 17.824 154 HE1 TRP 20 HE1 TRP 20 23.381 22.177 16.724 155 HE3 TRP 20 HE3 TRP 20 27.532 20.848 13.633 156 HZ2 TRP 20 HZ2 TRP 20 23.764 23.985 14.510 157 HZ3 TRP 20 HZ3 TRP 20 27.090 22.733 12.080 158 HH2 TRP 20 HH2 TRP 20 25.214 24.302 12.506 159 H VAL 21 H VAL 21 26.320 16.246 17.665 160 HA VAL 21 HA VAL 21 28.943 14.941 17.379 161 HB VAL 21 HB VAL 21 27.497 12.807 17.427 162 HG11 VAL 21 HG11 VAL 21 27.987 14.571 19.855 163 HG12 VAL 21 HG12 VAL 21 27.672 12.827 19.906 164 HG13 VAL 21 HG13 VAL 21 29.138 13.433 19.121 165 HG21 VAL 21 HG21 VAL 21 25.640 14.656 18.995 166 HG22 VAL 21 HG22 VAL 21 25.261 14.012 17.380 167 HG23 VAL 21 HG23 VAL 21 25.492 12.912 18.747 168 H THR 22 H THR 22 28.540 14.015 13.924 169 HA THR 22 HA THR 22 30.412 14.622 16.176 170 HB THR 22 HB THR 22 32.126 13.524 15.069 171 HG1 THR 22 HG1 THR 22 30.379 12.723 13.012 172 HG21 THR 22 HG21 THR 22 29.688 11.702 14.981 173 HG22 THR 22 HG22 THR 22 30.678 12.064 16.411 174 HG23 THR 22 HG23 THR 22 31.389 11.200 15.040 175 H CYS 23 H CYS 23 31.897 16.231 15.976 176 HA CYS 23 HA CYS 23 31.774 17.938 13.530 177 HB2 CYS 23 HB2 CYS 23 30.340 18.936 15.211 178 HB3 CYS 23 HB3 CYS 23 31.591 18.763 16.445 179 HG CYS 23 HG CYS 23 31.462 20.669 13.736 180 HA PRO 24 HA PRO 24 36.144 17.173 13.863 181 HB2 PRO 24 HB2 PRO 24 37.140 18.852 11.936 182 HB3 PRO 24 HB3 PRO 24 36.209 17.368 11.574 183 HG2 PRO 24 HG2 PRO 24 35.153 20.214 11.780 184 HG3 PRO 24 HG3 PRO 24 34.921 19.053 10.433 185 HD2 PRO 24 HD2 PRO 24 33.042 19.339 12.341 186 HD3 PRO 24 HD3 PRO 24 33.454 17.705 11.740 187 H TYR 25 H TYR 25 34.807 20.310 14.615 188 HA TYR 25 HA TYR 25 37.280 21.084 16.052 189 HB2 TYR 25 HB2 TYR 25 34.517 22.353 15.807 190 HB3 TYR 25 HB3 TYR 25 35.736 22.942 16.919 191 HD1 TYR 25 HD1 TYR 25 38.131 23.384 15.972 192 HD2 TYR 25 HD2 TYR 25 34.529 23.426 13.599 193 HE1 TYR 25 HE1 TYR 25 39.223 24.928 14.354 194 HE2 TYR 25 HE2 TYR 25 35.635 24.952 11.968 195 HH TYR 25 HH TYR 25 37.571 26.081 11.416 196 H CYS 26 H CYS 26 34.134 19.636 16.875 197 HA CYS 26 HA CYS 26 34.473 20.143 19.673 198 HB2 CYS 26 HB2 CYS 26 32.369 19.773 18.566 199 HB3 CYS 26 HB3 CYS 26 32.721 18.063 18.294 200 HG CYS 26 HG CYS 26 32.699 17.252 20.671 201 H VAL 27 H VAL 27 35.359 17.322 17.641 202 HA VAL 27 HA VAL 27 36.379 15.510 19.475 203 HB VAL 27 HB VAL 27 36.358 15.320 17.179 204 HG11 VAL 27 HG11 VAL 27 38.760 16.795 16.524 205 HG12 VAL 27 HG12 VAL 27 37.597 15.960 15.492 206 HG13 VAL 27 HG13 VAL 27 37.055 17.376 16.410 207 HG21 VAL 27 HG21 VAL 27 39.209 14.865 18.183 208 HG22 VAL 27 HG22 VAL 27 37.841 13.772 18.515 209 HG23 VAL 27 HG23 VAL 27 38.440 13.963 16.860 210 H ARG 28 H ARG 28 38.064 17.865 17.871 211 HA ARG 28 HA ARG 28 40.488 17.703 19.412 212 HB2 ARG 28 HB2 ARG 28 41.463 19.558 18.308 213 HB3 ARG 28 HB3 ARG 28 40.667 18.487 17.151 214 HG2 ARG 28 HG2 ARG 28 38.854 20.001 16.866 215 HG3 ARG 28 HG3 ARG 28 39.321 20.943 18.282 216 HD2 ARG 28 HD2 ARG 28 40.006 22.274 16.463 217 HD3 ARG 28 HD3 ARG 28 41.492 21.518 17.038 218 HE ARG 28 HE ARG 28 40.321 19.883 14.981 219 HH11 ARG 28 HH22 ARG 28 42.033 22.974 15.231 220 HH12 ARG 28 HH21 ARG 28 42.529 22.891 13.558 221 HH21 ARG 28 HH12 ARG 28 41.053 19.806 13.004 222 HH22 ARG 28 HH11 ARG 28 42.093 21.062 12.351 223 H ALA 29 H ALA 29 37.832 19.941 19.912 224 HA ALA 29 HA ALA 29 39.049 21.264 22.157 225 HB1 ALA 29 HB1 ALA 29 36.104 20.799 21.493 226 HB2 ALA 29 HB2 ALA 29 36.741 21.971 22.667 227 HB3 ALA 29 HB3 ALA 29 37.093 22.165 20.938 228 H GLU 30 H GLU 30 36.752 18.396 22.075 229 HA GLU 30 HA GLU 30 36.756 17.908 24.886 230 HB2 GLU 30 HB2 GLU 30 36.566 15.998 22.512 231 HB3 GLU 30 HB3 GLU 30 36.410 15.498 24.184 232 HG2 GLU 30 HG2 GLU 30 34.430 17.094 24.393 233 HG3 GLU 30 HG3 GLU 30 34.445 17.251 22.634 234 H LYS 31 H LYS 31 39.075 16.798 22.471 235 HA LYS 31 HA LYS 31 40.569 15.170 24.197 236 HB2 LYS 31 HB2 LYS 31 40.732 15.044 21.756 237 HB3 LYS 31 HB3 LYS 31 41.145 16.740 21.647 238 HG2 LYS 31 HG2 LYS 31 43.385 16.244 22.686 239 HG3 LYS 31 HG3 LYS 31 42.942 14.529 22.704 240 HD2 LYS 31 HD2 LYS 31 44.316 15.003 20.753 241 HD3 LYS 31 HD3 LYS 31 42.670 14.602 20.223 242 HE2 LYS 31 HE2 LYS 31 42.145 16.942 19.853 243 HE3 LYS 31 HE3 LYS 31 43.684 17.476 20.561 244 HZ1 LYS 31 HZ1 LYS 31 43.236 16.048 18.005 245 HZ2 LYS 31 HZ2 LYS 31 43.930 17.517 18.229 246 HZ3 LYS 31 HZ3 LYS 31 44.736 16.152 18.662 247 H LEU 32 H LEU 32 41.154 18.521 23.247 248 HA LEU 32 HA LEU 32 43.493 19.009 24.830 249 HB2 LEU 32 HB2 LEU 32 42.846 20.092 22.738 250 HB3 LEU 32 HB3 LEU 32 41.383 20.695 23.505 251 HG LEU 32 HG LEU 32 42.479 22.374 24.689 252 HD11 LEU 32 HD11 LEU 32 44.941 22.665 24.802 253 HD12 LEU 32 HD12 LEU 32 44.402 21.230 25.675 254 HD13 LEU 32 HD13 LEU 32 45.152 21.056 24.077 255 HD21 LEU 32 HD21 LEU 32 43.943 21.988 22.044 256 HD22 LEU 32 HD22 LEU 32 42.333 22.702 22.240 257 HD23 LEU 32 HD23 LEU 32 43.750 23.529 22.928 258 H LEU 33 H LEU 33 40.006 19.537 25.421 259 HA LEU 33 HA LEU 33 40.357 21.087 27.801 260 HB2 LEU 33 HB2 LEU 33 38.055 19.311 26.853 261 HB3 LEU 33 HB3 LEU 33 37.942 20.339 28.274 262 HG LEU 33 HG LEU 33 38.498 21.395 25.483 263 HD11 LEU 33 HD11 LEU 33 36.308 22.119 25.212 264 HD12 LEU 33 HD12 LEU 33 36.233 20.401 25.605 265 HD13 LEU 33 HD13 LEU 33 35.855 21.634 26.847 266 HD21 LEU 33 HD21 LEU 33 38.000 22.792 28.066 267 HD22 LEU 33 HD22 LEU 33 39.299 22.976 26.835 268 HD23 LEU 33 HD23 LEU 33 37.678 23.561 26.494 269 H HIS 34 H HIS 34 39.954 17.535 27.342 270 HA HIS 34 HA HIS 34 40.514 16.952 30.118 271 HB2 HIS 34 HB2 HIS 34 40.387 15.382 27.544 272 HB3 HIS 34 HB3 HIS 34 41.059 14.643 29.002 273 HD1 HIS 34 HD1 HIS 34 39.383 14.338 31.117 274 HD2 HIS 34 HD2 HIS 34 37.706 15.681 27.489 275 HE1 HIS 34 HE1 HIS 34 36.860 13.966 31.293 276 H ALA 35 H ALA 35 42.759 17.370 27.301 277 HA ALA 35 HA ALA 35 44.953 16.063 28.563 278 HB1 ALA 35 HB1 ALA 35 46.309 17.212 26.866 279 HB2 ALA 35 HB2 ALA 35 44.811 16.591 26.150 280 HB3 ALA 35 HB3 ALA 35 44.976 18.326 26.515 281 H ARG 36 H ARG 36 43.876 19.367 28.808 282 HA ARG 36 HA ARG 36 46.029 20.164 30.708 283 HB2 ARG 36 HB2 ARG 36 44.533 21.437 28.467 284 HB3 ARG 36 HB3 ARG 36 45.019 22.494 29.792 285 HG2 ARG 36 HG2 ARG 36 46.980 20.600 28.437 286 HG3 ARG 36 HG3 ARG 36 46.639 22.194 27.758 287 HD2 ARG 36 HD2 ARG 36 47.347 21.921 30.677 288 HD3 ARG 36 HD3 ARG 36 48.630 21.868 29.456 289 HE ARG 36 HE ARG 36 47.416 24.083 28.622 290 HH11 ARG 36 HH12 ARG 36 48.218 23.392 31.989 291 HH12 ARG 36 HH11 ARG 36 48.155 25.095 32.398 292 HH21 ARG 36 HH22 ARG 36 47.667 26.131 29.172 293 HH22 ARG 36 HH21 ARG 36 47.811 26.591 30.878 294 H THR 37 H THR 37 43.356 18.918 31.142 295 HA THR 37 HA THR 37 42.038 18.620 32.978 296 HB THR 37 HB THR 37 43.414 20.635 34.625 297 HG1 THR 37 HG1 THR 37 44.657 18.289 33.614 298 HG21 THR 37 HG21 THR 37 41.828 18.973 35.614 299 HG22 THR 37 HG22 THR 37 43.463 18.824 36.286 300 HG23 THR 37 HG23 THR 37 42.902 17.672 35.057 301 H LYS 38 H LYS 38 41.137 20.543 31.144 302 HA LYS 38 HA LYS 38 39.644 22.556 32.774 303 HB2 LYS 38 HB2 LYS 38 39.678 21.703 29.857 304 HB3 LYS 38 HB3 LYS 38 38.340 22.579 30.555 305 HG2 LYS 38 HG2 LYS 38 39.575 24.557 30.671 306 HG3 LYS 38 HG3 LYS 38 40.996 23.726 31.279 307 HD2 LYS 38 HD2 LYS 38 40.263 23.929 28.370 308 HD3 LYS 38 HD3 LYS 38 41.412 24.933 29.190 309 HE2 LYS 38 HE2 LYS 38 42.798 22.944 29.774 310 HE3 LYS 38 HE3 LYS 38 41.657 21.905 28.935 311 HZ1 LYS 38 HZ1 LYS 38 43.607 23.792 27.775 312 HZ2 LYS 38 HZ2 LYS 38 43.236 22.272 27.334 313 HZ3 LYS 38 HZ3 LYS 38 42.222 23.495 26.932 314 H ASP 39 H ASP 39 38.525 21.448 34.232 315 HA ASP 39 HA ASP 39 37.340 19.031 33.721 316 HB2 ASP 39 HB2 ASP 39 38.039 19.887 35.961 317 HB3 ASP 39 HB3 ASP 39 36.604 20.900 36.004 318 H ILE 40 H ILE 40 35.826 18.494 32.616 319 HA ILE 40 HA ILE 40 34.002 20.569 31.597 320 HB ILE 40 HB ILE 40 36.074 20.147 30.461 321 HG12 ILE 40 HG12 ILE 40 33.558 20.513 29.242 322 HG13 ILE 40 HG13 ILE 40 35.139 21.091 28.798 323 HG21 ILE 40 HG21 ILE 40 36.573 18.139 29.204 324 HG22 ILE 40 HG22 ILE 40 36.322 17.725 30.886 325 HG23 ILE 40 HG23 ILE 40 35.044 17.387 29.715 326 HD11 ILE 40 HD11 ILE 40 35.543 19.088 27.420 327 HD12 ILE 40 HD12 ILE 40 33.952 18.431 27.895 328 HD13 ILE 40 HD13 ILE 40 34.051 19.921 26.938 329 H THR 41 H THR 41 32.031 20.331 30.901 330 HA THR 41 HA THR 41 30.854 17.638 30.349 331 HB THR 41 HB THR 41 29.937 19.622 32.294 332 HG1 THR 41 HG1 THR 41 30.031 17.478 32.804 333 HG21 THR 41 HG21 THR 41 27.520 19.447 31.848 334 HG22 THR 41 HG22 THR 41 27.855 18.785 30.236 335 HG23 THR 41 HG23 THR 41 28.349 20.442 30.653 336 H VAL 42 H VAL 42 29.999 17.478 28.294 337 HA VAL 42 HA VAL 42 29.305 20.006 26.921 338 HB VAL 42 HB VAL 42 31.213 19.496 25.925 339 HG11 VAL 42 HG11 VAL 42 31.847 17.489 26.702 340 HG12 VAL 42 HG12 VAL 42 30.651 16.618 25.670 341 HG13 VAL 42 HG13 VAL 42 32.019 17.539 24.958 342 HG21 VAL 42 HG21 VAL 42 29.463 19.982 24.246 343 HG22 VAL 42 HG22 VAL 42 30.769 18.980 23.598 344 HG23 VAL 42 HG23 VAL 42 29.224 18.230 24.035 345 H HIS 43 H HIS 43 27.655 20.265 25.766 346 HA HIS 43 HA HIS 43 25.368 18.402 26.077 347 HB2 HIS 43 HB2 HIS 43 25.685 21.402 25.646 348 HB3 HIS 43 HB3 HIS 43 24.144 20.609 25.756 349 HD1 HIS 43 HD1 HIS 43 26.545 22.380 27.833 350 HD2 HIS 43 HD2 HIS 43 23.854 19.193 28.346 351 HE1 HIS 43 HE1 HIS 43 26.102 22.190 30.358 352 H TYR 44 H TYR 44 24.313 17.588 24.272 353 HA TYR 44 HA TYR 44 25.097 18.663 21.601 354 HB2 TYR 44 HB2 TYR 44 24.008 15.941 22.278 355 HB3 TYR 44 HB3 TYR 44 24.486 16.511 20.680 356 HD1 TYR 44 HD2 TYR 44 27.077 17.931 21.293 357 HD2 TYR 44 HD1 TYR 44 25.502 14.150 22.670 358 HE1 TYR 44 HE2 TYR 44 29.388 17.147 21.802 359 HE2 TYR 44 HE1 TYR 44 27.806 13.402 23.201 360 HH TYR 44 HH TYR 44 30.018 14.110 23.484 361 H VAL 45 H VAL 45 23.767 20.295 21.182 362 HA VAL 45 HA VAL 45 20.888 20.164 21.536 363 HB VAL 45 HB VAL 45 20.784 22.240 20.286 364 HG11 VAL 45 HG11 VAL 45 22.083 23.625 21.796 365 HG12 VAL 45 HG12 VAL 45 21.458 22.245 22.707 366 HG13 VAL 45 HG13 VAL 45 23.165 22.273 22.184 367 HG21 VAL 45 HG21 VAL 45 22.825 23.346 19.438 368 HG22 VAL 45 HG22 VAL 45 23.789 21.906 19.803 369 HG23 VAL 45 HG23 VAL 45 22.509 21.840 18.572 370 H ASP 46 H ASP 46 22.905 18.841 19.152 371 HA ASP 46 HA ASP 46 21.000 18.483 17.004 372 HB2 ASP 46 HB2 ASP 46 23.506 18.281 16.873 373 HB3 ASP 46 HB3 ASP 46 23.422 16.834 17.872 374 H LYS 47 H LYS 47 21.328 17.061 20.154 375 HA LYS 47 HA LYS 47 19.678 14.657 19.481 376 HB2 LYS 47 HB2 LYS 47 21.518 15.161 21.855 377 HB3 LYS 47 HB3 LYS 47 20.716 13.651 21.462 378 HG2 LYS 47 HG2 LYS 47 22.851 14.997 19.737 379 HG3 LYS 47 HG3 LYS 47 23.155 13.712 20.879 380 HD2 LYS 47 HD2 LYS 47 21.301 13.421 18.473 381 HD3 LYS 47 HD3 LYS 47 23.012 13.000 18.493 382 HE2 LYS 47 HE2 LYS 47 22.591 11.454 20.417 383 HE3 LYS 47 HE3 LYS 47 20.851 11.757 20.254 384 HZ1 LYS 47 HZ1 LYS 47 21.586 9.753 19.044 385 HZ2 LYS 47 HZ2 LYS 47 20.971 10.881 17.989 386 HZ3 LYS 47 HZ3 LYS 47 22.581 10.674 18.100 387 H MET 48 H MET 48 19.873 17.421 21.661 388 HA MET 48 HA MET 48 17.437 16.695 23.131 389 HB2 MET 48 HB2 MET 48 19.166 19.197 23.075 390 HB3 MET 48 HB3 MET 48 17.719 19.024 24.073 391 HG2 MET 48 HG2 MET 48 18.679 17.091 25.215 392 HG3 MET 48 HG3 MET 48 20.156 17.211 24.254 393 HE1 MET 48 HE1 MET 48 22.122 18.765 24.771 394 HE2 MET 48 HE2 MET 48 21.091 20.038 24.073 395 HE3 MET 48 HE3 MET 48 21.941 20.327 25.606 396 H SER 49 H SER 49 15.410 17.216 22.660 397 HA SER 49 HA SER 49 14.519 18.673 20.327 398 HB2 SER 49 HB2 SER 49 13.263 16.905 21.585 399 HB3 SER 49 HB3 SER 49 13.096 18.042 22.947 400 HG SER 49 HG SER 49 11.718 19.230 21.817 401 H GLU 50 H GLU 50 15.032 19.513 23.714 402 HA GLU 50 HA GLU 50 14.237 22.280 23.553 403 HB2 GLU 50 HB2 GLU 50 15.938 20.650 25.470 404 HB3 GLU 50 HB3 GLU 50 15.529 22.337 25.796 405 HG2 GLU 50 HG2 GLU 50 13.546 20.008 25.469 406 HG3 GLU 50 HG3 GLU 50 14.091 20.663 26.998 407 H GLY 51 H GLY 51 16.986 20.790 22.229 408 HA2 GLY 51 HA2 GLY 51 19.146 22.440 22.804 409 HA3 GLY 51 HA3 GLY 51 18.863 21.579 21.289 410 H GLU 52 H GLU 52 16.417 23.234 20.599 411 HA GLU 52 HA GLU 52 17.678 25.446 19.312 412 HB2 GLU 52 HB2 GLU 52 15.681 23.750 18.761 413 HB3 GLU 52 HB3 GLU 52 14.713 24.933 19.647 414 HG2 GLU 52 HG2 GLU 52 15.503 26.652 18.181 415 HG3 GLU 52 HG3 GLU 52 16.549 25.521 17.302 416 H GLN 53 H GLN 53 15.666 25.067 22.250 417 HA GLN 53 HA GLN 53 15.386 27.931 22.749 418 HB2 GLN 53 HB2 GLN 53 13.816 26.108 23.504 419 HB3 GLN 53 HB3 GLN 53 15.046 25.564 24.643 420 HG2 GLN 53 HG2 GLN 53 14.916 27.662 25.875 421 HG3 GLN 53 HG3 GLN 53 13.900 28.392 24.623 422 HE21 GLN 53 HE21 GLN 53 13.901 25.654 27.041 423 HE22 GLN 53 HE22 GLN 53 12.155 25.607 27.104 424 H LEU 54 H LEU 54 17.632 25.333 23.730 425 HA LEU 54 HA LEU 54 19.275 26.989 25.449 426 HB2 LEU 54 HB2 LEU 54 19.965 24.479 23.884 427 HB3 LEU 54 HB3 LEU 54 21.012 25.226 25.042 428 HG LEU 54 HG LEU 54 20.173 24.124 26.735 429 HD11 LEU 54 HD11 LEU 54 17.941 23.997 27.530 430 HD12 LEU 54 HD12 LEU 54 18.233 25.655 27.019 431 HD13 LEU 54 HD13 LEU 54 17.286 24.550 25.978 432 HD21 LEU 54 HD21 LEU 54 19.087 22.098 26.444 433 HD22 LEU 54 HD22 LEU 54 18.417 22.599 24.891 434 HD23 LEU 54 HD23 LEU 54 20.179 22.370 25.075 435 H ARG 55 H ARG 55 19.520 26.210 21.930 436 HA ARG 55 HA ARG 55 21.803 27.848 21.354 437 HB2 ARG 55 HB2 ARG 55 19.412 26.905 19.739 438 HB3 ARG 55 HB3 ARG 55 20.563 28.046 19.043 439 HG2 ARG 55 HG2 ARG 55 22.397 26.529 19.328 440 HG3 ARG 55 HG3 ARG 55 21.410 25.362 20.203 441 HD2 ARG 55 HD2 ARG 55 20.792 26.250 17.356 442 HD3 ARG 55 HD3 ARG 55 21.891 24.916 17.707 443 HE ARG 55 HE ARG 55 19.702 24.146 19.114 444 HH11 ARG 55 HH12 ARG 55 19.923 25.265 15.752 445 HH12 ARG 55 HH11 ARG 55 18.551 24.267 15.301 446 HH21 ARG 55 HH22 ARG 55 18.052 22.699 18.225 447 HH22 ARG 55 HH21 ARG 55 17.669 22.953 16.536 448 H GLY 56 H GLY 56 18.346 28.772 21.473 449 HA2 GLY 56 HA2 GLY 56 18.636 31.492 20.750 450 HA3 GLY 56 HA3 GLY 56 17.371 30.842 21.804 451 H GLU 57 H GLU 57 19.050 29.987 24.014 452 HA GLU 57 HA GLU 57 19.443 32.482 25.366 453 HB2 GLU 57 HB2 GLU 57 20.263 29.626 26.018 454 HB3 GLU 57 HB3 GLU 57 20.671 30.969 27.054 455 HG2 GLU 57 HG2 GLU 57 17.955 29.785 26.517 456 HG3 GLU 57 HG3 GLU 57 18.809 30.061 28.007 457 H ILE 58 H ILE 58 21.767 30.424 23.641 458 HA ILE 58 HA ILE 58 24.074 32.051 24.418 459 HB ILE 58 HB ILE 58 23.826 30.287 21.952 460 HG12 ILE 58 HG12 ILE 58 24.985 29.425 24.644 461 HG13 ILE 58 HG13 ILE 58 23.356 29.007 24.124 462 HG21 ILE 58 HG21 ILE 58 26.267 31.197 23.567 463 HG22 ILE 58 HG22 ILE 58 26.289 30.249 22.064 464 HG23 ILE 58 HG23 ILE 58 25.746 31.919 22.032 465 HD11 ILE 58 HD11 ILE 58 24.771 27.142 23.669 466 HD12 ILE 58 HD12 ILE 58 24.267 27.851 22.122 467 HD13 ILE 58 HD13 ILE 58 25.907 28.137 22.749 468 H TYR 59 H TYR 59 21.853 31.909 21.585 469 HA TYR 59 HA TYR 59 23.279 33.843 20.135 470 HB2 TYR 59 HB2 TYR 59 21.507 32.103 19.354 471 HB3 TYR 59 HB3 TYR 59 20.343 33.401 19.621 472 HD1 TYR 59 HD2 TYR 59 20.724 35.641 18.364 473 HD2 TYR 59 HD1 TYR 59 23.011 32.090 17.557 474 HE1 TYR 59 HE2 TYR 59 21.627 36.697 16.304 475 HE2 TYR 59 HE1 TYR 59 23.854 33.076 15.442 476 HH TYR 59 HH TYR 59 23.973 34.992 14.188 477 H GLN 60 H GLN 60 20.342 34.407 22.192 478 HA GLN 60 HA GLN 60 20.181 37.188 21.495 479 HB2 GLN 60 HB2 GLN 60 19.223 35.613 23.913 480 HB3 GLN 60 HB3 GLN 60 18.929 37.348 23.733 481 HG2 GLN 60 HG2 GLN 60 18.050 35.218 21.742 482 HG3 GLN 60 HG3 GLN 60 17.016 35.962 22.951 483 HE21 GLN 60 HE21 GLN 60 17.019 35.990 19.857 484 HE22 GLN 60 HE22 GLN 60 16.838 37.718 19.513 485 H ALA 61 H ALA 61 22.210 35.573 23.948 486 HA ALA 61 HA ALA 61 23.085 38.122 25.082 487 HB1 ALA 61 HB1 ALA 61 22.856 36.139 26.478 488 HB2 ALA 61 HB2 ALA 61 24.026 35.255 25.479 489 HB3 ALA 61 HB3 ALA 61 24.550 36.656 26.442 490 H TYR 62 H TYR 62 24.587 35.699 22.873 491 HA TYR 62 HA TYR 62 26.957 37.501 22.599 492 HB2 TYR 62 HB2 TYR 62 26.850 34.492 22.308 493 HB3 TYR 62 HB3 TYR 62 28.285 35.514 22.361 494 HD1 TYR 62 HD2 TYR 62 28.547 37.033 24.537 495 HD2 TYR 62 HD1 TYR 62 26.084 33.504 24.304 496 HE1 TYR 62 HE2 TYR 62 28.477 36.905 27.017 497 HE2 TYR 62 HE1 TYR 62 26.007 33.378 26.778 498 HH TYR 62 HH TYR 62 26.548 34.451 28.756 499 H LYS 63 H LYS 63 24.347 36.666 20.711 500 HA LYS 63 HA LYS 63 23.902 36.189 18.582 501 HB2 LYS 63 HB2 LYS 63 25.810 38.520 18.322 502 HB3 LYS 63 HB3 LYS 63 24.875 37.880 16.972 503 HG2 LYS 63 HG2 LYS 63 23.692 39.706 17.862 504 HG3 LYS 63 HG3 LYS 63 22.757 38.257 18.195 505 HD2 LYS 63 HD2 LYS 63 23.313 38.393 20.561 506 HD3 LYS 63 HD3 LYS 63 24.557 39.608 20.240 507 HE2 LYS 63 HE2 LYS 63 22.794 41.174 19.483 508 HE3 LYS 63 HE3 LYS 63 21.558 39.942 19.788 509 HZ1 LYS 63 HZ1 LYS 63 21.946 41.634 21.613 510 HZ2 LYS 63 HZ2 LYS 63 22.002 40.064 22.113 511 HZ3 LYS 63 HZ3 LYS 63 23.394 40.927 21.905 512 H HIS 64 H HIS 64 25.352 34.262 19.455 513 HA HIS 64 HA HIS 64 26.400 33.098 16.994 514 HB2 HIS 64 HB2 HIS 64 27.961 33.118 19.644 515 HB3 HIS 64 HB3 HIS 64 28.290 32.004 18.325 516 HD1 HIS 64 HD1 HIS 64 28.751 35.718 19.192 517 HD2 HIS 64 HD2 HIS 64 29.728 32.845 16.278 518 HE1 HIS 64 HE1 HIS 64 30.655 36.715 17.806 519 H GLU 65 H GLU 65 26.442 30.871 17.034 520 HA GLU 65 HA GLU 65 24.194 29.848 18.744 521 HB2 GLU 65 HB2 GLU 65 23.927 30.886 16.249 522 HB3 GLU 65 HB3 GLU 65 24.409 29.357 15.778 523 HG2 GLU 65 HG2 GLU 65 22.570 28.377 17.272 524 HG3 GLU 65 HG3 GLU 65 22.117 30.060 17.610 525 H THR 66 H THR 66 26.793 28.868 16.497 526 HA THR 66 HA THR 66 27.661 26.777 18.373 527 HB THR 66 HB THR 66 27.980 25.157 16.460 528 HG1 THR 66 HG1 THR 66 25.745 26.311 15.244 529 HG21 THR 66 HG21 THR 66 25.926 24.068 16.756 530 HG22 THR 66 HG22 THR 66 25.042 25.577 17.077 531 HG23 THR 66 HG23 THR 66 26.201 24.936 18.264 532 H VAL 67 H VAL 67 29.801 26.200 18.096 533 HA VAL 67 HA VAL 67 31.420 27.242 15.945 534 HB VAL 67 HB VAL 67 32.856 28.075 18.331 535 HG11 VAL 67 HG11 VAL 67 31.971 29.580 15.854 536 HG12 VAL 67 HG12 VAL 67 33.230 30.078 17.004 537 HG13 VAL 67 HG13 VAL 67 33.458 28.622 16.026 538 HG21 VAL 67 HG21 VAL 67 30.645 28.761 19.258 539 HG22 VAL 67 HG22 VAL 67 31.717 30.115 18.894 540 HG23 VAL 67 HG23 VAL 67 30.377 29.750 17.799 541 HA PRO 68 HA PRO 68 30.128 24.892 18.936 542 HB2 PRO 68 HB2 PRO 68 31.170 23.604 21.098 543 HB3 PRO 68 HB3 PRO 68 30.781 22.794 19.550 544 HG2 PRO 68 HG2 PRO 68 33.477 23.847 20.459 545 HG3 PRO 68 HG3 PRO 68 33.073 22.202 19.852 546 HD2 PRO 68 HD2 PRO 68 34.068 24.021 18.182 547 HD3 PRO 68 HD3 PRO 68 32.696 23.017 17.645 548 H ALA 69 H ALA 69 29.489 25.607 21.160 549 HA ALA 69 HA ALA 69 30.827 28.207 21.762 550 HB1 ALA 69 HB1 ALA 69 28.419 28.277 21.272 551 HB2 ALA 69 HB2 ALA 69 28.106 27.100 22.566 552 HB3 ALA 69 HB3 ALA 69 28.716 28.711 22.966 553 H ILE 70 H ILE 70 31.878 28.600 23.682 554 HA ILE 70 HA ILE 70 32.203 26.276 25.536 555 HB ILE 70 HB ILE 70 34.296 28.127 24.337 556 HG12 ILE 70 HG12 ILE 70 34.223 25.110 24.000 557 HG13 ILE 70 HG13 ILE 70 33.325 26.139 22.900 558 HG21 ILE 70 HG21 ILE 70 34.940 27.601 26.627 559 HG22 ILE 70 HG22 ILE 70 34.618 25.874 26.367 560 HG23 ILE 70 HG23 ILE 70 35.957 26.683 25.530 561 HD11 ILE 70 HD11 ILE 70 35.482 25.611 21.942 562 HD12 ILE 70 HD12 ILE 70 35.354 27.351 22.258 563 HD13 ILE 70 HD13 ILE 70 36.318 26.320 23.334 564 H PHE 71 H PHE 71 32.219 26.705 27.683 565 HA PHE 71 HA PHE 71 32.348 29.541 28.560 566 HB2 PHE 71 HB2 PHE 71 30.355 27.432 29.429 567 HB3 PHE 71 HB3 PHE 71 30.571 28.999 30.198 568 HD1 PHE 71 HD1 PHE 71 29.618 27.401 26.930 569 HD2 PHE 71 HD2 PHE 71 29.338 30.881 29.466 570 HE1 PHE 71 HE1 PHE 71 27.921 28.390 25.403 571 HE2 PHE 71 HE2 PHE 71 27.590 31.815 27.982 572 HZ PHE 71 HZ PHE 71 26.882 30.562 25.943 573 H ILE 72 H ILE 72 33.283 29.959 30.485 574 HA ILE 72 HA ILE 72 34.458 27.712 32.090 575 HB ILE 72 HB ILE 72 35.827 30.330 31.330 576 HG12 ILE 72 HG12 ILE 72 36.439 27.463 30.453 577 HG13 ILE 72 HG13 ILE 72 35.779 28.739 29.431 578 HG21 ILE 72 HG21 ILE 72 36.827 27.955 32.989 579 HG22 ILE 72 HG22 ILE 72 37.775 29.401 32.567 580 HG23 ILE 72 HG23 ILE 72 36.395 29.551 33.631 581 HD11 ILE 72 HD11 ILE 72 37.878 30.072 29.784 582 HD12 ILE 72 HD12 ILE 72 38.579 28.648 30.596 583 HD13 ILE 72 HD13 ILE 72 38.086 28.546 28.901 584 H ASN 73 H ASN 73 33.707 27.827 34.142 585 HA ASN 73 HA ASN 73 32.436 28.540 35.892 586 HB2 ASN 73 HB2 ASN 73 34.347 30.888 35.755 587 HB3 ASN 73 HB3 ASN 73 33.456 30.365 37.173 588 HD21 ASN 73 HD21 ASN 73 36.433 30.537 36.455 589 HD22 ASN 73 HD22 ASN 73 37.046 28.941 36.884 590 H GLY 74 H GLY 74 30.864 29.005 33.744 591 HA2 GLY 74 HA2 GLY 74 28.833 30.119 33.285 592 HA3 GLY 74 HA3 GLY 74 29.247 31.304 34.502 593 H ASN 75 H ASN 75 31.930 31.590 32.669 594 HA ASN 75 HA ASN 75 30.785 33.875 31.153 595 HB2 ASN 75 HB2 ASN 75 33.592 33.145 32.078 596 HB3 ASN 75 HB3 ASN 75 33.253 34.532 31.078 597 HD21 ASN 75 HD21 ASN 75 33.921 33.870 34.208 598 HD22 ASN 75 HD22 ASN 75 32.938 35.137 34.941 599 H PHE 76 H PHE 76 31.030 34.201 28.957 600 HA PHE 76 HA PHE 76 31.402 31.781 27.370 601 HB2 PHE 76 HB2 PHE 76 29.469 33.152 27.000 602 HB3 PHE 76 HB3 PHE 76 30.455 34.580 26.733 603 HD1 PHE 76 HD1 PHE 76 30.016 31.098 25.327 604 HD2 PHE 76 HD2 PHE 76 30.909 35.241 24.532 605 HE1 PHE 76 HE1 PHE 76 30.128 30.616 22.895 606 HE2 PHE 76 HE2 PHE 76 31.026 34.750 22.103 607 HZ PHE 76 HZ PHE 76 30.626 32.438 21.277 608 H ILE 77 H ILE 77 32.820 31.239 25.930 609 HA ILE 77 HA ILE 77 34.883 33.030 24.765 610 HB ILE 77 HB ILE 77 35.284 30.211 25.853 611 HG12 ILE 77 HG12 ILE 77 35.334 31.785 27.703 612 HG13 ILE 77 HG13 ILE 77 36.925 31.123 27.398 613 HG21 ILE 77 HG21 ILE 77 37.243 31.987 24.347 614 HG22 ILE 77 HG22 ILE 77 37.687 30.506 25.216 615 HG23 ILE 77 HG23 ILE 77 36.598 30.415 23.834 616 HD11 ILE 77 HD11 ILE 77 35.994 33.920 26.612 617 HD12 ILE 77 HD12 ILE 77 37.085 33.494 27.934 618 HD13 ILE 77 HD13 ILE 77 37.591 33.250 26.253 619 H GLY 78 H GLY 78 35.219 32.586 22.462 620 HA2 GLY 78 HA2 GLY 78 33.531 30.322 21.374 621 HA3 GLY 78 HA3 GLY 78 33.472 31.923 20.683 622 H GLY 79 H GLY 79 34.840 28.938 20.461 623 HA2 GLY 79 HA2 GLY 79 35.619 28.296 18.259 624 HA3 GLY 79 HA3 GLY 79 36.529 29.796 18.147 625 H CYS 80 H CYS 80 37.434 26.985 17.863 626 HA CYS 80 HA CYS 80 38.979 26.174 20.134 627 HB2 CYS 80 HB2 CYS 80 39.183 25.608 17.154 628 HB3 CYS 80 HB3 CYS 80 40.300 24.915 18.338 629 HG CYS 80 HG CYS 80 37.003 24.750 18.211 630 H SER 81 H SER 81 39.867 28.350 17.408 631 HA SER 81 HA SER 81 42.585 28.749 18.186 632 HB2 SER 81 HB2 SER 81 40.654 30.631 16.768 633 HB3 SER 81 HB3 SER 81 42.414 30.853 16.876 634 HG SER 81 HG SER 81 41.831 29.811 14.933 635 H ASP 82 H ASP 82 39.612 30.142 19.433 636 HA ASP 82 HA ASP 82 40.806 32.259 21.017 637 HB2 ASP 82 HB2 ASP 82 38.403 31.859 19.975 638 HB3 ASP 82 HB3 ASP 82 38.070 31.040 21.486 639 H LEU 83 H LEU 83 39.512 29.027 21.661 640 HA LEU 83 HA LEU 83 39.952 28.912 24.495 641 HB2 LEU 83 HB2 LEU 83 38.403 27.409 23.395 642 HB3 LEU 83 HB3 LEU 83 39.649 26.831 22.297 643 HG LEU 83 HG LEU 83 40.839 25.741 24.188 644 HD11 LEU 83 HD11 LEU 83 40.035 27.114 26.069 645 HD12 LEU 83 HD12 LEU 83 38.378 26.536 25.799 646 HD13 LEU 83 HD13 LEU 83 39.644 25.410 26.332 647 HD21 LEU 83 HD21 LEU 83 39.354 23.860 24.413 648 HD22 LEU 83 HD22 LEU 83 37.950 24.848 23.955 649 HD23 LEU 83 HD23 LEU 83 39.233 24.499 22.775 650 H GLU 84 H GLU 84 41.928 27.747 21.754 651 HA GLU 84 HA GLU 84 44.111 26.668 23.284 652 HB2 GLU 84 HB2 GLU 84 43.797 27.692 20.428 653 HB3 GLU 84 HB3 GLU 84 45.357 27.132 21.042 654 HG2 GLU 84 HG2 GLU 84 44.574 24.956 21.491 655 HG3 GLU 84 HG3 GLU 84 42.874 25.401 21.285 656 H ALA 85 H ALA 85 43.386 29.965 22.133 657 HA ALA 85 HA ALA 85 45.992 31.003 22.565 658 HB1 ALA 85 HB1 ALA 85 44.416 32.122 21.112 659 HB2 ALA 85 HB2 ALA 85 43.204 32.282 22.398 660 HB3 ALA 85 HB3 ALA 85 44.715 33.220 22.463 661 H LEU 86 H LEU 86 43.178 30.778 24.781 662 HA LEU 86 HA LEU 86 44.398 32.262 26.966 663 HB2 LEU 86 HB2 LEU 86 42.234 30.106 26.903 664 HB3 LEU 86 HB3 LEU 86 42.685 31.007 28.343 665 HG LEU 86 HG LEU 86 41.475 32.222 25.826 666 HD11 LEU 86 HD11 LEU 86 39.894 30.837 27.098 667 HD12 LEU 86 HD12 LEU 86 40.325 31.691 28.602 668 HD13 LEU 86 HD13 LEU 86 39.512 32.555 27.286 669 HD21 LEU 86 HD21 LEU 86 42.169 33.481 28.521 670 HD22 LEU 86 HD22 LEU 86 42.881 33.877 26.932 671 HD23 LEU 86 HD23 LEU 86 41.193 34.250 27.253 672 H ASP 87 H ASP 87 44.462 28.901 25.968 673 HA ASP 87 HA ASP 87 45.841 27.822 28.257 674 HB2 ASP 87 HB2 ASP 87 44.385 26.649 26.489 675 HB3 ASP 87 HB3 ASP 87 45.796 26.685 25.437 676 H LYS 88 H LYS 88 47.007 28.895 25.022 677 HA LYS 88 HA LYS 88 49.812 28.402 25.586 678 HB2 LYS 88 HB2 LYS 88 48.354 29.927 23.390 679 HB3 LYS 88 HB3 LYS 88 50.101 29.991 23.558 680 HG2 LYS 88 HG2 LYS 88 49.769 28.336 21.974 681 HG3 LYS 88 HG3 LYS 88 50.170 27.468 23.457 682 HD2 LYS 88 HD2 LYS 88 47.718 26.975 23.771 683 HD3 LYS 88 HD3 LYS 88 47.413 27.922 22.294 684 HE2 LYS 88 HE2 LYS 88 47.268 25.770 21.566 685 HE3 LYS 88 HE3 LYS 88 48.858 26.316 21.039 686 HZ1 LYS 88 HZ1 LYS 88 48.875 24.054 22.015 687 HZ2 LYS 88 HZ2 LYS 88 49.837 25.066 22.905 688 HZ3 LYS 88 HZ3 LYS 88 48.364 24.611 23.447 689 H GLU 89 H GLU 89 47.846 31.405 25.883 690 HA GLU 89 HA GLU 89 50.179 32.930 26.730 691 HB2 GLU 89 HB2 GLU 89 47.181 33.404 26.706 692 HB3 GLU 89 HB3 GLU 89 48.249 34.546 27.488 693 HG2 GLU 89 HG2 GLU 89 48.648 33.686 24.594 694 HG3 GLU 89 HG3 GLU 89 47.656 35.058 25.077 695 H GLY 90 H GLY 90 48.506 30.554 28.445 696 HA2 GLY 90 HA2 GLY 90 48.746 29.925 30.658 697 HA3 GLY 90 HA3 GLY 90 49.876 31.271 30.882 698 H LYS 91 H LYS 91 46.647 31.929 29.692 699 HA LYS 91 HA LYS 91 45.915 33.478 32.128 700 HB2 LYS 91 HB2 LYS 91 45.007 33.356 29.218 701 HB3 LYS 91 HB3 LYS 91 44.057 34.145 30.456 702 HG2 LYS 91 HG2 LYS 91 46.035 35.606 31.013 703 HG3 LYS 91 HG3 LYS 91 46.880 34.922 29.618 704 HD2 LYS 91 HD2 LYS 91 44.192 36.371 29.515 705 HD3 LYS 91 HD3 LYS 91 45.743 37.142 29.185 706 HE2 LYS 91 HE2 LYS 91 46.132 35.722 27.241 707 HE3 LYS 91 HE3 LYS 91 44.719 34.731 27.635 708 HZ1 LYS 91 HZ1 LYS 91 44.721 37.474 26.555 709 HZ2 LYS 91 HZ2 LYS 91 43.962 36.155 25.995 710 HZ3 LYS 91 HZ3 LYS 91 43.407 36.885 27.358 711 H LEU 92 H LEU 92 45.309 30.505 30.589 712 HA LEU 92 HA LEU 92 42.705 29.859 31.605 713 HB2 LEU 92 HB2 LEU 92 43.777 28.777 29.628 714 HB3 LEU 92 HB3 LEU 92 45.118 28.252 30.639 715 HG LEU 92 HG LEU 92 43.599 26.785 31.949 716 HD11 LEU 92 HD11 LEU 92 41.453 27.980 31.582 717 HD12 LEU 92 HD12 LEU 92 41.513 27.555 29.856 718 HD13 LEU 92 HD13 LEU 92 41.348 26.295 31.107 719 HD21 LEU 92 HD21 LEU 92 44.898 25.986 30.005 720 HD22 LEU 92 HD22 LEU 92 43.431 25.075 30.300 721 HD23 LEU 92 HD23 LEU 92 43.487 26.271 28.966 722 H ASP 93 H ASP 93 46.031 29.270 32.799 723 HA ASP 93 HA ASP 93 45.394 27.198 34.539 724 HB2 ASP 93 HB2 ASP 93 47.677 29.205 34.522 725 HB3 ASP 93 HB3 ASP 93 47.621 27.811 35.597 726 H GLY 94 H GLY 94 45.604 30.664 35.451 727 HA2 GLY 94 HA2 GLY 94 44.784 30.304 38.194 728 HA3 GLY 94 HA3 GLY 94 44.786 31.805 37.262 729 H LEU 95 H LEU 95 42.921 30.556 35.159 730 HA LEU 95 HA LEU 95 40.386 31.152 36.483 731 HB2 LEU 95 HB2 LEU 95 41.198 30.298 33.671 732 HB3 LEU 95 HB3 LEU 95 39.517 30.427 34.168 733 HG LEU 95 HG LEU 95 41.520 32.723 34.241 734 HD11 LEU 95 HD11 LEU 95 40.972 31.970 31.938 735 HD12 LEU 95 HD12 LEU 95 39.237 32.137 32.300 736 HD13 LEU 95 HD13 LEU 95 40.290 33.566 32.288 737 HD21 LEU 95 HD21 LEU 95 39.702 33.074 35.878 738 HD22 LEU 95 HD22 LEU 95 39.492 34.138 34.497 739 HD23 LEU 95 HD23 LEU 95 38.494 32.681 34.632 740 H LEU 96 H LEU 96 42.133 28.223 35.578 741 HA LEU 96 HA LEU 96 39.997 26.425 36.446 742 HB2 LEU 96 HB2 LEU 96 42.963 26.004 35.915 743 HB3 LEU 96 HB3 LEU 96 41.836 24.691 36.244 744 HG LEU 96 HG LEU 96 41.736 26.528 33.822 745 HD11 LEU 96 HD11 LEU 96 43.643 24.917 33.910 746 HD12 LEU 96 HD12 LEU 96 42.488 23.585 34.100 747 HD13 LEU 96 HD13 LEU 96 42.512 24.556 32.612 748 HD21 LEU 96 HD21 LEU 96 39.474 25.764 34.435 749 HD22 LEU 96 HD22 LEU 96 40.035 24.963 32.980 750 HD23 LEU 96 HD23 LEU 96 40.062 24.084 34.530 751 H SER 97 H SER 97 41.742 28.477 38.288 752 HA SER 97 HA SER 97 42.128 26.622 40.601 753 HB2 SER 97 HB2 SER 97 43.468 29.284 40.028 754 HB3 SER 97 HB3 SER 97 43.777 28.215 41.405 755 HG SER 97 HG SER 97 44.302 27.752 38.638 Start of MODEL 9 1 H1 GLY 1 H1 GLY 1 6.807 32.338 34.241 2 H2 GLY 1 H2 GLY 1 7.675 32.197 32.845 3 H3 GLY 1 H3 GLY 1 6.227 32.969 32.840 4 HA2 GLY 1 HA2 GLY 1 8.029 34.562 32.742 5 HA3 GLY 1 HA3 GLY 1 7.062 34.726 34.223 6 H ALA 2 H ALA 2 10.121 34.908 33.260 7 HA ALA 2 HA ALA 2 12.171 34.597 34.135 8 HB1 ALA 2 HB1 ALA 2 10.657 35.014 36.724 9 HB2 ALA 2 HB2 ALA 2 12.354 35.430 36.385 10 HB3 ALA 2 HB3 ALA 2 11.046 36.282 35.548 11 H MET 3 H MET 3 10.900 31.910 33.817 12 HA MET 3 HA MET 3 12.137 30.251 35.874 13 HB2 MET 3 HB2 MET 3 11.114 29.627 33.073 14 HB3 MET 3 HB3 MET 3 11.913 28.443 34.096 15 HG2 MET 3 HG2 MET 3 9.721 28.010 34.545 16 HG3 MET 3 HG3 MET 3 10.174 29.030 35.903 17 HE1 MET 3 HE1 MET 3 7.627 29.284 36.491 18 HE2 MET 3 HE2 MET 3 6.382 29.755 35.315 19 HE3 MET 3 HE3 MET 3 7.252 28.221 35.115 20 HA PRO 4 HA PRO 4 16.293 30.615 34.592 21 HB2 PRO 4 HB2 PRO 4 17.463 28.273 35.398 22 HB3 PRO 4 HB3 PRO 4 16.824 29.510 36.519 23 HG2 PRO 4 HG2 PRO 4 15.427 27.001 35.526 24 HG3 PRO 4 HG3 PRO 4 15.613 27.566 37.220 25 HD2 PRO 4 HD2 PRO 4 13.359 28.068 35.807 26 HD3 PRO 4 HD3 PRO 4 14.036 29.294 36.917 27 H SER 5 H SER 5 18.117 29.665 33.369 28 HA SER 5 HA SER 5 17.355 27.775 31.225 29 HB2 SER 5 HB2 SER 5 18.394 29.044 29.544 30 HB3 SER 5 HB3 SER 5 17.204 30.122 30.247 31 HG SER 5 HG SER 5 19.248 31.228 30.068 32 H ILE 6 H ILE 6 19.699 27.912 29.794 33 HA ILE 6 HA ILE 6 21.491 26.127 30.937 34 HB ILE 6 HB ILE 6 22.830 26.441 29.105 35 HG12 ILE 6 HG12 ILE 6 21.718 29.227 28.760 36 HG13 ILE 6 HG13 ILE 6 23.385 28.769 29.049 37 HG21 ILE 6 HG21 ILE 6 21.360 26.206 27.315 38 HG22 ILE 6 HG22 ILE 6 20.527 25.602 28.761 39 HG23 ILE 6 HG23 ILE 6 20.095 27.190 28.071 40 HD11 ILE 6 HD11 ILE 6 23.419 27.691 26.759 41 HD12 ILE 6 HD12 ILE 6 21.796 28.336 26.481 42 HD13 ILE 6 HD13 ILE 6 23.150 29.445 26.744 43 H ALA 7 H ALA 7 21.438 29.631 31.265 44 HA ALA 7 HA ALA 7 24.060 30.234 32.014 45 HB1 ALA 7 HB1 ALA 7 22.277 31.873 31.595 46 HB2 ALA 7 HB2 ALA 7 21.438 31.373 33.078 47 HB3 ALA 7 HB3 ALA 7 23.033 32.158 33.175 48 H SER 8 H SER 8 21.469 28.903 34.129 49 HA SER 8 HA SER 8 23.026 28.843 36.547 50 HB2 SER 8 HB2 SER 8 20.626 27.184 35.693 51 HB3 SER 8 HB3 SER 8 21.286 27.282 37.342 52 HG SER 8 HG SER 8 19.716 28.795 37.297 53 H MET 9 H MET 9 22.804 26.573 33.816 54 HA MET 9 HA MET 9 24.281 24.406 35.082 55 HB2 MET 9 HB2 MET 9 24.058 24.893 32.092 56 HB3 MET 9 HB3 MET 9 24.327 23.381 32.941 57 HG2 MET 9 HG2 MET 9 22.015 23.438 33.818 58 HG3 MET 9 HG3 MET 9 21.748 24.998 33.033 59 HE1 MET 9 HE1 MET 9 19.448 23.072 30.697 60 HE2 MET 9 HE2 MET 9 19.555 23.132 32.473 61 HE3 MET 9 HE3 MET 9 19.767 24.616 31.512 62 H ILE 10 H ILE 10 25.149 27.269 33.129 63 HA ILE 10 HA ILE 10 27.946 26.626 32.834 64 HB ILE 10 HB ILE 10 26.951 29.441 32.753 65 HG12 ILE 10 HG12 ILE 10 26.307 27.119 30.926 66 HG13 ILE 10 HG13 ILE 10 25.336 28.513 31.450 67 HG21 ILE 10 HG21 ILE 10 28.741 29.661 31.128 68 HG22 ILE 10 HG22 ILE 10 29.428 28.879 32.544 69 HG23 ILE 10 HG23 ILE 10 29.036 27.902 31.135 70 HD11 ILE 10 HD11 ILE 10 27.476 28.470 29.384 71 HD12 ILE 10 HD12 ILE 10 25.717 28.646 29.144 72 HD13 ILE 10 HD13 ILE 10 26.630 29.948 29.966 73 H LYS 11 H LYS 11 26.089 28.037 35.392 74 HA LYS 11 HA LYS 11 28.411 28.605 37.156 75 HB2 LYS 11 HB2 LYS 11 25.429 28.702 37.566 76 HB3 LYS 11 HB3 LYS 11 26.630 29.025 38.829 77 HG2 LYS 11 HG2 LYS 11 27.636 30.816 37.502 78 HG3 LYS 11 HG3 LYS 11 26.503 30.522 36.159 79 HD2 LYS 11 HD2 LYS 11 24.622 30.939 37.658 80 HD3 LYS 11 HD3 LYS 11 25.744 31.293 38.986 81 HE2 LYS 11 HE2 LYS 11 25.615 32.847 36.354 82 HE3 LYS 11 HE3 LYS 11 24.754 33.321 37.821 83 HZ1 LYS 11 HZ1 LYS 11 27.715 33.131 37.579 84 HZ2 LYS 11 HZ2 LYS 11 26.810 34.510 37.713 85 HZ3 LYS 11 HZ3 LYS 11 26.887 33.469 38.965 86 H GLY 12 H GLY 12 26.653 25.812 36.245 87 HA2 GLY 12 HA2 GLY 12 26.891 24.344 38.768 88 HA3 GLY 12 HA3 GLY 12 26.232 23.764 37.240 89 H ASN 13 H ASN 13 28.685 24.567 35.717 90 HA ASN 13 HA ASN 13 30.796 22.808 36.889 91 HB2 ASN 13 HB2 ASN 13 29.721 22.850 34.048 92 HB3 ASN 13 HB3 ASN 13 31.333 22.257 34.415 93 HD21 ASN 13 HD21 ASN 13 31.428 20.630 36.287 94 HD22 ASN 13 HD22 ASN 13 30.262 19.325 36.129 95 H LYS 14 H LYS 14 32.961 23.238 36.007 96 HA LYS 14 HA LYS 14 33.580 26.089 36.034 97 HB2 LYS 14 HB2 LYS 14 34.993 24.117 36.961 98 HB3 LYS 14 HB3 LYS 14 35.485 23.840 35.301 99 HG2 LYS 14 HG2 LYS 14 37.168 25.308 35.755 100 HG3 LYS 14 HG3 LYS 14 35.947 26.545 35.458 101 HD2 LYS 14 HD2 LYS 14 36.997 27.103 37.519 102 HD3 LYS 14 HD3 LYS 14 35.387 26.464 37.922 103 HE2 LYS 14 HE2 LYS 14 36.568 24.189 38.267 104 HE3 LYS 14 HE3 LYS 14 38.095 25.089 38.168 105 HZ1 LYS 14 HZ1 LYS 14 37.361 24.821 40.446 106 HZ2 LYS 14 HZ2 LYS 14 37.340 26.404 40.078 107 HZ3 LYS 14 HZ3 LYS 14 35.929 25.501 40.149 108 H VAL 15 H VAL 15 33.836 23.537 33.517 109 HA VAL 15 HA VAL 15 33.791 25.659 31.403 110 HB VAL 15 HB VAL 15 35.209 22.991 31.193 111 HG11 VAL 15 HG11 VAL 15 34.412 23.837 29.032 112 HG12 VAL 15 HG12 VAL 15 35.129 25.426 29.364 113 HG13 VAL 15 HG13 VAL 15 36.166 24.000 29.141 114 HG21 VAL 15 HG21 VAL 15 36.354 25.772 31.651 115 HG22 VAL 15 HG22 VAL 15 36.469 24.379 32.749 116 HG23 VAL 15 HG23 VAL 15 37.302 24.341 31.195 117 H VAL 16 H VAL 16 32.178 25.573 29.999 118 HA VAL 16 HA VAL 16 30.599 23.054 29.701 119 HB VAL 16 HB VAL 16 29.382 25.798 30.106 120 HG11 VAL 16 HG11 VAL 16 28.093 23.067 29.654 121 HG12 VAL 16 HG12 VAL 16 27.232 24.555 30.097 122 HG13 VAL 16 HG13 VAL 16 28.039 24.446 28.528 123 HG21 VAL 16 HG21 VAL 16 28.354 24.619 32.123 124 HG22 VAL 16 HG22 VAL 16 29.465 23.278 31.818 125 HG23 VAL 16 HG23 VAL 16 30.097 24.884 32.253 126 H VAL 17 H VAL 17 30.346 22.473 27.619 127 HA VAL 17 HA VAL 17 30.635 24.565 25.481 128 HB VAL 17 HB VAL 17 31.646 21.702 25.483 129 HG11 VAL 17 HG11 VAL 17 30.940 22.421 23.231 130 HG12 VAL 17 HG12 VAL 17 32.053 23.801 23.341 131 HG13 VAL 17 HG13 VAL 17 32.664 22.116 23.373 132 HG21 VAL 17 HG21 VAL 17 33.091 23.106 26.852 133 HG22 VAL 17 HG22 VAL 17 33.894 22.753 25.322 134 HG23 VAL 17 HG23 VAL 17 33.138 24.343 25.578 135 H PHE 18 H PHE 18 29.237 24.475 23.733 136 HA PHE 18 HA PHE 18 27.021 22.434 23.815 137 HB2 PHE 18 HB2 PHE 18 26.825 25.327 22.931 138 HB3 PHE 18 HB3 PHE 18 25.540 24.135 22.909 139 HD1 PHE 18 HD1 PHE 18 24.499 23.343 25.058 140 HD2 PHE 18 HD2 PHE 18 27.451 26.478 24.975 141 HE1 PHE 18 HE1 PHE 18 23.748 24.115 27.300 142 HE2 PHE 18 HE2 PHE 18 26.696 27.250 27.209 143 HZ PHE 18 HZ PHE 18 24.819 26.110 28.357 144 H SER 19 H SER 19 26.901 21.218 22.022 145 HA SER 19 HA SER 19 28.517 21.917 19.597 146 HB2 SER 19 HB2 SER 19 28.752 19.406 21.306 147 HB3 SER 19 HB3 SER 19 29.659 19.763 19.817 148 HG SER 19 HG SER 19 30.932 20.398 21.450 149 H TRP 20 H TRP 20 28.513 20.170 17.886 150 HA TRP 20 HA TRP 20 25.906 18.725 17.670 151 HB2 TRP 20 HB2 TRP 20 27.220 20.411 15.521 152 HB3 TRP 20 HB3 TRP 20 25.900 19.290 15.252 153 HD1 TRP 20 HD1 TRP 20 24.298 20.407 18.018 154 HE1 TRP 20 HE1 TRP 20 22.752 22.375 17.570 155 HE3 TRP 20 HE3 TRP 20 26.586 22.286 13.826 156 HZ2 TRP 20 HZ2 TRP 20 22.760 24.717 15.876 157 HZ3 TRP 20 HZ3 TRP 20 25.830 24.447 12.866 158 HH2 TRP 20 HH2 TRP 20 23.928 25.678 13.883 159 H VAL 21 H VAL 21 25.994 16.712 16.708 160 HA VAL 21 HA VAL 21 28.653 15.492 16.399 161 HB VAL 21 HB VAL 21 25.906 14.215 16.176 162 HG11 VAL 21 HG11 VAL 21 28.701 13.003 16.416 163 HG12 VAL 21 HG12 VAL 21 27.177 12.096 16.528 164 HG13 VAL 21 HG13 VAL 21 27.611 12.883 15.016 165 HG21 VAL 21 HG21 VAL 21 26.219 15.014 18.456 166 HG22 VAL 21 HG22 VAL 21 26.417 13.267 18.418 167 HG23 VAL 21 HG23 VAL 21 27.854 14.308 18.516 168 H THR 22 H THR 22 28.555 15.282 12.772 169 HA THR 22 HA THR 22 30.280 15.439 15.225 170 HB THR 22 HB THR 22 30.950 14.599 12.389 171 HG1 THR 22 HG1 THR 22 29.867 12.989 13.422 172 HG21 THR 22 HG21 THR 22 32.926 15.614 13.414 173 HG22 THR 22 HG22 THR 22 33.109 13.870 13.403 174 HG23 THR 22 HG23 THR 22 32.662 14.687 14.914 175 H CYS 23 H CYS 23 31.722 17.134 15.443 176 HA CYS 23 HA CYS 23 31.498 19.342 13.436 177 HB2 CYS 23 HB2 CYS 23 30.226 19.874 15.388 178 HB3 CYS 23 HB3 CYS 23 31.564 19.416 16.449 179 HG CYS 23 HG CYS 23 31.184 21.920 14.329 180 HA PRO 24 HA PRO 24 35.890 18.284 13.286 181 HB2 PRO 24 HB2 PRO 24 36.717 20.029 11.343 182 HB3 PRO 24 HB3 PRO 24 35.724 18.582 10.995 183 HG2 PRO 24 HG2 PRO 24 34.769 21.437 11.412 184 HG3 PRO 24 HG3 PRO 24 34.369 20.326 10.061 185 HD2 PRO 24 HD2 PRO 24 32.727 20.618 12.196 186 HD3 PRO 24 HD3 PRO 24 32.962 19.010 11.441 187 H TYR 25 H TYR 25 34.546 21.258 14.296 188 HA TYR 25 HA TYR 25 37.022 22.239 15.545 189 HB2 TYR 25 HB2 TYR 25 34.196 23.325 15.701 190 HB3 TYR 25 HB3 TYR 25 35.669 24.153 16.161 191 HD1 TYR 25 HD1 TYR 25 37.557 23.970 14.102 192 HD2 TYR 25 HD2 TYR 25 33.267 23.972 13.647 193 HE1 TYR 25 HE1 TYR 25 37.799 24.698 11.718 194 HE2 TYR 25 HE2 TYR 25 33.521 24.598 11.247 195 HH TYR 25 HH TYR 25 36.675 25.345 9.796 196 H CYS 26 H CYS 26 33.849 20.952 16.687 197 HA CYS 26 HA CYS 26 34.446 21.132 19.436 198 HB2 CYS 26 HB2 CYS 26 32.235 20.621 18.433 199 HB3 CYS 26 HB3 CYS 26 32.743 18.944 18.168 200 HG CYS 26 HG CYS 26 33.534 18.557 20.697 201 H VAL 27 H VAL 27 35.294 18.515 17.198 202 HA VAL 27 HA VAL 27 36.426 16.590 18.864 203 HB VAL 27 HB VAL 27 36.162 16.673 16.520 204 HG11 VAL 27 HG11 VAL 27 38.661 18.019 15.952 205 HG12 VAL 27 HG12 VAL 27 37.428 17.349 14.861 206 HG13 VAL 27 HG13 VAL 27 36.984 18.694 15.920 207 HG21 VAL 27 HG21 VAL 27 38.952 15.838 17.424 208 HG22 VAL 27 HG22 VAL 27 37.479 14.852 17.602 209 HG23 VAL 27 HG23 VAL 27 38.128 15.175 15.987 210 H ARG 28 H ARG 28 37.922 19.132 17.373 211 HA ARG 28 HA ARG 28 40.535 19.179 18.532 212 HB2 ARG 28 HB2 ARG 28 39.202 21.888 18.123 213 HB3 ARG 28 HB3 ARG 28 40.902 21.476 18.091 214 HG2 ARG 28 HG2 ARG 28 40.382 20.123 15.955 215 HG3 ARG 28 HG3 ARG 28 38.804 20.967 15.981 216 HD2 ARG 28 HD2 ARG 28 39.971 23.144 16.069 217 HD3 ARG 28 HD3 ARG 28 41.531 22.311 15.918 218 HE ARG 28 HE ARG 28 40.266 21.351 13.750 219 HH11 ARG 28 HH12 ARG 28 40.957 24.639 14.771 220 HH12 ARG 28 HH11 ARG 28 40.563 25.318 13.214 221 HH21 ARG 28 HH22 ARG 28 39.988 22.249 11.696 222 HH22 ARG 28 HH21 ARG 28 40.269 23.953 11.504 223 H ALA 29 H ALA 29 37.719 20.956 19.790 224 HA ALA 29 HA ALA 29 38.978 21.826 22.213 225 HB1 ALA 29 HB1 ALA 29 36.699 22.424 22.898 226 HB2 ALA 29 HB2 ALA 29 36.993 22.907 21.217 227 HB3 ALA 29 HB3 ALA 29 36.019 21.462 21.570 228 H GLU 30 H GLU 30 36.732 18.995 21.687 229 HA GLU 30 HA GLU 30 36.789 18.065 24.391 230 HB2 GLU 30 HB2 GLU 30 36.408 16.637 21.713 231 HB3 GLU 30 HB3 GLU 30 36.420 15.786 23.247 232 HG2 GLU 30 HG2 GLU 30 34.560 17.530 23.943 233 HG3 GLU 30 HG3 GLU 30 34.331 17.680 22.186 234 H LYS 31 H LYS 31 39.141 17.467 21.794 235 HA LYS 31 HA LYS 31 40.490 15.383 23.254 236 HB2 LYS 31 HB2 LYS 31 40.592 15.563 20.816 237 HB3 LYS 31 HB3 LYS 31 41.203 17.214 20.911 238 HG2 LYS 31 HG2 LYS 31 43.332 16.353 21.922 239 HG3 LYS 31 HG3 LYS 31 42.687 14.706 21.793 240 HD2 LYS 31 HD2 LYS 31 44.142 15.125 19.929 241 HD3 LYS 31 HD3 LYS 31 42.469 15.018 19.338 242 HE2 LYS 31 HE2 LYS 31 42.311 17.320 18.906 243 HE3 LYS 31 HE3 LYS 31 43.682 17.723 19.983 244 HZ1 LYS 31 HZ1 LYS 31 44.421 17.827 17.662 245 HZ2 LYS 31 HZ2 LYS 31 45.136 16.547 18.384 246 HZ3 LYS 31 HZ3 LYS 31 43.891 16.298 17.366 247 H LEU 32 H LEU 32 41.130 18.804 22.781 248 HA LEU 32 HA LEU 32 43.457 19.079 24.390 249 HB2 LEU 32 HB2 LEU 32 42.456 20.508 22.552 250 HB3 LEU 32 HB3 LEU 32 41.256 21.029 23.737 251 HG LEU 32 HG LEU 32 43.046 22.643 23.220 252 HD11 LEU 32 HD11 LEU 32 41.859 22.807 25.371 253 HD12 LEU 32 HD12 LEU 32 43.132 21.833 26.139 254 HD13 LEU 32 HD13 LEU 32 43.521 23.417 25.449 255 HD21 LEU 32 HD21 LEU 32 45.317 22.355 23.997 256 HD22 LEU 32 HD22 LEU 32 44.934 20.754 24.664 257 HD23 LEU 32 HD23 LEU 32 44.874 21.022 22.913 258 H LEU 33 H LEU 33 39.984 19.643 25.176 259 HA LEU 33 HA LEU 33 40.432 20.630 27.788 260 HB2 LEU 33 HB2 LEU 33 38.010 19.293 26.497 261 HB3 LEU 33 HB3 LEU 33 37.936 20.054 28.081 262 HG LEU 33 HG LEU 33 38.801 21.530 25.579 263 HD11 LEU 33 HD11 LEU 33 36.428 20.787 25.390 264 HD12 LEU 33 HD12 LEU 33 36.083 21.843 26.786 265 HD13 LEU 33 HD13 LEU 33 36.724 22.531 25.303 266 HD21 LEU 33 HD21 LEU 33 38.004 22.504 28.333 267 HD22 LEU 33 HD22 LEU 33 39.597 22.659 27.539 268 HD23 LEU 33 HD23 LEU 33 38.211 23.562 26.925 269 H HIS 34 H HIS 34 39.895 17.288 26.720 270 HA HIS 34 HA HIS 34 40.111 16.168 29.411 271 HB2 HIS 34 HB2 HIS 34 39.912 15.046 26.620 272 HB3 HIS 34 HB3 HIS 34 40.387 14.020 27.977 273 HD1 HIS 34 HD1 HIS 34 38.464 13.789 30.030 274 HD2 HIS 34 HD2 HIS 34 37.312 15.554 26.379 275 HE1 HIS 34 HE1 HIS 34 35.925 13.674 29.926 276 H ALA 35 H ALA 35 42.465 16.932 26.766 277 HA ALA 35 HA ALA 35 44.544 15.285 27.990 278 HB1 ALA 35 HB1 ALA 35 44.594 15.858 25.606 279 HB2 ALA 35 HB2 ALA 35 44.710 17.589 25.996 280 HB3 ALA 35 HB3 ALA 35 46.033 16.483 26.420 281 H ARG 36 H ARG 36 43.515 18.620 28.313 282 HA ARG 36 HA ARG 36 45.843 19.384 29.976 283 HB2 ARG 36 HB2 ARG 36 43.557 20.929 28.693 284 HB3 ARG 36 HB3 ARG 36 44.870 21.633 29.618 285 HG2 ARG 36 HG2 ARG 36 45.085 20.183 26.962 286 HG3 ARG 36 HG3 ARG 36 45.245 21.921 27.224 287 HD2 ARG 36 HD2 ARG 36 47.089 19.793 28.325 288 HD3 ARG 36 HD3 ARG 36 47.379 20.749 26.861 289 HE ARG 36 HE ARG 36 47.209 22.791 28.474 290 HH11 ARG 36 HH12 ARG 36 48.806 19.760 29.414 291 HH12 ARG 36 HH11 ARG 36 50.036 20.641 30.275 292 HH21 ARG 36 HH22 ARG 36 48.705 23.743 29.492 293 HH22 ARG 36 HH21 ARG 36 50.011 22.881 30.316 294 H THR 37 H THR 37 43.182 17.989 30.873 295 HA THR 37 HA THR 37 42.018 17.692 32.824 296 HB THR 37 HB THR 37 43.611 19.583 34.439 297 HG1 THR 37 HG1 THR 37 45.421 18.641 33.930 298 HG21 THR 37 HG21 THR 37 42.792 16.656 34.883 299 HG22 THR 37 HG22 THR 37 41.895 18.063 35.475 300 HG23 THR 37 HG23 THR 37 43.520 17.735 36.094 301 H LYS 38 H LYS 38 41.162 19.775 31.056 302 HA LYS 38 HA LYS 38 40.231 21.963 32.829 303 HB2 LYS 38 HB2 LYS 38 39.769 21.281 29.921 304 HB3 LYS 38 HB3 LYS 38 38.721 22.368 30.817 305 HG2 LYS 38 HG2 LYS 38 40.432 23.548 29.465 306 HG3 LYS 38 HG3 LYS 38 40.524 23.976 31.141 307 HD2 LYS 38 HD2 LYS 38 42.354 21.780 30.269 308 HD3 LYS 38 HD3 LYS 38 42.651 23.347 29.539 309 HE2 LYS 38 HE2 LYS 38 42.624 24.274 31.982 310 HE3 LYS 38 HE3 LYS 38 42.783 22.596 32.474 311 HZ1 LYS 38 HZ1 LYS 38 44.862 22.445 31.498 312 HZ2 LYS 38 HZ2 LYS 38 44.763 23.860 30.622 313 HZ3 LYS 38 HZ3 LYS 38 44.904 23.845 32.268 314 H ASP 39 H ASP 39 38.948 21.289 34.344 315 HA ASP 39 HA ASP 39 37.172 19.210 34.160 316 HB2 ASP 39 HB2 ASP 39 37.913 20.382 36.262 317 HB3 ASP 39 HB3 ASP 39 36.737 21.653 35.934 318 H ILE 40 H ILE 40 35.912 18.919 32.588 319 HA ILE 40 HA ILE 40 34.213 21.091 31.519 320 HB ILE 40 HB ILE 40 36.246 20.328 30.313 321 HG12 ILE 40 HG12 ILE 40 33.679 20.908 29.163 322 HG13 ILE 40 HG13 ILE 40 35.286 21.418 28.737 323 HG21 ILE 40 HG21 ILE 40 34.747 17.767 29.671 324 HG22 ILE 40 HG22 ILE 40 36.381 18.233 29.157 325 HG23 ILE 40 HG23 ILE 40 36.063 17.903 30.846 326 HD11 ILE 40 HD11 ILE 40 35.602 19.389 27.328 327 HD12 ILE 40 HD12 ILE 40 33.968 18.837 27.773 328 HD13 ILE 40 HD13 ILE 40 34.179 20.325 26.840 329 H THR 41 H THR 41 32.235 20.841 30.766 330 HA THR 41 HA THR 41 30.894 18.173 30.588 331 HB THR 41 HB THR 41 29.863 20.792 31.733 332 HG1 THR 41 HG1 THR 41 29.275 19.502 33.384 333 HG21 THR 41 HG21 THR 41 28.161 18.497 30.688 334 HG22 THR 41 HG22 THR 41 28.127 20.199 30.154 335 HG23 THR 41 HG23 THR 41 27.585 19.778 31.779 336 H VAL 42 H VAL 42 30.262 17.835 28.433 337 HA VAL 42 HA VAL 42 29.565 20.264 26.898 338 HB VAL 42 HB VAL 42 31.578 19.798 26.045 339 HG11 VAL 42 HG11 VAL 42 32.472 18.026 25.031 340 HG12 VAL 42 HG12 VAL 42 32.089 17.657 26.712 341 HG13 VAL 42 HG13 VAL 42 31.062 16.971 25.407 342 HG21 VAL 42 HG21 VAL 42 31.184 19.438 23.667 343 HG22 VAL 42 HG22 VAL 42 29.673 18.575 24.006 344 HG23 VAL 42 HG23 VAL 42 29.800 20.317 24.322 345 H HIS 43 H HIS 43 27.842 20.426 25.952 346 HA HIS 43 HA HIS 43 25.831 18.235 26.018 347 HB2 HIS 43 HB2 HIS 43 25.805 21.270 26.131 348 HB3 HIS 43 HB3 HIS 43 24.368 20.396 25.698 349 HD1 HIS 43 HD1 HIS 43 24.254 18.083 27.876 350 HD2 HIS 43 HD2 HIS 43 25.593 22.018 28.604 351 HE1 HIS 43 HE1 HIS 43 24.006 18.481 30.357 352 H TYR 44 H TYR 44 25.982 17.152 24.093 353 HA TYR 44 HA TYR 44 26.161 18.594 21.537 354 HB2 TYR 44 HB2 TYR 44 25.803 15.691 22.265 355 HB3 TYR 44 HB3 TYR 44 25.546 16.290 20.639 356 HD1 TYR 44 HD2 TYR 44 28.173 16.030 23.279 357 HD2 TYR 44 HD1 TYR 44 27.263 17.082 19.239 358 HE1 TYR 44 HE2 TYR 44 30.620 16.054 22.755 359 HE2 TYR 44 HE1 TYR 44 29.700 16.997 18.650 360 HH TYR 44 HH TYR 44 32.202 15.998 20.984 361 H VAL 45 H VAL 45 24.496 20.079 21.561 362 HA VAL 45 HA VAL 45 21.840 19.462 22.392 363 HB VAL 45 HB VAL 45 21.174 21.630 21.579 364 HG11 VAL 45 HG11 VAL 45 22.627 23.006 22.932 365 HG12 VAL 45 HG12 VAL 45 22.451 21.424 23.719 366 HG13 VAL 45 HG13 VAL 45 23.939 21.817 22.828 367 HG21 VAL 45 HG21 VAL 45 23.947 21.891 20.330 368 HG22 VAL 45 HG22 VAL 45 22.400 21.759 19.461 369 HG23 VAL 45 HG23 VAL 45 22.725 23.169 20.465 370 H ASP 46 H ASP 46 23.338 18.868 19.370 371 HA ASP 46 HA ASP 46 21.063 18.510 17.662 372 HB2 ASP 46 HB2 ASP 46 23.520 18.521 17.056 373 HB3 ASP 46 HB3 ASP 46 23.670 16.928 17.756 374 H LYS 47 H LYS 47 22.334 16.585 20.338 375 HA LYS 47 HA LYS 47 20.592 14.239 19.863 376 HB2 LYS 47 HB2 LYS 47 22.619 14.768 22.020 377 HB3 LYS 47 HB3 LYS 47 21.715 13.296 21.749 378 HG2 LYS 47 HG2 LYS 47 22.824 13.709 19.248 379 HG3 LYS 47 HG3 LYS 47 24.078 14.359 20.302 380 HD2 LYS 47 HD2 LYS 47 22.868 11.575 20.291 381 HD3 LYS 47 HD3 LYS 47 24.536 12.021 19.890 382 HE2 LYS 47 HE2 LYS 47 24.770 12.884 22.254 383 HE3 LYS 47 HE3 LYS 47 23.197 12.192 22.632 384 HZ1 LYS 47 HZ1 LYS 47 24.945 10.632 23.240 385 HZ2 LYS 47 HZ2 LYS 47 24.004 10.009 22.042 386 HZ3 LYS 47 HZ3 LYS 47 25.515 10.593 21.704 387 H MET 48 H MET 48 20.142 17.236 21.427 388 HA MET 48 HA MET 48 18.686 16.060 23.755 389 HB2 MET 48 HB2 MET 48 19.814 18.847 23.345 390 HB3 MET 48 HB3 MET 48 18.977 18.279 24.793 391 HG2 MET 48 HG2 MET 48 20.732 16.656 25.248 392 HG3 MET 48 HG3 MET 48 21.509 17.019 23.711 393 HE1 MET 48 HE1 MET 48 21.672 19.588 27.537 394 HE2 MET 48 HE2 MET 48 20.115 19.162 26.795 395 HE3 MET 48 HE3 MET 48 21.176 17.886 27.436 396 H SER 49 H SER 49 16.538 16.198 23.947 397 HA SER 49 HA SER 49 14.834 17.475 22.062 398 HB2 SER 49 HB2 SER 49 14.029 16.810 24.901 399 HB3 SER 49 HB3 SER 49 13.034 16.809 23.433 400 HG SER 49 HG SER 49 13.502 14.721 23.607 401 H GLU 50 H GLU 50 16.078 18.631 25.206 402 HA GLU 50 HA GLU 50 14.724 21.182 25.075 403 HB2 GLU 50 HB2 GLU 50 15.982 19.814 27.095 404 HB3 GLU 50 HB3 GLU 50 17.276 20.897 26.628 405 HG2 GLU 50 HG2 GLU 50 16.282 22.272 28.132 406 HG3 GLU 50 HG3 GLU 50 15.197 22.687 26.806 407 H GLY 51 H GLY 51 17.317 20.045 23.233 408 HA2 GLY 51 HA2 GLY 51 19.307 21.967 23.283 409 HA3 GLY 51 HA3 GLY 51 18.844 21.032 21.864 410 H GLU 52 H GLU 52 16.130 22.347 21.759 411 HA GLU 52 HA GLU 52 16.884 24.637 20.087 412 HB2 GLU 52 HB2 GLU 52 14.200 23.618 21.133 413 HB3 GLU 52 HB3 GLU 52 14.354 24.949 19.993 414 HG2 GLU 52 HG2 GLU 52 15.377 22.138 19.392 415 HG3 GLU 52 HG3 GLU 52 13.741 22.685 19.028 416 H GLN 53 H GLN 53 15.642 24.221 23.405 417 HA GLN 53 HA GLN 53 15.074 27.044 23.825 418 HB2 GLN 53 HB2 GLN 53 14.078 24.939 24.990 419 HB3 GLN 53 HB3 GLN 53 15.527 24.972 26.001 420 HG2 GLN 53 HG2 GLN 53 14.971 27.288 26.707 421 HG3 GLN 53 HG3 GLN 53 13.560 27.279 25.643 422 HE21 GLN 53 HE21 GLN 53 12.296 24.842 26.171 423 HE22 GLN 53 HE22 GLN 53 11.770 24.883 27.842 424 H LEU 54 H LEU 54 17.783 24.832 24.488 425 HA LEU 54 HA LEU 54 19.464 26.741 25.847 426 HB2 LEU 54 HB2 LEU 54 20.216 24.253 24.265 427 HB3 LEU 54 HB3 LEU 54 21.302 25.159 25.282 428 HG LEU 54 HG LEU 54 20.809 24.054 27.090 429 HD11 LEU 54 HD11 LEU 54 18.717 23.672 28.137 430 HD12 LEU 54 HD12 LEU 54 18.629 25.288 27.451 431 HD13 LEU 54 HD13 LEU 54 17.813 23.937 26.632 432 HD21 LEU 54 HD21 LEU 54 19.091 22.231 25.438 433 HD22 LEU 54 HD22 LEU 54 20.872 22.205 25.486 434 HD23 LEU 54 HD23 LEU 54 19.934 21.856 26.945 435 H ARG 55 H ARG 55 19.291 25.739 22.392 436 HA ARG 55 HA ARG 55 21.321 27.441 21.348 437 HB2 ARG 55 HB2 ARG 55 18.733 26.319 20.220 438 HB3 ARG 55 HB3 ARG 55 19.783 27.352 19.250 439 HG2 ARG 55 HG2 ARG 55 21.532 25.779 19.189 440 HG3 ARG 55 HG3 ARG 55 20.958 24.943 20.618 441 HD2 ARG 55 HD2 ARG 55 20.297 23.399 19.186 442 HD3 ARG 55 HD3 ARG 55 18.871 24.356 19.024 443 HE ARG 55 HE ARG 55 20.508 23.539 16.983 444 HH11 ARG 55 HH22 ARG 55 18.857 26.595 17.593 445 HH12 ARG 55 HH21 ARG 55 19.496 27.282 16.116 446 HH21 ARG 55 HH12 ARG 55 20.443 24.268 14.901 447 HH22 ARG 55 HH11 ARG 55 20.084 25.958 14.597 448 H GLY 56 H GLY 56 17.896 28.249 22.047 449 HA2 GLY 56 HA2 GLY 56 17.939 30.848 20.837 450 HA3 GLY 56 HA3 GLY 56 16.814 30.285 22.080 451 H GLU 57 H GLU 57 18.739 29.771 24.167 452 HA GLU 57 HA GLU 57 19.101 32.451 25.215 453 HB2 GLU 57 HB2 GLU 57 19.564 29.633 26.120 454 HB3 GLU 57 HB3 GLU 57 20.580 30.850 26.874 455 HG2 GLU 57 HG2 GLU 57 17.531 31.068 26.788 456 HG3 GLU 57 HG3 GLU 57 18.455 30.319 28.037 457 H ILE 58 H ILE 58 21.310 30.218 23.553 458 HA ILE 58 HA ILE 58 23.647 31.937 23.947 459 HB ILE 58 HB ILE 58 23.170 29.869 21.769 460 HG12 ILE 58 HG12 ILE 58 24.674 29.427 24.395 461 HG13 ILE 58 HG13 ILE 58 23.006 28.928 24.155 462 HG21 ILE 58 HG21 ILE 58 25.569 29.857 21.481 463 HG22 ILE 58 HG22 ILE 58 25.093 31.548 21.461 464 HG23 ILE 58 HG23 ILE 58 25.821 30.872 22.918 465 HD11 ILE 58 HD11 ILE 58 24.402 27.026 23.814 466 HD12 ILE 58 HD12 ILE 58 23.688 27.480 22.259 467 HD13 ILE 58 HD13 ILE 58 25.390 27.869 22.611 468 H TYR 59 H TYR 59 21.223 31.481 21.300 469 HA TYR 59 HA TYR 59 22.475 33.319 19.584 470 HB2 TYR 59 HB2 TYR 59 20.642 31.519 19.111 471 HB3 TYR 59 HB3 TYR 59 19.499 32.826 19.407 472 HD1 TYR 59 HD1 TYR 59 22.209 31.549 17.336 473 HD2 TYR 59 HD2 TYR 59 19.472 34.818 17.815 474 HE1 TYR 59 HE1 TYR 59 22.840 32.349 15.076 475 HE2 TYR 59 HE2 TYR 59 20.146 35.706 15.594 476 HH TYR 59 HH TYR 59 22.652 34.076 13.597 477 H GLN 60 H GLN 60 19.755 33.960 21.826 478 HA GLN 60 HA GLN 60 19.265 36.618 20.953 479 HB2 GLN 60 HB2 GLN 60 18.794 35.229 23.617 480 HB3 GLN 60 HB3 GLN 60 18.209 36.862 23.245 481 HG2 GLN 60 HG2 GLN 60 16.885 36.042 21.368 482 HG3 GLN 60 HG3 GLN 60 17.516 34.415 21.549 483 HE21 GLN 60 HE21 GLN 60 15.175 33.830 21.655 484 HE22 GLN 60 HE22 GLN 60 14.272 34.145 23.138 485 H ALA 61 H ALA 61 21.766 35.436 23.193 486 HA ALA 61 HA ALA 61 22.580 38.177 23.921 487 HB1 ALA 61 HB1 ALA 61 22.637 36.431 25.607 488 HB2 ALA 61 HB2 ALA 61 23.698 35.434 24.593 489 HB3 ALA 61 HB3 ALA 61 24.288 36.977 25.251 490 H TYR 62 H TYR 62 23.907 35.504 21.890 491 HA TYR 62 HA TYR 62 26.229 37.258 21.235 492 HB2 TYR 62 HB2 TYR 62 26.096 34.241 21.198 493 HB3 TYR 62 HB3 TYR 62 27.530 35.258 21.136 494 HD1 TYR 62 HD1 TYR 62 27.720 36.983 23.253 495 HD2 TYR 62 HD2 TYR 62 25.575 33.257 23.262 496 HE1 TYR 62 HE1 TYR 62 27.783 36.957 25.736 497 HE2 TYR 62 HE2 TYR 62 25.573 33.262 25.750 498 HH TYR 62 HH TYR 62 26.006 34.484 27.615 499 H LYS 63 H LYS 63 23.516 36.019 19.669 500 HA LYS 63 HA LYS 63 22.886 35.456 17.625 501 HB2 LYS 63 HB2 LYS 63 24.869 37.523 16.643 502 HB3 LYS 63 HB3 LYS 63 23.452 36.940 15.771 503 HG2 LYS 63 HG2 LYS 63 23.372 38.447 18.413 504 HG3 LYS 63 HG3 LYS 63 23.184 39.190 16.836 505 HD2 LYS 63 HD2 LYS 63 21.073 38.136 16.443 506 HD3 LYS 63 HD3 LYS 63 21.275 37.023 17.816 507 HE2 LYS 63 HE2 LYS 63 21.265 38.863 19.401 508 HE3 LYS 63 HE3 LYS 63 21.212 40.045 18.088 509 HZ1 LYS 63 HZ1 LYS 63 19.011 38.117 18.641 510 HZ2 LYS 63 HZ2 LYS 63 19.058 39.667 19.151 511 HZ3 LYS 63 HZ3 LYS 63 18.994 39.341 17.547 512 H HIS 64 H HIS 64 24.696 33.757 18.663 513 HA HIS 64 HA HIS 64 25.403 32.194 16.258 514 HB2 HIS 64 HB2 HIS 64 27.130 32.502 18.758 515 HB3 HIS 64 HB3 HIS 64 27.337 31.235 17.551 516 HD1 HIS 64 HD1 HIS 64 28.433 34.787 18.202 517 HD2 HIS 64 HD2 HIS 64 28.072 32.061 15.002 518 HE1 HIS 64 HE1 HIS 64 29.881 35.683 16.332 519 H GLU 65 H GLU 65 24.991 29.896 16.653 520 HA GLU 65 HA GLU 65 23.263 29.381 19.076 521 HB2 GLU 65 HB2 GLU 65 21.882 27.900 17.769 522 HB3 GLU 65 HB3 GLU 65 21.859 29.512 17.105 523 HG2 GLU 65 HG2 GLU 65 23.817 28.456 15.549 524 HG3 GLU 65 HG3 GLU 65 22.947 26.985 15.943 525 H THR 66 H THR 66 25.492 27.887 16.756 526 HA THR 66 HA THR 66 27.045 26.673 18.870 527 HB THR 66 HB THR 66 25.268 24.885 17.223 528 HG1 THR 66 HG1 THR 66 24.931 25.644 19.474 529 HG21 THR 66 HG21 THR 66 27.798 23.984 18.643 530 HG22 THR 66 HG22 THR 66 27.482 23.870 16.886 531 HG23 THR 66 HG23 THR 66 26.525 22.927 18.029 532 H VAL 67 H VAL 67 29.091 26.286 18.133 533 HA VAL 67 HA VAL 67 29.588 25.858 15.304 534 HB VAL 67 HB VAL 67 29.498 28.306 15.506 535 HG11 VAL 67 HG11 VAL 67 30.488 28.641 17.722 536 HG12 VAL 67 HG12 VAL 67 32.064 28.071 17.104 537 HG13 VAL 67 HG13 VAL 67 31.339 29.560 16.479 538 HG21 VAL 67 HG21 VAL 67 32.257 27.358 14.679 539 HG22 VAL 67 HG22 VAL 67 30.784 27.206 13.694 540 HG23 VAL 67 HG23 VAL 67 31.393 28.805 14.140 541 HA PRO 68 HA PRO 68 29.687 24.924 18.944 542 HB2 PRO 68 HB2 PRO 68 31.154 24.160 21.041 543 HB3 PRO 68 HB3 PRO 68 30.864 23.054 19.664 544 HG2 PRO 68 HG2 PRO 68 33.290 24.839 20.123 545 HG3 PRO 68 HG3 PRO 68 33.268 23.068 19.829 546 HD2 PRO 68 HD2 PRO 68 33.617 24.846 17.795 547 HD3 PRO 68 HD3 PRO 68 32.668 23.352 17.572 548 H ALA 69 H ALA 69 29.279 25.891 21.034 549 HA ALA 69 HA ALA 69 30.569 28.564 21.410 550 HB1 ALA 69 HB1 ALA 69 27.944 27.498 22.526 551 HB2 ALA 69 HB2 ALA 69 28.608 29.131 22.744 552 HB3 ALA 69 HB3 ALA 69 28.108 28.591 21.134 553 H ILE 70 H ILE 70 31.764 28.960 23.256 554 HA ILE 70 HA ILE 70 32.186 26.679 25.145 555 HB ILE 70 HB ILE 70 34.265 28.550 23.945 556 HG12 ILE 70 HG12 ILE 70 33.949 25.561 23.439 557 HG13 ILE 70 HG13 ILE 70 33.390 26.807 22.326 558 HG21 ILE 70 HG21 ILE 70 35.928 27.138 25.112 559 HG22 ILE 70 HG22 ILE 70 34.837 27.897 26.252 560 HG23 ILE 70 HG23 ILE 70 34.617 26.184 25.838 561 HD11 ILE 70 HD11 ILE 70 35.714 27.677 22.105 562 HD12 ILE 70 HD12 ILE 70 36.285 26.297 23.075 563 HD13 ILE 70 HD13 ILE 70 35.489 26.019 21.521 564 H PHE 71 H PHE 71 32.071 27.155 27.257 565 HA PHE 71 HA PHE 71 32.270 30.003 28.117 566 HB2 PHE 71 HB2 PHE 71 30.179 27.970 28.945 567 HB3 PHE 71 HB3 PHE 71 30.395 29.579 29.630 568 HD1 PHE 71 HD1 PHE 71 29.390 27.731 26.551 569 HD2 PHE 71 HD2 PHE 71 29.437 31.520 28.610 570 HE1 PHE 71 HE1 PHE 71 27.765 28.661 24.908 571 HE2 PHE 71 HE2 PHE 71 27.790 32.421 26.985 572 HZ PHE 71 HZ PHE 71 26.963 30.982 25.127 573 H ILE 72 H ILE 72 33.065 30.409 30.125 574 HA ILE 72 HA ILE 72 33.855 28.129 31.856 575 HB ILE 72 HB ILE 72 35.765 30.417 31.252 576 HG12 ILE 72 HG12 ILE 72 35.802 27.555 30.200 577 HG13 ILE 72 HG13 ILE 72 35.612 29.029 29.250 578 HG21 ILE 72 HG21 ILE 72 37.352 28.969 32.576 579 HG22 ILE 72 HG22 ILE 72 35.969 29.459 33.532 580 HG23 ILE 72 HG23 ILE 72 36.043 27.821 32.856 581 HD11 ILE 72 HD11 ILE 72 38.124 28.115 30.675 582 HD12 ILE 72 HD12 ILE 72 37.843 28.275 28.937 583 HD13 ILE 72 HD13 ILE 72 37.922 29.733 29.949 584 H ASN 73 H ASN 73 33.114 28.483 33.903 585 HA ASN 73 HA ASN 73 31.911 29.524 35.557 586 HB2 ASN 73 HB2 ASN 73 34.367 31.289 35.323 587 HB3 ASN 73 HB3 ASN 73 33.234 31.399 36.660 588 HD21 ASN 73 HD21 ASN 73 35.955 30.801 37.001 589 HD22 ASN 73 HD22 ASN 73 35.988 29.223 37.734 590 H GLY 74 H GLY 74 30.542 30.085 33.365 591 HA2 GLY 74 HA2 GLY 74 28.772 31.417 32.685 592 HA3 GLY 74 HA3 GLY 74 29.148 32.540 33.984 593 H ASN 75 H ASN 75 31.987 32.316 32.147 594 HA ASN 75 HA ASN 75 31.317 34.790 30.620 595 HB2 ASN 75 HB2 ASN 75 33.962 33.483 31.399 596 HB3 ASN 75 HB3 ASN 75 33.839 34.864 30.344 597 HD21 ASN 75 HD21 ASN 75 34.329 34.049 33.540 598 HD22 ASN 75 HD22 ASN 75 33.846 35.606 34.213 599 H PHE 76 H PHE 76 31.709 34.940 28.397 600 HA PHE 76 HA PHE 76 31.576 32.354 26.929 601 HB2 PHE 76 HB2 PHE 76 29.700 33.843 26.602 602 HB3 PHE 76 HB3 PHE 76 30.767 35.184 26.217 603 HD1 PHE 76 HD2 PHE 76 30.427 31.600 25.001 604 HD2 PHE 