NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
559670 | 2lzs | 18771 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 HCN FME 1 HCN FME 1 222.442 170.269 9.788 2 HA FME 1 HA FME 1 223.669 169.204 11.834 3 HB2 FME 1 HB2 FME 1 226.237 168.964 12.610 4 HB3 FME 1 HB1 FME 1 225.467 167.757 11.583 5 HG2 FME 1 HG2 FME 1 226.851 170.134 10.351 6 HG3 FME 1 HG1 FME 1 227.773 168.714 10.847 7 HE1 FME 1 HE1 FME 1 227.885 169.783 8.170 8 HE2 FME 1 HE2 FME 1 226.232 170.256 7.783 9 HE3 FME 1 HE3 FME 1 227.009 168.965 6.870 10 H GLY 2 HN GLY 2 226.721 170.905 11.988 11 HA2 GLY 2 HA2 GLY 2 225.676 173.453 12.749 12 HA3 GLY 2 HA1 GLY 2 226.123 172.499 14.160 13 H GLY 3 HN GLY 3 227.495 174.734 13.945 14 HA2 GLY 3 HA2 GLY 3 229.730 175.360 14.145 15 HA3 GLY 3 HA1 GLY 3 230.201 173.831 13.409 16 H ILE 4 HN ILE 4 227.771 175.481 11.694 17 HA ILE 4 HA ILE 4 229.704 176.817 9.895 18 HB ILE 4 HB ILE 4 229.197 174.588 8.961 19 HG12 ILE 4 HG12 ILE 4 227.745 176.719 7.379 20 HG13 ILE 4 HG11 ILE 4 229.500 176.704 7.550 21 HG21 ILE 4 HG21 ILE 4 226.933 174.011 8.308 22 HG22 ILE 4 HG22 ILE 4 226.334 175.579 8.847 23 HG23 ILE 4 HG23 ILE 4 226.931 174.409 10.025 24 HD11 ILE 4 HD11 ILE 4 228.689 175.553 5.471 25 HD12 ILE 4 HD12 ILE 4 227.879 174.369 6.497 26 HD13 ILE 4 HD13 ILE 4 229.637 174.509 6.528 27 H SER 5 HN SER 5 228.855 178.575 8.721 28 HA SER 5 HA SER 5 227.627 180.505 8.583 29 HB2 SER 5 HB2 SER 5 225.697 180.054 7.458 30 HB3 SER 5 HB1 SER 5 226.106 178.360 7.701 31 HG SER 5 HG SER 5 224.939 179.505 9.890 32 H ILE 6 HN ILE 6 228.140 179.244 11.323 33 HA ILE 6 HA ILE 6 226.103 179.672 13.176 34 HB ILE 6 HB ILE 6 228.062 180.358 14.713 35 HG12 ILE 6 HG12 ILE 6 229.671 179.543 12.269 36 HG13 ILE 6 HG11 ILE 6 229.452 181.216 12.782 37 HG21 ILE 6 HG21 ILE 6 227.190 178.043 14.523 38 HG22 ILE 6 HG22 ILE 6 228.934 178.069 14.779 39 HG23 ILE 6 HG23 ILE 6 228.284 177.746 13.176 40 HD11 ILE 6 HD11 ILE 6 230.748 178.990 14.376 41 HD12 ILE 6 HD12 ILE 6 230.407 180.599 15.014 42 HD13 ILE 6 HD13 ILE 6 231.552 180.401 13.687 43 H TRP 7 HN TRP 7 228.103 181.953 11.465 44 HA TRP 7 HA TRP 7 227.552 184.243 13.025 45 HB2 TRP 7 HB2 TRP 7 228.486 183.790 10.206 46 HB3 TRP 7 HB1 TRP 7 227.947 185.409 10.651 47 HD1 TRP 7 HD1 TRP 7 230.663 182.845 11.383 48 HE1 TRP 7 HE1 TRP 7 232.536 183.989 12.736 49 HE3 TRP 7 HE3 TRP 7 228.430 187.343 12.295 50 HZ2 TRP 7 HZ2 TRP 7 233.017 186.480 14.046 51 HZ3 TRP 7 HZ3 TRP 7 229.613 189.071 13.608 52 HH2 TRP 7 HH2 TRP 7 231.906 188.649 14.486 53 H GLN 8 HN GLN 8 225.651 182.570 10.620 54 HA GLN 8 HA GLN 8 223.838 184.639 9.984 55 HB2 GLN 8 HB2 GLN 8 223.645 181.635 9.949 56 HB3 GLN 8 HB1 GLN 8 222.230 182.608 9.622 57 HG2 GLN 8 HG2 GLN 8 223.541 181.955 7.573 58 HG3 GLN 8 HG1 GLN 8 223.274 183.685 7.764 59 HE21 GLN 8 HE21 GLN 8 225.139 184.712 7.046 60 HE22 GLN 8 HE22 GLN 8 226.720 184.260 7.471 61 H LEU 9 HN LEU 9 224.003 182.447 12.734 62 HA LEU 9 HA LEU 9 221.436 183.020 13.826 63 HB2 LEU 9 HB2 LEU 9 222.762 181.035 14.390 64 HB3 LEU 9 HB1 LEU 9 223.991 182.046 15.116 65 HG LEU 9 HG LEU 9 221.237 182.535 16.116 66 HD11 LEU 9 HD11 LEU 9 222.621 179.886 16.503 67 HD12 LEU 9 HD12 LEU 9 220.936 180.194 16.074 68 HD13 LEU 9 HD13 LEU 9 221.497 180.519 17.713 69 HD21 LEU 9 HD21 LEU 9 222.466 182.472 18.316 70 HD22 LEU 9 HD22 LEU 9 223.117 183.646 17.183 71 HD23 LEU 9 HD23 LEU 9 223.946 182.105 17.418 72 H LEU 10 HN LEU 10 224.706 184.425 14.298 73 HA LEU 10 HA LEU 10 224.070 186.047 16.517 74 HB2 LEU 10 HB2 LEU 10 226.170 186.196 14.361 75 HB3 LEU 10 HB1 LEU 10 226.003 187.521 15.508 76 HG LEU 10 HG LEU 10 226.110 185.607 17.326 77 HD11 LEU 10 HD11 LEU 10 227.037 183.567 16.748 78 HD12 LEU 10 HD12 LEU 10 227.849 184.205 15.317 79 HD13 LEU 10 HD13 LEU 10 226.116 183.890 15.284 80 HD21 LEU 10 HD21 LEU 10 227.801 187.354 17.084 81 HD22 LEU 10 HD22 LEU 10 228.529 186.497 15.725 82 HD23 LEU 10 HD23 LEU 10 228.590 185.799 17.345 83 H ILE 11 HN ILE 11 223.975 186.802 13.045 84 HA ILE 11 HA ILE 11 223.092 189.475 13.383 85 HB ILE 11 HB ILE 11 224.065 188.818 11.295 86 HG12 ILE 11 HG12 ILE 11 221.138 189.117 10.594 87 HG13 ILE 11 HG11 ILE 11 222.026 190.443 11.346 88 HG21 ILE 11 HG21 ILE 11 221.780 186.867 11.019 89 HG22 ILE 11 HG22 ILE 11 223.450 186.448 11.367 90 HG23 ILE 11 HG23 ILE 11 223.015 187.161 9.816 91 HD11 ILE 11 HD11 ILE 11 222.033 190.515 8.826 92 HD12 ILE 11 HD12 ILE 11 222.954 189.009 8.844 93 HD13 ILE 11 HD13 ILE 11 223.645 190.469 9.549 94 H ILE 12 HN ILE 12 221.303 186.398 12.871 95 HA ILE 12 HA ILE 12 218.740 187.588 12.775 96 HB ILE 12 HB ILE 12 219.663 184.785 13.468 97 HG12 ILE 12 HG12 ILE 12 218.305 186.063 11.064 98 HG13 ILE 12 HG11 ILE 12 219.962 185.512 11.138 99 HG21 ILE 12 HG21 ILE 12 216.872 185.963 13.353 100 HG22 ILE 12 HG22 ILE 12 217.595 185.009 14.643 101 HG23 ILE 12 HG23 ILE 12 217.156 184.238 13.130 102 HD11 ILE 12 HD11 ILE 12 217.462 183.845 11.169 103 HD12 ILE 12 HD12 ILE 12 219.015 183.190 11.671 104 HD13 ILE 12 HD13 ILE 12 218.797 183.779 10.023 105 H ALA 13 HN ALA 13 220.621 186.259 15.486 106 HA ALA 13 HA ALA 13 218.642 186.563 17.460 107 HB1 ALA 13 HB1 ALA 13 220.616 186.647 19.040 108 HB2 ALA 13 HB2 ALA 13 221.660 186.623 17.619 109 HB3 ALA 13 HB3 ALA 13 220.594 185.258 17.953 110 H VAL 14 HN VAL 14 221.092 188.800 16.221 111 HA VAL 14 HA VAL 14 220.695 190.864 18.093 112 HB VAL 14 HB VAL 14 221.650 190.833 15.231 113 HG11 VAL 14 HG11 VAL 14 220.868 193.190 16.819 114 HG12 VAL 14 HG12 VAL 14 221.362 193.097 15.131 115 HG13 VAL 14 HG13 VAL 14 222.561 193.239 16.411 116 HG21 VAL 14 HG21 VAL 14 222.926 189.810 17.282 117 HG22 VAL 14 HG22 VAL 14 223.252 191.491 17.703 118 HG23 VAL 14 HG23 VAL 14 223.810 190.844 16.161 119 H ILE 15 HN ILE 15 219.125 190.219 14.956 120 HA ILE 15 HA ILE 15 217.489 192.514 14.956 121 HB ILE 15 HB ILE 15 217.316 189.821 13.603 122 HG12 ILE 15 HG12 ILE 15 217.503 192.631 12.557 123 HG13 ILE 15 HG11 ILE 15 218.905 191.658 12.913 124 HG21 ILE 15 HG21 ILE 15 215.260 192.040 13.641 125 HG22 ILE 15 HG22 ILE 15 214.996 190.313 13.874 126 HG23 ILE 15 HG23 ILE 15 215.395 190.934 12.275 127 HD11 ILE 15 HD11 ILE 15 216.794 190.503 11.116 128 HD12 ILE 15 HD12 ILE 15 218.536 190.215 11.122 129 HD13 ILE 15 HD13 ILE 15 217.893 191.715 10.458 130 H VAL 16 HN VAL 16 216.908 189.252 16.227 131 HA VAL 16 HA VAL 16 214.237 189.606 17.038 132 HB VAL 16 HB VAL 16 216.497 187.969 18.237 133 HG11 VAL 16 HG11 VAL 16 214.625 186.629 19.280 134 HG12 VAL 16 HG12 VAL 16 213.552 187.966 18.896 135 HG13 VAL 16 HG13 VAL 16 214.900 188.212 20.005 136 HG21 VAL 16 HG21 VAL 16 215.791 187.398 15.927 137 HG22 VAL 16 HG22 VAL 16 214.150 187.146 16.519 138 HG23 VAL 16 HG23 VAL 16 215.461 186.109 17.087 139 H VAL 17 HN VAL 17 217.274 190.216 18.811 140 HA VAL 17 HA VAL 17 216.061 191.036 21.220 141 HB VAL 17 HB VAL 17 218.787 191.632 20.053 142 HG11 VAL 17 HG11 VAL 17 219.312 192.187 22.507 143 HG12 VAL 17 HG12 VAL 17 217.569 192.328 22.733 144 HG13 VAL 17 HG13 VAL 17 218.402 193.401 21.608 145 HG21 VAL 17 HG21 VAL 17 218.364 189.276 20.585 146 HG22 VAL 17 HG22 VAL 17 217.785 189.724 22.189 147 HG23 VAL 17 HG23 VAL 17 219.481 189.960 21.767 148 H LEU 18 HN LEU 18 217.139 192.915 18.370 149 HA LEU 18 HA LEU 18 216.594 195.460 19.498 150 HB2 LEU 18 HB2 LEU 18 216.763 194.452 16.659 151 HB3 LEU 18 HB1 LEU 18 216.370 196.131 17.008 152 HG LEU 18 HG LEU 18 218.860 194.711 17.996 153 HD11 LEU 18 HD11 LEU 18 219.168 194.874 15.675 154 HD12 LEU 18 HD12 LEU 18 219.893 196.368 16.260 155 HD13 LEU 18 HD13 LEU 18 218.272 196.390 15.558 156 HD21 LEU 18 HD21 LEU 18 218.652 196.486 19.470 157 HD22 LEU 18 HD22 LEU 18 217.717 197.468 18.336 158 HD23 LEU 18 HD23 LEU 18 219.459 197.320 18.155 159 H LEU 19 HN LEU 19 214.602 193.325 17.413 160 HA LEU 19 HA LEU 19 212.389 195.089 17.279 161 HB2 LEU 19 HB2 LEU 19 212.425 192.072 17.029 162 HB3 LEU 19 HB1 LEU 19 211.113 193.131 16.515 163 HG LEU 19 HG LEU 19 213.934 193.119 15.422 164 HD11 LEU 19 HD11 LEU 19 211.288 192.271 14.280 165 HD12 LEU 19 HD12 LEU 19 212.710 191.273 14.584 166 HD13 LEU 19 HD13 LEU 19 212.742 192.487 13.311 167 HD21 LEU 19 HD21 LEU 19 212.753 194.699 13.694 168 HD22 LEU 19 HD22 LEU 19 213.407 195.343 15.195 169 HD23 LEU 19 HD23 LEU 19 211.670 195.029 15.051 170 H PHE 20 HN PHE 20 213.161 192.446 19.543 171 HA PHE 20 HA PHE 20 210.707 192.996 21.082 172 HB2 PHE 20 HB2 PHE 20 212.870 190.908 21.206 173 HB3 PHE 20 HB1 PHE 20 211.873 191.199 22.630 174 HD1 PHE 20 HD2 PHE 20 209.374 191.010 22.458 175 HD2 PHE 20 HD1 PHE 20 212.017 189.734 19.336 176 HE1 PHE 20 HE2 PHE 20 207.551 189.642 21.482 177 HE2 PHE 20 HE1 PHE 20 210.206 188.344 18.367 178 HZ PHE 20 HZ PHE 20 207.967 188.302 19.435 179 H GLY 21 HN GLY 21 213.885 194.148 20.931 180 HA2 GLY 21 HA2 GLY 21 214.955 195.728 22.249 181 HA3 GLY 21 HA1 GLY 21 213.533 195.755 23.294 182 H THR 22 HN THR 22 215.794 195.837 24.698 183 HA THR 22 HA THR 22 216.525 193.064 25.419 184 HB THR 22 HB THR 22 218.390 194.587 24.930 185 HG1 THR 22 HG1 THR 22 218.149 193.047 26.936 186 HG21 THR 22 HG21 THR 22 217.092 196.645 25.695 187 HG22 THR 22 HG22 THR 22 218.781 196.573 26.196 188 HG23 THR 22 HG23 THR 22 217.503 196.175 27.344 189 H LYS 23 HN LYS 23 215.280 196.086 26.798 190 HA LYS 23 HA LYS 23 215.149 195.172 29.483 191 HB2 LYS 23 HB2 LYS 23 214.951 197.537 28.800 192 HB3 LYS 23 HB1 LYS 23 213.364 197.195 28.118 193 HG2 LYS 23 HG2 LYS 23 212.570 196.456 30.346 194 HG3 LYS 23 HG1 LYS 23 214.153 196.821 31.027 195 HD2 LYS 23 HD2 LYS 23 212.476 198.889 29.585 196 HD3 LYS 23 HD1 LYS 23 212.363 198.626 31.323 197 HE2 LYS 23 HE2 LYS 23 214.912 198.997 31.383 198 HE3 LYS 23 HE1 LYS 23 214.747 199.606 29.738 199 HZ1 LYS 23 HZ1 LYS 23 214.389 201.044 32.016 200 HZ2 LYS 23 HZ2 LYS 23 212.802 200.721 31.501 201 HZ3 LYS 23 HZ3 LYS 23 213.895 201.499 30.459 202 H LYS 24 HN LYS 24 212.686 195.137 26.875 203 HA LYS 24 HA LYS 24 210.646 193.962 28.441 204 HB2 LYS 24 HB2 LYS 24 211.093 193.837 25.455 205 HB3 LYS 24 HB1 LYS 24 209.591 193.435 26.276 206 HG2 LYS 24 HG2 LYS 24 210.935 196.148 26.449 207 HG3 LYS 24 HG1 LYS 24 209.649 195.766 25.306 208 HD2 LYS 24 HD2 LYS 24 208.291 195.028 27.393 209 HD3 LYS 24 HD1 LYS 24 209.501 195.913 28.321 210 HE2 LYS 24 HE2 LYS 24 209.036 197.945 27.004 211 HE3 LYS 24 HE1 LYS 24 207.806 197.067 26.093 212 HZ1 LYS 24 HZ1 LYS 24 206.576 196.704 28.110 213 HZ2 LYS 24 HZ2 LYS 24 206.873 198.367 27.931 214 HZ3 LYS 24 HZ3 LYS 24 207.784 197.453 29.036 215 H LEU 25 HN LEU 25 213.159 192.582 26.351 216 HA LEU 25 HA LEU 25 212.292 189.915 26.513 217 HB2 LEU 25 HB2 LEU 25 213.935 190.614 24.868 218 HB3 LEU 25 HB1 LEU 25 215.094 191.011 26.130 219 HG LEU 25 HG LEU 25 214.007 188.226 26.241 220 HD11 LEU 25 HD11 LEU 25 215.722 187.526 24.470 221 HD12 LEU 25 HD12 LEU 25 215.722 189.214 23.953 222 HD13 LEU 25 HD13 LEU 25 214.237 188.264 23.876 223 HD21 LEU 25 HD21 LEU 25 216.802 189.416 26.392 224 HD22 LEU 25 HD22 LEU 25 216.409 187.722 26.681 225 HD23 LEU 25 HD23 LEU 25 215.798 188.967 27.766 226 H GLY 26 HN GLY 26 213.865 191.933 28.869 227 HA2 GLY 26 HA2 GLY 26 215.070 189.870 30.415 228 HA3 GLY 26 HA1 GLY 26 214.660 191.485 30.986 229 H SER 27 HN SER 27 211.999 191.647 30.796 230 HA SER 27 HA SER 27 211.063 190.155 33.004 231 HB2 SER 27 HB2 SER 27 208.846 191.076 32.413 232 HB3 SER 27 HB1 SER 27 210.097 192.315 32.403 233 HG SER 27 HG SER 27 209.936 192.473 30.287 234 H ILE 28 HN ILE 28 210.605 189.710 29.487 235 HA ILE 28 HA ILE 28 208.753 187.594 29.672 236 HB ILE 28 HB ILE 28 210.775 188.272 27.523 237 HG12 ILE 28 HG12 ILE 28 207.772 188.688 27.612 238 HG13 ILE 28 HG11 ILE 28 208.932 189.927 28.092 239 HG21 ILE 28 HG21 ILE 28 210.226 185.970 27.196 240 HG22 ILE 28 HG22 ILE 28 209.165 186.860 26.105 241 HG23 ILE 28 HG23 ILE 28 208.538 186.236 27.630 242 HD11 ILE 28 HD11 ILE 28 208.206 190.176 25.721 243 HD12 ILE 28 HD12 ILE 28 208.873 188.581 25.375 244 HD13 ILE 28 HD13 ILE 28 209.941 189.896 25.866 245 H GLY 29 HN GLY 29 212.330 187.540 29.366 246 HA2 GLY 29 HA2 GLY 29 212.555 184.721 29.357 247 HA3 GLY 29 HA1 GLY 29 213.836 185.846 29.790 248 H SER 30 HN SER 30 212.946 187.049 32.072 249 HA SER 30 HA SER 30 213.412 185.100 34.045 250 HB2 SER 30 HB2 SER 30 212.097 187.806 34.395 251 HB3 SER 30 HB1 SER 30 212.833 186.832 35.663 252 HG SER 30 HG SER 30 214.575 187.064 33.679 253 H ASP 31 HN ASP 31 210.394 186.472 32.770 254 HA ASP 31 HA ASP 31 208.665 185.313 34.685 255 HB2 ASP 31 HB2 ASP 31 207.954 187.112 33.172 256 HB3 ASP 31 HB1 ASP 31 208.121 186.023 31.795 257 H LEU 32 HN LEU 32 209.841 184.194 31.529 258 HA LEU 32 HA LEU 32 208.417 181.660 31.783 259 HB2 LEU 32 HB2 LEU 32 210.430 182.615 29.729 260 HB3 LEU 32 HB1 LEU 32 209.520 181.113 29.632 261 HG LEU 32 HG LEU 32 208.192 183.828 29.871 262 HD11 LEU 32 HD11 LEU 32 207.775 183.587 27.410 263 HD12 LEU 32 HD12 LEU 32 208.891 182.221 27.400 264 HD13 LEU 32 HD13 LEU 32 209.473 183.833 27.817 265 HD21 LEU 32 HD21 LEU 32 206.315 182.414 28.740 266 HD22 LEU 32 HD22 LEU 32 206.611 182.170 30.456 267 HD23 LEU 32 HD23 LEU 32 207.244 181.017 29.283 268 H GLY 33 HN GLY 33 211.401 182.887 32.885 269 HA2 GLY 33 HA2 GLY 33 212.820 180.356 32.758 270 HA3 GLY 33 HA1 GLY 33 213.395 181.847 33.491 271 H ALA 34 HN ALA 34 210.270 181.231 34.568 272 HA ALA 34 HA ALA 34 211.116 180.774 37.228 273 HB1 ALA 34 HB1 ALA 34 208.439 180.695 35.850 274 HB2 ALA 34 HB2 ALA 34 209.024 181.809 37.083 275 HB3 ALA 34 HB3 ALA 34 208.594 180.157 37.524 276 H SER 35 HN SER 35 210.024 178.578 34.667 277 HA SER 35 HA SER 35 209.795 176.271 36.302 278 HB2 SER 35 HB2 SER 35 209.960 175.028 34.159 279 HB3 SER 35 HB1 SER 35 208.787 176.339 34.088 280 HG SER 35 HG SER 35 211.394 176.195 33.010 281 H ILE 36 HN ILE 36 212.482 177.730 34.560 282 HA ILE 36 HA ILE 36 214.322 175.605 34.808 283 HB ILE 36 HB ILE 36 214.768 178.591 34.575 284 HG12 ILE 36 HG12 ILE 36 215.211 176.377 32.563 285 HG13 ILE 36 HG11 ILE 36 213.697 177.263 32.661 286 HG21 ILE 36 HG21 ILE 36 217.107 177.832 33.858 287 HG22 ILE 36 HG22 ILE 36 216.720 176.273 34.585 288 HG23 ILE 36 HG23 ILE 36 216.769 177.725 35.584 289 HD11 ILE 36 HD11 ILE 36 215.137 178.281 30.970 290 HD12 ILE 36 HD12 ILE 36 216.432 178.462 32.153 291 HD13 ILE 36 HD13 ILE 36 214.940 179.386 32.330 292 H LYS 37 HN LYS 37 213.535 178.308 36.935 293 HA LYS 37 HA LYS 37 215.560 177.981 38.836 294 HB2 LYS 37 HB2 LYS 37 212.682 178.852 39.207 295 HB3 LYS 37 HB1 LYS 37 213.929 179.003 40.444 296 HG2 LYS 37 HG2 LYS 37 215.271 180.411 38.921 297 HG3 LYS 37 HG1 LYS 37 214.019 180.267 37.687 298 HD2 LYS 37 HD2 LYS 37 212.389 181.297 39.272 299 HD3 LYS 37 HD1 LYS 37 213.701 181.526 40.428 300 HE2 LYS 37 HE2 LYS 37 213.585 182.704 37.634 301 HE3 LYS 37 HE1 LYS 37 213.309 183.587 39.136 302 HZ1 LYS 37 HZ1 LYS 37 215.728 182.207 39.365 303 HZ2 LYS 37 HZ2 LYS 37 215.476 183.886 39.318 304 HZ3 LYS 37 HZ3 LYS 37 215.744 183.024 37.878 305 H GLY 38 HN GLY 38 212.474 176.255 38.445 306 HA2 GLY 38 HA2 GLY 38 212.642 174.825 40.900 307 HA3 GLY 38 HA1 GLY 38 211.636 174.395 39.529 308 H PHE 39 HN PHE 39 213.658 174.031 37.561 309 HA PHE 39 HA PHE 39 214.414 171.359 38.084 310 HB2 PHE 39 HB2 PHE 39 215.157 173.428 36.032 311 HB3 PHE 39 HB1 PHE 39 216.101 171.940 36.108 312 HD1 PHE 39 HD1 PHE 39 212.462 172.892 36.348 313 HD2 PHE 39 HD2 PHE 39 215.405 170.282 34.607 314 HE1 PHE 39 HE1 PHE 39 210.678 171.700 35.107 315 HE2 PHE 39 HE2 PHE 39 213.616 169.097 33.369 316 HZ PHE 39 HZ PHE 39 211.255 169.805 33.618 317 H LYS 40 HN LYS 40 216.262 174.392 38.184 318 HA LYS 40 HA LYS 40 218.748 173.307 38.907 319 HB2 LYS 40 HB2 LYS 40 218.358 175.664 38.190 320 HB3 LYS 40 HB1 LYS 40 217.585 175.977 39.742 321 HG2 LYS 40 HG2 LYS 40 219.652 175.456 40.927 322 HG3 LYS 40 HG1 LYS 40 220.438 175.006 39.412 323 HD2 LYS 40 HD2 LYS 40 220.132 177.302 38.563 324 HD3 LYS 40 HD1 LYS 40 219.347 177.761 40.074 325 HE2 LYS 40 HE2 LYS 40 221.404 177.234 41.317 326 HE3 LYS 40 HE1 LYS 40 222.193 176.737 39.819 327 HZ1 LYS 40 HZ1 LYS 40 221.679 179.036 38.983 328 HZ2 LYS 40 HZ2 LYS 40 222.844 178.950 40.216 329 HZ3 LYS 40 HZ3 LYS 40 221.259 179.446 40.574 330 H LYS 41 HN LYS 41 216.058 174.477 40.953 331 HA LYS 41 HA LYS 41 217.302 174.040 43.429 332 HB2 LYS 41 HB2 LYS 41 215.252 175.383 43.104 333 HB3 LYS 41 HB1 LYS 41 214.355 173.905 42.761 334 HG2 LYS 41 HG2 LYS 41 214.852 173.044 44.996 335 HG3 LYS 41 HG1 LYS 41 215.835 174.469 45.348 336 HD2 LYS 41 HD2 LYS 41 213.856 175.909 45.035 337 HD3 LYS 41 HD1 LYS 41 212.873 174.484 44.704 338 HE2 LYS 41 HE2 LYS 41 213.395 173.605 46.961 339 HE3 LYS 41 HE1 LYS 41 214.359 175.044 47.292 340 HZ1 LYS 41 HZ1 LYS 41 211.998 176.061 46.440 341 HZ2 LYS 41 HZ2 LYS 41 212.466 175.895 48.065 342 HZ3 LYS 41 HZ3 LYS 41 211.506 174.702 47.327 343 H ALA 42 HN ALA 42 215.006 171.926 41.635 344 HA ALA 42 HA ALA 42 215.038 169.826 43.493 345 HB1 ALA 42 HB1 ALA 42 213.464 169.967 41.594 346 HB2 ALA 42 HB2 ALA 42 214.248 168.391 41.704 347 HB3 ALA 42 HB3 ALA 42 214.783 169.556 40.497 348 H MET 43 HN MET 43 217.262 170.353 40.705 349 HA MET 43 HA MET 43 218.738 167.955 41.261 350 HB2 MET 43 HB2 MET 43 219.158 170.320 39.436 351 HB3 MET 43 HB1 MET 43 220.388 169.070 39.622 352 HG2 MET 43 HG2 MET 43 218.948 168.566 37.706 353 HG3 MET 43 HG1 MET 43 218.732 167.354 38.967 354 HE1 MET 43 HE1 MET 43 216.748 166.967 40.328 355 HE2 MET 43 HE2 MET 43 216.384 166.423 38.692 356 HE3 MET 43 HE3 MET 43 215.153 167.271 39.624 357 H SER 44 HN SER 44 218.436 170.304 43.313 358 HA SER 44 HA SER 44 221.097 171.278 43.719 359 HB2 SER 44 HB2 SER 44 220.226 172.033 45.904 360 HB3 SER 44 HB1 SER 44 219.162 172.501 44.580 361 HG SER 44 HG SER 44 217.691 171.480 45.674 362 H ASP 45 HN ASP 45 219.541 168.313 44.325 363 HA ASP 45 HA ASP 45 220.788 167.455 46.697 364 HB2 ASP 45 HB2 ASP 45 220.324 165.159 45.821 365 HB3 ASP 45 HB1 ASP 45 218.926 166.231 45.775 366 H ASP 46 HN ASP 46 221.856 167.215 43.281 367 HA ASP 46 HA ASP 46 224.490 166.219 44.232 368 HB2 ASP 46 HB2 ASP 46 223.063 165.973 41.582 369 HB3 ASP 46 HB1 ASP 46 224.775 165.606 41.779 370 H GLU 47 HN GLU 47 224.229 168.881 44.695 371 HA GLU 47 HA GLU 47 226.309 170.008 43.161 372 HB2 GLU 47 HB2 GLU 47 224.456 170.170 41.459 373 HB3 GLU 47 HB1 GLU 47 223.615 171.251 42.571 374 HG2 GLU 47 HG2 GLU 47 225.320 172.899 42.432 375 HG3 GLU 47 HG1 GLU 47 226.460 171.775 41.697 376 HA PRO 48 HA PRO 48 225.427 172.068 47.175 377 HB2 PRO 48 HB2 PRO 48 227.980 172.399 48.025 378 HB3 PRO 48 HB1 PRO 48 227.147 170.834 48.133 379 HG2 PRO 48 HG2 PRO 48 229.141 171.778 46.119 380 HG3 PRO 48 HG1 PRO 48 229.001 170.197 46.910 381 HD2 PRO 48 HD2 PRO 48 228.075 170.721 44.362 382 HD3 PRO 48 HD1 PRO 48 227.409 169.440 45.401 383 H LYS 49 HN LYS 49 225.529 174.241 47.814 384 HA LYS 49 HA LYS 49 226.384 176.118 45.710 385 HB2 LYS 49 HB2 LYS 49 224.585 176.431 48.122 386 HB3 LYS 49 HB1 LYS 49 225.037 177.760 47.054 387 HG2 LYS 49 HG2 LYS 49 224.074 176.549 45.131 388 HG3 LYS 49 HG1 LYS 49 223.622 175.218 46.197 389 HD2 LYS 49 HD2 LYS 49 222.159 176.702 47.483 390 HD3 LYS 49 HD1 LYS 49 222.648 178.074 46.489 391 HE2 LYS 49 HE2 LYS 49 221.704 176.997 44.496 392 HE3 LYS 49 HE1 LYS 49 221.245 175.590 45.456 393 HZ1 LYS 49 HZ1 LYS 49 220.186 178.349 45.632 394 HZ2 LYS 49 HZ2 LYS 49 219.945 177.208 46.867 395 HZ3 LYS 49 HZ3 LYS 49 219.334 176.919 45.308 396 HCN FME 1 HCN FME 1 228.447 176.113 -2.784 397 HA FME 1 HA FME 1 225.329 177.439 -3.862 398 HB2 FME 1 HB2 FME 1 225.389 175.638 -6.298 399 HB3 FME 1 HB1 FME 1 224.342 177.031 -6.026 400 HG2 FME 1 HG2 FME 1 226.057 177.857 -7.436 401 HG3 FME 1 HG1 FME 1 226.520 178.402 -5.824 402 HE1 FME 1 HE1 FME 1 229.739 177.402 -8.006 403 HE2 FME 1 HE2 FME 1 228.895 178.749 -7.246 404 HE3 FME 1 HE3 FME 1 228.164 177.923 -8.620 405 H GLY 2 HN GLY 2 223.375 176.792 -3.065 406 HA2 GLY 2 HA2 GLY 2 222.373 174.122 -3.261 407 HA3 GLY 2 HA1 GLY 2 223.076 174.422 -1.675 408 H GLY 3 HN GLY 3 220.406 175.025 -3.776 409 HA2 GLY 3 HA2 GLY 3 219.193 177.196 -2.424 410 HA3 GLY 3 HA1 GLY 3 218.364 176.037 -3.459 411 H ILE 4 HN ILE 4 218.984 173.689 -2.000 412 HA ILE 4 HA ILE 4 216.903 173.729 -0.049 413 HB ILE 4 HB ILE 4 219.056 171.661 -0.592 414 HG12 ILE 4 HG12 ILE 4 216.168 171.676 -1.493 415 HG13 ILE 4 HG11 ILE 4 217.470 172.331 -2.487 416 HG21 ILE 4 HG21 ILE 4 218.030 171.335 1.615 417 HG22 ILE 4 HG22 ILE 4 217.443 170.105 0.499 418 HG23 ILE 4 HG23 ILE 4 216.421 171.482 0.907 419 HD11 ILE 4 HD11 ILE 4 218.628 170.151 -2.408 420 HD12 ILE 4 HD12 ILE 4 217.009 169.986 -3.089 421 HD13 ILE 4 HD13 ILE 4 217.321 169.493 -1.424 422 H SER 5 HN SER 5 217.561 175.396 1.424 423 HA SER 5 HA SER 5 219.820 174.650 3.206 424 HB2 SER 5 HB2 SER 5 220.264 176.732 2.036 425 HB3 SER 5 HB1 SER 5 218.701 177.375 2.534 426 HG SER 5 HG SER 5 220.952 176.729 4.128 427 H ILE 6 HN ILE 6 219.297 174.070 5.149 428 HA ILE 6 HA ILE 6 216.636 174.178 6.169 429 HB ILE 6 HB ILE 6 218.476 172.485 6.784 430 HG12 ILE 6 HG12 ILE 6 217.077 173.807 9.131 431 HG13 ILE 6 HG11 ILE 6 216.247 172.775 7.968 432 HG21 ILE 6 HG21 ILE 6 220.028 173.029 8.516 433 HG22 ILE 6 HG22 ILE 6 219.247 174.576 8.833 434 HG23 ILE 6 HG23 ILE 6 220.160 174.341 7.349 435 HD11 ILE 6 HD11 ILE 6 216.904 171.438 9.898 436 HD12 ILE 6 HD12 ILE 6 218.577 171.969 9.731 437 HD13 ILE 6 HD13 ILE 6 217.851 170.942 8.496 438 H TRP 7 HN TRP 7 219.495 176.171 6.468 439 HA TRP 7 HA TRP 7 218.673 177.667 8.714 440 HB2 TRP 7 HB2 TRP 7 220.683 178.140 6.538 441 HB3 TRP 7 HB1 TRP 7 220.214 179.515 7.538 442 HD1 TRP 7 HD1 TRP 7 222.304 176.373 7.631 443 HE1 TRP 7 HE1 TRP 7 223.335 176.135 9.991 444 HE3 TRP 7 HE3 TRP 7 219.743 180.050 10.048 445 HZ2 TRP 7 HZ2 TRP 7 223.039 177.350 12.591 446 HZ3 TRP 7 HZ3 TRP 7 220.124 180.480 12.459 447 HH2 TRP 7 HH2 TRP 7 221.771 179.128 13.722 448 H GLN 8 HN GLN 8 217.763 177.853 5.367 449 HA GLN 8 HA GLN 8 216.737 180.490 5.348 450 HB2 GLN 8 HB2 GLN 8 216.186 178.034 3.721 451 HB3 GLN 8 HB1 GLN 8 215.158 179.435 3.528 452 HG2 GLN 8 HG2 GLN 8 218.178 179.626 3.324 453 HG3 GLN 8 HG1 GLN 8 217.149 179.296 1.935 454 HE21 GLN 8 HE21 GLN 8 218.783 181.790 3.129 455 HE22 GLN 8 HE22 GLN 8 217.704 183.068 2.834 456 H LEU 9 HN LEU 9 215.390 