data_16258_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16258
_Entry.PDB_ID 2KHZ
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 15
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 6 . 1 1 1 A 4 4 ALA H H 2 8.270 8.412 -0.142 1
1 7 . 1 1 1 A 4 4 ALA HA H 2 4.212 4.210 0.002 1
1 11 . 1 1 1 A 4 4 ALA C C 2 177.441 177.397 0.044 1
1 12 . 1 1 1 A 4 4 ALA CA C 2 52.280 52.603 -0.323 1
1 13 . 1 1 1 A 4 4 ALA CB C 2 18.880 19.377 -0.497 1
1 14 . 1 1 1 A 4 4 ALA N N 2 126.500 126.404 0.096 1
1 15 . 1 1 1 A 5 5 ALA H H 3 8.251 8.324 -0.073 1
1 16 . 1 1 1 A 5 5 ALA HA H 3 4.261 4.274 -0.013 1
1 20 . 1 1 1 A 5 5 ALA C C 3 177.824 177.687 0.137 1
1 21 . 1 1 1 A 5 5 ALA CA C 3 52.347 52.384 -0.037 1
1 22 . 1 1 1 A 5 5 ALA CB C 3 18.869 18.717 0.152 1
1 23 . 1 1 1 A 5 5 ALA N N 3 124.322 123.957 0.365 1
1 24 . 1 1 1 A 6 6 SER H H 4 8.158 8.827 -0.669 1
1 25 . 1 1 1 A 6 6 SER HA H 4 4.358 4.375 -0.017 1
1 27 . 1 1 1 A 6 6 SER C C 4 175.222 175.617 -0.395 1
1 28 . 1 1 1 A 6 6 SER CA C 4 58.438 59.076 -0.638 1
1 29 . 1 1 1 A 6 6 SER CB C 4 63.859 64.223 -0.364 1
1 30 . 1 1 1 A 6 6 SER N N 4 115.338 117.707 -2.369 1
1 31 . 1 1 1 A 7 7 GLY H H 5 8.265 8.579 -0.314 1
1 32 . 1 1 1 A 7 7 GLY HA2 H 5 3.900 3.696 0.204 1
1 33 . 1 1 1 A 7 7 GLY C C 5 174.083 173.639 0.444 1
1 34 . 1 1 1 A 7 7 GLY CA C 5 45.113 46.360 -1.247 1
1 35 . 1 1 1 A 7 7 GLY N N 5 111.360 111.156 0.204 1
1 36 . 1 1 1 A 8 8 GLU H H 6 8.100 8.327 -0.227 1
1 37 . 1 1 1 A 8 8 GLU HA H 6 4.209 4.780 -0.571 1
1 41 . 1 1 1 A 8 8 GLU C C 6 176.354 175.998 0.356 1
1 42 . 1 1 1 A 8 8 GLU CA C 6 56.261 54.405 1.856 1
1 43 . 1 1 1 A 8 8 GLU CB C 6 29.830 32.528 -2.698 1
1 45 . 1 1 1 A 8 8 GLU N N 6 121.056 118.325 2.731 1
1 46 . 1 1 1 A 9 9 GLN H H 7 8.287 8.384 -0.097 1
1 47 . 1 1 1 A 9 9 GLN HA H 7 4.247 4.507 -0.260 1
1 51 . 1 1 1 A 9 9 GLN C C 7 172.457 175.693 -3.236 1
1 52 . 1 1 1 A 9 9 GLN CA C 7 55.269 56.006 -0.737 1
1 53 . 1 1 1 A 9 9 GLN CB C 7 29.236 30.056 -0.820 1
1 55 . 1 1 1 A 9 9 GLN N N 7 122.164 120.910 1.254 1
1 56 . 1 1 1 A 10 10 ALA H H 8 8.368 8.441 -0.073 1
1 57 . 1 1 1 A 10 10 ALA HA H 8 4.509 4.582 -0.073 1
1 61 . 1 1 1 A 10 10 ALA CA C 8 50.341 50.230 0.111 1
1 62 . 1 1 1 A 10 10 ALA CB C 8 18.140 18.896 -0.756 1
1 63 . 1 1 1 A 10 10 ALA N N 8 128.028 123.440 4.588 1
1 64 . 1 1 1 A 11 11 PRO HA H 9 4.437 4.561 -0.124 1
1 70 . 1 1 1 A 11 11 PRO C C 9 176.381 176.252 0.129 1
1 71 . 1 1 1 A 11 11 PRO CA C 9 63.298 62.364 0.934 1
1 72 . 1 1 1 A 11 11 PRO CB C 9 31.776 33.159 -1.383 1
1 75 . 1 1 1 A 12 12 CYS H H 10 8.056 8.301 -0.245 1
1 76 . 1 1 1 A 12 12 CYS HA H 10 4.717 5.042 -0.325 1
1 79 . 1 1 1 A 12 12 CYS C C 10 173.266 173.670 -0.404 1
1 80 . 1 1 1 A 12 12 CYS CA C 10 57.398 56.900 0.498 1
1 81 . 1 1 1 A 12 12 CYS CB C 10 29.165 29.977 -0.812 1
1 82 . 1 1 1 A 12 12 CYS N N 10 118.295 116.807 1.488 1
1 83 . 1 1 1 A 13 13 SER H H 11 9.815 8.756 1.059 1
1 84 . 1 1 1 A 13 13 SER HA H 11 5.227 5.852 -0.625 1
1 87 . 1 1 1 A 13 13 SER C C 11 173.648 173.201 0.447 1
1 88 . 1 1 1 A 13 13 SER CA C 11 57.630 57.166 0.464 1
1 89 . 1 1 1 A 13 13 SER CB C 11 64.820 66.363 -1.543 1
1 90 . 1 1 1 A 13 13 SER N N 11 122.365 116.893 5.472 1
1 91 . 1 1 1 A 14 14 VAL H H 12 9.352 9.247 0.105 1
1 92 . 1 1 1 A 14 14 VAL HA H 12 4.696 5.195 -0.499 1
1 100 . 1 1 1 A 14 14 VAL C C 12 173.875 173.692 0.183 1
1 101 . 1 1 1 A 14 14 VAL CA C 12 60.146 60.823 -0.677 1
1 102 . 1 1 1 A 14 14 VAL CB C 12 34.499 35.202 -0.703 1
1 105 . 1 1 1 A 14 14 VAL N N 12 126.378 122.816 3.562 1
1 106 . 1 1 1 A 15 15 TYR H H 13 8.745 8.977 -0.232 1
1 111 . 1 1 1 A 15 15 TYR C C 13 173.345 173.917 -0.572 1
1 112 . 1 1 1 A 15 15 TYR CA C 13 56.186 55.018 1.168 1
1 113 . 1 1 1 A 15 15 TYR CB C 13 40.858 40.181 0.677 1
1 116 . 1 1 1 A 15 15 TYR N N 13 129.472 128.444 1.028 1
1 117 . 1 1 1 A 16 16 PHE H H 14 7.370 8.854 -1.484 1
1 118 . 1 1 1 A 16 16 PHE HA H 14 5.720 5.439 0.281 1
1 123 . 1 1 1 A 16 16 PHE C C 14 174.058 174.425 -0.367 1
1 124 . 1 1 1 A 16 16 PHE CA C 14 54.361 56.076 -1.715 1
1 125 . 1 1 1 A 16 16 PHE CB C 14 40.461 39.391 1.070 1
1 129 . 1 1 1 A 16 16 PHE N N 14 128.263 128.246 0.017 1
1 130 . 1 1 1 A 17 17 CYS H H 15 8.147 8.760 -0.613 1
1 131 . 1 1 1 A 17 17 CYS CA C 15 56.570 57.664 -1.094 1
1 132 . 1 1 1 A 17 17 CYS CB C 15 29.690 29.347 0.343 1
1 133 . 1 1 1 A 17 17 CYS N N 15 126.188 125.552 0.636 1
1 134 . 1 1 1 A 18 18 GLY HA2 H 16 3.819 3.524 0.295 1
1 135 . 1 1 1 A 18 18 GLY C C 16 173.374 173.424 -0.050 1
1 136 . 1 1 1 A 18 18 GLY CA C 16 45.510 45.557 -0.047 1
1 137 . 1 1 1 A 19 19 SER H H 17 8.533 8.570 -0.037 1
1 138 . 1 1 1 A 19 19 SER HA H 17 4.505 4.409 0.096 1
1 139 . 1 1 1 A 19 19 SER CA C 17 58.700 59.881 -1.181 1
1 140 . 1 1 1 A 19 19 SER CB C 17 63.810 63.697 0.113 1
1 141 . 1 1 1 A 19 19 SER N N 17 117.300 118.651 -1.351 1
1 142 . 1 1 1 A 20 20 ILE HA H 18 4.309 4.234 0.075 1
1 152 . 1 1 1 A 20 20 ILE CA C 18 61.317 63.536 -2.219 1
1 153 . 1 1 1 A 20 20 ILE CB C 18 38.302 37.836 0.466 1
1 157 . 1 1 1 A 21 21 ARG HA H 19 4.172 4.037 0.135 1
1 160 . 1 1 1 A 21 21 ARG C C 19 177.118 176.375 0.743 1
1 161 . 1 1 1 A 21 21 ARG CA C 19 56.960 57.275 -0.315 1
1 162 . 1 1 1 A 21 21 ARG CB C 19 29.568 28.665 0.903 1
1 165 . 1 1 1 A 22 22 GLY H H 20 8.685 8.421 0.264 1
1 166 . 1 1 1 A 22 22 GLY HA2 H 20 3.801 4.058 -0.257 1
1 167 . 1 1 1 A 22 22 GLY HA3 H 20 3.923 4.061 -0.138 1
1 168 . 1 1 1 A 22 22 GLY C C 20 174.814 172.848 1.966 1
1 169 . 1 1 1 A 22 22 GLY CA C 20 45.289 45.222 0.067 1
1 170 . 1 1 1 A 22 22 GLY N N 20 110.145 104.853 5.292 1
1 171 . 1 1 1 A 23 23 GLY H H 21 8.058 8.316 -0.258 1
1 172 . 1 1 1 A 23 23 GLY HA2 H 21 3.998 4.160 -0.162 1
1 173 . 1 1 1 A 23 23 GLY HA3 H 21 4.237 4.171 0.066 1
1 174 . 1 1 1 A 23 23 GLY C C 21 174.762 172.449 2.313 1
1 175 . 1 1 1 A 23 23 GLY CA C 21 45.025 45.743 -0.718 1
1 176 . 1 1 1 A 23 23 GLY N N 21 109.327 109.497 -0.170 1
1 177 . 1 1 1 A 24 24 ARG H H 22 8.376 8.924 -0.548 1
1 178 . 1 1 1 A 24 24 ARG HA H 22 4.086 4.732 -0.646 1
1 184 . 1 1 1 A 24 24 ARG C C 22 178.178 176.633 1.545 1
1 185 . 1 1 1 A 24 24 ARG CA C 22 57.471 54.396 3.075 1
1 186 . 1 1 1 A 24 24 ARG CB C 22 29.653 32.417 -2.764 1
1 189 . 1 1 1 A 24 24 ARG N N 22 120.861 125.052 -4.191 1
1 190 . 1 1 1 A 25 25 GLU H H 23 8.831 8.585 0.246 1
1 191 . 1 1 1 A 25 25 GLU HA H 23 4.015 3.937 0.078 1
1 195 . 1 1 1 A 25 25 GLU C C 23 178.005 177.714 0.291 1
1 196 . 1 1 1 A 25 25 GLU CA C 23 58.920 59.758 -0.838 1
1 197 . 1 1 1 A 25 25 GLU CB C 23 28.592 29.528 -0.936 1
1 199 . 1 1 1 A 25 25 GLU N N 23 121.243 122.430 -1.187 1
1 200 . 1 1 1 A 26 26 ASP H H 24 7.897 8.115 -0.218 1
1 201 . 1 1 1 A 26 26 ASP HA H 24 4.516 3.866 0.650 1
1 203 . 1 1 1 A 26 26 ASP C C 24 176.455 177.922 -1.467 1
1 204 . 1 1 1 A 26 26 ASP CA C 24 55.122 56.356 -1.234 1
1 205 . 1 1 1 A 26 26 ASP CB C 24 39.888 39.999 -0.111 1
1 206 . 1 1 1 A 26 26 ASP N N 24 119.541 120.074 -0.533 1
1 207 . 1 1 1 A 27 27 GLN H H 25 7.696 7.828 -0.132 1
1 208 . 1 1 1 A 27 27 GLN HA H 25 3.704 4.121 -0.417 1
1 212 . 1 1 1 A 27 27 GLN C C 25 177.016 178.211 -1.195 1
1 213 . 1 1 1 A 27 27 GLN CA C 25 59.501 58.798 0.703 1
1 214 . 1 1 1 A 27 27 GLN CB C 25 27.762 28.944 -1.182 1
1 216 . 1 1 1 A 27 27 GLN N N 25 119.471 119.280 0.191 1
1 217 . 1 1 1 A 28 28 ALA H H 26 8.227 7.552 0.675 1
1 218 . 1 1 1 A 28 28 ALA HA H 26 4.072 4.264 -0.192 1
1 222 . 1 1 1 A 28 28 ALA C C 26 180.567 179.752 0.815 1
1 223 . 1 1 1 A 28 28 ALA CA C 26 54.627 55.047 -0.420 1
1 224 . 1 1 1 A 28 28 ALA CB C 26 17.355 18.576 -1.221 1
1 225 . 1 1 1 A 28 28 ALA N N 26 122.362 122.481 -0.119 1
1 226 . 1 1 1 A 29 29 LEU H H 27 7.533 8.517 -0.984 1
1 227 . 1 1 1 A 29 29 LEU HA H 27 4.050 3.994 0.056 1
1 237 . 1 1 1 A 29 29 LEU C C 27 178.752 178.016 0.736 1
1 238 . 1 1 1 A 29 29 LEU CA C 27 57.578 57.557 0.021 1
1 239 . 1 1 1 A 29 29 LEU CB C 27 40.734 41.594 -0.860 1
1 243 . 1 1 1 A 29 29 LEU N N 27 122.255 119.788 2.467 1
1 244 . 1 1 1 A 30 30 TYR H H 28 8.473 8.132 0.341 1
1 245 . 1 1 1 A 30 30 TYR HA H 28 4.049 3.919 0.130 1
1 250 . 1 1 1 A 30 30 TYR C C 28 177.736 178.567 -0.831 1
1 251 . 1 1 1 A 30 30 TYR CA C 28 59.817 59.986 -0.169 1
1 252 . 1 1 1 A 30 30 TYR CB C 28 36.140 37.041 -0.901 1
1 255 . 1 1 1 A 30 30 TYR N N 28 120.403 118.523 1.880 1
1 256 . 1 1 1 A 31 31 ALA H H 29 8.008 8.336 -0.328 1
1 257 . 1 1 1 A 31 31 ALA HA H 29 4.005 4.039 -0.034 1
1 261 . 1 1 1 A 31 31 ALA C C 29 180.879 179.644 1.235 1
1 262 . 1 1 1 A 31 31 ALA CA C 29 54.914 55.327 -0.413 1
1 263 . 1 1 1 A 31 31 ALA CB C 29 17.375 18.180 -0.805 1
1 264 . 1 1 1 A 31 31 ALA N N 29 120.771 122.892 -2.121 1
1 265 . 1 1 1 A 32 32 ARG H H 30 7.596 7.525 0.071 1
1 266 . 1 1 1 A 32 32 ARG HA H 30 3.916 4.051 -0.135 1
1 273 . 1 1 1 A 32 32 ARG C C 30 179.919 178.491 1.428 1
1 274 . 1 1 1 A 32 32 ARG CA C 30 59.014 59.069 -0.055 1
1 275 . 1 1 1 A 32 32 ARG CB C 30 30.531 29.704 0.827 1
1 278 . 1 1 1 A 32 32 ARG N N 30 120.365 118.224 2.141 1
1 279 . 1 1 1 A 33 33 ILE H H 31 8.066 8.278 -0.212 1
1 280 . 1 1 1 A 33 33 ILE HA H 31 3.120 3.580 -0.460 1
1 290 . 1 1 1 A 33 33 ILE C C 31 177.051 178.245 -1.194 1
1 291 . 1 1 1 A 33 33 ILE CA C 31 65.757 65.183 0.574 1
1 292 . 1 1 1 A 33 33 ILE CB C 31 36.928 37.681 -0.753 1
1 296 . 1 1 1 A 33 33 ILE N N 31 121.608 119.412 2.196 1
1 297 . 1 1 1 A 34 34 VAL H H 32 8.148 8.817 -0.669 1
1 298 . 1 1 1 A 34 34 VAL HA H 32 2.954 3.449 -0.495 1
1 306 . 1 1 1 A 34 34 VAL C C 32 177.159 178.085 -0.926 1
1 307 . 1 1 1 A 34 34 VAL CA C 32 67.220 66.322 0.898 1
1 308 . 1 1 1 A 34 34 VAL CB C 32 31.039 31.180 -0.141 1
1 311 . 1 1 1 A 34 34 VAL N N 32 119.318 120.141 -0.823 1
1 312 . 1 1 1 A 35 35 SER H H 33 7.826 8.105 -0.279 1
1 313 . 1 1 1 A 35 35 SER HA H 33 3.868 4.073 -0.205 1
1 316 . 1 1 1 A 35 35 SER C C 33 176.779 177.302 -0.523 1
1 317 . 1 1 1 A 35 35 SER CA C 33 62.000 61.230 0.770 1
1 318 . 1 1 1 A 35 35 SER CB C 33 62.789 62.912 -0.123 1
1 319 . 1 1 1 A 35 35 SER N N 33 111.936 116.150 -4.214 1
1 320 . 1 1 1 A 36 36 ARG H H 34 7.405 7.473 -0.068 1
1 321 . 1 1 1 A 36 36 ARG HA H 34 4.070 4.105 -0.035 1
1 323 . 1 1 1 A 36 36 ARG C C 34 178.047 178.813 -0.766 1
1 324 . 1 1 1 A 36 36 ARG CA C 34 56.108 58.678 -2.570 1
1 325 . 1 1 1 A 36 36 ARG CB C 34 28.837 29.868 -1.031 1
1 326 . 1 1 1 A 36 36 ARG N N 34 120.909 122.041 -1.132 1
1 327 . 1 1 1 A 37 37 LEU H H 35 8.301 8.238 0.063 1
1 328 . 1 1 1 A 37 37 LEU HA H 35 3.620 3.601 0.019 1
1 336 . 1 1 1 A 37 37 LEU C C 35 178.446 179.134 -0.688 1
1 337 . 1 1 1 A 37 37 LEU CA C 35 57.640 57.825 -0.185 1
1 338 . 1 1 1 A 37 37 LEU CB C 35 41.584 41.485 0.099 1
1 342 . 1 1 1 A 37 37 LEU N N 35 118.567 119.467 -0.900 1
1 343 . 1 1 1 A 38 38 ARG H H 36 7.379 8.391 -1.012 1
1 344 . 1 1 1 A 38 38 ARG HA H 36 4.340 4.040 0.300 1
1 350 . 1 1 1 A 38 38 ARG C C 36 177.895 179.000 -1.105 1
1 351 . 1 1 1 A 38 38 ARG CA C 36 57.785 59.168 -1.383 1
1 352 . 1 1 1 A 38 38 ARG CB C 36 29.775 29.817 -0.042 1
1 355 . 1 1 1 A 38 38 ARG N N 36 115.352 119.130 -3.778 1
1 356 . 1 1 1 A 39 39 ARG H H 37 7.240 7.795 -0.555 1
1 357 . 1 1 1 A 39 39 ARG HA H 37 3.743 4.136 -0.393 1
1 363 . 1 1 1 A 39 39 ARG C C 37 176.988 178.756 -1.768 1
1 364 . 1 1 1 A 39 39 ARG CA C 37 57.605 58.507 -0.902 1
1 365 . 1 1 1 A 39 39 ARG CB C 37 28.925 30.476 -1.551 1
1 368 . 1 1 1 A 39 39 ARG N N 37 117.410 119.031 -1.621 1
1 369 . 1 1 1 A 40 40 TYR H H 38 7.296 8.227 -0.931 1
1 370 . 1 1 1 A 40 40 TYR HA H 38 4.319 4.157 0.162 1
1 375 . 1 1 1 A 40 40 TYR C C 38 175.001 176.186 -1.185 1
1 376 . 1 1 1 A 40 40 TYR CA C 38 57.730 60.229 -2.499 1
1 377 . 1 1 1 A 40 40 TYR CB C 38 39.343 37.909 1.434 1
1 380 . 1 1 1 A 40 40 TYR N N 38 116.937 118.885 -1.948 1
1 381 . 1 1 1 A 41 41 GLY H H 39 7.325 7.560 -0.235 1
1 382 . 1 1 1 A 41 41 GLY HA2 H 39 3.953 4.056 -0.103 1
1 383 . 1 1 1 A 41 41 GLY C C 39 171.302 171.809 -0.507 1
1 384 . 1 1 1 A 41 41 GLY CA C 39 45.590 45.782 -0.192 1
1 385 . 1 1 1 A 41 41 GLY N N 39 105.596 104.412 1.184 1
1 386 . 1 1 1 A 42 42 LYS H H 40 8.186 8.919 -0.733 1
1 387 . 1 1 1 A 42 42 LYS HA H 40 4.205 4.682 -0.477 1
1 393 . 1 1 1 A 42 42 LYS C C 40 175.672 175.360 0.312 1
1 394 . 1 1 1 A 42 42 LYS CA C 40 55.241 55.337 -0.096 1
1 395 . 1 1 1 A 42 42 LYS CB C 40 32.889 34.419 -1.530 1
1 399 . 1 1 1 A 42 42 LYS N N 40 120.341 122.442 -2.101 1
1 400 . 1 1 1 A 43 43 VAL H H 41 8.610 8.806 -0.196 1
1 401 . 1 1 1 A 43 43 VAL HA H 41 4.416 4.402 0.014 1
1 409 . 1 1 1 A 43 43 VAL C C 41 175.997 175.293 0.704 1
1 410 . 1 1 1 A 43 43 VAL CA C 41 61.331 62.409 -1.078 1
1 411 . 1 1 1 A 43 43 VAL CB C 41 30.573 31.717 -1.144 1
1 414 . 1 1 1 A 43 43 VAL N N 41 127.312 123.977 3.335 1
1 415 . 1 1 1 A 44 44 LEU H H 42 8.894 8.301 0.593 1
1 416 . 1 1 1 A 44 44 LEU HA H 42 4.496 3.432 1.064 1
1 424 . 1 1 1 A 44 44 LEU CA C 42 54.522 56.845 -2.323 1
1 425 . 1 1 1 A 44 44 LEU CB C 42 40.980 41.634 -0.654 1
1 429 . 1 1 1 A 44 44 LEU N N 42 130.261 127.839 2.422 1
1 430 . 1 1 1 A 45 45 THR HA H 43 4.263 3.883 0.380 1
1 435 . 1 1 1 A 45 45 THR CA C 43 61.033 62.024 -0.991 1
1 436 . 1 1 1 A 45 45 THR CB C 43 69.768 66.524 3.244 1
1 440 . 1 1 1 A 46 46 GLU CA C 44 56.411 59.459 -3.048 1
1 441 . 1 1 1 A 46 46 GLU CB C 44 29.827 29.173 0.654 1
1 443 . 1 1 1 A 47 47 HIS HA H 45 4.549 4.290 0.259 1
1 447 . 1 1 1 A 47 47 HIS C C 45 174.812 175.738 -0.926 1
1 448 . 1 1 1 A 47 47 HIS CA C 45 56.107 59.693 -3.586 1
1 449 . 1 1 1 A 47 47 HIS CB C 45 29.080 30.220 -1.140 1
1 451 . 1 1 1 A 48 48 VAL H H 46 7.826 7.209 0.617 1
1 452 . 1 1 1 A 48 48 VAL HA H 46 4.024 3.401 0.623 1
1 460 . 1 1 1 A 48 48 VAL C C 46 175.697 176.678 -0.981 1
1 461 . 1 1 1 A 48 48 VAL CA C 46 61.841 62.979 -1.138 1
1 462 . 1 1 1 A 48 48 VAL CB C 46 32.600 32.051 0.549 1
1 465 . 1 1 1 A 48 48 VAL N N 46 121.117 117.580 3.537 1
1 466 . 1 1 1 A 49 49 ALA H H 47 8.237 8.774 -0.537 1
1 467 . 1 1 1 A 49 49 ALA HA H 47 4.281 3.964 0.317 1
1 471 . 1 1 1 A 49 49 ALA C C 47 177.173 176.981 0.192 1
1 472 . 1 1 1 A 49 49 ALA CA C 47 52.207 55.114 -2.907 1
1 473 . 1 1 1 A 49 49 ALA CB C 47 19.064 17.656 1.408 1
1 474 . 1 1 1 A 49 49 ALA N N 47 126.817 123.411 3.406 1
1 475 . 1 1 1 A 50 50 ASP H H 48 8.029 9.875 -1.846 1
1 476 . 1 1 1 A 50 50 ASP HA H 48 4.436 4.518 -0.082 1
1 479 . 1 1 1 A 50 50 ASP C C 48 176.124 176.761 -0.637 1
1 480 . 1 1 1 A 50 50 ASP CA C 48 54.447 54.866 -0.419 1
1 481 . 1 1 1 A 50 50 ASP CB C 48 40.877 39.976 0.901 1
1 482 . 1 1 1 A 50 50 ASP N N 48 119.687 118.451 1.236 1
1 483 . 1 1 1 A 51 51 ALA H H 49 8.094 8.531 -0.437 1
1 484 . 1 1 1 A 51 51 ALA HA H 49 4.134 4.394 -0.260 1
1 488 . 1 1 1 A 51 51 ALA C C 49 177.835 178.571 -0.736 1
1 489 . 1 1 1 A 51 51 ALA CA C 49 52.900 52.480 0.420 1
1 490 . 1 1 1 A 51 51 ALA CB C 49 18.942 19.840 -0.898 1
1 491 . 1 1 1 A 51 51 ALA N N 49 124.400 122.418 1.982 1
1 492 . 1 1 1 A 52 52 GLU H H 50 8.243 7.995 0.248 1
1 493 . 1 1 1 A 52 52 GLU HA H 50 4.152 4.132 0.020 1
1 497 . 1 1 1 A 52 52 GLU C C 50 176.456 176.672 -0.216 1
1 498 . 1 1 1 A 52 52 GLU CA C 50 56.480 59.066 -2.586 1
1 499 . 1 1 1 A 52 52 GLU CB C 50 29.470 29.657 -0.187 1
1 501 . 1 1 1 A 52 52 GLU N N 50 118.917 116.697 2.220 1
1 502 . 1 1 1 A 53 53 LEU H H 51 7.839 7.349 0.490 1
1 503 . 1 1 1 A 53 53 LEU HA H 51 4.229 4.328 -0.099 1
1 513 . 1 1 1 A 53 53 LEU C C 51 177.058 176.552 0.506 1
1 514 . 1 1 1 A 53 53 LEU CA C 51 54.625 54.863 -0.238 1
1 515 . 1 1 1 A 53 53 LEU CB C 51 42.125 42.724 -0.599 1
1 519 . 1 1 1 A 53 53 LEU N N 51 122.169 118.424 3.745 1
1 520 . 1 1 1 A 54 54 GLU H H 52 8.104 8.856 -0.752 1
1 521 . 1 1 1 A 54 54 GLU HA H 52 4.470 4.326 0.144 1
1 525 . 1 1 1 A 54 54 GLU CA C 52 54.286 58.422 -4.136 1
1 526 . 1 1 1 A 54 54 GLU CB C 52 29.268 28.740 0.528 1
1 528 . 1 1 1 A 54 54 GLU N N 52 123.040 117.711 5.329 1
1 529 . 1 1 1 A 55 55 PRO HA H 53 4.310 4.487 -0.177 1
1 536 . 1 1 1 A 55 55 PRO C C 53 177.019 176.666 0.353 1
1 537 . 1 1 1 A 55 55 PRO CA C 53 63.075 63.195 -0.120 1
1 538 . 1 1 1 A 55 55 PRO CB C 53 31.329 31.883 -0.554 1
1 541 . 1 1 1 A 56 56 LEU H H 54 8.263 8.409 -0.146 1
1 542 . 1 1 1 A 56 56 LEU HA H 54 4.237 4.690 -0.453 1
1 552 . 1 1 1 A 56 56 LEU C C 54 178.055 177.361 0.694 1
1 553 . 1 1 1 A 56 56 LEU CA C 54 55.018 54.528 0.490 1
1 554 . 1 1 1 A 56 56 LEU CB C 54 41.990 43.400 -1.410 1
1 558 . 1 1 1 A 56 56 LEU N N 54 122.728 122.395 0.333 1
1 559 . 1 1 1 A 57 57 GLY H H 55 8.231 8.593 -0.362 1
1 560 . 1 1 1 A 57 57 GLY HA2 H 55 3.911 3.993 -0.082 1
1 561 . 1 1 1 A 57 57 GLY HA3 H 55 3.808 3.996 -0.188 1
1 562 . 1 1 1 A 57 57 GLY C C 55 174.379 174.738 -0.359 1
1 563 . 1 1 1 A 57 57 GLY CA C 55 45.092 45.191 -0.099 1
1 564 . 1 1 1 A 57 57 GLY N N 55 110.035 110.576 -0.541 1
1 565 . 1 1 1 A 58 58 GLU H H 56 8.241 8.454 -0.213 1
1 566 . 1 1 1 A 58 58 GLU HA H 56 4.136 3.973 0.163 1
1 570 . 1 1 1 A 58 58 GLU C C 56 176.868 177.738 -0.870 1
1 571 . 1 1 1 A 58 58 GLU CA C 56 56.734 58.791 -2.057 1
1 572 . 1 1 1 A 58 58 GLU CB C 56 29.584 28.424 1.160 1
1 574 . 1 1 1 A 58 58 GLU N N 56 121.173 113.902 7.271 1
1 575 . 1 1 1 A 59 59 GLU H H 57 8.419 8.618 -0.199 1
1 576 . 1 1 1 A 59 59 GLU HA H 57 4.074 4.083 -0.009 1
1 580 . 1 1 1 A 59 59 GLU C C 57 176.502 177.512 -1.010 1
1 581 . 1 1 1 A 59 59 GLU CA C 57 56.842 59.170 -2.328 1
1 582 . 1 1 1 A 59 59 GLU CB C 57 29.267 29.279 -0.012 1
1 584 . 1 1 1 A 59 59 GLU N N 57 121.777 121.176 0.601 1
1 585 . 1 1 1 A 60 60 ALA H H 58 8.077 7.574 0.503 1
1 586 . 1 1 1 A 60 60 ALA HA H 58 4.134 4.288 -0.154 1
1 590 . 1 1 1 A 60 60 ALA CA C 58 52.432 52.612 -0.180 1
1 591 . 1 1 1 A 60 60 ALA CB C 58 18.743 19.434 -0.691 1
1 592 . 1 1 1 A 60 60 ALA N N 58 125.120 123.553 1.567 1
1 593 . 1 1 1 A 61 61 ALA H H 59 8.041 8.299 -0.258 1
1 594 . 1 1 1 A 61 61 ALA HA H 59 4.131 3.997 0.134 1
1 598 . 1 1 1 A 61 61 ALA C C 59 178.147 177.658 0.489 1
1 599 . 1 1 1 A 61 61 ALA CA C 59 52.586 53.632 -1.046 1
1 600 . 1 1 1 A 61 61 ALA CB C 59 18.692 18.641 0.051 1
1 601 . 1 1 1 A 61 61 ALA N N 59 123.857 122.643 1.214 1
1 602 . 1 1 1 A 62 62 GLY H H 60 8.069 8.440 -0.371 1
1 603 . 1 1 1 A 62 62 GLY HA2 H 60 3.810 4.067 -0.257 1
1 604 . 1 1 1 A 62 62 GLY HA3 H 60 3.888 4.089 -0.201 1
1 605 . 1 1 1 A 62 62 GLY C C 60 174.914 175.319 -0.405 1
1 606 . 1 1 1 A 62 62 GLY CA C 60 45.320 45.706 -0.386 1
1 607 . 1 1 1 A 62 62 GLY N N 60 107.924 108.862 -0.938 1
1 608 . 1 1 1 A 63 63 GLY H H 61 8.118 8.165 -0.047 1
1 609 . 1 1 1 A 63 63 GLY HA2 H 61 4.008 4.171 -0.163 1
1 610 . 1 1 1 A 63 63 GLY HA3 H 61 3.893 4.191 -0.298 1
1 611 . 1 1 1 A 63 63 GLY C C 61 174.743 175.109 -0.366 1
1 612 . 1 1 1 A 63 63 GLY CA C 61 45.202 46.213 -1.011 1
1 613 . 1 1 1 A 63 63 GLY N N 61 109.441 107.165 2.276 1
1 614 . 1 1 1 A 64 64 ASP H H 62 8.305 8.395 -0.090 1
1 615 . 1 1 1 A 64 64 ASP HA H 62 4.240 4.287 -0.047 1
1 618 . 1 1 1 A 64 64 ASP C C 62 177.571 177.633 -0.062 1
1 619 . 1 1 1 A 64 64 ASP CA C 62 57.210 57.260 -0.050 1
1 620 . 1 1 1 A 64 64 ASP CB C 62 40.142 40.022 0.120 1
1 621 . 1 1 1 A 64 64 ASP N N 62 121.568 121.293 0.275 1
1 622 . 1 1 1 A 65 65 GLN H H 63 8.337 8.258 0.079 1
1 623 . 1 1 1 A 65 65 GLN HA H 63 4.138 3.945 0.193 1
1 628 . 1 1 1 A 65 65 GLN C C 63 177.490 178.842 -1.352 1
1 629 . 1 1 1 A 65 65 GLN CA C 63 58.643 58.701 -0.058 1
1 630 . 1 1 1 A 65 65 GLN CB C 63 27.803 28.429 -0.626 1
1 632 . 1 1 1 A 65 65 GLN N N 63 119.700 118.495 1.205 1
1 633 . 1 1 1 A 66 66 PHE H H 64 7.658 8.186 -0.528 1
1 634 . 1 1 1 A 66 66 PHE HA H 64 4.170 4.338 -0.168 1
1 638 . 1 1 1 A 66 66 PHE C C 64 176.872 178.146 -1.274 1
1 639 . 1 1 1 A 66 66 PHE CA C 64 60.158 61.117 -0.959 1
1 640 . 1 1 1 A 66 66 PHE CB C 64 38.490 38.328 0.162 1
1 643 . 1 1 1 A 66 66 PHE N N 64 121.036 119.480 1.556 1
1 644 . 1 1 1 A 67 67 ILE H H 65 7.646 9.095 -1.449 1
1 645 . 1 1 1 A 67 67 ILE HA H 65 3.426 3.509 -0.083 1
1 655 . 1 1 1 A 67 67 ILE CA C 65 63.377 65.651 -2.274 1
1 656 . 1 1 1 A 67 67 ILE CB C 65 37.057 37.554 -0.497 1
1 660 . 1 1 1 A 67 67 ILE N N 65 121.372 119.925 1.447 1
1 661 . 1 1 1 A 68 68 HIS H H 66 7.945 8.531 -0.586 1
1 662 . 1 1 1 A 68 68 HIS HA H 66 4.005 4.214 -0.209 1
1 665 . 1 1 1 A 68 68 HIS CA C 66 59.915 60.137 -0.222 1
1 668 . 1 1 1 A 68 68 HIS N N 66 120.036 119.463 0.573 1
1 669 . 1 1 1 A 69 69 GLU HA H 67 3.677 3.988 -0.311 1
1 673 . 1 1 1 A 69 69 GLU CA C 67 58.490 59.745 -1.255 1
1 674 . 1 1 1 A 69 69 GLU CB C 67 29.290 29.472 -0.182 1
1 676 . 1 1 1 A 70 70 GLN H H 68 8.017 8.067 -0.050 1
1 677 . 1 1 1 A 70 70 GLN HA H 68 3.426 3.911 -0.485 1
1 678 . 1 1 1 A 70 70 GLN C C 68 179.280 178.135 1.145 1
1 679 . 1 1 1 A 70 70 GLN CA C 68 57.561 58.861 -1.300 1
1 680 . 1 1 1 A 70 70 GLN CB C 68 28.530 28.132 0.398 1
1 682 . 1 1 1 A 70 70 GLN N N 68 120.410 117.872 2.538 1
1 683 . 1 1 1 A 71 71 ASP HA H 69 4.440 4.855 -0.415 1
1 684 . 1 1 1 A 71 71 ASP C C 69 177.402 178.852 -1.450 1
1 685 . 1 1 1 A 71 71 ASP CA C 69 56.290 58.153 -1.863 1
1 686 . 1 1 1 A 72 72 LEU H H 70 7.952 8.444 -0.492 1
1 687 . 1 1 1 A 72 72 LEU HA H 70 3.775 3.886 -0.111 1
1 697 . 1 1 1 A 72 72 LEU C C 70 178.316 178.942 -0.626 1
1 698 . 1 1 1 A 72 72 LEU CA C 70 56.101 57.986 -1.885 1
1 699 . 1 1 1 A 72 72 LEU CB C 70 39.872 41.306 -1.434 1
1 703 . 1 1 1 A 72 72 LEU N N 70 120.832 119.836 0.996 1
1 704 . 1 1 1 A 73 73 ASN H H 71 7.723 8.137 -0.414 1
1 705 . 1 1 1 A 73 73 ASN HA H 71 4.270 4.377 -0.107 1
1 708 . 1 1 1 A 73 73 ASN C C 71 178.193 177.729 0.464 1
1 709 . 1 1 1 A 73 73 ASN CA C 71 55.970 56.300 -0.330 1
1 710 . 1 1 1 A 73 73 ASN CB C 71 37.640 38.852 -1.212 1
1 711 . 1 1 1 A 73 73 ASN N N 71 119.295 116.636 2.659 1
1 712 . 1 1 1 A 74 74 TRP H H 72 7.811 8.692 -0.881 1
1 713 . 1 1 1 A 74 74 TRP HA H 72 4.500 4.483 0.017 1
1 720 . 1 1 1 A 74 74 TRP CA C 72 58.480 59.650 -1.170 1
1 721 . 1 1 1 A 74 74 TRP CB C 72 28.920 29.734 -0.814 1
1 727 . 1 1 1 A 74 74 TRP N N 72 121.490 120.412 1.078 1
1 729 . 1 1 1 A 75 75 LEU H H 73 8.412 8.677 -0.265 1
1 730 . 1 1 1 A 75 75 LEU HA H 73 3.290 3.612 -0.322 1
1 739 . 1 1 1 A 75 75 LEU C C 73 178.562 178.680 -0.118 1
1 740 . 1 1 1 A 75 75 LEU CA C 73 58.226 57.649 0.577 1
1 741 . 1 1 1 A 75 75 LEU CB C 73 41.200 41.304 -0.104 1
1 745 . 1 1 1 A 75 75 LEU N N 73 121.065 121.339 -0.274 1
1 746 . 1 1 1 A 76 76 GLN H H 74 7.648 7.774 -0.126 1
1 747 . 1 1 1 A 76 76 GLN HA H 74 3.657 4.145 -0.488 1
1 752 . 1 1 1 A 76 76 GLN C C 74 178.616 177.688 0.928 1
1 753 . 1 1 1 A 76 76 GLN CA C 74 58.777 58.913 -0.136 1
1 754 . 1 1 1 A 76 76 GLN CB C 74 28.163 28.155 0.008 1
1 756 . 1 1 1 A 76 76 GLN N N 74 113.985 118.991 -5.006 1
1 757 . 1 1 1 A 77 77 GLN H H 75 7.465 7.896 -0.431 1
1 758 . 1 1 1 A 77 77 GLN HA H 75 4.134 4.468 -0.334 1
1 761 . 1 1 1 A 77 77 GLN C C 75 176.223 175.818 0.405 1
1 762 . 1 1 1 A 77 77 GLN CA C 75 56.203 55.657 0.546 1
1 763 . 1 1 1 A 77 77 GLN CB C 75 29.524 29.545 -0.021 1
1 765 . 1 1 1 A 77 77 GLN N N 75 117.481 116.716 0.765 1
1 766 . 1 1 1 A 78 78 ALA H H 76 7.420 7.252 0.168 1
1 767 . 1 1 1 A 78 78 ALA HA H 76 3.864 4.271 -0.407 1
1 771 . 1 1 1 A 78 78 ALA C C 76 176.733 176.800 -0.067 1
1 772 . 1 1 1 A 78 78 ALA CA C 76 52.529 52.975 -0.446 1
1 773 . 1 1 1 A 78 78 ALA CB C 76 20.124 19.293 0.831 1
1 774 . 1 1 1 A 78 78 ALA N N 76 122.682 123.317 -0.635 1
1 775 . 1 1 1 A 79 79 ASP H H 77 9.028 8.809 0.219 1
1 776 . 1 1 1 A 79 79 ASP HA H 77 4.673 4.716 -0.043 1
1 779 . 1 1 1 A 79 79 ASP C C 77 175.740 176.183 -0.443 1
1 780 . 1 1 1 A 79 79 ASP CA C 77 56.383 56.778 -0.395 1
1 781 . 1 1 1 A 79 79 ASP CB C 77 42.826 42.755 0.071 1
1 782 . 1 1 1 A 79 79 ASP N N 77 119.887 122.409 -2.522 1
1 783 . 1 1 1 A 80 80 VAL H H 78 7.379 7.789 -0.410 1
1 784 . 1 1 1 A 80 80 VAL HA H 78 4.340 4.818 -0.478 1
1 792 . 1 1 1 A 80 80 VAL C C 78 175.321 174.391 0.930 1
1 793 . 1 1 1 A 80 80 VAL CA C 78 60.011 60.451 -0.440 1
1 794 . 1 1 1 A 80 80 VAL CB C 78 35.362 35.856 -0.494 1
1 797 . 1 1 1 A 80 80 VAL N N 78 114.152 117.971 -3.819 1
1 798 . 1 1 1 A 81 81 VAL H H 79 8.350 8.571 -0.221 1
1 799 . 1 1 1 A 81 81 VAL HA H 79 4.799 4.809 -0.010 1
1 807 . 1 1 1 A 81 81 VAL C C 79 173.095 174.792 -1.697 1
1 808 . 1 1 1 A 81 81 VAL CA C 79 60.775 60.833 -0.058 1
1 809 . 1 1 1 A 81 81 VAL CB C 79 32.824 35.336 -2.512 1
1 812 . 1 1 1 A 81 81 VAL N N 79 128.429 125.981 2.448 1
1 813 . 1 1 1 A 82 82 VAL H H 80 8.947 8.604 0.343 1
1 814 . 1 1 1 A 82 82 VAL HA H 80 4.947 4.762 0.185 1
1 822 . 1 1 1 A 82 82 VAL C C 80 173.522 174.240 -0.718 1
1 823 . 1 1 1 A 82 82 VAL CA C 80 59.684 60.213 -0.529 1
1 824 . 1 1 1 A 82 82 VAL CB C 80 33.702 35.257 -1.555 1
1 827 . 1 1 1 A 82 82 VAL N N 80 126.957 126.617 0.340 1
1 828 . 1 1 1 A 83 83 ALA H H 81 9.011 9.030 -0.019 1
1 829 . 1 1 1 A 83 83 ALA HA H 81 4.938 5.305 -0.367 1
1 833 . 1 1 1 A 83 83 ALA C C 81 130.330 175.351 -45.021 1
1 834 . 1 1 1 A 83 83 ALA CA C 81 49.490 49.818 -0.328 1
1 835 . 1 1 1 A 83 83 ALA CB C 81 23.628 21.875 1.753 1
1 836 . 1 1 1 A 83 83 ALA N N 81 128.705 128.807 -0.102 1
1 837 . 1 1 1 A 84 84 GLU H H 82 8.922 8.988 -0.066 1
1 838 . 1 1 1 A 84 84 GLU HA H 82 4.937 4.755 0.182 1
1 839 . 1 1 1 A 84 84 GLU C C 82 177.673 175.341 2.332 1
1 840 . 1 1 1 A 84 84 GLU CA C 82 56.714 56.301 0.413 1
1 841 . 1 1 1 A 84 84 GLU CB C 82 29.882 31.041 -1.159 1
1 842 . 1 1 1 A 84 84 GLU N N 82 130.330 122.739 7.591 1
1 843 . 1 1 1 A 85 85 VAL H H 83 8.427 8.835 -0.408 1
1 844 . 1 1 1 A 85 85 VAL HA H 83 4.435 5.225 -0.790 1
1 852 . 1 1 1 A 85 85 VAL C C 83 174.252 175.466 -1.214 1
1 853 . 1 1 1 A 85 85 VAL CA C 83 59.896 60.351 -0.455 1
1 854 . 1 1 1 A 85 85 VAL CB C 83 29.968 35.990 -6.022 1
1 857 . 1 1 1 A 85 85 VAL N N 83 114.212 126.384 -12.172 1
1 858 . 1 1 1 A 86 86 THR H H 84 9.347 9.184 0.163 1
1 859 . 1 1 1 A 86 86 THR HA H 84 4.146 4.816 -0.670 1
1 864 . 1 1 1 A 86 86 THR C C 84 175.751 174.408 1.343 1
1 865 . 1 1 1 A 86 86 THR CA C 84 67.629 63.443 4.186 1
1 866 . 1 1 1 A 86 86 THR CB C 84 66.819 71.157 -4.338 1
1 868 . 1 1 1 A 86 86 THR N N 84 121.640 118.792 2.848 1
1 869 . 1 1 1 A 87 87 GLN H H 85 8.114 7.977 0.137 1
1 870 . 1 1 1 A 87 87 GLN HA H 85 4.736 4.696 0.040 1
1 874 . 1 1 1 A 87 87 GLN CA C 85 51.898 53.765 -1.867 1
1 875 . 1 1 1 A 87 87 GLN CB C 85 27.942 29.814 -1.872 1
1 877 . 1 1 1 A 87 87 GLN N N 85 120.367 116.298 4.069 1
1 878 . 1 1 1 A 88 88 PRO HA H 86 4.061 4.502 -0.441 1
1 885 . 1 1 1 A 88 88 PRO C C 86 176.436 175.688 0.748 1
1 886 . 1 1 1 A 88 88 PRO CA C 86 63.422 63.408 0.014 1
1 887 . 1 1 1 A 88 88 PRO CB C 86 31.925 32.583 -0.658 1
1 889 . 1 1 1 A 89 89 SER H H 87 6.044 8.541 -2.497 1
1 890 . 1 1 1 A 89 89 SER HA H 87 4.630 4.943 -0.313 1
1 893 . 1 1 1 A 89 89 SER C C 87 175.612 173.920 1.692 1
1 894 . 1 1 1 A 89 89 SER CA C 87 56.800 58.306 -1.506 1
1 895 . 1 1 1 A 89 89 SER CB C 87 64.196 66.248 -2.052 1
1 896 . 1 1 1 A 89 89 SER N N 87 115.721 118.041 -2.320 1
1 897 . 1 1 1 A 90 90 LEU H H 88 9.702 8.927 0.775 1
1 898 . 1 1 1 A 90 90 LEU HA H 88 4.270 4.044 0.226 1
1 906 . 1 1 1 A 90 90 LEU C C 88 179.173 179.157 0.016 1
1 907 . 1 1 1 A 90 90 LEU CA C 88 57.402 58.389 -0.987 1
1 908 . 1 1 1 A 90 90 LEU CB C 88 43.642 41.826 1.816 1
1 911 . 1 1 1 A 90 90 LEU N N 88 130.488 127.467 3.021 1
1 912 . 1 1 1 A 91 91 GLY H H 89 8.354 8.359 -0.005 1
1 913 . 1 1 1 A 91 91 GLY HA2 H 89 3.680 3.799 -0.119 1
1 914 . 1 1 1 A 91 91 GLY HA3 H 89 3.584 3.827 -0.243 1
1 915 . 1 1 1 A 91 91 GLY C C 89 175.106 176.193 -1.087 1
1 916 . 1 1 1 A 91 91 GLY CA C 89 47.770 47.614 0.156 1
1 917 . 1 1 1 A 91 91 GLY N N 89 107.522 105.834 1.688 1
1 918 . 1 1 1 A 92 92 VAL H H 90 7.906 9.110 -1.204 1
1 919 . 1 1 1 A 92 92 VAL HA H 90 3.940 3.714 0.226 1
1 927 . 1 1 1 A 92 92 VAL C C 90 178.467 177.709 0.758 1
1 928 . 1 1 1 A 92 92 VAL CA C 90 65.379 66.555 -1.176 1
1 929 . 1 1 1 A 92 92 VAL CB C 90 31.785 31.742 0.043 1
1 932 . 1 1 1 A 92 92 VAL N N 90 121.741 122.206 -0.465 1
1 933 . 1 1 1 A 93 93 GLY H H 91 7.595 7.851 -0.256 1
1 934 . 1 1 1 A 93 93 GLY HA2 H 91 3.628 3.768 -0.140 1
1 935 . 1 1 1 A 93 93 GLY HA3 H 91 3.415 3.779 -0.364 1
1 936 . 1 1 1 A 93 93 GLY C C 91 174.022 175.618 -1.596 1
1 937 . 1 1 1 A 93 93 GLY CA C 91 48.319 47.392 0.927 1
1 938 . 1 1 1 A 93 93 GLY N N 91 104.629 107.455 -2.826 1
1 939 . 1 1 1 A 94 94 TYR H H 92 8.372 8.438 -0.066 1
1 940 . 1 1 1 A 94 94 TYR HA H 92 4.046 4.035 0.011 1
1 943 . 1 1 1 A 94 94 TYR C C 92 177.458 177.810 -0.352 1
1 944 . 1 1 1 A 94 94 TYR CA C 92 61.760 60.724 1.036 1
1 945 . 1 1 1 A 94 94 TYR CB C 92 38.431 38.777 -0.346 1
1 948 . 1 1 1 A 94 94 TYR N N 92 123.383 123.451 -0.068 1
1 949 . 1 1 1 A 95 95 GLU H H 93 8.424 9.059 -0.635 1
1 950 . 1 1 1 A 95 95 GLU HA H 93 3.421 3.876 -0.455 1
1 951 . 1 1 1 A 95 95 GLU C C 93 178.590 179.406 -0.816 1
1 952 . 1 1 1 A 95 95 GLU CA C 93 60.211 59.149 1.062 1
1 953 . 1 1 1 A 95 95 GLU CB C 93 29.025 29.132 -0.107 1
1 954 . 1 1 1 A 95 95 GLU N N 93 120.181 118.225 1.956 1
1 955 . 1 1 1 A 96 96 LEU H H 94 8.210 8.443 -0.233 1
1 956 . 1 1 1 A 96 96 LEU HA H 94 3.830 4.013 -0.183 1
1 964 . 1 1 1 A 96 96 LEU C C 94 179.032 178.977 0.055 1
1 965 . 1 1 1 A 96 96 LEU CA C 94 57.683 58.121 -0.438 1
1 966 . 1 1 1 A 96 96 LEU CB C 94 41.883 41.835 0.048 1
1 970 . 1 1 1 A 96 96 LEU N N 94 118.091 120.613 -2.522 1
1 971 . 1 1 1 A 97 97 GLY H H 95 8.773 8.572 0.201 1
1 972 . 1 1 1 A 97 97 GLY C C 95 175.344 175.597 -0.253 1
1 973 . 1 1 1 A 97 97 GLY CA C 95 47.308 46.639 0.669 1
1 974 . 1 1 1 A 97 97 GLY N N 95 108.085 105.821 2.264 1
1 975 . 1 1 1 A 98 98 ARG H H 96 8.100 8.431 -0.331 1
1 976 . 1 1 1 A 98 98 ARG C C 96 179.692 178.749 0.943 1
1 977 . 1 1 1 A 98 98 ARG CA C 96 56.308 59.147 -2.839 1
1 978 . 1 1 1 A 98 98 ARG CB C 96 26.854 29.470 -2.616 1
1 979 . 1 1 1 A 98 98 ARG N N 96 118.156 121.865 -3.709 1
1 980 . 1 1 1 A 99 99 ALA H H 97 8.498 7.519 0.979 1
1 981 . 1 1 1 A 99 99 ALA HA H 97 3.640 3.986 -0.346 1
1 985 . 1 1 1 A 99 99 ALA C C 97 179.650 180.356 -0.706 1
1 986 . 1 1 1 A 99 99 ALA CA C 97 55.166 54.975 0.191 1
1 987 . 1 1 1 A 99 99 ALA CB C 97 18.604 18.597 0.007 1
1 988 . 1 1 1 A 99 99 ALA N N 97 122.310 121.833 0.477 1
1 989 . 1 1 1 A 100 100 VAL H H 98 8.597 8.499 0.098 1
1 990 . 1 1 1 A 100 100 VAL HA H 98 3.798 3.510 0.288 1
1 998 . 1 1 1 A 100 100 VAL C C 98 180.464 178.170 2.294 1
1 999 . 1 1 1 A 100 100 VAL CA C 98 65.664 66.766 -1.102 1
1 1000 . 1 1 1 A 100 100 VAL CB C 98 31.065 31.371 -0.306 1
1 1003 . 1 1 1 A 100 100 VAL N N 98 120.603 119.333 1.270 1
1 1004 . 1 1 1 A 101 101 ALA H H 99 7.280 7.624 -0.344 1
1 1005 . 1 1 1 A 101 101 ALA HA H 99 3.963 4.270 -0.307 1
1 1009 . 1 1 1 A 101 101 ALA C C 99 179.314 179.357 -0.043 1
1 1010 . 1 1 1 A 101 101 ALA CA C 99 54.367 54.234 0.133 1
1 1011 . 1 1 1 A 101 101 ALA CB C 99 18.139 19.380 -1.241 1
1 1012 . 1 1 1 A 101 101 ALA N N 99 124.450 121.716 2.734 1
1 1013 . 1 1 1 A 102 102 LEU H H 100 7.200 8.439 -1.239 1
1 1014 . 1 1 1 A 102 102 LEU HA H 100 4.192 4.137 0.055 1
1 1024 . 1 1 1 A 102 102 LEU C C 100 177.306 177.845 -0.539 1
1 1025 . 1 1 1 A 102 102 LEU CA C 100 54.808 57.269 -2.461 1
1 1026 . 1 1 1 A 102 102 LEU CB C 100 42.880 42.533 0.347 1
1 1030 . 1 1 1 A 102 102 LEU N N 100 116.834 118.343 -1.509 1
1 1031 . 1 1 1 A 103 103 GLY H H 101 7.891 7.567 0.324 1
1 1032 . 1 1 1 A 103 103 GLY HA2 H 101 3.941 4.021 -0.080 1
1 1033 . 1 1 1 A 103 103 GLY HA3 H 101 3.831 4.026 -0.195 1
1 1034 . 1 1 1 A 103 103 GLY C C 101 175.137 173.988 1.149 1
1 1035 . 1 1 1 A 103 103 GLY CA C 101 45.673 44.869 0.804 1
1 1036 . 1 1 1 A 103 103 GLY N N 101 109.395 107.598 1.797 1
1 1037 . 1 1 1 A 104 104 LYS H H 102 7.337 8.761 -1.424 1
1 1038 . 1 1 1 A 104 104 LYS HA H 102 4.402 4.492 -0.090 1
1 1043 . 1 1 1 A 104 104 LYS CA C 102 52.136 57.169 -5.033 1
1 1044 . 1 1 1 A 104 104 LYS CB C 102 31.045 34.904 -3.859 1
1 1047 . 1 1 1 A 104 104 LYS N N 102 118.954 118.882 0.072 1
1 1048 . 1 1 1 A 105 105 PRO HA H 103 4.781 4.864 -0.083 1
1 1054 . 1 1 1 A 105 105 PRO CA C 103 62.791 62.300 0.491 1
1 1055 . 1 1 1 A 105 105 PRO CB C 103 30.405 31.660 -1.255 1
1 1058 . 1 1 1 A 106 106 ILE H H 104 8.261 8.867 -0.606 1
1 1059 . 1 1 1 A 106 106 ILE HA H 104 4.680 4.705 -0.025 1
1 1069 . 1 1 1 A 106 106 ILE C C 104 175.543 173.849 1.694 1
1 1070 . 1 1 1 A 106 106 ILE CA C 104 59.362 59.935 -0.573 1
1 1071 . 1 1 1 A 106 106 ILE CB C 104 43.738 40.281 3.457 1
1 1075 . 1 1 1 A 106 106 ILE N N 104 123.509 124.061 -0.552 1
1 1076 . 1 1 1 A 107 107 LEU H H 105 8.584 8.640 -0.056 1
1 1077 . 1 1 1 A 107 107 LEU HA H 105 4.243 4.756 -0.513 1
1 1087 . 1 1 1 A 107 107 LEU C C 105 174.204 174.595 -0.391 1
1 1088 . 1 1 1 A 107 107 LEU CA C 105 52.863 52.969 -0.106 1
1 1089 . 1 1 1 A 107 107 LEU CB C 105 42.408 44.303 -1.895 1
1 1093 . 1 1 1 A 107 107 LEU N N 105 131.882 129.695 2.187 1
1 1094 . 1 1 1 A 108 108 CYS H H 106 8.679 9.211 -0.532 1
1 1095 . 1 1 1 A 108 108 CYS HA H 106 5.280 5.332 -0.052 1
1 1099 . 1 1 1 A 108 108 CYS C C 106 173.134 173.280 -0.146 1
1 1100 . 1 1 1 A 108 108 CYS CA C 106 57.290 56.857 0.433 1
1 1101 . 1 1 1 A 108 108 CYS CB C 106 29.559 30.295 -0.736 1
1 1102 . 1 1 1 A 108 108 CYS N N 106 122.904 125.315 -2.411 1
1 1103 . 1 1 1 A 109 109 LEU H H 107 8.987 8.753 0.234 1
1 1104 . 1 1 1 A 109 109 LEU HA H 107 5.120 5.553 -0.433 1
1 1112 . 1 1 1 A 109 109 LEU C C 107 174.500 175.488 -0.988 1
1 1113 . 1 1 1 A 109 109 LEU CA C 107 53.274 53.587 -0.313 1
1 1114 . 1 1 1 A 109 109 LEU CB C 107 43.450 44.710 -1.260 1
1 1118 . 1 1 1 A 109 109 LEU N N 107 124.653 124.032 0.621 1
1 1119 . 1 1 1 A 110 110 PHE H H 108 8.981 9.182 -0.201 1
1 1120 . 1 1 1 A 110 110 PHE HA H 108 4.846 6.192 -1.346 1
1 1125 . 1 1 1 A 110 110 PHE C C 108 172.231 173.373 -1.142 1
1 1126 . 1 1 1 A 110 110 PHE CA C 108 55.963 56.477 -0.514 1
1 1127 . 1 1 1 A 110 110 PHE CB C 108 43.270 42.966 0.304 1
1 1130 . 1 1 1 A 110 110 PHE N N 108 125.052 125.287 -0.235 1
1 1131 . 1 1 1 A 111 111 ARG H H 109 7.461 8.587 -1.126 1
1 1132 . 1 1 1 A 111 111 ARG HA H 109 4.804 4.575 0.229 1
1 1136 . 1 1 1 A 111 111 ARG CA C 109 51.953 51.943 0.010 1
1 1137 . 1 1 1 A 111 111 ARG CB C 109 30.008 30.440 -0.432 1
1 1140 . 1 1 1 A 111 111 ARG N N 109 128.034 126.705 1.329 1
1 1141 . 1 1 1 A 112 112 PRO C C 110 178.675 177.478 1.197 1
1 1142 . 1 1 1 A 112 112 PRO CA C 110 64.024 64.205 -0.181 1
1 1143 . 1 1 1 A 112 112 PRO CB C 110 31.416 32.033 -0.617 1
1 1144 . 1 1 1 A 113 113 GLN H H 111 8.188 8.658 -0.470 1
1 1145 . 1 1 1 A 113 113 GLN HA H 111 4.056 4.027 0.029 1
1 1149 . 1 1 1 A 113 113 GLN C C 111 175.936 177.444 -1.508 1
1 1150 . 1 1 1 A 113 113 GLN CA C 111 57.144 58.238 -1.094 1
1 1151 . 1 1 1 A 113 113 GLN CB C 111 28.033 27.967 0.066 1
1 1153 . 1 1 1 A 113 113 GLN N N 111 118.835 117.612 1.223 1
1 1154 . 1 1 1 A 114 114 SER H H 112 7.730 7.594 0.136 1
1 1155 . 1 1 1 A 114 114 SER HA H 112 4.037 4.547 -0.510 1
1 1158 . 1 1 1 A 114 114 SER C C 112 175.750 174.495 1.255 1
1 1159 . 1 1 1 A 114 114 SER CA C 112 60.154 58.492 1.662 1
1 1160 . 1 1 1 A 114 114 SER CB C 112 64.282 64.320 -0.038 1
1 1161 . 1 1 1 A 114 114 SER N N 112 114.887 114.360 0.527 1
1 1162 . 1 1 1 A 115 115 GLY H H 113 8.005 7.974 0.031 1
1 1163 . 1 1 1 A 115 115 GLY HA2 H 113 3.712 4.004 -0.292 1
1 1164 . 1 1 1 A 115 115 GLY HA3 H 113 4.130 4.196 -0.066 1
1 1165 . 1 1 1 A 115 115 GLY C C 113 173.945 175.586 -1.641 1
1 1166 . 1 1 1 A 115 115 GLY CA C 113 45.233 47.326 -2.093 1
1 1167 . 1 1 1 A 115 115 GLY N N 113 110.740 109.542 1.198 1
1 1168 . 1 1 1 A 116 116 ARG H H 114 7.665 8.578 -0.913 1
1 1169 . 1 1 1 A 116 116 ARG HA H 114 4.449 4.536 -0.087 1
1 1173 . 1 1 1 A 116 116 ARG C C 114 175.370 175.247 0.123 1
1 1174 . 1 1 1 A 116 116 ARG CA C 114 55.080 55.711 -0.631 1
1 1175 . 1 1 1 A 116 116 ARG CB C 114 31.215 29.831 1.384 1
1 1178 . 1 1 1 A 116 116 ARG N N 114 119.983 118.518 1.465 1
1 1179 . 1 1 1 A 117 117 VAL H H 115 8.409 8.111 0.298 1
1 1180 . 1 1 1 A 117 117 VAL HA H 115 4.184 3.537 0.647 1
1 1188 . 1 1 1 A 117 117 VAL C C 115 175.980 174.701 1.279 1
1 1189 . 1 1 1 A 117 117 VAL CA C 115 61.167 62.083 -0.916 1
1 1190 . 1 1 1 A 117 117 VAL CB C 115 32.931 30.840 2.091 1
1 1193 . 1 1 1 A 117 117 VAL N N 115 122.240 116.085 6.155 1
1 1194 . 1 1 1 A 118 118 LEU H H 116 8.227 7.314 0.913 1
1 1195 . 1 1 1 A 118 118 LEU HA H 116 3.720 4.243 -0.523 1
1 1204 . 1 1 1 A 118 118 LEU C C 116 175.623 176.924 -1.301 1
1 1205 . 1 1 1 A 118 118 LEU CA C 116 54.555 55.542 -0.987 1
1 1206 . 1 1 1 A 118 118 LEU CB C 116 39.292 43.219 -3.927 1
1 1210 . 1 1 1 A 118 118 LEU N N 116 131.481 129.249 2.232 1
1 1211 . 1 1 1 A 119 119 SER H H 117 7.780 8.602 -0.822 1
1 1212 . 1 1 1 A 119 119 SER HA H 117 4.060 4.400 -0.340 1
1 1214 . 1 1 1 A 119 119 SER C C 117 175.782 175.455 0.327 1
1 1215 . 1 1 1 A 119 119 SER CA C 117 58.530 60.293 -1.763 1
1 1216 . 1 1 1 A 119 119 SER CB C 117 64.785 64.036 0.749 1
1 1217 . 1 1 1 A 119 119 SER N N 117 118.658 120.729 -2.071 1
1 1218 . 1 1 1 A 120 120 ALA H H 118 8.955 8.944 0.011 1
1 1219 . 1 1 1 A 120 120 ALA HA H 118 3.846 3.911 -0.065 1
1 1223 . 1 1 1 A 120 120 ALA C C 118 179.731 179.850 -0.119 1
1 1224 . 1 1 1 A 120 120 ALA CA C 118 54.927 55.127 -0.200 1
1 1225 . 1 1 1 A 120 120 ALA CB C 118 18.627 18.402 0.225 1
1 1226 . 1 1 1 A 120 120 ALA N N 118 134.119 127.302 6.817 1
1 1227 . 1 1 1 A 121 121 MET H H 119 7.718 8.071 -0.353 1
1 1228 . 1 1 1 A 121 121 MET HA H 119 4.130 4.200 -0.070 1
1 1235 . 1 1 1 A 121 121 MET C C 119 175.610 178.560 -2.950 1
1 1236 . 1 1 1 A 121 121 MET CA C 119 55.968 58.416 -2.448 1
1 1237 . 1 1 1 A 121 121 MET CB C 119 30.814 33.034 -2.220 1
1 1240 . 1 1 1 A 121 121 MET N N 119 115.424 116.461 -1.037 1
1 1241 . 1 1 1 A 122 122 ILE H H 120 6.451 8.140 -1.689 1
1 1242 . 1 1 1 A 122 122 ILE HA H 120 3.392 3.714 -0.322 1
1 1252 . 1 1 1 A 122 122 ILE C C 120 177.108 178.137 -1.029 1
1 1253 . 1 1 1 A 122 122 ILE CA C 120 59.650 65.061 -5.411 1
1 1254 . 1 1 1 A 122 122 ILE CB C 120 34.640 37.879 -3.239 1
1 1258 . 1 1 1 A 122 122 ILE N N 120 113.418 119.355 -5.937 1
1 1259 . 1 1 1 A 123 123 ARG H H 121 7.540 8.624 -1.084 1
1 1260 . 1 1 1 A 123 123 ARG HA H 121 3.551 3.964 -0.413 1
1 1264 . 1 1 1 A 123 123 ARG C C 121 179.642 178.862 0.780 1
1 1265 . 1 1 1 A 123 123 ARG CA C 121 59.242 59.780 -0.538 1
1 1266 . 1 1 1 A 123 123 ARG CB C 121 29.087 29.610 -0.523 1
1 1269 . 1 1 1 A 123 123 ARG N N 121 116.248 120.871 -4.623 1
1 1270 . 1 1 1 A 124 124 GLY H H 122 8.086 8.979 -0.893 1
1 1271 . 1 1 1 A 124 124 GLY C C 122 172.357 176.237 -3.880 1
1 1272 . 1 1 1 A 124 124 GLY CA C 122 44.836 46.885 -2.049 1
1 1273 . 1 1 1 A 124 124 GLY N N 122 104.381 107.566 -3.185 1
1 1274 . 1 1 1 A 125 125 ALA H H 123 6.411 8.158 -1.747 1
1 1275 . 1 1 1 A 125 125 ALA HA H 123 2.441 4.038 -1.597 1
1 1279 . 1 1 1 A 125 125 ALA C C 123 176.908 178.738 -1.830 1
1 1280 . 1 1 1 A 125 125 ALA CA C 123 51.593 53.896 -2.303 1
1 1281 . 1 1 1 A 125 125 ALA CB C 123 16.997 18.017 -1.020 1
1 1282 . 1 1 1 A 125 125 ALA N N 123 123.136 123.760 -0.624 1
1 1283 . 1 1 1 A 126 126 ALA H H 124 6.190 7.783 -1.593 1
1 1284 . 1 1 1 A 126 126 ALA HA H 124 3.829 4.524 -0.695 1
1 1288 . 1 1 1 A 126 126 ALA C C 124 177.535 176.795 0.740 1
1 1289 . 1 1 1 A 126 126 ALA CA C 124 52.403 52.980 -0.577 1
1 1290 . 1 1 1 A 126 126 ALA CB C 124 18.375 19.224 -0.849 1
1 1291 . 1 1 1 A 126 126 ALA N N 124 117.999 121.845 -3.846 1
1 1292 . 1 1 1 A 127 127 ASP H H 125 8.877 9.192 -0.315 1
1 1293 . 1 1 1 A 127 127 ASP HA H 125 4.665 4.937 -0.272 1
1 1296 . 1 1 1 A 127 127 ASP C C 125 177.795 177.044 0.751 1
1 1297 . 1 1 1 A 127 127 ASP CA C 125 52.855 54.123 -1.268 1
1 1298 . 1 1 1 A 127 127 ASP CB C 125 41.814 42.277 -0.463 1
1 1299 . 1 1 1 A 127 127 ASP N N 125 121.828 124.056 -2.228 1
1 1300 . 1 1 1 A 128 128 GLY H H 126 7.954 8.306 -0.352 1
1 1301 . 1 1 1 A 128 128 GLY HA2 H 126 3.830 3.996 -0.166 1
1 1302 . 1 1 1 A 128 128 GLY HA3 H 126 4.249 4.024 0.225 1
1 1303 . 1 1 1 A 128 128 GLY C C 126 173.822 175.051 -1.229 1
1 1304 . 1 1 1 A 128 128 GLY CA C 126 45.549 46.730 -1.181 1
1 1305 . 1 1 1 A 128 128 GLY N N 126 108.814 109.957 -1.143 1
1 1306 . 1 1 1 A 129 129 SER H H 127 8.547 7.753 0.794 1
1 1307 . 1 1 1 A 129 129 SER HA H 127 4.486 4.819 -0.333 1
1 1309 . 1 1 1 A 129 129 SER C C 127 174.178 174.507 -0.329 1
1 1310 . 1 1 1 A 129 129 SER CA C 127 58.653 56.627 2.026 1
1 1311 . 1 1 1 A 129 129 SER CB C 127 63.316 63.175 0.141 1
1 1312 . 1 1 1 A 129 129 SER N N 127 115.599 113.076 2.523 1
1 1313 . 1 1 1 A 130 130 ARG H H 128 8.795 8.249 0.546 1
1 1314 . 1 1 1 A 130 130 ARG HA H 128 4.160 4.014 0.146 1
1 1318 . 1 1 1 A 130 130 ARG C C 128 175.518 174.832 0.686 1
1 1319 . 1 1 1 A 130 130 ARG CA C 128 58.479 58.187 0.292 1
1 1320 . 1 1 1 A 130 130 ARG CB C 128 29.952 28.142 1.810 1
1 1323 . 1 1 1 A 130 130 ARG N N 128 127.611 114.751 12.860 1
1 1324 . 1 1 1 A 131 131 PHE H H 129 9.315 8.110 1.205 1
1 1325 . 1 1 1 A 131 131 PHE HA H 129 4.878 5.109 -0.231 1
1 1331 . 1 1 1 A 131 131 PHE C C 129 175.058 174.466 0.592 1
1 1332 . 1 1 1 A 131 131 PHE CA C 129 55.953 56.738 -0.785 1
1 1333 . 1 1 1 A 131 131 PHE CB C 129 40.189 40.728 -0.539 1
1 1337 . 1 1 1 A 131 131 PHE N N 129 126.219 121.270 4.949 1
1 1338 . 1 1 1 A 132 132 GLN H H 130 8.160 7.960 0.200 1
1 1339 . 1 1 1 A 132 132 GLN HA H 130 5.013 4.798 0.215 1
1 1343 . 1 1 1 A 132 132 GLN CA C 130 54.498 54.377 0.121 1
1 1344 . 1 1 1 A 132 132 GLN CB C 130 32.106 33.155 -1.049 1
1 1346 . 1 1 1 A 132 132 GLN N N 130 125.589 125.381 0.208 1
1 1347 . 1 1 1 A 133 133 VAL H H 131 8.689 8.895 -0.206 1
1 1348 . 1 1 1 A 133 133 VAL HA H 131 4.529 4.440 0.089 1
1 1356 . 1 1 1 A 133 133 VAL C C 131 174.441 175.434 -0.993 1
1 1357 . 1 1 1 A 133 133 VAL CA C 131 60.758 61.528 -0.770 1
1 1358 . 1 1 1 A 133 133 VAL CB C 131 32.417 32.224 0.193 1
1 1361 . 1 1 1 A 133 133 VAL N N 131 122.441 122.661 -0.220 1
1 1362 . 1 1 1 A 134 134 TRP H H 132 9.256 9.216 0.040 1
1 1363 . 1 1 1 A 134 134 TRP HA H 132 5.213 5.135 0.078 1
1 1371 . 1 1 1 A 134 134 TRP C C 132 174.575 176.051 -1.476 1
1 1372 . 1 1 1 A 134 134 TRP CA C 132 53.859 56.744 -2.885 1
1 1373 . 1 1 1 A 134 134 TRP CB C 132 31.311 31.552 -0.241 1
1 1379 . 1 1 1 A 134 134 TRP N N 132 130.303 128.132 2.171 1
1 1381 . 1 1 1 A 135 135 ASP H H 133 8.237 8.922 -0.685 1
1 1382 . 1 1 1 A 135 135 ASP HA H 133 6.018 5.877 0.141 1
1 1385 . 1 1 1 A 135 135 ASP C C 133 177.020 175.303 1.717 1
1 1386 . 1 1 1 A 135 135 ASP CA C 133 53.321 53.124 0.197 1
1 1387 . 1 1 1 A 135 135 ASP CB C 133 41.514 43.277 -1.763 1
1 1388 . 1 1 1 A 135 135 ASP N N 133 125.516 121.623 3.893 1
1 1389 . 1 1 1 A 136 136 TYR H H 134 9.058 8.347 0.711 1
1 1390 . 1 1 1 A 136 136 TYR HA H 134 4.970 5.206 -0.236 1
1 1394 . 1 1 1 A 136 136 TYR C C 134 172.324 172.955 -0.631 1
1 1395 . 1 1 1 A 136 136 TYR CA C 134 55.982 56.440 -0.458 1
1 1396 . 1 1 1 A 136 136 TYR CB C 134 42.265 40.380 1.885 1
1 1399 . 1 1 1 A 136 136 TYR N N 134 120.315 117.699 2.616 1
1 1400 . 1 1 1 A 137 137 ALA H H 135 8.521 8.482 0.039 1
1 1401 . 1 1 1 A 137 137 ALA HA H 135 4.280 4.193 0.087 1
1 1405 . 1 1 1 A 137 137 ALA C C 135 178.561 177.319 1.242 1
1 1406 . 1 1 1 A 137 137 ALA CA C 135 49.550 50.964 -1.414 1
1 1407 . 1 1 1 A 137 137 ALA CB C 135 19.998 22.063 -2.065 1
1 1408 . 1 1 1 A 137 137 ALA N N 135 123.386 121.651 1.735 1
1 1409 . 1 1 1 A 138 138 GLU H H 136 8.678 8.885 -0.207 1
1 1410 . 1 1 1 A 138 138 GLU HA H 136 3.777 4.109 -0.332 1
1 1414 . 1 1 1 A 138 138 GLU C C 136 177.624 177.832 -0.208 1
1 1415 . 1 1 1 A 138 138 GLU CA C 136 60.527 59.165 1.362 1
1 1416 . 1 1 1 A 138 138 GLU CB C 136 29.020 29.280 -0.260 1
1 1418 . 1 1 1 A 138 138 GLU N N 136 121.774 120.656 1.118 1
1 1419 . 1 1 1 A 139 139 GLY H H 137 8.666 8.320 0.346 1
1 1420 . 1 1 1 A 139 139 GLY HA2 H 137 3.872 3.952 -0.080 1
1 1421 . 1 1 1 A 139 139 GLY HA3 H 137 3.872 3.962 -0.090 1
1 1422 . 1 1 1 A 139 139 GLY C C 137 175.122 174.557 0.565 1
1 1423 . 1 1 1 A 139 139 GLY CA C 137 46.093 45.856 0.237 1
1 1424 . 1 1 1 A 139 139 GLY N N 137 106.053 108.380 -2.327 1
1 1425 . 1 1 1 A 140 140 GLU H H 138 8.305 9.477 -1.172 1
1 1426 . 1 1 1 A 140 140 GLU HA H 138 4.754 4.702 0.052 1
1 1430 . 1 1 1 A 140 140 GLU C C 138 177.819 177.735 0.084 1
1 1431 . 1 1 1 A 140 140 GLU CA C 138 55.049 55.691 -0.642 1
1 1432 . 1 1 1 A 140 140 GLU CB C 138 30.504 30.710 -0.206 1
1 1434 . 1 1 1 A 140 140 GLU N N 138 117.485 116.934 0.551 1
1 1435 . 1 1 1 A 141 141 VAL H H 139 7.267 7.534 -0.267 1
1 1436 . 1 1 1 A 141 141 VAL HA H 139 3.422 3.912 -0.490 1
1 1444 . 1 1 1 A 141 141 VAL C C 139 175.454 177.213 -1.759 1
1 1445 . 1 1 1 A 141 141 VAL CA C 139 66.769 65.010 1.759 1
1 1446 . 1 1 1 A 141 141 VAL CB C 139 31.377 31.414 -0.037 1
1 1449 . 1 1 1 A 141 141 VAL N N 139 120.764 121.124 -0.360 1
1 1450 . 1 1 1 A 142 142 GLU H H 140 8.620 8.288 0.332 1
1 1451 . 1 1 1 A 142 142 GLU HA H 140 3.592 3.993 -0.401 1
1 1452 . 1 1 1 A 142 142 GLU C C 140 177.320 179.633 -2.313 1
1 1453 . 1 1 1 A 142 142 GLU CA C 140 62.607 59.366 3.241 1
1 1454 . 1 1 1 A 142 142 GLU CB C 140 26.759 29.116 -2.357 1
1 1455 . 1 1 1 A 142 142 GLU N N 140 120.048 121.844 -1.796 1
1 1456 . 1 1 1 A 143 143 THR H H 141 7.449 8.051 -0.602 1
1 1457 . 1 1 1 A 143 143 THR HA H 141 4.003 3.991 0.012 1
1 1462 . 1 1 1 A 143 143 THR C C 141 177.258 175.565 1.693 1
1 1463 . 1 1 1 A 143 143 THR CA C 141 65.490 67.309 -1.819 1
1 1464 . 1 1 1 A 143 143 THR CB C 141 68.641 68.242 0.399 1
1 1466 . 1 1 1 A 143 143 THR N N 141 114.073 118.675 -4.602 1
1 1467 . 1 1 1 A 144 144 MET H H 142 7.992 8.238 -0.246 1
1 1468 . 1 1 1 A 144 144 MET HA H 142 4.316 4.345 -0.029 1
1 1476 . 1 1 1 A 144 144 MET C C 142 178.233 178.927 -0.694 1
1 1477 . 1 1 1 A 144 144 MET CA C 142 57.743 58.880 -1.137 1
1 1478 . 1 1 1 A 144 144 MET CB C 142 31.326 32.145 -0.819 1
1 1481 . 1 1 1 A 144 144 MET N N 142 120.595 119.183 1.412 1
1 1482 . 1 1 1 A 145 145 LEU H H 143 7.847 8.134 -0.287 1
1 1483 . 1 1 1 A 145 145 LEU HA H 143 3.919 3.863 0.056 1
1 1491 . 1 1 1 A 145 145 LEU C C 143 178.774 179.223 -0.449 1
1 1492 . 1 1 1 A 145 145 LEU CA C 143 57.877 58.044 -0.167 1
1 1493 . 1 1 1 A 145 145 LEU CB C 143 40.951 40.868 0.083 1
1 1497 . 1 1 1 A 145 145 LEU N N 143 119.410 119.977 -0.567 1
1 1498 . 1 1 1 A 146 146 ASP H H 144 8.431 8.841 -0.410 1
1 1499 . 1 1 1 A 146 146 ASP HA H 144 4.312 4.602 -0.290 1
1 1502 . 1 1 1 A 146 146 ASP C C 144 178.129 178.903 -0.774 1
1 1503 . 1 1 1 A 146 146 ASP CA C 144 57.464 58.090 -0.626 1
1 1504 . 1 1 1 A 146 146 ASP CB C 144 39.548 41.273 -1.725 1
1 1505 . 1 1 1 A 146 146 ASP N N 144 119.837 120.073 -0.236 1
1 1506 . 1 1 1 A 147 147 ARG H H 145 7.949 8.605 -0.656 1
1 1507 . 1 1 1 A 147 147 ARG HA H 145 4.050 4.152 -0.102 1
1 1512 . 1 1 1 A 147 147 ARG C C 145 179.547 178.921 0.626 1
1 1513 . 1 1 1 A 147 147 ARG CA C 145 58.972 59.862 -0.890 1
1 1514 . 1 1 1 A 147 147 ARG CB C 145 29.798 30.436 -0.638 1
1 1517 . 1 1 1 A 147 147 ARG N N 145 119.173 119.218 -0.045 1
1 1518 . 1 1 1 A 148 148 TYR H H 146 8.128 8.230 -0.102 1
1 1519 . 1 1 1 A 148 148 TYR HA H 146 3.995 4.425 -0.430 1
1 1524 . 1 1 1 A 148 148 TYR C C 146 178.199 177.611 0.588 1
1 1525 . 1 1 1 A 148 148 TYR CA C 146 62.347 61.515 0.832 1
1 1526 . 1 1 1 A 148 148 TYR CB C 146 37.418 37.881 -0.463 1
1 1529 . 1 1 1 A 148 148 TYR N N 146 120.102 121.287 -1.185 1
1 1530 . 1 1 1 A 149 149 PHE H H 147 8.308 8.903 -0.595 1
1 1531 . 1 1 1 A 149 149 PHE HA H 147 4.013 4.468 -0.455 1
1 1535 . 1 1 1 A 149 149 PHE C C 147 177.574 178.512 -0.938 1
1 1536 . 1 1 1 A 149 149 PHE CA C 147 63.044 61.890 1.154 1
1 1537 . 1 1 1 A 149 149 PHE CB C 147 37.153 38.336 -1.183 1
1 1541 . 1 1 1 A 149 149 PHE N N 147 116.680 118.523 -1.843 1
1 1542 . 1 1 1 A 150 150 GLU H H 148 8.271 9.244 -0.973 1
1 1543 . 1 1 1 A 150 150 GLU HA H 148 4.030 4.035 -0.005 1
1 1547 . 1 1 1 A 150 150 GLU C C 148 177.687 178.326 -0.639 1
1 1548 . 1 1 1 A 150 150 GLU CA C 148 58.746 59.932 -1.186 1
1 1549 . 1 1 1 A 150 150 GLU CB C 148 28.847 29.273 -0.426 1
1 1551 . 1 1 1 A 150 150 GLU N N 148 119.973 119.706 0.267 1
1 1552 . 1 1 1 A 151 151 ALA H H 149 6.992 7.786 -0.794 1
1 1553 . 1 1 1 A 151 151 ALA HA H 149 4.217 4.245 -0.028 1
1 1557 . 1 1 1 A 151 151 ALA C C 149 178.190 176.831 1.359 1
1 1558 . 1 1 1 A 151 151 ALA CA C 149 52.779 52.934 -0.155 1
1 1559 . 1 1 1 A 151 151 ALA CB C 149 19.087 18.010 1.077 1
1 1560 . 1 1 1 A 151 151 ALA N N 149 118.629 121.528 -2.899 1
1 1561 . 1 1 1 A 152 152 TYR H H 150 7.722 8.654 -0.932 1
1 1562 . 1 1 1 A 152 152 TYR HA H 150 4.137 4.753 -0.616 1
1 1567 . 1 1 1 A 152 152 TYR C C 150 175.703 175.298 0.405 1
1 1568 . 1 1 1 A 152 152 TYR CA C 150 59.260 58.917 0.343 1
1 1569 . 1 1 1 A 152 152 TYR CB C 150 39.165 38.765 0.400 1
1 1572 . 1 1 1 A 152 152 TYR N N 150 118.767 118.407 0.360 1
1 1573 . 1 1 1 A 153 153 LEU H H 151 7.670 8.857 -1.187 1
1 1574 . 1 1 1 A 153 153 LEU HA H 151 4.145 4.438 -0.293 1
1 1584 . 1 1 1 A 153 153 LEU CA C 151 54.704 53.981 0.723 1
1 1585 . 1 1 1 A 153 153 LEU CB C 151 40.520 41.784 -1.264 1
1 1589 . 1 1 1 A 153 153 LEU N N 151 122.313 122.475 -0.162 1
1 1590 . 1 1 1 A 154 154 PRO HA H 152 4.258 4.382 -0.124 1
1 1597 . 1 1 1 A 154 154 PRO C C 152 177.496 177.346 0.150 1
1 1598 . 1 1 1 A 154 154 PRO CA C 152 63.899 64.798 -0.899 1
1 1599 . 1 1 1 A 154 154 PRO CB C 152 31.080 31.691 -0.611 1
1 1602 . 1 1 1 A 155 155 GLN H H 153 8.023 8.592 -0.569 1
1 1603 . 1 1 1 A 155 155 GLN HA H 153 4.176 4.391 -0.215 1
1 1607 . 1 1 1 A 155 155 GLN C C 153 176.636 177.446 -0.810 1
1 1608 . 1 1 1 A 155 155 GLN CA C 153 55.968 56.590 -0.622 1
1 1609 . 1 1 1 A 155 155 GLN CB C 153 28.723 29.570 -0.847 1
1 1610 . 1 1 1 A 155 155 GLN N N 153 119.173 117.165 2.008 1
1 1611 . 1 1 1 A 156 156 LYS H H 154 8.113 8.028 0.085 1
1 1612 . 1 1 1 A 156 156 LYS HA H 154 4.196 4.067 0.129 1
1 1619 . 1 1 1 A 156 156 LYS C C 154 56.493 178.942 -122.449 1
1 1620 . 1 1 1 A 156 156 LYS CA C 154 56.493 59.110 -2.617 1
1 1621 . 1 1 1 A 156 156 LYS CB C 154 32.037 32.040 -0.003 1
1 1625 . 1 1 1 A 156 156 LYS N N 154 122.788 120.620 2.168 1
1 1626 . 1 1 1 A 157 157 THR H H 155 8.013 7.883 0.130 1
1 1627 . 1 1 1 A 157 157 THR HA H 155 4.183 3.957 0.226 1
1 1632 . 1 1 1 A 157 157 THR C C 155 174.580 174.281 0.299 1
1 1633 . 1 1 1 A 157 157 THR CA C 155 61.958 65.718 -3.760 1
1 1634 . 1 1 1 A 157 157 THR CB C 155 69.665 69.209 0.456 1
1 1636 . 1 1 1 A 157 157 THR N N 155 115.504 114.569 0.935 1
1 1637 . 1 1 1 A 158 158 ALA H H 156 8.170 7.195 0.975 1
1 1638 . 1 1 1 A 158 158 ALA HA H 156 4.220 4.637 -0.417 1
1 1642 . 1 1 1 A 158 158 ALA CA C 156 52.492 51.914 0.578 1
1 1643 . 1 1 1 A 158 158 ALA CB C 156 18.810 22.356 -3.546 1
1 1644 . 1 1 1 A 158 158 ALA N N 156 126.825 120.343 6.482 1
1 1645 . 1 1 1 A 159 159 SER H H 157 7.762 8.528 -0.766 1
1 1646 . 1 1 1 A 159 159 SER CA C 157 58.230 56.711 1.519 1
1 1647 . 1 1 1 A 159 159 SER CB C 157 63.440 65.230 -1.790 1
1 1648 . 1 1 1 A 159 159 SER N N 157 123.078 114.518 8.560 1
1 1649 . 1 1 1 A 162 162 HIS HA H 160 4.845 5.198 -0.353 1
1 1652 . 1 1 1 A 162 162 HIS CA C 160 53.590 52.146 1.444 1
1 1653 . 1 1 1 A 162 162 HIS CB C 160 29.398 29.350 0.048 1
1 1654 . 1 1 1 A 163 163 PRO HA H 161 4.388 4.287 0.101 1
1 1660 . 1 1 1 A 163 163 PRO C C 161 177.018 177.207 -0.189 1
1 1661 . 1 1 1 A 163 163 PRO CA C 161 63.118 62.813 0.305 1
1 1662 . 1 1 1 A 163 163 PRO CB C 161 31.668 32.108 -0.440 1
1 1665 . 1 1 1 A 164 164 SER H H 162 8.418 8.196 0.222 1
1 1666 . 1 1 1 A 164 164 SER HA H 162 4.338 4.439 -0.101 1
1 1668 . 1 1 1 A 164 164 SER C C 162 173.327 174.358 -1.031 1
1 1669 . 1 1 1 A 164 164 SER CA C 162 58.202 59.842 -1.640 1
1 1670 . 1 1 1 A 164 164 SER CB C 162 64.080 64.081 -0.001 1
1 1671 . 1 1 1 A 164 164 SER N N 162 117.485 118.310 -0.825 1
1 6 . 2 1 1 A 4 4 ALA H H 2 8.270 8.691 -0.421 1
1 7 . 2 1 1 A 4 4 ALA HA H 2 4.212 4.333 -0.121 1
1 11 . 2 1 1 A 4 4 ALA C C 2 177.441 177.735 -0.294 1
1 12 . 2 1 1 A 4 4 ALA CA C 2 52.280 52.054 0.226 1
1 13 . 2 1 1 A 4 4 ALA CB C 2 18.880 19.286 -0.406 1
1 14 . 2 1 1 A 4 4 ALA N N 2 126.500 127.396 -0.896 1
1 15 . 2 1 1 A 5 5 ALA H H 3 8.251 8.865 -0.614 1
1 16 . 2 1 1 A 5 5 ALA HA H 3 4.261 3.921 0.340 1
1 20 . 2 1 1 A 5 5 ALA C C 3 177.824 177.680 0.144 1
1 21 . 2 1 1 A 5 5 ALA CA C 3 52.347 54.377 -2.030 1
1 22 . 2 1 1 A 5 5 ALA CB C 3 18.869 18.823 0.046 1
1 23 . 2 1 1 A 5 5 ALA N N 3 124.322 126.812 -2.490 1
1 24 . 2 1 1 A 6 6 SER H H 4 8.158 8.044 0.114 1
1 25 . 2 1 1 A 6 6 SER HA H 4 4.358 4.231 0.127 1
1 27 . 2 1 1 A 6 6 SER C C 4 175.222 174.608 0.614 1
1 28 . 2 1 1 A 6 6 SER CA C 4 58.438 59.906 -1.468 1
1 29 . 2 1 1 A 6 6 SER CB C 4 63.859 61.304 2.555 1
1 30 . 2 1 1 A 6 6 SER N N 4 115.338 110.980 4.358 1
1 31 . 2 1 1 A 7 7 GLY H H 5 8.265 8.121 0.144 1
1 32 . 2 1 1 A 7 7 GLY HA2 H 5 3.900 3.854 0.046 1
1 33 . 2 1 1 A 7 7 GLY C C 5 174.083 174.582 -0.499 1
1 34 . 2 1 1 A 7 7 GLY CA C 5 45.113 47.279 -2.166 1
1 35 . 2 1 1 A 7 7 GLY N N 5 111.360 108.189 3.171 1
1 36 . 2 1 1 A 8 8 GLU H H 6 8.100 7.760 0.340 1
1 37 . 2 1 1 A 8 8 GLU HA H 6 4.209 4.297 -0.088 1
1 41 . 2 1 1 A 8 8 GLU C C 6 176.354 176.770 -0.416 1
1 42 . 2 1 1 A 8 8 GLU CA C 6 56.261 56.837 -0.576 1
1 43 . 2 1 1 A 8 8 GLU CB C 6 29.830 29.992 -0.162 1
1 45 . 2 1 1 A 8 8 GLU N N 6 121.056 118.350 2.706 1
1 46 . 2 1 1 A 9 9 GLN H H 7 8.287 8.789 -0.502 1
1 47 . 2 1 1 A 9 9 GLN HA H 7 4.247 4.176 0.071 1
1 51 . 2 1 1 A 9 9 GLN C C 7 172.457 175.727 -3.270 1
1 52 . 2 1 1 A 9 9 GLN CA C 7 55.269 58.241 -2.972 1
1 53 . 2 1 1 A 9 9 GLN CB C 7 29.236 29.475 -0.239 1
1 55 . 2 1 1 A 9 9 GLN N N 7 122.164 122.977 -0.813 1
1 56 . 2 1 1 A 10 10 ALA H H 8 8.368 7.787 0.581 1
1 57 . 2 1 1 A 10 10 ALA HA H 8 4.509 4.780 -0.271 1
1 61 . 2 1 1 A 10 10 ALA CA C 8 50.341 49.877 0.464 1
1 62 . 2 1 1 A 10 10 ALA CB C 8 18.140 20.789 -2.649 1
1 63 . 2 1 1 A 10 10 ALA N N 8 128.028 119.460 8.568 1
1 64 . 2 1 1 A 11 11 PRO HA H 9 4.437 4.530 -0.093 1
1 70 . 2 1 1 A 11 11 PRO C C 9 176.381 176.210 0.171 1
1 71 . 2 1 1 A 11 11 PRO CA C 9 63.298 62.422 0.876 1
1 72 . 2 1 1 A 11 11 PRO CB C 9 31.776 33.328 -1.552 1
1 75 . 2 1 1 A 12 12 CYS H H 10 8.056 8.325 -0.269 1
1 76 . 2 1 1 A 12 12 CYS HA H 10 4.717 5.140 -0.423 1
1 79 . 2 1 1 A 12 12 CYS C C 10 173.266 172.877 0.389 1
1 80 . 2 1 1 A 12 12 CYS CA C 10 57.398 57.118 0.280 1
1 81 . 2 1 1 A 12 12 CYS CB C 10 29.165 31.284 -2.119 1
1 82 . 2 1 1 A 12 12 CYS N N 10 118.295 117.260 1.035 1
1 83 . 2 1 1 A 13 13 SER H H 11 9.815 9.073 0.742 1
1 84 . 2 1 1 A 13 13 SER HA H 11 5.227 5.652 -0.425 1
1 87 . 2 1 1 A 13 13 SER C C 11 173.648 173.403 0.245 1
1 88 . 2 1 1 A 13 13 SER CA C 11 57.630 56.317 1.313 1
1 89 . 2 1 1 A 13 13 SER CB C 11 64.820 66.356 -1.536 1
1 90 . 2 1 1 A 13 13 SER N N 11 122.365 117.194 5.171 1
1 91 . 2 1 1 A 14 14 VAL H H 12 9.352 9.193 0.159 1
1 92 . 2 1 1 A 14 14 VAL HA H 12 4.696 5.517 -0.821 1
1 100 . 2 1 1 A 14 14 VAL C C 12 173.875 173.366 0.509 1
1 101 . 2 1 1 A 14 14 VAL CA C 12 60.146 61.410 -1.264 1
1 102 . 2 1 1 A 14 14 VAL CB C 12 34.499 35.110 -0.611 1
1 105 . 2 1 1 A 14 14 VAL N N 12 126.378 123.140 3.238 1
1 106 . 2 1 1 A 15 15 TYR H H 13 8.745 9.471 -0.726 1
1 111 . 2 1 1 A 15 15 TYR C C 13 173.345 174.100 -0.755 1
1 112 . 2 1 1 A 15 15 TYR CA C 13 56.186 57.291 -1.105 1
1 113 . 2 1 1 A 15 15 TYR CB C 13 40.858 40.480 0.378 1
1 116 . 2 1 1 A 15 15 TYR N N 13 129.472 128.584 0.888 1
1 117 . 2 1 1 A 16 16 PHE H H 14 7.370 8.477 -1.107 1
1 118 . 2 1 1 A 16 16 PHE HA H 14 5.720 5.047 0.673 1
1 123 . 2 1 1 A 16 16 PHE C C 14 174.058 174.233 -0.175 1
1 124 . 2 1 1 A 16 16 PHE CA C 14 54.361 56.380 -2.019 1
1 125 . 2 1 1 A 16 16 PHE CB C 14 40.461 41.942 -1.481 1
1 129 . 2 1 1 A 16 16 PHE N N 14 128.263 129.671 -1.408 1
1 130 . 2 1 1 A 17 17 CYS H H 15 8.147 8.166 -0.019 1
1 131 . 2 1 1 A 17 17 CYS CA C 15 56.570 57.268 -0.698 1
1 132 . 2 1 1 A 17 17 CYS CB C 15 29.690 31.036 -1.346 1
1 133 . 2 1 1 A 17 17 CYS N N 15 126.188 126.901 -0.713 1
1 134 . 2 1 1 A 18 18 GLY HA2 H 16 3.819 3.927 -0.108 1
1 135 . 2 1 1 A 18 18 GLY C C 16 173.374 173.074 0.300 1
1 136 . 2 1 1 A 18 18 GLY CA C 16 45.510 45.559 -0.049 1
1 137 . 2 1 1 A 19 19 SER H H 17 8.533 8.982 -0.449 1
1 138 . 2 1 1 A 19 19 SER HA H 17 4.505 4.838 -0.333 1
1 139 . 2 1 1 A 19 19 SER CA C 17 58.700 58.059 0.641 1
1 140 . 2 1 1 A 19 19 SER CB C 17 63.810 63.485 0.325 1
1 141 . 2 1 1 A 19 19 SER N N 17 117.300 113.465 3.835 1
1 142 . 2 1 1 A 20 20 ILE HA H 18 4.309 4.683 -0.374 1
1 152 . 2 1 1 A 20 20 ILE CA C 18 61.317 60.855 0.462 1
1 153 . 2 1 1 A 20 20 ILE CB C 18 38.302 40.055 -1.753 1
1 157 . 2 1 1 A 21 21 ARG HA H 19 4.172 4.393 -0.221 1
1 160 . 2 1 1 A 21 21 ARG C C 19 177.118 177.220 -0.102 1
1 161 . 2 1 1 A 21 21 ARG CA C 19 56.960 57.867 -0.907 1
1 162 . 2 1 1 A 21 21 ARG CB C 19 29.568 31.361 -1.793 1
1 165 . 2 1 1 A 22 22 GLY H H 20 8.685 7.971 0.714 1
1 166 . 2 1 1 A 22 22 GLY HA2 H 20 3.801 4.085 -0.284 1
1 167 . 2 1 1 A 22 22 GLY HA3 H 20 3.923 4.102 -0.179 1
1 168 . 2 1 1 A 22 22 GLY C C 20 174.814 174.539 0.275 1
1 169 . 2 1 1 A 22 22 GLY CA C 20 45.289 45.513 -0.224 1
1 170 . 2 1 1 A 22 22 GLY N N 20 110.145 106.523 3.622 1
1 171 . 2 1 1 A 23 23 GLY H H 21 8.058 8.185 -0.127 1
1 172 . 2 1 1 A 23 23 GLY HA2 H 21 3.998 4.068 -0.070 1
1 173 . 2 1 1 A 23 23 GLY HA3 H 21 4.237 4.074 0.163 1
1 174 . 2 1 1 A 23 23 GLY C C 21 174.762 172.935 1.827 1
1 175 . 2 1 1 A 23 23 GLY CA C 21 45.025 44.554 0.471 1
1 176 . 2 1 1 A 23 23 GLY N N 21 109.327 107.591 1.736 1
1 177 . 2 1 1 A 24 24 ARG H H 22 8.376 8.429 -0.053 1
1 178 . 2 1 1 A 24 24 ARG HA H 22 4.086 4.735 -0.649 1
1 184 . 2 1 1 A 24 24 ARG C C 22 178.178 175.897 2.281 1
1 185 . 2 1 1 A 24 24 ARG CA C 22 57.471 54.956 2.515 1
1 186 . 2 1 1 A 24 24 ARG CB C 22 29.653 31.253 -1.600 1
1 189 . 2 1 1 A 24 24 ARG N N 22 120.861 118.271 2.590 1
1 190 . 2 1 1 A 25 25 GLU H H 23 8.831 8.950 -0.119 1
1 191 . 2 1 1 A 25 25 GLU HA H 23 4.015 3.966 0.049 1
1 195 . 2 1 1 A 25 25 GLU C C 23 178.005 178.021 -0.016 1
1 196 . 2 1 1 A 25 25 GLU CA C 23 58.920 59.437 -0.517 1
1 197 . 2 1 1 A 25 25 GLU CB C 23 28.592 29.520 -0.928 1
1 199 . 2 1 1 A 25 25 GLU N N 23 121.243 118.287 2.956 1
1 200 . 2 1 1 A 26 26 ASP H H 24 7.897 8.176 -0.279 1
1 201 . 2 1 1 A 26 26 ASP HA H 24 4.516 4.055 0.461 1
1 203 . 2 1 1 A 26 26 ASP C C 24 176.455 177.994 -1.539 1
1 204 . 2 1 1 A 26 26 ASP CA C 24 55.122 56.166 -1.044 1
1 205 . 2 1 1 A 26 26 ASP CB C 24 39.888 40.175 -0.287 1
1 206 . 2 1 1 A 26 26 ASP N N 24 119.541 120.409 -0.868 1
1 207 . 2 1 1 A 27 27 GLN H H 25 7.696 8.044 -0.348 1
1 208 . 2 1 1 A 27 27 GLN HA H 25 3.704 3.946 -0.242 1
1 212 . 2 1 1 A 27 27 GLN C C 25 177.016 177.990 -0.974 1
1 213 . 2 1 1 A 27 27 GLN CA C 25 59.501 58.654 0.847 1
1 214 . 2 1 1 A 27 27 GLN CB C 25 27.762 28.833 -1.071 1
1 216 . 2 1 1 A 27 27 GLN N N 25 119.471 119.603 -0.132 1
1 217 . 2 1 1 A 28 28 ALA H H 26 8.227 7.517 0.710 1
1 218 . 2 1 1 A 28 28 ALA HA H 26 4.072 3.984 0.088 1
1 222 . 2 1 1 A 28 28 ALA C C 26 180.567 179.932 0.635 1
1 223 . 2 1 1 A 28 28 ALA CA C 26 54.627 55.049 -0.422 1
1 224 . 2 1 1 A 28 28 ALA CB C 26 17.355 18.502 -1.147 1
1 225 . 2 1 1 A 28 28 ALA N N 26 122.362 122.017 0.345 1
1 226 . 2 1 1 A 29 29 LEU H H 27 7.533 7.906 -0.373 1
1 227 . 2 1 1 A 29 29 LEU HA H 27 4.050 4.076 -0.026 1
1 237 . 2 1 1 A 29 29 LEU C C 27 178.752 177.980 0.772 1
1 238 . 2 1 1 A 29 29 LEU CA C 27 57.578 57.685 -0.107 1
1 239 . 2 1 1 A 29 29 LEU CB C 27 40.734 41.713 -0.979 1
1 243 . 2 1 1 A 29 29 LEU N N 27 122.255 119.866 2.389 1
1 244 . 2 1 1 A 30 30 TYR H H 28 8.473 7.997 0.476 1
1 245 . 2 1 1 A 30 30 TYR HA H 28 4.049 4.148 -0.099 1
1 250 . 2 1 1 A 30 30 TYR C C 28 177.736 178.259 -0.523 1
1 251 . 2 1 1 A 30 30 TYR CA C 28 59.817 60.472 -0.655 1
1 252 . 2 1 1 A 30 30 TYR CB C 28 36.140 37.263 -1.123 1
1 255 . 2 1 1 A 30 30 TYR N N 28 120.403 118.456 1.947 1
1 256 . 2 1 1 A 31 31 ALA H H 29 8.008 8.305 -0.297 1
1 257 . 2 1 1 A 31 31 ALA HA H 29 4.005 3.967 0.038 1
1 261 . 2 1 1 A 31 31 ALA C C 29 180.879 179.507 1.372 1
1 262 . 2 1 1 A 31 31 ALA CA C 29 54.914 55.208 -0.294 1
1 263 . 2 1 1 A 31 31 ALA CB C 29 17.375 18.116 -0.741 1
1 264 . 2 1 1 A 31 31 ALA N N 29 120.771 122.904 -2.133 1
1 265 . 2 1 1 A 32 32 ARG H H 30 7.596 7.572 0.024 1
1 266 . 2 1 1 A 32 32 ARG HA H 30 3.916 4.087 -0.171 1
1 273 . 2 1 1 A 32 32 ARG C C 30 179.919 178.628 1.291 1
1 274 . 2 1 1 A 32 32 ARG CA C 30 59.014 59.119 -0.105 1
1 275 . 2 1 1 A 32 32 ARG CB C 30 30.531 29.804 0.727 1
1 278 . 2 1 1 A 32 32 ARG N N 30 120.365 118.199 2.166 1
1 279 . 2 1 1 A 33 33 ILE H H 31 8.066 8.301 -0.235 1
1 280 . 2 1 1 A 33 33 ILE HA H 31 3.120 3.726 -0.606 1
1 290 . 2 1 1 A 33 33 ILE C C 31 177.051 178.537 -1.486 1
1 291 . 2 1 1 A 33 33 ILE CA C 31 65.757 65.093 0.664 1
1 292 . 2 1 1 A 33 33 ILE CB C 31 36.928 37.927 -0.999 1
1 296 . 2 1 1 A 33 33 ILE N N 31 121.608 119.716 1.892 1
1 297 . 2 1 1 A 34 34 VAL H H 32 8.148 9.005 -0.857 1
1 298 . 2 1 1 A 34 34 VAL HA H 32 2.954 3.636 -0.682 1
1 306 . 2 1 1 A 34 34 VAL C C 32 177.159 178.115 -0.956 1
1 307 . 2 1 1 A 34 34 VAL CA C 32 67.220 66.422 0.798 1
1 308 . 2 1 1 A 34 34 VAL CB C 32 31.039 30.922 0.117 1
1 311 . 2 1 1 A 34 34 VAL N N 32 119.318 120.982 -1.664 1
1 312 . 2 1 1 A 35 35 SER H H 33 7.826 8.203 -0.377 1
1 313 . 2 1 1 A 35 35 SER HA H 33 3.868 4.046 -0.178 1
1 316 . 2 1 1 A 35 35 SER C C 33 176.779 176.679 0.100 1
1 317 . 2 1 1 A 35 35 SER CA C 33 62.000 61.815 0.185 1
1 318 . 2 1 1 A 35 35 SER CB C 33 62.789 62.801 -0.012 1
1 319 . 2 1 1 A 35 35 SER N N 33 111.936 116.514 -4.578 1
1 320 . 2 1 1 A 36 36 ARG H H 34 7.405 7.591 -0.186 1
1 321 . 2 1 1 A 36 36 ARG HA H 34 4.070 4.074 -0.004 1
1 323 . 2 1 1 A 36 36 ARG C C 34 178.047 178.342 -0.295 1
1 324 . 2 1 1 A 36 36 ARG CA C 34 56.108 59.031 -2.923 1
1 325 . 2 1 1 A 36 36 ARG CB C 34 28.837 30.108 -1.271 1
1 326 . 2 1 1 A 36 36 ARG N N 34 120.909 122.171 -1.262 1
1 327 . 2 1 1 A 37 37 LEU H H 35 8.301 8.245 0.056 1
1 328 . 2 1 1 A 37 37 LEU HA H 35 3.620 3.692 -0.072 1
1 336 . 2 1 1 A 37 37 LEU C C 35 178.446 179.081 -0.635 1
1 337 . 2 1 1 A 37 37 LEU CA C 35 57.640 57.935 -0.295 1
1 338 . 2 1 1 A 37 37 LEU CB C 35 41.584 41.562 0.022 1
1 342 . 2 1 1 A 37 37 LEU N N 35 118.567 120.019 -1.452 1
1 343 . 2 1 1 A 38 38 ARG H H 36 7.379 8.306 -0.927 1
1 344 . 2 1 1 A 38 38 ARG HA H 36 4.340 3.981 0.359 1
1 350 . 2 1 1 A 38 38 ARG C C 36 177.895 178.689 -0.794 1
1 351 . 2 1 1 A 38 38 ARG CA C 36 57.785 59.057 -1.272 1
1 352 . 2 1 1 A 38 38 ARG CB C 36 29.775 29.648 0.127 1
1 355 . 2 1 1 A 38 38 ARG N N 36 115.352 119.426 -4.074 1
1 356 . 2 1 1 A 39 39 ARG H H 37 7.240 7.724 -0.484 1
1 357 . 2 1 1 A 39 39 ARG HA H 37 3.743 4.137 -0.394 1
1 363 . 2 1 1 A 39 39 ARG C C 37 176.988 178.772 -1.784 1
1 364 . 2 1 1 A 39 39 ARG CA C 37 57.605 58.616 -1.011 1
1 365 . 2 1 1 A 39 39 ARG CB C 37 28.925 30.566 -1.641 1
1 368 . 2 1 1 A 39 39 ARG N N 37 117.410 118.933 -1.523 1
1 369 . 2 1 1 A 40 40 TYR H H 38 7.296 8.357 -1.061 1
1 370 . 2 1 1 A 40 40 TYR HA H 38 4.319 4.136 0.183 1
1 375 . 2 1 1 A 40 40 TYR C C 38 175.001 176.273 -1.272 1
1 376 . 2 1 1 A 40 40 TYR CA C 38 57.730 60.184 -2.454 1
1 377 . 2 1 1 A 40 40 TYR CB C 38 39.343 37.890 1.453 1
1 380 . 2 1 1 A 40 40 TYR N N 38 116.937 118.878 -1.941 1
1 381 . 2 1 1 A 41 41 GLY H H 39 7.325 7.575 -0.250 1
1 382 . 2 1 1 A 41 41 GLY HA2 H 39 3.953 4.064 -0.111 1
1 383 . 2 1 1 A 41 41 GLY C C 39 171.302 172.179 -0.877 1
1 384 . 2 1 1 A 41 41 GLY CA C 39 45.590 45.589 0.001 1
1 385 . 2 1 1 A 41 41 GLY N N 39 105.596 104.452 1.144 1
1 386 . 2 1 1 A 42 42 LYS H H 40 8.186 8.927 -0.741 1
1 387 . 2 1 1 A 42 42 LYS HA H 40 4.205 4.540 -0.335 1
1 393 . 2 1 1 A 42 42 LYS C C 40 175.672 175.450 0.222 1
1 394 . 2 1 1 A 42 42 LYS CA C 40 55.241 55.577 -0.336 1
1 395 . 2 1 1 A 42 42 LYS CB C 40 32.889 33.525 -0.636 1
1 399 . 2 1 1 A 42 42 LYS N N 40 120.341 122.045 -1.704 1
1 400 . 2 1 1 A 43 43 VAL H H 41 8.610 8.594 0.016 1
1 401 . 2 1 1 A 43 43 VAL HA H 41 4.416 4.578 -0.162 1
1 409 . 2 1 1 A 43 43 VAL C C 41 175.997 175.416 0.581 1
1 410 . 2 1 1 A 43 43 VAL CA C 41 61.331 62.148 -0.817 1
1 411 . 2 1 1 A 43 43 VAL CB C 41 30.573 31.907 -1.334 1
1 414 . 2 1 1 A 43 43 VAL N N 41 127.312 125.081 2.231 1
1 415 . 2 1 1 A 44 44 LEU H H 42 8.894 8.427 0.467 1
1 416 . 2 1 1 A 44 44 LEU HA H 42 4.496 3.839 0.657 1
1 424 . 2 1 1 A 44 44 LEU CA C 42 54.522 54.017 0.505 1
1 425 . 2 1 1 A 44 44 LEU CB C 42 40.980 42.470 -1.490 1
1 429 . 2 1 1 A 44 44 LEU N N 42 130.261 127.839 2.422 1
1 430 . 2 1 1 A 45 45 THR HA H 43 4.263 3.901 0.362 1
1 435 . 2 1 1 A 45 45 THR CA C 43 61.033 62.231 -1.198 1
1 436 . 2 1 1 A 45 45 THR CB C 43 69.768 66.680 3.088 1
1 440 . 2 1 1 A 46 46 GLU CA C 44 56.411 59.055 -2.644 1
1 441 . 2 1 1 A 46 46 GLU CB C 44 29.827 29.049 0.778 1
1 443 . 2 1 1 A 47 47 HIS HA H 45 4.549 4.230 0.319 1
1 447 . 2 1 1 A 47 47 HIS C C 45 174.812 176.957 -2.145 1
1 448 . 2 1 1 A 47 47 HIS CA C 45 56.107 59.898 -3.791 1
1 449 . 2 1 1 A 47 47 HIS CB C 45 29.080 30.015 -0.935 1
1 451 . 2 1 1 A 48 48 VAL H H 46 7.826 8.013 -0.187 1
1 452 . 2 1 1 A 48 48 VAL HA H 46 4.024 3.533 0.491 1
1 460 . 2 1 1 A 48 48 VAL C C 46 175.697 177.716 -2.019 1
1 461 . 2 1 1 A 48 48 VAL CA C 46 61.841 66.573 -4.732 1
1 462 . 2 1 1 A 48 48 VAL CB C 46 32.600 31.571 1.029 1
1 465 . 2 1 1 A 48 48 VAL N N 46 121.117 119.796 1.321 1
1 466 . 2 1 1 A 49 49 ALA H H 47 8.237 8.109 0.128 1
1 467 . 2 1 1 A 49 49 ALA HA H 47 4.281 3.887 0.394 1
1 471 . 2 1 1 A 49 49 ALA C C 47 177.173 178.965 -1.792 1
1 472 . 2 1 1 A 49 49 ALA CA C 47 52.207 55.506 -3.299 1
1 473 . 2 1 1 A 49 49 ALA CB C 47 19.064 18.316 0.748 1
1 474 . 2 1 1 A 49 49 ALA N N 47 126.817 122.308 4.509 1
1 475 . 2 1 1 A 50 50 ASP H H 48 8.029 7.861 0.168 1
1 476 . 2 1 1 A 50 50 ASP HA H 48 4.436 4.481 -0.045 1
1 479 . 2 1 1 A 50 50 ASP C C 48 176.124 176.796 -0.672 1
1 480 . 2 1 1 A 50 50 ASP CA C 48 54.447 53.623 0.824 1
1 481 . 2 1 1 A 50 50 ASP CB C 48 40.877 40.514 0.363 1
1 482 . 2 1 1 A 50 50 ASP N N 48 119.687 117.957 1.730 1
1 483 . 2 1 1 A 51 51 ALA H H 49 8.094 8.506 -0.412 1
1 484 . 2 1 1 A 51 51 ALA HA H 49 4.134 4.206 -0.072 1
1 488 . 2 1 1 A 51 51 ALA C C 49 177.835 177.861 -0.026 1
1 489 . 2 1 1 A 51 51 ALA CA C 49 52.900 51.014 1.886 1
1 490 . 2 1 1 A 51 51 ALA CB C 49 18.942 19.094 -0.152 1
1 491 . 2 1 1 A 51 51 ALA N N 49 124.400 122.779 1.621 1
1 492 . 2 1 1 A 52 52 GLU H H 50 8.243 7.951 0.292 1
1 493 . 2 1 1 A 52 52 GLU HA H 50 4.152 4.498 -0.346 1
1 497 . 2 1 1 A 52 52 GLU C C 50 176.456 176.261 0.195 1
1 498 . 2 1 1 A 52 52 GLU CA C 50 56.480 56.627 -0.147 1
1 499 . 2 1 1 A 52 52 GLU CB C 50 29.470 31.444 -1.974 1
1 501 . 2 1 1 A 52 52 GLU N N 50 118.917 116.595 2.322 1
1 502 . 2 1 1 A 53 53 LEU H H 51 7.839 7.352 0.487 1
1 503 . 2 1 1 A 53 53 LEU HA H 51 4.229 4.423 -0.194 1
1 513 . 2 1 1 A 53 53 LEU C C 51 177.058 176.611 0.447 1
1 514 . 2 1 1 A 53 53 LEU CA C 51 54.625 53.856 0.769 1
1 515 . 2 1 1 A 53 53 LEU CB C 51 42.125 43.347 -1.222 1
1 519 . 2 1 1 A 53 53 LEU N N 51 122.169 117.080 5.089 1
1 520 . 2 1 1 A 54 54 GLU H H 52 8.104 8.774 -0.670 1
1 521 . 2 1 1 A 54 54 GLU HA H 52 4.470 4.268 0.202 1
1 525 . 2 1 1 A 54 54 GLU CA C 52 54.286 58.219 -3.933 1
1 526 . 2 1 1 A 54 54 GLU CB C 52 29.268 28.663 0.605 1
1 528 . 2 1 1 A 54 54 GLU N N 52 123.040 117.321 5.719 1
1 529 . 2 1 1 A 55 55 PRO HA H 53 4.310 4.577 -0.267 1
1 536 . 2 1 1 A 55 55 PRO C C 53 177.019 176.830 0.189 1
1 537 . 2 1 1 A 55 55 PRO CA C 53 63.075 62.267 0.808 1
1 538 . 2 1 1 A 55 55 PRO CB C 53 31.329 29.091 2.238 1
1 541 . 2 1 1 A 56 56 LEU H H 54 8.263 8.415 -0.152 1
1 542 . 2 1 1 A 56 56 LEU HA H 54 4.237 4.324 -0.087 1
1 552 . 2 1 1 A 56 56 LEU C C 54 178.055 177.004 1.051 1
1 553 . 2 1 1 A 56 56 LEU CA C 54 55.018 56.015 -0.997 1
1 554 . 2 1 1 A 56 56 LEU CB C 54 41.990 42.807 -0.817 1
1 558 . 2 1 1 A 56 56 LEU N N 54 122.728 123.310 -0.582 1
1 559 . 2 1 1 A 57 57 GLY H H 55 8.231 8.652 -0.421 1
1 560 . 2 1 1 A 57 57 GLY HA2 H 55 3.911 4.260 -0.349 1
1 561 . 2 1 1 A 57 57 GLY HA3 H 55 3.808 4.272 -0.464 1
1 562 . 2 1 1 A 57 57 GLY C C 55 174.379 175.140 -0.761 1
1 563 . 2 1 1 A 57 57 GLY CA C 55 45.092 44.790 0.302 1
1 564 . 2 1 1 A 57 57 GLY N N 55 110.035 108.907 1.128 1
1 565 . 2 1 1 A 58 58 GLU H H 56 8.241 9.047 -0.806 1
1 566 . 2 1 1 A 58 58 GLU HA H 56 4.136 4.196 -0.060 1
1 570 . 2 1 1 A 58 58 GLU C C 56 176.868 178.701 -1.833 1
1 571 . 2 1 1 A 58 58 GLU CA C 56 56.734 59.654 -2.920 1
1 572 . 2 1 1 A 58 58 GLU CB C 56 29.584 29.428 0.156 1
1 574 . 2 1 1 A 58 58 GLU N N 56 121.173 122.184 -1.011 1
1 575 . 2 1 1 A 59 59 GLU H H 57 8.419 8.244 0.175 1
1 576 . 2 1 1 A 59 59 GLU HA H 57 4.074 4.059 0.015 1
1 580 . 2 1 1 A 59 59 GLU C C 57 176.502 177.620 -1.118 1
1 581 . 2 1 1 A 59 59 GLU CA C 57 56.842 58.895 -2.053 1
1 582 . 2 1 1 A 59 59 GLU CB C 57 29.267 29.260 0.007 1
1 584 . 2 1 1 A 59 59 GLU N N 57 121.777 119.563 2.214 1
1 585 . 2 1 1 A 60 60 ALA H H 58 8.077 8.112 -0.035 1
1 586 . 2 1 1 A 60 60 ALA HA H 58 4.134 4.267 -0.133 1
1 590 . 2 1 1 A 60 60 ALA CA C 58 52.432 52.404 0.028 1
1 591 . 2 1 1 A 60 60 ALA CB C 58 18.743 19.238 -0.495 1
1 592 . 2 1 1 A 60 60 ALA N N 58 125.120 122.323 2.797 1
1 593 . 2 1 1 A 61 61 ALA H H 59 8.041 8.948 -0.907 1
1 594 . 2 1 1 A 61 61 ALA HA H 59 4.131 4.229 -0.098 1
1 598 . 2 1 1 A 61 61 ALA C C 59 178.147 178.528 -0.381 1
1 599 . 2 1 1 A 61 61 ALA CA C 59 52.586 53.165 -0.579 1
1 600 . 2 1 1 A 61 61 ALA CB C 59 18.692 18.180 0.512 1
1 601 . 2 1 1 A 61 61 ALA N N 59 123.857 124.589 -0.732 1
1 602 . 2 1 1 A 62 62 GLY H H 60 8.069 8.120 -0.051 1
1 603 . 2 1 1 A 62 62 GLY HA2 H 60 3.810 3.936 -0.126 1
1 604 . 2 1 1 A 62 62 GLY HA3 H 60 3.888 3.983 -0.095 1
1 605 . 2 1 1 A 62 62 GLY C C 60 174.914 174.987 -0.073 1
1 606 . 2 1 1 A 62 62 GLY CA C 60 45.320 46.650 -1.330 1
1 607 . 2 1 1 A 62 62 GLY N N 60 107.924 107.929 -0.005 1
1 608 . 2 1 1 A 63 63 GLY H H 61 8.118 7.802 0.316 1
1 609 . 2 1 1 A 63 63 GLY HA2 H 61 4.008 4.071 -0.063 1
1 610 . 2 1 1 A 63 63 GLY HA3 H 61 3.893 4.125 -0.232 1
1 611 . 2 1 1 A 63 63 GLY C C 61 174.743 175.041 -0.298 1
1 612 . 2 1 1 A 63 63 GLY CA C 61 45.202 46.450 -1.248 1
1 613 . 2 1 1 A 63 63 GLY N N 61 109.441 106.992 2.449 1
1 614 . 2 1 1 A 64 64 ASP H H 62 8.305 8.355 -0.050 1
1 615 . 2 1 1 A 64 64 ASP HA H 62 4.240 4.300 -0.060 1
1 618 . 2 1 1 A 64 64 ASP C C 62 177.571 178.489 -0.918 1
1 619 . 2 1 1 A 64 64 ASP CA C 62 57.210 57.223 -0.013 1
1 620 . 2 1 1 A 64 64 ASP CB C 62 40.142 40.288 -0.146 1
1 621 . 2 1 1 A 64 64 ASP N N 62 121.568 118.638 2.930 1
1 622 . 2 1 1 A 65 65 GLN H H 63 8.337 8.321 0.016 1
1 623 . 2 1 1 A 65 65 GLN HA H 63 4.138 4.046 0.092 1
1 628 . 2 1 1 A 65 65 GLN C C 63 177.490 178.871 -1.381 1
1 629 . 2 1 1 A 65 65 GLN CA C 63 58.643 58.869 -0.226 1
1 630 . 2 1 1 A 65 65 GLN CB C 63 27.803 28.489 -0.686 1
1 632 . 2 1 1 A 65 65 GLN N N 63 119.700 118.426 1.274 1
1 633 . 2 1 1 A 66 66 PHE H H 64 7.658 8.370 -0.712 1
1 634 . 2 1 1 A 66 66 PHE HA H 64 4.170 4.346 -0.176 1
1 638 . 2 1 1 A 66 66 PHE C C 64 176.872 178.461 -1.589 1
1 639 . 2 1 1 A 66 66 PHE CA C 64 60.158 61.092 -0.934 1
1 640 . 2 1 1 A 66 66 PHE CB C 64 38.490 38.284 0.206 1
1 643 . 2 1 1 A 66 66 PHE N N 64 121.036 119.252 1.784 1
1 644 . 2 1 1 A 67 67 ILE H H 65 7.646 8.430 -0.784 1
1 645 . 2 1 1 A 67 67 ILE HA H 65 3.426 3.698 -0.272 1
1 655 . 2 1 1 A 67 67 ILE CA C 65 63.377 65.002 -1.625 1
1 656 . 2 1 1 A 67 67 ILE CB C 65 37.057 37.297 -0.240 1
1 660 . 2 1 1 A 67 67 ILE N N 65 121.372 119.725 1.647 1
1 661 . 2 1 1 A 68 68 HIS H H 66 7.945 8.159 -0.214 1
1 662 . 2 1 1 A 68 68 HIS HA H 66 4.005 4.273 -0.268 1
1 665 . 2 1 1 A 68 68 HIS CA C 66 59.915 59.205 0.710 1
1 668 . 2 1 1 A 68 68 HIS N N 66 120.036 120.243 -0.207 1
1 669 . 2 1 1 A 69 69 GLU HA H 67 3.677 3.830 -0.153 1
1 673 . 2 1 1 A 69 69 GLU CA C 67 58.490 59.786 -1.296 1
1 674 . 2 1 1 A 69 69 GLU CB C 67 29.290 29.248 0.042 1
1 676 . 2 1 1 A 70 70 GLN H H 68 8.017 7.801 0.216 1
1 677 . 2 1 1 A 70 70 GLN HA H 68 3.426 3.931 -0.505 1
1 678 . 2 1 1 A 70 70 GLN C C 68 179.280 178.760 0.520 1
1 679 . 2 1 1 A 70 70 GLN CA C 68 57.561 58.635 -1.074 1
1 680 . 2 1 1 A 70 70 GLN CB C 68 28.530 28.360 0.170 1
1 682 . 2 1 1 A 70 70 GLN N N 68 120.410 118.753 1.657 1
1 683 . 2 1 1 A 71 71 ASP HA H 69 4.440 5.137 -0.697 1
1 684 . 2 1 1 A 71 71 ASP C C 69 177.402 179.295 -1.893 1
1 685 . 2 1 1 A 71 71 ASP CA C 69 56.290 57.472 -1.182 1
1 686 . 2 1 1 A 72 72 LEU H H 70 7.952 8.579 -0.627 1
1 687 . 2 1 1 A 72 72 LEU HA H 70 3.775 3.917 -0.142 1
1 697 . 2 1 1 A 72 72 LEU C C 70 178.316 178.819 -0.503 1
1 698 . 2 1 1 A 72 72 LEU CA C 70 56.101 58.071 -1.970 1
1 699 . 2 1 1 A 72 72 LEU CB C 70 39.872 41.320 -1.448 1
1 703 . 2 1 1 A 72 72 LEU N N 70 120.832 120.691 0.141 1
1 704 . 2 1 1 A 73 73 ASN H H 71 7.723 8.261 -0.538 1
1 705 . 2 1 1 A 73 73 ASN HA H 71 4.270 4.361 -0.091 1
1 708 . 2 1 1 A 73 73 ASN C C 71 178.193 177.660 0.533 1
1 709 . 2 1 1 A 73 73 ASN CA C 71 55.970 56.371 -0.401 1
1 710 . 2 1 1 A 73 73 ASN CB C 71 37.640 39.069 -1.429 1
1 711 . 2 1 1 A 73 73 ASN N N 71 119.295 116.579 2.716 1
1 712 . 2 1 1 A 74 74 TRP H H 72 7.811 8.482 -0.671 1
1 713 . 2 1 1 A 74 74 TRP HA H 72 4.500 4.525 -0.025 1
1 720 . 2 1 1 A 74 74 TRP CA C 72 58.480 59.929 -1.449 1
1 721 . 2 1 1 A 74 74 TRP CB C 72 28.920 29.435 -0.515 1
1 727 . 2 1 1 A 74 74 TRP N N 72 121.490 120.272 1.218 1
1 729 . 2 1 1 A 75 75 LEU H H 73 8.412 8.568 -0.156 1
1 730 . 2 1 1 A 75 75 LEU HA H 73 3.290 3.621 -0.331 1
1 739 . 2 1 1 A 75 75 LEU C C 73 178.562 178.674 -0.112 1
1 740 . 2 1 1 A 75 75 LEU CA C 73 58.226 57.799 0.427 1
1 741 . 2 1 1 A 75 75 LEU CB C 73 41.200 40.925 0.275 1
1 745 . 2 1 1 A 75 75 LEU N N 73 121.065 121.329 -0.264 1
1 746 . 2 1 1 A 76 76 GLN H H 74 7.648 7.755 -0.107 1
1 747 . 2 1 1 A 76 76 GLN HA H 74 3.657 4.095 -0.438 1
1 752 . 2 1 1 A 76 76 GLN C C 74 178.616 177.342 1.274 1
1 753 . 2 1 1 A 76 76 GLN CA C 74 58.777 58.167 0.610 1
1 754 . 2 1 1 A 76 76 GLN CB C 74 28.163 28.292 -0.129 1
1 756 . 2 1 1 A 76 76 GLN N N 74 113.985 118.322 -4.337 1
1 757 . 2 1 1 A 77 77 GLN H H 75 7.465 7.578 -0.113 1
1 758 . 2 1 1 A 77 77 GLN HA H 75 4.134 4.413 -0.279 1
1 761 . 2 1 1 A 77 77 GLN C C 75 176.223 175.845 0.378 1
1 762 . 2 1 1 A 77 77 GLN CA C 75 56.203 56.061 0.142 1
1 763 . 2 1 1 A 77 77 GLN CB C 75 29.524 29.549 -0.025 1
1 765 . 2 1 1 A 77 77 GLN N N 75 117.481 116.998 0.483 1
1 766 . 2 1 1 A 78 78 ALA H H 76 7.420 7.293 0.127 1
1 767 . 2 1 1 A 78 78 ALA HA H 76 3.864 4.285 -0.421 1
1 771 . 2 1 1 A 78 78 ALA C C 76 176.733 176.776 -0.043 1
1 772 . 2 1 1 A 78 78 ALA CA C 76 52.529 53.021 -0.492 1
1 773 . 2 1 1 A 78 78 ALA CB C 76 20.124 19.393 0.731 1
1 774 . 2 1 1 A 78 78 ALA N N 76 122.682 122.921 -0.239 1
1 775 . 2 1 1 A 79 79 ASP H H 77 9.028 8.886 0.142 1
1 776 . 2 1 1 A 79 79 ASP HA H 77 4.673 4.684 -0.011 1
1 779 . 2 1 1 A 79 79 ASP C C 77 175.740 176.144 -0.404 1
1 780 . 2 1 1 A 79 79 ASP CA C 77 56.383 56.595 -0.212 1
1 781 . 2 1 1 A 79 79 ASP CB C 77 42.826 42.808 0.018 1
1 782 . 2 1 1 A 79 79 ASP N N 77 119.887 122.132 -2.245 1
1 783 . 2 1 1 A 80 80 VAL H H 78 7.379 7.902 -0.523 1
1 784 . 2 1 1 A 80 80 VAL HA H 78 4.340 4.809 -0.469 1
1 792 . 2 1 1 A 80 80 VAL C C 78 175.321 174.474 0.847 1
1 793 . 2 1 1 A 80 80 VAL CA C 78 60.011 60.028 -0.017 1
1 794 . 2 1 1 A 80 80 VAL CB C 78 35.362 35.928 -0.566 1
1 797 . 2 1 1 A 80 80 VAL N N 78 114.152 118.323 -4.171 1
1 798 . 2 1 1 A 81 81 VAL H H 79 8.350 8.631 -0.281 1
1 799 . 2 1 1 A 81 81 VAL HA H 79 4.799 4.925 -0.126 1
1 807 . 2 1 1 A 81 81 VAL C C 79 173.095 174.911 -1.816 1
1 808 . 2 1 1 A 81 81 VAL CA C 79 60.775 60.690 0.085 1
1 809 . 2 1 1 A 81 81 VAL CB C 79 32.824 35.130 -2.306 1
1 812 . 2 1 1 A 81 81 VAL N N 79 128.429 125.728 2.701 1
1 813 . 2 1 1 A 82 82 VAL H H 80 8.947 8.837 0.110 1
1 814 . 2 1 1 A 82 82 VAL HA H 80 4.947 4.809 0.138 1
1 822 . 2 1 1 A 82 82 VAL C C 80 173.522 174.129 -0.607 1
1 823 . 2 1 1 A 82 82 VAL CA C 80 59.684 60.373 -0.689 1
1 824 . 2 1 1 A 82 82 VAL CB C 80 33.702 34.663 -0.961 1
1 827 . 2 1 1 A 82 82 VAL N N 80 126.957 126.296 0.661 1
1 828 . 2 1 1 A 83 83 ALA H H 81 9.011 8.600 0.411 1
1 829 . 2 1 1 A 83 83 ALA HA H 81 4.938 5.239 -0.301 1
1 833 . 2 1 1 A 83 83 ALA C C 81 130.330 175.462 -45.132 1
1 834 . 2 1 1 A 83 83 ALA CA C 81 49.490 49.718 -0.228 1
1 835 . 2 1 1 A 83 83 ALA CB C 81 23.628 21.525 2.103 1
1 836 . 2 1 1 A 83 83 ALA N N 81 128.705 128.939 -0.234 1
1 837 . 2 1 1 A 84 84 GLU H H 82 8.922 8.694 0.228 1
1 838 . 2 1 1 A 84 84 GLU HA H 82 4.937 4.565 0.372 1
1 839 . 2 1 1 A 84 84 GLU C C 82 177.673 177.582 0.091 1
1 840 . 2 1 1 A 84 84 GLU CA C 82 56.714 56.085 0.629 1
1 841 . 2 1 1 A 84 84 GLU CB C 82 29.882 30.693 -0.811 1
1 842 . 2 1 1 A 84 84 GLU N N 82 130.330 122.704 7.626 1
1 843 . 2 1 1 A 85 85 VAL H H 83 8.427 8.865 -0.438 1
1 844 . 2 1 1 A 85 85 VAL HA H 83 4.435 4.572 -0.137 1
1 852 . 2 1 1 A 85 85 VAL C C 83 174.252 176.410 -2.158 1
1 853 . 2 1 1 A 85 85 VAL CA C 83 59.896 61.057 -1.161 1
1 854 . 2 1 1 A 85 85 VAL CB C 83 29.968 31.765 -1.797 1
1 857 . 2 1 1 A 85 85 VAL N N 83 114.212 119.470 -5.258 1
1 858 . 2 1 1 A 86 86 THR H H 84 9.347 7.960 1.387 1
1 859 . 2 1 1 A 86 86 THR HA H 84 4.146 4.475 -0.329 1
1 864 . 2 1 1 A 86 86 THR C C 84 175.751 173.998 1.753 1
1 865 . 2 1 1 A 86 86 THR CA C 84 67.629 61.978 5.651 1
1 866 . 2 1 1 A 86 86 THR CB C 84 66.819 68.751 -1.932 1
1 868 . 2 1 1 A 86 86 THR N N 84 121.640 118.069 3.571 1
1 869 . 2 1 1 A 87 87 GLN H H 85 8.114 7.583 0.531 1
1 870 . 2 1 1 A 87 87 GLN HA H 85 4.736 4.691 0.045 1
1 874 . 2 1 1 A 87 87 GLN CA C 85 51.898 53.318 -1.420 1
1 875 . 2 1 1 A 87 87 GLN CB C 85 27.942 31.091 -3.149 1
1 877 . 2 1 1 A 87 87 GLN N N 85 120.367 120.528 -0.161 1
1 878 . 2 1 1 A 88 88 PRO HA H 86 4.061 4.398 -0.337 1
1 885 . 2 1 1 A 88 88 PRO C C 86 176.436 176.043 0.393 1
1 886 . 2 1 1 A 88 88 PRO CA C 86 63.422 63.360 0.062 1
1 887 . 2 1 1 A 88 88 PRO CB C 86 31.925 31.935 -0.010 1
1 889 . 2 1 1 A 89 89 SER H H 87 6.044 8.699 -2.655 1
1 890 . 2 1 1 A 89 89 SER HA H 87 4.630 4.866 -0.236 1
1 893 . 2 1 1 A 89 89 SER C C 87 175.612 174.052 1.560 1
1 894 . 2 1 1 A 89 89 SER CA C 87 56.800 58.034 -1.234 1
1 895 . 2 1 1 A 89 89 SER CB C 87 64.196 66.172 -1.976 1
1 896 . 2 1 1 A 89 89 SER N N 87 115.721 120.526 -4.805 1
1 897 . 2 1 1 A 90 90 LEU H H 88 9.702 8.959 0.743 1
1 898 . 2 1 1 A 90 90 LEU HA H 88 4.270 3.994 0.276 1
1 906 . 2 1 1 A 90 90 LEU C C 88 179.173 179.318 -0.145 1
1 907 . 2 1 1 A 90 90 LEU CA C 88 57.402 58.226 -0.824 1
1 908 . 2 1 1 A 90 90 LEU CB C 88 43.642 41.590 2.052 1
1 911 . 2 1 1 A 90 90 LEU N N 88 130.488 126.647 3.841 1
1 912 . 2 1 1 A 91 91 GLY H H 89 8.354 8.399 -0.045 1
1 913 . 2 1 1 A 91 91 GLY HA2 H 89 3.680 3.853 -0.173 1
1 914 . 2 1 1 A 91 91 GLY HA3 H 89 3.584 3.870 -0.286 1
1 915 . 2 1 1 A 91 91 GLY C C 89 175.106 175.918 -0.812 1
1 916 . 2 1 1 A 91 91 GLY CA C 89 47.770 47.661 0.109 1
1 917 . 2 1 1 A 91 91 GLY N N 89 107.522 107.172 0.350 1
1 918 . 2 1 1 A 92 92 VAL H H 90 7.906 8.249 -0.343 1
1 919 . 2 1 1 A 92 92 VAL HA H 90 3.940 3.711 0.229 1
1 927 . 2 1 1 A 92 92 VAL C C 90 178.467 177.864 0.603 1
1 928 . 2 1 1 A 92 92 VAL CA C 90 65.379 66.573 -1.194 1
1 929 . 2 1 1 A 92 92 VAL CB C 90 31.785 31.775 0.010 1
1 932 . 2 1 1 A 92 92 VAL N N 90 121.741 122.276 -0.535 1
1 933 . 2 1 1 A 93 93 GLY H H 91 7.595 8.137 -0.542 1
1 934 . 2 1 1 A 93 93 GLY HA2 H 91 3.628 3.734 -0.106 1
1 935 . 2 1 1 A 93 93 GLY HA3 H 91 3.415 3.744 -0.329 1
1 936 . 2 1 1 A 93 93 GLY C C 91 174.022 175.230 -1.208 1
1 937 . 2 1 1 A 93 93 GLY CA C 91 48.319 47.513 0.806 1
1 938 . 2 1 1 A 93 93 GLY N N 91 104.629 106.464 -1.835 1
1 939 . 2 1 1 A 94 94 TYR H H 92 8.372 8.801 -0.429 1
1 940 . 2 1 1 A 94 94 TYR HA H 92 4.046 4.033 0.013 1
1 943 . 2 1 1 A 94 94 TYR C C 92 177.458 177.853 -0.395 1
1 944 . 2 1 1 A 94 94 TYR CA C 92 61.760 60.724 1.036 1
1 945 . 2 1 1 A 94 94 TYR CB C 92 38.431 38.900 -0.469 1
1 948 . 2 1 1 A 94 94 TYR N N 92 123.383 123.717 -0.334 1
1 949 . 2 1 1 A 95 95 GLU H H 93 8.424 8.931 -0.507 1
1 950 . 2 1 1 A 95 95 GLU HA H 93 3.421 3.954 -0.533 1
1 951 . 2 1 1 A 95 95 GLU C C 93 178.590 179.066 -0.476 1
1 952 . 2 1 1 A 95 95 GLU CA C 93 60.211 59.074 1.137 1
1 953 . 2 1 1 A 95 95 GLU CB C 93 29.025 29.491 -0.466 1
1 954 . 2 1 1 A 95 95 GLU N N 93 120.181 120.005 0.176 1
1 955 . 2 1 1 A 96 96 LEU H H 94 8.210 8.189 0.021 1
1 956 . 2 1 1 A 96 96 LEU HA H 94 3.830 3.998 -0.168 1
1 964 . 2 1 1 A 96 96 LEU C C 94 179.032 179.142 -0.110 1
1 965 . 2 1 1 A 96 96 LEU CA C 94 57.683 58.392 -0.709 1
1 966 . 2 1 1 A 96 96 LEU CB C 94 41.883 41.934 -0.051 1
1 970 . 2 1 1 A 96 96 LEU N N 94 118.091 120.064 -1.973 1
1 971 . 2 1 1 A 97 97 GLY H H 95 8.773 8.273 0.500 1
1 972 . 2 1 1 A 97 97 GLY C C 95 175.344 175.712 -0.368 1
1 973 . 2 1 1 A 97 97 GLY CA C 95 47.308 46.706 0.602 1
1 974 . 2 1 1 A 97 97 GLY N N 95 108.085 105.539 2.546 1
1 975 . 2 1 1 A 98 98 ARG H H 96 8.100 8.547 -0.447 1
1 976 . 2 1 1 A 98 98 ARG C C 96 179.692 178.595 1.097 1
1 977 . 2 1 1 A 98 98 ARG CA C 96 56.308 59.515 -3.207 1
1 978 . 2 1 1 A 98 98 ARG CB C 96 26.854 29.720 -2.866 1
1 979 . 2 1 1 A 98 98 ARG N N 96 118.156 121.732 -3.576 1
1 980 . 2 1 1 A 99 99 ALA H H 97 8.498 7.984 0.514 1
1 981 . 2 1 1 A 99 99 ALA HA H 97 3.640 3.979 -0.339 1
1 985 . 2 1 1 A 99 99 ALA C C 97 179.650 180.044 -0.394 1
1 986 . 2 1 1 A 99 99 ALA CA C 97 55.166 55.013 0.153 1
1 987 . 2 1 1 A 99 99 ALA CB C 97 18.604 18.574 0.030 1
1 988 . 2 1 1 A 99 99 ALA N N 97 122.310 121.697 0.613 1
1 989 . 2 1 1 A 100 100 VAL H H 98 8.597 8.281 0.316 1
1 990 . 2 1 1 A 100 100 VAL HA H 98 3.798 3.518 0.280 1
1 998 . 2 1 1 A 100 100 VAL C C 98 180.464 177.808 2.656 1
1 999 . 2 1 1 A 100 100 VAL CA C 98 65.664 66.681 -1.017 1
1 1000 . 2 1 1 A 100 100 VAL CB C 98 31.065 31.593 -0.528 1
1 1003 . 2 1 1 A 100 100 VAL N N 98 120.603 119.161 1.442 1
1 1004 . 2 1 1 A 101 101 ALA H H 99 7.280 7.698 -0.418 1
1 1005 . 2 1 1 A 101 101 ALA HA H 99 3.963 4.243 -0.280 1
1 1009 . 2 1 1 A 101 101 ALA C C 99 179.314 179.372 -0.058 1
1 1010 . 2 1 1 A 101 101 ALA CA C 99 54.367 54.553 -0.186 1
1 1011 . 2 1 1 A 101 101 ALA CB C 99 18.139 19.191 -1.052 1
1 1012 . 2 1 1 A 101 101 ALA N N 99 124.450 121.764 2.686 1
1 1013 . 2 1 1 A 102 102 LEU H H 100 7.200 8.427 -1.227 1
1 1014 . 2 1 1 A 102 102 LEU HA H 100 4.192 4.146 0.046 1
1 1024 . 2 1 1 A 102 102 LEU C C 100 177.306 177.871 -0.565 1
1 1025 . 2 1 1 A 102 102 LEU CA C 100 54.808 57.148 -2.340 1
1 1026 . 2 1 1 A 102 102 LEU CB C 100 42.880 42.588 0.292 1
1 1030 . 2 1 1 A 102 102 LEU N N 100 116.834 118.666 -1.832 1
1 1031 . 2 1 1 A 103 103 GLY H H 101 7.891 7.477 0.414 1
1 1032 . 2 1 1 A 103 103 GLY HA2 H 101 3.941 4.038 -0.097 1
1 1033 . 2 1 1 A 103 103 GLY HA3 H 101 3.831 4.041 -0.210 1
1 1034 . 2 1 1 A 103 103 GLY C C 101 175.137 174.117 1.020 1
1 1035 . 2 1 1 A 103 103 GLY CA C 101 45.673 44.639 1.034 1
1 1036 . 2 1 1 A 103 103 GLY N N 101 109.395 107.244 2.151 1
1 1037 . 2 1 1 A 104 104 LYS H H 102 7.337 8.856 -1.519 1
1 1038 . 2 1 1 A 104 104 LYS HA H 102 4.402 4.605 -0.203 1
1 1043 . 2 1 1 A 104 104 LYS CA C 102 52.136 56.992 -4.856 1
1 1044 . 2 1 1 A 104 104 LYS CB C 102 31.045 35.470 -4.425 1
1 1047 . 2 1 1 A 104 104 LYS N N 102 118.954 117.652 1.302 1
1 1048 . 2 1 1 A 105 105 PRO HA H 103 4.781 4.767 0.014 1
1 1054 . 2 1 1 A 105 105 PRO CA C 103 62.791 62.266 0.525 1
1 1055 . 2 1 1 A 105 105 PRO CB C 103 30.405 31.748 -1.343 1
1 1058 . 2 1 1 A 106 106 ILE H H 104 8.261 8.592 -0.331 1
1 1059 . 2 1 1 A 106 106 ILE HA H 104 4.680 4.567 0.113 1
1 1069 . 2 1 1 A 106 106 ILE C C 104 175.543 173.970 1.573 1
1 1070 . 2 1 1 A 106 106 ILE CA C 104 59.362 59.637 -0.275 1
1 1071 . 2 1 1 A 106 106 ILE CB C 104 43.738 41.094 2.644 1
1 1075 . 2 1 1 A 106 106 ILE N N 104 123.509 124.940 -1.431 1
1 1076 . 2 1 1 A 107 107 LEU H H 105 8.584 8.480 0.104 1
1 1077 . 2 1 1 A 107 107 LEU HA H 105 4.243 4.557 -0.314 1
1 1087 . 2 1 1 A 107 107 LEU C C 105 174.204 174.662 -0.458 1
1 1088 . 2 1 1 A 107 107 LEU CA C 105 52.863 53.003 -0.140 1
1 1089 . 2 1 1 A 107 107 LEU CB C 105 42.408 44.519 -2.111 1
1 1093 . 2 1 1 A 107 107 LEU N N 105 131.882 129.875 2.007 1
1 1094 . 2 1 1 A 108 108 CYS H H 106 8.679 8.662 0.017 1
1 1095 . 2 1 1 A 108 108 CYS HA H 106 5.280 5.207 0.073 1
1 1099 . 2 1 1 A 108 108 CYS C C 106 173.134 173.359 -0.225 1
1 1100 . 2 1 1 A 108 108 CYS CA C 106 57.290 57.145 0.145 1
1 1101 . 2 1 1 A 108 108 CYS CB C 106 29.559 29.702 -0.143 1
1 1102 . 2 1 1 A 108 108 CYS N N 106 122.904 125.862 -2.958 1
1 1103 . 2 1 1 A 109 109 LEU H H 107 8.987 8.682 0.305 1
1 1104 . 2 1 1 A 109 109 LEU HA H 107 5.120 5.707 -0.587 1
1 1112 . 2 1 1 A 109 109 LEU C C 107 174.500 175.723 -1.223 1
1 1113 . 2 1 1 A 109 109 LEU CA C 107 53.274 53.679 -0.405 1
1 1114 . 2 1 1 A 109 109 LEU CB C 107 43.450 44.521 -1.071 1
1 1118 . 2 1 1 A 109 109 LEU N N 107 124.653 124.008 0.645 1
1 1119 . 2 1 1 A 110 110 PHE H H 108 8.981 9.023 -0.042 1
1 1120 . 2 1 1 A 110 110 PHE HA H 108 4.846 5.176 -0.330 1
1 1125 . 2 1 1 A 110 110 PHE C C 108 172.231 173.827 -1.596 1
1 1126 . 2 1 1 A 110 110 PHE CA C 108 55.963 57.598 -1.635 1
1 1127 . 2 1 1 A 110 110 PHE CB C 108 43.270 42.494 0.776 1
1 1130 . 2 1 1 A 110 110 PHE N N 108 125.052 125.294 -0.242 1
1 1131 . 2 1 1 A 111 111 ARG H H 109 7.461 9.051 -1.590 1
1 1132 . 2 1 1 A 111 111 ARG HA H 109 4.804 4.781 0.023 1
1 1136 . 2 1 1 A 111 111 ARG CA C 109 51.953 53.365 -1.412 1
1 1137 . 2 1 1 A 111 111 ARG CB C 109 30.008 29.686 0.322 1
1 1140 . 2 1 1 A 111 111 ARG N N 109 128.034 126.843 1.191 1
1 1141 . 2 1 1 A 112 112 PRO C C 110 178.675 177.885 0.790 1
1 1142 . 2 1 1 A 112 112 PRO CA C 110 64.024 64.411 -0.387 1
1 1143 . 2 1 1 A 112 112 PRO CB C 110 31.416 31.869 -0.453 1
1 1144 . 2 1 1 A 113 113 GLN H H 111 8.188 8.777 -0.589 1
1 1145 . 2 1 1 A 113 113 GLN HA H 111 4.056 4.063 -0.007 1
1 1149 . 2 1 1 A 113 113 GLN C C 111 175.936 177.539 -1.603 1
1 1150 . 2 1 1 A 113 113 GLN CA C 111 57.144 58.286 -1.142 1
1 1151 . 2 1 1 A 113 113 GLN CB C 111 28.033 28.078 -0.045 1
1 1153 . 2 1 1 A 113 113 GLN N N 111 118.835 116.341 2.494 1
1 1154 . 2 1 1 A 114 114 SER H H 112 7.730 7.707 0.023 1
1 1155 . 2 1 1 A 114 114 SER HA H 112 4.037 4.571 -0.534 1
1 1158 . 2 1 1 A 114 114 SER C C 112 175.750 174.742 1.008 1
1 1159 . 2 1 1 A 114 114 SER CA C 112 60.154 58.649 1.505 1
1 1160 . 2 1 1 A 114 114 SER CB C 112 64.282 64.403 -0.121 1
1 1161 . 2 1 1 A 114 114 SER N N 112 114.887 115.527 -0.640 1
1 1162 . 2 1 1 A 115 115 GLY H H 113 8.005 7.653 0.352 1
1 1163 . 2 1 1 A 115 115 GLY HA2 H 113 3.712 4.002 -0.290 1
1 1164 . 2 1 1 A 115 115 GLY HA3 H 113 4.130 4.131 -0.001 1
1 1165 . 2 1 1 A 115 115 GLY C C 113 173.945 175.615 -1.670 1
1 1166 . 2 1 1 A 115 115 GLY CA C 113 45.233 47.127 -1.894 1
1 1167 . 2 1 1 A 115 115 GLY N N 113 110.740 109.467 1.273 1
1 1168 . 2 1 1 A 116 116 ARG H H 114 7.665 8.795 -1.130 1
1 1169 . 2 1 1 A 116 116 ARG HA H 114 4.449 4.358 0.091 1
1 1173 . 2 1 1 A 116 116 ARG C C 114 175.370 175.847 -0.477 1
1 1174 . 2 1 1 A 116 116 ARG CA C 114 55.080 56.184 -1.104 1
1 1175 . 2 1 1 A 116 116 ARG CB C 114 31.215 30.847 0.368 1
1 1178 . 2 1 1 A 116 116 ARG N N 114 119.983 118.648 1.335 1
1 1179 . 2 1 1 A 117 117 VAL H H 115 8.409 8.130 0.279 1
1 1180 . 2 1 1 A 117 117 VAL HA H 115 4.184 4.074 0.110 1
1 1188 . 2 1 1 A 117 117 VAL C C 115 175.980 175.062 0.918 1
1 1189 . 2 1 1 A 117 117 VAL CA C 115 61.167 62.545 -1.378 1
1 1190 . 2 1 1 A 117 117 VAL CB C 115 32.931 31.090 1.841 1
1 1193 . 2 1 1 A 117 117 VAL N N 115 122.240 116.729 5.511 1
1 1194 . 2 1 1 A 118 118 LEU H H 116 8.227 8.502 -0.275 1
1 1195 . 2 1 1 A 118 118 LEU HA H 116 3.720 4.205 -0.485 1
1 1204 . 2 1 1 A 118 118 LEU C C 116 175.623 176.338 -0.715 1
1 1205 . 2 1 1 A 118 118 LEU CA C 116 54.555 54.514 0.041 1
1 1206 . 2 1 1 A 118 118 LEU CB C 116 39.292 42.404 -3.112 1
1 1210 . 2 1 1 A 118 118 LEU N N 116 131.481 128.301 3.180 1
1 1211 . 2 1 1 A 119 119 SER H H 117 7.780 8.458 -0.678 1
1 1212 . 2 1 1 A 119 119 SER HA H 117 4.060 4.396 -0.336 1
1 1214 . 2 1 1 A 119 119 SER C C 117 175.782 175.866 -0.084 1
1 1215 . 2 1 1 A 119 119 SER CA C 117 58.530 58.628 -0.098 1
1 1216 . 2 1 1 A 119 119 SER CB C 117 64.785 63.702 1.083 1
1 1217 . 2 1 1 A 119 119 SER N N 117 118.658 116.819 1.839 1
1 1218 . 2 1 1 A 120 120 ALA H H 118 8.955 8.944 0.011 1
1 1219 . 2 1 1 A 120 120 ALA HA H 118 3.846 3.926 -0.080 1
1 1223 . 2 1 1 A 120 120 ALA C C 118 179.731 179.404 0.327 1
1 1224 . 2 1 1 A 120 120 ALA CA C 118 54.927 54.873 0.054 1
1 1225 . 2 1 1 A 120 120 ALA CB C 118 18.627 18.382 0.245 1
1 1226 . 2 1 1 A 120 120 ALA N N 118 134.119 130.142 3.977 1
1 1227 . 2 1 1 A 121 121 MET H H 119 7.718 8.149 -0.431 1
1 1228 . 2 1 1 A 121 121 MET HA H 119 4.130 4.256 -0.126 1
1 1235 . 2 1 1 A 121 121 MET C C 119 175.610 178.743 -3.133 1
1 1236 . 2 1 1 A 121 121 MET CA C 119 55.968 57.876 -1.908 1
1 1237 . 2 1 1 A 121 121 MET CB C 119 30.814 33.112 -2.298 1
1 1240 . 2 1 1 A 121 121 MET N N 119 115.424 116.350 -0.926 1
1 1241 . 2 1 1 A 122 122 ILE H H 120 6.451 7.727 -1.276 1
1 1242 . 2 1 1 A 122 122 ILE HA H 120 3.392 3.631 -0.239 1
1 1252 . 2 1 1 A 122 122 ILE C C 120 177.108 177.910 -0.802 1
1 1253 . 2 1 1 A 122 122 ILE CA C 120 59.650 64.486 -4.836 1
1 1254 . 2 1 1 A 122 122 ILE CB C 120 34.640 37.419 -2.779 1
1 1258 . 2 1 1 A 122 122 ILE N N 120 113.418 119.221 -5.803 1
1 1259 . 2 1 1 A 123 123 ARG H H 121 7.540 8.280 -0.740 1
1 1260 . 2 1 1 A 123 123 ARG HA H 121 3.551 4.061 -0.510 1
1 1264 . 2 1 1 A 123 123 ARG C C 121 179.642 178.831 0.811 1
1 1265 . 2 1 1 A 123 123 ARG CA C 121 59.242 59.594 -0.352 1
1 1266 . 2 1 1 A 123 123 ARG CB C 121 29.087 29.696 -0.609 1
1 1269 . 2 1 1 A 123 123 ARG N N 121 116.248 119.948 -3.700 1
1 1270 . 2 1 1 A 124 124 GLY H H 122 8.086 8.637 -0.551 1
1 1271 . 2 1 1 A 124 124 GLY C C 122 172.357 175.856 -3.499 1
1 1272 . 2 1 1 A 124 124 GLY CA C 122 44.836 46.889 -2.053 1
1 1273 . 2 1 1 A 124 124 GLY N N 122 104.381 107.685 -3.304 1
1 1274 . 2 1 1 A 125 125 ALA H H 123 6.411 8.117 -1.706 1
1 1275 . 2 1 1 A 125 125 ALA HA H 123 2.441 3.815 -1.374 1
1 1279 . 2 1 1 A 125 125 ALA C C 123 176.908 178.145 -1.237 1
1 1280 . 2 1 1 A 125 125 ALA CA C 123 51.593 54.893 -3.300 1
1 1281 . 2 1 1 A 125 125 ALA CB C 123 16.997 18.408 -1.411 1
1 1282 . 2 1 1 A 125 125 ALA N N 123 123.136 124.762 -1.626 1
1 1283 . 2 1 1 A 126 126 ALA H H 124 6.190 7.694 -1.504 1
1 1284 . 2 1 1 A 126 126 ALA HA H 124 3.829 4.570 -0.741 1
1 1288 . 2 1 1 A 126 126 ALA C C 124 177.535 177.763 -0.228 1
1 1289 . 2 1 1 A 126 126 ALA CA C 124 52.403 52.331 0.072 1
1 1290 . 2 1 1 A 126 126 ALA CB C 124 18.375 19.898 -1.523 1
1 1291 . 2 1 1 A 126 126 ALA N N 124 117.999 117.164 0.835 1
1 1292 . 2 1 1 A 127 127 ASP H H 125 8.877 8.742 0.135 1
1 1293 . 2 1 1 A 127 127 ASP HA H 125 4.665 4.829 -0.164 1
1 1296 . 2 1 1 A 127 127 ASP C C 125 177.795 176.000 1.795 1
1 1297 . 2 1 1 A 127 127 ASP CA C 125 52.855 55.433 -2.578 1
1 1298 . 2 1 1 A 127 127 ASP CB C 125 41.814 38.687 3.127 1
1 1299 . 2 1 1 A 127 127 ASP N N 125 121.828 115.870 5.958 1
1 1300 . 2 1 1 A 128 128 GLY H H 126 7.954 8.077 -0.123 1
1 1301 . 2 1 1 A 128 128 GLY HA2 H 126 3.830 4.191 -0.361 1
1 1302 . 2 1 1 A 128 128 GLY HA3 H 126 4.249 4.238 0.011 1
1 1303 . 2 1 1 A 128 128 GLY C C 126 173.822 173.082 0.740 1
1 1304 . 2 1 1 A 128 128 GLY CA C 126 45.549 45.667 -0.118 1
1 1305 . 2 1 1 A 128 128 GLY N N 126 108.814 108.653 0.161 1
1 1306 . 2 1 1 A 129 129 SER H H 127 8.547 7.954 0.593 1
1 1307 . 2 1 1 A 129 129 SER HA H 127 4.486 4.839 -0.353 1
1 1309 . 2 1 1 A 129 129 SER C C 127 174.178 174.240 -0.062 1
1 1310 . 2 1 1 A 129 129 SER CA C 127 58.653 56.584 2.069 1
1 1311 . 2 1 1 A 129 129 SER CB C 127 63.316 62.967 0.349 1
1 1312 . 2 1 1 A 129 129 SER N N 127 115.599 112.955 2.644 1
1 1313 . 2 1 1 A 130 130 ARG H H 128 8.795 8.430 0.365 1
1 1314 . 2 1 1 A 130 130 ARG HA H 128 4.160 4.086 0.074 1
1 1318 . 2 1 1 A 130 130 ARG C C 128 175.518 174.974 0.544 1
1 1319 . 2 1 1 A 130 130 ARG CA C 128 58.479 57.611 0.868 1
1 1320 . 2 1 1 A 130 130 ARG CB C 128 29.952 30.162 -0.210 1
1 1323 . 2 1 1 A 130 130 ARG N N 128 127.611 119.391 8.220 1
1 1324 . 2 1 1 A 131 131 PHE H H 129 9.315 7.959 1.356 1
1 1325 . 2 1 1 A 131 131 PHE HA H 129 4.878 5.015 -0.137 1
1 1331 . 2 1 1 A 131 131 PHE C C 129 175.058 173.818 1.240 1
1 1332 . 2 1 1 A 131 131 PHE CA C 129 55.953 56.058 -0.105 1
1 1333 . 2 1 1 A 131 131 PHE CB C 129 40.189 41.538 -1.349 1
1 1337 . 2 1 1 A 131 131 PHE N N 129 126.219 119.500 6.719 1
1 1338 . 2 1 1 A 132 132 GLN H H 130 8.160 8.382 -0.222 1
1 1339 . 2 1 1 A 132 132 GLN HA H 130 5.013 5.132 -0.119 1
1 1343 . 2 1 1 A 132 132 GLN CA C 130 54.498 54.624 -0.126 1
1 1344 . 2 1 1 A 132 132 GLN CB C 130 32.106 32.574 -0.468 1
1 1346 . 2 1 1 A 132 132 GLN N N 130 125.589 127.880 -2.291 1
1 1347 . 2 1 1 A 133 133 VAL H H 131 8.689 9.006 -0.317 1
1 1348 . 2 1 1 A 133 133 VAL HA H 131 4.529 4.437 0.092 1
1 1356 . 2 1 1 A 133 133 VAL C C 131 174.441 175.680 -1.239 1
1 1357 . 2 1 1 A 133 133 VAL CA C 131 60.758 62.036 -1.278 1
1 1358 . 2 1 1 A 133 133 VAL CB C 131 32.417 31.883 0.534 1
1 1361 . 2 1 1 A 133 133 VAL N N 131 122.441 126.791 -4.350 1
1 1362 . 2 1 1 A 134 134 TRP H H 132 9.256 9.280 -0.024 1
1 1363 . 2 1 1 A 134 134 TRP HA H 132 5.213 5.186 0.027 1
1 1371 . 2 1 1 A 134 134 TRP C C 132 174.575 175.759 -1.184 1
1 1372 . 2 1 1 A 134 134 TRP CA C 132 53.859 56.033 -2.174 1
1 1373 . 2 1 1 A 134 134 TRP CB C 132 31.311 31.421 -0.110 1
1 1379 . 2 1 1 A 134 134 TRP N N 132 130.303 128.266 2.037 1
1 1381 . 2 1 1 A 135 135 ASP H H 133 8.237 8.740 -0.503 1
1 1382 . 2 1 1 A 135 135 ASP HA H 133 6.018 6.108 -0.090 1
1 1385 . 2 1 1 A 135 135 ASP C C 133 177.020 175.188 1.832 1
1 1386 . 2 1 1 A 135 135 ASP CA C 133 53.321 52.971 0.350 1
1 1387 . 2 1 1 A 135 135 ASP CB C 133 41.514 43.174 -1.660 1
1 1388 . 2 1 1 A 135 135 ASP N N 133 125.516 121.935 3.581 1
1 1389 . 2 1 1 A 136 136 TYR H H 134 9.058 8.401 0.657 1
1 1390 . 2 1 1 A 136 136 TYR HA H 134 4.970 5.224 -0.254 1
1 1394 . 2 1 1 A 136 136 TYR C C 134 172.324 173.248 -0.924 1
1 1395 . 2 1 1 A 136 136 TYR CA C 134 55.982 56.405 -0.423 1
1 1396 . 2 1 1 A 136 136 TYR CB C 134 42.265 40.612 1.653 1
1 1399 . 2 1 1 A 136 136 TYR N N 134 120.315 117.690 2.625 1
1 1400 . 2 1 1 A 137 137 ALA H H 135 8.521 8.696 -0.175 1
1 1401 . 2 1 1 A 137 137 ALA HA H 135 4.280 4.357 -0.077 1
1 1405 . 2 1 1 A 137 137 ALA C C 135 178.561 177.414 1.147 1
1 1406 . 2 1 1 A 137 137 ALA CA C 135 49.550 51.186 -1.636 1
1 1407 . 2 1 1 A 137 137 ALA CB C 135 19.998 22.226 -2.228 1
1 1408 . 2 1 1 A 137 137 ALA N N 135 123.386 121.579 1.807 1
1 1409 . 2 1 1 A 138 138 GLU H H 136 8.678 8.967 -0.289 1
1 1410 . 2 1 1 A 138 138 GLU HA H 136 3.777 4.175 -0.398 1
1 1414 . 2 1 1 A 138 138 GLU C C 136 177.624 178.258 -0.634 1
1 1415 . 2 1 1 A 138 138 GLU CA C 136 60.527 59.369 1.158 1
1 1416 . 2 1 1 A 138 138 GLU CB C 136 29.020 29.339 -0.319 1
1 1418 . 2 1 1 A 138 138 GLU N N 136 121.774 120.863 0.911 1
1 1419 . 2 1 1 A 139 139 GLY H H 137 8.666 8.359 0.307 1
1 1420 . 2 1 1 A 139 139 GLY HA2 H 137 3.872 4.004 -0.132 1
1 1421 . 2 1 1 A 139 139 GLY HA3 H 137 3.872 4.017 -0.145 1
1 1422 . 2 1 1 A 139 139 GLY C C 137 175.122 174.681 0.441 1
1 1423 . 2 1 1 A 139 139 GLY CA C 137 46.093 45.736 0.357 1
1 1424 . 2 1 1 A 139 139 GLY N N 137 106.053 108.186 -2.133 1
1 1425 . 2 1 1 A 140 140 GLU H H 138 8.305 9.527 -1.222 1
1 1426 . 2 1 1 A 140 140 GLU HA H 138 4.754 4.687 0.067 1
1 1430 . 2 1 1 A 140 140 GLU C C 138 177.819 177.756 0.063 1
1 1431 . 2 1 1 A 140 140 GLU CA C 138 55.049 55.812 -0.763 1
1 1432 . 2 1 1 A 140 140 GLU CB C 138 30.504 31.125 -0.621 1
1 1434 . 2 1 1 A 140 140 GLU N N 138 117.485 117.087 0.398 1
1 1435 . 2 1 1 A 141 141 VAL H H 139 7.267 7.736 -0.469 1
1 1436 . 2 1 1 A 141 141 VAL HA H 139 3.422 3.911 -0.489 1
1 1444 . 2 1 1 A 141 141 VAL C C 139 175.454 177.186 -1.732 1
1 1445 . 2 1 1 A 141 141 VAL CA C 139 66.769 65.044 1.725 1
1 1446 . 2 1 1 A 141 141 VAL CB C 139 31.377 31.428 -0.051 1
1 1449 . 2 1 1 A 141 141 VAL N N 139 120.764 121.059 -0.295 1
1 1450 . 2 1 1 A 142 142 GLU H H 140 8.620 8.338 0.282 1
1 1451 . 2 1 1 A 142 142 GLU HA H 140 3.592 4.018 -0.426 1
1 1452 . 2 1 1 A 142 142 GLU C C 140 177.320 179.686 -2.366 1
1 1453 . 2 1 1 A 142 142 GLU CA C 140 62.607 59.410 3.197 1
1 1454 . 2 1 1 A 142 142 GLU CB C 140 26.759 29.207 -2.448 1
1 1455 . 2 1 1 A 142 142 GLU N N 140 120.048 121.894 -1.846 1
1 1456 . 2 1 1 A 143 143 THR H H 141 7.449 8.074 -0.625 1
1 1457 . 2 1 1 A 143 143 THR HA H 141 4.003 3.990 0.013 1
1 1462 . 2 1 1 A 143 143 THR C C 141 177.258 175.477 1.781 1
1 1463 . 2 1 1 A 143 143 THR CA C 141 65.490 67.271 -1.781 1
1 1464 . 2 1 1 A 143 143 THR CB C 141 68.641 68.226 0.415 1
1 1466 . 2 1 1 A 143 143 THR N N 141 114.073 118.456 -4.383 1
1 1467 . 2 1 1 A 144 144 MET H H 142 7.992 8.362 -0.370 1
1 1468 . 2 1 1 A 144 144 MET HA H 142 4.316 4.353 -0.037 1
1 1476 . 2 1 1 A 144 144 MET C C 142 178.233 178.724 -0.491 1
1 1477 . 2 1 1 A 144 144 MET CA C 142 57.743 58.753 -1.010 1
1 1478 . 2 1 1 A 144 144 MET CB C 142 31.326 32.112 -0.786 1
1 1481 . 2 1 1 A 144 144 MET N N 142 120.595 119.508 1.087 1
1 1482 . 2 1 1 A 145 145 LEU H H 143 7.847 8.125 -0.278 1
1 1483 . 2 1 1 A 145 145 LEU HA H 143 3.919 3.833 0.086 1
1 1491 . 2 1 1 A 145 145 LEU C C 143 178.774 179.415 -0.641 1
1 1492 . 2 1 1 A 145 145 LEU CA C 143 57.877 57.932 -0.055 1
1 1493 . 2 1 1 A 145 145 LEU CB C 143 40.951 41.262 -0.311 1
1 1497 . 2 1 1 A 145 145 LEU N N 143 119.410 119.808 -0.398 1
1 1498 . 2 1 1 A 146 146 ASP H H 144 8.431 8.689 -0.258 1
1 1499 . 2 1 1 A 146 146 ASP HA H 144 4.312 4.684 -0.372 1
1 1502 . 2 1 1 A 146 146 ASP C C 144 178.129 179.482 -1.353 1
1 1503 . 2 1 1 A 146 146 ASP CA C 144 57.464 57.524 -0.060 1
1 1504 . 2 1 1 A 146 146 ASP CB C 144 39.548 40.323 -0.775 1
1 1505 . 2 1 1 A 146 146 ASP N N 144 119.837 120.862 -1.025 1
1 1506 . 2 1 1 A 147 147 ARG H H 145 7.949 8.473 -0.524 1
1 1507 . 2 1 1 A 147 147 ARG HA H 145 4.050 4.145 -0.095 1
1 1512 . 2 1 1 A 147 147 ARG C C 145 179.547 178.977 0.570 1
1 1513 . 2 1 1 A 147 147 ARG CA C 145 58.972 59.728 -0.756 1
1 1514 . 2 1 1 A 147 147 ARG CB C 145 29.798 30.573 -0.775 1
1 1517 . 2 1 1 A 147 147 ARG N N 145 119.173 120.710 -1.537 1
1 1518 . 2 1 1 A 148 148 TYR H H 146 8.128 8.102 0.026 1
1 1519 . 2 1 1 A 148 148 TYR HA H 146 3.995 4.371 -0.376 1
1 1524 . 2 1 1 A 148 148 TYR C C 146 178.199 177.591 0.608 1
1 1525 . 2 1 1 A 148 148 TYR CA C 146 62.347 61.425 0.922 1
1 1526 . 2 1 1 A 148 148 TYR CB C 146 37.418 37.577 -0.159 1
1 1529 . 2 1 1 A 148 148 TYR N N 146 120.102 121.212 -1.110 1
1 1530 . 2 1 1 A 149 149 PHE H H 147 8.308 8.761 -0.453 1
1 1531 . 2 1 1 A 149 149 PHE HA H 147 4.013 4.151 -0.138 1
1 1535 . 2 1 1 A 149 149 PHE C C 147 177.574 178.312 -0.738 1
1 1536 . 2 1 1 A 149 149 PHE CA C 147 63.044 61.732 1.312 1
1 1537 . 2 1 1 A 149 149 PHE CB C 147 37.153 38.308 -1.155 1
1 1541 . 2 1 1 A 149 149 PHE N N 147 116.680 118.478 -1.798 1
1 1542 . 2 1 1 A 150 150 GLU H H 148 8.271 9.047 -0.776 1
1 1543 . 2 1 1 A 150 150 GLU HA H 148 4.030 4.008 0.022 1
1 1547 . 2 1 1 A 150 150 GLU C C 148 177.687 178.591 -0.904 1
1 1548 . 2 1 1 A 150 150 GLU CA C 148 58.746 59.352 -0.606 1
1 1549 . 2 1 1 A 150 150 GLU CB C 148 28.847 29.034 -0.187 1
1 1551 . 2 1 1 A 150 150 GLU N N 148 119.973 119.715 0.258 1
1 1552 . 2 1 1 A 151 151 ALA H H 149 6.992 7.597 -0.605 1
1 1553 . 2 1 1 A 151 151 ALA HA H 149 4.217 4.182 0.035 1
1 1557 . 2 1 1 A 151 151 ALA C C 149 178.190 177.552 0.638 1
1 1558 . 2 1 1 A 151 151 ALA CA C 149 52.779 54.262 -1.483 1
1 1559 . 2 1 1 A 151 151 ALA CB C 149 19.087 18.647 0.440 1
1 1560 . 2 1 1 A 151 151 ALA N N 149 118.629 121.914 -3.285 1
1 1561 . 2 1 1 A 152 152 TYR H H 150 7.722 7.741 -0.019 1
1 1562 . 2 1 1 A 152 152 TYR HA H 150 4.137 4.878 -0.741 1
1 1567 . 2 1 1 A 152 152 TYR C C 150 175.703 177.279 -1.576 1
1 1568 . 2 1 1 A 152 152 TYR CA C 150 59.260 57.864 1.396 1
1 1569 . 2 1 1 A 152 152 TYR CB C 150 39.165 39.919 -0.754 1
1 1572 . 2 1 1 A 152 152 TYR N N 150 118.767 113.428 5.339 1
1 1573 . 2 1 1 A 153 153 LEU H H 151 7.670 6.729 0.941 1
1 1574 . 2 1 1 A 153 153 LEU HA H 151 4.145 3.296 0.849 1
1 1584 . 2 1 1 A 153 153 LEU CA C 151 54.704 59.592 -4.888 1
1 1585 . 2 1 1 A 153 153 LEU CB C 151 40.520 40.337 0.183 1
1 1589 . 2 1 1 A 153 153 LEU N N 151 122.313 121.538 0.775 1
1 1590 . 2 1 1 A 154 154 PRO HA H 152 4.258 4.278 -0.020 1
1 1597 . 2 1 1 A 154 154 PRO C C 152 177.496 178.196 -0.700 1
1 1598 . 2 1 1 A 154 154 PRO CA C 152 63.899 65.602 -1.703 1
1 1599 . 2 1 1 A 154 154 PRO CB C 152 31.080 30.826 0.254 1
1 1602 . 2 1 1 A 155 155 GLN H H 153 8.023 8.825 -0.802 1
1 1603 . 2 1 1 A 155 155 GLN HA H 153 4.176 4.146 0.030 1
1 1607 . 2 1 1 A 155 155 GLN C C 153 176.636 178.559 -1.923 1
1 1608 . 2 1 1 A 155 155 GLN CA C 153 55.968 57.683 -1.715 1
1 1609 . 2 1 1 A 155 155 GLN CB C 153 28.723 28.702 0.021 1
1 1610 . 2 1 1 A 155 155 GLN N N 153 119.173 116.489 2.684 1
1 1611 . 2 1 1 A 156 156 LYS H H 154 8.113 8.090 0.023 1
1 1612 . 2 1 1 A 156 156 LYS HA H 154 4.196 4.214 -0.018 1
1 1619 . 2 1 1 A 156 156 LYS C C 154 56.493 179.119 -122.626 1
1 1620 . 2 1 1 A 156 156 LYS CA C 154 56.493 59.060 -2.567 1
1 1621 . 2 1 1 A 156 156 LYS CB C 154 32.037 32.198 -0.161 1
1 1625 . 2 1 1 A 156 156 LYS N N 154 122.788 121.088 1.700 1
1 1626 . 2 1 1 A 157 157 THR H H 155 8.013 8.009 0.004 1
1 1627 . 2 1 1 A 157 157 THR HA H 155 4.183 3.917 0.266 1
1 1632 . 2 1 1 A 157 157 THR C C 155 174.580 177.393 -2.813 1
1 1633 . 2 1 1 A 157 157 THR CA C 155 61.958 65.597 -3.639 1
1 1634 . 2 1 1 A 157 157 THR CB C 155 69.665 68.735 0.930 1
1 1636 . 2 1 1 A 157 157 THR N N 155 115.504 114.431 1.073 1
1 1637 . 2 1 1 A 158 158 ALA H H 156 8.170 7.442 0.728 1
1 1638 . 2 1 1 A 158 158 ALA HA H 156 4.220 4.130 0.090 1
1 1642 . 2 1 1 A 158 158 ALA CA C 156 52.492 55.069 -2.577 1
1 1643 . 2 1 1 A 158 158 ALA CB C 156 18.810 18.235 0.575 1
1 1644 . 2 1 1 A 158 158 ALA N N 156 126.825 122.568 4.257 1
1 1645 . 2 1 1 A 159 159 SER H H 157 7.762 7.327 0.435 1
1 1646 . 2 1 1 A 159 159 SER CA C 157 58.230 59.263 -1.033 1
1 1647 . 2 1 1 A 159 159 SER CB C 157 63.440 64.071 -0.631 1
1 1648 . 2 1 1 A 159 159 SER N N 157 123.078 115.306 7.772 1
1 1649 . 2 1 1 A 162 162 HIS HA H 160 4.845 4.603 0.242 1
1 1652 . 2 1 1 A 162 162 HIS CA C 160 53.590 55.386 -1.796 1
1 1653 . 2 1 1 A 162 162 HIS CB C 160 29.398 29.760 -0.362 1
1 1654 . 2 1 1 A 163 163 PRO HA H 161 4.388 4.326 0.062 1
1 1660 . 2 1 1 A 163 163 PRO C C 161 177.018 176.374 0.644 1
1 1661 . 2 1 1 A 163 163 PRO CA C 161 63.118 64.795 -1.677 1
1 1662 . 2 1 1 A 163 163 PRO CB C 161 31.668 32.096 -0.428 1
1 1665 . 2 1 1 A 164 164 SER H H 162 8.418 7.814 0.604 1
1 1666 . 2 1 1 A 164 164 SER HA H 162 4.338 4.612 -0.274 1
1 1668 . 2 1 1 A 164 164 SER C C 162 173.327 174.480 -1.153 1
1 1669 . 2 1 1 A 164 164 SER CA C 162 58.202 57.005 1.197 1
1 1670 . 2 1 1 A 164 164 SER CB C 162 64.080 64.717 -0.637 1
1 1671 . 2 1 1 A 164 164 SER N N 162 117.485 113.046 4.439 1
1 6 . 3 1 1 A 4 4 ALA H H 2 8.270 7.566 0.704 1
1 7 . 3 1 1 A 4 4 ALA HA H 2 4.212 4.370 -0.158 1
1 11 . 3 1 1 A 4 4 ALA C C 2 177.441 177.163 0.278 1
1 12 . 3 1 1 A 4 4 ALA CA C 2 52.280 52.331 -0.051 1
1 13 . 3 1 1 A 4 4 ALA CB C 2 18.880 19.428 -0.548 1
1 14 . 3 1 1 A 4 4 ALA N N 2 126.500 121.609 4.891 1
1 15 . 3 1 1 A 5 5 ALA H H 3 8.251 8.682 -0.431 1
1 16 . 3 1 1 A 5 5 ALA HA H 3 4.261 4.414 -0.153 1
1 20 . 3 1 1 A 5 5 ALA C C 3 177.824 178.442 -0.618 1
1 21 . 3 1 1 A 5 5 ALA CA C 3 52.347 52.385 -0.038 1
1 22 . 3 1 1 A 5 5 ALA CB C 3 18.869 19.350 -0.481 1
1 23 . 3 1 1 A 5 5 ALA N N 3 124.322 123.571 0.751 1
1 24 . 3 1 1 A 6 6 SER H H 4 8.158 9.090 -0.932 1
1 25 . 3 1 1 A 6 6 SER HA H 4 4.358 4.094 0.264 1
1 27 . 3 1 1 A 6 6 SER C C 4 175.222 175.041 0.181 1