76 HD1 PHE 76 30.683 35.784 23.971 605 HE1 PHE 76 HE2 PHE 76 30.417 31.017 22.593 606 HE2 PHE 76 HE1 PHE 76 30.645 35.191 21.570 607 HZ PHE 76 HZ PHE 76 30.525 32.807 20.870 608 H ILE 77 H ILE 77 32.998 31.725 25.485 609 HA ILE 77 HA ILE 77 35.311 33.392 24.625 610 HB ILE 77 HB ILE 77 35.331 30.539 25.699 611 HG12 ILE 77 HG12 ILE 77 35.302 32.127 27.545 612 HG13 ILE 77 HG13 ILE 77 36.839 31.299 27.444 613 HG21 ILE 77 HG21 ILE 77 36.887 30.601 23.856 614 HG22 ILE 77 HG22 ILE 77 37.621 32.106 24.444 615 HG23 ILE 77 HG23 ILE 77 37.808 30.598 25.357 616 HD11 ILE 77 HD11 ILE 77 37.884 33.317 26.428 617 HD12 ILE 77 HD12 ILE 77 36.329 34.160 26.510 618 HD13 ILE 77 HD13 ILE 77 37.147 33.666 27.999 619 H GLY 78 H GLY 78 35.862 33.061 22.428 620 HA2 GLY 78 HA2 GLY 78 34.577 30.710 21.078 621 HA3 GLY 78 HA3 GLY 78 34.368 32.298 20.372 622 H GLY 79 H GLY 79 36.024 29.549 20.159 623 HA2 GLY 79 HA2 GLY 79 37.374 29.594 17.994 624 HA3 GLY 79 HA3 GLY 79 38.456 30.672 18.859 625 H CYS 80 H CYS 80 38.266 27.583 17.861 626 HA CYS 80 HA CYS 80 39.077 26.090 20.171 627 HB2 CYS 80 HB2 CYS 80 39.532 25.612 17.197 628 HB3 CYS 80 HB3 CYS 80 39.878 24.432 18.479 629 HG CYS 80 HG CYS 80 37.025 25.873 17.614 630 H SER 81 H SER 81 41.024 28.041 17.906 631 HA SER 81 HA SER 81 43.550 27.339 19.244 632 HB2 SER 81 HB2 SER 81 42.931 29.403 17.111 633 HB3 SER 81 HB3 SER 81 44.534 29.065 17.792 634 HG SER 81 HG SER 81 44.031 27.879 15.839 635 H ASP 82 H ASP 82 41.107 29.882 19.433 636 HA ASP 82 HA ASP 82 42.425 31.720 21.150 637 HB2 ASP 82 HB2 ASP 82 40.110 31.723 19.890 638 HB3 ASP 82 HB3 ASP 82 39.454 31.069 21.371 639 H LEU 83 H LEU 83 40.516 28.865 21.874 640 HA LEU 83 HA LEU 83 40.664 28.803 24.715 641 HB2 LEU 83 HB2 LEU 83 39.107 27.442 23.428 642 HB3 LEU 83 HB3 LEU 83 40.425 26.651 22.578 643 HG LEU 83 HG LEU 83 41.160 25.556 24.654 644 HD11 LEU 83 HD11 LEU 83 40.329 27.148 26.347 645 HD12 LEU 83 HD12 LEU 83 38.650 26.786 25.882 646 HD13 LEU 83 HD13 LEU 83 39.669 25.538 26.637 647 HD21 LEU 83 HD21 LEU 83 39.582 24.454 23.106 648 HD22 LEU 83 HD22 LEU 83 39.340 23.944 24.782 649 HD23 LEU 83 HD23 LEU 83 38.216 25.107 24.038 650 H GLU 84 H GLU 84 42.896 27.328 22.278 651 HA GLU 84 HA GLU 84 44.737 26.309 24.271 652 HB2 GLU 84 HB2 GLU 84 45.174 26.973 21.327 653 HB3 GLU 84 HB3 GLU 84 46.370 26.214 22.388 654 HG2 GLU 84 HG2 GLU 84 44.732 24.374 22.855 655 HG3 GLU 84 HG3 GLU 84 43.671 25.052 21.617 656 H ALA 85 H ALA 85 44.414 29.496 22.706 657 HA ALA 85 HA ALA 85 46.958 30.500 23.556 658 HB1 ALA 85 HB1 ALA 85 44.371 32.030 23.026 659 HB2 ALA 85 HB2 ALA 85 45.998 32.708 23.095 660 HB3 ALA 85 HB3 ALA 85 45.578 31.569 21.805 661 H LEU 86 H LEU 86 43.828 30.297 25.274 662 HA LEU 86 HA LEU 86 44.668 31.823 27.599 663 HB2 LEU 86 HB2 LEU 86 42.527 29.682 27.231 664 HB3 LEU 86 HB3 LEU 86 42.752 30.618 28.702 665 HG LEU 86 HG LEU 86 42.034 31.817 25.999 666 HD11 LEU 86 HD11 LEU 86 39.808 32.120 26.968 667 HD12 LEU 86 HD12 LEU 86 40.238 30.407 26.919 668 HD13 LEU 86 HD13 LEU 86 40.316 31.296 28.461 669 HD21 LEU 86 HD21 LEU 86 41.479 33.837 27.335 670 HD22 LEU 86 HD22 LEU 86 42.137 33.052 28.790 671 HD23 LEU 86 HD23 LEU 86 43.196 33.456 27.409 672 H ASP 87 H ASP 87 45.021 28.448 26.611 673 HA ASP 87 HA ASP 87 46.095 27.560 29.158 674 HB2 ASP 87 HB2 ASP 87 45.000 26.131 27.305 675 HB3 ASP 87 HB3 ASP 87 46.554 26.211 26.502 676 H LYS 88 H LYS 88 47.589 28.697 26.111 677 HA LYS 88 HA LYS 88 50.318 28.487 27.114 678 HB2 LYS 88 HB2 LYS 88 49.030 29.864 24.731 679 HB3 LYS 88 HB3 LYS 88 50.686 30.240 25.186 680 HG2 LYS 88 HG2 LYS 88 50.892 28.581 23.567 681 HG3 LYS 88 HG3 LYS 88 51.257 27.797 25.103 682 HD2 LYS 88 HD2 LYS 88 48.922 26.825 25.113 683 HD3 LYS 88 HD3 LYS 88 48.620 27.658 23.581 684 HE2 LYS 88 HE2 LYS 88 49.137 25.374 23.084 685 HE3 LYS 88 HE3 LYS 88 50.442 26.404 22.490 686 HZ1 LYS 88 HZ1 LYS 88 50.522 24.885 25.044 687 HZ2 LYS 88 HZ2 LYS 88 51.277 24.419 23.646 688 HZ3 LYS 88 HZ3 LYS 88 51.772 25.741 24.436 689 H GLU 89 H GLU 89 47.925 31.056 27.381 690 HA GLU 89 HA GLU 89 49.809 32.898 28.679 691 HB2 GLU 89 HB2 GLU 89 46.771 32.851 28.381 692 HB3 GLU 89 HB3 GLU 89 47.663 34.115 29.228 693 HG2 GLU 89 HG2 GLU 89 48.830 34.797 27.270 694 HG3 GLU 89 HG3 GLU 89 48.156 33.479 26.311 695 H GLY 90 H GLY 90 48.633 30.024 29.820 696 HA2 GLY 90 HA2 GLY 90 48.664 29.114 31.930 697 HA3 GLY 90 HA3 GLY 90 49.304 30.650 32.539 698 H LYS 91 H LYS 91 46.393 31.260 30.928 699 HA LYS 91 HA LYS 91 45.138 31.992 33.511 700 HB2 LYS 91 HB2 LYS 91 44.857 32.682 30.568 701 HB3 LYS 91 HB3 LYS 91 43.511 33.020 31.643 702 HG2 LYS 91 HG2 LYS 91 44.712 34.537 32.965 703 HG3 LYS 91 HG3 LYS 91 46.276 33.962 32.393 704 HD2 LYS 91 HD2 LYS 91 45.642 36.189 31.490 705 HD3 LYS 91 HD3 LYS 91 46.032 34.968 30.284 706 HE2 LYS 91 HE2 LYS 91 43.660 34.650 29.776 707 HE3 LYS 91 HE3 LYS 91 43.232 35.878 30.991 708 HZ1 LYS 91 HZ1 LYS 91 44.499 37.490 29.691 709 HZ2 LYS 91 HZ2 LYS 91 44.912 36.355 28.571 710 HZ3 LYS 91 HZ3 LYS 91 43.327 36.820 28.762 711 H LEU 92 H LEU 92 44.793 29.529 31.105 712 HA LEU 92 HA LEU 92 42.140 28.700 31.966 713 HB2 LEU 92 HB2 LEU 92 43.253 28.376 29.685 714 HB3 LEU 92 HB3 LEU 92 44.258 27.142 30.426 715 HG LEU 92 HG LEU 92 42.267 25.781 30.878 716 HD11 LEU 92 HD11 LEU 92 40.075 26.413 29.858 717 HD12 LEU 92 HD12 LEU 92 40.532 27.452 31.206 718 HD13 LEU 92 HD13 LEU 92 40.730 28.031 29.532 719 HD21 LEU 92 HD21 LEU 92 41.640 25.339 28.472 720 HD22 LEU 92 HD22 LEU 92 42.471 26.834 28.019 721 HD23 LEU 92 HD23 LEU 92 43.384 25.488 28.726 722 H ASP 93 H ASP 93 45.513 27.660 32.705 723 HA ASP 93 HA ASP 93 44.775 25.821 34.810 724 HB2 ASP 93 HB2 ASP 93 47.278 27.299 33.990 725 HB3 ASP 93 HB3 ASP 93 47.222 26.535 35.564 726 H GLY 94 H GLY 94 45.362 29.348 34.811 727 HA2 GLY 94 HA2 GLY 94 45.172 29.750 37.605 728 HA3 GLY 94 HA3 GLY 94 44.750 30.939 36.362 729 H LEU 95 H LEU 95 42.589 29.482 35.145 730 HA LEU 95 HA LEU 95 40.408 30.038 36.994 731 HB2 LEU 95 HB2 LEU 95 40.695 28.986 34.157 732 HB3 LEU 95 HB3 LEU 95 39.118 28.973 34.957 733 HG LEU 95 HG LEU 95 40.783 31.518 34.820 734 HD11 LEU 95 HD11 LEU 95 40.435 30.689 32.490 735 HD12 LEU 95 HD12 LEU 95 38.680 30.696 32.781 736 HD13 LEU 95 HD13 LEU 95 39.599 32.208 32.840 737 HD21 LEU 95 HD21 LEU 95 37.773 31.049 35.017 738 HD22 LEU 95 HD22 LEU 95 38.835 31.454 36.379 739 HD23 LEU 95 HD23 LEU 95 38.614 32.615 35.067 740 H LEU 96 H LEU 96 42.152 27.160 36.025 741 HA LEU 96 HA LEU 96 40.383 25.413 37.642 742 HB2 LEU 96 HB2 LEU 96 42.477 25.002 35.513 743 HB3 LEU 96 HB3 LEU 96 41.950 23.587 36.417 744 HG LEU 96 HG LEU 96 39.854 25.508 35.262 745 HD11 LEU 96 HD11 LEU 96 39.797 24.076 33.265 746 HD12 LEU 96 HD12 LEU 96 41.245 25.084 33.399 747 HD13 LEU 96 HD13 LEU 96 41.363 23.362 33.816 748 HD21 LEU 96 HD21 LEU 96 39.154 23.653 36.813 749 HD22 LEU 96 HD22 LEU 96 38.520 23.430 35.173 750 HD23 LEU 96 HD23 LEU 96 39.921 22.483 35.731 751 H SER 97 H SER 97 42.654 27.386 38.569 752 HA SER 97 HA SER 97 44.079 25.697 40.531 753 HB2 SER 97 HB2 SER 97 43.846 28.720 40.245 754 HB3 SER 97 HB3 SER 97 44.805 27.883 41.473 755 HG SER 97 HG SER 97 45.068 27.421 38.665 Start of MODEL 10 1 H1 GLY 1 H1 GLY 1 15.744 33.531 27.148 2 H2 GLY 1 H2 GLY 1 16.552 32.477 28.112 3 H3 GLY 1 H3 GLY 1 17.059 34.042 27.996 4 HA2 GLY 1 HA2 GLY 1 15.933 33.765 30.074 5 HA3 GLY 1 HA3 GLY 1 15.007 34.826 29.002 6 H ALA 2 H ALA 2 13.187 34.293 30.234 7 HA ALA 2 HA ALA 2 11.205 33.399 30.685 8 HB1 ALA 2 HB1 ALA 2 10.134 31.809 29.185 9 HB2 ALA 2 HB2 ALA 2 10.932 33.111 28.279 10 HB3 ALA 2 HB3 ALA 2 11.671 31.495 28.365 11 H MET 3 H MET 3 13.736 30.919 30.465 12 HA MET 3 HA MET 3 12.917 29.904 33.105 13 HB2 MET 3 HB2 MET 3 13.237 28.178 30.616 14 HB3 MET 3 HB3 MET 3 13.474 27.530 32.240 15 HG2 MET 3 HG2 MET 3 11.194 28.227 32.872 16 HG3 MET 3 HG3 MET 3 10.914 28.803 31.223 17 HE1 MET 3 HE1 MET 3 9.179 26.647 33.009 18 HE2 MET 3 HE2 MET 3 8.660 27.287 31.432 19 HE3 MET 3 HE3 MET 3 8.691 25.532 31.716 20 HA PRO 4 HA PRO 4 17.279 30.064 33.891 21 HB2 PRO 4 HB2 PRO 4 17.015 27.314 35.113 22 HB3 PRO 4 HB3 PRO 4 17.810 28.779 35.777 23 HG2 PRO 4 HG2 PRO 4 15.361 28.074 36.660 24 HG3 PRO 4 HG3 PRO 4 15.716 29.793 36.283 25 HD2 PRO 4 HD2 PRO 4 14.270 27.754 34.572 26 HD3 PRO 4 HD3 PRO 4 13.845 29.457 34.923 27 H SER 5 H SER 5 16.124 27.012 32.443 28 HA SER 5 HA SER 5 17.023 25.676 30.814 29 HB2 SER 5 HB2 SER 5 17.307 28.500 29.791 30 HB3 SER 5 HB3 SER 5 17.533 27.080 28.745 31 HG SER 5 HG SER 5 15.318 27.964 28.885 32 H ILE 6 H ILE 6 19.392 26.916 29.047 33 HA ILE 6 HA ILE 6 21.339 25.227 30.300 34 HB ILE 6 HB ILE 6 22.754 25.591 28.610 35 HG12 ILE 6 HG12 ILE 6 21.462 28.210 28.025 36 HG13 ILE 6 HG13 ILE 6 23.134 27.893 28.439 37 HG21 ILE 6 HG21 ILE 6 21.673 24.837 26.805 38 HG22 ILE 6 HG22 ILE 6 20.488 24.517 28.079 39 HG23 ILE 6 HG23 ILE 6 20.335 25.971 27.032 40 HD11 ILE 6 HD11 ILE 6 22.902 28.494 26.094 41 HD12 ILE 6 HD12 ILE 6 23.500 26.826 26.238 42 HD13 ILE 6 HD13 ILE 6 21.809 27.133 25.799 43 H ALA 7 H ALA 7 20.691 28.594 30.536 44 HA ALA 7 HA ALA 7 23.163 29.698 31.355 45 HB1 ALA 7 HB1 ALA 7 21.194 31.007 30.668 46 HB2 ALA 7 HB2 ALA 7 20.343 30.532 32.153 47 HB3 ALA 7 HB3 ALA 7 21.809 31.525 32.247 48 H SER 8 H SER 8 20.712 27.983 33.270 49 HA SER 8 HA SER 8 22.042 28.233 35.865 50 HB2 SER 8 HB2 SER 8 19.684 27.619 35.709 51 HB3 SER 8 HB3 SER 8 20.077 26.198 34.718 52 HG SER 8 HG SER 8 19.884 25.449 36.759 53 H MET 9 H MET 9 22.243 25.863 33.184 54 HA MET 9 HA MET 9 23.811 23.941 34.569 55 HB2 MET 9 HB2 MET 9 23.269 22.737 32.857 56 HB3 MET 9 HB3 MET 9 22.548 24.145 32.064 57 HG2 MET 9 HG2 MET 9 24.434 24.647 30.893 58 HG3 MET 9 HG3 MET 9 25.467 23.544 31.792 59 HE1 MET 9 HE1 MET 9 22.172 21.593 29.166 60 HE2 MET 9 HE2 MET 9 21.879 22.217 30.794 61 HE3 MET 9 HE3 MET 9 22.163 23.344 29.445 62 H ILE 10 H ILE 10 24.806 26.899 32.922 63 HA ILE 10 HA ILE 10 27.566 26.382 32.687 64 HB ILE 10 HB ILE 10 26.589 29.116 33.529 65 HG12 ILE 10 HG12 ILE 10 24.946 28.449 31.870 66 HG13 ILE 10 HG13 ILE 10 25.995 29.710 31.267 67 HG21 ILE 10 HG21 ILE 10 28.764 28.081 31.670 68 HG22 ILE 10 HG22 ILE 10 28.309 29.792 31.804 69 HG23 ILE 10 HG23 ILE 10 28.965 28.932 33.205 70 HD11 ILE 10 HD11 ILE 10 25.506 28.021 29.551 71 HD12 ILE 10 HD12 ILE 10 27.241 28.079 29.907 72 HD13 ILE 10 HD13 ILE 10 26.242 26.756 30.558 73 H LYS 11 H LYS 11 25.721 26.912 35.599 74 HA LYS 11 HA LYS 11 28.087 27.566 37.254 75 HB2 LYS 11 HB2 LYS 11 25.103 27.348 37.876 76 HB3 LYS 11 HB3 LYS 11 26.350 27.633 39.085 77 HG2 LYS 11 HG2 LYS 11 25.630 29.759 38.670 78 HG3 LYS 11 HG3 LYS 11 27.071 29.671 37.657 79 HD2 LYS 11 HD2 LYS 11 25.650 29.356 35.654 80 HD3 LYS 11 HD3 LYS 11 24.197 29.310 36.676 81 HE2 LYS 11 HE2 LYS 11 24.663 31.616 37.438 82 HE3 LYS 11 HE3 LYS 11 26.139 31.657 36.470 83 HZ1 LYS 11 HZ1 LYS 11 24.210 32.734 35.358 84 HZ2 LYS 11 HZ2 LYS 11 24.812 31.519 34.460 85 HZ3 LYS 11 HZ3 LYS 11 23.420 31.313 35.306 86 H GLY 12 H GLY 12 26.796 24.624 36.158 87 HA2 GLY 12 HA2 GLY 12 27.004 23.073 38.594 88 HA3 GLY 12 HA3 GLY 12 26.854 22.458 36.949 89 H ASN 13 H ASN 13 29.334 23.788 36.016 90 HA ASN 13 HA ASN 13 31.524 22.467 37.530 91 HB2 ASN 13 HB2 ASN 13 30.857 22.010 34.587 92 HB3 ASN 13 HB3 ASN 13 32.441 21.681 35.272 93 HD21 ASN 13 HD21 ASN 13 32.691 19.929 36.890 94 HD22 ASN 13 HD22 ASN 13 31.428 18.699 36.922 95 H LYS 14 H LYS 14 33.675 23.218 36.803 96 HA LYS 14 HA LYS 14 33.838 26.070 36.723 97 HB2 LYS 14 HB2 LYS 14 35.536 24.372 37.579 98 HB3 LYS 14 HB3 LYS 14 35.931 24.036 35.894 99 HG2 LYS 14 HG2 LYS 14 37.456 25.637 35.949 100 HG3 LYS 14 HG3 LYS 14 36.164 26.834 36.063 101 HD2 LYS 14 HD2 LYS 14 37.590 27.353 37.862 102 HD3 LYS 14 HD3 LYS 14 36.273 26.453 38.631 103 HE2 LYS 14 HE2 LYS 14 37.702 24.358 38.431 104 HE3 LYS 14 HE3 LYS 14 39.002 25.368 37.795 105 HZ1 LYS 14 HZ1 LYS 14 38.895 26.620 39.940 106 HZ2 LYS 14 HZ2 LYS 14 37.806 25.502 40.488 107 HZ3 LYS 14 HZ3 LYS 14 39.334 25.057 40.129 108 H VAL 15 H VAL 15 34.142 23.631 34.155 109 HA VAL 15 HA VAL 15 33.900 25.734 32.068 110 HB VAL 15 HB VAL 15 35.269 23.060 31.744 111 HG11 VAL 15 HG11 VAL 15 34.378 23.973 29.639 112 HG12 VAL 15 HG12 VAL 15 35.180 25.523 29.958 113 HG13 VAL 15 HG13 VAL 15 36.138 24.060 29.670 114 HG21 VAL 15 HG21 VAL 15 37.328 24.634 31.579 115 HG22 VAL 15 HG22 VAL 15 36.344 25.797 32.474 116 HG23 VAL 15 HG23 VAL 15 36.714 24.219 33.191 117 H VAL 16 H VAL 16 32.286 25.604 30.621 118 HA VAL 16 HA VAL 16 30.774 23.063 30.385 119 HB VAL 16 HB VAL 16 29.465 25.744 30.892 120 HG11 VAL 16 HG11 VAL 16 28.188 23.068 30.163 121 HG12 VAL 16 HG12 VAL 16 27.321 24.511 30.728 122 HG13 VAL 16 HG13 VAL 16 28.157 24.550 29.180 123 HG21 VAL 16 HG21 VAL 16 28.426 24.399 32.796 124 HG22 VAL 16 HG22 VAL 16 29.543 23.091 32.407 125 HG23 VAL 16 HG23 VAL 16 30.162 24.663 32.962 126 H VAL 17 H VAL 17 30.096 22.524 28.354 127 HA VAL 17 HA VAL 17 30.670 24.453 26.136 128 HB VAL 17 HB VAL 17 31.658 21.587 26.433 129 HG11 VAL 17 HG11 VAL 17 30.927 21.860 24.110 130 HG12 VAL 17 HG12 VAL 17 31.804 23.403 23.979 131 HG13 VAL 17 HG13 VAL 17 32.683 21.869 24.192 132 HG21 VAL 17 HG21 VAL 17 33.094 23.204 27.533 133 HG22 VAL 17 HG22 VAL 17 33.868 22.668 26.040 134 HG23 VAL 17 HG23 VAL 17 33.073 24.256 26.104 135 H PHE 18 H PHE 18 29.355 24.375 24.338 136 HA PHE 18 HA PHE 18 27.123 22.358 24.357 137 HB2 PHE 18 HB2 PHE 18 26.979 25.247 23.444 138 HB3 PHE 18 HB3 PHE 18 25.705 24.051 23.304 139 HD1 PHE 18 HD1 PHE 18 27.592 26.185 25.658 140 HD2 PHE 18 HD2 PHE 18 24.474 23.261 25.252 141 HE1 PHE 18 HE1 PHE 18 26.812 26.714 27.946 142 HE2 PHE 18 HE2 PHE 18 23.737 23.721 27.581 143 HZ PHE 18 HZ PHE 18 24.842 25.499 28.918 144 H SER 19 H SER 19 27.199 21.015 22.725 145 HA SER 19 HA SER 19 28.641 21.703 20.190 146 HB2 SER 19 HB2 SER 19 29.150 19.348 22.054 147 HB3 SER 19 HB3 SER 19 29.790 19.494 20.417 148 HG SER 19 HG SER 19 31.313 20.246 21.776 149 H TRP 20 H TRP 20 28.613 19.870 18.618 150 HA TRP 20 HA TRP 20 26.081 18.295 18.647 151 HB2 TRP 20 HB2 TRP 20 27.293 19.882 16.394 152 HB3 TRP 20 HB3 TRP 20 26.497 18.356 16.051 153 HD1 TRP 20 HD1 TRP 20 24.788 20.325 18.733 154 HE1 TRP 20 HE1 TRP 20 22.557 21.248 17.833 155 HE3 TRP 20 HE3 TRP 20 25.391 19.237 13.776 156 HZ2 TRP 20 HZ2 TRP 20 21.217 21.485 15.307 157 HZ3 TRP 20 HZ3 TRP 20 23.593 19.755 12.154 158 HH2 TRP 20 HH2 TRP 20 21.520 20.908 12.889 159 H VAL 21 H VAL 21 26.208 16.252 18.062 160 HA VAL 21 HA VAL 21 28.850 14.976 17.613 161 HB VAL 21 HB VAL 21 27.534 12.812 17.735 162 HG11 VAL 21 HG11 VAL 21 27.765 14.541 20.239 163 HG12 VAL 21 HG12 VAL 21 27.700 12.765 20.183 164 HG13 VAL 21 HG13 VAL 21 29.082 13.617 19.489 165 HG21 VAL 21 HG21 VAL 21 25.499 12.765 19.025 166 HG22 VAL 21 HG22 VAL 21 25.499 14.525 19.229 167 HG23 VAL 21 HG23 VAL 21 25.233 13.807 17.625 168 H THR 22 H THR 22 28.124 14.225 14.158 169 HA THR 22 HA THR 22 30.218 14.346 16.306 170 HB THR 22 HB THR 22 30.456 12.900 13.692 171 HG1 THR 22 HG1 THR 22 29.646 11.738 16.146 172 HG21 THR 22 HG21 THR 22 31.884 12.631 16.354 173 HG22 THR 22 HG22 THR 22 32.538 13.255 14.822 174 HG23 THR 22 HG23 THR 22 32.109 11.542 14.966 175 H CYS 23 H CYS 23 31.638 16.072 15.986 176 HA CYS 23 HA CYS 23 31.455 17.456 13.364 177 HB2 CYS 23 HB2 CYS 23 30.800 18.661 16.063 178 HB3 CYS 23 HB3 CYS 23 30.908 19.558 14.532 179 HG CYS 23 HG CYS 23 29.053 18.229 13.236 180 HA PRO 24 HA PRO 24 35.607 17.810 13.406 181 HB2 PRO 24 HB2 PRO 24 35.501 20.509 12.078 182 HB3 PRO 24 HB3 PRO 24 36.304 19.006 11.529 183 HG2 PRO 24 HG2 PRO 24 33.962 19.784 10.421 184 HG3 PRO 24 HG3 PRO 24 34.214 18.057 10.851 185 HD2 PRO 24 HD2 PRO 24 32.789 20.204 12.458 186 HD3 PRO 24 HD3 PRO 24 32.229 18.580 11.998 187 H TYR 25 H TYR 25 34.285 20.748 14.963 188 HA TYR 25 HA TYR 25 36.943 21.343 16.143 189 HB2 TYR 25 HB2 TYR 25 34.266 22.734 16.389 190 HB3 TYR 25 HB3 TYR 25 35.743 23.235 17.194 191 HD1 TYR 25 HD1 TYR 25 37.916 23.191 15.463 192 HD2 TYR 25 HD2 TYR 25 33.809 24.070 14.450 193 HE1 TYR 25 HE1 TYR 25 38.670 24.377 13.436 194 HE2 TYR 25 HE2 TYR 25 34.578 25.271 12.417 195 HH TYR 25 HH TYR 25 38.088 25.460 11.563 196 H CYS 26 H CYS 26 33.806 20.070 17.133 197 HA CYS 26 HA CYS 26 34.246 20.201 19.912 198 HB2 CYS 26 HB2 CYS 26 32.133 19.776 18.789 199 HB3 CYS 26 HB3 CYS 26 32.630 18.120 18.383 200 HG CYS 26 HG CYS 26 33.082 17.291 20.865 201 H VAL 27 H VAL 27 35.260 17.623 17.669 202 HA VAL 27 HA VAL 27 36.435 15.758 19.369 203 HB VAL 27 HB VAL 27 36.270 15.650 17.083 204 HG11 VAL 27 HG11 VAL 27 37.372 16.416 15.350 205 HG12 VAL 27 HG12 VAL 27 36.829 17.764 16.347 206 HG13 VAL 27 HG13 VAL 27 38.561 17.264 16.355 207 HG21 VAL 27 HG21 VAL 27 39.194 15.288 17.881 208 HG22 VAL 27 HG22 VAL 27 37.894 14.125 18.236 209 HG23 VAL 27 HG23 VAL 27 38.383 14.421 16.559 210 H ARG 28 H ARG 28 37.922 18.207 17.817 211 HA ARG 28 HA ARG 28 40.480 18.416 19.061 212 HB2 ARG 28 HB2 ARG 28 39.039 20.941 18.128 213 HB3 ARG 28 HB3 ARG 28 40.757 20.712 18.389 214 HG2 ARG 28 HG2 ARG 28 40.458 18.802 16.561 215 HG3 ARG 28 HG3 ARG 28 38.999 19.709 16.174 216 HD2 ARG 28 HD2 ARG 28 40.755 20.456 14.707 217 HD3 ARG 28 HD3 ARG 28 40.371 21.758 15.832 218 HE ARG 28 HE ARG 28 42.774 19.942 15.948 219 HH11 ARG 28 HH12 ARG 28 41.615 23.228 16.460 220 HH12 ARG 28 HH11 ARG 28 42.945 23.567 17.550 221 HH21 ARG 28 HH22 ARG 28 44.362 20.487 17.357 222 HH22 ARG 28 HH21 ARG 28 44.332 22.062 18.137 223 H ALA 29 H ALA 29 37.603 20.260 20.071 224 HA ALA 29 HA ALA 29 38.831 21.461 22.357 225 HB1 ALA 29 HB1 ALA 29 36.823 22.353 21.254 226 HB2 ALA 29 HB2 ALA 29 35.886 20.934 21.779 227 HB3 ALA 29 HB3 ALA 29 36.537 22.068 22.985 228 H GLU 30 H GLU 30 36.644 18.542 22.250 229 HA GLU 30 HA GLU 30 36.715 18.002 25.061 230 HB2 GLU 30 HB2 GLU 30 36.441 16.142 22.652 231 HB3 GLU 30 HB3 GLU 30 36.180 15.636 24.321 232 HG2 GLU 30 HG2 GLU 30 34.302 17.174 24.567 233 HG3 GLU 30 HG3 GLU 30 34.529 17.793 22.930 234 H LYS 31 H LYS 31 39.042 17.143 22.586 235 HA LYS 31 HA LYS 31 40.570 15.382 24.294 236 HB2 LYS 31 HB2 LYS 31 40.810 15.087 21.945 237 HB3 LYS 31 HB3 LYS 31 40.944 16.809 21.647 238 HG2 LYS 31 HG2 LYS 31 43.266 16.764 22.694 239 HG3 LYS 31 HG3 LYS 31 43.103 15.012 22.817 240 HD2 LYS 31 HD2 LYS 31 44.282 15.418 20.773 241 HD3 LYS 31 HD3 LYS 31 42.632 15.003 20.313 242 HE2 LYS 31 HE2 LYS 31 42.945 16.876 18.994 243 HE3 LYS 31 HE3 LYS 31 42.250 17.640 20.421 244 HZ1 LYS 31 HZ1 LYS 31 44.125 18.891 19.946 245 HZ2 LYS 31 HZ2 LYS 31 44.652 17.949 21.173 246 HZ3 LYS 31 HZ3 LYS 31 45.082 17.587 19.623 247 H LEU 32 H LEU 32 40.999 18.755 23.309 248 HA LEU 32 HA LEU 32 43.343 19.368 24.782 249 HB2 LEU 32 HB2 LEU 32 42.026 20.578 22.880 250 HB3 LEU 32 HB3 LEU 32 41.064 21.239 24.193 251 HG LEU 32 HG LEU 32 42.716 22.774 23.295 252 HD11 LEU 32 HD11 LEU 32 43.732 23.618 25.294 253 HD12 LEU 32 HD12 LEU 32 42.114 23.009 25.687 254 HD13 LEU 32 HD13 LEU 32 43.558 22.060 26.114 255 HD21 LEU 32 HD21 LEU 32 44.914 20.955 24.341 256 HD22 LEU 32 HD22 LEU 32 44.410 21.059 22.643 257 HD23 LEU 32 HD23 LEU 32 45.079 22.484 23.444 258 H LEU 33 H LEU 33 39.893 19.796 25.654 259 HA LEU 33 HA LEU 33 40.341 21.104 28.125 260 HB2 LEU 33 HB2 LEU 33 38.024 19.396 27.074 261 HB3 LEU 33 HB3 LEU 33 37.901 20.294 28.573 262 HG LEU 33 HG LEU 33 38.478 21.559 25.880 263 HD11 LEU 33 HD11 LEU 33 36.310 22.313 25.653 264 HD12 LEU 33 HD12 LEU 33 36.194 20.581 25.986 265 HD13 LEU 33 HD13 LEU 33 35.851 21.779 27.270 266 HD21 LEU 33 HD21 LEU 33 37.820 23.684 27.000 267 HD22 LEU 33 HD22 LEU 33 37.738 22.800 28.535 268 HD23 LEU 33 HD23 LEU 33 39.292 22.982 27.674 269 H HIS 34 H HIS 34 39.888 17.594 27.535 270 HA HIS 34 HA HIS 34 40.441 16.926 30.310 271 HB2 HIS 34 HB2 HIS 34 40.191 15.405 27.711 272 HB3 HIS 34 HB3 HIS 34 40.783 14.616 29.181 273 HD1 HIS 34 HD1 HIS 34 39.047 14.759 31.369 274 HD2 HIS 34 HD2 HIS 34 37.529 15.664 27.547 275 HE1 HIS 34 HE1 HIS 34 36.500 14.607 31.532 276 H ALA 35 H ALA 35 42.572 17.412 27.433 277 HA ALA 35 HA ALA 35 44.902 16.222 28.665 278 HB1 ALA 35 HB1 ALA 35 44.642 18.309 26.452 279 HB2 ALA 35 HB2 ALA 35 46.115 17.422 26.860 280 HB3 ALA 35 HB3 ALA 35 44.712 16.549 26.236 281 H ARG 36 H ARG 36 43.446 19.365 28.909 282 HA ARG 36 HA ARG 36 45.681 20.553 30.497 283 HB2 ARG 36 HB2 ARG 36 43.427 21.577 28.777 284 HB3 ARG 36 HB3 ARG 36 44.020 22.594 30.042 285 HG2 ARG 36 HG2 ARG 36 45.048 23.132 27.938 286 HG3 ARG 36 HG3 ARG 36 46.225 22.702 29.185 287 HD2 ARG 36 HD2 ARG 36 46.640 20.563 28.156 288 HD3 ARG 36 HD3 ARG 36 45.329 20.809 26.983 289 HE ARG 36 HE ARG 36 46.913 23.022 26.582 290 HH11 ARG 36 HH12 ARG 36 48.029 19.718 26.786 291 HH12 ARG 36 HH11 ARG 36 49.230 19.985 25.558 292 HH21 ARG 36 HH22 ARG 36 48.380 23.287 25.142 293 HH22 ARG 36 HH21 ARG 36 49.371 21.955 24.532 294 H THR 37 H THR 37 43.245 18.756 31.400 295 HA THR 37 HA THR 37 42.211 18.358 33.355 296 HB THR 37 HB THR 37 43.487 20.532 34.891 297 HG1 THR 37 HG1 THR 37 44.842 18.295 33.739 298 HG21 THR 37 HG21 THR 37 43.272 17.503 35.336 299 HG22 THR 37 HG22 THR 37 42.190 18.730 36.018 300 HG23 THR 37 HG23 THR 37 43.883 18.685 36.514 301 H LYS 38 H LYS 38 40.889 20.208 31.589 302 HA LYS 38 HA LYS 38 39.636 22.260 33.312 303 HB2 LYS 38 HB2 LYS 38 39.132 21.297 30.509 304 HB3 LYS 38 HB3 LYS 38 37.951 22.231 31.400 305 HG2 LYS 38 HG2 LYS 38 39.296 23.695 29.972 306 HG3 LYS 38 HG3 LYS 38 39.455 24.112 31.652 307 HD2 LYS 38 HD2 LYS 38 41.632 22.354 30.592 308 HD3 LYS 38 HD3 LYS 38 41.513 23.970 29.880 309 HE2 LYS 38 HE2 LYS 38 41.352 24.919 32.229 310 HE3 LYS 38 HE3 LYS 38 41.765 23.299 32.824 311 HZ1 LYS 38 HZ1 LYS 38 43.939 23.539 32.089 312 HZ2 LYS 38 HZ2 LYS 38 43.627 24.670 30.949 313 HZ3 LYS 38 HZ3 LYS 38 43.605 25.062 32.521 314 H ASP 39 H ASP 39 38.601 21.533 34.995 315 HA ASP 39 HA ASP 39 36.783 19.396 35.106 316 HB2 ASP 39 HB2 ASP 39 37.344 20.636 37.136 317 HB3 ASP 39 HB3 ASP 39 36.761 22.129 36.456 318 H ILE 40 H ILE 40 35.541 19.017 33.448 319 HA ILE 40 HA ILE 40 34.029 21.205 32.151 320 HB ILE 40 HB ILE 40 36.112 20.398 31.099 321 HG12 ILE 40 HG12 ILE 40 33.651 21.028 29.814 322 HG13 ILE 40 HG13 ILE 40 35.298 21.408 29.384 323 HG21 ILE 40 HG21 ILE 40 36.264 18.258 29.982 324 HG22 ILE 40 HG22 ILE 40 35.924 18.008 31.682 325 HG23 ILE 40 HG23 ILE 40 34.623 17.814 30.509 326 HD11 ILE 40 HD11 ILE 40 34.086 20.264 27.550 327 HD12 ILE 40 HD12 ILE 40 35.524 19.361 28.058 328 HD13 ILE 40 HD13 ILE 40 33.891 18.827 28.555 329 H THR 41 H THR 41 32.020 20.961 31.371 330 HA THR 41 HA THR 41 30.781 18.257 31.182 331 HB THR 41 HB THR 41 29.829 20.562 32.813 332 HG1 THR 41 HG1 THR 41 29.681 19.007 34.126 333 HG21 THR 41 HG21 THR 41 28.008 20.668 31.249 334 HG22 THR 41 HG22 THR 41 27.457 19.782 32.673 335 HG23 THR 41 HG23 THR 41 27.870 18.896 31.187 336 H VAL 42 H VAL 42 30.158 17.930 29.090 337 HA VAL 42 HA VAL 42 29.309 20.304 27.539 338 HB VAL 42 HB VAL 42 31.011 19.665 26.342 339 HG11 VAL 42 HG11 VAL 42 31.837 17.489 25.786 340 HG12 VAL 42 HG12 VAL 42 31.897 17.935 27.483 341 HG13 VAL 42 HG13 VAL 42 30.641 16.777 26.914 342 HG21 VAL 42 HG21 VAL 42 29.120 19.669 24.813 343 HG22 VAL 42 HG22 VAL 42 30.405 18.581 24.280 344 HG23 VAL 42 HG23 VAL 42 28.944 17.909 25.033 345 H HIS 43 H HIS 43 27.505 20.476 26.487 346 HA HIS 43 HA HIS 43 25.397 18.397 26.879 347 HB2 HIS 43 HB2 HIS 43 25.112 20.649 27.985 348 HB3 HIS 43 HB3 HIS 43 25.115 21.375 26.400 349 HD1 HIS 43 HD1 HIS 43 23.032 18.323 27.761 350 HD2 HIS 43 HD2 HIS 43 22.648 22.138 26.023 351 HE1 HIS 43 HE1 HIS 43 20.564 18.675 27.344 352 H TYR 44 H TYR 44 24.744 17.366 25.088 353 HA TYR 44 HA TYR 44 25.717 18.330 22.469 354 HB2 TYR 44 HB2 TYR 44 24.621 15.644 23.294 355 HB3 TYR 44 HB3 TYR 44 25.218 16.067 21.686 356 HD1 TYR 44 HD1 TYR 44 27.646 16.953 21.476 357 HD2 TYR 44 HD2 TYR 44 26.141 14.903 24.966 358 HE1 TYR 44 HE1 TYR 44 29.972 16.428 22.148 359 HE2 TYR 44 HE2 TYR 44 28.469 14.350 25.632 360 HH TYR 44 HH TYR 44 31.346 15.204 23.739 361 H VAL 45 H VAL 45 24.289 19.995 22.037 362 HA VAL 45 HA VAL 45 21.425 19.635 22.085 363 HB VAL 45 HB VAL 45 21.245 21.873 21.152 364 HG11 VAL 45 HG11 VAL 45 21.557 21.566 23.587 365 HG12 VAL 45 HG12 VAL 45 23.317 21.733 23.382 366 HG13 VAL 45 HG13 VAL 45 22.234 23.090 23.014 367 HG21 VAL 45 HG21 VAL 45 23.227 23.288 20.804 368 HG22 VAL 45 HG22 VAL 45 24.291 21.879 21.003 369 HG23 VAL 45 HG23 VAL 45 23.158 21.979 19.635 370 H ASP 46 H ASP 46 23.332 18.119 20.045 371 HA ASP 46 HA ASP 46 21.593 18.148 17.647 372 HB2 ASP 46 HB2 ASP 46 24.012 17.627 17.439 373 HB3 ASP 46 HB3 ASP 46 23.831 16.279 18.546 374 H LYS 47 H LYS 47 21.919 16.349 20.716 375 HA LYS 47 HA LYS 47 20.737 13.922 19.693 376 HB2 LYS 47 HB2 LYS 47 21.482 14.681 22.510 377 HB3 LYS 47 HB3 LYS 47 20.921 13.094 21.965 378 HG2 LYS 47 HG2 LYS 47 22.863 13.482 20.106 379 HG3 LYS 47 HG3 LYS 47 23.530 14.462 21.404 380 HD2 LYS 47 HD2 LYS 47 22.742 11.530 21.504 381 HD3 LYS 47 HD3 LYS 47 24.393 12.176 21.436 382 HE2 LYS 47 HE2 LYS 47 23.710 13.448 23.627 383 HE3 LYS 47 HE3 LYS 47 22.416 12.255 23.747 384 HZ1 LYS 47 HZ1 LYS 47 24.129 10.494 23.738 385 HZ2 LYS 47 HZ2 LYS 47 25.324 11.620 23.609 386 HZ3 LYS 47 HZ3 LYS 47 24.412 11.556 24.959 387 H MET 48 H MET 48 19.132 16.717 20.711 388 HA MET 48 HA MET 48 16.563 15.304 20.786 389 HB2 MET 48 HB2 MET 48 15.853 16.032 22.884 390 HB3 MET 48 HB3 MET 48 17.461 15.402 23.166 391 HG2 MET 48 HG2 MET 48 16.649 18.328 22.994 392 HG3 MET 48 HG3 MET 48 17.075 17.428 24.439 393 HE1 MET 48 HE1 MET 48 18.713 19.260 25.282 394 HE2 MET 48 HE2 MET 48 19.916 20.048 24.243 395 HE3 MET 48 HE3 MET 48 18.182 20.226 23.887 396 H SER 49 H SER 49 14.723 16.667 20.456 397 HA SER 49 HA SER 49 15.091 18.545 18.385 398 HB2 SER 49 HB2 SER 49 12.641 18.171 20.140 399 HB3 SER 49 HB3 SER 49 12.675 18.800 18.482 400 HG SER 49 HG SER 49 12.124 16.493 18.888 401 H GLU 50 H GLU 50 14.558 19.132 21.862 402 HA GLU 50 HA GLU 50 13.949 21.899 21.635 403 HB2 GLU 50 HB2 GLU 50 13.756 20.198 23.643 404 HB3 GLU 50 HB3 GLU 50 15.360 20.812 24.083 405 HG2 GLU 50 HG2 GLU 50 14.448 23.096 24.237 406 HG3 GLU 50 HG3 GLU 50 12.893 22.552 23.607 407 H GLY 51 H GLY 51 16.998 20.425 21.161 408 HA2 GLY 51 HA2 GLY 51 18.894 22.103 22.228 409 HA3 GLY 51 HA3 GLY 51 19.033 21.321 20.657 410 H GLU 52 H GLU 52 16.848 22.945 19.431 411 HA GLU 52 HA GLU 52 18.438 25.214 18.463 412 HB2 GLU 52 HB2 GLU 52 15.440 24.586 18.271 413 HB3 GLU 52 HB3 GLU 52 16.285 25.821 17.342 414 HG2 GLU 52 HG2 GLU 52 17.675 24.030 16.280 415 HG3 GLU 52 HG3 GLU 52 16.744 22.812 17.166 416 H GLN 53 H GLN 53 15.900 24.845 20.966 417 HA GLN 53 HA GLN 53 15.557 27.738 21.321 418 HB2 GLN 53 HB2 GLN 53 14.608 25.412 23.047 419 HB3 GLN 53 HB3 GLN 53 14.179 27.118 23.248 420 HG2 GLN 53 HG2 GLN 53 13.325 27.060 20.824 421 HG3 GLN 53 HG3 GLN 53 13.467 25.303 20.903 422 HE21 GLN 53 HE21 GLN 53 11.194 27.652 21.063 423 HE22 GLN 53 HE22 GLN 53 10.091 26.910 22.199 424 H LEU 54 H LEU 54 17.501 25.139 22.779 425 HA LEU 54 HA LEU 54 18.762 26.887 24.727 426 HB2 LEU 54 HB2 LEU 54 19.704 24.212 23.648 427 HB3 LEU 54 HB3 LEU 54 20.407 25.086 24.975 428 HG LEU 54 HG LEU 54 19.188 23.444 26.046 429 HD11 LEU 54 HD11 LEU 54 17.107 24.312 27.072 430 HD12 LEU 54 HD12 LEU 54 18.389 25.471 27.202 431 HD13 LEU 54 HD13 LEU 54 17.128 25.695 25.967 432 HD21 LEU 54 HD21 LEU 54 16.758 23.887 24.343 433 HD22 LEU 54 HD22 LEU 54 18.008 22.649 24.045 434 HD23 LEU 54 HD23 LEU 54 17.052 22.600 25.524 435 H ARG 55 H ARG 55 19.564 26.037 21.291 436 HA ARG 55 HA ARG 55 21.952 27.657 21.161 437 HB2 ARG 55 HB2 ARG 55 19.876 27.288 18.946 438 HB3 ARG 55 HB3 ARG 55 21.490 27.949 18.765 439 HG2 ARG 55 HG2 ARG 55 22.399 25.719 19.593 440 HG3 ARG 55 HG3 ARG 55 20.773 25.074 19.417 441 HD2 ARG 55 HD2 ARG 55 22.460 26.246 17.232 442 HD3 ARG 55 HD3 ARG 55 22.155 24.533 17.485 443 HE ARG 55 HE ARG 55 19.762 26.201 16.997 444 HH11 ARG 55 HH22 ARG 55 22.398 24.693 15.160 445 HH12 ARG 55 HH21 ARG 55 21.315 24.493 13.798 446 HH21 ARG 55 HH12 ARG 55 18.671 26.033 15.122 447 HH22 ARG 55 HH11 ARG 55 19.403 25.201 13.750 448 H GLY 56 H GLY 56 18.529 28.582 20.865 449 HA2 GLY 56 HA2 GLY 56 18.854 31.378 20.498 450 HA3 GLY 56 HA3 GLY 56 17.473 30.587 21.269 451 H GLU 57 H GLU 57 18.934 29.490 23.578 452 HA GLU 57 HA GLU 57 19.013 31.731 25.361 453 HB2 GLU 57 HB2 GLU 57 20.216 28.971 25.668 454 HB3 GLU 57 HB3 GLU 57 20.254 30.203 26.906 455 HG2 GLU 57 HG2 GLU 57 17.750 28.933 25.741 456 HG3 GLU 57 HG3 GLU 57 18.480 28.666 27.314 457 H ILE 58 H ILE 58 21.641 30.078 23.578 458 HA ILE 58 HA ILE 58 23.785 31.683 24.695 459 HB ILE 58 HB ILE 58 23.784 30.316 21.970 460 HG12 ILE 58 HG12 ILE 58 24.679 29.038 24.587 461 HG13 ILE 58 HG13 ILE 58 23.151 28.676 23.773 462 HG21 ILE 58 HG21 ILE 58 25.653 31.935 22.491 463 HG22 ILE 58 HG22 ILE 58 26.086 30.931 23.883 464 HG23 ILE 58 HG23 ILE 58 26.208 30.293 22.228 465 HD11 ILE 58 HD11 ILE 58 25.912 28.105 22.670 466 HD12 ILE 58 HD12 ILE 58 24.697 26.946 23.226 467 HD13 ILE 58 HD13 ILE 58 24.395 27.906 21.763 468 H TYR 59 H TYR 59 21.882 31.852 21.628 469 HA TYR 59 HA TYR 59 23.357 34.040 20.629 470 HB2 TYR 59 HB2 TYR 59 21.745 32.364 19.445 471 HB3 TYR 59 HB3 TYR 59 20.543 33.628 19.710 472 HD1 TYR 59 HD1 TYR 59 21.188 36.038 18.931 473 HD2 TYR 59 HD2 TYR 59 23.364 32.510 17.697 474 HE1 TYR 59 HE1 TYR 59 22.229 37.329 17.066 475 HE2 TYR 59 HE2 TYR 59 24.351 33.802 15.817 476 HH TYR 59 HH TYR 59 23.728 37.263 15.306 477 H GLN 60 H GLN 60 20.269 34.160 22.561 478 HA GLN 60 HA GLN 60 20.030 37.020 22.294 479 HB2 GLN 60 HB2 GLN 60 18.979 35.023 24.333 480 HB3 GLN 60 HB3 GLN 60 18.619 36.744 24.450 481 HG2 GLN 60 HG2 GLN 60 17.950 35.054 21.999 482 HG3 GLN 60 HG3 GLN 60 16.845 35.359 23.334 483 HE21 GLN 60 HE21 GLN 60 15.618 36.173 21.252 484 HE22 GLN 60 HE22 GLN 60 15.831 37.892 20.918 485 H ALA 61 H ALA 61 21.911 35.068 24.608 486 HA ALA 61 HA ALA 61 22.534 37.387 26.278 487 HB1 ALA 61 HB1 ALA 61 22.169 35.208 27.276 488 HB2 ALA 61 HB2 ALA 61 23.467 34.495 26.299 489 HB3 ALA 61 HB3 ALA 61 23.851 35.702 27.549 490 H TYR 62 H TYR 62 24.262 35.566 23.750 491 HA TYR 62 HA TYR 62 26.630 37.359 24.090 492 HB2 TYR 62 HB2 TYR 62 26.581 34.499 23.095 493 HB3 TYR 62 HB3 TYR 62 28.008 35.490 23.407 494 HD1 TYR 62 HD2 TYR 62 28.325 36.434 25.810 495 HD2 TYR 62 HD1 TYR 62 25.613 33.226 24.857 496 HE1 TYR 62 HE2 TYR 62 28.109 35.895 28.227 497 HE2 TYR 62 HE1 TYR 62 25.366 32.708 27.281 498 HH TYR 62 HH TYR 62 27.174 34.528 29.773 499 H LYS 63 H LYS 63 24.160 36.873 21.910 500 HA LYS 63 HA LYS 63 23.779 37.204 19.733 501 HB2 LYS 63 HB2 LYS 63 25.800 39.416 20.156 502 HB3 LYS 63 HB3 LYS 63 24.742 39.296 18.752 503 HG2 LYS 63 HG2 LYS 63 23.759 39.528 21.635 504 HG3 LYS 63 HG3 LYS 63 23.890 40.847 20.487 505 HD2 LYS 63 HD2 LYS 63 22.291 39.520 18.951 506 HD3 LYS 63 HD3 LYS 63 22.051 38.424 20.310 507 HE2 LYS 63 HE2 LYS 63 20.253 39.880 20.512 508 HE3 LYS 63 HE3 LYS 63 21.422 40.471 21.705 509 HZ1 LYS 63 HZ1 LYS 63 20.747 41.638 19.066 510 HZ2 LYS 63 HZ2 LYS 63 20.746 42.387 20.527 511 HZ3 LYS 63 HZ3 LYS 63 22.159 42.012 19.791 512 H HIS 64 H HIS 64 25.443 35.097 20.167 513 HA HIS 64 HA HIS 64 26.191 34.493 17.441 514 HB2 HIS 64 HB2 HIS 64 28.263 35.715 18.445 515 HB3 HIS 64 HB3 HIS 64 28.347 34.430 19.645 516 HD1 HIS 64 HD1 HIS 64 29.096 31.964 18.662 517 HD2 HIS 64 HD2 HIS 64 29.109 35.221 15.982 518 HE1 HIS 64 HE1 HIS 64 30.292 31.157 16.529 519 H GLU 65 H GLU 65 26.536 32.398 17.019 520 HA GLU 65 HA GLU 65 24.729 30.882 18.739 521 HB2 GLU 65 HB2 GLU 65 24.482 31.580 16.220 522 HB3 GLU 65 HB3 GLU 65 25.548 30.321 15.893 523 HG2 GLU 65 HG2 GLU 65 23.690 29.115 17.597 524 HG3 GLU 65 HG3 GLU 65 22.768 30.345 16.723 525 H THR 66 H THR 66 27.131 29.381 16.530 526 HA THR 66 HA THR 66 28.160 27.664 18.781 527 HB THR 66 HB THR 66 27.935 25.733 17.279 528 HG1 THR 66 HG1 THR 66 26.051 27.214 15.790 529 HG21 THR 66 HG21 THR 66 25.555 25.351 17.657 530 HG22 THR 66 HG22 THR 66 25.262 27.084 17.871 531 HG23 THR 66 HG23 THR 66 26.246 26.191 19.050 532 H VAL 67 H VAL 67 30.086 26.687 18.464 533 HA VAL 67 HA VAL 67 31.833 27.412 16.252 534 HB VAL 67 HB VAL 67 33.330 28.240 18.559 535 HG11 VAL 67 HG11 VAL 67 33.633 30.271 17.217 536 HG12 VAL 67 HG12 VAL 67 33.774 28.816 16.224 537 HG13 VAL 67 HG13 VAL 67 32.290 29.787 16.158 538 HG21 VAL 67 HG21 VAL 67 30.820 29.932 18.247 539 HG22 VAL 67 HG22 VAL 67 31.244 28.981 19.675 540 HG23 VAL 67 HG23 VAL 67 32.261 30.334 19.181 541 HA PRO 68 HA PRO 68 30.204 25.235 19.165 542 HB2 PRO 68 HB2 PRO 68 31.002 23.804 21.353 543 HB3 PRO 68 HB3 PRO 68 30.698 23.044 19.760 544 HG2 PRO 68 HG2 PRO 68 33.354 23.949 20.926 545 HG3 PRO 68 HG3 PRO 68 32.931 22.337 20.250 546 HD2 PRO 68 HD2 PRO 68 34.152 24.167 18.717 547 HD3 PRO 68 HD3 PRO 68 32.809 23.196 18.043 548 H ALA 69 H ALA 69 29.542 25.816 21.452 549 HA ALA 69 HA ALA 69 30.874 28.395 22.113 550 HB1 ALA 69 HB1 ALA 69 28.465 28.439 21.607 551 HB2 ALA 69 HB2 ALA 69 28.162 27.255 22.899 552 HB3 ALA 69 HB3 ALA 69 28.760 28.875 23.302 553 H ILE 70 H ILE 70 31.890 28.787 24.021 554 HA ILE 70 HA ILE 70 32.223 26.507 25.927 555 HB ILE 70 HB ILE 70 34.309 28.319 24.663 556 HG12 ILE 70 HG12 ILE 70 34.333 25.307 24.372 557 HG13 ILE 70 HG13 ILE 70 33.315 26.250 23.300 558 HG21 ILE 70 HG21 ILE 70 35.984 26.884 25.856 559 HG22 ILE 70 HG22 ILE 70 34.982 27.821 26.954 560 HG23 ILE 70 HG23 ILE 70 34.650 26.091 26.720 561 HD11 ILE 70 HD11 ILE 70 35.208 27.567 22.508 562 HD12 ILE 70 HD12 ILE 70 36.300 26.681 23.591 563 HD13 ILE 70 HD13 ILE 70 35.482 25.830 22.268 564 H PHE 71 H PHE 71 32.305 27.021 28.064 565 HA PHE 71 HA PHE 71 32.320 29.896 28.859 566 HB2 PHE 71 HB2 PHE 71 30.476 27.674 29.806 567 HB3 PHE 71 HB3 PHE 71 30.583 29.277 30.525 568 HD1 PHE 71 HD2 PHE 71 29.513 27.393 27.495 569 HD2 PHE 71 HD1 PHE 71 29.650 31.229 29.463 570 HE1 PHE 71 HE2 PHE 71 27.925 28.329 25.811 571 HE2 PHE 71 HE1 PHE 71 28.070 32.127 27.802 572 HZ PHE 71 HZ PHE 71 27.184 30.681 25.981 573 H ILE 72 H ILE 72 33.407 30.418 30.713 574 HA ILE 72 HA ILE 72 34.302 28.257 32.551 575 HB ILE 72 HB ILE 72 36.112 30.470 31.507 576 HG12 ILE 72 HG12 ILE 72 35.994 27.451 31.058 577 HG13 ILE 72 HG13 ILE 72 35.920 28.715 29.851 578 HG21 ILE 72 HG21 ILE 72 37.841 29.377 32.962 579 HG22 ILE 72 HG22 ILE 72 36.520 29.988 33.922 580 HG23 ILE 72 HG23 ILE 72 36.612 28.249 33.573 581 HD11 ILE 72 HD11 ILE 72 38.380 27.804 31.397 582 HD12 ILE 72 HD12 ILE 72 38.035 27.645 29.669 583 HD13 ILE 72 HD13 ILE 72 38.337 29.254 30.353 584 H ASN 73 H ASN 73 33.720 28.717 34.595 585 HA ASN 73 HA ASN 73 32.721 29.799 36.328 586 HB2 ASN 73 HB2 ASN 73 34.781 31.945 35.680 587 HB3 ASN 73 HB3 ASN 73 33.890 31.808 37.189 588 HD21 ASN 73 HD21 ASN 73 36.725 31.856 36.942 589 HD22 ASN 73 HD22 ASN 73 37.254 30.349 37.681 590 H GLY 74 H GLY 74 31.173 30.005 34.077 591 HA2 GLY 74 HA2 GLY 74 29.228 31.115 33.410 592 HA3 GLY 74 HA3 GLY 74 29.582 32.416 34.509 593 H ASN 75 H ASN 75 32.380 32.351 32.761 594 HA ASN 75 HA ASN 75 31.431 34.568 31.044 595 HB2 ASN 75 HB2 ASN 75 34.153 33.635 31.984 596 HB3 ASN 75 HB3 ASN 75 33.970 34.903 30.830 597 HD21 ASN 75 HD21 ASN 75 34.930 34.816 33.750 598 HD22 ASN 75 HD22 ASN 75 34.014 36.141 34.478 599 H PHE 76 H PHE 76 31.432 34.598 28.883 600 HA PHE 76 HA PHE 76 31.626 32.081 27.454 601 HB2 PHE 76 HB2 PHE 76 29.789 33.534 27.030 602 HB3 PHE 76 HB3 PHE 76 30.833 34.898 26.692 603 HD1 PHE 76 HD1 PHE 76 30.097 31.426 25.406 604 HD2 PHE 76 HD2 PHE 76 31.336 35.450 24.470 605 HE1 PHE 76 HE1 PHE 76 30.035 30.893 22.981 606 HE2 PHE 76 HE2 PHE 76 31.291 34.900 22.051 607 HZ PHE 76 HZ PHE 76 30.624 32.623 21.304 608 H ILE 77 H ILE 77 32.909 31.398 25.947 609 HA ILE 77 HA ILE 77 35.091 32.992 24.718 610 HB ILE 77 HB ILE 77 35.241 30.142 25.778 611 HG12 ILE 77 HG12 ILE 77 37.072 32.431 26.573 612 HG13 ILE 77 HG13 ILE 77 35.591 32.085 27.461 613 HG21 ILE 77 HG21 ILE 77 37.319 31.717 24.181 614 HG22 ILE 77 HG22 ILE 77 37.596 30.133 24.922 615 HG23 ILE 77 HG23 ILE 77 36.432 30.281 23.623 616 HD11 ILE 77 HD11 ILE 77 37.889 30.127 27.131 617 HD12 ILE 77 HD12 ILE 77 37.427 31.021 28.590 618 HD13 ILE 77 HD13 ILE 77 36.337 29.790 27.917 619 H GLY 78 H GLY 78 35.107 32.709 22.459 620 HA2 GLY 78 HA2 GLY 78 33.612 30.323 21.388 621 HA3 GLY 78 HA3 GLY 78 33.273 31.920 20.751 622 H GLY 79 H GLY 79 34.942 29.175 20.312 623 HA2 GLY 79 HA2 GLY 79 35.816 28.983 17.933 624 HA3 GLY 79 HA3 GLY 79 36.921 30.283 18.383 625 H CYS 80 H CYS 80 37.152 27.172 17.747 626 HA CYS 80 HA CYS 80 38.305 26.056 20.158 627 HB2 CYS 80 HB2 CYS 80 37.347 24.736 18.225 628 HB3 CYS 80 HB3 CYS 80 38.804 25.145 17.300 629 HG CYS 80 HG CYS 80 40.483 24.299 19.225 630 H SER 81 H SER 81 39.763 27.713 17.307 631 HA SER 81 HA SER 81 42.449 27.620 18.333 632 HB2 SER 81 HB2 SER 81 41.921 28.114 15.987 633 HB3 SER 81 HB3 SER 81 41.194 29.654 16.465 634 HG SER 81 HG SER 81 43.202 30.147 15.916 635 H ASP 82 H ASP 82 39.743 29.866 18.928 636 HA ASP 82 HA ASP 82 41.125 31.818 20.462 637 HB2 ASP 82 HB2 ASP 82 38.581 31.465 19.568 638 HB3 ASP 82 HB3 ASP 82 38.314 31.034 21.236 639 H LEU 83 H LEU 83 39.534 28.789 21.539 640 HA LEU 83 HA LEU 83 40.284 28.921 24.297 641 HB2 LEU 83 HB2 LEU 83 38.477 27.515 23.490 642 HB3 LEU 83 HB3 LEU 83 39.564 26.642 22.416 643 HG LEU 83 HG LEU 83 40.777 25.726 24.391 644 HD11 LEU 83 HD11 LEU 83 38.495 27.006 25.964 645 HD12 LEU 83 HD12 LEU 83 39.647 25.815 26.610 646 HD13 LEU 83 HD13 LEU 83 40.221 27.407 26.095 647 HD21 LEU 83 HD21 LEU 83 39.128 24.063 24.952 648 HD22 LEU 83 HD22 LEU 83 37.802 25.120 24.418 649 HD23 LEU 83 HD23 LEU 83 38.969 24.476 23.241 650 H GLU 84 H GLU 84 41.899 27.246 21.536 651 HA GLU 84 HA GLU 84 44.156 26.335 23.097 652 HB2 GLU 84 HB2 GLU 84 43.879 26.789 20.106 653 HB3 GLU 84 HB3 GLU 84 45.259 26.017 20.912 654 HG2 GLU 84 HG2 GLU 84 43.787 24.283 21.843 655 HG3 GLU 84 HG3 GLU 84 42.428 24.928 20.925 656 H ALA 85 H ALA 85 43.473 29.487 21.597 657 HA ALA 85 HA ALA 85 46.185 30.468 21.929 658 HB1 ALA 85 HB1 ALA 85 44.650 31.529 20.342 659 HB2 ALA 85 HB2 ALA 85 43.527 31.949 21.648 660 HB3 ALA 85 HB3 ALA 85 45.138 32.691 21.586 661 H LEU 86 H LEU 86 43.213 30.578 24.024 662 HA LEU 86 HA LEU 86 44.408 32.047 26.171 663 HB2 LEU 86 HB2 LEU 86 42.230 29.915 26.139 664 HB3 LEU 86 HB3 LEU 86 42.662 30.826 27.576 665 HG LEU 86 HG LEU 86 41.695 32.150 25.006 666 HD11 LEU 86 HD11 LEU 86 39.956 30.668 25.924 667 HD12 LEU 86 HD12 LEU 86 40.131 31.441 27.522 668 HD13 LEU 86 HD13 LEU 86 39.533 32.372 26.132 669 HD21 LEU 86 HD21 LEU 86 42.932 33.678 26.467 670 HD22 LEU 86 HD22 LEU 86 41.204 34.031 26.522 671 HD23 LEU 86 HD23 LEU 86 41.956 33.162 27.872 672 H ASP 87 H ASP 87 44.510 28.579 25.440 673 HA ASP 87 HA ASP 87 45.908 27.683 27.760 674 HB2 ASP 87 HB2 ASP 87 44.781 26.224 26.102 675 HB3 ASP 87 HB3 ASP 87 46.000 26.647 24.907 676 H LYS 88 H LYS 88 47.254 28.655 24.560 677 HA LYS 88 HA LYS 88 50.031 28.548 25.370 678 HB2 LYS 88 HB2 LYS 88 48.483 29.657 23.028 679 HB3 LYS 88 HB3 LYS 88 50.128 30.215 23.274 680 HG2 LYS 88 HG2 LYS 88 50.011 28.360 21.697 681 HG3 LYS 88 HG3 LYS 88 51.049 28.021 23.076 682 HD2 LYS 88 HD2 LYS 88 49.568 26.407 23.976 683 HD3 LYS 88 HD3 LYS 88 48.200 27.041 23.077 684 HE2 LYS 88 HE2 LYS 88 48.742 25.012 22.028 685 HE3 LYS 88 HE3 LYS 88 49.231 26.304 20.941 686 HZ1 LYS 88 HZ1 LYS 88 50.851 24.440 21.202 687 HZ2 LYS 88 HZ2 LYS 88 51.535 25.898 21.542 688 HZ3 LYS 88 HZ3 LYS 88 51.120 24.865 22.750 689 H GLU 89 H GLU 89 47.668 31.178 25.451 690 HA GLU 89 HA GLU 89 49.548 33.208 26.327 691 HB2 GLU 89 HB2 GLU 89 46.512 33.092 26.223 692 HB3 GLU 89 HB3 GLU 89 47.433 34.530 26.677 693 HG2 GLU 89 HG2 GLU 89 48.486 34.712 24.564 694 HG3 GLU 89 HG3 GLU 89 47.888 33.169 24.004 695 H GLY 90 H GLY 90 48.691 30.586 28.042 696 HA2 GLY 90 HA2 GLY 90 49.144 30.055 30.224 697 HA3 GLY 90 HA3 GLY 90 49.715 31.705 30.465 698 H LYS 91 H LYS 91 46.426 31.619 29.400 699 HA LYS 91 HA LYS 91 45.602 32.697 32.048 700 HB2 LYS 91 HB2 LYS 91 44.641 32.844 29.176 701 HB3 LYS 91 HB3 LYS 91 43.541 33.221 30.486 702 HG2 LYS 91 HG2 LYS 91 44.978 34.972 31.339 703 HG3 LYS 91 HG3 LYS 91 46.247 34.584 30.173 704 HD2 LYS 91 HD2 LYS 91 43.458 35.529 29.364 705 HD3 LYS 91 HD3 LYS 91 44.824 36.619 29.644 706 HE2 LYS 91 HE2 LYS 91 46.150 35.447 27.925 707 HE3 LYS 91 HE3 LYS 91 44.792 34.359 27.596 708 HZ1 LYS 91 HZ1 LYS 91 43.499 36.358 26.947 709 HZ2 LYS 91 HZ2 LYS 91 44.807 37.299 27.169 710 HZ3 LYS 91 HZ3 LYS 91 44.819 36.129 25.996 711 H LEU 92 H LEU 92 45.180 29.831 30.149 712 HA LEU 92 HA LEU 92 42.631 29.066 31.410 713 HB2 LEU 92 HB2 LEU 92 43.351 28.854 28.932 714 HB3 LEU 92 HB3 LEU 92 44.465 27.613 29.453 715 HG LEU 92 HG LEU 92 42.519 26.246 30.252 716 HD11 LEU 92 HD11 LEU 92 40.266 26.832 29.427 717 HD12 LEU 92 HD12 LEU 92 40.851 28.008 30.612 718 HD13 LEU 92 HD13 LEU 92 40.877 28.408 28.879 719 HD21 LEU 92 HD21 LEU 92 42.462 27.110 27.334 720 HD22 LEU 92 HD22 LEU 92 43.494 25.855 28.044 721 HD23 LEU 92 HD23 LEU 92 41.743 25.619 27.981 722 H ASP 93 H ASP 93 45.988 28.300 31.788 723 HA ASP 93 HA ASP 93 45.621 26.114 33.692 724 HB2 ASP 93 HB2 ASP 93 47.900 27.976 32.951 725 HB3 ASP 93 HB3 ASP 93 48.004 26.837 34.290 726 H GLY 94 H GLY 94 46.151 29.654 34.075 727 HA2 GLY 94 HA2 GLY 94 45.858 29.669 36.926 728 HA3 GLY 94 HA3 GLY 94 45.699 31.057 35.847 729 H LEU 95 H LEU 95 43.433 29.944 34.304 730 HA LEU 95 HA LEU 95 41.222 30.686 35.946 731 HB2 LEU 95 HB2 LEU 95 41.538 29.428 33.233 732 HB3 LEU 95 HB3 LEU 95 39.955 29.407 33.976 733 HG LEU 95 HG LEU 95 41.523 31.993 33.657 734 HD11 LEU 95 HD11 LEU 95 41.104 30.976 31.426 735 HD12 LEU 95 HD12 LEU 95 39.373 30.844 31.821 736 HD13 LEU 95 HD13 LEU 95 40.143 32.435 31.682 737 HD21 LEU 95 HD21 LEU 95 38.556 31.450 34.107 738 HD22 LEU 95 HD22 LEU 95 39.689 32.078 35.317 739 HD23 LEU 95 HD23 LEU 95 39.311 33.039 33.889 740 H LEU 96 H LEU 96 42.739 27.556 35.551 741 HA LEU 96 HA LEU 96 40.676 26.094 36.973 742 HB2 LEU 96 HB2 LEU 96 43.643 25.550 36.674 743 HB3 LEU 96 HB3 LEU 96 42.550 24.408 37.446 744 HG LEU 96 HG LEU 96 42.329 25.289 34.565 745 HD11 LEU 96 HD11 LEU 96 44.272 23.826 35.081 746 HD12 LEU 96 HD12 LEU 96 43.236 22.739 36.020 747 HD13 LEU 96 HD13 LEU 96 43.028 22.850 34.282 748 HD21 LEU 96 HD21 LEU 96 40.725 23.335 34.558 749 HD22 LEU 96 HD22 LEU 96 40.706 23.394 36.314 750 HD23 LEU 96 HD23 LEU 96 40.108 24.778 35.359 751 H SER 97 H SER 97 42.193 28.700 38.262 752 HA SER 97 HA SER 97 42.710 28.037 40.991 753 HB2 SER 97 HB2 SER 97 41.323 30.509 39.870 754 HB3 SER 97 HB3 SER 97 41.946 30.344 41.515 755 HG SER 97 HG SER 97 43.442 30.215 39.084 Start of MODEL 11 1 H1 GLY 1 H1 GLY 1 11.852 33.944 24.450 2 H2 GLY 1 H2 GLY 1 10.552 33.200 25.158 3 H3 GLY 1 H3 GLY 1 11.540 32.354 24.143 4 HA2 GLY 1 HA2 GLY 1 12.013 31.743 26.395 5 HA3 GLY 1 HA3 GLY 1 13.390 32.617 25.685 6 H ALA 2 H ALA 2 11.253 32.495 28.305 7 HA ALA 2 HA ALA 2 11.589 35.383 29.002 8 HB1 ALA 2 HB1 ALA 2 9.741 34.964 30.548 9 HB2 ALA 2 HB2 ALA 2 9.292 34.492 28.900 10 HB3 ALA 2 HB3 ALA 2 9.715 33.246 30.098 11 H MET 3 H MET 3 12.478 32.139 29.992 12 HA MET 3 HA MET 3 14.091 33.222 32.265 13 HB2 MET 3 HB2 MET 3 13.090 30.400 31.744 14 HB3 MET 3 HB3 MET 3 14.142 30.864 33.076 15 HG2 MET 3 HG2 MET 3 11.330 31.929 32.642 16 HG3 MET 3 HG3 MET 3 11.783 30.643 33.757 17 HE1 MET 3 HE1 MET 3 10.451 31.963 35.631 18 HE2 MET 3 HE2 MET 3 10.801 33.640 36.106 19 HE3 MET 3 HE3 MET 3 10.104 33.296 34.507 20 HA PRO 4 HA PRO 4 17.598 32.424 29.790 21 HB2 PRO 4 HB2 PRO 4 19.656 32.540 31.533 22 HB3 PRO 4 HB3 PRO 4 18.530 33.905 31.312 23 HG2 PRO 4 HG2 PRO 4 18.396 31.735 33.435 24 HG3 PRO 4 HG3 PRO 4 18.393 33.513 33.686 25 HD2 PRO 4 HD2 PRO 4 16.072 32.091 33.561 26 HD3 PRO 4 HD3 PRO 4 16.201 33.725 32.845 27 H SER 5 H SER 5 16.427 29.794 31.357 28 HA SER 5 HA SER 5 16.748 27.546 31.139 29 HB2 SER 5 HB2 SER 5 17.944 28.394 28.501 30 HB3 SER 5 HB3 SER 5 17.169 26.872 28.806 31 HG SER 5 HG SER 5 16.106 29.113 27.946 32 H ILE 6 H ILE 6 19.567 27.911 29.162 33 HA ILE 6 HA ILE 6 20.925 25.840 30.516 34 HB ILE 6 HB ILE 6 22.623 26.022 28.921 35 HG12 ILE 6 HG12 ILE 6 21.606 28.799 28.299 36 HG13 ILE 6 HG13 ILE 6 23.228 28.323 28.785 37 HG21 ILE 6 HG21 ILE 6 20.322 25.194 28.356 38 HG22 ILE 6 HG22 ILE 6 20.114 26.719 27.442 39 HG23 ILE 6 HG23 ILE 6 21.419 25.580 27.025 40 HD11 ILE 6 HD11 ILE 6 21.887 27.731 26.119 41 HD12 ILE 6 HD12 ILE 6 23.212 28.873 26.417 42 HD13 ILE 6 HD13 ILE 6 23.475 27.121 26.577 43 H ALA 7 H ALA 7 21.001 29.241 30.928 44 HA ALA 7 HA ALA 7 23.582 29.892 31.688 45 HB1 ALA 7 HB1 ALA 7 22.549 31.761 32.935 46 HB2 ALA 7 HB2 ALA 7 21.759 31.503 31.369 47 HB3 ALA 7 HB3 ALA 7 20.974 30.940 32.867 48 H SER 8 H SER 8 21.171 28.257 33.741 49 HA SER 8 HA SER 8 22.711 28.323 36.196 50 HB2 SER 8 HB2 SER 8 20.400 26.595 35.279 51 HB3 SER 8 HB3 SER 8 21.049 26.645 36.934 52 HG SER 8 HG SER 8 19.418 28.077 36.924 53 H MET 9 H MET 9 22.644 26.072 33.425 54 HA MET 9 HA MET 9 24.008 23.844 34.615 55 HB2 MET 9 HB2 MET 9 24.359 24.833 31.756 56 HB3 MET 9 HB3 MET 9 24.600 23.211 32.378 57 HG2 MET 9 HG2 MET 9 22.196 22.930 32.713 58 HG3 MET 9 HG3 MET 9 21.899 24.602 32.272 59 HE1 MET 9 HE1 MET 9 23.257 21.356 29.254 60 HE2 MET 9 HE2 MET 9 24.429 22.094 30.363 61 HE3 MET 9 HE3 MET 9 23.088 21.107 31.007 62 H ILE 10 H ILE 10 25.147 26.882 33.158 63 HA ILE 10 HA ILE 10 27.898 26.340 32.945 64 HB ILE 10 HB ILE 10 26.823 29.096 33.603 65 HG12 ILE 10 HG12 ILE 10 25.282 28.306 31.897 66 HG13 ILE 10 HG13 ILE 10 26.385 29.474 31.212 67 HG21 ILE 10 HG21 ILE 10 28.589 29.723 31.920 68 HG22 ILE 10 HG22 ILE 10 29.178 29.042 33.440 69 HG23 ILE 10 HG23 ILE 10 29.148 28.034 31.982 70 HD11 ILE 10 HD11 ILE 10 27.678 27.619 30.145 71 HD12 ILE 10 HD12 ILE 10 26.512 26.455 30.822 72 HD13 ILE 10 HD13 ILE 10 25.975 27.669 29.654 73 H LYS 11 H LYS 11 26.045 27.180 35.771 74 HA LYS 11 HA LYS 11 28.296 27.997 37.440 75 HB2 LYS 11 HB2 LYS 11 25.359 27.705 38.051 76 HB3 LYS 11 HB3 LYS 11 26.596 28.538 39.018 77 HG2 LYS 11 HG2 LYS 11 27.086 30.014 37.021 78 HG3 LYS 11 HG3 LYS 11 25.730 29.260 36.167 79 HD2 LYS 11 HD2 LYS 11 24.222 29.991 37.982 80 HD3 LYS 11 HD3 LYS 11 25.605 30.895 38.677 81 HE2 LYS 11 HE2 LYS 11 25.869 32.107 36.509 82 HE3 LYS 11 HE3 LYS 11 24.498 31.219 35.835 83 HZ1 LYS 11 HZ1 LYS 11 23.866 33.435 36.583 84 HZ2 LYS 11 HZ2 LYS 11 23.072 32.316 37.495 85 HZ3 LYS 11 HZ3 LYS 11 24.366 33.120 38.106 86 H GLY 12 H GLY 12 26.807 25.010 36.664 87 HA2 GLY 12 HA2 GLY 12 27.206 23.669 39.229 88 HA3 GLY 12 HA3 GLY 12 26.587 22.970 37.735 89 H ASN 13 H ASN 13 29.270 24.139 36.457 90 HA ASN 13 HA ASN 13 31.250 22.209 37.581 91 HB2 ASN 13 HB2 ASN 13 30.718 22.541 34.600 92 HB3 ASN 13 HB3 ASN 13 31.884 21.462 35.349 93 HD21 ASN 13 HD21 ASN 13 30.847 19.747 36.901 94 HD22 ASN 13 HD22 ASN 13 29.414 18.997 36.197 95 H LYS 14 H LYS 14 33.478 22.654 36.804 96 HA LYS 14 HA LYS 14 34.131 25.484 36.891 97 HB2 LYS 14 HB2 LYS 14 35.536 23.426 37.596 98 HB3 LYS 14 HB3 LYS 14 35.886 23.222 35.890 99 HG2 LYS 14 HG2 LYS 14 37.698 24.486 36.396 100 HG3 LYS 14 HG3 LYS 14 36.576 25.790 35.993 101 HD2 LYS 14 HD2 LYS 14 37.631 26.437 38.013 102 HD3 LYS 14 HD3 LYS 14 36.005 25.909 38.461 103 HE2 LYS 14 HE2 LYS 14 36.988 23.643 39.069 104 HE3 LYS 14 HE3 LYS 14 38.597 24.304 38.748 105 HZ1 LYS 14 HZ1 LYS 14 38.186 25.953 40.469 106 HZ2 LYS 14 HZ2 LYS 14 36.672 25.358 40.730 107 HZ3 LYS 14 HZ3 LYS 14 37.982 24.426 41.102 108 H VAL 15 H VAL 15 34.205 23.067 34.210 109 HA VAL 15 HA VAL 15 33.895 25.324 32.272 110 HB VAL 15 HB VAL 15 35.314 22.678 31.805 111 HG11 VAL 15 HG11 VAL 15 34.290 23.454 29.733 112 HG12 VAL 15 HG12 VAL 15 34.887 25.096 29.998 113 HG13 VAL 15 HG13 VAL 15 36.020 23.775 29.667 114 HG21 VAL 15 HG21 VAL 15 36.731 24.014 33.186 115 HG22 VAL 15 HG22 VAL 15 37.313 24.259 31.526 116 HG23 VAL 15 HG23 VAL 15 36.308 25.486 32.300 117 H VAL 16 H VAL 16 32.296 25.288 30.827 118 HA VAL 16 HA VAL 16 30.677 22.811 30.472 119 HB VAL 16 HB VAL 16 29.482 25.552 30.982 120 HG11 VAL 16 HG11 VAL 16 27.331 24.252 30.980 121 HG12 VAL 16 HG12 VAL 16 28.101 24.267 29.387 122 HG13 VAL 16 HG13 VAL 16 28.214 22.822 30.423 123 HG21 VAL 16 HG21 VAL 16 30.230 24.561 33.084 124 HG22 VAL 16 HG22 VAL 16 28.491 24.293 32.974 125 HG23 VAL 16 HG23 VAL 16 29.590 22.967 32.608 126 H VAL 17 H VAL 17 30.306 22.313 28.402 127 HA VAL 17 HA VAL 17 30.761 24.349 26.253 128 HB VAL 17 HB VAL 17 31.754 21.488 26.551 129 HG11 VAL 17 HG11 VAL 17 31.799 23.185 24.007 130 HG12 VAL 17 HG12 VAL 17 32.705 21.678 24.257 131 HG13 VAL 17 HG13 VAL 17 30.951 21.634 24.214 132 HG21 VAL 17 HG21 VAL 17 33.913 22.540 26.053 133 HG22 VAL 17 HG22 VAL 17 33.124 24.123 25.951 134 HG23 VAL 17 HG23 VAL 17 33.173 23.245 27.498 135 H PHE 18 H PHE 18 29.532 24.224 24.394 136 HA PHE 18 HA PHE 18 27.311 22.199 24.358 137 HB2 PHE 18 HB2 PHE 18 27.227 25.029 23.276 138 HB3 PHE 18 HB3 PHE 18 25.951 23.826 23.154 139 HD1 PHE 18 HD2 PHE 18 24.692 23.092 25.197 140 HD2 PHE 18 HD1 PHE 18 27.605 26.265 25.341 141 HE1 PHE 18 HE2 PHE 18 23.796 23.822 27.405 142 HE2 PHE 18 HE1 PHE 18 26.709 26.985 27.538 143 HZ PHE 18 HZ PHE 18 24.793 25.786 28.560 144 H SER 19 H SER 19 27.445 20.787 22.772 145 HA SER 19 HA SER 19 28.985 21.415 20.293 146 HB2 SER 19 HB2 SER 19 29.177 18.905 22.006 147 HB3 SER 19 HB3 SER 19 29.817 19.030 20.352 148 HG SER 19 HG SER 19 31.411 19.381 21.790 149 H TRP 20 H TRP 20 28.683 19.832 18.577 150 HA TRP 20 HA TRP 20 25.988 18.540 18.468 151 HB2 TRP 20 HB2 TRP 20 27.331 20.408 16.542 152 HB3 TRP 20 HB3 TRP 20 26.581 18.977 15.866 153 HD1 TRP 20 HD1 TRP 20 24.494 20.227 18.684 154 HE1 TRP 20 HE1 TRP 20 22.342 21.278 17.671 155 HE3 TRP 20 HE3 TRP 20 25.958 20.629 13.787 156 HZ2 TRP 20 HZ2 TRP 20 21.483 22.325 15.150 157 HZ3 TRP 20 HZ3 TRP 20 24.458 21.674 12.106 158 HH2 TRP 20 HH2 TRP 20 22.225 22.530 12.776 159 H VAL 21 H VAL 21 26.104 16.420 18.124 160 HA VAL 21 HA VAL 21 28.590 15.187 17.149 161 HB VAL 21 HB VAL 21 27.274 13.056 17.283 162 HG11 VAL 21 HG11 VAL 21 27.761 14.645 19.832 163 HG12 VAL 21 HG12 VAL 21 27.640 12.876 19.704 164 HG13 VAL 21 HG13 VAL 21 28.972 13.725 18.915 165 HG21 VAL 21 HG21 VAL 21 25.389 14.673 19.067 166 HG22 VAL 21 HG22 VAL 21 24.956 14.077 17.451 167 HG23 VAL 21 HG23 VAL 21 25.349 12.931 18.731 168 H THR 22 H THR 22 27.467 14.910 13.731 169 HA THR 22 HA THR 22 29.790 15.091 15.629 170 HB THR 22 HB THR 22 31.081 13.927 13.948 171 HG1 THR 22 HG1 THR 22 28.588 13.624 12.622 172 HG21 THR 22 HG21 THR 22 28.570 12.349 14.657 173 HG22 THR 22 HG22 THR 22 29.958 12.611 15.734 174 HG23 THR 22 HG23 THR 22 30.166 11.698 14.234 175 H CYS 23 H CYS 23 31.079 16.836 15.480 176 HA CYS 23 HA CYS 23 30.979 18.545 13.023 177 HB2 CYS 23 HB2 CYS 23 30.424 19.337 15.875 178 HB3 CYS 23 HB3 CYS 23 31.021 20.502 14.679 179 HG CYS 23 HG CYS 23 28.424 18.497 14.400 180 HA PRO 24 HA PRO 24 35.347 17.858 13.558 181 HB2 PRO 24 HB2 PRO 24 35.464 19.979 11.398 182 HB3 PRO 24 HB3 PRO 24 36.424 18.470 11.552 183 HG2 PRO 24 HG2 PRO 24 34.294 18.461 9.930 184 HG3 PRO 24 HG3 PRO 24 34.493 17.115 11.090 185 HD2 PRO 24 HD2 PRO 24 32.763 19.599 11.382 186 HD3 PRO 24 HD3 PRO 24 32.334 17.880 11.633 187 H TYR 25 H TYR 25 34.002 21.060 14.161 188 HA TYR 25 HA TYR 25 36.484 22.037 15.449 189 HB2 TYR 25 HB2 TYR 25 33.535 22.852 15.566 190 HB3 TYR 25 HB3 TYR 25 34.807 23.731 16.396 191 HD1 TYR 25 HD2 TYR 25 36.941 23.623 14.122 192 HD2 TYR 25 HD1 TYR 25 32.798 24.832 14.322 193 HE1 TYR 25 HE2 TYR 25 37.332 25.346 12.380 194 HE2 TYR 25 HE1 TYR 25 33.215 26.563 12.581 195 HH TYR 25 HH TYR 25 34.785 27.586 11.222 196 H CYS 26 H CYS 26 33.502 20.505 16.563 197 HA CYS 26 HA CYS 26 33.672 21.272 19.286 198 HB2 CYS 26 HB2 CYS 26 32.348 19.160 17.631 199 HB3 CYS 26 HB3 CYS 26 32.309 18.975 19.361 200 HG CYS 26 HG CYS 26 31.096 21.143 19.899 201 H VAL 27 H VAL 27 34.750 18.330 17.709 202 HA VAL 27 HA VAL 27 36.023 16.803 19.604 203 HB VAL 27 HB VAL 27 35.742 16.454 17.342 204 HG11 VAL 27 HG11 VAL 27 37.939 18.018 16.334 205 HG12 VAL 27 HG12 VAL 27 36.757 17.013 15.486 206 HG13 VAL 27 HG13 VAL 27 36.181 18.440 16.354 207 HG21 VAL 27 HG21 VAL 27 37.445 15.057 18.588 208 HG22 VAL 27 HG22 VAL 27 37.760 15.105 16.843 209 HG23 VAL 27 HG23 VAL 27 38.708 16.128 17.944 210 H ARG 28 H ARG 28 37.389 19.147 17.685 211 HA ARG 28 HA ARG 28 40.028 19.276 18.723 212 HB2 ARG 28 HB2 ARG 28 38.783 21.923 17.879 213 HB3 ARG 28 HB3 ARG 28 40.477 21.449 17.855 214 HG2 ARG 28 HG2 ARG 28 39.669 19.592 16.181 215 HG3 ARG 28 HG3 ARG 28 38.245 20.666 16.017 216 HD2 ARG 28 HD2 ARG 28 39.601 22.481 15.238 217 HD3 ARG 28 HD3 ARG 28 41.101 21.579 15.574 218 HE ARG 28 HE ARG 28 39.586 19.948 13.868 219 HH11 ARG 28 HH12 ARG 28 41.126 23.081 13.506 220 HH12 ARG 28 HH11 ARG 28 41.412 22.793 11.800 221 HH21 ARG 28 HH22 ARG 28 39.874 19.700 11.817 222 HH22 ARG 28 HH21 ARG 28 40.631 20.959 10.829 223 H ALA 29 H ALA 29 37.340 21.209 19.985 224 HA ALA 29 HA ALA 29 38.871 22.269 22.235 225 HB1 ALA 29 HB1 ALA 29 36.669 23.048 23.026 226 HB2 ALA 29 HB2 ALA 29 36.957 23.498 21.330 227 HB3 ALA 29 HB3 ALA 29 35.873 22.141 21.723 228 H GLU 30 H GLU 30 36.341 19.678 21.964 229 HA GLU 30 HA GLU 30 36.323 18.964 24.722 230 HB2 GLU 30 HB2 GLU 30 35.745 17.288 22.230 231 HB3 GLU 30 HB3 GLU 30 35.390 16.784 23.884 232 HG2 GLU 30 HG2 GLU 30 33.802 18.636 24.164 233 HG3 GLU 30 HG3 GLU 30 34.148 19.229 22.537 234 H LYS 31 H LYS 31 38.510 17.858 22.209 235 HA LYS 31 HA LYS 31 39.761 15.842 23.830 236 HB2 LYS 31 HB2 LYS 31 39.779 15.800 21.387 237 HB3 LYS 31 HB3 LYS 31 40.580 17.361 21.316 238 HG2 LYS 31 HG2 LYS 31 42.134 15.395 22.849 239 HG3 LYS 31 HG3 LYS 31 41.765 14.800 21.242 240 HD2 LYS 31 HD2 LYS 31 43.191 17.395 21.924 241 HD3 LYS 31 HD3 LYS 31 43.934 15.934 21.282 242 HE2 LYS 31 HE2 LYS 31 41.890 17.658 19.803 243 HE3 LYS 31 HE3 LYS 31 43.640 17.738 19.597 244 HZ1 LYS 31 HZ1 LYS 31 42.609 16.400 17.903 245 HZ2 LYS 31 HZ2 LYS 31 43.581 15.419 18.805 246 HZ3 LYS 31 HZ3 LYS 31 41.948 15.364 18.988 247 H LEU 32 H LEU 32 40.683 19.149 23.011 248 HA LEU 32 HA LEU 32 43.126 19.410 24.448 249 HB2 LEU 32 HB2 LEU 32 42.136 20.698 22.565 250 HB3 LEU 32 HB3 LEU 32 41.006 21.405 23.722 251 HG LEU 32 HG LEU 32 42.720 22.907 23.030 252 HD11 LEU 32 HD11 LEU 32 41.811 23.148 25.337 253 HD12 LEU 32 HD12 LEU 32 43.266 22.319 25.946 254 HD13 LEU 32 HD13 LEU 32 43.415 23.858 25.095 255 HD21 LEU 32 HD21 LEU 32 45.055 22.726 23.541 256 HD22 LEU 32 HD22 LEU 32 44.805 21.146 24.337 257 HD23 LEU 32 HD23 LEU 32 44.540 21.322 22.589 258 H LEU 33 H LEU 33 39.751 20.119 25.435 259 HA LEU 33 HA LEU 33 40.390 21.221 27.983 260 HB2 LEU 33 HB2 LEU 33 37.922 19.777 26.884 261 HB3 LEU 33 HB3 LEU 33 37.910 20.545 28.461 262 HG LEU 33 HG LEU 33 38.476 22.002 25.864 263 HD11 LEU 33 HD11 LEU 33 36.311 22.918 25.890 264 HD12 LEU 33 HD12 LEU 33 36.159 21.158 25.951 265 HD13 LEU 33 HD13 LEU 33 35.918 22.135 27.427 266 HD21 LEU 33 HD21 LEU 33 39.436 23.212 27.751 267 HD22 LEU 33 HD22 LEU 33 37.969 24.044 27.219 268 HD23 LEU 33 HD23 LEU 33 37.914 23.021 28.661 269 H HIS 34 H HIS 34 39.676 17.825 27.138 270 HA HIS 34 HA HIS 34 40.196 16.871 29.830 271 HB2 HIS 34 HB2 HIS 34 39.914 15.570 27.114 272 HB3 HIS 34 HB3 HIS 34 40.540 14.667 28.483 273 HD1 HIS 34 HD1 HIS 34 38.831 13.681 30.161 274 HD2 HIS 34 HD2 HIS 34 37.252 16.558 27.525 275 HE1 HIS 34 HE1 HIS 34 36.296 13.586 30.419 276 H ALA 35 H ALA 35 42.329 17.568 27.012 277 HA ALA 35 HA ALA 35 44.593 16.137 28.097 278 HB1 ALA 35 HB1 ALA 35 45.865 17.336 26.419 279 HB2 ALA 35 HB2 ALA 35 44.325 16.813 25.715 280 HB3 ALA 35 HB3 ALA 35 44.560 18.509 26.182 281 H ARG 36 H ARG 36 43.431 19.446 28.483 282 HA ARG 36 HA ARG 36 45.696 20.272 30.221 283 HB2 ARG 36 HB2 ARG 36 43.425 21.638 28.779 284 HB3 ARG 36 HB3 ARG 36 44.189 22.427 30.143 285 HG2 ARG 36 HG2 ARG 36 45.120 23.230 28.106 286 HG3 ARG 36 HG3 ARG 36 46.320 22.512 29.180 287 HD2 ARG 36 HD2 ARG 36 46.473 20.535 27.783 288 HD3 ARG 36 HD3 ARG 36 45.146 21.106 26.752 289 HE ARG 36 HE ARG 36 46.977 23.206 26.763 290 HH11 ARG 36 HH12 ARG 36 47.650 19.852 25.926 291 HH12 ARG 36 HH11 ARG 36 48.558 20.363 24.506 292 HH21 ARG 36 HH22 ARG 36 48.265 23.697 25.322 293 HH22 ARG 36 HH21 ARG 36 49.164 22.503 24.385 294 H THR 37 H THR 37 43.266 18.473 30.976 295 HA THR 37 HA THR 37 42.458 17.732 32.952 296 HB THR 37 HB THR 37 43.606 19.829 34.664 297 HG1 THR 37 HG1 THR 37 45.409 19.638 33.462 298 HG21 THR 37 HG21 THR 37 44.368 17.780 35.953 299 HG22 THR 37 HG22 THR 37 43.666 16.757 34.689 300 HG23 THR 37 HG23 THR 37 42.621 17.801 35.675 301 H LYS 38 H LYS 38 40.968 19.897 31.474 302 HA LYS 38 HA LYS 38 39.906 21.602 33.621 303 HB2 LYS 38 HB2 LYS 38 38.691 21.051 30.888 304 HB3 LYS 38 HB3 LYS 38 