177.459 6.496 457 HA LEU 9 HA LEU 9 212.717 178.378 6.905 458 HB2 LEU 9 HB2 LEU 9 214.291 176.124 8.165 459 HB3 LEU 9 HB1 LEU 9 212.566 176.375 8.405 460 HG LEU 9 HG LEU 9 213.886 175.936 5.710 461 HD11 LEU 9 HD11 LEU 9 212.416 173.709 6.046 462 HD12 LEU 9 HD12 LEU 9 212.725 174.048 7.740 463 HD13 LEU 9 HD13 LEU 9 214.075 173.815 6.628 464 HD21 LEU 9 HD21 LEU 9 211.899 177.058 5.212 465 HD22 LEU 9 HD22 LEU 9 211.053 176.412 6.622 466 HD23 LEU 9 HD23 LEU 9 211.344 175.391 5.215 467 H LEU 10 HN LEU 10 215.633 178.278 8.984 468 HA LEU 10 HA LEU 10 214.384 178.954 11.424 469 HB2 LEU 10 HB2 LEU 10 217.135 179.111 10.243 470 HB3 LEU 10 HB1 LEU 10 216.855 179.984 11.745 471 HG LEU 10 HG LEU 10 215.858 177.146 11.648 472 HD11 LEU 10 HD11 LEU 10 218.203 176.411 12.406 473 HD12 LEU 10 HD12 LEU 10 218.781 177.909 11.700 474 HD13 LEU 10 HD13 LEU 10 218.001 176.707 10.682 475 HD21 LEU 10 HD21 LEU 10 215.820 178.864 13.624 476 HD22 LEU 10 HD22 LEU 10 217.541 178.481 13.783 477 HD23 LEU 10 HD23 LEU 10 216.324 177.210 13.962 478 H ILE 11 HN ILE 11 215.878 181.051 8.945 479 HA ILE 11 HA ILE 11 215.336 183.473 10.308 480 HB ILE 11 HB ILE 11 217.013 183.398 8.584 481 HG12 ILE 11 HG12 ILE 11 214.775 185.028 7.372 482 HG13 ILE 11 HG11 ILE 11 215.537 185.495 8.895 483 HG21 ILE 11 HG21 ILE 11 216.039 181.635 7.212 484 HG22 ILE 11 HG22 ILE 11 216.445 183.036 6.225 485 HG23 ILE 11 HG23 ILE 11 214.774 182.730 6.673 486 HD11 ILE 11 HD11 ILE 11 216.990 185.028 6.273 487 HD12 ILE 11 HD12 ILE 11 217.749 185.483 7.797 488 HD13 ILE 11 HD13 ILE 11 216.650 186.605 6.989 489 H ILE 12 HN ILE 12 213.505 181.677 7.791 490 HA ILE 12 HA ILE 12 211.437 183.584 7.524 491 HB ILE 12 HB ILE 12 211.526 180.600 7.037 492 HG12 ILE 12 HG12 ILE 12 211.492 182.998 5.181 493 HG13 ILE 12 HG11 ILE 12 212.898 182.024 5.550 494 HG21 ILE 12 HG21 ILE 12 209.370 180.986 5.751 495 HG22 ILE 12 HG22 ILE 12 209.287 182.575 6.511 496 HG23 ILE 12 HG23 ILE 12 209.203 181.110 7.488 497 HD11 ILE 12 HD11 ILE 12 211.520 180.017 4.699 498 HD12 ILE 12 HD12 ILE 12 212.106 181.162 3.488 499 HD13 ILE 12 HD13 ILE 12 210.436 181.227 4.020 500 H ALA 13 HN ALA 13 211.763 180.734 9.639 501 HA ALA 13 HA ALA 13 209.195 180.862 10.779 502 HB1 ALA 13 HB1 ALA 13 210.263 179.605 12.681 503 HB2 ALA 13 HB2 ALA 13 211.815 179.827 11.872 504 HB3 ALA 13 HB3 ALA 13 210.538 178.894 11.092 505 H VAL 14 HN VAL 14 212.252 182.434 11.651 506 HA VAL 14 HA VAL 14 211.367 183.559 14.077 507 HB VAL 14 HB VAL 14 213.533 184.386 12.136 508 HG11 VAL 14 HG11 VAL 14 213.119 186.438 13.167 509 HG12 VAL 14 HG12 VAL 14 214.284 185.721 14.283 510 HG13 VAL 14 HG13 VAL 14 212.560 185.698 14.665 511 HG21 VAL 14 HG21 VAL 14 214.982 183.324 13.693 512 HG22 VAL 14 HG22 VAL 14 213.599 182.238 13.578 513 HG23 VAL 14 HG23 VAL 14 213.751 183.325 14.958 514 H ILE 15 HN ILE 15 211.249 184.813 10.750 515 HA ILE 15 HA ILE 15 210.138 187.321 11.396 516 HB ILE 15 HB ILE 15 210.054 185.617 8.900 517 HG12 ILE 15 HG12 ILE 15 211.304 188.292 9.435 518 HG13 ILE 15 HG11 ILE 15 212.151 186.788 9.712 519 HG21 ILE 15 HG21 ILE 15 208.010 186.873 8.769 520 HG22 ILE 15 HG22 ILE 15 209.191 187.728 7.779 521 HG23 ILE 15 HG23 ILE 15 208.795 188.327 9.389 522 HD11 ILE 15 HD11 ILE 15 211.722 186.161 7.323 523 HD12 ILE 15 HD12 ILE 15 212.726 187.602 7.489 524 HD13 ILE 15 HD13 ILE 15 211.018 187.758 7.075 525 H VAL 16 HN VAL 16 208.579 184.225 10.615 526 HA VAL 16 HA VAL 16 205.909 185.118 10.652 527 HB VAL 16 HB VAL 16 207.158 182.461 11.416 528 HG11 VAL 16 HG11 VAL 16 204.250 183.258 11.264 529 HG12 VAL 16 HG12 VAL 16 205.087 182.425 12.569 530 HG13 VAL 16 HG13 VAL 16 204.771 181.588 11.051 531 HG21 VAL 16 HG21 VAL 16 205.791 183.521 8.943 532 HG22 VAL 16 HG22 VAL 16 206.072 181.803 9.218 533 HG23 VAL 16 HG23 VAL 16 207.436 182.914 9.094 534 H VAL 17 HN VAL 17 207.949 183.875 13.306 535 HA VAL 17 HA VAL 17 205.963 184.004 15.303 536 HB VAL 17 HB VAL 17 208.977 184.158 15.533 537 HG11 VAL 17 HG11 VAL 17 206.783 183.881 17.595 538 HG12 VAL 17 HG12 VAL 17 208.118 185.034 17.571 539 HG13 VAL 17 HG13 VAL 17 208.431 183.332 17.906 540 HG21 VAL 17 HG21 VAL 17 208.875 181.804 15.952 541 HG22 VAL 17 HG22 VAL 17 207.902 182.089 14.510 542 HG23 VAL 17 HG23 VAL 17 207.115 181.834 16.068 543 H LEU 18 HN LEU 18 208.429 186.397 14.267 544 HA LEU 18 HA LEU 18 207.837 188.285 16.306 545 HB2 LEU 18 HB2 LEU 18 209.184 188.349 13.638 546 HB3 LEU 18 HB1 LEU 18 208.724 189.896 14.343 547 HG LEU 18 HG LEU 18 210.192 187.907 16.070 548 HD11 LEU 18 HD11 LEU 18 212.316 189.089 15.242 549 HD12 LEU 18 HD12 LEU 18 211.346 189.593 13.847 550 HD13 LEU 18 HD13 LEU 18 211.611 187.884 14.172 551 HD21 LEU 18 HD21 LEU 18 210.184 190.937 15.820 552 HD22 LEU 18 HD22 LEU 18 211.066 190.031 17.039 553 HD23 LEU 18 HD23 LEU 18 209.296 190.014 17.017 554 H LEU 19 HN LEU 19 206.632 187.984 12.934 555 HA LEU 19 HA LEU 19 204.990 190.288 13.079 556 HB2 LEU 19 HB2 LEU 19 204.595 187.901 11.258 557 HB3 LEU 19 HB1 LEU 19 203.940 189.521 11.028 558 HG LEU 19 HG LEU 19 206.866 188.761 11.030 559 HD11 LEU 19 HD11 LEU 19 204.949 189.584 8.872 560 HD12 LEU 19 HD12 LEU 19 205.950 188.132 8.950 561 HD13 LEU 19 HD13 LEU 19 206.696 189.708 8.671 562 HD21 LEU 19 HD21 LEU 19 205.512 191.425 11.081 563 HD22 LEU 19 HD22 LEU 19 207.046 191.238 10.224 564 HD23 LEU 19 HD23 LEU 19 206.954 190.883 11.948 565 H PHE 20 HN PHE 20 204.305 186.867 13.776 566 HA PHE 20 HA PHE 20 201.536 187.520 14.550 567 HB2 PHE 20 HB2 PHE 20 203.134 184.970 14.346 568 HB3 PHE 20 HB1 PHE 20 201.641 184.997 15.279 569 HD1 PHE 20 HD1 PHE 20 203.112 185.444 11.928 570 HD2 PHE 20 HD2 PHE 20 199.499 185.176 14.225 571 HE1 PHE 20 HE1 PHE 20 201.793 185.198 9.855 572 HE2 PHE 20 HE2 PHE 20 198.183 184.922 12.140 573 HZ PHE 20 HZ PHE 20 199.337 184.932 9.947 574 H GLY 21 HN GLY 21 204.612 187.508 15.973 575 HA2 GLY 21 HA2 GLY 21 205.248 187.957 18.167 576 HA3 GLY 21 HA1 GLY 21 203.537 188.043 18.597 577 H THR 22 HN THR 22 204.967 186.778 20.452 578 HA THR 22 HA THR 22 204.877 183.882 19.850 579 HB THR 22 HB THR 22 206.955 184.255 20.813 580 HG1 THR 22 HG1 THR 22 206.823 183.454 22.855 581 HG21 THR 22 HG21 THR 22 206.744 186.632 21.175 582 HG22 THR 22 HG22 THR 22 207.279 185.904 22.690 583 HG23 THR 22 HG23 THR 22 205.593 186.379 22.486 584 H LYS 23 HN LYS 23 203.639 186.311 22.118 585 HA LYS 23 HA LYS 23 202.243 184.496 23.790 586 HB2 LYS 23 HB2 LYS 23 202.704 186.870 24.374 587 HB3 LYS 23 HB1 LYS 23 201.522 187.372 23.166 588 HG2 LYS 23 HG2 LYS 23 199.773 186.062 24.379 589 HG3 LYS 23 HG1 LYS 23 200.970 185.657 25.608 590 HD2 LYS 23 HD2 LYS 23 201.282 188.040 26.121 591 HD3 LYS 23 HD1 LYS 23 200.114 188.473 24.872 592 HE2 LYS 23 HE2 LYS 23 198.377 187.160 26.091 593 HE3 LYS 23 HE1 LYS 23 199.551 186.839 27.367 594 HZ1 LYS 23 HZ1 LYS 23 198.004 189.187 26.880 595 HZ2 LYS 23 HZ2 LYS 23 199.661 189.546 26.990 596 HZ3 LYS 23 HZ3 LYS 23 198.876 188.742 28.265 597 H LYS 24 HN LYS 24 201.151 186.350 20.918 598 HA LYS 24 HA LYS 24 198.492 185.411 20.983 599 HB2 LYS 24 HB2 LYS 24 199.334 187.395 19.671 600 HB3 LYS 24 HB1 LYS 24 200.058 186.258 18.543 601 HG2 LYS 24 HG2 LYS 24 198.002 186.654 17.503 602 HG3 LYS 24 HG1 LYS 24 197.621 185.222 18.453 603 HD2 LYS 24 HD2 LYS 24 196.666 186.614 20.223 604 HD3 LYS 24 HD1 LYS 24 197.121 188.074 19.347 605 HE2 LYS 24 HE2 LYS 24 195.658 187.421 17.477 606 HE3 LYS 24 HE1 LYS 24 195.208 185.947 18.338 607 HZ1 LYS 24 HZ1 LYS 24 194.716 188.732 19.245 608 HZ2 LYS 24 HZ2 LYS 24 194.351 187.338 20.143 609 HZ3 LYS 24 HZ3 LYS 24 193.548 187.640 18.677 610 H LEU 25 HN LEU 25 201.417 184.229 19.345 611 HA LEU 25 HA LEU 25 200.163 182.191 17.882 612 HB2 LEU 25 HB2 LEU 25 202.393 182.854 17.318 613 HB3 LEU 25 HB1 LEU 25 203.002 182.411 18.909 614 HG LEU 25 HG LEU 25 201.596 180.278 17.321 615 HD11 LEU 25 HD11 LEU 25 203.016 181.196 15.605 616 HD12 LEU 25 HD12 LEU 25 203.793 179.733 16.206 617 HD13 LEU 25 HD13 LEU 25 204.381 181.316 16.718 618 HD21 LEU 25 HD21 LEU 25 204.225 179.809 18.671 619 HD22 LEU 25 HD22 LEU 25 202.753 178.836 18.688 620 HD23 LEU 25 HD23 LEU 25 202.900 180.237 19.737 621 H GLY 26 HN GLY 26 200.871 182.427 21.272 622 HA2 GLY 26 HA2 GLY 26 200.971 179.637 21.844 623 HA3 GLY 26 HA1 GLY 26 200.606 180.914 23.001 624 H SER 27 HN SER 27 198.345 182.032 22.117 625 HA SER 27 HA SER 27 196.342 180.180 22.868 626 HB2 SER 27 HB2 SER 27 196.066 182.599 23.190 627 HB3 SER 27 HB1 SER 27 196.041 182.851 21.452 628 HG SER 27 HG SER 27 193.941 182.696 22.061 629 H ILE 28 HN ILE 28 197.370 181.381 19.653 630 HA ILE 28 HA ILE 28 195.313 180.132 18.190 631 HB ILE 28 HB ILE 28 198.128 180.926 17.415 632 HG12 ILE 28 HG12 ILE 28 195.472 182.192 16.697 633 HG13 ILE 28 HG11 ILE 28 196.411 182.685 18.107 634 HG21 ILE 28 HG21 ILE 28 197.503 179.257 15.830 635 HG22 ILE 28 HG22 ILE 28 197.124 180.796 15.056 636 HG23 ILE 28 HG23 ILE 28 195.836 179.828 15.774 637 HD11 ILE 28 HD11 ILE 28 196.812 184.044 15.984 638 HD12 ILE 28 HD12 ILE 28 197.583 182.604 15.320 639 HD13 ILE 28 HD13 ILE 28 198.255 183.382 16.753 640 H GLY 29 HN GLY 29 198.626 179.003 18.999 641 HA2 GLY 29 HA2 GLY 29 198.416 176.539 17.635 642 HA3 GLY 29 HA1 GLY 29 199.535 176.890 18.945 643 H SER 30 HN SER 30 197.942 177.286 21.122 644 HA SER 30 HA SER 30 197.226 174.677 21.877 645 HB2 SER 30 HB2 SER 30 196.276 177.268 23.128 646 HB3 SER 30 HB1 SER 30 196.310 175.682 23.891 647 HG SER 30 HG SER 30 198.580 177.033 22.847 648 H ASP 31 HN ASP 31 195.289 177.375 20.627 649 HA ASP 31 HA ASP 31 192.768 176.161 21.063 650 HB2 ASP 31 HB2 ASP 31 193.734 178.400 19.294 651 HB3 ASP 31 HB1 ASP 31 192.122 177.744 19.048 652 H LEU 32 HN LEU 32 194.981 176.126 18.299 653 HA LEU 32 HA LEU 32 193.224 174.349 16.795 654 HB2 LEU 32 HB2 LEU 32 196.039 175.319 16.229 655 HB3 LEU 32 HB1 LEU 32 195.049 174.380 15.118 656 HG LEU 32 HG LEU 32 194.184 177.053 16.262 657 HD11 LEU 32 HD11 LEU 32 195.512 176.422 13.613 658 HD12 LEU 32 HD12 LEU 32 196.212 177.359 14.934 659 HD13 LEU 32 HD13 LEU 32 194.817 177.982 14.051 660 HD21 LEU 32 HD21 LEU 32 192.247 175.969 15.481 661 HD22 LEU 32 HD22 LEU 32 193.102 175.166 14.165 662 HD23 LEU 32 HD23 LEU 32 192.750 176.890 14.070 663 H GLY 33 HN GLY 33 195.591 173.938 19.214 664 HA2 GLY 33 HA2 GLY 33 196.535 171.365 18.260 665 HA3 GLY 33 HA1 GLY 33 196.955 172.142 19.780 666 H ALA 34 HN ALA 34 193.616 172.235 19.394 667 HA ALA 34 HA ALA 34 193.164 170.484 21.570 668 HB1 ALA 34 HB1 ALA 34 190.692 170.702 20.690 669 HB2 ALA 34 HB2 ALA 34 191.382 171.918 19.615 670 HB3 ALA 34 HB3 ALA 34 191.511 172.115 21.360 671 H SER 35 HN SER 35 192.958 170.022 18.067 672 HA SER 35 HA SER 35 191.708 167.473 18.145 673 HB2 SER 35 HB2 SER 35 192.589 167.244 15.832 674 HB3 SER 35 HB1 SER 35 191.767 168.779 16.092 675 HG SER 35 HG SER 35 193.686 169.805 16.138 676 H ILE 36 HN ILE 36 195.063 168.515 18.292 677 HA ILE 36 HA ILE 36 196.284 165.990 17.970 678 HB ILE 36 HB ILE 36 197.224 168.474 19.426 679 HG12 ILE 36 HG12 ILE 36 198.169 167.251 16.827 680 HG13 ILE 36 HG11 ILE 36 196.898 168.462 16.880 681 HG21 ILE 36 HG21 ILE 36 198.590 165.821 18.916 682 HG22 ILE 36 HG22 ILE 36 198.467 166.705 20.436 683 HG23 ILE 36 HG23 ILE 36 199.511 167.307 19.150 684 HD11 ILE 36 HD11 ILE 36 199.744 168.784 17.862 685 HD12 ILE 36 HD12 ILE 36 198.469 169.979 18.106 686 HD13 ILE 36 HD13 ILE 36 199.007 169.585 16.474 687 H LYS 37 HN LYS 37 195.080 167.690 20.824 688 HA LYS 37 HA LYS 37 196.022 165.962 22.801 689 HB2 LYS 37 HB2 LYS 37 193.443 167.556 22.671 690 HB3 LYS 37 HB1 LYS 37 194.007 166.727 24.120 691 HG2 LYS 37 HG2 LYS 37 196.096 168.063 24.061 692 HG3 LYS 37 HG1 LYS 37 195.506 168.905 22.628 693 HD2 LYS 37 HD2 LYS 37 193.581 169.762 23.896 694 HD3 LYS 37 HD1 LYS 37 194.119 168.888 25.330 695 HE2 LYS 37 HE2 LYS 37 196.211 170.204 25.351 696 HE3 LYS 37 HE1 LYS 37 195.679 171.078 23.916 697 HZ1 LYS 37 HZ1 LYS 37 194.471 172.429 25.169 698 HZ2 LYS 37 HZ2 LYS 37 195.141 171.704 26.551 699 HZ3 LYS 37 HZ3 LYS 37 193.672 171.133 25.917 700 H GLY 38 HN GLY 38 193.174 165.688 20.684 701 HA2 GLY 38 HA2 GLY 38 192.062 163.424 22.001 702 HA3 GLY 38 HA1 GLY 38 191.685 163.953 20.371 703 H PHE 39 HN PHE 39 194.268 163.757 19.203 704 HA PHE 39 HA PHE 39 194.324 161.023 18.521 705 HB2 PHE 39 HB2 PHE 39 196.222 163.324 18.121 706 HB3 PHE 39 HB1 PHE 39 196.719 161.694 17.666 707 HD1 PHE 39 HD1 PHE 39 193.534 163.697 17.385 708 HD2 PHE 39 HD2 PHE 39 196.462 161.276 15.378 709 HE1 PHE 39 HE1 PHE 39 192.250 163.893 15.281 710 HE2 PHE 39 HE2 PHE 39 195.172 161.473 13.272 711 HZ PHE 39 HZ PHE 39 193.067 162.781 13.223 712 H LYS 40 HN LYS 40 196.382 162.936 20.680 713 HA LYS 40 HA LYS 40 198.125 160.881 21.466 714 HB2 LYS 40 HB2 LYS 40 198.386 163.340 21.960 715 HB3 LYS 40 HB1 LYS 40 197.141 163.165 23.190 716 HG2 LYS 40 HG2 LYS 40 199.111 162.927 24.439 717 HG3 LYS 40 HG1 LYS 40 198.665 161.254 24.128 718 HD2 LYS 40 HD2 LYS 40 200.250 161.133 22.272 719 HD3 LYS 40 HD1 LYS 40 200.622 162.846 22.443 720 HE2 LYS 40 HE2 LYS 40 201.527 162.448 24.680 721 HE3 LYS 40 HE1 LYS 40 201.096 160.740 24.568 722 HZ1 LYS 40 HZ1 LYS 40 202.595 160.447 22.769 723 HZ2 LYS 40 HZ2 LYS 40 203.448 161.249 24.002 724 HZ3 LYS 40 HZ3 LYS 40 202.889 162.111 22.648 725 H LYS 41 HN LYS 41 195.039 161.958 22.891 726 HA LYS 41 HA LYS 41 195.024 160.159 25.051 727 HB2 LYS 41 HB2 LYS 41 192.903 161.707 23.593 728 HB3 LYS 41 HB1 LYS 41 192.422 160.522 24.803 729 HG2 LYS 41 HG2 LYS 41 194.535 162.567 25.488 730 HG3 LYS 41 HG1 LYS 41 192.834 163.024 25.525 731 HD2 LYS 41 HD2 LYS 41 192.367 161.168 27.082 732 HD3 LYS 41 HD1 LYS 41 194.068 160.710 27.054 733 HE2 LYS 41 HE2 LYS 41 194.692 162.905 27.962 734 HE3 LYS 41 HE1 LYS 41 192.996 163.390 27.972 735 HZ1 LYS 41 HZ1 LYS 41 192.779 161.167 29.327 736 HZ2 LYS 41 HZ2 LYS 41 193.193 162.629 30.086 737 HZ3 LYS 41 HZ3 LYS 41 194.400 161.497 29.701 738 H ALA 42 HN ALA 42 193.419 159.871 21.848 739 HA ALA 42 HA ALA 42 192.335 157.317 22.296 740 HB1 ALA 42 HB1 ALA 42 193.372 158.320 19.646 741 HB2 ALA 42 HB2 ALA 42 191.825 158.798 20.346 742 HB3 ALA 42 HB3 ALA 42 192.117 157.113 19.913 743 H MET 43 HN MET 43 195.589 158.146 20.983 744 HA MET 43 HA MET 43 196.301 155.378 20.683 745 HB2 MET 43 HB2 MET 43 197.676 158.022 20.341 746 HB3 MET 43 HB1 MET 43 198.682 156.585 20.518 747 HG2 MET 43 HG2 MET 43 198.229 157.022 18.144 748 HG3 MET 43 HG1 MET 43 197.473 155.512 18.647 749 HE1 MET 43 HE1 MET 43 195.571 159.429 17.351 750 HE2 MET 43 HE2 MET 43 196.901 158.577 16.571 751 HE3 MET 43 HE3 MET 43 197.118 159.243 18.188 752 H SER 44 HN SER 44 195.559 156.750 23.435 753 HA SER 44 HA SER 44 197.514 155.220 24.949 754 HB2 SER 44 HB2 SER 44 197.202 158.203 25.339 755 HB3 SER 44 HB1 SER 44 198.109 157.128 26.400 756 HG SER 44 HG SER 44 199.365 158.220 24.744 757 H ASP 45 HN ASP 45 194.727 154.894 24.514 758 HA ASP 45 HA ASP 45 193.104 155.968 26.566 759 HB2 ASP 45 HB2 ASP 45 192.913 153.412 24.956 760 HB3 ASP 45 HB1 ASP 45 191.692 153.890 26.132 761 H ASP 46 HN ASP 46 195.080 152.986 26.412 762 HA ASP 46 HA ASP 46 194.360 152.246 29.129 763 HB2 ASP 46 HB2 ASP 46 196.311 151.115 27.118 764 HB3 ASP 46 HB1 ASP 46 196.116 150.467 28.744 765 H GLU 47 HN GLU 47 195.384 154.824 29.115 766 HA GLU 47 HA GLU 47 197.507 154.620 31.017 767 HB2 GLU 47 HB2 GLU 47 198.738 154.258 28.812 768 HB3 GLU 47 HB1 GLU 47 198.308 155.923 28.403 769 HG2 GLU 47 HG2 GLU 47 200.510 155.984 29.407 770 HG3 GLU 47 HG1 GLU 47 199.377 156.643 30.587 771 HA PRO 48 HA PRO 48 194.879 158.454 31.216 772 HB2 PRO 48 HB2 PRO 48 195.507 158.147 34.120 773 HB3 PRO 48 HB1 PRO 48 193.939 158.406 33.328 774 HG2 PRO 48 HG2 PRO 48 194.557 156.036 34.339 775 HG3 PRO 48 HG1 PRO 48 193.700 156.161 32.790 776 HD2 PRO 48 HD2 PRO 48 196.635 155.626 33.263 777 HD3 PRO 48 HD1 PRO 48 195.510 154.818 32.142 778 H LYS 49 HN LYS 49 195.501 160.593 31.482 779 HA LYS 49 HA LYS 49 198.273 161.126 32.389 780 HB2 LYS 49 HB2 LYS 49 196.860 162.220 29.941 781 HB3 LYS 49 HB1 LYS 49 198.400 162.821 30.547 782 HG2 LYS 49 HG2 LYS 49 198.033 159.892 29.908 783 HG3 LYS 49 HG1 LYS 49 198.428 161.046 28.637 784 HD2 LYS 49 HD2 LYS 49 200.428 161.758 29.943 785 HD3 LYS 49 HD1 LYS 49 200.060 160.530 31.148 786 HE2 LYS 49 HE2 LYS 49 200.203 158.790 29.366 787 HE3 LYS 49 HE1 LYS 49 200.714 160.046 28.235 788 HZ1 LYS 49 HZ1 LYS 49 202.117 159.758 30.797 789 HZ2 LYS 49 HZ2 LYS 49 202.696 160.349 29.313 790 HZ3 LYS 49 HZ3 LYS 49 202.475 158.679 29.540 791 HCN FME 1 HCN FME 1 219.432 173.229 -7.339 792 HA FME 1 HA FME 1 221.923 172.052 -9.187 793 HB2 FME 1 HB2 FME 1 219.889 171.432 -11.333 794 HB3 FME 1 HB1 FME 1 221.559 171.822 -11.748 795 HG2 FME 1 HG2 FME 1 220.842 169.676 -9.741 796 HG3 FME 1 HG1 FME 1 221.043 169.339 -11.460 797 HE1 FME 1 HE1 FME 1 224.640 169.525 -12.240 798 HE2 FME 1 HE2 FME 1 223.301 170.558 -12.734 799 HE3 FME 1 HE3 FME 1 223.048 168.824 -12.554 800 H GLY 2 HN GLY 2 222.074 174.223 -8.446 801 HA2 GLY 2 HA2 GLY 2 222.276 176.499 -8.706 802 HA3 GLY 2 HA1 GLY 2 222.315 176.177 -10.437 803 H GLY 3 HN GLY 3 220.700 176.981 -11.617 804 HA2 GLY 3 HA2 GLY 3 218.590 178.484 -10.453 805 HA3 GLY 3 HA1 GLY 3 218.742 178.065 -12.157 806 H ILE 4 HN ILE 4 216.274 177.998 -11.596 807 HA ILE 4 HA ILE 4 214.348 176.743 -11.406 808 HB ILE 4 HB ILE 4 216.260 174.473 -12.026 809 HG12 ILE 4 HG12 ILE 4 214.504 176.073 -13.911 810 HG13 ILE 4 HG11 ILE 4 216.214 176.423 -13.654 811 HG21 ILE 4 HG21 ILE 4 214.192 173.549 -11.249 812 HG22 ILE 4 HG22 ILE 4 214.105 173.500 -13.008 813 HG23 ILE 4 HG23 ILE 4 213.248 174.758 -12.117 814 HD11 ILE 4 HD11 ILE 4 215.076 173.789 -14.639 815 HD12 ILE 4 HD12 ILE 4 216.785 174.120 -14.357 816 HD13 ILE 4 HD13 ILE 4 215.918 174.982 -15.628 817 H SER 5 HN SER 5 214.327 177.254 -9.073 818 HA SER 5 HA SER 5 214.920 174.879 -7.387 819 HB2 SER 5 HB2 SER 5 216.387 176.732 -6.828 820 HB3 SER 5 HB1 SER 5 215.001 177.800 -6.630 821 HG SER 5 HG SER 5 215.901 175.681 -5.034 822 H ILE 6 HN ILE 6 213.312 173.932 -6.468 823 HA ILE 6 HA ILE 6 210.597 174.815 -6.633 824 HB ILE 6 HB ILE 6 211.498 172.400 -6.406 825 HG12 ILE 6 HG12 ILE 6 209.296 173.143 -4.455 826 HG13 ILE 6 HG11 ILE 6 209.065 173.123 -6.203 827 HG21 ILE 6 HG21 ILE 6 211.923 171.535 -4.215 828 HG22 ILE 6 HG22 ILE 6 211.369 173.017 -3.440 829 HG23 ILE 6 HG23 ILE 6 212.886 173.004 -4.327 830 HD11 ILE 6 HD11 ILE 6 210.101 170.746 -4.634 831 HD12 ILE 6 HD12 ILE 6 209.602 170.773 -6.324 832 HD13 ILE 6 HD13 ILE 6 208.401 170.974 -5.048 833 H TRP 7 HN TRP 7 213.152 175.013 -4.297 834 HA TRP 7 HA TRP 7 211.735 175.768 -2.007 835 HB2 TRP 7 HB2 TRP 7 214.577 176.136 -2.894 836 HB3 TRP 7 HB1 TRP 7 214.013 177.095 -1.525 837 HD1 TRP 7 HD1 TRP 7 214.981 173.555 -2.465 838 HE1 TRP 7 HE1 TRP 7 214.719 172.059 -0.370 839 HE3 TRP 7 HE3 TRP 7 212.647 176.848 0.651 840 HZ2 TRP 7 HZ2 TRP 7 213.612 172.266 2.288 841 HZ3 TRP 7 HZ3 TRP 7 212.007 176.176 2.949 842 HH2 TRP 7 HH2 TRP 7 212.500 173.894 3.761 843 H GLN 8 HN GLN 8 212.554 177.587 -4.850 844 HA GLN 8 HA GLN 8 212.268 180.199 -3.796 845 HB2 GLN 8 HB2 GLN 8 211.944 179.028 -6.537 846 HB3 GLN 8 HB1 GLN 8 211.527 180.696 -6.251 847 HG2 GLN 8 HG2 GLN 8 214.210 179.642 -5.352 848 HG3 GLN 8 HG1 GLN 8 213.955 180.140 -7.021 849 HE21 GLN 8 HE21 GLN 8 214.490 182.279 -7.369 850 HE22 GLN 8 HE22 GLN 8 214.391 183.513 -6.209 851 H LEU 9 HN LEU 9 209.904 177.826 -4.850 852 HA LEU 9 HA LEU 9 207.629 179.554 -4.820 853 HB2 LEU 9 HB2 LEU 9 207.873 176.553 -4.534 854 HB3 LEU 9 HB1 LEU 9 206.346 177.406 -4.725 855 HG LEU 9 HG LEU 9 208.620 177.615 -6.712 856 HD11 LEU 9 HD11 LEU 9 206.898 176.083 -8.055 857 HD12 LEU 9 HD12 LEU 9 206.402 175.596 -6.441 858 HD13 LEU 9 HD13 LEU 9 208.072 175.360 -6.956 859 HD21 LEU 9 HD21 LEU 9 205.712 178.452 -6.694 860 HD22 LEU 9 HD22 LEU 9 206.607 178.251 -8.199 861 HD23 LEU 9 HD23 LEU 9 207.134 179.445 -7.024 862 H LEU 10 HN LEU 10 209.146 177.446 -2.370 863 HA LEU 10 HA LEU 10 207.100 177.592 -0.424 864 HB2 LEU 10 HB2 LEU 10 210.048 177.034 -0.450 865 HB3 LEU 10 HB1 LEU 10 209.262 177.244 1.112 866 HG LEU 10 HG LEU 10 207.892 175.406 -0.839 867 HD11 LEU 10 HD11 LEU 10 209.422 173.525 0.167 868 HD12 LEU 10 HD12 LEU 10 210.569 174.834 0.433 869 HD13 LEU 10 HD13 LEU 10 210.022 174.462 -1.198 870 HD21 LEU 10 HD21 LEU 10 208.551 174.928 2.081 871 HD22 LEU 10 HD22 LEU 10 207.189 174.307 1.142 872 HD23 LEU 10 HD23 LEU 10 207.226 176.005 1.614 873 H ILE 11 HN ILE 11 209.996 179.636 -0.873 874 HA ILE 11 HA ILE 11 209.428 181.329 1.331 875 HB ILE 11 HB ILE 11 211.663 181.212 0.418 876 HG12 ILE 11 HG12 ILE 11 210.630 183.980 -0.222 877 HG13 ILE 11 HG11 ILE 11 210.750 183.379 1.433 878 HG21 ILE 11 HG21 ILE 11 210.493 182.459 -2.076 879 HG22 ILE 11 HG22 ILE 11 211.072 180.803 -1.916 880 HG23 ILE 11 HG23 ILE 11 212.202 182.147 -1.786 881 HD11 ILE 11 HD11 ILE 11 213.103 183.149 1.306 882 HD12 ILE 11 HD12 ILE 11 212.779 184.689 0.506 883 HD13 ILE 11 HD13 ILE 11 213.106 183.246 -0.455 884 H ILE 12 HN ILE 12 208.630 181.590 -2.158 885 HA ILE 12 HA ILE 12 207.406 184.132 -1.979 886 HB ILE 12 HB ILE 12 206.978 181.859 -3.929 887 HG12 ILE 12 HG12 ILE 12 208.395 184.529 -4.177 888 HG13 ILE 12 HG11 ILE 12 209.202 182.991 -3.933 889 HG21 ILE 12 HG21 ILE 12 204.936 183.135 -3.970 890 HG22 ILE 12 HG22 ILE 12 205.883 183.693 -5.338 891 HG23 ILE 12 HG23 ILE 12 205.814 184.661 -3.868 892 HD11 ILE 12 HD11 ILE 12 207.527 183.800 -6.309 893 HD12 ILE 12 HD12 ILE 12 208.108 182.162 -6.050 894 HD13 ILE 12 HD13 ILE 12 209.251 183.487 -6.305 895 H ALA 13 HN ALA 13 206.070 180.841 -1.693 896 HA ALA 13 HA ALA 13 203.371 181.587 -1.465 897 HB1 ALA 13 HB1 ALA 13 204.890 179.219 -0.358 898 HB2 ALA 13 HB2 ALA 13 203.944 179.284 -1.845 899 HB3 ALA 13 HB3 ALA 13 203.135 179.376 -0.281 900 H VAL 14 HN VAL 14 205.941 181.261 0.956 901 HA VAL 14 HA VAL 14 204.340 181.621 3.245 902 HB VAL 14 HB VAL 14 207.244 182.093 2.600 903 HG11 VAL 14 HG11 VAL 14 206.990 183.665 4.324 904 HG12 VAL 14 HG12 VAL 14 207.438 182.199 5.190 905 HG13 VAL 14 HG13 VAL 14 205.754 182.710 5.145 906 HG21 VAL 14 HG21 VAL 14 206.083 179.774 2.837 907 HG22 VAL 14 HG22 VAL 14 206.007 180.149 4.559 908 HG23 VAL 14 HG23 VAL 14 207.564 180.041 3.748 909 H ILE 15 HN ILE 15 206.034 183.986 