1 28 . 3 1 1 A 6 6 SER CA C 4 58.438 60.835 -2.397 1
1 29 . 3 1 1 A 6 6 SER CB C 4 63.859 63.600 0.259 1
1 30 . 3 1 1 A 6 6 SER N N 4 115.338 117.045 -1.707 1
1 31 . 3 1 1 A 7 7 GLY H H 5 8.265 8.148 0.117 1
1 32 . 3 1 1 A 7 7 GLY HA2 H 5 3.900 3.901 -0.001 1
1 33 . 3 1 1 A 7 7 GLY C C 5 174.083 174.829 -0.746 1
1 34 . 3 1 1 A 7 7 GLY CA C 5 45.113 46.550 -1.437 1
1 35 . 3 1 1 A 7 7 GLY N N 5 111.360 109.420 1.940 1
1 36 . 3 1 1 A 8 8 GLU H H 6 8.100 8.185 -0.085 1
1 37 . 3 1 1 A 8 8 GLU HA H 6 4.209 4.410 -0.201 1
1 41 . 3 1 1 A 8 8 GLU C C 6 176.354 177.237 -0.883 1
1 42 . 3 1 1 A 8 8 GLU CA C 6 56.261 56.023 0.238 1
1 43 . 3 1 1 A 8 8 GLU CB C 6 29.830 31.872 -2.042 1
1 45 . 3 1 1 A 8 8 GLU N N 6 121.056 120.215 0.841 1
1 46 . 3 1 1 A 9 9 GLN H H 7 8.287 8.861 -0.574 1
1 47 . 3 1 1 A 9 9 GLN HA H 7 4.247 4.063 0.184 1
1 51 . 3 1 1 A 9 9 GLN C C 7 172.457 176.822 -4.365 1
1 52 . 3 1 1 A 9 9 GLN CA C 7 55.269 58.947 -3.678 1
1 53 . 3 1 1 A 9 9 GLN CB C 7 29.236 28.886 0.350 1
1 55 . 3 1 1 A 9 9 GLN N N 7 122.164 126.075 -3.911 1
1 56 . 3 1 1 A 10 10 ALA H H 8 8.368 7.794 0.574 1
1 57 . 3 1 1 A 10 10 ALA HA H 8 4.509 4.458 0.051 1
1 61 . 3 1 1 A 10 10 ALA CA C 8 50.341 50.791 -0.450 1
1 62 . 3 1 1 A 10 10 ALA CB C 8 18.140 18.231 -0.091 1
1 63 . 3 1 1 A 10 10 ALA N N 8 128.028 120.912 7.116 1
1 64 . 3 1 1 A 11 11 PRO HA H 9 4.437 4.558 -0.121 1
1 70 . 3 1 1 A 11 11 PRO C C 9 176.381 176.246 0.135 1
1 71 . 3 1 1 A 11 11 PRO CA C 9 63.298 62.361 0.937 1
1 72 . 3 1 1 A 11 11 PRO CB C 9 31.776 33.151 -1.375 1
1 75 . 3 1 1 A 12 12 CYS H H 10 8.056 8.327 -0.271 1
1 76 . 3 1 1 A 12 12 CYS HA H 10 4.717 5.024 -0.307 1
1 79 . 3 1 1 A 12 12 CYS C C 10 173.266 174.137 -0.871 1
1 80 . 3 1 1 A 12 12 CYS CA C 10 57.398 56.865 0.533 1
1 81 . 3 1 1 A 12 12 CYS CB C 10 29.165 30.396 -1.231 1
1 82 . 3 1 1 A 12 12 CYS N N 10 118.295 116.848 1.447 1
1 83 . 3 1 1 A 13 13 SER H H 11 9.815 8.905 0.910 1
1 84 . 3 1 1 A 13 13 SER HA H 11 5.227 5.741 -0.514 1
1 87 . 3 1 1 A 13 13 SER C C 11 173.648 173.924 -0.276 1
1 88 . 3 1 1 A 13 13 SER CA C 11 57.630 55.992 1.638 1
1 89 . 3 1 1 A 13 13 SER CB C 11 64.820 66.444 -1.624 1
1 90 . 3 1 1 A 13 13 SER N N 11 122.365 113.939 8.426 1
1 91 . 3 1 1 A 14 14 VAL H H 12 9.352 9.157 0.195 1
1 92 . 3 1 1 A 14 14 VAL HA H 12 4.696 5.371 -0.675 1
1 100 . 3 1 1 A 14 14 VAL C C 12 173.875 173.574 0.301 1
1 101 . 3 1 1 A 14 14 VAL CA C 12 60.146 60.874 -0.728 1
1 102 . 3 1 1 A 14 14 VAL CB C 12 34.499 35.748 -1.249 1
1 105 . 3 1 1 A 14 14 VAL N N 12 126.378 121.274 5.104 1
1 106 . 3 1 1 A 15 15 TYR H H 13 8.745 9.021 -0.276 1
1 111 . 3 1 1 A 15 15 TYR C C 13 173.345 173.872 -0.527 1
1 112 . 3 1 1 A 15 15 TYR CA C 13 56.186 54.520 1.666 1
1 113 . 3 1 1 A 15 15 TYR CB C 13 40.858 40.634 0.224 1
1 116 . 3 1 1 A 15 15 TYR N N 13 129.472 128.221 1.251 1
1 117 . 3 1 1 A 16 16 PHE H H 14 7.370 8.736 -1.366 1
1 118 . 3 1 1 A 16 16 PHE HA H 14 5.720 5.524 0.196 1
1 123 . 3 1 1 A 16 16 PHE C C 14 174.058 175.377 -1.319 1
1 124 . 3 1 1 A 16 16 PHE CA C 14 54.361 55.629 -1.268 1
1 125 . 3 1 1 A 16 16 PHE CB C 14 40.461 40.157 0.304 1
1 129 . 3 1 1 A 16 16 PHE N N 14 128.263 123.678 4.585 1
1 130 . 3 1 1 A 17 17 CYS H H 15 8.147 8.874 -0.727 1
1 131 . 3 1 1 A 17 17 CYS CA C 15 56.570 58.396 -1.826 1
1 132 . 3 1 1 A 17 17 CYS CB C 15 29.690 28.791 0.899 1
1 133 . 3 1 1 A 17 17 CYS N N 15 126.188 122.446 3.742 1
1 134 . 3 1 1 A 18 18 GLY HA2 H 16 3.819 3.797 0.022 1
1 135 . 3 1 1 A 18 18 GLY C C 16 173.374 171.980 1.394 1
1 136 . 3 1 1 A 18 18 GLY CA C 16 45.510 45.340 0.170 1
1 137 . 3 1 1 A 19 19 SER H H 17 8.533 9.848 -1.315 1
1 138 . 3 1 1 A 19 19 SER HA H 17 4.505 5.165 -0.660 1
1 139 . 3 1 1 A 19 19 SER CA C 17 58.700 57.395 1.305 1
1 140 . 3 1 1 A 19 19 SER CB C 17 63.810 64.051 -0.241 1
1 141 . 3 1 1 A 19 19 SER N N 17 117.300 114.690 2.610 1
1 142 . 3 1 1 A 20 20 ILE HA H 18 4.309 4.654 -0.345 1
1 152 . 3 1 1 A 20 20 ILE CA C 18 61.317 61.137 0.180 1
1 153 . 3 1 1 A 20 20 ILE CB C 18 38.302 39.244 -0.942 1
1 157 . 3 1 1 A 21 21 ARG HA H 19 4.172 4.710 -0.538 1
1 160 . 3 1 1 A 21 21 ARG C C 19 177.118 176.922 0.196 1
1 161 . 3 1 1 A 21 21 ARG CA C 19 56.960 55.621 1.339 1
1 162 . 3 1 1 A 21 21 ARG CB C 19 29.568 30.637 -1.069 1
1 165 . 3 1 1 A 22 22 GLY H H 20 8.685 7.985 0.700 1
1 166 . 3 1 1 A 22 22 GLY HA2 H 20 3.801 4.068 -0.267 1
1 167 . 3 1 1 A 22 22 GLY HA3 H 20 3.923 4.079 -0.156 1
1 168 . 3 1 1 A 22 22 GLY C C 20 174.814 173.564 1.250 1
1 169 . 3 1 1 A 22 22 GLY CA C 20 45.289 45.329 -0.040 1
1 170 . 3 1 1 A 22 22 GLY N N 20 110.145 107.787 2.358 1
1 171 . 3 1 1 A 23 23 GLY H H 21 8.058 7.588 0.470 1
1 172 . 3 1 1 A 23 23 GLY HA2 H 21 3.998 4.074 -0.076 1
1 173 . 3 1 1 A 23 23 GLY HA3 H 21 4.237 4.080 0.157 1
1 174 . 3 1 1 A 23 23 GLY C C 21 174.762 173.540 1.222 1
1 175 . 3 1 1 A 23 23 GLY CA C 21 45.025 45.589 -0.564 1
1 176 . 3 1 1 A 23 23 GLY N N 21 109.327 107.480 1.847 1
1 177 . 3 1 1 A 24 24 ARG H H 22 8.376 8.633 -0.257 1
1 178 . 3 1 1 A 24 24 ARG HA H 22 4.086 4.471 -0.385 1
1 184 . 3 1 1 A 24 24 ARG C C 22 178.178 177.231 0.947 1
1 185 . 3 1 1 A 24 24 ARG CA C 22 57.471 56.174 1.297 1
1 186 . 3 1 1 A 24 24 ARG CB C 22 29.653 32.577 -2.924 1
1 189 . 3 1 1 A 24 24 ARG N N 22 120.861 118.643 2.218 1
1 190 . 3 1 1 A 25 25 GLU H H 23 8.831 8.227 0.604 1
1 191 . 3 1 1 A 25 25 GLU HA H 23 4.015 4.002 0.013 1
1 195 . 3 1 1 A 25 25 GLU C C 23 178.005 178.896 -0.891 1
1 196 . 3 1 1 A 25 25 GLU CA C 23 58.920 59.351 -0.431 1
1 197 . 3 1 1 A 25 25 GLU CB C 23 28.592 29.087 -0.495 1
1 199 . 3 1 1 A 25 25 GLU N N 23 121.243 120.318 0.925 1
1 200 . 3 1 1 A 26 26 ASP H H 24 7.897 8.156 -0.259 1
1 201 . 3 1 1 A 26 26 ASP HA H 24 4.516 4.088 0.428 1
1 203 . 3 1 1 A 26 26 ASP C C 24 176.455 177.665 -1.210 1
1 204 . 3 1 1 A 26 26 ASP CA C 24 55.122 56.051 -0.929 1
1 205 . 3 1 1 A 26 26 ASP CB C 24 39.888 39.690 0.198 1
1 206 . 3 1 1 A 26 26 ASP N N 24 119.541 119.418 0.123 1
1 207 . 3 1 1 A 27 27 GLN H H 25 7.696 8.449 -0.753 1
1 208 . 3 1 1 A 27 27 GLN HA H 25 3.704 4.040 -0.336 1
1 212 . 3 1 1 A 27 27 GLN C C 25 177.016 178.057 -1.041 1
1 213 . 3 1 1 A 27 27 GLN CA C 25 59.501 58.772 0.729 1
1 214 . 3 1 1 A 27 27 GLN CB C 25 27.762 28.816 -1.054 1
1 216 . 3 1 1 A 27 27 GLN N N 25 119.471 119.905 -0.434 1
1 217 . 3 1 1 A 28 28 ALA H H 26 8.227 7.581 0.646 1
1 218 . 3 1 1 A 28 28 ALA HA H 26 4.072 3.931 0.141 1
1 222 . 3 1 1 A 28 28 ALA C C 26 180.567 179.767 0.800 1
1 223 . 3 1 1 A 28 28 ALA CA C 26 54.627 55.196 -0.569 1
1 224 . 3 1 1 A 28 28 ALA CB C 26 17.355 18.749 -1.394 1
1 225 . 3 1 1 A 28 28 ALA N N 26 122.362 122.091 0.271 1
1 226 . 3 1 1 A 29 29 LEU H H 27 7.533 7.762 -0.229 1
1 227 . 3 1 1 A 29 29 LEU HA H 27 4.050 3.989 0.061 1
1 237 . 3 1 1 A 29 29 LEU C C 27 178.752 178.022 0.730 1
1 238 . 3 1 1 A 29 29 LEU CA C 27 57.578 57.417 0.161 1
1 239 . 3 1 1 A 29 29 LEU CB C 27 40.734 41.423 -0.689 1
1 243 . 3 1 1 A 29 29 LEU N N 27 122.255 119.605 2.650 1
1 244 . 3 1 1 A 30 30 TYR H H 28 8.473 8.055 0.418 1
1 245 . 3 1 1 A 30 30 TYR HA H 28 4.049 3.911 0.138 1
1 250 . 3 1 1 A 30 30 TYR C C 28 177.736 178.567 -0.831 1
1 251 . 3 1 1 A 30 30 TYR CA C 28 59.817 60.164 -0.347 1
1 252 . 3 1 1 A 30 30 TYR CB C 28 36.140 37.102 -0.962 1
1 255 . 3 1 1 A 30 30 TYR N N 28 120.403 118.782 1.621 1
1 256 . 3 1 1 A 31 31 ALA H H 29 8.008 8.357 -0.349 1
1 257 . 3 1 1 A 31 31 ALA HA H 29 4.005 4.197 -0.192 1
1 261 . 3 1 1 A 31 31 ALA C C 29 180.879 179.490 1.389 1
1 262 . 3 1 1 A 31 31 ALA CA C 29 54.914 55.124 -0.210 1
1 263 . 3 1 1 A 31 31 ALA CB C 29 17.375 18.248 -0.873 1
1 264 . 3 1 1 A 31 31 ALA N N 29 120.771 123.060 -2.289 1
1 265 . 3 1 1 A 32 32 ARG H H 30 7.596 7.564 0.032 1
1 266 . 3 1 1 A 32 32 ARG HA H 30 3.916 4.039 -0.123 1
1 273 . 3 1 1 A 32 32 ARG C C 30 179.919 178.066 1.853 1
1 274 . 3 1 1 A 32 32 ARG CA C 30 59.014 59.056 -0.042 1
1 275 . 3 1 1 A 32 32 ARG CB C 30 30.531 29.794 0.737 1
1 278 . 3 1 1 A 32 32 ARG N N 30 120.365 117.925 2.440 1
1 279 . 3 1 1 A 33 33 ILE H H 31 8.066 8.617 -0.551 1
1 280 . 3 1 1 A 33 33 ILE HA H 31 3.120 3.683 -0.563 1
1 290 . 3 1 1 A 33 33 ILE C C 31 177.051 177.434 -0.383 1
1 291 . 3 1 1 A 33 33 ILE CA C 31 65.757 64.220 1.537 1
1 292 . 3 1 1 A 33 33 ILE CB C 31 36.928 37.315 -0.387 1
1 296 . 3 1 1 A 33 33 ILE N N 31 121.608 119.749 1.859 1
1 297 . 3 1 1 A 34 34 VAL H H 32 8.148 8.726 -0.578 1
1 298 . 3 1 1 A 34 34 VAL HA H 32 2.954 3.497 -0.543 1
1 306 . 3 1 1 A 34 34 VAL C C 32 177.159 177.842 -0.683 1
1 307 . 3 1 1 A 34 34 VAL CA C 32 67.220 66.345 0.875 1
1 308 . 3 1 1 A 34 34 VAL CB C 32 31.039 31.187 -0.148 1
1 311 . 3 1 1 A 34 34 VAL N N 32 119.318 122.001 -2.683 1
1 312 . 3 1 1 A 35 35 SER H H 33 7.826 8.525 -0.699 1
1 313 . 3 1 1 A 35 35 SER HA H 33 3.868 4.076 -0.208 1
1 316 . 3 1 1 A 35 35 SER C C 33 176.779 177.203 -0.424 1
1 317 . 3 1 1 A 35 35 SER CA C 33 62.000 61.625 0.375 1
1 318 . 3 1 1 A 35 35 SER CB C 33 62.789 62.400 0.389 1
1 319 . 3 1 1 A 35 35 SER N N 33 111.936 114.831 -2.895 1
1 320 . 3 1 1 A 36 36 ARG H H 34 7.405 7.485 -0.080 1
1 321 . 3 1 1 A 36 36 ARG HA H 34 4.070 4.089 -0.019 1
1 323 . 3 1 1 A 36 36 ARG C C 34 178.047 178.312 -0.265 1
1 324 . 3 1 1 A 36 36 ARG CA C 34 56.108 59.017 -2.909 1
1 325 . 3 1 1 A 36 36 ARG CB C 34 28.837 30.292 -1.455 1
1 326 . 3 1 1 A 36 36 ARG N N 34 120.909 122.219 -1.310 1
1 327 . 3 1 1 A 37 37 LEU H H 35 8.301 8.273 0.028 1
1 328 . 3 1 1 A 37 37 LEU HA H 35 3.620 3.578 0.042 1
1 336 . 3 1 1 A 37 37 LEU C C 35 178.446 178.969 -0.523 1
1 337 . 3 1 1 A 37 37 LEU CA C 35 57.640 57.818 -0.178 1
1 338 . 3 1 1 A 37 37 LEU CB C 35 41.584 41.672 -0.088 1
1 342 . 3 1 1 A 37 37 LEU N N 35 118.567 119.994 -1.427 1
1 343 . 3 1 1 A 38 38 ARG H H 36 7.379 8.248 -0.869 1
1 344 . 3 1 1 A 38 38 ARG HA H 36 4.340 3.963 0.377 1
1 350 . 3 1 1 A 38 38 ARG C C 36 177.895 178.741 -0.846 1
1 351 . 3 1 1 A 38 38 ARG CA C 36 57.785 59.067 -1.282 1
1 352 . 3 1 1 A 38 38 ARG CB C 36 29.775 29.586 0.189 1
1 355 . 3 1 1 A 38 38 ARG N N 36 115.352 119.812 -4.460 1
1 356 . 3 1 1 A 39 39 ARG H H 37 7.240 7.962 -0.722 1
1 357 . 3 1 1 A 39 39 ARG HA H 37 3.743 4.110 -0.367 1
1 363 . 3 1 1 A 39 39 ARG C C 37 176.988 178.925 -1.937 1
1 364 . 3 1 1 A 39 39 ARG CA C 37 57.605 58.633 -1.028 1
1 365 . 3 1 1 A 39 39 ARG CB C 37 28.925 30.499 -1.574 1
1 368 . 3 1 1 A 39 39 ARG N N 37 117.410 118.815 -1.405 1
1 369 . 3 1 1 A 40 40 TYR H H 38 7.296 8.212 -0.916 1
1 370 . 3 1 1 A 40 40 TYR HA H 38 4.319 4.173 0.146 1
1 375 . 3 1 1 A 40 40 TYR C C 38 175.001 176.160 -1.159 1
1 376 . 3 1 1 A 40 40 TYR CA C 38 57.730 60.165 -2.435 1
1 377 . 3 1 1 A 40 40 TYR CB C 38 39.343 37.806 1.537 1
1 380 . 3 1 1 A 40 40 TYR N N 38 116.937 118.885 -1.948 1
1 381 . 3 1 1 A 41 41 GLY H H 39 7.325 7.599 -0.274 1
1 382 . 3 1 1 A 41 41 GLY HA2 H 39 3.953 4.065 -0.112 1
1 383 . 3 1 1 A 41 41 GLY C C 39 171.302 172.214 -0.912 1
1 384 . 3 1 1 A 41 41 GLY CA C 39 45.590 45.605 -0.015 1
1 385 . 3 1 1 A 41 41 GLY N N 39 105.596 104.400 1.196 1
1 386 . 3 1 1 A 42 42 LYS H H 40 8.186 8.902 -0.716 1
1 387 . 3 1 1 A 42 42 LYS HA H 40 4.205 4.747 -0.542 1
1 393 . 3 1 1 A 42 42 LYS C C 40 175.672 175.312 0.360 1
1 394 . 3 1 1 A 42 42 LYS CA C 40 55.241 55.267 -0.026 1
1 395 . 3 1 1 A 42 42 LYS CB C 40 32.889 34.488 -1.599 1
1 399 . 3 1 1 A 42 42 LYS N N 40 120.341 122.317 -1.976 1
1 400 . 3 1 1 A 43 43 VAL H H 41 8.610 8.825 -0.215 1
1 401 . 3 1 1 A 43 43 VAL HA H 41 4.416 4.527 -0.111 1
1 409 . 3 1 1 A 43 43 VAL C C 41 175.997 175.374 0.623 1
1 410 . 3 1 1 A 43 43 VAL CA C 41 61.331 62.296 -0.965 1
1 411 . 3 1 1 A 43 43 VAL CB C 41 30.573 32.386 -1.813 1
1 414 . 3 1 1 A 43 43 VAL N N 41 127.312 123.822 3.490 1
1 415 . 3 1 1 A 44 44 LEU H H 42 8.894 8.356 0.538 1
1 416 . 3 1 1 A 44 44 LEU HA H 42 4.496 3.584 0.912 1
1 424 . 3 1 1 A 44 44 LEU CA C 42 54.522 56.621 -2.099 1
1 425 . 3 1 1 A 44 44 LEU CB C 42 40.980 42.028 -1.048 1
1 429 . 3 1 1 A 44 44 LEU N N 42 130.261 127.986 2.275 1
1 430 . 3 1 1 A 45 45 THR HA H 43 4.263 4.138 0.125 1
1 435 . 3 1 1 A 45 45 THR CA C 43 61.033 60.112 0.921 1
1 436 . 3 1 1 A 45 45 THR CB C 43 69.768 66.357 3.411 1
1 440 . 3 1 1 A 46 46 GLU CA C 44 56.411 58.383 -1.972 1
1 441 . 3 1 1 A 46 46 GLU CB C 44 29.827 29.148 0.679 1
1 443 . 3 1 1 A 47 47 HIS HA H 45 4.549 4.282 0.267 1
1 447 . 3 1 1 A 47 47 HIS C C 45 174.812 177.102 -2.290 1
1 448 . 3 1 1 A 47 47 HIS CA C 45 56.107 59.092 -2.985 1
1 449 . 3 1 1 A 47 47 HIS CB C 45 29.080 28.373 0.707 1
1 451 . 3 1 1 A 48 48 VAL H H 46 7.826 7.178 0.648 1
1 452 . 3 1 1 A 48 48 VAL HA H 46 4.024 3.084 0.940 1
1 460 . 3 1 1 A 48 48 VAL C C 46 175.697 177.546 -1.849 1
1 461 . 3 1 1 A 48 48 VAL CA C 46 61.841 65.256 -3.415 1
1 462 . 3 1 1 A 48 48 VAL CB C 46 32.600 31.209 1.391 1
1 465 . 3 1 1 A 48 48 VAL N N 46 121.117 121.418 -0.301 1
1 466 . 3 1 1 A 49 49 ALA H H 47 8.237 8.034 0.203 1
1 467 . 3 1 1 A 49 49 ALA HA H 47 4.281 4.236 0.045 1
1 471 . 3 1 1 A 49 49 ALA C C 47 177.173 178.333 -1.160 1
1 472 . 3 1 1 A 49 49 ALA CA C 47 52.207 54.736 -2.529 1
1 473 . 3 1 1 A 49 49 ALA CB C 47 19.064 18.321 0.743 1
1 474 . 3 1 1 A 49 49 ALA N N 47 126.817 122.837 3.980 1
1 475 . 3 1 1 A 50 50 ASP H H 48 8.029 8.312 -0.283 1
1 476 . 3 1 1 A 50 50 ASP HA H 48 4.436 4.675 -0.239 1
1 479 . 3 1 1 A 50 50 ASP C C 48 176.124 176.804 -0.680 1
1 480 . 3 1 1 A 50 50 ASP CA C 48 54.447 52.954 1.493 1
1 481 . 3 1 1 A 50 50 ASP CB C 48 40.877 39.402 1.475 1
1 482 . 3 1 1 A 50 50 ASP N N 48 119.687 117.560 2.127 1
1 483 . 3 1 1 A 51 51 ALA H H 49 8.094 7.928 0.166 1
1 484 . 3 1 1 A 51 51 ALA HA H 49 4.134 4.661 -0.527 1
1 488 . 3 1 1 A 51 51 ALA C C 49 177.835 178.400 -0.565 1
1 489 . 3 1 1 A 51 51 ALA CA C 49 52.900 52.436 0.464 1
1 490 . 3 1 1 A 51 51 ALA CB C 49 18.942 21.404 -2.462 1
1 491 . 3 1 1 A 51 51 ALA N N 49 124.400 124.135 0.265 1
1 492 . 3 1 1 A 52 52 GLU H H 50 8.243 8.357 -0.114 1
1 493 . 3 1 1 A 52 52 GLU HA H 50 4.152 4.147 0.005 1
1 497 . 3 1 1 A 52 52 GLU C C 50 176.456 178.518 -2.062 1
1 498 . 3 1 1 A 52 52 GLU CA C 50 56.480 58.311 -1.831 1
1 499 . 3 1 1 A 52 52 GLU CB C 50 29.470 28.700 0.770 1
1 501 . 3 1 1 A 52 52 GLU N N 50 118.917 118.070 0.847 1
1 502 . 3 1 1 A 53 53 LEU H H 51 7.839 7.628 0.211 1
1 503 . 3 1 1 A 53 53 LEU HA H 51 4.229 4.053 0.176 1
1 513 . 3 1 1 A 53 53 LEU C C 51 177.058 177.304 -0.246 1
1 514 . 3 1 1 A 53 53 LEU CA C 51 54.625 57.823 -3.198 1
1 515 . 3 1 1 A 53 53 LEU CB C 51 42.125 41.958 0.167 1
1 519 . 3 1 1 A 53 53 LEU N N 51 122.169 120.602 1.567 1
1 520 . 3 1 1 A 54 54 GLU H H 52 8.104 7.975 0.129 1
1 521 . 3 1 1 A 54 54 GLU HA H 52 4.470 4.555 -0.085 1
1 525 . 3 1 1 A 54 54 GLU CA C 52 54.286 57.724 -3.438 1
1 526 . 3 1 1 A 54 54 GLU CB C 52 29.268 32.258 -2.990 1
1 528 . 3 1 1 A 54 54 GLU N N 52 123.040 115.466 7.574 1
1 529 . 3 1 1 A 55 55 PRO HA H 53 4.310 4.595 -0.285 1
1 536 . 3 1 1 A 55 55 PRO C C 53 177.019 175.340 1.679 1
1 537 . 3 1 1 A 55 55 PRO CA C 53 63.075 62.792 0.283 1
1 538 . 3 1 1 A 55 55 PRO CB C 53 31.329 31.628 -0.299 1
1 541 . 3 1 1 A 56 56 LEU H H 54 8.263 8.566 -0.303 1
1 542 . 3 1 1 A 56 56 LEU HA H 54 4.237 4.866 -0.629 1
1 552 . 3 1 1 A 56 56 LEU C C 54 178.055 176.326 1.729 1
1 553 . 3 1 1 A 56 56 LEU CA C 54 55.018 53.707 1.311 1
1 554 . 3 1 1 A 56 56 LEU CB C 54 41.990 44.814 -2.824 1
1 558 . 3 1 1 A 56 56 LEU N N 54 122.728 124.917 -2.189 1
1 559 . 3 1 1 A 57 57 GLY H H 55 8.231 8.656 -0.425 1
1 560 . 3 1 1 A 57 57 GLY HA2 H 55 3.911 4.081 -0.170 1
1 561 . 3 1 1 A 57 57 GLY HA3 H 55 3.808 4.086 -0.278 1
1 562 . 3 1 1 A 57 57 GLY C C 55 174.379 174.863 -0.484 1
1 563 . 3 1 1 A 57 57 GLY CA C 55 45.092 45.343 -0.251 1
1 564 . 3 1 1 A 57 57 GLY N N 55 110.035 113.406 -3.371 1
1 565 . 3 1 1 A 58 58 GLU H H 56 8.241 8.527 -0.286 1
1 566 . 3 1 1 A 58 58 GLU HA H 56 4.136 3.983 0.153 1
1 570 . 3 1 1 A 58 58 GLU C C 56 176.868 176.977 -0.109 1
1 571 . 3 1 1 A 58 58 GLU CA C 56 56.734 58.969 -2.235 1
1 572 . 3 1 1 A 58 58 GLU CB C 56 29.584 28.268 1.316 1
1 574 . 3 1 1 A 58 58 GLU N N 56 121.173 112.015 9.158 1
1 575 . 3 1 1 A 59 59 GLU H H 57 8.419 8.897 -0.478 1
1 576 . 3 1 1 A 59 59 GLU HA H 57 4.074 4.109 -0.035 1
1 580 . 3 1 1 A 59 59 GLU C C 57 176.502 177.466 -0.964 1
1 581 . 3 1 1 A 59 59 GLU CA C 57 56.842 59.102 -2.260 1
1 582 . 3 1 1 A 59 59 GLU CB C 57 29.267 29.561 -0.294 1
1 584 . 3 1 1 A 59 59 GLU N N 57 121.777 120.381 1.396 1
1 585 . 3 1 1 A 60 60 ALA H H 58 8.077 7.752 0.325 1
1 586 . 3 1 1 A 60 60 ALA HA H 58 4.134 4.544 -0.410 1
1 590 . 3 1 1 A 60 60 ALA CA C 58 52.432 51.430 1.002 1
1 591 . 3 1 1 A 60 60 ALA CB C 58 18.743 17.785 0.958 1
1 592 . 3 1 1 A 60 60 ALA N N 58 125.120 119.485 5.635 1
1 593 . 3 1 1 A 61 61 ALA H H 59 8.041 8.431 -0.390 1
1 594 . 3 1 1 A 61 61 ALA HA H 59 4.131 4.599 -0.468 1
1 598 . 3 1 1 A 61 61 ALA C C 59 178.147 178.705 -0.558 1
1 599 . 3 1 1 A 61 61 ALA CA C 59 52.586 52.486 0.100 1
1 600 . 3 1 1 A 61 61 ALA CB C 59 18.692 21.587 -2.895 1
1 601 . 3 1 1 A 61 61 ALA N N 59 123.857 121.845 2.012 1
1 602 . 3 1 1 A 62 62 GLY H H 60 8.069 8.795 -0.726 1
1 603 . 3 1 1 A 62 62 GLY HA2 H 60 3.810 3.972 -0.162 1
1 604 . 3 1 1 A 62 62 GLY HA3 H 60 3.888 4.000 -0.112 1
1 605 . 3 1 1 A 62 62 GLY C C 60 174.914 175.404 -0.490 1
1 606 . 3 1 1 A 62 62 GLY CA C 60 45.320 46.523 -1.203 1
1 607 . 3 1 1 A 62 62 GLY N N 60 107.924 106.923 1.001 1
1 608 . 3 1 1 A 63 63 GLY H H 61 8.118 8.718 -0.600 1
1 609 . 3 1 1 A 63 63 GLY HA2 H 61 4.008 4.121 -0.113 1
1 610 . 3 1 1 A 63 63 GLY HA3 H 61 3.893 4.199 -0.306 1
1 611 . 3 1 1 A 63 63 GLY C C 61 174.743 175.271 -0.528 1
1 612 . 3 1 1 A 63 63 GLY CA C 61 45.202 46.423 -1.221 1
1 613 . 3 1 1 A 63 63 GLY N N 61 109.441 107.056 2.385 1
1 614 . 3 1 1 A 64 64 ASP H H 62 8.305 8.360 -0.055 1
1 615 . 3 1 1 A 64 64 ASP HA H 62 4.240 4.306 -0.066 1
1 618 . 3 1 1 A 64 64 ASP C C 62 177.571 177.786 -0.215 1
1 619 . 3 1 1 A 64 64 ASP CA C 62 57.210 57.214 -0.004 1
1 620 . 3 1 1 A 64 64 ASP CB C 62 40.142 40.141 0.001 1
1 621 . 3 1 1 A 64 64 ASP N N 62 121.568 120.068 1.500 1
1 622 . 3 1 1 A 65 65 GLN H H 63 8.337 7.881 0.456 1
1 623 . 3 1 1 A 65 65 GLN HA H 63 4.138 4.001 0.137 1
1 628 . 3 1 1 A 65 65 GLN C C 63 177.490 178.334 -0.844 1
1 629 . 3 1 1 A 65 65 GLN CA C 63 58.643 58.679 -0.036 1
1 630 . 3 1 1 A 65 65 GLN CB C 63 27.803 28.466 -0.663 1
1 632 . 3 1 1 A 65 65 GLN N N 63 119.700 118.997 0.703 1
1 633 . 3 1 1 A 66 66 PHE H H 64 7.658 8.251 -0.593 1
1 634 . 3 1 1 A 66 66 PHE HA H 64 4.170 4.312 -0.142 1
1 638 . 3 1 1 A 66 66 PHE C C 64 176.872 177.015 -0.143 1
1 639 . 3 1 1 A 66 66 PHE CA C 64 60.158 61.079 -0.921 1
1 640 . 3 1 1 A 66 66 PHE CB C 64 38.490 39.335 -0.845 1
1 643 . 3 1 1 A 66 66 PHE N N 64 121.036 120.768 0.268 1
1 644 . 3 1 1 A 67 67 ILE H H 65 7.646 8.260 -0.614 1
1 645 . 3 1 1 A 67 67 ILE HA H 65 3.426 3.143 0.283 1
1 655 . 3 1 1 A 67 67 ILE CA C 65 63.377 63.575 -0.198 1
1 656 . 3 1 1 A 67 67 ILE CB C 65 37.057 37.369 -0.312 1
1 660 . 3 1 1 A 67 67 ILE N N 65 121.372 119.864 1.508 1
1 661 . 3 1 1 A 68 68 HIS H H 66 7.945 7.973 -0.028 1
1 662 . 3 1 1 A 68 68 HIS HA H 66 4.005 4.135 -0.130 1
1 665 . 3 1 1 A 68 68 HIS CA C 66 59.915 59.316 0.599 1
1 668 . 3 1 1 A 68 68 HIS N N 66 120.036 121.047 -1.011 1
1 669 . 3 1 1 A 69 69 GLU HA H 67 3.677 3.856 -0.179 1
1 673 . 3 1 1 A 69 69 GLU CA C 67 58.490 59.061 -0.571 1
1 674 . 3 1 1 A 69 69 GLU CB C 67 29.290 29.349 -0.059 1
1 676 . 3 1 1 A 70 70 GLN H H 68 8.017 7.601 0.416 1
1 677 . 3 1 1 A 70 70 GLN HA H 68 3.426 3.835 -0.409 1
1 678 . 3 1 1 A 70 70 GLN C C 68 179.280 178.105 1.175 1
1 679 . 3 1 1 A 70 70 GLN CA C 68 57.561 58.662 -1.101 1
1 680 . 3 1 1 A 70 70 GLN CB C 68 28.530 28.177 0.353 1
1 682 . 3 1 1 A 70 70 GLN N N 68 120.410 119.030 1.380 1
1 683 . 3 1 1 A 71 71 ASP HA H 69 4.440 4.659 -0.219 1
1 684 . 3 1 1 A 71 71 ASP C C 69 177.402 178.487 -1.085 1
1 685 . 3 1 1 A 71 71 ASP CA C 69 56.290 56.969 -0.679 1
1 686 . 3 1 1 A 72 72 LEU H H 70 7.952 8.431 -0.479 1
1 687 . 3 1 1 A 72 72 LEU HA H 70 3.775 3.892 -0.117 1
1 697 . 3 1 1 A 72 72 LEU C C 70 178.316 178.249 0.067 1
1 698 . 3 1 1 A 72 72 LEU CA C 70 56.101 57.708 -1.607 1
1 699 . 3 1 1 A 72 72 LEU CB C 70 39.872 41.152 -1.280 1
1 703 . 3 1 1 A 72 72 LEU N N 70 120.832 121.247 -0.415 1
1 704 . 3 1 1 A 73 73 ASN H H 71 7.723 8.082 -0.359 1
1 705 . 3 1 1 A 73 73 ASN HA H 71 4.270 4.299 -0.029 1
1 708 . 3 1 1 A 73 73 ASN C C 71 178.193 178.168 0.025 1
1 709 . 3 1 1 A 73 73 ASN CA C 71 55.970 56.394 -0.424 1
1 710 . 3 1 1 A 73 73 ASN CB C 71 37.640 38.234 -0.594 1
1 711 . 3 1 1 A 73 73 ASN N N 71 119.295 116.168 3.127 1
1 712 . 3 1 1 A 74 74 TRP H H 72 7.811 8.047 -0.236 1
1 713 . 3 1 1 A 74 74 TRP HA H 72 4.500 4.466 0.034 1
1 720 . 3 1 1 A 74 74 TRP CA C 72 58.480 59.658 -1.178 1
1 721 . 3 1 1 A 74 74 TRP CB C 72 28.920 29.597 -0.677 1
1 727 . 3 1 1 A 74 74 TRP N N 72 121.490 120.892 0.598 1
1 729 . 3 1 1 A 75 75 LEU H H 73 8.412 8.692 -0.280 1
1 730 . 3 1 1 A 75 75 LEU HA H 73 3.290 3.456 -0.166 1
1 739 . 3 1 1 A 75 75 LEU C C 73 178.562 178.524 0.038 1
1 740 . 3 1 1 A 75 75 LEU CA C 73 58.226 57.538 0.688 1
1 741 . 3 1 1 A 75 75 LEU CB C 73 41.200 40.910 0.290 1
1 745 . 3 1 1 A 75 75 LEU N N 73 121.065 121.078 -0.013 1
1 746 . 3 1 1 A 76 76 GLN H H 74 7.648 7.691 -0.043 1
1 747 . 3 1 1 A 76 76 GLN HA H 74 3.657 4.092 -0.435 1
1 752 . 3 1 1 A 76 76 GLN C C 74 178.616 177.703 0.913 1
1 753 . 3 1 1 A 76 76 GLN CA C 74 58.777 58.999 -0.222 1
1 754 . 3 1 1 A 76 76 GLN CB C 74 28.163 28.183 -0.020 1
1 756 . 3 1 1 A 76 76 GLN N N 74 113.985 118.760 -4.775 1
1 757 . 3 1 1 A 77 77 GLN H H 75 7.465 7.820 -0.355 1
1 758 . 3 1 1 A 77 77 GLN HA H 75 4.134 4.442 -0.308 1
1 761 . 3 1 1 A 77 77 GLN C C 75 176.223 175.851 0.372 1
1 762 . 3 1 1 A 77 77 GLN CA C 75 56.203 55.628 0.575 1
1 763 . 3 1 1 A 77 77 GLN CB C 75 29.524 29.505 0.019 1
1 765 . 3 1 1 A 77 77 GLN N N 75 117.481 116.745 0.736 1
1 766 . 3 1 1 A 78 78 ALA H H 76 7.420 7.217 0.203 1
1 767 . 3 1 1 A 78 78 ALA HA H 76 3.864 4.245 -0.381 1
1 771 . 3 1 1 A 78 78 ALA C C 76 176.733 177.119 -0.386 1
1 772 . 3 1 1 A 78 78 ALA CA C 76 52.529 52.955 -0.426 1
1 773 . 3 1 1 A 78 78 ALA CB C 76 20.124 19.192 0.932 1
1 774 . 3 1 1 A 78 78 ALA N N 76 122.682 123.312 -0.630 1
1 775 . 3 1 1 A 79 79 ASP H H 77 9.028 9.655 -0.627 1
1 776 . 3 1 1 A 79 79 ASP HA H 77 4.673 4.584 0.089 1
1 779 . 3 1 1 A 79 79 ASP C C 77 175.740 175.786 -0.046 1
1 780 . 3 1 1 A 79 79 ASP CA C 77 56.383 55.877 0.506 1
1 781 . 3 1 1 A 79 79 ASP CB C 77 42.826 42.037 0.789 1
1 782 . 3 1 1 A 79 79 ASP N N 77 119.887 122.660 -2.773 1
1 783 . 3 1 1 A 80 80 VAL H H 78 7.379 7.793 -0.414 1
1 784 . 3 1 1 A 80 80 VAL HA H 78 4.340 4.878 -0.538 1
1 792 . 3 1 1 A 80 80 VAL C C 78 175.321 174.477 0.844 1
1 793 . 3 1 1 A 80 80 VAL CA C 78 60.011 60.538 -0.527 1
1 794 . 3 1 1 A 80 80 VAL CB C 78 35.362 36.005 -0.643 1
1 797 . 3 1 1 A 80 80 VAL N N 78 114.152 116.778 -2.626 1
1 798 . 3 1 1 A 81 81 VAL H H 79 8.350 8.196 0.154 1
1 799 . 3 1 1 A 81 81 VAL HA H 79 4.799 4.943 -0.144 1
1 807 . 3 1 1 A 81 81 VAL C C 79 173.095 174.582 -1.487 1
1 808 . 3 1 1 A 81 81 VAL CA C 79 60.775 60.719 0.056 1
1 809 . 3 1 1 A 81 81 VAL CB C 79 32.824 34.856 -2.032 1
1 812 . 3 1 1 A 81 81 VAL N N 79 128.429 126.149 2.280 1
1 813 . 3 1 1 A 82 82 VAL H H 80 8.947 9.119 -0.172 1
1 814 . 3 1 1 A 82 82 VAL HA H 80 4.947 5.032 -0.085 1
1 822 . 3 1 1 A 82 82 VAL C C 80 173.522 175.070 -1.548 1
1 823 . 3 1 1 A 82 82 VAL CA C 80 59.684 59.871 -0.187 1
1 824 . 3 1 1 A 82 82 VAL CB C 80 33.702 35.613 -1.911 1
1 827 . 3 1 1 A 82 82 VAL N N 80 126.957 126.756 0.201 1
1 828 . 3 1 1 A 83 83 ALA H H 81 9.011 8.319 0.692 1
1 829 . 3 1 1 A 83 83 ALA HA H 81 4.938 4.887 0.051 1
1 833 . 3 1 1 A 83 83 ALA C C 81 130.330 175.942 -45.612 1
1 834 . 3 1 1 A 83 83 ALA CA C 81 49.490 51.866 -2.376 1
1 835 . 3 1 1 A 83 83 ALA CB C 81 23.628 21.566 2.062 1
1 836 . 3 1 1 A 83 83 ALA N N 81 128.705 124.788 3.917 1
1 837 . 3 1 1 A 84 84 GLU H H 82 8.922 8.776 0.146 1
1 838 . 3 1 1 A 84 84 GLU HA H 82 4.937 4.681 0.256 1
1 839 . 3 1 1 A 84 84 GLU C C 82 177.673 176.377 1.296 1
1 840 . 3 1 1 A 84 84 GLU CA C 82 56.714 56.919 -0.205 1
1 841 . 3 1 1 A 84 84 GLU CB C 82 29.882 30.195 -0.313 1
1 842 . 3 1 1 A 84 84 GLU N N 82 130.330 123.373 6.957 1
1 843 . 3 1 1 A 85 85 VAL H H 83 8.427 8.870 -0.443 1
1 844 . 3 1 1 A 85 85 VAL HA H 83 4.435 5.092 -0.657 1
1 852 . 3 1 1 A 85 85 VAL C C 83 174.252 175.271 -1.019 1
1 853 . 3 1 1 A 85 85 VAL CA C 83 59.896 60.378 -0.482 1
1 854 . 3 1 1 A 85 85 VAL CB C 83 29.968 36.437 -6.469 1
1 857 . 3 1 1 A 85 85 VAL N N 83 114.212 123.400 -9.188 1
1 858 . 3 1 1 A 86 86 THR H H 84 9.347 9.282 0.065 1
1 859 . 3 1 1 A 86 86 THR HA H 84 4.146 4.796 -0.650 1
1 864 . 3 1 1 A 86 86 THR C C 84 175.751 174.590 1.161 1
1 865 . 3 1 1 A 86 86 THR CA C 84 67.629 63.087 4.542 1
1 866 . 3 1 1 A 86 86 THR CB C 84 66.819 71.592 -4.773 1
1 868 . 3 1 1 A 86 86 THR N N 84 121.640 118.387 3.253 1
1 869 . 3 1 1 A 87 87 GLN H H 85 8.114 7.893 0.221 1
1 870 . 3 1 1 A 87 87 GLN HA H 85 4.736 5.024 -0.288 1
1 874 . 3 1 1 A 87 87 GLN CA C 85 51.898 53.485 -1.587 1
1 875 . 3 1 1 A 87 87 GLN CB C 85 27.942 31.363 -3.421 1
1 877 . 3 1 1 A 87 87 GLN N N 85 120.367 116.336 4.031 1
1 878 . 3 1 1 A 88 88 PRO HA H 86 4.061 4.488 -0.427 1
1 885 . 3 1 1 A 88 88 PRO C C 86 176.436 175.269 1.167 1
1 886 . 3 1 1 A 88 88 PRO CA C 86 63.422 63.327 0.095 1
1 887 . 3 1 1 A 88 88 PRO CB C 86 31.925 32.482 -0.557 1
1 889 . 3 1 1 A 89 89 SER H H 87 6.044 8.837 -2.793 1
1 890 . 3 1 1 A 89 89 SER HA H 87 4.630 4.938 -0.308 1
1 893 . 3 1 1 A 89 89 SER C C 87 175.612 174.233 1.379 1
1 894 . 3 1 1 A 89 89 SER CA C 87 56.800 57.512 -0.712 1
1 895 . 3 1 1 A 89 89 SER CB C 87 64.196 65.902 -1.706 1
1 896 . 3 1 1 A 89 89 SER N N 87 115.721 118.870 -3.149 1
1 897 . 3 1 1 A 90 90 LEU H H 88 9.702 9.019 0.683 1
1 898 . 3 1 1 A 90 90 LEU HA H 88 4.270 4.013 0.257 1
1 906 . 3 1 1 A 90 90 LEU C C 88 179.173 179.104 0.069 1
1 907 . 3 1 1 A 90 90 LEU CA C 88 57.402 58.511 -1.109 1
1 908 . 3 1 1 A 90 90 LEU CB C 88 43.642 41.795 1.847 1
1 911 . 3 1 1 A 90 90 LEU N N 88 130.488 129.258 1.230 1
1 912 . 3 1 1 A 91 91 GLY H H 89 8.354 8.385 -0.031 1
1 913 . 3 1 1 A 91 91 GLY HA2 H 89 3.680 3.784 -0.104 1
1 914 . 3 1 1 A 91 91 GLY HA3 H 89 3.584 3.821 -0.237 1
1 915 . 3 1 1 A 91 91 GLY C C 89 175.106 176.540 -1.434 1
1 916 . 3 1 1 A 91 91 GLY CA C 89 47.770 47.541 0.229 1
1 917 . 3 1 1 A 91 91 GLY N N 89 107.522 105.688 1.834 1
1 918 . 3 1 1 A 92 92 VAL H H 90 7.906 8.058 -0.152 1
1 919 . 3 1 1 A 92 92 VAL HA H 90 3.940 3.756 0.184 1
1 927 . 3 1 1 A 92 92 VAL C C 90 178.467 178.104 0.363 1
1 928 . 3 1 1 A 92 92 VAL CA C 90 65.379 66.459 -1.080 1
1 929 . 3 1 1 A 92 92 VAL CB C 90 31.785 31.816 -0.031 1
1 932 . 3 1 1 A 92 92 VAL N N 90 121.741 121.792 -0.051 1
1 933 . 3 1 1 A 93 93 GLY H H 91 7.595 8.199 -0.604 1
1 934 . 3 1 1 A 93 93 GLY HA2 H 91 3.628 3.777 -0.149 1
1 935 . 3 1 1 A 93 93 GLY HA3 H 91 3.415 3.785 -0.370 1
1 936 . 3 1 1 A 93 93 GLY C C 91 174.022 175.399 -1.377 1
1 937 . 3 1 1 A 93 93 GLY CA C 91 48.319 47.493 0.826 1
1 938 . 3 1 1 A 93 93 GLY N N 91 104.629 107.273 -2.644 1
1 939 . 3 1 1 A 94 94 TYR H H 92 8.372 9.091 -0.719 1
1 940 . 3 1 1 A 94 94 TYR HA H 92 4.046 4.060 -0.014 1
1 943 . 3 1 1 A 94 94 TYR C C 92 177.458 177.950 -0.492 1
1 944 . 3 1 1 A 94 94 TYR CA C 92 61.760 60.757 1.003 1
1 945 . 3 1 1 A 94 94 TYR CB C 92 38.431 38.668 -0.237 1
1 948 . 3 1 1 A 94 94 TYR N N 92 123.383 123.492 -0.109 1
1 949 . 3 1 1 A 95 95 GLU H H 93 8.424 8.353 0.071 1
1 950 . 3 1 1 A 95 95 GLU HA H 93 3.421 3.807 -0.386 1
1 951 . 3 1 1 A 95 95 GLU C C 93 178.590 179.684 -1.094 1
1 952 . 3 1 1 A 95 95 GLU CA C 93 60.211 59.289 0.922 1
1 953 . 3 1 1 A 95 95 GLU CB C 93 29.025 29.186 -0.161 1
1 954 . 3 1 1 A 95 95 GLU N N 93 120.181 118.545 1.636 1
1 955 . 3 1 1 A 96 96 LEU H H 94 8.210 8.211 -0.001 1
1 956 . 3 1 1 A 96 96 LEU HA H 94 3.830 3.988 -0.158 1
1 964 . 3 1 1 A 96 96 LEU C C 94 179.032 179.261 -0.229 1
1 965 . 3 1 1 A 96 96 LEU CA C 94 57.683 58.522 -0.839 1
1 966 . 3 1 1 A 96 96 LEU CB C 94 41.883 41.979 -0.096 1
1 970 . 3 1 1 A 96 96 LEU N N 94 118.091 120.872 -2.781 1
1 971 . 3 1 1 A 97 97 GLY H H 95 8.773 8.269 0.504 1
1 972 . 3 1 1 A 97 97 GLY C C 95 175.344 175.326 0.018 1
1 973 . 3 1 1 A 97 97 GLY CA C 95 47.308 47.135 0.173 1
1 974 . 3 1 1 A 97 97 GLY N N 95 108.085 105.177 2.908 1
1 975 . 3 1 1 A 98 98 ARG H H 96 8.100 8.012 0.088 1
1 976 . 3 1 1 A 98 98 ARG C C 96 179.692 177.914 1.778 1
1 977 . 3 1 1 A 98 98 ARG CA C 96 56.308 58.702 -2.394 1
1 978 . 3 1 1 A 98 98 ARG CB C 96 26.854 29.596 -2.742 1
1 979 . 3 1 1 A 98 98 ARG N N 96 118.156 121.820 -3.664 1
1 980 . 3 1 1 A 99 99 ALA H H 97 8.498 7.574 0.924 1
1 981 . 3 1 1 A 99 99 ALA HA H 97 3.640 4.009 -0.369 1
1 985 . 3 1 1 A 99 99 ALA C C 97 179.650 180.362 -0.712 1
1 986 . 3 1 1 A 99 99 ALA CA C 97 55.166 54.992 0.174 1
1 987 . 3 1 1 A 99 99 ALA CB C 97 18.604 18.435 0.169 1
1 988 . 3 1 1 A 99 99 ALA N N 97 122.310 121.483 0.827 1
1 989 . 3 1 1 A 100 100 VAL H H 98 8.597 8.111 0.486 1
1 990 . 3 1 1 A 100 100 VAL HA H 98 3.798 3.526 0.272 1
1 998 . 3 1 1 A 100 100 VAL C C 98 180.464 178.129 2.335 1
1 999 . 3 1 1 A 100 100 VAL CA C 98 65.664 66.715 -1.051 1
1 1000 . 3 1 1 A 100 100 VAL CB C 98 31.065 31.597 -0.532 1
1 1003 . 3 1 1 A 100 100 VAL N N 98 120.603 118.997 1.606 1
1 1004 . 3 1 1 A 101 101 ALA H H 99 7.280 7.655 -0.375 1
1 1005 . 3 1 1 A 101 101 ALA HA H 99 3.963 4.089 -0.126 1
1 1009 . 3 1 1 A 101 101 ALA C C 99 179.314 179.720 -0.406 1
1 1010 . 3 1 1 A 101 101 ALA CA C 99 54.367 54.917 -0.550 1
1 1011 . 3 1 1 A 101 101 ALA CB C 99 18.139 18.815 -0.676 1
1 1012 . 3 1 1 A 101 101 ALA N N 99 124.450 121.957 2.493 1
1 1013 . 3 1 1 A 102 102 LEU H H 100 7.200 8.518 -1.318 1
1 1014 . 3 1 1 A 102 102 LEU HA H 100 4.192 4.169 0.023 1
1 1024 . 3 1 1 A 102 102 LEU C C 100 177.306 176.976 0.330 1
1 1025 . 3 1 1 A 102 102 LEU CA C 100 54.808 55.387 -0.579 1
1 1026 . 3 1 1 A 102 102 LEU CB C 100 42.880 42.150 0.730 1
1 1030 . 3 1 1 A 102 102 LEU N N 100 116.834 116.162 0.672 1
1 1031 . 3 1 1 A 103 103 GLY H H 101 7.891 8.091 -0.200 1
1 1032 . 3 1 1 A 103 103 GLY HA2 H 101 3.941 3.929 0.012 1
1 1033 . 3 1 1 A 103 103 GLY HA3 H 101 3.831 3.936 -0.105 1
1 1034 . 3 1 1 A 103 103 GLY C C 101 175.137 173.730 1.407 1
1 1035 . 3 1 1 A 103 103 GLY CA C 101 45.673 46.881 -1.208 1
1 1036 . 3 1 1 A 103 103 GLY N N 101 109.395 108.650 0.745 1
1 1037 . 3 1 1 A 104 104 LYS H H 102 7.337 7.884 -0.547 1
1 1038 . 3 1 1 A 104 104 LYS HA H 102 4.402 4.728 -0.326 1
1 1043 . 3 1 1 A 104 104 LYS CA C 102 52.136 53.169 -1.033 1
1 1044 . 3 1 1 A 104 104 LYS CB C 102 31.045 36.019 -4.974 1
1 1047 . 3 1 1 A 104 104 LYS N N 102 118.954 121.150 -2.196 1
1 1048 . 3 1 1 A 105 105 PRO HA H 103 4.781 4.399 0.382 1
1 1054 . 3 1 1 A 105 105 PRO CA C 103 62.791 63.399 -0.608 1
1 1055 . 3 1 1 A 105 105 PRO CB C 103 30.405 31.773 -1.368 1
1 1058 . 3 1 1 A 106 106 ILE H H 104 8.261 8.543 -0.282 1
1 1059 . 3 1 1 A 106 106 ILE HA H 104 4.680 4.330 0.350 1
1 1069 . 3 1 1 A 106 106 ILE C C 104 175.543 173.991 1.552 1
1 1070 . 3 1 1 A 106 106 ILE CA C 104 59.362 60.332 -0.970 1
1 1071 . 3 1 1 A 106 106 ILE CB C 104 43.738 37.540 6.198 1
1 1075 . 3 1 1 A 106 106 ILE N N 104 123.509 124.995 -1.486 1
1 1076 . 3 1 1 A 107 107 LEU H H 105 8.584 8.553 0.031 1
1 1077 . 3 1 1 A 107 107 LEU HA H 105 4.243 4.524 -0.281 1
1 1087 . 3 1 1 A 107 107 LEU C C 105 174.204 174.330 -0.126 1
1 1088 . 3 1 1 A 107 107 LEU CA C 105 52.863 53.280 -0.417 1
1 1089 . 3 1 1 A 107 107 LEU CB C 105 42.408 43.234 -0.826 1
1 1093 . 3 1 1 A 107 107 LEU N N 105 131.882 129.737 2.145 1
1 1094 . 3 1 1 A 108 108 CYS H H 106 8.679 8.658 0.021 1
1 1095 . 3 1 1 A 108 108 CYS HA H 106 5.280 5.624 -0.344 1
1 1099 . 3 1 1 A 108 108 CYS C C 106 173.134 173.379 -0.245 1
1 1100 . 3 1 1 A 108 108 CYS CA C 106 57.290 56.656 0.634 1
1 1101 . 3 1 1 A 108 108 CYS CB C 106 29.559 31.021 -1.462 1
1 1102 . 3 1 1 A 108 108 CYS N N 106 122.904 124.884 -1.980 1
1 1103 . 3 1 1 A 109 109 LEU H H 107 8.987 8.835 0.152 1
1 1104 . 3 1 1 A 109 109 LEU HA H 107 5.120 5.758 -0.638 1
1 1112 . 3 1 1 A 109 109 LEU C C 107 174.500 176.205 -1.705 1
1 1113 . 3 1 1 A 109 109 LEU CA C 107 53.274 53.839 -0.565 1
1 1114 . 3 1 1 A 109 109 LEU CB C 107 43.450 45.376 -1.926 1
1 1118 . 3 1 1 A 109 109 LEU N N 107 124.653 123.748 0.905 1
1 1119 . 3 1 1 A 110 110 PHE H H 108 8.981 9.196 -0.215 1
1 1120 . 3 1 1 A 110 110 PHE HA H 108 4.846 6.449 -1.603 1
1 1125 . 3 1 1 A 110 110 PHE C C 108 172.231 172.969 -0.738 1
1 1126 . 3 1 1 A 110 110 PHE CA C 108 55.963 55.456 0.507 1
1 1127 . 3 1 1 A 110 110 PHE CB C 108 43.270 43.040 0.230 1
1 1130 . 3 1 1 A 110 110 PHE N N 108 125.052 121.592 3.460 1
1 1131 . 3 1 1 A 111 111 ARG H H 109 7.461 8.526 -1.065 1
1 1132 . 3 1 1 A 111 111 ARG HA H 109 4.804 4.604 0.200 1
1 1136 . 3 1 1 A 111 111 ARG CA C 109 51.953 52.343 -0.390 1
1 1137 . 3 1 1 A 111 111 ARG CB C 109 30.008 30.807 -0.799 1
1 1140 . 3 1 1 A 111 111 ARG N N 109 128.034 123.745 4.289 1
1 1141 . 3 1 1 A 112 112 PRO C C 110 178.675 177.647 1.028 1
1 1142 . 3 1 1 A 112 112 PRO CA C 110 64.024 64.297 -0.273 1
1 1143 . 3 1 1 A 112 112 PRO CB C 110 31.416 31.910 -0.494 1
1 1144 . 3 1 1 A 113 113 GLN H H 111 8.188 8.694 -0.506 1
1 1145 . 3 1 1 A 113 113 GLN HA H 111 4.056 4.039 0.017 1
1 1149 . 3 1 1 A 113 113 GLN C C 111 175.936 177.098 -1.162 1
1 1150 . 3 1 1 A 113 113 GLN CA C 111 57.144 58.260 -1.116 1
1 1151 . 3 1 1 A 113 113 GLN CB C 111 28.033 27.989 0.044 1
1 1153 . 3 1 1 A 113 113 GLN N N 111 118.835 117.263 1.572 1
1 1154 . 3 1 1 A 114 114 SER H H 112 7.730 7.743 -0.013 1
1 1155 . 3 1 1 A 114 114 SER HA H 112 4.037 4.556 -0.519 1
1 1158 . 3 1 1 A 114 114 SER C C 112 175.750 175.793 -0.043 1
1 1159 . 3 1 1 A 114 114 SER CA C 112 60.154 58.764 1.390 1
1 1160 . 3 1 1 A 114 114 SER CB C 112 64.282 65.041 -0.759 1
1 1161 . 3 1 1 A 114 114 SER N N 112 114.887 110.370 4.517 1
1 1162 . 3 1 1 A 115 115 GLY H H 113 8.005 7.974 0.031 1
1 1163 . 3 1 1 A 115 115 GLY HA2 H 113 3.712 3.999 -0.287 1
1 1164 . 3 1 1 A 115 115 GLY HA3 H 113 4.130 4.194 -0.064 1
1 1165 . 3 1 1 A 115 115 GLY C C 113 173.945 175.665 -1.720 1
1 1166 . 3 1 1 A 115 115 GLY CA C 113 45.233 47.225 -1.992 1
1 1167 . 3 1 1 A 115 115 GLY N N 113 110.740 110.935 -0.195 1
1 1168 . 3 1 1 A 116 116 ARG H H 114 7.665 8.176 -0.511 1
1 1169 . 3 1 1 A 116 116 ARG HA H 114 4.449 4.542 -0.093 1
1 1173 . 3 1 1 A 116 116 ARG C C 114 175.370 175.385 -0.015 1
1 1174 . 3 1 1 A 116 116 ARG CA C 114 55.080 55.745 -0.665 1
1 1175 . 3 1 1 A 116 116 ARG CB C 114 31.215 29.881 1.334 1
1 1178 . 3 1 1 A 116 116 ARG N N 114 119.983 118.797 1.186 1
1 1179 . 3 1 1 A 117 117 VAL H H 115 8.409 8.155 0.254 1
1 1180 . 3 1 1 A 117 117 VAL HA H 115 4.184 3.543 0.641 1
1 1188 . 3 1 1 A 117 117 VAL C C 115 175.980 174.709 1.271 1
1 1189 . 3 1 1 A 117 117 VAL CA C 115 61.167 62.027 -0.860 1
1 1190 . 3 1 1 A 117 117 VAL CB C 115 32.931 30.828 2.103 1
1 1193 . 3 1 1 A 117 117 VAL N N 115 122.240 116.113 6.127 1
1 1194 . 3 1 1 A 118 118 LEU H H 116 8.227 7.254 0.973 1
1 1195 . 3 1 1 A 118 118 LEU HA H 116 3.720 4.223 -0.503 1
1 1204 . 3 1 1 A 118 118 LEU C C 116 175.623 176.222 -0.599 1
1 1205 . 3 1 1 A 118 118 LEU CA C 116 54.555 55.269 -0.714 1
1 1206 . 3 1 1 A 118 118 LEU CB C 116 39.292 43.508 -4.216 1
1 1210 . 3 1 1 A 118 118 LEU N N 116 131.481 128.989 2.492 1
1 1211 . 3 1 1 A 119 119 SER H H 117 7.780 8.553 -0.773 1
1 1212 . 3 1 1 A 119 119 SER HA H 117 4.060 4.366 -0.306 1
1 1214 . 3 1 1 A 119 119 SER C C 117 175.782 175.738 0.044 1
1 1215 . 3 1 1 A 119 119 SER CA C 117 58.530 58.623 -0.093 1
1 1216 . 3 1 1 A 119 119 SER CB C 117 64.785 63.786 0.999 1
1 1217 . 3 1 1 A 119 119 SER N N 117 118.658 120.461 -1.803 1
1 1218 . 3 1 1 A 120 120 ALA H H 118 8.955 9.000 -0.045 1
1 1219 . 3 1 1 A 120 120 ALA HA H 118 3.846 4.041 -0.195 1
1 1223 . 3 1 1 A 120 120 ALA C C 118 179.731 179.844 -0.113 1
1 1224 . 3 1 1 A 120 120 ALA CA C 118 54.927 55.568 -0.641 1
1 1225 . 3 1 1 A 120 120 ALA CB C 118 18.627 18.192 0.435 1
1 1226 . 3 1 1 A 120 120 ALA N N 118 134.119 130.186 3.933 1
1 1227 . 3 1 1 A 121 121 MET H H 119 7.718 8.208 -0.490 1
1 1228 . 3 1 1 A 121 121 MET HA H 119 4.130 4.169 -0.039 1
1 1235 . 3 1 1 A 121 121 MET C C 119 175.610 178.979 -3.369 1
1 1236 . 3 1 1 A 121 121 MET CA C 119 55.968 58.239 -2.271 1
1 1237 . 3 1 1 A 121 121 MET CB C 119 30.814 32.758 -1.944 1
1 1240 . 3 1 1 A 121 121 MET N N 119 115.424 116.256 -0.832 1
1 1241 . 3 1 1 A 122 122 ILE H H 120 6.451 8.105 -1.654 1
1 1242 . 3 1 1 A 122 122 ILE HA H 120 3.392 3.611 -0.219 1
1 1252 . 3 1 1 A 122 122 ILE C C 120 177.108 178.299 -1.191 1
1 1253 . 3 1 1 A 122 122 ILE CA C 120 59.650 64.796 -5.146 1
1 1254 . 3 1 1 A 122 122 ILE CB C 120 34.640 37.624 -2.984 1
1 1258 . 3 1 1 A 122 122 ILE N N 120 113.418 119.596 -6.178 1
1 1259 . 3 1 1 A 123 123 ARG H H 121 7.540 8.482 -0.942 1
1 1260 . 3 1 1 A 123 123 ARG HA H 121 3.551 4.085 -0.534 1
1 1264 . 3 1 1 A 123 123 ARG C C 121 179.642 178.807 0.835 1
1 1265 . 3 1 1 A 123 123 ARG CA C 121 59.242 59.522 -0.280 1
1 1266 . 3 1 1 A 123 123 ARG CB C 121 29.087 29.608 -0.521 1
1 1269 . 3 1 1 A 123 123 ARG N N 121 116.248 120.643 -4.395 1
1 1270 . 3 1 1 A 124 124 GLY H H 122 8.086 9.068 -0.982 1
1 1271 . 3 1 1 A 124 124 GLY C C 122 172.357 175.877 -3.520 1
1 1272 . 3 1 1 A 124 124 GLY CA C 122 44.836 46.745 -1.909 1
1 1273 . 3 1 1 A 124 124 GLY N N 122 104.381 107.545 -3.164 1
1 1274 . 3 1 1 A 125 125 ALA H H 123 6.411 7.882 -1.471 1
1 1275 . 3 1 1 A 125 125 ALA HA H 123 2.441 3.800 -1.359 1
1 1279 . 3 1 1 A 125 125 ALA C C 123 176.908 178.133 -1.225 1
1 1280 . 3 1 1 A 125 125 ALA CA C 123 51.593 54.736 -3.143 1
1 1281 . 3 1 1 A 125 125 ALA CB C 123 16.997 18.404 -1.407 1
1 1282 . 3 1 1 A 125 125 ALA N N 123 123.136 124.522 -1.386 1
1 1283 . 3 1 1 A 126 126 ALA H H 124 6.190 7.618 -1.428 1
1 1284 . 3 1 1 A 126 126 ALA HA H 124 3.829 4.543 -0.714 1
1 1288 . 3 1 1 A 126 126 ALA C C 124 177.535 178.149 -0.614 1
1 1289 . 3 1 1 A 126 126 ALA CA C 124 52.403 52.756 -0.353 1
1 1290 . 3 1 1 A 126 126 ALA CB C 124 18.375 19.980 -1.605 1
1 1291 . 3 1 1 A 126 126 ALA N N 124 117.999 117.282 0.717 1
1 1292 . 3 1 1 A 127 127 ASP H H 125 8.877 8.948 -0.071 1
1 1293 . 3 1 1 A 127 127 ASP HA H 125 4.665 4.835 -0.170 1
1 1296 . 3 1 1 A 127 127 ASP C C 125 177.795 175.457 2.338 1
1 1297 . 3 1 1 A 127 127 ASP CA C 125 52.855 55.580 -2.725 1
1 1298 . 3 1 1 A 127 127 ASP CB C 125 41.814 38.753 3.061 1
1 1299 . 3 1 1 A 127 127 ASP N N 125 121.828 118.389 3.439 1
1 1300 . 3 1 1 A 128 128 GLY H H 126 7.954 7.895 0.059 1
1 1301 . 3 1 1 A 128 128 GLY HA2 H 126 3.830 4.234 -0.404 1
1 1302 . 3 1 1 A 128 128 GLY HA3 H 126 4.249 4.280 -0.031 1
1 1303 . 3 1 1 A 128 128 GLY C C 126 173.822 172.604 1.218 1
1 1304 . 3 1 1 A 128 128 GLY CA C 126 45.549 45.579 -0.030 1
1 1305 . 3 1 1 A 128 128 GLY N N 126 108.814 107.372 1.442 1
1 1306 . 3 1 1 A 129 129 SER H H 127 8.547 8.614 -0.067 1
1 1307 . 3 1 1 A 129 129 SER HA H 127 4.486 4.829 -0.343 1
1 1309 . 3 1 1 A 129 129 SER C C 127 174.178 174.194 -0.016 1
1 1310 . 3 1 1 A 129 129 SER CA C 127 58.653 57.100 1.553 1
1 1311 . 3 1 1 A 129 129 SER CB C 127 63.316 63.547 -0.231 1
1 1312 . 3 1 1 A 129 129 SER N N 127 115.599 116.120 -0.521 1
1 1313 . 3 1 1 A 130 130 ARG H H 128 8.795 8.543 0.252 1
1 1314 . 3 1 1 A 130 130 ARG HA H 128 4.160 4.086 0.074 1
1 1318 . 3 1 1 A 130 130 ARG C C 128 175.518 174.924 0.594 1
1 1319 . 3 1 1 A 130 130 ARG CA C 128 58.479 57.779 0.700 1
1 1320 . 3 1 1 A 130 130 ARG CB C 128 29.952 30.197 -0.245 1
1 1323 . 3 1 1 A 130 130 ARG N N 128 127.611 119.541 8.070 1
1 1324 . 3 1 1 A 131 131 PHE H H 129 9.315 8.012 1.303 1
1 1325 . 3 1 1 A 131 131 PHE HA H 129 4.878 5.042 -0.164 1
1 1331 . 3 1 1 A 131 131 PHE C C 129 175.058 173.808 1.250 1
1 1332 . 3 1 1 A 131 131 PHE CA C 129 55.953 56.339 -0.386 1
1 1333 . 3 1 1 A 131 131 PHE CB C 129 40.189 41.650 -1.461 1
1 1337 . 3 1 1 A 131 131 PHE N N 129 126.219 119.104 7.115 1
1 1338 . 3 1 1 A 132 132 GLN H H 130 8.160 8.244 -0.084 1
1 1339 . 3 1 1 A 132 132 GLN HA H 130 5.013 5.274 -0.261 1
1 1343 . 3 1 1 A 132 132 GLN CA C 130 54.498 54.661 -0.163 1
1 1344 . 3 1 1 A 132 132 GLN CB C 130 32.106 33.509 -1.403 1
1 1346 . 3 1 1 A 132 132 GLN N N 130 125.589 125.614 -0.025 1
1 1347 . 3 1 1 A 133 133 VAL H H 131 8.689 9.126 -0.437 1
1 1348 . 3 1 1 A 133 133 VAL HA H 131 4.529 4.827 -0.298 1
1 1356 . 3 1 1 A 133 133 VAL C C 131 174.441 175.557 -1.116 1
1 1357 . 3 1 1 A 133 133 VAL CA C 131 60.758 61.590 -0.832 1
1 1358 . 3 1 1 A 133 133 VAL CB C 131 32.417 32.224 0.193 1
1 1361 . 3 1 1 A 133 133 VAL N N 131 122.441 123.423 -0.982 1
1 1362 . 3 1 1 A 134 134 TRP H H 132 9.256 9.351 -0.095 1
1 1363 . 3 1 1 A 134 134 TRP HA H 132 5.213 5.064 0.149 1
1 1371 . 3 1 1 A 134 134 TRP C C 132 174.575 176.120 -1.545 1
1 1372 . 3 1 1 A 134 134 TRP CA C 132 53.859 56.538 -2.679 1
1 1373 . 3 1 1 A 134 134 TRP CB C 132 31.311 31.287 0.024 1
1 1379 . 3 1 1 A 134 134 TRP N N 132 130.303 128.407 1.896 1
1 1381 . 3 1 1 A 135 135 ASP H H 133 8.237 9.064 -0.827 1
1 1382 . 3 1 1 A 135 135 ASP HA H 133 6.018 5.827 0.191 1
1 1385 . 3 1 1 A 135 135 ASP C C 133 177.020 174.926 2.094 1
1 1386 . 3 1 1 A 135 135 ASP CA C 133 53.321 53.536 -0.215 1
1 1387 . 3 1 1 A 135 135 ASP CB C 133 41.514 42.881 -1.367 1
1 1388 . 3 1 1 A 135 135 ASP N N 133 125.516 123.453 2.063 1
1 1389 . 3 1 1 A 136 136 TYR H H 134 9.058 8.427 0.631 1
1 1390 . 3 1 1 A 136 136 TYR HA H 134 4.970 5.277 -0.307 1
1 1394 . 3 1 1 A 136 136 TYR C C 134 172.324 173.031 -0.707 1
1 1395 . 3 1 1 A 136 136 TYR CA C 134 55.982 56.388 -0.406 1
1 1396 . 3 1 1 A 136 136 TYR CB C 134 42.265 40.334 1.931 1
1 1399 . 3 1 1 A 136 136 TYR N N 134 120.315 120.264 0.051 1
1 1400 . 3 1 1 A 137 137 ALA H H 135 8.521 8.529 -0.008 1
1 1401 . 3 1 1 A 137 137 ALA HA H 135 4.280 4.438 -0.158 1
1 1405 . 3 1 1 A 137 137 ALA C C 135 178.561 177.608 0.953 1
1 1406 . 3 1 1 A 137 137 ALA CA C 135 49.550 50.369 -0.819 1
1 1407 . 3 1 1 A 137 137 ALA CB C 135 19.998 22.535 -2.537 1
1 1408 . 3 1 1 A 137 137 ALA N N 135 123.386 122.040 1.346 1
1 1409 . 3 1 1 A 138 138 GLU H H 136 8.678 8.878 -0.200 1
1 1410 . 3 1 1 A 138 138 GLU HA H 136 3.777 4.092 -0.315 1
1 1414 . 3 1 1 A 138 138 GLU C C 136 177.624 177.721 -0.097 1
1 1415 . 3 1 1 A 138 138 GLU CA C 136 60.527 59.120 1.407 1
1 1416 . 3 1 1 A 138 138 GLU CB C 136 29.020 29.243 -0.223 1
1 1418 . 3 1 1 A 138 138 GLU N N 136 121.774 121.277 0.497 1
1 1419 . 3 1 1 A 139 139 GLY H H 137 8.666 8.317 0.349 1
1 1420 . 3 1 1 A 139 139 GLY HA2 H 137 3.872 3.966 -0.094 1
1 1421 . 3 1 1 A 139 139 GLY HA3 H 137 3.872 3.976 -0.104 1
1 1422 . 3 1 1 A 139 139 GLY C C 137 175.122 174.342 0.780 1
1 1423 . 3 1 1 A 139 139 GLY CA C 137 46.093 45.604 0.489 1
1 1424 . 3 1 1 A 139 139 GLY N N 137 106.053 108.336 -2.283 1
1 1425 . 3 1 1 A 140 140 GLU H H 138 8.305 9.564 -1.259 1
1 1426 . 3 1 1 A 140 140 GLU HA H 138 4.754 4.582 0.172 1
1 1430 . 3 1 1 A 140 140 GLU C C 138 177.819 176.955 0.864 1
1 1431 . 3 1 1 A 140 140 GLU CA C 138 55.049 56.525 -1.476 1
1 1432 . 3 1 1 A 140 140 GLU CB C 138 30.504 31.220 -0.716 1
1 1434 . 3 1 1 A 140 140 GLU N N 138 117.485 117.745 -0.260 1
1 1435 . 3 1 1 A 141 141 VAL H H 139 7.267 7.673 -0.406 1
1 1436 . 3 1 1 A 141 141 VAL HA H 139 3.422 3.910 -0.488 1
1 1444 . 3 1 1 A 141 141 VAL C C 139 175.454 177.488 -2.034 1
1 1445 . 3 1 1 A 141 141 VAL CA C 139 66.769 65.126 1.643 1
1 1446 . 3 1 1 A 141 141 VAL CB C 139 31.377 31.510 -0.133 1
1 1449 . 3 1 1 A 141 141 VAL N N 139 120.764 121.095 -0.331 1
1 1450 . 3 1 1 A 142 142 GLU H H 140 8.620 8.390 0.230 1
1 1451 . 3 1 1 A 142 142 GLU HA H 140 3.592 3.984 -0.392 1
1 1452 . 3 1 1 A 142 142 GLU C C 140 177.320 179.638 -2.318 1
1 1453 . 3 1 1 A 142 142 GLU CA C 140 62.607 59.439 3.168 1
1 1454 . 3 1 1 A 142 142 GLU CB C 140 26.759 29.122 -2.363 1
1 1455 . 3 1 1 A 142 142 GLU N N 140 120.048 121.727 -1.679 1
1 1456 . 3 1 1 A 143 143 THR H H 141 7.449 8.238 -0.789 1
1 1457 . 3 1 1 A 143 143 THR HA H 141 4.003 3.981 0.022 1
1 1462 . 3 1 1 A 143 143 THR C C 141 177.258 176.755 0.503 1
1 1463 . 3 1 1 A 143 143 THR CA C 141 65.490 67.021 -1.531 1
1 1464 . 3 1 1 A 143 143 THR CB C 141 68.641 68.162 0.479 1
1 1466 . 3 1 1 A 143 143 THR N N 141 114.073 118.171 -4.098 1
1 1467 . 3 1 1 A 144 144 MET H H 142 7.992 8.134 -0.142 1
1 1468 . 3 1 1 A 144 144 MET HA H 142 4.316 4.372 -0.056 1
1 1476 . 3 1 1 A 144 144 MET C C 142 178.233 178.605 -0.372 1
1 1477 . 3 1 1 A 144 144 MET CA C 142 57.743 59.200 -1.457 1
1 1478 . 3 1 1 A 144 144 MET CB C 142 31.326 32.520 -1.194 1
1 1481 . 3 1 1 A 144 144 MET N N 142 120.595 118.678 1.917 1
1 1482 . 3 1 1 A 145 145 LEU H H 143 7.847 8.241 -0.394 1
1 1483 . 3 1 1 A 145 145 LEU HA H 143 3.919 3.879 0.040 1
1 1491 . 3 1 1 A 145 145 LEU C C 143 178.774 179.510 -0.736 1
1 1492 . 3 1 1 A 145 145 LEU CA C 143 57.877 57.917 -0.040 1
1 1493 . 3 1 1 A 145 145 LEU CB C 143 40.951 40.980 -0.029 1
1 1497 . 3 1 1 A 145 145 LEU N N 143 119.410 119.616 -0.206 1
1 1498 . 3 1 1 A 146 146 ASP H H 144 8.431 8.487 -0.056 1
1 1499 . 3 1 1 A 146 146 ASP HA H 144 4.312 4.528 -0.216 1
1 1502 . 3 1 1 A 146 146 ASP C C 144 178.129 178.863 -0.734 1
1 1503 . 3 1 1 A 146 146 ASP CA C 144 57.464 58.099 -0.635 1
1 1504 . 3 1 1 A 146 146 ASP CB C 144 39.548 41.539 -1.991 1
1 1505 . 3 1 1 A 146 146 ASP N N 144 119.837 119.956 -0.119 1
1 1506 . 3 1 1 A 147 147 ARG H H 145 7.949 8.255 -0.306 1
1 1507 . 3 1 1 A 147 147 ARG HA H 145 4.050 4.161 -0.111 1
1 1512 . 3 1 1 A 147 147 ARG C C 145 179.547 178.831 0.716 1
1 1513 . 3 1 1 A 147 147 ARG CA C 145 58.972 59.584 -0.612 1
1 1514 . 3 1 1 A 147 147 ARG CB C 145 29.798 30.430 -0.632 1
1 1517 . 3 1 1 A 147 147 ARG N N 145 119.173 119.020 0.153 1
1 1518 . 3 1 1 A 148 148 TYR H H 146 8.128 8.263 -0.135 1
1 1519 . 3 1 1 A 148 148 TYR HA H 146 3.995 4.450 -0.455 1
1 1524 . 3 1 1 A 148 148 TYR C C 146 178.199 177.651 0.548 1
1 1525 . 3 1 1 A 148 148 TYR CA C 146 62.347 61.602 0.745 1
1 1526 . 3 1 1 A 148 148 TYR CB C 146 37.418 37.972 -0.554 1
1 1529 . 3 1 1 A 148 148 TYR N N 146 120.102 121.626 -1.524 1
1 1530 . 3 1 1 A 149 149 PHE H H 147 8.308 8.287 0.021 1
1 1531 . 3 1 1 A 149 149 PHE HA H 147 4.013 4.354 -0.341 1
1 1535 . 3 1 1 A 149 149 PHE C C 147 177.574 178.353 -0.779 1
1 1536 . 3 1 1 A 149 149 PHE CA C 147 63.044 61.693 1.351 1
1 1537 . 3 1 1 A 149 149 PHE CB C 147 37.153 38.555 -1.402 1
1 1541 . 3 1 1 A 149 149 PHE N N 147 116.680 118.211 -1.531 1
1 1542 . 3 1 1 A 150 150 GLU H H 148 8.271 8.625 -0.354 1
1 1543 . 3 1 1 A 150 150 GLU HA H 148 4.030 4.022 0.008 1
1 1547 . 3 1 1 A 150 150 GLU C C 148 177.687 178.879 -1.192 1
1 1548 . 3 1 1 A 150 150 GLU CA C 148 58.746 59.390 -0.644 1
1 1549 . 3 1 1 A 150 150 GLU CB C 148 28.847 28.890 -0.043 1
1 1551 . 3 1 1 A 150 150 GLU N N 148 119.973 119.663 0.310 1
1 1552 . 3 1 1 A 151 151 ALA H H 149 6.992 7.672 -0.680 1
1 1553 . 3 1 1 A 151 151 ALA HA H 149 4.217 4.196 0.021 1
1 1557 . 3 1 1 A 151 151 ALA C C 149 178.190 177.509 0.681 1
1 1558 . 3 1 1 A 151 151 ALA CA C 149 52.779 54.365 -1.586 1
1 1559 . 3 1 1 A 151 151 ALA CB C 149 19.087 18.552 0.535 1
1 1560 . 3 1 1 A 151 151 ALA N N 149 118.629 121.740 -3.111 1
1 1561 . 3 1 1 A 152 152 TYR H H 150 7.722 7.717 0.005 1
1 1562 . 3 1 1 A 152 152 TYR HA H 150 4.137 4.814 -0.677 1
1 1567 . 3 1 1 A 152 152 TYR C C 150 175.703 177.554 -1.851 1
1 1568 . 3 1 1 A 152 152 TYR CA C 150 59.260 57.895 1.365 1
1 1569 . 3 1 1 A 152 152 TYR CB C 150 39.165 40.020 -0.855 1
1 1572 . 3 1 1 A 152 152 TYR N N 150 118.767 113.158 5.609 1
1 1573 . 3 1 1 A 153 153 LEU H H 151 7.670 6.985 0.685 1
1 1574 . 3 1 1 A 153 153 LEU HA H 151 4.145 3.385 0.760 1
1 1584 . 3 1 1 A 153 153 LEU CA C 151 54.704 59.641 -4.937 1
1 1585 . 3 1 1 A 153 153 LEU CB C 151 40.520 40.068 0.452 1
1 1589 . 3 1 1 A 153 153 LEU N N 151 122.313 121.776 0.537 1
1 1590 . 3 1 1 A 154 154 PRO HA H 152 4.258 4.285 -0.027 1
1 1597 . 3 1 1 A 154 154 PRO C C 152 177.496 178.739 -1.243 1
1 1598 . 3 1 1 A 154 154 PRO CA C 152 63.899 65.283 -1.384 1
1 1599 . 3 1 1 A 154 154 PRO CB C 152 31.080 31.397 -0.317 1
1 1602 . 3 1 1 A 155 155 GLN H H 153 8.023 8.920 -0.897 1
1 1603 . 3 1 1 A 155 155 GLN HA H 153 4.176 4.113 0.063 1
1 1607 . 3 1 1 A 155 155 GLN C C 153 176.636 178.289 -1.653 1
1 1608 . 3 1 1 A 155 155 GLN CA C 153 55.968 58.884 -2.916 1
1 1609 . 3 1 1 A 155 155 GLN CB C 153 28.723 28.950 -0.227 1
1 1610 . 3 1 1 A 155 155 GLN N N 153 119.173 117.727 1.446 1
1 1611 . 3 1 1 A 156 156 LYS H H 154 8.113 7.846 0.267 1
1 1612 . 3 1 1 A 156 156 LYS HA H 154 4.196 4.364 -0.168 1
1 1619 . 3 1 1 A 156 156 LYS C C 154 56.493 176.728 -120.235 1
1 1620 . 3 1 1 A 156 156 LYS CA C 154 56.493 57.860 -1.367 1
1 1621 . 3 1 1 A 156 156 LYS CB C 154 32.037 32.534 -0.497 1
1 1625 . 3 1 1 A 156 156 LYS N N 154 122.788 116.535 6.253 1
1 1626 . 3 1 1 A 157 157 THR H H 155 8.013 7.502 0.511 1
1 1627 . 3 1 1 A 157 157 THR HA H 155 4.183 4.307 -0.124 1
1 1632 . 3 1 1 A 157 157 THR C C 155 174.580 174.527 0.053 1
1 1633 . 3 1 1 A 157 157 THR CA C 155 61.958 62.287 -0.329 1
1 1634 . 3 1 1 A 157 157 THR CB C 155 69.665 69.743 -0.078 1
1 1636 . 3 1 1 A 157 157 THR N N 155 115.504 115.662 -0.158 1
1 1637 . 3 1 1 A 158 158 ALA H H 156 8.170 8.551 -0.381 1
1 1638 . 3 1 1 A 158 158 ALA HA H 156 4.220 3.873 0.347 1
1 1642 . 3 1 1 A 158 158 ALA CA C 156 52.492 53.004 -0.512 1
1 1643 . 3 1 1 A 158 158 ALA CB C 156 18.810 17.825 0.985 1
1 1644 . 3 1 1 A 158 158 ALA N N 156 126.825 124.548 2.277 1
1 1645 . 3 1 1 A 159 159 SER H H 157 7.762 7.563 0.199 1
1 1646 . 3 1 1 A 159 159 SER CA C 157 58.230 56.562 1.668 1
1 1647 . 3 1 1 A 159 159 SER CB C 157 63.440 66.352 -2.912 1
1 1648 . 3 1 1 A 159 159 SER N N 157 123.078 108.637 14.441 1
1 1649 . 3 1 1 A 162 162 HIS HA H 160 4.845 5.319 -0.474 1
1 1652 . 3 1 1 A 162 162 HIS CA C 160 53.590 53.153 0.437 1
1 1653 . 3 1 1 A 162 162 HIS CB C 160 29.398 29.936 -0.538 1
1 1654 . 3 1 1 A 163 163 PRO HA H 161 4.388 4.581 -0.193 1
1 1660 . 3 1 1 A 163 163 PRO C C 161 177.018 176.265 0.753 1
1 1661 . 3 1 1 A 163 163 PRO CA C 161 63.118 62.357 0.761 1
1 1662 . 3 1 1 A 163 163 PRO CB C 161 31.668 32.414 -0.746 1
1 1665 . 3 1 1 A 164 164 SER H H 162 8.418 8.533 -0.115 1
1 1666 . 3 1 1 A 164 164 SER HA H 162 4.338 4.695 -0.357 1
1 1668 . 3 1 1 A 164 164 SER C C 162 173.327 175.189 -1.862 1
1 1669 . 3 1 1 A 164 164 SER CA C 162 58.202 57.663 0.539 1
1 1670 . 3 1 1 A 164 164 SER CB C 162 64.080 64.249 -0.169 1
1 1671 . 3 1 1 A 164 164 SER N N 162 117.485 117.442 0.043 1
1 6 . 4 1 1 A 4 4 ALA H H 2 8.270 8.410 -0.140 1
1 7 . 4 1 1 A 4 4 ALA HA H 2 4.212 4.366 -0.154 1
1 11 . 4 1 1 A 4 4 ALA C C 2 177.441 177.284 0.157 1
1 12 . 4 1 1 A 4 4 ALA CA C 2 52.280 52.108 0.172 1
1 13 . 4 1 1 A 4 4 ALA CB C 2 18.880 19.348 -0.468 1
1 14 . 4 1 1 A 4 4 ALA N N 2 126.500 129.375 -2.875 1
1 15 . 4 1 1 A 5 5 ALA H H 3 8.251 8.309 -0.058 1
1 16 . 4 1 1 A 5 5 ALA HA H 3 4.261 4.231 0.030 1
1 20 . 4 1 1 A 5 5 ALA C C 3 177.824 177.093 0.731 1
1 21 . 4 1 1 A 5 5 ALA CA C 3 52.347 52.604 -0.257 1
1 22 . 4 1 1 A 5 5 ALA CB C 3 18.869 19.223 -0.354 1
1 23 . 4 1 1 A 5 5 ALA N N 3 124.322 123.380 0.942 1
1 24 . 4 1 1 A 6 6 SER H H 4 8.158 8.624 -0.466 1
1 25 . 4 1 1 A 6 6 SER HA H 4 4.358 4.371 -0.013 1
1 27 . 4 1 1 A 6 6 SER C C 4 175.222 174.460 0.762 1
1 28 . 4 1 1 A 6 6 SER CA C 4 58.438 58.644 -0.206 1
1 29 . 4 1 1 A 6 6 SER CB C 4 63.859 63.991 -0.132 1
1 30 . 4 1 1 A 6 6 SER N N 4 115.338 114.010 1.328 1
1 31 . 4 1 1 A 7 7 GLY H H 5 8.265 8.591 -0.326 1
1 32 . 4 1 1 A 7 7 GLY HA2 H 5 3.900 4.089 -0.189 1
1 33 . 4 1 1 A 7 7 GLY C C 5 174.083 172.778 1.305 1
1 34 . 4 1 1 A 7 7 GLY CA C 5 45.113 44.446 0.667 1
1 35 . 4 1 1 A 7 7 GLY N N 5 111.360 109.443 1.917 1
1 36 . 4 1 1 A 8 8 GLU H H 6 8.100 8.543 -0.443 1
1 37 . 4 1 1 A 8 8 GLU HA H 6 4.209 5.266 -1.057 1
1 41 . 4 1 1 A 8 8 GLU C C 6 176.354 175.501 0.853 1
1 42 . 4 1 1 A 8 8 GLU CA C 6 56.261 54.697 1.564 1
1 43 . 4 1 1 A 8 8 GLU CB C 6 29.830 34.116 -4.286 1
1 45 . 4 1 1 A 8 8 GLU N N 6 121.056 118.461 2.595 1
1 46 . 4 1 1 A 9 9 GLN H H 7 8.287 8.792 -0.505 1
1 47 . 4 1 1 A 9 9 GLN HA H 7 4.247 5.229 -0.982 1
1 51 . 4 1 1 A 9 9 GLN C C 7 172.457 173.741 -1.284 1
1 52 . 4 1 1 A 9 9 GLN CA C 7 55.269 53.638 1.631 1
1 53 . 4 1 1 A 9 9 GLN CB C 7 29.236 32.279 -3.043 1
1 55 . 4 1 1 A 9 9 GLN N N 7 122.164 117.830 4.334 1
1 56 . 4 1 1 A 10 10 ALA H H 8 8.368 8.609 -0.241 1
1 57 . 4 1 1 A 10 10 ALA HA H 8 4.509 4.886 -0.377 1
1 61 . 4 1 1 A 10 10 ALA CA C 8 50.341 49.769 0.572 1
1 62 . 4 1 1 A 10 10 ALA CB C 8 18.140 22.408 -4.268 1
1 63 . 4 1 1 A 10 10 ALA N N 8 128.028 121.741 6.287 1
1 64 . 4 1 1 A 11 11 PRO HA H 9 4.437 4.638 -0.201 1
1 70 . 4 1 1 A 11 11 PRO C C 9 176.381 176.374 0.007 1
1 71 . 4 1 1 A 11 11 PRO CA C 9 63.298 62.328 0.970 1
1 72 . 4 1 1 A 11 11 PRO CB C 9 31.776 33.066 -1.290 1
1 75 . 4 1 1 A 12 12 CYS H H 10 8.056 8.302 -0.246 1
1 76 . 4 1 1 A 12 12 CYS HA H 10 4.717 4.876 -0.159 1
1 79 . 4 1 1 A 12 12 CYS C C 10 173.266 173.353 -0.087 1
1 80 . 4 1 1 A 12 12 CYS CA C 10 57.398 57.591 -0.193 1
1 81 . 4 1 1 A 12 12 CYS CB C 10 29.165 30.125 -0.960 1
1 82 . 4 1 1 A 12 12 CYS N N 10 118.295 118.066 0.229 1
1 83 . 4 1 1 A 13 13 SER H H 11 9.815 9.117 0.698 1
1 84 . 4 1 1 A 13 13 SER HA H 11 5.227 5.335 -0.108 1
1 87 . 4 1 1 A 13 13 SER C C 11 173.648 173.394 0.254 1
1 88 . 4 1 1 A 13 13 SER CA C 11 57.630 56.511 1.119 1
1 89 . 4 1 1 A 13 13 SER CB C 11 64.820 66.398 -1.578 1
1 90 . 4 1 1 A 13 13 SER N N 11 122.365 116.979 5.386 1
1 91 . 4 1 1 A 14 14 VAL H H 12 9.352 9.094 0.258 1
1 92 . 4 1 1 A 14 14 VAL HA H 12 4.696 5.094 -0.398 1
1 100 . 4 1 1 A 14 14 VAL C C 12 173.875 173.230 0.645 1
1 101 . 4 1 1 A 14 14 VAL CA C 12 60.146 61.001 -0.855 1
1 102 . 4 1 1 A 14 14 VAL CB C 12 34.499 35.514 -1.015 1
1 105 . 4 1 1 A 14 14 VAL N N 12 126.378 123.578 2.800 1
1 106 . 4 1 1 A 15 15 TYR H H 13 8.745 9.010 -0.265 1
1 111 . 4 1 1 A 15 15 TYR C C 13 173.345 174.077 -0.732 1
1 112 . 4 1 1 A 15 15 TYR CA C 13 56.186 57.491 -1.305 1
1 113 . 4 1 1 A 15 15 TYR CB C 13 40.858 41.104 -0.246 1
1 116 . 4 1 1 A 15 15 TYR N N 13 129.472 128.590 0.882 1
1 117 . 4 1 1 A 16 16 PHE H H 14 7.370 8.160 -0.790 1
1 118 . 4 1 1 A 16 16 PHE HA H 14 5.720 5.195 0.525 1
1 123 . 4 1 1 A 16 16 PHE C C 14 174.058 173.979 0.079 1
1 124 . 4 1 1 A 16 16 PHE CA C 14 54.361 56.090 -1.729 1
1 125 . 4 1 1 A 16 16 PHE CB C 14 40.461 42.096 -1.635 1
1 129 . 4 1 1 A 16 16 PHE N N 14 128.263 128.291 -0.028 1
1 130 . 4 1 1 A 17 17 CYS H H 15 8.147 7.944 0.203 1
1 131 . 4 1 1 A 17 17 CYS CA C 15 56.570 57.597 -1.027 1
1 132 . 4 1 1 A 17 17 CYS CB C 15 29.690 30.152 -0.462 1
1 133 . 4 1 1 A 17 17 CYS N N 15 126.188 125.555 0.633 1
1 134 . 4 1 1 A 18 18 GLY HA2 H 16 3.819 3.740 0.079 1
1 135 . 4 1 1 A 18 18 GLY C C 16 173.374 172.386 0.988 1
1 136 . 4 1 1 A 18 18 GLY CA C 16 45.510 44.179 1.331 1
1 137 . 4 1 1 A 19 19 SER H H 17 8.533 9.017 -0.484 1
1 138 . 4 1 1 A 19 19 SER HA H 17 4.505 4.843 -0.338 1
1 139 . 4 1 1 A 19 19 SER CA C 17 58.700 59.643 -0.943 1
1 140 . 4 1 1 A 19 19 SER CB C 17 63.810 63.864 -0.054 1
1 141 . 4 1 1 A 19 19 SER N N 17 117.300 115.970 1.330 1
1 142 . 4 1 1 A 20 20 ILE HA H 18 4.309 4.696 -0.387 1
1 152 . 4 1 1 A 20 20 ILE CA C 18 61.317 60.961 0.356 1
1 153 . 4 1 1 A 20 20 ILE CB C 18 38.302 39.596 -1.294 1
1 157 . 4 1 1 A 21 21 ARG HA H 19 4.172 4.635 -0.463 1
1 160 . 4 1 1 A 21 21 ARG C C 19 177.118 175.032 2.086 1
1 161 . 4 1 1 A 21 21 ARG CA C 19 56.960 55.115 1.845 1
1 162 . 4 1 1 A 21 21 ARG CB C 19 29.568 31.984 -2.416 1
1 165 . 4 1 1 A 22 22 GLY H H 20 8.685 7.207 1.478 1
1 166 . 4 1 1 A 22 22 GLY HA2 H 20 3.801 4.095 -0.294 1
1 167 . 4 1 1 A 22 22 GLY HA3 H 20 3.923 4.100 -0.177 1
1 168 . 4 1 1 A 22 22 GLY C C 20 174.814 174.118 0.696 1
1 169 . 4 1 1 A 22 22 GLY CA C 20 45.289 45.326 -0.037 1
1 170 . 4 1 1 A 22 22 GLY N N 20 110.145 107.294 2.851 1
1 171 . 4 1 1 A 23 23 GLY H H 21 8.058 8.783 -0.725 1
1 172 . 4 1 1 A 23 23 GLY HA2 H 21 3.998 3.783 0.215 1
1 173 . 4 1 1 A 23 23 GLY HA3 H 21 4.237 3.785 0.452 1
1 174 . 4 1 1 A 23 23 GLY C C 21 174.762 173.880 0.882 1
1 175 . 4 1 1 A 23 23 GLY CA C 21 45.025 46.316 -1.291 1
1 176 . 4 1 1 A 23 23 GLY N N 21 109.327 114.433 -5.106 1
1 177 . 4 1 1 A 24 24 ARG H H 22 8.376 8.360 0.016 1
1 178 . 4 1 1 A 24 24 ARG HA H 22 4.086 4.848 -0.762 1
1 184 . 4 1 1 A 24 24 ARG C C 22 178.178 176.128 2.050 1
1 185 . 4 1 1 A 24 24 ARG CA C 22 57.471 54.054 3.417 1
1 186 . 4 1 1 A 24 24 ARG CB C 22 29.653 32.786 -3.133 1
1 189 . 4 1 1 A 24 24 ARG N N 22 120.861 120.636 0.225 1
1 190 . 4 1 1 A 25 25 GLU H H 23 8.831 9.078 -0.247 1
1 191 . 4 1 1 A 25 25 GLU HA H 23 4.015 3.891 0.124 1
1 195 . 4 1 1 A 25 25 GLU C C 23 178.005 177.970 0.035 1
1 196 . 4 1 1 A 25 25 GLU CA C 23 58.920 59.445 -0.525 1
1 197 . 4 1 1 A 25 25 GLU CB C 23 28.592 29.143 -0.551 1
1 199 . 4 1 1 A 25 25 GLU N N 23 121.243 120.741 0.502 1
1 200 . 4 1 1 A 26 26 ASP H H 24 7.897 8.167 -0.270 1
1 201 . 4 1 1 A 26 26 ASP HA H 24 4.516 4.051 0.465 1
1 203 . 4 1 1 A 26 26 ASP C C 24 176.455 178.722 -2.267 1
1 204 . 4 1 1 A 26 26 ASP CA C 24 55.122 55.853 -0.731 1
1 205 . 4 1 1 A 26 26 ASP CB C 24 39.888 39.866 0.022 1
1 206 . 4 1 1 A 26 26 ASP N N 24 119.541 119.684 -0.143 1
1 207 . 4 1 1 A 27 27 GLN H H 25 7.696 7.913 -0.217 1
1 208 . 4 1 1 A 27 27 GLN HA H 25 3.704 4.035 -0.331 1
1 212 . 4 1 1 A 27 27 GLN C C 25 177.016 178.256 -1.240 1
1 213 . 4 1 1 A 27 27 GLN CA C 25 59.501 58.796 0.705 1
1 214 . 4 1 1 A 27 27 GLN CB C 25 27.762 28.946 -1.184 1
1 216 . 4 1 1 A 27 27 GLN N N 25 119.471 119.343 0.128 1
1 217 . 4 1 1 A 28 28 ALA H H 26 8.227 7.615 0.612 1
1 218 . 4 1 1 A 28 28 ALA HA H 26 4.072 3.974 0.098 1
1 222 . 4 1 1 A 28 28 ALA C C 26 180.567 179.884 0.683 1
1 223 . 4 1 1 A 28 28 ALA CA C 26 54.627 55.170 -0.543 1
1 224 . 4 1 1 A 28 28 ALA CB C 26 17.355 18.645 -1.290 1
1 225 . 4 1 1 A 28 28 ALA N N 26 122.362 122.295 0.067 1
1 226 . 4 1 1 A 29 29 LEU H H 27 7.533 8.203 -0.670 1
1 227 . 4 1 1 A 29 29 LEU HA H 27 4.050 4.062 -0.012 1
1 237 . 4 1 1 A 29 29 LEU C C 27 178.752 178.042 0.710 1
1 238 . 4 1 1 A 29 29 LEU CA C 27 57.578 57.652 -0.074 1
1 239 . 4 1 1 A 29 29 LEU CB C 27 40.734 41.650 -0.916 1
1 243 . 4 1 1 A 29 29 LEU N N 27 122.255 119.795 2.460 1
1 244 . 4 1 1 A 30 30 TYR H H 28 8.473 8.249 0.224 1
1 245 . 4 1 1 A 30 30 TYR HA H 28 4.049 4.334 -0.285 1
1 250 . 4 1 1 A 30 30 TYR C C 28 177.736 178.500 -0.764 1
1 251 . 4 1 1 A 30 30 TYR CA C 28 59.817 60.077 -0.260 1
1 252 . 4 1 1 A 30 30 TYR CB C 28 36.140 37.107 -0.967 1
1 255 . 4 1 1 A 30 30 TYR N N 28 120.403 118.486 1.917 1
1 256 . 4 1 1 A 31 31 ALA H H 29 8.008 8.357 -0.349 1
1 257 . 4 1 1 A 31 31 ALA HA H 29 4.005 3.851 0.154 1
1 261 . 4 1 1 A 31 31 ALA C C 29 180.879 179.696 1.183 1
1 262 . 4 1 1 A 31 31 ALA CA C 29 54.914 55.242 -0.328 1
1 263 . 4 1 1 A 31 31 ALA CB C 29 17.375 18.052 -0.677 1
1 264 . 4 1 1 A 31 31 ALA N N 29 120.771 122.723 -1.952 1
1 265 . 4 1 1 A 32 32 ARG H H 30 7.596 7.620 -0.024 1
1 266 . 4 1 1 A 32 32 ARG HA H 30 3.916 4.035 -0.119 1
1 273 . 4 1 1 A 32 32 ARG C C 30 179.919 178.601 1.318 1
1 274 . 4 1 1 A 32 32 ARG CA C 30 59.014 59.137 -0.123 1
1 275 . 4 1 1 A 32 32 ARG CB C 30 30.531 29.718 0.813 1
1 278 . 4 1 1 A 32 32 ARG N N 30 120.365 118.316 2.049 1
1 279 . 4 1 1 A 33 33 ILE H H 31 8.066 8.416 -0.350 1
1 280 . 4 1 1 A 33 33 ILE HA H 31 3.120 3.707 -0.587 1
1 290 . 4 1 1 A 33 33 ILE C C 31 177.051 178.502 -1.451 1
1 291 . 4 1 1 A 33 33 ILE CA C 31 65.757 65.489 0.268 1
1 292 . 4 1 1 A 33 33 ILE CB C 31 36.928 38.057 -1.129 1
1 296 . 4 1 1 A 33 33 ILE N N 31 121.608 119.788 1.820 1
1 297 . 4 1 1 A 34 34 VAL H H 32 8.148 9.028 -0.880 1
1 298 . 4 1 1 A 34 34 VAL HA H 32 2.954 3.563 -0.609 1
1 306 . 4 1 1 A 34 34 VAL C C 32 177.159 178.048 -0.889 1
1 307 . 4 1 1 A 34 34 VAL CA C 32 67.220 66.304 0.916 1
1 308 . 4 1 1 A 34 34 VAL CB C 32 31.039 31.109 -0.070 1
1 311 . 4 1 1 A 34 34 VAL N N 32 119.318 120.218 -0.900 1
1 312 . 4 1 1 A 35 35 SER H H 33 7.826 8.198 -0.372 1
1 313 . 4 1 1 A 35 35 SER HA H 33 3.868 4.058 -0.190 1
1 316 . 4 1 1 A 35 35 SER C C 33 176.779 177.377 -0.598 1
1 317 . 4 1 1 A 35 35 SER CA C 33 62.000 61.287 0.713 1
1 318 . 4 1 1 A 35 35 SER CB C 33 62.789 62.991 -0.202 1
1 319 . 4 1 1 A 35 35 SER N N 33 111.936 116.198 -4.262 1
1 320 . 4 1 1 A 36 36 ARG H H 34 7.405 7.663 -0.258 1
1 321 . 4 1 1 A 36 36 ARG HA H 34 4.070 4.094 -0.024 1
1 323 . 4 1 1 A 36 36 ARG C C 34 178.047 178.181 -0.134 1
1 324 . 4 1 1 A 36 36 ARG CA C 34 56.108 58.799 -2.691 1
1 325 . 4 1 1 A 36 36 ARG CB C 34 28.837 29.604 -0.767 1
1 326 . 4 1 1 A 36 36 ARG N N 34 120.909 121.836 -0.927 1
1 327 . 4 1 1 A 37 37 LEU H H 35 8.301 8.163 0.138 1
1 328 . 4 1 1 A 37 37 LEU HA H 35 3.620 3.816 -0.196 1
1 336 . 4 1 1 A 37 37 LEU C C 35 178.446 179.215 -0.769 1
1 337 . 4 1 1 A 37 37 LEU CA C 35 57.640 57.939 -0.299 1
1 338 . 4 1 1 A 37 37 LEU CB C 35 41.584 41.212 0.372 1
1 342 . 4 1 1 A 37 37 LEU N N 35 118.567 119.803 -1.236 1
1 343 . 4 1 1 A 38 38 ARG H H 36 7.379 8.517 -1.138 1
1 344 . 4 1 1 A 38 38 ARG HA H 36 4.340 4.017 0.323 1
1 350 . 4 1 1 A 38 38 ARG C C 36 177.895 178.561 -0.666 1
1 351 . 4 1 1 A 38 38 ARG CA C 36 57.785 59.400 -1.615 1
1 352 . 4 1 1 A 38 38 ARG CB C 36 29.775 29.848 -0.073 1
1 355 . 4 1 1 A 38 38 ARG N N 36 115.352 118.618 -3.266 1
1 356 . 4 1 1 A 39 39 ARG H H 37 7.240 7.792 -0.552 1
1 357 . 4 1 1 A 39 39 ARG HA H 37 3.743 4.214 -0.471 1
1 363 . 4 1 1 A 39 39 ARG C C 37 176.988 178.373 -1.385 1
1 364 . 4 1 1 A 39 39 ARG CA C 37 57.605 57.406 0.199 1
1 365 . 4 1 1 A 39 39 ARG CB C 37 28.925 30.359 -1.434 1
1 368 . 4 1 1 A 39 39 ARG N N 37 117.410 118.265 -0.855 1
1 369 . 4 1 1 A 40 40 TYR H H 38 7.296 7.850 -0.554 1
1 370 . 4 1 1 A 40 40 TYR HA H 38 4.319 4.211 0.108 1
1 375 . 4 1 1 A 40 40 TYR C C 38 175.001 176.314 -1.313 1
1 376 . 4 1 1 A 40 40 TYR CA C 38 57.730 60.612 -2.882 1
1 377 . 4 1 1 A 40 40 TYR CB C 38 39.343 38.810 0.533 1
1 380 . 4 1 1 A 40 40 TYR N N 38 116.937 117.264 -0.327 1
1 381 . 4 1 1 A 41 41 GLY H H 39 7.325 7.895 -0.570 1
1 382 . 4 1 1 A 41 41 GLY HA2 H 39 3.953 4.079 -0.126 1
1 383 . 4 1 1 A 41 41 GLY C C 39 171.302 172.710 -1.408 1
1 384 . 4 1 1 A 41 41 GLY CA C 39 45.590 44.631 0.959 1
1 385 . 4 1 1 A 41 41 GLY N N 39 105.596 104.528 1.068 1
1 386 . 4 1 1 A 42 42 LYS H H 40 8.186 8.976 -0.790 1
1 387 . 4 1 1 A 42 42 LYS HA H 40 4.205 4.486 -0.281 1
1 393 . 4 1 1 A 42 42 LYS C C 40 175.672 175.683 -0.011 1
1 394 . 4 1 1 A 42 42 LYS CA C 40 55.241 55.705 -0.464 1
1 395 . 4 1 1 A 42 42 LYS CB C 40 32.889 33.766 -0.877 1
1 399 . 4 1 1 A 42 42 LYS N N 40 120.341 120.454 -0.113 1
1 400 . 4 1 1 A 43 43 VAL H H 41 8.610 8.673 -0.063 1
1 401 . 4 1 1 A 43 43 VAL HA H 41 4.416 4.243 0.173 1
1 409 . 4 1 1 A 43 43 VAL C C 41 175.997 175.652 0.345 1
1 410 . 4 1 1 A 43 43 VAL CA C 41 61.331 62.715 -1.384 1
1 411 . 4 1 1 A 43 43 VAL CB C 41 30.573 31.410 -0.837 1
1 414 . 4 1 1 A 43 43 VAL N N 41 127.312 124.765 2.547 1
1 415 . 4 1 1 A 44 44 LEU H H 42 8.894 8.293 0.601 1
1 416 . 4 1 1 A 44 44 LEU HA H 42 4.496 3.778 0.718 1
1 424 . 4 1 1 A 44 44 LEU CA C 42 54.522 55.279 -0.757 1
1 425 . 4 1 1 A 44 44 LEU CB C 42 40.980 41.771 -0.791 1
1 429 . 4 1 1 A 44 44 LEU N N 42 130.261 128.853 1.408 1
1 430 . 4 1 1 A 45 45 THR HA H 43 4.263 3.981 0.282 1
1 435 . 4 1 1 A 45 45 THR CA C 43 61.033 62.150 -1.117 1
1 436 . 4 1 1 A 45 45 THR CB C 43 69.768 68.464 1.304 1
1 440 . 4 1 1 A 46 46 GLU CA C 44 56.411 54.700 1.711 1
1 441 . 4 1 1 A 46 46 GLU CB C 44 29.827 31.013 -1.186 1
1 443 . 4 1 1 A 47 47 HIS HA H 45 4.549 4.255 0.294 1
1 447 . 4 1 1 A 47 47 HIS C C 45 174.812 176.910 -2.098 1
1 448 . 4 1 1 A 47 47 HIS CA C 45 56.107 58.627 -2.520 1
1 449 . 4 1 1 A 47 47 HIS CB C 45 29.080 29.117 -0.037 1
1 451 . 4 1 1 A 48 48 VAL H H 46 7.826 7.262 0.564 1
1 452 . 4 1 1 A 48 48 VAL HA H 46 4.024 3.072 0.952 1
1 460 . 4 1 1 A 48 48 VAL C C 46 175.697 177.645 -1.948 1
1 461 . 4 1 1 A 48 48 VAL CA C 46 61.841 66.287 -4.446 1
1 462 . 4 1 1 A 48 48 VAL CB C 46 32.600 31.384 1.216 1
1 465 . 4 1 1 A 48 48 VAL N N 46 121.117 120.374 0.743 1
1 466 . 4 1 1 A 49 49 ALA H H 47 8.237 7.999 0.238 1
1 467 . 4 1 1 A 49 49 ALA HA H 47 4.281 3.903 0.378 1
1 471 . 4 1 1 A 49 49 ALA C C 47 177.173 178.227 -1.054 1
1 472 . 4 1 1 A 49 49 ALA CA C 47 52.207 54.856 -2.649 1
1 473 . 4 1 1 A 49 49 ALA CB C 47 19.064 18.399 0.665 1
1 474 . 4 1 1 A 49 49 ALA N N 47 126.817 122.218 4.599 1
1 475 . 4 1 1 A 50 50 ASP H H 48 8.029 7.835 0.194 1
1 476 . 4 1 1 A 50 50 ASP HA H 48 4.436 4.689 -0.253 1
1 479 . 4 1 1 A 50 50 ASP C C 48 176.124 176.938 -0.814 1
1 480 . 4 1 1 A 50 50 ASP CA C 48 54.447 53.202 1.245 1
1 481 . 4 1 1 A 50 50 ASP CB C 48 40.877 40.931 -0.054 1
1 482 . 4 1 1 A 50 50 ASP N N 48 119.687 117.496 2.191 1
1 483 . 4 1 1 A 51 51 ALA H H 49 8.094 9.019 -0.925 1
1 484 . 4 1 1 A 51 51 ALA HA H 49 4.134 4.680 -0.546 1
1 488 . 4 1 1 A 51 51 ALA C C 49 177.835 177.880 -0.045 1
1 489 . 4 1 1 A 51 51 ALA CA C 49 52.900 51.133 1.767 1
1 490 . 4 1 1 A 51 51 ALA CB C 49 18.942 19.230 -0.288 1
1 491 . 4 1 1 A 51 51 ALA N N 49 124.400 123.117 1.283 1
1 492 . 4 1 1 A 52 52 GLU H H 50 8.243 8.094 0.149 1
1 493 . 4 1 1 A 52 52 GLU HA H 50 4.152 4.608 -0.456 1
1 497 . 4 1 1 A 52 52 GLU C C 50 176.456 177.833 -1.377 1
1 498 . 4 1 1 A 52 52 GLU CA C 50 56.480 56.363 0.117 1
1 499 . 4 1 1 A 52 52 GLU CB C 50 29.470 31.636 -2.166 1
1 501 . 4 1 1 A 52 52 GLU N N 50 118.917 116.625 2.292 1
1 502 . 4 1 1 A 53 53 LEU H H 51 7.839 7.857 -0.018 1
1 503 . 4 1 1 A 53 53 LEU HA H 51 4.229 4.039 0.190 1
1 513 . 4 1 1 A 53 53 LEU C C 51 177.058 176.884 0.174 1
1 514 . 4 1 1 A 53 53 LEU CA C 51 54.625 57.440 -2.815 1
1 515 . 4 1 1 A 53 53 LEU CB C 51 42.125 41.696 0.429 1
1 519 . 4 1 1 A 53 53 LEU N N 51 122.169 120.212 1.957 1
1 520 . 4 1 1 A 54 54 GLU H H 52 8.104 8.104 0.000 1
1 521 . 4 1 1 A 54 54 GLU HA H 52 4.470 4.526 -0.056 1
1 525 . 4 1 1 A 54 54 GLU CA C 52 54.286 55.180 -0.894 1
1 526 . 4 1 1 A 54 54 GLU CB C 52 29.268 29.010 0.258 1
1 528 . 4 1 1 A 54 54 GLU N N 52 123.040 120.586 2.454 1
1 529 . 4 1 1 A 55 55 PRO HA H 53 4.310 4.551 -0.241 1
1 536 . 4 1 1 A 55 55 PRO C C 53 177.019 177.144 -0.125 1
1 537 . 4 1 1 A 55 55 PRO CA C 53 63.075 63.138 -0.063 1
1 538 . 4 1 1 A 55 55 PRO CB C 53 31.329 30.854 0.475 1
1 541 . 4 1 1 A 56 56 LEU H H 54 8.263 9.687 -1.424 1
1 542 . 4 1 1 A 56 56 LEU HA H 54 4.237 4.111 0.126 1
1 552 . 4 1 1 A 56 56 LEU C C 54 178.055 176.725 1.330 1
1 553 . 4 1 1 A 56 56 LEU CA C 54 55.018 57.097 -2.079 1
1 554 . 4 1 1 A 56 56 LEU CB C 54 41.990 40.798 1.192 1
1 558 . 4 1 1 A 56 56 LEU N N 54 122.728 116.889 5.839 1
1 559 . 4 1 1 A 57 57 GLY H H 55 8.231 8.673 -0.442 1
1 560 . 4 1 1 A 57 57 GLY HA2 H 55 3.911 4.092 -0.181 1
1 561 . 4 1 1 A 57 57 GLY HA3 H 55 3.808 4.097 -0.289 1
1 562 . 4 1 1 A 57 57 GLY C C 55 174.379 175.743 -1.364 1
1 563 . 4 1 1 A 57 57 GLY CA C 55 45.092 45.714 -0.622 1
1 564 . 4 1 1 A 57 57 GLY N N 55 110.035 110.703 -0.668 1
1 565 . 4 1 1 A 58 58 GLU H H 56 8.241 8.262 -0.021 1
1 566 . 4 1 1 A 58 58 GLU HA H 56 4.136 4.083 0.053 1
1 570 . 4 1 1 A 58 58 GLU C C 56 176.868 177.436 -0.568 1
1 571 . 4 1 1 A 58 58 GLU CA C 56 56.734 59.414 -2.680 1
1 572 . 4 1 1 A 58 58 GLU CB C 56 29.584 29.563 0.021 1
1 574 . 4 1 1 A 58 58 GLU N N 56 121.173 121.269 -0.096 1
1 575 . 4 1 1 A 59 59 GLU H H 57 8.419 8.040 0.379 1
1 576 . 4 1 1 A 59 59 GLU HA H 57 4.074 4.649 -0.575 1
1 580 . 4 1 1 A 59 59 GLU C C 57 176.502 175.342 1.160 1
1 581 . 4 1 1 A 59 59 GLU CA C 57 56.842 56.050 0.792 1
1 582 . 4 1 1 A 59 59 GLU CB C 57 29.267 31.090 -1.823 1
1 584 . 4 1 1 A 59 59 GLU N N 57 121.777 113.989 7.788 1
1 585 . 4 1 1 A 60 60 ALA H H 58 8.077 7.983 0.094 1
1 586 . 4 1 1 A 60 60 ALA HA H 58 4.134 4.650 -0.516 1
1 590 . 4 1 1 A 60 60 ALA CA C 58 52.432 51.110 1.322 1
1 591 . 4 1 1 A 60 60 ALA CB C 58 18.743 23.271 -4.528 1
1 592 . 4 1 1 A 60 60 ALA N N 58 125.120 121.889 3.231 1
1 593 . 4 1 1 A 61 61 ALA H H 59 8.041 8.356 -0.315 1
1 594 . 4 1 1 A 61 61 ALA HA H 59 4.131 4.722 -0.591 1
1 598 . 4 1 1 A 61 61 ALA C C 59 178.147 177.340 0.807 1
1 599 . 4 1 1 A 61 61 ALA CA C 59 52.586 51.730 0.856 1
1 600 . 4 1 1 A 61 61 ALA CB C 59 18.692 19.933 -1.241 1
1 601 . 4 1 1 A 61 61 ALA N N 59 123.857 121.720 2.137 1
1 602 . 4 1 1 A 62 62 GLY H H 60 8.069 8.424 -0.355 1
1 603 . 4 1 1 A 62 62 GLY HA2 H 60 3.810 3.910 -0.100 1
1 604 . 4 1 1 A 62 62 GLY HA3 H 60 3.888 3.944 -0.056 1
1 605 . 4 1 1 A 62 62 GLY C C 60 174.914 175.431 -0.517 1
1 606 . 4 1 1 A 62 62 GLY CA C 60 45.320 45.380 -0.060 1
1 607 . 4 1 1 A 62 62 GLY N N 60 107.924 109.255 -1.331 1
1 608 . 4 1 1 A 63 63 GLY H H 61 8.118 8.149 -0.031 1
1 609 . 4 1 1 A 63 63 GLY HA2 H 61 4.008 4.039 -0.031 1
1 610 . 4 1 1 A 63 63 GLY HA3 H 61 3.893 4.102 -0.209 1
1 611 . 4 1 1 A 63 63 GLY C C 61 174.743 175.152 -0.409 1
1 612 . 4 1 1 A 63 63 GLY CA C 61 45.202 46.554 -1.352 1
1 613 . 4 1 1 A 63 63 GLY N N 61 109.441 108.396 1.045 1
1 614 . 4 1 1 A 64 64 ASP H H 62 8.305 8.330 -0.025 1
1 615 . 4 1 1 A 64 64 ASP HA H 62 4.240 4.285 -0.045 1
1 618 . 4 1 1 A 64 64 ASP C C 62 177.571 178.523 -0.952 1
1 619 . 4 1 1 A 64 64 ASP CA C 62 57.210 57.153 0.057 1
1 620 . 4 1 1 A 64 64 ASP CB C 62 40.142 40.407 -0.265 1
1 621 . 4 1 1 A 64 64 ASP N N 62 121.568 118.444 3.124 1
1 622 . 4 1 1 A 65 65 GLN H H 63 8.337 8.138 0.199 1
1 623 . 4 1 1 A 65 65 GLN HA H 63 4.138 4.053 0.085 1
1 628 . 4 1 1 A 65 65 GLN C C 63 177.490 178.817 -1.327 1
1 629 . 4 1 1 A 65 65 GLN CA C 63 58.643 58.799 -0.156 1
1 630 . 4 1 1 A 65 65 GLN CB C 63 27.803 28.543 -0.740 1
1 632 . 4 1 1 A 65 65 GLN N N 63 119.700 120.312 -0.612 1
1 633 . 4 1 1 A 66 66 PHE H H 64 7.658 8.407 -0.749 1
1 634 . 4 1 1 A 66 66 PHE HA H 64 4.170 4.379 -0.209 1
1 638 . 4 1 1 A 66 66 PHE C C 64 176.872 178.316 -1.444 1
1 639 . 4 1 1 A 66 66 PHE CA C 64 60.158 61.097 -0.939 1
1 640 . 4 1 1 A 66 66 PHE CB C 64 38.490 38.287 0.203 1
1 643 . 4 1 1 A 66 66 PHE N N 64 121.036 119.176 1.860 1
1 644 . 4 1 1 A 67 67 ILE H H 65 7.646 7.896 -0.250 1
1 645 . 4 1 1 A 67 67 ILE HA H 65 3.426 3.596 -0.170 1
1 655 . 4 1 1 A 67 67 ILE CA C 65 63.377 64.928 -1.551 1
1 656 . 4 1 1 A 67 67 ILE CB C 65 37.057 37.632 -0.575 1
1 660 . 4 1 1 A 67 67 ILE N N 65 121.372 119.760 1.612 1
1 661 . 4 1 1 A 68 68 HIS H H 66 7.945 8.374 -0.429 1
1 662 . 4 1 1 A 68 68 HIS HA H 66 4.005 4.174 -0.169 1
1 665 . 4 1 1 A 68 68 HIS CA C 66 59.915 60.290 -0.375 1
1 668 . 4 1 1 A 68 68 HIS N N 66 120.036 119.455 0.581 1
1 669 . 4 1 1 A 69 69 GLU HA H 67 3.677 3.898 -0.221 1
1 673 . 4 1 1 A 69 69 GLU CA C 67 58.490 59.845 -1.355 1
1 674 . 4 1 1 A 69 69 GLU CB C 67 29.290 29.017 0.273 1
1 676 . 4 1 1 A 70 70 GLN H H 68 8.017 8.020 -0.003 1
1 677 . 4 1 1 A 70 70 GLN HA H 68 3.426 4.289 -0.863 1
1 678 . 4 1 1 A 70 70 GLN C C 68 179.280 179.029 0.251 1
1 679 . 4 1 1 A 70 70 GLN CA C 68 57.561 58.762 -1.201 1
1 680 . 4 1 1 A 70 70 GLN CB C 68 28.530 28.437 0.093 1
1 682 . 4 1 1 A 70 70 GLN N N 68 120.410 118.857 1.553 1
1 683 . 4 1 1 A 71 71 ASP HA H 69 4.440 5.250 -0.810 1
1 684 . 4 1 1 A 71 71 ASP C C 69 177.402 178.768 -1.366 1
1 685 . 4 1 1 A 71 71 ASP CA C 69 56.290 57.353 -1.063 1
1 686 . 4 1 1 A 72 72 LEU H H 70 7.952 8.588 -0.636 1
1 687 . 4 1 1 A 72 72 LEU HA H 70 3.775 3.930 -0.155 1
1 697 . 4 1 1 A 72 72 LEU C C 70 178.316 178.243 0.073 1
1 698 . 4 1 1 A 72 72 LEU CA C 70 56.101 57.396 -1.295 1
1 699 . 4 1 1 A 72 72 LEU CB C 70 39.872 41.309 -1.437 1
1 703 . 4 1 1 A 72 72 LEU N N 70 120.832 120.801 0.031 1
1 704 . 4 1 1 A 73 73 ASN H H 71 7.723 8.153 -0.430 1
1 705 . 4 1 1 A 73 73 ASN HA H 71 4.270 4.360 -0.090 1
1 708 . 4 1 1 A 73 73 ASN C C 71 178.193 177.721 0.472 1
1 709 . 4 1 1 A 73 73 ASN CA C 71 55.970 56.392 -0.422 1
1 710 . 4 1 1 A 73 73 ASN CB C 71 37.640 38.862 -1.222 1
1 711 . 4 1 1 A 73 73 ASN N N 71 119.295 117.141 2.154 1
1 712 . 4 1 1 A 74 74 TRP H H 72 7.811 8.243 -0.432 1
1 713 . 4 1 1 A 74 74 TRP HA H 72 4.500 4.468 0.032 1
1 720 . 4 1 1 A 74 74 TRP CA C 72 58.480 60.236 -1.756 1
1 721 . 4 1 1 A 74 74 TRP CB C 72 28.920 29.942 -1.022 1
1 727 . 4 1 1 A 74 74 TRP N N 72 121.490 120.439 1.051 1
1 729 . 4 1 1 A 75 75 LEU H H 73 8.412 8.199 0.213 1
1 730 . 4 1 1 A 75 75 LEU HA H 73 3.290 3.557 -0.267 1
1 739 . 4 1 1 A 75 75 LEU C C 73 178.562 178.619 -0.057 1
1 740 . 4 1 1 A 75 75 LEU CA C 73 58.226 57.457 0.769 1
1 741 . 4 1 1 A 75 75 LEU CB C 73 41.200 41.057 0.143 1
1 745 . 4 1 1 A 75 75 LEU N N 73 121.065 120.817 0.248 1
1 746 . 4 1 1 A 76 76 GLN H H 74 7.648 7.790 -0.142 1
1 747 . 4 1 1 A 76 76 GLN HA H 74 3.657 4.114 -0.457 1
1 752 . 4 1 1 A 76 76 GLN C C 74 178.616 177.535 1.081 1
1 753 . 4 1 1 A 76 76 GLN CA C 74 58.777 58.813 -0.036 1
1 754 . 4 1 1 A 76 76 GLN CB C 74 28.163 28.155 0.008 1
1 756 . 4 1 1 A 76 76 GLN N N 74 113.985 118.976 -4.991 1
1 757 . 4 1 1 A 77 77 GLN H H 75 7.465 8.276 -0.811 1
1 758 . 4 1 1 A 77 77 GLN HA H 75 4.134 4.390 -0.256 1
1 761 . 4 1 1 A 77 77 GLN C C 75 176.223 175.915 0.308 1
1 762 . 4 1 1 A 77 77 GLN CA C 75 56.203 55.305 0.898 1
1 763 . 4 1 1 A 77 77 GLN CB C 75 29.524 28.050 1.474 1
1 765 . 4 1 1 A 77 77 GLN N N 75 117.481 114.970 2.511 1
1 766 . 4 1 1 A 78 78 ALA H H 76 7.420 7.214 0.206 1
1 767 . 4 1 1 A 78 78 ALA HA H 76 3.864 4.298 -0.434 1
1 771 . 4 1 1 A 78 78 ALA C C 76 176.733 177.326 -0.593 1
1 772 . 4 1 1 A 78 78 ALA CA C 76 52.529 53.090 -0.561 1
1 773 . 4 1 1 A 78 78 ALA CB C 76 20.124 19.243 0.881 1
1 774 . 4 1 1 A 78 78 ALA N N 76 122.682 124.684 -2.002 1
1 775 . 4 1 1 A 79 79 ASP H H 77 9.028 8.854 0.174 1
1 776 . 4 1 1 A 79 79 ASP HA H 77 4.673 4.572 0.101 1
1 779 . 4 1 1 A 79 79 ASP C C 77 175.740 175.939 -0.199 1
1 780 . 4 1 1 A 79 79 ASP CA C 77 56.383 56.198 0.185 1
1 781 . 4 1 1 A 79 79 ASP CB C 77 42.826 41.810 1.016 1
1 782 . 4 1 1 A 79 79 ASP N N 77 119.887 122.853 -2.966 1
1 783 . 4 1 1 A 80 80 VAL H H 78 7.379 7.877 -0.498 1
1 784 . 4 1 1 A 80 80 VAL HA H 78 4.340 4.983 -0.643 1
1 792 . 4 1 1 A 80 80 VAL C C 78 175.321 174.587 0.734 1
1 793 . 4 1 1 A 80 80 VAL CA C 78 60.011 60.283 -0.272 1
1 794 . 4 1 1 A 80 80 VAL CB C 78 35.362 36.931 -1.569 1
1 797 . 4 1 1 A 80 80 VAL N N 78 114.152 116.599 -2.447 1
1 798 . 4 1 1 A 81 81 VAL H H 79 8.350 8.683 -0.333 1
1 799 . 4 1 1 A 81 81 VAL HA H 79 4.799 4.884 -0.085 1
1 807 . 4 1 1 A 81 81 VAL C C 79 173.095 174.637 -1.542 1
1 808 . 4 1 1 A 81 81 VAL CA C 79 60.775 60.901 -0.126 1
1 809 . 4 1 1 A 81 81 VAL CB C 79 32.824 36.111 -3.287 1
1 812 . 4 1 1 A 81 81 VAL N N 79 128.429 123.440 4.989 1
1 813 . 4 1 1 A 82 82 VAL H H 80 8.947 8.738 0.209 1
1 814 . 4 1 1 A 82 82 VAL HA H 80 4.947 4.745 0.202 1
1 822 . 4 1 1 A 82 82 VAL C C 80 173.522 173.939 -0.417 1
1 823 . 4 1 1 A 82 82 VAL CA C 80 59.684 60.259 -0.575 1
1 824 . 4 1 1 A 82 82 VAL CB C 80 33.702 34.925 -1.223 1
1 827 . 4 1 1 A 82 82 VAL N N 80 126.957 125.196 1.761 1
1 828 . 4 1 1 A 83 83 ALA H H 81 9.011 8.387 0.624 1
1 829 . 4 1 1 A 83 83 ALA HA H 81 4.938 4.729 0.209 1
1 833 . 4 1 1 A 83 83 ALA C C 81 130.330 174.694 -44.364 1
1 834 . 4 1 1 A 83 83 ALA CA C 81 49.490 50.871 -1.381 1
1 835 . 4 1 1 A 83 83 ALA CB C 81 23.628 23.657 -0.029 1
1 836 . 4 1 1 A 83 83 ALA N N 81 128.705 126.477 2.228 1
1 837 . 4 1 1 A 84 84 GLU H H 82 8.922 8.545 0.377 1
1 838 . 4 1 1 A 84 84 GLU HA H 82 4.937 5.188 -0.251 1
1 839 . 4 1 1 A 84 84 GLU C C 82 177.673 176.679 0.994 1
1 840 . 4 1 1 A 84 84 GLU CA C 82 56.714 54.773 1.941 1
1 841 . 4 1 1 A 84 84 GLU CB C 82 29.882 33.090 -3.208 1
1 842 . 4 1 1 A 84 84 GLU N N 82 130.330 121.327 9.003 1
1 843 . 4 1 1 A 85 85 VAL H H 83 8.427 9.230 -0.803 1
1 844 . 4 1 1 A 85 85 VAL HA H 83 4.435 4.671 -0.236 1
1 852 . 4 1 1 A 85 85 VAL C C 83 174.252 176.754 -2.502 1
1 853 . 4 1 1 A 85 85 VAL CA C 83 59.896 61.245 -1.349 1
1 854 . 4 1 1 A 85 85 VAL CB C 83 29.968 32.024 -2.056 1
1 857 . 4 1 1 A 85 85 VAL N N 83 114.212 120.787 -6.575 1
1 858 . 4 1 1 A 86 86 THR H H 84 9.347 7.884 1.463 1
1 859 . 4 1 1 A 86 86 THR HA H 84 4.146 4.115 0.031 1
1 864 . 4 1 1 A 86 86 THR C C 84 175.751 175.829 -0.078 1
1 865 . 4 1 1 A 86 86 THR CA C 84 67.629 65.822 1.807 1
1 866 . 4 1 1 A 86 86 THR CB C 84 66.819 69.083 -2.264 1
1 868 . 4 1 1 A 86 86 THR N N 84 121.640 118.488 3.152 1
1 869 . 4 1 1 A 87 87 GLN H H 85 8.114 7.885 0.229 1
1 870 . 4 1 1 A 87 87 GLN HA H 85 4.736 4.769 -0.033 1
1 874 . 4 1 1 A 87 87 GLN CA C 85 51.898 54.160 -2.262 1
1 875 . 4 1 1 A 87 87 GLN CB C 85 27.942 29.922 -1.980 1
1 877 . 4 1 1 A 87 87 GLN N N 85 120.367 119.743 0.624 1
1 878 . 4 1 1 A 88 88 PRO HA H 86 4.061 4.458 -0.397 1
1 885 . 4 1 1 A 88 88 PRO C C 86 176.436 176.147 0.289 1
1 886 . 4 1 1 A 88 88 PRO CA C 86 63.422 63.537 -0.115 1
1 887 . 4 1 1 A 88 88 PRO CB C 86 31.925 32.064 -0.139 1
1 889 . 4 1 1 A 89 89 SER H H 87 6.044 8.256 -2.212 1
1 890 . 4 1 1 A 89 89 SER HA H 87 4.630 5.200 -0.570 1
1 893 . 4 1 1 A 89 89 SER C C 87 175.612 175.071 0.541 1
1 894 . 4 1 1 A 89 89 SER CA C 87 56.800 56.561 0.239 1
1 895 . 4 1 1 A 89 89 SER CB C 87 64.196 65.215 -1.019 1
1 896 . 4 1 1 A 89 89 SER N N 87 115.721 114.008 1.713 1
1 897 . 4 1 1 A 90 90 LEU H H 88 9.702 8.937 0.765 1
1 898 . 4 1 1 A 90 90 LEU HA H 88 4.270 4.155 0.115 1
1 906 . 4 1 1 A 90 90 LEU C C 88 179.173 178.859 0.314 1
1 907 . 4 1 1 A 90 90 LEU CA C 88 57.402 57.935 -0.533 1
1 908 . 4 1 1 A 90 90 LEU CB C 88 43.642 42.010 1.632 1
1 911 . 4 1 1 A 90 90 LEU N N 88 130.488 125.644 4.844 1
1 912 . 4 1 1 A 91 91 GLY H H 89 8.354 8.414 -0.060 1
1 913 . 4 1 1 A 91 91 GLY HA2 H 89 3.680 3.884 -0.204 1
1 914 . 4 1 1 A 91 91 GLY HA3 H 89 3.584 3.888 -0.304 1
1 915 . 4 1 1 A 91 91 GLY C C 89 175.106 176.446 -1.340 1
1 916 . 4 1 1 A 91 91 GLY CA C 89 47.770 47.653 0.117 1
1 917 . 4 1 1 A 91 91 GLY N N 89 107.522 106.397 1.125 1
1 918 . 4 1 1 A 92 92 VAL H H 90 7.906 8.163 -0.257 1
1 919 . 4 1 1 A 92 92 VAL HA H 90 3.940 3.793 0.147 1
1 927 . 4 1 1 A 92 92 VAL C C 90 178.467 178.171 0.296 1
1 928 . 4 1 1 A 92 92 VAL CA C 90 65.379 66.503 -1.124 1
1 929 . 4 1 1 A 92 92 VAL CB C 90 31.785 31.540 0.245 1
1 932 . 4 1 1 A 92 92 VAL N N 90 121.741 121.988 -0.247 1
1 933 . 4 1 1 A 93 93 GLY H H 91 7.595 7.798 -0.203 1
1 934 . 4 1 1 A 93 93 GLY HA2 H 91 3.628 3.775 -0.147 1
1 935 . 4 1 1 A 93 93 GLY HA3 H 91 3.415 3.788 -0.373 1
1 936 . 4 1 1 A 93 93 GLY C C 91 174.022 175.657 -1.635 1
1 937 . 4 1 1 A 93 93 GLY CA C 91 48.319 47.448 0.871 1
1 938 . 4 1 1 A 93 93 GLY N N 91 104.629 108.166 -3.537 1
1 939 . 4 1 1 A 94 94 TYR H H 92 8.372 7.852 0.520 1
1 940 . 4 1 1 A 94 94 TYR HA H 92 4.046 4.059 -0.013 1
1 943 . 4 1 1 A 94 94 TYR C C 92 177.458 177.907 -0.449 1
1 944 . 4 1 1 A 94 94 TYR CA C 92 61.760 60.723 1.037 1
1 945 . 4 1 1 A 94 94 TYR CB C 92 38.431 38.783 -0.352 1
1 948 . 4 1 1 A 94 94 TYR N N 92 123.383 123.521 -0.138 1
1 949 . 4 1 1 A 95 95 GLU H H 93 8.424 8.458 -0.034 1
1 950 . 4 1 1 A 95 95 GLU HA H 93 3.421 3.946 -0.525 1
1 951 . 4 1 1 A 95 95 GLU C C 93 178.590 179.680 -1.090 1
1 952 . 4 1 1 A 95 95 GLU CA C 93 60.211 59.200 1.011 1
1 953 . 4 1 1 A 95 95 GLU CB C 93 29.025 29.032 -0.007 1
1 954 . 4 1 1 A 95 95 GLU N N 93 120.181 118.364 1.817 1
1 955 . 4 1 1 A 96 96 LEU H H 94 8.210 8.534 -0.324 1
1 956 . 4 1 1 A 96 96 LEU HA H 94 3.830 4.004 -0.174 1
1 964 . 4 1 1 A 96 96 LEU C C 94 179.032 179.470 -0.438 1
1 965 . 4 1 1 A 96 96 LEU CA C 94 57.683 58.240 -0.557 1
1 966 . 4 1 1 A 96 96 LEU CB C 94 41.883 41.976 -0.093 1
1 970 . 4 1 1 A 96 96 LEU N N 94 118.091 120.628 -2.537 1
1 971 . 4 1 1 A 97 97 GLY H H 95 8.773 8.197 0.576 1
1 972 . 4 1 1 A 97 97 GLY C C 95 175.344 175.233 0.111 1
1 973 . 4 1 1 A 97 97 GLY CA C 95 47.308 47.190 0.118 1
1 974 . 4 1 1 A 97 97 GLY N N 95 108.085 105.902 2.183 1
1 975 . 4 1 1 A 98 98 ARG H H 96 8.100 8.402 -0.302 1
1 976 . 4 1 1 A 98 98 ARG C C 96 179.692 177.951 1.741 1
1 977 . 4 1 1 A 98 98 ARG CA C 96 56.308 58.628 -2.320 1
1 978 . 4 1 1 A 98 98 ARG CB C 96 26.854 29.579 -2.725 1
1 979 . 4 1 1 A 98 98 ARG N N 96 118.156 121.824 -3.668 1
1 980 . 4 1 1 A 99 99 ALA H H 97 8.498 7.599 0.899 1
1 981 . 4 1 1 A 99 99 ALA HA H 97 3.640 4.020 -0.380 1
1 985 . 4 1 1 A 99 99 ALA C C 97 179.650 180.054 -0.404 1
1 986 . 4 1 1 A 99 99 ALA CA C 97 55.166 55.015 0.151 1
1 987 . 4 1 1 A 99 99 ALA CB C 97 18.604 18.532 0.072 1
1 988 . 4 1 1 A 99 99 ALA N N 97 122.310 121.147 1.163 1
1 989 . 4 1 1 A 100 100 VAL H H 98 8.597 8.046 0.551 1
1 990 . 4 1 1 A 100 100 VAL HA H 98 3.798 3.494 0.304 1
1 998 . 4 1 1 A 100 100 VAL C C 98 180.464 178.134 2.330 1
1 999 . 4 1 1 A 100 100 VAL CA C 98 65.664 66.577 -0.913 1
1 1000 . 4 1 1 A 100 100 VAL CB C 98 31.065 31.536 -0.471 1
1 1003 . 4 1 1 A 100 100 VAL N N 98 120.603 119.025 1.578 1
1 1004 . 4 1 1 A 101 101 ALA H H 99 7.280 7.925 -0.645 1
1 1005 . 4 1 1 A 101 101 ALA HA H 99 3.963 4.021 -0.058 1
1 1009 . 4 1 1 A 101 101 ALA C C 99 179.314 178.558 0.756 1
1 1010 . 4 1 1 A 101 101 ALA CA C 99 54.367 54.923 -0.556 1
1 1011 . 4 1 1 A 101 101 ALA CB C 99 18.139 18.994 -0.855 1
1 1012 . 4 1 1 A 101 101 ALA N N 99 124.450 121.930 2.520 1
1 1013 . 4 1 1 A 102 102 LEU H H 100 7.200 7.365 -0.165 1
1 1014 . 4 1 1 A 102 102 LEU HA H 100 4.192 4.535 -0.343 1
1 1024 . 4 1 1 A 102 102 LEU C C 100 177.306 177.107 0.199 1
1 1025 . 4 1 1 A 102 102 LEU CA C 100 54.808 55.125 -0.317 1
1 1026 . 4 1 1 A 102 102 LEU CB C 100 42.880 44.025 -1.145 1
1 1030 . 4 1 1 A 102 102 LEU N N 100 116.834 111.367 5.467 1
1 1031 . 4 1 1 A 103 103 GLY H H 101 7.891 8.076 -0.185 1
1 1032 . 4 1 1 A 103 103 GLY HA2 H 101 3.941 3.870 0.071 1
1 1033 . 4 1 1 A 103 103 GLY HA3 H 101 3.831 3.887 -0.056 1
1 1034 . 4 1 1 A 103 103 GLY C C 101 175.137 174.673 0.464 1
1 1035 . 4 1 1 A 103 103 GLY CA C 101 45.673 46.404 -0.731 1
1 1036 . 4 1 1 A 103 103 GLY N N 101 109.395 108.239 1.156 1
1 1037 . 4 1 1 A 104 104 LYS H H 102 7.337 8.003 -0.666 1
1 1038 . 4 1 1 A 104 104 LYS HA H 102 4.402 4.126 0.276 1
1 1043 . 4 1 1 A 104 104 LYS CA C 102 52.136 60.973 -8.837 1
1 1044 . 4 1 1 A 104 104 LYS CB C 102 31.045 31.165 -0.120 1
1 1047 . 4 1 1 A 104 104 LYS N N 102 118.954 126.251 -7.297 1
1 1048 . 4 1 1 A 105 105 PRO HA H 103 4.781 4.575 0.206 1
1 1054 . 4 1 1 A 105 105 PRO CA C 103 62.791 63.020 -0.229 1
1 1055 . 4 1 1 A 105 105 PRO CB C 103 30.405 31.806 -1.401 1
1 1058 . 4 1 1 A 106 106 ILE H H 104 8.261 8.699 -0.438 1
1 1059 . 4 1 1 A 106 106 ILE HA H 104 4.680 4.442 0.238 1
1 1069 . 4 1 1 A 106 106 ILE C C 104 175.543 174.220 1.323 1
1 1070 . 4 1 1 A 106 106 ILE CA C 104 59.362 60.218 -0.856 1
1 1071 . 4 1 1 A 106 106 ILE CB C 104 43.738 39.761 3.977 1
1 1075 . 4 1 1 A 106 106 ILE N N 104 123.509 124.809 -1.300 1
1 1076 . 4 1 1 A 107 107 LEU H H 105 8.584 8.360 0.224 1
1 1077 . 4 1 1 A 107 107 LEU HA H 105 4.243 4.377 -0.134 1
1 1087 . 4 1 1 A 107 107 LEU C C 105 174.204 174.265 -0.061 1
1 1088 . 4 1 1 A 107 107 LEU CA C 105 52.863 53.395 -0.532 1
1 1089 . 4 1 1 A 107 107 LEU CB C 105 42.408 42.690 -0.282 1
1 1093 . 4 1 1 A 107 107 LEU N N 105 131.882 129.865 2.017 1
1 1094 . 4 1 1 A 108 108 CYS H H 106 8.679 8.698 -0.019 1
1 1095 . 4 1 1 A 108 108 CYS HA H 106 5.280 5.271 0.009 1
1 1099 . 4 1 1 A 108 108 CYS C C 106 173.134 173.215 -0.081 1
1 1100 . 4 1 1 A 108 108 CYS CA C 106 57.290 56.825 0.465 1
1 1101 . 4 1 1 A 108 108 CYS CB C 106 29.559 29.548 0.011 1
1 1102 . 4 1 1 A 108 108 CYS N N 106 122.904 125.546 -2.642 1
1 1103 . 4 1 1 A 109 109 LEU H H 107 8.987 9.175 -0.188 1
1 1104 . 4 1 1 A 109 109 LEU HA H 107 5.120 5.719 -0.599 1
1 1112 . 4 1 1 A 109 109 LEU C C 107 174.500 176.172 -1.672 1
1 1113 . 4 1 1 A 109 109 LEU CA C 107 53.274 53.614 -0.340 1
1 1114 . 4 1 1 A 109 109 LEU CB C 107 43.450 44.977 -1.527 1
1 1118 . 4 1 1 A 109 109 LEU N N 107 124.653 125.020 -0.367 1
1 1119 . 4 1 1 A 110 110 PHE H H 108 8.981 9.244 -0.263 1
1 1120 . 4 1 1 A 110 110 PHE HA H 108 4.846 5.905 -1.059 1
1 1125 . 4 1 1 A 110 110 PHE C C 108 172.231 172.395 -0.164 1
1 1126 . 4 1 1 A 110 110 PHE CA C 108 55.963 56.227 -0.264 1
1 1127 . 4 1 1 A 110 110 PHE CB C 108 43.270 42.612 0.658 1
1 1130 . 4 1 1 A 110 110 PHE N N 108 125.052 120.288 4.764 1
1 1131 . 4 1 1 A 111 111 ARG H H 109 7.461 8.244 -0.783 1
1 1132 . 4 1 1 A 111 111 ARG HA H 109 4.804 4.558 0.246 1
1 1136 . 4 1 1 A 111 111 ARG CA C 109 51.953 52.421 -0.468 1
1 1137 . 4 1 1 A 111 111 ARG CB C 109 30.008 31.104 -1.096 1
1 1140 . 4 1 1 A 111 111 ARG N N 109 128.034 121.001 7.033 1
1 1141 . 4 1 1 A 112 112 PRO C C 110 178.675 177.518 1.157 1
1 1142 . 4 1 1 A 112 112 PRO CA C 110 64.024 64.379 -0.355 1
1 1143 . 4 1 1 A 112 112 PRO CB C 110 31.416 31.696 -0.280 1
1 1144 . 4 1 1 A 113 113 GLN H H 111 8.188 8.551 -0.363 1
1 1145 . 4 1 1 A 113 113 GLN HA H 111 4.056 4.031 0.025 1
1 1149 . 4 1 1 A 113 113 GLN C C 111 175.936 176.417 -0.481 1
1 1150 . 4 1 1 A 113 113 GLN CA C 111 57.144 58.116 -0.972 1
1 1151 . 4 1 1 A 113 113 GLN CB C 111 28.033 27.600 0.433 1
1 1153 . 4 1 1 A 113 113 GLN N N 111 118.835 115.492 3.343 1
1 1154 . 4 1 1 A 114 114 SER H H 112 7.730 7.982 -0.252 1
1 1155 . 4 1 1 A 114 114 SER HA H 112 4.037 4.733 -0.696 1
1 1158 . 4 1 1 A 114 114 SER C C 112 175.750 173.274 2.476 1
1 1159 . 4 1 1 A 114 114 SER CA C 112 60.154 58.075 2.079 1
1 1160 . 4 1 1 A 114 114 SER CB C 112 64.282 65.635 -1.353 1
1 1161 . 4 1 1 A 114 114 SER N N 112 114.887 114.033 0.854 1
1 1162 . 4 1 1 A 115 115 GLY H H 113 8.005 8.552 -0.547 1
1 1163 . 4 1 1 A 115 115 GLY HA2 H 113 3.712 4.060 -0.348 1
1 1164 . 4 1 1 A 115 115 GLY HA3 H 113 4.130 4.269 -0.139 1
1 1165 . 4 1 1 A 115 115 GLY C C 113 173.945 174.673 -0.728 1
1 1166 . 4 1 1 A 115 115 GLY CA C 113 45.233 45.394 -0.161 1
1 1167 . 4 1 1 A 115 115 GLY N N 113 110.740 108.733 2.007 1
1 1168 . 4 1 1 A 116 116 ARG H H 114 7.665 8.777 -1.112 1
1 1169 . 4 1 1 A 116 116 ARG HA H 114 4.449 4.513 -0.064 1
1 1173 . 4 1 1 A 116 116 ARG C C 114 175.370 176.070 -0.700 1
1 1174 . 4 1 1 A 116 116 ARG CA C 114 55.080 58.051 -2.971 1
1 1175 . 4 1 1 A 116 116 ARG CB C 114 31.215 31.044 0.171 1
1 1178 . 4 1 1 A 116 116 ARG N N 114 119.983 123.539 -3.556 1
1 1179 . 4 1 1 A 117 117 VAL H H 115 8.409 8.230 0.179 1
1 1180 . 4 1 1 A 117 117 VAL HA H 115 4.184 4.475 -0.291 1
1 1188 . 4 1 1 A 117 117 VAL C C 115 175.980 175.467 0.513 1
1 1189 . 4 1 1 A 117 117 VAL CA C 115 61.167 61.441 -0.274 1
1 1190 . 4 1 1 A 117 117 VAL CB C 115 32.931 34.024 -1.093 1
1 1193 . 4 1 1 A 117 117 VAL N N 115 122.240 116.322 5.918 1
1 1194 . 4 1 1 A 118 118 LEU H H 116 8.227 8.312 -0.085 1
1 1195 . 4 1 1 A 118 118 LEU HA H 116 3.720 4.424 -0.704 1
1 1204 . 4 1 1 A 118 118 LEU C C 116 175.623 177.770 -2.147 1
1 1205 . 4 1 1 A 118 118 LEU CA C 116 54.555 55.732 -1.177 1
1 1206 . 4 1 1 A 118 118 LEU CB C 116 39.292 42.813 -3.521 1
1 1210 . 4 1 1 A 118 118 LEU N N 116 131.481 131.492 -0.011 1
1 1211 . 4 1 1 A 119 119 SER H H 117 7.780 8.431 -0.651 1
1 1212 . 4 1 1 A 119 119 SER HA H 117 4.060 4.307 -0.247 1
1 1214 . 4 1 1 A 119 119 SER C C 117 175.782 175.606 0.176 1
1 1215 . 4 1 1 A 119 119 SER CA C 117 58.530 60.000 -1.470 1
1 1216 . 4 1 1 A 119 119 SER CB C 117 64.785 64.241 0.544 1
1 1217 . 4 1 1 A 119 119 SER N N 117 118.658 120.231 -1.573 1
1 1218 . 4 1 1 A 120 120 ALA H H 118 8.955 8.994 -0.039 1
1 1219 . 4 1 1 A 120 120 ALA HA H 118 3.846 3.989 -0.143 1
1 1223 . 4 1 1 A 120 120 ALA C C 118 179.731 179.862 -0.131 1
1 1224 . 4 1 1 A 120 120 ALA CA C 118 54.927 55.542 -0.615 1
1 1225 . 4 1 1 A 120 120 ALA CB C 118 18.627 18.251 0.376 1
1 1226 . 4 1 1 A 120 120 ALA N N 118 134.119 128.398 5.721 1
1 1227 . 4 1 1 A 121 121 MET H H 119 7.718 8.130 -0.412 1
1 1228 . 4 1 1 A 121 121 MET HA H 119 4.130 4.157 -0.027 1
1 1235 . 4 1 1 A 121 121 MET C C 119 175.610 178.951 -3.341 1
1 1236 . 4 1 1 A 121 121 MET CA C 119 55.968 58.296 -2.328 1
1 1237 . 4 1 1 A 121 121 MET CB C 119 30.814 32.842 -2.028 1
1 1240 . 4 1 1 A 121 121 MET N N 119 115.424 116.558 -1.134 1
1 1241 . 4 1 1 A 122 122 ILE H H 120 6.451 8.082 -1.631 1
1 1242 . 4 1 1 A 122 122 ILE HA H 120 3.392 3.630 -0.238 1
1 1252 . 4 1 1 A 122 122 ILE C C 120 177.108 177.687 -0.579 1
1 1253 . 4 1 1 A 122 122 ILE CA C 120 59.650 64.270 -4.620 1
1 1254 . 4 1 1 A 122 122 ILE CB C 120 34.640 37.297 -2.657 1
1 1258 . 4 1 1 A 122 122 ILE N N 120 113.418 119.529 -6.111 1
1 1259 . 4 1 1 A 123 123 ARG H H 121 7.540 8.322 -0.782 1
1 1260 . 4 1 1 A 123 123 ARG HA H 121 3.551 3.938 -0.387 1
1 1264 . 4 1 1 A 123 123 ARG C C 121 179.642 178.722 0.920 1
1 1265 . 4 1 1 A 123 123 ARG CA C 121 59.242 59.950 -0.708 1
1 1266 . 4 1 1 A 123 123 ARG CB C 121 29.087 29.668 -0.581 1
1 1269 . 4 1 1 A 123 123 ARG N N 121 116.248 119.771 -3.523 1
1 1270 . 4 1 1 A 124 124 GLY H H 122 8.086 8.522 -0.436 1
1 1271 . 4 1 1 A 124 124 GLY C C 122 172.357 176.231 -3.874 1
1 1272 . 4 1 1 A 124 124 GLY CA C 122 44.836 47.085 -2.249 1
1 1273 . 4 1 1 A 124 124 GLY N N 122 104.381 107.412 -3.031 1
1 1274 . 4 1 1 A 125 125 ALA H H 123 6.411 7.886 -1.475 1
1 1275 . 4 1 1 A 125 125 ALA HA H 123 2.441 3.788 -1.347 1
1 1279 . 4 1 1 A 125 125 ALA C C 123 176.908 178.264 -1.356 1
1 1280 . 4 1 1 A 125 125 ALA CA C 123 51.593 54.517 -2.924 1
1 1281 . 4 1 1 A 125 125 ALA CB C 123 16.997 17.721 -0.724 1
1 1282 . 4 1 1 A 125 125 ALA N N 123 123.136 124.502 -1.366 1
1 1283 . 4 1 1 A 126 126 ALA H H 124 6.190 7.583 -1.393 1
1 1284 . 4 1 1 A 126 126 ALA HA H 124 3.829 4.409 -0.580 1
1 1288 . 4 1 1 A 126 126 ALA C C 124 177.535 177.751 -0.216 1
1 1289 . 4 1 1 A 126 126 ALA CA C 124 52.403 53.002 -0.599 1
1 1290 . 4 1 1 A 126 126 ALA CB C 124 18.375 17.894 0.481 1
1 1291 . 4 1 1 A 126 126 ALA N N 124 117.999 118.764 -0.765 1
1 1292 . 4 1 1 A 127 127 ASP H H 125 8.877 8.651 0.226 1
1 1293 . 4 1 1 A 127 127 ASP HA H 125 4.665 4.568 0.097 1
1 1296 . 4 1 1 A 127 127 ASP C C 125 177.795 176.544 1.251 1
1 1297 . 4 1 1 A 127 127 ASP CA C 125 52.855 54.752 -1.897 1
1 1298 . 4 1 1 A 127 127 ASP CB C 125 41.814 41.769 0.045 1
1 1299 . 4 1 1 A 127 127 ASP N N 125 121.828 125.315 -3.487 1
1 1300 . 4 1 1 A 128 128 GLY H H 126 7.954 8.162 -0.208 1
1 1301 . 4 1 1 A 128 128 GLY HA2 H 126 3.830 4.033 -0.203 1
1 1302 . 4 1 1 A 128 128 GLY HA3 H 126 4.249 4.074 0.175 1
1 1303 . 4 1 1 A 128 128 GLY C C 126 173.822 174.306 -0.484 1
1 1304 . 4 1 1 A 128 128 GLY CA C 126 45.549 45.648 -0.099 1
1 1305 . 4 1 1 A 128 128 GLY N N 126 108.814 107.469 1.345 1
1 1306 . 4 1 1 A 129 129 SER H H 127 8.547 8.094 0.453 1
1 1307 . 4 1 1 A 129 129 SER HA H 127 4.486 4.653 -0.167 1
1 1309 . 4 1 1 A 129 129 SER C C 127 174.178 175.695 -1.517 1
1 1310 . 4 1 1 A 129 129 SER CA C 127 58.653 60.279 -1.626 1
1 1311 . 4 1 1 A 129 129 SER CB C 127 63.316 64.346 -1.030 1
1 1312 . 4 1 1 A 129 129 SER N N 127 115.599 116.826 -1.227 1
1 1313 . 4 1 1 A 130 130 ARG H H 128 8.795 7.857 0.938 1
1 1314 . 4 1 1 A 130 130 ARG HA H 128 4.160 4.636 -0.476 1
1 1318 . 4 1 1 A 130 130 ARG C C 128 175.518 175.744 -0.226 1
1 1319 . 4 1 1 A 130 130 ARG CA C 128 58.479 56.762 1.717 1
1 1320 . 4 1 1 A 130 130 ARG CB C 128 29.952 32.066 -2.114 1
1 1323 . 4 1 1 A 130 130 ARG N N 128 127.611 116.584 11.027 1
1 1324 . 4 1 1 A 131 131 PHE H H 129 9.315 7.988 1.327 1
1 1325 . 4 1 1 A 131 131 PHE HA H 129 4.878 5.201 -0.323 1
1 1331 . 4 1 1 A 131 131 PHE C C 129 175.058 174.700 0.358 1
1 1332 . 4 1 1 A 131 131 PHE CA C 129 55.953 57.290 -1.337 1
1 1333 . 4 1 1 A 131 131 PHE CB C 129 40.189 41.297 -1.108 1
1 1337 . 4 1 1 A 131 131 PHE N N 129 126.219 121.554 4.665 1
1 1338 . 4 1 1 A 132 132 GLN H H 130 8.160 7.915 0.245 1
1 1339 . 4 1 1 A 132 132 GLN HA H 130 5.013 4.775 0.238 1
1 1343 . 4 1 1 A 132 132 GLN CA C 130 54.498 55.033 -0.535 1
1 1344 . 4 1 1 A 132 132 GLN CB C 130 32.106 33.161 -1.055 1
1 1346 . 4 1 1 A 132 132 GLN N N 130 125.589 126.414 -0.825 1
1 1347 . 4 1 1 A 133 133 VAL H H 131 8.689 8.521 0.168 1
1 1348 . 4 1 1 A 133 133 VAL HA H 131 4.529 4.855 -0.326 1
1 1356 . 4 1 1 A 133 133 VAL C C 131 174.441 175.456 -1.015 1
1 1357 . 4 1 1 A 133 133 VAL CA C 131 60.758 61.502 -0.744 1
1 1358 . 4 1 1 A 133 133 VAL CB C 131 32.417 33.100 -0.683 1
1 1361 . 4 1 1 A 133 133 VAL N N 131 122.441 122.651 -0.210 1
1 1362 . 4 1 1 A 134 134 TRP H H 132 9.256 9.365 -0.109 1
1 1363 . 4 1 1 A 134 134 TRP HA H 132 5.213 5.225 -0.012 1
1 1371 . 4 1 1 A 134 134 TRP C C 132 174.575 176.026 -1.451 1
1 1372 . 4 1 1 A 134 134 TRP CA C 132 53.859 56.061 -2.202 1
1 1373 . 4 1 1 A 134 134 TRP CB C 132 31.311 31.465 -0.154 1
1 1379 . 4 1 1 A 134 134 TRP N N 132 130.303 127.694 2.609 1
1 1381 . 4 1 1 A 135 135 ASP H H 133 8.237 9.068 -0.831 1
1 1382 . 4 1 1 A 135 135 ASP HA H 133 6.018 5.875 0.143 1
1 1385 . 4 1 1 A 135 135 ASP C C 133 177.020 174.987 2.033 1
1 1386 . 4 1 1 A 135 135 ASP CA C 133 53.321 53.649 -0.328 1
1 1387 . 4 1 1 A 135 135 ASP CB C 133 41.514 42.691 -1.177 1
1 1388 . 4 1 1 A 135 135 ASP N N 133 125.516 124.030 1.486 1
1 1389 . 4 1 1 A 136 136 TYR H H 134 9.058 8.110 0.948 1
1 1390 . 4 1 1 A 136 136 TYR HA H 134 4.970 5.344 -0.374 1
1 1394 . 4 1 1 A 136 136 TYR C C 134 172.324 173.279 -0.955 1
1 1395 . 4 1 1 A 136 136 TYR CA C 134 55.982 56.384 -0.402 1
1 1396 . 4 1 1 A 136 136 TYR CB C 134 42.265 40.644 1.621 1
1 1399 . 4 1 1 A 136 136 TYR N N 134 120.315 119.593 0.722 1
1 1400 . 4 1 1 A 137 137 ALA H H 135 8.521 8.810 -0.289 1
1 1401 . 4 1 1 A 137 137 ALA HA H 135 4.280 4.155 0.125 1
1 1405 . 4 1 1 A 137 137 ALA C C 135 178.561 177.005 1.556 1
1 1406 . 4 1 1 A 137 137 ALA CA C 135 49.550 50.861 -1.311 1
1 1407 . 4 1 1 A 137 137 ALA CB C 135 19.998 22.545 -2.547 1
1 1408 . 4 1 1 A 137 137 ALA N N 135 123.386 121.524 1.862 1
1 1409 . 4 1 1 A 138 138 GLU H H 136 8.678 8.485 0.193 1
1 1410 . 4 1 1 A 138 138 GLU HA H 136 3.777 4.388 -0.611 1
1 1414 . 4 1 1 A 138 138 GLU C C 136 177.624 177.455 0.169 1
1 1415 . 4 1 1 A 138 138 GLU CA C 136 60.527 57.670 2.857 1
1 1416 . 4 1 1 A 138 138 GLU CB C 136 29.020 29.432 -0.412 1
1 1418 . 4 1 1 A 138 138 GLU N N 136 121.774 117.606 4.168 1
1 1419 . 4 1 1 A 139 139 GLY H H 137 8.666 9.444 -0.778 1
1 1420 . 4 1 1 A 139 139 GLY HA2 H 137 3.872 4.079 -0.207 1
1 1421 . 4 1 1 A 139 139 GLY HA3 H 137 3.872 4.091 -0.219 1
1 1422 . 4 1 1 A 139 139 GLY C C 137 175.122 174.987 0.135 1
1 1423 . 4 1 1 A 139 139 GLY CA C 137 46.093 45.308 0.785 1
1 1424 . 4 1 1 A 139 139 GLY N N 137 106.053 107.901 -1.848 1
1 1425 . 4 1 1 A 140 140 GLU H H 138 8.305 8.437 -0.132 1
1 1426 . 4 1 1 A 140 140 GLU HA H 138 4.754 4.696 0.058 1
1 1430 . 4 1 1 A 140 140 GLU C C 138 177.819 177.686 0.133 1
1 1431 . 4 1 1 A 140 140 GLU CA C 138 55.049 55.812 -0.763 1
1 1432 . 4 1 1 A 140 140 GLU CB C 138 30.504 30.752 -0.248 1
1 1434 . 4 1 1 A 140 140 GLU N N 138 117.485 117.592 -0.107 1
1 1435 . 4 1 1 A 141 141 VAL H H 139 7.267 7.312 -0.045 1
1 1436 . 4 1 1 A 141 141 VAL HA H 139 3.422 3.885 -0.463 1
1 1444 . 4 1 1 A 141 141 VAL C C 139 175.454 177.141 -1.687 1
1 1445 . 4 1 1 A 141 141 VAL CA C 139 66.769 65.068 1.701 1
1 1446 . 4 1 1 A 141 141 VAL CB C 139 31.377 31.483 -0.106 1
1 1449 . 4 1 1 A 141 141 VAL N N 139 120.764 121.181 -0.417 1
1 1450 . 4 1 1 A 142 142 GLU H H 140 8.620 8.324 0.296 1
1 1451 . 4 1 1 A 142 142 GLU HA H 140 3.592 3.976 -0.384 1
1 1452 . 4 1 1 A 142 142 GLU C C 140 177.320 179.637 -2.317 1
1 1453 . 4 1 1 A 142 142 GLU CA C 140 62.607 59.495 3.112 1
1 1454 . 4 1 1 A 142 142 GLU CB C 140 26.759 29.191 -2.432 1
1 1455 . 4 1 1 A 142 142 GLU N N 140 120.048 122.182 -2.134 1
1 1456 . 4 1 1 A 143 143 THR H H 141 7.449 8.175 -0.726 1
1 1457 . 4 1 1 A 143 143 THR HA H 141 4.003 4.000 0.003 1
1 1462 . 4 1 1 A 143 143 THR C C 141 177.258 175.575 1.683 1
1 1463 . 4 1 1 A 143 143 THR CA C 141 65.490 67.208 -1.718 1
1 1464 . 4 1 1 A 143 143 THR CB C 141 68.641 68.019 0.622 1
1 1466 . 4 1 1 A 143 143 THR N N 141 114.073 118.358 -4.285 1
1 1467 . 4 1 1 A 144 144 MET H H 142 7.992 8.283 -0.291 1
1 1468 . 4 1 1 A 144 144 MET HA H 142 4.316 4.325 -0.009 1
1 1476 . 4 1 1 A 144 144 MET C C 142 178.233 178.879 -0.646 1
1 1477 . 4 1 1 A 144 144 MET CA C 142 57.743 59.110 -1.367 1
1 1478 . 4 1 1 A 144 144 MET CB C 142 31.326 32.265 -0.939 1
1 1481 . 4 1 1 A 144 144 MET N N 142 120.595 119.147 1.448 1
1 1482 . 4 1 1 A 145 145 LEU H H 143 7.847 8.162 -0.315 1
1 1483 . 4 1 1 A 145 145 LEU HA H 143 3.919 3.873 0.046 1
1 1491 . 4 1 1 A 145 145 LEU C C 143 178.774 179.170 -0.396 1
1 1492 . 4 1 1 A 145 145 LEU CA C 143 57.877 57.995 -0.118 1
1 1493 . 4 1 1 A 145 145 LEU CB C 143 40.951 41.127 -0.176 1
1 1497 . 4 1 1 A 145 145 LEU N N 143 119.410 119.892 -0.482 1
1 1498 . 4 1 1 A 146 146 ASP H H 144 8.431 8.770 -0.339 1
1 1499 . 4 1 1 A 146 146 ASP HA H 144 4.312 4.513 -0.201 1
1 1502 . 4 1 1 A 146 146 ASP C C 144 178.129 178.871 -0.742 1
1 1503 . 4 1 1 A 146 146 ASP CA C 144 57.464 58.055 -0.591 1
1 1504 . 4 1 1 A 146 146 ASP CB C 144 39.548 41.039 -1.491 1
1 1505 . 4 1 1 A 146 146 ASP N N 144 119.837 119.867 -0.030 1
1 1506 . 4 1 1 A 147 147 ARG H H 145 7.949 8.473 -0.524 1
1 1507 . 4 1 1 A 147 147 ARG HA H 145 4.050 4.245 -0.195 1
1 1512 . 4 1 1 A 147 147 ARG C C 145 179.547 178.904 0.643 1
1 1513 . 4 1 1 A 147 147 ARG CA C 145 58.972 59.483 -0.511 1
1 1514 . 4 1 1 A 147 147 ARG CB C 145 29.798 30.654 -0.856 1
1 1517 . 4 1 1 A 147 147 ARG N N 145 119.173 119.484 -0.311 1
1 1518 . 4 1 1 A 148 148 TYR H H 146 8.128 8.086 0.042 1
1 1519 . 4 1 1 A 148 148 TYR HA H 146 3.995 4.389 -0.394 1
1 1524 . 4 1 1 A 148 148 TYR C C 146 178.199 177.480 0.719 1
1 1525 . 4 1 1 A 148 148 TYR CA C 146 62.347 61.425 0.922 1
1 1526 . 4 1 1 A 148 148 TYR CB C 146 37.418 37.628 -0.210 1
1 1529 . 4 1 1 A 148 148 TYR N N 146 120.102 121.412 -1.310 1
1 1530 . 4 1 1 A 149 149 PHE H H 147 8.308 8.452 -0.144 1
1 1531 . 4 1 1 A 149 149 PHE HA H 147 4.013 4.283 -0.270 1
1 1535 . 4 1 1 A 149 149 PHE C C 147 177.574 178.181 -0.607 1
1 1536 . 4 1 1 A 149 149 PHE CA C 147 63.044 61.389 1.655 1
1 1537 . 4 1 1 A 149 149 PHE CB C 147 37.153 38.310 -1.157 1
1 1541 . 4 1 1 A 149 149 PHE N N 147 116.680 117.208 -0.528 1
1 1542 . 4 1 1 A 150 150 GLU H H 148 8.271 8.968 -0.697 1
1 1543 . 4 1 1 A 150 150 GLU HA H 148 4.030 3.975 0.055 1
1 1547 . 4 1 1 A 150 150 GLU C C 148 177.687 178.714 -1.027 1
1 1548 . 4 1 1 A 150 150 GLU CA C 148 58.746 59.943 -1.197 1
1 1549 . 4 1 1 A 150 150 GLU CB C 148 28.847 29.063 -0.216 1
1 1551 . 4 1 1 A 150 150 GLU N N 148 119.973 119.584 0.389 1
1 1552 . 4 1 1 A 151 151 ALA H H 149 6.992 7.516 -0.524 1
1 1553 . 4 1 1 A 151 151 ALA HA H 149 4.217 4.183 0.034 1
1 1557 . 4 1 1 A 151 151 ALA C C 149 178.190 177.447 0.743 1
1 1558 . 4 1 1 A 151 151 ALA CA C 149 52.779 54.003 -1.224 1
1 1559 . 4 1 1 A 151 151 ALA CB C 149 19.087 18.983 0.104 1
1 1560 . 4 1 1 A 151 151 ALA N N 149 118.629 121.363 -2.734 1
1 1561 . 4 1 1 A 152 152 TYR H H 150 7.722 8.638 -0.916 1
1 1562 . 4 1 1 A 152 152 TYR HA H 150 4.137 4.832 -0.695 1
1 1567 . 4 1 1 A 152 152 TYR C C 150 175.703 173.697 2.006 1
1 1568 . 4 1 1 A 152 152 TYR CA C 150 59.260 57.219 2.041 1
1 1569 . 4 1 1 A 152 152 TYR CB C 150 39.165 40.443 -1.278 1
1 1572 . 4 1 1 A 152 152 TYR N N 150 118.767 115.056 3.711 1
1 1573 . 4 1 1 A 153 153 LEU H H 151 7.670 8.731 -1.061 1
1 1574 . 4 1 1 A 153 153 LEU HA H 151 4.145 4.202 -0.057 1
1 1584 . 4 1 1 A 153 153 LEU CA C 151 54.704 55.945 -1.241 1
1 1585 . 4 1 1 A 153 153 LEU CB C 151 40.520 44.100 -3.580 1
1 1589 . 4 1 1 A 153 153 LEU N N 151 122.313 125.516 -3.203 1
1 1590 . 4 1 1 A 154 154 PRO HA H 152 4.258 4.310 -0.052 1
1 1597 . 4 1 1 A 154 154 PRO C C 152 177.496 178.685 -1.189 1
1 1598 . 4 1 1 A 154 154 PRO CA C 152 63.899 64.742 -0.843 1
1 1599 . 4 1 1 A 154 154 PRO CB C 152 31.080 31.462 -0.382 1
1 1602 . 4 1 1 A 155 155 GLN H H 153 8.023 8.201 -0.178 1
1 1603 . 4 1 1 A 155 155 GLN HA H 153 4.176 4.109 0.067 1
1 1607 . 4 1 1 A 155 155 GLN C C 153 176.636 178.381 -1.745 1
1 1608 . 4 1 1 A 155 155 GLN CA C 153 55.968 59.028 -3.060 1
1 1609 . 4 1 1 A 155 155 GLN CB C 153 28.723 28.553 0.170 1
1 1610 . 4 1 1 A 155 155 GLN N N 153 119.173 118.188 0.985 1
1 1611 . 4 1 1 A 156 156 LYS H H 154 8.113 7.361 0.752 1
1 1612 . 4 1 1 A 156 156 LYS HA H 154 4.196 4.091 0.105 1
1 1619 . 4 1 1 A 156 156 LYS C C 154 56.493 179.303 -122.810 1
1 1620 . 4 1 1 A 156 156 LYS CA C 154 56.493 59.457 -2.964 1
1 1621 . 4 1 1 A 156 156 LYS CB C 154 32.037 32.391 -0.354 1
1 1625 . 4 1 1 A 156 156 LYS N N 154 122.788 118.243 4.545 1
1 1626 . 4 1 1 A 157 157 THR H H 155 8.013 8.219 -0.206 1
1 1627 . 4 1 1 A 157 157 THR HA H 155 4.183 4.075 0.108 1
1 1632 . 4 1 1 A 157 157 THR C C 155 174.580 177.017 -2.437 1
1 1633 . 4 1 1 A 157 157 THR CA C 155 61.958 65.198 -3.240 1
1 1634 . 4 1 1 A 157 157 THR CB C 155 69.665 68.055 1.610 1
1 1636 . 4 1 1 A 157 157 THR N N 155 115.504 112.797 2.707 1
1 1637 . 4 1 1 A 158 158 ALA H H 156 8.170 7.135 1.035 1
1 1638 . 4 1 1 A 158 158 ALA HA H 156 4.220 4.221 -0.001 1
1 1642 . 4 1 1 A 158 158 ALA CA C 156 52.492 53.176 -0.684 1
1 1643 . 4 1 1 A 158 158 ALA CB C 156 18.810 18.972 -0.162 1
1 1644 . 4 1 1 A 158 158 ALA N N 156 126.825 123.674 3.151 1
1 1645 . 4 1 1 A 159 159 SER H H 157 7.762 7.292 0.470 1
1 1646 . 4 1 1 A 159 159 SER CA C 157 58.230 58.227 0.003 1
1 1647 . 4 1 1 A 159 159 SER CB C 157 63.440 64.817 -1.377 1
1 1648 . 4 1 1 A 159 159 SER N N 157 123.078 113.227 9.851 1
1 1649 . 4 1 1 A 162 162 HIS HA H 160 4.845 4.911 -0.066 1
1 1652 . 4 1 1 A 162 162 HIS CA C 160 53.590 53.373 0.217 1
1 1653 . 4 1 1 A 162 162 HIS CB C 160 29.398 30.609 -1.211 1
1 1654 . 4 1 1 A 163 163 PRO HA H 161 4.388 4.275 0.113 1
1 1660 . 4 1 1 A 163 163 PRO C C 161 177.018 176.947 0.071 1
1 1661 . 4 1 1 A 163 163 PRO CA C 161 63.118 63.395 -0.277 1
1 1662 . 4 1 1 A 163 163 PRO CB C 161 31.668 31.904 -0.236 1
1 1665 . 4 1 1 A 164 164 SER H H 162 8.418 7.806 0.612 1
1 1666 . 4 1 1 A 164 164 SER HA H 162 4.338 4.069 0.269 1
1 1668 . 4 1 1 A 164 164 SER C C 162 173.327 172.860 0.467 1
1 1669 . 4 1 1 A 164 164 SER CA C 162 58.202 60.312 -2.110 1
1 1670 . 4 1 1 A 164 164 SER CB C 162 64.080 61.717 2.363 1
1 1671 . 4 1 1 A 164 164 SER N N 162 117.485 114.420 3.065 1
1 6 . 5 1 1 A 4 4 ALA H H 2 8.270 8.504 -0.234 1
1 7 . 5 1 1 A 4 4 ALA HA H 2 4.212 3.883 0.329 1
1 11 . 5 1 1 A 4 4 ALA C C 2 177.441 176.254 1.187 1
1 12 . 5 1 1 A 4 4 ALA CA C 2 52.280 53.352 -1.072 1
1 13 . 5 1 1 A 4 4 ALA CB C 2 18.880 18.004 0.876 1
1 14 . 5 1 1 A 4 4 ALA N N 2 126.500 120.331 6.169 1
1 15 . 5 1 1 A 5 5 ALA H H 3 8.251 7.278 0.973 1
1 16 . 5 1 1 A 5 5 ALA HA H 3 4.261 4.994 -0.733 1
1 20 . 5 1 1 A 5 5 ALA C C 3 177.824 175.118 2.706 1
1 21 . 5 1 1 A 5 5 ALA CA C 3 52.347 51.520 0.827 1
1 22 . 5 1 1 A 5 5 ALA CB C 3 18.869 23.255 -4.386 1
1 23 . 5 1 1 A 5 5 ALA N N 3 124.322 116.978 7.344 1
1 24 . 5 1 1 A 6 6 SER H H 4 8.158 8.547 -0.389 1
1 25 . 5 1 1 A 6 6 SER HA H 4 4.358 4.985 -0.627 1
1 27 . 5 1 1 A 6 6 SER C C 4 175.222 174.619 0.603 1
1 28 . 5 1 1 A 6 6 SER CA C 4 58.438 56.749 1.689 1
1 29 . 5 1 1 A 6 6 SER CB C 4 63.859 66.051 -2.192 1
1 30 . 5 1 1 A 6 6 SER N N 4 115.338 112.283 3.055 1
1 31 . 5 1 1 A 7 7 GLY H H 5 8.265 8.377 -0.112 1
1 32 . 5 1 1 A 7 7 GLY HA2 H 5 3.900 3.841 0.059 1
1 33 . 5 1 1 A 7 7 GLY C C 5 174.083 174.343 -0.260 1
1 34 . 5 1 1 A 7 7 GLY CA C 5 45.113 46.949 -1.836 1
1 35 . 5 1 1 A 7 7 GLY N N 5 111.360 109.117 2.243 1
1 36 . 5 1 1 A 8 8 GLU H H 6 8.100 8.554 -0.454 1
1 37 . 5 1 1 A 8 8 GLU HA H 6 4.209 3.950 0.259 1
1 41 . 5 1 1 A 8 8 GLU C C 6 176.354 175.965 0.389 1
1 42 . 5 1 1 A 8 8 GLU CA C 6 56.261 57.018 -0.757 1
1 43 . 5 1 1 A 8 8 GLU CB C 6 29.830 28.602 1.228 1
1 45 . 5 1 1 A 8 8 GLU N N 6 121.056 122.772 -1.716 1
1 46 . 5 1 1 A 9 9 GLN H H 7 8.287 8.398 -0.111 1
1 47 . 5 1 1 A 9 9 GLN HA H 7 4.247 4.569 -0.322 1
1 51 . 5 1 1 A 9 9 GLN C C 7 172.457 174.980 -2.523 1
1 52 . 5 1 1 A 9 9 GLN CA C 7 55.269 55.336 -0.067 1
