data_10242_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 10242
_Entry.PDB_ID 1X6D
_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 20
_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 1 . 1 1 1 A 7 7 GLY HA2 H 7 3.960 3.990 -0.030 1
1 2 . 1 1 1 A 7 7 GLY HA3 H 7 3.960 3.990 -0.030 1
1 3 . 1 1 1 A 7 7 GLY C C 7 174.009 173.241 0.768 1
1 4 . 1 1 1 A 7 7 GLY CA C 7 45.374 45.808 -0.434 1
1 5 . 1 1 1 A 8 8 ALA H H 8 8.163 8.452 -0.289 1
1 6 . 1 1 1 A 8 8 ALA HA H 8 4.381 4.955 -0.574 1
1 10 . 1 1 1 A 8 8 ALA C C 8 178.078 177.213 0.865 1
1 11 . 1 1 1 A 8 8 ALA CA C 8 52.677 50.433 2.244 1
1 12 . 1 1 1 A 8 8 ALA CB C 8 19.368 22.358 -2.990 1
1 13 . 1 1 1 A 8 8 ALA N N 8 123.721 126.839 -3.118 1
1 14 . 1 1 1 A 9 9 THR H H 9 8.142 8.655 -0.513 1
1 15 . 1 1 1 A 9 9 THR HA H 9 4.353 4.435 -0.082 1
1 20 . 1 1 1 A 9 9 THR C C 9 174.597 172.782 1.815 1
1 21 . 1 1 1 A 9 9 THR CA C 9 62.093 61.014 1.079 1
1 22 . 1 1 1 A 9 9 THR CB C 9 69.948 66.439 3.509 1
1 24 . 1 1 1 A 9 9 THR N N 9 113.761 116.210 -2.449 1
1 25 . 1 1 1 A 10 10 LEU H H 10 8.218 7.466 0.752 1
1 26 . 1 1 1 A 10 10 LEU HA H 10 4.169 4.904 -0.735 1
1 36 . 1 1 1 A 10 10 LEU C C 10 176.110 175.962 0.148 1
1 37 . 1 1 1 A 10 10 LEU CA C 10 61.099 53.495 7.604 1
1 38 . 1 1 1 A 10 10 LEU CB C 10 38.686 46.720 -8.034 1
1 42 . 1 1 1 A 10 10 LEU N N 10 123.516 122.071 1.445 1
1 43 . 1 1 1 A 11 11 LYS H H 11 8.496 8.967 -0.471 1
1 44 . 1 1 1 A 11 11 LYS HA H 11 4.891 4.528 0.363 1
1 49 . 1 1 1 A 11 11 LYS C C 11 175.794 175.911 -0.117 1
1 50 . 1 1 1 A 11 11 LYS CA C 11 55.652 57.175 -1.523 1
1 51 . 1 1 1 A 11 11 LYS CB C 11 29.444 35.264 -5.820 1
1 52 . 1 1 1 A 11 11 LYS N N 11 125.141 119.893 5.248 1
1 53 . 1 1 1 A 12 12 GLN HA H 12 4.315 4.496 -0.181 1
1 54 . 1 1 1 A 12 12 GLN C C 12 176.300 175.408 0.892 1
1 55 . 1 1 1 A 12 12 GLN CA C 12 56.286 55.190 1.096 1
1 56 . 1 1 1 A 12 12 GLN CB C 12 32.901 27.219 5.682 1
1 57 . 1 1 1 A 13 13 LEU H H 13 8.410 8.666 -0.256 1
1 58 . 1 1 1 A 13 13 LEU HA H 13 4.348 4.293 0.055 1
1 67 . 1 1 1 A 13 13 LEU C C 13 177.120 176.080 1.040 1
1 68 . 1 1 1 A 13 13 LEU CA C 13 55.142 55.950 -0.808 1
1 69 . 1 1 1 A 13 13 LEU CB C 13 42.352 42.121 0.231 1
1 73 . 1 1 1 A 13 13 LEU N N 13 124.340 127.104 -2.764 1
1 74 . 1 1 1 A 14 14 ASP H H 14 8.250 8.739 -0.489 1
1 75 . 1 1 1 A 14 14 ASP HA H 14 4.540 4.509 0.031 1
1 78 . 1 1 1 A 14 14 ASP C C 14 176.769 175.433 1.336 1
1 79 . 1 1 1 A 14 14 ASP CA C 14 54.772 55.997 -1.225 1
1 80 . 1 1 1 A 14 14 ASP CB C 14 41.322 40.148 1.174 1
1 81 . 1 1 1 A 14 14 ASP N N 14 120.493 126.740 -6.247 1
1 82 . 1 1 1 A 15 15 GLY H H 15 8.428 8.696 -0.268 1
1 83 . 1 1 1 A 15 15 GLY HA2 H 15 4.089 3.982 0.107 1
1 84 . 1 1 1 A 15 15 GLY HA3 H 15 3.874 3.984 -0.110 1
1 85 . 1 1 1 A 15 15 GLY C C 15 174.122 173.480 0.642 1
1 86 . 1 1 1 A 15 15 GLY CA C 15 45.972 46.231 -0.259 1
1 87 . 1 1 1 A 15 15 GLY N N 15 108.670 109.608 -0.938 1
1 88 . 1 1 1 A 16 16 ILE H H 16 7.727 7.553 0.174 1
1 89 . 1 1 1 A 16 16 ILE HA H 16 4.705 4.646 0.059 1
1 99 . 1 1 1 A 16 16 ILE C C 16 175.807 174.102 1.705 1
1 100 . 1 1 1 A 16 16 ILE CA C 16 60.703 59.786 0.917 1
1 101 . 1 1 1 A 16 16 ILE CB C 16 38.509 39.559 -1.050 1
1 105 . 1 1 1 A 16 16 ILE N N 16 120.267 120.728 -0.461 1
1 106 . 1 1 1 A 17 17 HIS H H 17 9.101 8.385 0.716 1
1 107 . 1 1 1 A 17 17 HIS HA H 17 4.782 5.208 -0.426 1
1 112 . 1 1 1 A 17 17 HIS C C 17 173.051 174.325 -1.274 1
1 113 . 1 1 1 A 17 17 HIS CA C 17 55.353 53.707 1.646 1
1 114 . 1 1 1 A 17 17 HIS CB C 17 32.468 32.577 -0.109 1
1 117 . 1 1 1 A 17 17 HIS N N 17 125.061 126.952 -1.891 1
1 118 . 1 1 1 A 18 18 VAL H H 18 8.427 8.636 -0.209 1
1 119 . 1 1 1 A 18 18 VAL HA H 18 4.375 4.037 0.338 1
1 127 . 1 1 1 A 18 18 VAL C C 18 174.702 175.147 -0.445 1
1 128 . 1 1 1 A 18 18 VAL CA C 18 62.035 62.915 -0.880 1
1 129 . 1 1 1 A 18 18 VAL CB C 18 32.325 32.213 0.112 1
1 132 . 1 1 1 A 18 18 VAL N N 18 127.069 128.297 -1.228 1
1 133 . 1 1 1 A 19 19 THR H H 19 9.272 8.135 1.137 1
1 134 . 1 1 1 A 19 19 THR HA H 19 4.512 4.776 -0.264 1
1 139 . 1 1 1 A 19 19 THR C C 19 172.784 173.404 -0.620 1
1 140 . 1 1 1 A 19 19 THR CA C 19 62.512 61.834 0.678 1
1 141 . 1 1 1 A 19 19 THR CB C 19 70.663 70.063 0.600 1
1 143 . 1 1 1 A 19 19 THR N N 19 126.619 122.377 4.242 1
1 144 . 1 1 1 A 20 20 ILE H H 20 8.737 9.196 -0.459 1
1 145 . 1 1 1 A 20 20 ILE HA H 20 4.870 4.586 0.284 1
1 155 . 1 1 1 A 20 20 ILE C C 20 175.315 174.609 0.706 1
1 156 . 1 1 1 A 20 20 ILE CA C 20 60.157 60.193 -0.036 1
1 157 . 1 1 1 A 20 20 ILE CB C 20 38.603 37.790 0.813 1
1 161 . 1 1 1 A 20 20 ILE N N 20 128.114 128.790 -0.676 1
1 162 . 1 1 1 A 21 21 LEU H H 21 8.902 8.686 0.216 1
1 163 . 1 1 1 A 21 21 LEU HA H 21 4.804 4.939 -0.135 1
1 173 . 1 1 1 A 21 21 LEU C C 21 175.565 175.320 0.245 1
1 174 . 1 1 1 A 21 21 LEU CA C 21 52.731 53.513 -0.782 1
1 175 . 1 1 1 A 21 21 LEU CB C 21 43.947 43.575 0.372 1
1 179 . 1 1 1 A 21 21 LEU N N 21 125.457 128.954 -3.497 1
1 180 . 1 1 1 A 22 22 HIS H H 22 8.577 9.095 -0.518 1
1 181 . 1 1 1 A 22 22 HIS HA H 22 5.013 5.097 -0.084 1
1 186 . 1 1 1 A 22 22 HIS C C 22 174.258 174.977 -0.719 1
1 187 . 1 1 1 A 22 22 HIS CA C 22 55.880 54.474 1.406 1
1 188 . 1 1 1 A 22 22 HIS CB C 22 30.901 30.707 0.194 1
1 191 . 1 1 1 A 22 22 HIS N N 22 122.595 123.790 -1.195 1
1 192 . 1 1 1 A 23 23 LYS H H 23 8.712 9.761 -1.049 1
1 193 . 1 1 1 A 23 23 LYS HA H 23 4.880 5.070 -0.190 1
1 202 . 1 1 1 A 23 23 LYS C C 23 174.265 175.350 -1.085 1
1 203 . 1 1 1 A 23 23 LYS CA C 23 54.314 54.166 0.148 1
1 204 . 1 1 1 A 23 23 LYS CB C 23 36.068 36.103 -0.035 1
1 208 . 1 1 1 A 23 23 LYS N N 23 120.814 120.821 -0.007 1
1 209 . 1 1 1 A 24 24 GLU H H 24 8.360 8.460 -0.100 1
1 210 . 1 1 1 A 24 24 GLU HA H 24 4.350 4.705 -0.355 1
1 215 . 1 1 1 A 24 24 GLU C C 24 177.843 176.930 0.913 1
1 216 . 1 1 1 A 24 24 GLU CA C 24 55.601 54.548 1.053 1
1 217 . 1 1 1 A 24 24 GLU CB C 24 30.512 31.603 -1.091 1
1 219 . 1 1 1 A 24 24 GLU N N 24 117.859 119.139 -1.280 1
1 220 . 1 1 1 A 25 25 GLU H H 25 9.146 8.847 0.299 1
1 221 . 1 1 1 A 25 25 GLU HA H 25 3.924 4.070 -0.146 1
1 226 . 1 1 1 A 25 25 GLU C C 25 177.809 177.544 0.265 1
1 227 . 1 1 1 A 25 25 GLU CA C 25 58.568 58.614 -0.046 1
1 228 . 1 1 1 A 25 25 GLU CB C 25 29.313 29.097 0.216 1
1 230 . 1 1 1 A 25 25 GLU N N 25 124.543 122.282 2.261 1
1 231 . 1 1 1 A 26 26 GLY H H 26 8.242 8.610 -0.368 1
1 232 . 1 1 1 A 26 26 GLY HA2 H 26 4.287 4.031 0.256 1
1 233 . 1 1 1 A 26 26 GLY HA3 H 26 3.407 4.031 -0.624 1
1 234 . 1 1 1 A 26 26 GLY C C 26 174.234 175.115 -0.881 1
1 235 . 1 1 1 A 26 26 GLY CA C 26 46.113 46.158 -0.045 1
1 236 . 1 1 1 A 26 26 GLY N N 26 115.394 114.021 1.373 1
1 237 . 1 1 1 A 27 27 ALA H H 27 7.432 8.015 -0.583 1
1 238 . 1 1 1 A 27 27 ALA HA H 27 4.402 4.311 0.091 1
1 242 . 1 1 1 A 27 27 ALA C C 27 178.138 178.215 -0.077 1
1 243 . 1 1 1 A 27 27 ALA CA C 27 52.273 52.177 0.096 1
1 244 . 1 1 1 A 27 27 ALA CB C 27 20.214 19.930 0.284 1
1 245 . 1 1 1 A 27 27 ALA N N 27 122.323 122.309 0.014 1
1 246 . 1 1 1 A 28 28 GLY H H 28 8.624 7.995 0.629 1
1 247 . 1 1 1 A 28 28 GLY HA2 H 28 4.134 4.057 0.077 1
1 248 . 1 1 1 A 28 28 GLY HA3 H 28 3.953 4.095 -0.142 1
1 249 . 1 1 1 A 28 28 GLY C C 28 174.069 175.074 -1.005 1
1 250 . 1 1 1 A 28 28 GLY CA C 28 44.546 44.766 -0.220 1
1 251 . 1 1 1 A 28 28 GLY N N 28 107.593 106.640 0.953 1
1 252 . 1 1 1 A 29 29 LEU H H 29 7.934 8.642 -0.708 1
1 253 . 1 1 1 A 29 29 LEU HA H 29 4.059 4.286 -0.227 1
1 263 . 1 1 1 A 29 29 LEU C C 29 177.548 176.786 0.762 1
1 264 . 1 1 1 A 29 29 LEU CA C 29 56.298 56.571 -0.273 1
1 265 . 1 1 1 A 29 29 LEU CB C 29 41.940 42.886 -0.946 1
1 269 . 1 1 1 A 29 29 LEU N N 29 115.495 121.442 -5.947 1
1 270 . 1 1 1 A 30 30 GLY H H 30 8.669 7.908 0.761 1
1 271 . 1 1 1 A 30 30 GLY HA2 H 30 4.264 4.066 0.198 1
1 272 . 1 1 1 A 30 30 GLY HA3 H 30 4.001 4.169 -0.168 1
1 273 . 1 1 1 A 30 30 GLY C C 30 175.296 173.136 2.160 1
1 274 . 1 1 1 A 30 30 GLY CA C 30 46.368 45.148 1.220 1
1 275 . 1 1 1 A 30 30 GLY N N 30 103.121 106.116 -2.995 1
1 276 . 1 1 1 A 31 31 PHE H H 31 7.044 7.466 -0.422 1
1 277 . 1 1 1 A 31 31 PHE HA H 31 4.541 4.502 0.039 1
1 285 . 1 1 1 A 31 31 PHE C C 31 171.141 172.884 -1.743 1
1 286 . 1 1 1 A 31 31 PHE CA C 31 55.704 55.119 0.585 1
1 287 . 1 1 1 A 31 31 PHE CB C 31 40.745 41.904 -1.159 1
1 293 . 1 1 1 A 31 31 PHE N N 31 115.404 115.335 0.069 1
1 294 . 1 1 1 A 32 32 SER H H 32 8.752 8.953 -0.201 1
1 295 . 1 1 1 A 32 32 SER HA H 32 4.990 5.037 -0.047 1
1 298 . 1 1 1 A 32 32 SER C C 32 175.049 172.806 2.243 1
1 299 . 1 1 1 A 32 32 SER CA C 32 55.001 56.155 -1.154 1
1 300 . 1 1 1 A 32 32 SER CB C 32 67.170 66.618 0.552 1
1 301 . 1 1 1 A 32 32 SER N N 32 113.639 115.047 -1.408 1
1 302 . 1 1 1 A 33 33 LEU H H 33 8.639 8.214 0.425 1
1 303 . 1 1 1 A 33 33 LEU HA H 33 5.573 5.016 0.557 1
1 313 . 1 1 1 A 33 33 LEU C C 33 175.827 175.433 0.394 1
1 314 . 1 1 1 A 33 33 LEU CA C 33 53.620 53.815 -0.195 1
1 315 . 1 1 1 A 33 33 LEU CB C 33 45.399 43.766 1.633 1
1 319 . 1 1 1 A 33 33 LEU N N 33 118.936 124.225 -5.289 1
1 320 . 1 1 1 A 34 34 ALA H H 34 9.410 9.042 0.368 1
1 321 . 1 1 1 A 34 34 ALA HA H 34 4.749 5.267 -0.518 1
1 325 . 1 1 1 A 34 34 ALA C C 34 176.231 176.769 -0.538 1
1 326 . 1 1 1 A 34 34 ALA CA C 34 50.425 51.332 -0.907 1
1 327 . 1 1 1 A 34 34 ALA CB C 34 22.518 22.990 -0.472 1
1 328 . 1 1 1 A 34 34 ALA N N 34 124.395 122.995 1.400 1
1 329 . 1 1 1 A 35 35 GLY H H 35 8.130 8.735 -0.605 1
1 330 . 1 1 1 A 35 35 GLY HA2 H 35 4.712 4.166 0.546 1
1 331 . 1 1 1 A 35 35 GLY HA3 H 35 3.955 4.179 -0.224 1
1 332 . 1 1 1 A 35 35 GLY C C 35 174.750 173.045 1.705 1
1 333 . 1 1 1 A 35 35 GLY CA C 35 44.494 44.883 -0.389 1
1 334 . 1 1 1 A 35 35 GLY N N 35 103.650 107.566 -3.916 1
1 335 . 1 1 1 A 36 36 GLY H H 36 8.217 8.112 0.105 1
1 336 . 1 1 1 A 36 36 GLY HA2 H 36 4.494 4.327 0.167 1
1 337 . 1 1 1 A 36 36 GLY HA3 H 36 3.836 4.357 -0.521 1
1 338 . 1 1 1 A 36 36 GLY C C 36 174.410 174.095 0.315 1
1 339 . 1 1 1 A 36 36 GLY CA C 36 45.462 46.030 -0.568 1
1 340 . 1 1 1 A 36 36 GLY N N 36 122.114 108.013 14.101 1
1 341 . 1 1 1 A 37 37 ALA H H 37 8.963 8.909 0.054 1
1 342 . 1 1 1 A 37 37 ALA HA H 37 3.998 4.149 -0.151 1
1 346 . 1 1 1 A 37 37 ALA C C 37 176.935 179.271 -2.336 1
1 347 . 1 1 1 A 37 37 ALA CA C 37 55.308 54.500 0.808 1
1 348 . 1 1 1 A 37 37 ALA CB C 37 18.822 18.638 0.184 1
1 349 . 1 1 1 A 37 37 ALA N N 37 123.418 122.038 1.380 1
1 350 . 1 1 1 A 38 38 ASP H H 38 10.586 8.273 2.313 1
1 351 . 1 1 1 A 38 38 ASP HA H 38 4.485 4.487 -0.002 1
1 354 . 1 1 1 A 38 38 ASP C C 38 175.309 176.487 -1.178 1
1 355 . 1 1 1 A 38 38 ASP CA C 38 52.730 56.320 -3.590 1
1 356 . 1 1 1 A 38 38 ASP CB C 38 38.689 40.897 -2.208 1
1 357 . 1 1 1 A 38 38 ASP N N 38 111.480 118.237 -6.757 1
1 358 . 1 1 1 A 39 39 LEU H H 39 7.789 7.868 -0.079 1
1 359 . 1 1 1 A 39 39 LEU HA H 39 4.699 4.502 0.197 1
1 369 . 1 1 1 A 39 39 LEU C C 39 176.377 177.712 -1.335 1
1 370 . 1 1 1 A 39 39 LEU CA C 39 52.952 54.096 -1.144 1
1 371 . 1 1 1 A 39 39 LEU CB C 39 43.294 42.434 0.860 1
1 375 . 1 1 1 A 39 39 LEU N N 39 122.545 121.640 0.905 1
1 376 . 1 1 1 A 40 40 GLU H H 40 8.331 8.538 -0.207 1
1 377 . 1 1 1 A 40 40 GLU HA H 40 3.978 4.174 -0.196 1
1 382 . 1 1 1 A 40 40 GLU C C 40 176.887 176.846 0.041 1
1 383 . 1 1 1 A 40 40 GLU CA C 40 59.066 58.711 0.355 1
1 384 . 1 1 1 A 40 40 GLU CB C 40 29.523 30.068 -0.545 1
1 386 . 1 1 1 A 40 40 GLU N N 40 118.036 120.134 -2.098 1
1 387 . 1 1 1 A 41 41 ASN H H 41 7.890 8.085 -0.195 1
1 388 . 1 1 1 A 41 41 ASN HA H 41 4.820 4.895 -0.075 1
1 393 . 1 1 1 A 41 41 ASN CA C 41 52.316 52.166 0.150 1
1 394 . 1 1 1 A 41 41 ASN CB C 41 37.409 38.679 -1.270 1
1 395 . 1 1 1 A 41 41 ASN N N 41 115.196 116.091 -0.895 1
1 397 . 1 1 1 A 42 42 LYS H H 42 7.943 8.572 -0.629 1
1 398 . 1 1 1 A 42 42 LYS HA H 42 4.328 4.318 0.010 1
1 407 . 1 1 1 A 42 42 LYS C C 42 177.081 177.205 -0.124 1
1 408 . 1 1 1 A 42 42 LYS CA C 42 56.567 59.302 -2.735 1
1 409 . 1 1 1 A 42 42 LYS CB C 42 33.120 32.436 0.684 1
1 413 . 1 1 1 A 42 42 LYS N N 42 120.612 123.487 -2.875 1
1 414 . 1 1 1 A 43 43 VAL H H 43 7.456 7.684 -0.228 1
1 415 . 1 1 1 A 43 43 VAL HA H 43 4.059 4.138 -0.079 1
1 423 . 1 1 1 A 43 43 VAL CA C 43 61.330 62.338 -1.008 1
1 424 . 1 1 1 A 43 43 VAL CB C 43 32.819 32.473 0.346 1
1 427 . 1 1 1 A 43 43 VAL N N 43 118.284 118.810 -0.526 1
1 428 . 1 1 1 A 44 44 ILE H H 44 8.481 8.576 -0.095 1
1 429 . 1 1 1 A 44 44 ILE HA H 44 4.913 4.688 0.225 1
1 439 . 1 1 1 A 44 44 ILE C C 44 176.719 175.821 0.898 1
1 440 . 1 1 1 A 44 44 ILE CA C 44 59.946 61.793 -1.847 1
1 441 . 1 1 1 A 44 44 ILE CB C 44 35.784 37.826 -2.042 1
1 445 . 1 1 1 A 44 44 ILE N N 44 127.089 129.012 -1.923 1
1 446 . 1 1 1 A 45 45 THR H H 45 8.906 9.537 -0.631 1
1 447 . 1 1 1 A 45 45 THR HA H 45 5.400 5.131 0.269 1
1 452 . 1 1 1 A 45 45 THR CA C 45 58.528 59.690 -1.162 1
1 453 . 1 1 1 A 45 45 THR CB C 45 73.760 71.686 2.074 1
1 455 . 1 1 1 A 45 45 THR N N 45 116.832 118.013 -1.181 1
1 456 . 1 1 1 A 46 46 VAL H H 46 8.336 8.726 -0.390 1
1 457 . 1 1 1 A 46 46 VAL HA H 46 4.059 4.197 -0.138 1
1 465 . 1 1 1 A 46 46 VAL C C 46 176.648 176.522 0.126 1
1 466 . 1 1 1 A 46 46 VAL CA C 46 63.058 63.113 -0.055 1
1 467 . 1 1 1 A 46 46 VAL CB C 46 31.601 30.914 0.687 1
1 470 . 1 1 1 A 46 46 VAL N N 46 118.542 122.417 -3.875 1
1 471 . 1 1 1 A 47 47 HIS H H 47 9.382 8.724 0.658 1
1 472 . 1 1 1 A 47 47 HIS HA H 47 4.628 4.188 0.440 1
1 477 . 1 1 1 A 47 47 HIS C C 47 174.339 174.405 -0.066 1
1 478 . 1 1 1 A 47 47 HIS CA C 47 57.764 59.895 -2.131 1
1 479 . 1 1 1 A 47 47 HIS CB C 47 31.453 30.625 0.828 1
1 482 . 1 1 1 A 47 47 HIS N N 47 133.900 128.247 5.653 1
1 483 . 1 1 1 A 48 48 ARG H H 48 7.135 7.771 -0.636 1
1 484 . 1 1 1 A 48 48 ARG HA H 48 4.360 4.852 -0.492 1
1 491 . 1 1 1 A 48 48 ARG C C 48 173.877 174.624 -0.747 1
1 492 . 1 1 1 A 48 48 ARG CA C 48 54.385 55.370 -0.985 1
1 493 . 1 1 1 A 48 48 ARG CB C 48 33.996 34.687 -0.691 1
1 496 . 1 1 1 A 48 48 ARG N N 48 114.736 117.805 -3.069 1
1 497 . 1 1 1 A 49 49 VAL H H 49 8.690 8.706 -0.016 1
1 498 . 1 1 1 A 49 49 VAL HA H 49 4.015 4.474 -0.459 1
1 506 . 1 1 1 A 49 49 VAL C C 49 176.255 175.580 0.675 1
1 507 . 1 1 1 A 49 49 VAL CA C 49 61.882 61.691 0.191 1
1 508 . 1 1 1 A 49 49 VAL CB C 49 32.261 33.223 -0.962 1
1 511 . 1 1 1 A 49 49 VAL N N 49 122.844 123.015 -0.171 1
1 512 . 1 1 1 A 50 50 PHE H H 50 7.866 8.357 -0.491 1
1 513 . 1 1 1 A 50 50 PHE HA H 50 4.866 4.530 0.336 1
1 521 . 1 1 1 A 50 50 PHE C C 50 174.847 176.340 -1.493 1
1 522 . 1 1 1 A 50 50 PHE CA C 50 54.596 57.529 -2.933 1
1 523 . 1 1 1 A 50 50 PHE CB C 50 36.558 38.986 -2.428 1
1 529 . 1 1 1 A 50 50 PHE N N 50 128.498 127.433 1.065 1
1 530 . 1 1 1 A 51 51 PRO HA H 51 4.386 4.552 -0.166 1
1 537 . 1 1 1 A 51 51 PRO C C 51 177.321 176.661 0.660 1
1 538 . 1 1 1 A 51 51 PRO CA C 51 64.381 64.548 -0.167 1
1 539 . 1 1 1 A 51 51 PRO CB C 51 31.773 32.224 -0.451 1
1 542 . 1 1 1 A 52 52 ASN H H 52 8.814 8.538 0.276 1
1 543 . 1 1 1 A 52 52 ASN HA H 52 4.496 5.005 -0.509 1
1 548 . 1 1 1 A 52 52 ASN C C 52 174.823 174.508 0.315 1
1 549 . 1 1 1 A 52 52 ASN CA C 52 54.719 52.227 2.492 1
1 550 . 1 1 1 A 52 52 ASN CB C 52 38.109 39.252 -1.143 1
1 551 . 1 1 1 A 52 52 ASN N N 52 116.145 116.234 -0.089 1
1 553 . 1 1 1 A 53 53 GLY H H 53 7.730 8.332 -0.602 1
1 554 . 1 1 1 A 53 53 GLY HA2 H 53 4.430 4.321 0.109 1
1 555 . 1 1 1 A 53 53 GLY HA3 H 53 4.089 4.338 -0.249 1
1 556 . 1 1 1 A 53 53 GLY C C 53 174.810 174.443 0.367 1
1 557 . 1 1 1 A 53 53 GLY CA C 53 44.987 45.648 -0.661 1
1 558 . 1 1 1 A 53 53 GLY N N 53 106.196 111.175 -4.979 1
1 559 . 1 1 1 A 54 54 LEU H H 54 8.764 8.792 -0.028 1
1 560 . 1 1 1 A 54 54 LEU HA H 54 4.041 4.074 -0.033 1
1 570 . 1 1 1 A 54 54 LEU C C 54 179.712 178.679 1.033 1
1 571 . 1 1 1 A 54 54 LEU CA C 54 58.310 57.694 0.616 1
1 572 . 1 1 1 A 54 54 LEU CB C 54 42.390 41.845 0.545 1
1 576 . 1 1 1 A 54 54 LEU N N 54 118.836 119.748 -0.912 1
1 577 . 1 1 1 A 55 55 ALA H H 55 7.593 8.276 -0.683 1
1 578 . 1 1 1 A 55 55 ALA HA H 55 4.275 3.900 0.375 1
1 582 . 1 1 1 A 55 55 ALA C C 55 181.307 180.013 1.294 1
1 583 . 1 1 1 A 55 55 ALA CA C 55 54.825 55.618 -0.793 1
1 584 . 1 1 1 A 55 55 ALA CB C 55 18.345 18.465 -0.120 1
1 585 . 1 1 1 A 55 55 ALA N N 55 118.782 121.869 -3.087 1
1 586 . 1 1 1 A 56 56 SER H H 56 9.339 8.145 1.194 1
1 587 . 1 1 1 A 56 56 SER HA H 56 4.023 4.099 -0.076 1
1 589 . 1 1 1 A 56 56 SER C C 56 176.392 177.231 -0.839 1
1 590 . 1 1 1 A 56 56 SER CA C 56 60.984 61.412 -0.428 1
1 591 . 1 1 1 A 56 56 SER CB C 56 62.987 62.921 0.066 1
1 592 . 1 1 1 A 56 56 SER N N 56 117.631 112.491 5.140 1
1 593 . 1 1 1 A 57 57 GLN H H 57 7.942 7.585 0.357 1
1 594 . 1 1 1 A 57 57 GLN HA H 57 4.034 4.004 0.030 1
1 601 . 1 1 1 A 57 57 GLN C C 57 177.400 178.323 -0.923 1
1 602 . 1 1 1 A 57 57 GLN CA C 57 58.362 59.237 -0.875 1
1 603 . 1 1 1 A 57 57 GLN CB C 57 28.801 28.316 0.485 1
1 605 . 1 1 1 A 57 57 GLN N N 57 118.162 121.214 -3.052 1
1 607 . 1 1 1 A 58 58 GLU H H 58 7.683 8.179 -0.496 1
1 608 . 1 1 1 A 58 58 GLU HA H 58 4.163 4.077 0.086 1
1 613 . 1 1 1 A 58 58 GLU C C 58 179.248 176.700 2.548 1
1 614 . 1 1 1 A 58 58 GLU CA C 58 59.559 58.663 0.896 1
1 615 . 1 1 1 A 58 58 GLU CB C 58 29.317 29.488 -0.171 1
1 617 . 1 1 1 A 58 58 GLU N N 58 119.877 119.349 0.528 1
1 618 . 1 1 1 A 59 59 GLY H H 59 7.446 7.752 -0.306 1
1 619 . 1 1 1 A 59 59 GLY HA2 H 59 4.100 3.985 0.115 1
1 620 . 1 1 1 A 59 59 GLY HA3 H 59 3.770 3.995 -0.225 1
1 621 . 1 1 1 A 59 59 GLY C C 59 175.432 175.185 0.247 1
1 622 . 1 1 1 A 59 59 GLY CA C 59 46.817 45.351 1.466 1
1 623 . 1 1 1 A 59 59 GLY N N 59 102.653 107.759 -5.106 1
1 624 . 1 1 1 A 60 60 THR H H 60 8.343 8.005 0.338 1
1 625 . 1 1 1 A 60 60 THR HA H 60 4.037 4.166 -0.129 1
1 630 . 1 1 1 A 60 60 THR C C 60 175.843 174.754 1.089 1
1 631 . 1 1 1 A 60 60 THR CA C 60 64.792 65.483 -0.691 1
1 632 . 1 1 1 A 60 60 THR CB C 60 69.325 69.326 -0.001 1
1 634 . 1 1 1 A 60 60 THR N N 60 113.863 113.014 0.849 1
1 635 . 1 1 1 A 61 61 ILE H H 61 8.802 7.603 1.199 1
1 636 . 1 1 1 A 61 61 ILE HA H 61 3.631 4.101 -0.470 1
1 646 . 1 1 1 A 61 61 ILE C C 61 174.198 174.437 -0.239 1
1 647 . 1 1 1 A 61 61 ILE CA C 61 62.938 60.920 2.018 1
1 648 . 1 1 1 A 61 61 ILE CB C 61 37.225 36.247 0.978 1
1 652 . 1 1 1 A 61 61 ILE N N 61 126.153 119.460 6.693 1
1 653 . 1 1 1 A 62 62 GLN H H 62 7.124 8.032 -0.908 1
1 654 . 1 1 1 A 62 62 GLN HA H 62 4.500 4.607 -0.107 1
1 661 . 1 1 1 A 62 62 GLN C C 62 174.556 175.413 -0.857 1
1 662 . 1 1 1 A 62 62 GLN CA C 62 53.364 54.171 -0.807 1
1 663 . 1 1 1 A 62 62 GLN CB C 62 32.196 31.321 0.875 1
1 665 . 1 1 1 A 62 62 GLN N N 62 123.730 126.447 -2.717 1
1 667 . 1 1 1 A 63 63 LYS H H 63 8.399 8.551 -0.152 1
1 668 . 1 1 1 A 63 63 LYS HA H 63 3.464 4.307 -0.843 1
1 677 . 1 1 1 A 63 63 LYS CA C 63 57.905 56.921 0.984 1
1 678 . 1 1 1 A 63 63 LYS CB C 63 32.260 32.214 0.046 1
1 682 . 1 1 1 A 63 63 LYS N N 63 121.381 123.899 -2.518 1
1 683 . 1 1 1 A 64 64 GLY H H 64 9.265 8.993 0.272 1
1 684 . 1 1 1 A 64 64 GLY HA2 H 64 4.415 3.999 0.416 1
1 685 . 1 1 1 A 64 64 GLY HA3 H 64 3.639 4.000 -0.361 1
1 686 . 1 1 1 A 64 64 GLY CA C 64 44.881 45.049 -0.168 1
1 687 . 1 1 1 A 64 64 GLY N N 64 113.750 112.954 0.796 1
1 688 . 1 1 1 A 65 65 ASN H H 65 7.594 8.627 -1.033 1
1 689 . 1 1 1 A 65 65 ASN HA H 65 4.798 4.657 0.141 1
1 694 . 1 1 1 A 65 65 ASN C C 65 175.042 174.004 1.038 1
1 695 . 1 1 1 A 65 65 ASN CA C 65 53.047 54.029 -0.982 1
1 696 . 1 1 1 A 65 65 ASN CB C 65 38.153 39.758 -1.605 1
1 697 . 1 1 1 A 65 65 ASN N N 65 117.999 120.344 -2.345 1
1 699 . 1 1 1 A 66 66 GLU H H 66 8.538 8.642 -0.104 1
1 700 . 1 1 1 A 66 66 GLU HA H 66 4.634 4.738 -0.104 1
1 705 . 1 1 1 A 66 66 GLU C C 66 176.620 175.346 1.274 1
1 706 . 1 1 1 A 66 66 GLU CA C 66 55.863 55.057 0.806 1
1 707 . 1 1 1 A 66 66 GLU CB C 66 30.899 31.379 -0.480 1
1 709 . 1 1 1 A 66 66 GLU N N 66 122.233 122.486 -0.253 1
1 710 . 1 1 1 A 67 67 VAL H H 67 8.452 9.138 -0.686 1
1 711 . 1 1 1 A 67 67 VAL HA H 67 4.172 4.215 -0.043 1
1 719 . 1 1 1 A 67 67 VAL C C 67 174.641 175.522 -0.881 1
1 720 . 1 1 1 A 67 67 VAL CA C 67 61.856 62.703 -0.847 1
1 721 . 1 1 1 A 67 67 VAL CB C 67 31.066 31.044 0.022 1
1 724 . 1 1 1 A 67 67 VAL N N 67 126.311 127.757 -1.446 1
1 725 . 1 1 1 A 68 68 LEU H H 68 9.000 8.814 0.186 1
1 726 . 1 1 1 A 68 68 LEU HA H 68 4.390 4.227 0.163 1
1 736 . 1 1 1 A 68 68 LEU C C 68 178.924 176.964 1.960 1
1 737 . 1 1 1 A 68 68 LEU CA C 68 56.990 56.466 0.524 1
1 738 . 1 1 1 A 68 68 LEU CB C 68 42.392 42.523 -0.131 1
1 742 . 1 1 1 A 68 68 LEU N N 68 127.175 129.978 -2.803 1
1 743 . 1 1 1 A 69 69 SER H H 69 7.666 7.778 -0.112 1
1 744 . 1 1 1 A 69 69 SER HA H 69 5.144 4.917 0.227 1
1 747 . 1 1 1 A 69 69 SER C C 69 172.722 172.345 0.377 1
1 748 . 1 1 1 A 69 69 SER CA C 69 57.606 57.426 0.180 1
1 749 . 1 1 1 A 69 69 SER CB C 69 64.511 66.057 -1.546 1
1 750 . 1 1 1 A 69 69 SER N N 69 110.346 108.992 1.354 1
1 751 . 1 1 1 A 70 70 ILE H H 70 7.965 8.420 -0.455 1
1 752 . 1 1 1 A 70 70 ILE HA H 70 4.548 4.752 -0.204 1
1 762 . 1 1 1 A 70 70 ILE C C 70 174.993 176.200 -1.207 1
1 763 . 1 1 1 A 70 70 ILE CA C 70 60.897 60.266 0.631 1
1 764 . 1 1 1 A 70 70 ILE CB C 70 41.186 40.464 0.722 1
1 768 . 1 1 1 A 70 70 ILE N N 70 119.579 121.010 -1.431 1
1 769 . 1 1 1 A 71 71 ASN H H 71 9.839 10.546 -0.707 1
1 770 . 1 1 1 A 71 71 ASN HA H 71 4.485 4.401 0.084 1
1 775 . 1 1 1 A 71 71 ASN C C 71 174.975 174.655 0.320 1
1 776 . 1 1 1 A 71 71 ASN CA C 71 54.085 54.188 -0.103 1
1 777 . 1 1 1 A 71 71 ASN CB C 71 36.255 37.521 -1.266 1
1 778 . 1 1 1 A 71 71 ASN N N 71 126.963 124.882 2.081 1
1 780 . 1 1 1 A 72 72 GLY H H 72 8.911 8.507 0.404 1
1 781 . 1 1 1 A 72 72 GLY HA2 H 72 4.149 3.833 0.316 1
1 782 . 1 1 1 A 72 72 GLY HA3 H 72 3.507 3.833 -0.326 1
1 783 . 1 1 1 A 72 72 GLY C C 72 173.594 173.546 0.048 1
1 784 . 1 1 1 A 72 72 GLY CA C 72 45.162 45.425 -0.263 1
1 785 . 1 1 1 A 72 72 GLY N N 72 103.020 105.037 -2.017 1
1 786 . 1 1 1 A 73 73 LYS H H 73 7.922 7.513 0.409 1
1 787 . 1 1 1 A 73 73 LYS HA H 73 4.485 4.615 -0.130 1
1 796 . 1 1 1 A 73 73 LYS C C 73 175.036 175.604 -0.568 1
1 797 . 1 1 1 A 73 73 LYS CA C 73 54.719 55.328 -0.609 1
1 798 . 1 1 1 A 73 73 LYS CB C 73 32.137 33.787 -1.650 1
1 802 . 1 1 1 A 73 73 LYS N N 73 122.413 122.550 -0.137 1
1 803 . 1 1 1 A 74 74 SER H H 74 8.585 8.817 -0.232 1
1 804 . 1 1 1 A 74 74 SER HA H 74 4.452 4.728 -0.276 1
1 807 . 1 1 1 A 74 74 SER C C 74 175.965 174.111 1.854 1
1 808 . 1 1 1 A 74 74 SER CA C 74 58.028 58.610 -0.582 1
1 809 . 1 1 1 A 74 74 SER CB C 74 63.799 63.814 -0.015 1
1 810 . 1 1 1 A 74 74 SER N N 74 118.737 124.302 -5.565 1
1 811 . 1 1 1 A 75 75 LEU H H 75 8.015 8.291 -0.276 1
1 812 . 1 1 1 A 75 75 LEU HA H 75 4.661 4.468 0.193 1
1 822 . 1 1 1 A 75 75 LEU C C 75 178.117 177.612 0.505 1
1 823 . 1 1 1 A 75 75 LEU CA C 75 53.980 54.651 -0.671 1
1 824 . 1 1 1 A 75 75 LEU CB C 75 40.830 41.075 -0.245 1
1 828 . 1 1 1 A 75 75 LEU N N 75 125.425 125.540 -0.115 1
1 829 . 1 1 1 A 76 76 LYS H H 76 8.099 8.618 -0.519 1
1 830 . 1 1 1 A 76 76 LYS HA H 76 4.210 4.424 -0.214 1
1 839 . 1 1 1 A 76 76 LYS C C 76 178.487 176.762 1.725 1
1 840 . 1 1 1 A 76 76 LYS CA C 76 58.010 55.472 2.538 1
1 841 . 1 1 1 A 76 76 LYS CB C 76 31.683 31.678 0.005 1
1 845 . 1 1 1 A 76 76 LYS N N 76 124.064 120.363 3.701 1
1 846 . 1 1 1 A 77 77 GLY H H 77 8.859 7.848 1.011 1
1 847 . 1 1 1 A 77 77 GLY HA2 H 77 4.110 4.063 0.047 1
1 848 . 1 1 1 A 77 77 GLY HA3 H 77 3.869 4.067 -0.198 1
1 849 . 1 1 1 A 77 77 GLY C C 77 174.335 174.732 -0.397 1
1 850 . 1 1 1 A 77 77 GLY CA C 77 46.232 44.940 1.292 1
1 851 . 1 1 1 A 77 77 GLY N N 77 115.659 108.711 6.948 1
1 852 . 1 1 1 A 78 78 THR H H 78 7.654 7.736 -0.082 1
1 853 . 1 1 1 A 78 78 THR HA H 78 4.624 4.171 0.453 1
1 858 . 1 1 1 A 78 78 THR C C 78 177.272 174.856 2.416 1
1 859 . 1 1 1 A 78 78 THR CA C 78 61.794 63.211 -1.417 1
1 860 . 1 1 1 A 78 78 THR CB C 78 70.595 69.129 1.466 1
1 862 . 1 1 1 A 78 78 THR N N 78 112.847 116.544 -3.697 1
1 863 . 1 1 1 A 79 79 THR H H 79 8.813 8.662 0.151 1
1 864 . 1 1 1 A 79 79 THR HA H 79 4.395 4.606 -0.211 1
1 869 . 1 1 1 A 79 79 THR C C 79 174.503 175.442 -0.939 1
1 870 . 1 1 1 A 79 79 THR CA C 79 61.724 61.317 0.407 1
1 871 . 1 1 1 A 79 79 THR CB C 79 71.007 70.981 0.026 1
1 873 . 1 1 1 A 79 79 THR N N 79 114.123 117.713 -3.590 1
1 874 . 1 1 1 A 80 80 HIS H H 80 10.266 8.967 1.299 1
1 875 . 1 1 1 A 80 80 HIS HA H 80 4.331 4.163 0.168 1
1 880 . 1 1 1 A 80 80 HIS C C 80 177.075 176.858 0.217 1
1 881 . 1 1 1 A 80 80 HIS CA C 80 61.338 59.474 1.864 1
1 882 . 1 1 1 A 80 80 HIS CB C 80 28.651 29.925 -1.274 1
1 885 . 1 1 1 A 80 80 HIS N N 80 122.776 121.204 1.572 1
1 886 . 1 1 1 A 81 81 HIS H H 81 9.335 8.112 1.223 1
1 887 . 1 1 1 A 81 81 HIS HA H 81 4.078 4.057 0.021 1
1 892 . 1 1 1 A 81 81 HIS C C 81 178.269 176.552 1.717 1
1 893 . 1 1 1 A 81 81 HIS CA C 81 60.210 59.823 0.387 1
1 894 . 1 1 1 A 81 81 HIS CB C 81 29.569 29.973 -0.404 1
1 897 . 1 1 1 A 81 81 HIS N N 81 114.733 118.888 -4.155 1
1 898 . 1 1 1 A 82 82 ASP H H 82 7.741 8.122 -0.381 1
1 899 . 1 1 1 A 82 82 ASP HA H 82 4.452 4.239 0.213 1
1 902 . 1 1 1 A 82 82 ASP C C 82 178.683 178.892 -0.209 1
1 903 . 1 1 1 A 82 82 ASP CA C 82 57.148 57.472 -0.324 1
1 904 . 1 1 1 A 82 82 ASP CB C 82 39.522 40.325 -0.803 1
1 905 . 1 1 1 A 82 82 ASP N N 82 121.407 118.051 3.356 1
1 906 . 1 1 1 A 83 83 ALA H H 83 8.502 7.886 0.616 1
1 907 . 1 1 1 A 83 83 ALA HA H 83 3.939 4.084 -0.145 1
1 911 . 1 1 1 A 83 83 ALA C C 83 179.361 179.394 -0.033 1
1 912 . 1 1 1 A 83 83 ALA CA C 83 55.635 54.922 0.713 1
1 913 . 1 1 1 A 83 83 ALA CB C 83 18.124 18.885 -0.761 1
1 914 . 1 1 1 A 83 83 ALA N N 83 125.049 122.751 2.298 1
1 915 . 1 1 1 A 84 84 LEU H H 84 8.100 8.370 -0.270 1
1 916 . 1 1 1 A 84 84 LEU HA H 84 3.792 3.781 0.011 1
1 926 . 1 1 1 A 84 84 LEU C C 84 180.173 179.018 1.155 1
1 927 . 1 1 1 A 84 84 LEU CA C 84 57.932 57.879 0.053 1
1 928 . 1 1 1 A 84 84 LEU CB C 84 41.157 41.316 -0.159 1
1 932 . 1 1 1 A 84 84 LEU N N 84 117.139 118.214 -1.075 1
1 933 . 1 1 1 A 85 85 ALA H H 85 7.715 8.864 -1.149 1
1 934 . 1 1 1 A 85 85 ALA HA H 85 4.061 4.110 -0.049 1
1 938 . 1 1 1 A 85 85 ALA C C 85 180.380 179.678 0.702 1
1 939 . 1 1 1 A 85 85 ALA CA C 85 55.212 55.405 -0.193 1
1 940 . 1 1 1 A 85 85 ALA CB C 85 17.803 18.652 -0.849 1
1 941 . 1 1 1 A 85 85 ALA N N 85 122.448 121.352 1.096 1
1 942 . 1 1 1 A 86 86 ILE H H 86 7.669 7.936 -0.267 1
1 943 . 1 1 1 A 86 86 ILE HA H 86 3.678 3.715 -0.037 1
1 953 . 1 1 1 A 86 86 ILE C C 86 178.692 178.918 -0.226 1
1 954 . 1 1 1 A 86 86 ILE CA C 86 65.226 64.662 0.564 1
1 955 . 1 1 1 A 86 86 ILE CB C 86 38.099 37.802 0.297 1
1 959 . 1 1 1 A 86 86 ILE N N 86 121.804 117.828 3.976 1
1 960 . 1 1 1 A 87 87 LEU H H 87 7.922 8.444 -0.522 1
1 961 . 1 1 1 A 87 87 LEU HA H 87 3.903 4.037 -0.134 1
1 971 . 1 1 1 A 87 87 LEU C C 87 178.610 178.678 -0.068 1
1 972 . 1 1 1 A 87 87 LEU CA C 87 58.221 58.041 0.180 1
1 973 . 1 1 1 A 87 87 LEU CB C 87 42.344 41.496 0.848 1
1 977 . 1 1 1 A 87 87 LEU N N 87 121.947 121.702 0.245 1
1 978 . 1 1 1 A 88 88 ARG H H 88 8.317 8.258 0.059 1
1 979 . 1 1 1 A 88 88 ARG HA H 88 4.060 4.181 -0.121 1
1 986 . 1 1 1 A 88 88 ARG C C 88 180.698 177.339 3.359 1
1 987 . 1 1 1 A 88 88 ARG CA C 88 59.383 58.451 0.932 1
1 988 . 1 1 1 A 88 88 ARG CB C 88 30.055 29.939 0.116 1
1 991 . 1 1 1 A 88 88 ARG N N 88 119.343 119.437 -0.094 1
1 992 . 1 1 1 A 89 89 GLN H H 89 8.270 7.700 0.570 1
1 993 . 1 1 1 A 89 89 GLN HA H 89 4.122 4.217 -0.095 1
1 1000 . 1 1 1 A 89 89 GLN C C 89 177.955 178.141 -0.186 1
1 1001 . 1 1 1 A 89 89 GLN CA C 89 58.714 57.862 0.852 1
1 1002 . 1 1 1 A 89 89 GLN CB C 89 28.160 29.140 -0.980 1
1 1004 . 1 1 1 A 89 89 GLN N N 89 121.097 117.445 3.652 1
1 1006 . 1 1 1 A 90 90 ALA H H 90 7.558 7.594 -0.036 1
1 1007 . 1 1 1 A 90 90 ALA HA H 90 4.123 4.181 -0.058 1
1 1011 . 1 1 1 A 90 90 ALA C C 90 178.076 178.230 -0.154 1
1 1012 . 1 1 1 A 90 90 ALA CA C 90 52.942 53.790 -0.848 1
1 1013 . 1 1 1 A 90 90 ALA CB C 90 18.015 18.319 -0.304 1
1 1014 . 1 1 1 A 90 90 ALA N N 90 119.652 121.746 -2.094 1
1 1015 . 1 1 1 A 91 91 ARG H H 91 7.768 8.093 -0.325 1
1 1016 . 1 1 1 A 91 91 ARG HA H 91 4.065 4.268 -0.203 1
1 1022 . 1 1 1 A 91 91 ARG C C 91 177.858 177.764 0.094 1
1 1023 . 1 1 1 A 91 91 ARG CA C 91 58.573 57.436 1.137 1
1 1024 . 1 1 1 A 91 91 ARG CB C 91 30.384 30.814 -0.430 1
1 1027 . 1 1 1 A 91 91 ARG N N 91 118.081 116.875 1.206 1
1 1028 . 1 1 1 A 92 92 GLU H H 92 7.691 7.883 -0.192 1
1 1029 . 1 1 1 A 92 92 GLU HA H 92 4.123 4.152 -0.029 1
1 1034 . 1 1 1 A 92 92 GLU C C 92 174.459 176.668 -2.209 1
1 1035 . 1 1 1 A 92 92 GLU CA C 92 61.565 60.856 0.709 1
1 1036 . 1 1 1 A 92 92 GLU CB C 92 27.583 28.791 -1.208 1
1 1038 . 1 1 1 A 92 92 GLU N N 92 118.447 118.717 -0.270 1
1 1039 . 1 1 1 A 93 93 PRO HA H 93 4.716 4.542 0.174 1
1 1046 . 1 1 1 A 93 93 PRO C C 93 176.221 176.379 -0.158 1
1 1047 . 1 1 1 A 93 93 PRO CA C 93 63.149 62.494 0.655 1
1 1048 . 1 1 1 A 93 93 PRO CB C 93 32.571 33.127 -0.556 1
1 1051 . 1 1 1 A 94 94 ARG H H 94 8.434 9.042 -0.608 1
1 1052 . 1 1 1 A 94 94 ARG HA H 94 4.232 4.263 -0.031 1
1 1058 . 1 1 1 A 94 94 ARG C C 94 175.323 176.065 -0.742 1
1 1059 . 1 1 1 A 94 94 ARG CA C 94 56.972 56.995 -0.023 1
1 1060 . 1 1 1 A 94 94 ARG CB C 94 30.448 31.174 -0.726 1
1 1063 . 1 1 1 A 94 94 ARG N N 94 115.987 119.016 -3.029 1
1 1064 . 1 1 1 A 95 95 GLN H H 95 7.246 7.604 -0.358 1
1 1065 . 1 1 1 A 95 95 GLN HA H 95 5.251 5.305 -0.054 1
1 1072 . 1 1 1 A 95 95 GLN C C 95 174.786 173.669 1.117 1
1 1073 . 1 1 1 A 95 95 GLN CA C 95 54.209 54.195 0.014 1
1 1074 . 1 1 1 A 95 95 GLN CB C 95 32.384 32.268 0.116 1
1 1076 . 1 1 1 A 95 95 GLN N N 95 115.998 119.706 -3.708 1
1 1078 . 1 1 1 A 96 96 ALA H H 96 8.739 8.396 0.343 1
1 1079 . 1 1 1 A 96 96 ALA HA H 96 5.412 5.158 0.254 1
1 1083 . 1 1 1 A 96 96 ALA C C 96 175.258 175.822 -0.564 1
1 1084 . 1 1 1 A 96 96 ALA CA C 96 50.355 50.802 -0.447 1
1 1085 . 1 1 1 A 96 96 ALA CB C 96 24.270 23.007 1.263 1
1 1086 . 1 1 1 A 96 96 ALA N N 96 126.197 125.307 0.890 1
1 1087 . 1 1 1 A 97 97 VAL H H 97 8.568 8.727 -0.159 1
1 1088 . 1 1 1 A 97 97 VAL HA H 97 4.804 4.706 0.098 1
1 1096 . 1 1 1 A 97 97 VAL C C 97 175.982 174.750 1.232 1
1 1097 . 1 1 1 A 97 97 VAL CA C 97 61.442 61.260 0.182 1
1 1098 . 1 1 1 A 97 97 VAL CB C 97 33.413 33.754 -0.341 1
1 1101 . 1 1 1 A 97 97 VAL N N 97 120.702 120.143 0.559 1
1 1102 . 1 1 1 A 98 98 ILE H H 98 9.753 8.516 1.237 1
1 1103 . 1 1 1 A 98 98 ILE HA H 98 4.826 5.037 -0.211 1
1 1113 . 1 1 1 A 98 98 ILE C C 98 174.292 174.552 -0.260 1
1 1114 . 1 1 1 A 98 98 ILE CA C 98 59.981 59.618 0.363 1
1 1115 . 1 1 1 A 98 98 ILE CB C 98 40.608 40.866 -0.258 1
1 1119 . 1 1 1 A 98 98 ILE N N 98 131.738 127.036 4.702 1
1 1120 . 1 1 1 A 99 99 VAL H H 99 8.493 8.636 -0.143 1
1 1121 . 1 1 1 A 99 99 VAL HA H 99 5.201 4.783 0.418 1
1 1129 . 1 1 1 A 99 99 VAL C C 99 176.557 175.343 1.214 1
1 1130 . 1 1 1 A 99 99 VAL CA C 99 61.495 60.977 0.518 1
1 1131 . 1 1 1 A 99 99 VAL CB C 99 32.327 32.697 -0.370 1
1 1134 . 1 1 1 A 99 99 VAL N N 99 129.537 128.938 0.599 1
1 1135 . 1 1 1 A 100 100 THR H H 100 9.050 8.978 0.072 1
1 1136 . 1 1 1 A 100 100 THR HA H 100 5.606 5.548 0.058 1
1 1141 . 1 1 1 A 100 100 THR C C 100 172.815 173.184 -0.369 1
1 1142 . 1 1 1 A 100 100 THR CA C 100 59.049 59.321 -0.272 1
1 1143 . 1 1 1 A 100 100 THR CB C 100 73.966 72.089 1.877 1
1 1145 . 1 1 1 A 100 100 THR N N 100 117.469 117.060 0.409 1
1 1146 . 1 1 1 A 101 101 ARG H H 101 8.773 8.629 0.144 1
1 1147 . 1 1 1 A 101 101 ARG HA H 101 4.989 4.791 0.198 1
1 1155 . 1 1 1 A 101 101 ARG C C 101 174.738 175.881 -1.143 1
1 1156 . 1 1 1 A 101 101 ARG CA C 101 54.825 54.100 0.725 1
1 1157 . 1 1 1 A 101 101 ARG CB C 101 34.636 32.617 2.019 1
1 1160 . 1 1 1 A 101 101 ARG N N 101 117.532 120.884 -3.352 1
1 1162 . 1 1 1 A 102 102 LYS H H 102 8.616 8.547 0.069 1
1 1163 . 1 1 1 A 102 102 LYS HA H 102 4.232 4.512 -0.280 1
1 1171 . 1 1 1 A 102 102 LYS C C 102 175.935 175.407 0.528 1
1 1172 . 1 1 1 A 102 102 LYS CA C 102 56.549 56.199 0.350 1
1 1173 . 1 1 1 A 102 102 LYS CB C 102 33.266 32.772 0.494 1
1 1177 . 1 1 1 A 102 102 LYS N N 102 126.899 121.832 5.067 1
1 1178 . 1 1 1 A 103 103 LEU H H 103 8.424 8.909 -0.485 1
1 1179 . 1 1 1 A 103 103 LEU HA H 103 4.540 4.963 -0.423 1
1 1189 . 1 1 1 A 103 103 LEU C C 103 176.956 176.738 0.218 1
1 1190 . 1 1 1 A 103 103 LEU CA C 103 54.755 53.246 1.509 1
1 1191 . 1 1 1 A 103 103 LEU CB C 103 42.929 45.249 -2.320 1
1 1195 . 1 1 1 A 103 103 LEU N N 103 126.246 126.012 0.234 1
1 1196 . 1 1 1 A 104 104 THR H H 104 8.201 8.431 -0.230 1
1 1197 . 1 1 1 A 104 104 THR HA H 104 4.624 4.930 -0.306 1
1 1202 . 1 1 1 A 104 104 THR C C 104 172.954 174.308 -1.354 1
1 1203 . 1 1 1 A 104 104 THR CA C 104 59.483 58.666 0.817 1
1 1204 . 1 1 1 A 104 104 THR CB C 104 69.761 69.885 -0.124 1
1 1206 . 1 1 1 A 104 104 THR N N 104 117.263 112.314 4.949 1
1 1207 . 1 1 1 A 105 105 PRO HA H 105 4.399 4.465 -0.066 1
1 1213 . 1 1 1 A 105 105 PRO CA C 105 63.495 65.121 -1.626 1
1 1214 . 1 1 1 A 105 105 PRO CB C 105 32.096 31.955 0.141 1
1 1217 . 1 1 1 A 106 106 GLU H H 106 8.519 7.844 0.675 1
1 1218 . 1 1 1 A 106 106 GLU HA H 106 4.197 4.677 -0.480 1
1 1221 . 1 1 1 A 106 106 GLU C C 106 176.110 176.079 0.031 1
1 1222 . 1 1 1 A 106 106 GLU CA C 106 56.743 54.529 2.214 1
1 1223 . 1 1 1 A 106 106 GLU CB C 106 30.137 32.890 -2.753 1
1 1225 . 1 1 1 A 106 106 GLU N N 106 120.609 116.639 3.970 1
1 1226 . 1 1 1 A 107 107 ALA H H 107 8.241 8.510 -0.269 1
1 1227 . 1 1 1 A 107 107 ALA HA H 107 4.317 3.829 0.488 1
1 1231 . 1 1 1 A 107 107 ALA C C 107 177.299 176.554 0.745 1
1 1232 . 1 1 1 A 107 107 ALA CA C 107 52.203 52.790 -0.587 1
1 1233 . 1 1 1 A 107 107 ALA CB C 107 19.392 17.459 1.933 1
1 1234 . 1 1 1 A 107 107 ALA N N 107 124.849 124.982 -0.133 1
1 1235 . 1 1 1 A 108 108 MET H H 108 8.284 7.770 0.514 1
1 1236 . 1 1 1 A 108 108 MET HA H 108 4.792 4.490 0.302 1
1 1244 . 1 1 1 A 108 108 MET C C 108 174.337 176.076 -1.739 1
1 1245 . 1 1 1 A 108 108 MET CA C 108 53.258 53.992 -0.734 1
1 1246 . 1 1 1 A 108 108 MET CB C 108 32.608 32.745 -0.137 1
1 1249 . 1 1 1 A 108 108 MET N N 108 121.025 115.231 5.794 1
1 1250 . 1 1 1 A 109 109 PRO HA H 109 4.408 4.603 -0.195 1
1 1256 . 1 1 1 A 109 109 PRO C C 109 176.412 175.994 0.418 1
1 1257 . 1 1 1 A 109 109 PRO CA C 109 63.290 62.252 1.038 1
1 1258 . 1 1 1 A 109 109 PRO CB C 109 32.077 32.450 -0.373 1
1 1261 . 1 1 1 A 110 110 ASP H H 110 8.417 8.383 0.034 1
1 1262 . 1 1 1 A 110 110 ASP HA H 110 4.573 5.056 -0.483 1
1 1265 . 1 1 1 A 110 110 ASP C C 110 176.508 174.958 1.550 1
1 1266 . 1 1 1 A 110 110 ASP CA C 110 54.085 52.933 1.152 1
1 1267 . 1 1 1 A 110 110 ASP CB C 110 41.075 41.270 -0.195 1
1 1268 . 1 1 1 A 110 110 ASP N N 110 120.239 119.830 0.409 1
1 1269 . 1 1 1 A 111 111 LEU H H 111 8.279 8.622 -0.343 1
1 1270 . 1 1 1 A 111 111 LEU HA H 111 4.319 4.376 -0.057 1
1 1280 . 1 1 1 A 111 111 LEU C C 111 177.551 174.785 2.766 1
1 1281 . 1 1 1 A 111 111 LEU CA C 111 55.581 54.458 1.123 1
1 1282 . 1 1 1 A 111 111 LEU CB C 111 42.360 39.999 2.361 1
1 1286 . 1 1 1 A 111 111 LEU N N 111 123.318 126.946 -3.628 1
1 1287 . 1 1 1 A 112 112 ASN H H 112 8.487 7.721 0.766 1
1 1288 . 1 1 1 A 112 112 ASN HA H 112 4.725 5.151 -0.426 1
1 1293 . 1 1 1 A 112 112 ASN C C 112 175.454 173.137 2.317 1
1 1294 . 1 1 1 A 112 112 ASN CA C 112 53.610 52.918 0.692 1
1 1295 . 1 1 1 A 112 112 ASN CB C 112 39.116 41.902 -2.786 1
1 1296 . 1 1 1 A 112 112 ASN N N 112 118.752 119.630 -0.878 1
1 1298 . 1 1 1 A 115 115 GLY H H 115 8.205 8.451 -0.246 1
1 1299 . 1 1 1 A 115 115 GLY HA2 H 115 4.126 4.260 -0.134 1
1 1300 . 1 1 1 A 115 115 GLY HA3 H 115 4.126 4.260 -0.134 1
1 1301 . 1 1 1 A 115 115 GLY CA C 115 44.727 44.792 -0.065 1
1 1302 . 1 1 1 A 116 116 PRO HA H 116 4.485 4.571 -0.086 1
1 1309 . 1 1 1 A 116 116 PRO CA C 116 63.298 62.353 0.945 1
1 1310 . 1 1 1 A 116 116 PRO CB C 116 32.077 33.008 -0.931 1
1 1313 . 1 1 1 A 117 117 SER H H 117 8.532 8.489 0.043 1
1 1 . 2 1 1 A 7 7 GLY HA2 H 7 3.960 3.952 0.008 1
1 2 . 2 1 1 A 7 7 GLY HA3 H 7 3.960 3.953 0.007 1
1 3 . 2 1 1 A 7 7 GLY C C 7 174.009 174.311 -0.302 1
1 4 . 2 1 1 A 7 7 GLY CA C 7 45.374 46.571 -1.197 1
1 5 . 2 1 1 A 8 8 ALA H H 8 8.163 7.614 0.549 1
1 6 . 2 1 1 A 8 8 ALA HA H 8 4.381 4.740 -0.359 1
1 10 . 2 1 1 A 8 8 ALA C C 8 178.078 176.692 1.386 1
1 11 . 2 1 1 A 8 8 ALA CA C 8 52.677 50.977 1.700 1
1 12 . 2 1 1 A 8 8 ALA CB C 8 19.368 21.166 -1.798 1
1 13 . 2 1 1 A 8 8 ALA N N 8 123.721 121.251 2.470 1
1 14 . 2 1 1 A 9 9 THR H H 9 8.142 8.614 -0.472 1
1 15 . 2 1 1 A 9 9 THR HA H 9 4.353 3.827 0.526 1
1 20 . 2 1 1 A 9 9 THR C C 9 174.597 173.222 1.375 1
1 21 . 2 1 1 A 9 9 THR CA C 9 62.093 62.603 -0.510 1
1 22 . 2 1 1 A 9 9 THR CB C 9 69.948 66.815 3.133 1
1 24 . 2 1 1 A 9 9 THR N N 9 113.761 115.506 -1.745 1
1 25 . 2 1 1 A 10 10 LEU H H 10 8.218 7.593 0.625 1
1 26 . 2 1 1 A 10 10 LEU HA H 10 4.169 4.772 -0.603 1
1 36 . 2 1 1 A 10 10 LEU C C 10 176.110 175.724 0.386 1
1 37 . 2 1 1 A 10 10 LEU CA C 10 61.099 53.421 7.678 1
1 38 . 2 1 1 A 10 10 LEU CB C 10 38.686 46.073 -7.387 1
1 42 . 2 1 1 A 10 10 LEU N N 10 123.516 120.443 3.073 1
1 43 . 2 1 1 A 11 11 LYS H H 11 8.496 8.329 0.167 1
1 44 . 2 1 1 A 11 11 LYS HA H 11 4.891 4.205 0.686 1
1 49 . 2 1 1 A 11 11 LYS C C 11 175.794 175.802 -0.008 1
1 50 . 2 1 1 A 11 11 LYS CA C 11 55.652 56.681 -1.029 1
1 51 . 2 1 1 A 11 11 LYS CB C 11 29.444 32.761 -3.317 1
1 52 . 2 1 1 A 11 11 LYS N N 11 125.141 120.122 5.019 1
1 53 . 2 1 1 A 12 12 GLN HA H 12 4.315 4.818 -0.503 1
1 54 . 2 1 1 A 12 12 GLN C C 12 176.300 173.676 2.624 1
1 55 . 2 1 1 A 12 12 GLN CA C 12 56.286 55.521 0.765 1
1 56 . 2 1 1 A 12 12 GLN CB C 12 32.901 32.268 0.633 1
1 57 . 2 1 1 A 13 13 LEU H H 13 8.410 8.568 -0.158 1
1 58 . 2 1 1 A 13 13 LEU HA H 13 4.348 4.893 -0.545 1
1 67 . 2 1 1 A 13 13 LEU C C 13 177.120 175.913 1.207 1
1 68 . 2 1 1 A 13 13 LEU CA C 13 55.142 53.463 1.679 1
1 69 . 2 1 1 A 13 13 LEU CB C 13 42.352 44.434 -2.082 1
1 73 . 2 1 1 A 13 13 LEU N N 13 124.340 123.104 1.236 1
1 74 . 2 1 1 A 14 14 ASP H H 14 8.250 9.049 -0.799 1
1 75 . 2 1 1 A 14 14 ASP HA H 14 4.540 4.259 0.281 1
1 78 . 2 1 1 A 14 14 ASP C C 14 176.769 176.323 0.446 1
1 79 . 2 1 1 A 14 14 ASP CA C 14 54.772 56.827 -2.055 1
1 80 . 2 1 1 A 14 14 ASP CB C 14 41.322 40.802 0.520 1
1 81 . 2 1 1 A 14 14 ASP N N 14 120.493 125.049 -4.556 1
1 82 . 2 1 1 A 15 15 GLY H H 15 8.428 8.491 -0.063 1
1 83 . 2 1 1 A 15 15 GLY HA2 H 15 4.089 3.939 0.150 1
1 84 . 2 1 1 A 15 15 GLY HA3 H 15 3.874 3.939 -0.065 1
1 85 . 2 1 1 A 15 15 GLY C C 15 174.122 174.448 -0.326 1
1 86 . 2 1 1 A 15 15 GLY CA C 15 45.972 46.502 -0.530 1
1 87 . 2 1 1 A 15 15 GLY N N 15 108.670 106.846 1.824 1
1 88 . 2 1 1 A 16 16 ILE H H 16 7.727 7.731 -0.004 1
1 89 . 2 1 1 A 16 16 ILE HA H 16 4.705 4.715 -0.010 1
1 99 . 2 1 1 A 16 16 ILE C C 16 175.807 174.737 1.070 1
1 100 . 2 1 1 A 16 16 ILE CA C 16 60.703 59.687 1.016 1
1 101 . 2 1 1 A 16 16 ILE CB C 16 38.509 40.103 -1.594 1
1 105 . 2 1 1 A 16 16 ILE N N 16 120.267 119.674 0.593 1
1 106 . 2 1 1 A 17 17 HIS H H 17 9.101 8.750 0.351 1
1 107 . 2 1 1 A 17 17 HIS HA H 17 4.782 5.253 -0.471 1
1 112 . 2 1 1 A 17 17 HIS C C 17 173.051 173.756 -0.705 1
1 113 . 2 1 1 A 17 17 HIS CA C 17 55.353 54.521 0.832 1
1 114 . 2 1 1 A 17 17 HIS CB C 17 32.468 32.846 -0.378 1
1 117 . 2 1 1 A 17 17 HIS N N 17 125.061 124.054 1.007 1
1 118 . 2 1 1 A 18 18 VAL H H 18 8.427 8.635 -0.208 1
1 119 . 2 1 1 A 18 18 VAL HA H 18 4.375 4.076 0.299 1
1 127 . 2 1 1 A 18 18 VAL C C 18 174.702 175.177 -0.475 1
1 128 . 2 1 1 A 18 18 VAL CA C 18 62.035 62.713 -0.678 1
1 129 . 2 1 1 A 18 18 VAL CB C 18 32.325 32.636 -0.311 1
1 132 . 2 1 1 A 18 18 VAL N N 18 127.069 126.224 0.845 1
1 133 . 2 1 1 A 19 19 THR H H 19 9.272 8.568 0.704 1
1 134 . 2 1 1 A 19 19 THR HA H 19 4.512 4.791 -0.279 1
1 139 . 2 1 1 A 19 19 THR C C 19 172.784 173.061 -0.277 1
1 140 . 2 1 1 A 19 19 THR CA C 19 62.512 61.473 1.039 1
1 141 . 2 1 1 A 19 19 THR CB C 19 70.663 70.613 0.050 1
1 143 . 2 1 1 A 19 19 THR N N 19 126.619 121.870 4.749 1
1 144 . 2 1 1 A 20 20 ILE H H 20 8.737 9.101 -0.364 1
1 145 . 2 1 1 A 20 20 ILE HA H 20 4.870 4.776 0.094 1
1 155 . 2 1 1 A 20 20 ILE C C 20 175.315 174.612 0.703 1
1 156 . 2 1 1 A 20 20 ILE CA C 20 60.157 60.176 -0.019 1
1 157 . 2 1 1 A 20 20 ILE CB C 20 38.603 38.123 0.480 1
1 161 . 2 1 1 A 20 20 ILE N N 20 128.114 127.952 0.162 1
1 162 . 2 1 1 A 21 21 LEU H H 21 8.902 8.721 0.181 1
1 163 . 2 1 1 A 21 21 LEU HA H 21 4.804 4.783 0.021 1
1 173 . 2 1 1 A 21 21 LEU C C 21 175.565 175.346 0.219 1
1 174 . 2 1 1 A 21 21 LEU CA C 21 52.731 53.501 -0.770 1
1 175 . 2 1 1 A 21 21 LEU CB C 21 43.947 43.254 0.693 1
1 179 . 2 1 1 A 21 21 LEU N N 21 125.457 128.544 -3.087 1
1 180 . 2 1 1 A 22 22 HIS H H 22 8.577 9.008 -0.431 1
1 181 . 2 1 1 A 22 22 HIS HA H 22 5.013 4.992 0.021 1
1 186 . 2 1 1 A 22 22 HIS C C 22 174.258 174.886 -0.628 1
1 187 . 2 1 1 A 22 22 HIS CA C 22 55.880 54.933 0.947 1
1 188 . 2 1 1 A 22 22 HIS CB C 22 30.901 29.997 0.904 1
1 191 . 2 1 1 A 22 22 HIS N N 22 122.595 124.419 -1.824 1
1 192 . 2 1 1 A 23 23 LYS H H 23 8.712 8.935 -0.223 1
1 193 . 2 1 1 A 23 23 LYS HA H 23 4.880 4.896 -0.016 1
1 202 . 2 1 1 A 23 23 LYS C C 23 174.265 175.372 -1.107 1
1 203 . 2 1 1 A 23 23 LYS CA C 23 54.314 54.195 0.119 1
1 204 . 2 1 1 A 23 23 LYS CB C 23 36.068 36.060 0.008 1
1 208 . 2 1 1 A 23 23 LYS N N 23 120.814 121.155 -0.341 1
1 209 . 2 1 1 A 24 24 GLU H H 24 8.360 8.425 -0.065 1
1 210 . 2 1 1 A 24 24 GLU HA H 24 4.350 4.522 -0.172 1
1 215 . 2 1 1 A 24 24 GLU C C 24 177.843 176.870 0.973 1
1 216 . 2 1 1 A 24 24 GLU CA C 24 55.601 55.463 0.138 1
1 217 . 2 1 1 A 24 24 GLU CB C 24 30.512 30.984 -0.472 1
1 219 . 2 1 1 A 24 24 GLU N N 24 117.859 119.764 -1.905 1
1 220 . 2 1 1 A 25 25 GLU H H 25 9.146 8.758 0.388 1
1 221 . 2 1 1 A 25 25 GLU HA H 25 3.924 4.300 -0.376 1
1 226 . 2 1 1 A 25 25 GLU C C 25 177.809 177.610 0.199 1
1 227 . 2 1 1 A 25 25 GLU CA C 25 58.568 58.612 -0.044 1
1 228 . 2 1 1 A 25 25 GLU CB C 25 29.313 29.125 0.188 1
1 230 . 2 1 1 A 25 25 GLU N N 25 124.543 121.908 2.635 1
1 231 . 2 1 1 A 26 26 GLY H H 26 8.242 9.051 -0.809 1
1 232 . 2 1 1 A 26 26 GLY HA2 H 26 4.287 4.002 0.285 1
1 233 . 2 1 1 A 26 26 GLY HA3 H 26 3.407 4.003 -0.596 1
1 234 . 2 1 1 A 26 26 GLY C C 26 174.234 175.116 -0.882 1
1 235 . 2 1 1 A 26 26 GLY CA C 26 46.113 46.684 -0.571 1
1 236 . 2 1 1 A 26 26 GLY N N 26 115.394 114.130 1.264 1
1 237 . 2 1 1 A 27 27 ALA H H 27 7.432 8.265 -0.833 1
1 238 . 2 1 1 A 27 27 ALA HA H 27 4.402 4.270 0.132 1
1 242 . 2 1 1 A 27 27 ALA C C 27 178.138 178.120 0.018 1
1 243 . 2 1 1 A 27 27 ALA CA C 27 52.273 52.905 -0.632 1
1 244 . 2 1 1 A 27 27 ALA CB C 27 20.214 19.619 0.595 1
1 245 . 2 1 1 A 27 27 ALA N N 27 122.323 122.572 -0.249 1
1 246 . 2 1 1 A 28 28 GLY H H 28 8.624 7.797 0.827 1
1 247 . 2 1 1 A 28 28 GLY HA2 H 28 4.134 4.081 0.053 1
1 248 . 2 1 1 A 28 28 GLY HA3 H 28 3.953 4.117 -0.164 1
1 249 . 2 1 1 A 28 28 GLY C C 28 174.069 174.914 -0.845 1
1 250 . 2 1 1 A 28 28 GLY CA C 28 44.546 44.386 0.160 1
1 251 . 2 1 1 A 28 28 GLY N N 28 107.593 105.280 2.313 1
1 252 . 2 1 1 A 29 29 LEU H H 29 7.934 8.557 -0.623 1
1 253 . 2 1 1 A 29 29 LEU HA H 29 4.059 4.475 -0.416 1
1 263 . 2 1 1 A 29 29 LEU C C 29 177.548 177.060 0.488 1
1 264 . 2 1 1 A 29 29 LEU CA C 29 56.298 56.080 0.218 1
1 265 . 2 1 1 A 29 29 LEU CB C 29 41.940 42.777 -0.837 1
1 269 . 2 1 1 A 29 29 LEU N N 29 115.495 121.122 -5.627 1
1 270 . 2 1 1 A 30 30 GLY H H 30 8.669 8.087 0.582 1
1 271 . 2 1 1 A 30 30 GLY HA2 H 30 4.264 4.100 0.164 1
1 272 . 2 1 1 A 30 30 GLY HA3 H 30 4.001 4.235 -0.234 1
1 273 . 2 1 1 A 30 30 GLY C C 30 175.296 173.098 2.198 1
1 274 . 2 1 1 A 30 30 GLY CA C 30 46.368 45.071 1.297 1
1 275 . 2 1 1 A 30 30 GLY N N 30 103.121 106.059 -2.938 1
1 276 . 2 1 1 A 31 31 PHE H H 31 7.044 7.419 -0.375 1
1 277 . 2 1 1 A 31 31 PHE HA H 31 4.541 4.406 0.135 1
1 285 . 2 1 1 A 31 31 PHE C C 31 171.141 172.764 -1.623 1
1 286 . 2 1 1 A 31 31 PHE CA C 31 55.704 55.155 0.549 1
1 287 . 2 1 1 A 31 31 PHE CB C 31 40.745 41.867 -1.122 1
1 293 . 2 1 1 A 31 31 PHE N N 31 115.404 115.288 0.116 1
1 294 . 2 1 1 A 32 32 SER H H 32 8.752 8.883 -0.131 1
1 295 . 2 1 1 A 32 32 SER HA H 32 4.990 5.000 -0.010 1
1 298 . 2 1 1 A 32 32 SER C C 32 175.049 172.762 2.287 1
1 299 . 2 1 1 A 32 32 SER CA C 32 55.001 55.865 -0.864 1
1 300 . 2 1 1 A 32 32 SER CB C 32 67.170 66.593 0.577 1
1 301 . 2 1 1 A 32 32 SER N N 32 113.639 115.004 -1.365 1
1 302 . 2 1 1 A 33 33 LEU H H 33 8.639 8.461 0.178 1
1 303 . 2 1 1 A 33 33 LEU HA H 33 5.573 5.067 0.506 1
1 313 . 2 1 1 A 33 33 LEU C C 33 175.827 175.492 0.335 1
1 314 . 2 1 1 A 33 33 LEU CA C 33 53.620 53.697 -0.077 1
1 315 . 2 1 1 A 33 33 LEU CB C 33 45.399 43.871 1.528 1
1 319 . 2 1 1 A 33 33 LEU N N 33 118.936 124.134 -5.198 1
1 320 . 2 1 1 A 34 34 ALA H H 34 9.410 8.815 0.595 1
1 321 . 2 1 1 A 34 34 ALA HA H 34 4.749 4.966 -0.217 1
1 325 . 2 1 1 A 34 34 ALA C C 34 176.231 177.423 -1.192 1
1 326 . 2 1 1 A 34 34 ALA CA C 34 50.425 51.055 -0.630 1
1 327 . 2 1 1 A 34 34 ALA CB C 34 22.518 22.820 -0.302 1
1 328 . 2 1 1 A 34 34 ALA N N 34 124.395 121.727 2.668 1
1 329 . 2 1 1 A 35 35 GLY H H 35 8.130 8.654 -0.524 1
1 330 . 2 1 1 A 35 35 GLY HA2 H 35 4.712 4.062 0.650 1
1 331 . 2 1 1 A 35 35 GLY HA3 H 35 3.955 4.078 -0.123 1
1 332 . 2 1 1 A 35 35 GLY C C 35 174.750 173.284 1.466 1
1 333 . 2 1 1 A 35 35 GLY CA C 35 44.494 45.023 -0.529 1
1 334 . 2 1 1 A 35 35 GLY N N 35 103.650 107.900 -4.250 1
1 335 . 2 1 1 A 36 36 GLY H H 36 8.217 7.800 0.417 1
1 336 . 2 1 1 A 36 36 GLY HA2 H 36 4.494 4.349 0.145 1
1 337 . 2 1 1 A 36 36 GLY HA3 H 36 3.836 4.394 -0.558 1
1 338 . 2 1 1 A 36 36 GLY C C 36 174.410 173.880 0.530 1
1 339 . 2 1 1 A 36 36 GLY CA C 36 45.462 45.970 -0.508 1
1 340 . 2 1 1 A 36 36 GLY N N 36 122.114 108.828 13.286 1
1 341 . 2 1 1 A 37 37 ALA H H 37 8.963 8.785 0.178 1
1 342 . 2 1 1 A 37 37 ALA HA H 37 3.998 4.181 -0.183 1
1 346 . 2 1 1 A 37 37 ALA C C 37 176.935 179.227 -2.292 1
1 347 . 2 1 1 A 37 37 ALA CA C 37 55.308 54.451 0.857 1
1 348 . 2 1 1 A 37 37 ALA CB C 37 18.822 19.247 -0.425 1
1 349 . 2 1 1 A 37 37 ALA N N 37 123.418 121.580 1.838 1
1 350 . 2 1 1 A 38 38 ASP H H 38 10.586 8.168 2.418 1
1 351 . 2 1 1 A 38 38 ASP HA H 38 4.485 4.443 0.042 1
1 354 . 2 1 1 A 38 38 ASP C C 38 175.309 176.442 -1.133 1
1 355 . 2 1 1 A 38 38 ASP CA C 38 52.730 56.283 -3.553 1
1 356 . 2 1 1 A 38 38 ASP CB C 38 38.689 40.768 -2.079 1
1 357 . 2 1 1 A 38 38 ASP N N 38 111.480 118.250 -6.770 1
1 358 . 2 1 1 A 39 39 LEU H H 39 7.789 7.769 0.020 1
1 359 . 2 1 1 A 39 39 LEU HA H 39 4.699 4.416 0.283 1
1 369 . 2 1 1 A 39 39 LEU C C 39 176.377 177.786 -1.409 1
1 370 . 2 1 1 A 39 39 LEU CA C 39 52.952 54.199 -1.247 1
1 371 . 2 1 1 A 39 39 LEU CB C 39 43.294 42.294 1.000 1
1 375 . 2 1 1 A 39 39 LEU N N 39 122.545 121.397 1.148 1
1 376 . 2 1 1 A 40 40 GLU H H 40 8.331 8.578 -0.247 1
1 377 . 2 1 1 A 40 40 GLU HA H 40 3.978 4.152 -0.174 1
1 382 . 2 1 1 A 40 40 GLU C C 40 176.887 177.215 -0.328 1
1 383 . 2 1 1 A 40 40 GLU CA C 40 59.066 59.073 -0.007 1
1 384 . 2 1 1 A 40 40 GLU CB C 40 29.523 30.026 -0.503 1
1 386 . 2 1 1 A 40 40 GLU N N 40 118.036 120.118 -2.082 1
1 387 . 2 1 1 A 41 41 ASN H H 41 7.890 7.726 0.164 1
1 388 . 2 1 1 A 41 41 ASN HA H 41 4.820 5.013 -0.193 1
1 393 . 2 1 1 A 41 41 ASN CA C 41 52.316 51.431 0.885 1
1 394 . 2 1 1 A 41 41 ASN CB C 41 37.409 36.372 1.037 1
1 395 . 2 1 1 A 41 41 ASN N N 41 115.196 118.312 -3.116 1
1 397 . 2 1 1 A 42 42 LYS H H 42 7.943 7.936 0.007 1
1 398 . 2 1 1 A 42 42 LYS HA H 42 4.328 4.321 0.007 1
1 407 . 2 1 1 A 42 42 LYS C C 42 177.081 177.029 0.052 1
1 408 . 2 1 1 A 42 42 LYS CA C 42 56.567 58.795 -2.228 1
1 409 . 2 1 1 A 42 42 LYS CB C 42 33.120 32.663 0.457 1
1 413 . 2 1 1 A 42 42 LYS N N 42 120.612 125.727 -5.115 1
1 414 . 2 1 1 A 43 43 VAL H H 43 7.456 7.606 -0.150 1
1 415 . 2 1 1 A 43 43 VAL HA H 43 4.059 4.606 -0.547 1
1 423 . 2 1 1 A 43 43 VAL CA C 43 61.330 60.332 0.998 1
1 424 . 2 1 1 A 43 43 VAL CB C 43 32.819 33.476 -0.657 1
1 427 . 2 1 1 A 43 43 VAL N N 43 118.284 118.980 -0.696 1
1 428 . 2 1 1 A 44 44 ILE H H 44 8.481 8.698 -0.217 1
1 429 . 2 1 1 A 44 44 ILE HA H 44 4.913 4.547 0.366 1
1 439 . 2 1 1 A 44 44 ILE C C 44 176.719 175.865 0.854 1
1 440 . 2 1 1 A 44 44 ILE CA C 44 59.946 62.069 -2.123 1
1 441 . 2 1 1 A 44 44 ILE CB C 44 35.784 38.104 -2.320 1
1 445 . 2 1 1 A 44 44 ILE N N 44 127.089 129.984 -2.895 1
1 446 . 2 1 1 A 45 45 THR H H 45 8.906 9.017 -0.111 1
1 447 . 2 1 1 A 45 45 THR HA H 45 5.400 5.049 0.351 1
1 452 . 2 1 1 A 45 45 THR CA C 45 58.528 59.521 -0.993 1
1 453 . 2 1 1 A 45 45 THR CB C 45 73.760 71.981 1.779 1
1 455 . 2 1 1 A 45 45 THR N N 45 116.832 117.513 -0.681 1
1 456 . 2 1 1 A 46 46 VAL H H 46 8.336 8.583 -0.247 1
1 457 . 2 1 1 A 46 46 VAL HA H 46 4.059 4.203 -0.144 1
1 465 . 2 1 1 A 46 46 VAL C C 46 176.648 176.540 0.108 1
1 466 . 2 1 1 A 46 46 VAL CA C 46 63.058 63.056 0.002 1
1 467 . 2 1 1 A 46 46 VAL CB C 46 31.601 30.896 0.705 1
1 470 . 2 1 1 A 46 46 VAL N N 46 118.542 122.488 -3.946 1
1 471 . 2 1 1 A 47 47 HIS H H 47 9.382 8.628 0.754 1
1 472 . 2 1 1 A 47 47 HIS HA H 47 4.628 4.212 0.416 1
1 477 . 2 1 1 A 47 47 HIS C C 47 174.339 174.298 0.041 1
1 478 . 2 1 1 A 47 47 HIS CA C 47 57.764 59.919 -2.155 1
1 479 . 2 1 1 A 47 47 HIS CB C 47 31.453 30.587 0.866 1
1 482 . 2 1 1 A 47 47 HIS N N 47 133.900 128.425 5.475 1
1 483 . 2 1 1 A 48 48 ARG H H 48 7.135 7.738 -0.603 1
1 484 . 2 1 1 A 48 48 ARG HA H 48 4.360 4.710 -0.350 1
1 491 . 2 1 1 A 48 48 ARG C C 48 173.877 174.687 -0.810 1
1 492 . 2 1 1 A 48 48 ARG CA C 48 54.385 54.572 -0.187 1
1 493 . 2 1 1 A 48 48 ARG CB C 48 33.996 35.212 -1.216 1
1 496 . 2 1 1 A 48 48 ARG N N 48 114.736 117.142 -2.406 1
1 497 . 2 1 1 A 49 49 VAL H H 49 8.690 8.617 0.073 1
1 498 . 2 1 1 A 49 49 VAL HA H 49 4.015 4.421 -0.406 1
1 506 . 2 1 1 A 49 49 VAL C C 49 176.255 175.418 0.837 1
1 507 . 2 1 1 A 49 49 VAL CA C 49 61.882 61.685 0.197 1
1 508 . 2 1 1 A 49 49 VAL CB C 49 32.261 33.800 -1.539 1
1 511 . 2 1 1 A 49 49 VAL N N 49 122.844 122.053 0.791 1
1 512 . 2 1 1 A 50 50 PHE H H 50 7.866 8.383 -0.517 1
1 513 . 2 1 1 A 50 50 PHE HA H 50 4.866 4.463 0.403 1
1 521 . 2 1 1 A 50 50 PHE C C 50 174.847 176.308 -1.461 1
1 522 . 2 1 1 A 50 50 PHE CA C 50 54.596 57.513 -2.917 1
1 523 . 2 1 1 A 50 50 PHE CB C 50 36.558 39.122 -2.564 1
1 529 . 2 1 1 A 50 50 PHE N N 50 128.498 127.407 1.091 1
1 530 . 2 1 1 A 51 51 PRO HA H 51 4.386 4.539 -0.153 1
1 537 . 2 1 1 A 51 51 PRO C C 51 177.321 176.859 0.462 1
1 538 . 2 1 1 A 51 51 PRO CA C 51 64.381 64.538 -0.157 1
1 539 . 2 1 1 A 51 51 PRO CB C 51 31.773 32.216 -0.443 1
1 542 . 2 1 1 A 52 52 ASN H H 52 8.814 8.446 0.368 1
1 543 . 2 1 1 A 52 52 ASN HA H 52 4.496 5.008 -0.512 1
1 548 . 2 1 1 A 52 52 ASN C C 52 174.823 174.635 0.188 1
1 549 . 2 1 1 A 52 52 ASN CA C 52 54.719 52.026 2.693 1
1 550 . 2 1 1 A 52 52 ASN CB C 52 38.109 39.348 -1.239 1
1 551 . 2 1 1 A 52 52 ASN N N 52 116.145 116.580 -0.435 1
1 553 . 2 1 1 A 53 53 GLY H H 53 7.730 8.256 -0.526 1
1 554 . 2 1 1 A 53 53 GLY HA2 H 53 4.430 4.346 0.084 1
1 555 . 2 1 1 A 53 53 GLY HA3 H 53 4.089 4.373 -0.284 1
1 556 . 2 1 1 A 53 53 GLY C C 53 174.810 174.268 0.542 1
1 557 . 2 1 1 A 53 53 GLY CA C 53 44.987 45.776 -0.789 1
1 558 . 2 1 1 A 53 53 GLY N N 53 106.196 111.521 -5.325 1
1 559 . 2 1 1 A 54 54 LEU H H 54 8.764 9.315 -0.551 1
1 560 . 2 1 1 A 54 54 LEU HA H 54 4.041 4.145 -0.104 1
1 570 . 2 1 1 A 54 54 LEU C C 54 179.712 178.499 1.213 1
1 571 . 2 1 1 A 54 54 LEU CA C 54 58.310 57.539 0.771 1
1 572 . 2 1 1 A 54 54 LEU CB C 54 42.390 41.775 0.615 1
1 576 . 2 1 1 A 54 54 LEU N N 54 118.836 119.717 -0.881 1
1 577 . 2 1 1 A 55 55 ALA H H 55 7.593 9.176 -1.583 1
1 578 . 2 1 1 A 55 55 ALA HA H 55 4.275 3.882 0.393 1
1 582 . 2 1 1 A 55 55 ALA C C 55 181.307 179.750 1.557 1
1 583 . 2 1 1 A 55 55 ALA CA C 55 54.825 55.132 -0.307 1
1 584 . 2 1 1 A 55 55 ALA CB C 55 18.345 18.318 0.027 1
1 585 . 2 1 1 A 55 55 ALA N N 55 118.782 121.735 -2.953 1
1 586 . 2 1 1 A 56 56 SER H H 56 9.339 7.926 1.413 1
1 587 . 2 1 1 A 56 56 SER HA H 56 4.023 4.212 -0.189 1
1 589 . 2 1 1 A 56 56 SER C C 56 176.392 176.995 -0.603 1
1 590 . 2 1 1 A 56 56 SER CA C 56 60.984 61.324 -0.340 1
1 591 . 2 1 1 A 56 56 SER CB C 56 62.987 62.837 0.150 1
1 592 . 2 1 1 A 56 56 SER N N 56 117.631 113.389 4.242 1
1 593 . 2 1 1 A 57 57 GLN H H 57 7.942 8.040 -0.098 1
1 594 . 2 1 1 A 57 57 GLN HA H 57 4.034 4.034 0.000 1
1 601 . 2 1 1 A 57 57 GLN C C 57 177.400 178.587 -1.187 1
1 602 . 2 1 1 A 57 57 GLN CA C 57 58.362 59.299 -0.937 1
1 603 . 2 1 1 A 57 57 GLN CB C 57 28.801 28.349 0.452 1
1 605 . 2 1 1 A 57 57 GLN N N 57 118.162 121.439 -3.277 1
1 607 . 2 1 1 A 58 58 GLU H H 58 7.683 7.804 -0.121 1
1 608 . 2 1 1 A 58 58 GLU HA H 58 4.163 4.052 0.111 1
1 613 . 2 1 1 A 58 58 GLU C C 58 179.248 176.656 2.592 1
1 614 . 2 1 1 A 58 58 GLU CA C 58 59.559 58.784 0.775 1
1 615 . 2 1 1 A 58 58 GLU CB C 58 29.317 29.509 -0.192 1
1 617 . 2 1 1 A 58 58 GLU N N 58 119.877 119.553 0.324 1
1 618 . 2 1 1 A 59 59 GLY H H 59 7.446 7.299 0.147 1
1 619 . 2 1 1 A 59 59 GLY HA2 H 59 4.100 3.967 0.133 1
1 620 . 2 1 1 A 59 59 GLY HA3 H 59 3.770 3.980 -0.210 1
1 621 . 2 1 1 A 59 59 GLY C C 59 175.432 175.208 0.224 1
1 622 . 2 1 1 A 59 59 GLY CA C 59 46.817 45.339 1.478 1
1 623 . 2 1 1 A 59 59 GLY N N 59 102.653 107.744 -5.091 1
1 624 . 2 1 1 A 60 60 THR H H 60 8.343 7.988 0.355 1