1.185 910 HA ILE 15 HA ILE 15 205.340 186.258 2.695 911 HB ILE 15 HB ILE 15 206.020 185.910 -0.230 912 HG12 ILE 15 HG12 ILE 15 207.507 187.269 1.998 913 HG13 ILE 15 HG11 ILE 15 207.720 185.573 1.637 914 HG21 ILE 15 HG21 ILE 15 204.644 187.878 -0.182 915 HG22 ILE 15 HG22 ILE 15 206.318 188.434 -0.179 916 HG23 ILE 15 HG23 ILE 15 205.387 188.434 1.319 917 HD11 ILE 15 HD11 ILE 15 209.451 186.782 0.466 918 HD12 ILE 15 HD12 ILE 15 208.272 187.909 -0.204 919 HD13 ILE 15 HD13 ILE 15 208.285 186.227 -0.735 920 H VAL 16 HN VAL 16 203.671 184.681 -0.013 921 HA VAL 16 HA VAL 16 201.565 186.517 -0.303 922 HB VAL 16 HB VAL 16 201.745 183.522 -0.736 923 HG11 VAL 16 HG11 VAL 16 199.432 183.772 -0.345 924 HG12 VAL 16 HG12 VAL 16 199.571 183.910 -2.096 925 HG13 VAL 16 HG13 VAL 16 199.381 185.359 -1.104 926 HG21 VAL 16 HG21 VAL 16 201.567 184.260 -3.130 927 HG22 VAL 16 HG22 VAL 16 203.023 184.820 -2.306 928 HG23 VAL 16 HG23 VAL 16 201.673 185.926 -2.561 929 H VAL 17 HN VAL 17 201.812 183.619 1.771 930 HA VAL 17 HA VAL 17 199.215 183.807 2.855 931 HB VAL 17 HB VAL 17 201.739 182.539 3.939 932 HG11 VAL 17 HG11 VAL 17 200.356 182.856 5.847 933 HG12 VAL 17 HG12 VAL 17 200.016 181.209 5.315 934 HG13 VAL 17 HG13 VAL 17 198.886 182.509 4.936 935 HG21 VAL 17 HG21 VAL 17 200.811 180.495 3.058 936 HG22 VAL 17 HG22 VAL 17 200.741 181.696 1.768 937 HG23 VAL 17 HG23 VAL 17 199.283 181.292 2.675 938 H LEU 18 HN LEU 18 202.339 185.126 3.995 939 HA LEU 18 HA LEU 18 201.300 186.147 6.435 940 HB2 LEU 18 HB2 LEU 18 203.689 186.993 4.775 941 HB3 LEU 18 HB1 LEU 18 203.310 187.694 6.345 942 HG LEU 18 HG LEU 18 203.840 184.750 5.831 943 HD11 LEU 18 HD11 LEU 18 205.916 185.828 5.587 944 HD12 LEU 18 HD12 LEU 18 205.896 185.348 7.283 945 HD13 LEU 18 HD13 LEU 18 205.553 187.021 6.833 946 HD21 LEU 18 HD21 LEU 18 202.537 184.691 7.730 947 HD22 LEU 18 HD22 LEU 18 202.965 186.335 8.219 948 HD23 LEU 18 HD23 LEU 18 204.095 185.012 8.479 949 H LEU 19 HN LEU 19 201.773 187.699 3.241 950 HA LEU 19 HA LEU 19 200.817 190.235 4.070 951 HB2 LEU 19 HB2 LEU 19 200.738 189.131 1.256 952 HB3 LEU 19 HB1 LEU 19 200.664 190.824 1.726 953 HG LEU 19 HG LEU 19 203.001 188.952 2.103 954 HD11 LEU 19 HD11 LEU 19 202.555 191.359 0.358 955 HD12 LEU 19 HD12 LEU 19 202.860 189.699 -0.161 956 HD13 LEU 19 HD13 LEU 19 204.136 190.629 0.627 957 HD21 LEU 19 HD21 LEU 19 203.185 190.274 3.999 958 HD22 LEU 19 HD22 LEU 19 202.468 191.681 3.204 959 HD23 LEU 19 HD23 LEU 19 204.122 191.192 2.822 960 H PHE 20 HN PHE 20 199.138 187.436 2.640 961 HA PHE 20 HA PHE 20 196.552 188.843 2.792 962 HB2 PHE 20 HB2 PHE 20 197.432 186.141 1.767 963 HB3 PHE 20 HB1 PHE 20 195.727 186.470 2.058 964 HD1 PHE 20 HD1 PHE 20 198.725 187.774 0.291 965 HD2 PHE 20 HD2 PHE 20 194.443 187.622 0.456 966 HE1 PHE 20 HE1 PHE 20 198.595 188.989 -1.861 967 HE2 PHE 20 HE2 PHE 20 194.310 188.812 -1.717 968 HZ PHE 20 HZ PHE 20 196.392 189.495 -2.879 969 H GLY 21 HN GLY 21 198.530 186.990 4.835 970 HA2 GLY 21 HA2 GLY 21 198.159 186.252 7.004 971 HA3 GLY 21 HA1 GLY 21 196.512 186.874 6.887 972 H THR 22 HN THR 22 196.604 184.527 8.132 973 HA THR 22 HA THR 22 196.156 182.414 6.111 974 HB THR 22 HB THR 22 197.589 181.486 7.685 975 HG1 THR 22 HG1 THR 22 196.321 179.955 8.311 976 HG21 THR 22 HG21 THR 22 197.780 183.354 9.177 977 HG22 THR 22 HG22 THR 22 197.319 181.962 10.157 978 HG23 THR 22 HG23 THR 22 196.112 183.170 9.716 979 H LYS 23 HN LYS 23 194.592 184.063 8.829 980 HA LYS 23 HA LYS 23 192.213 182.518 8.812 981 HB2 LYS 23 HB2 LYS 23 192.856 184.041 10.658 982 HB3 LYS 23 HB1 LYS 23 192.554 185.422 9.604 983 HG2 LYS 23 HG2 LYS 23 190.201 184.755 9.366 984 HG3 LYS 23 HG1 LYS 23 190.491 183.331 10.365 985 HD2 LYS 23 HD2 LYS 23 191.125 184.791 12.257 986 HD3 LYS 23 HD1 LYS 23 190.813 186.212 11.258 987 HE2 LYS 23 HE2 LYS 23 188.462 185.538 11.006 988 HE3 LYS 23 HE1 LYS 23 188.762 184.095 11.974 989 HZ1 LYS 23 HZ1 LYS 23 187.998 186.539 12.918 990 HZ2 LYS 23 HZ2 LYS 23 189.659 186.476 13.272 991 HZ3 LYS 23 HZ3 LYS 23 188.618 185.261 13.844 992 H LYS 24 HN LYS 24 193.017 185.599 7.169 993 HA LYS 24 HA LYS 24 190.492 185.924 5.944 994 HB2 LYS 24 HB2 LYS 24 193.232 186.958 5.206 995 HB3 LYS 24 HB1 LYS 24 191.763 187.433 4.360 996 HG2 LYS 24 HG2 LYS 24 190.811 188.241 6.506 997 HG3 LYS 24 HG1 LYS 24 192.313 187.802 7.320 998 HD2 LYS 24 HD2 LYS 24 193.570 189.373 5.931 999 HD3 LYS 24 HD1 LYS 24 192.110 189.774 5.025 1000 HE2 LYS 24 HE2 LYS 24 191.062 190.646 7.077 1001 HE3 LYS 24 HE1 LYS 24 192.503 190.229 8.002 1002 HZ1 LYS 24 HZ1 LYS 24 192.059 192.412 6.130 1003 HZ2 LYS 24 HZ2 LYS 24 193.589 191.675 6.067 1004 HZ3 LYS 24 HZ3 LYS 24 193.028 192.355 7.520 1005 H LEU 25 HN LEU 25 193.493 184.348 4.872 1006 HA LEU 25 HA LEU 25 192.636 183.762 2.265 1007 HB2 LEU 25 HB2 LEU 25 194.965 183.593 2.817 1008 HB3 LEU 25 HB1 LEU 25 194.656 182.361 4.036 1009 HG LEU 25 HG LEU 25 193.708 181.789 1.242 1010 HD11 LEU 25 HD11 LEU 25 195.929 182.658 0.792 1011 HD12 LEU 25 HD12 LEU 25 195.972 180.901 0.655 1012 HD13 LEU 25 HD13 LEU 25 196.620 181.691 2.095 1013 HD21 LEU 25 HD21 LEU 25 193.675 180.285 3.498 1014 HD22 LEU 25 HD22 LEU 25 195.271 179.848 2.925 1015 HD23 LEU 25 HD23 LEU 25 193.864 179.572 1.898 1016 H GLY 26 HN GLY 26 191.735 182.354 5.310 1017 HA2 GLY 26 HA2 GLY 26 190.933 179.803 4.331 1018 HA3 GLY 26 HA1 GLY 26 190.375 180.559 5.820 1019 H SER 27 HN SER 27 189.085 182.772 5.037 1020 HA SER 27 HA SER 27 186.606 181.808 4.083 1021 HB2 SER 27 HB2 SER 27 185.951 184.191 4.003 1022 HB3 SER 27 HB1 SER 27 186.745 183.773 5.518 1023 HG SER 27 HG SER 27 188.408 184.976 4.981 1024 H ILE 28 HN ILE 28 189.237 183.596 2.451 1025 HA ILE 28 HA ILE 28 187.876 183.995 0.012 1026 HB ILE 28 HB ILE 28 190.830 183.745 0.621 1027 HG12 ILE 28 HG12 ILE 28 189.155 186.190 -0.013 1028 HG13 ILE 28 HG11 ILE 28 189.459 185.640 1.635 1029 HG21 ILE 28 HG21 ILE 28 190.619 183.275 -1.709 1030 HG22 ILE 28 HG22 ILE 28 191.011 184.993 -1.614 1031 HG23 ILE 28 HG23 ILE 28 189.349 184.482 -1.913 1032 HD11 ILE 28 HD11 ILE 28 191.562 186.427 -0.404 1033 HD12 ILE 28 HD12 ILE 28 191.907 185.788 1.204 1034 HD13 ILE 28 HD13 ILE 28 191.102 187.348 1.027 1035 H GLY 29 HN GLY 29 190.092 181.359 1.041 1036 HA2 GLY 29 HA2 GLY 29 189.984 179.948 -1.406 1037 HA3 GLY 29 HA1 GLY 29 190.425 179.259 0.151 1038 H SER 30 HN SER 30 188.137 179.423 1.638 1039 HA SER 30 HA SER 30 186.585 177.289 0.667 1040 HB2 SER 30 HB2 SER 30 185.795 179.342 2.751 1041 HB3 SER 30 HB1 SER 30 185.082 177.748 2.530 1042 HG SER 30 HG SER 30 187.708 178.427 3.347 1043 H ASP 31 HN ASP 31 186.108 180.798 0.513 1044 HA ASP 31 HA ASP 31 183.469 180.706 -0.512 1045 HB2 ASP 31 HB2 ASP 31 185.623 182.817 -0.582 1046 HB3 ASP 31 HB1 ASP 31 184.128 183.030 -1.489 1047 H LEU 32 HN LEU 32 186.639 180.797 -2.094 1048 HA LEU 32 HA LEU 32 185.421 180.646 -4.740 1049 HB2 LEU 32 HB2 LEU 32 188.316 180.500 -3.859 1050 HB3 LEU 32 HB1 LEU 32 187.776 180.531 -5.532 1051 HG LEU 32 HG LEU 32 187.051 182.691 -3.532 1052 HD11 LEU 32 HD11 LEU 32 189.349 182.578 -5.507 1053 HD12 LEU 32 HD12 LEU 32 189.481 182.627 -3.748 1054 HD13 LEU 32 HD13 LEU 32 188.852 184.023 -4.627 1055 HD21 LEU 32 HD21 LEU 32 186.851 183.966 -5.801 1056 HD22 LEU 32 HD22 LEU 32 185.569 182.843 -5.371 1057 HD23 LEU 32 HD23 LEU 32 186.806 182.361 -6.530 1058 H GLY 33 HN GLY 33 186.250 178.387 -2.327 1059 HA2 GLY 33 HA2 GLY 33 186.924 176.240 -4.157 1060 HA3 GLY 33 HA1 GLY 33 186.754 176.121 -2.412 1061 H ALA 34 HN ALA 34 184.089 177.751 -3.648 1062 HA ALA 34 HA ALA 34 182.303 175.670 -2.959 1063 HB1 ALA 34 HB1 ALA 34 180.640 177.232 -4.288 1064 HB2 ALA 34 HB2 ALA 34 182.002 178.353 -4.281 1065 HB3 ALA 34 HB3 ALA 34 181.330 177.775 -2.759 1066 H SER 35 HN SER 35 183.639 176.721 -6.066 1067 HA SER 35 HA SER 35 181.961 175.117 -7.698 1068 HB2 SER 35 HB2 SER 35 184.793 175.997 -8.295 1069 HB3 SER 35 HB1 SER 35 183.553 175.538 -9.459 1070 HG SER 35 HG SER 35 182.313 177.318 -8.659 1071 H ILE 36 HN ILE 36 185.008 174.506 -6.060 1072 HA ILE 36 HA ILE 36 185.631 172.040 -7.278 1073 HB ILE 36 HB ILE 36 186.329 173.135 -4.543 1074 HG12 ILE 36 HG12 ILE 36 188.046 172.727 -6.999 1075 HG13 ILE 36 HG11 ILE 36 187.222 174.243 -6.671 1076 HG21 ILE 36 HG21 ILE 36 186.531 170.772 -4.287 1077 HG22 ILE 36 HG22 ILE 36 188.155 171.315 -4.701 1078 HG23 ILE 36 HG23 ILE 36 187.136 170.570 -5.932 1079 HD11 ILE 36 HD11 ILE 36 189.285 172.896 -4.909 1080 HD12 ILE 36 HD12 ILE 36 188.375 174.335 -4.451 1081 HD13 ILE 36 HD13 ILE 36 189.491 174.394 -5.815 1082 H LYS 37 HN LYS 37 183.668 172.852 -4.460 1083 HA LYS 37 HA LYS 37 183.169 170.276 -3.501 1084 HB2 LYS 37 HB2 LYS 37 182.466 172.376 -2.347 1085 HB3 LYS 37 HB1 LYS 37 181.212 172.596 -3.569 1086 HG2 LYS 37 HG2 LYS 37 180.164 170.491 -2.929 1087 HG3 LYS 37 HG1 LYS 37 181.454 170.170 -1.768 1088 HD2 LYS 37 HD2 LYS 37 180.833 172.223 -0.525 1089 HD3 LYS 37 HD1 LYS 37 179.529 172.514 -1.676 1090 HE2 LYS 37 HE2 LYS 37 178.453 170.411 -1.045 1091 HE3 LYS 37 HE1 LYS 37 179.785 170.028 0.045 1092 HZ1 LYS 37 HZ1 LYS 37 178.553 171.049 1.578 1093 HZ2 LYS 37 HZ2 LYS 37 177.547 171.794 0.430 1094 HZ3 LYS 37 HZ3 LYS 37 179.036 172.500 0.844 1095 H GLY 38 HN GLY 38 181.650 172.059 -6.176 1096 HA2 GLY 38 HA2 GLY 38 179.575 170.165 -6.639 1097 HA3 GLY 38 HA1 GLY 38 180.125 171.384 -7.775 1098 H PHE 39 HN PHE 39 182.840 170.581 -8.051 1099 HA PHE 39 HA PHE 39 182.580 168.570 -10.018 1100 HB2 PHE 39 HB2 PHE 39 184.910 169.818 -8.581 1101 HB3 PHE 39 HB1 PHE 39 185.183 168.437 -9.644 1102 HD1 PHE 39 HD1 PHE 39 183.051 171.548 -9.764 1103 HD2 PHE 39 HD2 PHE 39 185.906 169.051 -11.785 1104 HE1 PHE 39 HE1 PHE 39 182.972 173.049 -11.729 1105 HE2 PHE 39 HE2 PHE 39 185.820 170.557 -13.752 1106 HZ PHE 39 HZ PHE 39 184.354 172.555 -13.724 1107 H LYS 40 HN LYS 40 183.786 168.453 -6.684 1108 HA LYS 40 HA LYS 40 184.460 165.724 -6.614 1109 HB2 LYS 40 HB2 LYS 40 184.948 167.535 -4.871 1110 HB3 LYS 40 HB1 LYS 40 183.310 167.262 -4.281 1111 HG2 LYS 40 HG2 LYS 40 183.807 164.936 -3.812 1112 HG3 LYS 40 HG1 LYS 40 185.403 165.086 -4.551 1113 HD2 LYS 40 HD2 LYS 40 186.030 166.765 -2.846 1114 HD3 LYS 40 HD1 LYS 40 184.441 166.595 -2.099 1115 HE2 LYS 40 HE2 LYS 40 184.898 164.213 -1.656 1116 HE3 LYS 40 HE1 LYS 40 186.482 164.373 -2.416 1117 HZ1 LYS 40 HZ1 LYS 40 185.800 164.902 0.229 1118 HZ2 LYS 40 HZ2 LYS 40 186.165 166.398 -0.489 1119 HZ3 LYS 40 HZ3 LYS 40 187.302 165.135 -0.524 1120 H LYS 41 HN LYS 41 181.384 167.360 -5.815 1121 HA LYS 41 HA LYS 41 179.974 165.065 -5.027 1122 HB2 LYS 41 HB2 LYS 41 179.371 167.611 -4.837 1123 HB3 LYS 41 HB1 LYS 41 178.621 167.376 -6.413 1124 HG2 LYS 41 HG2 LYS 41 177.200 165.607 -5.510 1125 HG3 LYS 41 HG1 LYS 41 178.012 165.720 -3.946 1126 HD2 LYS 41 HD2 LYS 41 177.283 168.075 -3.750 1127 HD3 LYS 41 HD1 LYS 41 176.423 167.924 -5.282 1128 HE2 LYS 41 HE2 LYS 41 174.787 167.562 -3.550 1129 HE3 LYS 41 HE1 LYS 41 175.142 165.981 -4.247 1130 HZ1 LYS 41 HZ1 LYS 41 175.321 166.670 -1.603 1131 HZ2 LYS 41 HZ2 LYS 41 176.935 166.632 -2.131 1132 HZ3 LYS 41 HZ3 LYS 41 175.945 165.265 -2.323 1133 H ALA 42 HN ALA 42 180.018 166.727 -8.219 1134 HA ALA 42 HA ALA 42 178.306 164.914 -9.514 1135 HB1 ALA 42 HB1 ALA 42 179.132 165.774 -11.582 1136 HB2 ALA 42 HB2 ALA 42 180.647 166.279 -10.837 1137 HB3 ALA 42 HB3 ALA 42 179.145 167.108 -10.429 1138 H MET 43 HN MET 43 181.891 164.732 -9.178 1139 HA MET 43 HA MET 43 182.017 162.276 -10.659 1140 HB2 MET 43 HB2 MET 43 183.862 164.099 -10.290 1141 HB3 MET 43 HB1 MET 43 184.179 163.234 -8.789 1142 HG2 MET 43 HG2 MET 43 184.428 161.127 -10.130 1143 HG3 MET 43 HG1 MET 43 184.263 162.093 -11.595 1144 HE1 MET 43 HE1 MET 43 187.184 164.106 -12.080 1145 HE2 MET 43 HE2 MET 43 186.299 164.904 -10.781 1146 HE3 MET 43 HE3 MET 43 185.420 164.077 -12.064 1147 H SER 44 HN SER 44 180.413 162.633 -7.938 1148 HA SER 44 HA SER 44 181.365 160.064 -6.810 1149 HB2 SER 44 HB2 SER 44 181.319 160.854 -4.614 1150 HB3 SER 44 HB1 SER 44 182.026 162.208 -5.491 1151 HG SER 44 HG SER 44 180.373 162.969 -4.189 1152 H ASP 45 HN ASP 45 178.749 162.289 -7.464 1153 HA ASP 45 HA ASP 45 176.655 160.974 -6.123 1154 HB2 ASP 45 HB2 ASP 45 176.349 163.189 -7.096 1155 HB3 ASP 45 HB1 ASP 45 176.586 162.541 -8.720 1156 H ASP 46 HN ASP 46 177.842 160.548 -9.489 1157 HA ASP 46 HA ASP 46 177.257 158.949 -11.067 1158 HB2 ASP 46 HB2 ASP 46 177.994 156.771 -10.425 1159 HB3 ASP 46 HB1 ASP 46 179.013 157.938 -9.587 1160 H GLU 47 HN GLU 47 174.853 159.966 -10.438 1161 HA GLU 47 HA GLU 47 173.062 157.760 -10.745 1162 HB2 GLU 47 HB2 GLU 47 173.548 157.765 -8.226 1163 HB3 GLU 47 HB1 GLU 47 172.662 159.291 -8.173 1164 HG2 GLU 47 HG2 GLU 47 171.059 157.585 -7.700 1165 HG3 GLU 47 HG1 GLU 47 170.762 158.089 -9.362 1166 HA PRO 48 HA PRO 48 171.533 161.841 -12.244 1167 HB2 PRO 48 HB2 PRO 48 170.746 161.082 -14.727 1168 HB3 PRO 48 HB1 PRO 48 172.442 161.434 -14.338 1169 HG2 PRO 48 HG2 PRO 48 171.069 158.797 -14.607 1170 HG3 PRO 48 HG1 PRO 48 172.686 159.285 -15.146 1171 HD2 PRO 48 HD2 PRO 48 172.194 157.849 -12.831 1172 HD3 PRO 48 HD1 PRO 48 173.640 158.852 -13.083 1173 H LYS 49 HN LYS 49 169.382 162.604 -12.662 1174 HA LYS 49 HA LYS 49 167.320 160.850 -11.553 1175 HB2 LYS 49 HB2 LYS 49 167.333 163.794 -12.260 1176 HB3 LYS 49 HB1 LYS 49 165.940 162.943 -11.592 1177 HG2 LYS 49 HG2 LYS 49 167.297 162.300 -9.616 1178 HG3 LYS 49 HG1 LYS 49 168.661 163.205 -10.277 1179 HD2 LYS 49 HD2 LYS 49 167.344 165.277 -10.213 1180 HD3 LYS 49 HD1 LYS 49 165.952 164.385 -9.597 1181 HE2 LYS 49 HE2 LYS 49 167.310 165.579 -7.823 1182 HE3 LYS 49 HE1 LYS 49 167.098 163.849 -7.551 1183 HZ1 LYS 49 HZ1 LYS 49 169.414 164.554 -9.131 1184 HZ2 LYS 49 HZ2 LYS 49 169.267 163.452 -7.847 1185 HZ3 LYS 49 HZ3 LYS 49 169.464 165.109 -7.529 1186 HCN FME 1 HCN FME 1 227.009 181.158 -17.648 1187 HA FME 1 HA FME 1 227.318 183.928 -20.578 1188 HB2 FME 1 HB2 FME 1 225.453 181.543 -20.713 1189 HB3 FME 1 HB1 FME 1 225.934 182.583 -22.052 1190 HG2 FME 1 HG2 FME 1 228.374 181.872 -21.390 1191 HG3 FME 1 HG1 FME 1 227.567 180.534 -20.572 1192 HE1 FME 1 HE1 FME 1 228.056 181.358 -25.013 1193 HE2 FME 1 HE2 FME 1 229.265 181.516 -23.741 1194 HE3 FME 1 HE3 FME 1 227.867 182.588 -23.755 1195 H GLY 2 HN GLY 2 224.694 183.967 -21.646 1196 HA2 GLY 2 HA2 GLY 2 223.503 185.985 -20.062 1197 HA3 GLY 2 HA1 GLY 2 222.751 185.184 -21.439 1198 H GLY 3 HN GLY 3 221.694 185.972 -18.745 1199 HA2 GLY 3 HA2 GLY 3 221.149 183.464 -17.392 1200 HA3 GLY 3 HA1 GLY 3 220.525 185.051 -16.954 1201 H ILE 4 HN ILE 4 218.878 185.977 -18.520 1202 HA ILE 4 HA ILE 4 216.668 185.755 -19.197 1203 HB ILE 4 HB ILE 4 218.020 183.767 -21.045 1204 HG12 ILE 4 HG12 ILE 4 217.530 186.734 -21.429 1205 HG13 ILE 4 HG11 ILE 4 219.070 186.064 -20.891 1206 HG21 ILE 4 HG21 ILE 4 216.200 184.483 -22.600 1207 HG22 ILE 4 HG22 ILE 4 215.472 185.394 -21.275 1208 HG23 ILE 4 HG23 ILE 4 215.590 183.637 -21.179 1209 HD11 ILE 4 HD11 ILE 4 219.267 184.757 -22.945 1210 HD12 ILE 4 HD12 ILE 4 219.010 186.453 -23.355 1211 HD13 ILE 4 HD13 ILE 4 217.677 185.306 -23.477 1212 H SER 5 HN SER 5 216.061 184.735 -17.136 1213 HA SER 5 HA SER 5 215.428 181.851 -17.395 1214 HB2 SER 5 HB2 SER 5 216.853 181.983 -15.565 1215 HB3 SER 5 HB1 SER 5 216.214 183.537 -15.058 1216 HG SER 5 HG SER 5 215.317 180.976 -14.563 1217 H ILE 6 HN ILE 6 213.453 181.211 -17.360 1218 HA ILE 6 HA ILE 6 211.291 183.038 -17.464 1219 HB ILE 6 HB ILE 6 211.587 180.580 -18.447 1220 HG12 ILE 6 HG12 ILE 6 208.934 181.637 -17.415 1221 HG13 ILE 6 HG11 ILE 6 209.707 182.117 -18.925 1222 HG21 ILE 6 HG21 ILE 6 209.921 179.981 -16.006 1223 HG22 ILE 6 HG22 ILE 6 211.650 179.636 -16.068 1224 HG23 ILE 6 HG23 ILE 6 210.553 178.849 -17.203 1225 HD11 ILE 6 HD11 ILE 6 208.112 180.448 -19.522 1226 HD12 ILE 6 HD12 ILE 6 208.605 179.400 -18.192 1227 HD13 ILE 6 HD13 ILE 6 209.681 179.646 -19.568 1228 H TRP 7 HN TRP 7 212.884 181.308 -14.847 1229 HA TRP 7 HA TRP 7 210.664 181.398 -13.089 1230 HB2 TRP 7 HB2 TRP 7 213.613 181.138 -12.658 1231 HB3 TRP 7 HB1 TRP 7 212.632 181.603 -11.268 1232 HD1 TRP 7 HD1 TRP 7 213.362 178.641 -13.543 1233 HE1 TRP 7 HE1 TRP 7 212.035 176.606 -12.654 1234 HE3 TRP 7 HE3 TRP 7 210.526 180.948 -9.986 1235 HZ2 TRP 7 HZ2 TRP 7 209.994 176.070 -10.692 1236 HZ3 TRP 7 HZ3 TRP 7 208.916 179.655 -8.618 1237 HH2 TRP 7 HH2 TRP 7 208.665 177.220 -8.972 1238 H GLN 8 HN GLN 8 212.902 183.856 -14.123 1239 HA GLN 8 HA GLN 8 212.464 185.719 -12.031 1240 HB2 GLN 8 HB2 GLN 8 213.349 185.947 -14.887 1241 HB3 GLN 8 HB1 GLN 8 212.997 187.406 -13.982 1242 HG2 GLN 8 HG2 GLN 8 215.409 186.716 -13.879 1243 HG3 GLN 8 HG1 GLN 8 214.641 186.856 -12.301 1244 HE21 GLN 8 HE21 GLN 8 216.299 185.335 -11.453 1245 HE22 GLN 8 HE22 GLN 8 216.147 183.671 -11.751 1246 H LEU 9 HN LEU 9 210.568 184.938 -14.896 1247 HA LEU 9 HA LEU 9 208.771 187.139 -14.755 1248 HB2 LEU 9 HB2 LEU 9 208.992 185.934 -16.803 1249 HB3 LEU 9 HB1 LEU 9 208.647 184.401 -16.038 1250 HG LEU 9 HG LEU 9 206.628 186.616 -15.884 1251 HD11 LEU 9 HD11 LEU 9 207.294 185.009 -18.324 1252 HD12 LEU 9 HD12 LEU 9 206.820 186.706 -18.184 1253 HD13 LEU 9 HD13 LEU 9 205.609 185.448 -18.015 1254 HD21 LEU 9 HD21 LEU 9 205.641 184.898 -14.718 1255 HD22 LEU 9 HD22 LEU 9 206.612 183.654 -15.509 1256 HD23 LEU 9 HD23 LEU 9 205.196 184.316 -16.311 1257 H LEU 10 HN LEU 10 208.740 183.819 -13.383 1258 HA LEU 10 HA LEU 10 206.066 183.810 -12.470 1259 HB2 LEU 10 HB2 LEU 10 208.623 182.415 -11.728 1260 HB3 LEU 10 HB1 LEU 10 207.206 182.177 -10.711 1261 HG LEU 10 HG LEU 10 206.794 181.874 -13.675 1262 HD11 LEU 10 HD11 LEU 10 207.479 179.331 -13.203 1263 HD12 LEU 10 HD12 LEU 10 208.565 180.080 -12.030 1264 HD13 LEU 10 HD13 LEU 10 208.670 180.505 -13.739 1265 HD21 LEU 10 HD21 LEU 10 205.921 180.031 -11.434 1266 HD22 LEU 10 HD22 LEU 10 205.138 180.319 -12.991 1267 HD23 LEU 10 HD23 LEU 10 205.075 181.559 -11.740 1268 H ILE 11 HN ILE 11 209.066 184.786 -10.792 1269 HA ILE 11 HA ILE 11 207.773 185.495 -8.367 1270 HB ILE 11 HB ILE 11 210.143 185.066 -8.373 1271 HG12 ILE 11 HG12 ILE 11 209.770 188.035 -7.899 1272 HG13 ILE 11 HG11 ILE 11 209.212 186.791 -6.778 1273 HG21 ILE 11 HG21 ILE 11 210.621 185.804 -10.660 1274 HG22 ILE 11 HG22 ILE 11 211.735 186.541 -9.511 1275 HG23 ILE 11 HG23 ILE 11 210.403 187.480 -10.171 1276 HD11 ILE 11 HD11 ILE 11 212.059 187.377 -7.622 1277 HD12 ILE 11 HD12 ILE 11 211.604 185.897 -6.777 1278 HD13 ILE 11 HD13 ILE 11 211.377 187.464 -5.998 1279 H ILE 12 HN ILE 12 208.683 187.425 -11.258 1280 HA ILE 12 HA ILE 12 207.822 189.906 -10.216 1281 HB ILE 12 HB ILE 12 208.138 188.894 -13.044 1282 HG12 ILE 12 HG12 ILE 12 209.725 190.804 -11.298 1283 HG13 ILE 12 HG11 ILE 12 210.193 189.170 -11.722 1284 HG21 ILE 12 HG21 ILE 12 207.301 191.641 -12.055 1285 HG22 ILE 12 HG22 ILE 12 206.460 190.611 -13.213 1286 HG23 ILE 12 HG23 ILE 12 207.973 191.376 -13.661 1287 HD11 ILE 12 HD11 ILE 12 210.100 189.883 -14.157 1288 HD12 ILE 12 HD12 ILE 12 211.389 190.624 -13.203 1289 HD13 ILE 12 HD13 ILE 12 209.931 191.537 -13.578 1290 H ALA 13 HN ALA 13 206.123 187.441 -12.144 1291 HA ALA 13 HA ALA 13 203.726 188.866 -12.488 1292 HB1 ALA 13 HB1 ALA 13 204.265 185.897 -12.312 1293 HB2 ALA 13 HB2 ALA 13 204.145 186.874 -13.775 1294 HB3 ALA 13 HB3 ALA 13 202.712 186.588 -12.786 1295 H VAL 14 HN VAL 14 204.852 186.741 -9.884 1296 HA VAL 14 HA VAL 14 202.437 186.631 -8.441 1297 HB VAL 14 HB VAL 14 205.333 186.339 -7.636 1298 HG11 VAL 14 HG11 VAL 14 204.249 185.338 -5.490 1299 HG12 VAL 14 HG12 VAL 14 202.846 186.309 -5.920 1300 HG13 VAL 14 HG13 VAL 14 204.396 187.088 -5.601 1301 HG21 VAL 14 HG21 VAL 14 203.061 184.338 -7.632 1302 HG22 VAL 14 HG22 VAL 14 204.786 184.007 -7.593 1303 HG23 VAL 14 HG23 VAL 14 204.049 184.632 -9.062 1304 H ILE 15 HN ILE 15 205.153 188.930 -8.266 1305 HA ILE 15 HA ILE 15 204.121 190.459 -6.136 1306 HB ILE 15 HB ILE 15 206.065 191.067 -8.373 1307 HG12 ILE 15 HG12 ILE 15 206.387 191.026 -5.386 1308 HG13 ILE 15 HG11 ILE 15 206.604 189.599 -6.372 1309 HG21 ILE 15 HG21 ILE 15 205.095 193.219 -7.998 1310 HG22 ILE 15 HG22 ILE 15 206.545 193.190 -6.997 1311 HG23 ILE 15 HG23 ILE 15 204.960 192.937 -6.264 1312 HD11 ILE 15 HD11 ILE 15 208.096 192.167 -6.927 1313 HD12 ILE 15 HD12 ILE 15 208.454 190.551 -7.534 1314 HD13 ILE 15 HD13 ILE 15 208.729 190.935 -5.835 1315 H VAL 16 HN VAL 16 203.703 190.797 -9.649 1316 HA VAL 16 HA VAL 16 202.191 193.162 -9.621 1317 HB VAL 16 HB VAL 16 202.146 190.781 -11.499 1318 HG11 VAL 16 HG11 VAL 16 201.067 192.414 -13.102 1319 HG12 VAL 16 HG12 VAL 16 200.771 193.460 -11.723 1320 HG13 VAL 16 HG13 VAL 16 200.020 191.870 -11.791 1321 HG21 VAL 16 HG21 VAL 16 204.240 192.157 -11.308 1322 HG22 VAL 16 HG22 VAL 16 203.305 193.558 -11.832 1323 HG23 VAL 16 HG23 VAL 16 203.513 192.178 -12.913 1324 H VAL 17 HN VAL 17 201.122 189.765 -9.419 1325 HA VAL 17 HA VAL 17 198.356 190.325 -9.341 1326 HB VAL 17 HB VAL 17 199.931 187.967 -8.290 1327 HG11 VAL 17 HG11 VAL 17 196.951 188.440 -8.542 1328 HG12 VAL 17 HG12 VAL 17 197.851 187.974 -7.097 1329 HG13 VAL 17 HG13 VAL 17 197.657 186.828 -8.423 1330 HG21 VAL 17 HG21 VAL 17 199.269 186.909 -10.351 1331 HG22 VAL 17 HG22 VAL 17 199.933 188.488 -10.773 1332 HG23 VAL 17 HG23 VAL 17 198.187 188.243 -10.751 1333 H LEU 18 HN LEU 18 200.748 189.950 -6.712 1334 HA LEU 18 HA LEU 18 198.844 190.143 -4.612 1335 HB2 LEU 18 HB2 LEU 18 201.718 191.058 -4.472 1336 HB3 LEU 18 HB1 LEU 18 200.684 190.596 -3.126 1337 HG LEU 18 HG LEU 18 202.062 188.862 -5.133 1338 HD11 LEU 18 HD11 LEU 18 202.858 189.392 -2.787 1339 HD12 LEU 18 HD12 LEU 18 202.873 187.716 -3.331 1340 HD13 LEU 18 HD13 LEU 18 201.583 188.280 -2.266 1341 HD21 LEU 18 HD21 LEU 18 199.503 188.110 -3.717 1342 HD22 LEU 18 HD22 LEU 18 200.606 186.933 -4.402 1343 HD23 LEU 18 HD23 LEU 18 199.793 188.088 -5.451 1344 H LEU 19 HN LEU 19 200.899 192.632 -6.175 1345 HA LEU 19 HA LEU 19 200.001 194.770 -4.546 1346 HB2 LEU 19 HB2 LEU 19 201.131 194.800 -7.357 1347 HB3 LEU 19 HB1 LEU 19 201.002 196.208 -6.304 1348 HG LEU 19 HG LEU 19 202.686 193.729 -5.848 1349 HD11 LEU 19 HD11 LEU 19 204.496 195.560 -5.703 1350 HD12 LEU 19 HD12 LEU 19 203.307 196.578 -6.504 1351 HD13 LEU 19 HD13 LEU 19 203.871 195.100 -7.282 1352 HD21 LEU 19 HD21 LEU 19 202.044 194.170 -3.670 1353 HD22 LEU 19 HD22 LEU 19 