38.182 22.247 32.056 305 HG2 LYS 38 HG2 LYS 38 40.638 22.179 30.288 306 HG3 LYS 38 HG3 LYS 38 39.374 23.381 30.312 307 HD2 LYS 38 HD2 LYS 38 40.528 24.727 31.677 308 HD3 LYS 38 HD3 LYS 38 40.718 23.453 32.876 309 HE2 LYS 38 HE2 LYS 38 42.502 22.454 31.345 310 HE3 LYS 38 HE3 LYS 38 42.406 23.927 30.387 311 HZ1 LYS 38 HZ1 LYS 38 43.058 25.067 32.642 312 HZ2 LYS 38 HZ2 LYS 38 43.619 23.545 33.033 313 HZ3 LYS 38 HZ3 LYS 38 44.191 24.304 31.767 314 H ASP 39 H ASP 39 38.734 20.799 35.186 315 HA ASP 39 HA ASP 39 36.891 18.685 35.022 316 HB2 ASP 39 HB2 ASP 39 37.480 19.697 37.152 317 HB3 ASP 39 HB3 ASP 39 36.779 21.236 36.682 318 H ILE 40 H ILE 40 35.720 18.489 33.285 319 HA ILE 40 HA ILE 40 34.191 20.792 32.208 320 HB ILE 40 HB ILE 40 36.318 20.216 31.127 321 HG12 ILE 40 HG12 ILE 40 33.865 20.862 29.864 322 HG13 ILE 40 HG13 ILE 40 35.508 21.299 29.454 323 HG21 ILE 40 HG21 ILE 40 36.666 18.258 29.793 324 HG22 ILE 40 HG22 ILE 40 36.248 17.743 31.419 325 HG23 ILE 40 HG23 ILE 40 35.036 17.646 30.140 326 HD11 ILE 40 HD11 ILE 40 35.719 19.433 27.921 327 HD12 ILE 40 HD12 ILE 40 34.108 18.819 28.402 328 HD13 ILE 40 HD13 ILE 40 34.265 20.363 27.554 329 H THR 41 H THR 41 32.215 20.659 31.496 330 HA THR 41 HA THR 41 30.931 17.999 30.985 331 HB THR 41 HB THR 41 29.821 20.522 32.226 332 HG1 THR 41 HG1 THR 41 29.312 19.175 33.799 333 HG21 THR 41 HG21 THR 41 28.138 19.974 30.582 334 HG22 THR 41 HG22 THR 41 27.576 19.422 32.159 335 HG23 THR 41 HG23 THR 41 28.218 18.238 30.998 336 H VAL 42 H VAL 42 30.339 17.722 28.856 337 HA VAL 42 HA VAL 42 29.634 20.150 27.310 338 HB VAL 42 HB VAL 42 31.430 19.533 26.193 339 HG11 VAL 42 HG11 VAL 42 32.266 17.346 25.639 340 HG12 VAL 42 HG12 VAL 42 32.275 17.834 27.331 341 HG13 VAL 42 HG13 VAL 42 31.041 16.657 26.746 342 HG21 VAL 42 HG21 VAL 42 29.423 17.786 24.763 343 HG22 VAL 42 HG22 VAL 42 29.556 19.554 24.598 344 HG23 VAL 42 HG23 VAL 42 30.882 18.514 24.072 345 H HIS 43 H HIS 43 27.752 20.289 26.362 346 HA HIS 43 HA HIS 43 25.856 18.014 26.641 347 HB2 HIS 43 HB2 HIS 43 25.378 20.159 27.839 348 HB3 HIS 43 HB3 HIS 43 25.280 20.966 26.282 349 HD1 HIS 43 HD1 HIS 43 23.617 17.485 26.723 350 HD2 HIS 43 HD2 HIS 43 22.705 21.606 26.681 351 HE1 HIS 43 HE1 HIS 43 21.077 17.677 26.702 352 H TYR 44 H TYR 44 25.129 17.013 24.906 353 HA TYR 44 HA TYR 44 25.845 17.954 22.183 354 HB2 TYR 44 HB2 TYR 44 24.826 15.309 23.280 355 HB3 TYR 44 HB3 TYR 44 25.232 15.587 21.603 356 HD1 TYR 44 HD2 TYR 44 27.772 16.846 21.433 357 HD2 TYR 44 HD1 TYR 44 26.416 14.186 24.549 358 HE1 TYR 44 HE2 TYR 44 30.122 16.495 22.150 359 HE2 TYR 44 HE1 TYR 44 28.761 13.818 25.248 360 HH TYR 44 HH TYR 44 31.532 15.499 23.700 361 H VAL 45 H VAL 45 24.295 19.677 22.146 362 HA VAL 45 HA VAL 45 21.560 19.270 22.717 363 HB VAL 45 HB VAL 45 21.136 21.438 21.670 364 HG11 VAL 45 HG11 VAL 45 23.676 21.428 23.344 365 HG12 VAL 45 HG12 VAL 45 22.523 22.766 23.152 366 HG13 VAL 45 HG13 VAL 45 22.017 21.279 23.969 367 HG21 VAL 45 HG21 VAL 45 22.601 21.376 19.746 368 HG22 VAL 45 HG22 VAL 45 22.966 22.783 20.746 369 HG23 VAL 45 HG23 VAL 45 24.047 21.381 20.793 370 H ASP 46 H ASP 46 23.141 18.308 19.829 371 HA ASP 46 HA ASP 46 20.927 18.132 18.012 372 HB2 ASP 46 HB2 ASP 46 23.353 17.914 17.440 373 HB3 ASP 46 HB3 ASP 46 23.420 16.393 18.322 374 H LYS 47 H LYS 47 21.576 16.330 20.900 375 HA LYS 47 HA LYS 47 20.349 13.785 20.230 376 HB2 LYS 47 HB2 LYS 47 21.060 15.191 22.828 377 HB3 LYS 47 HB3 LYS 47 20.455 13.535 22.767 378 HG2 LYS 47 HG2 LYS 47 22.944 14.404 21.251 379 HG3 LYS 47 HG3 LYS 47 22.943 13.997 22.960 380 HD2 LYS 47 HD2 LYS 47 22.126 11.711 22.449 381 HD3 LYS 47 HD3 LYS 47 22.040 12.137 20.728 382 HE2 LYS 47 HE2 LYS 47 24.534 12.731 20.891 383 HE3 LYS 47 HE3 LYS 47 24.530 11.981 22.493 384 HZ1 LYS 47 HZ1 LYS 47 23.841 9.892 21.420 385 HZ2 LYS 47 HZ2 LYS 47 23.789 10.631 19.958 386 HZ3 LYS 47 HZ3 LYS 47 25.225 10.437 20.716 387 H MET 48 H MET 48 19.022 16.808 21.367 388 HA MET 48 HA MET 48 16.300 15.602 21.301 389 HB2 MET 48 HB2 MET 48 15.679 16.432 23.469 390 HB3 MET 48 HB3 MET 48 17.117 15.433 23.619 391 HG2 MET 48 HG2 MET 48 18.479 17.607 23.610 392 HG3 MET 48 HG3 MET 48 16.934 18.460 23.743 393 HE1 MET 48 HE1 MET 48 18.944 19.213 25.774 394 HE2 MET 48 HE2 MET 48 17.244 19.673 26.025 395 HE3 MET 48 HE3 MET 48 18.175 18.958 27.357 396 H SER 49 H SER 49 14.530 16.963 20.977 397 HA SER 49 HA SER 49 14.872 19.073 19.148 398 HB2 SER 49 HB2 SER 49 12.460 18.600 20.934 399 HB3 SER 49 HB3 SER 49 12.479 19.414 19.365 400 HG SER 49 HG SER 49 12.987 17.481 18.371 401 H GLU 50 H GLU 50 14.405 19.319 22.685 402 HA GLU 50 HA GLU 50 14.120 22.136 22.825 403 HB2 GLU 50 HB2 GLU 50 14.775 19.956 24.699 404 HB3 GLU 50 HB3 GLU 50 15.739 21.400 25.063 405 HG2 GLU 50 HG2 GLU 50 13.818 21.644 26.371 406 HG3 GLU 50 HG3 GLU 50 13.569 22.745 25.022 407 H GLY 51 H GLY 51 16.951 20.402 21.887 408 HA2 GLY 51 HA2 GLY 51 19.089 22.024 22.675 409 HA3 GLY 51 HA3 GLY 51 18.977 21.108 21.170 410 H GLU 52 H GLU 52 16.655 22.723 20.103 411 HA GLU 52 HA GLU 52 18.009 24.845 18.856 412 HB2 GLU 52 HB2 GLU 52 16.075 23.342 18.105 413 HB3 GLU 52 HB3 GLU 52 15.018 24.212 19.241 414 HG2 GLU 52 HG2 GLU 52 15.525 26.287 18.110 415 HG3 GLU 52 HG3 GLU 52 16.678 25.437 17.059 416 H GLN 53 H GLN 53 15.978 24.729 21.834 417 HA GLN 53 HA GLN 53 15.894 27.657 22.106 418 HB2 GLN 53 HB2 GLN 53 14.096 26.223 22.996 419 HB3 GLN 53 HB3 GLN 53 15.236 25.560 24.171 420 HG2 GLN 53 HG2 GLN 53 13.858 27.409 25.063 421 HG3 GLN 53 HG3 GLN 53 15.570 27.759 25.184 422 HE21 GLN 53 HE21 GLN 53 15.615 30.047 25.048 423 HE22 GLN 53 HE22 GLN 53 14.955 30.900 23.645 424 H LEU 54 H LEU 54 17.879 24.954 23.373 425 HA LEU 54 HA LEU 54 19.465 26.648 25.103 426 HB2 LEU 54 HB2 LEU 54 20.142 23.973 23.826 427 HB3 LEU 54 HB3 LEU 54 21.089 24.774 25.063 428 HG LEU 54 HG LEU 54 20.003 23.701 26.640 429 HD11 LEU 54 HD11 LEU 54 18.340 25.610 26.759 430 HD12 LEU 54 HD12 LEU 54 17.244 24.580 25.806 431 HD13 LEU 54 HD13 LEU 54 17.835 24.070 27.401 432 HD21 LEU 54 HD21 LEU 54 19.772 21.944 25.075 433 HD22 LEU 54 HD22 LEU 54 18.476 21.964 26.286 434 HD23 LEU 54 HD23 LEU 54 18.147 22.544 24.646 435 H ARG 55 H ARG 55 19.852 25.717 21.667 436 HA ARG 55 HA ARG 55 22.158 27.381 21.104 437 HB2 ARG 55 HB2 ARG 55 19.831 26.320 19.449 438 HB3 ARG 55 HB3 ARG 55 21.071 27.351 18.737 439 HG2 ARG 55 HG2 ARG 55 22.777 25.776 19.042 440 HG3 ARG 55 HG3 ARG 55 21.902 24.893 20.291 441 HD2 ARG 55 HD2 ARG 55 22.009 23.583 18.254 442 HD3 ARG 55 HD3 ARG 55 20.350 24.001 18.668 443 HE ARG 55 HE ARG 55 21.778 25.688 16.632 444 HH11 ARG 55 HH12 ARG 55 19.559 23.011 17.028 445 HH12 ARG 55 HH11 ARG 55 18.586 23.502 15.655 446 HH21 ARG 55 HH22 ARG 55 20.793 26.045 14.814 447 HH22 ARG 55 HH21 ARG 55 19.351 25.163 14.314 448 H GLY 56 H GLY 56 18.667 28.124 21.081 449 HA2 GLY 56 HA2 GLY 56 18.770 30.791 20.189 450 HA3 GLY 56 HA3 GLY 56 17.532 30.109 21.252 451 H GLU 57 H GLU 57 19.036 29.616 23.623 452 HA GLU 57 HA GLU 57 19.237 32.181 24.844 453 HB2 GLU 57 HB2 GLU 57 20.677 29.644 25.643 454 HB3 GLU 57 HB3 GLU 57 20.555 31.095 26.607 455 HG2 GLU 57 HG2 GLU 57 18.523 28.938 26.210 456 HG3 GLU 57 HG3 GLU 57 19.110 29.803 27.602 457 H ILE 58 H ILE 58 21.793 30.257 23.252 458 HA ILE 58 HA ILE 58 23.947 32.092 23.938 459 HB ILE 58 HB ILE 58 23.881 30.083 21.656 460 HG12 ILE 58 HG12 ILE 58 25.002 29.605 24.459 461 HG13 ILE 58 HG13 ILE 58 23.427 29.018 23.934 462 HG21 ILE 58 HG21 ILE 58 26.318 30.198 21.765 463 HG22 ILE 58 HG22 ILE 58 25.712 31.836 21.612 464 HG23 ILE 58 HG23 ILE 58 26.254 31.254 23.194 465 HD11 ILE 58 HD11 ILE 58 24.978 27.216 23.745 466 HD12 ILE 58 HD12 ILE 58 24.517 27.717 22.108 467 HD13 ILE 58 HD13 ILE 58 26.101 28.179 22.775 468 H TYR 59 H TYR 59 21.920 31.582 20.986 469 HA TYR 59 HA TYR 59 23.212 33.585 19.479 470 HB2 TYR 59 HB2 TYR 59 21.485 31.716 18.797 471 HB3 TYR 59 HB3 TYR 59 20.298 32.994 19.003 472 HD1 TYR 59 HD1 TYR 59 20.556 35.148 17.550 473 HD2 TYR 59 HD2 TYR 59 23.012 31.666 17.036 474 HE1 TYR 59 HE1 TYR 59 21.248 35.950 15.276 475 HE2 TYR 59 HE2 TYR 59 23.712 32.444 14.794 476 HH TYR 59 HH TYR 59 23.658 34.167 13.333 477 H GLN 60 H GLN 60 20.311 33.908 21.569 478 HA GLN 60 HA GLN 60 19.787 36.621 20.853 479 HB2 GLN 60 HB2 GLN 60 19.113 34.988 23.331 480 HB3 GLN 60 HB3 GLN 60 18.494 36.621 23.050 481 HG2 GLN 60 HG2 GLN 60 18.081 34.329 21.082 482 HG3 GLN 60 HG3 GLN 60 16.940 34.751 22.353 483 HE21 GLN 60 HE21 GLN 60 15.978 36.909 22.330 484 HE22 GLN 60 HE22 GLN 60 15.851 37.807 20.835 485 H ALA 61 H ALA 61 22.107 35.314 23.213 486 HA ALA 61 HA ALA 61 22.734 38.004 24.257 487 HB1 ALA 61 HB1 ALA 61 23.934 35.250 24.733 488 HB2 ALA 61 HB2 ALA 61 24.453 36.740 25.550 489 HB3 ALA 61 HB3 ALA 61 22.805 36.131 25.781 490 H TYR 62 H TYR 62 24.321 35.603 22.086 491 HA TYR 62 HA TYR 62 26.605 37.489 21.720 492 HB2 TYR 62 HB2 TYR 62 26.530 34.463 21.545 493 HB3 TYR 62 HB3 TYR 62 27.953 35.474 21.389 494 HD1 TYR 62 HD1 TYR 62 28.713 36.893 23.400 495 HD2 TYR 62 HD2 TYR 62 25.847 33.690 23.695 496 HE1 TYR 62 HE1 TYR 62 29.156 36.721 25.840 497 HE2 TYR 62 HE2 TYR 62 26.286 33.520 26.137 498 HH TYR 62 HH TYR 62 28.675 35.634 27.775 499 H LYS 63 H LYS 63 24.013 36.396 19.905 500 HA LYS 63 HA LYS 63 23.512 36.016 17.788 501 HB2 LYS 63 HB2 LYS 63 25.694 38.022 17.140 502 HB3 LYS 63 HB3 LYS 63 24.376 37.552 16.076 503 HG2 LYS 63 HG2 LYS 63 24.060 39.046 18.710 504 HG3 LYS 63 HG3 LYS 63 23.990 39.729 17.089 505 HD2 LYS 63 HD2 LYS 63 22.004 38.173 16.621 506 HD3 LYS 63 HD3 LYS 63 22.033 37.769 18.336 507 HE2 LYS 63 HE2 LYS 63 20.431 39.439 18.262 508 HE3 LYS 63 HE3 LYS 63 21.874 40.318 18.784 509 HZ1 LYS 63 HZ1 LYS 63 22.161 41.028 16.451 510 HZ2 LYS 63 HZ2 LYS 63 20.820 40.181 16.013 511 HZ3 LYS 63 HZ3 LYS 63 20.677 41.478 17.002 512 H HIS 64 H HIS 64 25.237 34.074 18.805 513 HA HIS 64 HA HIS 64 25.988 32.745 16.286 514 HB2 HIS 64 HB2 HIS 64 27.850 32.886 18.698 515 HB3 HIS 64 HB3 HIS 64 28.086 31.869 17.278 516 HD1 HIS 64 HD1 HIS 64 28.026 33.612 14.857 517 HD2 HIS 64 HD2 HIS 64 29.332 35.028 18.603 518 HE1 HIS 64 HE1 HIS 64 29.409 35.696 14.392 519 H GLU 65 H GLU 65 25.960 30.351 16.547 520 HA GLU 65 HA GLU 65 24.370 29.468 18.953 521 HB2 GLU 65 HB2 GLU 65 23.158 27.920 17.512 522 HB3 GLU 65 HB3 GLU 65 22.848 29.592 17.089 523 HG2 GLU 65 HG2 GLU 65 24.305 29.447 15.137 524 HG3 GLU 65 HG3 GLU 65 24.808 27.811 15.590 525 H THR 66 H THR 66 26.957 28.537 16.701 526 HA THR 66 HA THR 66 27.989 26.713 18.761 527 HB THR 66 HB THR 66 27.490 25.567 16.004 528 HG1 THR 66 HG1 THR 66 25.819 25.742 18.109 529 HG21 THR 66 HG21 THR 66 28.359 24.269 18.623 530 HG22 THR 66 HG22 THR 66 29.341 24.446 17.142 531 HG23 THR 66 HG23 THR 66 27.931 23.390 17.142 532 H VAL 67 H VAL 67 30.169 26.480 18.606 533 HA VAL 67 HA VAL 67 31.652 27.241 16.202 534 HB VAL 67 HB VAL 67 32.944 28.554 18.461 535 HG11 VAL 67 HG11 VAL 67 31.984 29.589 15.773 536 HG12 VAL 67 HG12 VAL 67 33.165 30.363 16.851 537 HG13 VAL 67 HG13 VAL 67 33.553 28.815 16.090 538 HG21 VAL 67 HG21 VAL 67 31.566 30.535 18.648 539 HG22 VAL 67 HG22 VAL 67 30.300 29.811 17.644 540 HG23 VAL 67 HG23 VAL 67 30.678 29.136 19.256 541 HA PRO 68 HA PRO 68 30.628 25.150 19.443 542 HB2 PRO 68 HB2 PRO 68 31.728 24.161 21.713 543 HB3 PRO 68 HB3 PRO 68 31.522 23.188 20.234 544 HG2 PRO 68 HG2 PRO 68 34.006 24.690 21.132 545 HG3 PRO 68 HG3 PRO 68 33.876 22.963 20.675 546 HD2 PRO 68 HD2 PRO 68 34.674 24.797 18.871 547 HD3 PRO 68 HD3 PRO 68 33.533 23.513 18.381 548 H ALA 69 H ALA 69 29.977 25.889 21.671 549 HA ALA 69 HA ALA 69 31.184 28.522 22.393 550 HB1 ALA 69 HB1 ALA 69 28.763 28.558 21.959 551 HB2 ALA 69 HB2 ALA 69 28.511 27.239 23.124 552 HB3 ALA 69 HB3 ALA 69 29.073 28.823 23.685 553 H ILE 70 H ILE 70 32.418 28.675 24.231 554 HA ILE 70 HA ILE 70 32.390 26.407 26.171 555 HB ILE 70 HB ILE 70 34.831 28.027 25.380 556 HG12 ILE 70 HG12 ILE 70 35.448 25.504 24.516 557 HG13 ILE 70 HG13 ILE 70 33.740 25.539 24.114 558 HG21 ILE 70 HG21 ILE 70 34.493 25.533 27.094 559 HG22 ILE 70 HG22 ILE 70 36.050 26.212 26.588 560 HG23 ILE 70 HG23 ILE 70 34.988 27.147 27.630 561 HD11 ILE 70 HD11 ILE 70 35.826 27.611 23.262 562 HD12 ILE 70 HD12 ILE 70 35.191 26.312 22.243 563 HD13 ILE 70 HD13 ILE 70 34.120 27.620 22.781 564 H PHE 71 H PHE 71 32.238 26.910 28.253 565 HA PHE 71 HA PHE 71 32.558 29.743 29.129 566 HB2 PHE 71 HB2 PHE 71 30.479 27.714 30.001 567 HB3 PHE 71 HB3 PHE 71 30.701 29.316 30.687 568 HD1 PHE 71 HD2 PHE 71 29.617 27.430 27.673 569 HD2 PHE 71 HD1 PHE 71 29.846 31.309 29.544 570 HE1 PHE 71 HE2 PHE 71 28.110 28.370 25.932 571 HE2 PHE 71 HE1 PHE 71 28.310 32.226 27.820 572 HZ PHE 71 HZ PHE 71 27.447 30.745 26.006 573 H ILE 72 H ILE 72 33.885 30.020 30.868 574 HA ILE 72 HA ILE 72 34.570 27.660 32.581 575 HB ILE 72 HB ILE 72 36.582 29.728 31.617 576 HG12 ILE 72 HG12 ILE 72 35.996 26.917 30.645 577 HG13 ILE 72 HG13 ILE 72 36.034 28.407 29.719 578 HG21 ILE 72 HG21 ILE 72 36.793 27.256 33.406 579 HG22 ILE 72 HG22 ILE 72 38.195 28.128 32.755 580 HG23 ILE 72 HG23 ILE 72 37.087 28.931 33.852 581 HD11 ILE 72 HD11 ILE 72 38.503 28.552 30.135 582 HD12 ILE 72 HD12 ILE 72 38.416 26.925 30.869 583 HD13 ILE 72 HD13 ILE 72 37.983 27.155 29.168 584 H ASN 73 H ASN 73 33.955 28.052 34.590 585 HA ASN 73 HA ASN 73 32.844 29.137 36.221 586 HB2 ASN 73 HB2 ASN 73 35.444 30.686 36.125 587 HB3 ASN 73 HB3 ASN 73 34.212 31.015 37.341 588 HD21 ASN 73 HD21 ASN 73 36.608 30.247 38.314 589 HD22 ASN 73 HD22 ASN 73 36.402 28.627 38.979 590 H GLY 74 H GLY 74 31.674 29.669 33.896 591 HA2 GLY 74 HA2 GLY 74 30.097 31.032 32.932 592 HA3 GLY 74 HA3 GLY 74 30.212 32.111 34.297 593 H ASN 75 H ASN 75 33.328 31.988 32.922 594 HA ASN 75 HA ASN 75 32.921 34.458 31.349 595 HB2 ASN 75 HB2 ASN 75 35.458 32.813 31.724 596 HB3 ASN 75 HB3 ASN 75 35.352 34.460 31.143 597 HD21 ASN 75 HD21 ASN 75 35.434 32.459 33.930 598 HD22 ASN 75 HD22 ASN 75 35.653 33.803 35.049 599 H PHE 76 H PHE 76 32.721 34.504 29.112 600 HA PHE 76 HA PHE 76 32.553 31.900 27.720 601 HB2 PHE 76 HB2 PHE 76 30.610 33.292 27.585 602 HB3 PHE 76 HB3 PHE 76 31.560 34.683 27.080 603 HD1 PHE 76 HD1 PHE 76 30.868 31.137 25.958 604 HD2 PHE 76 HD2 PHE 76 31.628 35.218 24.804 605 HE1 PHE 76 HE1 PHE 76 30.636 30.518 23.571 606 HE2 PHE 76 HE2 PHE 76 31.379 34.596 22.420 607 HZ PHE 76 HZ PHE 76 30.884 32.241 21.793 608 H ILE 77 H ILE 77 33.830 31.210 26.146 609 HA ILE 77 HA ILE 77 35.209 33.128 24.425 610 HB ILE 77 HB ILE 77 37.197 31.850 24.125 611 HG12 ILE 77 HG12 ILE 77 36.589 29.603 24.804 612 HG13 ILE 77 HG13 ILE 77 38.069 30.177 25.540 613 HG21 ILE 77 HG21 ILE 77 37.090 33.786 25.669 614 HG22 ILE 77 HG22 ILE 77 36.957 32.679 27.033 615 HG23 ILE 77 HG23 ILE 77 38.407 32.666 25.994 616 HD11 ILE 77 HD11 ILE 77 36.837 28.859 27.138 617 HD12 ILE 77 HD12 ILE 77 36.873 30.530 27.707 618 HD13 ILE 77 HD13 ILE 77 35.400 29.873 26.965 619 H GLY 78 H GLY 78 35.255 32.580 22.253 620 HA2 GLY 78 HA2 GLY 78 33.687 30.107 21.537 621 HA3 GLY 78 HA3 GLY 78 33.341 31.676 20.829 622 H GLY 79 H GLY 79 34.807 28.854 20.299 623 HA2 GLY 79 HA2 GLY 79 35.507 28.419 17.985 624 HA3 GLY 79 HA3 GLY 79 36.465 29.895 18.030 625 H CYS 80 H CYS 80 37.327 27.132 17.441 626 HA CYS 80 HA CYS 80 38.537 25.843 19.631 627 HB2 CYS 80 HB2 CYS 80 39.436 25.866 16.713 628 HB3 CYS 80 HB3 CYS 80 39.872 24.648 17.920 629 HG CYS 80 HG CYS 80 37.507 23.708 18.351 630 H SER 81 H SER 81 40.012 28.226 17.405 631 HA SER 81 HA SER 81 42.584 28.285 18.670 632 HB2 SER 81 HB2 SER 81 41.268 30.447 16.987 633 HB3 SER 81 HB3 SER 81 42.995 30.274 17.343 634 HG SER 81 HG SER 81 41.297 28.577 15.824 635 H ASP 82 H ASP 82 39.596 30.119 19.339 636 HA ASP 82 HA ASP 82 40.767 32.097 21.021 637 HB2 ASP 82 HB2 ASP 82 38.389 31.810 19.899 638 HB3 ASP 82 HB3 ASP 82 37.911 31.082 21.399 639 H LEU 83 H LEU 83 39.371 28.964 21.714 640 HA LEU 83 HA LEU 83 39.736 29.004 24.590 641 HB2 LEU 83 HB2 LEU 83 38.192 27.444 23.592 642 HB3 LEU 83 HB3 LEU 83 39.437 26.789 22.529 643 HG LEU 83 HG LEU 83 40.632 25.829 24.466 644 HD11 LEU 83 HD11 LEU 83 39.525 25.717 26.676 645 HD12 LEU 83 HD12 LEU 83 39.926 27.378 26.259 646 HD13 LEU 83 HD13 LEU 83 38.251 26.822 26.094 647 HD21 LEU 83 HD21 LEU 83 38.960 24.527 23.219 648 HD22 LEU 83 HD22 LEU 83 39.079 24.036 24.911 649 HD23 LEU 83 HD23 LEU 83 37.707 25.036 24.373 650 H GLU 84 H GLU 84 41.791 27.650 21.950 651 HA GLU 84 HA GLU 84 43.873 26.794 23.753 652 HB2 GLU 84 HB2 GLU 84 43.862 27.263 20.753 653 HB3 GLU 84 HB3 GLU 84 45.259 26.626 21.664 654 HG2 GLU 84 HG2 GLU 84 44.043 24.742 22.462 655 HG3 GLU 84 HG3 GLU 84 42.516 25.341 21.819 656 H ALA 85 H ALA 85 43.225 29.930 22.269 657 HA ALA 85 HA ALA 85 45.753 31.135 22.759 658 HB1 ALA 85 HB1 ALA 85 44.462 33.267 22.666 659 HB2 ALA 85 HB2 ALA 85 44.002 32.173 21.352 660 HB3 ALA 85 HB3 ALA 85 42.948 32.356 22.763 661 H LEU 86 H LEU 86 42.956 30.605 24.991 662 HA LEU 86 HA LEU 86 44.019 32.105 27.207 663 HB2 LEU 86 HB2 LEU 86 42.313 29.576 27.254 664 HB3 LEU 86 HB3 LEU 86 42.578 30.696 28.582 665 HG LEU 86 HG LEU 86 40.999 31.271 26.053 666 HD11 LEU 86 HD11 LEU 86 39.868 29.795 27.641 667 HD12 LEU 86 HD12 LEU 86 40.250 30.894 28.992 668 HD13 LEU 86 HD13 LEU 86 39.134 31.401 27.722 669 HD21 LEU 86 HD21 LEU 86 41.567 33.051 28.470 670 HD22 LEU 86 HD22 LEU 86 42.109 33.339 26.798 671 HD23 LEU 86 HD23 LEU 86 40.392 33.395 27.188 672 H ASP 87 H ASP 87 44.645 28.856 25.978 673 HA ASP 87 HA ASP 87 46.130 27.929 28.290 674 HB2 ASP 87 HB2 ASP 87 44.941 26.469 26.593 675 HB3 ASP 87 HB3 ASP 87 46.248 26.827 25.472 676 H LYS 88 H LYS 88 47.021 29.287 25.139 677 HA LYS 88 HA LYS 88 49.899 29.300 25.537 678 HB2 LYS 88 HB2 LYS 88 47.959 30.596 23.580 679 HB3 LYS 88 HB3 LYS 88 49.619 31.148 23.656 680 HG2 LYS 88 HG2 LYS 88 49.643 29.565 21.953 681 HG3 LYS 88 HG3 LYS 88 50.392 28.774 23.339 682 HD2 LYS 88 HD2 LYS 88 48.172 27.614 23.784 683 HD3 LYS 88 HD3 LYS 88 47.538 28.410 22.335 684 HE2 LYS 88 HE2 LYS 88 48.159 26.142 21.811 685 HE3 LYS 88 HE3 LYS 88 49.188 27.274 20.931 686 HZ1 LYS 88 HZ1 LYS 88 49.990 25.976 23.486 687 HZ2 LYS 88 HZ2 LYS 88 50.435 25.384 22.014 688 HZ3 LYS 88 HZ3 LYS 88 50.952 26.860 22.508 689 H GLU 89 H GLU 89 47.386 31.651 26.332 690 HA GLU 89 HA GLU 89 49.375 33.616 27.275 691 HB2 GLU 89 HB2 GLU 89 46.346 33.621 27.305 692 HB3 GLU 89 HB3 GLU 89 47.355 34.969 27.820 693 HG2 GLU 89 HG2 GLU 89 47.478 33.814 24.993 694 HG3 GLU 89 HG3 GLU 89 46.405 35.113 25.477 695 H GLY 90 H GLY 90 48.464 30.783 28.652 696 HA2 GLY 90 HA2 GLY 90 49.113 29.995 30.717 697 HA3 GLY 90 HA3 GLY 90 49.596 31.624 31.171 698 H LYS 91 H LYS 91 46.354 31.822 30.264 699 HA LYS 91 HA LYS 91 45.605 32.140 33.104 700 HB2 LYS 91 HB2 LYS 91 44.565 33.137 30.424 701 HB3 LYS 91 HB3 LYS 91 43.660 33.327 31.918 702 HG2 LYS 91 HG2 LYS 91 45.713 34.439 32.942 703 HG3 LYS 91 HG3 LYS 91 46.430 34.444 31.331 704 HD2 LYS 91 HD2 LYS 91 43.864 35.844 32.186 705 HD3 LYS 91 HD3 LYS 91 45.431 36.607 31.890 706 HE2 LYS 91 HE2 LYS 91 45.305 35.812 29.493 707 HE3 LYS 91 HE3 LYS 91 43.673 35.208 29.822 708 HZ1 LYS 91 HZ1 LYS 91 43.537 37.383 28.873 709 HZ2 LYS 91 HZ2 LYS 91 43.076 37.516 30.454 710 HZ3 LYS 91 HZ3 LYS 91 44.565 38.027 29.989 711 H LEU 92 H LEU 92 45.099 29.812 30.652 712 HA LEU 92 HA LEU 92 42.559 28.783 31.747 713 HB2 LEU 92 HB2 LEU 92 43.429 28.661 29.290 714 HB3 LEU 92 HB3 LEU 92 44.594 27.487 29.868 715 HG LEU 92 HG LEU 92 42.663 26.050 30.609 716 HD11 LEU 92 HD11 LEU 92 40.460 26.481 29.582 717 HD12 LEU 92 HD12 LEU 92 40.888 27.719 30.774 718 HD13 LEU 92 HD13 LEU 92 41.032 28.069 29.037 719 HD21 LEU 92 HD21 LEU 92 43.807 25.622 28.482 720 HD22 LEU 92 HD22 LEU 92 42.077 25.277 28.331 721 HD23 LEU 92 HD23 LEU 92 42.741 26.783 27.658 722 H ASP 93 H ASP 93 45.994 28.227 32.213 723 HA ASP 93 HA ASP 93 45.711 26.071 34.136 724 HB2 ASP 93 HB2 ASP 93 47.804 28.240 33.675 725 HB3 ASP 93 HB3 ASP 93 47.904 27.038 34.946 726 H GLY 94 H GLY 94 45.915 29.664 34.439 727 HA2 GLY 94 HA2 GLY 94 45.536 29.845 37.235 728 HA3 GLY 94 HA3 GLY 94 45.199 31.122 36.063 729 H LEU 95 H LEU 95 43.060 29.425 34.726 730 HA LEU 95 HA LEU 95 40.829 29.945 36.526 731 HB2 LEU 95 HB2 LEU 95 41.145 28.794 33.744 732 HB3 LEU 95 HB3 LEU 95 39.591 28.761 34.575 733 HG LEU 95 HG LEU 95 41.147 31.356 34.250 734 HD11 LEU 95 HD11 LEU 95 39.019 30.282 32.360 735 HD12 LEU 95 HD12 LEU 95 39.797 31.872 32.293 736 HD13 LEU 95 HD13 LEU 95 40.757 30.419 31.997 737 HD21 LEU 95 HD21 LEU 95 38.183 30.801 34.694 738 HD22 LEU 95 HD22 LEU 95 39.323 31.414 35.910 739 HD23 LEU 95 HD23 LEU 95 38.932 32.396 34.498 740 H LEU 96 H LEU 96 42.790 27.111 35.819 741 HA LEU 96 HA LEU 96 41.125 25.457 37.655 742 HB2 LEU 96 HB2 LEU 96 43.746 24.815 36.257 743 HB3 LEU 96 HB3 LEU 96 42.883 23.682 37.291 744 HG LEU 96 HG LEU 96 41.987 24.747 34.626 745 HD11 LEU 96 HD11 LEU 96 42.357 21.941 35.822 746 HD12 LEU 96 HD12 LEU 96 42.066 22.291 34.121 747 HD13 LEU 96 HD13 LEU 96 43.594 22.760 34.882 748 HD21 LEU 96 HD21 LEU 96 39.927 23.302 34.978 749 HD22 LEU 96 HD22 LEU 96 40.363 23.202 36.690 750 HD23 LEU 96 HD23 LEU 96 39.963 24.769 35.944 751 H SER 97 H SER 97 42.883 27.983 38.393 752 HA SER 97 HA SER 97 43.968 26.825 40.923 753 HB2 SER 97 HB2 SER 97 44.500 29.415 39.492 754 HB3 SER 97 HB3 SER 97 44.752 29.292 41.238 755 HG SER 97 HG SER 97 46.259 27.862 40.991 Start of MODEL 12 1 H1 GLY 1 H1 GLY 1 21.701 38.051 34.212 2 H2 GLY 1 H2 GLY 1 21.542 38.287 32.586 3 H3 GLY 1 H3 GLY 1 21.575 36.770 33.201 4 HA2 GLY 1 HA2 GLY 1 19.463 38.765 33.693 5 HA3 GLY 1 HA3 GLY 1 19.322 37.365 32.615 6 H ALA 2 H ALA 2 17.411 36.958 34.029 7 HA ALA 2 HA ALA 2 18.155 35.120 36.247 8 HB1 ALA 2 HB1 ALA 2 16.199 37.444 36.510 9 HB2 ALA 2 HB2 ALA 2 16.494 36.195 37.739 10 HB3 ALA 2 HB3 ALA 2 17.788 37.313 37.290 11 H MET 3 H MET 3 16.555 35.281 33.403 12 HA MET 3 HA MET 3 14.084 33.889 34.099 13 HB2 MET 3 HB2 MET 3 14.153 35.412 32.245 14 HB3 MET 3 HB3 MET 3 15.466 34.534 31.472 15 HG2 MET 3 HG2 MET 3 12.744 33.298 31.973 16 HG3 MET 3 HG3 MET 3 13.103 34.252 30.544 17 HE1 MET 3 HE1 MET 3 12.155 31.026 31.032 18 HE2 MET 3 HE2 MET 3 12.002 31.901 29.489 19 HE3 MET 3 HE3 MET 3 12.871 30.350 29.556 20 HA PRO 4 HA PRO 4 16.116 30.011 34.700 21 HB2 PRO 4 HB2 PRO 4 14.068 28.189 34.398 22 HB3 PRO 4 HB3 PRO 4 14.267 29.267 35.808 23 HG2 PRO 4 HG2 PRO 4 12.528 29.723 33.363 24 HG3 PRO 4 HG3 PRO 4 12.071 29.867 35.093 25 HD2 PRO 4 HD2 PRO 4 12.748 32.050 33.676 26 HD3 PRO 4 HD3 PRO 4 13.349 31.864 35.349 27 H SER 5 H SER 5 17.596 29.676 33.200 28 HA SER 5 HA SER 5 17.185 28.022 30.898 29 HB2 SER 5 HB2 SER 5 17.981 29.658 29.207 30 HB3 SER 5 HB3 SER 5 16.377 29.998 29.767 31 HG SER 5 HG SER 5 17.297 31.491 31.313 32 H ILE 6 H ILE 6 19.423 28.593 29.463 33 HA ILE 6 HA ILE 6 20.970 26.756 30.647 34 HB ILE 6 HB ILE 6 22.432 26.831 28.943 35 HG12 ILE 6 HG12 ILE 6 21.926 29.756 28.454 36 HG13 ILE 6 HG13 ILE 6 23.430 28.999 28.951 37 HG21 ILE 6 HG21 ILE 6 19.974 28.116 27.706 38 HG22 ILE 6 HG22 ILE 6 21.045 26.879 27.034 39 HG23 ILE 6 HG23 ILE 6 20.005 26.480 28.415 40 HD11 ILE 6 HD11 ILE 6 22.082 28.699 26.225 41 HD12 ILE 6 HD12 ILE 6 23.582 29.567 26.606 42 HD13 ILE 6 HD13 ILE 6 23.501 27.795 26.729 43 H ALA 7 H ALA 7 21.404 30.105 31.233 44 HA ALA 7 HA ALA 7 24.014 30.305 32.300 45 HB1 ALA 7 HB1 ALA 7 21.401 31.534 33.266 46 HB2 ALA 7 HB2 ALA 7 23.029 32.082 33.730 47 HB3 ALA 7 HB3 ALA 7 22.507 32.190 32.039 48 H SER 8 H SER 8 21.093 28.861 33.839 49 HA SER 8 HA SER 8 22.173 28.253 36.406 50 HB2 SER 8 HB2 SER 8 20.178 26.621 34.788 51 HB3 SER 8 HB3 SER 8 20.338 26.668 36.555 52 HG SER 8 HG SER 8 18.642 27.959 35.398 53 H MET 9 H MET 9 22.460 26.545 33.293 54 HA MET 9 HA MET 9 23.578 24.083 34.369 55 HB2 MET 9 HB2 MET 9 23.785 25.093 31.509 56 HB3 MET 9 HB3 MET 9 23.936 23.441 32.093 57 HG2 MET 9 HG2 MET 9 21.531 23.475 32.756 58 HG3 MET 9 HG3 MET 9 21.388 25.107 32.117 59 HE1 MET 9 HE1 MET 9 19.350 23.017 29.519 60 HE2 MET 9 HE2 MET 9 19.437 22.834 31.283 61 HE3 MET 9 HE3 MET 9 19.357 24.457 30.559 62 H ILE 10 H ILE 10 24.915 27.128 33.077 63 HA ILE 10 HA ILE 10 27.647 26.318 32.870 64 HB ILE 10 HB ILE 10 26.828 29.148 33.598 65 HG12 ILE 10 HG12 ILE 10 25.292 28.611 31.848 66 HG13 ILE 10 HG13 ILE 10 26.528 29.660 31.212 67 HG21 ILE 10 HG21 ILE 10 29.095 27.916 32.001 68 HG22 ILE 10 HG22 ILE 10 28.706 29.654 31.981 69 HG23 ILE 10 HG23 ILE 10 29.179 28.875 33.489 70 HD11 ILE 10 HD11 ILE 10 25.947 27.961 29.586 71 HD12 ILE 10 HD12 ILE 10 27.616 27.681 30.115 72 HD13 ILE 10 HD13 ILE 10 26.301 26.652 30.725 73 H LYS 11 H LYS 11 25.713 27.030 35.615 74 HA LYS 11 HA LYS 11 27.943 27.391 37.505 75 HB2 LYS 11 HB2 LYS 11 24.954 27.404 37.866 76 HB3 LYS 11 HB3 LYS 11 26.156 27.733 39.130 77 HG2 LYS 11 HG2 LYS 11 27.104 29.595 37.795 78 HG3 LYS 11 HG3 LYS 11 25.936 29.297 36.497 79 HD2 LYS 11 HD2 LYS 11 24.085 29.726 38.018 80 HD3 LYS 11 HD3 LYS 11 25.251 30.016 39.335 81 HE2 LYS 11 HE2 LYS 11 26.240 31.900 38.087 82 HE3 LYS 11 HE3 LYS 11 25.174 31.573 36.705 83 HZ1 LYS 11 HZ1 LYS 11 24.245 32.395 39.399 84 HZ2 LYS 11 HZ2 LYS 11 24.353 33.374 38.074 85 HZ3 LYS 11 HZ3 LYS 11 23.287 32.127 38.083 86 H GLY 12 H GLY 12 26.658 24.696 36.064 87 HA2 GLY 12 HA2 GLY 12 26.630 22.857 38.336 88 HA3 GLY 12 HA3 GLY 12 26.532 22.444 36.625 89 H ASN 13 H ASN 13 28.811 23.292 35.489 90 HA ASN 13 HA ASN 13 31.007 21.967 37.017 91 HB2 ASN 13 HB2 ASN 13 30.329 21.845 34.057 92 HB3 ASN 13 HB3 ASN 13 31.886 21.354 34.701 93 HD21 ASN 13 HD21 ASN 13 28.435 20.511 34.635 94 HD22 ASN 13 HD22 ASN 13 28.746 18.834 35.130 95 H LYS 14 H LYS 14 33.190 22.545 36.409 96 HA LYS 14 HA LYS 14 33.756 25.390 36.465 97 HB2 LYS 14 HB2 LYS 14 35.187 23.442 37.345 98 HB3 LYS 14 HB3 LYS 14 35.608 23.088 35.684 99 HG2 LYS 14 HG2 LYS 14 37.361 24.469 35.954 100 HG3 LYS 14 HG3 LYS 14 36.210 25.785 35.801 101 HD2 LYS 14 HD2 LYS 14 37.395 26.321 37.734 102 HD3 LYS 14 HD3 LYS 14 35.916 25.594 38.378 103 HE2 LYS 14 HE2 LYS 14 37.161 23.411 38.619 104 HE3 LYS 14 HE3 LYS 14 38.619 24.205 38.020 105 HZ1 LYS 14 HZ1 LYS 14 37.178 24.899 40.526 106 HZ2 LYS 14 HZ2 LYS 14 38.615 24.140 40.434 107 HZ3 LYS 14 HZ3 LYS 14 38.490 25.714 39.970 108 H VAL 15 H VAL 15 34.064 22.922 33.869 109 HA VAL 15 HA VAL 15 33.685 25.099 31.859 110 HB VAL 15 HB VAL 15 35.171 22.502 31.422 111 HG11 VAL 15 HG11 VAL 15 35.767 23.594 29.247 112 HG12 VAL 15 HG12 VAL 15 34.047 23.239 29.378 113 HG13 VAL 15 HG13 VAL 15 34.624 24.902 29.611 114 HG21 VAL 15 HG21 VAL 15 36.034 25.367 31.928 115 HG22 VAL 15 HG22 VAL 15 36.599 23.884 32.720 116 HG23 VAL 15 HG23 VAL 15 37.057 24.238 31.040 117 H VAL 16 H VAL 16 32.002 25.099 30.642 118 HA VAL 16 HA VAL 16 30.405 22.605 30.205 119 HB VAL 16 HB VAL 16 29.276 25.376 30.736 120 HG11 VAL 16 HG11 VAL 16 27.892 22.748 30.015 121 HG12 VAL 16 HG12 VAL 16 27.068 24.222 30.568 122 HG13 VAL 16 HG13 VAL 16 27.923 24.229 29.028 123 HG21 VAL 16 HG21 VAL 16 29.933 24.246 32.815 124 HG22 VAL 16 HG22 VAL 16 28.177 24.190 32.653 125 HG23 VAL 16 HG23 VAL 16 29.132 22.749 32.277 126 H VAL 17 H VAL 17 30.126 22.165 28.075 127 HA VAL 17 HA VAL 17 30.522 24.375 26.076 128 HB VAL 17 HB VAL 17 31.555 21.524 26.003 129 HG11 VAL 17 HG11 VAL 17 31.856 23.651 23.853 130 HG12 VAL 17 HG12 VAL 17 32.596 22.024 23.871 131 HG13 VAL 17 HG13 VAL 17 30.851 22.192 23.736 132 HG21 VAL 17 HG21 VAL 17 32.959 24.193 26.161 133 HG22 VAL 17 HG22 VAL 17 32.961 22.894 27.367 134 HG23 VAL 17 HG23 VAL 17 33.773 22.649 25.820 135 H PHE 18 H PHE 18 29.202 24.372 24.233 136 HA PHE 18 HA PHE 18 27.000 22.320 24.127 137 HB2 PHE 18 HB2 PHE 18 26.778 25.214 23.276 138 HB3 PHE 18 HB3 PHE 18 25.535 23.988 23.188 139 HD1 PHE 18 HD2 PHE 18 27.473 26.181 25.446 140 HD2 PHE 18 HD1 PHE 18 24.204 23.392 25.166 141 HE1 PHE 18 HE2 PHE 18 26.565 27.030 27.589 142 HE2 PHE 18 HE1 PHE 18 23.295 24.243 27.323 143 HZ PHE 18 HZ PHE 18 24.444 26.125 28.497 144 H SER 19 H SER 19 27.083 21.139 22.326 145 HA SER 19 HA SER 19 28.614 22.034 19.907 146 HB2 SER 19 HB2 SER 19 29.088 19.544 21.593 147 HB3 SER 19 HB3 SER 19 29.813 19.862 20.010 148 HG SER 19 HG SER 19 31.247 20.520 21.500 149 H TRP 20 H TRP 20 28.670 20.346 18.173 150 HA TRP 20 HA TRP 20 26.155 18.708 18.021 151 HB2 TRP 20 HB2 TRP 20 27.620 20.261 15.884 152 HB3 TRP 20 HB3 TRP 20 26.616 18.887 15.495 153 HD1 TRP 20 HD1 TRP 20 24.780 20.588 18.153 154 HE1 TRP 20 HE1 TRP 20 22.758 21.813 17.120 155 HE3 TRP 20 HE3 TRP 20 26.289 20.763 13.251 156 HZ2 TRP 20 HZ2 TRP 20 21.991 22.885 14.606 157 HZ3 TRP 20 HZ3 TRP 20 24.876 21.931 11.566 158 HH2 TRP 20 HH2 TRP 20 22.736 22.982 12.227 159 H VAL 21 H VAL 21 26.373 16.612 17.642 160 HA VAL 21 HA VAL 21 29.018 15.374 17.135 161 HB VAL 21 HB VAL 21 26.312 14.086 17.614 162 HG11 VAL 21 HG11 VAL 21 29.102 12.852 17.551 163 HG12 VAL 21 HG12 VAL 21 27.588 12.010 17.928 164 HG13 VAL 21 HG13 VAL 21 27.849 12.636 16.303 165 HG21 VAL 21 HG21 VAL 21 27.279 13.439 19.814 166 HG22 VAL 21 HG22 VAL 21 28.700 14.450 19.475 167 HG23 VAL 21 HG23 VAL 21 27.093 15.183 19.650 168 H THR 22 H THR 22 28.228 14.963 13.598 169 HA THR 22 HA THR 22 30.358 15.255 15.667 170 HB THR 22 HB THR 22 31.877 14.198 14.132 171 HG1 THR 22 HG1 THR 22 29.565 13.798 12.527 172 HG21 THR 22 HG21 THR 22 30.668 12.825 15.806 173 HG22 THR 22 HG22 THR 22 31.103 11.919 14.360 174 HG23 THR 22 HG23 THR 22 29.428 12.448 14.578 175 H CYS 23 H CYS 23 31.928 16.781 15.437 176 HA CYS 23 HA CYS 23 31.711 18.729 13.181 177 HB2 CYS 23 HB2 CYS 23 30.398 19.606 15.020 178 HB3 CYS 23 HB3 CYS 23 31.700 19.280 16.161 179 HG CYS 23 HG CYS 23 31.599 21.376 13.579 180 HA PRO 24 HA PRO 24 36.148 17.981 13.488 181 HB2 PRO 24 HB2 PRO 24 36.378 20.185 11.483 182 HB3 PRO 24 HB3 PRO 24 37.076 18.550 11.457 183 HG2 PRO 24 HG2 PRO 24 34.914 19.160 9.921 184 HG3 PRO 24 HG3 PRO 24 35.014 17.582 10.771 185 HD2 PRO 24 HD2 PRO 24 33.529 20.084 11.633 186 HD3 PRO 24 HD3 PRO 24 32.968 18.383 11.587 187 H TYR 25 H TYR 25 34.628 21.012 14.317 188 HA TYR 25 HA TYR 25 37.080 21.903 15.711 189 HB2 TYR 25 HB2 TYR 25 34.248 23.005 15.690 190 HB3 TYR 25 HB3 TYR 25 35.563 23.680 16.620 191 HD1 TYR 25 HD2 TYR 25 37.899 23.709 14.912 192 HD2 TYR 25 HD1 TYR 25 33.765 24.547 13.958 193 HE1 TYR 25 HE2 TYR 25 38.620 25.182 13.048 194 HE2 TYR 25 HE1 TYR 25 34.500 25.985 12.078 195 HH TYR 25 HH TYR 25 36.272 26.786 10.892 196 H CYS 26 H CYS 26 33.960 20.385 16.635 197 HA CYS 26 HA CYS 26 34.385 20.719 19.417 198 HB2 CYS 26 HB2 CYS 26 32.254 20.243 18.353 199 HB3 CYS 26 HB3 CYS 26 32.727 18.584 18.007 200 HG CYS 26 HG CYS 26 33.106 17.798 20.500 201 H VAL 27 H VAL 27 35.490 18.105 17.319 202 HA VAL 27 HA VAL 27 36.675 16.296 19.085 203 HB VAL 27 HB VAL 27 36.546 16.237 16.771 204 HG11 VAL 27 HG11 VAL 27 38.852 17.867 16.162 205 HG12 VAL 27 HG12 VAL 27 37.714 17.026 15.098 206 HG13 VAL 27 HG13 VAL 27 37.115 18.354 16.093 207 HG21 VAL 27 HG21 VAL 27 38.626 14.964 16.311 208 HG22 VAL 27 HG22 VAL 27 39.451 15.847 17.621 209 HG23 VAL 27 HG23 VAL 27 38.144 14.695 17.994 210 H ARG 28 H ARG 28 38.077 18.864 17.582 211 HA ARG 28 HA ARG 28 40.608 19.123 18.861 212 HB2 ARG 28 HB2 ARG 28 39.194 21.707 18.100 213 HB3 ARG 28 HB3 ARG 28 40.921 21.374 18.180 214 HG2 ARG 28 HG2 ARG 28 40.542 19.657 16.319 215 HG3 ARG 28 HG3 ARG 28 38.916 20.358 16.184 216 HD2 ARG 28 HD2 ARG 28 39.905 22.577 15.718 217 HD3 ARG 28 HD3 ARG 28 41.526 21.854 15.755 218 HE ARG 28 HE ARG 28 40.079 20.303 13.939 219 HH11 ARG 28 HH22 ARG 28 40.839 23.767 13.999 220 HH12 ARG 28 HH21 ARG 28 40.563 23.868 12.258 221 HH21 ARG 28 HH12 ARG 28 40.056 20.567 11.727 222 HH22 ARG 28 HH11 ARG 28 40.376 22.139 11.043 223 H ALA 29 H ALA 29 37.657 20.772 19.949 224 HA ALA 29 HA ALA 29 38.817 21.814 22.390 225 HB1 ALA 29 HB1 ALA 29 36.425 22.152 23.063 226 HB2 ALA 29 HB2 ALA 29 36.847 22.860 21.506 227 HB3 ALA 29 HB3 ALA 29 35.923 21.338 21.566 228 H GLU 30 H GLU 30 36.687 18.903 21.875 229 HA GLU 30 HA GLU 30 36.729 18.004 24.590 230 HB2 GLU 30 HB2 GLU 30 36.476 16.496 21.953 231 HB3 GLU 30 HB3 GLU 30 36.320 15.740 23.538 232 HG2 GLU 30 HG2 GLU 30 34.351 17.234 24.016 233 HG3 GLU 30 HG3 GLU 30 34.478 17.867 22.382 234 H LYS 31 H LYS 31 39.136 17.559 22.079 235 HA LYS 31 HA LYS 31 40.699 15.649 23.564 236 HB2 LYS 31 HB2 LYS 31 40.811 15.808 21.127 237 HB3 LYS 31 HB3 LYS 31 41.208 17.524 21.218 238 HG2 LYS 31 HG2 LYS 31 43.425 16.937 22.219 239 HG3 LYS 31 HG3 LYS 31 43.007 15.222 22.064 240 HD2 LYS 31 HD2 LYS 31 44.372 15.850 20.171 241 HD3 LYS 31 HD3 LYS 31 42.714 15.567 19.597 242 HE2 LYS 31 HE2 LYS 31 42.270 17.942 19.463 243 HE3 LYS 31 HE3 LYS 31 43.825 18.337 20.242 244 HZ1 LYS 31 HZ1 LYS 31 43.395 17.155 17.560 245 HZ2 LYS 31 HZ2 LYS 31 44.052 18.616 17.884 246 HZ3 LYS 31 HZ3 LYS 31 44.880 17.234 18.251 247 H LEU 32 H LEU 32 41.112 19.157 22.974 248 HA LEU 32 HA LEU 32 43.388 19.605 24.603 249 HB2 LEU 32 HB2 LEU 32 42.272 21.032 22.837 250 HB3 LEU 32 HB3 LEU 32 41.043 21.400 24.038 251 HG LEU 32 HG LEU 32 42.659 23.179 23.612 252 HD11 LEU 32 HD11 LEU 32 43.044 22.308 26.478 253 HD12 LEU 32 HD12 LEU 32 43.068 23.941 25.809 254 HD13 LEU 32 HD13 LEU 32 41.541 23.038 25.845 255 HD21 LEU 32 HD21 LEU 32 44.966 23.096 24.325 256 HD22 LEU 32 HD22 LEU 32 44.767 21.433 24.922 257 HD23 LEU 32 HD23 LEU 32 44.645 21.777 23.183 258 H LEU 33 H LEU 33 39.913 19.856 25.409 259 HA LEU 33 HA LEU 33 40.246 20.872 28.026 260 HB2 LEU 33 HB2 LEU 33 38.009 19.267 26.707 261 HB3 LEU 33 HB3 LEU 33 37.836 19.966 28.311 262 HG LEU 33 HG LEU 33 38.493 21.591 25.831 263 HD11 LEU 33 HD11 LEU 33 36.218 20.560 25.689 264 HD12 LEU 33 HD12 LEU 33 35.783 21.542 27.117 265 HD13 LEU 33 HD13 LEU 33 36.294 22.326 25.621 266 HD21 LEU 33 HD21 LEU 33 37.673 23.507 27.251 267 HD22 LEU 33 HD22 LEU 33 37.634 22.388 28.624 268 HD23 LEU 33 HD23 LEU 33 39.177 22.776 27.818 269 H HIS 34 H HIS 34 40.047 17.500 26.923 270 HA HIS 34 HA HIS 34 40.425 16.353 29.577 271 HB2 HIS 34 HB2 HIS 34 40.503 15.301 26.723 272 HB3 HIS 34 HB3 HIS 34 40.982 14.309 28.093 273 HD1 HIS 34 HD1 HIS 34 39.126 12.707 28.711 274 HD2 HIS 34 HD2 HIS 34 37.737 16.461 27.422 275 HE1 HIS 34 HE1 HIS 34 36.596 12.518 28.564 276 H ALA 35 H ALA 35 42.641 17.266 26.845 277 HA ALA 35 HA ALA 35 44.847 15.774 27.946 278 HB1 ALA 35 HB1 ALA 35 46.177 17.025 26.288 279 HB2 ALA 35 HB2 ALA 35 44.672 16.427 25.574 280 HB3 ALA 35 HB3 ALA 35 44.821 18.141 26.019 281 H ARG 36 H ARG 36 43.694 19.008 28.442 282 HA ARG 36 HA ARG 36 45.921 19.742 30.286 283 HB2 ARG 36 HB2 ARG 36 44.304 21.293 28.297 284 HB3 ARG 36 HB3 ARG 36 45.266 22.067 29.558 285 HG2 ARG 36 HG2 ARG 36 46.585 20.070 27.703 286 HG3 ARG 36 HG3 ARG 36 46.362 21.747 27.203 287 HD2 ARG 36 HD2 ARG 36 47.652 21.033 29.862 288 HD3 ARG 36 HD3 ARG 36 48.589 21.164 28.359 289 HE ARG 36 HE ARG 36 47.512 23.490 28.159 290 HH11 ARG 36 HH12 ARG 36 48.368 22.343 31.416 291 HH12 ARG 36 HH11 ARG 36 48.005 23.958 32.045 292 HH21 ARG 36 HH22 ARG 36 47.410 25.319 28.982 293 HH22 ARG 36 HH21 ARG 36 47.646 25.636 30.712 294 H THR 37 H THR 37 43.468 18.500 30.885 295 HA THR 37 HA THR 37 42.382 18.074 32.815 296 HB THR 37 HB THR 37 43.544 20.217 34.412 297 HG1 THR 37 HG1 THR 37 45.241 18.385 33.069 298 HG21 THR 37 HG21 THR 37 43.778 17.180 34.613 299 HG22 THR 37 HG22 THR 37 42.557 18.187 35.423 300 HG23 THR 37 HG23 THR 37 44.266 18.352 35.861 301 H LYS 38 H LYS 38 40.880 19.907 31.203 302 HA LYS 38 HA LYS 38 39.626 21.770 33.168 303 HB2 LYS 38 HB2 LYS 38 39.229 21.155 30.237 304 HB3 LYS 38 HB3 LYS 38 37.892 21.809 31.175 305 HG2 LYS 38 HG2 LYS 38 39.149 23.634 30.087 306 HG3 LYS 38 HG3 LYS 38 39.146 23.743 31.836 307 HD2 LYS 38 HD2 LYS 38 41.246 24.408 31.219 308 HD3 LYS 38 HD3 LYS 38 41.484 22.787 31.841 309 HE2 LYS 38 HE2 LYS 38 41.808 21.877 29.638 310 HE3 LYS 38 HE3 LYS 38 41.270 23.397 28.872 311 HZ1 LYS 38 HZ1 LYS 38 43.722 22.976 30.478 312 HZ2 LYS 38 HZ2 LYS 38 43.680 23.470 28.901 313 HZ3 LYS 38 HZ3 LYS 38 43.202 24.475 30.043 314 H ASP 39 H ASP 39 38.595 20.803 34.789 315 HA ASP 39 HA ASP 39 37.006 18.509 34.502 316 HB2 ASP 39 HB2 ASP 39 37.629 19.420 36.695 317 HB3 ASP 39 HB3 ASP 39 36.475 20.745 36.465 318 H ILE 40 H ILE 40 35.650 18.219 33.048 319 HA ILE 40 HA ILE 40 34.025 20.444 31.927 320 HB ILE 40 HB ILE 40 36.146 19.859 30.827 321 HG12 ILE 40 HG12 ILE 40 33.643 20.358 29.533 322 HG13 ILE 40 HG13 ILE 40 35.246 20.922 29.182 323 HG21 ILE 40 HG21 ILE 40 34.875 17.216 30.023 324 HG22 ILE 40 HG22 ILE 40 36.486 17.827 29.578 325 HG23 ILE 40 HG23 ILE 40 36.134 17.418 31.248 326 HD11 ILE 40 HD11 ILE 40 34.077 18.304 28.130 327 HD12 ILE 40 HD12 ILE 40 34.186 19.828 27.242 328 HD13 ILE 40 HD13 ILE 40 35.673 18.993 27.711 329 H THR 41 H THR 41 32.086 20.195 31.020 330 HA THR 41 HA THR 41 31.093 17.513 30.273 331 HB THR 41 HB THR 41 29.806 19.309 32.271 332 HG1 THR 41 HG1 THR 41 30.582 17.268 32.736 333 HG21 THR 41 HG21 THR 41 27.537 18.501 31.776 334 HG22 THR 41 HG22 THR 41 28.094 17.864 30.211 335 HG23 THR 41 HG23 THR 41 28.140 19.617 30.546 336 H VAL 42 H VAL 42 30.129 17.509 28.294 337 HA VAL 42 HA VAL 42 29.413 20.111 27.081 338 HB VAL 42 HB VAL 42 31.268 19.609 25.942 339 HG11 VAL 42 HG11 VAL 42 31.977 17.619 24.913 340 HG12 VAL 42 HG12 VAL 42 31.979 17.666 26.669 341 HG13 VAL 42 HG13 VAL 42 30.687 16.741 25.807 342 HG21 VAL 42 HG21 VAL 42 29.399 20.087 24.369 343 HG22 VAL 42 HG22 VAL 42 30.689 19.120 23.644 344 HG23 VAL 42 HG23 VAL 42 29.185 18.333 24.153 345 H HIS 43 H HIS 43 27.587 20.382 26.161 346 HA HIS 43 HA HIS 43 25.517 18.255 26.271 347 HB2 HIS 43 HB2 HIS 43 25.589 21.269 26.491 348 HB3 HIS 43 HB3 HIS 43 24.141 20.497 25.917 349 HD1 HIS 43 HD1 HIS 43 22.557 19.527 27.788 350 HD2 HIS 43 HD2 HIS 43 26.468 20.373 29.064 351 HE1 HIS 43 HE1 HIS 43 22.559 19.248 30.323 352 H TYR 44 H TYR 44 24.789 17.381 24.421 353 HA TYR 44 HA TYR 44 25.763 18.499 21.849 354 HB2 TYR 44 HB2 TYR 44 24.689 15.758 22.533 355 HB3 TYR 44 HB3 TYR 44 25.218 16.271 20.936 356 HD1 TYR 44 HD2 TYR 44 27.715 17.611 21.180 357 HD2 TYR 44 HD1 TYR 44 26.233 14.269 23.475 358 HE1 TYR 44 HE2 TYR 44 30.053 16.955 21.716 359 HE2 TYR 44 HE1 TYR 44 28.582 13.656 24.066 360 HH TYR 44 HH TYR 44 31.412 15.426 22.769 361 H VAL 45 H VAL 45 24.345 20.164 21.452 362 HA VAL 45 HA VAL 45 21.501 19.856 21.834 363 HB VAL 45 HB VAL 45 21.252 22.088 20.904 364 HG11 VAL 45 HG11 VAL 45 23.587 21.918 22.853 365 HG12 VAL 45 HG12 VAL 45 22.455 23.269 22.643 366 HG13 VAL 45 HG13 VAL 45 21.877 21.722 23.288 367 HG21 VAL 45 HG21 VAL 45 22.986 22.105 19.173 368 HG22 VAL 45 HG22 VAL 45 23.219 23.441 20.299 369 HG23 VAL 45 HG23 VAL 45 24.265 22.015 20.406 370 H ASP 46 H ASP 46 23.339 18.729 19.270 371 HA ASP 46 HA ASP 46 21.229 18.660 17.240 372 HB2 ASP 46 HB2 ASP 46 23.684 18.475 16.771 373 HB3 ASP 46 HB3 ASP 46 23.717 16.936 17.620 374 H LYS 47 H LYS 47 21.872 16.954 20.156 375 HA LYS 47 HA LYS 47 20.136 14.596 19.504 376 HB2 LYS 47 HB2 LYS 47 22.234 14.994 21.683 377 HB3 LYS 47 HB3 LYS 47 21.334 13.528 21.405 378 HG2 LYS 47 HG2 LYS 47 23.124 14.672 19.213 379 HG3 LYS 47 HG3 LYS 47 23.823 13.814 20.570 380 HD2 LYS 47 HD2 LYS 47 21.718 12.601 18.732 381 HD3 LYS 47 HD3 LYS 47 23.473 12.403 18.562 382 HE2 LYS 47 HE2 LYS 47 23.509 11.548 20.974 383 HE3 LYS 47 HE3 LYS 47 21.736 11.496 20.893 384 HZ1 LYS 47 HZ1 LYS 47 22.612 9.345 20.294 385 HZ2 LYS 47 HZ2 LYS 47 21.997 10.011 18.910 386 HZ3 LYS 47 HZ3 LYS 47 23.616 9.990 19.182 387 H MET 48 H MET 48 20.860 17.011 22.030 388 HA MET 48 HA MET 48 18.820 16.183 23.862 389 HB2 MET 48 HB2 MET 48 20.951 17.301 24.450 390 HB3 MET 48 HB3 MET 48 20.426 18.765 23.616 391 HG2 MET 48 HG2 MET 48 18.575 19.025 25.235 392 HG3 MET 48 HG3 MET 48 19.087 17.539 26.052 393 HE1 MET 48 HE1 MET 48 20.032 20.312 28.662 394 HE2 MET 48 HE2 MET 48 18.658 20.393 27.549 395 HE3 MET 48 HE3 MET 48 19.072 18.851 28.327 396 H SER 49 H SER 49 16.665 16.556 23.748 397 HA SER 49 HA SER 49 15.353 17.862 21.647 398 HB2 SER 49 HB2 SER 49 14.279 17.411 24.465 399 HB3 SER 49 HB3 SER 49 13.327 17.600 22.981 400 HG SER 49 HG SER 49 14.056 15.392 23.954 401 H GLU 50 H GLU 50 16.023 19.144 24.901 402 HA GLU 50 HA GLU 50 14.781 21.703 24.476 403 HB2 GLU 50 HB2 GLU 50 16.661 20.565 26.560 404 HB3 GLU 50 HB3 GLU 50 16.171 22.264 26.599 405 HG2 GLU 50 HG2 GLU 50 13.813 21.652 26.727 406 HG3 GLU 50 HG3 GLU 50 14.168 19.953 26.442 407 H GLY 51 H GLY 51 17.693 20.537 23.168 408 HA2 GLY 51 HA2 GLY 51 19.558 22.559 23.276 409 HA3 GLY 51 HA3 GLY 51 19.287 21.494 21.901 410 H GLU 52 H GLU 52 16.579 22.691 21.332 411 HA GLU 52 HA GLU 52 17.425 24.849 19.570 412 HB2 GLU 52 HB2 GLU 52 14.650 23.985 20.498 413 HB3 GLU 52 HB3 GLU 52 14.981 25.088 19.161 414 HG2 GLU 52 HG2 GLU 52 16.107 23.275 17.931 415 HG3 GLU 52 HG3 GLU 52 15.817 22.155 19.279 416 H GLN 53 H GLN 53 15.951 24.807 22.822 417 HA GLN 53 HA GLN 53 15.478 27.721 22.884 418 HB2 GLN 53 HB2 GLN 53 15.425 25.610 25.073 419 HB3 GLN 53 HB3 GLN 53 15.071 27.326 25.274 420 HG2 GLN 53 HG2 GLN 53 12.981 26.452 25.048 421 HG3 GLN 53 HG3 GLN 53 13.282 27.030 23.417 422 HE21 GLN 53 HE21 GLN 53 13.317 24.116 25.509 423 HE22 GLN 53 HE22 GLN 53 12.959 22.975 24.200 424 H LEU 54 H LEU 54 17.873 25.407 24.066 425 HA LEU 54 HA LEU 54 19.578 27.274 25.401 426 HB2 LEU 54 HB2 LEU 54 20.226 24.625 24.067 427 HB3 LEU 54 HB3 LEU 54 21.348 25.496 25.045 428 HG LEU 54 HG LEU 54 20.548 24.747 26.985 429 HD11 LEU 54 HD11 LEU 54 18.320 24.438 27.744 430 HD12 LEU 54 HD12 LEU 54 18.369 25.986 26.915 431 HD13 LEU 54 HD13 LEU 54 17.653 24.569 26.114 432 HD21 LEU 54 HD21 LEU 54 19.790 22.554 27.017 433 HD22 LEU 54 HD22 LEU 54 19.066 22.682 25.414 434 HD23 LEU 54 HD23 LEU 54 20.841 22.729 25.604 435 H ARG 55 H ARG 55 19.659 26.104 21.999 436 HA ARG 55 HA ARG 55 21.690 27.854 20.981 437 HB2 ARG 55 HB2 ARG 55 19.160 26.636 19.788 438 HB3 ARG 55 HB3 ARG 55 20.202 27.693 18.836 439 HG2 ARG 55 HG2 ARG 55 22.041 26.219 18.946 440 HG3 ARG 55 HG3 ARG 55 21.344 25.278 20.259 441 HD2 ARG 55 HD2 ARG 55 21.227 24.008 18.231 442 HD3 ARG 55 HD3 ARG 55 19.600 24.408 18.761 443 HE ARG 55 HE ARG 55 19.249 25.621 16.809 444 HH11 ARG 55 HH12 ARG 55 22.739 25.196 17.026 445 HH12 ARG 55 HH11 ARG 55 22.969 25.571 15.357 446 HH21 ARG 55 HH22 ARG 55 19.618 25.884 14.615 447 HH22 ARG 55 HH21 ARG 55 21.243 25.759 14.000 448 H GLY 56 H GLY 56 18.238 28.484 21.626 449 HA2 GLY 56 HA2 GLY 56 18.172 31.121 20.544 450 HA3 GLY 56 HA3 GLY 56 17.081 30.486 21.790 451 H GLU 57 H GLU 57 18.934 30.090 23.977 452 HA GLU 57 HA GLU 57 19.357 32.805 24.836 453 HB2 GLU 57 HB2 GLU 57 20.358 30.125 25.881 454 HB3 GLU 57 HB3 GLU 57 20.748 31.656 26.644 455 HG2 GLU 57 HG2 GLU 57 18.124 30.183 26.649 456 HG3 GLU 57 HG3 GLU 57 19.056 30.946 27.916 457 H ILE 58 H ILE 58 21.620 30.415 23.431 458 HA ILE 58 HA ILE 58 23.962 32.049 23.781 459 HB ILE 58 HB ILE 58 23.438 29.873 21.715 460 HG12 ILE 58 HG12 ILE 58 24.918 29.649 24.380 461 HG13 ILE 58 HG13 ILE 58 23.237 29.206 24.169 462 HG21 ILE 58 HG21 ILE 58 25.871 29.690 21.499 463 HG22 ILE 58 HG22 ILE 58 25.422 31.350 21.163 464 HG23 ILE 58 HG23 ILE 58 26.121 30.936 22.741 465 HD11 ILE 58 HD11 ILE 58 25.587 27.860 22.809 466 HD12 ILE 58 HD12 ILE 58 24.530 27.204 24.068 467 HD13 ILE 58 HD13 ILE 58 23.875 27.518 22.451 468 H TYR 59 H TYR 59 21.661 31.724 21.010 469 HA TYR 59 HA TYR 59 23.107 33.554 19.391 470 HB2 TYR 59 HB2 TYR 59 21.179 31.920 18.740 471 HB3 TYR 59 HB3 TYR 59 20.128 33.303 19.052 472 HD1 TYR 59 HD1 TYR 59 20.640 35.522 17.748 473 HD2 TYR 59 HD2 TYR 59 22.544 31.764 16.860 474 HE1 TYR 59 HE1 TYR 59 21.505 36.468 15.612 475 HE2 TYR 59 HE2 TYR 59 23.418 32.716 14.717 476 HH TYR 59 HH TYR 59 22.845 36.096 13.730 477 H GLN 60 H GLN 60 20.360 34.212 21.649 478 HA GLN 60 HA GLN 60 20.126 36.967 20.929 479 HB2 GLN 60 HB2 GLN 60 19.477 35.481 23.501 480 HB3 GLN 60 HB3 GLN 60 19.054 37.184 23.229 481 HG2 GLN 60 HG2 GLN 60 18.087 34.806 21.612 482 HG3 GLN 60 HG3 GLN 60 17.165 35.668 22.826 483 HE21 GLN 60 HE21 GLN 60 15.909 37.419 22.103 484 HE22 GLN 60 HE22 GLN 60 15.978 37.960 20.420 485 H ALA 61 H ALA 61 22.254 35.456 23.395 486 HA ALA 61 HA ALA 61 23.331 38.040 24.201 487 HB1 ALA 61 HB1 ALA 61 23.015 36.221 25.793 488 HB2 ALA 61 HB2 ALA 61 24.121 35.180 24.875 489 HB3 ALA 61 HB3 ALA 61 24.735 36.640 25.682 490 H TYR 62 H TYR 62 24.613 35.351 22.164 491 HA TYR 62 HA TYR 62 27.101 36.951 21.730 492 HB2 TYR 62 HB2 TYR 62 26.843 33.950 21.594 493 HB3 TYR 62 HB3 TYR 62 28.313 34.911 21.658 494 HD1 TYR 62 HD1 TYR 62 28.606 36.451 23.819 495 HD2 TYR 62 HD2 TYR 62 25.968 33.059 23.564 496 HE1 TYR 62 HE1 TYR 62 28.547 36.306 26.307 497 HE2 TYR 62 HE2 TYR 62 25.899 32.919 26.051 498 HH TYR 62 HH TYR 62 27.753 35.155 28.129 499 H LYS 63 H LYS 63 24.404 36.105 20.013 500 HA LYS 63 HA LYS 63 23.811 35.780 17.887 501 HB2 LYS 63 HB2 LYS 63 26.175 37.527 17.194 502 HB3 LYS 63 HB3 LYS 63 24.741 37.254 16.212 503 HG2 LYS 63 HG2 LYS 63 24.747 38.623 18.925 504 HG3 LYS 63 HG3 LYS 63 24.815 39.456 17.379 505 HD2 LYS 63 HD2 LYS 63 22.615 38.551 16.747 506 HD3 LYS 63 HD3 LYS 63 22.484 37.707 18.289 507 HE2 LYS 63 HE2 LYS 63 22.762 40.721 17.945 508 HE3 LYS 63 HE3 LYS 63 21.231 39.878 18.196 509 HZ1 LYS 63 HZ1 LYS 63 21.976 39.218 20.404 510 HZ2 LYS 63 HZ2 LYS 63 23.470 39.845 20.155 511 HZ3 LYS 63 HZ3 LYS 63 22.201 40.835 20.252 512 H HIS 64 H HIS 64 25.182 33.606 18.807 513 HA HIS 64 HA HIS 64 26.005 32.410 16.221 514 HB2 HIS 64 HB2 HIS 64 27.393 31.906 18.886 515 HB3 HIS 64 HB3 HIS 64 27.643 30.966 17.419 516 HD1 HIS 64 HD1 HIS 64 28.064 33.356 15.325 517 HD2 HIS 64 HD2 HIS 64 29.753 32.955 19.160 518 HE1 HIS 64 HE1 HIS 64 30.233 34.698 15.300 519 H GLU 65 H GLU 65 25.462 30.223 16.004 520 HA GLU 65 HA GLU 65 23.717 29.053 18.144 521 HB2 GLU 65 HB2 GLU 65 22.499 27.852 16.378 522 HB3 GLU 65 HB3 GLU 65 22.302 29.570 16.402 523 HG2 GLU 65 HG2 GLU 65 22.354 29.038 14.159 524 HG3 GLU 65 HG3 GLU 65 23.903 29.790 14.476 525 H THR 66 H THR 66 26.561 28.615 16.306 526 HA THR 66 HA THR 66 27.410 26.315 17.915 527 HB THR 66 HB THR 66 28.321 25.272 15.699 528 HG1 THR 66 HG1 THR 66 25.899 26.364 14.726 529 HG21 THR 66 HG21 THR 66 26.521 23.712 15.519 530 HG22 THR 66 HG22 THR 66 25.381 24.832 16.289 531 HG23 THR 66 HG23 THR 66 26.717 24.131 17.224 532 H VAL 67 H VAL 67 29.722 26.031 17.764 533 HA VAL 67 HA VAL 67 31.360 27.641 16.132 534 HB VAL 67 HB VAL 67 32.434 28.505 18.641 535 HG11 VAL 67 HG11 VAL 67 32.407 30.680 17.585 536 HG12 VAL 67 HG12 VAL 67 32.914 29.435 16.435 537 HG13 VAL 67 HG13 VAL 67 31.268 30.102 16.351 538 HG21 VAL 67 HG21 VAL 67 30.919 30.128 19.472 539 HG22 VAL 67 HG22 VAL 67 29.703 29.763 18.241 540 HG23 VAL 67 HG23 VAL 67 30.062 28.586 19.521 541 HA PRO 68 HA PRO 68 30.128 25.189 19.076 542 HB2 PRO 68 HB2 PRO 68 31.144 23.780 21.141 543 HB3 PRO 68 HB3 PRO 68 30.903 23.063 19.519 544 HG2 PRO 68 HG2 PRO 68 33.463 24.244 20.666 545 HG3 PRO 68 HG3 PRO 68 33.228 22.622 19.931 546 HD2 PRO 68 HD2 PRO 68 34.157 24.688 18.460 547 HD3 PRO 68 HD3 PRO 68 32.977 23.545 17.757 548 H ALA 69 H ALA 69 29.472 25.726 21.348 549 HA ALA 69 HA ALA 69 30.685 28.350 22.075 550 HB1 ALA 69 HB1 ALA 69 28.012 27.066 22.762 551 HB2 ALA 69 HB2 ALA 69 28.520 28.688 23.251 552 HB3 ALA 69 HB3 ALA 69 28.295 28.316 21.532 553 H ILE 70 H ILE 70 31.859 28.629 23.919 554 HA ILE 70 HA ILE 70 32.084 26.313 25.804 555 HB ILE 70 HB ILE 70 34.211 28.096 24.567 556 HG12 ILE 70 HG12 ILE 70 34.057 25.079 24.276 557 HG13 ILE 70 HG13 ILE 70 33.208 26.134 23.161 558 HG21 ILE 70 HG21 ILE 70 34.861 27.609 26.868 559 HG22 ILE 70 HG22 ILE 70 34.536 25.878 26.634 560 HG23 ILE 70 HG23 ILE 70 35.866 26.675 25.773 561 HD11 ILE 70 HD11 ILE 70 35.315 27.266 22.550 562 HD12 ILE 70 HD12 ILE 70 36.206 26.139 23.595 563 HD13 ILE 70 HD13 ILE 70 35.320 25.529 22.192 564 H PHE 71 H PHE 71 31.982 26.759 27.944 565 HA PHE 71 HA PHE 71 32.182 29.602 28.828 566 HB2 PHE 71 HB2 PHE 71 30.140 27.523 29.659 567 HB3 PHE 71 HB3 PHE 71 30.354 29.111 30.385 568 HD1 PHE 71 HD1 PHE 71 29.446 27.418 27.160 569 HD2 PHE 71 HD2 PHE 71 29.226 31.011 29.537 570 HE1 PHE 71 HE1 PHE 71 27.830 28.402 25.545 571 HE2 PHE 71 HE2 PHE 71 27.560 31.947 27.961 572 HZ PHE 71 HZ PHE 71 26.868 30.643 25.955 573 H ILE 72 H ILE 72 33.320 29.994 30.628 574 HA ILE 72 HA ILE 72 34.258 27.738 32.345 575 HB ILE 72 HB ILE 72 36.118 29.828 31.140 576 HG12 ILE 72 HG12 ILE 72 35.574 26.940 30.363 577 HG13 ILE 72 HG13 ILE 72 35.510 28.376 29.348 578 HG21 ILE 72 HG21 ILE 72 36.652 27.379 32.900 579 HG22 ILE 72 HG22 ILE 72 37.898 28.445 32.211 580 HG23 ILE 72 HG23 ILE 72 36.780 29.071 33.406 581 HD11 ILE 72 HD11 ILE 72 37.982 26.997 30.412 582 HD12 ILE 72 HD12 ILE 72 37.434 27.124 28.740 583 HD13 ILE 72 HD13 ILE 72 38.008 28.581 29.583 584 H ASN 73 H ASN 73 33.902 28.216 34.422 585 HA ASN 73 HA ASN 73 33.160 29.345 36.237 586 HB2 ASN 73 HB2 ASN 73 35.426 31.232 35.461 587 HB3 ASN 73 HB3 ASN 73 34.635 31.210 37.027 588 HD21 ASN 73 HD21 ASN 73 37.211 30.928 37.254 589 HD22 ASN 73 HD22 ASN 73 37.708 29.233 37.398 590 H GLY 74 H GLY 74 31.445 29.780 34.183 591 HA2 GLY 74 HA2 GLY 74 29.747 31.116 33.397 592 HA3 GLY 74 HA3 GLY 74 30.046 32.209 34.721 593 H ASN 75 H ASN 75 32.851 32.024 32.728 594 HA ASN 75 HA ASN 75 32.217 34.533 31.253 595 HB2 ASN 75 HB2 ASN 75 34.806 32.914 31.376 596 HB3 ASN 75 HB3 ASN 75 34.624 34.504 30.695 597 HD21 ASN 75 HD21 ASN 75 34.830 32.728 33.684 598 HD22 ASN 75 HD22 ASN 75 35.205 34.180 34.633 599 H PHE 76 H PHE 76 32.131 34.585 28.924 600 HA PHE 76 HA PHE 76 31.799 31.945 27.608 601 HB2 PHE 76 HB2 PHE 76 29.932 33.414 27.389 602 HB3 PHE 76 HB3 PHE 76 30.952 34.741 26.840 603 HD1 PHE 76 HD2 PHE 76 30.087 31.192 25.894 604 HD2 PHE 76 HD1 PHE 76 31.199 35.128 24.530 605 HE1 PHE 76 HE2 PHE 76 29.871 30.447 23.546 606 HE2 PHE 76 HE1 PHE 76 30.973 34.372 22.179 607 HZ PHE 76 HZ PHE 76 30.304 32.031 21.679 608 H ILE 77 H ILE 77 32.890 31.200 25.956 609 HA ILE 77 HA ILE 77 34.918 32.820 24.500 610 HB ILE 77 HB ILE 77 35.223 29.953 25.479 611 HG12 ILE 77 HG12 ILE 77 36.947 32.348 26.239 612 HG13 ILE 77 HG13 ILE 77 35.637 31.728 27.243 613 HG21 ILE 77 HG21 ILE 77 37.081 31.662 23.764 614 HG22 ILE 77 HG22 ILE 77 37.487 30.065 24.414 615 HG23 ILE 77 HG23 ILE 77 36.204 30.207 23.237 616 HD11 ILE 77 HD11 ILE 77 37.637 30.804 28.108 617 HD12 ILE 77 HD12 ILE 77 36.753 29.489 27.313 618 HD13 ILE 77 HD13 ILE 77 38.167 30.225 26.520 619 H GLY 78 H GLY 78 34.585 32.684 22.305 620 HA2 GLY 78 HA2 GLY 78 33.167 30.227 21.249 621 HA3 GLY 78 HA3 GLY 78 33.053 31.807 20.493 622 H GLY 79 H GLY 79 34.684 28.911 20.511 623 HA2 GLY 79 HA2 GLY 79 35.638 28.466 18.252 624 HA3 GLY 79 HA3 GLY 79 36.672 29.867 18.502 625 H CYS 80 H CYS 80 37.131 26.805 18.204 626 HA CYS 80 HA CYS 80 38.220 25.880 20.697 627 HB2 CYS 80 HB2 CYS 80 38.724 24.944 17.841 628 HB3 CYS 80 HB3 CYS 80 39.216 24.082 19.309 629 HG CYS 80 HG CYS 80 37.085 22.897 18.495 630 H SER 81 H SER 81 39.786 27.544 17.947 631 HA SER 81 HA SER 81 42.426 27.548 19.127 632 HB2 SER 81 HB2 SER 81 41.720 27.997 16.673 633 HB3 SER 81 HB3 SER 81 41.451 29.667 17.216 634 HG SER 81 HG SER 81 43.515 29.680 16.648 635 H ASP 82 H ASP 82 39.601 29.633 19.413 636 HA ASP 82 HA ASP 82 40.708 31.834 20.850 637 HB2 ASP 82 HB2 ASP 82 38.272 31.145 19.716 638 HB3 ASP 82 HB3 ASP 82 37.876 31.074 21.416 639 H LEU 83 H LEU 83 39.329 28.771 21.969 640 HA LEU 83 HA LEU 83 39.696 29.189 24.817 641 HB2 LEU 83 HB2 LEU 83 38.137 27.525 24.028 642 HB3 LEU 83 HB3 LEU 83 39.348 26.775 23.001 643 HG LEU 83 HG LEU 83 40.599 26.002 25.028 644 HD11 LEU 83 HD11 LEU 83 38.144 27.055 26.493 645 HD12 LEU 83 HD12 LEU 83 39.393 26.004 27.201 646 HD13 LEU 83 HD13 LEU 83 39.808 27.645 26.678 647 HD21 LEU 83 HD21 LEU 83 38.951 24.578 23.818 648 HD22 LEU 83 HD22 LEU 83 39.151 24.178 25.523 649 HD23 LEU 83 HD23 LEU 83 37.711 25.079 24.992 650 H GLU 84 H GLU 84 41.674 27.586 22.301 651 HA GLU 84 HA GLU 84 43.803 26.774 24.038 652 HB2 GLU 84 HB2 GLU 84 43.626 27.211 21.046 653 HB3 GLU 84 HB3 GLU 84 45.136 26.719 21.844 654 HG2 GLU 84 HG2 GLU 84 44.221 24.708 22.656 655 HG3 GLU 84 HG3 GLU 84 42.571 25.187 22.255 656 H ALA 85 H ALA 85 43.188 29.876 22.418 657 HA ALA 85 HA ALA 85 45.750 31.051 22.731 658 HB1 ALA 85 HB1 ALA 85 42.956 32.292 22.945 659 HB2 ALA 85 HB2 ALA 85 44.466 33.192 22.688 660 HB3 ALA 85 HB3 ALA 85 43.888 32.055 21.456 661 H LEU 86 H LEU 86 43.110 30.731 25.122 662 HA LEU 86 HA LEU 86 44.553 32.143 27.232 663 HB2 LEU 86 HB2 LEU 86 42.126 30.312 27.345 664 HB3 LEU 86 HB3 LEU 86 42.732 31.304 28.669 665 HG LEU 86 HG LEU 86 41.580 32.338 26.044 666 HD11 LEU 86 HD11 LEU 86 39.958 31.390 27.661 667 HD12 LEU 86 HD12 LEU 86 40.547 32.513 28.907 668 HD13 LEU 86 HD13 LEU 86 39.751 33.134 27.442 669 HD21 LEU 86 HD21 LEU 86 42.612 33.889 28.466 670 HD22 LEU 86 HD22 LEU 86 43.295 33.922 26.815 671 HD23 LEU 86 HD23 LEU 86 41.692 34.577 27.116 672 H ASP 87 H ASP 87 44.372 28.821 26.152 673 HA ASP 87 HA ASP 87 45.649 27.618 28.452 674 HB2 ASP 87 HB2 ASP 87 44.162 26.530 26.605 675 HB3 ASP 87 HB3 ASP 87 45.617 26.515 25.619 676 H LYS 88 H LYS 88 46.901 28.914 25.365 677 HA LYS 88 HA LYS 88 49.707 28.319 26.004 678 HB2 LYS 88 HB2 LYS 88 48.382 30.023 23.874 679 HB3 LYS 88 HB3 LYS 88 50.117 30.049 24.162 680 HG2 LYS 88 HG2 LYS 88 49.866 28.526 22.435 681 HG3 LYS 88 HG3 LYS 88 50.176 27.535 23.858 682 HD2 LYS 88 HD2 LYS 88 47.735 27.005 23.998 683 HD3 LYS 88 HD3 LYS 88 47.448 28.100 22.630 684 HE2 LYS 88 HE2 LYS 88 47.365 25.864 21.829 685 HE3 LYS 88 HE3 LYS 88 48.779 26.667 21.152 686 HZ1 LYS 88 HZ1 LYS 88 50.182 25.449 22.604 687 HZ2 LYS 88 HZ2 LYS 88 48.934 24.906 23.546 688 HZ3 LYS 88 HZ3 LYS 88 49.115 24.349 22.012 689 H GLU 89 H GLU 89 47.740 31.299 26.235 690 HA GLU 89 HA GLU 89 49.906 32.773 27.466 691 HB2 GLU 89 HB2 GLU 89 46.941 33.317 27.118 692 HB3 GLU 89 HB3 GLU 89 48.013 34.463 27.901 693 HG2 GLU 89 HG2 GLU 89 48.506 33.437 25.076 694 HG3 GLU 89 HG3 GLU 89 47.585 34.891 25.451 695 H GLY 90 H GLY 90 48.394 30.260 28.894 696 HA2 GLY 90 HA2 GLY 90 48.460 29.523 31.079 697 HA3 GLY 90 HA3 GLY 90 49.384 30.971 31.483 698 H LYS 91 H LYS 91 46.424 31.937 30.149 699 HA LYS 91 HA LYS 91 45.474 32.827 32.797 700 HB2 LYS 91 HB2 LYS 91 44.798 33.416 29.881 701 HB3 LYS 91 HB3 LYS 91 43.808 33.996 31.209 702 HG2 LYS 91 HG2 LYS 91 45.840 35.082 32.220 703 HG3 LYS 91 HG3 LYS 91 46.757 34.643 30.777 704 HD2 LYS 91 HD2 LYS 91 44.259 36.392 30.791 705 HD3 LYS 91 HD3 LYS 91 45.910 37.008 30.829 706 HE2 LYS 91 HE2 LYS 91 46.395 36.004 28.633 707 HE3 LYS 91 HE3 LYS 91 44.766 35.300 28.581 708 HZ1 LYS 91 HZ1 LYS 91 44.812 37.338 27.329 709 HZ2 LYS 91 HZ2 LYS 91 43.861 37.542 28.629 710 HZ3 LYS 91 HZ3 LYS 91 45.377 38.209 28.601 711 H LEU 92 H LEU 92 44.777 30.285 30.567 712 HA LEU 92 HA LEU 92 42.221 29.553 31.765 713 HB2 LEU 92 HB2 LEU 92 42.918 28.970 29.462 714 HB3 LEU 92 HB3 LEU 92 44.209 27.962 30.095 715 HG LEU 92 HG LEU 92 42.675 26.351 30.982 716 HD11 LEU 92 HD11 LEU 92 40.200 26.584 30.742 717 HD12 LEU 92 HD12 LEU 92 40.870 27.733 31.887 718 HD13 LEU 92 HD13 LEU 92 40.428 28.279 30.251 719 HD21 LEU 92 HD21 LEU 92 41.397 25.717 28.920 720 HD22 LEU 92 HD22 LEU 92 41.724 27.321 28.252 721 HD23 LEU 92 HD23 LEU 92 43.064 26.218 28.566 722 H ASP 93 H ASP 93 45.670 28.595 32.253 723 HA ASP 93 HA ASP 93 45.204 26.681 34.314 724 HB2 ASP 93 HB2 ASP 93 47.543 28.570 33.824 725 HB3 ASP 93 HB3 ASP 93 47.525 27.230 34.950 726 H GLY 94 H GLY 94 45.422 30.254 34.451 727 HA2 GLY 94 HA2 GLY 94 45.099 30.493 37.300 728 HA3 GLY 94 HA3 GLY 94 44.727 31.731 36.091 729 H LEU 95 H LEU 95 42.713 29.934 34.710 730 HA LEU 95 HA LEU 95 40.408 30.422 36.467 731 HB2 LEU 95 HB2 LEU 95 40.781 29.385 33.642 732 HB3 LEU 95 HB3 LEU 95 39.221 29.346 34.442 733 HG LEU 95 HG LEU 95 40.823 31.916 34.104 734 HD11 LEU 95 HD11 LEU 95 39.357 32.421 32.201 735 HD12 LEU 95 HD12 LEU 95 40.302 30.962 31.885 736 HD13 LEU 95 HD13 LEU 95 38.586 30.828 32.341 737 HD21 LEU 95 HD21 LEU 95 37.869 31.411 34.678 738 HD22 LEU 95 HD22 LEU 95 39.065 32.033 35.838 739 HD23 LEU 95 HD23 LEU 95 38.624 32.999 34.432 740 H LEU 96 H LEU 96 42.391 27.669 35.540 741 HA LEU 96 HA LEU 96 40.784 25.674 36.974 742 HB2 LEU 96 HB2 LEU 96 43.679 25.651 36.026 743 HB3 LEU 96 HB3 LEU 96 42.831 24.246 36.658 744 HG LEU 96 HG LEU 96 42.019 25.683 34.108 745 HD11 LEU 96 HD11 LEU 96 43.065 23.787 32.979 746 HD12 LEU 96 HD12 LEU 96 44.258 24.569 34.008 747 HD13 LEU 96 HD13 LEU 96 43.499 23.054 34.532 748 HD21 LEU 96 HD21 LEU 96 40.148 24.487 35.243 749 HD22 LEU 96 HD22 LEU 96 40.623 23.719 33.739 750 HD23 LEU 96 HD23 LEU 96 41.138 23.014 35.280 751 H SER 97 H SER 97 42.585 28.256 38.054 752 HA SER 97 HA SER 97 43.355 26.996 40.657 753 HB2 SER 97 HB2 SER 97 44.409 29.544 39.389 754 HB3 SER 97 HB3 SER 97 44.956 28.794 40.899 