1 625 . 2 1 1 A 60 60 THR HA H 60 4.037 4.153 -0.116 1
1 630 . 2 1 1 A 60 60 THR C C 60 175.843 174.794 1.049 1
1 631 . 2 1 1 A 60 60 THR CA C 60 64.792 65.271 -0.479 1
1 632 . 2 1 1 A 60 60 THR CB C 60 69.325 69.410 -0.085 1
1 634 . 2 1 1 A 60 60 THR N N 60 113.863 113.119 0.744 1
1 635 . 2 1 1 A 61 61 ILE H H 61 8.802 7.535 1.267 1
1 636 . 2 1 1 A 61 61 ILE HA H 61 3.631 4.071 -0.440 1
1 646 . 2 1 1 A 61 61 ILE C C 61 174.198 174.442 -0.244 1
1 647 . 2 1 1 A 61 61 ILE CA C 61 62.938 61.094 1.844 1
1 648 . 2 1 1 A 61 61 ILE CB C 61 37.225 36.140 1.085 1
1 652 . 2 1 1 A 61 61 ILE N N 61 126.153 119.782 6.371 1
1 653 . 2 1 1 A 62 62 GLN H H 62 7.124 9.628 -2.504 1
1 654 . 2 1 1 A 62 62 GLN HA H 62 4.500 4.715 -0.215 1
1 661 . 2 1 1 A 62 62 GLN C C 62 174.556 175.171 -0.615 1
1 662 . 2 1 1 A 62 62 GLN CA C 62 53.364 54.002 -0.638 1
1 663 . 2 1 1 A 62 62 GLN CB C 62 32.196 31.612 0.584 1
1 665 . 2 1 1 A 62 62 GLN N N 62 123.730 126.716 -2.986 1
1 667 . 2 1 1 A 63 63 LYS H H 63 8.399 8.583 -0.184 1
1 668 . 2 1 1 A 63 63 LYS HA H 63 3.464 4.308 -0.844 1
1 677 . 2 1 1 A 63 63 LYS CA C 63 57.905 58.259 -0.354 1
1 678 . 2 1 1 A 63 63 LYS CB C 63 32.260 32.047 0.213 1
1 682 . 2 1 1 A 63 63 LYS N N 63 121.381 124.284 -2.903 1
1 683 . 2 1 1 A 64 64 GLY H H 64 9.265 8.594 0.671 1
1 684 . 2 1 1 A 64 64 GLY HA2 H 64 4.415 4.031 0.384 1
1 685 . 2 1 1 A 64 64 GLY HA3 H 64 3.639 4.044 -0.405 1
1 686 . 2 1 1 A 64 64 GLY CA C 64 44.881 45.061 -0.180 1
1 687 . 2 1 1 A 64 64 GLY N N 64 113.750 114.992 -1.242 1
1 688 . 2 1 1 A 65 65 ASN H H 65 7.594 8.368 -0.774 1
1 689 . 2 1 1 A 65 65 ASN HA H 65 4.798 4.798 0.000 1
1 694 . 2 1 1 A 65 65 ASN C C 65 175.042 173.891 1.151 1
1 695 . 2 1 1 A 65 65 ASN CA C 65 53.047 53.411 -0.364 1
1 696 . 2 1 1 A 65 65 ASN CB C 65 38.153 40.058 -1.905 1
1 697 . 2 1 1 A 65 65 ASN N N 65 117.999 119.904 -1.905 1
1 699 . 2 1 1 A 66 66 GLU H H 66 8.538 8.503 0.035 1
1 700 . 2 1 1 A 66 66 GLU HA H 66 4.634 4.758 -0.124 1
1 705 . 2 1 1 A 66 66 GLU C C 66 176.620 175.302 1.318 1
1 706 . 2 1 1 A 66 66 GLU CA C 66 55.863 55.020 0.843 1
1 707 . 2 1 1 A 66 66 GLU CB C 66 30.899 31.129 -0.230 1
1 709 . 2 1 1 A 66 66 GLU N N 66 122.233 121.675 0.558 1
1 710 . 2 1 1 A 67 67 VAL H H 67 8.452 9.038 -0.586 1
1 711 . 2 1 1 A 67 67 VAL HA H 67 4.172 4.145 0.027 1
1 719 . 2 1 1 A 67 67 VAL C C 67 174.641 175.433 -0.792 1
1 720 . 2 1 1 A 67 67 VAL CA C 67 61.856 62.805 -0.949 1
1 721 . 2 1 1 A 67 67 VAL CB C 67 31.066 31.100 -0.034 1
1 724 . 2 1 1 A 67 67 VAL N N 67 126.311 127.786 -1.475 1
1 725 . 2 1 1 A 68 68 LEU H H 68 9.000 8.732 0.268 1
1 726 . 2 1 1 A 68 68 LEU HA H 68 4.390 4.150 0.240 1
1 736 . 2 1 1 A 68 68 LEU C C 68 178.924 176.894 2.030 1
1 737 . 2 1 1 A 68 68 LEU CA C 68 56.990 56.731 0.259 1
1 738 . 2 1 1 A 68 68 LEU CB C 68 42.392 42.482 -0.090 1
1 742 . 2 1 1 A 68 68 LEU N N 68 127.175 130.153 -2.978 1
1 743 . 2 1 1 A 69 69 SER H H 69 7.666 7.801 -0.135 1
1 744 . 2 1 1 A 69 69 SER HA H 69 5.144 5.036 0.108 1
1 747 . 2 1 1 A 69 69 SER C C 69 172.722 172.342 0.380 1
1 748 . 2 1 1 A 69 69 SER CA C 69 57.606 57.303 0.303 1
1 749 . 2 1 1 A 69 69 SER CB C 69 64.511 66.391 -1.880 1
1 750 . 2 1 1 A 69 69 SER N N 69 110.346 108.977 1.369 1
1 751 . 2 1 1 A 70 70 ILE H H 70 7.965 8.500 -0.535 1
1 752 . 2 1 1 A 70 70 ILE HA H 70 4.548 4.774 -0.226 1
1 762 . 2 1 1 A 70 70 ILE C C 70 174.993 176.131 -1.138 1
1 763 . 2 1 1 A 70 70 ILE CA C 70 60.897 60.298 0.599 1
1 764 . 2 1 1 A 70 70 ILE CB C 70 41.186 40.509 0.677 1
1 768 . 2 1 1 A 70 70 ILE N N 70 119.579 120.743 -1.164 1
1 769 . 2 1 1 A 71 71 ASN H H 71 9.839 10.467 -0.628 1
1 770 . 2 1 1 A 71 71 ASN HA H 71 4.485 4.417 0.068 1
1 775 . 2 1 1 A 71 71 ASN C C 71 174.975 174.745 0.230 1
1 776 . 2 1 1 A 71 71 ASN CA C 71 54.085 54.234 -0.149 1
1 777 . 2 1 1 A 71 71 ASN CB C 71 36.255 37.172 -0.917 1
1 778 . 2 1 1 A 71 71 ASN N N 71 126.963 125.768 1.195 1
1 780 . 2 1 1 A 72 72 GLY H H 72 8.911 8.462 0.449 1
1 781 . 2 1 1 A 72 72 GLY HA2 H 72 4.149 3.859 0.290 1
1 782 . 2 1 1 A 72 72 GLY HA3 H 72 3.507 3.860 -0.353 1
1 783 . 2 1 1 A 72 72 GLY C C 72 173.594 173.976 -0.382 1
1 784 . 2 1 1 A 72 72 GLY CA C 72 45.162 45.448 -0.286 1
1 785 . 2 1 1 A 72 72 GLY N N 72 103.020 104.281 -1.261 1
1 786 . 2 1 1 A 73 73 LYS H H 73 7.922 7.615 0.307 1
1 787 . 2 1 1 A 73 73 LYS HA H 73 4.485 4.317 0.168 1
1 796 . 2 1 1 A 73 73 LYS C C 73 175.036 175.804 -0.768 1
1 797 . 2 1 1 A 73 73 LYS CA C 73 54.719 55.521 -0.802 1
1 798 . 2 1 1 A 73 73 LYS CB C 73 32.137 32.040 0.097 1
1 802 . 2 1 1 A 73 73 LYS N N 73 122.413 120.575 1.838 1
1 803 . 2 1 1 A 74 74 SER H H 74 8.585 8.814 -0.229 1
1 804 . 2 1 1 A 74 74 SER HA H 74 4.452 4.715 -0.263 1
1 807 . 2 1 1 A 74 74 SER C C 74 175.965 173.998 1.967 1
1 808 . 2 1 1 A 74 74 SER CA C 74 58.028 58.581 -0.553 1
1 809 . 2 1 1 A 74 74 SER CB C 74 63.799 63.816 -0.017 1
1 810 . 2 1 1 A 74 74 SER N N 74 118.737 121.596 -2.859 1
1 811 . 2 1 1 A 75 75 LEU H H 75 8.015 8.303 -0.288 1
1 812 . 2 1 1 A 75 75 LEU HA H 75 4.661 4.482 0.179 1
1 822 . 2 1 1 A 75 75 LEU C C 75 178.117 177.367 0.750 1
1 823 . 2 1 1 A 75 75 LEU CA C 75 53.980 54.657 -0.677 1
1 824 . 2 1 1 A 75 75 LEU CB C 75 40.830 40.894 -0.064 1
1 828 . 2 1 1 A 75 75 LEU N N 75 125.425 125.776 -0.351 1
1 829 . 2 1 1 A 76 76 LYS H H 76 8.099 8.651 -0.552 1
1 830 . 2 1 1 A 76 76 LYS HA H 76 4.210 4.406 -0.196 1
1 839 . 2 1 1 A 76 76 LYS C C 76 178.487 176.754 1.733 1
1 840 . 2 1 1 A 76 76 LYS CA C 76 58.010 55.455 2.555 1
1 841 . 2 1 1 A 76 76 LYS CB C 76 31.683 31.642 0.041 1
1 845 . 2 1 1 A 76 76 LYS N N 76 124.064 120.052 4.012 1
1 846 . 2 1 1 A 77 77 GLY H H 77 8.859 7.841 1.018 1
1 847 . 2 1 1 A 77 77 GLY HA2 H 77 4.110 4.056 0.054 1
1 848 . 2 1 1 A 77 77 GLY HA3 H 77 3.869 4.059 -0.190 1
1 849 . 2 1 1 A 77 77 GLY C C 77 174.335 174.724 -0.389 1
1 850 . 2 1 1 A 77 77 GLY CA C 77 46.232 44.975 1.257 1
1 851 . 2 1 1 A 77 77 GLY N N 77 115.659 108.709 6.950 1
1 852 . 2 1 1 A 78 78 THR H H 78 7.654 7.754 -0.100 1
1 853 . 2 1 1 A 78 78 THR HA H 78 4.624 4.153 0.471 1
1 858 . 2 1 1 A 78 78 THR C C 78 177.272 174.737 2.535 1
1 859 . 2 1 1 A 78 78 THR CA C 78 61.794 63.232 -1.438 1
1 860 . 2 1 1 A 78 78 THR CB C 78 70.595 69.190 1.405 1
1 862 . 2 1 1 A 78 78 THR N N 78 112.847 116.609 -3.762 1
1 863 . 2 1 1 A 79 79 THR H H 79 8.813 8.598 0.215 1
1 864 . 2 1 1 A 79 79 THR HA H 79 4.395 4.680 -0.285 1
1 869 . 2 1 1 A 79 79 THR C C 79 174.503 175.354 -0.851 1
1 870 . 2 1 1 A 79 79 THR CA C 79 61.724 61.144 0.580 1
1 871 . 2 1 1 A 79 79 THR CB C 79 71.007 70.686 0.321 1
1 873 . 2 1 1 A 79 79 THR N N 79 114.123 117.939 -3.816 1
1 874 . 2 1 1 A 80 80 HIS H H 80 10.266 9.202 1.064 1
1 875 . 2 1 1 A 80 80 HIS HA H 80 4.331 4.179 0.152 1
1 880 . 2 1 1 A 80 80 HIS C C 80 177.075 176.892 0.183 1
1 881 . 2 1 1 A 80 80 HIS CA C 80 61.338 60.285 1.053 1
1 882 . 2 1 1 A 80 80 HIS CB C 80 28.651 30.753 -2.102 1
1 885 . 2 1 1 A 80 80 HIS N N 80 122.776 122.001 0.775 1
1 886 . 2 1 1 A 81 81 HIS H H 81 9.335 8.167 1.168 1
1 887 . 2 1 1 A 81 81 HIS HA H 81 4.078 4.090 -0.012 1
1 892 . 2 1 1 A 81 81 HIS C C 81 178.269 176.590 1.679 1
1 893 . 2 1 1 A 81 81 HIS CA C 81 60.210 59.837 0.373 1
1 894 . 2 1 1 A 81 81 HIS CB C 81 29.569 29.892 -0.323 1
1 897 . 2 1 1 A 81 81 HIS N N 81 114.733 119.008 -4.275 1
1 898 . 2 1 1 A 82 82 ASP H H 82 7.741 8.022 -0.281 1
1 899 . 2 1 1 A 82 82 ASP HA H 82 4.452 4.072 0.380 1
1 902 . 2 1 1 A 82 82 ASP C C 82 178.683 179.084 -0.401 1
1 903 . 2 1 1 A 82 82 ASP CA C 82 57.148 57.372 -0.224 1
1 904 . 2 1 1 A 82 82 ASP CB C 82 39.522 40.389 -0.867 1
1 905 . 2 1 1 A 82 82 ASP N N 82 121.407 118.020 3.387 1
1 906 . 2 1 1 A 83 83 ALA H H 83 8.502 8.456 0.046 1
1 907 . 2 1 1 A 83 83 ALA HA H 83 3.939 4.081 -0.142 1
1 911 . 2 1 1 A 83 83 ALA C C 83 179.361 179.422 -0.061 1
1 912 . 2 1 1 A 83 83 ALA CA C 83 55.635 54.843 0.792 1
1 913 . 2 1 1 A 83 83 ALA CB C 83 18.124 18.754 -0.630 1
1 914 . 2 1 1 A 83 83 ALA N N 83 125.049 122.800 2.249 1
1 915 . 2 1 1 A 84 84 LEU H H 84 8.100 8.382 -0.282 1
1 916 . 2 1 1 A 84 84 LEU HA H 84 3.792 3.847 -0.055 1
1 926 . 2 1 1 A 84 84 LEU C C 84 180.173 179.082 1.091 1
1 927 . 2 1 1 A 84 84 LEU CA C 84 57.932 58.003 -0.071 1
1 928 . 2 1 1 A 84 84 LEU CB C 84 41.157 41.543 -0.386 1
1 932 . 2 1 1 A 84 84 LEU N N 84 117.139 118.330 -1.191 1
1 933 . 2 1 1 A 85 85 ALA H H 85 7.715 8.645 -0.930 1
1 934 . 2 1 1 A 85 85 ALA HA H 85 4.061 4.126 -0.065 1
1 938 . 2 1 1 A 85 85 ALA C C 85 180.380 179.698 0.682 1
1 939 . 2 1 1 A 85 85 ALA CA C 85 55.212 55.415 -0.203 1
1 940 . 2 1 1 A 85 85 ALA CB C 85 17.803 18.602 -0.799 1
1 941 . 2 1 1 A 85 85 ALA N N 85 122.448 121.389 1.059 1
1 942 . 2 1 1 A 86 86 ILE H H 86 7.669 7.866 -0.197 1
1 943 . 2 1 1 A 86 86 ILE HA H 86 3.678 3.698 -0.020 1
1 953 . 2 1 1 A 86 86 ILE C C 86 178.692 178.897 -0.205 1
1 954 . 2 1 1 A 86 86 ILE CA C 86 65.226 64.793 0.433 1
1 955 . 2 1 1 A 86 86 ILE CB C 86 38.099 37.804 0.295 1
1 959 . 2 1 1 A 86 86 ILE N N 86 121.804 117.847 3.957 1
1 960 . 2 1 1 A 87 87 LEU H H 87 7.922 8.391 -0.469 1
1 961 . 2 1 1 A 87 87 LEU HA H 87 3.903 4.030 -0.127 1
1 971 . 2 1 1 A 87 87 LEU C C 87 178.610 178.592 0.018 1
1 972 . 2 1 1 A 87 87 LEU CA C 87 58.221 57.927 0.294 1
1 973 . 2 1 1 A 87 87 LEU CB C 87 42.344 41.458 0.886 1
1 977 . 2 1 1 A 87 87 LEU N N 87 121.947 121.688 0.259 1
1 978 . 2 1 1 A 88 88 ARG H H 88 8.317 8.287 0.030 1
1 979 . 2 1 1 A 88 88 ARG HA H 88 4.060 4.180 -0.120 1
1 986 . 2 1 1 A 88 88 ARG C C 88 180.698 176.932 3.766 1
1 987 . 2 1 1 A 88 88 ARG CA C 88 59.383 58.491 0.892 1
1 988 . 2 1 1 A 88 88 ARG CB C 88 30.055 29.766 0.289 1
1 991 . 2 1 1 A 88 88 ARG N N 88 119.343 119.264 0.079 1
1 992 . 2 1 1 A 89 89 GLN H H 89 8.270 7.723 0.547 1
1 993 . 2 1 1 A 89 89 GLN HA H 89 4.122 4.275 -0.153 1
1 1000 . 2 1 1 A 89 89 GLN C C 89 177.955 178.090 -0.135 1
1 1001 . 2 1 1 A 89 89 GLN CA C 89 58.714 57.078 1.636 1
1 1002 . 2 1 1 A 89 89 GLN CB C 89 28.160 29.311 -1.151 1
1 1004 . 2 1 1 A 89 89 GLN N N 89 121.097 117.368 3.729 1
1 1006 . 2 1 1 A 90 90 ALA H H 90 7.558 7.717 -0.159 1
1 1007 . 2 1 1 A 90 90 ALA HA H 90 4.123 4.178 -0.055 1
1 1011 . 2 1 1 A 90 90 ALA C C 90 178.076 178.306 -0.230 1
1 1012 . 2 1 1 A 90 90 ALA CA C 90 52.942 53.877 -0.935 1
1 1013 . 2 1 1 A 90 90 ALA CB C 90 18.015 18.314 -0.299 1
1 1014 . 2 1 1 A 90 90 ALA N N 90 119.652 121.715 -2.063 1
1 1015 . 2 1 1 A 91 91 ARG H H 91 7.768 8.099 -0.331 1
1 1016 . 2 1 1 A 91 91 ARG HA H 91 4.065 4.253 -0.188 1
1 1022 . 2 1 1 A 91 91 ARG C C 91 177.858 177.994 -0.136 1
1 1023 . 2 1 1 A 91 91 ARG CA C 91 58.573 57.575 0.998 1
1 1024 . 2 1 1 A 91 91 ARG CB C 91 30.384 30.726 -0.342 1
1 1027 . 2 1 1 A 91 91 ARG N N 91 118.081 116.907 1.174 1
1 1028 . 2 1 1 A 92 92 GLU H H 92 7.691 7.974 -0.283 1
1 1029 . 2 1 1 A 92 92 GLU HA H 92 4.123 4.152 -0.029 1
1 1034 . 2 1 1 A 92 92 GLU C C 92 174.459 176.758 -2.299 1
1 1035 . 2 1 1 A 92 92 GLU CA C 92 61.565 60.843 0.722 1
1 1036 . 2 1 1 A 92 92 GLU CB C 92 27.583 28.669 -1.086 1
1 1038 . 2 1 1 A 92 92 GLU N N 92 118.447 119.046 -0.599 1
1 1039 . 2 1 1 A 93 93 PRO HA H 93 4.716 4.541 0.175 1
1 1046 . 2 1 1 A 93 93 PRO C C 93 176.221 176.596 -0.375 1
1 1047 . 2 1 1 A 93 93 PRO CA C 93 63.149 62.529 0.620 1
1 1048 . 2 1 1 A 93 93 PRO CB C 93 32.571 33.178 -0.607 1
1 1051 . 2 1 1 A 94 94 ARG H H 94 8.434 8.994 -0.560 1
1 1052 . 2 1 1 A 94 94 ARG HA H 94 4.232 4.780 -0.548 1
1 1058 . 2 1 1 A 94 94 ARG C C 94 175.323 175.780 -0.457 1
1 1059 . 2 1 1 A 94 94 ARG CA C 94 56.972 56.587 0.385 1
1 1060 . 2 1 1 A 94 94 ARG CB C 94 30.448 30.841 -0.393 1
1 1063 . 2 1 1 A 94 94 ARG N N 94 115.987 119.359 -3.372 1
1 1064 . 2 1 1 A 95 95 GLN H H 95 7.246 7.563 -0.317 1
1 1065 . 2 1 1 A 95 95 GLN HA H 95 5.251 5.213 0.038 1
1 1072 . 2 1 1 A 95 95 GLN C C 95 174.786 173.739 1.047 1
1 1073 . 2 1 1 A 95 95 GLN CA C 95 54.209 54.877 -0.668 1
1 1074 . 2 1 1 A 95 95 GLN CB C 95 32.384 32.458 -0.074 1
1 1076 . 2 1 1 A 95 95 GLN N N 95 115.998 119.639 -3.641 1
1 1078 . 2 1 1 A 96 96 ALA H H 96 8.739 8.135 0.604 1
1 1079 . 2 1 1 A 96 96 ALA HA H 96 5.412 5.205 0.207 1
1 1083 . 2 1 1 A 96 96 ALA C C 96 175.258 175.958 -0.700 1
1 1084 . 2 1 1 A 96 96 ALA CA C 96 50.355 50.757 -0.402 1
1 1085 . 2 1 1 A 96 96 ALA CB C 96 24.270 22.904 1.366 1
1 1086 . 2 1 1 A 96 96 ALA N N 96 126.197 124.497 1.700 1
1 1087 . 2 1 1 A 97 97 VAL H H 97 8.568 8.727 -0.159 1
1 1088 . 2 1 1 A 97 97 VAL HA H 97 4.804 4.630 0.174 1
1 1096 . 2 1 1 A 97 97 VAL C C 97 175.982 174.548 1.434 1
1 1097 . 2 1 1 A 97 97 VAL CA C 97 61.442 61.388 0.054 1
1 1098 . 2 1 1 A 97 97 VAL CB C 97 33.413 33.537 -0.124 1
1 1101 . 2 1 1 A 97 97 VAL N N 97 120.702 120.611 0.091 1
1 1102 . 2 1 1 A 98 98 ILE H H 98 9.753 8.648 1.105 1
1 1103 . 2 1 1 A 98 98 ILE HA H 98 4.826 4.974 -0.148 1
1 1113 . 2 1 1 A 98 98 ILE C C 98 174.292 174.668 -0.376 1
1 1114 . 2 1 1 A 98 98 ILE CA C 98 59.981 59.771 0.210 1
1 1115 . 2 1 1 A 98 98 ILE CB C 98 40.608 40.593 0.015 1
1 1119 . 2 1 1 A 98 98 ILE N N 98 131.738 127.343 4.395 1
1 1120 . 2 1 1 A 99 99 VAL H H 99 8.493 8.635 -0.142 1
1 1121 . 2 1 1 A 99 99 VAL HA H 99 5.201 4.644 0.557 1
1 1129 . 2 1 1 A 99 99 VAL C C 99 176.557 175.541 1.016 1
1 1130 . 2 1 1 A 99 99 VAL CA C 99 61.495 61.219 0.276 1
1 1131 . 2 1 1 A 99 99 VAL CB C 99 32.327 32.245 0.082 1
1 1134 . 2 1 1 A 99 99 VAL N N 99 129.537 129.175 0.362 1
1 1135 . 2 1 1 A 100 100 THR H H 100 9.050 8.450 0.600 1
1 1136 . 2 1 1 A 100 100 THR HA H 100 5.606 5.172 0.434 1
1 1141 . 2 1 1 A 100 100 THR C C 100 172.815 172.957 -0.142 1
1 1142 . 2 1 1 A 100 100 THR CA C 100 59.049 59.341 -0.292 1
1 1143 . 2 1 1 A 100 100 THR CB C 100 73.966 72.054 1.912 1
1 1145 . 2 1 1 A 100 100 THR N N 100 117.469 117.175 0.294 1
1 1146 . 2 1 1 A 101 101 ARG H H 101 8.773 8.493 0.280 1
1 1147 . 2 1 1 A 101 101 ARG HA H 101 4.989 4.788 0.201 1
1 1155 . 2 1 1 A 101 101 ARG C C 101 174.738 176.379 -1.641 1
1 1156 . 2 1 1 A 101 101 ARG CA C 101 54.825 54.504 0.321 1
1 1157 . 2 1 1 A 101 101 ARG CB C 101 34.636 32.317 2.319 1
1 1160 . 2 1 1 A 101 101 ARG N N 101 117.532 121.377 -3.845 1
1 1162 . 2 1 1 A 102 102 LYS H H 102 8.616 8.109 0.507 1
1 1163 . 2 1 1 A 102 102 LYS HA H 102 4.232 4.490 -0.258 1
1 1171 . 2 1 1 A 102 102 LYS C C 102 175.935 175.338 0.597 1
1 1172 . 2 1 1 A 102 102 LYS CA C 102 56.549 56.267 0.282 1
1 1173 . 2 1 1 A 102 102 LYS CB C 102 33.266 32.789 0.477 1
1 1177 . 2 1 1 A 102 102 LYS N N 102 126.899 121.986 4.913 1
1 1178 . 2 1 1 A 103 103 LEU H H 103 8.424 8.795 -0.371 1
1 1179 . 2 1 1 A 103 103 LEU HA H 103 4.540 5.017 -0.477 1
1 1189 . 2 1 1 A 103 103 LEU C C 103 176.956 176.881 0.075 1
1 1190 . 2 1 1 A 103 103 LEU CA C 103 54.755 53.389 1.366 1
1 1191 . 2 1 1 A 103 103 LEU CB C 103 42.929 44.878 -1.949 1
1 1195 . 2 1 1 A 103 103 LEU N N 103 126.246 126.176 0.070 1
1 1196 . 2 1 1 A 104 104 THR H H 104 8.201 8.745 -0.544 1
1 1197 . 2 1 1 A 104 104 THR HA H 104 4.624 4.747 -0.123 1
1 1202 . 2 1 1 A 104 104 THR C C 104 172.954 173.791 -0.837 1
1 1203 . 2 1 1 A 104 104 THR CA C 104 59.483 60.432 -0.949 1
1 1204 . 2 1 1 A 104 104 THR CB C 104 69.761 68.917 0.844 1
1 1206 . 2 1 1 A 104 104 THR N N 104 117.263 115.588 1.675 1
1 1207 . 2 1 1 A 105 105 PRO HA H 105 4.399 4.687 -0.288 1
1 1213 . 2 1 1 A 105 105 PRO CA C 105 63.495 62.393 1.102 1
1 1214 . 2 1 1 A 105 105 PRO CB C 105 32.096 33.251 -1.155 1
1 1217 . 2 1 1 A 106 106 GLU H H 106 8.519 8.653 -0.134 1
1 1218 . 2 1 1 A 106 106 GLU HA H 106 4.197 4.788 -0.591 1
1 1221 . 2 1 1 A 106 106 GLU C C 106 176.110 175.976 0.134 1
1 1222 . 2 1 1 A 106 106 GLU CA C 106 56.743 55.599 1.144 1
1 1223 . 2 1 1 A 106 106 GLU CB C 106 30.137 29.655 0.482 1
1 1225 . 2 1 1 A 106 106 GLU N N 106 120.609 115.893 4.716 1
1 1226 . 2 1 1 A 107 107 ALA H H 107 8.241 8.209 0.032 1
1 1227 . 2 1 1 A 107 107 ALA HA H 107 4.317 5.117 -0.800 1
1 1231 . 2 1 1 A 107 107 ALA C C 107 177.299 176.066 1.233 1
1 1232 . 2 1 1 A 107 107 ALA CA C 107 52.203 50.184 2.019 1
1 1233 . 2 1 1 A 107 107 ALA CB C 107 19.392 23.405 -4.013 1
1 1234 . 2 1 1 A 107 107 ALA N N 107 124.849 122.903 1.946 1
1 1235 . 2 1 1 A 108 108 MET H H 108 8.284 8.403 -0.119 1
1 1236 . 2 1 1 A 108 108 MET HA H 108 4.792 4.774 0.018 1
1 1244 . 2 1 1 A 108 108 MET C C 108 174.337 174.377 -0.040 1
1 1245 . 2 1 1 A 108 108 MET CA C 108 53.258 54.970 -1.712 1
1 1246 . 2 1 1 A 108 108 MET CB C 108 32.608 32.260 0.348 1
1 1249 . 2 1 1 A 108 108 MET N N 108 121.025 119.149 1.876 1
1 1250 . 2 1 1 A 109 109 PRO HA H 109 4.408 4.794 -0.386 1
1 1256 . 2 1 1 A 109 109 PRO C C 109 176.412 175.341 1.071 1
1 1257 . 2 1 1 A 109 109 PRO CA C 109 63.290 62.634 0.656 1
1 1258 . 2 1 1 A 109 109 PRO CB C 109 32.077 31.781 0.296 1
1 1261 . 2 1 1 A 110 110 ASP H H 110 8.417 8.911 -0.494 1
1 1262 . 2 1 1 A 110 110 ASP HA H 110 4.573 4.944 -0.371 1
1 1265 . 2 1 1 A 110 110 ASP C C 110 176.508 175.336 1.172 1
1 1266 . 2 1 1 A 110 110 ASP CA C 110 54.085 53.163 0.922 1
1 1267 . 2 1 1 A 110 110 ASP CB C 110 41.075 43.701 -2.626 1
1 1268 . 2 1 1 A 110 110 ASP N N 110 120.239 123.049 -2.810 1
1 1269 . 2 1 1 A 111 111 LEU H H 111 8.279 8.785 -0.506 1
1 1270 . 2 1 1 A 111 111 LEU HA H 111 4.319 4.326 -0.007 1
1 1280 . 2 1 1 A 111 111 LEU C C 111 177.551 175.820 1.731 1
1 1281 . 2 1 1 A 111 111 LEU CA C 111 55.581 55.058 0.523 1
1 1282 . 2 1 1 A 111 111 LEU CB C 111 42.360 42.411 -0.051 1
1 1286 . 2 1 1 A 111 111 LEU N N 111 123.318 126.660 -3.342 1
1 1287 . 2 1 1 A 112 112 ASN H H 112 8.487 8.536 -0.049 1
1 1288 . 2 1 1 A 112 112 ASN HA H 112 4.725 5.514 -0.789 1
1 1293 . 2 1 1 A 112 112 ASN C C 112 175.454 174.317 1.137 1
1 1294 . 2 1 1 A 112 112 ASN CA C 112 53.610 51.805 1.805 1
1 1295 . 2 1 1 A 112 112 ASN CB C 112 39.116 41.808 -2.692 1
1 1296 . 2 1 1 A 112 112 ASN N N 112 118.752 119.135 -0.383 1
1 1298 . 2 1 1 A 115 115 GLY H H 115 8.205 8.680 -0.475 1
1 1299 . 2 1 1 A 115 115 GLY HA2 H 115 4.126 4.191 -0.065 1
1 1300 . 2 1 1 A 115 115 GLY HA3 H 115 4.126 4.191 -0.065 1
1 1301 . 2 1 1 A 115 115 GLY CA C 115 44.727 44.842 -0.115 1
1 1302 . 2 1 1 A 116 116 PRO HA H 116 4.485 4.744 -0.259 1
1 1309 . 2 1 1 A 116 116 PRO CA C 116 63.298 62.667 0.631 1
1 1310 . 2 1 1 A 116 116 PRO CB C 116 32.077 33.451 -1.374 1
1 1313 . 2 1 1 A 117 117 SER H H 117 8.532 9.013 -0.481 1
1 1 . 3 1 1 A 7 7 GLY HA2 H 7 3.960 4.180 -0.220 1
1 2 . 3 1 1 A 7 7 GLY HA3 H 7 3.960 4.181 -0.221 1
1 3 . 3 1 1 A 7 7 GLY C C 7 174.009 172.131 1.878 1
1 4 . 3 1 1 A 7 7 GLY CA C 7 45.374 45.454 -0.080 1
1 5 . 3 1 1 A 8 8 ALA H H 8 8.163 8.486 -0.323 1
1 6 . 3 1 1 A 8 8 ALA HA H 8 4.381 4.779 -0.398 1
1 10 . 3 1 1 A 8 8 ALA C C 8 178.078 175.777 2.301 1
1 11 . 3 1 1 A 8 8 ALA CA C 8 52.677 51.105 1.572 1
1 12 . 3 1 1 A 8 8 ALA CB C 8 19.368 19.544 -0.176 1
1 13 . 3 1 1 A 8 8 ALA N N 8 123.721 122.093 1.628 1
1 14 . 3 1 1 A 9 9 THR H H 9 8.142 8.632 -0.490 1
1 15 . 3 1 1 A 9 9 THR HA H 9 4.353 4.762 -0.409 1
1 20 . 3 1 1 A 9 9 THR C C 9 174.597 174.985 -0.388 1
1 21 . 3 1 1 A 9 9 THR CA C 9 62.093 61.105 0.988 1
1 22 . 3 1 1 A 9 9 THR CB C 9 69.948 69.742 0.206 1
1 24 . 3 1 1 A 9 9 THR N N 9 113.761 118.776 -5.015 1
1 25 . 3 1 1 A 10 10 LEU H H 10 8.218 8.877 -0.659 1
1 26 . 3 1 1 A 10 10 LEU HA H 10 4.169 4.009 0.160 1
1 36 . 3 1 1 A 10 10 LEU C C 10 176.110 177.436 -1.326 1
1 37 . 3 1 1 A 10 10 LEU CA C 10 61.099 55.583 5.516 1
1 38 . 3 1 1 A 10 10 LEU CB C 10 38.686 40.708 -2.022 1
1 42 . 3 1 1 A 10 10 LEU N N 10 123.516 126.239 -2.723 1
1 43 . 3 1 1 A 11 11 LYS H H 11 8.496 8.337 0.159 1
1 44 . 3 1 1 A 11 11 LYS HA H 11 4.891 4.644 0.247 1
1 49 . 3 1 1 A 11 11 LYS C C 11 175.794 176.250 -0.456 1
1 50 . 3 1 1 A 11 11 LYS CA C 11 55.652 56.487 -0.835 1
1 51 . 3 1 1 A 11 11 LYS CB C 11 29.444 34.081 -4.637 1
1 52 . 3 1 1 A 11 11 LYS N N 11 125.141 121.401 3.740 1
1 53 . 3 1 1 A 12 12 GLN HA H 12 4.315 4.619 -0.304 1
1 54 . 3 1 1 A 12 12 GLN C C 12 176.300 173.591 2.709 1
1 55 . 3 1 1 A 12 12 GLN CA C 12 56.286 55.538 0.748 1
1 56 . 3 1 1 A 12 12 GLN CB C 12 32.901 31.789 1.112 1
1 57 . 3 1 1 A 13 13 LEU H H 13 8.410 8.697 -0.287 1
1 58 . 3 1 1 A 13 13 LEU HA H 13 4.348 4.661 -0.313 1
1 67 . 3 1 1 A 13 13 LEU C C 13 177.120 175.593 1.527 1
1 68 . 3 1 1 A 13 13 LEU CA C 13 55.142 54.051 1.091 1
1 69 . 3 1 1 A 13 13 LEU CB C 13 42.352 44.852 -2.500 1
1 73 . 3 1 1 A 13 13 LEU N N 13 124.340 121.858 2.482 1
1 74 . 3 1 1 A 14 14 ASP H H 14 8.250 9.396 -1.146 1
1 75 . 3 1 1 A 14 14 ASP HA H 14 4.540 4.346 0.194 1
1 78 . 3 1 1 A 14 14 ASP C C 14 176.769 176.396 0.373 1
1 79 . 3 1 1 A 14 14 ASP CA C 14 54.772 55.244 -0.472 1
1 80 . 3 1 1 A 14 14 ASP CB C 14 41.322 39.437 1.885 1
1 81 . 3 1 1 A 14 14 ASP N N 14 120.493 127.148 -6.655 1
1 82 . 3 1 1 A 15 15 GLY H H 15 8.428 8.682 -0.254 1
1 83 . 3 1 1 A 15 15 GLY HA2 H 15 4.089 3.920 0.169 1
1 84 . 3 1 1 A 15 15 GLY HA3 H 15 3.874 3.927 -0.053 1
1 85 . 3 1 1 A 15 15 GLY C C 15 174.122 174.591 -0.469 1
1 86 . 3 1 1 A 15 15 GLY CA C 15 45.972 46.674 -0.702 1
1 87 . 3 1 1 A 15 15 GLY N N 15 108.670 104.394 4.276 1
1 88 . 3 1 1 A 16 16 ILE H H 16 7.727 8.107 -0.380 1
1 89 . 3 1 1 A 16 16 ILE HA H 16 4.705 4.271 0.434 1
1 99 . 3 1 1 A 16 16 ILE C C 16 175.807 175.294 0.513 1
1 100 . 3 1 1 A 16 16 ILE CA C 16 60.703 61.255 -0.552 1
1 101 . 3 1 1 A 16 16 ILE CB C 16 38.509 38.462 0.047 1
1 105 . 3 1 1 A 16 16 ILE N N 16 120.267 121.716 -1.449 1
1 106 . 3 1 1 A 17 17 HIS H H 17 9.101 9.327 -0.226 1
1 107 . 3 1 1 A 17 17 HIS HA H 17 4.782 5.282 -0.500 1
1 112 . 3 1 1 A 17 17 HIS C C 17 173.051 172.406 0.645 1
1 113 . 3 1 1 A 17 17 HIS CA C 17 55.353 54.418 0.935 1
1 114 . 3 1 1 A 17 17 HIS CB C 17 32.468 33.089 -0.621 1
1 117 . 3 1 1 A 17 17 HIS N N 17 125.061 127.135 -2.074 1
1 118 . 3 1 1 A 18 18 VAL H H 18 8.427 8.754 -0.327 1
1 119 . 3 1 1 A 18 18 VAL HA H 18 4.375 5.058 -0.683 1
1 127 . 3 1 1 A 18 18 VAL C C 18 174.702 173.557 1.145 1
1 128 . 3 1 1 A 18 18 VAL CA C 18 62.035 59.688 2.347 1
1 129 . 3 1 1 A 18 18 VAL CB C 18 32.325 33.949 -1.624 1
1 132 . 3 1 1 A 18 18 VAL N N 18 127.069 127.197 -0.128 1
1 133 . 3 1 1 A 19 19 THR H H 19 9.272 8.689 0.583 1
1 134 . 3 1 1 A 19 19 THR HA H 19 4.512 4.932 -0.420 1
1 139 . 3 1 1 A 19 19 THR C C 19 172.784 173.225 -0.441 1
1 140 . 3 1 1 A 19 19 THR CA C 19 62.512 61.682 0.830 1
1 141 . 3 1 1 A 19 19 THR CB C 19 70.663 70.439 0.224 1
1 143 . 3 1 1 A 19 19 THR N N 19 126.619 121.744 4.875 1
1 144 . 3 1 1 A 20 20 ILE H H 20 8.737 9.165 -0.428 1
1 145 . 3 1 1 A 20 20 ILE HA H 20 4.870 4.690 0.180 1
1 155 . 3 1 1 A 20 20 ILE C C 20 175.315 174.681 0.634 1
1 156 . 3 1 1 A 20 20 ILE CA C 20 60.157 60.178 -0.021 1
1 157 . 3 1 1 A 20 20 ILE CB C 20 38.603 38.198 0.405 1
1 161 . 3 1 1 A 20 20 ILE N N 20 128.114 128.463 -0.349 1
1 162 . 3 1 1 A 21 21 LEU H H 21 8.902 8.839 0.063 1
1 163 . 3 1 1 A 21 21 LEU HA H 21 4.804 4.886 -0.082 1
1 173 . 3 1 1 A 21 21 LEU C C 21 175.565 175.374 0.191 1
1 174 . 3 1 1 A 21 21 LEU CA C 21 52.731 53.815 -1.084 1
1 175 . 3 1 1 A 21 21 LEU CB C 21 43.947 43.478 0.469 1
1 179 . 3 1 1 A 21 21 LEU N N 21 125.457 128.554 -3.097 1
1 180 . 3 1 1 A 22 22 HIS H H 22 8.577 9.089 -0.512 1
1 181 . 3 1 1 A 22 22 HIS HA H 22 5.013 5.082 -0.069 1
1 186 . 3 1 1 A 22 22 HIS C C 22 174.258 174.932 -0.674 1
1 187 . 3 1 1 A 22 22 HIS CA C 22 55.880 54.458 1.422 1
1 188 . 3 1 1 A 22 22 HIS CB C 22 30.901 31.020 -0.119 1
1 191 . 3 1 1 A 22 22 HIS N N 22 122.595 123.681 -1.086 1
1 192 . 3 1 1 A 23 23 LYS H H 23 8.712 9.726 -1.014 1
1 193 . 3 1 1 A 23 23 LYS HA H 23 4.880 4.925 -0.045 1
1 202 . 3 1 1 A 23 23 LYS C C 23 174.265 175.452 -1.187 1
1 203 . 3 1 1 A 23 23 LYS CA C 23 54.314 54.259 0.055 1
1 204 . 3 1 1 A 23 23 LYS CB C 23 36.068 36.036 0.032 1
1 208 . 3 1 1 A 23 23 LYS N N 23 120.814 121.168 -0.354 1
1 209 . 3 1 1 A 24 24 GLU H H 24 8.360 8.448 -0.088 1
1 210 . 3 1 1 A 24 24 GLU HA H 24 4.350 4.510 -0.160 1
1 215 . 3 1 1 A 24 24 GLU C C 24 177.843 176.798 1.045 1
1 216 . 3 1 1 A 24 24 GLU CA C 24 55.601 55.866 -0.265 1
1 217 . 3 1 1 A 24 24 GLU CB C 24 30.512 30.877 -0.365 1
1 219 . 3 1 1 A 24 24 GLU N N 24 117.859 119.944 -2.085 1
1 220 . 3 1 1 A 25 25 GLU H H 25 9.146 8.758 0.388 1
1 221 . 3 1 1 A 25 25 GLU HA H 25 3.924 3.904 0.020 1
1 226 . 3 1 1 A 25 25 GLU C C 25 177.809 177.651 0.158 1
1 227 . 3 1 1 A 25 25 GLU CA C 25 58.568 58.793 -0.225 1
1 228 . 3 1 1 A 25 25 GLU CB C 25 29.313 29.195 0.118 1
1 230 . 3 1 1 A 25 25 GLU N N 25 124.543 121.983 2.560 1
1 231 . 3 1 1 A 26 26 GLY H H 26 8.242 8.741 -0.499 1
1 232 . 3 1 1 A 26 26 GLY HA2 H 26 4.287 3.997 0.290 1
1 233 . 3 1 1 A 26 26 GLY HA3 H 26 3.407 3.999 -0.592 1
1 234 . 3 1 1 A 26 26 GLY C C 26 174.234 175.182 -0.948 1
1 235 . 3 1 1 A 26 26 GLY CA C 26 46.113 46.737 -0.624 1
1 236 . 3 1 1 A 26 26 GLY N N 26 115.394 113.844 1.550 1
1 237 . 3 1 1 A 27 27 ALA H H 27 7.432 8.466 -1.034 1
1 238 . 3 1 1 A 27 27 ALA HA H 27 4.402 4.272 0.130 1
1 242 . 3 1 1 A 27 27 ALA C C 27 178.138 178.238 -0.100 1
1 243 . 3 1 1 A 27 27 ALA CA C 27 52.273 52.902 -0.629 1
1 244 . 3 1 1 A 27 27 ALA CB C 27 20.214 19.534 0.680 1
1 245 . 3 1 1 A 27 27 ALA N N 27 122.323 122.587 -0.264 1
1 246 . 3 1 1 A 28 28 GLY H H 28 8.624 7.817 0.807 1
1 247 . 3 1 1 A 28 28 GLY HA2 H 28 4.134 4.081 0.053 1
1 248 . 3 1 1 A 28 28 GLY HA3 H 28 3.953 4.112 -0.159 1
1 249 . 3 1 1 A 28 28 GLY C C 28 174.069 175.008 -0.939 1
1 250 . 3 1 1 A 28 28 GLY CA C 28 44.546 44.465 0.081 1
1 251 . 3 1 1 A 28 28 GLY N N 28 107.593 105.413 2.180 1
1 252 . 3 1 1 A 29 29 LEU H H 29 7.934 8.554 -0.620 1
1 253 . 3 1 1 A 29 29 LEU HA H 29 4.059 4.453 -0.394 1
1 263 . 3 1 1 A 29 29 LEU C C 29 177.548 177.062 0.486 1
1 264 . 3 1 1 A 29 29 LEU CA C 29 56.298 55.774 0.524 1
1 265 . 3 1 1 A 29 29 LEU CB C 29 41.940 43.181 -1.241 1
1 269 . 3 1 1 A 29 29 LEU N N 29 115.495 121.276 -5.781 1
1 270 . 3 1 1 A 30 30 GLY H H 30 8.669 8.134 0.535 1
1 271 . 3 1 1 A 30 30 GLY HA2 H 30 4.264 4.063 0.201 1
1 272 . 3 1 1 A 30 30 GLY HA3 H 30 4.001 4.123 -0.122 1
1 273 . 3 1 1 A 30 30 GLY C C 30 175.296 173.164 2.132 1
1 274 . 3 1 1 A 30 30 GLY CA C 30 46.368 45.092 1.276 1
1 275 . 3 1 1 A 30 30 GLY N N 30 103.121 106.057 -2.936 1
1 276 . 3 1 1 A 31 31 PHE H H 31 7.044 7.489 -0.445 1
1 277 . 3 1 1 A 31 31 PHE HA H 31 4.541 4.451 0.090 1
1 285 . 3 1 1 A 31 31 PHE C C 31 171.141 172.876 -1.735 1
1 286 . 3 1 1 A 31 31 PHE CA C 31 55.704 55.139 0.565 1
1 287 . 3 1 1 A 31 31 PHE CB C 31 40.745 41.835 -1.090 1
1 293 . 3 1 1 A 31 31 PHE N N 31 115.404 115.323 0.081 1
1 294 . 3 1 1 A 32 32 SER H H 32 8.752 8.479 0.273 1
1 295 . 3 1 1 A 32 32 SER HA H 32 4.990 4.896 0.094 1
1 298 . 3 1 1 A 32 32 SER C C 32 175.049 172.957 2.092 1
1 299 . 3 1 1 A 32 32 SER CA C 32 55.001 56.953 -1.952 1
1 300 . 3 1 1 A 32 32 SER CB C 32 67.170 66.594 0.576 1
1 301 . 3 1 1 A 32 32 SER N N 32 113.639 115.723 -2.084 1
1 302 . 3 1 1 A 33 33 LEU H H 33 8.639 8.364 0.275 1
1 303 . 3 1 1 A 33 33 LEU HA H 33 5.573 5.020 0.553 1
1 313 . 3 1 1 A 33 33 LEU C C 33 175.827 175.294 0.533 1
1 314 . 3 1 1 A 33 33 LEU CA C 33 53.620 53.516 0.104 1
1 315 . 3 1 1 A 33 33 LEU CB C 33 45.399 43.860 1.539 1
1 319 . 3 1 1 A 33 33 LEU N N 33 118.936 123.262 -4.326 1
1 320 . 3 1 1 A 34 34 ALA H H 34 9.410 8.851 0.559 1
1 321 . 3 1 1 A 34 34 ALA HA H 34 4.749 4.730 0.019 1
1 325 . 3 1 1 A 34 34 ALA C C 34 176.231 176.652 -0.421 1
1 326 . 3 1 1 A 34 34 ALA CA C 34 50.425 51.013 -0.588 1
1 327 . 3 1 1 A 34 34 ALA CB C 34 22.518 22.737 -0.219 1
1 328 . 3 1 1 A 34 34 ALA N N 34 124.395 122.328 2.067 1
1 329 . 3 1 1 A 35 35 GLY H H 35 8.130 8.520 -0.390 1
1 330 . 3 1 1 A 35 35 GLY HA2 H 35 4.712 4.064 0.648 1
1 331 . 3 1 1 A 35 35 GLY HA3 H 35 3.955 4.108 -0.153 1
1 332 . 3 1 1 A 35 35 GLY C C 35 174.750 172.860 1.890 1
1 333 . 3 1 1 A 35 35 GLY CA C 35 44.494 44.843 -0.349 1
1 334 . 3 1 1 A 35 35 GLY N N 35 103.650 107.472 -3.822 1
1 335 . 3 1 1 A 36 36 GLY H H 36 8.217 8.550 -0.333 1
1 336 . 3 1 1 A 36 36 GLY HA2 H 36 4.494 4.218 0.276 1
1 337 . 3 1 1 A 36 36 GLY HA3 H 36 3.836 4.269 -0.433 1
1 338 . 3 1 1 A 36 36 GLY C C 36 174.410 174.403 0.007 1
1 339 . 3 1 1 A 36 36 GLY CA C 36 45.462 45.889 -0.427 1
1 340 . 3 1 1 A 36 36 GLY N N 36 122.114 107.730 14.384 1
1 341 . 3 1 1 A 37 37 ALA H H 37 8.963 8.875 0.088 1
1 342 . 3 1 1 A 37 37 ALA HA H 37 3.998 4.044 -0.046 1
1 346 . 3 1 1 A 37 37 ALA C C 37 176.935 179.110 -2.175 1
1 347 . 3 1 1 A 37 37 ALA CA C 37 55.308 54.756 0.552 1
1 348 . 3 1 1 A 37 37 ALA CB C 37 18.822 18.254 0.568 1
1 349 . 3 1 1 A 37 37 ALA N N 37 123.418 123.480 -0.062 1
1 350 . 3 1 1 A 38 38 ASP H H 38 10.586 8.203 2.383 1
1 351 . 3 1 1 A 38 38 ASP HA H 38 4.485 4.347 0.138 1
1 354 . 3 1 1 A 38 38 ASP C C 38 175.309 176.517 -1.208 1
1 355 . 3 1 1 A 38 38 ASP CA C 38 52.730 56.370 -3.640 1
1 356 . 3 1 1 A 38 38 ASP CB C 38 38.689 41.008 -2.319 1
1 357 . 3 1 1 A 38 38 ASP N N 38 111.480 118.012 -6.532 1
1 358 . 3 1 1 A 39 39 LEU H H 39 7.789 7.850 -0.061 1
1 359 . 3 1 1 A 39 39 LEU HA H 39 4.699 4.400 0.299 1
1 369 . 3 1 1 A 39 39 LEU C C 39 176.377 177.838 -1.461 1
1 370 . 3 1 1 A 39 39 LEU CA C 39 52.952 54.276 -1.324 1
1 371 . 3 1 1 A 39 39 LEU CB C 39 43.294 42.309 0.985 1
1 375 . 3 1 1 A 39 39 LEU N N 39 122.545 120.867 1.678 1
1 376 . 3 1 1 A 40 40 GLU H H 40 8.331 8.593 -0.262 1
1 377 . 3 1 1 A 40 40 GLU HA H 40 3.978 4.206 -0.228 1
1 382 . 3 1 1 A 40 40 GLU C C 40 176.887 176.891 -0.004 1
1 383 . 3 1 1 A 40 40 GLU CA C 40 59.066 58.980 0.086 1
1 384 . 3 1 1 A 40 40 GLU CB C 40 29.523 30.241 -0.718 1
1 386 . 3 1 1 A 40 40 GLU N N 40 118.036 119.947 -1.911 1
1 387 . 3 1 1 A 41 41 ASN H H 41 7.890 7.819 0.071 1
1 388 . 3 1 1 A 41 41 ASN HA H 41 4.820 4.958 -0.138 1
1 393 . 3 1 1 A 41 41 ASN CA C 41 52.316 52.149 0.167 1
1 394 . 3 1 1 A 41 41 ASN CB C 41 37.409 37.856 -0.447 1
1 395 . 3 1 1 A 41 41 ASN N N 41 115.196 118.371 -3.175 1
1 397 . 3 1 1 A 42 42 LYS H H 42 7.943 8.526 -0.583 1
1 398 . 3 1 1 A 42 42 LYS HA H 42 4.328 4.213 0.115 1
1 407 . 3 1 1 A 42 42 LYS C C 42 177.081 177.323 -0.242 1
1 408 . 3 1 1 A 42 42 LYS CA C 42 56.567 59.563 -2.996 1
1 409 . 3 1 1 A 42 42 LYS CB C 42 33.120 32.627 0.493 1
1 413 . 3 1 1 A 42 42 LYS N N 42 120.612 125.861 -5.249 1
1 414 . 3 1 1 A 43 43 VAL H H 43 7.456 7.649 -0.193 1
1 415 . 3 1 1 A 43 43 VAL HA H 43 4.059 4.304 -0.245 1
1 423 . 3 1 1 A 43 43 VAL CA C 43 61.330 61.484 -0.154 1
1 424 . 3 1 1 A 43 43 VAL CB C 43 32.819 32.318 0.501 1
1 427 . 3 1 1 A 43 43 VAL N N 43 118.284 118.638 -0.354 1
1 428 . 3 1 1 A 44 44 ILE H H 44 8.481 8.610 -0.129 1
1 429 . 3 1 1 A 44 44 ILE HA H 44 4.913 4.443 0.470 1
1 439 . 3 1 1 A 44 44 ILE C C 44 176.719 175.940 0.779 1
1 440 . 3 1 1 A 44 44 ILE CA C 44 59.946 62.103 -2.157 1
1 441 . 3 1 1 A 44 44 ILE CB C 44 35.784 38.103 -2.319 1
1 445 . 3 1 1 A 44 44 ILE N N 44 127.089 129.631 -2.542 1
1 446 . 3 1 1 A 45 45 THR H H 45 8.906 9.447 -0.541 1
1 447 . 3 1 1 A 45 45 THR HA H 45 5.400 4.971 0.429 1
1 452 . 3 1 1 A 45 45 THR CA C 45 58.528 59.483 -0.955 1
1 453 . 3 1 1 A 45 45 THR CB C 45 73.760 71.671 2.089 1
1 455 . 3 1 1 A 45 45 THR N N 45 116.832 117.470 -0.638 1
1 456 . 3 1 1 A 46 46 VAL H H 46 8.336 8.464 -0.128 1
1 457 . 3 1 1 A 46 46 VAL HA H 46 4.059 4.191 -0.132 1
1 465 . 3 1 1 A 46 46 VAL C C 46 176.648 176.537 0.111 1
1 466 . 3 1 1 A 46 46 VAL CA C 46 63.058 63.143 -0.085 1
1 467 . 3 1 1 A 46 46 VAL CB C 46 31.601 30.905 0.696 1
1 470 . 3 1 1 A 46 46 VAL N N 46 118.542 122.470 -3.928 1
1 471 . 3 1 1 A 47 47 HIS H H 47 9.382 8.638 0.744 1
1 472 . 3 1 1 A 47 47 HIS HA H 47 4.628 4.179 0.449 1
1 477 . 3 1 1 A 47 47 HIS C C 47 174.339 174.532 -0.193 1
1 478 . 3 1 1 A 47 47 HIS CA C 47 57.764 59.883 -2.119 1
1 479 . 3 1 1 A 47 47 HIS CB C 47 31.453 30.557 0.896 1
1 482 . 3 1 1 A 47 47 HIS N N 47 133.900 128.427 5.473 1
1 483 . 3 1 1 A 48 48 ARG H H 48 7.135 7.836 -0.701 1
1 484 . 3 1 1 A 48 48 ARG HA H 48 4.360 4.765 -0.405 1
1 491 . 3 1 1 A 48 48 ARG C C 48 173.877 174.464 -0.587 1
1 492 . 3 1 1 A 48 48 ARG CA C 48 54.385 55.134 -0.749 1
1 493 . 3 1 1 A 48 48 ARG CB C 48 33.996 34.508 -0.512 1
1 496 . 3 1 1 A 48 48 ARG N N 48 114.736 117.573 -2.837 1
1 497 . 3 1 1 A 49 49 VAL H H 49 8.690 8.911 -0.221 1
1 498 . 3 1 1 A 49 49 VAL HA H 49 4.015 4.415 -0.400 1
1 506 . 3 1 1 A 49 49 VAL C C 49 176.255 175.732 0.523 1
1 507 . 3 1 1 A 49 49 VAL CA C 49 61.882 61.551 0.331 1
1 508 . 3 1 1 A 49 49 VAL CB C 49 32.261 32.330 -0.069 1
1 511 . 3 1 1 A 49 49 VAL N N 49 122.844 122.215 0.629 1
1 512 . 3 1 1 A 50 50 PHE H H 50 7.866 8.455 -0.589 1
1 513 . 3 1 1 A 50 50 PHE HA H 50 4.866 4.512 0.354 1
1 521 . 3 1 1 A 50 50 PHE C C 50 174.847 176.333 -1.486 1
1 522 . 3 1 1 A 50 50 PHE CA C 50 54.596 57.511 -2.915 1
1 523 . 3 1 1 A 50 50 PHE CB C 50 36.558 39.149 -2.591 1
1 529 . 3 1 1 A 50 50 PHE N N 50 128.498 127.632 0.866 1
1 530 . 3 1 1 A 51 51 PRO HA H 51 4.386 4.552 -0.166 1
1 537 . 3 1 1 A 51 51 PRO C C 51 177.321 176.667 0.654 1
1 538 . 3 1 1 A 51 51 PRO CA C 51 64.381 64.520 -0.139 1
1 539 . 3 1 1 A 51 51 PRO CB C 51 31.773 32.221 -0.448 1
1 542 . 3 1 1 A 52 52 ASN H H 52 8.814 8.544 0.270 1
1 543 . 3 1 1 A 52 52 ASN HA H 52 4.496 5.003 -0.507 1
1 548 . 3 1 1 A 52 52 ASN C C 52 174.823 174.682 0.141 1
1 549 . 3 1 1 A 52 52 ASN CA C 52 54.719 52.224 2.495 1
1 550 . 3 1 1 A 52 52 ASN CB C 52 38.109 39.247 -1.138 1
1 551 . 3 1 1 A 52 52 ASN N N 52 116.145 116.238 -0.093 1
1 553 . 3 1 1 A 53 53 GLY H H 53 7.730 8.274 -0.544 1
1 554 . 3 1 1 A 53 53 GLY HA2 H 53 4.430 4.338 0.092 1
1 555 . 3 1 1 A 53 53 GLY HA3 H 53 4.089 4.350 -0.261 1
1 556 . 3 1 1 A 53 53 GLY C C 53 174.810 174.116 0.694 1
1 557 . 3 1 1 A 53 53 GLY CA C 53 44.987 45.770 -0.783 1
1 558 . 3 1 1 A 53 53 GLY N N 53 106.196 110.837 -4.641 1
1 559 . 3 1 1 A 54 54 LEU H H 54 8.764 9.171 -0.407 1
1 560 . 3 1 1 A 54 54 LEU HA H 54 4.041 4.239 -0.198 1
1 570 . 3 1 1 A 54 54 LEU C C 54 179.712 178.716 0.996 1
1 571 . 3 1 1 A 54 54 LEU CA C 54 58.310 57.635 0.675 1
1 572 . 3 1 1 A 54 54 LEU CB C 54 42.390 41.968 0.422 1
1 576 . 3 1 1 A 54 54 LEU N N 54 118.836 119.724 -0.888 1
1 577 . 3 1 1 A 55 55 ALA H H 55 7.593 8.494 -0.901 1
1 578 . 3 1 1 A 55 55 ALA HA H 55 4.275 3.859 0.416 1
1 582 . 3 1 1 A 55 55 ALA C C 55 181.307 179.813 1.494 1
1 583 . 3 1 1 A 55 55 ALA CA C 55 54.825 55.159 -0.334 1
1 584 . 3 1 1 A 55 55 ALA CB C 55 18.345 18.015 0.330 1
1 585 . 3 1 1 A 55 55 ALA N N 55 118.782 121.868 -3.086 1
1 586 . 3 1 1 A 56 56 SER H H 56 9.339 7.930 1.409 1
1 587 . 3 1 1 A 56 56 SER HA H 56 4.023 4.158 -0.135 1
1 589 . 3 1 1 A 56 56 SER C C 56 176.392 177.439 -1.047 1
1 590 . 3 1 1 A 56 56 SER CA C 56 60.984 61.315 -0.331 1
1 591 . 3 1 1 A 56 56 SER CB C 56 62.987 62.740 0.247 1
1 592 . 3 1 1 A 56 56 SER N N 56 117.631 113.429 4.202 1
1 593 . 3 1 1 A 57 57 GLN H H 57 7.942 7.679 0.263 1
1 594 . 3 1 1 A 57 57 GLN HA H 57 4.034 4.017 0.017 1
1 601 . 3 1 1 A 57 57 GLN C C 57 177.400 178.948 -1.548 1
1 602 . 3 1 1 A 57 57 GLN CA C 57 58.362 58.892 -0.530 1
1 603 . 3 1 1 A 57 57 GLN CB C 57 28.801 28.706 0.095 1
1 605 . 3 1 1 A 57 57 GLN N N 57 118.162 122.022 -3.860 1
1 607 . 3 1 1 A 58 58 GLU H H 58 7.683 8.751 -1.068 1
1 608 . 3 1 1 A 58 58 GLU HA H 58 4.163 4.088 0.075 1
1 613 . 3 1 1 A 58 58 GLU C C 58 179.248 177.218 2.030 1
1 614 . 3 1 1 A 58 58 GLU CA C 58 59.559 58.314 1.245 1
1 615 . 3 1 1 A 58 58 GLU CB C 58 29.317 29.505 -0.188 1
1 617 . 3 1 1 A 58 58 GLU N N 58 119.877 118.635 1.242 1
1 618 . 3 1 1 A 59 59 GLY H H 59 7.446 7.419 0.027 1
1 619 . 3 1 1 A 59 59 GLY HA2 H 59 4.100 3.941 0.159 1
1 620 . 3 1 1 A 59 59 GLY HA3 H 59 3.770 3.948 -0.178 1
1 621 . 3 1 1 A 59 59 GLY C C 59 175.432 175.093 0.339 1
1 622 . 3 1 1 A 59 59 GLY CA C 59 46.817 45.525 1.292 1
1 623 . 3 1 1 A 59 59 GLY N N 59 102.653 107.679 -5.026 1
1 624 . 3 1 1 A 60 60 THR H H 60 8.343 7.978 0.365 1
1 625 . 3 1 1 A 60 60 THR HA H 60 4.037 4.096 -0.059 1
1 630 . 3 1 1 A 60 60 THR C C 60 175.843 174.733 1.110 1
1 631 . 3 1 1 A 60 60 THR CA C 60 64.792 65.513 -0.721 1
1 632 . 3 1 1 A 60 60 THR CB C 60 69.325 69.318 0.007 1
1 634 . 3 1 1 A 60 60 THR N N 60 113.863 113.099 0.764 1
1 635 . 3 1 1 A 61 61 ILE H H 61 8.802 7.651 1.151 1
1 636 . 3 1 1 A 61 61 ILE HA H 61 3.631 4.083 -0.452 1
1 646 . 3 1 1 A 61 61 ILE C C 61 174.198 174.470 -0.272 1
1 647 . 3 1 1 A 61 61 ILE CA C 61 62.938 60.843 2.095 1
1 648 . 3 1 1 A 61 61 ILE CB C 61 37.225 36.136 1.089 1
1 652 . 3 1 1 A 61 61 ILE N N 61 126.153 119.417 6.736 1
1 653 . 3 1 1 A 62 62 GLN H H 62 7.124 9.313 -2.189 1
1 654 . 3 1 1 A 62 62 GLN HA H 62 4.500 4.619 -0.119 1
1 661 . 3 1 1 A 62 62 GLN C C 62 174.556 175.466 -0.910 1
1 662 . 3 1 1 A 62 62 GLN CA C 62 53.364 54.245 -0.881 1
1 663 . 3 1 1 A 62 62 GLN CB C 62 32.196 31.250 0.946 1
1 665 . 3 1 1 A 62 62 GLN N N 62 123.730 126.438 -2.708 1
1 667 . 3 1 1 A 63 63 LYS H H 63 8.399 8.518 -0.119 1
1 668 . 3 1 1 A 63 63 LYS HA H 63 3.464 4.242 -0.778 1
1 677 . 3 1 1 A 63 63 LYS CA C 63 57.905 57.023 0.882 1
1 678 . 3 1 1 A 63 63 LYS CB C 63 32.260 32.269 -0.009 1
1 682 . 3 1 1 A 63 63 LYS N N 63 121.381 125.781 -4.400 1
1 683 . 3 1 1 A 64 64 GLY H H 64 9.265 8.777 0.488 1
1 684 . 3 1 1 A 64 64 GLY HA2 H 64 4.415 4.020 0.395 1
1 685 . 3 1 1 A 64 64 GLY HA3 H 64 3.639 4.025 -0.386 1
1 686 . 3 1 1 A 64 64 GLY CA C 64 44.881 44.982 -0.101 1
1 687 . 3 1 1 A 64 64 GLY N N 64 113.750 113.460 0.290 1
1 688 . 3 1 1 A 65 65 ASN H H 65 7.594 8.414 -0.820 1
1 689 . 3 1 1 A 65 65 ASN HA H 65 4.798 4.781 0.017 1
1 694 . 3 1 1 A 65 65 ASN C C 65 175.042 173.792 1.250 1
1 695 . 3 1 1 A 65 65 ASN CA C 65 53.047 53.549 -0.502 1
1 696 . 3 1 1 A 65 65 ASN CB C 65 38.153 40.003 -1.850 1
1 697 . 3 1 1 A 65 65 ASN N N 65 117.999 119.955 -1.956 1
1 699 . 3 1 1 A 66 66 GLU H H 66 8.538 8.549 -0.011 1
1 700 . 3 1 1 A 66 66 GLU HA H 66 4.634 4.962 -0.328 1
1 705 . 3 1 1 A 66 66 GLU C C 66 176.620 174.929 1.691 1
1 706 . 3 1 1 A 66 66 GLU CA C 66 55.863 54.816 1.047 1
1 707 . 3 1 1 A 66 66 GLU CB C 66 30.899 32.490 -1.591 1
1 709 . 3 1 1 A 66 66 GLU N N 66 122.233 121.800 0.433 1
1 710 . 3 1 1 A 67 67 VAL H H 67 8.452 8.957 -0.505 1
1 711 . 3 1 1 A 67 67 VAL HA H 67 4.172 4.199 -0.027 1
1 719 . 3 1 1 A 67 67 VAL C C 67 174.641 175.458 -0.817 1
1 720 . 3 1 1 A 67 67 VAL CA C 67 61.856 62.827 -0.971 1
1 721 . 3 1 1 A 67 67 VAL CB C 67 31.066 31.753 -0.687 1
1 724 . 3 1 1 A 67 67 VAL N N 67 126.311 127.685 -1.374 1
1 725 . 3 1 1 A 68 68 LEU H H 68 9.000 8.854 0.146 1
1 726 . 3 1 1 A 68 68 LEU HA H 68 4.390 4.349 0.041 1
1 736 . 3 1 1 A 68 68 LEU C C 68 178.924 177.046 1.878 1
1 737 . 3 1 1 A 68 68 LEU CA C 68 56.990 56.106 0.884 1
1 738 . 3 1 1 A 68 68 LEU CB C 68 42.392 42.438 -0.046 1
1 742 . 3 1 1 A 68 68 LEU N N 68 127.175 129.003 -1.828 1
1 743 . 3 1 1 A 69 69 SER H H 69 7.666 7.828 -0.162 1
1 744 . 3 1 1 A 69 69 SER HA H 69 5.144 5.069 0.075 1
1 747 . 3 1 1 A 69 69 SER C C 69 172.722 172.314 0.408 1
1 748 . 3 1 1 A 69 69 SER CA C 69 57.606 57.471 0.135 1
1 749 . 3 1 1 A 69 69 SER CB C 69 64.511 65.686 -1.175 1
1 750 . 3 1 1 A 69 69 SER N N 69 110.346 109.186 1.160 1
1 751 . 3 1 1 A 70 70 ILE H H 70 7.965 8.375 -0.410 1
1 752 . 3 1 1 A 70 70 ILE HA H 70 4.548 4.939 -0.391 1
1 762 . 3 1 1 A 70 70 ILE C C 70 174.993 176.201 -1.208 1
1 763 . 3 1 1 A 70 70 ILE CA C 70 60.897 60.351 0.546 1
1 764 . 3 1 1 A 70 70 ILE CB C 70 41.186 40.398 0.788 1
1 768 . 3 1 1 A 70 70 ILE N N 70 119.579 121.595 -2.016 1
1 769 . 3 1 1 A 71 71 ASN H H 71 9.839 10.631 -0.792 1
1 770 . 3 1 1 A 71 71 ASN HA H 71 4.485 4.390 0.095 1
1 775 . 3 1 1 A 71 71 ASN C C 71 174.975 174.549 0.426 1
1 776 . 3 1 1 A 71 71 ASN CA C 71 54.085 54.148 -0.063 1
1 777 . 3 1 1 A 71 71 ASN CB C 71 36.255 37.346 -1.091 1
1 778 . 3 1 1 A 71 71 ASN N N 71 126.963 125.688 1.275 1
1 780 . 3 1 1 A 72 72 GLY H H 72 8.911 8.364 0.547 1
1 781 . 3 1 1 A 72 72 GLY HA2 H 72 4.149 3.933 0.216 1
1 782 . 3 1 1 A 72 72 GLY HA3 H 72 3.507 3.934 -0.427 1
1 783 . 3 1 1 A 72 72 GLY C C 72 173.594 174.204 -0.610 1
1 784 . 3 1 1 A 72 72 GLY CA C 72 45.162 45.081 0.081 1
1 785 . 3 1 1 A 72 72 GLY N N 72 103.020 105.166 -2.146 1
1 786 . 3 1 1 A 73 73 LYS H H 73 7.922 7.929 -0.007 1
1 787 . 3 1 1 A 73 73 LYS HA H 73 4.485 4.386 0.099 1
1 796 . 3 1 1 A 73 73 LYS C C 73 175.036 175.549 -0.513 1
1 797 . 3 1 1 A 73 73 LYS CA C 73 54.719 55.996 -1.277 1
1 798 . 3 1 1 A 73 73 LYS CB C 73 32.137 32.880 -0.743 1
1 802 . 3 1 1 A 73 73 LYS N N 73 122.413 122.777 -0.364 1
1 803 . 3 1 1 A 74 74 SER H H 74 8.585 8.851 -0.266 1
1 804 . 3 1 1 A 74 74 SER HA H 74 4.452 4.749 -0.297 1
1 807 . 3 1 1 A 74 74 SER C C 74 175.965 174.067 1.898 1
1 808 . 3 1 1 A 74 74 SER CA C 74 58.028 58.025 0.003 1
1 809 . 3 1 1 A 74 74 SER CB C 74 63.799 63.954 -0.155 1
1 810 . 3 1 1 A 74 74 SER N N 74 118.737 122.920 -4.183 1
1 811 . 3 1 1 A 75 75 LEU H H 75 8.015 8.397 -0.382 1
1 812 . 3 1 1 A 75 75 LEU HA H 75 4.661 4.429 0.232 1
1 822 . 3 1 1 A 75 75 LEU C C 75 178.117 177.323 0.794 1
1 823 . 3 1 1 A 75 75 LEU CA C 75 53.980 54.617 -0.637 1
1 824 . 3 1 1 A 75 75 LEU CB C 75 40.830 40.890 -0.060 1
1 828 . 3 1 1 A 75 75 LEU N N 75 125.425 127.040 -1.615 1
1 829 . 3 1 1 A 76 76 LYS H H 76 8.099 8.194 -0.095 1
1 830 . 3 1 1 A 76 76 LYS HA H 76 4.210 4.384 -0.174 1
1 839 . 3 1 1 A 76 76 LYS C C 76 178.487 176.752 1.735 1
1 840 . 3 1 1 A 76 76 LYS CA C 76 58.010 55.458 2.552 1
1 841 . 3 1 1 A 76 76 LYS CB C 76 31.683 31.605 0.078 1
1 845 . 3 1 1 A 76 76 LYS N N 76 124.064 120.876 3.188 1
1 846 . 3 1 1 A 77 77 GLY H H 77 8.859 7.847 1.012 1
1 847 . 3 1 1 A 77 77 GLY HA2 H 77 4.110 4.064 0.046 1
1 848 . 3 1 1 A 77 77 GLY HA3 H 77 3.869 4.065 -0.196 1
1 849 . 3 1 1 A 77 77 GLY C C 77 174.335 174.620 -0.285 1
1 850 . 3 1 1 A 77 77 GLY CA C 77 46.232 44.928 1.304 1
1 851 . 3 1 1 A 77 77 GLY N N 77 115.659 108.694 6.965 1
1 852 . 3 1 1 A 78 78 THR H H 78 7.654 7.751 -0.097 1
1 853 . 3 1 1 A 78 78 THR HA H 78 4.624 4.269 0.355 1
1 858 . 3 1 1 A 78 78 THR C C 78 177.272 174.880 2.392 1
1 859 . 3 1 1 A 78 78 THR CA C 78 61.794 62.901 -1.107 1
1 860 . 3 1 1 A 78 78 THR CB C 78 70.595 69.555 1.040 1
1 862 . 3 1 1 A 78 78 THR N N 78 112.847 116.892 -4.045 1
1 863 . 3 1 1 A 79 79 THR H H 79 8.813 8.678 0.135 1
1 864 . 3 1 1 A 79 79 THR HA H 79 4.395 4.725 -0.330 1
1 869 . 3 1 1 A 79 79 THR C C 79 174.503 175.572 -1.069 1
1 870 . 3 1 1 A 79 79 THR CA C 79 61.724 60.752 0.972 1
1 871 . 3 1 1 A 79 79 THR CB C 79 71.007 70.944 0.063 1
1 873 . 3 1 1 A 79 79 THR N N 79 114.123 117.342 -3.219 1
1 874 . 3 1 1 A 80 80 HIS H H 80 10.266 9.261 1.005 1
1 875 . 3 1 1 A 80 80 HIS HA H 80 4.331 4.300 0.031 1
1 880 . 3 1 1 A 80 80 HIS C C 80 177.075 176.924 0.151 1
1 881 . 3 1 1 A 80 80 HIS CA C 80 61.338 59.997 1.341 1
1 882 . 3 1 1 A 80 80 HIS CB C 80 28.651 30.444 -1.793 1
1 885 . 3 1 1 A 80 80 HIS N N 80 122.776 122.283 0.493 1
1 886 . 3 1 1 A 81 81 HIS H H 81 9.335 8.168 1.167 1
1 887 . 3 1 1 A 81 81 HIS HA H 81 4.078 4.231 -0.153 1
1 892 . 3 1 1 A 81 81 HIS C C 81 178.269 177.153 1.116 1
1 893 . 3 1 1 A 81 81 HIS CA C 81 60.210 59.953 0.257 1
1 894 . 3 1 1 A 81 81 HIS CB C 81 29.569 29.928 -0.359 1
1 897 . 3 1 1 A 81 81 HIS N N 81 114.733 118.926 -4.193 1
1 898 . 3 1 1 A 82 82 ASP H H 82 7.741 8.249 -0.508 1
1 899 . 3 1 1 A 82 82 ASP HA H 82 4.452 4.260 0.192 1
1 902 . 3 1 1 A 82 82 ASP C C 82 178.683 177.524 1.159 1
1 903 . 3 1 1 A 82 82 ASP CA C 82 57.148 56.686 0.462 1
1 904 . 3 1 1 A 82 82 ASP CB C 82 39.522 40.542 -1.020 1
1 905 . 3 1 1 A 82 82 ASP N N 82 121.407 118.198 3.209 1
1 906 . 3 1 1 A 83 83 ALA H H 83 8.502 8.267 0.235 1
1 907 . 3 1 1 A 83 83 ALA HA H 83 3.939 4.334 -0.395 1
1 911 . 3 1 1 A 83 83 ALA C C 83 179.361 179.415 -0.054 1
1 912 . 3 1 1 A 83 83 ALA CA C 83 55.635 53.104 2.531 1
1 913 . 3 1 1 A 83 83 ALA CB C 83 18.124 19.334 -1.210 1
1 914 . 3 1 1 A 83 83 ALA N N 83 125.049 121.877 3.172 1
1 915 . 3 1 1 A 84 84 LEU H H 84 8.100 8.678 -0.578 1
1 916 . 3 1 1 A 84 84 LEU HA H 84 3.792 4.105 -0.313 1
1 926 . 3 1 1 A 84 84 LEU C C 84 180.173 178.234 1.939 1
1 927 . 3 1 1 A 84 84 LEU CA C 84 57.932 57.442 0.490 1
1 928 . 3 1 1 A 84 84 LEU CB C 84 41.157 42.057 -0.900 1
1 932 . 3 1 1 A 84 84 LEU N N 84 117.139 120.652 -3.513 1
1 933 . 3 1 1 A 85 85 ALA H H 85 7.715 9.790 -2.075 1
1 934 . 3 1 1 A 85 85 ALA HA H 85 4.061 4.107 -0.046 1
1 938 . 3 1 1 A 85 85 ALA C C 85 180.380 179.788 0.592 1
1 939 . 3 1 1 A 85 85 ALA CA C 85 55.212 55.425 -0.213 1
1 940 . 3 1 1 A 85 85 ALA CB C 85 17.803 18.395 -0.592 1
1 941 . 3 1 1 A 85 85 ALA N N 85 122.448 120.837 1.611 1
1 942 . 3 1 1 A 86 86 ILE H H 86 7.669 8.126 -0.457 1
1 943 . 3 1 1 A 86 86 ILE HA H 86 3.678 3.736 -0.058 1
1 953 . 3 1 1 A 86 86 ILE C C 86 178.692 178.747 -0.055 1
1 954 . 3 1 1 A 86 86 ILE CA C 86 65.226 64.795 0.431 1
1 955 . 3 1 1 A 86 86 ILE CB C 86 38.099 37.773 0.326 1
1 959 . 3 1 1 A 86 86 ILE N N 86 121.804 117.937 3.867 1
1 960 . 3 1 1 A 87 87 LEU H H 87 7.922 8.226 -0.304 1
1 961 . 3 1 1 A 87 87 LEU HA H 87 3.903 4.025 -0.122 1
1 971 . 3 1 1 A 87 87 LEU C C 87 178.610 178.703 -0.093 1
1 972 . 3 1 1 A 87 87 LEU CA C 87 58.221 58.172 0.049 1
1 973 . 3 1 1 A 87 87 LEU CB C 87 42.344 41.531 0.813 1
1 977 . 3 1 1 A 87 87 LEU N N 87 121.947 121.498 0.449 1
1 978 . 3 1 1 A 88 88 ARG H H 88 8.317 8.117 0.200 1
1 979 . 3 1 1 A 88 88 ARG HA H 88 4.060 4.189 -0.129 1
1 986 . 3 1 1 A 88 88 ARG C C 88 180.698 177.117 3.581 1
1 987 . 3 1 1 A 88 88 ARG CA C 88 59.383 58.657 0.726 1
1 988 . 3 1 1 A 88 88 ARG CB C 88 30.055 30.018 0.037 1
1 991 . 3 1 1 A 88 88 ARG N N 88 119.343 119.502 -0.159 1
1 992 . 3 1 1 A 89 89 GLN H H 89 8.270 7.754 0.516 1
1 993 . 3 1 1 A 89 89 GLN HA H 89 4.122 4.336 -0.214 1
1 1000 . 3 1 1 A 89 89 GLN C C 89 177.955 178.099 -0.144 1
1 1001 . 3 1 1 A 89 89 GLN CA C 89 58.714 57.072 1.642 1
1 1002 . 3 1 1 A 89 89 GLN CB C 89 28.160 29.390 -1.230 1
1 1004 . 3 1 1 A 89 89 GLN N N 89 121.097 117.343 3.754 1
1 1006 . 3 1 1 A 90 90 ALA H H 90 7.558 7.880 -0.322 1
1 1007 . 3 1 1 A 90 90 ALA HA H 90 4.123 4.157 -0.034 1
1 1011 . 3 1 1 A 90 90 ALA C C 90 178.076 178.199 -0.123 1
1 1012 . 3 1 1 A 90 90 ALA CA C 90 52.942 54.031 -1.089 1
1 1013 . 3 1 1 A 90 90 ALA CB C 90 18.015 18.278 -0.263 1
1 1014 . 3 1 1 A 90 90 ALA N N 90 119.652 121.318 -1.666 1
1 1015 . 3 1 1 A 91 91 ARG H H 91 7.768 8.100 -0.332 1
1 1016 . 3 1 1 A 91 91 ARG HA H 91 4.065 4.281 -0.216 1
1 1022 . 3 1 1 A 91 91 ARG C C 91 177.858 177.775 0.083 1
1 1023 . 3 1 1 A 91 91 ARG CA C 91 58.573 57.425 1.148 1
1 1024 . 3 1 1 A 91 91 ARG CB C 91 30.384 30.829 -0.445 1
1 1027 . 3 1 1 A 91 91 ARG N N 91 118.081 116.838 1.243 1
1 1028 . 3 1 1 A 92 92 GLU H H 92 7.691 8.270 -0.579 1
1 1029 . 3 1 1 A 92 92 GLU HA H 92 4.123 4.134 -0.011 1
1 1034 . 3 1 1 A 92 92 GLU C C 92 174.459 176.718 -2.259 1
1 1035 . 3 1 1 A 92 92 GLU CA C 92 61.565 60.887 0.678 1
1 1036 . 3 1 1 A 92 92 GLU CB C 92 27.583 28.609 -1.026 1
1 1038 . 3 1 1 A 92 92 GLU N N 92 118.447 119.047 -0.600 1
1 1039 . 3 1 1 A 93 93 PRO HA H 93 4.716 4.555 0.161 1
1 1046 . 3 1 1 A 93 93 PRO C C 93 176.221 176.274 -0.053 1
1 1047 . 3 1 1 A 93 93 PRO CA C 93 63.149 62.325 0.824 1
1 1048 . 3 1 1 A 93 93 PRO CB C 93 32.571 33.234 -0.663 1
1 1051 . 3 1 1 A 94 94 ARG H H 94 8.434 8.885 -0.451 1
1 1052 . 3 1 1 A 94 94 ARG HA H 94 4.232 4.830 -0.598 1
1 1058 . 3 1 1 A 94 94 ARG C C 94 175.323 175.718 -0.395 1
1 1059 . 3 1 1 A 94 94 ARG CA C 94 56.972 56.269 0.703 1
1 1060 . 3 1 1 A 94 94 ARG CB C 94 30.448 31.460 -1.012 1
1 1063 . 3 1 1 A 94 94 ARG N N 94 115.987 118.684 -2.697 1
1 1064 . 3 1 1 A 95 95 GLN H H 95 7.246 7.594 -0.348 1
1 1065 . 3 1 1 A 95 95 GLN HA H 95 5.251 5.251 0.000 1
1 1072 . 3 1 1 A 95 95 GLN C C 95 174.786 173.593 1.193 1
1 1073 . 3 1 1 A 95 95 GLN CA C 95 54.209 54.509 -0.300 1
1 1074 . 3 1 1 A 95 95 GLN CB C 95 32.384 32.374 0.010 1
1 1076 . 3 1 1 A 95 95 GLN N N 95 115.998 119.713 -3.715 1
1 1078 . 3 1 1 A 96 96 ALA H H 96 8.739 8.251 0.488 1
1 1079 . 3 1 1 A 96 96 ALA HA H 96 5.412 5.088 0.324 1
1 1083 . 3 1 1 A 96 96 ALA C C 96 175.258 175.878 -0.620 1
1 1084 . 3 1 1 A 96 96 ALA CA C 96 50.355 50.931 -0.576 1
1 1085 . 3 1 1 A 96 96 ALA CB C 96 24.270 23.423 0.847 1
1 1086 . 3 1 1 A 96 96 ALA N N 96 126.197 124.220 1.977 1
1 1087 . 3 1 1 A 97 97 VAL H H 97 8.568 8.658 -0.090 1
1 1088 . 3 1 1 A 97 97 VAL HA H 97 4.804 4.634 0.170 1
1 1096 . 3 1 1 A 97 97 VAL C C 97 175.982 174.711 1.271 1
1 1097 . 3 1 1 A 97 97 VAL CA C 97 61.442 61.245 0.197 1
1 1098 . 3 1 1 A 97 97 VAL CB C 97 33.413 33.734 -0.321 1
1 1101 . 3 1 1 A 97 97 VAL N N 97 120.702 119.782 0.920 1
1 1102 . 3 1 1 A 98 98 ILE H H 98 9.753 8.656 1.097 1
1 1103 . 3 1 1 A 98 98 ILE HA H 98 4.826 4.965 -0.139 1
1 1113 . 3 1 1 A 98 98 ILE C C 98 174.292 174.657 -0.365 1
1 1114 . 3 1 1 A 98 98 ILE CA C 98 59.981 60.054 -0.073 1
1 1115 . 3 1 1 A 98 98 ILE CB C 98 40.608 40.358 0.250 1
1 1119 . 3 1 1 A 98 98 ILE N N 98 131.738 127.343 4.395 1
1 1120 . 3 1 1 A 99 99 VAL H H 99 8.493 8.603 -0.110 1
1 1121 . 3 1 1 A 99 99 VAL HA H 99 5.201 4.500 0.701 1
1 1129 . 3 1 1 A 99 99 VAL C C 99 176.557 175.468 1.089 1
1 1130 . 3 1 1 A 99 99 VAL CA C 99 61.495 61.728 -0.233 1
1 1131 . 3 1 1 A 99 99 VAL CB C 99 32.327 31.851 0.476 1
1 1134 . 3 1 1 A 99 99 VAL N N 99 129.537 129.138 0.399 1
1 1135 . 3 1 1 A 100 100 THR H H 100 9.050 9.117 -0.067 1
1 1136 . 3 1 1 A 100 100 THR HA H 100 5.606 5.295 0.311 1
1 1141 . 3 1 1 A 100 100 THR C C 100 172.815 172.990 -0.175 1
1 1142 . 3 1 1 A 100 100 THR CA C 100 59.049 59.340 -0.291 1
1 1143 . 3 1 1 A 100 100 THR CB C 100 73.966 72.373 1.593 1
1 1145 . 3 1 1 A 100 100 THR N N 100 117.469 117.518 -0.049 1
1 1146 . 3 1 1 A 101 101 ARG H H 101 8.773 8.869 -0.096 1
1 1147 . 3 1 1 A 101 101 ARG HA H 101 4.989 5.123 -0.134 1
1 1155 . 3 1 1 A 101 101 ARG C C 101 174.738 175.305 -0.567 1
1 1156 . 3 1 1 A 101 101 ARG CA C 101 54.825 54.416 0.409 1
1 1157 . 3 1 1 A 101 101 ARG CB C 101 34.636 33.755 0.881 1
1 1160 . 3 1 1 A 101 101 ARG N N 101 117.532 120.352 -2.820 1
1 1162 . 3 1 1 A 102 102 LYS H H 102 8.616 8.459 0.157 1
1 1163 . 3 1 1 A 102 102 LYS HA H 102 4.232 4.493 -0.261 1
1 1171 . 3 1 1 A 102 102 LYS C C 102 175.935 175.922 0.013 1
1 1172 . 3 1 1 A 102 102 LYS CA C 102 56.549 56.296 0.253 1
1 1173 . 3 1 1 A 102 102 LYS CB C 102 33.266 32.961 0.305 1
1 1177 . 3 1 1 A 102 102 LYS N N 102 126.899 122.079 4.820 1
1 1178 . 3 1 1 A 103 103 LEU H H 103 8.424 8.490 -0.066 1
1 1179 . 3 1 1 A 103 103 LEU HA H 103 4.540 4.668 -0.128 1
1 1189 . 3 1 1 A 103 103 LEU C C 103 176.956 176.120 0.836 1
1 1190 . 3 1 1 A 103 103 LEU CA C 103 54.755 54.045 0.710 1
1 1191 . 3 1 1 A 103 103 LEU CB C 103 42.929 42.383 0.546 1
1 1195 . 3 1 1 A 103 103 LEU N N 103 126.246 126.511 -0.265 1
1 1196 . 3 1 1 A 104 104 THR H H 104 8.201 8.216 -0.015 1
1 1197 . 3 1 1 A 104 104 THR HA H 104 4.624 4.372 0.252 1
1 1202 . 3 1 1 A 104 104 THR C C 104 172.954 174.178 -1.224 1
1 1203 . 3 1 1 A 104 104 THR CA C 104 59.483 60.802 -1.319 1
1 1204 . 3 1 1 A 104 104 THR CB C 104 69.761 68.875 0.886 1
1 1206 . 3 1 1 A 104 104 THR N N 104 117.263 115.072 2.191 1
1 1207 . 3 1 1 A 105 105 PRO HA H 105 4.399 4.577 -0.178 1
1 1213 . 3 1 1 A 105 105 PRO CA C 105 63.495 62.326 1.169 1
1 1214 . 3 1 1 A 105 105 PRO CB C 105 32.096 33.168 -1.072 1
1 1217 . 3 1 1 A 106 106 GLU H H 106 8.519 8.270 0.249 1
1 1218 . 3 1 1 A 106 106 GLU HA H 106 4.197 4.568 -0.371 1
1 1221 . 3 1 1 A 106 106 GLU C C 106 176.110 175.919 0.191 1
1 1222 . 3 1 1 A 106 106 GLU CA C 106 56.743 56.110 0.633 1
1 1223 . 3 1 1 A 106 106 GLU CB C 106 30.137 31.496 -1.359 1
1 1225 . 3 1 1 A 106 106 GLU N N 106 120.609 117.637 2.972 1
1 1226 . 3 1 1 A 107 107 ALA H H 107 8.241 7.957 0.284 1
1 1227 . 3 1 1 A 107 107 ALA HA H 107 4.317 4.112 0.205 1
1 1231 . 3 1 1 A 107 107 ALA C C 107 177.299 176.799 0.500 1
1 1232 . 3 1 1 A 107 107 ALA CA C 107 52.203 52.949 -0.746 1
1 1233 . 3 1 1 A 107 107 ALA CB C 107 19.392 18.107 1.285 1
1 1234 . 3 1 1 A 107 107 ALA N N 107 124.849 121.104 3.745 1
1 1235 . 3 1 1 A 108 108 MET H H 108 8.284 8.151 0.133 1
1 1236 . 3 1 1 A 108 108 MET HA H 108 4.792 4.926 -0.134 1
1 1244 . 3 1 1 A 108 108 MET C C 108 174.337 173.024 1.313 1
1 1245 . 3 1 1 A 108 108 MET CA C 108 53.258 53.707 -0.449 1
1 1246 . 3 1 1 A 108 108 MET CB C 108 32.608 34.853 -2.245 1
1 1249 . 3 1 1 A 108 108 MET N N 108 121.025 120.032 0.993 1
1 1250 . 3 1 1 A 109 109 PRO HA H 109 4.408 4.825 -0.417 1
1 1256 . 3 1 1 A 109 109 PRO C C 109 176.412 175.846 0.566 1
1 1257 . 3 1 1 A 109 109 PRO CA C 109 63.290 62.395 0.895 1
1 1258 . 3 1 1 A 109 109 PRO CB C 109 32.077 31.252 0.825 1
1 1261 . 3 1 1 A 110 110 ASP H H 110 8.417 8.552 -0.135 1
1 1262 . 3 1 1 A 110 110 ASP HA H 110 4.573 4.973 -0.400 1
1 1265 . 3 1 1 A 110 110 ASP C C 110 176.508 176.032 0.476 1
1 1266 . 3 1 1 A 110 110 ASP CA C 110 54.085 53.607 0.478 1
1 1267 . 3 1 1 A 110 110 ASP CB C 110 41.075 41.764 -0.689 1
1 1268 . 3 1 1 A 110 110 ASP N N 110 120.239 123.070 -2.831 1
1 1269 . 3 1 1 A 111 111 LEU H H 111 8.279 8.754 -0.475 1
1 1270 . 3 1 1 A 111 111 LEU HA H 111 4.319 4.439 -0.120 1
1 1280 . 3 1 1 A 111 111 LEU C C 111 177.551 176.636 0.915 1
1 1281 . 3 1 1 A 111 111 LEU CA C 111 55.581 54.484 1.097 1
1 1282 . 3 1 1 A 111 111 LEU CB C 111 42.360 42.867 -0.507 1
1 1286 . 3 1 1 A 111 111 LEU N N 111 123.318 126.577 -3.259 1
1 1287 . 3 1 1 A 112 112 ASN H H 112 8.487 8.774 -0.287 1
1 1288 . 3 1 1 A 112 112 ASN HA H 112 4.725 4.620 0.105 1
1 1293 . 3 1 1 A 112 112 ASN C C 112 175.454 174.735 0.719 1
1 1294 . 3 1 1 A 112 112 ASN CA C 112 53.610 55.656 -2.046 1