201.943 195.916 -3.948 1354 HD23 LEU 19 HD23 LEU 19 203.516 195.123 -3.819 1355 H PHE 20 HN PHE 20 198.819 193.523 -7.667 1356 HA PHE 20 HA PHE 20 196.635 195.502 -7.685 1357 HB2 PHE 20 HB2 PHE 20 197.583 193.376 -9.604 1358 HB3 PHE 20 HB1 PHE 20 195.972 194.072 -9.776 1359 HD1 PHE 20 HD2 PHE 20 195.658 196.434 -10.241 1360 HD2 PHE 20 HD1 PHE 20 199.561 194.691 -10.007 1361 HE1 PHE 20 HE2 PHE 20 196.607 198.440 -11.340 1362 HE2 PHE 20 HE1 PHE 20 200.521 196.689 -11.122 1363 HZ PHE 20 HZ PHE 20 199.047 198.566 -11.785 1364 H GLY 21 HN GLY 21 197.234 192.438 -6.375 1365 HA2 GLY 21 HA2 GLY 21 195.830 191.030 -5.174 1366 HA3 GLY 21 HA1 GLY 21 194.504 192.149 -5.496 1367 H THR 22 HN THR 22 193.733 189.611 -5.700 1368 HA THR 22 HA THR 22 194.011 188.803 -8.531 1369 HB THR 22 HB THR 22 193.489 186.624 -7.875 1370 HG1 THR 22 HG1 THR 22 192.660 186.924 -5.350 1371 HG21 THR 22 HG21 THR 22 194.623 187.641 -5.271 1372 HG22 THR 22 HG22 THR 22 195.585 187.620 -6.747 1373 HG23 THR 22 HG23 THR 22 194.953 186.113 -6.088 1374 H LYS 23 HN LYS 23 191.594 189.595 -6.070 1375 HA LYS 23 HA LYS 23 189.322 189.071 -7.693 1376 HB2 LYS 23 HB2 LYS 23 189.782 190.744 -5.234 1377 HB3 LYS 23 HB1 LYS 23 188.235 190.824 -6.072 1378 HG2 LYS 23 HG2 LYS 23 187.949 188.392 -5.818 1379 HG3 LYS 23 HG1 LYS 23 189.510 188.269 -5.013 1380 HD2 LYS 23 HD2 LYS 23 188.735 189.677 -3.188 1381 HD3 LYS 23 HD1 LYS 23 187.204 189.959 -4.016 1382 HE2 LYS 23 HE2 LYS 23 186.852 188.230 -2.353 1383 HE3 LYS 23 HE1 LYS 23 186.784 187.483 -3.949 1384 HZ1 LYS 23 HZ1 LYS 23 188.484 186.849 -1.834 1385 HZ2 LYS 23 HZ2 LYS 23 189.450 187.509 -3.066 1386 HZ3 LYS 23 HZ3 LYS 23 188.455 186.169 -3.387 1387 H LYS 24 HN LYS 24 191.140 192.099 -7.120 1388 HA LYS 24 HA LYS 24 189.514 193.722 -8.764 1389 HB2 LYS 24 HB2 LYS 24 192.418 193.999 -7.972 1390 HB3 LYS 24 HB1 LYS 24 191.477 195.259 -8.763 1391 HG2 LYS 24 HG2 LYS 24 189.895 195.284 -6.881 1392 HG3 LYS 24 HG1 LYS 24 190.797 193.991 -6.090 1393 HD2 LYS 24 HD2 LYS 24 192.786 195.437 -5.962 1394 HD3 LYS 24 HD1 LYS 24 191.907 196.731 -6.778 1395 HE2 LYS 24 HE2 LYS 24 191.857 197.153 -4.385 1396 HE3 LYS 24 HE1 LYS 24 190.235 196.698 -4.907 1397 HZ1 LYS 24 HZ1 LYS 24 191.937 194.493 -4.124 1398 HZ2 LYS 24 HZ2 LYS 24 190.306 194.794 -3.754 1399 HZ3 LYS 24 HZ3 LYS 24 191.536 195.559 -2.866 1400 H LEU 25 HN LEU 25 192.458 191.835 -9.406 1401 HA LEU 25 HA LEU 25 192.825 192.698 -12.049 1402 HB2 LEU 25 HB2 LEU 25 194.595 191.549 -10.910 1403 HB3 LEU 25 HB1 LEU 25 193.615 190.105 -10.698 1404 HG LEU 25 HG LEU 25 194.014 191.118 -13.503 1405 HD11 LEU 25 HD11 LEU 25 196.137 189.676 -13.570 1406 HD12 LEU 25 HD12 LEU 25 196.146 189.808 -11.809 1407 HD13 LEU 25 HD13 LEU 25 196.271 191.258 -12.806 1408 HD21 LEU 25 HD21 LEU 25 192.763 188.882 -12.477 1409 HD22 LEU 25 HD22 LEU 25 194.362 188.234 -12.810 1410 HD23 LEU 25 HD23 LEU 25 193.425 188.981 -14.102 1411 H GLY 26 HN GLY 26 190.468 190.539 -10.685 1412 HA2 GLY 26 HA2 GLY 26 189.903 189.049 -13.044 1413 HA3 GLY 26 HA1 GLY 26 188.823 189.254 -11.669 1414 H SER 27 HN SER 27 188.306 191.878 -11.575 1415 HA SER 27 HA SER 27 186.433 192.270 -13.661 1416 HB2 SER 27 HB2 SER 27 186.181 194.542 -12.714 1417 HB3 SER 27 HB1 SER 27 186.153 193.301 -11.465 1418 HG SER 27 HG SER 27 188.568 193.770 -11.465 1419 H ILE 28 HN ILE 28 189.718 193.594 -13.143 1420 HA ILE 28 HA ILE 28 189.674 195.396 -15.315 1421 HB ILE 28 HB ILE 28 191.973 193.966 -13.963 1422 HG12 ILE 28 HG12 ILE 28 191.094 196.859 -13.777 1423 HG13 ILE 28 HG11 ILE 28 190.515 195.617 -12.668 1424 HG21 ILE 28 HG21 ILE 28 191.907 196.088 -16.117 1425 HG22 ILE 28 HG22 ILE 28 192.829 194.586 -16.090 1426 HG23 ILE 28 HG23 ILE 28 193.287 195.919 -15.031 1427 HD11 ILE 28 HD11 ILE 28 193.449 196.191 -13.152 1428 HD12 ILE 28 HD12 ILE 28 192.758 195.149 -11.908 1429 HD13 ILE 28 HD13 ILE 28 192.521 196.895 -11.826 1430 H GLY 29 HN GLY 29 190.850 192.008 -15.116 1431 HA2 GLY 29 HA2 GLY 29 191.700 191.852 -17.810 1432 HA3 GLY 29 HA1 GLY 29 191.294 190.481 -16.788 1433 H SER 30 HN SER 30 188.618 190.756 -16.301 1434 HA SER 30 HA SER 30 187.446 189.863 -18.692 1435 HB2 SER 30 HB2 SER 30 186.008 190.999 -16.282 1436 HB3 SER 30 HB1 SER 30 185.337 189.922 -17.502 1437 HG SER 30 HG SER 30 186.891 188.368 -16.842 1438 H ASP 31 HN ASP 31 187.509 193.061 -17.168 1439 HA ASP 31 HA ASP 31 185.634 194.272 -18.903 1440 HB2 ASP 31 HB2 ASP 31 186.403 195.267 -16.745 1441 HB3 ASP 31 HB1 ASP 31 187.934 195.660 -17.519 1442 H LEU 32 HN LEU 32 189.166 193.966 -19.043 1443 HA LEU 32 HA LEU 32 189.285 195.337 -21.609 1444 HB2 LEU 32 HB2 LEU 32 191.405 193.881 -20.008 1445 HB3 LEU 32 HB1 LEU 32 191.706 194.779 -21.491 1446 HG LEU 32 HG LEU 32 190.430 196.010 -19.030 1447 HD11 LEU 32 HD11 LEU 32 193.324 196.121 -19.930 1448 HD12 LEU 32 HD12 LEU 32 192.723 195.204 -18.547 1449 HD13 LEU 32 HD13 LEU 32 192.634 196.967 -18.544 1450 HD21 LEU 32 HD21 LEU 32 191.431 197.058 -21.682 1451 HD22 LEU 32 HD22 LEU 32 191.426 198.107 -20.266 1452 HD23 LEU 32 HD23 LEU 32 189.919 197.413 -20.847 1453 H GLY 33 HN GLY 33 188.646 192.145 -20.592 1454 HA2 GLY 33 HA2 GLY 33 189.814 190.855 -22.918 1455 HA3 GLY 33 HA1 GLY 33 188.853 190.086 -21.663 1456 H ALA 34 HN ALA 34 187.258 192.863 -22.697 1457 HA ALA 34 HA ALA 34 185.124 191.398 -23.828 1458 HB1 ALA 34 HB1 ALA 34 185.496 194.340 -24.358 1459 HB2 ALA 34 HB2 ALA 34 185.147 193.775 -22.722 1460 HB3 ALA 34 HB3 ALA 34 184.016 193.446 -24.036 1461 H SER 35 HN SER 35 187.850 193.142 -25.284 1462 HA SER 35 HA SER 35 186.918 193.006 -27.962 1463 HB2 SER 35 HB2 SER 35 189.789 193.069 -27.011 1464 HB3 SER 35 HB1 SER 35 189.188 193.553 -28.594 1465 HG SER 35 HG SER 35 188.045 195.219 -27.595 1466 H ILE 36 HN ILE 36 188.785 190.804 -25.953 1467 HA ILE 36 HA ILE 36 189.596 189.014 -27.981 1468 HB ILE 36 HB ILE 36 189.101 188.573 -25.026 1469 HG12 ILE 36 HG12 ILE 36 191.690 188.667 -26.583 1470 HG13 ILE 36 HG11 ILE 36 190.994 190.101 -25.846 1471 HG21 ILE 36 HG21 ILE 36 190.126 186.708 -27.177 1472 HG22 ILE 36 HG22 ILE 36 188.883 186.396 -25.966 1473 HG23 ILE 36 HG23 ILE 36 190.575 186.497 -25.484 1474 HD11 ILE 36 HD11 ILE 36 192.609 189.148 -24.302 1475 HD12 ILE 36 HD12 ILE 36 191.839 187.566 -24.418 1476 HD13 ILE 36 HD13 ILE 36 190.991 188.905 -23.644 1477 H LYS 37 HN LYS 37 186.671 189.183 -26.002 1478 HA LYS 37 HA LYS 37 185.499 186.761 -26.748 1479 HB2 LYS 37 HB2 LYS 37 184.283 189.431 -26.046 1480 HB3 LYS 37 HB1 LYS 37 183.307 187.996 -26.356 1481 HG2 LYS 37 HG2 LYS 37 184.475 186.790 -24.565 1482 HG3 LYS 37 HG1 LYS 37 185.510 188.186 -24.281 1483 HD2 LYS 37 HD2 LYS 37 183.807 188.355 -22.628 1484 HD3 LYS 37 HD1 LYS 37 183.353 189.516 -23.871 1485 HE2 LYS 37 HE2 LYS 37 181.656 188.088 -24.738 1486 HE3 LYS 37 HE1 LYS 37 182.278 186.685 -23.872 1487 HZ1 LYS 37 HZ1 LYS 37 181.337 189.080 -22.431 1488 HZ2 LYS 37 HZ2 LYS 37 181.508 187.490 -21.856 1489 HZ3 LYS 37 HZ3 LYS 37 180.251 187.879 -22.932 1490 H GLY 38 HN GLY 38 185.580 189.884 -28.443 1491 HA2 GLY 38 HA2 GLY 38 183.737 189.143 -30.479 1492 HA3 GLY 38 HA1 GLY 38 184.880 190.471 -30.562 1493 H PHE 39 HN PHE 39 187.311 189.006 -30.275 1494 HA PHE 39 HA PHE 39 187.740 188.208 -32.949 1495 HB2 PHE 39 HB2 PHE 39 189.290 187.907 -30.387 1496 HB3 PHE 39 HB1 PHE 39 189.849 187.079 -31.839 1497 HD1 PHE 39 HD1 PHE 39 188.409 190.477 -31.058 1498 HD2 PHE 39 HD2 PHE 39 191.541 188.235 -32.964 1499 HE1 PHE 39 HE1 PHE 39 189.430 192.585 -31.863 1500 HE2 PHE 39 HE2 PHE 39 192.556 190.345 -33.770 1501 HZ PHE 39 HZ PHE 39 191.503 192.521 -33.220 1502 H LYS 40 HN LYS 40 187.264 186.326 -29.982 1503 HA LYS 40 HA LYS 40 187.506 183.763 -31.101 1504 HB2 LYS 40 HB2 LYS 40 187.447 184.242 -28.677 1505 HB3 LYS 40 HB1 LYS 40 185.741 184.659 -28.817 1506 HG2 LYS 40 HG2 LYS 40 185.188 182.405 -29.518 1507 HG3 LYS 40 HG1 LYS 40 186.891 181.967 -29.591 1508 HD2 LYS 40 HD2 LYS 40 186.120 181.105 -27.504 1509 HD3 LYS 40 HD1 LYS 40 187.015 182.567 -27.103 1510 HE2 LYS 40 HE2 LYS 40 184.789 182.317 -25.915 1511 HE3 LYS 40 HE1 LYS 40 184.983 183.825 -26.801 1512 HZ1 LYS 40 HZ1 LYS 40 183.592 183.102 -28.490 1513 HZ2 LYS 40 HZ2 LYS 40 182.827 182.511 -27.093 1514 HZ3 LYS 40 HZ3 LYS 40 183.746 181.466 -28.069 1515 H LYS 41 HN LYS 41 184.626 185.833 -30.668 1516 HA LYS 41 HA LYS 41 182.738 184.028 -31.702 1517 HB2 LYS 41 HB2 LYS 41 182.238 186.110 -30.418 1518 HB3 LYS 41 HB1 LYS 41 182.666 187.047 -31.849 1519 HG2 LYS 41 HG2 LYS 41 180.896 185.990 -33.132 1520 HG3 LYS 41 HG1 LYS 41 180.516 184.912 -31.786 1521 HD2 LYS 41 HD2 LYS 41 179.990 186.906 -30.387 1522 HD3 LYS 41 HD1 LYS 41 180.269 187.931 -31.794 1523 HE2 LYS 41 HE2 LYS 41 178.451 186.874 -33.004 1524 HE3 LYS 41 HE1 LYS 41 178.235 185.686 -31.719 1525 HZ1 LYS 41 HZ1 LYS 41 177.420 187.290 -30.267 1526 HZ2 LYS 41 HZ2 LYS 41 176.686 187.685 -31.747 1527 HZ3 LYS 41 HZ3 LYS 41 178.016 188.583 -31.187 1528 H ALA 42 HN ALA 42 184.439 186.740 -33.351 1529 HA ALA 42 HA ALA 42 183.307 186.308 -35.885 1530 HB1 ALA 42 HB1 ALA 42 184.719 188.269 -35.206 1531 HB2 ALA 42 HB2 ALA 42 185.117 187.597 -36.788 1532 HB3 ALA 42 HB3 ALA 42 186.136 187.236 -35.397 1533 H MET 43 HN MET 43 186.288 184.827 -34.505 1534 HA MET 43 HA MET 43 186.788 183.316 -36.893 1535 HB2 MET 43 HB2 MET 43 188.450 184.105 -35.036 1536 HB3 MET 43 HB1 MET 43 187.943 182.645 -34.195 1537 HG2 MET 43 HG2 MET 43 189.798 181.901 -35.430 1538 HG3 MET 43 HG1 MET 43 188.451 181.453 -36.475 1539 HE1 MET 43 HE1 MET 43 191.856 183.278 -36.373 1540 HE2 MET 43 HE2 MET 43 190.740 184.258 -35.428 1541 HE3 MET 43 HE3 MET 43 191.418 184.901 -36.921 1542 H SER 44 HN SER 44 184.186 183.047 -35.099 1543 HA SER 44 HA SER 44 183.684 180.335 -35.702 1544 HB2 SER 44 HB2 SER 44 184.715 180.945 -32.956 1545 HB3 SER 44 HB1 SER 44 183.492 179.689 -33.151 1546 HG SER 44 HG SER 44 184.855 178.559 -34.431 1547 H ASP 45 HN ASP 45 181.929 181.873 -36.483 1548 HA ASP 45 HA ASP 45 180.165 183.181 -34.722 1549 HB2 ASP 45 HB2 ASP 45 179.715 182.005 -37.475 1550 HB3 ASP 45 HB1 ASP 45 178.556 183.030 -36.637 1551 H ASP 46 HN ASP 46 179.496 180.119 -36.510 1552 HA ASP 46 HA ASP 46 178.047 178.384 -36.031 1553 HB2 ASP 46 HB2 ASP 46 179.968 177.993 -34.454 1554 HB3 ASP 46 HB1 ASP 46 179.021 178.804 -33.206 1555 H GLU 47 HN GLU 47 176.106 179.822 -36.436 1556 HA GLU 47 HA GLU 47 174.015 179.573 -34.756 1557 HB2 GLU 47 HB2 GLU 47 175.797 181.682 -33.643 1558 HB3 GLU 47 HB1 GLU 47 174.122 182.170 -33.804 1559 HG2 GLU 47 HG2 GLU 47 173.338 180.594 -32.288 1560 HG3 GLU 47 HG1 GLU 47 174.689 179.500 -32.538 1561 HA PRO 48 HA PRO 48 172.829 183.482 -37.254 1562 HB2 PRO 48 HB2 PRO 48 174.838 184.791 -38.638 1563 HB3 PRO 48 HB1 PRO 48 174.300 185.246 -37.009 1564 HG2 PRO 48 HG2 PRO 48 176.617 183.530 -37.816 1565 HG3 PRO 48 HG1 PRO 48 176.564 184.860 -36.636 1566 HD2 PRO 48 HD2 PRO 48 176.485 182.348 -35.788 1567 HD3 PRO 48 HD1 PRO 48 175.448 183.567 -35.036 1568 H LYS 49 HN LYS 49 172.438 183.771 -39.587 1569 HA LYS 49 HA LYS 49 172.270 181.454 -41.027 1570 HB2 LYS 49 HB2 LYS 49 171.139 183.547 -41.669 1571 HB3 LYS 49 HB1 LYS 49 172.685 184.236 -42.163 1572 HG2 LYS 49 HG2 LYS 49 172.935 182.457 -43.867 1573 HG3 LYS 49 HG1 LYS 49 171.394 181.764 -43.363 1574 HD2 LYS 49 HD2 LYS 49 170.250 183.866 -43.973 1575 HD3 LYS 49 HD1 LYS 49 171.792 184.550 -44.490 1576 HE2 LYS 49 HE2 LYS 49 172.031 182.801 -46.186 1577 HE3 LYS 49 HE1 LYS 49 170.529 182.048 -45.651 1578 HZ1 LYS 49 HZ1 LYS 49 169.286 183.614 -46.650 1579 HZ2 LYS 49 HZ2 LYS 49 170.665 183.826 -47.620 1580 HZ3 LYS 49 HZ3 LYS 49 170.374 184.870 -46.311 1581 HCN FME 1 HCN FME 1 224.721 186.243 -24.514 1582 HA FME 1 HA FME 1 227.193 186.921 -22.174 1583 HB2 FME 1 HB2 FME 1 226.362 188.677 -23.973 1584 HB3 FME 1 HB1 FME 1 225.987 189.660 -22.560 1585 HG2 FME 1 HG2 FME 1 228.692 188.440 -23.195 1586 HG3 FME 1 HG1 FME 1 228.263 190.138 -23.393 1587 HE1 FME 1 HE1 FME 1 230.734 190.137 -20.501 1588 HE2 FME 1 HE2 FME 1 229.976 191.375 -21.499 1589 HE3 FME 1 HE3 FME 1 230.554 189.885 -22.242 1590 H GLY 2 HN GLY 2 224.217 188.563 -21.144 1591 HA2 GLY 2 HA2 GLY 2 223.399 188.567 -18.912 1592 HA3 GLY 2 HA1 GLY 2 225.032 188.261 -18.328 1593 H GLY 3 HN GLY 3 225.995 190.385 -20.309 1594 HA2 GLY 3 HA2 GLY 3 226.052 192.556 -18.472 1595 HA3 GLY 3 HA1 GLY 3 226.629 192.597 -20.136 1596 H ILE 4 HN ILE 4 224.310 192.023 -21.527 1597 HA ILE 4 HA ILE 4 222.581 194.360 -20.914 1598 HB ILE 4 HB ILE 4 223.326 193.093 -23.563 1599 HG12 ILE 4 HG12 ILE 4 223.700 195.935 -22.587 1600 HG13 ILE 4 HG11 ILE 4 224.937 194.692 -22.402 1601 HG21 ILE 4 HG21 ILE 4 221.032 193.694 -23.772 1602 HG22 ILE 4 HG22 ILE 4 221.929 195.045 -24.465 1603 HG23 ILE 4 HG23 ILE 4 221.254 195.172 -22.839 1604 HD11 ILE 4 HD11 ILE 4 223.691 195.306 -25.084 1605 HD12 ILE 4 HD12 ILE 4 225.193 194.444 -24.750 1606 HD13 ILE 4 HD13 ILE 4 225.100 196.185 -24.489 1607 H SER 5 HN SER 5 220.788 193.614 -19.937 1608 HA SER 5 HA SER 5 219.446 191.231 -21.098 1609 HB2 SER 5 HB2 SER 5 220.261 190.758 -18.859 1610 HB3 SER 5 HB1 SER 5 219.450 192.194 -18.237 1611 HG SER 5 HG SER 5 218.346 189.808 -19.273 1612 H ILE 6 HN ILE 6 217.617 191.589 -22.024 1613 HA ILE 6 HA ILE 6 216.234 194.101 -21.948 1614 HB ILE 6 HB ILE 6 216.312 192.169 -23.787 1615 HG12 ILE 6 HG12 ILE 6 213.839 193.797 -23.127 1616 HG13 ILE 6 HG11 ILE 6 215.204 194.323 -24.112 1617 HG21 ILE 6 HG21 ILE 6 214.520 190.624 -23.733 1618 HG22 ILE 6 HG22 ILE 6 213.712 191.481 -22.417 1619 HG23 ILE 6 HG23 ILE 6 215.193 190.573 -22.104 1620 HD11 ILE 6 HD11 ILE 6 213.144 192.211 -24.744 1621 HD12 ILE 6 HD12 ILE 6 214.689 192.271 -25.594 1622 HD13 ILE 6 HD13 ILE 6 213.575 193.635 -25.689 1623 H TRP 7 HN TRP 7 216.105 191.086 -20.172 1624 HA TRP 7 HA TRP 7 213.495 191.368 -19.159 1625 HB2 TRP 7 HB2 TRP 7 215.898 189.823 -18.266 1626 HB3 TRP 7 HB1 TRP 7 214.613 190.060 -17.081 1627 HD1 TRP 7 HD1 TRP 7 215.458 188.007 -20.123 1628 HE1 TRP 7 HE1 TRP 7 213.404 186.558 -20.736 1629 HE3 TRP 7 HE3 TRP 7 211.995 190.111 -17.042 1630 HZ2 TRP 7 HZ2 TRP 7 210.613 186.378 -20.007 1631 HZ3 TRP 7 HZ3 TRP 7 209.654 189.298 -17.025 1632 HH2 TRP 7 HH2 TRP 7 208.972 187.439 -18.507 1633 H GLN 8 HN GLN 8 216.455 192.966 -18.300 1634 HA GLN 8 HA GLN 8 215.719 193.886 -15.719 1635 HB2 GLN 8 HB2 GLN 8 217.617 194.895 -17.820 1636 HB3 GLN 8 HB1 GLN 8 217.324 195.846 -16.371 1637 HG2 GLN 8 HG2 GLN 8 218.022 193.982 -14.951 1638 HG3 GLN 8 HG1 GLN 8 218.227 192.939 -16.348 1639 HE21 GLN 8 HE21 GLN 8 220.511 192.955 -15.141 1640 HE22 GLN 8 HE22 GLN 8 221.620 194.093 -15.737 1641 H LEU 9 HN LEU 9 214.919 195.066 -18.939 1642 HA LEU 9 HA LEU 9 213.764 197.541 -18.144 1643 HB2 LEU 9 HB2 LEU 9 214.486 197.237 -20.391 1644 HB3 LEU 9 HB1 LEU 9 213.496 195.812 -20.609 1645 HG LEU 9 HG LEU 9 212.236 198.426 -19.843 1646 HD11 LEU 9 HD11 LEU 9 213.437 199.184 -21.709 1647 HD12 LEU 9 HD12 LEU 9 211.879 198.730 -22.396 1648 HD13 LEU 9 HD13 LEU 9 213.266 197.645 -22.564 1649 HD21 LEU 9 HD21 LEU 9 211.291 195.807 -20.902 1650 HD22 LEU 9 HD22 LEU 9 210.550 197.206 -21.663 1651 HD23 LEU 9 HD23 LEU 9 210.438 197.007 -19.924 1652 H LEU 10 HN LEU 10 212.449 194.246 -18.641 1653 HA LEU 10 HA LEU 10 209.705 194.912 -18.485 1654 HB2 LEU 10 HB2 LEU 10 211.398 192.474 -18.111 1655 HB3 LEU 10 HB1 LEU 10 209.752 192.386 -17.497 1656 HG LEU 10 HG LEU 10 210.090 193.477 -20.283 1657 HD11 LEU 10 HD11 LEU 10 210.058 191.134 -21.195 1658 HD12 LEU 10 HD12 LEU 10 210.419 190.546 -19.582 1659 HD13 LEU 10 HD13 LEU 10 211.585 191.556 -20.424 1660 HD21 LEU 10 HD21 LEU 10 207.900 193.083 -18.943 1661 HD22 LEU 10 HD22 LEU 10 208.174 191.363 -19.258 1662 HD23 LEU 10 HD23 LEU 10 207.950 192.489 -20.601 1663 H ILE 11 HN ILE 11 211.980 193.920 -15.920 1664 HA ILE 11 HA ILE 11 210.067 194.064 -13.826 1665 HB ILE 11 HB ILE 11 212.098 192.817 -13.493 1666 HG12 ILE 11 HG12 ILE 11 212.361 195.258 -11.727 1667 HG13 ILE 11 HG11 ILE 11 211.037 194.104 -11.544 1668 HG21 ILE 11 HG21 ILE 11 213.561 194.120 -14.958 1669 HG22 ILE 11 HG22 ILE 11 214.297 193.897 -13.371 1670 HG23 ILE 11 HG23 ILE 11 213.568 195.439 -13.795 1671 HD11 ILE 11 HD11 ILE 11 212.834 193.468 -10.030 1672 HD12 ILE 11 HD12 ILE 11 214.003 193.502 -11.350 1673 HD13 ILE 11 HD13 ILE 11 212.739 192.272 -11.326 1674 H ILE 12 HN ILE 12 212.423 196.459 -15.098 1675 HA ILE 12 HA ILE 12 211.802 198.441 -13.184 1676 HB ILE 12 HB ILE 12 213.009 198.698 -15.947 1677 HG12 ILE 12 HG12 ILE 12 214.103 198.822 -13.109 1678 HG13 ILE 12 HG11 ILE 12 214.387 197.539 -14.271 1679 HG21 ILE 12 HG21 ILE 12 212.541 200.785 -13.778 1680 HG22 ILE 12 HG22 ILE 12 211.896 200.816 -15.423 1681 HG23 ILE 12 HG23 ILE 12 213.608 201.025 -15.151 1682 HD11 ILE 12 HD11 ILE 12 216.332 198.951 -14.289 1683 HD12 ILE 12 HD12 ILE 12 215.343 200.401 -14.442 1684 HD13 ILE 12 HD13 ILE 12 215.450 199.265 -15.784 1685 H ALA 13 HN ALA 13 210.475 197.792 -16.411 1686 HA ALA 13 HA ALA 13 208.794 200.039 -16.547 1687 HB1 ALA 13 HB1 ALA 13 207.465 198.621 -18.152 1688 HB2 ALA 13 HB2 ALA 13 208.536 197.277 -17.750 1689 HB3 ALA 13 HB3 ALA 13 209.186 198.724 -18.522 1690 H VAL 14 HN VAL 14 208.312 196.820 -15.152 1691 HA VAL 14 HA VAL 14 205.576 197.079 -14.548 1692 HB VAL 14 HB VAL 14 207.822 195.434 -13.375 1693 HG11 VAL 14 HG11 VAL 14 206.395 195.531 -11.523 1694 HG12 VAL 14 HG12 VAL 14 205.814 194.104 -12.380 1695 HG13 VAL 14 HG13 VAL 14 204.943 195.634 -12.518 1696 HG21 VAL 14 HG21 VAL 14 206.885 193.682 -14.676 1697 HG22 VAL 14 HG22 VAL 14 206.809 195.092 -15.732 1698 HG23 VAL 14 HG23 VAL 14 205.361 194.544 -14.888 1699 H ILE 15 HN ILE 15 208.474 197.905 -12.646 1700 HA ILE 15 HA ILE 15 207.109 198.756 -10.336 1701 HB ILE 15 HB ILE 15 209.805 199.525 -11.480 1702 HG12 ILE 15 HG12 ILE 15 209.088 197.964 -9.018 1703 HG13 ILE 15 HG11 ILE 15 209.329 197.199 -10.573 1704 HG21 ILE 15 HG21 ILE 15 210.192 200.430 -9.111 1705 HG22 ILE 15 HG22 ILE 15 208.436 200.432 -8.942 1706 HG23 ILE 15 HG23 ILE 15 209.205 201.427 -10.178 1707 HD11 ILE 15 HD11 ILE 15 211.370 198.934 -9.156 1708 HD12 ILE 15 HD12 ILE 15 211.607 198.110 -10.697 1709 HD13 ILE 15 HD13 ILE 15 211.409 197.173 -9.216 1710 H VAL 16 HN VAL 16 208.129 200.560 -13.226 1711 HA VAL 16 HA VAL 16 207.336 203.121 -12.393 1712 HB VAL 16 HB VAL 16 207.379 201.835 -15.146 1713 HG11 VAL 16 HG11 VAL 16 205.833 203.656 -15.357 1714 HG12 VAL 16 HG12 VAL 16 207.377 204.238 -15.968 1715 HG13 VAL 16 HG13 VAL 16 206.847 204.702 -14.363 1716 HG21 VAL 16 HG21 VAL 16 209.260 203.651 -13.634 1717 HG22 VAL 16 HG22 VAL 16 209.379 203.380 -15.376 1718 HG23 VAL 16 HG23 VAL 16 209.582 202.034 -14.255 1719 H VAL 17 HN VAL 17 205.502 200.597 -14.121 1720 HA VAL 17 HA VAL 17 203.123 202.089 -14.424 1721 HB VAL 17 HB VAL 17 203.549 199.095 -14.282 1722 HG11 VAL 17 HG11 VAL 17 201.331 199.138 -15.595 1723 HG12 VAL 17 HG12 VAL 17 201.145 200.783 -14.988 1724 HG13 VAL 17 HG13 VAL 17 201.238 199.431 -13.859 1725 HG21 VAL 17 HG21 VAL 17 203.621 199.179 -16.675 1726 HG22 VAL 17 HG22 VAL 17 204.703 200.453 -16.112 1727 HG23 VAL 17 HG23 VAL 17 203.091 200.861 -16.697 1728 H LEU 18 HN LEU 18 204.179 199.834 -11.844 1729 HA LEU 18 HA LEU 18 201.719 199.919 -10.431 1730 HB2 LEU 18 HB2 LEU 18 204.530 199.134 -9.767 1731 HB3 LEU 18 HB1 LEU 18 203.390 199.326 -8.442 1732 HG LEU 18 HG LEU 18 202.602 197.690 -10.855 1733 HD11 LEU 18 HD11 LEU 18 203.457 195.690 -9.473 1734 HD12 LEU 18 HD12 LEU 18 204.450 196.886 -8.614 1735 HD13 LEU 18 HD13 LEU 18 204.650 196.641 -10.348 1736 HD21 LEU 18 HD21 LEU 18 200.835 198.092 -9.273 1737 HD22 LEU 18 HD22 LEU 18 201.879 197.737 -7.906 1738 HD23 LEU 18 HD23 LEU 18 201.375 196.442 -8.988 1739 H LEU 19 HN LEU 19 204.733 201.822 -10.036 1740 HA LEU 19 HA LEU 19 203.788 203.316 -7.821 1741 HB2 LEU 19 HB2 LEU 19 205.863 204.202 -9.839 1742 HB3 LEU 19 HB1 LEU 19 205.649 204.823 -8.204 1743 HG LEU 19 HG LEU 19 206.515 202.038 -8.980 1744 HD11 LEU 19 HD11 LEU 19 207.895 204.294 -7.560 1745 HD12 LEU 19 HD12 LEU 19 208.308 203.601 -9.128 1746 HD13 LEU 19 HD13 LEU 19 208.533 202.652 -7.660 1747 HD21 LEU 19 HD21 LEU 19 206.807 201.848 -6.412 1748 HD22 LEU 19 HD22 LEU 19 205.216 201.587 -7.119 1749 HD23 LEU 19 HD23 LEU 19 205.602 203.139 -6.359 1750 H PHE 20 HN PHE 20 203.642 203.943 -11.326 1751 HA PHE 20 HA PHE 20 202.154 206.447 -10.858 1752 HB2 PHE 20 HB2 PHE 20 203.261 205.066 -13.296 1753 HB3 PHE 20 HB1 PHE 20 202.035 206.317 -13.476 1754 HD1 PHE 20 HD2 PHE 20 202.459 208.616 -12.696 1755 HD2 PHE 20 HD1 PHE 20 205.504 205.601 -12.624 1756 HE1 PHE 20 HE2 PHE 20 204.187 210.376 -12.457 1757 HE2 PHE 20 HE1 PHE 20 207.244 207.362 -12.411 1758 HZ PHE 20 HZ PHE 20 206.584 209.750 -12.321 1759 H GLY 21 HN GLY 21 201.482 203.142 -11.145 1760 HA2 GLY 21 HA2 GLY 21 199.442 202.034 -11.146 1761 HA3 GLY 21 HA1 GLY 21 198.638 203.605 -11.170 1762 H THR 22 HN THR 22 197.435 201.847 -12.769 1763 HA THR 22 HA THR 22 198.572 202.169 -15.483 1764 HB THR 22 HB THR 22 198.043 199.917 -15.300 1765 HG1 THR 22 HG1 THR 22 195.594 199.933 -16.002 1766 HG21 THR 22 HG21 THR 22 195.732 200.800 -13.557 1767 HG22 THR 22 HG22 THR 22 197.183 199.935 -13.052 1768 HG23 THR 22 HG23 THR 22 195.985 199.130 -14.066 1769 H LYS 23 HN LYS 23 195.647 202.795 -13.576 1770 HA LYS 23 HA LYS 23 194.122 203.855 -15.716 1771 HB2 LYS 23 HB2 LYS 23 193.240 203.185 -13.446 1772 HB3 LYS 23 HB1 LYS 23 193.911 204.689 -12.824 1773 HG2 LYS 23 HG2 LYS 23 191.737 205.376 -13.328 1774 HG3 LYS 23 HG1 LYS 23 192.551 205.778 -14.836 1775 HD2 LYS 23 HD2 LYS 23 191.833 203.608 -15.793 1776 HD3 LYS 23 HD1 LYS 23 191.015 203.221 -14.282 1777 HE2 LYS 23 HE2 LYS 23 190.397 205.599 -16.054 1778 HE3 LYS 23 HE1 LYS 23 189.437 204.123 -15.948 1779 HZ1 LYS 23 HZ1 LYS 23 188.510 205.826 -14.534 1780 HZ2 LYS 23 HZ2 LYS 23 189.991 206.013 -13.724 1781 HZ3 LYS 23 HZ3 LYS 23 189.118 204.563 -13.580 1782 H LYS 24 HN LYS 24 196.234 205.479 -13.320 1783 HA LYS 24 HA LYS 24 195.776 208.096 -14.275 1784 HB2 LYS 24 HB2 LYS 24 198.102 206.889 -12.770 1785 HB3 LYS 24 HB1 LYS 24 197.927 208.613 -13.081 1786 HG2 LYS 24 HG2 LYS 24 195.818 208.663 -11.869 1787 HG3 LYS 24 HG1 LYS 24 195.866 206.914 -11.646 1788 HD2 LYS 24 HD2 LYS 24 197.980 207.164 -10.358 1789 HD3 LYS 24 HD1 LYS 24 197.849 