755 HG SER 97 HG SER 97 45.159 27.781 38.235 Start of MODEL 13 1 H1 GLY 1 H1 GLY 1 6.102 23.704 40.206 2 H2 GLY 1 H2 GLY 1 7.062 24.671 41.140 3 H3 GLY 1 H3 GLY 1 6.826 23.102 41.564 4 HA2 GLY 1 HA2 GLY 1 8.973 23.270 40.653 5 HA3 GLY 1 HA3 GLY 1 7.930 22.360 39.535 6 H ALA 2 H ALA 2 10.330 24.354 39.421 7 HA ALA 2 HA ALA 2 9.291 26.381 37.549 8 HB1 ALA 2 HB1 ALA 2 10.676 26.972 39.541 9 HB2 ALA 2 HB2 ALA 2 12.026 26.045 38.849 10 HB3 ALA 2 HB3 ALA 2 11.404 27.485 38.018 11 H MET 3 H MET 3 10.758 26.978 35.690 12 HA MET 3 HA MET 3 11.821 24.583 34.242 13 HB2 MET 3 HB2 MET 3 9.844 26.570 33.073 14 HB3 MET 3 HB3 MET 3 10.683 25.275 32.213 15 HG2 MET 3 HG2 MET 3 8.678 24.254 32.619 16 HG3 MET 3 HG3 MET 3 9.616 23.697 34.001 17 HE1 MET 3 HE1 MET 3 7.810 23.086 35.718 18 HE2 MET 3 HE2 MET 3 6.232 23.897 35.777 19 HE3 MET 3 HE3 MET 3 6.775 23.122 34.271 20 HA PRO 4 HA PRO 4 14.765 28.173 33.946 21 HB2 PRO 4 HB2 PRO 4 17.059 26.845 34.689 22 HB3 PRO 4 HB3 PRO 4 15.890 27.535 35.847 23 HG2 PRO 4 HG2 PRO 4 16.064 24.674 34.856 24 HG3 PRO 4 HG3 PRO 4 15.959 25.254 36.549 25 HD2 PRO 4 HD2 PRO 4 13.761 24.429 35.206 26 HD3 PRO 4 HD3 PRO 4 13.685 25.829 36.313 27 H SER 5 H SER 5 17.057 28.097 32.844 28 HA SER 5 HA SER 5 16.982 26.536 30.308 29 HB2 SER 5 HB2 SER 5 17.807 29.416 30.415 30 HB3 SER 5 HB3 SER 5 17.396 28.459 28.996 31 HG SER 5 HG SER 5 15.238 28.608 29.523 32 H ILE 6 H ILE 6 19.360 27.543 29.183 33 HA ILE 6 HA ILE 6 21.112 25.784 30.571 34 HB ILE 6 HB ILE 6 22.745 26.129 28.984 35 HG12 ILE 6 HG12 ILE 6 21.338 28.656 28.222 36 HG13 ILE 6 HG13 ILE 6 23.014 28.444 28.672 37 HG21 ILE 6 HG21 ILE 6 20.274 26.260 27.436 38 HG22 ILE 6 HG22 ILE 6 21.734 25.300 27.139 39 HG23 ILE 6 HG23 ILE 6 20.666 24.861 28.481 40 HD11 ILE 6 HD11 ILE 6 23.408 27.263 26.490 41 HD12 ILE 6 HD12 ILE 6 21.717 27.586 26.047 42 HD13 ILE 6 HD13 ILE 6 22.837 28.932 26.304 43 H ALA 7 H ALA 7 20.779 29.240 30.781 44 HA ALA 7 HA ALA 7 23.231 30.074 31.833 45 HB1 ALA 7 HB1 ALA 7 21.447 31.613 31.289 46 HB2 ALA 7 HB2 ALA 7 20.392 30.924 32.542 47 HB3 ALA 7 HB3 ALA 7 21.861 31.820 32.999 48 H SER 8 H SER 8 20.592 28.360 33.583 49 HA SER 8 HA SER 8 21.869 28.432 36.186 50 HB2 SER 8 HB2 SER 8 19.876 26.466 35.000 51 HB3 SER 8 HB3 SER 8 20.261 26.651 36.724 52 HG SER 8 HG SER 8 18.697 28.027 36.677 53 H MET 9 H MET 9 22.160 26.209 33.422 54 HA MET 9 HA MET 9 23.528 24.076 34.798 55 HB2 MET 9 HB2 MET 9 23.706 24.731 31.833 56 HB3 MET 9 HB3 MET 9 24.004 23.186 32.620 57 HG2 MET 9 HG2 MET 9 21.613 23.038 33.248 58 HG3 MET 9 HG3 MET 9 21.316 24.596 32.472 59 HE1 MET 9 HE1 MET 9 19.488 23.974 30.820 60 HE2 MET 9 HE2 MET 9 19.455 22.454 29.902 61 HE3 MET 9 HE3 MET 9 19.406 22.420 31.679 62 H ILE 10 H ILE 10 24.665 27.070 33.237 63 HA ILE 10 HA ILE 10 27.413 26.413 33.038 64 HB ILE 10 HB ILE 10 26.578 29.209 33.764 65 HG12 ILE 10 HG12 ILE 10 24.909 28.631 32.116 66 HG13 ILE 10 HG13 ILE 10 26.054 29.781 31.474 67 HG21 ILE 10 HG21 ILE 10 28.358 29.755 32.082 68 HG22 ILE 10 HG22 ILE 10 28.961 28.797 33.442 69 HG23 ILE 10 HG23 ILE 10 28.672 28.017 31.888 70 HD11 ILE 10 HD11 ILE 10 27.160 28.009 30.160 71 HD12 ILE 10 HD12 ILE 10 26.056 26.796 30.853 72 HD13 ILE 10 HD13 ILE 10 25.428 28.095 29.815 73 H LYS 11 H LYS 11 25.539 27.177 35.896 74 HA LYS 11 HA LYS 11 27.927 27.675 37.574 75 HB2 LYS 11 HB2 LYS 11 24.935 27.587 38.200 76 HB3 LYS 11 HB3 LYS 11 26.194 27.820 39.408 77 HG2 LYS 11 HG2 LYS 11 25.558 29.974 39.005 78 HG3 LYS 11 HG3 LYS 11 26.991 29.837 37.989 79 HD2 LYS 11 HD2 LYS 11 25.592 29.594 35.989 80 HD3 LYS 11 HD3 LYS 11 24.123 29.489 36.986 81 HE2 LYS 11 HE2 LYS 11 24.485 31.788 37.778 82 HE3 LYS 11 HE3 LYS 11 25.984 31.896 36.836 83 HZ1 LYS 11 HZ1 LYS 11 23.258 31.504 35.745 84 HZ2 LYS 11 HZ2 LYS 11 24.144 32.885 35.616 85 HZ3 LYS 11 HZ3 LYS 11 24.642 31.538 34.829 86 H GLY 12 H GLY 12 26.496 24.882 36.402 87 HA2 GLY 12 HA2 GLY 12 26.758 23.227 38.799 88 HA3 GLY 12 HA3 GLY 12 26.305 22.712 37.178 89 H ASN 13 H ASN 13 28.953 24.097 36.189 90 HA ASN 13 HA ASN 13 30.960 22.199 37.270 91 HB2 ASN 13 HB2 ASN 13 30.427 22.542 34.289 92 HB3 ASN 13 HB3 ASN 13 31.704 21.574 35.000 93 HD21 ASN 13 HD21 ASN 13 31.203 19.454 35.836 94 HD22 ASN 13 HD22 ASN 13 29.612 18.774 35.550 95 H LYS 14 H LYS 14 33.137 22.706 36.697 96 HA LYS 14 HA LYS 14 33.922 25.486 36.785 97 HB2 LYS 14 HB2 LYS 14 35.153 23.564 37.720 98 HB3 LYS 14 HB3 LYS 14 35.410 22.928 36.104 99 HG2 LYS 14 HG2 LYS 14 36.776 24.914 35.512 100 HG3 LYS 14 HG3 LYS 14 36.559 25.547 37.149 101 HD2 LYS 14 HD2 LYS 14 37.786 22.817 36.471 102 HD3 LYS 14 HD3 LYS 14 38.751 24.263 36.715 103 HE2 LYS 14 HE2 LYS 14 38.197 24.455 38.986 104 HE3 LYS 14 HE3 LYS 14 36.835 23.330 38.865 105 HZ1 LYS 14 HZ1 LYS 14 39.687 22.518 38.589 106 HZ2 LYS 14 HZ2 LYS 14 38.790 22.327 39.920 107 HZ3 LYS 14 HZ3 LYS 14 38.390 21.509 38.553 108 H VAL 15 H VAL 15 33.824 23.108 34.096 109 HA VAL 15 HA VAL 15 33.726 25.393 32.174 110 HB VAL 15 HB VAL 15 35.101 22.744 31.657 111 HG11 VAL 15 HG11 VAL 15 34.869 25.269 29.958 112 HG12 VAL 15 HG12 VAL 15 35.857 23.848 29.574 113 HG13 VAL 15 HG13 VAL 15 34.103 23.704 29.610 114 HG21 VAL 15 HG21 VAL 15 36.532 24.010 33.107 115 HG22 VAL 15 HG22 VAL 15 37.133 24.278 31.463 116 HG23 VAL 15 HG23 VAL 15 36.168 25.530 32.261 117 H VAL 16 H VAL 16 32.099 25.433 30.771 118 HA VAL 16 HA VAL 16 30.489 22.969 30.306 119 HB VAL 16 HB VAL 16 29.286 25.692 30.892 120 HG11 VAL 16 HG11 VAL 16 27.971 23.050 30.104 121 HG12 VAL 16 HG12 VAL 16 27.109 24.487 30.693 122 HG13 VAL 16 HG13 VAL 16 27.966 24.555 29.153 123 HG21 VAL 16 HG21 VAL 16 29.212 23.024 32.371 124 HG22 VAL 16 HG22 VAL 16 29.923 24.550 32.956 125 HG23 VAL 16 HG23 VAL 16 28.174 24.398 32.764 126 H VAL 17 H VAL 17 30.029 22.578 28.194 127 HA VAL 17 HA VAL 17 30.521 24.748 26.196 128 HB VAL 17 HB VAL 17 31.551 21.891 26.123 129 HG11 VAL 17 HG11 VAL 17 32.644 22.461 24.018 130 HG12 VAL 17 HG12 VAL 17 30.899 22.569 23.852 131 HG13 VAL 17 HG13 VAL 17 31.859 24.063 24.029 132 HG21 VAL 17 HG21 VAL 17 32.996 24.544 26.290 133 HG22 VAL 17 HG22 VAL 17 32.943 23.275 27.530 134 HG23 VAL 17 HG23 VAL 17 33.776 22.971 26.008 135 H PHE 18 H PHE 18 29.220 24.771 24.354 136 HA PHE 18 HA PHE 18 27.045 22.701 24.170 137 HB2 PHE 18 HB2 PHE 18 26.733 25.604 23.426 138 HB3 PHE 18 HB3 PHE 18 25.516 24.347 23.371 139 HD1 PHE 18 HD1 PHE 18 24.447 23.513 25.438 140 HD2 PHE 18 HD2 PHE 18 27.435 26.610 25.541 141 HE1 PHE 18 HE1 PHE 18 23.759 24.098 27.755 142 HE2 PHE 18 HE2 PHE 18 26.704 27.243 27.830 143 HZ PHE 18 HZ PHE 18 24.830 26.027 28.913 144 H SER 19 H SER 19 26.726 21.795 22.230 145 HA SER 19 HA SER 19 28.438 22.569 19.905 146 HB2 SER 19 HB2 SER 19 28.539 19.933 21.432 147 HB3 SER 19 HB3 SER 19 29.501 20.358 19.995 148 HG SER 19 HG SER 19 30.723 20.754 21.794 149 H TRP 20 H TRP 20 28.324 20.882 18.099 150 HA TRP 20 HA TRP 20 25.590 19.709 17.820 151 HB2 TRP 20 HB2 TRP 20 26.659 21.961 16.274 152 HB3 TRP 20 HB3 TRP 20 26.276 20.601 15.255 153 HD1 TRP 20 HD1 TRP 20 24.141 21.563 18.324 154 HE1 TRP 20 HE1 TRP 20 21.761 22.158 17.513 155 HE3 TRP 20 HE3 TRP 20 24.961 21.566 13.265 156 HZ2 TRP 20 HZ2 TRP 20 20.437 22.665 15.037 157 HZ3 TRP 20 HZ3 TRP 20 23.123 22.167 11.705 158 HH2 TRP 20 HH2 TRP 20 20.860 22.706 12.572 159 H VAL 21 H VAL 21 25.449 17.815 16.599 160 HA VAL 21 HA VAL 21 28.005 16.386 16.464 161 HB VAL 21 HB VAL 21 25.210 15.315 16.142 162 HG11 VAL 21 HG11 VAL 21 26.352 13.107 16.420 163 HG12 VAL 21 HG12 VAL 21 26.773 13.882 14.904 164 HG13 VAL 21 HG13 VAL 21 27.921 13.910 16.269 165 HG21 VAL 21 HG21 VAL 21 25.785 14.268 18.361 166 HG22 VAL 21 HG22 VAL 21 27.253 15.244 18.411 167 HG23 VAL 21 HG23 VAL 21 25.654 16.028 18.431 168 H THR 22 H THR 22 28.281 16.107 12.874 169 HA THR 22 HA THR 22 29.678 16.096 15.538 170 HB THR 22 HB THR 22 30.514 15.009 12.858 171 HG1 THR 22 HG1 THR 22 29.362 13.451 13.839 172 HG21 THR 22 HG21 THR 22 32.506 15.926 13.971 173 HG22 THR 22 HG22 THR 22 32.511 14.165 14.045 174 HG23 THR 22 HG23 THR 22 32.057 15.096 15.483 175 H CYS 23 H CYS 23 31.210 17.590 15.933 176 HA CYS 23 HA CYS 23 31.280 19.950 14.075 177 HB2 CYS 23 HB2 CYS 23 30.027 20.483 16.022 178 HB3 CYS 23 HB3 CYS 23 31.271 19.806 17.089 179 HG CYS 23 HG CYS 23 31.254 22.452 15.102 180 HA PRO 24 HA PRO 24 35.528 18.440 13.931 181 HB2 PRO 24 HB2 PRO 24 35.799 20.909 12.224 182 HB3 PRO 24 HB3 PRO 24 36.472 19.268 11.962 183 HG2 PRO 24 HG2 PRO 24 34.263 20.036 10.605 184 HG3 PRO 24 HG3 PRO 24 34.316 18.405 11.358 185 HD2 PRO 24 HD2 PRO 24 33.014 20.926 12.428 186 HD3 PRO 24 HD3 PRO 24 32.367 19.259 12.342 187 H TYR 25 H TYR 25 34.517 21.584 15.090 188 HA TYR 25 HA TYR 25 37.102 22.039 16.447 189 HB2 TYR 25 HB2 TYR 25 34.465 23.536 16.508 190 HB3 TYR 25 HB3 TYR 25 35.903 24.008 17.395 191 HD1 TYR 25 HD2 TYR 25 38.173 23.783 15.678 192 HD2 TYR 25 HD1 TYR 25 34.143 24.939 14.610 193 HE1 TYR 25 HE2 TYR 25 39.038 24.982 13.677 194 HE2 TYR 25 HE1 TYR 25 35.015 26.107 12.602 195 HH TYR 25 HH TYR 25 36.856 26.637 11.362 196 H CYS 26 H CYS 26 33.823 20.912 17.405 197 HA CYS 26 HA CYS 26 34.436 21.074 20.185 198 HB2 CYS 26 HB2 CYS 26 32.215 20.990 19.227 199 HB3 CYS 26 HB3 CYS 26 32.369 19.249 18.902 200 HG CYS 26 HG CYS 26 32.956 18.517 21.374 201 H VAL 27 H VAL 27 34.984 18.391 17.926 202 HA VAL 27 HA VAL 27 35.987 16.390 19.594 203 HB VAL 27 HB VAL 27 35.803 16.360 17.299 204 HG11 VAL 27 HG11 VAL 27 38.231 17.786 16.614 205 HG12 VAL 27 HG12 VAL 27 36.995 17.044 15.583 206 HG13 VAL 27 HG13 VAL 27 36.535 18.408 16.605 207 HG21 VAL 27 HG21 VAL 27 37.262 14.642 18.432 208 HG22 VAL 27 HG22 VAL 27 37.757 14.901 16.752 209 HG23 VAL 27 HG23 VAL 27 38.676 15.662 18.074 210 H ARG 28 H ARG 28 37.681 18.764 18.074 211 HA ARG 28 HA ARG 28 40.250 18.750 19.369 212 HB2 ARG 28 HB2 ARG 28 39.029 21.432 18.564 213 HB3 ARG 28 HB3 ARG 28 40.707 21.057 18.861 214 HG2 ARG 28 HG2 ARG 28 40.515 19.404 16.887 215 HG3 ARG 28 HG3 ARG 28 38.985 20.251 16.551 216 HD2 ARG 28 HD2 ARG 28 40.274 22.433 16.592 217 HD3 ARG 28 HD3 ARG 28 41.768 21.474 16.638 218 HE ARG 28 HE ARG 28 40.268 20.466 14.487 219 HH11 ARG 28 HH12 ARG 28 41.711 23.637 15.155 220 HH12 ARG 28 HH11 ARG 28 41.766 23.953 13.417 221 HH21 ARG 28 HH22 ARG 28 40.315 21.046 12.467 222 HH22 ARG 28 HH21 ARG 28 41.017 22.604 11.979 223 H ALA 29 H ALA 29 37.524 20.841 20.310 224 HA ALA 29 HA ALA 29 38.778 21.923 22.609 225 HB1 ALA 29 HB1 ALA 29 36.553 22.671 23.268 226 HB2 ALA 29 HB2 ALA 29 36.806 22.931 21.526 227 HB3 ALA 29 HB3 ALA 29 35.798 21.573 22.089 228 H GLU 30 H GLU 30 36.421 19.120 22.521 229 HA GLU 30 HA GLU 30 36.594 18.580 25.334 230 HB2 GLU 30 HB2 GLU 30 36.076 16.716 22.990 231 HB3 GLU 30 HB3 GLU 30 35.882 16.277 24.696 232 HG2 GLU 30 HG2 GLU 30 34.161 18.023 24.963 233 HG3 GLU 30 HG3 GLU 30 34.312 18.476 23.259 234 H LYS 31 H LYS 31 38.723 17.534 22.710 235 HA LYS 31 HA LYS 31 40.189 15.688 24.337 236 HB2 LYS 31 HB2 LYS 31 40.100 15.490 21.904 237 HB3 LYS 31 HB3 LYS 31 40.734 17.118 21.694 238 HG2 LYS 31 HG2 LYS 31 42.931 16.310 22.719 239 HG3 LYS 31 HG3 LYS 31 42.235 14.680 22.733 240 HD2 LYS 31 HD2 LYS 31 43.586 14.904 20.765 241 HD3 LYS 31 HD3 LYS 31 41.878 14.885 20.256 242 HE2 LYS 31 HE2 LYS 31 41.851 17.223 19.838 243 HE3 LYS 31 HE3 LYS 31 43.352 17.516 20.719 244 HZ1 LYS 31 HZ1 LYS 31 43.587 17.515 18.251 245 HZ2 LYS 31 HZ2 LYS 31 44.574 16.421 18.947 246 HZ3 LYS 31 HZ3 LYS 31 43.184 15.928 18.198 247 H LEU 32 H LEU 32 40.725 19.047 23.412 248 HA LEU 32 HA LEU 32 43.225 19.538 24.742 249 HB2 LEU 32 HB2 LEU 32 42.074 20.739 22.877 250 HB3 LEU 32 HB3 LEU 32 40.926 21.333 24.083 251 HG LEU 32 HG LEU 32 42.512 22.987 23.329 252 HD11 LEU 32 HD11 LEU 32 43.227 23.948 25.403 253 HD12 LEU 32 HD12 LEU 32 41.637 23.201 25.624 254 HD13 LEU 32 HD13 LEU 32 43.097 22.395 26.240 255 HD21 LEU 32 HD21 LEU 32 44.864 22.948 23.731 256 HD22 LEU 32 HD22 LEU 32 44.750 21.377 24.578 257 HD23 LEU 32 HD23 LEU 32 44.402 21.490 22.844 258 H LEU 33 H LEU 33 39.801 20.082 25.751 259 HA LEU 33 HA LEU 33 40.431 21.179 28.303 260 HB2 LEU 33 HB2 LEU 33 37.931 19.772 27.255 261 HB3 LEU 33 HB3 LEU 33 37.981 20.610 28.801 262 HG LEU 33 HG LEU 33 38.508 21.938 26.122 263 HD11 LEU 33 HD11 LEU 33 36.387 22.946 26.162 264 HD12 LEU 33 HD12 LEU 33 36.194 21.193 26.244 265 HD13 LEU 33 HD13 LEU 33 35.983 22.195 27.709 266 HD21 LEU 33 HD21 LEU 33 38.003 23.134 28.862 267 HD22 LEU 33 HD22 LEU 33 39.554 23.172 27.981 268 HD23 LEU 33 HD23 LEU 33 38.158 24.056 27.359 269 H HIS 34 H HIS 34 39.638 17.810 27.373 270 HA HIS 34 HA HIS 34 40.056 16.585 29.913 271 HB2 HIS 34 HB2 HIS 34 40.387 15.638 27.034 272 HB3 HIS 34 HB3 HIS 34 40.717 14.594 28.409 273 HD1 HIS 34 HD1 HIS 34 38.786 13.042 27.209 274 HD2 HIS 34 HD2 HIS 34 37.593 16.669 28.969 275 HE1 HIS 34 HE1 HIS 34 36.263 12.892 27.526 276 H ALA 35 H ALA 35 42.426 17.451 27.291 277 HA ALA 35 HA ALA 35 44.601 16.108 28.672 278 HB1 ALA 35 HB1 ALA 35 44.639 18.266 26.514 279 HB2 ALA 35 HB2 ALA 35 46.019 17.270 27.020 280 HB3 ALA 35 HB3 ALA 35 44.622 16.510 26.246 281 H ARG 36 H ARG 36 43.252 19.343 28.810 282 HA ARG 36 HA ARG 36 45.483 20.449 30.432 283 HB2 ARG 36 HB2 ARG 36 43.142 21.582 28.921 284 HB3 ARG 36 HB3 ARG 36 43.809 22.514 30.224 285 HG2 ARG 36 HG2 ARG 36 44.824 23.235 28.168 286 HG3 ARG 36 HG3 ARG 36 46.021 22.564 29.274 287 HD2 ARG 36 HD2 ARG 36 45.972 20.431 27.973 288 HD3 ARG 36 HD3 ARG 36 44.834 21.154 26.852 289 HE ARG 36 HE ARG 36 46.800 22.984 26.722 290 HH11 ARG 36 HH22 ARG 36 47.614 19.650 27.164 291 HH12 ARG 36 HH21 ARG 36 48.657 19.586 25.764 292 HH21 ARG 36 HH12 ARG 36 48.278 22.966 25.125 293 HH22 ARG 36 HH11 ARG 36 49.289 21.554 24.866 294 H THR 37 H THR 37 43.069 18.598 31.380 295 HA THR 37 HA THR 37 42.555 17.992 33.566 296 HB THR 37 HB THR 37 43.338 20.627 34.721 297 HG1 THR 37 HG1 THR 37 45.366 20.368 34.135 298 HG21 THR 37 HG21 THR 37 42.679 19.105 36.437 299 HG22 THR 37 HG22 THR 37 44.430 19.094 36.512 300 HG23 THR 37 HG23 THR 37 43.586 17.750 35.721 301 H LYS 38 H LYS 38 40.943 19.886 31.731 302 HA LYS 38 HA LYS 38 39.540 21.646 33.659 303 HB2 LYS 38 HB2 LYS 38 39.295 21.160 30.706 304 HB3 LYS 38 HB3 LYS 38 37.961 21.874 31.580 305 HG2 LYS 38 HG2 LYS 38 39.397 23.583 30.570 306 HG3 LYS 38 HG3 LYS 38 39.229 23.747 32.300 307 HD2 LYS 38 HD2 LYS 38 41.668 22.428 31.092 308 HD3 LYS 38 HD3 LYS 38 41.500 24.183 31.172 309 HE2 LYS 38 HE2 LYS 38 41.022 23.860 33.708 310 HE3 LYS 38 HE3 LYS 38 41.668 22.246 33.497 311 HZ1 LYS 38 HZ1 LYS 38 43.384 23.717 34.185 312 HZ2 LYS 38 HZ2 LYS 38 43.722 23.176 32.718 313 HZ3 LYS 38 HZ3 LYS 38 43.181 24.750 32.915 314 H ASP 39 H ASP 39 38.364 20.793 35.065 315 HA ASP 39 HA ASP 39 36.569 18.609 34.763 316 HB2 ASP 39 HB2 ASP 39 36.456 21.023 36.624 317 HB3 ASP 39 HB3 ASP 39 35.350 19.661 36.721 318 H ILE 40 H ILE 40 35.347 18.478 33.128 319 HA ILE 40 HA ILE 40 33.888 20.815 32.034 320 HB ILE 40 HB ILE 40 35.940 19.853 30.924 321 HG12 ILE 40 HG12 ILE 40 33.483 20.746 29.627 322 HG13 ILE 40 HG13 ILE 40 35.155 21.227 29.433 323 HG21 ILE 40 HG21 ILE 40 35.799 17.831 29.618 324 HG22 ILE 40 HG22 ILE 40 35.441 17.471 31.296 325 HG23 ILE 40 HG23 ILE 40 34.121 17.556 30.114 326 HD11 ILE 40 HD11 ILE 40 35.561 19.358 27.875 327 HD12 ILE 40 HD12 ILE 40 33.877 18.808 28.086 328 HD13 ILE 40 HD13 ILE 40 34.208 20.374 27.341 329 H THR 41 H THR 41 31.909 20.678 31.071 330 HA THR 41 HA THR 41 30.533 18.060 30.686 331 HB THR 41 HB THR 41 29.469 20.484 32.142 332 HG1 THR 41 HG1 THR 41 30.042 18.622 33.263 333 HG21 THR 41 HG21 THR 41 27.163 19.720 31.840 334 HG22 THR 41 HG22 THR 41 27.691 18.522 30.632 335 HG23 THR 41 HG23 THR 41 27.828 20.274 30.316 336 H VAL 42 H VAL 42 29.918 17.889 28.526 337 HA VAL 42 HA VAL 42 29.139 20.423 27.216 338 HB VAL 42 HB VAL 42 31.029 19.999 26.166 339 HG11 VAL 42 HG11 VAL 42 31.834 18.076 25.129 340 HG12 VAL 42 HG12 VAL 42 31.747 17.998 26.876 341 HG13 VAL 42 HG13 VAL 42 30.534 17.100 25.888 342 HG21 VAL 42 HG21 VAL 42 30.567 19.518 23.834 343 HG22 VAL 42 HG22 VAL 42 29.068 18.683 24.264 344 HG23 VAL 42 HG23 VAL 42 29.222 20.440 24.508 345 H HIS 43 H HIS 43 27.436 20.706 26.210 346 HA HIS 43 HA HIS 43 25.316 18.611 26.095 347 HB2 HIS 43 HB2 HIS 43 25.427 21.587 26.532 348 HB3 HIS 43 HB3 HIS 43 24.021 20.932 25.741 349 HD1 HIS 43 HD1 HIS 43 22.727 18.853 27.319 350 HD2 HIS 43 HD2 HIS 43 25.546 21.398 29.154 351 HE1 HIS 43 HE1 HIS 43 22.280 18.737 29.807 352 H TYR 44 H TYR 44 25.402 17.644 24.113 353 HA TYR 44 HA TYR 44 25.732 19.239 21.656 354 HB2 TYR 44 HB2 TYR 44 25.362 16.308 22.217 355 HB3 TYR 44 HB3 TYR 44 25.163 16.979 20.614 356 HD1 TYR 44 HD2 TYR 44 27.702 16.401 23.294 357 HD2 TYR 44 HD1 TYR 44 26.952 17.904 19.342 358 HE1 TYR 44 HE2 TYR 44 30.143 16.326 22.808 359 HE2 TYR 44 HE1 TYR 44 29.390 17.755 18.816 360 HH TYR 44 HH TYR 44 31.797 16.638 21.235 361 H VAL 45 H VAL 45 24.058 20.704 21.609 362 HA VAL 45 HA VAL 45 21.317 20.004 22.153 363 HB VAL 45 HB VAL 45 20.722 22.208 21.271 364 HG11 VAL 45 HG11 VAL 45 23.035 22.333 23.234 365 HG12 VAL 45 HG12 VAL 45 21.721 23.514 23.043 366 HG13 VAL 45 HG13 VAL 45 21.351 21.904 23.649 367 HG21 VAL 45 HG21 VAL 45 23.694 22.517 20.682 368 HG22 VAL 45 HG22 VAL 45 22.322 22.641 19.545 369 HG23 VAL 45 HG23 VAL 45 22.546 23.853 20.798 370 H ASP 46 H ASP 46 23.106 19.233 19.452 371 HA ASP 46 HA ASP 46 20.947 18.958 17.509 372 HB2 ASP 46 HB2 ASP 46 23.436 18.975 17.025 373 HB3 ASP 46 HB3 ASP 46 23.553 17.397 17.786 374 H LYS 47 H LYS 47 22.153 17.020 20.249 375 HA LYS 47 HA LYS 47 20.490 14.668 19.512 376 HB2 LYS 47 HB2 LYS 47 22.598 14.934 21.660 377 HB3 LYS 47 HB3 LYS 47 21.706 13.477 21.207 378 HG2 LYS 47 HG2 LYS 47 22.675 14.319 18.743 379 HG3 LYS 47 HG3 LYS 47 23.958 14.838 19.827 380 HD2 LYS 47 HD2 LYS 47 22.840 12.016 19.540 381 HD3 LYS 47 HD3 LYS 47 24.362 12.607 18.878 382 HE2 LYS 47 HE2 LYS 47 24.879 13.262 21.369 383 HE3 LYS 47 HE3 LYS 47 23.632 12.077 21.772 384 HZ1 LYS 47 HZ1 LYS 47 25.859 11.072 21.706 385 HZ2 LYS 47 HZ2 LYS 47 24.929 10.377 20.581 386 HZ3 LYS 47 HZ3 LYS 47 26.057 11.482 20.133 387 H MET 48 H MET 48 20.770 17.090 22.029 388 HA MET 48 HA MET 48 18.691 16.118 23.799 389 HB2 MET 48 HB2 MET 48 20.578 17.640 24.411 390 HB3 MET 48 HB3 MET 48 19.883 18.892 23.380 391 HG2 MET 48 HG2 MET 48 17.843 18.895 24.820 392 HG3 MET 48 HG3 MET 48 18.630 17.703 25.871 393 HE1 MET 48 HE1 MET 48 17.478 20.196 27.198 394 HE2 MET 48 HE2 MET 48 18.495 19.018 28.053 395 HE3 MET 48 HE3 MET 48 18.829 20.757 28.203 396 H SER 49 H SER 49 16.516 16.090 23.295 397 HA SER 49 HA SER 49 15.431 17.127 20.891 398 HB2 SER 49 HB2 SER 49 14.035 16.251 23.450 399 HB3 SER 49 HB3 SER 49 13.241 16.545 21.893 400 HG SER 49 HG SER 49 13.612 14.466 21.855 401 H GLU 50 H GLU 50 15.441 18.586 24.117 402 HA GLU 50 HA GLU 50 13.858 20.929 23.353 403 HB2 GLU 50 HB2 GLU 50 14.192 19.855 25.678 404 HB3 GLU 50 HB3 GLU 50 15.805 20.586 25.677 405 HG2 GLU 50 HG2 GLU 50 14.702 22.843 25.518 406 HG3 GLU 50 HG3 GLU 50 13.129 22.043 25.593 407 H GLY 51 H GLY 51 17.052 20.019 22.689 408 HA2 GLY 51 HA2 GLY 51 18.700 22.103 23.233 409 HA3 GLY 51 HA3 GLY 51 18.852 21.029 21.849 410 H GLU 52 H GLU 52 16.204 22.272 20.661 411 HA GLU 52 HA GLU 52 17.509 24.210 18.983 412 HB2 GLU 52 HB2 GLU 52 15.788 22.736 18.202 413 HB3 GLU 52 HB3 GLU 52 14.732 23.126 19.560 414 HG2 GLU 52 HG2 GLU 52 13.956 24.075 17.541 415 HG3 GLU 52 HG3 GLU 52 14.317 25.303 18.759 416 H GLN 53 H GLN 53 15.504 24.332 21.920 417 HA GLN 53 HA GLN 53 15.017 27.198 21.909 418 HB2 GLN 53 HB2 GLN 53 14.905 25.147 24.171 419 HB3 GLN 53 HB3 GLN 53 14.227 26.773 24.209 420 HG2 GLN 53 HG2 GLN 53 12.678 26.155 22.345 421 HG3 GLN 53 HG3 GLN 53 13.357 24.526 22.328 422 HE21 GLN 53 HE21 GLN 53 11.164 23.752 22.706 423 HE22 GLN 53 HE22 GLN 53 10.521 23.829 24.356 424 H LEU 54 H LEU 54 17.395 25.029 23.409 425 HA LEU 54 HA LEU 54 18.782 27.117 24.878 426 HB2 LEU 54 HB2 LEU 54 19.674 24.281 24.230 427 HB3 LEU 54 HB3 LEU 54 20.425 25.382 25.369 428 HG LEU 54 HG LEU 54 19.261 24.064 26.810 429 HD11 LEU 54 HD11 LEU 54 16.852 25.809 26.257 430 HD12 LEU 54 HD12 LEU 54 17.435 25.151 27.800 431 HD13 LEU 54 HD13 LEU 54 18.284 26.489 27.025 432 HD21 LEU 54 HD21 LEU 54 17.094 23.054 26.525 433 HD22 LEU 54 HD22 LEU 54 16.949 23.778 24.916 434 HD23 LEU 54 HD23 LEU 54 18.230 22.584 25.266 435 H ARG 55 H ARG 55 19.279 25.607 21.664 436 HA ARG 55 HA ARG 55 21.625 27.083 20.906 437 HB2 ARG 55 HB2 ARG 55 20.935 25.074 19.791 438 HB3 ARG 55 HB3 ARG 55 19.299 25.666 19.548 439 HG2 ARG 55 HG2 ARG 55 19.958 27.204 17.926 440 HG3 ARG 55 HG3 ARG 55 21.701 26.868 18.148 441 HD2 ARG 55 HD2 ARG 55 21.333 24.519 17.480 442 HD3 ARG 55 HD3 ARG 55 19.612 24.798 17.286 443 HE ARG 55 HE ARG 55 21.819 25.709 15.503 444 HH11 ARG 55 HH12 ARG 55 18.241 25.448 15.790 445 HH12 ARG 55 HH11 ARG 55 18.127 25.755 14.079 446 HH21 ARG 55 HH22 ARG 55 21.402 26.048 13.384 447 HH22 ARG 55 HH21 ARG 55 19.726 26.009 12.834 448 H GLY 56 H GLY 56 18.135 27.824 20.882 449 HA2 GLY 56 HA2 GLY 56 18.271 30.446 19.741 450 HA3 GLY 56 HA3 GLY 56 17.038 29.842 20.853 451 H GLU 57 H GLU 57 18.612 29.365 23.188 452 HA GLU 57 HA GLU 57 18.863 31.959 24.331 453 HB2 GLU 57 HB2 GLU 57 20.012 29.299 25.235 454 HB3 GLU 57 HB3 GLU 57 20.257 30.780 26.117 455 HG2 GLU 57 HG2 GLU 57 17.618 29.391 25.602 456 HG3 GLU 57 HG3 GLU 57 18.482 29.614 27.120 457 H ILE 58 H ILE 58 21.420 29.837 22.993 458 HA ILE 58 HA ILE 58 23.548 31.723 23.545 459 HB ILE 58 HB ILE 58 23.569 29.522 21.454 460 HG12 ILE 58 HG12 ILE 58 24.571 29.313 24.338 461 HG13 ILE 58 HG13 ILE 58 22.990 28.728 23.843 462 HG21 ILE 58 HG21 ILE 58 25.420 31.197 21.284 463 HG22 ILE 58 HG22 ILE 58 25.809 30.942 23.003 464 HG23 ILE 58 HG23 ILE 58 26.038 29.642 21.808 465 HD11 ILE 58 HD11 ILE 58 24.436 26.864 23.854 466 HD12 ILE 58 HD12 ILE 58 24.052 27.226 22.163 467 HD13 ILE 58 HD13 ILE 58 25.639 27.676 22.835 468 H TYR 59 H TYR 59 21.504 31.119 20.602 469 HA TYR 59 HA TYR 59 22.934 33.000 19.034 470 HB2 TYR 59 HB2 TYR 59 21.218 31.168 18.319 471 HB3 TYR 59 HB3 TYR 59 20.029 32.460 18.472 472 HD1 TYR 59 HD1 TYR 59 20.336 34.577 17.023 473 HD2 TYR 59 HD2 TYR 59 22.808 31.079 16.586 474 HE1 TYR 59 HE1 TYR 59 21.253 35.483 14.893 475 HE2 TYR 59 HE2 TYR 59 23.811 32.022 14.509 476 HH TYR 59 HH TYR 59 22.748 35.220 13.209 477 H GLN 60 H GLN 60 19.963 33.517 21.020 478 HA GLN 60 HA GLN 60 19.591 36.234 20.231 479 HB2 GLN 60 HB2 GLN 60 18.792 34.663 22.710 480 HB3 GLN 60 HB3 GLN 60 18.292 36.335 22.462 481 HG2 GLN 60 HG2 GLN 60 17.686 34.160 20.410 482 HG3 GLN 60 HG3 GLN 60 16.638 34.511 21.776 483 HE21 GLN 60 HE21 GLN 60 15.070 36.080 21.483 484 HE22 GLN 60 HE22 GLN 60 15.092 37.217 20.142 485 H ALA 61 H ALA 61 21.679 34.879 22.764 486 HA ALA 61 HA ALA 61 22.431 37.534 23.773 487 HB1 ALA 61 HB1 ALA 61 23.848 36.179 25.298 488 HB2 ALA 61 HB2 ALA 61 22.148 35.675 25.305 489 HB3 ALA 61 HB3 ALA 61 23.359 34.711 24.429 490 H TYR 62 H TYR 62 24.068 34.969 21.841 491 HA TYR 62 HA TYR 62 26.465 36.735 21.571 492 HB2 TYR 62 HB2 TYR 62 26.304 33.705 21.594 493 HB3 TYR 62 HB3 TYR 62 27.767 34.668 21.502 494 HD1 TYR 62 HD2 TYR 62 28.303 36.300 23.435 495 HD2 TYR 62 HD1 TYR 62 25.428 33.102 23.716 496 HE1 TYR 62 HE2 TYR 62 28.445 36.386 25.907 497 HE2 TYR 62 HE1 TYR 62 25.600 33.147 26.186 498 HH TYR 62 HH TYR 62 26.501 34.248 28.021 499 H LYS 63 H LYS 63 23.974 35.628 19.647 500 HA LYS 63 HA LYS 63 23.657 35.095 17.489 501 HB2 LYS 63 HB2 LYS 63 25.952 36.996 16.937 502 HB3 LYS 63 HB3 LYS 63 24.638 36.580 15.840 503 HG2 LYS 63 HG2 LYS 63 24.294 38.068 18.482 504 HG3 LYS 63 HG3 LYS 63 24.463 38.837 16.922 505 HD2 LYS 63 HD2 LYS 63 22.223 36.865 17.477 506 HD3 LYS 63 HD3 LYS 63 22.083 38.564 17.901 507 HE2 LYS 63 HE2 LYS 63 22.776 37.656 15.075 508 HE3 LYS 63 HE3 LYS 63 21.109 37.788 15.654 509 HZ1 LYS 63 HZ1 LYS 63 21.737 39.806 14.575 510 HZ2 LYS 63 HZ2 LYS 63 21.473 40.108 16.143 511 HZ3 LYS 63 HZ3 LYS 63 23.029 40.052 15.564 512 H HIS 64 H HIS 64 24.931 33.075 18.641 513 HA HIS 64 HA HIS 64 26.313 31.827 16.330 514 HB2 HIS 64 HB2 HIS 64 27.202 31.595 19.236 515 HB3 HIS 64 HB3 HIS 64 27.742 30.535 17.937 516 HD1 HIS 64 HD1 HIS 64 28.555 32.567 15.693 517 HD2 HIS 64 HD2 HIS 64 29.336 32.931 19.816 518 HE1 HIS 64 HE1 HIS 64 30.539 34.150 15.915 519 H GLU 65 H GLU 65 25.894 29.632 16.092 520 HA GLU 65 HA GLU 65 23.885 28.403 17.947 521 HB2 GLU 65 HB2 GLU 65 23.137 27.054 16.019 522 HB3 GLU 65 HB3 GLU 65 22.731 28.761 15.927 523 HG2 GLU 65 HG2 GLU 65 24.435 29.167 14.253 524 HG3 GLU 65 HG3 GLU 65 25.102 27.536 14.463 525 H THR 66 H THR 66 26.884 27.816 16.103 526 HA THR 66 HA THR 66 27.805 26.406 18.419 527 HB THR 66 HB THR 66 27.151 24.702 16.032 528 HG1 THR 66 HG1 THR 66 26.050 24.797 18.074 529 HG21 THR 66 HG21 THR 66 29.595 24.297 16.205 530 HG22 THR 66 HG22 THR 66 28.668 22.922 16.784 531 HG23 THR 66 HG23 THR 66 29.416 24.012 17.960 532 H VAL 67 H VAL 67 29.973 26.418 18.583 533 HA VAL 67 HA VAL 67 31.699 27.325 16.337 534 HB VAL 67 HB VAL 67 31.334 28.718 19.003 535 HG11 VAL 67 HG11 VAL 67 33.533 29.205 16.957 536 HG12 VAL 67 HG12 VAL 67 33.146 30.264 18.329 537 HG13 VAL 67 HG13 VAL 67 33.754 28.634 18.631 538 HG21 VAL 67 HG21 VAL 67 29.798 29.461 17.244 539 HG22 VAL 67 HG22 VAL 67 30.998 30.709 17.564 540 HG23 VAL 67 HG23 VAL 67 31.152 29.683 16.123 541 HA PRO 68 HA PRO 68 30.480 25.241 19.548 542 HB2 PRO 68 HB2 PRO 68 31.376 24.155 21.792 543 HB3 PRO 68 HB3 PRO 68 31.365 23.245 20.254 544 HG2 PRO 68 HG2 PRO 68 33.703 24.767 21.469 545 HG3 PRO 68 HG3 PRO 68 33.665 23.051 20.950 546 HD2 PRO 68 HD2 PRO 68 34.567 24.984 19.286 547 HD3 PRO 68 HD3 PRO 68 33.553 23.653 18.658 548 H ALA 69 H ALA 69 29.663 26.075 21.677 549 HA ALA 69 HA ALA 69 30.871 28.741 22.297 550 HB1 ALA 69 HB1 ALA 69 28.704 29.168 23.413 551 HB2 ALA 69 HB2 ALA 69 28.481 28.706 21.712 552 HB3 ALA 69 HB3 ALA 69 28.169 27.526 23.006 553 H ILE 70 H ILE 70 32.067 29.010 24.137 554 HA ILE 70 HA ILE 70 32.241 26.691 26.016 555 HB ILE 70 HB ILE 70 34.404 28.510 24.899 556 HG12 ILE 70 HG12 ILE 70 34.348 25.515 24.468 557 HG13 ILE 70 HG13 ILE 70 33.388 26.540 23.416 558 HG21 ILE 70 HG21 ILE 70 36.011 26.988 26.064 559 HG22 ILE 70 HG22 ILE 70 35.004 27.907 27.174 560 HG23 ILE 70 HG23 ILE 70 34.642 26.194 26.866 561 HD11 ILE 70 HD11 ILE 70 35.349 27.833 22.739 562 HD12 ILE 70 HD12 ILE 70 36.381 26.856 23.801 563 HD13 ILE 70 HD13 ILE 70 35.572 26.104 22.417 564 H PHE 71 H PHE 71 32.159 27.075 28.151 565 HA PHE 71 HA PHE 71 32.380 29.880 29.109 566 HB2 PHE 71 HB2 PHE 71 30.352 27.783 29.931 567 HB3 PHE 71 HB3 PHE 71 30.568 29.348 30.707 568 HD1 PHE 71 HD1 PHE 71 29.510 27.678 27.534 569 HD2 PHE 71 HD2 PHE 71 29.633 31.366 29.767 570 HE1 PHE 71 HE1 PHE 71 27.962 28.735 25.896 571 HE2 PHE 71 HE2 PHE 71 28.066 32.391 28.148 572 HZ PHE 71 HZ PHE 71 27.206 31.071 26.216 573 H ILE 72 H ILE 72 33.603 30.224 30.868 574 HA ILE 72 HA ILE 72 34.586 27.893 32.492 575 HB ILE 72 HB ILE 72 36.210 30.320 31.620 576 HG12 ILE 72 HG12 ILE 72 36.477 27.372 30.841 577 HG13 ILE 72 HG13 ILE 72 35.950 28.677 29.785 578 HG21 ILE 72 HG21 ILE 72 38.079 29.203 32.851 579 HG22 ILE 72 HG22 ILE 72 36.765 29.566 33.933 580 HG23 ILE 72 HG23 ILE 72 36.969 27.902 33.354 581 HD11 ILE 72 HD11 ILE 72 38.744 28.310 30.938 582 HD12 ILE 72 HD12 ILE 72 38.231 28.200 29.248 583 HD13 ILE 72 HD13 ILE 72 38.205 29.771 30.077 584 H ASN 73 H ASN 73 33.892 28.078 34.522 585 HA ASN 73 HA ASN 73 32.908 28.914 36.377 586 HB2 ASN 73 HB2 ASN 73 35.060 31.039 36.099 587 HB3 ASN 73 HB3 ASN 73 34.163 30.692 37.565 588 HD21 ASN 73 HD21 ASN 73 37.118 30.255 36.353 589 HD22 ASN 73 HD22 ASN 73 37.504 28.717 37.112 590 H GLY 74 H GLY 74 31.367 29.581 34.192 591 HA2 GLY 74 HA2 GLY 74 29.439 30.870 33.797 592 HA3 GLY 74 HA3 GLY 74 29.943 32.005 35.017 593 H ASN 75 H ASN 75 32.622 32.023 33.112 594 HA ASN 75 HA ASN 75 31.695 34.443 31.662 595 HB2 ASN 75 HB2 ASN 75 34.458 33.292 32.189 596 HB3 ASN 75 HB3 ASN 75 34.165 34.813 31.390 597 HD21 ASN 75 HD21 ASN 75 35.564 34.166 33.971 598 HD22 ASN 75 HD22 ASN 75 34.721 35.131 35.191 599 H PHE 76 H PHE 76 31.806 34.719 29.443 600 HA PHE 76 HA PHE 76 31.819 32.243 27.860 601 HB2 PHE 76 HB2 PHE 76 29.954 33.746 27.613 602 HB3 PHE 76 HB3 PHE 76 31.018 35.088 27.215 603 HD1 PHE 76 HD2 PHE 76 30.394 31.550 26.006 604 HD2 PHE 76 HD1 PHE 76 31.210 35.651 24.947 605 HE1 PHE 76 HE2 PHE 76 30.335 30.949 23.607 606 HE2 PHE 76 HE1 PHE 76 31.141 35.042 22.547 607 HZ PHE 76 HZ PHE 76 30.709 32.690 21.868 608 H ILE 77 H ILE 77 33.166 31.567 26.425 609 HA ILE 77 HA ILE 77 35.224 33.307 25.153 610 HB ILE 77 HB ILE 77 35.553 30.418 26.089 611 HG12 ILE 77 HG12 ILE 77 37.666 31.420 27.195 612 HG13 ILE 77 HG13 ILE 77 36.908 32.993 27.001 613 HG21 ILE 77 HG21 ILE 77 36.610 30.715 23.882 614 HG22 ILE 77 HG22 ILE 77 37.462 32.159 24.476 615 HG23 ILE 77 HG23 ILE 77 37.835 30.554 25.127 616 HD11 ILE 77 HD11 ILE 77 35.182 32.399 28.595 617 HD12 ILE 77 HD12 ILE 77 35.600 30.672 28.496 618 HD13 ILE 77 HD13 ILE 77 36.702 31.829 29.269 619 H GLY 78 H GLY 78 34.998 33.300 22.954 620 HA2 GLY 78 HA2 GLY 78 33.565 30.975 21.664 621 HA3 GLY 78 HA3 GLY 78 33.460 32.628 21.092 622 H GLY 79 H GLY 79 34.948 29.741 20.658 623 HA2 GLY 79 HA2 GLY 79 35.919 29.596 18.332 624 HA3 GLY 79 HA3 GLY 79 37.048 30.847 18.839 625 H CYS 80 H CYS 80 37.231 27.785 18.111 626 HA CYS 80 HA CYS 80 38.402 26.525 20.437 627 HB2 CYS 80 HB2 CYS 80 37.632 25.340 18.365 628 HB3 CYS 80 HB3 CYS 80 39.019 26.011 17.492 629 HG CYS 80 HG CYS 80 40.879 24.996 19.084 630 H SER 81 H SER 81 39.865 28.430 17.758 631 HA SER 81 HA SER 81 42.522 28.495 18.763 632 HB2 SER 81 HB2 SER 81 41.914 29.172 16.496 633 HB3 SER 81 HB3 SER 81 40.998 30.555 17.124 634 HG SER 81 HG SER 81 42.756 31.623 17.279 635 H ASP 82 H ASP 82 39.700 30.408 19.730 636 HA ASP 82 HA ASP 82 41.113 32.451 21.202 637 HB2 ASP 82 HB2 ASP 82 38.643 32.212 20.218 638 HB3 ASP 82 HB3 ASP 82 38.266 31.599 21.802 639 H LEU 83 H LEU 83 39.572 29.386 22.070 640 HA LEU 83 HA LEU 83 40.242 29.396 24.896 641 HB2 LEU 83 HB2 LEU 83 38.477 27.967 24.068 642 HB3 LEU 83 HB3 LEU 83 39.544 27.223 22.885 643 HG LEU 83 HG LEU 83 40.871 26.189 24.733 644 HD11 LEU 83 HD11 LEU 83 38.603 27.226 26.491 645 HD12 LEU 83 HD12 LEU 83 39.851 26.060 26.988 646 HD13 LEU 83 HD13 LEU 83 40.308 27.718 26.582 647 HD21 LEU 83 HD21 LEU 83 39.070 24.967 23.548 648 HD22 LEU 83 HD22 LEU 83 39.311 24.422 25.210 649 HD23 LEU 83 HD23 LEU 83 37.926 25.463 24.816 650 H GLU 84 H GLU 84 41.861 27.913 22.041 651 HA GLU 84 HA GLU 84 44.092 26.897 23.530 652 HB2 GLU 84 HB2 GLU 84 43.848 27.515 20.571 653 HB3 GLU 84 HB3 GLU 84 45.151 26.576 21.339 654 HG2 GLU 84 HG2 GLU 84 43.675 24.846 22.041 655 HG3 GLU 84 HG3 GLU 84 42.237 25.717 21.545 656 H ALA 85 H ALA 85 43.526 30.121 22.133 657 HA ALA 85 HA ALA 85 46.191 31.077 22.280 658 HB1 ALA 85 HB1 ALA 85 45.079 33.329 22.436 659 HB2 ALA 85 HB2 ALA 85 44.389 32.317 21.159 660 HB3 ALA 85 HB3 ALA 85 43.518 32.517 22.686 661 H LEU 86 H LEU 86 43.731 30.783 24.850 662 HA LEU 86 HA LEU 86 45.306 31.968 26.971 663 HB2 LEU 86 HB2 LEU 86 42.970 30.010 27.023 664 HB3 LEU 86 HB3 LEU 86 43.642 30.782 28.446 665 HG LEU 86 HG LEU 86 42.442 32.352 26.133 666 HD11 LEU 86 HD11 LEU 86 40.440 32.585 27.538 667 HD12 LEU 86 HD12 LEU 86 40.733 30.892 27.120 668 HD13 LEU 86 HD13 LEU 86 41.142 31.487 28.749 669 HD21 LEU 86 HD21 LEU 86 42.291 34.159 27.802 670 HD22 LEU 86 HD22 LEU 86 43.026 33.111 29.032 671 HD23 LEU 86 HD23 LEU 86 43.969 33.646 27.614 672 H ASP 87 H ASP 87 45.047 28.684 25.637 673 HA ASP 87 HA ASP 87 46.596 27.326 27.639 674 HB2 ASP 87 HB2 ASP 87 45.208 26.175 25.945 675 HB3 ASP 87 HB3 ASP 87 46.347 26.652 24.695 676 H LYS 88 H LYS 88 47.537 28.928 24.605 677 HA LYS 88 HA LYS 88 50.397 28.592 24.906 678 HB2 LYS 88 HB2 LYS 88 48.613 30.379 23.229 679 HB3 LYS 88 HB3 LYS 88 50.344 30.694 23.315 680 HG2 LYS 88 HG2 LYS 88 50.060 29.395 21.412 681 HG3 LYS 88 HG3 LYS 88 50.790 28.329 22.614 682 HD2 LYS 88 HD2 LYS 88 48.547 27.271 23.019 683 HD3 LYS 88 HD3 LYS 88 47.842 28.404 21.825 684 HE2 LYS 88 HE2 LYS 88 49.451 27.624 20.128 685 HE3 LYS 88 HE3 LYS 88 50.077 26.414 21.264 686 HZ1 LYS 88 HZ1 LYS 88 48.511 25.401 19.803 687 HZ2 LYS 88 HZ2 LYS 88 47.772 25.456 21.261 688 HZ3 LYS 88 HZ3 LYS 88 47.368 26.513 20.049 689 H GLU 89 H GLU 89 48.260 31.210 26.025 690 HA GLU 89 HA GLU 89 50.486 32.763 27.141 691 HB2 GLU 89 HB2 GLU 89 47.463 32.962 27.421 692 HB3 GLU 89 HB3 GLU 89 48.600 34.081 28.188 693 HG2 GLU 89 HG2 GLU 89 49.500 34.773 26.057 694 HG3 GLU 89 HG3 GLU 89 48.450 33.659 25.185 695 H GLY 90 H GLY 90 49.364 29.838 28.152 696 HA2 GLY 90 HA2 GLY 90 49.798 28.668 30.094 697 HA3 GLY 90 HA3 GLY 90 50.592 30.102 30.748 698 H LYS 91 H LYS 91 47.406 30.808 29.733 699 HA LYS 91 HA LYS 91 46.668 31.434 32.528 700 HB2 LYS 91 HB2 LYS 91 45.831 32.311 29.734 701 HB3 LYS 91 HB3 LYS 91 44.830 32.674 31.126 702 HG2 LYS 91 HG2 LYS 91 46.564 33.979 32.183 703 HG3 LYS 91 HG3 LYS 91 47.760 33.443 31.011 704 HD2 LYS 91 HD2 LYS 91 47.081 35.742 30.544 705 HD3 LYS 91 HD3 LYS 91 46.688 34.662 29.219 706 HE2 LYS 91 HE2 LYS 91 44.906 36.199 29.443 707 HE3 LYS 91 HE3 LYS 91 44.319 34.606 29.916 708 HZ1 LYS 91 HZ1 LYS 91 44.541 35.279 32.244 709 HZ2 LYS 91 HZ2 LYS 91 45.120 36.755 31.818 710 HZ3 LYS 91 HZ3 LYS 91 43.571 36.311 31.453 711 H LEU 92 H LEU 92 45.819 29.061 30.130 712 HA LEU 92 HA LEU 92 43.178 28.506 31.329 713 HB2 LEU 92 HB2 LEU 92 43.754 28.205 28.877 714 HB3 LEU 92 HB3 LEU 92 44.912 26.964 29.324 715 HG LEU 92 HG LEU 92 43.102 25.526 30.171 716 HD11 LEU 92 HD11 LEU 92 41.247 27.740 29.187 717 HD12 LEU 92 HD12 LEU 92 40.724 26.109 29.642 718 HD13 LEU 92 HD13 LEU 92 41.420 27.179 30.865 719 HD21 LEU 92 HD21 LEU 92 42.102 24.990 27.989 720 HD22 LEU 92 HD22 LEU 92 42.601 26.576 27.357 721 HD23 LEU 92 HD23 LEU 92 43.823 25.377 27.819 722 H ASP 93 H ASP 93 46.459 27.245 31.558 723 HA ASP 93 HA ASP 93 45.772 25.431 33.762 724 HB2 ASP 93 HB2 ASP 93 48.406 26.631 32.798 725 HB3 ASP 93 HB3 ASP 93 48.228 25.429 34.058 726 H GLY 94 H GLY 94 47.052 28.792 33.472 727 HA2 GLY 94 HA2 GLY 94 47.476 29.183 36.233 728 HA3 GLY 94 HA3 GLY 94 47.308 30.459 35.020 729 H LEU 95 H LEU 95 44.503 29.505 34.445 730 HA LEU 95 HA LEU 95 43.007 30.872 36.563 731 HB2 LEU 95 HB2 LEU 95 42.388 29.463 33.943 732 HB3 LEU 95 HB3 LEU 95 41.064 29.862 35.030 733 HG LEU 95 HG LEU 95 43.022 31.936 33.964 734 HD11 LEU 95 HD11 LEU 95 41.696 30.907 32.136 735 HD12 LEU 95 HD12 LEU 95 40.197 31.244 33.036 736 HD13 LEU 95 HD13 LEU 95 41.204 32.579 32.434 737 HD21 LEU 95 HD21 LEU 95 41.927 32.671 36.027 738 HD22 LEU 95 HD22 LEU 95 41.236 33.521 34.640 739 HD23 LEU 95 HD23 LEU 95 40.349 32.177 35.385 740 H LEU 96 H LEU 96 43.567 27.528 35.601 741 HA LEU 96 HA LEU 96 41.459 26.580 37.525 742 HB2 LEU 96 HB2 LEU 96 42.431 25.591 34.856 743 HB3 LEU 96 HB3 LEU 96 41.216 24.738 35.775 744 HG LEU 96 HG LEU 96 41.158 27.505 34.461 745 HD11 LEU 96 HD11 LEU 96 39.146 26.703 33.297 746 HD12 LEU 96 HD12 LEU 96 40.580 25.753 32.963 747 HD13 LEU 96 HD13 LEU 96 39.329 25.131 34.101 748 HD21 LEU 96 HD21 LEU 96 38.974 26.445 36.316 749 HD22 LEU 96 HD22 LEU 96 39.958 27.889 36.582 750 HD23 LEU 96 HD23 LEU 96 38.814 27.857 35.253 751 H SER 97 H SER 97 41.562 24.636 38.548 752 HA SER 97 HA SER 97 44.234 23.288 38.737 753 HB2 SER 97 HB2 SER 97 42.365 23.905 41.047 754 HB3 SER 97 HB3 SER 97 43.876 22.974 41.136 755 HG SER 97 HG SER 97 43.560 25.712 40.361 Start of MODEL 14 1 H1 GLY 1 H1 GLY 1 6.347 26.068 36.263 2 H2 GLY 1 H2 GLY 1 5.860 27.044 37.495 3 H3 GLY 1 H3 GLY 1 5.685 25.410 37.619 4 HA2 GLY 1 HA2 GLY 1 7.529 26.236 38.951 5 HA3 GLY 1 HA3 GLY 1 8.016 25.058 37.712 6 H ALA 2 H ALA 2 10.010 26.525 38.575 7 HA ALA 2 HA ALA 2 10.216 29.187 37.658 8 HB1 ALA 2 HB1 ALA 2 11.441 28.259 39.569 9 HB2 ALA 2 HB2 ALA 2 12.373 27.198 38.481 10 HB3 ALA 2 HB3 ALA 2 12.566 28.961 38.393 11 H MET 3 H MET 3 11.070 26.241 35.942 12 HA MET 3 HA MET 3 11.992 25.825 33.899 13 HB2 MET 3 HB2 MET 3 10.331 28.268 33.237 14 HB3 MET 3 HB3 MET 3 11.044 27.176 32.038 15 HG2 MET 3 HG2 MET 3 9.827 25.271 33.009 16 HG3 MET 3 HG3 MET 3 9.063 26.342 34.186 17 HE1 MET 3 HE1 MET 3 7.151 27.928 33.763 18 HE2 MET 3 HE2 MET 3 8.147 28.925 32.683 19 HE3 MET 3 HE3 MET 3 6.529 28.401 32.168 20 HA PRO 4 HA PRO 4 15.586 28.783 34.016 21 HB2 PRO 4 HB2 PRO 4 17.521 27.060 34.836 22 HB3 PRO 4 HB3 PRO 4 16.415 27.862 35.992 23 HG2 PRO 4 HG2 PRO 4 16.147 25.079 34.794 24 HG3 PRO 4 HG3 PRO 4 16.073 25.546 36.526 25 HD2 PRO 4 HD2 PRO 4 13.828 25.237 35.008 26 HD3 PRO 4 HD3 PRO 4 13.931 26.493 36.276 27 H SER 5 H SER 5 17.610 28.489 32.749 28 HA SER 5 HA SER 5 17.473 26.515 30.495 29 HB2 SER 5 HB2 SER 5 18.026 29.491 30.364 30 HB3 SER 5 HB3 SER 5 18.346 28.360 29.035 31 HG SER 5 HG SER 5 15.857 28.979 30.242 32 H ILE 6 H ILE 6 19.812 27.097 29.247 33 HA ILE 6 HA ILE 6 21.535 25.446 30.671 34 HB ILE 6 HB ILE 6 23.187 25.840 28.950 35 HG12 ILE 6 HG12 ILE 6 21.448 28.158 28.136 36 HG13 ILE 6 HG13 ILE 6 23.131 28.210 28.591 37 HG21 ILE 6 HG21 ILE 6 21.439 24.267 28.679 38 HG22 ILE 6 HG22 ILE 6 20.475 25.501 27.876 39 HG23 ILE 6 HG23 ILE 6 22.008 24.945 27.152 40 HD11 ILE 6 HD11 ILE 6 23.682 26.949 26.479 41 HD12 ILE 6 HD12 ILE 6 21.967 27.058 26.029 42 HD13 ILE 6 HD13 ILE 6 22.929 28.530 26.216 43 H ALA 7 H ALA 7 21.455 28.965 30.858 44 HA ALA 7 HA ALA 7 23.953 29.589 31.896 45 HB1 ALA 7 HB1 ALA 7 21.209 30.607 32.739 46 HB2 ALA 7 HB2 ALA 7 22.755 31.411 33.088 47 HB3 ALA 7 HB3 ALA 7 22.226 31.223 31.414 48 H SER 8 H SER 8 21.322 27.901 33.662 49 HA SER 8 HA SER 8 22.514 28.102 36.294 50 HB2 SER 8 HB2 SER 8 20.391 26.313 35.094 51 HB3 SER 8 HB3 SER 8 20.939 26.170 36.782 52 HG SER 8 HG SER 8 20.189 28.096 37.264 53 H MET 9 H MET 9 22.992 25.828 33.620 54 HA MET 9 HA MET 9 24.436 23.775 35.054 55 HB2 MET 9 HB2 MET 9 24.851 24.667 32.167 56 HB3 MET 9 HB3 MET 9 25.219 23.107 32.873 57 HG2 MET 9 HG2 MET 9 22.836 22.606 33.118 58 HG3 MET 9 HG3 MET 9 22.394 24.217 32.604 59 HE1 MET 9 HE1 MET 9 24.380 21.028 31.385 60 HE2 MET 9 HE2 MET 9 24.352 21.247 29.620 61 HE3 MET 9 HE3 MET 9 25.345 22.322 30.627 62 H ILE 10 H ILE 10 25.299 26.871 33.594 63 HA ILE 10 HA ILE 10 28.135 26.479 33.559 64 HB ILE 10 HB ILE 10 26.910 29.180 33.298 65 HG12 ILE 10 HG12 ILE 10 26.597 26.735 31.528 66 HG13 ILE 10 HG13 ILE 10 25.423 27.977 32.003 67 HG21 ILE 10 HG21 ILE 10 29.433 28.716 33.233 68 HG22 ILE 10 HG22 ILE 10 29.143 27.714 31.820 69 HG23 ILE 10 HG23 ILE 10 28.760 29.455 31.774 70 HD11 ILE 10 HD11 ILE 10 26.613 29.557 30.508 71 HD12 ILE 10 HD12 ILE 10 27.608 28.153 29.989 72 HD13 ILE 10 HD13 ILE 10 25.846 28.154 29.699 73 H LYS 11 H LYS 11 25.932 27.692 35.908 74 HA LYS 11 HA LYS 11 28.092 28.406 37.853 75 HB2 LYS 11 HB2 LYS 11 25.088 28.855 37.786 76 HB3 LYS 11 HB3 LYS 11 25.946 28.828 39.319 77 HG2 LYS 11 HG2 LYS 11 25.911 31.084 38.766 78 HG3 LYS 11 HG3 LYS 11 27.546 30.539 38.442 79 HD2 LYS 11 HD2 LYS 11 26.958 32.055 36.740 80 HD3 LYS 11 HD3 LYS 11 26.979 30.470 35.970 81 HE2 LYS 11 HE2 LYS 11 24.532 30.362 36.025 82 HE3 LYS 11 HE3 LYS 11 24.460 31.773 37.088 83 HZ1 LYS 11 HZ1 LYS 11 25.354 31.839 34.249 84 HZ2 LYS 11 HZ2 LYS 11 23.982 32.524 34.922 85 HZ3 LYS 11 HZ3 LYS 11 25.443 33.090 35.300 86 H GLY 12 H GLY 12 26.638 25.624 36.817 87 HA2 GLY 12 HA2 GLY 12 26.589 24.214 39.421 88 HA3 GLY 12 HA3 GLY 12 26.079 23.599 37.847 89 H ASN 13 H ASN 13 28.546 24.322 36.408 90 HA ASN 13 HA ASN 13 30.671 22.704 37.775 91 HB2 ASN 13 HB2 ASN 13 30.164 22.668 34.786 92 HB3 ASN 13 HB3 ASN 13 31.190 21.593 35.724 93 HD21 ASN 13 HD21 ASN 13 29.584 20.506 37.676 94 HD22 ASN 13 HD22 ASN 13 28.116 19.861 36.966 95 H LYS 14 H LYS 14 32.865 23.105 36.966 96 HA LYS 14 HA LYS 14 33.377 25.958 36.865 97 HB2 LYS 14 HB2 LYS 14 34.786 24.375 38.069 98 HB3 LYS 14 HB3 LYS 14 35.301 23.611 36.568 99 HG2 LYS 14 HG2 LYS 14 36.730 25.319 36.000 100 HG3 LYS 14 HG3 LYS 14 35.665 26.573 36.620 101 HD2 LYS 14 HD2 LYS 14 37.611 26.679 37.942 102 HD3 LYS 14 HD3 LYS 14 36.345 25.973 38.954 103 HE2 LYS 14 HE2 LYS 14 37.270 23.692 38.424 104 HE3 LYS 14 HE3 LYS 14 38.560 24.462 37.495 105 HZ1 LYS 14 HZ1 LYS 14 38.082 24.838 40.393 106 HZ2 LYS 14 HZ2 LYS 14 39.264 23.909 39.707 107 HZ3 LYS 14 HZ3 LYS 14 39.268 25.575 39.561 108 H VAL 15 H VAL 15 33.827 23.401 34.396 109 HA VAL 15 HA VAL 15 33.799 25.569 32.334 110 HB VAL 15 HB VAL 15 35.254 22.923 32.032 111 HG11 VAL 15 HG11 VAL 15 34.495 23.897 29.897 112 HG12 VAL 15 HG12 VAL 15 35.238 25.449 30.329 113 HG13 VAL 15 HG13 VAL 15 36.250 24.016 30.054 114 HG21 VAL 15 HG21 VAL 15 37.334 24.320 32.127 115 HG22 VAL 15 HG22 VAL 15 36.344 25.682 32.702 116 HG23 VAL 15 HG23 VAL 15 36.485 24.200 33.672 117 H VAL 16 H VAL 16 32.256 25.463 30.829 118 HA VAL 16 HA VAL 16 30.726 22.926 30.450 119 HB VAL 16 HB VAL 16 29.432 25.639 30.818 120 HG11 VAL 16 HG11 VAL 16 28.179 24.258 29.198 121 HG12 VAL 16 HG12 VAL 16 28.230 22.877 30.322 122 HG13 VAL 16 HG13 VAL 16 27.314 24.341 30.735 123 HG21 VAL 16 HG21 VAL 16 28.356 24.447 32.794 124 HG22 VAL 16 HG22 VAL 16 29.507 23.131 32.556 125 HG23 VAL 16 HG23 VAL 16 30.085 24.755 32.995 126 H VAL 17 H VAL 17 30.429 22.396 28.369 127 HA VAL 17 HA VAL 17 30.906 24.432 26.222 128 HB VAL 17 HB VAL 17 31.909 21.562 26.492 129 HG11 VAL 17 HG11 VAL 17 31.178 21.818 24.148 130 HG12 VAL 17 HG12 VAL 17 32.023 23.381 24.036 131 HG13 VAL 17 HG13 VAL 17 32.932 21.865 24.241 132 HG21 VAL 17 HG21 VAL 17 33.278 24.251 26.137 133 HG22 VAL 17 HG22 VAL 17 33.312 23.221 27.583 134 HG23 VAL 17 HG23 VAL 17 34.095 22.677 26.094 135 H PHE 18 H PHE 18 29.599 24.379 24.435 136 HA PHE 18 HA PHE 18 27.511 22.232 24.349 137 HB2 PHE 18 HB2 PHE 18 27.116 25.012 23.240 138 HB3 PHE 18 HB3 PHE 18 25.955 23.710 23.350 139 HD1 PHE 18 HD2 PHE 18 24.953 23.075 25.538 140 HD2 PHE 18 HD1 PHE 18 27.695 26.377 25.198 141 HE1 PHE 18 HE2 PHE 18 24.273 23.875 27.797 142 HE2 PHE 18 HE1 PHE 18 26.975 27.195 27.438 143 HZ PHE 18 HZ PHE 18 25.253 25.980 28.711 144 H SER 19 H SER 19 27.585 20.954 22.685 145 HA SER 19 HA SER 19 29.210 21.646 20.279 146 HB2 SER 19 HB2 SER 19 28.961 19.021 21.781 147 HB3 SER 19 HB3 SER 19 29.647 19.149 20.142 148 HG SER 19 HG SER 19 31.244 19.179 21.825 149 H TRP 20 H TRP 20 28.680 20.311 18.342 150 HA TRP 20 HA TRP 20 25.841 19.495 18.185 151 HB2 TRP 20 HB2 TRP 20 26.567 22.033 17.411 152 HB3 TRP 20 HB3 TRP 20 26.761 21.156 15.904 153 HD1 TRP 20 HD1 TRP 20 24.134 21.329 18.744 154 HE1 TRP 20 HE1 TRP 20 21.780 21.596 17.716 155 HE3 TRP 20 HE3 TRP 20 25.371 21.141 13.760 156 HZ2 TRP 20 HZ2 TRP 20 20.589 21.521 15.102 157 HZ3 TRP 20 HZ3 TRP 20 23.600 21.300 12.026 158 HH2 TRP 20 HH2 TRP 20 21.210 21.494 12.681 159 H VAL 21 H VAL 21 25.351 17.979 16.622 160 HA VAL 21 HA VAL 21 27.638 16.416 15.636 161 HB VAL 21 HB VAL 21 24.686 15.800 15.367 162 HG11 VAL 21 HG11 VAL 21 25.504 13.471 15.040 163 HG12 VAL 21 HG12 VAL 21 26.066 14.547 13.767 164 HG13 VAL 21 HG13 VAL 21 27.180 14.063 15.063 165 HG21 VAL 21 HG21 VAL 21 25.241 15.871 17.750 166 HG22 VAL 21 HG22 VAL 21 25.103 14.194 17.237 167 HG23 VAL 21 HG23 VAL 21 26.714 14.914 17.466 168 H THR 22 H THR 22 27.222 17.270 12.137 169 HA THR 22 HA THR 22 29.106 16.376 14.293 170 HB THR 22 HB THR 22 29.384 16.124 11.283 171 HG1 THR 22 HG1 THR 22 27.748 14.777 11.952 172 HG21 THR 22 HG21 THR 22 31.146 14.501 11.834 173 HG22 THR 22 HG22 THR 22 30.892 14.778 13.562 174 HG23 THR 22 HG23 THR 22 31.534 16.081 12.534 175 H CYS 23 H CYS 23 30.899 17.756 14.655 176 HA CYS 23 HA CYS 23 31.140 20.178 12.932 177 HB2 CYS 23 HB2 CYS 23 29.572 20.697 14.762 178 HB3 CYS 23 HB3 CYS 23 30.822 20.266 15.945 179 HG CYS 23 HG CYS 23 31.059 22.462 13.458 180 HA PRO 24 HA PRO 24 35.137 18.235 13.569 181 HB2 PRO 24 HB2 PRO 24 36.031 20.387 11.639 182 HB3 PRO 24 HB3 PRO 24 36.419 18.636 11.632 183 HG2 PRO 24 HG2 PRO 24 34.553 19.607 9.941 184 HG3 PRO 24 HG3 PRO 24 34.247 18.074 10.826 185 HD2 PRO 24 HD2 PRO 24 33.252 20.858 11.485 186 HD3 PRO 24 HD3 PRO 24 32.365 19.304 11.463 187 H TYR 25 H TYR 25 34.408 21.413 14.497 188 HA TYR 25 HA TYR 25 36.970 21.990 15.848 189 HB2 TYR 25 HB2 TYR 25 34.173 23.169 15.981 190 HB3 TYR 25 HB3 TYR 25 35.593 23.901 16.755 191 HD1 TYR 25 HD2 TYR 25 37.702 23.608 14.648 192 HD2 TYR 25 HD1 TYR 25 33.614 24.989 14.426 193 HE1 TYR 25 HE2 TYR 25 38.291 25.046 12.713 194 HE2 TYR 25 HE1 TYR 25 34.224 26.433 12.485 195 HH TYR 25 HH TYR 25 37.555 26.532 11.152 196 H CYS 26 H CYS 26 33.820 20.664 16.770 197 HA CYS 26 HA CYS 26 33.947 21.321 19.550 198 HB2 CYS 26 HB2 CYS 26 32.499 19.444 17.741 199 HB3 CYS 26 HB3 CYS 26 32.329 19.184 19.470 200 HG CYS 26 HG CYS 26 31.237 21.357 20.024 201 H VAL 27 H VAL 27 34.750 18.322 17.852 202 HA VAL 27 HA VAL 27 35.896 16.656 19.676 203 HB VAL 27 HB VAL 27 35.631 16.323 17.463 204 HG11 VAL 27 HG11 VAL 27 36.623 16.864 15.566 205 HG12 VAL 27 HG12 VAL 27 36.011 18.276 16.404 206 HG13 VAL 27 HG13 VAL 27 37.784 17.919 16.388 207 HG21 VAL 27 HG21 VAL 27 37.602 14.959 16.864 208 HG22 VAL 27 HG22 VAL 27 38.598 15.931 17.966 209 HG23 VAL 27 HG23 VAL 27 37.321 14.875 18.611 210 H ARG 28 H ARG 28 37.493 18.868 17.840 211 HA ARG 28 HA ARG 28 40.134 18.883 18.898 212 HB2 ARG 28 HB2 ARG 28 38.988 21.616 18.227 213 HB3 ARG 28 HB3 ARG 28 40.662 21.071 18.147 214 HG2 ARG 28 HG2 ARG 28 39.935 19.527 16.261 215 HG3 ARG 28 HG3 ARG 28 38.364 20.354 16.350 216 HD2 ARG 28 HD2 ARG 28 39.466 22.536 15.979 217 HD3 ARG 28 HD3 ARG 28 41.027 21.717 15.819 218 HE ARG 28 HE ARG 28 39.266 20.475 13.991 219 HH11 ARG 28 HH12 ARG 28 40.698 23.697 14.292 220 HH12 ARG 28 HH11 ARG 28 40.626 23.884 12.534 221 HH21 ARG 28 HH22 ARG 28 39.339 20.837 11.878 222 HH22 ARG 28 HH21 ARG 28 39.835 22.435 11.276 223 H ALA 29 H ALA 29 37.530 20.991 20.096 224 HA ALA 29 HA ALA 29 39.047 22.011 22.343 225 HB1 ALA 29 HB1 ALA 29 36.913 22.942 23.085 226 HB2 ALA 29 HB2 ALA 29 37.167 23.254 21.353 227 HB3 ALA 29 HB3 ALA 29 36.042 21.974 21.874 228 H GLU 30 H GLU 30 36.459 19.465 22.156 229 HA GLU 30 HA GLU 30 36.447 18.809 24.938 230 HB2 GLU 30 HB2 GLU 30 35.926 17.059 22.486 231 HB3 GLU 30 HB3 GLU 30 35.537 16.620 24.153 232 HG2 GLU 30 HG2 GLU 30 33.954 18.519 24.304 233 HG3 GLU 30 HG3 GLU 30 34.301 18.975 22.634 234 H LYS 31 H LYS 31 38.580 17.641 22.401 235 HA LYS 31 HA LYS 31 39.975 15.781 24.066 236 HB2 LYS 31 HB2 LYS 31 39.944 15.621 21.622 237 HB3 LYS 31 HB3 LYS 31 40.615 17.246 21.487 238 HG2 LYS 31 HG2 LYS 31 42.764 16.383 22.547 239 HG3 LYS 31 HG3 LYS 31 42.050 14.759 22.514 240 HD2 LYS 31 HD2 LYS 31 43.470 15.046 20.573 241 HD3 LYS 31 HD3 LYS 31 41.776 14.983 20.048 242 HE2 LYS 31 HE2 LYS 31 41.723 17.459 19.880 243 HE3 LYS 31 HE3 LYS 31 43.408 17.545 20.419 244 HZ1 LYS 31 HZ1 LYS 31 42.419 16.227 17.931 245 HZ2 LYS 31 HZ2 LYS 31 43.254 17.632 18.009 246 HZ3 LYS 31 HZ3 LYS 31 43.971 16.211 18.410 247 H LEU 32 H LEU 32 40.746 19.150 23.108 248 HA LEU 32 HA LEU 32 43.244 19.430 24.471 249 HB2 LEU 32 HB2 LEU 32 42.179 20.822 22.688 250 HB3 LEU 32 HB3 LEU 32 41.074 21.428 23.921 251 HG LEU 32 HG LEU 32 42.792 22.992 23.259 252 HD11 LEU 32 HD11 LEU 32 41.875 23.111 25.586 253 HD12 LEU 32 HD12 LEU 32 43.349 22.277 26.147 254 HD13 LEU 32 HD13 LEU 32 43.468 23.853 25.360 255 HD21 LEU 32 HD21 LEU 32 44.877 21.205 24.536 256 HD22 LEU 32 HD22 LEU 32 44.603 21.371 22.787 257 HD23 LEU 32 HD23 LEU 32 45.123 22.777 23.728 258 H LEU 33 H LEU 33 39.907 20.081 25.550 259 HA LEU 33 HA LEU 33 40.571 21.063 28.136 260 HB2 LEU 33 HB2 LEU 33 38.068 19.687 27.034 261 HB3 LEU 33 HB3 LEU 33 38.097 20.474 28.600 262 HG LEU 33 HG LEU 33 38.651 21.882 25.968 263 HD11 LEU 33 HD11 LEU 33 36.125 22.185 27.525 264 HD12 LEU 33 HD12 LEU 33 36.552 22.850 25.947 265 HD13 LEU 33 HD13 LEU 33 36.314 21.108 26.110 266 HD21 LEU 33 HD21 LEU 33 38.237 23.967 27.265 267 HD22 LEU 33 HD22 LEU 33 38.206 22.993 28.746 268 HD23 LEU 33 HD23 LEU 33 39.693 23.103 27.754 269 H HIS 34 H HIS 34 39.778 17.733 27.093 270 HA HIS 34 HA HIS 34 40.264 16.471 29.637 271 HB2 HIS 34 HB2 HIS 34 40.056 15.597 26.747 272 HB3 HIS 34 HB3 HIS 34 40.744 14.501 27.933 273 HD1 HIS 34 HD1 HIS 34 39.027 12.863 28.690 274 HD2 HIS 34 HD2 HIS 34 37.481 16.724 28.094 275 HE1 HIS 34 HE1 HIS 34 36.563 12.763 29.379 276 H ALA 35 H ALA 35 42.452 17.350 26.900 277 HA ALA 35 HA ALA 35 44.628 15.713 27.792 278 HB1 ALA 35 HB1 ALA 35 45.939 17.010 26.170 279 HB2 ALA 35 HB2 ALA 35 44.363 16.606 25.479 280 HB3 ALA 35 HB3 ALA 35 44.672 18.246 26.086 281 H ARG 36 H ARG 36 43.617 18.952 28.637 282 HA ARG 36 HA ARG 36 46.007 19.344 30.362 283 HB2 ARG 36 HB2 ARG 36 44.168 21.271 28.909 284 HB3 ARG 36 HB3 ARG 36 45.303 21.781 30.135 285 HG2 ARG 36 HG2 ARG 36 45.923 20.634 27.407 286 HG3 ARG 36 HG3 ARG 36 46.390 22.192 28.072 287 HD2 ARG 36 HD2 ARG 36 47.524 19.452 28.638 288 HD3 ARG 36 HD3 ARG 36 48.387 20.873 28.044 289 HE ARG 36 HE ARG 36 47.935 20.068 30.788 290 HH11 ARG 36 HH22 ARG 36 48.543 23.100 29.068 291 HH12 ARG 36 HH21 ARG 36 48.366 23.979 30.583 292 HH21 ARG 36 HH12 ARG 36 47.832 21.201 32.495 293 HH22 ARG 36 HH11 ARG 36 47.971 22.959 32.477 294 H THR 37 H THR 37 43.335 18.181 31.059 295 HA THR 37 HA THR 37 42.471 17.625 33.153 296 HB THR 37 HB THR 37 43.673 19.892 34.606 297 HG1 THR 37 HG1 THR 37 45.611 18.965 34.866 298 HG21 THR 37 HG21 THR 37 44.104 18.089 36.343 299 HG22 THR 37 HG22 THR 37 43.463 16.881 35.211 300 HG23 THR 37 HG23 THR 37 42.406 18.142 35.860 301 H LYS 38 H LYS 38 41.213 19.674 31.342 302 HA LYS 38 HA LYS 38 40.246 21.729 33.188 303 HB2 LYS 38 HB2 LYS 38 39.607 21.112 30.330 304 HB3 LYS 38 HB3 LYS 38 38.570 22.129 31.313 305 HG2 LYS 38 HG2 LYS 38 40.280 23.363 29.908 306 HG3 LYS 38 HG3 LYS 38 40.238 23.802 31.587 307 HD2 LYS 38 HD2 LYS 38 42.299 21.742 30.796 308 HD3 LYS 38 HD3 LYS 38 42.508 23.353 30.162 309 HE2 LYS 38 HE2 LYS 38 42.187 24.278 32.489 310 HE3 LYS 38 HE3 LYS 38 42.263 22.606 33.104 311 HZ1 LYS 38 HZ1 LYS 38 44.497 22.492 32.240 312 HZ2 LYS 38 HZ2 LYS 38 44.443 24.015 31.630 313 HZ3 LYS 38 HZ3 LYS 38 44.376 23.726 33.270 314 H ASP 39 H ASP 39 38.926 21.329 34.696 315 HA ASP 39 HA ASP 39 37.260 19.104 34.859 316 HB2 ASP 39 HB2 ASP 39 38.216 20.475 36.737 317 HB3 ASP 39 HB3 ASP 39 37.080 21.761 36.365 318 H ILE 40 H ILE 40 35.869 18.763 33.269 319 HA ILE 40 HA ILE 40 34.211 21.002 32.254 320 HB ILE 40 HB ILE 40 36.319 20.430 31.111 321 HG12 ILE 40 HG12 ILE 40 33.845 21.096 29.909 322 HG13 ILE 40 HG13 ILE 40 35.487 21.518 29.462 323 HG21 ILE 40 HG21 ILE 40 36.256 17.980 31.411 324 HG22 ILE 40 HG22 ILE 40 34.979 17.853 30.208 325 HG23 ILE 40 HG23 ILE 40 36.593 18.458 29.754 326 HD11 ILE 40 HD11 ILE 40 35.650 19.624 27.951 327 HD12 ILE 40 HD12 ILE 40 34.044 19.040 28.472 328 HD13 ILE 40 HD13 ILE 40 34.199 20.567 27.593 329 H THR 41 H THR 41 32.259 20.824 31.484 330 HA THR 41 HA THR 41 30.901 18.164 31.127 331 HB THR 41 HB THR 41 29.840 20.871 32.028 332 HG1 THR 41 HG1 THR 41 29.169 19.760 33.769 333 HG21 THR 41 HG21 THR 41 28.167 20.062 30.492 334 HG22 THR 41 HG22 THR 41 27.593 19.777 32.134 335 HG23 THR 41 HG23 THR 41 28.247 18.419 31.190 336 H VAL 42 H VAL 42 30.521 17.799 28.884 337 HA VAL 42 HA VAL 42 29.763 20.169 27.282 338 HB VAL 42 HB VAL 42 31.595 19.584 26.207 339 HG11 VAL 42 HG11 VAL 42 31.241 16.719 26.837 340 HG12 VAL 42 HG12 VAL 42 32.468 17.386 25.720 341 HG13 VAL 42 HG13 VAL 42 32.452 17.930 27.393 342 HG21 VAL 42 HG21 VAL 42 31.140 18.628 24.105 343 HG22 VAL 42 HG22 VAL 42 29.740 17.737 24.718 344 HG23 VAL 42 HG23 VAL 42 29.710 19.519 24.596 345 H HIS 43 H HIS 43 27.940 20.287 26.308 346 HA HIS 43 HA HIS 43 26.019 18.008 26.408 347 HB2 HIS 43 HB2 HIS 43 25.556 20.085 27.764 348 HB3 HIS 43 HB3 HIS 43 25.547 21.006 26.282 349 HD1 HIS 43 HD1 HIS 43 23.691 17.622 26.268 350 HD2 HIS 43 HD2 HIS 43 23.005 21.740 26.867 351 HE1 HIS 43 HE1 HIS 43 21.170 17.947 26.270 352 H TYR 44 H TYR 44 25.228 17.221 24.497 353 HA TYR 44 HA TYR 44 25.627 18.758 21.949 354 HB2 TYR 44 HB2 TYR 44 25.133 15.847 22.497 355 HB3 TYR 44 HB3 TYR 44 24.788 16.596 20.947 356 HD1 TYR 44 HD1 TYR 44 27.595 16.206 23.406 357 HD2 TYR 44 HD2 TYR 44 26.466 17.247 19.413 358 HE1 TYR 44 HE1 TYR 44 30.002 16.270 22.726 359 HE2 TYR 44 HE2 TYR 44 28.832 16.988 18.649 360 HH TYR 44 HH TYR 44 31.430 16.810 21.019 361 H VAL 45 H VAL 45 24.070 20.307 22.019 362 HA VAL 45 HA VAL 45 21.307 19.786 22.730 363 HB VAL 45 HB VAL 45 20.827 22.030 21.805 364 HG11 VAL 45 HG11 VAL 45 21.969 23.299 23.536 365 HG12 VAL 45 HG12 VAL 45 21.486 21.738 24.187 366 HG13 VAL 45 HG13 VAL 45 23.190 22.020 23.730 367 HG21 VAL 45 HG21 VAL 45 22.523 22.215 20.051 368 HG22 VAL 45 HG22 VAL 45 22.657 23.538 21.197 369 HG23 VAL 45 HG23 VAL 45 23.826 22.206 21.268 370 H ASP 46 H ASP 46 22.920 18.709 20.074 371 HA ASP 46 HA ASP 46 20.794 18.763 18.074 372 HB2 ASP 46 HB2 ASP 46 23.127 18.581 17.425 373 HB3 ASP 46 HB3 ASP 46 23.352 17.169 18.453 374 H LYS 47 H LYS 47 21.532 16.755 20.854 375 HA LYS 47 HA LYS 47 20.401 14.315 19.752 376 HB2 LYS 47 HB2 LYS 47 21.567 15.095 22.446 377 HB3 LYS 47 HB3 LYS 47 21.030 13.464 22.105 378 HG2 LYS 47 HG2 LYS 47 23.167 14.897 20.472 379 HG3 LYS 47 HG3 LYS 47 23.502 13.852 21.856 380 HD2 LYS 47 HD2 LYS 47 22.364 11.954 20.696 381 HD3 LYS 47 HD3 LYS 47 22.036 13.013 19.318 382 HE2 LYS 47 HE2 LYS 47 24.600 13.378 19.208 383 HE3 LYS 47 HE3 LYS 47 24.718 11.991 20.302 384 HZ1 LYS 47 HZ1 LYS 47 23.382 10.731 18.662 385 HZ2 LYS 47 HZ2 LYS 47 23.389 12.001 17.643 386 HZ3 LYS 47 HZ3 LYS 47 24.805 11.222 18.006 387 H MET 48 H MET 48 19.267 16.514 22.293 388 HA MET 48 HA MET 48 16.707 14.978 22.385 389 HB2 MET 48 HB2 MET 48 16.379 15.808 24.626 390 HB3 MET 48 HB3 MET 48 17.896 14.938 24.454 391 HG2 MET 48 HG2 MET 48 18.350 16.760 25.852 392 HG3 MET 48 HG3 MET 48 19.095 17.158 24.307 393 HE1 MET 48 HE1 MET 48 18.004 20.603 25.928 394 HE2 MET 48 HE2 MET 48 18.681 19.155 26.699 395 HE3 MET 48 HE3 MET 48 19.346 19.733 25.152 396 H SER 49 H SER 49 14.709 16.116 22.708 397 HA SER 49 HA SER 49 14.138 17.741 20.532 398 HB2 SER 49 HB2 SER 49 12.600 17.572 23.155 399 HB3 SER 49 HB3 SER 49 11.938 18.090 21.594 400 HG SER 49 HG SER 49 11.995 15.668 22.525 401 H GLU 50 H GLU 50 14.738 18.885 23.848 402 HA GLU 50 HA GLU 50 13.749 21.556 23.338 403 HB2 GLU 50 HB2 GLU 50 15.318 20.372 25.660 404 HB3 GLU 50 HB3 GLU 50 14.591 21.976 25.680 405 HG2 GLU 50 HG2 GLU 50 12.344 20.957 25.400 406 HG3 GLU 50 HG3 GLU 50 13.058 19.351 25.276 407 H GLY 51 H GLY 51 16.863 20.139 22.851 408 HA2 GLY 51 HA2 GLY 51 18.657 22.128 23.437 409 HA3 GLY 51 HA3 GLY 51 18.815 20.997 22.101 410 H GLU 52 H GLU 52 16.393 22.227 20.722 411 HA GLU 52 HA GLU 52 17.819 24.188 19.113 412 HB2 GLU 52 HB2 GLU 52 14.845 23.619 19.250 413 HB3 GLU 52 HB3 GLU 52 15.677 24.493 17.970 414 HG2 GLU 52 HG2 GLU 52 16.131 21.547 18.628 415 HG3 GLU 52 HG3 GLU 52 15.023 22.159 17.417 416 H GLN 53 H GLN 53 15.604 24.429 21.870 417 HA GLN 53 HA GLN 53 15.248 27.328 21.761 418 HB2 GLN 53 HB2 GLN 53 13.567 25.797 22.727 419 HB3 GLN 53 HB3 GLN 53 14.737 25.247 23.927 420 HG2 GLN 53 HG2 GLN 53 14.827 27.564 24.878 421 HG3 GLN 53 HG3 GLN 53 13.584 28.053 23.723 422 HE21 GLN 53 HE21 GLN 53 11.395 27.652 24.336 423 HE22 GLN 53 HE22 GLN 53 11.012 26.817 25.843 424 H LEU 54 H LEU 54 17.404 25.046 23.504 425 HA LEU 54 HA LEU 54 18.682 27.115 25.088 426 HB2 LEU 54 HB2 LEU 54 19.594 24.269 24.468 427 HB3 LEU 54 HB3 LEU 54 20.343 25.360 25.633 428 HG LEU 54 HG LEU 54 19.080 23.916 26.930 429 HD11 LEU 54 HD11 LEU 54 18.689 26.441 27.330 430 HD12 LEU 54 HD12 LEU 54 17.082 26.172 26.651 431 HD13 LEU 54 HD13 LEU 54 17.586 25.285 28.111 432 HD21 LEU 54 HD21 LEU 54 17.639 22.891 25.238 433 HD22 LEU 54 HD22 LEU 54 16.813 23.276 26.747 434 HD23 LEU 54 HD23 LEU 54 16.550 24.299 25.335 435 H ARG 55 H ARG 55 19.448 25.615 21.948 436 HA ARG 55 HA ARG 55 21.822 27.086 21.318 437 HB2 ARG 55 HB2 ARG 55 21.234 25.160 20.106 438 HB3 ARG 55 HB3 ARG 55 19.563 25.663 19.897 439 HG2 ARG 55 HG2 ARG 55 20.075 27.218 18.239 440 HG3 ARG 55 HG3 ARG 55 21.843 27.011 18.439 441 HD2 ARG 55 HD2 ARG 55 21.722 24.698 17.713 442 HD3 ARG 55 HD3 ARG 55 19.968 24.691 17.781 443 HE ARG 55 HE ARG 55 21.345 26.525 15.840 444 HH11 ARG 55 HH12 ARG 55 19.235 23.637 16.123 445 HH12 ARG 55 HH11 ARG 55 19.103 23.587 14.389 446 HH21 ARG 55 HH22 ARG 55 21.085 26.309 13.796 447 HH22 ARG 55 HH21 ARG 55 20.181 24.996 13.074 448 H GLY 56 H GLY 56 18.378 27.973 21.153 449 HA2 GLY 56 HA2 GLY 56 18.638 30.580 20.032 450 HA3 GLY 56 HA3 GLY 56 17.361 30.025 21.115 451 H GLU 57 H GLU 57 19.241 29.511 23.438 452 HA GLU 57 HA GLU 57 19.405 32.201 24.558 453 HB2 GLU 57 HB2 GLU 57 20.713 29.646 25.509 454 HB3 GLU 57 HB3 GLU 57 20.694 31.167 26.368 455 HG2 GLU 57 HG2 GLU 57 