1 1295 . 3 1 1 A 112 112 ASN CB C 112 39.116 37.788 1.328 1
1 1296 . 3 1 1 A 112 112 ASN N N 112 118.752 118.664 0.088 1
1 1298 . 3 1 1 A 115 115 GLY H H 115 8.205 8.636 -0.431 1
1 1299 . 3 1 1 A 115 115 GLY HA2 H 115 4.126 4.244 -0.118 1
1 1300 . 3 1 1 A 115 115 GLY HA3 H 115 4.126 4.244 -0.118 1
1 1301 . 3 1 1 A 115 115 GLY CA C 115 44.727 45.628 -0.901 1
1 1302 . 3 1 1 A 116 116 PRO HA H 116 4.485 4.655 -0.170 1
1 1309 . 3 1 1 A 116 116 PRO CA C 116 63.298 62.445 0.853 1
1 1310 . 3 1 1 A 116 116 PRO CB C 116 32.077 33.342 -1.265 1
1 1313 . 3 1 1 A 117 117 SER H H 117 8.532 8.699 -0.167 1
1 1 . 4 1 1 A 7 7 GLY HA2 H 7 3.960 4.166 -0.206 1
1 2 . 4 1 1 A 7 7 GLY HA3 H 7 3.960 4.166 -0.206 1
1 3 . 4 1 1 A 7 7 GLY C C 7 174.009 173.845 0.164 1
1 4 . 4 1 1 A 7 7 GLY CA C 7 45.374 46.028 -0.654 1
1 5 . 4 1 1 A 8 8 ALA H H 8 8.163 7.832 0.331 1
1 6 . 4 1 1 A 8 8 ALA HA H 8 4.381 4.446 -0.065 1
1 10 . 4 1 1 A 8 8 ALA C C 8 178.078 176.114 1.964 1
1 11 . 4 1 1 A 8 8 ALA CA C 8 52.677 52.175 0.502 1
1 12 . 4 1 1 A 8 8 ALA CB C 8 19.368 20.198 -0.830 1
1 13 . 4 1 1 A 8 8 ALA N N 8 123.721 125.247 -1.526 1
1 14 . 4 1 1 A 9 9 THR H H 9 8.142 8.613 -0.471 1
1 15 . 4 1 1 A 9 9 THR HA H 9 4.353 5.119 -0.766 1
1 20 . 4 1 1 A 9 9 THR C C 9 174.597 173.852 0.745 1
1 21 . 4 1 1 A 9 9 THR CA C 9 62.093 61.712 0.381 1
1 22 . 4 1 1 A 9 9 THR CB C 9 69.948 70.930 -0.982 1
1 24 . 4 1 1 A 9 9 THR N N 9 113.761 114.842 -1.081 1
1 25 . 4 1 1 A 10 10 LEU H H 10 8.218 9.004 -0.786 1
1 26 . 4 1 1 A 10 10 LEU HA H 10 4.169 5.035 -0.866 1
1 36 . 4 1 1 A 10 10 LEU C C 10 176.110 175.456 0.654 1
1 37 . 4 1 1 A 10 10 LEU CA C 10 61.099 54.386 6.713 1
1 38 . 4 1 1 A 10 10 LEU CB C 10 38.686 44.831 -6.145 1
1 42 . 4 1 1 A 10 10 LEU N N 10 123.516 127.281 -3.765 1
1 43 . 4 1 1 A 11 11 LYS H H 11 8.496 9.070 -0.574 1
1 44 . 4 1 1 A 11 11 LYS HA H 11 4.891 5.042 -0.151 1
1 49 . 4 1 1 A 11 11 LYS C C 11 175.794 175.327 0.467 1
1 50 . 4 1 1 A 11 11 LYS CA C 11 55.652 55.104 0.548 1
1 51 . 4 1 1 A 11 11 LYS CB C 11 29.444 35.207 -5.763 1
1 52 . 4 1 1 A 11 11 LYS N N 11 125.141 124.432 0.709 1
1 53 . 4 1 1 A 12 12 GLN HA H 12 4.315 5.074 -0.759 1
1 54 . 4 1 1 A 12 12 GLN C C 12 176.300 175.150 1.150 1
1 55 . 4 1 1 A 12 12 GLN CA C 12 56.286 54.209 2.077 1
1 56 . 4 1 1 A 12 12 GLN CB C 12 32.901 32.208 0.693 1
1 57 . 4 1 1 A 13 13 LEU H H 13 8.410 8.457 -0.047 1
1 58 . 4 1 1 A 13 13 LEU HA H 13 4.348 4.445 -0.097 1
1 67 . 4 1 1 A 13 13 LEU C C 13 177.120 176.439 0.681 1
1 68 . 4 1 1 A 13 13 LEU CA C 13 55.142 54.492 0.650 1
1 69 . 4 1 1 A 13 13 LEU CB C 13 42.352 42.361 -0.009 1
1 73 . 4 1 1 A 13 13 LEU N N 13 124.340 123.570 0.770 1
1 74 . 4 1 1 A 14 14 ASP H H 14 8.250 8.809 -0.559 1
1 75 . 4 1 1 A 14 14 ASP HA H 14 4.540 4.877 -0.337 1
1 78 . 4 1 1 A 14 14 ASP C C 14 176.769 176.280 0.489 1
1 79 . 4 1 1 A 14 14 ASP CA C 14 54.772 52.709 2.063 1
1 80 . 4 1 1 A 14 14 ASP CB C 14 41.322 40.849 0.473 1
1 81 . 4 1 1 A 14 14 ASP N N 14 120.493 121.236 -0.743 1
1 82 . 4 1 1 A 15 15 GLY H H 15 8.428 8.678 -0.250 1
1 83 . 4 1 1 A 15 15 GLY HA2 H 15 4.089 3.906 0.183 1
1 84 . 4 1 1 A 15 15 GLY HA3 H 15 3.874 3.913 -0.039 1
1 85 . 4 1 1 A 15 15 GLY C C 15 174.122 174.486 -0.364 1
1 86 . 4 1 1 A 15 15 GLY CA C 15 45.972 46.962 -0.990 1
1 87 . 4 1 1 A 15 15 GLY N N 15 108.670 113.842 -5.172 1
1 88 . 4 1 1 A 16 16 ILE H H 16 7.727 7.551 0.176 1
1 89 . 4 1 1 A 16 16 ILE HA H 16 4.705 4.429 0.276 1
1 99 . 4 1 1 A 16 16 ILE C C 16 175.807 173.910 1.897 1
1 100 . 4 1 1 A 16 16 ILE CA C 16 60.703 60.280 0.423 1
1 101 . 4 1 1 A 16 16 ILE CB C 16 38.509 40.062 -1.553 1
1 105 . 4 1 1 A 16 16 ILE N N 16 120.267 120.251 0.016 1
1 106 . 4 1 1 A 17 17 HIS H H 17 9.101 8.660 0.441 1
1 107 . 4 1 1 A 17 17 HIS HA H 17 4.782 5.320 -0.538 1
1 112 . 4 1 1 A 17 17 HIS C C 17 173.051 173.089 -0.038 1
1 113 . 4 1 1 A 17 17 HIS CA C 17 55.353 53.276 2.077 1
1 114 . 4 1 1 A 17 17 HIS CB C 17 32.468 32.944 -0.476 1
1 117 . 4 1 1 A 17 17 HIS N N 17 125.061 127.600 -2.539 1
1 118 . 4 1 1 A 18 18 VAL H H 18 8.427 8.377 0.050 1
1 119 . 4 1 1 A 18 18 VAL HA H 18 4.375 4.177 0.198 1
1 127 . 4 1 1 A 18 18 VAL C C 18 174.702 174.822 -0.120 1
1 128 . 4 1 1 A 18 18 VAL CA C 18 62.035 61.818 0.217 1
1 129 . 4 1 1 A 18 18 VAL CB C 18 32.325 32.698 -0.373 1
1 132 . 4 1 1 A 18 18 VAL N N 18 127.069 127.371 -0.302 1
1 133 . 4 1 1 A 19 19 THR H H 19 9.272 8.140 1.132 1
1 134 . 4 1 1 A 19 19 THR HA H 19 4.512 4.895 -0.383 1
1 139 . 4 1 1 A 19 19 THR C C 19 172.784 173.210 -0.426 1
1 140 . 4 1 1 A 19 19 THR CA C 19 62.512 61.540 0.972 1
1 141 . 4 1 1 A 19 19 THR CB C 19 70.663 71.263 -0.600 1
1 143 . 4 1 1 A 19 19 THR N N 19 126.619 121.595 5.024 1
1 144 . 4 1 1 A 20 20 ILE H H 20 8.737 9.101 -0.364 1
1 145 . 4 1 1 A 20 20 ILE HA H 20 4.870 4.605 0.265 1
1 155 . 4 1 1 A 20 20 ILE C C 20 175.315 174.974 0.341 1
1 156 . 4 1 1 A 20 20 ILE CA C 20 60.157 60.077 0.080 1
1 157 . 4 1 1 A 20 20 ILE CB C 20 38.603 37.497 1.106 1
1 161 . 4 1 1 A 20 20 ILE N N 20 128.114 128.580 -0.466 1
1 162 . 4 1 1 A 21 21 LEU H H 21 8.902 8.982 -0.080 1
1 163 . 4 1 1 A 21 21 LEU HA H 21 4.804 4.951 -0.147 1
1 173 . 4 1 1 A 21 21 LEU C C 21 175.565 175.369 0.196 1
1 174 . 4 1 1 A 21 21 LEU CA C 21 52.731 53.442 -0.711 1
1 175 . 4 1 1 A 21 21 LEU CB C 21 43.947 42.620 1.327 1
1 179 . 4 1 1 A 21 21 LEU N N 21 125.457 128.947 -3.490 1
1 180 . 4 1 1 A 22 22 HIS H H 22 8.577 9.176 -0.599 1
1 181 . 4 1 1 A 22 22 HIS HA H 22 5.013 5.038 -0.025 1
1 186 . 4 1 1 A 22 22 HIS C C 22 174.258 175.102 -0.844 1
1 187 . 4 1 1 A 22 22 HIS CA C 22 55.880 54.768 1.112 1
1 188 . 4 1 1 A 22 22 HIS CB C 22 30.901 30.148 0.753 1
1 191 . 4 1 1 A 22 22 HIS N N 22 122.595 124.488 -1.893 1
1 192 . 4 1 1 A 23 23 LYS H H 23 8.712 9.602 -0.890 1
1 193 . 4 1 1 A 23 23 LYS HA H 23 4.880 4.957 -0.077 1
1 202 . 4 1 1 A 23 23 LYS C C 23 174.265 175.437 -1.172 1
1 203 . 4 1 1 A 23 23 LYS CA C 23 54.314 54.217 0.097 1
1 204 . 4 1 1 A 23 23 LYS CB C 23 36.068 36.048 0.020 1
1 208 . 4 1 1 A 23 23 LYS N N 23 120.814 120.925 -0.111 1
1 209 . 4 1 1 A 24 24 GLU H H 24 8.360 8.434 -0.074 1
1 210 . 4 1 1 A 24 24 GLU HA H 24 4.350 4.526 -0.176 1
1 215 . 4 1 1 A 24 24 GLU C C 24 177.843 176.822 1.021 1
1 216 . 4 1 1 A 24 24 GLU CA C 24 55.601 55.579 0.022 1
1 217 . 4 1 1 A 24 24 GLU CB C 24 30.512 30.980 -0.468 1
1 219 . 4 1 1 A 24 24 GLU N N 24 117.859 119.776 -1.917 1
1 220 . 4 1 1 A 25 25 GLU H H 25 9.146 8.828 0.318 1
1 221 . 4 1 1 A 25 25 GLU HA H 25 3.924 4.031 -0.107 1
1 226 . 4 1 1 A 25 25 GLU C C 25 177.809 177.624 0.185 1
1 227 . 4 1 1 A 25 25 GLU CA C 25 58.568 58.755 -0.187 1
1 228 . 4 1 1 A 25 25 GLU CB C 25 29.313 29.095 0.218 1
1 230 . 4 1 1 A 25 25 GLU N N 25 124.543 121.877 2.666 1
1 231 . 4 1 1 A 26 26 GLY H H 26 8.242 8.784 -0.542 1
1 232 . 4 1 1 A 26 26 GLY HA2 H 26 4.287 4.025 0.262 1
1 233 . 4 1 1 A 26 26 GLY HA3 H 26 3.407 4.027 -0.620 1
1 234 . 4 1 1 A 26 26 GLY C C 26 174.234 175.105 -0.871 1
1 235 . 4 1 1 A 26 26 GLY CA C 26 46.113 45.962 0.151 1
1 236 . 4 1 1 A 26 26 GLY N N 26 115.394 114.094 1.300 1
1 237 . 4 1 1 A 27 27 ALA H H 27 7.432 8.413 -0.981 1
1 238 . 4 1 1 A 27 27 ALA HA H 27 4.402 4.271 0.131 1
1 242 . 4 1 1 A 27 27 ALA C C 27 178.138 178.150 -0.012 1
1 243 . 4 1 1 A 27 27 ALA CA C 27 52.273 52.913 -0.640 1
1 244 . 4 1 1 A 27 27 ALA CB C 27 20.214 19.632 0.582 1
1 245 . 4 1 1 A 27 27 ALA N N 27 122.323 122.636 -0.313 1
1 246 . 4 1 1 A 28 28 GLY H H 28 8.624 7.817 0.807 1
1 247 . 4 1 1 A 28 28 GLY HA2 H 28 4.134 4.046 0.088 1
1 248 . 4 1 1 A 28 28 GLY HA3 H 28 3.953 4.082 -0.129 1
1 249 . 4 1 1 A 28 28 GLY C C 28 174.069 175.025 -0.956 1
1 250 . 4 1 1 A 28 28 GLY CA C 28 44.546 44.428 0.118 1
1 251 . 4 1 1 A 28 28 GLY N N 28 107.593 105.389 2.204 1
1 252 . 4 1 1 A 29 29 LEU H H 29 7.934 8.545 -0.611 1
1 253 . 4 1 1 A 29 29 LEU HA H 29 4.059 4.421 -0.362 1
1 263 . 4 1 1 A 29 29 LEU C C 29 177.548 176.999 0.549 1
1 264 . 4 1 1 A 29 29 LEU CA C 29 56.298 56.026 0.272 1
1 265 . 4 1 1 A 29 29 LEU CB C 29 41.940 42.763 -0.823 1
1 269 . 4 1 1 A 29 29 LEU N N 29 115.495 121.247 -5.752 1
1 270 . 4 1 1 A 30 30 GLY H H 30 8.669 8.016 0.653 1
1 271 . 4 1 1 A 30 30 GLY HA2 H 30 4.264 4.065 0.199 1
1 272 . 4 1 1 A 30 30 GLY HA3 H 30 4.001 4.144 -0.143 1
1 273 . 4 1 1 A 30 30 GLY C C 30 175.296 173.130 2.166 1
1 274 . 4 1 1 A 30 30 GLY CA C 30 46.368 45.046 1.322 1
1 275 . 4 1 1 A 30 30 GLY N N 30 103.121 106.038 -2.917 1
1 276 . 4 1 1 A 31 31 PHE H H 31 7.044 7.354 -0.310 1
1 277 . 4 1 1 A 31 31 PHE HA H 31 4.541 4.625 -0.084 1
1 285 . 4 1 1 A 31 31 PHE C C 31 171.141 172.983 -1.842 1
1 286 . 4 1 1 A 31 31 PHE CA C 31 55.704 55.162 0.542 1
1 287 . 4 1 1 A 31 31 PHE CB C 31 40.745 41.797 -1.052 1
1 293 . 4 1 1 A 31 31 PHE N N 31 115.404 115.511 -0.107 1
1 294 . 4 1 1 A 32 32 SER H H 32 8.752 9.169 -0.417 1
1 295 . 4 1 1 A 32 32 SER HA H 32 4.990 5.205 -0.215 1
1 298 . 4 1 1 A 32 32 SER C C 32 175.049 172.766 2.283 1
1 299 . 4 1 1 A 32 32 SER CA C 32 55.001 56.128 -1.127 1
1 300 . 4 1 1 A 32 32 SER CB C 32 67.170 66.542 0.628 1
1 301 . 4 1 1 A 32 32 SER N N 32 113.639 115.058 -1.419 1
1 302 . 4 1 1 A 33 33 LEU H H 33 8.639 8.334 0.305 1
1 303 . 4 1 1 A 33 33 LEU HA H 33 5.573 5.272 0.301 1
1 313 . 4 1 1 A 33 33 LEU C C 33 175.827 175.606 0.221 1
1 314 . 4 1 1 A 33 33 LEU CA C 33 53.620 53.619 0.001 1
1 315 . 4 1 1 A 33 33 LEU CB C 33 45.399 44.304 1.095 1
1 319 . 4 1 1 A 33 33 LEU N N 33 118.936 123.806 -4.870 1
1 320 . 4 1 1 A 34 34 ALA H H 34 9.410 8.907 0.503 1
1 321 . 4 1 1 A 34 34 ALA HA H 34 4.749 5.198 -0.449 1
1 325 . 4 1 1 A 34 34 ALA C C 34 176.231 176.590 -0.359 1
1 326 . 4 1 1 A 34 34 ALA CA C 34 50.425 51.474 -1.049 1
1 327 . 4 1 1 A 34 34 ALA CB C 34 22.518 23.127 -0.609 1
1 328 . 4 1 1 A 34 34 ALA N N 34 124.395 122.090 2.305 1
1 329 . 4 1 1 A 35 35 GLY H H 35 8.130 8.828 -0.698 1
1 330 . 4 1 1 A 35 35 GLY HA2 H 35 4.712 4.179 0.533 1
1 331 . 4 1 1 A 35 35 GLY HA3 H 35 3.955 4.198 -0.243 1
1 332 . 4 1 1 A 35 35 GLY C C 35 174.750 172.892 1.858 1
1 333 . 4 1 1 A 35 35 GLY CA C 35 44.494 44.698 -0.204 1
1 334 . 4 1 1 A 35 35 GLY N N 35 103.650 107.856 -4.206 1
1 335 . 4 1 1 A 36 36 GLY H H 36 8.217 8.806 -0.589 1
1 336 . 4 1 1 A 36 36 GLY HA2 H 36 4.494 4.294 0.200 1
1 337 . 4 1 1 A 36 36 GLY HA3 H 36 3.836 4.359 -0.523 1
1 338 . 4 1 1 A 36 36 GLY C C 36 174.410 174.148 0.262 1
1 339 . 4 1 1 A 36 36 GLY CA C 36 45.462 45.487 -0.025 1
1 340 . 4 1 1 A 36 36 GLY N N 36 122.114 108.016 14.098 1
1 341 . 4 1 1 A 37 37 ALA H H 37 8.963 8.684 0.279 1
1 342 . 4 1 1 A 37 37 ALA HA H 37 3.998 4.191 -0.193 1
1 346 . 4 1 1 A 37 37 ALA C C 37 176.935 179.004 -2.069 1
1 347 . 4 1 1 A 37 37 ALA CA C 37 55.308 53.882 1.426 1
1 348 . 4 1 1 A 37 37 ALA CB C 37 18.822 18.622 0.200 1
1 349 . 4 1 1 A 37 37 ALA N N 37 123.418 122.882 0.536 1
1 350 . 4 1 1 A 38 38 ASP H H 38 10.586 8.042 2.544 1
1 351 . 4 1 1 A 38 38 ASP HA H 38 4.485 4.389 0.096 1
1 354 . 4 1 1 A 38 38 ASP C C 38 175.309 176.221 -0.912 1
1 355 . 4 1 1 A 38 38 ASP CA C 38 52.730 56.355 -3.625 1
1 356 . 4 1 1 A 38 38 ASP CB C 38 38.689 41.081 -2.392 1
1 357 . 4 1 1 A 38 38 ASP N N 38 111.480 118.102 -6.622 1
1 358 . 4 1 1 A 39 39 LEU H H 39 7.789 7.773 0.016 1
1 359 . 4 1 1 A 39 39 LEU HA H 39 4.699 4.712 -0.013 1
1 369 . 4 1 1 A 39 39 LEU C C 39 176.377 176.964 -0.587 1
1 370 . 4 1 1 A 39 39 LEU CA C 39 52.952 53.633 -0.681 1
1 371 . 4 1 1 A 39 39 LEU CB C 39 43.294 43.038 0.256 1
1 375 . 4 1 1 A 39 39 LEU N N 39 122.545 118.080 4.465 1
1 376 . 4 1 1 A 40 40 GLU H H 40 8.331 8.504 -0.173 1
1 377 . 4 1 1 A 40 40 GLU HA H 40 3.978 4.391 -0.413 1
1 382 . 4 1 1 A 40 40 GLU C C 40 176.887 176.772 0.115 1
1 383 . 4 1 1 A 40 40 GLU CA C 40 59.066 57.345 1.721 1
1 384 . 4 1 1 A 40 40 GLU CB C 40 29.523 30.789 -1.266 1
1 386 . 4 1 1 A 40 40 GLU N N 40 118.036 120.126 -2.090 1
1 387 . 4 1 1 A 41 41 ASN H H 41 7.890 7.622 0.268 1
1 388 . 4 1 1 A 41 41 ASN HA H 41 4.820 4.977 -0.157 1
1 393 . 4 1 1 A 41 41 ASN CA C 41 52.316 51.792 0.524 1
1 394 . 4 1 1 A 41 41 ASN CB C 41 37.409 36.594 0.815 1
1 395 . 4 1 1 A 41 41 ASN N N 41 115.196 118.441 -3.245 1
1 397 . 4 1 1 A 42 42 LYS H H 42 7.943 7.989 -0.046 1
1 398 . 4 1 1 A 42 42 LYS HA H 42 4.328 4.092 0.236 1
1 407 . 4 1 1 A 42 42 LYS C C 42 177.081 177.249 -0.168 1
1 408 . 4 1 1 A 42 42 LYS CA C 42 56.567 59.546 -2.979 1
1 409 . 4 1 1 A 42 42 LYS CB C 42 33.120 32.415 0.705 1
1 413 . 4 1 1 A 42 42 LYS N N 42 120.612 125.607 -4.995 1
1 414 . 4 1 1 A 43 43 VAL H H 43 7.456 7.573 -0.117 1
1 415 . 4 1 1 A 43 43 VAL HA H 43 4.059 4.164 -0.105 1
1 423 . 4 1 1 A 43 43 VAL CA C 43 61.330 62.194 -0.864 1
1 424 . 4 1 1 A 43 43 VAL CB C 43 32.819 32.648 0.171 1
1 427 . 4 1 1 A 43 43 VAL N N 43 118.284 118.612 -0.328 1
1 428 . 4 1 1 A 44 44 ILE H H 44 8.481 8.519 -0.038 1
1 429 . 4 1 1 A 44 44 ILE HA H 44 4.913 4.781 0.132 1
1 439 . 4 1 1 A 44 44 ILE C C 44 176.719 175.925 0.794 1
1 440 . 4 1 1 A 44 44 ILE CA C 44 59.946 61.512 -1.566 1
1 441 . 4 1 1 A 44 44 ILE CB C 44 35.784 37.915 -2.131 1
1 445 . 4 1 1 A 44 44 ILE N N 44 127.089 128.299 -1.210 1
1 446 . 4 1 1 A 45 45 THR H H 45 8.906 10.040 -1.134 1
1 447 . 4 1 1 A 45 45 THR HA H 45 5.400 4.989 0.411 1
1 452 . 4 1 1 A 45 45 THR CA C 45 58.528 59.672 -1.144 1
1 453 . 4 1 1 A 45 45 THR CB C 45 73.760 71.834 1.926 1
1 455 . 4 1 1 A 45 45 THR N N 45 116.832 117.296 -0.464 1
1 456 . 4 1 1 A 46 46 VAL H H 46 8.336 8.668 -0.332 1
1 457 . 4 1 1 A 46 46 VAL HA H 46 4.059 4.262 -0.203 1
1 465 . 4 1 1 A 46 46 VAL C C 46 176.648 176.532 0.116 1
1 466 . 4 1 1 A 46 46 VAL CA C 46 63.058 63.039 0.019 1
1 467 . 4 1 1 A 46 46 VAL CB C 46 31.601 30.834 0.767 1
1 470 . 4 1 1 A 46 46 VAL N N 46 118.542 122.462 -3.920 1
1 471 . 4 1 1 A 47 47 HIS H H 47 9.382 8.717 0.665 1
1 472 . 4 1 1 A 47 47 HIS HA H 47 4.628 4.212 0.416 1
1 477 . 4 1 1 A 47 47 HIS C C 47 174.339 174.235 0.104 1
1 478 . 4 1 1 A 47 47 HIS CA C 47 57.764 59.953 -2.189 1
1 479 . 4 1 1 A 47 47 HIS CB C 47 31.453 30.613 0.840 1
1 482 . 4 1 1 A 47 47 HIS N N 47 133.900 128.236 5.664 1
1 483 . 4 1 1 A 48 48 ARG H H 48 7.135 7.857 -0.722 1
1 484 . 4 1 1 A 48 48 ARG HA H 48 4.360 4.816 -0.456 1
1 491 . 4 1 1 A 48 48 ARG C C 48 173.877 174.512 -0.635 1
1 492 . 4 1 1 A 48 48 ARG CA C 48 54.385 55.536 -1.151 1
1 493 . 4 1 1 A 48 48 ARG CB C 48 33.996 34.656 -0.660 1
1 496 . 4 1 1 A 48 48 ARG N N 48 114.736 117.842 -3.106 1
1 497 . 4 1 1 A 49 49 VAL H H 49 8.690 8.704 -0.014 1
1 498 . 4 1 1 A 49 49 VAL HA H 49 4.015 4.481 -0.466 1
1 506 . 4 1 1 A 49 49 VAL C C 49 176.255 175.566 0.689 1
1 507 . 4 1 1 A 49 49 VAL CA C 49 61.882 61.692 0.190 1
1 508 . 4 1 1 A 49 49 VAL CB C 49 32.261 33.432 -1.171 1
1 511 . 4 1 1 A 49 49 VAL N N 49 122.844 122.637 0.207 1
1 512 . 4 1 1 A 50 50 PHE H H 50 7.866 8.500 -0.634 1
1 513 . 4 1 1 A 50 50 PHE HA H 50 4.866 4.526 0.340 1
1 521 . 4 1 1 A 50 50 PHE C C 50 174.847 176.339 -1.492 1
1 522 . 4 1 1 A 50 50 PHE CA C 50 54.596 57.525 -2.929 1
1 523 . 4 1 1 A 50 50 PHE CB C 50 36.558 38.978 -2.420 1
1 529 . 4 1 1 A 50 50 PHE N N 50 128.498 127.560 0.938 1
1 530 . 4 1 1 A 51 51 PRO HA H 51 4.386 4.550 -0.164 1
1 537 . 4 1 1 A 51 51 PRO C C 51 177.321 176.630 0.691 1
1 538 . 4 1 1 A 51 51 PRO CA C 51 64.381 64.549 -0.168 1
1 539 . 4 1 1 A 51 51 PRO CB C 51 31.773 32.232 -0.459 1
1 542 . 4 1 1 A 52 52 ASN H H 52 8.814 8.533 0.281 1
1 543 . 4 1 1 A 52 52 ASN HA H 52 4.496 5.020 -0.524 1
1 548 . 4 1 1 A 52 52 ASN C C 52 174.823 174.666 0.157 1
1 549 . 4 1 1 A 52 52 ASN CA C 52 54.719 52.222 2.497 1
1 550 . 4 1 1 A 52 52 ASN CB C 52 38.109 39.062 -0.953 1
1 551 . 4 1 1 A 52 52 ASN N N 52 116.145 116.219 -0.074 1
1 553 . 4 1 1 A 53 53 GLY H H 53 7.730 8.332 -0.602 1
1 554 . 4 1 1 A 53 53 GLY HA2 H 53 4.430 4.367 0.063 1
1 555 . 4 1 1 A 53 53 GLY HA3 H 53 4.089 4.385 -0.296 1
1 556 . 4 1 1 A 53 53 GLY C C 53 174.810 174.270 0.540 1
1 557 . 4 1 1 A 53 53 GLY CA C 53 44.987 45.756 -0.769 1
1 558 . 4 1 1 A 53 53 GLY N N 53 106.196 111.023 -4.827 1
1 559 . 4 1 1 A 54 54 LEU H H 54 8.764 9.080 -0.316 1
1 560 . 4 1 1 A 54 54 LEU HA H 54 4.041 4.250 -0.209 1
1 570 . 4 1 1 A 54 54 LEU C C 54 179.712 178.832 0.880 1
1 571 . 4 1 1 A 54 54 LEU CA C 54 58.310 57.452 0.858 1
1 572 . 4 1 1 A 54 54 LEU CB C 54 42.390 42.002 0.388 1
1 576 . 4 1 1 A 54 54 LEU N N 54 118.836 119.744 -0.908 1
1 577 . 4 1 1 A 55 55 ALA H H 55 7.593 8.705 -1.112 1
1 578 . 4 1 1 A 55 55 ALA HA H 55 4.275 3.950 0.325 1
1 582 . 4 1 1 A 55 55 ALA C C 55 181.307 179.915 1.392 1
1 583 . 4 1 1 A 55 55 ALA CA C 55 54.825 55.572 -0.747 1
1 584 . 4 1 1 A 55 55 ALA CB C 55 18.345 18.737 -0.392 1
1 585 . 4 1 1 A 55 55 ALA N N 55 118.782 122.144 -3.362 1
1 586 . 4 1 1 A 56 56 SER H H 56 9.339 7.969 1.370 1
1 587 . 4 1 1 A 56 56 SER HA H 56 4.023 4.153 -0.130 1
1 589 . 4 1 1 A 56 56 SER C C 56 176.392 177.482 -1.090 1
1 590 . 4 1 1 A 56 56 SER CA C 56 60.984 61.435 -0.451 1
1 591 . 4 1 1 A 56 56 SER CB C 56 62.987 62.814 0.173 1
1 592 . 4 1 1 A 56 56 SER N N 56 117.631 113.236 4.395 1
1 593 . 4 1 1 A 57 57 GLN H H 57 7.942 7.922 0.020 1
1 594 . 4 1 1 A 57 57 GLN HA H 57 4.034 3.984 0.050 1
1 601 . 4 1 1 A 57 57 GLN C C 57 177.400 178.364 -0.964 1
1 602 . 4 1 1 A 57 57 GLN CA C 57 58.362 59.225 -0.863 1
1 603 . 4 1 1 A 57 57 GLN CB C 57 28.801 28.109 0.692 1
1 605 . 4 1 1 A 57 57 GLN N N 57 118.162 121.753 -3.591 1
1 607 . 4 1 1 A 58 58 GLU H H 58 7.683 8.461 -0.778 1
1 608 . 4 1 1 A 58 58 GLU HA H 58 4.163 4.091 0.072 1
1 613 . 4 1 1 A 58 58 GLU C C 58 179.248 176.819 2.429 1
1 614 . 4 1 1 A 58 58 GLU CA C 58 59.559 58.645 0.914 1
1 615 . 4 1 1 A 58 58 GLU CB C 58 29.317 29.623 -0.306 1
1 617 . 4 1 1 A 58 58 GLU N N 58 119.877 119.876 0.001 1
1 618 . 4 1 1 A 59 59 GLY H H 59 7.446 7.429 0.017 1
1 619 . 4 1 1 A 59 59 GLY HA2 H 59 4.100 3.920 0.180 1
1 620 . 4 1 1 A 59 59 GLY HA3 H 59 3.770 3.921 -0.151 1
1 621 . 4 1 1 A 59 59 GLY C C 59 175.432 174.933 0.499 1
1 622 . 4 1 1 A 59 59 GLY CA C 59 46.817 45.643 1.174 1
1 623 . 4 1 1 A 59 59 GLY N N 59 102.653 107.432 -4.779 1
1 624 . 4 1 1 A 60 60 THR H H 60 8.343 7.999 0.344 1
1 625 . 4 1 1 A 60 60 THR HA H 60 4.037 4.103 -0.066 1
1 630 . 4 1 1 A 60 60 THR C C 60 175.843 174.466 1.377 1
1 631 . 4 1 1 A 60 60 THR CA C 60 64.792 65.467 -0.675 1
1 632 . 4 1 1 A 60 60 THR CB C 60 69.325 69.358 -0.033 1
1 634 . 4 1 1 A 60 60 THR N N 60 113.863 113.157 0.706 1
1 635 . 4 1 1 A 61 61 ILE H H 61 8.802 7.596 1.206 1
1 636 . 4 1 1 A 61 61 ILE HA H 61 3.631 4.107 -0.476 1
1 646 . 4 1 1 A 61 61 ILE C C 61 174.198 174.393 -0.195 1
1 647 . 4 1 1 A 61 61 ILE CA C 61 62.938 60.737 2.201 1
1 648 . 4 1 1 A 61 61 ILE CB C 61 37.225 36.436 0.789 1
1 652 . 4 1 1 A 61 61 ILE N N 61 126.153 119.725 6.428 1
1 653 . 4 1 1 A 62 62 GLN H H 62 7.124 8.668 -1.544 1
1 654 . 4 1 1 A 62 62 GLN HA H 62 4.500 4.676 -0.176 1
1 661 . 4 1 1 A 62 62 GLN C C 62 174.556 175.484 -0.928 1
1 662 . 4 1 1 A 62 62 GLN CA C 62 53.364 54.226 -0.862 1
1 663 . 4 1 1 A 62 62 GLN CB C 62 32.196 31.501 0.695 1
1 665 . 4 1 1 A 62 62 GLN N N 62 123.730 126.671 -2.941 1
1 667 . 4 1 1 A 63 63 LYS H H 63 8.399 8.533 -0.134 1
1 668 . 4 1 1 A 63 63 LYS HA H 63 3.464 4.434 -0.970 1
1 677 . 4 1 1 A 63 63 LYS CA C 63 57.905 56.916 0.989 1
1 678 . 4 1 1 A 63 63 LYS CB C 63 32.260 32.226 0.034 1
1 682 . 4 1 1 A 63 63 LYS N N 63 121.381 124.332 -2.951 1
1 683 . 4 1 1 A 64 64 GLY H H 64 9.265 9.231 0.034 1
1 684 . 4 1 1 A 64 64 GLY HA2 H 64 4.415 3.997 0.418 1
1 685 . 4 1 1 A 64 64 GLY HA3 H 64 3.639 3.998 -0.359 1
1 686 . 4 1 1 A 64 64 GLY CA C 64 44.881 45.013 -0.132 1
1 687 . 4 1 1 A 64 64 GLY N N 64 113.750 112.890 0.860 1
1 688 . 4 1 1 A 65 65 ASN H H 65 7.594 8.403 -0.809 1
1 689 . 4 1 1 A 65 65 ASN HA H 65 4.798 4.766 0.032 1
1 694 . 4 1 1 A 65 65 ASN C C 65 175.042 173.694 1.348 1
1 695 . 4 1 1 A 65 65 ASN CA C 65 53.047 53.523 -0.476 1
1 696 . 4 1 1 A 65 65 ASN CB C 65 38.153 40.057 -1.904 1
1 697 . 4 1 1 A 65 65 ASN N N 65 117.999 120.159 -2.160 1
1 699 . 4 1 1 A 66 66 GLU H H 66 8.538 8.532 0.006 1
1 700 . 4 1 1 A 66 66 GLU HA H 66 4.634 4.853 -0.219 1
1 705 . 4 1 1 A 66 66 GLU C C 66 176.620 175.438 1.182 1
1 706 . 4 1 1 A 66 66 GLU CA C 66 55.863 55.377 0.486 1
1 707 . 4 1 1 A 66 66 GLU CB C 66 30.899 31.469 -0.570 1
1 709 . 4 1 1 A 66 66 GLU N N 66 122.233 121.212 1.021 1
1 710 . 4 1 1 A 67 67 VAL H H 67 8.452 8.803 -0.351 1
1 711 . 4 1 1 A 67 67 VAL HA H 67 4.172 4.286 -0.114 1
1 719 . 4 1 1 A 67 67 VAL C C 67 174.641 175.676 -1.035 1
1 720 . 4 1 1 A 67 67 VAL CA C 67 61.856 62.064 -0.208 1
1 721 . 4 1 1 A 67 67 VAL CB C 67 31.066 31.333 -0.267 1
1 724 . 4 1 1 A 67 67 VAL N N 67 126.311 127.316 -1.005 1
1 725 . 4 1 1 A 68 68 LEU H H 68 9.000 8.758 0.242 1
1 726 . 4 1 1 A 68 68 LEU HA H 68 4.390 4.038 0.352 1
1 736 . 4 1 1 A 68 68 LEU C C 68 178.924 176.840 2.084 1
1 737 . 4 1 1 A 68 68 LEU CA C 68 56.990 57.042 -0.052 1
1 738 . 4 1 1 A 68 68 LEU CB C 68 42.392 42.242 0.150 1
1 742 . 4 1 1 A 68 68 LEU N N 68 127.175 130.111 -2.936 1
1 743 . 4 1 1 A 69 69 SER H H 69 7.666 7.767 -0.101 1
1 744 . 4 1 1 A 69 69 SER HA H 69 5.144 4.982 0.162 1
1 747 . 4 1 1 A 69 69 SER C C 69 172.722 172.356 0.366 1
1 748 . 4 1 1 A 69 69 SER CA C 69 57.606 57.278 0.328 1
1 749 . 4 1 1 A 69 69 SER CB C 69 64.511 66.453 -1.942 1
1 750 . 4 1 1 A 69 69 SER N N 69 110.346 108.924 1.422 1
1 751 . 4 1 1 A 70 70 ILE H H 70 7.965 8.480 -0.515 1
1 752 . 4 1 1 A 70 70 ILE HA H 70 4.548 4.739 -0.191 1
1 762 . 4 1 1 A 70 70 ILE C C 70 174.993 176.193 -1.200 1
1 763 . 4 1 1 A 70 70 ILE CA C 70 60.897 60.288 0.609 1
1 764 . 4 1 1 A 70 70 ILE CB C 70 41.186 40.513 0.673 1
1 768 . 4 1 1 A 70 70 ILE N N 70 119.579 120.667 -1.088 1
1 769 . 4 1 1 A 71 71 ASN H H 71 9.839 10.548 -0.709 1
1 770 . 4 1 1 A 71 71 ASN HA H 71 4.485 4.409 0.076 1
1 775 . 4 1 1 A 71 71 ASN C C 71 174.975 174.736 0.239 1
1 776 . 4 1 1 A 71 71 ASN CA C 71 54.085 54.360 -0.275 1
1 777 . 4 1 1 A 71 71 ASN CB C 71 36.255 37.507 -1.252 1
1 778 . 4 1 1 A 71 71 ASN N N 71 126.963 124.725 2.238 1
1 780 . 4 1 1 A 72 72 GLY H H 72 8.911 8.425 0.486 1
1 781 . 4 1 1 A 72 72 GLY HA2 H 72 4.149 3.901 0.248 1
1 782 . 4 1 1 A 72 72 GLY HA3 H 72 3.507 3.901 -0.394 1
1 783 . 4 1 1 A 72 72 GLY C C 72 173.594 173.500 0.094 1
1 784 . 4 1 1 A 72 72 GLY CA C 72 45.162 45.415 -0.253 1
1 785 . 4 1 1 A 72 72 GLY N N 72 103.020 105.277 -2.257 1
1 786 . 4 1 1 A 73 73 LYS H H 73 7.922 7.440 0.482 1
1 787 . 4 1 1 A 73 73 LYS HA H 73 4.485 4.629 -0.144 1
1 796 . 4 1 1 A 73 73 LYS C C 73 175.036 175.606 -0.570 1
1 797 . 4 1 1 A 73 73 LYS CA C 73 54.719 54.836 -0.117 1
1 798 . 4 1 1 A 73 73 LYS CB C 73 32.137 34.437 -2.300 1
1 802 . 4 1 1 A 73 73 LYS N N 73 122.413 122.298 0.115 1
1 803 . 4 1 1 A 74 74 SER H H 74 8.585 8.903 -0.318 1
1 804 . 4 1 1 A 74 74 SER HA H 74 4.452 4.595 -0.143 1
1 807 . 4 1 1 A 74 74 SER C C 74 175.965 173.995 1.970 1
1 808 . 4 1 1 A 74 74 SER CA C 74 58.028 57.857 0.171 1
1 809 . 4 1 1 A 74 74 SER CB C 74 63.799 64.296 -0.497 1
1 810 . 4 1 1 A 74 74 SER N N 74 118.737 123.674 -4.937 1
1 811 . 4 1 1 A 75 75 LEU H H 75 8.015 8.205 -0.190 1
1 812 . 4 1 1 A 75 75 LEU HA H 75 4.661 4.481 0.180 1
1 822 . 4 1 1 A 75 75 LEU C C 75 178.117 177.628 0.489 1
1 823 . 4 1 1 A 75 75 LEU CA C 75 53.980 54.348 -0.368 1
1 824 . 4 1 1 A 75 75 LEU CB C 75 40.830 41.337 -0.507 1
1 828 . 4 1 1 A 75 75 LEU N N 75 125.425 125.213 0.212 1
1 829 . 4 1 1 A 76 76 LYS H H 76 8.099 8.618 -0.519 1
1 830 . 4 1 1 A 76 76 LYS HA H 76 4.210 4.413 -0.203 1
1 839 . 4 1 1 A 76 76 LYS C C 76 178.487 176.766 1.721 1
1 840 . 4 1 1 A 76 76 LYS CA C 76 58.010 55.454 2.556 1
1 841 . 4 1 1 A 76 76 LYS CB C 76 31.683 31.698 -0.015 1
1 845 . 4 1 1 A 76 76 LYS N N 76 124.064 120.011 4.053 1
1 846 . 4 1 1 A 77 77 GLY H H 77 8.859 7.844 1.015 1
1 847 . 4 1 1 A 77 77 GLY HA2 H 77 4.110 4.053 0.057 1
1 848 . 4 1 1 A 77 77 GLY HA3 H 77 3.869 4.057 -0.188 1
1 849 . 4 1 1 A 77 77 GLY C C 77 174.335 174.965 -0.630 1
1 850 . 4 1 1 A 77 77 GLY CA C 77 46.232 45.022 1.210 1
1 851 . 4 1 1 A 77 77 GLY N N 77 115.659 108.730 6.929 1
1 852 . 4 1 1 A 78 78 THR H H 78 7.654 7.869 -0.215 1
1 853 . 4 1 1 A 78 78 THR HA H 78 4.624 4.181 0.443 1
1 858 . 4 1 1 A 78 78 THR C C 78 177.272 174.816 2.456 1
1 859 . 4 1 1 A 78 78 THR CA C 78 61.794 63.099 -1.305 1
1 860 . 4 1 1 A 78 78 THR CB C 78 70.595 69.107 1.488 1
1 862 . 4 1 1 A 78 78 THR N N 78 112.847 116.207 -3.360 1
1 863 . 4 1 1 A 79 79 THR H H 79 8.813 8.649 0.164 1
1 864 . 4 1 1 A 79 79 THR HA H 79 4.395 4.696 -0.301 1
1 869 . 4 1 1 A 79 79 THR C C 79 174.503 175.522 -1.019 1
1 870 . 4 1 1 A 79 79 THR CA C 79 61.724 60.952 0.772 1
1 871 . 4 1 1 A 79 79 THR CB C 79 71.007 71.199 -0.192 1
1 873 . 4 1 1 A 79 79 THR N N 79 114.123 117.969 -3.846 1
1 874 . 4 1 1 A 80 80 HIS H H 80 10.266 9.216 1.050 1
1 875 . 4 1 1 A 80 80 HIS HA H 80 4.331 4.221 0.110 1
1 880 . 4 1 1 A 80 80 HIS C C 80 177.075 176.836 0.239 1
1 881 . 4 1 1 A 80 80 HIS CA C 80 61.338 60.051 1.287 1
1 882 . 4 1 1 A 80 80 HIS CB C 80 28.651 30.610 -1.959 1
1 885 . 4 1 1 A 80 80 HIS N N 80 122.776 122.122 0.654 1
1 886 . 4 1 1 A 81 81 HIS H H 81 9.335 8.214 1.121 1
1 887 . 4 1 1 A 81 81 HIS HA H 81 4.078 4.101 -0.023 1
1 892 . 4 1 1 A 81 81 HIS C C 81 178.269 176.571 1.698 1
1 893 . 4 1 1 A 81 81 HIS CA C 81 60.210 59.873 0.337 1
1 894 . 4 1 1 A 81 81 HIS CB C 81 29.569 29.885 -0.316 1
1 897 . 4 1 1 A 81 81 HIS N N 81 114.733 118.844 -4.111 1
1 898 . 4 1 1 A 82 82 ASP H H 82 7.741 8.153 -0.412 1
1 899 . 4 1 1 A 82 82 ASP HA H 82 4.452 4.224 0.228 1
1 902 . 4 1 1 A 82 82 ASP C C 82 178.683 178.889 -0.206 1
1 903 . 4 1 1 A 82 82 ASP CA C 82 57.148 57.443 -0.295 1
1 904 . 4 1 1 A 82 82 ASP CB C 82 39.522 40.347 -0.825 1
1 905 . 4 1 1 A 82 82 ASP N N 82 121.407 118.204 3.203 1
1 906 . 4 1 1 A 83 83 ALA H H 83 8.502 7.862 0.640 1
1 907 . 4 1 1 A 83 83 ALA HA H 83 3.939 4.111 -0.172 1
1 911 . 4 1 1 A 83 83 ALA C C 83 179.361 179.391 -0.030 1
1 912 . 4 1 1 A 83 83 ALA CA C 83 55.635 55.106 0.529 1
1 913 . 4 1 1 A 83 83 ALA CB C 83 18.124 19.003 -0.879 1
1 914 . 4 1 1 A 83 83 ALA N N 83 125.049 122.737 2.312 1
1 915 . 4 1 1 A 84 84 LEU H H 84 8.100 8.354 -0.254 1
1 916 . 4 1 1 A 84 84 LEU HA H 84 3.792 3.814 -0.022 1
1 926 . 4 1 1 A 84 84 LEU C C 84 180.173 179.236 0.937 1
1 927 . 4 1 1 A 84 84 LEU CA C 84 57.932 57.996 -0.064 1
1 928 . 4 1 1 A 84 84 LEU CB C 84 41.157 41.253 -0.096 1
1 932 . 4 1 1 A 84 84 LEU N N 84 117.139 117.867 -0.728 1
1 933 . 4 1 1 A 85 85 ALA H H 85 7.715 8.736 -1.021 1
1 934 . 4 1 1 A 85 85 ALA HA H 85 4.061 4.122 -0.061 1
1 938 . 4 1 1 A 85 85 ALA C C 85 180.380 179.774 0.606 1
1 939 . 4 1 1 A 85 85 ALA CA C 85 55.212 55.415 -0.203 1
1 940 . 4 1 1 A 85 85 ALA CB C 85 17.803 18.688 -0.885 1
1 941 . 4 1 1 A 85 85 ALA N N 85 122.448 121.797 0.651 1
1 942 . 4 1 1 A 86 86 ILE H H 86 7.669 7.832 -0.163 1
1 943 . 4 1 1 A 86 86 ILE HA H 86 3.678 3.708 -0.030 1
1 953 . 4 1 1 A 86 86 ILE C C 86 178.692 178.124 0.568 1
1 954 . 4 1 1 A 86 86 ILE CA C 86 65.226 65.224 0.002 1
1 955 . 4 1 1 A 86 86 ILE CB C 86 38.099 37.893 0.206 1
1 959 . 4 1 1 A 86 86 ILE N N 86 121.804 117.924 3.880 1
1 960 . 4 1 1 A 87 87 LEU H H 87 7.922 8.332 -0.410 1
1 961 . 4 1 1 A 87 87 LEU HA H 87 3.903 3.900 0.003 1
1 971 . 4 1 1 A 87 87 LEU C C 87 178.610 178.760 -0.150 1
1 972 . 4 1 1 A 87 87 LEU CA C 87 58.221 58.007 0.214 1
1 973 . 4 1 1 A 87 87 LEU CB C 87 42.344 41.557 0.787 1
1 977 . 4 1 1 A 87 87 LEU N N 87 121.947 120.930 1.017 1
1 978 . 4 1 1 A 88 88 ARG H H 88 8.317 8.908 -0.591 1
1 979 . 4 1 1 A 88 88 ARG HA H 88 4.060 4.074 -0.014 1
1 986 . 4 1 1 A 88 88 ARG C C 88 180.698 177.717 2.981 1
1 987 . 4 1 1 A 88 88 ARG CA C 88 59.383 57.980 1.403 1
1 988 . 4 1 1 A 88 88 ARG CB C 88 30.055 29.910 0.145 1
1 991 . 4 1 1 A 88 88 ARG N N 88 119.343 118.277 1.066 1
1 992 . 4 1 1 A 89 89 GLN H H 89 8.270 8.112 0.158 1
1 993 . 4 1 1 A 89 89 GLN HA H 89 4.122 4.090 0.032 1
1 1000 . 4 1 1 A 89 89 GLN C C 89 177.955 178.144 -0.189 1
1 1001 . 4 1 1 A 89 89 GLN CA C 89 58.714 58.230 0.484 1
1 1002 . 4 1 1 A 89 89 GLN CB C 89 28.160 27.890 0.270 1
1 1004 . 4 1 1 A 89 89 GLN N N 89 121.097 117.567 3.530 1
1 1006 . 4 1 1 A 90 90 ALA H H 90 7.558 8.055 -0.497 1
1 1007 . 4 1 1 A 90 90 ALA HA H 90 4.123 4.161 -0.038 1
1 1011 . 4 1 1 A 90 90 ALA C C 90 178.076 178.079 -0.003 1
1 1012 . 4 1 1 A 90 90 ALA CA C 90 52.942 53.754 -0.812 1
1 1013 . 4 1 1 A 90 90 ALA CB C 90 18.015 18.319 -0.304 1
1 1014 . 4 1 1 A 90 90 ALA N N 90 119.652 121.748 -2.096 1
1 1015 . 4 1 1 A 91 91 ARG H H 91 7.768 8.133 -0.365 1
1 1016 . 4 1 1 A 91 91 ARG HA H 91 4.065 4.277 -0.212 1
1 1022 . 4 1 1 A 91 91 ARG C C 91 177.858 177.554 0.304 1
1 1023 . 4 1 1 A 91 91 ARG CA C 91 58.573 57.389 1.184 1
1 1024 . 4 1 1 A 91 91 ARG CB C 91 30.384 30.691 -0.307 1
1 1027 . 4 1 1 A 91 91 ARG N N 91 118.081 117.605 0.476 1
1 1028 . 4 1 1 A 92 92 GLU H H 92 7.691 7.894 -0.203 1
1 1029 . 4 1 1 A 92 92 GLU HA H 92 4.123 4.199 -0.076 1
1 1034 . 4 1 1 A 92 92 GLU C C 92 174.459 176.563 -2.104 1
1 1035 . 4 1 1 A 92 92 GLU CA C 92 61.565 60.704 0.861 1
1 1036 . 4 1 1 A 92 92 GLU CB C 92 27.583 29.091 -1.508 1
1 1038 . 4 1 1 A 92 92 GLU N N 92 118.447 118.283 0.164 1
1 1039 . 4 1 1 A 93 93 PRO HA H 93 4.716 4.533 0.183 1
1 1046 . 4 1 1 A 93 93 PRO C C 93 176.221 176.360 -0.139 1
1 1047 . 4 1 1 A 93 93 PRO CA C 93 63.149 62.484 0.665 1
1 1048 . 4 1 1 A 93 93 PRO CB C 93 32.571 33.130 -0.559 1
1 1051 . 4 1 1 A 94 94 ARG H H 94 8.434 8.994 -0.560 1
1 1052 . 4 1 1 A 94 94 ARG HA H 94 4.232 4.695 -0.463 1
1 1058 . 4 1 1 A 94 94 ARG C C 94 175.323 176.078 -0.755 1
1 1059 . 4 1 1 A 94 94 ARG CA C 94 56.972 56.609 0.363 1
1 1060 . 4 1 1 A 94 94 ARG CB C 94 30.448 31.144 -0.696 1
1 1063 . 4 1 1 A 94 94 ARG N N 94 115.987 118.854 -2.867 1
1 1064 . 4 1 1 A 95 95 GLN H H 95 7.246 7.554 -0.308 1
1 1065 . 4 1 1 A 95 95 GLN HA H 95 5.251 5.246 0.005 1
1 1072 . 4 1 1 A 95 95 GLN C C 95 174.786 173.618 1.168 1
1 1073 . 4 1 1 A 95 95 GLN CA C 95 54.209 54.394 -0.185 1
1 1074 . 4 1 1 A 95 95 GLN CB C 95 32.384 32.323 0.061 1
1 1076 . 4 1 1 A 95 95 GLN N N 95 115.998 120.242 -4.244 1
1 1078 . 4 1 1 A 96 96 ALA H H 96 8.739 8.354 0.385 1
1 1079 . 4 1 1 A 96 96 ALA HA H 96 5.412 5.070 0.342 1
1 1083 . 4 1 1 A 96 96 ALA C C 96 175.258 175.887 -0.629 1
1 1084 . 4 1 1 A 96 96 ALA CA C 96 50.355 50.946 -0.591 1
1 1085 . 4 1 1 A 96 96 ALA CB C 96 24.270 22.817 1.453 1
1 1086 . 4 1 1 A 96 96 ALA N N 96 126.197 126.185 0.012 1
1 1087 . 4 1 1 A 97 97 VAL H H 97 8.568 8.750 -0.182 1
1 1088 . 4 1 1 A 97 97 VAL HA H 97 4.804 4.699 0.105 1
1 1096 . 4 1 1 A 97 97 VAL C C 97 175.982 174.682 1.300 1
1 1097 . 4 1 1 A 97 97 VAL CA C 97 61.442 61.292 0.150 1
1 1098 . 4 1 1 A 97 97 VAL CB C 97 33.413 33.392 0.021 1
1 1101 . 4 1 1 A 97 97 VAL N N 97 120.702 122.198 -1.496 1
1 1102 . 4 1 1 A 98 98 ILE H H 98 9.753 9.048 0.705 1
1 1103 . 4 1 1 A 98 98 ILE HA H 98 4.826 4.946 -0.120 1
1 1113 . 4 1 1 A 98 98 ILE C C 98 174.292 174.549 -0.257 1
1 1114 . 4 1 1 A 98 98 ILE CA C 98 59.981 59.718 0.263 1
1 1115 . 4 1 1 A 98 98 ILE CB C 98 40.608 40.626 -0.018 1
1 1119 . 4 1 1 A 98 98 ILE N N 98 131.738 127.305 4.433 1
1 1120 . 4 1 1 A 99 99 VAL H H 99 8.493 8.634 -0.141 1
1 1121 . 4 1 1 A 99 99 VAL HA H 99 5.201 4.740 0.461 1
1 1129 . 4 1 1 A 99 99 VAL C C 99 176.557 175.324 1.233 1
1 1130 . 4 1 1 A 99 99 VAL CA C 99 61.495 61.046 0.449 1
1 1131 . 4 1 1 A 99 99 VAL CB C 99 32.327 32.456 -0.129 1
1 1134 . 4 1 1 A 99 99 VAL N N 99 129.537 129.173 0.364 1
1 1135 . 4 1 1 A 100 100 THR H H 100 9.050 8.491 0.559 1
1 1136 . 4 1 1 A 100 100 THR HA H 100 5.606 5.417 0.189 1
1 1141 . 4 1 1 A 100 100 THR C C 100 172.815 172.782 0.033 1
1 1142 . 4 1 1 A 100 100 THR CA C 100 59.049 59.361 -0.312 1
1 1143 . 4 1 1 A 100 100 THR CB C 100 73.966 72.748 1.218 1
1 1145 . 4 1 1 A 100 100 THR N N 100 117.469 117.181 0.288 1
1 1146 . 4 1 1 A 101 101 ARG H H 101 8.773 8.712 0.061 1
1 1147 . 4 1 1 A 101 101 ARG HA H 101 4.989 4.990 -0.001 1
1 1155 . 4 1 1 A 101 101 ARG C C 101 174.738 174.906 -0.168 1
1 1156 . 4 1 1 A 101 101 ARG CA C 101 54.825 54.090 0.735 1
1 1157 . 4 1 1 A 101 101 ARG CB C 101 34.636 34.198 0.438 1
1 1160 . 4 1 1 A 101 101 ARG N N 101 117.532 120.381 -2.849 1
1 1162 . 4 1 1 A 102 102 LYS H H 102 8.616 8.275 0.341 1
1 1163 . 4 1 1 A 102 102 LYS HA H 102 4.232 4.404 -0.172 1
1 1171 . 4 1 1 A 102 102 LYS C C 102 175.935 175.805 0.130 1
1 1172 . 4 1 1 A 102 102 LYS CA C 102 56.549 56.371 0.178 1
1 1173 . 4 1 1 A 102 102 LYS CB C 102 33.266 32.451 0.815 1
1 1177 . 4 1 1 A 102 102 LYS N N 102 126.899 121.443 5.456 1
1 1178 . 4 1 1 A 103 103 LEU H H 103 8.424 8.792 -0.368 1
1 1179 . 4 1 1 A 103 103 LEU HA H 103 4.540 4.985 -0.445 1
1 1189 . 4 1 1 A 103 103 LEU C C 103 176.956 176.445 0.511 1
1 1190 . 4 1 1 A 103 103 LEU CA C 103 54.755 53.479 1.276 1
1 1191 . 4 1 1 A 103 103 LEU CB C 103 42.929 44.229 -1.300 1
1 1195 . 4 1 1 A 103 103 LEU N N 103 126.246 126.604 -0.358 1
1 1196 . 4 1 1 A 104 104 THR H H 104 8.201 8.508 -0.307 1
1 1197 . 4 1 1 A 104 104 THR HA H 104 4.624 4.427 0.197 1
1 1202 . 4 1 1 A 104 104 THR C C 104 172.954 174.043 -1.089 1
1 1203 . 4 1 1 A 104 104 THR CA C 104 59.483 60.902 -1.419 1
1 1204 . 4 1 1 A 104 104 THR CB C 104 69.761 69.020 0.741 1
1 1206 . 4 1 1 A 104 104 THR N N 104 117.263 117.591 -0.328 1
1 1207 . 4 1 1 A 105 105 PRO HA H 105 4.399 4.552 -0.153 1
1 1213 . 4 1 1 A 105 105 PRO CA C 105 63.495 62.426 1.069 1
1 1214 . 4 1 1 A 105 105 PRO CB C 105 32.096 33.287 -1.191 1
1 1217 . 4 1 1 A 106 106 GLU H H 106 8.519 9.100 -0.581 1
1 1218 . 4 1 1 A 106 106 GLU HA H 106 4.197 4.497 -0.300 1
1 1221 . 4 1 1 A 106 106 GLU C C 106 176.110 176.515 -0.405 1
1 1222 . 4 1 1 A 106 106 GLU CA C 106 56.743 57.798 -1.055 1
1 1223 . 4 1 1 A 106 106 GLU CB C 106 30.137 30.977 -0.840 1
1 1225 . 4 1 1 A 106 106 GLU N N 106 120.609 119.000 1.609 1
1 1226 . 4 1 1 A 107 107 ALA H H 107 8.241 7.495 0.746 1
1 1227 . 4 1 1 A 107 107 ALA HA H 107 4.317 4.552 -0.235 1
1 1231 . 4 1 1 A 107 107 ALA C C 107 177.299 174.794 2.505 1
1 1232 . 4 1 1 A 107 107 ALA CA C 107 52.203 51.811 0.392 1
1 1233 . 4 1 1 A 107 107 ALA CB C 107 19.392 22.352 -2.960 1
1 1234 . 4 1 1 A 107 107 ALA N N 107 124.849 117.133 7.716 1
1 1235 . 4 1 1 A 108 108 MET H H 108 8.284 8.701 -0.417 1
1 1236 . 4 1 1 A 108 108 MET HA H 108 4.792 5.021 -0.229 1
1 1244 . 4 1 1 A 108 108 MET C C 108 174.337 174.911 -0.574 1
1 1245 . 4 1 1 A 108 108 MET CA C 108 53.258 52.894 0.364 1
1 1246 . 4 1 1 A 108 108 MET CB C 108 32.608 35.573 -2.965 1
1 1249 . 4 1 1 A 108 108 MET N N 108 121.025 118.705 2.320 1
1 1250 . 4 1 1 A 109 109 PRO HA H 109 4.408 4.672 -0.264 1
1 1256 . 4 1 1 A 109 109 PRO C C 109 176.412 175.011 1.401 1
1 1257 . 4 1 1 A 109 109 PRO CA C 109 63.290 62.497 0.793 1
1 1258 . 4 1 1 A 109 109 PRO CB C 109 32.077 33.237 -1.160 1
1 1261 . 4 1 1 A 110 110 ASP H H 110 8.417 8.900 -0.483 1
1 1262 . 4 1 1 A 110 110 ASP HA H 110 4.573 4.892 -0.319 1
1 1265 . 4 1 1 A 110 110 ASP C C 110 176.508 174.991 1.517 1
1 1266 . 4 1 1 A 110 110 ASP CA C 110 54.085 53.664 0.421 1
1 1267 . 4 1 1 A 110 110 ASP CB C 110 41.075 44.205 -3.130 1
1 1268 . 4 1 1 A 110 110 ASP N N 110 120.239 120.998 -0.759 1
1 1269 . 4 1 1 A 111 111 LEU H H 111 8.279 8.619 -0.340 1
1 1270 . 4 1 1 A 111 111 LEU HA H 111 4.319 4.437 -0.118 1
1 1280 . 4 1 1 A 111 111 LEU C C 111 177.551 175.534 2.017 1
1 1281 . 4 1 1 A 111 111 LEU CA C 111 55.581 54.948 0.633 1
1 1282 . 4 1 1 A 111 111 LEU CB C 111 42.360 42.403 -0.043 1
1 1286 . 4 1 1 A 111 111 LEU N N 111 123.318 125.912 -2.594 1
1 1287 . 4 1 1 A 112 112 ASN H H 112 8.487 8.623 -0.136 1
1 1288 . 4 1 1 A 112 112 ASN HA H 112 4.725 5.412 -0.687 1
1 1293 . 4 1 1 A 112 112 ASN C C 112 175.454 173.795 1.659 1
1 1294 . 4 1 1 A 112 112 ASN CA C 112 53.610 51.525 2.085 1
1 1295 . 4 1 1 A 112 112 ASN CB C 112 39.116 42.853 -3.737 1
1 1296 . 4 1 1 A 112 112 ASN N N 112 118.752 116.946 1.806 1
1 1298 . 4 1 1 A 115 115 GLY H H 115 8.205 7.465 0.740 1
1 1299 . 4 1 1 A 115 115 GLY HA2 H 115 4.126 4.108 0.018 1
1 1300 . 4 1 1 A 115 115 GLY HA3 H 115 4.126 4.108 0.018 1
1 1301 . 4 1 1 A 115 115 GLY CA C 115 44.727 44.149 0.578 1
1 1302 . 4 1 1 A 116 116 PRO HA H 116 4.485 4.695 -0.210 1
1 1309 . 4 1 1 A 116 116 PRO CA C 116 63.298 62.594 0.704 1
1 1310 . 4 1 1 A 116 116 PRO CB C 116 32.077 33.373 -1.296 1
1 1313 . 4 1 1 A 117 117 SER H H 117 8.532 8.591 -0.059 1
1 1 . 5 1 1 A 7 7 GLY HA2 H 7 3.960 4.133 -0.173 1
1 2 . 5 1 1 A 7 7 GLY HA3 H 7 3.960 4.134 -0.174 1
1 3 . 5 1 1 A 7 7 GLY C C 7 174.009 172.126 1.883 1
1 4 . 5 1 1 A 7 7 GLY CA C 7 45.374 45.716 -0.342 1
1 5 . 5 1 1 A 8 8 ALA H H 8 8.163 8.600 -0.437 1
1 6 . 5 1 1 A 8 8 ALA HA H 8 4.381 5.088 -0.707 1
1 10 . 5 1 1 A 8 8 ALA C C 8 178.078 175.322 2.756 1
1 11 . 5 1 1 A 8 8 ALA CA C 8 52.677 51.343 1.334 1
1 12 . 5 1 1 A 8 8 ALA CB C 8 19.368 23.156 -3.788 1
1 13 . 5 1 1 A 8 8 ALA N N 8 123.721 125.073 -1.352 1
1 14 . 5 1 1 A 9 9 THR H H 9 8.142 8.692 -0.550 1
1 15 . 5 1 1 A 9 9 THR HA H 9 4.353 4.866 -0.513 1
1 20 . 5 1 1 A 9 9 THR C C 9 174.597 173.026 1.571 1
1 21 . 5 1 1 A 9 9 THR CA C 9 62.093 61.660 0.433 1
1 22 . 5 1 1 A 9 9 THR CB C 9 69.948 70.286 -0.338 1
1 24 . 5 1 1 A 9 9 THR N N 9 113.761 115.741 -1.980 1
1 25 . 5 1 1 A 10 10 LEU H H 10 8.218 9.085 -0.867 1
1 26 . 5 1 1 A 10 10 LEU HA H 10 4.169 4.851 -0.682 1
1 36 . 5 1 1 A 10 10 LEU C C 10 176.110 176.342 -0.232 1
1 37 . 5 1 1 A 10 10 LEU CA C 10 61.099 53.985 7.114 1
1 38 . 5 1 1 A 10 10 LEU CB C 10 38.686 43.395 -4.709 1
1 42 . 5 1 1 A 10 10 LEU N N 10 123.516 128.090 -4.574 1
1 43 . 5 1 1 A 11 11 LYS H H 11 8.496 8.748 -0.252 1
1 44 . 5 1 1 A 11 11 LYS HA H 11 4.891 4.878 0.013 1
1 49 . 5 1 1 A 11 11 LYS C C 11 175.794 175.012 0.782 1
1 50 . 5 1 1 A 11 11 LYS CA C 11 55.652 54.150 1.502 1
1 51 . 5 1 1 A 11 11 LYS CB C 11 29.444 36.715 -7.271 1
1 52 . 5 1 1 A 11 11 LYS N N 11 125.141 122.887 2.254 1
1 53 . 5 1 1 A 12 12 GLN HA H 12 4.315 4.801 -0.486 1
1 54 . 5 1 1 A 12 12 GLN C C 12 176.300 174.323 1.977 1
1 55 . 5 1 1 A 12 12 GLN CA C 12 56.286 54.968 1.318 1
1 56 . 5 1 1 A 12 12 GLN CB C 12 32.901 28.311 4.590 1
1 57 . 5 1 1 A 13 13 LEU H H 13 8.410 8.226 0.184 1
1 58 . 5 1 1 A 13 13 LEU HA H 13 4.348 4.662 -0.314 1
1 67 . 5 1 1 A 13 13 LEU C C 13 177.120 175.983 1.137 1
1 68 . 5 1 1 A 13 13 LEU CA C 13 55.142 54.247 0.895 1
1 69 . 5 1 1 A 13 13 LEU CB C 13 42.352 43.526 -1.174 1
1 73 . 5 1 1 A 13 13 LEU N N 13 124.340 120.122 4.218 1
1 74 . 5 1 1 A 14 14 ASP H H 14 8.250 9.429 -1.179 1
1 75 . 5 1 1 A 14 14 ASP HA H 14 4.540 4.456 0.084 1
1 78 . 5 1 1 A 14 14 ASP C C 14 176.769 176.458 0.311 1
1 79 . 5 1 1 A 14 14 ASP CA C 14 54.772 55.843 -1.071 1
1 80 . 5 1 1 A 14 14 ASP CB C 14 41.322 40.455 0.867 1
1 81 . 5 1 1 A 14 14 ASP N N 14 120.493 119.448 1.045 1
1 82 . 5 1 1 A 15 15 GLY H H 15 8.428 8.700 -0.272 1
1 83 . 5 1 1 A 15 15 GLY HA2 H 15 4.089 3.927 0.162 1
1 84 . 5 1 1 A 15 15 GLY HA3 H 15 3.874 3.935 -0.061 1
1 85 . 5 1 1 A 15 15 GLY C C 15 174.122 174.430 -0.308 1
1 86 . 5 1 1 A 15 15 GLY CA C 15 45.972 45.589 0.383 1
1 87 . 5 1 1 A 15 15 GLY N N 15 108.670 106.311 2.359 1
1 88 . 5 1 1 A 16 16 ILE H H 16 7.727 7.934 -0.207 1
1 89 . 5 1 1 A 16 16 ILE HA H 16 4.705 4.245 0.460 1
1 99 . 5 1 1 A 16 16 ILE C C 16 175.807 175.451 0.356 1
1 100 . 5 1 1 A 16 16 ILE CA C 16 60.703 60.946 -0.243 1
1 101 . 5 1 1 A 16 16 ILE CB C 16 38.509 38.429 0.080 1
1 105 . 5 1 1 A 16 16 ILE N N 16 120.267 123.181 -2.914 1
1 106 . 5 1 1 A 17 17 HIS H H 17 9.101 9.277 -0.176 1
1 107 . 5 1 1 A 17 17 HIS HA H 17 4.782 5.278 -0.496 1
1 112 . 5 1 1 A 17 17 HIS C C 17 173.051 173.239 -0.188 1
1 113 . 5 1 1 A 17 17 HIS CA C 17 55.353 53.182 2.171 1
1 114 . 5 1 1 A 17 17 HIS CB C 17 32.468 32.854 -0.386 1
1 117 . 5 1 1 A 17 17 HIS N N 17 125.061 127.131 -2.070 1
1 118 . 5 1 1 A 18 18 VAL H H 18 8.427 8.750 -0.323 1
1 119 . 5 1 1 A 18 18 VAL HA H 18 4.375 4.483 -0.108 1
1 127 . 5 1 1 A 18 18 VAL C C 18 174.702 175.167 -0.465 1
1 128 . 5 1 1 A 18 18 VAL CA C 18 62.035 61.581 0.454 1
1 129 . 5 1 1 A 18 18 VAL CB C 18 32.325 32.860 -0.535 1
1 132 . 5 1 1 A 18 18 VAL N N 18 127.069 127.792 -0.723 1
1 133 . 5 1 1 A 19 19 THR H H 19 9.272 8.561 0.711 1
1 134 . 5 1 1 A 19 19 THR HA H 19 4.512 5.037 -0.525 1
1 139 . 5 1 1 A 19 19 THR C C 19 172.784 173.373 -0.589 1
1 140 . 5 1 1 A 19 19 THR CA C 19 62.512 61.687 0.825 1
1 141 . 5 1 1 A 19 19 THR CB C 19 70.663 70.950 -0.287 1
1 143 . 5 1 1 A 19 19 THR N N 19 126.619 122.955 3.664 1
1 144 . 5 1 1 A 20 20 ILE H H 20 8.737 9.083 -0.346 1
1 145 . 5 1 1 A 20 20 ILE HA H 20 4.870 4.660 0.210 1
1 155 . 5 1 1 A 20 20 ILE C C 20 175.315 174.558 0.757 1
1 156 . 5 1 1 A 20 20 ILE CA C 20 60.157 60.232 -0.075 1
1 157 . 5 1 1 A 20 20 ILE CB C 20 38.603 38.307 0.296 1
1 161 . 5 1 1 A 20 20 ILE N N 20 128.114 128.455 -0.341 1
1 162 . 5 1 1 A 21 21 LEU H H 21 8.902 9.062 -0.160 1
1 163 . 5 1 1 A 21 21 LEU HA H 21 4.804 4.806 -0.002 1
1 173 . 5 1 1 A 21 21 LEU C C 21 175.565 175.461 0.104 1
1 174 . 5 1 1 A 21 21 LEU CA C 21 52.731 53.754 -1.023 1
1 175 . 5 1 1 A 21 21 LEU CB C 21 43.947 43.185 0.762 1
1 179 . 5 1 1 A 21 21 LEU N N 21 125.457 128.445 -2.988 1
1 180 . 5 1 1 A 22 22 HIS H H 22 8.577 9.118 -0.541 1
1 181 . 5 1 1 A 22 22 HIS HA H 22 5.013 5.118 -0.105 1
1 186 . 5 1 1 A 22 22 HIS C C 22 174.258 174.933 -0.675 1
1 187 . 5 1 1 A 22 22 HIS CA C 22 55.880 54.695 1.185 1
1 188 . 5 1 1 A 22 22 HIS CB C 22 30.901 30.459 0.442 1
1 191 . 5 1 1 A 22 22 HIS N N 22 122.595 124.617 -2.022 1
1 192 . 5 1 1 A 23 23 LYS H H 23 8.712 9.128 -0.416 1
1 193 . 5 1 1 A 23 23 LYS HA H 23 4.880 4.951 -0.071 1
1 202 . 5 1 1 A 23 23 LYS C C 23 174.265 175.451 -1.186 1
1 203 . 5 1 1 A 23 23 LYS CA C 23 54.314 54.157 0.157 1
1 204 . 5 1 1 A 23 23 LYS CB C 23 36.068 36.093 -0.025 1
1 208 . 5 1 1 A 23 23 LYS N N 23 120.814 121.153 -0.339 1
1 209 . 5 1 1 A 24 24 GLU H H 24 8.360 8.482 -0.122 1
1 210 . 5 1 1 A 24 24 GLU HA H 24 4.350 4.575 -0.225 1
1 215 . 5 1 1 A 24 24 GLU C C 24 177.843 176.827 1.016 1
1 216 . 5 1 1 A 24 24 GLU CA C 24 55.601 55.396 0.205 1
1 217 . 5 1 1 A 24 24 GLU CB C 24 30.512 31.070 -0.558 1
1 219 . 5 1 1 A 24 24 GLU N N 24 117.859 119.289 -1.430 1
1 220 . 5 1 1 A 25 25 GLU H H 25 9.146 8.808 0.338 1
1 221 . 5 1 1 A 25 25 GLU HA H 25 3.924 4.298 -0.374 1
1 226 . 5 1 1 A 25 25 GLU C C 25 177.809 177.635 0.174 1
1 227 . 5 1 1 A 25 25 GLU CA C 25 58.568 58.838 -0.270 1
1 228 . 5 1 1 A 25 25 GLU CB C 25 29.313 29.129 0.184 1
1 230 . 5 1 1 A 25 25 GLU N N 25 124.543 122.282 2.261 1
1 231 . 5 1 1 A 26 26 GLY H H 26 8.242 8.908 -0.666 1
1 232 . 5 1 1 A 26 26 GLY HA2 H 26 4.287 4.035 0.252 1
1 233 . 5 1 1 A 26 26 GLY HA3 H 26 3.407 4.038 -0.631 1
1 234 . 5 1 1 A 26 26 GLY C C 26 174.234 175.235 -1.001 1
1 235 . 5 1 1 A 26 26 GLY CA C 26 46.113 46.031 0.082 1
1 236 . 5 1 1 A 26 26 GLY N N 26 115.394 114.237 1.157 1
1 237 . 5 1 1 A 27 27 ALA H H 27 7.432 8.384 -0.952 1
1 238 . 5 1 1 A 27 27 ALA HA H 27 4.402 4.296 0.106 1
1 242 . 5 1 1 A 27 27 ALA C C 27 178.138 178.251 -0.113 1
1 243 . 5 1 1 A 27 27 ALA CA C 27 52.273 52.889 -0.616 1
1 244 . 5 1 1 A 27 27 ALA CB C 27 20.214 19.724 0.490 1
1 245 . 5 1 1 A 27 27 ALA N N 27 122.323 122.454 -0.131 1
1 246 . 5 1 1 A 28 28 GLY H H 28 8.624 7.894 0.730 1
1 247 . 5 1 1 A 28 28 GLY HA2 H 28 4.134 4.038 0.096 1
1 248 . 5 1 1 A 28 28 GLY HA3 H 28 3.953 4.083 -0.130 1
1 249 . 5 1 1 A 28 28 GLY C C 28 174.069 174.783 -0.714 1
1 250 . 5 1 1 A 28 28 GLY CA C 28 44.546 44.667 -0.121 1
1 251 . 5 1 1 A 28 28 GLY N N 28 107.593 105.663 1.930 1
1 252 . 5 1 1 A 29 29 LEU H H 29 7.934 8.516 -0.582 1
1 253 . 5 1 1 A 29 29 LEU HA H 29 4.059 4.467 -0.408 1
1 263 . 5 1 1 A 29 29 LEU C C 29 177.548 177.030 0.518 1
1 264 . 5 1 1 A 29 29 LEU CA C 29 56.298 55.528 0.770 1
1 265 . 5 1 1 A 29 29 LEU CB C 29 41.940 43.100 -1.160 1
1 269 . 5 1 1 A 29 29 LEU N N 29 115.495 121.291 -5.796 1
1 270 . 5 1 1 A 30 30 GLY H H 30 8.669 8.104 0.565 1
1 271 . 5 1 1 A 30 30 GLY HA2 H 30 4.264 4.052 0.212 1
1 272 . 5 1 1 A 30 30 GLY HA3 H 30 4.001 4.152 -0.151 1
1 273 . 5 1 1 A 30 30 GLY C C 30 175.296 173.115 2.181 1
1 274 . 5 1 1 A 30 30 GLY CA C 30 46.368 44.955 1.413 1
1 275 . 5 1 1 A 30 30 GLY N N 30 103.121 106.032 -2.911 1
1 276 . 5 1 1 A 31 31 PHE H H 31 7.044 7.272 -0.228 1
1 277 . 5 1 1 A 31 31 PHE HA H 31 4.541 4.562 -0.021 1
1 285 . 5 1 1 A 31 31 PHE C C 31 171.141 172.819 -1.678 1
1 286 . 5 1 1 A 31 31 PHE CA C 31 55.704 55.201 0.503 1
1 287 . 5 1 1 A 31 31 PHE CB C 31 40.745 41.934 -1.189 1
1 293 . 5 1 1 A 31 31 PHE N N 31 115.404 114.985 0.419 1
1 294 . 5 1 1 A 32 32 SER H H 32 8.752 8.910 -0.158 1
1 295 . 5 1 1 A 32 32 SER HA H 32 4.990 5.152 -0.162 1
1 298 . 5 1 1 A 32 32 SER C C 32 175.049 173.882 1.167 1
1 299 . 5 1 1 A 32 32 SER CA C 32 55.001 55.950 -0.949 1
1 300 . 5 1 1 A 32 32 SER CB C 32 67.170 66.583 0.587 1
1 301 . 5 1 1 A 32 32 SER N N 32 113.639 114.289 -0.650 1
1 302 . 5 1 1 A 33 33 LEU H H 33 8.639 8.476 0.163 1
1 303 . 5 1 1 A 33 33 LEU HA H 33 5.573 5.197 0.376 1
1 313 . 5 1 1 A 33 33 LEU C C 33 175.827 175.649 0.178 1
1 314 . 5 1 1 A 33 33 LEU CA C 33 53.620 53.575 0.045 1
1 315 . 5 1 1 A 33 33 LEU CB C 33 45.399 44.625 0.774 1
1 319 . 5 1 1 A 33 33 LEU N N 33 118.936 121.479 -2.543 1
1 320 . 5 1 1 A 34 34 ALA H H 34 9.410 8.998 0.412 1
1 321 . 5 1 1 A 34 34 ALA HA H 34 4.749 5.005 -0.256 1
1 325 . 5 1 1 A 34 34 ALA C C 34 176.231 176.810 -0.579 1
1 326 . 5 1 1 A 34 34 ALA CA C 34 50.425 51.218 -0.793 1
1 327 . 5 1 1 A 34 34 ALA CB C 34 22.518 22.899 -0.381 1
1 328 . 5 1 1 A 34 34 ALA N N 34 124.395 122.280 2.115 1
1 329 . 5 1 1 A 35 35 GLY H H 35 8.130 8.672 -0.542 1
1 330 . 5 1 1 A 35 35 GLY HA2 H 35 4.712 4.137 0.575 1
1 331 . 5 1 1 A 35 35 GLY HA3 H 35 3.955 4.151 -0.196 1
1 332 . 5 1 1 A 35 35 GLY C C 35 174.750 173.055 1.695 1
1 333 . 5 1 1 A 35 35 GLY CA C 35 44.494 44.958 -0.464 1
1 334 . 5 1 1 A 35 35 GLY N N 35 103.650 107.830 -4.180 1
1 335 . 5 1 1 A 36 36 GLY H H 36 8.217 7.927 0.290 1
1 336 . 5 1 1 A 36 36 GLY HA2 H 36 4.494 4.321 0.173 1
1 337 . 5 1 1 A 36 36 GLY HA3 H 36 3.836 4.360 -0.524 1
1 338 . 5 1 1 A 36 36 GLY C C 36 174.410 174.100 0.310 1
1 339 . 5 1 1 A 36 36 GLY CA C 36 45.462 45.979 -0.517 1
1 340 . 5 1 1 A 36 36 GLY N N 36 122.114 108.260 13.854 1
1 341 . 5 1 1 A 37 37 ALA H H 37 8.963 8.901 0.062 1
1 342 . 5 1 1 A 37 37 ALA HA H 37 3.998 4.183 -0.185 1
1 346 . 5 1 1 A 37 37 ALA C C 37 176.935 179.432 -2.497 1
1 347 . 5 1 1 A 37 37 ALA CA C 37 55.308 54.474 0.834 1
1 348 . 5 1 1 A 37 37 ALA CB C 37 18.822 18.437 0.385 1
1 349 . 5 1 1 A 37 37 ALA N N 37 123.418 121.856 1.562 1
1 350 . 5 1 1 A 38 38 ASP H H 38 10.586 8.235 2.351 1
1 351 . 5 1 1 A 38 38 ASP HA H 38 4.485 4.388 0.097 1
1 354 . 5 1 1 A 38 38 ASP C C 38 175.309 176.404 -1.095 1
1 355 . 5 1 1 A 38 38 ASP CA C 38 52.730 56.315 -3.585 1
1 356 . 5 1 1 A 38 38 ASP CB C 38 38.689 40.857 -2.168 1
1 357 . 5 1 1 A 38 38 ASP N N 38 111.480 118.263 -6.783 1
1 358 . 5 1 1 A 39 39 LEU H H 39 7.789 7.731 0.058 1
1 359 . 5 1 1 A 39 39 LEU HA H 39 4.699 4.372 0.327 1
1 369 . 5 1 1 A 39 39 LEU C C 39 176.377 177.637 -1.260 1
1 370 . 5 1 1 A 39 39 LEU CA C 39 52.952 54.248 -1.296 1
1 371 . 5 1 1 A 39 39 LEU CB C 39 43.294 42.259 1.035 1
1 375 . 5 1 1 A 39 39 LEU N N 39 122.545 121.468 1.077 1
1 376 . 5 1 1 A 40 40 GLU H H 40 8.331 8.553 -0.222 1
1 377 . 5 1 1 A 40 40 GLU HA H 40 3.978 4.215 -0.237 1
1 382 . 5 1 1 A 40 40 GLU C C 40 176.887 177.014 -0.127 1
1 383 . 5 1 1 A 40 40 GLU CA C 40 59.066 59.064 0.002 1
1 384 . 5 1 1 A 40 40 GLU CB C 40 29.523 30.073 -0.550 1
1 386 . 5 1 1 A 40 40 GLU N N 40 118.036 120.168 -2.132 1
1 387 . 5 1 1 A 41 41 ASN H H 41 7.890 8.158 -0.268 1
1 388 . 5 1 1 A 41 41 ASN HA H 41 4.820 4.761 0.059 1
1 393 . 5 1 1 A 41 41 ASN CA C 41 52.316 52.595 -0.279 1
1 394 . 5 1 1 A 41 41 ASN CB C 41 37.409 37.493 -0.084 1
1 395 . 5 1 1 A 41 41 ASN N N 41 115.196 115.265 -0.069 1
1 397 . 5 1 1 A 42 42 LYS H H 42 7.943 7.942 0.001 1
1 398 . 5 1 1 A 42 42 LYS HA H 42 4.328 4.269 0.059 1
1 407 . 5 1 1 A 42 42 LYS C C 42 177.081 177.252 -0.171 1
1 408 . 5 1 1 A 42 42 LYS CA C 42 56.567 59.038 -2.471 1
1 409 . 5 1 1 A 42 42 LYS CB C 42 33.120 32.598 0.522 1
1 413 . 5 1 1 A 42 42 LYS N N 42 120.612 123.660 -3.048 1
1 414 . 5 1 1 A 43 43 VAL H H 43 7.456 7.733 -0.277 1
1 415 . 5 1 1 A 43 43 VAL HA H 43 4.059 4.448 -0.389 1
1 423 . 5 1 1 A 43 43 VAL CA C 43 61.330 60.981 0.349 1
1 424 . 5 1 1 A 43 43 VAL CB C 43 32.819 32.950 -0.131 1
1 427 . 5 1 1 A 43 43 VAL N N 43 118.284 118.920 -0.636 1
1 428 . 5 1 1 A 44 44 ILE H H 44 8.481 8.675 -0.194 1
1 429 . 5 1 1 A 44 44 ILE HA H 44 4.913 4.510 0.403 1
1 439 . 5 1 1 A 44 44 ILE C C 44 176.719 175.915 0.804 1
1 440 . 5 1 1 A 44 44 ILE CA C 44 59.946 62.197 -2.251 1
1 441 . 5 1 1 A 44 44 ILE CB C 44 35.784 38.242 -2.458 1
1 445 . 5 1 1 A 44 44 ILE N N 44 127.089 130.461 -3.372 1
1 446 . 5 1 1 A 45 45 THR H H 45 8.906 9.446 -0.540 1
1 447 . 5 1 1 A 45 45 THR HA H 45 5.400 4.956 0.444 1
1 452 . 5 1 1 A 45 45 THR CA C 45 58.528 59.748 -1.220 1
1 453 . 5 1 1 A 45 45 THR CB C 45 73.760 72.132 1.628 1
1 455 . 5 1 1 A 45 45 THR N N 45 116.832 117.938 -1.106 1
1 456 . 5 1 1 A 46 46 VAL H H 46 8.336 8.567 -0.231 1
1 457 . 5 1 1 A 46 46 VAL HA H 46 4.059 4.194 -0.135 1
1 465 . 5 1 1 A 46 46 VAL C C 46 176.648 176.529 0.119 1
1 466 . 5 1 1 A 46 46 VAL CA C 46 63.058 63.099 -0.041 1
1 467 . 5 1 1 A 46 46 VAL CB C 46 31.601 30.925 0.676 1
1 470 . 5 1 1 A 46 46 VAL N N 46 118.542 122.149 -3.607 1
1 471 . 5 1 1 A 47 47 HIS H H 47 9.382 8.560 0.822 1
1 472 . 5 1 1 A 47 47 HIS HA H 47 4.628 4.209 0.419 1
1 477 . 5 1 1 A 47 47 HIS C C 47 174.339 174.211 0.128 1
1 478 . 5 1 1 A 47 47 HIS CA C 47 57.764 59.892 -2.128 1
1 479 . 5 1 1 A 47 47 HIS CB C 47 31.453 30.552 0.901 1
1 482 . 5 1 1 A 47 47 HIS N N 47 133.900 128.285 5.615 1
1 483 . 5 1 1 A 48 48 ARG H H 48 7.135 7.771 -0.636 1
1 484 . 5 1 1 A 48 48 ARG HA H 48 4.360 4.713 -0.353 1
1 491 . 5 1 1 A 48 48 ARG C C 48 173.877 174.714 -0.837 1
1 492 . 5 1 1 A 48 48 ARG CA C 48 54.385 54.772 -0.387 1
1 493 . 5 1 1 A 48 48 ARG CB C 48 33.996 34.680 -0.684 1
1 496 . 5 1 1 A 48 48 ARG N N 48 114.736 117.488 -2.752 1
1 497 . 5 1 1 A 49 49 VAL H H 49 8.690 8.654 0.036 1
1 498 . 5 1 1 A 49 49 VAL HA H 49 4.015 4.455 -0.440 1
1 506 . 5 1 1 A 49 49 VAL C C 49 176.255 175.586 0.669 1
1 507 . 5 1 1 A 49 49 VAL CA C 49 61.882 61.663 0.219 1
1 508 . 5 1 1 A 49 49 VAL CB C 49 32.261 33.304 -1.043 1
1 511 . 5 1 1 A 49 49 VAL N N 49 122.844 122.410 0.434 1
1 512 . 5 1 1 A 50 50 PHE H H 50 7.866 8.659 -0.793 1
1 513 . 5 1 1 A 50 50 PHE HA H 50 4.866 4.510 0.356 1
1 521 . 5 1 1 A 50 50 PHE C C 50 174.847 176.334 -1.487 1
1 522 . 5 1 1 A 50 50 PHE CA C 50 54.596 57.516 -2.920 1
1 523 . 5 1 1 A 50 50 PHE CB C 50 36.558 39.142 -2.584 1
1 529 . 5 1 1 A 50 50 PHE N N 50 128.498 127.366 1.132 1
1 530 . 5 1 1 A 51 51 PRO HA H 51 4.386 4.549 -0.163 1
1 537 . 5 1 1 A 51 51 PRO C C 51 177.321 176.660 0.661 1
1 538 . 5 1 1 A 51 51 PRO CA C 51 64.381 64.539 -0.158 1
1 539 . 5 1 1 A 51 51 PRO CB C 51 31.773 32.244 -0.471 1
1 542 . 5 1 1 A 52 52 ASN H H 52 8.814 8.540 0.274 1
1 543 . 5 1 1 A 52 52 ASN HA H 52 4.496 5.003 -0.507 1
1 548 . 5 1 1 A 52 52 ASN C C 52 174.823 174.665 0.158 1
1 549 . 5 1 1 A 52 52 ASN CA C 52 54.719 52.224 2.495 1
1 550 . 5 1 1 A 52 52 ASN CB C 52 38.109 39.245 -1.136 1
1 551 . 5 1 1 A 52 52 ASN N N 52 116.145 116.236 -0.091 1
1 553 . 5 1 1 A 53 53 GLY H H 53 7.730 8.255 -0.525 1
1 554 . 5 1 1 A 53 53 GLY HA2 H 53 4.430 4.306 0.124 1
1 555 . 5 1 1 A 53 53 GLY HA3 H 53 4.089 4.322 -0.233 1
1 556 . 5 1 1 A 53 53 GLY C C 53 174.810 174.223 0.587 1
1 557 . 5 1 1 A 53 53 GLY CA C 53 44.987 45.765 -0.778 1
1 558 . 5 1 1 A 53 53 GLY N N 53 106.196 111.140 -4.944 1
1 559 . 5 1 1 A 54 54 LEU H H 54 8.764 9.343 -0.579 1
1 560 . 5 1 1 A 54 54 LEU HA H 54 4.041 4.099 -0.058 1
1 570 . 5 1 1 A 54 54 LEU C C 54 179.712 178.700 1.012 1
1 571 . 5 1 1 A 54 54 LEU CA C 54 58.310 57.626 0.684 1
1 572 . 5 1 1 A 54 54 LEU CB C 54 42.390 41.791 0.599 1
1 576 . 5 1 1 A 54 54 LEU N N 54 118.836 119.726 -0.890 1
1 577 . 5 1 1 A 55 55 ALA H H 55 7.593 8.800 -1.207 1
1 578 . 5 1 1 A 55 55 ALA HA H 55 4.275 3.940 0.335 1
1 582 . 5 1 1 A 55 55 ALA C C 55 181.307 179.696 1.611 1
1 583 . 5 1 1 A 55 55 ALA CA C 55 54.825 55.120 -0.295 1
1 584 . 5 1 1 A 55 55 ALA CB C 55 18.345 18.121 0.224 1
1 585 . 5 1 1 A 55 55 ALA N N 55 118.782 121.894 -3.112 1
1 586 . 5 1 1 A 56 56 SER H H 56 9.339 7.981 1.358 1
1 587 . 5 1 1 A 56 56 SER HA H 56 4.023 4.175 -0.152 1
1 589 . 5 1 1 A 56 56 SER C C 56 176.392 176.850 -0.458 1
1 590 . 5 1 1 A 56 56 SER CA C 56 60.984 61.542 -0.558 1
1 591 . 5 1 1 A 56 56 SER CB C 56 62.987 63.079 -0.092 1
1 592 . 5 1 1 A 56 56 SER N N 56 117.631 114.187 3.444 1
1 593 . 5 1 1 A 57 57 GLN H H 57 7.942 7.889 0.053 1
1 594 . 5 1 1 A 57 57 GLN HA H 57 4.034 4.013 0.021 1
1 601 . 5 1 1 A 57 57 GLN C C 57 177.400 178.887 -1.487 1
1 602 . 5 1 1 A 57 57 GLN CA C 57 58.362 58.956 -0.594 1
1 603 . 5 1 1 A 57 57 GLN CB C 57 28.801 28.457 0.344 1
1 605 . 5 1 1 A 57 57 GLN N N 57 118.162 121.353 -3.191 1
1 607 . 5 1 1 A 58 58 GLU H H 58 7.683 8.455 -0.772 1
1 608 . 5 1 1 A 58 58 GLU HA H 58 4.163 4.049 0.114 1
1 613 . 5 1 1 A 58 58 GLU C C 58 179.248 177.048 2.200 1
1 614 . 5 1 1 A 58 58 GLU CA C 58 59.559 58.090 1.469 1
1 615 . 5 1 1 A 58 58 GLU CB C 58 29.317 29.399 -0.082 1