1 53 . 5 1 1 A 9 9 GLN CB C 7 29.236 30.728 -1.492 1
1 55 . 5 1 1 A 9 9 GLN N N 7 122.164 121.142 1.022 1
1 56 . 5 1 1 A 10 10 ALA H H 8 8.368 8.540 -0.172 1
1 57 . 5 1 1 A 10 10 ALA HA H 8 4.509 4.954 -0.445 1
1 61 . 5 1 1 A 10 10 ALA CA C 8 50.341 49.681 0.660 1
1 62 . 5 1 1 A 10 10 ALA CB C 8 18.140 22.566 -4.426 1
1 63 . 5 1 1 A 10 10 ALA N N 8 128.028 121.188 6.840 1
1 64 . 5 1 1 A 11 11 PRO HA H 9 4.437 4.606 -0.169 1
1 70 . 5 1 1 A 11 11 PRO C C 9 176.381 175.607 0.774 1
1 71 . 5 1 1 A 11 11 PRO CA C 9 63.298 62.360 0.938 1
1 72 . 5 1 1 A 11 11 PRO CB C 9 31.776 33.074 -1.298 1
1 75 . 5 1 1 A 12 12 CYS H H 10 8.056 8.355 -0.299 1
1 76 . 5 1 1 A 12 12 CYS HA H 10 4.717 5.060 -0.343 1
1 79 . 5 1 1 A 12 12 CYS C C 10 173.266 173.578 -0.312 1
1 80 . 5 1 1 A 12 12 CYS CA C 10 57.398 58.244 -0.846 1
1 81 . 5 1 1 A 12 12 CYS CB C 10 29.165 30.671 -1.506 1
1 82 . 5 1 1 A 12 12 CYS N N 10 118.295 120.085 -1.790 1
1 83 . 5 1 1 A 13 13 SER H H 11 9.815 8.714 1.101 1
1 84 . 5 1 1 A 13 13 SER HA H 11 5.227 5.449 -0.222 1
1 87 . 5 1 1 A 13 13 SER C C 11 173.648 173.540 0.108 1
1 88 . 5 1 1 A 13 13 SER CA C 11 57.630 57.733 -0.103 1
1 89 . 5 1 1 A 13 13 SER CB C 11 64.820 64.861 -0.041 1
1 90 . 5 1 1 A 13 13 SER N N 11 122.365 117.834 4.531 1
1 91 . 5 1 1 A 14 14 VAL H H 12 9.352 9.105 0.247 1
1 92 . 5 1 1 A 14 14 VAL HA H 12 4.696 5.126 -0.430 1
1 100 . 5 1 1 A 14 14 VAL C C 12 173.875 174.368 -0.493 1
1 101 . 5 1 1 A 14 14 VAL CA C 12 60.146 61.692 -1.546 1
1 102 . 5 1 1 A 14 14 VAL CB C 12 34.499 32.768 1.731 1
1 105 . 5 1 1 A 14 14 VAL N N 12 126.378 127.892 -1.514 1
1 106 . 5 1 1 A 15 15 TYR H H 13 8.745 9.338 -0.593 1
1 111 . 5 1 1 A 15 15 TYR C C 13 173.345 174.179 -0.834 1
1 112 . 5 1 1 A 15 15 TYR CA C 13 56.186 57.126 -0.940 1
1 113 . 5 1 1 A 15 15 TYR CB C 13 40.858 41.291 -0.433 1
1 116 . 5 1 1 A 15 15 TYR N N 13 129.472 128.138 1.334 1
1 117 . 5 1 1 A 16 16 PHE H H 14 7.370 7.967 -0.597 1
1 118 . 5 1 1 A 16 16 PHE HA H 14 5.720 4.603 1.117 1
1 123 . 5 1 1 A 16 16 PHE C C 14 174.058 173.681 0.377 1
1 124 . 5 1 1 A 16 16 PHE CA C 14 54.361 57.078 -2.717 1
1 125 . 5 1 1 A 16 16 PHE CB C 14 40.461 39.416 1.045 1
1 129 . 5 1 1 A 16 16 PHE N N 14 128.263 128.533 -0.270 1
1 130 . 5 1 1 A 17 17 CYS H H 15 8.147 8.409 -0.262 1
1 131 . 5 1 1 A 17 17 CYS CA C 15 56.570 57.078 -0.508 1
1 132 . 5 1 1 A 17 17 CYS CB C 15 29.690 28.961 0.729 1
1 133 . 5 1 1 A 17 17 CYS N N 15 126.188 127.590 -1.402 1
1 134 . 5 1 1 A 18 18 GLY HA2 H 16 3.819 4.234 -0.415 1
1 135 . 5 1 1 A 18 18 GLY C C 16 173.374 172.358 1.016 1
1 136 . 5 1 1 A 18 18 GLY CA C 16 45.510 45.773 -0.263 1
1 137 . 5 1 1 A 19 19 SER H H 17 8.533 8.602 -0.069 1
1 138 . 5 1 1 A 19 19 SER HA H 17 4.505 5.237 -0.732 1
1 139 . 5 1 1 A 19 19 SER CA C 17 58.700 56.153 2.547 1
1 140 . 5 1 1 A 19 19 SER CB C 17 63.810 66.585 -2.775 1
1 141 . 5 1 1 A 19 19 SER N N 17 117.300 112.122 5.178 1
1 142 . 5 1 1 A 20 20 ILE HA H 18 4.309 4.261 0.048 1
1 152 . 5 1 1 A 20 20 ILE CA C 18 61.317 62.555 -1.238 1
1 153 . 5 1 1 A 20 20 ILE CB C 18 38.302 38.133 0.169 1
1 157 . 5 1 1 A 21 21 ARG HA H 19 4.172 3.971 0.201 1
1 160 . 5 1 1 A 21 21 ARG C C 19 177.118 177.930 -0.812 1
1 161 . 5 1 1 A 21 21 ARG CA C 19 56.960 59.103 -2.143 1
1 162 . 5 1 1 A 21 21 ARG CB C 19 29.568 30.290 -0.722 1
1 165 . 5 1 1 A 22 22 GLY H H 20 8.685 8.442 0.243 1
1 166 . 5 1 1 A 22 22 GLY HA2 H 20 3.801 3.856 -0.055 1
1 167 . 5 1 1 A 22 22 GLY HA3 H 20 3.923 3.858 0.065 1
1 168 . 5 1 1 A 22 22 GLY C C 20 174.814 174.805 0.009 1
1 169 . 5 1 1 A 22 22 GLY CA C 20 45.289 47.464 -2.175 1
1 170 . 5 1 1 A 22 22 GLY N N 20 110.145 107.196 2.949 1
1 171 . 5 1 1 A 23 23 GLY H H 21 8.058 7.966 0.092 1
1 172 . 5 1 1 A 23 23 GLY HA2 H 21 3.998 4.052 -0.054 1
1 173 . 5 1 1 A 23 23 GLY HA3 H 21 4.237 4.061 0.176 1
1 174 . 5 1 1 A 23 23 GLY C C 21 174.762 175.080 -0.318 1
1 175 . 5 1 1 A 23 23 GLY CA C 21 45.025 45.244 -0.219 1
1 176 . 5 1 1 A 23 23 GLY N N 21 109.327 106.231 3.096 1
1 177 . 5 1 1 A 24 24 ARG H H 22 8.376 7.894 0.482 1
1 178 . 5 1 1 A 24 24 ARG HA H 22 4.086 3.794 0.292 1
1 184 . 5 1 1 A 24 24 ARG C C 22 178.178 176.283 1.895 1
1 185 . 5 1 1 A 24 24 ARG CA C 22 57.471 58.624 -1.153 1
1 186 . 5 1 1 A 24 24 ARG CB C 22 29.653 27.940 1.713 1
1 189 . 5 1 1 A 24 24 ARG N N 22 120.861 114.255 6.606 1
1 190 . 5 1 1 A 25 25 GLU H H 23 8.831 11.120 -2.289 1
1 191 . 5 1 1 A 25 25 GLU HA H 23 4.015 3.941 0.074 1
1 195 . 5 1 1 A 25 25 GLU C C 23 178.005 179.125 -1.120 1
1 196 . 5 1 1 A 25 25 GLU CA C 23 58.920 59.567 -0.647 1
1 197 . 5 1 1 A 25 25 GLU CB C 23 28.592 29.128 -0.536 1
1 199 . 5 1 1 A 25 25 GLU N N 23 121.243 119.012 2.231 1
1 200 . 5 1 1 A 26 26 ASP H H 24 7.897 8.176 -0.279 1
1 201 . 5 1 1 A 26 26 ASP HA H 24 4.516 4.199 0.317 1
1 203 . 5 1 1 A 26 26 ASP C C 24 176.455 177.710 -1.255 1
1 204 . 5 1 1 A 26 26 ASP CA C 24 55.122 56.172 -1.050 1
1 205 . 5 1 1 A 26 26 ASP CB C 24 39.888 39.876 0.012 1
1 206 . 5 1 1 A 26 26 ASP N N 24 119.541 119.388 0.153 1
1 207 . 5 1 1 A 27 27 GLN H H 25 7.696 8.354 -0.658 1
1 208 . 5 1 1 A 27 27 GLN HA H 25 3.704 3.809 -0.105 1
1 212 . 5 1 1 A 27 27 GLN C C 25 177.016 177.758 -0.742 1
1 213 . 5 1 1 A 27 27 GLN CA C 25 59.501 58.577 0.924 1
1 214 . 5 1 1 A 27 27 GLN CB C 25 27.762 28.726 -0.964 1
1 216 . 5 1 1 A 27 27 GLN N N 25 119.471 119.757 -0.286 1
1 217 . 5 1 1 A 28 28 ALA H H 26 8.227 7.743 0.484 1
1 218 . 5 1 1 A 28 28 ALA HA H 26 4.072 4.277 -0.205 1
1 222 . 5 1 1 A 28 28 ALA C C 26 180.567 179.948 0.619 1
1 223 . 5 1 1 A 28 28 ALA CA C 26 54.627 55.123 -0.496 1
1 224 . 5 1 1 A 28 28 ALA CB C 26 17.355 18.035 -0.680 1
1 225 . 5 1 1 A 28 28 ALA N N 26 122.362 122.119 0.243 1
1 226 . 5 1 1 A 29 29 LEU H H 27 7.533 7.794 -0.261 1
1 227 . 5 1 1 A 29 29 LEU HA H 27 4.050 4.094 -0.044 1
1 237 . 5 1 1 A 29 29 LEU C C 27 178.752 177.994 0.758 1
1 238 . 5 1 1 A 29 29 LEU CA C 27 57.578 57.706 -0.128 1
1 239 . 5 1 1 A 29 29 LEU CB C 27 40.734 41.674 -0.940 1
1 243 . 5 1 1 A 29 29 LEU N N 27 122.255 119.790 2.465 1
1 244 . 5 1 1 A 30 30 TYR H H 28 8.473 8.294 0.179 1
1 245 . 5 1 1 A 30 30 TYR HA H 28 4.049 4.399 -0.350 1
1 250 . 5 1 1 A 30 30 TYR C C 28 177.736 178.364 -0.628 1
1 251 . 5 1 1 A 30 30 TYR CA C 28 59.817 60.213 -0.396 1
1 252 . 5 1 1 A 30 30 TYR CB C 28 36.140 37.131 -0.991 1
1 255 . 5 1 1 A 30 30 TYR N N 28 120.403 118.560 1.843 1
1 256 . 5 1 1 A 31 31 ALA H H 29 8.008 8.664 -0.656 1
1 257 . 5 1 1 A 31 31 ALA HA H 29 4.005 3.993 0.012 1
1 261 . 5 1 1 A 31 31 ALA C C 29 180.879 179.732 1.147 1
1 262 . 5 1 1 A 31 31 ALA CA C 29 54.914 55.299 -0.385 1
1 263 . 5 1 1 A 31 31 ALA CB C 29 17.375 18.110 -0.735 1
1 264 . 5 1 1 A 31 31 ALA N N 29 120.771 122.987 -2.216 1
1 265 . 5 1 1 A 32 32 ARG H H 30 7.596 7.699 -0.103 1
1 266 . 5 1 1 A 32 32 ARG HA H 30 3.916 4.231 -0.315 1
1 273 . 5 1 1 A 32 32 ARG C C 30 179.919 178.775 1.144 1
1 274 . 5 1 1 A 32 32 ARG CA C 30 59.014 59.124 -0.110 1
1 275 . 5 1 1 A 32 32 ARG CB C 30 30.531 29.864 0.667 1
1 278 . 5 1 1 A 32 32 ARG N N 30 120.365 118.533 1.832 1
1 279 . 5 1 1 A 33 33 ILE H H 31 8.066 8.631 -0.565 1
1 280 . 5 1 1 A 33 33 ILE HA H 31 3.120 3.763 -0.643 1
1 290 . 5 1 1 A 33 33 ILE C C 31 177.051 178.407 -1.356 1
1 291 . 5 1 1 A 33 33 ILE CA C 31 65.757 65.485 0.272 1
1 292 . 5 1 1 A 33 33 ILE CB C 31 36.928 38.105 -1.177 1
1 296 . 5 1 1 A 33 33 ILE N N 31 121.608 119.976 1.632 1
1 297 . 5 1 1 A 34 34 VAL H H 32 8.148 9.246 -1.098 1
1 298 . 5 1 1 A 34 34 VAL HA H 32 2.954 3.708 -0.754 1
1 306 . 5 1 1 A 34 34 VAL C C 32 177.159 178.611 -1.452 1
1 307 . 5 1 1 A 34 34 VAL CA C 32 67.220 66.463 0.757 1
1 308 . 5 1 1 A 34 34 VAL CB C 32 31.039 31.387 -0.348 1
1 311 . 5 1 1 A 34 34 VAL N N 32 119.318 120.517 -1.199 1
1 312 . 5 1 1 A 35 35 SER H H 33 7.826 8.294 -0.468 1
1 313 . 5 1 1 A 35 35 SER HA H 33 3.868 4.100 -0.232 1
1 316 . 5 1 1 A 35 35 SER C C 33 176.779 176.663 0.116 1
1 317 . 5 1 1 A 35 35 SER CA C 33 62.000 61.832 0.168 1
1 318 . 5 1 1 A 35 35 SER CB C 33 62.789 62.845 -0.056 1
1 319 . 5 1 1 A 35 35 SER N N 33 111.936 116.548 -4.612 1
1 320 . 5 1 1 A 36 36 ARG H H 34 7.405 7.610 -0.205 1
1 321 . 5 1 1 A 36 36 ARG HA H 34 4.070 4.126 -0.056 1
1 323 . 5 1 1 A 36 36 ARG C C 34 178.047 178.607 -0.560 1
1 324 . 5 1 1 A 36 36 ARG CA C 34 56.108 59.105 -2.997 1
1 325 . 5 1 1 A 36 36 ARG CB C 34 28.837 30.165 -1.328 1
1 326 . 5 1 1 A 36 36 ARG N N 34 120.909 122.288 -1.379 1
1 327 . 5 1 1 A 37 37 LEU H H 35 8.301 8.291 0.010 1
1 328 . 5 1 1 A 37 37 LEU HA H 35 3.620 3.807 -0.187 1
1 336 . 5 1 1 A 37 37 LEU C C 35 178.446 179.143 -0.697 1
1 337 . 5 1 1 A 37 37 LEU CA C 35 57.640 57.962 -0.322 1
1 338 . 5 1 1 A 37 37 LEU CB C 35 41.584 41.740 -0.156 1
1 342 . 5 1 1 A 37 37 LEU N N 35 118.567 120.224 -1.657 1
1 343 . 5 1 1 A 38 38 ARG H H 36 7.379 8.236 -0.857 1
1 344 . 5 1 1 A 38 38 ARG HA H 36 4.340 3.977 0.363 1
1 350 . 5 1 1 A 38 38 ARG C C 36 177.895 178.698 -0.803 1
1 351 . 5 1 1 A 38 38 ARG CA C 36 57.785 59.184 -1.399 1
1 352 . 5 1 1 A 38 38 ARG CB C 36 29.775 29.747 0.028 1
1 355 . 5 1 1 A 38 38 ARG N N 36 115.352 119.542 -4.190 1
1 356 . 5 1 1 A 39 39 ARG H H 37 7.240 8.019 -0.779 1
1 357 . 5 1 1 A 39 39 ARG HA H 37 3.743 4.110 -0.367 1
1 363 . 5 1 1 A 39 39 ARG C C 37 176.988 178.953 -1.965 1
1 364 . 5 1 1 A 39 39 ARG CA C 37 57.605 58.610 -1.005 1
1 365 . 5 1 1 A 39 39 ARG CB C 37 28.925 30.504 -1.579 1
1 368 . 5 1 1 A 39 39 ARG N N 37 117.410 119.160 -1.750 1
1 369 . 5 1 1 A 40 40 TYR H H 38 7.296 8.209 -0.913 1
1 370 . 5 1 1 A 40 40 TYR HA H 38 4.319 4.154 0.165 1
1 375 . 5 1 1 A 40 40 TYR C C 38 175.001 176.154 -1.153 1
1 376 . 5 1 1 A 40 40 TYR CA C 38 57.730 60.186 -2.456 1
1 377 . 5 1 1 A 40 40 TYR CB C 38 39.343 37.980 1.363 1
1 380 . 5 1 1 A 40 40 TYR N N 38 116.937 118.911 -1.974 1
1 381 . 5 1 1 A 41 41 GLY H H 39 7.325 7.700 -0.375 1
1 382 . 5 1 1 A 41 41 GLY HA2 H 39 3.953 4.066 -0.113 1
1 383 . 5 1 1 A 41 41 GLY C C 39 171.302 172.165 -0.863 1
1 384 . 5 1 1 A 41 41 GLY CA C 39 45.590 45.420 0.170 1
1 385 . 5 1 1 A 41 41 GLY N N 39 105.596 104.343 1.253 1
1 386 . 5 1 1 A 42 42 LYS H H 40 8.186 9.043 -0.857 1
1 387 . 5 1 1 A 42 42 LYS HA H 40 4.205 4.617 -0.412 1
1 393 . 5 1 1 A 42 42 LYS C C 40 175.672 175.594 0.078 1
1 394 . 5 1 1 A 42 42 LYS CA C 40 55.241 55.531 -0.290 1
1 395 . 5 1 1 A 42 42 LYS CB C 40 32.889 33.877 -0.988 1
1 399 . 5 1 1 A 42 42 LYS N N 40 120.341 121.888 -1.547 1
1 400 . 5 1 1 A 43 43 VAL H H 41 8.610 8.686 -0.076 1
1 401 . 5 1 1 A 43 43 VAL HA H 41 4.416 4.540 -0.124 1
1 409 . 5 1 1 A 43 43 VAL C C 41 175.997 175.528 0.469 1
1 410 . 5 1 1 A 43 43 VAL CA C 41 61.331 62.721 -1.390 1
1 411 . 5 1 1 A 43 43 VAL CB C 41 30.573 31.318 -0.745 1
1 414 . 5 1 1 A 43 43 VAL N N 41 127.312 124.664 2.648 1
1 415 . 5 1 1 A 44 44 LEU H H 42 8.894 8.230 0.664 1
1 416 . 5 1 1 A 44 44 LEU HA H 42 4.496 3.915 0.581 1
1 424 . 5 1 1 A 44 44 LEU CA C 42 54.522 55.186 -0.664 1
1 425 . 5 1 1 A 44 44 LEU CB C 42 40.980 41.833 -0.853 1
1 429 . 5 1 1 A 44 44 LEU N N 42 130.261 128.579 1.682 1
1 430 . 5 1 1 A 45 45 THR HA H 43 4.263 3.912 0.351 1
1 435 . 5 1 1 A 45 45 THR CA C 43 61.033 63.306 -2.273 1
1 436 . 5 1 1 A 45 45 THR CB C 43 69.768 68.941 0.827 1
1 440 . 5 1 1 A 46 46 GLU CA C 44 56.411 55.071 1.340 1
1 441 . 5 1 1 A 46 46 GLU CB C 44 29.827 33.368 -3.541 1
1 443 . 5 1 1 A 47 47 HIS HA H 45 4.549 4.524 0.025 1
1 447 . 5 1 1 A 47 47 HIS C C 45 174.812 176.370 -1.558 1
1 448 . 5 1 1 A 47 47 HIS CA C 45 56.107 56.912 -0.805 1
1 449 . 5 1 1 A 47 47 HIS CB C 45 29.080 29.445 -0.365 1
1 451 . 5 1 1 A 48 48 VAL H H 46 7.826 7.466 0.360 1
1 452 . 5 1 1 A 48 48 VAL HA H 46 4.024 3.708 0.316 1
1 460 . 5 1 1 A 48 48 VAL C C 46 175.697 176.572 -0.875 1
1 461 . 5 1 1 A 48 48 VAL CA C 46 61.841 64.815 -2.974 1
1 462 . 5 1 1 A 48 48 VAL CB C 46 32.600 31.238 1.362 1
1 465 . 5 1 1 A 48 48 VAL N N 46 121.117 118.894 2.223 1
1 466 . 5 1 1 A 49 49 ALA H H 47 8.237 7.743 0.494 1
1 467 . 5 1 1 A 49 49 ALA HA H 47 4.281 4.197 0.084 1
1 471 . 5 1 1 A 49 49 ALA C C 47 177.173 177.621 -0.448 1
1 472 . 5 1 1 A 49 49 ALA CA C 47 52.207 51.912 0.295 1
1 473 . 5 1 1 A 49 49 ALA CB C 47 19.064 19.869 -0.805 1
1 474 . 5 1 1 A 49 49 ALA N N 47 126.817 122.912 3.905 1
1 475 . 5 1 1 A 50 50 ASP H H 48 8.029 8.975 -0.946 1
1 476 . 5 1 1 A 50 50 ASP HA H 48 4.436 4.266 0.170 1
1 479 . 5 1 1 A 50 50 ASP C C 48 176.124 176.472 -0.348 1
1 480 . 5 1 1 A 50 50 ASP CA C 48 54.447 55.272 -0.825 1
1 481 . 5 1 1 A 50 50 ASP CB C 48 40.877 40.607 0.270 1
1 482 . 5 1 1 A 50 50 ASP N N 48 119.687 119.192 0.495 1
1 483 . 5 1 1 A 51 51 ALA H H 49 8.094 7.802 0.292 1
1 484 . 5 1 1 A 51 51 ALA HA H 49 4.134 4.215 -0.081 1
1 488 . 5 1 1 A 51 51 ALA C C 49 177.835 178.039 -0.204 1
1 489 . 5 1 1 A 51 51 ALA CA C 49 52.900 51.666 1.234 1
1 490 . 5 1 1 A 51 51 ALA CB C 49 18.942 20.099 -1.157 1
1 491 . 5 1 1 A 51 51 ALA N N 49 124.400 120.341 4.059 1
1 492 . 5 1 1 A 52 52 GLU H H 50 8.243 8.004 0.239 1
1 493 . 5 1 1 A 52 52 GLU HA H 50 4.152 4.164 -0.012 1
1 497 . 5 1 1 A 52 52 GLU C C 50 176.456 176.539 -0.083 1
1 498 . 5 1 1 A 52 52 GLU CA C 50 56.480 58.857 -2.377 1
1 499 . 5 1 1 A 52 52 GLU CB C 50 29.470 29.426 0.044 1
1 501 . 5 1 1 A 52 52 GLU N N 50 118.917 116.689 2.228 1
1 502 . 5 1 1 A 53 53 LEU H H 51 7.839 7.296 0.543 1
1 503 . 5 1 1 A 53 53 LEU HA H 51 4.229 4.351 -0.122 1
1 513 . 5 1 1 A 53 53 LEU C C 51 177.058 176.482 0.576 1
1 514 . 5 1 1 A 53 53 LEU CA C 51 54.625 54.877 -0.252 1
1 515 . 5 1 1 A 53 53 LEU CB C 51 42.125 42.645 -0.520 1
1 519 . 5 1 1 A 53 53 LEU N N 51 122.169 118.119 4.050 1
1 520 . 5 1 1 A 54 54 GLU H H 52 8.104 8.893 -0.789 1
1 521 . 5 1 1 A 54 54 GLU HA H 52 4.470 4.295 0.175 1
1 525 . 5 1 1 A 54 54 GLU CA C 52 54.286 58.294 -4.008 1
1 526 . 5 1 1 A 54 54 GLU CB C 52 29.268 28.711 0.557 1
1 528 . 5 1 1 A 54 54 GLU N N 52 123.040 117.686 5.354 1
1 529 . 5 1 1 A 55 55 PRO HA H 53 4.310 4.654 -0.344 1
1 536 . 5 1 1 A 55 55 PRO C C 53 177.019 176.764 0.255 1
1 537 . 5 1 1 A 55 55 PRO CA C 53 63.075 62.312 0.763 1
1 538 . 5 1 1 A 55 55 PRO CB C 53 31.329 28.951 2.378 1
1 541 . 5 1 1 A 56 56 LEU H H 54 8.263 8.321 -0.058 1
1 542 . 5 1 1 A 56 56 LEU HA H 54 4.237 4.245 -0.008 1
1 552 . 5 1 1 A 56 56 LEU C C 54 178.055 176.939 1.116 1
1 553 . 5 1 1 A 56 56 LEU CA C 54 55.018 54.348 0.670 1
1 554 . 5 1 1 A 56 56 LEU CB C 54 41.990 43.337 -1.347 1
1 558 . 5 1 1 A 56 56 LEU N N 54 122.728 121.202 1.526 1
1 559 . 5 1 1 A 57 57 GLY H H 55 8.231 8.567 -0.336 1
1 560 . 5 1 1 A 57 57 GLY HA2 H 55 3.911 3.992 -0.081 1
1 561 . 5 1 1 A 57 57 GLY HA3 H 55 3.808 4.001 -0.193 1
1 562 . 5 1 1 A 57 57 GLY C C 55 174.379 174.846 -0.467 1
1 563 . 5 1 1 A 57 57 GLY CA C 55 45.092 45.048 0.044 1
1 564 . 5 1 1 A 57 57 GLY N N 55 110.035 109.112 0.923 1
1 565 . 5 1 1 A 58 58 GLU H H 56 8.241 8.467 -0.226 1
1 566 . 5 1 1 A 58 58 GLU HA H 56 4.136 3.988 0.148 1
1 570 . 5 1 1 A 58 58 GLU C C 56 176.868 176.664 0.204 1
1 571 . 5 1 1 A 58 58 GLU CA C 56 56.734 59.070 -2.336 1
1 572 . 5 1 1 A 58 58 GLU CB C 56 29.584 28.192 1.392 1
1 574 . 5 1 1 A 58 58 GLU N N 56 121.173 114.790 6.383 1
1 575 . 5 1 1 A 59 59 GLU H H 57 8.419 9.141 -0.722 1
1 576 . 5 1 1 A 59 59 GLU HA H 57 4.074 4.020 0.054 1
1 580 . 5 1 1 A 59 59 GLU C C 57 176.502 177.704 -1.202 1
1 581 . 5 1 1 A 59 59 GLU CA C 57 56.842 59.277 -2.435 1
1 582 . 5 1 1 A 59 59 GLU CB C 57 29.267 29.551 -0.284 1
1 584 . 5 1 1 A 59 59 GLU N N 57 121.777 120.391 1.386 1
1 585 . 5 1 1 A 60 60 ALA H H 58 8.077 7.696 0.381 1
1 586 . 5 1 1 A 60 60 ALA HA H 58 4.134 4.379 -0.245 1
1 590 . 5 1 1 A 60 60 ALA CA C 58 52.432 52.252 0.180 1
1 591 . 5 1 1 A 60 60 ALA CB C 58 18.743 19.349 -0.606 1
1 592 . 5 1 1 A 60 60 ALA N N 58 125.120 121.479 3.641 1
1 593 . 5 1 1 A 61 61 ALA H H 59 8.041 8.368 -0.327 1
1 594 . 5 1 1 A 61 61 ALA HA H 59 4.131 3.945 0.186 1
1 598 . 5 1 1 A 61 61 ALA C C 59 178.147 177.834 0.313 1
1 599 . 5 1 1 A 61 61 ALA CA C 59 52.586 53.421 -0.835 1
1 600 . 5 1 1 A 61 61 ALA CB C 59 18.692 18.808 -0.116 1
1 601 . 5 1 1 A 61 61 ALA N N 59 123.857 122.731 1.126 1
1 602 . 5 1 1 A 62 62 GLY H H 60 8.069 8.453 -0.384 1
1 603 . 5 1 1 A 62 62 GLY HA2 H 60 3.810 4.023 -0.213 1
1 604 . 5 1 1 A 62 62 GLY HA3 H 60 3.888 4.046 -0.158 1
1 605 . 5 1 1 A 62 62 GLY C C 60 174.914 174.728 0.186 1
1 606 . 5 1 1 A 62 62 GLY CA C 60 45.320 45.470 -0.150 1
1 607 . 5 1 1 A 62 62 GLY N N 60 107.924 109.109 -1.185 1
1 608 . 5 1 1 A 63 63 GLY H H 61 8.118 8.036 0.082 1
1 609 . 5 1 1 A 63 63 GLY HA2 H 61 4.008 4.211 -0.203 1
1 610 . 5 1 1 A 63 63 GLY HA3 H 61 3.893 4.234 -0.341 1
1 611 . 5 1 1 A 63 63 GLY C C 61 174.743 175.162 -0.419 1
1 612 . 5 1 1 A 63 63 GLY CA C 61 45.202 45.843 -0.641 1
1 613 . 5 1 1 A 63 63 GLY N N 61 109.441 107.205 2.236 1
1 614 . 5 1 1 A 64 64 ASP H H 62 8.305 8.661 -0.356 1
1 615 . 5 1 1 A 64 64 ASP HA H 62 4.240 4.275 -0.035 1
1 618 . 5 1 1 A 64 64 ASP C C 62 177.571 178.498 -0.927 1
1 619 . 5 1 1 A 64 64 ASP CA C 62 57.210 57.216 -0.006 1
1 620 . 5 1 1 A 64 64 ASP CB C 62 40.142 40.249 -0.107 1
1 621 . 5 1 1 A 64 64 ASP N N 62 121.568 120.439 1.129 1
1 622 . 5 1 1 A 65 65 GLN H H 63 8.337 8.087 0.250 1
1 623 . 5 1 1 A 65 65 GLN HA H 63 4.138 4.002 0.136 1
1 628 . 5 1 1 A 65 65 GLN C C 63 177.490 178.848 -1.358 1
1 629 . 5 1 1 A 65 65 GLN CA C 63 58.643 58.763 -0.120 1
1 630 . 5 1 1 A 65 65 GLN CB C 63 27.803 28.619 -0.816 1
1 632 . 5 1 1 A 65 65 GLN N N 63 119.700 119.455 0.245 1
1 633 . 5 1 1 A 66 66 PHE H H 64 7.658 8.210 -0.552 1
1 634 . 5 1 1 A 66 66 PHE HA H 64 4.170 4.363 -0.193 1
1 638 . 5 1 1 A 66 66 PHE C C 64 176.872 178.482 -1.610 1
1 639 . 5 1 1 A 66 66 PHE CA C 64 60.158 61.126 -0.968 1
1 640 . 5 1 1 A 66 66 PHE CB C 64 38.490 38.356 0.134 1
1 643 . 5 1 1 A 66 66 PHE N N 64 121.036 119.444 1.592 1
1 644 . 5 1 1 A 67 67 ILE H H 65 7.646 9.075 -1.429 1
1 645 . 5 1 1 A 67 67 ILE HA H 65 3.426 3.852 -0.426 1
1 655 . 5 1 1 A 67 67 ILE CA C 65 63.377 64.633 -1.256 1
1 656 . 5 1 1 A 67 67 ILE CB C 65 37.057 37.850 -0.793 1
1 660 . 5 1 1 A 67 67 ILE N N 65 121.372 119.348 2.024 1
1 661 . 5 1 1 A 68 68 HIS H H 66 7.945 8.151 -0.206 1
1 662 . 5 1 1 A 68 68 HIS HA H 66 4.005 4.367 -0.362 1
1 665 . 5 1 1 A 68 68 HIS CA C 66 59.915 59.524 0.391 1
1 668 . 5 1 1 A 68 68 HIS N N 66 120.036 120.853 -0.817 1
1 669 . 5 1 1 A 69 69 GLU HA H 67 3.677 3.857 -0.180 1
1 673 . 5 1 1 A 69 69 GLU CA C 67 58.490 59.910 -1.420 1
1 674 . 5 1 1 A 69 69 GLU CB C 67 29.290 29.211 0.079 1
1 676 . 5 1 1 A 70 70 GLN H H 68 8.017 7.867 0.150 1
1 677 . 5 1 1 A 70 70 GLN HA H 68 3.426 4.249 -0.823 1
1 678 . 5 1 1 A 70 70 GLN C C 68 179.280 178.750 0.530 1
1 679 . 5 1 1 A 70 70 GLN CA C 68 57.561 58.856 -1.295 1
1 680 . 5 1 1 A 70 70 GLN CB C 68 28.530 28.860 -0.330 1
1 682 . 5 1 1 A 70 70 GLN N N 68 120.410 118.817 1.593 1
1 683 . 5 1 1 A 71 71 ASP HA H 69 4.440 4.746 -0.306 1
1 684 . 5 1 1 A 71 71 ASP C C 69 177.402 178.901 -1.499 1
1 685 . 5 1 1 A 71 71 ASP CA C 69 56.290 57.401 -1.111 1
1 686 . 5 1 1 A 72 72 LEU H H 70 7.952 8.681 -0.729 1
1 687 . 5 1 1 A 72 72 LEU HA H 70 3.775 3.939 -0.164 1
1 697 . 5 1 1 A 72 72 LEU C C 70 178.316 178.128 0.188 1
1 698 . 5 1 1 A 72 72 LEU CA C 70 56.101 57.322 -1.221 1
1 699 . 5 1 1 A 72 72 LEU CB C 70 39.872 41.185 -1.313 1
1 703 . 5 1 1 A 72 72 LEU N N 70 120.832 120.396 0.436 1
1 704 . 5 1 1 A 73 73 ASN H H 71 7.723 8.183 -0.460 1
1 705 . 5 1 1 A 73 73 ASN HA H 71 4.270 4.320 -0.050 1
1 708 . 5 1 1 A 73 73 ASN C C 71 178.193 177.721 0.472 1
1 709 . 5 1 1 A 73 73 ASN CA C 71 55.970 56.347 -0.377 1
1 710 . 5 1 1 A 73 73 ASN CB C 71 37.640 39.112 -1.472 1
1 711 . 5 1 1 A 73 73 ASN N N 71 119.295 117.129 2.166 1
1 712 . 5 1 1 A 74 74 TRP H H 72 7.811 8.220 -0.409 1
1 713 . 5 1 1 A 74 74 TRP HA H 72 4.500 4.481 0.019 1
1 720 . 5 1 1 A 74 74 TRP CA C 72 58.480 59.878 -1.398 1
1 721 . 5 1 1 A 74 74 TRP CB C 72 28.920 29.561 -0.641 1
1 727 . 5 1 1 A 74 74 TRP N N 72 121.490 120.203 1.287 1
1 729 . 5 1 1 A 75 75 LEU H H 73 8.412 7.982 0.430 1
1 730 . 5 1 1 A 75 75 LEU HA H 73 3.290 3.050 0.240 1
1 739 . 5 1 1 A 75 75 LEU C C 73 178.562 178.343 0.219 1
1 740 . 5 1 1 A 75 75 LEU CA C 73 58.226 57.422 0.804 1
1 741 . 5 1 1 A 75 75 LEU CB C 73 41.200 40.461 0.739 1
1 745 . 5 1 1 A 75 75 LEU N N 73 121.065 120.649 0.416 1
1 746 . 5 1 1 A 76 76 GLN H H 74 7.648 7.625 0.023 1
1 747 . 5 1 1 A 76 76 GLN HA H 74 3.657 4.016 -0.359 1
1 752 . 5 1 1 A 76 76 GLN C C 74 178.616 177.691 0.925 1
1 753 . 5 1 1 A 76 76 GLN CA C 74 58.777 58.971 -0.194 1
1 754 . 5 1 1 A 76 76 GLN CB C 74 28.163 28.316 -0.153 1
1 756 . 5 1 1 A 76 76 GLN N N 74 113.985 118.164 -4.179 1
1 757 . 5 1 1 A 77 77 GLN H H 75 7.465 7.432 0.033 1
1 758 . 5 1 1 A 77 77 GLN HA H 75 4.134 4.398 -0.264 1
1 761 . 5 1 1 A 77 77 GLN C C 75 176.223 175.783 0.440 1
1 762 . 5 1 1 A 77 77 GLN CA C 75 56.203 55.497 0.706 1
1 763 . 5 1 1 A 77 77 GLN CB C 75 29.524 29.537 -0.013 1
1 765 . 5 1 1 A 77 77 GLN N N 75 117.481 116.336 1.145 1
1 766 . 5 1 1 A 78 78 ALA H H 76 7.420 7.194 0.226 1
1 767 . 5 1 1 A 78 78 ALA HA H 76 3.864 4.263 -0.399 1
1 771 . 5 1 1 A 78 78 ALA C C 76 176.733 176.781 -0.048 1
1 772 . 5 1 1 A 78 78 ALA CA C 76 52.529 53.009 -0.480 1
1 773 . 5 1 1 A 78 78 ALA CB C 76 20.124 18.930 1.194 1
1 774 . 5 1 1 A 78 78 ALA N N 76 122.682 123.326 -0.644 1
1 775 . 5 1 1 A 79 79 ASP H H 77 9.028 8.758 0.270 1
1 776 . 5 1 1 A 79 79 ASP HA H 77 4.673 4.710 -0.037 1
1 779 . 5 1 1 A 79 79 ASP C C 77 175.740 175.413 0.327 1
1 780 . 5 1 1 A 79 79 ASP CA C 77 56.383 55.172 1.211 1
1 781 . 5 1 1 A 79 79 ASP CB C 77 42.826 42.640 0.186 1
1 782 . 5 1 1 A 79 79 ASP N N 77 119.887 121.857 -1.970 1
1 783 . 5 1 1 A 80 80 VAL H H 78 7.379 7.954 -0.575 1
1 784 . 5 1 1 A 80 80 VAL HA H 78 4.340 4.828 -0.488 1
1 792 . 5 1 1 A 80 80 VAL C C 78 175.321 174.471 0.850 1
1 793 . 5 1 1 A 80 80 VAL CA C 78 60.011 60.404 -0.393 1
1 794 . 5 1 1 A 80 80 VAL CB C 78 35.362 36.735 -1.373 1
1 797 . 5 1 1 A 80 80 VAL N N 78 114.152 116.869 -2.717 1
1 798 . 5 1 1 A 81 81 VAL H H 79 8.350 8.637 -0.287 1
1 799 . 5 1 1 A 81 81 VAL HA H 79 4.799 4.850 -0.051 1
1 807 . 5 1 1 A 81 81 VAL C C 79 173.095 174.741 -1.646 1
1 808 . 5 1 1 A 81 81 VAL CA C 79 60.775 60.791 -0.016 1
1 809 . 5 1 1 A 81 81 VAL CB C 79 32.824 36.167 -3.343 1
1 812 . 5 1 1 A 81 81 VAL N N 79 128.429 125.955 2.474 1
1 813 . 5 1 1 A 82 82 VAL H H 80 8.947 8.453 0.494 1
1 814 . 5 1 1 A 82 82 VAL HA H 80 4.947 4.763 0.184 1
1 822 . 5 1 1 A 82 82 VAL C C 80 173.522 174.405 -0.883 1
1 823 . 5 1 1 A 82 82 VAL CA C 80 59.684 60.227 -0.543 1
1 824 . 5 1 1 A 82 82 VAL CB C 80 33.702 34.712 -1.010 1
1 827 . 5 1 1 A 82 82 VAL N N 80 126.957 125.987 0.970 1
1 828 . 5 1 1 A 83 83 ALA H H 81 9.011 9.290 -0.279 1
1 829 . 5 1 1 A 83 83 ALA HA H 81 4.938 5.261 -0.323 1
1 833 . 5 1 1 A 83 83 ALA C C 81 130.330 175.459 -45.129 1
1 834 . 5 1 1 A 83 83 ALA CA C 81 49.490 49.617 -0.127 1
1 835 . 5 1 1 A 83 83 ALA CB C 81 23.628 22.469 1.159 1
1 836 . 5 1 1 A 83 83 ALA N N 81 128.705 129.291 -0.586 1
1 837 . 5 1 1 A 84 84 GLU H H 82 8.922 8.292 0.630 1
1 838 . 5 1 1 A 84 84 GLU HA H 82 4.937 4.948 -0.011 1
1 839 . 5 1 1 A 84 84 GLU C C 82 177.673 175.399 2.274 1
1 840 . 5 1 1 A 84 84 GLU CA C 82 56.714 55.271 1.443 1
1 841 . 5 1 1 A 84 84 GLU CB C 82 29.882 31.098 -1.216 1
1 842 . 5 1 1 A 84 84 GLU N N 82 130.330 121.402 8.928 1
1 843 . 5 1 1 A 85 85 VAL H H 83 8.427 9.161 -0.734 1
1 844 . 5 1 1 A 85 85 VAL HA H 83 4.435 4.883 -0.448 1
1 852 . 5 1 1 A 85 85 VAL C C 83 174.252 175.571 -1.319 1
1 853 . 5 1 1 A 85 85 VAL CA C 83 59.896 60.095 -0.199 1
1 854 . 5 1 1 A 85 85 VAL CB C 83 29.968 34.357 -4.389 1
1 857 . 5 1 1 A 85 85 VAL N N 83 114.212 118.250 -4.038 1
1 858 . 5 1 1 A 86 86 THR H H 84 9.347 9.091 0.256 1
1 859 . 5 1 1 A 86 86 THR HA H 84 4.146 4.925 -0.779 1
1 864 . 5 1 1 A 86 86 THR C C 84 175.751 174.576 1.175 1
1 865 . 5 1 1 A 86 86 THR CA C 84 67.629 62.533 5.096 1
1 866 . 5 1 1 A 86 86 THR CB C 84 66.819 70.688 -3.869 1
1 868 . 5 1 1 A 86 86 THR N N 84 121.640 119.435 2.205 1
1 869 . 5 1 1 A 87 87 GLN H H 85 8.114 7.657 0.457 1
1 870 . 5 1 1 A 87 87 GLN HA H 85 4.736 4.914 -0.178 1
1 874 . 5 1 1 A 87 87 GLN CA C 85 51.898 53.384 -1.486 1
1 875 . 5 1 1 A 87 87 GLN CB C 85 27.942 31.387 -3.445 1
1 877 . 5 1 1 A 87 87 GLN N N 85 120.367 117.850 2.517 1
1 878 . 5 1 1 A 88 88 PRO HA H 86 4.061 4.387 -0.326 1
1 885 . 5 1 1 A 88 88 PRO C C 86 176.436 176.033 0.403 1
1 886 . 5 1 1 A 88 88 PRO CA C 86 63.422 63.523 -0.101 1
1 887 . 5 1 1 A 88 88 PRO CB C 86 31.925 32.016 -0.091 1
1 889 . 5 1 1 A 89 89 SER H H 87 6.044 8.657 -2.613 1
1 890 . 5 1 1 A 89 89 SER HA H 87 4.630 5.091 -0.461 1
1 893 . 5 1 1 A 89 89 SER C C 87 175.612 172.680 2.932 1
1 894 . 5 1 1 A 89 89 SER CA C 87 56.800 57.871 -1.071 1
1 895 . 5 1 1 A 89 89 SER CB C 87 64.196 65.181 -0.985 1
1 896 . 5 1 1 A 89 89 SER N N 87 115.721 119.188 -3.467 1
1 897 . 5 1 1 A 90 90 LEU H H 88 9.702 8.728 0.974 1
1 898 . 5 1 1 A 90 90 LEU HA H 88 4.270 4.948 -0.678 1
1 906 . 5 1 1 A 90 90 LEU C C 88 179.173 177.555 1.618 1
1 907 . 5 1 1 A 90 90 LEU CA C 88 57.402 53.645 3.757 1
1 908 . 5 1 1 A 90 90 LEU CB C 88 43.642 44.672 -1.030 1
1 911 . 5 1 1 A 90 90 LEU N N 88 130.488 126.400 4.088 1
1 912 . 5 1 1 A 91 91 GLY H H 89 8.354 8.955 -0.601 1
1 913 . 5 1 1 A 91 91 GLY HA2 H 89 3.680 4.090 -0.410 1
1 914 . 5 1 1 A 91 91 GLY HA3 H 89 3.584 4.108 -0.524 1
1 915 . 5 1 1 A 91 91 GLY C C 89 175.106 175.740 -0.634 1
1 916 . 5 1 1 A 91 91 GLY CA C 89 47.770 45.709 2.061 1
1 917 . 5 1 1 A 91 91 GLY N N 89 107.522 114.031 -6.509 1
1 918 . 5 1 1 A 92 92 VAL H H 90 7.906 8.035 -0.129 1
1 919 . 5 1 1 A 92 92 VAL HA H 90 3.940 3.919 0.021 1
1 927 . 5 1 1 A 92 92 VAL C C 90 178.467 178.393 0.074 1
1 928 . 5 1 1 A 92 92 VAL CA C 90 65.379 66.208 -0.829 1
1 929 . 5 1 1 A 92 92 VAL CB C 90 31.785 31.895 -0.110 1
1 932 . 5 1 1 A 92 92 VAL N N 90 121.741 120.595 1.146 1
1 933 . 5 1 1 A 93 93 GLY H H 91 7.595 7.865 -0.270 1
1 934 . 5 1 1 A 93 93 GLY HA2 H 91 3.628 3.846 -0.218 1
1 935 . 5 1 1 A 93 93 GLY HA3 H 91 3.415 3.854 -0.439 1
1 936 . 5 1 1 A 93 93 GLY C C 91 174.022 175.407 -1.385 1
1 937 . 5 1 1 A 93 93 GLY CA C 91 48.319 47.541 0.778 1
1 938 . 5 1 1 A 93 93 GLY N N 91 104.629 107.796 -3.167 1
1 939 . 5 1 1 A 94 94 TYR H H 92 8.372 8.149 0.223 1
1 940 . 5 1 1 A 94 94 TYR HA H 92 4.046 4.071 -0.025 1
1 943 . 5 1 1 A 94 94 TYR C C 92 177.458 177.852 -0.394 1
1 944 . 5 1 1 A 94 94 TYR CA C 92 61.760 60.815 0.945 1
1 945 . 5 1 1 A 94 94 TYR CB C 92 38.431 38.702 -0.271 1
1 948 . 5 1 1 A 94 94 TYR N N 92 123.383 123.228 0.155 1
1 949 . 5 1 1 A 95 95 GLU H H 93 8.424 8.604 -0.180 1
1 950 . 5 1 1 A 95 95 GLU HA H 93 3.421 3.773 -0.352 1
1 951 . 5 1 1 A 95 95 GLU C C 93 178.590 179.290 -0.700 1
1 952 . 5 1 1 A 95 95 GLU CA C 93 60.211 59.456 0.755 1
1 953 . 5 1 1 A 95 95 GLU CB C 93 29.025 29.179 -0.154 1
1 954 . 5 1 1 A 95 95 GLU N N 93 120.181 118.465 1.716 1
1 955 . 5 1 1 A 96 96 LEU H H 94 8.210 8.275 -0.065 1
1 956 . 5 1 1 A 96 96 LEU HA H 94 3.830 3.979 -0.149 1
1 964 . 5 1 1 A 96 96 LEU C C 94 179.032 178.929 0.103 1
1 965 . 5 1 1 A 96 96 LEU CA C 94 57.683 58.089 -0.406 1
1 966 . 5 1 1 A 96 96 LEU CB C 94 41.883 41.831 0.052 1
1 970 . 5 1 1 A 96 96 LEU N N 94 118.091 120.850 -2.759 1
1 971 . 5 1 1 A 97 97 GLY H H 95 8.773 8.631 0.142 1
1 972 . 5 1 1 A 97 97 GLY C C 95 175.344 175.154 0.190 1
1 973 . 5 1 1 A 97 97 GLY CA C 95 47.308 46.491 0.817 1
1 974 . 5 1 1 A 97 97 GLY N N 95 108.085 105.841 2.244 1
1 975 . 5 1 1 A 98 98 ARG H H 96 8.100 8.501 -0.401 1
1 976 . 5 1 1 A 98 98 ARG C C 96 179.692 177.806 1.886 1
1 977 . 5 1 1 A 98 98 ARG CA C 96 56.308 58.627 -2.319 1
1 978 . 5 1 1 A 98 98 ARG CB C 96 26.854 29.470 -2.616 1
1 979 . 5 1 1 A 98 98 ARG N N 96 118.156 121.689 -3.533 1
1 980 . 5 1 1 A 99 99 ALA H H 97 8.498 7.627 0.871 1
1 981 . 5 1 1 A 99 99 ALA HA H 97 3.640 3.969 -0.329 1
1 985 . 5 1 1 A 99 99 ALA C C 97 179.650 180.296 -0.646 1
1 986 . 5 1 1 A 99 99 ALA CA C 97 55.166 55.071 0.095 1
1 987 . 5 1 1 A 99 99 ALA CB C 97 18.604 18.519 0.085 1
1 988 . 5 1 1 A 99 99 ALA N N 97 122.310 121.880 0.430 1
1 989 . 5 1 1 A 100 100 VAL H H 98 8.597 8.547 0.050 1
1 990 . 5 1 1 A 100 100 VAL HA H 98 3.798 3.378 0.420 1
1 998 . 5 1 1 A 100 100 VAL C C 98 180.464 178.016 2.448 1
1 999 . 5 1 1 A 100 100 VAL CA C 98 65.664 66.602 -0.938 1
1 1000 . 5 1 1 A 100 100 VAL CB C 98 31.065 31.300 -0.235 1
1 1003 . 5 1 1 A 100 100 VAL N N 98 120.603 119.207 1.396 1
1 1004 . 5 1 1 A 101 101 ALA H H 99 7.280 7.844 -0.564 1
1 1005 . 5 1 1 A 101 101 ALA HA H 99 3.963 4.080 -0.117 1
1 1009 . 5 1 1 A 101 101 ALA C C 99 179.314 178.705 0.609 1
1 1010 . 5 1 1 A 101 101 ALA CA C 99 54.367 54.784 -0.417 1
1 1011 . 5 1 1 A 101 101 ALA CB C 99 18.139 18.905 -0.766 1
1 1012 . 5 1 1 A 101 101 ALA N N 99 124.450 121.608 2.842 1
1 1013 . 5 1 1 A 102 102 LEU H H 100 7.200 7.845 -0.645 1
1 1014 . 5 1 1 A 102 102 LEU HA H 100 4.192 4.512 -0.320 1
1 1024 . 5 1 1 A 102 102 LEU C C 100 177.306 177.396 -0.090 1
1 1025 . 5 1 1 A 102 102 LEU CA C 100 54.808 55.008 -0.200 1
1 1026 . 5 1 1 A 102 102 LEU CB C 100 42.880 43.652 -0.772 1
1 1030 . 5 1 1 A 102 102 LEU N N 100 116.834 112.323 4.511 1
1 1031 . 5 1 1 A 103 103 GLY H H 101 7.891 7.947 -0.056 1
1 1032 . 5 1 1 A 103 103 GLY HA2 H 101 3.941 4.001 -0.060 1
1 1033 . 5 1 1 A 103 103 GLY HA3 H 101 3.831 4.002 -0.171 1
1 1034 . 5 1 1 A 103 103 GLY C C 101 175.137 173.899 1.238 1
1 1035 . 5 1 1 A 103 103 GLY CA C 101 45.673 45.001 0.672 1
1 1036 . 5 1 1 A 103 103 GLY N N 101 109.395 108.852 0.543 1
1 1037 . 5 1 1 A 104 104 LYS H H 102 7.337 8.725 -1.388 1
1 1038 . 5 1 1 A 104 104 LYS HA H 102 4.402 4.502 -0.100 1
1 1043 . 5 1 1 A 104 104 LYS CA C 102 52.136 57.057 -4.921 1
1 1044 . 5 1 1 A 104 104 LYS CB C 102 31.045 35.122 -4.077 1
1 1047 . 5 1 1 A 104 104 LYS N N 102 118.954 118.797 0.157 1
1 1048 . 5 1 1 A 105 105 PRO HA H 103 4.781 4.886 -0.105 1
1 1054 . 5 1 1 A 105 105 PRO CA C 103 62.791 62.281 0.510 1
1 1055 . 5 1 1 A 105 105 PRO CB C 103 30.405 31.631 -1.226 1
1 1058 . 5 1 1 A 106 106 ILE H H 104 8.261 8.569 -0.308 1
1 1059 . 5 1 1 A 106 106 ILE HA H 104 4.680 4.655 0.025 1
1 1069 . 5 1 1 A 106 106 ILE C C 104 175.543 174.056 1.487 1
1 1070 . 5 1 1 A 106 106 ILE CA C 104 59.362 59.636 -0.274 1
1 1071 . 5 1 1 A 106 106 ILE CB C 104 43.738 41.445 2.293 1
1 1075 . 5 1 1 A 106 106 ILE N N 104 123.509 124.344 -0.835 1
1 1076 . 5 1 1 A 107 107 LEU H H 105 8.584 8.518 0.066 1
1 1077 . 5 1 1 A 107 107 LEU HA H 105 4.243 4.559 -0.316 1
1 1087 . 5 1 1 A 107 107 LEU C C 105 174.204 174.646 -0.442 1
1 1088 . 5 1 1 A 107 107 LEU CA C 105 52.863 53.056 -0.193 1
1 1089 . 5 1 1 A 107 107 LEU CB C 105 42.408 44.747 -2.339 1
1 1093 . 5 1 1 A 107 107 LEU N N 105 131.882 129.992 1.890 1
1 1094 . 5 1 1 A 108 108 CYS H H 106 8.679 8.992 -0.313 1
1 1095 . 5 1 1 A 108 108 CYS HA H 106 5.280 5.139 0.141 1
1 1099 . 5 1 1 A 108 108 CYS C C 106 173.134 173.507 -0.373 1
1 1100 . 5 1 1 A 108 108 CYS CA C 106 57.290 57.247 0.043 1
1 1101 . 5 1 1 A 108 108 CYS CB C 106 29.559 29.850 -0.291 1
1 1102 . 5 1 1 A 108 108 CYS N N 106 122.904 125.868 -2.964 1
1 1103 . 5 1 1 A 109 109 LEU H H 107 8.987 8.717 0.270 1
1 1104 . 5 1 1 A 109 109 LEU HA H 107 5.120 5.728 -0.608 1
1 1112 . 5 1 1 A 109 109 LEU C C 107 174.500 175.496 -0.996 1
1 1113 . 5 1 1 A 109 109 LEU CA C 107 53.274 53.633 -0.359 1
1 1114 . 5 1 1 A 109 109 LEU CB C 107 43.450 44.834 -1.384 1
1 1118 . 5 1 1 A 109 109 LEU N N 107 124.653 123.450 1.203 1
1 1119 . 5 1 1 A 110 110 PHE H H 108 8.981 8.917 0.064 1
1 1120 . 5 1 1 A 110 110 PHE HA H 108 4.846 5.777 -0.931 1
1 1125 . 5 1 1 A 110 110 PHE C C 108 172.231 173.816 -1.585 1
1 1126 . 5 1 1 A 110 110 PHE CA C 108 55.963 57.104 -1.141 1
1 1127 . 5 1 1 A 110 110 PHE CB C 108 43.270 42.459 0.811 1
1 1130 . 5 1 1 A 110 110 PHE N N 108 125.052 125.545 -0.493 1
1 1131 . 5 1 1 A 111 111 ARG H H 109 7.461 8.963 -1.502 1
1 1132 . 5 1 1 A 111 111 ARG HA H 109 4.804 4.756 0.048 1
1 1136 . 5 1 1 A 111 111 ARG CA C 109 51.953 53.335 -1.382 1
1 1137 . 5 1 1 A 111 111 ARG CB C 109 30.008 29.698 0.310 1
1 1140 . 5 1 1 A 111 111 ARG N N 109 128.034 127.277 0.757 1
1 1141 . 5 1 1 A 112 112 PRO C C 110 178.675 177.681 0.994 1
1 1142 . 5 1 1 A 112 112 PRO CA C 110 64.024 64.158 -0.134 1
1 1143 . 5 1 1 A 112 112 PRO CB C 110 31.416 31.789 -0.373 1
1 1144 . 5 1 1 A 113 113 GLN H H 111 8.188 8.737 -0.549 1
1 1145 . 5 1 1 A 113 113 GLN HA H 111 4.056 4.056 0.000 1
1 1149 . 5 1 1 A 113 113 GLN C C 111 175.936 177.878 -1.942 1
1 1150 . 5 1 1 A 113 113 GLN CA C 111 57.144 58.298 -1.154 1
1 1151 . 5 1 1 A 113 113 GLN CB C 111 28.033 28.071 -0.038 1
1 1153 . 5 1 1 A 113 113 GLN N N 111 118.835 116.727 2.108 1
1 1154 . 5 1 1 A 114 114 SER H H 112 7.730 7.696 0.034 1
1 1155 . 5 1 1 A 114 114 SER HA H 112 4.037 4.577 -0.540 1
1 1158 . 5 1 1 A 114 114 SER C C 112 175.750 174.623 1.127 1
1 1159 . 5 1 1 A 114 114 SER CA C 112 60.154 58.584 1.570 1
1 1160 . 5 1 1 A 114 114 SER CB C 112 64.282 64.262 0.020 1
1 1161 . 5 1 1 A 114 114 SER N N 112 114.887 114.716 0.171 1
1 1162 . 5 1 1 A 115 115 GLY H H 113 8.005 8.125 -0.120 1
1 1163 . 5 1 1 A 115 115 GLY HA2 H 113 3.712 4.000 -0.288 1
1 1164 . 5 1 1 A 115 115 GLY HA3 H 113 4.130 4.197 -0.067 1
1 1165 . 5 1 1 A 115 115 GLY C C 113 173.945 175.721 -1.776 1
1 1166 . 5 1 1 A 115 115 GLY CA C 113 45.233 47.227 -1.994 1
1 1167 . 5 1 1 A 115 115 GLY N N 113 110.740 109.629 1.111 1
1 1168 . 5 1 1 A 116 116 ARG H H 114 7.665 8.666 -1.001 1
1 1169 . 5 1 1 A 116 116 ARG HA H 114 4.449 4.418 0.031 1
1 1173 . 5 1 1 A 116 116 ARG C C 114 175.370 175.370 0.000 1
1 1174 . 5 1 1 A 116 116 ARG CA C 114 55.080 55.483 -0.403 1
1 1175 . 5 1 1 A 116 116 ARG CB C 114 31.215 30.320 0.895 1
1 1178 . 5 1 1 A 116 116 ARG N N 114 119.983 118.092 1.891 1
1 1179 . 5 1 1 A 117 117 VAL H H 115 8.409 7.865 0.544 1
1 1180 . 5 1 1 A 117 117 VAL HA H 115 4.184 3.722 0.462 1
1 1188 . 5 1 1 A 117 117 VAL C C 115 175.980 174.326 1.654 1
1 1189 . 5 1 1 A 117 117 VAL CA C 115 61.167 62.364 -1.197 1
1 1190 . 5 1 1 A 117 117 VAL CB C 115 32.931 30.945 1.986 1
1 1193 . 5 1 1 A 117 117 VAL N N 115 122.240 116.097 6.143 1
1 1194 . 5 1 1 A 118 118 LEU H H 116 8.227 7.929 0.298 1
1 1195 . 5 1 1 A 118 118 LEU HA H 116 3.720 4.063 -0.343 1
1 1204 . 5 1 1 A 118 118 LEU C C 116 175.623 176.238 -0.615 1
1 1205 . 5 1 1 A 118 118 LEU CA C 116 54.555 55.053 -0.498 1
1 1206 . 5 1 1 A 118 118 LEU CB C 116 39.292 43.124 -3.832 1
1 1210 . 5 1 1 A 118 118 LEU N N 116 131.481 127.462 4.019 1
1 1211 . 5 1 1 A 119 119 SER H H 117 7.780 8.453 -0.673 1
1 1212 . 5 1 1 A 119 119 SER HA H 117 4.060 4.270 -0.210 1
1 1214 . 5 1 1 A 119 119 SER C C 117 175.782 175.988 -0.206 1
1 1215 . 5 1 1 A 119 119 SER CA C 117 58.530 58.664 -0.134 1
1 1216 . 5 1 1 A 119 119 SER CB C 117 64.785 63.653 1.132 1
1 1217 . 5 1 1 A 119 119 SER N N 117 118.658 120.388 -1.730 1
1 1218 . 5 1 1 A 120 120 ALA H H 118 8.955 8.965 -0.010 1
1 1219 . 5 1 1 A 120 120 ALA HA H 118 3.846 3.994 -0.148 1
1 1223 . 5 1 1 A 120 120 ALA C C 118 179.731 179.942 -0.211 1
1 1224 . 5 1 1 A 120 120 ALA CA C 118 54.927 55.507 -0.580 1
1 1225 . 5 1 1 A 120 120 ALA CB C 118 18.627 18.183 0.444 1
1 1226 . 5 1 1 A 120 120 ALA N N 118 134.119 130.304 3.815 1
1 1227 . 5 1 1 A 121 121 MET H H 119 7.718 8.178 -0.460 1
1 1228 . 5 1 1 A 121 121 MET HA H 119 4.130 4.154 -0.024 1
1 1235 . 5 1 1 A 121 121 MET C C 119 175.610 178.778 -3.168 1
1 1236 . 5 1 1 A 121 121 MET CA C 119 55.968 58.593 -2.625 1
1 1237 . 5 1 1 A 121 121 MET CB C 119 30.814 32.889 -2.075 1
1 1240 . 5 1 1 A 121 121 MET N N 119 115.424 116.385 -0.961 1
1 1241 . 5 1 1 A 122 122 ILE H H 120 6.451 8.129 -1.678 1
1 1242 . 5 1 1 A 122 122 ILE HA H 120 3.392 3.678 -0.286 1
1 1252 . 5 1 1 A 122 122 ILE C C 120 177.108 177.955 -0.847 1
1 1253 . 5 1 1 A 122 122 ILE CA C 120 59.650 65.095 -5.445 1
1 1254 . 5 1 1 A 122 122 ILE CB C 120 34.640 37.839 -3.199 1
1 1258 . 5 1 1 A 122 122 ILE N N 120 113.418 119.440 -6.022 1
1 1259 . 5 1 1 A 123 123 ARG H H 121 7.540 8.349 -0.809 1
1 1260 . 5 1 1 A 123 123 ARG HA H 121 3.551 4.138 -0.587 1
1 1264 . 5 1 1 A 123 123 ARG C C 121 179.642 179.858 -0.216 1
1 1265 . 5 1 1 A 123 123 ARG CA C 121 59.242 59.143 0.099 1
1 1266 . 5 1 1 A 123 123 ARG CB C 121 29.087 30.031 -0.944 1
1 1269 . 5 1 1 A 123 123 ARG N N 121 116.248 119.986 -3.738 1
1 1270 . 5 1 1 A 124 124 GLY H H 122 8.086 8.520 -0.434 1
1 1271 . 5 1 1 A 124 124 GLY C C 122 172.357 176.246 -3.889 1
1 1272 . 5 1 1 A 124 124 GLY CA C 122 44.836 47.203 -2.367 1
1 1273 . 5 1 1 A 124 124 GLY N N 122 104.381 108.429 -4.048 1
1 1274 . 5 1 1 A 125 125 ALA H H 123 6.411 8.428 -2.017 1
1 1275 . 5 1 1 A 125 125 ALA HA H 123 2.441 4.041 -1.600 1
1 1279 . 5 1 1 A 125 125 ALA C C 123 176.908 179.055 -2.147 1
1 1280 . 5 1 1 A 125 125 ALA CA C 123 51.593 55.053 -3.460 1
1 1281 . 5 1 1 A 125 125 ALA CB C 123 16.997 18.384 -1.387 1
1 1282 . 5 1 1 A 125 125 ALA N N 123 123.136 124.258 -1.122 1
1 1283 . 5 1 1 A 126 126 ALA H H 124 6.190 7.729 -1.539 1
1 1284 . 5 1 1 A 126 126 ALA HA H 124 3.829 4.469 -0.640 1
1 1288 . 5 1 1 A 126 126 ALA C C 124 177.535 176.914 0.621 1
1 1289 . 5 1 1 A 126 126 ALA CA C 124 52.403 53.471 -1.068 1
1 1290 . 5 1 1 A 126 126 ALA CB C 124 18.375 19.103 -0.728 1
1 1291 . 5 1 1 A 126 126 ALA N N 124 117.999 119.686 -1.687 1
1 1292 . 5 1 1 A 127 127 ASP H H 125 8.877 8.805 0.072 1
1 1293 . 5 1 1 A 127 127 ASP HA H 125 4.665 4.954 -0.289 1
1 1296 . 5 1 1 A 127 127 ASP C C 125 177.795 176.605 1.190 1
1 1297 . 5 1 1 A 127 127 ASP CA C 125 52.855 54.692 -1.837 1
1 1298 . 5 1 1 A 127 127 ASP CB C 125 41.814 43.045 -1.231 1
1 1299 . 5 1 1 A 127 127 ASP N N 125 121.828 126.048 -4.220 1
1 1300 . 5 1 1 A 128 128 GLY H H 126 7.954 8.383 -0.429 1
1 1301 . 5 1 1 A 128 128 GLY HA2 H 126 3.830 4.018 -0.188 1
1 1302 . 5 1 1 A 128 128 GLY HA3 H 126 4.249 4.033 0.216 1
1 1303 . 5 1 1 A 128 128 GLY C C 126 173.822 174.950 -1.128 1
1 1304 . 5 1 1 A 128 128 GLY CA C 126 45.549 45.544 0.005 1
1 1305 . 5 1 1 A 128 128 GLY N N 126 108.814 108.071 0.743 1
1 1306 . 5 1 1 A 129 129 SER H H 127 8.547 8.239 0.308 1
1 1307 . 5 1 1 A 129 129 SER HA H 127 4.486 4.407 0.079 1
1 1309 . 5 1 1 A 129 129 SER C C 127 174.178 174.864 -0.686 1
1 1310 . 5 1 1 A 129 129 SER CA C 127 58.653 57.710 0.943 1
1 1311 . 5 1 1 A 129 129 SER CB C 127 63.316 62.734 0.582 1
1 1312 . 5 1 1 A 129 129 SER N N 127 115.599 114.859 0.740 1
1 1313 . 5 1 1 A 130 130 ARG H H 128 8.795 8.531 0.264 1
1 1314 . 5 1 1 A 130 130 ARG HA H 128 4.160 3.988 0.172 1
1 1318 . 5 1 1 A 130 130 ARG C C 128 175.518 174.893 0.625 1
1 1319 . 5 1 1 A 130 130 ARG CA C 128 58.479 58.183 0.296 1
1 1320 . 5 1 1 A 130 130 ARG CB C 128 29.952 28.210 1.742 1
1 1323 . 5 1 1 A 130 130 ARG N N 128 127.611 114.535 13.076 1
1 1324 . 5 1 1 A 131 131 PHE H H 129 9.315 8.161 1.154 1
1 1325 . 5 1 1 A 131 131 PHE HA H 129 4.878 4.754 0.124 1
1 1331 . 5 1 1 A 131 131 PHE C C 129 175.058 174.538 0.520 1
1 1332 . 5 1 1 A 131 131 PHE CA C 129 55.953 57.001 -1.048 1
1 1333 . 5 1 1 A 131 131 PHE CB C 129 40.189 39.777 0.412 1
1 1337 . 5 1 1 A 131 131 PHE N N 129 126.219 121.442 4.777 1
1 1338 . 5 1 1 A 132 132 GLN H H 130 8.160 8.115 0.045 1
1 1339 . 5 1 1 A 132 132 GLN HA H 130 5.013 4.896 0.117 1
1 1343 . 5 1 1 A 132 132 GLN CA C 130 54.498 54.292 0.206 1
1 1344 . 5 1 1 A 132 132 GLN CB C 130 32.106 32.996 -0.890 1
1 1346 . 5 1 1 A 132 132 GLN N N 130 125.589 125.425 0.164 1
1 1347 . 5 1 1 A 133 133 VAL H H 131 8.689 8.808 -0.119 1
1 1348 . 5 1 1 A 133 133 VAL HA H 131 4.529 4.448 0.081 1
1 1356 . 5 1 1 A 133 133 VAL C C 131 174.441 175.428 -0.987 1
1 1357 . 5 1 1 A 133 133 VAL CA C 131 60.758 61.467 -0.709 1
1 1358 . 5 1 1 A 133 133 VAL CB C 131 32.417 32.065 0.352 1
1 1361 . 5 1 1 A 133 133 VAL N N 131 122.441 123.258 -0.817 1
1 1362 . 5 1 1 A 134 134 TRP H H 132 9.256 9.114 0.142 1
1 1363 . 5 1 1 A 134 134 TRP HA H 132 5.213 5.213 0.000 1
1 1371 . 5 1 1 A 134 134 TRP C C 132 174.575 175.691 -1.116 1
1 1372 . 5 1 1 A 134 134 TRP CA C 132 53.859 55.783 -1.924 1
1 1373 . 5 1 1 A 134 134 TRP CB C 132 31.311 31.459 -0.148 1
1 1379 . 5 1 1 A 134 134 TRP N N 132 130.303 128.035 2.268 1
1 1381 . 5 1 1 A 135 135 ASP H H 133 8.237 8.717 -0.480 1
1 1382 . 5 1 1 A 135 135 ASP HA H 133 6.018 5.867 0.151 1
1 1385 . 5 1 1 A 135 135 ASP C C 133 177.020 175.155 1.865 1
1 1386 . 5 1 1 A 135 135 ASP CA C 133 53.321 52.934 0.387 1
1 1387 . 5 1 1 A 135 135 ASP CB C 133 41.514 43.002 -1.488 1
1 1388 . 5 1 1 A 135 135 ASP N N 133 125.516 121.771 3.745 1
1 1389 . 5 1 1 A 136 136 TYR H H 134 9.058 8.369 0.689 1
1 1390 . 5 1 1 A 136 136 TYR HA H 134 4.970 5.185 -0.215 1
1 1394 . 5 1 1 A 136 136 TYR C C 134 172.324 173.252 -0.928 1
1 1395 . 5 1 1 A 136 136 TYR CA C 134 55.982 56.237 -0.255 1
1 1396 . 5 1 1 A 136 136 TYR CB C 134 42.265 40.591 1.674 1
1 1399 . 5 1 1 A 136 136 TYR N N 134 120.315 117.168 3.147 1
1 1400 . 5 1 1 A 137 137 ALA H H 135 8.521 8.758 -0.237 1
1 1401 . 5 1 1 A 137 137 ALA HA H 135 4.280 4.296 -0.016 1
1 1405 . 5 1 1 A 137 137 ALA C C 135 178.561 177.299 1.262 1
1 1406 . 5 1 1 A 137 137 ALA CA C 135 49.550 51.263 -1.713 1
1 1407 . 5 1 1 A 137 137 ALA CB C 135 19.998 22.085 -2.087 1
1 1408 . 5 1 1 A 137 137 ALA N N 135 123.386 121.410 1.976 1
1 1409 . 5 1 1 A 138 138 GLU H H 136 8.678 8.986 -0.308 1
1 1410 . 5 1 1 A 138 138 GLU HA H 136 3.777 4.160 -0.383 1
1 1414 . 5 1 1 A 138 138 GLU C C 136 177.624 178.268 -0.644 1
1 1415 . 5 1 1 A 138 138 GLU CA C 136 60.527 59.382 1.145 1
1 1416 . 5 1 1 A 138 138 GLU CB C 136 29.020 29.319 -0.299 1
1 1418 . 5 1 1 A 138 138 GLU N N 136 121.774 121.106 0.668 1
1 1419 . 5 1 1 A 139 139 GLY H H 137 8.666 8.326 0.340 1
1 1420 . 5 1 1 A 139 139 GLY HA2 H 137 3.872 3.991 -0.119 1
1 1421 . 5 1 1 A 139 139 GLY HA3 H 137 3.872 4.006 -0.134 1
1 1422 . 5 1 1 A 139 139 GLY C C 137 175.122 174.692 0.430 1
1 1423 . 5 1 1 A 139 139 GLY CA C 137 46.093 45.704 0.389 1
1 1424 . 5 1 1 A 139 139 GLY N N 137 106.053 108.177 -2.124 1
1 1425 . 5 1 1 A 140 140 GLU H H 138 8.305 9.501 -1.196 1
1 1426 . 5 1 1 A 140 140 GLU HA H 138 4.754 4.675 0.079 1
1 1430 . 5 1 1 A 140 140 GLU C C 138 177.819 177.709 0.110 1
1 1431 . 5 1 1 A 140 140 GLU CA C 138 55.049 55.861 -0.812 1
1 1432 . 5 1 1 A 140 140 GLU CB C 138 30.504 31.074 -0.570 1
1 1434 . 5 1 1 A 140 140 GLU N N 138 117.485 117.122 0.363 1
1 1435 . 5 1 1 A 141 141 VAL H H 139 7.267 7.683 -0.416 1
1 1436 . 5 1 1 A 141 141 VAL HA H 139 3.422 3.931 -0.509 1
1 1444 . 5 1 1 A 141 141 VAL C C 139 175.454 177.276 -1.822 1
1 1445 . 5 1 1 A 141 141 VAL CA C 139 66.769 65.039 1.730 1
1 1446 . 5 1 1 A 141 141 VAL CB C 139 31.377 31.372 0.005 1
1 1449 . 5 1 1 A 141 141 VAL N N 139 120.764 121.212 -0.448 1
1 1450 . 5 1 1 A 142 142 GLU H H 140 8.620 8.569 0.051 1
1 1451 . 5 1 1 A 142 142 GLU HA H 140 3.592 4.115 -0.523 1
1 1452 . 5 1 1 A 142 142 GLU C C 140 177.320 178.738 -1.418 1
1 1453 . 5 1 1 A 142 142 GLU CA C 140 62.607 58.750 3.857 1
1 1454 . 5 1 1 A 142 142 GLU CB C 140 26.759 28.883 -2.124 1
1 1455 . 5 1 1 A 142 142 GLU N N 140 120.048 119.549 0.499 1
1 1456 . 5 1 1 A 143 143 THR H H 141 7.449 8.126 -0.677 1
1 1457 . 5 1 1 A 143 143 THR HA H 141 4.003 3.998 0.005 1
1 1462 . 5 1 1 A 143 143 THR C C 141 177.258 175.502 1.756 1
1 1463 . 5 1 1 A 143 143 THR CA C 141 65.490 67.296 -1.806 1
1 1464 . 5 1 1 A 143 143 THR CB C 141 68.641 68.359 0.282 1
1 1466 . 5 1 1 A 143 143 THR N N 141 114.073 116.960 -2.887 1
1 1467 . 5 1 1 A 144 144 MET H H 142 7.992 8.319 -0.327 1
1 1468 . 5 1 1 A 144 144 MET HA H 142 4.316 4.301 0.015 1
1 1476 . 5 1 1 A 144 144 MET C C 142 178.233 178.826 -0.593 1
1 1477 . 5 1 1 A 144 144 MET CA C 142 57.743 58.959 -1.216 1
1 1478 . 5 1 1 A 144 144 MET CB C 142 31.326 32.264 -0.938 1
1 1481 . 5 1 1 A 144 144 MET N N 142 120.595 119.348 1.247 1
1 1482 . 5 1 1 A 145 145 LEU H H 143 7.847 8.094 -0.247 1
1 1483 . 5 1 1 A 145 145 LEU HA H 143 3.919 3.819 0.100 1
1 1491 . 5 1 1 A 145 145 LEU C C 143 178.774 179.160 -0.386 1
1 1492 . 5 1 1 A 145 145 LEU CA C 143 57.877 57.813 0.064 1
1 1493 . 5 1 1 A 145 145 LEU CB C 143 40.951 41.159 -0.208 1
1 1497 . 5 1 1 A 145 145 LEU N N 143 119.410 119.687 -0.277 1
1 1498 . 5 1 1 A 146 146 ASP H H 144 8.431 8.797 -0.366 1
1 1499 . 5 1 1 A 146 146 ASP HA H 144 4.312 4.563 -0.251 1
1 1502 . 5 1 1 A 146 146 ASP C C 144 178.129 178.922 -0.793 1
1 1503 . 5 1 1 A 146 146 ASP CA C 144 57.464 58.056 -0.592 1
1 1504 . 5 1 1 A 146 146 ASP CB C 144 39.548 41.235 -1.687 1
1 1505 . 5 1 1 A 146 146 ASP N N 144 119.837 119.979 -0.142 1
1 1506 . 5 1 1 A 147 147 ARG H H 145 7.949 8.591 -0.642 1
1 1507 . 5 1 1 A 147 147 ARG HA H 145 4.050 4.155 -0.105 1
1 1512 . 5 1 1 A 147 147 ARG C C 145 179.547 179.018 0.529 1
1 1513 . 5 1 1 A 147 147 ARG CA C 145 58.972 59.540 -0.568 1
1 1514 . 5 1 1 A 147 147 ARG CB C 145 29.798 30.685 -0.887 1
1 1517 . 5 1 1 A 147 147 ARG N N 145 119.173 119.271 -0.098 1
1 1518 . 5 1 1 A 148 148 TYR H H 146 8.128 8.141 -0.013 1
1 1519 . 5 1 1 A 148 148 TYR HA H 146 3.995 4.332 -0.337 1
1 1524 . 5 1 1 A 148 148 TYR C C 146 178.199 177.593 0.606 1
1 1525 . 5 1 1 A 148 148 TYR CA C 146 62.347 61.383 0.964 1
1 1526 . 5 1 1 A 148 148 TYR CB C 146 37.418 37.539 -0.121 1
1 1529 . 5 1 1 A 148 148 TYR N N 146 120.102 121.224 -1.122 1
1 1530 . 5 1 1 A 149 149 PHE H H 147 8.308 8.715 -0.407 1
1 1531 . 5 1 1 A 149 149 PHE HA H 147 4.013 4.146 -0.133 1
1 1535 . 5 1 1 A 149 149 PHE C C 147 177.574 178.312 -0.738 1
1 1536 . 5 1 1 A 149 149 PHE CA C 147 63.044 61.652 1.392 1
1 1537 . 5 1 1 A 149 149 PHE CB C 147 37.153 38.242 -1.089 1
1 1541 . 5 1 1 A 149 149 PHE N N 147 116.680 118.427 -1.747 1
1 1542 . 5 1 1 A 150 150 GLU H H 148 8.271 8.796 -0.525 1
1 1543 . 5 1 1 A 150 150 GLU HA H 148 4.030 4.011 0.019 1
1 1547 . 5 1 1 A 150 150 GLU C C 148 177.687 178.675 -0.988 1
1 1548 . 5 1 1 A 150 150 GLU CA C 148 58.746 59.428 -0.682 1
1 1549 . 5 1 1 A 150 150 GLU CB C 148 28.847 28.993 -0.146 1
1 1551 . 5 1 1 A 150 150 GLU N N 148 119.973 119.701 0.272 1
1 1552 . 5 1 1 A 151 151 ALA H H 149 6.992 7.589 -0.597 1
1 1553 . 5 1 1 A 151 151 ALA HA H 149 4.217 4.160 0.057 1
1 1557 . 5 1 1 A 151 151 ALA C C 149 178.190 177.264 0.926 1
1 1558 . 5 1 1 A 151 151 ALA CA C 149 52.779 54.328 -1.549 1
1 1559 . 5 1 1 A 151 151 ALA CB C 149 19.087 18.681 0.406 1
1 1560 . 5 1 1 A 151 151 ALA N N 149 118.629 121.593 -2.964 1
1 1561 . 5 1 1 A 152 152 TYR H H 150 7.722 7.623 0.099 1
1 1562 . 5 1 1 A 152 152 TYR HA H 150 4.137 4.795 -0.658 1
1 1567 . 5 1 1 A 152 152 TYR C C 150 175.703 174.236 1.467 1
1 1568 . 5 1 1 A 152 152 TYR CA C 150 59.260 57.254 2.006 1
1 1569 . 5 1 1 A 152 152 TYR CB C 150 39.165 40.581 -1.416 1
1 1572 . 5 1 1 A 152 152 TYR N N 150 118.767 111.989 6.778 1
1 1573 . 5 1 1 A 153 153 LEU H H 151 7.670 8.562 -0.892 1
1 1574 . 5 1 1 A 153 153 LEU HA H 151 4.145 4.532 -0.387 1
1 1584 . 5 1 1 A 153 153 LEU CA C 151 54.704 51.123 3.581 1
1 1585 . 5 1 1 A 153 153 LEU CB C 151 40.520 42.390 -1.870 1
1 1589 . 5 1 1 A 153 153 LEU N N 151 122.313 121.799 0.514 1
1 1590 . 5 1 1 A 154 154 PRO HA H 152 4.258 4.302 -0.044 1
1 1597 . 5 1 1 A 154 154 PRO C C 152 177.496 178.483 -0.987 1
1 1598 . 5 1 1 A 154 154 PRO CA C 152 63.899 65.428 -1.529 1
1 1599 . 5 1 1 A 154 154 PRO CB C 152 31.080 31.363 -0.283 1
1 1602 . 5 1 1 A 155 155 GLN H H 153 8.023 8.295 -0.272 1
1 1603 . 5 1 1 A 155 155 GLN HA H 153 4.176 3.982 0.194 1
1 1607 . 5 1 1 A 155 155 GLN C C 153 176.636 179.365 -2.729 1
1 1608 . 5 1 1 A 155 155 GLN CA C 153 55.968 58.832 -2.864 1
1 1609 . 5 1 1 A 155 155 GLN CB C 153 28.723 27.950 0.773 1
1 1610 . 5 1 1 A 155 155 GLN N N 153 119.173 117.766 1.407 1
1 1611 . 5 1 1 A 156 156 LYS H H 154 8.113 7.879 0.234 1
1 1612 . 5 1 1 A 156 156 LYS HA H 154 4.196 4.082 0.114 1
1 1619 . 5 1 1 A 156 156 LYS C C 154 56.493 178.453 -121.960 1
1 1620 . 5 1 1 A 156 156 LYS CA C 154 56.493 58.761 -2.268 1
1 1621 . 5 1 1 A 156 156 LYS CB C 154 32.037 32.289 -0.252 1
1 1625 . 5 1 1 A 156 156 LYS N N 154 122.788 121.621 1.167 1
1 1626 . 5 1 1 A 157 157 THR H H 155 8.013 7.535 0.478 1
1 1627 . 5 1 1 A 157 157 THR HA H 155 4.183 3.784 0.399 1
1 1632 . 5 1 1 A 157 157 THR C C 155 174.580 174.801 -0.221 1
1 1633 . 5 1 1 A 157 157 THR CA C 155 61.958 66.060 -4.102 1
1 1634 . 5 1 1 A 157 157 THR CB C 155 69.665 68.422 1.243 1
1 1636 . 5 1 1 A 157 157 THR N N 155 115.504 113.283 2.221 1
1 1637 . 5 1 1 A 158 158 ALA H H 156 8.170 7.366 0.804 1
1 1638 . 5 1 1 A 158 158 ALA HA H 156 4.220 4.573 -0.353 1
1 1642 . 5 1 1 A 158 158 ALA CA C 156 52.492 51.660 0.832 1
1 1643 . 5 1 1 A 158 158 ALA CB C 156 18.810 22.337 -3.527 1
1 1644 . 5 1 1 A 158 158 ALA N N 156 126.825 119.733 7.092 1
1 1645 . 5 1 1 A 159 159 SER H H 157 7.762 8.562 -0.800 1
1 1646 . 5 1 1 A 159 159 SER CA C 157 58.230 57.491 0.739 1
1 1647 . 5 1 1 A 159 159 SER CB C 157 63.440 66.180 -2.740 1
1 1648 . 5 1 1 A 159 159 SER N N 157 123.078 116.569 6.509 1
1 1649 . 5 1 1 A 162 162 HIS HA H 160 4.845 4.717 0.128 1
1 1652 . 5 1 1 A 162 162 HIS CA C 160 53.590 54.212 -0.622 1
1 1653 . 5 1 1 A 162 162 HIS CB C 160 29.398 30.130 -0.732 1
1 1654 . 5 1 1 A 163 163 PRO HA H 161 4.388 4.469 -0.081 1
1 1660 . 5 1 1 A 163 163 PRO C C 161 177.018 177.589 -0.571 1
1 1661 . 5 1 1 A 163 163 PRO CA C 161 63.118 62.881 0.237 1
1 1662 . 5 1 1 A 163 163 PRO CB C 161 31.668 32.904 -1.236 1
1 1665 . 5 1 1 A 164 164 SER H H 162 8.418 8.786 -0.368 1
1 1666 . 5 1 1 A 164 164 SER HA H 162 4.338 4.171 0.167 1
1 1668 . 5 1 1 A 164 164 SER C C 162 173.327 176.416 -3.089 1
1 1669 . 5 1 1 A 164 164 SER CA C 162 58.202 60.488 -2.286 1
1 1670 . 5 1 1 A 164 164 SER CB C 162 64.080 62.900 1.180 1
1 1671 . 5 1 1 A 164 164 SER N N 162 117.485 117.888 -0.403 1
1 6 . 6 1 1 A 4 4 ALA H H 2 8.270 7.442 0.828 1
1 7 . 6 1 1 A 4 4 ALA HA H 2 4.212 4.302 -0.090 1
1 11 . 6 1 1 A 4 4 ALA C C 2 177.441 177.293 0.148 1
1 12 . 6 1 1 A 4 4 ALA CA C 2 52.280 52.598 -0.318 1
1 13 . 6 1 1 A 4 4 ALA CB C 2 18.880 19.447 -0.567 1
1 14 . 6 1 1 A 4 4 ALA N N 2 126.500 122.813 3.687 1
1 15 . 6 1 1 A 5 5 ALA H H 3 8.251 8.324 -0.073 1
1 16 . 6 1 1 A 5 5 ALA HA H 3 4.261 4.268 -0.007 1
1 20 . 6 1 1 A 5 5 ALA C C 3 177.824 177.763 0.061 1
1 21 . 6 1 1 A 5 5 ALA CA C 3 52.347 52.578 -0.231 1
1 22 . 6 1 1 A 5 5 ALA CB C 3 18.869 19.004 -0.135 1
1 23 . 6 1 1 A 5 5 ALA N N 3 124.322 124.497 -0.175 1
1 24 . 6 1 1 A 6 6 SER H H 4 8.158 8.676 -0.518 1
1 25 . 6 1 1 A 6 6 SER HA H 4 4.358 4.236 0.122 1
1 27 . 6 1 1 A 6 6 SER C C 4 175.222 175.054 0.168 1
1 28 . 6 1 1 A 6 6 SER CA C 4 58.438 59.788 -1.350 1
1 29 . 6 1 1 A 6 6 SER CB C 4 63.859 63.723 0.136 1
1 30 . 6 1 1 A 6 6 SER N N 4 115.338 117.189 -1.851 1
1 31 . 6 1 1 A 7 7 GLY H H 5 8.265 8.681 -0.416 1
1 32 . 6 1 1 A 7 7 GLY HA2 H 5 3.900 4.026 -0.126 1
1 33 . 6 1 1 A 7 7 GLY C C 5 174.083 173.265 0.818 1
1 34 . 6 1 1 A 7 7 GLY CA C 5 45.113 44.672 0.441 1
1 35 . 6 1 1 A 7 7 GLY N N 5 111.360 111.202 0.158 1
1 36 . 6 1 1 A 8 8 GLU H H 6 8.100 8.400 -0.300 1
1 37 . 6 1 1 A 8 8 GLU HA H 6 4.209 4.646 -0.437 1
1 41 . 6 1 1 A 8 8 GLU C C 6 176.354 176.106 0.248 1
1 42 . 6 1 1 A 8 8 GLU CA C 6 56.261 55.486 0.775 1
1 43 . 6 1 1 A 8 8 GLU CB C 6 29.830 31.302 -1.472 1
1 45 . 6 1 1 A 8 8 GLU N N 6 121.056 120.502 0.554 1
1 46 . 6 1 1 A 9 9 GLN H H 7 8.287 8.760 -0.473 1
1 47 . 6 1 1 A 9 9 GLN HA H 7 4.247 4.054 0.193 1
1 51 . 6 1 1 A 9 9 GLN C C 7 172.457 174.517 -2.060 1
1 52 . 6 1 1 A 9 9 GLN CA C 7 55.269 57.956 -2.687 1
1 53 . 6 1 1 A 9 9 GLN CB C 7 29.236 27.403 1.833 1
1 55 . 6 1 1 A 9 9 GLN N N 7 122.164 123.971 -1.807 1
1 56 . 6 1 1 A 10 10 ALA H H 8 8.368 8.440 -0.072 1
1 57 . 6 1 1 A 10 10 ALA HA H 8 4.509 4.732 -0.223 1
1 61 . 6 1 1 A 10 10 ALA CA C 8 50.341 50.342 -0.001 1
1 62 . 6 1 1 A 10 10 ALA CB C 8 18.140 22.170 -4.030 1
1 63 . 6 1 1 A 10 10 ALA N N 8 128.028 121.049 6.979 1
1 64 . 6 1 1 A 11 11 PRO HA H 9 4.437 4.635 -0.198 1
1 70 . 6 1 1 A 11 11 PRO C C 9 176.381 176.389 -0.008 1
1 71 . 6 1 1 A 11 11 PRO CA C 9 63.298 62.341 0.957 1
1 72 . 6 1 1 A 11 11 PRO CB C 9 31.776 32.956 -1.180 1
1 75 . 6 1 1 A 12 12 CYS H H 10 8.056 8.294 -0.238 1
1 76 . 6 1 1 A 12 12 CYS HA H 10 4.717 4.919 -0.202 1
1 79 . 6 1 1 A 12 12 CYS C C 10 173.266 174.278 -1.012 1
1 80 . 6 1 1 A 12 12 CYS CA C 10 57.398 57.271 0.127 1
1 81 . 6 1 1 A 12 12 CYS CB C 10 29.165 29.791 -0.626 1
1 82 . 6 1 1 A 12 12 CYS N N 10 118.295 117.642 0.653 1
1 83 . 6 1 1 A 13 13 SER H H 11 9.815 8.842 0.973 1
1 84 . 6 1 1 A 13 13 SER HA H 11 5.227 5.656 -0.429 1
1 87 . 6 1 1 A 13 13 SER C C 11 173.648 173.819 -0.171 1
1 88 . 6 1 1 A 13 13 SER CA C 11 57.630 55.940 1.690 1
1 89 . 6 1 1 A 13 13 SER CB C 11 64.820 66.433 -1.613 1
1 90 . 6 1 1 A 13 13 SER N N 11 122.365 113.737 8.628 1
1 91 . 6 1 1 A 14 14 VAL H H 12 9.352 9.582 -0.230 1
1 92 . 6 1 1 A 14 14 VAL HA H 12 4.696 5.256 -0.560 1
1 100 . 6 1 1 A 14 14 VAL C C 12 173.875 173.926 -0.051 1
1 101 . 6 1 1 A 14 14 VAL CA C 12 60.146 61.055 -0.909 1
1 102 . 6 1 1 A 14 14 VAL CB C 12 34.499 35.081 -0.582 1
1 105 . 6 1 1 A 14 14 VAL N N 12 126.378 121.856 4.522 1
1 106 . 6 1 1 A 15 15 TYR H H 13 8.745 9.408 -0.663 1
1 111 . 6 1 1 A 15 15 TYR C C 13 173.345 174.044 -0.699 1
1 112 . 6 1 1 A 15 15 TYR CA C 13 56.186 56.072 0.114 1
1 113 . 6 1 1 A 15 15 TYR CB C 13 40.858 39.505 1.353 1
1 116 . 6 1 1 A 15 15 TYR N N 13 129.472 128.352 1.120 1
1 117 . 6 1 1 A 16 16 PHE H H 14 7.370 9.098 -1.728 1
1 118 . 6 1 1 A 16 16 PHE HA H 14 5.720 5.056 0.664 1
1 123 . 6 1 1 A 16 16 PHE C C 14 174.058 174.057 0.001 1
1 124 . 6 1 1 A 16 16 PHE CA C 14 54.361 57.307 -2.946 1
1 125 . 6 1 1 A 16 16 PHE CB C 14 40.461 40.128 0.333 1
1 129 . 6 1 1 A 16 16 PHE N N 14 128.263 128.946 -0.683 1
1 130 . 6 1 1 A 17 17 CYS H H 15 8.147 8.052 0.095 1
1 131 . 6 1 1 A 17 17 CYS CA C 15 56.570 57.379 -0.809 1
1 132 . 6 1 1 A 17 17 CYS CB C 15 29.690 31.580 -1.890 1
1 133 . 6 1 1 A 17 17 CYS N N 15 126.188 124.709 1.479 1
1 134 . 6 1 1 A 18 18 GLY HA2 H 16 3.819 3.359 0.460 1
1 135 . 6 1 1 A 18 18 GLY C C 16 173.374 172.062 1.312 1
1 136 . 6 1 1 A 18 18 GLY CA C 16 45.510 45.388 0.122 1
1 137 . 6 1 1 A 19 19 SER H H 17 8.533 9.766 -1.233 1
1 138 . 6 1 1 A 19 19 SER HA H 17 4.505 4.976 -0.471 1
1 139 . 6 1 1 A 19 19 SER CA C 17 58.700 58.013 0.687 1
1 140 . 6 1 1 A 19 19 SER CB C 17 63.810 63.971 -0.161 1
1 141 . 6 1 1 A 19 19 SER N N 17 117.300 114.874 2.426 1
1 142 . 6 1 1 A 20 20 ILE HA H 18 4.309 4.909 -0.600 1
1 152 . 6 1 1 A 20 20 ILE CA C 18 61.317 60.131 1.186 1
1 153 . 6 1 1 A 20 20 ILE CB C 18 38.302 41.902 -3.600 1
1 157 . 6 1 1 A 21 21 ARG HA H 19 4.172 4.628 -0.456 1
1 160 . 6 1 1 A 21 21 ARG C C 19 177.118 175.706 1.412 1
1 161 . 6 1 1 A 21 21 ARG CA C 19 56.960 55.755 1.205 1
1 162 . 6 1 1 A 21 21 ARG CB C 19 29.568 32.597 -3.029 1
1 165 . 6 1 1 A 22 22 GLY H H 20 8.685 7.375 1.310 1
1 166 . 6 1 1 A 22 22 GLY HA2 H 20 3.801 4.140 -0.339 1
1 167 . 6 1 1 A 22 22 GLY HA3 H 20 3.923 4.143 -0.220 1
1 168 . 6 1 1 A 22 22 GLY C C 20 174.814 174.827 -0.013 1
1 169 . 6 1 1 A 22 22 GLY CA C 20 45.289 45.520 -0.231 1
1 170 . 6 1 1 A 22 22 GLY N N 20 110.145 107.329 2.816 1
1 171 . 6 1 1 A 23 23 GLY H H 21 8.058 8.912 -0.854 1
1 172 . 6 1 1 A 23 23 GLY HA2 H 21 3.998 3.821 0.177 1
1 173 . 6 1 1 A 23 23 GLY HA3 H 21 4.237 3.821 0.416 1
1 174 . 6 1 1 A 23 23 GLY C C 21 174.762 173.833 0.929 1
1 175 . 6 1 1 A 23 23 GLY CA C 21 45.025 46.465 -1.440 1
1 176 . 6 1 1 A 23 23 GLY N N 21 109.327 115.719 -6.392 1
1 177 . 6 1 1 A 24 24 ARG H H 22 8.376 8.565 -0.189 1
1 178 . 6 1 1 A 24 24 ARG HA H 22 4.086 4.489 -0.403 1
1 184 . 6 1 1 A 24 24 ARG C C 22 178.178 176.107 2.071 1
1 185 . 6 1 1 A 24 24 ARG CA C 22 57.471 56.274 1.197 1
1 186 . 6 1 1 A 24 24 ARG CB C 22 29.653 31.057 -1.404 1
1 189 . 6 1 1 A 24 24 ARG N N 22 120.861 119.694 1.167 1
1 190 . 6 1 1 A 25 25 GLU H H 23 8.831 9.007 -0.176 1
1 191 . 6 1 1 A 25 25 GLU HA H 23 4.015 3.984 0.031 1
1 195 . 6 1 1 A 25 25 GLU C C 23 178.005 178.174 -0.169 1
1 196 . 6 1 1 A 25 25 GLU CA C 23 58.920 59.129 -0.209 1
1 197 . 6 1 1 A 25 25 GLU CB C 23 28.592 29.544 -0.952 1
1 199 . 6 1 1 A 25 25 GLU N N 23 121.243 123.824 -2.581 1
1 200 . 6 1 1 A 26 26 ASP H H 24 7.897 7.897 0.000 1
1 201 . 6 1 1 A 26 26 ASP HA H 24 4.516 4.193 0.323 1
1 203 . 6 1 1 A 26 26 ASP C C 24 176.455 178.581 -2.126 1
1 204 . 6 1 1 A 26 26 ASP CA C 24 55.122 56.329 -1.207 1
1 205 . 6 1 1 A 26 26 ASP CB C 24 39.888 39.925 -0.037 1
1 206 . 6 1 1 A 26 26 ASP N N 24 119.541 120.082 -0.541 1
1 207 . 6 1 1 A 27 27 GLN H H 25 7.696 8.437 -0.741 1
1 208 . 6 1 1 A 27 27 GLN HA H 25 3.704 3.785 -0.081 1
1 212 . 6 1 1 A 27 27 GLN C C 25 177.016 178.555 -1.539 1
1 213 . 6 1 1 A 27 27 GLN CA C 25 59.501 58.554 0.947 1
1 214 . 6 1 1 A 27 27 GLN CB C 25 27.762 28.405 -0.643 1
1 216 . 6 1 1 A 27 27 GLN N N 25 119.471 119.016 0.455 1
1 217 . 6 1 1 A 28 28 ALA H H 26 8.227 7.450 0.777 1
1 218 . 6 1 1 A 28 28 ALA HA H 26 4.072 4.152 -0.080 1
1 222 . 6 1 1 A 28 28 ALA C C 26 180.567 179.854 0.713 1
1 223 . 6 1 1 A 28 28 ALA CA C 26 54.627 54.978 -0.351 1
1 224 . 6 1 1 A 28 28 ALA CB C 26 17.355 18.376 -1.021 1
1 225 . 6 1 1 A 28 28 ALA N N 26 122.362 122.533 -0.171 1
1 226 . 6 1 1 A 29 29 LEU H H 27 7.533 8.129 -0.596 1
1 227 . 6 1 1 A 29 29 LEU HA H 27 4.050 4.059 -0.009 1
1 237 . 6 1 1 A 29 29 LEU C C 27 178.752 178.234 0.518 1
1 238 . 6 1 1 A 29 29 LEU CA C 27 57.578 57.595 -0.017 1
1 239 . 6 1 1 A 29 29 LEU CB C 27 40.734 41.603 -0.869 1
1 243 . 6 1 1 A 29 29 LEU N N 27 122.255 119.859 2.396 1
1 244 . 6 1 1 A 30 30 TYR H H 28 8.473 8.390 0.083 1
1 245 . 6 1 1 A 30 30 TYR HA H 28 4.049 4.231 -0.182 1
1 250 . 6 1 1 A 30 30 TYR C C 28 177.736 178.719 -0.983 1
1 251 . 6 1 1 A 30 30 TYR CA C 28 59.817 60.158 -0.341 1
1 252 . 6 1 1 A 30 30 TYR CB C 28 36.140 37.206 -1.066 1
1 255 . 6 1 1 A 30 30 TYR N N 28 120.403 118.578 1.825 1
1 256 . 6 1 1 A 31 31 ALA H H 29 8.008 8.288 -0.280 1
1 257 . 6 1 1 A 31 31 ALA HA H 29 4.005 4.121 -0.116 1
1 261 . 6 1 1 A 31 31 ALA C C 29 180.879 179.506 1.373 1
1 262 . 6 1 1 A 31 31 ALA CA C 29 54.914 55.212 -0.298 1
1 263 . 6 1 1 A 31 31 ALA CB C 29 17.375 18.151 -0.776 1
1 264 . 6 1 1 A 31 31 ALA N N 29 120.771 123.011 -2.240 1
1 265 . 6 1 1 A 32 32 ARG H H 30 7.596 7.606 -0.010 1
1 266 . 6 1 1 A 32 32 ARG HA H 30 3.916 4.084 -0.168 1
1 273 . 6 1 1 A 32 32 ARG C C 30 179.919 178.590 1.329 1
1 274 . 6 1 1 A 32 32 ARG CA C 30 59.014 58.919 0.095 1
1 275 . 6 1 1 A 32 32 ARG CB C 30 30.531 29.858 0.673 1
1 278 . 6 1 1 A 32 32 ARG N N 30 120.365 117.942 2.423 1
1 279 . 6 1 1 A 33 33 ILE H H 31 8.066 8.627 -0.561 1
1 280 . 6 1 1 A 33 33 ILE HA H 31 3.120 3.535 -0.415 1
1 290 . 6 1 1 A 33 33 ILE C C 31 177.051 178.112 -1.061 1
1 291 . 6 1 1 A 33 33 ILE CA C 31 65.757 65.250 0.507 1
1 292 . 6 1 1 A 33 33 ILE CB C 31 36.928 37.727 -0.799 1
1 296 . 6 1 1 A 33 33 ILE N N 31 121.608 119.737 1.871 1
1 297 . 6 1 1 A 34 34 VAL H H 32 8.148 8.775 -0.627 1
1 298 . 6 1 1 A 34 34 VAL HA H 32 2.954 3.186 -0.232 1
1 306 . 6 1 1 A 34 34 VAL C C 32 177.159 177.888 -0.729 1
1 307 . 6 1 1 A 34 34 VAL CA C 32 67.220 66.098 1.122 1
1 308 . 6 1 1 A 34 34 VAL CB C 32 31.039 31.148 -0.109 1
1 311 . 6 1 1 A 34 34 VAL N N 32 119.318 120.052 -0.734 1
1 312 . 6 1 1 A 35 35 SER H H 33 7.826 8.176 -0.350 1
1 313 . 6 1 1 A 35 35 SER HA H 33 3.868 4.066 -0.198 1
1 316 . 6 1 1 A 35 35 SER C C 33 176.779 177.086 -0.307 1
1 317 . 6 1 1 A 35 35 SER CA C 33 62.000 61.492 0.508 1
1 318 . 6 1 1 A 35 35 SER CB C 33 62.789 62.366 0.423 1
1 319 . 6 1 1 A 35 35 SER N N 33 111.936 114.696 -2.760 1
1 320 . 6 1 1 A 36 36 ARG H H 34 7.405 7.415 -0.010 1
1 321 . 6 1 1 A 36 36 ARG HA H 34 4.070 4.069 0.001 1
1 323 . 6 1 1 A 36 36 ARG C C 34 178.047 178.281 -0.234 1
1 324 . 6 1 1 A 36 36 ARG CA C 34 56.108 58.964 -2.856 1
1 325 . 6 1 1 A 36 36 ARG CB C 34 28.837 30.163 -1.326 1
1 326 . 6 1 1 A 36 36 ARG N N 34 120.909 122.540 -1.631 1
1 327 . 6 1 1 A 37 37 LEU H H 35 8.301 8.117 0.184 1
1 328 . 6 1 1 A 37 37 LEU HA H 35 3.620 3.658 -0.038 1
1 336 . 6 1 1 A 37 37 LEU C C 35 178.446 179.112 -0.666 1
1 337 . 6 1 1 A 37 37 LEU CA C 35 57.640 57.858 -0.218 1
1 338 . 6 1 1 A 37 37 LEU CB C 35 41.584 41.295 0.289 1
1 342 . 6 1 1 A 37 37 LEU N N 35 118.567 119.776 -1.209 1
1 343 . 6 1 1 A 38 38 ARG H H 36 7.379 8.140 -0.761 1
1 344 . 6 1 1 A 38 38 ARG HA H 36 4.340 3.952 0.388 1
1 350 . 6 1 1 A 38 38 ARG C C 36 177.895 178.569 -0.674 1
1 351 . 6 1 1 A 38 38 ARG CA C 36 57.785 59.008 -1.223 1
1 352 . 6 1 1 A 38 38 ARG CB C 36 29.775 29.664 0.111 1
1 355 . 6 1 1 A 38 38 ARG N N 36 115.352 119.385 -4.033 1
1 356 . 6 1 1 A 39 39 ARG H H 37 7.240 7.756 -0.516 1
1 357 . 6 1 1 A 39 39 ARG HA H 37 3.743 4.163 -0.420 1
1 363 . 6 1 1 A 39 39 ARG C C 37 176.988 178.575 -1.587 1
1 364 . 6 1 1 A 39 39 ARG CA C 37 57.605 58.182 -0.577 1
1 365 . 6 1 1 A 39 39 ARG CB C 37 28.925 30.365 -1.440 1
1 368 . 6 1 1 A 39 39 ARG N N 37 117.410 118.910 -1.500 1
1 369 . 6 1 1 A 40 40 TYR H H 38 7.296 8.135 -0.839 1
1 370 . 6 1 1 A 40 40 TYR HA H 38 4.319 4.207 0.112 1
1 375 . 6 1 1 A 40 40 TYR C C 38 175.001 176.122 -1.121 1
1 376 . 6 1 1 A 40 40 TYR CA C 38 57.730 60.259 -2.529 1
1 377 . 6 1 1 A 40 40 TYR CB C 38 39.343 38.108 1.235 1
1 380 . 6 1 1 A 40 40 TYR N N 38 116.937 118.570 -1.633 1
1 381 . 6 1 1 A 41 41 GLY H H 39 7.325 7.922 -0.597 1
1 382 . 6 1 1 A 41 41 GLY HA2 H 39 3.953 4.072 -0.119 1
1 383 . 6 1 1 A 41 41 GLY C C 39 171.302 172.474 -1.172 1
1 384 . 6 1 1 A 41 41 GLY CA C 39 45.590 45.125 0.465 1
1 385 . 6 1 1 A 41 41 GLY N N 39 105.596 104.369 1.227 1
1 386 . 6 1 1 A 42 42 LYS H H 40 8.186 8.904 -0.718 1
1 387 . 6 1 1 A 42 42 LYS HA H 40 4.205 4.620 -0.415 1
1 393 . 6 1 1 A 42 42 LYS C C 40 175.672 175.444 0.228 1
1 394 . 6 1 1 A 42 42 LYS CA C 40 55.241 55.505 -0.264 1
1 395 . 6 1 1 A 42 42 LYS CB C 40 32.889 34.109 -1.220 1
1 399 . 6 1 1 A 42 42 LYS N N 40 120.341 121.650 -1.309 1
1 400 . 6 1 1 A 43 43 VAL H H 41 8.610 8.807 -0.197 1
1 401 . 6 1 1 A 43 43 VAL HA H 41 4.416 4.214 0.202 1
1 409 . 6 1 1 A 43 43 VAL C C 41 175.997 175.360 0.637 1
1 410 . 6 1 1 A 43 43 VAL CA C 41 61.331 62.825 -1.494 1
1 411 . 6 1 1 A 43 43 VAL CB C 41 30.573 31.131 -0.558 1
1 414 . 6 1 1 A 43 43 VAL N N 41 127.312 124.399 2.913 1
1 415 . 6 1 1 A 44 44 LEU H H 42 8.894 8.363 0.531 1
1 416 . 6 1 1 A 44 44 LEU HA H 42 4.496 3.392 1.104 1
1 424 . 6 1 1 A 44 44 LEU CA C 42 54.522 56.802 -2.280 1
1 425 . 6 1 1 A 44 44 LEU CB C 42 40.980 41.661 -0.681 1
1 429 . 6 1 1 A 44 44 LEU N N 42 130.261 127.824 2.437 1
1 430 . 6 1 1 A 45 45 THR HA H 43 4.263 4.120 0.143 1
1 435 . 6 1 1 A 45 45 THR CA C 43 61.033 62.021 -0.988 1
1 436 . 6 1 1 A 45 45 THR CB C 43 69.768 68.973 0.795 1
1 440 . 6 1 1 A 46 46 GLU CA C 44 56.411 59.532 -3.121 1
1 441 . 6 1 1 A 46 46 GLU CB C 44 29.827 29.189 0.638 1
1 443 . 6 1 1 A 47 47 HIS HA H 45 4.549 4.282 0.267 1
1 447 . 6 1 1 A 47 47 HIS C C 45 174.812 176.751 -1.939 1
1 448 . 6 1 1 A 47 47 HIS CA C 45 56.107 58.837 -2.730 1
1 449 . 6 1 1 A 47 47 HIS CB C 45 29.080 28.667 0.413 1
1 451 . 6 1 1 A 48 48 VAL H H 46 7.826 8.342 -0.516 1
1 452 . 6 1 1 A 48 48 VAL HA H 46 4.024 2.879 1.145 1
1 460 . 6 1 1 A 48 48 VAL C C 46 175.697 177.954 -2.257 1
1 461 . 6 1 1 A 48 48 VAL CA C 46 61.841 66.286 -4.445 1
1 462 . 6 1 1 A 48 48 VAL CB C 46 32.600 31.317 1.283 1
1 465 . 6 1 1 A 48 48 VAL N N 46 121.117 119.517 1.600 1
1 466 . 6 1 1 A 49 49 ALA H H 47 8.237 8.350 -0.113 1
1 467 . 6 1 1 A 49 49 ALA HA H 47 4.281 4.105 0.176 1
1 471 . 6 1 1 A 49 49 ALA C C 47 177.173 179.922 -2.749 1
1 472 . 6 1 1 A 49 49 ALA CA C 47 52.207 55.463 -3.256 1
1 473 . 6 1 1 A 49 49 ALA CB C 47 19.064 17.921 1.143 1
1 474 . 6 1 1 A 49 49 ALA N N 47 126.817 121.426 5.391 1
1 475 . 6 1 1 A 50 50 ASP H H 48 8.029 8.503 -0.474 1
1 476 . 6 1 1 A 50 50 ASP HA H 48 4.436 4.507 -0.071 1
1 479 . 6 1 1 A 50 50 ASP C C 48 176.124 177.433 -1.309 1
1 480 . 6 1 1 A 50 50 ASP CA C 48 54.447 55.278 -0.831 1
1 481 . 6 1 1 A 50 50 ASP CB C 48 40.877 39.322 1.555 1
1 482 . 6 1 1 A 50 50 ASP N N 48 119.687 117.907 1.780 1
1 483 . 6 1 1 A 51 51 ALA H H 49 8.094 8.284 -0.190 1
1 484 . 6 1 1 A 51 51 ALA HA H 49 4.134 4.048 0.086 1
1 488 . 6 1 1 A 51 51 ALA C C 49 177.835 180.529 -2.694 1
1 489 . 6 1 1 A 51 51 ALA CA C 49 52.900 55.066 -2.166 1
1 490 . 6 1 1 A 51 51 ALA CB C 49 18.942 18.373 0.569 1
1 491 . 6 1 1 A 51 51 ALA N N 49 124.400 124.001 0.399 1
1 492 . 6 1 1 A 52 52 GLU H H 50 8.243 8.012 0.231 1
1 493 . 6 1 1 A 52 52 GLU HA H 50 4.152 4.094 0.058 1
1 497 . 6 1 1 A 52 52 GLU C C 50 176.456 177.667 -1.211 1
1 498 . 6 1 1 A 52 52 GLU CA C 50 56.480 59.373 -2.893 1
1 499 . 6 1 1 A 52 52 GLU CB C 50 29.470 29.271 0.199 1
1 501 . 6 1 1 A 52 52 GLU N N 50 118.917 118.447 0.470 1
1 502 . 6 1 1 A 53 53 LEU H H 51 7.839 7.492 0.347 1
1 503 . 6 1 1 A 53 53 LEU HA H 51 4.229 4.324 -0.095 1
1 513 . 6 1 1 A 53 53 LEU C C 51 177.058 177.332 -0.274 1
1 514 . 6 1 1 A 53 53 LEU CA C 51 54.625 55.707 -1.082 1
1 515 . 6 1 1 A 53 53 LEU CB C 51 42.125 41.745 0.380 1
1 519 . 6 1 1 A 53 53 LEU N N 51 122.169 121.843 0.326 1
1 520 . 6 1 1 A 54 54 GLU H H 52 8.104 8.773 -0.669 1
1 521 . 6 1 1 A 54 54 GLU HA H 52 4.470 4.344 0.126 1
1 525 . 6 1 1 A 54 54 GLU CA C 52 54.286 58.411 -4.125 1
1 526 . 6 1 1 A 54 54 GLU CB C 52 29.268 28.688 0.580 1
1 528 . 6 1 1 A 54 54 GLU N N 52 123.040 120.113 2.927 1
1 529 . 6 1 1 A 55 55 PRO HA H 53 4.310 4.468 -0.158 1
1 536 . 6 1 1 A 55 55 PRO C C 53 177.019 176.612 0.407 1
1 537 . 6 1 1 A 55 55 PRO CA C 53 63.075 63.465 -0.390 1
1 538 . 6 1 1 A 55 55 PRO CB C 53 31.329 32.512 -1.183 1
1 541 . 6 1 1 A 56 56 LEU H H 54 8.263 8.454 -0.191 1
1 542 . 6 1 1 A 56 56 LEU HA H 54 4.237 4.237 0.000 1
1 552 . 6 1 1 A 56 56 LEU C C 54 178.055 177.245 0.810 1
1 553 . 6 1 1 A 56 56 LEU CA C 54 55.018 56.993 -1.975 1
1 554 . 6 1 1 A 56 56 LEU CB C 54 41.990 42.027 -0.037 1
1 558 . 6 1 1 A 56 56 LEU N N 54 122.728 121.351 1.377 1
1 559 . 6 1 1 A 57 57 GLY H H 55 8.231 8.219 0.012 1
1 560 . 6 1 1 A 57 57 GLY HA2 H 55 3.911 3.946 -0.035 1
1 561 . 6 1 1 A 57 57 GLY HA3 H 55 3.808 3.952 -0.144 1
1 562 . 6 1 1 A 57 57 GLY C C 55 174.379 175.575 -1.196 1
1 563 . 6 1 1 A 57 57 GLY CA C 55 45.092 45.923 -0.831 1
1 564 . 6 1 1 A 57 57 GLY N N 55 110.035 107.397 2.638 1
1 565 . 6 1 1 A 58 58 GLU H H 56 8.241 8.847 -0.606 1
1 566 . 6 1 1 A 58 58 GLU HA H 56 4.136 4.028 0.108 1
1 570 . 6 1 1 A 58 58 GLU C C 56 176.868 178.142 -1.274 1
1 571 . 6 1 1 A 58 58 GLU CA C 56 56.734 59.622 -2.888 1
1 572 . 6 1 1 A 58 58 GLU CB C 56 29.584 29.483 0.101 1
1 574 . 6 1 1 A 58 58 GLU N N 56 121.173 124.844 -3.671 1
1 575 . 6 1 1 A 59 59 GLU H H 57 8.419 8.281 0.138 1
1 576 . 6 1 1 A 59 59 GLU HA H 57 4.074 4.173 -0.099 1
1 580 . 6 1 1 A 59 59 GLU C C 57 176.502 178.110 -1.608 1
1 581 . 6 1 1 A 59 59 GLU CA C 57 56.842 59.148 -2.306 1
1 582 . 6 1 1 A 59 59 GLU CB C 57 29.267 29.039 0.228 1
1 584 . 6 1 1 A 59 59 GLU N N 57 121.777 119.270 2.507 1
1 585 . 6 1 1 A 60 60 ALA H H 58 8.077 7.797 0.280 1
1 586 . 6 1 1 A 60 60 ALA HA H 58 4.134 4.354 -0.220 1
1 590 . 6 1 1 A 60 60 ALA CA C 58 52.432 52.038 0.394 1
1 591 . 6 1 1 A 60 60 ALA CB C 58 18.743 17.798 0.945 1
1 592 . 6 1 1 A 60 60 ALA N N 58 125.120 120.725 4.395 1
1 593 . 6 1 1 A 61 61 ALA H H 59 8.041 7.665 0.376 1
1 594 . 6 1 1 A 61 61 ALA HA H 59 4.131 4.628 -0.497 1
1 598 . 6 1 1 A 61 61 ALA C C 59 178.147 176.598 1.549 1
1 599 . 6 1 1 A 61 61 ALA CA C 59 52.586 51.071 1.515 1
1 600 . 6 1 1 A 61 61 ALA CB C 59 18.692 21.862 -3.170 1
1 601 . 6 1 1 A 61 61 ALA N N 59 123.857 119.886 3.971 1
1 602 . 6 1 1 A 62 62 GLY H H 60 8.069 8.641 -0.572 1
1 603 . 6 1 1 A 62 62 GLY HA2 H 60 3.810 3.996 -0.186 1
1 604 . 6 1 1 A 62 62 GLY HA3 H 60 3.888 4.006 -0.118 1
1 605 . 6 1 1 A 62 62 GLY C C 60 174.914 174.514 0.400 1
1 606 . 6 1 1 A 62 62 GLY CA C 60 45.320 46.580 -1.260 1
1 607 . 6 1 1 A 62 62 GLY N N 60 107.924 106.219 1.705 1
1 608 . 6 1 1 A 63 63 GLY H H 61 8.118 7.947 0.171 1
1 609 . 6 1 1 A 63 63 GLY HA2 H 61 4.008 4.176 -0.168 1
1 610 . 6 1 1 A 63 63 GLY HA3 H 61 3.893 4.184 -0.291 1
1 611 . 6 1 1 A 63 63 GLY C C 61 174.743 175.285 -0.542 1
1 612 . 6 1 1 A 63 63 GLY CA C 61 45.202 46.489 -1.287 1
1 613 . 6 1 1 A 63 63 GLY N N 61 109.441 110.737 -1.296 1
1 614 . 6 1 1 A 64 64 ASP H H 62 8.305 8.364 -0.059 1
1 615 . 6 1 1 A 64 64 ASP HA H 62 4.240 4.318 -0.078 1
1 618 . 6 1 1 A 64 64 ASP C C 62 177.571 177.733 -0.162 1
1 619 . 6 1 1 A 64 64 ASP CA C 62 57.210 57.367 -0.157 1
1 620 . 6 1 1 A 64 64 ASP CB C 62 40.142 40.090 0.052 1
1 621 . 6 1 1 A 64 64 ASP N N 62 121.568 120.078 1.490 1
1 622 . 6 1 1 A 65 65 GLN H H 63 8.337 7.929 0.408 1
1 623 . 6 1 1 A 65 65 GLN HA H 63 4.138 3.993 0.145 1
1 628 . 6 1 1 A 65 65 GLN C C 63 177.490 178.859 -1.369 1
1 629 . 6 1 1 A 65 65 GLN CA C 63 58.643 58.625 0.018 1
1 630 . 6 1 1 A 65 65 GLN CB C 63 27.803 28.377 -0.574 1
1 632 . 6 1 1 A 65 65 GLN N N 63 119.700 118.988 0.712 1
1 633 . 6 1 1 A 66 66 PHE H H 64 7.658 8.283 -0.625 1
1 634 . 6 1 1 A 66 66 PHE HA H 64 4.170 4.336 -0.166 1
1 638 . 6 1 1 A 66 66 PHE C C 64 176.872 178.417 -1.545 1
1 639 . 6 1 1 A 66 66 PHE CA C 64 60.158 61.088 -0.930 1
1 640 . 6 1 1 A 66 66 PHE CB C 64 38.490 38.303 0.187 1
1 643 . 6 1 1 A 66 66 PHE N N 64 121.036 119.308 1.728 1
1 644 . 6 1 1 A 67 67 ILE H H 65 7.646 8.673 -1.027 1
1 645 . 6 1 1 A 67 67 ILE HA H 65 3.426 3.607 -0.181 1
1 655 . 6 1 1 A 67 67 ILE CA C 65 63.377 64.494 -1.117 1
1 656 . 6 1 1 A 67 67 ILE CB C 65 37.057 37.653 -0.596 1
1 660 . 6 1 1 A 67 67 ILE N N 65 121.372 119.213 2.159 1
1 661 . 6 1 1 A 68 68 HIS H H 66 7.945 8.088 -0.143 1
1 662 . 6 1 1 A 68 68 HIS HA H 66 4.005 4.169 -0.164 1
1 665 . 6 1 1 A 68 68 HIS CA C 66 59.915 59.322 0.593 1
1 668 . 6 1 1 A 68 68 HIS N N 66 120.036 120.756 -0.720 1
1 669 . 6 1 1 A 69 69 GLU HA H 67 3.677 3.827 -0.150 1
1 673 . 6 1 1 A 69 69 GLU CA C 67 58.490 59.801 -1.311 1
1 674 . 6 1 1 A 69 69 GLU CB C 67 29.290 29.272 0.018 1
1 676 . 6 1 1 A 70 70 GLN H H 68 8.017 7.801 0.216 1
1 677 . 6 1 1 A 70 70 GLN HA H 68 3.426 3.787 -0.361 1
1 678 . 6 1 1 A 70 70 GLN C C 68 179.280 178.768 0.512 1
1 679 . 6 1 1 A 70 70 GLN CA C 68 57.561 58.508 -0.947 1
1 680 . 6 1 1 A 70 70 GLN CB C 68 28.530 28.215 0.315 1
1 682 . 6 1 1 A 70 70 GLN N N 68 120.410 118.673 1.737 1
1 683 . 6 1 1 A 71 71 ASP HA H 69 4.440 4.835 -0.395 1
1 684 . 6 1 1 A 71 71 ASP C C 69 177.402 179.112 -1.710 1
1 685 . 6 1 1 A 71 71 ASP CA C 69 56.290 57.572 -1.282 1
1 686 . 6 1 1 A 72 72 LEU H H 70 7.952 8.622 -0.670 1
1 687 . 6 1 1 A 72 72 LEU HA H 70 3.775 3.966 -0.191 1
1 697 . 6 1 1 A 72 72 LEU C C 70 178.316 178.322 -0.006 1
1 698 . 6 1 1 A 72 72 LEU CA C 70 56.101 57.848 -1.747 1
1 699 . 6 1 1 A 72 72 LEU CB C 70 39.872 41.444 -1.572 1
1 703 . 6 1 1 A 72 72 LEU N N 70 120.832 121.142 -0.310 1
1 704 . 6 1 1 A 73 73 ASN H H 71 7.723 8.273 -0.550 1
1 705 . 6 1 1 A 73 73 ASN HA H 71 4.270 4.308 -0.038 1
1 708 . 6 1 1 A 73 73 ASN C C 71 178.193 177.762 0.431 1
1 709 . 6 1 1 A 73 73 ASN CA C 71 55.970 56.346 -0.376 1
1 710 . 6 1 1 A 73 73 ASN CB C 71 37.640 38.816 -1.176 1
1 711 . 6 1 1 A 73 73 ASN N N 71 119.295 116.773 2.522 1
1 712 . 6 1 1 A 74 74 TRP H H 72 7.811 7.979 -0.168 1
1 713 . 6 1 1 A 74 74 TRP HA H 72 4.500 4.499 0.001 1
1 720 . 6 1 1 A 74 74 TRP CA C 72 58.480 60.159 -1.679 1
1 721 . 6 1 1 A 74 74 TRP CB C 72 28.920 29.633 -0.713 1
1 727 . 6 1 1 A 74 74 TRP N N 72 121.490 120.589 0.901 1
1 729 . 6 1 1 A 75 75 LEU H H 73 8.412 8.638 -0.226 1
1 730 . 6 1 1 A 75 75 LEU HA H 73 3.290 3.450 -0.160 1
1 739 . 6 1 1 A 75 75 LEU C C 73 178.562 178.655 -0.093 1
1 740 . 6 1 1 A 75 75 LEU CA C 73 58.226 57.535 0.691 1
1 741 . 6 1 1 A 75 75 LEU CB C 73 41.200 41.340 -0.140 1
1 745 . 6 1 1 A 75 75 LEU N N 73 121.065 121.413 -0.348 1
1 746 . 6 1 1 A 76 76 GLN H H 74 7.648 7.944 -0.296 1
1 747 . 6 1 1 A 76 76 GLN HA H 74 3.657 4.032 -0.375 1
1 752 . 6 1 1 A 76 76 GLN C C 74 178.616 178.001 0.615 1
1 753 . 6 1 1 A 76 76 GLN CA C 74 58.777 59.123 -0.346 1
1 754 . 6 1 1 A 76 76 GLN CB C 74 28.163 28.588 -0.425 1
1 756 . 6 1 1 A 76 76 GLN N N 74 113.985 119.066 -5.081 1
1 757 . 6 1 1 A 77 77 GLN H H 75 7.465 7.747 -0.282 1
1 758 . 6 1 1 A 77 77 GLN HA H 75 4.134 4.452 -0.318 1
1 761 . 6 1 1 A 77 77 GLN C C 75 176.223 175.845 0.378 1
1 762 . 6 1 1 A 77 77 GLN CA C 75 56.203 56.229 -0.026 1
1 763 . 6 1 1 A 77 77 GLN CB C 75 29.524 29.284 0.240 1
1 765 . 6 1 1 A 77 77 GLN N N 75 117.481 116.357 1.124 1
1 766 . 6 1 1 A 78 78 ALA H H 76 7.420 7.318 0.102 1
1 767 . 6 1 1 A 78 78 ALA HA H 76 3.864 4.316 -0.452 1
1 771 . 6 1 1 A 78 78 ALA C C 76 176.733 176.303 0.430 1
1 772 . 6 1 1 A 78 78 ALA CA C 76 52.529 53.077 -0.548 1
1 773 . 6 1 1 A 78 78 ALA CB C 76 20.124 19.411 0.713 1
1 774 . 6 1 1 A 78 78 ALA N N 76 122.682 123.208 -0.526 1
1 775 . 6 1 1 A 79 79 ASP H H 77 9.028 8.912 0.116 1
1 776 . 6 1 1 A 79 79 ASP HA H 77 4.673 4.912 -0.239 1
1 779 . 6 1 1 A 79 79 ASP C C 77 175.740 176.161 -0.421 1
1 780 . 6 1 1 A 79 79 ASP CA C 77 56.383 56.235 0.148 1
1 781 . 6 1 1 A 79 79 ASP CB C 77 42.826 43.245 -0.419 1
1 782 . 6 1 1 A 79 79 ASP N N 77 119.887 121.609 -1.722 1
1 783 . 6 1 1 A 80 80 VAL H H 78 7.379 7.893 -0.514 1
1 784 . 6 1 1 A 80 80 VAL HA H 78 4.340 4.919 -0.579 1
1 792 . 6 1 1 A 80 80 VAL C C 78 175.321 174.508 0.813 1
1 793 . 6 1 1 A 80 80 VAL CA C 78 60.011 60.471 -0.460 1
1 794 . 6 1 1 A 80 80 VAL CB C 78 35.362 36.334 -0.972 1
1 797 . 6 1 1 A 80 80 VAL N N 78 114.152 118.042 -3.890 1
1 798 . 6 1 1 A 81 81 VAL H H 79 8.350 8.262 0.088 1
1 799 . 6 1 1 A 81 81 VAL HA H 79 4.799 4.976 -0.177 1
1 807 . 6 1 1 A 81 81 VAL C C 79 173.095 174.762 -1.667 1
1 808 . 6 1 1 A 81 81 VAL CA C 79 60.775 60.739 0.036 1
1 809 . 6 1 1 A 81 81 VAL CB C 79 32.824 35.439 -2.615 1
1 812 . 6 1 1 A 81 81 VAL N N 79 128.429 125.793 2.636 1
1 813 . 6 1 1 A 82 82 VAL H H 80 8.947 8.694 0.253 1
1 814 . 6 1 1 A 82 82 VAL HA H 80 4.947 4.825 0.122 1
1 822 . 6 1 1 A 82 82 VAL C C 80 173.522 174.525 -1.003 1
1 823 . 6 1 1 A 82 82 VAL CA C 80 59.684 60.689 -1.005 1
1 824 . 6 1 1 A 82 82 VAL CB C 80 33.702 35.074 -1.372 1
1 827 . 6 1 1 A 82 82 VAL N N 80 126.957 126.295 0.662 1
1 828 . 6 1 1 A 83 83 ALA H H 81 9.011 8.785 0.226 1
1 829 . 6 1 1 A 83 83 ALA HA H 81 4.938 4.938 0.000 1
1 833 . 6 1 1 A 83 83 ALA C C 81 130.330 175.114 -44.784 1
1 834 . 6 1 1 A 83 83 ALA CA C 81 49.490 49.871 -0.381 1
1 835 . 6 1 1 A 83 83 ALA CB C 81 23.628 21.264 2.364 1
1 836 . 6 1 1 A 83 83 ALA N N 81 128.705 129.049 -0.344 1
1 837 . 6 1 1 A 84 84 GLU H H 82 8.922 8.340 0.582 1
1 838 . 6 1 1 A 84 84 GLU HA H 82 4.937 4.407 0.530 1
1 839 . 6 1 1 A 84 84 GLU C C 82 177.673 175.880 1.793 1
1 840 . 6 1 1 A 84 84 GLU CA C 82 56.714 56.017 0.697 1
1 841 . 6 1 1 A 84 84 GLU CB C 82 29.882 29.918 -0.036 1
1 842 . 6 1 1 A 84 84 GLU N N 82 130.330 123.916 6.414 1
1 843 . 6 1 1 A 85 85 VAL H H 83 8.427 8.993 -0.566 1
1 844 . 6 1 1 A 85 85 VAL HA H 83 4.435 3.997 0.438 1
1 852 . 6 1 1 A 85 85 VAL C C 83 174.252 176.182 -1.930 1
1 853 . 6 1 1 A 85 85 VAL CA C 83 59.896 64.962 -5.066 1
1 854 . 6 1 1 A 85 85 VAL CB C 83 29.968 31.937 -1.969 1
1 857 . 6 1 1 A 85 85 VAL N N 83 114.212 127.173 -12.961 1
1 858 . 6 1 1 A 86 86 THR H H 84 9.347 8.179 1.168 1
1 859 . 6 1 1 A 86 86 THR HA H 84 4.146 4.066 0.080 1
1 864 . 6 1 1 A 86 86 THR C C 84 175.751 174.338 1.413 1
1 865 . 6 1 1 A 86 86 THR CA C 84 67.629 64.773 2.856 1
1 866 . 6 1 1 A 86 86 THR CB C 84 66.819 67.549 -0.730 1
1 868 . 6 1 1 A 86 86 THR N N 84 121.640 116.138 5.502 1
1 869 . 6 1 1 A 87 87 GLN H H 85 8.114 7.954 0.160 1
1 870 . 6 1 1 A 87 87 GLN HA H 85 4.736 4.516 0.220 1
1 874 . 6 1 1 A 87 87 GLN CA C 85 51.898 54.181 -2.283 1
1 875 . 6 1 1 A 87 87 GLN CB C 85 27.942 29.509 -1.567 1
1 877 . 6 1 1 A 87 87 GLN N N 85 120.367 124.654 -4.287 1
1 878 . 6 1 1 A 88 88 PRO HA H 86 4.061 4.695 -0.634 1
1 885 . 6 1 1 A 88 88 PRO C C 86 176.436 175.479 0.957 1
1 886 . 6 1 1 A 88 88 PRO CA C 86 63.422 63.137 0.285 1
1 887 . 6 1 1 A 88 88 PRO CB C 86 31.925 31.728 0.197 1
1 889 . 6 1 1 A 89 89 SER H H 87 6.044 8.886 -2.842 1
1 890 . 6 1 1 A 89 89 SER HA H 87 4.630 4.994 -0.364 1
1 893 . 6 1 1 A 89 89 SER C C 87 175.612 174.549 1.063 1
1 894 . 6 1 1 A 89 89 SER CA C 87 56.800 56.876 -0.076 1
1 895 . 6 1 1 A 89 89 SER CB C 87 64.196 65.600 -1.404 1
1 896 . 6 1 1 A 89 89 SER N N 87 115.721 118.316 -2.595 1
1 897 . 6 1 1 A 90 90 LEU H H 88 9.702 8.940 0.762 1
1 898 . 6 1 1 A 90 90 LEU HA H 88 4.270 3.998 0.272 1
1 906 . 6 1 1 A 90 90 LEU C C 88 179.173 179.245 -0.072 1
1 907 . 6 1 1 A 90 90 LEU CA C 88 57.402 58.241 -0.839 1
1 908 . 6 1 1 A 90 90 LEU CB C 88 43.642 41.784 1.858 1
1 911 . 6 1 1 A 90 90 LEU N N 88 130.488 130.180 0.308 1
1 912 . 6 1 1 A 91 91 GLY H H 89 8.354 8.399 -0.045 1
1 913 . 6 1 1 A 91 91 GLY HA2 H 89 3.680 3.836 -0.156 1
1 914 . 6 1 1 A 91 91 GLY HA3 H 89 3.584 3.847 -0.263 1
1 915 . 6 1 1 A 91 91 GLY C C 89 175.106 176.257 -1.151 1
1 916 . 6 1 1 A 91 91 GLY CA C 89 47.770 47.730 0.040 1
1 917 . 6 1 1 A 91 91 GLY N N 89 107.522 106.528 0.994 1
1 918 . 6 1 1 A 92 92 VAL H H 90 7.906 7.919 -0.013 1
1 919 . 6 1 1 A 92 92 VAL HA H 90 3.940 3.752 0.188 1
1 927 . 6 1 1 A 92 92 VAL C C 90 178.467 177.983 0.484 1
1 928 . 6 1 1 A 92 92 VAL CA C 90 65.379 66.547 -1.168 1
1 929 . 6 1 1 A 92 92 VAL CB C 90 31.785 31.721 0.064 1
1 932 . 6 1 1 A 92 92 VAL N N 90 121.741 122.197 -0.456 1
1 933 . 6 1 1 A 93 93 GLY H H 91 7.595 8.223 -0.628 1
1 934 . 6 1 1 A 93 93 GLY HA2 H 91 3.628 3.803 -0.175 1
1 935 . 6 1 1 A 93 93 GLY HA3 H 91 3.415 3.813 -0.398 1
1 936 . 6 1 1 A 93 93 GLY C C 91 174.022 175.441 -1.419 1
1 937 . 6 1 1 A 93 93 GLY CA C 91 48.319 47.556 0.763 1
1 938 . 6 1 1 A 93 93 GLY N N 91 104.629 107.276 -2.647 1
1 939 . 6 1 1 A 94 94 TYR H H 92 8.372 8.529 -0.157 1
1 940 . 6 1 1 A 94 94 TYR HA H 92 4.046 4.085 -0.039 1
1 943 . 6 1 1 A 94 94 TYR C C 92 177.458 178.016 -0.558 1
1 944 . 6 1 1 A 94 94 TYR CA C 92 61.760 60.720 1.040 1
1 945 . 6 1 1 A 94 94 TYR CB C 92 38.431 38.786 -0.355 1
1 948 . 6 1 1 A 94 94 TYR N N 92 123.383 123.400 -0.017 1
1 949 . 6 1 1 A 95 95 GLU H H 93 8.424 8.493 -0.069 1
1 950 . 6 1 1 A 95 95 GLU HA H 93 3.421 3.924 -0.503 1
1 951 . 6 1 1 A 95 95 GLU C C 93 178.590 179.465 -0.875 1
1 952 . 6 1 1 A 95 95 GLU CA C 93 60.211 59.139 1.072 1
1 953 . 6 1 1 A 95 95 GLU CB C 93 29.025 29.176 -0.151 1
1 954 . 6 1 1 A 95 95 GLU N N 93 120.181 118.438 1.743 1
1 955 . 6 1 1 A 96 96 LEU H H 94 8.210 8.243 -0.033 1
1 956 . 6 1 1 A 96 96 LEU HA H 94 3.830 3.963 -0.133 1
1 964 . 6 1 1 A 96 96 LEU C C 94 179.032 179.387 -0.355 1
1 965 . 6 1 1 A 96 96 LEU CA C 94 57.683 58.489 -0.806 1
1 966 . 6 1 1 A 96 96 LEU CB C 94 41.883 41.904 -0.021 1
1 970 . 6 1 1 A 96 96 LEU N N 94 118.091 120.719 -2.628 1
1 971 . 6 1 1 A 97 97 GLY H H 95 8.773 8.286 0.487 1
1 972 . 6 1 1 A 97 97 GLY C C 95 175.344 175.278 0.066 1
1 973 . 6 1 1 A 97 97 GLY CA C 95 47.308 47.177 0.131 1
1 974 . 6 1 1 A 97 97 GLY N N 95 108.085 105.226 2.859 1
1 975 . 6 1 1 A 98 98 ARG H H 96 8.100 8.256 -0.156 1
1 976 . 6 1 1 A 98 98 ARG C C 96 179.692 178.216 1.476 1
1 977 . 6 1 1 A 98 98 ARG CA C 96 56.308 58.598 -2.290 1
1 978 . 6 1 1 A 98 98 ARG CB C 96 26.854 29.509 -2.655 1
1 979 . 6 1 1 A 98 98 ARG N N 96 118.156 121.871 -3.715 1
1 980 . 6 1 1 A 99 99 ALA H H 97 8.498 7.551 0.947 1
1 981 . 6 1 1 A 99 99 ALA HA H 97 3.640 4.261 -0.621 1
1 985 . 6 1 1 A 99 99 ALA C C 97 179.650 179.941 -0.291 1
1 986 . 6 1 1 A 99 99 ALA CA C 97 55.166 54.766 0.400 1
1 987 . 6 1 1 A 99 99 ALA CB C 97 18.604 18.471 0.133 1
1 988 . 6 1 1 A 99 99 ALA N N 97 122.310 121.074 1.236 1
1 989 . 6 1 1 A 100 100 VAL H H 98 8.597 8.068 0.529 1
1 990 . 6 1 1 A 100 100 VAL HA H 98 3.798 3.525 0.273 1
1 998 . 6 1 1 A 100 100 VAL C C 98 180.464 178.197 2.267 1
1 999 . 6 1 1 A 100 100 VAL CA C 98 65.664 66.974 -1.310 1
1 1000 . 6 1 1 A 100 100 VAL CB C 98 31.065 31.636 -0.571 1
1 1003 . 6 1 1 A 100 100 VAL N N 98 120.603 119.346 1.257 1
1 1004 . 6 1 1 A 101 101 ALA H H 99 7.280 7.661 -0.381 1
1 1005 . 6 1 1 A 101 101 ALA HA H 99 3.963 4.196 -0.233 1
1 1009 . 6 1 1 A 101 101 ALA C C 99 179.314 179.282 0.032 1
1 1010 . 6 1 1 A 101 101 ALA CA C 99 54.367 54.829 -0.462 1
1 1011 . 6 1 1 A 101 101 ALA CB C 99 18.139 19.174 -1.035 1
1 1012 . 6 1 1 A 101 101 ALA N N 99 124.450 121.775 2.675 1
1 1013 . 6 1 1 A 102 102 LEU H H 100 7.200 8.551 -1.351 1
1 1014 . 6 1 1 A 102 102 LEU HA H 100 4.192 4.112 0.080 1
1 1024 . 6 1 1 A 102 102 LEU C C 100 177.306 176.808 0.498 1
1 1025 . 6 1 1 A 102 102 LEU CA C 100 54.808 56.370 -1.562 1
1 1026 . 6 1 1 A 102 102 LEU CB C 100 42.880 43.101 -0.221 1
1 1030 . 6 1 1 A 102 102 LEU N N 100 116.834 118.579 -1.745 1
1 1031 . 6 1 1 A 103 103 GLY H H 101 7.891 8.219 -0.328 1
1 1032 . 6 1 1 A 103 103 GLY HA2 H 101 3.941 3.988 -0.047 1
1 1033 . 6 1 1 A 103 103 GLY HA3 H 101 3.831 3.997 -0.166 1
1 1034 . 6 1 1 A 103 103 GLY C C 101 175.137 173.831 1.306 1
1 1035 . 6 1 1 A 103 103 GLY CA C 101 45.673 45.133 0.540 1
1 1036 . 6 1 1 A 103 103 GLY N N 101 109.395 106.737 2.658 1
1 1037 . 6 1 1 A 104 104 LYS H H 102 7.337 8.556 -1.219 1
1 1038 . 6 1 1 A 104 104 LYS HA H 102 4.402 4.500 -0.098 1
1 1043 . 6 1 1 A 104 104 LYS CA C 102 52.136 57.044 -4.908 1
1 1044 . 6 1 1 A 104 104 LYS CB C 102 31.045 31.381 -0.336 1
1 1047 . 6 1 1 A 104 104 LYS N N 102 118.954 119.384 -0.430 1
1 1048 . 6 1 1 A 105 105 PRO HA H 103 4.781 4.417 0.364 1
1 1054 . 6 1 1 A 105 105 PRO CA C 103 62.791 63.435 -0.644 1
1 1055 . 6 1 1 A 105 105 PRO CB C 103 30.405 32.124 -1.719 1
1 1058 . 6 1 1 A 106 106 ILE H H 104 8.261 8.928 -0.667 1
1 1059 . 6 1 1 A 106 106 ILE HA H 104 4.680 4.332 0.348 1
1 1069 . 6 1 1 A 106 106 ILE C C 104 175.543 173.788 1.755 1
1 1070 . 6 1 1 A 106 106 ILE CA C 104 59.362 60.362 -1.000 1
1 1071 . 6 1 1 A 106 106 ILE CB C 104 43.738 37.073 6.665 1
1 1075 . 6 1 1 A 106 106 ILE N N 104 123.509 124.315 -0.806 1
1 1076 . 6 1 1 A 107 107 LEU H H 105 8.584 8.413 0.171 1
1 1077 . 6 1 1 A 107 107 LEU HA H 105 4.243 4.403 -0.160 1
1 1087 . 6 1 1 A 107 107 LEU C C 105 174.204 174.329 -0.125 1
1 1088 . 6 1 1 A 107 107 LEU CA C 105 52.863 53.415 -0.552 1
1 1089 . 6 1 1 A 107 107 LEU CB C 105 42.408 42.737 -0.329 1
1 1093 . 6 1 1 A 107 107 LEU N N 105 131.882 129.097 2.785 1
1 1094 . 6 1 1 A 108 108 CYS H H 106 8.679 8.547 0.132 1
1 1095 . 6 1 1 A 108 108 CYS HA H 106 5.280 5.132 0.148 1
1 1099 . 6 1 1 A 108 108 CYS C C 106 173.134 173.419 -0.285 1
1 1100 . 6 1 1 A 108 108 CYS CA C 106 57.290 56.880 0.410 1
1 1101 . 6 1 1 A 108 108 CYS CB C 106 29.559 29.235 0.324 1
1 1102 . 6 1 1 A 108 108 CYS N N 106 122.904 125.836 -2.932 1
1 1103 . 6 1 1 A 109 109 LEU H H 107 8.987 8.869 0.118 1
1 1104 . 6 1 1 A 109 109 LEU HA H 107 5.120 5.610 -0.490 1
1 1112 . 6 1 1 A 109 109 LEU C C 107 174.500 175.780 -1.280 1
1 1113 . 6 1 1 A 109 109 LEU CA C 107 53.274 53.762 -0.488 1
1 1114 . 6 1 1 A 109 109 LEU CB C 107 43.450 44.659 -1.209 1
1 1118 . 6 1 1 A 109 109 LEU N N 107 124.653 124.647 0.006 1
1 1119 . 6 1 1 A 110 110 PHE H H 108 8.981 9.171 -0.190 1
1 1120 . 6 1 1 A 110 110 PHE HA H 108 4.846 5.529 -0.683 1
1 1125 . 6 1 1 A 110 110 PHE C C 108 172.231 172.918 -0.687 1
1 1126 . 6 1 1 A 110 110 PHE CA C 108 55.963 56.391 -0.428 1
1 1127 . 6 1 1 A 110 110 PHE CB C 108 43.270 42.763 0.507 1
1 1130 . 6 1 1 A 110 110 PHE N N 108 125.052 122.187 2.865 1
1 1131 . 6 1 1 A 111 111 ARG H H 109 7.461 8.569 -1.108 1
1 1132 . 6 1 1 A 111 111 ARG HA H 109 4.804 4.589 0.215 1
1 1136 . 6 1 1 A 111 111 ARG CA C 109 51.953 52.576 -0.623 1
1 1137 . 6 1 1 A 111 111 ARG CB C 109 30.008 29.777 0.231 1
1 1140 . 6 1 1 A 111 111 ARG N N 109 128.034 125.839 2.195 1
1 1141 . 6 1 1 A 112 112 PRO C C 110 178.675 177.942 0.733 1
1 1142 . 6 1 1 A 112 112 PRO CA C 110 64.024 64.520 -0.496 1
1 1143 . 6 1 1 A 112 112 PRO CB C 110 31.416 32.037 -0.621 1
1 1144 . 6 1 1 A 113 113 GLN H H 111 8.188 8.712 -0.524 1
1 1145 . 6 1 1 A 113 113 GLN HA H 111 4.056 4.053 0.003 1
1 1149 . 6 1 1 A 113 113 GLN C C 111 175.936 177.039 -1.103 1
1 1150 . 6 1 1 A 113 113 GLN CA C 111 57.144 58.246 -1.102 1
1 1151 . 6 1 1 A 113 113 GLN CB C 111 28.033 28.079 -0.046 1
1 1153 . 6 1 1 A 113 113 GLN N N 111 118.835 116.506 2.329 1
1 1154 . 6 1 1 A 114 114 SER H H 112 7.730 7.696 0.034 1
1 1155 . 6 1 1 A 114 114 SER HA H 112 4.037 4.542 -0.505 1
1 1158 . 6 1 1 A 114 114 SER C C 112 175.750 175.750 0.000 1
1 1159 . 6 1 1 A 114 114 SER CA C 112 60.154 58.712 1.442 1
1 1160 . 6 1 1 A 114 114 SER CB C 112 64.282 65.242 -0.960 1
1 1161 . 6 1 1 A 114 114 SER N N 112 114.887 110.448 4.439 1
1 1162 . 6 1 1 A 115 115 GLY H H 113 8.005 7.549 0.456 1
1 1163 . 6 1 1 A 115 115 GLY HA2 H 113 3.712 3.998 -0.286 1
1 1164 . 6 1 1 A 115 115 GLY HA3 H 113 4.130 4.196 -0.066 1
1 1165 . 6 1 1 A 115 115 GLY C C 113 173.945 175.598 -1.653 1
1 1166 . 6 1 1 A 115 115 GLY CA C 113 45.233 47.215 -1.982 1
1 1167 . 6 1 1 A 115 115 GLY N N 113 110.740 110.856 -0.116 1
1 1168 . 6 1 1 A 116 116 ARG H H 114 7.665 7.977 -0.312 1
1 1169 . 6 1 1 A 116 116 ARG HA H 114 4.449 4.470 -0.021 1
1 1173 . 6 1 1 A 116 116 ARG C C 114 175.370 175.528 -0.158 1
1 1174 . 6 1 1 A 116 116 ARG CA C 114 55.080 55.891 -0.811 1
1 1175 . 6 1 1 A 116 116 ARG CB C 114 31.215 30.168 1.047 1
1 1178 . 6 1 1 A 116 116 ARG N N 114 119.983 118.837 1.146 1
1 1179 . 6 1 1 A 117 117 VAL H H 115 8.409 8.272 0.137 1
1 1180 . 6 1 1 A 117 117 VAL HA H 115 4.184 3.780 0.404 1
1 1188 . 6 1 1 A 117 117 VAL C C 115 175.980 174.800 1.180 1
1 1189 . 6 1 1 A 117 117 VAL CA C 115 61.167 62.312 -1.145 1
1 1190 . 6 1 1 A 117 117 VAL CB C 115 32.931 31.119 1.812 1
1 1193 . 6 1 1 A 117 117 VAL N N 115 122.240 116.644 5.596 1
1 1194 . 6 1 1 A 118 118 LEU H H 116 8.227 7.751 0.476 1
1 1195 . 6 1 1 A 118 118 LEU HA H 116 3.720 4.327 -0.607 1
1 1204 . 6 1 1 A 118 118 LEU C C 116 175.623 176.163 -0.540 1
1 1205 . 6 1 1 A 118 118 LEU CA C 116 54.555 55.721 -1.166 1
1 1206 . 6 1 1 A 118 118 LEU CB C 116 39.292 43.301 -4.009 1
1 1210 . 6 1 1 A 118 118 LEU N N 116 131.481 129.335 2.146 1
1 1211 . 6 1 1 A 119 119 SER H H 117 7.780 8.773 -0.993 1
1 1212 . 6 1 1 A 119 119 SER HA H 117 4.060 4.318 -0.258 1
1 1214 . 6 1 1 A 119 119 SER C C 117 175.782 175.912 -0.130 1
1 1215 . 6 1 1 A 119 119 SER CA C 117 58.530 58.622 -0.092 1
1 1216 . 6 1 1 A 119 119 SER CB C 117 64.785 63.858 0.927 1
1 1217 . 6 1 1 A 119 119 SER N N 117 118.658 120.511 -1.853 1
1 1218 . 6 1 1 A 120 120 ALA H H 118 8.955 8.936 0.019 1
1 1219 . 6 1 1 A 120 120 ALA HA H 118 3.846 3.962 -0.116 1
1 1223 . 6 1 1 A 120 120 ALA C C 118 179.731 179.931 -0.200 1
1 1224 . 6 1 1 A 120 120 ALA CA C 118 54.927 55.330 -0.403 1
1 1225 . 6 1 1 A 120 120 ALA CB C 118 18.627 18.307 0.320 1
1 1226 . 6 1 1 A 120 120 ALA N N 118 134.119 130.219 3.900 1
1 1227 . 6 1 1 A 121 121 MET H H 119 7.718 7.784 -0.066 1
1 1228 . 6 1 1 A 121 121 MET HA H 119 4.130 4.176 -0.046 1
1 1235 . 6 1 1 A 121 121 MET C C 119 175.610 178.752 -3.142 1
1 1236 . 6 1 1 A 121 121 MET CA C 119 55.968 58.165 -2.197 1
1 1237 . 6 1 1 A 121 121 MET CB C 119 30.814 33.120 -2.306 1
1 1240 . 6 1 1 A 121 121 MET N N 119 115.424 116.500 -1.076 1
1 1241 . 6 1 1 A 122 122 ILE H H 120 6.451 7.841 -1.390 1
1 1242 . 6 1 1 A 122 122 ILE HA H 120 3.392 3.652 -0.260 1
1 1252 . 6 1 1 A 122 122 ILE C C 120 177.108 177.981 -0.873 1
1 1253 . 6 1 1 A 122 122 ILE CA C 120 59.650 64.505 -4.855 1
1 1254 . 6 1 1 A 122 122 ILE CB C 120 34.640 37.436 -2.796 1
1 1258 . 6 1 1 A 122 122 ILE N N 120 113.418 119.309 -5.891 1
1 1259 . 6 1 1 A 123 123 ARG H H 121 7.540 8.646 -1.106 1
1 1260 . 6 1 1 A 123 123 ARG HA H 121 3.551 3.955 -0.404 1
1 1264 . 6 1 1 A 123 123 ARG C C 121 179.642 178.714 0.928 1
1 1265 . 6 1 1 A 123 123 ARG CA C 121 59.242 59.666 -0.424 1
1 1266 . 6 1 1 A 123 123 ARG CB C 121 29.087 29.524 -0.437 1
1 1269 . 6 1 1 A 123 123 ARG N N 121 116.248 120.608 -4.360 1
1 1270 . 6 1 1 A 124 124 GLY H H 122 8.086 8.935 -0.849 1
1 1271 . 6 1 1 A 124 124 GLY C C 122 172.357 176.130 -3.773 1
1 1272 . 6 1 1 A 124 124 GLY CA C 122 44.836 46.702 -1.866 1
1 1273 . 6 1 1 A 124 124 GLY N N 122 104.381 107.485 -3.104 1
1 1274 . 6 1 1 A 125 125 ALA H H 123 6.411 7.815 -1.404 1
1 1275 . 6 1 1 A 125 125 ALA HA H 123 2.441 3.751 -1.310 1
1 1279 . 6 1 1 A 125 125 ALA C C 123 176.908 177.463 -0.555 1
1 1280 . 6 1 1 A 125 125 ALA CA C 123 51.593 54.435 -2.842 1
1 1281 . 6 1 1 A 125 125 ALA CB C 123 16.997 17.796 -0.799 1
1 1282 . 6 1 1 A 125 125 ALA N N 123 123.136 124.393 -1.257 1
1 1283 . 6 1 1 A 126 126 ALA H H 124 6.190 7.085 -0.895 1
1 1284 . 6 1 1 A 126 126 ALA HA H 124 3.829 4.200 -0.371 1
1 1288 . 6 1 1 A 126 126 ALA C C 124 177.535 177.067 0.468 1
1 1289 . 6 1 1 A 126 126 ALA CA C 124 52.403 52.869 -0.466 1
1 1290 . 6 1 1 A 126 126 ALA CB C 124 18.375 17.503 0.872 1
1 1291 . 6 1 1 A 126 126 ALA N N 124 117.999 118.260 -0.261 1
1 1292 . 6 1 1 A 127 127 ASP H H 125 8.877 7.821 1.056 1
1 1293 . 6 1 1 A 127 127 ASP HA H 125 4.665 4.442 0.223 1
1 1296 . 6 1 1 A 127 127 ASP C C 125 177.795 176.517 1.278 1
1 1297 . 6 1 1 A 127 127 ASP CA C 125 52.855 55.388 -2.533 1
1 1298 . 6 1 1 A 127 127 ASP CB C 125 41.814 41.759 0.055 1
1 1299 . 6 1 1 A 127 127 ASP N N 125 121.828 119.628 2.200 1
1 1300 . 6 1 1 A 128 128 GLY H H 126 7.954 8.921 -0.967 1
1 1301 . 6 1 1 A 128 128 GLY HA2 H 126 3.830 4.149 -0.319 1
1 1302 . 6 1 1 A 128 128 GLY HA3 H 126 4.249 4.214 0.035 1
1 1303 . 6 1 1 A 128 128 GLY C C 126 173.822 174.471 -0.649 1
1 1304 . 6 1 1 A 128 128 GLY CA C 126 45.549 45.098 0.451 1
1 1305 . 6 1 1 A 128 128 GLY N N 126 108.814 107.275 1.539 1
1 1306 . 6 1 1 A 129 129 SER H H 127 8.547 8.886 -0.339 1
1 1307 . 6 1 1 A 129 129 SER HA H 127 4.486 4.212 0.274 1
1 1309 . 6 1 1 A 129 129 SER C C 127 174.178 173.056 1.122 1
1 1310 . 6 1 1 A 129 129 SER CA C 127 58.653 60.722 -2.069 1
1 1311 . 6 1 1 A 129 129 SER CB C 127 63.316 61.262 2.054 1
1 1312 . 6 1 1 A 129 129 SER N N 127 115.599 114.655 0.944 1
1 1313 . 6 1 1 A 130 130 ARG H H 128 8.795 10.517 -1.722 1
1 1314 . 6 1 1 A 130 130 ARG HA H 128 4.160 4.683 -0.523 1
1 1318 . 6 1 1 A 130 130 ARG C C 128 175.518 175.493 0.025 1
1 1319 . 6 1 1 A 130 130 ARG CA C 128 58.479 56.061 2.418 1
1 1320 . 6 1 1 A 130 130 ARG CB C 128 29.952 33.093 -3.141 1
1 1323 . 6 1 1 A 130 130 ARG N N 128 127.611 120.460 7.151 1
1 1324 . 6 1 1 A 131 131 PHE H H 129 9.315 7.718 1.597 1
1 1325 . 6 1 1 A 131 131 PHE HA H 129 4.878 5.346 -0.468 1
1 1331 . 6 1 1 A 131 131 PHE C C 129 175.058 173.097 1.961 1
1 1332 . 6 1 1 A 131 131 PHE CA C 129 55.953 57.927 -1.974 1
1 1333 . 6 1 1 A 131 131 PHE CB C 129 40.189 42.004 -1.815 1
1 1337 . 6 1 1 A 131 131 PHE N N 129 126.219 118.312 7.907 1
1 1338 . 6 1 1 A 132 132 GLN H H 130 8.160 8.179 -0.019 1
1 1339 . 6 1 1 A 132 132 GLN HA H 130 5.013 5.254 -0.241 1
1 1343 . 6 1 1 A 132 132 GLN CA C 130 54.498 54.673 -0.175 1
1 1344 . 6 1 1 A 132 132 GLN CB C 130 32.106 33.118 -1.012 1
1 1346 . 6 1 1 A 132 132 GLN N N 130 125.589 126.280 -0.691 1
1 1347 . 6 1 1 A 133 133 VAL H H 131 8.689 8.977 -0.288 1
1 1348 . 6 1 1 A 133 133 VAL HA H 131 4.529 4.489 0.040 1
1 1356 . 6 1 1 A 133 133 VAL C C 131 174.441 175.722 -1.281 1
1 1357 . 6 1 1 A 133 133 VAL CA C 131 60.758 62.241 -1.483 1
1 1358 . 6 1 1 A 133 133 VAL CB C 131 32.417 31.740 0.677 1
1 1361 . 6 1 1 A 133 133 VAL N N 131 122.441 124.096 -1.655 1
1 1362 . 6 1 1 A 134 134 TRP H H 132 9.256 9.447 -0.191 1
1 1363 . 6 1 1 A 134 134 TRP HA H 132 5.213 5.174 0.039 1
1 1371 . 6 1 1 A 134 134 TRP C C 132 174.575 175.795 -1.220 1
1 1372 . 6 1 1 A 134 134 TRP CA C 132 53.859 56.247 -2.388 1
1 1373 . 6 1 1 A 134 134 TRP CB C 132 31.311 30.840 0.471 1
1 1379 . 6 1 1 A 134 134 TRP N N 132 130.303 128.465 1.838 1
1 1381 . 6 1 1 A 135 135 ASP H H 133 8.237 8.801 -0.564 1
1 1382 . 6 1 1 A 135 135 ASP HA H 133 6.018 5.879 0.139 1
1 1385 . 6 1 1 A 135 135 ASP C C 133 177.020 175.579 1.441 1
1 1386 . 6 1 1 A 135 135 ASP CA C 133 53.321 53.451 -0.130 1
1 1387 . 6 1 1 A 135 135 ASP CB C 133 41.514 43.185 -1.671 1
1 1388 . 6 1 1 A 135 135 ASP N N 133 125.516 122.309 3.207 1
1 1389 . 6 1 1 A 136 136 TYR H H 134 9.058 8.516 0.542 1
1 1390 . 6 1 1 A 136 136 TYR HA H 134 4.970 5.461 -0.491 1
1 1394 . 6 1 1 A 136 136 TYR C C 134 172.324 172.953 -0.629 1
1 1395 . 6 1 1 A 136 136 TYR CA C 134 55.982 56.008 -0.026 1
1 1396 . 6 1 1 A 136 136 TYR CB C 134 42.265 40.934 1.331 1
1 1399 . 6 1 1 A 136 136 TYR N N 134 120.315 118.690 1.625 1
1 1400 . 6 1 1 A 137 137 ALA H H 135 8.521 8.672 -0.151 1
1 1401 . 6 1 1 A 137 137 ALA HA H 135 4.280 4.216 0.064 1
1 1405 . 6 1 1 A 137 137 ALA C C 135 178.561 176.966 1.595 1
1 1406 . 6 1 1 A 137 137 ALA CA C 135 49.550 50.786 -1.236 1
1 1407 . 6 1 1 A 137 137 ALA CB C 135 19.998 22.784 -2.786 1
1 1408 . 6 1 1 A 137 137 ALA N N 135 123.386 121.243 2.143 1
1 1409 . 6 1 1 A 138 138 GLU H H 136 8.678 8.428 0.250 1
1 1410 . 6 1 1 A 138 138 GLU HA H 136 3.777 4.367 -0.590 1
1 1414 . 6 1 1 A 138 138 GLU C C 136 177.624 177.518 0.106 1
1 1415 . 6 1 1 A 138 138 GLU CA C 136 60.527 57.629 2.898 1
1 1416 . 6 1 1 A 138 138 GLU CB C 136 29.020 29.533 -0.513 1
1 1418 . 6 1 1 A 138 138 GLU N N 136 121.774 118.717 3.057 1
1 1419 . 6 1 1 A 139 139 GLY H H 137 8.666 9.445 -0.779 1
1 1420 . 6 1 1 A 139 139 GLY HA2 H 137 3.872 4.092 -0.220 1
1 1421 . 6 1 1 A 139 139 GLY HA3 H 137 3.872 4.104 -0.232 1
1 1422 . 6 1 1 A 139 139 GLY C C 137 175.122 174.954 0.168 1
1 1423 . 6 1 1 A 139 139 GLY CA C 137 46.093 45.323 0.770 1
1 1424 . 6 1 1 A 139 139 GLY N N 137 106.053 107.889 -1.836 1
1 1425 . 6 1 1 A 140 140 GLU H H 138 8.305 8.281 0.024 1
1 1426 . 6 1 1 A 140 140 GLU HA H 138 4.754 4.670 0.084 1
1 1430 . 6 1 1 A 140 140 GLU C C 138 177.819 177.689 0.130 1
1 1431 . 6 1 1 A 140 140 GLU CA C 138 55.049 55.748 -0.699 1
1 1432 . 6 1 1 A 140 140 GLU CB C 138 30.504 30.957 -0.453 1
1 1434 . 6 1 1 A 140 140 GLU N N 138 117.485 117.535 -0.050 1
1 1435 . 6 1 1 A 141 141 VAL H H 139 7.267 7.301 -0.034 1
1 1436 . 6 1 1 A 141 141 VAL HA H 139 3.422 3.931 -0.509 1
1 1444 . 6 1 1 A 141 141 VAL C C 139 175.454 177.522 -2.068 1
1 1445 . 6 1 1 A 141 141 VAL CA C 139 66.769 65.097 1.672 1
1 1446 . 6 1 1 A 141 141 VAL CB C 139 31.377 31.577 -0.200 1
1 1449 . 6 1 1 A 141 141 VAL N N 139 120.764 121.178 -0.414 1
1 1450 . 6 1 1 A 142 142 GLU H H 140 8.620 8.228 0.392 1
1 1451 . 6 1 1 A 142 142 GLU HA H 140 3.592 4.027 -0.435 1
1 1452 . 6 1 1 A 142 142 GLU C C 140 177.320 179.241 -1.921 1
1 1453 . 6 1 1 A 142 142 GLU CA C 140 62.607 59.624 2.983 1
1 1454 . 6 1 1 A 142 142 GLU CB C 140 26.759 29.288 -2.529 1
1 1455 . 6 1 1 A 142 142 GLU N N 140 120.048 121.075 -1.027 1
1 1456 . 6 1 1 A 143 143 THR H H 141 7.449 8.413 -0.964 1
1 1457 . 6 1 1 A 143 143 THR HA H 141 4.003 4.029 -0.026 1
1 1462 . 6 1 1 A 143 143 THR C C 141 177.258 176.688 0.570 1
1 1463 . 6 1 1 A 143 143 THR CA C 141 65.490 67.173 -1.683 1
1 1464 . 6 1 1 A 143 143 THR CB C 141 68.641 68.536 0.105 1
1 1466 . 6 1 1 A 143 143 THR N N 141 114.073 117.393 -3.320 1
1 1467 . 6 1 1 A 144 144 MET H H 142 7.992 7.986 0.006 1
1 1468 . 6 1 1 A 144 144 MET HA H 142 4.316 4.353 -0.037 1
1 1476 . 6 1 1 A 144 144 MET C C 142 178.233 179.095 -0.862 1
1 1477 . 6 1 1 A 144 144 MET CA C 142 57.743 58.882 -1.139 1
1 1478 . 6 1 1 A 144 144 MET CB C 142 31.326 32.045 -0.719 1
1 1481 . 6 1 1 A 144 144 MET N N 142 120.595 118.523 2.072 1
1 1482 . 6 1 1 A 145 145 LEU H H 143 7.847 8.239 -0.392 1
1 1483 . 6 1 1 A 145 145 LEU HA H 143 3.919 3.837 0.082 1
1 1491 . 6 1 1 A 145 145 LEU C C 143 178.774 179.393 -0.619 1
1 1492 . 6 1 1 A 145 145 LEU CA C 143 57.877 58.068 -0.191 1
1 1493 . 6 1 1 A 145 145 LEU CB C 143 40.951 40.726 0.225 1
1 1497 . 6 1 1 A 145 145 LEU N N 143 119.410 120.382 -0.972 1
1 1498 . 6 1 1 A 146 146 ASP H H 144 8.431 8.538 -0.107 1
1 1499 . 6 1 1 A 146 146 ASP HA H 144 4.312 4.530 -0.218 1
1 1502 . 6 1 1 A 146 146 ASP C C 144 178.129 178.952 -0.823 1
1 1503 . 6 1 1 A 146 146 ASP CA C 144 57.464 58.023 -0.559 1
1 1504 . 6 1 1 A 146 146 ASP CB C 144 39.548 40.979 -1.431 1
1 1505 . 6 1 1 A 146 146 ASP N N 144 119.837 119.870 -0.033 1
1 1506 . 6 1 1 A 147 147 ARG H H 145 7.949 8.393 -0.444 1
1 1507 . 6 1 1 A 147 147 ARG HA H 145 4.050 4.138 -0.088 1
1 1512 . 6 1 1 A 147 147 ARG C C 145 179.547 178.896 0.651 1
1 1513 . 6 1 1 A 147 147 ARG CA C 145 58.972 59.580 -0.608 1
1 1514 . 6 1 1 A 147 147 ARG CB C 145 29.798 30.652 -0.854 1
1 1517 . 6 1 1 A 147 147 ARG N N 145 119.173 119.385 -0.212 1
1 1518 . 6 1 1 A 148 148 TYR H H 146 8.128 8.274 -0.146 1
1 1519 . 6 1 1 A 148 148 TYR HA H 146 3.995 4.403 -0.408 1
1 1524 . 6 1 1 A 148 148 TYR C C 146 178.199 177.604 0.595 1
1 1525 . 6 1 1 A 148 148 TYR CA C 146 62.347 61.429 0.918 1
1 1526 . 6 1 1 A 148 148 TYR CB C 146 37.418 37.627 -0.209 1
1 1529 . 6 1 1 A 148 148 TYR N N 146 120.102 121.212 -1.110 1
1 1530 . 6 1 1 A 149 149 PHE H H 147 8.308 8.429 -0.121 1
1 1531 . 6 1 1 A 149 149 PHE HA H 147 4.013 4.245 -0.232 1
1 1535 . 6 1 1 A 149 149 PHE C C 147 177.574 178.304 -0.730 1
1 1536 . 6 1 1 A 149 149 PHE CA C 147 63.044 61.531 1.513 1
1 1537 . 6 1 1 A 149 149 PHE CB C 147 37.153 38.215 -1.062 1
1 1541 . 6 1 1 A 149 149 PHE N N 147 116.680 118.167 -1.487 1
1 1542 . 6 1 1 A 150 150 GLU H H 148 8.271 8.975 -0.704 1
1 1543 . 6 1 1 A 150 150 GLU HA H 148 4.030 3.968 0.062 1
1 1547 . 6 1 1 A 150 150 GLU C C 148 177.687 178.745 -1.058 1
1 1548 . 6 1 1 A 150 150 GLU CA C 148 58.746 59.935 -1.189 1
1 1549 . 6 1 1 A 150 150 GLU CB C 148 28.847 29.086 -0.239 1
1 1551 . 6 1 1 A 150 150 GLU N N 148 119.973 119.511 0.462 1
1 1552 . 6 1 1 A 151 151 ALA H H 149 6.992 7.618 -0.626 1
1 1553 . 6 1 1 A 151 151 ALA HA H 149 4.217 4.171 0.046 1
1 1557 . 6 1 1 A 151 151 ALA C C 149 178.190 177.511 0.679 1
1 1558 . 6 1 1 A 151 151 ALA CA C 149 52.779 54.255 -1.476 1
1 1559 . 6 1 1 A 151 151 ALA CB C 149 19.087 18.852 0.235 1
1 1560 . 6 1 1 A 151 151 ALA N N 149 118.629 121.442 -2.813 1
1 1561 . 6 1 1 A 152 152 TYR H H 150 7.722 8.432 -0.710 1
1 1562 . 6 1 1 A 152 152 TYR HA H 150 4.137 4.881 -0.744 1
1 1567 . 6 1 1 A 152 152 TYR C C 150 175.703 173.392 2.311 1
1 1568 . 6 1 1 A 152 152 TYR CA C 150 59.260 57.103 2.157 1
1 1569 . 6 1 1 A 152 152 TYR CB C 150 39.165 40.502 -1.337 1
1 1572 . 6 1 1 A 152 152 TYR N N 150 118.767 115.494 3.273 1
1 1573 . 6 1 1 A 153 153 LEU H H 151 7.670 8.304 -0.634 1
1 1574 . 6 1 1 A 153 153 LEU HA H 151 4.145 4.487 -0.342 1
1 1584 . 6 1 1 A 153 153 LEU CA C 151 54.704 52.566 2.138 1
1 1585 . 6 1 1 A 153 153 LEU CB C 151 40.520 42.018 -1.498 1
1 1589 . 6 1 1 A 153 153 LEU N N 151 122.313 128.238 -5.925 1
1 1590 . 6 1 1 A 154 154 PRO HA H 152 4.258 4.565 -0.307 1
1 1597 . 6 1 1 A 154 154 PRO C C 152 177.496 177.223 0.273 1
1 1598 . 6 1 1 A 154 154 PRO CA C 152 63.899 63.547 0.352 1
1 1599 . 6 1 1 A 154 154 PRO CB C 152 31.080 32.148 -1.068 1
1 1602 . 6 1 1 A 155 155 GLN H H 153 8.023 8.042 -0.019 1
1 1603 . 6 1 1 A 155 155 GLN HA H 153 4.176 3.893 0.283 1
1 1607 . 6 1 1 A 155 155 GLN C C 153 176.636 174.820 1.816 1
1 1608 . 6 1 1 A 155 155 GLN CA C 153 55.968 56.898 -0.930 1
1 1609 . 6 1 1 A 155 155 GLN CB C 153 28.723 27.563 1.160 1
1 1610 . 6 1 1 A 155 155 GLN N N 153 119.173 118.036 1.137 1
1 1611 . 6 1 1 A 156 156 LYS H H 154 8.113 8.350 -0.237 1
1 1612 . 6 1 1 A 156 156 LYS HA H 154 4.196 3.855 0.341 1
1 1619 . 6 1 1 A 156 156 LYS C C 154 56.493 175.542 -119.049 1
1 1620 . 6 1 1 A 156 156 LYS CA C 154 56.493 57.175 -0.682 1
1 1621 . 6 1 1 A 156 156 LYS CB C 154 32.037 29.850 2.187 1
1 1625 . 6 1 1 A 156 156 LYS N N 154 122.788 111.743 11.045 1
1 1626 . 6 1 1 A 157 157 THR H H 155 8.013 7.464 0.549 1
1 1627 . 6 1 1 A 157 157 THR HA H 155 4.183 4.286 -0.103 1
1 1632 . 6 1 1 A 157 157 THR C C 155 174.580 175.783 -1.203 1
1 1633 . 6 1 1 A 157 157 THR CA C 155 61.958 62.303 -0.345 1
1 1634 . 6 1 1 A 157 157 THR CB C 155 69.665 69.802 -0.137 1
1 1636 . 6 1 1 A 157 157 THR N N 155 115.504 113.053 2.451 1
1 1637 . 6 1 1 A 158 158 ALA H H 156 8.170 8.831 -0.661 1
1 1638 . 6 1 1 A 158 158 ALA HA H 156 4.220 4.054 0.166 1
1 1642 . 6 1 1 A 158 158 ALA CA C 156 52.492 54.893 -2.401 1
1 1643 . 6 1 1 A 158 158 ALA CB C 156 18.810 18.890 -0.080 1
1 1644 . 6 1 1 A 158 158 ALA N N 156 126.825 129.135 -2.310 1
1 1645 . 6 1 1 A 159 159 SER H H 157 7.762 8.067 -0.305 1
1 1646 . 6 1 1 A 159 159 SER CA C 157 58.230 58.949 -0.719 1
1 1647 . 6 1 1 A 159 159 SER CB C 157 63.440 62.822 0.618 1
1 1648 . 6 1 1 A 159 159 SER N N 157 123.078 113.553 9.525 1
1 1649 . 6 1 1 A 162 162 HIS HA H 160 4.845 4.697 0.148 1
1 1652 . 6 1 1 A 162 162 HIS CA C 160 53.590 55.050 -1.460 1
1 1653 . 6 1 1 A 162 162 HIS CB C 160 29.398 30.184 -0.786 1
1 1654 . 6 1 1 A 163 163 PRO HA H 161 4.388 4.186 0.202 1
1 1660 . 6 1 1 A 163 163 PRO C C 161 177.018 176.577 0.441 1
1 1661 . 6 1 1 A 163 163 PRO CA C 161 63.118 65.344 -2.226 1
1 1662 . 6 1 1 A 163 163 PRO CB C 161 31.668 31.840 -0.172 1
1 1665 . 6 1 1 A 164 164 SER H H 162 8.418 8.070 0.348 1
1 1666 . 6 1 1 A 164 164 SER HA H 162 4.338 4.573 -0.235 1
1 1668 . 6 1 1 A 164 164 SER C C 162 173.327 174.132 -0.805 1
1 1669 . 6 1 1 A 164 164 SER CA C 162 58.202 59.420 -1.218 1
1 1670 . 6 1 1 A 164 164 SER CB C 162 64.080 64.353 -0.273 1
1 1671 . 6 1 1 A 164 164 SER N N 162 117.485 114.561 2.924 1
1 6 . 7 1 1 A 4 4 ALA H H 2 8.270 7.789 0.481 1
1 7 . 7 1 1 A 4 4 ALA HA H 2 4.212 4.391 -0.179 1
1 11 . 7 1 1 A 4 4 ALA C C 2 177.441 177.389 0.052 1
1 12 . 7 1 1 A 4 4 ALA CA C 2 52.280 52.252 0.028 1
1 13 . 7 1 1 A 4 4 ALA CB C 2 18.880 19.570 -0.690 1
1 14 . 7 1 1 A 4 4 ALA N N 2 126.500 122.086 4.414 1
1 15 . 7 1 1 A 5 5 ALA H H 3 8.251 8.338 -0.087 1
1 16 . 7 1 1 A 5 5 ALA HA H 3 4.261 4.546 -0.285 1
1 20 . 7 1 1 A 5 5 ALA C C 3 177.824 176.813 1.011 1
1 21 . 7 1 1 A 5 5 ALA CA C 3 52.347 51.784 0.563 1
1 22 . 7 1 1 A 5 5 ALA CB C 3 18.869 19.881 -1.012 1
1 23 . 7 1 1 A 5 5 ALA N N 3 124.322 123.736 0.586 1
1 24 . 7 1 1 A 6 6 SER H H 4 8.158 8.609 -0.451 1
1 25 . 7 1 1 A 6 6 SER HA H 4 4.358 5.185 -0.827 1
1 27 . 7 1 1 A 6 6 SER C C 4 175.222 173.847 1.375 1
1 28 . 7 1 1 A 6 6 SER CA C 4 58.438 56.246 2.192 1
1 29 . 7 1 1 A 6 6 SER CB C 4 63.859 65.808 -1.949 1
1 30 . 7 1 1 A 6 6 SER N N 4 115.338 114.973 0.365 1
1 31 . 7 1 1 A 7 7 GLY H H 5 8.265 8.664 -0.399 1
1 32 . 7 1 1 A 7 7 GLY HA2 H 5 3.900 4.065 -0.165 1
1 33 . 7 1 1 A 7 7 GLY C C 5 174.083 172.903 1.180 1
1 34 . 7 1 1 A 7 7 GLY CA C 5 45.113 44.544 0.569 1
1 35 . 7 1 1 A 7 7 GLY N N 5 111.360 113.738 -2.378 1
1 36 . 7 1 1 A 8 8 GLU H H 6 8.100 8.545 -0.445 1
1 37 . 7 1 1 A 8 8 GLU HA H 6 4.209 4.901 -0.692 1
1 41 . 7 1 1 A 8 8 GLU C C 6 176.354 176.140 0.214 1
1 42 . 7 1 1 A 8 8 GLU CA C 6 56.261 55.613 0.648 1
1 43 . 7 1 1 A 8 8 GLU CB C 6 29.830 31.955 -2.125 1
1 45 . 7 1 1 A 8 8 GLU N N 6 121.056 119.620 1.436 1
1 46 . 7 1 1 A 9 9 GLN H H 7 8.287 8.928 -0.641 1
1 47 . 7 1 1 A 9 9 GLN HA H 7 4.247 5.138 -0.891 1
1 51 . 7 1 1 A 9 9 GLN C C 7 172.457 174.041 -1.584 1
1 52 . 7 1 1 A 9 9 GLN CA C 7 55.269 54.440 0.829 1
1 53 . 7 1 1 A 9 9 GLN CB C 7 29.236 33.321 -4.085 1
1 55 . 7 1 1 A 9 9 GLN N N 7 122.164 119.813 2.351 1
1 56 . 7 1 1 A 10 10 ALA H H 8 8.368 8.298 0.070 1
1 57 . 7 1 1 A 10 10 ALA HA H 8 4.509 4.786 -0.277 1
1 61 . 7 1 1 A 10 10 ALA CA C 8 50.341 50.467 -0.126 1
1 62 . 7 1 1 A 10 10 ALA CB C 8 18.140 22.928 -4.788 1
1 63 . 7 1 1 A 10 10 ALA N N 8 128.028 121.135 6.893 1
1 64 . 7 1 1 A 11 11 PRO HA H 9 4.437 4.523 -0.086 1
1 70 . 7 1 1 A 11 11 PRO C C 9 176.381 176.949 -0.568 1
1 71 . 7 1 1 A 11 11 PRO CA C 9 63.298 62.448 0.850 1
1 72 . 7 1 1 A 11 11 PRO CB C 9 31.776 32.400 -0.624 1
1 75 . 7 1 1 A 12 12 CYS H H 10 8.056 8.354 -0.298 1
1 76 . 7 1 1 A 12 12 CYS HA H 10 4.717 4.562 0.155 1
1 79 . 7 1 1 A 12 12 CYS C C 10 173.266 174.533 -1.267 1
1 80 . 7 1 1 A 12 12 CYS CA C 10 57.398 59.077 -1.679 1
1 81 . 7 1 1 A 12 12 CYS CB C 10 29.165 29.051 0.114 1
1 82 . 7 1 1 A 12 12 CYS N N 10 118.295 119.480 -1.185 1
1 83 . 7 1 1 A 13 13 SER H H 11 9.815 8.687 1.128 1