208.916 -10.523 1790 HE2 LYS 24 HE2 LYS 24 195.807 207.114 -9.181 1791 HE3 LYS 24 HE1 LYS 24 196.944 208.173 -8.348 1792 HZ1 LYS 24 HZ1 LYS 24 195.269 209.633 -8.471 1793 HZ2 LYS 24 HZ2 LYS 24 194.496 208.820 -9.746 1794 HZ3 LYS 24 HZ3 LYS 24 195.795 209.867 -10.067 1795 H LEU 25 HN LEU 25 198.219 205.642 -15.071 1796 HA LEU 25 HA LEU 25 199.757 207.252 -16.784 1797 HB2 LEU 25 HB2 LEU 25 200.642 205.161 -15.997 1798 HB3 LEU 25 HB1 LEU 25 199.344 204.249 -16.758 1799 HG LEU 25 HG LEU 25 201.005 206.038 -18.517 1800 HD11 LEU 25 HD11 LEU 25 202.651 204.162 -18.810 1801 HD12 LEU 25 HD12 LEU 25 201.944 203.383 -17.392 1802 HD13 LEU 25 HD13 LEU 25 202.738 204.950 -17.234 1803 HD21 LEU 25 HD21 LEU 25 198.970 204.242 -19.039 1804 HD22 LEU 25 HD22 LEU 25 200.379 203.226 -19.294 1805 HD23 LEU 25 HD23 LEU 25 200.195 204.718 -20.211 1806 H GLY 26 HN GLY 26 196.619 205.816 -17.240 1807 HA2 GLY 26 HA2 GLY 26 196.666 205.691 -20.082 1808 HA3 GLY 26 HA1 GLY 26 195.223 205.745 -19.075 1809 H SER 27 HN SER 27 195.341 208.112 -17.822 1810 HA SER 27 HA SER 27 194.545 209.965 -19.805 1811 HB2 SER 27 HB2 SER 27 194.473 211.597 -17.957 1812 HB3 SER 27 HB1 SER 27 193.709 210.074 -17.507 1813 HG SER 27 HG SER 27 195.967 211.288 -16.528 1814 H ILE 28 HN ILE 28 197.590 209.622 -17.959 1815 HA ILE 28 HA ILE 28 198.805 211.989 -18.910 1816 HB ILE 28 HB ILE 28 200.020 209.378 -17.975 1817 HG12 ILE 28 HG12 ILE 28 199.765 212.051 -16.566 1818 HG13 ILE 28 HG11 ILE 28 198.589 210.750 -16.384 1819 HG21 ILE 28 HG21 ILE 28 201.711 210.476 -19.265 1820 HG22 ILE 28 HG22 ILE 28 202.047 210.895 -17.584 1821 HG23 ILE 28 HG23 ILE 28 201.253 212.061 -18.644 1822 HD11 ILE 28 HD11 ILE 28 200.295 209.257 -15.509 1823 HD12 ILE 28 HD12 ILE 28 200.332 210.758 -14.584 1824 HD13 ILE 28 HD13 ILE 28 201.552 210.454 -15.820 1825 H GLY 29 HN GLY 29 198.985 208.618 -20.146 1826 HA2 GLY 29 HA2 GLY 29 200.739 209.211 -22.284 1827 HA3 GLY 29 HA1 GLY 29 199.666 207.819 -22.200 1828 H SER 30 HN SER 30 197.155 208.880 -22.269 1829 HA SER 30 HA SER 30 196.805 209.514 -24.983 1830 HB2 SER 30 HB2 SER 30 194.474 210.037 -24.364 1831 HB3 SER 30 HB1 SER 30 195.014 208.514 -23.662 1832 HG SER 30 HG SER 30 194.896 211.057 -22.396 1833 H ASP 31 HN ASP 31 197.024 211.580 -22.106 1834 HA ASP 31 HA ASP 31 196.285 213.992 -23.387 1835 HB2 ASP 31 HB2 ASP 31 197.954 213.461 -20.926 1836 HB3 ASP 31 HB1 ASP 31 197.616 215.091 -21.515 1837 H LEU 32 HN LEU 32 199.428 212.432 -22.862 1838 HA LEU 32 HA LEU 32 200.829 214.534 -24.313 1839 HB2 LEU 32 HB2 LEU 32 201.787 211.886 -23.196 1840 HB3 LEU 32 HB1 LEU 32 202.825 213.095 -23.939 1841 HG LEU 32 HG LEU 32 201.028 213.714 -21.580 1842 HD11 LEU 32 HD11 LEU 32 203.069 213.473 -20.186 1843 HD12 LEU 32 HD12 LEU 32 203.939 212.861 -21.593 1844 HD13 LEU 32 HD13 LEU 32 202.587 211.945 -20.924 1845 HD21 LEU 32 HD21 LEU 32 203.283 215.136 -23.011 1846 HD22 LEU 32 HD22 LEU 32 202.918 215.508 -21.328 1847 HD23 LEU 32 HD23 LEU 32 201.692 215.755 -22.564 1848 H GLY 33 HN GLY 33 199.128 211.711 -25.182 1849 HA2 GLY 33 HA2 GLY 33 200.761 211.087 -27.496 1850 HA3 GLY 33 HA1 GLY 33 199.245 210.322 -27.042 1851 H ALA 34 HN ALA 34 198.858 213.655 -26.903 1852 HA ALA 34 HA ALA 34 197.035 213.688 -29.067 1853 HB1 ALA 34 HB1 ALA 34 197.254 216.267 -28.703 1854 HB2 ALA 34 HB2 ALA 34 198.241 215.815 -27.311 1855 HB3 ALA 34 HB3 ALA 34 196.568 215.274 -27.416 1856 H SER 35 HN SER 35 200.432 214.670 -28.805 1857 HA SER 35 HA SER 35 200.583 215.959 -31.326 1858 HB2 SER 35 HB2 SER 35 202.817 214.538 -29.862 1859 HB3 SER 35 HB1 SER 35 202.976 215.811 -31.068 1860 HG SER 35 HG SER 35 203.125 216.700 -29.008 1861 H ILE 36 HN ILE 36 200.983 212.616 -30.307 1862 HA ILE 36 HA ILE 36 202.063 211.593 -32.706 1863 HB ILE 36 HB ILE 36 200.393 210.258 -30.559 1864 HG12 ILE 36 HG12 ILE 36 203.333 209.996 -31.220 1865 HG13 ILE 36 HG11 ILE 36 202.734 211.142 -30.031 1866 HG21 ILE 36 HG21 ILE 36 201.780 209.117 -33.002 1867 HG22 ILE 36 HG22 ILE 36 200.090 208.924 -32.539 1868 HG23 ILE 36 HG23 ILE 36 201.355 208.133 -31.602 1869 HD11 ILE 36 HD11 ILE 36 203.449 209.038 -28.955 1870 HD12 ILE 36 HD12 ILE 36 202.296 208.144 -29.946 1871 HD13 ILE 36 HD13 ILE 36 201.717 209.303 -28.749 1872 H LYS 37 HN LYS 37 198.731 212.078 -31.629 1873 HA LYS 37 HA LYS 37 197.410 210.794 -33.722 1874 HB2 LYS 37 HB2 LYS 37 196.677 213.226 -32.092 1875 HB3 LYS 37 HB1 LYS 37 195.582 212.523 -33.277 1876 HG2 LYS 37 HG2 LYS 37 196.827 210.793 -31.138 1877 HG3 LYS 37 HG1 LYS 37 195.399 211.760 -30.778 1878 HD2 LYS 37 HD2 LYS 37 194.246 210.686 -32.735 1879 HD3 LYS 37 HD1 LYS 37 195.642 209.631 -32.930 1880 HE2 LYS 37 HE2 LYS 37 194.046 208.415 -31.624 1881 HE3 LYS 37 HE1 LYS 37 195.322 208.925 -30.519 1882 HZ1 LYS 37 HZ1 LYS 37 192.836 209.312 -29.924 1883 HZ2 LYS 37 HZ2 LYS 37 193.002 210.674 -30.927 1884 HZ3 LYS 37 HZ3 LYS 37 193.993 210.497 -29.558 1885 H GLY 38 HN GLY 38 198.845 214.035 -33.577 1886 HA2 GLY 38 HA2 GLY 38 197.802 214.918 -36.077 1887 HA3 GLY 38 HA1 GLY 38 199.168 215.622 -35.230 1888 H PHE 39 HN PHE 39 200.896 213.357 -35.155 1889 HA PHE 39 HA PHE 39 202.106 213.562 -37.696 1890 HB2 PHE 39 HB2 PHE 39 202.452 211.712 -35.347 1891 HB3 PHE 39 HB1 PHE 39 203.322 211.391 -36.847 1892 HD1 PHE 39 HD1 PHE 39 202.487 214.485 -34.852 1893 HD2 PHE 39 HD2 PHE 39 205.536 212.148 -36.780 1894 HE1 PHE 39 HE1 PHE 39 204.179 216.178 -34.226 1895 HE2 PHE 39 HE2 PHE 39 207.226 213.847 -36.153 1896 HZ PHE 39 HZ PHE 39 206.550 215.861 -34.876 1897 H LYS 40 HN LYS 40 200.114 211.005 -36.244 1898 HA LYS 40 HA LYS 40 200.154 209.191 -38.368 1899 HB2 LYS 40 HB2 LYS 40 199.261 208.727 -36.110 1900 HB3 LYS 40 HB1 LYS 40 197.867 209.740 -36.478 1901 HG2 LYS 40 HG2 LYS 40 197.306 208.270 -38.385 1902 HG3 LYS 40 HG1 LYS 40 198.686 207.246 -37.997 1903 HD2 LYS 40 HD2 LYS 40 196.517 207.842 -35.974 1904 HD3 LYS 40 HD1 LYS 40 196.388 206.494 -37.100 1905 HE2 LYS 40 HE2 LYS 40 198.687 205.743 -36.233 1906 HE3 LYS 40 HE1 LYS 40 198.466 206.920 -34.940 1907 HZ1 LYS 40 HZ1 LYS 40 196.383 205.826 -34.361 1908 HZ2 LYS 40 HZ2 LYS 40 197.695 204.753 -34.256 1909 HZ3 LYS 40 HZ3 LYS 40 196.634 204.674 -35.580 1910 H LYS 41 HN LYS 41 197.899 211.873 -37.666 1911 HA LYS 41 HA LYS 41 196.197 211.476 -39.863 1912 HB2 LYS 41 HB2 LYS 41 195.919 213.001 -37.771 1913 HB3 LYS 41 HB1 LYS 41 196.780 214.207 -38.725 1914 HG2 LYS 41 HG2 LYS 41 195.102 214.083 -40.481 1915 HG3 LYS 41 HG1 LYS 41 194.272 212.770 -39.641 1916 HD2 LYS 41 HD2 LYS 41 193.874 214.271 -37.711 1917 HD3 LYS 41 HD1 LYS 41 194.653 215.586 -38.590 1918 HE2 LYS 41 HE2 LYS 41 192.954 215.431 -40.367 1919 HE3 LYS 41 HE1 LYS 41 192.181 214.091 -39.521 1920 HZ1 LYS 41 HZ1 LYS 41 191.296 216.481 -39.197 1921 HZ2 LYS 41 HZ2 LYS 41 192.608 216.651 -38.131 1922 HZ3 LYS 41 HZ3 LYS 41 191.431 215.459 -37.849 1923 H ALA 42 HN ALA 42 198.963 213.751 -39.514 1924 HA ALA 42 HA ALA 42 198.811 214.799 -42.111 1925 HB1 ALA 42 HB1 ALA 42 201.019 215.602 -41.811 1926 HB2 ALA 42 HB2 ALA 42 201.412 214.316 -40.673 1927 HB3 ALA 42 HB3 ALA 42 200.289 215.594 -40.206 1928 H MET 43 HN MET 43 200.614 211.894 -41.000 1929 HA MET 43 HA MET 43 201.614 211.357 -43.639 1930 HB2 MET 43 HB2 MET 43 202.681 209.462 -42.708 1931 HB3 MET 43 HB1 MET 43 202.692 210.641 -41.404 1932 HG2 MET 43 HG2 MET 43 200.769 209.554 -40.377 1933 HG3 MET 43 HG1 MET 43 200.631 208.416 -41.683 1934 HE1 MET 43 HE1 MET 43 202.512 209.811 -38.844 1935 HE2 MET 43 HE2 MET 43 204.017 209.670 -39.747 1936 HE3 MET 43 HE3 MET 43 203.720 208.616 -38.369 1937 H SER 44 HN SER 44 198.534 211.411 -42.877 1938 HA SER 44 HA SER 44 197.899 208.929 -44.370 1939 HB2 SER 44 HB2 SER 44 197.250 208.472 -42.118 1940 HB3 SER 44 HB1 SER 44 196.488 210.049 -41.939 1941 HG SER 44 HG SER 44 194.845 208.711 -42.431 1942 H ASP 45 HN ASP 45 197.666 212.297 -44.170 1943 HA ASP 45 HA ASP 45 195.123 212.689 -45.397 1944 HB2 ASP 45 HB2 ASP 45 196.326 214.495 -44.220 1945 HB3 ASP 45 HB1 ASP 45 197.578 214.476 -45.462 1946 H ASP 46 HN ASP 46 198.449 212.455 -46.704 1947 HA ASP 46 HA ASP 46 197.513 212.674 -49.441 1948 HB2 ASP 46 HB2 ASP 46 200.224 212.135 -48.222 1949 HB3 ASP 46 HB1 ASP 46 199.938 212.198 -49.959 1950 H GLU 47 HN GLU 47 196.235 210.517 -48.194 1951 HA GLU 47 HA GLU 47 196.842 208.405 -50.010 1952 HB2 GLU 47 HB2 GLU 47 198.693 208.155 -48.278 1953 HB3 GLU 47 HB1 GLU 47 197.432 207.712 -47.130 1954 HG2 GLU 47 HG2 GLU 47 197.817 206.306 -49.788 1955 HG3 GLU 47 HG1 GLU 47 198.567 205.764 -48.291 1956 HA PRO 48 HA PRO 48 192.592 208.343 -48.194 1957 HB2 PRO 48 HB2 PRO 48 191.183 208.055 -50.486 1958 HB3 PRO 48 HB1 PRO 48 191.839 209.628 -49.982 1959 HG2 PRO 48 HG2 PRO 48 192.930 207.677 -51.969 1960 HG3 PRO 48 HG1 PRO 48 192.781 209.441 -52.092 1961 HD2 PRO 48 HD2 PRO 48 195.123 208.188 -51.415 1962 HD3 PRO 48 HD1 PRO 48 194.715 209.826 -50.865 1963 H LYS 49 HN LYS 49 191.026 206.633 -48.004 1964 HA LYS 49 HA LYS 49 191.958 204.088 -47.691 1965 HB2 LYS 49 HB2 LYS 49 189.178 204.980 -48.475 1966 HB3 LYS 49 HB1 LYS 49 189.569 203.338 -47.961 1967 HG2 LYS 49 HG2 LYS 49 190.426 204.207 -45.819 1968 HG3 LYS 49 HG1 LYS 49 190.045 205.851 -46.331 1969 HD2 LYS 49 HD2 LYS 49 187.666 205.283 -46.482 1970 HD3 LYS 49 HD1 LYS 49 188.020 203.611 -46.046 1971 HE2 LYS 49 HE2 LYS 49 187.255 204.800 -44.062 1972 HE3 LYS 49 HE1 LYS 49 188.968 204.420 -43.880 1973 HZ1 LYS 49 HZ1 LYS 49 189.088 206.797 -45.084 1974 HZ2 LYS 49 HZ2 LYS 49 189.114 206.591 -43.397 1975 HZ3 LYS 49 HZ3 LYS 49 187.663 206.988 -44.185 1976 HCN FME 1 HCN FME 1 236.788 191.378 -19.457 1977 HA FME 1 HA FME 1 236.050 193.171 -16.723 1978 HB2 FME 1 HB2 FME 1 235.311 195.604 -16.729 1979 HB3 FME 1 HB1 FME 1 236.833 195.282 -17.560 1980 HG2 FME 1 HG2 FME 1 234.211 195.295 -19.059 1981 HG3 FME 1 HG1 FME 1 235.109 196.785 -18.769 1982 HE1 FME 1 HE1 FME 1 236.237 197.674 -20.727 1983 HE2 FME 1 HE2 FME 1 234.857 196.841 -21.439 1984 HE3 FME 1 HE3 FME 1 236.441 196.717 -22.201 1985 H GLY 2 HN GLY 2 234.173 194.040 -15.395 1986 HA2 GLY 2 HA2 GLY 2 231.525 193.750 -16.557 1987 HA3 GLY 2 HA1 GLY 2 231.983 192.471 -15.436 1988 H GLY 3 HN GLY 3 232.647 195.970 -15.386 1989 HA2 GLY 3 HA2 GLY 3 231.163 196.180 -12.821 1990 HA3 GLY 3 HA1 GLY 3 232.755 196.900 -13.033 1991 H ILE 4 HN ILE 4 232.098 197.590 -15.876 1992 HA ILE 4 HA ILE 4 230.680 200.105 -15.298 1993 HB ILE 4 HB ILE 4 232.251 199.179 -17.719 1994 HG12 ILE 4 HG12 ILE 4 232.931 201.289 -15.652 1995 HG13 ILE 4 HG11 ILE 4 233.514 199.627 -15.564 1996 HG21 ILE 4 HG21 ILE 4 232.118 201.630 -18.320 1997 HG22 ILE 4 HG22 ILE 4 230.907 201.811 -17.052 1998 HG23 ILE 4 HG23 ILE 4 230.583 200.769 -18.437 1999 HD11 ILE 4 HD11 ILE 4 234.627 199.859 -17.722 2000 HD12 ILE 4 HD12 ILE 4 235.151 201.164 -16.659 2001 HD13 ILE 4 HD13 ILE 4 233.962 201.481 -17.922 2002 H SER 5 HN SER 5 228.505 199.778 -15.389 2003 HA SER 5 HA SER 5 227.407 198.448 -17.810 2004 HB2 SER 5 HB2 SER 5 226.845 197.074 -15.974 2005 HB3 SER 5 HB1 SER 5 226.434 198.457 -14.965 2006 HG SER 5 HG SER 5 225.044 197.330 -17.139 2007 H ILE 6 HN ILE 6 226.310 199.648 -19.110 2008 HA ILE 6 HA ILE 6 225.677 202.389 -18.627 2009 HB ILE 6 HB ILE 6 226.104 201.137 -20.880 2010 HG12 ILE 6 HG12 ILE 6 223.754 203.045 -20.653 2011 HG13 ILE 6 HG11 ILE 6 225.454 203.518 -20.716 2012 HG21 ILE 6 HG21 ILE 6 223.102 200.748 -20.738 2013 HG22 ILE 6 HG22 ILE 6 224.239 199.446 -20.397 2014 HG23 ILE 6 HG23 ILE 6 224.205 200.190 -21.993 2015 HD11 ILE 6 HD11 ILE 6 225.602 202.238 -22.913 2016 HD12 ILE 6 HD12 ILE 6 224.636 203.711 -22.961 2017 HD13 ILE 6 HD13 ILE 6 223.844 202.137 -22.877 2018 H TRP 7 HN TRP 7 224.016 199.334 -18.386 2019 HA TRP 7 HA TRP 7 221.363 200.224 -18.188 2020 HB2 TRP 7 HB2 TRP 7 222.763 197.707 -17.348 2021 HB3 TRP 7 HB1 TRP 7 221.138 198.004 -16.728 2022 HD1 TRP 7 HD1 TRP 7 222.958 196.961 -19.862 2023 HE1 TRP 7 HE1 TRP 7 221.225 196.616 -21.750 2024 HE3 TRP 7 HE3 TRP 7 218.827 198.874 -17.577 2025 HZ2 TRP 7 HZ2 TRP 7 218.423 197.159 -22.216 2026 HZ3 TRP 7 HZ3 TRP 7 216.651 198.955 -18.766 2027 HH2 TRP 7 HH2 TRP 7 216.461 198.092 -21.080 2028 H GLN 8 HN GLN 8 223.948 200.215 -15.866 2029 HA GLN 8 HA GLN 8 222.403 200.422 -13.507 2030 HB2 GLN 8 HB2 GLN 8 225.190 201.250 -14.245 2031 HB3 GLN 8 HB1 GLN 8 224.528 201.742 -12.708 2032 HG2 GLN 8 HG2 GLN 8 224.575 198.854 -13.621 2033 HG3 GLN 8 HG1 GLN 8 225.831 199.590 -12.629 2034 HE21 GLN 8 HE21 GLN 8 223.241 197.645 -12.283 2035 HE22 GLN 8 HE22 GLN 8 222.683 198.147 -10.761 2036 H LEU 9 HN LEU 9 223.338 202.803 -15.909 2037 HA LEU 9 HA LEU 9 222.533 205.134 -14.467 2038 HB2 LEU 9 HB2 LEU 9 222.794 204.586 -17.439 2039 HB3 LEU 9 HB1 LEU 9 222.516 206.181 -16.754 2040 HG LEU 9 HG LEU 9 224.899 204.445 -16.038 2041 HD11 LEU 9 HD11 LEU 9 226.157 206.006 -17.542 2042 HD12 LEU 9 HD12 LEU 9 224.609 206.635 -18.106 2043 HD13 LEU 9 HD13 LEU 9 225.034 204.947 -18.396 2044 HD21 LEU 9 HD21 LEU 9 224.637 206.068 -14.347 2045 HD22 LEU 9 HD22 LEU 9 224.092 207.300 -15.484 2046 HD23 LEU 9 HD23 LEU 9 225.785 206.812 -15.453 2047 H LEU 10 HN LEU 10 220.858 202.942 -16.760 2048 HA LEU 10 HA LEU 10 218.527 204.494 -17.138 2049 HB2 LEU 10 HB2 LEU 10 219.308 201.612 -17.386 2050 HB3 LEU 10 HB1 LEU 10 217.589 201.986 -17.454 2051 HG LEU 10 HG LEU 10 219.395 203.688 -19.158 2052 HD11 LEU 10 HD11 LEU 10 219.206 201.931 -20.995 2053 HD12 LEU 10 HD12 LEU 10 218.777 200.781 -19.739 2054 HD13 LEU 10 HD13 LEU 10 220.358 201.552 -19.722 2055 HD21 LEU 10 HD21 LEU 10 217.493 203.757 -20.577 2056 HD22 LEU 10 HD22 LEU 10 216.806 203.755 -18.953 2057 HD23 LEU 10 HD23 LEU 10 216.828 202.262 -19.907 2058 H ILE 11 HN ILE 11 219.215 201.925 -14.757 2059 HA ILE 11 HA ILE 11 216.680 202.074 -13.491 2060 HB ILE 11 HB ILE 11 218.048 200.117 -13.214 2061 HG12 ILE 11 HG12 ILE 11 218.085 201.464 -10.507 2062 HG13 ILE 11 HG11 ILE 11 216.573 200.981 -11.279 2063 HG21 ILE 11 HG21 ILE 11 220.027 201.909 -11.816 2064 HG22 ILE 11 HG22 ILE 11 220.237 201.186 -13.404 2065 HG23 ILE 11 HG23 ILE 11 220.161 200.166 -11.969 2066 HD11 ILE 11 HD11 ILE 11 217.488 198.657 -11.503 2067 HD12 ILE 11 HD12 ILE 11 217.322 199.175 -9.823 2068 HD13 ILE 11 HD13 ILE 11 218.909 199.172 -10.593 2069 H ILE 12 HN ILE 12 219.815 203.674 -12.772 2070 HA ILE 12 HA ILE 12 218.933 204.997 -10.435 2071 HB ILE 12 HB ILE 12 221.109 205.628 -12.433 2072 HG12 ILE 12 HG12 ILE 12 221.220 204.597 -9.586 2073 HG13 ILE 12 HG11 ILE 12 221.293 203.576 -11.005 2074 HG21 ILE 12 HG21 ILE 12 220.820 207.760 -11.553 2075 HG22 ILE 12 HG22 ILE 12 221.895 207.088 -10.333 2076 HG23 ILE 12 HG23 ILE 12 220.159 207.163 -10.033 2077 HD11 ILE 12 HD11 ILE 12 223.262 205.711 -10.231 2078 HD12 ILE 12 HD12 ILE 12 223.290 204.887 -11.774 2079 HD13 ILE 12 HD13 ILE 12 223.554 203.987 -10.278 2080 H ALA 13 HN ALA 13 218.957 206.008 -13.854 2081 HA ALA 13 HA ALA 13 218.021 208.626 -13.443 2082 HB1 ALA 13 HB1 ALA 13 217.762 206.728 -15.775 2083 HB2 ALA 13 HB2 ALA 13 218.901 208.061 -15.585 2084 HB3 ALA 13 HB3 ALA 13 217.186 208.394 -15.832 2085 H VAL 14 HN VAL 14 216.302 205.554 -13.874 2086 HA VAL 14 HA VAL 14 213.710 206.627 -14.047 2087 HB VAL 14 HB VAL 14 214.744 203.942 -13.140 2088 HG11 VAL 14 HG11 VAL 14 212.714 204.031 -11.966 2089 HG12 VAL 14 HG12 VAL 14 212.236 203.304 -13.497 2090 HG13 VAL 14 HG13 VAL 14 211.923 205.015 -13.203 2091 HG21 VAL 14 HG21 VAL 14 214.091 203.243 -15.312 2092 HG22 VAL 14 HG22 VAL 14 214.818 204.816 -15.585 2093 HG23 VAL 14 HG23 VAL 14 213.061 204.646 -15.554 2094 H ILE 15 HN ILE 15 215.619 205.601 -11.226 2095 HA ILE 15 HA ILE 15 213.620 206.073 -9.300 2096 HB ILE 15 HB ILE 15 216.640 206.075 -9.132 2097 HG12 ILE 15 HG12 ILE 15 214.612 204.195 -7.966 2098 HG13 ILE 15 HG11 ILE 15 215.280 203.964 -9.567 2099 HG21 ILE 15 HG21 ILE 15 216.074 207.489 -7.329 2100 HG22 ILE 15 HG22 ILE 15 216.136 205.887 -6.595 2101 HG23 ILE 15 HG23 ILE 15 214.579 206.614 -6.995 2102 HD11 ILE 15 HD11 ILE 15 216.527 202.674 -7.833 2103 HD12 ILE 15 HD12 ILE 15 216.925 204.193 -7.031 2104 HD13 ILE 15 HD13 ILE 15 217.546 203.861 -8.648 2105 H VAL 16 HN VAL 16 216.144 208.211 -10.604 2106 HA VAL 16 HA VAL 16 215.638 210.441 -8.974 2107 HB VAL 16 HB VAL 16 216.621 210.216 -11.831 2108 HG11 VAL 16 HG11 VAL 16 217.491 212.580 -11.399 2109 HG12 VAL 16 HG12 VAL 16 216.352 212.649 -10.056 2110 HG13 VAL 16 HG13 VAL 16 215.759 212.435 -11.701 2111 HG21 VAL 16 HG21 VAL 16 218.794 210.784 -10.734 2112 HG22 VAL 16 HG22 VAL 16 218.116 209.249 -10.188 2113 HG23 VAL 16 HG23 VAL 16 217.987 210.683 -9.171 2114 H VAL 17 HN VAL 17 214.219 209.537 -12.120 2115 HA VAL 17 HA VAL 17 212.589 211.826 -12.378 2116 HB VAL 17 HB VAL 17 212.288 209.047 -13.534 2117 HG11 VAL 17 HG11 VAL 17 210.852 210.309 -15.231 2118 HG12 VAL 17 HG12 VAL 17 210.799 211.628 -14.062 2119 HG13 VAL 17 HG13 VAL 17 210.121 210.053 -13.647 2120 HG21 VAL 17 HG21 VAL 17 213.205 211.601 -14.867 2121 HG22 VAL 17 HG22 VAL 17 213.366 209.948 -15.461 2122 HG23 VAL 17 HG23 VAL 17 214.331 210.490 -14.088 2123 H LEU 18 HN LEU 18 211.924 208.611 -10.932 2124 HA LEU 18 HA LEU 18 209.177 209.133 -10.433 2125 HB2 LEU 18 HB2 LEU 18 211.211 207.183 -9.438 2126 HB3 LEU 18 HB1 LEU 18 209.736 207.351 -8.496 2127 HG LEU 18 HG LEU 18 209.494 207.028 -11.489 2128 HD11 LEU 18 HD11 LEU 18 210.989 205.217 -11.014 2129 HD12 LEU 18 HD12 LEU 18 209.382 204.495 -10.976 2130 HD13 LEU 18 HD13 LEU 18 210.216 204.884 -9.468 2131 HD21 LEU 18 HD21 LEU 18 207.486 207.457 -10.111 2132 HD22 LEU 18 HD22 LEU 18 207.898 206.105 -9.065 2133 HD23 LEU 18 HD23 LEU 18 207.439 205.791 -10.727 2134 H LEU 19 HN LEU 19 212.080 209.515 -8.354 2135 HA LEU 19 HA LEU 19 210.615 210.426 -6.103 2136 HB2 LEU 19 HB2 LEU 19 213.513 211.029 -6.737 2137 HB3 LEU 19 HB1 LEU 19 212.741 211.101 -5.154 2138 HG LEU 19 HG LEU 19 213.162 208.630 -6.841 2139 HD11 LEU 19 HD11 LEU 19 215.175 209.224 -5.719 2140 HD12 LEU 19 HD12 LEU 19 214.450 207.887 -4.823 2141 HD13 LEU 19 HD13 LEU 19 214.305 209.535 -4.216 2142 HD21 LEU 19 HD21 LEU 19 211.490 209.063 -4.400 2143 HD22 LEU 19 HD22 LEU 19 212.240 207.491 -4.701 2144 HD23 LEU 19 HD23 LEU 19 211.105 208.160 -5.871 2145 H PHE 20 HN PHE 20 212.133 212.189 -8.791 2146 HA PHE 20 HA PHE 20 211.187 214.766 -7.710 2147 HB2 PHE 20 HB2 PHE 20 212.845 213.947 -10.096 2148 HB3 PHE 20 HB1 PHE 20 212.119 215.552 -10.040 2149 HD1 PHE 20 HD1 PHE 20 214.438 213.235 -8.342 2150 HD2 PHE 20 HD2 PHE 20 212.926 217.242 -8.579 2151 HE1 PHE 20 HE1 PHE 20 216.241 214.023 -6.847 2152 HE2 PHE 20 HE2 PHE 20 214.741 218.026 -7.086 2153 HZ PHE 20 HZ PHE 20 216.404 216.407 -6.216 2154 H GLY 21 HN GLY 21 209.980 212.252 -9.638 2155 HA2 GLY 21 HA2 GLY 21 207.949 212.064 -10.749 2156 HA3 GLY 21 HA1 GLY 21 207.596 213.732 -10.292 2157 H THR 22 HN THR 22 206.836 213.209 -12.784 2158 HA THR 22 HA THR 22 209.059 213.961 -14.589 2159 HB THR 22 HB THR 22 206.274 212.983 -15.259 2160 HG1 THR 22 HG1 THR 22 207.203 211.202 -14.600 2161 HG21 THR 22 HG21 THR 22 208.728 213.620 -16.902 2162 HG22 THR 22 HG22 THR 22 207.096 214.261 -17.093 2163 HG23 THR 22 HG23 THR 22 207.437 212.579 -17.502 2164 H LYS 23 HN LYS 23 205.823 214.968 -13.555 2165 HA LYS 23 HA LYS 23 205.612 217.174 -15.327 2166 HB2 LYS 23 HB2 LYS 23 204.292 216.457 -12.722 2167 HB3 LYS 23 HB1 LYS 23 204.023 218.049 -13.427 2168 HG2 LYS 23 HG2 LYS 23 203.214 217.002 -15.507 2169 HG3 LYS 23 HG1 LYS 23 203.488 215.400 -14.827 2170 HD2 LYS 23 HD2 LYS 23 201.903 215.923 -12.993 2171 HD3 LYS 23 HD1 LYS 23 201.596 217.498 -13.726 2172 HE2 LYS 23 HE2 LYS 23 200.831 216.352 -15.798 2173 HE3 LYS 23 HE1 LYS 23 201.067 214.797 -14.999 2174 HZ1 LYS 23 HZ1 LYS 23 198.872 215.177 -14.568 2175 HZ2 LYS 23 HZ2 LYS 23 199.051 216.865 -14.490 2176 HZ3 LYS 23 HZ3 LYS 23 199.562 215.892 -13.194 2177 H LYS 24 HN LYS 24 206.816 216.979 -11.950 2178 HA LYS 24 HA LYS 24 207.381 219.728 -11.704 2179 HB2 LYS 24 HB2 LYS 24 207.254 217.908 -9.870 2180 HB3 LYS 24 HB1 LYS 24 208.929 217.556 -10.293 2181 HG2 LYS 24 HG2 LYS 24 209.555 219.887 -9.847 2182 HG3 LYS 24 HG1 LYS 24 207.873 220.282 -9.487 2183 HD2 LYS 24 HD2 LYS 24 207.883 218.671 -7.631 2184 HD3 LYS 24 HD1 LYS 24 209.566 218.278 -7.978 2185 HE2 LYS 24 HE2 LYS 24 210.021 220.814 -7.702 2186 HE3 LYS 24 HE1 LYS 24 208.432 220.880 -6.941 2187 HZ1 LYS 24 HZ1 LYS 24 210.821 220.167 -5.762 2188 HZ2 LYS 24 HZ2 LYS 24 209.943 218.720 -5.905 2189 HZ3 LYS 24 HZ3 LYS 24 209.270 220.047 -5.085 2190 H LEU 25 HN LEU 25 209.333 216.958 -12.769 2191 HA LEU 25 HA LEU 25 211.759 218.340 -13.022 2192 HB2 LEU 25 HB2 LEU 25 211.771 215.951 -13.042 2193 HB3 LEU 25 HB1 LEU 25 210.726 215.881 -14.455 2194 HG LEU 25 HG LEU 25 213.307 217.407 -14.700 2195 HD11 LEU 25 HD11 LEU 25 214.414 215.209 -15.369 2196 HD12 LEU 25 HD12 LEU 25 213.081 214.393 -14.546 2197 HD13 LEU 25 HD13 LEU 25 214.165 215.455 -13.643 2198 HD21 LEU 25 HD21 LEU 25 212.989 217.121 -16.950 2199 HD22 LEU 25 HD22 LEU 25 211.325 216.764 -16.515 2200 HD23 LEU 25 HD23 LEU 25 212.454 215.447 -16.780 2201 H GLY 26 HN GLY 26 208.893 218.439 -14.978 2202 HA2 GLY 26 HA2 GLY 26 210.110 219.260 -17.415 2203 HA3 GLY 26 HA1 GLY 26 208.427 219.514 -16.963 2204 H SER 27 HN SER 27 208.512 221.097 -14.806 2205 HA SER 27 HA SER 27 209.079 223.653 -15.873 2206 HB2 SER 27 HB2 SER 27 208.498 222.774 -13.033 2207 HB3 SER 27 HB1 SER 27 208.651 224.457 -13.523 2208 HG SER 27 HG SER 27 206.677 222.576 -14.081 2209 H ILE 28 HN ILE 28 210.890 221.593 -13.579 2210 HA ILE 28 HA ILE 28 212.868 223.505 -12.944 2211 HB ILE 28 HB ILE 28 212.935 220.481 -12.950 2212 HG12 ILE 28 HG12 ILE 28 212.835 222.442 -10.644 2213 HG13 ILE 28 HG11 ILE 28 211.387 221.748 -11.374 2214 HG21 ILE 28 HG21 ILE 28 214.942 220.881 -11.399 2215 HG22 ILE 28 HG22 ILE 28 214.986 222.517 -12.057 2216 HG23 ILE 28 HG23 ILE 28 215.220 221.132 -13.122 2217 HD11 ILE 28 HD11 ILE 28 212.029 219.528 -10.761 2218 HD12 ILE 28 HD12 ILE 28 212.294 220.520 -9.327 2219 HD13 ILE 28 HD13 ILE 28 213.660 220.044 -10.336 2220 H GLY 29 HN GLY 29 212.817 220.934 -15.458 2221 HA2 GLY 29 HA2 GLY 29 215.395 221.505 -16.465 2222 HA3 GLY 29 HA1 GLY 29 214.118 220.674 -17.343 2223 H SER 30 HN SER 30 212.172 222.566 -17.657 2224 HA SER 30 HA SER 30 213.148 224.152 -19.762 2225 HB2 SER 