18.287 29.445 25.695 456 HG3 GLU 57 HG3 GLU 57 19.035 29.742 27.264 457 H ILE 58 H ILE 58 21.810 29.915 23.204 458 HA ILE 58 HA ILE 58 24.090 31.592 23.564 459 HB ILE 58 HB ILE 58 23.725 29.489 21.394 460 HG12 ILE 58 HG12 ILE 58 24.766 29.072 24.239 461 HG13 ILE 58 HG13 ILE 58 23.182 28.552 23.662 462 HG21 ILE 58 HG21 ILE 58 26.144 29.308 21.412 463 HG22 ILE 58 HG22 ILE 58 25.761 31.008 21.232 464 HG23 ILE 58 HG23 ILE 58 26.278 30.395 22.814 465 HD11 ILE 58 HD11 ILE 58 24.591 26.643 23.659 466 HD12 ILE 58 HD12 ILE 58 24.300 27.087 21.966 467 HD13 ILE 58 HD13 ILE 58 25.858 27.470 22.742 468 H TYR 59 H TYR 59 21.836 31.252 20.768 469 HA TYR 59 HA TYR 59 23.284 33.098 19.174 470 HB2 TYR 59 HB2 TYR 59 21.370 31.363 18.569 471 HB3 TYR 59 HB3 TYR 59 20.342 32.788 18.696 472 HD1 TYR 59 HD1 TYR 59 20.972 34.869 17.262 473 HD2 TYR 59 HD2 TYR 59 22.898 31.032 16.821 474 HE1 TYR 59 HE1 TYR 59 21.980 35.623 15.107 475 HE2 TYR 59 HE2 TYR 59 23.897 31.782 14.670 476 HH TYR 59 HH TYR 59 23.422 35.066 13.318 477 H GLN 60 H GLN 60 20.397 33.734 21.264 478 HA GLN 60 HA GLN 60 20.087 36.450 20.484 479 HB2 GLN 60 HB2 GLN 60 19.455 34.973 23.069 480 HB3 GLN 60 HB3 GLN 60 19.007 36.663 22.815 481 HG2 GLN 60 HG2 GLN 60 17.539 36.124 20.988 482 HG3 GLN 60 HG3 GLN 60 18.106 34.452 20.925 483 HE21 GLN 60 HE21 GLN 60 17.644 33.060 22.801 484 HE22 GLN 60 HE22 GLN 60 16.267 33.454 23.864 485 H ALA 61 H ALA 61 22.203 35.052 23.034 486 HA ALA 61 HA ALA 61 23.140 37.689 23.878 487 HB1 ALA 61 HB1 ALA 61 24.591 36.328 25.350 488 HB2 ALA 61 HB2 ALA 61 22.885 35.850 25.441 489 HB3 ALA 61 HB3 ALA 61 24.016 34.857 24.521 490 H TYR 62 H TYR 62 24.635 34.994 21.956 491 HA TYR 62 HA TYR 62 27.044 36.718 21.618 492 HB2 TYR 62 HB2 TYR 62 26.979 33.708 21.530 493 HB3 TYR 62 HB3 TYR 62 28.362 34.769 21.751 494 HD1 TYR 62 HD1 TYR 62 28.268 36.332 23.946 495 HD2 TYR 62 HD2 TYR 62 25.991 32.724 23.399 496 HE1 TYR 62 HE1 TYR 62 27.796 36.253 26.393 497 HE2 TYR 62 HE2 TYR 62 25.479 32.665 25.834 498 HH TYR 62 HH TYR 62 25.558 33.835 27.787 499 H LYS 63 H LYS 63 24.511 35.782 19.769 500 HA LYS 63 HA LYS 63 24.004 35.454 17.643 501 HB2 LYS 63 HB2 LYS 63 26.386 37.255 17.109 502 HB3 LYS 63 HB3 LYS 63 25.121 36.894 15.943 503 HG2 LYS 63 HG2 LYS 63 24.653 38.311 18.597 504 HG3 LYS 63 HG3 LYS 63 24.870 39.089 17.029 505 HD2 LYS 63 HD2 LYS 63 22.817 38.029 16.158 506 HD3 LYS 63 HD3 LYS 63 22.608 37.152 17.676 507 HE2 LYS 63 HE2 LYS 63 21.124 38.992 17.778 508 HE3 LYS 63 HE3 LYS 63 22.447 39.322 18.899 509 HZ1 LYS 63 HZ1 LYS 63 23.423 40.764 17.144 510 HZ2 LYS 63 HZ2 LYS 63 22.079 40.515 16.202 511 HZ3 LYS 63 HZ3 LYS 63 21.967 41.279 17.652 512 H HIS 64 H HIS 64 25.467 33.337 18.677 513 HA HIS 64 HA HIS 64 26.368 32.062 16.155 514 HB2 HIS 64 HB2 HIS 64 27.918 32.133 18.776 515 HB3 HIS 64 HB3 HIS 64 28.179 30.908 17.537 516 HD1 HIS 64 HD1 HIS 64 28.501 34.757 17.895 517 HD2 HIS 64 HD2 HIS 64 29.630 31.533 15.437 518 HE1 HIS 64 HE1 HIS 64 30.138 35.698 16.176 519 H GLU 65 H GLU 65 26.133 29.807 16.131 520 HA GLU 65 HA GLU 65 24.460 28.623 18.315 521 HB2 GLU 65 HB2 GLU 65 23.520 27.093 16.660 522 HB3 GLU 65 HB3 GLU 65 23.102 28.783 16.403 523 HG2 GLU 65 HG2 GLU 65 24.764 28.919 14.553 524 HG3 GLU 65 HG3 GLU 65 25.200 27.223 14.831 525 H THR 66 H THR 66 27.327 28.217 16.299 526 HA THR 66 HA THR 66 28.427 26.557 18.398 527 HB THR 66 HB THR 66 27.397 24.779 17.052 528 HG1 THR 66 HG1 THR 66 29.427 23.651 16.766 529 HG21 THR 66 HG21 THR 66 27.614 25.787 14.766 530 HG22 THR 66 HG22 THR 66 28.264 24.145 14.876 531 HG23 THR 66 HG23 THR 66 29.371 25.532 14.848 532 H VAL 67 H VAL 67 30.647 26.303 18.294 533 HA VAL 67 HA VAL 67 32.279 27.521 16.280 534 HB VAL 67 HB VAL 67 33.241 28.774 18.724 535 HG11 VAL 67 HG11 VAL 67 32.484 29.907 16.015 536 HG12 VAL 67 HG12 VAL 67 33.498 30.686 17.248 537 HG13 VAL 67 HG13 VAL 67 34.061 29.212 16.450 538 HG21 VAL 67 HG21 VAL 67 31.722 30.644 18.897 539 HG22 VAL 67 HG22 VAL 67 30.617 29.924 17.717 540 HG23 VAL 67 HG23 VAL 67 30.865 29.157 19.308 541 HA PRO 68 HA PRO 68 31.086 25.239 19.388 542 HB2 PRO 68 HB2 PRO 68 32.089 24.359 21.763 543 HB3 PRO 68 HB3 PRO 68 31.991 23.358 20.299 544 HG2 PRO 68 HG2 PRO 68 34.371 24.942 21.302 545 HG3 PRO 68 HG3 PRO 68 34.321 23.214 20.825 546 HD2 PRO 68 HD2 PRO 68 35.162 25.072 19.083 547 HD3 PRO 68 HD3 PRO 68 34.070 23.769 18.532 548 H ALA 69 H ALA 69 30.119 25.952 21.451 549 HA ALA 69 HA ALA 69 31.062 28.643 22.313 550 HB1 ALA 69 HB1 ALA 69 28.814 28.825 23.319 551 HB2 ALA 69 HB2 ALA 69 28.706 28.444 21.593 552 HB3 ALA 69 HB3 ALA 69 28.436 27.170 22.803 553 H ILE 70 H ILE 70 32.218 28.813 24.144 554 HA ILE 70 HA ILE 70 32.377 26.487 26.021 555 HB ILE 70 HB ILE 70 34.572 28.317 24.981 556 HG12 ILE 70 HG12 ILE 70 34.555 25.333 24.488 557 HG13 ILE 70 HG13 ILE 70 33.652 26.380 23.404 558 HG21 ILE 70 HG21 ILE 70 34.707 25.981 26.934 559 HG22 ILE 70 HG22 ILE 70 36.124 26.754 26.204 560 HG23 ILE 70 HG23 ILE 70 35.081 27.685 27.266 561 HD11 ILE 70 HD11 ILE 70 35.953 25.948 22.585 562 HD12 ILE 70 HD12 ILE 70 35.618 27.673 22.840 563 HD13 ILE 70 HD13 ILE 70 36.592 26.770 24.012 564 H PHE 71 H PHE 71 32.289 26.966 28.177 565 HA PHE 71 HA PHE 71 32.447 29.825 28.976 566 HB2 PHE 71 HB2 PHE 71 30.333 27.809 29.781 567 HB3 PHE 71 HB3 PHE 71 30.542 29.418 30.466 568 HD1 PHE 71 HD1 PHE 71 29.742 27.628 27.267 569 HD2 PHE 71 HD2 PHE 71 29.458 31.297 29.519 570 HE1 PHE 71 HE1 PHE 71 28.200 28.567 25.562 571 HE2 PHE 71 HE2 PHE 71 27.865 32.196 27.842 572 HZ PHE 71 HZ PHE 71 27.246 30.829 25.852 573 H ILE 72 H ILE 72 33.196 30.297 30.981 574 HA ILE 72 HA ILE 72 34.135 28.082 32.748 575 HB ILE 72 HB ILE 72 35.822 30.483 31.945 576 HG12 ILE 72 HG12 ILE 72 36.137 27.515 31.261 577 HG13 ILE 72 HG13 ILE 72 35.695 28.787 30.131 578 HG21 ILE 72 HG21 ILE 72 36.394 28.098 33.790 579 HG22 ILE 72 HG22 ILE 72 37.569 29.348 33.342 580 HG23 ILE 72 HG23 ILE 72 36.178 29.782 34.308 581 HD11 ILE 72 HD11 ILE 72 37.911 29.875 30.492 582 HD12 ILE 72 HD12 ILE 72 38.397 28.461 31.467 583 HD13 ILE 72 HD13 ILE 72 37.983 28.261 29.762 584 H ASN 73 H ASN 73 33.327 28.354 34.735 585 HA ASN 73 HA ASN 73 32.094 29.243 36.431 586 HB2 ASN 73 HB2 ASN 73 34.196 31.439 36.219 587 HB3 ASN 73 HB3 ASN 73 33.186 31.126 37.615 588 HD21 ASN 73 HD21 ASN 73 36.145 31.008 37.317 589 HD22 ASN 73 HD22 ASN 73 36.545 29.437 38.012 590 H GLY 74 H GLY 74 30.767 29.810 34.043 591 HA2 GLY 74 HA2 GLY 74 28.790 30.967 33.524 592 HA3 GLY 74 HA3 GLY 74 29.137 32.126 34.792 593 H ASN 75 H ASN 75 31.934 32.128 32.959 594 HA ASN 75 HA ASN 75 31.073 34.465 31.312 595 HB2 ASN 75 HB2 ASN 75 33.753 33.533 32.422 596 HB3 ASN 75 HB3 ASN 75 33.609 34.844 31.273 597 HD21 ASN 75 HD21 ASN 75 34.367 34.646 34.301 598 HD22 ASN 75 HD22 ASN 75 33.418 35.988 34.949 599 H PHE 76 H PHE 76 31.736 34.679 29.119 600 HA PHE 76 HA PHE 76 31.770 32.061 27.729 601 HB2 PHE 76 HB2 PHE 76 29.873 33.484 27.355 602 HB3 PHE 76 HB3 PHE 76 30.898 34.846 26.951 603 HD1 PHE 76 HD1 PHE 76 30.431 31.274 25.788 604 HD2 PHE 76 HD2 PHE 76 31.088 35.394 24.692 605 HE1 PHE 76 HE1 PHE 76 30.372 30.653 23.393 606 HE2 PHE 76 HE2 PHE 76 31.045 34.759 22.297 607 HZ PHE 76 HZ PHE 76 30.677 32.390 21.638 608 H ILE 77 H ILE 77 33.059 31.408 26.164 609 HA ILE 77 HA ILE 77 35.005 33.145 24.775 610 HB ILE 77 HB ILE 77 35.677 30.321 25.710 611 HG12 ILE 77 HG12 ILE 77 37.569 31.705 26.990 612 HG13 ILE 77 HG13 ILE 77 36.349 32.964 27.014 613 HG21 ILE 77 HG21 ILE 77 37.399 32.472 24.411 614 HG22 ILE 77 HG22 ILE 77 37.942 30.859 24.908 615 HG23 ILE 77 HG23 ILE 77 36.779 31.016 23.603 616 HD11 ILE 77 HD11 ILE 77 36.068 30.120 28.113 617 HD12 ILE 77 HD12 ILE 77 36.371 31.579 29.075 618 HD13 ILE 77 HD13 ILE 77 34.821 31.372 28.252 619 H GLY 78 H GLY 78 34.875 32.786 22.480 620 HA2 GLY 78 HA2 GLY 78 33.571 30.205 21.609 621 HA3 GLY 78 HA3 GLY 78 33.327 31.734 20.794 622 H GLY 79 H GLY 79 34.966 28.911 20.704 623 HA2 GLY 79 HA2 GLY 79 35.902 28.506 18.416 624 HA3 GLY 79 HA3 GLY 79 36.954 29.889 18.693 625 H CYS 80 H CYS 80 37.533 26.921 18.217 626 HA CYS 80 HA CYS 80 38.742 25.950 20.696 627 HB2 CYS 80 HB2 CYS 80 38.007 24.455 18.800 628 HB3 CYS 80 HB3 CYS 80 39.387 25.065 17.856 629 HG CYS 80 HG CYS 80 41.228 24.455 19.713 630 H SER 81 H SER 81 39.961 27.795 17.862 631 HA SER 81 HA SER 81 42.703 27.861 18.798 632 HB2 SER 81 HB2 SER 81 41.359 29.781 16.876 633 HB3 SER 81 HB3 SER 81 43.088 29.406 17.025 634 HG SER 81 HG SER 81 42.325 27.138 16.574 635 H ASP 82 H ASP 82 39.859 29.868 19.313 636 HA ASP 82 HA ASP 82 41.093 32.045 20.706 637 HB2 ASP 82 HB2 ASP 82 38.672 31.645 19.720 638 HB3 ASP 82 HB3 ASP 82 38.301 30.966 21.282 639 H LEU 83 H LEU 83 39.693 29.001 21.797 640 HA LEU 83 HA LEU 83 40.248 29.237 24.619 641 HB2 LEU 83 HB2 LEU 83 38.598 27.689 23.819 642 HB3 LEU 83 HB3 LEU 83 39.733 26.916 22.729 643 HG LEU 83 HG LEU 83 41.012 26.028 24.688 644 HD11 LEU 83 HD11 LEU 83 40.308 27.625 26.422 645 HD12 LEU 83 HD12 LEU 83 38.624 27.073 26.272 646 HD13 LEU 83 HD13 LEU 83 39.880 25.974 26.890 647 HD21 LEU 83 HD21 LEU 83 39.500 24.231 25.163 648 HD22 LEU 83 HD22 LEU 83 38.095 25.195 24.661 649 HD23 LEU 83 HD23 LEU 83 39.316 24.694 23.468 650 H GLU 84 H GLU 84 42.096 27.531 22.003 651 HA GLU 84 HA GLU 84 44.276 26.806 23.727 652 HB2 GLU 84 HB2 GLU 84 44.164 27.150 20.706 653 HB3 GLU 84 HB3 GLU 84 45.570 26.551 21.612 654 HG2 GLU 84 HG2 GLU 84 44.336 24.665 22.470 655 HG3 GLU 84 HG3 GLU 84 42.863 25.188 21.656 656 H ALA 85 H ALA 85 43.617 29.844 21.965 657 HA ALA 85 HA ALA 85 46.186 31.004 22.274 658 HB1 ALA 85 HB1 ALA 85 44.963 33.168 22.040 659 HB2 ALA 85 HB2 ALA 85 44.456 31.974 20.834 660 HB3 ALA 85 HB3 ALA 85 43.419 32.309 22.234 661 H LEU 86 H LEU 86 43.487 30.793 24.605 662 HA LEU 86 HA LEU 86 44.792 32.324 26.703 663 HB2 LEU 86 HB2 LEU 86 42.525 30.289 26.800 664 HB3 LEU 86 HB3 LEU 86 43.036 31.295 28.144 665 HG LEU 86 HG LEU 86 41.876 32.338 25.526 666 HD11 LEU 86 HD11 LEU 86 39.907 32.869 26.894 667 HD12 LEU 86 HD12 LEU 86 40.240 31.132 26.921 668 HD13 LEU 86 HD13 LEU 86 40.676 32.143 28.321 669 HD21 LEU 86 HD21 LEU 86 41.702 34.494 26.754 670 HD22 LEU 86 HD22 LEU 86 42.617 33.796 28.103 671 HD23 LEU 86 HD23 LEU 86 43.377 34.014 26.503 672 H ASP 87 H ASP 87 44.805 28.892 25.767 673 HA ASP 87 HA ASP 87 46.225 27.928 28.091 674 HB2 ASP 87 HB2 ASP 87 45.048 26.458 26.474 675 HB3 ASP 87 HB3 ASP 87 46.278 26.817 25.269 676 H LYS 88 H LYS 88 47.324 29.186 24.966 677 HA LYS 88 HA LYS 88 50.154 29.057 25.545 678 HB2 LYS 88 HB2 LYS 88 48.489 30.557 23.495 679 HB3 LYS 88 HB3 LYS 88 50.205 30.893 23.688 680 HG2 LYS 88 HG2 LYS 88 50.142 29.351 21.965 681 HG3 LYS 88 HG3 LYS 88 50.673 28.429 23.369 682 HD2 LYS 88 HD2 LYS 88 48.363 27.485 23.605 683 HD3 LYS 88 HD3 LYS 88 47.872 28.452 22.181 684 HE2 LYS 88 HE2 LYS 88 49.615 27.339 20.820 685 HE3 LYS 88 HE3 LYS 88 50.040 26.325 22.206 686 HZ1 LYS 88 HZ1 LYS 88 47.730 25.459 22.134 687 HZ2 LYS 88 HZ2 LYS 88 47.473 26.318 20.730 688 HZ3 LYS 88 HZ3 LYS 88 48.582 25.132 20.770 689 H GLU 89 H GLU 89 47.785 31.417 26.536 690 HA GLU 89 HA GLU 89 49.897 33.180 27.676 691 HB2 GLU 89 HB2 GLU 89 46.874 33.460 27.716 692 HB3 GLU 89 HB3 GLU 89 48.046 34.594 28.402 693 HG2 GLU 89 HG2 GLU 89 49.045 34.805 26.059 694 HG3 GLU 89 HG3 GLU 89 47.573 34.005 25.487 695 H GLY 90 H GLY 90 48.876 30.258 28.688 696 HA2 GLY 90 HA2 GLY 90 49.033 29.234 30.748 697 HA3 GLY 90 HA3 GLY 90 49.632 30.748 31.415 698 H LYS 91 H LYS 91 46.539 31.157 29.959 699 HA LYS 91 HA LYS 91 45.445 31.796 32.645 700 HB2 LYS 91 HB2 LYS 91 44.955 32.640 29.786 701 HB3 LYS 91 HB3 LYS 91 43.622 32.752 30.923 702 HG2 LYS 91 HG2 LYS 91 44.956 34.112 32.465 703 HG3 LYS 91 HG3 LYS 91 46.354 34.016 31.388 704 HD2 LYS 91 HD2 LYS 91 43.671 35.226 30.562 705 HD3 LYS 91 HD3 LYS 91 44.995 36.153 31.278 706 HE2 LYS 91 HE2 LYS 91 46.511 35.400 29.456 707 HE3 LYS 91 HE3 LYS 91 45.158 34.538 28.694 708 HZ1 LYS 91 HZ1 LYS 91 45.429 36.670 27.660 709 HZ2 LYS 91 HZ2 LYS 91 44.025 36.704 28.519 710 HZ3 LYS 91 HZ3 LYS 91 45.349 37.470 29.103 711 H LEU 92 H LEU 92 45.129 29.259 30.375 712 HA LEU 92 HA LEU 92 42.446 28.481 31.275 713 HB2 LEU 92 HB2 LEU 92 43.368 28.115 28.950 714 HB3 LEU 92 HB3 LEU 92 44.529 26.985 29.624 715 HG LEU 92 HG LEU 92 42.677 25.535 30.399 716 HD11 LEU 92 HD11 LEU 92 40.880 27.545 28.988 717 HD12 LEU 92 HD12 LEU 92 40.372 25.918 29.485 718 HD13 LEU 92 HD13 LEU 92 40.840 27.097 30.710 719 HD21 LEU 92 HD21 LEU 92 41.975 24.754 28.142 720 HD22 LEU 92 HD22 LEU 92 42.550 26.284 27.445 721 HD23 LEU 92 HD23 LEU 92 43.699 25.156 28.193 722 H ASP 93 H ASP 93 45.824 27.636 31.978 723 HA ASP 93 HA ASP 93 45.148 25.854 34.202 724 HB2 ASP 93 HB2 ASP 93 47.662 27.316 33.330 725 HB3 ASP 93 HB3 ASP 93 47.549 26.461 34.856 726 H GLY 94 H GLY 94 45.890 29.350 33.881 727 HA2 GLY 94 HA2 GLY 94 45.776 29.948 36.648 728 HA3 GLY 94 HA3 GLY 94 45.529 31.102 35.331 729 H LEU 95 H LEU 95 43.068 29.489 34.394 730 HA LEU 95 HA LEU 95 41.115 30.597 36.301 731 HB2 LEU 95 HB2 LEU 95 41.059 29.370 33.532 732 HB3 LEU 95 HB3 LEU 95 39.563 29.533 34.471 733 HG LEU 95 HG LEU 95 41.404 31.896 33.908 734 HD11 LEU 95 HD11 LEU 95 39.865 32.527 32.125 735 HD12 LEU 95 HD12 LEU 95 40.557 30.936 31.781 736 HD13 LEU 95 HD13 LEU 95 38.891 31.068 32.397 737 HD21 LEU 95 HD21 LEU 95 39.357 33.217 34.386 738 HD22 LEU 95 HD22 LEU 95 38.482 31.724 34.786 739 HD23 LEU 95 HD23 LEU 95 39.848 32.268 35.784 740 H LEU 96 H LEU 96 42.477 27.461 35.506 741 HA LEU 96 HA LEU 96 40.412 26.014 37.085 742 HB2 LEU 96 HB2 LEU 96 42.581 25.299 35.119 743 HB3 LEU 96 HB3 LEU 96 41.800 24.026 35.991 744 HG LEU 96 HG LEU 96 41.029 25.150 33.630 745 HD11 LEU 96 HD11 LEU 96 39.029 23.864 35.557 746 HD12 LEU 96 HD12 LEU 96 39.056 23.691 33.792 747 HD13 LEU 96 HD13 LEU 96 40.330 22.958 34.802 748 HD21 LEU 96 HD21 LEU 96 38.754 26.038 33.737 749 HD22 LEU 96 HD22 LEU 96 38.979 26.370 35.460 750 HD23 LEU 96 HD23 LEU 96 40.005 27.153 34.227 751 H SER 97 H SER 97 43.552 27.163 37.546 752 HA SER 97 HA SER 97 44.294 25.483 39.800 753 HB2 SER 97 HB2 SER 97 45.141 28.311 39.060 754 HB3 SER 97 HB3 SER 97 45.838 27.353 40.385 755 HG SER 97 HG SER 97 45.804 26.794 37.607 Start of MODEL 15 1 H1 GLY 1 H1 GLY 1 5.024 32.693 37.196 2 H2 GLY 1 H2 GLY 1 5.450 34.279 37.062 3 H3 GLY 1 H3 GLY 1 5.535 33.515 38.516 4 HA2 GLY 1 HA2 GLY 1 7.726 33.816 37.566 5 HA3 GLY 1 HA3 GLY 1 7.291 32.111 37.795 6 H ALA 2 H ALA 2 9.279 32.863 36.110 7 HA ALA 2 HA ALA 2 8.279 32.281 33.349 8 HB1 ALA 2 HB1 ALA 2 9.343 34.483 33.571 9 HB2 ALA 2 HB2 ALA 2 10.784 33.740 34.299 10 HB3 ALA 2 HB3 ALA 2 10.368 33.403 32.608 11 H MET 3 H MET 3 9.913 31.020 32.013 12 HA MET 3 HA MET 3 10.560 28.556 33.413 13 HB2 MET 3 HB2 MET 3 10.989 29.447 30.541 14 HB3 MET 3 HB3 MET 3 11.367 27.831 31.127 15 HG2 MET 3 HG2 MET 3 8.610 29.094 31.231 16 HG3 MET 3 HG3 MET 3 9.175 28.001 29.974 17 HE1 MET 3 HE1 MET 3 6.919 26.663 30.392 18 HE2 MET 3 HE2 MET 3 6.454 25.974 31.963 19 HE3 MET 3 HE3 MET 3 6.493 27.736 31.745 20 HA PRO 4 HA PRO 4 15.042 29.239 33.842 21 HB2 PRO 4 HB2 PRO 4 15.956 26.700 34.106 22 HB3 PRO 4 HB3 PRO 4 14.937 27.471 35.358 23 HG2 PRO 4 HG2 PRO 4 14.059 25.584 33.147 24 HG3 PRO 4 HG3 PRO 4 13.673 25.502 34.896 25 HD2 PRO 4 HD2 PRO 4 11.986 26.631 33.052 26 HD3 PRO 4 HD3 PRO 4 12.099 27.221 34.736 27 H SER 5 H SER 5 17.121 28.491 32.731 28 HA SER 5 HA SER 5 16.885 27.255 30.081 29 HB2 SER 5 HB2 SER 5 17.913 29.041 28.865 30 HB3 SER 5 HB3 SER 5 16.518 29.736 29.666 31 HG SER 5 HG SER 5 18.300 31.080 29.966 32 H ILE 6 H ILE 6 19.212 27.274 29.024 33 HA ILE 6 HA ILE 6 20.946 25.800 30.640 34 HB ILE 6 HB ILE 6 22.503 25.790 29.002 35 HG12 ILE 6 HG12 ILE 6 21.476 28.409 27.998 36 HG13 ILE 6 HG13 ILE 6 23.092 28.015 28.530 37 HG21 ILE 6 HG21 ILE 6 21.420 24.983 27.215 38 HG22 ILE 6 HG22 ILE 6 20.239 24.826 28.517 39 HG23 ILE 6 HG23 ILE 6 20.103 26.181 27.342 40 HD11 ILE 6 HD11 ILE 6 23.465 26.663 26.501 41 HD12 ILE 6 HD12 ILE 6 21.820 27.013 25.948 42 HD13 ILE 6 HD13 ILE 6 22.998 28.325 26.111 43 H ALA 7 H ALA 7 20.750 29.256 30.336 44 HA ALA 7 HA ALA 7 23.269 30.150 31.131 45 HB1 ALA 7 HB1 ALA 7 20.567 31.355 31.841 46 HB2 ALA 7 HB2 ALA 7 22.127 32.192 31.803 47 HB3 ALA 7 HB3 ALA 7 21.426 31.573 30.298 48 H SER 8 H SER 8 20.655 28.904 33.231 49 HA SER 8 HA SER 8 22.052 29.408 35.773 50 HB2 SER 8 HB2 SER 8 19.836 27.434 35.034 51 HB3 SER 8 HB3 SER 8 20.345 27.864 36.674 52 HG SER 8 HG SER 8 19.105 29.546 34.719 53 H MET 9 H MET 9 22.027 26.718 33.441 54 HA MET 9 HA MET 9 23.230 24.749 35.129 55 HB2 MET 9 HB2 MET 9 22.457 23.509 33.457 56 HB3 MET 9 HB3 MET 9 22.026 24.947 32.536 57 HG2 MET 9 HG2 MET 9 24.202 25.030 31.518 58 HG3 MET 9 HG3 MET 9 24.674 23.573 32.413 59 HE1 MET 9 HE1 MET 9 24.121 21.163 29.662 60 HE2 MET 9 HE2 MET 9 25.286 22.501 29.837 61 HE3 MET 9 HE3 MET 9 24.834 21.505 31.246 62 H ILE 10 H ILE 10 24.543 27.274 33.072 63 HA ILE 10 HA ILE 10 27.165 26.371 32.655 64 HB ILE 10 HB ILE 10 26.592 29.292 32.938 65 HG12 ILE 10 HG12 ILE 10 25.524 27.260 30.983 66 HG13 ILE 10 HG13 ILE 10 24.763 28.666 31.768 67 HG21 ILE 10 HG21 ILE 10 28.943 28.394 32.406 68 HG22 ILE 10 HG22 ILE 10 28.249 27.700 30.937 69 HG23 ILE 10 HG23 ILE 10 28.238 29.460 31.198 70 HD11 ILE 10 HD11 ILE 10 24.912 28.948 29.411 71 HD12 ILE 10 HD12 ILE 10 25.964 30.138 30.249 72 HD13 ILE 10 HD13 ILE 10 26.670 28.683 29.471 73 H LYS 11 H LYS 11 25.727 27.735 35.486 74 HA LYS 11 HA LYS 11 28.238 28.500 36.826 75 HB2 LYS 11 HB2 LYS 11 25.282 28.663 37.623 76 HB3 LYS 11 HB3 LYS 11 26.617 29.093 38.698 77 HG2 LYS 11 HG2 LYS 11 26.049 31.153 37.882 78 HG3 LYS 11 HG3 LYS 11 27.366 30.722 36.788 79 HD2 LYS 11 HD2 LYS 11 25.652 29.947 35.130 80 HD3 LYS 11 HD3 LYS 11 24.368 30.451 36.224 81 HE2 LYS 11 HE2 LYS 11 26.469 32.325 35.041 82 HE3 LYS 11 HE3 LYS 11 24.919 31.961 34.275 83 HZ1 LYS 11 HZ1 LYS 11 25.289 33.362 36.857 84 HZ2 LYS 11 HZ2 LYS 11 24.644 33.944 35.461 85 HZ3 LYS 11 HZ3 LYS 11 23.824 32.822 36.313 86 H GLY 12 H GLY 12 26.898 25.530 36.345 87 HA2 GLY 12 HA2 GLY 12 27.203 24.477 39.069 88 HA3 GLY 12 HA3 GLY 12 26.577 23.637 37.662 89 H ASN 13 H ASN 13 29.442 24.677 36.447 90 HA ASN 13 HA ASN 13 31.245 22.851 37.870 91 HB2 ASN 13 HB2 ASN 13 30.147 21.621 35.818 92 HB3 ASN 13 HB3 ASN 13 31.176 22.627 34.839 93 HD21 ASN 13 HD21 ASN 13 31.436 19.895 34.640 94 HD22 ASN 13 HD22 ASN 13 32.924 19.402 35.445 95 H LYS 14 H LYS 14 33.489 23.150 37.093 96 HA LYS 14 HA LYS 14 34.166 25.964 36.972 97 HB2 LYS 14 HB2 LYS 14 35.527 24.019 37.968 98 HB3 LYS 14 HB3 LYS 14 36.037 23.656 36.317 99 HG2 LYS 14 HG2 LYS 14 36.959 25.935 36.071 100 HG3 LYS 14 HG3 LYS 14 36.399 26.376 37.681 101 HD2 LYS 14 HD2 LYS 14 38.422 24.186 37.084 102 HD3 LYS 14 HD3 LYS 14 38.858 25.843 37.494 103 HE2 LYS 14 HE2 LYS 14 37.349 23.924 39.314 104 HE3 LYS 14 HE3 LYS 14 39.086 24.261 39.376 105 HZ1 LYS 14 HZ1 LYS 14 37.995 25.572 41.005 106 HZ2 LYS 14 HZ2 LYS 14 38.539 26.594 39.853 107 HZ3 LYS 14 HZ3 LYS 14 36.916 26.184 39.933 108 H VAL 15 H VAL 15 33.760 23.454 34.509 109 HA VAL 15 HA VAL 15 33.868 25.573 32.425 110 HB VAL 15 HB VAL 15 35.242 22.892 32.041 111 HG11 VAL 15 HG11 VAL 15 34.341 23.848 29.953 112 HG12 VAL 15 HG12 VAL 15 35.193 25.370 30.283 113 HG13 VAL 15 HG13 VAL 15 36.103 23.881 29.977 114 HG21 VAL 15 HG21 VAL 15 37.351 24.300 31.913 115 HG22 VAL 15 HG22 VAL 15 36.422 25.627 32.628 116 HG23 VAL 15 HG23 VAL 15 36.661 24.119 33.531 117 H VAL 16 H VAL 16 32.278 25.436 30.925 118 HA VAL 16 HA VAL 16 30.634 22.954 30.734 119 HB VAL 16 HB VAL 16 29.447 25.711 31.114 120 HG11 VAL 16 HG11 VAL 16 28.077 24.342 29.584 121 HG12 VAL 16 HG12 VAL 16 28.139 22.978 30.723 122 HG13 VAL 16 HG13 VAL 16 27.281 24.473 31.151 123 HG21 VAL 16 HG21 VAL 16 30.204 24.857 33.267 124 HG22 VAL 16 HG22 VAL 16 28.458 24.651 33.189 125 HG23 VAL 16 HG23 VAL 16 29.514 23.256 32.924 126 H VAL 17 H VAL 17 30.105 22.435 28.639 127 HA VAL 17 HA VAL 17 30.683 24.416 26.463 128 HB VAL 17 HB VAL 17 31.604 21.526 26.768 129 HG11 VAL 17 HG11 VAL 17 30.915 21.827 24.436 130 HG12 VAL 17 HG12 VAL 17 31.837 23.345 24.323 131 HG13 VAL 17 HG13 VAL 17 32.668 21.783 24.546 132 HG21 VAL 17 HG21 VAL 17 33.070 24.176 26.459 133 HG22 VAL 17 HG22 VAL 17 33.054 23.123 27.890 134 HG23 VAL 17 HG23 VAL 17 33.839 22.579 26.405 135 H PHE 18 H PHE 18 29.353 24.429 24.703 136 HA PHE 18 HA PHE 18 27.128 22.429 24.604 137 HB2 PHE 18 HB2 PHE 18 26.967 25.387 23.980 138 HB3 PHE 18 HB3 PHE 18 25.692 24.217 23.721 139 HD1 PHE 18 HD2 PHE 18 27.581 26.105 26.296 140 HD2 PHE 18 HD1 PHE 18 24.382 23.330 25.573 141 HE1 PHE 18 HE2 PHE 18 26.660 26.591 28.547 142 HE2 PHE 18 HE1 PHE 18 23.475 23.779 27.848 143 HZ PHE 18 HZ PHE 18 24.546 25.486 29.309 144 H SER 19 H SER 19 27.069 21.284 22.795 145 HA SER 19 HA SER 19 28.757 22.113 20.453 146 HB2 SER 19 HB2 SER 19 28.645 19.421 21.869 147 HB3 SER 19 HB3 SER 19 29.649 19.838 20.484 148 HG SER 19 HG SER 19 30.974 20.282 22.072 149 H TRP 20 H TRP 20 28.604 20.833 18.490 150 HA TRP 20 HA TRP 20 26.004 19.419 18.085 151 HB2 TRP 20 HB2 TRP 20 26.791 21.985 16.949 152 HB3 TRP 20 HB3 TRP 20 26.640 20.797 15.678 153 HD1 TRP 20 HD1 TRP 20 24.276 20.648 18.681 154 HE1 TRP 20 HE1 TRP 20 21.880 21.114 17.901 155 HE3 TRP 20 HE3 TRP 20 25.277 22.165 13.891 156 HZ2 TRP 20 HZ2 TRP 20 20.578 22.191 15.558 157 HZ3 TRP 20 HZ3 TRP 20 23.430 22.932 12.412 158 HH2 TRP 20 HH2 TRP 20 21.091 22.961 13.235 159 H VAL 21 H VAL 21 25.921 17.825 16.562 160 HA VAL 21 HA VAL 21 28.494 16.582 15.847 161 HB VAL 21 HB VAL 21 25.683 15.495 15.542 162 HG11 VAL 21 HG11 VAL 21 27.165 14.385 13.952 163 HG12 VAL 21 HG12 VAL 21 28.415 14.174 15.204 164 HG13 VAL 21 HG13 VAL 21 26.882 13.294 15.301 165 HG21 VAL 21 HG21 VAL 21 26.249 15.714 17.921 166 HG22 VAL 21 HG22 VAL 21 26.316 14.019 17.442 167 HG23 VAL 21 HG23 VAL 21 27.823 14.935 17.644 168 H THR 22 H THR 22 28.070 16.978 12.236 169 HA THR 22 HA THR 22 29.871 16.188 14.471 170 HB THR 22 HB THR 22 29.953 14.363 13.212 171 HG1 THR 22 HG1 THR 22 31.963 14.416 12.295 172 HG21 THR 22 HG21 THR 22 30.225 14.371 10.746 173 HG22 THR 22 HG22 THR 22 29.971 16.140 10.775 174 HG23 THR 22 HG23 THR 22 28.686 15.034 11.320 175 H CYS 23 H CYS 23 31.569 17.508 14.952 176 HA CYS 23 HA CYS 23 31.745 20.014 13.340 177 HB2 CYS 23 HB2 CYS 23 30.372 20.268 15.333 178 HB3 CYS 23 HB3 CYS 23 31.688 19.651 16.350 179 HG CYS 23 HG CYS 23 31.474 22.345 14.443 180 HA PRO 24 HA PRO 24 36.017 18.633 13.334 181 HB2 PRO 24 HB2 PRO 24 37.163 20.636 11.862 182 HB3 PRO 24 HB3 PRO 24 36.111 19.378 11.143 183 HG2 PRO 24 HG2 PRO 24 35.327 22.181 12.013 184 HG3 PRO 24 HG3 PRO 24 34.976 21.365 10.453 185 HD2 PRO 24 HD2 PRO 24 33.166 21.432 12.480 186 HD3 PRO 24 HD3 PRO 24 33.328 19.989 11.438 187 H TYR 25 H TYR 25 34.839 21.614 14.677 188 HA TYR 25 HA TYR 25 37.273 22.137 16.241 189 HB2 TYR 25 HB2 TYR 25 34.528 23.443 16.297 190 HB3 TYR 25 HB3 TYR 25 35.968 24.045 17.081 191 HD1 TYR 25 HD1 TYR 25 38.096 23.778 15.029 192 HD2 TYR 25 HD2 TYR 25 33.957 24.941 14.561 193 HE1 TYR 25 HE1 TYR 25 38.647 24.875 12.883 194 HE2 TYR 25 HE2 TYR 25 34.532 26.050 12.399 195 HH TYR 25 HH TYR 25 37.797 25.826 10.982 196 H CYS 26 H CYS 26 33.973 20.885 17.008 197 HA CYS 26 HA CYS 26 34.461 20.951 19.798 198 HB2 CYS 26 HB2 CYS 26 32.238 20.702 18.739 199 HB3 CYS 26 HB3 CYS 26 32.575 18.970 18.469 200 HG CYS 26 HG CYS 26 33.303 18.480 20.973 201 H VAL 27 H VAL 27 35.229 18.342 17.517 202 HA VAL 27 HA VAL 27 36.232 16.357 19.179 203 HB VAL 27 HB VAL 27 36.112 16.371 16.879 204 HG11 VAL 27 HG11 VAL 27 38.508 17.887 16.303 205 HG12 VAL 27 HG12 VAL 27 37.343 17.107 15.212 206 HG13 VAL 27 HG13 VAL 27 36.791 18.437 16.227 207 HG21 VAL 27 HG21 VAL 27 38.938 15.719 17.813 208 HG22 VAL 27 HG22 VAL 27 37.541 14.639 17.945 209 HG23 VAL 27 HG23 VAL 27 38.200 15.040 16.347 210 H ARG 28 H ARG 28 37.903 18.805 17.758 211 HA ARG 28 HA ARG 28 40.430 18.808 19.115 212 HB2 ARG 28 HB2 ARG 28 39.140 21.411 18.168 213 HB3 ARG 28 HB3 ARG 28 40.804 21.187 18.649 214 HG2 ARG 28 HG2 ARG 28 40.612 19.279 16.697 215 HG3 ARG 28 HG3 ARG 28 39.431 20.497 16.143 216 HD2 ARG 28 HD2 ARG 28 41.189 22.263 16.389 217 HD3 ARG 28 HD3 ARG 28 42.344 21.009 16.882 218 HE ARG 28 HE ARG 28 41.157 20.412 14.307 219 HH11 ARG 28 HH22 ARG 28 43.751 22.309 15.821 220 HH12 ARG 28 HH21 ARG 28 44.544 22.495 14.255 221 HH21 ARG 28 HH12 ARG 28 42.321 20.813 12.393 222 HH22 ARG 28 HH11 ARG 28 43.853 21.691 12.534 223 H ALA 29 H ALA 29 37.601 20.748 20.079 224 HA ALA 29 HA ALA 29 38.816 21.793 22.454 225 HB1 ALA 29 HB1 ALA 29 36.550 22.431 23.108 226 HB2 ALA 29 HB2 ALA 29 36.847 22.824 21.399 227 HB3 ALA 29 HB3 ALA 29 35.860 21.406 21.827 228 H GLU 30 H GLU 30 36.518 18.966 22.125 229 HA GLU 30 HA GLU 30 36.615 18.246 24.901 230 HB2 GLU 30 HB2 GLU 30 36.148 16.578 22.398 231 HB3 GLU 30 HB3 GLU 30 36.030 15.945 24.036 232 HG2 GLU 30 HG2 GLU 30 34.283 17.791 24.480 233 HG3 GLU 30 HG3 GLU 30 34.219 18.009 22.724 234 H LYS 31 H LYS 31 38.843 17.370 22.282 235 HA LYS 31 HA LYS 31 40.326 15.518 23.826 236 HB2 LYS 31 HB2 LYS 31 40.549 15.557 21.410 237 HB3 LYS 31 HB3 LYS 31 40.883 17.289 21.391 238 HG2 LYS 31 HG2 LYS 31 43.115 16.919 22.387 239 HG3 LYS 31 HG3 LYS 31 42.767 15.191 22.484 240 HD2 LYS 31 HD2 LYS 31 44.105 15.500 20.557 241 HD3 LYS 31 HD3 LYS 31 42.451 15.219 19.969 242 HE2 LYS 31 HE2 LYS 31 42.122 17.478 19.393 243 HE3 LYS 31 HE3 LYS 31 43.533 18.039 20.338 244 HZ1 LYS 31 HZ1 LYS 31 43.632 16.361 17.869 245 HZ2 LYS 31 HZ2 LYS 31 44.068 17.926 17.940 246 HZ3 LYS 31 HZ3 LYS 31 44.948 16.798 18.725 247 H LEU 32 H LEU 32 40.893 18.951 23.232 248 HA LEU 32 HA LEU 32 43.248 19.359 24.770 249 HB2 LEU 32 HB2 LEU 32 42.155 20.712 22.964 250 HB3 LEU 32 HB3 LEU 32 40.937 21.172 24.154 251 HG LEU 32 HG LEU 32 42.521 22.899 23.629 252 HD11 LEU 32 HD11 LEU 32 41.491 22.915 25.867 253 HD12 LEU 32 HD12 LEU 32 42.937 22.105 26.516 254 HD13 LEU 32 HD13 LEU 32 43.068 23.721 25.808 255 HD21 LEU 32 HD21 LEU 32 44.841 22.892 24.171 256 HD22 LEU 32 HD22 LEU 32 44.720 21.282 24.936 257 HD23 LEU 32 HD23 LEU 32 44.492 21.466 23.184 258 H LEU 33 H LEU 33 39.776 19.738 25.642 259 HA LEU 33 HA LEU 33 40.242 20.810 28.228 260 HB2 LEU 33 HB2 LEU 33 37.860 19.266 27.083 261 HB3 LEU 33 HB3 LEU 33 37.808 20.137 28.614 262 HG LEU 33 HG LEU 33 38.420 21.495 25.963 263 HD11 LEU 33 HD11 LEU 33 36.095 20.568 26.044 264 HD12 LEU 33 HD12 LEU 33 35.805 21.726 27.377 265 HD13 LEU 33 HD13 LEU 33 36.268 22.308 25.776 266 HD21 LEU 33 HD21 LEU 33 39.277 22.797 27.789 267 HD22 LEU 33 HD22 LEU 33 37.810 23.570 27.186 268 HD23 LEU 33 HD23 LEU 33 37.734 22.619 28.680 269 H HIS 34 H HIS 34 39.685 17.422 27.271 270 HA HIS 34 HA HIS 34 40.097 16.391 29.956 271 HB2 HIS 34 HB2 HIS 34 39.873 15.126 27.209 272 HB3 HIS 34 HB3 HIS 34 40.214 14.196 28.673 273 HD1 HIS 34 HD1 HIS 34 38.237 14.534 30.717 274 HD2 HIS 34 HD2 HIS 34 37.307 15.497 26.726 275 HE1 HIS 34 HE1 HIS 34 35.691 14.593 30.550 276 H ALA 35 H ALA 35 42.291 17.141 27.217 277 HA ALA 35 HA ALA 35 44.495 15.601 28.383 278 HB1 ALA 35 HB1 ALA 35 44.441 17.689 26.167 279 HB2 ALA 35 HB2 ALA 35 45.810 16.636 26.573 280 HB3 ALA 35 HB3 ALA 35 44.310 15.927 25.961 281 H ARG 36 H ARG 36 43.272 18.811 28.840 282 HA ARG 36 HA ARG 36 45.693 19.693 30.359 283 HB2 ARG 36 HB2 ARG 36 43.379 21.220 29.102 284 HB3 ARG 36 HB3 ARG 36 44.674 21.915 30.063 285 HG2 ARG 36 HG2 ARG 36 45.065 20.533 27.387 286 HG3 ARG 36 HG3 ARG 36 45.000 22.277 27.674 287 HD2 ARG 36 HD2 ARG 36 46.968 21.949 29.292 288 HD3 ARG 36 HD3 ARG 36 47.100 20.315 28.608 289 HE ARG 36 HE ARG 36 47.228 22.862 26.998 290 HH11 ARG 36 HH22 ARG 36 48.862 19.852 27.744 291 HH12 ARG 36 HH21 ARG 36 49.588 19.767 26.139 292 HH21 ARG 36 HH12 ARG 36 48.326 22.843 25.180 293 HH22 ARG 36 HH11 ARG 36 49.529 21.588 24.842 294 H THR 37 H THR 37 43.163 18.169 31.240 295 HA THR 37 HA THR 37 42.241 17.683 33.273 296 HB THR 37 HB THR 37 43.620 19.817 34.764 297 HG1 THR 37 HG1 THR 37 45.564 18.897 34.701 298 HG21 THR 37 HG21 THR 37 42.369 18.055 35.999 299 HG22 THR 37 HG22 THR 37 44.086 17.992 36.398 300 HG23 THR 37 HG23 THR 37 43.392 16.804 35.273 301 H LYS 38 H LYS 38 40.888 19.633 31.605 302 HA LYS 38 HA LYS 38 39.866 21.629 33.508 303 HB2 LYS 38 HB2 LYS 38 38.658 20.832 30.853 304 HB3 LYS 38 HB3 LYS 38 38.217 22.178 31.881 305 HG2 LYS 38 HG2 LYS 38 40.678 21.737 30.170 306 HG3 LYS 38 HG3 LYS 38 39.528 23.050 30.047 307 HD2 LYS 38 HD2 LYS 38 40.714 24.412 31.393 308 HD3 LYS 38 HD3 LYS 38 41.011 23.146 32.575 309 HE2 LYS 38 HE2 LYS 38 42.629 22.097 30.944 310 HE3 LYS 38 HE3 LYS 38 42.477 23.548 29.945 311 HZ1 LYS 38 HZ1 LYS 38 43.278 24.711 32.161 312 HZ2 LYS 38 HZ2 LYS 38 43.887 23.184 32.481 313 HZ3 LYS 38 HZ3 LYS 38 44.332 23.980 31.157 314 H ASP 39 H ASP 39 38.788 20.995 35.152 315 HA ASP 39 HA ASP 39 36.787 18.968 35.198 316 HB2 ASP 39 HB2 ASP 39 37.252 21.514 36.774 317 HB3 ASP 39 HB3 ASP 39 35.699 20.696 36.919 318 H ILE 40 H ILE 40 35.519 18.764 33.589 319 HA ILE 40 HA ILE 40 34.124 21.085 32.384 320 HB ILE 40 HB ILE 40 36.213 20.320 31.302 321 HG12 ILE 40 HG12 ILE 40 33.772 21.043 30.065 322 HG13 ILE 40 HG13 ILE 40 35.417 21.348 29.576 323 HG21 ILE 40 HG21 ILE 40 36.020 17.886 31.762 324 HG22 ILE 40 HG22 ILE 40 34.746 17.757 30.555 325 HG23 ILE 40 HG23 ILE 40 36.388 18.243 30.081 326 HD11 ILE 40 HD11 ILE 40 35.471 19.350 28.184 327 HD12 ILE 40 HD12 ILE 40 33.862 18.854 28.782 328 HD13 ILE 40 HD13 ILE 40 34.034 20.306 27.793 329 H THR 41 H THR 41 32.109 20.928 31.630 330 HA THR 41 HA THR 41 30.702 18.271 31.471 331 HB THR 41 HB THR 41 29.737 20.979 32.475 332 HG1 THR 41 HG1 THR 41 29.064 19.713 34.234 333 HG21 THR 41 HG21 THR 41 28.076 18.556 31.707 334 HG22 THR 41 HG22 THR 41 27.949 20.225 31.082 335 HG23 THR 41 HG23 THR 41 27.490 19.876 32.743 336 H VAL 42 H VAL 42 30.330 17.867 29.233 337 HA VAL 42 HA VAL 42 29.489 20.191 27.607 338 HB VAL 42 HB VAL 42 31.119 19.517 26.385 339 HG11 VAL 42 HG11 VAL 42 32.083 17.340 26.081 340 HG12 VAL 42 HG12 VAL 42 32.088 17.953 27.728 341 HG13 VAL 42 HG13 VAL 42 30.911 16.678 27.259 342 HG21 VAL 42 HG21 VAL 42 30.564 18.155 24.467 343 HG22 VAL 42 HG22 VAL 42 29.172 17.465 25.318 344 HG23 VAL 42 HG23 VAL 42 29.208 19.199 24.885 345 H HIS 43 H HIS 43 27.683 20.376 26.572 346 HA HIS 43 HA HIS 43 25.633 18.206 26.699 347 HB2 HIS 43 HB2 HIS 43 25.133 20.286 27.993 348 HB3 HIS 43 HB3 HIS 43 25.245 21.218 26.517 349 HD1 HIS 43 HD1 HIS 43 23.271 17.872 27.078 350 HD2 HIS 43 HD2 HIS 43 22.749 21.949 26.155 351 HE1 HIS 43 HE1 HIS 43 20.798 18.207 26.665 352 H TYR 44 H TYR 44 25.382 17.245 24.709 353 HA TYR 44 HA TYR 44 25.990 18.800 22.247 354 HB2 TYR 44 HB2 TYR 44 25.527 15.900 22.809 355 HB3 TYR 44 HB3 TYR 44 25.192 16.558 21.211 356 HD1 TYR 44 HD1 TYR 44 26.913 17.502 19.779 357 HD2 TYR 44 HD2 TYR 44 27.892 15.859 23.642 358 HE1 TYR 44 HE1 TYR 44 29.312 17.361 19.108 359 HE2 TYR 44 HE2 TYR 44 30.304 15.831 23.011 360 HH TYR 44 HH TYR 44 31.852 16.214 21.350 361 H VAL 45 H VAL 45 24.528 20.291 21.914 362 HA VAL 45 HA VAL 45 21.668 19.881 22.233 363 HB VAL 45 HB VAL 45 21.424 22.152 21.241 364 HG11 VAL 45 HG11 VAL 45 23.308 21.902 23.617 365 HG12 VAL 45 HG12 VAL 45 22.255 23.284 23.238 366 HG13 VAL 45 HG13 VAL 45 21.538 21.729 23.670 367 HG21 VAL 45 HG21 VAL 45 23.466 22.370 19.903 368 HG22 VAL 45 HG22 VAL 45 23.401 23.616 21.141 369 HG23 VAL 45 HG23 VAL 45 24.471 22.228 21.364 370 H ASP 46 H ASP 46 23.435 18.375 20.210 371 HA ASP 46 HA ASP 46 21.431 18.217 17.999 372 HB2 ASP 46 HB2 ASP 46 23.763 18.241 17.281 373 HB3 ASP 46 HB3 ASP 46 24.160 16.934 18.399 374 H LYS 47 H LYS 47 22.991 16.223 20.568 375 HA LYS 47 HA LYS 47 21.301 13.881 20.250 376 HB2 LYS 47 HB2 LYS 47 22.933 14.816 22.654 377 HB3 LYS 47 HB3 LYS 47 22.321 13.190 22.398 378 HG2 LYS 47 HG2 LYS 47 24.376 14.515 20.571 379 HG3 LYS 47 HG3 LYS 47 24.785 13.569 21.998 380 HD2 LYS 47 HD2 LYS 47 23.723 11.573 21.023 381 HD3 LYS 47 HD3 LYS 47 23.295 12.504 19.562 382 HE2 LYS 47 HE2 LYS 47 25.652 12.988 19.126 383 HE3 LYS 47 HE3 LYS 47 26.142 12.237 20.644 384 HZ1 LYS 47 HZ1 LYS 47 26.443 10.867 18.618 385 HZ2 LYS 47 HZ2 LYS 47 25.645 10.115 19.830 386 HZ3 LYS 47 HZ3 LYS 47 24.793 10.671 18.521 387 H MET 48 H MET 48 21.182 16.769 22.279 388 HA MET 48 HA MET 48 18.618 16.056 23.549 389 HB2 MET 48 HB2 MET 48 20.410 17.492 24.586 390 HB3 MET 48 HB3 MET 48 20.098 18.714 23.359 391 HG2 MET 48 HG2 MET 48 18.909 19.429 25.237 392 HG3 MET 48 HG3 MET 48 17.673 18.746 24.185 393 HE1 MET 48 HE1 MET 48 16.348 19.088 26.760 394 HE2 MET 48 HE2 MET 48 16.892 18.175 28.174 395 HE3 MET 48 HE3 MET 48 17.928 19.446 27.496 396 H SER 49 H SER 49 16.830 15.969 22.194 397 HA SER 49 HA SER 49 16.654 17.356 19.668 398 HB2 SER 49 HB2 SER 49 14.413 16.179 21.342 399 HB3 SER 49 HB3 SER 49 14.367 16.575 19.617 400 HG SER 49 HG SER 49 16.410 15.043 19.707 401 H GLU 50 H GLU 50 15.551 18.188 22.925 402 HA GLU 50 HA GLU 50 14.286 20.650 22.350 403 HB2 GLU 50 HB2 GLU 50 14.504 19.235 24.543 404 HB3 GLU 50 HB3 GLU 50 16.014 20.122 24.801 405 HG2 GLU 50 HG2 GLU 50 14.744 22.243 24.870 406 HG3 GLU 50 HG3 GLU 50 13.244 21.357 24.562 407 H GLY 51 H GLY 51 17.604 19.912 21.955 408 HA2 GLY 51 HA2 GLY 51 19.081 22.063 22.806 409 HA3 GLY 51 HA3 GLY 51 19.421 21.098 21.375 410 H GLU 52 H GLU 52 16.874 22.157 20.055 411 HA GLU 52 HA GLU 52 18.061 24.501 18.783 412 HB2 GLU 52 HB2 GLU 52 15.410 23.065 18.537 413 HB3 GLU 52 HB3 GLU 52 15.676 24.626 17.738 414 HG2 GLU 52 HG2 GLU 52 17.483 23.805 16.424 415 HG3 GLU 52 HG3 GLU 52 17.655 22.357 17.410 416 H GLN 53 H GLN 53 15.719 24.054 21.397 417 HA GLN 53 HA GLN 53 15.054 26.882 21.664 418 HB2 GLN 53 HB2 GLN 53 13.626 24.857 22.344 419 HB3 GLN 53 HB3 GLN 53 14.732 24.652 23.707 420 HG2 GLN 53 HG2 GLN 53 14.149 27.003 24.443 421 HG3 GLN 53 HG3 GLN 53 13.013 27.100 23.099 422 HE21 GLN 53 HE21 GLN 53 11.343 27.511 24.793 423 HE22 GLN 53 HE22 GLN 53 10.679 26.129 25.664 424 H LEU 54 H LEU 54 17.353 24.601 23.260 425 HA LEU 54 HA LEU 54 18.320 26.522 25.180 426 HB2 LEU 54 HB2 LEU 54 19.650 24.009 24.076 427 HB3 LEU 54 HB3 LEU 54 20.300 25.000 25.353 428 HG LEU 54 HG LEU 54 19.375 23.393 26.638 429 HD11 LEU 54 HD11 LEU 54 16.808 24.986 26.255 430 HD12 LEU 54 HD12 LEU 54 17.250 23.960 27.633 431 HD13 LEU 54 HD13 LEU 54 18.122 25.452 27.356 432 HD21 LEU 54 HD21 LEU 54 18.552 22.008 24.879 433 HD22 LEU 54 HD22 LEU 54 17.374 22.103 26.186 434 HD23 LEU 54 HD23 LEU 54 17.099 23.045 24.710 435 H ARG 55 H ARG 55 19.394 25.789 21.874 436 HA ARG 55 HA ARG 55 21.676 27.480 21.698 437 HB2 ARG 55 HB2 ARG 55 19.553 26.598 19.724 438 HB3 ARG 55 HB3 ARG 55 20.845 27.695 19.215 439 HG2 ARG 55 HG2 ARG 55 22.548 26.118 19.616 440 HG3 ARG 55 HG3 ARG 55 21.516 25.124 20.639 441 HD2 ARG 55 HD2 ARG 55 21.928 23.998 18.554 442 HD3 ARG 55 HD3 ARG 55 20.224 24.368 18.706 443 HE ARG 55 HE ARG 55 22.135 25.375 16.705 444 HH11 ARG 55 HH22 ARG 55 18.955 26.139 18.008 445 HH12 ARG 55 HH21 ARG 55 18.324 26.465 16.412 446 HH21 ARG 55 HH12 ARG 55 21.325 25.900 14.835 447 HH22 ARG 55 HH11 ARG 55 19.627 26.305 14.621 448 H GLY 56 H GLY 56 18.298 28.427 21.858 449 HA2 GLY 56 HA2 GLY 56 18.426 31.033 20.751 450 HA3 GLY 56 HA3 GLY 56 17.306 30.494 22.011 451 H GLU 57 H GLU 57 19.215 29.994 24.162 452 HA GLU 57 HA GLU 57 19.605 32.673 25.129 453 HB2 GLU 57 HB2 GLU 57 20.647 30.008 26.053 454 HB3 GLU 57 HB3 GLU 57 21.215 31.499 26.788 455 HG2 GLU 57 HG2 GLU 57 18.294 30.653 26.722 456 HG3 GLU 57 HG3 GLU 57 19.450 30.389 27.998 457 H ILE 58 H ILE 58 21.774 30.412 23.472 458 HA ILE 58 HA ILE 58 24.198 31.932 23.871 459 HB ILE 58 HB ILE 58 23.713 29.963 21.606 460 HG12 ILE 58 HG12 ILE 58 24.537 29.262 24.458 461 HG13 ILE 58 HG13 ILE 58 22.986 28.861 23.708 462 HG21 ILE 58 HG21 ILE 58 26.234 30.671 23.188 463 HG22 ILE 58 HG22 ILE 58 26.131 29.639 21.739 464 HG23 ILE 58 HG23 ILE 58 25.810 31.355 21.605 465 HD11 ILE 58 HD11 ILE 58 25.688 27.738 22.922 466 HD12 ILE 58 HD12 ILE 58 24.324 26.896 23.665 467 HD13 ILE 58 HD13 ILE 58 24.186 27.487 21.997 468 H TYR 59 H TYR 59 21.827 31.649 21.191 469 HA TYR 59 HA TYR 59 23.193 33.479 19.492 470 HB2 TYR 59 HB2 TYR 59 21.280 31.716 19.035 471 HB3 TYR 59 HB3 TYR 59 20.216 33.096 19.281 472 HD1 TYR 59 HD1 TYR 59 20.549 35.177 17.781 473 HD2 TYR 59 HD2 TYR 59 22.662 31.475 17.146 474 HE1 TYR 59 HE1 TYR 59 21.097 35.883 15.452 475 HE2 TYR 59 HE2 TYR 59 23.255 32.200 14.837 476 HH TYR 59 HH TYR 59 22.174 35.335 13.497 477 H GLN 60 H GLN 60 20.462 34.041 21.778 478 HA GLN 60 HA GLN 60 19.971 36.725 21.089 479 HB2 GLN 60 HB2 GLN 60 19.655 35.111 23.650 480 HB3 GLN 60 HB3 GLN 60 19.180 36.801 23.610 481 HG2 GLN 60 HG2 GLN 60 18.103 34.734 21.633 482 HG3 GLN 60 HG3 GLN 60 17.331 35.091 23.175 483 HE21 GLN 60 HE21 GLN 60 15.909 35.458 20.785 484 HE22 GLN 60 HE22 GLN 60 15.693 37.202 20.548 485 H ALA 61 H ALA 61 22.341 35.484 23.513 486 HA ALA 61 HA ALA 61 23.241 38.222 24.105 487 HB1 ALA 61 HB1 ALA 61 23.137 36.599 25.898 488 HB2 ALA 61 HB2 ALA 61 24.229 35.499 25.023 489 HB3 ALA 61 HB3 ALA 61 24.823 37.064 25.617 490 H TYR 62 H TYR 62 24.647 35.375 22.341 491 HA TYR 62 HA TYR 62 27.068 37.031 21.812 492 HB2 TYR 62 HB2 TYR 62 26.966 34.025 21.882 493 HB3 TYR 62 HB3 TYR 62 28.361 35.078 22.000 494 HD1 TYR 62 HD2 TYR 62 28.443 36.676 24.154 495 HD2 TYR 62 HD1 TYR 62 26.047 33.118 23.807 496 HE1 TYR 62 HE2 TYR 62 28.309 36.523 26.635 497 HE2 TYR 62 HE1 TYR 62 25.881 32.979 26.292 498 HH TYR 62 HH TYR 62 27.618 35.220 28.459 499 H LYS 63 H LYS 63 24.432 36.016 20.136 500 HA LYS 63 HA LYS 63 23.869 35.689 18.021 501 HB2 LYS 63 HB2 LYS 63 26.316 37.384 17.400 502 HB3 LYS 63 HB3 LYS 63 24.926 37.163 16.347 503 HG2 LYS 63 HG2 LYS 63 24.793 38.482 19.094 504 HG3 LYS 63 HG3 LYS 63 24.967 39.336 17.563 505 HD2 LYS 63 HD2 LYS 63 22.796 38.638 16.787 506 HD3 LYS 63 HD3 LYS 63 22.616 37.474 18.095 507 HE2 LYS 63 HE2 LYS 63 21.264 39.389 18.587 508 HE3 LYS 63 HE3 LYS 63 22.569 39.269 19.771 509 HZ1 LYS 63 HZ1 LYS 63 23.752 41.022 18.565 510 HZ2 LYS 63 HZ2 LYS 63 22.576 41.080 17.414 511 HZ3 LYS 63 HZ3 LYS 63 22.237 41.528 18.962 512 H HIS 64 H HIS 64 25.410 33.516 18.987 513 HA HIS 64 HA HIS 64 26.133 32.304 16.372 514 HB2 HIS 64 HB2 HIS 64 27.777 32.124 18.929 515 HB3 HIS 64 HB3 HIS 64 27.936 31.010 17.577 516 HD1 HIS 64 HD1 HIS 64 28.471 34.798 18.254 517 HD2 HIS 64 HD2 HIS 64 29.526 31.684 15.623 518 HE1 HIS 64 HE1 HIS 64 30.291 35.734 16.730 519 H GLU 65 H GLU 65 25.660 30.072 16.225 520 HA GLU 65 HA GLU 65 23.997 28.958 18.458 521 HB2 GLU 65 HB2 GLU 65 23.016 27.534 16.529 522 HB3 GLU 65 HB3 GLU 65 22.439 29.151 16.862 523 HG2 GLU 65 HG2 GLU 65 22.578 28.747 14.481 524 HG3 GLU 65 HG3 GLU 65 23.589 30.085 14.979 525 H THR 66 H THR 66 26.686 28.227 16.282 526 HA THR 66 HA THR 66 27.634 26.378 18.368 527 HB THR 66 HB THR 66 26.532 24.702 17.192 528 HG1 THR 66 HG1 THR 66 28.766 24.280 15.719 529 HG21 THR 66 HG21 THR 66 25.852 25.730 15.149 530 HG22 THR 66 HG22 THR 66 26.775 24.288 14.742 531 HG23 THR 66 HG23 THR 66 27.523 25.903 14.585 532 H VAL 67 H VAL 67 29.842 25.964 18.261 533 HA VAL 67 HA VAL 67 31.535 27.168 16.291 534 HB VAL 67 HB VAL 67 32.626 28.407 18.629 535 HG11 VAL 67 HG11 VAL 67 32.553 30.391 17.220 536 HG12 VAL 67 HG12 VAL 67 33.078 28.980 16.291 537 HG13 VAL 67 HG13 VAL 67 31.419 29.593 16.111 538 HG21 VAL 67 HG21 VAL 67 31.082 30.174 19.143 539 HG22 VAL 67 HG22 VAL 67 29.851 29.510 18.059 540 HG23 VAL 67 HG23 VAL 67 30.304 28.638 19.543 541 HA PRO 68 HA PRO 68 30.272 25.024 19.441 542 HB2 PRO 68 HB2 PRO 68 31.237 23.876 21.686 543 HB3 PRO 68 HB3 PRO 68 31.103 22.982 20.145 544 HG2 PRO 68 HG2 PRO 68 33.550 24.399 21.260 545 HG3 PRO 68 HG3 PRO 68 33.420 22.696 20.714 546 HD2 PRO 68 HD2 PRO 68 34.345 24.609 19.049 547 HD3 PRO 68 HD3 PRO 68 33.232 23.354 18.432 548 H ALA 69 H ALA 69 29.553 25.736 21.685 549 HA ALA 69 HA ALA 69 30.756 28.396 22.322 550 HB1 ALA 69 HB1 ALA 69 28.625 28.804 23.502 551 HB2 ALA 69 HB2 ALA 69 28.364 28.386 21.795 552 HB3 ALA 69 HB3 ALA 69 28.073 27.175 23.064 553 H ILE 70 H ILE 70 31.860 28.740 24.192 554 HA ILE 70 HA ILE 70 32.188 26.421 26.056 555 HB ILE 70 HB ILE 70 34.263 28.211 24.739 556 HG12 ILE 70 HG12 ILE 70 34.178 25.188 24.487 557 HG13 ILE 70 HG13 ILE 70 33.188 26.166 23.421 558 HG21 ILE 70 HG21 ILE 70 35.004 27.737 27.007 559 HG22 ILE 70 HG22 ILE 70 34.647 26.006 26.809 560 HG23 ILE 70 HG23 ILE 70 35.954 26.773 25.886 561 HD11 ILE 70 HD11 ILE 70 35.286 25.645 22.331 562 HD12 ILE 70 HD12 ILE 70 35.142 27.392 22.599 563 HD13 ILE 70 HD13 ILE 70 36.195 26.411 23.636 564 H PHE 71 H PHE 71 32.292 26.886 28.214 565 HA PHE 71 HA PHE 71 32.482 29.738 29.038 566 HB2 PHE 71 HB2 PHE 71 30.443 27.706 29.979 567 HB3 PHE 71 HB3 PHE 71 30.656 29.323 30.631 568 HD1 PHE 71 HD2 PHE 71 29.604 27.431 27.575 569 HD2 PHE 71 HD1 PHE 71 29.555 31.208 29.658 570 HE1 PHE 71 HE2 PHE 71 27.915 28.305 25.971 571 HE2 PHE 71 HE1 PHE 71 27.823 32.044 28.093 572 HZ PHE 71 HZ PHE 71 27.009 30.595 26.241 573 H ILE 72 H ILE 72 33.385 30.153 31.015 574 HA ILE 72 HA ILE 72 34.306 27.859 32.694 575 HB ILE 72 HB ILE 72 35.997 30.290 32.004 576 HG12 ILE 72 HG12 ILE 72 36.184 27.349 31.203 577 HG13 ILE 72 HG13 ILE 72 35.948 28.725 30.137 578 HG21 ILE 72 HG21 ILE 72 36.668 27.864 33.758 579 HG22 ILE 72 HG22 ILE 72 37.708 29.267 33.445 580 HG23 ILE 72 HG23 ILE 72 36.247 29.450 34.404 581 HD11 ILE 72 HD11 ILE 72 38.234 29.519 30.625 582 HD12 ILE 72 HD12 ILE 72 38.511 28.069 31.640 583 HD13 ILE 72 HD13 ILE 72 38.190 27.901 29.909 584 H ASN 73 H ASN 73 33.590 28.049 34.709 585 HA ASN 73 HA ASN 73 32.235 28.819 36.365 586 HB2 ASN 73 HB2 ASN 73 34.280 31.065 36.327 587 HB3 ASN 73 HB3 ASN 73 33.218 30.685 37.669 588 HD21 ASN 73 HD21 ASN 73 33.309 28.260 38.122 589 HD22 ASN 73 HD22 ASN 73 34.922 27.677 38.553 590 H GLY 74 H GLY 74 30.830 29.265 34.151 591 HA2 GLY 74 HA2 GLY 74 28.886 30.374 33.465 592 HA3 GLY 74 HA3 GLY 74 29.137 31.522 34.767 593 H ASN 75 H ASN 75 32.011 31.829 33.171 594 HA ASN 75 HA ASN 75 31.095 34.207 31.648 595 HB2 ASN 75 HB2 ASN 75 33.838 33.150 32.447 596 HB3 ASN 75 HB3 ASN 75 33.600 34.581 31.507 597 HD21 ASN 75 HD21 ASN 75 34.491 33.797 34.478 598 HD22 ASN 75 HD22 ASN 75 33.745 35.123 35.363 599 H PHE 76 H PHE 76 31.436 34.466 29.404 600 HA PHE 76 HA PHE 76 31.519 31.946 27.892 601 HB2 PHE 76 HB2 PHE 76 29.694 33.474 27.531 602 HB3 PHE 76 HB3 PHE 76 30.791 34.804 27.207 603 HD1 PHE 76 HD2 PHE 76 30.097 31.321 25.886 604 HD2 PHE 76 HD1 PHE 76 31.146 35.405 24.979 605 HE1 PHE 76 HE2 PHE 76 30.015 30.813 23.461 606 HE2 PHE 76 HE1 PHE 76 31.079 34.885 22.559 607 HZ PHE 76 HZ PHE 76 30.491 32.597 21.790 608 H ILE 77 H ILE 77 32.837 31.341 26.312 609 HA ILE 77 HA ILE 77 34.781 33.172 25.044 610 HB ILE 77 HB ILE 77 35.344 30.334 26.003 611 HG12 ILE 77 HG12 ILE 77 35.704 31.987 27.778 612 HG13 ILE 77 HG13 ILE 77 37.191 31.220 27.273 613 HG21 ILE 77 HG21 ILE 77 36.302 30.476 23.801 614 HG22 ILE 77 HG22 ILE 77 37.003 32.070 24.141 615 HG23 ILE 77 HG23 ILE 77 37.618 30.624 24.963 616 HD11 ILE 77 HD11 ILE 77 36.333 34.024 26.423 617 HD12 ILE 77 HD12 ILE 77 37.490 33.630 27.704 618 HD13 ILE 77 HD13 ILE 77 37.870 33.228 26.023 619 H GLY 78 H GLY 78 34.519 33.095 22.814 620 HA2 GLY 78 HA2 GLY 78 33.043 30.701 21.679 621 HA3 GLY 78 HA3 GLY 78 32.913 32.329 21.052 622 H GLY 79 H GLY 79 34.411 29.419 20.721 623 HA2 GLY 79 HA2 GLY 79 35.290 29.069 18.398 624 HA3 GLY 79 HA3 GLY 79 36.406 30.394 18.725 625 H CYS 80 H CYS 80 36.753 27.334 18.224 626 HA CYS 80 HA CYS 80 37.917 26.299 20.682 627 HB2 CYS 80 HB2 CYS 80 37.035 24.852 18.894 628 HB3 CYS 80 HB3 CYS 80 38.351 25.365 17.816 629 HG CYS 80 HG CYS 80 40.311 24.541 19.260 630 H SER 81 H SER 81 39.377 27.870 17.776 631 HA SER 81 HA SER 81 41.989 28.000 18.885 632 HB2 SER 81 HB2 SER 81 42.496 29.631 17.183 633 HB3 SER 81 HB3 SER 81 41.544 28.305 16.507 634 HG SER 81 HG SER 81 40.855 30.310 15.786 635 H ASP 82 H ASP 82 39.205 29.966 19.573 636 HA ASP 82 HA ASP 82 40.595 32.079 20.989 637 HB2 ASP 82 HB2 ASP 82 38.087 31.765 20.013 638 HB3 ASP 82 HB3 ASP 82 37.750 31.339 21.669 639 H LEU 83 H LEU 83 39.088 29.019 21.937 640 HA LEU 83 HA LEU 83 39.748 29.154 24.760 641 HB2 LEU 83 HB2 LEU 83 38.030 27.657 24.065 642 HB3 LEU 83 HB3 LEU 83 39.049 26.909 22.844 643 HG LEU 83 HG LEU 83 40.484 25.928 24.658 644 HD11 LEU 83 HD11 LEU 83 39.520 25.798 26.941 645 HD12 LEU 83 HD12 LEU 83 39.953 27.458 26.505 646 HD13 LEU 83 HD13 LEU 83 38.253 26.950 26.470 647 HD21 LEU 83 HD21 LEU 83 37.578 25.103 24.884 648 HD22 LEU 83 HD22 LEU 83 38.653 24.666 23.535 649 HD23 LEU 83 HD23 LEU 83 39.029 24.119 25.168 650 H GLU 84 H GLU 84 41.449 27.517 22.004 651 HA GLU 84 HA GLU 84 43.669 26.754 23.655 652 HB2 GLU 84 HB2 GLU 84 43.446 26.933 20.638 653 HB3 GLU 84 HB3 GLU 84 44.896 26.394 21.521 654 HG2 GLU 84 HG2 GLU 84 43.484 24.708 22.724 655 HG3 GLU 84 HG3 GLU 84 42.171 25.066 21.593 656 H ALA 85 H ALA 85 43.019 29.853 22.058 657 HA ALA 85 HA ALA 85 45.662 30.913 22.267 658 HB1 ALA 85 HB1 ALA 85 44.515 33.115 22.397 659 HB2 ALA 85 HB2 ALA 85 43.870 32.096 21.104 660 HB3 ALA 85 HB3 ALA 85 42.959 32.291 22.619 661 H LEU 86 H LEU 86 43.128 30.497 24.791 662 HA LEU 86 HA LEU 86 44.678 31.750 26.895 663 HB2 LEU 86 HB2 LEU 86 42.382 29.763 27.063 664 HB3 LEU 86 HB3 LEU 86 43.032 30.710 28.393 665 HG LEU 86 HG LEU 86 41.646 31.863 25.940 666 HD11 LEU 86 HD11 LEU 86 40.711 31.573 28.827 667 HD12 LEU 86 HD12 LEU 86 39.829 32.369 27.508 668 HD13 LEU 86 HD13 LEU 86 40.129 30.627 27.433 669 HD21 LEU 86 HD21 LEU 86 43.263 33.480 26.846 670 HD22 LEU 86 HD22 LEU 86 41.617 33.974 27.242 671 HD23 LEU 86 HD23 LEU 86 42.624 33.222 28.497 672 H ASP 87 H ASP 87 44.605 28.468 25.569 673 HA ASP 87 HA ASP 87 46.272 27.260 27.646 674 HB2 ASP 87 HB2 ASP 87 44.762 26.006 26.054 675 HB3 ASP 87 HB3 ASP 87 45.897 26.371 24.763 676 H LYS 88 H LYS 88 46.886 28.855 24.558 677 HA LYS 88 HA LYS 88 49.774 28.545 24.553 678 HB2 LYS 88 HB2 LYS 88 47.723 30.099 22.987 679 HB3 LYS 88 HB3 LYS 88 49.375 30.694 22.953 680 HG2 LYS 88 HG2 LYS 88 48.920 29.213 21.077 681 HG3 LYS 88 HG3 LYS 88 50.229 28.631 22.104 682 HD2 LYS 88 HD2 LYS 88 48.732 26.914 23.089 683 HD3 LYS 88 HD3 LYS 88 47.371 27.579 22.187 684 HE2 LYS 88 HE2 LYS 88 48.199 25.604 21.048 685 HE3 LYS 88 HE3 LYS 88 48.420 27.049 20.055 686 HZ1 LYS 88 HZ1 LYS 88 50.571 25.817 21.697 687 HZ2 LYS 88 HZ2 LYS 88 50.391 25.616 20.054 688 HZ3 LYS 88 HZ3 LYS 88 50.739 27.082 20.660 689 H GLU 89 H GLU 89 47.685 31.244 25.642 690 HA GLU 89 HA GLU 89 49.982 32.757 26.639 691 HB2 GLU 89 HB2 GLU 89 47.001 33.117 27.186 692 HB3 GLU 89 HB3 GLU 89 48.286 34.225 27.645 693 HG2 GLU 89 HG2 GLU 89 48.783 34.152 24.999 694 HG3 GLU 89 HG3 GLU 89 47.059 33.806 24.954 695 H GLY 90 H GLY 90 48.522 29.999 27.916 696 HA2 GLY 90 HA2 GLY 90 49.028 28.923 29.904 697 HA3 GLY 90 HA3 GLY 90 49.965 30.331 30.417 698 H LYS 91 H LYS 91 46.767 31.239 29.536 699 HA LYS 91 HA LYS 91 46.067 31.707 32.369 700 HB2 LYS 91 HB2 LYS 91 45.040 32.646 29.658 701 HB3 LYS 91 HB3 LYS 91 44.260 33.046 31.179 702 HG2 LYS 91 HG2 LYS 91 46.389 34.042 32.026 703 HG3 LYS 91 HG3 LYS 91 47.155 33.696 30.478 704 HD2 LYS 91 HD2 LYS 91 44.785 35.570 30.892 705 HD3 LYS 91 HD3 LYS 91 46.477 36.047 30.719 706 HE2 LYS 91 HE2 LYS 91 46.540 34.968 28.485 707 HE3 LYS 91 HE3 LYS 91 44.806 34.604 28.608 708 HZ1 LYS 91 HZ1 LYS 91 45.926 37.329 28.815 709 HZ2 LYS 91 HZ2 LYS 91 45.451 36.682 27.384 710 HZ3 LYS 91 HZ3 LYS 91 44.341 36.938 28.603 711 H LEU 92 H LEU 92 45.165 29.444 29.862 712 HA LEU 92 HA LEU 92 42.713 28.583 31.276 713 HB2 LEU 92 HB2 LEU 92 43.293 28.341 28.746 714 HB3 LEU 92 HB3 LEU 92 44.438 27.105 29.220 715 HG LEU 92 HG LEU 92 42.528 25.784 30.185 716 HD11 LEU 92 HD11 LEU 92 40.889 27.551 30.598 717 HD12 LEU 92 HD12 LEU 92 40.831 27.934 28.863 718 HD13 LEU 92 HD13 LEU 92 40.224 26.375 29.459 719 HD21 LEU 92 HD21 LEU 92 41.632 25.065 28.002 720 HD22 LEU 92 HD22 LEU 92 42.284 26.541 27.250 721 HD23 LEU 92 HD23 LEU 92 43.381 25.324 27.935 722 H ASP 93 H ASP 93 46.091 27.878 31.462 723 HA ASP 93 HA ASP 93 45.849 25.722 33.389 724 HB2 ASP 93 HB2 ASP 93 48.150 27.614 32.793 725 HB3 ASP 93 HB3 ASP 93 48.184 26.111 33.697 726 H GLY 94 H GLY 94 46.471 29.292 33.671 727 HA2 GLY 94 HA2 GLY 94 46.348 29.413 36.511 728 HA3 GLY 94 HA3 GLY 94 46.059 30.753 35.401 729 H LEU 95 H LEU 95 43.704 29.357 34.177 730 HA LEU 95 HA LEU 95 41.642 30.176 36.034 731 HB2 LEU 95 HB2 LEU 95 41.684 28.971 33.276 732 HB3 LEU 95 HB3 LEU 95 40.174 29.050 34.165 733 HG LEU 95 HG LEU 95 41.902 31.528 33.770 734 HD11 LEU 95 HD11 LEU 95 39.541 30.624 32.080 735 HD12 LEU 95 HD12 LEU 95 40.447 32.142 31.913 736 HD13 LEU 95 HD13 LEU 95 41.243 30.604 31.552 737 HD21 LEU 95 HD21 LEU 95 39.793 32.719 34.184 738 HD22 LEU 95 HD22 LEU 95 38.940 31.179 34.412 739 HD23 LEU 95 HD23 LEU 95 40.197 31.688 35.555 740 H LEU 96 H LEU 96 43.152 27.112 35.429 741 HA LEU 96 HA LEU 96 41.282 25.673 37.213 742 HB2 LEU 96 HB2 LEU 96 43.986 24.868 36.075 743 HB3 LEU 96 HB3 LEU 96 42.969 23.826 37.061 744 HG LEU 96 HG LEU 96 42.283 24.839 34.318 745 HD11 LEU 96 HD11 LEU 96 42.434 22.318 33.902 746 HD12 LEU 96 HD12 LEU 96 43.956 22.970 34.538 747 HD13 LEU 96 HD13 LEU 96 42.844 22.093 35.588 748 HD21 LEU 96 HD21 LEU 96 40.254 23.346 34.599 749 HD22 LEU 96 HD22 LEU 96 40.645 23.220 36.321 750 HD23 LEU 96 HD23 LEU 96 40.216 24.789 35.578 751 H SER 97 H SER 97 43.146 28.050 38.131 752 HA SER 97 HA SER 97 43.493 26.886 40.852 753 HB2 SER 97 HB2 SER 97 45.653 26.802 39.536 754 HB3 SER 97 HB3 SER 97 45.677 28.572 39.589 755 HG SER 97 HG SER 97 45.637 28.434 41.862 Start of MODEL 16 1 H1 GLY 1 H1 GLY 1 19.462 27.238 41.331 2 H2 GLY 1 H2 GLY 1 18.368 26.501 40.341 3 H3 GLY 1 H3 GLY 1 17.847 27.436 41.592 4 HA2 GLY 1 HA2 GLY 1 18.748 29.409 40.613 5 HA3 GLY 1 HA3 GLY 1 19.346 28.426 39.262 6 H ALA 2 H ALA 2 16.932 30.456 40.189 7 HA ALA 2 HA ALA 2 14.593 29.066 39.337 8 HB1 ALA 2 HB1 ALA 2 14.670 30.846 41.052 9 HB2 ALA 2 HB2 ALA 2 15.068 32.041 39.796 10 HB3 ALA 2 HB3 ALA 2 13.494 31.216 39.778 11 H MET 3 H MET 3 16.921 30.586 37.309 12 HA MET 3 HA MET 3 15.032 31.374 35.220 13 HB2 MET 3 HB2 MET 3 17.166 32.540 35.656 14 HB3 MET 3 HB3 MET 3 18.055 31.140 35.048 15 HG2 MET 3 HG2 MET 3 15.958 32.680 33.459 16 HG3 MET 3 HG3 MET 3 17.670 33.081 33.452 17 HE1 MET 3 HE1 MET 3 17.509 33.074 30.832 18 HE2 MET 3 HE2 MET 3 17.024 31.668 29.861 19 HE3 MET 3 HE3 MET 3 15.826 32.510 30.865 20 HA PRO 4 HA PRO 4 14.792 27.071 34.106 21 HB2 PRO 4 HB2 PRO 4 12.668 27.073 32.424 22 HB3 PRO 4 HB3 PRO 4 12.526 27.600 34.124 23 HG2 PRO 4 HG2 PRO 4 12.963 29.364 31.682 24 HG3 PRO 4 HG3 PRO 4 11.678 29.509 32.928 25 HD2 PRO 4 HD2 PRO 4 14.005 30.937 33.078 26 HD3 PRO 4 HD3 PRO 4 13.189 30.303 34.538 27 H SER 5 H SER 5 16.988 28.365 32.769 28 HA SER 5 HA SER 5 17.198 26.615 30.439 29 HB2 SER 5 HB2 SER 5 16.229 28.922 29.656 30 HB3 SER 5 HB3 SER 5 17.878 29.510 29.863 31 HG SER 5 HG SER 5 16.902 28.176 27.836 32 H ILE 6 H ILE 6 19.424 27.501 29.312 33 HA ILE 6 HA ILE 6 21.307 26.247 30.907 34 HB ILE 6 HB ILE 6 23.021 27.030 29.218 35 HG12 ILE 6 HG12 ILE 6 20.710 27.920 27.568 36 HG13 ILE 6 HG13 ILE 6 21.638 29.111 28.509 37 HG21 ILE 6 HG21 ILE 6 22.041 25.511 27.539 38 HG22 ILE 6 HG22 ILE 6 21.996 24.896 29.179 39 HG23 ILE 6 HG23 ILE 6 20.520 25.562 28.465 40 HD11 ILE 6 HD11 ILE 6 22.498 29.040 26.248 41 HD12 ILE 6 HD12 ILE 6 23.711 28.318 27.315 42 HD13 ILE 6 HD13 ILE 6 22.678 27.279 26.298 43 H ALA 7 H ALA 7 20.587 29.648 31.074 44 HA ALA 7 HA ALA 7 22.992 30.679 32.143 45 HB1 ALA 7 HB1 ALA 7 21.565 32.317 33.235 46 HB2 ALA 7 HB2 ALA 7 20.964 31.992 31.599 47 HB3 ALA 7 HB3 ALA 7 20.134 31.280 32.999 48 H SER 8 H SER 8 20.483 28.706 33.810 49 HA SER 8 HA SER 8 21.819 28.779 36.439 50 HB2 SER 8 HB2 SER 8 19.649 26.951 35.324 51 HB3 SER 8 HB3 SER 8 20.128 27.097 37.028 52 HG SER 8 HG SER 8 18.310 28.500 35.770 53 H MET 9 H MET 9 21.719 26.594 33.636 54 HA MET 9 HA MET 9 23.182 24.433 34.784 55 HB2 MET 9 HB2 MET 9 22.998 25.209 31.849 56 HB3 MET 9 HB3 MET 9 23.502 23.655 32.506 57 HG2 MET 9 HG2 MET 9 21.309 23.257 33.466 58 HG3 MET 9 HG3 MET 9 20.749 24.852 33.017 59 HE1 MET 9 HE1 MET 9 22.901 22.959 30.270 60 HE2 MET 9 HE2 MET 9 22.315 21.608 31.268 61 HE3 MET 9 HE3 MET 9 21.701 21.829 29.619 62 H ILE 10 H ILE 10 24.381 27.476 33.370 63 HA ILE 10 HA ILE 10 27.099 26.764 33.039 64 HB ILE 10 HB ILE 10 26.335 29.472 34.192 65 HG12 ILE 10 HG12 ILE 10 24.715 29.247 32.474 66 HG13 ILE 10 HG13 ILE 10 25.941 30.342 31.928 67 HG21 ILE 10 HG21 ILE 10 28.107 30.212 32.570 68 HG22 ILE 10 HG22 ILE 10 28.667 29.196 33.902 69 HG23 ILE 10 HG23 ILE 10 28.472 28.496 32.281 70 HD11 ILE 10 HD11 ILE 10 26.934 28.585 30.476 71 HD12 ILE 10 HD12 ILE 10 25.693 27.432 31.018 72 HD13 ILE 10 HD13 ILE 10 25.228 28.871 30.095 73 H LYS 11 H LYS 11 25.302 27.243 36.020 74 HA LYS 11 HA LYS 11 27.646 27.316 37.775 75 HB2 LYS 11 HB2 LYS 11 24.673 27.220 38.349 76 HB3 LYS 11 HB3 LYS 11 25.981 27.516 39.512 77 HG2 LYS 11 HG2 LYS 11 26.700 29.491 38.117 78 HG3 LYS 11 HG3 LYS 11 25.265 29.255 37.091 79 HD2 LYS 11 HD2 LYS 11 23.823 29.461 39.052 80 HD3 LYS 11 HD3 LYS 11 25.268 29.744 40.069 81 HE2 LYS 11 HE2 LYS 11 25.821 31.702 38.509 82 HE3 LYS 11 HE3 LYS 11 24.212 31.493 37.795 83 HZ1 LYS 11 HZ1 LYS 11 24.850 32.169 40.605 84 HZ2 LYS 11 HZ2 LYS 11 24.181 33.167 39.528 85 HZ3 LYS 11 HZ3 LYS 11 23.298 31.857 40.051 86 H GLY 12 H GLY 12 26.141 24.735 36.184 87 HA2 GLY 12 HA2 GLY 12 25.974 22.818 38.336 88 HA3 GLY 12 HA3 GLY 12 25.885 22.491 36.606 89 H ASN 13 H ASN 13 28.525 23.490 35.919 90 HA ASN 13 HA ASN 13 30.455 21.872 37.488 91 HB2 ASN 13 HB2 ASN 13 29.865 21.538 34.506 92 HB3 ASN 13 HB3 ASN 13 31.426 21.106 35.200 93 HD21 ASN 13 HD21 ASN 13 31.170 19.794 37.373 94 HD22 ASN 13 HD22 ASN 13 30.047 18.453 37.256 95 H LYS 14 H LYS 14 32.695 22.351 37.010 96 HA LYS 14 HA LYS 14 33.161 25.154 37.052 97 HB2 LYS 14 HB2 LYS 14 34.626 23.328 37.997 98 HB3 LYS 14 HB3 LYS 14 35.227 23.010 36.364 99 HG2 LYS 14 HG2 LYS 14 35.970 25.392 36.170 100 HG3 LYS 14 HG3 LYS 14 35.381 25.713 37.788 101 HD2 LYS 14 HD2 LYS 14 37.730 23.996 36.956 102 HD3 LYS 14 HD3 LYS 14 37.754 25.494 37.877 103 HE2 LYS 14 HE2 LYS 14 36.863 22.746 38.789 104 HE3 LYS 14 HE3 LYS 14 38.246 23.694 39.339 105 HZ1 LYS 14 HZ1 LYS 14 36.686 25.291 40.307 106 HZ2 LYS 14 HZ2 LYS 14 35.392 24.406 39.850 107 HZ3 LYS 14 HZ3 LYS 14 36.459 23.830 40.965 108 H VAL 15 H VAL 15 33.792 22.856 34.363 109 HA VAL 15 HA VAL 15 33.586 25.164 32.485 110 HB VAL 15 HB VAL 15 35.022 22.554 31.943 111 HG11 VAL 15 HG11 VAL 15 35.933 23.819 30.007 112 HG12 VAL 15 HG12 VAL 15 34.187 23.589 29.904 113 HG13 VAL 15 HG13 VAL 15 34.837 25.163 30.389 114 HG21 VAL 15 HG21 VAL 15 36.351 23.636 33.574 115 HG22 VAL 15 HG22 VAL 15 37.059 24.111 32.024 116 HG23 VAL 15 HG23 VAL 15 36.028 25.243 32.909 117 H VAL 16 H VAL 16 31.963 25.234 31.116 118 HA VAL 16 HA VAL 16 30.296 22.782 30.598 119 HB VAL 16 HB VAL 16 29.320 25.621 31.110 120 HG11 VAL 16 HG11 VAL 16 27.047 24.571 30.900 121 HG12 VAL 16 HG12 VAL 16 27.936 24.601 29.374 122 HG13 VAL 16 HG13 VAL 16 27.837 23.089 30.309 123 HG21 VAL 16 HG21 VAL 16 29.859 24.431 33.200 124 HG22 VAL 16 HG22 VAL 16 28.110 24.554 33.013 125 HG23 VAL 16 HG23 VAL 16 28.929 23.018 32.659 126 H VAL 17 H VAL 17 30.157 22.306 28.473 127 HA VAL 17 HA VAL 17 30.724 24.442 26.452 128 HB VAL 17 HB VAL 17 31.513 21.516 26.602 129 HG11 VAL 17 HG11 VAL 17 30.886 21.938 24.254 130 HG12 VAL 17 HG12 VAL 17 31.855 23.429 24.241 131 HG13 VAL 17 HG13 VAL 17 32.636 21.841 24.402 132 HG21 VAL 17 HG21 VAL 17 33.097 24.090 26.404 133 HG22 VAL 17 HG22 VAL 17 32.985 23.019 27.818 134 HG23 VAL 17 HG23 VAL 17 33.787 22.457 26.346 135 H PHE 18 H PHE 18 29.547 24.532 24.573 136 HA PHE 18 HA PHE 18 27.223 22.649 24.225 137 HB2 PHE 18 HB2 PHE 18 27.329 25.616 23.572 138 HB3 PHE 18 HB3 PHE 18 26.034 24.516 23.135 139 HD1 PHE 18 HD2 PHE 18 24.741 23.322 24.959 140 HD2 PHE 18 HD1 PHE 18 27.354 26.658 25.748 141 HE1 PHE 18 HE2 PHE 18 23.628 23.668 27.149 142 HE2 PHE 18 HE1 PHE 18 26.208 27.030 27.928 143 HZ PHE 18 HZ PHE 18 24.325 25.556 28.599 144 H SER 19 H SER 19 27.326 21.538 22.398 145 HA SER 19 HA SER 19 28.959 22.378 20.049 146 HB2 SER 19 HB2 SER 19 29.312 19.777 21.596 147 HB3 SER 19 HB3 SER 19 30.088 20.201 20.065 148 HG SER 19 HG SER 19 31.519 20.640 21.635 149 H TRP 20 H TRP 20 28.849 20.668 18.296 150 HA TRP 20 HA TRP 20 26.364 18.994 18.364 151 HB2 TRP 20 HB2 TRP 20 27.559 20.357 15.938 152 HB3 TRP 20 HB3 TRP 20 26.253 19.187 15.913 153 HD1 TRP 20 HD1 TRP 20 24.638 20.712 18.432 154 HE1 TRP 20 HE1 TRP 20 23.098 22.628 17.661 155 HE3 TRP 20 HE3 TRP 20 26.945 21.928 