1 84 . 7 1 1 A 13 13 SER HA H 11 5.227 5.199 0.028 1
1 87 . 7 1 1 A 13 13 SER C C 11 173.648 172.995 0.653 1
1 88 . 7 1 1 A 13 13 SER CA C 11 57.630 57.379 0.251 1
1 89 . 7 1 1 A 13 13 SER CB C 11 64.820 66.045 -1.225 1
1 90 . 7 1 1 A 13 13 SER N N 11 122.365 118.054 4.311 1
1 91 . 7 1 1 A 14 14 VAL H H 12 9.352 9.275 0.077 1
1 92 . 7 1 1 A 14 14 VAL HA H 12 4.696 5.309 -0.613 1
1 100 . 7 1 1 A 14 14 VAL C C 12 173.875 173.384 0.491 1
1 101 . 7 1 1 A 14 14 VAL CA C 12 60.146 60.923 -0.777 1
1 102 . 7 1 1 A 14 14 VAL CB C 12 34.499 35.898 -1.399 1
1 105 . 7 1 1 A 14 14 VAL N N 12 126.378 122.727 3.651 1
1 106 . 7 1 1 A 15 15 TYR H H 13 8.745 8.778 -0.033 1
1 111 . 7 1 1 A 15 15 TYR C C 13 173.345 173.724 -0.379 1
1 112 . 7 1 1 A 15 15 TYR CA C 13 56.186 54.065 2.121 1
1 113 . 7 1 1 A 15 15 TYR CB C 13 40.858 40.880 -0.022 1
1 116 . 7 1 1 A 15 15 TYR N N 13 129.472 128.309 1.163 1
1 117 . 7 1 1 A 16 16 PHE H H 14 7.370 8.879 -1.509 1
1 118 . 7 1 1 A 16 16 PHE HA H 14 5.720 5.326 0.394 1
1 123 . 7 1 1 A 16 16 PHE C C 14 174.058 174.170 -0.112 1
1 124 . 7 1 1 A 16 16 PHE CA C 14 54.361 56.314 -1.953 1
1 125 . 7 1 1 A 16 16 PHE CB C 14 40.461 40.665 -0.204 1
1 129 . 7 1 1 A 16 16 PHE N N 14 128.263 128.308 -0.045 1
1 130 . 7 1 1 A 17 17 CYS H H 15 8.147 8.775 -0.628 1
1 131 . 7 1 1 A 17 17 CYS CA C 15 56.570 57.330 -0.760 1
1 132 . 7 1 1 A 17 17 CYS CB C 15 29.690 29.544 0.146 1
1 133 . 7 1 1 A 17 17 CYS N N 15 126.188 124.613 1.575 1
1 134 . 7 1 1 A 18 18 GLY HA2 H 16 3.819 3.416 0.403 1
1 135 . 7 1 1 A 18 18 GLY C C 16 173.374 171.879 1.495 1
1 136 . 7 1 1 A 18 18 GLY CA C 16 45.510 44.225 1.285 1
1 137 . 7 1 1 A 19 19 SER H H 17 8.533 10.188 -1.655 1
1 138 . 7 1 1 A 19 19 SER HA H 17 4.505 4.928 -0.423 1
1 139 . 7 1 1 A 19 19 SER CA C 17 58.700 59.077 -0.377 1
1 140 . 7 1 1 A 19 19 SER CB C 17 63.810 64.014 -0.204 1
1 141 . 7 1 1 A 19 19 SER N N 17 117.300 116.258 1.042 1
1 142 . 7 1 1 A 20 20 ILE HA H 18 4.309 4.722 -0.413 1
1 152 . 7 1 1 A 20 20 ILE CA C 18 61.317 59.810 1.507 1
1 153 . 7 1 1 A 20 20 ILE CB C 18 38.302 39.678 -1.376 1
1 157 . 7 1 1 A 21 21 ARG HA H 19 4.172 4.115 0.057 1
1 160 . 7 1 1 A 21 21 ARG C C 19 177.118 176.925 0.193 1
1 161 . 7 1 1 A 21 21 ARG CA C 19 56.960 57.462 -0.502 1
1 162 . 7 1 1 A 21 21 ARG CB C 19 29.568 30.095 -0.527 1
1 165 . 7 1 1 A 22 22 GLY H H 20 8.685 8.338 0.347 1
1 166 . 7 1 1 A 22 22 GLY HA2 H 20 3.801 3.982 -0.181 1
1 167 . 7 1 1 A 22 22 GLY HA3 H 20 3.923 3.998 -0.075 1
1 168 . 7 1 1 A 22 22 GLY C C 20 174.814 174.227 0.587 1
1 169 . 7 1 1 A 22 22 GLY CA C 20 45.289 45.493 -0.204 1
1 170 . 7 1 1 A 22 22 GLY N N 20 110.145 106.590 3.555 1
1 171 . 7 1 1 A 23 23 GLY H H 21 8.058 7.431 0.627 1
1 172 . 7 1 1 A 23 23 GLY HA2 H 21 3.998 4.045 -0.047 1
1 173 . 7 1 1 A 23 23 GLY HA3 H 21 4.237 4.051 0.186 1
1 174 . 7 1 1 A 23 23 GLY C C 21 174.762 174.420 0.342 1
1 175 . 7 1 1 A 23 23 GLY CA C 21 45.025 45.692 -0.667 1
1 176 . 7 1 1 A 23 23 GLY N N 21 109.327 107.300 2.027 1
1 177 . 7 1 1 A 24 24 ARG H H 22 8.376 9.009 -0.633 1
1 178 . 7 1 1 A 24 24 ARG HA H 22 4.086 3.935 0.151 1
1 184 . 7 1 1 A 24 24 ARG C C 22 178.178 178.448 -0.270 1
1 185 . 7 1 1 A 24 24 ARG CA C 22 57.471 59.131 -1.660 1
1 186 . 7 1 1 A 24 24 ARG CB C 22 29.653 29.969 -0.316 1
1 189 . 7 1 1 A 24 24 ARG N N 22 120.861 125.151 -4.290 1
1 190 . 7 1 1 A 25 25 GLU H H 23 8.831 8.292 0.539 1
1 191 . 7 1 1 A 25 25 GLU HA H 23 4.015 4.000 0.015 1
1 195 . 7 1 1 A 25 25 GLU C C 23 178.005 178.568 -0.563 1
1 196 . 7 1 1 A 25 25 GLU CA C 23 58.920 59.427 -0.507 1
1 197 . 7 1 1 A 25 25 GLU CB C 23 28.592 29.103 -0.511 1
1 199 . 7 1 1 A 25 25 GLU N N 23 121.243 119.216 2.027 1
1 200 . 7 1 1 A 26 26 ASP H H 24 7.897 8.365 -0.468 1
1 201 . 7 1 1 A 26 26 ASP HA H 24 4.516 4.143 0.373 1
1 203 . 7 1 1 A 26 26 ASP C C 24 176.455 177.979 -1.524 1
1 204 . 7 1 1 A 26 26 ASP CA C 24 55.122 56.104 -0.982 1
1 205 . 7 1 1 A 26 26 ASP CB C 24 39.888 39.711 0.177 1
1 206 . 7 1 1 A 26 26 ASP N N 24 119.541 119.675 -0.134 1
1 207 . 7 1 1 A 27 27 GLN H H 25 7.696 8.128 -0.432 1
1 208 . 7 1 1 A 27 27 GLN HA H 25 3.704 4.039 -0.335 1
1 212 . 7 1 1 A 27 27 GLN C C 25 177.016 178.268 -1.252 1
1 213 . 7 1 1 A 27 27 GLN CA C 25 59.501 58.627 0.874 1
1 214 . 7 1 1 A 27 27 GLN CB C 25 27.762 28.598 -0.836 1
1 216 . 7 1 1 A 27 27 GLN N N 25 119.471 119.885 -0.414 1
1 217 . 7 1 1 A 28 28 ALA H H 26 8.227 7.686 0.541 1
1 218 . 7 1 1 A 28 28 ALA HA H 26 4.072 3.916 0.156 1
1 222 . 7 1 1 A 28 28 ALA C C 26 180.567 179.849 0.718 1
1 223 . 7 1 1 A 28 28 ALA CA C 26 54.627 55.195 -0.568 1
1 224 . 7 1 1 A 28 28 ALA CB C 26 17.355 18.642 -1.287 1
1 225 . 7 1 1 A 28 28 ALA N N 26 122.362 123.119 -0.757 1
1 226 . 7 1 1 A 29 29 LEU H H 27 7.533 7.785 -0.252 1
1 227 . 7 1 1 A 29 29 LEU HA H 27 4.050 4.033 0.017 1
1 237 . 7 1 1 A 29 29 LEU C C 27 178.752 177.998 0.754 1
1 238 . 7 1 1 A 29 29 LEU CA C 27 57.578 57.633 -0.055 1
1 239 . 7 1 1 A 29 29 LEU CB C 27 40.734 41.578 -0.844 1
1 243 . 7 1 1 A 29 29 LEU N N 27 122.255 119.698 2.557 1
1 244 . 7 1 1 A 30 30 TYR H H 28 8.473 8.188 0.285 1
1 245 . 7 1 1 A 30 30 TYR HA H 28 4.049 3.997 0.052 1
1 250 . 7 1 1 A 30 30 TYR C C 28 177.736 178.601 -0.865 1
1 251 . 7 1 1 A 30 30 TYR CA C 28 59.817 60.091 -0.274 1
1 252 . 7 1 1 A 30 30 TYR CB C 28 36.140 37.155 -1.015 1
1 255 . 7 1 1 A 30 30 TYR N N 28 120.403 118.412 1.991 1
1 256 . 7 1 1 A 31 31 ALA H H 29 8.008 8.660 -0.652 1
1 257 . 7 1 1 A 31 31 ALA HA H 29 4.005 4.024 -0.019 1
1 261 . 7 1 1 A 31 31 ALA C C 29 180.879 179.593 1.286 1
1 262 . 7 1 1 A 31 31 ALA CA C 29 54.914 55.287 -0.373 1
1 263 . 7 1 1 A 31 31 ALA CB C 29 17.375 18.135 -0.760 1
1 264 . 7 1 1 A 31 31 ALA N N 29 120.771 122.910 -2.139 1
1 265 . 7 1 1 A 32 32 ARG H H 30 7.596 7.633 -0.037 1
1 266 . 7 1 1 A 32 32 ARG HA H 30 3.916 4.033 -0.117 1
1 273 . 7 1 1 A 32 32 ARG C C 30 179.919 178.570 1.349 1
1 274 . 7 1 1 A 32 32 ARG CA C 30 59.014 59.079 -0.065 1
1 275 . 7 1 1 A 32 32 ARG CB C 30 30.531 29.618 0.913 1
1 278 . 7 1 1 A 32 32 ARG N N 30 120.365 118.222 2.143 1
1 279 . 7 1 1 A 33 33 ILE H H 31 8.066 8.339 -0.273 1
1 280 . 7 1 1 A 33 33 ILE HA H 31 3.120 3.582 -0.462 1
1 290 . 7 1 1 A 33 33 ILE C C 31 177.051 178.213 -1.162 1
1 291 . 7 1 1 A 33 33 ILE CA C 31 65.757 65.374 0.383 1
1 292 . 7 1 1 A 33 33 ILE CB C 31 36.928 37.751 -0.823 1
1 296 . 7 1 1 A 33 33 ILE N N 31 121.608 119.665 1.943 1
1 297 . 7 1 1 A 34 34 VAL H H 32 8.148 8.797 -0.649 1
1 298 . 7 1 1 A 34 34 VAL HA H 32 2.954 3.317 -0.363 1
1 306 . 7 1 1 A 34 34 VAL C C 32 177.159 177.876 -0.717 1
1 307 . 7 1 1 A 34 34 VAL CA C 32 67.220 66.109 1.111 1
1 308 . 7 1 1 A 34 34 VAL CB C 32 31.039 31.320 -0.281 1
1 311 . 7 1 1 A 34 34 VAL N N 32 119.318 119.961 -0.643 1
1 312 . 7 1 1 A 35 35 SER H H 33 7.826 8.183 -0.357 1
1 313 . 7 1 1 A 35 35 SER HA H 33 3.868 4.019 -0.151 1
1 316 . 7 1 1 A 35 35 SER C C 33 176.779 177.020 -0.241 1
1 317 . 7 1 1 A 35 35 SER CA C 33 62.000 61.430 0.570 1
1 318 . 7 1 1 A 35 35 SER CB C 33 62.789 62.516 0.273 1
1 319 . 7 1 1 A 35 35 SER N N 33 111.936 114.636 -2.700 1
1 320 . 7 1 1 A 36 36 ARG H H 34 7.405 7.572 -0.167 1
1 321 . 7 1 1 A 36 36 ARG HA H 34 4.070 3.975 0.095 1
1 323 . 7 1 1 A 36 36 ARG C C 34 178.047 178.021 0.026 1
1 324 . 7 1 1 A 36 36 ARG CA C 34 56.108 58.792 -2.684 1
1 325 . 7 1 1 A 36 36 ARG CB C 34 28.837 29.807 -0.970 1
1 326 . 7 1 1 A 36 36 ARG N N 34 120.909 121.898 -0.989 1
1 327 . 7 1 1 A 37 37 LEU H H 35 8.301 7.950 0.351 1
1 328 . 7 1 1 A 37 37 LEU HA H 35 3.620 3.734 -0.114 1
1 336 . 7 1 1 A 37 37 LEU C C 35 178.446 178.956 -0.510 1
1 337 . 7 1 1 A 37 37 LEU CA C 35 57.640 57.774 -0.134 1
1 338 . 7 1 1 A 37 37 LEU CB C 35 41.584 41.039 0.545 1
1 342 . 7 1 1 A 37 37 LEU N N 35 118.567 119.494 -0.927 1
1 343 . 7 1 1 A 38 38 ARG H H 36 7.379 8.777 -1.398 1
1 344 . 7 1 1 A 38 38 ARG HA H 36 4.340 3.829 0.511 1
1 350 . 7 1 1 A 38 38 ARG C C 36 177.895 178.876 -0.981 1
1 351 . 7 1 1 A 38 38 ARG CA C 36 57.785 59.405 -1.620 1
1 352 . 7 1 1 A 38 38 ARG CB C 36 29.775 29.797 -0.022 1
1 355 . 7 1 1 A 38 38 ARG N N 36 115.352 118.020 -2.668 1
1 356 . 7 1 1 A 39 39 ARG H H 37 7.240 7.481 -0.241 1
1 357 . 7 1 1 A 39 39 ARG HA H 37 3.743 4.210 -0.467 1
1 363 . 7 1 1 A 39 39 ARG C C 37 176.988 176.123 0.865 1
1 364 . 7 1 1 A 39 39 ARG CA C 37 57.605 59.003 -1.398 1
1 365 . 7 1 1 A 39 39 ARG CB C 37 28.925 30.631 -1.706 1
1 368 . 7 1 1 A 39 39 ARG N N 37 117.410 117.909 -0.499 1
1 369 . 7 1 1 A 40 40 TYR H H 38 7.296 7.299 -0.003 1
1 370 . 7 1 1 A 40 40 TYR HA H 38 4.319 4.935 -0.616 1
1 375 . 7 1 1 A 40 40 TYR C C 38 175.001 174.923 0.078 1
1 376 . 7 1 1 A 40 40 TYR CA C 38 57.730 55.822 1.908 1
1 377 . 7 1 1 A 40 40 TYR CB C 38 39.343 41.213 -1.870 1
1 380 . 7 1 1 A 40 40 TYR N N 38 116.937 116.019 0.918 1
1 381 . 7 1 1 A 41 41 GLY H H 39 7.325 8.653 -1.328 1
1 382 . 7 1 1 A 41 41 GLY HA2 H 39 3.953 3.723 0.230 1
1 383 . 7 1 1 A 41 41 GLY C C 39 171.302 174.612 -3.310 1
1 384 . 7 1 1 A 41 41 GLY CA C 39 45.590 46.780 -1.190 1
1 385 . 7 1 1 A 41 41 GLY N N 39 105.596 111.089 -5.493 1
1 386 . 7 1 1 A 42 42 LYS H H 40 8.186 7.633 0.553 1
1 387 . 7 1 1 A 42 42 LYS HA H 40 4.205 4.127 0.078 1
1 393 . 7 1 1 A 42 42 LYS C C 40 175.672 176.202 -0.530 1
1 394 . 7 1 1 A 42 42 LYS CA C 40 55.241 57.198 -1.957 1
1 395 . 7 1 1 A 42 42 LYS CB C 40 32.889 33.323 -0.434 1
1 399 . 7 1 1 A 42 42 LYS N N 40 120.341 121.078 -0.737 1
1 400 . 7 1 1 A 43 43 VAL H H 41 8.610 8.634 -0.024 1
1 401 . 7 1 1 A 43 43 VAL HA H 41 4.416 4.177 0.239 1
1 409 . 7 1 1 A 43 43 VAL C C 41 175.997 175.156 0.841 1
1 410 . 7 1 1 A 43 43 VAL CA C 41 61.331 62.907 -1.576 1
1 411 . 7 1 1 A 43 43 VAL CB C 41 30.573 30.891 -0.318 1
1 414 . 7 1 1 A 43 43 VAL N N 41 127.312 127.153 0.159 1
1 415 . 7 1 1 A 44 44 LEU H H 42 8.894 8.157 0.737 1
1 416 . 7 1 1 A 44 44 LEU HA H 42 4.496 3.655 0.841 1
1 424 . 7 1 1 A 44 44 LEU CA C 42 54.522 56.937 -2.415 1
1 425 . 7 1 1 A 44 44 LEU CB C 42 40.980 42.131 -1.151 1
1 429 . 7 1 1 A 44 44 LEU N N 42 130.261 128.685 1.576 1
1 430 . 7 1 1 A 45 45 THR HA H 43 4.263 4.265 -0.002 1
1 435 . 7 1 1 A 45 45 THR CA C 43 61.033 60.021 1.012 1
1 436 . 7 1 1 A 45 45 THR CB C 43 69.768 67.432 2.336 1
1 440 . 7 1 1 A 46 46 GLU CA C 44 56.411 57.287 -0.876 1
1 441 . 7 1 1 A 46 46 GLU CB C 44 29.827 29.699 0.128 1
1 443 . 7 1 1 A 47 47 HIS HA H 45 4.549 4.263 0.286 1
1 447 . 7 1 1 A 47 47 HIS C C 45 174.812 177.377 -2.565 1
1 448 . 7 1 1 A 47 47 HIS CA C 45 56.107 60.006 -3.899 1
1 449 . 7 1 1 A 47 47 HIS CB C 45 29.080 29.989 -0.909 1
1 451 . 7 1 1 A 48 48 VAL H H 46 7.826 8.318 -0.492 1
1 452 . 7 1 1 A 48 48 VAL HA H 46 4.024 3.634 0.390 1
1 460 . 7 1 1 A 48 48 VAL C C 46 175.697 177.912 -2.215 1
1 461 . 7 1 1 A 48 48 VAL CA C 46 61.841 66.865 -5.024 1
1 462 . 7 1 1 A 48 48 VAL CB C 46 32.600 31.630 0.970 1
1 465 . 7 1 1 A 48 48 VAL N N 46 121.117 119.608 1.509 1
1 466 . 7 1 1 A 49 49 ALA H H 47 8.237 8.354 -0.117 1
1 467 . 7 1 1 A 49 49 ALA HA H 47 4.281 4.422 -0.141 1
1 471 . 7 1 1 A 49 49 ALA C C 47 177.173 179.323 -2.150 1
1 472 . 7 1 1 A 49 49 ALA CA C 47 52.207 55.919 -3.712 1
1 473 . 7 1 1 A 49 49 ALA CB C 47 19.064 18.366 0.698 1
1 474 . 7 1 1 A 49 49 ALA N N 47 126.817 122.067 4.750 1
1 475 . 7 1 1 A 50 50 ASP H H 48 8.029 7.910 0.119 1
1 476 . 7 1 1 A 50 50 ASP HA H 48 4.436 4.601 -0.165 1
1 479 . 7 1 1 A 50 50 ASP C C 48 176.124 176.411 -0.287 1
1 480 . 7 1 1 A 50 50 ASP CA C 48 54.447 52.874 1.573 1
1 481 . 7 1 1 A 50 50 ASP CB C 48 40.877 38.806 2.071 1
1 482 . 7 1 1 A 50 50 ASP N N 48 119.687 117.721 1.966 1
1 483 . 7 1 1 A 51 51 ALA H H 49 8.094 8.857 -0.763 1
1 484 . 7 1 1 A 51 51 ALA HA H 49 4.134 4.451 -0.317 1
1 488 . 7 1 1 A 51 51 ALA C C 49 177.835 178.596 -0.761 1
1 489 . 7 1 1 A 51 51 ALA CA C 49 52.900 51.944 0.956 1
1 490 . 7 1 1 A 51 51 ALA CB C 49 18.942 20.995 -2.053 1
1 491 . 7 1 1 A 51 51 ALA N N 49 124.400 123.724 0.676 1
1 492 . 7 1 1 A 52 52 GLU H H 50 8.243 8.058 0.185 1
1 493 . 7 1 1 A 52 52 GLU HA H 50 4.152 4.219 -0.067 1
1 497 . 7 1 1 A 52 52 GLU C C 50 176.456 176.754 -0.298 1
1 498 . 7 1 1 A 52 52 GLU CA C 50 56.480 58.112 -1.632 1
1 499 . 7 1 1 A 52 52 GLU CB C 50 29.470 28.482 0.988 1
1 501 . 7 1 1 A 52 52 GLU N N 50 118.917 116.102 2.815 1
1 502 . 7 1 1 A 53 53 LEU H H 51 7.839 7.383 0.456 1
1 503 . 7 1 1 A 53 53 LEU HA H 51 4.229 4.410 -0.181 1
1 513 . 7 1 1 A 53 53 LEU C C 51 177.058 176.735 0.323 1
1 514 . 7 1 1 A 53 53 LEU CA C 51 54.625 53.907 0.718 1
1 515 . 7 1 1 A 53 53 LEU CB C 51 42.125 42.732 -0.607 1
1 519 . 7 1 1 A 53 53 LEU N N 51 122.169 118.017 4.152 1
1 520 . 7 1 1 A 54 54 GLU H H 52 8.104 8.603 -0.499 1
1 521 . 7 1 1 A 54 54 GLU HA H 52 4.470 4.366 0.104 1
1 525 . 7 1 1 A 54 54 GLU CA C 52 54.286 58.419 -4.133 1
1 526 . 7 1 1 A 54 54 GLU CB C 52 29.268 28.732 0.536 1
1 528 . 7 1 1 A 54 54 GLU N N 52 123.040 117.989 5.051 1
1 529 . 7 1 1 A 55 55 PRO HA H 53 4.310 4.460 -0.150 1
1 536 . 7 1 1 A 55 55 PRO C C 53 177.019 177.117 -0.098 1
1 537 . 7 1 1 A 55 55 PRO CA C 53 63.075 63.445 -0.370 1
1 538 . 7 1 1 A 55 55 PRO CB C 53 31.329 31.777 -0.448 1
1 541 . 7 1 1 A 56 56 LEU H H 54 8.263 8.354 -0.091 1
1 542 . 7 1 1 A 56 56 LEU HA H 54 4.237 4.487 -0.250 1
1 552 . 7 1 1 A 56 56 LEU C C 54 178.055 177.689 0.366 1
1 553 . 7 1 1 A 56 56 LEU CA C 54 55.018 54.714 0.304 1
1 554 . 7 1 1 A 56 56 LEU CB C 54 41.990 42.180 -0.190 1
1 558 . 7 1 1 A 56 56 LEU N N 54 122.728 120.227 2.501 1
1 559 . 7 1 1 A 57 57 GLY H H 55 8.231 8.166 0.065 1
1 560 . 7 1 1 A 57 57 GLY HA2 H 55 3.911 4.049 -0.138 1
1 561 . 7 1 1 A 57 57 GLY HA3 H 55 3.808 4.060 -0.252 1
1 562 . 7 1 1 A 57 57 GLY C C 55 174.379 175.066 -0.687 1
1 563 . 7 1 1 A 57 57 GLY CA C 55 45.092 45.647 -0.555 1
1 564 . 7 1 1 A 57 57 GLY N N 55 110.035 109.011 1.024 1
1 565 . 7 1 1 A 58 58 GLU H H 56 8.241 8.827 -0.586 1
1 566 . 7 1 1 A 58 58 GLU HA H 56 4.136 4.205 -0.069 1
1 570 . 7 1 1 A 58 58 GLU C C 56 176.868 178.194 -1.326 1
1 571 . 7 1 1 A 58 58 GLU CA C 56 56.734 59.592 -2.858 1
1 572 . 7 1 1 A 58 58 GLU CB C 56 29.584 29.429 0.155 1
1 574 . 7 1 1 A 58 58 GLU N N 56 121.173 121.099 0.074 1
1 575 . 7 1 1 A 59 59 GLU H H 57 8.419 7.906 0.513 1
1 576 . 7 1 1 A 59 59 GLU HA H 57 4.074 4.260 -0.186 1
1 580 . 7 1 1 A 59 59 GLU C C 57 176.502 177.134 -0.632 1
1 581 . 7 1 1 A 59 59 GLU CA C 57 56.842 57.860 -1.018 1
1 582 . 7 1 1 A 59 59 GLU CB C 57 29.267 29.531 -0.264 1
1 584 . 7 1 1 A 59 59 GLU N N 57 121.777 118.615 3.162 1
1 585 . 7 1 1 A 60 60 ALA H H 58 8.077 8.461 -0.384 1
1 586 . 7 1 1 A 60 60 ALA HA H 58 4.134 4.341 -0.207 1
1 590 . 7 1 1 A 60 60 ALA CA C 58 52.432 52.254 0.178 1
1 591 . 7 1 1 A 60 60 ALA CB C 58 18.743 19.906 -1.163 1
1 592 . 7 1 1 A 60 60 ALA N N 58 125.120 123.318 1.802 1
1 593 . 7 1 1 A 61 61 ALA H H 59 8.041 8.304 -0.263 1
1 594 . 7 1 1 A 61 61 ALA HA H 59 4.131 4.217 -0.086 1
1 598 . 7 1 1 A 61 61 ALA C C 59 178.147 177.832 0.315 1
1 599 . 7 1 1 A 61 61 ALA CA C 59 52.586 52.685 -0.099 1
1 600 . 7 1 1 A 61 61 ALA CB C 59 18.692 19.541 -0.849 1
1 601 . 7 1 1 A 61 61 ALA N N 59 123.857 121.115 2.742 1
1 602 . 7 1 1 A 62 62 GLY H H 60 8.069 8.451 -0.382 1
1 603 . 7 1 1 A 62 62 GLY HA2 H 60 3.810 3.844 -0.034 1
1 604 . 7 1 1 A 62 62 GLY HA3 H 60 3.888 3.857 0.031 1
1 605 . 7 1 1 A 62 62 GLY C C 60 174.914 175.468 -0.554 1
1 606 . 7 1 1 A 62 62 GLY CA C 60 45.320 46.336 -1.016 1
1 607 . 7 1 1 A 62 62 GLY N N 60 107.924 107.440 0.484 1
1 608 . 7 1 1 A 63 63 GLY H H 61 8.118 8.485 -0.367 1
1 609 . 7 1 1 A 63 63 GLY HA2 H 61 4.008 4.120 -0.112 1
1 610 . 7 1 1 A 63 63 GLY HA3 H 61 3.893 4.185 -0.292 1
1 611 . 7 1 1 A 63 63 GLY C C 61 174.743 175.712 -0.969 1
1 612 . 7 1 1 A 63 63 GLY CA C 61 45.202 45.443 -0.241 1
1 613 . 7 1 1 A 63 63 GLY N N 61 109.441 112.351 -2.910 1
1 614 . 7 1 1 A 64 64 ASP H H 62 8.305 8.483 -0.178 1
1 615 . 7 1 1 A 64 64 ASP HA H 62 4.240 4.356 -0.116 1
1 618 . 7 1 1 A 64 64 ASP C C 62 177.571 179.216 -1.645 1
1 619 . 7 1 1 A 64 64 ASP CA C 62 57.210 56.952 0.258 1
1 620 . 7 1 1 A 64 64 ASP CB C 62 40.142 40.040 0.102 1
1 621 . 7 1 1 A 64 64 ASP N N 62 121.568 121.751 -0.183 1
1 622 . 7 1 1 A 65 65 GLN H H 63 8.337 7.847 0.490 1
1 623 . 7 1 1 A 65 65 GLN HA H 63 4.138 4.076 0.062 1
1 628 . 7 1 1 A 65 65 GLN C C 63 177.490 178.547 -1.057 1
1 629 . 7 1 1 A 65 65 GLN CA C 63 58.643 58.583 0.060 1
1 630 . 7 1 1 A 65 65 GLN CB C 63 27.803 28.764 -0.961 1
1 632 . 7 1 1 A 65 65 GLN N N 63 119.700 119.101 0.599 1
1 633 . 7 1 1 A 66 66 PHE H H 64 7.658 8.290 -0.632 1
1 634 . 7 1 1 A 66 66 PHE HA H 64 4.170 4.144 0.026 1
1 638 . 7 1 1 A 66 66 PHE C C 64 176.872 177.216 -0.344 1
1 639 . 7 1 1 A 66 66 PHE CA C 64 60.158 60.928 -0.770 1
1 640 . 7 1 1 A 66 66 PHE CB C 64 38.490 39.365 -0.875 1
1 643 . 7 1 1 A 66 66 PHE N N 64 121.036 120.590 0.446 1
1 644 . 7 1 1 A 67 67 ILE H H 65 7.646 8.871 -1.225 1
1 645 . 7 1 1 A 67 67 ILE HA H 65 3.426 3.156 0.270 1
1 655 . 7 1 1 A 67 67 ILE CA C 65 63.377 64.361 -0.984 1
1 656 . 7 1 1 A 67 67 ILE CB C 65 37.057 37.787 -0.730 1
1 660 . 7 1 1 A 67 67 ILE N N 65 121.372 119.017 2.355 1
1 661 . 7 1 1 A 68 68 HIS H H 66 7.945 8.305 -0.360 1
1 662 . 7 1 1 A 68 68 HIS HA H 66 4.005 4.114 -0.109 1
1 665 . 7 1 1 A 68 68 HIS CA C 66 59.915 59.874 0.041 1
1 668 . 7 1 1 A 68 68 HIS N N 66 120.036 119.303 0.733 1
1 669 . 7 1 1 A 69 69 GLU HA H 67 3.677 3.709 -0.032 1
1 673 . 7 1 1 A 69 69 GLU CA C 67 58.490 59.610 -1.120 1
1 674 . 7 1 1 A 69 69 GLU CB C 67 29.290 29.007 0.283 1
1 676 . 7 1 1 A 70 70 GLN H H 68 8.017 7.618 0.399 1
1 677 . 7 1 1 A 70 70 GLN HA H 68 3.426 3.762 -0.336 1
1 678 . 7 1 1 A 70 70 GLN C C 68 179.280 178.432 0.848 1
1 679 . 7 1 1 A 70 70 GLN CA C 68 57.561 58.554 -0.993 1
1 680 . 7 1 1 A 70 70 GLN CB C 68 28.530 28.209 0.321 1
1 682 . 7 1 1 A 70 70 GLN N N 68 120.410 118.681 1.729 1
1 683 . 7 1 1 A 71 71 ASP HA H 69 4.440 4.634 -0.194 1
1 684 . 7 1 1 A 71 71 ASP C C 69 177.402 178.527 -1.125 1
1 685 . 7 1 1 A 71 71 ASP CA C 69 56.290 57.252 -0.962 1
1 686 . 7 1 1 A 72 72 LEU H H 70 7.952 8.164 -0.212 1
1 687 . 7 1 1 A 72 72 LEU HA H 70 3.775 3.848 -0.073 1
1 697 . 7 1 1 A 72 72 LEU C C 70 178.316 177.974 0.342 1
1 698 . 7 1 1 A 72 72 LEU CA C 70 56.101 57.294 -1.193 1
1 699 . 7 1 1 A 72 72 LEU CB C 70 39.872 41.304 -1.432 1
1 703 . 7 1 1 A 72 72 LEU N N 70 120.832 121.007 -0.175 1
1 704 . 7 1 1 A 73 73 ASN H H 71 7.723 8.043 -0.320 1
1 705 . 7 1 1 A 73 73 ASN HA H 71 4.270 4.237 0.033 1
1 708 . 7 1 1 A 73 73 ASN C C 71 178.193 177.565 0.628 1
1 709 . 7 1 1 A 73 73 ASN CA C 71 55.970 56.177 -0.207 1
1 710 . 7 1 1 A 73 73 ASN CB C 71 37.640 39.206 -1.566 1
1 711 . 7 1 1 A 73 73 ASN N N 71 119.295 117.285 2.010 1
1 712 . 7 1 1 A 74 74 TRP H H 72 7.811 8.096 -0.285 1
1 713 . 7 1 1 A 74 74 TRP HA H 72 4.500 4.445 0.055 1
1 720 . 7 1 1 A 74 74 TRP CA C 72 58.480 59.578 -1.098 1
1 721 . 7 1 1 A 74 74 TRP CB C 72 28.920 29.430 -0.510 1
1 727 . 7 1 1 A 74 74 TRP N N 72 121.490 120.543 0.947 1
1 729 . 7 1 1 A 75 75 LEU H H 73 8.412 7.926 0.486 1
1 730 . 7 1 1 A 75 75 LEU HA H 73 3.290 3.419 -0.129 1
1 739 . 7 1 1 A 75 75 LEU C C 73 178.562 178.503 0.059 1
1 740 . 7 1 1 A 75 75 LEU CA C 73 58.226 57.456 0.770 1
1 741 . 7 1 1 A 75 75 LEU CB C 73 41.200 41.063 0.137 1
1 745 . 7 1 1 A 75 75 LEU N N 73 121.065 121.034 0.031 1
1 746 . 7 1 1 A 76 76 GLN H H 74 7.648 7.710 -0.062 1
1 747 . 7 1 1 A 76 76 GLN HA H 74 3.657 4.002 -0.345 1
1 752 . 7 1 1 A 76 76 GLN C C 74 178.616 177.884 0.732 1
1 753 . 7 1 1 A 76 76 GLN CA C 74 58.777 59.005 -0.228 1
1 754 . 7 1 1 A 76 76 GLN CB C 74 28.163 28.453 -0.290 1
1 756 . 7 1 1 A 76 76 GLN N N 74 113.985 118.832 -4.847 1
1 757 . 7 1 1 A 77 77 GLN H H 75 7.465 7.666 -0.201 1
1 758 . 7 1 1 A 77 77 GLN HA H 75 4.134 4.433 -0.299 1
1 761 . 7 1 1 A 77 77 GLN C C 75 176.223 175.964 0.259 1
1 762 . 7 1 1 A 77 77 GLN CA C 75 56.203 55.978 0.225 1
1 763 . 7 1 1 A 77 77 GLN CB C 75 29.524 29.407 0.117 1
1 765 . 7 1 1 A 77 77 GLN N N 75 117.481 116.362 1.119 1
1 766 . 7 1 1 A 78 78 ALA H H 76 7.420 7.205 0.215 1
1 767 . 7 1 1 A 78 78 ALA HA H 76 3.864 4.254 -0.390 1
1 771 . 7 1 1 A 78 78 ALA C C 76 176.733 177.477 -0.744 1
1 772 . 7 1 1 A 78 78 ALA CA C 76 52.529 52.845 -0.316 1
1 773 . 7 1 1 A 78 78 ALA CB C 76 20.124 19.134 0.990 1
1 774 . 7 1 1 A 78 78 ALA N N 76 122.682 123.379 -0.697 1
1 775 . 7 1 1 A 79 79 ASP H H 77 9.028 8.821 0.207 1
1 776 . 7 1 1 A 79 79 ASP HA H 77 4.673 4.593 0.080 1
1 779 . 7 1 1 A 79 79 ASP C C 77 175.740 176.485 -0.745 1
1 780 . 7 1 1 A 79 79 ASP CA C 77 56.383 57.394 -1.011 1
1 781 . 7 1 1 A 79 79 ASP CB C 77 42.826 42.526 0.300 1
1 782 . 7 1 1 A 79 79 ASP N N 77 119.887 123.249 -3.362 1
1 783 . 7 1 1 A 80 80 VAL H H 78 7.379 7.870 -0.491 1
1 784 . 7 1 1 A 80 80 VAL HA H 78 4.340 4.828 -0.488 1
1 792 . 7 1 1 A 80 80 VAL C C 78 175.321 174.419 0.902 1
1 793 . 7 1 1 A 80 80 VAL CA C 78 60.011 60.437 -0.426 1
1 794 . 7 1 1 A 80 80 VAL CB C 78 35.362 36.310 -0.948 1
1 797 . 7 1 1 A 80 80 VAL N N 78 114.152 117.633 -3.481 1
1 798 . 7 1 1 A 81 81 VAL H H 79 8.350 8.251 0.099 1
1 799 . 7 1 1 A 81 81 VAL HA H 79 4.799 4.951 -0.152 1
1 807 . 7 1 1 A 81 81 VAL C C 79 173.095 174.730 -1.635 1
1 808 . 7 1 1 A 81 81 VAL CA C 79 60.775 60.725 0.050 1
1 809 . 7 1 1 A 81 81 VAL CB C 79 32.824 35.566 -2.742 1
1 812 . 7 1 1 A 81 81 VAL N N 79 128.429 125.636 2.793 1
1 813 . 7 1 1 A 82 82 VAL H H 80 8.947 9.373 -0.426 1
1 814 . 7 1 1 A 82 82 VAL HA H 80 4.947 5.058 -0.111 1
1 822 . 7 1 1 A 82 82 VAL C C 80 173.522 174.611 -1.089 1
1 823 . 7 1 1 A 82 82 VAL CA C 80 59.684 59.929 -0.245 1
1 824 . 7 1 1 A 82 82 VAL CB C 80 33.702 35.759 -2.057 1
1 827 . 7 1 1 A 82 82 VAL N N 80 126.957 125.379 1.578 1
1 828 . 7 1 1 A 83 83 ALA H H 81 9.011 8.421 0.590 1
1 829 . 7 1 1 A 83 83 ALA HA H 81 4.938 4.847 0.091 1
1 833 . 7 1 1 A 83 83 ALA C C 81 130.330 175.893 -45.563 1
1 834 . 7 1 1 A 83 83 ALA CA C 81 49.490 51.852 -2.362 1
1 835 . 7 1 1 A 83 83 ALA CB C 81 23.628 22.451 1.177 1
1 836 . 7 1 1 A 83 83 ALA N N 81 128.705 124.998 3.707 1
1 837 . 7 1 1 A 84 84 GLU H H 82 8.922 8.780 0.142 1
1 838 . 7 1 1 A 84 84 GLU HA H 82 4.937 5.050 -0.113 1
1 839 . 7 1 1 A 84 84 GLU C C 82 177.673 177.559 0.114 1
1 840 . 7 1 1 A 84 84 GLU CA C 82 56.714 56.579 0.135 1
1 841 . 7 1 1 A 84 84 GLU CB C 82 29.882 30.451 -0.569 1
1 842 . 7 1 1 A 84 84 GLU N N 82 130.330 123.582 6.748 1
1 843 . 7 1 1 A 85 85 VAL H H 83 8.427 8.658 -0.231 1
1 844 . 7 1 1 A 85 85 VAL HA H 83 4.435 4.615 -0.180 1
1 852 . 7 1 1 A 85 85 VAL C C 83 174.252 176.776 -2.524 1
1 853 . 7 1 1 A 85 85 VAL CA C 83 59.896 61.224 -1.328 1
1 854 . 7 1 1 A 85 85 VAL CB C 83 29.968 31.951 -1.983 1
1 857 . 7 1 1 A 85 85 VAL N N 83 114.212 120.397 -6.185 1
1 858 . 7 1 1 A 86 86 THR H H 84 9.347 7.825 1.522 1
1 859 . 7 1 1 A 86 86 THR HA H 84 4.146 4.255 -0.109 1
1 864 . 7 1 1 A 86 86 THR C C 84 175.751 174.864 0.887 1
1 865 . 7 1 1 A 86 86 THR CA C 84 67.629 65.327 2.302 1
1 866 . 7 1 1 A 86 86 THR CB C 84 66.819 69.147 -2.328 1
1 868 . 7 1 1 A 86 86 THR N N 84 121.640 118.954 2.686 1
1 869 . 7 1 1 A 87 87 GLN H H 85 8.114 8.082 0.032 1
1 870 . 7 1 1 A 87 87 GLN HA H 85 4.736 4.680 0.056 1
1 874 . 7 1 1 A 87 87 GLN CA C 85 51.898 54.209 -2.311 1
1 875 . 7 1 1 A 87 87 GLN CB C 85 27.942 29.622 -1.680 1
1 877 . 7 1 1 A 87 87 GLN N N 85 120.367 122.783 -2.416 1
1 878 . 7 1 1 A 88 88 PRO HA H 86 4.061 4.445 -0.384 1
1 885 . 7 1 1 A 88 88 PRO C C 86 176.436 175.468 0.968 1
1 886 . 7 1 1 A 88 88 PRO CA C 86 63.422 63.468 -0.046 1
1 887 . 7 1 1 A 88 88 PRO CB C 86 31.925 32.090 -0.165 1
1 889 . 7 1 1 A 89 89 SER H H 87 6.044 8.833 -2.789 1
1 890 . 7 1 1 A 89 89 SER HA H 87 4.630 5.040 -0.410 1
1 893 . 7 1 1 A 89 89 SER C C 87 175.612 174.250 1.362 1
1 894 . 7 1 1 A 89 89 SER CA C 87 56.800 57.047 -0.247 1
1 895 . 7 1 1 A 89 89 SER CB C 87 64.196 65.382 -1.186 1
1 896 . 7 1 1 A 89 89 SER N N 87 115.721 118.569 -2.848 1
1 897 . 7 1 1 A 90 90 LEU H H 88 9.702 8.920 0.782 1
1 898 . 7 1 1 A 90 90 LEU HA H 88 4.270 3.981 0.289 1
1 906 . 7 1 1 A 90 90 LEU C C 88 179.173 179.131 0.042 1
1 907 . 7 1 1 A 90 90 LEU CA C 88 57.402 58.153 -0.751 1
1 908 . 7 1 1 A 90 90 LEU CB C 88 43.642 41.925 1.717 1
1 911 . 7 1 1 A 90 90 LEU N N 88 130.488 130.182 0.306 1
1 912 . 7 1 1 A 91 91 GLY H H 89 8.354 8.369 -0.015 1
1 913 . 7 1 1 A 91 91 GLY HA2 H 89 3.680 3.758 -0.078 1
1 914 . 7 1 1 A 91 91 GLY HA3 H 89 3.584 3.769 -0.185 1
1 915 . 7 1 1 A 91 91 GLY C C 89 175.106 176.504 -1.398 1
1 916 . 7 1 1 A 91 91 GLY CA C 89 47.770 47.550 0.220 1
1 917 . 7 1 1 A 91 91 GLY N N 89 107.522 106.110 1.412 1
1 918 . 7 1 1 A 92 92 VAL H H 90 7.906 8.045 -0.139 1
1 919 . 7 1 1 A 92 92 VAL HA H 90 3.940 3.727 0.213 1
1 927 . 7 1 1 A 92 92 VAL C C 90 178.467 178.620 -0.153 1
1 928 . 7 1 1 A 92 92 VAL CA C 90 65.379 66.543 -1.164 1
1 929 . 7 1 1 A 92 92 VAL CB C 90 31.785 31.755 0.030 1
1 932 . 7 1 1 A 92 92 VAL N N 90 121.741 121.796 -0.055 1
1 933 . 7 1 1 A 93 93 GLY H H 91 7.595 8.003 -0.408 1
1 934 . 7 1 1 A 93 93 GLY HA2 H 91 3.628 3.853 -0.225 1
1 935 . 7 1 1 A 93 93 GLY HA3 H 91 3.415 3.862 -0.447 1
1 936 . 7 1 1 A 93 93 GLY C C 91 174.022 175.549 -1.527 1
1 937 . 7 1 1 A 93 93 GLY CA C 91 48.319 47.250 1.069 1
1 938 . 7 1 1 A 93 93 GLY N N 91 104.629 107.716 -3.087 1
1 939 . 7 1 1 A 94 94 TYR H H 92 8.372 8.259 0.113 1
1 940 . 7 1 1 A 94 94 TYR HA H 92 4.046 4.073 -0.027 1
1 943 . 7 1 1 A 94 94 TYR C C 92 177.458 177.839 -0.381 1
1 944 . 7 1 1 A 94 94 TYR CA C 92 61.760 60.657 1.103 1
1 945 . 7 1 1 A 94 94 TYR CB C 92 38.431 38.675 -0.244 1
1 948 . 7 1 1 A 94 94 TYR N N 92 123.383 123.172 0.211 1
1 949 . 7 1 1 A 95 95 GLU H H 93 8.424 8.324 0.100 1
1 950 . 7 1 1 A 95 95 GLU HA H 93 3.421 3.688 -0.267 1
1 951 . 7 1 1 A 95 95 GLU C C 93 178.590 178.972 -0.382 1
1 952 . 7 1 1 A 95 95 GLU CA C 93 60.211 59.116 1.095 1
1 953 . 7 1 1 A 95 95 GLU CB C 93 29.025 28.895 0.130 1
1 954 . 7 1 1 A 95 95 GLU N N 93 120.181 118.507 1.674 1
1 955 . 7 1 1 A 96 96 LEU H H 94 8.210 8.307 -0.097 1
1 956 . 7 1 1 A 96 96 LEU HA H 94 3.830 3.891 -0.061 1
1 964 . 7 1 1 A 96 96 LEU C C 94 179.032 178.802 0.230 1
1 965 . 7 1 1 A 96 96 LEU CA C 94 57.683 57.770 -0.087 1
1 966 . 7 1 1 A 96 96 LEU CB C 94 41.883 41.961 -0.078 1
1 970 . 7 1 1 A 96 96 LEU N N 94 118.091 120.982 -2.891 1
1 971 . 7 1 1 A 97 97 GLY H H 95 8.773 8.707 0.066 1
1 972 . 7 1 1 A 97 97 GLY C C 95 175.344 175.389 -0.045 1
1 973 . 7 1 1 A 97 97 GLY CA C 95 47.308 46.828 0.480 1
1 974 . 7 1 1 A 97 97 GLY N N 95 108.085 106.128 1.957 1
1 975 . 7 1 1 A 98 98 ARG H H 96 8.100 8.623 -0.523 1
1 976 . 7 1 1 A 98 98 ARG C C 96 179.692 177.888 1.804 1
1 977 . 7 1 1 A 98 98 ARG CA C 96 56.308 58.763 -2.455 1
1 978 . 7 1 1 A 98 98 ARG CB C 96 26.854 29.700 -2.846 1
1 979 . 7 1 1 A 98 98 ARG N N 96 118.156 121.789 -3.633 1
1 980 . 7 1 1 A 99 99 ALA H H 97 8.498 7.674 0.824 1
1 981 . 7 1 1 A 99 99 ALA HA H 97 3.640 3.986 -0.346 1
1 985 . 7 1 1 A 99 99 ALA C C 97 179.650 180.745 -1.095 1
1 986 . 7 1 1 A 99 99 ALA CA C 97 55.166 55.071 0.095 1
1 987 . 7 1 1 A 99 99 ALA CB C 97 18.604 18.476 0.128 1
1 988 . 7 1 1 A 99 99 ALA N N 97 122.310 121.763 0.547 1
1 989 . 7 1 1 A 100 100 VAL H H 98 8.597 8.409 0.188 1
1 990 . 7 1 1 A 100 100 VAL HA H 98 3.798 3.535 0.263 1
1 998 . 7 1 1 A 100 100 VAL C C 98 180.464 178.109 2.355 1
1 999 . 7 1 1 A 100 100 VAL CA C 98 65.664 66.568 -0.904 1
1 1000 . 7 1 1 A 100 100 VAL CB C 98 31.065 31.364 -0.299 1
1 1003 . 7 1 1 A 100 100 VAL N N 98 120.603 119.277 1.326 1
1 1004 . 7 1 1 A 101 101 ALA H H 99 7.280 7.821 -0.541 1
1 1005 . 7 1 1 A 101 101 ALA HA H 99 3.963 4.081 -0.118 1
1 1009 . 7 1 1 A 101 101 ALA C C 99 179.314 178.698 0.616 1
1 1010 . 7 1 1 A 101 101 ALA CA C 99 54.367 54.826 -0.459 1
1 1011 . 7 1 1 A 101 101 ALA CB C 99 18.139 18.928 -0.789 1
1 1012 . 7 1 1 A 101 101 ALA N N 99 124.450 121.993 2.457 1
1 1013 . 7 1 1 A 102 102 LEU H H 100 7.200 7.685 -0.485 1
1 1014 . 7 1 1 A 102 102 LEU HA H 100 4.192 4.550 -0.358 1
1 1024 . 7 1 1 A 102 102 LEU C C 100 177.306 177.262 0.044 1
1 1025 . 7 1 1 A 102 102 LEU CA C 100 54.808 55.360 -0.552 1
1 1026 . 7 1 1 A 102 102 LEU CB C 100 42.880 43.928 -1.048 1
1 1030 . 7 1 1 A 102 102 LEU N N 100 116.834 112.459 4.375 1
1 1031 . 7 1 1 A 103 103 GLY H H 101 7.891 7.490 0.401 1
1 1032 . 7 1 1 A 103 103 GLY HA2 H 101 3.941 3.982 -0.041 1
1 1033 . 7 1 1 A 103 103 GLY HA3 H 101 3.831 3.989 -0.158 1
1 1034 . 7 1 1 A 103 103 GLY C C 101 175.137 173.281 1.856 1
1 1035 . 7 1 1 A 103 103 GLY CA C 101 45.673 45.399 0.274 1
1 1036 . 7 1 1 A 103 103 GLY N N 101 109.395 108.647 0.748 1
1 1037 . 7 1 1 A 104 104 LYS H H 102 7.337 8.235 -0.898 1
1 1038 . 7 1 1 A 104 104 LYS HA H 102 4.402 4.678 -0.276 1
1 1043 . 7 1 1 A 104 104 LYS CA C 102 52.136 54.180 -2.044 1
1 1044 . 7 1 1 A 104 104 LYS CB C 102 31.045 33.814 -2.769 1
1 1047 . 7 1 1 A 104 104 LYS N N 102 118.954 120.391 -1.437 1
1 1048 . 7 1 1 A 105 105 PRO HA H 103 4.781 4.430 0.351 1
1 1054 . 7 1 1 A 105 105 PRO CA C 103 62.791 63.418 -0.627 1
1 1055 . 7 1 1 A 105 105 PRO CB C 103 30.405 32.042 -1.637 1
1 1058 . 7 1 1 A 106 106 ILE H H 104 8.261 9.285 -1.024 1
1 1059 . 7 1 1 A 106 106 ILE HA H 104 4.680 4.894 -0.214 1
1 1069 . 7 1 1 A 106 106 ILE C C 104 175.543 174.013 1.530 1
1 1070 . 7 1 1 A 106 106 ILE CA C 104 59.362 59.982 -0.620 1
1 1071 . 7 1 1 A 106 106 ILE CB C 104 43.738 39.933 3.805 1
1 1075 . 7 1 1 A 106 106 ILE N N 104 123.509 124.278 -0.769 1
1 1076 . 7 1 1 A 107 107 LEU H H 105 8.584 8.560 0.024 1
1 1077 . 7 1 1 A 107 107 LEU HA H 105 4.243 4.584 -0.341 1
1 1087 . 7 1 1 A 107 107 LEU C C 105 174.204 174.729 -0.525 1
1 1088 . 7 1 1 A 107 107 LEU CA C 105 52.863 53.109 -0.246 1
1 1089 . 7 1 1 A 107 107 LEU CB C 105 42.408 44.769 -2.361 1
1 1093 . 7 1 1 A 107 107 LEU N N 105 131.882 128.898 2.984 1
1 1094 . 7 1 1 A 108 108 CYS H H 106 8.679 8.973 -0.294 1
1 1095 . 7 1 1 A 108 108 CYS HA H 106 5.280 5.394 -0.114 1
1 1099 . 7 1 1 A 108 108 CYS C C 106 173.134 173.640 -0.506 1
1 1100 . 7 1 1 A 108 108 CYS CA C 106 57.290 57.141 0.149 1
1 1101 . 7 1 1 A 108 108 CYS CB C 106 29.559 29.947 -0.388 1
1 1102 . 7 1 1 A 108 108 CYS N N 106 122.904 125.880 -2.976 1
1 1103 . 7 1 1 A 109 109 LEU H H 107 8.987 8.643 0.344 1
1 1104 . 7 1 1 A 109 109 LEU HA H 107 5.120 5.789 -0.669 1
1 1112 . 7 1 1 A 109 109 LEU C C 107 174.500 175.748 -1.248 1
1 1113 . 7 1 1 A 109 109 LEU CA C 107 53.274 53.868 -0.594 1
1 1114 . 7 1 1 A 109 109 LEU CB C 107 43.450 45.593 -2.143 1
1 1118 . 7 1 1 A 109 109 LEU N N 107 124.653 122.392 2.261 1
1 1119 . 7 1 1 A 110 110 PHE H H 108 8.981 9.212 -0.231 1
1 1120 . 7 1 1 A 110 110 PHE HA H 108 4.846 6.056 -1.210 1
1 1125 . 7 1 1 A 110 110 PHE C C 108 172.231 173.123 -0.892 1
1 1126 . 7 1 1 A 110 110 PHE CA C 108 55.963 55.550 0.413 1
1 1127 . 7 1 1 A 110 110 PHE CB C 108 43.270 43.185 0.085 1
1 1130 . 7 1 1 A 110 110 PHE N N 108 125.052 121.935 3.117 1
1 1131 . 7 1 1 A 111 111 ARG H H 109 7.461 8.625 -1.164 1
1 1132 . 7 1 1 A 111 111 ARG HA H 109 4.804 4.182 0.622 1
1 1136 . 7 1 1 A 111 111 ARG CA C 109 51.953 52.715 -0.762 1
1 1137 . 7 1 1 A 111 111 ARG CB C 109 30.008 32.933 -2.925 1
1 1140 . 7 1 1 A 111 111 ARG N N 109 128.034 119.826 8.208 1
1 1141 . 7 1 1 A 112 112 PRO C C 110 178.675 176.349 2.326 1
1 1142 . 7 1 1 A 112 112 PRO CA C 110 64.024 63.568 0.456 1
1 1143 . 7 1 1 A 112 112 PRO CB C 110 31.416 31.631 -0.215 1
1 1144 . 7 1 1 A 113 113 GLN H H 111 8.188 8.120 0.068 1
1 1145 . 7 1 1 A 113 113 GLN HA H 111 4.056 4.324 -0.268 1
1 1149 . 7 1 1 A 113 113 GLN C C 111 175.936 177.253 -1.317 1
1 1150 . 7 1 1 A 113 113 GLN CA C 111 57.144 57.346 -0.202 1
1 1151 . 7 1 1 A 113 113 GLN CB C 111 28.033 30.173 -2.140 1
1 1153 . 7 1 1 A 113 113 GLN N N 111 118.835 119.628 -0.793 1
1 1154 . 7 1 1 A 114 114 SER H H 112 7.730 8.029 -0.299 1
1 1155 . 7 1 1 A 114 114 SER HA H 112 4.037 4.693 -0.656 1
1 1158 . 7 1 1 A 114 114 SER C C 112 175.750 176.006 -0.256 1
1 1159 . 7 1 1 A 114 114 SER CA C 112 60.154 58.953 1.201 1
1 1160 . 7 1 1 A 114 114 SER CB C 112 64.282 65.572 -1.290 1
1 1161 . 7 1 1 A 114 114 SER N N 112 114.887 111.493 3.394 1
1 1162 . 7 1 1 A 115 115 GLY H H 113 8.005 7.749 0.256 1
1 1163 . 7 1 1 A 115 115 GLY HA2 H 113 3.712 3.867 -0.155 1
1 1164 . 7 1 1 A 115 115 GLY HA3 H 113 4.130 3.986 0.144 1
1 1165 . 7 1 1 A 115 115 GLY C C 113 173.945 174.282 -0.337 1
1 1166 . 7 1 1 A 115 115 GLY CA C 113 45.233 47.186 -1.953 1
1 1167 . 7 1 1 A 115 115 GLY N N 113 110.740 109.973 0.767 1
1 1168 . 7 1 1 A 116 116 ARG H H 114 7.665 7.791 -0.126 1
1 1169 . 7 1 1 A 116 116 ARG HA H 114 4.449 4.317 0.132 1
1 1173 . 7 1 1 A 116 116 ARG C C 114 175.370 175.570 -0.200 1
1 1174 . 7 1 1 A 116 116 ARG CA C 114 55.080 56.951 -1.871 1
1 1175 . 7 1 1 A 116 116 ARG CB C 114 31.215 29.213 2.002 1
1 1178 . 7 1 1 A 116 116 ARG N N 114 119.983 115.738 4.245 1
1 1179 . 7 1 1 A 117 117 VAL H H 115 8.409 8.561 -0.152 1
1 1180 . 7 1 1 A 117 117 VAL HA H 115 4.184 3.680 0.504 1
1 1188 . 7 1 1 A 117 117 VAL C C 115 175.980 176.406 -0.426 1
1 1189 . 7 1 1 A 117 117 VAL CA C 115 61.167 62.118 -0.951 1
1 1190 . 7 1 1 A 117 117 VAL CB C 115 32.931 30.383 2.548 1
1 1193 . 7 1 1 A 117 117 VAL N N 115 122.240 117.548 4.692 1
1 1194 . 7 1 1 A 118 118 LEU H H 116 8.227 7.644 0.583 1
1 1195 . 7 1 1 A 118 118 LEU HA H 116 3.720 4.233 -0.513 1
1 1204 . 7 1 1 A 118 118 LEU C C 116 175.623 176.567 -0.944 1
1 1205 . 7 1 1 A 118 118 LEU CA C 116 54.555 56.661 -2.106 1
1 1206 . 7 1 1 A 118 118 LEU CB C 116 39.292 42.025 -2.733 1
1 1210 . 7 1 1 A 118 118 LEU N N 116 131.481 124.469 7.012 1
1 1211 . 7 1 1 A 119 119 SER H H 117 7.780 7.566 0.214 1
1 1212 . 7 1 1 A 119 119 SER HA H 117 4.060 4.621 -0.561 1
1 1214 . 7 1 1 A 119 119 SER C C 117 175.782 174.015 1.767 1
1 1215 . 7 1 1 A 119 119 SER CA C 117 58.530 57.380 1.150 1
1 1216 . 7 1 1 A 119 119 SER CB C 117 64.785 65.566 -0.781 1
1 1217 . 7 1 1 A 119 119 SER N N 117 118.658 113.457 5.201 1
1 1218 . 7 1 1 A 120 120 ALA H H 118 8.955 8.910 0.045 1
1 1219 . 7 1 1 A 120 120 ALA HA H 118 3.846 4.060 -0.214 1
1 1223 . 7 1 1 A 120 120 ALA C C 118 179.731 179.673 0.058 1
1 1224 . 7 1 1 A 120 120 ALA CA C 118 54.927 55.541 -0.614 1
1 1225 . 7 1 1 A 120 120 ALA CB C 118 18.627 18.198 0.429 1
1 1226 . 7 1 1 A 120 120 ALA N N 118 134.119 129.319 4.800 1
1 1227 . 7 1 1 A 121 121 MET H H 119 7.718 8.174 -0.456 1
1 1228 . 7 1 1 A 121 121 MET HA H 119 4.130 4.127 0.003 1
1 1235 . 7 1 1 A 121 121 MET C C 119 175.610 178.736 -3.126 1
1 1236 . 7 1 1 A 121 121 MET CA C 119 55.968 58.566 -2.598 1
1 1237 . 7 1 1 A 121 121 MET CB C 119 30.814 32.844 -2.030 1
1 1240 . 7 1 1 A 121 121 MET N N 119 115.424 116.218 -0.794 1
1 1241 . 7 1 1 A 122 122 ILE H H 120 6.451 8.361 -1.910 1
1 1242 . 7 1 1 A 122 122 ILE HA H 120 3.392 3.612 -0.220 1
1 1252 . 7 1 1 A 122 122 ILE C C 120 177.108 178.127 -1.019 1
1 1253 . 7 1 1 A 122 122 ILE CA C 120 59.650 65.056 -5.406 1
1 1254 . 7 1 1 A 122 122 ILE CB C 120 34.640 37.843 -3.203 1
1 1258 . 7 1 1 A 122 122 ILE N N 120 113.418 119.395 -5.977 1
1 1259 . 7 1 1 A 123 123 ARG H H 121 7.540 8.705 -1.165 1
1 1260 . 7 1 1 A 123 123 ARG HA H 121 3.551 3.892 -0.341 1
1 1264 . 7 1 1 A 123 123 ARG C C 121 179.642 178.773 0.869 1
1 1265 . 7 1 1 A 123 123 ARG CA C 121 59.242 59.959 -0.717 1
1 1266 . 7 1 1 A 123 123 ARG CB C 121 29.087 29.605 -0.518 1
1 1269 . 7 1 1 A 123 123 ARG N N 121 116.248 120.838 -4.590 1
1 1270 . 7 1 1 A 124 124 GLY H H 122 8.086 8.848 -0.762 1
1 1271 . 7 1 1 A 124 124 GLY C C 122 172.357 176.431 -4.074 1
1 1272 . 7 1 1 A 124 124 GLY CA C 122 44.836 47.040 -2.204 1
1 1273 . 7 1 1 A 124 124 GLY N N 122 104.381 107.661 -3.280 1
1 1274 . 7 1 1 A 125 125 ALA H H 123 6.411 8.042 -1.631 1
1 1275 . 7 1 1 A 125 125 ALA HA H 123 2.441 3.981 -1.540 1
1 1279 . 7 1 1 A 125 125 ALA C C 123 176.908 178.826 -1.918 1
1 1280 . 7 1 1 A 125 125 ALA CA C 123 51.593 54.415 -2.822 1
1 1281 . 7 1 1 A 125 125 ALA CB C 123 16.997 17.878 -0.881 1
1 1282 . 7 1 1 A 125 125 ALA N N 123 123.136 123.929 -0.793 1
1 1283 . 7 1 1 A 126 126 ALA H H 124 6.190 7.645 -1.455 1
1 1284 . 7 1 1 A 126 126 ALA HA H 124 3.829 4.505 -0.676 1
1 1288 . 7 1 1 A 126 126 ALA C C 124 177.535 177.240 0.295 1
1 1289 . 7 1 1 A 126 126 ALA CA C 124 52.403 53.556 -1.153 1
1 1290 . 7 1 1 A 126 126 ALA CB C 124 18.375 19.300 -0.925 1
1 1291 . 7 1 1 A 126 126 ALA N N 124 117.999 121.475 -3.476 1
1 1292 . 7 1 1 A 127 127 ASP H H 125 8.877 9.288 -0.411 1
1 1293 . 7 1 1 A 127 127 ASP HA H 125 4.665 4.797 -0.132 1
1 1296 . 7 1 1 A 127 127 ASP C C 125 177.795 176.712 1.083 1
1 1297 . 7 1 1 A 127 127 ASP CA C 125 52.855 54.450 -1.595 1
1 1298 . 7 1 1 A 127 127 ASP CB C 125 41.814 42.284 -0.470 1
1 1299 . 7 1 1 A 127 127 ASP N N 125 121.828 125.907 -4.079 1
1 1300 . 7 1 1 A 128 128 GLY H H 126 7.954 8.594 -0.640 1
1 1301 . 7 1 1 A 128 128 GLY HA2 H 126 3.830 3.957 -0.127 1
1 1302 . 7 1 1 A 128 128 GLY HA3 H 126 4.249 3.983 0.266 1
1 1303 . 7 1 1 A 128 128 GLY C C 126 173.822 174.424 -0.602 1
1 1304 . 7 1 1 A 128 128 GLY CA C 126 45.549 45.925 -0.376 1
1 1305 . 7 1 1 A 128 128 GLY N N 126 108.814 107.674 1.140 1
1 1306 . 7 1 1 A 129 129 SER H H 127 8.547 8.073 0.474 1
1 1307 . 7 1 1 A 129 129 SER HA H 127 4.486 4.938 -0.452 1
1 1309 . 7 1 1 A 129 129 SER C C 127 174.178 175.489 -1.311 1
1 1310 . 7 1 1 A 129 129 SER CA C 127 58.653 58.710 -0.057 1
1 1311 . 7 1 1 A 129 129 SER CB C 127 63.316 64.159 -0.843 1
1 1312 . 7 1 1 A 129 129 SER N N 127 115.599 113.391 2.208 1
1 1313 . 7 1 1 A 130 130 ARG H H 128 8.795 7.925 0.870 1
1 1314 . 7 1 1 A 130 130 ARG HA H 128 4.160 4.304 -0.144 1
1 1318 . 7 1 1 A 130 130 ARG C C 128 175.518 175.806 -0.288 1
1 1319 . 7 1 1 A 130 130 ARG CA C 128 58.479 57.310 1.169 1
1 1320 . 7 1 1 A 130 130 ARG CB C 128 29.952 30.894 -0.942 1
1 1323 . 7 1 1 A 130 130 ARG N N 128 127.611 121.473 6.138 1
1 1324 . 7 1 1 A 131 131 PHE H H 129 9.315 7.755 1.560 1
1 1325 . 7 1 1 A 131 131 PHE HA H 129 4.878 4.780 0.098 1
1 1331 . 7 1 1 A 131 131 PHE C C 129 175.058 173.281 1.777 1
1 1332 . 7 1 1 A 131 131 PHE CA C 129 55.953 56.867 -0.914 1
1 1333 . 7 1 1 A 131 131 PHE CB C 129 40.189 42.405 -2.216 1
1 1337 . 7 1 1 A 131 131 PHE N N 129 126.219 118.480 7.739 1
1 1338 . 7 1 1 A 132 132 GLN H H 130 8.160 8.051 0.109 1
1 1339 . 7 1 1 A 132 132 GLN HA H 130 5.013 4.873 0.140 1
1 1343 . 7 1 1 A 132 132 GLN CA C 130 54.498 54.331 0.167 1
1 1344 . 7 1 1 A 132 132 GLN CB C 130 32.106 33.331 -1.225 1
1 1346 . 7 1 1 A 132 132 GLN N N 130 125.589 125.466 0.123 1
1 1347 . 7 1 1 A 133 133 VAL H H 131 8.689 8.536 0.153 1
1 1348 . 7 1 1 A 133 133 VAL HA H 131 4.529 4.646 -0.117 1
1 1356 . 7 1 1 A 133 133 VAL C C 131 174.441 175.522 -1.081 1
1 1357 . 7 1 1 A 133 133 VAL CA C 131 60.758 61.483 -0.725 1
1 1358 . 7 1 1 A 133 133 VAL CB C 131 32.417 33.249 -0.832 1
1 1361 . 7 1 1 A 133 133 VAL N N 131 122.441 121.433 1.008 1
1 1362 . 7 1 1 A 134 134 TRP H H 132 9.256 9.126 0.130 1
1 1363 . 7 1 1 A 134 134 TRP HA H 132 5.213 5.305 -0.092 1
1 1371 . 7 1 1 A 134 134 TRP C C 132 174.575 175.689 -1.114 1
1 1372 . 7 1 1 A 134 134 TRP CA C 132 53.859 55.678 -1.819 1
1 1373 . 7 1 1 A 134 134 TRP CB C 132 31.311 31.859 -0.548 1
1 1379 . 7 1 1 A 134 134 TRP N N 132 130.303 127.954 2.349 1
1 1381 . 7 1 1 A 135 135 ASP H H 133 8.237 8.996 -0.759 1
1 1382 . 7 1 1 A 135 135 ASP HA H 133 6.018 6.010 0.008 1
1 1385 . 7 1 1 A 135 135 ASP C C 133 177.020 175.140 1.880 1
1 1386 . 7 1 1 A 135 135 ASP CA C 133 53.321 52.840 0.481 1
1 1387 . 7 1 1 A 135 135 ASP CB C 133 41.514 43.092 -1.578 1
1 1388 . 7 1 1 A 135 135 ASP N N 133 125.516 121.082 4.434 1
1 1389 . 7 1 1 A 136 136 TYR H H 134 9.058 8.256 0.802 1
1 1390 . 7 1 1 A 136 136 TYR HA H 134 4.970 5.405 -0.435 1
1 1394 . 7 1 1 A 136 136 TYR C C 134 172.324 172.614 -0.290 1
1 1395 . 7 1 1 A 136 136 TYR CA C 134 55.982 56.316 -0.334 1
1 1396 . 7 1 1 A 136 136 TYR CB C 134 42.265 40.473 1.792 1
1 1399 . 7 1 1 A 136 136 TYR N N 134 120.315 116.696 3.619 1
1 1400 . 7 1 1 A 137 137 ALA H H 135 8.521 8.441 0.080 1
1 1401 . 7 1 1 A 137 137 ALA HA H 135 4.280 4.527 -0.247 1
1 1405 . 7 1 1 A 137 137 ALA C C 135 178.561 177.864 0.697 1
1 1406 . 7 1 1 A 137 137 ALA CA C 135 49.550 50.047 -0.497 1
1 1407 . 7 1 1 A 137 137 ALA CB C 135 19.998 22.303 -2.305 1
1 1408 . 7 1 1 A 137 137 ALA N N 135 123.386 122.203 1.183 1
1 1409 . 7 1 1 A 138 138 GLU H H 136 8.678 8.724 -0.046 1
1 1410 . 7 1 1 A 138 138 GLU HA H 136 3.777 4.203 -0.426 1
1 1414 . 7 1 1 A 138 138 GLU C C 136 177.624 177.903 -0.279 1
1 1415 . 7 1 1 A 138 138 GLU CA C 136 60.527 59.350 1.177 1
1 1416 . 7 1 1 A 138 138 GLU CB C 136 29.020 29.356 -0.336 1
1 1418 . 7 1 1 A 138 138 GLU N N 136 121.774 121.726 0.048 1
1 1419 . 7 1 1 A 139 139 GLY H H 137 8.666 7.830 0.836 1
1 1420 . 7 1 1 A 139 139 GLY HA2 H 137 3.872 4.099 -0.227 1
1 1421 . 7 1 1 A 139 139 GLY HA3 H 137 3.872 4.120 -0.248 1
1 1422 . 7 1 1 A 139 139 GLY C C 137 175.122 175.211 -0.089 1
1 1423 . 7 1 1 A 139 139 GLY CA C 137 46.093 44.345 1.748 1
1 1424 . 7 1 1 A 139 139 GLY N N 137 106.053 108.510 -2.457 1
1 1425 . 7 1 1 A 140 140 GLU H H 138 8.305 9.053 -0.748 1
1 1426 . 7 1 1 A 140 140 GLU HA H 138 4.754 4.380 0.374 1
1 1430 . 7 1 1 A 140 140 GLU C C 138 177.819 177.049 0.770 1
1 1431 . 7 1 1 A 140 140 GLU CA C 138 55.049 58.040 -2.991 1
1 1432 . 7 1 1 A 140 140 GLU CB C 138 30.504 27.957 2.547 1
1 1434 . 7 1 1 A 140 140 GLU N N 138 117.485 120.782 -3.297 1
1 1435 . 7 1 1 A 141 141 VAL H H 139 7.267 8.223 -0.956 1
1 1436 . 7 1 1 A 141 141 VAL HA H 139 3.422 3.735 -0.313 1
1 1444 . 7 1 1 A 141 141 VAL C C 139 175.454 177.518 -2.064 1
1 1445 . 7 1 1 A 141 141 VAL CA C 139 66.769 64.550 2.219 1
1 1446 . 7 1 1 A 141 141 VAL CB C 139 31.377 31.111 0.266 1
1 1449 . 7 1 1 A 141 141 VAL N N 139 120.764 119.630 1.134 1
1 1450 . 7 1 1 A 142 142 GLU H H 140 8.620 8.489 0.131 1
1 1451 . 7 1 1 A 142 142 GLU HA H 140 3.592 4.156 -0.564 1
1 1452 . 7 1 1 A 142 142 GLU C C 140 177.320 178.722 -1.402 1
1 1453 . 7 1 1 A 142 142 GLU CA C 140 62.607 58.647 3.960 1
1 1454 . 7 1 1 A 142 142 GLU CB C 140 26.759 29.124 -2.365 1
1 1455 . 7 1 1 A 142 142 GLU N N 140 120.048 119.399 0.649 1
1 1456 . 7 1 1 A 143 143 THR H H 141 7.449 7.902 -0.453 1
1 1457 . 7 1 1 A 143 143 THR HA H 141 4.003 4.213 -0.210 1
1 1462 . 7 1 1 A 143 143 THR C C 141 177.258 176.945 0.313 1
1 1463 . 7 1 1 A 143 143 THR CA C 141 65.490 67.206 -1.716 1
1 1464 . 7 1 1 A 143 143 THR CB C 141 68.641 68.368 0.273 1
1 1466 . 7 1 1 A 143 143 THR N N 141 114.073 116.918 -2.845 1
1 1467 . 7 1 1 A 144 144 MET H H 142 7.992 8.113 -0.121 1
1 1468 . 7 1 1 A 144 144 MET HA H 142 4.316 4.325 -0.009 1
1 1476 . 7 1 1 A 144 144 MET C C 142 178.233 178.830 -0.597 1
1 1477 . 7 1 1 A 144 144 MET CA C 142 57.743 59.171 -1.428 1
1 1478 . 7 1 1 A 144 144 MET CB C 142 31.326 32.669 -1.343 1
1 1481 . 7 1 1 A 144 144 MET N N 142 120.595 118.495 2.100 1
1 1482 . 7 1 1 A 145 145 LEU H H 143 7.847 8.176 -0.329 1
1 1483 . 7 1 1 A 145 145 LEU HA H 143 3.919 3.899 0.020 1
1 1491 . 7 1 1 A 145 145 LEU C C 143 178.774 179.466 -0.692 1
1 1492 . 7 1 1 A 145 145 LEU CA C 143 57.877 58.110 -0.233 1
1 1493 . 7 1 1 A 145 145 LEU CB C 143 40.951 41.186 -0.235 1
1 1497 . 7 1 1 A 145 145 LEU N N 143 119.410 119.823 -0.413 1
1 1498 . 7 1 1 A 146 146 ASP H H 144 8.431 8.538 -0.107 1
1 1499 . 7 1 1 A 146 146 ASP HA H 144 4.312 4.588 -0.276 1
1 1502 . 7 1 1 A 146 146 ASP C C 144 178.129 179.585 -1.456 1
1 1503 . 7 1 1 A 146 146 ASP CA C 144 57.464 57.594 -0.130 1
1 1504 . 7 1 1 A 146 146 ASP CB C 144 39.548 40.354 -0.806 1
1 1505 . 7 1 1 A 146 146 ASP N N 144 119.837 120.988 -1.151 1
1 1506 . 7 1 1 A 147 147 ARG H H 145 7.949 8.632 -0.683 1
1 1507 . 7 1 1 A 147 147 ARG HA H 145 4.050 4.128 -0.078 1
1 1512 . 7 1 1 A 147 147 ARG C C 145 179.547 178.814 0.733 1
1 1513 . 7 1 1 A 147 147 ARG CA C 145 58.972 59.598 -0.626 1
1 1514 . 7 1 1 A 147 147 ARG CB C 145 29.798 30.588 -0.790 1
1 1517 . 7 1 1 A 147 147 ARG N N 145 119.173 120.487 -1.314 1
1 1518 . 7 1 1 A 148 148 TYR H H 146 8.128 8.257 -0.129 1
1 1519 . 7 1 1 A 148 148 TYR HA H 146 3.995 4.397 -0.402 1
1 1524 . 7 1 1 A 148 148 TYR C C 146 178.199 177.579 0.620 1
1 1525 . 7 1 1 A 148 148 TYR CA C 146 62.347 61.482 0.865 1
1 1526 . 7 1 1 A 148 148 TYR CB C 146 37.418 37.851 -0.433 1
1 1529 . 7 1 1 A 148 148 TYR N N 146 120.102 121.316 -1.214 1
1 1530 . 7 1 1 A 149 149 PHE H H 147 8.308 8.766 -0.458 1
1 1531 . 7 1 1 A 149 149 PHE HA H 147 4.013 4.439 -0.426 1
1 1535 . 7 1 1 A 149 149 PHE C C 147 177.574 178.409 -0.835 1
1 1536 . 7 1 1 A 149 149 PHE CA C 147 63.044 61.770 1.274 1
1 1537 . 7 1 1 A 149 149 PHE CB C 147 37.153 38.201 -1.048 1
1 1541 . 7 1 1 A 149 149 PHE N N 147 116.680 118.450 -1.770 1
1 1542 . 7 1 1 A 150 150 GLU H H 148 8.271 9.185 -0.914 1
1 1543 . 7 1 1 A 150 150 GLU HA H 148 4.030 3.997 0.033 1
1 1547 . 7 1 1 A 150 150 GLU C C 148 177.687 178.154 -0.467 1
1 1548 . 7 1 1 A 150 150 GLU CA C 148 58.746 60.026 -1.280 1
1 1549 . 7 1 1 A 150 150 GLU CB C 148 28.847 29.058 -0.211 1
1 1551 . 7 1 1 A 150 150 GLU N N 148 119.973 119.567 0.406 1
1 1552 . 7 1 1 A 151 151 ALA H H 149 6.992 7.662 -0.670 1
1 1553 . 7 1 1 A 151 151 ALA HA H 149 4.217 4.239 -0.022 1
1 1557 . 7 1 1 A 151 151 ALA C C 149 178.190 176.713 1.477 1
1 1558 . 7 1 1 A 151 151 ALA CA C 149 52.779 52.904 -0.125 1
1 1559 . 7 1 1 A 151 151 ALA CB C 149 19.087 18.060 1.027 1
1 1560 . 7 1 1 A 151 151 ALA N N 149 118.629 121.377 -2.748 1
1 1561 . 7 1 1 A 152 152 TYR H H 150 7.722 8.751 -1.029 1
1 1562 . 7 1 1 A 152 152 TYR HA H 150 4.137 4.746 -0.609 1
1 1567 . 7 1 1 A 152 152 TYR C C 150 175.703 175.274 0.429 1
1 1568 . 7 1 1 A 152 152 TYR CA C 150 59.260 58.819 0.441 1
1 1569 . 7 1 1 A 152 152 TYR CB C 150 39.165 38.870 0.295 1
1 1572 . 7 1 1 A 152 152 TYR N N 150 118.767 118.847 -0.080 1
1 1573 . 7 1 1 A 153 153 LEU H H 151 7.670 8.722 -1.052 1
1 1574 . 7 1 1 A 153 153 LEU HA H 151 4.145 4.395 -0.250 1
1 1584 . 7 1 1 A 153 153 LEU CA C 151 54.704 53.983 0.721 1
1 1585 . 7 1 1 A 153 153 LEU CB C 151 40.520 41.731 -1.211 1
1 1589 . 7 1 1 A 153 153 LEU N N 151 122.313 122.789 -0.476 1
1 1590 . 7 1 1 A 154 154 PRO HA H 152 4.258 4.374 -0.116 1
1 1597 . 7 1 1 A 154 154 PRO C C 152 177.496 178.800 -1.304 1
1 1598 . 7 1 1 A 154 154 PRO CA C 152 63.899 65.960 -2.061 1
1 1599 . 7 1 1 A 154 154 PRO CB C 152 31.080 31.420 -0.340 1
1 1602 . 7 1 1 A 155 155 GLN H H 153 8.023 7.996 0.027 1
1 1603 . 7 1 1 A 155 155 GLN HA H 153 4.176 4.098 0.078 1
1 1607 . 7 1 1 A 155 155 GLN C C 153 176.636 178.299 -1.663 1
1 1608 . 7 1 1 A 155 155 GLN CA C 153 55.968 58.668 -2.700 1
1 1609 . 7 1 1 A 155 155 GLN CB C 153 28.723 28.196 0.527 1
1 1610 . 7 1 1 A 155 155 GLN N N 153 119.173 117.105 2.068 1
1 1611 . 7 1 1 A 156 156 LYS H H 154 8.113 7.862 0.251 1
1 1612 . 7 1 1 A 156 156 LYS HA H 154 4.196 4.080 0.116 1
1 1619 . 7 1 1 A 156 156 LYS C C 154 56.493 178.970 -122.477 1
1 1620 . 7 1 1 A 156 156 LYS CA C 154 56.493 59.149 -2.656 1
1 1621 . 7 1 1 A 156 156 LYS CB C 154 32.037 32.460 -0.423 1
1 1625 . 7 1 1 A 156 156 LYS N N 154 122.788 119.208 3.580 1
1 1626 . 7 1 1 A 157 157 THR H H 155 8.013 8.001 0.012 1
1 1627 . 7 1 1 A 157 157 THR HA H 155 4.183 3.907 0.276 1
1 1632 . 7 1 1 A 157 157 THR C C 155 174.580 176.506 -1.926 1
1 1633 . 7 1 1 A 157 157 THR CA C 155 61.958 66.163 -4.205 1
1 1634 . 7 1 1 A 157 157 THR CB C 155 69.665 68.459 1.206 1
1 1636 . 7 1 1 A 157 157 THR N N 155 115.504 117.518 -2.014 1
1 1637 . 7 1 1 A 158 158 ALA H H 156 8.170 7.478 0.692 1
1 1638 . 7 1 1 A 158 158 ALA HA H 156 4.220 4.317 -0.097 1
1 1642 . 7 1 1 A 158 158 ALA CA C 156 52.492 54.282 -1.790 1
1 1643 . 7 1 1 A 158 158 ALA CB C 156 18.810 19.680 -0.870 1
1 1644 . 7 1 1 A 158 158 ALA N N 156 126.825 121.864 4.961 1
1 1645 . 7 1 1 A 159 159 SER H H 157 7.762 8.267 -0.505 1
1 1646 . 7 1 1 A 159 159 SER CA C 157 58.230 56.927 1.303 1
1 1647 . 7 1 1 A 159 159 SER CB C 157 63.440 65.568 -2.128 1
1 1648 . 7 1 1 A 159 159 SER N N 157 123.078 111.274 11.804 1
1 1649 . 7 1 1 A 162 162 HIS HA H 160 4.845 4.597 0.248 1
1 1652 . 7 1 1 A 162 162 HIS CA C 160 53.590 55.455 -1.865 1
1 1653 . 7 1 1 A 162 162 HIS CB C 160 29.398 29.608 -0.210 1
1 1654 . 7 1 1 A 163 163 PRO HA H 161 4.388 4.219 0.169 1
1 1660 . 7 1 1 A 163 163 PRO C C 161 177.018 177.369 -0.351 1
1 1661 . 7 1 1 A 163 163 PRO CA C 161 63.118 65.356 -2.238 1
1 1662 . 7 1 1 A 163 163 PRO CB C 161 31.668 31.714 -0.046 1
1 1665 . 7 1 1 A 164 164 SER H H 162 8.418 8.428 -0.010 1
1 1666 . 7 1 1 A 164 164 SER HA H 162 4.338 4.195 0.143 1
1 1668 . 7 1 1 A 164 164 SER C C 162 173.327 177.149 -3.822 1
1 1669 . 7 1 1 A 164 164 SER CA C 162 58.202 61.123 -2.921 1
1 1670 . 7 1 1 A 164 164 SER CB C 162 64.080 63.099 0.981 1
1 1671 . 7 1 1 A 164 164 SER N N 162 117.485 112.458 5.027 1
1 6 . 8 1 1 A 4 4 ALA H H 2 8.270 9.039 -0.769 1
1 7 . 8 1 1 A 4 4 ALA HA H 2 4.212 3.940 0.272 1
1 11 . 8 1 1 A 4 4 ALA C C 2 177.441 179.987 -2.546 1
1 12 . 8 1 1 A 4 4 ALA CA C 2 52.280 55.404 -3.124 1
1 13 . 8 1 1 A 4 4 ALA CB C 2 18.880 18.323 0.557 1
1 14 . 8 1 1 A 4 4 ALA N N 2 126.500 125.835 0.665 1
1 15 . 8 1 1 A 5 5 ALA H H 3 8.251 8.055 0.196 1
1 16 . 8 1 1 A 5 5 ALA HA H 3 4.261 4.105 0.156 1
1 20 . 8 1 1 A 5 5 ALA C C 3 177.824 177.681 0.143 1
1 21 . 8 1 1 A 5 5 ALA CA C 3 52.347 55.055 -2.708 1
1 22 . 8 1 1 A 5 5 ALA CB C 3 18.869 18.385 0.484 1
1 23 . 8 1 1 A 5 5 ALA N N 3 124.322 119.349 4.973 1
1 24 . 8 1 1 A 6 6 SER H H 4 8.158 7.584 0.574 1
1 25 . 8 1 1 A 6 6 SER HA H 4 4.358 4.484 -0.126 1
1 27 . 8 1 1 A 6 6 SER C C 4 175.222 175.021 0.201 1
1 28 . 8 1 1 A 6 6 SER CA C 4 58.438 57.257 1.181 1
1 29 . 8 1 1 A 6 6 SER CB C 4 63.859 64.620 -0.761 1
1 30 . 8 1 1 A 6 6 SER N N 4 115.338 111.482 3.856 1
1 31 . 8 1 1 A 7 7 GLY H H 5 8.265 8.581 -0.316 1
1 32 . 8 1 1 A 7 7 GLY HA2 H 5 3.900 3.842 0.058 1
1 33 . 8 1 1 A 7 7 GLY C C 5 174.083 173.326 0.757 1
1 34 . 8 1 1 A 7 7 GLY CA C 5 45.113 46.521 -1.408 1
1 35 . 8 1 1 A 7 7 GLY N N 5 111.360 109.429 1.931 1
1 36 . 8 1 1 A 8 8 GLU H H 6 8.100 7.665 0.435 1
1 37 . 8 1 1 A 8 8 GLU HA H 6 4.209 4.869 -0.660 1
1 41 . 8 1 1 A 8 8 GLU C C 6 176.354 175.511 0.843 1
1 42 . 8 1 1 A 8 8 GLU CA C 6 56.261 55.363 0.898 1
1 43 . 8 1 1 A 8 8 GLU CB C 6 29.830 31.219 -1.389 1
1 45 . 8 1 1 A 8 8 GLU N N 6 121.056 122.890 -1.834 1
1 46 . 8 1 1 A 9 9 GLN H H 7 8.287 8.807 -0.520 1
1 47 . 8 1 1 A 9 9 GLN HA H 7 4.247 5.045 -0.798 1
1 51 . 8 1 1 A 9 9 GLN C C 7 172.457 174.712 -2.255 1
1 52 . 8 1 1 A 9 9 GLN CA C 7 55.269 53.934 1.335 1
1 53 . 8 1 1 A 9 9 GLN CB C 7 29.236 33.550 -4.314 1
1 55 . 8 1 1 A 9 9 GLN N N 7 122.164 125.122 -2.958 1
1 56 . 8 1 1 A 10 10 ALA H H 8 8.368 8.681 -0.313 1
1 57 . 8 1 1 A 10 10 ALA HA H 8 4.509 5.035 -0.526 1
1 61 . 8 1 1 A 10 10 ALA CA C 8 50.341 49.753 0.588 1
1 62 . 8 1 1 A 10 10 ALA CB C 8 18.140 22.622 -4.482 1
1 63 . 8 1 1 A 10 10 ALA N N 8 128.028 121.902 6.126 1
1 64 . 8 1 1 A 11 11 PRO HA H 9 4.437 4.647 -0.210 1
1 70 . 8 1 1 A 11 11 PRO C C 9 176.381 176.366 0.015 1
1 71 . 8 1 1 A 11 11 PRO CA C 9 63.298 62.330 0.968 1
1 72 . 8 1 1 A 11 11 PRO CB C 9 31.776 33.230 -1.454 1
1 75 . 8 1 1 A 12 12 CYS H H 10 8.056 8.337 -0.281 1
1 76 . 8 1 1 A 12 12 CYS HA H 10 4.717 4.898 -0.181 1
1 79 . 8 1 1 A 12 12 CYS C C 10 173.266 174.368 -1.102 1
1 80 . 8 1 1 A 12 12 CYS CA C 10 57.398 57.447 -0.049 1
1 81 . 8 1 1 A 12 12 CYS CB C 10 29.165 29.607 -0.442 1
1 82 . 8 1 1 A 12 12 CYS N N 10 118.295 118.038 0.257 1
1 83 . 8 1 1 A 13 13 SER H H 11 9.815 8.875 0.940 1
1 84 . 8 1 1 A 13 13 SER HA H 11 5.227 5.676 -0.449 1
1 87 . 8 1 1 A 13 13 SER C C 11 173.648 173.781 -0.133 1
1 88 . 8 1 1 A 13 13 SER CA C 11 57.630 56.014 1.616 1
1 89 . 8 1 1 A 13 13 SER CB C 11 64.820 66.399 -1.579 1
1 90 . 8 1 1 A 13 13 SER N N 11 122.365 112.931 9.434 1
1 91 . 8 1 1 A 14 14 VAL H H 12 9.352 9.224 0.128 1
1 92 . 8 1 1 A 14 14 VAL HA H 12 4.696 5.243 -0.547 1
1 100 . 8 1 1 A 14 14 VAL C C 12 173.875 173.655 0.220 1
1 101 . 8 1 1 A 14 14 VAL CA C 12 60.146 60.858 -0.712 1
1 102 . 8 1 1 A 14 14 VAL CB C 12 34.499 35.437 -0.938 1
1 105 . 8 1 1 A 14 14 VAL N N 12 126.378 121.318 5.060 1
1 106 . 8 1 1 A 15 15 TYR H H 13 8.745 9.013 -0.268 1
1 111 . 8 1 1 A 15 15 TYR C C 13 173.345 173.992 -0.647 1
1 112 . 8 1 1 A 15 15 TYR CA C 13 56.186 54.934 1.252 1
1 113 . 8 1 1 A 15 15 TYR CB C 13 40.858 40.094 0.764 1
1 116 . 8 1 1 A 15 15 TYR N N 13 129.472 128.358 1.114 1
1 117 . 8 1 1 A 16 16 PHE H H 14 7.370 9.062 -1.692 1
1 118 . 8 1 1 A 16 16 PHE HA H 14 5.720 6.018 -0.298 1
1 123 . 8 1 1 A 16 16 PHE C C 14 174.058 175.367 -1.309 1
1 124 . 8 1 1 A 16 16 PHE CA C 14 54.361 56.791 -2.430 1
1 125 . 8 1 1 A 16 16 PHE CB C 14 40.461 39.093 1.368 1
1 129 . 8 1 1 A 16 16 PHE N N 14 128.263 125.817 2.446 1
1 130 . 8 1 1 A 17 17 CYS H H 15 8.147 8.426 -0.279 1
1 131 . 8 1 1 A 17 17 CYS CA C 15 56.570 58.168 -1.598 1
1 132 . 8 1 1 A 17 17 CYS CB C 15 29.690 29.183 0.507 1
1 133 . 8 1 1 A 17 17 CYS N N 15 126.188 123.434 2.754 1
1 134 . 8 1 1 A 18 18 GLY HA2 H 16 3.819 3.971 -0.152 1
1 135 . 8 1 1 A 18 18 GLY C C 16 173.374 173.365 0.009 1
1 136 . 8 1 1 A 18 18 GLY CA C 16 45.510 46.004 -0.494 1
1 137 . 8 1 1 A 19 19 SER H H 17 8.533 7.642 0.891 1
1 138 . 8 1 1 A 19 19 SER HA H 17 4.505 5.086 -0.581 1
1 139 . 8 1 1 A 19 19 SER CA C 17 58.700 57.009 1.691 1
1 140 . 8 1 1 A 19 19 SER CB C 17 63.810 65.649 -1.839 1
1 141 . 8 1 1 A 19 19 SER N N 17 117.300 112.826 4.474 1
1 142 . 8 1 1 A 20 20 ILE HA H 18 4.309 4.208 0.101 1
1 152 . 8 1 1 A 20 20 ILE CA C 18 61.317 62.757 -1.440 1
1 153 . 8 1 1 A 20 20 ILE CB C 18 38.302 37.474 0.828 1
1 157 . 8 1 1 A 21 21 ARG HA H 19 4.172 4.048 0.124 1
1 160 . 8 1 1 A 21 21 ARG C C 19 177.118 175.082 2.036 1
1 161 . 8 1 1 A 21 21 ARG CA C 19 56.960 57.471 -0.511 1
1 162 . 8 1 1 A 21 21 ARG CB C 19 29.568 30.181 -0.613 1
1 165 . 8 1 1 A 22 22 GLY H H 20 8.685 7.588 1.097 1
1 166 . 8 1 1 A 22 22 GLY HA2 H 20 3.801 4.088 -0.287 1
1 167 . 8 1 1 A 22 22 GLY HA3 H 20 3.923 4.095 -0.172 1
1 168 . 8 1 1 A 22 22 GLY C C 20 174.814 173.492 1.322 1
1 169 . 8 1 1 A 22 22 GLY CA C 20 45.289 45.913 -0.624 1
1 170 . 8 1 1 A 22 22 GLY N N 20 110.145 106.371 3.774 1
1 171 . 8 1 1 A 23 23 GLY H H 21 8.058 8.376 -0.318 1
1 172 . 8 1 1 A 23 23 GLY HA2 H 21 3.998 4.032 -0.034 1
1 173 . 8 1 1 A 23 23 GLY HA3 H 21 4.237 4.064 0.173 1
1 174 . 8 1 1 A 23 23 GLY C C 21 174.762 175.561 -0.799 1
1 175 . 8 1 1 A 23 23 GLY CA C 21 45.025 45.535 -0.510 1
1 176 . 8 1 1 A 23 23 GLY N N 21 109.327 111.165 -1.838 1
1 177 . 8 1 1 A 24 24 ARG H H 22 8.376 8.122 0.254 1
1 178 . 8 1 1 A 24 24 ARG HA H 22 4.086 3.866 0.220 1
1 184 . 8 1 1 A 24 24 ARG C C 22 178.178 177.286 0.892 1
1 185 . 8 1 1 A 24 24 ARG CA C 22 57.471 58.580 -1.109 1
1 186 . 8 1 1 A 24 24 ARG CB C 22 29.653 28.757 0.896 1
1 189 . 8 1 1 A 24 24 ARG N N 22 120.861 116.697 4.164 1
1 190 . 8 1 1 A 25 25 GLU H H 23 8.831 9.282 -0.451 1
1 191 . 8 1 1 A 25 25 GLU HA H 23 4.015 3.946 0.069 1
1 195 . 8 1 1 A 25 25 GLU C C 23 178.005 178.852 -0.847 1
1 196 . 8 1 1 A 25 25 GLU CA C 23 58.920 59.542 -0.622 1
1 197 . 8 1 1 A 25 25 GLU CB C 23 28.592 29.074 -0.482 1
1 199 . 8 1 1 A 25 25 GLU N N 23 121.243 119.304 1.939 1
1 200 . 8 1 1 A 26 26 ASP H H 24 7.897 8.006 -0.109 1
1 201 . 8 1 1 A 26 26 ASP HA H 24 4.516 3.985 0.531 1
1 203 . 8 1 1 A 26 26 ASP C C 24 176.455 177.665 -1.210 1
1 204 . 8 1 1 A 26 26 ASP CA C 24 55.122 56.893 -1.771 1
1 205 . 8 1 1 A 26 26 ASP CB C 24 39.888 40.490 -0.602 1
1 206 . 8 1 1 A 26 26 ASP N N 24 119.541 119.559 -0.018 1
1 207 . 8 1 1 A 27 27 GLN H H 25 7.696 8.894 -1.198 1
1 208 . 8 1 1 A 27 27 GLN HA H 25 3.704 4.065 -0.361 1
1 212 . 8 1 1 A 27 27 GLN C C 25 177.016 177.791 -0.775 1
1 213 . 8 1 1 A 27 27 GLN CA C 25 59.501 58.831 0.670 1
1 214 . 8 1 1 A 27 27 GLN CB C 25 27.762 28.901 -1.139 1
1 216 . 8 1 1 A 27 27 GLN N N 25 119.471 118.607 0.864 1
1 217 . 8 1 1 A 28 28 ALA H H 26 8.227 7.567 0.660 1
1 218 . 8 1 1 A 28 28 ALA HA H 26 4.072 4.071 0.001 1
1 222 . 8 1 1 A 28 28 ALA C C 26 180.567 179.705 0.862 1
1 223 . 8 1 1 A 28 28 ALA CA C 26 54.627 54.925 -0.298 1
1 224 . 8 1 1 A 28 28 ALA CB C 26 17.355 18.120 -0.765 1
1 225 . 8 1 1 A 28 28 ALA N N 26 122.362 121.679 0.683 1
1 226 . 8 1 1 A 29 29 LEU H H 27 7.533 7.691 -0.158 1
1 227 . 8 1 1 A 29 29 LEU HA H 27 4.050 3.941 0.109 1
1 237 . 8 1 1 A 29 29 LEU C C 27 178.752 177.927 0.825 1
1 238 . 8 1 1 A 29 29 LEU CA C 27 57.578 57.468 0.110 1
1 239 . 8 1 1 A 29 29 LEU CB C 27 40.734 41.370 -0.636 1
1 243 . 8 1 1 A 29 29 LEU N N 27 122.255 119.894 2.361 1
1 244 . 8 1 1 A 30 30 TYR H H 28 8.473 8.273 0.200 1
1 245 . 8 1 1 A 30 30 TYR HA H 28 4.049 3.850 0.199 1
1 250 . 8 1 1 A 30 30 TYR C C 28 177.736 178.665 -0.929 1
1 251 . 8 1 1 A 30 30 TYR CA C 28 59.817 60.148 -0.331 1
1 252 . 8 1 1 A 30 30 TYR CB C 28 36.140 37.254 -1.114 1
1 255 . 8 1 1 A 30 30 TYR N N 28 120.403 118.475 1.928 1
1 256 . 8 1 1 A 31 31 ALA H H 29 8.008 8.398 -0.390 1
1 257 . 8 1 1 A 31 31 ALA HA H 29 4.005 4.144 -0.139 1
1 261 . 8 1 1 A 31 31 ALA C C 29 180.879 179.502 1.377 1
1 262 . 8 1 1 A 31 31 ALA CA C 29 54.914 55.212 -0.298 1
1 263 . 8 1 1 A 31 31 ALA CB C 29 17.375 18.221 -0.846 1
1 264 . 8 1 1 A 31 31 ALA N N 29 120.771 122.960 -2.189 1
1 265 . 8 1 1 A 32 32 ARG H H 30 7.596 7.558 0.038 1
1 266 . 8 1 1 A 32 32 ARG HA H 30 3.916 4.018 -0.102 1
1 273 . 8 1 1 A 32 32 ARG C C 30 179.919 178.540 1.379 1
1 274 . 8 1 1 A 32 32 ARG CA C 30 59.014 59.050 -0.036 1
1 275 . 8 1 1 A 32 32 ARG CB C 30 30.531 29.718 0.813 1
1 278 . 8 1 1 A 32 32 ARG N N 30 120.365 117.926 2.439 1
1 279 . 8 1 1 A 33 33 ILE H H 31 8.066 8.449 -0.383 1
1 280 . 8 1 1 A 33 33 ILE HA H 31 3.120 3.567 -0.447 1
1 290 . 8 1 1 A 33 33 ILE C C 31 177.051 178.245 -1.194 1
1 291 . 8 1 1 A 33 33 ILE CA C 31 65.757 65.202 0.555 1
1 292 . 8 1 1 A 33 33 ILE CB C 31 36.928 37.689 -0.761 1
1 296 . 8 1 1 A 33 33 ILE N N 31 121.608 119.458 2.150 1
1 297 . 8 1 1 A 34 34 VAL H H 32 8.148 8.889 -0.741 1
1 298 . 8 1 1 A 34 34 VAL HA H 32 2.954 3.470 -0.516 1
1 306 . 8 1 1 A 34 34 VAL C C 32 177.159 178.163 -1.004 1
1 307 . 8 1 1 A 34 34 VAL CA C 32 67.220 66.286 0.934 1
1 308 . 8 1 1 A 34 34 VAL CB C 32 31.039 31.229 -0.190 1
1 311 . 8 1 1 A 34 34 VAL N N 32 119.318 120.247 -0.929 1
1 312 . 8 1 1 A 35 35 SER H H 33 7.826 8.046 -0.220 1
1 313 . 8 1 1 A 35 35 SER HA H 33 3.868 4.108 -0.240 1
1 316 . 8 1 1 A 35 35 SER C C 33 176.779 177.106 -0.327 1
1 317 . 8 1 1 A 35 35 SER CA C 33 62.000 61.147 0.853 1
1 318 . 8 1 1 A 35 35 SER CB C 33 62.789 63.142 -0.353 1
1 319 . 8 1 1 A 35 35 SER N N 33 111.936 116.318 -4.382 1
1 320 . 8 1 1 A 36 36 ARG H H 34 7.405 7.182 0.223 1
1 321 . 8 1 1 A 36 36 ARG HA H 34 4.070 4.085 -0.015 1
1 323 . 8 1 1 A 36 36 ARG C C 34 178.047 178.306 -0.259 1
1 324 . 8 1 1 A 36 36 ARG CA C 34 56.108 59.093 -2.985 1
1 325 . 8 1 1 A 36 36 ARG CB C 34 28.837 30.258 -1.421 1
1 326 . 8 1 1 A 36 36 ARG N N 34 120.909 122.141 -1.232 1
1 327 . 8 1 1 A 37 37 LEU H H 35 8.301 8.303 -0.002 1
1 328 . 8 1 1 A 37 37 LEU HA H 35 3.620 3.523 0.097 1
1 336 . 8 1 1 A 37 37 LEU C C 35 178.446 178.897 -0.451 1
1 337 . 8 1 1 A 37 37 LEU CA C 35 57.640 57.766 -0.126 1
1 338 . 8 1 1 A 37 37 LEU CB C 35 41.584 41.697 -0.113 1
1 342 . 8 1 1 A 37 37 LEU N N 35 118.567 119.782 -1.215 1
1 343 . 8 1 1 A 38 38 ARG H H 36 7.379 8.133 -0.754 1
1 344 . 8 1 1 A 38 38 ARG HA H 36 4.340 3.955 0.385 1
1 350 . 8 1 1 A 38 38 ARG C C 36 177.895 178.761 -0.866 1
1 351 . 8 1 1 A 38 38 ARG CA C 36 57.785 58.939 -1.154 1
1 352 . 8 1 1 A 38 38 ARG CB C 36 29.775 29.661 0.114 1
1 355 . 8 1 1 A 38 38 ARG N N 36 115.352 119.325 -3.973 1
1 356 . 8 1 1 A 39 39 ARG H H 37 7.240 7.819 -0.579 1
1 357 . 8 1 1 A 39 39 ARG HA H 37 3.743 4.143 -0.400 1
1 363 . 8 1 1 A 39 39 ARG C C 37 176.988 178.788 -1.800 1
1 364 . 8 1 1 A 39 39 ARG CA C 37 57.605 58.190 -0.585 1
1 365 . 8 1 1 A 39 39 ARG CB C 37 28.925 30.355 -1.430 1
1 368 . 8 1 1 A 39 39 ARG N N 37 117.410 118.914 -1.504 1
1 369 . 8 1 1 A 40 40 TYR H H 38 7.296 8.111 -0.815 1
1 370 . 8 1 1 A 40 40 TYR HA H 38 4.319 4.210 0.109 1
1 375 . 8 1 1 A 40 40 TYR C C 38 175.001 176.172 -1.171 1
1 376 . 8 1 1 A 40 40 TYR CA C 38 57.730 60.369 -2.639 1
1 377 . 8 1 1 A 40 40 TYR CB C 38 39.343 37.959 1.384 1
1 380 . 8 1 1 A 40 40 TYR N N 38 116.937 118.567 -1.630 1
1 381 . 8 1 1 A 41 41 GLY H H 39 7.325 7.693 -0.368 1
1 382 . 8 1 1 A 41 41 GLY HA2 H 39 3.953 4.077 -0.124 1
1 383 . 8 1 1 A 41 41 GLY C C 39 171.302 172.481 -1.179 1
1 384 . 8 1 1 A 41 41 GLY CA C 39 45.590 45.320 0.270 1
1 385 . 8 1 1 A 41 41 GLY N N 39 105.596 104.409 1.187 1
1 386 . 8 1 1 A 42 42 LYS H H 40 8.186 8.959 -0.773 1
1 387 . 8 1 1 A 42 42 LYS HA H 40 4.205 4.653 -0.448 1
1 393 . 8 1 1 A 42 42 LYS C C 40 175.672 175.309 0.363 1
1 394 . 8 1 1 A 42 42 LYS CA C 40 55.241 55.319 -0.078 1
1 395 . 8 1 1 A 42 42 LYS CB C 40 32.889 34.403 -1.514 1
1 399 . 8 1 1 A 42 42 LYS N N 40 120.341 122.070 -1.729 1
1 400 . 8 1 1 A 43 43 VAL H H 41 8.610 8.847 -0.237 1
1 401 . 8 1 1 A 43 43 VAL HA H 41 4.416 4.548 -0.132 1
1 409 . 8 1 1 A 43 43 VAL C C 41 175.997 175.548 0.449 1
1 410 . 8 1 1 A 43 43 VAL CA C 41 61.331 62.170 -0.839 1
1 411 . 8 1 1 A 43 43 VAL CB C 41 30.573 32.261 -1.688 1
1 414 . 8 1 1 A 43 43 VAL N N 41 127.312 124.023 3.289 1
1 415 . 8 1 1 A 44 44 LEU H H 42 8.894 8.439 0.455 1
1 416 . 8 1 1 A 44 44 LEU HA H 42 4.496 3.606 0.890 1
1 424 . 8 1 1 A 44 44 LEU CA C 42 54.522 55.415 -0.893 1
1 425 . 8 1 1 A 44 44 LEU CB C 42 40.980 41.970 -0.990 1
1 429 . 8 1 1 A 44 44 LEU N N 42 130.261 127.366 2.895 1
1 430 . 8 1 1 A 45 45 THR HA H 43 4.263 4.182 0.081 1
1 435 . 8 1 1 A 45 45 THR CA C 43 61.033 61.042 -0.009 1
1 436 . 8 1 1 A 45 45 THR CB C 43 69.768 67.295 2.473 1
1 440 . 8 1 1 A 46 46 GLU CA C 44 56.411 59.784 -3.373 1
1 441 . 8 1 1 A 46 46 GLU CB C 44 29.827 29.102 0.725 1
1 443 . 8 1 1 A 47 47 HIS HA H 45 4.549 4.280 0.269 1
1 447 . 8 1 1 A 47 47 HIS C C 45 174.812 177.260 -2.448 1
1 448 . 8 1 1 A 47 47 HIS CA C 45 56.107 59.922 -3.815 1
1 449 . 8 1 1 A 47 47 HIS CB C 45 29.080 30.037 -0.957 1
1 451 . 8 1 1 A 48 48 VAL H H 46 7.826 8.354 -0.528 1
1 452 . 8 1 1 A 48 48 VAL HA H 46 4.024 3.722 0.302 1
1 460 . 8 1 1 A 48 48 VAL C C 46 175.697 178.049 -2.352 1
1 461 . 8 1 1 A 48 48 VAL CA C 46 61.841 66.611 -4.770 1
1 462 . 8 1 1 A 48 48 VAL CB C 46 32.600 31.631 0.969 1
1 465 . 8 1 1 A 48 48 VAL N N 46 121.117 119.737 1.380 1
1 466 . 8 1 1 A 49 49 ALA H H 47 8.237 8.201 0.036 1
1 467 . 8 1 1 A 49 49 ALA HA H 47 4.281 4.247 0.034 1
1 471 . 8 1 1 A 49 49 ALA C C 47 177.173 178.578 -1.405 1
1 472 . 8 1 1 A 49 49 ALA CA C 47 52.207 55.321 -3.114 1
1 473 . 8 1 1 A 49 49 ALA CB C 47 19.064 18.288 0.776 1
1 474 . 8 1 1 A 49 49 ALA N N 47 126.817 121.999 4.818 1
1 475 . 8 1 1 A 50 50 ASP H H 48 8.029 8.940 -0.911 1
1 476 . 8 1 1 A 50 50 ASP HA H 48 4.436 4.596 -0.160 1
1 479 . 8 1 1 A 50 50 ASP C C 48 176.124 176.512 -0.388 1
1 480 . 8 1 1 A 50 50 ASP CA C 48 54.447 52.883 1.564 1
1 481 . 8 1 1 A 50 50 ASP CB C 48 40.877 38.820 2.057 1
1 482 . 8 1 1 A 50 50 ASP N N 48 119.687 117.689 1.998 1
1 483 . 8 1 1 A 51 51 ALA H H 49 8.094 8.648 -0.554 1
1 484 . 8 1 1 A 51 51 ALA HA H 49 4.134 4.485 -0.351 1
1 488 . 8 1 1 A 51 51 ALA C C 49 177.835 179.037 -1.202 1
1 489 . 8 1 1 A 51 51 ALA CA C 49 52.900 52.715 0.185 1
1 490 . 8 1 1 A 51 51 ALA CB C 49 18.942 21.082 -2.140 1
1 491 . 8 1 1 A 51 51 ALA N N 49 124.400 124.614 -0.214 1
1 492 . 8 1 1 A 52 52 GLU H H 50 8.243 7.775 0.468 1
1 493 . 8 1 1 A 52 52 GLU HA H 50 4.152 4.156 -0.004 1
1 497 . 8 1 1 A 52 52 GLU C C 50 176.456 178.289 -1.833 1
1 498 . 8 1 1 A 52 52 GLU CA C 50 56.480 58.523 -2.043 1
1 499 . 8 1 1 A 52 52 GLU CB C 50 29.470 28.378 1.092 1
1 501 . 8 1 1 A 52 52 GLU N N 50 118.917 116.972 1.945 1
1 502 . 8 1 1 A 53 53 LEU H H 51 7.839 7.552 0.287 1
1 503 . 8 1 1 A 53 53 LEU HA H 51 4.229 4.027 0.202 1
1 513 . 8 1 1 A 53 53 LEU C C 51 177.058 177.417 -0.359 1
1 514 . 8 1 1 A 53 53 LEU CA C 51 54.625 57.750 -3.125 1
1 515 . 8 1 1 A 53 53 LEU CB C 51 42.125 41.897 0.228 1
1 519 . 8 1 1 A 53 53 LEU N N 51 122.169 120.826 1.343 1
1 520 . 8 1 1 A 54 54 GLU H H 52 8.104 7.593 0.511 1
1 521 . 8 1 1 A 54 54 GLU HA H 52 4.470 4.556 -0.086 1
1 525 . 8 1 1 A 54 54 GLU CA C 52 54.286 57.680 -3.394 1
1 526 . 8 1 1 A 54 54 GLU CB C 52 29.268 32.220 -2.952 1
1 528 . 8 1 1 A 54 54 GLU N N 52 123.040 114.385 8.655 1
1 529 . 8 1 1 A 55 55 PRO HA H 53 4.310 4.584 -0.274 1
1 536 . 8 1 1 A 55 55 PRO C C 53 177.019 176.163 0.856 1
1 537 . 8 1 1 A 55 55 PRO CA C 53 63.075 62.705 0.370 1
1 538 . 8 1 1 A 55 55 PRO CB C 53 31.329 30.454 0.875 1
1 541 . 8 1 1 A 56 56 LEU H H 54 8.263 8.339 -0.076 1
1 542 . 8 1 1 A 56 56 LEU HA H 54 4.237 4.764 -0.527 1
1 552 . 8 1 1 A 56 56 LEU C C 54 178.055 176.364 1.691 1
1 553 . 8 1 1 A 56 56 LEU CA C 54 55.018 53.684 1.334 1
1 554 . 8 1 1 A 56 56 LEU CB C 54 41.990 45.269 -3.279 1
1 558 . 8 1 1 A 56 56 LEU N N 54 122.728 124.772 -2.044 1
1 559 . 8 1 1 A 57 57 GLY H H 55 8.231 8.803 -0.572 1
1 560 . 8 1 1 A 57 57 GLY HA2 H 55 3.911 3.872 0.039 1
1 561 . 8 1 1 A 57 57 GLY HA3 H 55 3.808 3.877 -0.069 1
1 562 . 8 1 1 A 57 57 GLY C C 55 174.379 174.609 -0.230 1
1 563 . 8 1 1 A 57 57 GLY CA C 55 45.092 46.609 -1.517 1
1 564 . 8 1 1 A 57 57 GLY N N 55 110.035 110.708 -0.673 1
1 565 . 8 1 1 A 58 58 GLU H H 56 8.241 8.469 -0.228 1
1 566 . 8 1 1 A 58 58 GLU HA H 56 4.136 4.136 0.000 1
1 570 . 8 1 1 A 58 58 GLU C C 56 176.868 176.726 0.142 1
1 571 . 8 1 1 A 58 58 GLU CA C 56 56.734 58.676 -1.942 1
1 572 . 8 1 1 A 58 58 GLU CB C 56 29.584 28.469 1.115 1
1 574 . 8 1 1 A 58 58 GLU N N 56 121.173 113.763 7.410 1
1 575 . 8 1 1 A 59 59 GLU H H 57 8.419 9.018 -0.599 1
1 576 . 8 1 1 A 59 59 GLU HA H 57 4.074 4.021 0.053 1
1 580 . 8 1 1 A 59 59 GLU C C 57 176.502 175.069 1.433 1
1 581 . 8 1 1 A 59 59 GLU CA C 57 56.842 58.002 -1.160 1
1 582 . 8 1 1 A 59 59 GLU CB C 57 29.267 29.543 -0.276 1
1 584 . 8 1 1 A 59 59 GLU N N 57 121.777 122.200 -0.423 1
1 585 . 8 1 1 A 60 60 ALA H H 58 8.077 7.657 0.420 1
1 586 . 8 1 1 A 60 60 ALA HA H 58 4.134 4.578 -0.444 1
1 590 . 8 1 1 A 60 60 ALA CA C 58 52.432 51.529 0.903 1
1 591 . 8 1 1 A 60 60 ALA CB C 58 18.743 20.296 -1.553 1
1 592 . 8 1 1 A 60 60 ALA N N 58 125.120 120.513 4.607 1
1 593 . 8 1 1 A 61 61 ALA H H 59 8.041 8.633 -0.592 1
1 594 . 8 1 1 A 61 61 ALA HA H 59 4.131 4.496 -0.365 1
1 598 . 8 1 1 A 61 61 ALA C C 59 178.147 178.518 -0.371 1
1 599 . 8 1 1 A 61 61 ALA CA C 59 52.586 52.406 0.180 1
1 600 . 8 1 1 A 61 61 ALA CB C 59 18.692 21.341 -2.649 1
1 601 . 8 1 1 A 61 61 ALA N N 59 123.857 125.798 -1.941 1
1 602 . 8 1 1 A 62 62 GLY H H 60 8.069 8.886 -0.817 1
1 603 . 8 1 1 A 62 62 GLY HA2 H 60 3.810 3.962 -0.152 1
1 604 . 8 1 1 A 62 62 GLY HA3 H 60 3.888 3.970 -0.082 1
1 605 . 8 1 1 A 62 62 GLY C C 60 174.914 174.305 0.609 1
1 606 . 8 1 1 A 62 62 GLY CA C 60 45.320 45.386 -0.066 1
1 607 . 8 1 1 A 62 62 GLY N N 60 107.924 107.871 0.053 1
1 608 . 8 1 1 A 63 63 GLY H H 61 8.118 8.514 -0.396 1
1 609 . 8 1 1 A 63 63 GLY HA2 H 61 4.008 4.162 -0.154 1
1 610 . 8 1 1 A 63 63 GLY HA3 H 61 3.893 4.225 -0.332 1
1 611 . 8 1 1 A 63 63 GLY C C 61 174.743 174.491 0.252 1
1 612 . 8 1 1 A 63 63 GLY CA C 61 45.202 45.639 -0.437 1
1 613 . 8 1 1 A 63 63 GLY N N 61 109.441 107.723 1.718 1
1 614 . 8 1 1 A 64 64 ASP H H 62 8.305 8.971 -0.666 1
1 615 . 8 1 1 A 64 64 ASP HA H 62 4.240 4.268 -0.028 1
1 618 . 8 1 1 A 64 64 ASP C C 62 177.571 177.565 0.006 1
1 619 . 8 1 1 A 64 64 ASP CA C 62 57.210 57.219 -0.009 1
1 620 . 8 1 1 A 64 64 ASP CB C 62 40.142 39.969 0.173 1
1 621 . 8 1 1 A 64 64 ASP N N 62 121.568 122.307 -0.739 1
1 622 . 8 1 1 A 65 65 GLN H H 63 8.337 8.330 0.007 1
1 623 . 8 1 1 A 65 65 GLN HA H 63 4.138 4.031 0.107 1
1 628 . 8 1 1 A 65 65 GLN C C 63 177.490 178.712 -1.222 1
1 629 . 8 1 1 A 65 65 GLN CA C 63 58.643 59.058 -0.415 1
1 630 . 8 1 1 A 65 65 GLN CB C 63 27.803 28.312 -0.509 1
1 632 . 8 1 1 A 65 65 GLN N N 63 119.700 118.820 0.880 1
1 633 . 8 1 1 A 66 66 PHE H H 64 7.658 7.916 -0.258 1
1 634 . 8 1 1 A 66 66 PHE HA H 64 4.170 4.145 0.025 1
1 638 . 8 1 1 A 66 66 PHE C C 64 176.872 177.118 -0.246 1
1 639 . 8 1 1 A 66 66 PHE CA C 64 60.158 61.368 -1.210 1
1 640 . 8 1 1 A 66 66 PHE CB C 64 38.490 39.167 -0.677 1
1 643 . 8 1 1 A 66 66 PHE N N 64 121.036 120.130 0.906 1
1 644 . 8 1 1 A 67 67 ILE H H 65 7.646 8.915 -1.269 1
1 645 . 8 1 1 A 67 67 ILE HA H 65 3.426 3.205 0.221 1
1 655 . 8 1 1 A 67 67 ILE CA C 65 63.377 65.209 -1.832 1
1 656 . 8 1 1 A 67 67 ILE CB C 65 37.057 37.650 -0.593 1
1 660 . 8 1 1 A 67 67 ILE N N 65 121.372 120.050 1.322 1
1 661 . 8 1 1 A 68 68 HIS H H 66 7.945 8.167 -0.222 1
1 662 . 8 1 1 A 68 68 HIS HA H 66 4.005 4.172 -0.167 1
1 665 . 8 1 1 A 68 68 HIS CA C 66 59.915 59.353 0.562 1
1 668 . 8 1 1 A 68 68 HIS N N 66 120.036 119.955 0.081 1
1 669 . 8 1 1 A 69 69 GLU HA H 67 3.677 3.865 -0.188 1
1 673 . 8 1 1 A 69 69 GLU CA C 67 58.490 59.696 -1.206 1
1 674 . 8 1 1 A 69 69 GLU CB C 67 29.290 29.019 0.271 1
1 676 . 8 1 1 A 70 70 GLN H H 68 8.017 7.654 0.363 1
1 677 . 8 1 1 A 70 70 GLN HA H 68 3.426 3.755 -0.329 1
1 678 . 8 1 1 A 70 70 GLN C C 68 179.280 178.504 0.776 1
1 679 . 8 1 1 A 70 70 GLN CA C 68 57.561 58.276 -0.715 1
1 680 . 8 1 1 A 70 70 GLN CB C 68 28.530 28.040 0.490 1
1 682 . 8 1 1 A 70 70 GLN N N 68 120.410 118.557 1.853 1
1 683 . 8 1 1 A 71 71 ASP HA H 69 4.440 4.616 -0.176 1
1 684 . 8 1 1 A 71 71 ASP C C 69 177.402 178.627 -1.225 1
1 685 . 8 1 1 A 71 71 ASP CA C 69 56.290 57.140 -0.850 1
1 686 . 8 1 1 A 72 72 LEU H H 70 7.952 8.168 -0.216 1
1 687 . 8 1 1 A 72 72 LEU HA H 70 3.775 3.829 -0.054 1
1 697 . 8 1 1 A 72 72 LEU C C 70 178.316 177.995 0.321 1
1 698 . 8 1 1 A 72 72 LEU CA C 70 56.101 57.314 -1.213 1
1 699 . 8 1 1 A 72 72 LEU CB C 70 39.872 41.311 -1.439 1
1 703 . 8 1 1 A 72 72 LEU N N 70 120.832 120.903 -0.071 1
1 704 . 8 1 1 A 73 73 ASN H H 71 7.723 8.076 -0.353 1
1 705 . 8 1 1 A 73 73 ASN HA H 71 4.270 4.303 -0.033 1
1 708 . 8 1 1 A 73 73 ASN C C 71 178.193 177.658 0.535 1
1 709 . 8 1 1 A 73 73 ASN CA C 71 55.970 56.297 -0.327 1
1 710 . 8 1 1 A 73 73 ASN CB C 71 37.640 39.155 -1.515 1
1 711 . 8 1 1 A 73 73 ASN N N 71 119.295 117.136 2.159 1
1 712 . 8 1 1 A 74 74 TRP H H 72 7.811 8.125 -0.314 1
1 713 . 8 1 1 A 74 74 TRP HA H 72 4.500 4.455 0.045 1
1 720 . 8 1 1 A 74 74 TRP CA C 72 58.480 59.541 -1.061 1
1 721 . 8 1 1 A 74 74 TRP CB C 72 28.920 29.483 -0.563 1
1 727 . 8 1 1 A 74 74 TRP N N 72 121.490 120.340 1.150 1
1 729 . 8 1 1 A 75 75 LEU H H 73 8.412 8.072 0.340 1
1 730 . 8 1 1 A 75 75 LEU HA H 73 3.290 3.331 -0.041 1
1 739 . 8 1 1 A 75 75 LEU C C 73 178.562 178.582 -0.020 1
1 740 . 8 1 1 A 75 75 LEU CA C 73 58.226 57.402 0.824 1
1 741 . 8 1 1 A 75 75 LEU CB C 73 41.200 41.064 0.136 1
1 745 . 8 1 1 A 75 75 LEU N N 73 121.065 121.009 0.056 1
1 746 . 8 1 1 A 76 76 GLN H H 74 7.648 7.701 -0.053 1
1 747 . 8 1 1 A 76 76 GLN HA H 74 3.657 4.050 -0.393 1
1 752 . 8 1 1 A 76 76 GLN C C 74 178.616 177.595 1.021 1
1 753 . 8 1 1 A 76 76 GLN CA C 74 58.777 58.840 -0.063 1
1 754 . 8 1 1 A 76 76 GLN CB C 74 28.163 28.270 -0.107 1
1 756 . 8 1 1 A 76 76 GLN N N 74 113.985 119.055 -5.070 1
1 757 . 8 1 1 A 77 77 GLN H H 75 7.465 7.725 -0.260 1
1 758 . 8 1 1 A 77 77 GLN HA H 75 4.134 4.438 -0.304 1
1 761 . 8 1 1 A 77 77 GLN C C 75 176.223 175.793 0.430 1
1 762 . 8 1 1 A 77 77 GLN CA C 75 56.203 55.614 0.589 1
1 763 . 8 1 1 A 77 77 GLN CB C 75 29.524 29.511 0.013 1
1 765 . 8 1 1 A 77 77 GLN N N 75 117.481 116.544 0.937 1
1 766 . 8 1 1 A 78 78 ALA H H 76 7.420 7.198 0.222 1
1 767 . 8 1 1 A 78 78 ALA HA H 76 3.864 4.262 -0.398 1
1 771 . 8 1 1 A 78 78 ALA C C 76 176.733 177.072 -0.339 1
1 772 . 8 1 1 A 78 78 ALA CA C 76 52.529 52.812 -0.283 1
1 773 . 8 1 1 A 78 78 ALA CB C 76 20.124 19.262 0.862 1
1 774 . 8 1 1 A 78 78 ALA N N 76 122.682 123.312 -0.630 1
1 775 . 8 1 1 A 79 79 ASP H H 77 9.028 9.238 -0.210 1
1 776 . 8 1 1 A 79 79 ASP HA H 77 4.673 4.663 0.010 1
1 779 . 8 1 1 A 79 79 ASP C C 77 175.740 176.420 -0.680 1
1 780 . 8 1 1 A 79 79 ASP CA C 77 56.383 57.026 -0.643 1
1 781 . 8 1 1 A 79 79 ASP CB C 77 42.826 42.761 0.065 1
1 782 . 8 1 1 A 79 79 ASP N N 77 119.887 122.894 -3.007 1
1 783 . 8 1 1 A 80 80 VAL H H 78 7.379 7.778 -0.399 1
1 784 . 8 1 1 A 80 80 VAL HA H 78 4.340 4.819 -0.479 1
1 792 . 8 1 1 A 80 80 VAL C C 78 175.321 174.371 0.950 1
1 793 . 8 1 1 A 80 80 VAL CA C 78 60.011 60.453 -0.442 1
1 794 . 8 1 1 A 80 80 VAL CB C 78 35.362 35.819 -0.457 1
1 797 . 8 1 1 A 80 80 VAL N N 78 114.152 117.811 -3.659 1
1 798 . 8 1 1 A 81 81 VAL H H 79 8.350 8.216 0.134 1
1 799 . 8 1 1 A 81 81 VAL HA H 79 4.799 4.835 -0.036 1
1 807 . 8 1 1 A 81 81 VAL C C 79 173.095 174.680 -1.585 1
1 808 . 8 1 1 A 81 81 VAL CA C 79 60.775 60.686 0.089 1
1 809 . 8 1 1 A 81 81 VAL CB C 79 32.824 35.284 -2.460 1
1 812 . 8 1 1 A 81 81 VAL N N 79 128.429 125.909 2.520 1
1 813 . 8 1 1 A 82 82 VAL H H 80 8.947 8.704 0.243 1
1 814 . 8 1 1 A 82 82 VAL HA H 80 4.947 4.691 0.256 1
1 822 . 8 1 1 A 82 82 VAL C C 80 173.522 174.534 -1.012 1
1 823 . 8 1 1 A 82 82 VAL CA C 80 59.684 60.395 -0.711 1
1 824 . 8 1 1 A 82 82 VAL CB C 80 33.702 34.376 -0.674 1
1 827 . 8 1 1 A 82 82 VAL N N 80 126.957 126.758 0.199 1
1 828 . 8 1 1 A 83 83 ALA H H 81 9.011 9.145 -0.134 1
1 829 . 8 1 1 A 83 83 ALA HA H 81 4.938 5.559 -0.621 1
1 833 . 8 1 1 A 83 83 ALA C C 81 130.330 175.736 -45.406 1
1 834 . 8 1 1 A 83 83 ALA CA C 81 49.490 49.989 -0.499 1
1 835 . 8 1 1 A 83 83 ALA CB C 81 23.628 23.292 0.336 1
1 836 . 8 1 1 A 83 83 ALA N N 81 128.705 129.199 -0.494 1
1 837 . 8 1 1 A 84 84 GLU H H 82 8.922 8.555 0.367 1
1 838 . 8 1 1 A 84 84 GLU HA H 82 4.937 4.811 0.126 1
1 839 . 8 1 1 A 84 84 GLU C C 82 177.673 177.408 0.265 1
1 840 . 8 1 1 A 84 84 GLU CA C 82 56.714 55.656 1.058 1
1 841 . 8 1 1 A 84 84 GLU CB C 82 29.882 31.062 -1.180 1
1 842 . 8 1 1 A 84 84 GLU N N 82 130.330 119.951 10.379 1
1 843 . 8 1 1 A 85 85 VAL H H 83 8.427 8.820 -0.393 1
1 844 . 8 1 1 A 85 85 VAL HA H 83 4.435 4.613 -0.178 1
1 852 . 8 1 1 A 85 85 VAL C C 83 174.252 176.389 -2.137 1
1 853 . 8 1 1 A 85 85 VAL CA C 83 59.896 61.245 -1.349 1
1 854 . 8 1 1 A 85 85 VAL CB C 83 29.968 31.815 -1.847 1
1 857 . 8 1 1 A 85 85 VAL N N 83 114.212 119.931 -5.719 1
1 858 . 8 1 1 A 86 86 THR H H 84 9.347 7.852 1.495 1
1 859 . 8 1 1 A 86 86 THR HA H 84 4.146 4.383 -0.237 1
1 864 . 8 1 1 A 86 86 THR C C 84 175.751 175.175 0.576 1
1 865 . 8 1 1 A 86 86 THR CA C 84 67.629 64.790 2.839 1
1 866 . 8 1 1 A 86 86 THR CB C 84 66.819 69.770 -2.951 1
1 868 . 8 1 1 A 86 86 THR N N 84 121.640 117.060 4.580 1
1 869 . 8 1 1 A 87 87 GLN H H 85 8.114 7.974 0.140 1
1 870 . 8 1 1 A 87 87 GLN HA H 85 4.736 4.555 0.181 1
1 874 . 8 1 1 A 87 87 GLN CA C 85 51.898 53.774 -1.876 1
1 875 . 8 1 1 A 87 87 GLN CB C 85 27.942 29.565 -1.623 1
1 877 . 8 1 1 A 87 87 GLN N N 85 120.367 119.632 0.735 1
1 878 . 8 1 1 A 88 88 PRO HA H 86 4.061 4.617 -0.556 1
1 885 . 8 1 1 A 88 88 PRO C C 86 176.436 176.229 0.207 1
1 886 . 8 1 1 A 88 88 PRO CA C 86 63.422 63.258 0.164 1
1 887 . 8 1 1 A 88 88 PRO CB C 86 31.925 32.428 -0.503 1
1 889 . 8 1 1 A 89 89 SER H H 87 6.044 8.229 -2.185 1
1 890 . 8 1 1 A 89 89 SER HA H 87 4.630 4.893 -0.263 1
1 893 . 8 1 1 A 89 89 SER C C 87 175.612 174.274 1.338 1
1 894 . 8 1 1 A 89 89 SER CA C 87 56.800 57.648 -0.848 1
1 895 . 8 1 1 A 89 89 SER CB C 87 64.196 65.758 -1.562 1
1 896 . 8 1 1 A 89 89 SER N N 87 115.721 114.367 1.354 1
1 897 . 8 1 1 A 90 90 LEU H H 88 9.702 8.886 0.816 1
1 898 . 8 1 1 A 90 90 LEU HA H 88 4.270 3.955 0.315 1
1 906 . 8 1 1 A 90 90 LEU C C 88 179.173 179.162 0.011 1
1 907 . 8 1 1 A 90 90 LEU CA C 88 57.402 58.385 -0.983 1
1 908 . 8 1 1 A 90 90 LEU CB C 88 43.642 41.549 2.093 1
1 911 . 8 1 1 A 90 90 LEU N N 88 130.488 123.165 7.323 1
1 912 . 8 1 1 A 91 91 GLY H H 89 8.354 8.454 -0.100 1
1 913 . 8 1 1 A 91 91 GLY HA2 H 89 3.680 3.801 -0.121 1
1 914 . 8 1 1 A 91 91 GLY HA3 H 89 3.584 3.835 -0.251 1
1 915 . 8 1 1 A 91 91 GLY C C 89 175.106 176.400 -1.294 1
1 916 . 8 1 1 A 91 91 GLY CA C 89 47.770 47.485 0.285 1
1 917 . 8 1 1 A 91 91 GLY N N 89 107.522 105.955 1.567 1
1 918 . 8 1 1 A 92 92 VAL H H 90 7.906 8.206 -0.300 1
1 919 . 8 1 1 A 92 92 VAL HA H 90 3.940 3.743 0.197 1
1 927 . 8 1 1 A 92 92 VAL C C 90 178.467 178.322 0.145 1
1 928 . 8 1 1 A 92 92 VAL CA C 90 65.379 66.548 -1.169 1
1 929 . 8 1 1 A 92 92 VAL CB C 90 31.785 31.807 -0.022 1
1 932 . 8 1 1 A 92 92 VAL N N 90 121.741 121.785 -0.044 1
1 933 . 8 1 1 A 93 93 GLY H H 91 7.595 8.162 -0.567 1
1 934 . 8 1 1 A 93 93 GLY HA2 H 91 3.628 3.778 -0.150 1
1 935 . 8 1 1 A 93 93 GLY HA3 H 91 3.415 3.785 -0.370 1
1 936 . 8 1 1 A 93 93 GLY C C 91 174.022 175.411 -1.389 1
1 937 . 8 1 1 A 93 93 GLY CA C 91 48.319 47.314 1.005 1
1 938 . 8 1 1 A 93 93 GLY N N 91 104.629 107.218 -2.589 1
1 939 . 8 1 1 A 94 94 TYR H H 92 8.372 9.225 -0.853 1
1 940 . 8 1 1 A 94 94 TYR HA H 92 4.046 4.067 -0.021 1
1 943 . 8 1 1 A 94 94 TYR C C 92 177.458 177.836 -0.378 1
1 944 . 8 1 1 A 94 94 TYR CA C 92 61.760 60.730 1.030 1
1 945 . 8 1 1 A 94 94 TYR CB C 92 38.431 38.719 -0.288 1
1 948 . 8 1 1 A 94 94 TYR N N 92 123.383 123.245 0.138 1
1 949 . 8 1 1 A 95 95 GLU H H 93 8.424 8.664 -0.240 1
1 950 . 8 1 1 A 95 95 GLU HA H 93 3.421 3.829 -0.408 1
1 951 . 8 1 1 A 95 95 GLU C C 93 178.590 179.365 -0.775 1
1 952 . 8 1 1 A 95 95 GLU CA C 93 60.211 59.098 1.113 1
1 953 . 8 1 1 A 95 95 GLU CB C 93 29.025 29.010 0.015 1
1 954 . 8 1 1 A 95 95 GLU N N 93 120.181 118.668 1.513 1
1 955 . 8 1 1 A 96 96 LEU H H 94 8.210 8.214 -0.004 1
1 956 . 8 1 1 A 96 96 LEU HA H 94 3.830 3.976 -0.146 1
1 964 . 8 1 1 A 96 96 LEU C C 94 179.032 179.172 -0.140 1
1 965 . 8 1 1 A 96 96 LEU CA C 94 57.683 58.536 -0.853 1
1 966 . 8 1 1 A 96 96 LEU CB C 94 41.883 42.002 -0.119 1
1 970 . 8 1 1 A 96 96 LEU N N 94 118.091 120.904 -2.813 1
1 971 . 8 1 1 A 97 97 GLY H H 95 8.773 8.490 0.283 1
1 972 . 8 1 1 A 97 97 GLY C C 95 175.344 175.371 -0.027 1
1 973 . 8 1 1 A 97 97 GLY CA C 95 47.308 47.072 0.236 1
1 974 . 8 1 1 A 97 97 GLY N N 95 108.085 105.050 3.035 1
1 975 . 8 1 1 A 98 98 ARG H H 96 8.100 8.206 -0.106 1
1 976 . 8 1 1 A 98 98 ARG C C 96 179.692 177.975 1.717 1
1 977 . 8 1 1 A 98 98 ARG CA C 96 56.308 58.728 -2.420 1
1 978 . 8 1 1 A 98 98 ARG CB C 96 26.854 29.635 -2.781 1
1 979 . 8 1 1 A 98 98 ARG N N 96 118.156 121.643 -3.487 1
1 980 . 8 1 1 A 99 99 ALA H H 97 8.498 7.628 0.870 1
1 981 . 8 1 1 A 99 99 ALA HA H 97 3.640 4.023 -0.383 1
1 985 . 8 1 1 A 99 99 ALA C C 97 179.650 180.097 -0.447 1
1 986 . 8 1 1 A 99 99 ALA CA C 97 55.166 55.025 0.141 1
1 987 . 8 1 1 A 99 99 ALA CB C 97 18.604 18.263 0.341 1
1 988 . 8 1 1 A 99 99 ALA N N 97 122.310 121.520 0.790 1
1 989 . 8 1 1 A 100 100 VAL H H 98 8.597 8.352 0.245 1
1 990 . 8 1 1 A 100 100 VAL HA H 98 3.798 3.542 0.256 1
1 998 . 8 1 1 A 100 100 VAL C C 98 180.464 177.996 2.468 1
1 999 . 8 1 1 A 100 100 VAL CA C 98 65.664 66.666 -1.002 1
1 1000 . 8 1 1 A 100 100 VAL CB C 98 31.065 31.456 -0.391 1
1 1003 . 8 1 1 A 100 100 VAL N N 98 120.603 118.818 1.785 1
1 1004 . 8 1 1 A 101 101 ALA H H 99 7.280 7.891 -0.611 1
1 1005 . 8 1 1 A 101 101 ALA HA H 99 3.963 4.045 -0.082 1
1 1009 . 8 1 1 A 101 101 ALA C C 99 179.314 180.424 -1.110 1
1 1010 . 8 1 1 A 101 101 ALA CA C 99 54.367 55.193 -0.826 1
1 1011 . 8 1 1 A 101 101 ALA CB C 99 18.139 18.616 -0.477 1
1 1012 . 8 1 1 A 101 101 ALA N N 99 124.450 121.962 2.488 1
1 1013 . 8 1 1 A 102 102 LEU H H 100 7.200 8.433 -1.233 1
1 1014 . 8 1 1 A 102 102 LEU HA H 100 4.192 4.180 0.012 1
1 1024 . 8 1 1 A 102 102 LEU C C 100 177.306 176.991 0.315 1
1 1025 . 8 1 1 A 102 102 LEU CA C 100 54.808 55.175 -0.367 1
1 1026 . 8 1 1 A 102 102 LEU CB C 100 42.880 42.260 0.620 1
1 1030 . 8 1 1 A 102 102 LEU N N 100 116.834 116.444 0.390 1
1 1031 . 8 1 1 A 103 103 GLY H H 101 7.891 7.907 -0.016 1
1 1032 . 8 1 1 A 103 103 GLY HA2 H 101 3.941 3.925 0.016 1
1 1033 . 8 1 1 A 103 103 GLY HA3 H 101 3.831 3.933 -0.102 1
1 1034 . 8 1 1 A 103 103 GLY C C 101 175.137 174.888 0.249 1
1 1035 . 8 1 1 A 103 103 GLY CA C 101 45.673 46.468 -0.795 1
1 1036 . 8 1 1 A 103 103 GLY N N 101 109.395 108.802 0.593 1
1 1037 . 8 1 1 A 104 104 LYS H H 102 7.337 7.996 -0.659 1
1 1038 . 8 1 1 A 104 104 LYS HA H 102 4.402 4.544 -0.142 1
1 1043 . 8 1 1 A 104 104 LYS CA C 102 52.136 53.578 -1.442 1
1 1044 . 8 1 1 A 104 104 LYS CB C 102 31.045 32.067 -1.022 1
1 1047 . 8 1 1 A 104 104 LYS N N 102 118.954 120.822 -1.868 1
1 1048 . 8 1 1 A 105 105 PRO HA H 103 4.781 4.428 0.353 1
1 1054 . 8 1 1 A 105 105 PRO CA C 103 62.791 63.359 -0.568 1
1 1055 . 8 1 1 A 105 105 PRO CB C 103 30.405 32.087 -1.682 1
1 1058 . 8 1 1 A 106 106 ILE H H 104 8.261 8.961 -0.700 1
1 1059 . 8 1 1 A 106 106 ILE HA H 104 4.680 4.431 0.249 1
1 1069 . 8 1 1 A 106 106 ILE C C 104 175.543 174.052 1.491 1
1 1070 . 8 1 1 A 106 106 ILE CA C 104 59.362 60.383 -1.021 1
1 1071 . 8 1 1 A 106 106 ILE CB C 104 43.738 38.420 5.318 1
1 1075 . 8 1 1 A 106 106 ILE N N 104 123.509 124.930 -1.421 1
1 1076 . 8 1 1 A 107 107 LEU H H 105 8.584 8.402 0.182 1
1 1077 . 8 1 1 A 107 107 LEU HA H 105 4.243 4.466 -0.223 1
1 1087 . 8 1 1 A 107 107 LEU C C 105 174.204 174.368 -0.164 1
1 1088 . 8 1 1 A 107 107 LEU CA C 105 52.863 53.337 -0.474 1
1 1089 . 8 1 1 A 107 107 LEU CB C 105 42.408 42.972 -0.564 1
1 1093 . 8 1 1 A 107 107 LEU N N 105 131.882 129.726 2.156 1
1 1094 . 8 1 1 A 108 108 CYS H H 106 8.679 8.722 -0.043 1
1 1095 . 8 1 1 A 108 108 CYS HA H 106 5.280 5.492 -0.212 1
1 1099 . 8 1 1 A 108 108 CYS C C 106 173.134 173.390 -0.256 1
1 1100 . 8 1 1 A 108 108 CYS CA C 106 57.290 56.893 0.397 1
1 1101 . 8 1 1 A 108 108 CYS CB C 106 29.559 28.772 0.787 1
1 1102 . 8 1 1 A 108 108 CYS N N 106 122.904 125.745 -2.841 1
1 1103 . 8 1 1 A 109 109 LEU H H 107 8.987 8.989 -0.002 1
1 1104 . 8 1 1 A 109 109 LEU HA H 107 5.120 5.586 -0.466 1
1 1112 . 8 1 1 A 109 109 LEU C C 107 174.500 175.382 -0.882 1
1 1113 . 8 1 1 A 109 109 LEU CA C 107 53.274 53.585 -0.311 1
1 1114 . 8 1 1 A 109 109 LEU CB C 107 43.450 44.429 -0.979 1
1 1118 . 8 1 1 A 109 109 LEU N N 107 124.653 125.602 -0.949 1
1 1119 . 8 1 1 A 110 110 PHE H H 108 8.981 9.236 -0.255 1
1 1120 . 8 1 1 A 110 110 PHE HA H 108 4.846 5.849 -1.003 1
1 1125 . 8 1 1 A 110 110 PHE C C 108 172.231 172.934 -0.703 1
1 1126 . 8 1 1 A 110 110 PHE CA C 108 55.963 56.247 -0.284 1
1 1127 . 8 1 1 A 110 110 PHE CB C 108 43.270 43.366 -0.096 1
1 1130 . 8 1 1 A 110 110 PHE N N 108 125.052 125.438 -0.386 1
1 1131 . 8 1 1 A 111 111 ARG H H 109 7.461 8.072 -0.611 1
1 1132 . 8 1 1 A 111 111 ARG HA H 109 4.804 4.576 0.228 1
1 1136 . 8 1 1 A 111 111 ARG CA C 109 51.953 51.874 0.079 1
1 1137 . 8 1 1 A 111 111 ARG CB C 109 30.008 31.017 -1.009 1
1 1140 . 8 1 1 A 111 111 ARG N N 109 128.034 126.315 1.719 1
1 1141 . 8 1 1 A 112 112 PRO C C 110 178.675 177.999 0.676 1
1 1142 . 8 1 1 A 112 112 PRO CA C 110 64.024 64.481 -0.457 1
1 1143 . 8 1 1 A 112 112 PRO CB C 110 31.416 32.043 -0.627 1
1 1144 . 8 1 1 A 113 113 GLN H H 111 8.188 8.658 -0.470 1
1 1145 . 8 1 1 A 113 113 GLN HA H 111 4.056 4.031 0.025 1
1 1149 . 8 1 1 A 113 113 GLN C C 111 175.936 177.778 -1.842 1
1 1150 . 8 1 1 A 113 113 GLN CA C 111 57.144 58.360 -1.216 1
1 1151 . 8 1 1 A 113 113 GLN CB C 111 28.033 27.988 0.045 1
1 1153 . 8 1 1 A 113 113 GLN N N 111 118.835 116.462 2.373 1
1 1154 . 8 1 1 A 114 114 SER H H 112 7.730 7.523 0.207 1
1 1155 . 8 1 1 A 114 114 SER HA H 112 4.037 4.402 -0.365 1
1 1158 . 8 1 1 A 114 114 SER C C 112 175.750 174.637 1.113 1
1 1159 . 8 1 1 A 114 114 SER CA C 112 60.154 58.494 1.660 1
1 1160 . 8 1 1 A 114 114 SER CB C 112 64.282 63.654 0.628 1
1 1161 . 8 1 1 A 114 114 SER N N 112 114.887 114.012 0.875 1
1 1162 . 8 1 1 A 115 115 GLY H H 113 8.005 7.839 0.166 1
1 1163 . 8 1 1 A 115 115 GLY HA2 H 113 3.712 3.947 -0.235 1
1 1164 . 8 1 1 A 115 115 GLY HA3 H 113 4.130 3.985 0.145 1
1 1165 . 8 1 1 A 115 115 GLY C C 113 173.945 174.739 -0.794 1
1 1166 . 8 1 1 A 115 115 GLY CA C 113 45.233 45.666 -0.433 1
1 1167 . 8 1 1 A 115 115 GLY N N 113 110.740 108.387 2.353 1
1 1168 . 8 1 1 A 116 116 ARG H H 114 7.665 8.818 -1.153 1
1 1169 . 8 1 1 A 116 116 ARG HA H 114 4.449 4.696 -0.247 1
1 1173 . 8 1 1 A 116 116 ARG C C 114 175.370 175.517 -0.147 1
1 1174 . 8 1 1 A 116 116 ARG CA C 114 55.080 55.243 -0.163 1
1 1175 . 8 1 1 A 116 116 ARG CB C 114 31.215 32.698 -1.483 1
1 1178 . 8 1 1 A 116 116 ARG N N 114 119.983 122.487 -2.504 1
1 1179 . 8 1 1 A 117 117 VAL H H 115 8.409 8.298 0.111 1
1 1180 . 8 1 1 A 117 117 VAL HA H 115 4.184 3.673 0.511 1
1 1188 . 8 1 1 A 117 117 VAL C C 115 175.980 174.964 1.016 1
1 1189 . 8 1 1 A 117 117 VAL CA C 115 61.167 62.529 -1.362 1
1 1190 . 8 1 1 A 117 117 VAL CB C 115 32.931 30.696 2.235 1
1 1193 . 8 1 1 A 117 117 VAL N N 115 122.240 116.760 5.480 1
1 1194 . 8 1 1 A 118 118 LEU H H 116 8.227 7.709 0.518 1
1 1195 . 8 1 1 A 118 118 LEU HA H 116 3.720 4.396 -0.676 1
1 1204 . 8 1 1 A 118 118 LEU C C 116 175.623 176.615 -0.992 1
1 1205 . 8 1 1 A 118 118 LEU CA C 116 54.555 54.225 0.330 1
1 1206 . 8 1 1 A 118 118 LEU CB C 116 39.292 43.370 -4.078 1
1 1210 . 8 1 1 A 118 118 LEU N N 116 131.481 125.195 6.286 1
1 1211 . 8 1 1 A 119 119 SER H H 117 7.780 8.432 -0.652 1
1 1212 . 8 1 1 A 119 119 SER HA H 117 4.060 4.512 -0.452 1
1 1214 . 8 1 1 A 119 119 SER C C 117 175.782 175.629 0.153 1
1 1215 . 8 1 1 A 119 119 SER CA C 117 58.530 58.614 -0.084 1
1 1216 . 8 1 1 A 119 119 SER CB C 117 64.785 63.683 1.102 1
1 1217 . 8 1 1 A 119 119 SER N N 117 118.658 116.336 2.322 1
1 1218 . 8 1 1 A 120 120 ALA H H 118 8.955 8.958 -0.003 1
1 1219 . 8 1 1 A 120 120 ALA HA H 118 3.846 3.957 -0.111 1
1 1223 . 8 1 1 A 120 120 ALA C C 118 179.731 179.855 -0.124 1
1 1224 . 8 1 1 A 120 120 ALA CA C 118 54.927 55.326 -0.399 1
1 1225 . 8 1 1 A 120 120 ALA CB C 118 18.627 18.394 0.233 1
1 1226 . 8 1 1 A 120 120 ALA N N 118 134.119 130.261 3.858 1
1 1227 . 8 1 1 A 121 121 MET H H 119 7.718 7.818 -0.100 1
1 1228 . 8 1 1 A 121 121 MET HA H 119 4.130 4.114 0.016 1
1 1235 . 8 1 1 A 121 121 MET C C 119 175.610 178.805 -3.195 1
1 1236 . 8 1 1 A 121 121 MET CA C 119 55.968 58.569 -2.601 1
1 1237 . 8 1 1 A 121 121 MET CB C 119 30.814 32.935 -2.121 1
1 1240 . 8 1 1 A 121 121 MET N N 119 115.424 116.575 -1.151 1
1 1241 . 8 1 1 A 122 122 ILE H H 120 6.451 7.866 -1.415 1
1 1242 . 8 1 1 A 122 122 ILE HA H 120 3.392 3.641 -0.249 1
1 1252 . 8 1 1 A 122 122 ILE C C 120 177.108 177.887 -0.779 1
1 1253 . 8 1 1 A 122 122 ILE CA C 120 59.650 64.766 -5.116 1
1 1254 . 8 1 1 A 122 122 ILE CB C 120 34.640 37.596 -2.956 1
1 1258 . 8 1 1 A 122 122 ILE N N 120 113.418 119.376 -5.958 1
1 1259 . 8 1 1 A 123 123 ARG H H 121 7.540 7.987 -0.447 1
1 1260 . 8 1 1 A 123 123 ARG HA H 121 3.551 4.151 -0.600 1
1 1264 . 8 1 1 A 123 123 ARG C C 121 179.642 179.814 -0.172 1
1 1265 . 8 1 1 A 123 123 ARG CA C 121 59.242 59.189 0.053 1
1 1266 . 8 1 1 A 123 123 ARG CB C 121 29.087 30.018 -0.931 1
1 1269 . 8 1 1 A 123 123 ARG N N 121 116.248 119.657 -3.409 1
1 1270 . 8 1 1 A 124 124 GLY H H 122 8.086 8.745 -0.659 1
1 1271 . 8 1 1 A 124 124 GLY C C 122 172.357 176.008 -3.651 1
1 1272 . 8 1 1 A 124 124 GLY CA C 122 44.836 46.961 -2.125 1
1 1273 . 8 1 1 A 124 124 GLY N N 122 104.381 108.400 -4.019 1
1 1274 . 8 1 1 A 125 125 ALA H H 123 6.411 7.814 -1.403 1
1 1275 . 8 1 1 A 125 125 ALA HA H 123 2.441 3.762 -1.321 1
1 1279 . 8 1 1 A 125 125 ALA C C 123 176.908 177.611 -0.703 1
1 1280 . 8 1 1 A 125 125 ALA CA C 123 51.593 54.604 -3.011 1
1 1281 . 8 1 1 A 125 125 ALA CB C 123 16.997 17.826 -0.829 1
1 1282 . 8 1 1 A 125 125 ALA N N 123 123.136 124.455 -1.319 1
1 1283 . 8 1 1 A 126 126 ALA H H 124 6.190 7.275 -1.085 1
1 1284 . 8 1 1 A 126 126 ALA HA H 124 3.829 4.360 -0.531 1
1 1288 . 8 1 1 A 126 126 ALA C C 124 177.535 177.064 0.471 1
1 1289 . 8 1 1 A 126 126 ALA CA C 124 52.403 52.994 -0.591 1
1 1290 . 8 1 1 A 126 126 ALA CB C 124 18.375 17.566 0.809 1
1 1291 . 8 1 1 A 126 126 ALA N N 124 117.999 118.288 -0.289 1
1 1292 . 8 1 1 A 127 127 ASP H H 125 8.877 8.366 0.511 1
1 1293 . 8 1 1 A 127 127 ASP HA H 125 4.665 4.385 0.280 1
1 1296 . 8 1 1 A 127 127 ASP C C 125 177.795 177.192 0.603 1
1 1297 . 8 1 1 A 127 127 ASP CA C 125 52.855 55.050 -2.195 1
1 1298 . 8 1 1 A 127 127 ASP CB C 125 41.814 41.147 0.667 1
1 1299 . 8 1 1 A 127 127 ASP N N 125 121.828 116.114 5.714 1
1 1300 . 8 1 1 A 128 128 GLY H H 126 7.954 9.005 -1.051 1
1 1301 . 8 1 1 A 128 128 GLY HA2 H 126 3.830 4.158 -0.328 1
1 1302 . 8 1 1 A 128 128 GLY HA3 H 126 4.249 4.218 0.031 1
1 1303 . 8 1 1 A 128 128 GLY C C 126 173.822 174.353 -0.531 1
1 1304 . 8 1 1 A 128 128 GLY CA C 126 45.549 45.052 0.497 1
1 1305 . 8 1 1 A 128 128 GLY N N 126 108.814 108.369 0.445 1
1 1306 . 8 1 1 A 129 129 SER H H 127 8.547 8.986 -0.439 1
1 1307 . 8 1 1 A 129 129 SER HA H 127 4.486 4.460 0.026 1
1 1309 . 8 1 1 A 129 129 SER C C 127 174.178 173.970 0.208 1
1 1310 . 8 1 1 A 129 129 SER CA C 127 58.653 59.965 -1.312 1
1 1311 . 8 1 1 A 129 129 SER CB C 127 63.316 63.146 0.170 1
1 1312 . 8 1 1 A 129 129 SER N N 127 115.599 115.038 0.561 1
1 1313 . 8 1 1 A 130 130 ARG H H 128 8.795 10.350 -1.555 1
1 1314 . 8 1 1 A 130 130 ARG HA H 128 4.160 4.550 -0.390 1
1 1318 . 8 1 1 A 130 130 ARG C C 128 175.518 174.961 0.557 1
1 1319 . 8 1 1 A 130 130 ARG CA C 128 58.479 55.627 2.852 1
1 1320 . 8 1 1 A 130 130 ARG CB C 128 29.952 32.379 -2.427 1
1 1323 . 8 1 1 A 130 130 ARG N N 128 127.611 118.921 8.690 1
1 1324 . 8 1 1 A 131 131 PHE H H 129 9.315 7.746 1.569 1
1 1325 . 8 1 1 A 131 131 PHE HA H 129 4.878 5.360 -0.482 1
1 1331 . 8 1 1 A 131 131 PHE C C 129 175.058 173.257 1.801 1
1 1332 . 8 1 1 A 131 131 PHE CA C 129 55.953 57.939 -1.986 1
1 1333 . 8 1 1 A 131 131 PHE CB C 129 40.189 42.128 -1.939 1
1 1337 . 8 1 1 A 131 131 PHE N N 129 126.219 120.726 5.493 1
1 1338 . 8 1 1 A 132 132 GLN H H 130 8.160 8.159 0.001 1
1 1339 . 8 1 1 A 132 132 GLN HA H 130 5.013 5.208 -0.195 1
1 1343 . 8 1 1 A 132 132 GLN CA C 130 54.498 54.570 -0.072 1
1 1344 . 8 1 1 A 132 132 GLN CB C 130 32.106 33.619 -1.513 1
1 1346 . 8 1 1 A 132 132 GLN N N 130 125.589 126.254 -0.665 1
1 1347 . 8 1 1 A 133 133 VAL H H 131 8.689 9.113 -0.424 1
1 1348 . 8 1 1 A 133 133 VAL HA H 131 4.529 4.503 0.026 1
1 1356 . 8 1 1 A 133 133 VAL C C 131 174.441 175.610 -1.169 1
1 1357 . 8 1 1 A 133 133 VAL CA C 131 60.758 61.697 -0.939 1
1 1358 . 8 1 1 A 133 133 VAL CB C 131 32.417 31.867 0.550 1
1 1361 . 8 1 1 A 133 133 VAL N N 131 122.441 122.971 -0.530 1
1 1362 . 8 1 1 A 134 134 TRP H H 132 9.256 9.603 -0.347 1
1 1363 . 8 1 1 A 134 134 TRP HA H 132 5.213 5.097 0.116 1
1 1371 . 8 1 1 A 134 134 TRP C C 132 174.575 175.992 -1.417 1
1 1372 . 8 1 1 A 134 134 TRP CA C 132 53.859 56.548 -2.689 1
1 1373 . 8 1 1 A 134 134 TRP CB C 132 31.311 31.508 -0.197 1
1 1379 . 8 1 1 A 134 134 TRP N N 132 130.303 128.311 1.992 1
1 1381 . 8 1 1 A 135 135 ASP H H 133 8.237 8.883 -0.646 1
1 1382 . 8 1 1 A 135 135 ASP HA H 133 6.018 5.921 0.097 1
1 1385 . 8 1 1 A 135 135 ASP C C 133 177.020 175.287 1.733 1
1 1386 . 8 1 1 A 135 135 ASP CA C 133 53.321 53.085 0.236 1
1 1387 . 8 1 1 A 135 135 ASP CB C 133 41.514 43.350 -1.836 1
1 1388 . 8 1 1 A 135 135 ASP N N 133 125.516 122.169 3.347 1
1 1389 . 8 1 1 A 136 136 TYR H H 134 9.058 8.440 0.618 1
1 1390 . 8 1 1 A 136 136 TYR HA H 134 4.970 5.279 -0.309 1
1 1394 . 8 1 1 A 136 136 TYR C C 134 172.324 173.125 -0.801 1
1 1395 . 8 1 1 A 136 136 TYR CA C 134 55.982 56.506 -0.524 1
1 1396 . 8 1 1 A 136 136 TYR CB C 134 42.265 40.263 2.002 1
1 1399 . 8 1 1 A 136 136 TYR N N 134 120.315 118.082 2.233 1
1 1400 . 8 1 1 A 137 137 ALA H H 135 8.521 8.611 -0.090 1
1 1401 . 8 1 1 A 137 137 ALA HA H 135 4.280 4.447 -0.167 1
1 1405 . 8 1 1 A 137 137 ALA C C 135 178.561 177.849 0.712 1
1 1406 . 8 1 1 A 137 137 ALA CA C 135 49.550 50.571 -1.021 1
1 1407 . 8 1 1 A 137 137 ALA CB C 135 19.998 22.566 -2.568 1
1 1408 . 8 1 1 A 137 137 ALA N N 135 123.386 121.971 1.415 1
1 1409 . 8 1 1 A 138 138 GLU H H 136 8.678 8.919 -0.241 1
1 1410 . 8 1 1 A 138 138 GLU HA H 136 3.777 4.140 -0.363 1
1 1414 . 8 1 1 A 138 138 GLU C C 136 177.624 177.692 -0.068 1
1 1415 . 8 1 1 A 138 138 GLU CA C 136 60.527 59.047 1.480 1
1 1416 . 8 1 1 A 138 138 GLU CB C 136 29.020 29.295 -0.275 1
1 1418 . 8 1 1 A 138 138 GLU N N 136 121.774 121.587 0.187 1
1 1419 . 8 1 1 A 139 139 GLY H H 137 8.666 8.357 0.309 1
1 1420 . 8 1 1 A 139 139 GLY HA2 H 137 3.872 3.969 -0.097 1
1 1421 . 8 1 1 A 139 139 GLY HA3 H 137 3.872 3.977 -0.105 1
1 1422 . 8 1 1 A 139 139 GLY C C 137 175.122 174.405 0.717 1
1 1423 . 8 1 1 A 139 139 GLY CA C 137 46.093 45.617 0.476 1
1 1424 . 8 1 1 A 139 139 GLY N N 137 106.053 108.189 -2.136 1
1 1425 . 8 1 1 A 140 140 GLU H H 138 8.305 9.795 -1.490 1
1 1426 . 8 1 1 A 140 140 GLU HA H 138 4.754 4.657 0.097 1
1 1430 . 8 1 1 A 140 140 GLU C C 138 177.819 176.996 0.823 1
1 1431 . 8 1 1 A 140 140 GLU CA C 138 55.049 56.181 -1.132 1
1 1432 . 8 1 1 A 140 140 GLU CB C 138 30.504 31.190 -0.686 1
1 1434 . 8 1 1 A 140 140 GLU N N 138 117.485 117.791 -0.306 1
1 1435 . 8 1 1 A 141 141 VAL H H 139 7.267 7.572 -0.305 1
1 1436 . 8 1 1 A 141 141 VAL HA H 139 3.422 3.757 -0.335 1
1 1444 . 8 1 1 A 141 141 VAL C C 139 175.454 177.419 -1.965 1
1 1445 . 8 1 1 A 141 141 VAL CA C 139 66.769 64.912 1.857 1
1 1446 . 8 1 1 A 141 141 VAL CB C 139 31.377 31.357 0.020 1
1 1449 . 8 1 1 A 141 141 VAL N N 139 120.764 121.272 -0.508 1
1 1450 . 8 1 1 A 142 142 GLU H H 140 8.620 8.383 0.237 1
1 1451 . 8 1 1 A 142 142 GLU HA H 140 3.592 3.986 -0.394 1
1 1452 . 8 1 1 A 142 142 GLU C C 140 177.320 179.720 -2.400 1
1 1453 . 8 1 1 A 142 142 GLU CA C 140 62.607 59.369 3.238 1
1 1454 . 8 1 1 A 142 142 GLU CB C 140 26.759 29.078 -2.319 1
1 1455 . 8 1 1 A 142 142 GLU N N 140 120.048 121.640 -1.592 1
1 1456 . 8 1 1 A 143 143 THR H H 141 7.449 8.061 -0.612 1
1 1457 . 8 1 1 A 143 143 THR HA H 141 4.003 4.006 -0.003 1
1 1462 . 8 1 1 A 143 143 THR C C 141 177.258 176.819 0.439 1
1 1463 . 8 1 1 A 143 143 THR CA C 141 65.490 67.096 -1.606 1
1 1464 . 8 1 1 A 143 143 THR CB C 141 68.641 68.350 0.291 1
1 1466 . 8 1 1 A 143 143 THR N N 141 114.073 118.406 -4.333 1
1 1467 . 8 1 1 A 144 144 MET H H 142 7.992 8.151 -0.159 1
1 1468 . 8 1 1 A 144 144 MET HA H 142 4.316 4.325 -0.009 1
1 1476 . 8 1 1 A 144 144 MET C C 142 178.233 178.754 -0.521 1
1 1477 . 8 1 1 A 144 144 MET CA C 142 57.743 58.973 -1.230 1
1 1478 . 8 1 1 A 144 144 MET CB C 142 31.326 32.597 -1.271 1
1 1481 . 8 1 1 A 144 144 MET N N 142 120.595 118.504 2.091 1
1 1482 . 8 1 1 A 145 145 LEU H H 143 7.847 8.202 -0.355 1
1 1483 . 8 1 1 A 145 145 LEU HA H 143 3.919 3.870 0.049 1
1 1491 . 8 1 1 A 145 145 LEU C C 143 178.774 179.432 -0.658 1
1 1492 . 8 1 1 A 145 145 LEU CA C 143 57.877 58.158 -0.281 1
1 1493 . 8 1 1 A 145 145 LEU CB C 143 40.951 40.798 0.153 1
1 1497 . 8 1 1 A 145 145 LEU N N 143 119.410 119.732 -0.322 1
1 1498 . 8 1 1 A 146 146 ASP H H 144 8.431 8.582 -0.151 1
1 1499 . 8 1 1 A 146 146 ASP HA H 144 4.312 4.545 -0.233 1
1 1502 . 8 1 1 A 146 146 ASP C C 144 178.129 178.847 -0.718 1
1 1503 . 8 1 1 A 146 146 ASP CA C 144 57.464 58.158 -0.694 1
1 1504 . 8 1 1 A 146 146 ASP CB C 144 39.548 41.348 -1.800 1
1 1505 . 8 1 1 A 146 146 ASP N N 144 119.837 119.949 -0.112 1
1 1506 . 8 1 1 A 147 147 ARG H H 145 7.949 8.550 -0.601 1
1 1507 . 8 1 1 A 147 147 ARG HA H 145 4.050 4.162 -0.112 1
1 1512 . 8 1 1 A 147 147 ARG C C 145 179.547 178.821 0.726 1
1 1513 . 8 1 1 A 147 147 ARG CA C 145 58.972 59.511 -0.539 1
1 1514 . 8 1 1 A 147 147 ARG CB C 145 29.798 30.531 -0.733 1
1 1517 . 8 1 1 A 147 147 ARG N N 145 119.173 119.094 0.079 1
1 1518 . 8 1 1 A 148 148 TYR H H 146 8.128 8.342 -0.214 1
1 1519 . 8 1 1 A 148 148 TYR HA H 146 3.995 4.428 -0.433 1
1 1524 . 8 1 1 A 148 148 TYR C C 146 178.199 177.551 0.648 1
1 1525 . 8 1 1 A 148 148 TYR CA C 146 62.347 61.566 0.781 1
1 1526 . 8 1 1 A 148 148 TYR CB C 146 37.418 38.055 -0.637 1
1 1529 . 8 1 1 A 148 148 TYR N N 146 120.102 121.454 -1.352 1
1 1530 . 8 1 1 A 149 149 PHE H H 147 8.308 8.669 -0.361 1
1 1531 . 8 1 1 A 149 149 PHE HA H 147 4.013 4.568 -0.555 1
1 1535 . 8 1 1 A 149 149 PHE C C 147 177.574 178.572 -0.998 1
1 1536 . 8 1 1 A 149 149 PHE CA C 147 63.044 61.815 1.229 1
1 1537 . 8 1 1 A 149 149 PHE CB C 147 37.153 38.240 -1.087 1
1 1541 . 8 1 1 A 149 149 PHE N N 147 116.680 118.247 -1.567 1
1 1542 . 8 1 1 A 150 150 GLU H H 148 8.271 8.899 -0.628 1
1 1543 . 8 1 1 A 150 150 GLU HA H 148 4.030 4.103 -0.073 1
1 1547 . 8 1 1 A 150 150 GLU C C 148 177.687 178.112 -0.425 1
1 1548 . 8 1 1 A 150 150 GLU CA C 148 58.746 59.811 -1.065 1
1 1549 . 8 1 1 A 150 150 GLU CB C 148 28.847 29.293 -0.446 1
1 1551 . 8 1 1 A 150 150 GLU N N 148 119.973 119.905 0.068 1
1 1552 . 8 1 1 A 151 151 ALA H H 149 6.992 7.737 -0.745 1
1 1553 . 8 1 1 A 151 151 ALA HA H 149 4.217 4.284 -0.067 1
1 1557 . 8 1 1 A 151 151 ALA C C 149 178.190 176.847 1.343 1
1 1558 . 8 1 1 A 151 151 ALA CA C 149 52.779 52.816 -0.037 1
1 1559 . 8 1 1 A 151 151 ALA CB C 149 19.087 18.125 0.962 1
1 1560 . 8 1 1 A 151 151 ALA N N 149 118.629 121.663 -3.034 1
1 1561 . 8 1 1 A 152 152 TYR H H 150 7.722 8.438 -0.716 1
1 1562 . 8 1 1 A 152 152 TYR HA H 150 4.137 4.768 -0.631 1
1 1567 . 8 1 1 A 152 152 TYR C C 150 175.703 175.313 0.390 1
1 1568 . 8 1 1 A 152 152 TYR CA C 150 59.260 58.939 0.321 1
1 1569 . 8 1 1 A 152 152 TYR CB C 150 39.165 38.797 0.368 1
1 1572 . 8 1 1 A 152 152 TYR N N 150 118.767 118.420 0.347 1
1 1573 . 8 1 1 A 153 153 LEU H H 151 7.670 8.863 -1.193 1
1 1574 . 8 1 1 A 153 153 LEU HA H 151 4.145 4.410 -0.265 1
1 1584 . 8 1 1 A 153 153 LEU CA C 151 54.704 54.142 0.562 1
1 1585 . 8 1 1 A 153 153 LEU CB C 151 40.520 41.739 -1.219 1
1 1589 . 8 1 1 A 153 153 LEU N N 151 122.313 122.297 0.016 1
1 1590 . 8 1 1 A 154 154 PRO HA H 152 4.258 4.420 -0.162 1
1 1597 . 8 1 1 A 154 154 PRO C C 152 177.496 178.926 -1.430 1
1 1598 . 8 1 1 A 154 154 PRO CA C 152 63.899 65.832 -1.933 1
1 1599 . 8 1 1 A 154 154 PRO CB C 152 31.080 31.513 -0.433 1
1 1602 . 8 1 1 A 155 155 GLN H H 153 8.023 8.366 -0.343 1
1 1603 . 8 1 1 A 155 155 GLN HA H 153 4.176 4.255 -0.079 1
1 1607 . 8 1 1 A 155 155 GLN C C 153 176.636 177.906 -1.270 1
1 1608 . 8 1 1 A 155 155 GLN CA C 153 55.968 56.939 -0.971 1
1 1609 . 8 1 1 A 155 155 GLN CB C 153 28.723 29.044 -0.321 1
1 1610 . 8 1 1 A 155 155 GLN N N 153 119.173 117.491 1.682 1
1 1611 . 8 1 1 A 156 156 LYS H H 154 8.113 7.832 0.281 1
1 1612 . 8 1 1 A 156 156 LYS HA H 154 4.196 4.244 -0.048 1
1 1619 . 8 1 1 A 156 156 LYS C C 154 56.493 177.621 -121.128 1
1 1620 . 8 1 1 A 156 156 LYS CA C 154 56.493 58.848 -2.355 1
1 1621 . 8 1 1 A 156 156 LYS CB C 154 32.037 32.258 -0.221 1
1 1625 . 8 1 1 A 156 156 LYS N N 154 122.788 118.062 4.726 1
1 1626 . 8 1 1 A 157 157 THR H H 155 8.013 7.557 0.456 1
1 1627 . 8 1 1 A 157 157 THR HA H 155 4.183 4.262 -0.079 1
1 1632 . 8 1 1 A 157 157 THR C C 155 174.580 174.130 0.450 1
1 1633 . 8 1 1 A 157 157 THR CA C 155 61.958 62.981 -1.023 1
1 1634 . 8 1 1 A 157 157 THR CB C 155 69.665 69.585 0.080 1
1 1636 . 8 1 1 A 157 157 THR N N 155 115.504 115.338 0.166 1
1 1637 . 8 1 1 A 158 158 ALA H H 156 8.170 8.095 0.075 1
1 1638 . 8 1 1 A 158 158 ALA HA H 156 4.220 4.144 0.076 1
1 1642 . 8 1 1 A 158 158 ALA CA C 156 52.492 52.849 -0.357 1
1 1643 . 8 1 1 A 158 158 ALA CB C 156 18.810 18.929 -0.119 1
1 1644 . 8 1 1 A 158 158 ALA N N 156 126.825 127.548 -0.723 1
1 1645 . 8 1 1 A 159 159 SER H H 157 7.762 8.607 -0.845 1
1 1646 . 8 1 1 A 159 159 SER CA C 157 58.230 56.522 1.708 1
1 1647 . 8 1 1 A 159 159 SER CB C 157 63.440 64.938 -1.498 1
1 1648 . 8 1 1 A 159 159 SER N N 157 123.078 119.620 3.458 1
1 1649 . 8 1 1 A 162 162 HIS HA H 160 4.845 5.018 -0.173 1
1 1652 . 8 1 1 A 162 162 HIS CA C 160 53.590 53.339 0.251 1
1 1653 . 8 1 1 A 162 162 HIS CB C 160 29.398 30.870 -1.472 1
1 1654 . 8 1 1 A 163 163 PRO HA H 161 4.388 4.359 0.029 1
1 1660 . 8 1 1 A 163 163 PRO C C 161 177.018 176.322 0.696 1
1 1661 . 8 1 1 A 163 163 PRO CA C 161 63.118 64.823 -1.705 1
1 1662 . 8 1 1 A 163 163 PRO CB C 161 31.668 31.914 -0.246 1
1 1665 . 8 1 1 A 164 164 SER H H 162 8.418 7.399 1.019 1
1 1666 . 8 1 1 A 164 164 SER HA H 162 4.338 4.536 -0.198 1
1 1668 . 8 1 1 A 164 164 SER C C 162 173.327 173.887 -0.560 1
1 1669 . 8 1 1 A 164 164 SER CA C 162 58.202 56.509 1.693 1
1 1670 . 8 1 1 A 164 164 SER CB C 162 64.080 64.753 -0.673 1
1 1671 . 8 1 1 A 164 164 SER N N 162 117.485 112.774 4.711 1
1 6 . 9 1 1 A 4 4 ALA H H 2 8.270 7.507 0.763 1
1 7 . 9 1 1 A 4 4 ALA HA H 2 4.212 4.592 -0.380 1
1 11 . 9 1 1 A 4 4 ALA C C 2 177.441 175.763 1.678 1
1 12 . 9 1 1 A 4 4 ALA CA C 2 52.280 50.792 1.488 1
1 13 . 9 1 1 A 4 4 ALA CB C 2 18.880 22.835 -3.955 1
1 14 . 9 1 1 A 4 4 ALA N N 2 126.500 119.792 6.708 1
1 15 . 9 1 1 A 5 5 ALA H H 3 8.251 8.499 -0.248 1
1 16 . 9 1 1 A 5 5 ALA HA H 3 4.261 3.874 0.387 1
1 20 . 9 1 1 A 5 5 ALA C C 3 177.824 176.513 1.311 1
1 21 . 9 1 1 A 5 5 ALA CA C 3 52.347 53.454 -1.107 1
1 22 . 9 1 1 A 5 5 ALA CB C 3 18.869 18.037 0.832 1
1 23 . 9 1 1 A 5 5 ALA N N 3 124.322 119.686 4.636 1
1 24 . 9 1 1 A 6 6 SER H H 4 8.158 7.653 0.505 1
1 25 . 9 1 1 A 6 6 SER HA H 4 4.358 4.225 0.133 1
1 27 . 9 1 1 A 6 6 SER C C 4 175.222 175.781 -0.559 1
1 28 . 9 1 1 A 6 6 SER CA C 4 58.438 60.024 -1.586 1
1 29 . 9 1 1 A 6 6 SER CB C 4 63.859 63.583 0.276 1
1 30 . 9 1 1 A 6 6 SER N N 4 115.338 114.007 1.331 1
1 31 . 9 1 1 A 7 7 GLY H H 5 8.265 8.794 -0.529 1
1 32 . 9 1 1 A 7 7 GLY HA2 H 5 3.900 3.847 0.053 1
1 33 . 9 1 1 A 7 7 GLY C C 5 174.083 174.924 -0.841 1
1 34 . 9 1 1 A 7 7 GLY CA C 5 45.113 46.644 -1.531 1
1 35 . 9 1 1 A 7 7 GLY N N 5 111.360 112.765 -1.405 1
1 36 . 9 1 1 A 8 8 GLU H H 6 8.100 7.917 0.183 1
1 37 . 9 1 1 A 8 8 GLU HA H 6 4.209 4.296 -0.087 1
1 41 . 9 1 1 A 8 8 GLU C C 6 176.354 176.278 0.076 1
1 42 . 9 1 1 A 8 8 GLU CA C 6 56.261 56.705 -0.444 1
1 43 . 9 1 1 A 8 8 GLU CB C 6 29.830 30.001 -0.171 1
1 45 . 9 1 1 A 8 8 GLU N N 6 121.056 118.997 2.059 1
1 46 . 9 1 1 A 9 9 GLN H H 7 8.287 8.506 -0.219 1
1 47 . 9 1 1 A 9 9 GLN HA H 7 4.247 4.401 -0.154 1
1 51 . 9 1 1 A 9 9 GLN C C 7 172.457 175.579 -3.122 1
1 52 . 9 1 1 A 9 9 GLN CA C 7 55.269 55.831 -0.562 1
1 53 . 9 1 1 A 9 9 GLN CB C 7 29.236 29.835 -0.599 1
1 55 . 9 1 1 A 9 9 GLN N N 7 122.164 122.314 -0.150 1
1 56 . 9 1 1 A 10 10 ALA H H 8 8.368 8.203 0.165 1
1 57 . 9 1 1 A 10 10 ALA HA H 8 4.509 4.349 0.160 1
1 61 . 9 1 1 A 10 10 ALA CA C 8 50.341 51.102 -0.761 1
1 62 . 9 1 1 A 10 10 ALA CB C 8 18.140 18.014 0.126 1
1 63 . 9 1 1 A 10 10 ALA N N 8 128.028 123.758 4.270 1
1 64 . 9 1 1 A 11 11 PRO HA H 9 4.437 4.505 -0.068 1
1 70 . 9 1 1 A 11 11 PRO C C 9 176.381 176.261 0.120 1
1 71 . 9 1 1 A 11 11 PRO CA C 9 63.298 62.345 0.953 1
1 72 . 9 1 1 A 11 11 PRO CB C 9 31.776 33.210 -1.434 1
1 75 . 9 1 1 A 12 12 CYS H H 10 8.056 8.355 -0.299 1
1 76 . 9 1 1 A 12 12 CYS HA H 10 4.717 5.085 -0.368 1
1 79 . 9 1 1 A 12 12 CYS C C 10 173.266 173.267 -0.001 1
1 80 . 9 1 1 A 12 12 CYS CA C 10 57.398 57.136 0.262 1
1 81 . 9 1 1 A 12 12 CYS CB C 10 29.165 31.035 -1.870 1
1 82 . 9 1 1 A 12 12 CYS N N 10 118.295 117.242 1.053 1
1 83 . 9 1 1 A 13 13 SER H H 11 9.815 8.612 1.203 1
1 84 . 9 1 1 A 13 13 SER HA H 11 5.227 5.796 -0.569 1
1 87 . 9 1 1 A 13 13 SER C C 11 173.648 173.092 0.556 1
1 88 . 9 1 1 A 13 13 SER CA C 11 57.630 57.054 0.576 1
1 89 . 9 1 1 A 13 13 SER CB C 11 64.820 66.425 -1.605 1
1 90 . 9 1 1 A 13 13 SER N N 11 122.365 117.671 4.694 1
1 91 . 9 1 1 A 14 14 VAL H H 12 9.352 8.841 0.511 1
1 92 . 9 1 1 A 14 14 VAL HA H 12 4.696 5.149 -0.453 1
1 100 . 9 1 1 A 14 14 VAL C C 12 173.875 173.847 0.028 1
1 101 . 9 1 1 A 14 14 VAL CA C 12 60.146 60.997 -0.851 1
1 102 . 9 1 1 A 14 14 VAL CB C 12 34.499 35.760 -1.261 1
1 105 . 9 1 1 A 14 14 VAL N N 12 126.378 122.696 3.682 1
1 106 . 9 1 1 A 15 15 TYR H H 13 8.745 8.887 -0.142 1
1 111 . 9 1 1 A 15 15 TYR C C 13 173.345 174.269 -0.924 1
1 112 . 9 1 1 A 15 15 TYR CA C 13 56.186 55.198 0.988 1
1 113 . 9 1 1 A 15 15 TYR CB C 13 40.858 40.082 0.776 1
1 116 . 9 1 1 A 15 15 TYR N N 13 129.472 128.474 0.998 1
1 117 . 9 1 1 A 16 16 PHE H H 14 7.370 8.764 -1.394 1