30 HB2 SER 30 210.619 224.633 -18.172 2226 HB3 SER 30 HB1 SER 30 210.962 225.178 -19.810 2227 HG SER 30 HG SER 30 210.171 222.717 -18.878 2228 H ASP 31 HN ASP 31 212.580 224.885 -16.340 2229 HA ASP 31 HA ASP 31 213.007 227.674 -16.558 2230 HB2 ASP 31 HB2 ASP 31 213.060 225.735 -14.253 2231 HB3 ASP 31 HB1 ASP 31 213.699 227.360 -14.023 2232 H LEU 32 HN LEU 32 215.189 224.972 -15.874 2233 HA LEU 32 HA LEU 32 217.504 226.737 -15.725 2234 HB2 LEU 32 HB2 LEU 32 217.294 223.715 -15.728 2235 HB3 LEU 32 HB1 LEU 32 218.778 224.622 -15.466 2236 HG LEU 32 HG LEU 32 216.295 224.985 -13.763 2237 HD11 LEU 32 HD11 LEU 32 217.320 223.528 -12.119 2238 HD12 LEU 32 HD12 LEU 32 218.753 223.329 -13.128 2239 HD13 LEU 32 HD13 LEU 32 217.208 222.652 -13.647 2240 HD21 LEU 32 HD21 LEU 32 217.647 226.879 -13.425 2241 HD22 LEU 32 HD22 LEU 32 219.146 225.977 -13.638 2242 HD23 LEU 32 HD23 LEU 32 218.213 225.797 -12.156 2243 H GLY 33 HN GLY 33 215.767 225.236 -18.243 2244 HA2 GLY 33 HA2 GLY 33 218.041 224.854 -19.997 2245 HA3 GLY 33 HA1 GLY 33 216.348 224.617 -20.403 2246 H ALA 34 HN ALA 34 216.681 227.592 -18.890 2247 HA ALA 34 HA ALA 34 216.011 229.028 -21.234 2248 HB1 ALA 34 HB1 ALA 34 216.731 229.805 -18.421 2249 HB2 ALA 34 HB2 ALA 34 215.229 230.066 -19.302 2250 HB3 ALA 34 HB3 ALA 34 216.643 231.053 -19.667 2251 H SER 35 HN SER 35 219.088 228.513 -19.569 2252 HA SER 35 HA SER 35 220.576 230.410 -21.067 2253 HB2 SER 35 HB2 SER 35 221.450 229.461 -18.956 2254 HB3 SER 35 HB1 SER 35 221.579 227.877 -19.725 2255 HG SER 35 HG SER 35 223.213 230.044 -19.882 2256 H ILE 36 HN ILE 36 219.766 227.030 -21.602 2257 HA ILE 36 HA ILE 36 221.512 226.542 -23.762 2258 HB ILE 36 HB ILE 36 218.844 225.305 -23.047 2259 HG12 ILE 36 HG12 ILE 36 221.644 224.174 -22.901 2260 HG13 ILE 36 HG11 ILE 36 220.894 224.996 -21.542 2261 HG21 ILE 36 HG21 ILE 36 220.805 224.665 -25.264 2262 HG22 ILE 36 HG22 ILE 36 219.064 224.913 -25.396 2263 HG23 ILE 36 HG23 ILE 36 219.690 223.456 -24.629 2264 HD11 ILE 36 HD11 ILE 36 218.968 223.367 -21.737 2265 HD12 ILE 36 HD12 ILE 36 220.499 222.640 -21.248 2266 HD13 ILE 36 HD13 ILE 36 219.934 222.473 -22.911 2267 H LYS 37 HN LYS 37 218.235 227.862 -23.617 2268 HA LYS 37 HA LYS 37 217.680 227.947 -26.350 2269 HB2 LYS 37 HB2 LYS 37 216.897 229.872 -24.149 2270 HB3 LYS 37 HB1 LYS 37 216.215 229.902 -25.774 2271 HG2 LYS 37 HG2 LYS 37 215.410 227.591 -25.493 2272 HG3 LYS 37 HG1 LYS 37 216.112 227.540 -23.874 2273 HD2 LYS 37 HD2 LYS 37 214.663 229.434 -23.197 2274 HD3 LYS 37 HD1 LYS 37 213.935 229.438 -24.804 2275 HE2 LYS 37 HE2 LYS 37 213.925 227.031 -22.963 2276 HE3 LYS 37 HE1 LYS 37 212.594 228.183 -23.078 2277 HZ1 LYS 37 HZ1 LYS 37 212.917 225.992 -24.637 2278 HZ2 LYS 37 HZ2 LYS 37 213.504 227.238 -25.631 2279 HZ3 LYS 37 HZ3 LYS 37 211.928 227.321 -25.004 2280 H GLY 38 HN GLY 38 219.597 230.156 -24.333 2281 HA2 GLY 38 HA2 GLY 38 219.933 232.149 -26.341 2282 HA3 GLY 38 HA1 GLY 38 220.925 231.961 -24.905 2283 H PHE 39 HN PHE 39 221.916 229.334 -25.364 2284 HA PHE 39 HA PHE 39 224.107 229.894 -27.052 2285 HB2 PHE 39 HB2 PHE 39 223.001 227.381 -25.818 2286 HB3 PHE 39 HB1 PHE 39 224.343 227.283 -26.957 2287 HD1 PHE 39 HD1 PHE 39 223.409 229.609 -24.134 2288 HD2 PHE 39 HD2 PHE 39 226.416 227.084 -25.880 2289 HE1 PHE 39 HE1 PHE 39 224.976 230.240 -22.334 2290 HE2 PHE 39 HE2 PHE 39 227.986 227.722 -24.071 2291 HZ PHE 39 HZ PHE 39 227.266 229.299 -22.299 2292 H LYS 40 HN LYS 40 221.185 227.952 -27.574 2293 HA LYS 40 HA LYS 40 221.740 227.099 -30.191 2294 HB2 LYS 40 HB2 LYS 40 219.887 226.233 -28.778 2295 HB3 LYS 40 HB1 LYS 40 219.037 227.763 -28.994 2296 HG2 LYS 40 HG2 LYS 40 218.974 227.407 -31.423 2297 HG3 LYS 40 HG1 LYS 40 219.862 225.893 -31.232 2298 HD2 LYS 40 HD2 LYS 40 218.040 224.974 -29.863 2299 HD3 LYS 40 HD1 LYS 40 217.154 226.492 -30.004 2300 HE2 LYS 40 HE2 LYS 40 216.448 224.650 -31.620 2301 HE3 LYS 40 HE1 LYS 40 216.844 226.202 -32.356 2302 HZ1 LYS 40 HZ1 LYS 40 217.867 224.310 -33.508 2303 HZ2 LYS 40 HZ2 LYS 40 218.730 223.925 -32.096 2304 HZ3 LYS 40 HZ3 LYS 40 219.021 225.394 -32.898 2305 H LYS 41 HN LYS 41 220.029 230.016 -29.030 2306 HA LYS 41 HA LYS 41 219.374 231.058 -31.556 2307 HB2 LYS 41 HB2 LYS 41 218.515 231.791 -29.272 2308 HB3 LYS 41 HB1 LYS 41 220.010 232.711 -29.111 2309 HG2 LYS 41 HG2 LYS 41 219.488 233.966 -31.152 2310 HG3 LYS 41 HG1 LYS 41 218.026 233.005 -31.386 2311 HD2 LYS 41 HD2 LYS 41 217.130 233.817 -29.246 2312 HD3 LYS 41 HD1 LYS 41 218.591 234.770 -28.986 2313 HE2 LYS 41 HE2 LYS 41 218.121 236.066 -31.031 2314 HE3 LYS 41 HE1 LYS 41 216.666 235.111 -31.310 2315 HZ1 LYS 41 HZ1 LYS 41 215.792 235.901 -29.195 2316 HZ2 LYS 41 HZ2 LYS 41 216.147 237.202 -30.228 2317 HZ3 LYS 41 HZ3 LYS 41 217.191 236.828 -28.941 2318 H ALA 42 HN ALA 42 222.161 231.854 -29.416 2319 HA ALA 42 HA ALA 42 223.359 233.685 -31.174 2320 HB1 ALA 42 HB1 ALA 42 224.565 231.865 -29.104 2321 HB2 ALA 42 HB2 ALA 42 224.192 233.579 -28.961 2322 HB3 ALA 42 HB3 ALA 42 225.515 233.049 -29.998 2323 H MET 43 HN MET 43 223.838 230.119 -31.027 2324 HA MET 43 HA MET 43 225.720 230.168 -33.197 2325 HB2 MET 43 HB2 MET 43 224.441 228.099 -31.468 2326 HB3 MET 43 HB1 MET 43 224.977 227.554 -33.053 2327 HG2 MET 43 HG2 MET 43 227.243 228.345 -32.609 2328 HG3 MET 43 HG1 MET 43 226.737 229.028 -31.067 2329 HE1 MET 43 HE1 MET 43 225.258 227.460 -29.381 2330 HE2 MET 43 HE2 MET 43 226.905 227.883 -28.923 2331 HE3 MET 43 HE3 MET 43 226.323 226.241 -28.668 2332 H SER 44 HN SER 44 222.723 231.133 -33.423 2333 HA SER 44 HA SER 44 222.435 230.362 -36.153 2334 HB2 SER 44 HB2 SER 44 221.639 228.275 -35.282 2335 HB3 SER 44 HB1 SER 44 220.603 229.094 -34.115 2336 HG SER 44 HG SER 44 219.400 229.913 -35.840 2337 H ASP 45 HN ASP 45 222.393 232.752 -36.117 2338 HA ASP 45 HA ASP 45 220.410 234.243 -34.774 2339 HB2 ASP 45 HB2 ASP 45 222.093 234.760 -37.235 2340 HB3 ASP 45 HB1 ASP 45 220.873 235.917 -36.716 2341 H ASP 46 HN ASP 46 220.465 232.865 -38.091 2342 HA ASP 46 HA ASP 46 217.665 233.660 -38.469 2343 HB2 ASP 46 HB2 ASP 46 219.283 234.012 -40.306 2344 HB3 ASP 46 HB1 ASP 46 219.574 232.272 -40.373 2345 H GLU 47 HN GLU 47 216.396 231.793 -39.791 2346 HA GLU 47 HA GLU 47 216.942 229.115 -39.083 2347 HB2 GLU 47 HB2 GLU 47 216.219 230.183 -36.838 2348 HB3 GLU 47 HB1 GLU 47 214.597 230.215 -37.535 2349 HG2 GLU 47 HG2 GLU 47 214.792 228.164 -36.303 2350 HG3 GLU 47 HG1 GLU 47 214.858 227.745 -38.013 2351 HA PRO 48 HA PRO 48 213.953 229.249 -42.476 2352 HB2 PRO 48 HB2 PRO 48 213.910 226.596 -43.128 2353 HB3 PRO 48 HB1 PRO 48 215.264 227.666 -43.548 2354 HG2 PRO 48 HG2 PRO 48 215.025 225.719 -41.297 2355 HG3 PRO 48 HG1 PRO 48 216.409 226.055 -42.353 2356 HD2 PRO 48 HD2 PRO 48 216.186 227.078 -39.816 2357 HD3 PRO 48 HD1 PRO 48 217.079 227.901 -41.112 2358 H LYS 49 HN LYS 49 213.628 227.403 -39.574 2359 HA LYS 49 HA LYS 49 210.777 227.760 -39.539 2360 HB2 LYS 49 HB2 LYS 49 210.194 225.369 -39.426 2361 HB3 LYS 49 HB1 LYS 49 210.899 225.793 -40.983 2362 HG2 LYS 49 HG2 LYS 49 213.087 224.933 -40.242 2363 HG3 LYS 49 HG1 LYS 49 212.408 224.538 -38.668 2364 HD2 LYS 49 HD2 LYS 49 212.385 222.495 -39.901 2365 HD3 LYS 49 HD1 LYS 49 210.721 223.072 -39.895 2366 HE2 LYS 49 HE2 LYS 49 210.851 223.806 -42.151 2367 HE3 LYS 49 HE1 LYS 49 212.612 223.735 -42.163 2368 HZ1 LYS 49 HZ1 LYS 49 211.294 221.245 -41.527 2369 HZ2 LYS 49 HZ2 LYS 49 212.598 221.553 -42.572 2370 HZ3 LYS 49 HZ3 LYS 49 211.003 221.812 -43.098 2371 HCN FME 1 HCN FME 1 239.793 189.851 -11.834 2372 HA FME 1 HA FME 1 238.772 189.105 -8.601 2373 HB2 FME 1 HB2 FME 1 240.843 190.925 -7.376 2374 HB3 FME 1 HB1 FME 1 240.337 189.315 -6.861 2375 HG2 FME 1 HG2 FME 1 242.417 188.903 -7.869 2376 HG3 FME 1 HG1 FME 1 241.286 188.542 -9.173 2377 HE1 FME 1 HE1 FME 1 244.661 190.267 -10.426 2378 HE2 FME 1 HE2 FME 1 244.082 188.845 -9.563 2379 HE3 FME 1 HE3 FME 1 244.643 190.247 -8.656 2380 H GLY 2 HN GLY 2 238.986 192.478 -9.310 2381 HA2 GLY 2 HA2 GLY 2 237.441 194.153 -8.856 2382 HA3 GLY 2 HA1 GLY 2 236.538 193.006 -7.868 2383 H GLY 3 HN GLY 3 236.865 195.594 -6.988 2384 HA2 GLY 3 HA2 GLY 3 237.622 195.403 -4.384 2385 HA3 GLY 3 HA1 GLY 3 239.131 195.795 -5.203 2386 H ILE 4 HN ILE 4 239.166 197.771 -6.528 2387 HA ILE 4 HA ILE 4 237.558 199.908 -5.276 2388 HB ILE 4 HB ILE 4 240.072 200.024 -6.961 2389 HG12 ILE 4 HG12 ILE 4 239.693 200.561 -4.002 2390 HG13 ILE 4 HG11 ILE 4 240.246 199.013 -4.640 2391 HG21 ILE 4 HG21 ILE 4 240.098 202.402 -6.035 2392 HG22 ILE 4 HG22 ILE 4 238.421 202.137 -5.560 2393 HG23 ILE 4 HG23 ILE 4 238.875 202.074 -7.263 2394 HD11 ILE 4 HD11 ILE 4 242.108 200.565 -3.938 2395 HD12 ILE 4 HD12 ILE 4 241.610 201.652 -5.234 2396 HD13 ILE 4 HD13 ILE 4 242.203 200.036 -5.618 2397 H SER 5 HN SER 5 235.761 200.424 -6.349 2398 HA SER 5 HA SER 5 235.836 200.501 -9.315 2399 HB2 SER 5 HB2 SER 5 234.367 198.729 -8.579 2400 HB3 SER 5 HB1 SER 5 233.546 199.822 -7.474 2401 HG SER 5 HG SER 5 233.541 199.773 -10.301 2402 H ILE 6 HN ILE 6 235.557 202.369 -10.200 2403 HA ILE 6 HA ILE 6 235.108 204.759 -8.719 2404 HB ILE 6 HB ILE 6 236.342 204.413 -10.981 2405 HG12 ILE 6 HG12 ILE 6 234.383 206.719 -10.738 2406 HG13 ILE 6 HG11 ILE 6 235.922 206.617 -9.883 2407 HG21 ILE 6 HG21 ILE 6 235.061 204.622 -12.992 2408 HG22 ILE 6 HG22 ILE 6 233.579 204.954 -12.099 2409 HG23 ILE 6 HG23 ILE 6 234.287 203.341 -12.061 2410 HD11 ILE 6 HD11 ILE 6 235.447 206.876 -12.853 2411 HD12 ILE 6 HD12 ILE 6 236.981 206.274 -12.225 2412 HD13 ILE 6 HD13 ILE 6 236.435 207.896 -11.807 2413 H TRP 7 HN TRP 7 233.091 202.566 -10.590 2414 HA TRP 7 HA TRP 7 230.812 204.195 -10.839 2415 HB2 TRP 7 HB2 TRP 7 231.266 201.230 -10.901 2416 HB3 TRP 7 HB1 TRP 7 229.604 201.808 -10.758 2417 HD1 TRP 7 HD1 TRP 7 232.447 201.538 -13.258 2418 HE1 TRP 7 HE1 TRP 7 231.636 202.534 -15.507 2419 HE3 TRP 7 HE3 TRP 7 228.020 203.549 -11.752 2420 HZ2 TRP 7 HZ2 TRP 7 229.369 204.033 -16.500 2421 HZ3 TRP 7 HZ3 TRP 7 226.551 204.742 -13.352 2422 HH2 TRP 7 HH2 TRP 7 227.218 204.974 -15.728 2423 H GLN 8 HN GLN 8 232.048 202.409 -8.112 2424 HA GLN 8 HA GLN 8 229.677 202.309 -6.571 2425 HB2 GLN 8 HB2 GLN 8 232.598 202.274 -5.899 2426 HB3 GLN 8 HB1 GLN 8 231.436 202.424 -4.607 2427 HG2 GLN 8 HG2 GLN 8 232.251 200.028 -5.405 2428 HG3 GLN 8 HG1 GLN 8 230.579 200.293 -4.921 2429 HE21 GLN 8 HE21 GLN 8 229.356 199.010 -6.318 2430 HE22 GLN 8 HE22 GLN 8 229.509 199.008 -8.009 2431 H LEU 9 HN LEU 9 231.992 204.884 -7.108 2432 HA LEU 9 HA LEU 9 231.040 206.659 -5.075 2433 HB2 LEU 9 HB2 LEU 9 232.543 207.167 -7.658 2434 HB3 LEU 9 HB1 LEU 9 232.239 208.402 -6.442 2435 HG LEU 9 HG LEU 9 233.703 205.806 -5.898 2436 HD11 LEU 9 HD11 LEU 9 234.802 208.586 -6.398 2437 HD12 LEU 9 HD12 LEU 9 234.961 207.204 -7.482 2438 HD13 LEU 9 HD13 LEU 9 235.753 207.183 -5.907 2439 HD21 LEU 9 HD21 LEU 9 233.010 208.240 -4.266 2440 HD22 LEU 9 HD22 LEU 9 234.512 207.387 -3.924 2441 HD23 LEU 9 HD23 LEU 9 232.975 206.538 -3.806 2442 H LEU 10 HN LEU 10 230.216 206.205 -8.534 2443 HA LEU 10 HA LEU 10 228.608 208.499 -8.860 2444 HB2 LEU 10 HB2 LEU 10 228.892 205.805 -10.151 2445 HB3 LEU 10 HB1 LEU 10 227.495 206.777 -10.604 2446 HG LEU 10 HG LEU 10 230.161 208.174 -10.601 2447 HD11 LEU 10 HD11 LEU 10 230.951 206.282 -11.767 2448 HD12 LEU 10 HD12 LEU 10 230.392 207.324 -13.067 2449 HD13 LEU 10 HD13 LEU 10 229.391 205.979 -12.526 2450 HD21 LEU 10 HD21 LEU 10 229.162 209.479 -12.290 2451 HD22 LEU 10 HD22 LEU 10 227.782 209.075 -11.269 2452 HD23 LEU 10 HD23 LEU 10 228.055 208.187 -12.775 2453 H ILE 11 HN ILE 11 227.699 205.181 -7.895 2454 HA ILE 11 HA ILE 11 224.942 205.769 -7.602 2455 HB ILE 11 HB ILE 11 225.668 203.493 -7.886 2456 HG12 ILE 11 HG12 ILE 11 224.690 203.642 -5.030 2457 HG13 ILE 11 HG11 ILE 11 223.649 204.090 -6.381 2458 HG21 ILE 11 HG21 ILE 11 227.850 203.678 -6.796 2459 HG22 ILE 11 HG22 ILE 11 226.944 202.311 -6.153 2460 HG23 ILE 11 HG23 ILE 11 227.068 203.801 -5.226 2461 HD11 ILE 11 HD11 ILE 11 223.263 201.748 -5.868 2462 HD12 ILE 11 HD12 ILE 11 224.991 201.407 -5.938 2463 HD13 ILE 11 HD13 ILE 11 224.118 201.841 -7.408 2464 H ILE 12 HN ILE 12 227.653 205.764 -5.254 2465 HA ILE 12 HA ILE 12 226.075 206.369 -2.988 2466 HB ILE 12 HB ILE 12 228.986 206.812 -3.647 2467 HG12 ILE 12 HG12 ILE 12 227.501 204.883 -1.838 2468 HG13 ILE 12 HG11 ILE 12 228.244 204.491 -3.374 2469 HG21 ILE 12 HG21 ILE 12 227.493 207.458 -1.088 2470 HG22 ILE 12 HG22 ILE 12 228.485 208.544 -2.059 2471 HG23 ILE 12 HG23 ILE 12 229.242 207.251 -1.149 2472 HD11 ILE 12 HD11 ILE 12 229.865 203.796 -1.831 2473 HD12 ILE 12 HD12 ILE 12 229.575 205.165 -0.773 2474 HD13 ILE 12 HD13 ILE 12 230.435 205.401 -2.291 2475 H ALA 13 HN ALA 13 227.789 208.470 -5.307 2476 HA ALA 13 HA ALA 13 227.243 210.903 -4.013 2477 HB1 ALA 13 HB1 ALA 13 227.695 210.236 -6.923 2478 HB2 ALA 13 HB2 ALA 13 228.875 210.849 -5.764 2479 HB3 ALA 13 HB3 ALA 13 227.560 211.886 -6.316 2480 H VAL 14 HN VAL 14 225.387 209.027 -6.374 2481 HA VAL 14 HA VAL 14 223.367 210.927 -6.853 2482 HB VAL 14 HB VAL 14 223.505 207.927 -7.018 2483 HG11 VAL 14 HG11 VAL 14 221.183 208.338 -6.554 2484 HG12 VAL 14 HG12 VAL 14 221.324 208.104 -8.291 2485 HG13 VAL 14 HG13 VAL 14 221.149 209.731 -7.639 2486 HG21 VAL 14 HG21 VAL 14 224.558 209.889 -8.638 2487 HG22 VAL 14 HG22 VAL 14 222.981 209.666 -9.394 2488 HG23 VAL 14 HG23 VAL 14 224.081 208.309 -9.222 2489 H ILE 15 HN ILE 15 223.626 208.354 -4.404 2490 HA ILE 15 HA ILE 15 221.090 208.786 -3.243 2491 HB ILE 15 HB ILE 15 223.651 207.622 -2.133 2492 HG12 ILE 15 HG12 ILE 15 221.002 206.352 -2.753 2493 HG13 ILE 15 HG11 ILE 15 222.282 206.465 -3.937 2494 HG21 ILE 15 HG21 ILE 15 222.564 208.429 -0.179 2495 HG22 ILE 15 HG22 ILE 15 222.074 206.739 -0.306 2496 HG23 ILE 15 HG23 ILE 15 220.966 208.018 -0.804 2497 HD11 ILE 15 HD11 ILE 15 222.694 205.221 -1.213 2498 HD12 ILE 15 HD12 ILE 15 223.754 205.111 -2.619 2499 HD13 ILE 15 HD13 ILE 15 222.198 204.281 -2.621 2500 H VAL 16 HN VAL 16 224.266 210.192 -2.485 2501 HA VAL 16 HA VAL 16 223.491 211.705 -0.249 2502 HB VAL 16 HB VAL 16 225.572 212.208 -2.397 2503 HG11 VAL 16 HG11 VAL 16 226.609 213.739 -0.690 2504 HG12 VAL 16 HG12 VAL 16 225.110 213.650 0.215 2505 HG13 VAL 16 HG13 VAL 16 225.117 214.358 -1.396 2506 HG21 VAL 16 HG21 VAL 16 227.109 211.231 -0.886 2507 HG22 VAL 16 HG22 VAL 16 225.698 210.174 -0.840 2508 HG23 VAL 16 HG23 VAL 16 225.975 211.330 0.462 2509 H VAL 17 HN VAL 17 223.482 212.569 -3.714 2510 HA VAL 17 HA VAL 17 222.569 215.212 -3.361 2511 HB VAL 17 HB VAL 17 222.316 213.340 -5.723 2512 HG11 VAL 17 HG11 VAL 17 220.664 215.028 -6.047 2513 HG12 VAL 17 HG12 VAL 17 222.069 215.573 -6.962 2514 HG13 VAL 17 HG13 VAL 17 221.711 216.283 -5.387 2515 HG21 VAL 17 HG21 VAL 17 224.624 213.975 -4.893 2516 HG22 VAL 17 HG22 VAL 17 224.209 215.656 -5.229 2517 HG23 VAL 17 HG23 VAL 17 224.276 214.484 -6.546 2518 H LEU 18 HN LEU 18 220.782 212.163 -3.912 2519 HA LEU 18 HA LEU 18 218.237 213.407 -4.124 2520 HB2 LEU 18 HB2 LEU 18 218.971 210.596 -3.268 2521 HB3 LEU 18 HB1 LEU 18 217.325 211.145 -3.566 2522 HG LEU 18 HG LEU 18 219.557 211.187 -5.626 2523 HD11 LEU 18 HD11 LEU 18 217.438 209.184 -4.944 2524 HD12 LEU 18 HD12 LEU 18 219.095 208.935 -5.494 2525 HD13 LEU 18 HD13 LEU 18 217.852 209.421 -6.643 2526 HD21 LEU 18 HD21 LEU 18 216.724 212.154 -5.587 2527 HD22 LEU 18 HD22 LEU 18 217.344 211.456 -7.081 2528 HD23 LEU 18 HD23 LEU 18 218.151 212.847 -6.371 2529 H LEU 19 HN LEU 19 219.920 211.947 -1.317 2530 HA LEU 19 HA LEU 19 217.803 212.429 0.504 2531 HB2 LEU 19 HB2 LEU 19 220.745 212.200 1.161 2532 HB3 LEU 19 HB1 LEU 19 219.398 211.978 2.277 2533 HG LEU 19 HG LEU 19 220.038 210.259 -0.126 2534 HD11 LEU 19 HD11 LEU 19 221.487 209.741 1.664 2535 HD12 LEU 19 HD12 LEU 19 220.256 208.487 1.631 2536 HD13 LEU 19 HD13 LEU 19 220.169 209.773 2.833 2537 HD21 LEU 19 HD21 LEU 19 218.151 208.827 0.932 2538 HD22 LEU 19 HD22 LEU 19 217.731 210.179 -0.111 2539 HD23 LEU 19 HD23 LEU 19 217.640 210.361 1.647 2540 H PHE 20 HN PHE 20 220.640 214.390 -0.386 2541 HA PHE 20 HA PHE 20 219.765 216.551 1.415 2542 HB2 PHE 20 HB2 PHE 20 222.168 216.116 -0.347 2543 HB3 PHE 20 HB1 PHE 20 221.769 217.743 0.197 2544 HD1 PHE 20 HD2 PHE 20 221.651 218.263 2.615 2545 HD2 PHE 20 HD1 PHE 20 223.087 214.499 1.157 2546 HE1 PHE 20 HE2 PHE 20 222.731 217.836 4.803 2547 HE2 PHE 20 HE1 PHE 20 224.187 214.073 3.344 2548 HZ PHE 20 HZ PHE 20 224.005 215.741 5.167 2549 H GLY 21 HN GLY 21 219.137 215.518 -1.744 2550 HA2 GLY 21 HA2 GLY 21 217.805 216.479 -3.387 2551 HA3 GLY 21 HA1 GLY 21 217.588 217.878 -2.333 2552 H THR 22 HN THR 22 217.937 218.597 -4.871 2553 HA THR 22 HA THR 22 220.821 219.104 -5.283 2554 HB THR 22 HB THR 22 218.560 219.619 -7.220 2555 HG1 THR 22 HG1 THR 22 218.967 217.619 -8.033 2556 HG21 THR 22 HG21 THR 22 220.457 219.472 -8.856 2557 HG22 THR 22 HG22 THR 22 221.567 219.375 -7.489 2558 HG23 THR 22 HG23 THR 22 220.597 220.826 -7.736 2559 H LYS 23 HN LYS 23 217.696 220.756 -4.998 2560 HA LYS 23 HA LYS 23 218.683 223.371 -5.461 2561 HB2 LYS 23 HB2 LYS 23 216.274 222.749 -5.486 2562 HB3 LYS 23 HB1 LYS 23 216.337 222.549 -3.735 2563 HG2 LYS 23 HG2 LYS 23 216.939 224.891 -3.440 2564 HG3 LYS 23 HG1 LYS 23 217.028 225.119 -5.187 2565 HD2 LYS 23 HD2 LYS 23 214.639 224.606 -5.401 2566 HD3 LYS 23 HD1 LYS 23 214.526 224.320 -3.664 2567 HE2 LYS 23 HE2 LYS 23 215.217 226.666 -3.251 2568 HE3 LYS 23 HE1 LYS 23 215.284 226.942 -4.991 2569 HZ1 LYS 23 HZ1 LYS 23 212.941 226.414 -5.143 2570 HZ2 LYS 23 HZ2 LYS 23 213.182 227.678 -4.033 2571 HZ3 LYS 23 HZ3 LYS 23 212.869 226.104 -3.477 2572 H LYS 24 HN LYS 24 218.206 221.552 -2.409 2573 HA LYS 24 HA LYS 24 219.091 223.635 -0.709 2574 HB2 LYS 24 HB2 LYS 24 219.003 220.639 -0.351 2575 HB3 LYS 24 HB1 LYS 24 219.461 221.753 0.934 2576 HG2 LYS 24 HG2 LYS 24 217.301 222.875 0.783 2577 HG3 LYS 24 HG1 LYS 24 216.837 221.861 -0.583 2578 HD2 LYS 24 HD2 LYS 24 217.020 219.851 0.867 2579 HD3 LYS 24 HD1 LYS 24 217.431 220.890 2.232 2580 HE2 LYS 24 HE2 LYS 24 215.270 222.024 2.057 2581 HE3 LYS 24 HE1 LYS 24 214.860 221.064 0.636 2582 HZ1 LYS 24 HZ1 LYS 24 215.407 219.976 3.345 2583 HZ2 LYS 24 HZ2 LYS 24 214.985 219.068 1.973 2584 HZ3 LYS 24 HZ3 LYS 24 213.871 220.156 2.652 2585 H LEU 25 HN LEU 25 220.784 220.933 -2.277 2586 HA LEU 25 HA LEU 25 223.272 221.357 -1.051 2587 HB2 LEU 25 HB2 LEU 25 222.857 219.300 -2.204 2588 HB3 LEU 25 HB1 LEU 25 222.573 220.130 -3.730 2589 HG LEU 25 HG LEU 25 225.211 220.593 -2.359 2590 HD11 LEU 25 HD11 LEU 25 226.154 218.563 -3.405 2591 HD12 LEU 25 HD12 LEU 25 224.533 218.072 -3.905 2592 HD13 LEU 25 HD13 LEU 25 224.941 218.168 -2.191 2593 HD21 LEU 25 HD21 LEU 25 225.046 219.971 -5.273 2594 HD22 LEU 25 HD22 LEU 25 225.905 221.263 -4.437 2595 HD23 LEU 25 HD23 LEU 25 224.188 221.421 -4.784 2596 H GLY 26 HN GLY 26 221.635 223.164 -3.527 2597 HA2 GLY 26 HA2 GLY 26 223.938 224.324 -4.743 2598 HA3 GLY 26 HA1 GLY 26 222.304 224.979 -4.793 2599 H SER 27 HN SER 27 221.695 225.532 -2.238 2600 HA SER 27 HA SER 27 223.110 227.919 -1.714 2601 HB2 SER 27 HB2 SER 27 221.813 227.975 0.388 2602 HB3 SER 27 HB1 SER 27 220.799 227.618 -1.006 2603 HG SER 27 HG SER 27 220.304 226.157 0.597 2604 H ILE 28 HN ILE 28 223.323 224.669 -0.239 2605 HA ILE 28 HA ILE 28 225.112 225.384 1.821 2606 HB ILE 28 HB ILE 28 224.674 222.755 0.385 2607 HG12 ILE 28 HG12 ILE 28 223.795 223.657 3.142 2608 HG13 ILE 28 HG11 ILE 28 222.776 223.810 1.710 2609 HG21 ILE 28 HG21 ILE 28 225.751 221.824 2.507 2610 HG22 ILE 28 HG22 ILE 28 226.317 223.464 2.826 2611 HG23 ILE 28 HG23 ILE 28 226.850 222.613 1.376 2612 HD11 ILE 28 HD11 ILE 28 222.401 221.703 3.088 2613 HD12 ILE 28 HD12 ILE 28 224.005 221.182 2.573 2614 HD13 ILE 28 HD13 ILE 28 222.735 221.436 1.377 2615 H GLY 29 HN GLY 29 225.738 224.096 -1.477 2616 HA2 GLY 29 HA2 GLY 29 228.554 224.033 -1.213 2617 HA3 GLY 29 HA1 GLY 29 227.672 224.089 -2.733 2618 H SER 30 HN SER 30 226.434 226.527 -2.709 2619 HA SER 30 HA SER 30 228.508 228.306 -3.372 2620 HB2 SER 30 HB2 SER 30 225.646 229.004 -2.657 2621 HB3 SER 30 HB1 SER 30 226.770 230.000 -3.575 2622 HG SER 30 HG SER 30 226.306 228.869 -5.274 2623 H ASP 31 HN ASP 31 226.610 227.910 -0.393 2624 HA ASP 31 HA ASP 31 227.566 230.234 0.900 2625 HB2 ASP 31 HB2 ASP 31 226.461 227.646 2.008 2626 HB3 ASP 31 HB1 ASP 31 226.951 228.996 3.027 2627 H LEU 32 HN LEU 32 228.723 226.877 0.855 2628 HA LEU 32 HA LEU 32 230.999 227.535 2.558 2629 HB2 LEU 32 HB2 LEU 32 230.289 224.996 1.062 2630 HB3 LEU 32 HB1 LEU 32 231.625 225.162 2.195 2631 HG LEU 32 HG LEU 32 228.740 225.734 2.938 2632 HD11 LEU 32 HD11 LEU 32 228.876 223.497 4.097 2633 HD12 LEU 32 HD12 LEU 32 230.374 223.200 3.215 2634 HD13 LEU 32 HD13 LEU 32 228.859 223.405 2.334 2635 HD21 LEU 32 HD21 LEU 32 231.349 225.539 4.453 2636 HD22 LEU 32 HD22 LEU 32 229.821 225.208 5.268 2637 HD23 LEU 32 HD23 LEU 32 230.104 226.786 4.545 2638 H GLY 33 HN GLY 33 230.318 227.768 -0.771 2639 HA2 GLY 33 HA2 GLY 33 233.034 227.256 -1.664 2640 HA3 GLY 33 HA1 GLY 33 231.687 227.799 -2.654 2641 H ALA 34 HN ALA 34 231.830 229.705 0.109 2642 HA ALA 34 HA ALA 34 232.534 232.027 -1.341 2643 HB1 ALA 34 HB1 ALA 34 232.714 233.029 1.046 2644 HB2 ALA 34 HB2 ALA 34 232.145 231.452 1.593 2645 HB3 ALA 34 HB3 ALA 34 231.148 232.417 0.510 2646 H SER 35 HN SER 35 234.414 229.878 0.769 2647 HA SER 35 HA SER 35 236.716 231.529 0.916 2648 HB2 SER 35 HB2 SER 35 236.607 228.510 1.066 2649 HB3 SER 35 HB1 SER 35 237.860 229.560 1.721 2650 HG SER 35 HG SER 35 236.417 229.014 3.352 2651 H ILE 36 HN ILE 36 235.643 229.101 -1.392 2652 HA ILE 36 HA ILE 36 238.054 228.841 -2.839 2653 HB ILE 36 HB ILE 36 235.172 228.460 -3.685 2654 HG12 ILE 36 HG12 ILE 36 237.377 226.444 -3.216 2655 HG13 ILE 36 HG11 ILE 36 236.245 226.916 -1.958 2656 HG21 ILE 36 HG21 ILE 36 237.755 228.009 -5.201 2657 HG22 ILE 36 HG22 ILE 36 236.336 228.913 -5.727 2658 HG23 ILE 36 HG23 ILE 36 236.266 227.158 -5.609 2659 HD11 ILE 36 HD11 ILE 36 234.367 226.111 -3.245 2660 HD12 ILE 36 HD12 ILE 36 235.579 224.830 -3.207 2661 HD13 ILE 36 HD13 ILE 36 235.393 225.826 -4.651 2662 H LYS 37 HN LYS 37 235.350 231.086 -3.134 2663 HA LYS 37 HA LYS 37 236.084 232.345 -5.519 2664 HB2 LYS 37 HB2 LYS 37 234.443 233.894 -4.996 2665 HB3 LYS 37 HB1 LYS 37 234.011 232.663 -3.826 2666 HG2 LYS 37 HG2 