1 617 . 5 1 1 A 58 58 GLU N N 58 119.877 118.843 1.034 1
1 618 . 5 1 1 A 59 59 GLY H H 59 7.446 7.517 -0.071 1
1 619 . 5 1 1 A 59 59 GLY HA2 H 59 4.100 3.951 0.149 1
1 620 . 5 1 1 A 59 59 GLY HA3 H 59 3.770 3.959 -0.189 1
1 621 . 5 1 1 A 59 59 GLY C C 59 175.432 174.681 0.751 1
1 622 . 5 1 1 A 59 59 GLY CA C 59 46.817 45.876 0.941 1
1 623 . 5 1 1 A 59 59 GLY N N 59 102.653 108.194 -5.541 1
1 624 . 5 1 1 A 60 60 THR H H 60 8.343 8.009 0.334 1
1 625 . 5 1 1 A 60 60 THR HA H 60 4.037 4.130 -0.093 1
1 630 . 5 1 1 A 60 60 THR C C 60 175.843 174.494 1.349 1
1 631 . 5 1 1 A 60 60 THR CA C 60 64.792 64.944 -0.152 1
1 632 . 5 1 1 A 60 60 THR CB C 60 69.325 69.428 -0.103 1
1 634 . 5 1 1 A 60 60 THR N N 60 113.863 112.488 1.375 1
1 635 . 5 1 1 A 61 61 ILE H H 61 8.802 7.553 1.249 1
1 636 . 5 1 1 A 61 61 ILE HA H 61 3.631 4.099 -0.468 1
1 646 . 5 1 1 A 61 61 ILE C C 61 174.198 174.368 -0.170 1
1 647 . 5 1 1 A 61 61 ILE CA C 61 62.938 60.698 2.240 1
1 648 . 5 1 1 A 61 61 ILE CB C 61 37.225 36.401 0.824 1
1 652 . 5 1 1 A 61 61 ILE N N 61 126.153 119.256 6.897 1
1 653 . 5 1 1 A 62 62 GLN H H 62 7.124 8.661 -1.537 1
1 654 . 5 1 1 A 62 62 GLN HA H 62 4.500 4.696 -0.196 1
1 661 . 5 1 1 A 62 62 GLN C C 62 174.556 175.266 -0.710 1
1 662 . 5 1 1 A 62 62 GLN CA C 62 53.364 54.040 -0.676 1
1 663 . 5 1 1 A 62 62 GLN CB C 62 32.196 31.867 0.329 1
1 665 . 5 1 1 A 62 62 GLN N N 62 123.730 126.517 -2.787 1
1 667 . 5 1 1 A 63 63 LYS H H 63 8.399 8.598 -0.199 1
1 668 . 5 1 1 A 63 63 LYS HA H 63 3.464 4.205 -0.741 1
1 677 . 5 1 1 A 63 63 LYS CA C 63 57.905 58.301 -0.396 1
1 678 . 5 1 1 A 63 63 LYS CB C 63 32.260 32.040 0.220 1
1 682 . 5 1 1 A 63 63 LYS N N 63 121.381 124.667 -3.286 1
1 683 . 5 1 1 A 64 64 GLY H H 64 9.265 8.681 0.584 1
1 684 . 5 1 1 A 64 64 GLY HA2 H 64 4.415 4.027 0.388 1
1 685 . 5 1 1 A 64 64 GLY HA3 H 64 3.639 4.040 -0.401 1
1 686 . 5 1 1 A 64 64 GLY CA C 64 44.881 45.028 -0.147 1
1 687 . 5 1 1 A 64 64 GLY N N 64 113.750 115.009 -1.259 1
1 688 . 5 1 1 A 65 65 ASN H H 65 7.594 8.551 -0.957 1
1 689 . 5 1 1 A 65 65 ASN HA H 65 4.798 4.707 0.091 1
1 694 . 5 1 1 A 65 65 ASN C C 65 175.042 173.847 1.195 1
1 695 . 5 1 1 A 65 65 ASN CA C 65 53.047 53.827 -0.780 1
1 696 . 5 1 1 A 65 65 ASN CB C 65 38.153 39.682 -1.529 1
1 697 . 5 1 1 A 65 65 ASN N N 65 117.999 120.404 -2.405 1
1 699 . 5 1 1 A 66 66 GLU H H 66 8.538 8.572 -0.034 1
1 700 . 5 1 1 A 66 66 GLU HA H 66 4.634 4.683 -0.049 1
1 705 . 5 1 1 A 66 66 GLU C C 66 176.620 175.047 1.573 1
1 706 . 5 1 1 A 66 66 GLU CA C 66 55.863 54.806 1.057 1
1 707 . 5 1 1 A 66 66 GLU CB C 66 30.899 30.727 0.172 1
1 709 . 5 1 1 A 66 66 GLU N N 66 122.233 121.936 0.297 1
1 710 . 5 1 1 A 67 67 VAL H H 67 8.452 8.905 -0.453 1
1 711 . 5 1 1 A 67 67 VAL HA H 67 4.172 4.061 0.111 1
1 719 . 5 1 1 A 67 67 VAL C C 67 174.641 175.487 -0.846 1
1 720 . 5 1 1 A 67 67 VAL CA C 67 61.856 63.203 -1.347 1
1 721 . 5 1 1 A 67 67 VAL CB C 67 31.066 31.138 -0.072 1
1 724 . 5 1 1 A 67 67 VAL N N 67 126.311 127.873 -1.562 1
1 725 . 5 1 1 A 68 68 LEU H H 68 9.000 8.810 0.190 1
1 726 . 5 1 1 A 68 68 LEU HA H 68 4.390 4.242 0.148 1
1 736 . 5 1 1 A 68 68 LEU C C 68 178.924 176.978 1.946 1
1 737 . 5 1 1 A 68 68 LEU CA C 68 56.990 56.421 0.569 1
1 738 . 5 1 1 A 68 68 LEU CB C 68 42.392 42.582 -0.190 1
1 742 . 5 1 1 A 68 68 LEU N N 68 127.175 129.697 -2.522 1
1 743 . 5 1 1 A 69 69 SER H H 69 7.666 7.778 -0.112 1
1 744 . 5 1 1 A 69 69 SER HA H 69 5.144 4.897 0.247 1
1 747 . 5 1 1 A 69 69 SER C C 69 172.722 172.257 0.465 1
1 748 . 5 1 1 A 69 69 SER CA C 69 57.606 57.455 0.151 1
1 749 . 5 1 1 A 69 69 SER CB C 69 64.511 66.015 -1.504 1
1 750 . 5 1 1 A 69 69 SER N N 69 110.346 108.828 1.518 1
1 751 . 5 1 1 A 70 70 ILE H H 70 7.965 8.407 -0.442 1
1 752 . 5 1 1 A 70 70 ILE HA H 70 4.548 4.928 -0.380 1
1 762 . 5 1 1 A 70 70 ILE C C 70 174.993 176.147 -1.154 1
1 763 . 5 1 1 A 70 70 ILE CA C 70 60.897 60.170 0.727 1
1 764 . 5 1 1 A 70 70 ILE CB C 70 41.186 40.546 0.640 1
1 768 . 5 1 1 A 70 70 ILE N N 70 119.579 121.124 -1.545 1
1 769 . 5 1 1 A 71 71 ASN H H 71 9.839 10.550 -0.711 1
1 770 . 5 1 1 A 71 71 ASN HA H 71 4.485 4.413 0.072 1
1 775 . 5 1 1 A 71 71 ASN C C 71 174.975 174.747 0.228 1
1 776 . 5 1 1 A 71 71 ASN CA C 71 54.085 54.345 -0.260 1
1 777 . 5 1 1 A 71 71 ASN CB C 71 36.255 37.581 -1.326 1
1 778 . 5 1 1 A 71 71 ASN N N 71 126.963 125.376 1.587 1
1 780 . 5 1 1 A 72 72 GLY H H 72 8.911 8.418 0.493 1
1 781 . 5 1 1 A 72 72 GLY HA2 H 72 4.149 3.905 0.244 1
1 782 . 5 1 1 A 72 72 GLY HA3 H 72 3.507 3.906 -0.399 1
1 783 . 5 1 1 A 72 72 GLY C C 72 173.594 173.571 0.023 1
1 784 . 5 1 1 A 72 72 GLY CA C 72 45.162 45.400 -0.238 1
1 785 . 5 1 1 A 72 72 GLY N N 72 103.020 104.715 -1.695 1
1 786 . 5 1 1 A 73 73 LYS H H 73 7.922 7.626 0.296 1
1 787 . 5 1 1 A 73 73 LYS HA H 73 4.485 4.595 -0.110 1
1 796 . 5 1 1 A 73 73 LYS C C 73 175.036 175.533 -0.497 1
1 797 . 5 1 1 A 73 73 LYS CA C 73 54.719 55.055 -0.336 1
1 798 . 5 1 1 A 73 73 LYS CB C 73 32.137 34.004 -1.867 1
1 802 . 5 1 1 A 73 73 LYS N N 73 122.413 122.417 -0.004 1
1 803 . 5 1 1 A 74 74 SER H H 74 8.585 8.902 -0.317 1
1 804 . 5 1 1 A 74 74 SER HA H 74 4.452 4.679 -0.227 1
1 807 . 5 1 1 A 74 74 SER C C 74 175.965 174.123 1.842 1
1 808 . 5 1 1 A 74 74 SER CA C 74 58.028 58.674 -0.646 1
1 809 . 5 1 1 A 74 74 SER CB C 74 63.799 63.807 -0.008 1
1 810 . 5 1 1 A 74 74 SER N N 74 118.737 124.933 -6.196 1
1 811 . 5 1 1 A 75 75 LEU H H 75 8.015 8.244 -0.229 1
1 812 . 5 1 1 A 75 75 LEU HA H 75 4.661 4.487 0.174 1
1 822 . 5 1 1 A 75 75 LEU C C 75 178.117 177.590 0.527 1
1 823 . 5 1 1 A 75 75 LEU CA C 75 53.980 54.580 -0.600 1
1 824 . 5 1 1 A 75 75 LEU CB C 75 40.830 41.103 -0.273 1
1 828 . 5 1 1 A 75 75 LEU N N 75 125.425 125.507 -0.082 1
1 829 . 5 1 1 A 76 76 LYS H H 76 8.099 8.625 -0.526 1
1 830 . 5 1 1 A 76 76 LYS HA H 76 4.210 4.421 -0.211 1
1 839 . 5 1 1 A 76 76 LYS C C 76 178.487 176.759 1.728 1
1 840 . 5 1 1 A 76 76 LYS CA C 76 58.010 55.452 2.558 1
1 841 . 5 1 1 A 76 76 LYS CB C 76 31.683 31.653 0.030 1
1 845 . 5 1 1 A 76 76 LYS N N 76 124.064 120.157 3.907 1
1 846 . 5 1 1 A 77 77 GLY H H 77 8.859 7.838 1.021 1
1 847 . 5 1 1 A 77 77 GLY HA2 H 77 4.110 4.048 0.062 1
1 848 . 5 1 1 A 77 77 GLY HA3 H 77 3.869 4.051 -0.182 1
1 849 . 5 1 1 A 77 77 GLY C C 77 174.335 174.900 -0.565 1
1 850 . 5 1 1 A 77 77 GLY CA C 77 46.232 44.998 1.234 1
1 851 . 5 1 1 A 77 77 GLY N N 77 115.659 108.717 6.942 1
1 852 . 5 1 1 A 78 78 THR H H 78 7.654 7.750 -0.096 1
1 853 . 5 1 1 A 78 78 THR HA H 78 4.624 4.156 0.468 1
1 858 . 5 1 1 A 78 78 THR C C 78 177.272 174.755 2.517 1
1 859 . 5 1 1 A 78 78 THR CA C 78 61.794 63.087 -1.293 1
1 860 . 5 1 1 A 78 78 THR CB C 78 70.595 69.191 1.404 1
1 862 . 5 1 1 A 78 78 THR N N 78 112.847 116.556 -3.709 1
1 863 . 5 1 1 A 79 79 THR H H 79 8.813 8.590 0.223 1
1 864 . 5 1 1 A 79 79 THR HA H 79 4.395 4.656 -0.261 1
1 869 . 5 1 1 A 79 79 THR C C 79 174.503 175.405 -0.902 1
1 870 . 5 1 1 A 79 79 THR CA C 79 61.724 60.998 0.726 1
1 871 . 5 1 1 A 79 79 THR CB C 79 71.007 70.966 0.041 1
1 873 . 5 1 1 A 79 79 THR N N 79 114.123 117.908 -3.785 1
1 874 . 5 1 1 A 80 80 HIS H H 80 10.266 9.205 1.061 1
1 875 . 5 1 1 A 80 80 HIS HA H 80 4.331 4.413 -0.082 1
1 880 . 5 1 1 A 80 80 HIS C C 80 177.075 176.765 0.310 1
1 881 . 5 1 1 A 80 80 HIS CA C 80 61.338 60.344 0.994 1
1 882 . 5 1 1 A 80 80 HIS CB C 80 28.651 30.680 -2.029 1
1 885 . 5 1 1 A 80 80 HIS N N 80 122.776 121.996 0.780 1
1 886 . 5 1 1 A 81 81 HIS H H 81 9.335 8.193 1.142 1
1 887 . 5 1 1 A 81 81 HIS HA H 81 4.078 4.104 -0.026 1
1 892 . 5 1 1 A 81 81 HIS C C 81 178.269 176.514 1.755 1
1 893 . 5 1 1 A 81 81 HIS CA C 81 60.210 59.880 0.330 1
1 894 . 5 1 1 A 81 81 HIS CB C 81 29.569 30.036 -0.467 1
1 897 . 5 1 1 A 81 81 HIS N N 81 114.733 119.020 -4.287 1
1 898 . 5 1 1 A 82 82 ASP H H 82 7.741 8.421 -0.680 1
1 899 . 5 1 1 A 82 82 ASP HA H 82 4.452 4.013 0.439 1
1 902 . 5 1 1 A 82 82 ASP C C 82 178.683 179.054 -0.371 1
1 903 . 5 1 1 A 82 82 ASP CA C 82 57.148 57.332 -0.184 1
1 904 . 5 1 1 A 82 82 ASP CB C 82 39.522 40.373 -0.851 1
1 905 . 5 1 1 A 82 82 ASP N N 82 121.407 117.964 3.443 1
1 906 . 5 1 1 A 83 83 ALA H H 83 8.502 8.383 0.119 1
1 907 . 5 1 1 A 83 83 ALA HA H 83 3.939 4.075 -0.136 1
1 911 . 5 1 1 A 83 83 ALA C C 83 179.361 179.527 -0.166 1
1 912 . 5 1 1 A 83 83 ALA CA C 83 55.635 54.773 0.862 1
1 913 . 5 1 1 A 83 83 ALA CB C 83 18.124 18.761 -0.637 1
1 914 . 5 1 1 A 83 83 ALA N N 83 125.049 122.781 2.268 1
1 915 . 5 1 1 A 84 84 LEU H H 84 8.100 8.426 -0.326 1
1 916 . 5 1 1 A 84 84 LEU HA H 84 3.792 3.844 -0.052 1
1 926 . 5 1 1 A 84 84 LEU C C 84 180.173 179.053 1.120 1
1 927 . 5 1 1 A 84 84 LEU CA C 84 57.932 57.974 -0.042 1
1 928 . 5 1 1 A 84 84 LEU CB C 84 41.157 41.643 -0.486 1
1 932 . 5 1 1 A 84 84 LEU N N 84 117.139 118.348 -1.209 1
1 933 . 5 1 1 A 85 85 ALA H H 85 7.715 8.775 -1.060 1
1 934 . 5 1 1 A 85 85 ALA HA H 85 4.061 4.133 -0.072 1
1 938 . 5 1 1 A 85 85 ALA C C 85 180.380 179.709 0.671 1
1 939 . 5 1 1 A 85 85 ALA CA C 85 55.212 55.458 -0.246 1
1 940 . 5 1 1 A 85 85 ALA CB C 85 17.803 18.558 -0.755 1
1 941 . 5 1 1 A 85 85 ALA N N 85 122.448 121.544 0.904 1
1 942 . 5 1 1 A 86 86 ILE H H 86 7.669 7.921 -0.252 1
1 943 . 5 1 1 A 86 86 ILE HA H 86 3.678 3.712 -0.034 1
1 953 . 5 1 1 A 86 86 ILE C C 86 178.692 178.831 -0.139 1
1 954 . 5 1 1 A 86 86 ILE CA C 86 65.226 64.650 0.576 1
1 955 . 5 1 1 A 86 86 ILE CB C 86 38.099 37.693 0.406 1
1 959 . 5 1 1 A 86 86 ILE N N 86 121.804 117.829 3.975 1
1 960 . 5 1 1 A 87 87 LEU H H 87 7.922 8.303 -0.381 1
1 961 . 5 1 1 A 87 87 LEU HA H 87 3.903 4.033 -0.130 1
1 971 . 5 1 1 A 87 87 LEU C C 87 178.610 178.592 0.018 1
1 972 . 5 1 1 A 87 87 LEU CA C 87 58.221 57.879 0.342 1
1 973 . 5 1 1 A 87 87 LEU CB C 87 42.344 41.714 0.630 1
1 977 . 5 1 1 A 87 87 LEU N N 87 121.947 121.844 0.103 1
1 978 . 5 1 1 A 88 88 ARG H H 88 8.317 8.284 0.033 1
1 979 . 5 1 1 A 88 88 ARG HA H 88 4.060 4.172 -0.112 1
1 986 . 5 1 1 A 88 88 ARG C C 88 180.698 177.070 3.628 1
1 987 . 5 1 1 A 88 88 ARG CA C 88 59.383 58.535 0.848 1
1 988 . 5 1 1 A 88 88 ARG CB C 88 30.055 29.723 0.332 1
1 991 . 5 1 1 A 88 88 ARG N N 88 119.343 119.436 -0.093 1
1 992 . 5 1 1 A 89 89 GLN H H 89 8.270 7.684 0.586 1
1 993 . 5 1 1 A 89 89 GLN HA H 89 4.122 4.238 -0.116 1
1 1000 . 5 1 1 A 89 89 GLN C C 89 177.955 177.746 0.209 1
1 1001 . 5 1 1 A 89 89 GLN CA C 89 58.714 57.278 1.436 1
1 1002 . 5 1 1 A 89 89 GLN CB C 89 28.160 29.035 -0.875 1
1 1004 . 5 1 1 A 89 89 GLN N N 89 121.097 117.463 3.634 1
1 1006 . 5 1 1 A 90 90 ALA H H 90 7.558 7.371 0.187 1
1 1007 . 5 1 1 A 90 90 ALA HA H 90 4.123 4.168 -0.045 1
1 1011 . 5 1 1 A 90 90 ALA C C 90 178.076 178.438 -0.362 1
1 1012 . 5 1 1 A 90 90 ALA CA C 90 52.942 53.625 -0.683 1
1 1013 . 5 1 1 A 90 90 ALA CB C 90 18.015 18.597 -0.582 1
1 1014 . 5 1 1 A 90 90 ALA N N 90 119.652 121.940 -2.288 1
1 1015 . 5 1 1 A 91 91 ARG H H 91 7.768 8.088 -0.320 1
1 1016 . 5 1 1 A 91 91 ARG HA H 91 4.065 4.256 -0.191 1
1 1022 . 5 1 1 A 91 91 ARG C C 91 177.858 177.705 0.153 1
1 1023 . 5 1 1 A 91 91 ARG CA C 91 58.573 57.536 1.037 1
1 1024 . 5 1 1 A 91 91 ARG CB C 91 30.384 30.760 -0.376 1
1 1027 . 5 1 1 A 91 91 ARG N N 91 118.081 117.222 0.859 1
1 1028 . 5 1 1 A 92 92 GLU H H 92 7.691 7.723 -0.032 1
1 1029 . 5 1 1 A 92 92 GLU HA H 92 4.123 4.168 -0.045 1
1 1034 . 5 1 1 A 92 92 GLU C C 92 174.459 176.721 -2.262 1
1 1035 . 5 1 1 A 92 92 GLU CA C 92 61.565 60.845 0.720 1
1 1036 . 5 1 1 A 92 92 GLU CB C 92 27.583 28.879 -1.296 1
1 1038 . 5 1 1 A 92 92 GLU N N 92 118.447 118.806 -0.359 1
1 1039 . 5 1 1 A 93 93 PRO HA H 93 4.716 4.537 0.179 1
1 1046 . 5 1 1 A 93 93 PRO C C 93 176.221 176.552 -0.331 1
1 1047 . 5 1 1 A 93 93 PRO CA C 93 63.149 62.536 0.613 1
1 1048 . 5 1 1 A 93 93 PRO CB C 93 32.571 33.129 -0.558 1
1 1051 . 5 1 1 A 94 94 ARG H H 94 8.434 8.998 -0.564 1
1 1052 . 5 1 1 A 94 94 ARG HA H 94 4.232 4.744 -0.512 1
1 1058 . 5 1 1 A 94 94 ARG C C 94 175.323 175.939 -0.616 1
1 1059 . 5 1 1 A 94 94 ARG CA C 94 56.972 56.804 0.168 1
1 1060 . 5 1 1 A 94 94 ARG CB C 94 30.448 30.923 -0.475 1
1 1063 . 5 1 1 A 94 94 ARG N N 94 115.987 119.423 -3.436 1
1 1064 . 5 1 1 A 95 95 GLN H H 95 7.246 7.568 -0.322 1
1 1065 . 5 1 1 A 95 95 GLN HA H 95 5.251 5.171 0.080 1
1 1072 . 5 1 1 A 95 95 GLN C C 95 174.786 173.564 1.222 1
1 1073 . 5 1 1 A 95 95 GLN CA C 95 54.209 54.517 -0.308 1
1 1074 . 5 1 1 A 95 95 GLN CB C 95 32.384 32.333 0.051 1
1 1076 . 5 1 1 A 95 95 GLN N N 95 115.998 119.872 -3.874 1
1 1078 . 5 1 1 A 96 96 ALA H H 96 8.739 8.316 0.423 1
1 1079 . 5 1 1 A 96 96 ALA HA H 96 5.412 5.068 0.344 1
1 1083 . 5 1 1 A 96 96 ALA C C 96 175.258 175.897 -0.639 1
1 1084 . 5 1 1 A 96 96 ALA CA C 96 50.355 50.926 -0.571 1
1 1085 . 5 1 1 A 96 96 ALA CB C 96 24.270 22.819 1.451 1
1 1086 . 5 1 1 A 96 96 ALA N N 96 126.197 126.325 -0.128 1
1 1087 . 5 1 1 A 97 97 VAL H H 97 8.568 8.719 -0.151 1
1 1088 . 5 1 1 A 97 97 VAL HA H 97 4.804 4.775 0.029 1
1 1096 . 5 1 1 A 97 97 VAL C C 97 175.982 175.051 0.931 1
1 1097 . 5 1 1 A 97 97 VAL CA C 97 61.442 61.347 0.095 1
1 1098 . 5 1 1 A 97 97 VAL CB C 97 33.413 33.603 -0.190 1
1 1101 . 5 1 1 A 97 97 VAL N N 97 120.702 122.160 -1.458 1
1 1102 . 5 1 1 A 98 98 ILE H H 98 9.753 8.639 1.114 1
1 1103 . 5 1 1 A 98 98 ILE HA H 98 4.826 5.046 -0.220 1
1 1113 . 5 1 1 A 98 98 ILE C C 98 174.292 174.684 -0.392 1
1 1114 . 5 1 1 A 98 98 ILE CA C 98 59.981 60.016 -0.035 1
1 1115 . 5 1 1 A 98 98 ILE CB C 98 40.608 40.612 -0.004 1
1 1119 . 5 1 1 A 98 98 ILE N N 98 131.738 127.062 4.676 1
1 1120 . 5 1 1 A 99 99 VAL H H 99 8.493 8.702 -0.209 1
1 1121 . 5 1 1 A 99 99 VAL HA H 99 5.201 4.630 0.571 1
1 1129 . 5 1 1 A 99 99 VAL C C 99 176.557 175.470 1.087 1
1 1130 . 5 1 1 A 99 99 VAL CA C 99 61.495 61.323 0.172 1
1 1131 . 5 1 1 A 99 99 VAL CB C 99 32.327 32.190 0.137 1
1 1134 . 5 1 1 A 99 99 VAL N N 99 129.537 129.422 0.115 1
1 1135 . 5 1 1 A 100 100 THR H H 100 9.050 8.741 0.309 1
1 1136 . 5 1 1 A 100 100 THR HA H 100 5.606 5.302 0.304 1
1 1141 . 5 1 1 A 100 100 THR C C 100 172.815 172.860 -0.045 1
1 1142 . 5 1 1 A 100 100 THR CA C 100 59.049 59.453 -0.404 1
1 1143 . 5 1 1 A 100 100 THR CB C 100 73.966 72.590 1.376 1
1 1145 . 5 1 1 A 100 100 THR N N 100 117.469 117.257 0.212 1
1 1146 . 5 1 1 A 101 101 ARG H H 101 8.773 8.820 -0.047 1
1 1147 . 5 1 1 A 101 101 ARG HA H 101 4.989 5.007 -0.018 1
1 1155 . 5 1 1 A 101 101 ARG C C 101 174.738 174.970 -0.232 1
1 1156 . 5 1 1 A 101 101 ARG CA C 101 54.825 53.988 0.837 1
1 1157 . 5 1 1 A 101 101 ARG CB C 101 34.636 34.048 0.588 1
1 1160 . 5 1 1 A 101 101 ARG N N 101 117.532 120.431 -2.899 1
1 1162 . 5 1 1 A 102 102 LYS H H 102 8.616 8.375 0.241 1
1 1163 . 5 1 1 A 102 102 LYS HA H 102 4.232 4.491 -0.259 1
1 1171 . 5 1 1 A 102 102 LYS C C 102 175.935 175.933 0.002 1
1 1172 . 5 1 1 A 102 102 LYS CA C 102 56.549 56.353 0.196 1
1 1173 . 5 1 1 A 102 102 LYS CB C 102 33.266 32.961 0.305 1
1 1177 . 5 1 1 A 102 102 LYS N N 102 126.899 121.623 5.276 1
1 1178 . 5 1 1 A 103 103 LEU H H 103 8.424 8.551 -0.127 1
1 1179 . 5 1 1 A 103 103 LEU HA H 103 4.540 4.791 -0.251 1
1 1189 . 5 1 1 A 103 103 LEU C C 103 176.956 176.142 0.814 1
1 1190 . 5 1 1 A 103 103 LEU CA C 103 54.755 53.567 1.188 1
1 1191 . 5 1 1 A 103 103 LEU CB C 103 42.929 43.490 -0.561 1
1 1195 . 5 1 1 A 103 103 LEU N N 103 126.246 126.549 -0.303 1
1 1196 . 5 1 1 A 104 104 THR H H 104 8.201 8.448 -0.247 1
1 1197 . 5 1 1 A 104 104 THR HA H 104 4.624 4.524 0.100 1
1 1202 . 5 1 1 A 104 104 THR C C 104 172.954 173.924 -0.970 1
1 1203 . 5 1 1 A 104 104 THR CA C 104 59.483 60.715 -1.232 1
1 1204 . 5 1 1 A 104 104 THR CB C 104 69.761 69.063 0.698 1
1 1206 . 5 1 1 A 104 104 THR N N 104 117.263 114.081 3.182 1
1 1207 . 5 1 1 A 105 105 PRO HA H 105 4.399 4.565 -0.166 1
1 1213 . 5 1 1 A 105 105 PRO CA C 105 63.495 62.239 1.256 1
1 1214 . 5 1 1 A 105 105 PRO CB C 105 32.096 32.880 -0.784 1
1 1217 . 5 1 1 A 106 106 GLU H H 106 8.519 8.439 0.080 1
1 1218 . 5 1 1 A 106 106 GLU HA H 106 4.197 4.891 -0.694 1
1 1221 . 5 1 1 A 106 106 GLU C C 106 176.110 175.416 0.694 1
1 1222 . 5 1 1 A 106 106 GLU CA C 106 56.743 54.692 2.051 1
1 1223 . 5 1 1 A 106 106 GLU CB C 106 30.137 33.227 -3.090 1
1 1225 . 5 1 1 A 106 106 GLU N N 106 120.609 119.882 0.727 1
1 1226 . 5 1 1 A 107 107 ALA H H 107 8.241 8.308 -0.067 1
1 1227 . 5 1 1 A 107 107 ALA HA H 107 4.317 4.347 -0.030 1
1 1231 . 5 1 1 A 107 107 ALA C C 107 177.299 177.471 -0.172 1
1 1232 . 5 1 1 A 107 107 ALA CA C 107 52.203 53.172 -0.969 1
1 1233 . 5 1 1 A 107 107 ALA CB C 107 19.392 20.203 -0.811 1
1 1234 . 5 1 1 A 107 107 ALA N N 107 124.849 122.048 2.801 1
1 1235 . 5 1 1 A 108 108 MET H H 108 8.284 8.055 0.229 1
1 1236 . 5 1 1 A 108 108 MET HA H 108 4.792 4.121 0.671 1
1 1244 . 5 1 1 A 108 108 MET C C 108 174.337 174.940 -0.603 1
1 1245 . 5 1 1 A 108 108 MET CA C 108 53.258 56.156 -2.898 1
1 1246 . 5 1 1 A 108 108 MET CB C 108 32.608 31.166 1.442 1
1 1249 . 5 1 1 A 108 108 MET N N 108 121.025 117.248 3.777 1
1 1250 . 5 1 1 A 109 109 PRO HA H 109 4.408 4.565 -0.157 1
1 1256 . 5 1 1 A 109 109 PRO C C 109 176.412 175.567 0.845 1
1 1257 . 5 1 1 A 109 109 PRO CA C 109 63.290 62.297 0.993 1
1 1258 . 5 1 1 A 109 109 PRO CB C 109 32.077 32.680 -0.603 1
1 1261 . 5 1 1 A 110 110 ASP H H 110 8.417 8.639 -0.222 1
1 1262 . 5 1 1 A 110 110 ASP HA H 110 4.573 4.568 0.005 1
1 1265 . 5 1 1 A 110 110 ASP C C 110 176.508 175.701 0.807 1
1 1266 . 5 1 1 A 110 110 ASP CA C 110 54.085 53.657 0.428 1
1 1267 . 5 1 1 A 110 110 ASP CB C 110 41.075 39.667 1.408 1
1 1268 . 5 1 1 A 110 110 ASP N N 110 120.239 121.056 -0.817 1
1 1269 . 5 1 1 A 111 111 LEU H H 111 8.279 7.949 0.330 1
1 1270 . 5 1 1 A 111 111 LEU HA H 111 4.319 3.824 0.495 1
1 1280 . 5 1 1 A 111 111 LEU C C 111 177.551 177.715 -0.164 1
1 1281 . 5 1 1 A 111 111 LEU CA C 111 55.581 57.829 -2.248 1
1 1282 . 5 1 1 A 111 111 LEU CB C 111 42.360 41.981 0.379 1
1 1286 . 5 1 1 A 111 111 LEU N N 111 123.318 127.256 -3.938 1
1 1287 . 5 1 1 A 112 112 ASN H H 112 8.487 7.787 0.700 1
1 1288 . 5 1 1 A 112 112 ASN HA H 112 4.725 4.842 -0.117 1
1 1293 . 5 1 1 A 112 112 ASN C C 112 175.454 174.733 0.721 1
1 1294 . 5 1 1 A 112 112 ASN CA C 112 53.610 53.017 0.593 1
1 1295 . 5 1 1 A 112 112 ASN CB C 112 39.116 40.428 -1.312 1
1 1296 . 5 1 1 A 112 112 ASN N N 112 118.752 115.320 3.432 1
1 1298 . 5 1 1 A 115 115 GLY H H 115 8.205 8.480 -0.275 1
1 1299 . 5 1 1 A 115 115 GLY HA2 H 115 4.126 4.374 -0.248 1
1 1300 . 5 1 1 A 115 115 GLY HA3 H 115 4.126 4.374 -0.248 1
1 1301 . 5 1 1 A 115 115 GLY CA C 115 44.727 44.615 0.112 1
1 1302 . 5 1 1 A 116 116 PRO HA H 116 4.485 4.766 -0.281 1
1 1309 . 5 1 1 A 116 116 PRO CA C 116 63.298 62.642 0.656 1
1 1310 . 5 1 1 A 116 116 PRO CB C 116 32.077 33.513 -1.436 1
1 1313 . 5 1 1 A 117 117 SER H H 117 8.532 8.649 -0.117 1
1 1 . 6 1 1 A 7 7 GLY HA2 H 7 3.960 4.075 -0.115 1
1 2 . 6 1 1 A 7 7 GLY HA3 H 7 3.960 4.075 -0.115 1
1 3 . 6 1 1 A 7 7 GLY C C 7 174.009 172.112 1.897 1
1 4 . 6 1 1 A 7 7 GLY CA C 7 45.374 43.961 1.413 1
1 5 . 6 1 1 A 8 8 ALA H H 8 8.163 8.062 0.101 1
1 6 . 6 1 1 A 8 8 ALA HA H 8 4.381 4.892 -0.511 1
1 10 . 6 1 1 A 8 8 ALA C C 8 178.078 176.200 1.878 1
1 11 . 6 1 1 A 8 8 ALA CA C 8 52.677 51.538 1.139 1
1 12 . 6 1 1 A 8 8 ALA CB C 8 19.368 22.351 -2.983 1
1 13 . 6 1 1 A 8 8 ALA N N 8 123.721 120.946 2.775 1
1 14 . 6 1 1 A 9 9 THR H H 9 8.142 8.609 -0.467 1
1 15 . 6 1 1 A 9 9 THR HA H 9 4.353 3.895 0.458 1
1 20 . 6 1 1 A 9 9 THR C C 9 174.597 175.152 -0.555 1
1 21 . 6 1 1 A 9 9 THR CA C 9 62.093 64.982 -2.889 1
1 22 . 6 1 1 A 9 9 THR CB C 9 69.948 68.493 1.455 1
1 24 . 6 1 1 A 9 9 THR N N 9 113.761 115.190 -1.429 1
1 25 . 6 1 1 A 10 10 LEU H H 10 8.218 8.712 -0.494 1
1 26 . 6 1 1 A 10 10 LEU HA H 10 4.169 4.120 0.049 1
1 36 . 6 1 1 A 10 10 LEU C C 10 176.110 175.945 0.165 1
1 37 . 6 1 1 A 10 10 LEU CA C 10 61.099 55.445 5.654 1
1 38 . 6 1 1 A 10 10 LEU CB C 10 38.686 41.031 -2.345 1
1 42 . 6 1 1 A 10 10 LEU N N 10 123.516 123.029 0.487 1
1 43 . 6 1 1 A 11 11 LYS H H 11 8.496 7.935 0.561 1
1 44 . 6 1 1 A 11 11 LYS HA H 11 4.891 4.179 0.712 1
1 49 . 6 1 1 A 11 11 LYS C C 11 175.794 175.817 -0.023 1
1 50 . 6 1 1 A 11 11 LYS CA C 11 55.652 56.489 -0.837 1
1 51 . 6 1 1 A 11 11 LYS CB C 11 29.444 32.775 -3.331 1
1 52 . 6 1 1 A 11 11 LYS N N 11 125.141 123.296 1.845 1
1 53 . 6 1 1 A 12 12 GLN HA H 12 4.315 4.769 -0.454 1
1 54 . 6 1 1 A 12 12 GLN C C 12 176.300 174.936 1.364 1
1 55 . 6 1 1 A 12 12 GLN CA C 12 56.286 54.687 1.599 1
1 56 . 6 1 1 A 12 12 GLN CB C 12 32.901 29.217 3.684 1
1 57 . 6 1 1 A 13 13 LEU H H 13 8.410 8.663 -0.253 1
1 58 . 6 1 1 A 13 13 LEU HA H 13 4.348 4.808 -0.460 1
1 67 . 6 1 1 A 13 13 LEU C C 13 177.120 174.938 2.182 1
1 68 . 6 1 1 A 13 13 LEU CA C 13 55.142 53.446 1.696 1
1 69 . 6 1 1 A 13 13 LEU CB C 13 42.352 44.010 -1.658 1
1 73 . 6 1 1 A 13 13 LEU N N 13 124.340 126.211 -1.871 1
1 74 . 6 1 1 A 14 14 ASP H H 14 8.250 8.825 -0.575 1
1 75 . 6 1 1 A 14 14 ASP HA H 14 4.540 4.978 -0.438 1
1 78 . 6 1 1 A 14 14 ASP C C 14 176.769 175.840 0.929 1
1 79 . 6 1 1 A 14 14 ASP CA C 14 54.772 52.739 2.033 1
1 80 . 6 1 1 A 14 14 ASP CB C 14 41.322 41.549 -0.227 1
1 81 . 6 1 1 A 14 14 ASP N N 14 120.493 119.960 0.533 1
1 82 . 6 1 1 A 15 15 GLY H H 15 8.428 8.604 -0.176 1
1 83 . 6 1 1 A 15 15 GLY HA2 H 15 4.089 3.909 0.180 1
1 84 . 6 1 1 A 15 15 GLY HA3 H 15 3.874 3.915 -0.041 1
1 85 . 6 1 1 A 15 15 GLY C C 15 174.122 174.477 -0.355 1
1 86 . 6 1 1 A 15 15 GLY CA C 15 45.972 46.939 -0.967 1
1 87 . 6 1 1 A 15 15 GLY N N 15 108.670 113.695 -5.025 1
1 88 . 6 1 1 A 16 16 ILE H H 16 7.727 7.504 0.223 1
1 89 . 6 1 1 A 16 16 ILE HA H 16 4.705 4.563 0.142 1
1 99 . 6 1 1 A 16 16 ILE C C 16 175.807 173.817 1.990 1
1 100 . 6 1 1 A 16 16 ILE CA C 16 60.703 60.254 0.449 1
1 101 . 6 1 1 A 16 16 ILE CB C 16 38.509 40.406 -1.897 1
1 105 . 6 1 1 A 16 16 ILE N N 16 120.267 120.209 0.058 1
1 106 . 6 1 1 A 17 17 HIS H H 17 9.101 8.586 0.515 1
1 107 . 6 1 1 A 17 17 HIS HA H 17 4.782 5.292 -0.510 1
1 112 . 6 1 1 A 17 17 HIS C C 17 173.051 173.672 -0.621 1
1 113 . 6 1 1 A 17 17 HIS CA C 17 55.353 53.241 2.112 1
1 114 . 6 1 1 A 17 17 HIS CB C 17 32.468 32.974 -0.506 1
1 117 . 6 1 1 A 17 17 HIS N N 17 125.061 127.497 -2.436 1
1 118 . 6 1 1 A 18 18 VAL H H 18 8.427 8.492 -0.065 1
1 119 . 6 1 1 A 18 18 VAL HA H 18 4.375 4.208 0.167 1
1 127 . 6 1 1 A 18 18 VAL C C 18 174.702 175.180 -0.478 1
1 128 . 6 1 1 A 18 18 VAL CA C 18 62.035 62.088 -0.053 1
1 129 . 6 1 1 A 18 18 VAL CB C 18 32.325 32.078 0.247 1
1 132 . 6 1 1 A 18 18 VAL N N 18 127.069 127.414 -0.345 1
1 133 . 6 1 1 A 19 19 THR H H 19 9.272 8.220 1.052 1
1 134 . 6 1 1 A 19 19 THR HA H 19 4.512 4.990 -0.478 1
1 139 . 6 1 1 A 19 19 THR C C 19 172.784 173.146 -0.362 1
1 140 . 6 1 1 A 19 19 THR CA C 19 62.512 61.892 0.620 1
1 141 . 6 1 1 A 19 19 THR CB C 19 70.663 70.937 -0.274 1
1 143 . 6 1 1 A 19 19 THR N N 19 126.619 122.136 4.483 1
1 144 . 6 1 1 A 20 20 ILE H H 20 8.737 9.234 -0.497 1
1 145 . 6 1 1 A 20 20 ILE HA H 20 4.870 4.564 0.306 1
1 155 . 6 1 1 A 20 20 ILE C C 20 175.315 174.700 0.615 1
1 156 . 6 1 1 A 20 20 ILE CA C 20 60.157 60.223 -0.066 1
1 157 . 6 1 1 A 20 20 ILE CB C 20 38.603 38.023 0.580 1
1 161 . 6 1 1 A 20 20 ILE N N 20 128.114 128.908 -0.794 1
1 162 . 6 1 1 A 21 21 LEU H H 21 8.902 8.592 0.310 1
1 163 . 6 1 1 A 21 21 LEU HA H 21 4.804 5.022 -0.218 1
1 173 . 6 1 1 A 21 21 LEU C C 21 175.565 175.095 0.470 1
1 174 . 6 1 1 A 21 21 LEU CA C 21 52.731 53.248 -0.517 1
1 175 . 6 1 1 A 21 21 LEU CB C 21 43.947 42.940 1.007 1
1 179 . 6 1 1 A 21 21 LEU N N 21 125.457 128.640 -3.183 1
1 180 . 6 1 1 A 22 22 HIS H H 22 8.577 9.226 -0.649 1
1 181 . 6 1 1 A 22 22 HIS HA H 22 5.013 5.185 -0.172 1
1 186 . 6 1 1 A 22 22 HIS C C 22 174.258 174.980 -0.722 1
1 187 . 6 1 1 A 22 22 HIS CA C 22 55.880 54.960 0.920 1
1 188 . 6 1 1 A 22 22 HIS CB C 22 30.901 30.756 0.145 1
1 191 . 6 1 1 A 22 22 HIS N N 22 122.595 124.402 -1.807 1
1 192 . 6 1 1 A 23 23 LYS H H 23 8.712 9.551 -0.839 1
1 193 . 6 1 1 A 23 23 LYS HA H 23 4.880 4.923 -0.043 1
1 202 . 6 1 1 A 23 23 LYS C C 23 174.265 175.929 -1.664 1
1 203 . 6 1 1 A 23 23 LYS CA C 23 54.314 54.236 0.078 1
1 204 . 6 1 1 A 23 23 LYS CB C 23 36.068 36.007 0.061 1
1 208 . 6 1 1 A 23 23 LYS N N 23 120.814 121.210 -0.396 1
1 209 . 6 1 1 A 24 24 GLU H H 24 8.360 8.397 -0.037 1
1 210 . 6 1 1 A 24 24 GLU HA H 24 4.350 4.504 -0.154 1
1 215 . 6 1 1 A 24 24 GLU C C 24 177.843 176.219 1.624 1
1 216 . 6 1 1 A 24 24 GLU CA C 24 55.601 55.139 0.462 1
1 217 . 6 1 1 A 24 24 GLU CB C 24 30.512 30.468 0.044 1
1 219 . 6 1 1 A 24 24 GLU N N 24 117.859 119.963 -2.104 1
1 220 . 6 1 1 A 25 25 GLU H H 25 9.146 8.816 0.330 1
1 221 . 6 1 1 A 25 25 GLU HA H 25 3.924 4.156 -0.232 1
1 226 . 6 1 1 A 25 25 GLU C C 25 177.809 177.272 0.537 1
1 227 . 6 1 1 A 25 25 GLU CA C 25 58.568 58.322 0.246 1
1 228 . 6 1 1 A 25 25 GLU CB C 25 29.313 28.916 0.397 1
1 230 . 6 1 1 A 25 25 GLU N N 25 124.543 121.379 3.164 1
1 231 . 6 1 1 A 26 26 GLY H H 26 8.242 8.825 -0.583 1
1 232 . 6 1 1 A 26 26 GLY HA2 H 26 4.287 4.003 0.284 1
1 233 . 6 1 1 A 26 26 GLY HA3 H 26 3.407 4.006 -0.599 1
1 234 . 6 1 1 A 26 26 GLY C C 26 174.234 175.665 -1.431 1
1 235 . 6 1 1 A 26 26 GLY CA C 26 46.113 45.481 0.632 1
1 236 . 6 1 1 A 26 26 GLY N N 26 115.394 113.883 1.511 1
1 237 . 6 1 1 A 27 27 ALA H H 27 7.432 8.166 -0.734 1
1 238 . 6 1 1 A 27 27 ALA HA H 27 4.402 4.204 0.198 1
1 242 . 6 1 1 A 27 27 ALA C C 27 178.138 178.124 0.014 1
1 243 . 6 1 1 A 27 27 ALA CA C 27 52.273 53.168 -0.895 1
1 244 . 6 1 1 A 27 27 ALA CB C 27 20.214 19.651 0.563 1
1 245 . 6 1 1 A 27 27 ALA N N 27 122.323 123.064 -0.741 1
1 246 . 6 1 1 A 28 28 GLY H H 28 8.624 7.918 0.706 1
1 247 . 6 1 1 A 28 28 GLY HA2 H 28 4.134 4.042 0.092 1
1 248 . 6 1 1 A 28 28 GLY HA3 H 28 3.953 4.082 -0.129 1
1 249 . 6 1 1 A 28 28 GLY C C 28 174.069 175.104 -1.035 1
1 250 . 6 1 1 A 28 28 GLY CA C 28 44.546 44.566 -0.020 1
1 251 . 6 1 1 A 28 28 GLY N N 28 107.593 105.299 2.294 1
1 252 . 6 1 1 A 29 29 LEU H H 29 7.934 8.560 -0.626 1
1 253 . 6 1 1 A 29 29 LEU HA H 29 4.059 4.443 -0.384 1
1 263 . 6 1 1 A 29 29 LEU C C 29 177.548 177.035 0.513 1
1 264 . 6 1 1 A 29 29 LEU CA C 29 56.298 55.803 0.495 1
1 265 . 6 1 1 A 29 29 LEU CB C 29 41.940 42.920 -0.980 1
1 269 . 6 1 1 A 29 29 LEU N N 29 115.495 121.301 -5.806 1
1 270 . 6 1 1 A 30 30 GLY H H 30 8.669 8.081 0.588 1
1 271 . 6 1 1 A 30 30 GLY HA2 H 30 4.264 4.058 0.206 1
1 272 . 6 1 1 A 30 30 GLY HA3 H 30 4.001 4.141 -0.140 1
1 273 . 6 1 1 A 30 30 GLY C C 30 175.296 173.003 2.293 1
1 274 . 6 1 1 A 30 30 GLY CA C 30 46.368 44.970 1.398 1
1 275 . 6 1 1 A 30 30 GLY N N 30 103.121 105.991 -2.870 1
1 276 . 6 1 1 A 31 31 PHE H H 31 7.044 7.279 -0.235 1
1 277 . 6 1 1 A 31 31 PHE HA H 31 4.541 4.514 0.027 1
1 285 . 6 1 1 A 31 31 PHE C C 31 171.141 172.632 -1.491 1
1 286 . 6 1 1 A 31 31 PHE CA C 31 55.704 55.148 0.556 1
1 287 . 6 1 1 A 31 31 PHE CB C 31 40.745 41.909 -1.164 1
1 293 . 6 1 1 A 31 31 PHE N N 31 115.404 114.943 0.461 1
1 294 . 6 1 1 A 32 32 SER H H 32 8.752 8.887 -0.135 1
1 295 . 6 1 1 A 32 32 SER HA H 32 4.990 5.089 -0.099 1
1 298 . 6 1 1 A 32 32 SER C C 32 175.049 172.672 2.377 1
1 299 . 6 1 1 A 32 32 SER CA C 32 55.001 55.706 -0.705 1
1 300 . 6 1 1 A 32 32 SER CB C 32 67.170 66.319 0.851 1
1 301 . 6 1 1 A 32 32 SER N N 32 113.639 115.092 -1.453 1
1 302 . 6 1 1 A 33 33 LEU H H 33 8.639 8.454 0.185 1
1 303 . 6 1 1 A 33 33 LEU HA H 33 5.573 5.241 0.332 1
1 313 . 6 1 1 A 33 33 LEU C C 33 175.827 175.457 0.370 1
1 314 . 6 1 1 A 33 33 LEU CA C 33 53.620 53.532 0.088 1
1 315 . 6 1 1 A 33 33 LEU CB C 33 45.399 44.639 0.760 1
1 319 . 6 1 1 A 33 33 LEU N N 33 118.936 123.315 -4.379 1
1 320 . 6 1 1 A 34 34 ALA H H 34 9.410 8.965 0.445 1
1 321 . 6 1 1 A 34 34 ALA HA H 34 4.749 5.034 -0.285 1
1 325 . 6 1 1 A 34 34 ALA C C 34 176.231 176.644 -0.413 1
1 326 . 6 1 1 A 34 34 ALA CA C 34 50.425 51.221 -0.796 1
1 327 . 6 1 1 A 34 34 ALA CB C 34 22.518 23.015 -0.497 1
1 328 . 6 1 1 A 34 34 ALA N N 34 124.395 122.114 2.281 1
1 329 . 6 1 1 A 35 35 GLY H H 35 8.130 8.652 -0.522 1
1 330 . 6 1 1 A 35 35 GLY HA2 H 35 4.712 4.119 0.593 1
1 331 . 6 1 1 A 35 35 GLY HA3 H 35 3.955 4.145 -0.190 1
1 332 . 6 1 1 A 35 35 GLY C C 35 174.750 172.970 1.780 1
1 333 . 6 1 1 A 35 35 GLY CA C 35 44.494 44.846 -0.352 1
1 334 . 6 1 1 A 35 35 GLY N N 35 103.650 107.483 -3.833 1
1 335 . 6 1 1 A 36 36 GLY H H 36 8.217 7.920 0.297 1
1 336 . 6 1 1 A 36 36 GLY HA2 H 36 4.494 4.356 0.138 1
1 337 . 6 1 1 A 36 36 GLY HA3 H 36 3.836 4.379 -0.543 1
1 338 . 6 1 1 A 36 36 GLY C C 36 174.410 174.198 0.212 1
1 339 . 6 1 1 A 36 36 GLY CA C 36 45.462 45.892 -0.430 1
1 340 . 6 1 1 A 36 36 GLY N N 36 122.114 108.362 13.752 1
1 341 . 6 1 1 A 37 37 ALA H H 37 8.963 8.637 0.326 1
1 342 . 6 1 1 A 37 37 ALA HA H 37 3.998 4.081 -0.083 1
1 346 . 6 1 1 A 37 37 ALA C C 37 176.935 179.496 -2.561 1
1 347 . 6 1 1 A 37 37 ALA CA C 37 55.308 54.734 0.574 1
1 348 . 6 1 1 A 37 37 ALA CB C 37 18.822 18.469 0.353 1
1 349 . 6 1 1 A 37 37 ALA N N 37 123.418 122.420 0.998 1
1 350 . 6 1 1 A 38 38 ASP H H 38 10.586 8.164 2.422 1
1 351 . 6 1 1 A 38 38 ASP HA H 38 4.485 4.504 -0.019 1
1 354 . 6 1 1 A 38 38 ASP C C 38 175.309 176.372 -1.063 1
1 355 . 6 1 1 A 38 38 ASP CA C 38 52.730 55.933 -3.203 1
1 356 . 6 1 1 A 38 38 ASP CB C 38 38.689 41.067 -2.378 1
1 357 . 6 1 1 A 38 38 ASP N N 38 111.480 118.307 -6.827 1
1 358 . 6 1 1 A 39 39 LEU H H 39 7.789 7.674 0.115 1
1 359 . 6 1 1 A 39 39 LEU HA H 39 4.699 4.546 0.153 1
1 369 . 6 1 1 A 39 39 LEU C C 39 176.377 177.332 -0.955 1
1 370 . 6 1 1 A 39 39 LEU CA C 39 52.952 53.807 -0.855 1
1 371 . 6 1 1 A 39 39 LEU CB C 39 43.294 42.791 0.503 1
1 375 . 6 1 1 A 39 39 LEU N N 39 122.545 121.545 1.000 1
1 376 . 6 1 1 A 40 40 GLU H H 40 8.331 8.630 -0.299 1
1 377 . 6 1 1 A 40 40 GLU HA H 40 3.978 4.259 -0.281 1
1 382 . 6 1 1 A 40 40 GLU C C 40 176.887 176.583 0.304 1
1 383 . 6 1 1 A 40 40 GLU CA C 40 59.066 58.055 1.011 1
1 384 . 6 1 1 A 40 40 GLU CB C 40 29.523 30.421 -0.898 1
1 386 . 6 1 1 A 40 40 GLU N N 40 118.036 119.995 -1.959 1
1 387 . 6 1 1 A 41 41 ASN H H 41 7.890 7.546 0.344 1
1 388 . 6 1 1 A 41 41 ASN HA H 41 4.820 5.022 -0.202 1
1 393 . 6 1 1 A 41 41 ASN CA C 41 52.316 51.569 0.747 1
1 394 . 6 1 1 A 41 41 ASN CB C 41 37.409 37.073 0.336 1
1 395 . 6 1 1 A 41 41 ASN N N 41 115.196 119.047 -3.851 1
1 397 . 6 1 1 A 42 42 LYS H H 42 7.943 8.435 -0.492 1
1 398 . 6 1 1 A 42 42 LYS HA H 42 4.328 4.134 0.194 1
1 407 . 6 1 1 A 42 42 LYS C C 42 177.081 177.119 -0.038 1
1 408 . 6 1 1 A 42 42 LYS CA C 42 56.567 59.113 -2.546 1
1 409 . 6 1 1 A 42 42 LYS CB C 42 33.120 32.636 0.484 1
1 413 . 6 1 1 A 42 42 LYS N N 42 120.612 125.464 -4.852 1
1 414 . 6 1 1 A 43 43 VAL H H 43 7.456 7.717 -0.261 1
1 415 . 6 1 1 A 43 43 VAL HA H 43 4.059 4.586 -0.527 1
1 423 . 6 1 1 A 43 43 VAL CA C 43 61.330 60.328 1.002 1
1 424 . 6 1 1 A 43 43 VAL CB C 43 32.819 33.421 -0.602 1
1 427 . 6 1 1 A 43 43 VAL N N 43 118.284 118.640 -0.356 1
1 428 . 6 1 1 A 44 44 ILE H H 44 8.481 8.703 -0.222 1
1 429 . 6 1 1 A 44 44 ILE HA H 44 4.913 4.490 0.423 1
1 439 . 6 1 1 A 44 44 ILE C C 44 176.719 175.938 0.781 1
1 440 . 6 1 1 A 44 44 ILE CA C 44 59.946 62.141 -2.195 1
1 441 . 6 1 1 A 44 44 ILE CB C 44 35.784 38.155 -2.371 1
1 445 . 6 1 1 A 44 44 ILE N N 44 127.089 130.212 -3.123 1
1 446 . 6 1 1 A 45 45 THR H H 45 8.906 9.629 -0.723 1
1 447 . 6 1 1 A 45 45 THR HA H 45 5.400 5.037 0.363 1
1 452 . 6 1 1 A 45 45 THR CA C 45 58.528 59.291 -0.763 1
1 453 . 6 1 1 A 45 45 THR CB C 45 73.760 71.944 1.816 1
1 455 . 6 1 1 A 45 45 THR N N 45 116.832 117.370 -0.538 1
1 456 . 6 1 1 A 46 46 VAL H H 46 8.336 8.535 -0.199 1
1 457 . 6 1 1 A 46 46 VAL HA H 46 4.059 4.217 -0.158 1
1 465 . 6 1 1 A 46 46 VAL C C 46 176.648 176.619 0.029 1
1 466 . 6 1 1 A 46 46 VAL CA C 46 63.058 63.196 -0.138 1
1 467 . 6 1 1 A 46 46 VAL CB C 46 31.601 30.898 0.703 1
1 470 . 6 1 1 A 46 46 VAL N N 46 118.542 122.494 -3.952 1
1 471 . 6 1 1 A 47 47 HIS H H 47 9.382 8.600 0.782 1
1 472 . 6 1 1 A 47 47 HIS HA H 47 4.628 4.191 0.437 1
1 477 . 6 1 1 A 47 47 HIS C C 47 174.339 174.564 -0.225 1
1 478 . 6 1 1 A 47 47 HIS CA C 47 57.764 59.911 -2.147 1
1 479 . 6 1 1 A 47 47 HIS CB C 47 31.453 30.597 0.856 1
1 482 . 6 1 1 A 47 47 HIS N N 47 133.900 128.466 5.434 1
1 483 . 6 1 1 A 48 48 ARG H H 48 7.135 7.783 -0.648 1
1 484 . 6 1 1 A 48 48 ARG HA H 48 4.360 4.728 -0.368 1
1 491 . 6 1 1 A 48 48 ARG C C 48 173.877 174.678 -0.801 1
1 492 . 6 1 1 A 48 48 ARG CA C 48 54.385 54.877 -0.492 1
1 493 . 6 1 1 A 48 48 ARG CB C 48 33.996 34.829 -0.833 1
1 496 . 6 1 1 A 48 48 ARG N N 48 114.736 117.846 -3.110 1
1 497 . 6 1 1 A 49 49 VAL H H 49 8.690 8.668 0.022 1
1 498 . 6 1 1 A 49 49 VAL HA H 49 4.015 4.478 -0.463 1
1 506 . 6 1 1 A 49 49 VAL C C 49 176.255 175.543 0.712 1
1 507 . 6 1 1 A 49 49 VAL CA C 49 61.882 61.631 0.251 1
1 508 . 6 1 1 A 49 49 VAL CB C 49 32.261 33.436 -1.175 1
1 511 . 6 1 1 A 49 49 VAL N N 49 122.844 122.417 0.427 1
1 512 . 6 1 1 A 50 50 PHE H H 50 7.866 8.634 -0.768 1
1 513 . 6 1 1 A 50 50 PHE HA H 50 4.866 4.508 0.358 1
1 521 . 6 1 1 A 50 50 PHE C C 50 174.847 176.333 -1.486 1
1 522 . 6 1 1 A 50 50 PHE CA C 50 54.596 57.523 -2.927 1
1 523 . 6 1 1 A 50 50 PHE CB C 50 36.558 39.275 -2.717 1
1 529 . 6 1 1 A 50 50 PHE N N 50 128.498 127.323 1.175 1
1 530 . 6 1 1 A 51 51 PRO HA H 51 4.386 4.552 -0.166 1
1 537 . 6 1 1 A 51 51 PRO C C 51 177.321 176.657 0.664 1
1 538 . 6 1 1 A 51 51 PRO CA C 51 64.381 64.527 -0.146 1
1 539 . 6 1 1 A 51 51 PRO CB C 51 31.773 32.225 -0.452 1
1 542 . 6 1 1 A 52 52 ASN H H 52 8.814 8.544 0.270 1
1 543 . 6 1 1 A 52 52 ASN HA H 52 4.496 4.993 -0.497 1
1 548 . 6 1 1 A 52 52 ASN C C 52 174.823 174.691 0.132 1
1 549 . 6 1 1 A 52 52 ASN CA C 52 54.719 52.224 2.495 1
1 550 . 6 1 1 A 52 52 ASN CB C 52 38.109 39.249 -1.140 1
1 551 . 6 1 1 A 52 52 ASN N N 52 116.145 116.254 -0.109 1
1 553 . 6 1 1 A 53 53 GLY H H 53 7.730 8.247 -0.517 1
1 554 . 6 1 1 A 53 53 GLY HA2 H 53 4.430 4.292 0.138 1
1 555 . 6 1 1 A 53 53 GLY HA3 H 53 4.089 4.307 -0.218 1
1 556 . 6 1 1 A 53 53 GLY C C 53 174.810 174.414 0.396 1
1 557 . 6 1 1 A 53 53 GLY CA C 53 44.987 45.716 -0.729 1
1 558 . 6 1 1 A 53 53 GLY N N 53 106.196 111.095 -4.899 1
1 559 . 6 1 1 A 54 54 LEU H H 54 8.764 8.885 -0.121 1
1 560 . 6 1 1 A 54 54 LEU HA H 54 4.041 4.025 0.016 1
1 570 . 6 1 1 A 54 54 LEU C C 54 179.712 178.873 0.839 1
1 571 . 6 1 1 A 54 54 LEU CA C 54 58.310 57.742 0.568 1
1 572 . 6 1 1 A 54 54 LEU CB C 54 42.390 41.865 0.525 1
1 576 . 6 1 1 A 54 54 LEU N N 54 118.836 119.584 -0.748 1
1 577 . 6 1 1 A 55 55 ALA H H 55 7.593 8.413 -0.820 1
1 578 . 6 1 1 A 55 55 ALA HA H 55 4.275 3.944 0.331 1
1 582 . 6 1 1 A 55 55 ALA C C 55 181.307 179.759 1.548 1
1 583 . 6 1 1 A 55 55 ALA CA C 55 54.825 54.858 -0.033 1
1 584 . 6 1 1 A 55 55 ALA CB C 55 18.345 18.430 -0.085 1
1 585 . 6 1 1 A 55 55 ALA N N 55 118.782 121.742 -2.960 1
1 586 . 6 1 1 A 56 56 SER H H 56 9.339 7.958 1.381 1
1 587 . 6 1 1 A 56 56 SER HA H 56 4.023 4.220 -0.197 1
1 589 . 6 1 1 A 56 56 SER C C 56 176.392 177.222 -0.830 1
1 590 . 6 1 1 A 56 56 SER CA C 56 60.984 61.330 -0.346 1
1 591 . 6 1 1 A 56 56 SER CB C 56 62.987 63.000 -0.013 1
1 592 . 6 1 1 A 56 56 SER N N 56 117.631 113.536 4.095 1
1 593 . 6 1 1 A 57 57 GLN H H 57 7.942 7.774 0.168 1
1 594 . 6 1 1 A 57 57 GLN HA H 57 4.034 4.013 0.021 1
1 601 . 6 1 1 A 57 57 GLN C C 57 177.400 178.532 -1.132 1
1 602 . 6 1 1 A 57 57 GLN CA C 57 58.362 58.819 -0.457 1
1 603 . 6 1 1 A 57 57 GLN CB C 57 28.801 28.797 0.004 1
1 605 . 6 1 1 A 57 57 GLN N N 57 118.162 122.427 -4.265 1
1 607 . 6 1 1 A 58 58 GLU H H 58 7.683 8.311 -0.628 1
1 608 . 6 1 1 A 58 58 GLU HA H 58 4.163 4.072 0.091 1
1 613 . 6 1 1 A 58 58 GLU C C 58 179.248 176.782 2.466 1
1 614 . 6 1 1 A 58 58 GLU CA C 58 59.559 58.405 1.154 1
1 615 . 6 1 1 A 58 58 GLU CB C 58 29.317 29.261 0.056 1
1 617 . 6 1 1 A 58 58 GLU N N 58 119.877 119.995 -0.118 1
1 618 . 6 1 1 A 59 59 GLY H H 59 7.446 7.388 0.058 1
1 619 . 6 1 1 A 59 59 GLY HA2 H 59 4.100 3.937 0.163 1
1 620 . 6 1 1 A 59 59 GLY HA3 H 59 3.770 3.942 -0.172 1
1 621 . 6 1 1 A 59 59 GLY C C 59 175.432 174.894 0.538 1
1 622 . 6 1 1 A 59 59 GLY CA C 59 46.817 45.632 1.185 1
1 623 . 6 1 1 A 59 59 GLY N N 59 102.653 107.644 -4.991 1
1 624 . 6 1 1 A 60 60 THR H H 60 8.343 7.964 0.379 1
1 625 . 6 1 1 A 60 60 THR HA H 60 4.037 4.142 -0.105 1
1 630 . 6 1 1 A 60 60 THR C C 60 175.843 174.626 1.217 1
1 631 . 6 1 1 A 60 60 THR CA C 60 64.792 65.405 -0.613 1
1 632 . 6 1 1 A 60 60 THR CB C 60 69.325 69.369 -0.044 1
1 634 . 6 1 1 A 60 60 THR N N 60 113.863 112.963 0.900 1
1 635 . 6 1 1 A 61 61 ILE H H 61 8.802 7.596 1.206 1
1 636 . 6 1 1 A 61 61 ILE HA H 61 3.631 4.080 -0.449 1
1 646 . 6 1 1 A 61 61 ILE C C 61 174.198 174.463 -0.265 1
1 647 . 6 1 1 A 61 61 ILE CA C 61 62.938 60.888 2.050 1
1 648 . 6 1 1 A 61 61 ILE CB C 61 37.225 36.208 1.017 1
1 652 . 6 1 1 A 61 61 ILE N N 61 126.153 119.523 6.630 1
1 653 . 6 1 1 A 62 62 GLN H H 62 7.124 8.086 -0.962 1
1 654 . 6 1 1 A 62 62 GLN HA H 62 4.500 4.626 -0.126 1
1 661 . 6 1 1 A 62 62 GLN C C 62 174.556 175.361 -0.805 1
1 662 . 6 1 1 A 62 62 GLN CA C 62 53.364 54.240 -0.876 1
1 663 . 6 1 1 A 62 62 GLN CB C 62 32.196 31.392 0.804 1
1 665 . 6 1 1 A 62 62 GLN N N 62 123.730 126.441 -2.711 1
1 667 . 6 1 1 A 63 63 LYS H H 63 8.399 8.519 -0.120 1
1 668 . 6 1 1 A 63 63 LYS HA H 63 3.464 4.416 -0.952 1
1 677 . 6 1 1 A 63 63 LYS CA C 63 57.905 56.921 0.984 1
1 678 . 6 1 1 A 63 63 LYS CB C 63 32.260 32.217 0.043 1
1 682 . 6 1 1 A 63 63 LYS N N 63 121.381 123.934 -2.553 1
1 683 . 6 1 1 A 64 64 GLY H H 64 9.265 9.272 -0.007 1
1 684 . 6 1 1 A 64 64 GLY HA2 H 64 4.415 4.011 0.404 1
1 685 . 6 1 1 A 64 64 GLY HA3 H 64 3.639 4.020 -0.381 1
1 686 . 6 1 1 A 64 64 GLY CA C 64 44.881 45.061 -0.180 1
1 687 . 6 1 1 A 64 64 GLY N N 64 113.750 113.020 0.730 1
1 688 . 6 1 1 A 65 65 ASN H H 65 7.594 8.676 -1.082 1
1 689 . 6 1 1 A 65 65 ASN HA H 65 4.798 4.711 0.087 1
1 694 . 6 1 1 A 65 65 ASN C C 65 175.042 173.686 1.356 1
1 695 . 6 1 1 A 65 65 ASN CA C 65 53.047 53.875 -0.828 1
1 696 . 6 1 1 A 65 65 ASN CB C 65 38.153 39.632 -1.479 1
1 697 . 6 1 1 A 65 65 ASN N N 65 117.999 120.200 -2.201 1
1 699 . 6 1 1 A 66 66 GLU H H 66 8.538 8.583 -0.045 1
1 700 . 6 1 1 A 66 66 GLU HA H 66 4.634 4.772 -0.138 1
1 705 . 6 1 1 A 66 66 GLU C C 66 176.620 175.445 1.175 1
1 706 . 6 1 1 A 66 66 GLU CA C 66 55.863 54.980 0.883 1
1 707 . 6 1 1 A 66 66 GLU CB C 66 30.899 31.738 -0.839 1
1 709 . 6 1 1 A 66 66 GLU N N 66 122.233 121.770 0.463 1
1 710 . 6 1 1 A 67 67 VAL H H 67 8.452 8.847 -0.395 1
1 711 . 6 1 1 A 67 67 VAL HA H 67 4.172 4.238 -0.066 1
1 719 . 6 1 1 A 67 67 VAL C C 67 174.641 175.674 -1.033 1
1 720 . 6 1 1 A 67 67 VAL CA C 67 61.856 62.485 -0.629 1
1 721 . 6 1 1 A 67 67 VAL CB C 67 31.066 30.803 0.263 1
1 724 . 6 1 1 A 67 67 VAL N N 67 126.311 127.668 -1.357 1
1 725 . 6 1 1 A 68 68 LEU H H 68 9.000 8.846 0.154 1
1 726 . 6 1 1 A 68 68 LEU HA H 68 4.390 4.040 0.350 1
1 736 . 6 1 1 A 68 68 LEU C C 68 178.924 176.789 2.135 1
1 737 . 6 1 1 A 68 68 LEU CA C 68 56.990 56.965 0.025 1
1 738 . 6 1 1 A 68 68 LEU CB C 68 42.392 42.241 0.151 1
1 742 . 6 1 1 A 68 68 LEU N N 68 127.175 130.091 -2.916 1
1 743 . 6 1 1 A 69 69 SER H H 69 7.666 7.807 -0.141 1
1 744 . 6 1 1 A 69 69 SER HA H 69 5.144 5.078 0.066 1
1 747 . 6 1 1 A 69 69 SER C C 69 172.722 172.310 0.412 1
1 748 . 6 1 1 A 69 69 SER CA C 69 57.606 57.301 0.305 1
1 749 . 6 1 1 A 69 69 SER CB C 69 64.511 66.620 -2.109 1
1 750 . 6 1 1 A 69 69 SER N N 69 110.346 108.949 1.397 1
1 751 . 6 1 1 A 70 70 ILE H H 70 7.965 8.730 -0.765 1
1 752 . 6 1 1 A 70 70 ILE HA H 70 4.548 4.571 -0.023 1
1 762 . 6 1 1 A 70 70 ILE C C 70 174.993 176.219 -1.226 1
1 763 . 6 1 1 A 70 70 ILE CA C 70 60.897 60.294 0.603 1
1 764 . 6 1 1 A 70 70 ILE CB C 70 41.186 40.332 0.854 1
1 768 . 6 1 1 A 70 70 ILE N N 70 119.579 120.650 -1.071 1
1 769 . 6 1 1 A 71 71 ASN H H 71 9.839 10.260 -0.421 1
1 770 . 6 1 1 A 71 71 ASN HA H 71 4.485 4.389 0.096 1
1 775 . 6 1 1 A 71 71 ASN C C 71 174.975 174.795 0.180 1
1 776 . 6 1 1 A 71 71 ASN CA C 71 54.085 54.206 -0.121 1
1 777 . 6 1 1 A 71 71 ASN CB C 71 36.255 37.266 -1.011 1
1 778 . 6 1 1 A 71 71 ASN N N 71 126.963 125.110 1.853 1
1 780 . 6 1 1 A 72 72 GLY H H 72 8.911 8.413 0.498 1
1 781 . 6 1 1 A 72 72 GLY HA2 H 72 4.149 3.876 0.273 1
1 782 . 6 1 1 A 72 72 GLY HA3 H 72 3.507 3.877 -0.370 1
1 783 . 6 1 1 A 72 72 GLY C C 72 173.594 173.576 0.018 1
1 784 . 6 1 1 A 72 72 GLY CA C 72 45.162 45.273 -0.111 1
1 785 . 6 1 1 A 72 72 GLY N N 72 103.020 104.844 -1.824 1
1 786 . 6 1 1 A 73 73 LYS H H 73 7.922 7.700 0.222 1
1 787 . 6 1 1 A 73 73 LYS HA H 73 4.485 4.609 -0.124 1
1 796 . 6 1 1 A 73 73 LYS C C 73 175.036 175.508 -0.472 1
1 797 . 6 1 1 A 73 73 LYS CA C 73 54.719 55.050 -0.331 1
1 798 . 6 1 1 A 73 73 LYS CB C 73 32.137 33.760 -1.623 1
1 802 . 6 1 1 A 73 73 LYS N N 73 122.413 122.703 -0.290 1
1 803 . 6 1 1 A 74 74 SER H H 74 8.585 8.843 -0.258 1
1 804 . 6 1 1 A 74 74 SER HA H 74 4.452 4.726 -0.274 1
1 807 . 6 1 1 A 74 74 SER C C 74 175.965 174.028 1.937 1
1 808 . 6 1 1 A 74 74 SER CA C 74 58.028 57.949 0.079 1
1 809 . 6 1 1 A 74 74 SER CB C 74 63.799 64.358 -0.559 1
1 810 . 6 1 1 A 74 74 SER N N 74 118.737 122.796 -4.059 1
1 811 . 6 1 1 A 75 75 LEU H H 75 8.015 8.264 -0.249 1
1 812 . 6 1 1 A 75 75 LEU HA H 75 4.661 4.464 0.197 1
1 822 . 6 1 1 A 75 75 LEU C C 75 178.117 177.605 0.512 1
1 823 . 6 1 1 A 75 75 LEU CA C 75 53.980 54.578 -0.598 1
1 824 . 6 1 1 A 75 75 LEU CB C 75 40.830 41.141 -0.311 1
1 828 . 6 1 1 A 75 75 LEU N N 75 125.425 125.294 0.131 1
1 829 . 6 1 1 A 76 76 LYS H H 76 8.099 8.608 -0.509 1
1 830 . 6 1 1 A 76 76 LYS HA H 76 4.210 4.427 -0.217 1
1 839 . 6 1 1 A 76 76 LYS C C 76 178.487 176.762 1.725 1
1 840 . 6 1 1 A 76 76 LYS CA C 76 58.010 55.455 2.555 1
1 841 . 6 1 1 A 76 76 LYS CB C 76 31.683 31.660 0.023 1
1 845 . 6 1 1 A 76 76 LYS N N 76 124.064 120.011 4.053 1
1 846 . 6 1 1 A 77 77 GLY H H 77 8.859 7.846 1.013 1
1 847 . 6 1 1 A 77 77 GLY HA2 H 77 4.110 4.060 0.050 1
1 848 . 6 1 1 A 77 77 GLY HA3 H 77 3.869 4.063 -0.194 1
1 849 . 6 1 1 A 77 77 GLY C C 77 174.335 174.725 -0.390 1
1 850 . 6 1 1 A 77 77 GLY CA C 77 46.232 44.934 1.298 1
1 851 . 6 1 1 A 77 77 GLY N N 77 115.659 108.713 6.946 1
1 852 . 6 1 1 A 78 78 THR H H 78 7.654 7.713 -0.059 1
1 853 . 6 1 1 A 78 78 THR HA H 78 4.624 4.167 0.457 1
1 858 . 6 1 1 A 78 78 THR C C 78 177.272 174.924 2.348 1
1 859 . 6 1 1 A 78 78 THR CA C 78 61.794 63.242 -1.448 1
1 860 . 6 1 1 A 78 78 THR CB C 78 70.595 69.047 1.548 1
1 862 . 6 1 1 A 78 78 THR N N 78 112.847 116.539 -3.692 1
1 863 . 6 1 1 A 79 79 THR H H 79 8.813 8.651 0.162 1
1 864 . 6 1 1 A 79 79 THR HA H 79 4.395 4.617 -0.222 1
1 869 . 6 1 1 A 79 79 THR C C 79 174.503 175.477 -0.974 1
1 870 . 6 1 1 A 79 79 THR CA C 79 61.724 61.053 0.671 1
1 871 . 6 1 1 A 79 79 THR CB C 79 71.007 71.020 -0.013 1
1 873 . 6 1 1 A 79 79 THR N N 79 114.123 118.044 -3.921 1
1 874 . 6 1 1 A 80 80 HIS H H 80 10.266 9.071 1.195 1
1 875 . 6 1 1 A 80 80 HIS HA H 80 4.331 4.171 0.160 1
1 880 . 6 1 1 A 80 80 HIS C C 80 177.075 176.931 0.144 1
1 881 . 6 1 1 A 80 80 HIS CA C 80 61.338 59.681 1.657 1
1 882 . 6 1 1 A 80 80 HIS CB C 80 28.651 30.048 -1.397 1
1 885 . 6 1 1 A 80 80 HIS N N 80 122.776 121.218 1.558 1
1 886 . 6 1 1 A 81 81 HIS H H 81 9.335 8.037 1.298 1
1 887 . 6 1 1 A 81 81 HIS HA H 81 4.078 4.094 -0.016 1
1 892 . 6 1 1 A 81 81 HIS C C 81 178.269 176.592 1.677 1
1 893 . 6 1 1 A 81 81 HIS CA C 81 60.210 59.738 0.472 1
1 894 . 6 1 1 A 81 81 HIS CB C 81 29.569 30.070 -0.501 1
1 897 . 6 1 1 A 81 81 HIS N N 81 114.733 118.785 -4.052 1
1 898 . 6 1 1 A 82 82 ASP H H 82 7.741 8.202 -0.461 1
1 899 . 6 1 1 A 82 82 ASP HA H 82 4.452 4.172 0.280 1
1 902 . 6 1 1 A 82 82 ASP C C 82 178.683 178.700 -0.017 1
1 903 . 6 1 1 A 82 82 ASP CA C 82 57.148 57.457 -0.309 1
1 904 . 6 1 1 A 82 82 ASP CB C 82 39.522 40.388 -0.866 1
1 905 . 6 1 1 A 82 82 ASP N N 82 121.407 118.208 3.199 1
1 906 . 6 1 1 A 83 83 ALA H H 83 8.502 7.565 0.937 1
1 907 . 6 1 1 A 83 83 ALA HA H 83 3.939 4.157 -0.218 1
1 911 . 6 1 1 A 83 83 ALA C C 83 179.361 179.318 0.043 1
1 912 . 6 1 1 A 83 83 ALA CA C 83 55.635 54.941 0.694 1
1 913 . 6 1 1 A 83 83 ALA CB C 83 18.124 19.067 -0.943 1
1 914 . 6 1 1 A 83 83 ALA N N 83 125.049 122.736 2.313 1
1 915 . 6 1 1 A 84 84 LEU H H 84 8.100 8.410 -0.310 1
1 916 . 6 1 1 A 84 84 LEU HA H 84 3.792 3.830 -0.038 1
1 926 . 6 1 1 A 84 84 LEU C C 84 180.173 179.188 0.985 1
1 927 . 6 1 1 A 84 84 LEU CA C 84 57.932 57.993 -0.061 1
1 928 . 6 1 1 A 84 84 LEU CB C 84 41.157 41.548 -0.391 1
1 932 . 6 1 1 A 84 84 LEU N N 84 117.139 118.226 -1.087 1
1 933 . 6 1 1 A 85 85 ALA H H 85 7.715 8.884 -1.169 1
1 934 . 6 1 1 A 85 85 ALA HA H 85 4.061 4.152 -0.091 1
1 938 . 6 1 1 A 85 85 ALA C C 85 180.380 179.918 0.462 1
1 939 . 6 1 1 A 85 85 ALA CA C 85 55.212 55.369 -0.157 1
1 940 . 6 1 1 A 85 85 ALA CB C 85 17.803 18.475 -0.672 1
1 941 . 6 1 1 A 85 85 ALA N N 85 122.448 121.145 1.303 1
1 942 . 6 1 1 A 86 86 ILE H H 86 7.669 7.786 -0.117 1
1 943 . 6 1 1 A 86 86 ILE HA H 86 3.678 3.729 -0.051 1
1 953 . 6 1 1 A 86 86 ILE C C 86 178.692 178.664 0.028 1
1 954 . 6 1 1 A 86 86 ILE CA C 86 65.226 64.887 0.339 1
1 955 . 6 1 1 A 86 86 ILE CB C 86 38.099 37.739 0.360 1
1 959 . 6 1 1 A 86 86 ILE N N 86 121.804 117.894 3.910 1
1 960 . 6 1 1 A 87 87 LEU H H 87 7.922 8.493 -0.571 1
1 961 . 6 1 1 A 87 87 LEU HA H 87 3.903 4.015 -0.112 1
1 971 . 6 1 1 A 87 87 LEU C C 87 178.610 178.842 -0.232 1
1 972 . 6 1 1 A 87 87 LEU CA C 87 58.221 58.144 0.077 1
1 973 . 6 1 1 A 87 87 LEU CB C 87 42.344 41.485 0.859 1
1 977 . 6 1 1 A 87 87 LEU N N 87 121.947 121.260 0.687 1
1 978 . 6 1 1 A 88 88 ARG H H 88 8.317 8.392 -0.075 1
1 979 . 6 1 1 A 88 88 ARG HA H 88 4.060 4.175 -0.115 1
1 986 . 6 1 1 A 88 88 ARG C C 88 180.698 177.566 3.132 1
1 987 . 6 1 1 A 88 88 ARG CA C 88 59.383 58.783 0.600 1
1 988 . 6 1 1 A 88 88 ARG CB C 88 30.055 30.108 -0.053 1
1 991 . 6 1 1 A 88 88 ARG N N 88 119.343 119.697 -0.354 1
1 992 . 6 1 1 A 89 89 GLN H H 89 8.270 7.757 0.513 1
1 993 . 6 1 1 A 89 89 GLN HA H 89 4.122 4.159 -0.037 1
1 1000 . 6 1 1 A 89 89 GLN C C 89 177.955 177.679 0.276 1
1 1001 . 6 1 1 A 89 89 GLN CA C 89 58.714 58.203 0.511 1
1 1002 . 6 1 1 A 89 89 GLN CB C 89 28.160 28.414 -0.254 1
1 1004 . 6 1 1 A 89 89 GLN N N 89 121.097 117.501 3.596 1
1 1006 . 6 1 1 A 90 90 ALA H H 90 7.558 7.352 0.206 1
1 1007 . 6 1 1 A 90 90 ALA HA H 90 4.123 4.200 -0.077 1
1 1011 . 6 1 1 A 90 90 ALA C C 90 178.076 178.182 -0.106 1
1 1012 . 6 1 1 A 90 90 ALA CA C 90 52.942 53.648 -0.706 1
1 1013 . 6 1 1 A 90 90 ALA CB C 90 18.015 18.530 -0.515 1
1 1014 . 6 1 1 A 90 90 ALA N N 90 119.652 121.728 -2.076 1
1 1015 . 6 1 1 A 91 91 ARG H H 91 7.768 8.144 -0.376 1
1 1016 . 6 1 1 A 91 91 ARG HA H 91 4.065 4.266 -0.201 1
1 1022 . 6 1 1 A 91 91 ARG C C 91 177.858 177.386 0.472 1
1 1023 . 6 1 1 A 91 91 ARG CA C 91 58.573 57.401 1.172 1
1 1024 . 6 1 1 A 91 91 ARG CB C 91 30.384 30.727 -0.343 1
1 1027 . 6 1 1 A 91 91 ARG N N 91 118.081 117.893 0.188 1
1 1028 . 6 1 1 A 92 92 GLU H H 92 7.691 7.598 0.093 1
1 1029 . 6 1 1 A 92 92 GLU HA H 92 4.123 4.203 -0.080 1
1 1034 . 6 1 1 A 92 92 GLU C C 92 174.459 176.592 -2.133 1
1 1035 . 6 1 1 A 92 92 GLU CA C 92 61.565 60.588 0.977 1
1 1036 . 6 1 1 A 92 92 GLU CB C 92 27.583 29.442 -1.859 1
1 1038 . 6 1 1 A 92 92 GLU N N 92 118.447 118.260 0.187 1
1 1039 . 6 1 1 A 93 93 PRO HA H 93 4.716 4.566 0.150 1
1 1046 . 6 1 1 A 93 93 PRO C C 93 176.221 176.503 -0.282 1
1 1047 . 6 1 1 A 93 93 PRO CA C 93 63.149 62.536 0.613 1
1 1048 . 6 1 1 A 93 93 PRO CB C 93 32.571 33.102 -0.531 1
1 1051 . 6 1 1 A 94 94 ARG H H 94 8.434 8.996 -0.562 1
1 1052 . 6 1 1 A 94 94 ARG HA H 94 4.232 4.317 -0.085 1
1 1058 . 6 1 1 A 94 94 ARG C C 94 175.323 175.913 -0.590 1
1 1059 . 6 1 1 A 94 94 ARG CA C 94 56.972 56.900 0.072 1
1 1060 . 6 1 1 A 94 94 ARG CB C 94 30.448 30.974 -0.526 1
1 1063 . 6 1 1 A 94 94 ARG N N 94 115.987 118.998 -3.011 1
1 1064 . 6 1 1 A 95 95 GLN H H 95 7.246 7.581 -0.335 1
1 1065 . 6 1 1 A 95 95 GLN HA H 95 5.251 5.244 0.007 1
1 1072 . 6 1 1 A 95 95 GLN C C 95 174.786 173.613 1.173 1
1 1073 . 6 1 1 A 95 95 GLN CA C 95 54.209 54.627 -0.418 1
1 1074 . 6 1 1 A 95 95 GLN CB C 95 32.384 32.292 0.092 1
1 1076 . 6 1 1 A 95 95 GLN N N 95 115.998 119.819 -3.821 1
1 1078 . 6 1 1 A 96 96 ALA H H 96 8.739 8.084 0.655 1
1 1079 . 6 1 1 A 96 96 ALA HA H 96 5.412 5.156 0.256 1
1 1083 . 6 1 1 A 96 96 ALA C C 96 175.258 175.785 -0.527 1
1 1084 . 6 1 1 A 96 96 ALA CA C 96 50.355 51.254 -0.899 1
1 1085 . 6 1 1 A 96 96 ALA CB C 96 24.270 22.562 1.708 1
1 1086 . 6 1 1 A 96 96 ALA N N 96 126.197 125.235 0.962 1
1 1087 . 6 1 1 A 97 97 VAL H H 97 8.568 8.975 -0.407 1
1 1088 . 6 1 1 A 97 97 VAL HA H 97 4.804 4.612 0.192 1
1 1096 . 6 1 1 A 97 97 VAL C C 97 175.982 175.230 0.752 1
1 1097 . 6 1 1 A 97 97 VAL CA C 97 61.442 61.641 -0.199 1
1 1098 . 6 1 1 A 97 97 VAL CB C 97 33.413 32.829 0.584 1
1 1101 . 6 1 1 A 97 97 VAL N N 97 120.702 122.867 -2.165 1
1 1102 . 6 1 1 A 98 98 ILE H H 98 9.753 8.607 1.146 1
1 1103 . 6 1 1 A 98 98 ILE HA H 98 4.826 4.914 -0.088 1
1 1113 . 6 1 1 A 98 98 ILE C C 98 174.292 174.599 -0.307 1
1 1114 . 6 1 1 A 98 98 ILE CA C 98 59.981 59.657 0.324 1
1 1115 . 6 1 1 A 98 98 ILE CB C 98 40.608 40.416 0.192 1
1 1119 . 6 1 1 A 98 98 ILE N N 98 131.738 128.112 3.626 1
1 1120 . 6 1 1 A 99 99 VAL H H 99 8.493 8.502 -0.009 1
1 1121 . 6 1 1 A 99 99 VAL HA H 99 5.201 4.698 0.503 1
1 1129 . 6 1 1 A 99 99 VAL C C 99 176.557 175.180 1.377 1
1 1130 . 6 1 1 A 99 99 VAL CA C 99 61.495 61.042 0.453 1
1 1131 . 6 1 1 A 99 99 VAL CB C 99 32.327 32.482 -0.155 1
1 1134 . 6 1 1 A 99 99 VAL N N 99 129.537 129.196 0.341 1
1 1135 . 6 1 1 A 100 100 THR H H 100 9.050 8.933 0.117 1
1 1136 . 6 1 1 A 100 100 THR HA H 100 5.606 5.539 0.067 1
1 1141 . 6 1 1 A 100 100 THR C C 100 172.815 172.630 0.185 1
1 1142 . 6 1 1 A 100 100 THR CA C 100 59.049 59.414 -0.365 1
1 1143 . 6 1 1 A 100 100 THR CB C 100 73.966 72.897 1.069 1
1 1145 . 6 1 1 A 100 100 THR N N 100 117.469 117.112 0.357 1
1 1146 . 6 1 1 A 101 101 ARG H H 101 8.773 8.711 0.062 1
1 1147 . 6 1 1 A 101 101 ARG HA H 101 4.989 4.989 0.000 1
1 1155 . 6 1 1 A 101 101 ARG C C 101 174.738 174.866 -0.128 1
1 1156 . 6 1 1 A 101 101 ARG CA C 101 54.825 54.189 0.636 1
1 1157 . 6 1 1 A 101 101 ARG CB C 101 34.636 34.066 0.570 1
1 1160 . 6 1 1 A 101 101 ARG N N 101 117.532 119.751 -2.219 1
1 1162 . 6 1 1 A 102 102 LYS H H 102 8.616 8.367 0.249 1
1 1163 . 6 1 1 A 102 102 LYS HA H 102 4.232 4.358 -0.126 1
1 1171 . 6 1 1 A 102 102 LYS C C 102 175.935 175.573 0.362 1
1 1172 . 6 1 1 A 102 102 LYS CA C 102 56.549 56.371 0.178 1
1 1173 . 6 1 1 A 102 102 LYS CB C 102 33.266 32.475 0.791 1
1 1177 . 6 1 1 A 102 102 LYS N N 102 126.899 121.673 5.226 1
1 1178 . 6 1 1 A 103 103 LEU H H 103 8.424 8.534 -0.110 1
1 1179 . 6 1 1 A 103 103 LEU HA H 103 4.540 4.680 -0.140 1
1 1189 . 6 1 1 A 103 103 LEU C C 103 176.956 176.768 0.188 1
1 1190 . 6 1 1 A 103 103 LEU CA C 103 54.755 53.692 1.063 1
1 1191 . 6 1 1 A 103 103 LEU CB C 103 42.929 43.287 -0.358 1
1 1195 . 6 1 1 A 103 103 LEU N N 103 126.246 126.704 -0.458 1
1 1196 . 6 1 1 A 104 104 THR H H 104 8.201 8.458 -0.257 1
1 1197 . 6 1 1 A 104 104 THR HA H 104 4.624 4.449 0.175 1
1 1202 . 6 1 1 A 104 104 THR C C 104 172.954 173.270 -0.316 1
1 1203 . 6 1 1 A 104 104 THR CA C 104 59.483 62.102 -2.619 1
1 1204 . 6 1 1 A 104 104 THR CB C 104 69.761 68.148 1.613 1
1 1206 . 6 1 1 A 104 104 THR N N 104 117.263 116.266 0.997 1
1 1207 . 6 1 1 A 105 105 PRO HA H 105 4.399 4.527 -0.128 1
1 1213 . 6 1 1 A 105 105 PRO CA C 105 63.495 62.191 1.304 1
1 1214 . 6 1 1 A 105 105 PRO CB C 105 32.096 32.767 -0.671 1
1 1217 . 6 1 1 A 106 106 GLU H H 106 8.519 8.690 -0.171 1
1 1218 . 6 1 1 A 106 106 GLU HA H 106 4.197 4.382 -0.185 1
1 1221 . 6 1 1 A 106 106 GLU C C 106 176.110 175.297 0.813 1
1 1222 . 6 1 1 A 106 106 GLU CA C 106 56.743 55.859 0.884 1
1 1223 . 6 1 1 A 106 106 GLU CB C 106 30.137 27.959 2.178 1
1 1225 . 6 1 1 A 106 106 GLU N N 106 120.609 120.940 -0.331 1
1 1226 . 6 1 1 A 107 107 ALA H H 107 8.241 8.546 -0.305 1
1 1227 . 6 1 1 A 107 107 ALA HA H 107 4.317 4.436 -0.119 1
1 1231 . 6 1 1 A 107 107 ALA C C 107 177.299 176.198 1.101 1
1 1232 . 6 1 1 A 107 107 ALA CA C 107 52.203 51.570 0.633 1
1 1233 . 6 1 1 A 107 107 ALA CB C 107 19.392 18.441 0.951 1
1 1234 . 6 1 1 A 107 107 ALA N N 107 124.849 127.383 -2.534 1
1 1235 . 6 1 1 A 108 108 MET H H 108 8.284 8.397 -0.113 1
1 1236 . 6 1 1 A 108 108 MET HA H 108 4.792 5.145 -0.353 1
1 1244 . 6 1 1 A 108 108 MET C C 108 174.337 173.959 0.378 1
1 1245 . 6 1 1 A 108 108 MET CA C 108 53.258 52.516 0.742 1
1 1246 . 6 1 1 A 108 108 MET CB C 108 32.608 33.276 -0.668 1
1 1249 . 6 1 1 A 108 108 MET N N 108 121.025 123.941 -2.916 1
1 1250 . 6 1 1 A 109 109 PRO HA H 109 4.408 4.753 -0.345 1
1 1256 . 6 1 1 A 109 109 PRO C C 109 176.412 176.411 0.001 1
1 1257 . 6 1 1 A 109 109 PRO CA C 109 63.290 62.551 0.739 1
1 1258 . 6 1 1 A 109 109 PRO CB C 109 32.077 31.729 0.348 1
1 1261 . 6 1 1 A 110 110 ASP H H 110 8.417 8.613 -0.196 1
1 1262 . 6 1 1 A 110 110 ASP HA H 110 4.573 4.695 -0.122 1
1 1265 . 6 1 1 A 110 110 ASP C C 110 176.508 176.502 0.006 1
1 1266 . 6 1 1 A 110 110 ASP CA C 110 54.085 54.423 -0.338 1
1 1267 . 6 1 1 A 110 110 ASP CB C 110 41.075 41.691 -0.616 1
1 1268 . 6 1 1 A 110 110 ASP N N 110 120.239 122.762 -2.523 1
1 1269 . 6 1 1 A 111 111 LEU H H 111 8.279 8.618 -0.339 1
1 1270 . 6 1 1 A 111 111 LEU HA H 111 4.319 3.948 0.371 1
1 1280 . 6 1 1 A 111 111 LEU C C 111 177.551 176.968 0.583 1