1 118 . 9 1 1 A 16 16 PHE HA H 14 5.720 5.261 0.459 1
1 123 . 9 1 1 A 16 16 PHE C C 14 174.058 174.602 -0.544 1
1 124 . 9 1 1 A 16 16 PHE CA C 14 54.361 57.063 -2.702 1
1 125 . 9 1 1 A 16 16 PHE CB C 14 40.461 39.447 1.014 1
1 129 . 9 1 1 A 16 16 PHE N N 14 128.263 125.794 2.469 1
1 130 . 9 1 1 A 17 17 CYS H H 15 8.147 9.392 -1.245 1
1 131 . 9 1 1 A 17 17 CYS CA C 15 56.570 58.036 -1.466 1
1 132 . 9 1 1 A 17 17 CYS CB C 15 29.690 28.270 1.420 1
1 133 . 9 1 1 A 17 17 CYS N N 15 126.188 124.941 1.247 1
1 134 . 9 1 1 A 18 18 GLY HA2 H 16 3.819 3.126 0.693 1
1 135 . 9 1 1 A 18 18 GLY C C 16 173.374 172.328 1.046 1
1 136 . 9 1 1 A 18 18 GLY CA C 16 45.510 44.221 1.289 1
1 137 . 9 1 1 A 19 19 SER H H 17 8.533 8.518 0.015 1
1 138 . 9 1 1 A 19 19 SER HA H 17 4.505 5.001 -0.496 1
1 139 . 9 1 1 A 19 19 SER CA C 17 58.700 57.869 0.831 1
1 140 . 9 1 1 A 19 19 SER CB C 17 63.810 65.589 -1.779 1
1 141 . 9 1 1 A 19 19 SER N N 17 117.300 115.740 1.560 1
1 142 . 9 1 1 A 20 20 ILE HA H 18 4.309 3.917 0.392 1
1 152 . 9 1 1 A 20 20 ILE CA C 18 61.317 65.054 -3.737 1
1 153 . 9 1 1 A 20 20 ILE CB C 18 38.302 37.733 0.569 1
1 157 . 9 1 1 A 21 21 ARG HA H 19 4.172 4.174 -0.002 1
1 160 . 9 1 1 A 21 21 ARG C C 19 177.118 176.932 0.186 1
1 161 . 9 1 1 A 21 21 ARG CA C 19 56.960 58.382 -1.422 1
1 162 . 9 1 1 A 21 21 ARG CB C 19 29.568 30.270 -0.702 1
1 165 . 9 1 1 A 22 22 GLY H H 20 8.685 8.389 0.296 1
1 166 . 9 1 1 A 22 22 GLY HA2 H 20 3.801 4.036 -0.235 1
1 167 . 9 1 1 A 22 22 GLY HA3 H 20 3.923 4.046 -0.123 1
1 168 . 9 1 1 A 22 22 GLY C C 20 174.814 175.042 -0.228 1
1 169 . 9 1 1 A 22 22 GLY CA C 20 45.289 45.505 -0.216 1
1 170 . 9 1 1 A 22 22 GLY N N 20 110.145 111.993 -1.848 1
1 171 . 9 1 1 A 23 23 GLY H H 21 8.058 7.366 0.692 1
1 172 . 9 1 1 A 23 23 GLY HA2 H 21 3.998 4.033 -0.035 1
1 173 . 9 1 1 A 23 23 GLY HA3 H 21 4.237 4.040 0.197 1
1 174 . 9 1 1 A 23 23 GLY C C 21 174.762 174.895 -0.133 1
1 175 . 9 1 1 A 23 23 GLY CA C 21 45.025 45.135 -0.110 1
1 176 . 9 1 1 A 23 23 GLY N N 21 109.327 107.348 1.979 1
1 177 . 9 1 1 A 24 24 ARG H H 22 8.376 8.110 0.266 1
1 178 . 9 1 1 A 24 24 ARG HA H 22 4.086 4.043 0.043 1
1 184 . 9 1 1 A 24 24 ARG C C 22 178.178 176.991 1.187 1
1 185 . 9 1 1 A 24 24 ARG CA C 22 57.471 57.966 -0.495 1
1 186 . 9 1 1 A 24 24 ARG CB C 22 29.653 30.232 -0.579 1
1 189 . 9 1 1 A 24 24 ARG N N 22 120.861 118.469 2.392 1
1 190 . 9 1 1 A 25 25 GLU H H 23 8.831 9.417 -0.586 1
1 191 . 9 1 1 A 25 25 GLU HA H 23 4.015 3.972 0.043 1
1 195 . 9 1 1 A 25 25 GLU C C 23 178.005 178.856 -0.851 1
1 196 . 9 1 1 A 25 25 GLU CA C 23 58.920 59.458 -0.538 1
1 197 . 9 1 1 A 25 25 GLU CB C 23 28.592 29.140 -0.548 1
1 199 . 9 1 1 A 25 25 GLU N N 23 121.243 118.735 2.508 1
1 200 . 9 1 1 A 26 26 ASP H H 24 7.897 8.493 -0.596 1
1 201 . 9 1 1 A 26 26 ASP HA H 24 4.516 3.984 0.532 1
1 203 . 9 1 1 A 26 26 ASP C C 24 176.455 178.006 -1.551 1
1 204 . 9 1 1 A 26 26 ASP CA C 24 55.122 56.635 -1.513 1
1 205 . 9 1 1 A 26 26 ASP CB C 24 39.888 39.323 0.565 1
1 206 . 9 1 1 A 26 26 ASP N N 24 119.541 118.676 0.865 1
1 207 . 9 1 1 A 27 27 GLN H H 25 7.696 8.337 -0.641 1
1 208 . 9 1 1 A 27 27 GLN HA H 25 3.704 4.079 -0.375 1
1 212 . 9 1 1 A 27 27 GLN C C 25 177.016 177.985 -0.969 1
1 213 . 9 1 1 A 27 27 GLN CA C 25 59.501 58.707 0.794 1
1 214 . 9 1 1 A 27 27 GLN CB C 25 27.762 28.832 -1.070 1
1 216 . 9 1 1 A 27 27 GLN N N 25 119.471 119.617 -0.146 1
1 217 . 9 1 1 A 28 28 ALA H H 26 8.227 7.484 0.743 1
1 218 . 9 1 1 A 28 28 ALA HA H 26 4.072 4.113 -0.041 1
1 222 . 9 1 1 A 28 28 ALA C C 26 180.567 179.823 0.744 1
1 223 . 9 1 1 A 28 28 ALA CA C 26 54.627 55.029 -0.402 1
1 224 . 9 1 1 A 28 28 ALA CB C 26 17.355 18.502 -1.147 1
1 225 . 9 1 1 A 28 28 ALA N N 26 122.362 122.010 0.352 1
1 226 . 9 1 1 A 29 29 LEU H H 27 7.533 7.814 -0.281 1
1 227 . 9 1 1 A 29 29 LEU HA H 27 4.050 4.002 0.048 1
1 237 . 9 1 1 A 29 29 LEU C C 27 178.752 178.175 0.577 1
1 238 . 9 1 1 A 29 29 LEU CA C 27 57.578 57.551 0.027 1
1 239 . 9 1 1 A 29 29 LEU CB C 27 40.734 41.452 -0.718 1
1 243 . 9 1 1 A 29 29 LEU N N 27 122.255 119.778 2.477 1
1 244 . 9 1 1 A 30 30 TYR H H 28 8.473 8.103 0.370 1
1 245 . 9 1 1 A 30 30 TYR HA H 28 4.049 3.929 0.120 1
1 250 . 9 1 1 A 30 30 TYR C C 28 177.736 178.517 -0.781 1
1 251 . 9 1 1 A 30 30 TYR CA C 28 59.817 60.127 -0.310 1
1 252 . 9 1 1 A 30 30 TYR CB C 28 36.140 37.674 -1.534 1
1 255 . 9 1 1 A 30 30 TYR N N 28 120.403 118.675 1.728 1
1 256 . 9 1 1 A 31 31 ALA H H 29 8.008 8.193 -0.185 1
1 257 . 9 1 1 A 31 31 ALA HA H 29 4.005 4.016 -0.011 1
1 261 . 9 1 1 A 31 31 ALA C C 29 180.879 179.666 1.213 1
1 262 . 9 1 1 A 31 31 ALA CA C 29 54.914 55.311 -0.397 1
1 263 . 9 1 1 A 31 31 ALA CB C 29 17.375 18.284 -0.909 1
1 264 . 9 1 1 A 31 31 ALA N N 29 120.771 122.656 -1.885 1
1 265 . 9 1 1 A 32 32 ARG H H 30 7.596 7.599 -0.003 1
1 266 . 9 1 1 A 32 32 ARG HA H 30 3.916 4.028 -0.112 1
1 273 . 9 1 1 A 32 32 ARG C C 30 179.919 178.546 1.373 1
1 274 . 9 1 1 A 32 32 ARG CA C 30 59.014 59.119 -0.105 1
1 275 . 9 1 1 A 32 32 ARG CB C 30 30.531 29.706 0.825 1
1 278 . 9 1 1 A 32 32 ARG N N 30 120.365 118.057 2.308 1
1 279 . 9 1 1 A 33 33 ILE H H 31 8.066 8.385 -0.319 1
1 280 . 9 1 1 A 33 33 ILE HA H 31 3.120 3.618 -0.498 1
1 290 . 9 1 1 A 33 33 ILE C C 31 177.051 178.281 -1.230 1
1 291 . 9 1 1 A 33 33 ILE CA C 31 65.757 65.229 0.528 1
1 292 . 9 1 1 A 33 33 ILE CB C 31 36.928 37.718 -0.790 1
1 296 . 9 1 1 A 33 33 ILE N N 31 121.608 119.545 2.063 1
1 297 . 9 1 1 A 34 34 VAL H H 32 8.148 8.848 -0.700 1
1 298 . 9 1 1 A 34 34 VAL HA H 32 2.954 3.441 -0.487 1
1 306 . 9 1 1 A 34 34 VAL C C 32 177.159 177.943 -0.784 1
1 307 . 9 1 1 A 34 34 VAL CA C 32 67.220 66.349 0.871 1
1 308 . 9 1 1 A 34 34 VAL CB C 32 31.039 31.107 -0.068 1
1 311 . 9 1 1 A 34 34 VAL N N 32 119.318 120.202 -0.884 1
1 312 . 9 1 1 A 35 35 SER H H 33 7.826 8.464 -0.638 1
1 313 . 9 1 1 A 35 35 SER HA H 33 3.868 4.115 -0.247 1
1 316 . 9 1 1 A 35 35 SER C C 33 176.779 177.206 -0.427 1
1 317 . 9 1 1 A 35 35 SER CA C 33 62.000 61.589 0.411 1
1 318 . 9 1 1 A 35 35 SER CB C 33 62.789 62.435 0.354 1
1 319 . 9 1 1 A 35 35 SER N N 33 111.936 114.763 -2.827 1
1 320 . 9 1 1 A 36 36 ARG H H 34 7.405 7.576 -0.171 1
1 321 . 9 1 1 A 36 36 ARG HA H 34 4.070 4.142 -0.072 1
1 323 . 9 1 1 A 36 36 ARG C C 34 178.047 178.509 -0.462 1
1 324 . 9 1 1 A 36 36 ARG CA C 34 56.108 59.108 -3.000 1
1 325 . 9 1 1 A 36 36 ARG CB C 34 28.837 30.317 -1.480 1
1 326 . 9 1 1 A 36 36 ARG N N 34 120.909 122.230 -1.321 1
1 327 . 9 1 1 A 37 37 LEU H H 35 8.301 8.437 -0.136 1
1 328 . 9 1 1 A 37 37 LEU HA H 35 3.620 3.710 -0.090 1
1 336 . 9 1 1 A 37 37 LEU C C 35 178.446 179.050 -0.604 1
1 337 . 9 1 1 A 37 37 LEU CA C 35 57.640 57.908 -0.268 1
1 338 . 9 1 1 A 37 37 LEU CB C 35 41.584 41.729 -0.145 1
1 342 . 9 1 1 A 37 37 LEU N N 35 118.567 120.111 -1.544 1
1 343 . 9 1 1 A 38 38 ARG H H 36 7.379 8.220 -0.841 1
1 344 . 9 1 1 A 38 38 ARG HA H 36 4.340 4.013 0.327 1
1 350 . 9 1 1 A 38 38 ARG C C 36 177.895 178.793 -0.898 1
1 351 . 9 1 1 A 38 38 ARG CA C 36 57.785 59.132 -1.347 1
1 352 . 9 1 1 A 38 38 ARG CB C 36 29.775 29.694 0.081 1
1 355 . 9 1 1 A 38 38 ARG N N 36 115.352 119.795 -4.443 1
1 356 . 9 1 1 A 39 39 ARG H H 37 7.240 7.867 -0.627 1
1 357 . 9 1 1 A 39 39 ARG HA H 37 3.743 4.114 -0.371 1
1 363 . 9 1 1 A 39 39 ARG C C 37 176.988 178.996 -2.008 1
1 364 . 9 1 1 A 39 39 ARG CA C 37 57.605 58.757 -1.152 1
1 365 . 9 1 1 A 39 39 ARG CB C 37 28.925 30.479 -1.554 1
1 368 . 9 1 1 A 39 39 ARG N N 37 117.410 118.934 -1.524 1
1 369 . 9 1 1 A 40 40 TYR H H 38 7.296 8.335 -1.039 1
1 370 . 9 1 1 A 40 40 TYR HA H 38 4.319 4.139 0.180 1
1 375 . 9 1 1 A 40 40 TYR C C 38 175.001 176.275 -1.274 1
1 376 . 9 1 1 A 40 40 TYR CA C 38 57.730 60.208 -2.478 1
1 377 . 9 1 1 A 40 40 TYR CB C 38 39.343 37.647 1.696 1
1 380 . 9 1 1 A 40 40 TYR N N 38 116.937 118.887 -1.950 1
1 381 . 9 1 1 A 41 41 GLY H H 39 7.325 7.527 -0.202 1
1 382 . 9 1 1 A 41 41 GLY HA2 H 39 3.953 4.088 -0.135 1
1 383 . 9 1 1 A 41 41 GLY C C 39 171.302 172.197 -0.895 1
1 384 . 9 1 1 A 41 41 GLY CA C 39 45.590 45.529 0.061 1
1 385 . 9 1 1 A 41 41 GLY N N 39 105.596 104.357 1.239 1
1 386 . 9 1 1 A 42 42 LYS H H 40 8.186 8.988 -0.802 1
1 387 . 9 1 1 A 42 42 LYS HA H 40 4.205 4.565 -0.360 1
1 393 . 9 1 1 A 42 42 LYS C C 40 175.672 175.703 -0.031 1
1 394 . 9 1 1 A 42 42 LYS CA C 40 55.241 55.450 -0.209 1
1 395 . 9 1 1 A 42 42 LYS CB C 40 32.889 33.163 -0.274 1
1 399 . 9 1 1 A 42 42 LYS N N 40 120.341 122.131 -1.790 1
1 400 . 9 1 1 A 43 43 VAL H H 41 8.610 8.539 0.071 1
1 401 . 9 1 1 A 43 43 VAL HA H 41 4.416 4.385 0.031 1
1 409 . 9 1 1 A 43 43 VAL C C 41 175.997 176.013 -0.016 1
1 410 . 9 1 1 A 43 43 VAL CA C 41 61.331 62.904 -1.573 1
1 411 . 9 1 1 A 43 43 VAL CB C 41 30.573 31.489 -0.916 1
1 414 . 9 1 1 A 43 43 VAL N N 41 127.312 125.480 1.832 1
1 415 . 9 1 1 A 44 44 LEU H H 42 8.894 8.470 0.424 1
1 416 . 9 1 1 A 44 44 LEU HA H 42 4.496 4.251 0.245 1
1 424 . 9 1 1 A 44 44 LEU CA C 42 54.522 56.011 -1.489 1
1 425 . 9 1 1 A 44 44 LEU CB C 42 40.980 41.817 -0.837 1
1 429 . 9 1 1 A 44 44 LEU N N 42 130.261 129.157 1.104 1
1 430 . 9 1 1 A 45 45 THR HA H 43 4.263 4.234 0.029 1
1 435 . 9 1 1 A 45 45 THR CA C 43 61.033 64.132 -3.099 1
1 436 . 9 1 1 A 45 45 THR CB C 43 69.768 69.742 0.026 1
1 440 . 9 1 1 A 46 46 GLU CA C 44 56.411 54.974 1.437 1
1 441 . 9 1 1 A 46 46 GLU CB C 44 29.827 31.047 -1.220 1
1 443 . 9 1 1 A 47 47 HIS HA H 45 4.549 4.469 0.080 1
1 447 . 9 1 1 A 47 47 HIS C C 45 174.812 176.776 -1.964 1
1 448 . 9 1 1 A 47 47 HIS CA C 45 56.107 59.209 -3.102 1
1 449 . 9 1 1 A 47 47 HIS CB C 45 29.080 30.205 -1.125 1
1 451 . 9 1 1 A 48 48 VAL H H 46 7.826 7.925 -0.099 1
1 452 . 9 1 1 A 48 48 VAL HA H 46 4.024 3.613 0.411 1
1 460 . 9 1 1 A 48 48 VAL C C 46 175.697 177.940 -2.243 1
1 461 . 9 1 1 A 48 48 VAL CA C 46 61.841 66.645 -4.804 1
1 462 . 9 1 1 A 48 48 VAL CB C 46 32.600 31.598 1.002 1
1 465 . 9 1 1 A 48 48 VAL N N 46 121.117 119.165 1.952 1
1 466 . 9 1 1 A 49 49 ALA H H 47 8.237 8.445 -0.208 1
1 467 . 9 1 1 A 49 49 ALA HA H 47 4.281 4.125 0.156 1
1 471 . 9 1 1 A 49 49 ALA C C 47 177.173 179.233 -2.060 1
1 472 . 9 1 1 A 49 49 ALA CA C 47 52.207 55.572 -3.365 1
1 473 . 9 1 1 A 49 49 ALA CB C 47 19.064 18.561 0.503 1
1 474 . 9 1 1 A 49 49 ALA N N 47 126.817 122.596 4.221 1
1 475 . 9 1 1 A 50 50 ASP H H 48 8.029 7.380 0.649 1
1 476 . 9 1 1 A 50 50 ASP HA H 48 4.436 4.549 -0.113 1
1 479 . 9 1 1 A 50 50 ASP C C 48 176.124 176.284 -0.160 1
1 480 . 9 1 1 A 50 50 ASP CA C 48 54.447 54.567 -0.120 1
1 481 . 9 1 1 A 50 50 ASP CB C 48 40.877 39.810 1.067 1
1 482 . 9 1 1 A 50 50 ASP N N 48 119.687 116.219 3.468 1
1 483 . 9 1 1 A 51 51 ALA H H 49 8.094 7.973 0.121 1
1 484 . 9 1 1 A 51 51 ALA HA H 49 4.134 3.501 0.633 1
1 488 . 9 1 1 A 51 51 ALA C C 49 177.835 178.886 -1.051 1
1 489 . 9 1 1 A 51 51 ALA CA C 49 52.900 53.015 -0.115 1
1 490 . 9 1 1 A 51 51 ALA CB C 49 18.942 18.998 -0.056 1
1 491 . 9 1 1 A 51 51 ALA N N 49 124.400 121.415 2.985 1
1 492 . 9 1 1 A 52 52 GLU H H 50 8.243 7.653 0.590 1
1 493 . 9 1 1 A 52 52 GLU HA H 50 4.152 4.296 -0.144 1
1 497 . 9 1 1 A 52 52 GLU C C 50 176.456 176.753 -0.297 1
1 498 . 9 1 1 A 52 52 GLU CA C 50 56.480 58.083 -1.603 1
1 499 . 9 1 1 A 52 52 GLU CB C 50 29.470 29.096 0.374 1
1 501 . 9 1 1 A 52 52 GLU N N 50 118.917 115.665 3.252 1
1 502 . 9 1 1 A 53 53 LEU H H 51 7.839 7.461 0.378 1
1 503 . 9 1 1 A 53 53 LEU HA H 51 4.229 4.285 -0.056 1
1 513 . 9 1 1 A 53 53 LEU C C 51 177.058 177.279 -0.221 1
1 514 . 9 1 1 A 53 53 LEU CA C 51 54.625 54.407 0.218 1
1 515 . 9 1 1 A 53 53 LEU CB C 51 42.125 42.362 -0.237 1
1 519 . 9 1 1 A 53 53 LEU N N 51 122.169 121.988 0.181 1
1 520 . 9 1 1 A 54 54 GLU H H 52 8.104 8.727 -0.623 1
1 521 . 9 1 1 A 54 54 GLU HA H 52 4.470 4.291 0.179 1
1 525 . 9 1 1 A 54 54 GLU CA C 52 54.286 58.266 -3.980 1
1 526 . 9 1 1 A 54 54 GLU CB C 52 29.268 28.551 0.717 1
1 528 . 9 1 1 A 54 54 GLU N N 52 123.040 118.935 4.105 1
1 529 . 9 1 1 A 55 55 PRO HA H 53 4.310 4.448 -0.138 1
1 536 . 9 1 1 A 55 55 PRO C C 53 177.019 175.911 1.108 1
1 537 . 9 1 1 A 55 55 PRO CA C 53 63.075 63.179 -0.104 1
1 538 . 9 1 1 A 55 55 PRO CB C 53 31.329 32.395 -1.066 1
1 541 . 9 1 1 A 56 56 LEU H H 54 8.263 8.502 -0.239 1
1 542 . 9 1 1 A 56 56 LEU HA H 54 4.237 5.022 -0.785 1
1 552 . 9 1 1 A 56 56 LEU C C 54 178.055 177.298 0.757 1
1 553 . 9 1 1 A 56 56 LEU CA C 54 55.018 54.276 0.742 1
1 554 . 9 1 1 A 56 56 LEU CB C 54 41.990 44.655 -2.665 1
1 558 . 9 1 1 A 56 56 LEU N N 54 122.728 122.536 0.192 1
1 559 . 9 1 1 A 57 57 GLY H H 55 8.231 8.580 -0.349 1
1 560 . 9 1 1 A 57 57 GLY HA2 H 55 3.911 3.980 -0.069 1
1 561 . 9 1 1 A 57 57 GLY HA3 H 55 3.808 3.986 -0.178 1
1 562 . 9 1 1 A 57 57 GLY C C 55 174.379 174.717 -0.338 1
1 563 . 9 1 1 A 57 57 GLY CA C 55 45.092 45.230 -0.138 1
1 564 . 9 1 1 A 57 57 GLY N N 55 110.035 111.106 -1.071 1
1 565 . 9 1 1 A 58 58 GLU H H 56 8.241 8.455 -0.214 1
1 566 . 9 1 1 A 58 58 GLU HA H 56 4.136 3.940 0.196 1
1 570 . 9 1 1 A 58 58 GLU C C 56 176.868 176.943 -0.075 1
1 571 . 9 1 1 A 58 58 GLU CA C 56 56.734 58.900 -2.166 1
1 572 . 9 1 1 A 58 58 GLU CB C 56 29.584 28.317 1.267 1
1 574 . 9 1 1 A 58 58 GLU N N 56 121.173 113.113 8.060 1
1 575 . 9 1 1 A 59 59 GLU H H 57 8.419 8.706 -0.287 1
1 576 . 9 1 1 A 59 59 GLU HA H 57 4.074 4.086 -0.012 1
1 580 . 9 1 1 A 59 59 GLU C C 57 176.502 177.814 -1.312 1
1 581 . 9 1 1 A 59 59 GLU CA C 57 56.842 59.077 -2.235 1
1 582 . 9 1 1 A 59 59 GLU CB C 57 29.267 29.523 -0.256 1
1 584 . 9 1 1 A 59 59 GLU N N 57 121.777 120.334 1.443 1
1 585 . 9 1 1 A 60 60 ALA H H 58 8.077 7.404 0.673 1
1 586 . 9 1 1 A 60 60 ALA HA H 58 4.134 4.312 -0.178 1
1 590 . 9 1 1 A 60 60 ALA CA C 58 52.432 52.194 0.238 1
1 591 . 9 1 1 A 60 60 ALA CB C 58 18.743 17.860 0.883 1
1 592 . 9 1 1 A 60 60 ALA N N 58 125.120 119.843 5.277 1
1 593 . 9 1 1 A 61 61 ALA H H 59 8.041 7.720 0.321 1
1 594 . 9 1 1 A 61 61 ALA HA H 59 4.131 4.812 -0.681 1
1 598 . 9 1 1 A 61 61 ALA C C 59 178.147 176.398 1.749 1
1 599 . 9 1 1 A 61 61 ALA CA C 59 52.586 50.974 1.612 1
1 600 . 9 1 1 A 61 61 ALA CB C 59 18.692 23.103 -4.411 1
1 601 . 9 1 1 A 61 61 ALA N N 59 123.857 119.486 4.371 1
1 602 . 9 1 1 A 62 62 GLY H H 60 8.069 8.562 -0.493 1
1 603 . 9 1 1 A 62 62 GLY HA2 H 60 3.810 3.837 -0.027 1
1 604 . 9 1 1 A 62 62 GLY HA3 H 60 3.888 3.873 0.015 1
1 605 . 9 1 1 A 62 62 GLY C C 60 174.914 173.863 1.051 1
1 606 . 9 1 1 A 62 62 GLY CA C 60 45.320 45.981 -0.661 1
1 607 . 9 1 1 A 62 62 GLY N N 60 107.924 106.403 1.521 1
1 608 . 9 1 1 A 63 63 GLY H H 61 8.118 7.774 0.344 1
1 609 . 9 1 1 A 63 63 GLY HA2 H 61 4.008 3.969 0.039 1
1 610 . 9 1 1 A 63 63 GLY HA3 H 61 3.893 4.125 -0.232 1
1 611 . 9 1 1 A 63 63 GLY C C 61 174.743 174.885 -0.142 1
1 612 . 9 1 1 A 63 63 GLY CA C 61 45.202 46.049 -0.847 1
1 613 . 9 1 1 A 63 63 GLY N N 61 109.441 108.705 0.736 1
1 614 . 9 1 1 A 64 64 ASP H H 62 8.305 8.538 -0.233 1
1 615 . 9 1 1 A 64 64 ASP HA H 62 4.240 4.186 0.054 1
1 618 . 9 1 1 A 64 64 ASP C C 62 177.571 178.368 -0.797 1
1 619 . 9 1 1 A 64 64 ASP CA C 62 57.210 57.155 0.055 1
1 620 . 9 1 1 A 64 64 ASP CB C 62 40.142 40.222 -0.080 1
1 621 . 9 1 1 A 64 64 ASP N N 62 121.568 119.498 2.070 1
1 622 . 9 1 1 A 65 65 GLN H H 63 8.337 8.196 0.141 1
1 623 . 9 1 1 A 65 65 GLN HA H 63 4.138 4.025 0.113 1
1 628 . 9 1 1 A 65 65 GLN C C 63 177.490 179.011 -1.521 1
1 629 . 9 1 1 A 65 65 GLN CA C 63 58.643 59.119 -0.476 1
1 630 . 9 1 1 A 65 65 GLN CB C 63 27.803 28.300 -0.497 1
1 632 . 9 1 1 A 65 65 GLN N N 63 119.700 119.697 0.003 1
1 633 . 9 1 1 A 66 66 PHE H H 64 7.658 8.603 -0.945 1
1 634 . 9 1 1 A 66 66 PHE HA H 64 4.170 4.305 -0.135 1
1 638 . 9 1 1 A 66 66 PHE C C 64 176.872 178.207 -1.335 1
1 639 . 9 1 1 A 66 66 PHE CA C 64 60.158 61.006 -0.848 1
1 640 . 9 1 1 A 66 66 PHE CB C 64 38.490 38.377 0.113 1
1 643 . 9 1 1 A 66 66 PHE N N 64 121.036 119.110 1.926 1
1 644 . 9 1 1 A 67 67 ILE H H 65 7.646 7.776 -0.130 1
1 645 . 9 1 1 A 67 67 ILE HA H 65 3.426 3.604 -0.178 1
1 655 . 9 1 1 A 67 67 ILE CA C 65 63.377 65.231 -1.854 1
1 656 . 9 1 1 A 67 67 ILE CB C 65 37.057 37.697 -0.640 1
1 660 . 9 1 1 A 67 67 ILE N N 65 121.372 119.865 1.507 1
1 661 . 9 1 1 A 68 68 HIS H H 66 7.945 8.161 -0.216 1
1 662 . 9 1 1 A 68 68 HIS HA H 66 4.005 4.244 -0.239 1
1 665 . 9 1 1 A 68 68 HIS CA C 66 59.915 59.622 0.293 1
1 668 . 9 1 1 A 68 68 HIS N N 66 120.036 119.391 0.645 1
1 669 . 9 1 1 A 69 69 GLU HA H 67 3.677 3.905 -0.228 1
1 673 . 9 1 1 A 69 69 GLU CA C 67 58.490 59.774 -1.284 1
1 674 . 9 1 1 A 69 69 GLU CB C 67 29.290 29.178 0.112 1
1 676 . 9 1 1 A 70 70 GLN H H 68 8.017 7.923 0.094 1
1 677 . 9 1 1 A 70 70 GLN HA H 68 3.426 3.745 -0.319 1
1 678 . 9 1 1 A 70 70 GLN C C 68 179.280 178.746 0.534 1
1 679 . 9 1 1 A 70 70 GLN CA C 68 57.561 58.681 -1.120 1
1 680 . 9 1 1 A 70 70 GLN CB C 68 28.530 28.115 0.415 1
1 682 . 9 1 1 A 70 70 GLN N N 68 120.410 119.036 1.374 1
1 683 . 9 1 1 A 71 71 ASP HA H 69 4.440 5.051 -0.611 1
1 684 . 9 1 1 A 71 71 ASP C C 69 177.402 178.996 -1.594 1
1 685 . 9 1 1 A 71 71 ASP CA C 69 56.290 57.474 -1.184 1
1 686 . 9 1 1 A 72 72 LEU H H 70 7.952 8.633 -0.681 1
1 687 . 9 1 1 A 72 72 LEU HA H 70 3.775 3.877 -0.102 1
1 697 . 9 1 1 A 72 72 LEU C C 70 178.316 178.904 -0.588 1
1 698 . 9 1 1 A 72 72 LEU CA C 70 56.101 57.915 -1.814 1
1 699 . 9 1 1 A 72 72 LEU CB C 70 39.872 41.392 -1.520 1
1 703 . 9 1 1 A 72 72 LEU N N 70 120.832 121.009 -0.177 1
1 704 . 9 1 1 A 73 73 ASN H H 71 7.723 8.178 -0.455 1
1 705 . 9 1 1 A 73 73 ASN HA H 71 4.270 4.458 -0.188 1
1 708 . 9 1 1 A 73 73 ASN C C 71 178.193 178.734 -0.541 1
1 709 . 9 1 1 A 73 73 ASN CA C 71 55.970 56.653 -0.683 1
1 710 . 9 1 1 A 73 73 ASN CB C 71 37.640 38.470 -0.830 1
1 711 . 9 1 1 A 73 73 ASN N N 71 119.295 116.449 2.846 1
1 712 . 9 1 1 A 74 74 TRP H H 72 7.811 8.379 -0.568 1
1 713 . 9 1 1 A 74 74 TRP HA H 72 4.500 4.493 0.007 1
1 720 . 9 1 1 A 74 74 TRP CA C 72 58.480 59.971 -1.491 1
1 721 . 9 1 1 A 74 74 TRP CB C 72 28.920 29.789 -0.869 1
1 727 . 9 1 1 A 74 74 TRP N N 72 121.490 120.783 0.707 1
1 729 . 9 1 1 A 75 75 LEU H H 73 8.412 8.431 -0.019 1
1 730 . 9 1 1 A 75 75 LEU HA H 73 3.290 3.295 -0.005 1
1 739 . 9 1 1 A 75 75 LEU C C 73 178.562 178.613 -0.051 1
1 740 . 9 1 1 A 75 75 LEU CA C 73 58.226 57.391 0.835 1
1 741 . 9 1 1 A 75 75 LEU CB C 73 41.200 41.233 -0.033 1
1 745 . 9 1 1 A 75 75 LEU N N 73 121.065 121.184 -0.119 1
1 746 . 9 1 1 A 76 76 GLN H H 74 7.648 7.965 -0.317 1
1 747 . 9 1 1 A 76 76 GLN HA H 74 3.657 4.017 -0.360 1
1 752 . 9 1 1 A 76 76 GLN C C 74 178.616 177.601 1.015 1
1 753 . 9 1 1 A 76 76 GLN CA C 74 58.777 58.980 -0.203 1
1 754 . 9 1 1 A 76 76 GLN CB C 74 28.163 28.769 -0.606 1
1 756 . 9 1 1 A 76 76 GLN N N 74 113.985 118.628 -4.643 1
1 757 . 9 1 1 A 77 77 GLN H H 75 7.465 7.476 -0.011 1
1 758 . 9 1 1 A 77 77 GLN HA H 75 4.134 4.342 -0.208 1
1 761 . 9 1 1 A 77 77 GLN C C 75 176.223 175.960 0.263 1
1 762 . 9 1 1 A 77 77 GLN CA C 75 56.203 55.502 0.701 1
1 763 . 9 1 1 A 77 77 GLN CB C 75 29.524 29.168 0.356 1
1 765 . 9 1 1 A 77 77 GLN N N 75 117.481 116.405 1.076 1
1 766 . 9 1 1 A 78 78 ALA H H 76 7.420 7.223 0.197 1
1 767 . 9 1 1 A 78 78 ALA HA H 76 3.864 4.126 -0.262 1
1 771 . 9 1 1 A 78 78 ALA C C 76 176.733 177.011 -0.278 1
1 772 . 9 1 1 A 78 78 ALA CA C 76 52.529 52.962 -0.433 1
1 773 . 9 1 1 A 78 78 ALA CB C 76 20.124 19.270 0.854 1
1 774 . 9 1 1 A 78 78 ALA N N 76 122.682 123.170 -0.488 1
1 775 . 9 1 1 A 79 79 ASP H H 77 9.028 8.854 0.174 1
1 776 . 9 1 1 A 79 79 ASP HA H 77 4.673 4.626 0.047 1
1 779 . 9 1 1 A 79 79 ASP C C 77 175.740 176.353 -0.613 1
1 780 . 9 1 1 A 79 79 ASP CA C 77 56.383 57.057 -0.674 1
1 781 . 9 1 1 A 79 79 ASP CB C 77 42.826 42.669 0.157 1
1 782 . 9 1 1 A 79 79 ASP N N 77 119.887 122.988 -3.101 1
1 783 . 9 1 1 A 80 80 VAL H H 78 7.379 7.770 -0.391 1
1 784 . 9 1 1 A 80 80 VAL HA H 78 4.340 4.857 -0.517 1
1 792 . 9 1 1 A 80 80 VAL C C 78 175.321 174.366 0.955 1
1 793 . 9 1 1 A 80 80 VAL CA C 78 60.011 60.335 -0.324 1
1 794 . 9 1 1 A 80 80 VAL CB C 78 35.362 36.448 -1.086 1
1 797 . 9 1 1 A 80 80 VAL N N 78 114.152 117.790 -3.638 1
1 798 . 9 1 1 A 81 81 VAL H H 79 8.350 7.978 0.372 1
1 799 . 9 1 1 A 81 81 VAL HA H 79 4.799 4.883 -0.084 1
1 807 . 9 1 1 A 81 81 VAL C C 79 173.095 174.673 -1.578 1
1 808 . 9 1 1 A 81 81 VAL CA C 79 60.775 60.733 0.042 1
1 809 . 9 1 1 A 81 81 VAL CB C 79 32.824 35.995 -3.171 1
1 812 . 9 1 1 A 81 81 VAL N N 79 128.429 125.068 3.361 1
1 813 . 9 1 1 A 82 82 VAL H H 80 8.947 8.709 0.238 1
1 814 . 9 1 1 A 82 82 VAL HA H 80 4.947 4.931 0.016 1
1 822 . 9 1 1 A 82 82 VAL C C 80 173.522 174.132 -0.610 1
1 823 . 9 1 1 A 82 82 VAL CA C 80 59.684 59.848 -0.164 1
1 824 . 9 1 1 A 82 82 VAL CB C 80 33.702 35.788 -2.086 1
1 827 . 9 1 1 A 82 82 VAL N N 80 126.957 125.431 1.526 1
1 828 . 9 1 1 A 83 83 ALA H H 81 9.011 8.601 0.410 1
1 829 . 9 1 1 A 83 83 ALA HA H 81 4.938 4.966 -0.028 1
1 833 . 9 1 1 A 83 83 ALA C C 81 130.330 175.733 -45.403 1
1 834 . 9 1 1 A 83 83 ALA CA C 81 49.490 51.255 -1.765 1
1 835 . 9 1 1 A 83 83 ALA CB C 81 23.628 23.384 0.244 1
1 836 . 9 1 1 A 83 83 ALA N N 81 128.705 124.915 3.790 1
1 837 . 9 1 1 A 84 84 GLU H H 82 8.922 8.854 0.068 1
1 838 . 9 1 1 A 84 84 GLU HA H 82 4.937 5.123 -0.186 1
1 839 . 9 1 1 A 84 84 GLU C C 82 177.673 175.996 1.677 1
1 840 . 9 1 1 A 84 84 GLU CA C 82 56.714 55.061 1.653 1
1 841 . 9 1 1 A 84 84 GLU CB C 82 29.882 32.424 -2.542 1
1 842 . 9 1 1 A 84 84 GLU N N 82 130.330 120.054 10.276 1
1 843 . 9 1 1 A 85 85 VAL H H 83 8.427 8.951 -0.524 1
1 844 . 9 1 1 A 85 85 VAL HA H 83 4.435 4.620 -0.185 1
1 852 . 9 1 1 A 85 85 VAL C C 83 174.252 176.637 -2.385 1
1 853 . 9 1 1 A 85 85 VAL CA C 83 59.896 61.158 -1.262 1
1 854 . 9 1 1 A 85 85 VAL CB C 83 29.968 32.082 -2.114 1
1 857 . 9 1 1 A 85 85 VAL N N 83 114.212 124.257 -10.045 1
1 858 . 9 1 1 A 86 86 THR H H 84 9.347 7.918 1.429 1
1 859 . 9 1 1 A 86 86 THR HA H 84 4.146 4.103 0.043 1
1 864 . 9 1 1 A 86 86 THR C C 84 175.751 175.268 0.483 1
1 865 . 9 1 1 A 86 86 THR CA C 84 67.629 66.448 1.181 1
1 866 . 9 1 1 A 86 86 THR CB C 84 66.819 69.217 -2.398 1
1 868 . 9 1 1 A 86 86 THR N N 84 121.640 117.768 3.872 1
1 869 . 9 1 1 A 87 87 GLN H H 85 8.114 7.955 0.159 1
1 870 . 9 1 1 A 87 87 GLN HA H 85 4.736 4.663 0.073 1
1 874 . 9 1 1 A 87 87 GLN CA C 85 51.898 54.016 -2.118 1
1 875 . 9 1 1 A 87 87 GLN CB C 85 27.942 29.738 -1.796 1
1 877 . 9 1 1 A 87 87 GLN N N 85 120.367 117.229 3.138 1
1 878 . 9 1 1 A 88 88 PRO HA H 86 4.061 4.465 -0.404 1
1 885 . 9 1 1 A 88 88 PRO C C 86 176.436 175.556 0.880 1
1 886 . 9 1 1 A 88 88 PRO CA C 86 63.422 62.779 0.643 1
1 887 . 9 1 1 A 88 88 PRO CB C 86 31.925 30.492 1.433 1
1 889 . 9 1 1 A 89 89 SER H H 87 6.044 8.468 -2.424 1
1 890 . 9 1 1 A 89 89 SER HA H 87 4.630 4.780 -0.150 1
1 893 . 9 1 1 A 89 89 SER C C 87 175.612 174.906 0.706 1
1 894 . 9 1 1 A 89 89 SER CA C 87 56.800 56.679 0.121 1
1 895 . 9 1 1 A 89 89 SER CB C 87 64.196 64.604 -0.408 1
1 896 . 9 1 1 A 89 89 SER N N 87 115.721 118.324 -2.603 1
1 897 . 9 1 1 A 90 90 LEU H H 88 9.702 8.881 0.821 1
1 898 . 9 1 1 A 90 90 LEU HA H 88 4.270 4.151 0.119 1
1 906 . 9 1 1 A 90 90 LEU C C 88 179.173 178.919 0.254 1
1 907 . 9 1 1 A 90 90 LEU CA C 88 57.402 57.691 -0.289 1
1 908 . 9 1 1 A 90 90 LEU CB C 88 43.642 41.676 1.966 1
1 911 . 9 1 1 A 90 90 LEU N N 88 130.488 130.556 -0.068 1
1 912 . 9 1 1 A 91 91 GLY H H 89 8.354 8.286 0.068 1
1 913 . 9 1 1 A 91 91 GLY HA2 H 89 3.680 3.754 -0.074 1
1 914 . 9 1 1 A 91 91 GLY HA3 H 89 3.584 3.780 -0.196 1
1 915 . 9 1 1 A 91 91 GLY C C 89 175.106 176.210 -1.104 1
1 916 . 9 1 1 A 91 91 GLY CA C 89 47.770 47.538 0.232 1
1 917 . 9 1 1 A 91 91 GLY N N 89 107.522 108.167 -0.645 1
1 918 . 9 1 1 A 92 92 VAL H H 90 7.906 7.722 0.184 1
1 919 . 9 1 1 A 92 92 VAL HA H 90 3.940 3.720 0.220 1
1 927 . 9 1 1 A 92 92 VAL C C 90 178.467 177.982 0.485 1
1 928 . 9 1 1 A 92 92 VAL CA C 90 65.379 66.550 -1.171 1
1 929 . 9 1 1 A 92 92 VAL CB C 90 31.785 31.584 0.201 1
1 932 . 9 1 1 A 92 92 VAL N N 90 121.741 121.858 -0.117 1
1 933 . 9 1 1 A 93 93 GLY H H 91 7.595 7.997 -0.402 1
1 934 . 9 1 1 A 93 93 GLY HA2 H 91 3.628 3.744 -0.116 1
1 935 . 9 1 1 A 93 93 GLY HA3 H 91 3.415 3.756 -0.341 1
1 936 . 9 1 1 A 93 93 GLY C C 91 174.022 175.682 -1.660 1
1 937 . 9 1 1 A 93 93 GLY CA C 91 48.319 47.396 0.923 1
1 938 . 9 1 1 A 93 93 GLY N N 91 104.629 107.975 -3.346 1
1 939 . 9 1 1 A 94 94 TYR H H 92 8.372 7.966 0.406 1
1 940 . 9 1 1 A 94 94 TYR HA H 92 4.046 4.056 -0.010 1
1 943 . 9 1 1 A 94 94 TYR C C 92 177.458 178.046 -0.588 1
1 944 . 9 1 1 A 94 94 TYR CA C 92 61.760 60.780 0.980 1
1 945 . 9 1 1 A 94 94 TYR CB C 92 38.431 38.678 -0.247 1
1 948 . 9 1 1 A 94 94 TYR N N 92 123.383 123.306 0.077 1
1 949 . 9 1 1 A 95 95 GLU H H 93 8.424 8.651 -0.227 1
1 950 . 9 1 1 A 95 95 GLU HA H 93 3.421 3.772 -0.351 1
1 951 . 9 1 1 A 95 95 GLU C C 93 178.590 179.561 -0.971 1
1 952 . 9 1 1 A 95 95 GLU CA C 93 60.211 59.317 0.894 1
1 953 . 9 1 1 A 95 95 GLU CB C 93 29.025 29.049 -0.024 1
1 954 . 9 1 1 A 95 95 GLU N N 93 120.181 117.911 2.270 1
1 955 . 9 1 1 A 96 96 LEU H H 94 8.210 8.343 -0.133 1
1 956 . 9 1 1 A 96 96 LEU HA H 94 3.830 3.972 -0.142 1
1 964 . 9 1 1 A 96 96 LEU C C 94 179.032 179.052 -0.020 1
1 965 . 9 1 1 A 96 96 LEU CA C 94 57.683 57.959 -0.276 1
1 966 . 9 1 1 A 96 96 LEU CB C 94 41.883 41.840 0.043 1
1 970 . 9 1 1 A 96 96 LEU N N 94 118.091 121.142 -3.051 1
1 971 . 9 1 1 A 97 97 GLY H H 95 8.773 8.148 0.625 1
1 972 . 9 1 1 A 97 97 GLY C C 95 175.344 175.605 -0.261 1
1 973 . 9 1 1 A 97 97 GLY CA C 95 47.308 46.889 0.419 1
1 974 . 9 1 1 A 97 97 GLY N N 95 108.085 106.303 1.782 1
1 975 . 9 1 1 A 98 98 ARG H H 96 8.100 7.904 0.196 1
1 976 . 9 1 1 A 98 98 ARG C C 96 179.692 178.859 0.833 1
1 977 . 9 1 1 A 98 98 ARG CA C 96 56.308 59.562 -3.254 1
1 978 . 9 1 1 A 98 98 ARG CB C 96 26.854 29.803 -2.949 1
1 979 . 9 1 1 A 98 98 ARG N N 96 118.156 121.521 -3.365 1
1 980 . 9 1 1 A 99 99 ALA H H 97 8.498 7.508 0.990 1
1 981 . 9 1 1 A 99 99 ALA HA H 97 3.640 3.994 -0.354 1
1 985 . 9 1 1 A 99 99 ALA C C 97 179.650 180.027 -0.377 1
1 986 . 9 1 1 A 99 99 ALA CA C 97 55.166 55.022 0.144 1
1 987 . 9 1 1 A 99 99 ALA CB C 97 18.604 18.494 0.110 1
1 988 . 9 1 1 A 99 99 ALA N N 97 122.310 121.857 0.453 1
1 989 . 9 1 1 A 100 100 VAL H H 98 8.597 8.307 0.290 1
1 990 . 9 1 1 A 100 100 VAL HA H 98 3.798 3.508 0.290 1
1 998 . 9 1 1 A 100 100 VAL C C 98 180.464 178.217 2.247 1
1 999 . 9 1 1 A 100 100 VAL CA C 98 65.664 66.753 -1.089 1
1 1000 . 9 1 1 A 100 100 VAL CB C 98 31.065 31.414 -0.349 1
1 1003 . 9 1 1 A 100 100 VAL N N 98 120.603 119.123 1.480 1
1 1004 . 9 1 1 A 101 101 ALA H H 99 7.280 7.909 -0.629 1
1 1005 . 9 1 1 A 101 101 ALA HA H 99 3.963 4.100 -0.137 1
1 1009 . 9 1 1 A 101 101 ALA C C 99 179.314 178.788 0.526 1
1 1010 . 9 1 1 A 101 101 ALA CA C 99 54.367 54.814 -0.447 1
1 1011 . 9 1 1 A 101 101 ALA CB C 99 18.139 18.855 -0.716 1
1 1012 . 9 1 1 A 101 101 ALA N N 99 124.450 121.819 2.631 1
1 1013 . 9 1 1 A 102 102 LEU H H 100 7.200 7.638 -0.438 1
1 1014 . 9 1 1 A 102 102 LEU HA H 100 4.192 4.533 -0.341 1
1 1024 . 9 1 1 A 102 102 LEU C C 100 177.306 177.315 -0.009 1
1 1025 . 9 1 1 A 102 102 LEU CA C 100 54.808 55.060 -0.252 1
1 1026 . 9 1 1 A 102 102 LEU CB C 100 42.880 43.663 -0.783 1
1 1030 . 9 1 1 A 102 102 LEU N N 100 116.834 112.405 4.429 1
1 1031 . 9 1 1 A 103 103 GLY H H 101 7.891 7.552 0.339 1
1 1032 . 9 1 1 A 103 103 GLY HA2 H 101 3.941 4.003 -0.062 1
1 1033 . 9 1 1 A 103 103 GLY HA3 H 101 3.831 4.013 -0.182 1
1 1034 . 9 1 1 A 103 103 GLY C C 101 175.137 174.002 1.135 1
1 1035 . 9 1 1 A 103 103 GLY CA C 101 45.673 45.158 0.515 1
1 1036 . 9 1 1 A 103 103 GLY N N 101 109.395 108.534 0.861 1
1 1037 . 9 1 1 A 104 104 LYS H H 102 7.337 8.722 -1.385 1
1 1038 . 9 1 1 A 104 104 LYS HA H 102 4.402 4.483 -0.081 1
1 1043 . 9 1 1 A 104 104 LYS CA C 102 52.136 57.407 -5.271 1
1 1044 . 9 1 1 A 104 104 LYS CB C 102 31.045 33.740 -2.695 1
1 1047 . 9 1 1 A 104 104 LYS N N 102 118.954 119.438 -0.484 1
1 1048 . 9 1 1 A 105 105 PRO HA H 103 4.781 4.912 -0.131 1
1 1054 . 9 1 1 A 105 105 PRO CA C 103 62.791 62.291 0.500 1
1 1055 . 9 1 1 A 105 105 PRO CB C 103 30.405 31.087 -0.682 1
1 1058 . 9 1 1 A 106 106 ILE H H 104 8.261 8.600 -0.339 1
1 1059 . 9 1 1 A 106 106 ILE HA H 104 4.680 4.313 0.367 1
1 1069 . 9 1 1 A 106 106 ILE C C 104 175.543 173.987 1.556 1
1 1070 . 9 1 1 A 106 106 ILE CA C 104 59.362 60.233 -0.871 1
1 1071 . 9 1 1 A 106 106 ILE CB C 104 43.738 37.462 6.276 1
1 1075 . 9 1 1 A 106 106 ILE N N 104 123.509 123.951 -0.442 1
1 1076 . 9 1 1 A 107 107 LEU H H 105 8.584 8.430 0.154 1
1 1077 . 9 1 1 A 107 107 LEU HA H 105 4.243 4.482 -0.239 1
1 1087 . 9 1 1 A 107 107 LEU C C 105 174.204 174.296 -0.092 1
1 1088 . 9 1 1 A 107 107 LEU CA C 105 52.863 53.339 -0.476 1
1 1089 . 9 1 1 A 107 107 LEU CB C 105 42.408 42.902 -0.494 1
1 1093 . 9 1 1 A 107 107 LEU N N 105 131.882 129.561 2.321 1
1 1094 . 9 1 1 A 108 108 CYS H H 106 8.679 8.660 0.019 1
1 1095 . 9 1 1 A 108 108 CYS HA H 106 5.280 5.183 0.097 1
1 1099 . 9 1 1 A 108 108 CYS C C 106 173.134 173.308 -0.174 1
1 1100 . 9 1 1 A 108 108 CYS CA C 106 57.290 57.140 0.150 1
1 1101 . 9 1 1 A 108 108 CYS CB C 106 29.559 30.053 -0.494 1
1 1102 . 9 1 1 A 108 108 CYS N N 106 122.904 125.709 -2.805 1
1 1103 . 9 1 1 A 109 109 LEU H H 107 8.987 8.793 0.194 1
1 1104 . 9 1 1 A 109 109 LEU HA H 107 5.120 5.474 -0.354 1
1 1112 . 9 1 1 A 109 109 LEU C C 107 174.500 175.481 -0.981 1
1 1113 . 9 1 1 A 109 109 LEU CA C 107 53.274 53.756 -0.482 1
1 1114 . 9 1 1 A 109 109 LEU CB C 107 43.450 45.108 -1.658 1
1 1118 . 9 1 1 A 109 109 LEU N N 107 124.653 123.412 1.241 1
1 1119 . 9 1 1 A 110 110 PHE H H 108 8.981 9.024 -0.043 1
1 1120 . 9 1 1 A 110 110 PHE HA H 108 4.846 5.371 -0.525 1
1 1125 . 9 1 1 A 110 110 PHE C C 108 172.231 173.801 -1.570 1
1 1126 . 9 1 1 A 110 110 PHE CA C 108 55.963 56.930 -0.967 1
1 1127 . 9 1 1 A 110 110 PHE CB C 108 43.270 42.230 1.040 1
1 1130 . 9 1 1 A 110 110 PHE N N 108 125.052 125.333 -0.281 1
1 1131 . 9 1 1 A 111 111 ARG H H 109 7.461 8.858 -1.397 1
1 1132 . 9 1 1 A 111 111 ARG HA H 109 4.804 4.371 0.433 1
1 1136 . 9 1 1 A 111 111 ARG CA C 109 51.953 53.939 -1.986 1
1 1137 . 9 1 1 A 111 111 ARG CB C 109 30.008 30.372 -0.364 1
1 1140 . 9 1 1 A 111 111 ARG N N 109 128.034 128.770 -0.736 1
1 1141 . 9 1 1 A 112 112 PRO C C 110 178.675 177.634 1.041 1
1 1142 . 9 1 1 A 112 112 PRO CA C 110 64.024 64.265 -0.241 1
1 1143 . 9 1 1 A 112 112 PRO CB C 110 31.416 31.779 -0.363 1
1 1144 . 9 1 1 A 113 113 GLN H H 111 8.188 8.719 -0.531 1
1 1145 . 9 1 1 A 113 113 GLN HA H 111 4.056 4.057 -0.001 1
1 1149 . 9 1 1 A 113 113 GLN C C 111 175.936 176.911 -0.975 1
1 1150 . 9 1 1 A 113 113 GLN CA C 111 57.144 58.269 -1.125 1
1 1151 . 9 1 1 A 113 113 GLN CB C 111 28.033 27.996 0.037 1
1 1153 . 9 1 1 A 113 113 GLN N N 111 118.835 116.911 1.924 1
1 1154 . 9 1 1 A 114 114 SER H H 112 7.730 7.686 0.044 1
1 1155 . 9 1 1 A 114 114 SER HA H 112 4.037 4.582 -0.545 1
1 1158 . 9 1 1 A 114 114 SER C C 112 175.750 174.567 1.183 1
1 1159 . 9 1 1 A 114 114 SER CA C 112 60.154 58.808 1.346 1
1 1160 . 9 1 1 A 114 114 SER CB C 112 64.282 64.417 -0.135 1
1 1161 . 9 1 1 A 114 114 SER N N 112 114.887 114.082 0.805 1
1 1162 . 9 1 1 A 115 115 GLY H H 113 8.005 8.205 -0.200 1
1 1163 . 9 1 1 A 115 115 GLY HA2 H 113 3.712 4.009 -0.297 1
1 1164 . 9 1 1 A 115 115 GLY HA3 H 113 4.130 4.196 -0.066 1
1 1165 . 9 1 1 A 115 115 GLY C C 113 173.945 175.636 -1.691 1
1 1166 . 9 1 1 A 115 115 GLY CA C 113 45.233 47.291 -2.058 1
1 1167 . 9 1 1 A 115 115 GLY N N 113 110.740 109.884 0.856 1
1 1168 . 9 1 1 A 116 116 ARG H H 114 7.665 8.706 -1.041 1
1 1169 . 9 1 1 A 116 116 ARG HA H 114 4.449 4.460 -0.011 1
1 1173 . 9 1 1 A 116 116 ARG C C 114 175.370 175.206 0.164 1
1 1174 . 9 1 1 A 116 116 ARG CA C 114 55.080 55.651 -0.571 1
1 1175 . 9 1 1 A 116 116 ARG CB C 114 31.215 29.817 1.398 1
1 1178 . 9 1 1 A 116 116 ARG N N 114 119.983 118.537 1.446 1
1 1179 . 9 1 1 A 117 117 VAL H H 115 8.409 8.054 0.355 1
1 1180 . 9 1 1 A 117 117 VAL HA H 115 4.184 3.538 0.646 1
1 1188 . 9 1 1 A 117 117 VAL C C 115 175.980 175.459 0.521 1
1 1189 . 9 1 1 A 117 117 VAL CA C 115 61.167 62.220 -1.053 1
1 1190 . 9 1 1 A 117 117 VAL CB C 115 32.931 30.641 2.290 1
1 1193 . 9 1 1 A 117 117 VAL N N 115 122.240 115.517 6.723 1
1 1194 . 9 1 1 A 118 118 LEU H H 116 8.227 7.328 0.899 1
1 1195 . 9 1 1 A 118 118 LEU HA H 116 3.720 3.664 0.056 1
1 1204 . 9 1 1 A 118 118 LEU C C 116 175.623 175.849 -0.226 1
1 1205 . 9 1 1 A 118 118 LEU CA C 116 54.555 58.056 -3.501 1
1 1206 . 9 1 1 A 118 118 LEU CB C 116 39.292 42.223 -2.931 1
1 1210 . 9 1 1 A 118 118 LEU N N 116 131.481 128.531 2.950 1
1 1211 . 9 1 1 A 119 119 SER H H 117 7.780 7.513 0.267 1
1 1212 . 9 1 1 A 119 119 SER HA H 117 4.060 4.705 -0.645 1
1 1214 . 9 1 1 A 119 119 SER C C 117 175.782 174.097 1.685 1
1 1215 . 9 1 1 A 119 119 SER CA C 117 58.530 57.711 0.819 1
1 1216 . 9 1 1 A 119 119 SER CB C 117 64.785 67.130 -2.345 1
1 1217 . 9 1 1 A 119 119 SER N N 117 118.658 111.190 7.468 1
1 1218 . 9 1 1 A 120 120 ALA H H 118 8.955 8.866 0.089 1
1 1219 . 9 1 1 A 120 120 ALA HA H 118 3.846 4.067 -0.221 1
1 1223 . 9 1 1 A 120 120 ALA C C 118 179.731 179.706 0.025 1
1 1224 . 9 1 1 A 120 120 ALA CA C 118 54.927 55.459 -0.532 1
1 1225 . 9 1 1 A 120 120 ALA CB C 118 18.627 18.106 0.521 1
1 1226 . 9 1 1 A 120 120 ALA N N 118 134.119 126.864 7.255 1
1 1227 . 9 1 1 A 121 121 MET H H 119 7.718 8.158 -0.440 1
1 1228 . 9 1 1 A 121 121 MET HA H 119 4.130 4.135 -0.005 1
1 1235 . 9 1 1 A 121 121 MET C C 119 175.610 178.615 -3.005 1
1 1236 . 9 1 1 A 121 121 MET CA C 119 55.968 58.347 -2.379 1
1 1237 . 9 1 1 A 121 121 MET CB C 119 30.814 32.953 -2.139 1
1 1240 . 9 1 1 A 121 121 MET N N 119 115.424 116.437 -1.013 1
1 1241 . 9 1 1 A 122 122 ILE H H 120 6.451 8.105 -1.654 1
1 1242 . 9 1 1 A 122 122 ILE HA H 120 3.392 3.653 -0.261 1
1 1252 . 9 1 1 A 122 122 ILE C C 120 177.108 177.844 -0.736 1
1 1253 . 9 1 1 A 122 122 ILE CA C 120 59.650 64.978 -5.328 1
1 1254 . 9 1 1 A 122 122 ILE CB C 120 34.640 37.652 -3.012 1
1 1258 . 9 1 1 A 122 122 ILE N N 120 113.418 119.395 -5.977 1
1 1259 . 9 1 1 A 123 123 ARG H H 121 7.540 8.529 -0.989 1
1 1260 . 9 1 1 A 123 123 ARG HA H 121 3.551 4.185 -0.634 1
1 1264 . 9 1 1 A 123 123 ARG C C 121 179.642 179.861 -0.219 1
1 1265 . 9 1 1 A 123 123 ARG CA C 121 59.242 59.177 0.065 1
1 1266 . 9 1 1 A 123 123 ARG CB C 121 29.087 30.043 -0.956 1
1 1269 . 9 1 1 A 123 123 ARG N N 121 116.248 119.997 -3.749 1
1 1270 . 9 1 1 A 124 124 GLY H H 122 8.086 8.755 -0.669 1
1 1271 . 9 1 1 A 124 124 GLY C C 122 172.357 176.372 -4.015 1
1 1272 . 9 1 1 A 124 124 GLY CA C 122 44.836 47.091 -2.255 1
1 1273 . 9 1 1 A 124 124 GLY N N 122 104.381 108.397 -4.016 1
1 1274 . 9 1 1 A 125 125 ALA H H 123 6.411 7.920 -1.509 1
1 1275 . 9 1 1 A 125 125 ALA HA H 123 2.441 3.796 -1.355 1
1 1279 . 9 1 1 A 125 125 ALA C C 123 176.908 178.576 -1.668 1
1 1280 . 9 1 1 A 125 125 ALA CA C 123 51.593 54.182 -2.589 1
1 1281 . 9 1 1 A 125 125 ALA CB C 123 16.997 17.403 -0.406 1
1 1282 . 9 1 1 A 125 125 ALA N N 123 123.136 123.872 -0.736 1
1 1283 . 9 1 1 A 126 126 ALA H H 124 6.190 7.454 -1.264 1
1 1284 . 9 1 1 A 126 126 ALA HA H 124 3.829 4.582 -0.753 1
1 1288 . 9 1 1 A 126 126 ALA C C 124 177.535 176.716 0.819 1
1 1289 . 9 1 1 A 126 126 ALA CA C 124 52.403 53.276 -0.873 1
1 1290 . 9 1 1 A 126 126 ALA CB C 124 18.375 19.397 -1.022 1
1 1291 . 9 1 1 A 126 126 ALA N N 124 117.999 121.314 -3.315 1
1 1292 . 9 1 1 A 127 127 ASP H H 125 8.877 9.280 -0.403 1
1 1293 . 9 1 1 A 127 127 ASP HA H 125 4.665 4.911 -0.246 1
1 1296 . 9 1 1 A 127 127 ASP C C 125 177.795 177.414 0.381 1
1 1297 . 9 1 1 A 127 127 ASP CA C 125 52.855 54.326 -1.471 1
1 1298 . 9 1 1 A 127 127 ASP CB C 125 41.814 42.291 -0.477 1
1 1299 . 9 1 1 A 127 127 ASP N N 125 121.828 123.900 -2.072 1
1 1300 . 9 1 1 A 128 128 GLY H H 126 7.954 8.264 -0.310 1
1 1301 . 9 1 1 A 128 128 GLY HA2 H 126 3.830 3.973 -0.143 1
1 1302 . 9 1 1 A 128 128 GLY HA3 H 126 4.249 4.005 0.244 1
1 1303 . 9 1 1 A 128 128 GLY C C 126 173.822 174.776 -0.954 1
1 1304 . 9 1 1 A 128 128 GLY CA C 126 45.549 46.010 -0.461 1
1 1305 . 9 1 1 A 128 128 GLY N N 126 108.814 108.659 0.155 1
1 1306 . 9 1 1 A 129 129 SER H H 127 8.547 8.128 0.419 1
1 1307 . 9 1 1 A 129 129 SER HA H 127 4.486 4.877 -0.391 1
1 1309 . 9 1 1 A 129 129 SER C C 127 174.178 176.080 -1.902 1
1 1310 . 9 1 1 A 129 129 SER CA C 127 58.653 58.755 -0.102 1
1 1311 . 9 1 1 A 129 129 SER CB C 127 63.316 64.271 -0.955 1
1 1312 . 9 1 1 A 129 129 SER N N 127 115.599 114.621 0.978 1
1 1313 . 9 1 1 A 130 130 ARG H H 128 8.795 8.317 0.478 1
1 1314 . 9 1 1 A 130 130 ARG HA H 128 4.160 4.550 -0.390 1
1 1318 . 9 1 1 A 130 130 ARG C C 128 175.518 176.126 -0.608 1
1 1319 . 9 1 1 A 130 130 ARG CA C 128 58.479 57.096 1.383 1
1 1320 . 9 1 1 A 130 130 ARG CB C 128 29.952 32.108 -2.156 1
1 1323 . 9 1 1 A 130 130 ARG N N 128 127.611 118.974 8.637 1
1 1324 . 9 1 1 A 131 131 PHE H H 129 9.315 8.003 1.312 1
1 1325 . 9 1 1 A 131 131 PHE HA H 129 4.878 5.049 -0.171 1
1 1331 . 9 1 1 A 131 131 PHE C C 129 175.058 174.686 0.372 1
1 1332 . 9 1 1 A 131 131 PHE CA C 129 55.953 57.243 -1.290 1
1 1333 . 9 1 1 A 131 131 PHE CB C 129 40.189 41.562 -1.373 1
1 1337 . 9 1 1 A 131 131 PHE N N 129 126.219 120.489 5.730 1
1 1338 . 9 1 1 A 132 132 GLN H H 130 8.160 7.953 0.207 1
1 1339 . 9 1 1 A 132 132 GLN HA H 130 5.013 4.751 0.262 1
1 1343 . 9 1 1 A 132 132 GLN CA C 130 54.498 54.953 -0.455 1
1 1344 . 9 1 1 A 132 132 GLN CB C 130 32.106 32.839 -0.733 1
1 1346 . 9 1 1 A 132 132 GLN N N 130 125.589 126.975 -1.386 1
1 1347 . 9 1 1 A 133 133 VAL H H 131 8.689 8.512 0.177 1
1 1348 . 9 1 1 A 133 133 VAL HA H 131 4.529 4.775 -0.246 1
1 1356 . 9 1 1 A 133 133 VAL C C 131 174.441 175.273 -0.832 1
1 1357 . 9 1 1 A 133 133 VAL CA C 131 60.758 61.544 -0.786 1
1 1358 . 9 1 1 A 133 133 VAL CB C 131 32.417 34.063 -1.646 1
1 1361 . 9 1 1 A 133 133 VAL N N 131 122.441 123.027 -0.586 1
1 1362 . 9 1 1 A 134 134 TRP H H 132 9.256 9.165 0.091 1
1 1363 . 9 1 1 A 134 134 TRP HA H 132 5.213 5.280 -0.067 1
1 1371 . 9 1 1 A 134 134 TRP C C 132 174.575 175.950 -1.375 1
1 1372 . 9 1 1 A 134 134 TRP CA C 132 53.859 55.734 -1.875 1
1 1373 . 9 1 1 A 134 134 TRP CB C 132 31.311 31.803 -0.492 1
1 1379 . 9 1 1 A 134 134 TRP N N 132 130.303 127.906 2.397 1
1 1381 . 9 1 1 A 135 135 ASP H H 133 8.237 8.832 -0.595 1
1 1382 . 9 1 1 A 135 135 ASP HA H 133 6.018 5.586 0.432 1
1 1385 . 9 1 1 A 135 135 ASP C C 133 177.020 175.345 1.675 1
1 1386 . 9 1 1 A 135 135 ASP CA C 133 53.321 53.310 0.011 1
1 1387 . 9 1 1 A 135 135 ASP CB C 133 41.514 42.187 -0.673 1
1 1388 . 9 1 1 A 135 135 ASP N N 133 125.516 121.728 3.788 1
1 1389 . 9 1 1 A 136 136 TYR H H 134 9.058 8.199 0.859 1
1 1390 . 9 1 1 A 136 136 TYR HA H 134 4.970 5.194 -0.224 1
1 1394 . 9 1 1 A 136 136 TYR C C 134 172.324 172.927 -0.603 1
1 1395 . 9 1 1 A 136 136 TYR CA C 134 55.982 56.334 -0.352 1
1 1396 . 9 1 1 A 136 136 TYR CB C 134 42.265 40.500 1.765 1
1 1399 . 9 1 1 A 136 136 TYR N N 134 120.315 116.658 3.657 1
1 1400 . 9 1 1 A 137 137 ALA H H 135 8.521 8.557 -0.036 1
1 1401 . 9 1 1 A 137 137 ALA HA H 135 4.280 4.257 0.023 1
1 1405 . 9 1 1 A 137 137 ALA C C 135 178.561 177.396 1.165 1
1 1406 . 9 1 1 A 137 137 ALA CA C 135 49.550 50.866 -1.316 1
1 1407 . 9 1 1 A 137 137 ALA CB C 135 19.998 22.235 -2.237 1
1 1408 . 9 1 1 A 137 137 ALA N N 135 123.386 121.626 1.760 1
1 1409 . 9 1 1 A 138 138 GLU H H 136 8.678 8.874 -0.196 1
1 1410 . 9 1 1 A 138 138 GLU HA H 136 3.777 4.144 -0.367 1
1 1414 . 9 1 1 A 138 138 GLU C C 136 177.624 178.028 -0.404 1
1 1415 . 9 1 1 A 138 138 GLU CA C 136 60.527 59.434 1.093 1
1 1416 . 9 1 1 A 138 138 GLU CB C 136 29.020 29.322 -0.302 1
1 1418 . 9 1 1 A 138 138 GLU N N 136 121.774 121.201 0.573 1
1 1419 . 9 1 1 A 139 139 GLY H H 137 8.666 8.433 0.233 1
1 1420 . 9 1 1 A 139 139 GLY HA2 H 137 3.872 3.966 -0.094 1
1 1421 . 9 1 1 A 139 139 GLY HA3 H 137 3.872 3.980 -0.108 1
1 1422 . 9 1 1 A 139 139 GLY C C 137 175.122 174.624 0.498 1
1 1423 . 9 1 1 A 139 139 GLY CA C 137 46.093 45.433 0.660 1
1 1424 . 9 1 1 A 139 139 GLY N N 137 106.053 107.696 -1.643 1
1 1425 . 9 1 1 A 140 140 GLU H H 138 8.305 9.567 -1.262 1
1 1426 . 9 1 1 A 140 140 GLU HA H 138 4.754 4.584 0.170 1
1 1430 . 9 1 1 A 140 140 GLU C C 138 177.819 176.805 1.014 1
1 1431 . 9 1 1 A 140 140 GLU CA C 138 55.049 56.538 -1.489 1
1 1432 . 9 1 1 A 140 140 GLU CB C 138 30.504 31.474 -0.970 1
1 1434 . 9 1 1 A 140 140 GLU N N 138 117.485 118.135 -0.650 1
1 1435 . 9 1 1 A 141 141 VAL H H 139 7.267 7.769 -0.502 1
1 1436 . 9 1 1 A 141 141 VAL HA H 139 3.422 3.771 -0.349 1
1 1444 . 9 1 1 A 141 141 VAL C C 139 175.454 177.521 -2.067 1
1 1445 . 9 1 1 A 141 141 VAL CA C 139 66.769 65.092 1.677 1
1 1446 . 9 1 1 A 141 141 VAL CB C 139 31.377 31.576 -0.199 1
1 1449 . 9 1 1 A 141 141 VAL N N 139 120.764 121.259 -0.495 1
1 1450 . 9 1 1 A 142 142 GLU H H 140 8.620 8.538 0.082 1
1 1451 . 9 1 1 A 142 142 GLU HA H 140 3.592 4.078 -0.486 1
1 1452 . 9 1 1 A 142 142 GLU C C 140 177.320 178.822 -1.502 1
1 1453 . 9 1 1 A 142 142 GLU CA C 140 62.607 58.644 3.963 1
1 1454 . 9 1 1 A 142 142 GLU CB C 140 26.759 29.101 -2.342 1
1 1455 . 9 1 1 A 142 142 GLU N N 140 120.048 119.561 0.487 1
1 1456 . 9 1 1 A 143 143 THR H H 141 7.449 8.100 -0.651 1
1 1457 . 9 1 1 A 143 143 THR HA H 141 4.003 4.003 0.000 1
1 1462 . 9 1 1 A 143 143 THR C C 141 177.258 175.799 1.459 1
1 1463 . 9 1 1 A 143 143 THR CA C 141 65.490 67.313 -1.823 1
1 1464 . 9 1 1 A 143 143 THR CB C 141 68.641 68.214 0.427 1
1 1466 . 9 1 1 A 143 143 THR N N 141 114.073 117.024 -2.951 1
1 1467 . 9 1 1 A 144 144 MET H H 142 7.992 8.443 -0.451 1
1 1468 . 9 1 1 A 144 144 MET HA H 142 4.316 4.338 -0.022 1
1 1476 . 9 1 1 A 144 144 MET C C 142 178.233 178.453 -0.220 1
1 1477 . 9 1 1 A 144 144 MET CA C 142 57.743 58.865 -1.122 1
1 1478 . 9 1 1 A 144 144 MET CB C 142 31.326 32.709 -1.383 1
1 1481 . 9 1 1 A 144 144 MET N N 142 120.595 118.811 1.784 1
1 1482 . 9 1 1 A 145 145 LEU H H 143 7.847 8.147 -0.300 1
1 1483 . 9 1 1 A 145 145 LEU HA H 143 3.919 3.753 0.166 1
1 1491 . 9 1 1 A 145 145 LEU C C 143 178.774 179.579 -0.805 1
1 1492 . 9 1 1 A 145 145 LEU CA C 143 57.877 58.040 -0.163 1
1 1493 . 9 1 1 A 145 145 LEU CB C 143 40.951 40.969 -0.018 1
1 1497 . 9 1 1 A 145 145 LEU N N 143 119.410 119.879 -0.469 1
1 1498 . 9 1 1 A 146 146 ASP H H 144 8.431 8.619 -0.188 1
1 1499 . 9 1 1 A 146 146 ASP HA H 144 4.312 4.692 -0.380 1
1 1502 . 9 1 1 A 146 146 ASP C C 144 178.129 179.563 -1.434 1
1 1503 . 9 1 1 A 146 146 ASP CA C 144 57.464 57.664 -0.200 1
1 1504 . 9 1 1 A 146 146 ASP CB C 144 39.548 40.400 -0.852 1
1 1505 . 9 1 1 A 146 146 ASP N N 144 119.837 121.035 -1.198 1
1 1506 . 9 1 1 A 147 147 ARG H H 145 7.949 8.402 -0.453 1
1 1507 . 9 1 1 A 147 147 ARG HA H 145 4.050 4.148 -0.098 1
1 1512 . 9 1 1 A 147 147 ARG C C 145 179.547 178.907 0.640 1
1 1513 . 9 1 1 A 147 147 ARG CA C 145 58.972 59.609 -0.637 1
1 1514 . 9 1 1 A 147 147 ARG CB C 145 29.798 30.605 -0.807 1
1 1517 . 9 1 1 A 147 147 ARG N N 145 119.173 120.161 -0.988 1
1 1518 . 9 1 1 A 148 148 TYR H H 146 8.128 8.167 -0.039 1
1 1519 . 9 1 1 A 148 148 TYR HA H 146 3.995 4.428 -0.433 1
1 1524 . 9 1 1 A 148 148 TYR C C 146 178.199 177.602 0.597 1
1 1525 . 9 1 1 A 148 148 TYR CA C 146 62.347 61.383 0.964 1
1 1526 . 9 1 1 A 148 148 TYR CB C 146 37.418 37.465 -0.047 1
1 1529 . 9 1 1 A 148 148 TYR N N 146 120.102 121.316 -1.214 1
1 1530 . 9 1 1 A 149 149 PHE H H 147 8.308 8.726 -0.418 1
1 1531 . 9 1 1 A 149 149 PHE HA H 147 4.013 4.458 -0.445 1
1 1535 . 9 1 1 A 149 149 PHE C C 147 177.574 178.473 -0.899 1
1 1536 . 9 1 1 A 149 149 PHE CA C 147 63.044 61.800 1.244 1
1 1537 . 9 1 1 A 149 149 PHE CB C 147 37.153 38.432 -1.279 1
1 1541 . 9 1 1 A 149 149 PHE N N 147 116.680 118.311 -1.631 1
1 1542 . 9 1 1 A 150 150 GLU H H 148 8.271 9.323 -1.052 1
1 1543 . 9 1 1 A 150 150 GLU HA H 148 4.030 4.130 -0.100 1
1 1547 . 9 1 1 A 150 150 GLU C C 148 177.687 177.983 -0.296 1
1 1548 . 9 1 1 A 150 150 GLU CA C 148 58.746 59.704 -0.958 1
1 1549 . 9 1 1 A 150 150 GLU CB C 148 28.847 29.286 -0.439 1
1 1551 . 9 1 1 A 150 150 GLU N N 148 119.973 118.576 1.397 1
1 1552 . 9 1 1 A 151 151 ALA H H 149 6.992 7.788 -0.796 1
1 1553 . 9 1 1 A 151 151 ALA HA H 149 4.217 4.460 -0.243 1
1 1557 . 9 1 1 A 151 151 ALA C C 149 178.190 177.028 1.162 1
1 1558 . 9 1 1 A 151 151 ALA CA C 149 52.779 51.896 0.883 1
1 1559 . 9 1 1 A 151 151 ALA CB C 149 19.087 19.277 -0.190 1
1 1560 . 9 1 1 A 151 151 ALA N N 149 118.629 120.093 -1.464 1
1 1561 . 9 1 1 A 152 152 TYR H H 150 7.722 8.641 -0.919 1
1 1562 . 9 1 1 A 152 152 TYR HA H 150 4.137 4.816 -0.679 1
1 1567 . 9 1 1 A 152 152 TYR C C 150 175.703 177.056 -1.353 1
1 1568 . 9 1 1 A 152 152 TYR CA C 150 59.260 59.304 -0.044 1
1 1569 . 9 1 1 A 152 152 TYR CB C 150 39.165 39.491 -0.326 1
1 1572 . 9 1 1 A 152 152 TYR N N 150 118.767 117.797 0.970 1
1 1573 . 9 1 1 A 153 153 LEU H H 151 7.670 8.795 -1.125 1
1 1574 . 9 1 1 A 153 153 LEU HA H 151 4.145 3.996 0.149 1
1 1584 . 9 1 1 A 153 153 LEU CA C 151 54.704 60.123 -5.419 1
1 1585 . 9 1 1 A 153 153 LEU CB C 151 40.520 39.859 0.661 1
1 1589 . 9 1 1 A 153 153 LEU N N 151 122.313 120.850 1.463 1
1 1590 . 9 1 1 A 154 154 PRO HA H 152 4.258 4.313 -0.055 1
1 1597 . 9 1 1 A 154 154 PRO C C 152 177.496 177.326 0.170 1
1 1598 . 9 1 1 A 154 154 PRO CA C 152 63.899 65.646 -1.747 1
1 1599 . 9 1 1 A 154 154 PRO CB C 152 31.080 30.784 0.296 1
1 1602 . 9 1 1 A 155 155 GLN H H 153 8.023 7.999 0.024 1
1 1603 . 9 1 1 A 155 155 GLN HA H 153 4.176 4.279 -0.103 1
1 1607 . 9 1 1 A 155 155 GLN C C 153 176.636 177.725 -1.089 1
1 1608 . 9 1 1 A 155 155 GLN CA C 153 55.968 56.759 -0.791 1
1 1609 . 9 1 1 A 155 155 GLN CB C 153 28.723 29.253 -0.530 1
1 1610 . 9 1 1 A 155 155 GLN N N 153 119.173 116.587 2.586 1
1 1611 . 9 1 1 A 156 156 LYS H H 154 8.113 7.781 0.332 1
1 1612 . 9 1 1 A 156 156 LYS HA H 154 4.196 4.065 0.131 1
1 1619 . 9 1 1 A 156 156 LYS C C 154 56.493 178.691 -122.198 1
1 1620 . 9 1 1 A 156 156 LYS CA C 154 56.493 58.777 -2.284 1
1 1621 . 9 1 1 A 156 156 LYS CB C 154 32.037 32.207 -0.170 1
1 1625 . 9 1 1 A 156 156 LYS N N 154 122.788 121.342 1.446 1
1 1626 . 9 1 1 A 157 157 THR H H 155 8.013 7.718 0.295 1
1 1627 . 9 1 1 A 157 157 THR HA H 155 4.183 3.929 0.254 1
1 1632 . 9 1 1 A 157 157 THR C C 155 174.580 175.031 -0.451 1
1 1633 . 9 1 1 A 157 157 THR CA C 155 61.958 66.099 -4.141 1
1 1634 . 9 1 1 A 157 157 THR CB C 155 69.665 68.763 0.902 1
1 1636 . 9 1 1 A 157 157 THR N N 155 115.504 115.779 -0.275 1
1 1637 . 9 1 1 A 158 158 ALA H H 156 8.170 7.298 0.872 1
1 1638 . 9 1 1 A 158 158 ALA HA H 156 4.220 4.434 -0.214 1
1 1642 . 9 1 1 A 158 158 ALA CA C 156 52.492 50.925 1.567 1
1 1643 . 9 1 1 A 158 158 ALA CB C 156 18.810 20.037 -1.227 1
1 1644 . 9 1 1 A 158 158 ALA N N 156 126.825 123.259 3.566 1
1 1645 . 9 1 1 A 159 159 SER H H 157 7.762 8.614 -0.852 1
1 1646 . 9 1 1 A 159 159 SER CA C 157 58.230 58.751 -0.521 1
1 1647 . 9 1 1 A 159 159 SER CB C 157 63.440 66.044 -2.604 1
1 1648 . 9 1 1 A 159 159 SER N N 157 123.078 119.354 3.724 1
1 1649 . 9 1 1 A 162 162 HIS HA H 160 4.845 4.657 0.188 1
1 1652 . 9 1 1 A 162 162 HIS CA C 160 53.590 54.748 -1.158 1
1 1653 . 9 1 1 A 162 162 HIS CB C 160 29.398 29.842 -0.444 1
1 1654 . 9 1 1 A 163 163 PRO HA H 161 4.388 4.340 0.048 1
1 1660 . 9 1 1 A 163 163 PRO C C 161 177.018 176.080 0.938 1
1 1661 . 9 1 1 A 163 163 PRO CA C 161 63.118 64.349 -1.231 1
1 1662 . 9 1 1 A 163 163 PRO CB C 161 31.668 32.135 -0.467 1
1 1665 . 9 1 1 A 164 164 SER H H 162 8.418 7.667 0.751 1
1 1666 . 9 1 1 A 164 164 SER HA H 162 4.338 4.718 -0.380 1
1 1668 . 9 1 1 A 164 164 SER C C 162 173.327 172.405 0.922 1
1 1669 . 9 1 1 A 164 164 SER CA C 162 58.202 57.299 0.903 1
1 1670 . 9 1 1 A 164 164 SER CB C 162 64.080 65.266 -1.186 1
1 1671 . 9 1 1 A 164 164 SER N N 162 117.485 111.949 5.536 1
1 6 . 10 1 1 A 4 4 ALA H H 2 8.270 8.609 -0.339 1
1 7 . 10 1 1 A 4 4 ALA HA H 2 4.212 3.984 0.228 1
1 11 . 10 1 1 A 4 4 ALA C C 2 177.441 176.976 0.465 1
1 12 . 10 1 1 A 4 4 ALA CA C 2 52.280 54.319 -2.039 1
1 13 . 10 1 1 A 4 4 ALA CB C 2 18.880 17.913 0.967 1
1 14 . 10 1 1 A 4 4 ALA N N 2 126.500 121.477 5.023 1
1 15 . 10 1 1 A 5 5 ALA H H 3 8.251 8.598 -0.347 1
1 16 . 10 1 1 A 5 5 ALA HA H 3 4.261 4.429 -0.168 1
1 20 . 10 1 1 A 5 5 ALA C C 3 177.824 175.667 2.157 1
1 21 . 10 1 1 A 5 5 ALA CA C 3 52.347 52.315 0.032 1
1 22 . 10 1 1 A 5 5 ALA CB C 3 18.869 19.622 -0.753 1
1 23 . 10 1 1 A 5 5 ALA N N 3 124.322 121.379 2.943 1
1 24 . 10 1 1 A 6 6 SER H H 4 8.158 8.174 -0.016 1
1 25 . 10 1 1 A 6 6 SER HA H 4 4.358 5.295 -0.937 1
1 27 . 10 1 1 A 6 6 SER C C 4 175.222 174.585 0.637 1
1 28 . 10 1 1 A 6 6 SER CA C 4 58.438 57.142 1.296 1
1 29 . 10 1 1 A 6 6 SER CB C 4 63.859 65.610 -1.751 1
1 30 . 10 1 1 A 6 6 SER N N 4 115.338 111.595 3.743 1
1 31 . 10 1 1 A 7 7 GLY H H 5 8.265 8.275 -0.010 1
1 32 . 10 1 1 A 7 7 GLY HA2 H 5 3.900 4.176 -0.276 1
1 33 . 10 1 1 A 7 7 GLY C C 5 174.083 172.215 1.868 1
1 34 . 10 1 1 A 7 7 GLY CA C 5 45.113 46.109 -0.996 1
1 35 . 10 1 1 A 7 7 GLY N N 5 111.360 110.848 0.512 1
1 36 . 10 1 1 A 8 8 GLU H H 6 8.100 8.520 -0.420 1
1 37 . 10 1 1 A 8 8 GLU HA H 6 4.209 4.538 -0.329 1
1 41 . 10 1 1 A 8 8 GLU C C 6 176.354 177.528 -1.174 1
1 42 . 10 1 1 A 8 8 GLU CA C 6 56.261 54.615 1.646 1
1 43 . 10 1 1 A 8 8 GLU CB C 6 29.830 30.363 -0.533 1
1 45 . 10 1 1 A 8 8 GLU N N 6 121.056 117.684 3.372 1
1 46 . 10 1 1 A 9 9 GLN H H 7 8.287 8.659 -0.372 1
1 47 . 10 1 1 A 9 9 GLN HA H 7 4.247 3.942 0.305 1
1 51 . 10 1 1 A 9 9 GLN C C 7 172.457 176.358 -3.901 1
1 52 . 10 1 1 A 9 9 GLN CA C 7 55.269 58.756 -3.487 1
1 53 . 10 1 1 A 9 9 GLN CB C 7 29.236 28.814 0.422 1
1 55 . 10 1 1 A 9 9 GLN N N 7 122.164 119.946 2.218 1
1 56 . 10 1 1 A 10 10 ALA H H 8 8.368 7.820 0.548 1
1 57 . 10 1 1 A 10 10 ALA HA H 8 4.509 4.283 0.226 1
1 61 . 10 1 1 A 10 10 ALA CA C 8 50.341 53.572 -3.231 1
1 62 . 10 1 1 A 10 10 ALA CB C 8 18.140 18.323 -0.183 1
1 63 . 10 1 1 A 10 10 ALA N N 8 128.028 120.896 7.132 1
1 64 . 10 1 1 A 11 11 PRO HA H 9 4.437 4.491 -0.054 1
1 70 . 10 1 1 A 11 11 PRO C C 9 176.381 176.797 -0.416 1
1 71 . 10 1 1 A 11 11 PRO CA C 9 63.298 62.525 0.773 1
1 72 . 10 1 1 A 11 11 PRO CB C 9 31.776 32.036 -0.260 1
1 75 . 10 1 1 A 12 12 CYS H H 10 8.056 8.429 -0.373 1
1 76 . 10 1 1 A 12 12 CYS HA H 10 4.717 4.575 0.142 1
1 79 . 10 1 1 A 12 12 CYS C C 10 173.266 174.933 -1.667 1
1 80 . 10 1 1 A 12 12 CYS CA C 10 57.398 59.178 -1.780 1
1 81 . 10 1 1 A 12 12 CYS CB C 10 29.165 29.012 0.153 1
1 82 . 10 1 1 A 12 12 CYS N N 10 118.295 119.365 -1.070 1
1 83 . 10 1 1 A 13 13 SER H H 11 9.815 8.513 1.302 1
1 84 . 10 1 1 A 13 13 SER HA H 11 5.227 5.451 -0.224 1
1 87 . 10 1 1 A 13 13 SER C C 11 173.648 173.840 -0.192 1
1 88 . 10 1 1 A 13 13 SER CA C 11 57.630 55.885 1.745 1
1 89 . 10 1 1 A 13 13 SER CB C 11 64.820 66.190 -1.370 1
1 90 . 10 1 1 A 13 13 SER N N 11 122.365 113.152 9.213 1
1 91 . 10 1 1 A 14 14 VAL H H 12 9.352 9.120 0.232 1
1 92 . 10 1 1 A 14 14 VAL HA H 12 4.696 5.611 -0.915 1
1 100 . 10 1 1 A 14 14 VAL C C 12 173.875 173.417 0.458 1
1 101 . 10 1 1 A 14 14 VAL CA C 12 60.146 61.012 -0.866 1
1 102 . 10 1 1 A 14 14 VAL CB C 12 34.499 35.506 -1.007 1
1 105 . 10 1 1 A 14 14 VAL N N 12 126.378 121.782 4.596 1
1 106 . 10 1 1 A 15 15 TYR H H 13 8.745 9.106 -0.361 1
1 111 . 10 1 1 A 15 15 TYR C C 13 173.345 174.047 -0.702 1
1 112 . 10 1 1 A 15 15 TYR CA C 13 56.186 56.924 -0.738 1
1 113 . 10 1 1 A 15 15 TYR CB C 13 40.858 40.494 0.364 1
1 116 . 10 1 1 A 15 15 TYR N N 13 129.472 128.405 1.067 1
1 117 . 10 1 1 A 16 16 PHE H H 14 7.370 8.593 -1.223 1
1 118 . 10 1 1 A 16 16 PHE HA H 14 5.720 5.139 0.581 1
1 123 . 10 1 1 A 16 16 PHE C C 14 174.058 174.435 -0.377 1
1 124 . 10 1 1 A 16 16 PHE CA C 14 54.361 57.093 -2.732 1
1 125 . 10 1 1 A 16 16 PHE CB C 14 40.461 40.556 -0.095 1
1 129 . 10 1 1 A 16 16 PHE N N 14 128.263 129.507 -1.244 1
1 130 . 10 1 1 A 17 17 CYS H H 15 8.147 8.149 -0.002 1
1 131 . 10 1 1 A 17 17 CYS CA C 15 56.570 57.203 -0.633 1
1 132 . 10 1 1 A 17 17 CYS CB C 15 29.690 32.026 -2.336 1
1 133 . 10 1 1 A 17 17 CYS N N 15 126.188 126.518 -0.330 1
1 134 . 10 1 1 A 18 18 GLY HA2 H 16 3.819 3.971 -0.152 1
1 135 . 10 1 1 A 18 18 GLY C C 16 173.374 172.632 0.742 1
1 136 . 10 1 1 A 18 18 GLY CA C 16 45.510 45.971 -0.461 1
1 137 . 10 1 1 A 19 19 SER H H 17 8.533 9.539 -1.006 1
1 138 . 10 1 1 A 19 19 SER HA H 17 4.505 5.305 -0.800 1
1 139 . 10 1 1 A 19 19 SER CA C 17 58.700 56.616 2.084 1
1 140 . 10 1 1 A 19 19 SER CB C 17 63.810 65.027 -1.217 1
1 141 . 10 1 1 A 19 19 SER N N 17 117.300 113.798 3.502 1
1 142 . 10 1 1 A 20 20 ILE HA H 18 4.309 4.558 -0.249 1
1 152 . 10 1 1 A 20 20 ILE CA C 18 61.317 61.090 0.227 1
1 153 . 10 1 1 A 20 20 ILE CB C 18 38.302 39.391 -1.089 1
1 157 . 10 1 1 A 21 21 ARG HA H 19 4.172 4.385 -0.213 1
1 160 . 10 1 1 A 21 21 ARG C C 19 177.118 176.917 0.201 1
1 161 . 10 1 1 A 21 21 ARG CA C 19 56.960 58.250 -1.290 1
1 162 . 10 1 1 A 21 21 ARG CB C 19 29.568 30.202 -0.634 1
1 165 . 10 1 1 A 22 22 GLY H H 20 8.685 8.744 -0.059 1
1 166 . 10 1 1 A 22 22 GLY HA2 H 20 3.801 4.028 -0.227 1
1 167 . 10 1 1 A 22 22 GLY HA3 H 20 3.923 4.035 -0.112 1
1 168 . 10 1 1 A 22 22 GLY C C 20 174.814 173.974 0.840 1
1 169 . 10 1 1 A 22 22 GLY CA C 20 45.289 44.754 0.535 1
1 170 . 10 1 1 A 22 22 GLY N N 20 110.145 114.189 -4.044 1
1 171 . 10 1 1 A 23 23 GLY H H 21 8.058 8.390 -0.332 1
1 172 . 10 1 1 A 23 23 GLY HA2 H 21 3.998 3.999 -0.001 1
1 173 . 10 1 1 A 23 23 GLY HA3 H 21 4.237 4.002 0.235 1
1 174 . 10 1 1 A 23 23 GLY C C 21 174.762 172.874 1.888 1
1 175 . 10 1 1 A 23 23 GLY CA C 21 45.025 45.557 -0.532 1
1 176 . 10 1 1 A 23 23 GLY N N 21 109.327 107.539 1.788 1
1 177 . 10 1 1 A 24 24 ARG H H 22 8.376 8.476 -0.100 1
1 178 . 10 1 1 A 24 24 ARG HA H 22 4.086 4.869 -0.783 1
1 184 . 10 1 1 A 24 24 ARG C C 22 178.178 176.594 1.584 1
1 185 . 10 1 1 A 24 24 ARG CA C 22 57.471 53.939 3.532 1
1 186 . 10 1 1 A 24 24 ARG CB C 22 29.653 33.547 -3.894 1
1 189 . 10 1 1 A 24 24 ARG N N 22 120.861 123.777 -2.916 1
1 190 . 10 1 1 A 25 25 GLU H H 23 8.831 9.127 -0.296 1
1 191 . 10 1 1 A 25 25 GLU HA H 23 4.015 3.930 0.085 1
1 195 . 10 1 1 A 25 25 GLU C C 23 178.005 178.236 -0.231 1
1 196 . 10 1 1 A 25 25 GLU CA C 23 58.920 59.243 -0.323 1
1 197 . 10 1 1 A 25 25 GLU CB C 23 28.592 29.280 -0.688 1
1 199 . 10 1 1 A 25 25 GLU N N 23 121.243 122.649 -1.406 1
1 200 . 10 1 1 A 26 26 ASP H H 24 7.897 7.975 -0.078 1
1 201 . 10 1 1 A 26 26 ASP HA H 24 4.516 4.179 0.337 1
1 203 . 10 1 1 A 26 26 ASP C C 24 176.455 178.630 -2.175 1
1 204 . 10 1 1 A 26 26 ASP CA C 24 55.122 56.277 -1.155 1
1 205 . 10 1 1 A 26 26 ASP CB C 24 39.888 39.727 0.161 1
1 206 . 10 1 1 A 26 26 ASP N N 24 119.541 119.743 -0.202 1
1 207 . 10 1 1 A 27 27 GLN H H 25 7.696 8.549 -0.853 1
1 208 . 10 1 1 A 27 27 GLN HA H 25 3.704 3.912 -0.208 1
1 212 . 10 1 1 A 27 27 GLN C C 25 177.016 178.305 -1.289 1
1 213 . 10 1 1 A 27 27 GLN CA C 25 59.501 58.508 0.993 1
1 214 . 10 1 1 A 27 27 GLN CB C 25 27.762 28.375 -0.613 1
1 216 . 10 1 1 A 27 27 GLN N N 25 119.471 119.903 -0.432 1
1 217 . 10 1 1 A 28 28 ALA H H 26 8.227 7.533 0.694 1
1 218 . 10 1 1 A 28 28 ALA HA H 26 4.072 4.234 -0.162 1
1 222 . 10 1 1 A 28 28 ALA C C 26 180.567 179.687 0.880 1
1 223 . 10 1 1 A 28 28 ALA CA C 26 54.627 55.125 -0.498 1
1 224 . 10 1 1 A 28 28 ALA CB C 26 17.355 18.687 -1.332 1
1 225 . 10 1 1 A 28 28 ALA N N 26 122.362 122.661 -0.299 1
1 226 . 10 1 1 A 29 29 LEU H H 27 7.533 8.217 -0.684 1
1 227 . 10 1 1 A 29 29 LEU HA H 27 4.050 4.120 -0.070 1
1 237 . 10 1 1 A 29 29 LEU C C 27 178.752 178.147 0.605 1
1 238 . 10 1 1 A 29 29 LEU CA C 27 57.578 57.690 -0.112 1
1 239 . 10 1 1 A 29 29 LEU CB C 27 40.734 41.815 -1.081 1
1 243 . 10 1 1 A 29 29 LEU N N 27 122.255 119.912 2.343 1
1 244 . 10 1 1 A 30 30 TYR H H 28 8.473 8.346 0.127 1
1 245 . 10 1 1 A 30 30 TYR HA H 28 4.049 4.268 -0.219 1
1 250 . 10 1 1 A 30 30 TYR C C 28 177.736 178.405 -0.669 1
1 251 . 10 1 1 A 30 30 TYR CA C 28 59.817 60.419 -0.602 1
1 252 . 10 1 1 A 30 30 TYR CB C 28 36.140 37.623 -1.483 1
1 255 . 10 1 1 A 30 30 TYR N N 28 120.403 118.676 1.727 1
1 256 . 10 1 1 A 31 31 ALA H H 29 8.008 8.347 -0.339 1
1 257 . 10 1 1 A 31 31 ALA HA H 29 4.005 4.068 -0.063 1
1 261 . 10 1 1 A 31 31 ALA C C 29 180.879 179.402 1.477 1
1 262 . 10 1 1 A 31 31 ALA CA C 29 54.914 55.120 -0.206 1
1 263 . 10 1 1 A 31 31 ALA CB C 29 17.375 18.162 -0.787 1
1 264 . 10 1 1 A 31 31 ALA N N 29 120.771 123.225 -2.454 1
1 265 . 10 1 1 A 32 32 ARG H H 30 7.596 7.579 0.017 1
1 266 . 10 1 1 A 32 32 ARG HA H 30 3.916 4.054 -0.138 1
1 273 . 10 1 1 A 32 32 ARG C C 30 179.919 178.553 1.366 1
1 274 . 10 1 1 A 32 32 ARG CA C 30 59.014 59.040 -0.026 1
1 275 . 10 1 1 A 32 32 ARG CB C 30 30.531 29.808 0.723 1
1 278 . 10 1 1 A 32 32 ARG N N 30 120.365 118.024 2.341 1
1 279 . 10 1 1 A 33 33 ILE H H 31 8.066 8.601 -0.535 1
1 280 . 10 1 1 A 33 33 ILE HA H 31 3.120 3.628 -0.508 1
1 290 . 10 1 1 A 33 33 ILE C C 31 177.051 178.193 -1.142 1
1 291 . 10 1 1 A 33 33 ILE CA C 31 65.757 65.273 0.484 1
1 292 . 10 1 1 A 33 33 ILE CB C 31 36.928 37.843 -0.915 1
1 296 . 10 1 1 A 33 33 ILE N N 31 121.608 119.688 1.920 1
1 297 . 10 1 1 A 34 34 VAL H H 32 8.148 8.700 -0.552 1
1 298 . 10 1 1 A 34 34 VAL HA H 32 2.954 3.166 -0.212 1
1 306 . 10 1 1 A 34 34 VAL C C 32 177.159 177.851 -0.692 1
1 307 . 10 1 1 A 34 34 VAL CA C 32 67.220 66.005 1.215 1
1 308 . 10 1 1 A 34 34 VAL CB C 32 31.039 31.057 -0.018 1
1 311 . 10 1 1 A 34 34 VAL N N 32 119.318 120.082 -0.764 1
1 312 . 10 1 1 A 35 35 SER H H 33 7.826 8.416 -0.590 1
1 313 . 10 1 1 A 35 35 SER HA H 33 3.868 4.027 -0.159 1
1 316 . 10 1 1 A 35 35 SER C C 33 176.779 177.084 -0.305 1
1 317 . 10 1 1 A 35 35 SER CA C 33 62.000 61.467 0.533 1
1 318 . 10 1 1 A 35 35 SER CB C 33 62.789 62.340 0.449 1
1 319 . 10 1 1 A 35 35 SER N N 33 111.936 114.773 -2.837 1
1 320 . 10 1 1 A 36 36 ARG H H 34 7.405 7.482 -0.077 1
1 321 . 10 1 1 A 36 36 ARG HA H 34 4.070 3.941 0.129 1
1 323 . 10 1 1 A 36 36 ARG C C 34 178.047 178.152 -0.105 1
1 324 . 10 1 1 A 36 36 ARG CA C 34 56.108 58.924 -2.816 1
1 325 . 10 1 1 A 36 36 ARG CB C 34 28.837 30.064 -1.227 1
1 326 . 10 1 1 A 36 36 ARG N N 34 120.909 122.546 -1.637 1
1 327 . 10 1 1 A 37 37 LEU H H 35 8.301 8.106 0.195 1
1 328 . 10 1 1 A 37 37 LEU HA H 35 3.620 3.788 -0.168 1
1 336 . 10 1 1 A 37 37 LEU C C 35 178.446 178.726 -0.280 1
1 337 . 10 1 1 A 37 37 LEU CA C 35 57.640 57.452 0.188 1
1 338 . 10 1 1 A 37 37 LEU CB C 35 41.584 40.524 1.060 1
1 342 . 10 1 1 A 37 37 LEU N N 35 118.567 119.181 -0.614 1
1 343 . 10 1 1 A 38 38 ARG H H 36 7.379 8.099 -0.720 1
1 344 . 10 1 1 A 38 38 ARG HA H 36 4.340 3.807 0.533 1
1 350 . 10 1 1 A 38 38 ARG C C 36 177.895 178.407 -0.512 1
1 351 . 10 1 1 A 38 38 ARG CA C 36 57.785 59.024 -1.239 1
1 352 . 10 1 1 A 38 38 ARG CB C 36 29.775 29.648 0.127 1
1 355 . 10 1 1 A 38 38 ARG N N 36 115.352 120.217 -4.865 1
1 356 . 10 1 1 A 39 39 ARG H H 37 7.240 7.767 -0.527 1
1 357 . 10 1 1 A 39 39 ARG HA H 37 3.743 4.188 -0.445 1
1 363 . 10 1 1 A 39 39 ARG C C 37 176.988 176.179 0.809 1
1 364 . 10 1 1 A 39 39 ARG CA C 37 57.605 59.010 -1.405 1
1 365 . 10 1 1 A 39 39 ARG CB C 37 28.925 30.714 -1.789 1
1 368 . 10 1 1 A 39 39 ARG N N 37 117.410 117.222 0.188 1
1 369 . 10 1 1 A 40 40 TYR H H 38 7.296 7.279 0.017 1
1 370 . 10 1 1 A 40 40 TYR HA H 38 4.319 4.980 -0.661 1
1 375 . 10 1 1 A 40 40 TYR C C 38 175.001 175.011 -0.010 1
1 376 . 10 1 1 A 40 40 TYR CA C 38 57.730 55.886 1.844 1
1 377 . 10 1 1 A 40 40 TYR CB C 38 39.343 41.102 -1.759 1
1 380 . 10 1 1 A 40 40 TYR N N 38 116.937 116.022 0.915 1
1 381 . 10 1 1 A 41 41 GLY H H 39 7.325 8.638 -1.313 1
1 382 . 10 1 1 A 41 41 GLY HA2 H 39 3.953 3.738 0.215 1
1 383 . 10 1 1 A 41 41 GLY C C 39 171.302 175.051 -3.749 1
1 384 . 10 1 1 A 41 41 GLY CA C 39 45.590 46.834 -1.244 1
1 385 . 10 1 1 A 41 41 GLY N N 39 105.596 110.492 -4.896 1
1 386 . 10 1 1 A 42 42 LYS H H 40 8.186 7.679 0.507 1
1 387 . 10 1 1 A 42 42 LYS HA H 40 4.205 4.041 0.164 1
1 393 . 10 1 1 A 42 42 LYS C C 40 175.672 175.997 -0.325 1
1 394 . 10 1 1 A 42 42 LYS CA C 40 55.241 57.478 -2.237 1
1 395 . 10 1 1 A 42 42 LYS CB C 40 32.889 32.822 0.067 1
1 399 . 10 1 1 A 42 42 LYS N N 40 120.341 119.613 0.728 1
1 400 . 10 1 1 A 43 43 VAL H H 41 8.610 8.726 -0.116 1
1 401 . 10 1 1 A 43 43 VAL HA H 41 4.416 4.653 -0.237 1
1 409 . 10 1 1 A 43 43 VAL C C 41 175.997 175.348 0.649 1
1 410 . 10 1 1 A 43 43 VAL CA C 41 61.331 61.770 -0.439 1
1 411 . 10 1 1 A 43 43 VAL CB C 41 30.573 31.803 -1.230 1
1 414 . 10 1 1 A 43 43 VAL N N 41 127.312 124.727 2.585 1
1 415 . 10 1 1 A 44 44 LEU H H 42 8.894 8.293 0.601 1
1 416 . 10 1 1 A 44 44 LEU HA H 42 4.496 3.728 0.768 1
1 424 . 10 1 1 A 44 44 LEU CA C 42 54.522 54.196 0.326 1
1 425 . 10 1 1 A 44 44 LEU CB C 42 40.980 42.604 -1.624 1
1 429 . 10 1 1 A 44 44 LEU N N 42 130.261 128.153 2.108 1
1 430 . 10 1 1 A 45 45 THR HA H 43 4.263 3.808 0.455 1
1 435 . 10 1 1 A 45 45 THR CA C 43 61.033 62.247 -1.214 1
1 436 . 10 1 1 A 45 45 THR CB C 43 69.768 66.687 3.081 1
1 440 . 10 1 1 A 46 46 GLU CA C 44 56.411 58.675 -2.264 1
1 441 . 10 1 1 A 46 46 GLU CB C 44 29.827 29.608 0.219 1
1 443 . 10 1 1 A 47 47 HIS HA H 45 4.549 4.189 0.360 1
1 447 . 10 1 1 A 47 47 HIS C C 45 174.812 177.018 -2.206 1
1 448 . 10 1 1 A 47 47 HIS CA C 45 56.107 59.436 -3.329 1
1 449 . 10 1 1 A 47 47 HIS CB C 45 29.080 30.053 -0.973 1
1 451 . 10 1 1 A 48 48 VAL H H 46 7.826 8.196 -0.370 1
1 452 . 10 1 1 A 48 48 VAL HA H 46 4.024 3.758 0.266 1
1 460 . 10 1 1 A 48 48 VAL C C 46 175.697 177.880 -2.183 1
1 461 . 10 1 1 A 48 48 VAL CA C 46 61.841 66.567 -4.726 1
1 462 . 10 1 1 A 48 48 VAL CB C 46 32.600 31.776 0.824 1
1 465 . 10 1 1 A 48 48 VAL N N 46 121.117 119.603 1.514 1
1 466 . 10 1 1 A 49 49 ALA H H 47 8.237 8.049 0.188 1
1 467 . 10 1 1 A 49 49 ALA HA H 47 4.281 4.103 0.178 1
1 471 . 10 1 1 A 49 49 ALA C C 47 177.173 179.446 -2.273 1
1 472 . 10 1 1 A 49 49 ALA CA C 47 52.207 55.549 -3.342 1
1 473 . 10 1 1 A 49 49 ALA CB C 47 19.064 18.067 0.997 1
1 474 . 10 1 1 A 49 49 ALA N N 47 126.817 121.658 5.159 1
1 475 . 10 1 1 A 50 50 ASP H H 48 8.029 8.021 0.008 1
1 476 . 10 1 1 A 50 50 ASP HA H 48 4.436 4.550 -0.114 1
1 479 . 10 1 1 A 50 50 ASP C C 48 176.124 176.567 -0.443 1
1 480 . 10 1 1 A 50 50 ASP CA C 48 54.447 53.269 1.178 1
1 481 . 10 1 1 A 50 50 ASP CB C 48 40.877 39.311 1.566 1
1 482 . 10 1 1 A 50 50 ASP N N 48 119.687 117.963 1.724 1
1 483 . 10 1 1 A 51 51 ALA H H 49 8.094 8.733 -0.639 1
1 484 . 10 1 1 A 51 51 ALA HA H 49 4.134 4.481 -0.347 1
1 488 . 10 1 1 A 51 51 ALA C C 49 177.835 178.177 -0.342 1
1 489 . 10 1 1 A 51 51 ALA CA C 49 52.900 51.331 1.569 1
1 490 . 10 1 1 A 51 51 ALA CB C 49 18.942 19.522 -0.580 1
1 491 . 10 1 1 A 51 51 ALA N N 49 124.400 123.341 1.059 1
1 492 . 10 1 1 A 52 52 GLU H H 50 8.243 7.968 0.275 1
1 493 . 10 1 1 A 52 52 GLU HA H 50 4.152 4.394 -0.242 1
1 497 . 10 1 1 A 52 52 GLU C C 50 176.456 176.140 0.316 1
1 498 . 10 1 1 A 52 52 GLU CA C 50 56.480 56.366 0.114 1
1 499 . 10 1 1 A 52 52 GLU CB C 50 29.470 30.301 -0.831 1
1 501 . 10 1 1 A 52 52 GLU N N 50 118.917 116.990 1.927 1
1 502 . 10 1 1 A 53 53 LEU H H 51 7.839 7.359 0.480 1
1 503 . 10 1 1 A 53 53 LEU HA H 51 4.229 4.644 -0.415 1
1 513 . 10 1 1 A 53 53 LEU C C 51 177.058 176.388 0.670 1
1 514 . 10 1 1 A 53 53 LEU CA C 51 54.625 53.114 1.511 1
1 515 . 10 1 1 A 53 53 LEU CB C 51 42.125 44.491 -2.366 1
1 519 . 10 1 1 A 53 53 LEU N N 51 122.169 116.610 5.559 1
1 520 . 10 1 1 A 54 54 GLU H H 52 8.104 8.913 -0.809 1
1 521 . 10 1 1 A 54 54 GLU HA H 52 4.470 4.267 0.203 1
1 525 . 10 1 1 A 54 54 GLU CA C 52 54.286 58.145 -3.859 1
1 526 . 10 1 1 A 54 54 GLU CB C 52 29.268 28.549 0.719 1
1 528 . 10 1 1 A 54 54 GLU N N 52 123.040 117.601 5.439 1
1 529 . 10 1 1 A 55 55 PRO HA H 53 4.310 4.368 -0.058 1
1 536 . 10 1 1 A 55 55 PRO C C 53 177.019 177.093 -0.074 1
1 537 . 10 1 1 A 55 55 PRO CA C 53 63.075 63.428 -0.353 1
1 538 . 10 1 1 A 55 55 PRO CB C 53 31.329 31.958 -0.629 1
1 541 . 10 1 1 A 56 56 LEU H H 54 8.263 8.439 -0.176 1
1 542 . 10 1 1 A 56 56 LEU HA H 54 4.237 4.560 -0.323 1
1 552 . 10 1 1 A 56 56 LEU C C 54 178.055 176.443 1.612 1
1 553 . 10 1 1 A 56 56 LEU CA C 54 55.018 54.363 0.655 1
1 554 . 10 1 1 A 56 56 LEU CB C 54 41.990 43.176 -1.186 1
1 558 . 10 1 1 A 56 56 LEU N N 54 122.728 124.066 -1.338 1
1 559 . 10 1 1 A 57 57 GLY H H 55 8.231 8.667 -0.436 1
1 560 . 10 1 1 A 57 57 GLY HA2 H 55 3.911 4.149 -0.238 1
1 561 . 10 1 1 A 57 57 GLY HA3 H 55 3.808 4.153 -0.345 1
1 562 . 10 1 1 A 57 57 GLY C C 55 174.379 175.273 -0.894 1
1 563 . 10 1 1 A 57 57 GLY CA C 55 45.092 44.723 0.369 1
1 564 . 10 1 1 A 57 57 GLY N N 55 110.035 108.826 1.209 1
1 565 . 10 1 1 A 58 58 GLU H H 56 8.241 8.955 -0.714 1
1 566 . 10 1 1 A 58 58 GLU HA H 56 4.136 4.050 0.086 1
1 570 . 10 1 1 A 58 58 GLU C C 56 176.868 177.841 -0.973 1
1 571 . 10 1 1 A 58 58 GLU CA C 56 56.734 59.586 -2.852 1
1 572 . 10 1 1 A 58 58 GLU CB C 56 29.584 29.606 -0.022 1
1 574 . 10 1 1 A 58 58 GLU N N 56 121.173 121.530 -0.357 1
1 575 . 10 1 1 A 59 59 GLU H H 57 8.419 8.455 -0.036 1
1 576 . 10 1 1 A 59 59 GLU HA H 57 4.074 4.268 -0.194 1
1 580 . 10 1 1 A 59 59 GLU C C 57 176.502 176.794 -0.292 1
1 581 . 10 1 1 A 59 59 GLU CA C 57 56.842 57.913 -1.071 1
1 582 . 10 1 1 A 59 59 GLU CB C 57 29.267 28.771 0.496 1
1 584 . 10 1 1 A 59 59 GLU N N 57 121.777 115.638 6.139 1
1 585 . 10 1 1 A 60 60 ALA H H 58 8.077 8.599 -0.522 1
1 586 . 10 1 1 A 60 60 ALA HA H 58 4.134 4.244 -0.110 1
1 590 . 10 1 1 A 60 60 ALA CA C 58 52.432 52.441 -0.009 1
1 591 . 10 1 1 A 60 60 ALA CB C 58 18.743 19.317 -0.574 1
1 592 . 10 1 1 A 60 60 ALA N N 58 125.120 124.365 0.755 1
1 593 . 10 1 1 A 61 61 ALA H H 59 8.041 8.994 -0.953 1
1 594 . 10 1 1 A 61 61 ALA HA H 59 4.131 4.166 -0.035 1
1 598 . 10 1 1 A 61 61 ALA C C 59 178.147 179.081 -0.934 1
1 599 . 10 1 1 A 61 61 ALA CA C 59 52.586 53.651 -1.065 1
1 600 . 10 1 1 A 61 61 ALA CB C 59 18.692 18.382 0.310 1
1 601 . 10 1 1 A 61 61 ALA N N 59 123.857 124.608 -0.751 1
1 602 . 10 1 1 A 62 62 GLY H H 60 8.069 8.253 -0.184 1
1 603 . 10 1 1 A 62 62 GLY HA2 H 60 3.810 4.031 -0.221 1
1 604 . 10 1 1 A 62 62 GLY HA3 H 60 3.888 4.105 -0.217 1
1 605 . 10 1 1 A 62 62 GLY C C 60 174.914 175.205 -0.291 1
1 606 . 10 1 1 A 62 62 GLY CA C 60 45.320 46.989 -1.669 1
1 607 . 10 1 1 A 62 62 GLY N N 60 107.924 107.544 0.380 1
1 608 . 10 1 1 A 63 63 GLY H H 61 8.118 7.412 0.706 1
1 609 . 10 1 1 A 63 63 GLY HA2 H 61 4.008 4.185 -0.177 1
1 610 . 10 1 1 A 63 63 GLY HA3 H 61 3.893 4.234 -0.341 1
1 611 . 10 1 1 A 63 63 GLY C C 61 174.743 175.134 -0.391 1
1 612 . 10 1 1 A 63 63 GLY CA C 61 45.202 46.499 -1.297 1
1 613 . 10 1 1 A 63 63 GLY N N 61 109.441 106.991 2.450 1
1 614 . 10 1 1 A 64 64 ASP H H 62 8.305 8.385 -0.080 1
1 615 . 10 1 1 A 64 64 ASP HA H 62 4.240 4.296 -0.056 1
1 618 . 10 1 1 A 64 64 ASP C C 62 177.571 178.119 -0.548 1
1 619 . 10 1 1 A 64 64 ASP CA C 62 57.210 57.162 0.048 1
1 620 . 10 1 1 A 64 64 ASP CB C 62 40.142 40.348 -0.206 1
1 621 . 10 1 1 A 64 64 ASP N N 62 121.568 118.819 2.749 1
1 622 . 10 1 1 A 65 65 GLN H H 63 8.337 7.978 0.359 1
1 623 . 10 1 1 A 65 65 GLN HA H 63 4.138 4.003 0.135 1
1 628 . 10 1 1 A 65 65 GLN C C 63 177.490 178.747 -1.257 1
1 629 . 10 1 1 A 65 65 GLN CA C 63 58.643 58.565 0.078 1
1 630 . 10 1 1 A 65 65 GLN CB C 63 27.803 28.572 -0.769 1
1 632 . 10 1 1 A 65 65 GLN N N 63 119.700 120.050 -0.350 1
1 633 . 10 1 1 A 66 66 PHE H H 64 7.658 8.182 -0.524 1
1 634 . 10 1 1 A 66 66 PHE HA H 64 4.170 4.335 -0.165 1
1 638 . 10 1 1 A 66 66 PHE C C 64 176.872 178.412 -1.540 1
1 639 . 10 1 1 A 66 66 PHE CA C 64 60.158 61.132 -0.974 1
1 640 . 10 1 1 A 66 66 PHE CB C 64 38.490 38.350 0.140 1
1 643 . 10 1 1 A 66 66 PHE N N 64 121.036 118.856 2.180 1
1 644 . 10 1 1 A 67 67 ILE H H 65 7.646 8.856 -1.210 1
1 645 . 10 1 1 A 67 67 ILE HA H 65 3.426 3.594 -0.168 1
1 655 . 10 1 1 A 67 67 ILE CA C 65 63.377 65.182 -1.805 1
1 656 . 10 1 1 A 67 67 ILE CB C 65 37.057 37.717 -0.660 1
1 660 . 10 1 1 A 67 67 ILE N N 65 121.372 119.908 1.464 1
1 661 . 10 1 1 A 68 68 HIS H H 66 7.945 8.413 -0.468 1
1 662 . 10 1 1 A 68 68 HIS HA H 66 4.005 4.177 -0.172 1
1 665 . 10 1 1 A 68 68 HIS CA C 66 59.915 59.838 0.077 1
1 668 . 10 1 1 A 68 68 HIS N N 66 120.036 119.333 0.703 1
1 669 . 10 1 1 A 69 69 GLU HA H 67 3.677 4.078 -0.401 1
1 673 . 10 1 1 A 69 69 GLU CA C 67 58.490 59.917 -1.427 1
1 674 . 10 1 1 A 69 69 GLU CB C 67 29.290 29.579 -0.289 1
1 676 . 10 1 1 A 70 70 GLN H H 68 8.017 8.088 -0.071 1
1 677 . 10 1 1 A 70 70 GLN HA H 68 3.426 4.090 -0.664 1
1 678 . 10 1 1 A 70 70 GLN C C 68 179.280 178.120 1.160 1
1 679 . 10 1 1 A 70 70 GLN CA C 68 57.561 58.839 -1.278 1
1 680 . 10 1 1 A 70 70 GLN CB C 68 28.530 28.535 -0.005 1
1 682 . 10 1 1 A 70 70 GLN N N 68 120.410 118.158 2.252 1
1 683 . 10 1 1 A 71 71 ASP HA H 69 4.440 5.290 -0.850 1
1 684 . 10 1 1 A 71 71 ASP C C 69 177.402 178.246 -0.844 1
1 685 . 10 1 1 A 71 71 ASP CA C 69 56.290 57.845 -1.555 1
1 686 . 10 1 1 A 72 72 LEU H H 70 7.952 8.508 -0.556 1
1 687 . 10 1 1 A 72 72 LEU HA H 70 3.775 3.839 -0.064 1
1 697 . 10 1 1 A 72 72 LEU C C 70 178.316 178.415 -0.099 1
1 698 . 10 1 1 A 72 72 LEU CA C 70 56.101 57.719 -1.618 1
1 699 . 10 1 1 A 72 72 LEU CB C 70 39.872 40.924 -1.052 1
1 703 . 10 1 1 A 72 72 LEU N N 70 120.832 120.170 0.662 1
1 704 . 10 1 1 A 73 73 ASN H H 71 7.723 8.156 -0.433 1
1 705 . 10 1 1 A 73 73 ASN HA H 71 4.270 4.326 -0.056 1
1 708 . 10 1 1 A 73 73 ASN C C 71 178.193 178.203 -0.010 1
1 709 . 10 1 1 A 73 73 ASN CA C 71 55.970 56.373 -0.403 1
1 710 . 10 1 1 A 73 73 ASN CB C 71 37.640 38.223 -0.583 1
1 711 . 10 1 1 A 73 73 ASN N N 71 119.295 116.269 3.026 1
1 712 . 10 1 1 A 74 74 TRP H H 72 7.811 8.154 -0.343 1
1 713 . 10 1 1 A 74 74 TRP HA H 72 4.500 4.483 0.017 1
1 720 . 10 1 1 A 74 74 TRP CA C 72 58.480 59.790 -1.310 1
1 721 . 10 1 1 A 74 74 TRP CB C 72 28.920 29.546 -0.626 1
1 727 . 10 1 1 A 74 74 TRP N N 72 121.490 120.904 0.586 1
1 729 . 10 1 1 A 75 75 LEU H H 73 8.412 8.688 -0.276 1
1 730 . 10 1 1 A 75 75 LEU HA H 73 3.290 3.819 -0.529 1
1 739 . 10 1 1 A 75 75 LEU C C 73 178.562 178.696 -0.134 1
1 740 . 10 1 1 A 75 75 LEU CA C 73 58.226 57.742 0.484 1
1 741 . 10 1 1 A 75 75 LEU CB C 73 41.200 41.101 0.099 1
1 745 . 10 1 1 A 75 75 LEU N N 73 121.065 121.110 -0.045 1
1 746 . 10 1 1 A 76 76 GLN H H 74 7.648 7.805 -0.157 1
1 747 . 10 1 1 A 76 76 GLN HA H 74 3.657 4.153 -0.496 1
1 752 . 10 1 1 A 76 76 GLN C C 74 178.616 177.622 0.994 1
1 753 . 10 1 1 A 76 76 GLN CA C 74 58.777 58.942 -0.165 1
1 754 . 10 1 1 A 76 76 GLN CB C 74 28.163 28.105 0.058 1
1 756 . 10 1 1 A 76 76 GLN N N 74 113.985 118.661 -4.676 1
1 757 . 10 1 1 A 77 77 GLN H H 75 7.465 7.840 -0.375 1
1 758 . 10 1 1 A 77 77 GLN HA H 75 4.134 4.452 -0.318 1
1 761 . 10 1 1 A 77 77 GLN C C 75 176.223 175.857 0.366 1
1 762 . 10 1 1 A 77 77 GLN CA C 75 56.203 55.637 0.566 1
1 763 . 10 1 1 A 77 77 GLN CB C 75 29.524 29.515 0.009 1
1 765 . 10 1 1 A 77 77 GLN N N 75 117.481 116.831 0.650 1
1 766 . 10 1 1 A 78 78 ALA H H 76 7.420 7.219 0.201 1
1 767 . 10 1 1 A 78 78 ALA HA H 76 3.864 4.362 -0.498 1
1 771 . 10 1 1 A 78 78 ALA C C 76 176.733 177.505 -0.772 1
1 772 . 10 1 1 A 78 78 ALA CA C 76 52.529 52.744 -0.215 1
1 773 . 10 1 1 A 78 78 ALA CB C 76 20.124 19.228 0.896 1
1 774 . 10 1 1 A 78 78 ALA N N 76 122.682 123.402 -0.720 1
1 775 . 10 1 1 A 79 79 ASP H H 77 9.028 9.716 -0.688 1
1 776 . 10 1 1 A 79 79 ASP HA H 77 4.673 4.629 0.044 1
1 779 . 10 1 1 A 79 79 ASP C C 77 175.740 176.585 -0.845 1
1 780 . 10 1 1 A 79 79 ASP CA C 77 56.383 57.274 -0.891 1
1 781 . 10 1 1 A 79 79 ASP CB C 77 42.826 42.646 0.180 1
1 782 . 10 1 1 A 79 79 ASP N N 77 119.887 123.332 -3.445 1
1 783 . 10 1 1 A 80 80 VAL H H 78 7.379 8.036 -0.657 1
1 784 . 10 1 1 A 80 80 VAL HA H 78 4.340 4.825 -0.485 1
1 792 . 10 1 1 A 80 80 VAL C C 78 175.321 174.416 0.905 1
1 793 . 10 1 1 A 80 80 VAL CA C 78 60.011 60.393 -0.382 1
1 794 . 10 1 1 A 80 80 VAL CB C 78 35.362 35.698 -0.336 1
1 797 . 10 1 1 A 80 80 VAL N N 78 114.152 117.705 -3.553 1
1 798 . 10 1 1 A 81 81 VAL H H 79 8.350 8.417 -0.067 1
1 799 . 10 1 1 A 81 81 VAL HA H 79 4.799 4.961 -0.162 1
1 807 . 10 1 1 A 81 81 VAL C C 79 173.095 174.482 -1.387 1
1 808 . 10 1 1 A 81 81 VAL CA C 79 60.775 60.576 0.199 1
1 809 . 10 1 1 A 81 81 VAL CB C 79 32.824 34.239 -1.415 1
1 812 . 10 1 1 A 81 81 VAL N N 79 128.429 126.338 2.091 1
1 813 . 10 1 1 A 82 82 VAL H H 80 8.947 8.886 0.061 1
1 814 . 10 1 1 A 82 82 VAL HA H 80 4.947 4.848 0.099 1
1 822 . 10 1 1 A 82 82 VAL C C 80 173.522 174.656 -1.134 1
1 823 . 10 1 1 A 82 82 VAL CA C 80 59.684 60.929 -1.245 1
1 824 . 10 1 1 A 82 82 VAL CB C 80 33.702 33.295 0.407 1
1 827 . 10 1 1 A 82 82 VAL N N 80 126.957 128.661 -1.704 1
1 828 . 10 1 1 A 83 83 ALA H H 81 9.011 8.649 0.362 1
1 829 . 10 1 1 A 83 83 ALA HA H 81 4.938 5.082 -0.144 1
1 833 . 10 1 1 A 83 83 ALA C C 81 130.330 174.791 -44.461 1
1 834 . 10 1 1 A 83 83 ALA CA C 81 49.490 49.846 -0.356 1
1 835 . 10 1 1 A 83 83 ALA CB C 81 23.628 23.512 0.116 1
1 836 . 10 1 1 A 83 83 ALA N N 81 128.705 129.236 -0.531 1
1 837 . 10 1 1 A 84 84 GLU H H 82 8.922 8.422 0.500 1
1 838 . 10 1 1 A 84 84 GLU HA H 82 4.937 4.925 0.012 1
1 839 . 10 1 1 A 84 84 GLU C C 82 177.673 177.438 0.235 1
1 840 . 10 1 1 A 84 84 GLU CA C 82 56.714 55.216 1.498 1
1 841 . 10 1 1 A 84 84 GLU CB C 82 29.882 31.465 -1.583 1
1 842 . 10 1 1 A 84 84 GLU N N 82 130.330 120.694 9.636 1
1 843 . 10 1 1 A 85 85 VAL H H 83 8.427 9.011 -0.584 1
1 844 . 10 1 1 A 85 85 VAL HA H 83 4.435 4.613 -0.178 1
1 852 . 10 1 1 A 85 85 VAL C C 83 174.252 176.850 -2.598 1
1 853 . 10 1 1 A 85 85 VAL CA C 83 59.896 61.274 -1.378 1
1 854 . 10 1 1 A 85 85 VAL CB C 83 29.968 31.979 -2.011 1
1 857 . 10 1 1 A 85 85 VAL N N 83 114.212 120.413 -6.201 1
1 858 . 10 1 1 A 86 86 THR H H 84 9.347 7.822 1.525 1
1 859 . 10 1 1 A 86 86 THR HA H 84 4.146 4.453 -0.307 1
1 864 . 10 1 1 A 86 86 THR C C 84 175.751 175.193 0.558 1
1 865 . 10 1 1 A 86 86 THR CA C 84 67.629 65.057 2.572 1
1 866 . 10 1 1 A 86 86 THR CB C 84 66.819 69.486 -2.667 1
1 868 . 10 1 1 A 86 86 THR N N 84 121.640 117.301 4.339 1
1 869 . 10 1 1 A 87 87 GLN H H 85 8.114 7.897 0.217 1
1 870 . 10 1 1 A 87 87 GLN HA H 85 4.736 4.546 0.190 1
1 874 . 10 1 1 A 87 87 GLN CA C 85 51.898 54.530 -2.632 1
1 875 . 10 1 1 A 87 87 GLN CB C 85 27.942 28.202 -0.260 1
1 877 . 10 1 1 A 87 87 GLN N N 85 120.367 119.985 0.382 1
1 878 . 10 1 1 A 88 88 PRO HA H 86 4.061 4.851 -0.790 1
1 885 . 10 1 1 A 88 88 PRO C C 86 176.436 175.482 0.954 1
1 886 . 10 1 1 A 88 88 PRO CA C 86 63.422 62.500 0.922 1
1 887 . 10 1 1 A 88 88 PRO CB C 86 31.925 29.696 2.229 1
1 889 . 10 1 1 A 89 89 SER H H 87 6.044 8.139 -2.095 1
1 890 . 10 1 1 A 89 89 SER HA H 87 4.630 4.851 -0.221 1
1 893 . 10 1 1 A 89 89 SER C C 87 175.612 174.758 0.854 1
1 894 . 10 1 1 A 89 89 SER CA C 87 56.800 56.962 -0.162 1
1 895 . 10 1 1 A 89 89 SER CB C 87 64.196 65.270 -1.074 1
1 896 . 10 1 1 A 89 89 SER N N 87 115.721 117.444 -1.723 1
1 897 . 10 1 1 A 90 90 LEU H H 88 9.702 8.969 0.733 1
1 898 . 10 1 1 A 90 90 LEU HA H 88 4.270 3.959 0.311 1
1 906 . 10 1 1 A 90 90 LEU C C 88 179.173 179.423 -0.250 1
1 907 . 10 1 1 A 90 90 LEU CA C 88 57.402 58.390 -0.988 1
1 908 . 10 1 1 A 90 90 LEU CB C 88 43.642 41.517 2.125 1
1 911 . 10 1 1 A 90 90 LEU N N 88 130.488 129.072 1.416 1
1 912 . 10 1 1 A 91 91 GLY H H 89 8.354 8.411 -0.057 1
1 913 . 10 1 1 A 91 91 GLY HA2 H 89 3.680 3.801 -0.121 1
1 914 . 10 1 1 A 91 91 GLY HA3 H 89 3.584 3.832 -0.248 1
1 915 . 10 1 1 A 91 91 GLY C C 89 175.106 176.694 -1.588 1
1 916 . 10 1 1 A 91 91 GLY CA C 89 47.770 47.281 0.489 1
1 917 . 10 1 1 A 91 91 GLY N N 89 107.522 105.916 1.606 1
1 918 . 10 1 1 A 92 92 VAL H H 90 7.906 7.957 -0.051 1
1 919 . 10 1 1 A 92 92 VAL HA H 90 3.940 3.749 0.191 1
1 927 . 10 1 1 A 92 92 VAL C C 90 178.467 178.029 0.438 1
1 928 . 10 1 1 A 92 92 VAL CA C 90 65.379 66.369 -0.990 1
1 929 . 10 1 1 A 92 92 VAL CB C 90 31.785 31.866 -0.081 1
1 932 . 10 1 1 A 92 92 VAL N N 90 121.741 121.755 -0.014 1
1 933 . 10 1 1 A 93 93 GLY H H 91 7.595 8.212 -0.617 1
1 934 . 10 1 1 A 93 93 GLY HA2 H 91 3.628 3.755 -0.127 1
1 935 . 10 1 1 A 93 93 GLY HA3 H 91 3.415 3.767 -0.352 1
1 936 . 10 1 1 A 93 93 GLY C C 91 174.022 175.301 -1.279 1
1 937 . 10 1 1 A 93 93 GLY CA C 91 48.319 47.462 0.857 1
1 938 . 10 1 1 A 93 93 GLY N N 91 104.629 107.567 -2.938 1
1 939 . 10 1 1 A 94 94 TYR H H 92 8.372 9.618 -1.246 1
1 940 . 10 1 1 A 94 94 TYR HA H 92 4.046 4.019 0.027 1
1 943 . 10 1 1 A 94 94 TYR C C 92 177.458 177.715 -0.257 1
1 944 . 10 1 1 A 94 94 TYR CA C 92 61.760 60.677 1.083 1
1 945 . 10 1 1 A 94 94 TYR CB C 92 38.431 38.483 -0.052 1
1 948 . 10 1 1 A 94 94 TYR N N 92 123.383 123.643 -0.260 1
1 949 . 10 1 1 A 95 95 GLU H H 93 8.424 8.311 0.113 1
1 950 . 10 1 1 A 95 95 GLU HA H 93 3.421 3.901 -0.480 1
1 951 . 10 1 1 A 95 95 GLU C C 93 178.590 178.964 -0.374 1
1 952 . 10 1 1 A 95 95 GLU CA C 93 60.211 59.015 1.196 1
1 953 . 10 1 1 A 95 95 GLU CB C 93 29.025 29.301 -0.276 1
1 954 . 10 1 1 A 95 95 GLU N N 93 120.181 119.885 0.296 1
1 955 . 10 1 1 A 96 96 LEU H H 94 8.210 8.086 0.124 1
1 956 . 10 1 1 A 96 96 LEU HA H 94 3.830 3.983 -0.153 1
1 964 . 10 1 1 A 96 96 LEU C C 94 179.032 179.130 -0.098 1
1 965 . 10 1 1 A 96 96 LEU CA C 94 57.683 58.074 -0.391 1
1 966 . 10 1 1 A 96 96 LEU CB C 94 41.883 41.837 0.046 1
1 970 . 10 1 1 A 96 96 LEU N N 94 118.091 120.025 -1.934 1
1 971 . 10 1 1 A 97 97 GLY H H 95 8.773 8.729 0.044 1
1 972 . 10 1 1 A 97 97 GLY C C 95 175.344 176.043 -0.699 1
1 973 . 10 1 1 A 97 97 GLY CA C 95 47.308 47.070 0.238 1
1 974 . 10 1 1 A 97 97 GLY N N 95 108.085 106.022 2.063 1
1 975 . 10 1 1 A 98 98 ARG H H 96 8.100 8.182 -0.082 1
1 976 . 10 1 1 A 98 98 ARG C C 96 179.692 178.720 0.972 1
1 977 . 10 1 1 A 98 98 ARG CA C 96 56.308 59.534 -3.226 1
1 978 . 10 1 1 A 98 98 ARG CB C 96 26.854 29.871 -3.017 1
1 979 . 10 1 1 A 98 98 ARG N N 96 118.156 121.951 -3.795 1
1 980 . 10 1 1 A 99 99 ALA H H 97 8.498 7.608 0.890 1
1 981 . 10 1 1 A 99 99 ALA HA H 97 3.640 4.012 -0.372 1
1 985 . 10 1 1 A 99 99 ALA C C 97 179.650 179.847 -0.197 1
1 986 . 10 1 1 A 99 99 ALA CA C 97 55.166 54.985 0.181 1
1 987 . 10 1 1 A 99 99 ALA CB C 97 18.604 18.221 0.383 1
1 988 . 10 1 1 A 99 99 ALA N N 97 122.310 121.914 0.396 1
1 989 . 10 1 1 A 100 100 VAL H H 98 8.597 8.470 0.127 1
1 990 . 10 1 1 A 100 100 VAL HA H 98 3.798 3.411 0.387 1
1 998 . 10 1 1 A 100 100 VAL C C 98 180.464 177.986 2.478 1
1 999 . 10 1 1 A 100 100 VAL CA C 98 65.664 66.550 -0.886 1
1 1000 . 10 1 1 A 100 100 VAL CB C 98 31.065 31.203 -0.138 1
1 1003 . 10 1 1 A 100 100 VAL N N 98 120.603 118.649 1.954 1
1 1004 . 10 1 1 A 101 101 ALA H H 99 7.280 7.907 -0.627 1
1 1005 . 10 1 1 A 101 101 ALA HA H 99 3.963 4.061 -0.098 1
1 1009 . 10 1 1 A 101 101 ALA C C 99 179.314 178.773 0.541 1
1 1010 . 10 1 1 A 101 101 ALA CA C 99 54.367 54.864 -0.497 1
1 1011 . 10 1 1 A 101 101 ALA CB C 99 18.139 18.885 -0.746 1
1 1012 . 10 1 1 A 101 101 ALA N N 99 124.450 121.734 2.716 1
1 1013 . 10 1 1 A 102 102 LEU H H 100 7.200 7.567 -0.367 1
1 1014 . 10 1 1 A 102 102 LEU HA H 100 4.192 4.536 -0.344 1
1 1024 . 10 1 1 A 102 102 LEU C C 100 177.306 177.146 0.160 1
1 1025 . 10 1 1 A 102 102 LEU CA C 100 54.808 55.053 -0.245 1
1 1026 . 10 1 1 A 102 102 LEU CB C 100 42.880 44.017 -1.137 1
1 1030 . 10 1 1 A 102 102 LEU N N 100 116.834 111.515 5.319 1
1 1031 . 10 1 1 A 103 103 GLY H H 101 7.891 7.568 0.323 1
1 1032 . 10 1 1 A 103 103 GLY HA2 H 101 3.941 3.842 0.099 1
1 1033 . 10 1 1 A 103 103 GLY HA3 H 101 3.831 3.861 -0.030 1
1 1034 . 10 1 1 A 103 103 GLY C C 101 175.137 174.617 0.520 1
1 1035 . 10 1 1 A 103 103 GLY CA C 101 45.673 46.038 -0.365 1
1 1036 . 10 1 1 A 103 103 GLY N N 101 109.395 107.890 1.505 1
1 1037 . 10 1 1 A 104 104 LYS H H 102 7.337 8.498 -1.161 1
1 1038 . 10 1 1 A 104 104 LYS HA H 102 4.402 4.200 0.202 1
1 1043 . 10 1 1 A 104 104 LYS CA C 102 52.136 61.060 -8.924 1
1 1044 . 10 1 1 A 104 104 LYS CB C 102 31.045 31.562 -0.517 1
1 1047 . 10 1 1 A 104 104 LYS N N 102 118.954 125.864 -6.910 1
1 1048 . 10 1 1 A 105 105 PRO HA H 103 4.781 4.725 0.056 1
1 1054 . 10 1 1 A 105 105 PRO CA C 103 62.791 63.021 -0.230 1
1 1055 . 10 1 1 A 105 105 PRO CB C 103 30.405 31.668 -1.263 1
1 1058 . 10 1 1 A 106 106 ILE H H 104 8.261 8.818 -0.557 1
1 1059 . 10 1 1 A 106 106 ILE HA H 104 4.680 4.853 -0.173 1
1 1069 . 10 1 1 A 106 106 ILE C C 104 175.543 173.818 1.725 1
1 1070 . 10 1 1 A 106 106 ILE CA C 104 59.362 59.830 -0.468 1
1 1071 . 10 1 1 A 106 106 ILE CB C 104 43.738 40.872 2.866 1
1 1075 . 10 1 1 A 106 106 ILE N N 104 123.509 124.748 -1.239 1
1 1076 . 10 1 1 A 107 107 LEU H H 105 8.584 8.672 -0.088 1
1 1077 . 10 1 1 A 107 107 LEU HA H 105 4.243 4.501 -0.258 1
1 1087 . 10 1 1 A 107 107 LEU C C 105 174.204 174.650 -0.446 1
1 1088 . 10 1 1 A 107 107 LEU CA C 105 52.863 53.146 -0.283 1
1 1089 . 10 1 1 A 107 107 LEU CB C 105 42.408 43.358 -0.950 1
1 1093 . 10 1 1 A 107 107 LEU N N 105 131.882 129.729 2.153 1
1 1094 . 10 1 1 A 108 108 CYS H H 106 8.679 8.996 -0.317 1
1 1095 . 10 1 1 A 108 108 CYS HA H 106 5.280 5.318 -0.038 1
1 1099 . 10 1 1 A 108 108 CYS C C 106 173.134 173.510 -0.376 1
1 1100 . 10 1 1 A 108 108 CYS CA C 106 57.290 56.892 0.398 1
1 1101 . 10 1 1 A 108 108 CYS CB C 106 29.559 29.154 0.405 1
1 1102 . 10 1 1 A 108 108 CYS N N 106 122.904 125.826 -2.922 1
1 1103 . 10 1 1 A 109 109 LEU H H 107 8.987 8.873 0.114 1
1 1104 . 10 1 1 A 109 109 LEU HA H 107 5.120 5.611 -0.491 1
1 1112 . 10 1 1 A 109 109 LEU C C 107 174.500 176.124 -1.624 1
1 1113 . 10 1 1 A 109 109 LEU CA C 107 53.274 53.534 -0.260 1
1 1114 . 10 1 1 A 109 109 LEU CB C 107 43.450 44.544 -1.094 1
1 1118 . 10 1 1 A 109 109 LEU N N 107 124.653 124.649 0.004 1
1 1119 . 10 1 1 A 110 110 PHE H H 108 8.981 9.382 -0.401 1
1 1120 . 10 1 1 A 110 110 PHE HA H 108 4.846 6.112 -1.266 1
1 1125 . 10 1 1 A 110 110 PHE C C 108 172.231 172.864 -0.633 1
1 1126 . 10 1 1 A 110 110 PHE CA C 108 55.963 55.329 0.634 1
1 1127 . 10 1 1 A 110 110 PHE CB C 108 43.270 42.500 0.770 1
1 1130 . 10 1 1 A 110 110 PHE N N 108 125.052 123.635 1.417 1
1 1131 . 10 1 1 A 111 111 ARG H H 109 7.461 8.250 -0.789 1
1 1132 . 10 1 1 A 111 111 ARG HA H 109 4.804 4.765 0.039 1
1 1136 . 10 1 1 A 111 111 ARG CA C 109 51.953 51.921 0.032 1
1 1137 . 10 1 1 A 111 111 ARG CB C 109 30.008 30.837 -0.829 1
1 1140 . 10 1 1 A 111 111 ARG N N 109 128.034 121.137 6.897 1
1 1141 . 10 1 1 A 112 112 PRO C C 110 178.675 177.612 1.063 1
1 1142 . 10 1 1 A 112 112 PRO CA C 110 64.024 64.322 -0.298 1
1 1143 . 10 1 1 A 112 112 PRO CB C 110 31.416 31.951 -0.535 1
1 1144 . 10 1 1 A 113 113 GLN H H 111 8.188 8.677 -0.489 1
1 1145 . 10 1 1 A 113 113 GLN HA H 111 4.056 4.034 0.022 1
1 1149 . 10 1 1 A 113 113 GLN C C 111 175.936 177.242 -1.306 1
1 1150 . 10 1 1 A 113 113 GLN CA C 111 57.144 58.257 -1.113 1
1 1151 . 10 1 1 A 113 113 GLN CB C 111 28.033 28.148 -0.115 1
1 1153 . 10 1 1 A 113 113 GLN N N 111 118.835 117.515 1.320 1
1 1154 . 10 1 1 A 114 114 SER H H 112 7.730 7.622 0.108 1
1 1155 . 10 1 1 A 114 114 SER HA H 112 4.037 4.505 -0.468 1
1 1158 . 10 1 1 A 114 114 SER C C 112 175.750 174.655 1.095 1
1 1159 . 10 1 1 A 114 114 SER CA C 112 60.154 58.962 1.192 1
1 1160 . 10 1 1 A 114 114 SER CB C 112 64.282 64.269 0.013 1
1 1161 . 10 1 1 A 114 114 SER N N 112 114.887 113.860 1.027 1
1 1162 . 10 1 1 A 115 115 GLY H H 113 8.005 7.496 0.509 1
1 1163 . 10 1 1 A 115 115 GLY HA2 H 113 3.712 3.975 -0.263 1
1 1164 . 10 1 1 A 115 115 GLY HA3 H 113 4.130 4.071 0.059 1
1 1165 . 10 1 1 A 115 115 GLY C C 113 173.945 175.409 -1.464 1
1 1166 . 10 1 1 A 115 115 GLY CA C 113 45.233 47.059 -1.826 1
1 1167 . 10 1 1 A 115 115 GLY N N 113 110.740 109.636 1.104 1
1 1168 . 10 1 1 A 116 116 ARG H H 114 7.665 8.296 -0.631 1
1 1169 . 10 1 1 A 116 116 ARG HA H 114 4.449 4.231 0.218 1
1 1173 . 10 1 1 A 116 116 ARG C C 114 175.370 175.977 -0.607 1
1 1174 . 10 1 1 A 116 116 ARG CA C 114 55.080 57.840 -2.760 1
1 1175 . 10 1 1 A 116 116 ARG CB C 114 31.215 30.346 0.869 1
1 1178 . 10 1 1 A 116 116 ARG N N 114 119.983 119.389 0.594 1
1 1179 . 10 1 1 A 117 117 VAL H H 115 8.409 8.390 0.019 1
1 1180 . 10 1 1 A 117 117 VAL HA H 115 4.184 3.832 0.352 1
1 1188 . 10 1 1 A 117 117 VAL C C 115 175.980 175.312 0.668 1
1 1189 . 10 1 1 A 117 117 VAL CA C 115 61.167 62.394 -1.227 1
1 1190 . 10 1 1 A 117 117 VAL CB C 115 32.931 30.851 2.080 1
1 1193 . 10 1 1 A 117 117 VAL N N 115 122.240 117.262 4.978 1
1 1194 . 10 1 1 A 118 118 LEU H H 116 8.227 7.592 0.635 1
1 1195 . 10 1 1 A 118 118 LEU HA H 116 3.720 4.094 -0.374 1
1 1204 . 10 1 1 A 118 118 LEU C C 116 175.623 177.149 -1.526 1
1 1205 . 10 1 1 A 118 118 LEU CA C 116 54.555 55.768 -1.213 1
1 1206 . 10 1 1 A 118 118 LEU CB C 116 39.292 41.805 -2.513 1
1 1210 . 10 1 1 A 118 118 LEU N N 116 131.481 126.414 5.067 1
1 1211 . 10 1 1 A 119 119 SER H H 117 7.780 8.787 -1.007 1
1 1212 . 10 1 1 A 119 119 SER HA H 117 4.060 4.383 -0.323 1
1 1214 . 10 1 1 A 119 119 SER C C 117 175.782 175.924 -0.142 1
1 1215 . 10 1 1 A 119 119 SER CA C 117 58.530 58.680 -0.150 1
1 1216 . 10 1 1 A 119 119 SER CB C 117 64.785 63.769 1.016 1
1 1217 . 10 1 1 A 119 119 SER N N 117 118.658 119.968 -1.310 1
1 1218 . 10 1 1 A 120 120 ALA H H 118 8.955 8.967 -0.012 1
1 1219 . 10 1 1 A 120 120 ALA HA H 118 3.846 3.978 -0.132 1
1 1223 . 10 1 1 A 120 120 ALA C C 118 179.731 179.926 -0.195 1
1 1224 . 10 1 1 A 120 120 ALA CA C 118 54.927 55.340 -0.413 1
1 1225 . 10 1 1 A 120 120 ALA CB C 118 18.627 18.302 0.325 1
1 1226 . 10 1 1 A 120 120 ALA N N 118 134.119 130.036 4.083 1
1 1227 . 10 1 1 A 121 121 MET H H 119 7.718 7.787 -0.069 1
1 1228 . 10 1 1 A 121 121 MET HA H 119 4.130 4.168 -0.038 1
1 1235 . 10 1 1 A 121 121 MET C C 119 175.610 178.867 -3.257 1
1 1236 . 10 1 1 A 121 121 MET CA C 119 55.968 58.229 -2.261 1
1 1237 . 10 1 1 A 121 121 MET CB C 119 30.814 33.210 -2.396 1
1 1240 . 10 1 1 A 121 121 MET N N 119 115.424 116.584 -1.160 1
1 1241 . 10 1 1 A 122 122 ILE H H 120 6.451 8.067 -1.616 1
1 1242 . 10 1 1 A 122 122 ILE HA H 120 3.392 3.662 -0.270 1
1 1252 . 10 1 1 A 122 122 ILE C C 120 177.108 177.941 -0.833 1
1 1253 . 10 1 1 A 122 122 ILE CA C 120 59.650 64.266 -4.616 1
1 1254 . 10 1 1 A 122 122 ILE CB C 120 34.640 37.233 -2.593 1
1 1258 . 10 1 1 A 122 122 ILE N N 120 113.418 118.965 -5.547 1
1 1259 . 10 1 1 A 123 123 ARG H H 121 7.540 8.678 -1.138 1
1 1260 . 10 1 1 A 123 123 ARG HA H 121 3.551 3.916 -0.365 1
1 1264 . 10 1 1 A 123 123 ARG C C 121 179.642 178.913 0.729 1
1 1265 . 10 1 1 A 123 123 ARG CA C 121 59.242 59.818 -0.576 1
1 1266 . 10 1 1 A 123 123 ARG CB C 121 29.087 29.651 -0.564 1
1 1269 . 10 1 1 A 123 123 ARG N N 121 116.248 120.773 -4.525 1
1 1270 . 10 1 1 A 124 124 GLY H H 122 8.086 9.005 -0.919 1
1 1271 . 10 1 1 A 124 124 GLY C C 122 172.357 176.228 -3.871 1
1 1272 . 10 1 1 A 124 124 GLY CA C 122 44.836 47.138 -2.302 1
1 1273 . 10 1 1 A 124 124 GLY N N 122 104.381 107.777 -3.396 1
1 1274 . 10 1 1 A 125 125 ALA H H 123 6.411 8.030 -1.619 1
1 1275 . 10 1 1 A 125 125 ALA HA H 123 2.441 3.998 -1.557 1
1 1279 . 10 1 1 A 125 125 ALA C C 123 176.908 177.650 -0.742 1
1 1280 . 10 1 1 A 125 125 ALA CA C 123 51.593 54.572 -2.979 1
1 1281 . 10 1 1 A 125 125 ALA CB C 123 16.997 19.506 -2.509 1
1 1282 . 10 1 1 A 125 125 ALA N N 123 123.136 123.654 -0.518 1
1 1283 . 10 1 1 A 126 126 ALA H H 124 6.190 7.382 -1.192 1
1 1284 . 10 1 1 A 126 126 ALA HA H 124 3.829 4.568 -0.739 1
1 1288 . 10 1 1 A 126 126 ALA C C 124 177.535 175.869 1.666 1
1 1289 . 10 1 1 A 126 126 ALA CA C 124 52.403 52.131 0.272 1
1 1290 . 10 1 1 A 126 126 ALA CB C 124 18.375 22.246 -3.871 1
1 1291 . 10 1 1 A 126 126 ALA N N 124 117.999 114.760 3.239 1
1 1292 . 10 1 1 A 127 127 ASP H H 125 8.877 8.724 0.153 1
1 1293 . 10 1 1 A 127 127 ASP HA H 125 4.665 5.053 -0.388 1
1 1296 . 10 1 1 A 127 127 ASP C C 125 177.795 175.818 1.977 1
1 1297 . 10 1 1 A 127 127 ASP CA C 125 52.855 52.834 0.021 1
1 1298 . 10 1 1 A 127 127 ASP CB C 125 41.814 41.496 0.318 1
1 1299 . 10 1 1 A 127 127 ASP N N 125 121.828 119.475 2.353 1
1 1300 . 10 1 1 A 128 128 GLY H H 126 7.954 7.782 0.172 1
1 1301 . 10 1 1 A 128 128 GLY HA2 H 126 3.830 4.209 -0.379 1
1 1302 . 10 1 1 A 128 128 GLY HA3 H 126 4.249 4.244 0.005 1
1 1303 . 10 1 1 A 128 128 GLY C C 126 173.822 173.381 0.441 1
1 1304 . 10 1 1 A 128 128 GLY CA C 126 45.549 45.861 -0.312 1
1 1305 . 10 1 1 A 128 128 GLY N N 126 108.814 108.207 0.607 1
1 1306 . 10 1 1 A 129 129 SER H H 127 8.547 9.319 -0.772 1
1 1307 . 10 1 1 A 129 129 SER HA H 127 4.486 4.233 0.253 1
1 1309 . 10 1 1 A 129 129 SER C C 127 174.178 173.416 0.762 1
1 1310 . 10 1 1 A 129 129 SER CA C 127 58.653 59.169 -0.516 1
1 1311 . 10 1 1 A 129 129 SER CB C 127 63.316 61.884 1.432 1
1 1312 . 10 1 1 A 129 129 SER N N 127 115.599 119.183 -3.584 1
1 1313 . 10 1 1 A 130 130 ARG H H 128 8.795 8.563 0.232 1
1 1314 . 10 1 1 A 130 130 ARG HA H 128 4.160 3.992 0.168 1
1 1318 . 10 1 1 A 130 130 ARG C C 128 175.518 174.538 0.980 1
1 1319 . 10 1 1 A 130 130 ARG CA C 128 58.479 58.005 0.474 1
1 1320 . 10 1 1 A 130 130 ARG CB C 128 29.952 28.366 1.586 1
1 1323 . 10 1 1 A 130 130 ARG N N 128 127.611 115.486 12.125 1
1 1324 . 10 1 1 A 131 131 PHE H H 129 9.315 8.560 0.755 1
1 1325 . 10 1 1 A 131 131 PHE HA H 129 4.878 4.832 0.046 1
1 1331 . 10 1 1 A 131 131 PHE C C 129 175.058 173.870 1.188 1
1 1332 . 10 1 1 A 131 131 PHE CA C 129 55.953 56.164 -0.211 1
1 1333 . 10 1 1 A 131 131 PHE CB C 129 40.189 41.489 -1.300 1
1 1337 . 10 1 1 A 131 131 PHE N N 129 126.219 120.733 5.486 1
1 1338 . 10 1 1 A 132 132 GLN H H 130 8.160 8.142 0.018 1
1 1339 . 10 1 1 A 132 132 GLN HA H 130 5.013 4.994 0.019 1
1 1343 . 10 1 1 A 132 132 GLN CA C 130 54.498 54.545 -0.047 1
1 1344 . 10 1 1 A 132 132 GLN CB C 130 32.106 32.847 -0.741 1
1 1346 . 10 1 1 A 132 132 GLN N N 130 125.589 125.405 0.184 1
1 1347 . 10 1 1 A 133 133 VAL H H 131 8.689 8.918 -0.229 1
1 1348 . 10 1 1 A 133 133 VAL HA H 131 4.529 4.435 0.094 1
1 1356 . 10 1 1 A 133 133 VAL C C 131 174.441 175.497 -1.056 1
1 1357 . 10 1 1 A 133 133 VAL CA C 131 60.758 61.396 -0.638 1
1 1358 . 10 1 1 A 133 133 VAL CB C 131 32.417 32.357 0.060 1
1 1361 . 10 1 1 A 133 133 VAL N N 131 122.441 123.596 -1.155 1
1 1362 . 10 1 1 A 134 134 TRP H H 132 9.256 9.348 -0.092 1
1 1363 . 10 1 1 A 134 134 TRP HA H 132 5.213 5.186 0.027 1
1 1371 . 10 1 1 A 134 134 TRP C C 132 174.575 175.390 -0.815 1
1 1372 . 10 1 1 A 134 134 TRP CA C 132 53.859 56.565 -2.706 1
1 1373 . 10 1 1 A 134 134 TRP CB C 132 31.311 31.754 -0.443 1
1 1379 . 10 1 1 A 134 134 TRP N N 132 130.303 127.875 2.428 1
1 1381 . 10 1 1 A 135 135 ASP H H 133 8.237 8.892 -0.655 1
1 1382 . 10 1 1 A 135 135 ASP HA H 133 6.018 6.370 -0.352 1
1 1385 . 10 1 1 A 135 135 ASP C C 133 177.020 175.254 1.766 1
1 1386 . 10 1 1 A 135 135 ASP CA C 133 53.321 52.800 0.521 1
1 1387 . 10 1 1 A 135 135 ASP CB C 133 41.514 44.092 -2.578 1
1 1388 . 10 1 1 A 135 135 ASP N N 133 125.516 120.361 5.155 1
1 1389 . 10 1 1 A 136 136 TYR H H 134 9.058 8.988 0.070 1
1 1390 . 10 1 1 A 136 136 TYR HA H 134 4.970 5.286 -0.316 1
1 1394 . 10 1 1 A 136 136 TYR C C 134 172.324 172.963 -0.639 1
1 1395 . 10 1 1 A 136 136 TYR CA C 134 55.982 56.360 -0.378 1
1 1396 . 10 1 1 A 136 136 TYR CB C 134 42.265 40.708 1.557 1
1 1399 . 10 1 1 A 136 136 TYR N N 134 120.315 117.214 3.101 1
1 1400 . 10 1 1 A 137 137 ALA H H 135 8.521 8.666 -0.145 1
1 1401 . 10 1 1 A 137 137 ALA HA H 135 4.280 4.257 0.023 1
1 1405 . 10 1 1 A 137 137 ALA C C 135 178.561 177.134 1.427 1
1 1406 . 10 1 1 A 137 137 ALA CA C 135 49.550 50.921 -1.371 1
1 1407 . 10 1 1 A 137 137 ALA CB C 135 19.998 22.715 -2.717 1
1 1408 . 10 1 1 A 137 137 ALA N N 135 123.386 121.314 2.072 1
1 1409 . 10 1 1 A 138 138 GLU H H 136 8.678 8.501 0.177 1
1 1410 . 10 1 1 A 138 138 GLU HA H 136 3.777 4.361 -0.584 1
1 1414 . 10 1 1 A 138 138 GLU C C 136 177.624 177.213 0.411 1
1 1415 . 10 1 1 A 138 138 GLU CA C 136 60.527 58.437 2.090 1
1 1416 . 10 1 1 A 138 138 GLU CB C 136 29.020 29.212 -0.192 1
1 1418 . 10 1 1 A 138 138 GLU N N 136 121.774 119.025 2.749 1
1 1419 . 10 1 1 A 139 139 GLY H H 137 8.666 9.100 -0.434 1
1 1420 . 10 1 1 A 139 139 GLY HA2 H 137 3.872 4.011 -0.139 1
1 1421 . 10 1 1 A 139 139 GLY HA3 H 137 3.872 4.020 -0.148 1
1 1422 . 10 1 1 A 139 139 GLY C C 137 175.122 175.003 0.119 1
1 1423 . 10 1 1 A 139 139 GLY CA C 137 46.093 45.421 0.672 1
1 1424 . 10 1 1 A 139 139 GLY N N 137 106.053 108.398 -2.345 1
1 1425 . 10 1 1 A 140 140 GLU H H 138 8.305 8.346 -0.041 1
1 1426 . 10 1 1 A 140 140 GLU HA H 138 4.754 4.707 0.047 1
1 1430 . 10 1 1 A 140 140 GLU C C 138 177.819 177.616 0.203 1
1 1431 . 10 1 1 A 140 140 GLU CA C 138 55.049 55.737 -0.688 1
1 1432 . 10 1 1 A 140 140 GLU CB C 138 30.504 30.652 -0.148 1
1 1434 . 10 1 1 A 140 140 GLU N N 138 117.485 116.574 0.911 1
1 1435 . 10 1 1 A 141 141 VAL H H 139 7.267 7.303 -0.036 1
1 1436 . 10 1 1 A 141 141 VAL HA H 139 3.422 3.937 -0.515 1
1 1444 . 10 1 1 A 141 141 VAL C C 139 175.454 177.463 -2.009 1
1 1445 . 10 1 1 A 141 141 VAL CA C 139 66.769 65.100 1.669 1
1 1446 . 10 1 1 A 141 141 VAL CB C 139 31.377 31.613 -0.236 1
1 1449 . 10 1 1 A 141 141 VAL N N 139 120.764 121.158 -0.394 1
1 1450 . 10 1 1 A 142 142 GLU H H 140 8.620 8.261 0.359 1
1 1451 . 10 1 1 A 142 142 GLU HA H 140 3.592 4.142 -0.550 1
1 1452 . 10 1 1 A 142 142 GLU C C 140 177.320 179.169 -1.849 1
1 1453 . 10 1 1 A 142 142 GLU CA C 140 62.607 59.603 3.004 1
1 1454 . 10 1 1 A 142 142 GLU CB C 140 26.759 29.437 -2.678 1
1 1455 . 10 1 1 A 142 142 GLU N N 140 120.048 121.127 -1.079 1
1 1456 . 10 1 1 A 143 143 THR H H 141 7.449 8.380 -0.931 1
1 1457 . 10 1 1 A 143 143 THR HA H 141 4.003 4.071 -0.068 1
1 1462 . 10 1 1 A 143 143 THR C C 141 177.258 176.270 0.988 1
1 1463 . 10 1 1 A 143 143 THR CA C 141 65.490 67.110 -1.620 1
1 1464 . 10 1 1 A 143 143 THR CB C 141 68.641 68.653 -0.012 1
1 1466 . 10 1 1 A 143 143 THR N N 141 114.073 117.160 -3.087 1
1 1467 . 10 1 1 A 144 144 MET H H 142 7.992 8.211 -0.219 1
1 1468 . 10 1 1 A 144 144 MET HA H 142 4.316 4.424 -0.108 1
1 1476 . 10 1 1 A 144 144 MET C C 142 178.233 178.832 -0.599 1
1 1477 . 10 1 1 A 144 144 MET CA C 142 57.743 59.169 -1.426 1
1 1478 . 10 1 1 A 144 144 MET CB C 142 31.326 32.975 -1.649 1
1 1481 . 10 1 1 A 144 144 MET N N 142 120.595 117.794 2.801 1
1 1482 . 10 1 1 A 145 145 LEU H H 143 7.847 8.373 -0.526 1
1 1483 . 10 1 1 A 145 145 LEU HA H 143 3.919 3.899 0.020 1
1 1491 . 10 1 1 A 145 145 LEU C C 143 178.774 179.114 -0.340 1
1 1492 . 10 1 1 A 145 145 LEU CA C 143 57.877 58.276 -0.399 1
1 1493 . 10 1 1 A 145 145 LEU CB C 143 40.951 41.697 -0.746 1
1 1497 . 10 1 1 A 145 145 LEU N N 143 119.410 119.863 -0.453 1
1 1498 . 10 1 1 A 146 146 ASP H H 144 8.431 8.493 -0.062 1
1 1499 . 10 1 1 A 146 146 ASP HA H 144 4.312 4.537 -0.225 1
1 1502 . 10 1 1 A 146 146 ASP C C 144 178.129 178.903 -0.774 1
1 1503 . 10 1 1 A 146 146 ASP CA C 144 57.464 57.901 -0.437 1
1 1504 . 10 1 1 A 146 146 ASP CB C 144 39.548 41.443 -1.895 1
1 1505 . 10 1 1 A 146 146 ASP N N 144 119.837 120.120 -0.283 1
1 1506 . 10 1 1 A 147 147 ARG H H 145 7.949 8.451 -0.502 1
1 1507 . 10 1 1 A 147 147 ARG HA H 145 4.050 4.300 -0.250 1
1 1512 . 10 1 1 A 147 147 ARG C C 145 179.547 178.880 0.667 1
1 1513 . 10 1 1 A 147 147 ARG CA C 145 58.972 59.648 -0.676 1
1 1514 . 10 1 1 A 147 147 ARG CB C 145 29.798 30.614 -0.816 1
1 1517 . 10 1 1 A 147 147 ARG N N 145 119.173 119.371 -0.198 1
1 1518 . 10 1 1 A 148 148 TYR H H 146 8.128 8.393 -0.265 1
1 1519 . 10 1 1 A 148 148 TYR HA H 146 3.995 4.399 -0.404 1
1 1524 . 10 1 1 A 148 148 TYR C C 146 178.199 177.599 0.600 1
1 1525 . 10 1 1 A 148 148 TYR CA C 146 62.347 61.419 0.928 1
1 1526 . 10 1 1 A 148 148 TYR CB C 146 37.418 37.590 -0.172 1
1 1529 . 10 1 1 A 148 148 TYR N N 146 120.102 121.059 -0.957 1
1 1530 . 10 1 1 A 149 149 PHE H H 147 8.308 8.758 -0.450 1
1 1531 . 10 1 1 A 149 149 PHE HA H 147 4.013 4.431 -0.418 1
1 1535 . 10 1 1 A 149 149 PHE C C 147 177.574 178.442 -0.868 1
1 1536 . 10 1 1 A 149 149 PHE CA C 147 63.044 61.726 1.318 1
1 1537 . 10 1 1 A 149 149 PHE CB C 147 37.153 38.164 -1.011 1
1 1541 . 10 1 1 A 149 149 PHE N N 147 116.680 118.380 -1.700 1
1 1542 . 10 1 1 A 150 150 GLU H H 148 8.271 9.167 -0.896 1
1 1543 . 10 1 1 A 150 150 GLU HA H 148 4.030 3.989 0.041 1
1 1547 . 10 1 1 A 150 150 GLU C C 148 177.687 178.066 -0.379 1
1 1548 . 10 1 1 A 150 150 GLU CA C 148 58.746 60.026 -1.280 1
1 1549 . 10 1 1 A 150 150 GLU CB C 148 28.847 29.284 -0.437 1
1 1551 . 10 1 1 A 150 150 GLU N N 148 119.973 119.269 0.704 1
1 1552 . 10 1 1 A 151 151 ALA H H 149 6.992 7.692 -0.700 1
1 1553 . 10 1 1 A 151 151 ALA HA H 149 4.217 4.274 -0.057 1
1 1557 . 10 1 1 A 151 151 ALA C C 149 178.190 177.398 0.792 1
1 1558 . 10 1 1 A 151 151 ALA CA C 149 52.779 52.506 0.273 1
1 1559 . 10 1 1 A 151 151 ALA CB C 149 19.087 19.000 0.087 1
1 1560 . 10 1 1 A 151 151 ALA N N 149 118.629 120.657 -2.028 1
1 1561 . 10 1 1 A 152 152 TYR H H 150 7.722 8.973 -1.251 1
1 1562 . 10 1 1 A 152 152 TYR HA H 150 4.137 4.827 -0.690 1
1 1567 . 10 1 1 A 152 152 TYR C C 150 175.703 175.816 -0.113 1
1 1568 . 10 1 1 A 152 152 TYR CA C 150 59.260 58.873 0.387 1
1 1569 . 10 1 1 A 152 152 TYR CB C 150 39.165 41.615 -2.450 1
1 1572 . 10 1 1 A 152 152 TYR N N 150 118.767 118.048 0.719 1
1 1573 . 10 1 1 A 153 153 LEU H H 151 7.670 9.383 -1.713 1
1 1574 . 10 1 1 A 153 153 LEU HA H 151 4.145 4.849 -0.704 1
1 1584 . 10 1 1 A 153 153 LEU CA C 151 54.704 52.969 1.735 1
1 1585 . 10 1 1 A 153 153 LEU CB C 151 40.520 42.647 -2.127 1
1 1589 . 10 1 1 A 153 153 LEU N N 151 122.313 118.489 3.824 1
1 1590 . 10 1 1 A 154 154 PRO HA H 152 4.258 4.668 -0.410 1
1 1597 . 10 1 1 A 154 154 PRO C C 152 177.496 177.705 -0.209 1
1 1598 . 10 1 1 A 154 154 PRO CA C 152 63.899 63.362 0.537 1
1 1599 . 10 1 1 A 154 154 PRO CB C 152 31.080 31.627 -0.547 1
1 1602 . 10 1 1 A 155 155 GLN H H 153 8.023 8.833 -0.810 1
1 1603 . 10 1 1 A 155 155 GLN HA H 153 4.176 3.897 0.279 1
1 1607 . 10 1 1 A 155 155 GLN C C 153 176.636 176.079 0.557 1
1 1608 . 10 1 1 A 155 155 GLN CA C 153 55.968 58.104 -2.136 1
1 1609 . 10 1 1 A 155 155 GLN CB C 153 28.723 26.368 2.355 1
1 1610 . 10 1 1 A 155 155 GLN N N 153 119.173 118.469 0.704 1
1 1611 . 10 1 1 A 156 156 LYS H H 154 8.113 8.877 -0.764 1
1 1612 . 10 1 1 A 156 156 LYS HA H 154 4.196 4.176 0.020 1
1 1619 . 10 1 1 A 156 156 LYS C C 154 56.493 178.876 -122.383 1
1 1620 . 10 1 1 A 156 156 LYS CA C 154 56.493 58.837 -2.344 1
1 1621 . 10 1 1 A 156 156 LYS CB C 154 32.037 32.141 -0.104 1
1 1625 . 10 1 1 A 156 156 LYS N N 154 122.788 119.360 3.428 1
1 1626 . 10 1 1 A 157 157 THR H H 155 8.013 7.798 0.215 1
1 1627 . 10 1 1 A 157 157 THR HA H 155 4.183 4.022 0.161 1
1 1632 . 10 1 1 A 157 157 THR C C 155 174.580 175.348 -0.768 1
1 1633 . 10 1 1 A 157 157 THR CA C 155 61.958 65.754 -3.796 1
1 1634 . 10 1 1 A 157 157 THR CB C 155 69.665 68.522 1.143 1
1 1636 . 10 1 1 A 157 157 THR N N 155 115.504 116.015 -0.511 1
1 1637 . 10 1 1 A 158 158 ALA H H 156 8.170 7.628 0.542 1
1 1638 . 10 1 1 A 158 158 ALA HA H 156 4.220 4.461 -0.241 1
1 1642 . 10 1 1 A 158 158 ALA CA C 156 52.492 52.194 0.298 1
1 1643 . 10 1 1 A 158 158 ALA CB C 156 18.810 21.174 -2.364 1
1 1644 . 10 1 1 A 158 158 ALA N N 156 126.825 119.821 7.004 1
1 1645 . 10 1 1 A 159 159 SER H H 157 7.762 8.404 -0.642 1
1 1646 . 10 1 1 A 159 159 SER CA C 157 58.230 58.245 -0.015 1
1 1647 . 10 1 1 A 159 159 SER CB C 157 63.440 63.167 0.273 1
1 1648 . 10 1 1 A 159 159 SER N N 157 123.078 113.738 9.340 1
1 1649 . 10 1 1 A 162 162 HIS HA H 160 4.845 4.077 0.768 1
1 1652 . 10 1 1 A 162 162 HIS CA C 160 53.590 56.488 -2.898 1
1 1653 . 10 1 1 A 162 162 HIS CB C 160 29.398 27.674 1.724 1
1 1654 . 10 1 1 A 163 163 PRO HA H 161 4.388 4.311 0.077 1
1 1660 . 10 1 1 A 163 163 PRO C C 161 177.018 176.914 0.104 1
1 1661 . 10 1 1 A 163 163 PRO CA C 161 63.118 65.084 -1.966 1
1 1662 . 10 1 1 A 163 163 PRO CB C 161 31.668 31.793 -0.125 1
1 1665 . 10 1 1 A 164 164 SER H H 162 8.418 7.778 0.640 1
1 1666 . 10 1 1 A 164 164 SER HA H 162 4.338 4.444 -0.106 1
1 1668 . 10 1 1 A 164 164 SER C C 162 173.327 174.782 -1.455 1
1 1669 . 10 1 1 A 164 164 SER CA C 162 58.202 57.430 0.772 1
1 1670 . 10 1 1 A 164 164 SER CB C 162 64.080 65.008 -0.928 1
1 1671 . 10 1 1 A 164 164 SER N N 162 117.485 112.719 4.766 1
1 6 . 11 1 1 A 4 4 ALA H H 2 8.270 7.891 0.379 1
1 7 . 11 1 1 A 4 4 ALA HA H 2 4.212 4.484 -0.272 1
1 11 . 11 1 1 A 4 4 ALA C C 2 177.441 177.183 0.258 1
1 12 . 11 1 1 A 4 4 ALA CA C 2 52.280 53.306 -1.026 1
1 13 . 11 1 1 A 4 4 ALA CB C 2 18.880 21.424 -2.544 1
1 14 . 11 1 1 A 4 4 ALA N N 2 126.500 120.117 6.383 1
1 15 . 11 1 1 A 5 5 ALA H H 3 8.251 7.558 0.693 1
1 16 . 11 1 1 A 5 5 ALA HA H 3 4.261 4.324 -0.063 1
1 20 . 11 1 1 A 5 5 ALA C C 3 177.824 178.404 -0.580 1
1 21 . 11 1 1 A 5 5 ALA CA C 3 52.347 52.307 0.040 1
1 22 . 11 1 1 A 5 5 ALA CB C 3 18.869 19.986 -1.117 1
1 23 . 11 1 1 A 5 5 ALA N N 3 124.322 120.313 4.009 1
1 24 . 11 1 1 A 6 6 SER H H 4 8.158 8.614 -0.456 1
1 25 . 11 1 1 A 6 6 SER HA H 4 4.358 4.162 0.196 1
1 27 . 11 1 1 A 6 6 SER C C 4 175.222 174.476 0.746 1
1 28 . 11 1 1 A 6 6 SER CA C 4 58.438 60.676 -2.238 1
1 29 . 11 1 1 A 6 6 SER CB C 4 63.859 63.518 0.341 1
1 30 . 11 1 1 A 6 6 SER N N 4 115.338 113.248 2.090 1
1 31 . 11 1 1 A 7 7 GLY H H 5 8.265 7.285 0.980 1
1 32 . 11 1 1 A 7 7 GLY HA2 H 5 3.900 4.038 -0.138 1
1 33 . 11 1 1 A 7 7 GLY C C 5 174.083 172.052 2.031 1
1 34 . 11 1 1 A 7 7 GLY CA C 5 45.113 45.697 -0.584 1
1 35 . 11 1 1 A 7 7 GLY N N 5 111.360 107.830 3.530 1
1 36 . 11 1 1 A 8 8 GLU H H 6 8.100 8.551 -0.451 1
1 37 . 11 1 1 A 8 8 GLU HA H 6 4.209 4.286 -0.077 1
1 41 . 11 1 1 A 8 8 GLU C C 6 176.354 176.565 -0.211 1
1 42 . 11 1 1 A 8 8 GLU CA C 6 56.261 57.119 -0.858 1
1 43 . 11 1 1 A 8 8 GLU CB C 6 29.830 30.449 -0.619 1
1 45 . 11 1 1 A 8 8 GLU N N 6 121.056 120.256 0.800 1
1 46 . 11 1 1 A 9 9 GLN H H 7 8.287 8.546 -0.259 1
1 47 . 11 1 1 A 9 9 GLN HA H 7 4.247 4.542 -0.295 1
1 51 . 11 1 1 A 9 9 GLN C C 7 172.457 175.389 -2.932 1
1 52 . 11 1 1 A 9 9 GLN CA C 7 55.269 54.805 0.464 1
1 53 . 11 1 1 A 9 9 GLN CB C 7 29.236 30.482 -1.246 1
1 55 . 11 1 1 A 9 9 GLN N N 7 122.164 122.104 0.060 1
1 56 . 11 1 1 A 10 10 ALA H H 8 8.368 8.239 0.129 1
1 57 . 11 1 1 A 10 10 ALA HA H 8 4.509 4.404 0.105 1
1 61 . 11 1 1 A 10 10 ALA CA C 8 50.341 51.157 -0.816 1
1 62 . 11 1 1 A 10 10 ALA CB C 8 18.140 17.935 0.205 1
1 63 . 11 1 1 A 10 10 ALA N N 8 128.028 123.266 4.762 1
1 64 . 11 1 1 A 11 11 PRO HA H 9 4.437 4.476 -0.039 1
1 70 . 11 1 1 A 11 11 PRO C C 9 176.381 176.287 0.094 1
1 71 . 11 1 1 A 11 11 PRO CA C 9 63.298 62.365 0.933 1
1 72 . 11 1 1 A 11 11 PRO CB C 9 31.776 33.204 -1.428 1
1 75 . 11 1 1 A 12 12 CYS H H 10 8.056 8.298 -0.242 1
1 76 . 11 1 1 A 12 12 CYS HA H 10 4.717 5.093 -0.376 1
1 79 . 11 1 1 A 12 12 CYS C C 10 173.266 173.415 -0.149 1
1 80 . 11 1 1 A 12 12 CYS CA C 10 57.398 57.002 0.396 1
1 81 . 11 1 1 A 12 12 CYS CB C 10 29.165 30.357 -1.192 1
1 82 . 11 1 1 A 12 12 CYS N N 10 118.295 117.278 1.017 1
1 83 . 11 1 1 A 13 13 SER H H 11 9.815 8.758 1.057 1
1 84 . 11 1 1 A 13 13 SER HA H 11 5.227 5.572 -0.345 1
1 87 . 11 1 1 A 13 13 SER C C 11 173.648 173.700 -0.052 1
1 88 . 11 1 1 A 13 13 SER CA C 11 57.630 57.880 -0.250 1
1 89 . 11 1 1 A 13 13 SER CB C 11 64.820 64.840 -0.020 1
1 90 . 11 1 1 A 13 13 SER N N 11 122.365 117.654 4.711 1
1 91 . 11 1 1 A 14 14 VAL H H 12 9.352 9.442 -0.090 1
1 92 . 11 1 1 A 14 14 VAL HA H 12 4.696 4.996 -0.300 1
1 100 . 11 1 1 A 14 14 VAL C C 12 173.875 174.191 -0.316 1
1 101 . 11 1 1 A 14 14 VAL CA C 12 60.146 61.152 -1.006 1
1 102 . 11 1 1 A 14 14 VAL CB C 12 34.499 33.208 1.291 1
1 105 . 11 1 1 A 14 14 VAL N N 12 126.378 126.818 -0.440 1
1 106 . 11 1 1 A 15 15 TYR H H 13 8.745 9.452 -0.707 1
1 111 . 11 1 1 A 15 15 TYR C C 13 173.345 174.241 -0.896 1
1 112 . 11 1 1 A 15 15 TYR CA C 13 56.186 57.011 -0.825 1
1 113 . 11 1 1 A 15 15 TYR CB C 13 40.858 39.872 0.986 1
1 116 . 11 1 1 A 15 15 TYR N N 13 129.472 128.337 1.135 1
1 117 . 11 1 1 A 16 16 PHE H H 14 7.370 8.549 -1.179 1
1 118 . 11 1 1 A 16 16 PHE HA H 14 5.720 4.628 1.092 1