LYS 37 234.060 234.582 -2.494 2667 HG3 LYS 37 HG1 LYS 37 235.643 233.936 -2.231 2668 HD2 LYS 37 HD2 LYS 37 236.513 235.940 -2.875 2669 HD3 LYS 37 HD1 LYS 37 235.979 235.574 -4.512 2670 HE2 LYS 37 HE2 LYS 37 234.498 237.088 -2.371 2671 HE3 LYS 37 HE1 LYS 37 234.995 237.664 -3.967 2672 HZ1 LYS 37 HZ1 LYS 37 232.810 235.850 -3.237 2673 HZ2 LYS 37 HZ2 LYS 37 233.577 235.627 -4.737 2674 HZ3 LYS 37 HZ3 LYS 37 232.827 237.108 -4.375 2675 H GLY 38 HN GLY 38 237.264 232.841 -2.200 2676 HA2 GLY 38 HA2 GLY 38 238.801 235.166 -2.795 2677 HA3 GLY 38 HA1 GLY 38 239.005 234.133 -1.392 2678 H PHE 39 HN PHE 39 239.608 231.681 -2.697 2679 HA PHE 39 HA PHE 39 242.383 231.996 -3.116 2680 HB2 PHE 39 HB2 PHE 39 240.415 229.781 -3.642 2681 HB3 PHE 39 HB1 PHE 39 242.074 229.626 -4.217 2682 HD1 PHE 39 HD1 PHE 39 240.424 230.912 -1.078 2683 HD2 PHE 39 HD2 PHE 39 243.424 228.357 -2.790 2684 HE1 PHE 39 HE1 PHE 39 241.140 230.237 1.191 2685 HE2 PHE 39 HE2 PHE 39 244.142 227.687 -0.516 2686 HZ PHE 39 HZ PHE 39 243.001 228.625 1.474 2687 H LYS 40 HN LYS 40 239.704 231.554 -5.399 2688 HA LYS 40 HA LYS 40 241.208 231.562 -7.773 2689 HB2 LYS 40 HB2 LYS 40 238.788 230.973 -7.602 2690 HB3 LYS 40 HB1 LYS 40 238.418 232.675 -7.343 2691 HG2 LYS 40 HG2 LYS 40 239.338 233.238 -9.543 2692 HG3 LYS 40 HG1 LYS 40 239.796 231.554 -9.804 2693 HD2 LYS 40 HD2 LYS 40 237.406 230.893 -9.619 2694 HD3 LYS 40 HD1 LYS 40 236.968 232.588 -9.419 2695 HE2 LYS 40 HE2 LYS 40 238.492 231.570 -11.826 2696 HE3 LYS 40 HE1 LYS 40 236.733 231.671 -11.784 2697 HZ1 LYS 40 HZ1 LYS 40 237.190 233.713 -12.605 2698 HZ2 LYS 40 HZ2 LYS 40 238.722 233.804 -11.877 2699 HZ3 LYS 40 HZ3 LYS 40 237.322 234.097 -10.959 2700 H LYS 41 HN LYS 41 239.710 234.255 -5.981 2701 HA LYS 41 HA LYS 41 240.444 236.295 -7.772 2702 HB2 LYS 41 HB2 LYS 41 239.698 236.239 -4.860 2703 HB3 LYS 41 HB1 LYS 41 240.251 237.743 -5.588 2704 HG2 LYS 41 HG2 LYS 41 238.070 236.155 -6.946 2705 HG3 LYS 41 HG1 LYS 41 237.674 237.176 -5.567 2706 HD2 LYS 41 HD2 LYS 41 238.672 239.116 -6.713 2707 HD3 LYS 41 HD1 LYS 41 239.070 238.103 -8.097 2708 HE2 LYS 41 HE2 LYS 41 236.670 237.592 -8.410 2709 HE3 LYS 41 HE1 LYS 41 236.279 238.635 -7.042 2710 HZ1 LYS 41 HZ1 LYS 41 236.123 239.654 -9.336 2711 HZ2 LYS 41 HZ2 LYS 41 237.821 239.609 -9.370 2712 HZ3 LYS 41 HZ3 LYS 41 237.018 240.520 -8.183 2713 H ALA 42 HN ALA 42 242.069 235.235 -4.749 2714 HA ALA 42 HA ALA 42 244.221 237.022 -4.930 2715 HB1 ALA 42 HB1 ALA 42 244.125 234.241 -3.762 2716 HB2 ALA 42 HB2 ALA 42 243.864 235.763 -2.914 2717 HB3 ALA 42 HB3 ALA 42 245.465 235.362 -3.534 2718 H MET 43 HN MET 43 243.950 233.722 -6.362 2719 HA MET 43 HA MET 43 246.579 233.885 -7.514 2720 HB2 MET 43 HB2 MET 43 244.317 231.932 -7.495 2721 HB3 MET 43 HB1 MET 43 245.401 231.845 -8.881 2722 HG2 MET 43 HG2 MET 43 247.151 231.027 -7.629 2723 HG3 MET 43 HG1 MET 43 246.763 232.028 -6.232 2724 HE1 MET 43 HE1 MET 43 244.819 231.806 -4.862 2725 HE2 MET 43 HE2 MET 43 245.993 230.805 -4.011 2726 HE3 MET 43 HE3 MET 43 244.328 230.253 -4.163 2727 H SER 44 HN SER 44 244.244 235.867 -8.178 2728 HA SER 44 HA SER 44 243.730 235.525 -10.967 2729 HB2 SER 44 HB2 SER 44 242.841 237.813 -10.840 2730 HB3 SER 44 HB1 SER 44 242.233 236.817 -9.521 2731 HG SER 44 HG SER 44 243.973 238.982 -9.496 2732 H ASP 45 HN ASP 45 246.491 236.529 -9.281 2733 HA ASP 45 HA ASP 45 247.483 238.598 -10.923 2734 HB2 ASP 45 HB2 ASP 45 248.889 236.491 -9.272 2735 HB3 ASP 45 HB1 ASP 45 249.737 237.799 -10.094 2736 H ASP 46 HN ASP 46 247.926 235.037 -11.153 2737 HA ASP 46 HA ASP 46 249.403 235.336 -13.664 2738 HB2 ASP 46 HB2 ASP 46 249.567 232.858 -13.533 2739 HB3 ASP 46 HB1 ASP 46 250.199 233.668 -12.102 2740 H GLU 47 HN GLU 47 246.840 236.348 -13.940 2741 HA GLU 47 HA GLU 47 245.757 234.540 -15.970 2742 HB2 GLU 47 HB2 GLU 47 243.937 235.577 -13.776 2743 HB3 GLU 47 HB1 GLU 47 243.493 234.560 -15.143 2744 HG2 GLU 47 HG2 GLU 47 245.094 232.819 -14.284 2745 HG3 GLU 47 HG1 GLU 47 245.308 233.806 -12.842 2746 HA PRO 48 HA PRO 48 245.894 238.956 -17.358 2747 HB2 PRO 48 HB2 PRO 48 245.317 237.549 -19.944 2748 HB3 PRO 48 HB1 PRO 48 246.505 238.822 -19.596 2749 HG2 PRO 48 HG2 PRO 48 247.262 236.294 -19.914 2750 HG3 PRO 48 HG1 PRO 48 248.029 237.331 -18.696 2751 HD2 PRO 48 HD2 PRO 48 246.014 235.139 -18.304 2752 HD3 PRO 48 HD1 PRO 48 247.380 235.613 -17.267 2753 H LYS 49 HN LYS 49 244.236 240.356 -17.666 2754 HA LYS 49 HA LYS 49 241.543 239.356 -17.402 2755 HB2 LYS 49 HB2 LYS 49 242.378 242.223 -17.876 2756 HB3 LYS 49 HB1 LYS 49 240.915 241.638 -17.091 2757 HG2 LYS 49 HG2 LYS 49 243.675 241.092 -15.960 2758 HG3 LYS 49 HG1 LYS 49 242.750 242.526 -15.545 2759 HD2 LYS 49 HD2 LYS 49 240.900 241.112 -14.733 2760 HD3 LYS 49 HD1 LYS 49 241.820 239.667 -15.148 2761 HE2 LYS 49 HE2 LYS 49 241.969 240.365 -12.718 2762 HE3 LYS 49 HE1 LYS 49 243.519 240.175 -13.539 2763 HZ1 LYS 49 HZ1 LYS 49 242.086 242.753 -13.202 2764 HZ2 LYS 49 HZ2 LYS 49 243.626 242.534 -13.884 2765 HZ3 LYS 49 HZ3 LYS 49 243.376 242.231 -12.232 2766 HCN FME 1 HCN FME 1 229.755 186.513 -0.297 2767 HA FME 1 HA FME 1 230.224 187.906 -2.333 2768 HB2 FME 1 HB2 FME 1 228.363 190.297 -2.436 2769 HB3 FME 1 HB1 FME 1 229.391 189.708 -3.742 2770 HG2 FME 1 HG2 FME 1 228.121 187.483 -3.517 2771 HG3 FME 1 HG1 FME 1 226.953 188.382 -2.547 2772 HE1 FME 1 HE1 FME 1 225.987 186.902 -4.519 2773 HE2 FME 1 HE2 FME 1 225.467 187.615 -6.042 2774 HE3 FME 1 HE3 FME 1 224.738 188.155 -4.532 2775 H GLY 2 HN GLY 2 232.225 188.694 -2.163 2776 HA2 GLY 2 HA2 GLY 2 233.932 190.237 -1.803 2777 HA3 GLY 2 HA1 GLY 2 232.737 191.380 -1.198 2778 H GLY 3 HN GLY 3 235.213 190.989 0.049 2779 HA2 GLY 3 HA2 GLY 3 234.346 190.370 2.728 2780 HA3 GLY 3 HA1 GLY 3 235.499 189.202 2.088 2781 H ILE 4 HN ILE 4 235.794 191.128 4.300 2782 HA ILE 4 HA ILE 4 237.208 192.809 5.063 2783 HB ILE 4 HB ILE 4 239.161 191.275 3.324 2784 HG12 ILE 4 HG12 ILE 4 238.311 190.683 6.178 2785 HG13 ILE 4 HG11 ILE 4 237.685 189.814 4.779 2786 HG21 ILE 4 HG21 ILE 4 239.552 192.645 6.004 2787 HG22 ILE 4 HG22 ILE 4 239.923 193.419 4.466 2788 HG23 ILE 4 HG23 ILE 4 240.803 191.975 4.954 2789 HD11 ILE 4 HD11 ILE 4 239.856 188.971 4.216 2790 HD12 ILE 4 HD12 ILE 4 239.642 188.700 5.945 2791 HD13 ILE 4 HD13 ILE 4 240.643 190.036 5.379 2792 H SER 5 HN SER 5 235.912 194.286 3.516 2793 HA SER 5 HA SER 5 237.718 195.449 1.468 2794 HB2 SER 5 HB2 SER 5 235.803 194.577 0.369 2795 HB3 SER 5 HB1 SER 5 234.715 195.257 1.576 2796 HG SER 5 HG SER 5 235.988 196.443 -0.576 2797 H ILE 6 HN ILE 6 238.381 197.423 1.712 2798 HA ILE 6 HA ILE 6 237.846 198.966 4.033 2799 HB ILE 6 HB ILE 6 239.934 199.007 2.523 2800 HG12 ILE 6 HG12 ILE 6 238.693 201.674 3.267 2801 HG13 ILE 6 HG11 ILE 6 239.479 200.585 4.410 2802 HG21 ILE 6 HG21 ILE 6 238.358 201.100 1.009 2803 HG22 ILE 6 HG22 ILE 6 238.525 199.451 0.421 2804 HG23 ILE 6 HG23 ILE 6 239.956 200.457 0.631 2805 HD11 ILE 6 HD11 ILE 6 240.768 201.889 1.997 2806 HD12 ILE 6 HD12 ILE 6 241.557 200.698 3.031 2807 HD13 ILE 6 HD13 ILE 6 241.088 202.265 3.690 2808 H TRP 7 HN TRP 7 236.602 198.868 0.823 2809 HA TRP 7 HA TRP 7 235.237 201.296 0.641 2810 HB2 TRP 7 HB2 TRP 7 234.931 198.638 -0.720 2811 HB3 TRP 7 HB1 TRP 7 233.622 199.806 -0.891 2812 HD1 TRP 7 HD1 TRP 7 237.145 199.112 -2.086 2813 HE1 TRP 7 HE1 TRP 7 237.851 201.025 -3.677 2814 HE3 TRP 7 HE3 TRP 7 233.252 202.318 -1.336 2815 HZ2 TRP 7 HZ2 TRP 7 236.868 203.618 -4.479 2816 HZ3 TRP 7 HZ3 TRP 7 233.162 204.495 -2.522 2817 HH2 TRP 7 HH2 TRP 7 234.966 205.129 -4.096 2818 H GLN 8 HN GLN 8 234.457 198.392 2.393 2819 HA GLN 8 HA GLN 8 231.676 198.845 2.723 2820 HB2 GLN 8 HB2 GLN 8 233.729 197.315 4.262 2821 HB3 GLN 8 HB1 GLN 8 232.144 197.526 4.960 2822 HG2 GLN 8 HG2 GLN 8 231.126 196.517 2.962 2823 HG3 GLN 8 HG1 GLN 8 232.715 196.324 2.232 2824 HE21 GLN 8 HE21 GLN 8 232.941 194.047 2.268 2825 HE22 GLN 8 HE22 GLN 8 232.871 193.121 3.689 2826 H LEU 9 HN LEU 9 234.472 200.175 4.367 2827 HA LEU 9 HA LEU 9 233.049 201.433 6.507 2828 HB2 LEU 9 HB2 LEU 9 235.729 202.172 5.286 2829 HB3 LEU 9 HB1 LEU 9 235.121 202.741 6.836 2830 HG LEU 9 HG LEU 9 235.913 199.934 6.076 2831 HD11 LEU 9 HD11 LEU 9 237.395 200.217 8.073 2832 HD12 LEU 9 HD12 LEU 9 236.899 201.909 8.124 2833 HD13 LEU 9 HD13 LEU 9 237.771 201.284 6.723 2834 HD21 LEU 9 HD21 LEU 9 234.000 199.510 7.388 2835 HD22 LEU 9 HD22 LEU 9 234.284 200.919 8.413 2836 HD23 LEU 9 HD23 LEU 9 235.301 199.487 8.571 2837 H LEU 10 HN LEU 10 234.045 202.507 3.246 2838 HA LEU 10 HA LEU 10 233.426 205.251 3.540 2839 HB2 LEU 10 HB2 LEU 10 233.671 203.295 1.274 2840 HB3 LEU 10 HB1 LEU 10 233.013 204.890 0.920 2841 HG LEU 10 HG LEU 10 235.534 204.824 2.563 2842 HD11 LEU 10 HD11 LEU 10 236.799 204.807 0.261 2843 HD12 LEU 10 HD12 LEU 10 235.380 203.947 -0.317 2844 HD13 LEU 10 HD13 LEU 10 236.343 203.272 0.990 2845 HD21 LEU 10 HD21 LEU 10 235.949 206.888 1.481 2846 HD22 LEU 10 HD22 LEU 10 234.197 206.878 1.669 2847 HD23 LEU 10 HD23 LEU 10 234.914 206.480 0.102 2848 H ILE 11 HN ILE 11 231.403 202.551 2.363 2849 HA ILE 11 HA ILE 11 229.101 204.145 1.900 2850 HB ILE 11 HB ILE 11 229.282 201.977 0.861 2851 HG12 ILE 11 HG12 ILE 11 227.100 201.705 2.937 2852 HG13 ILE 11 HG11 ILE 11 227.000 202.860 1.605 2853 HG21 ILE 11 HG21 ILE 11 230.612 200.884 2.598 2854 HG22 ILE 11 HG22 ILE 11 229.224 199.904 2.144 2855 HG23 ILE 11 HG23 ILE 11 229.199 200.817 3.649 2856 HD11 ILE 11 HD11 ILE 11 225.890 200.738 1.000 2857 HD12 ILE 11 HD12 ILE 11 227.390 199.865 1.315 2858 HD13 ILE 11 HD13 ILE 11 227.311 201.018 -0.016 2859 H ILE 12 HN ILE 12 230.148 202.215 4.747 2860 HA ILE 12 HA ILE 12 227.829 202.698 6.292 2861 HB ILE 12 HB ILE 12 230.681 202.025 7.026 2862 HG12 ILE 12 HG12 ILE 12 228.092 200.457 7.064 2863 HG13 ILE 12 HG11 ILE 12 229.385 200.282 5.892 2864 HG21 ILE 12 HG21 ILE 12 229.797 201.537 9.338 2865 HG22 ILE 12 HG22 ILE 12 228.302 202.351 8.885 2866 HG23 ILE 12 HG23 ILE 12 229.823 203.242 8.944 2867 HD11 ILE 12 HD11 ILE 12 230.922 199.749 7.863 2868 HD12 ILE 12 HD12 ILE 12 229.707 198.525 7.476 2869 HD13 ILE 12 HD13 ILE 12 229.456 199.612 8.836 2870 H ALA 13 HN ALA 13 230.924 204.447 6.066 2871 HA ALA 13 HA ALA 13 230.406 206.327 8.090 2872 HB1 ALA 13 HB1 ALA 13 232.631 206.014 7.114 2873 HB2 ALA 13 HB2 ALA 13 232.128 207.699 6.971 2874 HB3 ALA 13 HB3 ALA 13 232.052 206.632 5.568 2875 H VAL 14 HN VAL 14 229.632 206.314 4.633 2876 HA VAL 14 HA VAL 14 228.647 208.950 4.459 2877 HB VAL 14 HB VAL 14 228.148 206.410 2.906 2878 HG11 VAL 14 HG11 VAL 14 227.016 207.889 1.210 2879 HG12 VAL 14 HG12 VAL 14 226.938 209.143 2.447 2880 HG13 VAL 14 HG13 VAL 14 226.077 207.614 2.673 2881 HG21 VAL 14 HG21 VAL 14 229.500 207.506 1.252 2882 HG22 VAL 14 HG22 VAL 14 230.321 207.722 2.796 2883 HG23 VAL 14 HG23 VAL 14 229.391 209.046 2.094 2884 H ILE 15 HN ILE 15 226.999 205.892 5.251 2885 HA ILE 15 HA ILE 15 224.410 206.983 5.498 2886 HB ILE 15 HB ILE 15 225.707 204.560 6.775 2887 HG12 ILE 15 HG12 ILE 15 223.549 204.759 4.698 2888 HG13 ILE 15 HG11 ILE 15 225.245 204.689 4.278 2889 HG21 ILE 15 HG21 ILE 15 222.857 205.560 6.978 2890 HG22 ILE 15 HG22 ILE 15 223.955 205.164 8.301 2891 HG23 ILE 15 HG23 ILE 15 223.312 203.882 7.276 2892 HD11 ILE 15 HD11 ILE 15 225.448 202.549 5.536 2893 HD12 ILE 15 HD12 ILE 15 224.293 202.431 4.209 2894 HD13 ILE 15 HD13 ILE 15 223.716 202.607 5.866 2895 H VAL 16 HN VAL 16 226.988 206.548 7.916 2896 HA VAL 16 HA VAL 16 225.556 207.450 10.154 2897 HB VAL 16 HB VAL 16 228.493 207.540 9.425 2898 HG11 VAL 16 HG11 VAL 16 228.247 209.340 10.996 2899 HG12 VAL 16 HG12 VAL 16 228.844 207.953 11.905 2900 HG13 VAL 16 HG13 VAL 16 227.145 208.393 11.990 2901 HG21 VAL 16 HG21 VAL 16 228.581 205.761 11.181 2902 HG22 VAL 16 HG22 VAL 16 227.583 205.321 9.795 2903 HG23 VAL 16 HG23 VAL 16 226.822 205.843 11.298 2904 H VAL 17 HN VAL 17 227.529 209.271 7.812 2905 HA VAL 17 HA VAL 17 227.228 211.784 9.060 2906 HB VAL 17 HB VAL 17 227.798 211.070 6.177 2907 HG11 VAL 17 HG11 VAL 17 227.810 213.712 7.651 2908 HG12 VAL 17 HG12 VAL 17 226.971 213.313 6.151 2909 HG13 VAL 17 HG13 VAL 17 228.729 213.455 6.168 2910 HG21 VAL 17 HG21 VAL 17 229.410 210.381 8.043 2911 HG22 VAL 17 HG22 VAL 17 229.661 212.104 8.327 2912 HG23 VAL 17 HG23 VAL 17 230.094 211.394 6.772 2913 H LEU 18 HN LEU 18 225.301 210.182 6.498 2914 HA LEU 18 HA LEU 18 223.611 212.422 6.046 2915 HB2 LEU 18 HB2 LEU 18 223.462 209.495 5.454 2916 HB3 LEU 18 HB1 LEU 18 222.000 210.461 5.264 2917 HG LEU 18 HG LEU 18 224.549 211.526 4.062 2918 HD11 LEU 18 HD11 LEU 18 224.767 209.420 3.137 2919 HD12 LEU 18 HD12 LEU 18 223.741 210.188 1.940 2920 HD13 LEU 18 HD13 LEU 18 223.045 209.091 3.146 2921 HD21 LEU 18 HD21 LEU 18 221.637 211.498 3.207 2922 HD22 LEU 18 HD22 LEU 18 222.923 212.388 2.404 2923 HD23 LEU 18 HD23 LEU 18 222.425 212.812 4.048 2924 H LEU 19 HN LEU 19 223.224 209.555 8.167 2925 HA LEU 19 HA LEU 19 220.657 210.315 9.110 2926 HB2 LEU 19 HB2 LEU 19 222.681 208.611 10.579 2927 HB3 LEU 19 HB1 LEU 19 220.940 208.650 10.848 2928 HG LEU 19 HG LEU 19 222.377 207.660 8.388 2929 HD11 LEU 19 HD11 LEU 19 221.117 205.574 8.909 2930 HD12 LEU 19 HD12 LEU 19 220.632 206.325 10.427 2931 HD13 LEU 19 HD13 LEU 19 222.339 206.019 10.095 2932 HD21 LEU 19 HD21 LEU 19 220.541 208.712 7.425 2933 HD22 LEU 19 HD22 LEU 19 219.490 208.316 8.796 2934 HD23 LEU 19 HD23 LEU 19 219.980 207.060 7.657 2935 H PHE 20 HN PHE 20 223.919 211.000 10.350 2936 HA PHE 20 HA PHE 20 222.795 212.616 12.546 2937 HB2 PHE 20 HB2 PHE 20 225.579 211.786 11.736 2938 HB3 PHE 20 HB1 PHE 20 225.348 213.119 12.863 2939 HD1 PHE 20 HD2 PHE 20 224.329 212.770 15.047 2940 HD2 PHE 20 HD1 PHE 20 225.041 209.512 12.355 2941 HE1 PHE 20 HE2 PHE 20 224.025 211.170 16.914 2942 HE2 PHE 20 HE1 PHE 20 224.762 207.908 14.225 2943 HZ PHE 20 HZ PHE 20 224.243 208.734 16.504 2944 H GLY 21 HN GLY 21 223.633 213.035 9.288 2945 HA2 GLY 21 HA2 GLY 21 223.602 214.951 7.972 2946 HA3 GLY 21 HA1 GLY 21 223.219 215.886 9.419 2947 H THR 22 HN THR 22 224.973 217.142 7.860 2948 HA THR 22 HA THR 22 227.688 216.438 8.801 2949 HB THR 22 HB THR 22 226.886 218.437 6.679 2950 HG1 THR 22 HG1 THR 22 227.019 216.839 5.279 2951 HG21 THR 22 HG21 THR 22 229.104 218.809 7.676 2952 HG22 THR 22 HG22 THR 22 229.258 218.219 6.022 2953 HG23 THR 22 HG23 THR 22 229.528 217.123 7.377 2954 H LYS 23 HN LYS 23 225.352 219.107 8.731 2955 HA LYS 23 HA LYS 23 227.032 221.018 9.985 2956 HB2 LYS 23 HB2 LYS 23 224.906 221.574 8.813 2957 HB3 LYS 23 HB1 LYS 23 224.011 220.829 10.136 2958 HG2 LYS 23 HG2 LYS 23 224.933 222.442 11.722 2959 HG3 LYS 23 HG1 LYS 23 225.945 223.145 10.459 2960 HD2 LYS 23 HD2 LYS 23 223.915 223.785 9.193 2961 HD3 LYS 23 HD1 LYS 23 222.909 223.106 10.472 2962 HE2 LYS 23 HE2 LYS 23 223.103 225.530 10.763 2963 HE3 LYS 23 HE1 LYS 23 223.921 224.702 12.087 2964 HZ1 LYS 23 HZ1 LYS 23 225.246 226.523 11.160 2965 HZ2 LYS 23 HZ2 LYS 23 225.252 225.753 9.646 2966 HZ3 LYS 23 HZ3 LYS 23 226.023 225.027 10.974 2967 H LYS 24 HN LYS 24 224.646 218.727 11.367 2968 HA LYS 24 HA LYS 24 225.000 219.542 14.051 2969 HB2 LYS 24 HB2 LYS 24 224.039 216.939 12.855 2970 HB3 LYS 24 HB1 LYS 24 224.020 217.272 14.583 2971 HG2 LYS 24 HG2 LYS 24 222.588 219.243 14.188 2972 HG3 LYS 24 HG1 LYS 24 222.618 218.919 12.454 2973 HD2 LYS 24 HD2 LYS 24 221.560 216.724 12.841 2974 HD3 LYS 24 HD1 LYS 24 221.526 217.045 14.574 2975 HE2 LYS 24 HE2 LYS 24 220.187 219.154 14.016 2976 HE3 LYS 24 HE1 LYS 24 220.011 218.494 12.391 2977 HZ1 LYS 24 HZ1 LYS 24 218.768 217.667 14.869 2978 HZ2 LYS 24 HZ2 LYS 24 219.335 216.392 13.901 2979 HZ3 LYS 24 HZ3 LYS 24 218.220 217.507 13.272 2980 H LEU 25 HN LEU 25 226.558 217.037 12.080 2981 HA LEU 25 HA LEU 25 228.089 215.910 14.146 2982 HB2 LEU 25 HB2 LEU 25 227.831 214.746 12.054 2983 HB3 LEU 25 HB1 LEU 25 228.634 216.036 11.168 2984 HG LEU 25 HG LEU 25 230.127 214.779 13.458 2985 HD11 LEU 25 HD11 LEU 25 231.003 213.061 11.775 2986 HD12 LEU 25 HD12 LEU 25 229.580 213.444 10.803 2987 HD13 LEU 25 HD13 LEU 25 229.390 212.777 12.425 2988 HD21 LEU 25 HD21 LEU 25 231.439 215.216 10.819 2989 HD22 LEU 25 HD22 LEU 25 231.970 215.678 12.432 2990 HD23 LEU 25 HD23 LEU 25 230.816 216.682 11.568 2991 H GLY 26 HN GLY 26 228.435 218.931 12.466 2992 HA2 GLY 26 HA2 GLY 26 231.231 219.285 12.877 2993 HA3 GLY 26 HA1 GLY 26 230.061 220.567 12.577 2994 H SER 27 HN SER 27 228.387 220.482 14.668 2995 HA SER 27 HA SER 27 229.851 221.709 16.756 2996 HB2 SER 27 HB2 SER 27 227.717 221.643 18.003 2997 HB3 SER 27 HB1 SER 27 227.499 222.227 16.355 2998 HG SER 27 HG SER 27 226.798 219.765 17.511 2999 H ILE 28 HN ILE 28 228.507 218.411 16.425 3000 HA ILE 28 HA ILE 28 229.107 217.570 19.051 3001 HB ILE 28 HB ILE 28 228.843 216.004 16.474 3002 HG12 ILE 28 HG12 ILE 28 226.949 216.266 18.827 3003 HG13 ILE 28 HG11 ILE 28 226.853 217.292 17.395 3004 HG21 ILE 28 HG21 ILE 28 229.170 215.109 19.348 3005 HG22 ILE 28 HG22 ILE 28 230.120 214.616 17.946 3006 HG23 ILE 28 HG23 ILE 28 228.449 214.076 18.113 3007 HD11 ILE 28 HD11 ILE 28 226.399 215.426 15.970 3008 HD12 ILE 28 HD12 ILE 28 225.352 215.228 17.375 3009 HD13 ILE 28 HD13 ILE 28 226.826 214.271 17.234 3010 H GLY 29 HN GLY 29 230.998 217.263 16.006 3011 HA2 GLY 29 HA2 GLY 29 233.171 215.896 17.193 3012 HA3 GLY 29 HA1 GLY 29 233.237 216.807 15.692 3013 H SER 30 HN SER 30 232.779 219.396 16.457 3014 HA SER 30 HA SER 30 235.254 220.182 17.527 3015 HB2 SER 30 HB2 SER 30 232.719 221.832 17.455 3016 HB3 SER 30 HB1 SER 30 234.374 222.429 17.526 3017 HG SER 30 HG SER 30 234.724 221.516 15.485 3018 H ASP 31 HN ASP 31 232.076 219.734 19.040 3019 HA ASP 31 HA ASP 31 232.737 220.867 21.547 3020 HB2 ASP 31 HB2 ASP 31 230.702 218.800 20.706 3021 HB3 ASP 31 HB1 ASP 31 230.839 219.377 22.365 3022 H LEU 32 HN LEU 32 232.926 217.557 20.284 3023 HA LEU 32 HA LEU 32 234.099 216.560 22.766 3024 HB2 LEU 32 HB2 LEU 32 233.680 215.221 20.081 3025 HB3 LEU 32 HB1 LEU 32 234.250 214.412 21.536 3026 HG LEU 32 HG LEU 32 231.616 215.909 21.382 3027 HD11 LEU 32 HD11 LEU 32 230.529 213.764 21.095 3028 HD12 LEU 32 HD12 LEU 32 232.074 212.919 21.201 3029 HD13 LEU 32 HD13 LEU 32 231.726 213.956 19.815 3030 HD21 LEU 32 HD21 LEU 32 231.224 214.242 23.392 3031 HD22 LEU 32 HD22 LEU 32 232.133 215.725 23.661 3032 HD23 LEU 32 HD23 LEU 32 232.985 214.196 23.456 3033 H GLY 33 HN GLY 33 235.297 218.117 19.973 3034 HA2 GLY 33 HA2 GLY 33 237.872 216.779 19.982 3035 HA3 GLY 33 HA1 GLY 33 237.397 218.140 18.975 3036 H ALA 34 HN ALA 34 236.551 218.801 22.161 3037 HA ALA 34 HA ALA 34 238.427 220.906 22.380 3038 HB1 ALA 34 HB1 ALA 34 237.605 220.887 24.855 3039 HB2 ALA 34 HB2 ALA 34 236.458 219.671 24.294 3040 HB3 ALA 34 HB3 ALA 34 236.453 221.280 23.578 3041 H SER 35 HN SER 35 238.396 217.610 23.682 3042 HA SER 35 HA SER 35 240.612 217.931 25.424 3043 HB2 SER 35 HB2 SER 35 239.729 215.395 24.026 3044 HB3 SER 35 HB1 SER 35 240.679 215.518 25.504 3045 HG SER 35 HG SER 35 238.761 216.788 26.273 3046 H ILE 36 HN ILE 36 240.330 217.098 22.015 3047 HA ILE 36 HA ILE 36 242.996 216.284 21.582 3048 HB ILE 36 HB ILE 36 240.973 217.520 19.696 3049 HG12 ILE 36 HG12 ILE 36 242.010 214.685 19.910 3050 HG13 ILE 36 HG11 ILE 36 240.543 215.221 20.714 3051 HG21 ILE 36 HG21 ILE 36 243.150 217.968 18.742 3052 HG22 ILE 36 HG22 ILE 36 242.512 216.551 17.915 3053 HG23 ILE 36 HG23 ILE 36 243.728 216.360 19.176 3054 HD11 ILE 36 HD11 ILE 36 241.072 215.267 17.731 3055 HD12 ILE 36 HD12 ILE 36 239.633 215.935 18.503 3056 HD13 ILE 36 HD13 ILE 36 239.952 214.202 18.582 3057 H LYS 37 HN LYS 37 241.445 219.458 21.480 3058 HA LYS 37 HA LYS 37 243.563 220.953 20.455 3059 HB2 LYS 37 HB2 LYS 37 241.187 221.751 20.998 3060 HB3 LYS 37 HB1 LYS 37 241.744 221.934 22.662 3061 HG2 LYS 37 HG2 LYS 37 243.467 223.498 21.968 3062 HG3 LYS 37 HG1 LYS 37 243.073 223.238 20.269 3063 HD2 LYS 37 HD2 LYS 37 240.801 224.135 20.663 3064 HD3 LYS 37 HD1 LYS 37 241.210 224.413 22.356 3065 HE2 LYS 37 HE2 LYS 37 243.011 225.954 21.675 3066 HE3 LYS 37 HE1 LYS 37 242.615 225.672 19.980 3067 HZ1 LYS 37 HZ1 LYS 37 241.377 227.518 20.349 3068 HZ2 LYS 37 HZ2 LYS 37 241.164 227.200 22.003 3069 HZ3 LYS 37 HZ3 LYS 37 240.238 226.365 20.848 3070 H GLY 38 HN GLY 38 242.964 219.794 23.759 3071 HA2 GLY 38 HA2 GLY 38 245.092 221.263 24.962 3072 HA3 GLY 38 HA1 GLY 38 244.298 219.859 25.654 3073 H PHE 39 HN PHE 39 244.884 217.947 23.626 3074 HA PHE 39 HA PHE 39 247.465 217.131 24.435 3075 HB2 PHE 39 HB2 PHE 39 245.587 216.290 22.238 3076 HB3 PHE 39 HB1 PHE 39 247.215 215.616 22.300 3077 HD1 PHE 39 HD1 PHE 39 244.548 216.432 24.836 3078 HD2 PHE 39 HD2 PHE 39 247.295 213.506 23.307 3079 HE1 PHE 39 HE1 PHE 39 243.812 214.838 26.577 3080 HE2 PHE 39 HE2 PHE 39 246.561 211.912 25.057 3081 HZ PHE 39 HZ PHE 39 244.819 212.576 26.691 3082 H LYS 40 HN LYS 40 246.312 218.658 21.444 3083 HA LYS 40 HA LYS 40 248.770 218.760 20.088 3084 HB2 LYS 40 HB2 LYS 40 246.539 219.271 19.085 3085 HB3 LYS 40 HB1 LYS 40 246.525 220.791 19.978 3086 HG2 LYS 40 HG2 LYS 40 248.538 221.538 18.821 3087 HG3 LYS 40 HG1 LYS 40 248.664 219.990 17.983 3088 HD2 LYS 40 HD2 LYS 40 246.472 220.397 16.909 3089 HD3 LYS 40 HD1 LYS 40 246.364 221.955 17.729 3090 HE2 LYS 40 HE2 LYS 40 248.428 222.697 16.593 3091 HE3 LYS 40 HE1 LYS 40 248.533 221.140 15.772 3092 HZ1 LYS 40 HZ1 LYS 40 246.398 223.179 15.485 3093 HZ2 LYS 40 HZ2 LYS 40 246.290 221.609 14.845 3094 HZ3 LYS 40 HZ3 LYS 40 247.501 222.670 14.302 3095 H LYS 41 HN LYS 41 247.252 221.118 22.294 3096 HA LYS 41 HA LYS 41 249.252 223.073 22.120 3097 HB2 LYS 41 HB2 LYS 41 247.036 223.490 23.094 3098 HB3 LYS 41 HB1 LYS 41 247.429 222.433 24.445 3099 HG2 LYS 41 HG2 LYS 41 247.749 224.785 25.075 3100 HG3 LYS 41 HG1 LYS 41 249.296 223.947 25.074 3101 HD2 LYS 41 HD2 LYS 41 250.003 224.982 23.078 3102 HD3 LYS 41 HD1 LYS 41 248.356 225.403 22.600 3103 HE2 LYS 41 HE2 LYS 41 249.548 227.392 23.355 3104 HE3 LYS 41 HE1 LYS 41 248.264 227.001 24.501 3105 HZ1 LYS 41 HZ1 LYS 41 250.341 227.501 25.629 3106 HZ2 LYS 41 HZ2 LYS 41 251.123 226.251 24.785 3107 HZ3 LYS 41 HZ3 LYS 41 249.886 225.888 25.892 3108 H ALA 42 HN ALA 42 248.806 220.502 24.593 3109 HA ALA 42 HA ALA 42 251.109 221.122 26.077 3110 HB1 ALA 42 HB1 ALA 42 249.677 218.510 25.646 3111 HB2 ALA 42 HB2 ALA 42 249.578 219.592 27.032 3112 HB3 ALA 42 