1 1281 . 6 1 1 A 111 111 LEU CA C 111 55.581 58.343 -2.762 1
1 1282 . 6 1 1 A 111 111 LEU CB C 111 42.360 41.830 0.530 1
1 1286 . 6 1 1 A 111 111 LEU N N 111 123.318 126.762 -3.444 1
1 1287 . 6 1 1 A 112 112 ASN H H 112 8.487 8.143 0.344 1
1 1288 . 6 1 1 A 112 112 ASN HA H 112 4.725 4.355 0.370 1
1 1293 . 6 1 1 A 112 112 ASN C C 112 175.454 174.540 0.914 1
1 1294 . 6 1 1 A 112 112 ASN CA C 112 53.610 53.946 -0.336 1
1 1295 . 6 1 1 A 112 112 ASN CB C 112 39.116 36.948 2.168 1
1 1296 . 6 1 1 A 112 112 ASN N N 112 118.752 117.672 1.080 1
1 1298 . 6 1 1 A 115 115 GLY H H 115 8.205 9.064 -0.859 1
1 1299 . 6 1 1 A 115 115 GLY HA2 H 115 4.126 4.062 0.064 1
1 1300 . 6 1 1 A 115 115 GLY HA3 H 115 4.126 4.062 0.064 1
1 1301 . 6 1 1 A 115 115 GLY CA C 115 44.727 44.389 0.338 1
1 1302 . 6 1 1 A 116 116 PRO HA H 116 4.485 4.799 -0.314 1
1 1309 . 6 1 1 A 116 116 PRO CA C 116 63.298 62.682 0.616 1
1 1310 . 6 1 1 A 116 116 PRO CB C 116 32.077 32.954 -0.877 1
1 1313 . 6 1 1 A 117 117 SER H H 117 8.532 8.536 -0.004 1
1 1 . 7 1 1 A 7 7 GLY HA2 H 7 3.960 4.090 -0.130 1
1 2 . 7 1 1 A 7 7 GLY HA3 H 7 3.960 4.090 -0.130 1
1 3 . 7 1 1 A 7 7 GLY C C 7 174.009 172.954 1.055 1
1 4 . 7 1 1 A 7 7 GLY CA C 7 45.374 45.353 0.021 1
1 5 . 7 1 1 A 8 8 ALA H H 8 8.163 8.325 -0.162 1
1 6 . 7 1 1 A 8 8 ALA HA H 8 4.381 4.977 -0.596 1
1 10 . 7 1 1 A 8 8 ALA C C 8 178.078 175.603 2.475 1
1 11 . 7 1 1 A 8 8 ALA CA C 8 52.677 50.481 2.196 1
1 12 . 7 1 1 A 8 8 ALA CB C 8 19.368 22.557 -3.189 1
1 13 . 7 1 1 A 8 8 ALA N N 8 123.721 125.839 -2.118 1
1 14 . 7 1 1 A 9 9 THR H H 9 8.142 8.363 -0.221 1
1 15 . 7 1 1 A 9 9 THR HA H 9 4.353 4.938 -0.585 1
1 20 . 7 1 1 A 9 9 THR C C 9 174.597 173.893 0.704 1
1 21 . 7 1 1 A 9 9 THR CA C 9 62.093 62.008 0.085 1
1 22 . 7 1 1 A 9 9 THR CB C 9 69.948 69.565 0.383 1
1 24 . 7 1 1 A 9 9 THR N N 9 113.761 114.666 -0.905 1
1 25 . 7 1 1 A 10 10 LEU H H 10 8.218 8.740 -0.522 1
1 26 . 7 1 1 A 10 10 LEU HA H 10 4.169 4.803 -0.634 1
1 36 . 7 1 1 A 10 10 LEU C C 10 176.110 176.235 -0.125 1
1 37 . 7 1 1 A 10 10 LEU CA C 10 61.099 53.108 7.991 1
1 38 . 7 1 1 A 10 10 LEU CB C 10 38.686 45.013 -6.327 1
1 42 . 7 1 1 A 10 10 LEU N N 10 123.516 127.116 -3.600 1
1 43 . 7 1 1 A 11 11 LYS H H 11 8.496 8.734 -0.238 1
1 44 . 7 1 1 A 11 11 LYS HA H 11 4.891 4.147 0.744 1
1 49 . 7 1 1 A 11 11 LYS C C 11 175.794 176.270 -0.476 1
1 50 . 7 1 1 A 11 11 LYS CA C 11 55.652 57.235 -1.583 1
1 51 . 7 1 1 A 11 11 LYS CB C 11 29.444 31.234 -1.790 1
1 52 . 7 1 1 A 11 11 LYS N N 11 125.141 117.016 8.125 1
1 53 . 7 1 1 A 12 12 GLN HA H 12 4.315 4.330 -0.015 1
1 54 . 7 1 1 A 12 12 GLN C C 12 176.300 175.959 0.341 1
1 55 . 7 1 1 A 12 12 GLN CA C 12 56.286 58.088 -1.802 1
1 56 . 7 1 1 A 12 12 GLN CB C 12 32.901 30.123 2.778 1
1 57 . 7 1 1 A 13 13 LEU H H 13 8.410 7.994 0.416 1
1 58 . 7 1 1 A 13 13 LEU HA H 13 4.348 3.972 0.376 1
1 67 . 7 1 1 A 13 13 LEU C C 13 177.120 175.624 1.496 1
1 68 . 7 1 1 A 13 13 LEU CA C 13 55.142 55.712 -0.570 1
1 69 . 7 1 1 A 13 13 LEU CB C 13 42.352 41.073 1.279 1
1 73 . 7 1 1 A 13 13 LEU N N 13 124.340 119.553 4.787 1
1 74 . 7 1 1 A 14 14 ASP H H 14 8.250 8.565 -0.315 1
1 75 . 7 1 1 A 14 14 ASP HA H 14 4.540 4.590 -0.050 1
1 78 . 7 1 1 A 14 14 ASP C C 14 176.769 175.867 0.902 1
1 79 . 7 1 1 A 14 14 ASP CA C 14 54.772 55.761 -0.989 1
1 80 . 7 1 1 A 14 14 ASP CB C 14 41.322 40.085 1.237 1
1 81 . 7 1 1 A 14 14 ASP N N 14 120.493 124.860 -4.367 1
1 82 . 7 1 1 A 15 15 GLY H H 15 8.428 8.813 -0.385 1
1 83 . 7 1 1 A 15 15 GLY HA2 H 15 4.089 3.972 0.117 1
1 84 . 7 1 1 A 15 15 GLY HA3 H 15 3.874 3.977 -0.103 1
1 85 . 7 1 1 A 15 15 GLY C C 15 174.122 173.336 0.786 1
1 86 . 7 1 1 A 15 15 GLY CA C 15 45.972 46.355 -0.383 1
1 87 . 7 1 1 A 15 15 GLY N N 15 108.670 109.324 -0.654 1
1 88 . 7 1 1 A 16 16 ILE H H 16 7.727 7.428 0.299 1
1 89 . 7 1 1 A 16 16 ILE HA H 16 4.705 4.921 -0.216 1
1 99 . 7 1 1 A 16 16 ILE C C 16 175.807 174.759 1.048 1
1 100 . 7 1 1 A 16 16 ILE CA C 16 60.703 59.611 1.092 1
1 101 . 7 1 1 A 16 16 ILE CB C 16 38.509 40.462 -1.953 1
1 105 . 7 1 1 A 16 16 ILE N N 16 120.267 120.341 -0.074 1
1 106 . 7 1 1 A 17 17 HIS H H 17 9.101 8.342 0.759 1
1 107 . 7 1 1 A 17 17 HIS HA H 17 4.782 5.222 -0.440 1
1 112 . 7 1 1 A 17 17 HIS C C 17 173.051 173.609 -0.558 1
1 113 . 7 1 1 A 17 17 HIS CA C 17 55.353 54.328 1.025 1
1 114 . 7 1 1 A 17 17 HIS CB C 17 32.468 32.870 -0.402 1
1 117 . 7 1 1 A 17 17 HIS N N 17 125.061 126.945 -1.884 1
1 118 . 7 1 1 A 18 18 VAL H H 18 8.427 8.444 -0.017 1
1 119 . 7 1 1 A 18 18 VAL HA H 18 4.375 4.054 0.321 1
1 127 . 7 1 1 A 18 18 VAL C C 18 174.702 174.200 0.502 1
1 128 . 7 1 1 A 18 18 VAL CA C 18 62.035 62.170 -0.135 1
1 129 . 7 1 1 A 18 18 VAL CB C 18 32.325 32.380 -0.055 1
1 132 . 7 1 1 A 18 18 VAL N N 18 127.069 127.278 -0.209 1
1 133 . 7 1 1 A 19 19 THR H H 19 9.272 8.174 1.098 1
1 134 . 7 1 1 A 19 19 THR HA H 19 4.512 4.802 -0.290 1
1 139 . 7 1 1 A 19 19 THR C C 19 172.784 173.265 -0.481 1
1 140 . 7 1 1 A 19 19 THR CA C 19 62.512 61.844 0.668 1
1 141 . 7 1 1 A 19 19 THR CB C 19 70.663 70.159 0.504 1
1 143 . 7 1 1 A 19 19 THR N N 19 126.619 122.043 4.576 1
1 144 . 7 1 1 A 20 20 ILE H H 20 8.737 9.195 -0.458 1
1 145 . 7 1 1 A 20 20 ILE HA H 20 4.870 4.718 0.152 1
1 155 . 7 1 1 A 20 20 ILE C C 20 175.315 174.954 0.361 1
1 156 . 7 1 1 A 20 20 ILE CA C 20 60.157 59.827 0.330 1
1 157 . 7 1 1 A 20 20 ILE CB C 20 38.603 38.667 -0.064 1
1 161 . 7 1 1 A 20 20 ILE N N 20 128.114 128.752 -0.638 1
1 162 . 7 1 1 A 21 21 LEU H H 21 8.902 8.656 0.246 1
1 163 . 7 1 1 A 21 21 LEU HA H 21 4.804 4.888 -0.084 1
1 173 . 7 1 1 A 21 21 LEU C C 21 175.565 175.137 0.428 1
1 174 . 7 1 1 A 21 21 LEU CA C 21 52.731 52.966 -0.235 1
1 175 . 7 1 1 A 21 21 LEU CB C 21 43.947 43.746 0.201 1
1 179 . 7 1 1 A 21 21 LEU N N 21 125.457 128.437 -2.980 1
1 180 . 7 1 1 A 22 22 HIS H H 22 8.577 9.115 -0.538 1
1 181 . 7 1 1 A 22 22 HIS HA H 22 5.013 5.136 -0.123 1
1 186 . 7 1 1 A 22 22 HIS C C 22 174.258 175.127 -0.869 1
1 187 . 7 1 1 A 22 22 HIS CA C 22 55.880 55.104 0.776 1
1 188 . 7 1 1 A 22 22 HIS CB C 22 30.901 31.129 -0.228 1
1 191 . 7 1 1 A 22 22 HIS N N 22 122.595 123.392 -0.797 1
1 192 . 7 1 1 A 23 23 LYS H H 23 8.712 9.976 -1.264 1
1 193 . 7 1 1 A 23 23 LYS HA H 23 4.880 4.906 -0.026 1
1 202 . 7 1 1 A 23 23 LYS C C 23 174.265 175.404 -1.139 1
1 203 . 7 1 1 A 23 23 LYS CA C 23 54.314 54.289 0.025 1
1 204 . 7 1 1 A 23 23 LYS CB C 23 36.068 36.116 -0.048 1
1 208 . 7 1 1 A 23 23 LYS N N 23 120.814 121.067 -0.253 1
1 209 . 7 1 1 A 24 24 GLU H H 24 8.360 8.438 -0.078 1
1 210 . 7 1 1 A 24 24 GLU HA H 24 4.350 4.571 -0.221 1
1 215 . 7 1 1 A 24 24 GLU C C 24 177.843 176.932 0.911 1
1 216 . 7 1 1 A 24 24 GLU CA C 24 55.601 55.177 0.424 1
1 217 . 7 1 1 A 24 24 GLU CB C 24 30.512 31.226 -0.714 1
1 219 . 7 1 1 A 24 24 GLU N N 24 117.859 119.489 -1.630 1
1 220 . 7 1 1 A 25 25 GLU H H 25 9.146 8.836 0.310 1
1 221 . 7 1 1 A 25 25 GLU HA H 25 3.924 4.074 -0.150 1
1 226 . 7 1 1 A 25 25 GLU C C 25 177.809 177.611 0.198 1
1 227 . 7 1 1 A 25 25 GLU CA C 25 58.568 58.749 -0.181 1
1 228 . 7 1 1 A 25 25 GLU CB C 25 29.313 29.077 0.236 1
1 230 . 7 1 1 A 25 25 GLU N N 25 124.543 121.879 2.664 1
1 231 . 7 1 1 A 26 26 GLY H H 26 8.242 8.677 -0.435 1
1 232 . 7 1 1 A 26 26 GLY HA2 H 26 4.287 4.052 0.235 1
1 233 . 7 1 1 A 26 26 GLY HA3 H 26 3.407 4.054 -0.647 1
1 234 . 7 1 1 A 26 26 GLY C C 26 174.234 175.147 -0.913 1
1 235 . 7 1 1 A 26 26 GLY CA C 26 46.113 46.082 0.031 1
1 236 . 7 1 1 A 26 26 GLY N N 26 115.394 114.124 1.270 1
1 237 . 7 1 1 A 27 27 ALA H H 27 7.432 8.211 -0.779 1
1 238 . 7 1 1 A 27 27 ALA HA H 27 4.402 4.283 0.119 1
1 242 . 7 1 1 A 27 27 ALA C C 27 178.138 178.221 -0.083 1
1 243 . 7 1 1 A 27 27 ALA CA C 27 52.273 52.889 -0.616 1
1 244 . 7 1 1 A 27 27 ALA CB C 27 20.214 19.726 0.488 1
1 245 . 7 1 1 A 27 27 ALA N N 27 122.323 122.444 -0.121 1
1 246 . 7 1 1 A 28 28 GLY H H 28 8.624 7.806 0.818 1
1 247 . 7 1 1 A 28 28 GLY HA2 H 28 4.134 4.059 0.075 1
1 248 . 7 1 1 A 28 28 GLY HA3 H 28 3.953 4.099 -0.146 1
1 249 . 7 1 1 A 28 28 GLY C C 28 174.069 174.789 -0.720 1
1 250 . 7 1 1 A 28 28 GLY CA C 28 44.546 44.550 -0.004 1
1 251 . 7 1 1 A 28 28 GLY N N 28 107.593 105.418 2.175 1
1 252 . 7 1 1 A 29 29 LEU H H 29 7.934 8.530 -0.596 1
1 253 . 7 1 1 A 29 29 LEU HA H 29 4.059 4.347 -0.288 1
1 263 . 7 1 1 A 29 29 LEU C C 29 177.548 176.934 0.614 1
1 264 . 7 1 1 A 29 29 LEU CA C 29 56.298 56.258 0.040 1
1 265 . 7 1 1 A 29 29 LEU CB C 29 41.940 42.806 -0.866 1
1 269 . 7 1 1 A 29 29 LEU N N 29 115.495 121.208 -5.713 1
1 270 . 7 1 1 A 30 30 GLY H H 30 8.669 7.960 0.709 1
1 271 . 7 1 1 A 30 30 GLY HA2 H 30 4.264 4.087 0.177 1
1 272 . 7 1 1 A 30 30 GLY HA3 H 30 4.001 4.175 -0.174 1
1 273 . 7 1 1 A 30 30 GLY C C 30 175.296 173.045 2.251 1
1 274 . 7 1 1 A 30 30 GLY CA C 30 46.368 44.967 1.401 1
1 275 . 7 1 1 A 30 30 GLY N N 30 103.121 106.248 -3.127 1
1 276 . 7 1 1 A 31 31 PHE H H 31 7.044 7.293 -0.249 1
1 277 . 7 1 1 A 31 31 PHE HA H 31 4.541 4.658 -0.117 1
1 285 . 7 1 1 A 31 31 PHE C C 31 171.141 172.734 -1.593 1
1 286 . 7 1 1 A 31 31 PHE CA C 31 55.704 55.190 0.514 1
1 287 . 7 1 1 A 31 31 PHE CB C 31 40.745 41.931 -1.186 1
1 293 . 7 1 1 A 31 31 PHE N N 31 115.404 114.937 0.467 1
1 294 . 7 1 1 A 32 32 SER H H 32 8.752 9.061 -0.309 1
1 295 . 7 1 1 A 32 32 SER HA H 32 4.990 5.085 -0.095 1
1 298 . 7 1 1 A 32 32 SER C C 32 175.049 173.096 1.953 1
1 299 . 7 1 1 A 32 32 SER CA C 32 55.001 55.744 -0.743 1
1 300 . 7 1 1 A 32 32 SER CB C 32 67.170 66.226 0.944 1
1 301 . 7 1 1 A 32 32 SER N N 32 113.639 114.408 -0.769 1
1 302 . 7 1 1 A 33 33 LEU H H 33 8.639 8.424 0.215 1
1 303 . 7 1 1 A 33 33 LEU HA H 33 5.573 5.245 0.328 1
1 313 . 7 1 1 A 33 33 LEU C C 33 175.827 175.765 0.062 1
1 314 . 7 1 1 A 33 33 LEU CA C 33 53.620 53.553 0.067 1
1 315 . 7 1 1 A 33 33 LEU CB C 33 45.399 44.914 0.485 1
1 319 . 7 1 1 A 33 33 LEU N N 33 118.936 123.138 -4.202 1
1 320 . 7 1 1 A 34 34 ALA H H 34 9.410 9.051 0.359 1
1 321 . 7 1 1 A 34 34 ALA HA H 34 4.749 5.106 -0.357 1
1 325 . 7 1 1 A 34 34 ALA C C 34 176.231 176.824 -0.593 1
1 326 . 7 1 1 A 34 34 ALA CA C 34 50.425 51.263 -0.838 1
1 327 . 7 1 1 A 34 34 ALA CB C 34 22.518 22.882 -0.364 1
1 328 . 7 1 1 A 34 34 ALA N N 34 124.395 122.085 2.310 1
1 329 . 7 1 1 A 35 35 GLY H H 35 8.130 8.581 -0.451 1
1 330 . 7 1 1 A 35 35 GLY HA2 H 35 4.712 4.095 0.617 1
1 331 . 7 1 1 A 35 35 GLY HA3 H 35 3.955 4.128 -0.173 1
1 332 . 7 1 1 A 35 35 GLY C C 35 174.750 173.005 1.745 1
1 333 . 7 1 1 A 35 35 GLY CA C 35 44.494 44.916 -0.422 1
1 334 . 7 1 1 A 35 35 GLY N N 35 103.650 107.606 -3.956 1
1 335 . 7 1 1 A 36 36 GLY H H 36 8.217 7.895 0.322 1
1 336 . 7 1 1 A 36 36 GLY HA2 H 36 4.494 4.333 0.161 1
1 337 . 7 1 1 A 36 36 GLY HA3 H 36 3.836 4.357 -0.521 1
1 338 . 7 1 1 A 36 36 GLY C C 36 174.410 174.115 0.295 1
1 339 . 7 1 1 A 36 36 GLY CA C 36 45.462 45.911 -0.449 1
1 340 . 7 1 1 A 36 36 GLY N N 36 122.114 108.562 13.552 1
1 341 . 7 1 1 A 37 37 ALA H H 37 8.963 8.961 0.002 1
1 342 . 7 1 1 A 37 37 ALA HA H 37 3.998 4.120 -0.122 1
1 346 . 7 1 1 A 37 37 ALA C C 37 176.935 179.277 -2.342 1
1 347 . 7 1 1 A 37 37 ALA CA C 37 55.308 54.490 0.818 1
1 348 . 7 1 1 A 37 37 ALA CB C 37 18.822 18.576 0.246 1
1 349 . 7 1 1 A 37 37 ALA N N 37 123.418 121.845 1.573 1
1 350 . 7 1 1 A 38 38 ASP H H 38 10.586 8.234 2.352 1
1 351 . 7 1 1 A 38 38 ASP HA H 38 4.485 4.452 0.033 1
1 354 . 7 1 1 A 38 38 ASP C C 38 175.309 176.462 -1.153 1
1 355 . 7 1 1 A 38 38 ASP CA C 38 52.730 56.321 -3.591 1
1 356 . 7 1 1 A 38 38 ASP CB C 38 38.689 40.892 -2.203 1
1 357 . 7 1 1 A 38 38 ASP N N 38 111.480 118.323 -6.843 1
1 358 . 7 1 1 A 39 39 LEU H H 39 7.789 7.644 0.145 1
1 359 . 7 1 1 A 39 39 LEU HA H 39 4.699 4.380 0.319 1
1 369 . 7 1 1 A 39 39 LEU C C 39 176.377 177.718 -1.341 1
1 370 . 7 1 1 A 39 39 LEU CA C 39 52.952 54.208 -1.256 1
1 371 . 7 1 1 A 39 39 LEU CB C 39 43.294 42.322 0.972 1
1 375 . 7 1 1 A 39 39 LEU N N 39 122.545 121.468 1.077 1
1 376 . 7 1 1 A 40 40 GLU H H 40 8.331 8.559 -0.228 1
1 377 . 7 1 1 A 40 40 GLU HA H 40 3.978 4.212 -0.234 1
1 382 . 7 1 1 A 40 40 GLU C C 40 176.887 176.820 0.067 1
1 383 . 7 1 1 A 40 40 GLU CA C 40 59.066 58.997 0.069 1
1 384 . 7 1 1 A 40 40 GLU CB C 40 29.523 30.276 -0.753 1
1 386 . 7 1 1 A 40 40 GLU N N 40 118.036 120.120 -2.084 1
1 387 . 7 1 1 A 41 41 ASN H H 41 7.890 8.058 -0.168 1
1 388 . 7 1 1 A 41 41 ASN HA H 41 4.820 4.834 -0.014 1
1 393 . 7 1 1 A 41 41 ASN CA C 41 52.316 52.444 -0.128 1
1 394 . 7 1 1 A 41 41 ASN CB C 41 37.409 37.917 -0.508 1
1 395 . 7 1 1 A 41 41 ASN N N 41 115.196 115.728 -0.532 1
1 397 . 7 1 1 A 42 42 LYS H H 42 7.943 8.545 -0.602 1
1 398 . 7 1 1 A 42 42 LYS HA H 42 4.328 4.254 0.074 1
1 407 . 7 1 1 A 42 42 LYS C C 42 177.081 177.298 -0.217 1
1 408 . 7 1 1 A 42 42 LYS CA C 42 56.567 59.407 -2.840 1
1 409 . 7 1 1 A 42 42 LYS CB C 42 33.120 32.513 0.607 1
1 413 . 7 1 1 A 42 42 LYS N N 42 120.612 123.478 -2.866 1
1 414 . 7 1 1 A 43 43 VAL H H 43 7.456 7.618 -0.162 1
1 415 . 7 1 1 A 43 43 VAL HA H 43 4.059 4.144 -0.085 1
1 423 . 7 1 1 A 43 43 VAL CA C 43 61.330 62.172 -0.842 1
1 424 . 7 1 1 A 43 43 VAL CB C 43 32.819 32.333 0.486 1
1 427 . 7 1 1 A 43 43 VAL N N 43 118.284 118.786 -0.502 1
1 428 . 7 1 1 A 44 44 ILE H H 44 8.481 8.531 -0.050 1
1 429 . 7 1 1 A 44 44 ILE HA H 44 4.913 4.531 0.382 1
1 439 . 7 1 1 A 44 44 ILE C C 44 176.719 175.744 0.975 1
1 440 . 7 1 1 A 44 44 ILE CA C 44 59.946 61.888 -1.942 1
1 441 . 7 1 1 A 44 44 ILE CB C 44 35.784 38.262 -2.478 1
1 445 . 7 1 1 A 44 44 ILE N N 44 127.089 129.304 -2.215 1
1 446 . 7 1 1 A 45 45 THR H H 45 8.906 9.544 -0.638 1
1 447 . 7 1 1 A 45 45 THR HA H 45 5.400 4.962 0.438 1
1 452 . 7 1 1 A 45 45 THR CA C 45 58.528 59.729 -1.201 1
1 453 . 7 1 1 A 45 45 THR CB C 45 73.760 72.379 1.381 1
1 455 . 7 1 1 A 45 45 THR N N 45 116.832 117.298 -0.466 1
1 456 . 7 1 1 A 46 46 VAL H H 46 8.336 8.934 -0.598 1
1 457 . 7 1 1 A 46 46 VAL HA H 46 4.059 4.229 -0.170 1
1 465 . 7 1 1 A 46 46 VAL C C 46 176.648 176.463 0.185 1
1 466 . 7 1 1 A 46 46 VAL CA C 46 63.058 63.063 -0.005 1
1 467 . 7 1 1 A 46 46 VAL CB C 46 31.601 30.965 0.636 1
1 470 . 7 1 1 A 46 46 VAL N N 46 118.542 122.137 -3.595 1
1 471 . 7 1 1 A 47 47 HIS H H 47 9.382 8.560 0.822 1
1 472 . 7 1 1 A 47 47 HIS HA H 47 4.628 4.242 0.386 1
1 477 . 7 1 1 A 47 47 HIS C C 47 174.339 174.106 0.233 1
1 478 . 7 1 1 A 47 47 HIS CA C 47 57.764 59.935 -2.171 1
1 479 . 7 1 1 A 47 47 HIS CB C 47 31.453 30.696 0.757 1
1 482 . 7 1 1 A 47 47 HIS N N 47 133.900 128.348 5.552 1
1 483 . 7 1 1 A 48 48 ARG H H 48 7.135 7.797 -0.662 1
1 484 . 7 1 1 A 48 48 ARG HA H 48 4.360 4.851 -0.491 1
1 491 . 7 1 1 A 48 48 ARG C C 48 173.877 174.675 -0.798 1
1 492 . 7 1 1 A 48 48 ARG CA C 48 54.385 55.056 -0.671 1
1 493 . 7 1 1 A 48 48 ARG CB C 48 33.996 34.522 -0.526 1
1 496 . 7 1 1 A 48 48 ARG N N 48 114.736 117.685 -2.949 1
1 497 . 7 1 1 A 49 49 VAL H H 49 8.690 8.877 -0.187 1
1 498 . 7 1 1 A 49 49 VAL HA H 49 4.015 4.453 -0.438 1
1 506 . 7 1 1 A 49 49 VAL C C 49 176.255 175.549 0.706 1
1 507 . 7 1 1 A 49 49 VAL CA C 49 61.882 61.526 0.356 1
1 508 . 7 1 1 A 49 49 VAL CB C 49 32.261 32.600 -0.339 1
1 511 . 7 1 1 A 49 49 VAL N N 49 122.844 122.557 0.287 1
1 512 . 7 1 1 A 50 50 PHE H H 50 7.866 8.789 -0.923 1
1 513 . 7 1 1 A 50 50 PHE HA H 50 4.866 4.515 0.351 1
1 521 . 7 1 1 A 50 50 PHE C C 50 174.847 176.333 -1.486 1
1 522 . 7 1 1 A 50 50 PHE CA C 50 54.596 57.516 -2.920 1
1 523 . 7 1 1 A 50 50 PHE CB C 50 36.558 38.975 -2.417 1
1 529 . 7 1 1 A 50 50 PHE N N 50 128.498 127.427 1.071 1
1 530 . 7 1 1 A 51 51 PRO HA H 51 4.386 4.556 -0.170 1
1 537 . 7 1 1 A 51 51 PRO C C 51 177.321 176.588 0.733 1
1 538 . 7 1 1 A 51 51 PRO CA C 51 64.381 64.541 -0.160 1
1 539 . 7 1 1 A 51 51 PRO CB C 51 31.773 32.206 -0.433 1
1 542 . 7 1 1 A 52 52 ASN H H 52 8.814 8.392 0.422 1
1 543 . 7 1 1 A 52 52 ASN HA H 52 4.496 5.094 -0.598 1
1 548 . 7 1 1 A 52 52 ASN C C 52 174.823 174.524 0.299 1
1 549 . 7 1 1 A 52 52 ASN CA C 52 54.719 52.120 2.599 1
1 550 . 7 1 1 A 52 52 ASN CB C 52 38.109 39.348 -1.239 1
1 551 . 7 1 1 A 52 52 ASN N N 52 116.145 113.469 2.676 1
1 553 . 7 1 1 A 53 53 GLY H H 53 7.730 8.241 -0.511 1
1 554 . 7 1 1 A 53 53 GLY HA2 H 53 4.430 4.282 0.148 1
1 555 . 7 1 1 A 53 53 GLY HA3 H 53 4.089 4.295 -0.206 1
1 556 . 7 1 1 A 53 53 GLY C C 53 174.810 174.048 0.762 1
1 557 . 7 1 1 A 53 53 GLY CA C 53 44.987 45.730 -0.743 1
1 558 . 7 1 1 A 53 53 GLY N N 53 106.196 109.970 -3.774 1
1 559 . 7 1 1 A 54 54 LEU H H 54 8.764 9.074 -0.310 1
1 560 . 7 1 1 A 54 54 LEU HA H 54 4.041 4.089 -0.048 1
1 570 . 7 1 1 A 54 54 LEU C C 54 179.712 178.778 0.934 1
1 571 . 7 1 1 A 54 54 LEU CA C 54 58.310 57.812 0.498 1
1 572 . 7 1 1 A 54 54 LEU CB C 54 42.390 41.992 0.398 1
1 576 . 7 1 1 A 54 54 LEU N N 54 118.836 119.601 -0.765 1
1 577 . 7 1 1 A 55 55 ALA H H 55 7.593 8.004 -0.411 1
1 578 . 7 1 1 A 55 55 ALA HA H 55 4.275 3.883 0.392 1
1 582 . 7 1 1 A 55 55 ALA C C 55 181.307 179.326 1.981 1
1 583 . 7 1 1 A 55 55 ALA CA C 55 54.825 54.825 0.000 1
1 584 . 7 1 1 A 55 55 ALA CB C 55 18.345 18.290 0.055 1
1 585 . 7 1 1 A 55 55 ALA N N 55 118.782 121.593 -2.811 1
1 586 . 7 1 1 A 56 56 SER H H 56 9.339 7.787 1.552 1
1 587 . 7 1 1 A 56 56 SER HA H 56 4.023 4.266 -0.243 1
1 589 . 7 1 1 A 56 56 SER C C 56 176.392 177.244 -0.852 1
1 590 . 7 1 1 A 56 56 SER CA C 56 60.984 61.371 -0.387 1
1 591 . 7 1 1 A 56 56 SER CB C 56 62.987 62.754 0.233 1
1 592 . 7 1 1 A 56 56 SER N N 56 117.631 113.336 4.295 1
1 593 . 7 1 1 A 57 57 GLN H H 57 7.942 7.563 0.379 1
1 594 . 7 1 1 A 57 57 GLN HA H 57 4.034 4.004 0.030 1
1 601 . 7 1 1 A 57 57 GLN C C 57 177.400 178.403 -1.003 1
1 602 . 7 1 1 A 57 57 GLN CA C 57 58.362 59.020 -0.658 1
1 603 . 7 1 1 A 57 57 GLN CB C 57 28.801 28.254 0.547 1
1 605 . 7 1 1 A 57 57 GLN N N 57 118.162 121.723 -3.561 1
1 607 . 7 1 1 A 58 58 GLU H H 58 7.683 8.580 -0.897 1
1 608 . 7 1 1 A 58 58 GLU HA H 58 4.163 4.147 0.016 1
1 613 . 7 1 1 A 58 58 GLU C C 58 179.248 176.645 2.603 1
1 614 . 7 1 1 A 58 58 GLU CA C 58 59.559 58.651 0.908 1
1 615 . 7 1 1 A 58 58 GLU CB C 58 29.317 29.798 -0.481 1
1 617 . 7 1 1 A 58 58 GLU N N 58 119.877 119.170 0.707 1
1 618 . 7 1 1 A 59 59 GLY H H 59 7.446 7.504 -0.058 1
1 619 . 7 1 1 A 59 59 GLY HA2 H 59 4.100 3.976 0.124 1
1 620 . 7 1 1 A 59 59 GLY HA3 H 59 3.770 3.983 -0.213 1
1 621 . 7 1 1 A 59 59 GLY C C 59 175.432 175.580 -0.148 1
1 622 . 7 1 1 A 59 59 GLY CA C 59 46.817 45.329 1.488 1
1 623 . 7 1 1 A 59 59 GLY N N 59 102.653 108.099 -5.446 1
1 624 . 7 1 1 A 60 60 THR H H 60 8.343 8.054 0.289 1
1 625 . 7 1 1 A 60 60 THR HA H 60 4.037 4.096 -0.059 1
1 630 . 7 1 1 A 60 60 THR C C 60 175.843 174.479 1.364 1
1 631 . 7 1 1 A 60 60 THR CA C 60 64.792 65.725 -0.933 1
1 632 . 7 1 1 A 60 60 THR CB C 60 69.325 69.145 0.180 1
1 634 . 7 1 1 A 60 60 THR N N 60 113.863 113.505 0.358 1
1 635 . 7 1 1 A 61 61 ILE H H 61 8.802 7.740 1.062 1
1 636 . 7 1 1 A 61 61 ILE HA H 61 3.631 4.109 -0.478 1
1 646 . 7 1 1 A 61 61 ILE C C 61 174.198 174.396 -0.198 1
1 647 . 7 1 1 A 61 61 ILE CA C 61 62.938 60.472 2.466 1
1 648 . 7 1 1 A 61 61 ILE CB C 61 37.225 36.690 0.535 1
1 652 . 7 1 1 A 61 61 ILE N N 61 126.153 119.521 6.632 1
1 653 . 7 1 1 A 62 62 GLN H H 62 7.124 9.575 -2.451 1
1 654 . 7 1 1 A 62 62 GLN HA H 62 4.500 4.718 -0.218 1
1 661 . 7 1 1 A 62 62 GLN C C 62 174.556 175.085 -0.529 1
1 662 . 7 1 1 A 62 62 GLN CA C 62 53.364 54.104 -0.740 1
1 663 . 7 1 1 A 62 62 GLN CB C 62 32.196 32.038 0.158 1
1 665 . 7 1 1 A 62 62 GLN N N 62 123.730 126.535 -2.805 1
1 667 . 7 1 1 A 63 63 LYS H H 63 8.399 8.626 -0.227 1
1 668 . 7 1 1 A 63 63 LYS HA H 63 3.464 4.205 -0.741 1
1 677 . 7 1 1 A 63 63 LYS CA C 63 57.905 58.385 -0.480 1
1 678 . 7 1 1 A 63 63 LYS CB C 63 32.260 32.034 0.226 1
1 682 . 7 1 1 A 63 63 LYS N N 63 121.381 124.828 -3.447 1
1 683 . 7 1 1 A 64 64 GLY H H 64 9.265 8.440 0.825 1
1 684 . 7 1 1 A 64 64 GLY HA2 H 64 4.415 4.036 0.379 1
1 685 . 7 1 1 A 64 64 GLY HA3 H 64 3.639 4.042 -0.403 1
1 686 . 7 1 1 A 64 64 GLY CA C 64 44.881 45.033 -0.152 1
1 687 . 7 1 1 A 64 64 GLY N N 64 113.750 115.018 -1.268 1
1 688 . 7 1 1 A 65 65 ASN H H 65 7.594 8.194 -0.600 1
1 689 . 7 1 1 A 65 65 ASN HA H 65 4.798 4.907 -0.109 1
1 694 . 7 1 1 A 65 65 ASN C C 65 175.042 173.869 1.173 1
1 695 . 7 1 1 A 65 65 ASN CA C 65 53.047 53.056 -0.009 1
1 696 . 7 1 1 A 65 65 ASN CB C 65 38.153 40.162 -2.009 1
1 697 . 7 1 1 A 65 65 ASN N N 65 117.999 119.441 -1.442 1
1 699 . 7 1 1 A 66 66 GLU H H 66 8.538 8.569 -0.031 1
1 700 . 7 1 1 A 66 66 GLU HA H 66 4.634 5.024 -0.390 1
1 705 . 7 1 1 A 66 66 GLU C C 66 176.620 175.275 1.345 1
1 706 . 7 1 1 A 66 66 GLU CA C 66 55.863 54.964 0.899 1
1 707 . 7 1 1 A 66 66 GLU CB C 66 30.899 32.868 -1.969 1
1 709 . 7 1 1 A 66 66 GLU N N 66 122.233 121.539 0.694 1
1 710 . 7 1 1 A 67 67 VAL H H 67 8.452 9.014 -0.562 1
1 711 . 7 1 1 A 67 67 VAL HA H 67 4.172 4.282 -0.110 1
1 719 . 7 1 1 A 67 67 VAL C C 67 174.641 175.566 -0.925 1
1 720 . 7 1 1 A 67 67 VAL CA C 67 61.856 62.464 -0.608 1
1 721 . 7 1 1 A 67 67 VAL CB C 67 31.066 32.089 -1.023 1
1 724 . 7 1 1 A 67 67 VAL N N 67 126.311 127.380 -1.069 1
1 725 . 7 1 1 A 68 68 LEU H H 68 9.000 8.973 0.027 1
1 726 . 7 1 1 A 68 68 LEU HA H 68 4.390 4.319 0.071 1
1 736 . 7 1 1 A 68 68 LEU C C 68 178.924 176.977 1.947 1
1 737 . 7 1 1 A 68 68 LEU CA C 68 56.990 56.046 0.944 1
1 738 . 7 1 1 A 68 68 LEU CB C 68 42.392 42.510 -0.118 1
1 742 . 7 1 1 A 68 68 LEU N N 68 127.175 129.306 -2.131 1
1 743 . 7 1 1 A 69 69 SER H H 69 7.666 7.794 -0.128 1
1 744 . 7 1 1 A 69 69 SER HA H 69 5.144 4.961 0.183 1
1 747 . 7 1 1 A 69 69 SER C C 69 172.722 172.316 0.406 1
1 748 . 7 1 1 A 69 69 SER CA C 69 57.606 57.364 0.242 1
1 749 . 7 1 1 A 69 69 SER CB C 69 64.511 66.275 -1.764 1
1 750 . 7 1 1 A 69 69 SER N N 69 110.346 109.095 1.251 1
1 751 . 7 1 1 A 70 70 ILE H H 70 7.965 8.444 -0.479 1
1 752 . 7 1 1 A 70 70 ILE HA H 70 4.548 4.838 -0.290 1
1 762 . 7 1 1 A 70 70 ILE C C 70 174.993 176.171 -1.178 1
1 763 . 7 1 1 A 70 70 ILE CA C 70 60.897 60.279 0.618 1
1 764 . 7 1 1 A 70 70 ILE CB C 70 41.186 40.439 0.747 1
1 768 . 7 1 1 A 70 70 ILE N N 70 119.579 120.966 -1.387 1
1 769 . 7 1 1 A 71 71 ASN H H 71 9.839 10.610 -0.771 1
1 770 . 7 1 1 A 71 71 ASN HA H 71 4.485 4.418 0.067 1
1 775 . 7 1 1 A 71 71 ASN C C 71 174.975 174.789 0.186 1
1 776 . 7 1 1 A 71 71 ASN CA C 71 54.085 54.373 -0.288 1
1 777 . 7 1 1 A 71 71 ASN CB C 71 36.255 37.428 -1.173 1
1 778 . 7 1 1 A 71 71 ASN N N 71 126.963 125.417 1.546 1
1 780 . 7 1 1 A 72 72 GLY H H 72 8.911 8.455 0.456 1
1 781 . 7 1 1 A 72 72 GLY HA2 H 72 4.149 3.959 0.190 1
1 782 . 7 1 1 A 72 72 GLY HA3 H 72 3.507 3.960 -0.453 1
1 783 . 7 1 1 A 72 72 GLY C C 72 173.594 173.671 -0.077 1
1 784 . 7 1 1 A 72 72 GLY CA C 72 45.162 45.207 -0.045 1
1 785 . 7 1 1 A 72 72 GLY N N 72 103.020 104.900 -1.880 1
1 786 . 7 1 1 A 73 73 LYS H H 73 7.922 7.579 0.343 1
1 787 . 7 1 1 A 73 73 LYS HA H 73 4.485 4.609 -0.124 1
1 796 . 7 1 1 A 73 73 LYS C C 73 175.036 175.452 -0.416 1
1 797 . 7 1 1 A 73 73 LYS CA C 73 54.719 55.111 -0.392 1
1 798 . 7 1 1 A 73 73 LYS CB C 73 32.137 33.958 -1.821 1
1 802 . 7 1 1 A 73 73 LYS N N 73 122.413 122.566 -0.153 1
1 803 . 7 1 1 A 74 74 SER H H 74 8.585 8.868 -0.283 1
1 804 . 7 1 1 A 74 74 SER HA H 74 4.452 4.653 -0.201 1
1 807 . 7 1 1 A 74 74 SER C C 74 175.965 174.180 1.785 1
1 808 . 7 1 1 A 74 74 SER CA C 74 58.028 58.532 -0.504 1
1 809 . 7 1 1 A 74 74 SER CB C 74 63.799 63.832 -0.033 1
1 810 . 7 1 1 A 74 74 SER N N 74 118.737 124.901 -6.164 1
1 811 . 7 1 1 A 75 75 LEU H H 75 8.015 8.273 -0.258 1
1 812 . 7 1 1 A 75 75 LEU HA H 75 4.661 4.480 0.181 1
1 822 . 7 1 1 A 75 75 LEU C C 75 178.117 177.634 0.483 1
1 823 . 7 1 1 A 75 75 LEU CA C 75 53.980 54.586 -0.606 1
1 824 . 7 1 1 A 75 75 LEU CB C 75 40.830 41.070 -0.240 1
1 828 . 7 1 1 A 75 75 LEU N N 75 125.425 125.601 -0.176 1
1 829 . 7 1 1 A 76 76 LYS H H 76 8.099 8.598 -0.499 1
1 830 . 7 1 1 A 76 76 LYS HA H 76 4.210 4.433 -0.223 1
1 839 . 7 1 1 A 76 76 LYS C C 76 178.487 176.828 1.659 1
1 840 . 7 1 1 A 76 76 LYS CA C 76 58.010 55.458 2.552 1
1 841 . 7 1 1 A 76 76 LYS CB C 76 31.683 31.683 0.000 1
1 845 . 7 1 1 A 76 76 LYS N N 76 124.064 120.024 4.040 1
1 846 . 7 1 1 A 77 77 GLY H H 77 8.859 7.858 1.001 1
1 847 . 7 1 1 A 77 77 GLY HA2 H 77 4.110 4.040 0.070 1
1 848 . 7 1 1 A 77 77 GLY HA3 H 77 3.869 4.043 -0.174 1
1 849 . 7 1 1 A 77 77 GLY C C 77 174.335 174.788 -0.453 1
1 850 . 7 1 1 A 77 77 GLY CA C 77 46.232 45.042 1.190 1
1 851 . 7 1 1 A 77 77 GLY N N 77 115.659 108.710 6.949 1
1 852 . 7 1 1 A 78 78 THR H H 78 7.654 7.713 -0.059 1
1 853 . 7 1 1 A 78 78 THR HA H 78 4.624 4.128 0.496 1
1 858 . 7 1 1 A 78 78 THR C C 78 177.272 174.808 2.464 1
1 859 . 7 1 1 A 78 78 THR CA C 78 61.794 63.227 -1.433 1
1 860 . 7 1 1 A 78 78 THR CB C 78 70.595 69.166 1.429 1
1 862 . 7 1 1 A 78 78 THR N N 78 112.847 116.586 -3.739 1
1 863 . 7 1 1 A 79 79 THR H H 79 8.813 8.139 0.674 1
1 864 . 7 1 1 A 79 79 THR HA H 79 4.395 4.666 -0.271 1
1 869 . 7 1 1 A 79 79 THR C C 79 174.503 175.442 -0.939 1
1 870 . 7 1 1 A 79 79 THR CA C 79 61.724 60.886 0.838 1
1 871 . 7 1 1 A 79 79 THR CB C 79 71.007 71.084 -0.077 1
1 873 . 7 1 1 A 79 79 THR N N 79 114.123 118.318 -4.195 1
1 874 . 7 1 1 A 80 80 HIS H H 80 10.266 9.233 1.033 1
1 875 . 7 1 1 A 80 80 HIS HA H 80 4.331 4.254 0.077 1
1 880 . 7 1 1 A 80 80 HIS C C 80 177.075 176.924 0.151 1
1 881 . 7 1 1 A 80 80 HIS CA C 80 61.338 60.084 1.254 1
1 882 . 7 1 1 A 80 80 HIS CB C 80 28.651 30.468 -1.817 1
1 885 . 7 1 1 A 80 80 HIS N N 80 122.776 122.219 0.557 1
1 886 . 7 1 1 A 81 81 HIS H H 81 9.335 8.074 1.261 1
1 887 . 7 1 1 A 81 81 HIS HA H 81 4.078 4.039 0.039 1
1 892 . 7 1 1 A 81 81 HIS C C 81 178.269 176.453 1.816 1
1 893 . 7 1 1 A 81 81 HIS CA C 81 60.210 59.778 0.432 1
1 894 . 7 1 1 A 81 81 HIS CB C 81 29.569 30.067 -0.498 1
1 897 . 7 1 1 A 81 81 HIS N N 81 114.733 118.884 -4.151 1
1 898 . 7 1 1 A 82 82 ASP H H 82 7.741 7.748 -0.007 1
1 899 . 7 1 1 A 82 82 ASP HA H 82 4.452 3.758 0.694 1
1 902 . 7 1 1 A 82 82 ASP C C 82 178.683 178.736 -0.053 1
1 903 . 7 1 1 A 82 82 ASP CA C 82 57.148 57.142 0.006 1
1 904 . 7 1 1 A 82 82 ASP CB C 82 39.522 40.121 -0.599 1
1 905 . 7 1 1 A 82 82 ASP N N 82 121.407 117.675 3.732 1
1 906 . 7 1 1 A 83 83 ALA H H 83 8.502 8.050 0.452 1
1 907 . 7 1 1 A 83 83 ALA HA H 83 3.939 4.005 -0.066 1
1 911 . 7 1 1 A 83 83 ALA C C 83 179.361 179.458 -0.097 1
1 912 . 7 1 1 A 83 83 ALA CA C 83 55.635 55.114 0.521 1
1 913 . 7 1 1 A 83 83 ALA CB C 83 18.124 18.778 -0.654 1
1 914 . 7 1 1 A 83 83 ALA N N 83 125.049 122.844 2.205 1
1 915 . 7 1 1 A 84 84 LEU H H 84 8.100 8.229 -0.129 1
1 916 . 7 1 1 A 84 84 LEU HA H 84 3.792 3.857 -0.065 1
1 926 . 7 1 1 A 84 84 LEU C C 84 180.173 179.147 1.026 1
1 927 . 7 1 1 A 84 84 LEU CA C 84 57.932 58.001 -0.069 1
1 928 . 7 1 1 A 84 84 LEU CB C 84 41.157 41.512 -0.355 1
1 932 . 7 1 1 A 84 84 LEU N N 84 117.139 118.165 -1.026 1
1 933 . 7 1 1 A 85 85 ALA H H 85 7.715 8.482 -0.767 1
1 934 . 7 1 1 A 85 85 ALA HA H 85 4.061 4.132 -0.071 1
1 938 . 7 1 1 A 85 85 ALA C C 85 180.380 179.612 0.768 1
1 939 . 7 1 1 A 85 85 ALA CA C 85 55.212 55.409 -0.197 1
1 940 . 7 1 1 A 85 85 ALA CB C 85 17.803 18.685 -0.882 1
1 941 . 7 1 1 A 85 85 ALA N N 85 122.448 121.446 1.002 1
1 942 . 7 1 1 A 86 86 ILE H H 86 7.669 8.025 -0.356 1
1 943 . 7 1 1 A 86 86 ILE HA H 86 3.678 3.708 -0.030 1
1 953 . 7 1 1 A 86 86 ILE C C 86 178.692 178.577 0.115 1
1 954 . 7 1 1 A 86 86 ILE CA C 86 65.226 64.797 0.429 1
1 955 . 7 1 1 A 86 86 ILE CB C 86 38.099 37.691 0.408 1
1 959 . 7 1 1 A 86 86 ILE N N 86 121.804 117.816 3.988 1
1 960 . 7 1 1 A 87 87 LEU H H 87 7.922 8.801 -0.879 1
1 961 . 7 1 1 A 87 87 LEU HA H 87 3.903 3.995 -0.092 1
1 971 . 7 1 1 A 87 87 LEU C C 87 178.610 178.801 -0.191 1
1 972 . 7 1 1 A 87 87 LEU CA C 87 58.221 58.183 0.038 1
1 973 . 7 1 1 A 87 87 LEU CB C 87 42.344 41.466 0.878 1
1 977 . 7 1 1 A 87 87 LEU N N 87 121.947 121.277 0.670 1
1 978 . 7 1 1 A 88 88 ARG H H 88 8.317 8.421 -0.104 1
1 979 . 7 1 1 A 88 88 ARG HA H 88 4.060 4.204 -0.144 1
1 986 . 7 1 1 A 88 88 ARG C C 88 180.698 177.456 3.242 1
1 987 . 7 1 1 A 88 88 ARG CA C 88 59.383 58.815 0.568 1
1 988 . 7 1 1 A 88 88 ARG CB C 88 30.055 30.077 -0.022 1
1 991 . 7 1 1 A 88 88 ARG N N 88 119.343 119.803 -0.460 1
1 992 . 7 1 1 A 89 89 GLN H H 89 8.270 7.753 0.517 1
1 993 . 7 1 1 A 89 89 GLN HA H 89 4.122 4.082 0.040 1
1 1000 . 7 1 1 A 89 89 GLN C C 89 177.955 177.477 0.478 1
1 1001 . 7 1 1 A 89 89 GLN CA C 89 58.714 58.118 0.596 1
1 1002 . 7 1 1 A 89 89 GLN CB C 89 28.160 28.442 -0.282 1
1 1004 . 7 1 1 A 89 89 GLN N N 89 121.097 117.478 3.619 1
1 1006 . 7 1 1 A 90 90 ALA H H 90 7.558 7.282 0.276 1
1 1007 . 7 1 1 A 90 90 ALA HA H 90 4.123 4.203 -0.080 1
1 1011 . 7 1 1 A 90 90 ALA C C 90 178.076 177.862 0.214 1
1 1012 . 7 1 1 A 90 90 ALA CA C 90 52.942 53.566 -0.624 1
1 1013 . 7 1 1 A 90 90 ALA CB C 90 18.015 18.714 -0.699 1
1 1014 . 7 1 1 A 90 90 ALA N N 90 119.652 121.636 -1.984 1
1 1015 . 7 1 1 A 91 91 ARG H H 91 7.768 7.682 0.086 1
1 1016 . 7 1 1 A 91 91 ARG HA H 91 4.065 4.395 -0.330 1
1 1022 . 7 1 1 A 91 91 ARG C C 91 177.858 178.258 -0.400 1
1 1023 . 7 1 1 A 91 91 ARG CA C 91 58.573 56.495 2.078 1
1 1024 . 7 1 1 A 91 91 ARG CB C 91 30.384 30.456 -0.072 1
1 1027 . 7 1 1 A 91 91 ARG N N 91 118.081 116.700 1.381 1
1 1028 . 7 1 1 A 92 92 GLU H H 92 7.691 7.995 -0.304 1
1 1029 . 7 1 1 A 92 92 GLU HA H 92 4.123 4.088 0.035 1
1 1034 . 7 1 1 A 92 92 GLU C C 92 174.459 177.006 -2.547 1
1 1035 . 7 1 1 A 92 92 GLU CA C 92 61.565 60.398 1.167 1
1 1036 . 7 1 1 A 92 92 GLU CB C 92 27.583 28.736 -1.153 1
1 1038 . 7 1 1 A 92 92 GLU N N 92 118.447 118.380 0.067 1
1 1039 . 7 1 1 A 93 93 PRO HA H 93 4.716 4.598 0.118 1
1 1046 . 7 1 1 A 93 93 PRO C C 93 176.221 176.304 -0.083 1
1 1047 . 7 1 1 A 93 93 PRO CA C 93 63.149 62.365 0.784 1
1 1048 . 7 1 1 A 93 93 PRO CB C 93 32.571 33.236 -0.665 1
1 1051 . 7 1 1 A 94 94 ARG H H 94 8.434 8.910 -0.476 1
1 1052 . 7 1 1 A 94 94 ARG HA H 94 4.232 4.553 -0.321 1
1 1058 . 7 1 1 A 94 94 ARG C C 94 175.323 175.838 -0.515 1
1 1059 . 7 1 1 A 94 94 ARG CA C 94 56.972 56.207 0.765 1
1 1060 . 7 1 1 A 94 94 ARG CB C 94 30.448 32.138 -1.690 1
1 1063 . 7 1 1 A 94 94 ARG N N 94 115.987 118.291 -2.304 1
1 1064 . 7 1 1 A 95 95 GLN H H 95 7.246 7.557 -0.311 1
1 1065 . 7 1 1 A 95 95 GLN HA H 95 5.251 5.262 -0.011 1
1 1072 . 7 1 1 A 95 95 GLN C C 95 174.786 173.688 1.098 1
1 1073 . 7 1 1 A 95 95 GLN CA C 95 54.209 54.399 -0.190 1
1 1074 . 7 1 1 A 95 95 GLN CB C 95 32.384 32.308 0.076 1
1 1076 . 7 1 1 A 95 95 GLN N N 95 115.998 120.117 -4.119 1
1 1078 . 7 1 1 A 96 96 ALA H H 96 8.739 8.427 0.312 1
1 1079 . 7 1 1 A 96 96 ALA HA H 96 5.412 5.146 0.266 1
1 1083 . 7 1 1 A 96 96 ALA C C 96 175.258 175.764 -0.506 1
1 1084 . 7 1 1 A 96 96 ALA CA C 96 50.355 50.948 -0.593 1
1 1085 . 7 1 1 A 96 96 ALA CB C 96 24.270 22.587 1.683 1
1 1086 . 7 1 1 A 96 96 ALA N N 96 126.197 126.090 0.107 1
1 1087 . 7 1 1 A 97 97 VAL H H 97 8.568 8.773 -0.205 1
1 1088 . 7 1 1 A 97 97 VAL HA H 97 4.804 4.711 0.093 1
1 1096 . 7 1 1 A 97 97 VAL C C 97 175.982 175.010 0.972 1
1 1097 . 7 1 1 A 97 97 VAL CA C 97 61.442 61.339 0.103 1
1 1098 . 7 1 1 A 97 97 VAL CB C 97 33.413 33.233 0.180 1
1 1101 . 7 1 1 A 97 97 VAL N N 97 120.702 122.741 -2.039 1
1 1102 . 7 1 1 A 98 98 ILE H H 98 9.753 8.634 1.119 1
1 1103 . 7 1 1 A 98 98 ILE HA H 98 4.826 5.000 -0.174 1
1 1113 . 7 1 1 A 98 98 ILE C C 98 174.292 174.552 -0.260 1
1 1114 . 7 1 1 A 98 98 ILE CA C 98 59.981 59.753 0.228 1
1 1115 . 7 1 1 A 98 98 ILE CB C 98 40.608 40.547 0.061 1
1 1119 . 7 1 1 A 98 98 ILE N N 98 131.738 127.759 3.979 1
1 1120 . 7 1 1 A 99 99 VAL H H 99 8.493 8.587 -0.094 1
1 1121 . 7 1 1 A 99 99 VAL HA H 99 5.201 4.815 0.386 1
1 1129 . 7 1 1 A 99 99 VAL C C 99 176.557 175.292 1.265 1
1 1130 . 7 1 1 A 99 99 VAL CA C 99 61.495 60.899 0.596 1
1 1131 . 7 1 1 A 99 99 VAL CB C 99 32.327 32.691 -0.364 1
1 1134 . 7 1 1 A 99 99 VAL N N 99 129.537 129.409 0.128 1
1 1135 . 7 1 1 A 100 100 THR H H 100 9.050 8.955 0.095 1
1 1136 . 7 1 1 A 100 100 THR HA H 100 5.606 5.236 0.370 1
1 1141 . 7 1 1 A 100 100 THR C C 100 172.815 173.312 -0.497 1
1 1142 . 7 1 1 A 100 100 THR CA C 100 59.049 59.312 -0.263 1
1 1143 . 7 1 1 A 100 100 THR CB C 100 73.966 72.024 1.942 1
1 1145 . 7 1 1 A 100 100 THR N N 100 117.469 117.115 0.354 1
1 1146 . 7 1 1 A 101 101 ARG H H 101 8.773 8.395 0.378 1
1 1147 . 7 1 1 A 101 101 ARG HA H 101 4.989 4.760 0.229 1
1 1155 . 7 1 1 A 101 101 ARG C C 101 174.738 176.494 -1.756 1
1 1156 . 7 1 1 A 101 101 ARG CA C 101 54.825 54.504 0.321 1
1 1157 . 7 1 1 A 101 101 ARG CB C 101 34.636 32.179 2.457 1
1 1160 . 7 1 1 A 101 101 ARG N N 101 117.532 121.198 -3.666 1
1 1162 . 7 1 1 A 102 102 LYS H H 102 8.616 8.069 0.547 1
1 1163 . 7 1 1 A 102 102 LYS HA H 102 4.232 4.506 -0.274 1
1 1171 . 7 1 1 A 102 102 LYS C C 102 175.935 175.325 0.610 1
1 1172 . 7 1 1 A 102 102 LYS CA C 102 56.549 56.311 0.238 1
1 1173 . 7 1 1 A 102 102 LYS CB C 102 33.266 32.825 0.441 1
1 1177 . 7 1 1 A 102 102 LYS N N 102 126.899 121.835 5.064 1
1 1178 . 7 1 1 A 103 103 LEU H H 103 8.424 9.029 -0.605 1
1 1179 . 7 1 1 A 103 103 LEU HA H 103 4.540 4.992 -0.452 1
1 1189 . 7 1 1 A 103 103 LEU C C 103 176.956 176.605 0.351 1
1 1190 . 7 1 1 A 103 103 LEU CA C 103 54.755 53.394 1.361 1
1 1191 . 7 1 1 A 103 103 LEU CB C 103 42.929 44.559 -1.630 1
1 1195 . 7 1 1 A 103 103 LEU N N 103 126.246 126.211 0.035 1
1 1196 . 7 1 1 A 104 104 THR H H 104 8.201 8.680 -0.479 1
1 1197 . 7 1 1 A 104 104 THR HA H 104 4.624 4.964 -0.340 1
1 1202 . 7 1 1 A 104 104 THR C C 104 172.954 173.596 -0.642 1
1 1203 . 7 1 1 A 104 104 THR CA C 104 59.483 59.130 0.353 1
1 1204 . 7 1 1 A 104 104 THR CB C 104 69.761 69.235 0.526 1
1 1206 . 7 1 1 A 104 104 THR N N 104 117.263 114.804 2.459 1
1 1207 . 7 1 1 A 105 105 PRO HA H 105 4.399 4.739 -0.340 1
1 1213 . 7 1 1 A 105 105 PRO CA C 105 63.495 62.402 1.093 1
1 1214 . 7 1 1 A 105 105 PRO CB C 105 32.096 33.369 -1.273 1
1 1217 . 7 1 1 A 106 106 GLU H H 106 8.519 8.696 -0.177 1
1 1218 . 7 1 1 A 106 106 GLU HA H 106 4.197 4.749 -0.552 1
1 1221 . 7 1 1 A 106 106 GLU C C 106 176.110 175.690 0.420 1
1 1222 . 7 1 1 A 106 106 GLU CA C 106 56.743 55.698 1.045 1
1 1223 . 7 1 1 A 106 106 GLU CB C 106 30.137 29.526 0.611 1
1 1225 . 7 1 1 A 106 106 GLU N N 106 120.609 115.907 4.702 1
1 1226 . 7 1 1 A 107 107 ALA H H 107 8.241 8.284 -0.043 1
1 1227 . 7 1 1 A 107 107 ALA HA H 107 4.317 5.134 -0.817 1
1 1231 . 7 1 1 A 107 107 ALA C C 107 177.299 175.415 1.884 1
1 1232 . 7 1 1 A 107 107 ALA CA C 107 52.203 50.187 2.016 1
1 1233 . 7 1 1 A 107 107 ALA CB C 107 19.392 23.700 -4.308 1
1 1234 . 7 1 1 A 107 107 ALA N N 107 124.849 122.430 2.419 1
1 1235 . 7 1 1 A 108 108 MET H H 108 8.284 8.721 -0.437 1
1 1236 . 7 1 1 A 108 108 MET HA H 108 4.792 5.090 -0.298 1
1 1244 . 7 1 1 A 108 108 MET C C 108 174.337 174.999 -0.662 1
1 1245 . 7 1 1 A 108 108 MET CA C 108 53.258 52.891 0.367 1
1 1246 . 7 1 1 A 108 108 MET CB C 108 32.608 33.689 -1.081 1
1 1249 . 7 1 1 A 108 108 MET N N 108 121.025 119.252 1.773 1
1 1250 . 7 1 1 A 109 109 PRO HA H 109 4.408 4.643 -0.235 1
1 1256 . 7 1 1 A 109 109 PRO C C 109 176.412 175.588 0.824 1
1 1257 . 7 1 1 A 109 109 PRO CA C 109 63.290 62.436 0.854 1
1 1258 . 7 1 1 A 109 109 PRO CB C 109 32.077 29.213 2.864 1
1 1261 . 7 1 1 A 110 110 ASP H H 110 8.417 8.408 0.009 1
1 1262 . 7 1 1 A 110 110 ASP HA H 110 4.573 4.792 -0.219 1
1 1265 . 7 1 1 A 110 110 ASP C C 110 176.508 175.980 0.528 1
1 1266 . 7 1 1 A 110 110 ASP CA C 110 54.085 54.014 0.071 1
1 1267 . 7 1 1 A 110 110 ASP CB C 110 41.075 41.573 -0.498 1
1 1268 . 7 1 1 A 110 110 ASP N N 110 120.239 122.627 -2.388 1
1 1269 . 7 1 1 A 111 111 LEU H H 111 8.279 8.639 -0.360 1
1 1270 . 7 1 1 A 111 111 LEU HA H 111 4.319 4.080 0.239 1
1 1280 . 7 1 1 A 111 111 LEU C C 111 177.551 176.516 1.035 1
1 1281 . 7 1 1 A 111 111 LEU CA C 111 55.581 58.054 -2.473 1
1 1282 . 7 1 1 A 111 111 LEU CB C 111 42.360 42.256 0.104 1
1 1286 . 7 1 1 A 111 111 LEU N N 111 123.318 125.945 -2.627 1
1 1287 . 7 1 1 A 112 112 ASN H H 112 8.487 7.928 0.559 1
1 1288 . 7 1 1 A 112 112 ASN HA H 112 4.725 5.071 -0.346 1
1 1293 . 7 1 1 A 112 112 ASN C C 112 175.454 175.271 0.183 1
1 1294 . 7 1 1 A 112 112 ASN CA C 112 53.610 52.395 1.215 1
1 1295 . 7 1 1 A 112 112 ASN CB C 112 39.116 40.495 -1.379 1
1 1296 . 7 1 1 A 112 112 ASN N N 112 118.752 115.954 2.798 1
1 1298 . 7 1 1 A 115 115 GLY H H 115 8.205 8.534 -0.329 1
1 1299 . 7 1 1 A 115 115 GLY HA2 H 115 4.126 4.250 -0.124 1
1 1300 . 7 1 1 A 115 115 GLY HA3 H 115 4.126 4.250 -0.124 1
1 1301 . 7 1 1 A 115 115 GLY CA C 115 44.727 45.849 -1.122 1
1 1302 . 7 1 1 A 116 116 PRO HA H 116 4.485 4.657 -0.172 1
1 1309 . 7 1 1 A 116 116 PRO CA C 116 63.298 62.444 0.854 1
1 1310 . 7 1 1 A 116 116 PRO CB C 116 32.077 33.313 -1.236 1
1 1313 . 7 1 1 A 117 117 SER H H 117 8.532 8.417 0.115 1
1 1 . 8 1 1 A 7 7 GLY HA2 H 7 3.960 4.148 -0.188 1
1 2 . 8 1 1 A 7 7 GLY HA3 H 7 3.960 4.148 -0.188 1
1 3 . 8 1 1 A 7 7 GLY C C 7 174.009 172.830 1.179 1
1 4 . 8 1 1 A 7 7 GLY CA C 7 45.374 43.910 1.464 1
1 5 . 8 1 1 A 8 8 ALA H H 8 8.163 8.554 -0.391 1
1 6 . 8 1 1 A 8 8 ALA HA H 8 4.381 4.720 -0.339 1
1 10 . 8 1 1 A 8 8 ALA C C 8 178.078 176.192 1.886 1
1 11 . 8 1 1 A 8 8 ALA CA C 8 52.677 52.014 0.663 1
1 12 . 8 1 1 A 8 8 ALA CB C 8 19.368 21.770 -2.402 1
1 13 . 8 1 1 A 8 8 ALA N N 8 123.721 122.176 1.545 1
1 14 . 8 1 1 A 9 9 THR H H 9 8.142 8.415 -0.273 1
1 15 . 8 1 1 A 9 9 THR HA H 9 4.353 4.206 0.147 1
1 20 . 8 1 1 A 9 9 THR C C 9 174.597 174.147 0.450 1
1 21 . 8 1 1 A 9 9 THR CA C 9 62.093 62.512 -0.419 1
1 22 . 8 1 1 A 9 9 THR CB C 9 69.948 68.080 1.868 1
1 24 . 8 1 1 A 9 9 THR N N 9 113.761 111.569 2.192 1
1 25 . 8 1 1 A 10 10 LEU H H 10 8.218 8.644 -0.426 1
1 26 . 8 1 1 A 10 10 LEU HA H 10 4.169 5.158 -0.989 1
1 36 . 8 1 1 A 10 10 LEU C C 10 176.110 175.713 0.397 1
1 37 . 8 1 1 A 10 10 LEU CA C 10 61.099 53.296 7.803 1
1 38 . 8 1 1 A 10 10 LEU CB C 10 38.686 44.057 -5.371 1
1 42 . 8 1 1 A 10 10 LEU N N 10 123.516 125.140 -1.624 1
1 43 . 8 1 1 A 11 11 LYS H H 11 8.496 8.878 -0.382 1
1 44 . 8 1 1 A 11 11 LYS HA H 11 4.891 4.511 0.380 1
1 49 . 8 1 1 A 11 11 LYS C C 11 175.794 177.703 -1.909 1
1 50 . 8 1 1 A 11 11 LYS CA C 11 55.652 57.628 -1.976 1
1 51 . 8 1 1 A 11 11 LYS CB C 11 29.444 34.891 -5.447 1
1 52 . 8 1 1 A 11 11 LYS N N 11 125.141 122.141 3.000 1
1 53 . 8 1 1 A 12 12 GLN HA H 12 4.315 4.427 -0.112 1
1 54 . 8 1 1 A 12 12 GLN C C 12 176.300 175.915 0.385 1
1 55 . 8 1 1 A 12 12 GLN CA C 12 56.286 56.790 -0.504 1
1 56 . 8 1 1 A 12 12 GLN CB C 12 32.901 31.669 1.232 1
1 57 . 8 1 1 A 13 13 LEU H H 13 8.410 7.520 0.890 1
1 58 . 8 1 1 A 13 13 LEU HA H 13 4.348 4.636 -0.288 1
1 67 . 8 1 1 A 13 13 LEU C C 13 177.120 175.322 1.798 1
1 68 . 8 1 1 A 13 13 LEU CA C 13 55.142 53.987 1.155 1
1 69 . 8 1 1 A 13 13 LEU CB C 13 42.352 41.971 0.381 1
1 73 . 8 1 1 A 13 13 LEU N N 13 124.340 120.238 4.102 1
1 74 . 8 1 1 A 14 14 ASP H H 14 8.250 8.785 -0.535 1
1 75 . 8 1 1 A 14 14 ASP HA H 14 4.540 4.772 -0.232 1
1 78 . 8 1 1 A 14 14 ASP C C 14 176.769 175.284 1.485 1
1 79 . 8 1 1 A 14 14 ASP CA C 14 54.772 53.524 1.248 1
1 80 . 8 1 1 A 14 14 ASP CB C 14 41.322 41.773 -0.451 1
1 81 . 8 1 1 A 14 14 ASP N N 14 120.493 125.657 -5.164 1
1 82 . 8 1 1 A 15 15 GLY H H 15 8.428 8.661 -0.233 1
1 83 . 8 1 1 A 15 15 GLY HA2 H 15 4.089 3.882 0.207 1
1 84 . 8 1 1 A 15 15 GLY HA3 H 15 3.874 3.913 -0.039 1
1 85 . 8 1 1 A 15 15 GLY C C 15 174.122 173.914 0.208 1
1 86 . 8 1 1 A 15 15 GLY CA C 15 45.972 46.005 -0.033 1
1 87 . 8 1 1 A 15 15 GLY N N 15 108.670 113.445 -4.775 1
1 88 . 8 1 1 A 16 16 ILE H H 16 7.727 7.747 -0.020 1
1 89 . 8 1 1 A 16 16 ILE HA H 16 4.705 4.124 0.581 1
1 99 . 8 1 1 A 16 16 ILE C C 16 175.807 174.856 0.951 1
1 100 . 8 1 1 A 16 16 ILE CA C 16 60.703 60.224 0.479 1
1 101 . 8 1 1 A 16 16 ILE CB C 16 38.509 39.807 -1.298 1
1 105 . 8 1 1 A 16 16 ILE N N 16 120.267 121.906 -1.639 1
1 106 . 8 1 1 A 17 17 HIS H H 17 9.101 8.106 0.995 1
1 107 . 8 1 1 A 17 17 HIS HA H 17 4.782 5.602 -0.820 1
1 112 . 8 1 1 A 17 17 HIS C C 17 173.051 174.132 -1.081 1
1 113 . 8 1 1 A 17 17 HIS CA C 17 55.353 53.632 1.721 1
1 114 . 8 1 1 A 17 17 HIS CB C 17 32.468 31.992 0.476 1
1 117 . 8 1 1 A 17 17 HIS N N 17 125.061 123.466 1.595 1
1 118 . 8 1 1 A 18 18 VAL H H 18 8.427 8.933 -0.506 1
1 119 . 8 1 1 A 18 18 VAL HA H 18 4.375 4.188 0.187 1
1 127 . 8 1 1 A 18 18 VAL C C 18 174.702 175.475 -0.773 1
1 128 . 8 1 1 A 18 18 VAL CA C 18 62.035 62.529 -0.494 1
1 129 . 8 1 1 A 18 18 VAL CB C 18 32.325 32.271 0.054 1
1 132 . 8 1 1 A 18 18 VAL N N 18 127.069 125.212 1.857 1
1 133 . 8 1 1 A 19 19 THR H H 19 9.272 8.220 1.052 1
1 134 . 8 1 1 A 19 19 THR HA H 19 4.512 4.866 -0.354 1
1 139 . 8 1 1 A 19 19 THR C C 19 172.784 173.277 -0.493 1
1 140 . 8 1 1 A 19 19 THR CA C 19 62.512 61.529 0.983 1
1 141 . 8 1 1 A 19 19 THR CB C 19 70.663 70.913 -0.250 1
1 143 . 8 1 1 A 19 19 THR N N 19 126.619 120.947 5.672 1
1 144 . 8 1 1 A 20 20 ILE H H 20 8.737 9.064 -0.327 1
1 145 . 8 1 1 A 20 20 ILE HA H 20 4.870 4.506 0.364 1
1 155 . 8 1 1 A 20 20 ILE C C 20 175.315 175.065 0.250 1
1 156 . 8 1 1 A 20 20 ILE CA C 20 60.157 60.434 -0.277 1
1 157 . 8 1 1 A 20 20 ILE CB C 20 38.603 37.717 0.886 1
1 161 . 8 1 1 A 20 20 ILE N N 20 128.114 128.240 -0.126 1
1 162 . 8 1 1 A 21 21 LEU H H 21 8.902 9.092 -0.190 1
1 163 . 8 1 1 A 21 21 LEU HA H 21 4.804 4.977 -0.173 1
1 173 . 8 1 1 A 21 21 LEU C C 21 175.565 175.347 0.218 1
1 174 . 8 1 1 A 21 21 LEU CA C 21 52.731 53.408 -0.677 1
1 175 . 8 1 1 A 21 21 LEU CB C 21 43.947 42.922 1.025 1
1 179 . 8 1 1 A 21 21 LEU N N 21 125.457 128.841 -3.384 1
1 180 . 8 1 1 A 22 22 HIS H H 22 8.577 9.035 -0.458 1
1 181 . 8 1 1 A 22 22 HIS HA H 22 5.013 5.170 -0.157 1
1 186 . 8 1 1 A 22 22 HIS C C 22 174.258 175.115 -0.857 1
1 187 . 8 1 1 A 22 22 HIS CA C 22 55.880 54.697 1.183 1
1 188 . 8 1 1 A 22 22 HIS CB C 22 30.901 31.025 -0.124 1
1 191 . 8 1 1 A 22 22 HIS N N 22 122.595 124.219 -1.624 1
1 192 . 8 1 1 A 23 23 LYS H H 23 8.712 10.192 -1.480 1
1 193 . 8 1 1 A 23 23 LYS HA H 23 4.880 5.038 -0.158 1
1 202 . 8 1 1 A 23 23 LYS C C 23 174.265 175.325 -1.060 1
1 203 . 8 1 1 A 23 23 LYS CA C 23 54.314 54.137 0.177 1
1 204 . 8 1 1 A 23 23 LYS CB C 23 36.068 36.386 -0.318 1
1 208 . 8 1 1 A 23 23 LYS N N 23 120.814 121.255 -0.441 1
1 209 . 8 1 1 A 24 24 GLU H H 24 8.360 8.465 -0.105 1
1 210 . 8 1 1 A 24 24 GLU HA H 24 4.350 4.650 -0.300 1
1 215 . 8 1 1 A 24 24 GLU C C 24 177.843 176.952 0.891 1
1 216 . 8 1 1 A 24 24 GLU CA C 24 55.601 54.896 0.705 1
1 217 . 8 1 1 A 24 24 GLU CB C 24 30.512 31.428 -0.916 1
1 219 . 8 1 1 A 24 24 GLU N N 24 117.859 119.538 -1.679 1
1 220 . 8 1 1 A 25 25 GLU H H 25 9.146 8.746 0.400 1
1 221 . 8 1 1 A 25 25 GLU HA H 25 3.924 3.889 0.035 1
1 226 . 8 1 1 A 25 25 GLU C C 25 177.809 177.678 0.131 1
1 227 . 8 1 1 A 25 25 GLU CA C 25 58.568 58.821 -0.253 1
1 228 . 8 1 1 A 25 25 GLU CB C 25 29.313 29.530 -0.217 1
1 230 . 8 1 1 A 25 25 GLU N N 25 124.543 121.318 3.225 1
1 231 . 8 1 1 A 26 26 GLY H H 26 8.242 8.964 -0.722 1
1 232 . 8 1 1 A 26 26 GLY HA2 H 26 4.287 3.920 0.367 1
1 233 . 8 1 1 A 26 26 GLY HA3 H 26 3.407 3.921 -0.514 1
1 234 . 8 1 1 A 26 26 GLY C C 26 174.234 175.318 -1.084 1
1 235 . 8 1 1 A 26 26 GLY CA C 26 46.113 46.933 -0.820 1
1 236 . 8 1 1 A 26 26 GLY N N 26 115.394 113.924 1.470 1
1 237 . 8 1 1 A 27 27 ALA H H 27 7.432 8.472 -1.040 1
1 238 . 8 1 1 A 27 27 ALA HA H 27 4.402 4.277 0.125 1
1 242 . 8 1 1 A 27 27 ALA C C 27 178.138 178.272 -0.134 1
1 243 . 8 1 1 A 27 27 ALA CA C 27 52.273 52.903 -0.630 1
1 244 . 8 1 1 A 27 27 ALA CB C 27 20.214 19.546 0.668 1
1 245 . 8 1 1 A 27 27 ALA N N 27 122.323 122.613 -0.290 1
1 246 . 8 1 1 A 28 28 GLY H H 28 8.624 7.819 0.805 1
1 247 . 8 1 1 A 28 28 GLY HA2 H 28 4.134 4.086 0.048 1
1 248 . 8 1 1 A 28 28 GLY HA3 H 28 3.953 4.120 -0.167 1
1 249 . 8 1 1 A 28 28 GLY C C 28 174.069 174.805 -0.736 1
1 250 . 8 1 1 A 28 28 GLY CA C 28 44.546 44.493 0.053 1
1 251 . 8 1 1 A 28 28 GLY N N 28 107.593 105.399 2.194 1
1 252 . 8 1 1 A 29 29 LEU H H 29 7.934 8.560 -0.626 1
1 253 . 8 1 1 A 29 29 LEU HA H 29 4.059 4.374 -0.315 1
1 263 . 8 1 1 A 29 29 LEU C C 29 177.548 176.956 0.592 1
1 264 . 8 1 1 A 29 29 LEU CA C 29 56.298 56.289 0.009 1
1 265 . 8 1 1 A 29 29 LEU CB C 29 41.940 42.833 -0.893 1
1 269 . 8 1 1 A 29 29 LEU N N 29 115.495 121.249 -5.754 1
1 270 . 8 1 1 A 30 30 GLY H H 30 8.669 7.996 0.673 1
1 271 . 8 1 1 A 30 30 GLY HA2 H 30 4.264 4.103 0.161 1
1 272 . 8 1 1 A 30 30 GLY HA3 H 30 4.001 4.236 -0.235 1
1 273 . 8 1 1 A 30 30 GLY C C 30 175.296 173.085 2.211 1
1 274 . 8 1 1 A 30 30 GLY CA C 30 46.368 45.045 1.323 1
1 275 . 8 1 1 A 30 30 GLY N N 30 103.121 106.296 -3.175 1
1 276 . 8 1 1 A 31 31 PHE H H 31 7.044 7.391 -0.347 1
1 277 . 8 1 1 A 31 31 PHE HA H 31 4.541 4.396 0.145 1
1 285 . 8 1 1 A 31 31 PHE C C 31 171.141 172.752 -1.611 1
1 286 . 8 1 1 A 31 31 PHE CA C 31 55.704 55.219 0.485 1
1 287 . 8 1 1 A 31 31 PHE CB C 31 40.745 41.931 -1.186 1
1 293 . 8 1 1 A 31 31 PHE N N 31 115.404 115.243 0.161 1
1 294 . 8 1 1 A 32 32 SER H H 32 8.752 8.840 -0.088 1
1 295 . 8 1 1 A 32 32 SER HA H 32 4.990 5.042 -0.052 1
1 298 . 8 1 1 A 32 32 SER C C 32 175.049 172.787 2.262 1
1 299 . 8 1 1 A 32 32 SER CA C 32 55.001 55.734 -0.733 1
1 300 . 8 1 1 A 32 32 SER CB C 32 67.170 66.605 0.565 1
1 301 . 8 1 1 A 32 32 SER N N 32 113.639 115.055 -1.416 1
1 302 . 8 1 1 A 33 33 LEU H H 33 8.639 8.466 0.173 1
1 303 . 8 1 1 A 33 33 LEU HA H 33 5.573 5.157 0.416 1
1 313 . 8 1 1 A 33 33 LEU C C 33 175.827 175.532 0.295 1
1 314 . 8 1 1 A 33 33 LEU CA C 33 53.620 53.666 -0.046 1
1 315 . 8 1 1 A 33 33 LEU CB C 33 45.399 44.170 1.229 1
1 319 . 8 1 1 A 33 33 LEU N N 33 118.936 123.883 -4.947 1
1 320 . 8 1 1 A 34 34 ALA H H 34 9.410 8.818 0.592 1
1 321 . 8 1 1 A 34 34 ALA HA H 34 4.749 5.063 -0.314 1
1 325 . 8 1 1 A 34 34 ALA C C 34 176.231 177.622 -1.391 1
1 326 . 8 1 1 A 34 34 ALA CA C 34 50.425 51.086 -0.661 1
1 327 . 8 1 1 A 34 34 ALA CB C 34 22.518 22.733 -0.215 1
1 328 . 8 1 1 A 34 34 ALA N N 34 124.395 122.391 2.004 1
1 329 . 8 1 1 A 35 35 GLY H H 35 8.130 8.648 -0.518 1
1 330 . 8 1 1 A 35 35 GLY HA2 H 35 4.712 3.927 0.785 1
1 331 . 8 1 1 A 35 35 GLY HA3 H 35 3.955 3.994 -0.039 1
1 332 . 8 1 1 A 35 35 GLY C C 35 174.750 173.517 1.233 1
1 333 . 8 1 1 A 35 35 GLY CA C 35 44.494 45.297 -0.803 1
1 334 . 8 1 1 A 35 35 GLY N N 35 103.650 108.251 -4.601 1
1 335 . 8 1 1 A 36 36 GLY H H 36 8.217 8.778 -0.561 1
1 336 . 8 1 1 A 36 36 GLY HA2 H 36 4.494 4.358 0.136 1
1 337 . 8 1 1 A 36 36 GLY HA3 H 36 3.836 4.369 -0.533 1
1 338 . 8 1 1 A 36 36 GLY C C 36 174.410 173.838 0.572 1
1 339 . 8 1 1 A 36 36 GLY CA C 36 45.462 45.912 -0.450 1
1 340 . 8 1 1 A 36 36 GLY N N 36 122.114 108.959 13.155 1
1 341 . 8 1 1 A 37 37 ALA H H 37 8.963 8.432 0.531 1
1 342 . 8 1 1 A 37 37 ALA HA H 37 3.998 4.252 -0.254 1
1 346 . 8 1 1 A 37 37 ALA C C 37 176.935 178.587 -1.652 1
1 347 . 8 1 1 A 37 37 ALA CA C 37 55.308 53.556 1.752 1
1 348 . 8 1 1 A 37 37 ALA CB C 37 18.822 19.845 -1.023 1
1 349 . 8 1 1 A 37 37 ALA N N 37 123.418 122.460 0.958 1
1 350 . 8 1 1 A 38 38 ASP H H 38 10.586 7.944 2.642 1
1 351 . 8 1 1 A 38 38 ASP HA H 38 4.485 4.710 -0.225 1
1 354 . 8 1 1 A 38 38 ASP C C 38 175.309 176.192 -0.883 1
1 355 . 8 1 1 A 38 38 ASP CA C 38 52.730 54.095 -1.365 1
1 356 . 8 1 1 A 38 38 ASP CB C 38 38.689 41.160 -2.471 1
1 357 . 8 1 1 A 38 38 ASP N N 38 111.480 116.604 -5.124 1
1 358 . 8 1 1 A 39 39 LEU H H 39 7.789 7.522 0.267 1
1 359 . 8 1 1 A 39 39 LEU HA H 39 4.699 4.316 0.383 1
1 369 . 8 1 1 A 39 39 LEU C C 39 176.377 178.485 -2.108 1
1 370 . 8 1 1 A 39 39 LEU CA C 39 52.952 54.181 -1.229 1
1 371 . 8 1 1 A 39 39 LEU CB C 39 43.294 41.879 1.415 1
1 375 . 8 1 1 A 39 39 LEU N N 39 122.545 122.183 0.362 1
1 376 . 8 1 1 A 40 40 GLU H H 40 8.331 8.658 -0.327 1
1 377 . 8 1 1 A 40 40 GLU HA H 40 3.978 3.991 -0.013 1
1 382 . 8 1 1 A 40 40 GLU C C 40 176.887 176.758 0.129 1
1 383 . 8 1 1 A 40 40 GLU CA C 40 59.066 59.156 -0.090 1
1 384 . 8 1 1 A 40 40 GLU CB C 40 29.523 29.497 0.026 1
1 386 . 8 1 1 A 40 40 GLU N N 40 118.036 120.699 -2.663 1
1 387 . 8 1 1 A 41 41 ASN H H 41 7.890 7.976 -0.086 1
1 388 . 8 1 1 A 41 41 ASN HA H 41 4.820 4.974 -0.154 1
1 393 . 8 1 1 A 41 41 ASN CA C 41 52.316 51.748 0.568 1
1 394 . 8 1 1 A 41 41 ASN CB C 41 37.409 40.350 -2.941 1
1 395 . 8 1 1 A 41 41 ASN N N 41 115.196 116.158 -0.962 1
1 397 . 8 1 1 A 42 42 LYS H H 42 7.943 8.788 -0.845 1
1 398 . 8 1 1 A 42 42 LYS HA H 42 4.328 4.336 -0.008 1
1 407 . 8 1 1 A 42 42 LYS C C 42 177.081 176.064 1.017 1
1 408 . 8 1 1 A 42 42 LYS CA C 42 56.567 57.428 -0.861 1
1 409 . 8 1 1 A 42 42 LYS CB C 42 33.120 33.554 -0.434 1
1 413 . 8 1 1 A 42 42 LYS N N 42 120.612 122.263 -1.651 1
1 414 . 8 1 1 A 43 43 VAL H H 43 7.456 7.578 -0.122 1
1 415 . 8 1 1 A 43 43 VAL HA H 43 4.059 4.310 -0.251 1
1 423 . 8 1 1 A 43 43 VAL CA C 43 61.330 61.572 -0.242 1
1 424 . 8 1 1 A 43 43 VAL CB C 43 32.819 32.712 0.107 1
1 427 . 8 1 1 A 43 43 VAL N N 43 118.284 118.717 -0.433 1
1 428 . 8 1 1 A 44 44 ILE H H 44 8.481 8.752 -0.271 1
1 429 . 8 1 1 A 44 44 ILE HA H 44 4.913 4.304 0.609 1
1 439 . 8 1 1 A 44 44 ILE C C 44 176.719 176.114 0.605 1
1 440 . 8 1 1 A 44 44 ILE CA C 44 59.946 62.671 -2.725 1
1 441 . 8 1 1 A 44 44 ILE CB C 44 35.784 37.221 -1.437 1
1 445 . 8 1 1 A 44 44 ILE N N 44 127.089 128.513 -1.424 1
1 446 . 8 1 1 A 45 45 THR H H 45 8.906 8.462 0.444 1
1 447 . 8 1 1 A 45 45 THR HA H 45 5.400 5.467 -0.067 1
1 452 . 8 1 1 A 45 45 THR CA C 45 58.528 60.005 -1.477 1
1 453 . 8 1 1 A 45 45 THR CB C 45 73.760 71.410 2.350 1
1 455 . 8 1 1 A 45 45 THR N N 45 116.832 119.409 -2.577 1
1 456 . 8 1 1 A 46 46 VAL H H 46 8.336 8.975 -0.639 1
1 457 . 8 1 1 A 46 46 VAL HA H 46 4.059 4.199 -0.140 1
1 465 . 8 1 1 A 46 46 VAL C C 46 176.648 176.567 0.081 1
1 466 . 8 1 1 A 46 46 VAL CA C 46 63.058 62.864 0.194 1
1 467 . 8 1 1 A 46 46 VAL CB C 46 31.601 30.915 0.686 1
1 470 . 8 1 1 A 46 46 VAL N N 46 118.542 122.507 -3.965 1
1 471 . 8 1 1 A 47 47 HIS H H 47 9.382 8.518 0.864 1
1 472 . 8 1 1 A 47 47 HIS HA H 47 4.628 4.183 0.445 1
1 477 . 8 1 1 A 47 47 HIS C C 47 174.339 174.350 -0.011 1
1 478 . 8 1 1 A 47 47 HIS CA C 47 57.764 60.037 -2.273 1
1 479 . 8 1 1 A 47 47 HIS CB C 47 31.453 30.680 0.773 1
1 482 . 8 1 1 A 47 47 HIS N N 47 133.900 128.446 5.454 1
1 483 . 8 1 1 A 48 48 ARG H H 48 7.135 7.825 -0.690 1
1 484 . 8 1 1 A 48 48 ARG HA H 48 4.360 4.725 -0.365 1
1 491 . 8 1 1 A 48 48 ARG C C 48 173.877 174.683 -0.806 1
1 492 . 8 1 1 A 48 48 ARG CA C 48 54.385 54.813 -0.428 1
1 493 . 8 1 1 A 48 48 ARG CB C 48 33.996 34.722 -0.726 1
1 496 . 8 1 1 A 48 48 ARG N N 48 114.736 117.791 -3.055 1
1 497 . 8 1 1 A 49 49 VAL H H 49 8.690 8.650 0.040 1
1 498 . 8 1 1 A 49 49 VAL HA H 49 4.015 4.436 -0.421 1
1 506 . 8 1 1 A 49 49 VAL C C 49 176.255 175.461 0.794 1
1 507 . 8 1 1 A 49 49 VAL CA C 49 61.882 61.700 0.182 1
1 508 . 8 1 1 A 49 49 VAL CB C 49 32.261 33.411 -1.150 1
1 511 . 8 1 1 A 49 49 VAL N N 49 122.844 122.369 0.475 1
1 512 . 8 1 1 A 50 50 PHE H H 50 7.866 8.292 -0.426 1
1 513 . 8 1 1 A 50 50 PHE HA H 50 4.866 4.462 0.404 1
1 521 . 8 1 1 A 50 50 PHE C C 50 174.847 176.157 -1.310 1
1 522 . 8 1 1 A 50 50 PHE CA C 50 54.596 57.515 -2.919 1
1 523 . 8 1 1 A 50 50 PHE CB C 50 36.558 39.128 -2.570 1
1 529 . 8 1 1 A 50 50 PHE N N 50 128.498 127.422 1.076 1
1 530 . 8 1 1 A 51 51 PRO HA H 51 4.386 4.550 -0.164 1
1 537 . 8 1 1 A 51 51 PRO C C 51 177.321 176.674 0.647 1
1 538 . 8 1 1 A 51 51 PRO CA C 51 64.381 64.505 -0.124 1
1 539 . 8 1 1 A 51 51 PRO CB C 51 31.773 32.222 -0.449 1
1 542 . 8 1 1 A 52 52 ASN H H 52 8.814 8.516 0.298 1
1 543 . 8 1 1 A 52 52 ASN HA H 52 4.496 5.000 -0.504 1
1 548 . 8 1 1 A 52 52 ASN C C 52 174.823 174.702 0.121 1
1 549 . 8 1 1 A 52 52 ASN CA C 52 54.719 52.222 2.497 1
1 550 . 8 1 1 A 52 52 ASN CB C 52 38.109 39.195 -1.086 1
1 551 . 8 1 1 A 52 52 ASN N N 52 116.145 116.550 -0.405 1
1 553 . 8 1 1 A 53 53 GLY H H 53 7.730 8.278 -0.548 1
1 554 . 8 1 1 A 53 53 GLY HA2 H 53 4.430 4.360 0.070 1
1 555 . 8 1 1 A 53 53 GLY HA3 H 53 4.089 4.379 -0.290 1
1 556 . 8 1 1 A 53 53 GLY C C 53 174.810 174.110 0.700 1
1 557 . 8 1 1 A 53 53 GLY CA C 53 44.987 45.788 -0.801 1
1 558 . 8 1 1 A 53 53 GLY N N 53 106.196 111.630 -5.434 1
1 559 . 8 1 1 A 54 54 LEU H H 54 8.764 8.926 -0.162 1
1 560 . 8 1 1 A 54 54 LEU HA H 54 4.041 4.216 -0.175 1
1 570 . 8 1 1 A 54 54 LEU C C 54 179.712 178.639 1.073 1
1 571 . 8 1 1 A 54 54 LEU CA C 54 58.310 57.440 0.870 1
1 572 . 8 1 1 A 54 54 LEU CB C 54 42.390 42.032 0.358 1
1 576 . 8 1 1 A 54 54 LEU N N 54 118.836 119.720 -0.884 1
1 577 . 8 1 1 A 55 55 ALA H H 55 7.593 8.071 -0.478 1
1 578 . 8 1 1 A 55 55 ALA HA H 55 4.275 3.914 0.361 1
1 582 . 8 1 1 A 55 55 ALA C C 55 181.307 179.576 1.731 1
1 583 . 8 1 1 A 55 55 ALA CA C 55 54.825 54.865 -0.040 1
1 584 . 8 1 1 A 55 55 ALA CB C 55 18.345 18.291 0.054 1
1 585 . 8 1 1 A 55 55 ALA N N 55 118.782 122.032 -3.250 1
1 586 . 8 1 1 A 56 56 SER H H 56 9.339 7.726 1.613 1
1 587 . 8 1 1 A 56 56 SER HA H 56 4.023 4.230 -0.207 1
1 589 . 8 1 1 A 56 56 SER C C 56 176.392 177.356 -0.964 1
1 590 . 8 1 1 A 56 56 SER CA C 56 60.984 61.289 -0.305 1
1 591 . 8 1 1 A 56 56 SER CB C 56 62.987 62.787 0.200 1
1 592 . 8 1 1 A 56 56 SER N N 56 117.631 113.279 4.352 1
1 593 . 8 1 1 A 57 57 GLN H H 57 7.942 7.796 0.146 1
1 594 . 8 1 1 A 57 57 GLN HA H 57 4.034 4.075 -0.041 1
1 601 . 8 1 1 A 57 57 GLN C C 57 177.400 178.887 -1.487 1
1 602 . 8 1 1 A 57 57 GLN CA C 57 58.362 58.030 0.332 1