1 123 . 11 1 1 A 16 16 PHE C C 14 174.058 173.874 0.184 1
1 124 . 11 1 1 A 16 16 PHE CA C 14 54.361 57.416 -3.055 1
1 125 . 11 1 1 A 16 16 PHE CB C 14 40.461 39.668 0.793 1
1 129 . 11 1 1 A 16 16 PHE N N 14 128.263 129.363 -1.100 1
1 130 . 11 1 1 A 17 17 CYS H H 15 8.147 8.209 -0.062 1
1 131 . 11 1 1 A 17 17 CYS CA C 15 56.570 56.880 -0.310 1
1 132 . 11 1 1 A 17 17 CYS CB C 15 29.690 29.906 -0.216 1
1 133 . 11 1 1 A 17 17 CYS N N 15 126.188 127.413 -1.225 1
1 134 . 11 1 1 A 18 18 GLY HA2 H 16 3.819 4.011 -0.192 1
1 135 . 11 1 1 A 18 18 GLY C C 16 173.374 173.496 -0.122 1
1 136 . 11 1 1 A 18 18 GLY CA C 16 45.510 45.608 -0.098 1
1 137 . 11 1 1 A 19 19 SER H H 17 8.533 8.740 -0.207 1
1 138 . 11 1 1 A 19 19 SER HA H 17 4.505 4.419 0.086 1
1 139 . 11 1 1 A 19 19 SER CA C 17 58.700 59.126 -0.426 1
1 140 . 11 1 1 A 19 19 SER CB C 17 63.810 63.589 0.221 1
1 141 . 11 1 1 A 19 19 SER N N 17 117.300 120.129 -2.829 1
1 142 . 11 1 1 A 20 20 ILE HA H 18 4.309 4.407 -0.098 1
1 152 . 11 1 1 A 20 20 ILE CA C 18 61.317 60.773 0.544 1
1 153 . 11 1 1 A 20 20 ILE CB C 18 38.302 39.076 -0.774 1
1 157 . 11 1 1 A 21 21 ARG HA H 19 4.172 3.980 0.192 1
1 160 . 11 1 1 A 21 21 ARG C C 19 177.118 176.014 1.104 1
1 161 . 11 1 1 A 21 21 ARG CA C 19 56.960 56.891 0.069 1
1 162 . 11 1 1 A 21 21 ARG CB C 19 29.568 29.394 0.174 1
1 165 . 11 1 1 A 22 22 GLY H H 20 8.685 8.052 0.633 1
1 166 . 11 1 1 A 22 22 GLY HA2 H 20 3.801 4.067 -0.266 1
1 167 . 11 1 1 A 22 22 GLY HA3 H 20 3.923 4.084 -0.161 1
1 168 . 11 1 1 A 22 22 GLY C C 20 174.814 174.900 -0.086 1
1 169 . 11 1 1 A 22 22 GLY CA C 20 45.289 45.561 -0.272 1
1 170 . 11 1 1 A 22 22 GLY N N 20 110.145 111.511 -1.366 1
1 171 . 11 1 1 A 23 23 GLY H H 21 8.058 7.618 0.440 1
1 172 . 11 1 1 A 23 23 GLY HA2 H 21 3.998 3.979 0.019 1
1 173 . 11 1 1 A 23 23 GLY HA3 H 21 4.237 3.984 0.253 1
1 174 . 11 1 1 A 23 23 GLY C C 21 174.762 175.634 -0.872 1
1 175 . 11 1 1 A 23 23 GLY CA C 21 45.025 45.503 -0.478 1
1 176 . 11 1 1 A 23 23 GLY N N 21 109.327 106.865 2.462 1
1 177 . 11 1 1 A 24 24 ARG H H 22 8.376 8.033 0.343 1
1 178 . 11 1 1 A 24 24 ARG HA H 22 4.086 3.862 0.224 1
1 184 . 11 1 1 A 24 24 ARG C C 22 178.178 175.943 2.235 1
1 185 . 11 1 1 A 24 24 ARG CA C 22 57.471 57.906 -0.435 1
1 186 . 11 1 1 A 24 24 ARG CB C 22 29.653 27.883 1.770 1
1 189 . 11 1 1 A 24 24 ARG N N 22 120.861 114.786 6.075 1
1 190 . 11 1 1 A 25 25 GLU H H 23 8.831 8.464 0.367 1
1 191 . 11 1 1 A 25 25 GLU HA H 23 4.015 3.999 0.016 1
1 195 . 11 1 1 A 25 25 GLU C C 23 178.005 179.039 -1.034 1
1 196 . 11 1 1 A 25 25 GLU CA C 23 58.920 59.523 -0.603 1
1 197 . 11 1 1 A 25 25 GLU CB C 23 28.592 29.227 -0.635 1
1 199 . 11 1 1 A 25 25 GLU N N 23 121.243 118.843 2.400 1
1 200 . 11 1 1 A 26 26 ASP H H 24 7.897 8.214 -0.317 1
1 201 . 11 1 1 A 26 26 ASP HA H 24 4.516 4.156 0.360 1
1 203 . 11 1 1 A 26 26 ASP C C 24 176.455 178.093 -1.638 1
1 204 . 11 1 1 A 26 26 ASP CA C 24 55.122 56.178 -1.056 1
1 205 . 11 1 1 A 26 26 ASP CB C 24 39.888 40.103 -0.215 1
1 206 . 11 1 1 A 26 26 ASP N N 24 119.541 119.212 0.329 1
1 207 . 11 1 1 A 27 27 GLN H H 25 7.696 8.293 -0.597 1
1 208 . 11 1 1 A 27 27 GLN HA H 25 3.704 3.711 -0.007 1
1 212 . 11 1 1 A 27 27 GLN C C 25 177.016 177.834 -0.818 1
1 213 . 11 1 1 A 27 27 GLN CA C 25 59.501 58.433 1.068 1
1 214 . 11 1 1 A 27 27 GLN CB C 25 27.762 28.802 -1.040 1
1 216 . 11 1 1 A 27 27 GLN N N 25 119.471 120.068 -0.597 1
1 217 . 11 1 1 A 28 28 ALA H H 26 8.227 7.801 0.426 1
1 218 . 11 1 1 A 28 28 ALA HA H 26 4.072 4.153 -0.081 1
1 222 . 11 1 1 A 28 28 ALA C C 26 180.567 179.921 0.646 1
1 223 . 11 1 1 A 28 28 ALA CA C 26 54.627 55.089 -0.462 1
1 224 . 11 1 1 A 28 28 ALA CB C 26 17.355 17.932 -0.577 1
1 225 . 11 1 1 A 28 28 ALA N N 26 122.362 121.954 0.408 1
1 226 . 11 1 1 A 29 29 LEU H H 27 7.533 7.741 -0.208 1
1 227 . 11 1 1 A 29 29 LEU HA H 27 4.050 4.077 -0.027 1
1 237 . 11 1 1 A 29 29 LEU C C 27 178.752 177.930 0.822 1
1 238 . 11 1 1 A 29 29 LEU CA C 27 57.578 57.691 -0.113 1
1 239 . 11 1 1 A 29 29 LEU CB C 27 40.734 41.665 -0.931 1
1 243 . 11 1 1 A 29 29 LEU N N 27 122.255 119.830 2.425 1
1 244 . 11 1 1 A 30 30 TYR H H 28 8.473 8.147 0.326 1
1 245 . 11 1 1 A 30 30 TYR HA H 28 4.049 4.300 -0.251 1
1 250 . 11 1 1 A 30 30 TYR C C 28 177.736 178.329 -0.593 1
1 251 . 11 1 1 A 30 30 TYR CA C 28 59.817 60.225 -0.408 1
1 252 . 11 1 1 A 30 30 TYR CB C 28 36.140 37.191 -1.051 1
1 255 . 11 1 1 A 30 30 TYR N N 28 120.403 118.542 1.861 1
1 256 . 11 1 1 A 31 31 ALA H H 29 8.008 8.613 -0.605 1
1 257 . 11 1 1 A 31 31 ALA HA H 29 4.005 3.968 0.037 1
1 261 . 11 1 1 A 31 31 ALA C C 29 180.879 179.696 1.183 1
1 262 . 11 1 1 A 31 31 ALA CA C 29 54.914 55.279 -0.365 1
1 263 . 11 1 1 A 31 31 ALA CB C 29 17.375 18.136 -0.761 1
1 264 . 11 1 1 A 31 31 ALA N N 29 120.771 122.884 -2.113 1
1 265 . 11 1 1 A 32 32 ARG H H 30 7.596 7.613 -0.017 1
1 266 . 11 1 1 A 32 32 ARG HA H 30 3.916 4.199 -0.283 1
1 273 . 11 1 1 A 32 32 ARG C C 30 179.919 178.617 1.302 1
1 274 . 11 1 1 A 32 32 ARG CA C 30 59.014 59.052 -0.038 1
1 275 . 11 1 1 A 32 32 ARG CB C 30 30.531 29.859 0.672 1
1 278 . 11 1 1 A 32 32 ARG N N 30 120.365 118.034 2.331 1
1 279 . 11 1 1 A 33 33 ILE H H 31 8.066 8.615 -0.549 1
1 280 . 11 1 1 A 33 33 ILE HA H 31 3.120 3.749 -0.629 1
1 290 . 11 1 1 A 33 33 ILE C C 31 177.051 178.594 -1.543 1
1 291 . 11 1 1 A 33 33 ILE CA C 31 65.757 65.289 0.468 1
1 292 . 11 1 1 A 33 33 ILE CB C 31 36.928 37.945 -1.017 1
1 296 . 11 1 1 A 33 33 ILE N N 31 121.608 119.599 2.009 1
1 297 . 11 1 1 A 34 34 VAL H H 32 8.148 9.260 -1.112 1
1 298 . 11 1 1 A 34 34 VAL HA H 32 2.954 3.683 -0.729 1
1 306 . 11 1 1 A 34 34 VAL C C 32 177.159 178.364 -1.205 1
1 307 . 11 1 1 A 34 34 VAL CA C 32 67.220 66.478 0.742 1
1 308 . 11 1 1 A 34 34 VAL CB C 32 31.039 31.045 -0.006 1
1 311 . 11 1 1 A 34 34 VAL N N 32 119.318 120.981 -1.663 1
1 312 . 11 1 1 A 35 35 SER H H 33 7.826 8.416 -0.590 1
1 313 . 11 1 1 A 35 35 SER HA H 33 3.868 4.091 -0.223 1
1 316 . 11 1 1 A 35 35 SER C C 33 176.779 176.514 0.265 1
1 317 . 11 1 1 A 35 35 SER CA C 33 62.000 61.845 0.155 1
1 318 . 11 1 1 A 35 35 SER CB C 33 62.789 62.850 -0.061 1
1 319 . 11 1 1 A 35 35 SER N N 33 111.936 116.550 -4.614 1
1 320 . 11 1 1 A 36 36 ARG H H 34 7.405 7.494 -0.089 1
1 321 . 11 1 1 A 36 36 ARG HA H 34 4.070 4.101 -0.031 1
1 323 . 11 1 1 A 36 36 ARG C C 34 178.047 178.505 -0.458 1
1 324 . 11 1 1 A 36 36 ARG CA C 34 56.108 59.072 -2.964 1
1 325 . 11 1 1 A 36 36 ARG CB C 34 28.837 30.249 -1.412 1
1 326 . 11 1 1 A 36 36 ARG N N 34 120.909 122.072 -1.163 1
1 327 . 11 1 1 A 37 37 LEU H H 35 8.301 8.168 0.133 1
1 328 . 11 1 1 A 37 37 LEU HA H 35 3.620 3.670 -0.050 1
1 336 . 11 1 1 A 37 37 LEU C C 35 178.446 179.198 -0.752 1
1 337 . 11 1 1 A 37 37 LEU CA C 35 57.640 57.896 -0.256 1
1 338 . 11 1 1 A 37 37 LEU CB C 35 41.584 41.764 -0.180 1
1 342 . 11 1 1 A 37 37 LEU N N 35 118.567 119.919 -1.352 1
1 343 . 11 1 1 A 38 38 ARG H H 36 7.379 8.330 -0.951 1
1 344 . 11 1 1 A 38 38 ARG HA H 36 4.340 3.975 0.365 1
1 350 . 11 1 1 A 38 38 ARG C C 36 177.895 178.435 -0.540 1
1 351 . 11 1 1 A 38 38 ARG CA C 36 57.785 58.945 -1.160 1
1 352 . 11 1 1 A 38 38 ARG CB C 36 29.775 29.629 0.146 1
1 355 . 11 1 1 A 38 38 ARG N N 36 115.352 120.066 -4.714 1
1 356 . 11 1 1 A 39 39 ARG H H 37 7.240 8.036 -0.796 1
1 357 . 11 1 1 A 39 39 ARG HA H 37 3.743 4.194 -0.451 1
1 363 . 11 1 1 A 39 39 ARG C C 37 176.988 178.640 -1.652 1
1 364 . 11 1 1 A 39 39 ARG CA C 37 57.605 57.655 -0.050 1
1 365 . 11 1 1 A 39 39 ARG CB C 37 28.925 30.131 -1.206 1
1 368 . 11 1 1 A 39 39 ARG N N 37 117.410 118.982 -1.572 1
1 369 . 11 1 1 A 40 40 TYR H H 38 7.296 8.016 -0.720 1
1 370 . 11 1 1 A 40 40 TYR HA H 38 4.319 4.192 0.127 1
1 375 . 11 1 1 A 40 40 TYR C C 38 175.001 176.072 -1.071 1
1 376 . 11 1 1 A 40 40 TYR CA C 38 57.730 60.306 -2.576 1
1 377 . 11 1 1 A 40 40 TYR CB C 38 39.343 38.149 1.194 1
1 380 . 11 1 1 A 40 40 TYR N N 38 116.937 118.009 -1.072 1
1 381 . 11 1 1 A 41 41 GLY H H 39 7.325 7.609 -0.284 1
1 382 . 11 1 1 A 41 41 GLY HA2 H 39 3.953 4.060 -0.107 1
1 383 . 11 1 1 A 41 41 GLY C C 39 171.302 172.405 -1.103 1
1 384 . 11 1 1 A 41 41 GLY CA C 39 45.590 45.292 0.298 1
1 385 . 11 1 1 A 41 41 GLY N N 39 105.596 104.284 1.312 1
1 386 . 11 1 1 A 42 42 LYS H H 40 8.186 8.754 -0.568 1
1 387 . 11 1 1 A 42 42 LYS HA H 40 4.205 4.474 -0.269 1
1 393 . 11 1 1 A 42 42 LYS C C 40 175.672 175.831 -0.159 1
1 394 . 11 1 1 A 42 42 LYS CA C 40 55.241 55.760 -0.519 1
1 395 . 11 1 1 A 42 42 LYS CB C 40 32.889 34.019 -1.130 1
1 399 . 11 1 1 A 42 42 LYS N N 40 120.341 122.136 -1.795 1
1 400 . 11 1 1 A 43 43 VAL H H 41 8.610 8.601 0.009 1
1 401 . 11 1 1 A 43 43 VAL HA H 41 4.416 4.633 -0.217 1
1 409 . 11 1 1 A 43 43 VAL C C 41 175.997 175.292 0.705 1
1 410 . 11 1 1 A 43 43 VAL CA C 41 61.331 62.035 -0.704 1
1 411 . 11 1 1 A 43 43 VAL CB C 41 30.573 31.833 -1.260 1
1 414 . 11 1 1 A 43 43 VAL N N 41 127.312 124.381 2.931 1
1 415 . 11 1 1 A 44 44 LEU H H 42 8.894 8.376 0.518 1
1 416 . 11 1 1 A 44 44 LEU HA H 42 4.496 3.862 0.634 1
1 424 . 11 1 1 A 44 44 LEU CA C 42 54.522 53.892 0.630 1
1 425 . 11 1 1 A 44 44 LEU CB C 42 40.980 42.277 -1.297 1
1 429 . 11 1 1 A 44 44 LEU N N 42 130.261 128.278 1.983 1
1 430 . 11 1 1 A 45 45 THR HA H 43 4.263 4.085 0.178 1
1 435 . 11 1 1 A 45 45 THR CA C 43 61.033 62.316 -1.283 1
1 436 . 11 1 1 A 45 45 THR CB C 43 69.768 66.519 3.249 1
1 440 . 11 1 1 A 46 46 GLU CA C 44 56.411 59.342 -2.931 1
1 441 . 11 1 1 A 46 46 GLU CB C 44 29.827 29.206 0.621 1
1 443 . 11 1 1 A 47 47 HIS HA H 45 4.549 4.259 0.290 1
1 447 . 11 1 1 A 47 47 HIS C C 45 174.812 175.791 -0.979 1
1 448 . 11 1 1 A 47 47 HIS CA C 45 56.107 59.853 -3.746 1
1 449 . 11 1 1 A 47 47 HIS CB C 45 29.080 29.851 -0.771 1
1 451 . 11 1 1 A 48 48 VAL H H 46 7.826 8.036 -0.210 1
1 452 . 11 1 1 A 48 48 VAL HA H 46 4.024 3.989 0.035 1
1 460 . 11 1 1 A 48 48 VAL C C 46 175.697 176.676 -0.979 1
1 461 . 11 1 1 A 48 48 VAL CA C 46 61.841 62.931 -1.090 1
1 462 . 11 1 1 A 48 48 VAL CB C 46 32.600 32.386 0.214 1
1 465 . 11 1 1 A 48 48 VAL N N 46 121.117 118.743 2.374 1
1 466 . 11 1 1 A 49 49 ALA H H 47 8.237 8.608 -0.371 1
1 467 . 11 1 1 A 49 49 ALA HA H 47 4.281 3.772 0.509 1
1 471 . 11 1 1 A 49 49 ALA C C 47 177.173 176.950 0.223 1
1 472 . 11 1 1 A 49 49 ALA CA C 47 52.207 54.847 -2.640 1
1 473 . 11 1 1 A 49 49 ALA CB C 47 19.064 17.720 1.344 1
1 474 . 11 1 1 A 49 49 ALA N N 47 126.817 122.780 4.037 1
1 475 . 11 1 1 A 50 50 ASP H H 48 8.029 9.171 -1.142 1
1 476 . 11 1 1 A 50 50 ASP HA H 48 4.436 4.447 -0.011 1
1 479 . 11 1 1 A 50 50 ASP C C 48 176.124 176.570 -0.446 1
1 480 . 11 1 1 A 50 50 ASP CA C 48 54.447 53.928 0.519 1
1 481 . 11 1 1 A 50 50 ASP CB C 48 40.877 40.062 0.815 1
1 482 . 11 1 1 A 50 50 ASP N N 48 119.687 118.542 1.145 1
1 483 . 11 1 1 A 51 51 ALA H H 49 8.094 8.859 -0.765 1
1 484 . 11 1 1 A 51 51 ALA HA H 49 4.134 4.434 -0.300 1
1 488 . 11 1 1 A 51 51 ALA C C 49 177.835 177.906 -0.071 1
1 489 . 11 1 1 A 51 51 ALA CA C 49 52.900 51.404 1.496 1
1 490 . 11 1 1 A 51 51 ALA CB C 49 18.942 19.422 -0.480 1
1 491 . 11 1 1 A 51 51 ALA N N 49 124.400 122.770 1.630 1
1 492 . 11 1 1 A 52 52 GLU H H 50 8.243 7.515 0.728 1
1 493 . 11 1 1 A 52 52 GLU HA H 50 4.152 4.531 -0.379 1
1 497 . 11 1 1 A 52 52 GLU C C 50 176.456 176.668 -0.212 1
1 498 . 11 1 1 A 52 52 GLU CA C 50 56.480 55.802 0.678 1
1 499 . 11 1 1 A 52 52 GLU CB C 50 29.470 30.383 -0.913 1
1 501 . 11 1 1 A 52 52 GLU N N 50 118.917 118.360 0.557 1
1 502 . 11 1 1 A 53 53 LEU H H 51 7.839 7.659 0.180 1
1 503 . 11 1 1 A 53 53 LEU HA H 51 4.229 4.257 -0.028 1
1 513 . 11 1 1 A 53 53 LEU C C 51 177.058 177.195 -0.137 1
1 514 . 11 1 1 A 53 53 LEU CA C 51 54.625 56.298 -1.673 1
1 515 . 11 1 1 A 53 53 LEU CB C 51 42.125 42.330 -0.205 1
1 519 . 11 1 1 A 53 53 LEU N N 51 122.169 118.715 3.454 1
1 520 . 11 1 1 A 54 54 GLU H H 52 8.104 8.117 -0.013 1
1 521 . 11 1 1 A 54 54 GLU HA H 52 4.470 4.445 0.025 1
1 525 . 11 1 1 A 54 54 GLU CA C 52 54.286 55.311 -1.025 1
1 526 . 11 1 1 A 54 54 GLU CB C 52 29.268 29.488 -0.220 1
1 528 . 11 1 1 A 54 54 GLU N N 52 123.040 120.108 2.932 1
1 529 . 11 1 1 A 55 55 PRO HA H 53 4.310 4.276 0.034 1
1 536 . 11 1 1 A 55 55 PRO C C 53 177.019 177.577 -0.558 1
1 537 . 11 1 1 A 55 55 PRO CA C 53 63.075 65.505 -2.430 1
1 538 . 11 1 1 A 55 55 PRO CB C 53 31.329 31.993 -0.664 1
1 541 . 11 1 1 A 56 56 LEU H H 54 8.263 8.117 0.146 1
1 542 . 11 1 1 A 56 56 LEU HA H 54 4.237 4.221 0.016 1
1 552 . 11 1 1 A 56 56 LEU C C 54 178.055 177.261 0.794 1
1 553 . 11 1 1 A 56 56 LEU CA C 54 55.018 56.871 -1.853 1
1 554 . 11 1 1 A 56 56 LEU CB C 54 41.990 41.269 0.721 1
1 558 . 11 1 1 A 56 56 LEU N N 54 122.728 119.032 3.696 1
1 559 . 11 1 1 A 57 57 GLY H H 55 8.231 8.609 -0.378 1
1 560 . 11 1 1 A 57 57 GLY HA2 H 55 3.911 4.007 -0.096 1
1 561 . 11 1 1 A 57 57 GLY HA3 H 55 3.808 4.012 -0.204 1
1 562 . 11 1 1 A 57 57 GLY C C 55 174.379 174.814 -0.435 1
1 563 . 11 1 1 A 57 57 GLY CA C 55 45.092 45.360 -0.268 1
1 564 . 11 1 1 A 57 57 GLY N N 55 110.035 110.434 -0.399 1
1 565 . 11 1 1 A 58 58 GLU H H 56 8.241 8.459 -0.218 1
1 566 . 11 1 1 A 58 58 GLU HA H 56 4.136 3.979 0.157 1
1 570 . 11 1 1 A 58 58 GLU C C 56 176.868 177.009 -0.141 1
1 571 . 11 1 1 A 58 58 GLU CA C 56 56.734 59.022 -2.288 1
1 572 . 11 1 1 A 58 58 GLU CB C 56 29.584 28.217 1.367 1
1 574 . 11 1 1 A 58 58 GLU N N 56 121.173 111.990 9.183 1
1 575 . 11 1 1 A 59 59 GLU H H 57 8.419 9.213 -0.794 1
1 576 . 11 1 1 A 59 59 GLU HA H 57 4.074 4.060 0.014 1
1 580 . 11 1 1 A 59 59 GLU C C 57 176.502 177.725 -1.223 1
1 581 . 11 1 1 A 59 59 GLU CA C 57 56.842 59.039 -2.197 1
1 582 . 11 1 1 A 59 59 GLU CB C 57 29.267 29.576 -0.309 1
1 584 . 11 1 1 A 59 59 GLU N N 57 121.777 120.309 1.468 1
1 585 . 11 1 1 A 60 60 ALA H H 58 8.077 7.748 0.329 1
1 586 . 11 1 1 A 60 60 ALA HA H 58 4.134 4.381 -0.247 1
1 590 . 11 1 1 A 60 60 ALA CA C 58 52.432 52.201 0.231 1
1 591 . 11 1 1 A 60 60 ALA CB C 58 18.743 19.365 -0.622 1
1 592 . 11 1 1 A 60 60 ALA N N 58 125.120 121.434 3.686 1
1 593 . 11 1 1 A 61 61 ALA H H 59 8.041 8.413 -0.372 1
1 594 . 11 1 1 A 61 61 ALA HA H 59 4.131 4.033 0.098 1
1 598 . 11 1 1 A 61 61 ALA C C 59 178.147 177.603 0.544 1
1 599 . 11 1 1 A 61 61 ALA CA C 59 52.586 53.405 -0.819 1
1 600 . 11 1 1 A 61 61 ALA CB C 59 18.692 18.673 0.019 1
1 601 . 11 1 1 A 61 61 ALA N N 59 123.857 122.272 1.585 1
1 602 . 11 1 1 A 62 62 GLY H H 60 8.069 8.365 -0.296 1
1 603 . 11 1 1 A 62 62 GLY HA2 H 60 3.810 4.289 -0.479 1
1 604 . 11 1 1 A 62 62 GLY HA3 H 60 3.888 4.330 -0.442 1
1 605 . 11 1 1 A 62 62 GLY C C 60 174.914 173.376 1.538 1
1 606 . 11 1 1 A 62 62 GLY CA C 60 45.320 46.300 -0.980 1
1 607 . 11 1 1 A 62 62 GLY N N 60 107.924 108.975 -1.051 1
1 608 . 11 1 1 A 63 63 GLY H H 61 8.118 8.050 0.068 1
1 609 . 11 1 1 A 63 63 GLY HA2 H 61 4.008 4.258 -0.250 1
1 610 . 11 1 1 A 63 63 GLY HA3 H 61 3.893 4.275 -0.382 1
1 611 . 11 1 1 A 63 63 GLY C C 61 174.743 175.174 -0.431 1
1 612 . 11 1 1 A 63 63 GLY CA C 61 45.202 45.775 -0.573 1
1 613 . 11 1 1 A 63 63 GLY N N 61 109.441 105.696 3.745 1
1 614 . 11 1 1 A 64 64 ASP H H 62 8.305 8.672 -0.367 1
1 615 . 11 1 1 A 64 64 ASP HA H 62 4.240 4.333 -0.093 1
1 618 . 11 1 1 A 64 64 ASP C C 62 177.571 178.593 -1.022 1
1 619 . 11 1 1 A 64 64 ASP CA C 62 57.210 57.205 0.005 1
1 620 . 11 1 1 A 64 64 ASP CB C 62 40.142 40.291 -0.149 1
1 621 . 11 1 1 A 64 64 ASP N N 62 121.568 120.842 0.726 1
1 622 . 11 1 1 A 65 65 GLN H H 63 8.337 8.301 0.036 1
1 623 . 11 1 1 A 65 65 GLN HA H 63 4.138 4.008 0.130 1
1 628 . 11 1 1 A 65 65 GLN C C 63 177.490 178.827 -1.337 1
1 629 . 11 1 1 A 65 65 GLN CA C 63 58.643 58.734 -0.091 1
1 630 . 11 1 1 A 65 65 GLN CB C 63 27.803 28.458 -0.655 1
1 632 . 11 1 1 A 65 65 GLN N N 63 119.700 118.451 1.249 1
1 633 . 11 1 1 A 66 66 PHE H H 64 7.658 8.250 -0.592 1
1 634 . 11 1 1 A 66 66 PHE HA H 64 4.170 4.386 -0.216 1
1 638 . 11 1 1 A 66 66 PHE C C 64 176.872 178.183 -1.311 1
1 639 . 11 1 1 A 66 66 PHE CA C 64 60.158 61.131 -0.973 1
1 640 . 11 1 1 A 66 66 PHE CB C 64 38.490 38.239 0.251 1
1 643 . 11 1 1 A 66 66 PHE N N 64 121.036 119.421 1.615 1
1 644 . 11 1 1 A 67 67 ILE H H 65 7.646 8.969 -1.323 1
1 645 . 11 1 1 A 67 67 ILE HA H 65 3.426 3.689 -0.263 1
1 655 . 11 1 1 A 67 67 ILE CA C 65 63.377 65.497 -2.120 1
1 656 . 11 1 1 A 67 67 ILE CB C 65 37.057 37.723 -0.666 1
1 660 . 11 1 1 A 67 67 ILE N N 65 121.372 120.080 1.292 1
1 661 . 11 1 1 A 68 68 HIS H H 66 7.945 8.674 -0.729 1
1 662 . 11 1 1 A 68 68 HIS HA H 66 4.005 4.114 -0.109 1
1 665 . 11 1 1 A 68 68 HIS CA C 66 59.915 59.800 0.115 1
1 668 . 11 1 1 A 68 68 HIS N N 66 120.036 119.378 0.658 1
1 669 . 11 1 1 A 69 69 GLU HA H 67 3.677 4.003 -0.326 1
1 673 . 11 1 1 A 69 69 GLU CA C 67 58.490 59.664 -1.174 1
1 674 . 11 1 1 A 69 69 GLU CB C 67 29.290 29.226 0.064 1
1 676 . 11 1 1 A 70 70 GLN H H 68 8.017 8.146 -0.129 1
1 677 . 11 1 1 A 70 70 GLN HA H 68 3.426 3.944 -0.518 1
1 678 . 11 1 1 A 70 70 GLN C C 68 179.280 178.879 0.401 1
1 679 . 11 1 1 A 70 70 GLN CA C 68 57.561 58.663 -1.102 1
1 680 . 11 1 1 A 70 70 GLN CB C 68 28.530 28.239 0.291 1
1 682 . 11 1 1 A 70 70 GLN N N 68 120.410 118.135 2.275 1
1 683 . 11 1 1 A 71 71 ASP HA H 69 4.440 4.737 -0.297 1
1 684 . 11 1 1 A 71 71 ASP C C 69 177.402 178.699 -1.297 1
1 685 . 11 1 1 A 71 71 ASP CA C 69 56.290 57.361 -1.071 1
1 686 . 11 1 1 A 72 72 LEU H H 70 7.952 8.130 -0.178 1
1 687 . 11 1 1 A 72 72 LEU HA H 70 3.775 3.955 -0.180 1
1 697 . 11 1 1 A 72 72 LEU C C 70 178.316 178.507 -0.191 1
1 698 . 11 1 1 A 72 72 LEU CA C 70 56.101 57.660 -1.559 1
1 699 . 11 1 1 A 72 72 LEU CB C 70 39.872 41.319 -1.447 1
1 703 . 11 1 1 A 72 72 LEU N N 70 120.832 121.054 -0.222 1
1 704 . 11 1 1 A 73 73 ASN H H 71 7.723 8.109 -0.386 1
1 705 . 11 1 1 A 73 73 ASN HA H 71 4.270 4.378 -0.108 1
1 708 . 11 1 1 A 73 73 ASN C C 71 178.193 177.783 0.410 1
1 709 . 11 1 1 A 73 73 ASN CA C 71 55.970 56.305 -0.335 1
1 710 . 11 1 1 A 73 73 ASN CB C 71 37.640 38.781 -1.141 1
1 711 . 11 1 1 A 73 73 ASN N N 71 119.295 117.366 1.929 1
1 712 . 11 1 1 A 74 74 TRP H H 72 7.811 8.736 -0.925 1
1 713 . 11 1 1 A 74 74 TRP HA H 72 4.500 4.501 -0.001 1
1 720 . 11 1 1 A 74 74 TRP CA C 72 58.480 59.882 -1.402 1
1 721 . 11 1 1 A 74 74 TRP CB C 72 28.920 29.748 -0.828 1
1 727 . 11 1 1 A 74 74 TRP N N 72 121.490 120.406 1.084 1
1 729 . 11 1 1 A 75 75 LEU H H 73 8.412 8.510 -0.098 1
1 730 . 11 1 1 A 75 75 LEU HA H 73 3.290 3.394 -0.104 1
1 739 . 11 1 1 A 75 75 LEU C C 73 178.562 178.526 0.036 1
1 740 . 11 1 1 A 75 75 LEU CA C 73 58.226 57.636 0.590 1
1 741 . 11 1 1 A 75 75 LEU CB C 73 41.200 40.689 0.511 1
1 745 . 11 1 1 A 75 75 LEU N N 73 121.065 120.976 0.089 1
1 746 . 11 1 1 A 76 76 GLN H H 74 7.648 7.611 0.037 1
1 747 . 11 1 1 A 76 76 GLN HA H 74 3.657 4.010 -0.353 1
1 752 . 11 1 1 A 76 76 GLN C C 74 178.616 177.718 0.898 1
1 753 . 11 1 1 A 76 76 GLN CA C 74 58.777 58.899 -0.122 1
1 754 . 11 1 1 A 76 76 GLN CB C 74 28.163 28.317 -0.154 1
1 756 . 11 1 1 A 76 76 GLN N N 74 113.985 118.571 -4.586 1
1 757 . 11 1 1 A 77 77 GLN H H 75 7.465 8.147 -0.682 1
1 758 . 11 1 1 A 77 77 GLN HA H 75 4.134 4.414 -0.280 1
1 761 . 11 1 1 A 77 77 GLN C C 75 176.223 175.944 0.279 1
1 762 . 11 1 1 A 77 77 GLN CA C 75 56.203 55.235 0.968 1
1 763 . 11 1 1 A 77 77 GLN CB C 75 29.524 27.990 1.534 1
1 765 . 11 1 1 A 77 77 GLN N N 75 117.481 114.912 2.569 1
1 766 . 11 1 1 A 78 78 ALA H H 76 7.420 7.270 0.150 1
1 767 . 11 1 1 A 78 78 ALA HA H 76 3.864 4.336 -0.472 1
1 771 . 11 1 1 A 78 78 ALA C C 76 176.733 176.494 0.239 1
1 772 . 11 1 1 A 78 78 ALA CA C 76 52.529 52.860 -0.331 1
1 773 . 11 1 1 A 78 78 ALA CB C 76 20.124 19.429 0.695 1
1 774 . 11 1 1 A 78 78 ALA N N 76 122.682 124.118 -1.436 1
1 775 . 11 1 1 A 79 79 ASP H H 77 9.028 8.858 0.170 1
1 776 . 11 1 1 A 79 79 ASP HA H 77 4.673 4.748 -0.075 1
1 779 . 11 1 1 A 79 79 ASP C C 77 175.740 176.235 -0.495 1
1 780 . 11 1 1 A 79 79 ASP CA C 77 56.383 56.548 -0.165 1
1 781 . 11 1 1 A 79 79 ASP CB C 77 42.826 42.867 -0.041 1
1 782 . 11 1 1 A 79 79 ASP N N 77 119.887 121.742 -1.855 1
1 783 . 11 1 1 A 80 80 VAL H H 78 7.379 7.911 -0.532 1
1 784 . 11 1 1 A 80 80 VAL HA H 78 4.340 4.849 -0.509 1
1 792 . 11 1 1 A 80 80 VAL C C 78 175.321 174.513 0.808 1
1 793 . 11 1 1 A 80 80 VAL CA C 78 60.011 60.298 -0.287 1
1 794 . 11 1 1 A 80 80 VAL CB C 78 35.362 36.236 -0.874 1
1 797 . 11 1 1 A 80 80 VAL N N 78 114.152 118.032 -3.880 1
1 798 . 11 1 1 A 81 81 VAL H H 79 8.350 8.496 -0.146 1
1 799 . 11 1 1 A 81 81 VAL HA H 79 4.799 4.895 -0.096 1
1 807 . 11 1 1 A 81 81 VAL C C 79 173.095 174.384 -1.289 1
1 808 . 11 1 1 A 81 81 VAL CA C 79 60.775 60.694 0.081 1
1 809 . 11 1 1 A 81 81 VAL CB C 79 32.824 34.715 -1.891 1
1 812 . 11 1 1 A 81 81 VAL N N 79 128.429 125.897 2.532 1
1 813 . 11 1 1 A 82 82 VAL H H 80 8.947 8.708 0.239 1
1 814 . 11 1 1 A 82 82 VAL HA H 80 4.947 4.515 0.432 1
1 822 . 11 1 1 A 82 82 VAL C C 80 173.522 174.548 -1.026 1
1 823 . 11 1 1 A 82 82 VAL CA C 80 59.684 60.715 -1.031 1
1 824 . 11 1 1 A 82 82 VAL CB C 80 33.702 33.413 0.289 1
1 827 . 11 1 1 A 82 82 VAL N N 80 126.957 127.768 -0.811 1
1 828 . 11 1 1 A 83 83 ALA H H 81 9.011 8.961 0.050 1
1 829 . 11 1 1 A 83 83 ALA HA H 81 4.938 4.949 -0.011 1
1 833 . 11 1 1 A 83 83 ALA C C 81 130.330 175.759 -45.429 1
1 834 . 11 1 1 A 83 83 ALA CA C 81 49.490 49.773 -0.283 1
1 835 . 11 1 1 A 83 83 ALA CB C 81 23.628 22.721 0.907 1
1 836 . 11 1 1 A 83 83 ALA N N 81 128.705 129.208 -0.503 1
1 837 . 11 1 1 A 84 84 GLU H H 82 8.922 8.084 0.838 1
1 838 . 11 1 1 A 84 84 GLU HA H 82 4.937 4.695 0.242 1
1 839 . 11 1 1 A 84 84 GLU C C 82 177.673 175.880 1.793 1
1 840 . 11 1 1 A 84 84 GLU CA C 82 56.714 55.317 1.397 1
1 841 . 11 1 1 A 84 84 GLU CB C 82 29.882 31.396 -1.514 1
1 842 . 11 1 1 A 84 84 GLU N N 82 130.330 119.726 10.604 1
1 843 . 11 1 1 A 85 85 VAL H H 83 8.427 9.257 -0.830 1
1 844 . 11 1 1 A 85 85 VAL HA H 83 4.435 4.218 0.217 1
1 852 . 11 1 1 A 85 85 VAL C C 83 174.252 176.329 -2.077 1
1 853 . 11 1 1 A 85 85 VAL CA C 83 59.896 63.435 -3.539 1
1 854 . 11 1 1 A 85 85 VAL CB C 83 29.968 32.918 -2.950 1
1 857 . 11 1 1 A 85 85 VAL N N 83 114.212 120.434 -6.222 1
1 858 . 11 1 1 A 86 86 THR H H 84 9.347 8.376 0.971 1
1 859 . 11 1 1 A 86 86 THR HA H 84 4.146 4.290 -0.144 1
1 864 . 11 1 1 A 86 86 THR C C 84 175.751 174.045 1.706 1
1 865 . 11 1 1 A 86 86 THR CA C 84 67.629 64.038 3.591 1
1 866 . 11 1 1 A 86 86 THR CB C 84 66.819 67.525 -0.706 1
1 868 . 11 1 1 A 86 86 THR N N 84 121.640 114.871 6.769 1
1 869 . 11 1 1 A 87 87 GLN H H 85 8.114 8.413 -0.299 1
1 870 . 11 1 1 A 87 87 GLN HA H 85 4.736 4.372 0.364 1
1 874 . 11 1 1 A 87 87 GLN CA C 85 51.898 55.143 -3.245 1
1 875 . 11 1 1 A 87 87 GLN CB C 85 27.942 28.578 -0.636 1
1 877 . 11 1 1 A 87 87 GLN N N 85 120.367 123.826 -3.459 1
1 878 . 11 1 1 A 88 88 PRO HA H 86 4.061 4.426 -0.365 1
1 885 . 11 1 1 A 88 88 PRO C C 86 176.436 176.749 -0.313 1
1 886 . 11 1 1 A 88 88 PRO CA C 86 63.422 63.481 -0.059 1
1 887 . 11 1 1 A 88 88 PRO CB C 86 31.925 32.075 -0.150 1
1 889 . 11 1 1 A 89 89 SER H H 87 6.044 8.775 -2.731 1
1 890 . 11 1 1 A 89 89 SER HA H 87 4.630 4.605 0.025 1
1 893 . 11 1 1 A 89 89 SER C C 87 175.612 173.693 1.919 1
1 894 . 11 1 1 A 89 89 SER CA C 87 56.800 57.866 -1.066 1
1 895 . 11 1 1 A 89 89 SER CB C 87 64.196 63.791 0.405 1
1 896 . 11 1 1 A 89 89 SER N N 87 115.721 118.862 -3.141 1
1 897 . 11 1 1 A 90 90 LEU H H 88 9.702 8.066 1.636 1
1 898 . 11 1 1 A 90 90 LEU HA H 88 4.270 4.425 -0.155 1
1 906 . 11 1 1 A 90 90 LEU C C 88 179.173 177.642 1.531 1
1 907 . 11 1 1 A 90 90 LEU CA C 88 57.402 55.895 1.507 1
1 908 . 11 1 1 A 90 90 LEU CB C 88 43.642 44.216 -0.574 1
1 911 . 11 1 1 A 90 90 LEU N N 88 130.488 123.020 7.468 1
1 912 . 11 1 1 A 91 91 GLY H H 89 8.354 8.394 -0.040 1
1 913 . 11 1 1 A 91 91 GLY HA2 H 89 3.680 3.755 -0.075 1
1 914 . 11 1 1 A 91 91 GLY HA3 H 89 3.584 3.765 -0.181 1
1 915 . 11 1 1 A 91 91 GLY C C 89 175.106 175.756 -0.650 1
1 916 . 11 1 1 A 91 91 GLY CA C 89 47.770 47.570 0.200 1
1 917 . 11 1 1 A 91 91 GLY N N 89 107.522 106.756 0.766 1
1 918 . 11 1 1 A 92 92 VAL H H 90 7.906 8.169 -0.263 1
1 919 . 11 1 1 A 92 92 VAL HA H 90 3.940 3.806 0.134 1
1 927 . 11 1 1 A 92 92 VAL C C 90 178.467 178.007 0.460 1
1 928 . 11 1 1 A 92 92 VAL CA C 90 65.379 66.567 -1.188 1
1 929 . 11 1 1 A 92 92 VAL CB C 90 31.785 31.726 0.059 1
1 932 . 11 1 1 A 92 92 VAL N N 90 121.741 122.015 -0.274 1
1 933 . 11 1 1 A 93 93 GLY H H 91 7.595 8.200 -0.605 1
1 934 . 11 1 1 A 93 93 GLY HA2 H 91 3.628 3.838 -0.210 1
1 935 . 11 1 1 A 93 93 GLY HA3 H 91 3.415 3.848 -0.433 1
1 936 . 11 1 1 A 93 93 GLY C C 91 174.022 175.470 -1.448 1
1 937 . 11 1 1 A 93 93 GLY CA C 91 48.319 47.508 0.811 1
1 938 . 11 1 1 A 93 93 GLY N N 91 104.629 107.843 -3.214 1
1 939 . 11 1 1 A 94 94 TYR H H 92 8.372 7.919 0.453 1
1 940 . 11 1 1 A 94 94 TYR HA H 92 4.046 4.055 -0.009 1
1 943 . 11 1 1 A 94 94 TYR C C 92 177.458 177.754 -0.296 1
1 944 . 11 1 1 A 94 94 TYR CA C 92 61.760 60.706 1.054 1
1 945 . 11 1 1 A 94 94 TYR CB C 92 38.431 38.391 0.040 1
1 948 . 11 1 1 A 94 94 TYR N N 92 123.383 123.451 -0.068 1
1 949 . 11 1 1 A 95 95 GLU H H 93 8.424 8.759 -0.335 1
1 950 . 11 1 1 A 95 95 GLU HA H 93 3.421 3.905 -0.484 1
1 951 . 11 1 1 A 95 95 GLU C C 93 178.590 179.195 -0.605 1
1 952 . 11 1 1 A 95 95 GLU CA C 93 60.211 59.336 0.875 1
1 953 . 11 1 1 A 95 95 GLU CB C 93 29.025 29.109 -0.084 1
1 954 . 11 1 1 A 95 95 GLU N N 93 120.181 118.838 1.343 1
1 955 . 11 1 1 A 96 96 LEU H H 94 8.210 8.616 -0.406 1
1 956 . 11 1 1 A 96 96 LEU HA H 94 3.830 3.973 -0.143 1
1 964 . 11 1 1 A 96 96 LEU C C 94 179.032 179.738 -0.706 1
1 965 . 11 1 1 A 96 96 LEU CA C 94 57.683 58.444 -0.761 1
1 966 . 11 1 1 A 96 96 LEU CB C 94 41.883 41.965 -0.082 1
1 970 . 11 1 1 A 96 96 LEU N N 94 118.091 121.147 -3.056 1
1 971 . 11 1 1 A 97 97 GLY H H 95 8.773 7.969 0.804 1
1 972 . 11 1 1 A 97 97 GLY C C 95 175.344 176.355 -1.011 1
1 973 . 11 1 1 A 97 97 GLY CA C 95 47.308 46.786 0.522 1
1 974 . 11 1 1 A 97 97 GLY N N 95 108.085 104.879 3.206 1
1 975 . 11 1 1 A 98 98 ARG H H 96 8.100 7.752 0.348 1
1 976 . 11 1 1 A 98 98 ARG C C 96 179.692 179.016 0.676 1
1 977 . 11 1 1 A 98 98 ARG CA C 96 56.308 59.449 -3.141 1
1 978 . 11 1 1 A 98 98 ARG CB C 96 26.854 30.138 -3.284 1
1 979 . 11 1 1 A 98 98 ARG N N 96 118.156 121.859 -3.703 1
1 980 . 11 1 1 A 99 99 ALA H H 97 8.498 7.615 0.883 1
1 981 . 11 1 1 A 99 99 ALA HA H 97 3.640 4.363 -0.723 1
1 985 . 11 1 1 A 99 99 ALA C C 97 179.650 180.109 -0.459 1
1 986 . 11 1 1 A 99 99 ALA CA C 97 55.166 54.946 0.220 1
1 987 . 11 1 1 A 99 99 ALA CB C 97 18.604 18.602 0.002 1
1 988 . 11 1 1 A 99 99 ALA N N 97 122.310 121.854 0.456 1
1 989 . 11 1 1 A 100 100 VAL H H 98 8.597 8.012 0.585 1
1 990 . 11 1 1 A 100 100 VAL HA H 98 3.798 3.553 0.245 1
1 998 . 11 1 1 A 100 100 VAL C C 98 180.464 178.185 2.279 1
1 999 . 11 1 1 A 100 100 VAL CA C 98 65.664 66.532 -0.868 1
1 1000 . 11 1 1 A 100 100 VAL CB C 98 31.065 31.417 -0.352 1
1 1003 . 11 1 1 A 100 100 VAL N N 98 120.603 118.966 1.637 1
1 1004 . 11 1 1 A 101 101 ALA H H 99 7.280 7.818 -0.538 1
1 1005 . 11 1 1 A 101 101 ALA HA H 99 3.963 4.042 -0.079 1
1 1009 . 11 1 1 A 101 101 ALA C C 99 179.314 179.822 -0.508 1
1 1010 . 11 1 1 A 101 101 ALA CA C 99 54.367 55.101 -0.734 1
1 1011 . 11 1 1 A 101 101 ALA CB C 99 18.139 18.935 -0.796 1
1 1012 . 11 1 1 A 101 101 ALA N N 99 124.450 121.929 2.521 1
1 1013 . 11 1 1 A 102 102 LEU H H 100 7.200 8.677 -1.477 1
1 1014 . 11 1 1 A 102 102 LEU HA H 100 4.192 4.309 -0.117 1
1 1024 . 11 1 1 A 102 102 LEU C C 100 177.306 177.088 0.218 1
1 1025 . 11 1 1 A 102 102 LEU CA C 100 54.808 54.994 -0.186 1
1 1026 . 11 1 1 A 102 102 LEU CB C 100 42.880 42.245 0.635 1
1 1030 . 11 1 1 A 102 102 LEU N N 100 116.834 116.098 0.736 1
1 1031 . 11 1 1 A 103 103 GLY H H 101 7.891 8.239 -0.348 1
1 1032 . 11 1 1 A 103 103 GLY HA2 H 101 3.941 3.995 -0.054 1
1 1033 . 11 1 1 A 103 103 GLY HA3 H 101 3.831 4.000 -0.169 1
1 1034 . 11 1 1 A 103 103 GLY C C 101 175.137 173.847 1.290 1
1 1035 . 11 1 1 A 103 103 GLY CA C 101 45.673 45.173 0.500 1
1 1036 . 11 1 1 A 103 103 GLY N N 101 109.395 106.907 2.488 1
1 1037 . 11 1 1 A 104 104 LYS H H 102 7.337 8.601 -1.264 1
1 1038 . 11 1 1 A 104 104 LYS HA H 102 4.402 4.497 -0.095 1
1 1043 . 11 1 1 A 104 104 LYS CA C 102 52.136 57.149 -5.013 1
1 1044 . 11 1 1 A 104 104 LYS CB C 102 31.045 31.381 -0.336 1
1 1047 . 11 1 1 A 104 104 LYS N N 102 118.954 119.463 -0.509 1
1 1048 . 11 1 1 A 105 105 PRO HA H 103 4.781 4.428 0.353 1
1 1054 . 11 1 1 A 105 105 PRO CA C 103 62.791 63.411 -0.620 1
1 1055 . 11 1 1 A 105 105 PRO CB C 103 30.405 32.174 -1.769 1
1 1058 . 11 1 1 A 106 106 ILE H H 104 8.261 8.856 -0.595 1
1 1059 . 11 1 1 A 106 106 ILE HA H 104 4.680 4.401 0.279 1
1 1069 . 11 1 1 A 106 106 ILE C C 104 175.543 173.896 1.647 1
1 1070 . 11 1 1 A 106 106 ILE CA C 104 59.362 60.285 -0.923 1
1 1071 . 11 1 1 A 106 106 ILE CB C 104 43.738 38.539 5.199 1
1 1075 . 11 1 1 A 106 106 ILE N N 104 123.509 124.670 -1.161 1
1 1076 . 11 1 1 A 107 107 LEU H H 105 8.584 8.419 0.165 1
1 1077 . 11 1 1 A 107 107 LEU HA H 105 4.243 4.528 -0.285 1
1 1087 . 11 1 1 A 107 107 LEU C C 105 174.204 174.464 -0.260 1
1 1088 . 11 1 1 A 107 107 LEU CA C 105 52.863 53.299 -0.436 1
1 1089 . 11 1 1 A 107 107 LEU CB C 105 42.408 43.308 -0.900 1
1 1093 . 11 1 1 A 107 107 LEU N N 105 131.882 129.565 2.317 1
1 1094 . 11 1 1 A 108 108 CYS H H 106 8.679 8.773 -0.094 1
1 1095 . 11 1 1 A 108 108 CYS HA H 106 5.280 5.104 0.176 1
1 1099 . 11 1 1 A 108 108 CYS C C 106 173.134 173.252 -0.118 1
1 1100 . 11 1 1 A 108 108 CYS CA C 106 57.290 57.000 0.290 1
1 1101 . 11 1 1 A 108 108 CYS CB C 106 29.559 28.584 0.975 1
1 1102 . 11 1 1 A 108 108 CYS N N 106 122.904 125.678 -2.774 1
1 1103 . 11 1 1 A 109 109 LEU H H 107 8.987 8.874 0.113 1
1 1104 . 11 1 1 A 109 109 LEU HA H 107 5.120 5.568 -0.448 1
1 1112 . 11 1 1 A 109 109 LEU C C 107 174.500 176.379 -1.879 1
1 1113 . 11 1 1 A 109 109 LEU CA C 107 53.274 53.530 -0.256 1
1 1114 . 11 1 1 A 109 109 LEU CB C 107 43.450 44.288 -0.838 1
1 1118 . 11 1 1 A 109 109 LEU N N 107 124.653 126.685 -2.032 1
1 1119 . 11 1 1 A 110 110 PHE H H 108 8.981 9.250 -0.269 1
1 1120 . 11 1 1 A 110 110 PHE HA H 108 4.846 5.816 -0.970 1
1 1125 . 11 1 1 A 110 110 PHE C C 108 172.231 173.424 -1.193 1
1 1126 . 11 1 1 A 110 110 PHE CA C 108 55.963 55.246 0.717 1
1 1127 . 11 1 1 A 110 110 PHE CB C 108 43.270 42.510 0.760 1
1 1130 . 11 1 1 A 110 110 PHE N N 108 125.052 121.219 3.833 1
1 1131 . 11 1 1 A 111 111 ARG H H 109 7.461 8.410 -0.949 1
1 1132 . 11 1 1 A 111 111 ARG HA H 109 4.804 4.753 0.051 1
1 1136 . 11 1 1 A 111 111 ARG CA C 109 51.953 52.254 -0.301 1
1 1137 . 11 1 1 A 111 111 ARG CB C 109 30.008 30.779 -0.771 1
1 1140 . 11 1 1 A 111 111 ARG N N 109 128.034 119.999 8.035 1
1 1141 . 11 1 1 A 112 112 PRO C C 110 178.675 177.353 1.322 1
1 1142 . 11 1 1 A 112 112 PRO CA C 110 64.024 64.082 -0.058 1
1 1143 . 11 1 1 A 112 112 PRO CB C 110 31.416 32.063 -0.647 1
1 1144 . 11 1 1 A 113 113 GLN H H 111 8.188 8.672 -0.484 1
1 1145 . 11 1 1 A 113 113 GLN HA H 111 4.056 4.033 0.023 1
1 1149 . 11 1 1 A 113 113 GLN C C 111 175.936 177.079 -1.143 1
1 1150 . 11 1 1 A 113 113 GLN CA C 111 57.144 58.272 -1.128 1
1 1151 . 11 1 1 A 113 113 GLN CB C 111 28.033 28.139 -0.106 1
1 1153 . 11 1 1 A 113 113 GLN N N 111 118.835 117.692 1.143 1
1 1154 . 11 1 1 A 114 114 SER H H 112 7.730 7.677 0.053 1
1 1155 . 11 1 1 A 114 114 SER HA H 112 4.037 4.511 -0.474 1
1 1158 . 11 1 1 A 114 114 SER C C 112 175.750 174.523 1.227 1
1 1159 . 11 1 1 A 114 114 SER CA C 112 60.154 58.774 1.380 1
1 1160 . 11 1 1 A 114 114 SER CB C 112 64.282 64.017 0.265 1
1 1161 . 11 1 1 A 114 114 SER N N 112 114.887 113.945 0.942 1
1 1162 . 11 1 1 A 115 115 GLY H H 113 8.005 8.271 -0.266 1
1 1163 . 11 1 1 A 115 115 GLY HA2 H 113 3.712 3.937 -0.225 1
1 1164 . 11 1 1 A 115 115 GLY HA3 H 113 4.130 3.957 0.173 1
1 1165 . 11 1 1 A 115 115 GLY C C 113 173.945 174.788 -0.843 1
1 1166 . 11 1 1 A 115 115 GLY CA C 113 45.233 46.956 -1.723 1
1 1167 . 11 1 1 A 115 115 GLY N N 113 110.740 110.854 -0.114 1
1 1168 . 11 1 1 A 116 116 ARG H H 114 7.665 8.131 -0.466 1
1 1169 . 11 1 1 A 116 116 ARG HA H 114 4.449 4.643 -0.194 1
1 1173 . 11 1 1 A 116 116 ARG C C 114 175.370 175.563 -0.193 1
1 1174 . 11 1 1 A 116 116 ARG CA C 114 55.080 55.674 -0.594 1
1 1175 . 11 1 1 A 116 116 ARG CB C 114 31.215 32.102 -0.887 1
1 1178 . 11 1 1 A 116 116 ARG N N 114 119.983 119.391 0.592 1
1 1179 . 11 1 1 A 117 117 VAL H H 115 8.409 8.495 -0.086 1
1 1180 . 11 1 1 A 117 117 VAL HA H 115 4.184 4.524 -0.340 1
1 1188 . 11 1 1 A 117 117 VAL C C 115 175.980 176.127 -0.147 1
1 1189 . 11 1 1 A 117 117 VAL CA C 115 61.167 61.298 -0.131 1
1 1190 . 11 1 1 A 117 117 VAL CB C 115 32.931 33.005 -0.074 1
1 1193 . 11 1 1 A 117 117 VAL N N 115 122.240 120.414 1.826 1
1 1194 . 11 1 1 A 118 118 LEU H H 116 8.227 8.387 -0.160 1
1 1195 . 11 1 1 A 118 118 LEU HA H 116 3.720 4.324 -0.604 1
1 1204 . 11 1 1 A 118 118 LEU C C 116 175.623 176.680 -1.057 1
1 1205 . 11 1 1 A 118 118 LEU CA C 116 54.555 56.050 -1.495 1
1 1206 . 11 1 1 A 118 118 LEU CB C 116 39.292 43.016 -3.724 1
1 1210 . 11 1 1 A 118 118 LEU N N 116 131.481 131.490 -0.009 1
1 1211 . 11 1 1 A 119 119 SER H H 117 7.780 8.524 -0.744 1
1 1212 . 11 1 1 A 119 119 SER HA H 117 4.060 4.408 -0.348 1
1 1214 . 11 1 1 A 119 119 SER C C 117 175.782 175.652 0.130 1
1 1215 . 11 1 1 A 119 119 SER CA C 117 58.530 60.191 -1.661 1
1 1216 . 11 1 1 A 119 119 SER CB C 117 64.785 64.027 0.758 1
1 1217 . 11 1 1 A 119 119 SER N N 117 118.658 120.487 -1.829 1
1 1218 . 11 1 1 A 120 120 ALA H H 118 8.955 8.961 -0.006 1
1 1219 . 11 1 1 A 120 120 ALA HA H 118 3.846 3.903 -0.057 1
1 1223 . 11 1 1 A 120 120 ALA C C 118 179.731 179.670 0.061 1
1 1224 . 11 1 1 A 120 120 ALA CA C 118 54.927 54.967 -0.040 1
1 1225 . 11 1 1 A 120 120 ALA CB C 118 18.627 18.410 0.217 1
1 1226 . 11 1 1 A 120 120 ALA N N 118 134.119 127.261 6.858 1
1 1227 . 11 1 1 A 121 121 MET H H 119 7.718 7.882 -0.164 1
1 1228 . 11 1 1 A 121 121 MET HA H 119 4.130 4.170 -0.040 1
1 1235 . 11 1 1 A 121 121 MET C C 119 175.610 178.283 -2.673 1
1 1236 . 11 1 1 A 121 121 MET CA C 119 55.968 58.315 -2.347 1
1 1237 . 11 1 1 A 121 121 MET CB C 119 30.814 32.651 -1.837 1
1 1240 . 11 1 1 A 121 121 MET N N 119 115.424 117.581 -2.157 1
1 1241 . 11 1 1 A 122 122 ILE H H 120 6.451 8.125 -1.674 1
1 1242 . 11 1 1 A 122 122 ILE HA H 120 3.392 3.641 -0.249 1
1 1252 . 11 1 1 A 122 122 ILE C C 120 177.108 177.916 -0.808 1
1 1253 . 11 1 1 A 122 122 ILE CA C 120 59.650 64.923 -5.273 1
1 1254 . 11 1 1 A 122 122 ILE CB C 120 34.640 37.712 -3.072 1
1 1258 . 11 1 1 A 122 122 ILE N N 120 113.418 119.660 -6.242 1
1 1259 . 11 1 1 A 123 123 ARG H H 121 7.540 8.415 -0.875 1
1 1260 . 11 1 1 A 123 123 ARG HA H 121 3.551 3.934 -0.383 1
1 1264 . 11 1 1 A 123 123 ARG C C 121 179.642 179.004 0.638 1
1 1265 . 11 1 1 A 123 123 ARG CA C 121 59.242 59.857 -0.615 1
1 1266 . 11 1 1 A 123 123 ARG CB C 121 29.087 29.742 -0.655 1
1 1269 . 11 1 1 A 123 123 ARG N N 121 116.248 120.739 -4.491 1
1 1270 . 11 1 1 A 124 124 GLY H H 122 8.086 8.529 -0.443 1
1 1271 . 11 1 1 A 124 124 GLY C C 122 172.357 176.299 -3.942 1
1 1272 . 11 1 1 A 124 124 GLY CA C 122 44.836 47.038 -2.202 1
1 1273 . 11 1 1 A 124 124 GLY N N 122 104.381 107.459 -3.078 1
1 1274 . 11 1 1 A 125 125 ALA H H 123 6.411 7.826 -1.415 1
1 1275 . 11 1 1 A 125 125 ALA HA H 123 2.441 3.777 -1.336 1
1 1279 . 11 1 1 A 125 125 ALA C C 123 176.908 178.878 -1.970 1
1 1280 . 11 1 1 A 125 125 ALA CA C 123 51.593 54.426 -2.833 1
1 1281 . 11 1 1 A 125 125 ALA CB C 123 16.997 17.676 -0.679 1
1 1282 . 11 1 1 A 125 125 ALA N N 123 123.136 124.526 -1.390 1
1 1283 . 11 1 1 A 126 126 ALA H H 124 6.190 7.540 -1.350 1
1 1284 . 11 1 1 A 126 126 ALA HA H 124 3.829 4.600 -0.771 1
1 1288 . 11 1 1 A 126 126 ALA C C 124 177.535 176.707 0.828 1
1 1289 . 11 1 1 A 126 126 ALA CA C 124 52.403 52.738 -0.335 1
1 1290 . 11 1 1 A 126 126 ALA CB C 124 18.375 19.175 -0.800 1
1 1291 . 11 1 1 A 126 126 ALA N N 124 117.999 119.190 -1.191 1
1 1292 . 11 1 1 A 127 127 ASP H H 125 8.877 8.926 -0.049 1
1 1293 . 11 1 1 A 127 127 ASP HA H 125 4.665 4.845 -0.180 1
1 1296 . 11 1 1 A 127 127 ASP C C 125 177.795 176.996 0.799 1
1 1297 . 11 1 1 A 127 127 ASP CA C 125 52.855 53.826 -0.971 1
1 1298 . 11 1 1 A 127 127 ASP CB C 125 41.814 42.359 -0.545 1
1 1299 . 11 1 1 A 127 127 ASP N N 125 121.828 123.385 -1.557 1
1 1300 . 11 1 1 A 128 128 GLY H H 126 7.954 8.096 -0.142 1
1 1301 . 11 1 1 A 128 128 GLY HA2 H 126 3.830 4.003 -0.173 1
1 1302 . 11 1 1 A 128 128 GLY HA3 H 126 4.249 4.050 0.199 1
1 1303 . 11 1 1 A 128 128 GLY C C 126 173.822 174.767 -0.945 1
1 1304 . 11 1 1 A 128 128 GLY CA C 126 45.549 46.726 -1.177 1
1 1305 . 11 1 1 A 128 128 GLY N N 126 108.814 110.162 -1.348 1
1 1306 . 11 1 1 A 129 129 SER H H 127 8.547 7.649 0.898 1
1 1307 . 11 1 1 A 129 129 SER HA H 127 4.486 4.746 -0.260 1
1 1309 . 11 1 1 A 129 129 SER C C 127 174.178 174.282 -0.104 1
1 1310 . 11 1 1 A 129 129 SER CA C 127 58.653 56.616 2.037 1
1 1311 . 11 1 1 A 129 129 SER CB C 127 63.316 63.169 0.147 1
1 1312 . 11 1 1 A 129 129 SER N N 127 115.599 112.288 3.311 1
1 1313 . 11 1 1 A 130 130 ARG H H 128 8.795 8.218 0.577 1
1 1314 . 11 1 1 A 130 130 ARG HA H 128 4.160 3.973 0.187 1
1 1318 . 11 1 1 A 130 130 ARG C C 128 175.518 174.752 0.766 1
1 1319 . 11 1 1 A 130 130 ARG CA C 128 58.479 58.156 0.323 1
1 1320 . 11 1 1 A 130 130 ARG CB C 128 29.952 28.160 1.792 1
1 1323 . 11 1 1 A 130 130 ARG N N 128 127.611 114.947 12.664 1
1 1324 . 11 1 1 A 131 131 PHE H H 129 9.315 8.096 1.219 1
1 1325 . 11 1 1 A 131 131 PHE HA H 129 4.878 5.122 -0.244 1
1 1331 . 11 1 1 A 131 131 PHE C C 129 175.058 174.328 0.730 1
1 1332 . 11 1 1 A 131 131 PHE CA C 129 55.953 56.407 -0.454 1
1 1333 . 11 1 1 A 131 131 PHE CB C 129 40.189 41.120 -0.931 1
1 1337 . 11 1 1 A 131 131 PHE N N 129 126.219 121.284 4.935 1
1 1338 . 11 1 1 A 132 132 GLN H H 130 8.160 8.054 0.106 1
1 1339 . 11 1 1 A 132 132 GLN HA H 130 5.013 4.962 0.051 1
1 1343 . 11 1 1 A 132 132 GLN CA C 130 54.498 54.483 0.015 1
1 1344 . 11 1 1 A 132 132 GLN CB C 130 32.106 33.293 -1.187 1
1 1346 . 11 1 1 A 132 132 GLN N N 130 125.589 125.514 0.075 1
1 1347 . 11 1 1 A 133 133 VAL H H 131 8.689 8.952 -0.263 1
1 1348 . 11 1 1 A 133 133 VAL HA H 131 4.529 4.686 -0.157 1
1 1356 . 11 1 1 A 133 133 VAL C C 131 174.441 175.500 -1.059 1
1 1357 . 11 1 1 A 133 133 VAL CA C 131 60.758 61.491 -0.733 1
1 1358 . 11 1 1 A 133 133 VAL CB C 131 32.417 32.320 0.097 1
1 1361 . 11 1 1 A 133 133 VAL N N 131 122.441 122.309 0.132 1
1 1362 . 11 1 1 A 134 134 TRP H H 132 9.256 9.412 -0.156 1
1 1363 . 11 1 1 A 134 134 TRP HA H 132 5.213 5.155 0.058 1
1 1371 . 11 1 1 A 134 134 TRP C C 132 174.575 175.820 -1.245 1
1 1372 . 11 1 1 A 134 134 TRP CA C 132 53.859 56.383 -2.524 1
1 1373 . 11 1 1 A 134 134 TRP CB C 132 31.311 31.225 0.086 1
1 1379 . 11 1 1 A 134 134 TRP N N 132 130.303 127.940 2.363 1
1 1381 . 11 1 1 A 135 135 ASP H H 133 8.237 8.879 -0.642 1
1 1382 . 11 1 1 A 135 135 ASP HA H 133 6.018 6.077 -0.059 1
1 1385 . 11 1 1 A 135 135 ASP C C 133 177.020 175.295 1.725 1
1 1386 . 11 1 1 A 135 135 ASP CA C 133 53.321 53.093 0.228 1
1 1387 . 11 1 1 A 135 135 ASP CB C 133 41.514 43.429 -1.915 1
1 1388 . 11 1 1 A 135 135 ASP N N 133 125.516 120.748 4.768 1
1 1389 . 11 1 1 A 136 136 TYR H H 134 9.058 8.535 0.523 1
1 1390 . 11 1 1 A 136 136 TYR HA H 134 4.970 5.259 -0.289 1
1 1394 . 11 1 1 A 136 136 TYR C C 134 172.324 172.937 -0.613 1
1 1395 . 11 1 1 A 136 136 TYR CA C 134 55.982 56.417 -0.435 1
1 1396 . 11 1 1 A 136 136 TYR CB C 134 42.265 40.499 1.766 1
1 1399 . 11 1 1 A 136 136 TYR N N 134 120.315 117.493 2.822 1
1 1400 . 11 1 1 A 137 137 ALA H H 135 8.521 8.580 -0.059 1
1 1401 . 11 1 1 A 137 137 ALA HA H 135 4.280 4.254 0.026 1
1 1405 . 11 1 1 A 137 137 ALA C C 135 178.561 177.283 1.278 1
1 1406 . 11 1 1 A 137 137 ALA CA C 135 49.550 50.820 -1.270 1
1 1407 . 11 1 1 A 137 137 ALA CB C 135 19.998 22.846 -2.848 1
1 1408 . 11 1 1 A 137 137 ALA N N 135 123.386 121.269 2.117 1
1 1409 . 11 1 1 A 138 138 GLU H H 136 8.678 8.535 0.143 1
1 1410 . 11 1 1 A 138 138 GLU HA H 136 3.777 4.362 -0.585 1
1 1414 . 11 1 1 A 138 138 GLU C C 136 177.624 177.270 0.354 1
1 1415 . 11 1 1 A 138 138 GLU CA C 136 60.527 58.139 2.388 1
1 1416 . 11 1 1 A 138 138 GLU CB C 136 29.020 29.202 -0.182 1
1 1418 . 11 1 1 A 138 138 GLU N N 136 121.774 119.065 2.709 1
1 1419 . 11 1 1 A 139 139 GLY H H 137 8.666 9.444 -0.778 1
1 1420 . 11 1 1 A 139 139 GLY HA2 H 137 3.872 4.069 -0.197 1
1 1421 . 11 1 1 A 139 139 GLY HA3 H 137 3.872 4.082 -0.210 1
1 1422 . 11 1 1 A 139 139 GLY C C 137 175.122 175.016 0.106 1
1 1423 . 11 1 1 A 139 139 GLY CA C 137 46.093 45.431 0.662 1
1 1424 . 11 1 1 A 139 139 GLY N N 137 106.053 108.342 -2.289 1
1 1425 . 11 1 1 A 140 140 GLU H H 138 8.305 8.517 -0.212 1
1 1426 . 11 1 1 A 140 140 GLU HA H 138 4.754 4.716 0.038 1
1 1430 . 11 1 1 A 140 140 GLU C C 138 177.819 177.744 0.075 1
1 1431 . 11 1 1 A 140 140 GLU CA C 138 55.049 55.725 -0.676 1
1 1432 . 11 1 1 A 140 140 GLU CB C 138 30.504 30.747 -0.243 1
1 1434 . 11 1 1 A 140 140 GLU N N 138 117.485 116.750 0.735 1
1 1435 . 11 1 1 A 141 141 VAL H H 139 7.267 7.338 -0.071 1
1 1436 . 11 1 1 A 141 141 VAL HA H 139 3.422 3.908 -0.486 1
1 1444 . 11 1 1 A 141 141 VAL C C 139 175.454 177.225 -1.771 1
1 1445 . 11 1 1 A 141 141 VAL CA C 139 66.769 65.283 1.486 1
1 1446 . 11 1 1 A 141 141 VAL CB C 139 31.377 31.672 -0.295 1
1 1449 . 11 1 1 A 141 141 VAL N N 139 120.764 121.162 -0.398 1
1 1450 . 11 1 1 A 142 142 GLU H H 140 8.620 8.365 0.255 1
1 1451 . 11 1 1 A 142 142 GLU HA H 140 3.592 4.011 -0.419 1
1 1452 . 11 1 1 A 142 142 GLU C C 140 177.320 179.705 -2.385 1
1 1453 . 11 1 1 A 142 142 GLU CA C 140 62.607 59.401 3.206 1
1 1454 . 11 1 1 A 142 142 GLU CB C 140 26.759 29.104 -2.345 1
1 1455 . 11 1 1 A 142 142 GLU N N 140 120.048 122.110 -2.062 1
1 1456 . 11 1 1 A 143 143 THR H H 141 7.449 8.578 -1.129 1
1 1457 . 11 1 1 A 143 143 THR HA H 141 4.003 4.216 -0.213 1
1 1462 . 11 1 1 A 143 143 THR C C 141 177.258 176.796 0.462 1
1 1463 . 11 1 1 A 143 143 THR CA C 141 65.490 67.085 -1.595 1
1 1464 . 11 1 1 A 143 143 THR CB C 141 68.641 67.854 0.787 1
1 1466 . 11 1 1 A 143 143 THR N N 141 114.073 118.442 -4.369 1
1 1467 . 11 1 1 A 144 144 MET H H 142 7.992 8.088 -0.096 1
1 1468 . 11 1 1 A 144 144 MET HA H 142 4.316 4.337 -0.021 1
1 1476 . 11 1 1 A 144 144 MET C C 142 178.233 178.653 -0.420 1
1 1477 . 11 1 1 A 144 144 MET CA C 142 57.743 59.050 -1.307 1
1 1478 . 11 1 1 A 144 144 MET CB C 142 31.326 32.547 -1.221 1
1 1481 . 11 1 1 A 144 144 MET N N 142 120.595 118.622 1.973 1
1 1482 . 11 1 1 A 145 145 LEU H H 143 7.847 8.231 -0.384 1
1 1483 . 11 1 1 A 145 145 LEU HA H 143 3.919 3.807 0.112 1
1 1491 . 11 1 1 A 145 145 LEU C C 143 178.774 179.712 -0.938 1
1 1492 . 11 1 1 A 145 145 LEU CA C 143 57.877 58.063 -0.186 1
1 1493 . 11 1 1 A 145 145 LEU CB C 143 40.951 40.719 0.232 1
1 1497 . 11 1 1 A 145 145 LEU N N 143 119.410 119.615 -0.205 1
1 1498 . 11 1 1 A 146 146 ASP H H 144 8.431 8.173 0.258 1
1 1499 . 11 1 1 A 146 146 ASP HA H 144 4.312 4.579 -0.267 1
1 1502 . 11 1 1 A 146 146 ASP C C 144 178.129 179.289 -1.160 1
1 1503 . 11 1 1 A 146 146 ASP CA C 144 57.464 57.391 0.073 1
1 1504 . 11 1 1 A 146 146 ASP CB C 144 39.548 40.567 -1.019 1
1 1505 . 11 1 1 A 146 146 ASP N N 144 119.837 120.878 -1.041 1
1 1506 . 11 1 1 A 147 147 ARG H H 145 7.949 8.467 -0.518 1
1 1507 . 11 1 1 A 147 147 ARG HA H 145 4.050 4.180 -0.130 1
1 1512 . 11 1 1 A 147 147 ARG C C 145 179.547 178.895 0.652 1
1 1513 . 11 1 1 A 147 147 ARG CA C 145 58.972 59.779 -0.807 1
1 1514 . 11 1 1 A 147 147 ARG CB C 145 29.798 30.588 -0.790 1
1 1517 . 11 1 1 A 147 147 ARG N N 145 119.173 119.914 -0.741 1
1 1518 . 11 1 1 A 148 148 TYR H H 146 8.128 8.348 -0.220 1
1 1519 . 11 1 1 A 148 148 TYR HA H 146 3.995 4.400 -0.405 1
1 1524 . 11 1 1 A 148 148 TYR C C 146 178.199 177.629 0.570 1
1 1525 . 11 1 1 A 148 148 TYR CA C 146 62.347 61.566 0.781 1
1 1526 . 11 1 1 A 148 148 TYR CB C 146 37.418 37.832 -0.414 1
1 1529 . 11 1 1 A 148 148 TYR N N 146 120.102 121.412 -1.310 1
1 1530 . 11 1 1 A 149 149 PHE H H 147 8.308 8.476 -0.168 1
1 1531 . 11 1 1 A 149 149 PHE HA H 147 4.013 4.364 -0.351 1
1 1535 . 11 1 1 A 149 149 PHE C C 147 177.574 178.312 -0.738 1
1 1536 . 11 1 1 A 149 149 PHE CA C 147 63.044 61.629 1.415 1
1 1537 . 11 1 1 A 149 149 PHE CB C 147 37.153 38.388 -1.235 1
1 1541 . 11 1 1 A 149 149 PHE N N 147 116.680 117.043 -0.363 1
1 1542 . 11 1 1 A 150 150 GLU H H 148 8.271 8.956 -0.685 1
1 1543 . 11 1 1 A 150 150 GLU HA H 148 4.030 3.989 0.041 1
1 1547 . 11 1 1 A 150 150 GLU C C 148 177.687 178.934 -1.247 1
1 1548 . 11 1 1 A 150 150 GLU CA C 148 58.746 59.782 -1.036 1
1 1549 . 11 1 1 A 150 150 GLU CB C 148 28.847 29.150 -0.303 1
1 1551 . 11 1 1 A 150 150 GLU N N 148 119.973 120.120 -0.147 1
1 1552 . 11 1 1 A 151 151 ALA H H 149 6.992 7.646 -0.654 1
1 1553 . 11 1 1 A 151 151 ALA HA H 149 4.217 4.184 0.033 1
1 1557 . 11 1 1 A 151 151 ALA C C 149 178.190 177.475 0.715 1
1 1558 . 11 1 1 A 151 151 ALA CA C 149 52.779 54.234 -1.455 1
1 1559 . 11 1 1 A 151 151 ALA CB C 149 19.087 18.852 0.235 1
1 1560 . 11 1 1 A 151 151 ALA N N 149 118.629 121.555 -2.926 1
1 1561 . 11 1 1 A 152 152 TYR H H 150 7.722 8.185 -0.463 1
1 1562 . 11 1 1 A 152 152 TYR HA H 150 4.137 4.870 -0.733 1
1 1567 . 11 1 1 A 152 152 TYR C C 150 175.703 174.081 1.622 1
1 1568 . 11 1 1 A 152 152 TYR CA C 150 59.260 57.280 1.980 1
1 1569 . 11 1 1 A 152 152 TYR CB C 150 39.165 40.342 -1.177 1
1 1572 . 11 1 1 A 152 152 TYR N N 150 118.767 115.169 3.598 1
1 1573 . 11 1 1 A 153 153 LEU H H 151 7.670 8.640 -0.970 1
1 1574 . 11 1 1 A 153 153 LEU HA H 151 4.145 4.222 -0.077 1
1 1584 . 11 1 1 A 153 153 LEU CA C 151 54.704 55.724 -1.020 1
1 1585 . 11 1 1 A 153 153 LEU CB C 151 40.520 44.482 -3.962 1
1 1589 . 11 1 1 A 153 153 LEU N N 151 122.313 126.170 -3.857 1
1 1590 . 11 1 1 A 154 154 PRO HA H 152 4.258 4.183 0.075 1
1 1597 . 11 1 1 A 154 154 PRO C C 152 177.496 178.827 -1.331 1
1 1598 . 11 1 1 A 154 154 PRO CA C 152 63.899 65.887 -1.988 1
1 1599 . 11 1 1 A 154 154 PRO CB C 152 31.080 31.244 -0.164 1
1 1602 . 11 1 1 A 155 155 GLN H H 153 8.023 8.313 -0.290 1
1 1603 . 11 1 1 A 155 155 GLN HA H 153 4.176 4.144 0.032 1
1 1607 . 11 1 1 A 155 155 GLN C C 153 176.636 178.625 -1.989 1
1 1608 . 11 1 1 A 155 155 GLN CA C 153 55.968 59.005 -3.037 1
1 1609 . 11 1 1 A 155 155 GLN CB C 153 28.723 28.160 0.563 1
1 1610 . 11 1 1 A 155 155 GLN N N 153 119.173 117.156 2.017 1
1 1611 . 11 1 1 A 156 156 LYS H H 154 8.113 7.934 0.179 1
1 1612 . 11 1 1 A 156 156 LYS HA H 154 4.196 4.168 0.028 1
1 1619 . 11 1 1 A 156 156 LYS C C 154 56.493 177.747 -121.254 1
1 1620 . 11 1 1 A 156 156 LYS CA C 154 56.493 58.164 -1.671 1
1 1621 . 11 1 1 A 156 156 LYS CB C 154 32.037 32.392 -0.355 1
1 1625 . 11 1 1 A 156 156 LYS N N 154 122.788 118.984 3.804 1
1 1626 . 11 1 1 A 157 157 THR H H 155 8.013 7.529 0.484 1
1 1627 . 11 1 1 A 157 157 THR HA H 155 4.183 4.343 -0.160 1
1 1632 . 11 1 1 A 157 157 THR C C 155 174.580 173.908 0.672 1
1 1633 . 11 1 1 A 157 157 THR CA C 155 61.958 61.979 -0.021 1
1 1634 . 11 1 1 A 157 157 THR CB C 155 69.665 68.341 1.324 1
1 1636 . 11 1 1 A 157 157 THR N N 155 115.504 113.207 2.297 1
1 1637 . 11 1 1 A 158 158 ALA H H 156 8.170 8.652 -0.482 1
1 1638 . 11 1 1 A 158 158 ALA HA H 156 4.220 3.896 0.324 1
1 1642 . 11 1 1 A 158 158 ALA CA C 156 52.492 52.939 -0.447 1
1 1643 . 11 1 1 A 158 158 ALA CB C 156 18.810 16.960 1.850 1
1 1644 . 11 1 1 A 158 158 ALA N N 156 126.825 120.875 5.950 1
1 1645 . 11 1 1 A 159 159 SER H H 157 7.762 7.336 0.426 1
1 1646 . 11 1 1 A 159 159 SER CA C 157 58.230 58.395 -0.165 1
1 1647 . 11 1 1 A 159 159 SER CB C 157 63.440 64.106 -0.666 1
1 1648 . 11 1 1 A 159 159 SER N N 157 123.078 112.204 10.874 1
1 1649 . 11 1 1 A 162 162 HIS HA H 160 4.845 4.104 0.741 1
1 1652 . 11 1 1 A 162 162 HIS CA C 160 53.590 56.563 -2.973 1
1 1653 . 11 1 1 A 162 162 HIS CB C 160 29.398 27.468 1.930 1
1 1654 . 11 1 1 A 163 163 PRO HA H 161 4.388 4.389 -0.001 1
1 1660 . 11 1 1 A 163 163 PRO C C 161 177.018 176.989 0.029 1
1 1661 . 11 1 1 A 163 163 PRO CA C 161 63.118 65.125 -2.007 1
1 1662 . 11 1 1 A 163 163 PRO CB C 161 31.668 31.858 -0.190 1
1 1665 . 11 1 1 A 164 164 SER H H 162 8.418 7.724 0.694 1
1 1666 . 11 1 1 A 164 164 SER HA H 162 4.338 4.421 -0.083 1
1 1668 . 11 1 1 A 164 164 SER C C 162 173.327 173.704 -0.377 1
1 1669 . 11 1 1 A 164 164 SER CA C 162 58.202 58.421 -0.219 1
1 1670 . 11 1 1 A 164 164 SER CB C 162 64.080 64.214 -0.134 1
1 1671 . 11 1 1 A 164 164 SER N N 162 117.485 114.873 2.612 1
1 6 . 12 1 1 A 4 4 ALA H H 2 8.270 8.535 -0.265 1
1 7 . 12 1 1 A 4 4 ALA HA H 2 4.212 4.121 0.091 1
1 11 . 12 1 1 A 4 4 ALA C C 2 177.441 177.816 -0.375 1
1 12 . 12 1 1 A 4 4 ALA CA C 2 52.280 54.485 -2.205 1
1 13 . 12 1 1 A 4 4 ALA CB C 2 18.880 18.747 0.133 1
1 14 . 12 1 1 A 4 4 ALA N N 2 126.500 126.455 0.045 1
1 15 . 12 1 1 A 5 5 ALA H H 3 8.251 7.500 0.751 1
1 16 . 12 1 1 A 5 5 ALA HA H 3 4.261 4.314 -0.053 1
1 20 . 12 1 1 A 5 5 ALA C C 3 177.824 177.494 0.330 1
1 21 . 12 1 1 A 5 5 ALA CA C 3 52.347 52.759 -0.412 1
1 22 . 12 1 1 A 5 5 ALA CB C 3 18.869 19.230 -0.361 1
1 23 . 12 1 1 A 5 5 ALA N N 3 124.322 121.880 2.442 1
1 24 . 12 1 1 A 6 6 SER H H 4 8.158 8.526 -0.368 1
1 25 . 12 1 1 A 6 6 SER HA H 4 4.358 4.734 -0.376 1
1 27 . 12 1 1 A 6 6 SER C C 4 175.222 174.243 0.979 1
1 28 . 12 1 1 A 6 6 SER CA C 4 58.438 57.751 0.687 1
1 29 . 12 1 1 A 6 6 SER CB C 4 63.859 64.873 -1.014 1
1 30 . 12 1 1 A 6 6 SER N N 4 115.338 115.252 0.086 1
1 31 . 12 1 1 A 7 7 GLY H H 5 8.265 8.399 -0.134 1
1 32 . 12 1 1 A 7 7 GLY HA2 H 5 3.900 4.275 -0.375 1
1 33 . 12 1 1 A 7 7 GLY C C 5 174.083 171.923 2.160 1
1 34 . 12 1 1 A 7 7 GLY CA C 5 45.113 45.175 -0.062 1
1 35 . 12 1 1 A 7 7 GLY N N 5 111.360 107.665 3.695 1
1 36 . 12 1 1 A 8 8 GLU H H 6 8.100 8.416 -0.316 1
1 37 . 12 1 1 A 8 8 GLU HA H 6 4.209 4.271 -0.062 1
1 41 . 12 1 1 A 8 8 GLU C C 6 176.354 177.000 -0.646 1
1 42 . 12 1 1 A 8 8 GLU CA C 6 56.261 56.120 0.141 1
1 43 . 12 1 1 A 8 8 GLU CB C 6 29.830 30.193 -0.363 1
1 45 . 12 1 1 A 8 8 GLU N N 6 121.056 119.101 1.955 1
1 46 . 12 1 1 A 9 9 GLN H H 7 8.287 8.498 -0.211 1
1 47 . 12 1 1 A 9 9 GLN HA H 7 4.247 4.427 -0.180 1
1 51 . 12 1 1 A 9 9 GLN C C 7 172.457 175.219 -2.762 1
1 52 . 12 1 1 A 9 9 GLN CA C 7 55.269 56.149 -0.880 1
1 53 . 12 1 1 A 9 9 GLN CB C 7 29.236 29.915 -0.679 1
1 55 . 12 1 1 A 9 9 GLN N N 7 122.164 121.339 0.825 1
1 56 . 12 1 1 A 10 10 ALA H H 8 8.368 8.376 -0.008 1
1 57 . 12 1 1 A 10 10 ALA HA H 8 4.509 4.940 -0.431 1
1 61 . 12 1 1 A 10 10 ALA CA C 8 50.341 49.785 0.556 1
1 62 . 12 1 1 A 10 10 ALA CB C 8 18.140 22.591 -4.451 1
1 63 . 12 1 1 A 10 10 ALA N N 8 128.028 121.247 6.781 1
1 64 . 12 1 1 A 11 11 PRO HA H 9 4.437 4.511 -0.074 1
1 70 . 12 1 1 A 11 11 PRO C C 9 176.381 176.851 -0.470 1
1 71 . 12 1 1 A 11 11 PRO CA C 9 63.298 62.424 0.874 1
1 72 . 12 1 1 A 11 11 PRO CB C 9 31.776 32.382 -0.606 1
1 75 . 12 1 1 A 12 12 CYS H H 10 8.056 8.388 -0.332 1
1 76 . 12 1 1 A 12 12 CYS HA H 10 4.717 4.474 0.243 1
1 79 . 12 1 1 A 12 12 CYS C C 10 173.266 174.863 -1.597 1
1 80 . 12 1 1 A 12 12 CYS CA C 10 57.398 58.995 -1.597 1
1 81 . 12 1 1 A 12 12 CYS CB C 10 29.165 28.818 0.347 1
1 82 . 12 1 1 A 12 12 CYS N N 10 118.295 119.312 -1.017 1
1 83 . 12 1 1 A 13 13 SER H H 11 9.815 8.456 1.359 1
1 84 . 12 1 1 A 13 13 SER HA H 11 5.227 5.509 -0.282 1
1 87 . 12 1 1 A 13 13 SER C C 11 173.648 173.824 -0.176 1
1 88 . 12 1 1 A 13 13 SER CA C 11 57.630 55.850 1.780 1
1 89 . 12 1 1 A 13 13 SER CB C 11 64.820 66.247 -1.427 1
1 90 . 12 1 1 A 13 13 SER N N 11 122.365 113.533 8.832 1
1 91 . 12 1 1 A 14 14 VAL H H 12 9.352 9.608 -0.256 1
1 92 . 12 1 1 A 14 14 VAL HA H 12 4.696 5.213 -0.517 1
1 100 . 12 1 1 A 14 14 VAL C C 12 173.875 173.176 0.699 1
1 101 . 12 1 1 A 14 14 VAL CA C 12 60.146 61.284 -1.138 1
1 102 . 12 1 1 A 14 14 VAL CB C 12 34.499 35.003 -0.504 1
1 105 . 12 1 1 A 14 14 VAL N N 12 126.378 121.868 4.510 1
1 106 . 12 1 1 A 15 15 TYR H H 13 8.745 9.255 -0.510 1
1 111 . 12 1 1 A 15 15 TYR C C 13 173.345 173.938 -0.593 1
1 112 . 12 1 1 A 15 15 TYR CA C 13 56.186 56.987 -0.801 1
1 113 . 12 1 1 A 15 15 TYR CB C 13 40.858 41.447 -0.589 1
1 116 . 12 1 1 A 15 15 TYR N N 13 129.472 128.563 0.909 1
1 117 . 12 1 1 A 16 16 PHE H H 14 7.370 8.322 -0.952 1
1 118 . 12 1 1 A 16 16 PHE HA H 14 5.720 5.068 0.652 1
1 123 . 12 1 1 A 16 16 PHE C C 14 174.058 173.689 0.369 1
1 124 . 12 1 1 A 16 16 PHE CA C 14 54.361 56.471 -2.110 1
1 125 . 12 1 1 A 16 16 PHE CB C 14 40.461 41.566 -1.105 1
1 129 . 12 1 1 A 16 16 PHE N N 14 128.263 128.256 0.007 1
1 130 . 12 1 1 A 17 17 CYS H H 15 8.147 8.492 -0.345 1
1 131 . 12 1 1 A 17 17 CYS CA C 15 56.570 57.711 -1.141 1
1 132 . 12 1 1 A 17 17 CYS CB C 15 29.690 29.289 0.401 1
1 133 . 12 1 1 A 17 17 CYS N N 15 126.188 125.658 0.530 1
1 134 . 12 1 1 A 18 18 GLY HA2 H 16 3.819 4.248 -0.429 1
1 135 . 12 1 1 A 18 18 GLY C C 16 173.374 174.931 -1.557 1
1 136 . 12 1 1 A 18 18 GLY CA C 16 45.510 43.789 1.721 1
1 137 . 12 1 1 A 19 19 SER H H 17 8.533 8.951 -0.418 1
1 138 . 12 1 1 A 19 19 SER HA H 17 4.505 4.268 0.237 1
1 139 . 12 1 1 A 19 19 SER CA C 17 58.700 62.914 -4.214 1
1 140 . 12 1 1 A 19 19 SER CB C 17 63.810 63.178 0.632 1
1 141 . 12 1 1 A 19 19 SER N N 17 117.300 116.130 1.170 1
1 142 . 12 1 1 A 20 20 ILE HA H 18 4.309 4.011 0.298 1
1 152 . 12 1 1 A 20 20 ILE CA C 18 61.317 63.412 -2.095 1
1 153 . 12 1 1 A 20 20 ILE CB C 18 38.302 36.781 1.521 1
1 157 . 12 1 1 A 21 21 ARG HA H 19 4.172 3.994 0.178 1
1 160 . 12 1 1 A 21 21 ARG C C 19 177.118 175.313 1.805 1
1 161 . 12 1 1 A 21 21 ARG CA C 19 56.960 57.053 -0.093 1
1 162 . 12 1 1 A 21 21 ARG CB C 19 29.568 29.358 0.210 1
1 165 . 12 1 1 A 22 22 GLY H H 20 8.685 8.243 0.442 1
1 166 . 12 1 1 A 22 22 GLY HA2 H 20 3.801 4.010 -0.209 1
1 167 . 12 1 1 A 22 22 GLY HA3 H 20 3.923 4.012 -0.089 1
1 168 . 12 1 1 A 22 22 GLY C C 20 174.814 175.120 -0.306 1
1 169 . 12 1 1 A 22 22 GLY CA C 20 45.289 44.971 0.318 1
1 170 . 12 1 1 A 22 22 GLY N N 20 110.145 108.326 1.819 1
1 171 . 12 1 1 A 23 23 GLY H H 21 8.058 8.525 -0.467 1
1 172 . 12 1 1 A 23 23 GLY HA2 H 21 3.998 4.034 -0.036 1
1 173 . 12 1 1 A 23 23 GLY HA3 H 21 4.237 4.035 0.202 1
1 174 . 12 1 1 A 23 23 GLY C C 21 174.762 173.715 1.047 1
1 175 . 12 1 1 A 23 23 GLY CA C 21 45.025 44.812 0.213 1
1 176 . 12 1 1 A 23 23 GLY N N 21 109.327 108.955 0.372 1
1 177 . 12 1 1 A 24 24 ARG H H 22 8.376 8.225 0.151 1
1 178 . 12 1 1 A 24 24 ARG HA H 22 4.086 4.672 -0.586 1
1 184 . 12 1 1 A 24 24 ARG C C 22 178.178 176.338 1.840 1
1 185 . 12 1 1 A 24 24 ARG CA C 22 57.471 54.692 2.779 1
1 186 . 12 1 1 A 24 24 ARG CB C 22 29.653 31.222 -1.569 1
1 189 . 12 1 1 A 24 24 ARG N N 22 120.861 121.024 -0.163 1
1 190 . 12 1 1 A 25 25 GLU H H 23 8.831 8.775 0.056 1
1 191 . 12 1 1 A 25 25 GLU HA H 23 4.015 3.957 0.058 1
1 195 . 12 1 1 A 25 25 GLU C C 23 178.005 178.142 -0.137 1
1 196 . 12 1 1 A 25 25 GLU CA C 23 58.920 59.575 -0.655 1
1 197 . 12 1 1 A 25 25 GLU CB C 23 28.592 29.310 -0.718 1
1 199 . 12 1 1 A 25 25 GLU N N 23 121.243 117.551 3.692 1
1 200 . 12 1 1 A 26 26 ASP H H 24 7.897 8.160 -0.263 1
1 201 . 12 1 1 A 26 26 ASP HA H 24 4.516 4.106 0.410 1
1 203 . 12 1 1 A 26 26 ASP C C 24 176.455 178.438 -1.983 1
1 204 . 12 1 1 A 26 26 ASP CA C 24 55.122 56.007 -0.885 1
1 205 . 12 1 1 A 26 26 ASP CB C 24 39.888 40.092 -0.204 1
1 206 . 12 1 1 A 26 26 ASP N N 24 119.541 119.675 -0.134 1
1 207 . 12 1 1 A 27 27 GLN H H 25 7.696 7.522 0.174 1
1 208 . 12 1 1 A 27 27 GLN HA H 25 3.704 3.822 -0.118 1
1 212 . 12 1 1 A 27 27 GLN C C 25 177.016 178.073 -1.057 1
1 213 . 12 1 1 A 27 27 GLN CA C 25 59.501 58.434 1.067 1
1 214 . 12 1 1 A 27 27 GLN CB C 25 27.762 28.815 -1.053 1
1 216 . 12 1 1 A 27 27 GLN N N 25 119.471 120.177 -0.706 1
1 217 . 12 1 1 A 28 28 ALA H H 26 8.227 7.862 0.365 1
1 218 . 12 1 1 A 28 28 ALA HA H 26 4.072 4.277 -0.205 1
1 222 . 12 1 1 A 28 28 ALA C C 26 180.567 179.838 0.729 1
1 223 . 12 1 1 A 28 28 ALA CA C 26 54.627 55.113 -0.486 1
1 224 . 12 1 1 A 28 28 ALA CB C 26 17.355 18.069 -0.714 1
1 225 . 12 1 1 A 28 28 ALA N N 26 122.362 122.116 0.246 1
1 226 . 12 1 1 A 29 29 LEU H H 27 7.533 8.252 -0.719 1
1 227 . 12 1 1 A 29 29 LEU HA H 27 4.050 4.087 -0.037 1
1 237 . 12 1 1 A 29 29 LEU C C 27 178.752 177.963 0.789 1
1 238 . 12 1 1 A 29 29 LEU CA C 27 57.578 57.641 -0.063 1
1 239 . 12 1 1 A 29 29 LEU CB C 27 40.734 41.671 -0.937 1
1 243 . 12 1 1 A 29 29 LEU N N 27 122.255 119.734 2.521 1
1 244 . 12 1 1 A 30 30 TYR H H 28 8.473 8.010 0.463 1
1 245 . 12 1 1 A 30 30 TYR HA H 28 4.049 4.216 -0.167 1
1 250 . 12 1 1 A 30 30 TYR C C 28 177.736 178.460 -0.724 1
1 251 . 12 1 1 A 30 30 TYR CA C 28 59.817 60.273 -0.456 1
1 252 . 12 1 1 A 30 30 TYR CB C 28 36.140 37.062 -0.922 1
1 255 . 12 1 1 A 30 30 TYR N N 28 120.403 118.421 1.982 1
1 256 . 12 1 1 A 31 31 ALA H H 29 8.008 8.559 -0.551 1
1 257 . 12 1 1 A 31 31 ALA HA H 29 4.005 4.026 -0.021 1
1 261 . 12 1 1 A 31 31 ALA C C 29 180.879 179.723 1.156 1
1 262 . 12 1 1 A 31 31 ALA CA C 29 54.914 55.298 -0.384 1
1 263 . 12 1 1 A 31 31 ALA CB C 29 17.375 18.128 -0.753 1
1 264 . 12 1 1 A 31 31 ALA N N 29 120.771 123.001 -2.230 1
1 265 . 12 1 1 A 32 32 ARG H H 30 7.596 7.630 -0.034 1
1 266 . 12 1 1 A 32 32 ARG HA H 30 3.916 4.074 -0.158 1
1 273 . 12 1 1 A 32 32 ARG C C 30 179.919 178.622 1.297 1
1 274 . 12 1 1 A 32 32 ARG CA C 30 59.014 59.139 -0.125 1
1 275 . 12 1 1 A 32 32 ARG CB C 30 30.531 29.792 0.739 1
1 278 . 12 1 1 A 32 32 ARG N N 30 120.365 118.156 2.209 1
1 279 . 12 1 1 A 33 33 ILE H H 31 8.066 8.493 -0.427 1
1 280 . 12 1 1 A 33 33 ILE HA H 31 3.120 3.796 -0.676 1
1 290 . 12 1 1 A 33 33 ILE C C 31 177.051 178.574 -1.523 1
1 291 . 12 1 1 A 33 33 ILE CA C 31 65.757 65.332 0.425 1
1 292 . 12 1 1 A 33 33 ILE CB C 31 36.928 38.040 -1.112 1
1 296 . 12 1 1 A 33 33 ILE N N 31 121.608 119.696 1.912 1
1 297 . 12 1 1 A 34 34 VAL H H 32 8.148 9.175 -1.027 1
1 298 . 12 1 1 A 34 34 VAL HA H 32 2.954 3.746 -0.792 1
1 306 . 12 1 1 A 34 34 VAL C C 32 177.159 177.972 -0.813 1
1 307 . 12 1 1 A 34 34 VAL CA C 32 67.220 66.437 0.783 1
1 308 . 12 1 1 A 34 34 VAL CB C 32 31.039 31.181 -0.142 1
1 311 . 12 1 1 A 34 34 VAL N N 32 119.318 121.178 -1.860 1
1 312 . 12 1 1 A 35 35 SER H H 33 7.826 8.652 -0.826 1
1 313 . 12 1 1 A 35 35 SER HA H 33 3.868 4.128 -0.260 1
1 316 . 12 1 1 A 35 35 SER C C 33 176.779 177.130 -0.351 1
1 317 . 12 1 1 A 35 35 SER CA C 33 62.000 61.650 0.350 1
1 318 . 12 1 1 A 35 35 SER CB C 33 62.789 62.375 0.414 1
1 319 . 12 1 1 A 35 35 SER N N 33 111.936 115.151 -3.215 1
1 320 . 12 1 1 A 36 36 ARG H H 34 7.405 7.649 -0.244 1
1 321 . 12 1 1 A 36 36 ARG HA H 34 4.070 4.039 0.031 1
1 323 . 12 1 1 A 36 36 ARG C C 34 178.047 178.053 -0.006 1
1 324 . 12 1 1 A 36 36 ARG CA C 34 56.108 58.890 -2.782 1
1 325 . 12 1 1 A 36 36 ARG CB C 34 28.837 29.826 -0.989 1
1 326 . 12 1 1 A 36 36 ARG N N 34 120.909 122.131 -1.222 1
1 327 . 12 1 1 A 37 37 LEU H H 35 8.301 8.110 0.191 1
1 328 . 12 1 1 A 37 37 LEU HA H 35 3.620 3.877 -0.257 1
1 336 . 12 1 1 A 37 37 LEU C C 35 178.446 179.173 -0.727 1
1 337 . 12 1 1 A 37 37 LEU CA C 35 57.640 57.782 -0.142 1
1 338 . 12 1 1 A 37 37 LEU CB C 35 41.584 41.464 0.120 1
1 342 . 12 1 1 A 37 37 LEU N N 35 118.567 119.957 -1.390 1
1 343 . 12 1 1 A 38 38 ARG H H 36 7.379 8.823 -1.444 1
1 344 . 12 1 1 A 38 38 ARG HA H 36 4.340 3.998 0.342 1
1 350 . 12 1 1 A 38 38 ARG C C 36 177.895 178.930 -1.035 1
1 351 . 12 1 1 A 38 38 ARG CA C 36 57.785 59.269 -1.484 1
1 352 . 12 1 1 A 38 38 ARG CB C 36 29.775 29.844 -0.069 1
1 355 . 12 1 1 A 38 38 ARG N N 36 115.352 118.306 -2.954 1
1 356 . 12 1 1 A 39 39 ARG H H 37 7.240 7.803 -0.563 1
1 357 . 12 1 1 A 39 39 ARG HA H 37 3.743 4.273 -0.530 1
1 363 . 12 1 1 A 39 39 ARG C C 37 176.988 176.196 0.792 1
1 364 . 12 1 1 A 39 39 ARG CA C 37 57.605 58.789 -1.184 1
1 365 . 12 1 1 A 39 39 ARG CB C 37 28.925 30.777 -1.852 1
1 368 . 12 1 1 A 39 39 ARG N N 37 117.410 117.716 -0.306 1
1 369 . 12 1 1 A 40 40 TYR H H 38 7.296 7.380 -0.084 1
1 370 . 12 1 1 A 40 40 TYR HA H 38 4.319 5.017 -0.698 1
1 375 . 12 1 1 A 40 40 TYR C C 38 175.001 174.855 0.146 1
1 376 . 12 1 1 A 40 40 TYR CA C 38 57.730 55.952 1.778 1
1 377 . 12 1 1 A 40 40 TYR CB C 38 39.343 41.327 -1.984 1
1 380 . 12 1 1 A 40 40 TYR N N 38 116.937 116.014 0.923 1
1 381 . 12 1 1 A 41 41 GLY H H 39 7.325 8.590 -1.265 1
1 382 . 12 1 1 A 41 41 GLY HA2 H 39 3.953 3.678 0.275 1
1 383 . 12 1 1 A 41 41 GLY C C 39 171.302 174.676 -3.374 1
1 384 . 12 1 1 A 41 41 GLY CA C 39 45.590 46.776 -1.186 1
1 385 . 12 1 1 A 41 41 GLY N N 39 105.596 110.380 -4.784 1
1 386 . 12 1 1 A 42 42 LYS H H 40 8.186 7.703 0.483 1
1 387 . 12 1 1 A 42 42 LYS HA H 40 4.205 4.155 0.050 1
1 393 . 12 1 1 A 42 42 LYS C C 40 175.672 176.256 -0.584 1
1 394 . 12 1 1 A 42 42 LYS CA C 40 55.241 57.207 -1.966 1
1 395 . 12 1 1 A 42 42 LYS CB C 40 32.889 33.563 -0.674 1
1 399 . 12 1 1 A 42 42 LYS N N 40 120.341 120.237 0.104 1
1 400 . 12 1 1 A 43 43 VAL H H 41 8.610 8.744 -0.134 1
1 401 . 12 1 1 A 43 43 VAL HA H 41 4.416 4.209 0.207 1
1 409 . 12 1 1 A 43 43 VAL C C 41 175.997 175.575 0.422 1
1 410 . 12 1 1 A 43 43 VAL CA C 41 61.331 62.926 -1.595 1
1 411 . 12 1 1 A 43 43 VAL CB C 41 30.573 30.486 0.087 1
1 414 . 12 1 1 A 43 43 VAL N N 41 127.312 126.685 0.627 1
1 415 . 12 1 1 A 44 44 LEU H H 42 8.894 8.117 0.777 1
1 416 . 12 1 1 A 44 44 LEU HA H 42 4.496 4.007 0.489 1
1 424 . 12 1 1 A 44 44 LEU CA C 42 54.522 58.425 -3.903 1
1 425 . 12 1 1 A 44 44 LEU CB C 42 40.980 41.919 -0.939 1
1 429 . 12 1 1 A 44 44 LEU N N 42 130.261 129.160 1.101 1
1 430 . 12 1 1 A 45 45 THR HA H 43 4.263 4.379 -0.116 1
1 435 . 12 1 1 A 45 45 THR CA C 43 61.033 61.768 -0.735 1
1 436 . 12 1 1 A 45 45 THR CB C 43 69.768 66.974 2.794 1
1 440 . 12 1 1 A 46 46 GLU CA C 44 56.411 59.190 -2.779 1
1 441 . 12 1 1 A 46 46 GLU CB C 44 29.827 29.208 0.619 1
1 443 . 12 1 1 A 47 47 HIS HA H 45 4.549 4.106 0.443 1
1 447 . 12 1 1 A 47 47 HIS C C 45 174.812 176.936 -2.124 1
1 448 . 12 1 1 A 47 47 HIS CA C 45 56.107 59.267 -3.160 1
1 449 . 12 1 1 A 47 47 HIS CB C 45 29.080 29.726 -0.646 1
1 451 . 12 1 1 A 48 48 VAL H H 46 7.826 8.089 -0.263 1
1 452 . 12 1 1 A 48 48 VAL HA H 46 4.024 3.566 0.458 1
1 460 . 12 1 1 A 48 48 VAL C C 46 175.697 177.177 -1.480 1
1 461 . 12 1 1 A 48 48 VAL CA C 46 61.841 65.973 -4.132 1
1 462 . 12 1 1 A 48 48 VAL CB C 46 32.600 31.317 1.283 1
1 465 . 12 1 1 A 48 48 VAL N N 46 121.117 119.410 1.707 1
1 466 . 12 1 1 A 49 49 ALA H H 47 8.237 7.347 0.890 1
1 467 . 12 1 1 A 49 49 ALA HA H 47 4.281 4.355 -0.074 1
1 471 . 12 1 1 A 49 49 ALA C C 47 177.173 178.403 -1.230 1
1 472 . 12 1 1 A 49 49 ALA CA C 47 52.207 53.440 -1.233 1
1 473 . 12 1 1 A 49 49 ALA CB C 47 19.064 19.898 -0.834 1
1 474 . 12 1 1 A 49 49 ALA N N 47 126.817 122.513 4.304 1
1 475 . 12 1 1 A 50 50 ASP H H 48 8.029 8.273 -0.244 1
1 476 . 12 1 1 A 50 50 ASP HA H 48 4.436 4.266 0.170 1
1 479 . 12 1 1 A 50 50 ASP C C 48 176.124 178.619 -2.495 1
1 480 . 12 1 1 A 50 50 ASP CA C 48 54.447 57.135 -2.688 1
1 481 . 12 1 1 A 50 50 ASP CB C 48 40.877 40.005 0.872 1
1 482 . 12 1 1 A 50 50 ASP N N 48 119.687 119.672 0.015 1
1 483 . 12 1 1 A 51 51 ALA H H 49 8.094 8.307 -0.213 1
1 484 . 12 1 1 A 51 51 ALA HA H 49 4.134 3.537 0.597 1
1 488 . 12 1 1 A 51 51 ALA C C 49 177.835 179.604 -1.769 1
1 489 . 12 1 1 A 51 51 ALA CA C 49 52.900 55.117 -2.217 1
1 490 . 12 1 1 A 51 51 ALA CB C 49 18.942 18.513 0.429 1
1 491 . 12 1 1 A 51 51 ALA N N 49 124.400 121.084 3.316 1
1 492 . 12 1 1 A 52 52 GLU H H 50 8.243 7.836 0.407 1
1 493 . 12 1 1 A 52 52 GLU HA H 50 4.152 4.188 -0.036 1
1 497 . 12 1 1 A 52 52 GLU C C 50 176.456 176.552 -0.096 1
1 498 . 12 1 1 A 52 52 GLU CA C 50 56.480 58.205 -1.725 1
1 499 . 12 1 1 A 52 52 GLU CB C 50 29.470 29.421 0.049 1
1 501 . 12 1 1 A 52 52 GLU N N 50 118.917 115.539 3.378 1
1 502 . 12 1 1 A 53 53 LEU H H 51 7.839 9.538 -1.699 1
1 503 . 12 1 1 A 53 53 LEU HA H 51 4.229 4.250 -0.021 1
1 513 . 12 1 1 A 53 53 LEU C C 51 177.058 176.542 0.516 1
1 514 . 12 1 1 A 53 53 LEU CA C 51 54.625 55.426 -0.801 1
1 515 . 12 1 1 A 53 53 LEU CB C 51 42.125 42.036 0.089 1
1 519 . 12 1 1 A 53 53 LEU N N 51 122.169 118.859 3.310 1
1 520 . 12 1 1 A 54 54 GLU H H 52 8.104 8.860 -0.756 1
1 521 . 12 1 1 A 54 54 GLU HA H 52 4.470 4.310 0.160 1
1 525 . 12 1 1 A 54 54 GLU CA C 52 54.286 58.148 -3.862 1
1 526 . 12 1 1 A 54 54 GLU CB C 52 29.268 28.630 0.638 1
1 528 . 12 1 1 A 54 54 GLU N N 52 123.040 117.765 5.275 1
1 529 . 12 1 1 A 55 55 PRO HA H 53 4.310 4.663 -0.353 1
1 536 . 12 1 1 A 55 55 PRO C C 53 177.019 177.275 -0.256 1
1 537 . 12 1 1 A 55 55 PRO CA C 53 63.075 62.410 0.665 1
1 538 . 12 1 1 A 55 55 PRO CB C 53 31.329 30.199 1.130 1
1 541 . 12 1 1 A 56 56 LEU H H 54 8.263 8.119 0.144 1
1 542 . 12 1 1 A 56 56 LEU HA H 54 4.237 4.146 0.091 1
1 552 . 12 1 1 A 56 56 LEU C C 54 178.055 178.006 0.049 1
1 553 . 12 1 1 A 56 56 LEU CA C 54 55.018 55.473 -0.455 1
1 554 . 12 1 1 A 56 56 LEU CB C 54 41.990 42.448 -0.458 1
1 558 . 12 1 1 A 56 56 LEU N N 54 122.728 123.628 -0.900 1
1 559 . 12 1 1 A 57 57 GLY H H 55 8.231 8.675 -0.444 1
1 560 . 12 1 1 A 57 57 GLY HA2 H 55 3.911 3.983 -0.072 1
1 561 . 12 1 1 A 57 57 GLY HA3 H 55 3.808 3.986 -0.178 1
1 562 . 12 1 1 A 57 57 GLY C C 55 174.379 174.899 -0.520 1
1 563 . 12 1 1 A 57 57 GLY CA C 55 45.092 45.475 -0.383 1
1 564 . 12 1 1 A 57 57 GLY N N 55 110.035 109.747 0.288 1
1 565 . 12 1 1 A 58 58 GLU H H 56 8.241 8.455 -0.214 1
1 566 . 12 1 1 A 58 58 GLU HA H 56 4.136 3.871 0.265 1
1 570 . 12 1 1 A 58 58 GLU C C 56 176.868 176.215 0.653 1
1 571 . 12 1 1 A 58 58 GLU CA C 56 56.734 58.196 -1.462 1
1 572 . 12 1 1 A 58 58 GLU CB C 56 29.584 27.541 2.043 1
1 574 . 12 1 1 A 58 58 GLU N N 56 121.173 111.434 9.739 1
1 575 . 12 1 1 A 59 59 GLU H H 57 8.419 8.797 -0.378 1
1 576 . 12 1 1 A 59 59 GLU HA H 57 4.074 4.080 -0.006 1
1 580 . 12 1 1 A 59 59 GLU C C 57 176.502 177.482 -0.980 1
1 581 . 12 1 1 A 59 59 GLU CA C 57 56.842 59.035 -2.193 1
1 582 . 12 1 1 A 59 59 GLU CB C 57 29.267 29.179 0.088 1
1 584 . 12 1 1 A 59 59 GLU N N 57 121.777 119.556 2.221 1
1 585 . 12 1 1 A 60 60 ALA H H 58 8.077 7.242 0.835 1
1 586 . 12 1 1 A 60 60 ALA HA H 58 4.134 4.339 -0.205 1
1 590 . 12 1 1 A 60 60 ALA CA C 58 52.432 51.323 1.109 1
1 591 . 12 1 1 A 60 60 ALA CB C 58 18.743 20.258 -1.515 1
1 592 . 12 1 1 A 60 60 ALA N N 58 125.120 122.680 2.440 1
1 593 . 12 1 1 A 61 61 ALA H H 59 8.041 8.581 -0.540 1
1 594 . 12 1 1 A 61 61 ALA HA H 59 4.131 4.001 0.130 1
1 598 . 12 1 1 A 61 61 ALA C C 59 178.147 177.854 0.293 1
1 599 . 12 1 1 A 61 61 ALA CA C 59 52.586 53.845 -1.259 1
1 600 . 12 1 1 A 61 61 ALA CB C 59 18.692 19.315 -0.623 1
1 601 . 12 1 1 A 61 61 ALA N N 59 123.857 120.318 3.539 1
1 602 . 12 1 1 A 62 62 GLY H H 60 8.069 8.045 0.024 1
1 603 . 12 1 1 A 62 62 GLY HA2 H 60 3.810 4.056 -0.246 1
1 604 . 12 1 1 A 62 62 GLY HA3 H 60 3.888 4.057 -0.169 1
1 605 . 12 1 1 A 62 62 GLY C C 60 174.914 174.640 0.274 1
1 606 . 12 1 1 A 62 62 GLY CA C 60 45.320 44.659 0.661 1
1 607 . 12 1 1 A 62 62 GLY N N 60 107.924 105.681 2.243 1
1 608 . 12 1 1 A 63 63 GLY H H 61 8.118 8.594 -0.476 1
1 609 . 12 1 1 A 63 63 GLY HA2 H 61 4.008 4.075 -0.067 1
1 610 . 12 1 1 A 63 63 GLY HA3 H 61 3.893 4.222 -0.329 1
1 611 . 12 1 1 A 63 63 GLY C C 61 174.743 175.142 -0.399 1
1 612 . 12 1 1 A 63 63 GLY CA C 61 45.202 46.600 -1.398 1
1 613 . 12 1 1 A 63 63 GLY N N 61 109.441 107.584 1.857 1
1 614 . 12 1 1 A 64 64 ASP H H 62 8.305 8.395 -0.090 1
1 615 . 12 1 1 A 64 64 ASP HA H 62 4.240 4.247 -0.007 1
1 618 . 12 1 1 A 64 64 ASP C C 62 177.571 178.607 -1.036 1
1 619 . 12 1 1 A 64 64 ASP CA C 62 57.210 57.153 0.057 1
1 620 . 12 1 1 A 64 64 ASP CB C 62 40.142 40.385 -0.243 1
1 621 . 12 1 1 A 64 64 ASP N N 62 121.568 120.504 1.064 1
1 622 . 12 1 1 A 65 65 GLN H H 63 8.337 8.319 0.018 1
1 623 . 12 1 1 A 65 65 GLN HA H 63 4.138 4.060 0.078 1
1 628 . 12 1 1 A 65 65 GLN C C 63 177.490 178.665 -1.175 1
1 629 . 12 1 1 A 65 65 GLN CA C 63 58.643 59.039 -0.396 1
1 630 . 12 1 1 A 65 65 GLN CB C 63 27.803 28.331 -0.528 1
1 632 . 12 1 1 A 65 65 GLN N N 63 119.700 118.262 1.438 1
1 633 . 12 1 1 A 66 66 PHE H H 64 7.658 8.169 -0.511 1
1 634 . 12 1 1 A 66 66 PHE HA H 64 4.170 4.158 0.012 1
1 638 . 12 1 1 A 66 66 PHE C C 64 176.872 176.927 -0.055 1
1 639 . 12 1 1 A 66 66 PHE CA C 64 60.158 60.953 -0.795 1
1 640 . 12 1 1 A 66 66 PHE CB C 64 38.490 39.357 -0.867 1
1 643 . 12 1 1 A 66 66 PHE N N 64 121.036 120.145 0.891 1
1 644 . 12 1 1 A 67 67 ILE H H 65 7.646 8.855 -1.209 1
1 645 . 12 1 1 A 67 67 ILE HA H 65 3.426 3.015 0.411 1
1 655 . 12 1 1 A 67 67 ILE CA C 65 63.377 62.863 0.514 1
1 656 . 12 1 1 A 67 67 ILE CB C 65 37.057 37.441 -0.384 1
1 660 . 12 1 1 A 67 67 ILE N N 65 121.372 118.820 2.552 1
1 661 . 12 1 1 A 68 68 HIS H H 66 7.945 8.712 -0.767 1
1 662 . 12 1 1 A 68 68 HIS HA H 66 4.005 4.179 -0.174 1
1 665 . 12 1 1 A 68 68 HIS CA C 66 59.915 58.943 0.972 1
1 668 . 12 1 1 A 68 68 HIS N N 66 120.036 121.714 -1.678 1
1 669 . 12 1 1 A 69 69 GLU HA H 67 3.677 4.035 -0.358 1
1 673 . 12 1 1 A 69 69 GLU CA C 67 58.490 59.677 -1.187 1
1 674 . 12 1 1 A 69 69 GLU CB C 67 29.290 29.520 -0.230 1
1 676 . 12 1 1 A 70 70 GLN H H 68 8.017 7.660 0.357 1
1 677 . 12 1 1 A 70 70 GLN HA H 68 3.426 3.763 -0.337 1
1 678 . 12 1 1 A 70 70 GLN C C 68 179.280 177.948 1.332 1
1 679 . 12 1 1 A 70 70 GLN CA C 68 57.561 58.681 -1.120 1
1 680 . 12 1 1 A 70 70 GLN CB C 68 28.530 28.143 0.387 1
1 682 . 12 1 1 A 70 70 GLN N N 68 120.410 119.654 0.756 1
1 683 . 12 1 1 A 71 71 ASP HA H 69 4.440 4.598 -0.158 1
1 684 . 12 1 1 A 71 71 ASP C C 69 177.402 178.729 -1.327 1
1 685 . 12 1 1 A 71 71 ASP CA C 69 56.290 56.996 -0.706 1
1 686 . 12 1 1 A 72 72 LEU H H 70 7.952 8.444 -0.492 1
1 687 . 12 1 1 A 72 72 LEU HA H 70 3.775 3.913 -0.138 1
1 697 . 12 1 1 A 72 72 LEU C C 70 178.316 178.254 0.062 1
1 698 . 12 1 1 A 72 72 LEU CA C 70 56.101 57.462 -1.361 1
1 699 . 12 1 1 A 72 72 LEU CB C 70 39.872 41.563 -1.691 1
1 703 . 12 1 1 A 72 72 LEU N N 70 120.832 120.883 -0.051 1
1 704 . 12 1 1 A 73 73 ASN H H 71 7.723 8.682 -0.959 1
1 705 . 12 1 1 A 73 73 ASN HA H 71 4.270 4.545 -0.275 1
1 708 . 12 1 1 A 73 73 ASN C C 71 178.193 178.036 0.157 1
1 709 . 12 1 1 A 73 73 ASN CA C 71 55.970 56.636 -0.666 1
1 710 . 12 1 1 A 73 73 ASN CB C 71 37.640 39.349 -1.709 1
1 711 . 12 1 1 A 73 73 ASN N N 71 119.295 117.415 1.880 1
1 712 . 12 1 1 A 74 74 TRP H H 72 7.811 8.501 -0.690 1
1 713 . 12 1 1 A 74 74 TRP HA H 72 4.500 4.481 0.019 1
1 720 . 12 1 1 A 74 74 TRP CA C 72 58.480 59.628 -1.148 1
1 721 . 12 1 1 A 74 74 TRP CB C 72 28.920 29.655 -0.735 1
1 727 . 12 1 1 A 74 74 TRP N N 72 121.490 120.425 1.065 1
1 729 . 12 1 1 A 75 75 LEU H H 73 8.412 8.179 0.233 1
1 730 . 12 1 1 A 75 75 LEU HA H 73 3.290 3.348 -0.058 1
1 739 . 12 1 1 A 75 75 LEU C C 73 178.562 178.540 0.022 1
1 740 . 12 1 1 A 75 75 LEU CA C 73 58.226 57.393 0.833 1
1 741 . 12 1 1 A 75 75 LEU CB C 73 41.200 41.097 0.103 1
1 745 . 12 1 1 A 75 75 LEU N N 73 121.065 121.070 -0.005 1
1 746 . 12 1 1 A 76 76 GLN H H 74 7.648 7.737 -0.089 1
1 747 . 12 1 1 A 76 76 GLN HA H 74 3.657 4.065 -0.408 1
1 752 . 12 1 1 A 76 76 GLN C C 74 178.616 177.501 1.115 1
1 753 . 12 1 1 A 76 76 GLN CA C 74 58.777 58.868 -0.091 1
1 754 . 12 1 1 A 76 76 GLN CB C 74 28.163 28.341 -0.178 1
1 756 . 12 1 1 A 76 76 GLN N N 74 113.985 118.975 -4.990 1
1 757 . 12 1 1 A 77 77 GLN H H 75 7.465 7.476 -0.011 1
1 758 . 12 1 1 A 77 77 GLN HA H 75 4.134 4.322 -0.188 1
1 761 . 12 1 1 A 77 77 GLN C C 75 176.223 175.565 0.658 1
1 762 . 12 1 1 A 77 77 GLN CA C 75 56.203 55.459 0.744 1
1 763 . 12 1 1 A 77 77 GLN CB C 75 29.524 29.325 0.199 1
1 765 . 12 1 1 A 77 77 GLN N N 75 117.481 116.400 1.081 1
1 766 . 12 1 1 A 78 78 ALA H H 76 7.420 7.089 0.331 1
1 767 . 12 1 1 A 78 78 ALA HA H 76 3.864 4.473 -0.609 1
1 771 . 12 1 1 A 78 78 ALA C C 76 176.733 177.166 -0.433 1
1 772 . 12 1 1 A 78 78 ALA CA C 76 52.529 52.215 0.314 1
1 773 . 12 1 1 A 78 78 ALA CB C 76 20.124 19.266 0.858 1
1 774 . 12 1 1 A 78 78 ALA N N 76 122.682 123.310 -0.628 1
1 775 . 12 1 1 A 79 79 ASP H H 77 9.028 9.664 -0.636 1
1 776 . 12 1 1 A 79 79 ASP HA H 77 4.673 4.603 0.070 1
1 779 . 12 1 1 A 79 79 ASP C C 77 175.740 176.303 -0.563 1
1 780 . 12 1 1 A 79 79 ASP CA C 77 56.383 56.973 -0.590 1
1 781 . 12 1 1 A 79 79 ASP CB C 77 42.826 42.690 0.136 1
1 782 . 12 1 1 A 79 79 ASP N N 77 119.887 122.639 -2.752 1
1 783 . 12 1 1 A 80 80 VAL H H 78 7.379 7.790 -0.411 1
1 784 . 12 1 1 A 80 80 VAL HA H 78 4.340 4.754 -0.414 1
1 792 . 12 1 1 A 80 80 VAL C C 78 175.321 174.328 0.993 1
1 793 . 12 1 1 A 80 80 VAL CA C 78 60.011 60.247 -0.236 1
1 794 . 12 1 1 A 80 80 VAL CB C 78 35.362 35.852 -0.490 1
1 797 . 12 1 1 A 80 80 VAL N N 78 114.152 118.001 -3.849 1
1 798 . 12 1 1 A 81 81 VAL H H 79 8.350 8.138 0.212 1
1 799 . 12 1 1 A 81 81 VAL HA H 79 4.799 4.836 -0.037 1
1 807 . 12 1 1 A 81 81 VAL C C 79 173.095 174.294 -1.199 1
1 808 . 12 1 1 A 81 81 VAL CA C 79 60.775 60.559 0.216 1
1 809 . 12 1 1 A 81 81 VAL CB C 79 32.824 35.290 -2.466 1
1 812 . 12 1 1 A 81 81 VAL N N 79 128.429 125.880 2.549 1
1 813 . 12 1 1 A 82 82 VAL H H 80 8.947 8.911 0.036 1
1 814 . 12 1 1 A 82 82 VAL HA H 80 4.947 4.537 0.410 1
1 822 . 12 1 1 A 82 82 VAL C C 80 173.522 174.122 -0.600 1
1 823 . 12 1 1 A 82 82 VAL CA C 80 59.684 60.672 -0.988 1
1 824 . 12 1 1 A 82 82 VAL CB C 80 33.702 33.471 0.231 1
1 827 . 12 1 1 A 82 82 VAL N N 80 126.957 127.351 -0.394 1
1 828 . 12 1 1 A 83 83 ALA H H 81 9.011 8.878 0.133 1
1 829 . 12 1 1 A 83 83 ALA HA H 81 4.938 4.984 -0.046 1
1 833 . 12 1 1 A 83 83 ALA C C 81 130.330 175.543 -45.213 1
1 834 . 12 1 1 A 83 83 ALA CA C 81 49.490 49.857 -0.367 1
1 835 . 12 1 1 A 83 83 ALA CB C 81 23.628 20.782 2.846 1
1 836 . 12 1 1 A 83 83 ALA N N 81 128.705 129.813 -1.108 1
1 837 . 12 1 1 A 84 84 GLU H H 82 8.922 8.568 0.354 1
1 838 . 12 1 1 A 84 84 GLU HA H 82 4.937 4.527 0.410 1
1 839 . 12 1 1 A 84 84 GLU C C 82 177.673 175.449 2.224 1
1 840 . 12 1 1 A 84 84 GLU CA C 82 56.714 56.145 0.569 1
1 841 . 12 1 1 A 84 84 GLU CB C 82 29.882 30.372 -0.490 1
1 842 . 12 1 1 A 84 84 GLU N N 82 130.330 123.900 6.430 1
1 843 . 12 1 1 A 85 85 VAL H H 83 8.427 8.931 -0.504 1
1 844 . 12 1 1 A 85 85 VAL HA H 83 4.435 5.010 -0.575 1
1 852 . 12 1 1 A 85 85 VAL C C 83 174.252 175.767 -1.515 1
1 853 . 12 1 1 A 85 85 VAL CA C 83 59.896 61.215 -1.319 1
1 854 . 12 1 1 A 85 85 VAL CB C 83 29.968 35.122 -5.154 1
1 857 . 12 1 1 A 85 85 VAL N N 83 114.212 126.971 -12.759 1
1 858 . 12 1 1 A 86 86 THR H H 84 9.347 9.397 -0.050 1
1 859 . 12 1 1 A 86 86 THR HA H 84 4.146 4.803 -0.657 1
1 864 . 12 1 1 A 86 86 THR C C 84 175.751 174.321 1.430 1
1 865 . 12 1 1 A 86 86 THR CA C 84 67.629 62.935 4.694 1
1 866 . 12 1 1 A 86 86 THR CB C 84 66.819 71.212 -4.393 1
1 868 . 12 1 1 A 86 86 THR N N 84 121.640 120.580 1.060 1
1 869 . 12 1 1 A 87 87 GLN H H 85 8.114 7.803 0.311 1
1 870 . 12 1 1 A 87 87 GLN HA H 85 4.736 5.020 -0.284 1
1 874 . 12 1 1 A 87 87 GLN CA C 85 51.898 53.653 -1.755 1
1 875 . 12 1 1 A 87 87 GLN CB C 85 27.942 31.275 -3.333 1
1 877 . 12 1 1 A 87 87 GLN N N 85 120.367 116.362 4.005 1
1 878 . 12 1 1 A 88 88 PRO HA H 86 4.061 4.458 -0.397 1
1 885 . 12 1 1 A 88 88 PRO C C 86 176.436 175.700 0.736 1
1 886 . 12 1 1 A 88 88 PRO CA C 86 63.422 63.463 -0.041 1
1 887 . 12 1 1 A 88 88 PRO CB C 86 31.925 32.450 -0.525 1
1 889 . 12 1 1 A 89 89 SER H H 87 6.044 8.538 -2.494 1
1 890 . 12 1 1 A 89 89 SER HA H 87 4.630 4.939 -0.309 1
1 893 . 12 1 1 A 89 89 SER C C 87 175.612 174.049 1.563 1
1 894 . 12 1 1 A 89 89 SER CA C 87 56.800 58.153 -1.353 1
1 895 . 12 1 1 A 89 89 SER CB C 87 64.196 65.962 -1.766 1
1 896 . 12 1 1 A 89 89 SER N N 87 115.721 118.299 -2.578 1
1 897 . 12 1 1 A 90 90 LEU H H 88 9.702 8.997 0.705 1
1 898 . 12 1 1 A 90 90 LEU HA H 88 4.270 4.047 0.223 1
1 906 . 12 1 1 A 90 90 LEU C C 88 179.173 179.290 -0.117 1
1 907 . 12 1 1 A 90 90 LEU CA C 88 57.402 58.269 -0.867 1
1 908 . 12 1 1 A 90 90 LEU CB C 88 43.642 41.836 1.806 1
1 911 . 12 1 1 A 90 90 LEU N N 88 130.488 128.559 1.929 1
1 912 . 12 1 1 A 91 91 GLY H H 89 8.354 8.306 0.048 1
1 913 . 12 1 1 A 91 91 GLY HA2 H 89 3.680 3.792 -0.112 1
1 914 . 12 1 1 A 91 91 GLY HA3 H 89 3.584 3.812 -0.228 1
1 915 . 12 1 1 A 91 91 GLY C C 89 175.106 176.689 -1.583 1
1 916 . 12 1 1 A 91 91 GLY CA C 89 47.770 47.492 0.278 1
1 917 . 12 1 1 A 91 91 GLY N N 89 107.522 106.293 1.229 1
1 918 . 12 1 1 A 92 92 VAL H H 90 7.906 8.044 -0.138 1
1 919 . 12 1 1 A 92 92 VAL HA H 90 3.940 3.786 0.154 1
1 927 . 12 1 1 A 92 92 VAL C C 90 178.467 178.094 0.373 1
1 928 . 12 1 1 A 92 92 VAL CA C 90 65.379 66.350 -0.971 1
1 929 . 12 1 1 A 92 92 VAL CB C 90 31.785 31.780 0.005 1
1 932 . 12 1 1 A 92 92 VAL N N 90 121.741 121.802 -0.061 1
1 933 . 12 1 1 A 93 93 GLY H H 91 7.595 8.340 -0.745 1
1 934 . 12 1 1 A 93 93 GLY HA2 H 91 3.628 3.786 -0.158 1
1 935 . 12 1 1 A 93 93 GLY HA3 H 91 3.415 3.794 -0.379 1
1 936 . 12 1 1 A 93 93 GLY C C 91 174.022 175.182 -1.160 1
1 937 . 12 1 1 A 93 93 GLY CA C 91 48.319 47.494 0.825 1
1 938 . 12 1 1 A 93 93 GLY N N 91 104.629 107.338 -2.709 1
1 939 . 12 1 1 A 94 94 TYR H H 92 8.372 9.406 -1.034 1
1 940 . 12 1 1 A 94 94 TYR HA H 92 4.046 4.085 -0.039 1
1 943 . 12 1 1 A 94 94 TYR C C 92 177.458 178.009 -0.551 1
1 944 . 12 1 1 A 94 94 TYR CA C 92 61.760 60.916 0.844 1
1 945 . 12 1 1 A 94 94 TYR CB C 92 38.431 38.928 -0.497 1
1 948 . 12 1 1 A 94 94 TYR N N 92 123.383 123.840 -0.457 1
1 949 . 12 1 1 A 95 95 GLU H H 93 8.424 8.119 0.305 1
1 950 . 12 1 1 A 95 95 GLU HA H 93 3.421 4.091 -0.670 1
1 951 . 12 1 1 A 95 95 GLU C C 93 178.590 179.699 -1.109 1
1 952 . 12 1 1 A 95 95 GLU CA C 93 60.211 58.941 1.270 1
1 953 . 12 1 1 A 95 95 GLU CB C 93 29.025 29.361 -0.336 1
1 954 . 12 1 1 A 95 95 GLU N N 93 120.181 118.038 2.143 1
1 955 . 12 1 1 A 96 96 LEU H H 94 8.210 8.136 0.074 1
1 956 . 12 1 1 A 96 96 LEU HA H 94 3.830 3.962 -0.132 1
1 964 . 12 1 1 A 96 96 LEU C C 94 179.032 179.267 -0.235 1
1 965 . 12 1 1 A 96 96 LEU CA C 94 57.683 58.352 -0.669 1
1 966 . 12 1 1 A 96 96 LEU CB C 94 41.883 41.994 -0.111 1
1 970 . 12 1 1 A 96 96 LEU N N 94 118.091 120.911 -2.820 1
1 971 . 12 1 1 A 97 97 GLY H H 95 8.773 8.414 0.359 1
1 972 . 12 1 1 A 97 97 GLY C C 95 175.344 175.314 0.030 1
1 973 . 12 1 1 A 97 97 GLY CA C 95 47.308 47.108 0.200 1
1 974 . 12 1 1 A 97 97 GLY N N 95 108.085 105.605 2.480 1
1 975 . 12 1 1 A 98 98 ARG H H 96 8.100 7.951 0.149 1
1 976 . 12 1 1 A 98 98 ARG C C 96 179.692 178.137 1.555 1
1 977 . 12 1 1 A 98 98 ARG CA C 96 56.308 58.833 -2.525 1
1 978 . 12 1 1 A 98 98 ARG CB C 96 26.854 29.792 -2.938 1
1 979 . 12 1 1 A 98 98 ARG N N 96 118.156 121.678 -3.522 1
1 980 . 12 1 1 A 99 99 ALA H H 97 8.498 7.484 1.014 1
1 981 . 12 1 1 A 99 99 ALA HA H 97 3.640 4.023 -0.383 1
1 985 . 12 1 1 A 99 99 ALA C C 97 179.650 179.999 -0.349 1
1 986 . 12 1 1 A 99 99 ALA CA C 97 55.166 55.016 0.150 1
1 987 . 12 1 1 A 99 99 ALA CB C 97 18.604 18.293 0.311 1
1 988 . 12 1 1 A 99 99 ALA N N 97 122.310 121.409 0.901 1
1 989 . 12 1 1 A 100 100 VAL H H 98 8.597 8.227 0.370 1
1 990 . 12 1 1 A 100 100 VAL HA H 98 3.798 3.602 0.196 1
1 998 . 12 1 1 A 100 100 VAL C C 98 180.464 178.205 2.259 1
1 999 . 12 1 1 A 100 100 VAL CA C 98 65.664 66.634 -0.970 1
1 1000 . 12 1 1 A 100 100 VAL CB C 98 31.065 31.348 -0.283 1
1 1003 . 12 1 1 A 100 100 VAL N N 98 120.603 118.919 1.684 1
1 1004 . 12 1 1 A 101 101 ALA H H 99 7.280 7.923 -0.643 1
1 1005 . 12 1 1 A 101 101 ALA HA H 99 3.963 4.012 -0.049 1
1 1009 . 12 1 1 A 101 101 ALA C C 99 179.314 180.311 -0.997 1
1 1010 . 12 1 1 A 101 101 ALA CA C 99 54.367 55.145 -0.778 1
1 1011 . 12 1 1 A 101 101 ALA CB C 99 18.139 18.544 -0.405 1
1 1012 . 12 1 1 A 101 101 ALA N N 99 124.450 121.976 2.474 1
1 1013 . 12 1 1 A 102 102 LEU H H 100 7.200 8.223 -1.023 1
1 1014 . 12 1 1 A 102 102 LEU HA H 100 4.192 4.210 -0.018 1
1 1024 . 12 1 1 A 102 102 LEU C C 100 177.306 176.888 0.418 1
1 1025 . 12 1 1 A 102 102 LEU CA C 100 54.808 55.115 -0.307 1
1 1026 . 12 1 1 A 102 102 LEU CB C 100 42.880 42.264 0.616 1
1 1030 . 12 1 1 A 102 102 LEU N N 100 116.834 116.666 0.168 1
1 1031 . 12 1 1 A 103 103 GLY H H 101 7.891 7.999 -0.108 1
1 1032 . 12 1 1 A 103 103 GLY HA2 H 101 3.941 3.902 0.039 1
1 1033 . 12 1 1 A 103 103 GLY HA3 H 101 3.831 3.910 -0.079 1
1 1034 . 12 1 1 A 103 103 GLY C C 101 175.137 174.635 0.502 1
1 1035 . 12 1 1 A 103 103 GLY CA C 101 45.673 46.612 -0.939 1
1 1036 . 12 1 1 A 103 103 GLY N N 101 109.395 109.067 0.328 1
1 1037 . 12 1 1 A 104 104 LYS H H 102 7.337 7.945 -0.608 1
1 1038 . 12 1 1 A 104 104 LYS HA H 102 4.402 4.699 -0.297 1
1 1043 . 12 1 1 A 104 104 LYS CA C 102 52.136 53.288 -1.152 1
1 1044 . 12 1 1 A 104 104 LYS CB C 102 31.045 32.295 -1.250 1
1 1047 . 12 1 1 A 104 104 LYS N N 102 118.954 120.602 -1.648 1
1 1048 . 12 1 1 A 105 105 PRO HA H 103 4.781 4.387 0.394 1
1 1054 . 12 1 1 A 105 105 PRO CA C 103 62.791 63.434 -0.643 1
1 1055 . 12 1 1 A 105 105 PRO CB C 103 30.405 32.057 -1.652 1
1 1058 . 12 1 1 A 106 106 ILE H H 104 8.261 8.797 -0.536 1
1 1059 . 12 1 1 A 106 106 ILE HA H 104 4.680 4.379 0.301 1
1 1069 . 12 1 1 A 106 106 ILE C C 104 175.543 173.841 1.702 1
1 1070 . 12 1 1 A 106 106 ILE CA C 104 59.362 60.192 -0.830 1
1 1071 . 12 1 1 A 106 106 ILE CB C 104 43.738 39.113 4.625 1
1 1075 . 12 1 1 A 106 106 ILE N N 104 123.509 124.507 -0.998 1
1 1076 . 12 1 1 A 107 107 LEU H H 105 8.584 8.386 0.198 1
1 1077 . 12 1 1 A 107 107 LEU HA H 105 4.243 4.502 -0.259 1
1 1087 . 12 1 1 A 107 107 LEU C C 105 174.204 174.516 -0.312 1
1 1088 . 12 1 1 A 107 107 LEU CA C 105 52.863 53.264 -0.401 1
1 1089 . 12 1 1 A 107 107 LEU CB C 105 42.408 43.380 -0.972 1
1 1093 . 12 1 1 A 107 107 LEU N N 105 131.882 129.522 2.360 1
1 1094 . 12 1 1 A 108 108 CYS H H 106 8.679 8.691 -0.012 1
1 1095 . 12 1 1 A 108 108 CYS HA H 106 5.280 5.063 0.217 1
1 1099 . 12 1 1 A 108 108 CYS C C 106 173.134 173.609 -0.475 1
1 1100 . 12 1 1 A 108 108 CYS CA C 106 57.290 56.883 0.407 1
1 1101 . 12 1 1 A 108 108 CYS CB C 106 29.559 29.225 0.334 1
1 1102 . 12 1 1 A 108 108 CYS N N 106 122.904 126.006 -3.102 1
1 1103 . 12 1 1 A 109 109 LEU H H 107 8.987 8.713 0.274 1
1 1104 . 12 1 1 A 109 109 LEU HA H 107 5.120 5.599 -0.479 1
1 1112 . 12 1 1 A 109 109 LEU C C 107 174.500 175.718 -1.218 1
1 1113 . 12 1 1 A 109 109 LEU CA C 107 53.274 53.797 -0.523 1
1 1114 . 12 1 1 A 109 109 LEU CB C 107 43.450 45.219 -1.769 1
1 1118 . 12 1 1 A 109 109 LEU N N 107 124.653 124.367 0.286 1
1 1119 . 12 1 1 A 110 110 PHE H H 108 8.981 9.201 -0.220 1
1 1120 . 12 1 1 A 110 110 PHE HA H 108 4.846 6.225 -1.379 1
1 1125 . 12 1 1 A 110 110 PHE C C 108 172.231 172.771 -0.540 1
1 1126 . 12 1 1 A 110 110 PHE CA C 108 55.963 56.523 -0.560 1
1 1127 . 12 1 1 A 110 110 PHE CB C 108 43.270 42.902 0.368 1
1 1130 . 12 1 1 A 110 110 PHE N N 108 125.052 122.620 2.432 1
1 1131 . 12 1 1 A 111 111 ARG H H 109 7.461 8.526 -1.065 1
1 1132 . 12 1 1 A 111 111 ARG HA H 109 4.804 4.579 0.225 1
1 1136 . 12 1 1 A 111 111 ARG CA C 109 51.953 52.358 -0.405 1
1 1137 . 12 1 1 A 111 111 ARG CB C 109 30.008 30.297 -0.289 1
1 1140 . 12 1 1 A 111 111 ARG N N 109 128.034 126.362 1.672 1
1 1141 . 12 1 1 A 112 112 PRO C C 110 178.675 178.070 0.605 1
1 1142 . 12 1 1 A 112 112 PRO CA C 110 64.024 64.630 -0.606 1
1 1143 . 12 1 1 A 112 112 PRO CB C 110 31.416 31.975 -0.559 1
1 1144 . 12 1 1 A 113 113 GLN H H 111 8.188 8.694 -0.506 1
1 1145 . 12 1 1 A 113 113 GLN HA H 111 4.056 4.040 0.016 1
1 1149 . 12 1 1 A 113 113 GLN C C 111 175.936 177.315 -1.379 1
1 1150 . 12 1 1 A 113 113 GLN CA C 111 57.144 58.272 -1.128 1
1 1151 . 12 1 1 A 113 113 GLN CB C 111 28.033 28.167 -0.134 1
1 1153 . 12 1 1 A 113 113 GLN N N 111 118.835 116.522 2.313 1
1 1154 . 12 1 1 A 114 114 SER H H 112 7.730 7.696 0.034 1
1 1155 . 12 1 1 A 114 114 SER HA H 112 4.037 4.504 -0.467 1
1 1158 . 12 1 1 A 114 114 SER C C 112 175.750 175.821 -0.071 1
1 1159 . 12 1 1 A 114 114 SER CA C 112 60.154 58.864 1.290 1
1 1160 . 12 1 1 A 114 114 SER CB C 112 64.282 64.902 -0.620 1
1 1161 . 12 1 1 A 114 114 SER N N 112 114.887 110.751 4.136 1
1 1162 . 12 1 1 A 115 115 GLY H H 113 8.005 7.584 0.421 1
1 1163 . 12 1 1 A 115 115 GLY HA2 H 113 3.712 3.995 -0.283 1
1 1164 . 12 1 1 A 115 115 GLY HA3 H 113 4.130 4.192 -0.062 1
1 1165 . 12 1 1 A 115 115 GLY C C 113 173.945 175.633 -1.688 1
1 1166 . 12 1 1 A 115 115 GLY CA C 113 45.233 47.187 -1.954 1
1 1167 . 12 1 1 A 115 115 GLY N N 113 110.740 110.761 -0.021 1
1 1168 . 12 1 1 A 116 116 ARG H H 114 7.665 8.217 -0.552 1
1 1169 . 12 1 1 A 116 116 ARG HA H 114 4.449 4.515 -0.066 1
1 1173 . 12 1 1 A 116 116 ARG C C 114 175.370 175.444 -0.074 1
1 1174 . 12 1 1 A 116 116 ARG CA C 114 55.080 55.751 -0.671 1
1 1175 . 12 1 1 A 116 116 ARG CB C 114 31.215 29.931 1.284 1
1 1178 . 12 1 1 A 116 116 ARG N N 114 119.983 118.803 1.180 1
1 1179 . 12 1 1 A 117 117 VAL H H 115 8.409 8.120 0.289 1
1 1180 . 12 1 1 A 117 117 VAL HA H 115 4.184 3.574 0.610 1
1 1188 . 12 1 1 A 117 117 VAL C C 115 175.980 174.688 1.292 1
1 1189 . 12 1 1 A 117 117 VAL CA C 115 61.167 62.053 -0.886 1
1 1190 . 12 1 1 A 117 117 VAL CB C 115 32.931 30.827 2.104 1
1 1193 . 12 1 1 A 117 117 VAL N N 115 122.240 116.257 5.983 1
1 1194 . 12 1 1 A 118 118 LEU H H 116 8.227 7.273 0.954 1
1 1195 . 12 1 1 A 118 118 LEU HA H 116 3.720 4.208 -0.488 1
1 1204 . 12 1 1 A 118 118 LEU C C 116 175.623 176.977 -1.354 1
1 1205 . 12 1 1 A 118 118 LEU CA C 116 54.555 55.474 -0.919 1
1 1206 . 12 1 1 A 118 118 LEU CB C 116 39.292 43.205 -3.913 1
1 1210 . 12 1 1 A 118 118 LEU N N 116 131.481 128.885 2.596 1
1 1211 . 12 1 1 A 119 119 SER H H 117 7.780 8.455 -0.675 1
1 1212 . 12 1 1 A 119 119 SER HA H 117 4.060 4.363 -0.303 1
1 1214 . 12 1 1 A 119 119 SER C C 117 175.782 175.423 0.359 1
1 1215 . 12 1 1 A 119 119 SER CA C 117 58.530 60.299 -1.769 1
1 1216 . 12 1 1 A 119 119 SER CB C 117 64.785 63.923 0.862 1
1 1217 . 12 1 1 A 119 119 SER N N 117 118.658 120.589 -1.931 1
1 1218 . 12 1 1 A 120 120 ALA H H 118 8.955 8.981 -0.026 1
1 1219 . 12 1 1 A 120 120 ALA HA H 118 3.846 4.027 -0.181 1
1 1223 . 12 1 1 A 120 120 ALA C C 118 179.731 179.822 -0.091 1
1 1224 . 12 1 1 A 120 120 ALA CA C 118 54.927 55.754 -0.827 1
1 1225 . 12 1 1 A 120 120 ALA CB C 118 18.627 18.239 0.388 1
1 1226 . 12 1 1 A 120 120 ALA N N 118 134.119 127.393 6.726 1
1 1227 . 12 1 1 A 121 121 MET H H 119 7.718 8.251 -0.533 1
1 1228 . 12 1 1 A 121 121 MET HA H 119 4.130 4.141 -0.011 1
1 1235 . 12 1 1 A 121 121 MET C C 119 175.610 178.904 -3.294 1
1 1236 . 12 1 1 A 121 121 MET CA C 119 55.968 58.433 -2.465 1
1 1237 . 12 1 1 A 121 121 MET CB C 119 30.814 32.690 -1.876 1
1 1240 . 12 1 1 A 121 121 MET N N 119 115.424 116.392 -0.968 1
1 1241 . 12 1 1 A 122 122 ILE H H 120 6.451 8.127 -1.676 1
1 1242 . 12 1 1 A 122 122 ILE HA H 120 3.392 3.608 -0.216 1
1 1252 . 12 1 1 A 122 122 ILE C C 120 177.108 178.355 -1.247 1
1 1253 . 12 1 1 A 122 122 ILE CA C 120 59.650 64.978 -5.328 1
1 1254 . 12 1 1 A 122 122 ILE CB C 120 34.640 37.783 -3.143 1
1 1258 . 12 1 1 A 122 122 ILE N N 120 113.418 119.640 -6.222 1
1 1259 . 12 1 1 A 123 123 ARG H H 121 7.540 8.183 -0.643 1
1 1260 . 12 1 1 A 123 123 ARG HA H 121 3.551 4.022 -0.471 1
1 1264 . 12 1 1 A 123 123 ARG C C 121 179.642 178.777 0.865 1
1 1265 . 12 1 1 A 123 123 ARG CA C 121 59.242 59.537 -0.295 1
1 1266 . 12 1 1 A 123 123 ARG CB C 121 29.087 29.538 -0.451 1
1 1269 . 12 1 1 A 123 123 ARG N N 121 116.248 120.963 -4.715 1
1 1270 . 12 1 1 A 124 124 GLY H H 122 8.086 8.803 -0.717 1
1 1271 . 12 1 1 A 124 124 GLY C C 122 172.357 176.007 -3.650 1
1 1272 . 12 1 1 A 124 124 GLY CA C 122 44.836 46.582 -1.746 1
1 1273 . 12 1 1 A 124 124 GLY N N 122 104.381 107.582 -3.201 1
1 1274 . 12 1 1 A 125 125 ALA H H 123 6.411 7.837 -1.426 1
1 1275 . 12 1 1 A 125 125 ALA HA H 123 2.441 3.795 -1.354 1
1 1279 . 12 1 1 A 125 125 ALA C C 123 176.908 178.119 -1.211 1
1 1280 . 12 1 1 A 125 125 ALA CA C 123 51.593 54.611 -3.018 1
1 1281 . 12 1 1 A 125 125 ALA CB C 123 16.997 18.184 -1.187 1
1 1282 . 12 1 1 A 125 125 ALA N N 123 123.136 124.491 -1.355 1
1 1283 . 12 1 1 A 126 126 ALA H H 124 6.190 7.617 -1.427 1
1 1284 . 12 1 1 A 126 126 ALA HA H 124 3.829 4.518 -0.689 1
1 1288 . 12 1 1 A 126 126 ALA C C 124 177.535 178.022 -0.487 1
1 1289 . 12 1 1 A 126 126 ALA CA C 124 52.403 52.617 -0.214 1
1 1290 . 12 1 1 A 126 126 ALA CB C 124 18.375 19.941 -1.566 1
1 1291 . 12 1 1 A 126 126 ALA N N 124 117.999 117.274 0.725 1
1 1292 . 12 1 1 A 127 127 ASP H H 125 8.877 8.770 0.107 1
1 1293 . 12 1 1 A 127 127 ASP HA H 125 4.665 4.662 0.003 1
1 1296 . 12 1 1 A 127 127 ASP C C 125 177.795 175.474 2.321 1
1 1297 . 12 1 1 A 127 127 ASP CA C 125 52.855 55.746 -2.891 1
1 1298 . 12 1 1 A 127 127 ASP CB C 125 41.814 40.535 1.279 1
1 1299 . 12 1 1 A 127 127 ASP N N 125 121.828 118.467 3.361 1
1 1300 . 12 1 1 A 128 128 GLY H H 126 7.954 7.883 0.071 1
1 1301 . 12 1 1 A 128 128 GLY HA2 H 126 3.830 4.164 -0.334 1
1 1302 . 12 1 1 A 128 128 GLY HA3 H 126 4.249 4.211 0.038 1
1 1303 . 12 1 1 A 128 128 GLY C C 126 173.822 172.587 1.235 1
1 1304 . 12 1 1 A 128 128 GLY CA C 126 45.549 45.578 -0.029 1
1 1305 . 12 1 1 A 128 128 GLY N N 126 108.814 106.845 1.969 1
1 1306 . 12 1 1 A 129 129 SER H H 127 8.547 8.590 -0.043 1
1 1307 . 12 1 1 A 129 129 SER HA H 127 4.486 4.864 -0.378 1
1 1309 . 12 1 1 A 129 129 SER C C 127 174.178 174.125 0.053 1
1 1310 . 12 1 1 A 129 129 SER CA C 127 58.653 57.069 1.584 1
1 1311 . 12 1 1 A 129 129 SER CB C 127 63.316 63.488 -0.172 1
1 1312 . 12 1 1 A 129 129 SER N N 127 115.599 115.661 -0.062 1
1 1313 . 12 1 1 A 130 130 ARG H H 128 8.795 8.453 0.342 1
1 1314 . 12 1 1 A 130 130 ARG HA H 128 4.160 4.081 0.079 1
1 1318 . 12 1 1 A 130 130 ARG C C 128 175.518 175.013 0.505 1
1 1319 . 12 1 1 A 130 130 ARG CA C 128 58.479 57.735 0.744 1
1 1320 . 12 1 1 A 130 130 ARG CB C 128 29.952 30.309 -0.357 1
1 1323 . 12 1 1 A 130 130 ARG N N 128 127.611 119.241 8.370 1
1 1324 . 12 1 1 A 131 131 PHE H H 129 9.315 8.736 0.579 1
1 1325 . 12 1 1 A 131 131 PHE HA H 129 4.878 5.028 -0.150 1
1 1331 . 12 1 1 A 131 131 PHE C C 129 175.058 174.091 0.967 1
1 1332 . 12 1 1 A 131 131 PHE CA C 129 55.953 56.048 -0.095 1
1 1333 . 12 1 1 A 131 131 PHE CB C 129 40.189 41.429 -1.240 1
1 1337 . 12 1 1 A 131 131 PHE N N 129 126.219 119.888 6.331 1
1 1338 . 12 1 1 A 132 132 GLN H H 130 8.160 8.244 -0.084 1
1 1339 . 12 1 1 A 132 132 GLN HA H 130 5.013 5.252 -0.239 1
1 1343 . 12 1 1 A 132 132 GLN CA C 130 54.498 54.496 0.002 1
1 1344 . 12 1 1 A 132 132 GLN CB C 130 32.106 32.728 -0.622 1
1 1346 . 12 1 1 A 132 132 GLN N N 130 125.589 125.930 -0.341 1
1 1347 . 12 1 1 A 133 133 VAL H H 131 8.689 9.054 -0.365 1
1 1348 . 12 1 1 A 133 133 VAL HA H 131 4.529 4.474 0.055 1
1 1356 . 12 1 1 A 133 133 VAL C C 131 174.441 175.810 -1.369 1
1 1357 . 12 1 1 A 133 133 VAL CA C 131 60.758 62.013 -1.255 1
1 1358 . 12 1 1 A 133 133 VAL CB C 131 32.417 31.763 0.654 1
1 1361 . 12 1 1 A 133 133 VAL N N 131 122.441 123.788 -1.347 1
1 1362 . 12 1 1 A 134 134 TRP H H 132 9.256 9.557 -0.301 1
1 1363 . 12 1 1 A 134 134 TRP HA H 132 5.213 5.110 0.103 1
1 1371 . 12 1 1 A 134 134 TRP C C 132 174.575 175.973 -1.398 1
1 1372 . 12 1 1 A 134 134 TRP CA C 132 53.859 56.441 -2.582 1
1 1373 . 12 1 1 A 134 134 TRP CB C 132 31.311 31.103 0.208 1
1 1379 . 12 1 1 A 134 134 TRP N N 132 130.303 128.459 1.844 1
1 1381 . 12 1 1 A 135 135 ASP H H 133 8.237 8.828 -0.591 1
1 1382 . 12 1 1 A 135 135 ASP HA H 133 6.018 5.965 0.053 1
1 1385 . 12 1 1 A 135 135 ASP C C 133 177.020 175.331 1.689 1
1 1386 . 12 1 1 A 135 135 ASP CA C 133 53.321 53.285 0.036 1
1 1387 . 12 1 1 A 135 135 ASP CB C 133 41.514 43.252 -1.738 1
1 1388 . 12 1 1 A 135 135 ASP N N 133 125.516 122.170 3.346 1
1 1389 . 12 1 1 A 136 136 TYR H H 134 9.058 8.220 0.838 1
1 1390 . 12 1 1 A 136 136 TYR HA H 134 4.970 5.238 -0.268 1
1 1394 . 12 1 1 A 136 136 TYR C C 134 172.324 172.950 -0.626 1
1 1395 . 12 1 1 A 136 136 TYR CA C 134 55.982 56.474 -0.492 1
1 1396 . 12 1 1 A 136 136 TYR CB C 134 42.265 40.288 1.977 1
1 1399 . 12 1 1 A 136 136 TYR N N 134 120.315 117.986 2.329 1
1 1400 . 12 1 1 A 137 137 ALA H H 135 8.521 8.479 0.042 1
1 1401 . 12 1 1 A 137 137 ALA HA H 135 4.280 4.296 -0.016 1
1 1405 . 12 1 1 A 137 137 ALA C C 135 178.561 177.447 1.114 1
1 1406 . 12 1 1 A 137 137 ALA CA C 135 49.550 50.813 -1.263 1
1 1407 . 12 1 1 A 137 137 ALA CB C 135 19.998 22.421 -2.423 1
1 1408 . 12 1 1 A 137 137 ALA N N 135 123.386 121.910 1.476 1
1 1409 . 12 1 1 A 138 138 GLU H H 136 8.678 8.963 -0.285 1
1 1410 . 12 1 1 A 138 138 GLU HA H 136 3.777 4.167 -0.390 1
1 1414 . 12 1 1 A 138 138 GLU C C 136 177.624 177.753 -0.129 1
1 1415 . 12 1 1 A 138 138 GLU CA C 136 60.527 59.052 1.475 1
1 1416 . 12 1 1 A 138 138 GLU CB C 136 29.020 29.318 -0.298 1
1 1418 . 12 1 1 A 138 138 GLU N N 136 121.774 120.924 0.850 1
1 1419 . 12 1 1 A 139 139 GLY H H 137 8.666 8.321 0.345 1
1 1420 . 12 1 1 A 139 139 GLY HA2 H 137 3.872 3.981 -0.109 1
1 1421 . 12 1 1 A 139 139 GLY HA3 H 137 3.872 3.997 -0.125 1
1 1422 . 12 1 1 A 139 139 GLY C C 137 175.122 174.427 0.695 1
1 1423 . 12 1 1 A 139 139 GLY CA C 137 46.093 45.700 0.393 1
1 1424 . 12 1 1 A 139 139 GLY N N 137 106.053 108.206 -2.153 1
1 1425 . 12 1 1 A 140 140 GLU H H 138 8.305 9.724 -1.419 1
1 1426 . 12 1 1 A 140 140 GLU HA H 138 4.754 4.666 0.088 1
1 1430 . 12 1 1 A 140 140 GLU C C 138 177.819 177.038 0.781 1
1 1431 . 12 1 1 A 140 140 GLU CA C 138 55.049 56.032 -0.983 1
1 1432 . 12 1 1 A 140 140 GLU CB C 138 30.504 30.944 -0.440 1
1 1434 . 12 1 1 A 140 140 GLU N N 138 117.485 117.810 -0.325 1
1 1435 . 12 1 1 A 141 141 VAL H H 139 7.267 7.636 -0.369 1
1 1436 . 12 1 1 A 141 141 VAL HA H 139 3.422 3.838 -0.416 1
1 1444 . 12 1 1 A 141 141 VAL C C 139 175.454 177.545 -2.091 1
1 1445 . 12 1 1 A 141 141 VAL CA C 139 66.769 64.980 1.789 1
1 1446 . 12 1 1 A 141 141 VAL CB C 139 31.377 31.605 -0.228 1
1 1449 . 12 1 1 A 141 141 VAL N N 139 120.764 121.294 -0.530 1
1 1450 . 12 1 1 A 142 142 GLU H H 140 8.620 8.525 0.095 1
1 1451 . 12 1 1 A 142 142 GLU HA H 140 3.592 4.204 -0.612 1
1 1452 . 12 1 1 A 142 142 GLU C C 140 177.320 178.787 -1.467 1
1 1453 . 12 1 1 A 142 142 GLU CA C 140 62.607 58.708 3.899 1
1 1454 . 12 1 1 A 142 142 GLU CB C 140 26.759 29.056 -2.297 1
1 1455 . 12 1 1 A 142 142 GLU N N 140 120.048 119.741 0.307 1
1 1456 . 12 1 1 A 143 143 THR H H 141 7.449 8.142 -0.693 1
1 1457 . 12 1 1 A 143 143 THR HA H 141 4.003 3.988 0.015 1
1 1462 . 12 1 1 A 143 143 THR C C 141 177.258 176.829 0.429 1
1 1463 . 12 1 1 A 143 143 THR CA C 141 65.490 67.020 -1.530 1
1 1464 . 12 1 1 A 143 143 THR CB C 141 68.641 68.125 0.516 1
1 1466 . 12 1 1 A 143 143 THR N N 141 114.073 116.967 -2.894 1
1 1467 . 12 1 1 A 144 144 MET H H 142 7.992 8.087 -0.095 1
1 1468 . 12 1 1 A 144 144 MET HA H 142 4.316 4.377 -0.061 1
1 1476 . 12 1 1 A 144 144 MET C C 142 178.233 178.726 -0.493 1
1 1477 . 12 1 1 A 144 144 MET CA C 142 57.743 59.040 -1.297 1
1 1478 . 12 1 1 A 144 144 MET CB C 142 31.326 32.540 -1.214 1
1 1481 . 12 1 1 A 144 144 MET N N 142 120.595 118.619 1.976 1
1 1482 . 12 1 1 A 145 145 LEU H H 143 7.847 8.213 -0.366 1
1 1483 . 12 1 1 A 145 145 LEU HA H 143 3.919 3.881 0.038 1
1 1491 . 12 1 1 A 145 145 LEU C C 143 178.774 179.567 -0.793 1
1 1492 . 12 1 1 A 145 145 LEU CA C 143 57.877 58.171 -0.294 1
1 1493 . 12 1 1 A 145 145 LEU CB C 143 40.951 40.814 0.137 1
1 1497 . 12 1 1 A 145 145 LEU N N 143 119.410 119.706 -0.296 1
1 1498 . 12 1 1 A 146 146 ASP H H 144 8.431 8.849 -0.418 1
1 1499 . 12 1 1 A 146 146 ASP HA H 144 4.312 4.474 -0.162 1
1 1502 . 12 1 1 A 146 146 ASP C C 144 178.129 178.911 -0.782 1
1 1503 . 12 1 1 A 146 146 ASP CA C 144 57.464 58.099 -0.635 1
1 1504 . 12 1 1 A 146 146 ASP CB C 144 39.548 41.535 -1.987 1
1 1505 . 12 1 1 A 146 146 ASP N N 144 119.837 119.709 0.128 1
1 1506 . 12 1 1 A 147 147 ARG H H 145 7.949 8.787 -0.838 1
1 1507 . 12 1 1 A 147 147 ARG HA H 145 4.050 4.129 -0.079 1
1 1512 . 12 1 1 A 147 147 ARG C C 145 179.547 178.850 0.697 1
1 1513 . 12 1 1 A 147 147 ARG CA C 145 58.972 59.569 -0.597 1
1 1514 . 12 1 1 A 147 147 ARG CB C 145 29.798 30.605 -0.807 1
1 1517 . 12 1 1 A 147 147 ARG N N 145 119.173 118.829 0.344 1
1 1518 . 12 1 1 A 148 148 TYR H H 146 8.128 8.232 -0.104 1
1 1519 . 12 1 1 A 148 148 TYR HA H 146 3.995 4.428 -0.433 1
1 1524 . 12 1 1 A 148 148 TYR C C 146 178.199 177.487 0.712 1
1 1525 . 12 1 1 A 148 148 TYR CA C 146 62.347 61.405 0.942 1
1 1526 . 12 1 1 A 148 148 TYR CB C 146 37.418 37.745 -0.327 1
1 1529 . 12 1 1 A 148 148 TYR N N 146 120.102 121.253 -1.151 1
1 1530 . 12 1 1 A 149 149 PHE H H 147 8.308 8.287 0.021 1
1 1531 . 12 1 1 A 149 149 PHE HA H 147 4.013 4.611 -0.598 1
1 1535 . 12 1 1 A 149 149 PHE C C 147 177.574 178.460 -0.886 1
1 1536 . 12 1 1 A 149 149 PHE CA C 147 63.044 61.632 1.412 1
1 1537 . 12 1 1 A 149 149 PHE CB C 147 37.153 38.188 -1.035 1
1 1541 . 12 1 1 A 149 149 PHE N N 147 116.680 117.723 -1.043 1
1 1542 . 12 1 1 A 150 150 GLU H H 148 8.271 9.161 -0.890 1
1 1543 . 12 1 1 A 150 150 GLU HA H 148 4.030 3.988 0.042 1
1 1547 . 12 1 1 A 150 150 GLU C C 148 177.687 178.291 -0.604 1
1 1548 . 12 1 1 A 150 150 GLU CA C 148 58.746 59.888 -1.142 1
1 1549 . 12 1 1 A 150 150 GLU CB C 148 28.847 29.536 -0.689 1
1 1551 . 12 1 1 A 150 150 GLU N N 148 119.973 119.171 0.802 1
1 1552 . 12 1 1 A 151 151 ALA H H 149 6.992 7.695 -0.703 1
1 1553 . 12 1 1 A 151 151 ALA HA H 149 4.217 4.266 -0.049 1
1 1557 . 12 1 1 A 151 151 ALA C C 149 178.190 177.404 0.786 1
1 1558 . 12 1 1 A 151 151 ALA CA C 149 52.779 52.892 -0.113 1
1 1559 . 12 1 1 A 151 151 ALA CB C 149 19.087 18.361 0.726 1
1 1560 . 12 1 1 A 151 151 ALA N N 149 118.629 120.587 -1.958 1
1 1561 . 12 1 1 A 152 152 TYR H H 150 7.722 9.468 -1.746 1
1 1562 . 12 1 1 A 152 152 TYR HA H 150 4.137 4.876 -0.739 1
1 1567 . 12 1 1 A 152 152 TYR C C 150 175.703 175.963 -0.260 1
1 1568 . 12 1 1 A 152 152 TYR CA C 150 59.260 59.121 0.139 1
1 1569 . 12 1 1 A 152 152 TYR CB C 150 39.165 41.453 -2.288 1
1 1572 . 12 1 1 A 152 152 TYR N N 150 118.767 117.859 0.908 1
1 1573 . 12 1 1 A 153 153 LEU H H 151 7.670 10.064 -2.394 1
1 1574 . 12 1 1 A 153 153 LEU HA H 151 4.145 4.799 -0.654 1
1 1584 . 12 1 1 A 153 153 LEU CA C 151 54.704 52.602 2.102 1
1 1585 . 12 1 1 A 153 153 LEU CB C 151 40.520 42.726 -2.206 1
1 1589 . 12 1 1 A 153 153 LEU N N 151 122.313 118.410 3.903 1
1 1590 . 12 1 1 A 154 154 PRO HA H 152 4.258 4.472 -0.214 1
1 1597 . 12 1 1 A 154 154 PRO C C 152 177.496 176.978 0.518 1
1 1598 . 12 1 1 A 154 154 PRO CA C 152 63.899 64.461 -0.562 1
1 1599 . 12 1 1 A 154 154 PRO CB C 152 31.080 31.957 -0.877 1
1 1602 . 12 1 1 A 155 155 GLN H H 153 8.023 8.166 -0.143 1
1 1603 . 12 1 1 A 155 155 GLN HA H 153 4.176 4.420 -0.244 1
1 1607 . 12 1 1 A 155 155 GLN C C 153 176.636 176.612 0.024 1
1 1608 . 12 1 1 A 155 155 GLN CA C 153 55.968 56.626 -0.658 1
1 1609 . 12 1 1 A 155 155 GLN CB C 153 28.723 30.812 -2.089 1
1 1610 . 12 1 1 A 155 155 GLN N N 153 119.173 116.414 2.759 1
1 1611 . 12 1 1 A 156 156 LYS H H 154 8.113 7.903 0.210 1
1 1612 . 12 1 1 A 156 156 LYS HA H 154 4.196 4.202 -0.006 1
1 1619 . 12 1 1 A 156 156 LYS C C 154 56.493 178.759 -122.266 1
1 1620 . 12 1 1 A 156 156 LYS CA C 154 56.493 58.839 -2.346 1
1 1621 . 12 1 1 A 156 156 LYS CB C 154 32.037 32.160 -0.123 1
1 1625 . 12 1 1 A 156 156 LYS N N 154 122.788 121.129 1.659 1
1 1626 . 12 1 1 A 157 157 THR H H 155 8.013 8.025 -0.012 1
1 1627 . 12 1 1 A 157 157 THR HA H 155 4.183 4.032 0.151 1
1 1632 . 12 1 1 A 157 157 THR C C 155 174.580 174.747 -0.167 1
1 1633 . 12 1 1 A 157 157 THR CA C 155 61.958 66.109 -4.151 1
1 1634 . 12 1 1 A 157 157 THR CB C 155 69.665 68.716 0.949 1
1 1636 . 12 1 1 A 157 157 THR N N 155 115.504 115.163 0.341 1
1 1637 . 12 1 1 A 158 158 ALA H H 156 8.170 7.515 0.655 1
1 1638 . 12 1 1 A 158 158 ALA HA H 156 4.220 4.642 -0.422 1
1 1642 . 12 1 1 A 158 158 ALA CA C 156 52.492 50.916 1.576 1
1 1643 . 12 1 1 A 158 158 ALA CB C 156 18.810 21.284 -2.474 1
1 1644 . 12 1 1 A 158 158 ALA N N 156 126.825 123.154 3.671 1
1 1645 . 12 1 1 A 159 159 SER H H 157 7.762 8.511 -0.749 1
1 1646 . 12 1 1 A 159 159 SER CA C 157 58.230 56.369 1.861 1
1 1647 . 12 1 1 A 159 159 SER CB C 157 63.440 66.552 -3.112 1
1 1648 . 12 1 1 A 159 159 SER N N 157 123.078 116.366 6.712 1
1 1649 . 12 1 1 A 162 162 HIS HA H 160 4.845 4.697 0.148 1
1 1652 . 12 1 1 A 162 162 HIS CA C 160 53.590 57.135 -3.545 1
1 1653 . 12 1 1 A 162 162 HIS CB C 160 29.398 28.611 0.787 1
1 1654 . 12 1 1 A 163 163 PRO HA H 161 4.388 4.507 -0.119 1
1 1660 . 12 1 1 A 163 163 PRO C C 161 177.018 177.397 -0.379 1
1 1661 . 12 1 1 A 163 163 PRO CA C 161 63.118 62.784 0.334 1
1 1662 . 12 1 1 A 163 163 PRO CB C 161 31.668 32.510 -0.842 1
1 1665 . 12 1 1 A 164 164 SER H H 162 8.418 8.725 -0.307 1
1 1666 . 12 1 1 A 164 164 SER HA H 162 4.338 4.220 0.118 1
1 1668 . 12 1 1 A 164 164 SER C C 162 173.327 175.778 -2.451 1
1 1669 . 12 1 1 A 164 164 SER CA C 162 58.202 61.261 -3.059 1
1 1670 . 12 1 1 A 164 164 SER CB C 162 64.080 62.717 1.363 1
1 1671 . 12 1 1 A 164 164 SER N N 162 117.485 118.328 -0.843 1
1 6 . 13 1 1 A 4 4 ALA H H 2 8.270 8.645 -0.375 1
1 7 . 13 1 1 A 4 4 ALA HA H 2 4.212 4.061 0.151 1
1 11 . 13 1 1 A 4 4 ALA C C 2 177.441 177.894 -0.453 1
1 12 . 13 1 1 A 4 4 ALA CA C 2 52.280 53.911 -1.631 1
1 13 . 13 1 1 A 4 4 ALA CB C 2 18.880 18.355 0.525 1
1 14 . 13 1 1 A 4 4 ALA N N 2 126.500 120.183 6.317 1
1 15 . 13 1 1 A 5 5 ALA H H 3 8.251 7.999 0.252 1
1 16 . 13 1 1 A 5 5 ALA HA H 3 4.261 4.123 0.138 1
1 20 . 13 1 1 A 5 5 ALA C C 3 177.824 179.777 -1.953 1
1 21 . 13 1 1 A 5 5 ALA CA C 3 52.347 54.707 -2.360 1
1 22 . 13 1 1 A 5 5 ALA CB C 3 18.869 18.368 0.501 1
1 23 . 13 1 1 A 5 5 ALA N N 3 124.322 120.311 4.011 1
1 24 . 13 1 1 A 6 6 SER H H 4 8.158 7.951 0.207 1
1 25 . 13 1 1 A 6 6 SER HA H 4 4.358 4.310 0.048 1
1 27 . 13 1 1 A 6 6 SER C C 4 175.222 174.467 0.755 1
1 28 . 13 1 1 A 6 6 SER CA C 4 58.438 59.953 -1.515 1
1 29 . 13 1 1 A 6 6 SER CB C 4 63.859 64.452 -0.593 1
1 30 . 13 1 1 A 6 6 SER N N 4 115.338 111.588 3.750 1
1 31 . 13 1 1 A 7 7 GLY H H 5 8.265 8.062 0.203 1
1 32 . 13 1 1 A 7 7 GLY HA2 H 5 3.900 4.130 -0.230 1
1 33 . 13 1 1 A 7 7 GLY C C 5 174.083 173.919 0.164 1
1 34 . 13 1 1 A 7 7 GLY CA C 5 45.113 44.645 0.468 1
1 35 . 13 1 1 A 7 7 GLY N N 5 111.360 109.877 1.483 1
1 36 . 13 1 1 A 8 8 GLU H H 6 8.100 8.426 -0.326 1
1 37 . 13 1 1 A 8 8 GLU HA H 6 4.209 4.271 -0.062 1
1 41 . 13 1 1 A 8 8 GLU C C 6 176.354 176.781 -0.427 1
1 42 . 13 1 1 A 8 8 GLU CA C 6 56.261 56.731 -0.470 1
1 43 . 13 1 1 A 8 8 GLU CB C 6 29.830 29.970 -0.140 1
1 45 . 13 1 1 A 8 8 GLU N N 6 121.056 121.082 -0.026 1
1 46 . 13 1 1 A 9 9 GLN H H 7 8.287 8.279 0.008 1
1 47 . 13 1 1 A 9 9 GLN HA H 7 4.247 4.567 -0.320 1
1 51 . 13 1 1 A 9 9 GLN C C 7 172.457 175.687 -3.230 1
1 52 . 13 1 1 A 9 9 GLN CA C 7 55.269 54.138 1.131 1
1 53 . 13 1 1 A 9 9 GLN CB C 7 29.236 29.285 -0.049 1
1 55 . 13 1 1 A 9 9 GLN N N 7 122.164 121.538 0.626 1
1 56 . 13 1 1 A 10 10 ALA H H 8 8.368 8.446 -0.078 1
1 57 . 13 1 1 A 10 10 ALA HA H 8 4.509 4.551 -0.042 1
1 61 . 13 1 1 A 10 10 ALA CA C 8 50.341 50.844 -0.503 1
1 62 . 13 1 1 A 10 10 ALA CB C 8 18.140 18.077 0.063 1
1 63 . 13 1 1 A 10 10 ALA N N 8 128.028 122.491 5.537 1
1 64 . 13 1 1 A 11 11 PRO HA H 9 4.437 4.583 -0.146 1
1 70 . 13 1 1 A 11 11 PRO C C 9 176.381 176.859 -0.478 1
1 71 . 13 1 1 A 11 11 PRO CA C 9 63.298 62.771 0.527 1
1 72 . 13 1 1 A 11 11 PRO CB C 9 31.776 32.114 -0.338 1
1 75 . 13 1 1 A 12 12 CYS H H 10 8.056 8.399 -0.343 1
1 76 . 13 1 1 A 12 12 CYS HA H 10 4.717 4.619 0.098 1
1 79 . 13 1 1 A 12 12 CYS C C 10 173.266 174.484 -1.218 1
1 80 . 13 1 1 A 12 12 CYS CA C 10 57.398 59.029 -1.631 1
1 81 . 13 1 1 A 12 12 CYS CB C 10 29.165 28.856 0.309 1
1 82 . 13 1 1 A 12 12 CYS N N 10 118.295 119.275 -0.980 1
1 83 . 13 1 1 A 13 13 SER H H 11 9.815 8.724 1.091 1
1 84 . 13 1 1 A 13 13 SER HA H 11 5.227 5.429 -0.202 1
1 87 . 13 1 1 A 13 13 SER C C 11 173.648 172.761 0.887 1
1 88 . 13 1 1 A 13 13 SER CA C 11 57.630 57.285 0.345 1