14.015 156 HZ2 TRP 20 HZ2 TRP 20 23.090 24.648 15.602 157 HZ3 TRP 20 HZ3 TRP 20 26.206 23.909 12.716 158 HH2 TRP 20 HH2 TRP 20 24.277 25.266 13.484 159 H VAL 21 H VAL 21 26.593 16.914 17.618 160 HA VAL 21 HA VAL 21 29.251 16.061 16.592 161 HB VAL 21 HB VAL 21 28.476 13.761 16.590 162 HG11 VAL 21 HG11 VAL 21 28.368 15.111 19.316 163 HG12 VAL 21 HG12 VAL 21 28.736 13.404 19.001 164 HG13 VAL 21 HG13 VAL 21 29.840 14.662 18.430 165 HG21 VAL 21 HG21 VAL 21 26.015 14.061 16.596 166 HG22 VAL 21 HG22 VAL 21 26.581 13.041 17.926 167 HG23 VAL 21 HG23 VAL 21 26.111 14.721 18.250 168 H THR 22 H THR 22 28.031 15.721 13.230 169 HA THR 22 HA THR 22 30.367 15.344 15.059 170 HB THR 22 HB THR 22 31.355 14.280 12.994 171 HG1 THR 22 HG1 THR 22 29.942 13.530 11.481 172 HG21 THR 22 HG21 THR 22 28.881 12.931 14.154 173 HG22 THR 22 HG22 THR 22 30.491 12.967 14.916 174 HG23 THR 22 HG23 THR 22 30.262 12.132 13.375 175 H CYS 23 H CYS 23 31.907 16.909 15.075 176 HA CYS 23 HA CYS 23 31.793 19.074 13.020 177 HB2 CYS 23 HB2 CYS 23 30.353 19.727 14.833 178 HB3 CYS 23 HB3 CYS 23 31.554 19.242 16.035 179 HG CYS 23 HG CYS 23 31.782 21.635 13.729 180 HA PRO 24 HA PRO 24 36.201 18.125 13.411 181 HB2 PRO 24 HB2 PRO 24 36.352 20.334 11.366 182 HB3 PRO 24 HB3 PRO 24 37.216 18.765 11.408 183 HG2 PRO 24 HG2 PRO 24 35.066 19.071 9.806 184 HG3 PRO 24 HG3 PRO 24 35.235 17.572 10.781 185 HD2 PRO 24 HD2 PRO 24 33.570 20.030 11.391 186 HD3 PRO 24 HD3 PRO 24 33.109 18.309 11.484 187 H TYR 25 H TYR 25 34.649 21.112 14.259 188 HA TYR 25 HA TYR 25 37.077 22.063 15.654 189 HB2 TYR 25 HB2 TYR 25 34.224 23.108 15.745 190 HB3 TYR 25 HB3 TYR 25 35.621 23.857 16.472 191 HD1 TYR 25 HD1 TYR 25 37.497 23.230 13.932 192 HD2 TYR 25 HD2 TYR 25 33.674 25.155 14.522 193 HE1 TYR 25 HE1 TYR 25 37.847 24.557 11.876 194 HE2 TYR 25 HE2 TYR 25 34.052 26.510 12.468 195 HH TYR 25 HH TYR 25 37.021 26.174 10.486 196 H CYS 26 H CYS 26 33.932 20.575 16.616 197 HA CYS 26 HA CYS 26 34.342 20.924 19.388 198 HB2 CYS 26 HB2 CYS 26 32.219 20.342 18.400 199 HB3 CYS 26 HB3 CYS 26 32.800 18.762 17.880 200 HG CYS 26 HG CYS 26 33.362 17.808 20.270 201 H VAL 27 H VAL 27 35.418 18.276 17.322 202 HA VAL 27 HA VAL 27 36.566 16.429 19.012 203 HB VAL 27 HB VAL 27 36.412 16.473 16.691 204 HG11 VAL 27 HG11 VAL 27 38.801 18.010 16.152 205 HG12 VAL 27 HG12 VAL 27 37.655 17.231 15.045 206 HG13 VAL 27 HG13 VAL 27 37.079 18.551 16.064 207 HG21 VAL 27 HG21 VAL 27 39.288 15.878 17.534 208 HG22 VAL 27 HG22 VAL 27 37.917 14.775 17.821 209 HG23 VAL 27 HG23 VAL 27 38.445 15.117 16.166 210 H ARG 28 H ARG 28 38.009 19.023 17.611 211 HA ARG 28 HA ARG 28 40.597 19.154 18.813 212 HB2 ARG 28 HB2 ARG 28 39.218 21.811 18.314 213 HB3 ARG 28 HB3 ARG 28 40.925 21.405 18.228 214 HG2 ARG 28 HG2 ARG 28 40.405 19.974 16.208 215 HG3 ARG 28 HG3 ARG 28 38.756 20.613 16.274 216 HD2 ARG 28 HD2 ARG 28 39.591 22.909 15.980 217 HD3 ARG 28 HD3 ARG 28 41.258 22.302 15.912 218 HE ARG 28 HE ARG 28 39.845 20.835 13.992 219 HH11 ARG 28 HH22 ARG 28 40.550 24.313 14.295 220 HH12 ARG 28 HH21 ARG 28 40.414 24.482 12.551 221 HH21 ARG 28 HH12 ARG 28 39.805 21.239 11.826 222 HH22 ARG 28 HH11 ARG 28 39.964 22.902 11.274 223 H ALA 29 H ALA 29 37.724 20.886 20.014 224 HA ALA 29 HA ALA 29 38.943 21.847 22.419 225 HB1 ALA 29 HB1 ALA 29 36.992 22.938 21.464 226 HB2 ALA 29 HB2 ALA 29 36.009 21.469 21.677 227 HB3 ALA 29 HB3 ALA 29 36.600 22.369 23.091 228 H GLU 30 H GLU 30 36.747 18.986 21.954 229 HA GLU 30 HA GLU 30 36.720 18.160 24.705 230 HB2 GLU 30 HB2 GLU 30 36.637 16.524 22.114 231 HB3 GLU 30 HB3 GLU 30 36.248 15.870 23.703 232 HG2 GLU 30 HG2 GLU 30 34.290 17.281 23.899 233 HG3 GLU 30 HG3 GLU 30 34.665 18.128 22.398 234 H LYS 31 H LYS 31 39.152 17.643 22.251 235 HA LYS 31 HA LYS 31 40.698 15.772 23.850 236 HB2 LYS 31 HB2 LYS 31 40.893 15.582 21.522 237 HB3 LYS 31 HB3 LYS 31 41.013 17.298 21.270 238 HG2 LYS 31 HG2 LYS 31 43.320 16.110 22.748 239 HG3 LYS 31 HG3 LYS 31 43.089 15.511 21.109 240 HD2 LYS 31 HD2 LYS 31 43.298 18.461 21.837 241 HD3 LYS 31 HD3 LYS 31 44.618 17.495 21.210 242 HE2 LYS 31 HE2 LYS 31 41.993 17.850 19.682 243 HE3 LYS 31 HE3 LYS 31 43.341 18.982 19.561 244 HZ1 LYS 31 HZ1 LYS 31 43.374 17.348 17.830 245 HZ2 LYS 31 HZ2 LYS 31 44.723 17.156 18.739 246 HZ3 LYS 31 HZ3 LYS 31 43.434 16.099 18.849 247 H LEU 32 H LEU 32 41.133 19.206 23.042 248 HA LEU 32 HA LEU 32 43.407 19.768 24.628 249 HB2 LEU 32 HB2 LEU 32 42.171 21.107 22.819 250 HB3 LEU 32 HB3 LEU 32 41.051 21.556 24.099 251 HG LEU 32 HG LEU 32 42.662 23.287 23.466 252 HD11 LEU 32 HD11 LEU 32 43.274 22.500 26.320 253 HD12 LEU 32 HD12 LEU 32 43.259 24.109 25.595 254 HD13 LEU 32 HD13 LEU 32 41.731 23.234 25.798 255 HD21 LEU 32 HD21 LEU 32 45.011 23.185 23.974 256 HD22 LEU 32 HD22 LEU 32 44.847 21.561 24.674 257 HD23 LEU 32 HD23 LEU 32 44.579 21.821 22.934 258 H LEU 33 H LEU 33 39.952 20.023 25.517 259 HA LEU 33 HA LEU 33 40.349 21.205 28.053 260 HB2 LEU 33 HB2 LEU 33 38.108 19.516 26.819 261 HB3 LEU 33 HB3 LEU 33 37.898 20.225 28.394 262 HG LEU 33 HG LEU 33 38.488 21.780 25.865 263 HD11 LEU 33 HD11 LEU 33 35.852 21.781 27.263 264 HD12 LEU 33 HD12 LEU 33 36.284 22.493 25.707 265 HD13 LEU 33 HD13 LEU 33 36.231 20.732 25.865 266 HD21 LEU 33 HD21 LEU 33 37.781 23.783 27.136 267 HD22 LEU 33 HD22 LEU 33 37.651 22.782 28.595 268 HD23 LEU 33 HD23 LEU 33 39.236 23.053 27.817 269 H HIS 34 H HIS 34 40.040 17.771 27.222 270 HA HIS 34 HA HIS 34 40.403 16.820 29.951 271 HB2 HIS 34 HB2 HIS 34 40.356 15.510 27.212 272 HB3 HIS 34 HB3 HIS 34 40.762 14.625 28.678 273 HD1 HIS 34 HD1 HIS 34 38.762 13.604 29.959 274 HD2 HIS 34 HD2 HIS 34 37.702 16.781 27.427 275 HE1 HIS 34 HE1 HIS 34 36.227 13.685 29.949 276 H ALA 35 H ALA 35 42.615 17.623 27.197 277 HA ALA 35 HA ALA 35 44.876 16.263 28.396 278 HB1 ALA 35 HB1 ALA 35 46.170 17.478 26.695 279 HB2 ALA 35 HB2 ALA 35 44.706 16.772 25.989 280 HB3 ALA 35 HB3 ALA 35 44.775 18.514 26.342 281 H ARG 36 H ARG 36 43.519 19.447 28.819 282 HA ARG 36 HA ARG 36 45.809 20.380 30.461 283 HB2 ARG 36 HB2 ARG 36 44.753 21.372 28.308 284 HB3 ARG 36 HB3 ARG 36 43.614 22.133 29.359 285 HG2 ARG 36 HG2 ARG 36 45.410 23.729 28.924 286 HG3 ARG 36 HG3 ARG 36 45.370 23.289 30.608 287 HD2 ARG 36 HD2 ARG 36 47.319 21.681 30.137 288 HD3 ARG 36 HD3 ARG 36 47.462 22.477 28.581 289 HE ARG 36 HE ARG 36 47.810 23.712 31.303 290 HH11 ARG 36 HH12 ARG 36 48.314 24.216 27.850 291 HH12 ARG 36 HH11 ARG 36 49.661 25.305 28.156 292 HH21 ARG 36 HH22 ARG 36 49.207 25.198 31.586 293 HH22 ARG 36 HH21 ARG 36 50.051 26.006 30.257 294 H THR 37 H THR 37 43.353 18.942 31.243 295 HA THR 37 HA THR 37 42.548 18.424 33.392 296 HB THR 37 HB THR 37 43.517 20.863 34.710 297 HG1 THR 37 HG1 THR 37 45.285 18.789 33.911 298 HG21 THR 37 HG21 THR 37 42.555 19.068 36.088 299 HG22 THR 37 HG22 THR 37 44.281 19.223 36.449 300 HG23 THR 37 HG23 THR 37 43.701 17.896 35.416 301 H LYS 38 H LYS 38 40.978 20.097 31.519 302 HA LYS 38 HA LYS 38 39.477 21.908 33.349 303 HB2 LYS 38 HB2 LYS 38 39.124 21.174 30.433 304 HB3 LYS 38 HB3 LYS 38 37.859 21.915 31.393 305 HG2 LYS 38 HG2 LYS 38 39.041 23.655 30.203 306 HG3 LYS 38 HG3 LYS 38 39.301 23.841 31.912 307 HD2 LYS 38 HD2 LYS 38 41.490 22.308 30.615 308 HD3 LYS 38 HD3 LYS 38 41.228 23.895 29.896 309 HE2 LYS 38 HE2 LYS 38 41.207 24.895 32.227 310 HE3 LYS 38 HE3 LYS 38 41.667 23.296 32.835 311 HZ1 LYS 38 HZ1 LYS 38 43.526 24.944 32.502 312 HZ2 LYS 38 HZ2 LYS 38 43.774 23.492 31.862 313 HZ3 LYS 38 HZ3 LYS 38 43.354 24.758 30.892 314 H ASP 39 H ASP 39 38.550 20.899 34.903 315 HA ASP 39 HA ASP 39 36.921 18.564 34.702 316 HB2 ASP 39 HB2 ASP 39 37.144 20.882 36.629 317 HB3 ASP 39 HB3 ASP 39 35.713 19.865 36.695 318 H ILE 40 H ILE 40 35.558 18.373 33.197 319 HA ILE 40 HA ILE 40 33.987 20.674 32.180 320 HB ILE 40 HB ILE 40 36.135 20.110 31.096 321 HG12 ILE 40 HG12 ILE 40 33.744 20.833 29.799 322 HG13 ILE 40 HG13 ILE 40 35.406 21.206 29.400 323 HG21 ILE 40 HG21 ILE 40 36.064 17.655 31.377 324 HG22 ILE 40 HG22 ILE 40 34.816 17.542 30.143 325 HG23 ILE 40 HG23 ILE 40 36.442 18.135 29.733 326 HD11 ILE 40 HD11 ILE 40 35.594 19.351 27.881 327 HD12 ILE 40 HD12 ILE 40 33.990 18.721 28.372 328 HD13 ILE 40 HD13 ILE 40 34.123 20.253 27.500 329 H THR 41 H THR 41 32.078 20.453 31.140 330 HA THR 41 HA THR 41 30.872 17.777 30.627 331 HB THR 41 HB THR 41 29.722 20.043 32.264 332 HG1 THR 41 HG1 THR 41 29.307 18.452 33.644 333 HG21 THR 41 HG21 THR 41 27.471 18.991 32.092 334 HG22 THR 41 HG22 THR 41 28.060 17.990 30.747 335 HG23 THR 41 HG23 THR 41 27.985 19.763 30.591 336 H VAL 42 H VAL 42 30.137 17.677 28.528 337 HA VAL 42 HA VAL 42 29.590 20.200 27.065 338 HB VAL 42 HB VAL 42 31.435 19.580 26.040 339 HG11 VAL 42 HG11 VAL 42 32.155 17.878 27.283 340 HG12 VAL 42 HG12 VAL 42 30.996 16.703 26.564 341 HG13 VAL 42 HG13 VAL 42 32.332 17.400 25.597 342 HG21 VAL 42 HG21 VAL 42 29.702 19.548 24.275 343 HG22 VAL 42 HG22 VAL 42 31.109 18.546 23.897 344 HG23 VAL 42 HG23 VAL 42 29.613 17.774 24.448 345 H HIS 43 H HIS 43 27.854 20.498 26.033 346 HA HIS 43 HA HIS 43 25.652 18.509 26.134 347 HB2 HIS 43 HB2 HIS 43 25.867 21.534 25.970 348 HB3 HIS 43 HB3 HIS 43 24.353 20.695 25.898 349 HD1 HIS 43 HD1 HIS 43 26.730 22.153 28.295 350 HD2 HIS 43 HD2 HIS 43 23.717 19.225 28.305 351 HE1 HIS 43 HE1 HIS 43 26.040 21.815 30.755 352 H TYR 44 H TYR 44 25.079 17.543 24.242 353 HA TYR 44 HA TYR 44 25.700 18.811 21.643 354 HB2 TYR 44 HB2 TYR 44 24.610 16.088 22.327 355 HB3 TYR 44 HB3 TYR 44 24.971 16.634 20.695 356 HD1 TYR 44 HD2 TYR 44 27.699 18.091 21.543 357 HD2 TYR 44 HD1 TYR 44 26.017 14.160 22.156 358 HE1 TYR 44 HE2 TYR 44 29.980 17.171 21.847 359 HE2 TYR 44 HE1 TYR 44 28.298 13.260 22.540 360 HH TYR 44 HH TYR 44 31.269 15.234 22.460 361 H VAL 45 H VAL 45 24.265 20.570 21.614 362 HA VAL 45 HA VAL 45 21.453 20.203 22.148 363 HB VAL 45 HB VAL 45 21.113 22.501 21.524 364 HG11 VAL 45 HG11 VAL 45 23.656 22.178 23.140 365 HG12 VAL 45 HG12 VAL 45 22.513 23.542 23.208 366 HG13 VAL 45 HG13 VAL 45 21.996 21.950 23.769 367 HG21 VAL 45 HG21 VAL 45 24.050 22.523 20.661 368 HG22 VAL 45 HG22 VAL 45 22.634 22.742 19.608 369 HG23 VAL 45 HG23 VAL 45 23.010 23.949 20.837 370 H ASP 46 H ASP 46 22.975 19.112 19.504 371 HA ASP 46 HA ASP 46 20.503 19.239 17.823 372 HB2 ASP 46 HB2 ASP 46 22.395 20.044 16.644 373 HB3 ASP 46 HB3 ASP 46 23.396 18.704 17.149 374 H LYS 47 H LYS 47 22.189 17.208 20.035 375 HA LYS 47 HA LYS 47 20.663 14.774 19.217 376 HB2 LYS 47 HB2 LYS 47 22.584 15.346 21.522 377 HB3 LYS 47 HB3 LYS 47 21.635 13.884 21.404 378 HG2 LYS 47 HG2 LYS 47 23.732 14.746 19.370 379 HG3 LYS 47 HG3 LYS 47 23.934 13.546 20.657 380 HD2 LYS 47 HD2 LYS 47 21.869 12.352 19.609 381 HD3 LYS 47 HD3 LYS 47 22.171 13.393 18.201 382 HE2 LYS 47 HE2 LYS 47 24.525 12.504 18.142 383 HE3 LYS 47 HE3 LYS 47 24.108 11.415 19.469 384 HZ1 LYS 47 HZ1 LYS 47 23.828 10.239 17.404 385 HZ2 LYS 47 HZ2 LYS 47 22.356 10.461 18.065 386 HZ3 LYS 47 HZ3 LYS 47 22.795 11.381 16.794 387 H MET 48 H MET 48 20.885 17.077 21.921 388 HA MET 48 HA MET 48 18.668 16.113 23.440 389 HB2 MET 48 HB2 MET 48 19.884 18.903 23.262 390 HB3 MET 48 HB3 MET 48 18.789 18.358 24.530 391 HG2 MET 48 HG2 MET 48 20.422 16.811 25.397 392 HG3 MET 48 HG3 MET 48 21.463 17.019 23.992 393 HE1 MET 48 HE1 MET 48 20.313 18.455 27.422 394 HE2 MET 48 HE2 MET 48 20.952 20.111 27.407 395 HE3 MET 48 HE3 MET 48 19.592 19.678 26.351 396 H SER 49 H SER 49 16.482 16.261 23.045 397 HA SER 49 HA SER 49 15.398 17.543 20.725 398 HB2 SER 49 HB2 SER 49 13.994 16.754 23.299 399 HB3 SER 49 HB3 SER 49 13.189 17.193 21.783 400 HG SER 49 HG SER 49 14.278 14.835 22.542 401 H GLU 50 H GLU 50 15.628 18.730 24.110 402 HA GLU 50 HA GLU 50 14.240 21.189 23.471 403 HB2 GLU 50 HB2 GLU 50 14.708 19.968 25.866 404 HB3 GLU 50 HB3 GLU 50 15.984 21.214 25.881 405 HG2 GLU 50 HG2 GLU 50 14.152 22.866 25.151 406 HG3 GLU 50 HG3 GLU 50 12.985 21.594 25.499 407 H GLY 51 H GLY 51 17.362 20.242 22.646 408 HA2 GLY 51 HA2 GLY 51 19.122 22.269 23.284 409 HA3 GLY 51 HA3 GLY 51 19.143 21.315 21.805 410 H GLU 52 H GLU 52 16.546 22.534 20.839 411 HA GLU 52 HA GLU 52 17.533 24.845 19.445 412 HB2 GLU 52 HB2 GLU 52 14.656 24.062 20.060 413 HB3 GLU 52 HB3 GLU 52 15.197 25.203 18.822 414 HG2 GLU 52 HG2 GLU 52 16.362 23.380 17.625 415 HG3 GLU 52 HG3 GLU 52 15.813 22.222 18.846 416 H GLN 53 H GLN 53 15.776 24.550 22.563 417 HA GLN 53 HA GLN 53 15.299 27.409 22.851 418 HB2 GLN 53 HB2 GLN 53 13.895 25.573 23.800 419 HB3 GLN 53 HB3 GLN 53 15.177 25.189 24.940 420 HG2 GLN 53 HG2 GLN 53 14.085 28.022 24.797 421 HG3 GLN 53 HG3 GLN 53 13.124 26.767 25.548 422 HE21 GLN 53 HE21 GLN 53 14.358 25.385 27.344 423 HE22 GLN 53 HE22 GLN 53 15.255 26.426 28.427 424 H LEU 54 H LEU 54 17.696 25.101 24.138 425 HA LEU 54 HA LEU 54 19.158 27.010 25.731 426 HB2 LEU 54 HB2 LEU 54 20.222 24.455 24.443 427 HB3 LEU 54 HB3 LEU 54 20.953 25.369 25.738 428 HG LEU 54 HG LEU 54 20.112 23.844 27.097 429 HD11 LEU 54 HD11 LEU 54 17.313 24.871 26.579 430 HD12 LEU 54 HD12 LEU 54 17.970 24.132 28.047 431 HD13 LEU 54 HD13 LEU 54 18.502 25.750 27.565 432 HD21 LEU 54 HD21 LEU 54 18.387 22.232 26.602 433 HD22 LEU 54 HD22 LEU 54 18.061 23.067 25.075 434 HD23 LEU 54 HD23 LEU 54 19.653 22.299 25.371 435 H ARG 55 H ARG 55 19.555 25.886 22.354 436 HA ARG 55 HA ARG 55 21.814 27.451 21.584 437 HB2 ARG 55 HB2 ARG 55 21.117 25.558 20.335 438 HB3 ARG 55 HB3 ARG 55 19.436 26.102 20.287 439 HG2 ARG 55 HG2 ARG 55 19.812 27.726 18.702 440 HG3 ARG 55 HG3 ARG 55 21.590 27.508 18.727 441 HD2 ARG 55 HD2 ARG 55 21.384 25.234 17.898 442 HD3 ARG 55 HD3 ARG 55 19.630 25.239 18.126 443 HE ARG 55 HE ARG 55 20.080 27.278 16.284 444 HH11 ARG 55 HH22 ARG 55 20.382 23.765 16.389 445 HH12 ARG 55 HH21 ARG 55 20.017 23.632 14.686 446 HH21 ARG 55 HH12 ARG 55 20.081 27.024 14.124 447 HH22 ARG 55 HH11 ARG 55 20.071 25.418 13.409 448 H GLY 56 H GLY 56 18.305 28.207 21.616 449 HA2 GLY 56 HA2 GLY 56 18.432 30.816 20.503 450 HA3 GLY 56 HA3 GLY 56 17.234 30.241 21.669 451 H GLU 57 H GLU 57 19.103 29.792 23.942 452 HA GLU 57 HA GLU 57 19.348 32.544 24.844 453 HB2 GLU 57 HB2 GLU 57 20.312 29.931 26.037 454 HB3 GLU 57 HB3 GLU 57 20.584 31.504 26.774 455 HG2 GLU 57 HG2 GLU 57 17.930 30.095 26.354 456 HG3 GLU 57 HG3 GLU 57 18.711 30.586 27.839 457 H ILE 58 H ILE 58 21.746 30.283 23.465 458 HA ILE 58 HA ILE 58 23.946 32.167 23.795 459 HB ILE 58 HB ILE 58 23.700 29.961 21.713 460 HG12 ILE 58 HG12 ILE 58 25.032 29.756 24.456 461 HG13 ILE 58 HG13 ILE 58 23.433 29.097 24.084 462 HG21 ILE 58 HG21 ILE 58 26.161 31.327 22.923 463 HG22 ILE 58 HG22 ILE 58 26.163 30.084 21.650 464 HG23 ILE 58 HG23 ILE 58 25.503 31.670 21.314 465 HD11 ILE 58 HD11 ILE 58 24.965 27.299 23.950 466 HD12 ILE 58 HD12 ILE 58 24.454 27.674 22.294 467 HD13 ILE 58 HD13 ILE 58 26.059 28.186 22.877 468 H TYR 59 H TYR 59 21.687 31.418 21.085 469 HA TYR 59 HA TYR 59 22.935 33.127 19.256 470 HB2 TYR 59 HB2 TYR 59 21.090 31.279 18.949 471 HB3 TYR 59 HB3 TYR 59 19.965 32.627 19.067 472 HD1 TYR 59 HD2 TYR 59 20.175 34.531 17.350 473 HD2 TYR 59 HD1 TYR 59 22.527 30.944 17.138 474 HE1 TYR 59 HE2 TYR 59 20.782 35.060 14.965 475 HE2 TYR 59 HE1 TYR 59 23.187 31.490 14.808 476 HH TYR 59 HH TYR 59 23.119 33.005 13.151 477 H GLN 60 H GLN 60 20.235 33.925 21.484 478 HA GLN 60 HA GLN 60 19.659 36.490 20.471 479 HB2 GLN 60 HB2 GLN 60 19.579 35.288 23.274 480 HB3 GLN 60 HB3 GLN 60 19.043 36.943 22.987 481 HG2 GLN 60 HG2 GLN 60 17.225 36.257 21.607 482 HG3 GLN 60 HG3 GLN 60 17.838 34.607 21.476 483 HE21 GLN 60 HE21 GLN 60 17.863 33.284 23.422 484 HE22 GLN 60 HE22 GLN 60 16.751 33.615 24.766 485 H ALA 61 H ALA 61 22.207 35.516 22.787 486 HA ALA 61 HA ALA 61 23.078 38.270 23.266 487 HB1 ALA 61 HB1 ALA 61 22.967 36.678 25.093 488 HB2 ALA 61 HB2 ALA 61 24.068 35.570 24.255 489 HB3 ALA 61 HB3 ALA 61 24.657 37.149 24.824 490 H TYR 62 H TYR 62 24.449 35.454 21.524 491 HA TYR 62 HA TYR 62 26.855 37.084 20.802 492 HB2 TYR 62 HB2 TYR 62 26.542 34.071 20.982 493 HB3 TYR 62 HB3 TYR 62 28.027 34.947 20.651 494 HD1 TYR 62 HD2 TYR 62 29.192 36.239 22.450 495 HD2 TYR 62 HD1 TYR 62 25.685 33.864 23.246 496 HE1 TYR 62 HE2 TYR 62 29.615 36.404 24.912 497 HE2 TYR 62 HE1 TYR 62 26.081 34.073 25.680 498 HH TYR 62 HH TYR 62 27.239 35.232 27.281 499 H LYS 63 H LYS 63 24.067 35.945 19.329 500 HA LYS 63 HA LYS 63 23.406 35.315 17.279 501 HB2 LYS 63 HB2 LYS 63 25.395 37.477 16.512 502 HB3 LYS 63 HB3 LYS 63 24.149 36.845 15.432 503 HG2 LYS 63 HG2 LYS 63 23.517 38.138 18.123 504 HG3 LYS 63 HG3 LYS 63 23.564 39.007 16.589 505 HD2 LYS 63 HD2 LYS 63 21.779 37.679 15.665 506 HD3 LYS 63 HD3 LYS 63 21.743 36.603 17.072 507 HE2 LYS 63 HE2 LYS 63 21.101 38.446 18.546 508 HE3 LYS 63 HE3 LYS 63 21.193 39.579 17.195 509 HZ1 LYS 63 HZ1 LYS 63 18.941 38.881 17.634 510 HZ2 LYS 63 HZ2 LYS 63 19.385 38.322 16.120 511 HZ3 LYS 63 HZ3 LYS 63 19.274 37.314 17.409 512 H HIS 64 H HIS 64 25.171 33.562 18.267 513 HA HIS 64 HA HIS 64 25.918 32.092 15.819 514 HB2 HIS 64 HB2 HIS 64 27.693 32.516 18.268 515 HB3 HIS 64 HB3 HIS 64 27.888 31.158 17.168 516 HD1 HIS 64 HD1 HIS 64 28.134 35.039 17.005 517 HD2 HIS 64 HD2 HIS 64 29.293 31.510 15.021 518 HE1 HIS 64 HE1 HIS 64 29.767 35.741 15.164 519 H GLU 65 H GLU 65 25.351 29.951 15.979 520 HA GLU 65 HA GLU 65 23.932 29.027 18.432 521 HB2 GLU 65 HB2 GLU 65 23.113 27.223 17.007 522 HB3 GLU 65 HB3 GLU 65 22.644 28.808 16.421 523 HG2 GLU 65 HG2 GLU 65 25.025 27.301 15.281 524 HG3 GLU 65 HG3 GLU 65 23.376 26.998 14.759 525 H THR 66 H THR 66 26.831 28.367 16.604 526 HA THR 66 HA THR 66 27.912 26.726 18.780 527 HB THR 66 HB THR 66 28.874 25.124 16.997 528 HG1 THR 66 HG1 THR 66 26.505 25.178 15.678 529 HG21 THR 66 HG21 THR 66 25.942 24.769 17.678 530 HG22 THR 66 HG22 THR 66 27.286 24.465 18.795 531 HG23 THR 66 HG23 THR 66 27.152 23.513 17.317 532 H VAL 67 H VAL 67 30.162 26.585 18.710 533 HA VAL 67 HA VAL 67 31.669 27.960 16.658 534 HB VAL 67 HB VAL 67 32.782 28.930 19.156 535 HG11 VAL 67 HG11 VAL 67 31.816 30.356 16.662 536 HG12 VAL 67 HG12 VAL 67 32.909 31.007 17.905 537 HG13 VAL 67 HG13 VAL 67 33.430 29.648 16.899 538 HG21 VAL 67 HG21 VAL 67 30.069 30.114 18.473 539 HG22 VAL 67 HG22 VAL 67 30.452 29.188 19.949 540 HG23 VAL 67 HG23 VAL 67 31.244 30.735 19.645 541 HA PRO 68 HA PRO 68 30.656 25.492 19.686 542 HB2 PRO 68 HB2 PRO 68 31.836 24.189 21.739 543 HB3 PRO 68 HB3 PRO 68 31.483 23.428 20.159 544 HG2 PRO 68 HG2 PRO 68 34.109 24.664 21.068 545 HG3 PRO 68 HG3 PRO 68 33.838 23.022 20.392 546 HD2 PRO 68 HD2 PRO 68 34.620 25.029 18.792 547 HD3 PRO 68 HD3 PRO 68 33.364 23.900 18.227 548 H ALA 69 H ALA 69 30.021 26.130 21.891 549 HA ALA 69 HA ALA 69 31.388 28.639 22.777 550 HB1 ALA 69 HB1 ALA 69 28.576 27.606 23.342 551 HB2 ALA 69 HB2 ALA 69 29.258 29.132 23.923 552 HB3 ALA 69 HB3 ALA 69 29.010 28.883 22.185 553 H ILE 70 H ILE 70 32.286 28.812 24.802 554 HA ILE 70 HA ILE 70 32.121 26.481 26.659 555 HB ILE 70 HB ILE 70 34.623 28.062 25.983 556 HG12 ILE 70 HG12 ILE 70 35.266 25.521 25.178 557 HG13 ILE 70 HG13 ILE 70 33.582 25.589 24.682 558 HG21 ILE 70 HG21 ILE 70 34.223 25.593 27.710 559 HG22 ILE 70 HG22 ILE 70 35.800 26.280 27.259 560 HG23 ILE 70 HG23 ILE 70 34.691 27.217 28.249 561 HD11 ILE 70 HD11 ILE 70 35.055 26.318 22.862 562 HD12 ILE 70 HD12 ILE 70 34.109 27.713 23.412 563 HD13 ILE 70 HD13 ILE 70 35.803 27.543 23.905 564 H PHE 71 H PHE 71 31.880 26.952 28.742 565 HA PHE 71 HA PHE 71 32.293 29.754 29.649 566 HB2 PHE 71 HB2 PHE 71 30.078 27.852 30.429 567 HB3 PHE 71 HB3 PHE 71 30.369 29.430 31.166 568 HD1 PHE 71 HD1 PHE 71 30.007 31.535 29.816 569 HD2 PHE 71 HD2 PHE 71 28.992 27.633 28.287 570 HE1 PHE 71 HE1 PHE 71 28.603 32.590 28.046 571 HE2 PHE 71 HE2 PHE 71 27.584 28.702 26.530 572 HZ PHE 71 HZ PHE 71 27.388 31.147 26.408 573 H ILE 72 H ILE 72 33.306 30.039 31.598 574 HA ILE 72 HA ILE 72 34.028 27.645 33.221 575 HB ILE 72 HB ILE 72 36.016 29.806 32.429 576 HG12 ILE 72 HG12 ILE 72 35.704 26.915 31.516 577 HG13 ILE 72 HG13 ILE 72 35.557 28.348 30.525 578 HG21 ILE 72 HG21 ILE 72 36.406 28.949 34.705 579 HG22 ILE 72 HG22 ILE 72 36.254 27.273 34.141 580 HG23 ILE 72 HG23 ILE 72 37.626 28.281 33.645 581 HD11 ILE 72 HD11 ILE 72 37.647 27.340 30.014 582 HD12 ILE 72 HD12 ILE 72 37.994 28.828 30.912 583 HD13 ILE 72 HD13 ILE 72 38.119 27.240 31.714 584 H ASN 73 H ASN 73 33.294 27.928 35.214 585 HA ASN 73 HA ASN 73 32.195 28.908 36.954 586 HB2 ASN 73 HB2 ASN 73 34.852 30.359 36.910 587 HB3 ASN 73 HB3 ASN 73 33.694 30.632 38.193 588 HD21 ASN 73 HD21 ASN 73 36.426 29.250 38.028 589 HD22 ASN 73 HD22 ASN 73 36.133 27.863 39.072 590 H GLY 74 H GLY 74 31.140 29.817 34.589 591 HA2 GLY 74 HA2 GLY 74 29.438 31.278 34.015 592 HA3 GLY 74 HA3 GLY 74 29.768 32.264 35.405 593 H ASN 75 H ASN 75 32.655 31.952 33.583 594 HA ASN 75 HA ASN 75 32.226 34.515 32.106 595 HB2 ASN 75 HB2 ASN 75 34.757 32.992 32.837 596 HB3 ASN 75 HB3 ASN 75 34.715 34.541 32.015 597 HD21 ASN 75 HD21 ASN 75 36.127 34.106 34.400 598 HD22 ASN 75 HD22 ASN 75 35.336 34.939 35.719 599 H PHE 76 H PHE 76 32.976 34.669 29.833 600 HA PHE 76 HA PHE 76 32.320 32.154 28.372 601 HB2 PHE 76 HB2 PHE 76 30.743 33.935 28.047 602 HB3 PHE 76 HB3 PHE 76 32.022 35.089 27.711 603 HD1 PHE 76 HD1 PHE 76 30.720 31.792 26.386 604 HD2 PHE 76 HD2 PHE 76 32.521 35.607 25.479 605 HE1 PHE 76 HE1 PHE 76 30.568 31.295 23.963 606 HE2 PHE 76 HE2 PHE 76 32.385 35.088 23.056 607 HZ PHE 76 HZ PHE 76 31.397 32.947 22.295 608 H ILE 77 H ILE 77 33.454 31.271 26.792 609 HA ILE 77 HA ILE 77 35.632 32.673 25.376 610 HB ILE 77 HB ILE 77 35.891 29.767 26.230 611 HG12 ILE 77 HG12 ILE 77 37.949 30.718 27.542 612 HG13 ILE 77 HG13 ILE 77 37.023 32.212 27.607 613 HG21 ILE 77 HG21 ILE 77 37.030 30.366 24.118 614 HG22 ILE 77 HG22 ILE 77 37.891 31.672 24.958 615 HG23 ILE 77 HG23 ILE 77 38.174 29.969 25.381 616 HD11 ILE 77 HD11 ILE 77 35.222 30.951 28.848 617 HD12 ILE 77 HD12 ILE 77 36.143 29.456 28.602 618 HD13 ILE 77 HD13 ILE 77 36.794 30.753 29.622 619 H GLY 78 H GLY 78 35.567 32.189 23.060 620 HA2 GLY 78 HA2 GLY 78 33.828 29.907 22.255 621 HA3 GLY 78 HA3 GLY 78 33.357 31.492 21.679 622 H GLY 79 H GLY 79 34.812 28.766 20.854 623 HA2 GLY 79 HA2 GLY 79 35.468 28.550 18.471 624 HA3 GLY 79 HA3 GLY 79 36.525 29.942 18.694 625 H CYS 80 H CYS 80 37.034 27.012 17.968 626 HA CYS 80 HA CYS 80 38.538 25.849 20.152 627 HB2 CYS 80 HB2 CYS 80 38.303 25.296 17.175 628 HB3 CYS 80 HB3 CYS 80 39.402 24.383 18.227 629 HG CYS 80 HG CYS 80 37.374 22.886 18.229 630 H SER 81 H SER 81 39.487 28.005 17.479 631 HA SER 81 HA SER 81 42.310 27.958 18.169 632 HB2 SER 81 HB2 SER 81 40.730 29.994 16.563 633 HB3 SER 81 HB3 SER 81 42.499 29.833 16.638 634 HG SER 81 HG SER 81 41.858 28.672 14.847 635 H ASP 82 H ASP 82 39.507 29.851 19.235 636 HA ASP 82 HA ASP 82 40.895 31.837 20.778 637 HB2 ASP 82 HB2 ASP 82 38.363 31.533 19.997 638 HB3 ASP 82 HB3 ASP 82 38.181 30.699 21.519 639 H LEU 83 H LEU 83 39.616 28.640 21.525 640 HA LEU 83 HA LEU 83 40.244 28.537 24.300 641 HB2 LEU 83 HB2 LEU 83 38.580 27.109 23.174 642 HB3 LEU 83 HB3 LEU 83 39.836 26.379 22.189 643 HG LEU 83 HG LEU 83 40.870 25.388 24.182 644 HD11 LEU 83 HD11 LEU 83 38.445 26.501 25.664 645 HD12 LEU 83 HD12 LEU 83 39.597 25.313 26.319 646 HD13 LEU 83 HD13 LEU 83 40.145 26.948 25.940 647 HD21 LEU 83 HD21 LEU 83 39.161 23.675 24.559 648 HD22 LEU 83 HD22 LEU 83 37.907 24.756 23.897 649 HD23 LEU 83 HD23 LEU 83 39.211 24.148 22.853 650 H GLU 84 H GLU 84 42.094 27.209 21.473 651 HA GLU 84 HA GLU 84 44.315 26.357 23.122 652 HB2 GLU 84 HB2 GLU 84 44.102 26.866 20.138 653 HB3 GLU 84 HB3 GLU 84 45.605 26.364 20.949 654 HG2 GLU 84 HG2 GLU 84 44.509 24.369 21.850 655 HG3 GLU 84 HG3 GLU 84 43.004 24.820 21.056 656 H ALA 85 H ALA 85 43.545 29.522 21.643 657 HA ALA 85 HA ALA 85 46.140 30.646 22.084 658 HB1 ALA 85 HB1 ALA 85 44.858 32.837 22.050 659 HB2 ALA 85 HB2 ALA 85 44.479 31.770 20.688 660 HB3 ALA 85 HB3 ALA 85 43.345 31.901 22.036 661 H LEU 86 H LEU 86 43.346 30.312 24.315 662 HA LEU 86 HA LEU 86 44.641 31.626 26.544 663 HB2 LEU 86 HB2 LEU 86 42.329 29.659 26.414 664 HB3 LEU 86 HB3 LEU 86 42.835 30.505 27.874 665 HG LEU 86 HG LEU 86 41.841 31.893 25.356 666 HD11 LEU 86 HD11 LEU 86 39.806 32.293 26.640 667 HD12 LEU 86 HD12 LEU 86 40.116 30.553 26.502 668 HD13 LEU 86 HD13 LEU 86 40.467 31.399 28.029 669 HD21 LEU 86 HD21 LEU 86 42.389 32.963 28.156 670 HD22 LEU 86 HD22 LEU 86 43.317 33.363 26.676 671 HD23 LEU 86 HD23 LEU 86 41.635 33.869 26.825 672 H ASP 87 H ASP 87 44.722 28.291 25.366 673 HA ASP 87 HA ASP 87 46.145 27.152 27.631 674 HB2 ASP 87 HB2 ASP 87 45.002 25.765 25.988 675 HB3 ASP 87 HB3 ASP 87 46.026 26.352 24.698 676 H LYS 88 H LYS 88 47.293 28.488 24.498 677 HA LYS 88 HA LYS 88 50.094 28.361 25.145 678 HB2 LYS 88 HB2 LYS 88 48.507 29.903 23.070 679 HB3 LYS 88 HB3 LYS 88 50.223 30.201 23.314 680 HG2 LYS 88 HG2 LYS 88 50.148 28.669 21.563 681 HG3 LYS 88 HG3 LYS 88 50.688 27.757 22.965 682 HD2 LYS 88 HD2 LYS 88 48.316 26.848 23.203 683 HD3 LYS 88 HD3 LYS 88 47.895 27.796 21.761 684 HE2 LYS 88 HE2 LYS 88 48.247 25.715 20.867 685 HE3 LYS 88 HE3 LYS 88 49.761 26.562 20.555 686 HZ1 LYS 88 HZ1 LYS 88 50.546 25.421 22.732 687 HZ2 LYS 88 HZ2 LYS 88 49.238 24.437 22.556 688 HZ3 LYS 88 HZ3 LYS 88 50.383 24.446 21.422 689 H GLU 89 H GLU 89 47.797 31.041 25.668 690 HA GLU 89 HA GLU 89 49.850 32.752 26.862 691 HB2 GLU 89 HB2 GLU 89 46.815 32.914 26.845 692 HB3 GLU 89 HB3 GLU 89 47.864 34.160 27.506 693 HG2 GLU 89 HG2 GLU 89 47.988 33.288 24.592 694 HG3 GLU 89 HG3 GLU 89 46.965 34.583 25.171 695 H GLY 90 H GLY 90 48.549 29.955 28.112 696 HA2 GLY 90 HA2 GLY 90 48.759 29.045 30.208 697 HA3 GLY 90 HA3 GLY 90 49.545 30.535 30.746 698 H LYS 91 H LYS 91 46.535 31.307 29.438 699 HA LYS 91 HA LYS 91 45.501 32.142 32.076 700 HB2 LYS 91 HB2 LYS 91 44.901 32.643 29.133 701 HB3 LYS 91 HB3 LYS 91 43.704 33.068 30.347 702 HG2 LYS 91 HG2 LYS 91 45.083 34.656 31.394 703 HG3 LYS 91 HG3 LYS 91 46.550 34.043 30.623 704 HD2 LYS 91 HD2 LYS 91 45.858 36.199 29.684 705 HD3 LYS 91 HD3 LYS 91 45.898 34.912 28.488 706 HE2 LYS 91 HE2 LYS 91 44.021 36.249 27.990 707 HE3 LYS 91 HE3 LYS 91 43.410 34.721 28.623 708 HZ1 LYS 91 HZ1 LYS 91 42.254 36.657 29.531 709 HZ2 LYS 91 HZ2 LYS 91 42.932 35.800 30.711 710 HZ3 LYS 91 HZ3 LYS 91 43.634 37.228 30.208 711 H LEU 92 H LEU 92 44.898 29.565 29.803 712 HA LEU 92 HA LEU 92 42.293 28.871 30.928 713 HB2 LEU 92 HB2 LEU 92 43.346 28.335 28.583 714 HB3 LEU 92 HB3 LEU 92 44.257 27.088 29.409 715 HG LEU 92 HG LEU 92 42.064 26.069 30.119 716 HD11 LEU 92 HD11 LEU 92 40.022 26.710 28.840 717 HD12 LEU 92 HD12 LEU 92 40.550 27.997 29.927 718 HD13 LEU 92 HD13 LEU 92 40.889 28.112 28.187 719 HD21 LEU 92 HD21 LEU 92 43.327 25.251 28.149 720 HD22 LEU 92 HD22 LEU 92 41.579 25.125 27.868 721 HD23 LEU 92 HD23 LEU 92 42.505 26.440 27.126 722 H ASP 93 H ASP 93 45.616 28.049 31.769 723 HA ASP 93 HA ASP 93 44.714 26.301 33.971 724 HB2 ASP 93 HB2 ASP 93 47.386 27.357 33.045 725 HB3 ASP 93 HB3 ASP 93 47.173 26.675 34.645 726 H GLY 94 H GLY 94 45.615 29.733 33.499 727 HA2 GLY 94 HA2 GLY 94 45.504 30.478 36.238 728 HA3 GLY 94 HA3 GLY 94 45.231 31.553 34.859 729 H LEU 95 H LEU 95 42.895 30.000 33.902 730 HA LEU 95 HA LEU 95 40.773 30.884 35.680 731 HB2 LEU 95 HB2 LEU 95 40.911 29.459 33.008 732 HB3 LEU 95 HB3 LEU 95 39.383 29.664 33.857 733 HG LEU 95 HG LEU 95 41.163 32.027 33.141 734 HD11 LEU 95 HD11 LEU 95 40.432 30.829 31.096 735 HD12 LEU 95 HD12 LEU 95 38.738 30.931 31.650 736 HD13 LEU 95 HD13 LEU 95 39.649 32.405 31.256 737 HD21 LEU 95 HD21 LEU 95 39.532 32.514 34.925 738 HD22 LEU 95 HD22 LEU 95 39.059 33.307 33.425 739 HD23 LEU 95 HD23 LEU 95 38.222 31.823 33.941 740 H LEU 96 H LEU 96 42.380 27.765 35.189 741 HA LEU 96 HA LEU 96 40.531 26.266 36.925 742 HB2 LEU 96 HB2 LEU 96 43.515 25.818 36.459 743 HB3 LEU 96 HB3 LEU 96 42.467 24.704 37.309 744 HG LEU 96 HG LEU 96 42.317 25.331 34.379 745 HD11 LEU 96 HD11 LEU 96 42.962 22.846 36.024 746 HD12 LEU 96 HD12 LEU 96 42.926 22.917 34.266 747 HD13 LEU 96 HD13 LEU 96 44.142 23.844 35.150 748 HD21 LEU 96 HD21 LEU 96 40.029 25.039 35.071 749 HD22 LEU 96 HD22 LEU 96 40.550 23.461 34.462 750 HD23 LEU 96 HD23 LEU 96 40.470 23.738 36.197 751 H SER 97 H SER 97 40.736 25.794 39.106 752 HA SER 97 HA SER 97 42.478 27.223 40.936 753 HB2 SER 97 HB2 SER 97 39.613 28.179 40.556 754 HB3 SER 97 HB3 SER 97 40.500 28.417 42.075 755 HG SER 97 HG SER 97 41.687 29.064 39.609 Start of MODEL 17 1 H1 GLY 1 H1 GLY 1 13.014 36.315 41.765 2 H2 GLY 1 H2 GLY 1 12.475 36.430 40.217 3 H3 GLY 1 H3 GLY 1 14.038 36.803 40.574 4 HA2 GLY 1 HA2 GLY 1 14.509 34.530 41.178 5 HA3 GLY 1 HA3 GLY 1 12.814 34.136 40.805 6 H ALA 2 H ALA 2 15.207 32.995 39.563 7 HA ALA 2 HA ALA 2 15.421 34.306 36.922 8 HB1 ALA 2 HB1 ALA 2 17.388 32.883 36.657 9 HB2 ALA 2 HB2 ALA 2 17.460 33.770 38.191 10 HB3 ALA 2 HB3 ALA 2 17.020 32.047 38.180 11 H MET 3 H MET 3 14.994 33.335 34.961 12 HA MET 3 HA MET 3 13.195 31.030 34.874 13 HB2 MET 3 HB2 MET 3 14.620 32.515 32.635 14 HB3 MET 3 HB3 MET 3 13.405 31.251 32.413 15 HG2 MET 3 HG2 MET 3 12.972 33.949 33.743 16 HG3 MET 3 HG3 MET 3 12.422 33.458 32.143 17 HE1 MET 3 HE1 MET 3 8.990 33.772 33.840 18 HE2 MET 3 HE2 MET 3 10.404 34.848 33.941 19 HE3 MET 3 HE3 MET 3 9.967 34.089 32.392 20 HA PRO 4 HA PRO 4 16.343 28.163 35.315 21 HB2 PRO 4 HB2 PRO 4 15.148 25.780 34.783 22 HB3 PRO 4 HB3 PRO 4 14.565 26.890 36.051 23 HG2 PRO 4 HG2 PRO 4 13.556 26.686 33.186 24 HG3 PRO 4 HG3 PRO 4 12.594 26.587 34.699 25 HD2 PRO 4 HD2 PRO 4 12.850 28.932 33.353 26 HD3 PRO 4 HD3 PRO 4 12.869 28.885 35.142 27 H SER 5 H SER 5 16.406 29.322 32.430 28 HA SER 5 HA SER 5 17.597 27.171 30.863 29 HB2 SER 5 HB2 SER 5 18.162 29.112 29.297 30 HB3 SER 5 HB3 SER 5 16.474 28.751 29.515 31 HG SER 5 HG SER 5 18.000 30.845 30.633 32 H ILE 6 H ILE 6 19.663 27.999 29.670 33 HA ILE 6 HA ILE 6 21.273 26.442 31.100 34 HB ILE 6 HB ILE 6 22.872 26.563 29.439 35 HG12 ILE 6 HG12 ILE 6 21.864 29.301 28.729 36 HG13 ILE 6 HG13 ILE 6 23.487 28.862 29.234 37 HG21 ILE 6 HG21 ILE 6 20.603 25.701 28.948 38 HG22 ILE 6 HG22 ILE 6 20.278 27.220 28.058 39 HG23 ILE 6 HG23 ILE 6 21.592 26.137 27.548 40 HD11 ILE 6 HD11 ILE 6 22.184 28.105 26.584 41 HD12 ILE 6 HD12 ILE 6 23.385 29.382 26.837 42 HD13 ILE 6 HD13 ILE 6 23.827 27.684 27.077 43 H ALA 7 H ALA 7 21.376 29.869 31.379 44 HA ALA 7 HA ALA 7 23.931 30.465 32.348 45 HB1 ALA 7 HB1 ALA 7 22.702 32.275 33.591 46 HB2 ALA 7 HB2 ALA 7 22.198 32.115 31.893 47 HB3 ALA 7 HB3 ALA 7 21.177 31.455 33.180 48 H SER 8 H SER 8 21.250 28.848 34.150 49 HA SER 8 HA SER 8 22.689 28.750 36.680 50 HB2 SER 8 HB2 SER 8 20.259 27.272 35.634 51 HB3 SER 8 HB3 SER 8 20.961 26.997 37.245 52 HG SER 8 HG SER 8 19.641 28.586 37.696 53 H MET 9 H MET 9 22.614 26.596 33.857 54 HA MET 9 HA MET 9 23.932 24.340 35.086 55 HB2 MET 9 HB2 MET 9 24.091 25.156 32.161 56 HB3 MET 9 HB3 MET 9 24.325 23.559 32.850 57 HG2 MET 9 HG2 MET 9 21.955 23.427 33.460 58 HG3 MET 9 HG3 MET 9 21.688 25.070 32.874 59 HE1 MET 9 HE1 MET 9 19.740 22.998 30.249 60 HE2 MET 9 HE2 MET 9 19.914 22.611 31.974 61 HE3 MET 9 HE3 MET 9 19.678 24.298 31.462 62 H ILE 10 H ILE 10 25.117 27.320 33.515 63 HA ILE 10 HA ILE 10 27.898 26.611 33.492 64 HB ILE 10 HB ILE 10 26.956 29.475 33.797 65 HG12 ILE 10 HG12 ILE 10 25.446 28.701 32.122 66 HG13 ILE 10 HG13 ILE 10 26.675 29.667 31.360 67 HG21 ILE 10 HG21 ILE 10 29.267 28.122 32.359 68 HG22 ILE 10 HG22 ILE 10 28.839 29.836 32.154 69 HG23 ILE 10 HG23 ILE 10 29.310 29.232 33.742 70 HD11 ILE 10 HD11 ILE 10 27.798 27.609 30.516 71 HD12 ILE 10 HD12 ILE 10 26.536 26.615 31.276 72 HD13 ILE 10 HD13 ILE 10 26.118 27.737 29.973 73 H LYS 11 H LYS 11 25.815 27.648 36.070 74 HA LYS 11 HA LYS 11 27.990 28.209 37.981 75 HB2 LYS 11 HB2 LYS 11 25.008 28.085 38.364 76 HB3 LYS 11 HB3 LYS 11 26.214 28.638 39.529 77 HG2 LYS 11 HG2 LYS 11 26.894 30.482 38.022 78 HG3 LYS 11 HG3 LYS 11 25.685 29.960 36.823 79 HD2 LYS 11 HD2 LYS 11 23.918 30.144 38.514 80 HD3 LYS 11 HD3 LYS 11 25.128 30.707 39.694 81 HE2 LYS 11 HE2 LYS 11 25.486 32.754 38.497 82 HE3 LYS 11 HE3 LYS 11 24.574 32.179 37.089 83 HZ1 LYS 11 HZ1 LYS 11 23.313 32.486 39.752 84 HZ2 LYS 11 HZ2 LYS 11 23.340 33.700 38.643 85 HZ3 LYS 11 HZ3 LYS 11 22.571 32.276 38.298 86 H GLY 12 H GLY 12 26.521 25.395 36.784 87 HA2 GLY 12 HA2 GLY 12 26.610 23.838 39.311 88 HA3 GLY 12 HA3 GLY 12 25.902 23.343 37.775 89 H ASN 13 H ASN 13 28.280 24.033 36.163 90 HA ASN 13 HA ASN 13 30.420 22.290 37.260 91 HB2 ASN 13 HB2 ASN 13 29.317 22.164 34.434 92 HB3 ASN 13 HB3 ASN 13 30.839 21.463 34.912 93 HD21 ASN 13 HD21 ASN 13 27.601 20.768 34.523 94 HD22 ASN 13 HD22 ASN 13 27.569 19.292 35.494 95 H LYS 14 H LYS 14 32.528 22.762 36.426 96 HA LYS 14 HA LYS 14 32.916 25.660 36.477 97 HB2 LYS 14 HB2 LYS 14 34.131 23.900 37.797 98 HB3 LYS 14 HB3 LYS 14 34.998 23.432 36.331 99 HG2 LYS 14 HG2 LYS 14 36.203 25.482 36.279 100 HG3 LYS 14 HG3 LYS 14 34.960 26.309 37.235 101 HD2 LYS 14 HD2 LYS 14 36.941 26.030 38.607 102 HD3 LYS 14 HD3 LYS 14 35.573 25.113 39.239 103 HE2 LYS 14 HE2 LYS 14 36.590 23.108 37.895 104 HE3 LYS 14 HE3 LYS 14 38.067 24.098 37.852 105 HZ1 LYS 14 HZ1 LYS 14 37.895 22.503 39.762 106 HZ2 LYS 14 HZ2 LYS 14 38.052 24.069 40.295 107 HZ3 LYS 14 HZ3 LYS 14 36.608 23.314 40.328 108 H VAL 15 H VAL 15 33.389 23.154 34.022 109 HA VAL 15 HA VAL 15 33.518 25.325 31.992 110 HB VAL 15 HB VAL 15 35.069 22.736 31.707 111 HG11 VAL 15 HG11 VAL 15 34.876 25.200 29.937 112 HG12 VAL 15 HG12 VAL 15 36.002 23.845 29.701 113 HG13 VAL 15 HG13 VAL 15 34.263 23.582 29.559 114 HG21 VAL 15 HG21 VAL 15 36.227 24.146 33.317 115 HG22 VAL 15 HG22 VAL 15 37.081 24.221 31.773 116 HG23 VAL 15 HG23 VAL 15 36.028 25.568 32.268 117 H VAL 16 H VAL 16 31.937 25.244 30.582 118 HA VAL 16 HA VAL 16 30.388 22.708 30.172 119 HB VAL 16 HB VAL 16 29.173 25.470 30.521 120 HG11 VAL 16 HG11 VAL 16 27.911 22.722 30.104 121 HG12 VAL 16 HG12 VAL 16 27.024 24.213 30.488 122 HG13 VAL 16 HG13 VAL 16 27.876 24.078 28.947 123 HG21 VAL 16 HG21 VAL 16 28.119 24.459 32.552 124 HG22 VAL 16 HG22 VAL 16 29.128 23.018 32.325 125 HG23 VAL 16 HG23 VAL 16 29.873 24.588 32.706 126 H VAL 17 H VAL 17 30.138 22.201 28.049 127 HA VAL 17 HA VAL 17 30.581 24.338 25.989 128 HB VAL 17 HB VAL 17 31.623 21.485 26.098 129 HG11 VAL 17 HG11 VAL 17 30.957 21.979 23.767 130 HG12 VAL 17 HG12 VAL 17 31.867 23.508 23.828 131 HG13 VAL 17 HG13 VAL 17 32.707 21.940 23.929 132 HG21 VAL 17 HG21 VAL 17 32.990 23.016 27.379 133 HG22 VAL 17 HG22 VAL 17 33.819 22.650 25.863 134 HG23 VAL 17 HG23 VAL 17 32.982 24.200 26.055 135 H PHE 18 H PHE 18 29.281 24.339 24.172 136 HA PHE 18 HA PHE 18 27.067 22.309 24.049 137 HB2 PHE 18 HB2 PHE 18 26.902 25.230 23.296 138 HB3 PHE 18 HB3 PHE 18 25.622 24.043 23.172 139 HD1 PHE 18 HD1 PHE 18 27.579 26.166 25.470 140 HD2 PHE 18 HD2 PHE 18 24.396 23.277 25.182 141 HE1 PHE 18 HE1 PHE 18 26.730 26.878 27.690 142 HE2 PHE 18 HE2 PHE 18 23.548 23.995 27.410 143 HZ PHE 18 HZ PHE 18 24.676 25.868 28.621 144 H SER 19 H SER 19 26.989 21.182 22.194 145 HA SER 19 HA SER 19 28.671 22.004 19.848 146 HB2 SER 19 HB2 SER 19 28.667 19.323 21.290 147 HB3 SER 19 HB3 SER 19 29.632 19.763 19.880 148 HG SER 19 HG SER 19 30.915 20.074 21.595 149 H TRP 20 H TRP 20 28.546 20.529 17.955 150 HA TRP 20 HA TRP 20 25.906 19.144 17.628 151 HB2 TRP 20 HB2 TRP 20 27.129 21.282 15.934 152 HB3 TRP 20 HB3 TRP 20 26.436 19.916 15.101 153 HD1 TRP 20 HD1 TRP 20 24.256 20.529 18.032 154 HE1 TRP 20 HE1 TRP 20 22.082 21.683 17.255 155 HE3 TRP 20 HE3 TRP 20 25.763 22.123 13.407 156 HZ2 TRP 20 HZ2 TRP 20 21.162 23.170 15.001 157 HZ3 TRP 20 HZ3 TRP 20 24.213 23.427 11.968 158 HH2 TRP 20 HH2 TRP 20 21.912 23.951 12.745 159 H VAL 21 H VAL 21 25.945 17.175 16.781 160 HA VAL 21 HA VAL 21 28.561 15.878 16.597 161 HB VAL 21 HB VAL 21 26.985 14.942 18.107 162 HG11 VAL 21 HG11 VAL 21 25.220 14.144 15.763 163 HG12 VAL 21 HG12 VAL 21 24.992 13.750 17.470 164 HG13 VAL 21 HG13 VAL 21 24.838 15.427 16.930 165 HG21 VAL 21 HG21 VAL 21 28.676 13.493 17.053 166 HG22 VAL 21 HG22 VAL 21 27.205 12.611 17.478 167 HG23 VAL 21 HG23 VAL 21 27.506 13.045 15.788 168 H THR 22 H THR 22 28.485 15.061 13.084 169 HA THR 22 HA THR 22 30.163 15.609 15.521 170 HB THR 22 HB THR 22 30.891 14.075 13.018 171 HG1 THR 22 HG1 THR 22 29.726 12.755 14.211 172 HG21 THR 22 HG21 THR 22 32.444 14.573 15.603 173 HG22 THR 22 HG22 THR 22 32.885 15.178 13.987 174 HG23 THR 22 HG23 THR 22 32.909 13.444 14.312 175 H CYS 23 H CYS 23 31.649 17.206 15.450 176 HA CYS 23 HA CYS 23 31.618 18.992 13.054 177 HB2 CYS 23 HB2 CYS 23 30.264 19.984 14.727 178 HB3 CYS 23 HB3 CYS 23 31.423 19.634 16.008 179 HG CYS 23 HG CYS 23 31.086 22.279 14.960 180 HA PRO 24 HA PRO 24 35.999 18.213 13.159 181 HB2 PRO 24 HB2 PRO 24 36.929 20.085 11.398 182 HB3 PRO 24 HB3 PRO 24 35.958 18.666 10.897 183 HG2 PRO 24 HG2 PRO 24 34.959 21.484 11.471 184 HG3 PRO 24 HG3 PRO 24 34.662 20.490 10.006 185 HD2 PRO 24 HD2 PRO 24 32.859 20.566 12.015 186 HD3 PRO 24 HD3 PRO 24 33.215 19.026 11.183 187 H TYR 25 H TYR 25 34.614 21.214 14.232 188 HA TYR 25 HA TYR 25 37.047 22.014 15.701 189 HB2 TYR 25 HB2 TYR 25 34.215 23.095 15.839 190 HB3 TYR 25 HB3 TYR 25 35.640 23.806 16.549 191 HD1 TYR 25 HD1 TYR 25 37.669 23.681 14.395 192 HD2 TYR 25 HD2 TYR 25 33.431 24.505 14.149 193 HE1 TYR 25 HE1 TYR 25 38.021 24.897 12.265 194 HE2 TYR 25 HE2 TYR 25 33.795 25.706 11.997 195 HH TYR 25 HH TYR 25 37.080 26.184 10.688 196 H CYS 26 H CYS 26 33.872 20.519 16.498 197 HA CYS 26 HA CYS 26 34.318 20.653 19.300 198 HB2 CYS 26 HB2 CYS 26 32.143 20.294 18.248 199 HB3 CYS 26 HB3 CYS 26 32.539 18.623 17.878 200 HG CYS 26 HG CYS 26 33.030 17.860 20.310 201 H VAL 27 H VAL 27 35.274 18.076 17.053 202 HA VAL 27 HA VAL 27 36.478 16.220 18.763 203 HB VAL 27 HB VAL 27 36.324 16.203 16.441 204 HG11 VAL 27 HG11 VAL 27 38.631 17.853 15.861 205 HG12 VAL 27 HG12 VAL 27 37.513 17.013 14.771 206 HG13 VAL 27 HG13 VAL 27 36.887 18.311 15.802 207 HG21 VAL 27 HG21 VAL 27 37.921 14.623 17.627 208 HG22 VAL 27 HG22 VAL 27 38.374 14.900 15.936 209 HG23 VAL 27 HG23 VAL 27 39.234 15.754 17.238 210 H ARG 28 H ARG 28 37.911 18.787 17.279 211 HA ARG 28 HA ARG 28 40.440 19.013 18.629 212 HB2 ARG 28 HB2 ARG 28 38.941 21.526 17.716 213 HB3 ARG 28 HB3 ARG 28 40.606 21.420 18.212 214 HG2 ARG 28 HG2 ARG 28 40.632 19.551 16.235 215 HG3 ARG 28 HG3 ARG 28 39.310 20.588 15.674 216 HD2 ARG 28 HD2 ARG 28 41.399 21.293 14.655 217 HD3 ARG 28 HD3 ARG 28 40.741 22.549 15.700 218 HE ARG 28 HE ARG 28 43.032 20.715 16.392 219 HH11 ARG 28 HH12 ARG 28 41.690 24.004 16.636 220 HH12 ARG 28 HH11 ARG 28 42.868 24.397 17.903 221 HH21 ARG 28 HH22 ARG 28 44.559 21.526 17.856 222 HH22 ARG 28 HH21 ARG 28 44.363 23.191 18.443 223 H ALA 29 H ALA 29 37.467 20.706 19.595 224 HA ALA 29 HA ALA 29 38.531 21.785 22.018 225 HB1 ALA 29 HB1 ALA 29 35.640 21.105 21.334 226 HB2 ALA 29 HB2 ALA 29 36.196 22.201 22.616 227 HB3 ALA 29 HB3 ALA 29 36.480 22.616 20.914 228 H GLU 30 H GLU 30 36.527 18.745 21.608 229 HA GLU 30 HA GLU 30 36.634 17.959 24.358 230 HB2 GLU 30 HB2 GLU 30 36.532 16.283 21.807 231 HB3 GLU 30 HB3 GLU 30 36.326 15.635 23.435 232 HG2 GLU 30 HG2 GLU 30 34.329 17.091 23.755 233 HG3 GLU 30 HG3 GLU 30 34.436 17.609 22.069 234 H LYS 31 H LYS 31 38.969 17.379 21.758 235 HA LYS 31 HA LYS 31 40.573 15.598 23.271 236 HB2 LYS 31 HB2 LYS 31 40.624 15.702 20.826 237 HB3 LYS 31 HB3 LYS 31 41.126 17.395 20.861 238 HG2 LYS 31 HG2 LYS 31 43.306 16.714 21.884 239 HG3 LYS 31 HG3 LYS 31 42.779 15.025 21.817 240 HD2 LYS 31 HD2 LYS 31 44.178 15.409 19.929 241 HD3 LYS 31 HD3 LYS 31 42.513 15.286 19.320 242 HE2 LYS 31 HE2 LYS 31 42.359 17.571 18.848 243 HE3 LYS 31 HE3 LYS 31 43.665 18.007 19.981 244 HZ1 LYS 31 HZ1 LYS 31 44.011 16.584 17.409 245 HZ2 LYS 31 HZ2 LYS 31 44.441 18.149 17.688 246 HZ3 LYS 31 HZ3 LYS 31 45.234 16.925 18.470 247 H LEU 32 H LEU 32 40.993 19.068 22.602 248 HA LEU 32 HA LEU 32 43.323 19.584 24.166 249 HB2 LEU 32 HB2 LEU 32 42.210 20.891 22.320 250 HB3 LEU 32 HB3 LEU 32 40.978 21.343 23.496 251 HG LEU 32 HG LEU 32 42.549 23.106 22.999 252 HD11 LEU 32 HD11 LEU 32 43.064 23.934 25.155 253 HD12 LEU 32 HD12 LEU 32 41.560 23.006 25.308 254 HD13 LEU 32 HD13 LEU 32 43.112 22.321 25.866 255 HD21 LEU 32 HD21 LEU 32 44.764 21.470 24.262 256 HD22 LEU 32 HD22 LEU 32 44.537 21.711 22.514 257 HD23 LEU 32 HD23 LEU 32 44.868 23.098 23.555 258 H LEU 33 H LEU 33 39.840 19.850 24.979 259 HA LEU 33 HA LEU 33 40.210 20.987 27.551 260 HB2 LEU 33 HB2 LEU 33 37.918 19.362 26.357 261 HB3 LEU 33 HB3 LEU 33 37.796 20.190 27.902 262 HG LEU 33 HG LEU 33 38.412 21.624 25.305 263 HD11 LEU 33 HD11 LEU 33 36.129 20.584 25.288 264 HD12 LEU 33 HD12 LEU 33 35.743 21.671 26.652 265 HD13 LEU 33 HD13 LEU 33 36.207 22.341 25.087 266 HD21 LEU 33 HD21 LEU 33 39.128 22.919 27.205 267 HD22 LEU 33 HD22 LEU 33 37.652 23.639 26.557 268 HD23 LEU 33 HD23 LEU 33 37.558 22.645 28.022 269 H HIS 34 H HIS 34 39.792 17.565 26.639 270 HA HIS 34 HA HIS 34 40.257 16.630 29.348 271 HB2 HIS 34 HB2 HIS 34 40.058 15.334 26.617 272 HB3 HIS 34 HB3 HIS 34 40.592 14.425 28.024 273 HD1 HIS 34 HD1 HIS 34 38.832 14.287 30.109 274 HD2 HIS 34 HD2 HIS 34 37.365 15.607 26.403 275 HE1 HIS 34 HE1 HIS 34 36.283 14.037 30.217 276 H ALA 35 H ALA 35 42.467 17.387 26.571 277 HA ALA 35 HA ALA 35 44.647 15.856 27.670 278 HB1 ALA 35 HB1 ALA 35 44.520 16.450 25.299 279 HB2 ALA 35 HB2 ALA 35 44.663 18.181 25.704 280 HB3 ALA 35 HB3 ALA 35 46.011 17.070 26.014 281 H ARG 36 H ARG 36 43.615 19.141 28.249 282 HA ARG 36 HA ARG 36 45.953 19.670 30.026 283 HB2 ARG 36 HB2 ARG 36 44.187 21.335 28.233 284 HB3 ARG 36 HB3 ARG 36 44.972 22.104 29.602 285 HG2 ARG 36 HG2 ARG 36 46.567 20.422 27.686 286 HG3 ARG 36 HG3 ARG 36 46.256 22.126 27.360 287 HD2 ARG 36 HD2 ARG 36 47.365 21.236 30.044 288 HD3 ARG 36 HD3 ARG 36 48.434 21.461 28.649 289 HE ARG 36 HE ARG 36 47.334 23.777 28.469 290 HH11 ARG 36 HH22 ARG 36 47.793 22.400 31.702 291 HH12 ARG 36 HH21 ARG 36 47.772 24.005 32.403 292 HH21 ARG 36 HH12 ARG 36 47.729 25.690 29.438 293 HH22 ARG 36 HH11 ARG 36 47.970 25.741 31.183 294 H THR 37 H THR 37 43.203 18.481 30.625 295 HA THR 37 HA THR 37 42.001 18.099 32.511 296 HB THR 37 HB THR 37 43.448 19.965 34.260 297 HG1 THR 37 HG1 THR 37 45.222 18.746 34.458 298 HG21 THR 37 HG21 THR 37 41.766 18.283 35.095 299 HG22 THR 37 HG22 THR 37 43.358 18.041 35.824 300 HG23 THR 37 HG23 THR 37 42.811 16.978 34.511 301 H LYS 38 H LYS 38 40.925 20.011 30.826 302 HA LYS 38 HA LYS 38 39.845 22.177 32.573 303 HB2 LYS 38 HB2 LYS 38 39.138 21.212 29.775 304 HB3 LYS 38 HB3 LYS 38 38.041 22.160 30.757 305 HG2 LYS 38 HG2 LYS 38 39.114 23.721 29.368 306 HG3 LYS 38 HG3 LYS 38 39.777 23.967 30.937 307 HD2 LYS 38 HD2 LYS 38 41.179 22.374 28.736 308 HD3 LYS 38 HD3 LYS 38 41.384 24.088 28.942 309 HE2 LYS 38 HE2 LYS 38 41.884 22.797 31.476 310 HE3 LYS 38 HE3 LYS 38 42.726 21.911 30.220 311 HZ1 LYS 38 HZ1 LYS 38 44.084 23.661 31.176 312 HZ2 LYS 38 HZ2 LYS 38 43.875 23.985 29.578 313 HZ3 LYS 38 HZ3 LYS 38 43.046 24.808 30.732 314 H ASP 39 H ASP 39 38.715 21.477 34.227 315 HA ASP 39 HA ASP 39 37.284 19.086 34.387 316 HB2 ASP 39 HB2 ASP 39 38.034 20.704 36.260 317 HB3 ASP 39 HB3 ASP 39 36.607 21.658 35.911 318 H ILE 40 H ILE 40 35.928 18.599 32.772 319 HA ILE 40 HA ILE 40 34.118 20.718 31.755 320 HB ILE 40 HB ILE 40 36.263 20.443 30.659 321 HG12 ILE 40 HG12 ILE 40 33.819 20.934 29.472 322 HG13 ILE 40 HG13 ILE 40 35.411 21.340 28.890 323 HG21 ILE 40 HG21 ILE 40 35.358 17.740 29.611 324 HG22 ILE 40 HG22 ILE 40 36.898 18.560 29.317 325 HG23 ILE 40 HG23 ILE 40 36.500 17.952 30.920 326 HD11 ILE 40 HD11 ILE 40 35.504 19.381 27.458 327 HD12 ILE 40 HD12 ILE 40 33.967 18.766 28.145 328 HD13 ILE 40 HD13 ILE 40 33.988 20.245 27.174 329 H THR 41 H THR 41 32.199 20.457 31.080 330 HA THR 41 HA THR 41 31.026 17.754 30.490 331 HB THR 41 HB THR 41 29.896 20.183 31.920 332 HG1 THR 41 HG1 THR 41 30.837 18.608 33.202 333 HG21 THR 41 HG21 THR 41 28.315 17.895 30.685 334 HG22 THR 41 HG22 THR 41 28.135 19.643 30.372 335 HG23 THR 41 HG23 THR 41 27.700 18.982 31.951 336 H VAL 42 H VAL 42 30.484 17.584 28.311 337 HA VAL 42 HA VAL 42 29.637 20.045 26.894 338 HB VAL 42 HB VAL 42 31.306 19.515 25.637 339 HG11 VAL 42 HG11 VAL 42 31.209 16.612 26.223 340 HG12 VAL 42 HG12 VAL 42 32.358 17.440 25.142 341 HG13 VAL 42 HG13 VAL 42 32.321 17.880 26.844 342 HG21 VAL 42 HG21 VAL 42 29.421 17.526 24.374 343 HG22 VAL 42 HG22 VAL 42 29.418 19.289 24.095 344 HG23 VAL 42 HG23 VAL 42 30.803 18.312 23.596 345 H HIS 43 H HIS 43 27.816 20.265 25.932 346 HA HIS 43 HA HIS 43 25.695 18.169 26.093 347 HB2 HIS 43 HB2 HIS 43 25.772 21.205 26.259 348 HB3 HIS 43 HB3 HIS 43 24.300 20.367 25.867 349 HD1 HIS 43 HD1 HIS 43 26.036 21.647 28.795 350 HD2 HIS 43 HD2 HIS 43 23.677 18.288 27.889 351 HE1 HIS 43 HE1 HIS 43 25.181 20.744 31.031 352 H TYR 44 H TYR 44 25.359 17.198 24.127 353 HA TYR 44 HA TYR 44 25.913 18.709 21.634 354 HB2 TYR 44 HB2 TYR 44 25.247 15.827 22.239 355 HB3 TYR 44 HB3 TYR 44 25.128 16.486 20.614 356 HD1 TYR 44 HD2 TYR 44 27.035 17.291 19.361 357 HD2 TYR 44 HD1 TYR 44 27.527 15.630 23.304 358 HE1 TYR 44 HE2 TYR 44 29.478 17.020 18.935 359 HE2 TYR 44 HE1 TYR 44 29.984 15.426 22.906 360 HH TYR 44 HH TYR 44 31.689 15.733 21.439 361 H VAL 45 H VAL 45 24.400 20.296 21.411 362 HA VAL 45 HA VAL 45 21.667 19.923 22.203 363 HB VAL 45 HB VAL 45 21.206 22.133 21.458 364 HG11 VAL 45 HG11 VAL 45 23.954 22.074 22.747 365 HG12 VAL 45 HG12 VAL 45 22.751 23.377 22.834 366 HG13 VAL 45 HG13 VAL 45 22.408 21.811 23.588 367 HG21 VAL 45 HG21 VAL 45 22.839 23.615 20.381 368 HG22 VAL 45 HG22 VAL 45 23.955 22.244 20.161 369 HG23 VAL 45 HG23 VAL 45 22.378 22.289 19.331 370 H ASP 46 H ASP 46 22.889 18.444 19.696 371 HA ASP 46 HA ASP 46 20.550 18.683 17.889 372 HB2 ASP 46 HB2 ASP 46 22.966 18.633 17.078 373 HB3 ASP 46 HB3 ASP 46 23.032 16.961 17.612 374 H LYS 47 H LYS 47 21.684 16.762 20.540 375 HA LYS 47 HA LYS 47 20.553 14.179 19.888 376 HB2 LYS 47 HB2 LYS 47 21.466 15.549 22.458 377 HB3 LYS 47 HB3 LYS 47 20.902 13.906 22.450 378 HG2 LYS 47 HG2 LYS 47 23.275 14.802 20.764 379 HG3 LYS 47 HG3 LYS 47 23.376 14.230 22.429 380 HD2 LYS 47 HD2 LYS 47 21.937 12.185 21.397 381 HD3 LYS 47 HD3 LYS 47 22.786 12.670 19.927 382 HE2 LYS 47 HE2 LYS 47 24.957 12.342 21.005 383 HE3 LYS 47 HE3 LYS 47 24.193 12.192 22.594 384 HZ1 LYS 47 HZ1 LYS 47 23.111 10.166 21.819 385 HZ2 LYS 47 HZ2 LYS 47 23.918 10.249 20.378 386 HZ3 LYS 47 HZ3 LYS 47 24.750 10.015 21.774 387 H MET 48 H MET 48 19.242 16.964 21.632 388 HA MET 48 HA MET 48 16.682 15.517 22.095 389 HB2 MET 48 HB2 MET 48 16.717 15.962 24.388 390 HB3 MET 48 HB3 MET 48 18.313 15.325 24.015 391 HG2 MET 48 HG2 MET 48 17.545 18.211 24.575 392 HG3 MET 48 HG3 MET 48 18.480 17.136 25.595 393 HE1 MET 48 HE1 MET 48 21.209 19.692 24.978 394 HE2 MET 48 HE2 MET 48 19.509 19.813 25.489 395 HE3 MET 48 HE3 MET 48 20.532 18.504 26.114 396 H SER 49 H SER 49 14.833 16.773 22.545 397 HA SER 49 HA SER 49 14.396 18.974 20.933 398 HB2 SER 49 HB2 SER 49 12.984 18.158 23.496 399 HB3 SER 49 HB3 SER 49 12.335 19.342 22.346 400 HG SER 49 HG SER 49 12.434 17.743 20.723 401 H GLU 50 H GLU 50 15.133 19.086 24.408 402 HA GLU 50 HA GLU 50 14.899 21.853 24.806 403 HB2 GLU 50 HB2 GLU 50 16.607 19.660 26.060 404 HB3 GLU 50 HB3 GLU 50 16.656 21.318 26.667 405 HG2 GLU 50 HG2 GLU 50 15.180 20.139 28.071 406 HG3 GLU 50 HG3 GLU 50 14.212 21.225 27.081 407 H GLY 51 H GLY 51 17.462 20.211 23.072 408 HA2 GLY 51 HA2 GLY 51 19.636 21.937 23.364 409 HA3 GLY 51 HA3 GLY 51 19.200 21.035 21.906 410 H GLU 52 H GLU 52 16.621 22.533 21.516 411 HA GLU 52 HA GLU 52 17.696 24.783 20.013 412 HB2 GLU 52 HB2 GLU 52 15.925 23.933 18.901 413 HB3 GLU 52 HB3 GLU 52 15.201 23.256 20.331 414 HG2 GLU 52 HG2 GLU 52 13.646 24.665 19.475 415 HG3 GLU 52 HG3 GLU 52 14.202 25.431 20.944 416 H GLN 53 H GLN 53 15.987 24.452 23.102 417 HA GLN 53 HA GLN 53 15.677 27.298 23.569 418 HB2 GLN 53 HB2 GLN 53 14.244 25.475 24.497 419 HB3 GLN 53 HB3 GLN 53 15.593 24.934 25.497 420 HG2 GLN 53 HG2 GLN 53 15.575 27.065 26.730 421 HG3 GLN 53 HG3 GLN 53 14.323 27.701 25.646 422 HE21 GLN 53 HE21 GLN 53 12.215 26.496 25.592 423 HE22 GLN 53 HE22 GLN 53 11.709 25.617 27.036 424 H LEU 54 H LEU 54 18.134 24.828 24.426 425 HA LEU 54 HA LEU 54 19.758 26.646 25.997 426 HB2 LEU 54 HB2 LEU 54 20.514 24.083 24.553 427 HB3 LEU 54 HB3 LEU 54 21.563 24.967 25.634 428 HG LEU 54 HG LEU 54 20.855 23.967 27.433 429 HD11 LEU 54 HD11 LEU 54 18.736 25.275 27.602 430 HD12 LEU 54 HD12 LEU 54 17.923 23.991 26.671 431 HD13 LEU 54 HD13 LEU 54 18.643 23.636 28.252 432 HD21 LEU 54 HD21 LEU 54 21.046 22.083 25.930 433 HD22 LEU 54 HD22 LEU 54 19.891 21.794 27.244 434 HD23 LEU 54 HD23 LEU 54 19.293 22.162 25.618 435 H ARG 55 H ARG 55 20.061 25.508 22.577 436 HA ARG 55 HA ARG 55 22.279 27.199 21.971 437 HB2 ARG 55 HB2 ARG 55 22.210 26.310 19.925 438 HB3 ARG 55 HB3 ARG 55 21.126 25.143 20.704 439 HG2 ARG 55 HG2 ARG 55 19.206 26.507 19.795 440 HG3 ARG 55 HG3 ARG 55 20.437 27.374 18.844 441 HD2 ARG 55 HD2 ARG 55 21.174 25.176 17.887 442 HD3 ARG 55 HD3 ARG 55 19.831 24.399 18.743 443 HE ARG 55 HE ARG 55 19.361 26.648 16.810 444 HH11 ARG 55 HH12 ARG 55 18.943 23.144 17.270 445 HH12 ARG 55 HH11 ARG 55 17.615 23.165 16.124 446 HH21 ARG 55 HH22 ARG 55 17.647 26.403 15.361 447 HH22 ARG 55 HH21 ARG 55 16.921 24.803 15.223 448 H GLY 56 H GLY 56 18.830 27.865 21.872 449 HA2 GLY 56 HA2 GLY 56 18.976 30.334 20.522 450 HA3 GLY 56 HA3 GLY 56 17.679 29.820 21.620 451 H GLU 57 H GLU 57 19.336 29.652 24.081 452 HA GLU 57 HA GLU 57 19.498 32.411 24.920 453 HB2 GLU 57 HB2 GLU 57 20.678 29.856 26.054 454 HB3 GLU 57 HB3 GLU 57 20.915 31.433 26.779 455 HG2 GLU 57 HG2 GLU 57 18.339 29.839 26.658 456 HG3 GLU 57 HG3 GLU 57 19.254 30.469 27.999 457 H ILE 58 H ILE 58 21.918 30.224 23.481 458 HA ILE 58 HA ILE 58 24.133 32.075 23.884 459 HB ILE 58 HB ILE 58 23.980 29.809 21.866 460 HG12 ILE 58 HG12 ILE 58 25.070 29.690 24.718 461 HG13 ILE 58 HG13 ILE 58 23.498 29.043 24.248 462 HG21 ILE 58 HG21 ILE 58 26.445 29.887 22.018 463 HG22 ILE 58 HG22 ILE 58 25.831 31.459 21.541 464 HG23 ILE 58 HG23 ILE 58 26.353 31.199 23.219 465 HD11 ILE 58 HD11 ILE 58 24.942 27.206 24.303 466 HD12 ILE 58 HD12 ILE 58 24.649 27.543 22.587 467 HD13 ILE 58 HD13 ILE 58 26.184 28.028 23.349 468 H TYR 59 H TYR 59 22.005 31.286 21.076 469 HA TYR 59 HA TYR 59 23.287 33.105 19.339 470 HB2 TYR 59 HB2 TYR 59 21.575 31.178 18.865 471 HB3 TYR 59 HB3 TYR 59 20.368 32.456 18.967 472 HD1 TYR 59 HD1 TYR 59 20.597 34.481 17.354 473 HD2 TYR 59 HD2 TYR 59 23.072 30.972 17.067 474 HE1 TYR 59 HE1 TYR 59 21.405 35.224 15.114 475 HE2 TYR 59 HE2 TYR 59 23.830 31.657 14.817 476 HH TYR 59 HH TYR 59 23.928 33.376 13.355 477 H GLN 60 H GLN 60 20.466 33.687 21.489 478 HA GLN 60 HA GLN 60 19.844 36.285 20.486 479 HB2 GLN 60 HB2 GLN 60 19.398 34.945 23.182 480 HB3 GLN 60 HB3 GLN 60 18.784 36.561 22.807 481 HG2 GLN 60 HG2 GLN 60 17.452 35.719 20.952 482 HG3 GLN 60 HG3 GLN 60 18.151 34.116 21.099 483 HE21 GLN 60 HE21 GLN 60 15.881 33.365 21.235 484 HE22 GLN 60 HE22 GLN 60 15.109 33.405 22.820 485 H ALA 61 H ALA 61 22.231 35.316 22.975 486 HA ALA 61 HA ALA 61 22.976 38.094 23.532 487 HB1 ALA 61 HB1 ALA 61 22.962 36.441 25.306 488 HB2 ALA 61 HB2 ALA 61 24.120 35.423 24.424 489 HB3 ALA 61 HB3 ALA 61 24.619 37.014 25.040 490 H TYR 62 H TYR 62 24.457 35.381 21.688 491 HA TYR 62 HA TYR 62 26.798 37.132 21.073 492 HB2 TYR 62 HB2 TYR 62 26.654 34.114 21.313 493 HB3 TYR 62 HB3 TYR 62 28.099 35.069 21.013 494 HD1 TYR 62 HD2 TYR 62 28.679 36.938 22.763 495 HD2 TYR 62 HD1 TYR 62 26.094 33.581 23.552 496 HE1 TYR 62 HE2 TYR 62 28.972 37.283 25.208 497 HE2 TYR 62 HE1 TYR 62 26.387 33.907 25.990 498 HH TYR 62 HH TYR 62 27.240 35.365 27.654 499 H LYS 63 H LYS 63 24.170 35.778 19.449 500 HA LYS 63 HA LYS 63 23.683 35.216 17.362 501 HB2 LYS 63 HB2 LYS 63 25.786 37.260 16.573 502 HB3 LYS 63 HB3 LYS 63 24.434 36.735 15.575 503 HG2 LYS 63 HG2 LYS 63 24.131 38.169 18.253 504 HG3 LYS 63 HG3 LYS 63 24.151 38.961 16.686 505 HD2 LYS 63 HD2 LYS 63 22.085 38.145 16.035 506 HD3 LYS 63 HD3 LYS 63 22.136 36.748 17.124 507 HE2 LYS 63 HE2 LYS 63 21.727 38.045 19.057 508 HE3 LYS 63 HE3 LYS 63 22.031 39.573 18.208 509 HZ1 LYS 63 HZ1 LYS 63 20.041 39.288 16.958 510 HZ2 LYS 63 HZ2 LYS 63 19.779 37.774 17.498 511 HZ3 LYS 63 HZ3 LYS 63 19.626 39.080 18.512 512 H HIS 64 H HIS 64 25.498 33.463 18.488 513 HA HIS 64 HA HIS 64 26.223 31.986 16.062 514 HB2 HIS 64 HB2 HIS 64 28.103 32.157 18.473 515 HB3 HIS 64 HB3 HIS 64 28.368 31.230 17.001 516 HD1 HIS 64 HD1 HIS 64 28.703 32.929 14.696 517 HD2 HIS 64 HD2 HIS 64 29.332 34.452 18.562 518 HE1 HIS 64 HE1 HIS 64 30.078 35.052 14.406 519 H GLU 65 H GLU 65 26.268 29.747 16.344 520 HA GLU 65 HA GLU 65 24.126 29.073 18.330 521 HB2 GLU 65 HB2 GLU 65 23.760 29.598 15.697 522 HB3 GLU 65 HB3 GLU 65 24.181 27.972 15.534 523 HG2 GLU 65 HG2 GLU 65 22.396 27.327 17.166 524 HG3 GLU 65 HG3 GLU 65 22.059 29.050 17.390 525 H THR 66 H THR 66 26.521 27.462 16.191 526 HA THR 66 HA THR 66 27.605 26.220 18.612 527 HB THR 66 HB THR 66 28.075 24.078 17.669 528 HG1 THR 66 HG1 THR 66 26.420 24.823 15.485 529 HG21 THR 66 HG21 THR 66 25.971 22.985 17.807 530 HG22 THR 66 HG22 THR 66 25.079 24.471 17.414 531 HG23 THR 66 HG23 THR 66 25.952 24.324 18.957 532 H VAL 67 H VAL 67 29.785 25.893 18.470 533 HA VAL 67 HA VAL 67 31.293 26.810 16.097 534 HB VAL 67 HB VAL 67 31.451 28.134 18.826 535 HG11 VAL 67 HG11 VAL 67 33.747 27.914 18.046 536 HG12 VAL 67 HG12 VAL 67 33.286 28.482 16.423 537 HG13 VAL 67 HG13 VAL 67 33.223 29.581 17.815 538 HG21 VAL 67 HG21 VAL 67 29.682 29.080 17.472 539 HG22 VAL 67 HG22 VAL 67 31.032 30.208 17.527 540 HG23 VAL 67 HG23 VAL 67 30.778 29.220 16.076 541 HA PRO 68 HA PRO 68 30.255 24.639 19.326 542 HB2 PRO 68 HB2 PRO 68 31.343 23.545 21.515 543 HB3 PRO 68 HB3 PRO 68 31.159 22.620 19.997 544 HG2 PRO 68 HG2 PRO 68 33.640 24.089 20.969 545 HG3 PRO 68 HG3 PRO 68 33.503 22.372 20.464 546 HD2 PRO 68 HD2 PRO 68 34.306 24.279 18.719 547 HD3 PRO 68 HD3 PRO 68 33.208 22.979 18.182 548 H ALA 69 H ALA 69 29.558 25.548 21.398 549 HA ALA 69 HA ALA 69 30.849 28.191 21.908 550 HB1 ALA 69 HB1 ALA 69 28.653 28.666 23.042 551 HB2 ALA 69 HB2 ALA 69 28.477 28.236 21.328 552 HB3 ALA 69 HB3 ALA 69 28.114 27.043 22.591 553 H ILE 70 H ILE 70 31.990 28.564 23.764 554 HA ILE 70 HA ILE 70 32.168 26.310 25.724 555 HB ILE 70 HB ILE 70 34.296 28.154 24.586 556 HG12 ILE 70 HG12 ILE 70 34.350 25.151 24.235 557 HG13 ILE 70 HG13 ILE 70 33.337 26.095 23.161 558 HG21 ILE 70 HG21 ILE 70 34.567 25.905 26.621 559 HG22 ILE 70 HG22 ILE 70 35.924 26.704 25.806 560 HG23 ILE 70 HG23 ILE 70 34.884 27.634 26.878 561 HD11 ILE 70 HD11 ILE 70 36.314 26.540 23.511 562 HD12 ILE 70 HD12 ILE 70 35.519 25.736 22.146 563 HD13 ILE 70 HD13 ILE 70 35.244 27.464 22.436 564 H PHE 71 H PHE 71 31.965 26.771 27.850 565 HA PHE 71 HA PHE 71 32.052 29.621 28.704 566 HB2 PHE 71 HB2 PHE 71 30.096 27.462 29.526 567 HB3 PHE 71 HB3 PHE 71 30.249 29.030 30.300 568 HD1 PHE 71 HD1 PHE 71 29.435 27.404 27.016 569 HD2 PHE 71 HD2 PHE 71 29.107 30.938 29.470 570 HE1 PHE 71 HE1 PHE 71 27.857 28.410 25.376 571 HE2 PHE 71 HE2 PHE 71 27.485 31.900 27.863 572 HZ PHE 71 HZ PHE 71 26.873 30.635 25.802 573 H ILE 72 H ILE 72 33.206 30.100 30.455 574 HA ILE 72 HA ILE 72 34.298 27.951 32.229 575 HB ILE 72 HB ILE 72 35.944 30.158 30.915 576 HG12 ILE 72 HG12 ILE 72 36.050 27.157 30.372 577 HG13 ILE 72 HG13 ILE 72 35.338 28.349 29.286 578 HG21 ILE 72 HG21 ILE 72 37.873 28.991 32.007 579 HG22 ILE 72 HG22 ILE 72 36.726 29.574 33.193 580 HG23 ILE 72 HG23 ILE 72 36.743 27.852 32.766 581 HD11 ILE 72 HD11 ILE 72 37.491 27.838 28.438 582 HD12 ILE 72 HD12 ILE 72 37.561 29.485 29.100 583 HD13 ILE 72 HD13 ILE 72 38.260 28.125 30.002 584 H ASN 73 H ASN 73 33.808 28.488 34.272 585 HA ASN 73 HA ASN 73 33.085 29.646 36.062 586 HB2 ASN 73 HB2 ASN 73 35.406 31.450 35.235 587 HB3 ASN 73 HB3 ASN 73 34.630 31.492 36.815 588 HD21 ASN 73 HD21 ASN 73 37.397 30.946 36.569 589 HD22 ASN 73 HD22 ASN 73 37.641 29.236 36.969 590 H GLY 74 H GLY 74 31.257 30.122 34.138 591 HA2 GLY 74 HA2 GLY 74 29.526 31.549 33.531 592 HA3 GLY 74 HA3 GLY 74 30.083 32.680 34.731 593 H ASN 75 H ASN 75 32.577 32.154 32.428 594 HA ASN 75 HA ASN 75 31.838 34.583 30.848 595 HB2 ASN 75 HB2 ASN 75 34.537 33.197 31.112 596 HB3 ASN 75 HB3 ASN 75 34.223 34.734 30.336 597 HD21 ASN 75 HD21 ASN 75 34.583 33.140 33.400 598 HD22 ASN 75 HD22 ASN 75 34.636 34.670 34.301 599 H PHE 76 H PHE 76 31.639 34.466 28.606 600 HA PHE 76 HA PHE 76 31.641 31.780 27.345 601 HB2 PHE 76 HB2 PHE 76 29.620 32.939 26.995 602 HB3 PHE 76 HB3 PHE 76 30.428 34.440 26.607 603 HD1 PHE 76 HD2 PHE 76 30.144 30.895 25.348 604 HD2 PHE 76 HD1 PHE 76 30.800 35.039 24.365 605 HE1 PHE 76 HE2 PHE 76 30.212 30.327 22.932 606 HE2 