1 603 . 8 1 1 A 57 57 GLN CB C 57 28.801 28.883 -0.082 1
1 605 . 8 1 1 A 57 57 GLN N N 57 118.162 121.849 -3.687 1
1 607 . 8 1 1 A 58 58 GLU H H 58 7.683 8.451 -0.768 1
1 608 . 8 1 1 A 58 58 GLU HA H 58 4.163 4.041 0.122 1
1 613 . 8 1 1 A 58 58 GLU C C 58 179.248 177.343 1.905 1
1 614 . 8 1 1 A 58 58 GLU CA C 58 59.559 58.186 1.373 1
1 615 . 8 1 1 A 58 58 GLU CB C 58 29.317 29.748 -0.431 1
1 617 . 8 1 1 A 58 58 GLU N N 58 119.877 118.239 1.638 1
1 618 . 8 1 1 A 59 59 GLY H H 59 7.446 7.456 -0.010 1
1 619 . 8 1 1 A 59 59 GLY HA2 H 59 4.100 3.916 0.184 1
1 620 . 8 1 1 A 59 59 GLY HA3 H 59 3.770 3.916 -0.146 1
1 621 . 8 1 1 A 59 59 GLY C C 59 175.432 175.182 0.250 1
1 622 . 8 1 1 A 59 59 GLY CA C 59 46.817 45.591 1.226 1
1 623 . 8 1 1 A 59 59 GLY N N 59 102.653 107.616 -4.963 1
1 624 . 8 1 1 A 60 60 THR H H 60 8.343 7.992 0.351 1
1 625 . 8 1 1 A 60 60 THR HA H 60 4.037 4.046 -0.009 1
1 630 . 8 1 1 A 60 60 THR C C 60 175.843 174.914 0.929 1
1 631 . 8 1 1 A 60 60 THR CA C 60 64.792 65.809 -1.017 1
1 632 . 8 1 1 A 60 60 THR CB C 60 69.325 68.668 0.657 1
1 634 . 8 1 1 A 60 60 THR N N 60 113.863 114.163 -0.300 1
1 635 . 8 1 1 A 61 61 ILE H H 61 8.802 7.757 1.045 1
1 636 . 8 1 1 A 61 61 ILE HA H 61 3.631 4.117 -0.486 1
1 646 . 8 1 1 A 61 61 ILE C C 61 174.198 174.461 -0.263 1
1 647 . 8 1 1 A 61 61 ILE CA C 61 62.938 60.961 1.977 1
1 648 . 8 1 1 A 61 61 ILE CB C 61 37.225 36.237 0.988 1
1 652 . 8 1 1 A 61 61 ILE N N 61 126.153 119.508 6.645 1
1 653 . 8 1 1 A 62 62 GLN H H 62 7.124 9.299 -2.175 1
1 654 . 8 1 1 A 62 62 GLN HA H 62 4.500 4.582 -0.082 1
1 661 . 8 1 1 A 62 62 GLN C C 62 174.556 175.413 -0.857 1
1 662 . 8 1 1 A 62 62 GLN CA C 62 53.364 54.279 -0.915 1
1 663 . 8 1 1 A 62 62 GLN CB C 62 32.196 30.684 1.512 1
1 665 . 8 1 1 A 62 62 GLN N N 62 123.730 126.491 -2.761 1
1 667 . 8 1 1 A 63 63 LYS H H 63 8.399 8.450 -0.051 1
1 668 . 8 1 1 A 63 63 LYS HA H 63 3.464 4.490 -1.026 1
1 677 . 8 1 1 A 63 63 LYS CA C 63 57.905 57.046 0.859 1
1 678 . 8 1 1 A 63 63 LYS CB C 63 32.260 32.166 0.094 1
1 682 . 8 1 1 A 63 63 LYS N N 63 121.381 123.460 -2.079 1
1 683 . 8 1 1 A 64 64 GLY H H 64 9.265 9.165 0.100 1
1 684 . 8 1 1 A 64 64 GLY HA2 H 64 4.415 3.941 0.474 1
1 685 . 8 1 1 A 64 64 GLY HA3 H 64 3.639 3.949 -0.310 1
1 686 . 8 1 1 A 64 64 GLY CA C 64 44.881 45.489 -0.608 1
1 687 . 8 1 1 A 64 64 GLY N N 64 113.750 112.258 1.492 1
1 688 . 8 1 1 A 65 65 ASN H H 65 7.594 7.779 -0.185 1
1 689 . 8 1 1 A 65 65 ASN HA H 65 4.798 4.992 -0.194 1
1 694 . 8 1 1 A 65 65 ASN C C 65 175.042 174.155 0.887 1
1 695 . 8 1 1 A 65 65 ASN CA C 65 53.047 52.888 0.159 1
1 696 . 8 1 1 A 65 65 ASN CB C 65 38.153 40.417 -2.264 1
1 697 . 8 1 1 A 65 65 ASN N N 65 117.999 118.950 -0.951 1
1 699 . 8 1 1 A 66 66 GLU H H 66 8.538 8.601 -0.063 1
1 700 . 8 1 1 A 66 66 GLU HA H 66 4.634 4.694 -0.060 1
1 705 . 8 1 1 A 66 66 GLU C C 66 176.620 175.116 1.504 1
1 706 . 8 1 1 A 66 66 GLU CA C 66 55.863 55.112 0.751 1
1 707 . 8 1 1 A 66 66 GLU CB C 66 30.899 30.656 0.243 1
1 709 . 8 1 1 A 66 66 GLU N N 66 122.233 121.843 0.390 1
1 710 . 8 1 1 A 67 67 VAL H H 67 8.452 9.321 -0.869 1
1 711 . 8 1 1 A 67 67 VAL HA H 67 4.172 4.023 0.149 1
1 719 . 8 1 1 A 67 67 VAL C C 67 174.641 175.229 -0.588 1
1 720 . 8 1 1 A 67 67 VAL CA C 67 61.856 63.282 -1.426 1
1 721 . 8 1 1 A 67 67 VAL CB C 67 31.066 31.019 0.047 1
1 724 . 8 1 1 A 67 67 VAL N N 67 126.311 127.875 -1.564 1
1 725 . 8 1 1 A 68 68 LEU H H 68 9.000 8.844 0.156 1
1 726 . 8 1 1 A 68 68 LEU HA H 68 4.390 4.235 0.155 1
1 736 . 8 1 1 A 68 68 LEU C C 68 178.924 176.961 1.963 1
1 737 . 8 1 1 A 68 68 LEU CA C 68 56.990 56.556 0.434 1
1 738 . 8 1 1 A 68 68 LEU CB C 68 42.392 42.608 -0.216 1
1 742 . 8 1 1 A 68 68 LEU N N 68 127.175 129.986 -2.811 1
1 743 . 8 1 1 A 69 69 SER H H 69 7.666 7.817 -0.151 1
1 744 . 8 1 1 A 69 69 SER HA H 69 5.144 5.067 0.077 1
1 747 . 8 1 1 A 69 69 SER C C 69 172.722 172.399 0.323 1
1 748 . 8 1 1 A 69 69 SER CA C 69 57.606 57.307 0.299 1
1 749 . 8 1 1 A 69 69 SER CB C 69 64.511 65.863 -1.352 1
1 750 . 8 1 1 A 69 69 SER N N 69 110.346 109.106 1.240 1
1 751 . 8 1 1 A 70 70 ILE H H 70 7.965 8.629 -0.664 1
1 752 . 8 1 1 A 70 70 ILE HA H 70 4.548 4.918 -0.370 1
1 762 . 8 1 1 A 70 70 ILE C C 70 174.993 176.213 -1.220 1
1 763 . 8 1 1 A 70 70 ILE CA C 70 60.897 60.203 0.694 1
1 764 . 8 1 1 A 70 70 ILE CB C 70 41.186 40.518 0.668 1
1 768 . 8 1 1 A 70 70 ILE N N 70 119.579 121.665 -2.086 1
1 769 . 8 1 1 A 71 71 ASN H H 71 9.839 10.186 -0.347 1
1 770 . 8 1 1 A 71 71 ASN HA H 71 4.485 4.405 0.080 1
1 775 . 8 1 1 A 71 71 ASN C C 71 174.975 174.545 0.430 1
1 776 . 8 1 1 A 71 71 ASN CA C 71 54.085 54.132 -0.047 1
1 777 . 8 1 1 A 71 71 ASN CB C 71 36.255 37.338 -1.083 1
1 778 . 8 1 1 A 71 71 ASN N N 71 126.963 125.562 1.401 1
1 780 . 8 1 1 A 72 72 GLY H H 72 8.911 8.415 0.496 1
1 781 . 8 1 1 A 72 72 GLY HA2 H 72 4.149 3.876 0.273 1
1 782 . 8 1 1 A 72 72 GLY HA3 H 72 3.507 3.877 -0.370 1
1 783 . 8 1 1 A 72 72 GLY C C 72 173.594 174.133 -0.539 1
1 784 . 8 1 1 A 72 72 GLY CA C 72 45.162 45.306 -0.144 1
1 785 . 8 1 1 A 72 72 GLY N N 72 103.020 105.052 -2.032 1
1 786 . 8 1 1 A 73 73 LYS H H 73 7.922 7.968 -0.046 1
1 787 . 8 1 1 A 73 73 LYS HA H 73 4.485 4.316 0.169 1
1 796 . 8 1 1 A 73 73 LYS C C 73 175.036 175.797 -0.761 1
1 797 . 8 1 1 A 73 73 LYS CA C 73 54.719 55.780 -1.061 1
1 798 . 8 1 1 A 73 73 LYS CB C 73 32.137 32.163 -0.026 1
1 802 . 8 1 1 A 73 73 LYS N N 73 122.413 120.813 1.600 1
1 803 . 8 1 1 A 74 74 SER H H 74 8.585 8.925 -0.340 1
1 804 . 8 1 1 A 74 74 SER HA H 74 4.452 4.843 -0.391 1
1 807 . 8 1 1 A 74 74 SER C C 74 175.965 173.755 2.210 1
1 808 . 8 1 1 A 74 74 SER CA C 74 58.028 58.833 -0.805 1
1 809 . 8 1 1 A 74 74 SER CB C 74 63.799 63.970 -0.171 1
1 810 . 8 1 1 A 74 74 SER N N 74 118.737 120.867 -2.130 1
1 811 . 8 1 1 A 75 75 LEU H H 75 8.015 8.295 -0.280 1
1 812 . 8 1 1 A 75 75 LEU HA H 75 4.661 4.460 0.201 1
1 822 . 8 1 1 A 75 75 LEU C C 75 178.117 177.444 0.673 1
1 823 . 8 1 1 A 75 75 LEU CA C 75 53.980 54.602 -0.622 1
1 824 . 8 1 1 A 75 75 LEU CB C 75 40.830 40.906 -0.076 1
1 828 . 8 1 1 A 75 75 LEU N N 75 125.425 125.891 -0.466 1
1 829 . 8 1 1 A 76 76 LYS H H 76 8.099 8.646 -0.547 1
1 830 . 8 1 1 A 76 76 LYS HA H 76 4.210 4.403 -0.193 1
1 839 . 8 1 1 A 76 76 LYS C C 76 178.487 176.757 1.730 1
1 840 . 8 1 1 A 76 76 LYS CA C 76 58.010 55.473 2.537 1
1 841 . 8 1 1 A 76 76 LYS CB C 76 31.683 31.631 0.052 1
1 845 . 8 1 1 A 76 76 LYS N N 76 124.064 120.086 3.978 1
1 846 . 8 1 1 A 77 77 GLY H H 77 8.859 7.844 1.015 1
1 847 . 8 1 1 A 77 77 GLY HA2 H 77 4.110 4.066 0.044 1
1 848 . 8 1 1 A 77 77 GLY HA3 H 77 3.869 4.068 -0.199 1
1 849 . 8 1 1 A 77 77 GLY C C 77 174.335 174.643 -0.308 1
1 850 . 8 1 1 A 77 77 GLY CA C 77 46.232 44.933 1.299 1
1 851 . 8 1 1 A 77 77 GLY N N 77 115.659 108.700 6.959 1
1 852 . 8 1 1 A 78 78 THR H H 78 7.654 7.761 -0.107 1
1 853 . 8 1 1 A 78 78 THR HA H 78 4.624 4.149 0.475 1
1 858 . 8 1 1 A 78 78 THR C C 78 177.272 174.964 2.308 1
1 859 . 8 1 1 A 78 78 THR CA C 78 61.794 63.448 -1.654 1
1 860 . 8 1 1 A 78 78 THR CB C 78 70.595 69.323 1.272 1
1 862 . 8 1 1 A 78 78 THR N N 78 112.847 116.820 -3.973 1
1 863 . 8 1 1 A 79 79 THR H H 79 8.813 8.642 0.171 1
1 864 . 8 1 1 A 79 79 THR HA H 79 4.395 4.619 -0.224 1
1 869 . 8 1 1 A 79 79 THR C C 79 174.503 175.467 -0.964 1
1 870 . 8 1 1 A 79 79 THR CA C 79 61.724 61.009 0.715 1
1 871 . 8 1 1 A 79 79 THR CB C 79 71.007 71.031 -0.024 1
1 873 . 8 1 1 A 79 79 THR N N 79 114.123 118.216 -4.093 1
1 874 . 8 1 1 A 80 80 HIS H H 80 10.266 9.037 1.229 1
1 875 . 8 1 1 A 80 80 HIS HA H 80 4.331 4.221 0.110 1
1 880 . 8 1 1 A 80 80 HIS C C 80 177.075 176.846 0.229 1
1 881 . 8 1 1 A 80 80 HIS CA C 80 61.338 59.590 1.748 1
1 882 . 8 1 1 A 80 80 HIS CB C 80 28.651 29.810 -1.159 1
1 885 . 8 1 1 A 80 80 HIS N N 80 122.776 121.223 1.553 1
1 886 . 8 1 1 A 81 81 HIS H H 81 9.335 7.976 1.359 1
1 887 . 8 1 1 A 81 81 HIS HA H 81 4.078 4.043 0.035 1
1 892 . 8 1 1 A 81 81 HIS C C 81 178.269 176.671 1.598 1
1 893 . 8 1 1 A 81 81 HIS CA C 81 60.210 59.419 0.791 1
1 894 . 8 1 1 A 81 81 HIS CB C 81 29.569 30.074 -0.505 1
1 897 . 8 1 1 A 81 81 HIS N N 81 114.733 118.566 -3.833 1
1 898 . 8 1 1 A 82 82 ASP H H 82 7.741 8.146 -0.405 1
1 899 . 8 1 1 A 82 82 ASP HA H 82 4.452 4.213 0.239 1
1 902 . 8 1 1 A 82 82 ASP C C 82 178.683 178.911 -0.228 1
1 903 . 8 1 1 A 82 82 ASP CA C 82 57.148 57.421 -0.273 1
1 904 . 8 1 1 A 82 82 ASP CB C 82 39.522 40.316 -0.794 1
1 905 . 8 1 1 A 82 82 ASP N N 82 121.407 118.225 3.182 1
1 906 . 8 1 1 A 83 83 ALA H H 83 8.502 7.468 1.034 1
1 907 . 8 1 1 A 83 83 ALA HA H 83 3.939 4.058 -0.119 1
1 911 . 8 1 1 A 83 83 ALA C C 83 179.361 179.485 -0.124 1
1 912 . 8 1 1 A 83 83 ALA CA C 83 55.635 55.083 0.552 1
1 913 . 8 1 1 A 83 83 ALA CB C 83 18.124 18.762 -0.638 1
1 914 . 8 1 1 A 83 83 ALA N N 83 125.049 122.850 2.199 1
1 915 . 8 1 1 A 84 84 LEU H H 84 8.100 8.148 -0.048 1
1 916 . 8 1 1 A 84 84 LEU HA H 84 3.792 3.765 0.027 1
1 926 . 8 1 1 A 84 84 LEU C C 84 180.173 179.233 0.940 1
1 927 . 8 1 1 A 84 84 LEU CA C 84 57.932 57.975 -0.043 1
1 928 . 8 1 1 A 84 84 LEU CB C 84 41.157 41.507 -0.350 1
1 932 . 8 1 1 A 84 84 LEU N N 84 117.139 118.253 -1.114 1
1 933 . 8 1 1 A 85 85 ALA H H 85 7.715 8.540 -0.825 1
1 934 . 8 1 1 A 85 85 ALA HA H 85 4.061 4.120 -0.059 1
1 938 . 8 1 1 A 85 85 ALA C C 85 180.380 180.021 0.359 1
1 939 . 8 1 1 A 85 85 ALA CA C 85 55.212 55.323 -0.111 1
1 940 . 8 1 1 A 85 85 ALA CB C 85 17.803 18.377 -0.574 1
1 941 . 8 1 1 A 85 85 ALA N N 85 122.448 120.834 1.614 1
1 942 . 8 1 1 A 86 86 ILE H H 86 7.669 7.877 -0.208 1
1 943 . 8 1 1 A 86 86 ILE HA H 86 3.678 3.712 -0.034 1
1 953 . 8 1 1 A 86 86 ILE C C 86 178.692 178.738 -0.046 1
1 954 . 8 1 1 A 86 86 ILE CA C 86 65.226 64.972 0.254 1
1 955 . 8 1 1 A 86 86 ILE CB C 86 38.099 37.785 0.314 1
1 959 . 8 1 1 A 86 86 ILE N N 86 121.804 117.876 3.928 1
1 960 . 8 1 1 A 87 87 LEU H H 87 7.922 8.336 -0.414 1
1 961 . 8 1 1 A 87 87 LEU HA H 87 3.903 4.045 -0.142 1
1 971 . 8 1 1 A 87 87 LEU C C 87 178.610 178.666 -0.056 1
1 972 . 8 1 1 A 87 87 LEU CA C 87 58.221 58.155 0.066 1
1 973 . 8 1 1 A 87 87 LEU CB C 87 42.344 41.506 0.838 1
1 977 . 8 1 1 A 87 87 LEU N N 87 121.947 121.496 0.451 1
1 978 . 8 1 1 A 88 88 ARG H H 88 8.317 8.154 0.163 1
1 979 . 8 1 1 A 88 88 ARG HA H 88 4.060 4.193 -0.133 1
1 986 . 8 1 1 A 88 88 ARG C C 88 180.698 177.234 3.464 1
1 987 . 8 1 1 A 88 88 ARG CA C 88 59.383 58.571 0.812 1
1 988 . 8 1 1 A 88 88 ARG CB C 88 30.055 29.757 0.298 1
1 991 . 8 1 1 A 88 88 ARG N N 88 119.343 119.499 -0.156 1
1 992 . 8 1 1 A 89 89 GLN H H 89 8.270 7.708 0.562 1
1 993 . 8 1 1 A 89 89 GLN HA H 89 4.122 4.220 -0.098 1
1 1000 . 8 1 1 A 89 89 GLN C C 89 177.955 177.924 0.031 1
1 1001 . 8 1 1 A 89 89 GLN CA C 89 58.714 57.828 0.886 1
1 1002 . 8 1 1 A 89 89 GLN CB C 89 28.160 29.202 -1.042 1
1 1004 . 8 1 1 A 89 89 GLN N N 89 121.097 117.524 3.573 1
1 1006 . 8 1 1 A 90 90 ALA H H 90 7.558 7.448 0.110 1
1 1007 . 8 1 1 A 90 90 ALA HA H 90 4.123 4.167 -0.044 1
1 1011 . 8 1 1 A 90 90 ALA C C 90 178.076 178.031 0.045 1
1 1012 . 8 1 1 A 90 90 ALA CA C 90 52.942 53.758 -0.816 1
1 1013 . 8 1 1 A 90 90 ALA CB C 90 18.015 18.343 -0.328 1
1 1014 . 8 1 1 A 90 90 ALA N N 90 119.652 121.866 -2.214 1
1 1015 . 8 1 1 A 91 91 ARG H H 91 7.768 7.653 0.115 1
1 1016 . 8 1 1 A 91 91 ARG HA H 91 4.065 4.361 -0.296 1
1 1022 . 8 1 1 A 91 91 ARG C C 91 177.858 177.621 0.237 1
1 1023 . 8 1 1 A 91 91 ARG CA C 91 58.573 56.559 2.014 1
1 1024 . 8 1 1 A 91 91 ARG CB C 91 30.384 30.456 -0.072 1
1 1027 . 8 1 1 A 91 91 ARG N N 91 118.081 116.690 1.391 1
1 1028 . 8 1 1 A 92 92 GLU H H 92 7.691 7.873 -0.182 1
1 1029 . 8 1 1 A 92 92 GLU HA H 92 4.123 4.187 -0.064 1
1 1034 . 8 1 1 A 92 92 GLU C C 92 174.459 176.642 -2.183 1
1 1035 . 8 1 1 A 92 92 GLU CA C 92 61.565 60.756 0.809 1
1 1036 . 8 1 1 A 92 92 GLU CB C 92 27.583 29.178 -1.595 1
1 1038 . 8 1 1 A 92 92 GLU N N 92 118.447 118.131 0.316 1
1 1039 . 8 1 1 A 93 93 PRO HA H 93 4.716 4.706 0.010 1
1 1046 . 8 1 1 A 93 93 PRO C C 93 176.221 176.271 -0.050 1
1 1047 . 8 1 1 A 93 93 PRO CA C 93 63.149 62.332 0.817 1
1 1048 . 8 1 1 A 93 93 PRO CB C 93 32.571 33.186 -0.615 1
1 1051 . 8 1 1 A 94 94 ARG H H 94 8.434 8.917 -0.483 1
1 1052 . 8 1 1 A 94 94 ARG HA H 94 4.232 4.531 -0.299 1
1 1058 . 8 1 1 A 94 94 ARG C C 94 175.323 175.872 -0.549 1
1 1059 . 8 1 1 A 94 94 ARG CA C 94 56.972 56.457 0.515 1
1 1060 . 8 1 1 A 94 94 ARG CB C 94 30.448 31.934 -1.486 1
1 1063 . 8 1 1 A 94 94 ARG N N 94 115.987 118.644 -2.657 1
1 1064 . 8 1 1 A 95 95 GLN H H 95 7.246 7.586 -0.340 1
1 1065 . 8 1 1 A 95 95 GLN HA H 95 5.251 5.326 -0.075 1
1 1072 . 8 1 1 A 95 95 GLN C C 95 174.786 173.845 0.941 1
1 1073 . 8 1 1 A 95 95 GLN CA C 95 54.209 54.094 0.115 1
1 1074 . 8 1 1 A 95 95 GLN CB C 95 32.384 32.275 0.109 1
1 1076 . 8 1 1 A 95 95 GLN N N 95 115.998 119.857 -3.859 1
1 1078 . 8 1 1 A 96 96 ALA H H 96 8.739 8.971 -0.232 1
1 1079 . 8 1 1 A 96 96 ALA HA H 96 5.412 5.254 0.158 1
1 1083 . 8 1 1 A 96 96 ALA C C 96 175.258 175.776 -0.518 1
1 1084 . 8 1 1 A 96 96 ALA CA C 96 50.355 50.599 -0.244 1
1 1085 . 8 1 1 A 96 96 ALA CB C 96 24.270 22.589 1.681 1
1 1086 . 8 1 1 A 96 96 ALA N N 96 126.197 125.474 0.723 1
1 1087 . 8 1 1 A 97 97 VAL H H 97 8.568 8.886 -0.318 1
1 1088 . 8 1 1 A 97 97 VAL HA H 97 4.804 4.634 0.170 1
1 1096 . 8 1 1 A 97 97 VAL C C 97 175.982 174.524 1.458 1
1 1097 . 8 1 1 A 97 97 VAL CA C 97 61.442 61.429 0.013 1
1 1098 . 8 1 1 A 97 97 VAL CB C 97 33.413 33.366 0.047 1
1 1101 . 8 1 1 A 97 97 VAL N N 97 120.702 122.111 -1.409 1
1 1102 . 8 1 1 A 98 98 ILE H H 98 9.753 8.610 1.143 1
1 1103 . 8 1 1 A 98 98 ILE HA H 98 4.826 5.223 -0.397 1
1 1113 . 8 1 1 A 98 98 ILE C C 98 174.292 174.588 -0.296 1
1 1114 . 8 1 1 A 98 98 ILE CA C 98 59.981 59.628 0.353 1
1 1115 . 8 1 1 A 98 98 ILE CB C 98 40.608 40.561 0.047 1
1 1119 . 8 1 1 A 98 98 ILE N N 98 131.738 127.235 4.503 1
1 1120 . 8 1 1 A 99 99 VAL H H 99 8.493 8.710 -0.217 1
1 1121 . 8 1 1 A 99 99 VAL HA H 99 5.201 4.775 0.426 1
1 1129 . 8 1 1 A 99 99 VAL C C 99 176.557 175.239 1.318 1
1 1130 . 8 1 1 A 99 99 VAL CA C 99 61.495 60.932 0.563 1
1 1131 . 8 1 1 A 99 99 VAL CB C 99 32.327 32.733 -0.406 1
1 1134 . 8 1 1 A 99 99 VAL N N 99 129.537 129.175 0.362 1
1 1135 . 8 1 1 A 100 100 THR H H 100 9.050 8.884 0.166 1
1 1136 . 8 1 1 A 100 100 THR HA H 100 5.606 5.084 0.522 1
1 1141 . 8 1 1 A 100 100 THR C C 100 172.815 172.796 0.019 1
1 1142 . 8 1 1 A 100 100 THR CA C 100 59.049 59.417 -0.368 1
1 1143 . 8 1 1 A 100 100 THR CB C 100 73.966 72.151 1.815 1
1 1145 . 8 1 1 A 100 100 THR N N 100 117.469 117.025 0.444 1
1 1146 . 8 1 1 A 101 101 ARG H H 101 8.773 8.678 0.095 1
1 1147 . 8 1 1 A 101 101 ARG HA H 101 4.989 4.506 0.483 1
1 1155 . 8 1 1 A 101 101 ARG C C 101 174.738 174.929 -0.191 1
1 1156 . 8 1 1 A 101 101 ARG CA C 101 54.825 53.510 1.315 1
1 1157 . 8 1 1 A 101 101 ARG CB C 101 34.636 33.894 0.742 1
1 1160 . 8 1 1 A 101 101 ARG N N 101 117.532 120.078 -2.546 1
1 1162 . 8 1 1 A 102 102 LYS H H 102 8.616 8.820 -0.204 1
1 1163 . 8 1 1 A 102 102 LYS HA H 102 4.232 4.386 -0.154 1
1 1171 . 8 1 1 A 102 102 LYS C C 102 175.935 175.876 0.059 1
1 1172 . 8 1 1 A 102 102 LYS CA C 102 56.549 56.392 0.157 1
1 1173 . 8 1 1 A 102 102 LYS CB C 102 33.266 32.352 0.914 1
1 1177 . 8 1 1 A 102 102 LYS N N 102 126.899 122.112 4.787 1
1 1178 . 8 1 1 A 103 103 LEU H H 103 8.424 8.760 -0.336 1
1 1179 . 8 1 1 A 103 103 LEU HA H 103 4.540 4.167 0.373 1
1 1189 . 8 1 1 A 103 103 LEU C C 103 176.956 176.879 0.077 1
1 1190 . 8 1 1 A 103 103 LEU CA C 103 54.755 57.629 -2.874 1
1 1191 . 8 1 1 A 103 103 LEU CB C 103 42.929 42.063 0.866 1
1 1195 . 8 1 1 A 103 103 LEU N N 103 126.246 126.819 -0.573 1
1 1196 . 8 1 1 A 104 104 THR H H 104 8.201 7.872 0.329 1
1 1197 . 8 1 1 A 104 104 THR HA H 104 4.624 4.912 -0.288 1
1 1202 . 8 1 1 A 104 104 THR C C 104 172.954 172.374 0.580 1
1 1203 . 8 1 1 A 104 104 THR CA C 104 59.483 58.506 0.977 1
1 1204 . 8 1 1 A 104 104 THR CB C 104 69.761 70.375 -0.614 1
1 1206 . 8 1 1 A 104 104 THR N N 104 117.263 108.224 9.039 1
1 1207 . 8 1 1 A 105 105 PRO HA H 105 4.399 4.759 -0.360 1
1 1213 . 8 1 1 A 105 105 PRO CA C 105 63.495 62.565 0.930 1
1 1214 . 8 1 1 A 105 105 PRO CB C 105 32.096 33.238 -1.142 1
1 1217 . 8 1 1 A 106 106 GLU H H 106 8.519 8.562 -0.043 1
1 1218 . 8 1 1 A 106 106 GLU HA H 106 4.197 4.833 -0.636 1
1 1221 . 8 1 1 A 106 106 GLU C C 106 176.110 174.759 1.351 1
1 1222 . 8 1 1 A 106 106 GLU CA C 106 56.743 55.488 1.255 1
1 1223 . 8 1 1 A 106 106 GLU CB C 106 30.137 33.290 -3.153 1
1 1225 . 8 1 1 A 106 106 GLU N N 106 120.609 117.487 3.122 1
1 1226 . 8 1 1 A 107 107 ALA H H 107 8.241 8.222 0.019 1
1 1227 . 8 1 1 A 107 107 ALA HA H 107 4.317 4.378 -0.061 1
1 1231 . 8 1 1 A 107 107 ALA C C 107 177.299 177.464 -0.165 1
1 1232 . 8 1 1 A 107 107 ALA CA C 107 52.203 52.924 -0.721 1
1 1233 . 8 1 1 A 107 107 ALA CB C 107 19.392 20.840 -1.448 1
1 1234 . 8 1 1 A 107 107 ALA N N 107 124.849 121.721 3.128 1
1 1235 . 8 1 1 A 108 108 MET H H 108 8.284 8.093 0.191 1
1 1236 . 8 1 1 A 108 108 MET HA H 108 4.792 4.112 0.680 1
1 1244 . 8 1 1 A 108 108 MET C C 108 174.337 174.864 -0.527 1
1 1245 . 8 1 1 A 108 108 MET CA C 108 53.258 56.153 -2.895 1
1 1246 . 8 1 1 A 108 108 MET CB C 108 32.608 31.198 1.410 1
1 1249 . 8 1 1 A 108 108 MET N N 108 121.025 117.000 4.025 1
1 1250 . 8 1 1 A 109 109 PRO HA H 109 4.408 4.598 -0.190 1
1 1256 . 8 1 1 A 109 109 PRO C C 109 176.412 175.071 1.341 1
1 1257 . 8 1 1 A 109 109 PRO CA C 109 63.290 62.580 0.710 1
1 1258 . 8 1 1 A 109 109 PRO CB C 109 32.077 32.956 -0.879 1
1 1261 . 8 1 1 A 110 110 ASP H H 110 8.417 8.559 -0.142 1
1 1262 . 8 1 1 A 110 110 ASP HA H 110 4.573 5.114 -0.541 1
1 1265 . 8 1 1 A 110 110 ASP C C 110 176.508 175.356 1.152 1
1 1266 . 8 1 1 A 110 110 ASP CA C 110 54.085 53.074 1.011 1
1 1267 . 8 1 1 A 110 110 ASP CB C 110 41.075 43.032 -1.957 1
1 1268 . 8 1 1 A 110 110 ASP N N 110 120.239 120.390 -0.151 1
1 1269 . 8 1 1 A 111 111 LEU H H 111 8.279 8.749 -0.470 1
1 1270 . 8 1 1 A 111 111 LEU HA H 111 4.319 4.478 -0.159 1
1 1280 . 8 1 1 A 111 111 LEU C C 111 177.551 174.992 2.559 1
1 1281 . 8 1 1 A 111 111 LEU CA C 111 55.581 54.442 1.139 1
1 1282 . 8 1 1 A 111 111 LEU CB C 111 42.360 40.660 1.700 1
1 1286 . 8 1 1 A 111 111 LEU N N 111 123.318 126.006 -2.688 1
1 1287 . 8 1 1 A 112 112 ASN H H 112 8.487 7.638 0.849 1
1 1288 . 8 1 1 A 112 112 ASN HA H 112 4.725 5.120 -0.395 1
1 1293 . 8 1 1 A 112 112 ASN C C 112 175.454 173.035 2.419 1
1 1294 . 8 1 1 A 112 112 ASN CA C 112 53.610 52.763 0.847 1
1 1295 . 8 1 1 A 112 112 ASN CB C 112 39.116 41.810 -2.694 1
1 1296 . 8 1 1 A 112 112 ASN N N 112 118.752 119.300 -0.548 1
1 1298 . 8 1 1 A 115 115 GLY H H 115 8.205 8.264 -0.059 1
1 1299 . 8 1 1 A 115 115 GLY HA2 H 115 4.126 4.220 -0.094 1
1 1300 . 8 1 1 A 115 115 GLY HA3 H 115 4.126 4.220 -0.094 1
1 1301 . 8 1 1 A 115 115 GLY CA C 115 44.727 45.329 -0.602 1
1 1302 . 8 1 1 A 116 116 PRO HA H 116 4.485 4.689 -0.204 1
1 1309 . 8 1 1 A 116 116 PRO CA C 116 63.298 62.600 0.698 1
1 1310 . 8 1 1 A 116 116 PRO CB C 116 32.077 33.554 -1.477 1
1 1313 . 8 1 1 A 117 117 SER H H 117 8.532 8.517 0.015 1
1 1 . 9 1 1 A 7 7 GLY HA2 H 7 3.960 4.265 -0.305 1
1 2 . 9 1 1 A 7 7 GLY HA3 H 7 3.960 4.266 -0.306 1
1 3 . 9 1 1 A 7 7 GLY C C 7 174.009 173.559 0.450 1
1 4 . 9 1 1 A 7 7 GLY CA C 7 45.374 45.892 -0.518 1
1 5 . 9 1 1 A 8 8 ALA H H 8 8.163 9.014 -0.851 1
1 6 . 9 1 1 A 8 8 ALA HA H 8 4.381 3.929 0.452 1
1 10 . 9 1 1 A 8 8 ALA C C 8 178.078 176.841 1.237 1
1 11 . 9 1 1 A 8 8 ALA CA C 8 52.677 54.880 -2.203 1
1 12 . 9 1 1 A 8 8 ALA CB C 8 19.368 17.881 1.487 1
1 13 . 9 1 1 A 8 8 ALA N N 8 123.721 121.552 2.169 1
1 14 . 9 1 1 A 9 9 THR H H 9 8.142 8.216 -0.074 1
1 15 . 9 1 1 A 9 9 THR HA H 9 4.353 4.436 -0.083 1
1 20 . 9 1 1 A 9 9 THR C C 9 174.597 173.286 1.311 1
1 21 . 9 1 1 A 9 9 THR CA C 9 62.093 63.334 -1.241 1
1 22 . 9 1 1 A 9 9 THR CB C 9 69.948 67.826 2.122 1
1 24 . 9 1 1 A 9 9 THR N N 9 113.761 108.947 4.814 1
1 25 . 9 1 1 A 10 10 LEU H H 10 8.218 8.625 -0.407 1
1 26 . 9 1 1 A 10 10 LEU HA H 10 4.169 4.356 -0.187 1
1 36 . 9 1 1 A 10 10 LEU C C 10 176.110 177.173 -1.063 1
1 37 . 9 1 1 A 10 10 LEU CA C 10 61.099 54.628 6.471 1
1 38 . 9 1 1 A 10 10 LEU CB C 10 38.686 42.553 -3.867 1
1 42 . 9 1 1 A 10 10 LEU N N 10 123.516 125.846 -2.330 1
1 43 . 9 1 1 A 11 11 LYS H H 11 8.496 8.437 0.059 1
1 44 . 9 1 1 A 11 11 LYS HA H 11 4.891 4.404 0.487 1
1 49 . 9 1 1 A 11 11 LYS C C 11 175.794 174.799 0.995 1
1 50 . 9 1 1 A 11 11 LYS CA C 11 55.652 55.899 -0.247 1
1 51 . 9 1 1 A 11 11 LYS CB C 11 29.444 30.466 -1.022 1
1 52 . 9 1 1 A 11 11 LYS N N 11 125.141 119.589 5.552 1
1 53 . 9 1 1 A 12 12 GLN HA H 12 4.315 5.066 -0.751 1
1 54 . 9 1 1 A 12 12 GLN C C 12 176.300 174.669 1.631 1
1 55 . 9 1 1 A 12 12 GLN CA C 12 56.286 54.333 1.953 1
1 56 . 9 1 1 A 12 12 GLN CB C 12 32.901 31.522 1.379 1
1 57 . 9 1 1 A 13 13 LEU H H 13 8.410 8.751 -0.341 1
1 58 . 9 1 1 A 13 13 LEU HA H 13 4.348 4.498 -0.150 1
1 67 . 9 1 1 A 13 13 LEU C C 13 177.120 175.151 1.969 1
1 68 . 9 1 1 A 13 13 LEU CA C 13 55.142 54.476 0.666 1
1 69 . 9 1 1 A 13 13 LEU CB C 13 42.352 44.867 -2.515 1
1 73 . 9 1 1 A 13 13 LEU N N 13 124.340 124.693 -0.353 1
1 74 . 9 1 1 A 14 14 ASP H H 14 8.250 9.396 -1.146 1
1 75 . 9 1 1 A 14 14 ASP HA H 14 4.540 4.322 0.218 1
1 78 . 9 1 1 A 14 14 ASP C C 14 176.769 176.402 0.367 1
1 79 . 9 1 1 A 14 14 ASP CA C 14 54.772 55.223 -0.451 1
1 80 . 9 1 1 A 14 14 ASP CB C 14 41.322 39.346 1.976 1
1 81 . 9 1 1 A 14 14 ASP N N 14 120.493 126.932 -6.439 1
1 82 . 9 1 1 A 15 15 GLY H H 15 8.428 8.691 -0.263 1
1 83 . 9 1 1 A 15 15 GLY HA2 H 15 4.089 3.948 0.141 1
1 84 . 9 1 1 A 15 15 GLY HA3 H 15 3.874 3.958 -0.084 1
1 85 . 9 1 1 A 15 15 GLY C C 15 174.122 174.350 -0.228 1
1 86 . 9 1 1 A 15 15 GLY CA C 15 45.972 46.548 -0.576 1
1 87 . 9 1 1 A 15 15 GLY N N 15 108.670 104.522 4.148 1
1 88 . 9 1 1 A 16 16 ILE H H 16 7.727 7.943 -0.216 1
1 89 . 9 1 1 A 16 16 ILE HA H 16 4.705 4.132 0.573 1
1 99 . 9 1 1 A 16 16 ILE C C 16 175.807 175.509 0.298 1
1 100 . 9 1 1 A 16 16 ILE CA C 16 60.703 60.929 -0.226 1
1 101 . 9 1 1 A 16 16 ILE CB C 16 38.509 38.905 -0.396 1
1 105 . 9 1 1 A 16 16 ILE N N 16 120.267 121.125 -0.858 1
1 106 . 9 1 1 A 17 17 HIS H H 17 9.101 8.626 0.475 1
1 107 . 9 1 1 A 17 17 HIS HA H 17 4.782 5.720 -0.938 1
1 112 . 9 1 1 A 17 17 HIS C C 17 173.051 172.905 0.146 1
1 113 . 9 1 1 A 17 17 HIS CA C 17 55.353 53.481 1.872 1
1 114 . 9 1 1 A 17 17 HIS CB C 17 32.468 32.774 -0.306 1
1 117 . 9 1 1 A 17 17 HIS N N 17 125.061 123.327 1.734 1
1 118 . 9 1 1 A 18 18 VAL H H 18 8.427 8.623 -0.196 1
1 119 . 9 1 1 A 18 18 VAL HA H 18 4.375 4.203 0.172 1
1 127 . 9 1 1 A 18 18 VAL C C 18 174.702 174.932 -0.230 1
1 128 . 9 1 1 A 18 18 VAL CA C 18 62.035 62.177 -0.142 1
1 129 . 9 1 1 A 18 18 VAL CB C 18 32.325 32.806 -0.481 1
1 132 . 9 1 1 A 18 18 VAL N N 18 127.069 124.292 2.777 1
1 133 . 9 1 1 A 19 19 THR H H 19 9.272 8.268 1.004 1
1 134 . 9 1 1 A 19 19 THR HA H 19 4.512 5.035 -0.523 1
1 139 . 9 1 1 A 19 19 THR C C 19 172.784 173.492 -0.708 1
1 140 . 9 1 1 A 19 19 THR CA C 19 62.512 61.981 0.531 1
1 141 . 9 1 1 A 19 19 THR CB C 19 70.663 70.706 -0.043 1
1 143 . 9 1 1 A 19 19 THR N N 19 126.619 121.946 4.673 1
1 144 . 9 1 1 A 20 20 ILE H H 20 8.737 9.296 -0.559 1
1 145 . 9 1 1 A 20 20 ILE HA H 20 4.870 4.734 0.136 1
1 155 . 9 1 1 A 20 20 ILE C C 20 175.315 174.349 0.966 1
1 156 . 9 1 1 A 20 20 ILE CA C 20 60.157 60.532 -0.375 1
1 157 . 9 1 1 A 20 20 ILE CB C 20 38.603 39.198 -0.595 1
1 161 . 9 1 1 A 20 20 ILE N N 20 128.114 128.539 -0.425 1
1 162 . 9 1 1 A 21 21 LEU H H 21 8.902 8.673 0.229 1
1 163 . 9 1 1 A 21 21 LEU HA H 21 4.804 4.949 -0.145 1
1 173 . 9 1 1 A 21 21 LEU C C 21 175.565 175.300 0.265 1
1 174 . 9 1 1 A 21 21 LEU CA C 21 52.731 53.411 -0.680 1
1 175 . 9 1 1 A 21 21 LEU CB C 21 43.947 43.547 0.400 1
1 179 . 9 1 1 A 21 21 LEU N N 21 125.457 128.349 -2.892 1
1 180 . 9 1 1 A 22 22 HIS H H 22 8.577 9.041 -0.464 1
1 181 . 9 1 1 A 22 22 HIS HA H 22 5.013 5.136 -0.123 1
1 186 . 9 1 1 A 22 22 HIS C C 22 174.258 175.243 -0.985 1
1 187 . 9 1 1 A 22 22 HIS CA C 22 55.880 55.252 0.628 1
1 188 . 9 1 1 A 22 22 HIS CB C 22 30.901 30.980 -0.079 1
1 191 . 9 1 1 A 22 22 HIS N N 22 122.595 123.667 -1.072 1
1 192 . 9 1 1 A 23 23 LYS H H 23 8.712 10.123 -1.411 1
1 193 . 9 1 1 A 23 23 LYS HA H 23 4.880 4.935 -0.055 1
1 202 . 9 1 1 A 23 23 LYS C C 23 174.265 175.354 -1.089 1
1 203 . 9 1 1 A 23 23 LYS CA C 23 54.314 54.185 0.129 1
1 204 . 9 1 1 A 23 23 LYS CB C 23 36.068 36.116 -0.048 1
1 208 . 9 1 1 A 23 23 LYS N N 23 120.814 121.195 -0.381 1
1 209 . 9 1 1 A 24 24 GLU H H 24 8.360 8.481 -0.121 1
1 210 . 9 1 1 A 24 24 GLU HA H 24 4.350 4.622 -0.272 1
1 215 . 9 1 1 A 24 24 GLU C C 24 177.843 176.981 0.862 1
1 216 . 9 1 1 A 24 24 GLU CA C 24 55.601 54.706 0.895 1
1 217 . 9 1 1 A 24 24 GLU CB C 24 30.512 31.480 -0.968 1
1 219 . 9 1 1 A 24 24 GLU N N 24 117.859 119.293 -1.434 1
1 220 . 9 1 1 A 25 25 GLU H H 25 9.146 8.837 0.309 1
1 221 . 9 1 1 A 25 25 GLU HA H 25 3.924 3.964 -0.040 1
1 226 . 9 1 1 A 25 25 GLU C C 25 177.809 177.608 0.201 1
1 227 . 9 1 1 A 25 25 GLU CA C 25 58.568 58.642 -0.074 1
1 228 . 9 1 1 A 25 25 GLU CB C 25 29.313 29.064 0.249 1
1 230 . 9 1 1 A 25 25 GLU N N 25 124.543 121.860 2.683 1
1 231 . 9 1 1 A 26 26 GLY H H 26 8.242 8.676 -0.434 1
1 232 . 9 1 1 A 26 26 GLY HA2 H 26 4.287 4.047 0.240 1
1 233 . 9 1 1 A 26 26 GLY HA3 H 26 3.407 4.048 -0.641 1
1 234 . 9 1 1 A 26 26 GLY C C 26 174.234 175.097 -0.863 1
1 235 . 9 1 1 A 26 26 GLY CA C 26 46.113 46.177 -0.064 1
1 236 . 9 1 1 A 26 26 GLY N N 26 115.394 114.090 1.304 1
1 237 . 9 1 1 A 27 27 ALA H H 27 7.432 8.213 -0.781 1
1 238 . 9 1 1 A 27 27 ALA HA H 27 4.402 4.304 0.098 1
1 242 . 9 1 1 A 27 27 ALA C C 27 178.138 178.033 0.105 1
1 243 . 9 1 1 A 27 27 ALA CA C 27 52.273 52.874 -0.601 1
1 244 . 9 1 1 A 27 27 ALA CB C 27 20.214 19.841 0.373 1
1 245 . 9 1 1 A 27 27 ALA N N 27 122.323 122.106 0.217 1
1 246 . 9 1 1 A 28 28 GLY H H 28 8.624 7.806 0.818 1
1 247 . 9 1 1 A 28 28 GLY HA2 H 28 4.134 4.083 0.051 1
1 248 . 9 1 1 A 28 28 GLY HA3 H 28 3.953 4.122 -0.169 1
1 249 . 9 1 1 A 28 28 GLY C C 28 174.069 174.782 -0.713 1
1 250 . 9 1 1 A 28 28 GLY CA C 28 44.546 44.492 0.054 1
1 251 . 9 1 1 A 28 28 GLY N N 28 107.593 105.452 2.141 1
1 252 . 9 1 1 A 29 29 LEU H H 29 7.934 8.545 -0.611 1
1 253 . 9 1 1 A 29 29 LEU HA H 29 4.059 4.352 -0.293 1
1 263 . 9 1 1 A 29 29 LEU C C 29 177.548 176.901 0.647 1
1 264 . 9 1 1 A 29 29 LEU CA C 29 56.298 56.241 0.057 1
1 265 . 9 1 1 A 29 29 LEU CB C 29 41.940 42.777 -0.837 1
1 269 . 9 1 1 A 29 29 LEU N N 29 115.495 121.204 -5.709 1
1 270 . 9 1 1 A 30 30 GLY H H 30 8.669 8.127 0.542 1
1 271 . 9 1 1 A 30 30 GLY HA2 H 30 4.264 4.063 0.201 1
1 272 . 9 1 1 A 30 30 GLY HA3 H 30 4.001 4.154 -0.153 1
1 273 . 9 1 1 A 30 30 GLY C C 30 175.296 173.067 2.229 1
1 274 . 9 1 1 A 30 30 GLY CA C 30 46.368 44.957 1.411 1
1 275 . 9 1 1 A 30 30 GLY N N 30 103.121 106.035 -2.914 1
1 276 . 9 1 1 A 31 31 PHE H H 31 7.044 7.200 -0.156 1
1 277 . 9 1 1 A 31 31 PHE HA H 31 4.541 4.704 -0.163 1
1 285 . 9 1 1 A 31 31 PHE C C 31 171.141 172.185 -1.044 1
1 286 . 9 1 1 A 31 31 PHE CA C 31 55.704 55.278 0.426 1
1 287 . 9 1 1 A 31 31 PHE CB C 31 40.745 41.498 -0.753 1
1 293 . 9 1 1 A 31 31 PHE N N 31 115.404 114.925 0.479 1
1 294 . 9 1 1 A 32 32 SER H H 32 8.752 8.809 -0.057 1
1 295 . 9 1 1 A 32 32 SER HA H 32 4.990 4.966 0.024 1
1 298 . 9 1 1 A 32 32 SER C C 32 175.049 172.916 2.133 1
1 299 . 9 1 1 A 32 32 SER CA C 32 55.001 56.208 -1.207 1
1 300 . 9 1 1 A 32 32 SER CB C 32 67.170 66.777 0.393 1
1 301 . 9 1 1 A 32 32 SER N N 32 113.639 114.893 -1.254 1
1 302 . 9 1 1 A 33 33 LEU H H 33 8.639 8.319 0.320 1
1 303 . 9 1 1 A 33 33 LEU HA H 33 5.573 5.069 0.504 1
1 313 . 9 1 1 A 33 33 LEU C C 33 175.827 176.037 -0.210 1
1 314 . 9 1 1 A 33 33 LEU CA C 33 53.620 53.922 -0.302 1
1 315 . 9 1 1 A 33 33 LEU CB C 33 45.399 43.829 1.570 1
1 319 . 9 1 1 A 33 33 LEU N N 33 118.936 124.327 -5.391 1
1 320 . 9 1 1 A 34 34 ALA H H 34 9.410 8.808 0.602 1
1 321 . 9 1 1 A 34 34 ALA HA H 34 4.749 5.134 -0.385 1
1 325 . 9 1 1 A 34 34 ALA C C 34 176.231 176.051 0.180 1
1 326 . 9 1 1 A 34 34 ALA CA C 34 50.425 51.509 -1.084 1
1 327 . 9 1 1 A 34 34 ALA CB C 34 22.518 22.887 -0.369 1
1 328 . 9 1 1 A 34 34 ALA N N 34 124.395 122.039 2.356 1
1 329 . 9 1 1 A 35 35 GLY H H 35 8.130 8.239 -0.109 1
1 330 . 9 1 1 A 35 35 GLY HA2 H 35 4.712 4.088 0.624 1
1 331 . 9 1 1 A 35 35 GLY HA3 H 35 3.955 4.165 -0.210 1
1 332 . 9 1 1 A 35 35 GLY C C 35 174.750 172.653 2.097 1
1 333 . 9 1 1 A 35 35 GLY CA C 35 44.494 44.114 0.380 1
1 334 . 9 1 1 A 35 35 GLY N N 35 103.650 108.707 -5.057 1
1 335 . 9 1 1 A 36 36 GLY H H 36 8.217 7.611 0.606 1
1 336 . 9 1 1 A 36 36 GLY HA2 H 36 4.494 4.248 0.246 1
1 337 . 9 1 1 A 36 36 GLY HA3 H 36 3.836 4.271 -0.435 1
1 338 . 9 1 1 A 36 36 GLY C C 36 174.410 174.656 -0.246 1
1 339 . 9 1 1 A 36 36 GLY CA C 36 45.462 45.737 -0.275 1
1 340 . 9 1 1 A 36 36 GLY N N 36 122.114 107.592 14.522 1
1 341 . 9 1 1 A 37 37 ALA H H 37 8.963 8.781 0.182 1
1 342 . 9 1 1 A 37 37 ALA HA H 37 3.998 4.016 -0.018 1
1 346 . 9 1 1 A 37 37 ALA C C 37 176.935 179.092 -2.157 1
1 347 . 9 1 1 A 37 37 ALA CA C 37 55.308 54.651 0.657 1
1 348 . 9 1 1 A 37 37 ALA CB C 37 18.822 18.376 0.446 1
1 349 . 9 1 1 A 37 37 ALA N N 37 123.418 124.493 -1.075 1
1 350 . 9 1 1 A 38 38 ASP H H 38 10.586 8.265 2.321 1
1 351 . 9 1 1 A 38 38 ASP HA H 38 4.485 4.365 0.120 1
1 354 . 9 1 1 A 38 38 ASP C C 38 175.309 176.512 -1.203 1
1 355 . 9 1 1 A 38 38 ASP CA C 38 52.730 56.405 -3.675 1
1 356 . 9 1 1 A 38 38 ASP CB C 38 38.689 41.030 -2.341 1
1 357 . 9 1 1 A 38 38 ASP N N 38 111.480 117.648 -6.168 1
1 358 . 9 1 1 A 39 39 LEU H H 39 7.789 7.880 -0.091 1
1 359 . 9 1 1 A 39 39 LEU HA H 39 4.699 4.380 0.319 1
1 369 . 9 1 1 A 39 39 LEU C C 39 176.377 177.920 -1.543 1
1 370 . 9 1 1 A 39 39 LEU CA C 39 52.952 54.156 -1.204 1
1 371 . 9 1 1 A 39 39 LEU CB C 39 43.294 41.821 1.473 1
1 375 . 9 1 1 A 39 39 LEU N N 39 122.545 121.200 1.345 1
1 376 . 9 1 1 A 40 40 GLU H H 40 8.331 8.546 -0.215 1
1 377 . 9 1 1 A 40 40 GLU HA H 40 3.978 4.076 -0.098 1
1 382 . 9 1 1 A 40 40 GLU C C 40 176.887 177.165 -0.278 1
1 383 . 9 1 1 A 40 40 GLU CA C 40 59.066 59.584 -0.518 1
1 384 . 9 1 1 A 40 40 GLU CB C 40 29.523 30.143 -0.620 1
1 386 . 9 1 1 A 40 40 GLU N N 40 118.036 120.329 -2.293 1
1 387 . 9 1 1 A 41 41 ASN H H 41 7.890 8.079 -0.189 1
1 388 . 9 1 1 A 41 41 ASN HA H 41 4.820 4.862 -0.042 1
1 393 . 9 1 1 A 41 41 ASN CA C 41 52.316 52.132 0.184 1
1 394 . 9 1 1 A 41 41 ASN CB C 41 37.409 39.844 -2.435 1
1 395 . 9 1 1 A 41 41 ASN N N 41 115.196 117.234 -2.038 1
1 397 . 9 1 1 A 42 42 LYS H H 42 7.943 8.716 -0.773 1
1 398 . 9 1 1 A 42 42 LYS HA H 42 4.328 4.548 -0.220 1
1 407 . 9 1 1 A 42 42 LYS C C 42 177.081 176.144 0.937 1
1 408 . 9 1 1 A 42 42 LYS CA C 42 56.567 56.131 0.436 1
1 409 . 9 1 1 A 42 42 LYS CB C 42 33.120 34.269 -1.149 1
1 413 . 9 1 1 A 42 42 LYS N N 42 120.612 119.619 0.993 1
1 414 . 9 1 1 A 43 43 VAL H H 43 7.456 7.494 -0.038 1
1 415 . 9 1 1 A 43 43 VAL HA H 43 4.059 4.197 -0.138 1
1 423 . 9 1 1 A 43 43 VAL CA C 43 61.330 61.704 -0.374 1
1 424 . 9 1 1 A 43 43 VAL CB C 43 32.819 32.452 0.367 1
1 427 . 9 1 1 A 43 43 VAL N N 43 118.284 119.556 -1.272 1
1 428 . 9 1 1 A 44 44 ILE H H 44 8.481 8.729 -0.248 1
1 429 . 9 1 1 A 44 44 ILE HA H 44 4.913 4.645 0.268 1
1 439 . 9 1 1 A 44 44 ILE C C 44 176.719 175.759 0.960 1
1 440 . 9 1 1 A 44 44 ILE CA C 44 59.946 62.374 -2.428 1
1 441 . 9 1 1 A 44 44 ILE CB C 44 35.784 37.153 -1.369 1
1 445 . 9 1 1 A 44 44 ILE N N 44 127.089 128.549 -1.460 1
1 446 . 9 1 1 A 45 45 THR H H 45 8.906 9.102 -0.196 1
1 447 . 9 1 1 A 45 45 THR HA H 45 5.400 5.549 -0.149 1
1 452 . 9 1 1 A 45 45 THR CA C 45 58.528 59.870 -1.342 1
1 453 . 9 1 1 A 45 45 THR CB C 45 73.760 71.474 2.286 1
1 455 . 9 1 1 A 45 45 THR N N 45 116.832 119.321 -2.489 1
1 456 . 9 1 1 A 46 46 VAL H H 46 8.336 8.591 -0.255 1
1 457 . 9 1 1 A 46 46 VAL HA H 46 4.059 4.160 -0.101 1
1 465 . 9 1 1 A 46 46 VAL C C 46 176.648 176.818 -0.170 1
1 466 . 9 1 1 A 46 46 VAL CA C 46 63.058 63.244 -0.186 1
1 467 . 9 1 1 A 46 46 VAL CB C 46 31.601 30.986 0.615 1
1 470 . 9 1 1 A 46 46 VAL N N 46 118.542 122.323 -3.781 1
1 471 . 9 1 1 A 47 47 HIS H H 47 9.382 8.766 0.616 1
1 472 . 9 1 1 A 47 47 HIS HA H 47 4.628 4.184 0.444 1
1 477 . 9 1 1 A 47 47 HIS C C 47 174.339 174.599 -0.260 1
1 478 . 9 1 1 A 47 47 HIS CA C 47 57.764 60.105 -2.341 1
1 479 . 9 1 1 A 47 47 HIS CB C 47 31.453 30.618 0.835 1
1 482 . 9 1 1 A 47 47 HIS N N 47 133.900 128.169 5.731 1
1 483 . 9 1 1 A 48 48 ARG H H 48 7.135 7.741 -0.606 1
1 484 . 9 1 1 A 48 48 ARG HA H 48 4.360 4.681 -0.321 1
1 491 . 9 1 1 A 48 48 ARG C C 48 173.877 174.494 -0.617 1
1 492 . 9 1 1 A 48 48 ARG CA C 48 54.385 54.975 -0.590 1
1 493 . 9 1 1 A 48 48 ARG CB C 48 33.996 34.333 -0.337 1
1 496 . 9 1 1 A 48 48 ARG N N 48 114.736 117.681 -2.945 1
1 497 . 9 1 1 A 49 49 VAL H H 49 8.690 8.697 -0.007 1
1 498 . 9 1 1 A 49 49 VAL HA H 49 4.015 4.444 -0.429 1
1 506 . 9 1 1 A 49 49 VAL C C 49 176.255 175.462 0.793 1
1 507 . 9 1 1 A 49 49 VAL CA C 49 61.882 61.561 0.321 1
1 508 . 9 1 1 A 49 49 VAL CB C 49 32.261 32.713 -0.452 1
1 511 . 9 1 1 A 49 49 VAL N N 49 122.844 122.414 0.430 1
1 512 . 9 1 1 A 50 50 PHE H H 50 7.866 8.707 -0.841 1
1 513 . 9 1 1 A 50 50 PHE HA H 50 4.866 4.444 0.422 1
1 521 . 9 1 1 A 50 50 PHE C C 50 174.847 176.131 -1.284 1
1 522 . 9 1 1 A 50 50 PHE CA C 50 54.596 57.519 -2.923 1
1 523 . 9 1 1 A 50 50 PHE CB C 50 36.558 39.133 -2.575 1
1 529 . 9 1 1 A 50 50 PHE N N 50 128.498 127.421 1.077 1
1 530 . 9 1 1 A 51 51 PRO HA H 51 4.386 4.569 -0.183 1
1 537 . 9 1 1 A 51 51 PRO C C 51 177.321 176.655 0.666 1
1 538 . 9 1 1 A 51 51 PRO CA C 51 64.381 64.534 -0.153 1
1 539 . 9 1 1 A 51 51 PRO CB C 51 31.773 32.097 -0.324 1
1 542 . 9 1 1 A 52 52 ASN H H 52 8.814 8.555 0.259 1
1 543 . 9 1 1 A 52 52 ASN HA H 52 4.496 4.992 -0.496 1
1 548 . 9 1 1 A 52 52 ASN C C 52 174.823 174.692 0.131 1
1 549 . 9 1 1 A 52 52 ASN CA C 52 54.719 52.222 2.497 1
1 550 . 9 1 1 A 52 52 ASN CB C 52 38.109 39.250 -1.141 1
1 551 . 9 1 1 A 52 52 ASN N N 52 116.145 116.224 -0.079 1
1 553 . 9 1 1 A 53 53 GLY H H 53 7.730 8.230 -0.500 1
1 554 . 9 1 1 A 53 53 GLY HA2 H 53 4.430 4.372 0.058 1
1 555 . 9 1 1 A 53 53 GLY HA3 H 53 4.089 4.388 -0.299 1
1 556 . 9 1 1 A 53 53 GLY C C 53 174.810 173.809 1.001 1
1 557 . 9 1 1 A 53 53 GLY CA C 53 44.987 45.928 -0.941 1
1 558 . 9 1 1 A 53 53 GLY N N 53 106.196 110.673 -4.477 1
1 559 . 9 1 1 A 54 54 LEU H H 54 8.764 8.904 -0.140 1
1 560 . 9 1 1 A 54 54 LEU HA H 54 4.041 4.174 -0.133 1
1 570 . 9 1 1 A 54 54 LEU C C 54 179.712 178.531 1.181 1
1 571 . 9 1 1 A 54 54 LEU CA C 54 58.310 57.779 0.531 1
1 572 . 9 1 1 A 54 54 LEU CB C 54 42.390 42.088 0.302 1
1 576 . 9 1 1 A 54 54 LEU N N 54 118.836 119.756 -0.920 1
1 577 . 9 1 1 A 55 55 ALA H H 55 7.593 7.993 -0.400 1
1 578 . 9 1 1 A 55 55 ALA HA H 55 4.275 4.263 0.012 1
1 582 . 9 1 1 A 55 55 ALA C C 55 181.307 179.885 1.422 1
1 583 . 9 1 1 A 55 55 ALA CA C 55 54.825 54.839 -0.014 1
1 584 . 9 1 1 A 55 55 ALA CB C 55 18.345 18.270 0.075 1
1 585 . 9 1 1 A 55 55 ALA N N 55 118.782 121.004 -2.222 1
1 586 . 9 1 1 A 56 56 SER H H 56 9.339 7.883 1.456 1
1 587 . 9 1 1 A 56 56 SER HA H 56 4.023 4.156 -0.133 1
1 589 . 9 1 1 A 56 56 SER C C 56 176.392 177.195 -0.803 1
1 590 . 9 1 1 A 56 56 SER CA C 56 60.984 61.619 -0.635 1
1 591 . 9 1 1 A 56 56 SER CB C 56 62.987 63.081 -0.094 1
1 592 . 9 1 1 A 56 56 SER N N 56 117.631 114.699 2.932 1
1 593 . 9 1 1 A 57 57 GLN H H 57 7.942 7.922 0.020 1
1 594 . 9 1 1 A 57 57 GLN HA H 57 4.034 3.976 0.058 1
1 601 . 9 1 1 A 57 57 GLN C C 57 177.400 178.270 -0.870 1
1 602 . 9 1 1 A 57 57 GLN CA C 57 58.362 58.978 -0.616 1
1 603 . 9 1 1 A 57 57 GLN CB C 57 28.801 28.510 0.291 1
1 605 . 9 1 1 A 57 57 GLN N N 57 118.162 121.990 -3.828 1
1 607 . 9 1 1 A 58 58 GLU H H 58 7.683 8.292 -0.609 1
1 608 . 9 1 1 A 58 58 GLU HA H 58 4.163 4.189 -0.026 1
1 613 . 9 1 1 A 58 58 GLU C C 58 179.248 177.423 1.825 1
1 614 . 9 1 1 A 58 58 GLU CA C 58 59.559 57.312 2.247 1
1 615 . 9 1 1 A 58 58 GLU CB C 58 29.317 30.576 -1.259 1
1 617 . 9 1 1 A 58 58 GLU N N 58 119.877 116.816 3.061 1
1 618 . 9 1 1 A 59 59 GLY H H 59 7.446 7.661 -0.215 1
1 619 . 9 1 1 A 59 59 GLY HA2 H 59 4.100 3.935 0.165 1
1 620 . 9 1 1 A 59 59 GLY HA3 H 59 3.770 3.938 -0.168 1
1 621 . 9 1 1 A 59 59 GLY C C 59 175.432 175.003 0.429 1
1 622 . 9 1 1 A 59 59 GLY CA C 59 46.817 45.810 1.007 1
1 623 . 9 1 1 A 59 59 GLY N N 59 102.653 108.788 -6.135 1
1 624 . 9 1 1 A 60 60 THR H H 60 8.343 7.989 0.354 1
1 625 . 9 1 1 A 60 60 THR HA H 60 4.037 4.035 0.002 1
1 630 . 9 1 1 A 60 60 THR C C 60 175.843 174.844 0.999 1
1 631 . 9 1 1 A 60 60 THR CA C 60 64.792 65.829 -1.037 1
1 632 . 9 1 1 A 60 60 THR CB C 60 69.325 68.886 0.439 1
1 634 . 9 1 1 A 60 60 THR N N 60 113.863 113.746 0.117 1
1 635 . 9 1 1 A 61 61 ILE H H 61 8.802 7.837 0.965 1
1 636 . 9 1 1 A 61 61 ILE HA H 61 3.631 4.125 -0.494 1
1 646 . 9 1 1 A 61 61 ILE C C 61 174.198 174.404 -0.206 1
1 647 . 9 1 1 A 61 61 ILE CA C 61 62.938 60.686 2.252 1
1 648 . 9 1 1 A 61 61 ILE CB C 61 37.225 36.379 0.846 1
1 652 . 9 1 1 A 61 61 ILE N N 61 126.153 119.280 6.873 1
1 653 . 9 1 1 A 62 62 GLN H H 62 7.124 9.110 -1.986 1
1 654 . 9 1 1 A 62 62 GLN HA H 62 4.500 4.579 -0.079 1
1 661 . 9 1 1 A 62 62 GLN C C 62 174.556 175.480 -0.924 1
1 662 . 9 1 1 A 62 62 GLN CA C 62 53.364 54.140 -0.776 1
1 663 . 9 1 1 A 62 62 GLN CB C 62 32.196 30.646 1.550 1
1 665 . 9 1 1 A 62 62 GLN N N 62 123.730 126.322 -2.592 1
1 667 . 9 1 1 A 63 63 LYS H H 63 8.399 8.480 -0.081 1
1 668 . 9 1 1 A 63 63 LYS HA H 63 3.464 4.578 -1.114 1
1 677 . 9 1 1 A 63 63 LYS CA C 63 57.905 57.080 0.825 1
1 678 . 9 1 1 A 63 63 LYS CB C 63 32.260 32.123 0.137 1
1 682 . 9 1 1 A 63 63 LYS N N 63 121.381 123.524 -2.143 1
1 683 . 9 1 1 A 64 64 GLY H H 64 9.265 9.128 0.137 1
1 684 . 9 1 1 A 64 64 GLY HA2 H 64 4.415 3.957 0.458 1
1 685 . 9 1 1 A 64 64 GLY HA3 H 64 3.639 3.963 -0.324 1
1 686 . 9 1 1 A 64 64 GLY CA C 64 44.881 45.435 -0.554 1
1 687 . 9 1 1 A 64 64 GLY N N 64 113.750 112.253 1.497 1
1 688 . 9 1 1 A 65 65 ASN H H 65 7.594 7.830 -0.236 1
1 689 . 9 1 1 A 65 65 ASN HA H 65 4.798 4.869 -0.071 1
1 694 . 9 1 1 A 65 65 ASN C C 65 175.042 174.810 0.232 1
1 695 . 9 1 1 A 65 65 ASN CA C 65 53.047 52.644 0.403 1
1 696 . 9 1 1 A 65 65 ASN CB C 65 38.153 38.913 -0.760 1
1 697 . 9 1 1 A 65 65 ASN N N 65 117.999 118.981 -0.982 1
1 699 . 9 1 1 A 66 66 GLU H H 66 8.538 8.555 -0.017 1
1 700 . 9 1 1 A 66 66 GLU HA H 66 4.634 4.415 0.219 1
1 705 . 9 1 1 A 66 66 GLU C C 66 176.620 175.314 1.306 1
1 706 . 9 1 1 A 66 66 GLU CA C 66 55.863 56.685 -0.822 1
1 707 . 9 1 1 A 66 66 GLU CB C 66 30.899 29.892 1.007 1
1 709 . 9 1 1 A 66 66 GLU N N 66 122.233 124.780 -2.547 1
1 710 . 9 1 1 A 67 67 VAL H H 67 8.452 9.442 -0.990 1
1 711 . 9 1 1 A 67 67 VAL HA H 67 4.172 4.117 0.055 1
1 719 . 9 1 1 A 67 67 VAL C C 67 174.641 175.555 -0.914 1
1 720 . 9 1 1 A 67 67 VAL CA C 67 61.856 62.868 -1.012 1
1 721 . 9 1 1 A 67 67 VAL CB C 67 31.066 30.476 0.590 1
1 724 . 9 1 1 A 67 67 VAL N N 67 126.311 128.365 -2.054 1
1 725 . 9 1 1 A 68 68 LEU H H 68 9.000 8.374 0.626 1
1 726 . 9 1 1 A 68 68 LEU HA H 68 4.390 3.894 0.496 1
1 736 . 9 1 1 A 68 68 LEU C C 68 178.924 176.837 2.087 1
1 737 . 9 1 1 A 68 68 LEU CA C 68 56.990 57.925 -0.935 1
1 738 . 9 1 1 A 68 68 LEU CB C 68 42.392 41.997 0.395 1
1 742 . 9 1 1 A 68 68 LEU N N 68 127.175 130.447 -3.272 1
1 743 . 9 1 1 A 69 69 SER H H 69 7.666 7.714 -0.048 1
1 744 . 9 1 1 A 69 69 SER HA H 69 5.144 4.890 0.254 1
1 747 . 9 1 1 A 69 69 SER C C 69 172.722 172.301 0.421 1
1 748 . 9 1 1 A 69 69 SER CA C 69 57.606 57.293 0.313 1
1 749 . 9 1 1 A 69 69 SER CB C 69 64.511 66.439 -1.928 1
1 750 . 9 1 1 A 69 69 SER N N 69 110.346 108.890 1.456 1
1 751 . 9 1 1 A 70 70 ILE H H 70 7.965 8.319 -0.354 1
1 752 . 9 1 1 A 70 70 ILE HA H 70 4.548 4.923 -0.375 1
1 762 . 9 1 1 A 70 70 ILE C C 70 174.993 175.866 -0.873 1
1 763 . 9 1 1 A 70 70 ILE CA C 70 60.897 60.267 0.630 1
1 764 . 9 1 1 A 70 70 ILE CB C 70 41.186 40.520 0.666 1
1 768 . 9 1 1 A 70 70 ILE N N 70 119.579 120.244 -0.665 1
1 769 . 9 1 1 A 71 71 ASN H H 71 9.839 10.061 -0.222 1
1 770 . 9 1 1 A 71 71 ASN HA H 71 4.485 4.450 0.035 1
1 775 . 9 1 1 A 71 71 ASN C C 71 174.975 175.365 -0.390 1
1 776 . 9 1 1 A 71 71 ASN CA C 71 54.085 54.442 -0.357 1
1 777 . 9 1 1 A 71 71 ASN CB C 71 36.255 36.904 -0.649 1
1 778 . 9 1 1 A 71 71 ASN N N 71 126.963 127.136 -0.173 1
1 780 . 9 1 1 A 72 72 GLY H H 72 8.911 8.407 0.504 1
1 781 . 9 1 1 A 72 72 GLY HA2 H 72 4.149 3.917 0.232 1
1 782 . 9 1 1 A 72 72 GLY HA3 H 72 3.507 3.919 -0.412 1
1 783 . 9 1 1 A 72 72 GLY C C 72 173.594 174.069 -0.475 1
1 784 . 9 1 1 A 72 72 GLY CA C 72 45.162 45.313 -0.151 1
1 785 . 9 1 1 A 72 72 GLY N N 72 103.020 105.279 -2.259 1
1 786 . 9 1 1 A 73 73 LYS H H 73 7.922 7.611 0.311 1
1 787 . 9 1 1 A 73 73 LYS HA H 73 4.485 4.321 0.164 1
1 796 . 9 1 1 A 73 73 LYS C C 73 175.036 175.925 -0.889 1
1 797 . 9 1 1 A 73 73 LYS CA C 73 54.719 55.489 -0.770 1
1 798 . 9 1 1 A 73 73 LYS CB C 73 32.137 31.808 0.329 1
1 802 . 9 1 1 A 73 73 LYS N N 73 122.413 120.557 1.856 1
1 803 . 9 1 1 A 74 74 SER H H 74 8.585 8.842 -0.257 1
1 804 . 9 1 1 A 74 74 SER HA H 74 4.452 4.685 -0.233 1
1 807 . 9 1 1 A 74 74 SER C C 74 175.965 173.918 2.047 1
1 808 . 9 1 1 A 74 74 SER CA C 74 58.028 58.827 -0.799 1
1 809 . 9 1 1 A 74 74 SER CB C 74 63.799 63.746 0.053 1
1 810 . 9 1 1 A 74 74 SER N N 74 118.737 122.321 -3.584 1
1 811 . 9 1 1 A 75 75 LEU H H 75 8.015 8.189 -0.174 1
1 812 . 9 1 1 A 75 75 LEU HA H 75 4.661 4.338 0.323 1
1 822 . 9 1 1 A 75 75 LEU C C 75 178.117 177.393 0.724 1
1 823 . 9 1 1 A 75 75 LEU CA C 75 53.980 54.665 -0.685 1
1 824 . 9 1 1 A 75 75 LEU CB C 75 40.830 40.750 0.080 1
1 828 . 9 1 1 A 75 75 LEU N N 75 125.425 126.658 -1.233 1
1 829 . 9 1 1 A 76 76 LYS H H 76 8.099 8.294 -0.195 1
1 830 . 9 1 1 A 76 76 LYS HA H 76 4.210 4.409 -0.199 1
1 839 . 9 1 1 A 76 76 LYS C C 76 178.487 176.757 1.730 1
1 840 . 9 1 1 A 76 76 LYS CA C 76 58.010 55.473 2.537 1
1 841 . 9 1 1 A 76 76 LYS CB C 76 31.683 31.632 0.051 1
1 845 . 9 1 1 A 76 76 LYS N N 76 124.064 120.596 3.468 1
1 846 . 9 1 1 A 77 77 GLY H H 77 8.859 7.846 1.013 1
1 847 . 9 1 1 A 77 77 GLY HA2 H 77 4.110 4.064 0.046 1
1 848 . 9 1 1 A 77 77 GLY HA3 H 77 3.869 4.067 -0.198 1
1 849 . 9 1 1 A 77 77 GLY C C 77 174.335 174.719 -0.384 1
1 850 . 9 1 1 A 77 77 GLY CA C 77 46.232 44.933 1.299 1
1 851 . 9 1 1 A 77 77 GLY N N 77 115.659 108.702 6.957 1
1 852 . 9 1 1 A 78 78 THR H H 78 7.654 7.755 -0.101 1
1 853 . 9 1 1 A 78 78 THR HA H 78 4.624 4.162 0.462 1
1 858 . 9 1 1 A 78 78 THR C C 78 177.272 174.728 2.544 1
1 859 . 9 1 1 A 78 78 THR CA C 78 61.794 63.396 -1.602 1
1 860 . 9 1 1 A 78 78 THR CB C 78 70.595 69.204 1.391 1
1 862 . 9 1 1 A 78 78 THR N N 78 112.847 116.694 -3.847 1
1 863 . 9 1 1 A 79 79 THR H H 79 8.813 8.539 0.274 1
1 864 . 9 1 1 A 79 79 THR HA H 79 4.395 4.761 -0.366 1
1 869 . 9 1 1 A 79 79 THR C C 79 174.503 175.465 -0.962 1
1 870 . 9 1 1 A 79 79 THR CA C 79 61.724 60.822 0.902 1
1 871 . 9 1 1 A 79 79 THR CB C 79 71.007 70.853 0.154 1
1 873 . 9 1 1 A 79 79 THR N N 79 114.123 118.007 -3.884 1
1 874 . 9 1 1 A 80 80 HIS H H 80 10.266 9.228 1.038 1
1 875 . 9 1 1 A 80 80 HIS HA H 80 4.331 4.457 -0.126 1
1 880 . 9 1 1 A 80 80 HIS C C 80 177.075 176.887 0.188 1
1 881 . 9 1 1 A 80 80 HIS CA C 80 61.338 60.309 1.029 1
1 882 . 9 1 1 A 80 80 HIS CB C 80 28.651 30.654 -2.003 1
1 885 . 9 1 1 A 80 80 HIS N N 80 122.776 121.993 0.783 1
1 886 . 9 1 1 A 81 81 HIS H H 81 9.335 8.135 1.200 1
1 887 . 9 1 1 A 81 81 HIS HA H 81 4.078 4.023 0.055 1
1 892 . 9 1 1 A 81 81 HIS C C 81 178.269 176.647 1.622 1
1 893 . 9 1 1 A 81 81 HIS CA C 81 60.210 59.794 0.416 1
1 894 . 9 1 1 A 81 81 HIS CB C 81 29.569 29.779 -0.210 1
1 897 . 9 1 1 A 81 81 HIS N N 81 114.733 118.880 -4.147 1
1 898 . 9 1 1 A 82 82 ASP H H 82 7.741 8.161 -0.420 1
1 899 . 9 1 1 A 82 82 ASP HA H 82 4.452 4.189 0.263 1
1 902 . 9 1 1 A 82 82 ASP C C 82 178.683 178.699 -0.016 1
1 903 . 9 1 1 A 82 82 ASP CA C 82 57.148 57.137 0.011 1
1 904 . 9 1 1 A 82 82 ASP CB C 82 39.522 40.554 -1.032 1
1 905 . 9 1 1 A 82 82 ASP N N 82 121.407 118.204 3.203 1
1 906 . 9 1 1 A 83 83 ALA H H 83 8.502 8.318 0.184 1
1 907 . 9 1 1 A 83 83 ALA HA H 83 3.939 4.263 -0.324 1
1 911 . 9 1 1 A 83 83 ALA C C 83 179.361 179.228 0.133 1
1 912 . 9 1 1 A 83 83 ALA CA C 83 55.635 54.666 0.969 1
1 913 . 9 1 1 A 83 83 ALA CB C 83 18.124 19.280 -1.156 1
1 914 . 9 1 1 A 83 83 ALA N N 83 125.049 122.691 2.358 1
1 915 . 9 1 1 A 84 84 LEU H H 84 8.100 9.112 -1.012 1
1 916 . 9 1 1 A 84 84 LEU HA H 84 3.792 3.821 -0.029 1
1 926 . 9 1 1 A 84 84 LEU C C 84 180.173 179.088 1.085 1
1 927 . 9 1 1 A 84 84 LEU CA C 84 57.932 57.950 -0.018 1
1 928 . 9 1 1 A 84 84 LEU CB C 84 41.157 41.392 -0.235 1
1 932 . 9 1 1 A 84 84 LEU N N 84 117.139 118.245 -1.106 1
1 933 . 9 1 1 A 85 85 ALA H H 85 7.715 8.649 -0.934 1
1 934 . 9 1 1 A 85 85 ALA HA H 85 4.061 4.116 -0.055 1
1 938 . 9 1 1 A 85 85 ALA C C 85 180.380 179.778 0.602 1
1 939 . 9 1 1 A 85 85 ALA CA C 85 55.212 55.394 -0.182 1
1 940 . 9 1 1 A 85 85 ALA CB C 85 17.803 18.563 -0.760 1
1 941 . 9 1 1 A 85 85 ALA N N 85 122.448 121.323 1.125 1
1 942 . 9 1 1 A 86 86 ILE H H 86 7.669 7.708 -0.039 1
1 943 . 9 1 1 A 86 86 ILE HA H 86 3.678 3.733 -0.055 1
1 953 . 9 1 1 A 86 86 ILE C C 86 178.692 178.838 -0.146 1
1 954 . 9 1 1 A 86 86 ILE CA C 86 65.226 64.663 0.563 1
1 955 . 9 1 1 A 86 86 ILE CB C 86 38.099 37.803 0.296 1
1 959 . 9 1 1 A 86 86 ILE N N 86 121.804 117.835 3.969 1
1 960 . 9 1 1 A 87 87 LEU H H 87 7.922 8.385 -0.463 1
1 961 . 9 1 1 A 87 87 LEU HA H 87 3.903 4.031 -0.128 1
1 971 . 9 1 1 A 87 87 LEU C C 87 178.610 178.685 -0.075 1
1 972 . 9 1 1 A 87 87 LEU CA C 87 58.221 57.919 0.302 1
1 973 . 9 1 1 A 87 87 LEU CB C 87 42.344 41.524 0.820 1
1 977 . 9 1 1 A 87 87 LEU N N 87 121.947 121.730 0.217 1
1 978 . 9 1 1 A 88 88 ARG H H 88 8.317 8.277 0.040 1
1 979 . 9 1 1 A 88 88 ARG HA H 88 4.060 4.189 -0.129 1
1 986 . 9 1 1 A 88 88 ARG C C 88 180.698 177.184 3.514 1
1 987 . 9 1 1 A 88 88 ARG CA C 88 59.383 58.508 0.875 1
1 988 . 9 1 1 A 88 88 ARG CB C 88 30.055 29.894 0.161 1
1 991 . 9 1 1 A 88 88 ARG N N 88 119.343 119.452 -0.109 1
1 992 . 9 1 1 A 89 89 GLN H H 89 8.270 7.649 0.621 1
1 993 . 9 1 1 A 89 89 GLN HA H 89 4.122 4.195 -0.073 1
1 1000 . 9 1 1 A 89 89 GLN C C 89 177.955 178.153 -0.198 1
1 1001 . 9 1 1 A 89 89 GLN CA C 89 58.714 57.706 1.008 1
1 1002 . 9 1 1 A 89 89 GLN CB C 89 28.160 28.956 -0.796 1
1 1004 . 9 1 1 A 89 89 GLN N N 89 121.097 117.464 3.633 1
1 1006 . 9 1 1 A 90 90 ALA H H 90 7.558 7.388 0.170 1
1 1007 . 9 1 1 A 90 90 ALA HA H 90 4.123 4.166 -0.043 1
1 1011 . 9 1 1 A 90 90 ALA C C 90 178.076 178.085 -0.009 1
1 1012 . 9 1 1 A 90 90 ALA CA C 90 52.942 53.760 -0.818 1
1 1013 . 9 1 1 A 90 90 ALA CB C 90 18.015 18.318 -0.303 1
1 1014 . 9 1 1 A 90 90 ALA N N 90 119.652 121.811 -2.159 1
1 1015 . 9 1 1 A 91 91 ARG H H 91 7.768 8.105 -0.337 1
1 1016 . 9 1 1 A 91 91 ARG HA H 91 4.065 4.284 -0.219 1
1 1022 . 9 1 1 A 91 91 ARG C C 91 177.858 177.465 0.393 1
1 1023 . 9 1 1 A 91 91 ARG CA C 91 58.573 57.400 1.173 1
1 1024 . 9 1 1 A 91 91 ARG CB C 91 30.384 30.706 -0.322 1
1 1027 . 9 1 1 A 91 91 ARG N N 91 118.081 116.864 1.217 1
1 1028 . 9 1 1 A 92 92 GLU H H 92 7.691 7.923 -0.232 1
1 1029 . 9 1 1 A 92 92 GLU HA H 92 4.123 4.182 -0.059 1
1 1034 . 9 1 1 A 92 92 GLU C C 92 174.459 176.586 -2.127 1
1 1035 . 9 1 1 A 92 92 GLU CA C 92 61.565 60.659 0.906 1
1 1036 . 9 1 1 A 92 92 GLU CB C 92 27.583 29.332 -1.749 1
1 1038 . 9 1 1 A 92 92 GLU N N 92 118.447 118.609 -0.162 1
1 1039 . 9 1 1 A 93 93 PRO HA H 93 4.716 4.574 0.142 1
1 1046 . 9 1 1 A 93 93 PRO C C 93 176.221 176.210 0.011 1
1 1047 . 9 1 1 A 93 93 PRO CA C 93 63.149 62.338 0.811 1
1 1048 . 9 1 1 A 93 93 PRO CB C 93 32.571 33.226 -0.655 1
1 1051 . 9 1 1 A 94 94 ARG H H 94 8.434 8.983 -0.549 1
1 1052 . 9 1 1 A 94 94 ARG HA H 94 4.232 4.418 -0.186 1
1 1058 . 9 1 1 A 94 94 ARG C C 94 175.323 176.127 -0.804 1
1 1059 . 9 1 1 A 94 94 ARG CA C 94 56.972 56.566 0.406 1
1 1060 . 9 1 1 A 94 94 ARG CB C 94 30.448 31.370 -0.922 1
1 1063 . 9 1 1 A 94 94 ARG N N 94 115.987 118.758 -2.771 1
1 1064 . 9 1 1 A 95 95 GLN H H 95 7.246 7.596 -0.350 1
1 1065 . 9 1 1 A 95 95 GLN HA H 95 5.251 5.282 -0.031 1
1 1072 . 9 1 1 A 95 95 GLN C C 95 174.786 173.596 1.190 1
1 1073 . 9 1 1 A 95 95 GLN CA C 95 54.209 54.419 -0.210 1
1 1074 . 9 1 1 A 95 95 GLN CB C 95 32.384 32.129 0.255 1
1 1076 . 9 1 1 A 95 95 GLN N N 95 115.998 120.215 -4.217 1
1 1078 . 9 1 1 A 96 96 ALA H H 96 8.739 8.599 0.140 1
1 1079 . 9 1 1 A 96 96 ALA HA H 96 5.412 5.486 -0.074 1
1 1083 . 9 1 1 A 96 96 ALA C C 96 175.258 175.790 -0.532 1
1 1084 . 9 1 1 A 96 96 ALA CA C 96 50.355 50.213 0.142 1
1 1085 . 9 1 1 A 96 96 ALA CB C 96 24.270 22.565 1.705 1
1 1086 . 9 1 1 A 96 96 ALA N N 96 126.197 126.062 0.135 1
1 1087 . 9 1 1 A 97 97 VAL H H 97 8.568 8.694 -0.126 1
1 1088 . 9 1 1 A 97 97 VAL HA H 97 4.804 5.033 -0.229 1
1 1096 . 9 1 1 A 97 97 VAL C C 97 175.982 175.055 0.927 1
1 1097 . 9 1 1 A 97 97 VAL CA C 97 61.442 61.195 0.247 1
1 1098 . 9 1 1 A 97 97 VAL CB C 97 33.413 33.846 -0.433 1
1 1101 . 9 1 1 A 97 97 VAL N N 97 120.702 120.682 0.020 1
1 1102 . 9 1 1 A 98 98 ILE H H 98 9.753 8.543 1.210 1
1 1103 . 9 1 1 A 98 98 ILE HA H 98 4.826 4.923 -0.097 1
1 1113 . 9 1 1 A 98 98 ILE C C 98 174.292 174.558 -0.266 1
1 1114 . 9 1 1 A 98 98 ILE CA C 98 59.981 60.048 -0.067 1
1 1115 . 9 1 1 A 98 98 ILE CB C 98 40.608 41.098 -0.490 1
1 1119 . 9 1 1 A 98 98 ILE N N 98 131.738 126.713 5.025 1
1 1120 . 9 1 1 A 99 99 VAL H H 99 8.493 8.682 -0.189 1
1 1121 . 9 1 1 A 99 99 VAL HA H 99 5.201 4.561 0.640 1
1 1129 . 9 1 1 A 99 99 VAL C C 99 176.557 175.372 1.185 1
1 1130 . 9 1 1 A 99 99 VAL CA C 99 61.495 61.151 0.344 1
1 1131 . 9 1 1 A 99 99 VAL CB C 99 32.327 32.266 0.061 1
1 1134 . 9 1 1 A 99 99 VAL N N 99 129.537 129.092 0.445 1
1 1135 . 9 1 1 A 100 100 THR H H 100 9.050 8.436 0.614 1
1 1136 . 9 1 1 A 100 100 THR HA H 100 5.606 5.046 0.560 1
1 1141 . 9 1 1 A 100 100 THR C C 100 172.815 172.634 0.181 1
1 1142 . 9 1 1 A 100 100 THR CA C 100 59.049 59.317 -0.268 1
1 1143 . 9 1 1 A 100 100 THR CB C 100 73.966 71.897 2.069 1
1 1145 . 9 1 1 A 100 100 THR N N 100 117.469 117.105 0.364 1
1 1146 . 9 1 1 A 101 101 ARG H H 101 8.773 8.717 0.056 1
1 1147 . 9 1 1 A 101 101 ARG HA H 101 4.989 4.803 0.186 1
1 1155 . 9 1 1 A 101 101 ARG C C 101 174.738 174.845 -0.107 1
1 1156 . 9 1 1 A 101 101 ARG CA C 101 54.825 53.673 1.152 1
1 1157 . 9 1 1 A 101 101 ARG CB C 101 34.636 33.981 0.655 1
1 1160 . 9 1 1 A 101 101 ARG N N 101 117.532 120.144 -2.612 1
1 1162 . 9 1 1 A 102 102 LYS H H 102 8.616 8.605 0.011 1
1 1163 . 9 1 1 A 102 102 LYS HA H 102 4.232 4.734 -0.502 1
1 1171 . 9 1 1 A 102 102 LYS C C 102 175.935 175.446 0.489 1
1 1172 . 9 1 1 A 102 102 LYS CA C 102 56.549 56.434 0.115 1
1 1173 . 9 1 1 A 102 102 LYS CB C 102 33.266 33.472 -0.206 1
1 1177 . 9 1 1 A 102 102 LYS N N 102 126.899 123.076 3.823 1
1 1178 . 9 1 1 A 103 103 LEU H H 103 8.424 8.563 -0.139 1
1 1179 . 9 1 1 A 103 103 LEU HA H 103 4.540 4.865 -0.325 1
1 1189 . 9 1 1 A 103 103 LEU C C 103 176.956 176.237 0.719 1
1 1190 . 9 1 1 A 103 103 LEU CA C 103 54.755 53.174 1.581 1
1 1191 . 9 1 1 A 103 103 LEU CB C 103 42.929 44.401 -1.472 1
1 1195 . 9 1 1 A 103 103 LEU N N 103 126.246 126.712 -0.466 1
1 1196 . 9 1 1 A 104 104 THR H H 104 8.201 8.451 -0.250 1
1 1197 . 9 1 1 A 104 104 THR HA H 104 4.624 4.351 0.273 1
1 1202 . 9 1 1 A 104 104 THR C C 104 172.954 174.145 -1.191 1
1 1203 . 9 1 1 A 104 104 THR CA C 104 59.483 60.898 -1.415 1
1 1204 . 9 1 1 A 104 104 THR CB C 104 69.761 69.039 0.722 1
1 1206 . 9 1 1 A 104 104 THR N N 104 117.263 115.202 2.061 1
1 1207 . 9 1 1 A 105 105 PRO HA H 105 4.399 4.601 -0.202 1
1 1213 . 9 1 1 A 105 105 PRO CA C 105 63.495 62.737 0.758 1
1 1214 . 9 1 1 A 105 105 PRO CB C 105 32.096 33.097 -1.001 1
1 1217 . 9 1 1 A 106 106 GLU H H 106 8.519 8.518 0.001 1
1 1218 . 9 1 1 A 106 106 GLU HA H 106 4.197 4.593 -0.396 1
1 1221 . 9 1 1 A 106 106 GLU C C 106 176.110 176.354 -0.244 1
1 1222 . 9 1 1 A 106 106 GLU CA C 106 56.743 56.222 0.521 1
1 1223 . 9 1 1 A 106 106 GLU CB C 106 30.137 31.793 -1.656 1
1 1225 . 9 1 1 A 106 106 GLU N N 106 120.609 116.976 3.633 1
1 1226 . 9 1 1 A 107 107 ALA H H 107 8.241 8.005 0.236 1
1 1227 . 9 1 1 A 107 107 ALA HA H 107 4.317 4.178 0.139 1
1 1231 . 9 1 1 A 107 107 ALA C C 107 177.299 176.187 1.112 1
1 1232 . 9 1 1 A 107 107 ALA CA C 107 52.203 53.483 -1.280 1
1 1233 . 9 1 1 A 107 107 ALA CB C 107 19.392 18.247 1.145 1
1 1234 . 9 1 1 A 107 107 ALA N N 107 124.849 120.806 4.043 1
1 1235 . 9 1 1 A 108 108 MET H H 108 8.284 8.913 -0.629 1
1 1236 . 9 1 1 A 108 108 MET HA H 108 4.792 4.972 -0.180 1
1 1244 . 9 1 1 A 108 108 MET C C 108 174.337 173.468 0.869 1
1 1245 . 9 1 1 A 108 108 MET CA C 108 53.258 53.470 -0.212 1
1 1246 . 9 1 1 A 108 108 MET CB C 108 32.608 36.273 -3.665 1
1 1249 . 9 1 1 A 108 108 MET N N 108 121.025 121.193 -0.168 1
1 1250 . 9 1 1 A 109 109 PRO HA H 109 4.408 4.664 -0.256 1
1 1256 . 9 1 1 A 109 109 PRO C C 109 176.412 176.892 -0.480 1
1 1257 . 9 1 1 A 109 109 PRO CA C 109 63.290 62.464 0.826 1
1 1258 . 9 1 1 A 109 109 PRO CB C 109 32.077 32.206 -0.129 1
1 1261 . 9 1 1 A 110 110 ASP H H 110 8.417 8.423 -0.006 1