1 89 . 13 1 1 A 13 13 SER CB C 11 64.820 66.570 -1.750 1
1 90 . 13 1 1 A 13 13 SER N N 11 122.365 119.086 3.279 1
1 91 . 13 1 1 A 14 14 VAL H H 12 9.352 9.445 -0.093 1
1 92 . 13 1 1 A 14 14 VAL HA H 12 4.696 5.900 -1.204 1
1 100 . 13 1 1 A 14 14 VAL C C 12 173.875 173.945 -0.070 1
1 101 . 13 1 1 A 14 14 VAL CA C 12 60.146 60.399 -0.253 1
1 102 . 13 1 1 A 14 14 VAL CB C 12 34.499 34.471 0.028 1
1 105 . 13 1 1 A 14 14 VAL N N 12 126.378 117.864 8.514 1
1 106 . 13 1 1 A 15 15 TYR H H 13 8.745 9.417 -0.672 1
1 111 . 13 1 1 A 15 15 TYR C C 13 173.345 174.130 -0.785 1
1 112 . 13 1 1 A 15 15 TYR CA C 13 56.186 57.377 -1.191 1
1 113 . 13 1 1 A 15 15 TYR CB C 13 40.858 40.100 0.758 1
1 116 . 13 1 1 A 15 15 TYR N N 13 129.472 126.994 2.478 1
1 117 . 13 1 1 A 16 16 PHE H H 14 7.370 8.363 -0.993 1
1 118 . 13 1 1 A 16 16 PHE HA H 14 5.720 5.008 0.712 1
1 123 . 13 1 1 A 16 16 PHE C C 14 174.058 173.885 0.173 1
1 124 . 13 1 1 A 16 16 PHE CA C 14 54.361 56.711 -2.350 1
1 125 . 13 1 1 A 16 16 PHE CB C 14 40.461 41.383 -0.922 1
1 129 . 13 1 1 A 16 16 PHE N N 14 128.263 129.031 -0.768 1
1 130 . 13 1 1 A 17 17 CYS H H 15 8.147 7.990 0.157 1
1 131 . 13 1 1 A 17 17 CYS CA C 15 56.570 58.076 -1.506 1
1 132 . 13 1 1 A 17 17 CYS CB C 15 29.690 29.893 -0.203 1
1 133 . 13 1 1 A 17 17 CYS N N 15 126.188 125.312 0.876 1
1 134 . 13 1 1 A 18 18 GLY HA2 H 16 3.819 4.007 -0.188 1
1 135 . 13 1 1 A 18 18 GLY C C 16 173.374 172.471 0.903 1
1 136 . 13 1 1 A 18 18 GLY CA C 16 45.510 44.493 1.017 1
1 137 . 13 1 1 A 19 19 SER H H 17 8.533 9.447 -0.914 1
1 138 . 13 1 1 A 19 19 SER HA H 17 4.505 4.852 -0.347 1
1 139 . 13 1 1 A 19 19 SER CA C 17 58.700 59.410 -0.710 1
1 140 . 13 1 1 A 19 19 SER CB C 17 63.810 63.824 -0.014 1
1 141 . 13 1 1 A 19 19 SER N N 17 117.300 116.244 1.056 1
1 142 . 13 1 1 A 20 20 ILE HA H 18 4.309 4.398 -0.089 1
1 152 . 13 1 1 A 20 20 ILE CA C 18 61.317 62.412 -1.095 1
1 153 . 13 1 1 A 20 20 ILE CB C 18 38.302 38.828 -0.526 1
1 157 . 13 1 1 A 21 21 ARG HA H 19 4.172 3.943 0.229 1
1 160 . 13 1 1 A 21 21 ARG C C 19 177.118 174.983 2.135 1
1 161 . 13 1 1 A 21 21 ARG CA C 19 56.960 57.605 -0.645 1
1 162 . 13 1 1 A 21 21 ARG CB C 19 29.568 29.611 -0.043 1
1 165 . 13 1 1 A 22 22 GLY H H 20 8.685 7.527 1.158 1
1 166 . 13 1 1 A 22 22 GLY HA2 H 20 3.801 4.122 -0.321 1
1 167 . 13 1 1 A 22 22 GLY HA3 H 20 3.923 4.130 -0.207 1
1 168 . 13 1 1 A 22 22 GLY C C 20 174.814 174.826 -0.012 1
1 169 . 13 1 1 A 22 22 GLY CA C 20 45.289 45.635 -0.346 1
1 170 . 13 1 1 A 22 22 GLY N N 20 110.145 107.282 2.863 1
1 171 . 13 1 1 A 23 23 GLY H H 21 8.058 8.883 -0.825 1
1 172 . 13 1 1 A 23 23 GLY HA2 H 21 3.998 3.804 0.194 1
1 173 . 13 1 1 A 23 23 GLY HA3 H 21 4.237 3.806 0.431 1
1 174 . 13 1 1 A 23 23 GLY C C 21 174.762 174.367 0.395 1
1 175 . 13 1 1 A 23 23 GLY CA C 21 45.025 47.377 -2.352 1
1 176 . 13 1 1 A 23 23 GLY N N 21 109.327 107.499 1.828 1
1 177 . 13 1 1 A 24 24 ARG H H 22 8.376 7.642 0.734 1
1 178 . 13 1 1 A 24 24 ARG HA H 22 4.086 4.168 -0.082 1
1 184 . 13 1 1 A 24 24 ARG C C 22 178.178 177.092 1.086 1
1 185 . 13 1 1 A 24 24 ARG CA C 22 57.471 57.454 0.017 1
1 186 . 13 1 1 A 24 24 ARG CB C 22 29.653 29.087 0.566 1
1 189 . 13 1 1 A 24 24 ARG N N 22 120.861 115.481 5.380 1
1 190 . 13 1 1 A 25 25 GLU H H 23 8.831 8.794 0.037 1
1 191 . 13 1 1 A 25 25 GLU HA H 23 4.015 4.020 -0.005 1
1 195 . 13 1 1 A 25 25 GLU C C 23 178.005 178.113 -0.108 1
1 196 . 13 1 1 A 25 25 GLU CA C 23 58.920 59.124 -0.204 1
1 197 . 13 1 1 A 25 25 GLU CB C 23 28.592 29.203 -0.611 1
1 199 . 13 1 1 A 25 25 GLU N N 23 121.243 122.123 -0.880 1
1 200 . 13 1 1 A 26 26 ASP H H 24 7.897 7.984 -0.087 1
1 201 . 13 1 1 A 26 26 ASP HA H 24 4.516 4.019 0.497 1
1 203 . 13 1 1 A 26 26 ASP C C 24 176.455 178.702 -2.247 1
1 204 . 13 1 1 A 26 26 ASP CA C 24 55.122 56.105 -0.983 1
1 205 . 13 1 1 A 26 26 ASP CB C 24 39.888 39.691 0.197 1
1 206 . 13 1 1 A 26 26 ASP N N 24 119.541 119.624 -0.083 1
1 207 . 13 1 1 A 27 27 GLN H H 25 7.696 8.007 -0.311 1
1 208 . 13 1 1 A 27 27 GLN HA H 25 3.704 3.854 -0.150 1
1 212 . 13 1 1 A 27 27 GLN C C 25 177.016 178.405 -1.389 1
1 213 . 13 1 1 A 27 27 GLN CA C 25 59.501 58.252 1.249 1
1 214 . 13 1 1 A 27 27 GLN CB C 25 27.762 28.331 -0.569 1
1 216 . 13 1 1 A 27 27 GLN N N 25 119.471 119.222 0.249 1
1 217 . 13 1 1 A 28 28 ALA H H 26 8.227 7.667 0.560 1
1 218 . 13 1 1 A 28 28 ALA HA H 26 4.072 4.275 -0.203 1
1 222 . 13 1 1 A 28 28 ALA C C 26 180.567 179.837 0.730 1
1 223 . 13 1 1 A 28 28 ALA CA C 26 54.627 55.093 -0.466 1
1 224 . 13 1 1 A 28 28 ALA CB C 26 17.355 18.448 -1.093 1
1 225 . 13 1 1 A 28 28 ALA N N 26 122.362 122.405 -0.043 1
1 226 . 13 1 1 A 29 29 LEU H H 27 7.533 8.600 -1.067 1
1 227 . 13 1 1 A 29 29 LEU HA H 27 4.050 4.065 -0.015 1
1 237 . 13 1 1 A 29 29 LEU C C 27 178.752 177.985 0.767 1
1 238 . 13 1 1 A 29 29 LEU CA C 27 57.578 57.638 -0.060 1
1 239 . 13 1 1 A 29 29 LEU CB C 27 40.734 41.777 -1.043 1
1 243 . 13 1 1 A 29 29 LEU N N 27 122.255 119.628 2.627 1
1 244 . 13 1 1 A 30 30 TYR H H 28 8.473 8.261 0.212 1
1 245 . 13 1 1 A 30 30 TYR HA H 28 4.049 4.252 -0.203 1
1 250 . 13 1 1 A 30 30 TYR C C 28 177.736 178.308 -0.572 1
1 251 . 13 1 1 A 30 30 TYR CA C 28 59.817 60.463 -0.646 1
1 252 . 13 1 1 A 30 30 TYR CB C 28 36.140 37.229 -1.089 1
1 255 . 13 1 1 A 30 30 TYR N N 28 120.403 118.568 1.835 1
1 256 . 13 1 1 A 31 31 ALA H H 29 8.008 8.788 -0.780 1
1 257 . 13 1 1 A 31 31 ALA HA H 29 4.005 3.979 0.026 1
1 261 . 13 1 1 A 31 31 ALA C C 29 180.879 179.592 1.287 1
1 262 . 13 1 1 A 31 31 ALA CA C 29 54.914 55.228 -0.314 1
1 263 . 13 1 1 A 31 31 ALA CB C 29 17.375 18.196 -0.821 1
1 264 . 13 1 1 A 31 31 ALA N N 29 120.771 122.989 -2.218 1
1 265 . 13 1 1 A 32 32 ARG H H 30 7.596 7.631 -0.035 1
1 266 . 13 1 1 A 32 32 ARG HA H 30 3.916 4.120 -0.204 1
1 273 . 13 1 1 A 32 32 ARG C C 30 179.919 178.669 1.250 1
1 274 . 13 1 1 A 32 32 ARG CA C 30 59.014 59.065 -0.051 1
1 275 . 13 1 1 A 32 32 ARG CB C 30 30.531 29.892 0.639 1
1 278 . 13 1 1 A 32 32 ARG N N 30 120.365 118.257 2.108 1
1 279 . 13 1 1 A 33 33 ILE H H 31 8.066 8.504 -0.438 1
1 280 . 13 1 1 A 33 33 ILE HA H 31 3.120 3.756 -0.636 1
1 290 . 13 1 1 A 33 33 ILE C C 31 177.051 178.518 -1.467 1
1 291 . 13 1 1 A 33 33 ILE CA C 31 65.757 65.400 0.357 1
1 292 . 13 1 1 A 33 33 ILE CB C 31 36.928 38.055 -1.127 1
1 296 . 13 1 1 A 33 33 ILE N N 31 121.608 119.943 1.665 1
1 297 . 13 1 1 A 34 34 VAL H H 32 8.148 9.118 -0.970 1
1 298 . 13 1 1 A 34 34 VAL HA H 32 2.954 3.584 -0.630 1
1 306 . 13 1 1 A 34 34 VAL C C 32 177.159 177.844 -0.685 1
1 307 . 13 1 1 A 34 34 VAL CA C 32 67.220 66.439 0.781 1
1 308 . 13 1 1 A 34 34 VAL CB C 32 31.039 31.143 -0.104 1
1 311 . 13 1 1 A 34 34 VAL N N 32 119.318 120.545 -1.227 1
1 312 . 13 1 1 A 35 35 SER H H 33 7.826 8.377 -0.551 1
1 313 . 13 1 1 A 35 35 SER HA H 33 3.868 4.059 -0.191 1
1 316 . 13 1 1 A 35 35 SER C C 33 176.779 177.176 -0.397 1
1 317 . 13 1 1 A 35 35 SER CA C 33 62.000 61.626 0.374 1
1 318 . 13 1 1 A 35 35 SER CB C 33 62.789 62.397 0.392 1
1 319 . 13 1 1 A 35 35 SER N N 33 111.936 114.934 -2.998 1
1 320 . 13 1 1 A 36 36 ARG H H 34 7.405 7.590 -0.185 1
1 321 . 13 1 1 A 36 36 ARG HA H 34 4.070 4.012 0.058 1
1 323 . 13 1 1 A 36 36 ARG C C 34 178.047 178.071 -0.024 1
1 324 . 13 1 1 A 36 36 ARG CA C 34 56.108 58.959 -2.851 1
1 325 . 13 1 1 A 36 36 ARG CB C 34 28.837 30.161 -1.324 1
1 326 . 13 1 1 A 36 36 ARG N N 34 120.909 122.159 -1.250 1
1 327 . 13 1 1 A 37 37 LEU H H 35 8.301 8.133 0.168 1
1 328 . 13 1 1 A 37 37 LEU HA H 35 3.620 3.705 -0.085 1
1 336 . 13 1 1 A 37 37 LEU C C 35 178.446 178.820 -0.374 1
1 337 . 13 1 1 A 37 37 LEU CA C 35 57.640 57.643 -0.003 1
1 338 . 13 1 1 A 37 37 LEU CB C 35 41.584 41.026 0.558 1
1 342 . 13 1 1 A 37 37 LEU N N 35 118.567 119.409 -0.842 1
1 343 . 13 1 1 A 38 38 ARG H H 36 7.379 8.149 -0.770 1
1 344 . 13 1 1 A 38 38 ARG HA H 36 4.340 3.825 0.515 1
1 350 . 13 1 1 A 38 38 ARG C C 36 177.895 178.483 -0.588 1
1 351 . 13 1 1 A 38 38 ARG CA C 36 57.785 59.078 -1.293 1
1 352 . 13 1 1 A 38 38 ARG CB C 36 29.775 29.588 0.187 1
1 355 . 13 1 1 A 38 38 ARG N N 36 115.352 120.325 -4.973 1
1 356 . 13 1 1 A 39 39 ARG H H 37 7.240 7.627 -0.387 1
1 357 . 13 1 1 A 39 39 ARG HA H 37 3.743 4.246 -0.503 1
1 363 . 13 1 1 A 39 39 ARG C C 37 176.988 176.104 0.884 1
1 364 . 13 1 1 A 39 39 ARG CA C 37 57.605 58.893 -1.288 1
1 365 . 13 1 1 A 39 39 ARG CB C 37 28.925 30.828 -1.903 1
1 368 . 13 1 1 A 39 39 ARG N N 37 117.410 117.083 0.327 1
1 369 . 13 1 1 A 40 40 TYR H H 38 7.296 7.420 -0.124 1
1 370 . 13 1 1 A 40 40 TYR HA H 38 4.319 4.946 -0.627 1
1 375 . 13 1 1 A 40 40 TYR C C 38 175.001 175.032 -0.031 1
1 376 . 13 1 1 A 40 40 TYR CA C 38 57.730 55.708 2.022 1
1 377 . 13 1 1 A 40 40 TYR CB C 38 39.343 41.358 -2.015 1
1 380 . 13 1 1 A 40 40 TYR N N 38 116.937 116.052 0.885 1
1 381 . 13 1 1 A 41 41 GLY H H 39 7.325 8.644 -1.319 1
1 382 . 13 1 1 A 41 41 GLY HA2 H 39 3.953 3.822 0.131 1
1 383 . 13 1 1 A 41 41 GLY C C 39 171.302 175.088 -3.786 1
1 384 . 13 1 1 A 41 41 GLY CA C 39 45.590 46.846 -1.256 1
1 385 . 13 1 1 A 41 41 GLY N N 39 105.596 110.659 -5.063 1
1 386 . 13 1 1 A 42 42 LYS H H 40 8.186 7.823 0.363 1
1 387 . 13 1 1 A 42 42 LYS HA H 40 4.205 4.062 0.143 1
1 393 . 13 1 1 A 42 42 LYS C C 40 175.672 176.111 -0.439 1
1 394 . 13 1 1 A 42 42 LYS CA C 40 55.241 57.329 -2.088 1
1 395 . 13 1 1 A 42 42 LYS CB C 40 32.889 32.510 0.379 1
1 399 . 13 1 1 A 42 42 LYS N N 40 120.341 119.707 0.634 1
1 400 . 13 1 1 A 43 43 VAL H H 41 8.610 8.615 -0.005 1
1 401 . 13 1 1 A 43 43 VAL HA H 41 4.416 4.144 0.272 1
1 409 . 13 1 1 A 43 43 VAL C C 41 175.997 175.180 0.817 1
1 410 . 13 1 1 A 43 43 VAL CA C 41 61.331 62.501 -1.170 1
1 411 . 13 1 1 A 43 43 VAL CB C 41 30.573 31.512 -0.939 1
1 414 . 13 1 1 A 43 43 VAL N N 41 127.312 125.717 1.595 1
1 415 . 13 1 1 A 44 44 LEU H H 42 8.894 8.217 0.677 1
1 416 . 13 1 1 A 44 44 LEU HA H 42 4.496 3.944 0.552 1
1 424 . 13 1 1 A 44 44 LEU CA C 42 54.522 52.785 1.737 1
1 425 . 13 1 1 A 44 44 LEU CB C 42 40.980 43.732 -2.752 1
1 429 . 13 1 1 A 44 44 LEU N N 42 130.261 127.758 2.503 1
1 430 . 13 1 1 A 45 45 THR HA H 43 4.263 3.915 0.348 1
1 435 . 13 1 1 A 45 45 THR CA C 43 61.033 62.101 -1.068 1
1 436 . 13 1 1 A 45 45 THR CB C 43 69.768 66.467 3.301 1
1 440 . 13 1 1 A 46 46 GLU CA C 44 56.411 59.170 -2.759 1
1 441 . 13 1 1 A 46 46 GLU CB C 44 29.827 29.301 0.526 1
1 443 . 13 1 1 A 47 47 HIS HA H 45 4.549 4.085 0.464 1
1 447 . 13 1 1 A 47 47 HIS C C 45 174.812 176.046 -1.234 1
1 448 . 13 1 1 A 47 47 HIS CA C 45 56.107 59.713 -3.606 1
1 449 . 13 1 1 A 47 47 HIS CB C 45 29.080 29.738 -0.658 1
1 451 . 13 1 1 A 48 48 VAL H H 46 7.826 6.963 0.863 1
1 452 . 13 1 1 A 48 48 VAL HA H 46 4.024 3.041 0.983 1
1 460 . 13 1 1 A 48 48 VAL C C 46 175.697 176.387 -0.690 1
1 461 . 13 1 1 A 48 48 VAL CA C 46 61.841 62.247 -0.406 1
1 462 . 13 1 1 A 48 48 VAL CB C 46 32.600 32.217 0.383 1
1 465 . 13 1 1 A 48 48 VAL N N 46 121.117 118.184 2.933 1
1 466 . 13 1 1 A 49 49 ALA H H 47 8.237 8.286 -0.049 1
1 467 . 13 1 1 A 49 49 ALA HA H 47 4.281 3.794 0.487 1
1 471 . 13 1 1 A 49 49 ALA C C 47 177.173 177.327 -0.154 1
1 472 . 13 1 1 A 49 49 ALA CA C 47 52.207 54.907 -2.700 1
1 473 . 13 1 1 A 49 49 ALA CB C 47 19.064 17.371 1.693 1
1 474 . 13 1 1 A 49 49 ALA N N 47 126.817 125.698 1.119 1
1 475 . 13 1 1 A 50 50 ASP H H 48 8.029 10.076 -2.047 1
1 476 . 13 1 1 A 50 50 ASP HA H 48 4.436 4.462 -0.026 1
1 479 . 13 1 1 A 50 50 ASP C C 48 176.124 177.028 -0.904 1
1 480 . 13 1 1 A 50 50 ASP CA C 48 54.447 55.346 -0.899 1
1 481 . 13 1 1 A 50 50 ASP CB C 48 40.877 39.879 0.998 1
1 482 . 13 1 1 A 50 50 ASP N N 48 119.687 117.390 2.297 1
1 483 . 13 1 1 A 51 51 ALA H H 49 8.094 7.712 0.382 1
1 484 . 13 1 1 A 51 51 ALA HA H 49 4.134 4.220 -0.086 1
1 488 . 13 1 1 A 51 51 ALA C C 49 177.835 179.799 -1.964 1
1 489 . 13 1 1 A 51 51 ALA CA C 49 52.900 54.920 -2.020 1
1 490 . 13 1 1 A 51 51 ALA CB C 49 18.942 18.463 0.479 1
1 491 . 13 1 1 A 51 51 ALA N N 49 124.400 121.091 3.309 1
1 492 . 13 1 1 A 52 52 GLU H H 50 8.243 7.805 0.438 1
1 493 . 13 1 1 A 52 52 GLU HA H 50 4.152 4.019 0.133 1
1 497 . 13 1 1 A 52 52 GLU C C 50 176.456 179.170 -2.714 1
1 498 . 13 1 1 A 52 52 GLU CA C 50 56.480 59.139 -2.659 1
1 499 . 13 1 1 A 52 52 GLU CB C 50 29.470 29.220 0.250 1
1 501 . 13 1 1 A 52 52 GLU N N 50 118.917 118.551 0.366 1
1 502 . 13 1 1 A 53 53 LEU H H 51 7.839 7.735 0.104 1
1 503 . 13 1 1 A 53 53 LEU HA H 51 4.229 3.997 0.232 1
1 513 . 13 1 1 A 53 53 LEU C C 51 177.058 178.219 -1.161 1
1 514 . 13 1 1 A 53 53 LEU CA C 51 54.625 57.986 -3.361 1
1 515 . 13 1 1 A 53 53 LEU CB C 51 42.125 41.650 0.475 1
1 519 . 13 1 1 A 53 53 LEU N N 51 122.169 120.597 1.572 1
1 520 . 13 1 1 A 54 54 GLU H H 52 8.104 8.086 0.018 1
1 521 . 13 1 1 A 54 54 GLU HA H 52 4.470 4.570 -0.100 1
1 525 . 13 1 1 A 54 54 GLU CA C 52 54.286 57.621 -3.335 1
1 526 . 13 1 1 A 54 54 GLU CB C 52 29.268 32.807 -3.539 1
1 528 . 13 1 1 A 54 54 GLU N N 52 123.040 114.446 8.594 1
1 529 . 13 1 1 A 55 55 PRO HA H 53 4.310 4.721 -0.411 1
1 536 . 13 1 1 A 55 55 PRO C C 53 177.019 176.048 0.971 1
1 537 . 13 1 1 A 55 55 PRO CA C 53 63.075 62.423 0.652 1
1 538 . 13 1 1 A 55 55 PRO CB C 53 31.329 29.332 1.997 1
1 541 . 13 1 1 A 56 56 LEU H H 54 8.263 8.096 0.167 1
1 542 . 13 1 1 A 56 56 LEU HA H 54 4.237 4.636 -0.399 1
1 552 . 13 1 1 A 56 56 LEU C C 54 178.055 177.433 0.622 1
1 553 . 13 1 1 A 56 56 LEU CA C 54 55.018 54.785 0.233 1
1 554 . 13 1 1 A 56 56 LEU CB C 54 41.990 43.492 -1.502 1
1 558 . 13 1 1 A 56 56 LEU N N 54 122.728 124.202 -1.474 1
1 559 . 13 1 1 A 57 57 GLY H H 55 8.231 8.943 -0.712 1
1 560 . 13 1 1 A 57 57 GLY HA2 H 55 3.911 4.007 -0.096 1
1 561 . 13 1 1 A 57 57 GLY HA3 H 55 3.808 4.039 -0.231 1
1 562 . 13 1 1 A 57 57 GLY C C 55 174.379 175.782 -1.403 1
1 563 . 13 1 1 A 57 57 GLY CA C 55 45.092 45.622 -0.530 1
1 564 . 13 1 1 A 57 57 GLY N N 55 110.035 110.279 -0.244 1
1 565 . 13 1 1 A 58 58 GLU H H 56 8.241 8.885 -0.644 1
1 566 . 13 1 1 A 58 58 GLU HA H 56 4.136 4.322 -0.186 1
1 570 . 13 1 1 A 58 58 GLU C C 56 176.868 179.164 -2.296 1
1 571 . 13 1 1 A 58 58 GLU CA C 56 56.734 59.503 -2.769 1
1 572 . 13 1 1 A 58 58 GLU CB C 56 29.584 29.310 0.274 1
1 574 . 13 1 1 A 58 58 GLU N N 56 121.173 122.118 -0.945 1
1 575 . 13 1 1 A 59 59 GLU H H 57 8.419 8.246 0.173 1
1 576 . 13 1 1 A 59 59 GLU HA H 57 4.074 4.032 0.042 1
1 580 . 13 1 1 A 59 59 GLU C C 57 176.502 177.774 -1.272 1
1 581 . 13 1 1 A 59 59 GLU CA C 57 56.842 59.068 -2.226 1
1 582 . 13 1 1 A 59 59 GLU CB C 57 29.267 29.366 -0.099 1
1 584 . 13 1 1 A 59 59 GLU N N 57 121.777 120.291 1.486 1
1 585 . 13 1 1 A 60 60 ALA H H 58 8.077 7.304 0.773 1
1 586 . 13 1 1 A 60 60 ALA HA H 58 4.134 4.312 -0.178 1
1 590 . 13 1 1 A 60 60 ALA CA C 58 52.432 51.941 0.491 1
1 591 . 13 1 1 A 60 60 ALA CB C 58 18.743 18.607 0.136 1
1 592 . 13 1 1 A 60 60 ALA N N 58 125.120 122.192 2.928 1
1 593 . 13 1 1 A 61 61 ALA H H 59 8.041 8.319 -0.278 1
1 594 . 13 1 1 A 61 61 ALA HA H 59 4.131 4.021 0.110 1
1 598 . 13 1 1 A 61 61 ALA C C 59 178.147 179.222 -1.075 1
1 599 . 13 1 1 A 61 61 ALA CA C 59 52.586 54.418 -1.832 1
1 600 . 13 1 1 A 61 61 ALA CB C 59 18.692 18.299 0.393 1
1 601 . 13 1 1 A 61 61 ALA N N 59 123.857 127.141 -3.284 1
1 602 . 13 1 1 A 62 62 GLY H H 60 8.069 8.362 -0.293 1
1 603 . 13 1 1 A 62 62 GLY HA2 H 60 3.810 3.917 -0.107 1
1 604 . 13 1 1 A 62 62 GLY HA3 H 60 3.888 3.950 -0.062 1
1 605 . 13 1 1 A 62 62 GLY C C 60 174.914 175.439 -0.525 1
1 606 . 13 1 1 A 62 62 GLY CA C 60 45.320 47.344 -2.024 1
1 607 . 13 1 1 A 62 62 GLY N N 60 107.924 107.272 0.652 1
1 608 . 13 1 1 A 63 63 GLY H H 61 8.118 7.154 0.964 1
1 609 . 13 1 1 A 63 63 GLY HA2 H 61 4.008 4.157 -0.149 1
1 610 . 13 1 1 A 63 63 GLY HA3 H 61 3.893 4.225 -0.332 1
1 611 . 13 1 1 A 63 63 GLY C C 61 174.743 174.554 0.189 1
1 612 . 13 1 1 A 63 63 GLY CA C 61 45.202 45.582 -0.380 1
1 613 . 13 1 1 A 63 63 GLY N N 61 109.441 105.863 3.578 1
1 614 . 13 1 1 A 64 64 ASP H H 62 8.305 8.888 -0.583 1
1 615 . 13 1 1 A 64 64 ASP HA H 62 4.240 4.196 0.044 1
1 618 . 13 1 1 A 64 64 ASP C C 62 177.571 178.005 -0.434 1
1 619 . 13 1 1 A 64 64 ASP CA C 62 57.210 57.276 -0.066 1
1 620 . 13 1 1 A 64 64 ASP CB C 62 40.142 40.133 0.009 1
1 621 . 13 1 1 A 64 64 ASP N N 62 121.568 122.118 -0.550 1
1 622 . 13 1 1 A 65 65 GLN H H 63 8.337 7.913 0.424 1
1 623 . 13 1 1 A 65 65 GLN HA H 63 4.138 4.007 0.131 1
1 628 . 13 1 1 A 65 65 GLN C C 63 177.490 178.249 -0.759 1
1 629 . 13 1 1 A 65 65 GLN CA C 63 58.643 58.699 -0.056 1
1 630 . 13 1 1 A 65 65 GLN CB C 63 27.803 28.413 -0.610 1
1 632 . 13 1 1 A 65 65 GLN N N 63 119.700 119.724 -0.024 1
1 633 . 13 1 1 A 66 66 PHE H H 64 7.658 7.900 -0.242 1
1 634 . 13 1 1 A 66 66 PHE HA H 64 4.170 4.227 -0.057 1
1 638 . 13 1 1 A 66 66 PHE C C 64 176.872 177.594 -0.722 1
1 639 . 13 1 1 A 66 66 PHE CA C 64 60.158 61.206 -1.048 1
1 640 . 13 1 1 A 66 66 PHE CB C 64 38.490 39.154 -0.664 1
1 643 . 13 1 1 A 66 66 PHE N N 64 121.036 120.574 0.462 1
1 644 . 13 1 1 A 67 67 ILE H H 65 7.646 9.180 -1.534 1
1 645 . 13 1 1 A 67 67 ILE HA H 65 3.426 3.494 -0.068 1
1 655 . 13 1 1 A 67 67 ILE CA C 65 63.377 65.176 -1.799 1
1 656 . 13 1 1 A 67 67 ILE CB C 65 37.057 37.501 -0.444 1
1 660 . 13 1 1 A 67 67 ILE N N 65 121.372 119.541 1.831 1
1 661 . 13 1 1 A 68 68 HIS H H 66 7.945 8.142 -0.197 1
1 662 . 13 1 1 A 68 68 HIS HA H 66 4.005 4.235 -0.230 1
1 665 . 13 1 1 A 68 68 HIS CA C 66 59.915 59.608 0.307 1
1 668 . 13 1 1 A 68 68 HIS N N 66 120.036 120.655 -0.619 1
1 669 . 13 1 1 A 69 69 GLU HA H 67 3.677 3.947 -0.270 1
1 673 . 13 1 1 A 69 69 GLU CA C 67 58.490 59.855 -1.365 1
1 674 . 13 1 1 A 69 69 GLU CB C 67 29.290 29.185 0.105 1
1 676 . 13 1 1 A 70 70 GLN H H 68 8.017 7.880 0.137 1
1 677 . 13 1 1 A 70 70 GLN HA H 68 3.426 3.896 -0.470 1
1 678 . 13 1 1 A 70 70 GLN C C 68 179.280 178.901 0.379 1
1 679 . 13 1 1 A 70 70 GLN CA C 68 57.561 58.792 -1.231 1
1 680 . 13 1 1 A 70 70 GLN CB C 68 28.530 27.848 0.682 1
1 682 . 13 1 1 A 70 70 GLN N N 68 120.410 119.058 1.352 1
1 683 . 13 1 1 A 71 71 ASP HA H 69 4.440 4.985 -0.545 1
1 684 . 13 1 1 A 71 71 ASP C C 69 177.402 179.006 -1.604 1
1 685 . 13 1 1 A 71 71 ASP CA C 69 56.290 57.387 -1.097 1
1 686 . 13 1 1 A 72 72 LEU H H 70 7.952 8.474 -0.522 1
1 687 . 13 1 1 A 72 72 LEU HA H 70 3.775 4.052 -0.277 1
1 697 . 13 1 1 A 72 72 LEU C C 70 178.316 178.782 -0.466 1
1 698 . 13 1 1 A 72 72 LEU CA C 70 56.101 57.578 -1.477 1
1 699 . 13 1 1 A 72 72 LEU CB C 70 39.872 41.099 -1.227 1
1 703 . 13 1 1 A 72 72 LEU N N 70 120.832 120.867 -0.035 1
1 704 . 13 1 1 A 73 73 ASN H H 71 7.723 8.510 -0.787 1
1 705 . 13 1 1 A 73 73 ASN HA H 71 4.270 4.305 -0.035 1
1 708 . 13 1 1 A 73 73 ASN C C 71 178.193 178.411 -0.218 1
1 709 . 13 1 1 A 73 73 ASN CA C 71 55.970 56.583 -0.613 1
1 710 . 13 1 1 A 73 73 ASN CB C 71 37.640 37.933 -0.293 1
1 711 . 13 1 1 A 73 73 ASN N N 71 119.295 117.347 1.948 1
1 712 . 13 1 1 A 74 74 TRP H H 72 7.811 7.955 -0.144 1
1 713 . 13 1 1 A 74 74 TRP HA H 72 4.500 4.500 0.000 1
1 720 . 13 1 1 A 74 74 TRP CA C 72 58.480 60.323 -1.843 1
1 721 . 13 1 1 A 74 74 TRP CB C 72 28.920 29.887 -0.967 1
1 727 . 13 1 1 A 74 74 TRP N N 72 121.490 121.036 0.454 1
1 729 . 13 1 1 A 75 75 LEU H H 73 8.412 8.484 -0.072 1
1 730 . 13 1 1 A 75 75 LEU HA H 73 3.290 3.409 -0.119 1
1 739 . 13 1 1 A 75 75 LEU C C 73 178.562 178.625 -0.063 1
1 740 . 13 1 1 A 75 75 LEU CA C 73 58.226 57.533 0.693 1
1 741 . 13 1 1 A 75 75 LEU CB C 73 41.200 40.970 0.230 1
1 745 . 13 1 1 A 75 75 LEU N N 73 121.065 121.165 -0.100 1
1 746 . 13 1 1 A 76 76 GLN H H 74 7.648 8.358 -0.710 1
1 747 . 13 1 1 A 76 76 GLN HA H 74 3.657 4.096 -0.439 1
1 752 . 13 1 1 A 76 76 GLN C C 74 178.616 177.489 1.127 1
1 753 . 13 1 1 A 76 76 GLN CA C 74 58.777 58.597 0.180 1
1 754 . 13 1 1 A 76 76 GLN CB C 74 28.163 28.456 -0.293 1
1 756 . 13 1 1 A 76 76 GLN N N 74 113.985 118.614 -4.629 1
1 757 . 13 1 1 A 77 77 GLN H H 75 7.465 8.123 -0.658 1
1 758 . 13 1 1 A 77 77 GLN HA H 75 4.134 4.408 -0.274 1
1 761 . 13 1 1 A 77 77 GLN C C 75 176.223 176.000 0.223 1
1 762 . 13 1 1 A 77 77 GLN CA C 75 56.203 55.328 0.875 1
1 763 . 13 1 1 A 77 77 GLN CB C 75 29.524 28.142 1.382 1
1 765 . 13 1 1 A 77 77 GLN N N 75 117.481 114.800 2.681 1
1 766 . 13 1 1 A 78 78 ALA H H 76 7.420 7.255 0.165 1
1 767 . 13 1 1 A 78 78 ALA HA H 76 3.864 4.303 -0.439 1
1 771 . 13 1 1 A 78 78 ALA C C 76 176.733 176.756 -0.023 1
1 772 . 13 1 1 A 78 78 ALA CA C 76 52.529 52.932 -0.403 1
1 773 . 13 1 1 A 78 78 ALA CB C 76 20.124 19.276 0.848 1
1 774 . 13 1 1 A 78 78 ALA N N 76 122.682 124.832 -2.150 1
1 775 . 13 1 1 A 79 79 ASP H H 77 9.028 8.849 0.179 1
1 776 . 13 1 1 A 79 79 ASP HA H 77 4.673 4.722 -0.049 1
1 779 . 13 1 1 A 79 79 ASP C C 77 175.740 176.292 -0.552 1
1 780 . 13 1 1 A 79 79 ASP CA C 77 56.383 56.777 -0.394 1
1 781 . 13 1 1 A 79 79 ASP CB C 77 42.826 42.629 0.197 1
1 782 . 13 1 1 A 79 79 ASP N N 77 119.887 122.381 -2.494 1
1 783 . 13 1 1 A 80 80 VAL H H 78 7.379 7.785 -0.406 1
1 784 . 13 1 1 A 80 80 VAL HA H 78 4.340 4.742 -0.402 1
1 792 . 13 1 1 A 80 80 VAL C C 78 175.321 174.425 0.896 1
1 793 . 13 1 1 A 80 80 VAL CA C 78 60.011 60.149 -0.138 1
1 794 . 13 1 1 A 80 80 VAL CB C 78 35.362 35.977 -0.615 1
1 797 . 13 1 1 A 80 80 VAL N N 78 114.152 118.075 -3.923 1
1 798 . 13 1 1 A 81 81 VAL H H 79 8.350 8.172 0.178 1
1 799 . 13 1 1 A 81 81 VAL HA H 79 4.799 5.001 -0.202 1
1 807 . 13 1 1 A 81 81 VAL C C 79 173.095 175.021 -1.926 1
1 808 . 13 1 1 A 81 81 VAL CA C 79 60.775 60.824 -0.049 1
1 809 . 13 1 1 A 81 81 VAL CB C 79 32.824 35.063 -2.239 1
1 812 . 13 1 1 A 81 81 VAL N N 79 128.429 125.940 2.489 1
1 813 . 13 1 1 A 82 82 VAL H H 80 8.947 9.028 -0.081 1
1 814 . 13 1 1 A 82 82 VAL HA H 80 4.947 4.746 0.201 1
1 822 . 13 1 1 A 82 82 VAL C C 80 173.522 174.164 -0.642 1
1 823 . 13 1 1 A 82 82 VAL CA C 80 59.684 60.770 -1.086 1
1 824 . 13 1 1 A 82 82 VAL CB C 80 33.702 34.513 -0.811 1
1 827 . 13 1 1 A 82 82 VAL N N 80 126.957 126.144 0.813 1
1 828 . 13 1 1 A 83 83 ALA H H 81 9.011 8.796 0.215 1
1 829 . 13 1 1 A 83 83 ALA HA H 81 4.938 5.276 -0.338 1
1 833 . 13 1 1 A 83 83 ALA C C 81 130.330 175.080 -44.750 1
1 834 . 13 1 1 A 83 83 ALA CA C 81 49.490 49.581 -0.091 1
1 835 . 13 1 1 A 83 83 ALA CB C 81 23.628 21.443 2.185 1
1 836 . 13 1 1 A 83 83 ALA N N 81 128.705 129.815 -1.110 1
1 837 . 13 1 1 A 84 84 GLU H H 82 8.922 8.294 0.628 1
1 838 . 13 1 1 A 84 84 GLU HA H 82 4.937 4.325 0.612 1
1 839 . 13 1 1 A 84 84 GLU C C 82 177.673 175.762 1.911 1
1 840 . 13 1 1 A 84 84 GLU CA C 82 56.714 55.442 1.272 1
1 841 . 13 1 1 A 84 84 GLU CB C 82 29.882 29.913 -0.031 1
1 842 . 13 1 1 A 84 84 GLU N N 82 130.330 122.750 7.580 1
1 843 . 13 1 1 A 85 85 VAL H H 83 8.427 9.135 -0.708 1
1 844 . 13 1 1 A 85 85 VAL HA H 83 4.435 3.990 0.445 1
1 852 . 13 1 1 A 85 85 VAL C C 83 174.252 176.092 -1.840 1
1 853 . 13 1 1 A 85 85 VAL CA C 83 59.896 64.789 -4.893 1
1 854 . 13 1 1 A 85 85 VAL CB C 83 29.968 31.840 -1.872 1
1 857 . 13 1 1 A 85 85 VAL N N 83 114.212 127.255 -13.043 1
1 858 . 13 1 1 A 86 86 THR H H 84 9.347 8.285 1.062 1
1 859 . 13 1 1 A 86 86 THR HA H 84 4.146 4.190 -0.044 1
1 864 . 13 1 1 A 86 86 THR C C 84 175.751 173.885 1.866 1
1 865 . 13 1 1 A 86 86 THR CA C 84 67.629 64.513 3.116 1
1 866 . 13 1 1 A 86 86 THR CB C 84 66.819 67.593 -0.774 1
1 868 . 13 1 1 A 86 86 THR N N 84 121.640 115.632 6.008 1
1 869 . 13 1 1 A 87 87 GLN H H 85 8.114 8.456 -0.342 1
1 870 . 13 1 1 A 87 87 GLN HA H 85 4.736 4.441 0.295 1
1 874 . 13 1 1 A 87 87 GLN CA C 85 51.898 55.136 -3.238 1
1 875 . 13 1 1 A 87 87 GLN CB C 85 27.942 28.774 -0.832 1
1 877 . 13 1 1 A 87 87 GLN N N 85 120.367 124.371 -4.004 1
1 878 . 13 1 1 A 88 88 PRO HA H 86 4.061 4.729 -0.668 1
1 885 . 13 1 1 A 88 88 PRO C C 86 176.436 175.491 0.945 1
1 886 . 13 1 1 A 88 88 PRO CA C 86 63.422 63.027 0.395 1
1 887 . 13 1 1 A 88 88 PRO CB C 86 31.925 31.704 0.221 1
1 889 . 13 1 1 A 89 89 SER H H 87 6.044 8.861 -2.817 1
1 890 . 13 1 1 A 89 89 SER HA H 87 4.630 5.031 -0.401 1
1 893 . 13 1 1 A 89 89 SER C C 87 175.612 174.568 1.044 1
1 894 . 13 1 1 A 89 89 SER CA C 87 56.800 57.074 -0.274 1
1 895 . 13 1 1 A 89 89 SER CB C 87 64.196 65.478 -1.282 1
1 896 . 13 1 1 A 89 89 SER N N 87 115.721 118.372 -2.651 1
1 897 . 13 1 1 A 90 90 LEU H H 88 9.702 8.955 0.747 1
1 898 . 13 1 1 A 90 90 LEU HA H 88 4.270 4.020 0.250 1
1 906 . 13 1 1 A 90 90 LEU C C 88 179.173 179.262 -0.089 1
1 907 . 13 1 1 A 90 90 LEU CA C 88 57.402 58.304 -0.902 1
1 908 . 13 1 1 A 90 90 LEU CB C 88 43.642 41.772 1.870 1
1 911 . 13 1 1 A 90 90 LEU N N 88 130.488 130.224 0.264 1
1 912 . 13 1 1 A 91 91 GLY H H 89 8.354 8.418 -0.064 1
1 913 . 13 1 1 A 91 91 GLY HA2 H 89 3.680 3.818 -0.138 1
1 914 . 13 1 1 A 91 91 GLY HA3 H 89 3.584 3.822 -0.238 1
1 915 . 13 1 1 A 91 91 GLY C C 89 175.106 176.522 -1.416 1
1 916 . 13 1 1 A 91 91 GLY CA C 89 47.770 47.629 0.141 1
1 917 . 13 1 1 A 91 91 GLY N N 89 107.522 106.391 1.131 1
1 918 . 13 1 1 A 92 92 VAL H H 90 7.906 7.746 0.160 1
1 919 . 13 1 1 A 92 92 VAL HA H 90 3.940 3.932 0.008 1
1 927 . 13 1 1 A 92 92 VAL C C 90 178.467 177.765 0.702 1
1 928 . 13 1 1 A 92 92 VAL CA C 90 65.379 66.692 -1.313 1
1 929 . 13 1 1 A 92 92 VAL CB C 90 31.785 31.806 -0.021 1
1 932 . 13 1 1 A 92 92 VAL N N 90 121.741 122.010 -0.269 1
1 933 . 13 1 1 A 93 93 GLY H H 91 7.595 8.192 -0.597 1
1 934 . 13 1 1 A 93 93 GLY HA2 H 91 3.628 3.779 -0.151 1
1 935 . 13 1 1 A 93 93 GLY HA3 H 91 3.415 3.788 -0.373 1
1 936 . 13 1 1 A 93 93 GLY C C 91 174.022 175.619 -1.597 1
1 937 . 13 1 1 A 93 93 GLY CA C 91 48.319 47.397 0.922 1
1 938 . 13 1 1 A 93 93 GLY N N 91 104.629 107.468 -2.839 1
1 939 . 13 1 1 A 94 94 TYR H H 92 8.372 8.782 -0.410 1
1 940 . 13 1 1 A 94 94 TYR HA H 92 4.046 4.075 -0.029 1
1 943 . 13 1 1 A 94 94 TYR C C 92 177.458 177.827 -0.369 1
1 944 . 13 1 1 A 94 94 TYR CA C 92 61.760 60.827 0.933 1
1 945 . 13 1 1 A 94 94 TYR CB C 92 38.431 38.809 -0.378 1
1 948 . 13 1 1 A 94 94 TYR N N 92 123.383 123.588 -0.205 1
1 949 . 13 1 1 A 95 95 GLU H H 93 8.424 8.943 -0.519 1
1 950 . 13 1 1 A 95 95 GLU HA H 93 3.421 3.949 -0.528 1
1 951 . 13 1 1 A 95 95 GLU C C 93 178.590 179.545 -0.955 1
1 952 . 13 1 1 A 95 95 GLU CA C 93 60.211 59.317 0.894 1
1 953 . 13 1 1 A 95 95 GLU CB C 93 29.025 29.098 -0.073 1
1 954 . 13 1 1 A 95 95 GLU N N 93 120.181 117.854 2.327 1
1 955 . 13 1 1 A 96 96 LEU H H 94 8.210 8.372 -0.162 1
1 956 . 13 1 1 A 96 96 LEU HA H 94 3.830 4.010 -0.180 1
1 964 . 13 1 1 A 96 96 LEU C C 94 179.032 179.078 -0.046 1
1 965 . 13 1 1 A 96 96 LEU CA C 94 57.683 58.144 -0.461 1
1 966 . 13 1 1 A 96 96 LEU CB C 94 41.883 41.907 -0.024 1
1 970 . 13 1 1 A 96 96 LEU N N 94 118.091 120.721 -2.630 1
1 971 . 13 1 1 A 97 97 GLY H H 95 8.773 8.471 0.302 1
1 972 . 13 1 1 A 97 97 GLY C C 95 175.344 175.270 0.074 1
1 973 . 13 1 1 A 97 97 GLY CA C 95 47.308 46.668 0.640 1
1 974 . 13 1 1 A 97 97 GLY N N 95 108.085 105.859 2.226 1
1 975 . 13 1 1 A 98 98 ARG H H 96 8.100 8.374 -0.274 1
1 976 . 13 1 1 A 98 98 ARG C C 96 179.692 177.910 1.782 1
1 977 . 13 1 1 A 98 98 ARG CA C 96 56.308 58.844 -2.536 1
1 978 . 13 1 1 A 98 98 ARG CB C 96 26.854 29.602 -2.748 1
1 979 . 13 1 1 A 98 98 ARG N N 96 118.156 121.752 -3.596 1
1 980 . 13 1 1 A 99 99 ALA H H 97 8.498 7.553 0.945 1
1 981 . 13 1 1 A 99 99 ALA HA H 97 3.640 3.981 -0.341 1
1 985 . 13 1 1 A 99 99 ALA C C 97 179.650 180.043 -0.393 1
1 986 . 13 1 1 A 99 99 ALA CA C 97 55.166 55.067 0.099 1
1 987 . 13 1 1 A 99 99 ALA CB C 97 18.604 18.445 0.159 1
1 988 . 13 1 1 A 99 99 ALA N N 97 122.310 121.594 0.716 1
1 989 . 13 1 1 A 100 100 VAL H H 98 8.597 8.350 0.247 1
1 990 . 13 1 1 A 100 100 VAL HA H 98 3.798 3.595 0.203 1
1 998 . 13 1 1 A 100 100 VAL C C 98 180.464 178.098 2.366 1
1 999 . 13 1 1 A 100 100 VAL CA C 98 65.664 66.596 -0.932 1
1 1000 . 13 1 1 A 100 100 VAL CB C 98 31.065 31.349 -0.284 1
1 1003 . 13 1 1 A 100 100 VAL N N 98 120.603 119.179 1.424 1
1 1004 . 13 1 1 A 101 101 ALA H H 99 7.280 7.871 -0.591 1
1 1005 . 13 1 1 A 101 101 ALA HA H 99 3.963 4.071 -0.108 1
1 1009 . 13 1 1 A 101 101 ALA C C 99 179.314 178.773 0.541 1
1 1010 . 13 1 1 A 101 101 ALA CA C 99 54.367 54.862 -0.495 1
1 1011 . 13 1 1 A 101 101 ALA CB C 99 18.139 19.024 -0.885 1
1 1012 . 13 1 1 A 101 101 ALA N N 99 124.450 121.617 2.833 1
1 1013 . 13 1 1 A 102 102 LEU H H 100 7.200 7.522 -0.322 1
1 1014 . 13 1 1 A 102 102 LEU HA H 100 4.192 4.544 -0.352 1
1 1024 . 13 1 1 A 102 102 LEU C C 100 177.306 178.907 -1.601 1
1 1025 . 13 1 1 A 102 102 LEU CA C 100 54.808 55.244 -0.436 1
1 1026 . 13 1 1 A 102 102 LEU CB C 100 42.880 43.517 -0.637 1
1 1030 . 13 1 1 A 102 102 LEU N N 100 116.834 113.278 3.556 1
1 1031 . 13 1 1 A 103 103 GLY H H 101 7.891 8.444 -0.553 1
1 1032 . 13 1 1 A 103 103 GLY HA2 H 101 3.941 3.868 0.073 1
1 1033 . 13 1 1 A 103 103 GLY HA3 H 101 3.831 3.901 -0.070 1
1 1034 . 13 1 1 A 103 103 GLY C C 101 175.137 175.559 -0.422 1
1 1035 . 13 1 1 A 103 103 GLY CA C 101 45.673 45.539 0.134 1
1 1036 . 13 1 1 A 103 103 GLY N N 101 109.395 108.281 1.114 1
1 1037 . 13 1 1 A 104 104 LYS H H 102 7.337 7.670 -0.333 1
1 1038 . 13 1 1 A 104 104 LYS HA H 102 4.402 4.104 0.298 1
1 1043 . 13 1 1 A 104 104 LYS CA C 102 52.136 59.345 -7.209 1
1 1044 . 13 1 1 A 104 104 LYS CB C 102 31.045 32.172 -1.127 1
1 1047 . 13 1 1 A 104 104 LYS N N 102 118.954 118.420 0.534 1
1 1048 . 13 1 1 A 105 105 PRO HA H 103 4.781 4.665 0.116 1
1 1054 . 13 1 1 A 105 105 PRO CA C 103 62.791 62.959 -0.168 1
1 1055 . 13 1 1 A 105 105 PRO CB C 103 30.405 31.766 -1.361 1
1 1058 . 13 1 1 A 106 106 ILE H H 104 8.261 8.997 -0.736 1
1 1059 . 13 1 1 A 106 106 ILE HA H 104 4.680 4.545 0.135 1
1 1069 . 13 1 1 A 106 106 ILE C C 104 175.543 174.080 1.463 1
1 1070 . 13 1 1 A 106 106 ILE CA C 104 59.362 59.098 0.264 1
1 1071 . 13 1 1 A 106 106 ILE CB C 104 43.738 41.904 1.834 1
1 1075 . 13 1 1 A 106 106 ILE N N 104 123.509 124.877 -1.368 1
1 1076 . 13 1 1 A 107 107 LEU H H 105 8.584 8.410 0.174 1
1 1077 . 13 1 1 A 107 107 LEU HA H 105 4.243 4.528 -0.285 1
1 1087 . 13 1 1 A 107 107 LEU C C 105 174.204 174.355 -0.151 1
1 1088 . 13 1 1 A 107 107 LEU CA C 105 52.863 53.143 -0.280 1
1 1089 . 13 1 1 A 107 107 LEU CB C 105 42.408 44.349 -1.941 1
1 1093 . 13 1 1 A 107 107 LEU N N 105 131.882 126.225 5.657 1
1 1094 . 13 1 1 A 108 108 CYS H H 106 8.679 8.772 -0.093 1
1 1095 . 13 1 1 A 108 108 CYS HA H 106 5.280 5.483 -0.203 1
1 1099 . 13 1 1 A 108 108 CYS C C 106 173.134 173.233 -0.099 1
1 1100 . 13 1 1 A 108 108 CYS CA C 106 57.290 57.012 0.278 1
1 1101 . 13 1 1 A 108 108 CYS CB C 106 29.559 31.098 -1.539 1
1 1102 . 13 1 1 A 108 108 CYS N N 106 122.904 125.102 -2.198 1
1 1103 . 13 1 1 A 109 109 LEU H H 107 8.987 8.749 0.238 1
1 1104 . 13 1 1 A 109 109 LEU HA H 107 5.120 5.867 -0.747 1
1 1112 . 13 1 1 A 109 109 LEU C C 107 174.500 175.583 -1.083 1
1 1113 . 13 1 1 A 109 109 LEU CA C 107 53.274 53.867 -0.593 1
1 1114 . 13 1 1 A 109 109 LEU CB C 107 43.450 45.243 -1.793 1
1 1118 . 13 1 1 A 109 109 LEU N N 107 124.653 123.594 1.059 1
1 1119 . 13 1 1 A 110 110 PHE H H 108 8.981 9.219 -0.238 1
1 1120 . 13 1 1 A 110 110 PHE HA H 108 4.846 5.615 -0.769 1
1 1125 . 13 1 1 A 110 110 PHE C C 108 172.231 173.156 -0.925 1
1 1126 . 13 1 1 A 110 110 PHE CA C 108 55.963 55.784 0.179 1
1 1127 . 13 1 1 A 110 110 PHE CB C 108 43.270 42.785 0.485 1
1 1130 . 13 1 1 A 110 110 PHE N N 108 125.052 123.056 1.996 1
1 1131 . 13 1 1 A 111 111 ARG H H 109 7.461 8.562 -1.101 1
1 1132 . 13 1 1 A 111 111 ARG HA H 109 4.804 4.508 0.296 1
1 1136 . 13 1 1 A 111 111 ARG CA C 109 51.953 52.724 -0.771 1
1 1137 . 13 1 1 A 111 111 ARG CB C 109 30.008 29.743 0.265 1
1 1140 . 13 1 1 A 111 111 ARG N N 109 128.034 126.000 2.034 1
1 1141 . 13 1 1 A 112 112 PRO C C 110 178.675 177.790 0.885 1
1 1142 . 13 1 1 A 112 112 PRO CA C 110 64.024 64.439 -0.415 1
1 1143 . 13 1 1 A 112 112 PRO CB C 110 31.416 31.994 -0.578 1
1 1144 . 13 1 1 A 113 113 GLN H H 111 8.188 8.739 -0.551 1
1 1145 . 13 1 1 A 113 113 GLN HA H 111 4.056 4.042 0.014 1
1 1149 . 13 1 1 A 113 113 GLN C C 111 175.936 176.900 -0.964 1
1 1150 . 13 1 1 A 113 113 GLN CA C 111 57.144 58.208 -1.064 1
1 1151 . 13 1 1 A 113 113 GLN CB C 111 28.033 28.065 -0.032 1
1 1153 . 13 1 1 A 113 113 GLN N N 111 118.835 116.988 1.847 1
1 1154 . 13 1 1 A 114 114 SER H H 112 7.730 7.701 0.029 1
1 1155 . 13 1 1 A 114 114 SER HA H 112 4.037 4.520 -0.483 1
1 1158 . 13 1 1 A 114 114 SER C C 112 175.750 175.754 -0.004 1
1 1159 . 13 1 1 A 114 114 SER CA C 112 60.154 58.729 1.425 1
1 1160 . 13 1 1 A 114 114 SER CB C 112 64.282 64.930 -0.648 1
1 1161 . 13 1 1 A 114 114 SER N N 112 114.887 110.773 4.114 1
1 1162 . 13 1 1 A 115 115 GLY H H 113 8.005 8.141 -0.136 1
1 1163 . 13 1 1 A 115 115 GLY HA2 H 113 3.712 3.999 -0.287 1
1 1164 . 13 1 1 A 115 115 GLY HA3 H 113 4.130 4.209 -0.079 1
1 1165 . 13 1 1 A 115 115 GLY C C 113 173.945 175.570 -1.625 1
1 1166 . 13 1 1 A 115 115 GLY CA C 113 45.233 47.182 -1.949 1
1 1167 . 13 1 1 A 115 115 GLY N N 113 110.740 110.980 -0.240 1
1 1168 . 13 1 1 A 116 116 ARG H H 114 7.665 8.045 -0.380 1
1 1169 . 13 1 1 A 116 116 ARG HA H 114 4.449 4.453 -0.004 1
1 1173 . 13 1 1 A 116 116 ARG C C 114 175.370 175.537 -0.167 1
1 1174 . 13 1 1 A 116 116 ARG CA C 114 55.080 55.925 -0.845 1
1 1175 . 13 1 1 A 116 116 ARG CB C 114 31.215 30.310 0.905 1
1 1178 . 13 1 1 A 116 116 ARG N N 114 119.983 118.748 1.235 1
1 1179 . 13 1 1 A 117 117 VAL H H 115 8.409 8.230 0.179 1
1 1180 . 13 1 1 A 117 117 VAL HA H 115 4.184 3.793 0.391 1
1 1188 . 13 1 1 A 117 117 VAL C C 115 175.980 174.812 1.168 1
1 1189 . 13 1 1 A 117 117 VAL CA C 115 61.167 62.290 -1.123 1
1 1190 . 13 1 1 A 117 117 VAL CB C 115 32.931 31.146 1.785 1
1 1193 . 13 1 1 A 117 117 VAL N N 115 122.240 116.667 5.573 1
1 1194 . 13 1 1 A 118 118 LEU H H 116 8.227 7.737 0.490 1
1 1195 . 13 1 1 A 118 118 LEU HA H 116 3.720 4.278 -0.558 1
1 1204 . 13 1 1 A 118 118 LEU C C 116 175.623 175.943 -0.320 1
1 1205 . 13 1 1 A 118 118 LEU CA C 116 54.555 55.346 -0.791 1
1 1206 . 13 1 1 A 118 118 LEU CB C 116 39.292 43.280 -3.988 1
1 1210 . 13 1 1 A 118 118 LEU N N 116 131.481 129.121 2.360 1
1 1211 . 13 1 1 A 119 119 SER H H 117 7.780 8.533 -0.753 1
1 1212 . 13 1 1 A 119 119 SER HA H 117 4.060 4.480 -0.420 1
1 1214 . 13 1 1 A 119 119 SER C C 117 175.782 175.660 0.122 1
1 1215 . 13 1 1 A 119 119 SER CA C 117 58.530 58.338 0.192 1
1 1216 . 13 1 1 A 119 119 SER CB C 117 64.785 64.278 0.507 1
1 1217 . 13 1 1 A 119 119 SER N N 117 118.658 118.423 0.235 1
1 1218 . 13 1 1 A 120 120 ALA H H 118 8.955 8.954 0.001 1
1 1219 . 13 1 1 A 120 120 ALA HA H 118 3.846 3.968 -0.122 1
1 1223 . 13 1 1 A 120 120 ALA C C 118 179.731 179.881 -0.150 1
1 1224 . 13 1 1 A 120 120 ALA CA C 118 54.927 55.534 -0.607 1
1 1225 . 13 1 1 A 120 120 ALA CB C 118 18.627 18.184 0.443 1
1 1226 . 13 1 1 A 120 120 ALA N N 118 134.119 125.883 8.236 1
1 1227 . 13 1 1 A 121 121 MET H H 119 7.718 8.159 -0.441 1
1 1228 . 13 1 1 A 121 121 MET HA H 119 4.130 4.098 0.032 1
1 1235 . 13 1 1 A 121 121 MET C C 119 175.610 178.694 -3.084 1
1 1236 . 13 1 1 A 121 121 MET CA C 119 55.968 58.543 -2.575 1
1 1237 . 13 1 1 A 121 121 MET CB C 119 30.814 32.771 -1.957 1
1 1240 . 13 1 1 A 121 121 MET N N 119 115.424 116.452 -1.028 1
1 1241 . 13 1 1 A 122 122 ILE H H 120 6.451 8.048 -1.597 1
1 1242 . 13 1 1 A 122 122 ILE HA H 120 3.392 3.505 -0.113 1
1 1252 . 13 1 1 A 122 122 ILE C C 120 177.108 177.870 -0.762 1
1 1253 . 13 1 1 A 122 122 ILE CA C 120 59.650 64.874 -5.224 1
1 1254 . 13 1 1 A 122 122 ILE CB C 120 34.640 37.669 -3.029 1
1 1258 . 13 1 1 A 122 122 ILE N N 120 113.418 119.318 -5.900 1
1 1259 . 13 1 1 A 123 123 ARG H H 121 7.540 8.474 -0.934 1
1 1260 . 13 1 1 A 123 123 ARG HA H 121 3.551 3.889 -0.338 1
1 1264 . 13 1 1 A 123 123 ARG C C 121 179.642 179.129 0.513 1
1 1265 . 13 1 1 A 123 123 ARG CA C 121 59.242 59.784 -0.542 1
1 1266 . 13 1 1 A 123 123 ARG CB C 121 29.087 29.813 -0.726 1
1 1269 . 13 1 1 A 123 123 ARG N N 121 116.248 120.708 -4.460 1
1 1270 . 13 1 1 A 124 124 GLY H H 122 8.086 8.176 -0.090 1
1 1271 . 13 1 1 A 124 124 GLY C C 122 172.357 174.749 -2.392 1
1 1272 . 13 1 1 A 124 124 GLY CA C 122 44.836 47.117 -2.281 1
1 1273 . 13 1 1 A 124 124 GLY N N 122 104.381 107.458 -3.077 1
1 1274 . 13 1 1 A 125 125 ALA H H 123 6.411 7.458 -1.047 1
1 1275 . 13 1 1 A 125 125 ALA HA H 123 2.441 3.803 -1.362 1
1 1279 . 13 1 1 A 125 125 ALA C C 123 176.908 177.048 -0.140 1
1 1280 . 13 1 1 A 125 125 ALA CA C 123 51.593 51.114 0.479 1
1 1281 . 13 1 1 A 125 125 ALA CB C 123 16.997 17.322 -0.325 1
1 1282 . 13 1 1 A 125 125 ALA N N 123 123.136 120.583 2.553 1
1 1283 . 13 1 1 A 126 126 ALA H H 124 6.190 7.862 -1.672 1
1 1284 . 13 1 1 A 126 126 ALA HA H 124 3.829 4.905 -1.076 1
1 1288 . 13 1 1 A 126 126 ALA C C 124 177.535 177.589 -0.054 1
1 1289 . 13 1 1 A 126 126 ALA CA C 124 52.403 51.299 1.104 1
1 1290 . 13 1 1 A 126 126 ALA CB C 124 18.375 19.426 -1.051 1
1 1291 . 13 1 1 A 126 126 ALA N N 124 117.999 125.766 -7.767 1
1 1292 . 13 1 1 A 127 127 ASP H H 125 8.877 8.130 0.747 1
1 1293 . 13 1 1 A 127 127 ASP HA H 125 4.665 4.468 0.197 1
1 1296 . 13 1 1 A 127 127 ASP C C 125 177.795 176.821 0.974 1
1 1297 . 13 1 1 A 127 127 ASP CA C 125 52.855 54.545 -1.690 1
1 1298 . 13 1 1 A 127 127 ASP CB C 125 41.814 40.966 0.848 1
1 1299 . 13 1 1 A 127 127 ASP N N 125 121.828 119.524 2.304 1
1 1300 . 13 1 1 A 128 128 GLY H H 126 7.954 8.602 -0.648 1
1 1301 . 13 1 1 A 128 128 GLY HA2 H 126 3.830 3.991 -0.161 1
1 1302 . 13 1 1 A 128 128 GLY HA3 H 126 4.249 4.059 0.190 1
1 1303 . 13 1 1 A 128 128 GLY C C 126 173.822 174.538 -0.716 1
1 1304 . 13 1 1 A 128 128 GLY CA C 126 45.549 45.742 -0.193 1
1 1305 . 13 1 1 A 128 128 GLY N N 126 108.814 108.775 0.039 1
1 1306 . 13 1 1 A 129 129 SER H H 127 8.547 8.101 0.446 1
1 1307 . 13 1 1 A 129 129 SER HA H 127 4.486 4.768 -0.282 1
1 1309 . 13 1 1 A 129 129 SER C C 127 174.178 176.583 -2.405 1
1 1310 . 13 1 1 A 129 129 SER CA C 127 58.653 59.700 -1.047 1
1 1311 . 13 1 1 A 129 129 SER CB C 127 63.316 64.358 -1.042 1
1 1312 . 13 1 1 A 129 129 SER N N 127 115.599 116.947 -1.348 1
1 1313 . 13 1 1 A 130 130 ARG H H 128 8.795 8.192 0.603 1
1 1314 . 13 1 1 A 130 130 ARG HA H 128 4.160 4.429 -0.269 1
1 1318 . 13 1 1 A 130 130 ARG C C 128 175.518 176.434 -0.916 1
1 1319 . 13 1 1 A 130 130 ARG CA C 128 58.479 57.986 0.493 1
1 1320 . 13 1 1 A 130 130 ARG CB C 128 29.952 31.357 -1.405 1
1 1323 . 13 1 1 A 130 130 ARG N N 128 127.611 121.006 6.605 1
1 1324 . 13 1 1 A 131 131 PHE H H 129 9.315 8.008 1.307 1
1 1325 . 13 1 1 A 131 131 PHE HA H 129 4.878 5.145 -0.267 1
1 1331 . 13 1 1 A 131 131 PHE C C 129 175.058 174.151 0.907 1
1 1332 . 13 1 1 A 131 131 PHE CA C 129 55.953 56.890 -0.937 1
1 1333 . 13 1 1 A 131 131 PHE CB C 129 40.189 41.578 -1.389 1
1 1337 . 13 1 1 A 131 131 PHE N N 129 126.219 119.391 6.828 1
1 1338 . 13 1 1 A 132 132 GLN H H 130 8.160 8.163 -0.003 1
1 1339 . 13 1 1 A 132 132 GLN HA H 130 5.013 5.215 -0.202 1
1 1343 . 13 1 1 A 132 132 GLN CA C 130 54.498 54.642 -0.144 1
1 1344 . 13 1 1 A 132 132 GLN CB C 130 32.106 32.904 -0.798 1
1 1346 . 13 1 1 A 132 132 GLN N N 130 125.589 125.817 -0.228 1
1 1347 . 13 1 1 A 133 133 VAL H H 131 8.689 9.082 -0.393 1
1 1348 . 13 1 1 A 133 133 VAL HA H 131 4.529 4.669 -0.140 1
1 1356 . 13 1 1 A 133 133 VAL C C 131 174.441 175.497 -1.056 1
1 1357 . 13 1 1 A 133 133 VAL CA C 131 60.758 62.057 -1.299 1
1 1358 . 13 1 1 A 133 133 VAL CB C 131 32.417 32.302 0.115 1
1 1361 . 13 1 1 A 133 133 VAL N N 131 122.441 123.450 -1.009 1
1 1362 . 13 1 1 A 134 134 TRP H H 132 9.256 9.501 -0.245 1
1 1363 . 13 1 1 A 134 134 TRP HA H 132 5.213 5.343 -0.130 1
1 1371 . 13 1 1 A 134 134 TRP C C 132 174.575 176.108 -1.533 1
1 1372 . 13 1 1 A 134 134 TRP CA C 132 53.859 55.505 -1.646 1
1 1373 . 13 1 1 A 134 134 TRP CB C 132 31.311 31.852 -0.541 1
1 1379 . 13 1 1 A 134 134 TRP N N 132 130.303 128.210 2.093 1
1 1381 . 13 1 1 A 135 135 ASP H H 133 8.237 8.671 -0.434 1
1 1382 . 13 1 1 A 135 135 ASP HA H 133 6.018 5.888 0.130 1
1 1385 . 13 1 1 A 135 135 ASP C C 133 177.020 175.238 1.782 1
1 1386 . 13 1 1 A 135 135 ASP CA C 133 53.321 53.713 -0.392 1
1 1387 . 13 1 1 A 135 135 ASP CB C 133 41.514 43.129 -1.615 1
1 1388 . 13 1 1 A 135 135 ASP N N 133 125.516 122.144 3.372 1
1 1389 . 13 1 1 A 136 136 TYR H H 134 9.058 8.375 0.683 1
1 1390 . 13 1 1 A 136 136 TYR HA H 134 4.970 5.237 -0.267 1
1 1394 . 13 1 1 A 136 136 TYR C C 134 172.324 172.994 -0.670 1
1 1395 . 13 1 1 A 136 136 TYR CA C 134 55.982 56.525 -0.543 1
1 1396 . 13 1 1 A 136 136 TYR CB C 134 42.265 40.372 1.893 1
1 1399 . 13 1 1 A 136 136 TYR N N 134 120.315 118.001 2.314 1
1 1400 . 13 1 1 A 137 137 ALA H H 135 8.521 8.505 0.016 1
1 1401 . 13 1 1 A 137 137 ALA HA H 135 4.280 4.228 0.052 1
1 1405 . 13 1 1 A 137 137 ALA C C 135 178.561 177.350 1.211 1
1 1406 . 13 1 1 A 137 137 ALA CA C 135 49.550 50.828 -1.278 1
1 1407 . 13 1 1 A 137 137 ALA CB C 135 19.998 22.255 -2.257 1
1 1408 . 13 1 1 A 137 137 ALA N N 135 123.386 121.654 1.732 1
1 1409 . 13 1 1 A 138 138 GLU H H 136 8.678 8.867 -0.189 1
1 1410 . 13 1 1 A 138 138 GLU HA H 136 3.777 4.136 -0.359 1
1 1414 . 13 1 1 A 138 138 GLU C C 136 177.624 177.882 -0.258 1
1 1415 . 13 1 1 A 138 138 GLU CA C 136 60.527 59.366 1.161 1
1 1416 . 13 1 1 A 138 138 GLU CB C 136 29.020 29.376 -0.356 1
1 1418 . 13 1 1 A 138 138 GLU N N 136 121.774 121.142 0.632 1
1 1419 . 13 1 1 A 139 139 GLY H H 137 8.666 8.347 0.319 1
1 1420 . 13 1 1 A 139 139 GLY HA2 H 137 3.872 3.965 -0.093 1
1 1421 . 13 1 1 A 139 139 GLY HA3 H 137 3.872 3.983 -0.111 1
1 1422 . 13 1 1 A 139 139 GLY C C 137 175.122 174.423 0.699 1
1 1423 . 13 1 1 A 139 139 GLY CA C 137 46.093 45.638 0.455 1
1 1424 . 13 1 1 A 139 139 GLY N N 137 106.053 108.276 -2.223 1
1 1425 . 13 1 1 A 140 140 GLU H H 138 8.305 9.473 -1.168 1
1 1426 . 13 1 1 A 140 140 GLU HA H 138 4.754 4.620 0.134 1
1 1430 . 13 1 1 A 140 140 GLU C C 138 177.819 176.994 0.825 1
1 1431 . 13 1 1 A 140 140 GLU CA C 138 55.049 56.496 -1.447 1
1 1432 . 13 1 1 A 140 140 GLU CB C 138 30.504 31.284 -0.780 1
1 1434 . 13 1 1 A 140 140 GLU N N 138 117.485 118.267 -0.782 1
1 1435 . 13 1 1 A 141 141 VAL H H 139 7.267 7.752 -0.485 1
1 1436 . 13 1 1 A 141 141 VAL HA H 139 3.422 3.959 -0.537 1
1 1444 . 13 1 1 A 141 141 VAL C C 139 175.454 177.514 -2.060 1
1 1445 . 13 1 1 A 141 141 VAL CA C 139 66.769 65.031 1.738 1
1 1446 . 13 1 1 A 141 141 VAL CB C 139 31.377 31.542 -0.165 1
1 1449 . 13 1 1 A 141 141 VAL N N 139 120.764 121.076 -0.312 1
1 1450 . 13 1 1 A 142 142 GLU H H 140 8.620 8.449 0.171 1
1 1451 . 13 1 1 A 142 142 GLU HA H 140 3.592 4.080 -0.488 1
1 1452 . 13 1 1 A 142 142 GLU C C 140 177.320 179.758 -2.438 1
1 1453 . 13 1 1 A 142 142 GLU CA C 140 62.607 59.496 3.111 1
1 1454 . 13 1 1 A 142 142 GLU CB C 140 26.759 29.110 -2.351 1
1 1455 . 13 1 1 A 142 142 GLU N N 140 120.048 121.734 -1.686 1
1 1456 . 13 1 1 A 143 143 THR H H 141 7.449 8.042 -0.593 1
1 1457 . 13 1 1 A 143 143 THR HA H 141 4.003 4.011 -0.008 1
1 1462 . 13 1 1 A 143 143 THR C C 141 177.258 176.741 0.517 1
1 1463 . 13 1 1 A 143 143 THR CA C 141 65.490 67.116 -1.626 1
1 1464 . 13 1 1 A 143 143 THR CB C 141 68.641 68.347 0.294 1
1 1466 . 13 1 1 A 143 143 THR N N 141 114.073 118.454 -4.381 1
1 1467 . 13 1 1 A 144 144 MET H H 142 7.992 8.155 -0.163 1
1 1468 . 13 1 1 A 144 144 MET HA H 142 4.316 4.355 -0.039 1
1 1476 . 13 1 1 A 144 144 MET C C 142 178.233 178.687 -0.454 1
1 1477 . 13 1 1 A 144 144 MET CA C 142 57.743 58.968 -1.225 1
1 1478 . 13 1 1 A 144 144 MET CB C 142 31.326 32.470 -1.144 1
1 1481 . 13 1 1 A 144 144 MET N N 142 120.595 118.438 2.157 1
1 1482 . 13 1 1 A 145 145 LEU H H 143 7.847 8.245 -0.398 1
1 1483 . 13 1 1 A 145 145 LEU HA H 143 3.919 3.823 0.096 1
1 1491 . 13 1 1 A 145 145 LEU C C 143 178.774 179.177 -0.403 1
1 1492 . 13 1 1 A 145 145 LEU CA C 143 57.877 58.129 -0.252 1
1 1493 . 13 1 1 A 145 145 LEU CB C 143 40.951 41.546 -0.595 1
1 1497 . 13 1 1 A 145 145 LEU N N 143 119.410 119.689 -0.279 1
1 1498 . 13 1 1 A 146 146 ASP H H 144 8.431 8.594 -0.163 1
1 1499 . 13 1 1 A 146 146 ASP HA H 144 4.312 4.457 -0.145 1
1 1502 . 13 1 1 A 146 146 ASP C C 144 178.129 178.939 -0.810 1
1 1503 . 13 1 1 A 146 146 ASP CA C 144 57.464 58.105 -0.641 1
1 1504 . 13 1 1 A 146 146 ASP CB C 144 39.548 41.499 -1.951 1
1 1505 . 13 1 1 A 146 146 ASP N N 144 119.837 119.959 -0.122 1
1 1506 . 13 1 1 A 147 147 ARG H H 145 7.949 8.834 -0.885 1
1 1507 . 13 1 1 A 147 147 ARG HA H 145 4.050 4.248 -0.198 1
1 1512 . 13 1 1 A 147 147 ARG C C 145 179.547 178.847 0.700 1
1 1513 . 13 1 1 A 147 147 ARG CA C 145 58.972 59.773 -0.801 1
1 1514 . 13 1 1 A 147 147 ARG CB C 145 29.798 30.546 -0.748 1
1 1517 . 13 1 1 A 147 147 ARG N N 145 119.173 118.942 0.231 1
1 1518 . 13 1 1 A 148 148 TYR H H 146 8.128 8.284 -0.156 1
1 1519 . 13 1 1 A 148 148 TYR HA H 146 3.995 4.418 -0.423 1
1 1524 . 13 1 1 A 148 148 TYR C C 146 178.199 177.540 0.659 1
1 1525 . 13 1 1 A 148 148 TYR CA C 146 62.347 61.448 0.899 1
1 1526 . 13 1 1 A 148 148 TYR CB C 146 37.418 37.496 -0.078 1
1 1529 . 13 1 1 A 148 148 TYR N N 146 120.102 121.173 -1.071 1
1 1530 . 13 1 1 A 149 149 PHE H H 147 8.308 8.704 -0.396 1
1 1531 . 13 1 1 A 149 149 PHE HA H 147 4.013 4.503 -0.490 1
1 1535 . 13 1 1 A 149 149 PHE C C 147 177.574 178.461 -0.887 1
1 1536 . 13 1 1 A 149 149 PHE CA C 147 63.044 61.718 1.326 1
1 1537 . 13 1 1 A 149 149 PHE CB C 147 37.153 38.359 -1.206 1
1 1541 . 13 1 1 A 149 149 PHE N N 147 116.680 118.055 -1.375 1
1 1542 . 13 1 1 A 150 150 GLU H H 148 8.271 9.280 -1.009 1
1 1543 . 13 1 1 A 150 150 GLU HA H 148 4.030 4.000 0.030 1
1 1547 . 13 1 1 A 150 150 GLU C C 148 177.687 178.038 -0.351 1
1 1548 . 13 1 1 A 150 150 GLU CA C 148 58.746 60.097 -1.351 1
1 1549 . 13 1 1 A 150 150 GLU CB C 148 28.847 29.376 -0.529 1
1 1551 . 13 1 1 A 150 150 GLU N N 148 119.973 118.933 1.040 1
1 1552 . 13 1 1 A 151 151 ALA H H 149 6.992 7.744 -0.752 1
1 1553 . 13 1 1 A 151 151 ALA HA H 149 4.217 4.454 -0.237 1
1 1557 . 13 1 1 A 151 151 ALA C C 149 178.190 176.953 1.237 1
1 1558 . 13 1 1 A 151 151 ALA CA C 149 52.779 51.902 0.877 1
1 1559 . 13 1 1 A 151 151 ALA CB C 149 19.087 19.132 -0.045 1
1 1560 . 13 1 1 A 151 151 ALA N N 149 118.629 119.987 -1.358 1
1 1561 . 13 1 1 A 152 152 TYR H H 150 7.722 8.726 -1.004 1
1 1562 . 13 1 1 A 152 152 TYR HA H 150 4.137 4.806 -0.669 1
1 1567 . 13 1 1 A 152 152 TYR C C 150 175.703 177.140 -1.437 1
1 1568 . 13 1 1 A 152 152 TYR CA C 150 59.260 59.286 -0.026 1
1 1569 . 13 1 1 A 152 152 TYR CB C 150 39.165 39.321 -0.156 1
1 1572 . 13 1 1 A 152 152 TYR N N 150 118.767 117.987 0.780 1
1 1573 . 13 1 1 A 153 153 LEU H H 151 7.670 8.982 -1.312 1
1 1574 . 13 1 1 A 153 153 LEU HA H 151 4.145 3.995 0.150 1
1 1584 . 13 1 1 A 153 153 LEU CA C 151 54.704 60.321 -5.617 1
1 1585 . 13 1 1 A 153 153 LEU CB C 151 40.520 40.562 -0.042 1
1 1589 . 13 1 1 A 153 153 LEU N N 151 122.313 120.989 1.324 1
1 1590 . 13 1 1 A 154 154 PRO HA H 152 4.258 4.582 -0.324 1
1 1597 . 13 1 1 A 154 154 PRO C C 152 177.496 178.824 -1.328 1
1 1598 . 13 1 1 A 154 154 PRO CA C 152 63.899 65.550 -1.651 1
1 1599 . 13 1 1 A 154 154 PRO CB C 152 31.080 31.451 -0.371 1
1 1602 . 13 1 1 A 155 155 GLN H H 153 8.023 8.040 -0.017 1
1 1603 . 13 1 1 A 155 155 GLN HA H 153 4.176 4.077 0.099 1
1 1607 . 13 1 1 A 155 155 GLN C C 153 176.636 178.360 -1.724 1
1 1608 . 13 1 1 A 155 155 GLN CA C 153 55.968 58.856 -2.888 1
1 1609 . 13 1 1 A 155 155 GLN CB C 153 28.723 29.006 -0.283 1
1 1610 . 13 1 1 A 155 155 GLN N N 153 119.173 117.615 1.558 1
1 1611 . 13 1 1 A 156 156 LYS H H 154 8.113 7.687 0.426 1
1 1612 . 13 1 1 A 156 156 LYS HA H 154 4.196 4.166 0.030 1
1 1619 . 13 1 1 A 156 156 LYS C C 154 56.493 178.395 -121.902 1
1 1620 . 13 1 1 A 156 156 LYS CA C 154 56.493 58.429 -1.936 1
1 1621 . 13 1 1 A 156 156 LYS CB C 154 32.037 31.326 0.711 1
1 1625 . 13 1 1 A 156 156 LYS N N 154 122.788 118.430 4.358 1
1 1626 . 13 1 1 A 157 157 THR H H 155 8.013 7.508 0.505 1
1 1627 . 13 1 1 A 157 157 THR HA H 155 4.183 4.038 0.145 1
1 1632 . 13 1 1 A 157 157 THR C C 155 174.580 175.465 -0.885 1
1 1633 . 13 1 1 A 157 157 THR CA C 155 61.958 66.004 -4.046 1
1 1634 . 13 1 1 A 157 157 THR CB C 155 69.665 68.539 1.126 1
1 1636 . 13 1 1 A 157 157 THR N N 155 115.504 115.451 0.053 1
1 1637 . 13 1 1 A 158 158 ALA H H 156 8.170 7.229 0.941 1
1 1638 . 13 1 1 A 158 158 ALA HA H 156 4.220 4.545 -0.325 1
1 1642 . 13 1 1 A 158 158 ALA CA C 156 52.492 51.257 1.235 1
1 1643 . 13 1 1 A 158 158 ALA CB C 156 18.810 19.147 -0.337 1
1 1644 . 13 1 1 A 158 158 ALA N N 156 126.825 121.632 5.193 1
1 1645 . 13 1 1 A 159 159 SER H H 157 7.762 8.330 -0.568 1
1 1646 . 13 1 1 A 159 159 SER CA C 157 58.230 61.568 -3.338 1
1 1647 . 13 1 1 A 159 159 SER CB C 157 63.440 63.433 0.007 1
1 1648 . 13 1 1 A 159 159 SER N N 157 123.078 116.387 6.691 1
1 1649 . 13 1 1 A 162 162 HIS HA H 160 4.845 5.128 -0.283 1
1 1652 . 13 1 1 A 162 162 HIS CA C 160 53.590 52.420 1.170 1
1 1653 . 13 1 1 A 162 162 HIS CB C 160 29.398 29.622 -0.224 1
1 1654 . 13 1 1 A 163 163 PRO HA H 161 4.388 4.233 0.155 1
1 1660 . 13 1 1 A 163 163 PRO C C 161 177.018 176.855 0.163 1
1 1661 . 13 1 1 A 163 163 PRO CA C 161 63.118 64.873 -1.755 1
1 1662 . 13 1 1 A 163 163 PRO CB C 161 31.668 31.791 -0.123 1
1 1665 . 13 1 1 A 164 164 SER H H 162 8.418 8.171 0.247 1
1 1666 . 13 1 1 A 164 164 SER HA H 162 4.338 4.230 0.108 1
1 1668 . 13 1 1 A 164 164 SER C C 162 173.327 173.619 -0.292 1
1 1669 . 13 1 1 A 164 164 SER CA C 162 58.202 58.818 -0.616 1
1 1670 . 13 1 1 A 164 164 SER CB C 162 64.080 61.983 2.097 1
1 1671 . 13 1 1 A 164 164 SER N N 162 117.485 112.913 4.572 1
1 6 . 14 1 1 A 4 4 ALA H H 2 8.270 7.538 0.732 1
1 7 . 14 1 1 A 4 4 ALA HA H 2 4.212 4.304 -0.092 1
1 11 . 14 1 1 A 4 4 ALA C C 2 177.441 177.247 0.194 1
1 12 . 14 1 1 A 4 4 ALA CA C 2 52.280 52.610 -0.330 1
1 13 . 14 1 1 A 4 4 ALA CB C 2 18.880 19.471 -0.591 1
1 14 . 14 1 1 A 4 4 ALA N N 2 126.500 124.385 2.115 1
1 15 . 14 1 1 A 5 5 ALA H H 3 8.251 8.312 -0.061 1
1 16 . 14 1 1 A 5 5 ALA HA H 3 4.261 4.372 -0.111 1
1 20 . 14 1 1 A 5 5 ALA C C 3 177.824 177.177 0.647 1
1 21 . 14 1 1 A 5 5 ALA CA C 3 52.347 52.321 0.026 1
1 22 . 14 1 1 A 5 5 ALA CB C 3 18.869 19.203 -0.334 1
1 23 . 14 1 1 A 5 5 ALA N N 3 124.322 123.856 0.466 1
1 24 . 14 1 1 A 6 6 SER H H 4 8.158 8.748 -0.590 1
1 25 . 14 1 1 A 6 6 SER HA H 4 4.358 5.020 -0.662 1
1 27 . 14 1 1 A 6 6 SER C C 4 175.222 174.279 0.943 1
1 28 . 14 1 1 A 6 6 SER CA C 4 58.438 57.308 1.130 1
1 29 . 14 1 1 A 6 6 SER CB C 4 63.859 64.457 -0.598 1
1 30 . 14 1 1 A 6 6 SER N N 4 115.338 117.272 -1.934 1
1 31 . 14 1 1 A 7 7 GLY H H 5 8.265 8.558 -0.293 1
1 32 . 14 1 1 A 7 7 GLY HA2 H 5 3.900 4.374 -0.474 1
1 33 . 14 1 1 A 7 7 GLY C C 5 174.083 171.955 2.128 1
1 34 . 14 1 1 A 7 7 GLY CA C 5 45.113 45.148 -0.035 1
1 35 . 14 1 1 A 7 7 GLY N N 5 111.360 112.503 -1.143 1
1 36 . 14 1 1 A 8 8 GLU H H 6 8.100 8.561 -0.461 1
1 37 . 14 1 1 A 8 8 GLU HA H 6 4.209 4.740 -0.531 1
1 41 . 14 1 1 A 8 8 GLU C C 6 176.354 176.966 -0.612 1
1 42 . 14 1 1 A 8 8 GLU CA C 6 56.261 55.444 0.817 1
1 43 . 14 1 1 A 8 8 GLU CB C 6 29.830 31.822 -1.992 1
1 45 . 14 1 1 A 8 8 GLU N N 6 121.056 120.088 0.968 1
1 46 . 14 1 1 A 9 9 GLN H H 7 8.287 8.439 -0.152 1
1 47 . 14 1 1 A 9 9 GLN HA H 7 4.247 4.539 -0.292 1
1 51 . 14 1 1 A 9 9 GLN C C 7 172.457 175.514 -3.057 1
1 52 . 14 1 1 A 9 9 GLN CA C 7 55.269 56.171 -0.902 1
1 53 . 14 1 1 A 9 9 GLN CB C 7 29.236 29.968 -0.732 1
1 55 . 14 1 1 A 9 9 GLN N N 7 122.164 120.622 1.542 1
1 56 . 14 1 1 A 10 10 ALA H H 8 8.368 8.455 -0.087 1
1 57 . 14 1 1 A 10 10 ALA HA H 8 4.509 4.727 -0.218 1
1 61 . 14 1 1 A 10 10 ALA CA C 8 50.341 50.074 0.267 1
1 62 . 14 1 1 A 10 10 ALA CB C 8 18.140 21.913 -3.773 1
1 63 . 14 1 1 A 10 10 ALA N N 8 128.028 121.404 6.624 1
1 64 . 14 1 1 A 11 11 PRO HA H 9 4.437 4.517 -0.080 1
1 70 . 14 1 1 A 11 11 PRO C C 9 176.381 176.243 0.138 1
1 71 . 14 1 1 A 11 11 PRO CA C 9 63.298 62.352 0.946 1
1 72 . 14 1 1 A 11 11 PRO CB C 9 31.776 33.301 -1.525 1
1 75 . 14 1 1 A 12 12 CYS H H 10 8.056 8.322 -0.266 1
1 76 . 14 1 1 A 12 12 CYS HA H 10 4.717 5.149 -0.432 1
1 79 . 14 1 1 A 12 12 CYS C C 10 173.266 173.285 -0.019 1
1 80 . 14 1 1 A 12 12 CYS CA C 10 57.398 57.107 0.291 1
1 81 . 14 1 1 A 12 12 CYS CB C 10 29.165 31.141 -1.976 1
1 82 . 14 1 1 A 12 12 CYS N N 10 118.295 117.372 0.923 1
1 83 . 14 1 1 A 13 13 SER H H 11 9.815 8.700 1.115 1
1 84 . 14 1 1 A 13 13 SER HA H 11 5.227 5.758 -0.531 1
1 87 . 14 1 1 A 13 13 SER C C 11 173.648 173.244 0.404 1
1 88 . 14 1 1 A 13 13 SER CA C 11 57.630 57.010 0.620 1
1 89 . 14 1 1 A 13 13 SER CB C 11 64.820 66.575 -1.755 1
1 90 . 14 1 1 A 13 13 SER N N 11 122.365 118.150 4.215 1
1 91 . 14 1 1 A 14 14 VAL H H 12 9.352 8.713 0.639 1
1 92 . 14 1 1 A 14 14 VAL HA H 12 4.696 5.310 -0.614 1
1 100 . 14 1 1 A 14 14 VAL C C 12 173.875 173.631 0.244 1
1 101 . 14 1 1 A 14 14 VAL CA C 12 60.146 60.982 -0.836 1
1 102 . 14 1 1 A 14 14 VAL CB C 12 34.499 35.753 -1.254 1
1 105 . 14 1 1 A 14 14 VAL N N 12 126.378 122.626 3.752 1
1 106 . 14 1 1 A 15 15 TYR H H 13 8.745 8.805 -0.060 1
1 111 . 14 1 1 A 15 15 TYR C C 13 173.345 173.955 -0.610 1
1 112 . 14 1 1 A 15 15 TYR CA C 13 56.186 54.866 1.320 1
1 113 . 14 1 1 A 15 15 TYR CB C 13 40.858 40.303 0.555 1
1 116 . 14 1 1 A 15 15 TYR N N 13 129.472 128.425 1.047 1
1 117 . 14 1 1 A 16 16 PHE H H 14 7.370 8.941 -1.571 1
1 118 . 14 1 1 A 16 16 PHE HA H 14 5.720 5.572 0.148 1
1 123 . 14 1 1 A 16 16 PHE C C 14 174.058 173.825 0.233 1
1 124 . 14 1 1 A 16 16 PHE CA C 14 54.361 56.413 -2.052 1
1 125 . 14 1 1 A 16 16 PHE CB C 14 40.461 40.545 -0.084 1
1 129 . 14 1 1 A 16 16 PHE N N 14 128.263 127.119 1.144 1
1 130 . 14 1 1 A 17 17 CYS H H 15 8.147 8.892 -0.745 1
1 131 . 14 1 1 A 17 17 CYS CA C 15 56.570 57.601 -1.031 1
1 132 . 14 1 1 A 17 17 CYS CB C 15 29.690 28.906 0.784 1
1 133 . 14 1 1 A 17 17 CYS N N 15 126.188 124.121 2.067 1
1 134 . 14 1 1 A 18 18 GLY HA2 H 16 3.819 3.056 0.763 1
1 135 . 14 1 1 A 18 18 GLY C C 16 173.374 172.236 1.138 1
1 136 . 14 1 1 A 18 18 GLY CA C 16 45.510 44.305 1.205 1
1 137 . 14 1 1 A 19 19 SER H H 17 8.533 8.457 0.076 1
1 138 . 14 1 1 A 19 19 SER HA H 17 4.505 5.276 -0.771 1
1 139 . 14 1 1 A 19 19 SER CA C 17 58.700 57.700 1.000 1
1 140 . 14 1 1 A 19 19 SER CB C 17 63.810 66.654 -2.844 1
1 141 . 14 1 1 A 19 19 SER N N 17 117.300 116.068 1.232 1
1 142 . 14 1 1 A 20 20 ILE HA H 18 4.309 5.090 -0.781 1
1 152 . 14 1 1 A 20 20 ILE CA C 18 61.317 59.215 2.102 1
1 153 . 14 1 1 A 20 20 ILE CB C 18 38.302 42.325 -4.023 1
1 157 . 14 1 1 A 21 21 ARG HA H 19 4.172 4.671 -0.499 1
1 160 . 14 1 1 A 21 21 ARG C C 19 177.118 176.920 0.198 1
1 161 . 14 1 1 A 21 21 ARG CA C 19 56.960 55.827 1.133 1
1 162 . 14 1 1 A 21 21 ARG CB C 19 29.568 32.889 -3.321 1
1 165 . 14 1 1 A 22 22 GLY H H 20 8.685 7.651 1.034 1
1 166 . 14 1 1 A 22 22 GLY HA2 H 20 3.801 4.030 -0.229 1
1 167 . 14 1 1 A 22 22 GLY HA3 H 20 3.923 4.036 -0.113 1
1 168 . 14 1 1 A 22 22 GLY C C 20 174.814 175.393 -0.579 1
1 169 . 14 1 1 A 22 22 GLY CA C 20 45.289 45.358 -0.069 1
1 170 . 14 1 1 A 22 22 GLY N N 20 110.145 107.008 3.137 1
1 171 . 14 1 1 A 23 23 GLY H H 21 8.058 8.103 -0.045 1
1 172 . 14 1 1 A 23 23 GLY HA2 H 21 3.998 4.001 -0.003 1
1 173 . 14 1 1 A 23 23 GLY HA3 H 21 4.237 4.027 0.210 1
1 174 . 14 1 1 A 23 23 GLY C C 21 174.762 174.162 0.600 1
1 175 . 14 1 1 A 23 23 GLY CA C 21 45.025 46.716 -1.691 1
1 176 . 14 1 1 A 23 23 GLY N N 21 109.327 109.624 -0.297 1
1 177 . 14 1 1 A 24 24 ARG H H 22 8.376 8.216 0.160 1
1 178 . 14 1 1 A 24 24 ARG HA H 22 4.086 4.863 -0.777 1
1 184 . 14 1 1 A 24 24 ARG C C 22 178.178 176.892 1.286 1
1 185 . 14 1 1 A 24 24 ARG CA C 22 57.471 54.301 3.170 1
1 186 . 14 1 1 A 24 24 ARG CB C 22 29.653 33.384 -3.731 1
1 189 . 14 1 1 A 24 24 ARG N N 22 120.861 121.611 -0.750 1
1 190 . 14 1 1 A 25 25 GLU H H 23 8.831 8.725 0.106 1
1 191 . 14 1 1 A 25 25 GLU HA H 23 4.015 3.966 0.049 1
1 195 . 14 1 1 A 25 25 GLU C C 23 178.005 178.131 -0.126 1
1 196 . 14 1 1 A 25 25 GLU CA C 23 58.920 59.581 -0.661 1
1 197 . 14 1 1 A 25 25 GLU CB C 23 28.592 29.483 -0.891 1
1 199 . 14 1 1 A 25 25 GLU N N 23 121.243 120.684 0.559 1
1 200 . 14 1 1 A 26 26 ASP H H 24 7.897 8.236 -0.339 1
1 201 . 14 1 1 A 26 26 ASP HA H 24 4.516 4.000 0.516 1
1 203 . 14 1 1 A 26 26 ASP C C 24 176.455 179.061 -2.606 1
1 204 . 14 1 1 A 26 26 ASP CA C 24 55.122 56.327 -1.205 1
1 205 . 14 1 1 A 26 26 ASP CB C 24 39.888 40.345 -0.457 1
1 206 . 14 1 1 A 26 26 ASP N N 24 119.541 119.762 -0.221 1
1 207 . 14 1 1 A 27 27 GLN H H 25 7.696 7.811 -0.115 1
1 208 . 14 1 1 A 27 27 GLN HA H 25 3.704 4.265 -0.561 1
1 212 . 14 1 1 A 27 27 GLN C C 25 177.016 178.349 -1.333 1
1 213 . 14 1 1 A 27 27 GLN CA C 25 59.501 58.716 0.785 1
1 214 . 14 1 1 A 27 27 GLN CB C 25 27.762 28.472 -0.710 1
1 216 . 14 1 1 A 27 27 GLN N N 25 119.471 119.848 -0.377 1
1 217 . 14 1 1 A 28 28 ALA H H 26 8.227 7.902 0.325 1
1 218 . 14 1 1 A 28 28 ALA HA H 26 4.072 4.069 0.003 1
1 222 . 14 1 1 A 28 28 ALA C C 26 180.567 179.826 0.741 1
1 223 . 14 1 1 A 28 28 ALA CA C 26 54.627 55.141 -0.514 1
1 224 . 14 1 1 A 28 28 ALA CB C 26 17.355 18.536 -1.181 1
1 225 . 14 1 1 A 28 28 ALA N N 26 122.362 122.397 -0.035 1
1 226 . 14 1 1 A 29 29 LEU H H 27 7.533 7.941 -0.408 1
1 227 . 14 1 1 A 29 29 LEU HA H 27 4.050 3.962 0.088 1
1 237 . 14 1 1 A 29 29 LEU C C 27 178.752 177.962 0.790 1
1 238 . 14 1 1 A 29 29 LEU CA C 27 57.578 57.532 0.046 1
1 239 . 14 1 1 A 29 29 LEU CB C 27 40.734 41.560 -0.826 1
1 243 . 14 1 1 A 29 29 LEU N N 27 122.255 119.553 2.702 1
1 244 . 14 1 1 A 30 30 TYR H H 28 8.473 7.952 0.521 1
1 245 . 14 1 1 A 30 30 TYR HA H 28 4.049 4.023 0.026 1
1 250 . 14 1 1 A 30 30 TYR C C 28 177.736 178.690 -0.954 1
1 251 . 14 1 1 A 30 30 TYR CA C 28 59.817 60.134 -0.317 1
1 252 . 14 1 1 A 30 30 TYR CB C 28 36.140 37.218 -1.078 1
1 255 . 14 1 1 A 30 30 TYR N N 28 120.403 118.431 1.972 1
1 256 . 14 1 1 A 31 31 ALA H H 29 8.008 8.979 -0.971 1
1 257 . 14 1 1 A 31 31 ALA HA H 29 4.005 4.111 -0.106 1
1 261 . 14 1 1 A 31 31 ALA C C 29 180.879 179.523 1.356 1
1 262 . 14 1 1 A 31 31 ALA CA C 29 54.914 55.367 -0.453 1
1 263 . 14 1 1 A 31 31 ALA CB C 29 17.375 18.259 -0.884 1
1 264 . 14 1 1 A 31 31 ALA N N 29 120.771 122.954 -2.183 1
1 265 . 14 1 1 A 32 32 ARG H H 30 7.596 7.610 -0.014 1
1 266 . 14 1 1 A 32 32 ARG HA H 30 3.916 4.213 -0.297 1
1 273 . 14 1 1 A 32 32 ARG C C 30 179.919 178.561 1.358 1
1 274 . 14 1 1 A 32 32 ARG CA C 30 59.014 59.104 -0.090 1
1 275 . 14 1 1 A 32 32 ARG CB C 30 30.531 29.617 0.914 1
1 278 . 14 1 1 A 32 32 ARG N N 30 120.365 118.049 2.316 1
1 279 . 14 1 1 A 33 33 ILE H H 31 8.066 8.442 -0.376 1
1 280 . 14 1 1 A 33 33 ILE HA H 31 3.120 3.598 -0.478 1
1 290 . 14 1 1 A 33 33 ILE C C 31 177.051 178.241 -1.190 1
1 291 . 14 1 1 A 33 33 ILE CA C 31 65.757 65.277 0.480 1
1 292 . 14 1 1 A 33 33 ILE CB C 31 36.928 37.726 -0.798 1
1 296 . 14 1 1 A 33 33 ILE N N 31 121.608 119.677 1.931 1
1 297 . 14 1 1 A 34 34 VAL H H 32 8.148 8.857 -0.709 1
1 298 . 14 1 1 A 34 34 VAL HA H 32 2.954 3.479 -0.525 1
1 306 . 14 1 1 A 34 34 VAL C C 32 177.159 178.234 -1.075 1
1 307 . 14 1 1 A 34 34 VAL CA C 32 67.220 66.365 0.855 1
1 308 . 14 1 1 A 34 34 VAL CB C 32 31.039 31.169 -0.130 1
1 311 . 14 1 1 A 34 34 VAL N N 32 119.318 120.245 -0.927 1
1 312 . 14 1 1 A 35 35 SER H H 33 7.826 8.387 -0.561 1
1 313 . 14 1 1 A 35 35 SER HA H 33 3.868 4.042 -0.174 1
1 316 . 14 1 1 A 35 35 SER C C 33 176.779 176.741 0.038 1
1 317 . 14 1 1 A 35 35 SER CA C 33 62.000 61.853 0.147 1
1 318 . 14 1 1 A 35 35 SER CB C 33 62.789 62.785 0.004 1
1 319 . 14 1 1 A 35 35 SER N N 33 111.936 116.222 -4.286 1
1 320 . 14 1 1 A 36 36 ARG H H 34 7.405 7.613 -0.208 1
1 321 . 14 1 1 A 36 36 ARG HA H 34 4.070 4.092 -0.022 1
1 323 . 14 1 1 A 36 36 ARG C C 34 178.047 178.580 -0.533 1
1 324 . 14 1 1 A 36 36 ARG CA C 34 56.108 59.031 -2.923 1
1 325 . 14 1 1 A 36 36 ARG CB C 34 28.837 30.058 -1.221 1
1 326 . 14 1 1 A 36 36 ARG N N 34 120.909 122.166 -1.257 1
1 327 . 14 1 1 A 37 37 LEU H H 35 8.301 8.272 0.029 1
1 328 . 14 1 1 A 37 37 LEU HA H 35 3.620 3.712 -0.092 1
1 336 . 14 1 1 A 37 37 LEU C C 35 178.446 179.383 -0.937 1
1 337 . 14 1 1 A 37 37 LEU CA C 35 57.640 57.908 -0.268 1
1 338 . 14 1 1 A 37 37 LEU CB C 35 41.584 41.670 -0.086 1
1 342 . 14 1 1 A 37 37 LEU N N 35 118.567 120.211 -1.644 1
1 343 . 14 1 1 A 38 38 ARG H H 36 7.379 8.426 -1.047 1
1 344 . 14 1 1 A 38 38 ARG HA H 36 4.340 4.098 0.242 1
1 350 . 14 1 1 A 38 38 ARG C C 36 177.895 179.274 -1.379 1
1 351 . 14 1 1 A 38 38 ARG CA C 36 57.785 59.254 -1.469 1
1 352 . 14 1 1 A 38 38 ARG CB C 36 29.775 29.733 0.042 1
1 355 . 14 1 1 A 38 38 ARG N N 36 115.352 119.144 -3.792 1
1 356 . 14 1 1 A 39 39 ARG H H 37 7.240 7.934 -0.694 1
1 357 . 14 1 1 A 39 39 ARG HA H 37 3.743 4.085 -0.342 1
1 363 . 14 1 1 A 39 39 ARG C C 37 176.988 178.991 -2.003 1
1 364 . 14 1 1 A 39 39 ARG CA C 37 57.605 58.718 -1.113 1
1 365 . 14 1 1 A 39 39 ARG CB C 37 28.925 30.375 -1.450 1
1 368 . 14 1 1 A 39 39 ARG N N 37 117.410 119.246 -1.836 1
1 369 . 14 1 1 A 40 40 TYR H H 38 7.296 8.314 -1.018 1
1 370 . 14 1 1 A 40 40 TYR HA H 38 4.319 4.169 0.150 1
1 375 . 14 1 1 A 40 40 TYR C C 38 175.001 176.145 -1.144 1
1 376 . 14 1 1 A 40 40 TYR CA C 38 57.730 60.243 -2.513 1
1 377 . 14 1 1 A 40 40 TYR CB C 38 39.343 37.934 1.409 1
1 380 . 14 1 1 A 40 40 TYR N N 38 116.937 118.906 -1.969 1
1 381 . 14 1 1 A 41 41 GLY H H 39 7.325 7.684 -0.359 1
1 382 . 14 1 1 A 41 41 GLY HA2 H 39 3.953 4.057 -0.104 1
1 383 . 14 1 1 A 41 41 GLY C C 39 171.302 171.999 -0.697 1
1 384 . 14 1 1 A 41 41 GLY CA C 39 45.590 45.573 0.017 1
1 385 . 14 1 1 A 41 41 GLY N N 39 105.596 104.294 1.302 1
1 386 . 14 1 1 A 42 42 LYS H H 40 8.186 8.774 -0.588 1
1 387 . 14 1 1 A 42 42 LYS HA H 40 4.205 4.732 -0.527 1
1 393 . 14 1 1 A 42 42 LYS C C 40 175.672 175.793 -0.121 1
1 394 . 14 1 1 A 42 42 LYS CA C 40 55.241 55.333 -0.092 1
1 395 . 14 1 1 A 42 42 LYS CB C 40 32.889 34.299 -1.410 1
1 399 . 14 1 1 A 42 42 LYS N N 40 120.341 121.943 -1.602 1
1 400 . 14 1 1 A 43 43 VAL H H 41 8.610 8.853 -0.243 1
1 401 . 14 1 1 A 43 43 VAL HA H 41 4.416 4.295 0.121 1
1 409 . 14 1 1 A 43 43 VAL C C 41 175.997 175.338 0.659 1
1 410 . 14 1 1 A 43 43 VAL CA C 41 61.331 62.765 -1.434 1
1 411 . 14 1 1 A 43 43 VAL CB C 41 30.573 31.880 -1.307 1
1 414 . 14 1 1 A 43 43 VAL N N 41 127.312 124.090 3.222 1
1 415 . 14 1 1 A 44 44 LEU H H 42 8.894 8.428 0.466 1
1 416 . 14 1 1 A 44 44 LEU HA H 42 4.496 3.563 0.933 1
1 424 . 14 1 1 A 44 44 LEU CA C 42 54.522 56.345 -1.823 1
1 425 . 14 1 1 A 44 44 LEU CB C 42 40.980 41.814 -0.834 1
1 429 . 14 1 1 A 44 44 LEU N N 42 130.261 127.206 3.055 1
1 430 . 14 1 1 A 45 45 THR HA H 43 4.263 3.978 0.285 1
1 435 . 14 1 1 A 45 45 THR CA C 43 61.033 61.936 -0.903 1
1 436 . 14 1 1 A 45 45 THR CB C 43 69.768 66.560 3.208 1
1 440 . 14 1 1 A 46 46 GLU CA C 44 56.411 59.662 -3.251 1
1 441 . 14 1 1 A 46 46 GLU CB C 44 29.827 29.063 0.764 1
1 443 . 14 1 1 A 47 47 HIS HA H 45 4.549 4.245 0.304 1
1 447 . 14 1 1 A 47 47 HIS C C 45 174.812 177.167 -2.355 1
1 448 . 14 1 1 A 47 47 HIS CA C 45 56.107 59.925 -3.818 1
1 449 . 14 1 1 A 47 47 HIS CB C 45 29.080 29.941 -0.861 1
1 451 . 14 1 1 A 48 48 VAL H H 46 7.826 8.085 -0.259 1
1 452 . 14 1 1 A 48 48 VAL HA H 46 4.024 3.635 0.389 1
1 460 . 14 1 1 A 48 48 VAL C C 46 175.697 177.983 -2.286 1
1 461 . 14 1 1 A 48 48 VAL CA C 46 61.841 66.881 -5.040 1
1 462 . 14 1 1 A 48 48 VAL CB C 46 32.600 31.642 0.958 1
1 465 . 14 1 1 A 48 48 VAL N N 46 121.117 119.432 1.685 1
1 466 . 14 1 1 A 49 49 ALA H H 47 8.237 8.370 -0.133 1
1 467 . 14 1 1 A 49 49 ALA HA H 47 4.281 4.081 0.200 1
1 471 . 14 1 1 A 49 49 ALA C C 47 177.173 178.719 -1.546 1
1 472 . 14 1 1 A 49 49 ALA CA C 47 52.207 55.644 -3.437 1
1 473 . 14 1 1 A 49 49 ALA CB C 47 19.064 18.560 0.504 1
1 474 . 14 1 1 A 49 49 ALA N N 47 126.817 121.445 5.372 1
1 475 . 14 1 1 A 50 50 ASP H H 48 8.029 8.341 -0.312 1
1 476 . 14 1 1 A 50 50 ASP HA H 48 4.436 4.594 -0.158 1
1 479 . 14 1 1 A 50 50 ASP C C 48 176.124 176.561 -0.437 1
1 480 . 14 1 1 A 50 50 ASP CA C 48 54.447 53.025 1.422 1
1 481 . 14 1 1 A 50 50 ASP CB C 48 40.877 39.245 1.632 1
1 482 . 14 1 1 A 50 50 ASP N N 48 119.687 117.329 2.358 1
1 483 . 14 1 1 A 51 51 ALA H H 49 8.094 8.060 0.034 1
1 484 . 14 1 1 A 51 51 ALA HA H 49 4.134 4.447 -0.313 1
1 488 . 14 1 1 A 51 51 ALA C C 49 177.835 177.744 0.091 1
1 489 . 14 1 1 A 51 51 ALA CA C 49 52.900 52.609 0.291 1
1 490 . 14 1 1 A 51 51 ALA CB C 49 18.942 21.114 -2.172 1
1 491 . 14 1 1 A 51 51 ALA N N 49 124.400 124.146 0.254 1
1 492 . 14 1 1 A 52 52 GLU H H 50 8.243 8.129 0.114 1
1 493 . 14 1 1 A 52 52 GLU HA H 50 4.152 4.324 -0.172 1
1 497 . 14 1 1 A 52 52 GLU C C 50 176.456 176.966 -0.510 1
1 498 . 14 1 1 A 52 52 GLU CA C 50 56.480 56.501 -0.021 1
1 499 . 14 1 1 A 52 52 GLU CB C 50 29.470 28.991 0.479 1
1 501 . 14 1 1 A 52 52 GLU N N 50 118.917 113.973 4.944 1
1 502 . 14 1 1 A 53 53 LEU H H 51 7.839 8.244 -0.405 1
1 503 . 14 1 1 A 53 53 LEU HA H 51 4.229 4.523 -0.294 1
1 513 . 14 1 1 A 53 53 LEU C C 51 177.058 175.901 1.157 1
1 514 . 14 1 1 A 53 53 LEU CA C 51 54.625 54.381 0.244 1
1 515 . 14 1 1 A 53 53 LEU CB C 51 42.125 43.019 -0.894 1
1 519 . 14 1 1 A 53 53 LEU N N 51 122.169 118.228 3.941 1
1 520 . 14 1 1 A 54 54 GLU H H 52 8.104 7.735 0.369 1
1 521 . 14 1 1 A 54 54 GLU HA H 52 4.470 4.595 -0.125 1
1 525 . 14 1 1 A 54 54 GLU CA C 52 54.286 54.779 -0.493 1
1 526 . 14 1 1 A 54 54 GLU CB C 52 29.268 33.229 -3.961 1
1 528 . 14 1 1 A 54 54 GLU N N 52 123.040 116.970 6.070 1
1 529 . 14 1 1 A 55 55 PRO HA H 53 4.310 4.491 -0.181 1
1 536 . 14 1 1 A 55 55 PRO C C 53 177.019 177.457 -0.438 1
1 537 . 14 1 1 A 55 55 PRO CA C 53 63.075 63.201 -0.126 1
1 538 . 14 1 1 A 55 55 PRO CB C 53 31.329 31.892 -0.563 1
1 541 . 14 1 1 A 56 56 LEU H H 54 8.263 8.597 -0.334 1
1 542 . 14 1 1 A 56 56 LEU HA H 54 4.237 4.054 0.183 1
1 552 . 14 1 1 A 56 56 LEU C C 54 178.055 178.776 -0.721 1
1 553 . 14 1 1 A 56 56 LEU CA C 54 55.018 58.330 -3.312 1
1 554 . 14 1 1 A 56 56 LEU CB C 54 41.990 42.011 -0.021 1
1 558 . 14 1 1 A 56 56 LEU N N 54 122.728 123.307 -0.579 1
1 559 . 14 1 1 A 57 57 GLY H H 55 8.231 7.570 0.661 1
1 560 . 14 1 1 A 57 57 GLY HA2 H 55 3.911 4.081 -0.170 1
1 561 . 14 1 1 A 57 57 GLY HA3 H 55 3.808 4.087 -0.279 1
1 562 . 14 1 1 A 57 57 GLY C C 55 174.379 175.289 -0.910 1
1 563 . 14 1 1 A 57 57 GLY CA C 55 45.092 45.611 -0.519 1
1 564 . 14 1 1 A 57 57 GLY N N 55 110.035 104.854 5.181 1
1 565 . 14 1 1 A 58 58 GLU H H 56 8.241 8.386 -0.145 1
1 566 . 14 1 1 A 58 58 GLU HA H 56 4.136 4.108 0.028 1
1 570 . 14 1 1 A 58 58 GLU C C 56 176.868 179.329 -2.461 1
1 571 . 14 1 1 A 58 58 GLU CA C 56 56.734 59.299 -2.565 1
1 572 . 14 1 1 A 58 58 GLU CB C 56 29.584 29.432 0.152 1
1 574 . 14 1 1 A 58 58 GLU N N 56 121.173 121.697 -0.524 1
1 575 . 14 1 1 A 59 59 GLU H H 57 8.419 8.242 0.177 1
1 576 . 14 1 1 A 59 59 GLU HA H 57 4.074 4.195 -0.121 1
1 580 . 14 1 1 A 59 59 GLU C C 57 176.502 177.111 -0.609 1
1 581 . 14 1 1 A 59 59 GLU CA C 57 56.842 58.221 -1.379 1
1 582 . 14 1 1 A 59 59 GLU CB C 57 29.267 29.481 -0.214 1
1 584 . 14 1 1 A 59 59 GLU N N 57 121.777 121.037 0.740 1
1 585 . 14 1 1 A 60 60 ALA H H 58 8.077 7.327 0.750 1
1 586 . 14 1 1 A 60 60 ALA HA H 58 4.134 4.242 -0.108 1
1 590 . 14 1 1 A 60 60 ALA CA C 58 52.432 52.474 -0.042 1
1 591 . 14 1 1 A 60 60 ALA CB C 58 18.743 19.775 -1.032 1
1 592 . 14 1 1 A 60 60 ALA N N 58 125.120 122.955 2.165 1
1 593 . 14 1 1 A 61 61 ALA H H 59 8.041 8.446 -0.405 1
1 594 . 14 1 1 A 61 61 ALA HA H 59 4.131 4.085 0.046 1
1 598 . 14 1 1 A 61 61 ALA C C 59 178.147 177.335 0.812 1
1 599 . 14 1 1 A 61 61 ALA CA C 59 52.586 53.958 -1.372 1
1 600 . 14 1 1 A 61 61 ALA CB C 59 18.692 19.648 -0.956 1
1 601 . 14 1 1 A 61 61 ALA N N 59 123.857 122.278 1.579 1
1 602 . 14 1 1 A 62 62 GLY H H 60 8.069 7.566 0.503 1
1 603 . 14 1 1 A 62 62 GLY HA2 H 60 3.810 4.077 -0.267 1
1 604 . 14 1 1 A 62 62 GLY HA3 H 60 3.888 4.080 -0.192 1
1 605 . 14 1 1 A 62 62 GLY C C 60 174.914 173.934 0.980 1
1 606 . 14 1 1 A 62 62 GLY CA C 60 45.320 45.944 -0.624 1
1 607 . 14 1 1 A 62 62 GLY N N 60 107.924 103.361 4.563 1
1 608 . 14 1 1 A 63 63 GLY H H 61 8.118 8.636 -0.518 1
1 609 . 14 1 1 A 63 63 GLY HA2 H 61 4.008 4.153 -0.145 1
1 610 . 14 1 1 A 63 63 GLY HA3 H 61 3.893 4.190 -0.297 1
1 611 . 14 1 1 A 63 63 GLY C C 61 174.743 174.905 -0.162 1
1 612 . 14 1 1 A 63 63 GLY CA C 61 45.202 45.333 -0.131 1
1 613 . 14 1 1 A 63 63 GLY N N 61 109.441 107.482 1.959 1
1 614 . 14 1 1 A 64 64 ASP H H 62 8.305 8.454 -0.149 1
1 615 . 14 1 1 A 64 64 ASP HA H 62 4.240 4.278 -0.038 1
1 618 . 14 1 1 A 64 64 ASP C C 62 177.571 178.228 -0.657 1
1 619 . 14 1 1 A 64 64 ASP CA C 62 57.210 57.283 -0.073 1
1 620 . 14 1 1 A 64 64 ASP CB C 62 40.142 40.213 -0.071 1
1 621 . 14 1 1 A 64 64 ASP N N 62 121.568 120.652 0.916 1
1 622 . 14 1 1 A 65 65 GLN H H 63 8.337 7.954 0.383 1
1 623 . 14 1 1 A 65 65 GLN HA H 63 4.138 4.033 0.105 1
1 628 . 14 1 1 A 65 65 GLN C C 63 177.490 178.529 -1.039 1
1 629 . 14 1 1 A 65 65 GLN CA C 63 58.643 58.757 -0.114 1
1 630 . 14 1 1 A 65 65 GLN CB C 63 27.803 28.605 -0.802 1
1 632 . 14 1 1 A 65 65 GLN N N 63 119.700 119.061 0.639 1
1 633 . 14 1 1 A 66 66 PHE H H 64 7.658 8.324 -0.666 1
1 634 . 14 1 1 A 66 66 PHE HA H 64 4.170 4.194 -0.024 1
1 638 . 14 1 1 A 66 66 PHE C C 64 176.872 177.653 -0.781 1
1 639 . 14 1 1 A 66 66 PHE CA C 64 60.158 61.213 -1.055 1
1 640 . 14 1 1 A 66 66 PHE CB C 64 38.490 38.919 -0.429 1
1 643 . 14 1 1 A 66 66 PHE N N 64 121.036 120.262 0.774 1
1 644 . 14 1 1 A 67 67 ILE H H 65 7.646 8.789 -1.143 1
1 645 . 14 1 1 A 67 67 ILE HA H 65 3.426 3.617 -0.191 1
1 655 . 14 1 1 A 67 67 ILE CA C 65 63.377 65.001 -1.624 1
1 656 . 14 1 1 A 67 67 ILE CB C 65 37.057 37.438 -0.381 1
1 660 . 14 1 1 A 67 67 ILE N N 65 121.372 119.974 1.398 1
1 661 . 14 1 1 A 68 68 HIS H H 66 7.945 8.164 -0.219 1
1 662 . 14 1 1 A 68 68 HIS HA H 66 4.005 4.210 -0.205 1
1 665 . 14 1 1 A 68 68 HIS CA C 66 59.915 59.289 0.626 1
1 668 . 14 1 1 A 68 68 HIS N N 66 120.036 120.110 -0.074 1
1 669 . 14 1 1 A 69 69 GLU HA H 67 3.677 3.990 -0.313 1
1 673 . 14 1 1 A 69 69 GLU CA C 67 58.490 59.725 -1.235 1
1 674 . 14 1 1 A 69 69 GLU CB C 67 29.290 29.535 -0.245 1
1 676 . 14 1 1 A 70 70 GLN H H 68 8.017 7.849 0.168 1
1 677 . 14 1 1 A 70 70 GLN HA H 68 3.426 3.816 -0.390 1
1 678 . 14 1 1 A 70 70 GLN C C 68 179.280 178.930 0.350 1
1 679 . 14 1 1 A 70 70 GLN CA C 68 57.561 58.724 -1.163 1
1 680 . 14 1 1 A 70 70 GLN CB C 68 28.530 28.507 0.023 1
1 682 . 14 1 1 A 70 70 GLN N N 68 120.410 118.132 2.278 1
1 683 . 14 1 1 A 71 71 ASP HA H 69 4.440 4.833 -0.393 1
1 684 . 14 1 1 A 71 71 ASP C C 69 177.402 179.079 -1.677 1
1 685 . 14 1 1 A 71 71 ASP CA C 69 56.290 57.442 -1.152 1
1 686 . 14 1 1 A 72 72 LEU H H 70 7.952 8.695 -0.743 1
1 687 . 14 1 1 A 72 72 LEU HA H 70 3.775 3.822 -0.047 1
1 697 . 14 1 1 A 72 72 LEU C C 70 178.316 178.655 -0.339 1
1 698 . 14 1 1 A 72 72 LEU CA C 70 56.101 57.955 -1.854 1
1 699 . 14 1 1 A 72 72 LEU CB C 70 39.872 41.331 -1.459 1
1 703 . 14 1 1 A 72 72 LEU N N 70 120.832 121.026 -0.194 1
1 704 . 14 1 1 A 73 73 ASN H H 71 7.723 8.234 -0.511 1
1 705 . 14 1 1 A 73 73 ASN HA H 71 4.270 4.344 -0.074 1
1 708 . 14 1 1 A 73 73 ASN C C 71 178.193 177.682 0.511 1
1 709 . 14 1 1 A 73 73 ASN CA C 71 55.970 56.274 -0.304 1
1 710 . 14 1 1 A 73 73 ASN CB C 71 37.640 39.082 -1.442 1
1 711 . 14 1 1 A 73 73 ASN N N 71 119.295 116.585 2.710 1
1 712 . 14 1 1 A 74 74 TRP H H 72 7.811 8.419 -0.608 1
1 713 . 14 1 1 A 74 74 TRP HA H 72 4.500 4.478 0.022 1
1 720 . 14 1 1 A 74 74 TRP CA C 72 58.480 59.834 -1.354 1
1 721 . 14 1 1 A 74 74 TRP CB C 72 28.920 29.648 -0.728 1
1 727 . 14 1 1 A 74 74 TRP N N 72 121.490 120.326 1.164 1
1 729 . 14 1 1 A 75 75 LEU H H 73 8.412 8.666 -0.254 1
1 730 . 14 1 1 A 75 75 LEU HA H 73 3.290 3.575 -0.285 1
1 739 . 14 1 1 A 75 75 LEU C C 73 178.562 178.646 -0.084 1
1 740 . 14 1 1 A 75 75 LEU CA C 73 58.226 57.554 0.672 1
1 741 . 14 1 1 A 75 75 LEU CB C 73 41.200 41.294 -0.094 1
1 745 . 14 1 1 A 75 75 LEU N N 73 121.065 121.225 -0.160 1
1 746 . 14 1 1 A 76 76 GLN H H 74 7.648 7.940 -0.292 1
1 747 . 14 1 1 A 76 76 GLN HA H 74 3.657 4.089 -0.432 1
1 752 . 14 1 1 A 76 76 GLN C C 74 178.616 177.754 0.862 1
1 753 . 14 1 1 A 76 76 GLN CA C 74 58.777 58.892 -0.115 1
1 754 . 14 1 1 A 76 76 GLN CB C 74 28.163 27.948 0.215 1
1 756 . 14 1 1 A 76 76 GLN N N 74 113.985 118.936 -4.951 1
1 757 . 14 1 1 A 77 77 GLN H H 75 7.465 7.790 -0.325 1
1 758 . 14 1 1 A 77 77 GLN HA H 75 4.134 4.419 -0.285 1
1 761 . 14 1 1 A 77 77 GLN C C 75 176.223 176.066 0.157 1
1 762 . 14 1 1 A 77 77 GLN CA C 75 56.203 56.123 0.080 1
1 763 . 14 1 1 A 77 77 GLN CB C 75 29.524 29.360 0.164 1
1 765 . 14 1 1 A 77 77 GLN N N 75 117.481 116.624 0.857 1
1 766 . 14 1 1 A 78 78 ALA H H 76 7.420 7.263 0.157 1
1 767 . 14 1 1 A 78 78 ALA HA H 76 3.864 4.249 -0.385 1
1 771 . 14 1 1 A 78 78 ALA C C 76 176.733 177.184 -0.451 1
1 772 . 14 1 1 A 78 78 ALA CA C 76 52.529 53.042 -0.513 1
1 773 . 14 1 1 A 78 78 ALA CB C 76 20.124 19.304 0.820 1
1 774 . 14 1 1 A 78 78 ALA N N 76 122.682 123.202 -0.520 1
1 775 . 14 1 1 A 79 79 ASP H H 77 9.028 8.906 0.122 1
1 776 . 14 1 1 A 79 79 ASP HA H 77 4.673 4.650 0.023 1
1 779 . 14 1 1 A 79 79 ASP C C 77 175.740 176.276 -0.536 1
1 780 . 14 1 1 A 79 79 ASP CA C 77 56.383 56.966 -0.583 1
1 781 . 14 1 1 A 79 79 ASP CB C 77 42.826 42.747 0.079 1
1 782 . 14 1 1 A 79 79 ASP N N 77 119.887 123.194 -3.307 1
1 783 . 14 1 1 A 80 80 VAL H H 78 7.379 7.846 -0.467 1
1 784 . 14 1 1 A 80 80 VAL HA H 78 4.340 4.887 -0.547 1
1 792 . 14 1 1 A 80 80 VAL C C 78 175.321 174.423 0.898 1
1 793 . 14 1 1 A 80 80 VAL CA C 78 60.011 60.575 -0.564 1
1 794 . 14 1 1 A 80 80 VAL CB C 78 35.362 36.322 -0.960 1
1 797 . 14 1 1 A 80 80 VAL N N 78 114.152 117.897 -3.745 1
1 798 . 14 1 1 A 81 81 VAL H H 79 8.350 8.139 0.211 1
1 799 . 14 1 1 A 81 81 VAL HA H 79 4.799 4.951 -0.152 1
1 807 . 14 1 1 A 81 81 VAL C C 79 173.095 174.519 -1.424 1
1 808 . 14 1 1 A 81 81 VAL CA C 79 60.775 60.611 0.164 1
1 809 . 14 1 1 A 81 81 VAL CB C 79 32.824 35.344 -2.520 1
1 812 . 14 1 1 A 81 81 VAL N N 79 128.429 125.980 2.449 1
1 813 . 14 1 1 A 82 82 VAL H H 80 8.947 9.051 -0.104 1
1 814 . 14 1 1 A 82 82 VAL HA H 80 4.947 5.036 -0.089 1
1 822 . 14 1 1 A 82 82 VAL C C 80 173.522 174.440 -0.918 1
1 823 . 14 1 1 A 82 82 VAL CA C 80 59.684 59.808 -0.124 1
1 824 . 14 1 1 A 82 82 VAL CB C 80 33.702 36.015 -2.313 1
1 827 . 14 1 1 A 82 82 VAL N N 80 126.957 125.397 1.560 1
1 828 . 14 1 1 A 83 83 ALA H H 81 9.011 8.569 0.442 1
1 829 . 14 1 1 A 83 83 ALA HA H 81 4.938 4.836 0.102 1
1 833 . 14 1 1 A 83 83 ALA C C 81 130.330 175.210 -44.880 1
1 834 . 14 1 1 A 83 83 ALA CA C 81 49.490 51.701 -2.211 1
1 835 . 14 1 1 A 83 83 ALA CB C 81 23.628 22.925 0.703 1
1 836 . 14 1 1 A 83 83 ALA N N 81 128.705 124.810 3.895 1
1 837 . 14 1 1 A 84 84 GLU H H 82 8.922 9.095 -0.173 1
1 838 . 14 1 1 A 84 84 GLU HA H 82 4.937 4.819 0.118 1
1 839 . 14 1 1 A 84 84 GLU C C 82 177.673 175.725 1.948 1
1 840 . 14 1 1 A 84 84 GLU CA C 82 56.714 55.644 1.070 1
1 841 . 14 1 1 A 84 84 GLU CB C 82 29.882 31.605 -1.723 1
1 842 . 14 1 1 A 84 84 GLU N N 82 130.330 123.070 7.260 1
1 843 . 14 1 1 A 85 85 VAL H H 83 8.427 8.930 -0.503 1
1 844 . 14 1 1 A 85 85 VAL HA H 83 4.435 4.922 -0.487 1
1 852 . 14 1 1 A 85 85 VAL C C 83 174.252 175.307 -1.055 1
1 853 . 14 1 1 A 85 85 VAL CA C 83 59.896 59.990 -0.094 1
1 854 . 14 1 1 A 85 85 VAL CB C 83 29.968 34.660 -4.692 1
1 857 . 14 1 1 A 85 85 VAL N N 83 114.212 121.309 -7.097 1
1 858 . 14 1 1 A 86 86 THR H H 84 9.347 9.079 0.268 1
1 859 . 14 1 1 A 86 86 THR HA H 84 4.146 4.847 -0.701 1
1 864 . 14 1 1 A 86 86 THR C C 84 175.751 174.339 1.412 1
1 865 . 14 1 1 A 86 86 THR CA C 84 67.629 63.358 4.271 1
1 866 . 14 1 1 A 86 86 THR CB C 84 66.819 70.165 -3.346 1
1 868 . 14 1 1 A 86 86 THR N N 84 121.640 119.309 2.331 1
1 869 . 14 1 1 A 87 87 GLN H H 85 8.114 7.954 0.160 1
1 870 . 14 1 1 A 87 87 GLN HA H 85 4.736 4.533 0.203 1
1 874 . 14 1 1 A 87 87 GLN CA C 85 51.898 57.100 -5.202 1
1 875 . 14 1 1 A 87 87 GLN CB C 85 27.942 31.496 -3.554 1
1 877 . 14 1 1 A 87 87 GLN N N 85 120.367 119.386 0.981 1
1 878 . 14 1 1 A 88 88 PRO HA H 86 4.061 4.632 -0.571 1
1 885 . 14 1 1 A 88 88 PRO C C 86 176.436 175.833 0.603 1
1 886 . 14 1 1 A 88 88 PRO CA C 86 63.422 62.962 0.460 1
1 887 . 14 1 1 A 88 88 PRO CB C 86 31.925 31.753 0.172 1
1 889 . 14 1 1 A 89 89 SER H H 87 6.044 8.598 -2.554 1
1 890 . 14 1 1 A 89 89 SER HA H 87 4.630 5.255 -0.625 1
1 893 . 14 1 1 A 89 89 SER C C 87 175.612 172.510 3.102 1
1 894 . 14 1 1 A 89 89 SER CA C 87 56.800 56.968 -0.168 1
1 895 . 14 1 1 A 89 89 SER CB C 87 64.196 65.411 -1.215 1
1 896 . 14 1 1 A 89 89 SER N N 87 115.721 118.671 -2.950 1
1 897 . 14 1 1 A 90 90 LEU H H 88 9.702 8.588 1.114 1
1 898 . 14 1 1 A 90 90 LEU HA H 88 4.270 4.507 -0.237 1
1 906 . 14 1 1 A 90 90 LEU C C 88 179.173 176.114 3.059 1
1 907 . 14 1 1 A 90 90 LEU CA C 88 57.402 54.812 2.590 1
1 908 . 14 1 1 A 90 90 LEU CB C 88 43.642 44.629 -0.987 1
1 911 . 14 1 1 A 90 90 LEU N N 88 130.488 122.594 7.894 1
1 912 . 14 1 1 A 91 91 GLY H H 89 8.354 9.001 -0.647 1
1 913 . 14 1 1 A 91 91 GLY HA2 H 89 3.680 3.999 -0.319 1
1 914 . 14 1 1 A 91 91 GLY HA3 H 89 3.584 4.007 -0.423 1
1 915 . 14 1 1 A 91 91 GLY C C 89 175.106 175.387 -0.281 1
1 916 . 14 1 1 A 91 91 GLY CA C 89 47.770 45.789 1.981 1
1 917 . 14 1 1 A 91 91 GLY N N 89 107.522 115.801 -8.279 1
1 918 . 14 1 1 A 92 92 VAL H H 90 7.906 8.003 -0.097 1
1 919 . 14 1 1 A 92 92 VAL HA H 90 3.940 3.849 0.091 1
1 927 . 14 1 1 A 92 92 VAL C C 90 178.467 178.313 0.154 1
1 928 . 14 1 1 A 92 92 VAL CA C 90 65.379 66.164 -0.785 1
1 929 . 14 1 1 A 92 92 VAL CB C 90 31.785 31.537 0.248 1
1 932 . 14 1 1 A 92 92 VAL N N 90 121.741 120.563 1.178 1
1 933 . 14 1 1 A 93 93 GLY H H 91 7.595 8.325 -0.730 1
1 934 . 14 1 1 A 93 93 GLY HA2 H 91 3.628 3.854 -0.226 1
1 935 . 14 1 1 A 93 93 GLY HA3 H 91 3.415 3.863 -0.448 1
1 936 . 14 1 1 A 93 93 GLY C C 91 174.022 175.435 -1.413 1
1 937 . 14 1 1 A 93 93 GLY CA C 91 48.319 47.569 0.750 1
1 938 . 14 1 1 A 93 93 GLY N N 91 104.629 108.048 -3.419 1
1 939 . 14 1 1 A 94 94 TYR H H 92 8.372 8.147 0.225 1
1 940 . 14 1 1 A 94 94 TYR HA H 92 4.046 4.067 -0.021 1
1 943 . 14 1 1 A 94 94 TYR C C 92 177.458 177.557 -0.099 1
1 944 . 14 1 1 A 94 94 TYR CA C 92 61.760 60.844 0.916 1
1 945 . 14 1 1 A 94 94 TYR CB C 92 38.431 38.706 -0.275 1
1 948 . 14 1 1 A 94 94 TYR N N 92 123.383 123.367 0.016 1
1 949 . 14 1 1 A 95 95 GLU H H 93 8.424 8.311 0.113 1
1 950 . 14 1 1 A 95 95 GLU HA H 93 3.421 3.878 -0.457 1
1 951 . 14 1 1 A 95 95 GLU C C 93 178.590 178.775 -0.185 1
1 952 . 14 1 1 A 95 95 GLU CA C 93 60.211 59.045 1.166 1
1 953 . 14 1 1 A 95 95 GLU CB C 93 29.025 29.284 -0.259 1
1 954 . 14 1 1 A 95 95 GLU N N 93 120.181 119.394 0.787 1
1 955 . 14 1 1 A 96 96 LEU H H 94 8.210 8.083 0.127 1
1 956 . 14 1 1 A 96 96 LEU HA H 94 3.830 3.981 -0.151 1
1 964 . 14 1 1 A 96 96 LEU C C 94 179.032 179.085 -0.053 1
1 965 . 14 1 1 A 96 96 LEU CA C 94 57.683 57.843 -0.160 1
1 966 . 14 1 1 A 96 96 LEU CB C 94 41.883 41.837 0.046 1
1 970 . 14 1 1 A 96 96 LEU N N 94 118.091 120.069 -1.978 1
1 971 . 14 1 1 A 97 97 GLY H H 95 8.773 8.140 0.633 1
1 972 . 14 1 1 A 97 97 GLY C C 95 175.344 175.295 0.049 1
1 973 . 14 1 1 A 97 97 GLY CA C 95 47.308 47.050 0.258 1
1 974 . 14 1 1 A 97 97 GLY N N 95 108.085 106.433 1.652 1
1 975 . 14 1 1 A 98 98 ARG H H 96 8.100 8.023 0.077 1
1 976 . 14 1 1 A 98 98 ARG C C 96 179.692 177.996 1.696 1
1 977 . 14 1 1 A 98 98 ARG CA C 96 56.308 58.495 -2.187 1
1 978 . 14 1 1 A 98 98 ARG CB C 96 26.854 29.474 -2.620 1
1 979 . 14 1 1 A 98 98 ARG N N 96 118.156 121.690 -3.534 1
1 980 . 14 1 1 A 99 99 ALA H H 97 8.498 7.587 0.911 1
1 981 . 14 1 1 A 99 99 ALA HA H 97 3.640 3.997 -0.357 1
1 985 . 14 1 1 A 99 99 ALA C C 97 179.650 179.921 -0.271 1
1 986 . 14 1 1 A 99 99 ALA CA C 97 55.166 55.009 0.157 1
1 987 . 14 1 1 A 99 99 ALA CB C 97 18.604 18.248 0.356 1
1 988 . 14 1 1 A 99 99 ALA N N 97 122.310 121.563 0.747 1
1 989 . 14 1 1 A 100 100 VAL H H 98 8.597 8.606 -0.009 1
1 990 . 14 1 1 A 100 100 VAL HA H 98 3.798 3.559 0.239 1
1 998 . 14 1 1 A 100 100 VAL C C 98 180.464 178.104 2.360 1
1 999 . 14 1 1 A 100 100 VAL CA C 98 65.664 66.531 -0.867 1
1 1000 . 14 1 1 A 100 100 VAL CB C 98 31.065 31.575 -0.510 1
1 1003 . 14 1 1 A 100 100 VAL N N 98 120.603 118.814 1.789 1
1 1004 . 14 1 1 A 101 101 ALA H H 99 7.280 7.946 -0.666 1
1 1005 . 14 1 1 A 101 101 ALA HA H 99 3.963 3.974 -0.011 1
1 1009 . 14 1 1 A 101 101 ALA C C 99 179.314 180.281 -0.967 1
1 1010 . 14 1 1 A 101 101 ALA CA C 99 54.367 55.389 -1.022 1
1 1011 . 14 1 1 A 101 101 ALA CB C 99 18.139 18.388 -0.249 1
1 1012 . 14 1 1 A 101 101 ALA N N 99 124.450 121.900 2.550 1
1 1013 . 14 1 1 A 102 102 LEU H H 100 7.200 8.252 -1.052 1
1 1014 . 14 1 1 A 102 102 LEU HA H 100 4.192 4.189 0.003 1
1 1024 . 14 1 1 A 102 102 LEU C C 100 177.306 176.986 0.320 1
1 1025 . 14 1 1 A 102 102 LEU CA C 100 54.808 55.099 -0.291 1
1 1026 . 14 1 1 A 102 102 LEU CB C 100 42.880 42.269 0.611 1
1 1030 . 14 1 1 A 102 102 LEU N N 100 116.834 116.404 0.430 1
1 1031 . 14 1 1 A 103 103 GLY H H 101 7.891 8.025 -0.134 1
1 1032 . 14 1 1 A 103 103 GLY HA2 H 101 3.941 3.890 0.051 1
1 1033 . 14 1 1 A 103 103 GLY HA3 H 101 3.831 3.900 -0.069 1
1 1034 . 14 1 1 A 103 103 GLY C C 101 175.137 174.872 0.265 1
1 1035 . 14 1 1 A 103 103 GLY CA C 101 45.673 46.483 -0.810 1
1 1036 . 14 1 1 A 103 103 GLY N N 101 109.395 108.738 0.657 1
1 1037 . 14 1 1 A 104 104 LYS H H 102 7.337 7.878 -0.541 1
1 1038 . 14 1 1 A 104 104 LYS HA H 102 4.402 4.511 -0.109 1
1 1043 . 14 1 1 A 104 104 LYS CA C 102 52.136 53.973 -1.837 1
1 1044 . 14 1 1 A 104 104 LYS CB C 102 31.045 31.503 -0.458 1
1 1047 . 14 1 1 A 104 104 LYS N N 102 118.954 120.710 -1.756 1
1 1048 . 14 1 1 A 105 105 PRO HA H 103 4.781 4.421 0.360 1
1 1054 . 14 1 1 A 105 105 PRO CA C 103 62.791 63.301 -0.510 1
1 1055 . 14 1 1 A 105 105 PRO CB C 103 30.405 32.038 -1.633 1
1 1058 . 14 1 1 A 106 106 ILE H H 104 8.261 8.474 -0.213 1
1 1059 . 14 1 1 A 106 106 ILE HA H 104 4.680 4.814 -0.134 1
1 1069 . 14 1 1 A 106 106 ILE C C 104 175.543 173.978 1.565 1
1 1070 . 14 1 1 A 106 106 ILE CA C 104 59.362 59.420 -0.058 1
1 1071 . 14 1 1 A 106 106 ILE CB C 104 43.738 41.226 2.512 1
1 1075 . 14 1 1 A 106 106 ILE N N 104 123.509 124.605 -1.096 1
1 1076 . 14 1 1 A 107 107 LEU H H 105 8.584 8.486 0.098 1
1 1077 . 14 1 1 A 107 107 LEU HA H 105 4.243 4.621 -0.378 1
1 1087 . 14 1 1 A 107 107 LEU C C 105 174.204 174.607 -0.403 1
1 1088 . 14 1 1 A 107 107 LEU CA C 105 52.863 53.206 -0.343 1
1 1089 . 14 1 1 A 107 107 LEU CB C 105 42.408 44.568 -2.160 1
1 1093 . 14 1 1 A 107 107 LEU N N 105 131.882 128.992 2.890 1
1 1094 . 14 1 1 A 108 108 CYS H H 106 8.679 9.387 -0.708 1
1 1095 . 14 1 1 A 108 108 CYS HA H 106 5.280 5.383 -0.103 1
1 1099 . 14 1 1 A 108 108 CYS C C 106 173.134 173.557 -0.423 1
1 1100 . 14 1 1 A 108 108 CYS CA C 106 57.290 57.368 -0.078 1
1 1101 . 14 1 1 A 108 108 CYS CB C 106 29.559 30.789 -1.230 1
1 1102 . 14 1 1 A 108 108 CYS N N 106 122.904 125.543 -2.639 1
1 1103 . 14 1 1 A 109 109 LEU H H 107 8.987 8.677 0.310 1
1 1104 . 14 1 1 A 109 109 LEU HA H 107 5.120 5.804 -0.684 1
1 1112 . 14 1 1 A 109 109 LEU C C 107 174.500 175.569 -1.069 1
1 1113 . 14 1 1 A 109 109 LEU CA C 107 53.274 53.847 -0.573 1
1 1114 . 14 1 1 A 109 109 LEU CB C 107 43.450 46.036 -2.586 1
1 1118 . 14 1 1 A 109 109 LEU N N 107 124.653 122.746 1.907 1
1 1119 . 14 1 1 A 110 110 PHE H H 108 8.981 9.144 -0.163 1
1 1120 . 14 1 1 A 110 110 PHE HA H 108 4.846 5.593 -0.747 1
1 1125 . 14 1 1 A 110 110 PHE C C 108 172.231 174.440 -2.209 1
1 1126 . 14 1 1 A 110 110 PHE CA C 108 55.963 57.482 -1.519 1
1 1127 . 14 1 1 A 110 110 PHE CB C 108 43.270 42.347 0.923 1
1 1130 . 14 1 1 A 110 110 PHE N N 108 125.052 121.722 3.330 1
1 1131 . 14 1 1 A 111 111 ARG H H 109 7.461 8.203 -0.742 1
1 1132 . 14 1 1 A 111 111 ARG HA H 109 4.804 4.271 0.533 1
1 1136 . 14 1 1 A 111 111 ARG CA C 109 51.953 54.380 -2.427 1
1 1137 . 14 1 1 A 111 111 ARG CB C 109 30.008 29.798 0.210 1
1 1140 . 14 1 1 A 111 111 ARG N N 109 128.034 126.819 1.215 1
1 1141 . 14 1 1 A 112 112 PRO C C 110 178.675 178.099 0.576 1
1 1142 . 14 1 1 A 112 112 PRO CA C 110 64.024 65.476 -1.452 1
1 1143 . 14 1 1 A 112 112 PRO CB C 110 31.416 31.791 -0.375 1
1 1144 . 14 1 1 A 113 113 GLN H H 111 8.188 8.030 0.158 1
1 1145 . 14 1 1 A 113 113 GLN HA H 111 4.056 4.345 -0.289 1
1 1149 . 14 1 1 A 113 113 GLN C C 111 175.936 175.483 0.453 1
1 1150 . 14 1 1 A 113 113 GLN CA C 111 57.144 54.596 2.548 1
1 1151 . 14 1 1 A 113 113 GLN CB C 111 28.033 29.156 -1.123 1
1 1153 . 14 1 1 A 113 113 GLN N N 111 118.835 116.404 2.431 1
1 1154 . 14 1 1 A 114 114 SER H H 112 7.730 8.856 -1.126 1
1 1155 . 14 1 1 A 114 114 SER HA H 112 4.037 4.062 -0.025 1
1 1158 . 14 1 1 A 114 114 SER C C 112 175.750 174.721 1.029 1
1 1159 . 14 1 1 A 114 114 SER CA C 112 60.154 60.627 -0.473 1
1 1160 . 14 1 1 A 114 114 SER CB C 112 64.282 62.264 2.018 1
1 1161 . 14 1 1 A 114 114 SER N N 112 114.887 114.107 0.780 1
1 1162 . 14 1 1 A 115 115 GLY H H 113 8.005 9.228 -1.223 1
1 1163 . 14 1 1 A 115 115 GLY HA2 H 113 3.712 4.064 -0.352 1
1 1164 . 14 1 1 A 115 115 GLY HA3 H 113 4.130 4.313 -0.183 1
1 1165 . 14 1 1 A 115 115 GLY C C 113 173.945 175.528 -1.583 1
1 1166 . 14 1 1 A 115 115 GLY CA C 113 45.233 46.622 -1.389 1
1 1167 . 14 1 1 A 115 115 GLY N N 113 110.740 107.593 3.147 1
1 1168 . 14 1 1 A 116 116 ARG H H 114 7.665 8.508 -0.843 1
1 1169 . 14 1 1 A 116 116 ARG HA H 114 4.449 4.550 -0.101 1
1 1173 . 14 1 1 A 116 116 ARG C C 114 175.370 175.267 0.103 1
1 1174 . 14 1 1 A 116 116 ARG CA C 114 55.080 55.729 -0.649 1
1 1175 . 14 1 1 A 116 116 ARG CB C 114 31.215 29.858 1.357 1
1 1178 . 14 1 1 A 116 116 ARG N N 114 119.983 118.660 1.323 1
1 1179 . 14 1 1 A 117 117 VAL H H 115 8.409 8.200 0.209 1
1 1180 . 14 1 1 A 117 117 VAL HA H 115 4.184 3.734 0.450 1
1 1188 . 14 1 1 A 117 117 VAL C C 115 175.980 175.872 0.108 1
1 1189 . 14 1 1 A 117 117 VAL CA C 115 61.167 62.346 -1.179 1
1 1190 . 14 1 1 A 117 117 VAL CB C 115 32.931 30.583 2.348 1
1 1193 . 14 1 1 A 117 117 VAL N N 115 122.240 115.463 6.777 1
1 1194 . 14 1 1 A 118 118 LEU H H 116 8.227 7.873 0.354 1
1 1195 . 14 1 1 A 118 118 LEU HA H 116 3.720 4.074 -0.354 1
1 1204 . 14 1 1 A 118 118 LEU C C 116 175.623 176.175 -0.552 1
1 1205 . 14 1 1 A 118 118 LEU CA C 116 54.555 58.068 -3.513 1
1 1206 . 14 1 1 A 118 118 LEU CB C 116 39.292 42.306 -3.014 1
1 1210 . 14 1 1 A 118 118 LEU N N 116 131.481 129.170 2.311 1
1 1211 . 14 1 1 A 119 119 SER H H 117 7.780 7.561 0.219 1
1 1212 . 14 1 1 A 119 119 SER HA H 117 4.060 4.754 -0.694 1
1 1214 . 14 1 1 A 119 119 SER C C 117 175.782 174.123 1.659 1
1 1215 . 14 1 1 A 119 119 SER CA C 117 58.530 57.753 0.777 1
1 1216 . 14 1 1 A 119 119 SER CB C 117 64.785 67.026 -2.241 1
1 1217 . 14 1 1 A 119 119 SER N N 117 118.658 111.386 7.272 1
1 1218 . 14 1 1 A 120 120 ALA H H 118 8.955 8.902 0.053 1
1 1219 . 14 1 1 A 120 120 ALA HA H 118 3.846 4.037 -0.191 1
1 1223 . 14 1 1 A 120 120 ALA C C 118 179.731 179.703 0.028 1
1 1224 . 14 1 1 A 120 120 ALA CA C 118 54.927 55.219 -0.292 1
1 1225 . 14 1 1 A 120 120 ALA CB C 118 18.627 18.151 0.476 1
1 1226 . 14 1 1 A 120 120 ALA N N 118 134.119 127.001 7.118 1
1 1227 . 14 1 1 A 121 121 MET H H 119 7.718 7.945 -0.227 1
1 1228 . 14 1 1 A 121 121 MET HA H 119 4.130 4.296 -0.166 1
1 1235 . 14 1 1 A 121 121 MET C C 119 175.610 178.902 -3.292 1
1 1236 . 14 1 1 A 121 121 MET CA C 119 55.968 57.886 -1.918 1
1 1237 . 14 1 1 A 121 121 MET CB C 119 30.814 31.971 -1.157 1
1 1240 . 14 1 1 A 121 121 MET N N 119 115.424 116.242 -0.818 1
1 1241 . 14 1 1 A 122 122 ILE H H 120 6.451 8.063 -1.612 1
1 1242 . 14 1 1 A 122 122 ILE HA H 120 3.392 3.693 -0.301 1
1 1252 . 14 1 1 A 122 122 ILE C C 120 177.108 178.343 -1.235 1
1 1253 . 14 1 1 A 122 122 ILE CA C 120 59.650 64.837 -5.187 1
1 1254 . 14 1 1 A 122 122 ILE CB C 120 34.640 37.855 -3.215 1
1 1258 . 14 1 1 A 122 122 ILE N N 120 113.418 120.035 -6.617 1
1 1259 . 14 1 1 A 123 123 ARG H H 121 7.540 8.409 -0.869 1
1 1260 . 14 1 1 A 123 123 ARG HA H 121 3.551 4.173 -0.622 1
1 1264 . 14 1 1 A 123 123 ARG C C 121 179.642 179.911 -0.269 1
1 1265 . 14 1 1 A 123 123 ARG CA C 121 59.242 59.059 0.183 1
1 1266 . 14 1 1 A 123 123 ARG CB C 121 29.087 29.928 -0.841 1
1 1269 . 14 1 1 A 123 123 ARG N N 121 116.248 119.737 -3.489 1
1 1270 . 14 1 1 A 124 124 GLY H H 122 8.086 8.619 -0.533 1
1 1271 . 14 1 1 A 124 124 GLY C C 122 172.357 175.732 -3.375 1
1 1272 . 14 1 1 A 124 124 GLY CA C 122 44.836 46.867 -2.031 1
1 1273 . 14 1 1 A 124 124 GLY N N 122 104.381 107.947 -3.566 1
1 1274 . 14 1 1 A 125 125 ALA H H 123 6.411 7.833 -1.422 1
1 1275 . 14 1 1 A 125 125 ALA HA H 123 2.441 3.770 -1.329 1
1 1279 . 14 1 1 A 125 125 ALA C C 123 176.908 177.792 -0.884 1
1 1280 . 14 1 1 A 125 125 ALA CA C 123 51.593 54.663 -3.070 1
1 1281 . 14 1 1 A 125 125 ALA CB C 123 16.997 18.298 -1.301 1
1 1282 . 14 1 1 A 125 125 ALA N N 123 123.136 124.682 -1.546 1
1 1283 . 14 1 1 A 126 126 ALA H H 124 6.190 7.696 -1.506 1
1 1284 . 14 1 1 A 126 126 ALA HA H 124 3.829 4.571 -0.742 1
1 1288 . 14 1 1 A 126 126 ALA C C 124 177.535 176.613 0.922 1
1 1289 . 14 1 1 A 126 126 ALA CA C 124 52.403 51.488 0.915 1
1 1290 . 14 1 1 A 126 126 ALA CB C 124 18.375 19.872 -1.497 1
1 1291 . 14 1 1 A 126 126 ALA N N 124 117.999 117.004 0.995 1
1 1292 . 14 1 1 A 127 127 ASP H H 125 8.877 8.093 0.784 1
1 1293 . 14 1 1 A 127 127 ASP HA H 125 4.665 4.808 -0.143 1
1 1296 . 14 1 1 A 127 127 ASP C C 125 177.795 176.959 0.836 1
1 1297 . 14 1 1 A 127 127 ASP CA C 125 52.855 53.902 -1.047 1
1 1298 . 14 1 1 A 127 127 ASP CB C 125 41.814 43.252 -1.438 1
1 1299 . 14 1 1 A 127 127 ASP N N 125 121.828 118.599 3.229 1
1 1300 . 14 1 1 A 128 128 GLY H H 126 7.954 7.916 0.038 1
1 1301 . 14 1 1 A 128 128 GLY HA2 H 126 3.830 4.153 -0.323 1
1 1302 . 14 1 1 A 128 128 GLY HA3 H 126 4.249 4.234 0.015 1
1 1303 . 14 1 1 A 128 128 GLY C C 126 173.822 174.602 -0.780 1
1 1304 . 14 1 1 A 128 128 GLY CA C 126 45.549 45.423 0.126 1
1 1305 . 14 1 1 A 128 128 GLY N N 126 108.814 107.833 0.981 1
1 1306 . 14 1 1 A 129 129 SER H H 127 8.547 7.720 0.827 1
1 1307 . 14 1 1 A 129 129 SER HA H 127 4.486 4.893 -0.407 1
1 1309 . 14 1 1 A 129 129 SER C C 127 174.178 175.313 -1.135 1
1 1310 . 14 1 1 A 129 129 SER CA C 127 58.653 58.404 0.249 1
1 1311 . 14 1 1 A 129 129 SER CB C 127 63.316 63.873 -0.557 1
1 1312 . 14 1 1 A 129 129 SER N N 127 115.599 113.790 1.809 1
1 1313 . 14 1 1 A 130 130 ARG H H 128 8.795 7.942 0.853 1
1 1314 . 14 1 1 A 130 130 ARG HA H 128 4.160 4.262 -0.102 1
1 1318 . 14 1 1 A 130 130 ARG C C 128 175.518 175.784 -0.266 1
1 1319 . 14 1 1 A 130 130 ARG CA C 128 58.479 57.691 0.788 1
1 1320 . 14 1 1 A 130 130 ARG CB C 128 29.952 31.307 -1.355 1
1 1323 . 14 1 1 A 130 130 ARG N N 128 127.611 121.867 5.744 1
1 1324 . 14 1 1 A 131 131 PHE H H 129 9.315 7.956 1.359 1
1 1325 . 14 1 1 A 131 131 PHE HA H 129 4.878 5.104 -0.226 1
1 1331 . 14 1 1 A 131 131 PHE C C 129 175.058 173.563 1.495 1
1 1332 . 14 1 1 A 131 131 PHE CA C 129 55.953 56.217 -0.264 1
1 1333 . 14 1 1 A 131 131 PHE CB C 129 40.189 41.828 -1.639 1
1 1337 . 14 1 1 A 131 131 PHE N N 129 126.219 118.488 7.731 1
1 1338 . 14 1 1 A 132 132 GLN H H 130 8.160 8.342 -0.182 1
1 1339 . 14 1 1 A 132 132 GLN HA H 130 5.013 5.266 -0.253 1
1 1343 . 14 1 1 A 132 132 GLN CA C 130 54.498 54.468 0.030 1
1 1344 . 14 1 1 A 132 132 GLN CB C 130 32.106 32.998 -0.892 1
1 1346 . 14 1 1 A 132 132 GLN N N 130 125.589 125.628 -0.039 1
1 1347 . 14 1 1 A 133 133 VAL H H 131 8.689 9.030 -0.341 1
1 1348 . 14 1 1 A 133 133 VAL HA H 131 4.529 4.761 -0.232 1
1 1356 . 14 1 1 A 133 133 VAL C C 131 174.441 175.509 -1.068 1
1 1357 . 14 1 1 A 133 133 VAL CA C 131 60.758 61.673 -0.915 1
1 1358 . 14 1 1 A 133 133 VAL CB C 131 32.417 32.379 0.038 1
1 1361 . 14 1 1 A 133 133 VAL N N 131 122.441 123.556 -1.115 1
1 1362 . 14 1 1 A 134 134 TRP H H 132 9.256 9.599 -0.343 1
1 1363 . 14 1 1 A 134 134 TRP HA H 132 5.213 5.347 -0.134 1
1 1371 . 14 1 1 A 134 134 TRP C C 132 174.575 176.267 -1.692 1
1 1372 . 14 1 1 A 134 134 TRP CA C 132 53.859 55.831 -1.972 1
1 1373 . 14 1 1 A 134 134 TRP CB C 132 31.311 31.761 -0.450 1
1 1379 . 14 1 1 A 134 134 TRP N N 132 130.303 128.171 2.132 1
1 1381 . 14 1 1 A 135 135 ASP H H 133 8.237 8.693 -0.456 1
1 1382 . 14 1 1 A 135 135 ASP HA H 133 6.018 5.856 0.162 1
1 1385 . 14 1 1 A 135 135 ASP C C 133 177.020 175.372 1.648 1
1 1386 . 14 1 1 A 135 135 ASP CA C 133 53.321 54.039 -0.718 1
1 1387 . 14 1 1 A 135 135 ASP CB C 133 41.514 42.625 -1.111 1
1 1388 . 14 1 1 A 135 135 ASP N N 133 125.516 122.126 3.390 1
1 1389 . 14 1 1 A 136 136 TYR H H 134 9.058 8.194 0.864 1
1 1390 . 14 1 1 A 136 136 TYR HA H 134 4.970 5.309 -0.339 1
1 1394 . 14 1 1 A 136 136 TYR C C 134 172.324 173.055 -0.731 1
1 1395 . 14 1 1 A 136 136 TYR CA C 134 55.982 56.408 -0.426 1
1 1396 . 14 1 1 A 136 136 TYR CB C 134 42.265 40.360 1.905 1
1 1399 . 14 1 1 A 136 136 TYR N N 134 120.315 117.864 2.451 1
1 1400 . 14 1 1 A 137 137 ALA H H 135 8.521 8.410 0.111 1
1 1401 . 14 1 1 A 137 137 ALA HA H 135 4.280 4.398 -0.118 1
1 1405 . 14 1 1 A 137 137 ALA C C 135 178.561 177.676 0.885 1
1 1406 . 14 1 1 A 137 137 ALA CA C 135 49.550 50.346 -0.796 1
1 1407 . 14 1 1 A 137 137 ALA CB C 135 19.998 22.358 -2.360 1
1 1408 . 14 1 1 A 137 137 ALA N N 135 123.386 122.024 1.362 1
1 1409 . 14 1 1 A 138 138 GLU H H 136 8.678 8.859 -0.181 1
1 1410 . 14 1 1 A 138 138 GLU HA H 136 3.777 4.048 -0.271 1
1 1414 . 14 1 1 A 138 138 GLU C C 136 177.624 178.076 -0.452 1
1 1415 . 14 1 1 A 138 138 GLU CA C 136 60.527 59.287 1.240 1
1 1416 . 14 1 1 A 138 138 GLU CB C 136 29.020 29.254 -0.234 1
1 1418 . 14 1 1 A 138 138 GLU N N 136 121.774 121.846 -0.072 1
1 1419 . 14 1 1 A 139 139 GLY H H 137 8.666 8.313 0.353 1
1 1420 . 14 1 1 A 139 139 GLY HA2 H 137 3.872 3.940 -0.068 1
1 1421 . 14 1 1 A 139 139 GLY HA3 H 137 3.872 3.953 -0.081 1
1 1422 . 14 1 1 A 139 139 GLY C C 137 175.122 174.713 0.409 1
1 1423 . 14 1 1 A 139 139 GLY CA C 137 46.093 45.408 0.685 1
1 1424 . 14 1 1 A 139 139 GLY N N 137 106.053 107.982 -1.929 1
1 1425 . 14 1 1 A 140 140 GLU H H 138 8.305 9.343 -1.038 1
1 1426 . 14 1 1 A 140 140 GLU HA H 138 4.754 4.597 0.157 1
1 1430 . 14 1 1 A 140 140 GLU C C 138 177.819 176.921 0.898 1
1 1431 . 14 1 1 A 140 140 GLU CA C 138 55.049 56.495 -1.446 1
1 1432 . 14 1 1 A 140 140 GLU CB C 138 30.504 31.477 -0.973 1
1 1434 . 14 1 1 A 140 140 GLU N N 138 117.485 118.475 -0.990 1
1 1435 . 14 1 1 A 141 141 VAL H H 139 7.267 7.590 -0.323 1
1 1436 . 14 1 1 A 141 141 VAL HA H 139 3.422 3.920 -0.498 1
1 1444 . 14 1 1 A 141 141 VAL C C 139 175.454 177.472 -2.018 1
1 1445 . 14 1 1 A 141 141 VAL CA C 139 66.769 65.128 1.641 1
1 1446 . 14 1 1 A 141 141 VAL CB C 139 31.377 31.413 -0.036 1
1 1449 . 14 1 1 A 141 141 VAL N N 139 120.764 121.092 -0.328 1
1 1450 . 14 1 1 A 142 142 GLU H H 140 8.620 8.512 0.108 1
1 1451 . 14 1 1 A 142 142 GLU HA H 140 3.592 4.085 -0.493 1
1 1452 . 14 1 1 A 142 142 GLU C C 140 177.320 178.784 -1.464 1
1 1453 . 14 1 1 A 142 142 GLU CA C 140 62.607 58.661 3.946 1
1 1454 . 14 1 1 A 142 142 GLU CB C 140 26.759 29.135 -2.376 1
1 1455 . 14 1 1 A 142 142 GLU N N 140 120.048 119.443 0.605 1
1 1456 . 14 1 1 A 143 143 THR H H 141 7.449 8.060 -0.611 1
1 1457 . 14 1 1 A 143 143 THR HA H 141 4.003 3.968 0.035 1
1 1462 . 14 1 1 A 143 143 THR C C 141 177.258 176.841 0.417 1
1 1463 . 14 1 1 A 143 143 THR CA C 141 65.490 67.005 -1.515 1
1 1464 . 14 1 1 A 143 143 THR CB C 141 68.641 68.092 0.549 1
1 1466 . 14 1 1 A 143 143 THR N N 141 114.073 116.933 -2.860 1
1 1467 . 14 1 1 A 144 144 MET H H 142 7.992 8.080 -0.088 1
1 1468 . 14 1 1 A 144 144 MET HA H 142 4.316 4.362 -0.046 1
1 1476 . 14 1 1 A 144 144 MET C C 142 178.233 178.750 -0.517 1
1 1477 . 14 1 1 A 144 144 MET CA C 142 57.743 59.030 -1.287 1
1 1478 . 14 1 1 A 144 144 MET CB C 142 31.326 32.508 -1.182 1
1 1481 . 14 1 1 A 144 144 MET N N 142 120.595 118.621 1.974 1
1 1482 . 14 1 1 A 145 145 LEU H H 143 7.847 8.139 -0.292 1
1 1483 . 14 1 1 A 145 145 LEU HA H 143 3.919 3.762 0.157 1
1 1491 . 14 1 1 A 145 145 LEU C C 143 178.774 179.733 -0.959 1
1 1492 . 14 1 1 A 145 145 LEU CA C 143 57.877 58.036 -0.159 1
1 1493 . 14 1 1 A 145 145 LEU CB C 143 40.951 40.465 0.486 1
1 1497 . 14 1 1 A 145 145 LEU N N 143 119.410 119.665 -0.255 1
1 1498 . 14 1 1 A 146 146 ASP H H 144 8.431 8.270 0.161 1
1 1499 . 14 1 1 A 146 146 ASP HA H 144 4.312 4.613 -0.301 1
1 1502 . 14 1 1 A 146 146 ASP C C 144 178.129 179.362 -1.233 1
1 1503 . 14 1 1 A 146 146 ASP CA C 144 57.464 57.475 -0.011 1
1 1504 . 14 1 1 A 146 146 ASP CB C 144 39.548 40.524 -0.976 1
1 1505 . 14 1 1 A 146 146 ASP N N 144 119.837 121.011 -1.174 1
1 1506 . 14 1 1 A 147 147 ARG H H 145 7.949 8.478 -0.529 1
1 1507 . 14 1 1 A 147 147 ARG HA H 145 4.050 4.144 -0.094 1
1 1512 . 14 1 1 A 147 147 ARG C C 145 179.547 178.789 0.758 1
1 1513 . 14 1 1 A 147 147 ARG CA C 145 58.972 59.676 -0.704 1
1 1514 . 14 1 1 A 147 147 ARG CB C 145 29.798 30.318 -0.520 1
1 1517 . 14 1 1 A 147 147 ARG N N 145 119.173 119.962 -0.789 1
1 1518 . 14 1 1 A 148 148 TYR H H 146 8.128 8.350 -0.222 1
1 1519 . 14 1 1 A 148 148 TYR HA H 146 3.995 4.397 -0.402 1
1 1524 . 14 1 1 A 148 148 TYR C C 146 178.199 177.575 0.624 1
1 1525 . 14 1 1 A 148 148 TYR CA C 146 62.347 61.564 0.783 1
1 1526 . 14 1 1 A 148 148 TYR CB C 146 37.418 38.088 -0.670 1
1 1529 . 14 1 1 A 148 148 TYR N N 146 120.102 121.658 -1.556 1
1 1530 . 14 1 1 A 149 149 PHE H H 147 8.308 8.415 -0.107 1
1 1531 . 14 1 1 A 149 149 PHE HA H 147 4.013 4.408 -0.395 1
1 1535 . 14 1 1 A 149 149 PHE C C 147 177.574 178.494 -0.920 1
1 1536 . 14 1 1 A 149 149 PHE CA C 147 63.044 61.559 1.485 1
1 1537 . 14 1 1 A 149 149 PHE CB C 147 37.153 38.207 -1.054 1
1 1541 . 14 1 1 A 149 149 PHE N N 147 116.680 118.255 -1.575 1
1 1542 . 14 1 1 A 150 150 GLU H H 148 8.271 8.682 -0.411 1
1 1543 . 14 1 1 A 150 150 GLU HA H 148 4.030 3.984 0.046 1
1 1547 . 14 1 1 A 150 150 GLU C C 148 177.687 179.476 -1.789 1
1 1548 . 14 1 1 A 150 150 GLU CA C 148 58.746 59.660 -0.914 1
1 1549 . 14 1 1 A 150 150 GLU CB C 148 28.847 29.059 -0.212 1
1 1551 . 14 1 1 A 150 150 GLU N N 148 119.973 119.791 0.182 1
1 1552 . 14 1 1 A 151 151 ALA H H 149 6.992 7.863 -0.871 1
1 1553 . 14 1 1 A 151 151 ALA HA H 149 4.217 4.158 0.059 1
1 1557 . 14 1 1 A 151 151 ALA C C 149 178.190 177.768 0.422 1
1 1558 . 14 1 1 A 151 151 ALA CA C 149 52.779 54.732 -1.953 1
1 1559 . 14 1 1 A 151 151 ALA CB C 149 19.087 18.487 0.600 1
1 1560 . 14 1 1 A 151 151 ALA N N 149 118.629 122.333 -3.704 1
1 1561 . 14 1 1 A 152 152 TYR H H 150 7.722 7.545 0.177 1
1 1562 . 14 1 1 A 152 152 TYR HA H 150 4.137 4.826 -0.689 1
1 1567 . 14 1 1 A 152 152 TYR C C 150 175.703 175.891 -0.188 1
1 1568 . 14 1 1 A 152 152 TYR CA C 150 59.260 58.181 1.079 1
1 1569 . 14 1 1 A 152 152 TYR CB C 150 39.165 39.694 -0.529 1
1 1572 . 14 1 1 A 152 152 TYR N N 150 118.767 112.401 6.366 1
1 1573 . 14 1 1 A 153 153 LEU H H 151 7.670 6.326 1.344 1
1 1574 . 14 1 1 A 153 153 LEU HA H 151 4.145 3.478 0.667 1
1 1584 . 14 1 1 A 153 153 LEU CA C 151 54.704 52.783 1.921 1
1 1585 . 14 1 1 A 153 153 LEU CB C 151 40.520 41.922 -1.402 1
1 1589 . 14 1 1 A 153 153 LEU N N 151 122.313 120.084 2.229 1
1 1590 . 14 1 1 A 154 154 PRO HA H 152 4.258 4.590 -0.332 1
1 1597 . 14 1 1 A 154 154 PRO C C 152 177.496 176.638 0.858 1
1 1598 . 14 1 1 A 154 154 PRO CA C 152 63.899 62.865 1.034 1
1 1599 . 14 1 1 A 154 154 PRO CB C 152 31.080 30.505 0.575 1
1 1602 . 14 1 1 A 155 155 GLN H H 153 8.023 8.490 -0.467 1
1 1603 . 14 1 1 A 155 155 GLN HA H 153 4.176 3.857 0.319 1
1 1607 . 14 1 1 A 155 155 GLN C C 153 176.636 175.515 1.121 1
1 1608 . 14 1 1 A 155 155 GLN CA C 153 55.968 57.279 -1.311 1
1 1609 . 14 1 1 A 155 155 GLN CB C 153 28.723 26.686 2.037 1
1 1610 . 14 1 1 A 155 155 GLN N N 153 119.173 113.863 5.310 1
1 1611 . 14 1 1 A 156 156 LYS H H 154 8.113 8.236 -0.123 1
1 1612 . 14 1 1 A 156 156 LYS HA H 154 4.196 3.997 0.199 1
1 1619 . 14 1 1 A 156 156 LYS C C 154 56.493 177.036 -120.543 1
1 1620 . 14 1 1 A 156 156 LYS CA C 154 56.493 57.447 -0.954 1
1 1621 . 14 1 1 A 156 156 LYS CB C 154 32.037 31.325 0.712 1
1 1625 . 14 1 1 A 156 156 LYS N N 154 122.788 115.493 7.295 1
1 1626 . 14 1 1 A 157 157 THR H H 155 8.013 8.410 -0.397 1
1 1627 . 14 1 1 A 157 157 THR HA H 155 4.183 4.126 0.057 1
1 1632 . 14 1 1 A 157 157 THR C C 155 174.580 174.600 -0.020 1
1 1633 . 14 1 1 A 157 157 THR CA C 155 61.958 65.369 -3.411 1
1 1634 . 14 1 1 A 157 157 THR CB C 155 69.665 68.964 0.701 1
1 1636 . 14 1 1 A 157 157 THR N N 155 115.504 111.827 3.677 1
1 1637 . 14 1 1 A 158 158 ALA H H 156 8.170 7.668 0.502 1
1 1638 . 14 1 1 A 158 158 ALA HA H 156 4.220 4.923 -0.703 1
1 1642 . 14 1 1 A 158 158 ALA CA C 156 52.492 50.531 1.961 1
1 1643 . 14 1 1 A 158 158 ALA CB C 156 18.810 23.438 -4.628 1
1 1644 . 14 1 1 A 158 158 ALA N N 156 126.825 121.232 5.593 1
1 1645 . 14 1 1 A 159 159 SER H H 157 7.762 8.559 -0.797 1
1 1646 . 14 1 1 A 159 159 SER CA C 157 58.230 56.662 1.568 1
1 1647 . 14 1 1 A 159 159 SER CB C 157 63.440 65.931 -2.491 1
1 1648 . 14 1 1 A 159 159 SER N N 157 123.078 114.787 8.291 1
1 1649 . 14 1 1 A 162 162 HIS HA H 160 4.845 4.112 0.733 1
1 1652 . 14 1 1 A 162 162 HIS CA C 160 53.590 56.476 -2.886 1
1 1653 . 14 1 1 A 162 162 HIS CB C 160 29.398 27.817 1.581 1
1 1654 . 14 1 1 A 163 163 PRO HA H 161 4.388 4.364 0.024 1
1 1660 . 14 1 1 A 163 163 PRO C C 161 177.018 177.869 -0.851 1
1 1661 . 14 1 1 A 163 163 PRO CA C 161 63.118 64.968 -1.850 1
1 1662 . 14 1 1 A 163 163 PRO CB C 161 31.668 31.831 -0.163 1
1 1665 . 14 1 1 A 164 164 SER H H 162 8.418 8.430 -0.012 1
1 1666 . 14 1 1 A 164 164 SER HA H 162 4.338 4.206 0.132 1
1 1668 . 14 1 1 A 164 164 SER C C 162 173.327 176.566 -3.239 1
1 1669 . 14 1 1 A 164 164 SER CA C 162 58.202 61.106 -2.904 1
1 1670 . 14 1 1 A 164 164 SER CB C 162 64.080 63.090 0.990 1
1 1671 . 14 1 1 A 164 164 SER N N 162 117.485 112.679 4.806 1
1 6 . 15 1 1 A 4 4 ALA H H 2 8.270 7.693 0.577 1
1 7 . 15 1 1 A 4 4 ALA HA H 2 4.212 4.181 0.031 1
1 11 . 15 1 1 A 4 4 ALA C C 2 177.441 178.198 -0.757 1
1 12 . 15 1 1 A 4 4 ALA CA C 2 52.280 54.619 -2.339 1
1 13 . 15 1 1 A 4 4 ALA CB C 2 18.880 18.375 0.505 1
1 14 . 15 1 1 A 4 4 ALA N N 2 126.500 120.206 6.294 1
1 15 . 15 1 1 A 5 5 ALA H H 3 8.251 7.606 0.645 1
1 16 . 15 1 1 A 5 5 ALA HA H 3 4.261 4.386 -0.125 1
1 20 . 15 1 1 A 5 5 ALA C C 3 177.824 177.388 0.436 1
1 21 . 15 1 1 A 5 5 ALA CA C 3 52.347 52.392 -0.045 1
1 22 . 15 1 1 A 5 5 ALA CB C 3 18.869 19.522 -0.653 1
1 23 . 15 1 1 A 5 5 ALA N N 3 124.322 120.819 3.503 1
1 24 . 15 1 1 A 6 6 SER H H 4 8.158 8.581 -0.423 1
1 25 . 15 1 1 A 6 6 SER HA H 4 4.358 4.760 -0.402 1
1 27 . 15 1 1 A 6 6 SER C C 4 175.222 174.718 0.504 1
1 28 . 15 1 1 A 6 6 SER CA C 4 58.438 57.660 0.778 1
1 29 . 15 1 1 A 6 6 SER CB C 4 63.859 64.256 -0.397 1
1 30 . 15 1 1 A 6 6 SER N N 4 115.338 115.093 0.245 1
1 31 . 15 1 1 A 7 7 GLY H H 5 8.265 8.581 -0.316 1
1 32 . 15 1 1 A 7 7 GLY HA2 H 5 3.900 4.345 -0.445 1
1 33 . 15 1 1 A 7 7 GLY C C 5 174.083 171.964 2.119 1
1 34 . 15 1 1 A 7 7 GLY CA C 5 45.113 45.185 -0.072 1
1 35 . 15 1 1 A 7 7 GLY N N 5 111.360 108.404 2.956 1
1 36 . 15 1 1 A 8 8 GLU H H 6 8.100 8.436 -0.336 1
1 37 . 15 1 1 A 8 8 GLU HA H 6 4.209 5.114 -0.905 1
1 41 . 15 1 1 A 8 8 GLU C C 6 176.354 175.780 0.574 1
1 42 . 15 1 1 A 8 8 GLU CA C 6 56.261 55.089 1.172 1
1 43 . 15 1 1 A 8 8 GLU CB C 6 29.830 32.495 -2.665 1
1 45 . 15 1 1 A 8 8 GLU N N 6 121.056 120.520 0.536 1
1 46 . 15 1 1 A 9 9 GLN H H 7 8.287 8.527 -0.240 1
1 47 . 15 1 1 A 9 9 GLN HA H 7 4.247 4.643 -0.396 1
1 51 . 15 1 1 A 9 9 GLN C C 7 172.457 175.547 -3.090 1
1 52 . 15 1 1 A 9 9 GLN CA C 7 55.269 55.478 -0.209 1
1 53 . 15 1 1 A 9 9 GLN CB C 7 29.236 30.318 -1.082 1
1 55 . 15 1 1 A 9 9 GLN N N 7 122.164 124.987 -2.823 1
1 56 . 15 1 1 A 10 10 ALA H H 8 8.368 8.648 -0.280 1
1 57 . 15 1 1 A 10 10 ALA HA H 8 4.509 4.818 -0.309 1
1 61 . 15 1 1 A 10 10 ALA CA C 8 50.341 49.836 0.505 1
1 62 . 15 1 1 A 10 10 ALA CB C 8 18.140 19.896 -1.756 1
1 63 . 15 1 1 A 10 10 ALA N N 8 128.028 123.588 4.440 1