PHE 76 HE1 PHE 76 30.852 34.465 21.955 607 HZ PHE 76 HZ PHE 76 30.552 32.102 21.233 608 H ILE 77 H ILE 77 32.920 31.143 25.776 609 HA ILE 77 HA ILE 77 34.906 32.948 24.473 610 HB ILE 77 HB ILE 77 35.377 30.128 25.563 611 HG12 ILE 77 HG12 ILE 77 37.381 31.334 26.697 612 HG13 ILE 77 HG13 ILE 77 36.490 32.827 26.439 613 HG21 ILE 77 HG21 ILE 77 37.675 30.358 24.696 614 HG22 ILE 77 HG22 ILE 77 36.508 30.426 23.388 615 HG23 ILE 77 HG23 ILE 77 37.256 31.927 23.986 616 HD11 ILE 77 HD11 ILE 77 34.768 32.097 27.995 617 HD12 ILE 77 HD12 ILE 77 35.364 30.424 27.956 618 HD13 ILE 77 HD13 ILE 77 36.315 31.709 28.728 619 H GLY 78 H GLY 78 34.831 32.755 22.245 620 HA2 GLY 78 HA2 GLY 78 33.538 30.283 21.095 621 HA3 GLY 78 HA3 GLY 78 33.339 31.887 20.410 622 H GLY 79 H GLY 79 35.008 29.079 20.193 623 HA2 GLY 79 HA2 GLY 79 36.095 28.787 17.968 624 HA3 GLY 79 HA3 GLY 79 37.060 30.211 18.341 625 H CYS 80 H CYS 80 37.614 27.113 17.975 626 HA CYS 80 HA CYS 80 38.773 26.249 20.434 627 HB2 CYS 80 HB2 CYS 80 39.483 25.506 17.570 628 HB3 CYS 80 HB3 CYS 80 40.054 24.657 19.020 629 HG CYS 80 HG CYS 80 36.949 25.161 17.955 630 H SER 81 H SER 81 40.238 28.241 17.820 631 HA SER 81 HA SER 81 42.820 28.462 19.071 632 HB2 SER 81 HB2 SER 81 43.117 30.447 17.635 633 HB3 SER 81 HB3 SER 81 42.514 29.042 16.746 634 HG SER 81 HG SER 81 41.234 31.448 17.411 635 H ASP 82 H ASP 82 39.789 30.134 19.693 636 HA ASP 82 HA ASP 82 40.870 32.285 21.288 637 HB2 ASP 82 HB2 ASP 82 38.533 31.875 20.051 638 HB3 ASP 82 HB3 ASP 82 38.058 31.187 21.582 639 H LEU 83 H LEU 83 39.532 29.112 21.954 640 HA LEU 83 HA LEU 83 39.846 29.085 24.839 641 HB2 LEU 83 HB2 LEU 83 38.364 27.526 23.751 642 HB3 LEU 83 HB3 LEU 83 39.625 26.958 22.680 643 HG LEU 83 HG LEU 83 40.812 25.898 24.586 644 HD11 LEU 83 HD11 LEU 83 39.607 25.568 26.719 645 HD12 LEU 83 HD12 LEU 83 39.980 27.276 26.454 646 HD13 LEU 83 HD13 LEU 83 38.329 26.679 26.176 647 HD21 LEU 83 HD21 LEU 83 39.215 24.661 23.153 648 HD22 LEU 83 HD22 LEU 83 39.316 24.023 24.795 649 HD23 LEU 83 HD23 LEU 83 37.919 25.015 24.318 650 H GLU 84 H GLU 84 41.941 27.829 22.193 651 HA GLU 84 HA GLU 84 44.029 26.880 23.917 652 HB2 GLU 84 HB2 GLU 84 44.098 27.727 20.991 653 HB3 GLU 84 HB3 GLU 84 45.472 27.042 21.874 654 HG2 GLU 84 HG2 GLU 84 44.215 24.992 22.335 655 HG3 GLU 84 HG3 GLU 84 42.860 25.579 21.378 656 H ALA 85 H ALA 85 43.383 30.105 22.556 657 HA ALA 85 HA ALA 85 45.904 31.279 23.014 658 HB1 ALA 85 HB1 ALA 85 44.056 32.349 21.756 659 HB2 ALA 85 HB2 ALA 85 43.091 32.482 23.232 660 HB3 ALA 85 HB3 ALA 85 44.607 33.405 23.067 661 H LEU 86 H LEU 86 43.215 30.775 25.308 662 HA LEU 86 HA LEU 86 44.484 32.176 27.534 663 HB2 LEU 86 HB2 LEU 86 42.270 30.083 27.569 664 HB3 LEU 86 HB3 LEU 86 42.693 31.218 28.853 665 HG LEU 86 HG LEU 86 41.496 31.952 26.147 666 HD11 LEU 86 HD11 LEU 86 40.310 31.995 28.951 667 HD12 LEU 86 HD12 LEU 86 39.509 32.530 27.459 668 HD13 LEU 86 HD13 LEU 86 39.920 30.820 27.668 669 HD21 LEU 86 HD21 LEU 86 41.222 34.213 27.160 670 HD22 LEU 86 HD22 LEU 86 42.185 33.677 28.555 671 HD23 LEU 86 HD23 LEU 86 42.918 33.781 26.935 672 H ASP 87 H ASP 87 44.393 28.884 26.343 673 HA ASP 87 HA ASP 87 45.627 27.605 28.617 674 HB2 ASP 87 HB2 ASP 87 44.092 26.593 26.817 675 HB3 ASP 87 HB3 ASP 87 45.518 26.558 25.778 676 H LYS 88 H LYS 88 46.907 28.886 25.586 677 HA LYS 88 HA LYS 88 49.692 28.152 26.007 678 HB2 LYS 88 HB2 LYS 88 48.136 29.957 24.145 679 HB3 LYS 88 HB3 LYS 88 49.866 30.197 24.285 680 HG2 LYS 88 HG2 LYS 88 49.202 28.783 22.387 681 HG3 LYS 88 HG3 LYS 88 50.402 28.060 23.453 682 HD2 LYS 88 HD2 LYS 88 48.876 26.458 24.317 683 HD3 LYS 88 HD3 LYS 88 47.466 27.328 23.715 684 HE2 LYS 88 HE2 LYS 88 48.071 26.927 21.402 685 HE3 LYS 88 HE3 LYS 88 49.611 26.206 21.878 686 HZ1 LYS 88 HZ1 LYS 88 48.614 24.255 22.120 687 HZ2 LYS 88 HZ2 LYS 88 47.506 24.816 23.157 688 HZ3 LYS 88 HZ3 LYS 88 47.203 24.885 21.530 689 H GLU 89 H GLU 89 47.858 31.165 26.583 690 HA GLU 89 HA GLU 89 50.147 32.589 27.678 691 HB2 GLU 89 HB2 GLU 89 47.170 33.150 27.595 692 HB3 GLU 89 HB3 GLU 89 48.322 34.268 28.310 693 HG2 GLU 89 HG2 GLU 89 48.725 33.301 25.456 694 HG3 GLU 89 HG3 GLU 89 47.597 34.592 25.819 695 H GLY 90 H GLY 90 48.362 30.123 29.060 696 HA2 GLY 90 HA2 GLY 90 48.618 29.178 31.136 697 HA3 GLY 90 HA3 GLY 90 49.691 30.510 31.568 698 H LYS 91 H LYS 91 46.609 31.734 30.614 699 HA LYS 91 HA LYS 91 45.946 32.334 33.442 700 HB2 LYS 91 HB2 LYS 91 45.042 33.306 30.700 701 HB3 LYS 91 HB3 LYS 91 44.186 33.720 32.177 702 HG2 LYS 91 HG2 LYS 91 46.291 34.635 33.159 703 HG3 LYS 91 HG3 LYS 91 47.137 34.300 31.645 704 HD2 LYS 91 HD2 LYS 91 44.747 36.178 31.933 705 HD3 LYS 91 HD3 LYS 91 46.447 36.671 31.937 706 HE2 LYS 91 HE2 LYS 91 46.729 35.697 29.657 707 HE3 LYS 91 HE3 LYS 91 44.997 35.321 29.625 708 HZ1 LYS 91 HZ1 LYS 91 44.526 37.685 29.760 709 HZ2 LYS 91 HZ2 LYS 91 46.140 38.049 29.906 710 HZ3 LYS 91 HZ3 LYS 91 45.578 37.417 28.532 711 H LEU 92 H LEU 92 44.960 30.092 30.965 712 HA LEU 92 HA LEU 92 42.452 29.428 32.197 713 HB2 LEU 92 HB2 LEU 92 43.239 28.944 29.850 714 HB3 LEU 92 HB3 LEU 92 44.235 27.652 30.489 715 HG LEU 92 HG LEU 92 42.366 26.338 31.102 716 HD11 LEU 92 HD11 LEU 92 40.544 28.719 30.614 717 HD12 LEU 92 HD12 LEU 92 40.009 27.043 30.911 718 HD13 LEU 92 HD13 LEU 92 40.860 27.909 32.171 719 HD21 LEU 92 HD21 LEU 92 41.009 26.260 28.975 720 HD22 LEU 92 HD22 LEU 92 41.751 27.781 28.488 721 HD23 LEU 92 HD23 LEU 92 42.763 26.343 28.697 722 H ASP 93 H ASP 93 45.772 28.388 32.814 723 HA ASP 93 HA ASP 93 45.187 26.353 34.783 724 HB2 ASP 93 HB2 ASP 93 47.568 28.183 34.266 725 HB3 ASP 93 HB3 ASP 93 47.503 27.054 35.597 726 H GLY 94 H GLY 94 45.214 29.898 34.937 727 HA2 GLY 94 HA2 GLY 94 45.077 30.078 37.845 728 HA3 GLY 94 HA3 GLY 94 44.737 31.363 36.669 729 H LEU 95 H LEU 95 42.758 29.891 35.199 730 HA LEU 95 HA LEU 95 40.385 30.405 36.787 731 HB2 LEU 95 HB2 LEU 95 40.923 29.327 34.001 732 HB3 LEU 95 HB3 LEU 95 39.292 29.491 34.613 733 HG LEU 95 HG LEU 95 41.226 31.845 34.469 734 HD11 LEU 95 HD11 LEU 95 39.086 31.012 32.462 735 HD12 LEU 95 HD12 LEU 95 40.036 32.512 32.428 736 HD13 LEU 95 HD13 LEU 95 40.846 30.964 32.194 737 HD21 LEU 95 HD21 LEU 95 39.291 32.144 35.996 738 HD22 LEU 95 HD22 LEU 95 39.174 33.188 34.580 739 HD23 LEU 95 HD23 LEU 95 38.184 31.721 34.664 740 H LEU 96 H LEU 96 42.174 27.484 36.020 741 HA LEU 96 HA LEU 96 39.972 25.718 36.937 742 HB2 LEU 96 HB2 LEU 96 42.643 25.284 35.574 743 HB3 LEU 96 HB3 LEU 96 41.666 23.914 36.083 744 HG LEU 96 HG LEU 96 40.536 26.106 34.272 745 HD11 LEU 96 HD11 LEU 96 42.537 25.093 33.276 746 HD12 LEU 96 HD12 LEU 96 41.822 23.479 33.471 747 HD13 LEU 96 HD13 LEU 96 41.060 24.710 32.406 748 HD21 LEU 96 HD21 LEU 96 38.962 24.297 33.620 749 HD22 LEU 96 HD22 LEU 96 39.713 23.222 34.830 750 HD23 LEU 96 HD23 LEU 96 38.835 24.680 35.339 751 H SER 97 H SER 97 42.856 27.006 38.254 752 HA SER 97 HA SER 97 44.100 26.660 40.112 753 HB2 SER 97 HB2 SER 97 41.394 25.955 41.271 754 HB3 SER 97 HB3 SER 97 42.855 26.310 42.214 755 HG SER 97 HG SER 97 41.246 27.999 40.652 Start of MODEL 18 1 H1 GLY 1 H1 GLY 1 16.289 33.726 37.047 2 H2 GLY 1 H2 GLY 1 15.567 34.674 38.170 3 H3 GLY 1 H3 GLY 1 17.025 35.119 37.536 4 HA2 GLY 1 HA2 GLY 1 15.295 36.450 36.570 5 HA3 GLY 1 HA3 GLY 1 16.022 35.386 35.347 6 H ALA 2 H ALA 2 13.466 36.426 34.936 7 HA ALA 2 HA ALA 2 11.347 34.850 36.016 8 HB1 ALA 2 HB1 ALA 2 9.982 36.071 34.374 9 HB2 ALA 2 HB2 ALA 2 11.111 37.156 35.201 10 HB3 ALA 2 HB3 ALA 2 11.451 36.622 33.538 11 H MET 3 H MET 3 13.341 34.281 33.146 12 HA MET 3 HA MET 3 11.824 31.748 32.639 13 HB2 MET 3 HB2 MET 3 11.314 33.402 30.892 14 HB3 MET 3 HB3 MET 3 13.037 33.546 30.517 15 HG2 MET 3 HG2 MET 3 13.093 31.112 29.960 16 HG3 MET 3 HG3 MET 3 11.374 30.994 30.344 17 HE1 MET 3 HE1 MET 3 12.834 30.010 27.652 18 HE2 MET 3 HE2 MET 3 11.101 29.770 27.958 19 HE3 MET 3 HE3 MET 3 11.642 30.499 26.429 20 HA PRO 4 HA PRO 4 16.104 30.719 33.965 21 HB2 PRO 4 HB2 PRO 4 14.645 28.110 34.395 22 HB3 PRO 4 HB3 PRO 4 15.911 28.878 35.408 23 HG2 PRO 4 HG2 PRO 4 13.315 29.064 36.113 24 HG3 PRO 4 HG3 PRO 4 14.365 30.520 36.211 25 HD2 PRO 4 HD2 PRO 4 12.368 29.800 34.077 26 HD3 PRO 4 HD3 PRO 4 12.679 31.370 34.872 27 H SER 5 H SER 5 17.737 29.529 33.012 28 HA SER 5 HA SER 5 17.146 27.911 30.599 29 HB2 SER 5 HB2 SER 5 18.461 29.327 29.186 30 HB3 SER 5 HB3 SER 5 17.124 30.262 29.769 31 HG SER 5 HG SER 5 19.150 31.369 29.846 32 H ILE 6 H ILE 6 19.574 27.974 29.437 33 HA ILE 6 HA ILE 6 20.965 25.910 30.653 34 HB ILE 6 HB ILE 6 22.554 26.062 28.971 35 HG12 ILE 6 HG12 ILE 6 21.743 28.945 28.526 36 HG13 ILE 6 HG13 ILE 6 23.328 28.319 28.950 37 HG21 ILE 6 HG21 ILE 6 20.012 27.086 27.706 38 HG22 ILE 6 HG22 ILE 6 21.194 25.902 27.108 39 HG23 ILE 6 HG23 ILE 6 20.162 25.488 28.489 40 HD11 ILE 6 HD11 ILE 6 23.338 28.940 26.610 41 HD12 ILE 6 HD12 ILE 6 23.413 27.164 26.697 42 HD13 ILE 6 HD13 ILE 6 21.896 27.961 26.286 43 H ALA 7 H ALA 7 21.392 29.321 31.138 44 HA ALA 7 HA ALA 7 23.949 29.637 32.143 45 HB1 ALA 7 HB1 ALA 7 22.295 31.421 31.740 46 HB2 ALA 7 HB2 ALA 7 21.363 30.882 33.156 47 HB3 ALA 7 HB3 ALA 7 22.998 31.541 33.364 48 H SER 8 H SER 8 21.176 28.157 33.855 49 HA SER 8 HA SER 8 22.354 27.875 36.470 50 HB2 SER 8 HB2 SER 8 20.331 26.118 35.020 51 HB3 SER 8 HB3 SER 8 20.587 26.206 36.779 52 HG SER 8 HG SER 8 18.857 27.466 36.283 53 H MET 9 H MET 9 22.514 25.823 33.555 54 HA MET 9 HA MET 9 23.711 23.490 34.787 55 HB2 MET 9 HB2 MET 9 24.016 24.373 31.889 56 HB3 MET 9 HB3 MET 9 24.104 22.744 32.539 57 HG2 MET 9 HG2 MET 9 21.695 22.748 32.967 58 HG3 MET 9 HG3 MET 9 21.571 24.433 32.461 59 HE1 MET 9 HE1 MET 9 19.666 22.621 29.606 60 HE2 MET 9 HE2 MET 9 19.678 22.229 31.340 61 HE3 MET 9 HE3 MET 9 19.623 23.925 30.814 62 H ILE 10 H ILE 10 24.917 26.468 33.343 63 HA ILE 10 HA ILE 10 27.605 25.766 32.892 64 HB ILE 10 HB ILE 10 26.709 28.574 33.439 65 HG12 ILE 10 HG12 ILE 10 26.201 26.647 31.151 66 HG13 ILE 10 HG13 ILE 10 25.118 27.777 31.994 67 HG21 ILE 10 HG21 ILE 10 28.495 28.992 31.724 68 HG22 ILE 10 HG22 ILE 10 29.118 28.260 33.197 69 HG23 ILE 10 HG23 ILE 10 28.899 27.272 31.745 70 HD11 ILE 10 HD11 ILE 10 25.399 28.506 29.803 71 HD12 ILE 10 HD12 ILE 10 26.249 29.637 30.901 72 HD13 ILE 10 HD13 ILE 10 27.174 28.420 29.955 73 H LYS 11 H LYS 11 25.999 26.672 35.811 74 HA LYS 11 HA LYS 11 28.368 27.148 37.447 75 HB2 LYS 11 HB2 LYS 11 25.474 26.696 38.204 76 HB3 LYS 11 HB3 LYS 11 26.770 27.317 39.244 77 HG2 LYS 11 HG2 LYS 11 27.031 29.277 37.675 78 HG3 LYS 11 HG3 LYS 11 25.631 28.673 36.752 79 HD2 LYS 11 HD2 LYS 11 24.306 28.670 38.859 80 HD3 LYS 11 HD3 LYS 11 25.706 29.413 39.675 81 HE2 LYS 11 HE2 LYS 11 25.542 31.330 38.022 82 HE3 LYS 11 HE3 LYS 11 24.053 30.614 37.392 83 HZ1 LYS 11 HZ1 LYS 11 23.629 32.341 39.070 84 HZ2 LYS 11 HZ2 LYS 11 23.066 30.892 39.617 85 HZ3 LYS 11 HZ3 LYS 11 24.486 31.525 40.182 86 H GLY 12 H GLY 12 26.994 24.274 36.250 87 HA2 GLY 12 HA2 GLY 12 27.154 22.575 38.563 88 HA3 GLY 12 HA3 GLY 12 26.968 22.078 36.882 89 H ASN 13 H ASN 13 29.472 23.467 36.085 90 HA ASN 13 HA ASN 13 31.680 21.892 37.319 91 HB2 ASN 13 HB2 ASN 13 30.785 21.855 34.391 92 HB3 ASN 13 HB3 ASN 13 32.421 21.435 34.882 93 HD21 ASN 13 HD21 ASN 13 32.670 19.710 36.540 94 HD22 ASN 13 HD22 ASN 13 31.492 18.384 36.494 95 H LYS 14 H LYS 14 33.815 22.655 36.543 96 HA LYS 14 HA LYS 14 34.030 25.556 36.703 97 HB2 LYS 14 HB2 LYS 14 35.750 23.745 37.345 98 HB3 LYS 14 HB3 LYS 14 36.101 23.623 35.631 99 HG2 LYS 14 HG2 LYS 14 37.738 25.103 36.132 100 HG3 LYS 14 HG3 LYS 14 36.453 26.242 35.747 101 HD2 LYS 14 HD2 LYS 14 37.470 27.036 37.733 102 HD3 LYS 14 HD3 LYS 14 35.927 26.315 38.231 103 HE2 LYS 14 HE2 LYS 14 37.132 24.225 38.855 104 HE3 LYS 14 HE3 LYS 14 38.661 24.949 38.370 105 HZ1 LYS 14 HZ1 LYS 14 38.409 26.564 40.188 106 HZ2 LYS 14 HZ2 LYS 14 36.934 25.952 40.577 107 HZ3 LYS 14 HZ3 LYS 14 38.270 25.024 40.749 108 H VAL 15 H VAL 15 34.109 23.236 33.999 109 HA VAL 15 HA VAL 15 33.700 25.474 32.074 110 HB VAL 15 HB VAL 15 35.265 22.923 31.567 111 HG11 VAL 15 HG11 VAL 15 35.965 24.039 29.485 112 HG12 VAL 15 HG12 VAL 15 34.218 23.803 29.518 113 HG13 VAL 15 HG13 VAL 15 34.899 25.408 29.845 114 HG21 VAL 15 HG21 VAL 15 36.641 24.215 33.005 115 HG22 VAL 15 HG22 VAL 15 37.199 24.623 31.375 116 HG23 VAL 15 HG23 VAL 15 36.149 25.743 32.254 117 H VAL 16 H VAL 16 32.064 25.309 30.649 118 HA VAL 16 HA VAL 16 30.694 22.684 30.279 119 HB VAL 16 HB VAL 16 29.266 25.271 30.911 120 HG11 VAL 16 HG11 VAL 16 27.996 24.079 29.175 121 HG12 VAL 16 HG12 VAL 16 28.141 22.556 30.086 122 HG13 VAL 16 HG13 VAL 16 27.188 23.909 30.731 123 HG21 VAL 16 HG21 VAL 16 30.021 24.167 32.942 124 HG22 VAL 16 HG22 VAL 16 28.312 23.755 32.766 125 HG23 VAL 16 HG23 VAL 16 29.540 22.572 32.321 126 H VAL 17 H VAL 17 30.102 22.237 28.208 127 HA VAL 17 HA VAL 17 30.646 24.315 26.114 128 HB VAL 17 HB VAL 17 31.603 21.432 26.303 129 HG11 VAL 17 HG11 VAL 17 31.934 23.383 23.983 130 HG12 VAL 17 HG12 VAL 17 32.708 21.783 24.134 131 HG13 VAL 17 HG13 VAL 17 30.962 21.890 23.959 132 HG21 VAL 17 HG21 VAL 17 33.012 22.948 27.547 133 HG22 VAL 17 HG22 VAL 17 33.836 22.533 26.041 134 HG23 VAL 17 HG23 VAL 17 33.037 24.109 26.203 135 H PHE 18 H PHE 18 29.292 24.431 24.391 136 HA PHE 18 HA PHE 18 27.054 22.442 24.228 137 HB2 PHE 18 HB2 PHE 18 26.954 25.389 23.570 138 HB3 PHE 18 HB3 PHE 18 25.637 24.245 23.415 139 HD1 PHE 18 HD1 PHE 18 24.438 23.397 25.417 140 HD2 PHE 18 HD2 PHE 18 27.629 26.269 25.752 141 HE1 PHE 18 HE1 PHE 18 23.641 24.022 27.691 142 HE2 PHE 18 HE2 PHE 18 26.823 26.903 28.013 143 HZ PHE 18 HZ PHE 18 24.803 25.822 28.965 144 H SER 19 H SER 19 26.884 21.344 22.446 145 HA SER 19 HA SER 19 28.555 22.042 20.053 146 HB2 SER 19 HB2 SER 19 28.379 19.390 21.529 147 HB3 SER 19 HB3 SER 19 29.432 19.788 20.156 148 HG SER 19 HG SER 19 30.696 20.150 21.846 149 H TRP 20 H TRP 20 28.267 20.469 18.161 150 HA TRP 20 HA TRP 20 25.458 19.431 18.006 151 HB2 TRP 20 HB2 TRP 20 26.421 21.751 16.629 152 HB3 TRP 20 HB3 TRP 20 26.191 20.486 15.446 153 HD1 TRP 20 HD1 TRP 20 23.956 21.214 18.518 154 HE1 TRP 20 HE1 TRP 20 21.552 21.822 17.680 155 HE3 TRP 20 HE3 TRP 20 24.742 21.010 13.464 156 HZ2 TRP 20 HZ2 TRP 20 20.295 22.398 15.199 157 HZ3 TRP 20 HZ3 TRP 20 22.959 21.715 11.880 158 HH2 TRP 20 HH2 TRP 20 20.735 22.422 12.736 159 H VAL 21 H VAL 21 25.089 17.601 16.801 160 HA VAL 21 HA VAL 21 27.496 15.986 16.303 161 HB VAL 21 HB VAL 21 24.593 15.166 16.033 162 HG11 VAL 21 HG11 VAL 21 26.182 13.698 14.814 163 HG12 VAL 21 HG12 VAL 21 27.171 13.546 16.280 164 HG13 VAL 21 HG13 VAL 21 25.525 12.881 16.233 165 HG21 VAL 21 HG21 VAL 21 25.004 15.800 18.363 166 HG22 VAL 21 HG22 VAL 21 24.911 14.046 18.213 167 HG23 VAL 21 HG23 VAL 21 26.496 14.828 18.385 168 H THR 22 H THR 22 27.360 16.217 12.686 169 HA THR 22 HA THR 22 29.082 15.983 15.135 170 HB THR 22 HB THR 22 29.653 15.117 12.291 171 HG1 THR 22 HG1 THR 22 28.266 13.691 13.061 172 HG21 THR 22 HG21 THR 22 31.537 13.883 13.345 173 HG22 THR 22 HG22 THR 22 31.183 14.673 14.896 174 HG23 THR 22 HG23 THR 22 31.736 15.631 13.500 175 H CYS 23 H CYS 23 30.847 17.390 15.404 176 HA CYS 23 HA CYS 23 31.049 19.656 13.449 177 HB2 CYS 23 HB2 CYS 23 30.649 19.758 16.434 178 HB3 CYS 23 HB3 CYS 23 31.468 21.049 15.534 179 HG CYS 23 HG CYS 23 28.484 19.764 15.176 180 HA PRO 24 HA PRO 24 35.155 17.842 13.691 181 HB2 PRO 24 HB2 PRO 24 35.611 20.079 11.707 182 HB3 PRO 24 HB3 PRO 24 36.250 18.404 11.691 183 HG2 PRO 24 HG2 PRO 24 34.108 18.995 10.165 184 HG3 PRO 24 HG3 PRO 24 34.094 17.499 11.156 185 HD2 PRO 24 HD2 PRO 24 32.830 20.184 11.776 186 HD3 PRO 24 HD3 PRO 24 32.138 18.538 11.923 187 H TYR 25 H TYR 25 34.341 21.093 14.663 188 HA TYR 25 HA TYR 25 36.937 21.486 16.011 189 HB2 TYR 25 HB2 TYR 25 34.257 22.935 16.113 190 HB3 TYR 25 HB3 TYR 25 35.591 23.354 17.151 191 HD1 TYR 25 HD2 TYR 25 37.998 23.418 15.706 192 HD2 TYR 25 HD1 TYR 25 34.065 24.658 14.444 193 HE1 TYR 25 HE2 TYR 25 39.016 25.014 14.092 194 HE2 TYR 25 HE1 TYR 25 35.086 26.225 12.807 195 HH TYR 25 HH TYR 25 37.036 26.910 11.804 196 H CYS 26 H CYS 26 33.698 20.222 17.051 197 HA CYS 26 HA CYS 26 34.323 20.638 19.800 198 HB2 CYS 26 HB2 CYS 26 32.085 20.435 18.936 199 HB3 CYS 26 HB3 CYS 26 32.289 18.704 18.606 200 HG CYS 26 HG CYS 26 32.897 17.980 21.071 201 H VAL 27 H VAL 27 34.934 17.830 17.755 202 HA VAL 27 HA VAL 27 36.080 15.975 19.477 203 HB VAL 27 HB VAL 27 35.964 15.685 17.288 204 HG11 VAL 27 HG11 VAL 27 37.902 17.575 16.286 205 HG12 VAL 27 HG12 VAL 27 36.907 16.407 15.416 206 HG13 VAL 27 HG13 VAL 27 36.098 17.706 16.267 207 HG21 VAL 27 HG21 VAL 27 38.949 15.672 17.819 208 HG22 VAL 27 HG22 VAL 27 37.806 14.446 18.411 209 HG23 VAL 27 HG23 VAL 27 38.095 14.618 16.669 210 H ARG 28 H ARG 28 37.655 18.314 17.832 211 HA ARG 28 HA ARG 28 40.234 18.421 19.043 212 HB2 ARG 28 HB2 ARG 28 39.106 21.109 18.222 213 HB3 ARG 28 HB3 ARG 28 40.762 20.520 18.168 214 HG2 ARG 28 HG2 ARG 28 39.995 18.893 16.344 215 HG3 ARG 28 HG3 ARG 28 38.462 19.796 16.370 216 HD2 ARG 28 HD2 ARG 28 39.772 21.904 15.983 217 HD3 ARG 28 HD3 ARG 28 41.220 20.901 15.757 218 HE ARG 28 HE ARG 28 39.341 19.859 13.978 219 HH11 ARG 28 HH22 ARG 28 40.874 22.966 14.389 220 HH12 ARG 28 HH21 ARG 28 40.629 23.426 12.717 221 HH21 ARG 28 HH12 ARG 28 39.142 20.423 11.821 222 HH22 ARG 28 HH11 ARG 28 39.835 21.925 11.283 223 H ALA 29 H ALA 29 37.443 20.340 20.087 224 HA ALA 29 HA ALA 29 38.729 21.539 22.375 225 HB1 ALA 29 HB1 ALA 29 36.459 22.172 23.032 226 HB2 ALA 29 HB2 ALA 29 36.706 22.467 21.299 227 HB3 ALA 29 HB3 ALA 29 35.767 21.057 21.837 228 H GLU 30 H GLU 30 36.533 18.667 22.149 229 HA GLU 30 HA GLU 30 36.708 17.872 24.886 230 HB2 GLU 30 HB2 GLU 30 36.227 16.261 22.328 231 HB3 GLU 30 HB3 GLU 30 36.065 15.601 23.956 232 HG2 GLU 30 HG2 GLU 30 34.299 17.247 24.475 233 HG3 GLU 30 HG3 GLU 30 34.393 17.913 22.848 234 H LYS 31 H LYS 31 39.045 17.342 22.287 235 HA LYS 31 HA LYS 31 40.705 15.583 23.878 236 HB2 LYS 31 HB2 LYS 31 40.852 15.541 21.466 237 HB3 LYS 31 HB3 LYS 31 41.057 17.283 21.378 238 HG2 LYS 31 HG2 LYS 31 43.332 17.050 22.431 239 HG3 LYS 31 HG3 LYS 31 43.099 15.292 22.436 240 HD2 LYS 31 HD2 LYS 31 44.402 15.892 20.500 241 HD3 LYS 31 HD3 LYS 31 42.785 15.376 19.961 242 HE2 LYS 31 HE2 LYS 31 42.124 17.515 19.356 243 HE3 LYS 31 HE3 LYS 31 43.312 18.303 20.425 244 HZ1 LYS 31 HZ1 LYS 31 43.945 18.493 18.070 245 HZ2 LYS 31 HZ2 LYS 31 45.068 17.637 18.880 246 HZ3 LYS 31 HZ3 LYS 31 43.993 16.851 17.925 247 H LEU 32 H LEU 32 40.956 19.072 23.144 248 HA LEU 32 HA LEU 32 43.247 19.629 24.697 249 HB2 LEU 32 HB2 LEU 32 41.970 21.004 22.961 250 HB3 LEU 32 HB3 LEU 32 40.834 21.384 24.241 251 HG LEU 32 HG LEU 32 42.440 23.166 23.660 252 HD11 LEU 32 HD11 LEU 32 42.943 23.965 25.829 253 HD12 LEU 32 HD12 LEU 32 41.412 23.076 25.949 254 HD13 LEU 32 HD13 LEU 32 42.930 22.344 26.530 255 HD21 LEU 32 HD21 LEU 32 44.391 21.732 23.199 256 HD22 LEU 32 HD22 LEU 32 44.772 23.072 24.288 257 HD23 LEU 32 HD23 LEU 32 44.585 21.435 24.942 258 H LEU 33 H LEU 33 39.812 19.826 25.597 259 HA LEU 33 HA LEU 33 40.193 21.008 28.141 260 HB2 LEU 33 HB2 LEU 33 37.922 19.396 26.886 261 HB3 LEU 33 HB3 LEU 33 37.734 20.238 28.411 262 HG LEU 33 HG LEU 33 38.547 21.606 25.812 263 HD11 LEU 33 HD11 LEU 33 35.815 21.780 27.036 264 HD12 LEU 33 HD12 LEU 33 36.384 22.434 25.501 265 HD13 LEU 33 HD13 LEU 33 36.231 20.681 25.693 266 HD21 LEU 33 HD21 LEU 33 37.648 22.686 28.508 267 HD22 LEU 33 HD22 LEU 33 39.232 22.934 27.726 268 HD23 LEU 33 HD23 LEU 33 37.779 23.677 27.047 269 H HIS 34 H HIS 34 39.918 17.603 27.233 270 HA HIS 34 HA HIS 34 40.215 16.607 29.956 271 HB2 HIS 34 HB2 HIS 34 40.062 15.302 27.222 272 HB3 HIS 34 HB3 HIS 34 40.464 14.400 28.679 273 HD1 HIS 34 HD1 HIS 34 38.407 13.220 29.667 274 HD2 HIS 34 HD2 HIS 34 37.486 16.784 27.648 275 HE1 HIS 34 HE1 HIS 34 35.910 13.546 29.912 276 H ALA 35 H ALA 35 42.423 17.396 27.240 277 HA ALA 35 HA ALA 35 44.688 15.965 28.371 278 HB1 ALA 35 HB1 ALA 35 44.479 16.574 25.981 279 HB2 ALA 35 HB2 ALA 35 44.558 18.296 26.404 280 HB3 ALA 35 HB3 ALA 35 45.956 17.248 26.702 281 H ARG 36 H ARG 36 43.448 19.238 28.704 282 HA ARG 36 HA ARG 36 45.755 20.064 30.413 283 HB2 ARG 36 HB2 ARG 36 43.848 21.541 28.595 284 HB3 ARG 36 HB3 ARG 36 44.895 22.359 29.732 285 HG2 ARG 36 HG2 ARG 36 45.998 20.460 27.629 286 HG3 ARG 36 HG3 ARG 36 45.793 22.186 27.339 287 HD2 ARG 36 HD2 ARG 36 47.442 21.054 29.637 288 HD3 ARG 36 HD3 ARG 36 48.116 21.495 28.062 289 HE ARG 36 HE ARG 36 47.068 23.831 28.545 290 HH11 ARG 36 HH22 ARG 36 48.891 21.974 30.924 291 HH12 ARG 36 HH21 ARG 36 49.267 23.435 31.805 292 HH21 ARG 36 HH12 ARG 36 47.281 25.431 29.827 293 HH22 ARG 36 HH11 ARG 36 48.367 25.395 31.218 294 H THR 37 H THR 37 43.280 18.772 31.231 295 HA THR 37 HA THR 37 42.176 18.499 33.228 296 HB THR 37 HB THR 37 43.525 20.651 34.672 297 HG1 THR 37 HG1 THR 37 45.519 19.822 34.556 298 HG21 THR 37 HG21 THR 37 42.248 18.805 35.811 299 HG22 THR 37 HG22 THR 37 43.936 18.880 36.334 300 HG23 THR 37 HG23 THR 37 43.415 17.631 35.181 301 H LYS 38 H LYS 38 40.928 20.343 31.422 302 HA LYS 38 HA LYS 38 39.587 22.289 33.244 303 HB2 LYS 38 HB2 LYS 38 39.118 21.424 30.368 304 HB3 LYS 38 HB3 LYS 38 37.936 22.301 31.323 305 HG2 LYS 38 HG2 LYS 38 39.125 23.906 30.000 306 HG3 LYS 38 HG3 LYS 38 39.578 24.161 31.661 307 HD2 LYS 38 HD2 LYS 38 41.488 22.408 30.180 308 HD3 LYS 38 HD3 LYS 38 41.273 24.002 29.456 309 HE2 LYS 38 HE2 LYS 38 41.672 25.034 31.746 310 HE3 LYS 38 HE3 LYS 38 42.061 23.401 32.315 311 HZ1 LYS 38 HZ1 LYS 38 43.636 24.779 30.173 312 HZ2 LYS 38 HZ2 LYS 38 44.066 24.673 31.756 313 HZ3 LYS 38 HZ3 LYS 38 43.948 23.335 30.939 314 H ASP 39 H ASP 39 38.569 21.340 34.874 315 HA ASP 39 HA ASP 39 36.932 19.030 34.718 316 HB2 ASP 39 HB2 ASP 39 37.359 20.060 36.883 317 HB3 ASP 39 HB3 ASP 39 36.562 21.551 36.384 318 H ILE 40 H ILE 40 35.750 18.712 33.057 319 HA ILE 40 HA ILE 40 34.067 20.874 31.945 320 HB ILE 40 HB ILE 40 36.201 20.425 30.848 321 HG12 ILE 40 HG12 ILE 40 33.699 20.916 29.655 322 HG13 ILE 40 HG13 ILE 40 35.285 21.380 29.143 323 HG21 ILE 40 HG21 ILE 40 35.074 17.716 30.038 324 HG22 ILE 40 HG22 ILE 40 36.623 18.426 29.542 325 HG23 ILE 40 HG23 ILE 40 36.354 17.985 31.218 326 HD11 ILE 40 HD11 ILE 40 33.924 18.776 28.328 327 HD12 ILE 40 HD12 ILE 40 33.984 20.255 27.358 328 HD13 ILE 40 HD13 ILE 40 35.486 19.392 27.713 329 H THR 41 H THR 41 32.137 20.568 31.095 330 HA THR 41 HA THR 41 31.045 17.826 30.669 331 HB THR 41 HB THR 41 29.960 20.046 32.365 332 HG1 THR 41 HG1 THR 41 29.853 18.490 33.710 333 HG21 THR 41 HG21 THR 41 28.147 19.928 30.799 334 HG22 THR 41 HG22 THR 41 27.683 19.063 32.270 335 HG23 THR 41 HG23 THR 41 28.162 18.139 30.826 336 H VAL 42 H VAL 42 30.268 17.595 28.603 337 HA VAL 42 HA VAL 42 29.480 20.025 27.112 338 HB VAL 42 HB VAL 42 31.201 19.456 25.916 339 HG11 VAL 42 HG11 VAL 42 32.167 17.827 27.132 340 HG12 VAL 42 HG12 VAL 42 30.999 16.572 26.578 341 HG13 VAL 42 HG13 VAL 42 32.174 17.311 25.452 342 HG21 VAL 42 HG21 VAL 42 30.721 18.292 23.862 343 HG22 VAL 42 HG22 VAL 42 29.333 17.479 24.605 344 HG23 VAL 42 HG23 VAL 42 29.314 19.245 24.344 345 H HIS 43 H HIS 43 27.660 20.235 26.184 346 HA HIS 43 HA HIS 43 25.652 18.033 26.224 347 HB2 HIS 43 HB2 HIS 43 25.445 20.164 27.720 348 HB3 HIS 43 HB3 HIS 43 25.070 21.012 26.239 349 HD1 HIS 43 HD1 HIS 43 23.608 17.481 27.002 350 HD2 HIS 43 HD2 HIS 43 22.634 21.568 27.249 351 HE1 HIS 43 HE1 HIS 43 21.114 17.605 27.477 352 H TYR 44 H TYR 44 25.356 17.222 24.206 353 HA TYR 44 HA TYR 44 25.792 18.871 21.757 354 HB2 TYR 44 HB2 TYR 44 25.334 15.930 22.275 355 HB3 TYR 44 HB3 TYR 44 25.063 16.666 20.706 356 HD1 TYR 44 HD2 TYR 44 27.766 15.977 23.189 357 HD2 TYR 44 HD1 TYR 44 26.725 17.472 19.314 358 HE1 TYR 44 HE2 TYR 44 30.176 15.862 22.504 359 HE2 TYR 44 HE1 TYR 44 29.106 17.267 18.572 360 HH TYR 44 HH TYR 44 31.705 16.177 20.767 361 H VAL 45 H VAL 45 24.187 20.336 21.561 362 HA VAL 45 HA VAL 45 21.479 19.764 22.412 363 HB VAL 45 HB VAL 45 20.911 22.022 21.563 364 HG11 VAL 45 HG11 VAL 45 21.741 21.585 23.879 365 HG12 VAL 45 HG12 VAL 45 23.400 21.893 23.334 366 HG13 VAL 45 HG13 VAL 45 22.191 23.192 23.286 367 HG21 VAL 45 HG21 VAL 45 23.846 22.212 20.794 368 HG22 VAL 45 HG22 VAL 45 22.413 22.355 19.732 369 HG23 VAL 45 HG23 VAL 45 22.729 23.571 20.963 370 H ASP 46 H ASP 46 22.976 18.916 19.509 371 HA ASP 46 HA ASP 46 20.548 18.828 17.892 372 HB2 ASP 46 HB2 ASP 46 22.885 18.773 16.969 373 HB3 ASP 46 HB3 ASP 46 23.083 17.166 17.656 374 H LYS 47 H LYS 47 21.673 16.911 20.601 375 HA LYS 47 HA LYS 47 20.522 14.368 19.754 376 HB2 LYS 47 HB2 LYS 47 21.697 15.243 22.397 377 HB3 LYS 47 HB3 LYS 47 21.168 13.623 21.999 378 HG2 LYS 47 HG2 LYS 47 22.772 13.994 19.852 379 HG3 LYS 47 HG3 LYS 47 23.552 15.098 20.990 380 HD2 LYS 47 HD2 LYS 47 23.505 13.150 22.672 381 HD3 LYS 47 HD3 LYS 47 22.951 12.154 21.308 382 HE2 LYS 47 HE2 LYS 47 25.090 12.800 20.089 383 HE3 LYS 47 HE3 LYS 47 25.621 13.613 21.568 384 HZ1 LYS 47 HZ1 LYS 47 25.068 10.703 21.277 385 HZ2 LYS 47 HZ2 LYS 47 26.530 11.399 21.544 386 HZ3 LYS 47 HZ3 LYS 47 25.381 11.411 22.708 387 H MET 48 H MET 48 18.952 17.079 21.197 388 HA MET 48 HA MET 48 16.562 15.447 21.743 389 HB2 MET 48 HB2 MET 48 16.264 16.153 24.016 390 HB3 MET 48 HB3 MET 48 17.833 15.366 23.879 391 HG2 MET 48 HG2 MET 48 18.944 17.571 23.888 392 HG3 MET 48 HG3 MET 48 17.367 18.377 23.913 393 HE1 MET 48 HE1 MET 48 18.500 19.283 27.450 394 HE2 MET 48 HE2 MET 48 19.312 19.366 25.870 395 HE3 MET 48 HE3 MET 48 17.602 19.822 26.013 396 H SER 49 H SER 49 14.600 16.684 22.149 397 HA SER 49 HA SER 49 14.264 18.699 20.230 398 HB2 SER 49 HB2 SER 49 12.437 18.069 22.567 399 HB3 SER 49 HB3 SER 49 11.987 18.923 21.083 400 HG SER 49 HG SER 49 11.550 16.584 21.207 401 H GLU 50 H GLU 50 14.496 19.265 23.830 402 HA GLU 50 HA GLU 50 14.002 22.046 23.561 403 HB2 GLU 50 HB2 GLU 50 14.357 20.388 25.739 404 HB3 GLU 50 HB3 GLU 50 15.871 21.305 25.761 405 HG2 GLU 50 HG2 GLU 50 14.395 22.547 27.106 406 HG3 GLU 50 HG3 GLU 50 14.422 23.434 25.585 407 H GLY 51 H GLY 51 16.814 20.431 22.535 408 HA2 GLY 51 HA2 GLY 51 18.940 22.136 23.091 409 HA3 GLY 51 HA3 GLY 51 18.752 21.164 21.640 410 H GLU 52 H GLU 52 16.346 22.729 20.706 411 HA GLU 52 HA GLU 52 17.752 24.859 19.291 412 HB2 GLU 52 HB2 GLU 52 14.847 24.002 19.528 413 HB3 GLU 52 HB3 GLU 52 15.310 25.466 18.655 414 HG2 GLU 52 HG2 GLU 52 16.411 22.708 18.027 415 HG3 GLU 52 HG3 GLU 52 15.045 23.461 17.193 416 H GLN 53 H GLN 53 15.738 24.799 22.212 417 HA GLN 53 HA GLN 53 15.571 27.708 22.446 418 HB2 GLN 53 HB2 GLN 53 13.880 26.136 23.219 419 HB3 GLN 53 HB3 GLN 53 14.987 25.459 24.414 420 HG2 GLN 53 HG2 GLN 53 14.979 27.473 25.702 421 HG3 GLN 53 HG3 GLN 53 14.209 28.397 24.412 422 HE21 GLN 53 HE21 GLN 53 13.412 27.312 27.392 423 HE22 GLN 53 HE22 GLN 53 11.768 26.742 27.047 424 H LEU 54 H LEU 54 17.601 25.102 23.812 425 HA LEU 54 HA LEU 54 19.273 26.787 25.449 426 HB2 LEU 54 HB2 LEU 54 19.831 24.137 24.063 427 HB3 LEU 54 HB3 LEU 54 20.925 24.884 25.173 428 HG LEU 54 HG LEU 54 20.010 23.951 26.926 429 HD11 LEU 54 HD11 LEU 54 17.142 24.519 26.131 430 HD12 LEU 54 HD12 LEU 54 17.771 24.041 27.723 431 HD13 LEU 54 HD13 LEU 54 18.156 25.630 27.085 432 HD21 LEU 54 HD21 LEU 54 18.142 22.464 25.148 433 HD22 LEU 54 HD22 LEU 54 19.869 22.085 25.403 434 HD23 LEU 54 HD23 LEU 54 18.732 22.011 26.756 435 H ARG 55 H ARG 55 19.588 25.772 21.980 436 HA ARG 55 HA ARG 55 22.016 27.159 21.420 437 HB2 ARG 55 HB2 ARG 55 21.160 25.188 20.301 438 HB3 ARG 55 HB3 ARG 55 19.662 26.011 19.864 439 HG2 ARG 55 HG2 ARG 55 20.686 27.329 18.296 440 HG3 ARG 55 HG3 ARG 55 22.347 26.845 18.766 441 HD2 ARG 55 HD2 ARG 55 21.816 24.489 18.153 442 HD3 ARG 55 HD3 ARG 55 20.201 24.947 17.668 443 HE ARG 55 HE ARG 55 22.761 25.798 16.310 444 HH11 ARG 55 HH12 ARG 55 19.324 24.965 15.786 445 HH12 ARG 55 HH11 ARG 55 19.554 25.227 14.067 446 HH21 ARG 55 HH22 ARG 55 22.827 26.102 14.218 447 HH22 ARG 55 HH21 ARG 55 21.359 26.043 13.248 448 H GLY 56 H GLY 56 18.604 28.146 21.386 449 HA2 GLY 56 HA2 GLY 56 18.906 30.696 20.128 450 HA3 GLY 56 HA3 GLY 56 17.608 30.200 21.224 451 H GLU 57 H GLU 57 19.160 29.750 23.622 452 HA GLU 57 HA GLU 57 19.420 32.367 24.697 453 HB2 GLU 57 HB2 GLU 57 20.254 29.621 25.541 454 HB3 GLU 57 HB3 GLU 57 21.073 30.949 26.339 455 HG2 GLU 57 HG2 GLU 57 18.048 30.587 26.316 456 HG3 GLU 57 HG3 GLU 57 19.200 30.101 27.531 457 H ILE 58 H ILE 58 21.877 30.210 23.330 458 HA ILE 58 HA ILE 58 24.154 31.892 23.860 459 HB ILE 58 HB ILE 58 23.871 29.721 21.745 460 HG12 ILE 58 HG12 ILE 58 24.864 29.401 24.620 461 HG13 ILE 58 HG13 ILE 58 23.269 28.910 24.069 462 HG21 ILE 58 HG21 ILE 58 26.388 30.665 23.203 463 HG22 ILE 58 HG22 ILE 58 26.279 29.543 21.827 464 HG23 ILE 58 HG23 ILE 58 25.915 31.241 21.595 465 HD11 ILE 58 HD11 ILE 58 24.317 27.351 22.421 466 HD12 ILE 58 HD12 ILE 58 25.893 27.712 23.168 467 HD13 ILE 58 HD13 ILE 58 24.609 26.961 24.127 468 H TYR 59 H TYR 59 22.061 31.442 20.932 469 HA TYR 59 HA TYR 59 23.528 33.333 19.389 470 HB2 TYR 59 HB2 TYR 59 21.725 31.574 18.668 471 HB3 TYR 59 HB3 TYR 59 20.583 32.891 18.914 472 HD1 TYR 59 HD2 TYR 59 20.896 35.060 17.527 473 HD2 TYR 59 HD1 TYR 59 23.261 31.526 16.892 474 HE1 TYR 59 HE2 TYR 59 21.688 35.965 15.328 475 HE2 TYR 59 HE1 TYR 59 24.064 32.416 14.723 476 HH TYR 59 HH TYR 59 23.974 34.177 13.246 477 H GLN 60 H GLN 60 20.627 33.813 21.463 478 HA GLN 60 HA GLN 60 20.178 36.518 20.780 479 HB2 GLN 60 HB2 GLN 60 19.612 34.870 23.278 480 HB3 GLN 60 HB3 GLN 60 19.108 36.555 23.158 481 HG2 GLN 60 HG2 GLN 60 18.315 34.472 21.072 482 HG3 GLN 60 HG3 GLN 60 17.360 34.814 22.515 483 HE21 GLN 60 HE21 GLN 60 16.425 36.956 22.771 484 HE22 GLN 60 HE22 GLN 60 16.230 38.002 21.346 485 H ALA 61 H ALA 61 22.376 35.208 23.282 486 HA ALA 61 HA ALA 61 23.223 37.901 24.088 487 HB1 ALA 61 HB1 ALA 61 24.685 36.631 25.640 488 HB2 ALA 61 HB2 ALA 61 22.978 36.161 25.756 489 HB3 ALA 61 HB3 ALA 61 24.126 35.115 24.896 490 H TYR 62 H TYR 62 24.739 35.208 22.195 491 HA TYR 62 HA TYR 62 27.160 36.927 21.868 492 HB2 TYR 62 HB2 TYR 62 27.062 33.913 21.786 493 HB3 TYR 62 HB3 TYR 62 28.469 34.956 21.934 494 HD1 TYR 62 HD1 TYR 62 28.503 36.556 24.073 495 HD2 TYR 62 HD2 TYR 62 26.137 32.978 23.716 496 HE1 TYR 62 HE1 TYR 62 28.206 36.505 26.546 497 HE2 TYR 62 HE2 TYR 62 25.828 32.931 26.196 498 HH TYR 62 HH TYR 62 27.246 35.439 28.305 499 H LYS 63 H LYS 63 24.616 35.932 19.998 500 HA LYS 63 HA LYS 63 24.194 35.497 17.854 501 HB2 LYS 63 HB2 LYS 63 26.536 37.346 17.287 502 HB3 LYS 63 HB3 LYS 63 25.226 36.965 16.174 503 HG2 LYS 63 HG2 LYS 63 24.890 38.414 18.828 504 HG3 LYS 63 HG3 LYS 63 25.000 39.178 17.244 505 HD2 LYS 63 HD2 LYS 63 22.952 38.055 16.502 506 HD3 LYS 63 HD3 LYS 63 22.780 37.249 18.052 507 HE2 LYS 63 HE2 LYS 63 22.746 40.260 17.609 508 HE3 LYS 63 HE3 LYS 63 21.322 39.242 17.821 509 HZ1 LYS 63 HZ1 LYS 63 22.106 38.709 20.072 510 HZ2 LYS 63 HZ2 LYS 63 23.438 39.684 19.860 511 HZ3 LYS 63 HZ3 LYS 63 21.953 40.327 19.877 512 H HIS 64 H HIS 64 25.815 33.534 19.037 513 HA HIS 64 HA HIS 64 26.800 32.197 16.563 514 HB2 HIS 64 HB2 HIS 64 27.991 31.966 19.361 515 HB3 HIS 64 HB3 HIS 64 28.362 30.898 18.017 516 HD1 HIS 64 HD1 HIS 64 28.959 34.584 19.055 517 HD2 HIS 64 HD2 HIS 64 30.246 31.649 16.330 518 HE1 HIS 64 HE1 HIS 64 31.162 35.416 18.099 519 H GLU 65 H GLU 65 26.050 30.084 16.364 520 HA GLU 65 HA GLU 65 24.153 29.112 18.490 521 HB2 GLU 65 HB2 GLU 65 23.176 27.698 16.697 522 HB3 GLU 65 HB3 GLU 65 22.870 29.408 16.609 523 HG2 GLU 65 HG2 GLU 65 23.194 28.658 14.399 524 HG3 GLU 65 HG3 GLU 65 24.601 29.625 14.809 525 H THR 66 H THR 66 26.955 28.190 16.566 526 HA THR 66 HA THR 66 27.899 26.667 18.820 527 HB THR 66 HB THR 66 26.412 24.984 17.534 528 HG1 THR 66 HG1 THR 66 27.647 24.292 19.108 529 HG21 THR 66 HG21 THR 66 27.435 23.725 15.787 530 HG22 THR 66 HG22 THR 66 28.920 24.680 15.855 531 HG23 THR 66 HG23 THR 66 27.408 25.411 15.256 532 H VAL 67 H VAL 67 30.057 25.869 18.473 533 HA VAL 67 HA VAL 67 31.702 26.869 16.364 534 HB VAL 67 HB VAL 67 32.998 28.012 18.701 535 HG11 VAL 67 HG11 VAL 67 33.603 28.396 16.352 536 HG12 VAL 67 HG12 VAL 67 32.075 29.270 16.104 537 HG13 VAL 67 HG13 VAL 67 33.299 29.906 17.224 538 HG21 VAL 67 HG21 VAL 67 30.728 28.630 19.522 539 HG22 VAL 67 HG22 VAL 67 31.723 30.015 19.069 540 HG23 VAL 67 HG23 VAL 67 30.435 29.476 17.982 541 HA PRO 68 HA PRO 68 30.355 24.760 19.480 542 HB2 PRO 68 HB2 PRO 68 31.259 23.681 21.770 543 HB3 PRO 68 HB3 PRO 68 31.096 22.723 20.274 544 HG2 PRO 68 HG2 PRO 68 33.606 24.085 21.324 545 HG3 PRO 68 HG3 PRO 68 33.399 22.365 20.858 546 HD2 PRO 68 HD2 PRO 68 34.398 24.139 19.099 547 HD3 PRO 68 HD3 PRO 68 33.201 22.933 18.543 548 H ALA 69 H ALA 69 29.578 25.659 21.557 549 HA ALA 69 HA ALA 69 30.889 28.287 22.101 550 HB1 ALA 69 HB1 ALA 69 28.146 27.178 22.803 551 HB2 ALA 69 HB2 ALA 69 28.722 28.803 23.210 552 HB3 ALA 69 HB3 ALA 69 28.516 28.337 21.508 553 H ILE 70 H ILE 70 32.073 28.593 23.914 554 HA ILE 70 HA ILE 70 32.212 26.340 25.878 555 HB ILE 70 HB ILE 70 34.374 28.150 24.746 556 HG12 ILE 70 HG12 ILE 70 34.381 25.137 24.455 557 HG13 ILE 70 HG13 ILE 70 33.410 26.086 23.344 558 HG21 ILE 70 HG21 ILE 70 34.580 25.928 26.825 559 HG22 ILE 70 HG22 ILE 70 35.968 26.688 26.020 560 HG23 ILE 70 HG23 ILE 70 34.928 27.655 27.060 561 HD11 ILE 70 HD11 ILE 70 35.621 25.645 22.400 562 HD12 ILE 70 HD12 ILE 70 35.347 27.384 22.621 563 HD13 ILE 70 HD13 ILE 70 36.391 26.499 23.752 564 H PHE 71 H PHE 71 32.071 26.814 28.004 565 HA PHE 71 HA PHE 71 32.145 29.674 28.822 566 HB2 PHE 71 HB2 PHE 71 30.178 27.514 29.621 567 HB3 PHE 71 HB3 PHE 71 30.339 29.061 30.430 568 HD1 PHE 71 HD1 PHE 71 29.469 27.470 27.158 569 HD2 PHE 71 HD2 PHE 71 29.273 31.037 29.576 570 HE1 PHE 71 HE1 PHE 71 27.882 28.495 25.537 571 HE2 PHE 71 HE2 PHE 71 27.651 32.025 27.983 572 HZ PHE 71 HZ PHE 71 26.961 30.747 25.955 573 H ILE 72 H ILE 72 33.242 30.160 30.651 574 HA ILE 72 HA ILE 72 34.210 27.941 32.415 575 HB ILE 72 HB ILE 72 35.869 30.320 31.490 576 HG12 ILE 72 HG12 ILE 72 35.847 27.371 30.739 577 HG13 ILE 72 HG13 ILE 72 35.770 28.768 29.680 578 HG21 ILE 72 HG21 ILE 72 36.332 29.678 33.851 579 HG22 ILE 72 HG22 ILE 72 36.548 27.984 33.358 580 HG23 ILE 72 HG23 ILE 72 37.676 29.251 32.821 581 HD11 ILE 72 HD11 ILE 72 38.169 29.278 30.273 582 HD12 ILE 72 HD12 ILE 72 38.223 27.736 31.171 583 HD13 ILE 72 HD13 ILE 72 37.917 27.737 29.429 584 H ASN 73 H ASN 73 33.549 28.202 34.418 585 HA ASN 73 HA ASN 73 32.309 29.034 36.113 586 HB2 ASN 73 HB2 ASN 73 34.286 31.324 35.857 587 HB3 ASN 73 HB3 ASN 73 33.217 31.087 37.231 588 HD21 ASN 73 HD21 ASN 73 36.016 31.254 37.285 589 HD22 ASN 73 HD22 ASN 73 36.642 29.742 37.936 590 H GLY 74 H GLY 74 30.959 29.389 33.701 591 HA2 GLY 74 HA2 GLY 74 28.950 30.499 33.068 592 HA3 GLY 74 HA3 GLY 74 29.231 31.677 34.321 593 H ASN 75 H ASN 75 32.076 31.872 32.651 594 HA ASN 75 HA ASN 75 31.203 34.255 31.128 595 HB2 ASN 75 HB2 ASN 75 33.986 33.153 31.737 596 HB3 ASN 75 HB3 ASN 75 33.651 34.722 31.083 597 HD21 ASN 75 HD21 ASN 75 33.831 32.860 33.952 598 HD22 ASN 75 HD22 ASN 75 33.563 34.232 35.034 599 H PHE 76 H PHE 76 31.311 34.447 28.849 600 HA PHE 76 HA PHE 76 31.513 31.918 27.395 601 HB2 PHE 76 HB2 PHE 76 29.633 33.320 26.955 602 HB3 PHE 76 HB3 PHE 76 30.656 34.711 26.626 603 HD1 PHE 76 HD2 PHE 76 30.011 31.217 25.352 604 HD2 PHE 76 HD1 PHE 76 31.256 35.235 24.416 605 HE1 PHE 76 HE2 PHE 76 30.117 30.635 22.939 606 HE2 PHE 76 HE1 PHE 76 31.360 34.648 22.011 607 HZ PHE 76 HZ PHE 76 30.781 32.348 21.264 608 H ILE 77 H ILE 77 32.885 31.243 25.960 609 HA ILE 77 HA ILE 77 34.953 32.958 24.694 610 HB ILE 77 HB ILE 77 35.364 30.139 25.780 611 HG12 ILE 77 HG12 ILE 77 36.647 32.741 26.725 612 HG13 ILE 77 HG13 ILE 77 35.384 31.861 27.583 613 HG21 ILE 77 HG21 ILE 77 37.366 31.974 24.382 614 HG22 ILE 77 HG22 ILE 77 37.697 30.349 25.008 615 HG23 ILE 77 HG23 ILE 77 36.611 30.538 23.652 616 HD11 ILE 77 HD11 ILE 77 37.436 31.322 28.642 617 HD12 ILE 77 HD12 ILE 77 36.902 29.877 27.757 618 HD13 ILE 77 HD13 ILE 77 38.216 30.891 27.116 619 H GLY 78 H GLY 78 35.062 32.608 22.441 620 HA2 GLY 78 HA2 GLY 78 33.766 30.102 21.374 621 HA3 GLY 78 HA3 GLY 78 33.464 31.661 20.634 622 H GLY 79 H GLY 79 35.260 28.943 20.507 623 HA2 GLY 79 HA2 GLY 79 36.161 28.591 18.197 624 HA3 GLY 79 HA3 GLY 79 37.183 29.996 18.474 625 H CYS 80 H CYS 80 37.678 26.928 18.089 626 HA CYS 80 HA CYS 80 38.959 25.977 20.479 627 HB2 CYS 80 HB2 CYS 80 39.412 25.276 17.540 628 HB3 CYS 80 HB3 CYS 80 40.129 24.404 18.910 629 HG CYS 80 HG CYS 80 36.939 24.937 18.216 630 H SER 81 H SER 81 40.306 27.741 17.669 631 HA SER 81 HA SER 81 42.993 28.001 18.633 632 HB2 SER 81 HB2 SER 81 43.117 29.943 17.114 633 HB3 SER 81 HB3 SER 81 42.351 28.557 16.328 634 HG SER 81 HG SER 81 40.359 29.501 16.586 635 H ASP 82 H ASP 82 40.053 29.720 19.425 636 HA ASP 82 HA ASP 82 41.229 31.989 20.759 637 HB2 ASP 82 HB2 ASP 82 38.777 31.306 19.628 638 HB3 ASP 82 HB3 ASP 82 38.381 31.272 21.330 639 H LEU 83 H LEU 83 39.854 28.909 21.851 640 HA LEU 83 HA LEU 83 40.209 29.334 24.686 641 HB2 LEU 83 HB2 LEU 83 38.614 27.706 23.777 642 HB3 LEU 83 HB3 LEU 83 39.902 26.876 22.910 643 HG LEU 83 HG LEU 83 40.941 26.233 25.106 644 HD11 LEU 83 HD11 LEU 83 38.351 27.380 26.242 645 HD12 LEU 83 HD12 LEU 83 39.485 26.343 27.133 646 HD13 LEU 83 HD13 LEU 83 40.001 27.944 26.585 647 HD21 LEU 83 HD21 LEU 83 39.450 24.726 23.818 648 HD22 LEU 83 HD22 LEU 83 39.412 24.444 25.559 649 HD23 LEU 83 HD23 LEU 83 38.070 25.309 24.777 650 H GLU 84 H GLU 84 42.200 27.632 22.185 651 HA GLU 84 HA GLU 84 44.296 26.920 24.041 652 HB2 GLU 84 HB2 GLU 84 44.339 27.221 21.005 653 HB3 GLU 84 HB3 GLU 84 45.700 26.659 21.987 654 HG2 GLU 84 HG2 GLU 84 44.177 24.850 22.909 655 HG3 GLU 84 HG3 GLU 84 43.026 25.265 21.641 656 H ALA 85 H ALA 85 43.734 29.877 22.108 657 HA ALA 85 HA ALA 85 46.297 30.978 22.413 658 HB1 ALA 85 HB1 ALA 85 45.087 33.185 22.040 659 HB2 ALA 85 HB2 ALA 85 44.663 31.931 20.873 660 HB3 ALA 85 HB3 ALA 85 43.547 32.317 22.201 661 H LEU 86 H LEU 86 43.565 31.042 24.700 662 HA LEU 86 HA LEU 86 44.857 32.762 26.678 663 HB2 LEU 86 HB2 LEU 86 42.508 30.809 26.704 664 HB3 LEU 86 HB3 LEU 86 43.028 31.628 28.169 665 HG LEU 86 HG LEU 86 42.293 33.204 25.673 666 HD11 LEU 86 HD11 LEU 86 40.050 33.495 26.656 667 HD12 LEU 86 HD12 LEU 86 40.365 31.807 26.238 668 HD13 LEU 86 HD13 LEU 86 40.451 32.329 27.939 669 HD21 LEU 86 HD21 LEU 86 41.860 34.983 27.337 670 HD22 LEU 86 HD22 LEU 86 42.304 33.884 28.658 671 HD23 LEU 86 HD23 LEU 86 43.526 34.405 27.475 672 H ASP 87 H ASP 87 44.868 29.298 26.008 673 HA ASP 87 HA ASP 87 46.112 28.478 28.488 674 HB2 ASP 87 HB2 ASP 87 44.764 27.062 26.815 675 HB3 ASP 87 HB3 ASP 87 46.243 26.988 25.866 676 H LYS 88 H LYS 88 47.401 29.132 25.234 677 HA LYS 88 HA LYS 88 50.200 28.929 25.889 678 HB2 LYS 88 HB2 LYS 88 48.609 30.252 23.659 679 HB3 LYS 88 HB3 LYS 88 50.339 30.514 23.803 680 HG2 LYS 88 HG2 LYS 88 50.051 28.793 22.233 681 HG3 LYS 88 HG3 LYS 88 50.758 28.076 23.679 682 HD2 LYS 88 HD2 LYS 88 48.574 27.080 24.287 683 HD3 LYS 88 HD3 LYS 88 47.818 27.911 22.899 684 HE2 LYS 88 HE2 LYS 88 49.093 26.743 21.295 685 HE3 LYS 88 HE3 LYS 88 50.161 26.056 22.531 686 HZ1 LYS 88 HZ1 LYS 88 47.976 24.968 23.377 687 HZ2 LYS 88 HZ2 LYS 88 47.415 25.174 21.856 688 HZ3 LYS 88 HZ3 LYS 88 48.764 24.311 22.112 689 H GLU 89 H GLU 89 47.953 31.600 26.268 690 HA GLU 89 HA GLU 89 50.064 33.489 27.090 691 HB2 GLU 89 HB2 GLU 89 47.044 33.686 26.927 692 HB3 GLU 89 HB3 GLU 89 48.089 34.978 27.547 693 HG2 GLU 89 HG2 GLU 89 49.203 35.305 25.534 694 HG3 GLU 89 HG3 GLU 89 48.574 33.835 24.818 695 H GLY 90 H GLY 90 49.064 30.859 28.707 696 HA2 GLY 90 HA2 GLY 90 49.513 30.285 30.885 697 HA3 GLY 90 HA3 GLY 90 50.179 31.899 31.121 698 H LYS 91 H LYS 91 46.858 31.952 30.125 699 HA LYS 91 HA LYS 91 45.993 32.731 32.881 700 HB2 LYS 91 HB2 LYS 91 45.264 33.479 30.034 701 HB3 LYS 91 HB3 LYS 91 44.174 33.815 31.361 702 HG2 LYS 91 HG2 LYS 91 45.762 35.216 32.504 703 HG3 LYS 91 HG3 LYS 91 47.071 34.747 31.419 704 HD2 LYS 91 HD2 LYS 91 44.608 36.338 30.559 705 HD3 LYS 91 HD3 LYS 91 46.196 37.023 30.960 706 HE2 LYS 91 HE2 LYS 91 47.214 35.536 29.209 707 HE3 LYS 91 HE3 LYS 91 45.582 35.065 28.704 708 HZ1 LYS 91 HZ1 LYS 91 45.178 37.483 28.283 709 HZ2 LYS 91 HZ2 LYS 91 46.780 37.762 28.576 710 HZ3 LYS 91 HZ3 LYS 91 46.323 36.815 27.304 711 H LEU 92 H LEU 92 45.474 30.202 30.542 712 HA LEU 92 HA LEU 92 42.795 29.575 31.600 713 HB2 LEU 92 HB2 LEU 92 43.640 29.151 29.199 714 HB3 LEU 92 HB3 LEU 92 44.576 27.822 29.881 715 HG LEU 92 HG LEU 92 42.503 26.747 30.681 716 HD11 LEU 92 HD11 LEU 92 41.093 29.053 29.277 717 HD12 LEU 92 HD12 LEU 92 40.310 27.535 29.758 718 HD13 LEU 92 HD13 LEU 92 40.968 28.597 30.997 719 HD21 LEU 92 HD21 LEU 92 42.448 27.487 27.726 720 HD22 LEU 92 HD22 LEU 92 43.343 26.143 28.450 721 HD23 LEU 92 HD23 LEU 92 41.576 26.125 28.449 722 H ASP 93 H ASP 93 46.101 28.575 32.210 723 HA ASP 93 HA ASP 93 45.548 26.606 34.232 724 HB2 ASP 93 HB2 ASP 93 47.756 28.685 33.849 725 HB3 ASP 93 HB3 ASP 93 47.737 27.537 35.176 726 H GLY 94 H GLY 94 45.758 30.203 34.384 727 HA2 GLY 94 HA2 GLY 94 45.331 30.483 37.193 728 HA3 GLY 94 HA3 GLY 94 45.011 31.710 35.956 729 H LEU 95 H LEU 95 43.024 30.329 34.463 730 HA LEU 95 HA LEU 95 40.660 30.804 35.997 731 HB2 LEU 95 HB2 LEU 95 41.231 29.525 33.312 732 HB3 LEU 95 HB3 LEU 95 39.600 29.604 33.953 733 HG LEU 95 HG LEU 95 41.328 32.090 33.609 734 HD11 LEU 95 HD11 LEU 95 40.015 32.524 31.567 735 HD12 LEU 95 HD12 LEU 95 40.980 31.052 31.412 736 HD13 LEU 95 HD13 LEU 95 39.229 30.940 31.725 737 HD21 LEU 95 HD21 LEU 95 38.320 31.715 33.977 738 HD22 LEU 95 HD22 LEU 95 39.444 32.396 35.172 739 HD23 LEU 95 HD23 LEU 95 39.141 33.257 33.669 740 H LEU 96 H LEU 96 42.489 27.802 35.589 741 HA LEU 96 HA LEU 96 40.442 26.124 36.798 742 HB2 LEU 96 HB2 LEU 96 43.447 25.714 36.616 743 HB3 LEU 96 HB3 LEU 96 42.313 24.477 37.145 744 HG LEU 96 HG LEU 96 42.418 25.634 34.347 745 HD11 LEU 96 HD11 LEU 96 43.189 23.304 33.872 746 HD12 LEU 96 HD12 LEU 96 44.230 24.053 35.084 747 HD13 LEU 96 HD13 LEU 96 42.995 22.883 35.573 748 HD21 LEU 96 HD21 LEU 96 40.092 25.130 34.893 749 HD22 LEU 96 HD22 LEU 96 40.760 23.897 33.835 750 HD23 LEU 96 HD23 LEU 96 40.568 23.550 35.564 751 H SER 97 H SER 97 41.856 28.681 38.290 752 HA SER 97 HA SER 97 42.565 27.983 40.895 753 HB2 SER 97 HB2 SER 97 40.788 30.258 39.915 754 HB3 SER 97 HB3 SER 97 41.348 30.110 41.585 755 HG SER 97 HG SER 97 42.869 30.404 39.206 Start of MODEL 19 1 H1 GLY 1 H1 GLY 1 5.900 33.590 31.955 2 H2 GLY 1 H2 GLY 1 4.326 33.235 32.244 3 H3 GLY 1 H3 GLY 1 5.085 32.599 30.932 4 HA2 GLY 1 HA2 GLY 1 5.785 32.012 33.737 5 HA3 GLY 1 HA3 GLY 1 4.803 30.958 32.713 6 H ALA 2 H ALA 2 7.998 32.549 32.882 7 HA ALA 2 HA ALA 2 9.249 30.689 31.019 8 HB1 ALA 2 HB1 ALA 2 10.398 32.812 32.876 9 HB2 ALA 2 HB2 ALA 2 11.261 32.002 31.551 10 HB3 ALA 2 HB3 ALA 2 9.887 33.058 31.190 11 H MET 3 H MET 3 11.261 29.563 31.590 12 HA MET 3 HA MET 3 11.415 28.437 34.333 13 HB2 MET 3 HB2 MET 3 11.390 26.876 31.724 14 HB3 MET 3 HB3 MET 3 12.058 26.235 33.227 15 HG2 MET 3 HG2 MET 3 9.867 26.650 34.354 16 HG3 MET 3 HG3 MET 3 9.182 27.111 32.792 17 HE1 MET 3 HE1 MET 3 7.650 23.565 33.792 18 HE2 MET 3 HE2 MET 3 8.213 24.808 34.928 19 HE3 MET 3 HE3 MET 3 7.285 25.278 33.487 20 HA PRO 4 HA PRO 4 15.791 29.228 33.907 21 HB2 PRO 4 HB2 PRO 4 16.228 26.583 35.292 22 HB3 PRO 4 HB3 PRO 4 16.927 28.185 35.665 23 HG2 PRO 4 HG2 PRO 4 14.906 27.203 37.172 24 HG3 PRO 4 HG3 PRO 4 14.874 28.924 36.661 25 HD2 PRO 4 HD2 PRO 4 13.450 26.564 35.382 26 HD3 PRO 4 HD3 PRO 4 12.796 28.160 35.855 27 H SER 5 H SER 5 16.884 28.997 32.059 28 HA SER 5 HA SER 5 16.874 26.447 30.519 29 HB2 SER 5 HB2 SER 5 17.687 29.277 29.826 30 HB3 SER 5 HB3 SER 5 17.855 27.898 28.730 31 HG SER 5 HG SER 5 15.975 29.194 28.433 32 H ILE 6 H ILE 6 19.257 26.798 29.145 33 HA ILE 6 HA ILE 6 21.059 25.339 30.607 34 HB ILE 6 HB ILE 6 22.700 25.872 28.824 35 HG12 ILE 6 HG12 ILE 6 20.540 27.567 27.610 36 HG13 ILE 6 HG13 ILE 6 21.921 28.262 28.439 37 HG21 ILE 6 HG21 ILE 6 21.410 24.777 27.055 38 HG22 ILE 6 HG22 ILE 6 21.304 24.007 28.637 39 HG23 ILE 6 HG23 ILE 6 19.960 24.986 28.069 40 HD11 ILE 6 HD11 ILE 6 22.096 26.555 25.922 41 HD12 ILE 6 HD12 ILE 6 22.115 28.322 25.991 42 HD13 ILE 6 HD13 ILE 6 23.422 27.432 26.740 43 H ALA 7 H ALA 7 20.859 28.851 30.677 44 HA ALA 7 HA ALA 7 23.306 29.682 31.660 45 HB1 ALA 7 HB1 ALA 7 20.491 30.430 32.584 46 HB2 ALA 7 HB2 ALA 7 21.957 31.405 32.849 47 HB3 ALA 7 HB3 ALA 7 21.361 31.119 31.208 48 H SER 8 H SER 8 20.802 27.909 33.532 49 HA SER 8 HA SER 8 22.106 28.096 36.118 50 HB2 SER 8 HB2 SER 8 19.702 27.612 35.756 51 HB3 SER 8 HB3 SER 8 20.120 26.063 35.007 52 HG SER 8 HG SER 8 19.538 26.182 37.357 53 H MET 9 H MET 9 22.496 25.832 33.406 54 HA MET 9 HA MET 9 23.981 23.820 34.865 55 HB2 MET 9 HB2 MET 9 24.125 24.441 31.886 56 HB3 MET 9 HB3 MET 9 24.578 22.947 32.692 57 HG2 MET 9 HG2 MET 9 22.197 22.590 33.346 58 HG3 MET 9 HG3 MET 9 21.762 24.070 32.480 59 HE1 MET 9 HE1 MET 9 20.066 23.161 30.851 60 HE2 MET 9 HE2 MET 9 20.217 21.613 29.996 61 HE3 MET 9 HE3 MET 9 20.137 21.639 31.774 62 H ILE 10 H ILE 10 24.913 26.833 33.220 63 HA ILE 10 HA ILE 10 27.677 26.323 32.918 64 HB ILE 10 HB ILE 10 26.650 29.103 33.522 65 HG12 ILE 10 HG12 ILE 10 25.036 28.214 31.918 66 HG13 ILE 10 HG13 ILE 10 26.048 29.444 31.201 67 HG21 ILE 10 HG21 ILE 10 29.041 28.897 33.234 68 HG22 ILE 10 HG22 ILE 10 28.850 27.971 31.747 69 HG23 ILE 10 HG23 ILE 10 28.367 29.683 31.797 70 HD11 ILE 10 HD11 ILE 10 26.365 26.441 30.771 71 HD12 ILE 10 HD12 ILE 10 25.640 27.600 29.641 72 HD13 ILE 10 HD13 ILE 10 27.367 27.706 30.016 73 H LYS 11 H LYS 11 25.898 27.141 35.802 74 HA LYS 11 HA LYS 11 28.291 27.998 37.308 75 HB2 LYS 11 HB2 LYS 11 25.332 27.721 38.021 76 HB3 LYS 11 HB3 LYS 11 26.583 28.146 39.182 77 HG2 LYS 11 HG2 LYS 11 25.900 30.201 38.669 78 HG3 LYS 11 HG3 LYS 11 27.188 30.072 37.482 79 HD2 LYS 11 HD2 LYS 11 25.620 29.785 35.685 80 HD3 LYS 11 HD3 LYS 11 24.290 29.392 36.802 81 HE2 LYS 11 HE2 LYS 11 24.433 31.665 37.766 82 HE3 LYS 11 HE3 LYS 11 25.686 32.096 36.592 83 HZ1 LYS 11 HZ1 LYS 11 24.073 31.852 34.839 84 HZ2 LYS 11 HZ2 LYS 11 22.942 31.227 35.883 85 HZ3 LYS 11 HZ3 LYS 11 23.384 32.783 36.030 86 H GLY 12 H GLY 12 27.149 24.948 36.503 87 HA2 GLY 12 HA2 GLY 12 27.588 23.683 39.102 88 HA3 GLY 12 HA3 GLY 12 27.176 22.897 37.585 89 H ASN 13 H ASN 13 29.506 24.003 36.117 90 HA ASN 13 HA ASN 13 31.739 22.397 37.319 91 HB2 ASN 13 HB2 ASN 13 30.643 22.443 34.481 92 HB3 ASN 13 HB3 ASN 13 32.296 21.957 34.809 93 HD21 ASN 13 HD21 ASN 13 32.663 20.155 36.379 94 HD22 ASN 13 HD22 ASN 13 31.450 18.885 36.377 95 H LYS 14 H LYS 14 33.880 22.906 36.481 96 HA LYS 14 HA LYS 14 34.504 25.738 36.526 97 HB2 LYS 14 HB2 LYS 14 35.979 23.653 37.128 98 HB3 LYS 14 HB3 LYS 14 36.271 23.546 35.395 99 HG2 LYS 14 HG2 LYS 14 38.075 24.800 35.998 100 HG3 LYS 14 HG3 LYS 14 36.938 26.098 35.623 101 HD2 LYS 14 HD2 LYS 14 37.858 26.762 37.670 102 HD3 LYS 14 HD3 LYS 14 36.327 26.016 38.152 103 HE2 LYS 14 HE2 LYS 14 37.590 23.872 38.622 104 HE3 LYS 14 HE3 LYS 14 39.097 24.718 38.224 105 HZ1 LYS 14 HZ1 LYS 14 38.741 24.733 40.600 106 HZ2 LYS 14 HZ2 LYS 14 38.594 26.273 40.037 107 HZ3 LYS 14 HZ3 LYS 14 37.245 25.381 40.436 108 H VAL 15 H VAL 15 34.206 23.355 33.880 109 HA VAL 15 HA VAL 15 33.795 25.596 31.960 110 HB VAL 15 HB VAL 15 35.238 22.989 31.372 111 HG11 VAL 15 HG11 VAL 15 35.741 24.072 29.179 112 HG12 VAL 15 HG12 VAL 15 34.025 23.754 29.395 113 HG13 VAL 15 HG13 VAL 15 34.647 25.401 29.603 114 HG21 VAL 15 HG21 VAL 15 36.746 24.355 32.613 115 HG22 VAL 15 HG22 VAL 15 37.155 24.628 30.907 116 HG23 VAL 15 HG23 VAL 15 36.207 25.831 31.793 117 H VAL 16 H VAL 16 32.109 25.493 30.624 118 HA VAL 16 HA VAL 16 30.631 22.936 30.304 119 HB VAL 16 HB VAL 16 29.270 25.594 30.803 120 HG11 VAL 16 HG11 VAL 16 28.156 22.816 30.177 121 HG12 VAL 16 HG12 VAL 16 27.191 24.192 30.743 122 HG13 VAL 16 HG13 VAL 16 27.986 24.274 29.169 123 HG21 VAL 16 HG21 VAL 16 30.042 24.623 32.900 124 HG22 VAL 16 HG22 VAL 16 28.318 24.264 32.766 125 HG23 VAL 16 HG23 VAL 16 29.501 23.002 32.405 126 H VAL 17 H VAL 17 30.143 22.440 28.222 127 HA VAL 17 HA VAL 17 30.721 24.453 26.074 128 HB VAL 17 HB VAL 17 31.620 21.561 26.385 129 HG11 VAL 17 HG11 VAL 17 31.740 23.249 23.838 130 HG12 VAL 17 HG12 VAL 17 32.600 21.718 24.103 131 HG13 VAL 17 HG13 VAL 17 30.847 21.723 24.042 132 HG21 VAL 17 HG21 VAL 17 33.080 24.159 25.785 133 HG22 VAL 17 HG22 VAL 17 33.071 23.297 27.339 134 HG23 VAL 17 HG23 VAL 17 33.824 22.555 25.921 135 H PHE 18 H PHE 18 29.502 24.397 24.187 136 HA PHE 18 HA PHE 18 27.304 22.366 24.073 137 HB2 PHE 18 HB2 PHE 18 27.090 25.170 22.965 138 HB3 PHE 18 HB3 PHE 18 25.890 23.903 22.895 139 HD1 PHE 18 HD1 PHE 18 24.622 23.221 24.878 140 HD2 PHE 18 HD2 PHE 18 27.511 26.409 25.070 141 HE1 PHE 18 HE1 PHE 18 23.696 23.926 27.074 142 HE2 PHE 18 HE2 PHE 18 26.559 27.133 27.251 143 HZ PHE 18 HZ PHE 18 24.630 25.929 28.220 144 H SER 19 H SER 19 27.550 20.984 22.558 145 HA SER 19 HA SER 19 29.281 21.507 20.170 146 HB2 SER 19 HB2 SER 19 28.866 19.020 21.859 147 HB3 SER 19 HB3 SER 19 29.622 18.998 20.260 148 HG SER 19 HG SER 19 31.192 19.147 21.926 149 H TRP 20 H TRP 20 28.791 20.039 18.266 150 HA TRP 20 HA TRP 20 25.922 19.305 18.096 151 HB2 TRP 20 HB2 TRP 20 26.744 21.683 17.088 152 HB3 TRP 20 HB3 TRP 20 27.028 20.659 15.692 153 HD1 TRP 20 HD1 TRP 20 24.192 20.984 18.305 154 HE1 TRP 20 HE1 TRP 20 21.922 21.346 17.081 155 HE3 TRP 20 HE3 TRP 20 25.805 20.663 13.449 156 HZ2 TRP 20 HZ2 TRP 20 20.954 21.286 14.395 157 HZ3 TRP 20 HZ3 TRP 20 24.185 20.842 11.579 158 HH2 TRP 20 HH2 TRP 20 21.761 21.156 12.031 159 H VAL 21 H VAL 21 25.291 17.768 16.679 160 HA VAL 21 HA VAL 21 27.309 15.734 16.026 161 HB VAL 21 HB VAL 21 24.293 15.713 15.790 162 HG11 VAL 21 HG11 VAL 21 26.261 13.389 15.620 163 HG12 VAL 21 HG12 VAL 21 24.494 13.272 15.597 164 HG13 VAL 21 HG13 VAL 21 25.322 14.054 14.256 165 HG21 VAL 21 HG21 VAL 21 26.135 14.491 17.895 166 HG22 VAL 21 HG22 VAL 21 24.995 15.833 18.147 167 HG23 VAL 21 HG23 VAL 21 24.381 14.225 17.775 168 H THR 22 H THR 22 27.266 16.258 12.436 169 HA THR 22 HA THR 22 28.919 15.722 14.871 170 HB THR 22 HB THR 22 30.346 14.332 13.397 171 HG1 THR 22 HG1 THR 22 28.121 14.403 11.632 172 HG21 THR 22 HG21 THR 22 27.485 13.291 13.443 173 HG22 THR 22 HG22 THR 22 28.589 13.277 14.839 174 HG23 THR 22 HG23 THR 22 28.989 12.352 13.380 175 H CYS 23 H CYS 23 30.587 17.078 15.192 176 HA CYS 23 HA CYS 23 31.238 18.999 12.984 177 HB2 CYS 23 HB2 CYS 23 29.680 19.882 14.613 178 HB3 CYS 23 HB3 CYS 23 30.819 19.515 15.920 179 HG CYS 23 HG CYS 23 31.313 21.434 13.226 180 HA PRO 24 HA PRO 24 35.329 17.250 13.826 181 HB2 PRO 24 HB2 PRO 24 36.073 19.268 11.707 182 HB3 PRO 24 HB3 PRO 24 36.587 17.559 11.871 183 HG2 PRO 24 HG2 PRO 24 34.651 18.217 10.102 184 HG3 PRO 24 HG3 PRO 24 34.440 16.773 11.149 185 HD2 PRO 24 HD2 PRO 24 33.292 19.548 11.534 186 HD3 PRO 24 HD3 PRO 24 32.489 17.957 11.657 187 H TYR 25 H TYR 25 34.435 20.512 14.373 188 HA TYR 25 HA TYR 25 36.919 21.386 15.688 189 HB2 TYR 25 HB2 TYR 25 34.010 22.289 15.677 190 HB3 TYR 25 HB3 TYR 25 35.256 23.147 16.548 191 HD1 TYR 25 HD1 TYR 25 37.586 23.051 14.643 192 HD2 TYR 25 HD2 TYR 25 33.423 24.070 14.080 193 HE1 TYR 25 HE1 TYR 25 38.205 24.588 12.795 194 HE2 TYR 25 HE2 TYR 25 34.059 25.604 12.225 195 HH TYR 25 HH TYR 25 35.771 26.523 11.009 196 H CYS 26 H CYS 26 34.052 19.634 16.727 197 HA CYS 26 HA CYS 26 33.943 20.995 19.342 198 HB2 CYS 26 HB2 CYS 26 32.477 18.795 17.944 199 HB3 CYS 26 HB3 CYS 26 32.154 19.137 19.666 200 HG CYS 26 HG CYS 26 32.045 21.243 17.091 201 H VAL 27 H VAL 27 34.934 17.843 17.988 202 HA VAL 27 HA VAL 27 35.963 16.544 20.178 203 HB VAL 27 HB VAL 27 37.492 15.747 18.614 204 HG11 VAL 27 HG11 VAL 27 35.993 14.534 17.101 205 HG12 VAL 27 HG12 VAL 27 35.148 14.832 18.626 206 HG13 VAL 27 HG13 VAL 27 34.810 15.854 17.210 207 HG21 VAL 27 HG21 VAL 27 36.919 17.773 16.668 208 HG22 VAL 27 HG22 VAL 27 38.465 17.067 17.292 209 HG23 VAL 27 HG23 VAL 27 37.467 16.153 16.161 210 H ARG 28 H ARG 28 37.744 18.655 18.062 211 HA ARG 28 HA ARG 28 40.168 18.843 19.267 212 HB2 ARG 28 HB2 ARG 28 39.014 21.454 18.216 213 HB3 ARG 28 HB3 ARG 28 40.681 20.886 18.181 214 HG2 ARG 28 HG2 ARG 28 39.873 19.026 16.613 215 HG3 ARG 28 HG3 ARG 28 38.336 19.916 16.541 216 HD2 ARG 28 HD2 ARG 28 39.459 21.887 15.656 217 HD3 ARG 28 HD3 ARG 28 41.021 21.050 15.732 218 HE ARG 28 HE ARG 28 39.175 19.433 14.277 219 HH11 ARG 28 HH22 ARG 28 40.733 22.544 13.740 220 HH12 ARG 28 HH21 ARG 28 40.544 22.376 11.995 221 HH21 ARG 28 HH12 ARG 28 39.457 19.119 12.147 222 HH22 ARG 28 HH11 ARG 28 39.856 20.459 11.108 223 H ALA 29 H ALA 29 37.460 20.975 20.198 224 HA ALA 29 HA ALA 29 38.875 22.133 22.451 225 HB1 ALA 29 HB1 ALA 29 36.952 23.254 21.411 226 HB2 ALA 29 HB2 ALA 29 35.885 21.912 21.894 227 HB3 ALA 29 HB3 ALA 29 36.657 22.931 23.134 228 H GLU 30 H GLU 30 36.406 19.455 22.250 229 HA GLU 30 HA GLU 30 36.420 18.787 25.022 230 HB2 GLU 30 HB2 GLU 30 35.954 17.064 22.555 231 HB3 GLU 30 HB3 GLU 30 35.607 16.560 24.208 232 HG2 GLU 30 HG2 GLU 30 33.910 18.297 24.457 233 HG3 GLU 30 HG3 GLU 30 34.274 18.967 22.865 234 H LYS 31 H LYS 31 38.635 17.721 22.516 235 HA LYS 31 HA LYS 31 39.985 15.809 24.092 236 HB2 LYS 31 HB2 LYS 31 40.169 15.492 21.796 237 HB3 LYS 31 HB3 LYS 31 40.379 17.160 21.357 238 HG2 LYS 31 HG2 LYS 31 42.742 17.036 22.389 239 HG3 LYS 31 HG3 LYS 31 42.447 15.310 22.644 240 HD2 LYS 31 HD2 LYS 31 43.651 15.475 20.639 241 HD3 LYS 31 HD3 LYS 31 41.970 15.177 20.143 242 HE2 LYS 31 HE2 LYS 31 41.667 17.501 19.536 243 HE3 LYS 31 HE3 LYS 31 43.207 17.958 20.296 244 HZ1 LYS 31 HZ1 LYS 31 42.878 16.303 17.842 245 HZ2 LYS 31 HZ2 LYS 31 43.548 17.805 17.958 246 HZ3 LYS 31 HZ3 LYS 31 44.314 16.524 18.625 247 H LEU 32 H LEU 32 40.806 19.119 23.223 248 HA LEU 32 HA LEU 32 43.218 19.448 24.715 249 HB2 LEU 32 HB2 LEU 32 42.200 20.842 22.870 250 HB3 LEU 32 HB3 LEU 32 41.062 21.442 24.073 251 HG LEU 32 HG LEU 32 42.785 23.015 23.521 252 HD11 LEU 32 HD11 LEU 32 41.913 23.020 25.878 253 HD12 LEU 32 HD12 LEU 32 43.437 22.210 26.353 254 HD13 LEU 32 HD13 LEU 32 43.477 23.811 25.613 255 HD21 LEU 32 HD21 LEU 32 44.583 21.545 22.889 256 HD22 LEU 32 HD22 LEU 32 45.153 22.675 24.122 257 HD23 LEU 32 HD23 LEU 32 44.793 20.992 24.559 258 H LEU 33 H LEU 33 39.820 20.112 25.590 259 HA LEU 33 HA LEU 33 40.334 21.267 28.117 260 HB2 LEU 33 HB2 LEU 33 37.907 19.830 26.967 261 HB3 LEU 33 HB3 LEU 33 37.861 20.640 28.529 262 HG LEU 33 HG LEU 33 38.610 22.070 25.950 263 HD11 LEU 33 HD11 LEU 33 35.906 22.235 27.251 264 HD12 LEU 33 HD12 LEU 33 36.457 22.984 25.751 265 HD13 LEU 33 HD13 LEU 33 36.275 21.229 25.824 266 HD21 LEU 33 HD21 LEU 33 39.390 23.264 27.900 267 HD22 LEU 33 HD22 LEU 33 37.975 24.104 27.260 268 HD23 LEU 33 HD23 LEU 33 37.797 23.071 28.687 269 H HIS 34 H HIS 34 39.642 17.834 27.302 270 HA HIS 34 HA HIS 34 40.110 16.849 29.982 271 HB2 HIS 34 HB2 HIS 34 40.056 15.608 27.211 272 HB3 HIS 34 HB3 HIS 34 40.637 14.692 28.597 273 HD1 HIS 34 HD1 HIS 34 38.823 13.347 29.830 274 HD2 HIS 34 HD2 HIS 34 37.365 16.709 27.749 275 HE1 HIS 34 HE1 HIS 34 36.311 13.359 30.154 276 H ALA 35 H ALA 35 42.313 17.389 27.144 277 HA ALA 35 HA ALA 35 44.438 15.870 28.309 278 HB1 ALA 35 HB1 ALA 35 44.269 16.306 25.905 279 HB2 ALA 35 HB2 ALA 35 44.480 18.050 26.173 280 HB3 ALA 35 HB3 ALA 35 45.806 16.919 26.516 281 H ARG 36 H ARG 36 43.534 19.215 28.728 282 HA ARG 36 HA ARG 36 45.914 19.683 30.457 283 HB2 ARG 36 HB2 ARG 36 44.524 21.544 28.633 284 HB3 ARG 36 HB3 ARG 36 45.532 22.102 29.986 285 HG2 ARG 36 HG2 ARG 36 47.118 22.153 28.355 286 HG3 ARG 36 HG3 ARG 36 47.396 20.557 29.048 287 HD2 ARG 36 HD2 ARG 36 45.871 19.627 27.292 288 HD3 ARG 36 HD3 ARG 36 45.823 21.222 26.524 289 HE ARG 36 HE ARG 36 47.797 19.206 26.174 290 HH11 ARG 36 HH12 ARG 36 47.836 22.742 26.500 291 HH12 ARG 36 HH11 ARG 36 49.458 22.772 25.860 292 HH21 ARG 36 HH22 ARG 36 49.573 19.426 25.132 293 HH22 ARG 36 HH21 ARG 36 50.182 21.023 24.692 294 H THR 37 H THR 37 43.302 18.715 31.081 295 HA THR 37 HA THR 37 42.234 18.347 33.083 296 HB THR 37 HB THR 37 43.614 20.476 34.567 297 HG1 THR 37 HG1 THR 37 45.558 19.694 34.451 298 HG21 THR 37 HG21 THR 37 44.012 18.694 36.232 299 HG22 THR 37 HG22 THR 37 43.373 17.484 35.098 300 HG23 THR 37 HG23 THR 37 42.308 18.743 35.764 301 H LYS 38 H LYS 38 40.887 20.165 31.411 302 HA LYS 38 HA LYS 38 39.634 22.103 33.307 303 HB2 LYS 38 HB2 LYS 38 39.217 21.453 30.392 304 HB3 LYS 38 HB3 LYS 38 37.944 22.195 31.341 305 HG2 LYS 38 HG2 LYS 38 39.302 23.925 30.171 306 HG3 LYS 38 HG3 LYS 38 