1 1262 . 9 1 1 A 110 110 ASP HA H 110 4.573 4.747 -0.174 1
1 1265 . 9 1 1 A 110 110 ASP C C 110 176.508 176.052 0.456 1
1 1266 . 9 1 1 A 110 110 ASP CA C 110 54.085 53.728 0.357 1
1 1267 . 9 1 1 A 110 110 ASP CB C 110 41.075 41.748 -0.673 1
1 1268 . 9 1 1 A 110 110 ASP N N 110 120.239 120.844 -0.605 1
1 1269 . 9 1 1 A 111 111 LEU H H 111 8.279 8.806 -0.527 1
1 1270 . 9 1 1 A 111 111 LEU HA H 111 4.319 4.151 0.168 1
1 1280 . 9 1 1 A 111 111 LEU C C 111 177.551 177.085 0.466 1
1 1281 . 9 1 1 A 111 111 LEU CA C 111 55.581 57.306 -1.725 1
1 1282 . 9 1 1 A 111 111 LEU CB C 111 42.360 41.704 0.656 1
1 1286 . 9 1 1 A 111 111 LEU N N 111 123.318 123.153 0.165 1
1 1287 . 9 1 1 A 112 112 ASN H H 112 8.487 8.190 0.297 1
1 1288 . 9 1 1 A 112 112 ASN HA H 112 4.725 4.372 0.353 1
1 1293 . 9 1 1 A 112 112 ASN C C 112 175.454 174.155 1.299 1
1 1294 . 9 1 1 A 112 112 ASN CA C 112 53.610 53.846 -0.236 1
1 1295 . 9 1 1 A 112 112 ASN CB C 112 39.116 37.145 1.971 1
1 1296 . 9 1 1 A 112 112 ASN N N 112 118.752 117.883 0.869 1
1 1298 . 9 1 1 A 115 115 GLY H H 115 8.205 8.302 -0.097 1
1 1299 . 9 1 1 A 115 115 GLY HA2 H 115 4.126 4.226 -0.100 1
1 1300 . 9 1 1 A 115 115 GLY HA3 H 115 4.126 4.226 -0.100 1
1 1301 . 9 1 1 A 115 115 GLY CA C 115 44.727 45.281 -0.554 1
1 1302 . 9 1 1 A 116 116 PRO HA H 116 4.485 4.698 -0.213 1
1 1309 . 9 1 1 A 116 116 PRO CA C 116 63.298 62.607 0.691 1
1 1310 . 9 1 1 A 116 116 PRO CB C 116 32.077 32.833 -0.756 1
1 1313 . 9 1 1 A 117 117 SER H H 117 8.532 8.581 -0.049 1
1 1 . 10 1 1 A 7 7 GLY HA2 H 7 3.960 4.176 -0.216 1
1 2 . 10 1 1 A 7 7 GLY HA3 H 7 3.960 4.176 -0.216 1
1 3 . 10 1 1 A 7 7 GLY C C 7 174.009 173.307 0.702 1
1 4 . 10 1 1 A 7 7 GLY CA C 7 45.374 45.473 -0.099 1
1 5 . 10 1 1 A 8 8 ALA H H 8 8.163 8.638 -0.475 1
1 6 . 10 1 1 A 8 8 ALA HA H 8 4.381 4.106 0.275 1
1 10 . 10 1 1 A 8 8 ALA C C 8 178.078 175.898 2.180 1
1 11 . 10 1 1 A 8 8 ALA CA C 8 52.677 53.482 -0.805 1
1 12 . 10 1 1 A 8 8 ALA CB C 8 19.368 18.253 1.115 1
1 13 . 10 1 1 A 8 8 ALA N N 8 123.721 122.916 0.805 1
1 14 . 10 1 1 A 9 9 THR H H 9 8.142 8.198 -0.056 1
1 15 . 10 1 1 A 9 9 THR HA H 9 4.353 4.754 -0.401 1
1 20 . 10 1 1 A 9 9 THR C C 9 174.597 172.437 2.160 1
1 21 . 10 1 1 A 9 9 THR CA C 9 62.093 61.937 0.156 1
1 22 . 10 1 1 A 9 9 THR CB C 9 69.948 69.055 0.893 1
1 24 . 10 1 1 A 9 9 THR N N 9 113.761 116.581 -2.820 1
1 25 . 10 1 1 A 10 10 LEU H H 10 8.218 8.815 -0.597 1
1 26 . 10 1 1 A 10 10 LEU HA H 10 4.169 5.141 -0.972 1
1 36 . 10 1 1 A 10 10 LEU C C 10 176.110 174.962 1.148 1
1 37 . 10 1 1 A 10 10 LEU CA C 10 61.099 53.506 7.593 1
1 38 . 10 1 1 A 10 10 LEU CB C 10 38.686 45.642 -6.956 1
1 42 . 10 1 1 A 10 10 LEU N N 10 123.516 128.273 -4.757 1
1 43 . 10 1 1 A 11 11 LYS H H 11 8.496 8.728 -0.232 1
1 44 . 10 1 1 A 11 11 LYS HA H 11 4.891 5.092 -0.201 1
1 49 . 10 1 1 A 11 11 LYS C C 11 175.794 174.119 1.675 1
1 50 . 10 1 1 A 11 11 LYS CA C 11 55.652 55.303 0.349 1
1 51 . 10 1 1 A 11 11 LYS CB C 11 29.444 35.945 -6.501 1
1 52 . 10 1 1 A 11 11 LYS N N 11 125.141 121.374 3.767 1
1 53 . 10 1 1 A 12 12 GLN HA H 12 4.315 4.822 -0.507 1
1 54 . 10 1 1 A 12 12 GLN C C 12 176.300 174.295 2.005 1
1 55 . 10 1 1 A 12 12 GLN CA C 12 56.286 54.739 1.547 1
1 56 . 10 1 1 A 12 12 GLN CB C 12 32.901 29.719 3.182 1
1 57 . 10 1 1 A 13 13 LEU H H 13 8.410 8.765 -0.355 1
1 58 . 10 1 1 A 13 13 LEU HA H 13 4.348 4.771 -0.423 1
1 67 . 10 1 1 A 13 13 LEU C C 13 177.120 175.391 1.729 1
1 68 . 10 1 1 A 13 13 LEU CA C 13 55.142 53.907 1.235 1
1 69 . 10 1 1 A 13 13 LEU CB C 13 42.352 44.842 -2.490 1
1 73 . 10 1 1 A 13 13 LEU N N 13 124.340 125.486 -1.146 1
1 74 . 10 1 1 A 14 14 ASP H H 14 8.250 8.708 -0.458 1
1 75 . 10 1 1 A 14 14 ASP HA H 14 4.540 4.802 -0.262 1
1 78 . 10 1 1 A 14 14 ASP C C 14 176.769 175.638 1.131 1
1 79 . 10 1 1 A 14 14 ASP CA C 14 54.772 53.852 0.920 1
1 80 . 10 1 1 A 14 14 ASP CB C 14 41.322 41.812 -0.490 1
1 81 . 10 1 1 A 14 14 ASP N N 14 120.493 126.658 -6.165 1
1 82 . 10 1 1 A 15 15 GLY H H 15 8.428 8.870 -0.442 1
1 83 . 10 1 1 A 15 15 GLY HA2 H 15 4.089 4.110 -0.021 1
1 84 . 10 1 1 A 15 15 GLY HA3 H 15 3.874 4.120 -0.246 1
1 85 . 10 1 1 A 15 15 GLY C C 15 174.122 173.631 0.491 1
1 86 . 10 1 1 A 15 15 GLY CA C 15 45.972 45.662 0.310 1
1 87 . 10 1 1 A 15 15 GLY N N 15 108.670 107.146 1.524 1
1 88 . 10 1 1 A 16 16 ILE H H 16 7.727 7.561 0.166 1
1 89 . 10 1 1 A 16 16 ILE HA H 16 4.705 4.464 0.241 1
1 99 . 10 1 1 A 16 16 ILE C C 16 175.807 174.244 1.563 1
1 100 . 10 1 1 A 16 16 ILE CA C 16 60.703 60.141 0.562 1
1 101 . 10 1 1 A 16 16 ILE CB C 16 38.509 38.842 -0.333 1
1 105 . 10 1 1 A 16 16 ILE N N 16 120.267 120.580 -0.313 1
1 106 . 10 1 1 A 17 17 HIS H H 17 9.101 8.916 0.185 1
1 107 . 10 1 1 A 17 17 HIS HA H 17 4.782 5.370 -0.588 1
1 112 . 10 1 1 A 17 17 HIS C C 17 173.051 174.382 -1.331 1
1 113 . 10 1 1 A 17 17 HIS CA C 17 55.353 53.060 2.293 1
1 114 . 10 1 1 A 17 17 HIS CB C 17 32.468 32.551 -0.083 1
1 117 . 10 1 1 A 17 17 HIS N N 17 125.061 127.597 -2.536 1
1 118 . 10 1 1 A 18 18 VAL H H 18 8.427 8.677 -0.250 1
1 119 . 10 1 1 A 18 18 VAL HA H 18 4.375 4.090 0.285 1
1 127 . 10 1 1 A 18 18 VAL C C 18 174.702 175.347 -0.645 1
1 128 . 10 1 1 A 18 18 VAL CA C 18 62.035 62.694 -0.659 1
1 129 . 10 1 1 A 18 18 VAL CB C 18 32.325 32.347 -0.022 1
1 132 . 10 1 1 A 18 18 VAL N N 18 127.069 126.710 0.359 1
1 133 . 10 1 1 A 19 19 THR H H 19 9.272 8.092 1.180 1
1 134 . 10 1 1 A 19 19 THR HA H 19 4.512 4.873 -0.361 1
1 139 . 10 1 1 A 19 19 THR C C 19 172.784 173.257 -0.473 1
1 140 . 10 1 1 A 19 19 THR CA C 19 62.512 61.583 0.929 1
1 141 . 10 1 1 A 19 19 THR CB C 19 70.663 70.244 0.419 1
1 143 . 10 1 1 A 19 19 THR N N 19 126.619 121.521 5.098 1
1 144 . 10 1 1 A 20 20 ILE H H 20 8.737 9.244 -0.507 1
1 145 . 10 1 1 A 20 20 ILE HA H 20 4.870 4.688 0.182 1
1 155 . 10 1 1 A 20 20 ILE C C 20 175.315 174.842 0.473 1
1 156 . 10 1 1 A 20 20 ILE CA C 20 60.157 60.141 0.016 1
1 157 . 10 1 1 A 20 20 ILE CB C 20 38.603 38.607 -0.004 1
1 161 . 10 1 1 A 20 20 ILE N N 20 128.114 128.329 -0.215 1
1 162 . 10 1 1 A 21 21 LEU H H 21 8.902 8.746 0.156 1
1 163 . 10 1 1 A 21 21 LEU HA H 21 4.804 4.965 -0.161 1
1 173 . 10 1 1 A 21 21 LEU C C 21 175.565 175.138 0.427 1
1 174 . 10 1 1 A 21 21 LEU CA C 21 52.731 53.001 -0.270 1
1 175 . 10 1 1 A 21 21 LEU CB C 21 43.947 43.016 0.931 1
1 179 . 10 1 1 A 21 21 LEU N N 21 125.457 127.921 -2.464 1
1 180 . 10 1 1 A 22 22 HIS H H 22 8.577 9.069 -0.492 1
1 181 . 10 1 1 A 22 22 HIS HA H 22 5.013 4.993 0.020 1
1 186 . 10 1 1 A 22 22 HIS C C 22 174.258 174.831 -0.573 1
1 187 . 10 1 1 A 22 22 HIS CA C 22 55.880 55.048 0.832 1
1 188 . 10 1 1 A 22 22 HIS CB C 22 30.901 29.599 1.302 1
1 191 . 10 1 1 A 22 22 HIS N N 22 122.595 123.687 -1.092 1
1 192 . 10 1 1 A 23 23 LYS H H 23 8.712 9.476 -0.764 1
1 193 . 10 1 1 A 23 23 LYS HA H 23 4.880 5.208 -0.328 1
1 202 . 10 1 1 A 23 23 LYS C C 23 174.265 175.033 -0.768 1
1 203 . 10 1 1 A 23 23 LYS CA C 23 54.314 53.971 0.343 1
1 204 . 10 1 1 A 23 23 LYS CB C 23 36.068 36.043 0.025 1
1 208 . 10 1 1 A 23 23 LYS N N 23 120.814 120.668 0.146 1
1 209 . 10 1 1 A 24 24 GLU H H 24 8.360 8.755 -0.395 1
1 210 . 10 1 1 A 24 24 GLU HA H 24 4.350 4.840 -0.490 1
1 215 . 10 1 1 A 24 24 GLU C C 24 177.843 176.276 1.567 1
1 216 . 10 1 1 A 24 24 GLU CA C 24 55.601 54.619 0.982 1
1 217 . 10 1 1 A 24 24 GLU CB C 24 30.512 32.343 -1.831 1
1 219 . 10 1 1 A 24 24 GLU N N 24 117.859 118.418 -0.559 1
1 220 . 10 1 1 A 25 25 GLU H H 25 9.146 8.595 0.551 1
1 221 . 10 1 1 A 25 25 GLU HA H 25 3.924 4.281 -0.357 1
1 226 . 10 1 1 A 25 25 GLU C C 25 177.809 177.121 0.688 1
1 227 . 10 1 1 A 25 25 GLU CA C 25 58.568 57.623 0.945 1
1 228 . 10 1 1 A 25 25 GLU CB C 25 29.313 29.142 0.171 1
1 230 . 10 1 1 A 25 25 GLU N N 25 124.543 122.450 2.093 1
1 231 . 10 1 1 A 26 26 GLY H H 26 8.242 8.716 -0.474 1
1 232 . 10 1 1 A 26 26 GLY HA2 H 26 4.287 4.039 0.248 1
1 233 . 10 1 1 A 26 26 GLY HA3 H 26 3.407 4.039 -0.632 1
1 234 . 10 1 1 A 26 26 GLY C C 26 174.234 175.121 -0.887 1
1 235 . 10 1 1 A 26 26 GLY CA C 26 46.113 45.806 0.307 1
1 236 . 10 1 1 A 26 26 GLY N N 26 115.394 113.634 1.760 1
1 237 . 10 1 1 A 27 27 ALA H H 27 7.432 8.417 -0.985 1
1 238 . 10 1 1 A 27 27 ALA HA H 27 4.402 4.307 0.095 1
1 242 . 10 1 1 A 27 27 ALA C C 27 178.138 177.976 0.162 1
1 243 . 10 1 1 A 27 27 ALA CA C 27 52.273 52.751 -0.478 1
1 244 . 10 1 1 A 27 27 ALA CB C 27 20.214 19.972 0.242 1
1 245 . 10 1 1 A 27 27 ALA N N 27 122.323 121.840 0.483 1
1 246 . 10 1 1 A 28 28 GLY H H 28 8.624 7.824 0.800 1
1 247 . 10 1 1 A 28 28 GLY HA2 H 28 4.134 4.098 0.036 1
1 248 . 10 1 1 A 28 28 GLY HA3 H 28 3.953 4.129 -0.176 1
1 249 . 10 1 1 A 28 28 GLY C C 28 174.069 175.014 -0.945 1
1 250 . 10 1 1 A 28 28 GLY CA C 28 44.546 44.414 0.132 1
1 251 . 10 1 1 A 28 28 GLY N N 28 107.593 105.513 2.080 1
1 252 . 10 1 1 A 29 29 LEU H H 29 7.934 8.602 -0.668 1
1 253 . 10 1 1 A 29 29 LEU HA H 29 4.059 4.459 -0.400 1
1 263 . 10 1 1 A 29 29 LEU C C 29 177.548 177.011 0.537 1
1 264 . 10 1 1 A 29 29 LEU CA C 29 56.298 56.086 0.212 1
1 265 . 10 1 1 A 29 29 LEU CB C 29 41.940 42.652 -0.712 1
1 269 . 10 1 1 A 29 29 LEU N N 29 115.495 121.300 -5.805 1
1 270 . 10 1 1 A 30 30 GLY H H 30 8.669 8.184 0.485 1
1 271 . 10 1 1 A 30 30 GLY HA2 H 30 4.264 4.067 0.197 1
1 272 . 10 1 1 A 30 30 GLY HA3 H 30 4.001 4.188 -0.187 1
1 273 . 10 1 1 A 30 30 GLY C C 30 175.296 173.090 2.206 1
1 274 . 10 1 1 A 30 30 GLY CA C 30 46.368 45.053 1.315 1
1 275 . 10 1 1 A 30 30 GLY N N 30 103.121 106.326 -3.205 1
1 276 . 10 1 1 A 31 31 PHE H H 31 7.044 7.446 -0.402 1
1 277 . 10 1 1 A 31 31 PHE HA H 31 4.541 4.574 -0.033 1
1 285 . 10 1 1 A 31 31 PHE C C 31 171.141 172.636 -1.495 1
1 286 . 10 1 1 A 31 31 PHE CA C 31 55.704 55.167 0.537 1
1 287 . 10 1 1 A 31 31 PHE CB C 31 40.745 41.895 -1.150 1
1 293 . 10 1 1 A 31 31 PHE N N 31 115.404 115.197 0.207 1
1 294 . 10 1 1 A 32 32 SER H H 32 8.752 8.792 -0.040 1
1 295 . 10 1 1 A 32 32 SER HA H 32 4.990 4.881 0.109 1
1 298 . 10 1 1 A 32 32 SER C C 32 175.049 172.713 2.336 1
1 299 . 10 1 1 A 32 32 SER CA C 32 55.001 55.862 -0.861 1
1 300 . 10 1 1 A 32 32 SER CB C 32 67.170 66.650 0.520 1
1 301 . 10 1 1 A 32 32 SER N N 32 113.639 114.931 -1.292 1
1 302 . 10 1 1 A 33 33 LEU H H 33 8.639 8.315 0.324 1
1 303 . 10 1 1 A 33 33 LEU HA H 33 5.573 5.040 0.533 1
1 313 . 10 1 1 A 33 33 LEU C C 33 175.827 175.472 0.355 1
1 314 . 10 1 1 A 33 33 LEU CA C 33 53.620 53.658 -0.038 1
1 315 . 10 1 1 A 33 33 LEU CB C 33 45.399 43.791 1.608 1
1 319 . 10 1 1 A 33 33 LEU N N 33 118.936 123.766 -4.830 1
1 320 . 10 1 1 A 34 34 ALA H H 34 9.410 8.904 0.506 1
1 321 . 10 1 1 A 34 34 ALA HA H 34 4.749 5.101 -0.352 1
1 325 . 10 1 1 A 34 34 ALA C C 34 176.231 177.203 -0.972 1
1 326 . 10 1 1 A 34 34 ALA CA C 34 50.425 51.190 -0.765 1
1 327 . 10 1 1 A 34 34 ALA CB C 34 22.518 22.785 -0.267 1
1 328 . 10 1 1 A 34 34 ALA N N 34 124.395 122.425 1.970 1
1 329 . 10 1 1 A 35 35 GLY H H 35 8.130 8.632 -0.502 1
1 330 . 10 1 1 A 35 35 GLY HA2 H 35 4.712 4.073 0.639 1
1 331 . 10 1 1 A 35 35 GLY HA3 H 35 3.955 4.110 -0.155 1
1 332 . 10 1 1 A 35 35 GLY C C 35 174.750 173.062 1.688 1
1 333 . 10 1 1 A 35 35 GLY CA C 35 44.494 44.950 -0.456 1
1 334 . 10 1 1 A 35 35 GLY N N 35 103.650 107.877 -4.227 1
1 335 . 10 1 1 A 36 36 GLY H H 36 8.217 7.779 0.438 1
1 336 . 10 1 1 A 36 36 GLY HA2 H 36 4.494 4.412 0.082 1
1 337 . 10 1 1 A 36 36 GLY HA3 H 36 3.836 4.441 -0.605 1
1 338 . 10 1 1 A 36 36 GLY C C 36 174.410 173.967 0.443 1
1 339 . 10 1 1 A 36 36 GLY CA C 36 45.462 45.809 -0.347 1
1 340 . 10 1 1 A 36 36 GLY N N 36 122.114 108.852 13.262 1
1 341 . 10 1 1 A 37 37 ALA H H 37 8.963 8.871 0.092 1
1 342 . 10 1 1 A 37 37 ALA HA H 37 3.998 4.129 -0.131 1
1 346 . 10 1 1 A 37 37 ALA C C 37 176.935 179.374 -2.439 1
1 347 . 10 1 1 A 37 37 ALA CA C 37 55.308 54.478 0.830 1
1 348 . 10 1 1 A 37 37 ALA CB C 37 18.822 19.037 -0.215 1
1 349 . 10 1 1 A 37 37 ALA N N 37 123.418 121.714 1.704 1
1 350 . 10 1 1 A 38 38 ASP H H 38 10.586 8.241 2.345 1
1 351 . 10 1 1 A 38 38 ASP HA H 38 4.485 4.402 0.083 1
1 354 . 10 1 1 A 38 38 ASP C C 38 175.309 176.426 -1.117 1
1 355 . 10 1 1 A 38 38 ASP CA C 38 52.730 56.327 -3.597 1
1 356 . 10 1 1 A 38 38 ASP CB C 38 38.689 40.909 -2.220 1
1 357 . 10 1 1 A 38 38 ASP N N 38 111.480 118.135 -6.655 1
1 358 . 10 1 1 A 39 39 LEU H H 39 7.789 7.660 0.129 1
1 359 . 10 1 1 A 39 39 LEU HA H 39 4.699 4.373 0.326 1
1 369 . 10 1 1 A 39 39 LEU C C 39 176.377 177.823 -1.446 1
1 370 . 10 1 1 A 39 39 LEU CA C 39 52.952 54.252 -1.300 1
1 371 . 10 1 1 A 39 39 LEU CB C 39 43.294 42.156 1.138 1
1 375 . 10 1 1 A 39 39 LEU N N 39 122.545 121.483 1.062 1
1 376 . 10 1 1 A 40 40 GLU H H 40 8.331 8.904 -0.573 1
1 377 . 10 1 1 A 40 40 GLU HA H 40 3.978 4.138 -0.160 1
1 382 . 10 1 1 A 40 40 GLU C C 40 176.887 177.180 -0.293 1
1 383 . 10 1 1 A 40 40 GLU CA C 40 59.066 59.255 -0.189 1
1 384 . 10 1 1 A 40 40 GLU CB C 40 29.523 29.211 0.312 1
1 386 . 10 1 1 A 40 40 GLU N N 40 118.036 120.613 -2.577 1
1 387 . 10 1 1 A 41 41 ASN H H 41 7.890 7.739 0.151 1
1 388 . 10 1 1 A 41 41 ASN HA H 41 4.820 4.979 -0.159 1
1 393 . 10 1 1 A 41 41 ASN CA C 41 52.316 51.520 0.796 1
1 394 . 10 1 1 A 41 41 ASN CB C 41 37.409 36.334 1.075 1
1 395 . 10 1 1 A 41 41 ASN N N 41 115.196 118.161 -2.965 1
1 397 . 10 1 1 A 42 42 LYS H H 42 7.943 7.980 -0.037 1
1 398 . 10 1 1 A 42 42 LYS HA H 42 4.328 4.350 -0.022 1
1 407 . 10 1 1 A 42 42 LYS C C 42 177.081 177.318 -0.237 1
1 408 . 10 1 1 A 42 42 LYS CA C 42 56.567 59.097 -2.530 1
1 409 . 10 1 1 A 42 42 LYS CB C 42 33.120 32.620 0.500 1
1 413 . 10 1 1 A 42 42 LYS N N 42 120.612 125.426 -4.814 1
1 414 . 10 1 1 A 43 43 VAL H H 43 7.456 7.687 -0.231 1
1 415 . 10 1 1 A 43 43 VAL HA H 43 4.059 4.398 -0.339 1
1 423 . 10 1 1 A 43 43 VAL CA C 43 61.330 60.949 0.381 1
1 424 . 10 1 1 A 43 43 VAL CB C 43 32.819 32.407 0.412 1
1 427 . 10 1 1 A 43 43 VAL N N 43 118.284 118.869 -0.585 1
1 428 . 10 1 1 A 44 44 ILE H H 44 8.481 8.652 -0.171 1
1 429 . 10 1 1 A 44 44 ILE HA H 44 4.913 4.534 0.379 1
1 439 . 10 1 1 A 44 44 ILE C C 44 176.719 175.927 0.792 1
1 440 . 10 1 1 A 44 44 ILE CA C 44 59.946 62.289 -2.343 1
1 441 . 10 1 1 A 44 44 ILE CB C 44 35.784 37.972 -2.188 1
1 445 . 10 1 1 A 44 44 ILE N N 44 127.089 129.708 -2.619 1
1 446 . 10 1 1 A 45 45 THR H H 45 8.906 9.104 -0.198 1
1 447 . 10 1 1 A 45 45 THR HA H 45 5.400 4.985 0.415 1
1 452 . 10 1 1 A 45 45 THR CA C 45 58.528 59.578 -1.050 1
1 453 . 10 1 1 A 45 45 THR CB C 45 73.760 71.766 1.994 1
1 455 . 10 1 1 A 45 45 THR N N 45 116.832 118.096 -1.264 1
1 456 . 10 1 1 A 46 46 VAL H H 46 8.336 8.870 -0.534 1
1 457 . 10 1 1 A 46 46 VAL HA H 46 4.059 4.221 -0.162 1
1 465 . 10 1 1 A 46 46 VAL C C 46 176.648 176.534 0.114 1
1 466 . 10 1 1 A 46 46 VAL CA C 46 63.058 63.153 -0.095 1
1 467 . 10 1 1 A 46 46 VAL CB C 46 31.601 30.887 0.714 1
1 470 . 10 1 1 A 46 46 VAL N N 46 118.542 122.452 -3.910 1
1 471 . 10 1 1 A 47 47 HIS H H 47 9.382 8.647 0.735 1
1 472 . 10 1 1 A 47 47 HIS HA H 47 4.628 4.183 0.445 1
1 477 . 10 1 1 A 47 47 HIS C C 47 174.339 174.168 0.171 1
1 478 . 10 1 1 A 47 47 HIS CA C 47 57.764 59.939 -2.175 1
1 479 . 10 1 1 A 47 47 HIS CB C 47 31.453 30.576 0.877 1
1 482 . 10 1 1 A 47 47 HIS N N 47 133.900 128.236 5.664 1
1 483 . 10 1 1 A 48 48 ARG H H 48 7.135 7.745 -0.610 1
1 484 . 10 1 1 A 48 48 ARG HA H 48 4.360 4.801 -0.441 1
1 491 . 10 1 1 A 48 48 ARG C C 48 173.877 174.567 -0.690 1
1 492 . 10 1 1 A 48 48 ARG CA C 48 54.385 55.485 -1.100 1
1 493 . 10 1 1 A 48 48 ARG CB C 48 33.996 34.420 -0.424 1
1 496 . 10 1 1 A 48 48 ARG N N 48 114.736 117.923 -3.187 1
1 497 . 10 1 1 A 49 49 VAL H H 49 8.690 8.817 -0.127 1
1 498 . 10 1 1 A 49 49 VAL HA H 49 4.015 4.464 -0.449 1
1 506 . 10 1 1 A 49 49 VAL C C 49 176.255 175.719 0.536 1
1 507 . 10 1 1 A 49 49 VAL CA C 49 61.882 61.518 0.364 1
1 508 . 10 1 1 A 49 49 VAL CB C 49 32.261 32.659 -0.398 1
1 511 . 10 1 1 A 49 49 VAL N N 49 122.844 122.668 0.176 1
1 512 . 10 1 1 A 50 50 PHE H H 50 7.866 8.618 -0.752 1
1 513 . 10 1 1 A 50 50 PHE HA H 50 4.866 4.516 0.350 1
1 521 . 10 1 1 A 50 50 PHE C C 50 174.847 176.337 -1.490 1
1 522 . 10 1 1 A 50 50 PHE CA C 50 54.596 57.518 -2.922 1
1 523 . 10 1 1 A 50 50 PHE CB C 50 36.558 39.143 -2.585 1
1 529 . 10 1 1 A 50 50 PHE N N 50 128.498 127.520 0.978 1
1 530 . 10 1 1 A 51 51 PRO HA H 51 4.386 4.545 -0.159 1
1 537 . 10 1 1 A 51 51 PRO C C 51 177.321 176.682 0.639 1
1 538 . 10 1 1 A 51 51 PRO CA C 51 64.381 64.542 -0.161 1
1 539 . 10 1 1 A 51 51 PRO CB C 51 31.773 32.215 -0.442 1
1 542 . 10 1 1 A 52 52 ASN H H 52 8.814 8.394 0.420 1
1 543 . 10 1 1 A 52 52 ASN HA H 52 4.496 5.093 -0.597 1
1 548 . 10 1 1 A 52 52 ASN C C 52 174.823 174.439 0.384 1
1 549 . 10 1 1 A 52 52 ASN CA C 52 54.719 52.018 2.701 1
1 550 . 10 1 1 A 52 52 ASN CB C 52 38.109 39.474 -1.365 1
1 551 . 10 1 1 A 52 52 ASN N N 52 116.145 113.483 2.662 1
1 553 . 10 1 1 A 53 53 GLY H H 53 7.730 8.247 -0.517 1
1 554 . 10 1 1 A 53 53 GLY HA2 H 53 4.430 4.288 0.142 1
1 555 . 10 1 1 A 53 53 GLY HA3 H 53 4.089 4.300 -0.211 1
1 556 . 10 1 1 A 53 53 GLY C C 53 174.810 174.113 0.697 1
1 557 . 10 1 1 A 53 53 GLY CA C 53 44.987 45.763 -0.776 1
1 558 . 10 1 1 A 53 53 GLY N N 53 106.196 110.014 -3.818 1
1 559 . 10 1 1 A 54 54 LEU H H 54 8.764 9.204 -0.440 1
1 560 . 10 1 1 A 54 54 LEU HA H 54 4.041 4.131 -0.090 1
1 570 . 10 1 1 A 54 54 LEU C C 54 179.712 178.681 1.031 1
1 571 . 10 1 1 A 54 54 LEU CA C 54 58.310 57.743 0.567 1
1 572 . 10 1 1 A 54 54 LEU CB C 54 42.390 41.961 0.429 1
1 576 . 10 1 1 A 54 54 LEU N N 54 118.836 119.715 -0.879 1
1 577 . 10 1 1 A 55 55 ALA H H 55 7.593 8.149 -0.556 1
1 578 . 10 1 1 A 55 55 ALA HA H 55 4.275 3.831 0.444 1
1 582 . 10 1 1 A 55 55 ALA C C 55 181.307 179.583 1.724 1
1 583 . 10 1 1 A 55 55 ALA CA C 55 54.825 54.918 -0.093 1
1 584 . 10 1 1 A 55 55 ALA CB C 55 18.345 17.853 0.492 1
1 585 . 10 1 1 A 55 55 ALA N N 55 118.782 121.841 -3.059 1
1 586 . 10 1 1 A 56 56 SER H H 56 9.339 7.920 1.419 1
1 587 . 10 1 1 A 56 56 SER HA H 56 4.023 4.160 -0.137 1
1 589 . 10 1 1 A 56 56 SER C C 56 176.392 177.437 -1.045 1
1 590 . 10 1 1 A 56 56 SER CA C 56 60.984 61.392 -0.408 1
1 591 . 10 1 1 A 56 56 SER CB C 56 62.987 62.700 0.287 1
1 592 . 10 1 1 A 56 56 SER N N 56 117.631 113.459 4.172 1
1 593 . 10 1 1 A 57 57 GLN H H 57 7.942 7.511 0.431 1
1 594 . 10 1 1 A 57 57 GLN HA H 57 4.034 4.027 0.007 1
1 601 . 10 1 1 A 57 57 GLN C C 57 177.400 178.636 -1.236 1
1 602 . 10 1 1 A 57 57 GLN CA C 57 58.362 58.947 -0.585 1
1 603 . 10 1 1 A 57 57 GLN CB C 57 28.801 28.338 0.463 1
1 605 . 10 1 1 A 57 57 GLN N N 57 118.162 121.593 -3.431 1
1 607 . 10 1 1 A 58 58 GLU H H 58 7.683 8.175 -0.492 1
1 608 . 10 1 1 A 58 58 GLU HA H 58 4.163 4.094 0.069 1
1 613 . 10 1 1 A 58 58 GLU C C 58 179.248 176.651 2.597 1
1 614 . 10 1 1 A 58 58 GLU CA C 58 59.559 58.488 1.071 1
1 615 . 10 1 1 A 58 58 GLU CB C 58 29.317 29.475 -0.158 1
1 617 . 10 1 1 A 58 58 GLU N N 58 119.877 119.627 0.250 1
1 618 . 10 1 1 A 59 59 GLY H H 59 7.446 7.487 -0.041 1
1 619 . 10 1 1 A 59 59 GLY HA2 H 59 4.100 3.995 0.105 1
1 620 . 10 1 1 A 59 59 GLY HA3 H 59 3.770 3.997 -0.227 1
1 621 . 10 1 1 A 59 59 GLY C C 59 175.432 175.416 0.016 1
1 622 . 10 1 1 A 59 59 GLY CA C 59 46.817 45.542 1.275 1
1 623 . 10 1 1 A 59 59 GLY N N 59 102.653 107.790 -5.137 1
1 624 . 10 1 1 A 60 60 THR H H 60 8.343 8.021 0.322 1
1 625 . 10 1 1 A 60 60 THR HA H 60 4.037 4.055 -0.018 1
1 630 . 10 1 1 A 60 60 THR C C 60 175.843 174.886 0.957 1
1 631 . 10 1 1 A 60 60 THR CA C 60 64.792 65.668 -0.876 1
1 632 . 10 1 1 A 60 60 THR CB C 60 69.325 68.994 0.331 1
1 634 . 10 1 1 A 60 60 THR N N 60 113.863 113.690 0.173 1
1 635 . 10 1 1 A 61 61 ILE H H 61 8.802 7.614 1.188 1
1 636 . 10 1 1 A 61 61 ILE HA H 61 3.631 4.131 -0.500 1
1 646 . 10 1 1 A 61 61 ILE C C 61 174.198 174.491 -0.293 1
1 647 . 10 1 1 A 61 61 ILE CA C 61 62.938 60.916 2.022 1
1 648 . 10 1 1 A 61 61 ILE CB C 61 37.225 36.220 1.005 1
1 652 . 10 1 1 A 61 61 ILE N N 61 126.153 119.486 6.667 1
1 653 . 10 1 1 A 62 62 GLN H H 62 7.124 8.675 -1.551 1
1 654 . 10 1 1 A 62 62 GLN HA H 62 4.500 4.697 -0.197 1
1 661 . 10 1 1 A 62 62 GLN C C 62 174.556 175.401 -0.845 1
1 662 . 10 1 1 A 62 62 GLN CA C 62 53.364 54.232 -0.868 1
1 663 . 10 1 1 A 62 62 GLN CB C 62 32.196 31.639 0.557 1
1 665 . 10 1 1 A 62 62 GLN N N 62 123.730 126.744 -3.014 1
1 667 . 10 1 1 A 63 63 LYS H H 63 8.399 8.499 -0.100 1
1 668 . 10 1 1 A 63 63 LYS HA H 63 3.464 4.595 -1.131 1
1 677 . 10 1 1 A 63 63 LYS CA C 63 57.905 57.210 0.695 1
1 678 . 10 1 1 A 63 63 LYS CB C 63 32.260 32.102 0.158 1
1 682 . 10 1 1 A 63 63 LYS N N 63 121.381 124.963 -3.582 1
1 683 . 10 1 1 A 64 64 GLY H H 64 9.265 9.834 -0.569 1
1 684 . 10 1 1 A 64 64 GLY HA2 H 64 4.415 4.006 0.409 1
1 685 . 10 1 1 A 64 64 GLY HA3 H 64 3.639 4.008 -0.369 1
1 686 . 10 1 1 A 64 64 GLY CA C 64 44.881 45.037 -0.156 1
1 687 . 10 1 1 A 64 64 GLY N N 64 113.750 113.486 0.264 1
1 688 . 10 1 1 A 65 65 ASN H H 65 7.594 8.762 -1.168 1
1 689 . 10 1 1 A 65 65 ASN HA H 65 4.798 4.655 0.143 1
1 694 . 10 1 1 A 65 65 ASN C C 65 175.042 174.181 0.861 1
1 695 . 10 1 1 A 65 65 ASN CA C 65 53.047 54.283 -1.236 1
1 696 . 10 1 1 A 65 65 ASN CB C 65 38.153 39.518 -1.365 1
1 697 . 10 1 1 A 65 65 ASN N N 65 117.999 120.321 -2.322 1
1 699 . 10 1 1 A 66 66 GLU H H 66 8.538 8.678 -0.140 1
1 700 . 10 1 1 A 66 66 GLU HA H 66 4.634 4.674 -0.040 1
1 705 . 10 1 1 A 66 66 GLU C C 66 176.620 175.171 1.449 1
1 706 . 10 1 1 A 66 66 GLU CA C 66 55.863 54.987 0.876 1
1 707 . 10 1 1 A 66 66 GLU CB C 66 30.899 30.704 0.195 1
1 709 . 10 1 1 A 66 66 GLU N N 66 122.233 123.012 -0.779 1
1 710 . 10 1 1 A 67 67 VAL H H 67 8.452 9.254 -0.802 1
1 711 . 10 1 1 A 67 67 VAL HA H 67 4.172 4.105 0.067 1
1 719 . 10 1 1 A 67 67 VAL C C 67 174.641 175.445 -0.804 1
1 720 . 10 1 1 A 67 67 VAL CA C 67 61.856 62.926 -1.070 1
1 721 . 10 1 1 A 67 67 VAL CB C 67 31.066 31.100 -0.034 1
1 724 . 10 1 1 A 67 67 VAL N N 67 126.311 127.939 -1.628 1
1 725 . 10 1 1 A 68 68 LEU H H 68 9.000 9.006 -0.006 1
1 726 . 10 1 1 A 68 68 LEU HA H 68 4.390 4.230 0.160 1
1 736 . 10 1 1 A 68 68 LEU C C 68 178.924 176.949 1.975 1
1 737 . 10 1 1 A 68 68 LEU CA C 68 56.990 56.495 0.495 1
1 738 . 10 1 1 A 68 68 LEU CB C 68 42.392 42.644 -0.252 1
1 742 . 10 1 1 A 68 68 LEU N N 68 127.175 129.739 -2.564 1
1 743 . 10 1 1 A 69 69 SER H H 69 7.666 7.763 -0.097 1
1 744 . 10 1 1 A 69 69 SER HA H 69 5.144 5.023 0.121 1
1 747 . 10 1 1 A 69 69 SER C C 69 172.722 172.322 0.400 1
1 748 . 10 1 1 A 69 69 SER CA C 69 57.606 57.473 0.133 1
1 749 . 10 1 1 A 69 69 SER CB C 69 64.511 65.862 -1.351 1
1 750 . 10 1 1 A 69 69 SER N N 69 110.346 108.878 1.468 1
1 751 . 10 1 1 A 70 70 ILE H H 70 7.965 8.546 -0.581 1
1 752 . 10 1 1 A 70 70 ILE HA H 70 4.548 4.806 -0.258 1
1 762 . 10 1 1 A 70 70 ILE C C 70 174.993 176.202 -1.209 1
1 763 . 10 1 1 A 70 70 ILE CA C 70 60.897 60.254 0.643 1
1 764 . 10 1 1 A 70 70 ILE CB C 70 41.186 40.465 0.721 1
1 768 . 10 1 1 A 70 70 ILE N N 70 119.579 121.455 -1.876 1
1 769 . 10 1 1 A 71 71 ASN H H 71 9.839 10.153 -0.314 1
1 770 . 10 1 1 A 71 71 ASN HA H 71 4.485 4.401 0.084 1
1 775 . 10 1 1 A 71 71 ASN C C 71 174.975 174.695 0.280 1
1 776 . 10 1 1 A 71 71 ASN CA C 71 54.085 54.235 -0.150 1
1 777 . 10 1 1 A 71 71 ASN CB C 71 36.255 37.288 -1.033 1
1 778 . 10 1 1 A 71 71 ASN N N 71 126.963 125.683 1.280 1
1 780 . 10 1 1 A 72 72 GLY H H 72 8.911 8.364 0.547 1
1 781 . 10 1 1 A 72 72 GLY HA2 H 72 4.149 3.907 0.242 1
1 782 . 10 1 1 A 72 72 GLY HA3 H 72 3.507 3.907 -0.400 1
1 783 . 10 1 1 A 72 72 GLY C C 72 173.594 174.102 -0.508 1
1 784 . 10 1 1 A 72 72 GLY CA C 72 45.162 45.181 -0.019 1
1 785 . 10 1 1 A 72 72 GLY N N 72 103.020 104.683 -1.663 1
1 786 . 10 1 1 A 73 73 LYS H H 73 7.922 7.736 0.186 1
1 787 . 10 1 1 A 73 73 LYS HA H 73 4.485 4.315 0.170 1
1 796 . 10 1 1 A 73 73 LYS C C 73 175.036 175.711 -0.675 1
1 797 . 10 1 1 A 73 73 LYS CA C 73 54.719 55.707 -0.988 1
1 798 . 10 1 1 A 73 73 LYS CB C 73 32.137 32.100 0.037 1
1 802 . 10 1 1 A 73 73 LYS N N 73 122.413 120.819 1.594 1
1 803 . 10 1 1 A 74 74 SER H H 74 8.585 8.842 -0.257 1
1 804 . 10 1 1 A 74 74 SER HA H 74 4.452 4.748 -0.296 1
1 807 . 10 1 1 A 74 74 SER C C 74 175.965 173.997 1.968 1
1 808 . 10 1 1 A 74 74 SER CA C 74 58.028 58.572 -0.544 1
1 809 . 10 1 1 A 74 74 SER CB C 74 63.799 63.845 -0.046 1
1 810 . 10 1 1 A 74 74 SER N N 74 118.737 121.227 -2.490 1
1 811 . 10 1 1 A 75 75 LEU H H 75 8.015 8.317 -0.302 1
1 812 . 10 1 1 A 75 75 LEU HA H 75 4.661 4.433 0.228 1
1 822 . 10 1 1 A 75 75 LEU C C 75 178.117 177.375 0.742 1
1 823 . 10 1 1 A 75 75 LEU CA C 75 53.980 54.642 -0.662 1
1 824 . 10 1 1 A 75 75 LEU CB C 75 40.830 40.937 -0.107 1
1 828 . 10 1 1 A 75 75 LEU N N 75 125.425 125.883 -0.458 1
1 829 . 10 1 1 A 76 76 LYS H H 76 8.099 8.636 -0.537 1
1 830 . 10 1 1 A 76 76 LYS HA H 76 4.210 4.411 -0.201 1
1 839 . 10 1 1 A 76 76 LYS C C 76 178.487 176.760 1.727 1
1 840 . 10 1 1 A 76 76 LYS CA C 76 58.010 55.462 2.548 1
1 841 . 10 1 1 A 76 76 LYS CB C 76 31.683 31.648 0.035 1
1 845 . 10 1 1 A 76 76 LYS N N 76 124.064 120.201 3.863 1
1 846 . 10 1 1 A 77 77 GLY H H 77 8.859 7.850 1.009 1
1 847 . 10 1 1 A 77 77 GLY HA2 H 77 4.110 4.068 0.042 1
1 848 . 10 1 1 A 77 77 GLY HA3 H 77 3.869 4.071 -0.202 1
1 849 . 10 1 1 A 77 77 GLY C C 77 174.335 174.734 -0.399 1
1 850 . 10 1 1 A 77 77 GLY CA C 77 46.232 44.938 1.294 1
1 851 . 10 1 1 A 77 77 GLY N N 77 115.659 108.709 6.950 1
1 852 . 10 1 1 A 78 78 THR H H 78 7.654 7.761 -0.107 1
1 853 . 10 1 1 A 78 78 THR HA H 78 4.624 4.172 0.452 1
1 858 . 10 1 1 A 78 78 THR C C 78 177.272 174.851 2.421 1
1 859 . 10 1 1 A 78 78 THR CA C 78 61.794 63.246 -1.452 1
1 860 . 10 1 1 A 78 78 THR CB C 78 70.595 69.189 1.406 1
1 862 . 10 1 1 A 78 78 THR N N 78 112.847 116.567 -3.720 1
1 863 . 10 1 1 A 79 79 THR H H 79 8.813 8.690 0.123 1
1 864 . 10 1 1 A 79 79 THR HA H 79 4.395 4.711 -0.316 1
1 869 . 10 1 1 A 79 79 THR C C 79 174.503 175.504 -1.001 1
1 870 . 10 1 1 A 79 79 THR CA C 79 61.724 60.892 0.832 1
1 871 . 10 1 1 A 79 79 THR CB C 79 71.007 71.286 -0.279 1
1 873 . 10 1 1 A 79 79 THR N N 79 114.123 117.832 -3.709 1
1 874 . 10 1 1 A 80 80 HIS H H 80 10.266 9.208 1.058 1
1 875 . 10 1 1 A 80 80 HIS HA H 80 4.331 4.186 0.145 1
1 880 . 10 1 1 A 80 80 HIS C C 80 177.075 176.873 0.202 1
1 881 . 10 1 1 A 80 80 HIS CA C 80 61.338 60.218 1.120 1
1 882 . 10 1 1 A 80 80 HIS CB C 80 28.651 30.510 -1.859 1
1 885 . 10 1 1 A 80 80 HIS N N 80 122.776 122.071 0.705 1
1 886 . 10 1 1 A 81 81 HIS H H 81 9.335 8.212 1.123 1
1 887 . 10 1 1 A 81 81 HIS HA H 81 4.078 4.069 0.009 1
1 892 . 10 1 1 A 81 81 HIS C C 81 178.269 176.730 1.539 1
1 893 . 10 1 1 A 81 81 HIS CA C 81 60.210 59.968 0.242 1
1 894 . 10 1 1 A 81 81 HIS CB C 81 29.569 30.043 -0.474 1
1 897 . 10 1 1 A 81 81 HIS N N 81 114.733 118.289 -3.556 1
1 898 . 10 1 1 A 82 82 ASP H H 82 7.741 8.118 -0.377 1
1 899 . 10 1 1 A 82 82 ASP HA H 82 4.452 4.212 0.240 1
1 902 . 10 1 1 A 82 82 ASP C C 82 178.683 178.773 -0.090 1
1 903 . 10 1 1 A 82 82 ASP CA C 82 57.148 57.467 -0.319 1
1 904 . 10 1 1 A 82 82 ASP CB C 82 39.522 40.446 -0.924 1
1 905 . 10 1 1 A 82 82 ASP N N 82 121.407 118.040 3.367 1
1 906 . 10 1 1 A 83 83 ALA H H 83 8.502 7.801 0.701 1
1 907 . 10 1 1 A 83 83 ALA HA H 83 3.939 4.150 -0.211 1
1 911 . 10 1 1 A 83 83 ALA C C 83 179.361 179.277 0.084 1
1 912 . 10 1 1 A 83 83 ALA CA C 83 55.635 54.954 0.681 1
1 913 . 10 1 1 A 83 83 ALA CB C 83 18.124 19.232 -1.108 1
1 914 . 10 1 1 A 83 83 ALA N N 83 125.049 122.565 2.484 1
1 915 . 10 1 1 A 84 84 LEU H H 84 8.100 8.473 -0.373 1
1 916 . 10 1 1 A 84 84 LEU HA H 84 3.792 3.824 -0.032 1
1 926 . 10 1 1 A 84 84 LEU C C 84 180.173 179.139 1.034 1
1 927 . 10 1 1 A 84 84 LEU CA C 84 57.932 57.880 0.052 1
1 928 . 10 1 1 A 84 84 LEU CB C 84 41.157 41.368 -0.211 1
1 932 . 10 1 1 A 84 84 LEU N N 84 117.139 117.762 -0.623 1
1 933 . 10 1 1 A 85 85 ALA H H 85 7.715 9.071 -1.356 1
1 934 . 10 1 1 A 85 85 ALA HA H 85 4.061 4.068 -0.007 1
1 938 . 10 1 1 A 85 85 ALA C C 85 180.380 179.633 0.747 1
1 939 . 10 1 1 A 85 85 ALA CA C 85 55.212 55.417 -0.205 1
1 940 . 10 1 1 A 85 85 ALA CB C 85 17.803 18.729 -0.926 1
1 941 . 10 1 1 A 85 85 ALA N N 85 122.448 121.660 0.788 1
1 942 . 10 1 1 A 86 86 ILE H H 86 7.669 7.913 -0.244 1
1 943 . 10 1 1 A 86 86 ILE HA H 86 3.678 3.710 -0.032 1
1 953 . 10 1 1 A 86 86 ILE C C 86 178.692 178.808 -0.116 1
1 954 . 10 1 1 A 86 86 ILE CA C 86 65.226 64.802 0.424 1
1 955 . 10 1 1 A 86 86 ILE CB C 86 38.099 37.817 0.282 1
1 959 . 10 1 1 A 86 86 ILE N N 86 121.804 117.873 3.931 1
1 960 . 10 1 1 A 87 87 LEU H H 87 7.922 8.514 -0.592 1
1 961 . 10 1 1 A 87 87 LEU HA H 87 3.903 4.048 -0.145 1
1 971 . 10 1 1 A 87 87 LEU C C 87 178.610 178.966 -0.356 1
1 972 . 10 1 1 A 87 87 LEU CA C 87 58.221 57.961 0.260 1
1 973 . 10 1 1 A 87 87 LEU CB C 87 42.344 41.570 0.774 1
1 977 . 10 1 1 A 87 87 LEU N N 87 121.947 121.681 0.266 1
1 978 . 10 1 1 A 88 88 ARG H H 88 8.317 8.063 0.254 1
1 979 . 10 1 1 A 88 88 ARG HA H 88 4.060 4.182 -0.122 1
1 986 . 10 1 1 A 88 88 ARG C C 88 180.698 177.062 3.636 1
1 987 . 10 1 1 A 88 88 ARG CA C 88 59.383 58.607 0.776 1
1 988 . 10 1 1 A 88 88 ARG CB C 88 30.055 29.965 0.090 1
1 991 . 10 1 1 A 88 88 ARG N N 88 119.343 119.280 0.063 1
1 992 . 10 1 1 A 89 89 GLN H H 89 8.270 7.691 0.579 1
1 993 . 10 1 1 A 89 89 GLN HA H 89 4.122 4.313 -0.191 1
1 1000 . 10 1 1 A 89 89 GLN C C 89 177.955 178.194 -0.239 1
1 1001 . 10 1 1 A 89 89 GLN CA C 89 58.714 56.654 2.060 1
1 1002 . 10 1 1 A 89 89 GLN CB C 89 28.160 29.342 -1.182 1
1 1004 . 10 1 1 A 89 89 GLN N N 89 121.097 117.397 3.700 1
1 1006 . 10 1 1 A 90 90 ALA H H 90 7.558 7.822 -0.264 1
1 1007 . 10 1 1 A 90 90 ALA HA H 90 4.123 4.166 -0.043 1
1 1011 . 10 1 1 A 90 90 ALA C C 90 178.076 178.047 0.029 1
1 1012 . 10 1 1 A 90 90 ALA CA C 90 52.942 54.010 -1.068 1
1 1013 . 10 1 1 A 90 90 ALA CB C 90 18.015 18.289 -0.274 1
1 1014 . 10 1 1 A 90 90 ALA N N 90 119.652 121.226 -1.574 1
1 1015 . 10 1 1 A 91 91 ARG H H 91 7.768 7.644 0.124 1
1 1016 . 10 1 1 A 91 91 ARG HA H 91 4.065 4.370 -0.305 1
1 1022 . 10 1 1 A 91 91 ARG C C 91 177.858 177.611 0.247 1
1 1023 . 10 1 1 A 91 91 ARG CA C 91 58.573 56.588 1.985 1
1 1024 . 10 1 1 A 91 91 ARG CB C 91 30.384 30.498 -0.114 1
1 1027 . 10 1 1 A 91 91 ARG N N 91 118.081 116.281 1.800 1
1 1028 . 10 1 1 A 92 92 GLU H H 92 7.691 8.366 -0.675 1
1 1029 . 10 1 1 A 92 92 GLU HA H 92 4.123 4.199 -0.076 1
1 1034 . 10 1 1 A 92 92 GLU C C 92 174.459 176.576 -2.117 1
1 1035 . 10 1 1 A 92 92 GLU CA C 92 61.565 60.785 0.780 1
1 1036 . 10 1 1 A 92 92 GLU CB C 92 27.583 29.072 -1.489 1
1 1038 . 10 1 1 A 92 92 GLU N N 92 118.447 117.678 0.769 1
1 1039 . 10 1 1 A 93 93 PRO HA H 93 4.716 4.551 0.165 1
1 1046 . 10 1 1 A 93 93 PRO C C 93 176.221 176.650 -0.429 1
1 1047 . 10 1 1 A 93 93 PRO CA C 93 63.149 62.392 0.757 1
1 1048 . 10 1 1 A 93 93 PRO CB C 93 32.571 33.170 -0.599 1
1 1051 . 10 1 1 A 94 94 ARG H H 94 8.434 9.014 -0.580 1
1 1052 . 10 1 1 A 94 94 ARG HA H 94 4.232 4.419 -0.187 1
1 1058 . 10 1 1 A 94 94 ARG C C 94 175.323 176.034 -0.711 1
1 1059 . 10 1 1 A 94 94 ARG CA C 94 56.972 56.570 0.402 1
1 1060 . 10 1 1 A 94 94 ARG CB C 94 30.448 31.114 -0.666 1
1 1063 . 10 1 1 A 94 94 ARG N N 94 115.987 119.166 -3.179 1
1 1064 . 10 1 1 A 95 95 GLN H H 95 7.246 7.583 -0.337 1
1 1065 . 10 1 1 A 95 95 GLN HA H 95 5.251 5.245 0.006 1
1 1072 . 10 1 1 A 95 95 GLN C C 95 174.786 173.592 1.194 1
1 1073 . 10 1 1 A 95 95 GLN CA C 95 54.209 54.970 -0.761 1
1 1074 . 10 1 1 A 95 95 GLN CB C 95 32.384 32.179 0.205 1
1 1076 . 10 1 1 A 95 95 GLN N N 95 115.998 119.606 -3.608 1
1 1078 . 10 1 1 A 96 96 ALA H H 96 8.739 8.506 0.233 1
1 1079 . 10 1 1 A 96 96 ALA HA H 96 5.412 5.251 0.161 1
1 1083 . 10 1 1 A 96 96 ALA C C 96 175.258 175.787 -0.529 1
1 1084 . 10 1 1 A 96 96 ALA CA C 96 50.355 50.471 -0.116 1
1 1085 . 10 1 1 A 96 96 ALA CB C 96 24.270 22.240 2.030 1
1 1086 . 10 1 1 A 96 96 ALA N N 96 126.197 125.898 0.299 1
1 1087 . 10 1 1 A 97 97 VAL H H 97 8.568 8.839 -0.271 1
1 1088 . 10 1 1 A 97 97 VAL HA H 97 4.804 4.678 0.126 1
1 1096 . 10 1 1 A 97 97 VAL C C 97 175.982 174.838 1.144 1
1 1097 . 10 1 1 A 97 97 VAL CA C 97 61.442 61.490 -0.048 1
1 1098 . 10 1 1 A 97 97 VAL CB C 97 33.413 32.768 0.645 1
1 1101 . 10 1 1 A 97 97 VAL N N 97 120.702 122.848 -2.146 1
1 1102 . 10 1 1 A 98 98 ILE H H 98 9.753 8.529 1.224 1
1 1103 . 10 1 1 A 98 98 ILE HA H 98 4.826 5.118 -0.292 1
1 1113 . 10 1 1 A 98 98 ILE C C 98 174.292 174.646 -0.354 1
1 1114 . 10 1 1 A 98 98 ILE CA C 98 59.981 59.643 0.338 1
1 1115 . 10 1 1 A 98 98 ILE CB C 98 40.608 40.613 -0.005 1
1 1119 . 10 1 1 A 98 98 ILE N N 98 131.738 127.267 4.471 1
1 1120 . 10 1 1 A 99 99 VAL H H 99 8.493 8.519 -0.026 1
1 1121 . 10 1 1 A 99 99 VAL HA H 99 5.201 4.804 0.397 1
1 1129 . 10 1 1 A 99 99 VAL C C 99 176.557 175.281 1.276 1
1 1130 . 10 1 1 A 99 99 VAL CA C 99 61.495 60.776 0.719 1
1 1131 . 10 1 1 A 99 99 VAL CB C 99 32.327 32.928 -0.601 1
1 1134 . 10 1 1 A 99 99 VAL N N 99 129.537 128.775 0.762 1
1 1135 . 10 1 1 A 100 100 THR H H 100 9.050 9.047 0.003 1
1 1136 . 10 1 1 A 100 100 THR HA H 100 5.606 5.660 -0.054 1
1 1141 . 10 1 1 A 100 100 THR C C 100 172.815 173.204 -0.389 1
1 1142 . 10 1 1 A 100 100 THR CA C 100 59.049 59.272 -0.223 1
1 1143 . 10 1 1 A 100 100 THR CB C 100 73.966 71.997 1.969 1
1 1145 . 10 1 1 A 100 100 THR N N 100 117.469 117.500 -0.031 1
1 1146 . 10 1 1 A 101 101 ARG H H 101 8.773 8.719 0.054 1
1 1147 . 10 1 1 A 101 101 ARG HA H 101 4.989 4.904 0.085 1
1 1155 . 10 1 1 A 101 101 ARG C C 101 174.738 175.548 -0.810 1
1 1156 . 10 1 1 A 101 101 ARG CA C 101 54.825 53.866 0.959 1
1 1157 . 10 1 1 A 101 101 ARG CB C 101 34.636 33.152 1.484 1
1 1160 . 10 1 1 A 101 101 ARG N N 101 117.532 120.984 -3.452 1
1 1162 . 10 1 1 A 102 102 LYS H H 102 8.616 8.464 0.152 1
1 1163 . 10 1 1 A 102 102 LYS HA H 102 4.232 4.628 -0.396 1
1 1171 . 10 1 1 A 102 102 LYS C C 102 175.935 175.770 0.165 1
1 1172 . 10 1 1 A 102 102 LYS CA C 102 56.549 56.616 -0.067 1
1 1173 . 10 1 1 A 102 102 LYS CB C 102 33.266 32.711 0.555 1
1 1177 . 10 1 1 A 102 102 LYS N N 102 126.899 122.620 4.279 1
1 1178 . 10 1 1 A 103 103 LEU H H 103 8.424 8.627 -0.203 1
1 1179 . 10 1 1 A 103 103 LEU HA H 103 4.540 4.779 -0.239 1
1 1189 . 10 1 1 A 103 103 LEU C C 103 176.956 176.138 0.818 1
1 1190 . 10 1 1 A 103 103 LEU CA C 103 54.755 53.125 1.630 1
1 1191 . 10 1 1 A 103 103 LEU CB C 103 42.929 44.961 -2.032 1
1 1195 . 10 1 1 A 103 103 LEU N N 103 126.246 126.862 -0.616 1
1 1196 . 10 1 1 A 104 104 THR H H 104 8.201 8.600 -0.399 1
1 1197 . 10 1 1 A 104 104 THR HA H 104 4.624 4.397 0.227 1
1 1202 . 10 1 1 A 104 104 THR C C 104 172.954 174.174 -1.220 1
1 1203 . 10 1 1 A 104 104 THR CA C 104 59.483 62.248 -2.765 1
1 1204 . 10 1 1 A 104 104 THR CB C 104 69.761 68.323 1.438 1
1 1206 . 10 1 1 A 104 104 THR N N 104 117.263 115.077 2.186 1
1 1207 . 10 1 1 A 105 105 PRO HA H 105 4.399 4.454 -0.055 1
1 1213 . 10 1 1 A 105 105 PRO CA C 105 63.495 65.429 -1.934 1
1 1214 . 10 1 1 A 105 105 PRO CB C 105 32.096 31.705 0.391 1
1 1217 . 10 1 1 A 106 106 GLU H H 106 8.519 7.747 0.772 1
1 1218 . 10 1 1 A 106 106 GLU HA H 106 4.197 4.605 -0.408 1
1 1221 . 10 1 1 A 106 106 GLU C C 106 176.110 175.914 0.196 1
1 1222 . 10 1 1 A 106 106 GLU CA C 106 56.743 55.571 1.172 1
1 1223 . 10 1 1 A 106 106 GLU CB C 106 30.137 29.879 0.258 1
1 1225 . 10 1 1 A 106 106 GLU N N 106 120.609 112.974 7.635 1
1 1226 . 10 1 1 A 107 107 ALA H H 107 8.241 7.912 0.329 1
1 1227 . 10 1 1 A 107 107 ALA HA H 107 4.317 4.075 0.242 1
1 1231 . 10 1 1 A 107 107 ALA C C 107 177.299 176.495 0.804 1
1 1232 . 10 1 1 A 107 107 ALA CA C 107 52.203 54.406 -2.203 1
1 1233 . 10 1 1 A 107 107 ALA CB C 107 19.392 18.087 1.305 1
1 1234 . 10 1 1 A 107 107 ALA N N 107 124.849 120.011 4.838 1
1 1235 . 10 1 1 A 108 108 MET H H 108 8.284 8.471 -0.187 1
1 1236 . 10 1 1 A 108 108 MET HA H 108 4.792 4.647 0.145 1
1 1244 . 10 1 1 A 108 108 MET C C 108 174.337 174.614 -0.277 1
1 1245 . 10 1 1 A 108 108 MET CA C 108 53.258 53.121 0.137 1
1 1246 . 10 1 1 A 108 108 MET CB C 108 32.608 33.506 -0.898 1
1 1249 . 10 1 1 A 108 108 MET N N 108 121.025 119.071 1.954 1
1 1250 . 10 1 1 A 109 109 PRO HA H 109 4.408 4.848 -0.440 1
1 1256 . 10 1 1 A 109 109 PRO C C 109 176.412 175.040 1.372 1
1 1257 . 10 1 1 A 109 109 PRO CA C 109 63.290 62.634 0.656 1
1 1258 . 10 1 1 A 109 109 PRO CB C 109 32.077 31.784 0.293 1
1 1261 . 10 1 1 A 110 110 ASP H H 110 8.417 8.845 -0.428 1
1 1262 . 10 1 1 A 110 110 ASP HA H 110 4.573 4.842 -0.269 1
1 1265 . 10 1 1 A 110 110 ASP C C 110 176.508 176.133 0.375 1
1 1266 . 10 1 1 A 110 110 ASP CA C 110 54.085 53.776 0.309 1
1 1267 . 10 1 1 A 110 110 ASP CB C 110 41.075 43.212 -2.137 1
1 1268 . 10 1 1 A 110 110 ASP N N 110 120.239 122.859 -2.620 1
1 1269 . 10 1 1 A 111 111 LEU H H 111 8.279 8.754 -0.475 1
1 1270 . 10 1 1 A 111 111 LEU HA H 111 4.319 4.159 0.160 1
1 1280 . 10 1 1 A 111 111 LEU C C 111 177.551 177.079 0.472 1
1 1281 . 10 1 1 A 111 111 LEU CA C 111 55.581 57.412 -1.831 1
1 1282 . 10 1 1 A 111 111 LEU CB C 111 42.360 41.708 0.652 1
1 1286 . 10 1 1 A 111 111 LEU N N 111 123.318 127.991 -4.673 1
1 1287 . 10 1 1 A 112 112 ASN H H 112 8.487 8.132 0.355 1
1 1288 . 10 1 1 A 112 112 ASN HA H 112 4.725 4.332 0.393 1
1 1293 . 10 1 1 A 112 112 ASN C C 112 175.454 174.069 1.385 1
1 1294 . 10 1 1 A 112 112 ASN CA C 112 53.610 53.805 -0.195 1
1 1295 . 10 1 1 A 112 112 ASN CB C 112 39.116 37.107 2.009 1
1 1296 . 10 1 1 A 112 112 ASN N N 112 118.752 118.021 0.731 1
1 1298 . 10 1 1 A 115 115 GLY H H 115 8.205 8.552 -0.347 1
1 1299 . 10 1 1 A 115 115 GLY HA2 H 115 4.126 4.514 -0.388 1
1 1300 . 10 1 1 A 115 115 GLY HA3 H 115 4.126 4.514 -0.388 1
1 1301 . 10 1 1 A 115 115 GLY CA C 115 44.727 46.269 -1.542 1
1 1302 . 10 1 1 A 116 116 PRO HA H 116 4.485 4.773 -0.288 1
1 1309 . 10 1 1 A 116 116 PRO CA C 116 63.298 62.654 0.644 1
1 1310 . 10 1 1 A 116 116 PRO CB C 116 32.077 33.159 -1.082 1
1 1313 . 10 1 1 A 117 117 SER H H 117 8.532 8.515 0.017 1
1 1 . 11 1 1 A 7 7 GLY HA2 H 7 3.960 4.176 -0.216 1
1 2 . 11 1 1 A 7 7 GLY HA3 H 7 3.960 4.177 -0.217 1
1 3 . 11 1 1 A 7 7 GLY C C 7 174.009 171.823 2.186 1
1 4 . 11 1 1 A 7 7 GLY CA C 7 45.374 46.260 -0.886 1
1 5 . 11 1 1 A 8 8 ALA H H 8 8.163 8.550 -0.387 1
1 6 . 11 1 1 A 8 8 ALA HA H 8 4.381 5.060 -0.679 1
1 10 . 11 1 1 A 8 8 ALA C C 8 178.078 176.257 1.821 1
1 11 . 11 1 1 A 8 8 ALA CA C 8 52.677 50.465 2.212 1
1 12 . 11 1 1 A 8 8 ALA CB C 8 19.368 21.932 -2.564 1
1 13 . 11 1 1 A 8 8 ALA N N 8 123.721 123.073 0.648 1
1 14 . 11 1 1 A 9 9 THR H H 9 8.142 8.549 -0.407 1
1 15 . 11 1 1 A 9 9 THR HA H 9 4.353 4.681 -0.328 1
1 20 . 11 1 1 A 9 9 THR C C 9 174.597 173.440 1.157 1
1 21 . 11 1 1 A 9 9 THR CA C 9 62.093 60.760 1.333 1
1 22 . 11 1 1 A 9 9 THR CB C 9 69.948 69.771 0.177 1
1 24 . 11 1 1 A 9 9 THR N N 9 113.761 112.592 1.169 1
1 25 . 11 1 1 A 10 10 LEU H H 10 8.218 7.519 0.699 1
1 26 . 11 1 1 A 10 10 LEU HA H 10 4.169 4.658 -0.489 1
1 36 . 11 1 1 A 10 10 LEU C C 10 176.110 178.233 -2.123 1
1 37 . 11 1 1 A 10 10 LEU CA C 10 61.099 53.635 7.464 1
1 38 . 11 1 1 A 10 10 LEU CB C 10 38.686 42.165 -3.479 1
1 42 . 11 1 1 A 10 10 LEU N N 10 123.516 125.794 -2.278 1
1 43 . 11 1 1 A 11 11 LYS H H 11 8.496 8.698 -0.202 1
1 44 . 11 1 1 A 11 11 LYS HA H 11 4.891 3.959 0.932 1
1 49 . 11 1 1 A 11 11 LYS C C 11 175.794 177.529 -1.735 1
1 50 . 11 1 1 A 11 11 LYS CA C 11 55.652 59.638 -3.986 1
1 51 . 11 1 1 A 11 11 LYS CB C 11 29.444 32.521 -3.077 1
1 52 . 11 1 1 A 11 11 LYS N N 11 125.141 121.909 3.232 1
1 53 . 11 1 1 A 12 12 GLN HA H 12 4.315 4.380 -0.065 1
1 54 . 11 1 1 A 12 12 GLN C C 12 176.300 174.360 1.940 1
1 55 . 11 1 1 A 12 12 GLN CA C 12 56.286 55.660 0.626 1
1 56 . 11 1 1 A 12 12 GLN CB C 12 32.901 27.197 5.704 1
1 57 . 11 1 1 A 13 13 LEU H H 13 8.410 8.036 0.374 1
1 58 . 11 1 1 A 13 13 LEU HA H 13 4.348 4.498 -0.150 1
1 67 . 11 1 1 A 13 13 LEU C C 13 177.120 175.336 1.784 1
1 68 . 11 1 1 A 13 13 LEU CA C 13 55.142 54.326 0.816 1
1 69 . 11 1 1 A 13 13 LEU CB C 13 42.352 44.885 -2.533 1
1 73 . 11 1 1 A 13 13 LEU N N 13 124.340 124.834 -0.494 1
1 74 . 11 1 1 A 14 14 ASP H H 14 8.250 8.983 -0.733 1
1 75 . 11 1 1 A 14 14 ASP HA H 14 4.540 4.558 -0.018 1
1 78 . 11 1 1 A 14 14 ASP C C 14 176.769 175.172 1.597 1
1 79 . 11 1 1 A 14 14 ASP CA C 14 54.772 54.327 0.445 1
1 80 . 11 1 1 A 14 14 ASP CB C 14 41.322 40.786 0.536 1
1 81 . 11 1 1 A 14 14 ASP N N 14 120.493 126.237 -5.744 1
1 82 . 11 1 1 A 15 15 GLY H H 15 8.428 8.721 -0.293 1
1 83 . 11 1 1 A 15 15 GLY HA2 H 15 4.089 3.905 0.184 1
1 84 . 11 1 1 A 15 15 GLY HA3 H 15 3.874 3.910 -0.036 1
1 85 . 11 1 1 A 15 15 GLY C C 15 174.122 173.735 0.387 1
1 86 . 11 1 1 A 15 15 GLY CA C 15 45.972 46.890 -0.918 1
1 87 . 11 1 1 A 15 15 GLY N N 15 108.670 108.159 0.511 1
1 88 . 11 1 1 A 16 16 ILE H H 16 7.727 7.458 0.269 1
1 89 . 11 1 1 A 16 16 ILE HA H 16 4.705 4.854 -0.149 1
1 99 . 11 1 1 A 16 16 ILE C C 16 175.807 174.055 1.752 1
1 100 . 11 1 1 A 16 16 ILE CA C 16 60.703 59.659 1.044 1
1 101 . 11 1 1 A 16 16 ILE CB C 16 38.509 40.276 -1.767 1
1 105 . 11 1 1 A 16 16 ILE N N 16 120.267 120.931 -0.664 1
1 106 . 11 1 1 A 17 17 HIS H H 17 9.101 8.564 0.537 1
1 107 . 11 1 1 A 17 17 HIS HA H 17 4.782 5.262 -0.480 1
1 112 . 11 1 1 A 17 17 HIS C C 17 173.051 174.397 -1.346 1
1 113 . 11 1 1 A 17 17 HIS CA C 17 55.353 53.233 2.120 1
1 114 . 11 1 1 A 17 17 HIS CB C 17 32.468 32.958 -0.490 1
1 117 . 11 1 1 A 17 17 HIS N N 17 125.061 127.089 -2.028 1
1 118 . 11 1 1 A 18 18 VAL H H 18 8.427 8.455 -0.028 1
1 119 . 11 1 1 A 18 18 VAL HA H 18 4.375 3.976 0.399 1
1 127 . 11 1 1 A 18 18 VAL C C 18 174.702 175.218 -0.516 1
1 128 . 11 1 1 A 18 18 VAL CA C 18 62.035 62.608 -0.573 1
1 129 . 11 1 1 A 18 18 VAL CB C 18 32.325 32.203 0.122 1
1 132 . 11 1 1 A 18 18 VAL N N 18 127.069 126.385 0.684 1
1 133 . 11 1 1 A 19 19 THR H H 19 9.272 8.430 0.842 1
1 134 . 11 1 1 A 19 19 THR HA H 19 4.512 4.866 -0.354 1
1 139 . 11 1 1 A 19 19 THR C C 19 172.784 173.458 -0.674 1
1 140 . 11 1 1 A 19 19 THR CA C 19 62.512 61.826 0.686 1
1 141 . 11 1 1 A 19 19 THR CB C 19 70.663 70.052 0.611 1
1 143 . 11 1 1 A 19 19 THR N N 19 126.619 120.085 6.534 1
1 144 . 11 1 1 A 20 20 ILE H H 20 8.737 9.244 -0.507 1
1 145 . 11 1 1 A 20 20 ILE HA H 20 4.870 4.648 0.222 1
1 155 . 11 1 1 A 20 20 ILE C C 20 175.315 174.127 1.188 1
1 156 . 11 1 1 A 20 20 ILE CA C 20 60.157 60.517 -0.360 1
1 157 . 11 1 1 A 20 20 ILE CB C 20 38.603 39.005 -0.402 1
1 161 . 11 1 1 A 20 20 ILE N N 20 128.114 128.410 -0.296 1
1 162 . 11 1 1 A 21 21 LEU H H 21 8.902 8.648 0.254 1
1 163 . 11 1 1 A 21 21 LEU HA H 21 4.804 4.879 -0.075 1
1 173 . 11 1 1 A 21 21 LEU C C 21 175.565 175.185 0.380 1
1 174 . 11 1 1 A 21 21 LEU CA C 21 52.731 52.932 -0.201 1
1 175 . 11 1 1 A 21 21 LEU CB C 21 43.947 43.256 0.691 1
1 179 . 11 1 1 A 21 21 LEU N N 21 125.457 128.263 -2.806 1
1 180 . 11 1 1 A 22 22 HIS H H 22 8.577 8.950 -0.373 1
1 181 . 11 1 1 A 22 22 HIS HA H 22 5.013 4.999 0.014 1
1 186 . 11 1 1 A 22 22 HIS C C 22 174.258 174.928 -0.670 1
1 187 . 11 1 1 A 22 22 HIS CA C 22 55.880 55.118 0.762 1
1 188 . 11 1 1 A 22 22 HIS CB C 22 30.901 29.732 1.169 1
1 191 . 11 1 1 A 22 22 HIS N N 22 122.595 123.564 -0.969 1
1 192 . 11 1 1 A 23 23 LYS H H 23 8.712 9.695 -0.983 1
1 193 . 11 1 1 A 23 23 LYS HA H 23 4.880 5.134 -0.254 1
1 202 . 11 1 1 A 23 23 LYS C C 23 174.265 175.084 -0.819 1
1 203 . 11 1 1 A 23 23 LYS CA C 23 54.314 54.173 0.141 1
1 204 . 11 1 1 A 23 23 LYS CB C 23 36.068 36.308 -0.240 1
1 208 . 11 1 1 A 23 23 LYS N N 23 120.814 120.842 -0.028 1
1 209 . 11 1 1 A 24 24 GLU H H 24 8.360 8.533 -0.173 1
1 210 . 11 1 1 A 24 24 GLU HA H 24 4.350 4.782 -0.432 1
1 215 . 11 1 1 A 24 24 GLU C C 24 177.843 176.794 1.049 1
1 216 . 11 1 1 A 24 24 GLU CA C 24 55.601 54.652 0.949 1
1 217 . 11 1 1 A 24 24 GLU CB C 24 30.512 31.994 -1.482 1
1 219 . 11 1 1 A 24 24 GLU N N 24 117.859 119.195 -1.336 1
1 220 . 11 1 1 A 25 25 GLU H H 25 9.146 8.853 0.293 1
1 221 . 11 1 1 A 25 25 GLU HA H 25 3.924 4.143 -0.219 1
1 226 . 11 1 1 A 25 25 GLU C C 25 177.809 177.635 0.174 1
1 227 . 11 1 1 A 25 25 GLU CA C 25 58.568 58.621 -0.053 1
1 228 . 11 1 1 A 25 25 GLU CB C 25 29.313 29.037 0.276 1
1 230 . 11 1 1 A 25 25 GLU N N 25 124.543 121.915 2.628 1
1 231 . 11 1 1 A 26 26 GLY H H 26 8.242 8.964 -0.722 1
1 232 . 11 1 1 A 26 26 GLY HA2 H 26 4.287 4.031 0.256 1
1 233 . 11 1 1 A 26 26 GLY HA3 H 26 3.407 4.031 -0.624 1
1 234 . 11 1 1 A 26 26 GLY C C 26 174.234 175.148 -0.914 1
1 235 . 11 1 1 A 26 26 GLY CA C 26 46.113 46.560 -0.447 1
1 236 . 11 1 1 A 26 26 GLY N N 26 115.394 114.186 1.208 1
1 237 . 11 1 1 A 27 27 ALA H H 27 7.432 7.931 -0.499 1
1 238 . 11 1 1 A 27 27 ALA HA H 27 4.402 4.293 0.109 1
1 242 . 11 1 1 A 27 27 ALA C C 27 178.138 178.088 0.050 1
1 243 . 11 1 1 A 27 27 ALA CA C 27 52.273 52.450 -0.177 1
1 244 . 11 1 1 A 27 27 ALA CB C 27 20.214 19.924 0.290 1
1 245 . 11 1 1 A 27 27 ALA N N 27 122.323 122.447 -0.124 1
1 246 . 11 1 1 A 28 28 GLY H H 28 8.624 7.799 0.825 1
1 247 . 11 1 1 A 28 28 GLY HA2 H 28 4.134 4.078 0.056 1
1 248 . 11 1 1 A 28 28 GLY HA3 H 28 3.953 4.112 -0.159 1
1 249 . 11 1 1 A 28 28 GLY C C 28 174.069 175.016 -0.947 1
1 250 . 11 1 1 A 28 28 GLY CA C 28 44.546 44.602 -0.056 1
1 251 . 11 1 1 A 28 28 GLY N N 28 107.593 105.658 1.935 1
1 252 . 11 1 1 A 29 29 LEU H H 29 7.934 8.581 -0.647 1
1 253 . 11 1 1 A 29 29 LEU HA H 29 4.059 4.342 -0.283 1
1 263 . 11 1 1 A 29 29 LEU C C 29 177.548 176.868 0.680 1
1 264 . 11 1 1 A 29 29 LEU CA C 29 56.298 56.388 -0.090 1
1 265 . 11 1 1 A 29 29 LEU CB C 29 41.940 42.807 -0.867 1
1 269 . 11 1 1 A 29 29 LEU N N 29 115.495 121.239 -5.744 1
1 270 . 11 1 1 A 30 30 GLY H H 30 8.669 8.002 0.667 1
1 271 . 11 1 1 A 30 30 GLY HA2 H 30 4.264 4.070 0.194 1
1 272 . 11 1 1 A 30 30 GLY HA3 H 30 4.001 4.147 -0.146 1
1 273 . 11 1 1 A 30 30 GLY C C 30 175.296 173.152 2.144 1
1 274 . 11 1 1 A 30 30 GLY CA C 30 46.368 45.173 1.195 1
1 275 . 11 1 1 A 30 30 GLY N N 30 103.121 105.979 -2.858 1
1 276 . 11 1 1 A 31 31 PHE H H 31 7.044 7.509 -0.465 1
1 277 . 11 1 1 A 31 31 PHE HA H 31 4.541 4.489 0.052 1
1 285 . 11 1 1 A 31 31 PHE C C 31 171.141 172.637 -1.496 1
1 286 . 11 1 1 A 31 31 PHE CA C 31 55.704 55.168 0.536 1
1 287 . 11 1 1 A 31 31 PHE CB C 31 40.745 41.819 -1.074 1
1 293 . 11 1 1 A 31 31 PHE N N 31 115.404 115.551 -0.147 1
1 294 . 11 1 1 A 32 32 SER H H 32 8.752 9.240 -0.488 1
1 295 . 11 1 1 A 32 32 SER HA H 32 4.990 4.886 0.104 1
1 298 . 11 1 1 A 32 32 SER C C 32 175.049 173.424 1.625 1
1 299 . 11 1 1 A 32 32 SER CA C 32 55.001 55.706 -0.705 1
1 300 . 11 1 1 A 32 32 SER CB C 32 67.170 66.058 1.112 1
1 301 . 11 1 1 A 32 32 SER N N 32 113.639 113.738 -0.099 1
1 302 . 11 1 1 A 33 33 LEU H H 33 8.639 8.397 0.242 1
1 303 . 11 1 1 A 33 33 LEU HA H 33 5.573 5.465 0.108 1
1 313 . 11 1 1 A 33 33 LEU C C 33 175.827 175.758 0.069 1
1 314 . 11 1 1 A 33 33 LEU CA C 33 53.620 53.643 -0.023 1
1 315 . 11 1 1 A 33 33 LEU CB C 33 45.399 45.076 0.323 1
1 319 . 11 1 1 A 33 33 LEU N N 33 118.936 120.475 -1.539 1
1 320 . 11 1 1 A 34 34 ALA H H 34 9.410 9.369 0.041 1
1 321 . 11 1 1 A 34 34 ALA HA H 34 4.749 5.007 -0.258 1
1 325 . 11 1 1 A 34 34 ALA C C 34 176.231 176.528 -0.297 1
1 326 . 11 1 1 A 34 34 ALA CA C 34 50.425 51.188 -0.763 1
1 327 . 11 1 1 A 34 34 ALA CB C 34 22.518 22.777 -0.259 1
1 328 . 11 1 1 A 34 34 ALA N N 34 124.395 122.967 1.428 1
1 329 . 11 1 1 A 35 35 GLY H H 35 8.130 8.410 -0.280 1
1 330 . 11 1 1 A 35 35 GLY HA2 H 35 4.712 4.045 0.667 1
1 331 . 11 1 1 A 35 35 GLY HA3 H 35 3.955 4.115 -0.160 1
1 332 . 11 1 1 A 35 35 GLY C C 35 174.750 172.729 2.021 1
1 333 . 11 1 1 A 35 35 GLY CA C 35 44.494 44.627 -0.133 1
1 334 . 11 1 1 A 35 35 GLY N N 35 103.650 106.925 -3.275 1
1 335 . 11 1 1 A 36 36 GLY H H 36 8.217 8.468 -0.251 1
1 336 . 11 1 1 A 36 36 GLY HA2 H 36 4.494 4.289 0.205 1
1 337 . 11 1 1 A 36 36 GLY HA3 H 36 3.836 4.301 -0.465 1
1 338 . 11 1 1 A 36 36 GLY C C 36 174.410 174.337 0.073 1
1 339 . 11 1 1 A 36 36 GLY CA C 36 45.462 45.891 -0.429 1
1 340 . 11 1 1 A 36 36 GLY N N 36 122.114 107.787 14.327 1
1 341 . 11 1 1 A 37 37 ALA H H 37 8.963 8.711 0.252 1
1 342 . 11 1 1 A 37 37 ALA HA H 37 3.998 4.073 -0.075 1
1 346 . 11 1 1 A 37 37 ALA C C 37 176.935 179.019 -2.084 1
1 347 . 11 1 1 A 37 37 ALA CA C 37 55.308 54.557 0.751 1
1 348 . 11 1 1 A 37 37 ALA CB C 37 18.822 18.317 0.505 1
1 349 . 11 1 1 A 37 37 ALA N N 37 123.418 123.543 -0.125 1
1 350 . 11 1 1 A 38 38 ASP H H 38 10.586 8.241 2.345 1
1 351 . 11 1 1 A 38 38 ASP HA H 38 4.485 4.348 0.137 1
1 354 . 11 1 1 A 38 38 ASP C C 38 175.309 176.315 -1.006 1
1 355 . 11 1 1 A 38 38 ASP CA C 38 52.730 56.260 -3.530 1
1 356 . 11 1 1 A 38 38 ASP CB C 38 38.689 41.096 -2.407 1
1 357 . 11 1 1 A 38 38 ASP N N 38 111.480 117.935 -6.455 1
1 358 . 11 1 1 A 39 39 LEU H H 39 7.789 7.870 -0.081 1
1 359 . 11 1 1 A 39 39 LEU HA H 39 4.699 4.471 0.228 1
1 369 . 11 1 1 A 39 39 LEU C C 39 176.377 177.486 -1.109 1
1 370 . 11 1 1 A 39 39 LEU CA C 39 52.952 54.057 -1.105 1
1 371 . 11 1 1 A 39 39 LEU CB C 39 43.294 42.360 0.934 1
1 375 . 11 1 1 A 39 39 LEU N N 39 122.545 120.712 1.833 1
1 376 . 11 1 1 A 40 40 GLU H H 40 8.331 8.615 -0.284 1
1 377 . 11 1 1 A 40 40 GLU HA H 40 3.978 4.226 -0.248 1
1 382 . 11 1 1 A 40 40 GLU C C 40 176.887 176.829 0.058 1
1 383 . 11 1 1 A 40 40 GLU CA C 40 59.066 58.382 0.684 1
1 384 . 11 1 1 A 40 40 GLU CB C 40 29.523 30.244 -0.721 1
1 386 . 11 1 1 A 40 40 GLU N N 40 118.036 119.833 -1.797 1
1 387 . 11 1 1 A 41 41 ASN H H 41 7.890 7.684 0.206 1
1 388 . 11 1 1 A 41 41 ASN HA H 41 4.820 4.958 -0.138 1
1 393 . 11 1 1 A 41 41 ASN CA C 41 52.316 51.943 0.373 1
1 394 . 11 1 1 A 41 41 ASN CB C 41 37.409 37.572 -0.163 1
1 395 . 11 1 1 A 41 41 ASN N N 41 115.196 118.807 -3.611 1
1 397 . 11 1 1 A 42 42 LYS H H 42 7.943 8.568 -0.625 1
1 398 . 11 1 1 A 42 42 LYS HA H 42 4.328 4.108 0.220 1
1 407 . 11 1 1 A 42 42 LYS C C 42 177.081 177.313 -0.232 1
1 408 . 11 1 1 A 42 42 LYS CA C 42 56.567 59.501 -2.934 1
1 409 . 11 1 1 A 42 42 LYS CB C 42 33.120 32.687 0.433 1
1 413 . 11 1 1 A 42 42 LYS N N 42 120.612 125.777 -5.165 1
1 414 . 11 1 1 A 43 43 VAL H H 43 7.456 7.560 -0.104 1
1 415 . 11 1 1 A 43 43 VAL HA H 43 4.059 4.277 -0.218 1
1 423 . 11 1 1 A 43 43 VAL CA C 43 61.330 61.691 -0.361 1
1 424 . 11 1 1 A 43 43 VAL CB C 43 32.819 32.458 0.361 1
1 427 . 11 1 1 A 43 43 VAL N N 43 118.284 118.792 -0.508 1
1 428 . 11 1 1 A 44 44 ILE H H 44 8.481 8.607 -0.126 1
1 429 . 11 1 1 A 44 44 ILE HA H 44 4.913 4.596 0.317 1
1 439 . 11 1 1 A 44 44 ILE C C 44 176.719 175.710 1.009 1
1 440 . 11 1 1 A 44 44 ILE CA C 44 59.946 62.044 -2.098 1
1 441 . 11 1 1 A 44 44 ILE CB C 44 35.784 38.367 -2.583 1
1 445 . 11 1 1 A 44 44 ILE N N 44 127.089 129.719 -2.630 1
1 446 . 11 1 1 A 45 45 THR H H 45 8.906 9.887 -0.981 1
1 447 . 11 1 1 A 45 45 THR HA H 45 5.400 5.064 0.336 1
1 452 . 11 1 1 A 45 45 THR CA C 45 58.528 59.720 -1.192 1
1 453 . 11 1 1 A 45 45 THR CB C 45 73.760 72.252 1.508 1
1 455 . 11 1 1 A 45 45 THR N N 45 116.832 115.891 0.941 1
1 456 . 11 1 1 A 46 46 VAL H H 46 8.336 8.934 -0.598 1
1 457 . 11 1 1 A 46 46 VAL HA H 46 4.059 4.316 -0.257 1
1 465 . 11 1 1 A 46 46 VAL C C 46 176.648 176.403 0.245 1
1 466 . 11 1 1 A 46 46 VAL CA C 46 63.058 62.671 0.387 1
1 467 . 11 1 1 A 46 46 VAL CB C 46 31.601 30.953 0.648 1
1 470 . 11 1 1 A 46 46 VAL N N 46 118.542 122.166 -3.624 1
1 471 . 11 1 1 A 47 47 HIS H H 47 9.382 8.559 0.823 1
1 472 . 11 1 1 A 47 47 HIS HA H 47 4.628 4.214 0.414 1
1 477 . 11 1 1 A 47 47 HIS C C 47 174.339 174.138 0.201 1
1 478 . 11 1 1 A 47 47 HIS CA C 47 57.764 59.980 -2.216 1
1 479 . 11 1 1 A 47 47 HIS CB C 47 31.453 30.401 1.052 1
1 482 . 11 1 1 A 47 47 HIS N N 47 133.900 128.251 5.649 1
1 483 . 11 1 1 A 48 48 ARG H H 48 7.135 7.814 -0.679 1
1 484 . 11 1 1 A 48 48 ARG HA H 48 4.360 4.816 -0.456 1
1 491 . 11 1 1 A 48 48 ARG C C 48 173.877 174.753 -0.876 1
1 492 . 11 1 1 A 48 48 ARG CA C 48 54.385 54.845 -0.460 1
1 493 . 11 1 1 A 48 48 ARG CB C 48 33.996 34.770 -0.774 1
1 496 . 11 1 1 A 48 48 ARG N N 48 114.736 117.543 -2.807 1
1 497 . 11 1 1 A 49 49 VAL H H 49 8.690 8.692 -0.002 1
1 498 . 11 1 1 A 49 49 VAL HA H 49 4.015 4.490 -0.475 1
1 506 . 11 1 1 A 49 49 VAL C C 49 176.255 175.596 0.659 1
1 507 . 11 1 1 A 49 49 VAL CA C 49 61.882 61.701 0.181 1
1 508 . 11 1 1 A 49 49 VAL CB C 49 32.261 33.344 -1.083 1
1 511 . 11 1 1 A 49 49 VAL N N 49 122.844 122.340 0.504 1
1 512 . 11 1 1 A 50 50 PHE H H 50 7.866 8.627 -0.761 1
1 513 . 11 1 1 A 50 50 PHE HA H 50 4.866 4.501 0.365 1
1 521 . 11 1 1 A 50 50 PHE C C 50 174.847 176.172 -1.325 1
1 522 . 11 1 1 A 50 50 PHE CA C 50 54.596 57.526 -2.930 1
1 523 . 11 1 1 A 50 50 PHE CB C 50 36.558 39.290 -2.732 1
1 529 . 11 1 1 A 50 50 PHE N N 50 128.498 127.365 1.133 1
1 530 . 11 1 1 A 51 51 PRO HA H 51 4.386 4.544 -0.158 1
1 537 . 11 1 1 A 51 51 PRO C C 51 177.321 176.675 0.646 1
1 538 . 11 1 1 A 51 51 PRO CA C 51 64.381 64.575 -0.194 1
1 539 . 11 1 1 A 51 51 PRO CB C 51 31.773 32.150 -0.377 1
1 542 . 11 1 1 A 52 52 ASN H H 52 8.814 8.550 0.264 1
1 543 . 11 1 1 A 52 52 ASN HA H 52 4.496 5.005 -0.509 1
1 548 . 11 1 1 A 52 52 ASN C C 52 174.823 174.665 0.158 1
1 549 . 11 1 1 A 52 52 ASN CA C 52 54.719 52.226 2.493 1
1 550 . 11 1 1 A 52 52 ASN CB C 52 38.109 39.259 -1.150 1
1 551 . 11 1 1 A 52 52 ASN N N 52 116.145 116.248 -0.103 1
1 553 . 11 1 1 A 53 53 GLY H H 53 7.730 8.278 -0.548 1
1 554 . 11 1 1 A 53 53 GLY HA2 H 53 4.430 4.339 0.091 1
1 555 . 11 1 1 A 53 53 GLY HA3 H 53 4.089 4.351 -0.262 1
1 556 . 11 1 1 A 53 53 GLY C C 53 174.810 174.109 0.701 1