1 64 . 15 1 1 A 11 11 PRO HA H 9 4.437 4.552 -0.115 1
1 70 . 15 1 1 A 11 11 PRO C C 9 176.381 176.315 0.066 1
1 71 . 15 1 1 A 11 11 PRO CA C 9 63.298 62.296 1.002 1
1 72 . 15 1 1 A 11 11 PRO CB C 9 31.776 33.205 -1.429 1
1 75 . 15 1 1 A 12 12 CYS H H 10 8.056 8.326 -0.270 1
1 76 . 15 1 1 A 12 12 CYS HA H 10 4.717 4.848 -0.131 1
1 79 . 15 1 1 A 12 12 CYS C C 10 173.266 173.954 -0.688 1
1 80 . 15 1 1 A 12 12 CYS CA C 10 57.398 57.598 -0.200 1
1 81 . 15 1 1 A 12 12 CYS CB C 10 29.165 29.480 -0.315 1
1 82 . 15 1 1 A 12 12 CYS N N 10 118.295 118.045 0.250 1
1 83 . 15 1 1 A 13 13 SER H H 11 9.815 8.659 1.156 1
1 84 . 15 1 1 A 13 13 SER HA H 11 5.227 5.644 -0.417 1
1 87 . 15 1 1 A 13 13 SER C C 11 173.648 173.111 0.537 1
1 88 . 15 1 1 A 13 13 SER CA C 11 57.630 57.262 0.368 1
1 89 . 15 1 1 A 13 13 SER CB C 11 64.820 66.030 -1.210 1
1 90 . 15 1 1 A 13 13 SER N N 11 122.365 117.582 4.783 1
1 91 . 15 1 1 A 14 14 VAL H H 12 9.352 9.380 -0.028 1
1 92 . 15 1 1 A 14 14 VAL HA H 12 4.696 5.255 -0.559 1
1 100 . 15 1 1 A 14 14 VAL C C 12 173.875 173.605 0.270 1
1 101 . 15 1 1 A 14 14 VAL CA C 12 60.146 60.896 -0.750 1
1 102 . 15 1 1 A 14 14 VAL CB C 12 34.499 35.210 -0.711 1
1 105 . 15 1 1 A 14 14 VAL N N 12 126.378 124.775 1.603 1
1 106 . 15 1 1 A 15 15 TYR H H 13 8.745 8.918 -0.173 1
1 111 . 15 1 1 A 15 15 TYR C C 13 173.345 174.017 -0.672 1
1 112 . 15 1 1 A 15 15 TYR CA C 13 56.186 54.595 1.591 1
1 113 . 15 1 1 A 15 15 TYR CB C 13 40.858 40.509 0.349 1
1 116 . 15 1 1 A 15 15 TYR N N 13 129.472 128.499 0.973 1
1 117 . 15 1 1 A 16 16 PHE H H 14 7.370 8.911 -1.541 1
1 118 . 15 1 1 A 16 16 PHE HA H 14 5.720 5.451 0.269 1
1 123 . 15 1 1 A 16 16 PHE C C 14 174.058 173.928 0.130 1
1 124 . 15 1 1 A 16 16 PHE CA C 14 54.361 56.642 -2.281 1
1 125 . 15 1 1 A 16 16 PHE CB C 14 40.461 41.322 -0.861 1
1 129 . 15 1 1 A 16 16 PHE N N 14 128.263 127.467 0.796 1
1 130 . 15 1 1 A 17 17 CYS H H 15 8.147 8.625 -0.478 1
1 131 . 15 1 1 A 17 17 CYS CA C 15 56.570 57.586 -1.016 1
1 132 . 15 1 1 A 17 17 CYS CB C 15 29.690 29.883 -0.193 1
1 133 . 15 1 1 A 17 17 CYS N N 15 126.188 123.978 2.210 1
1 134 . 15 1 1 A 18 18 GLY HA2 H 16 3.819 3.789 0.030 1
1 135 . 15 1 1 A 18 18 GLY C C 16 173.374 171.802 1.572 1
1 136 . 15 1 1 A 18 18 GLY CA C 16 45.510 45.284 0.226 1
1 137 . 15 1 1 A 19 19 SER H H 17 8.533 8.737 -0.204 1
1 138 . 15 1 1 A 19 19 SER HA H 17 4.505 4.632 -0.127 1
1 139 . 15 1 1 A 19 19 SER CA C 17 58.700 59.310 -0.610 1
1 140 . 15 1 1 A 19 19 SER CB C 17 63.810 63.798 0.012 1
1 141 . 15 1 1 A 19 19 SER N N 17 117.300 116.439 0.861 1
1 142 . 15 1 1 A 20 20 ILE HA H 18 4.309 4.297 0.012 1
1 152 . 15 1 1 A 20 20 ILE CA C 18 61.317 62.423 -1.106 1
1 153 . 15 1 1 A 20 20 ILE CB C 18 38.302 38.154 0.148 1
1 157 . 15 1 1 A 21 21 ARG HA H 19 4.172 4.088 0.084 1
1 160 . 15 1 1 A 21 21 ARG C C 19 177.118 178.380 -1.262 1
1 161 . 15 1 1 A 21 21 ARG CA C 19 56.960 59.310 -2.350 1
1 162 . 15 1 1 A 21 21 ARG CB C 19 29.568 30.092 -0.524 1
1 165 . 15 1 1 A 22 22 GLY H H 20 8.685 8.230 0.455 1
1 166 . 15 1 1 A 22 22 GLY HA2 H 20 3.801 4.025 -0.224 1
1 167 . 15 1 1 A 22 22 GLY HA3 H 20 3.923 4.031 -0.108 1
1 168 . 15 1 1 A 22 22 GLY C C 20 174.814 175.424 -0.610 1
1 169 . 15 1 1 A 22 22 GLY CA C 20 45.289 45.275 0.014 1
1 170 . 15 1 1 A 22 22 GLY N N 20 110.145 107.891 2.254 1
1 171 . 15 1 1 A 23 23 GLY H H 21 8.058 8.430 -0.372 1
1 172 . 15 1 1 A 23 23 GLY HA2 H 21 3.998 3.803 0.195 1
1 173 . 15 1 1 A 23 23 GLY HA3 H 21 4.237 3.849 0.388 1
1 174 . 15 1 1 A 23 23 GLY C C 21 174.762 174.863 -0.101 1
1 175 . 15 1 1 A 23 23 GLY CA C 21 45.025 47.289 -2.264 1
1 176 . 15 1 1 A 23 23 GLY N N 21 109.327 109.064 0.263 1
1 177 . 15 1 1 A 24 24 ARG H H 22 8.376 7.339 1.037 1
1 178 . 15 1 1 A 24 24 ARG HA H 22 4.086 3.907 0.179 1
1 184 . 15 1 1 A 24 24 ARG C C 22 178.178 177.415 0.763 1
1 185 . 15 1 1 A 24 24 ARG CA C 22 57.471 58.410 -0.939 1
1 186 . 15 1 1 A 24 24 ARG CB C 22 29.653 28.888 0.765 1
1 189 . 15 1 1 A 24 24 ARG N N 22 120.861 119.673 1.188 1
1 190 . 15 1 1 A 25 25 GLU H H 23 8.831 8.389 0.442 1
1 191 . 15 1 1 A 25 25 GLU HA H 23 4.015 3.952 0.063 1
1 195 . 15 1 1 A 25 25 GLU C C 23 178.005 179.181 -1.176 1
1 196 . 15 1 1 A 25 25 GLU CA C 23 58.920 59.230 -0.310 1
1 197 . 15 1 1 A 25 25 GLU CB C 23 28.592 29.224 -0.632 1
1 199 . 15 1 1 A 25 25 GLU N N 23 121.243 121.271 -0.028 1
1 200 . 15 1 1 A 26 26 ASP H H 24 7.897 8.111 -0.214 1
1 201 . 15 1 1 A 26 26 ASP HA H 24 4.516 4.194 0.322 1
1 203 . 15 1 1 A 26 26 ASP C C 24 176.455 178.026 -1.571 1
1 204 . 15 1 1 A 26 26 ASP CA C 24 55.122 56.157 -1.035 1
1 205 . 15 1 1 A 26 26 ASP CB C 24 39.888 39.906 -0.018 1
1 206 . 15 1 1 A 26 26 ASP N N 24 119.541 120.035 -0.494 1
1 207 . 15 1 1 A 27 27 GLN H H 25 7.696 8.594 -0.898 1
1 208 . 15 1 1 A 27 27 GLN HA H 25 3.704 3.870 -0.166 1
1 212 . 15 1 1 A 27 27 GLN C C 25 177.016 177.864 -0.848 1
1 213 . 15 1 1 A 27 27 GLN CA C 25 59.501 58.690 0.811 1
1 214 . 15 1 1 A 27 27 GLN CB C 25 27.762 28.668 -0.906 1
1 216 . 15 1 1 A 27 27 GLN N N 25 119.471 119.696 -0.225 1
1 217 . 15 1 1 A 28 28 ALA H H 26 8.227 7.582 0.645 1
1 218 . 15 1 1 A 28 28 ALA HA H 26 4.072 4.279 -0.207 1
1 222 . 15 1 1 A 28 28 ALA C C 26 180.567 179.895 0.672 1
1 223 . 15 1 1 A 28 28 ALA CA C 26 54.627 54.993 -0.366 1
1 224 . 15 1 1 A 28 28 ALA CB C 26 17.355 18.476 -1.121 1
1 225 . 15 1 1 A 28 28 ALA N N 26 122.362 122.388 -0.026 1
1 226 . 15 1 1 A 29 29 LEU H H 27 7.533 7.775 -0.242 1
1 227 . 15 1 1 A 29 29 LEU HA H 27 4.050 4.055 -0.005 1
1 237 . 15 1 1 A 29 29 LEU C C 27 178.752 178.098 0.654 1
1 238 . 15 1 1 A 29 29 LEU CA C 27 57.578 57.659 -0.081 1
1 239 . 15 1 1 A 29 29 LEU CB C 27 40.734 41.718 -0.984 1
1 243 . 15 1 1 A 29 29 LEU N N 27 122.255 119.829 2.426 1
1 244 . 15 1 1 A 30 30 TYR H H 28 8.473 8.216 0.257 1
1 245 . 15 1 1 A 30 30 TYR HA H 28 4.049 3.942 0.107 1
1 250 . 15 1 1 A 30 30 TYR C C 28 177.736 178.655 -0.919 1
1 251 . 15 1 1 A 30 30 TYR CA C 28 59.817 59.973 -0.156 1
1 252 . 15 1 1 A 30 30 TYR CB C 28 36.140 37.027 -0.887 1
1 255 . 15 1 1 A 30 30 TYR N N 28 120.403 118.544 1.859 1
1 256 . 15 1 1 A 31 31 ALA H H 29 8.008 8.308 -0.300 1
1 257 . 15 1 1 A 31 31 ALA HA H 29 4.005 4.073 -0.068 1
1 261 . 15 1 1 A 31 31 ALA C C 29 180.879 179.693 1.186 1
1 262 . 15 1 1 A 31 31 ALA CA C 29 54.914 55.351 -0.437 1
1 263 . 15 1 1 A 31 31 ALA CB C 29 17.375 18.240 -0.865 1
1 264 . 15 1 1 A 31 31 ALA N N 29 120.771 122.914 -2.143 1
1 265 . 15 1 1 A 32 32 ARG H H 30 7.596 7.603 -0.007 1
1 266 . 15 1 1 A 32 32 ARG HA H 30 3.916 4.094 -0.178 1
1 273 . 15 1 1 A 32 32 ARG C C 30 179.919 178.589 1.330 1
1 274 . 15 1 1 A 32 32 ARG CA C 30 59.014 59.112 -0.098 1
1 275 . 15 1 1 A 32 32 ARG CB C 30 30.531 29.793 0.738 1
1 278 . 15 1 1 A 32 32 ARG N N 30 120.365 118.275 2.090 1
1 279 . 15 1 1 A 33 33 ILE H H 31 8.066 8.486 -0.420 1
1 280 . 15 1 1 A 33 33 ILE HA H 31 3.120 3.660 -0.540 1
1 290 . 15 1 1 A 33 33 ILE C C 31 177.051 178.206 -1.155 1
1 291 . 15 1 1 A 33 33 ILE CA C 31 65.757 65.261 0.496 1
1 292 . 15 1 1 A 33 33 ILE CB C 31 36.928 37.758 -0.830 1
1 296 . 15 1 1 A 33 33 ILE N N 31 121.608 119.603 2.005 1
1 297 . 15 1 1 A 34 34 VAL H H 32 8.148 9.031 -0.883 1
1 298 . 15 1 1 A 34 34 VAL HA H 32 2.954 3.520 -0.566 1
1 306 . 15 1 1 A 34 34 VAL C C 32 177.159 178.753 -1.594 1
1 307 . 15 1 1 A 34 34 VAL CA C 32 67.220 66.251 0.969 1
1 308 . 15 1 1 A 34 34 VAL CB C 32 31.039 31.382 -0.343 1
1 311 . 15 1 1 A 34 34 VAL N N 32 119.318 120.172 -0.854 1
1 312 . 15 1 1 A 35 35 SER H H 33 7.826 8.414 -0.588 1
1 313 . 15 1 1 A 35 35 SER HA H 33 3.868 4.209 -0.341 1
1 316 . 15 1 1 A 35 35 SER C C 33 176.779 176.582 0.197 1
1 317 . 15 1 1 A 35 35 SER CA C 33 62.000 61.590 0.410 1
1 318 . 15 1 1 A 35 35 SER CB C 33 62.789 63.053 -0.264 1
1 319 . 15 1 1 A 35 35 SER N N 33 111.936 116.698 -4.762 1
1 320 . 15 1 1 A 36 36 ARG H H 34 7.405 7.526 -0.121 1
1 321 . 15 1 1 A 36 36 ARG HA H 34 4.070 4.097 -0.027 1
1 323 . 15 1 1 A 36 36 ARG C C 34 178.047 178.794 -0.747 1
1 324 . 15 1 1 A 36 36 ARG CA C 34 56.108 59.198 -3.090 1
1 325 . 15 1 1 A 36 36 ARG CB C 34 28.837 30.416 -1.579 1
1 326 . 15 1 1 A 36 36 ARG N N 34 120.909 122.124 -1.215 1
1 327 . 15 1 1 A 37 37 LEU H H 35 8.301 8.354 -0.053 1
1 328 . 15 1 1 A 37 37 LEU HA H 35 3.620 4.194 -0.574 1
1 336 . 15 1 1 A 37 37 LEU C C 35 178.446 179.105 -0.659 1
1 337 . 15 1 1 A 37 37 LEU CA C 35 57.640 58.177 -0.537 1
1 338 . 15 1 1 A 37 37 LEU CB C 35 41.584 41.929 -0.345 1
1 342 . 15 1 1 A 37 37 LEU N N 35 118.567 120.128 -1.561 1
1 343 . 15 1 1 A 38 38 ARG H H 36 7.379 8.086 -0.707 1
1 344 . 15 1 1 A 38 38 ARG HA H 36 4.340 3.990 0.350 1
1 350 . 15 1 1 A 38 38 ARG C C 36 177.895 178.244 -0.349 1
1 351 . 15 1 1 A 38 38 ARG CA C 36 57.785 58.949 -1.164 1
1 352 . 15 1 1 A 38 38 ARG CB C 36 29.775 29.718 0.057 1
1 355 . 15 1 1 A 38 38 ARG N N 36 115.352 119.852 -4.500 1
1 356 . 15 1 1 A 39 39 ARG H H 37 7.240 8.295 -1.055 1
1 357 . 15 1 1 A 39 39 ARG HA H 37 3.743 3.918 -0.175 1
1 363 . 15 1 1 A 39 39 ARG C C 37 176.988 178.239 -1.251 1
1 364 . 15 1 1 A 39 39 ARG CA C 37 57.605 58.923 -1.318 1
1 365 . 15 1 1 A 39 39 ARG CB C 37 28.925 29.709 -0.784 1
1 368 . 15 1 1 A 39 39 ARG N N 37 117.410 118.868 -1.458 1
1 369 . 15 1 1 A 40 40 TYR H H 38 7.296 7.564 -0.268 1
1 370 . 15 1 1 A 40 40 TYR HA H 38 4.319 4.097 0.222 1
1 375 . 15 1 1 A 40 40 TYR C C 38 175.001 176.558 -1.557 1
1 376 . 15 1 1 A 40 40 TYR CA C 38 57.730 60.162 -2.432 1
1 377 . 15 1 1 A 40 40 TYR CB C 38 39.343 38.360 0.983 1
1 380 . 15 1 1 A 40 40 TYR N N 38 116.937 116.521 0.416 1
1 381 . 15 1 1 A 41 41 GLY H H 39 7.325 7.851 -0.526 1
1 382 . 15 1 1 A 41 41 GLY HA2 H 39 3.953 4.156 -0.203 1
1 383 . 15 1 1 A 41 41 GLY C C 39 171.302 173.755 -2.453 1
1 384 . 15 1 1 A 41 41 GLY CA C 39 45.590 44.714 0.876 1
1 385 . 15 1 1 A 41 41 GLY N N 39 105.596 104.317 1.279 1
1 386 . 15 1 1 A 42 42 LYS H H 40 8.186 8.077 0.109 1
1 387 . 15 1 1 A 42 42 LYS HA H 40 4.205 4.162 0.043 1
1 393 . 15 1 1 A 42 42 LYS C C 40 175.672 175.914 -0.242 1
1 394 . 15 1 1 A 42 42 LYS CA C 40 55.241 56.647 -1.406 1
1 395 . 15 1 1 A 42 42 LYS CB C 40 32.889 32.768 0.121 1
1 399 . 15 1 1 A 42 42 LYS N N 40 120.341 122.707 -2.366 1
1 400 . 15 1 1 A 43 43 VAL H H 41 8.610 8.675 -0.065 1
1 401 . 15 1 1 A 43 43 VAL HA H 41 4.416 4.238 0.178 1
1 409 . 15 1 1 A 43 43 VAL C C 41 175.997 175.912 0.085 1
1 410 . 15 1 1 A 43 43 VAL CA C 41 61.331 62.864 -1.533 1
1 411 . 15 1 1 A 43 43 VAL CB C 41 30.573 31.277 -0.704 1
1 414 . 15 1 1 A 43 43 VAL N N 41 127.312 122.963 4.349 1
1 415 . 15 1 1 A 44 44 LEU H H 42 8.894 8.433 0.461 1
1 416 . 15 1 1 A 44 44 LEU HA H 42 4.496 4.065 0.431 1
1 424 . 15 1 1 A 44 44 LEU CA C 42 54.522 55.023 -0.501 1
1 425 . 15 1 1 A 44 44 LEU CB C 42 40.980 42.261 -1.281 1
1 429 . 15 1 1 A 44 44 LEU N N 42 130.261 130.131 0.130 1
1 430 . 15 1 1 A 45 45 THR HA H 43 4.263 3.747 0.516 1
1 435 . 15 1 1 A 45 45 THR CA C 43 61.033 61.931 -0.898 1
1 436 . 15 1 1 A 45 45 THR CB C 43 69.768 67.216 2.552 1
1 440 . 15 1 1 A 46 46 GLU CA C 44 56.411 55.152 1.259 1
1 441 . 15 1 1 A 46 46 GLU CB C 44 29.827 29.292 0.535 1
1 443 . 15 1 1 A 47 47 HIS HA H 45 4.549 4.350 0.199 1
1 447 . 15 1 1 A 47 47 HIS C C 45 174.812 177.067 -2.255 1
1 448 . 15 1 1 A 47 47 HIS CA C 45 56.107 58.365 -2.258 1
1 449 . 15 1 1 A 47 47 HIS CB C 45 29.080 28.911 0.169 1
1 451 . 15 1 1 A 48 48 VAL H H 46 7.826 7.129 0.697 1
1 452 . 15 1 1 A 48 48 VAL HA H 46 4.024 3.458 0.566 1
1 460 . 15 1 1 A 48 48 VAL C C 46 175.697 178.059 -2.362 1
1 461 . 15 1 1 A 48 48 VAL CA C 46 61.841 66.751 -4.910 1
1 462 . 15 1 1 A 48 48 VAL CB C 46 32.600 31.551 1.049 1
1 465 . 15 1 1 A 48 48 VAL N N 46 121.117 121.052 0.065 1
1 466 . 15 1 1 A 49 49 ALA H H 47 8.237 8.053 0.184 1
1 467 . 15 1 1 A 49 49 ALA HA H 47 4.281 4.254 0.027 1
1 471 . 15 1 1 A 49 49 ALA C C 47 177.173 179.891 -2.718 1
1 472 . 15 1 1 A 49 49 ALA CA C 47 52.207 55.557 -3.350 1
1 473 . 15 1 1 A 49 49 ALA CB C 47 19.064 18.131 0.933 1
1 474 . 15 1 1 A 49 49 ALA N N 47 126.817 121.348 5.469 1
1 475 . 15 1 1 A 50 50 ASP H H 48 8.029 8.358 -0.329 1
1 476 . 15 1 1 A 50 50 ASP HA H 48 4.436 4.594 -0.158 1
1 479 . 15 1 1 A 50 50 ASP C C 48 176.124 176.865 -0.741 1
1 480 . 15 1 1 A 50 50 ASP CA C 48 54.447 54.324 0.123 1
1 481 . 15 1 1 A 50 50 ASP CB C 48 40.877 40.291 0.586 1
1 482 . 15 1 1 A 50 50 ASP N N 48 119.687 118.448 1.239 1
1 483 . 15 1 1 A 51 51 ALA H H 49 8.094 7.562 0.532 1
1 484 . 15 1 1 A 51 51 ALA HA H 49 4.134 4.433 -0.299 1
1 488 . 15 1 1 A 51 51 ALA C C 49 177.835 178.886 -1.051 1
1 489 . 15 1 1 A 51 51 ALA CA C 49 52.900 52.762 0.138 1
1 490 . 15 1 1 A 51 51 ALA CB C 49 18.942 19.950 -1.008 1
1 491 . 15 1 1 A 51 51 ALA N N 49 124.400 122.669 1.731 1
1 492 . 15 1 1 A 52 52 GLU H H 50 8.243 7.947 0.296 1
1 493 . 15 1 1 A 52 52 GLU HA H 50 4.152 4.136 0.016 1
1 497 . 15 1 1 A 52 52 GLU C C 50 176.456 177.088 -0.632 1
1 498 . 15 1 1 A 52 52 GLU CA C 50 56.480 59.397 -2.917 1
1 499 . 15 1 1 A 52 52 GLU CB C 50 29.470 29.456 0.014 1
1 501 . 15 1 1 A 52 52 GLU N N 50 118.917 116.261 2.656 1
1 502 . 15 1 1 A 53 53 LEU H H 51 7.839 7.434 0.405 1
1 503 . 15 1 1 A 53 53 LEU HA H 51 4.229 4.315 -0.086 1
1 513 . 15 1 1 A 53 53 LEU C C 51 177.058 176.569 0.489 1
1 514 . 15 1 1 A 53 53 LEU CA C 51 54.625 55.348 -0.723 1
1 515 . 15 1 1 A 53 53 LEU CB C 51 42.125 42.173 -0.048 1
1 519 . 15 1 1 A 53 53 LEU N N 51 122.169 118.172 3.997 1
1 520 . 15 1 1 A 54 54 GLU H H 52 8.104 8.972 -0.868 1
1 521 . 15 1 1 A 54 54 GLU HA H 52 4.470 4.325 0.145 1
1 525 . 15 1 1 A 54 54 GLU CA C 52 54.286 58.144 -3.858 1
1 526 . 15 1 1 A 54 54 GLU CB C 52 29.268 28.596 0.672 1
1 528 . 15 1 1 A 54 54 GLU N N 52 123.040 117.665 5.375 1
1 529 . 15 1 1 A 55 55 PRO HA H 53 4.310 4.595 -0.285 1
1 536 . 15 1 1 A 55 55 PRO C C 53 177.019 176.876 0.143 1
1 537 . 15 1 1 A 55 55 PRO CA C 53 63.075 62.414 0.661 1
1 538 . 15 1 1 A 55 55 PRO CB C 53 31.329 29.965 1.364 1
1 541 . 15 1 1 A 56 56 LEU H H 54 8.263 8.174 0.089 1
1 542 . 15 1 1 A 56 56 LEU HA H 54 4.237 4.474 -0.237 1
1 552 . 15 1 1 A 56 56 LEU C C 54 178.055 176.559 1.496 1
1 553 . 15 1 1 A 56 56 LEU CA C 54 55.018 53.958 1.060 1
1 554 . 15 1 1 A 56 56 LEU CB C 54 41.990 42.971 -0.981 1
1 558 . 15 1 1 A 56 56 LEU N N 54 122.728 120.048 2.680 1
1 559 . 15 1 1 A 57 57 GLY H H 55 8.231 8.555 -0.324 1
1 560 . 15 1 1 A 57 57 GLY HA2 H 55 3.911 4.143 -0.232 1
1 561 . 15 1 1 A 57 57 GLY HA3 H 55 3.808 4.155 -0.347 1
1 562 . 15 1 1 A 57 57 GLY C C 55 174.379 174.026 0.353 1
1 563 . 15 1 1 A 57 57 GLY CA C 55 45.092 44.610 0.482 1
1 564 . 15 1 1 A 57 57 GLY N N 55 110.035 107.706 2.329 1
1 565 . 15 1 1 A 58 58 GLU H H 56 8.241 8.698 -0.457 1
1 566 . 15 1 1 A 58 58 GLU HA H 56 4.136 4.164 -0.028 1
1 570 . 15 1 1 A 58 58 GLU C C 56 176.868 177.123 -0.255 1
1 571 . 15 1 1 A 58 58 GLU CA C 56 56.734 56.214 0.520 1
1 572 . 15 1 1 A 58 58 GLU CB C 56 29.584 30.597 -1.013 1
1 574 . 15 1 1 A 58 58 GLU N N 56 121.173 121.347 -0.174 1
1 575 . 15 1 1 A 59 59 GLU H H 57 8.419 9.027 -0.608 1
1 576 . 15 1 1 A 59 59 GLU HA H 57 4.074 4.228 -0.154 1
1 580 . 15 1 1 A 59 59 GLU C C 57 176.502 175.281 1.221 1
1 581 . 15 1 1 A 59 59 GLU CA C 57 56.842 58.107 -1.265 1
1 582 . 15 1 1 A 59 59 GLU CB C 57 29.267 29.472 -0.205 1
1 584 . 15 1 1 A 59 59 GLU N N 57 121.777 122.398 -0.621 1
1 585 . 15 1 1 A 60 60 ALA H H 58 8.077 8.458 -0.381 1
1 586 . 15 1 1 A 60 60 ALA HA H 58 4.134 4.433 -0.299 1
1 590 . 15 1 1 A 60 60 ALA CA C 58 52.432 52.232 0.200 1
1 591 . 15 1 1 A 60 60 ALA CB C 58 18.743 19.876 -1.133 1
1 592 . 15 1 1 A 60 60 ALA N N 58 125.120 124.804 0.316 1
1 593 . 15 1 1 A 61 61 ALA H H 59 8.041 8.456 -0.415 1
1 594 . 15 1 1 A 61 61 ALA HA H 59 4.131 4.023 0.108 1
1 598 . 15 1 1 A 61 61 ALA C C 59 178.147 177.782 0.365 1
1 599 . 15 1 1 A 61 61 ALA CA C 59 52.586 53.446 -0.860 1
1 600 . 15 1 1 A 61 61 ALA CB C 59 18.692 18.573 0.119 1
1 601 . 15 1 1 A 61 61 ALA N N 59 123.857 123.365 0.492 1
1 602 . 15 1 1 A 62 62 GLY H H 60 8.069 8.406 -0.337 1
1 603 . 15 1 1 A 62 62 GLY HA2 H 60 3.810 4.125 -0.315 1
1 604 . 15 1 1 A 62 62 GLY HA3 H 60 3.888 4.156 -0.268 1
1 605 . 15 1 1 A 62 62 GLY C C 60 174.914 173.253 1.661 1
1 606 . 15 1 1 A 62 62 GLY CA C 60 45.320 46.014 -0.694 1
1 607 . 15 1 1 A 62 62 GLY N N 60 107.924 109.266 -1.342 1
1 608 . 15 1 1 A 63 63 GLY H H 61 8.118 7.717 0.401 1
1 609 . 15 1 1 A 63 63 GLY HA2 H 61 4.008 4.189 -0.181 1
1 610 . 15 1 1 A 63 63 GLY HA3 H 61 3.893 4.246 -0.353 1
1 611 . 15 1 1 A 63 63 GLY C C 61 174.743 175.102 -0.359 1
1 612 . 15 1 1 A 63 63 GLY CA C 61 45.202 45.454 -0.252 1
1 613 . 15 1 1 A 63 63 GLY N N 61 109.441 104.631 4.810 1
1 614 . 15 1 1 A 64 64 ASP H H 62 8.305 8.885 -0.580 1
1 615 . 15 1 1 A 64 64 ASP HA H 62 4.240 4.288 -0.048 1
1 618 . 15 1 1 A 64 64 ASP C C 62 177.571 178.534 -0.963 1
1 619 . 15 1 1 A 64 64 ASP CA C 62 57.210 57.320 -0.110 1
1 620 . 15 1 1 A 64 64 ASP CB C 62 40.142 40.242 -0.100 1
1 621 . 15 1 1 A 64 64 ASP N N 62 121.568 122.581 -1.013 1
1 622 . 15 1 1 A 65 65 GLN H H 63 8.337 8.348 -0.011 1
1 623 . 15 1 1 A 65 65 GLN HA H 63 4.138 4.074 0.064 1
1 628 . 15 1 1 A 65 65 GLN C C 63 177.490 178.742 -1.252 1
1 629 . 15 1 1 A 65 65 GLN CA C 63 58.643 58.908 -0.265 1
1 630 . 15 1 1 A 65 65 GLN CB C 63 27.803 28.483 -0.680 1
1 632 . 15 1 1 A 65 65 GLN N N 63 119.700 118.215 1.485 1
1 633 . 15 1 1 A 66 66 PHE H H 64 7.658 8.032 -0.374 1
1 634 . 15 1 1 A 66 66 PHE HA H 64 4.170 4.187 -0.017 1
1 638 . 15 1 1 A 66 66 PHE C C 64 176.872 177.344 -0.472 1
1 639 . 15 1 1 A 66 66 PHE CA C 64 60.158 61.357 -1.199 1
1 640 . 15 1 1 A 66 66 PHE CB C 64 38.490 39.243 -0.753 1
1 643 . 15 1 1 A 66 66 PHE N N 64 121.036 120.226 0.810 1
1 644 . 15 1 1 A 67 67 ILE H H 65 7.646 9.403 -1.757 1
1 645 . 15 1 1 A 67 67 ILE HA H 65 3.426 3.599 -0.173 1
1 655 . 15 1 1 A 67 67 ILE CA C 65 63.377 65.916 -2.539 1
1 656 . 15 1 1 A 67 67 ILE CB C 65 37.057 37.904 -0.847 1
1 660 . 15 1 1 A 67 67 ILE N N 65 121.372 120.224 1.148 1
1 661 . 15 1 1 A 68 68 HIS H H 66 7.945 8.121 -0.176 1
1 662 . 15 1 1 A 68 68 HIS HA H 66 4.005 4.216 -0.211 1
1 665 . 15 1 1 A 68 68 HIS CA C 66 59.915 59.066 0.849 1
1 668 . 15 1 1 A 68 68 HIS N N 66 120.036 119.375 0.661 1
1 669 . 15 1 1 A 69 69 GLU HA H 67 3.677 3.847 -0.170 1
1 673 . 15 1 1 A 69 69 GLU CA C 67 58.490 59.543 -1.053 1
1 674 . 15 1 1 A 69 69 GLU CB C 67 29.290 28.920 0.370 1
1 676 . 15 1 1 A 70 70 GLN H H 68 8.017 7.670 0.347 1
1 677 . 15 1 1 A 70 70 GLN HA H 68 3.426 3.919 -0.493 1
1 678 . 15 1 1 A 70 70 GLN C C 68 179.280 178.758 0.522 1
1 679 . 15 1 1 A 70 70 GLN CA C 68 57.561 58.444 -0.883 1
1 680 . 15 1 1 A 70 70 GLN CB C 68 28.530 28.130 0.400 1
1 682 . 15 1 1 A 70 70 GLN N N 68 120.410 118.668 1.742 1
1 683 . 15 1 1 A 71 71 ASP HA H 69 4.440 4.961 -0.521 1
1 684 . 15 1 1 A 71 71 ASP C C 69 177.402 178.855 -1.453 1
1 685 . 15 1 1 A 71 71 ASP CA C 69 56.290 57.302 -1.012 1
1 686 . 15 1 1 A 72 72 LEU H H 70 7.952 8.132 -0.180 1
1 687 . 15 1 1 A 72 72 LEU HA H 70 3.775 3.861 -0.086 1
1 697 . 15 1 1 A 72 72 LEU C C 70 178.316 177.980 0.336 1
1 698 . 15 1 1 A 72 72 LEU CA C 70 56.101 57.408 -1.307 1
1 699 . 15 1 1 A 72 72 LEU CB C 70 39.872 41.051 -1.179 1
1 703 . 15 1 1 A 72 72 LEU N N 70 120.832 120.499 0.333 1
1 704 . 15 1 1 A 73 73 ASN H H 71 7.723 8.070 -0.347 1
1 705 . 15 1 1 A 73 73 ASN HA H 71 4.270 4.264 0.006 1
1 708 . 15 1 1 A 73 73 ASN C C 71 178.193 177.635 0.558 1
1 709 . 15 1 1 A 73 73 ASN CA C 71 55.970 56.204 -0.234 1
1 710 . 15 1 1 A 73 73 ASN CB C 71 37.640 39.124 -1.484 1
1 711 . 15 1 1 A 73 73 ASN N N 71 119.295 116.923 2.372 1
1 712 . 15 1 1 A 74 74 TRP H H 72 7.811 8.103 -0.292 1
1 713 . 15 1 1 A 74 74 TRP HA H 72 4.500 4.454 0.046 1
1 720 . 15 1 1 A 74 74 TRP CA C 72 58.480 60.136 -1.656 1
1 721 . 15 1 1 A 74 74 TRP CB C 72 28.920 29.128 -0.208 1
1 727 . 15 1 1 A 74 74 TRP N N 72 121.490 119.575 1.915 1
1 729 . 15 1 1 A 75 75 LEU H H 73 8.412 8.095 0.317 1
1 730 . 15 1 1 A 75 75 LEU HA H 73 3.290 3.262 0.028 1
1 739 . 15 1 1 A 75 75 LEU C C 73 178.562 178.328 0.234 1
1 740 . 15 1 1 A 75 75 LEU CA C 73 58.226 57.512 0.714 1
1 741 . 15 1 1 A 75 75 LEU CB C 73 41.200 40.863 0.337 1
1 745 . 15 1 1 A 75 75 LEU N N 73 121.065 121.925 -0.860 1
1 746 . 15 1 1 A 76 76 GLN H H 74 7.648 7.924 -0.276 1
1 747 . 15 1 1 A 76 76 GLN HA H 74 3.657 4.148 -0.491 1
1 752 . 15 1 1 A 76 76 GLN C C 74 178.616 176.912 1.704 1
1 753 . 15 1 1 A 76 76 GLN CA C 74 58.777 57.237 1.540 1
1 754 . 15 1 1 A 76 76 GLN CB C 74 28.163 28.698 -0.535 1
1 756 . 15 1 1 A 76 76 GLN N N 74 113.985 116.789 -2.804 1
1 757 . 15 1 1 A 77 77 GLN H H 75 7.465 7.771 -0.306 1
1 758 . 15 1 1 A 77 77 GLN HA H 75 4.134 4.440 -0.306 1
1 761 . 15 1 1 A 77 77 GLN C C 75 176.223 176.155 0.068 1
1 762 . 15 1 1 A 77 77 GLN CA C 75 56.203 55.471 0.732 1
1 763 . 15 1 1 A 77 77 GLN CB C 75 29.524 28.830 0.694 1
1 765 . 15 1 1 A 77 77 GLN N N 75 117.481 119.018 -1.537 1
1 766 . 15 1 1 A 78 78 ALA H H 76 7.420 7.240 0.180 1
1 767 . 15 1 1 A 78 78 ALA HA H 76 3.864 4.261 -0.397 1
1 771 . 15 1 1 A 78 78 ALA C C 76 176.733 177.601 -0.868 1
1 772 . 15 1 1 A 78 78 ALA CA C 76 52.529 52.895 -0.366 1
1 773 . 15 1 1 A 78 78 ALA CB C 76 20.124 19.218 0.906 1
1 774 . 15 1 1 A 78 78 ALA N N 76 122.682 123.233 -0.551 1
1 775 . 15 1 1 A 79 79 ASP H H 77 9.028 8.841 0.187 1
1 776 . 15 1 1 A 79 79 ASP HA H 77 4.673 4.514 0.159 1
1 779 . 15 1 1 A 79 79 ASP C C 77 175.740 176.465 -0.725 1
1 780 . 15 1 1 A 79 79 ASP CA C 77 56.383 57.519 -1.136 1
1 781 . 15 1 1 A 79 79 ASP CB C 77 42.826 42.117 0.709 1
1 782 . 15 1 1 A 79 79 ASP N N 77 119.887 122.949 -3.062 1
1 783 . 15 1 1 A 80 80 VAL H H 78 7.379 7.821 -0.442 1
1 784 . 15 1 1 A 80 80 VAL HA H 78 4.340 4.815 -0.475 1
1 792 . 15 1 1 A 80 80 VAL C C 78 175.321 174.339 0.982 1
1 793 . 15 1 1 A 80 80 VAL CA C 78 60.011 60.417 -0.406 1
1 794 . 15 1 1 A 80 80 VAL CB C 78 35.362 36.573 -1.211 1
1 797 . 15 1 1 A 80 80 VAL N N 78 114.152 117.805 -3.653 1
1 798 . 15 1 1 A 81 81 VAL H H 79 8.350 8.427 -0.077 1
1 799 . 15 1 1 A 81 81 VAL HA H 79 4.799 4.955 -0.156 1
1 807 . 15 1 1 A 81 81 VAL C C 79 173.095 174.637 -1.542 1
1 808 . 15 1 1 A 81 81 VAL CA C 79 60.775 60.656 0.119 1
1 809 . 15 1 1 A 81 81 VAL CB C 79 32.824 35.806 -2.982 1
1 812 . 15 1 1 A 81 81 VAL N N 79 128.429 125.833 2.596 1
1 813 . 15 1 1 A 82 82 VAL H H 80 8.947 9.491 -0.544 1
1 814 . 15 1 1 A 82 82 VAL HA H 80 4.947 4.990 -0.043 1
1 822 . 15 1 1 A 82 82 VAL C C 80 173.522 174.193 -0.671 1
1 823 . 15 1 1 A 82 82 VAL CA C 80 59.684 59.815 -0.131 1
1 824 . 15 1 1 A 82 82 VAL CB C 80 33.702 36.147 -2.445 1
1 827 . 15 1 1 A 82 82 VAL N N 80 126.957 125.335 1.622 1
1 828 . 15 1 1 A 83 83 ALA H H 81 9.011 8.610 0.401 1
1 829 . 15 1 1 A 83 83 ALA HA H 81 4.938 4.914 0.024 1
1 833 . 15 1 1 A 83 83 ALA C C 81 130.330 176.098 -45.768 1
1 834 . 15 1 1 A 83 83 ALA CA C 81 49.490 51.679 -2.189 1
1 835 . 15 1 1 A 83 83 ALA CB C 81 23.628 22.819 0.809 1
1 836 . 15 1 1 A 83 83 ALA N N 81 128.705 124.277 4.428 1
1 837 . 15 1 1 A 84 84 GLU H H 82 8.922 8.798 0.124 1
1 838 . 15 1 1 A 84 84 GLU HA H 82 4.937 4.811 0.126 1
1 839 . 15 1 1 A 84 84 GLU C C 82 177.673 175.650 2.023 1
1 840 . 15 1 1 A 84 84 GLU CA C 82 56.714 55.931 0.783 1
1 841 . 15 1 1 A 84 84 GLU CB C 82 29.882 31.283 -1.401 1
1 842 . 15 1 1 A 84 84 GLU N N 82 130.330 122.439 7.891 1
1 843 . 15 1 1 A 85 85 VAL H H 83 8.427 9.015 -0.588 1
1 844 . 15 1 1 A 85 85 VAL HA H 83 4.435 5.149 -0.714 1
1 852 . 15 1 1 A 85 85 VAL C C 83 174.252 175.362 -1.110 1
1 853 . 15 1 1 A 85 85 VAL CA C 83 59.896 61.027 -1.131 1
1 854 . 15 1 1 A 85 85 VAL CB C 83 29.968 34.441 -4.473 1
1 857 . 15 1 1 A 85 85 VAL N N 83 114.212 123.767 -9.555 1
1 858 . 15 1 1 A 86 86 THR H H 84 9.347 9.011 0.336 1
1 859 . 15 1 1 A 86 86 THR HA H 84 4.146 4.884 -0.738 1
1 864 . 15 1 1 A 86 86 THR C C 84 175.751 174.145 1.606 1
1 865 . 15 1 1 A 86 86 THR CA C 84 67.629 63.096 4.533 1
1 866 . 15 1 1 A 86 86 THR CB C 84 66.819 70.397 -3.578 1
1 868 . 15 1 1 A 86 86 THR N N 84 121.640 118.442 3.198 1
1 869 . 15 1 1 A 87 87 GLN H H 85 8.114 8.409 -0.295 1
1 870 . 15 1 1 A 87 87 GLN HA H 85 4.736 4.344 0.392 1
1 874 . 15 1 1 A 87 87 GLN CA C 85 51.898 58.770 -6.872 1
1 875 . 15 1 1 A 87 87 GLN CB C 85 27.942 28.883 -0.941 1
1 877 . 15 1 1 A 87 87 GLN N N 85 120.367 121.597 -1.230 1
1 878 . 15 1 1 A 88 88 PRO HA H 86 4.061 4.607 -0.546 1
1 885 . 15 1 1 A 88 88 PRO C C 86 176.436 175.579 0.857 1
1 886 . 15 1 1 A 88 88 PRO CA C 86 63.422 62.750 0.672 1
1 887 . 15 1 1 A 88 88 PRO CB C 86 31.925 33.182 -1.257 1
1 889 . 15 1 1 A 89 89 SER H H 87 6.044 9.252 -3.208 1
1 890 . 15 1 1 A 89 89 SER HA H 87 4.630 4.792 -0.162 1
1 893 . 15 1 1 A 89 89 SER C C 87 175.612 172.646 2.966 1
1 894 . 15 1 1 A 89 89 SER CA C 87 56.800 56.620 0.180 1
1 895 . 15 1 1 A 89 89 SER CB C 87 64.196 64.970 -0.774 1
1 896 . 15 1 1 A 89 89 SER N N 87 115.721 116.224 -0.503 1
1 897 . 15 1 1 A 90 90 LEU H H 88 9.702 8.620 1.082 1
1 898 . 15 1 1 A 90 90 LEU HA H 88 4.270 3.791 0.479 1
1 906 . 15 1 1 A 90 90 LEU C C 88 179.173 178.009 1.164 1
1 907 . 15 1 1 A 90 90 LEU CA C 88 57.402 57.491 -0.089 1
1 908 . 15 1 1 A 90 90 LEU CB C 88 43.642 41.801 1.841 1
1 911 . 15 1 1 A 90 90 LEU N N 88 130.488 123.807 6.681 1
1 912 . 15 1 1 A 91 91 GLY H H 89 8.354 8.934 -0.580 1
1 913 . 15 1 1 A 91 91 GLY HA2 H 89 3.680 4.007 -0.327 1
1 914 . 15 1 1 A 91 91 GLY HA3 H 89 3.584 4.011 -0.427 1
1 915 . 15 1 1 A 91 91 GLY C C 89 175.106 175.656 -0.550 1
1 916 . 15 1 1 A 91 91 GLY CA C 89 47.770 45.311 2.459 1
1 917 . 15 1 1 A 91 91 GLY N N 89 107.522 113.450 -5.928 1
1 918 . 15 1 1 A 92 92 VAL H H 90 7.906 7.881 0.025 1
1 919 . 15 1 1 A 92 92 VAL HA H 90 3.940 3.833 0.107 1
1 927 . 15 1 1 A 92 92 VAL C C 90 178.467 178.377 0.090 1
1 928 . 15 1 1 A 92 92 VAL CA C 90 65.379 66.009 -0.630 1
1 929 . 15 1 1 A 92 92 VAL CB C 90 31.785 31.783 0.002 1
1 932 . 15 1 1 A 92 92 VAL N N 90 121.741 120.057 1.684 1
1 933 . 15 1 1 A 93 93 GLY H H 91 7.595 8.265 -0.670 1
1 934 . 15 1 1 A 93 93 GLY HA2 H 91 3.628 3.763 -0.135 1
1 935 . 15 1 1 A 93 93 GLY HA3 H 91 3.415 3.763 -0.348 1
1 936 . 15 1 1 A 93 93 GLY C C 91 174.022 175.413 -1.391 1
1 937 . 15 1 1 A 93 93 GLY CA C 91 48.319 47.404 0.915 1
1 938 . 15 1 1 A 93 93 GLY N N 91 104.629 107.509 -2.880 1
1 939 . 15 1 1 A 94 94 TYR H H 92 8.372 8.134 0.238 1
1 940 . 15 1 1 A 94 94 TYR HA H 92 4.046 4.041 0.005 1
1 943 . 15 1 1 A 94 94 TYR C C 92 177.458 177.817 -0.359 1
1 944 . 15 1 1 A 94 94 TYR CA C 92 61.760 60.696 1.064 1
1 945 . 15 1 1 A 94 94 TYR CB C 92 38.431 38.464 -0.033 1
1 948 . 15 1 1 A 94 94 TYR N N 92 123.383 123.522 -0.139 1
1 949 . 15 1 1 A 95 95 GLU H H 93 8.424 8.050 0.374 1
1 950 . 15 1 1 A 95 95 GLU HA H 93 3.421 3.958 -0.537 1
1 951 . 15 1 1 A 95 95 GLU C C 93 178.590 179.542 -0.952 1
1 952 . 15 1 1 A 95 95 GLU CA C 93 60.211 59.147 1.064 1
1 953 . 15 1 1 A 95 95 GLU CB C 93 29.025 29.287 -0.262 1
1 954 . 15 1 1 A 95 95 GLU N N 93 120.181 118.439 1.742 1
1 955 . 15 1 1 A 96 96 LEU H H 94 8.210 8.128 0.082 1
1 956 . 15 1 1 A 96 96 LEU HA H 94 3.830 3.980 -0.150 1
1 964 . 15 1 1 A 96 96 LEU C C 94 179.032 179.559 -0.527 1
1 965 . 15 1 1 A 96 96 LEU CA C 94 57.683 58.400 -0.717 1
1 966 . 15 1 1 A 96 96 LEU CB C 94 41.883 41.997 -0.114 1
1 970 . 15 1 1 A 96 96 LEU N N 94 118.091 121.072 -2.981 1
1 971 . 15 1 1 A 97 97 GLY H H 95 8.773 8.342 0.431 1
1 972 . 15 1 1 A 97 97 GLY C C 95 175.344 176.240 -0.896 1
1 973 . 15 1 1 A 97 97 GLY CA C 95 47.308 47.114 0.194 1
1 974 . 15 1 1 A 97 97 GLY N N 95 108.085 105.425 2.660 1
1 975 . 15 1 1 A 98 98 ARG H H 96 8.100 7.953 0.147 1
1 976 . 15 1 1 A 98 98 ARG C C 96 179.692 178.891 0.801 1
1 977 . 15 1 1 A 98 98 ARG CA C 96 56.308 59.667 -3.359 1
1 978 . 15 1 1 A 98 98 ARG CB C 96 26.854 29.950 -3.096 1
1 979 . 15 1 1 A 98 98 ARG N N 96 118.156 122.087 -3.931 1
1 980 . 15 1 1 A 99 99 ALA H H 97 8.498 7.604 0.894 1
1 981 . 15 1 1 A 99 99 ALA HA H 97 3.640 4.013 -0.373 1
1 985 . 15 1 1 A 99 99 ALA C C 97 179.650 180.109 -0.459 1
1 986 . 15 1 1 A 99 99 ALA CA C 97 55.166 54.978 0.188 1
1 987 . 15 1 1 A 99 99 ALA CB C 97 18.604 18.450 0.154 1
1 988 . 15 1 1 A 99 99 ALA N N 97 122.310 121.997 0.313 1
1 989 . 15 1 1 A 100 100 VAL H H 98 8.597 8.136 0.461 1
1 990 . 15 1 1 A 100 100 VAL HA H 98 3.798 3.527 0.271 1
1 998 . 15 1 1 A 100 100 VAL C C 98 180.464 178.222 2.242 1
1 999 . 15 1 1 A 100 100 VAL CA C 98 65.664 66.862 -1.198 1
1 1000 . 15 1 1 A 100 100 VAL CB C 98 31.065 31.656 -0.591 1
1 1003 . 15 1 1 A 100 100 VAL N N 98 120.603 119.014 1.589 1
1 1004 . 15 1 1 A 101 101 ALA H H 99 7.280 7.888 -0.608 1
1 1005 . 15 1 1 A 101 101 ALA HA H 99 3.963 4.006 -0.043 1
1 1009 . 15 1 1 A 101 101 ALA C C 99 179.314 180.503 -1.189 1
1 1010 . 15 1 1 A 101 101 ALA CA C 99 54.367 55.256 -0.889 1
1 1011 . 15 1 1 A 101 101 ALA CB C 99 18.139 18.529 -0.390 1
1 1012 . 15 1 1 A 101 101 ALA N N 99 124.450 122.039 2.411 1
1 1013 . 15 1 1 A 102 102 LEU H H 100 7.200 8.308 -1.108 1
1 1014 . 15 1 1 A 102 102 LEU HA H 100 4.192 4.169 0.023 1
1 1024 . 15 1 1 A 102 102 LEU C C 100 177.306 176.895 0.411 1
1 1025 . 15 1 1 A 102 102 LEU CA C 100 54.808 55.181 -0.373 1
1 1026 . 15 1 1 A 102 102 LEU CB C 100 42.880 42.325 0.555 1
1 1030 . 15 1 1 A 102 102 LEU N N 100 116.834 116.378 0.456 1
1 1031 . 15 1 1 A 103 103 GLY H H 101 7.891 7.785 0.106 1
1 1032 . 15 1 1 A 103 103 GLY HA2 H 101 3.941 3.938 0.003 1
1 1033 . 15 1 1 A 103 103 GLY HA3 H 101 3.831 3.947 -0.116 1
1 1034 . 15 1 1 A 103 103 GLY C C 101 175.137 174.644 0.493 1
1 1035 . 15 1 1 A 103 103 GLY CA C 101 45.673 46.154 -0.481 1
1 1036 . 15 1 1 A 103 103 GLY N N 101 109.395 108.097 1.298 1
1 1037 . 15 1 1 A 104 104 LYS H H 102 7.337 7.516 -0.179 1
1 1038 . 15 1 1 A 104 104 LYS HA H 102 4.402 4.481 -0.079 1
1 1043 . 15 1 1 A 104 104 LYS CA C 102 52.136 53.239 -1.103 1
1 1044 . 15 1 1 A 104 104 LYS CB C 102 31.045 32.698 -1.653 1
1 1047 . 15 1 1 A 104 104 LYS N N 102 118.954 120.919 -1.965 1
1 1048 . 15 1 1 A 105 105 PRO HA H 103 4.781 4.365 0.416 1
1 1054 . 15 1 1 A 105 105 PRO CA C 103 62.791 63.311 -0.520 1
1 1055 . 15 1 1 A 105 105 PRO CB C 103 30.405 32.027 -1.622 1
1 1058 . 15 1 1 A 106 106 ILE H H 104 8.261 8.659 -0.398 1
1 1059 . 15 1 1 A 106 106 ILE HA H 104 4.680 4.198 0.482 1
1 1069 . 15 1 1 A 106 106 ILE C C 104 175.543 173.706 1.837 1
1 1070 . 15 1 1 A 106 106 ILE CA C 104 59.362 60.185 -0.823 1
1 1071 . 15 1 1 A 106 106 ILE CB C 104 43.738 37.463 6.275 1
1 1075 . 15 1 1 A 106 106 ILE N N 104 123.509 124.348 -0.839 1
1 1076 . 15 1 1 A 107 107 LEU H H 105 8.584 8.374 0.210 1
1 1077 . 15 1 1 A 107 107 LEU HA H 105 4.243 4.277 -0.034 1
1 1087 . 15 1 1 A 107 107 LEU C C 105 174.204 174.289 -0.085 1
1 1088 . 15 1 1 A 107 107 LEU CA C 105 52.863 53.339 -0.476 1
1 1089 . 15 1 1 A 107 107 LEU CB C 105 42.408 42.595 -0.187 1
1 1093 . 15 1 1 A 107 107 LEU N N 105 131.882 129.781 2.101 1
1 1094 . 15 1 1 A 108 108 CYS H H 106 8.679 8.555 0.124 1
1 1095 . 15 1 1 A 108 108 CYS HA H 106 5.280 5.367 -0.087 1
1 1099 . 15 1 1 A 108 108 CYS C C 106 173.134 173.318 -0.184 1
1 1100 . 15 1 1 A 108 108 CYS CA C 106 57.290 57.262 0.028 1
1 1101 . 15 1 1 A 108 108 CYS CB C 106 29.559 30.667 -1.108 1
1 1102 . 15 1 1 A 108 108 CYS N N 106 122.904 125.820 -2.916 1
1 1103 . 15 1 1 A 109 109 LEU H H 107 8.987 8.619 0.368 1
1 1104 . 15 1 1 A 109 109 LEU HA H 107 5.120 5.766 -0.646 1
1 1112 . 15 1 1 A 109 109 LEU C C 107 174.500 175.808 -1.308 1
1 1113 . 15 1 1 A 109 109 LEU CA C 107 53.274 53.681 -0.407 1
1 1114 . 15 1 1 A 109 109 LEU CB C 107 43.450 45.476 -2.026 1
1 1118 . 15 1 1 A 109 109 LEU N N 107 124.653 123.419 1.234 1
1 1119 . 15 1 1 A 110 110 PHE H H 108 8.981 9.135 -0.154 1
1 1120 . 15 1 1 A 110 110 PHE HA H 108 4.846 6.095 -1.249 1
1 1125 . 15 1 1 A 110 110 PHE C C 108 172.231 174.258 -2.027 1
1 1126 . 15 1 1 A 110 110 PHE CA C 108 55.963 57.661 -1.698 1
1 1127 . 15 1 1 A 110 110 PHE CB C 108 43.270 42.303 0.967 1
1 1130 . 15 1 1 A 110 110 PHE N N 108 125.052 124.837 0.215 1
1 1131 . 15 1 1 A 111 111 ARG H H 109 7.461 8.963 -1.502 1
1 1132 . 15 1 1 A 111 111 ARG HA H 109 4.804 4.590 0.214 1
1 1136 . 15 1 1 A 111 111 ARG CA C 109 51.953 53.444 -1.491 1
1 1137 . 15 1 1 A 111 111 ARG CB C 109 30.008 29.935 0.073 1
1 1140 . 15 1 1 A 111 111 ARG N N 109 128.034 127.487 0.547 1
1 1141 . 15 1 1 A 112 112 PRO C C 110 178.675 177.607 1.068 1
1 1142 . 15 1 1 A 112 112 PRO CA C 110 64.024 64.171 -0.147 1
1 1143 . 15 1 1 A 112 112 PRO CB C 110 31.416 31.806 -0.390 1
1 1144 . 15 1 1 A 113 113 GLN H H 111 8.188 8.713 -0.525 1
1 1145 . 15 1 1 A 113 113 GLN HA H 111 4.056 4.055 0.001 1
1 1149 . 15 1 1 A 113 113 GLN C C 111 175.936 176.903 -0.967 1
1 1150 . 15 1 1 A 113 113 GLN CA C 111 57.144 58.262 -1.118 1
1 1151 . 15 1 1 A 113 113 GLN CB C 111 28.033 28.071 -0.038 1
1 1153 . 15 1 1 A 113 113 GLN N N 111 118.835 116.885 1.950 1
1 1154 . 15 1 1 A 114 114 SER H H 112 7.730 7.648 0.082 1
1 1155 . 15 1 1 A 114 114 SER HA H 112 4.037 4.579 -0.542 1
1 1158 . 15 1 1 A 114 114 SER C C 112 175.750 174.430 1.320 1
1 1159 . 15 1 1 A 114 114 SER CA C 112 60.154 58.732 1.422 1
1 1160 . 15 1 1 A 114 114 SER CB C 112 64.282 64.359 -0.077 1
1 1161 . 15 1 1 A 114 114 SER N N 112 114.887 113.838 1.049 1
1 1162 . 15 1 1 A 115 115 GLY H H 113 8.005 8.006 -0.001 1
1 1163 . 15 1 1 A 115 115 GLY HA2 H 113 3.712 3.980 -0.268 1
1 1164 . 15 1 1 A 115 115 GLY HA3 H 113 4.130 4.054 0.076 1
1 1165 . 15 1 1 A 115 115 GLY C C 113 173.945 175.614 -1.669 1
1 1166 . 15 1 1 A 115 115 GLY CA C 113 45.233 47.262 -2.029 1
1 1167 . 15 1 1 A 115 115 GLY N N 113 110.740 109.798 0.942 1
1 1168 . 15 1 1 A 116 116 ARG H H 114 7.665 8.701 -1.036 1
1 1169 . 15 1 1 A 116 116 ARG HA H 114 4.449 4.462 -0.013 1
1 1173 . 15 1 1 A 116 116 ARG C C 114 175.370 175.447 -0.077 1
1 1174 . 15 1 1 A 116 116 ARG CA C 114 55.080 55.893 -0.813 1
1 1175 . 15 1 1 A 116 116 ARG CB C 114 31.215 30.484 0.731 1
1 1178 . 15 1 1 A 116 116 ARG N N 114 119.983 118.900 1.083 1
1 1179 . 15 1 1 A 117 117 VAL H H 115 8.409 8.246 0.163 1
1 1180 . 15 1 1 A 117 117 VAL HA H 115 4.184 3.732 0.452 1
1 1188 . 15 1 1 A 117 117 VAL C C 115 175.980 174.355 1.625 1
1 1189 . 15 1 1 A 117 117 VAL CA C 115 61.167 62.205 -1.038 1
1 1190 . 15 1 1 A 117 117 VAL CB C 115 32.931 31.098 1.833 1
1 1193 . 15 1 1 A 117 117 VAL N N 115 122.240 116.352 5.888 1
1 1194 . 15 1 1 A 118 118 LEU H H 116 8.227 7.255 0.972 1
1 1195 . 15 1 1 A 118 118 LEU HA H 116 3.720 3.872 -0.152 1
1 1204 . 15 1 1 A 118 118 LEU C C 116 175.623 176.684 -1.061 1
1 1205 . 15 1 1 A 118 118 LEU CA C 116 54.555 55.202 -0.647 1
1 1206 . 15 1 1 A 118 118 LEU CB C 116 39.292 43.213 -3.921 1
1 1210 . 15 1 1 A 118 118 LEU N N 116 131.481 128.454 3.027 1
1 1211 . 15 1 1 A 119 119 SER H H 117 7.780 8.564 -0.784 1
1 1212 . 15 1 1 A 119 119 SER HA H 117 4.060 4.273 -0.213 1
1 1214 . 15 1 1 A 119 119 SER C C 117 175.782 175.234 0.548 1
1 1215 . 15 1 1 A 119 119 SER CA C 117 58.530 59.309 -0.779 1
1 1216 . 15 1 1 A 119 119 SER CB C 117 64.785 64.078 0.707 1
1 1217 . 15 1 1 A 119 119 SER N N 117 118.658 120.046 -1.388 1
1 1218 . 15 1 1 A 120 120 ALA H H 118 8.955 9.052 -0.097 1
1 1219 . 15 1 1 A 120 120 ALA HA H 118 3.846 3.952 -0.106 1
1 1223 . 15 1 1 A 120 120 ALA C C 118 179.731 179.740 -0.009 1
1 1224 . 15 1 1 A 120 120 ALA CA C 118 54.927 55.363 -0.436 1
1 1225 . 15 1 1 A 120 120 ALA CB C 118 18.627 18.117 0.510 1
1 1226 . 15 1 1 A 120 120 ALA N N 118 134.119 129.505 4.614 1
1 1227 . 15 1 1 A 121 121 MET H H 119 7.718 8.004 -0.286 1
1 1228 . 15 1 1 A 121 121 MET HA H 119 4.130 4.076 0.054 1
1 1235 . 15 1 1 A 121 121 MET C C 119 175.610 178.556 -2.946 1
1 1236 . 15 1 1 A 121 121 MET CA C 119 55.968 58.321 -2.353 1
1 1237 . 15 1 1 A 121 121 MET CB C 119 30.814 32.477 -1.663 1
1 1240 . 15 1 1 A 121 121 MET N N 119 115.424 118.099 -2.675 1
1 1241 . 15 1 1 A 122 122 ILE H H 120 6.451 8.015 -1.564 1
1 1242 . 15 1 1 A 122 122 ILE HA H 120 3.392 3.512 -0.120 1
1 1252 . 15 1 1 A 122 122 ILE C C 120 177.108 177.777 -0.669 1
1 1253 . 15 1 1 A 122 122 ILE CA C 120 59.650 65.141 -5.491 1
1 1254 . 15 1 1 A 122 122 ILE CB C 120 34.640 37.323 -2.683 1
1 1258 . 15 1 1 A 122 122 ILE N N 120 113.418 119.678 -6.260 1
1 1259 . 15 1 1 A 123 123 ARG H H 121 7.540 8.300 -0.760 1
1 1260 . 15 1 1 A 123 123 ARG HA H 121 3.551 4.066 -0.515 1
1 1264 . 15 1 1 A 123 123 ARG C C 121 179.642 179.660 -0.018 1
1 1265 . 15 1 1 A 123 123 ARG CA C 121 59.242 58.998 0.244 1
1 1266 . 15 1 1 A 123 123 ARG CB C 121 29.087 29.890 -0.803 1
1 1269 . 15 1 1 A 123 123 ARG N N 121 116.248 119.844 -3.596 1
1 1270 . 15 1 1 A 124 124 GLY H H 122 8.086 8.108 -0.022 1
1 1271 . 15 1 1 A 124 124 GLY C C 122 172.357 174.754 -2.397 1
1 1272 . 15 1 1 A 124 124 GLY CA C 122 44.836 47.183 -2.347 1
1 1273 . 15 1 1 A 124 124 GLY N N 122 104.381 108.395 -4.014 1
1 1274 . 15 1 1 A 125 125 ALA H H 123 6.411 7.331 -0.920 1
1 1275 . 15 1 1 A 125 125 ALA HA H 123 2.441 3.809 -1.368 1
1 1279 . 15 1 1 A 125 125 ALA C C 123 176.908 176.917 -0.009 1
1 1280 . 15 1 1 A 125 125 ALA CA C 123 51.593 51.090 0.503 1
1 1281 . 15 1 1 A 125 125 ALA CB C 123 16.997 17.206 -0.209 1
1 1282 . 15 1 1 A 125 125 ALA N N 123 123.136 120.575 2.561 1
1 1283 . 15 1 1 A 126 126 ALA H H 124 6.190 7.751 -1.561 1
1 1284 . 15 1 1 A 126 126 ALA HA H 124 3.829 4.943 -1.114 1
1 1288 . 15 1 1 A 126 126 ALA C C 124 177.535 177.255 0.280 1
1 1289 . 15 1 1 A 126 126 ALA CA C 124 52.403 51.428 0.975 1
1 1290 . 15 1 1 A 126 126 ALA CB C 124 18.375 19.136 -0.761 1
1 1291 . 15 1 1 A 126 126 ALA N N 124 117.999 125.773 -7.774 1
1 1292 . 15 1 1 A 127 127 ASP H H 125 8.877 8.092 0.785 1
1 1293 . 15 1 1 A 127 127 ASP HA H 125 4.665 4.699 -0.034 1
1 1296 . 15 1 1 A 127 127 ASP C C 125 177.795 176.548 1.247 1
1 1297 . 15 1 1 A 127 127 ASP CA C 125 52.855 54.430 -1.575 1
1 1298 . 15 1 1 A 127 127 ASP CB C 125 41.814 41.416 0.398 1
1 1299 . 15 1 1 A 127 127 ASP N N 125 121.828 119.936 1.892 1
1 1300 . 15 1 1 A 128 128 GLY H H 126 7.954 8.446 -0.492 1
1 1301 . 15 1 1 A 128 128 GLY HA2 H 126 3.830 4.001 -0.171 1
1 1302 . 15 1 1 A 128 128 GLY HA3 H 126 4.249 4.068 0.181 1
1 1303 . 15 1 1 A 128 128 GLY C C 126 173.822 174.099 -0.277 1
1 1304 . 15 1 1 A 128 128 GLY CA C 126 45.549 46.285 -0.736 1
1 1305 . 15 1 1 A 128 128 GLY N N 126 108.814 107.851 0.963 1
1 1306 . 15 1 1 A 129 129 SER H H 127 8.547 8.202 0.345 1
1 1307 . 15 1 1 A 129 129 SER HA H 127 4.486 4.767 -0.281 1
1 1309 . 15 1 1 A 129 129 SER C C 127 174.178 175.625 -1.447 1
1 1310 . 15 1 1 A 129 129 SER CA C 127 58.653 60.090 -1.437 1
1 1311 . 15 1 1 A 129 129 SER CB C 127 63.316 64.104 -0.788 1
1 1312 . 15 1 1 A 129 129 SER N N 127 115.599 116.172 -0.573 1
1 1313 . 15 1 1 A 130 130 ARG H H 128 8.795 8.044 0.751 1
1 1314 . 15 1 1 A 130 130 ARG HA H 128 4.160 4.391 -0.231 1
1 1318 . 15 1 1 A 130 130 ARG C C 128 175.518 176.297 -0.779 1
1 1319 . 15 1 1 A 130 130 ARG CA C 128 58.479 57.206 1.273 1
1 1320 . 15 1 1 A 130 130 ARG CB C 128 29.952 31.544 -1.592 1
1 1323 . 15 1 1 A 130 130 ARG N N 128 127.611 119.566 8.045 1
1 1324 . 15 1 1 A 131 131 PHE H H 129 9.315 7.994 1.321 1
1 1325 . 15 1 1 A 131 131 PHE HA H 129 4.878 4.992 -0.114 1
1 1331 . 15 1 1 A 131 131 PHE C C 129 175.058 173.721 1.337 1
1 1332 . 15 1 1 A 131 131 PHE CA C 129 55.953 56.326 -0.373 1
1 1333 . 15 1 1 A 131 131 PHE CB C 129 40.189 42.459 -2.270 1
1 1337 . 15 1 1 A 131 131 PHE N N 129 126.219 120.353 5.866 1
1 1338 . 15 1 1 A 132 132 GLN H H 130 8.160 8.207 -0.047 1
1 1339 . 15 1 1 A 132 132 GLN HA H 130 5.013 5.168 -0.155 1
1 1343 . 15 1 1 A 132 132 GLN CA C 130 54.498 54.956 -0.458 1
1 1344 . 15 1 1 A 132 132 GLN CB C 130 32.106 32.680 -0.574 1
1 1346 . 15 1 1 A 132 132 GLN N N 130 125.589 126.091 -0.502 1
1 1347 . 15 1 1 A 133 133 VAL H H 131 8.689 9.073 -0.384 1
1 1348 . 15 1 1 A 133 133 VAL HA H 131 4.529 4.541 -0.012 1
1 1356 . 15 1 1 A 133 133 VAL C C 131 174.441 175.874 -1.433 1
1 1357 . 15 1 1 A 133 133 VAL CA C 131 60.758 62.364 -1.606 1
1 1358 . 15 1 1 A 133 133 VAL CB C 131 32.417 31.762 0.655 1
1 1361 . 15 1 1 A 133 133 VAL N N 131 122.441 124.440 -1.999 1
1 1362 . 15 1 1 A 134 134 TRP H H 132 9.256 9.339 -0.083 1
1 1363 . 15 1 1 A 134 134 TRP HA H 132 5.213 5.228 -0.015 1
1 1371 . 15 1 1 A 134 134 TRP C C 132 174.575 175.986 -1.411 1
1 1372 . 15 1 1 A 134 134 TRP CA C 132 53.859 55.813 -1.954 1
1 1373 . 15 1 1 A 134 134 TRP CB C 132 31.311 31.159 0.152 1
1 1379 . 15 1 1 A 134 134 TRP N N 132 130.303 128.334 1.969 1
1 1381 . 15 1 1 A 135 135 ASP H H 133 8.237 8.658 -0.421 1
1 1382 . 15 1 1 A 135 135 ASP HA H 133 6.018 5.812 0.206 1
1 1385 . 15 1 1 A 135 135 ASP C C 133 177.020 175.200 1.820 1
1 1386 . 15 1 1 A 135 135 ASP CA C 133 53.321 53.353 -0.032 1
1 1387 . 15 1 1 A 135 135 ASP CB C 133 41.514 42.839 -1.325 1
1 1388 . 15 1 1 A 135 135 ASP N N 133 125.516 122.075 3.441 1
1 1389 . 15 1 1 A 136 136 TYR H H 134 9.058 8.438 0.620 1
1 1390 . 15 1 1 A 136 136 TYR HA H 134 4.970 5.261 -0.291 1
1 1394 . 15 1 1 A 136 136 TYR C C 134 172.324 172.971 -0.647 1
1 1395 . 15 1 1 A 136 136 TYR CA C 134 55.982 56.401 -0.419 1
1 1396 . 15 1 1 A 136 136 TYR CB C 134 42.265 40.715 1.550 1
1 1399 . 15 1 1 A 136 136 TYR N N 134 120.315 118.109 2.206 1
1 1400 . 15 1 1 A 137 137 ALA H H 135 8.521 8.541 -0.020 1
1 1401 . 15 1 1 A 137 137 ALA HA H 135 4.280 4.250 0.030 1
1 1405 . 15 1 1 A 137 137 ALA C C 135 178.561 177.375 1.186 1
1 1406 . 15 1 1 A 137 137 ALA CA C 135 49.550 50.922 -1.372 1
1 1407 . 15 1 1 A 137 137 ALA CB C 135 19.998 22.182 -2.184 1
1 1408 . 15 1 1 A 137 137 ALA N N 135 123.386 121.691 1.695 1
1 1409 . 15 1 1 A 138 138 GLU H H 136 8.678 8.984 -0.306 1
1 1410 . 15 1 1 A 138 138 GLU HA H 136 3.777 4.145 -0.368 1
1 1414 . 15 1 1 A 138 138 GLU C C 136 177.624 178.094 -0.470 1
1 1415 . 15 1 1 A 138 138 GLU CA C 136 60.527 59.314 1.213 1
1 1416 . 15 1 1 A 138 138 GLU CB C 136 29.020 29.374 -0.354 1
1 1418 . 15 1 1 A 138 138 GLU N N 136 121.774 121.147 0.627 1
1 1419 . 15 1 1 A 139 139 GLY H H 137 8.666 8.314 0.352 1
1 1420 . 15 1 1 A 139 139 GLY HA2 H 137 3.872 3.982 -0.110 1
1 1421 . 15 1 1 A 139 139 GLY HA3 H 137 3.872 3.996 -0.124 1
1 1422 . 15 1 1 A 139 139 GLY C C 137 175.122 174.636 0.486 1
1 1423 . 15 1 1 A 139 139 GLY CA C 137 46.093 45.691 0.402 1
1 1424 . 15 1 1 A 139 139 GLY N N 137 106.053 108.160 -2.107 1
1 1425 . 15 1 1 A 140 140 GLU H H 138 8.305 9.346 -1.041 1
1 1426 . 15 1 1 A 140 140 GLU HA H 138 4.754 4.672 0.082 1
1 1430 . 15 1 1 A 140 140 GLU C C 138 177.819 177.723 0.096 1
1 1431 . 15 1 1 A 140 140 GLU CA C 138 55.049 55.852 -0.803 1
1 1432 . 15 1 1 A 140 140 GLU CB C 138 30.504 31.116 -0.612 1
1 1434 . 15 1 1 A 140 140 GLU N N 138 117.485 117.310 0.175 1
1 1435 . 15 1 1 A 141 141 VAL H H 139 7.267 7.616 -0.349 1
1 1436 . 15 1 1 A 141 141 VAL HA H 139 3.422 3.965 -0.543 1
1 1444 . 15 1 1 A 141 141 VAL C C 139 175.454 177.193 -1.739 1
1 1445 . 15 1 1 A 141 141 VAL CA C 139 66.769 65.076 1.693 1
1 1446 . 15 1 1 A 141 141 VAL CB C 139 31.377 31.438 -0.061 1
1 1449 . 15 1 1 A 141 141 VAL N N 139 120.764 121.222 -0.458 1
1 1450 . 15 1 1 A 142 142 GLU H H 140 8.620 8.321 0.299 1
1 1451 . 15 1 1 A 142 142 GLU HA H 140 3.592 4.061 -0.469 1
1 1452 . 15 1 1 A 142 142 GLU C C 140 177.320 179.668 -2.348 1
1 1453 . 15 1 1 A 142 142 GLU CA C 140 62.607 59.501 3.106 1
1 1454 . 15 1 1 A 142 142 GLU CB C 140 26.759 29.263 -2.504 1
1 1455 . 15 1 1 A 142 142 GLU N N 140 120.048 122.232 -2.184 1
1 1456 . 15 1 1 A 143 143 THR H H 141 7.449 8.266 -0.817 1
1 1457 . 15 1 1 A 143 143 THR HA H 141 4.003 4.166 -0.163 1
1 1462 . 15 1 1 A 143 143 THR C C 141 177.258 175.358 1.900 1
1 1463 . 15 1 1 A 143 143 THR CA C 141 65.490 67.261 -1.771 1
1 1464 . 15 1 1 A 143 143 THR CB C 141 68.641 68.159 0.482 1
1 1466 . 15 1 1 A 143 143 THR N N 141 114.073 118.383 -4.310 1
1 1467 . 15 1 1 A 144 144 MET H H 142 7.992 8.353 -0.361 1
1 1468 . 15 1 1 A 144 144 MET HA H 142 4.316 4.318 -0.002 1
1 1476 . 15 1 1 A 144 144 MET C C 142 178.233 178.625 -0.392 1
1 1477 . 15 1 1 A 144 144 MET CA C 142 57.743 58.767 -1.024 1
1 1478 . 15 1 1 A 144 144 MET CB C 142 31.326 32.145 -0.819 1
1 1481 . 15 1 1 A 144 144 MET N N 142 120.595 119.491 1.104 1
1 1482 . 15 1 1 A 145 145 LEU H H 143 7.847 8.156 -0.309 1
1 1483 . 15 1 1 A 145 145 LEU HA H 143 3.919 3.656 0.263 1
1 1491 . 15 1 1 A 145 145 LEU C C 143 178.774 179.003 -0.229 1
1 1492 . 15 1 1 A 145 145 LEU CA C 143 57.877 57.787 0.090 1
1 1493 . 15 1 1 A 145 145 LEU CB C 143 40.951 41.078 -0.127 1
1 1497 . 15 1 1 A 145 145 LEU N N 143 119.410 119.694 -0.284 1
1 1498 . 15 1 1 A 146 146 ASP H H 144 8.431 8.707 -0.276 1
1 1499 . 15 1 1 A 146 146 ASP HA H 144 4.312 4.508 -0.196 1
1 1502 . 15 1 1 A 146 146 ASP C C 144 178.129 179.412 -1.283 1
1 1503 . 15 1 1 A 146 146 ASP CA C 144 57.464 57.474 -0.010 1
1 1504 . 15 1 1 A 146 146 ASP CB C 144 39.548 40.319 -0.771 1
1 1505 . 15 1 1 A 146 146 ASP N N 144 119.837 120.764 -0.927 1
1 1506 . 15 1 1 A 147 147 ARG H H 145 7.949 8.544 -0.595 1
1 1507 . 15 1 1 A 147 147 ARG HA H 145 4.050 4.105 -0.055 1
1 1512 . 15 1 1 A 147 147 ARG C C 145 179.547 178.839 0.708 1
1 1513 . 15 1 1 A 147 147 ARG CA C 145 58.972 59.682 -0.710 1
1 1514 . 15 1 1 A 147 147 ARG CB C 145 29.798 30.588 -0.790 1
1 1517 . 15 1 1 A 147 147 ARG N N 145 119.173 120.366 -1.193 1
1 1518 . 15 1 1 A 148 148 TYR H H 146 8.128 8.098 0.030 1
1 1519 . 15 1 1 A 148 148 TYR HA H 146 3.995 4.308 -0.313 1
1 1524 . 15 1 1 A 148 148 TYR C C 146 178.199 177.532 0.667 1
1 1525 . 15 1 1 A 148 148 TYR CA C 146 62.347 61.414 0.933 1
1 1526 . 15 1 1 A 148 148 TYR CB C 146 37.418 37.823 -0.405 1
1 1529 . 15 1 1 A 148 148 TYR N N 146 120.102 121.172 -1.070 1
1 1530 . 15 1 1 A 149 149 PHE H H 147 8.308 8.472 -0.164 1
1 1531 . 15 1 1 A 149 149 PHE HA H 147 4.013 3.833 0.180 1
1 1535 . 15 1 1 A 149 149 PHE C C 147 177.574 178.231 -0.657 1
1 1536 . 15 1 1 A 149 149 PHE CA C 147 63.044 61.499 1.545 1
1 1537 . 15 1 1 A 149 149 PHE CB C 147 37.153 37.590 -0.437 1
1 1541 . 15 1 1 A 149 149 PHE N N 147 116.680 118.192 -1.512 1
1 1542 . 15 1 1 A 150 150 GLU H H 148 8.271 8.674 -0.403 1
1 1543 . 15 1 1 A 150 150 GLU HA H 148 4.030 4.005 0.025 1
1 1547 . 15 1 1 A 150 150 GLU C C 148 177.687 178.891 -1.204 1
1 1548 . 15 1 1 A 150 150 GLU CA C 148 58.746 59.405 -0.659 1
1 1549 . 15 1 1 A 150 150 GLU CB C 148 28.847 28.778 0.069 1
1 1551 . 15 1 1 A 150 150 GLU N N 148 119.973 119.703 0.270 1
1 1552 . 15 1 1 A 151 151 ALA H H 149 6.992 7.561 -0.569 1
1 1553 . 15 1 1 A 151 151 ALA HA H 149 4.217 4.137 0.080 1
1 1557 . 15 1 1 A 151 151 ALA C C 149 178.190 177.263 0.927 1
1 1558 . 15 1 1 A 151 151 ALA CA C 149 52.779 54.306 -1.527 1
1 1559 . 15 1 1 A 151 151 ALA CB C 149 19.087 18.716 0.371 1
1 1560 . 15 1 1 A 151 151 ALA N N 149 118.629 121.309 -2.680 1
1 1561 . 15 1 1 A 152 152 TYR H H 150 7.722 7.356 0.366 1
1 1562 . 15 1 1 A 152 152 TYR HA H 150 4.137 4.771 -0.634 1
1 1567 . 15 1 1 A 152 152 TYR C C 150 175.703 174.258 1.445 1
1 1568 . 15 1 1 A 152 152 TYR CA C 150 59.260 57.138 2.122 1
1 1569 . 15 1 1 A 152 152 TYR CB C 150 39.165 40.518 -1.353 1
1 1572 . 15 1 1 A 152 152 TYR N N 150 118.767 111.905 6.862 1
1 1573 . 15 1 1 A 153 153 LEU H H 151 7.670 8.522 -0.852 1
1 1574 . 15 1 1 A 153 153 LEU HA H 151 4.145 4.566 -0.421 1
1 1584 . 15 1 1 A 153 153 LEU CA C 151 54.704 51.224 3.480 1
1 1585 . 15 1 1 A 153 153 LEU CB C 151 40.520 42.373 -1.853 1
1 1589 . 15 1 1 A 153 153 LEU N N 151 122.313 121.929 0.384 1
1 1590 . 15 1 1 A 154 154 PRO HA H 152 4.258 4.308 -0.050 1
1 1597 . 15 1 1 A 154 154 PRO C C 152 177.496 178.354 -0.858 1
1 1598 . 15 1 1 A 154 154 PRO CA C 152 63.899 65.505 -1.606 1
1 1599 . 15 1 1 A 154 154 PRO CB C 152 31.080 31.454 -0.374 1
1 1602 . 15 1 1 A 155 155 GLN H H 153 8.023 8.716 -0.693 1
1 1603 . 15 1 1 A 155 155 GLN HA H 153 4.176 4.135 0.041 1
1 1607 . 15 1 1 A 155 155 GLN C C 153 176.636 178.414 -1.778 1
1 1608 . 15 1 1 A 155 155 GLN CA C 153 55.968 58.685 -2.717 1
1 1609 . 15 1 1 A 155 155 GLN CB C 153 28.723 27.826 0.897 1
1 1610 . 15 1 1 A 155 155 GLN N N 153 119.173 116.550 2.623 1
1 1611 . 15 1 1 A 156 156 LYS H H 154 8.113 8.046 0.067 1
1 1612 . 15 1 1 A 156 156 LYS HA H 154 4.196 4.113 0.083 1
1 1619 . 15 1 1 A 156 156 LYS C C 154 56.493 178.606 -122.113 1
1 1620 . 15 1 1 A 156 156 LYS CA C 154 56.493 58.824 -2.331 1
1 1621 . 15 1 1 A 156 156 LYS CB C 154 32.037 32.158 -0.121 1
1 1625 . 15 1 1 A 156 156 LYS N N 154 122.788 119.642 3.146 1
1 1626 . 15 1 1 A 157 157 THR H H 155 8.013 7.686 0.327 1
1 1627 . 15 1 1 A 157 157 THR HA H 155 4.183 3.947 0.236 1
1 1632 . 15 1 1 A 157 157 THR C C 155 174.580 175.188 -0.608 1
1 1633 . 15 1 1 A 157 157 THR CA C 155 61.958 65.710 -3.752 1
1 1634 . 15 1 1 A 157 157 THR CB C 155 69.665 68.479 1.186 1
1 1636 . 15 1 1 A 157 157 THR N N 155 115.504 113.924 1.580 1
1 1637 . 15 1 1 A 158 158 ALA H H 156 8.170 7.842 0.328 1
1 1638 . 15 1 1 A 158 158 ALA HA H 156 4.220 4.474 -0.254 1
1 1642 . 15 1 1 A 158 158 ALA CA C 156 52.492 51.517 0.975 1
1 1643 . 15 1 1 A 158 158 ALA CB C 156 18.810 20.532 -1.722 1
1 1644 . 15 1 1 A 158 158 ALA N N 156 126.825 120.782 6.043 1
1 1645 . 15 1 1 A 159 159 SER H H 157 7.762 9.010 -1.248 1
1 1646 . 15 1 1 A 159 159 SER CA C 157 58.230 61.170 -2.940 1
1 1647 . 15 1 1 A 159 159 SER CB C 157 63.440 62.775 0.665 1
1 1648 . 15 1 1 A 159 159 SER N N 157 123.078 119.588 3.490 1
1 1649 . 15 1 1 A 162 162 HIS HA H 160 4.845 4.810 0.035 1
1 1652 . 15 1 1 A 162 162 HIS CA C 160 53.590 54.370 -0.780 1
1 1653 . 15 1 1 A 162 162 HIS CB C 160 29.398 29.968 -0.570 1
1 1654 . 15 1 1 A 163 163 PRO HA H 161 4.388 4.466 -0.078 1
1 1660 . 15 1 1 A 163 163 PRO C C 161 177.018 177.483 -0.465 1
1 1661 . 15 1 1 A 163 163 PRO CA C 161 63.118 62.706 0.412 1
1 1662 . 15 1 1 A 163 163 PRO CB C 161 31.668 32.592 -0.924 1
1 1665 . 15 1 1 A 164 164 SER H H 162 8.418 8.734 -0.316 1
1 1666 . 15 1 1 A 164 164 SER HA H 162 4.338 4.257 0.081 1
1 1668 . 15 1 1 A 164 164 SER C C 162 173.327 176.538 -3.211 1
1 1669 . 15 1 1 A 164 164 SER CA C 162 58.202 61.442 -3.240 1
1 1670 . 15 1 1 A 164 164 SER CB C 162 64.080 62.773 1.307 1
1 1671 . 15 1 1 A 164 164 SER N N 162 117.485 118.580 -1.095 1
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Assigned_chem_shift_list_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Entity_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Entity_delta_chem_shifts_ID
1 1 1 1 "RMS(OBS, PRED)" C 137 11.241 1
2 1 1 1 "RMS(OBS, PRED)" CA 159 1.491 1
3 1 1 1 "RMS(OBS, PRED)" CB 141 1.413 1
4 1 1 1 "RMS(OBS, PRED)" H 143 0.664 1
5 1 1 1 "RMS(OBS, PRED)" HA 162 0.346 1
6 1 1 1 "RMS(OBS, PRED)" N 143 3.066 1
7 1 2 1 "RMS(OBS, PRED)" C 137 11.266 1
8 1 2 1 "RMS(OBS, PRED)" CA 159 1.643 1
9 1 2 1 "RMS(OBS, PRED)" CB 141 1.296 1
10 1 2 1 "RMS(OBS, PRED)" H 143 0.618 1
11 1 2 1 "RMS(OBS, PRED)" HA 162 0.318 1
12 1 2 1 "RMS(OBS, PRED)" N 143 2.919 1
13 1 3 1 "RMS(OBS, PRED)" C 137 11.091 1
14 1 3 1 "RMS(OBS, PRED)" CA 159 1.475 1
15 1 3 1 "RMS(OBS, PRED)" CB 141 1.635 1
16 1 3 1 "RMS(OBS, PRED)" H 143 0.612 1
17 1 3 1 "RMS(OBS, PRED)" HA 162 0.361 1
18 1 3 1 "RMS(OBS, PRED)" N 143 3.303 1
19 1 4 1 "RMS(OBS, PRED)" C 137 11.257 1
20 1 4 1 "RMS(OBS, PRED)" CA 159 1.595 1
21 1 4 1 "RMS(OBS, PRED)" CB 141 1.443 1
22 1 4 1 "RMS(OBS, PRED)" H 143 0.603 1
23 1 4 1 "RMS(OBS, PRED)" HA 162 0.366 1
24 1 4 1 "RMS(OBS, PRED)" N 143 3.166 1
25 1 5 1 "RMS(OBS, PRED)" C 137 11.214 1
26 1 5 1 "RMS(OBS, PRED)" CA 159 1.565 1
27 1 5 1 "RMS(OBS, PRED)" CB 141 1.510 1
28 1 5 1 "RMS(OBS, PRED)" H 143 0.653 1
29 1 5 1 "RMS(OBS, PRED)" HA 162 0.349 1
30 1 5 1 "RMS(OBS, PRED)" N 143 3.157 1
31 1 6 1 "RMS(OBS, PRED)" C 137 10.970 1
32 1 6 1 "RMS(OBS, PRED)" CA 159 1.593 1
33 1 6 1 "RMS(OBS, PRED)" CB 141 1.401 1
34 1 6 1 "RMS(OBS, PRED)" H 143 0.651 1
35 1 6 1 "RMS(OBS, PRED)" HA 162 0.336 1
36 1 6 1 "RMS(OBS, PRED)" N 143 3.209 1
37 1 7 1 "RMS(OBS, PRED)" C 137 11.271 1
38 1 7 1 "RMS(OBS, PRED)" CA 159 1.543 1
39 1 7 1 "RMS(OBS, PRED)" CB 141 1.399 1
40 1 7 1 "RMS(OBS, PRED)" H 143 0.662 1
41 1 7 1 "RMS(OBS, PRED)" HA 162 0.338 1
42 1 7 1 "RMS(OBS, PRED)" N 143 3.099 1
43 1 8 1 "RMS(OBS, PRED)" C 137 11.148 1
44 1 8 1 "RMS(OBS, PRED)" CA 159 1.472 1
45 1 8 1 "RMS(OBS, PRED)" CB 141 1.448 1
46 1 8 1 "RMS(OBS, PRED)" H 143 0.641 1
47 1 8 1 "RMS(OBS, PRED)" HA 162 0.320 1
48 1 8 1 "RMS(OBS, PRED)" N 143 3.109 1
49 1 9 1 "RMS(OBS, PRED)" C 137 11.236 1
50 1 9 1 "RMS(OBS, PRED)" CA 159 1.615 1
51 1 9 1 "RMS(OBS, PRED)" CB 141 1.409 1
52 1 9 1 "RMS(OBS, PRED)" H 143 0.636 1
53 1 9 1 "RMS(OBS, PRED)" HA 162 0.312 1
54 1 9 1 "RMS(OBS, PRED)" N 143 3.065 1
55 1 10 1 "RMS(OBS, PRED)" C 137 11.230 1
56 1 10 1 "RMS(OBS, PRED)" CA 159 1.693 1
57 1 10 1 "RMS(OBS, PRED)" CB 141 1.327 1
58 1 10 1 "RMS(OBS, PRED)" H 143 0.631 1
59 1 10 1 "RMS(OBS, PRED)" HA 162 0.370 1
60 1 10 1 "RMS(OBS, PRED)" N 143 3.311 1
61 1 11 1 "RMS(OBS, PRED)" C 137 11.158 1
62 1 11 1 "RMS(OBS, PRED)" CA 159 1.473 1
63 1 11 1 "RMS(OBS, PRED)" CB 141 1.240 1
64 1 11 1 "RMS(OBS, PRED)" H 143 0.646 1
65 1 11 1 "RMS(OBS, PRED)" HA 162 0.322 1
66 1 11 1 "RMS(OBS, PRED)" N 143 3.358 1
67 1 12 1 "RMS(OBS, PRED)" C 137 11.240 1
68 1 12 1 "RMS(OBS, PRED)" CA 159 1.595 1
69 1 12 1 "RMS(OBS, PRED)" CB 141 1.468 1
70 1 12 1 "RMS(OBS, PRED)" H 143 0.676 1
71 1 12 1 "RMS(OBS, PRED)" HA 162 0.346 1
72 1 12 1 "RMS(OBS, PRED)" N 143 3.037 1
73 1 13 1 "RMS(OBS, PRED)" C 137 11.198 1
74 1 13 1 "RMS(OBS, PRED)" CA 159 1.685 1
75 1 13 1 "RMS(OBS, PRED)" CB 141 1.177 1
76 1 13 1 "RMS(OBS, PRED)" H 143 0.672 1
77 1 13 1 "RMS(OBS, PRED)" HA 162 0.348 1
78 1 13 1 "RMS(OBS, PRED)" N 143 3.231 1
79 1 14 1 "RMS(OBS, PRED)" C 137 11.097 1
80 1 14 1 "RMS(OBS, PRED)" CA 159 1.608 1
81 1 14 1 "RMS(OBS, PRED)" CB 141 1.584 1
82 1 14 1 "RMS(OBS, PRED)" H 143 0.627 1
83 1 14 1 "RMS(OBS, PRED)" HA 162 0.367 1
84 1 14 1 "RMS(OBS, PRED)" N 143 3.225 1
85 1 15 1 "RMS(OBS, PRED)" C 137 11.249 1
86 1 15 1 "RMS(OBS, PRED)" CA 159 1.629 1
87 1 15 1 "RMS(OBS, PRED)" CB 141 1.329 1
88 1 15 1 "RMS(OBS, PRED)" H 143 0.642 1
89 1 15 1 "RMS(OBS, PRED)" HA 162 0.337 1
90 1 15 1 "RMS(OBS, PRED)" N 143 2.979 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 6 . 1 1 A 4 4 ALA H H 2 8.270 8.151 0.119 2
1 7 . 1 1 A 4 4 ALA HA H 2 4.212 4.235 -0.023 2
1 11 . 1 1 A 4 4 ALA C C 2 177.441 177.439 0.002 2
1 12 . 1 1 A 4 4 ALA CA C 2 52.280 53.116 -0.836 2
1 13 . 1 1 A 4 4 ALA CB C 2 18.880 19.327 -0.447 2
1 14 . 1 1 A 4 4 ALA N N 2 126.500 123.231 3.269 2
1 15 . 1 1 A 5 5 ALA H H 3 8.251 8.150 0.101 2
1 16 . 1 1 A 5 5 ALA HA H 3 4.261 4.305 -0.044 2
1 20 . 1 1 A 5 5 ALA C C 3 177.824 177.380 0.444 2
1 21 . 1 1 A 5 5 ALA CA C 3 52.347 52.863 -0.516 2
1 22 . 1 1 A 5 5 ALA CB C 3 18.869 19.374 -0.505 2
1 23 . 1 1 A 5 5 ALA N N 3 124.322 122.035 2.287 2
1 24 . 1 1 A 6 6 SER H H 4 8.158 8.417 -0.259 2
1 25 . 1 1 A 6 6 SER HA H 4 4.358 4.564 -0.206 2
1 27 . 1 1 A 6 6 SER C C 4 175.222 174.721 0.501 2
1 28 . 1 1 A 6 6 SER CA C 4 58.438 58.601 -0.163 2
1 29 . 1 1 A 6 6 SER CB C 4 63.859 64.271 -0.412 2
1 30 . 1 1 A 6 6 SER N N 4 115.338 114.248 1.090 2
1 31 . 1 1 A 7 7 GLY H H 5 8.265 8.380 -0.115 2
1 32 . 1 1 A 7 7 GLY HA2 H 5 3.900 4.033 -0.133 2
1 33 . 1 1 A 7 7 GLY C C 5 174.083 173.241 0.842 2
1 34 . 1 1 A 7 7 GLY CA C 5 45.113 45.728 -0.615 2
1 35 . 1 1 A 7 7 GLY N N 5 111.360 110.106 1.254 2
1 36 . 1 1 A 8 8 GLU H H 6 8.100 8.320 -0.220 2
1 37 . 1 1 A 8 8 GLU HA H 6 4.209 4.576 -0.367 2
1 41 . 1 1 A 8 8 GLU C C 6 176.354 176.408 -0.054 2
1 42 . 1 1 A 8 8 GLU CA C 6 56.261 55.818 0.443 2
1 43 . 1 1 A 8 8 GLU CB C 6 29.830 31.125 -1.295 2
1 45 . 1 1 A 8 8 GLU N N 6 121.056 119.924 1.132 2
1 46 . 1 1 A 9 9 GLN H H 7 8.287 8.612 -0.325 2
1 47 . 1 1 A 9 9 GLN HA H 7 4.247 4.523 -0.276 2
1 51 . 1 1 A 9 9 GLN C C 7 172.457 175.302 -2.845 2
1 52 . 1 1 A 9 9 GLN CA C 7 55.269 55.988 -0.719 2
1 53 . 1 1 A 9 9 GLN CB C 7 29.236 30.288 -1.052 2
1 55 . 1 1 A 9 9 GLN N N 7 122.164 122.046 0.118 2
1 56 . 1 1 A 10 10 ALA H H 8 8.368 8.318 0.050 2
1 57 . 1 1 A 10 10 ALA HA H 8 4.509 4.686 -0.177 2
1 61 . 1 1 A 10 10 ALA CA C 8 50.341 50.485 -0.144 2
1 62 . 1 1 A 10 10 ALA CB C 8 18.140 20.491 -2.351 2
1 63 . 1 1 A 10 10 ALA N N 8 128.028 121.832 6.196 2
1 64 . 1 1 A 11 11 PRO HA H 9 4.437 4.556 -0.119 2
1 70 . 1 1 A 11 11 PRO C C 9 176.381 176.400 -0.019 2
1 71 . 1 1 A 11 11 PRO CA C 9 63.298 62.402 0.896 2
1 72 . 1 1 A 11 11 PRO CB C 9 31.776 32.921 -1.145 2
1 75 . 1 1 A 12 12 CYS H H 10 8.056 8.341 -0.285 2
1 76 . 1 1 A 12 12 CYS HA H 10 4.717 4.891 -0.174 2
1 79 . 1 1 A 12 12 CYS C C 10 173.266 173.933 -0.667 2
1 80 . 1 1 A 12 12 CYS CA C 10 57.398 57.771 -0.373 2
1 81 . 1 1 A 12 12 CYS CB C 10 29.165 29.973 -0.808 2
1 82 . 1 1 A 12 12 CYS N N 10 118.295 118.141 0.154 2
1 83 . 1 1 A 13 13 SER H H 11 9.815 8.759 1.056 2
1 84 . 1 1 A 13 13 SER HA H 11 5.227 5.581 -0.354 2
1 87 . 1 1 A 13 13 SER C C 11 173.648 173.442 0.206 2
1 88 . 1 1 A 13 13 SER CA C 11 57.630 56.752 0.878 2
1 89 . 1 1 A 13 13 SER CB C 11 64.820 66.145 -1.325 2
1 90 . 1 1 A 13 13 SER N N 11 122.365 116.293 6.072 2
1 91 . 1 1 A 14 14 VAL H H 12 9.352 9.228 0.124 2
1 92 . 1 1 A 14 14 VAL HA H 12 4.696 5.303 -0.607 2
1 100 . 1 1 A 14 14 VAL C C 12 173.875 173.667 0.208 2
1 101 . 1 1 A 14 14 VAL CA C 12 60.146 61.024 -0.878 2
1 102 . 1 1 A 14 14 VAL CB C 12 34.499 35.045 -0.546 2
1 105 . 1 1 A 14 14 VAL N N 12 126.378 122.869 3.509 2
1 106 . 1 1 A 15 15 TYR H H 13 8.745 9.124 -0.379 2
1 111 . 1 1 A 15 15 TYR C C 13 173.345 174.033 -0.688 2
1 112 . 1 1 A 15 15 TYR CA C 13 56.186 55.965 0.221 2
1 113 . 1 1 A 15 15 TYR CB C 13 40.858 40.465 0.393 2
1 116 . 1 1 A 15 15 TYR N N 13 129.472 128.313 1.159 2
1 117 . 1 1 A 16 16 PHE H H 14 7.370 8.645 -1.275 2
1 118 . 1 1 A 16 16 PHE HA H 14 5.720 5.222 0.498 2
1 123 . 1 1 A 16 16 PHE C C 14 174.058 174.235 -0.177 2
1 124 . 1 1 A 16 16 PHE CA C 14 54.361 56.632 -2.271 2
1 125 . 1 1 A 16 16 PHE CB C 14 40.461 40.492 -0.031 2
1 129 . 1 1 A 16 16 PHE N N 14 128.263 127.868 0.395 2
1 130 . 1 1 A 17 17 CYS H H 15 8.147 8.477 -0.330 2
1 131 . 1 1 A 17 17 CYS CA C 15 56.570 57.598 -1.028 2
1 132 . 1 1 A 17 17 CYS CB C 15 29.690 29.784 -0.094 2
1 133 . 1 1 A 17 17 CYS N N 15 126.188 125.249 0.939 2
1 134 . 1 1 A 18 18 GLY HA2 H 16 3.819 3.745 0.074 2
1 135 . 1 1 A 18 18 GLY C C 16 173.374 172.695 0.679 2
1 136 . 1 1 A 18 18 GLY CA C 16 45.510 45.046 0.464 2
1 137 . 1 1 A 19 19 SER H H 17 8.533 9.000 -0.467 2
1 138 . 1 1 A 19 19 SER HA H 17 4.505 4.882 -0.377 2
1 139 . 1 1 A 19 19 SER CA C 17 58.700 58.545 0.155 2
1 140 . 1 1 A 19 19 SER CB C 17 63.810 64.465 -0.655 2
1 141 . 1 1 A 19 19 SER N N 17 117.300 115.560 1.740 2
1 142 . 1 1 A 20 20 ILE HA H 18 4.309 4.470 -0.161 2
1 152 . 1 1 A 20 20 ILE CA C 18 61.317 61.741 -0.424 2
1 153 . 1 1 A 20 20 ILE CB C 18 38.302 39.080 -0.778 2
1 157 . 1 1 A 21 21 ARG HA H 19 4.172 4.251 -0.079 2
1 160 . 1 1 A 21 21 ARG C C 19 177.118 176.443 0.675 2
1 161 . 1 1 A 21 21 ARG CA C 19 56.960 57.266 -0.306 2
1 162 . 1 1 A 21 21 ARG CB C 19 29.568 30.508 -0.940 2
1 165 . 1 1 A 22 22 GLY H H 20 8.685 8.011 0.674 2
1 166 . 1 1 A 22 22 GLY HA2 H 20 3.801 4.046 -0.245 2
1 167 . 1 1 A 22 22 GLY HA3 H 20 3.923 4.054 -0.131 2
1 168 . 1 1 A 22 22 GLY C C 20 174.814 174.473 0.341 2
1 169 . 1 1 A 22 22 GLY CA C 20 45.289 45.523 -0.234 2
1 170 . 1 1 A 22 22 GLY N N 20 110.145 108.143 2.002 2
1 171 . 1 1 A 23 23 GLY H H 21 8.058 8.191 -0.133 2
1 172 . 1 1 A 23 23 GLY HA2 H 21 3.998 3.979 0.019 2
1 173 . 1 1 A 23 23 GLY HA3 H 21 4.237 3.990 0.247 2
1 174 . 1 1 A 23 23 GLY C C 21 174.762 174.147 0.615 2
1 175 . 1 1 A 23 23 GLY CA C 21 45.025 45.835 -0.810 2
1 176 . 1 1 A 23 23 GLY N N 21 109.327 109.087 0.240 2
1 177 . 1 1 A 24 24 ARG H H 22 8.376 8.265 0.111 2
1 178 . 1 1 A 24 24 ARG HA H 22 4.086 4.350 -0.264 2
1 184 . 1 1 A 24 24 ARG C C 22 178.178 176.752 1.426 2
1 185 . 1 1 A 24 24 ARG CA C 22 57.471 56.457 1.014 2
1 186 . 1 1 A 24 24 ARG CB C 22 29.653 30.733 -1.080 2
1 189 . 1 1 A 24 24 ARG N N 22 120.861 119.548 1.313 2
1 190 . 1 1 A 25 25 GLU H H 23 8.831 8.949 -0.118 2
1 191 . 1 1 A 25 25 GLU HA H 23 4.015 3.964 0.051 2
1 195 . 1 1 A 25 25 GLU C C 23 178.005 178.468 -0.463 2
1 196 . 1 1 A 25 25 GLU CA C 23 58.920 59.426 -0.506 2
1 197 . 1 1 A 25 25 GLU CB C 23 28.592 29.266 -0.674 2
1 199 . 1 1 A 25 25 GLU N N 23 121.243 120.333 0.910 2
1 200 . 1 1 A 26 26 ASP H H 24 7.897 8.149 -0.252 2
1 201 . 1 1 A 26 26 ASP HA H 24 4.516 4.081 0.435 2
1 203 . 1 1 A 26 26 ASP C C 24 176.455 178.213 -1.758 2
1 204 . 1 1 A 26 26 ASP CA C 24 55.122 56.241 -1.119 2
1 205 . 1 1 A 26 26 ASP CB C 24 39.888 39.928 -0.040 2
1 206 . 1 1 A 26 26 ASP N N 24 119.541 119.668 -0.127 2
1 207 . 1 1 A 27 27 GLN H H 25 7.696 8.211 -0.515 2
1 208 . 1 1 A 27 27 GLN HA H 25 3.704 3.957 -0.253 2
1 212 . 1 1 A 27 27 GLN C C 25 177.016 178.113 -1.097 2
1 213 . 1 1 A 27 27 GLN CA C 25 59.501 58.623 0.878 2
1 214 . 1 1 A 27 27 GLN CB C 25 27.762 28.698 -0.936 2
1 216 . 1 1 A 27 27 GLN N N 25 119.471 119.595 -0.124 2
1 217 . 1 1 A 28 28 ALA H H 26 8.227 7.636 0.591 2
1 218 . 1 1 A 28 28 ALA HA H 26 4.072 4.131 -0.059 2
1 222 . 1 1 A 28 28 ALA C C 26 180.567 179.835 0.732 2
1 223 . 1 1 A 28 28 ALA CA C 26 54.627 55.084 -0.457 2
1 224 . 1 1 A 28 28 ALA CB C 26 17.355 18.420 -1.065 2
1 225 . 1 1 A 28 28 ALA N N 26 122.362 122.284 0.078 2
1 226 . 1 1 A 29 29 LEU H H 27 7.533 8.008 -0.475 2
1 227 . 1 1 A 29 29 LEU HA H 27 4.050 4.041 0.009 2
1 237 . 1 1 A 29 29 LEU C C 27 178.752 178.032 0.720 2
1 238 . 1 1 A 29 29 LEU CA C 27 57.578 57.608 -0.030 2
1 239 . 1 1 A 29 29 LEU CB C 27 40.734 41.618 -0.884 2
1 243 . 1 1 A 29 29 LEU N N 27 122.255 119.771 2.484 2
1 244 . 1 1 A 30 30 TYR H H 28 8.473 8.174 0.299 2
1 245 . 1 1 A 30 30 TYR HA H 28 4.049 4.115 -0.066 2
1 250 . 1 1 A 30 30 TYR C C 28 177.736 178.507 -0.771 2
1 251 . 1 1 A 30 30 TYR CA C 28 59.817 60.195 -0.378 2
1 252 . 1 1 A 30 30 TYR CB C 28 36.140 37.219 -1.079 2
1 255 . 1 1 A 30 30 TYR N N 28 120.403 118.542 1.861 2
1 256 . 1 1 A 31 31 ALA H H 29 8.008 8.477 -0.469 2
1 257 . 1 1 A 31 31 ALA HA H 29 4.005 4.038 -0.033 2
1 261 . 1 1 A 31 31 ALA C C 29 180.879 179.598 1.281 2
1 262 . 1 1 A 31 31 ALA CA C 29 54.914 55.258 -0.344 2
1 263 . 1 1 A 31 31 ALA CB C 29 17.375 18.175 -0.800 2
1 264 . 1 1 A 31 31 ALA N N 29 120.771 122.938 -2.167 2
1 265 . 1 1 A 32 32 ARG H H 30 7.596 7.603 -0.007 2
1 266 . 1 1 A 32 32 ARG HA H 30 3.916 4.091 -0.175 2
1 273 . 1 1 A 32 32 ARG C C 30 179.919 178.561 1.358 2
1 274 . 1 1 A 32 32 ARG CA C 30 59.014 59.079 -0.065 2
1 275 . 1 1 A 32 32 ARG CB C 30 30.531 29.770 0.761 2
1 278 . 1 1 A 32 32 ARG N N 30 120.365 118.143 2.222 2
1 279 . 1 1 A 33 33 ILE H H 31 8.066 8.479 -0.413 2
1 280 . 1 1 A 33 33 ILE HA H 31 3.120 3.663 -0.543 2
1 290 . 1 1 A 33 33 ILE C C 31 177.051 178.287 -1.236 2
1 291 . 1 1 A 33 33 ILE CA C 31 65.757 65.224 0.533 2
1 292 . 1 1 A 33 33 ILE CB C 31 36.928 37.822 -0.894 2
1 296 . 1 1 A 33 33 ILE N N 31 121.608 119.683 1.925 2
1 297 . 1 1 A 34 34 VAL H H 32 8.148 8.951 -0.803 2
1 298 . 1 1 A 34 34 VAL HA H 32 2.954 3.496 -0.542 2
1 306 . 1 1 A 34 34 VAL C C 32 177.159 178.106 -0.947 2
1 307 . 1 1 A 34 34 VAL CA C 32 67.220 66.312 0.908 2
1 308 . 1 1 A 34 34 VAL CB C 32 31.039 31.171 -0.132 2
1 311 . 1 1 A 34 34 VAL N N 32 119.318 120.502 -1.184 2
1 312 . 1 1 A 35 35 SER H H 33 7.826 8.324 -0.498 2
1 313 . 1 1 A 35 35 SER HA H 33 3.868 4.081 -0.213 2
1 316 . 1 1 A 35 35 SER C C 33 176.779 176.991 -0.212 2
1 317 . 1 1 A 35 35 SER CA C 33 62.000 61.565 0.435 2
1 318 . 1 1 A 35 35 SER CB C 33 62.789 62.681 0.108 2
1 319 . 1 1 A 35 35 SER N N 33 111.936 115.665 -3.729 2
1 320 . 1 1 A 36 36 ARG H H 34 7.405 7.528 -0.123 2
1 321 . 1 1 A 36 36 ARG HA H 34 4.070 4.069 0.001 2
1 323 . 1 1 A 36 36 ARG C C 34 178.047 178.368 -0.321 2
1 324 . 1 1 A 36 36 ARG CA C 34 56.108 58.977 -2.869 2
1 325 . 1 1 A 36 36 ARG CB C 34 28.837 30.090 -1.253 2
1 326 . 1 1 A 36 36 ARG N N 34 120.909 122.171 -1.262 2
1 327 . 1 1 A 37 37 LEU H H 35 8.301 8.211 0.090 2
1 328 . 1 1 A 37 37 LEU HA H 35 3.620 3.738 -0.118 2
1 336 . 1 1 A 37 37 LEU C C 35 178.446 179.064 -0.618 2
1 337 . 1 1 A 37 37 LEU CA C 35 57.640 57.843 -0.203 2
1 338 . 1 1 A 37 37 LEU CB C 35 41.584 41.454 0.130 2
1 342 . 1 1 A 37 37 LEU N N 35 118.567 119.832 -1.265 2
1 343 . 1 1 A 38 38 ARG H H 36 7.379 8.325 -0.946 2
1 344 . 1 1 A 38 38 ARG HA H 36 4.340 3.961 0.379 2
1 350 . 1 1 A 38 38 ARG C C 36 177.895 178.697 -0.802 2
1 351 . 1 1 A 38 38 ARG CA C 36 57.785 59.125 -1.340 2
1 352 . 1 1 A 38 38 ARG CB C 36 29.775 29.708 0.067 2
1 355 . 1 1 A 38 38 ARG N N 36 115.352 119.398 -4.046 2
1 356 . 1 1 A 39 39 ARG H H 37 7.240 7.845 -0.605 2
1 357 . 1 1 A 39 39 ARG HA H 37 3.743 4.149 -0.406 2
1 363 . 1 1 A 39 39 ARG C C 37 176.988 178.041 -1.053 2
1 364 . 1 1 A 39 39 ARG CA C 37 57.605 58.526 -0.921 2
1 365 . 1 1 A 39 39 ARG CB C 37 28.925 30.451 -1.526 2
1 368 . 1 1 A 39 39 ARG N N 37 117.410 118.533 -1.123 2
1 369 . 1 1 A 40 40 TYR H H 38 7.296 7.914 -0.618 2
1 370 . 1 1 A 40 40 TYR HA H 38 4.319 4.382 -0.063 2
1 375 . 1 1 A 40 40 TYR C C 38 175.001 175.883 -0.882 2
1 376 . 1 1 A 40 40 TYR CA C 38 57.730 59.086 -1.356 2
1 377 . 1 1 A 40 40 TYR CB C 38 39.343 38.903 0.440 2
1 380 . 1 1 A 40 40 TYR N N 38 116.937 117.759 -0.822 2
1 381 . 1 1 A 41 41 GLY H H 39 7.325 7.943 -0.618 2
1 382 . 1 1 A 41 41 GLY HA2 H 39 3.953 3.987 -0.034 2
1 383 . 1 1 A 41 41 GLY C C 39 171.302 173.054 -1.752 2
1 384 . 1 1 A 41 41 GLY CA C 39 45.590 45.721 -0.131 2
1 385 . 1 1 A 41 41 GLY N N 39 105.596 106.052 -0.456 2
1 386 . 1 1 A 42 42 LYS H H 40 8.186 8.537 -0.351 2
1 387 . 1 1 A 42 42 LYS HA H 40 4.205 4.444 -0.239 2
1 393 . 1 1 A 42 42 LYS C C 40 175.672 175.731 -0.059 2
1 394 . 1 1 A 42 42 LYS CA C 40 55.241 56.043 -0.802 2
1 395 . 1 1 A 42 42 LYS CB C 40 32.889 33.670 -0.781 2
1 399 . 1 1 A 42 42 LYS N N 40 120.341 121.495 -1.154 2
1 400 . 1 1 A 43 43 VAL H H 41 8.610 8.708 -0.098 2
1 401 . 1 1 A 43 43 VAL HA H 41 4.416 4.386 0.030 2
1 409 . 1 1 A 43 43 VAL C C 41 175.997 175.466 0.531 2
1 410 . 1 1 A 43 43 VAL CA C 41 61.331 62.530 -1.199 2
1 411 . 1 1 A 43 43 VAL CB C 41 30.573 31.553 -0.980 2
1 414 . 1 1 A 43 43 VAL N N 41 127.312 124.795 2.517 2
1 415 . 1 1 A 44 44 LEU H H 42 8.894 8.327 0.567 2
1 416 . 1 1 A 44 44 LEU HA H 42 4.496 3.775 0.721 2
1 424 . 1 1 A 44 44 LEU CA C 42 54.522 55.585 -1.063 2
1 425 . 1 1 A 44 44 LEU CB C 42 40.980 42.128 -1.148 2
1 429 . 1 1 A 44 44 LEU N N 42 130.261 128.321 1.940 2
1 430 . 1 1 A 45 45 THR HA H 43 4.263 4.035 0.228 2
1 435 . 1 1 A 45 45 THR CA C 43 61.033 61.956 -0.923 2
1 436 . 1 1 A 45 45 THR CB C 43 69.768 67.389 2.379 2
1 440 . 1 1 A 46 46 GLU CA C 44 56.411 57.962 -1.551 2
1 441 . 1 1 A 46 46 GLU CB C 44 29.827 29.764 0.063 2
1 443 . 1 1 A 47 47 HIS HA H 45 4.549 4.274 0.275 2
1 447 . 1 1 A 47 47 HIS C C 45 174.812 176.751 -1.939 2
1 448 . 1 1 A 47 47 HIS CA C 45 56.107 59.250 -3.143 2
1 449 . 1 1 A 47 47 HIS CB C 45 29.080 29.619 -0.539 2
1 451 . 1 1 A 48 48 VAL H H 46 7.826 7.771 0.055 2
1 452 . 1 1 A 48 48 VAL HA H 46 4.024 3.473 0.551 2
1 460 . 1 1 A 48 48 VAL C C 46 175.697 177.478 -1.781 2
1 461 . 1 1 A 48 48 VAL CA C 46 61.841 65.578 -3.737 2
1 462 . 1 1 A 48 48 VAL CB C 46 32.600 31.635 0.965 2
1 465 . 1 1 A 48 48 VAL N N 46 121.117 119.501 1.616 2
1 466 . 1 1 A 49 49 ALA H H 47 8.237 8.181 0.056 2
1 467 . 1 1 A 49 49 ALA HA H 47 4.281 4.096 0.185 2
1 471 . 1 1 A 49 49 ALA C C 47 177.173 178.528 -1.355 2
1 472 . 1 1 A 49 49 ALA CA C 47 52.207 54.956 -2.749 2
1 473 . 1 1 A 49 49 ALA CB C 47 19.064 18.363 0.701 2
1 474 . 1 1 A 49 49 ALA N N 47 126.817 122.481 4.336 2
1 475 . 1 1 A 50 50 ASP H H 48 8.029 8.522 -0.493 2
1 476 . 1 1 A 50 50 ASP HA H 48 4.436 4.520 -0.084 2
1 479 . 1 1 A 50 50 ASP C C 48 176.124 176.841 -0.717 2
1 480 . 1 1 A 50 50 ASP CA C 48 54.447 54.170 0.277 2
1 481 . 1 1 A 50 50 ASP CB C 48 40.877 39.799 1.078 2
1 482 . 1 1 A 50 50 ASP N N 48 119.687 117.969 1.718 2
1 483 . 1 1 A 51 51 ALA H H 49 8.094 8.319 -0.225 2
1 484 . 1 1 A 51 51 ALA HA H 49 4.134 4.280 -0.146 2
1 488 . 1 1 A 51 51 ALA C C 49 177.835 178.661 -0.826 2
1 489 . 1 1 A 51 51 ALA CA C 49 52.900 52.641 0.259 2
1 490 . 1 1 A 51 51 ALA CB C 49 18.942 19.740 -0.798 2
1 491 . 1 1 A 51 51 ALA N N 49 124.400 122.776 1.624 2
1 492 . 1 1 A 52 52 GLU H H 50 8.243 7.940 0.303 2
1 493 . 1 1 A 52 52 GLU HA H 50 4.152 4.260 -0.108 2
1 497 . 1 1 A 52 52 GLU C C 50 176.456 177.191 -0.735 2
1 498 . 1 1 A 52 52 GLU CA C 50 56.480 57.915 -1.435 2
1 499 . 1 1 A 52 52 GLU CB C 50 29.470 29.591 -0.121 2
1 501 . 1 1 A 52 52 GLU N N 50 118.917 116.769 2.148 2
1 502 . 1 1 A 53 53 LEU H H 51 7.839 7.689 0.150 2
1 503 . 1 1 A 53 53 LEU HA H 51 4.229 4.282 -0.053 2
1 513 . 1 1 A 53 53 LEU C C 51 177.058 176.894 0.164 2
1 514 . 1 1 A 53 53 LEU CA C 51 54.625 55.546 -0.921 2
1 515 . 1 1 A 53 53 LEU CB C 51 42.125 42.454 -0.329 2
1 519 . 1 1 A 53 53 LEU N N 51 122.169 119.219 2.950 2
1 520 . 1 1 A 54 54 GLU H H 52 8.104 8.465 -0.361 2
1 521 . 1 1 A 54 54 GLU HA H 52 4.470 4.403 0.067 2
1 525 . 1 1 A 54 54 GLU CA C 52 54.286 57.518 -3.232 2
1 526 . 1 1 A 54 54 GLU CB C 52 29.268 29.791 -0.523 2
1 528 . 1 1 A 54 54 GLU N N 52 123.040 117.650 5.390 2
1 529 . 1 1 A 55 55 PRO HA H 53 4.310 4.529 -0.219 2
1 536 . 1 1 A 55 55 PRO C C 53 177.019 176.725 0.294 2
1 537 . 1 1 A 55 55 PRO CA C 53 63.075 63.059 0.016 2
1 538 . 1 1 A 55 55 PRO CB C 53 31.329 30.992 0.337 2
1 541 . 1 1 A 56 56 LEU H H 54 8.263 8.439 -0.176 2
1 542 . 1 1 A 56 56 LEU HA H 54 4.237 4.456 -0.219 2
1 552 . 1 1 A 56 56 LEU C C 54 178.055 177.162 0.893 2
1 553 . 1 1 A 56 56 LEU CA C 54 55.018 55.276 -0.258 2
1 554 . 1 1 A 56 56 LEU CB C 54 41.990 42.977 -0.987 2
1 558 . 1 1 A 56 56 LEU N N 54 122.728 122.125 0.603 2
1 559 . 1 1 A 57 57 GLY H H 55 8.231 8.529 -0.298 2
1 560 . 1 1 A 57 57 GLY HA2 H 55 3.911 4.042 -0.131 2
1 561 . 1 1 A 57 57 GLY HA3 H 55 3.808 4.051 -0.243 2
1 562 . 1 1 A 57 57 GLY C C 55 174.379 175.025 -0.646 2
1 563 . 1 1 A 57 57 GLY CA C 55 45.092 45.393 -0.301 2
1 564 . 1 1 A 57 57 GLY N N 55 110.035 109.518 0.517 2
1 565 . 1 1 A 58 58 GLU H H 56 8.241 8.613 -0.372 2
1 566 . 1 1 A 58 58 GLU HA H 56 4.136 4.068 0.068 2
1 570 . 1 1 A 58 58 GLU C C 56 176.868 177.613 -0.745 2
1 571 . 1 1 A 58 58 GLU CA C 56 56.734 58.967 -2.233 2
1 572 . 1 1 A 58 58 GLU CB C 56 29.584 28.952 0.632 2
1 574 . 1 1 A 58 58 GLU N N 56 121.173 117.806 3.367 2
1 575 . 1 1 A 59 59 GLU H H 57 8.419 8.589 -0.170 2
1 576 . 1 1 A 59 59 GLU HA H 57 4.074 4.155 -0.081 2
1 580 . 1 1 A 59 59 GLU C C 57 176.502 177.063 -0.561 2
1 581 . 1 1 A 59 59 GLU CA C 57 56.842 58.531 -1.689 2
1 582 . 1 1 A 59 59 GLU CB C 57 29.267 29.481 -0.214 2
1 584 . 1 1 A 59 59 GLU N N 57 121.777 119.677 2.100 2
1 585 . 1 1 A 60 60 ALA H H 58 8.077 7.808 0.269 2
1 586 . 1 1 A 60 60 ALA HA H 58 4.134 4.378 -0.244 2
1 590 . 1 1 A 60 60 ALA CA C 58 52.432 52.029 0.403 2
1 591 . 1 1 A 60 60 ALA CB C 58 18.743 19.476 -0.733 2
1 592 . 1 1 A 60 60 ALA N N 58 125.120 122.104 3.016 2
1 593 . 1 1 A 61 61 ALA H H 59 8.041 8.396 -0.355 2
1 594 . 1 1 A 61 61 ALA HA H 59 4.131 4.265 -0.134 2
1 598 . 1 1 A 61 61 ALA C C 59 178.147 177.886 0.261 2
1 599 . 1 1 A 61 61 ALA CA C 59 52.586 52.953 -0.367 2
1 600 . 1 1 A 61 61 ALA CB C 59 18.692 19.726 -1.034 2
1 601 . 1 1 A 61 61 ALA N N 59 123.857 122.653 1.204 2
1 602 . 1 1 A 62 62 GLY H H 60 8.069 8.385 -0.316 2
1 603 . 1 1 A 62 62 GLY HA2 H 60 3.810 4.003 -0.193 2
1 604 . 1 1 A 62 62 GLY HA3 H 60 3.888 4.030 -0.142 2
1 605 . 1 1 A 62 62 GLY C C 60 174.914 174.658 0.256 2
1 606 . 1 1 A 62 62 GLY CA C 60 45.320 46.084 -0.764 2
1 607 . 1 1 A 62 62 GLY N N 60 107.924 107.474 0.450 2
1 608 . 1 1 A 63 63 GLY H H 61 8.118 8.077 0.041 2
1 609 . 1 1 A 63 63 GLY HA2 H 61 4.008 4.137 -0.129 2
1 610 . 1 1 A 63 63 GLY HA3 H 61 3.893 4.197 -0.304 2
1 611 . 1 1 A 63 63 GLY C C 61 174.743 175.075 -0.332 2
1 612 . 1 1 A 63 63 GLY CA C 61 45.202 46.023 -0.821 2
1 613 . 1 1 A 63 63 GLY N N 61 109.441 107.638 1.803 2
1 614 . 1 1 A 64 64 ASP H H 62 8.305 8.542 -0.237 2
1 615 . 1 1 A 64 64 ASP HA H 62 4.240 4.281 -0.041 2
1 618 . 1 1 A 64 64 ASP C C 62 177.571 178.260 -0.689 2
1 619 . 1 1 A 64 64 ASP CA C 62 57.210 57.211 -0.001 2
1 620 . 1 1 A 64 64 ASP CB C 62 40.142 40.203 -0.061 2
1 621 . 1 1 A 64 64 ASP N N 62 121.568 120.535 1.033 2
1 622 . 1 1 A 65 65 GLN H H 63 8.337 8.120 0.217 2
1 623 . 1 1 A 65 65 GLN HA H 63 4.138 4.024 0.114 2
1 628 . 1 1 A 65 65 GLN C C 63 177.490 178.707 -1.217 2
1 629 . 1 1 A 65 65 GLN CA C 63 58.643 58.793 -0.150 2
1 630 . 1 1 A 65 65 GLN CB C 63 27.803 28.477 -0.674 2
1 632 . 1 1 A 65 65 GLN N N 63 119.700 119.070 0.630 2
1 633 . 1 1 A 66 66 PHE H H 64 7.658 8.225 -0.567 2
1 634 . 1 1 A 66 66 PHE HA H 64 4.170 4.277 -0.107 2
1 638 . 1 1 A 66 66 PHE C C 64 176.872 177.833 -0.961 2
1 639 . 1 1 A 66 66 PHE CA C 64 60.158 61.126 -0.968 2
1 640 . 1 1 A 66 66 PHE CB C 64 38.490 38.738 -0.248 2
1 643 . 1 1 A 66 66 PHE N N 64 121.036 119.783 1.253 2
1 644 . 1 1 A 67 67 ILE H H 65 7.646 8.736 -1.090 2
1 645 . 1 1 A 67 67 ILE HA H 65 3.426 3.492 -0.066 2
1 655 . 1 1 A 67 67 ILE CA C 65 63.377 64.848 -1.471 2
1 656 . 1 1 A 67 67 ILE CB C 65 37.057 37.614 -0.557 2
1 660 . 1 1 A 67 67 ILE N N 65 121.372 119.688 1.684 2
1 661 . 1 1 A 68 68 HIS H H 66 7.945 8.276 -0.331 2
1 662 . 1 1 A 68 68 HIS HA H 66 4.005 4.200 -0.195 2
1 665 . 1 1 A 68 68 HIS CA C 66 59.915 59.546 0.369 2
1 668 . 1 1 A 68 68 HIS N N 66 120.036 120.069 -0.033 2
1 669 . 1 1 A 69 69 GLU HA H 67 3.677 3.909 -0.232 2
1 673 . 1 1 A 69 69 GLU CA C 67 58.490 59.707 -1.217 2
1 674 . 1 1 A 69 69 GLU CB C 67 29.290 29.249 0.041 2
1 676 . 1 1 A 70 70 GLN H H 68 8.017 7.843 0.174 2
1 677 . 1 1 A 70 70 GLN HA H 68 3.426 3.913 -0.487 2
1 678 . 1 1 A 70 70 GLN C C 68 179.280 178.584 0.696 2
1 679 . 1 1 A 70 70 GLN CA C 68 57.561 58.663 -1.102 2
1 680 . 1 1 A 70 70 GLN CB C 68 28.530 28.263 0.267 2
1 682 . 1 1 A 70 70 GLN N N 68 120.410 118.672 1.738 2
1 683 . 1 1 A 71 71 ASP HA H 69 4.440 4.879 -0.439 2
1 684 . 1 1 A 71 71 ASP C C 69 177.402 178.812 -1.410 2
1 685 . 1 1 A 71 71 ASP CA C 69 56.290 57.408 -1.118 2
1 686 . 1 1 A 72 72 LEU H H 70 7.952 8.446 -0.494 2
1 687 . 1 1 A 72 72 LEU HA H 70 3.775 3.902 -0.127 2
1 697 . 1 1 A 72 72 LEU C C 70 178.316 178.411 -0.095 2
1 698 . 1 1 A 72 72 LEU CA C 70 56.101 57.642 -1.541 2
1 699 . 1 1 A 72 72 LEU CB C 70 39.872 41.267 -1.395 2
1 703 . 1 1 A 72 72 LEU N N 70 120.832 120.769 0.063 2
1 704 . 1 1 A 73 73 ASN H H 71 7.723 8.210 -0.487 2
1 705 . 1 1 A 73 73 ASN HA H 71 4.270 4.346 -0.076 2
1 708 . 1 1 A 73 73 ASN C C 71 178.193 177.898 0.295 2
1 709 . 1 1 A 73 73 ASN CA C 71 55.970 56.377 -0.407 2
1 710 . 1 1 A 73 73 ASN CB C 71 37.640 38.818 -1.178 2
1 711 . 1 1 A 73 73 ASN N N 71 119.295 116.880 2.415 2
1 712 . 1 1 A 74 74 TRP H H 72 7.811 8.275 -0.464 2
1 713 . 1 1 A 74 74 TRP HA H 72 4.500 4.481 0.019 2
1 720 . 1 1 A 74 74 TRP CA C 72 58.480 59.880 -1.400 2
1 721 . 1 1 A 74 74 TRP CB C 72 28.920 29.614 -0.694 2
1 727 . 1 1 A 74 74 TRP N N 72 121.490 120.476 1.014 2
1 729 . 1 1 A 75 75 LEU H H 73 8.412 8.387 0.025 2
1 730 . 1 1 A 75 75 LEU HA H 73 3.290 3.440 -0.150 2
1 739 . 1 1 A 75 75 LEU C C 73 178.562 178.570 -0.008 2
1 740 . 1 1 A 75 75 LEU CA C 73 58.226 57.535 0.691 2
1 741 . 1 1 A 75 75 LEU CB C 73 41.200 41.025 0.175 2
1 745 . 1 1 A 75 75 LEU N N 73 121.065 121.155 -0.090 2
1 746 . 1 1 A 76 76 GLN H H 74 7.648 7.822 -0.174 2
1 747 . 1 1 A 76 76 GLN HA H 74 3.657 4.075 -0.418 2
1 752 . 1 1 A 76 76 GLN C C 74 178.616 177.602 1.014 2
1 753 . 1 1 A 76 76 GLN CA C 74 58.777 58.750 0.027 2
1 754 . 1 1 A 76 76 GLN CB C 74 28.163 28.336 -0.173 2
1 756 . 1 1 A 76 76 GLN N N 74 113.985 118.623 -4.638 2
1 757 . 1 1 A 77 77 GLN H H 75 7.465 7.784 -0.319 2
1 758 . 1 1 A 77 77 GLN HA H 75 4.134 4.415 -0.281 2
1 761 . 1 1 A 77 77 GLN C C 75 176.223 175.891 0.332 2
1 762 . 1 1 A 77 77 GLN CA C 75 56.203 55.648 0.555 2
1 763 . 1 1 A 77 77 GLN CB C 75 29.524 29.115 0.409 2
1 765 . 1 1 A 77 77 GLN N N 75 117.481 116.401 1.080 2
1 766 . 1 1 A 78 78 ALA H H 76 7.420 7.230 0.190 2
1 767 . 1 1 A 78 78 ALA HA H 76 3.864 4.287 -0.423 2
1 771 . 1 1 A 78 78 ALA C C 76 176.733 177.025 -0.292 2
1 772 . 1 1 A 78 78 ALA CA C 76 52.529 52.896 -0.367 2
1 773 . 1 1 A 78 78 ALA CB C 76 20.124 19.257 0.867 2
1 774 . 1 1 A 78 78 ALA N N 76 122.682 123.515 -0.833 2
1 775 . 1 1 A 79 79 ASP H H 77 9.028 9.041 -0.013 2
1 776 . 1 1 A 79 79 ASP HA H 77 4.673 4.662 0.011 2
1 779 . 1 1 A 79 79 ASP C C 77 175.740 176.203 -0.463 2
1 780 . 1 1 A 79 79 ASP CA C 77 56.383 56.693 -0.310 2
1 781 . 1 1 A 79 79 ASP CB C 77 42.826 42.596 0.230 2
1 782 . 1 1 A 79 79 ASP N N 77 119.887 122.593 -2.706 2
1 783 . 1 1 A 80 80 VAL H H 78 7.379 7.854 -0.475 2
1 784 . 1 1 A 80 80 VAL HA H 78 4.340 4.841 -0.501 2
1 792 . 1 1 A 80 80 VAL C C 78 175.321 174.434 0.887 2
1 793 . 1 1 A 80 80 VAL CA C 78 60.011 60.365 -0.354 2
1 794 . 1 1 A 80 80 VAL CB C 78 35.362 36.202 -0.840 2
1 797 . 1 1 A 80 80 VAL N N 78 114.152 117.689 -3.537 2
1 798 . 1 1 A 81 81 VAL H H 79 8.350 8.348 0.002 2
1 799 . 1 1 A 81 81 VAL HA H 79 4.799 4.910 -0.111 2
1 807 . 1 1 A 81 81 VAL C C 79 173.095 174.656 -1.561 2
1 808 . 1 1 A 81 81 VAL CA C 79 60.775 60.716 0.059 2
1 809 . 1 1 A 81 81 VAL CB C 79 32.824 35.356 -2.532 2
1 812 . 1 1 A 81 81 VAL N N 79 128.429 125.702 2.727 2
1 813 . 1 1 A 82 82 VAL H H 80 8.947 8.887 0.060 2
1 814 . 1 1 A 82 82 VAL HA H 80 4.947 4.819 0.128 2
1 822 . 1 1 A 82 82 VAL C C 80 173.522 174.381 -0.859 2
1 823 . 1 1 A 82 82 VAL CA C 80 59.684 60.301 -0.617 2
1 824 . 1 1 A 82 82 VAL CB C 80 33.702 34.868 -1.166 2
1 827 . 1 1 A 82 82 VAL N N 80 126.957 126.358 0.599 2
1 828 . 1 1 A 83 83 ALA H H 81 9.011 8.736 0.275 2
1 829 . 1 1 A 83 83 ALA HA H 81 4.938 5.051 -0.113 2
1 833 . 1 1 A 83 83 ALA C C 81 130.330 175.458 -45.128 2
1 834 . 1 1 A 83 83 ALA CA C 81 49.490 50.486 -0.996 2
1 835 . 1 1 A 83 83 ALA CB C 81 23.628 22.379 1.249 2
1 836 . 1 1 A 83 83 ALA N N 81 128.705 127.575 1.130 2
1 837 . 1 1 A 84 84 GLU H H 82 8.922 8.606 0.316 2
1 838 . 1 1 A 84 84 GLU HA H 82 4.937 4.775 0.162 2
1 839 . 1 1 A 84 84 GLU C C 82 177.673 176.275 1.398 2
1 840 . 1 1 A 84 84 GLU CA C 82 56.714 55.757 0.957 2
1 841 . 1 1 A 84 84 GLU CB C 82 29.882 31.067 -1.185 2
1 842 . 1 1 A 84 84 GLU N N 82 130.330 122.108 8.222 2
1 843 . 1 1 A 85 85 VAL H H 83 8.427 8.977 -0.550 2
1 844 . 1 1 A 85 85 VAL HA H 83 4.435 4.679 -0.244 2
1 852 . 1 1 A 85 85 VAL C C 83 174.252 176.078 -1.826 2
1 853 . 1 1 A 85 85 VAL CA C 83 59.896 61.563 -1.667 2
1 854 . 1 1 A 85 85 VAL CB C 83 29.968 33.288 -3.320 2
1 857 . 1 1 A 85 85 VAL N N 83 114.212 122.680 -8.468 2
1 858 . 1 1 A 86 86 THR H H 84 9.347 8.476 0.871 2
1 859 . 1 1 A 86 86 THR HA H 84 4.146 4.493 -0.347 2
1 864 . 1 1 A 86 86 THR C C 84 175.751 174.598 1.153 2
1 865 . 1 1 A 86 86 THR CA C 84 67.629 64.080 3.549 2
1 866 . 1 1 A 86 86 THR CB C 84 66.819 69.555 -2.736 2
1 868 . 1 1 A 86 86 THR N N 84 121.640 117.948 3.692 2
1 869 . 1 1 A 87 87 GLN H H 85 8.114 7.993 0.121 2
1 870 . 1 1 A 87 87 GLN HA H 85 4.736 4.651 0.085 2
1 874 . 1 1 A 87 87 GLN CA C 85 51.898 54.575 -2.677 2
1 875 . 1 1 A 87 87 GLN CB C 85 27.942 29.948 -2.006 2
1 877 . 1 1 A 87 87 GLN N N 85 120.367 120.039 0.328 2
1 878 . 1 1 A 88 88 PRO HA H 86 4.061 4.544 -0.483 2
1 885 . 1 1 A 88 88 PRO C C 86 176.436 175.783 0.653 2
1 886 . 1 1 A 88 88 PRO CA C 86 63.422 63.199 0.223 2
1 887 . 1 1 A 88 88 PRO CB C 86 31.925 31.912 0.013 2
1 889 . 1 1 A 89 89 SER H H 87 6.044 8.638 -2.594 2
1 890 . 1 1 A 89 89 SER HA H 87 4.630 4.948 -0.318 2
1 893 . 1 1 A 89 89 SER C C 87 175.612 174.011 1.601 2
1 894 . 1 1 A 89 89 SER CA C 87 56.800 57.345 -0.545 2
1 895 . 1 1 A 89 89 SER CB C 87 64.196 65.396 -1.200 2
1 896 . 1 1 A 89 89 SER N N 87 115.721 117.872 -2.151 2
1 897 . 1 1 A 90 90 LEU H H 88 9.702 8.826 0.876 2
1 898 . 1 1 A 90 90 LEU HA H 88 4.270 4.133 0.137 2
1 906 . 1 1 A 90 90 LEU C C 88 179.173 178.679 0.494 2
1 907 . 1 1 A 90 90 LEU CA C 88 57.402 57.489 -0.087 2
1 908 . 1 1 A 90 90 LEU CB C 88 43.642 42.307 1.335 2
1 911 . 1 1 A 90 90 LEU N N 88 130.488 127.118 3.370 2
1 912 . 1 1 A 91 91 GLY H H 89 8.354 8.499 -0.145 2
1 913 . 1 1 A 91 91 GLY HA2 H 89 3.680 3.849 -0.169 2
1 914 . 1 1 A 91 91 GLY HA3 H 89 3.584 3.866 -0.282 2
1 915 . 1 1 A 91 91 GLY C C 89 175.106 176.194 -1.088 2
1 916 . 1 1 A 91 91 GLY CA C 89 47.770 47.170 0.600 2
1 917 . 1 1 A 91 91 GLY N N 89 107.522 108.033 -0.511 2
1 918 . 1 1 A 92 92 VAL H H 90 7.906 8.087 -0.181 2
1 919 . 1 1 A 92 92 VAL HA H 90 3.940 3.786 0.154 2
1 927 . 1 1 A 92 92 VAL C C 90 178.467 178.116 0.351 2
1 928 . 1 1 A 92 92 VAL CA C 90 65.379 66.442 -1.063 2
1 929 . 1 1 A 92 92 VAL CB C 90 31.785 31.742 0.043 2
1 932 . 1 1 A 92 92 VAL N N 90 121.741 121.646 0.095 2
1 933 . 1 1 A 93 93 GLY H H 91 7.595 8.118 -0.523 2
1 934 . 1 1 A 93 93 GLY HA2 H 91 3.628 3.790 -0.162 2
1 935 . 1 1 A 93 93 GLY HA3 H 91 3.415 3.799 -0.384 2
1 936 . 1 1 A 93 93 GLY C C 91 174.022 175.454 -1.432 2
1 937 . 1 1 A 93 93 GLY CA C 91 48.319 47.449 0.870 2
1 938 . 1 1 A 93 93 GLY N N 91 104.629 107.541 -2.912 2
1 939 . 1 1 A 94 94 TYR H H 92 8.372 8.554 -0.182 2
1 940 . 1 1 A 94 94 TYR HA H 92 4.046 4.059 -0.013 2
1 943 . 1 1 A 94 94 TYR C C 92 177.458 177.853 -0.395 2
1 944 . 1 1 A 94 94 TYR CA C 92 61.760 60.753 1.007 2
1 945 . 1 1 A 94 94 TYR CB C 92 38.431 38.698 -0.267 2
1 948 . 1 1 A 94 94 TYR N N 92 123.383 123.463 -0.080 2
1 949 . 1 1 A 95 95 GLU H H 93 8.424 8.535 -0.111 2
1 950 . 1 1 A 95 95 GLU HA H 93 3.421 3.883 -0.462 2
1 951 . 1 1 A 95 95 GLU C C 93 178.590 179.347 -0.757 2
1 952 . 1 1 A 95 95 GLU CA C 93 60.211 59.176 1.035 2
1 953 . 1 1 A 95 95 GLU CB C 93 29.025 29.173 -0.148 2
1 954 . 1 1 A 95 95 GLU N N 93 120.181 118.638 1.543 2
1 955 . 1 1 A 96 96 LEU H H 94 8.210 8.279 -0.069 2
1 956 . 1 1 A 96 96 LEU HA H 94 3.830 3.978 -0.148 2
1 964 . 1 1 A 96 96 LEU C C 94 179.032 179.203 -0.171 2
1 965 . 1 1 A 96 96 LEU CA C 94 57.683 58.225 -0.542 2
1 966 . 1 1 A 96 96 LEU CB C 94 41.883 41.920 -0.037 2
1 970 . 1 1 A 96 96 LEU N N 94 118.091 120.715 -2.624 2
1 971 . 1 1 A 97 97 GLY H H 95 8.773 8.376 0.397 2
1 972 . 1 1 A 97 97 GLY C C 95 175.344 175.545 -0.201 2
1 973 . 1 1 A 97 97 GLY CA C 95 47.308 46.928 0.380 2
1 974 . 1 1 A 97 97 GLY N N 95 108.085 105.681 2.404 2
1 975 . 1 1 A 98 98 ARG H H 96 8.100 8.208 -0.108 2
1 976 . 1 1 A 98 98 ARG C C 96 179.692 178.308 1.384 2
1 977 . 1 1 A 98 98 ARG CA C 96 56.308 59.006 -2.698 2
1 978 . 1 1 A 98 98 ARG CB C 96 26.854 29.687 -2.833 2
1 979 . 1 1 A 98 98 ARG N N 96 118.156 121.785 -3.629 2
1 980 . 1 1 A 99 99 ALA H H 97 8.498 7.608 0.890 2
1 981 . 1 1 A 99 99 ALA HA H 97 3.640 4.041 -0.401 2
1 985 . 1 1 A 99 99 ALA C C 97 179.650 180.130 -0.480 2
1 986 . 1 1 A 99 99 ALA CA C 97 55.166 54.997 0.169 2
1 987 . 1 1 A 99 99 ALA CB C 97 18.604 18.441 0.163 2
1 988 . 1 1 A 99 99 ALA N N 97 122.310 121.639 0.671 2
1 989 . 1 1 A 100 100 VAL H H 98 8.597 8.295 0.302 2
1 990 . 1 1 A 100 100 VAL HA H 98 3.798 3.519 0.279 2
1 998 . 1 1 A 100 100 VAL C C 98 180.464 178.105 2.359 2
1 999 . 1 1 A 100 100 VAL CA C 98 65.664 66.667 -1.003 2
1 1000 . 1 1 A 100 100 VAL CB C 98 31.065 31.454 -0.389 2
1 1003 . 1 1 A 100 100 VAL N N 98 120.603 119.055 1.548 2
1 1004 . 1 1 A 101 101 ALA H H 99 7.280 7.825 -0.545 2
1 1005 . 1 1 A 101 101 ALA HA H 99 3.963 4.086 -0.123 2
1 1009 . 1 1 A 101 101 ALA C C 99 179.314 179.424 -0.110 2
1 1010 . 1 1 A 101 101 ALA CA C 99 54.367 54.913 -0.546 2
1 1011 . 1 1 A 101 101 ALA CB C 99 18.139 18.878 -0.739 2
1 1012 . 1 1 A 101 101 ALA N N 99 124.450 121.848 2.602 2
1 1013 . 1 1 A 102 102 LEU H H 100 7.200 8.097 -0.897 2
1 1014 . 1 1 A 102 102 LEU HA H 100 4.192 4.322 -0.130 2
1 1024 . 1 1 A 102 102 LEU C C 100 177.306 177.299 0.007 2
1 1025 . 1 1 A 102 102 LEU CA C 100 54.808 55.506 -0.698 2
1 1026 . 1 1 A 102 102 LEU CB C 100 42.880 42.969 -0.089 2
1 1030 . 1 1 A 102 102 LEU N N 100 116.834 115.139 1.695 2
1 1031 . 1 1 A 103 103 GLY H H 101 7.891 7.892 -0.001 2
1 1032 . 1 1 A 103 103 GLY HA2 H 101 3.941 3.946 -0.005 2
1 1033 . 1 1 A 103 103 GLY HA3 H 101 3.831 3.956 -0.125 2
1 1034 . 1 1 A 103 103 GLY C C 101 175.137 174.306 0.831 2
1 1035 . 1 1 A 103 103 GLY CA C 101 45.673 45.730 -0.057 2
1 1036 . 1 1 A 103 103 GLY N N 101 109.395 108.152 1.243 2
1 1037 . 1 1 A 104 104 LYS H H 102 7.337 8.256 -0.919 2
1 1038 . 1 1 A 104 104 LYS HA H 102 4.402 4.477 -0.075 2
1 1043 . 1 1 A 104 104 LYS CA C 102 52.136 56.375 -4.239 2
1 1044 . 1 1 A 104 104 LYS CB C 102 31.045 33.020 -1.975 2
1 1047 . 1 1 A 104 104 LYS N N 102 118.954 120.583 -1.629 2
1 1048 . 1 1 A 105 105 PRO HA H 103 4.781 4.578 0.203 2
1 1054 . 1 1 A 105 105 PRO CA C 103 62.791 63.014 -0.223 2
1 1055 . 1 1 A 105 105 PRO CB C 103 30.405 31.846 -1.441 2
1 1058 . 1 1 A 106 106 ILE H H 104 8.261 8.776 -0.515 2
1 1059 . 1 1 A 106 106 ILE HA H 104 4.680 4.524 0.156 2
1 1069 . 1 1 A 106 106 ILE C C 104 175.543 173.950 1.593 2
1 1070 . 1 1 A 106 106 ILE CA C 104 59.362 59.982 -0.620 2
1 1071 . 1 1 A 106 106 ILE CB C 104 43.738 39.475 4.263 2
1 1075 . 1 1 A 106 106 ILE N N 104 123.509 124.559 -1.050 2
1 1076 . 1 1 A 107 107 LEU H H 105 8.584 8.474 0.110 2
1 1077 . 1 1 A 107 107 LEU HA H 105 4.243 4.511 -0.268 2
1 1087 . 1 1 A 107 107 LEU C C 105 174.204 174.473 -0.269 2
1 1088 . 1 1 A 107 107 LEU CA C 105 52.863 53.220 -0.357 2
1 1089 . 1 1 A 107 107 LEU CB C 105 42.408 43.629 -1.221 2
1 1093 . 1 1 A 107 107 LEU N N 105 131.882 129.351 2.531 2
1 1094 . 1 1 A 108 108 CYS H H 106 8.679 8.820 -0.141 2
1 1095 . 1 1 A 108 108 CYS HA H 106 5.280 5.299 -0.019 2
1 1099 . 1 1 A 108 108 CYS C C 106 173.134 173.398 -0.264 2
1 1100 . 1 1 A 108 108 CYS CA C 106 57.290 57.013 0.277 2
1 1101 . 1 1 A 108 108 CYS CB C 106 29.559 29.863 -0.304 2
1 1102 . 1 1 A 108 108 CYS N N 106 122.904 125.641 -2.737 2
1 1103 . 1 1 A 109 109 LEU H H 107 8.987 8.797 0.190 2
1 1104 . 1 1 A 109 109 LEU HA H 107 5.120 5.676 -0.556 2
1 1112 . 1 1 A 109 109 LEU C C 107 174.500 175.777 -1.277 2
1 1113 . 1 1 A 109 109 LEU CA C 107 53.274 53.705 -0.431 2
1 1114 . 1 1 A 109 109 LEU CB C 107 43.450 45.001 -1.551 2
1 1118 . 1 1 A 109 109 LEU N N 107 124.653 124.118 0.535 2
1 1119 . 1 1 A 110 110 PHE H H 108 8.981 9.169 -0.188 2
1 1120 . 1 1 A 110 110 PHE HA H 108 4.846 5.851 -1.005 2
1 1125 . 1 1 A 110 110 PHE C C 108 172.231 173.338 -1.107 2
1 1126 . 1 1 A 110 110 PHE CA C 108 55.963 56.400 -0.437 2
1 1127 . 1 1 A 110 110 PHE CB C 108 43.270 42.697 0.573 2
1 1130 . 1 1 A 110 110 PHE N N 108 125.052 123.333 1.719 2
1 1131 . 1 1 A 111 111 ARG H H 109 7.461 8.561 -1.100 2
1 1132 . 1 1 A 111 111 ARG HA H 109 4.804 4.564 0.240 2
1 1136 . 1 1 A 111 111 ARG CA C 109 51.953 52.773 -0.820 2
1 1137 . 1 1 A 111 111 ARG CB C 109 30.008 30.482 -0.474 2
1 1140 . 1 1 A 111 111 ARG N N 109 128.034 124.942 3.092 2
1 1141 . 1 1 A 112 112 PRO C C 110 178.675 177.644 1.031 2
1 1142 . 1 1 A 112 112 PRO CA C 110 64.024 64.360 -0.336 2
1 1143 . 1 1 A 112 112 PRO CB C 110 31.416 31.891 -0.475 2
1 1144 . 1 1 A 113 113 GLN H H 111 8.188 8.610 -0.422 2
1 1145 . 1 1 A 113 113 GLN HA H 111 4.056 4.082 -0.026 2
1 1149 . 1 1 A 113 113 GLN C C 111 175.936 177.085 -1.149 2
1 1150 . 1 1 A 113 113 GLN CA C 111 57.144 57.952 -0.808 2
1 1151 . 1 1 A 113 113 GLN CB C 111 28.033 28.246 -0.213 2
1 1153 . 1 1 A 113 113 GLN N N 111 118.835 116.997 1.838 2
1 1154 . 1 1 A 114 114 SER H H 112 7.730 7.790 -0.060 2
1 1155 . 1 1 A 114 114 SER HA H 112 4.037 4.526 -0.489 2
1 1158 . 1 1 A 114 114 SER C C 112 175.750 174.919 0.831 2
1 1159 . 1 1 A 114 114 SER CA C 112 60.154 58.815 1.339 2
1 1160 . 1 1 A 114 114 SER CB C 112 64.282 64.486 -0.204 2
1 1161 . 1 1 A 114 114 SER N N 112 114.887 113.088 1.799 2
1 1162 . 1 1 A 115 115 GLY H H 113 8.005 8.023 -0.018 2
1 1163 . 1 1 A 115 115 GLY HA2 H 113 3.712 3.989 -0.277 2
1 1164 . 1 1 A 115 115 GLY HA3 H 113 4.130 4.143 -0.013 2
1 1165 . 1 1 A 115 115 GLY C C 113 173.945 175.337 -1.392 2
1 1166 . 1 1 A 115 115 GLY CA C 113 45.233 46.928 -1.695 2
1 1167 . 1 1 A 115 115 GLY N N 113 110.740 109.802 0.938 2
1 1168 . 1 1 A 116 116 ARG H H 114 7.665 8.412 -0.747 2
1 1169 . 1 1 A 116 116 ARG HA H 114 4.449 4.478 -0.029 2
1 1173 . 1 1 A 116 116 ARG C C 114 175.370 175.532 -0.162 2
1 1174 . 1 1 A 116 116 ARG CA C 114 55.080 56.115 -1.035 2
1 1175 . 1 1 A 116 116 ARG CB C 114 31.215 30.457 0.758 2
1 1178 . 1 1 A 116 116 ARG N N 114 119.983 119.139 0.844 2
1 1179 . 1 1 A 117 117 VAL H H 115 8.409 8.224 0.185 2
1 1180 . 1 1 A 117 117 VAL HA H 115 4.184 3.814 0.370 2
1 1188 . 1 1 A 117 117 VAL C C 115 175.980 175.137 0.843 2
1 1189 . 1 1 A 117 117 VAL CA C 115 61.167 62.148 -0.981 2
1 1190 . 1 1 A 117 117 VAL CB C 115 32.931 31.205 1.726 2
1 1193 . 1 1 A 117 117 VAL N N 115 122.240 116.682 5.558 2
1 1194 . 1 1 A 118 118 LEU H H 116 8.227 7.724 0.503 2
1 1195 . 1 1 A 118 118 LEU HA H 116 3.720 4.175 -0.455 2
1 1204 . 1 1 A 118 118 LEU C C 116 175.623 176.553 -0.930 2
1 1205 . 1 1 A 118 118 LEU CA C 116 54.555 55.779 -1.224 2
1 1206 . 1 1 A 118 118 LEU CB C 116 39.292 42.854 -3.562 2
1 1210 . 1 1 A 118 118 LEU N N 116 131.481 128.437 3.044 2
1 1211 . 1 1 A 119 119 SER H H 117 7.780 8.347 -0.567 2
1 1212 . 1 1 A 119 119 SER HA H 117 4.060 4.437 -0.377 2
1 1214 . 1 1 A 119 119 SER C C 117 175.782 175.355 0.427 2
1 1215 . 1 1 A 119 119 SER CA C 117 58.530 58.874 -0.344 2
1 1216 . 1 1 A 119 119 SER CB C 117 64.785 64.450 0.335 2
1 1217 . 1 1 A 119 119 SER N N 117 118.658 118.068 0.590 2
1 1218 . 1 1 A 120 120 ALA H H 118 8.955 8.956 -0.001 2
1 1219 . 1 1 A 120 120 ALA HA H 118 3.846 3.985 -0.139 2
1 1223 . 1 1 A 120 120 ALA C C 118 179.731 179.787 -0.056 2
1 1224 . 1 1 A 120 120 ALA CA C 118 54.927 55.363 -0.436 2
1 1225 . 1 1 A 120 120 ALA CB C 118 18.627 18.255 0.372 2
1 1226 . 1 1 A 120 120 ALA N N 118 134.119 128.672 5.447 2
1 1227 . 1 1 A 121 121 MET H H 119 7.718 8.047 -0.329 2
1 1228 . 1 1 A 121 121 MET HA H 119 4.130 4.162 -0.032 2
1 1235 . 1 1 A 121 121 MET C C 119 175.610 178.742 -3.132 2
1 1236 . 1 1 A 121 121 MET CA C 119 55.968 58.320 -2.352 2
1 1237 . 1 1 A 121 121 MET CB C 119 30.814 32.817 -2.003 2
1 1240 . 1 1 A 121 121 MET N N 119 115.424 116.606 -1.182 2
1 1241 . 1 1 A 122 122 ILE H H 120 6.451 8.053 -1.602 2
1 1242 . 1 1 A 122 122 ILE HA H 120 3.392 3.630 -0.238 2
1 1252 . 1 1 A 122 122 ILE C C 120 177.108 178.002 -0.894 2
1 1253 . 1 1 A 122 122 ILE CA C 120 59.650 64.802 -5.152 2
1 1254 . 1 1 A 122 122 ILE CB C 120 34.640 37.611 -2.971 2
1 1258 . 1 1 A 122 122 ILE N N 120 113.418 119.461 -6.043 2
1 1259 . 1 1 A 123 123 ARG H H 121 7.540 8.426 -0.886 2
1 1260 . 1 1 A 123 123 ARG HA H 121 3.551 4.025 -0.474 2
1 1264 . 1 1 A 123 123 ARG C C 121 179.642 179.176 0.466 2
1 1265 . 1 1 A 123 123 ARG CA C 121 59.242 59.536 -0.294 2
1 1266 . 1 1 A 123 123 ARG CB C 121 29.087 29.758 -0.671 2
1 1269 . 1 1 A 123 123 ARG N N 121 116.248 120.339 -4.091 2
1 1270 . 1 1 A 124 124 GLY H H 122 8.086 8.683 -0.597 2
1 1271 . 1 1 A 124 124 GLY C C 122 172.357 175.944 -3.587 2
1 1272 . 1 1 A 124 124 GLY CA C 122 44.836 46.968 -2.132 2
1 1273 . 1 1 A 124 124 GLY N N 122 104.381 107.813 -3.432 2
1 1274 . 1 1 A 125 125 ALA H H 123 6.411 7.892 -1.481 2
1 1275 . 1 1 A 125 125 ALA HA H 123 2.441 3.848 -1.407 2
1 1279 . 1 1 A 125 125 ALA C C 123 176.908 178.081 -1.173 2
1 1280 . 1 1 A 125 125 ALA CA C 123 51.593 54.080 -2.487 2
1 1281 . 1 1 A 125 125 ALA CB C 123 16.997 18.002 -1.005 2
1 1282 . 1 1 A 125 125 ALA N N 123 123.136 123.798 -0.662 2
1 1283 . 1 1 A 126 126 ALA H H 124 6.190 7.581 -1.391 2
1 1284 . 1 1 A 126 126 ALA HA H 124 3.829 4.551 -0.722 2
1 1288 . 1 1 A 126 126 ALA C C 124 177.535 177.168 0.367 2
1 1289 . 1 1 A 126 126 ALA CA C 124 52.403 52.596 -0.193 2
1 1290 . 1 1 A 126 126 ALA CB C 124 18.375 19.311 -0.936 2
1 1291 . 1 1 A 126 126 ALA N N 124 117.999 119.590 -1.591 2
1 1292 . 1 1 A 127 127 ASP H H 125 8.877 8.655 0.222 2
1 1293 . 1 1 A 127 127 ASP HA H 125 4.665 4.746 -0.081 2
1 1296 . 1 1 A 127 127 ASP C C 125 177.795 176.540 1.255 2
1 1297 . 1 1 A 127 127 ASP CA C 125 52.855 54.605 -1.750 2
1 1298 . 1 1 A 127 127 ASP CB C 125 41.814 41.469 0.345 2
1 1299 . 1 1 A 127 127 ASP N N 125 121.828 120.974 0.854 2
1 1300 . 1 1 A 128 128 GLY H H 126 7.954 8.289 -0.335 2
1 1301 . 1 1 A 128 128 GLY HA2 H 126 3.830 4.082 -0.252 2
1 1302 . 1 1 A 128 128 GLY HA3 H 126 4.249 4.129 0.120 2
1 1303 . 1 1 A 128 128 GLY C C 126 173.822 174.133 -0.311 2
1 1304 . 1 1 A 128 128 GLY CA C 126 45.549 45.791 -0.242 2
1 1305 . 1 1 A 128 128 GLY N N 126 108.814 108.211 0.603 2
1 1306 . 1 1 A 129 129 SER H H 127 8.547 8.287 0.260 2
1 1307 . 1 1 A 129 129 SER HA H 127 4.486 4.687 -0.201 2
1 1309 . 1 1 A 129 129 SER C C 127 174.178 174.763 -0.585 2
1 1310 . 1 1 A 129 129 SER CA C 127 58.653 58.500 0.153 2
1 1311 . 1 1 A 129 129 SER CB C 127 63.316 63.366 -0.050 2
1 1312 . 1 1 A 129 129 SER N N 127 115.599 115.039 0.560 2
1 1313 . 1 1 A 130 130 ARG H H 128 8.795 8.542 0.253 2
1 1314 . 1 1 A 130 130 ARG HA H 128 4.160 4.268 -0.108 2
1 1318 . 1 1 A 130 130 ARG C C 128 175.518 175.371 0.147 2
1 1319 . 1 1 A 130 130 ARG CA C 128 58.479 57.426 1.053 2
1 1320 . 1 1 A 130 130 ARG CB C 128 29.952 30.553 -0.601 2
1 1323 . 1 1 A 130 130 ARG N N 128 127.611 118.450 9.161 2
1 1324 . 1 1 A 131 131 PHE H H 129 9.315 8.053 1.262 2
1 1325 . 1 1 A 131 131 PHE HA H 129 4.878 5.059 -0.181 2
1 1331 . 1 1 A 131 131 PHE C C 129 175.058 173.958 1.100 2
1 1332 . 1 1 A 131 131 PHE CA C 129 55.953 56.764 -0.811 2
1 1333 . 1 1 A 131 131 PHE CB C 129 40.189 41.533 -1.344 2
1 1337 . 1 1 A 131 131 PHE N N 129 126.219 120.068 6.151 2
1 1338 . 1 1 A 132 132 GLN H H 130 8.160 8.141 0.019 2
1 1339 . 1 1 A 132 132 GLN HA H 130 5.013 5.055 -0.042 2
1 1343 . 1 1 A 132 132 GLN CA C 130 54.498 54.607 -0.109 2
1 1344 . 1 1 A 132 132 GLN CB C 130 32.106 33.050 -0.944 2
1 1346 . 1 1 A 132 132 GLN N N 130 125.589 126.005 -0.416 2
1 1347 . 1 1 A 133 133 VAL H H 131 8.689 8.907 -0.218 2
1 1348 . 1 1 A 133 133 VAL HA H 131 4.529 4.599 -0.070 2
1 1356 . 1 1 A 133 133 VAL C C 131 174.441 175.558 -1.117 2
1 1357 . 1 1 A 133 133 VAL CA C 131 60.758 61.739 -0.981 2
1 1358 . 1 1 A 133 133 VAL CB C 131 32.417 32.353 0.064 2
1 1361 . 1 1 A 133 133 VAL N N 131 122.441 123.430 -0.989 2
1 1362 . 1 1 A 134 134 TRP H H 132 9.256 9.362 -0.106 2
1 1363 . 1 1 A 134 134 TRP HA H 132 5.213 5.203 0.010 2
1 1371 . 1 1 A 134 134 TRP C C 132 174.575 175.908 -1.333 2
1 1372 . 1 1 A 134 134 TRP CA C 132 53.859 56.127 -2.268 2
1 1373 . 1 1 A 134 134 TRP CB C 132 31.311 31.470 -0.159 2
1 1379 . 1 1 A 134 134 TRP N N 132 130.303 128.144 2.159 2
1 1381 . 1 1 A 135 135 ASP H H 133 8.237 8.843 -0.606 2
1 1382 . 1 1 A 135 135 ASP HA H 133 6.018 5.928 0.090 2
1 1385 . 1 1 A 135 135 ASP C C 133 177.020 175.240 1.780 2
1 1386 . 1 1 A 135 135 ASP CA C 133 53.321 53.279 0.042 2
1 1387 . 1 1 A 135 135 ASP CB C 133 41.514 43.080 -1.566 2
1 1388 . 1 1 A 135 135 ASP N N 133 125.516 121.982 3.534 2
1 1389 . 1 1 A 136 136 TYR H H 134 9.058 8.388 0.670 2
1 1390 . 1 1 A 136 136 TYR HA H 134 4.970 5.278 -0.308 2
1 1394 . 1 1 A 136 136 TYR C C 134 172.324 173.017 -0.693 2
1 1395 . 1 1 A 136 136 TYR CA C 134 55.982 56.374 -0.392 2
1 1396 . 1 1 A 136 136 TYR CB C 134 42.265 40.512 1.753 2
1 1399 . 1 1 A 136 136 TYR N N 134 120.315 117.947 2.368 2
1 1400 . 1 1 A 137 137 ALA H H 135 8.521 8.582 -0.061 2
1 1401 . 1 1 A 137 137 ALA HA H 135 4.280 4.305 -0.025 2
1 1405 . 1 1 A 137 137 ALA C C 135 178.561 177.399 1.162 2
1 1406 . 1 1 A 137 137 ALA CA C 135 49.550 50.771 -1.221 2
1 1407 . 1 1 A 137 137 ALA CB C 135 19.998 22.408 -2.410 2
1 1408 . 1 1 A 137 137 ALA N N 135 123.386 121.674 1.712 2
1 1409 . 1 1 A 138 138 GLU H H 136 8.678 8.790 -0.112 2
1 1410 . 1 1 A 138 138 GLU HA H 136 3.777 4.200 -0.423 2
1 1414 . 1 1 A 138 138 GLU C C 136 177.624 177.798 -0.174 2
1 1415 . 1 1 A 138 138 GLU CA C 136 60.527 58.917 1.610 2
1 1416 . 1 1 A 138 138 GLU CB C 136 29.020 29.324 -0.304 2
1 1418 . 1 1 A 138 138 GLU N N 136 121.774 120.526 1.248 2
1 1419 . 1 1 A 139 139 GLY H H 137 8.666 8.578 0.088 2
1 1420 . 1 1 A 139 139 GLY HA2 H 137 3.872 4.004 -0.132 2
1 1421 . 1 1 A 139 139 GLY HA3 H 137 3.872 4.018 -0.146 2
1 1422 . 1 1 A 139 139 GLY C C 137 175.122 174.711 0.411 2
1 1423 . 1 1 A 139 139 GLY CA C 137 46.093 45.481 0.612 2
1 1424 . 1 1 A 139 139 GLY N N 137 106.053 108.175 -2.122 2
1 1425 . 1 1 A 140 140 GLU H H 138 8.305 9.197 -0.892 2
1 1426 . 1 1 A 140 140 GLU HA H 138 4.754 4.641 0.113 2
1 1430 . 1 1 A 140 140 GLU C C 138 177.819 177.361 0.458 2
1 1431 . 1 1 A 140 140 GLU CA C 138 55.049 56.170 -1.121 2
1 1432 . 1 1 A 140 140 GLU CB C 138 30.504 30.845 -0.341 2
1 1434 . 1 1 A 140 140 GLU N N 138 117.485 117.727 -0.242 2
1 1435 . 1 1 A 141 141 VAL H H 139 7.267 7.603 -0.336 2
1 1436 . 1 1 A 141 141 VAL HA H 139 3.422 3.885 -0.463 2
1 1444 . 1 1 A 141 141 VAL C C 139 175.454 177.380 -1.926 2
1 1445 . 1 1 A 141 141 VAL CA C 139 66.769 65.036 1.733 2
1 1446 . 1 1 A 141 141 VAL CB C 139 31.377 31.474 -0.097 2
1 1449 . 1 1 A 141 141 VAL N N 139 120.764 121.068 -0.304 2
1 1450 . 1 1 A 142 142 GLU H H 140 8.620 8.399 0.221 2
1 1451 . 1 1 A 142 142 GLU HA H 140 3.592 4.061 -0.469 2
1 1452 . 1 1 A 142 142 GLU C C 140 177.320 179.314 -1.994 2
1 1453 . 1 1 A 142 142 GLU CA C 140 62.607 59.208 3.399 2
1 1454 . 1 1 A 142 142 GLU CB C 140 26.759 29.148 -2.389 2
1 1455 . 1 1 A 142 142 GLU N N 140 120.048 121.017 -0.969 2
1 1456 . 1 1 A 143 143 THR H H 141 7.449 8.174 -0.725 2
1 1457 . 1 1 A 143 143 THR HA H 141 4.003 4.042 -0.039 2
1 1462 . 1 1 A 143 143 THR C C 141 177.258 176.264 0.994 2
1 1463 . 1 1 A 143 143 THR CA C 141 65.490 67.166 -1.676 2
1 1464 . 1 1 A 143 143 THR CB C 141 68.641 68.247 0.394 2
1 1466 . 1 1 A 143 143 THR N N 141 114.073 117.780 -3.707 2
1 1467 . 1 1 A 144 144 MET H H 142 7.992 8.200 -0.208 2
1 1468 . 1 1 A 144 144 MET HA H 142 4.316 4.347 -0.031 2
1 1476 . 1 1 A 144 144 MET C C 142 178.233 178.758 -0.525 2
1 1477 . 1 1 A 144 144 MET CA C 142 57.743 58.988 -1.245 2
1 1478 . 1 1 A 144 144 MET CB C 142 31.326 32.434 -1.108 2
1 1481 . 1 1 A 144 144 MET N N 142 120.595 118.785 1.810 2
1 1482 . 1 1 A 145 145 LEU H H 143 7.847 8.192 -0.345 2
1 1483 . 1 1 A 145 145 LEU HA H 143 3.919 3.830 0.089 2
1 1491 . 1 1 A 145 145 LEU C C 143 178.774 179.377 -0.603 2
1 1492 . 1 1 A 145 145 LEU CA C 143 57.877 58.036 -0.159 2
1 1493 . 1 1 A 145 145 LEU CB C 143 40.951 41.026 -0.075 2
1 1497 . 1 1 A 145 145 LEU N N 143 119.410 119.802 -0.392 2
1 1498 . 1 1 A 146 146 ASP H H 144 8.431 8.596 -0.165 2
1 1499 . 1 1 A 146 146 ASP HA H 144 4.312 4.561 -0.249 2
1 1502 . 1 1 A 146 146 ASP C C 144 178.129 179.120 -0.991 2
1 1503 . 1 1 A 146 146 ASP CA C 144 57.464 57.847 -0.383 2
1 1504 . 1 1 A 146 146 ASP CB C 144 39.548 40.958 -1.410 2
1 1505 . 1 1 A 146 146 ASP N N 144 119.837 120.335 -0.498 2
1 1506 . 1 1 A 147 147 ARG H H 145 7.949 8.529 -0.580 2
1 1507 . 1 1 A 147 147 ARG HA H 145 4.050 4.169 -0.119 2
1 1512 . 1 1 A 147 147 ARG C C 145 179.547 178.879 0.668 2
1 1513 . 1 1 A 147 147 ARG CA C 145 58.972 59.641 -0.669 2
1 1514 . 1 1 A 147 147 ARG CB C 145 29.798 30.561 -0.763 2
1 1517 . 1 1 A 147 147 ARG N N 145 119.173 119.614 -0.441 2
1 1518 . 1 1 A 148 148 TYR H H 146 8.128 8.238 -0.110 2
1 1519 . 1 1 A 148 148 TYR HA H 146 3.995 4.398 -0.403 2
1 1524 . 1 1 A 148 148 TYR C C 146 178.199 177.575 0.624 2
1 1525 . 1 1 A 148 148 TYR CA C 146 62.347 61.468 0.879 2
1 1526 . 1 1 A 148 148 TYR CB C 146 37.418 37.745 -0.327 2
1 1529 . 1 1 A 148 148 TYR N N 146 120.102 121.319 -1.217 2
1 1530 . 1 1 A 149 149 PHE H H 147 8.308 8.588 -0.280 2
1 1531 . 1 1 A 149 149 PHE HA H 147 4.013 4.351 -0.338 2
1 1535 . 1 1 A 149 149 PHE C C 147 177.574 178.389 -0.815 2
1 1536 . 1 1 A 149 149 PHE CA C 147 63.044 61.669 1.375 2
1 1537 . 1 1 A 149 149 PHE CB C 147 37.153 38.249 -1.096 2
1 1541 . 1 1 A 149 149 PHE N N 147 116.680 118.111 -1.431 2
1 1542 . 1 1 A 150 150 GLU H H 148 8.271 8.999 -0.728 2
1 1543 . 1 1 A 150 150 GLU HA H 148 4.030 4.014 0.016 2
1 1547 . 1 1 A 150 150 GLU C C 148 177.687 178.525 -0.838 2
1 1548 . 1 1 A 150 150 GLU CA C 148 58.746 59.759 -1.013 2
1 1549 . 1 1 A 150 150 GLU CB C 148 28.847 29.144 -0.297 2
1 1551 . 1 1 A 150 150 GLU N N 148 119.973 119.528 0.445 2
1 1552 . 1 1 A 151 151 ALA H H 149 6.992 7.678 -0.686 2
1 1553 . 1 1 A 151 151 ALA HA H 149 4.217 4.240 -0.023 2
1 1557 . 1 1 A 151 151 ALA C C 149 178.190 177.264 0.926 2
1 1558 . 1 1 A 151 151 ALA CA C 149 52.779 53.489 -0.710 2
1 1559 . 1 1 A 151 151 ALA CB C 149 19.087 18.649 0.438 2
1 1560 . 1 1 A 151 151 ALA N N 149 118.629 121.276 -2.647 2
1 1561 . 1 1 A 152 152 TYR H H 150 7.722 8.326 -0.604 2
1 1562 . 1 1 A 152 152 TYR HA H 150 4.137 4.817 -0.680 2
1 1567 . 1 1 A 152 152 TYR C C 150 175.703 175.483 0.220 2
1 1568 . 1 1 A 152 152 TYR CA C 150 59.260 58.213 1.047 2
1 1569 . 1 1 A 152 152 TYR CB C 150 39.165 40.022 -0.857 2
1 1572 . 1 1 A 152 152 TYR N N 150 118.767 115.731 3.036 2
1 1573 . 1 1 A 153 153 LEU H H 151 7.670 8.431 -0.761 2
1 1574 . 1 1 A 153 153 LEU HA H 151 4.145 4.203 -0.058 2
1 1584 . 1 1 A 153 153 LEU CA C 151 54.704 55.115 -0.411 2
1 1585 . 1 1 A 153 153 LEU CB C 151 40.520 41.916 -1.396 2
1 1589 . 1 1 A 153 153 LEU N N 151 122.313 122.223 0.090 2
1 1590 . 1 1 A 154 154 PRO HA H 152 4.258 4.402 -0.144 2
1 1597 . 1 1 A 154 154 PRO C C 152 177.496 178.070 -0.574 2
1 1598 . 1 1 A 154 154 PRO CA C 152 63.899 64.965 -1.066 2
1 1599 . 1 1 A 154 154 PRO CB C 152 31.080 31.389 -0.309 2
1 1602 . 1 1 A 155 155 GLN H H 153 8.023 8.386 -0.363 2
1 1603 . 1 1 A 155 155 GLN HA H 153 4.176 4.120 0.056 2
1 1607 . 1 1 A 155 155 GLN C C 153 176.636 177.626 -0.990 2
1 1608 . 1 1 A 155 155 GLN CA C 153 55.968 57.922 -1.954 2
1 1609 . 1 1 A 155 155 GLN CB C 153 28.723 28.443 0.280 2
1 1610 . 1 1 A 155 155 GLN N N 153 119.173 117.108 2.065 2
1 1611 . 1 1 A 156 156 LYS H H 154 8.113 7.981 0.132 2
1 1612 . 1 1 A 156 156 LYS HA H 154 4.196 4.126 0.070 2
1 1619 . 1 1 A 156 156 LYS C C 154 56.493 178.186 -121.693 2
1 1620 . 1 1 A 156 156 LYS CA C 154 56.493 58.582 -2.089 2
1 1621 . 1 1 A 156 156 LYS CB C 154 32.037 31.982 0.055 2
1 1625 . 1 1 A 156 156 LYS N N 154 122.788 118.767 4.021 2
1 1626 . 1 1 A 157 157 THR H H 155 8.013 7.790 0.223 2
1 1627 . 1 1 A 157 157 THR HA H 155 4.183 4.062 0.121 2
1 1632 . 1 1 A 157 157 THR C C 155 174.580 175.248 -0.668 2
1 1633 . 1 1 A 157 157 THR CA C 155 61.958 64.889 -2.931 2
1 1634 . 1 1 A 157 157 THR CB C 155 69.665 68.822 0.843 2
1 1636 . 1 1 A 157 157 THR N N 155 115.504 114.534 0.970 2
1 1637 . 1 1 A 158 158 ALA H H 156 8.170 7.728 0.442 2
1 1638 . 1 1 A 158 158 ALA HA H 156 4.220 4.355 -0.135 2
1 1642 . 1 1 A 158 158 ALA CA C 156 52.492 52.475 0.017 2
1 1643 . 1 1 A 158 158 ALA CB C 156 18.810 19.986 -1.176 2
1 1644 . 1 1 A 158 158 ALA N N 156 126.825 122.678 4.147 2
1 1645 . 1 1 A 159 159 SER H H 157 7.762 8.198 -0.436 2
1 1646 . 1 1 A 159 159 SER CA C 157 58.230 58.121 0.109 2
1 1647 . 1 1 A 159 159 SER CB C 157 63.440 64.799 -1.359 2
1 1648 . 1 1 A 159 159 SER N N 157 123.078 115.009 8.069 2
1 1649 . 1 1 A 162 162 HIS HA H 160 4.845 4.710 0.135 2
1 1652 . 1 1 A 162 162 HIS CA C 160 53.590 54.688 -1.098 2
1 1653 . 1 1 A 162 162 HIS CB C 160 29.398 29.430 -0.032 2
1 1654 . 1 1 A 163 163 PRO HA H 161 4.388 4.354 0.034 2
1 1660 . 1 1 A 163 163 PRO C C 161 177.018 176.949 0.069 2
1 1661 . 1 1 A 163 163 PRO CA C 161 63.118 64.110 -0.992 2
1 1662 . 1 1 A 163 163 PRO CB C 161 31.668 32.094 -0.426 2
1 1665 . 1 1 A 164 164 SER H H 162 8.418 8.151 0.267 2
1 1666 . 1 1 A 164 164 SER HA H 162 4.338 4.386 -0.048 2
1 1668 . 1 1 A 164 164 SER C C 162 173.327 174.791 -1.464 2
1 1669 . 1 1 A 164 164 SER CA C 162 58.202 59.209 -1.007 2
1 1670 . 1 1 A 164 164 SER CB C 162 64.080 63.661 0.419 2
1 1671 . 1 1 A 164 164 SER N N 162 117.485 114.863 2.622 2
stop_
save_