39.261 24.091 31.903 307 HD2 LYS 38 HD2 LYS 38 41.404 24.649 31.321 308 HD3 LYS 38 HD3 LYS 38 41.573 23.037 31.984 309 HE2 LYS 38 HE2 LYS 38 41.855 22.068 29.783 310 HE3 LYS 38 HE3 LYS 38 41.493 23.637 29.012 311 HZ1 LYS 38 HZ1 LYS 38 43.842 22.971 30.695 312 HZ2 LYS 38 HZ2 LYS 38 43.885 23.549 29.144 313 HZ3 LYS 38 HZ3 LYS 38 43.486 24.506 30.363 314 H ASP 39 H ASP 39 38.645 21.095 34.901 315 HA ASP 39 HA ASP 39 36.817 18.963 34.683 316 HB2 ASP 39 HB2 ASP 39 37.166 19.845 36.872 317 HB3 ASP 39 HB3 ASP 39 36.718 21.479 36.389 318 H ILE 40 H ILE 40 35.646 18.722 33.010 319 HA ILE 40 HA ILE 40 34.076 20.965 31.874 320 HB ILE 40 HB ILE 40 36.194 20.384 30.759 321 HG12 ILE 40 HG12 ILE 40 33.645 20.914 29.560 322 HG13 ILE 40 HG13 ILE 40 35.239 21.491 29.175 323 HG21 ILE 40 HG21 ILE 40 34.893 17.771 29.917 324 HG22 ILE 40 HG22 ILE 40 36.494 18.390 29.450 325 HG23 ILE 40 HG23 ILE 40 36.178 17.937 31.117 326 HD11 ILE 40 HD11 ILE 40 34.120 20.479 27.235 327 HD12 ILE 40 HD12 ILE 40 35.605 19.607 27.632 328 HD13 ILE 40 HD13 ILE 40 34.012 18.927 28.075 329 H THR 41 H THR 41 32.121 20.755 31.174 330 HA THR 41 HA THR 41 30.849 18.072 30.778 331 HB THR 41 HB THR 41 29.861 20.502 32.280 332 HG1 THR 41 HG1 THR 41 29.652 19.125 33.826 333 HG21 THR 41 HG21 THR 41 27.582 19.456 32.284 334 HG22 THR 41 HG22 THR 41 28.102 18.417 30.939 335 HG23 THR 41 HG23 THR 41 28.051 20.192 30.755 336 H VAL 42 H VAL 42 30.002 17.875 28.720 337 HA VAL 42 HA VAL 42 29.387 20.349 27.199 338 HB VAL 42 HB VAL 42 31.137 19.629 26.058 339 HG11 VAL 42 HG11 VAL 42 30.570 16.788 26.661 340 HG12 VAL 42 HG12 VAL 42 31.819 17.367 25.510 341 HG13 VAL 42 HG13 VAL 42 31.908 17.877 27.194 342 HG21 VAL 42 HG21 VAL 42 30.534 18.597 23.970 343 HG22 VAL 42 HG22 VAL 42 29.052 17.933 24.664 344 HG23 VAL 42 HG23 VAL 42 29.247 19.697 24.467 345 H HIS 43 H HIS 43 27.499 20.599 26.248 346 HA HIS 43 HA HIS 43 25.546 18.330 26.296 347 HB2 HIS 43 HB2 HIS 43 25.068 20.586 27.515 348 HB3 HIS 43 HB3 HIS 43 24.860 21.245 25.918 349 HD1 HIS 43 HD1 HIS 43 23.180 18.771 28.364 350 HD2 HIS 43 HD2 HIS 43 22.658 20.524 24.576 351 HE1 HIS 43 HE1 HIS 43 20.763 18.337 27.695 352 H TYR 44 H TYR 44 25.139 17.392 24.409 353 HA TYR 44 HA TYR 44 25.664 18.749 21.781 354 HB2 TYR 44 HB2 TYR 44 25.186 15.906 22.650 355 HB3 TYR 44 HB3 TYR 44 24.828 16.430 21.009 356 HD1 TYR 44 HD1 TYR 44 27.595 16.074 23.486 357 HD2 TYR 44 HD2 TYR 44 26.510 17.062 19.456 358 HE1 TYR 44 HE1 TYR 44 30.008 16.036 22.817 359 HE2 TYR 44 HE2 TYR 44 28.898 16.842 18.740 360 HH TYR 44 HH TYR 44 31.454 16.753 21.147 361 H VAL 45 H VAL 45 24.036 20.316 21.713 362 HA VAL 45 HA VAL 45 21.366 19.885 22.648 363 HB VAL 45 HB VAL 45 20.732 21.870 21.209 364 HG11 VAL 45 HG11 VAL 45 21.349 22.148 23.590 365 HG12 VAL 45 HG12 VAL 45 23.075 22.268 23.141 366 HG13 VAL 45 HG13 VAL 45 21.907 23.501 22.626 367 HG21 VAL 45 HG21 VAL 45 22.555 23.231 20.285 368 HG22 VAL 45 HG22 VAL 45 23.722 21.948 20.610 369 HG23 VAL 45 HG23 VAL 45 22.383 21.688 19.453 370 H ASP 46 H ASP 46 22.753 18.692 19.686 371 HA ASP 46 HA ASP 46 20.176 18.200 18.412 372 HB2 ASP 46 HB2 ASP 46 22.295 18.455 17.164 373 HB3 ASP 46 HB3 ASP 46 22.891 16.958 17.873 374 H LYS 47 H LYS 47 21.657 16.636 21.119 375 HA LYS 47 HA LYS 47 20.575 13.957 20.552 376 HB2 LYS 47 HB2 LYS 47 21.864 15.169 23.011 377 HB3 LYS 47 HB3 LYS 47 21.258 13.525 22.956 378 HG2 LYS 47 HG2 LYS 47 23.350 14.575 21.009 379 HG3 LYS 47 HG3 LYS 47 23.720 13.843 22.574 380 HD2 LYS 47 HD2 LYS 47 22.545 11.760 21.889 381 HD3 LYS 47 HD3 LYS 47 22.183 12.492 20.311 382 HE2 LYS 47 HE2 LYS 47 24.613 12.725 19.862 383 HE3 LYS 47 HE3 LYS 47 24.970 11.969 21.419 384 HZ1 LYS 47 HZ1 LYS 47 23.351 10.602 19.337 385 HZ2 LYS 47 HZ2 LYS 47 24.986 10.434 19.471 386 HZ3 LYS 47 HZ3 LYS 47 24.001 9.932 20.687 387 H MET 48 H MET 48 19.553 16.698 22.486 388 HA MET 48 HA MET 48 16.992 15.319 23.152 389 HB2 MET 48 HB2 MET 48 18.342 16.123 25.035 390 HB3 MET 48 HB3 MET 48 18.332 17.761 24.362 391 HG2 MET 48 HG2 MET 48 15.889 17.886 24.663 392 HG3 MET 48 HG3 MET 48 15.865 16.218 25.239 393 HE1 MET 48 HE1 MET 48 16.945 19.927 25.982 394 HE2 MET 48 HE2 MET 48 17.645 19.802 27.609 395 HE3 MET 48 HE3 MET 48 18.513 19.122 26.220 396 H SER 49 H SER 49 15.076 15.997 22.351 397 HA SER 49 HA SER 49 14.918 17.542 20.047 398 HB2 SER 49 HB2 SER 49 12.666 16.902 21.981 399 HB3 SER 49 HB3 SER 49 12.495 17.314 20.264 400 HG SER 49 HG SER 49 12.459 15.051 20.776 401 H GLU 50 H GLU 50 14.713 18.818 23.293 402 HA GLU 50 HA GLU 50 13.525 21.372 22.503 403 HB2 GLU 50 HB2 GLU 50 13.381 20.153 24.813 404 HB3 GLU 50 HB3 GLU 50 14.992 20.813 25.116 405 HG2 GLU 50 HG2 GLU 50 14.148 23.077 25.024 406 HG3 GLU 50 HG3 GLU 50 12.611 22.545 24.342 407 H GLY 51 H GLY 51 16.673 20.135 22.136 408 HA2 GLY 51 HA2 GLY 51 18.422 22.084 22.930 409 HA3 GLY 51 HA3 GLY 51 18.615 21.057 21.525 410 H GLU 52 H GLU 52 16.281 22.419 20.102 411 HA GLU 52 HA GLU 52 17.863 24.486 18.765 412 HB2 GLU 52 HB2 GLU 52 14.970 23.608 18.597 413 HB3 GLU 52 HB3 GLU 52 15.539 25.034 17.734 414 HG2 GLU 52 HG2 GLU 52 16.811 22.286 17.411 415 HG3 GLU 52 HG3 GLU 52 15.507 22.886 16.399 416 H GLN 53 H GLN 53 15.476 24.527 21.378 417 HA GLN 53 HA GLN 53 15.221 27.426 21.470 418 HB2 GLN 53 HB2 GLN 53 13.509 25.787 22.257 419 HB3 GLN 53 HB3 GLN 53 14.591 25.308 23.570 420 HG2 GLN 53 HG2 GLN 53 14.472 27.557 24.544 421 HG3 GLN 53 HG3 GLN 53 13.536 28.139 23.153 422 HE21 GLN 53 HE21 GLN 53 13.390 25.857 25.974 423 HE22 GLN 53 HE22 GLN 53 11.644 25.707 25.895 424 H LEU 54 H LEU 54 17.296 24.996 23.113 425 HA LEU 54 HA LEU 54 18.567 26.960 24.847 426 HB2 LEU 54 HB2 LEU 54 19.444 24.126 24.115 427 HB3 LEU 54 HB3 LEU 54 20.166 25.162 25.349 428 HG LEU 54 HG LEU 54 18.861 23.698 26.560 429 HD11 LEU 54 HD11 LEU 54 17.319 25.098 27.697 430 HD12 LEU 54 HD12 LEU 54 18.525 26.196 27.012 431 HD13 LEU 54 HD13 LEU 54 16.945 26.038 26.229 432 HD21 LEU 54 HD21 LEU 54 17.484 22.732 24.780 433 HD22 LEU 54 HD22 LEU 54 16.598 23.076 26.259 434 HD23 LEU 54 HD23 LEU 54 16.403 24.145 24.861 435 H ARG 55 H ARG 55 19.431 25.578 21.672 436 HA ARG 55 HA ARG 55 21.907 26.960 21.311 437 HB2 ARG 55 HB2 ARG 55 21.118 24.952 20.157 438 HB3 ARG 55 HB3 ARG 55 19.691 25.797 19.555 439 HG2 ARG 55 HG2 ARG 55 20.945 27.154 18.151 440 HG3 ARG 55 HG3 ARG 55 22.517 26.573 18.788 441 HD2 ARG 55 HD2 ARG 55 21.894 24.248 18.059 442 HD3 ARG 55 HD3 ARG 55 20.416 24.879 17.338 443 HE ARG 55 HE ARG 55 23.097 25.945 16.508 444 HH11 ARG 55 HH12 ARG 55 20.229 24.110 15.375 445 HH12 ARG 55 HH11 ARG 55 20.904 24.105 13.756 446 HH21 ARG 55 HH22 ARG 55 23.617 26.048 14.519 447 HH22 ARG 55 HH21 ARG 55 22.867 25.055 13.292 448 H GLY 56 H GLY 56 18.493 27.801 20.740 449 HA2 GLY 56 HA2 GLY 56 18.813 30.480 19.839 450 HA3 GLY 56 HA3 GLY 56 17.431 29.821 20.717 451 H GLU 57 H GLU 57 18.976 29.177 23.272 452 HA GLU 57 HA GLU 57 18.818 31.786 24.451 453 HB2 GLU 57 HB2 GLU 57 20.156 29.329 25.551 454 HB3 GLU 57 HB3 GLU 57 19.956 30.844 26.412 455 HG2 GLU 57 HG2 GLU 57 17.702 29.057 25.442 456 HG3 GLU 57 HG3 GLU 57 18.400 29.189 27.054 457 H ILE 58 H ILE 58 21.601 29.857 23.311 458 HA ILE 58 HA ILE 58 23.669 31.646 24.157 459 HB ILE 58 HB ILE 58 23.726 29.887 21.671 460 HG12 ILE 58 HG12 ILE 58 24.778 29.004 24.390 461 HG13 ILE 58 HG13 ILE 58 23.148 28.594 23.835 462 HG21 ILE 58 HG21 ILE 58 26.148 29.922 21.914 463 HG22 ILE 58 HG22 ILE 58 25.600 31.587 21.963 464 HG23 ILE 58 HG23 ILE 58 26.035 30.775 23.468 465 HD11 ILE 58 HD11 ILE 58 24.562 26.741 23.353 466 HD12 ILE 58 HD12 ILE 58 24.155 27.508 21.807 467 HD13 ILE 58 HD13 ILE 58 25.758 27.758 22.535 468 H TYR 59 H TYR 59 21.923 31.401 20.986 469 HA TYR 59 HA TYR 59 23.351 33.617 19.895 470 HB2 TYR 59 HB2 TYR 59 21.960 31.711 18.726 471 HB3 TYR 59 HB3 TYR 59 20.659 32.899 18.795 472 HD1 TYR 59 HD1 TYR 59 21.101 35.242 17.747 473 HD2 TYR 59 HD2 TYR 59 23.804 31.915 17.254 474 HE1 TYR 59 HE1 TYR 59 22.219 36.406 15.837 475 HE2 TYR 59 HE2 TYR 59 24.917 33.071 15.373 476 HH TYR 59 HH TYR 59 25.010 34.952 14.094 477 H GLN 60 H GLN 60 20.098 33.545 21.441 478 HA GLN 60 HA GLN 60 19.638 36.330 20.971 479 HB2 GLN 60 HB2 GLN 60 18.542 34.412 23.064 480 HB3 GLN 60 HB3 GLN 60 17.974 36.078 22.861 481 HG2 GLN 60 HG2 GLN 60 17.285 35.613 20.548 482 HG3 GLN 60 HG3 GLN 60 17.906 33.968 20.659 483 HE21 GLN 60 HE21 GLN 60 15.535 33.645 19.932 484 HE22 GLN 60 HE22 GLN 60 14.383 33.433 21.263 485 H ALA 61 H ALA 61 21.438 34.683 23.599 486 HA ALA 61 HA ALA 61 21.639 37.123 25.197 487 HB1 ALA 61 HB1 ALA 61 23.065 35.724 26.641 488 HB2 ALA 61 HB2 ALA 61 21.519 34.942 26.268 489 HB3 ALA 61 HB3 ALA 61 23.004 34.419 25.438 490 H TYR 62 H TYR 62 23.891 35.330 23.038 491 HA TYR 62 HA TYR 62 25.965 37.423 23.514 492 HB2 TYR 62 HB2 TYR 62 26.357 34.548 22.656 493 HB3 TYR 62 HB3 TYR 62 27.597 35.688 23.160 494 HD1 TYR 62 HD2 TYR 62 27.289 36.722 25.600 495 HD2 TYR 62 HD1 TYR 62 25.499 33.050 24.250 496 HE1 TYR 62 HE2 TYR 62 26.892 36.055 27.954 497 HE2 TYR 62 HE1 TYR 62 25.079 32.382 26.623 498 HH TYR 62 HH TYR 62 25.948 34.535 29.350 499 H LYS 63 H LYS 63 23.829 36.595 21.127 500 HA LYS 63 HA LYS 63 23.652 36.753 18.907 501 HB2 LYS 63 HB2 LYS 63 25.524 39.101 19.312 502 HB3 LYS 63 HB3 LYS 63 24.559 38.829 17.860 503 HG2 LYS 63 HG2 LYS 63 23.304 39.037 20.630 504 HG3 LYS 63 HG3 LYS 63 23.599 40.445 19.625 505 HD2 LYS 63 HD2 LYS 63 21.985 39.859 18.039 506 HD3 LYS 63 HD3 LYS 63 22.035 38.148 18.447 507 HE2 LYS 63 HE2 LYS 63 19.948 39.056 19.196 508 HE3 LYS 63 HE3 LYS 63 20.912 38.528 20.570 509 HZ1 LYS 63 HZ1 LYS 63 20.586 41.362 19.704 510 HZ2 LYS 63 HZ2 LYS 63 19.849 40.637 20.979 511 HZ3 LYS 63 HZ3 LYS 63 21.478 40.848 21.002 512 H HIS 64 H HIS 64 25.199 34.777 19.664 513 HA HIS 64 HA HIS 64 26.815 34.084 17.324 514 HB2 HIS 64 HB2 HIS 64 28.343 35.284 19.074 515 HB3 HIS 64 HB3 HIS 64 27.926 34.007 20.194 516 HD1 HIS 64 HD1 HIS 64 28.785 31.407 19.278 517 HD2 HIS 64 HD2 HIS 64 30.396 34.886 17.528 518 HE1 HIS 64 HE1 HIS 64 30.982 30.730 18.220 519 H GLU 65 H GLU 65 27.238 31.898 17.158 520 HA GLU 65 HA GLU 65 25.241 30.243 18.621 521 HB2 GLU 65 HB2 GLU 65 25.276 31.076 15.989 522 HB3 GLU 65 HB3 GLU 65 26.123 29.646 15.810 523 HG2 GLU 65 HG2 GLU 65 23.736 29.253 17.483 524 HG3 GLU 65 HG3 GLU 65 23.384 30.038 15.947 525 H THR 66 H THR 66 26.553 28.051 16.804 526 HA THR 66 HA THR 66 28.492 27.172 18.931 527 HB THR 66 HB THR 66 28.221 24.926 17.838 528 HG1 THR 66 HG1 THR 66 25.940 26.074 16.585 529 HG21 THR 66 HG21 THR 66 26.937 25.488 19.853 530 HG22 THR 66 HG22 THR 66 26.000 24.456 18.760 531 HG23 THR 66 HG23 THR 66 25.646 26.196 18.856 532 H VAL 67 H VAL 67 30.523 26.647 18.505 533 HA VAL 67 HA VAL 67 31.633 26.323 15.837 534 HB VAL 67 HB VAL 67 33.397 27.949 16.026 535 HG11 VAL 67 HG11 VAL 67 31.296 28.643 14.923 536 HG12 VAL 67 HG12 VAL 67 30.791 29.432 16.430 537 HG13 VAL 67 HG13 VAL 67 32.250 29.972 15.582 538 HG21 VAL 67 HG21 VAL 67 33.379 29.754 17.716 539 HG22 VAL 67 HG22 VAL 67 32.099 28.893 18.603 540 HG23 VAL 67 HG23 VAL 67 33.711 28.169 18.413 541 HA PRO 68 HA PRO 68 30.642 24.894 19.149 542 HB2 PRO 68 HB2 PRO 68 31.525 23.949 21.534 543 HB3 PRO 68 HB3 PRO 68 31.469 22.935 20.073 544 HG2 PRO 68 HG2 PRO 68 33.839 24.474 21.190 545 HG3 PRO 68 HG3 PRO 68 33.768 22.738 20.749 546 HD2 PRO 68 HD2 PRO 68 34.731 24.587 19.021 547 HD3 PRO 68 HD3 PRO 68 33.720 23.238 18.433 548 H ALA 69 H ALA 69 29.849 25.680 21.387 549 HA ALA 69 HA ALA 69 30.995 28.382 21.992 550 HB1 ALA 69 HB1 ALA 69 28.864 28.763 23.197 551 HB2 ALA 69 HB2 ALA 69 28.572 28.320 21.508 552 HB3 ALA 69 HB3 ALA 69 28.329 27.127 22.799 553 H ILE 70 H ILE 70 32.216 28.666 23.837 554 HA ILE 70 HA ILE 70 32.242 26.472 25.867 555 HB ILE 70 HB ILE 70 34.604 28.205 25.065 556 HG12 ILE 70 HG12 ILE 70 35.316 25.627 24.339 557 HG13 ILE 70 HG13 ILE 70 33.629 25.646 23.864 558 HG21 ILE 70 HG21 ILE 70 35.910 26.531 26.352 559 HG22 ILE 70 HG22 ILE 70 34.768 27.417 27.353 560 HG23 ILE 70 HG23 ILE 70 34.395 25.754 26.857 561 HD11 ILE 70 HD11 ILE 70 34.079 27.721 22.512 562 HD12 ILE 70 HD12 ILE 70 35.781 27.648 23.016 563 HD13 ILE 70 HD13 ILE 70 35.097 26.356 22.013 564 H PHE 71 H PHE 71 32.034 27.001 27.950 565 HA PHE 71 HA PHE 71 32.202 29.862 28.755 566 HB2 PHE 71 HB2 PHE 71 30.181 27.775 29.628 567 HB3 PHE 71 HB3 PHE 71 30.369 29.371 30.349 568 HD1 PHE 71 HD2 PHE 71 29.371 27.550 27.257 569 HD2 PHE 71 HD1 PHE 71 29.504 31.367 29.260 570 HE1 PHE 71 HE2 PHE 71 27.913 28.538 25.497 571 HE2 PHE 71 HE1 PHE 71 28.017 32.326 27.521 572 HZ PHE 71 HZ PHE 71 27.224 30.899 25.634 573 H ILE 72 H ILE 72 33.537 30.247 30.435 574 HA ILE 72 HA ILE 72 34.447 27.981 32.170 575 HB ILE 72 HB ILE 72 36.210 30.208 31.070 576 HG12 ILE 72 HG12 ILE 72 35.764 27.345 30.176 577 HG13 ILE 72 HG13 ILE 72 35.773 28.819 29.218 578 HG21 ILE 72 HG21 ILE 72 38.046 28.890 32.152 579 HG22 ILE 72 HG22 ILE 72 36.878 29.465 33.322 580 HG23 ILE 72 HG23 ILE 72 36.834 27.771 32.815 581 HD11 ILE 72 HD11 ILE 72 37.737 27.556 28.686 582 HD12 ILE 72 HD12 ILE 72 38.260 28.983 29.609 583 HD13 ILE 72 HD13 ILE 72 38.167 27.380 30.393 584 H ASN 73 H ASN 73 34.094 28.365 34.259 585 HA ASN 73 HA ASN 73 33.189 29.386 36.078 586 HB2 ASN 73 HB2 ASN 73 35.232 31.543 35.409 587 HB3 ASN 73 HB3 ASN 73 34.505 31.262 36.986 588 HD21 ASN 73 HD21 ASN 73 37.295 31.309 36.617 589 HD22 ASN 73 HD22 ASN 73 37.890 29.664 36.883 590 H GLY 74 H GLY 74 31.533 29.757 33.874 591 HA2 GLY 74 HA2 GLY 74 29.640 30.949 33.263 592 HA3 GLY 74 HA3 GLY 74 29.954 32.115 34.507 593 H ASN 75 H ASN 75 32.712 32.039 32.511 594 HA ASN 75 HA ASN 75 31.784 34.413 30.987 595 HB2 ASN 75 HB2 ASN 75 34.530 33.431 31.853 596 HB3 ASN 75 HB3 ASN 75 34.312 34.748 30.727 597 HD21 ASN 75 HD21 ASN 75 34.248 33.926 34.074 598 HD22 ASN 75 HD22 ASN 75 33.847 35.564 34.584 599 H PHE 76 H PHE 76 31.899 34.598 28.773 600 HA PHE 76 HA PHE 76 31.887 32.048 27.330 601 HB2 PHE 76 HB2 PHE 76 30.092 33.610 26.943 602 HB3 PHE 76 HB3 PHE 76 31.224 34.893 26.539 603 HD1 PHE 76 HD2 PHE 76 30.387 31.377 25.412 604 HD2 PHE 76 HD1 PHE 76 31.623 35.351 24.273 605 HE1 PHE 76 HE2 PHE 76 30.358 30.712 23.022 606 HE2 PHE 76 HE1 PHE 76 31.597 34.673 21.886 607 HZ PHE 76 HZ PHE 76 30.963 32.359 21.257 608 H ILE 77 H ILE 77 33.236 31.279 25.868 609 HA ILE 77 HA ILE 77 35.175 32.993 24.446 610 HB ILE 77 HB ILE 77 35.821 30.315 25.734 611 HG12 ILE 77 HG12 ILE 77 36.127 32.217 27.261 612 HG13 ILE 77 HG13 ILE 77 37.637 31.426 26.867 613 HG21 ILE 77 HG21 ILE 77 36.782 30.187 23.531 614 HG22 ILE 77 HG22 ILE 77 37.437 31.834 23.647 615 HG23 ILE 77 HG23 ILE 77 38.086 30.533 24.662 616 HD11 ILE 77 HD11 ILE 77 38.261 33.259 25.338 617 HD12 ILE 77 HD12 ILE 77 36.705 34.063 25.636 618 HD13 ILE 77 HD13 ILE 77 37.874 33.879 26.949 619 H GLY 78 H GLY 78 35.152 32.646 22.293 620 HA2 GLY 78 HA2 GLY 78 33.973 30.091 21.237 621 HA3 GLY 78 HA3 GLY 78 33.614 31.644 20.500 622 H GLY 79 H GLY 79 35.443 28.998 20.215 623 HA2 GLY 79 HA2 GLY 79 36.391 28.915 17.879 624 HA3 GLY 79 HA3 GLY 79 37.461 30.219 18.381 625 H CYS 80 H CYS 80 37.731 27.123 17.683 626 HA CYS 80 HA CYS 80 38.775 25.816 19.987 627 HB2 CYS 80 HB2 CYS 80 39.514 25.418 17.045 628 HB3 CYS 80 HB3 CYS 80 39.893 24.307 18.372 629 HG CYS 80 HG CYS 80 36.972 25.270 17.159 630 H SER 81 H SER 81 40.531 27.725 17.497 631 HA SER 81 HA SER 81 43.080 27.567 18.846 632 HB2 SER 81 HB2 SER 81 42.391 28.254 16.375 633 HB3 SER 81 HB3 SER 81 42.541 29.882 17.063 634 HG SER 81 HG SER 81 44.692 29.175 17.801 635 H ASP 82 H ASP 82 40.357 29.844 19.016 636 HA ASP 82 HA ASP 82 41.553 31.885 20.572 637 HB2 ASP 82 HB2 ASP 82 39.146 31.445 19.331 638 HB3 ASP 82 HB3 ASP 82 38.642 31.258 20.990 639 H LEU 83 H LEU 83 39.957 28.903 21.552 640 HA LEU 83 HA LEU 83 40.187 29.240 24.421 641 HB2 LEU 83 HB2 LEU 83 38.532 27.767 23.409 642 HB3 LEU 83 HB3 LEU 83 39.781 26.866 22.559 643 HG LEU 83 HG LEU 83 40.661 26.012 24.723 644 HD11 LEU 83 HD11 LEU 83 39.907 27.786 26.253 645 HD12 LEU 83 HD12 LEU 83 38.210 27.402 25.893 646 HD13 LEU 83 HD13 LEU 83 39.238 26.228 26.751 647 HD21 LEU 83 HD21 LEU 83 37.696 25.509 24.270 648 HD22 LEU 83 HD22 LEU 83 39.027 24.745 23.375 649 HD23 LEU 83 HD23 LEU 83 38.847 24.432 25.100 650 H GLU 84 H GLU 84 42.169 27.497 21.991 651 HA GLU 84 HA GLU 84 44.128 26.515 23.849 652 HB2 GLU 84 HB2 GLU 84 44.042 26.843 20.836 653 HB3 GLU 84 HB3 GLU 84 45.520 26.329 21.664 654 HG2 GLU 84 HG2 GLU 84 44.442 24.455 22.683 655 HG3 GLU 84 HG3 GLU 84 42.858 24.962 22.101 656 H ALA 85 H ALA 85 43.878 29.611 22.168 657 HA ALA 85 HA ALA 85 46.501 30.614 22.590 658 HB1 ALA 85 HB1 ALA 85 44.813 31.742 21.207 659 HB2 ALA 85 HB2 ALA 85 43.750 31.975 22.606 660 HB3 ALA 85 HB3 ALA 85 45.296 32.828 22.525 661 H LEU 86 H LEU 86 43.703 30.551 24.839 662 HA LEU 86 HA LEU 86 45.080 31.967 26.977 663 HB2 LEU 86 HB2 LEU 86 42.684 30.080 27.075 664 HB3 LEU 86 HB3 LEU 86 43.195 31.179 28.353 665 HG LEU 86 HG LEU 86 42.146 32.025 25.619 666 HD11 LEU 86 HD11 LEU 86 40.886 32.129 28.393 667 HD12 LEU 86 HD12 LEU 86 40.189 32.784 26.897 668 HD13 LEU 86 HD13 LEU 86 40.422 31.038 27.064 669 HD21 LEU 86 HD21 LEU 86 43.706 33.707 26.490 670 HD22 LEU 86 HD22 LEU 86 42.048 34.292 26.616 671 HD23 LEU 86 HD23 LEU 86 42.873 33.693 28.071 672 H ASP 87 H ASP 87 44.757 28.576 26.029 673 HA ASP 87 HA ASP 87 45.930 27.408 28.360 674 HB2 ASP 87 HB2 ASP 87 44.507 26.333 26.486 675 HB3 ASP 87 HB3 ASP 87 46.000 26.224 25.574 676 H LYS 88 H LYS 88 47.405 28.630 25.388 677 HA LYS 88 HA LYS 88 50.152 27.936 26.105 678 HB2 LYS 88 HB2 LYS 88 48.901 29.820 24.071 679 HB3 LYS 88 HB3 LYS 88 50.625 29.871 24.405 680 HG2 LYS 88 HG2 LYS 88 50.433 28.491 22.551 681 HG3 LYS 88 HG3 LYS 88 50.784 27.412 23.903 682 HD2 LYS 88 HD2 LYS 88 48.362 26.775 24.003 683 HD3 LYS 88 HD3 LYS 88 48.045 27.920 22.673 684 HE2 LYS 88 HE2 LYS 88 49.687 26.718 21.244 685 HE3 LYS 88 HE3 LYS 88 49.889 25.501 22.523 686 HZ1 LYS 88 HZ1 LYS 88 47.435 26.094 20.984 687 HZ2 LYS 88 HZ2 LYS 88 48.347 24.709 20.929 688 HZ3 LYS 88 HZ3 LYS 88 47.486 25.062 22.293 689 H GLU 89 H GLU 89 48.269 30.913 26.597 690 HA GLU 89 HA GLU 89 50.623 32.339 27.548 691 HB2 GLU 89 HB2 GLU 89 47.706 33.081 27.162 692 HB3 GLU 89 HB3 GLU 89 48.906 34.232 27.737 693 HG2 GLU 89 HG2 GLU 89 49.084 32.748 25.081 694 HG3 GLU 89 HG3 GLU 89 48.513 34.396 25.290 695 H GLY 90 H GLY 90 49.175 30.152 29.340 696 HA2 GLY 90 HA2 GLY 90 49.085 29.813 31.630 697 HA3 GLY 90 HA3 GLY 90 49.772 31.420 31.871 698 H LYS 91 H LYS 91 46.989 31.723 29.942 699 HA LYS 91 HA LYS 91 45.618 33.084 32.151 700 HB2 LYS 91 HB2 LYS 91 45.390 33.112 29.108 701 HB3 LYS 91 HB3 LYS 91 44.319 33.989 30.183 702 HG2 LYS 91 HG2 LYS 91 46.367 35.105 31.204 703 HG3 LYS 91 HG3 LYS 91 47.316 34.388 29.906 704 HD2 LYS 91 HD2 LYS 91 45.046 36.398 29.588 705 HD3 LYS 91 HD3 LYS 91 46.776 36.728 29.462 706 HE2 LYS 91 HE2 LYS 91 46.866 35.091 27.515 707 HE3 LYS 91 HE3 LYS 91 45.104 35.008 27.583 708 HZ1 LYS 91 HZ1 LYS 91 45.128 37.484 27.218 709 HZ2 LYS 91 HZ2 LYS 91 46.742 37.414 26.981 710 HZ3 LYS 91 HZ3 LYS 91 45.763 36.624 25.960 711 H LEU 92 H LEU 92 45.405 30.037 30.784 712 HA LEU 92 HA LEU 92 42.586 29.671 31.667 713 HB2 LEU 92 HB2 LEU 92 43.150 29.039 29.320 714 HB3 LEU 92 HB3 LEU 92 44.375 27.935 29.915 715 HG LEU 92 HG LEU 92 42.725 26.487 30.913 716 HD11 LEU 92 HD11 LEU 92 40.306 26.874 30.649 717 HD12 LEU 92 HD12 LEU 92 41.044 28.049 31.726 718 HD13 LEU 92 HD13 LEU 92 40.638 28.524 30.057 719 HD21 LEU 92 HD21 LEU 92 41.455 25.841 28.859 720 HD22 LEU 92 HD22 LEU 92 41.894 27.386 28.118 721 HD23 LEU 92 HD23 LEU 92 43.158 26.210 28.508 722 H ASP 93 H ASP 93 45.926 28.369 32.010 723 HA ASP 93 HA ASP 93 45.487 26.591 34.165 724 HB2 ASP 93 HB2 ASP 93 47.800 28.481 33.556 725 HB3 ASP 93 HB3 ASP 93 47.849 27.198 34.752 726 H GLY 94 H GLY 94 45.953 30.160 34.209 727 HA2 GLY 94 HA2 GLY 94 45.677 30.538 37.029 728 HA3 GLY 94 HA3 GLY 94 45.423 31.752 35.774 729 H LEU 95 H LEU 95 43.159 29.918 34.617 730 HA LEU 95 HA LEU 95 40.972 30.891 36.349 731 HB2 LEU 95 HB2 LEU 95 41.153 29.558 33.622 732 HB3 LEU 95 HB3 LEU 95 39.620 29.745 34.456 733 HG LEU 95 HG LEU 95 41.454 32.069 33.759 734 HD11 LEU 95 HD11 LEU 95 40.609 30.923 31.720 735 HD12 LEU 95 HD12 LEU 95 38.943 31.108 32.322 736 HD13 LEU 95 HD13 LEU 95 39.918 32.535 31.916 737 HD21 LEU 95 HD21 LEU 95 38.536 31.965 34.646 738 HD22 LEU 95 HD22 LEU 95 39.899 32.631 35.578 739 HD23 LEU 95 HD23 LEU 95 39.385 33.414 34.081 740 H LEU 96 H LEU 96 42.634 27.879 35.631 741 HA LEU 96 HA LEU 96 40.640 26.124 36.762 742 HB2 LEU 96 HB2 LEU 96 43.621 25.789 36.224 743 HB3 LEU 96 HB3 LEU 96 42.599 24.467 36.773 744 HG LEU 96 HG LEU 96 42.171 25.952 34.141 745 HD11 LEU 96 HD11 LEU 96 43.162 24.014 33.120 746 HD12 LEU 96 HD12 LEU 96 44.275 24.527 34.370 747 HD13 LEU 96 HD13 LEU 96 43.215 23.137 34.668 748 HD21 LEU 96 HD21 LEU 96 40.073 25.128 34.940 749 HD22 LEU 96 HD22 LEU 96 40.653 24.018 33.721 750 HD23 LEU 96 HD23 LEU 96 40.792 23.569 35.425 751 H SER 97 H SER 97 43.553 27.574 38.212 752 HA SER 97 HA SER 97 42.435 27.378 40.910 753 HB2 SER 97 HB2 SER 97 44.855 25.669 40.175 754 HB3 SER 97 HB3 SER 97 44.368 26.068 41.835 755 HG SER 97 HG SER 97 42.293 25.169 40.288 Start of MODEL 20 1 H1 GLY 1 H1 GLY 1 18.651 35.092 29.428 2 H2 GLY 1 H2 GLY 1 17.202 35.145 28.631 3 H3 GLY 1 H3 GLY 1 18.041 33.733 28.723 4 HA2 GLY 1 HA2 GLY 1 16.822 35.186 30.972 5 HA3 GLY 1 HA3 GLY 1 16.192 33.693 30.233 6 H ALA 2 H ALA 2 17.808 34.804 32.851 7 HA ALA 2 HA ALA 2 20.106 33.109 32.986 8 HB1 ALA 2 HB1 ALA 2 20.243 33.948 35.296 9 HB2 ALA 2 HB2 ALA 2 19.938 35.249 34.134 10 HB3 ALA 2 HB3 ALA 2 18.609 34.632 35.147 11 H MET 3 H MET 3 16.748 32.500 33.958 12 HA MET 3 HA MET 3 17.643 30.438 35.879 13 HB2 MET 3 HB2 MET 3 14.986 31.865 35.626 14 HB3 MET 3 HB3 MET 3 15.434 30.699 36.876 15 HG2 MET 3 HG2 MET 3 16.748 33.389 36.363 16 HG3 MET 3 HG3 MET 3 15.700 32.968 37.714 17 HE1 MET 3 HE1 MET 3 17.696 34.165 39.153 18 HE2 MET 3 HE2 MET 3 19.354 33.539 39.214 19 HE3 MET 3 HE3 MET 3 18.750 34.306 37.727 20 HA PRO 4 HA PRO 4 14.547 27.617 33.790 21 HB2 PRO 4 HB2 PRO 4 13.563 28.014 31.279 22 HB3 PRO 4 HB3 PRO 4 12.819 28.729 32.742 23 HG2 PRO 4 HG2 PRO 4 14.732 30.043 30.790 24 HG3 PRO 4 HG3 PRO 4 13.200 30.693 31.454 25 HD2 PRO 4 HD2 PRO 4 15.654 31.320 32.478 26 HD3 PRO 4 HD3 PRO 4 14.198 31.198 33.517 27 H SER 5 H SER 5 16.924 29.194 31.710 28 HA SER 5 HA SER 5 17.609 26.600 30.394 29 HB2 SER 5 HB2 SER 5 17.591 29.385 29.214 30 HB3 SER 5 HB3 SER 5 17.942 27.865 28.362 31 HG SER 5 HG SER 5 15.684 28.678 28.230 32 H ILE 6 H ILE 6 19.720 27.453 28.889 33 HA ILE 6 HA ILE 6 21.453 26.142 30.446 34 HB ILE 6 HB ILE 6 23.049 26.233 28.773 35 HG12 ILE 6 HG12 ILE 6 21.826 28.834 27.894 36 HG13 ILE 6 HG13 ILE 6 23.498 28.499 28.301 37 HG21 ILE 6 HG21 ILE 6 21.917 25.375 27.038 38 HG22 ILE 6 HG22 ILE 6 20.805 25.154 28.389 39 HG23 ILE 6 HG23 ILE 6 20.541 26.492 27.223 40 HD11 ILE 6 HD11 ILE 6 22.034 27.572 25.788 41 HD12 ILE 6 HD12 ILE 6 23.269 28.837 25.909 42 HD13 ILE 6 HD13 ILE 6 23.702 27.141 26.198 43 H ALA 7 H ALA 7 21.280 29.566 30.388 44 HA ALA 7 HA ALA 7 23.737 30.457 31.457 45 HB1 ALA 7 HB1 ALA 7 22.313 32.212 32.554 46 HB2 ALA 7 HB2 ALA 7 21.918 31.971 30.849 47 HB3 ALA 7 HB3 ALA 7 20.873 31.266 32.095 48 H SER 8 H SER 8 21.085 28.728 33.161 49 HA SER 8 HA SER 8 22.223 29.021 35.835 50 HB2 SER 8 HB2 SER 8 20.137 27.191 34.586 51 HB3 SER 8 HB3 SER 8 20.667 27.032 36.271 52 HG SER 8 HG SER 8 19.642 29.429 35.102 53 H MET 9 H MET 9 22.632 26.626 33.237 54 HA MET 9 HA MET 9 23.865 24.554 34.796 55 HB2 MET 9 HB2 MET 9 24.298 25.173 31.842 56 HB3 MET 9 HB3 MET 9 24.576 23.643 32.662 57 HG2 MET 9 HG2 MET 9 22.196 23.324 33.029 58 HG3 MET 9 HG3 MET 9 21.831 24.941 32.455 59 HE1 MET 9 HE1 MET 9 23.119 21.376 31.370 60 HE2 MET 9 HE2 MET 9 23.220 21.547 29.606 61 HE3 MET 9 HE3 MET 9 24.386 22.398 30.641 62 H ILE 10 H ILE 10 25.140 27.467 33.232 63 HA ILE 10 HA ILE 10 27.906 26.885 33.360 64 HB ILE 10 HB ILE 10 26.866 29.693 33.774 65 HG12 ILE 10 HG12 ILE 10 25.396 28.919 32.049 66 HG13 ILE 10 HG13 ILE 10 26.578 30.004 31.367 67 HG21 ILE 10 HG21 ILE 10 28.766 30.201 32.223 68 HG22 ILE 10 HG22 ILE 10 29.255 29.467 33.752 69 HG23 ILE 10 HG23 ILE 10 29.219 28.478 32.285 70 HD11 ILE 10 HD11 ILE 10 27.807 28.059 30.395 71 HD12 ILE 10 HD12 ILE 10 26.586 26.964 31.085 72 HD13 ILE 10 HD13 ILE 10 26.122 28.141 29.851 73 H LYS 11 H LYS 11 25.731 27.705 35.960 74 HA LYS 11 HA LYS 11 27.979 28.240 37.839 75 HB2 LYS 11 HB2 LYS 11 24.975 28.351 38.289 76 HB3 LYS 11 HB3 LYS 11 26.228 28.700 39.478 77 HG2 LYS 11 HG2 LYS 11 25.687 30.799 38.823 78 HG3 LYS 11 HG3 LYS 11 27.103 30.488 37.815 79 HD2 LYS 11 HD2 LYS 11 25.689 30.136 35.855 80 HD3 LYS 11 HD3 LYS 11 24.223 30.136 36.865 81 HE2 LYS 11 HE2 LYS 11 24.762 32.472 37.556 82 HE3 LYS 11 HE3 LYS 11 26.123 32.484 36.420 83 HZ1 LYS 11 HZ1 LYS 11 24.579 32.343 34.601 84 HZ2 LYS 11 HZ2 LYS 11 23.321 31.946 35.612 85 HZ3 LYS 11 HZ3 LYS 11 23.939 33.446 35.650 86 H GLY 12 H GLY 12 26.453 25.491 36.687 87 HA2 GLY 12 HA2 GLY 12 26.607 23.925 39.195 88 HA3 GLY 12 HA3 GLY 12 25.983 23.398 37.631 89 H ASN 13 H ASN 13 28.533 24.388 36.242 90 HA ASN 13 HA ASN 13 30.561 22.509 37.333 91 HB2 ASN 13 HB2 ASN 13 29.445 22.508 34.507 92 HB3 ASN 13 HB3 ASN 13 30.978 21.762 34.919 93 HD21 ASN 13 HD21 ASN 13 30.812 20.236 36.957 94 HD22 ASN 13 HD22 ASN 13 29.439 19.126 36.880 95 H LYS 14 H LYS 14 32.704 22.841 36.575 96 HA LYS 14 HA LYS 14 33.368 25.674 36.707 97 HB2 LYS 14 HB2 LYS 14 34.583 23.871 37.894 98 HB3 LYS 14 HB3 LYS 14 35.215 23.267 36.363 99 HG2 LYS 14 HG2 LYS 14 36.655 25.053 36.059 100 HG3 LYS 14 HG3 LYS 14 35.616 26.188 36.935 101 HD2 LYS 14 HD2 LYS 14 37.466 26.002 38.299 102 HD3 LYS 14 HD3 LYS 14 36.283 24.952 39.083 103 HE2 LYS 14 HE2 LYS 14 37.374 22.989 37.913 104 HE3 LYS 14 HE3 LYS 14 38.566 24.109 37.236 105 HZ1 LYS 14 HZ1 LYS 14 39.459 23.103 39.170 106 HZ2 LYS 14 HZ2 LYS 14 39.142 24.682 39.616 107 HZ3 LYS 14 HZ3 LYS 14 38.147 23.472 40.088 108 H VAL 15 H VAL 15 33.544 23.293 34.130 109 HA VAL 15 HA VAL 15 33.747 25.546 32.190 110 HB VAL 15 HB VAL 15 35.176 22.923 31.697 111 HG11 VAL 15 HG11 VAL 15 34.984 25.474 30.071 112 HG12 VAL 15 HG12 VAL 15 36.101 24.134 29.734 113 HG13 VAL 15 HG13 VAL 15 34.356 23.879 29.642 114 HG21 VAL 15 HG21 VAL 15 36.328 25.647 32.389 115 HG22 VAL 15 HG22 VAL 15 36.460 24.168 33.352 116 HG23 VAL 15 HG23 VAL 15 37.268 24.263 31.785 117 H VAL 16 H VAL 16 32.082 25.600 30.881 118 HA VAL 16 HA VAL 16 30.490 23.107 30.379 119 HB VAL 16 HB VAL 16 29.382 25.902 30.771 120 HG11 VAL 16 HG11 VAL 16 28.067 24.681 29.083 121 HG12 VAL 16 HG12 VAL 16 28.032 23.236 30.121 122 HG13 VAL 16 HG13 VAL 16 27.178 24.713 30.608 123 HG21 VAL 16 HG21 VAL 16 29.207 23.334 32.405 124 HG22 VAL 16 HG22 VAL 16 29.968 24.859 32.915 125 HG23 VAL 16 HG23 VAL 16 28.216 24.771 32.704 126 H VAL 17 H VAL 17 30.228 22.583 28.298 127 HA VAL 17 HA VAL 17 30.685 24.637 26.160 128 HB VAL 17 HB VAL 17 31.811 21.806 26.309 129 HG11 VAL 17 HG11 VAL 17 32.883 22.313 24.120 130 HG12 VAL 17 HG12 VAL 17 31.137 22.204 23.976 131 HG13 VAL 17 HG13 VAL 17 31.924 23.805 24.000 132 HG21 VAL 17 HG21 VAL 17 33.977 23.042 26.033 133 HG22 VAL 17 HG22 VAL 17 33.083 24.565 26.226 134 HG23 VAL 17 HG23 VAL 17 33.152 23.389 27.554 135 H PHE 18 H PHE 18 29.486 24.418 24.262 136 HA PHE 18 HA PHE 18 27.244 22.414 24.340 137 HB2 PHE 18 HB2 PHE 18 27.202 25.243 23.234 138 HB3 PHE 18 HB3 PHE 18 25.876 24.088 23.193 139 HD1 PHE 18 HD2 PHE 18 24.751 23.380 25.323 140 HD2 PHE 18 HD1 PHE 18 27.709 26.512 25.254 141 HE1 PHE 18 HE2 PHE 18 24.052 24.097 27.607 142 HE2 PHE 18 HE1 PHE 18 26.979 27.237 27.520 143 HZ PHE 18 HZ PHE 18 25.157 26.061 28.679 144 H SER 19 H SER 19 27.385 20.936 22.773 145 HA SER 19 HA SER 19 28.723 21.603 20.190 146 HB2 SER 19 HB2 SER 19 29.231 19.057 21.771 147 HB3 SER 19 HB3 SER 19 29.902 19.463 20.171 148 HG SER 19 HG SER 19 31.350 19.745 21.744 149 H TRP 20 H TRP 20 28.519 19.849 18.581 150 HA TRP 20 HA TRP 20 26.044 18.181 18.755 151 HB2 TRP 20 HB2 TRP 20 27.318 19.542 16.361 152 HB3 TRP 20 HB3 TRP 20 26.165 18.234 16.215 153 HD1 TRP 20 HD1 TRP 20 24.206 19.573 18.627 154 HE1 TRP 20 HE1 TRP 20 22.430 21.157 17.617 155 HE3 TRP 20 HE3 TRP 20 26.642 20.967 14.337 156 HZ2 TRP 20 HZ2 TRP 20 22.266 23.063 15.470 157 HZ3 TRP 20 HZ3 TRP 20 25.687 22.730 12.874 158 HH2 TRP 20 HH2 TRP 20 23.521 23.786 13.434 159 H VAL 21 H VAL 21 26.178 16.136 17.714 160 HA VAL 21 HA VAL 21 28.562 14.587 17.846 161 HB VAL 21 HB VAL 21 26.265 13.656 17.785 162 HG11 VAL 21 HG11 VAL 21 25.056 13.372 15.685 163 HG12 VAL 21 HG12 VAL 21 25.285 15.096 15.995 164 HG13 VAL 21 HG13 VAL 21 26.293 14.261 14.793 165 HG21 VAL 21 HG21 VAL 21 26.736 11.700 16.492 166 HG22 VAL 21 HG22 VAL 21 27.929 12.537 15.496 167 HG23 VAL 21 HG23 VAL 21 28.253 12.242 17.221 168 H THR 22 H THR 22 29.825 13.706 15.933 169 HA THR 22 HA THR 22 30.915 15.993 16.580 170 HB THR 22 HB THR 22 32.375 13.969 14.854 171 HG1 THR 22 HG1 THR 22 32.673 12.833 16.716 172 HG21 THR 22 HG21 THR 22 33.245 15.714 17.207 173 HG22 THR 22 HG22 THR 22 33.711 15.933 15.500 174 HG23 THR 22 HG23 THR 22 34.260 14.516 16.383 175 H CYS 23 H CYS 23 31.482 17.795 15.793 176 HA CYS 23 HA CYS 23 31.450 18.325 12.885 177 HB2 CYS 23 HB2 CYS 23 30.419 20.039 15.170 178 HB3 CYS 23 HB3 CYS 23 30.570 20.584 13.492 179 HG CYS 23 HG CYS 23 28.898 17.896 14.503 180 HA PRO 24 HA PRO 24 35.499 19.133 12.896 181 HB2 PRO 24 HB2 PRO 24 35.152 21.712 11.359 182 HB3 PRO 24 HB3 PRO 24 36.201 20.309 10.990 183 HG2 PRO 24 HG2 PRO 24 33.844 20.602 9.701 184 HG3 PRO 24 HG3 PRO 24 34.318 18.987 10.329 185 HD2 PRO 24 HD2 PRO 24 32.445 21.018 11.566 186 HD3 PRO 24 HD3 PRO 24 32.234 19.264 11.340 187 H TYR 25 H TYR 25 33.950 22.001 14.281 188 HA TYR 25 HA TYR 25 36.528 22.799 15.549 189 HB2 TYR 25 HB2 TYR 25 33.714 23.908 15.651 190 HB3 TYR 25 HB3 TYR 25 35.011 24.542 16.631 191 HD1 TYR 25 HD2 TYR 25 37.381 24.653 14.974 192 HD2 TYR 25 HD1 TYR 25 33.296 25.655 13.995 193 HE1 TYR 25 HE2 TYR 25 38.182 26.317 13.305 194 HE2 TYR 25 HE1 TYR 25 34.105 27.323 12.355 195 HH TYR 25 HH TYR 25 35.932 28.454 11.557 196 H CYS 26 H CYS 26 33.336 21.588 16.519 197 HA CYS 26 HA CYS 26 33.648 21.688 19.300 198 HB2 CYS 26 HB2 CYS 26 32.192 20.079 17.258 199 HB3 CYS 26 HB3 CYS 26 32.217 19.417 18.864 200 HG CYS 26 HG CYS 26 31.097 21.511 19.993 201 H VAL 27 H VAL 27 34.607 19.104 17.093 202 HA VAL 27 HA VAL 27 35.607 17.083 18.693 203 HB VAL 27 HB VAL 27 35.379 17.278 16.373 204 HG11 VAL 27 HG11 VAL 27 36.191 19.317 15.881 205 HG12 VAL 27 HG12 VAL 27 37.862 18.625 15.826 206 HG13 VAL 27 HG13 VAL 27 36.601 18.037 14.729 207 HG21 VAL 27 HG21 VAL 27 38.185 16.319 17.057 208 HG22 VAL 27 HG22 VAL 27 36.706 15.365 17.317 209 HG23 VAL 27 HG23 VAL 27 37.223 15.761 15.670 210 H ARG 28 H ARG 28 37.251 19.610 17.338 211 HA ARG 28 HA ARG 28 39.871 19.412 18.446 212 HB2 ARG 28 HB2 ARG 28 38.766 22.224 18.053 213 HB3 ARG 28 HB3 ARG 28 40.425 21.659 17.928 214 HG2 ARG 28 HG2 ARG 28 39.671 20.291 15.904 215 HG3 ARG 28 HG3 ARG 28 38.132 21.163 16.034 216 HD2 ARG 28 HD2 ARG 28 39.285 23.304 15.696 217 HD3 ARG 28 HD3 ARG 28 40.847 22.458 15.618 218 HE ARG 28 HE ARG 28 38.929 21.346 13.754 219 HH11 ARG 28 HH12 ARG 28 41.050 24.176 13.943 220 HH12 ARG 28 HH11 ARG 28 41.192 24.223 12.193 221 HH21 ARG 28 HH22 ARG 28 39.423 21.313 11.726 222 HH22 ARG 28 HH21 ARG 28 40.272 22.639 10.934 223 H ALA 29 H ALA 29 37.336 21.555 19.778 224 HA ALA 29 HA ALA 29 38.828 22.209 22.139 225 HB1 ALA 29 HB1 ALA 29 37.023 23.630 21.287 226 HB2 ALA 29 HB2 ALA 29 35.826 22.352 21.611 227 HB3 ALA 29 HB3 ALA 29 36.693 23.132 22.959 228 H GLU 30 H GLU 30 36.156 19.811 21.645 229 HA GLU 30 HA GLU 30 36.129 18.802 24.327 230 HB2 GLU 30 HB2 GLU 30 35.473 17.489 21.636 231 HB3 GLU 30 HB3 GLU 30 35.150 16.757 23.200 232 HG2 GLU 30 HG2 GLU 30 33.666 18.690 23.789 233 HG3 GLU 30 HG3 GLU 30 33.893 19.347 22.159 234 H LYS 31 H LYS 31 38.316 17.987 21.671 235 HA LYS 31 HA LYS 31 39.503 15.756 23.048 236 HB2 LYS 31 HB2 LYS 31 39.587 15.942 20.615 237 HB3 LYS 31 HB3 LYS 31 40.285 17.547 20.718 238 HG2 LYS 31 HG2 LYS 31 42.395 16.527 21.676 239 HG3 LYS 31 HG3 LYS 31 41.660 14.929 21.440 240 HD2 LYS 31 HD2 LYS 31 43.112 15.448 19.561 241 HD3 LYS 31 HD3 LYS 31 41.415 15.447 19.013 242 HE2 LYS 31 HE2 LYS 31 41.314 17.812 18.913 243 HE3 LYS 31 HE3 LYS 31 42.826 18.017 19.820 244 HZ1 LYS 31 HZ1 LYS 31 42.708 16.745 17.142 245 HZ2 LYS 31 HZ2 LYS 31 42.969 18.343 17.365 246 HZ3 LYS 31 HZ3 LYS 31 44.056 17.265 17.939 247 H LEU 32 H LEU 32 40.540 19.109 22.486 248 HA LEU 32 HA LEU 32 42.980 19.175 23.895 249 HB2 LEU 32 HB2 LEU 32 41.985 20.769 22.247 250 HB3 LEU 32 HB3 LEU 32 40.868 21.277 23.505 251 HG LEU 32 HG LEU 32 42.642 22.844 22.997 252 HD11 LEU 32 HD11 LEU 32 43.246 23.547 25.182 253 HD12 LEU 32 HD12 LEU 32 41.619 22.851 25.265 254 HD13 LEU 32 HD13 LEU 32 43.026 21.929 25.855 255 HD21 LEU 32 HD21 LEU 32 44.957 22.533 23.650 256 HD22 LEU 32 HD22 LEU 32 44.608 20.862 24.166 257 HD23 LEU 32 HD23 LEU 32 44.460 21.325 22.459 258 H LEU 33 H LEU 33 39.681 19.933 25.043 259 HA LEU 33 HA LEU 33 40.406 20.829 27.616 260 HB2 LEU 33 HB2 LEU 33 37.860 19.621 26.434 261 HB3 LEU 33 HB3 LEU 33 37.877 20.272 28.058 262 HG LEU 33 HG LEU 33 38.663 21.889 25.611 263 HD11 LEU 33 HD11 LEU 33 36.019 22.169 26.991 264 HD12 LEU 33 HD12 LEU 33 36.592 22.938 25.513 265 HD13 LEU 33 HD13 LEU 33 36.264 21.201 25.513 266 HD21 LEU 33 HD21 LEU 33 39.569 22.870 27.634 267 HD22 LEU 33 HD22 LEU 33 38.175 23.835 27.142 268 HD23 LEU 33 HD23 LEU 33 38.003 22.682 28.474 269 H HIS 34 H HIS 34 39.550 17.533 26.601 270 HA HIS 34 HA HIS 34 40.040 16.352 29.225 271 HB2 HIS 34 HB2 HIS 34 39.521 15.262 26.441 272 HB3 HIS 34 HB3 HIS 34 40.054 14.215 27.755 273 HD1 HIS 34 HD1 HIS 34 38.221 13.399 29.432 274 HD2 HIS 34 HD2 HIS 34 37.086 16.652 27.012 275 HE1 HIS 34 HE1 HIS 34 35.759 13.839 29.916 276 H ALA 35 H ALA 35 42.023 16.982 26.263 277 HA ALA 35 HA ALA 35 44.157 15.235 27.107 278 HB1 ALA 35 HB1 ALA 35 45.453 16.387 25.364 279 HB2 ALA 35 HB2 ALA 35 43.837 15.965 24.775 280 HB3 ALA 35 HB3 ALA 35 44.206 17.643 25.236 281 H ARG 36 H ARG 36 43.363 18.558 27.853 282 HA ARG 36 HA ARG 36 45.931 19.022 29.281 283 HB2 ARG 36 HB2 ARG 36 43.868 20.981 28.212 284 HB3 ARG 36 HB3 ARG 36 45.431 21.333 28.935 285 HG2 ARG 36 HG2 ARG 36 45.043 19.814 26.331 286 HG3 ARG 36 HG3 ARG 36 45.393 21.538 26.439 287 HD2 ARG 36 HD2 ARG 36 47.565 21.195 27.234 288 HD3 ARG 36 HD3 ARG 36 47.253 19.529 27.708 289 HE ARG 36 HE ARG 36 47.456 20.489 24.872 290 HH11 ARG 36 HH22 ARG 36 48.176 17.907 27.167 291 HH12 ARG 36 HH21 ARG 36 48.409 16.742 25.897 292 HH21 ARG 36 HH12 ARG 36 47.833 18.991 23.327 293 HH22 ARG 36 HH11 ARG 36 48.381 17.389 23.762 294 H THR 37 H THR 37 43.321 17.944 30.389 295 HA THR 37 HA THR 37 42.695 17.472 32.534 296 HB THR 37 HB THR 37 43.900 19.768 33.889 297 HG1 THR 37 HG1 THR 37 45.526 17.722 32.788 298 HG21 THR 37 HG21 THR 37 44.465 18.115 35.612 299 HG22 THR 37 HG22 THR 37 44.179 16.771 34.486 300 HG23 THR 37 HG23 THR 37 42.832 17.758 35.063 301 H LYS 38 H LYS 38 41.326 19.603 30.804 302 HA LYS 38 HA LYS 38 40.381 21.515 32.840 303 HB2 LYS 38 HB2 LYS 38 39.565 21.062 29.962 304 HB3 LYS 38 HB3 LYS 38 38.633 22.033 31.091 305 HG2 LYS 38 HG2 LYS 38 40.011 23.545 29.863 306 HG3 LYS 38 HG3 LYS 38 40.603 23.503 31.496 307 HD2 LYS 38 HD2 LYS 38 42.095 21.608 29.784 308 HD3 LYS 38 HD3 LYS 38 42.073 23.227 29.089 309 HE2 LYS 38 HE2 LYS 38 42.735 24.077 31.461 310 HE3 LYS 38 HE3 LYS 38 43.071 22.379 31.812 311 HZ1 LYS 38 HZ1 LYS 38 44.755 22.303 30.262 312 HZ2 LYS 38 HZ2 LYS 38 44.536 23.819 29.648 313 HZ3 LYS 38 HZ3 LYS 38 45.062 23.535 31.191 314 H ASP 39 H ASP 39 39.126 20.983 34.376 315 HA ASP 39 HA ASP 39 37.298 18.826 34.431 316 HB2 ASP 39 HB2 ASP 39 38.065 20.124 36.474 317 HB3 ASP 39 HB3 ASP 39 37.130 21.499 35.932 318 H ILE 40 H ILE 40 35.980 18.613 32.740 319 HA ILE 40 HA ILE 40 34.372 20.939 31.810 320 HB ILE 40 HB ILE 40 36.449 20.478 30.541 321 HG12 ILE 40 HG12 ILE 40 33.865 21.135 29.564 322 HG13 ILE 40 HG13 ILE 40 35.437 21.626 29.009 323 HG21 ILE 40 HG21 ILE 40 36.686 18.565 29.079 324 HG22 ILE 40 HG22 ILE 40 36.460 18.002 30.727 325 HG23 ILE 40 HG23 ILE 40 35.120 17.910 29.590 326 HD11 ILE 40 HD11 ILE 40 35.508 19.753 27.405 327 HD12 ILE 40 HD12 ILE 40 33.947 19.153 28.033 328 HD13 ILE 40 HD13 ILE 40 34.035 20.709 27.198 329 H THR 41 H THR 41 32.394 20.780 31.236 330 HA THR 41 HA THR 41 31.061 18.123 30.861 331 HB THR 41 HB THR 41 30.201 20.613 32.365 332 HG1 THR 41 HG1 THR 41 29.605 18.418 33.621 333 HG21 THR 41 HG21 THR 41 27.995 19.521 32.691 334 HG22 THR 41 HG22 THR 41 28.422 18.328 31.436 335 HG23 THR 41 HG23 THR 41 28.277 20.069 31.045 336 H VAL 42 H VAL 42 30.489 17.954 28.712 337 HA VAL 42 HA VAL 42 29.498 20.392 27.369 338 HB VAL 42 HB VAL 42 31.110 19.882 26.012 339 HG11 VAL 42 HG11 VAL 42 32.137 18.127 27.066 340 HG12 VAL 42 HG12 VAL 42 30.914 16.947 26.472 341 HG13 VAL 42 HG13 VAL 42 32.027 17.771 25.348 342 HG21 VAL 42 HG21 VAL 42 29.100 19.791 24.616 343 HG22 VAL 42 HG22 VAL 42 30.410 18.800 23.966 344 HG23 VAL 42 HG23 VAL 42 29.061 18.017 24.804 345 H HIS 43 H HIS 43 27.597 20.616 26.588 346 HA HIS 43 HA HIS 43 25.579 18.456 26.948 347 HB2 HIS 43 HB2 HIS 43 25.258 20.738 27.999 348 HB3 HIS 43 HB3 HIS 43 25.187 21.409 26.384 349 HD1 HIS 43 HD1 HIS 43 23.320 18.110 27.271 350 HD2 HIS 43 HD2 HIS 43 22.649 22.226 26.657 351 HE1 HIS 43 HE1 HIS 43 20.811 18.430 27.232 352 H TYR 44 H TYR 44 24.816 17.413 25.209 353 HA TYR 44 HA TYR 44 25.709 18.272 22.516 354 HB2 TYR 44 HB2 TYR 44 24.686 15.660 23.639 355 HB3 TYR 44 HB3 TYR 44 25.008 15.929 21.935 356 HD1 TYR 44 HD2 TYR 44 27.498 17.334 21.725 357 HD2 TYR 44 HD1 TYR 44 26.344 14.259 24.525 358 HE1 TYR 44 HE2 TYR 44 29.891 16.761 22.088 359 HE2 TYR 44 HE1 TYR 44 28.742 13.665 24.845 360 HH TYR 44 HH TYR 44 31.369 15.480 23.197 361 H VAL 45 H VAL 45 24.377 19.782 21.738 362 HA VAL 45 HA VAL 45 21.541 19.616 22.353 363 HB VAL 45 HB VAL 45 21.252 21.803 21.387 364 HG11 VAL 45 HG11 VAL 45 23.644 21.628 23.245 365 HG12 VAL 45 HG12 VAL 45 22.534 23.006 23.052 366 HG13 VAL 45 HG13 VAL 45 21.935 21.493 23.742 367 HG21 VAL 45 HG21 VAL 45 22.869 21.858 19.594 368 HG22 VAL 45 HG22 VAL 45 23.246 23.143 20.736 369 HG23 VAL 45 HG23 VAL 45 24.228 21.666 20.726 370 H ASP 46 H ASP 46 22.980 17.882 20.090 371 HA ASP 46 HA ASP 46 20.430 17.801 18.519 372 HB2 ASP 46 HB2 ASP 46 22.312 18.274 17.076 373 HB3 ASP 46 HB3 ASP 46 23.176 16.858 17.653 374 H LYS 47 H LYS 47 22.604 15.950 20.645 375 HA LYS 47 HA LYS 47 20.920 13.568 20.722 376 HB2 LYS 47 HB2 LYS 47 22.667 14.848 22.866 377 HB3 LYS 47 HB3 LYS 47 21.891 13.295 23.029 378 HG2 LYS 47 HG2 LYS 47 23.946 13.939 20.877 379 HG3 LYS 47 HG3 LYS 47 24.350 13.237 22.436 380 HD2 LYS 47 HD2 LYS 47 22.495 11.940 20.401 381 HD3 LYS 47 HD3 LYS 47 24.216 11.593 20.566 382 HE2 LYS 47 HE2 LYS 47 23.941 10.777 22.833 383 HE3 LYS 47 HE3 LYS 47 22.245 11.273 22.870 384 HZ1 LYS 47 HZ1 LYS 47 22.536 8.894 22.426 385 HZ2 LYS 47 HZ2 LYS 47 21.727 9.635 21.212 386 HZ3 LYS 47 HZ3 LYS 47 23.310 9.231 21.009 387 H MET 48 H MET 48 20.815 16.734 22.275 388 HA MET 48 HA MET 48 18.444 16.125 23.880 389 HB2 MET 48 HB2 MET 48 20.393 17.573 24.581 390 HB3 MET 48 HB3 MET 48 19.887 18.748 23.367 391 HG2 MET 48 HG2 MET 48 19.055 19.499 25.425 392 HG3 MET 48 HG3 MET 48 17.663 18.889 24.531 393 HE1 MET 48 HE1 MET 48 18.487 19.579 27.679 394 HE2 MET 48 HE2 MET 48 16.766 19.240 27.409 395 HE3 MET 48 HE3 MET 48 17.660 18.340 28.650 396 H SER 49 H SER 49 16.455 16.012 22.846 397 HA SER 49 HA SER 49 15.747 17.389 20.443 398 HB2 SER 49 HB2 SER 49 13.942 16.278 22.612 399 HB3 SER 49 HB3 SER 49 13.471 16.681 20.949 400 HG SER 49 HG SER 49 14.057 14.405 21.470 401 H GLU 50 H GLU 50 15.557 18.402 23.803 402 HA GLU 50 HA GLU 50 14.169 20.881 23.421 403 HB2 GLU 50 HB2 GLU 50 14.767 19.596 25.593 404 HB3 GLU 50 HB3 GLU 50 16.362 20.346 25.479 405 HG2 GLU 50 HG2 GLU 50 15.540 22.494 25.952 406 HG3 GLU 50 HG3 GLU 50 13.883 22.061 25.524 407 H GLY 51 H GLY 51 17.263 19.967 22.316 408 HA2 GLY 51 HA2 GLY 51 19.002 22.008 22.809 409 HA3 GLY 51 HA3 GLY 51 18.978 21.036 21.343 410 H GLU 52 H GLU 52 16.258 22.337 20.621 411 HA GLU 52 HA GLU 52 17.347 24.582 19.070 412 HB2 GLU 52 HB2 GLU 52 14.518 23.550 19.543 413 HB3 GLU 52 HB3 GLU 52 14.896 24.932 18.502 414 HG2 GLU 52 HG2 GLU 52 16.274 23.547 17.043 415 HG3 GLU 52 HG3 GLU 52 16.053 22.141 18.094 416 H GLN 53 H GLN 53 15.561 24.281 22.148 417 HA GLN 53 HA GLN 53 15.129 27.139 22.495 418 HB2 GLN 53 HB2 GLN 53 13.716 25.482 23.621 419 HB3 GLN 53 HB3 GLN 53 15.114 24.821 24.487 420 HG2 GLN 53 HG2 GLN 53 15.430 26.920 25.699 421 HG3 GLN 53 HG3 GLN 53 14.195 27.710 24.725 422 HE21 GLN 53 HE21 GLN 53 13.651 28.204 27.089 423 HE22 GLN 53 HE22 GLN 53 12.379 27.182 27.754 424 H LEU 54 H LEU 54 17.624 24.790 23.591 425 HA LEU 54 HA LEU 54 19.123 26.757 25.079 426 HB2 LEU 54 HB2 LEU 54 20.116 24.104 23.967 427 HB3 LEU 54 HB3 LEU 54 20.891 25.094 25.174 428 HG LEU 54 HG LEU 54 20.021 23.626 26.631 429 HD11 LEU 54 HD11 LEU 54 18.573 25.682 27.140 430 HD12 LEU 54 HD12 LEU 54 17.289 24.884 26.212 431 HD13 LEU 54 HD13 LEU 54 17.953 24.122 27.666 432 HD21 LEU 54 HD21 LEU 54 19.360 22.078 24.987 433 HD22 LEU 54 HD22 LEU 54 18.141 22.164 26.262 434 HD23 LEU 54 HD23 LEU 54 17.836 22.973 24.709 435 H ARG 55 H ARG 55 19.420 25.557 21.710 436 HA ARG 55 HA ARG 55 21.637 27.179 20.866 437 HB2 ARG 55 HB2 ARG 55 19.167 26.069 19.468 438 HB3 ARG 55 HB3 ARG 55 20.329 27.075 18.604 439 HG2 ARG 55 HG2 ARG 55 22.089 25.517 18.845 440 HG3 ARG 55 HG3 ARG 55 21.268 24.626 20.120 441 HD2 ARG 55 HD2 ARG 55 21.274 23.411 17.977 442 HD3 ARG 55 HD3 ARG 55 19.653 23.721 18.598 443 HE ARG 55 HE ARG 55 20.480 25.755 16.664 444 HH11 ARG 55 HH22 ARG 55 19.389 22.420 16.713 445 HH12 ARG 55 HH21 ARG 55 18.393 22.652 15.287 446 HH21 ARG 55 HH12 ARG 55 19.486 25.878 14.790 447 HH22 ARG 55 HH11 ARG 55 18.597 24.516 14.123 448 H GLY 56 H GLY 56 18.152 27.965 21.080 449 HA2 GLY 56 HA2 GLY 56 18.251 30.591 20.031 450 HA3 GLY 56 HA3 GLY 56 17.093 29.994 21.231 451 H GLU 57 H GLU 57 18.901 29.486 23.421 452 HA GLU 57 HA GLU 57 19.213 32.121 24.534 453 HB2 GLU 57 HB2 GLU 57 20.397 29.473 25.389 454 HB3 GLU 57 HB3 GLU 57 20.530 30.973 26.300 455 HG2 GLU 57 HG2 GLU 57 17.929 29.562 25.566 456 HG3 GLU 57 HG3 GLU 57 18.734 29.576 27.124 457 H ILE 58 H ILE 58 21.580 29.963 22.927 458 HA ILE 58 HA ILE 58 23.824 31.772 23.302 459 HB ILE 58 HB ILE 58 23.526 29.658 21.134 460 HG12 ILE 58 HG12 ILE 58 24.728 29.313 23.926 461 HG13 ILE 58 HG13 ILE 58 23.168 28.668 23.420 462 HG21 ILE 58 HG21 ILE 58 25.968 29.698 21.081 463 HG22 ILE 58 HG22 ILE 58 25.407 31.346 20.895 464 HG23 ILE 58 HG23 ILE 58 26.029 30.812 22.469 465 HD11 ILE 58 HD11 ILE 58 24.733 26.883 23.331 466 HD12 ILE 58 HD12 ILE 58 24.300 27.304 21.663 467 HD13 ILE 58 HD13 ILE 58 25.868 27.811 22.341 468 H TYR 59 H TYR 59 21.463 31.249 20.624 469 HA TYR 59 HA TYR 59 22.653 33.121 18.881 470 HB2 TYR 59 HB2 TYR 59 20.756 31.308 18.519 471 HB3 TYR 59 HB3 TYR 59 19.693 32.694 18.718 472 HD1 TYR 59 HD2 TYR 59 20.165 34.782 17.181 473 HD2 TYR 59 HD1 TYR 59 21.980 30.932 16.591 474 HE1 TYR 59 HE2 TYR 59 20.825 35.455 14.867 475 HE2 TYR 59 HE1 TYR 59 22.613 31.576 14.258 476 HH TYR 59 HH TYR 59 21.822 34.789 12.906 477 H GLN 60 H GLN 60 20.007 33.683 21.273 478 HA GLN 60 HA GLN 60 19.595 36.387 20.450 479 HB2 GLN 60 HB2 GLN 60 18.985 35.029 23.106 480 HB3 GLN 60 HB3 GLN 60 18.435 36.649 22.675 481 HG2 GLN 60 HG2 GLN 60 17.697 34.089 21.193 482 HG3 GLN 60 HG3 GLN 60 16.677 34.948 22.322 483 HE21 GLN 60 HE21 GLN 60 15.756 34.337 19.795 484 HE22 GLN 60 HE22 GLN 60 15.649 35.798 18.840 485 H ALA 61 H ALA 61 21.975 35.053 22.718 486 HA ALA 61 HA ALA 61 22.877 37.729 23.540 487 HB1 ALA 61 HB1 ALA 61 22.970 35.928 25.130 488 HB2 ALA 61 HB2 ALA 61 23.946 34.932 24.029 489 HB3 ALA 61 HB3 ALA 61 24.623 36.422 24.725 490 H TYR 62 H TYR 62 24.143 35.131 21.368 491 HA TYR 62 HA TYR 62 26.422 36.923 20.689 492 HB2 TYR 62 HB2 TYR 62 26.299 33.899 20.761 493 HB3 TYR 62 HB3 TYR 62 27.730 34.882 20.483 494 HD1 TYR 62 HD2 TYR 62 28.189 36.747 22.366 495 HD2 TYR 62 HD1 TYR 62 25.940 33.122 22.965 496 HE1 TYR 62 HE2 TYR 62 28.534 36.935 24.819 497 HE2 TYR 62 HE1 TYR 62 26.312 33.304 25.430 498 HH TYR 62 HH TYR 62 28.056 36.090 26.858 499 H LYS 63 H LYS 63 23.702 35.763 19.158 500 HA LYS 63 HA LYS 63 23.065 35.182 17.118 501 HB2 LYS 63 HB2 LYS 63 24.929 37.454 16.446 502 HB3 LYS 63 HB3 LYS 63 23.892 36.700 15.233 503 HG2 LYS 63 HG2 LYS 63 22.023 37.709 15.978 504 HG3 LYS 63 HG3 LYS 63 22.327 37.253 17.641 505 HD2 LYS 63 HD2 LYS 63 22.243 39.572 17.670 506 HD3 LYS 63 HD3 LYS 63 23.959 39.165 17.827 507 HE2 LYS 63 HE2 LYS 63 24.264 39.617 15.386 508 HE3 LYS 63 HE3 LYS 63 22.530 39.969 15.247 509 HZ1 LYS 63 HZ1 LYS 63 22.878 41.779 16.881 510 HZ2 LYS 63 HZ2 LYS 63 24.499 41.508 16.853 511 HZ3 LYS 63 HZ3 LYS 63 23.711 42.030 15.490 512 H HIS 64 H HIS 64 24.682 33.363 18.071 513 HA HIS 64 HA HIS 64 25.272 31.923 15.590 514 HB2 HIS 64 HB2 HIS 64 27.182 31.977 17.972 515 HB3 HIS 64 HB3 HIS 64 27.229 30.786 16.674 516 HD1 HIS 64 HD1 HIS 64 27.777 31.835 14.143 517 HD2 HIS 64 HD2 HIS 64 28.577 34.168 17.549 518 HE1 HIS 64 HE1 HIS 64 29.398 33.664 13.399 519 H GLU 65 H GLU 65 24.886 29.679 15.830 520 HA GLU 65 HA GLU 65 23.591 28.817 18.405 521 HB2 GLU 65 HB2 GLU 65 22.438 27.100 17.169 522 HB3 GLU 65 HB3 GLU 65 22.035 28.708 16.585 523 HG2 GLU 65 HG2 GLU 65 23.574 28.367 14.640 524 HG3 GLU 65 HG3 GLU 65 23.933 26.737 15.232 525 H THR 66 H THR 66 26.195 28.108 16.130 526 HA THR 66 HA THR 66 27.451 26.548 18.278 527 HB THR 66 HB THR 66 28.393 24.877 16.674 528 HG1 THR 66 HG1 THR 66 26.858 24.521 14.873 529 HG21 THR 66 HG21 THR 66 25.364 24.689 16.852 530 HG22 THR 66 HG22 THR 66 26.474 24.313 18.186 531 HG23 THR 66 HG23 THR 66 26.534 23.360 16.697 532 H VAL 67 H VAL 67 29.659 26.526 18.197 533 HA VAL 67 HA VAL 67 31.184 28.157 16.307 534 HB VAL 67 HB VAL 67 30.875 29.028 19.193 535 HG11 VAL 67 HG11 VAL 67 33.301 29.045 18.714 536 HG12 VAL 67 HG12 VAL 67 33.000 29.904 17.190 537 HG13 VAL 67 HG13 VAL 67 32.670 30.687 18.747 538 HG21 VAL 67 HG21 VAL 67 29.268 30.062 17.729 539 HG22 VAL 67 HG22 VAL 67 30.494 31.251 18.156 540 HG23 VAL 67 HG23 VAL 67 30.535 30.485 16.554 541 HA PRO 68 HA PRO 68 30.236 25.954 19.574 542 HB2 PRO 68 HB2 PRO 68 31.304 24.658 21.645 543 HB3 PRO 68 HB3 PRO 68 31.101 23.878 20.063 544 HG2 PRO 68 HG2 PRO 68 33.617 25.229 21.122 545 HG3 PRO 68 HG3 PRO 68 33.460 23.556 20.500 546 HD2 PRO 68 HD2 PRO 68 34.254 25.604 18.893 547 HD3 PRO 68 HD3 PRO 68 33.183 24.314 18.271 548 H ALA 69 H ALA 69 29.604 26.685 21.706 549 HA ALA 69 HA ALA 69 31.003 29.173 22.533 550 HB1 ALA 69 HB1 ALA 69 28.595 29.318 22.019 551 HB2 ALA 69 HB2 ALA 69 28.250 28.070 23.239 552 HB3 ALA 69 HB3 ALA 69 28.904 29.646 23.732 553 H ILE 70 H ILE 70 32.124 29.309 24.398 554 HA ILE 70 HA ILE 70 32.281 26.898 26.161 555 HB ILE 70 HB ILE 70 34.512 28.665 25.076 556 HG12 ILE 70 HG12 ILE 70 34.174 25.703 24.474 557 HG13 ILE 70 HG13 ILE 70 33.448 26.924 23.442 558 HG21 ILE 70 HG21 ILE 70 35.054 27.905 27.333 559 HG22 ILE 70 HG22 ILE 70 34.642 26.230 26.909 560 HG23 ILE 70 HG23 ILE 70 36.047 27.030 26.178 561 HD11 ILE 70 HD11 ILE 70 35.561 26.249 22.503 562 HD12 ILE 70 HD12 ILE 70 35.633 27.949 23.001 563 HD13 ILE 70 HD13 ILE 70 36.415 26.697 23.987 564 H PHE 71 H PHE 71 32.143 27.287 28.289 565 HA PHE 71 HA PHE 71 32.405 30.104 29.245 566 HB2 PHE 71 HB2 PHE 71 30.280 28.087 29.997 567 HB3 PHE 71 HB3 PHE 71 30.469 29.704 30.665 568 HD1 PHE 71 HD1 PHE 71 29.569 27.764 27.627 569 HD2 PHE 71 HD2 PHE 71 29.648 31.672 29.450 570 HE1 PHE 71 HE1 PHE 71 28.118 28.645 25.819 571 HE2 PHE 71 HE2 PHE 71 28.164 32.536 27.636 572 HZ PHE 71 HZ PHE 71 27.391 30.999 25.830 573 H ILE 72 H ILE 72 33.452 30.429 31.119 574 HA ILE 72 HA ILE 72 34.202 28.095 32.827 575 HB ILE 72 HB ILE 72 36.192 30.202 31.879 576 HG12 ILE 72 HG12 ILE 72 35.772 27.328 30.985 577 HG13 ILE 72 HG13 ILE 72 35.717 28.777 29.990 578 HG21 ILE 72 HG21 ILE 72 36.615 29.334 34.170 579 HG22 ILE 72 HG22 ILE 72 36.512 27.670 33.574 580 HG23 ILE 72 HG23 ILE 72 37.828 28.741 33.057 581 HD11 ILE 72 HD11 ILE 72 38.174 29.096 30.379 582 HD12 ILE 72 HD12 ILE 72 38.201 27.514 31.208 583 HD13 ILE 72 HD13 ILE 72 37.748 27.614 29.504 584 H ASN 73 H ASN 73 33.599 28.515 34.858 585 HA ASN 73 HA ASN 73 32.759 29.612 36.654 586 HB2 ASN 73 HB2 ASN 73 35.237 31.311 36.171 587 HB3 ASN 73 HB3 ASN 73 34.257 31.404 37.628 588 HD21 ASN 73 HD21 ASN 73 37.051 30.689 37.498 589 HD22 ASN 73 HD22 ASN 73 37.124 29.068 38.188 590 H GLY 74 H GLY 74 31.359 30.275 34.371 591 HA2 GLY 74 HA2 GLY 74 29.663 31.744 33.730 592 HA3 GLY 74 HA3 GLY 74 30.014 32.719 35.126 593 H ASN 75 H ASN 75 32.793 32.358 33.131 594 HA ASN 75 HA ASN 75 32.383 34.999 31.801 595 HB2 ASN 75 HB2 ASN 75 34.888 33.273 32.002 596 HB3 ASN 75 HB3 ASN 75 34.813 34.917 31.426 597 HD21 ASN 75 HD21 ASN 75 35.020 32.917 34.223 598 HD22 ASN 75 HD22 ASN 75 35.357 34.288 35.300 599 H PHE 76 H PHE 76 32.316 35.130 29.503 600 HA PHE 76 HA PHE 76 32.002 32.555 28.049 601 HB2 PHE 76 HB2 PHE 76 30.115 34.031 27.808 602 HB3 PHE 76 HB3 PHE 76 31.159 35.389 27.417 603 HD1 PHE 76 HD2 PHE 76 30.701 31.842 26.127 604 HD2 PHE 76 HD1 PHE 76 31.121 36.029 25.177 605 HE1 PHE 76 HE2 PHE 76 30.582 31.317 23.715 606 HE2 PHE 76 HE1 PHE 76 31.006 35.489 22.763 607 HZ PHE 76 HZ PHE 76 30.728 33.133 22.023 608 H ILE 77 H ILE 77 33.274 31.838 26.530 609 HA ILE 77 HA ILE 77 35.133 33.611 25.035 610 HB ILE 77 HB ILE 77 35.713 30.829 26.131 611 HG12 ILE 77 HG12 ILE 77 36.123 32.615 27.785 612 HG13 ILE 77 HG13 ILE 77 37.578 31.763 27.316 613 HG21 ILE 77 HG21 ILE 77 37.955 31.052 25.008 614 HG22 ILE 77 HG22 ILE 77 36.605 30.846 23.895 615 HG23 ILE 77 HG23 ILE 77 37.323 32.455 24.124 616 HD11 ILE 77 HD11 ILE 77 36.795 34.509 26.242 617 HD12 ILE 77 HD12 ILE 77 37.935 34.201 27.562 618 HD13 ILE 77 HD13 ILE 77 38.313 33.642 25.928 619 H GLY 78 H GLY 78 34.870 33.416 22.886 620 HA2 GLY 78 HA2 GLY 78 33.593 30.915 21.786 621 HA3 GLY 78 HA3 GLY 78 33.396 32.499 21.050 622 H GLY 79 H GLY 79 35.099 29.698 20.899 623 HA2 GLY 79 HA2 GLY 79 36.047 29.626 18.544 624 HA3 GLY 79 HA3 GLY 79 37.177 30.848 19.102 625 H CYS 80 H CYS 80 37.259 27.797 18.268 626 HA CYS 80 HA CYS 80 38.376 26.362 20.481 627 HB2 CYS 80 HB2 CYS 80 38.807 26.054 17.470 628 HB3 CYS 80 HB3 CYS 80 39.327 24.881 18.698 629 HG CYS 80 HG CYS 80 36.313 25.991 17.954 630 H SER 81 H SER 81 39.958 28.416 18.023 631 HA SER 81 HA SER 81 42.623 28.125 19.080 632 HB2 SER 81 HB2 SER 81 42.984 30.241 17.687 633 HB3 SER 81 HB3 SER 81 42.443 28.792 16.822 634 HG SER 81 HG SER 81 41.326 30.748 16.261 635 H ASP 82 H ASP 82 39.966 30.347 19.700 636 HA ASP 82 HA ASP 82 41.284 32.227 21.338 637 HB2 ASP 82 HB2 ASP 82 38.767 31.835 20.248 638 HB3 ASP 82 HB3 ASP 82 38.418 31.621 21.941 639 H LEU 83 H LEU 83 39.747 29.163 22.187 640 HA LEU 83 HA LEU 83 40.186 29.245 25.050 641 HB2 LEU 83 HB2 LEU 83 38.506 27.790 24.145 642 HB3 LEU 83 HB3 LEU 83 39.620 27.103 22.973 643 HG LEU 83 HG LEU 83 40.882 25.980 24.824 644 HD11 LEU 83 HD11 LEU 83 39.802 25.753 27.025 645 HD12 LEU 83 HD12 LEU 83 40.243 27.435 26.713 646 HD13 LEU 83 HD13 LEU 83 38.549 26.923 26.546 647 HD21 LEU 83 HD21 LEU 83 37.945 25.240 24.789 648 HD22 LEU 83 HD22 LEU 83 39.099 24.860 23.488 649 HD23 LEU 83 HD23 LEU 83 39.348 24.195 25.100 650 H GLU 84 H GLU 84 42.025 27.694 22.353 651 HA GLU 84 HA GLU 84 44.062 26.596 24.072 652 HB2 GLU 84 HB2 GLU 84 44.038 27.215 21.089 653 HB3 GLU 84 HB3 GLU 84 45.436 26.515 21.935 654 HG2 GLU 84 HG2 GLU 84 44.123 24.627 22.693 655 HG3 GLU 84 HG3 GLU 84 42.691 25.256 21.867 656 H ALA 85 H ALA 85 43.701 29.769 22.571 657 HA ALA 85 HA ALA 85 46.353 30.660 22.754 658 HB1 ALA 85 HB1 ALA 85 44.545 31.870 21.562 659 HB2 ALA 85 HB2 ALA 85 43.689 32.170 23.083 660 HB3 ALA 85 HB3 ALA 85 45.251 32.952 22.772 661 H LEU 86 H LEU 86 43.844 30.524 25.274 662 HA LEU 86 HA LEU 86 45.485 31.804 27.334 663 HB2 LEU 86 HB2 LEU 86 42.875 30.229 27.410 664 HB3 LEU 86 HB3 LEU 86 43.632 30.915 28.845 665 HG LEU 86 HG LEU 86 42.705 32.553 26.441 666 HD11 LEU 86 HD11 LEU 86 41.474 32.216 29.211 667 HD12 LEU 86 HD12 LEU 86 40.901 33.302 27.926 668 HD13 LEU 86 HD13 LEU 86 40.828 31.550 27.689 669 HD21 LEU 86 HD21 LEU 86 43.005 34.470 28.019 670 HD22 LEU 86 HD22 LEU 86 43.758 33.379 29.188 671 HD23 LEU 86 HD23 LEU 86 44.527 33.703 27.606 672 H ASP 87 H ASP 87 44.998 28.491 26.255 673 HA ASP 87 HA ASP 87 46.269 27.185 28.514 674 HB2 ASP 87 HB2 ASP 87 44.737 26.163 26.714 675 HB3 ASP 87 HB3 ASP 87 46.160 26.129 25.678 676 H LYS 88 H LYS 88 47.430 28.316 25.348 677 HA LYS 88 HA LYS 88 50.251 27.783 25.759 678 HB2 LYS 88 HB2 LYS 88 48.619 29.484 23.839 679 HB3 LYS 88 HB3 LYS 88 50.369 29.626 23.897 680 HG2 LYS 88 HG2 LYS 88 49.826 28.167 22.130 681 HG3 LYS 88 HG3 LYS 88 50.651 27.248 23.380 682 HD2 LYS 88 HD2 LYS 88 48.560 26.162 24.051 683 HD3 LYS 88 HD3 LYS 88 47.636 27.217 22.953 684 HE2 LYS 88 HE2 LYS 88 48.673 26.369 21.002 685 HE3 LYS 88 HE3 LYS 88 49.863 25.453 21.946 686 HZ1 LYS 88 HZ1 LYS 88 47.847 24.180 22.833 687 HZ2 LYS 88 HZ2 LYS 88 47.017 24.768 21.505 688 HZ3 LYS 88 HZ3 LYS 88 48.354 23.848 21.329 689 H GLU 89 H GLU 89 48.259 30.669 26.481 690 HA GLU 89 HA GLU 89 50.571 32.214 27.379 691 HB2 GLU 89 HB2 GLU 89 47.572 32.650 27.452 692 HB3 GLU 89 HB3 GLU 89 48.672 33.723 28.315 693 HG2 GLU 89 HG2 GLU 89 49.909 34.230 26.299 694 HG3 GLU 89 HG3 GLU 89 48.949 33.100 25.365 695 H GLY 90 H GLY 90 49.048 29.639 28.926 696 HA2 GLY 90 HA2 GLY 90 49.555 28.776 31.011 697 HA3 GLY 90 HA3 GLY 90 50.533 30.200 31.358 698 H LYS 91 H LYS 91 47.214 30.808 30.434 699 HA LYS 91 HA LYS 91 46.604 31.742 33.205 700 HB2 LYS 91 HB2 LYS 91 45.898 32.613 30.391 701 HB3 LYS 91 HB3 LYS 91 44.822 33.001 31.721 702 HG2 LYS 91 HG2 LYS 91 46.688 34.052 32.968 703 HG3 LYS 91 HG3 LYS 91 47.783 33.702 31.629 704 HD2 LYS 91 HD2 LYS 91 45.302 35.468 31.434 705 HD3 LYS 91 HD3 LYS 91 46.934 36.072 31.751 706 HE2 LYS 91 HE2 LYS 91 47.736 35.175 29.611 707 HE3 LYS 91 HE3 LYS 91 46.129 34.514 29.257 708 HZ1 LYS 91 HZ1 LYS 91 45.260 36.764 29.253 709 HZ2 LYS 91 HZ2 LYS 91 46.726 37.402 29.603 710 HZ3 LYS 91 HZ3 LYS 91 46.486 36.637 28.163 711 H LEU 92 H LEU 92 45.748 29.211 31.092 712 HA LEU 92 HA LEU 92 43.017 28.903 32.081 713 HB2 LEU 92 HB2 LEU 92 43.926 28.333 29.763 714 HB3 LEU 92 HB3 LEU 92 44.742 26.964 30.493 715 HG LEU 92 HG LEU 92 42.621 25.965 31.140 716 HD11 LEU 92 HD11 LEU 92 40.456 26.908 30.251 717 HD12 LEU 92 HD12 LEU 92 41.148 27.824 31.577 718 HD13 LEU 92 HD13 LEU 92 41.314 28.424 29.905 719 HD21 LEU 92 HD21 LEU 92 42.582 26.953 28.243 720 HD22 LEU 92 HD22 LEU 92 43.475 25.551 28.839 721 HD23 LEU 92 HD23 LEU 92 41.703 25.542 28.853 722 H ASP 93 H ASP 93 46.211 27.713 32.914 723 HA ASP 93 HA ASP 93 45.437 25.787 34.882 724 HB2 ASP 93 HB2 ASP 93 47.835 27.649 34.578 725 HB3 ASP 93 HB3 ASP 93 47.701 26.473 35.882 726 H GLY 94 H GLY 94 45.747 29.347 35.114 727 HA2 GLY 94 HA2 GLY 94 45.100 29.591 37.916 728 HA3 GLY 94 HA3 GLY 94 44.943 30.845 36.681 729 H LEU 95 H LEU 95 43.115 29.052 35.059 730 HA LEU 95 HA LEU 95 40.574 29.590 36.427 731 HB2 LEU 95 HB2 LEU 95 41.365 28.548 33.691 732 HB3 LEU 95 HB3 LEU 95 39.698 28.646 34.231 733 HG LEU 95 HG LEU 95 41.591 31.041 34.098 734 HD11 LEU 95 HD11 LEU 95 41.220 30.204 31.833 735 HD12 LEU 95 HD12 LEU 95 39.462 30.175 32.106 736 HD13 LEU 95 HD13 LEU 95 40.348 31.713 32.079 737 HD21 LEU 95 HD21 LEU 95 39.735 31.412 35.636 738 HD22 LEU 95 HD22 LEU 95 39.494 32.364 34.173 739 HD23 LEU 95 HD23 LEU 95 38.563 30.871 34.414 740 H LEU 96 H LEU 96 42.634 26.776 35.852 741 HA LEU 96 HA LEU 96 40.675 24.941 37.074 742 HB2 LEU 96 HB2 LEU 96 43.528 24.566 36.153 743 HB3 LEU 96 HB3 LEU 96 42.556 23.243 36.802 744 HG LEU 96 HG LEU 96 42.052 24.736 34.213 745 HD11 LEU 96 HD11 LEU 96 43.721 22.960 34.129 746 HD12 LEU 96 HD12 LEU 96 42.681 21.864 35.061 747 HD13 LEU 96 HD13 LEU 96 42.212 22.319 33.440 748 HD21 LEU 96 HD21 LEU 96 39.840 24.392 35.228 749 HD22 LEU 96 HD22 LEU 96 40.084 23.307 33.894 750 HD23 LEU 96 HD23 LEU 96 40.247 22.686 35.561 751 H SER 97 H SER 97 41.714 27.242 38.556 752 HA SER 97 HA SER 97 42.739 26.243 41.100 753 HB2 SER 97 HB2 SER 97 42.609 28.677 40.163 754 HB3 SER 97 HB3 SER 97 40.923 28.645 40.717 755 HG SER 97 HG SER 97 43.357 28.556 42.118
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