HB3 ALA 42 251.049 218.666 26.741 3113 H MET 43 HN MET 43 250.825 218.923 23.240 3114 HA MET 43 HA MET 43 253.627 218.274 23.322 3115 HB2 MET 43 HB2 MET 43 251.278 217.578 21.636 3116 HB3 MET 43 HB1 MET 43 252.829 217.536 20.803 3117 HG2 MET 43 HG2 MET 43 253.714 216.052 22.611 3118 HG3 MET 43 HG1 MET 43 252.110 216.024 23.334 3119 HE1 MET 43 HE1 MET 43 249.928 213.974 21.143 3120 HE2 MET 43 HE2 MET 43 249.979 215.731 21.044 3121 HE3 MET 43 HE3 MET 43 250.180 214.936 22.603 3122 H SER 44 HN SER 44 252.491 221.196 22.898 3123 HA SER 44 HA SER 44 254.448 221.868 20.792 3124 HB2 SER 44 HB2 SER 44 252.367 221.907 19.616 3125 HB3 SER 44 HB1 SER 44 251.566 222.762 20.930 3126 HG SER 44 HG SER 44 252.257 224.543 20.081 3127 H ASP 45 HN ASP 45 254.900 222.053 23.529 3128 HA ASP 45 HA ASP 45 254.234 224.554 24.674 3129 HB2 ASP 45 HB2 ASP 45 255.192 222.567 25.910 3130 HB3 ASP 45 HB1 ASP 45 256.763 222.981 25.222 3131 H ASP 46 HN ASP 46 257.057 223.522 22.709 3132 HA ASP 46 HA ASP 46 258.601 224.759 21.550 3133 HB2 ASP 46 HB2 ASP 46 256.451 225.858 20.725 3134 HB3 ASP 46 HB1 ASP 46 256.772 227.144 21.883 3135 H GLU 47 HN GLU 47 257.464 226.026 24.621 3136 HA GLU 47 HA GLU 47 260.065 226.570 25.531 3137 HB2 GLU 47 HB2 GLU 47 260.248 228.915 25.455 3138 HB3 GLU 47 HB1 GLU 47 259.603 228.525 23.873 3139 HG2 GLU 47 HG2 GLU 47 257.269 228.946 24.887 3140 HG3 GLU 47 HG1 GLU 47 258.117 229.654 26.256 3141 HA PRO 48 HA PRO 48 257.941 226.357 29.441 3142 HB2 PRO 48 HB2 PRO 48 259.387 228.846 30.298 3143 HB3 PRO 48 HB1 PRO 48 259.276 227.272 31.111 3144 HG2 PRO 48 HG2 PRO 48 261.493 227.989 29.844 3145 HG3 PRO 48 HG1 PRO 48 260.900 226.316 29.764 3146 HD2 PRO 48 HD2 PRO 48 260.764 228.464 27.675 3147 HD3 PRO 48 HD1 PRO 48 261.007 226.713 27.491 3148 H LYS 49 HN LYS 49 258.199 229.645 28.084 3149 HA LYS 49 HA LYS 49 256.729 231.420 28.060 3150 HB2 LYS 49 HB2 LYS 49 255.575 229.770 26.581 3151 HB3 LYS 49 HB1 LYS 49 254.661 229.208 27.981 3152 HG2 LYS 49 HG2 LYS 49 253.707 231.442 28.291 3153 HG3 LYS 49 HG1 LYS 49 254.671 232.063 26.951 3154 HD2 LYS 49 HD2 LYS 49 253.538 230.463 25.424 3155 HD3 LYS 49 HD1 LYS 49 252.535 229.918 26.769 3156 HE2 LYS 49 HE2 LYS 49 252.661 232.781 25.778 3157 HE3 LYS 49 HE1 LYS 49 251.400 231.629 25.342 3158 HZ1 LYS 49 HZ1 LYS 49 251.594 231.527 28.089 3159 HZ2 LYS 49 HZ2 LYS 49 250.351 232.240 27.177 3160 HZ3 LYS 49 HZ3 LYS 49 251.667 233.177 27.703 3161 HCN FME 1 HCN FME 1 241.895 184.342 3.237 3162 HA FME 1 HA FME 1 241.711 181.546 4.909 3163 HB2 FME 1 HB2 FME 1 243.080 182.881 7.259 3164 HB3 FME 1 HB1 FME 1 242.325 181.287 7.227 3165 HG2 FME 1 HG2 FME 1 244.734 182.104 5.576 3166 HG3 FME 1 HG1 FME 1 244.797 181.141 7.052 3167 HE1 FME 1 HE1 FME 1 246.041 179.973 4.221 3168 HE2 FME 1 HE2 FME 1 245.615 178.338 4.720 3169 HE3 FME 1 HE3 FME 1 246.127 179.515 5.927 3170 H GLY 2 HN GLY 2 240.309 181.832 7.170 3171 HA2 GLY 2 HA2 GLY 2 239.207 184.300 7.835 3172 HA3 GLY 2 HA1 GLY 2 238.266 183.682 6.480 3173 H GLY 3 HN GLY 3 236.477 182.665 7.111 3174 HA2 GLY 3 HA2 GLY 3 235.278 180.897 8.119 3175 HA3 GLY 3 HA1 GLY 3 236.580 180.698 9.286 3176 H ILE 4 HN ILE 4 236.233 183.878 9.252 3177 HA ILE 4 HA ILE 4 234.002 183.987 11.200 3178 HB ILE 4 HB ILE 4 235.288 185.331 12.697 3179 HG12 ILE 4 HG12 ILE 4 236.540 186.727 11.133 3180 HG13 ILE 4 HG11 ILE 4 237.677 185.923 12.201 3181 HG21 ILE 4 HG21 ILE 4 235.706 182.897 12.831 3182 HG22 ILE 4 HG22 ILE 4 237.137 183.820 13.291 3183 HG23 ILE 4 HG23 ILE 4 237.045 183.073 11.697 3184 HD11 ILE 4 HD11 ILE 4 238.655 185.631 10.090 3185 HD12 ILE 4 HD12 ILE 4 237.105 185.359 9.299 3186 HD13 ILE 4 HD13 ILE 4 237.811 184.110 10.329 3187 H SER 5 HN SER 5 233.287 186.277 11.599 3188 HA SER 5 HA SER 5 233.766 188.065 9.301 3189 HB2 SER 5 HB2 SER 5 231.584 186.495 9.269 3190 HB3 SER 5 HB1 SER 5 230.940 187.836 10.209 3191 HG SER 5 HG SER 5 232.363 188.897 8.294 3192 H ILE 6 HN ILE 6 235.007 189.242 10.844 3193 HA ILE 6 HA ILE 6 233.839 190.303 13.243 3194 HB ILE 6 HB ILE 6 236.225 191.380 11.722 3195 HG12 ILE 6 HG12 ILE 6 236.569 189.007 12.104 3196 HG13 ILE 6 HG11 ILE 6 237.555 189.913 13.245 3197 HG21 ILE 6 HG21 ILE 6 235.397 192.852 13.499 3198 HG22 ILE 6 HG22 ILE 6 236.918 192.117 13.994 3199 HG23 ILE 6 HG23 ILE 6 235.400 191.503 14.636 3200 HD11 ILE 6 HD11 ILE 6 235.519 189.623 14.868 3201 HD12 ILE 6 HD12 ILE 6 236.590 188.256 14.596 3202 HD13 ILE 6 HD13 ILE 6 235.042 188.332 13.763 3203 H TRP 7 HN TRP 7 234.417 191.564 9.983 3204 HA TRP 7 HA TRP 7 233.619 194.203 10.416 3205 HB2 TRP 7 HB2 TRP 7 233.408 192.410 7.993 3206 HB3 TRP 7 HB1 TRP 7 232.918 194.107 7.952 3207 HD1 TRP 7 HD1 TRP 7 235.986 192.202 9.359 3208 HE1 TRP 7 HE1 TRP 7 238.101 193.530 8.722 3209 HE3 TRP 7 HE3 TRP 7 233.845 196.053 6.790 3210 HZ2 TRP 7 HZ2 TRP 7 238.787 195.925 7.332 3211 HZ3 TRP 7 HZ3 TRP 7 235.264 197.826 5.819 3212 HH2 TRP 7 HH2 TRP 7 237.722 197.775 6.076 3213 H GLN 8 HN GLN 8 231.674 191.304 10.133 3214 HA GLN 8 HA GLN 8 229.189 192.500 9.556 3215 HB2 GLN 8 HB2 GLN 8 230.002 189.941 10.911 3216 HB3 GLN 8 HB1 GLN 8 228.309 190.415 10.888 3217 HG2 GLN 8 HG2 GLN 8 229.305 188.910 8.937 3218 HG3 GLN 8 HG1 GLN 8 228.122 190.160 8.582 3219 HE21 GLN 8 HE21 GLN 8 231.708 190.227 9.107 3220 HE22 GLN 8 HE22 GLN 8 232.037 191.085 7.680 3221 H LEU 9 HN LEU 9 230.962 192.119 12.566 3222 HA LEU 9 HA LEU 9 228.838 192.911 14.309 3223 HB2 LEU 9 HB2 LEU 9 231.842 193.001 14.696 3224 HB3 LEU 9 HB1 LEU 9 230.662 193.293 15.970 3225 HG LEU 9 HG LEU 9 230.942 190.740 14.378 3226 HD11 LEU 9 HD11 LEU 9 232.792 191.055 15.938 3227 HD12 LEU 9 HD12 LEU 9 231.720 189.791 16.535 3228 HD13 LEU 9 HD13 LEU 9 231.660 191.406 17.241 3229 HD21 LEU 9 HD21 LEU 9 228.965 191.683 16.438 3230 HD22 LEU 9 HD22 LEU 9 229.414 189.978 16.414 3231 HD23 LEU 9 HD23 LEU 9 228.690 190.713 14.989 3232 H LEU 10 HN LEU 10 231.439 194.703 12.633 3233 HA LEU 10 HA LEU 10 231.088 197.172 13.951 3234 HB2 LEU 10 HB2 LEU 10 232.152 196.380 11.238 3235 HB3 LEU 10 HB1 LEU 10 232.023 198.080 11.687 3236 HG LEU 10 HG LEU 10 233.433 197.696 13.656 3237 HD11 LEU 10 HD11 LEU 10 233.310 194.827 12.703 3238 HD12 LEU 10 HD12 LEU 10 232.902 195.458 14.299 3239 HD13 LEU 10 HD13 LEU 10 234.586 195.399 13.777 3240 HD21 LEU 10 HD21 LEU 10 234.491 196.674 11.003 3241 HD22 LEU 10 HD22 LEU 10 235.539 196.904 12.402 3242 HD23 LEU 10 HD23 LEU 10 234.690 198.282 11.704 3243 H ILE 11 HN ILE 11 229.601 195.945 10.948 3244 HA ILE 11 HA ILE 11 228.064 198.277 10.483 3245 HB ILE 11 HB ILE 11 228.628 196.249 8.894 3246 HG12 ILE 11 HG12 ILE 11 225.817 197.363 8.727 3247 HG13 ILE 11 HG11 ILE 11 227.241 198.334 8.346 3248 HG21 ILE 11 HG21 ILE 11 227.413 194.645 10.376 3249 HG22 ILE 11 HG22 ILE 11 226.934 194.566 8.699 3250 HG23 ILE 11 HG23 ILE 11 225.905 195.376 9.880 3251 HD11 ILE 11 HD11 ILE 11 226.416 195.743 7.009 3252 HD12 ILE 11 HD12 ILE 11 227.940 196.581 6.697 3253 HD13 ILE 11 HD13 ILE 11 226.404 197.349 6.287 3254 H ILE 12 HN ILE 12 227.316 195.211 12.187 3255 HA ILE 12 HA ILE 12 224.624 195.879 12.747 3256 HB ILE 12 HB ILE 12 226.477 194.099 14.333 3257 HG12 ILE 12 HG12 ILE 12 225.815 193.724 11.683 3258 HG13 ILE 12 HG11 ILE 12 226.184 192.421 12.791 3259 HG21 ILE 12 HG21 ILE 12 224.553 194.599 15.644 3260 HG22 ILE 12 HG22 ILE 12 224.302 192.992 14.960 3261 HG23 ILE 12 HG23 ILE 12 223.471 194.390 14.269 3262 HD11 ILE 12 HD11 ILE 12 223.860 191.978 13.178 3263 HD12 ILE 12 HD12 ILE 12 224.053 192.142 11.431 3264 HD13 ILE 12 HD13 ILE 12 223.365 193.462 12.369 3265 H ALA 13 HN ALA 13 227.610 196.406 14.598 3266 HA ALA 13 HA ALA 13 226.398 197.475 16.900 3267 HB1 ALA 13 HB1 ALA 13 228.709 196.868 16.985 3268 HB2 ALA 13 HB2 ALA 13 228.642 198.618 17.197 3269 HB3 ALA 13 HB3 ALA 13 229.103 197.934 15.637 3270 H VAL 14 HN VAL 14 227.438 198.982 13.865 3271 HA VAL 14 HA VAL 14 227.020 201.665 14.612 3272 HB VAL 14 HB VAL 14 227.009 200.175 11.990 3273 HG11 VAL 14 HG11 VAL 14 225.559 201.929 11.426 3274 HG12 VAL 14 HG12 VAL 14 227.146 202.561 10.987 3275 HG13 VAL 14 HG13 VAL 14 226.377 203.078 12.488 3276 HG21 VAL 14 HG21 VAL 14 228.862 202.331 13.032 3277 HG22 VAL 14 HG22 VAL 14 229.148 201.215 11.697 3278 HG23 VAL 14 HG23 VAL 14 229.113 200.616 13.355 3279 H ILE 15 HN ILE 15 224.813 199.276 13.146 3280 HA ILE 15 HA ILE 15 222.626 201.021 12.897 3281 HB ILE 15 HB ILE 15 222.760 198.018 13.134 3282 HG12 ILE 15 HG12 ILE 15 223.617 199.369 11.082 3283 HG13 ILE 15 HG11 ILE 15 222.541 198.015 10.800 3284 HG21 ILE 15 HG21 ILE 15 220.354 198.134 12.290 3285 HG22 ILE 15 HG22 ILE 15 220.362 199.826 12.785 3286 HG23 ILE 15 HG23 ILE 15 220.596 198.555 13.986 3287 HD11 ILE 15 HD11 ILE 15 220.830 199.340 10.063 3288 HD12 ILE 15 HD12 ILE 15 222.154 200.442 9.690 3289 HD13 ILE 15 HD13 ILE 15 221.216 200.660 11.160 3290 H VAL 16 HN VAL 16 223.580 198.878 15.566 3291 HA VAL 16 HA VAL 16 221.353 199.335 17.210 3292 HB VAL 16 HB VAL 16 224.251 198.720 17.831 3293 HG11 VAL 16 HG11 VAL 16 221.890 199.028 19.682 3294 HG12 VAL 16 HG12 VAL 16 223.505 199.713 19.838 3295 HG13 VAL 16 HG13 VAL 16 223.255 197.987 20.094 3296 HG21 VAL 16 HG21 VAL 16 223.160 196.920 16.690 3297 HG22 VAL 16 HG22 VAL 16 221.712 197.083 17.680 3298 HG23 VAL 16 HG23 VAL 16 223.203 196.481 18.397 3299 H VAL 17 HN VAL 17 224.437 201.105 16.993 3300 HA VAL 17 HA VAL 17 223.872 202.934 19.065 3301 HB VAL 17 HB VAL 17 225.693 203.177 16.663 3302 HG11 VAL 17 HG11 VAL 17 225.299 205.406 17.416 3303 HG12 VAL 17 HG12 VAL 17 226.815 204.915 18.172 3304 HG13 VAL 17 HG13 VAL 17 225.321 204.914 19.109 3305 HG21 VAL 17 HG21 VAL 17 227.424 202.472 18.174 3306 HG22 VAL 17 HG22 VAL 17 226.091 201.334 18.370 3307 HG23 VAL 17 HG23 VAL 17 226.346 202.606 19.564 3308 H LEU 18 HN LEU 18 223.286 203.119 15.538 3309 HA LEU 18 HA LEU 18 222.336 205.798 15.570 3310 HB2 LEU 18 HB2 LEU 18 222.018 203.458 13.717 3311 HB3 LEU 18 HB1 LEU 18 221.063 204.910 13.432 3312 HG LEU 18 HG LEU 18 224.039 205.155 13.865 3313 HD11 LEU 18 HD11 LEU 18 222.610 204.144 11.405 3314 HD12 LEU 18 HD12 LEU 18 224.098 203.561 12.148 3315 HD13 LEU 18 HD13 LEU 18 224.107 205.073 11.252 3316 HD21 LEU 18 HD21 LEU 18 221.965 206.698 12.268 3317 HD22 LEU 18 HD22 LEU 18 223.674 207.105 12.336 3318 HD23 LEU 18 HD23 LEU 18 222.672 207.201 13.784 3319 H LEU 19 HN LEU 19 220.588 202.668 15.756 3320 HA LEU 19 HA LEU 19 218.015 203.844 15.877 3321 HB2 LEU 19 HB2 LEU 19 218.820 201.151 16.997 3322 HB3 LEU 19 HB1 LEU 19 217.188 201.680 16.596 3323 HG LEU 19 HG LEU 19 219.470 201.269 14.659 3324 HD11 LEU 19 HD11 LEU 19 217.814 199.614 13.687 3325 HD12 LEU 19 HD12 LEU 19 216.900 199.809 15.182 3326 HD13 LEU 19 HD13 LEU 19 218.544 199.172 15.232 3327 HD21 LEU 19 HD21 LEU 19 216.785 202.544 14.298 3328 HD22 LEU 19 HD22 LEU 19 217.567 201.701 12.954 3329 HD23 LEU 19 HD23 LEU 19 218.363 203.081 13.703 3330 H PHE 20 HN PHE 20 220.293 202.890 18.443 3331 HA PHE 20 HA PHE 20 218.450 203.883 20.516 3332 HB2 PHE 20 HB2 PHE 20 221.126 202.499 20.531 3333 HB3 PHE 20 HB1 PHE 20 220.569 203.339 21.975 3334 HD1 PHE 20 HD1 PHE 20 219.838 200.610 19.605 3335 HD2 PHE 20 HD2 PHE 20 218.763 202.494 23.306 3336 HE1 PHE 20 HE1 PHE 20 218.408 198.678 20.189 3337 HE2 PHE 20 HE2 PHE 20 217.333 200.552 23.887 3338 HZ PHE 20 HZ PHE 20 217.157 198.638 22.321 3339 H GLY 21 HN GLY 21 220.832 205.145 18.462 3340 HA2 GLY 21 HA2 GLY 21 221.696 207.300 18.338 3341 HA3 GLY 21 HA1 GLY 21 220.767 207.708 19.782 3342 H THR 22 HN THR 22 223.203 208.779 19.827 3343 HA THR 22 HA THR 22 224.989 206.910 21.267 3344 HB THR 22 HB THR 22 226.284 207.947 19.628 3345 HG1 THR 22 HG1 THR 22 227.636 208.658 21.042 3346 HG21 THR 22 HG21 THR 22 224.578 209.480 18.795 3347 HG22 THR 22 HG22 THR 22 226.075 210.369 19.078 3348 HG23 THR 22 HG23 THR 22 224.745 210.487 20.232 3349 H LYS 23 HN LYS 23 223.345 210.026 21.594 3350 HA LYS 23 HA LYS 23 224.420 210.673 24.146 3351 HB2 LYS 23 HB2 LYS 23 221.985 211.544 22.612 3352 HB3 LYS 23 HB1 LYS 23 222.169 212.035 24.294 3353 HG2 LYS 23 HG2 LYS 23 224.338 213.065 23.783 3354 HG3 LYS 23 HG1 LYS 23 224.226 212.535 22.108 3355 HD2 LYS 23 HD2 LYS 23 222.155 213.866 21.838 3356 HD3 LYS 23 HD1 LYS 23 222.321 214.429 23.503 3357 HE2 LYS 23 HE2 LYS 23 224.507 215.421 22.960 3358 HE3 LYS 23 HE1 LYS 23 224.359 214.851 21.298 3359 HZ1 LYS 23 HZ1 LYS 23 222.707 216.345 20.833 3360 HZ2 LYS 23 HZ2 LYS 23 223.641 217.250 21.926 3361 HZ3 LYS 23 HZ3 LYS 23 222.215 216.491 22.450 3362 H LYS 24 HN LYS 24 221.390 208.990 23.229 3363 HA LYS 24 HA LYS 24 220.477 208.605 25.871 3364 HB2 LYS 24 HB2 LYS 24 219.184 208.326 23.657 3365 HB3 LYS 24 HB1 LYS 24 219.901 206.719 23.589 3366 HG2 LYS 24 HG2 LYS 24 217.930 206.236 24.737 3367 HG3 LYS 24 HG1 LYS 24 219.007 206.554 26.094 3368 HD2 LYS 24 HD2 LYS 24 218.189 208.859 26.242 3369 HD3 LYS 24 HD1 LYS 24 217.176 208.613 24.819 3370 HE2 LYS 24 HE2 LYS 24 215.752 208.340 26.732 3371 HE3 LYS 24 HE1 LYS 24 216.044 206.728 26.078 3372 HZ1 LYS 24 HZ1 LYS 24 217.712 206.345 27.730 3373 HZ2 LYS 24 HZ2 LYS 24 216.295 206.862 28.513 3374 HZ3 LYS 24 HZ3 LYS 24 217.593 207.937 28.304 3375 H LEU 25 HN LEU 25 222.471 206.616 23.712 3376 HA LEU 25 HA LEU 25 222.632 204.362 25.376 3377 HB2 LEU 25 HB2 LEU 25 223.321 204.267 23.048 3378 HB3 LEU 25 HB1 LEU 25 224.625 205.410 23.343 3379 HG LEU 25 HG LEU 25 224.634 203.013 25.127 3380 HD11 LEU 25 HD11 LEU 25 225.796 201.679 23.264 3381 HD12 LEU 25 HD12 LEU 25 225.034 202.805 22.137 3382 HD13 LEU 25 HD13 LEU 25 224.041 201.790 23.185 3383 HD21 LEU 25 HD21 LEU 25 226.843 204.152 23.392 3384 HD22 LEU 25 HD22 LEU 25 227.009 203.175 24.850 3385 HD23 LEU 25 HD23 LEU 25 226.433 204.835 24.962 3386 H GLY 26 HN GLY 26 224.129 207.492 25.649 3387 HA2 GLY 26 HA2 GLY 26 226.381 206.709 27.208 3388 HA3 GLY 26 HA1 GLY 26 225.682 208.324 27.139 3389 H SER 27 HN SER 27 223.202 208.052 28.108 3390 HA SER 27 HA SER 27 223.589 207.864 30.901 3391 HB2 SER 27 HB2 SER 27 221.083 207.967 29.211 3392 HB3 SER 27 HB1 SER 27 221.043 207.932 30.969 3393 HG SER 27 HG SER 27 221.198 210.037 29.609 3394 H ILE 28 HN ILE 28 222.175 205.567 28.547 3395 HA ILE 28 HA ILE 28 221.287 203.686 30.446 3396 HB ILE 28 HB ILE 28 222.126 203.374 27.551 3397 HG12 ILE 28 HG12 ILE 28 219.380 203.338 28.835 3398 HG13 ILE 28 HG11 ILE 28 220.107 204.790 28.147 3399 HG21 ILE 28 HG21 ILE 28 222.362 201.195 28.473 3400 HG22 ILE 28 HG22 ILE 28 220.742 201.213 27.779 3401 HG23 ILE 28 HG23 ILE 28 220.958 201.401 29.520 3402 HD11 ILE 28 HD11 ILE 28 219.855 202.246 26.538 3403 HD12 ILE 28 HD12 ILE 28 220.103 203.893 25.956 3404 HD13 ILE 28 HD13 ILE 28 218.540 203.418 26.622 3405 H GLY 29 HN GLY 29 224.378 203.891 28.624 3406 HA2 GLY 29 HA2 GLY 29 225.499 201.541 29.724 3407 HA3 GLY 29 HA1 GLY 29 226.407 202.867 29.008 3408 H SER 30 HN SER 30 225.969 204.976 30.674 3409 HA SER 30 HA SER 30 227.664 204.446 32.856 3410 HB2 SER 30 HB2 SER 30 227.010 206.689 33.656 3411 HB3 SER 30 HB1 SER 30 227.419 206.693 31.941 3412 HG SER 30 HG SER 30 225.346 206.967 31.435 3413 H ASP 31 HN ASP 31 224.123 204.575 32.615 3414 HA ASP 31 HA ASP 31 223.597 204.419 35.386 3415 HB2 ASP 31 HB2 ASP 31 222.003 203.628 32.949 3416 HB3 ASP 31 HB1 ASP 31 221.372 203.447 34.585 3417 H LEU 32 HN LEU 32 223.966 201.939 32.874 3418 HA LEU 32 HA LEU 32 223.622 199.776 34.804 3419 HB2 LEU 32 HB2 LEU 32 224.406 199.745 31.879 3420 HB3 LEU 32 HB1 LEU 32 224.111 198.311 32.853 3421 HG LEU 32 HG LEU 32 222.060 200.517 32.514 3422 HD11 LEU 32 HD11 LEU 32 222.632 199.535 30.318 3423 HD12 LEU 32 HD12 LEU 32 220.999 199.090 30.819 3424 HD13 LEU 32 HD13 LEU 32 222.313 197.923 30.962 3425 HD21 LEU 32 HD21 LEU 32 220.567 198.419 33.062 3426 HD22 LEU 32 HD22 LEU 32 221.411 199.234 34.374 3427 HD23 LEU 32 HD23 LEU 32 222.061 197.739 33.705 3428 H GLY 33 HN GLY 33 226.232 201.739 33.807 3429 HA2 GLY 33 HA2 GLY 33 228.270 199.709 34.161 3430 HA3 GLY 33 HA1 GLY 33 228.531 201.416 33.835 3431 H ALA 34 HN ALA 34 226.317 201.113 36.347 3432 HA ALA 34 HA ALA 34 228.085 202.232 38.245 3433 HB1 ALA 34 HB1 ALA 34 225.848 202.790 38.609 3434 HB2 ALA 34 HB2 ALA 34 226.148 201.593 39.869 3435 HB3 ALA 34 HB3 ALA 34 225.289 201.132 38.400 3436 H SER 35 HN SER 35 226.995 198.906 37.681 3437 HA SER 35 HA SER 35 228.090 197.811 40.056 3438 HB2 SER 35 HB2 SER 35 227.698 196.410 37.403 3439 HB3 SER 35 HB1 SER 35 227.810 195.660 38.993 3440 HG SER 35 HG SER 35 225.762 196.020 39.201 3441 H ILE 36 HN ILE 36 229.423 198.417 36.863 3442 HA ILE 36 HA ILE 36 231.837 196.969 37.152 3443 HB ILE 36 HB ILE 36 231.166 199.401 35.470 3444 HG12 ILE 36 HG12 ILE 36 231.643 196.527 34.663 3445 HG13 ILE 36 HG11 ILE 36 230.038 197.149 35.016 3446 HG21 ILE 36 HG21 ILE 36 233.544 199.473 35.727 3447 HG22 ILE 36 HG22 ILE 36 233.266 198.652 34.193 3448 HG23 ILE 36 HG23 ILE 36 233.678 197.718 35.631 3449 HD11 ILE 36 HD11 ILE 36 230.279 198.842 33.256 3450 HD12 ILE 36 HD12 ILE 36 230.533 197.230 32.589 3451 HD13 ILE 36 HD13 ILE 36 231.916 198.274 32.919 3452 H LYS 37 HN LYS 37 230.942 200.287 37.996 3453 HA LYS 37 HA LYS 37 233.464 201.245 38.714 3454 HB2 LYS 37 HB2 LYS 37 230.732 201.849 39.869 3455 HB3 LYS 37 HB1 LYS 37 232.190 202.754 40.276 3456 HG2 LYS 37 HG2 LYS 37 232.507 203.363 37.925 3457 HG3 LYS 37 HG1 LYS 37 231.117 202.385 37.464 3458 HD2 LYS 37 HD2 LYS 37 230.257 204.589 37.576 3459 HD3 LYS 37 HD1 LYS 37 229.758 203.844 39.092 3460 HE2 LYS 37 HE2 LYS 37 231.493 204.964 40.319 3461 HE3 LYS 37 HE1 LYS 37 232.295 205.488 38.839 3462 HZ1 LYS 37 HZ1 LYS 37 230.892 207.192 40.013 3463 HZ2 LYS 37 HZ2 LYS 37 229.531 206.297 39.531 3464 HZ3 LYS 37 HZ3 LYS 37 230.562 206.977 38.364 3465 H GLY 38 HN GLY 38 231.168 199.240 40.544 3466 HA2 GLY 38 HA2 GLY 38 232.590 199.352 43.012 3467 HA3 GLY 38 HA1 GLY 38 231.390 198.149 42.573 3468 H PHE 39 HN PHE 39 232.652 197.034 40.288 3469 HA PHE 39 HA PHE 39 234.368 195.154 41.505 3470 HB2 PHE 39 HB2 PHE 39 233.194 194.596 39.457 3471 HB3 PHE 39 HB1 PHE 39 233.979 195.915 38.593 3472 HD1 PHE 39 HD2 PHE 39 236.467 195.843 38.222 3473 HD2 PHE 39 HD1 PHE 39 234.258 192.464 39.696 3474 HE1 PHE 39 HE2 PHE 39 238.364 194.347 37.651 3475 HE2 PHE 39 HE1 PHE 39 236.158 190.973 39.129 3476 HZ PHE 39 HZ PHE 39 238.210 191.915 38.106 3477 H LYS 40 HN LYS 40 235.049 197.967 39.446 3478 HA LYS 40 HA LYS 40 237.845 197.724 39.358 3479 HB2 LYS 40 HB2 LYS 40 236.487 199.285 37.961 3480 HB3 LYS 40 HB1 LYS 40 236.210 200.280 39.390 3481 HG2 LYS 40 HG2 LYS 40 238.650 200.619 39.620 3482 HG3 LYS 40 HG1 LYS 40 238.913 199.637 38.177 3483 HD2 LYS 40 HD2 LYS 40 237.575 201.218 36.843 3484 HD3 LYS 40 HD1 LYS 40 237.303 202.204 38.279 3485 HE2 LYS 40 HE2 LYS 40 239.742 202.568 38.489 3486 HE3 LYS 40 HE1 LYS 40 240.008 201.603 37.037 3487 HZ1 LYS 40 HZ1 LYS 40 239.671 204.255 37.036 3488 HZ2 LYS 40 HZ2 LYS 40 238.075 203.741 36.761 3489 HZ3 LYS 40 HZ3 LYS 40 239.318 203.256 35.710 3490 H LYS 41 HN LYS 41 235.746 199.483 41.661 3491 HA LYS 41 HA LYS 41 237.804 200.572 43.232 3492 HB2 LYS 41 HB2 LYS 41 235.414 201.265 43.273 3493 HB3 LYS 41 HB1 LYS 41 235.036 199.775 44.138 3494 HG2 LYS 41 HG2 LYS 41 236.489 200.423 45.985 3495 HG3 LYS 41 HG1 LYS 41 237.022 201.858 45.106 3496 HD2 LYS 41 HD2 LYS 41 234.669 202.670 45.075 3497 HD3 LYS 41 HD1 LYS 41 234.200 201.278 46.047 3498 HE2 LYS 41 HE2 LYS 41 236.268 203.338 46.890 3499 HE3 LYS 41 HE1 LYS 41 234.591 203.328 47.435 3500 HZ1 LYS 41 HZ1 LYS 41 235.394 200.795 47.907 3501 HZ2 LYS 41 HZ2 LYS 41 235.348 202.035 49.067 3502 HZ3 LYS 41 HZ3 LYS 41 236.798 201.679 48.257 3503 H ALA 42 HN ALA 42 235.872 197.585 43.775 3504 HA ALA 42 HA ALA 42 237.196 196.807 46.122 3505 HB1 ALA 42 HB1 ALA 42 235.793 195.229 43.989 3506 HB2 ALA 42 HB2 ALA 42 235.238 195.618 45.611 3507 HB3 ALA 42 HB3 ALA 42 236.525 194.434 45.378 3508 H MET 43 HN MET 43 238.084 196.029 42.717 3509 HA MET 43 HA MET 43 240.358 194.480 43.531 3510 HB2 MET 43 HB2 MET 43 238.981 194.336 41.311 3511 HB3 MET 43 HB1 MET 43 240.007 195.664 40.775 3512 HG2 MET 43 HG2 MET 43 242.001 194.205 41.467 3513 HG3 MET 43 HG1 MET 43 240.850 192.887 41.624 3514 HE1 MET 43 HE1 MET 43 242.452 194.922 37.884 3515 HE2 MET 43 HE2 MET 43 243.265 194.628 39.418 3516 HE3 MET 43 HE3 MET 43 241.952 195.800 39.337 3517 H SER 44 HN SER 44 239.988 197.475 44.268 3518 HA SER 44 HA SER 44 242.771 198.231 43.662 3519 HB2 SER 44 HB2 SER 44 240.436 200.161 43.510 3520 HB3 SER 44 HB1 SER 44 242.131 200.521 43.194 3521 HG SER 44 HG SER 44 241.577 200.024 41.222 3522 H ASP 45 HN ASP 45 240.365 197.640 45.879 3523 HA ASP 45 HA ASP 45 240.778 199.669 47.819 3524 HB2 ASP 45 HB2 ASP 45 238.836 198.142 47.843 3525 HB3 ASP 45 HB1 ASP 45 239.906 196.797 48.244 3526 H ASP 46 HN ASP 46 242.232 196.403 47.459 3527 HA ASP 46 HA ASP 46 243.741 196.160 49.695 3528 HB2 ASP 46 HB2 ASP 46 245.544 195.145 48.216 3529 HB3 ASP 46 HB1 ASP 46 243.925 194.470 48.035 3530 H GLU 47 HN GLU 47 244.814 198.067 46.834 3531 HA GLU 47 HA GLU 47 245.902 200.127 48.369 3532 HB2 GLU 47 HB2 GLU 47 247.582 197.808 48.340 3533 HB3 GLU 47 HB1 GLU 47 248.373 199.014 47.331 3534 HG2 GLU 47 HG2 GLU 47 247.369 199.503 50.149 3535 HG3 GLU 47 HG1 GLU 47 249.048 199.181 49.717 3536 HA PRO 48 HA PRO 48 245.572 201.268 43.994 3537 HB2 PRO 48 HB2 PRO 48 245.618 203.980 44.269 3538 HB3 PRO 48 HB1 PRO 48 244.187 203.004 44.660 3539 HG2 PRO 48 HG2 PRO 48 246.234 204.173 46.488 3540 HG3 PRO 48 HG1 PRO 48 244.478 204.053 46.693 3541 HD2 PRO 48 HD2 PRO 48 246.282 202.329 47.881 3542 HD3 PRO 48 HD1 PRO 48 244.596 201.892 47.524 3543 H LYS 49 HN LYS 49 248.152 201.922 46.156 3544 HA LYS 49 HA LYS 49 250.007 202.313 43.892 3545 HB2 LYS 49 HB2 LYS 49 249.874 204.021 46.388 3546 HB3 LYS 49 HB1 LYS 49 251.221 204.029 45.249 3547 HG2 LYS 49 HG2 LYS 49 249.697 204.693 43.433 3548 HG3 LYS 49 HG1 LYS 49 248.338 204.669 44.557 3549 HD2 LYS 49 HD2 LYS 49 249.398 206.431 45.904 3550 HD3 LYS 49 HD1 LYS 49 250.784 206.447 44.812 3551 HE2 LYS 49 HE2 LYS 49 249.258 207.067 42.940 3552 HE3 LYS 49 HE1 LYS 49 247.919 207.132 44.087 3553 HZ1 LYS 49 HZ1 LYS 49 249.526 209.206 43.465 3554 HZ2 LYS 49 HZ2 LYS 49 250.232 208.640 44.904 3555 HZ3 LYS 49 HZ3 LYS 49 248.594 209.092 44.876
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