1 557 . 11 1 1 A 53 53 GLY CA C 53 44.987 45.776 -0.789 1
1 558 . 11 1 1 A 53 53 GLY N N 53 106.196 110.836 -4.640 1
1 559 . 11 1 1 A 54 54 LEU H H 54 8.764 8.965 -0.201 1
1 560 . 11 1 1 A 54 54 LEU HA H 54 4.041 4.262 -0.221 1
1 570 . 11 1 1 A 54 54 LEU C C 54 179.712 178.707 1.005 1
1 571 . 11 1 1 A 54 54 LEU CA C 54 58.310 57.653 0.657 1
1 572 . 11 1 1 A 54 54 LEU CB C 54 42.390 42.158 0.232 1
1 576 . 11 1 1 A 54 54 LEU N N 54 118.836 119.722 -0.886 1
1 577 . 11 1 1 A 55 55 ALA H H 55 7.593 8.189 -0.596 1
1 578 . 11 1 1 A 55 55 ALA HA H 55 4.275 3.867 0.408 1
1 582 . 11 1 1 A 55 55 ALA C C 55 181.307 179.576 1.731 1
1 583 . 11 1 1 A 55 55 ALA CA C 55 54.825 55.085 -0.260 1
1 584 . 11 1 1 A 55 55 ALA CB C 55 18.345 17.872 0.473 1
1 585 . 11 1 1 A 55 55 ALA N N 55 118.782 121.742 -2.960 1
1 586 . 11 1 1 A 56 56 SER H H 56 9.339 7.922 1.417 1
1 587 . 11 1 1 A 56 56 SER HA H 56 4.023 4.177 -0.154 1
1 589 . 11 1 1 A 56 56 SER C C 56 176.392 177.327 -0.935 1
1 590 . 11 1 1 A 56 56 SER CA C 56 60.984 61.398 -0.414 1
1 591 . 11 1 1 A 56 56 SER CB C 56 62.987 62.691 0.296 1
1 592 . 11 1 1 A 56 56 SER N N 56 117.631 113.309 4.322 1
1 593 . 11 1 1 A 57 57 GLN H H 57 7.942 7.872 0.070 1
1 594 . 11 1 1 A 57 57 GLN HA H 57 4.034 3.956 0.078 1
1 601 . 11 1 1 A 57 57 GLN C C 57 177.400 178.738 -1.338 1
1 602 . 11 1 1 A 57 57 GLN CA C 57 58.362 59.027 -0.665 1
1 603 . 11 1 1 A 57 57 GLN CB C 57 28.801 28.336 0.465 1
1 605 . 11 1 1 A 57 57 GLN N N 57 118.162 121.583 -3.421 1
1 607 . 11 1 1 A 58 58 GLU H H 58 7.683 8.541 -0.858 1
1 608 . 11 1 1 A 58 58 GLU HA H 58 4.163 4.091 0.072 1
1 613 . 11 1 1 A 58 58 GLU C C 58 179.248 177.238 2.010 1
1 614 . 11 1 1 A 58 58 GLU CA C 58 59.559 58.279 1.280 1
1 615 . 11 1 1 A 58 58 GLU CB C 58 29.317 29.549 -0.232 1
1 617 . 11 1 1 A 58 58 GLU N N 58 119.877 119.081 0.796 1
1 618 . 11 1 1 A 59 59 GLY H H 59 7.446 7.444 0.002 1
1 619 . 11 1 1 A 59 59 GLY HA2 H 59 4.100 3.928 0.172 1
1 620 . 11 1 1 A 59 59 GLY HA3 H 59 3.770 3.933 -0.163 1
1 621 . 11 1 1 A 59 59 GLY C C 59 175.432 175.293 0.139 1
1 622 . 11 1 1 A 59 59 GLY CA C 59 46.817 45.575 1.242 1
1 623 . 11 1 1 A 59 59 GLY N N 59 102.653 107.748 -5.095 1
1 624 . 11 1 1 A 60 60 THR H H 60 8.343 8.143 0.200 1
1 625 . 11 1 1 A 60 60 THR HA H 60 4.037 4.080 -0.043 1
1 630 . 11 1 1 A 60 60 THR C C 60 175.843 174.722 1.121 1
1 631 . 11 1 1 A 60 60 THR CA C 60 64.792 65.877 -1.085 1
1 632 . 11 1 1 A 60 60 THR CB C 60 69.325 68.834 0.491 1
1 634 . 11 1 1 A 60 60 THR N N 60 113.863 114.250 -0.387 1
1 635 . 11 1 1 A 61 61 ILE H H 61 8.802 7.909 0.893 1
1 636 . 11 1 1 A 61 61 ILE HA H 61 3.631 4.495 -0.864 1
1 646 . 11 1 1 A 61 61 ILE C C 61 174.198 174.511 -0.313 1
1 647 . 11 1 1 A 61 61 ILE CA C 61 62.938 60.553 2.385 1
1 648 . 11 1 1 A 61 61 ILE CB C 61 37.225 36.347 0.878 1
1 652 . 11 1 1 A 61 61 ILE N N 61 126.153 119.850 6.303 1
1 653 . 11 1 1 A 62 62 GLN H H 62 7.124 8.575 -1.451 1
1 654 . 11 1 1 A 62 62 GLN HA H 62 4.500 4.624 -0.124 1
1 661 . 11 1 1 A 62 62 GLN C C 62 174.556 175.472 -0.916 1
1 662 . 11 1 1 A 62 62 GLN CA C 62 53.364 54.646 -1.282 1
1 663 . 11 1 1 A 62 62 GLN CB C 62 32.196 30.898 1.298 1
1 665 . 11 1 1 A 62 62 GLN N N 62 123.730 126.418 -2.688 1
1 667 . 11 1 1 A 63 63 LYS H H 63 8.399 8.646 -0.247 1
1 668 . 11 1 1 A 63 63 LYS HA H 63 3.464 4.111 -0.647 1
1 677 . 11 1 1 A 63 63 LYS CA C 63 57.905 58.415 -0.510 1
1 678 . 11 1 1 A 63 63 LYS CB C 63 32.260 32.020 0.240 1
1 682 . 11 1 1 A 63 63 LYS N N 63 121.381 124.908 -3.527 1
1 683 . 11 1 1 A 64 64 GLY H H 64 9.265 8.809 0.456 1
1 684 . 11 1 1 A 64 64 GLY HA2 H 64 4.415 4.042 0.373 1
1 685 . 11 1 1 A 64 64 GLY HA3 H 64 3.639 4.051 -0.412 1
1 686 . 11 1 1 A 64 64 GLY CA C 64 44.881 45.258 -0.377 1
1 687 . 11 1 1 A 64 64 GLY N N 64 113.750 114.285 -0.535 1
1 688 . 11 1 1 A 65 65 ASN H H 65 7.594 8.056 -0.462 1
1 689 . 11 1 1 A 65 65 ASN HA H 65 4.798 4.743 0.055 1
1 694 . 11 1 1 A 65 65 ASN C C 65 175.042 175.644 -0.602 1
1 695 . 11 1 1 A 65 65 ASN CA C 65 53.047 53.653 -0.606 1
1 696 . 11 1 1 A 65 65 ASN CB C 65 38.153 39.866 -1.713 1
1 697 . 11 1 1 A 65 65 ASN N N 65 117.999 119.194 -1.195 1
1 699 . 11 1 1 A 66 66 GLU H H 66 8.538 8.393 0.145 1
1 700 . 11 1 1 A 66 66 GLU HA H 66 4.634 4.599 0.035 1
1 705 . 11 1 1 A 66 66 GLU C C 66 176.620 176.348 0.272 1
1 706 . 11 1 1 A 66 66 GLU CA C 66 55.863 55.591 0.272 1
1 707 . 11 1 1 A 66 66 GLU CB C 66 30.899 30.992 -0.093 1
1 709 . 11 1 1 A 66 66 GLU N N 66 122.233 118.065 4.168 1
1 710 . 11 1 1 A 67 67 VAL H H 67 8.452 8.107 0.345 1
1 711 . 11 1 1 A 67 67 VAL HA H 67 4.172 3.855 0.317 1
1 719 . 11 1 1 A 67 67 VAL C C 67 174.641 175.936 -1.295 1
1 720 . 11 1 1 A 67 67 VAL CA C 67 61.856 62.543 -0.687 1
1 721 . 11 1 1 A 67 67 VAL CB C 67 31.066 30.556 0.510 1
1 724 . 11 1 1 A 67 67 VAL N N 67 126.311 116.763 9.548 1
1 725 . 11 1 1 A 68 68 LEU H H 68 9.000 8.055 0.945 1
1 726 . 11 1 1 A 68 68 LEU HA H 68 4.390 4.226 0.164 1
1 736 . 11 1 1 A 68 68 LEU C C 68 178.924 176.898 2.026 1
1 737 . 11 1 1 A 68 68 LEU CA C 68 56.990 56.603 0.387 1
1 738 . 11 1 1 A 68 68 LEU CB C 68 42.392 42.703 -0.311 1
1 742 . 11 1 1 A 68 68 LEU N N 68 127.175 129.594 -2.419 1
1 743 . 11 1 1 A 69 69 SER H H 69 7.666 7.772 -0.106 1
1 744 . 11 1 1 A 69 69 SER HA H 69 5.144 4.898 0.246 1
1 747 . 11 1 1 A 69 69 SER C C 69 172.722 172.231 0.491 1
1 748 . 11 1 1 A 69 69 SER CA C 69 57.606 57.444 0.162 1
1 749 . 11 1 1 A 69 69 SER CB C 69 64.511 66.148 -1.637 1
1 750 . 11 1 1 A 69 69 SER N N 69 110.346 108.755 1.591 1
1 751 . 11 1 1 A 70 70 ILE H H 70 7.965 8.259 -0.294 1
1 752 . 11 1 1 A 70 70 ILE HA H 70 4.548 4.680 -0.132 1
1 762 . 11 1 1 A 70 70 ILE C C 70 174.993 175.809 -0.816 1
1 763 . 11 1 1 A 70 70 ILE CA C 70 60.897 60.157 0.740 1
1 764 . 11 1 1 A 70 70 ILE CB C 70 41.186 40.626 0.560 1
1 768 . 11 1 1 A 70 70 ILE N N 70 119.579 120.117 -0.538 1
1 769 . 11 1 1 A 71 71 ASN H H 71 9.839 10.760 -0.921 1
1 770 . 11 1 1 A 71 71 ASN HA H 71 4.485 4.439 0.046 1
1 775 . 11 1 1 A 71 71 ASN C C 71 174.975 175.400 -0.425 1
1 776 . 11 1 1 A 71 71 ASN CA C 71 54.085 54.432 -0.347 1
1 777 . 11 1 1 A 71 71 ASN CB C 71 36.255 36.888 -0.633 1
1 778 . 11 1 1 A 71 71 ASN N N 71 126.963 126.962 0.001 1
1 780 . 11 1 1 A 72 72 GLY H H 72 8.911 8.504 0.407 1
1 781 . 11 1 1 A 72 72 GLY HA2 H 72 4.149 3.880 0.269 1
1 782 . 11 1 1 A 72 72 GLY HA3 H 72 3.507 3.881 -0.374 1
1 783 . 11 1 1 A 72 72 GLY C C 72 173.594 173.997 -0.403 1
1 784 . 11 1 1 A 72 72 GLY CA C 72 45.162 45.417 -0.255 1
1 785 . 11 1 1 A 72 72 GLY N N 72 103.020 105.286 -2.266 1
1 786 . 11 1 1 A 73 73 LYS H H 73 7.922 7.720 0.202 1
1 787 . 11 1 1 A 73 73 LYS HA H 73 4.485 4.351 0.134 1
1 796 . 11 1 1 A 73 73 LYS C C 73 175.036 175.844 -0.808 1
1 797 . 11 1 1 A 73 73 LYS CA C 73 54.719 55.175 -0.456 1
1 798 . 11 1 1 A 73 73 LYS CB C 73 32.137 31.810 0.327 1
1 802 . 11 1 1 A 73 73 LYS N N 73 122.413 120.835 1.578 1
1 803 . 11 1 1 A 74 74 SER H H 74 8.585 8.804 -0.219 1
1 804 . 11 1 1 A 74 74 SER HA H 74 4.452 4.616 -0.164 1
1 807 . 11 1 1 A 74 74 SER C C 74 175.965 174.161 1.804 1
1 808 . 11 1 1 A 74 74 SER CA C 74 58.028 58.496 -0.468 1
1 809 . 11 1 1 A 74 74 SER CB C 74 63.799 63.597 0.202 1
1 810 . 11 1 1 A 74 74 SER N N 74 118.737 121.178 -2.441 1
1 811 . 11 1 1 A 75 75 LEU H H 75 8.015 8.702 -0.687 1
1 812 . 11 1 1 A 75 75 LEU HA H 75 4.661 4.229 0.432 1
1 822 . 11 1 1 A 75 75 LEU C C 75 178.117 177.766 0.351 1
1 823 . 11 1 1 A 75 75 LEU CA C 75 53.980 54.772 -0.792 1
1 824 . 11 1 1 A 75 75 LEU CB C 75 40.830 40.570 0.260 1
1 828 . 11 1 1 A 75 75 LEU N N 75 125.425 127.145 -1.720 1
1 829 . 11 1 1 A 76 76 LYS H H 76 8.099 8.652 -0.553 1
1 830 . 11 1 1 A 76 76 LYS HA H 76 4.210 4.417 -0.207 1
1 839 . 11 1 1 A 76 76 LYS C C 76 178.487 176.841 1.646 1
1 840 . 11 1 1 A 76 76 LYS CA C 76 58.010 55.476 2.534 1
1 841 . 11 1 1 A 76 76 LYS CB C 76 31.683 31.616 0.067 1
1 845 . 11 1 1 A 76 76 LYS N N 76 124.064 120.615 3.449 1
1 846 . 11 1 1 A 77 77 GLY H H 77 8.859 7.846 1.013 1
1 847 . 11 1 1 A 77 77 GLY HA2 H 77 4.110 4.065 0.045 1
1 848 . 11 1 1 A 77 77 GLY HA3 H 77 3.869 4.067 -0.198 1
1 849 . 11 1 1 A 77 77 GLY C C 77 174.335 174.841 -0.506 1
1 850 . 11 1 1 A 77 77 GLY CA C 77 46.232 44.935 1.297 1
1 851 . 11 1 1 A 77 77 GLY N N 77 115.659 108.703 6.956 1
1 852 . 11 1 1 A 78 78 THR H H 78 7.654 7.759 -0.105 1
1 853 . 11 1 1 A 78 78 THR HA H 78 4.624 4.170 0.454 1
1 858 . 11 1 1 A 78 78 THR C C 78 177.272 174.754 2.518 1
1 859 . 11 1 1 A 78 78 THR CA C 78 61.794 63.245 -1.451 1
1 860 . 11 1 1 A 78 78 THR CB C 78 70.595 69.227 1.368 1
1 862 . 11 1 1 A 78 78 THR N N 78 112.847 116.596 -3.749 1
1 863 . 11 1 1 A 79 79 THR H H 79 8.813 8.608 0.205 1
1 864 . 11 1 1 A 79 79 THR HA H 79 4.395 4.753 -0.358 1
1 869 . 11 1 1 A 79 79 THR C C 79 174.503 175.474 -0.971 1
1 870 . 11 1 1 A 79 79 THR CA C 79 61.724 60.837 0.887 1
1 871 . 11 1 1 A 79 79 THR CB C 79 71.007 70.992 0.015 1
1 873 . 11 1 1 A 79 79 THR N N 79 114.123 117.638 -3.515 1
1 874 . 11 1 1 A 80 80 HIS H H 80 10.266 9.215 1.051 1
1 875 . 11 1 1 A 80 80 HIS HA H 80 4.331 4.203 0.128 1
1 880 . 11 1 1 A 80 80 HIS C C 80 177.075 176.827 0.248 1
1 881 . 11 1 1 A 80 80 HIS CA C 80 61.338 60.195 1.143 1
1 882 . 11 1 1 A 80 80 HIS CB C 80 28.651 30.734 -2.083 1
1 885 . 11 1 1 A 80 80 HIS N N 80 122.776 121.943 0.833 1
1 886 . 11 1 1 A 81 81 HIS H H 81 9.335 8.129 1.206 1
1 887 . 11 1 1 A 81 81 HIS HA H 81 4.078 4.066 0.012 1
1 892 . 11 1 1 A 81 81 HIS C C 81 178.269 176.485 1.784 1
1 893 . 11 1 1 A 81 81 HIS CA C 81 60.210 59.827 0.383 1
1 894 . 11 1 1 A 81 81 HIS CB C 81 29.569 29.783 -0.214 1
1 897 . 11 1 1 A 81 81 HIS N N 81 114.733 118.876 -4.143 1
1 898 . 11 1 1 A 82 82 ASP H H 82 7.741 8.116 -0.375 1
1 899 . 11 1 1 A 82 82 ASP HA H 82 4.452 4.159 0.293 1
1 902 . 11 1 1 A 82 82 ASP C C 82 178.683 178.969 -0.286 1
1 903 . 11 1 1 A 82 82 ASP CA C 82 57.148 57.241 -0.093 1
1 904 . 11 1 1 A 82 82 ASP CB C 82 39.522 40.460 -0.938 1
1 905 . 11 1 1 A 82 82 ASP N N 82 121.407 118.142 3.265 1
1 906 . 11 1 1 A 83 83 ALA H H 83 8.502 8.203 0.299 1
1 907 . 11 1 1 A 83 83 ALA HA H 83 3.939 4.169 -0.230 1
1 911 . 11 1 1 A 83 83 ALA C C 83 179.361 179.265 0.096 1
1 912 . 11 1 1 A 83 83 ALA CA C 83 55.635 54.940 0.695 1
1 913 . 11 1 1 A 83 83 ALA CB C 83 18.124 19.057 -0.933 1
1 914 . 11 1 1 A 83 83 ALA N N 83 125.049 122.760 2.289 1
1 915 . 11 1 1 A 84 84 LEU H H 84 8.100 8.823 -0.723 1
1 916 . 11 1 1 A 84 84 LEU HA H 84 3.792 3.825 -0.033 1
1 926 . 11 1 1 A 84 84 LEU C C 84 180.173 179.127 1.046 1
1 927 . 11 1 1 A 84 84 LEU CA C 84 57.932 57.921 0.011 1
1 928 . 11 1 1 A 84 84 LEU CB C 84 41.157 41.433 -0.276 1
1 932 . 11 1 1 A 84 84 LEU N N 84 117.139 118.223 -1.084 1
1 933 . 11 1 1 A 85 85 ALA H H 85 7.715 8.928 -1.213 1
1 934 . 11 1 1 A 85 85 ALA HA H 85 4.061 4.120 -0.059 1
1 938 . 11 1 1 A 85 85 ALA C C 85 180.380 179.680 0.700 1
1 939 . 11 1 1 A 85 85 ALA CA C 85 55.212 55.418 -0.206 1
1 940 . 11 1 1 A 85 85 ALA CB C 85 17.803 18.628 -0.825 1
1 941 . 11 1 1 A 85 85 ALA N N 85 122.448 121.706 0.742 1
1 942 . 11 1 1 A 86 86 ILE H H 86 7.669 7.857 -0.188 1
1 943 . 11 1 1 A 86 86 ILE HA H 86 3.678 3.737 -0.059 1
1 953 . 11 1 1 A 86 86 ILE C C 86 178.692 178.781 -0.089 1
1 954 . 11 1 1 A 86 86 ILE CA C 86 65.226 64.567 0.659 1
1 955 . 11 1 1 A 86 86 ILE CB C 86 38.099 37.690 0.409 1
1 959 . 11 1 1 A 86 86 ILE N N 86 121.804 117.819 3.985 1
1 960 . 11 1 1 A 87 87 LEU H H 87 7.922 8.326 -0.404 1
1 961 . 11 1 1 A 87 87 LEU HA H 87 3.903 4.074 -0.171 1
1 971 . 11 1 1 A 87 87 LEU C C 87 178.610 178.888 -0.278 1
1 972 . 11 1 1 A 87 87 LEU CA C 87 58.221 57.849 0.372 1
1 973 . 11 1 1 A 87 87 LEU CB C 87 42.344 41.659 0.685 1
1 977 . 11 1 1 A 87 87 LEU N N 87 121.947 121.692 0.255 1
1 978 . 11 1 1 A 88 88 ARG H H 88 8.317 8.461 -0.144 1
1 979 . 11 1 1 A 88 88 ARG HA H 88 4.060 4.181 -0.121 1
1 986 . 11 1 1 A 88 88 ARG C C 88 180.698 177.597 3.101 1
1 987 . 11 1 1 A 88 88 ARG CA C 88 59.383 58.819 0.564 1
1 988 . 11 1 1 A 88 88 ARG CB C 88 30.055 30.080 -0.025 1
1 991 . 11 1 1 A 88 88 ARG N N 88 119.343 119.692 -0.349 1
1 992 . 11 1 1 A 89 89 GLN H H 89 8.270 7.785 0.485 1
1 993 . 11 1 1 A 89 89 GLN HA H 89 4.122 4.119 0.003 1
1 1000 . 11 1 1 A 89 89 GLN C C 89 177.955 178.727 -0.772 1
1 1001 . 11 1 1 A 89 89 GLN CA C 89 58.714 58.300 0.414 1
1 1002 . 11 1 1 A 89 89 GLN CB C 89 28.160 28.432 -0.272 1
1 1004 . 11 1 1 A 89 89 GLN N N 89 121.097 117.774 3.323 1
1 1006 . 11 1 1 A 90 90 ALA H H 90 7.558 7.524 0.034 1
1 1007 . 11 1 1 A 90 90 ALA HA H 90 4.123 4.175 -0.052 1
1 1011 . 11 1 1 A 90 90 ALA C C 90 178.076 178.029 0.047 1
1 1012 . 11 1 1 A 90 90 ALA CA C 90 52.942 53.955 -1.013 1
1 1013 . 11 1 1 A 90 90 ALA CB C 90 18.015 18.282 -0.267 1
1 1014 . 11 1 1 A 90 90 ALA N N 90 119.652 121.290 -1.638 1
1 1015 . 11 1 1 A 91 91 ARG H H 91 7.768 7.652 0.116 1
1 1016 . 11 1 1 A 91 91 ARG HA H 91 4.065 4.381 -0.316 1
1 1022 . 11 1 1 A 91 91 ARG C C 91 177.858 177.626 0.232 1
1 1023 . 11 1 1 A 91 91 ARG CA C 91 58.573 56.531 2.042 1
1 1024 . 11 1 1 A 91 91 ARG CB C 91 30.384 30.488 -0.104 1
1 1027 . 11 1 1 A 91 91 ARG N N 91 118.081 116.289 1.792 1
1 1028 . 11 1 1 A 92 92 GLU H H 92 7.691 8.234 -0.543 1
1 1029 . 11 1 1 A 92 92 GLU HA H 92 4.123 4.189 -0.066 1
1 1034 . 11 1 1 A 92 92 GLU C C 92 174.459 176.667 -2.208 1
1 1035 . 11 1 1 A 92 92 GLU CA C 92 61.565 60.729 0.836 1
1 1036 . 11 1 1 A 92 92 GLU CB C 92 27.583 29.177 -1.594 1
1 1038 . 11 1 1 A 92 92 GLU N N 92 118.447 117.688 0.759 1
1 1039 . 11 1 1 A 93 93 PRO HA H 93 4.716 4.572 0.144 1
1 1046 . 11 1 1 A 93 93 PRO C C 93 176.221 176.256 -0.035 1
1 1047 . 11 1 1 A 93 93 PRO CA C 93 63.149 62.331 0.818 1
1 1048 . 11 1 1 A 93 93 PRO CB C 93 32.571 33.235 -0.664 1
1 1051 . 11 1 1 A 94 94 ARG H H 94 8.434 9.004 -0.570 1
1 1052 . 11 1 1 A 94 94 ARG HA H 94 4.232 4.392 -0.160 1
1 1058 . 11 1 1 A 94 94 ARG C C 94 175.323 176.179 -0.856 1
1 1059 . 11 1 1 A 94 94 ARG CA C 94 56.972 56.845 0.127 1
1 1060 . 11 1 1 A 94 94 ARG CB C 94 30.448 31.740 -1.292 1
1 1063 . 11 1 1 A 94 94 ARG N N 94 115.987 118.747 -2.760 1
1 1064 . 11 1 1 A 95 95 GLN H H 95 7.246 7.617 -0.371 1
1 1065 . 11 1 1 A 95 95 GLN HA H 95 5.251 5.373 -0.122 1
1 1072 . 11 1 1 A 95 95 GLN C C 95 174.786 173.815 0.971 1
1 1073 . 11 1 1 A 95 95 GLN CA C 95 54.209 54.046 0.163 1
1 1074 . 11 1 1 A 95 95 GLN CB C 95 32.384 32.158 0.226 1
1 1076 . 11 1 1 A 95 95 GLN N N 95 115.998 120.071 -4.073 1
1 1078 . 11 1 1 A 96 96 ALA H H 96 8.739 8.555 0.184 1
1 1079 . 11 1 1 A 96 96 ALA HA H 96 5.412 5.366 0.046 1
1 1083 . 11 1 1 A 96 96 ALA C C 96 175.258 175.844 -0.586 1
1 1084 . 11 1 1 A 96 96 ALA CA C 96 50.355 50.423 -0.068 1
1 1085 . 11 1 1 A 96 96 ALA CB C 96 24.270 22.851 1.419 1
1 1086 . 11 1 1 A 96 96 ALA N N 96 126.197 126.020 0.177 1
1 1087 . 11 1 1 A 97 97 VAL H H 97 8.568 8.723 -0.155 1
1 1088 . 11 1 1 A 97 97 VAL HA H 97 4.804 5.023 -0.219 1
1 1096 . 11 1 1 A 97 97 VAL C C 97 175.982 174.825 1.157 1
1 1097 . 11 1 1 A 97 97 VAL CA C 97 61.442 61.354 0.088 1
1 1098 . 11 1 1 A 97 97 VAL CB C 97 33.413 33.612 -0.199 1
1 1101 . 11 1 1 A 97 97 VAL N N 97 120.702 120.319 0.383 1
1 1102 . 11 1 1 A 98 98 ILE H H 98 9.753 8.572 1.181 1
1 1103 . 11 1 1 A 98 98 ILE HA H 98 4.826 4.815 0.011 1
1 1113 . 11 1 1 A 98 98 ILE C C 98 174.292 174.799 -0.507 1
1 1114 . 11 1 1 A 98 98 ILE CA C 98 59.981 59.943 0.038 1
1 1115 . 11 1 1 A 98 98 ILE CB C 98 40.608 40.865 -0.257 1
1 1119 . 11 1 1 A 98 98 ILE N N 98 131.738 127.236 4.502 1
1 1120 . 11 1 1 A 99 99 VAL H H 99 8.493 8.566 -0.073 1
1 1121 . 11 1 1 A 99 99 VAL HA H 99 5.201 4.606 0.595 1
1 1129 . 11 1 1 A 99 99 VAL C C 99 176.557 175.389 1.168 1
1 1130 . 11 1 1 A 99 99 VAL CA C 99 61.495 61.946 -0.451 1
1 1131 . 11 1 1 A 99 99 VAL CB C 99 32.327 31.875 0.452 1
1 1134 . 11 1 1 A 99 99 VAL N N 99 129.537 129.156 0.381 1
1 1135 . 11 1 1 A 100 100 THR H H 100 9.050 8.485 0.565 1
1 1136 . 11 1 1 A 100 100 THR HA H 100 5.606 5.570 0.036 1
1 1141 . 11 1 1 A 100 100 THR C C 100 172.815 173.267 -0.452 1
1 1142 . 11 1 1 A 100 100 THR CA C 100 59.049 60.281 -1.232 1
1 1143 . 11 1 1 A 100 100 THR CB C 100 73.966 71.895 2.071 1
1 1145 . 11 1 1 A 100 100 THR N N 100 117.469 117.675 -0.206 1
1 1146 . 11 1 1 A 101 101 ARG H H 101 8.773 9.122 -0.349 1
1 1147 . 11 1 1 A 101 101 ARG HA H 101 4.989 5.021 -0.032 1
1 1155 . 11 1 1 A 101 101 ARG C C 101 174.738 175.694 -0.956 1
1 1156 . 11 1 1 A 101 101 ARG CA C 101 54.825 54.785 0.040 1
1 1157 . 11 1 1 A 101 101 ARG CB C 101 34.636 33.233 1.403 1
1 1160 . 11 1 1 A 101 101 ARG N N 101 117.532 121.526 -3.994 1
1 1162 . 11 1 1 A 102 102 LYS H H 102 8.616 8.365 0.251 1
1 1163 . 11 1 1 A 102 102 LYS HA H 102 4.232 4.340 -0.108 1
1 1171 . 11 1 1 A 102 102 LYS C C 102 175.935 176.017 -0.082 1
1 1172 . 11 1 1 A 102 102 LYS CA C 102 56.549 56.621 -0.072 1
1 1173 . 11 1 1 A 102 102 LYS CB C 102 33.266 32.338 0.928 1
1 1177 . 11 1 1 A 102 102 LYS N N 102 126.899 122.364 4.535 1
1 1178 . 11 1 1 A 103 103 LEU H H 103 8.424 8.912 -0.488 1
1 1179 . 11 1 1 A 103 103 LEU HA H 103 4.540 4.896 -0.356 1
1 1189 . 11 1 1 A 103 103 LEU C C 103 176.956 176.605 0.351 1
1 1190 . 11 1 1 A 103 103 LEU CA C 103 54.755 53.205 1.550 1
1 1191 . 11 1 1 A 103 103 LEU CB C 103 42.929 43.504 -0.575 1
1 1195 . 11 1 1 A 103 103 LEU N N 103 126.246 127.165 -0.919 1
1 1196 . 11 1 1 A 104 104 THR H H 104 8.201 8.623 -0.422 1
1 1197 . 11 1 1 A 104 104 THR HA H 104 4.624 4.471 0.153 1
1 1202 . 11 1 1 A 104 104 THR C C 104 172.954 173.969 -1.015 1
1 1203 . 11 1 1 A 104 104 THR CA C 104 59.483 60.905 -1.422 1
1 1204 . 11 1 1 A 104 104 THR CB C 104 69.761 68.836 0.925 1
1 1206 . 11 1 1 A 104 104 THR N N 104 117.263 118.199 -0.936 1
1 1207 . 11 1 1 A 105 105 PRO HA H 105 4.399 4.553 -0.154 1
1 1213 . 11 1 1 A 105 105 PRO CA C 105 63.495 62.558 0.937 1
1 1214 . 11 1 1 A 105 105 PRO CB C 105 32.096 32.516 -0.420 1
1 1217 . 11 1 1 A 106 106 GLU H H 106 8.519 9.104 -0.585 1
1 1218 . 11 1 1 A 106 106 GLU HA H 106 4.197 4.330 -0.133 1
1 1221 . 11 1 1 A 106 106 GLU C C 106 176.110 177.421 -1.311 1
1 1222 . 11 1 1 A 106 106 GLU CA C 106 56.743 59.432 -2.689 1
1 1223 . 11 1 1 A 106 106 GLU CB C 106 30.137 30.841 -0.704 1
1 1225 . 11 1 1 A 106 106 GLU N N 106 120.609 120.022 0.587 1
1 1226 . 11 1 1 A 107 107 ALA H H 107 8.241 7.635 0.606 1
1 1227 . 11 1 1 A 107 107 ALA HA H 107 4.317 4.533 -0.216 1
1 1231 . 11 1 1 A 107 107 ALA C C 107 177.299 175.685 1.614 1
1 1232 . 11 1 1 A 107 107 ALA CA C 107 52.203 51.797 0.406 1
1 1233 . 11 1 1 A 107 107 ALA CB C 107 19.392 18.690 0.702 1
1 1234 . 11 1 1 A 107 107 ALA N N 107 124.849 117.434 7.415 1
1 1235 . 11 1 1 A 108 108 MET H H 108 8.284 8.536 -0.252 1
1 1236 . 11 1 1 A 108 108 MET HA H 108 4.792 4.924 -0.132 1
1 1244 . 11 1 1 A 108 108 MET C C 108 174.337 173.926 0.411 1
1 1245 . 11 1 1 A 108 108 MET CA C 108 53.258 52.911 0.347 1
1 1246 . 11 1 1 A 108 108 MET CB C 108 32.608 32.922 -0.314 1
1 1249 . 11 1 1 A 108 108 MET N N 108 121.025 120.983 0.042 1
1 1250 . 11 1 1 A 109 109 PRO HA H 109 4.408 4.590 -0.182 1
1 1256 . 11 1 1 A 109 109 PRO C C 109 176.412 176.045 0.367 1
1 1257 . 11 1 1 A 109 109 PRO CA C 109 63.290 62.612 0.678 1
1 1258 . 11 1 1 A 109 109 PRO CB C 109 32.077 32.489 -0.412 1
1 1261 . 11 1 1 A 110 110 ASP H H 110 8.417 8.419 -0.002 1
1 1262 . 11 1 1 A 110 110 ASP HA H 110 4.573 5.123 -0.550 1
1 1265 . 11 1 1 A 110 110 ASP C C 110 176.508 174.958 1.550 1
1 1266 . 11 1 1 A 110 110 ASP CA C 110 54.085 52.811 1.274 1
1 1267 . 11 1 1 A 110 110 ASP CB C 110 41.075 42.072 -0.997 1
1 1268 . 11 1 1 A 110 110 ASP N N 110 120.239 120.243 -0.004 1
1 1269 . 11 1 1 A 111 111 LEU H H 111 8.279 8.665 -0.386 1
1 1270 . 11 1 1 A 111 111 LEU HA H 111 4.319 4.414 -0.095 1
1 1280 . 11 1 1 A 111 111 LEU C C 111 177.551 174.971 2.580 1
1 1281 . 11 1 1 A 111 111 LEU CA C 111 55.581 54.396 1.185 1
1 1282 . 11 1 1 A 111 111 LEU CB C 111 42.360 40.090 2.270 1
1 1286 . 11 1 1 A 111 111 LEU N N 111 123.318 126.809 -3.491 1
1 1287 . 11 1 1 A 112 112 ASN H H 112 8.487 7.699 0.788 1
1 1288 . 11 1 1 A 112 112 ASN HA H 112 4.725 5.078 -0.353 1
1 1293 . 11 1 1 A 112 112 ASN C C 112 175.454 172.900 2.554 1
1 1294 . 11 1 1 A 112 112 ASN CA C 112 53.610 53.047 0.563 1
1 1295 . 11 1 1 A 112 112 ASN CB C 112 39.116 42.046 -2.930 1
1 1296 . 11 1 1 A 112 112 ASN N N 112 118.752 120.353 -1.601 1
1 1298 . 11 1 1 A 115 115 GLY H H 115 8.205 8.395 -0.190 1
1 1299 . 11 1 1 A 115 115 GLY HA2 H 115 4.126 4.307 -0.181 1
1 1300 . 11 1 1 A 115 115 GLY HA3 H 115 4.126 4.307 -0.181 1
1 1301 . 11 1 1 A 115 115 GLY CA C 115 44.727 44.484 0.243 1
1 1302 . 11 1 1 A 116 116 PRO HA H 116 4.485 4.691 -0.206 1
1 1309 . 11 1 1 A 116 116 PRO CA C 116 63.298 62.551 0.747 1
1 1310 . 11 1 1 A 116 116 PRO CB C 116 32.077 33.450 -1.373 1
1 1313 . 11 1 1 A 117 117 SER H H 117 8.532 8.860 -0.328 1
1 1 . 12 1 1 A 7 7 GLY HA2 H 7 3.960 4.151 -0.191 1
1 2 . 12 1 1 A 7 7 GLY HA3 H 7 3.960 4.151 -0.191 1
1 3 . 12 1 1 A 7 7 GLY C C 7 174.009 171.940 2.069 1
1 4 . 12 1 1 A 7 7 GLY CA C 7 45.374 45.974 -0.600 1
1 5 . 12 1 1 A 8 8 ALA H H 8 8.163 8.728 -0.565 1
1 6 . 12 1 1 A 8 8 ALA HA H 8 4.381 5.225 -0.844 1
1 10 . 12 1 1 A 8 8 ALA C C 8 178.078 176.248 1.830 1
1 11 . 12 1 1 A 8 8 ALA CA C 8 52.677 51.390 1.287 1
1 12 . 12 1 1 A 8 8 ALA CB C 8 19.368 20.341 -0.973 1
1 13 . 12 1 1 A 8 8 ALA N N 8 123.721 127.298 -3.577 1
1 14 . 12 1 1 A 9 9 THR H H 9 8.142 8.725 -0.583 1
1 15 . 12 1 1 A 9 9 THR HA H 9 4.353 4.744 -0.391 1
1 20 . 12 1 1 A 9 9 THR C C 9 174.597 173.362 1.235 1
1 21 . 12 1 1 A 9 9 THR CA C 9 62.093 60.914 1.179 1
1 22 . 12 1 1 A 9 9 THR CB C 9 69.948 72.563 -2.615 1
1 24 . 12 1 1 A 9 9 THR N N 9 113.761 116.896 -3.135 1
1 25 . 12 1 1 A 10 10 LEU H H 10 8.218 8.464 -0.246 1
1 26 . 12 1 1 A 10 10 LEU HA H 10 4.169 4.528 -0.359 1
1 36 . 12 1 1 A 10 10 LEU C C 10 176.110 175.745 0.365 1
1 37 . 12 1 1 A 10 10 LEU CA C 10 61.099 54.661 6.438 1
1 38 . 12 1 1 A 10 10 LEU CB C 10 38.686 39.978 -1.292 1
1 42 . 12 1 1 A 10 10 LEU N N 10 123.516 127.166 -3.650 1
1 43 . 12 1 1 A 11 11 LYS H H 11 8.496 8.086 0.410 1
1 44 . 12 1 1 A 11 11 LYS HA H 11 4.891 4.692 0.199 1
1 49 . 12 1 1 A 11 11 LYS C C 11 175.794 175.593 0.201 1
1 50 . 12 1 1 A 11 11 LYS CA C 11 55.652 54.588 1.064 1
1 51 . 12 1 1 A 11 11 LYS CB C 11 29.444 36.913 -7.469 1
1 52 . 12 1 1 A 11 11 LYS N N 11 125.141 121.918 3.223 1
1 53 . 12 1 1 A 12 12 GLN HA H 12 4.315 4.528 -0.213 1
1 54 . 12 1 1 A 12 12 GLN C C 12 176.300 174.820 1.480 1
1 55 . 12 1 1 A 12 12 GLN CA C 12 56.286 55.801 0.485 1
1 56 . 12 1 1 A 12 12 GLN CB C 12 32.901 28.032 4.869 1
1 57 . 12 1 1 A 13 13 LEU H H 13 8.410 8.151 0.259 1
1 58 . 12 1 1 A 13 13 LEU HA H 13 4.348 4.469 -0.121 1
1 67 . 12 1 1 A 13 13 LEU C C 13 177.120 175.324 1.796 1
1 68 . 12 1 1 A 13 13 LEU CA C 13 55.142 54.334 0.808 1
1 69 . 12 1 1 A 13 13 LEU CB C 13 42.352 44.685 -2.333 1
1 73 . 12 1 1 A 13 13 LEU N N 13 124.340 124.918 -0.578 1
1 74 . 12 1 1 A 14 14 ASP H H 14 8.250 8.910 -0.660 1
1 75 . 12 1 1 A 14 14 ASP HA H 14 4.540 4.478 0.062 1
1 78 . 12 1 1 A 14 14 ASP C C 14 176.769 175.246 1.523 1
1 79 . 12 1 1 A 14 14 ASP CA C 14 54.772 56.516 -1.744 1
1 80 . 12 1 1 A 14 14 ASP CB C 14 41.322 39.740 1.582 1
1 81 . 12 1 1 A 14 14 ASP N N 14 120.493 126.873 -6.380 1
1 82 . 12 1 1 A 15 15 GLY H H 15 8.428 8.739 -0.311 1
1 83 . 12 1 1 A 15 15 GLY HA2 H 15 4.089 4.150 -0.061 1
1 84 . 12 1 1 A 15 15 GLY HA3 H 15 3.874 4.154 -0.280 1
1 85 . 12 1 1 A 15 15 GLY C C 15 174.122 173.441 0.681 1
1 86 . 12 1 1 A 15 15 GLY CA C 15 45.972 45.769 0.203 1
1 87 . 12 1 1 A 15 15 GLY N N 15 108.670 108.290 0.380 1
1 88 . 12 1 1 A 16 16 ILE H H 16 7.727 7.075 0.652 1
1 89 . 12 1 1 A 16 16 ILE HA H 16 4.705 4.388 0.317 1
1 99 . 12 1 1 A 16 16 ILE C C 16 175.807 174.265 1.542 1
1 100 . 12 1 1 A 16 16 ILE CA C 16 60.703 60.354 0.349 1
1 101 . 12 1 1 A 16 16 ILE CB C 16 38.509 39.368 -0.859 1
1 105 . 12 1 1 A 16 16 ILE N N 16 120.267 120.895 -0.628 1
1 106 . 12 1 1 A 17 17 HIS H H 17 9.101 8.977 0.124 1
1 107 . 12 1 1 A 17 17 HIS HA H 17 4.782 5.399 -0.617 1
1 112 . 12 1 1 A 17 17 HIS C C 17 173.051 174.160 -1.109 1
1 113 . 12 1 1 A 17 17 HIS CA C 17 55.353 53.054 2.299 1
1 114 . 12 1 1 A 17 17 HIS CB C 17 32.468 32.571 -0.103 1
1 117 . 12 1 1 A 17 17 HIS N N 17 125.061 127.841 -2.780 1
1 118 . 12 1 1 A 18 18 VAL H H 18 8.427 8.557 -0.130 1
1 119 . 12 1 1 A 18 18 VAL HA H 18 4.375 3.928 0.447 1
1 127 . 12 1 1 A 18 18 VAL C C 18 174.702 175.188 -0.486 1
1 128 . 12 1 1 A 18 18 VAL CA C 18 62.035 63.083 -1.048 1
1 129 . 12 1 1 A 18 18 VAL CB C 18 32.325 32.058 0.267 1
1 132 . 12 1 1 A 18 18 VAL N N 18 127.069 127.053 0.016 1
1 133 . 12 1 1 A 19 19 THR H H 19 9.272 8.267 1.005 1
1 134 . 12 1 1 A 19 19 THR HA H 19 4.512 4.692 -0.180 1
1 139 . 12 1 1 A 19 19 THR C C 19 172.784 173.608 -0.824 1
1 140 . 12 1 1 A 19 19 THR CA C 19 62.512 61.873 0.639 1
1 141 . 12 1 1 A 19 19 THR CB C 19 70.663 69.446 1.217 1
1 143 . 12 1 1 A 19 19 THR N N 19 126.619 122.669 3.950 1
1 144 . 12 1 1 A 20 20 ILE H H 20 8.737 9.110 -0.373 1
1 145 . 12 1 1 A 20 20 ILE HA H 20 4.870 4.516 0.354 1
1 155 . 12 1 1 A 20 20 ILE C C 20 175.315 174.871 0.444 1
1 156 . 12 1 1 A 20 20 ILE CA C 20 60.157 60.179 -0.022 1
1 157 . 12 1 1 A 20 20 ILE CB C 20 38.603 37.494 1.109 1
1 161 . 12 1 1 A 20 20 ILE N N 20 128.114 128.289 -0.175 1
1 162 . 12 1 1 A 21 21 LEU H H 21 8.902 8.800 0.102 1
1 163 . 12 1 1 A 21 21 LEU HA H 21 4.804 4.885 -0.081 1
1 173 . 12 1 1 A 21 21 LEU C C 21 175.565 175.441 0.124 1
1 174 . 12 1 1 A 21 21 LEU CA C 21 52.731 53.786 -1.055 1
1 175 . 12 1 1 A 21 21 LEU CB C 21 43.947 43.454 0.493 1
1 179 . 12 1 1 A 21 21 LEU N N 21 125.457 128.573 -3.116 1
1 180 . 12 1 1 A 22 22 HIS H H 22 8.577 8.950 -0.373 1
1 181 . 12 1 1 A 22 22 HIS HA H 22 5.013 5.159 -0.146 1
1 186 . 12 1 1 A 22 22 HIS C C 22 174.258 174.791 -0.533 1
1 187 . 12 1 1 A 22 22 HIS CA C 22 55.880 54.288 1.592 1
1 188 . 12 1 1 A 22 22 HIS CB C 22 30.901 30.738 0.163 1
1 191 . 12 1 1 A 22 22 HIS N N 22 122.595 123.372 -0.777 1
1 192 . 12 1 1 A 23 23 LYS H H 23 8.712 10.045 -1.333 1
1 193 . 12 1 1 A 23 23 LYS HA H 23 4.880 5.096 -0.216 1
1 202 . 12 1 1 A 23 23 LYS C C 23 174.265 175.869 -1.604 1
1 203 . 12 1 1 A 23 23 LYS CA C 23 54.314 54.144 0.170 1
1 204 . 12 1 1 A 23 23 LYS CB C 23 36.068 36.030 0.038 1
1 208 . 12 1 1 A 23 23 LYS N N 23 120.814 120.798 0.016 1
1 209 . 12 1 1 A 24 24 GLU H H 24 8.360 8.306 0.054 1
1 210 . 12 1 1 A 24 24 GLU HA H 24 4.350 4.501 -0.151 1
1 215 . 12 1 1 A 24 24 GLU C C 24 177.843 176.155 1.688 1
1 216 . 12 1 1 A 24 24 GLU CA C 24 55.601 55.218 0.383 1
1 217 . 12 1 1 A 24 24 GLU CB C 24 30.512 30.501 0.011 1
1 219 . 12 1 1 A 24 24 GLU N N 24 117.859 119.869 -2.010 1
1 220 . 12 1 1 A 25 25 GLU H H 25 9.146 8.796 0.350 1
1 221 . 12 1 1 A 25 25 GLU HA H 25 3.924 3.938 -0.014 1
1 226 . 12 1 1 A 25 25 GLU C C 25 177.809 177.436 0.373 1
1 227 . 12 1 1 A 25 25 GLU CA C 25 58.568 58.392 0.176 1
1 228 . 12 1 1 A 25 25 GLU CB C 25 29.313 29.062 0.251 1
1 230 . 12 1 1 A 25 25 GLU N N 25 124.543 121.431 3.112 1
1 231 . 12 1 1 A 26 26 GLY H H 26 8.242 8.926 -0.684 1
1 232 . 12 1 1 A 26 26 GLY HA2 H 26 4.287 4.034 0.253 1
1 233 . 12 1 1 A 26 26 GLY HA3 H 26 3.407 4.035 -0.628 1
1 234 . 12 1 1 A 26 26 GLY C C 26 174.234 175.535 -1.301 1
1 235 . 12 1 1 A 26 26 GLY CA C 26 46.113 45.553 0.560 1
1 236 . 12 1 1 A 26 26 GLY N N 26 115.394 114.147 1.247 1
1 237 . 12 1 1 A 27 27 ALA H H 27 7.432 8.258 -0.826 1
1 238 . 12 1 1 A 27 27 ALA HA H 27 4.402 4.205 0.197 1
1 242 . 12 1 1 A 27 27 ALA C C 27 178.138 178.044 0.094 1
1 243 . 12 1 1 A 27 27 ALA CA C 27 52.273 53.186 -0.913 1
1 244 . 12 1 1 A 27 27 ALA CB C 27 20.214 19.633 0.581 1
1 245 . 12 1 1 A 27 27 ALA N N 27 122.323 123.236 -0.913 1
1 246 . 12 1 1 A 28 28 GLY H H 28 8.624 7.810 0.814 1
1 247 . 12 1 1 A 28 28 GLY HA2 H 28 4.134 4.066 0.068 1
1 248 . 12 1 1 A 28 28 GLY HA3 H 28 3.953 4.108 -0.155 1
1 249 . 12 1 1 A 28 28 GLY C C 28 174.069 175.051 -0.982 1
1 250 . 12 1 1 A 28 28 GLY CA C 28 44.546 44.478 0.068 1
1 251 . 12 1 1 A 28 28 GLY N N 28 107.593 105.009 2.584 1
1 252 . 12 1 1 A 29 29 LEU H H 29 7.934 8.579 -0.645 1
1 253 . 12 1 1 A 29 29 LEU HA H 29 4.059 4.360 -0.301 1
1 263 . 12 1 1 A 29 29 LEU C C 29 177.548 176.858 0.690 1
1 264 . 12 1 1 A 29 29 LEU CA C 29 56.298 56.392 -0.094 1
1 265 . 12 1 1 A 29 29 LEU CB C 29 41.940 42.829 -0.889 1
1 269 . 12 1 1 A 29 29 LEU N N 29 115.495 121.290 -5.795 1
1 270 . 12 1 1 A 30 30 GLY H H 30 8.669 7.848 0.821 1
1 271 . 12 1 1 A 30 30 GLY HA2 H 30 4.264 4.059 0.205 1
1 272 . 12 1 1 A 30 30 GLY HA3 H 30 4.001 4.128 -0.127 1
1 273 . 12 1 1 A 30 30 GLY C C 30 175.296 172.989 2.307 1
1 274 . 12 1 1 A 30 30 GLY CA C 30 46.368 44.983 1.385 1
1 275 . 12 1 1 A 30 30 GLY N N 30 103.121 106.238 -3.117 1
1 276 . 12 1 1 A 31 31 PHE H H 31 7.044 7.361 -0.317 1
1 277 . 12 1 1 A 31 31 PHE HA H 31 4.541 4.717 -0.176 1
1 285 . 12 1 1 A 31 31 PHE C C 31 171.141 172.715 -1.574 1
1 286 . 12 1 1 A 31 31 PHE CA C 31 55.704 55.184 0.520 1
1 287 . 12 1 1 A 31 31 PHE CB C 31 40.745 41.983 -1.238 1
1 293 . 12 1 1 A 31 31 PHE N N 31 115.404 114.926 0.478 1
1 294 . 12 1 1 A 32 32 SER H H 32 8.752 9.151 -0.399 1
1 295 . 12 1 1 A 32 32 SER HA H 32 4.990 5.127 -0.137 1
1 298 . 12 1 1 A 32 32 SER C C 32 175.049 172.862 2.187 1
1 299 . 12 1 1 A 32 32 SER CA C 32 55.001 56.204 -1.203 1
1 300 . 12 1 1 A 32 32 SER CB C 32 67.170 66.761 0.409 1
1 301 . 12 1 1 A 32 32 SER N N 32 113.639 114.988 -1.349 1
1 302 . 12 1 1 A 33 33 LEU H H 33 8.639 8.237 0.402 1
1 303 . 12 1 1 A 33 33 LEU HA H 33 5.573 4.969 0.604 1
1 313 . 12 1 1 A 33 33 LEU C C 33 175.827 175.437 0.390 1
1 314 . 12 1 1 A 33 33 LEU CA C 33 53.620 53.844 -0.224 1
1 315 . 12 1 1 A 33 33 LEU CB C 33 45.399 43.511 1.888 1
1 319 . 12 1 1 A 33 33 LEU N N 33 118.936 124.413 -5.477 1
1 320 . 12 1 1 A 34 34 ALA H H 34 9.410 8.878 0.532 1
1 321 . 12 1 1 A 34 34 ALA HA H 34 4.749 5.059 -0.310 1
1 325 . 12 1 1 A 34 34 ALA C C 34 176.231 176.769 -0.538 1
1 326 . 12 1 1 A 34 34 ALA CA C 34 50.425 51.249 -0.824 1
1 327 . 12 1 1 A 34 34 ALA CB C 34 22.518 23.300 -0.782 1
1 328 . 12 1 1 A 34 34 ALA N N 34 124.395 121.797 2.598 1
1 329 . 12 1 1 A 35 35 GLY H H 35 8.130 8.581 -0.451 1
1 330 . 12 1 1 A 35 35 GLY HA2 H 35 4.712 4.087 0.625 1
1 331 . 12 1 1 A 35 35 GLY HA3 H 35 3.955 4.136 -0.181 1
1 332 . 12 1 1 A 35 35 GLY C C 35 174.750 172.998 1.752 1
1 333 . 12 1 1 A 35 35 GLY CA C 35 44.494 44.893 -0.399 1
1 334 . 12 1 1 A 35 35 GLY N N 35 103.650 107.748 -4.098 1
1 335 . 12 1 1 A 36 36 GLY H H 36 8.217 8.076 0.141 1
1 336 . 12 1 1 A 36 36 GLY HA2 H 36 4.494 4.333 0.161 1
1 337 . 12 1 1 A 36 36 GLY HA3 H 36 3.836 4.354 -0.518 1
1 338 . 12 1 1 A 36 36 GLY C C 36 174.410 174.077 0.333 1
1 339 . 12 1 1 A 36 36 GLY CA C 36 45.462 45.991 -0.529 1
1 340 . 12 1 1 A 36 36 GLY N N 36 122.114 108.223 13.891 1
1 341 . 12 1 1 A 37 37 ALA H H 37 8.963 8.583 0.380 1
1 342 . 12 1 1 A 37 37 ALA HA H 37 3.998 4.139 -0.141 1
1 346 . 12 1 1 A 37 37 ALA C C 37 176.935 179.209 -2.274 1
1 347 . 12 1 1 A 37 37 ALA CA C 37 55.308 54.486 0.822 1
1 348 . 12 1 1 A 37 37 ALA CB C 37 18.822 18.692 0.130 1
1 349 . 12 1 1 A 37 37 ALA N N 37 123.418 121.863 1.555 1
1 350 . 12 1 1 A 38 38 ASP H H 38 10.586 8.228 2.358 1
1 351 . 12 1 1 A 38 38 ASP HA H 38 4.485 4.333 0.152 1
1 354 . 12 1 1 A 38 38 ASP C C 38 175.309 176.487 -1.178 1
1 355 . 12 1 1 A 38 38 ASP CA C 38 52.730 56.390 -3.660 1
1 356 . 12 1 1 A 38 38 ASP CB C 38 38.689 41.013 -2.324 1
1 357 . 12 1 1 A 38 38 ASP N N 38 111.480 118.254 -6.774 1
1 358 . 12 1 1 A 39 39 LEU H H 39 7.789 7.682 0.107 1
1 359 . 12 1 1 A 39 39 LEU HA H 39 4.699 4.340 0.359 1
1 369 . 12 1 1 A 39 39 LEU C C 39 176.377 177.961 -1.584 1
1 370 . 12 1 1 A 39 39 LEU CA C 39 52.952 54.201 -1.249 1
1 371 . 12 1 1 A 39 39 LEU CB C 39 43.294 41.812 1.482 1
1 375 . 12 1 1 A 39 39 LEU N N 39 122.545 121.259 1.286 1
1 376 . 12 1 1 A 40 40 GLU H H 40 8.331 8.935 -0.604 1
1 377 . 12 1 1 A 40 40 GLU HA H 40 3.978 4.139 -0.161 1
1 382 . 12 1 1 A 40 40 GLU C C 40 176.887 177.120 -0.233 1
1 383 . 12 1 1 A 40 40 GLU CA C 40 59.066 59.274 -0.208 1
1 384 . 12 1 1 A 40 40 GLU CB C 40 29.523 29.285 0.238 1
1 386 . 12 1 1 A 40 40 GLU N N 40 118.036 120.556 -2.520 1
1 387 . 12 1 1 A 41 41 ASN H H 41 7.890 7.641 0.249 1
1 388 . 12 1 1 A 41 41 ASN HA H 41 4.820 4.952 -0.132 1
1 393 . 12 1 1 A 41 41 ASN CA C 41 52.316 51.988 0.328 1
1 394 . 12 1 1 A 41 41 ASN CB C 41 37.409 36.900 0.509 1
1 395 . 12 1 1 A 41 41 ASN N N 41 115.196 118.749 -3.553 1
1 397 . 12 1 1 A 42 42 LYS H H 42 7.943 8.000 -0.057 1
1 398 . 12 1 1 A 42 42 LYS HA H 42 4.328 4.476 -0.148 1
1 407 . 12 1 1 A 42 42 LYS C C 42 177.081 177.333 -0.252 1
1 408 . 12 1 1 A 42 42 LYS CA C 42 56.567 59.542 -2.975 1
1 409 . 12 1 1 A 42 42 LYS CB C 42 33.120 32.367 0.753 1
1 413 . 12 1 1 A 42 42 LYS N N 42 120.612 125.698 -5.086 1
1 414 . 12 1 1 A 43 43 VAL H H 43 7.456 7.635 -0.179 1
1 415 . 12 1 1 A 43 43 VAL HA H 43 4.059 4.261 -0.202 1
1 423 . 12 1 1 A 43 43 VAL CA C 43 61.330 61.734 -0.404 1
1 424 . 12 1 1 A 43 43 VAL CB C 43 32.819 32.283 0.536 1
1 427 . 12 1 1 A 43 43 VAL N N 43 118.284 118.682 -0.398 1
1 428 . 12 1 1 A 44 44 ILE H H 44 8.481 8.622 -0.141 1
1 429 . 12 1 1 A 44 44 ILE HA H 44 4.913 4.513 0.400 1
1 439 . 12 1 1 A 44 44 ILE C C 44 176.719 175.958 0.761 1
1 440 . 12 1 1 A 44 44 ILE CA C 44 59.946 62.207 -2.261 1
1 441 . 12 1 1 A 44 44 ILE CB C 44 35.784 38.283 -2.499 1
1 445 . 12 1 1 A 44 44 ILE N N 44 127.089 129.782 -2.693 1
1 446 . 12 1 1 A 45 45 THR H H 45 8.906 9.686 -0.780 1
1 447 . 12 1 1 A 45 45 THR HA H 45 5.400 4.983 0.417 1
1 452 . 12 1 1 A 45 45 THR CA C 45 58.528 59.676 -1.148 1
1 453 . 12 1 1 A 45 45 THR CB C 45 73.760 71.934 1.826 1
1 455 . 12 1 1 A 45 45 THR N N 45 116.832 118.136 -1.304 1
1 456 . 12 1 1 A 46 46 VAL H H 46 8.336 8.948 -0.612 1
1 457 . 12 1 1 A 46 46 VAL HA H 46 4.059 4.218 -0.159 1
1 465 . 12 1 1 A 46 46 VAL C C 46 176.648 176.494 0.154 1
1 466 . 12 1 1 A 46 46 VAL CA C 46 63.058 63.190 -0.132 1
1 467 . 12 1 1 A 46 46 VAL CB C 46 31.601 31.006 0.595 1
1 470 . 12 1 1 A 46 46 VAL N N 46 118.542 122.452 -3.910 1
1 471 . 12 1 1 A 47 47 HIS H H 47 9.382 8.874 0.508 1
1 472 . 12 1 1 A 47 47 HIS HA H 47 4.628 4.225 0.403 1
1 477 . 12 1 1 A 47 47 HIS C C 47 174.339 174.088 0.251 1
1 478 . 12 1 1 A 47 47 HIS CA C 47 57.764 59.847 -2.083 1
1 479 . 12 1 1 A 47 47 HIS CB C 47 31.453 30.502 0.951 1
1 482 . 12 1 1 A 47 47 HIS N N 47 133.900 128.310 5.590 1
1 483 . 12 1 1 A 48 48 ARG H H 48 7.135 7.740 -0.605 1
1 484 . 12 1 1 A 48 48 ARG HA H 48 4.360 4.692 -0.332 1
1 491 . 12 1 1 A 48 48 ARG C C 48 173.877 174.569 -0.692 1
1 492 . 12 1 1 A 48 48 ARG CA C 48 54.385 55.032 -0.647 1
1 493 . 12 1 1 A 48 48 ARG CB C 48 33.996 34.429 -0.433 1
1 496 . 12 1 1 A 48 48 ARG N N 48 114.736 117.811 -3.075 1
1 497 . 12 1 1 A 49 49 VAL H H 49 8.690 8.838 -0.148 1
1 498 . 12 1 1 A 49 49 VAL HA H 49 4.015 4.480 -0.465 1
1 506 . 12 1 1 A 49 49 VAL C C 49 176.255 175.723 0.532 1
1 507 . 12 1 1 A 49 49 VAL CA C 49 61.882 61.589 0.293 1
1 508 . 12 1 1 A 49 49 VAL CB C 49 32.261 33.276 -1.015 1
1 511 . 12 1 1 A 49 49 VAL N N 49 122.844 122.191 0.653 1
1 512 . 12 1 1 A 50 50 PHE H H 50 7.866 9.080 -1.214 1
1 513 . 12 1 1 A 50 50 PHE HA H 50 4.866 4.550 0.316 1
1 521 . 12 1 1 A 50 50 PHE C C 50 174.847 176.337 -1.490 1
1 522 . 12 1 1 A 50 50 PHE CA C 50 54.596 57.607 -3.011 1
1 523 . 12 1 1 A 50 50 PHE CB C 50 36.558 38.790 -2.232 1
1 529 . 12 1 1 A 50 50 PHE N N 50 128.498 126.874 1.624 1
1 530 . 12 1 1 A 51 51 PRO HA H 51 4.386 4.547 -0.161 1
1 537 . 12 1 1 A 51 51 PRO C C 51 177.321 176.650 0.671 1
1 538 . 12 1 1 A 51 51 PRO CA C 51 64.381 64.537 -0.156 1
1 539 . 12 1 1 A 51 51 PRO CB C 51 31.773 32.238 -0.465 1
1 542 . 12 1 1 A 52 52 ASN H H 52 8.814 8.542 0.272 1
1 543 . 12 1 1 A 52 52 ASN HA H 52 4.496 5.018 -0.522 1
1 548 . 12 1 1 A 52 52 ASN C C 52 174.823 174.694 0.129 1
1 549 . 12 1 1 A 52 52 ASN CA C 52 54.719 52.221 2.498 1
1 550 . 12 1 1 A 52 52 ASN CB C 52 38.109 39.235 -1.126 1
1 551 . 12 1 1 A 52 52 ASN N N 52 116.145 116.221 -0.076 1
1 553 . 12 1 1 A 53 53 GLY H H 53 7.730 8.268 -0.538 1
1 554 . 12 1 1 A 53 53 GLY HA2 H 53 4.430 4.355 0.075 1
1 555 . 12 1 1 A 53 53 GLY HA3 H 53 4.089 4.363 -0.274 1
1 556 . 12 1 1 A 53 53 GLY C C 53 174.810 174.013 0.797 1
1 557 . 12 1 1 A 53 53 GLY CA C 53 44.987 45.881 -0.894 1
1 558 . 12 1 1 A 53 53 GLY N N 53 106.196 110.840 -4.644 1
1 559 . 12 1 1 A 54 54 LEU H H 54 8.764 9.017 -0.253 1
1 560 . 12 1 1 A 54 54 LEU HA H 54 4.041 4.209 -0.168 1
1 570 . 12 1 1 A 54 54 LEU C C 54 179.712 178.630 1.082 1
1 571 . 12 1 1 A 54 54 LEU CA C 54 58.310 57.732 0.578 1
1 572 . 12 1 1 A 54 54 LEU CB C 54 42.390 42.190 0.200 1
1 576 . 12 1 1 A 54 54 LEU N N 54 118.836 119.725 -0.889 1
1 577 . 12 1 1 A 55 55 ALA H H 55 7.593 7.895 -0.302 1
1 578 . 12 1 1 A 55 55 ALA HA H 55 4.275 3.873 0.402 1
1 582 . 12 1 1 A 55 55 ALA C C 55 181.307 179.432 1.875 1
1 583 . 12 1 1 A 55 55 ALA CA C 55 54.825 54.918 -0.093 1
1 584 . 12 1 1 A 55 55 ALA CB C 55 18.345 18.209 0.136 1
1 585 . 12 1 1 A 55 55 ALA N N 55 118.782 121.396 -2.614 1
1 586 . 12 1 1 A 56 56 SER H H 56 9.339 7.824 1.515 1
1 587 . 12 1 1 A 56 56 SER HA H 56 4.023 4.244 -0.221 1
1 589 . 12 1 1 A 56 56 SER C C 56 176.392 177.315 -0.923 1
1 590 . 12 1 1 A 56 56 SER CA C 56 60.984 61.235 -0.251 1
1 591 . 12 1 1 A 56 56 SER CB C 56 62.987 63.011 -0.024 1
1 592 . 12 1 1 A 56 56 SER N N 56 117.631 112.949 4.682 1
1 593 . 12 1 1 A 57 57 GLN H H 57 7.942 7.878 0.064 1
1 594 . 12 1 1 A 57 57 GLN HA H 57 4.034 3.994 0.040 1
1 601 . 12 1 1 A 57 57 GLN C C 57 177.400 178.675 -1.275 1
1 602 . 12 1 1 A 57 57 GLN CA C 57 58.362 58.857 -0.495 1
1 603 . 12 1 1 A 57 57 GLN CB C 57 28.801 28.649 0.152 1
1 605 . 12 1 1 A 57 57 GLN N N 57 118.162 121.627 -3.465 1
1 607 . 12 1 1 A 58 58 GLU H H 58 7.683 8.675 -0.992 1
1 608 . 12 1 1 A 58 58 GLU HA H 58 4.163 4.103 0.060 1
1 613 . 12 1 1 A 58 58 GLU C C 58 179.248 176.713 2.535 1
1 614 . 12 1 1 A 58 58 GLU CA C 58 59.559 58.705 0.854 1
1 615 . 12 1 1 A 58 58 GLU CB C 58 29.317 29.677 -0.360 1
1 617 . 12 1 1 A 58 58 GLU N N 58 119.877 119.362 0.515 1
1 618 . 12 1 1 A 59 59 GLY H H 59 7.446 7.465 -0.019 1
1 619 . 12 1 1 A 59 59 GLY HA2 H 59 4.100 3.965 0.135 1
1 620 . 12 1 1 A 59 59 GLY HA3 H 59 3.770 3.972 -0.202 1
1 621 . 12 1 1 A 59 59 GLY C C 59 175.432 175.077 0.355 1
1 622 . 12 1 1 A 59 59 GLY CA C 59 46.817 45.193 1.624 1
1 623 . 12 1 1 A 59 59 GLY N N 59 102.653 107.881 -5.228 1
1 624 . 12 1 1 A 60 60 THR H H 60 8.343 7.951 0.392 1
1 625 . 12 1 1 A 60 60 THR HA H 60 4.037 4.177 -0.140 1
1 630 . 12 1 1 A 60 60 THR C C 60 175.843 174.138 1.705 1
1 631 . 12 1 1 A 60 60 THR CA C 60 64.792 64.894 -0.102 1
1 632 . 12 1 1 A 60 60 THR CB C 60 69.325 69.572 -0.247 1
1 634 . 12 1 1 A 60 60 THR N N 60 113.863 112.484 1.379 1
1 635 . 12 1 1 A 61 61 ILE H H 61 8.802 7.634 1.168 1
1 636 . 12 1 1 A 61 61 ILE HA H 61 3.631 4.130 -0.499 1
1 646 . 12 1 1 A 61 61 ILE C C 61 174.198 174.499 -0.301 1
1 647 . 12 1 1 A 61 61 ILE CA C 61 62.938 60.693 2.245 1
1 648 . 12 1 1 A 61 61 ILE CB C 61 37.225 36.628 0.597 1
1 652 . 12 1 1 A 61 61 ILE N N 61 126.153 120.174 5.979 1
1 653 . 12 1 1 A 62 62 GLN H H 62 7.124 9.630 -2.506 1
1 654 . 12 1 1 A 62 62 GLN HA H 62 4.500 4.747 -0.247 1
1 661 . 12 1 1 A 62 62 GLN C C 62 174.556 175.044 -0.488 1
1 662 . 12 1 1 A 62 62 GLN CA C 62 53.364 54.169 -0.805 1
1 663 . 12 1 1 A 62 62 GLN CB C 62 32.196 32.034 0.162 1
1 665 . 12 1 1 A 62 62 GLN N N 62 123.730 126.532 -2.802 1
1 667 . 12 1 1 A 63 63 LYS H H 63 8.399 8.619 -0.220 1
1 668 . 12 1 1 A 63 63 LYS HA H 63 3.464 4.082 -0.618 1
1 677 . 12 1 1 A 63 63 LYS CA C 63 57.905 58.393 -0.488 1
1 678 . 12 1 1 A 63 63 LYS CB C 63 32.260 32.010 0.250 1
1 682 . 12 1 1 A 63 63 LYS N N 63 121.381 124.883 -3.502 1
1 683 . 12 1 1 A 64 64 GLY H H 64 9.265 8.832 0.433 1
1 684 . 12 1 1 A 64 64 GLY HA2 H 64 4.415 4.037 0.378 1
1 685 . 12 1 1 A 64 64 GLY HA3 H 64 3.639 4.047 -0.408 1
1 686 . 12 1 1 A 64 64 GLY CA C 64 44.881 45.103 -0.222 1
1 687 . 12 1 1 A 64 64 GLY N N 64 113.750 114.411 -0.661 1
1 688 . 12 1 1 A 65 65 ASN H H 65 7.594 8.226 -0.632 1
1 689 . 12 1 1 A 65 65 ASN HA H 65 4.798 4.900 -0.102 1
1 694 . 12 1 1 A 65 65 ASN C C 65 175.042 173.848 1.194 1
1 695 . 12 1 1 A 65 65 ASN CA C 65 53.047 53.050 -0.003 1
1 696 . 12 1 1 A 65 65 ASN CB C 65 38.153 40.211 -2.058 1
1 697 . 12 1 1 A 65 65 ASN N N 65 117.999 119.435 -1.436 1
1 699 . 12 1 1 A 66 66 GLU H H 66 8.538 8.578 -0.040 1
1 700 . 12 1 1 A 66 66 GLU HA H 66 4.634 4.998 -0.364 1
1 705 . 12 1 1 A 66 66 GLU C C 66 176.620 174.994 1.626 1
1 706 . 12 1 1 A 66 66 GLU CA C 66 55.863 54.849 1.014 1
1 707 . 12 1 1 A 66 66 GLU CB C 66 30.899 32.960 -2.061 1
1 709 . 12 1 1 A 66 66 GLU N N 66 122.233 121.392 0.841 1
1 710 . 12 1 1 A 67 67 VAL H H 67 8.452 8.910 -0.458 1
1 711 . 12 1 1 A 67 67 VAL HA H 67 4.172 4.249 -0.077 1
1 719 . 12 1 1 A 67 67 VAL C C 67 174.641 175.441 -0.800 1
1 720 . 12 1 1 A 67 67 VAL CA C 67 61.856 62.619 -0.763 1
1 721 . 12 1 1 A 67 67 VAL CB C 67 31.066 31.772 -0.706 1
1 724 . 12 1 1 A 67 67 VAL N N 67 126.311 127.560 -1.249 1
1 725 . 12 1 1 A 68 68 LEU H H 68 9.000 9.190 -0.190 1
1 726 . 12 1 1 A 68 68 LEU HA H 68 4.390 4.344 0.046 1
1 736 . 12 1 1 A 68 68 LEU C C 68 178.924 176.586 2.338 1
1 737 . 12 1 1 A 68 68 LEU CA C 68 56.990 56.108 0.882 1
1 738 . 12 1 1 A 68 68 LEU CB C 68 42.392 42.486 -0.094 1
1 742 . 12 1 1 A 68 68 LEU N N 68 127.175 128.995 -1.820 1
1 743 . 12 1 1 A 69 69 SER H H 69 7.666 7.745 -0.079 1
1 744 . 12 1 1 A 69 69 SER HA H 69 5.144 4.899 0.245 1
1 747 . 12 1 1 A 69 69 SER C C 69 172.722 172.485 0.237 1
1 748 . 12 1 1 A 69 69 SER CA C 69 57.606 57.783 -0.177 1
1 749 . 12 1 1 A 69 69 SER CB C 69 64.511 67.247 -2.736 1
1 750 . 12 1 1 A 69 69 SER N N 69 110.346 110.661 -0.315 1
1 751 . 12 1 1 A 70 70 ILE H H 70 7.965 8.380 -0.415 1
1 752 . 12 1 1 A 70 70 ILE HA H 70 4.548 4.800 -0.252 1
1 762 . 12 1 1 A 70 70 ILE C C 70 174.993 176.140 -1.147 1
1 763 . 12 1 1 A 70 70 ILE CA C 70 60.897 60.166 0.731 1
1 764 . 12 1 1 A 70 70 ILE CB C 70 41.186 40.682 0.504 1
1 768 . 12 1 1 A 70 70 ILE N N 70 119.579 122.934 -3.355 1
1 769 . 12 1 1 A 71 71 ASN H H 71 9.839 10.461 -0.622 1
1 770 . 12 1 1 A 71 71 ASN HA H 71 4.485 4.403 0.082 1
1 775 . 12 1 1 A 71 71 ASN C C 71 174.975 174.579 0.396 1
1 776 . 12 1 1 A 71 71 ASN CA C 71 54.085 54.163 -0.078 1
1 777 . 12 1 1 A 71 71 ASN CB C 71 36.255 37.309 -1.054 1
1 778 . 12 1 1 A 71 71 ASN N N 71 126.963 125.755 1.208 1
1 780 . 12 1 1 A 72 72 GLY H H 72 8.911 8.498 0.413 1
1 781 . 12 1 1 A 72 72 GLY HA2 H 72 4.149 3.855 0.294 1
1 782 . 12 1 1 A 72 72 GLY HA3 H 72 3.507 3.855 -0.348 1
1 783 . 12 1 1 A 72 72 GLY C C 72 173.594 174.021 -0.427 1
1 784 . 12 1 1 A 72 72 GLY CA C 72 45.162 45.417 -0.255 1
1 785 . 12 1 1 A 72 72 GLY N N 72 103.020 104.817 -1.797 1
1 786 . 12 1 1 A 73 73 LYS H H 73 7.922 8.030 -0.108 1
1 787 . 12 1 1 A 73 73 LYS HA H 73 4.485 4.328 0.157 1
1 796 . 12 1 1 A 73 73 LYS C C 73 175.036 175.692 -0.656 1
1 797 . 12 1 1 A 73 73 LYS CA C 73 54.719 55.447 -0.728 1
1 798 . 12 1 1 A 73 73 LYS CB C 73 32.137 31.692 0.445 1
1 802 . 12 1 1 A 73 73 LYS N N 73 122.413 120.724 1.689 1
1 803 . 12 1 1 A 74 74 SER H H 74 8.585 8.853 -0.268 1
1 804 . 12 1 1 A 74 74 SER HA H 74 4.452 5.039 -0.587 1
1 807 . 12 1 1 A 74 74 SER C C 74 175.965 173.857 2.108 1
1 808 . 12 1 1 A 74 74 SER CA C 74 58.028 58.849 -0.821 1
1 809 . 12 1 1 A 74 74 SER CB C 74 63.799 63.756 0.043 1
1 810 . 12 1 1 A 74 74 SER N N 74 118.737 122.165 -3.428 1
1 811 . 12 1 1 A 75 75 LEU H H 75 8.015 8.395 -0.380 1
1 812 . 12 1 1 A 75 75 LEU HA H 75 4.661 4.307 0.354 1
1 822 . 12 1 1 A 75 75 LEU C C 75 178.117 177.317 0.800 1
1 823 . 12 1 1 A 75 75 LEU CA C 75 53.980 54.667 -0.687 1
1 824 . 12 1 1 A 75 75 LEU CB C 75 40.830 40.748 0.082 1
1 828 . 12 1 1 A 75 75 LEU N N 75 125.425 126.774 -1.349 1
1 829 . 12 1 1 A 76 76 LYS H H 76 8.099 8.280 -0.181 1
1 830 . 12 1 1 A 76 76 LYS HA H 76 4.210 4.409 -0.199 1
1 839 . 12 1 1 A 76 76 LYS C C 76 178.487 176.761 1.726 1
1 840 . 12 1 1 A 76 76 LYS CA C 76 58.010 55.481 2.529 1
1 841 . 12 1 1 A 76 76 LYS CB C 76 31.683 31.646 0.037 1
1 845 . 12 1 1 A 76 76 LYS N N 76 124.064 119.949 4.115 1
1 846 . 12 1 1 A 77 77 GLY H H 77 8.859 7.844 1.015 1
1 847 . 12 1 1 A 77 77 GLY HA2 H 77 4.110 4.059 0.051 1
1 848 . 12 1 1 A 77 77 GLY HA3 H 77 3.869 4.061 -0.192 1
1 849 . 12 1 1 A 77 77 GLY C C 77 174.335 174.982 -0.647 1
1 850 . 12 1 1 A 77 77 GLY CA C 77 46.232 44.991 1.241 1
1 851 . 12 1 1 A 77 77 GLY N N 77 115.659 108.721 6.938 1
1 852 . 12 1 1 A 78 78 THR H H 78 7.654 7.758 -0.104 1
1 853 . 12 1 1 A 78 78 THR HA H 78 4.624 4.174 0.450 1
1 858 . 12 1 1 A 78 78 THR C C 78 177.272 174.793 2.479 1
1 859 . 12 1 1 A 78 78 THR CA C 78 61.794 63.232 -1.438 1
1 860 . 12 1 1 A 78 78 THR CB C 78 70.595 69.204 1.391 1
1 862 . 12 1 1 A 78 78 THR N N 78 112.847 116.572 -3.725 1
1 863 . 12 1 1 A 79 79 THR H H 79 8.813 8.650 0.163 1
1 864 . 12 1 1 A 79 79 THR HA H 79 4.395 4.707 -0.312 1
1 869 . 12 1 1 A 79 79 THR C C 79 174.503 175.502 -0.999 1
1 870 . 12 1 1 A 79 79 THR CA C 79 61.724 60.841 0.883 1
1 871 . 12 1 1 A 79 79 THR CB C 79 71.007 71.230 -0.223 1
1 873 . 12 1 1 A 79 79 THR N N 79 114.123 117.761 -3.638 1
1 874 . 12 1 1 A 80 80 HIS H H 80 10.266 9.203 1.063 1
1 875 . 12 1 1 A 80 80 HIS HA H 80 4.331 4.189 0.142 1
1 880 . 12 1 1 A 80 80 HIS C C 80 177.075 176.880 0.195 1
1 881 . 12 1 1 A 80 80 HIS CA C 80 61.338 60.072 1.266 1
1 882 . 12 1 1 A 80 80 HIS CB C 80 28.651 30.672 -2.021 1
1 885 . 12 1 1 A 80 80 HIS N N 80 122.776 122.104 0.672 1
1 886 . 12 1 1 A 81 81 HIS H H 81 9.335 8.207 1.128 1
1 887 . 12 1 1 A 81 81 HIS HA H 81 4.078 4.049 0.029 1
1 892 . 12 1 1 A 81 81 HIS C C 81 178.269 176.689 1.580 1
1 893 . 12 1 1 A 81 81 HIS CA C 81 60.210 59.868 0.342 1
1 894 . 12 1 1 A 81 81 HIS CB C 81 29.569 29.898 -0.329 1
1 897 . 12 1 1 A 81 81 HIS N N 81 114.733 118.283 -3.550 1
1 898 . 12 1 1 A 82 82 ASP H H 82 7.741 8.152 -0.411 1
1 899 . 12 1 1 A 82 82 ASP HA H 82 4.452 4.215 0.237 1
1 902 . 12 1 1 A 82 82 ASP C C 82 178.683 178.831 -0.148 1
1 903 . 12 1 1 A 82 82 ASP CA C 82 57.148 57.322 -0.174 1
1 904 . 12 1 1 A 82 82 ASP CB C 82 39.522 40.499 -0.977 1
1 905 . 12 1 1 A 82 82 ASP N N 82 121.407 118.217 3.190 1
1 906 . 12 1 1 A 83 83 ALA H H 83 8.502 7.834 0.668 1
1 907 . 12 1 1 A 83 83 ALA HA H 83 3.939 4.170 -0.231 1
1 911 . 12 1 1 A 83 83 ALA C C 83 179.361 179.122 0.239 1
1 912 . 12 1 1 A 83 83 ALA CA C 83 55.635 54.801 0.834 1
1 913 . 12 1 1 A 83 83 ALA CB C 83 18.124 19.253 -1.129 1
1 914 . 12 1 1 A 83 83 ALA N N 83 125.049 122.743 2.306 1
1 915 . 12 1 1 A 84 84 LEU H H 84 8.100 8.549 -0.449 1
1 916 . 12 1 1 A 84 84 LEU HA H 84 3.792 3.784 0.008 1
1 926 . 12 1 1 A 84 84 LEU C C 84 180.173 179.171 1.002 1
1 927 . 12 1 1 A 84 84 LEU CA C 84 57.932 57.940 -0.008 1
1 928 . 12 1 1 A 84 84 LEU CB C 84 41.157 41.252 -0.095 1
1 932 . 12 1 1 A 84 84 LEU N N 84 117.139 117.824 -0.685 1
1 933 . 12 1 1 A 85 85 ALA H H 85 7.715 8.705 -0.990 1
1 934 . 12 1 1 A 85 85 ALA HA H 85 4.061 4.082 -0.021 1
1 938 . 12 1 1 A 85 85 ALA C C 85 180.380 179.616 0.764 1
1 939 . 12 1 1 A 85 85 ALA CA C 85 55.212 55.423 -0.211 1
1 940 . 12 1 1 A 85 85 ALA CB C 85 17.803 18.687 -0.884 1
1 941 . 12 1 1 A 85 85 ALA N N 85 122.448 121.679 0.769 1
1 942 . 12 1 1 A 86 86 ILE H H 86 7.669 7.777 -0.108 1
1 943 . 12 1 1 A 86 86 ILE HA H 86 3.678 3.709 -0.031 1
1 953 . 12 1 1 A 86 86 ILE C C 86 178.692 178.450 0.242 1
1 954 . 12 1 1 A 86 86 ILE CA C 86 65.226 64.925 0.301 1
1 955 . 12 1 1 A 86 86 ILE CB C 86 38.099 37.764 0.335 1
1 959 . 12 1 1 A 86 86 ILE N N 86 121.804 117.845 3.959 1
1 960 . 12 1 1 A 87 87 LEU H H 87 7.922 8.608 -0.686 1
1 961 . 12 1 1 A 87 87 LEU HA H 87 3.903 4.009 -0.106 1
1 971 . 12 1 1 A 87 87 LEU C C 87 178.610 178.785 -0.175 1
1 972 . 12 1 1 A 87 87 LEU CA C 87 58.221 58.145 0.076 1
1 973 . 12 1 1 A 87 87 LEU CB C 87 42.344 41.518 0.826 1
1 977 . 12 1 1 A 87 87 LEU N N 87 121.947 121.176 0.771 1
1 978 . 12 1 1 A 88 88 ARG H H 88 8.317 8.345 -0.028 1
1 979 . 12 1 1 A 88 88 ARG HA H 88 4.060 4.183 -0.123 1
1 986 . 12 1 1 A 88 88 ARG C C 88 180.698 177.307 3.391 1
1 987 . 12 1 1 A 88 88 ARG CA C 88 59.383 58.471 0.912 1
1 988 . 12 1 1 A 88 88 ARG CB C 88 30.055 30.139 -0.084 1
1 991 . 12 1 1 A 88 88 ARG N N 88 119.343 119.663 -0.320 1
1 992 . 12 1 1 A 89 89 GLN H H 89 8.270 7.779 0.491 1
1 993 . 12 1 1 A 89 89 GLN HA H 89 4.122 4.169 -0.047 1
1 1000 . 12 1 1 A 89 89 GLN C C 89 177.955 178.140 -0.185 1
1 1001 . 12 1 1 A 89 89 GLN CA C 89 58.714 58.158 0.556 1
1 1002 . 12 1 1 A 89 89 GLN CB C 89 28.160 28.714 -0.554 1
1 1004 . 12 1 1 A 89 89 GLN N N 89 121.097 117.588 3.509 1
1 1006 . 12 1 1 A 90 90 ALA H H 90 7.558 7.543 0.015 1
1 1007 . 12 1 1 A 90 90 ALA HA H 90 4.123 4.161 -0.038 1
1 1011 . 12 1 1 A 90 90 ALA C C 90 178.076 178.178 -0.102 1
1 1012 . 12 1 1 A 90 90 ALA CA C 90 52.942 53.756 -0.814 1
1 1013 . 12 1 1 A 90 90 ALA CB C 90 18.015 18.339 -0.324 1
1 1014 . 12 1 1 A 90 90 ALA N N 90 119.652 121.861 -2.209 1
1 1015 . 12 1 1 A 91 91 ARG H H 91 7.768 8.142 -0.374 1
1 1016 . 12 1 1 A 91 91 ARG HA H 91 4.065 4.263 -0.198 1
1 1022 . 12 1 1 A 91 91 ARG C C 91 177.858 177.858 0.000 1
1 1023 . 12 1 1 A 91 91 ARG CA C 91 58.573 57.472 1.101 1
1 1024 . 12 1 1 A 91 91 ARG CB C 91 30.384 30.857 -0.473 1
1 1027 . 12 1 1 A 91 91 ARG N N 91 118.081 117.647 0.434 1
1 1028 . 12 1 1 A 92 92 GLU H H 92 7.691 7.814 -0.123 1
1 1029 . 12 1 1 A 92 92 GLU HA H 92 4.123 4.162 -0.039 1
1 1034 . 12 1 1 A 92 92 GLU C C 92 174.459 176.668 -2.209 1
1 1035 . 12 1 1 A 92 92 GLU CA C 92 61.565 60.737 0.828 1
1 1036 . 12 1 1 A 92 92 GLU CB C 92 27.583 28.909 -1.326 1
1 1038 . 12 1 1 A 92 92 GLU N N 92 118.447 118.759 -0.312 1
1 1039 . 12 1 1 A 93 93 PRO HA H 93 4.716 4.544 0.172 1
1 1046 . 12 1 1 A 93 93 PRO C C 93 176.221 176.332 -0.111 1
1 1047 . 12 1 1 A 93 93 PRO CA C 93 63.149 62.488 0.661 1
1 1048 . 12 1 1 A 93 93 PRO CB C 93 32.571 33.132 -0.561 1
1 1051 . 12 1 1 A 94 94 ARG H H 94 8.434 8.999 -0.565 1
1 1052 . 12 1 1 A 94 94 ARG HA H 94 4.232 4.295 -0.063 1
1 1058 . 12 1 1 A 94 94 ARG C C 94 175.323 176.155 -0.832 1
1 1059 . 12 1 1 A 94 94 ARG CA C 94 56.972 56.972 0.000 1
1 1060 . 12 1 1 A 94 94 ARG CB C 94 30.448 31.207 -0.759 1
1 1063 . 12 1 1 A 94 94 ARG N N 94 115.987 119.056 -3.069 1
1 1064 . 12 1 1 A 95 95 GLN H H 95 7.246 7.634 -0.388 1
1 1065 . 12 1 1 A 95 95 GLN HA H 95 5.251 5.318 -0.067 1
1 1072 . 12 1 1 A 95 95 GLN C C 95 174.786 173.663 1.123 1
1 1073 . 12 1 1 A 95 95 GLN CA C 95 54.209 54.408 -0.199 1
1 1074 . 12 1 1 A 95 95 GLN CB C 95 32.384 32.272 0.112 1
1 1076 . 12 1 1 A 95 95 GLN N N 95 115.998 119.373 -3.375 1
1 1078 . 12 1 1 A 96 96 ALA H H 96 8.739 8.332 0.407 1
1 1079 . 12 1 1 A 96 96 ALA HA H 96 5.412 5.283 0.129 1
1 1083 . 12 1 1 A 96 96 ALA C C 96 175.258 175.776 -0.518 1
1 1084 . 12 1 1 A 96 96 ALA CA C 96 50.355 50.343 0.012 1
1 1085 . 12 1 1 A 96 96 ALA CB C 96 24.270 23.139 1.131 1
1 1086 . 12 1 1 A 96 96 ALA N N 96 126.197 125.915 0.282 1
1 1087 . 12 1 1 A 97 97 VAL H H 97 8.568 8.680 -0.112 1
1 1088 . 12 1 1 A 97 97 VAL HA H 97 4.804 4.711 0.093 1
1 1096 . 12 1 1 A 97 97 VAL C C 97 175.982 174.716 1.266 1
1 1097 . 12 1 1 A 97 97 VAL CA C 97 61.442 61.313 0.129 1
1 1098 . 12 1 1 A 97 97 VAL CB C 97 33.413 33.850 -0.437 1
1 1101 . 12 1 1 A 97 97 VAL N N 97 120.702 119.935 0.767 1
1 1102 . 12 1 1 A 98 98 ILE H H 98 9.753 8.969 0.784 1
1 1103 . 12 1 1 A 98 98 ILE HA H 98 4.826 5.118 -0.292 1
1 1113 . 12 1 1 A 98 98 ILE C C 98 174.292 174.717 -0.425 1
1 1114 . 12 1 1 A 98 98 ILE CA C 98 59.981 59.526 0.455 1
1 1115 . 12 1 1 A 98 98 ILE CB C 98 40.608 41.224 -0.616 1
1 1119 . 12 1 1 A 98 98 ILE N N 98 131.738 127.077 4.661 1
1 1120 . 12 1 1 A 99 99 VAL H H 99 8.493 8.599 -0.106 1
1 1121 . 12 1 1 A 99 99 VAL HA H 99 5.201 4.762 0.439 1
1 1129 . 12 1 1 A 99 99 VAL C C 99 176.557 175.378 1.179 1
1 1130 . 12 1 1 A 99 99 VAL CA C 99 61.495 60.850 0.645 1
1 1131 . 12 1 1 A 99 99 VAL CB C 99 32.327 32.983 -0.656 1
1 1134 . 12 1 1 A 99 99 VAL N N 99 129.537 128.591 0.946 1
1 1135 . 12 1 1 A 100 100 THR H H 100 9.050 9.007 0.043 1
1 1136 . 12 1 1 A 100 100 THR HA H 100 5.606 5.469 0.137 1
1 1141 . 12 1 1 A 100 100 THR C C 100 172.815 172.797 0.018 1
1 1142 . 12 1 1 A 100 100 THR CA C 100 59.049 59.600 -0.551 1
1 1143 . 12 1 1 A 100 100 THR CB C 100 73.966 72.029 1.937 1
1 1145 . 12 1 1 A 100 100 THR N N 100 117.469 117.516 -0.047 1
1 1146 . 12 1 1 A 101 101 ARG H H 101 8.773 8.774 -0.001 1
1 1147 . 12 1 1 A 101 101 ARG HA H 101 4.989 4.592 0.397 1
1 1155 . 12 1 1 A 101 101 ARG C C 101 174.738 177.301 -2.563 1
1 1156 . 12 1 1 A 101 101 ARG CA C 101 54.825 54.503 0.322 1
1 1157 . 12 1 1 A 101 101 ARG CB C 101 34.636 32.538 2.098 1
1 1160 . 12 1 1 A 101 101 ARG N N 101 117.532 121.675 -4.143 1
1 1162 . 12 1 1 A 102 102 LYS H H 102 8.616 8.532 0.084 1
1 1163 . 12 1 1 A 102 102 LYS HA H 102 4.232 4.101 0.131 1
1 1171 . 12 1 1 A 102 102 LYS C C 102 175.935 176.108 -0.173 1
1 1172 . 12 1 1 A 102 102 LYS CA C 102 56.549 58.405 -1.856 1
1 1173 . 12 1 1 A 102 102 LYS CB C 102 33.266 32.118 1.148 1
1 1177 . 12 1 1 A 102 102 LYS N N 102 126.899 121.425 5.474 1
1 1178 . 12 1 1 A 103 103 LEU H H 103 8.424 7.903 0.521 1
1 1179 . 12 1 1 A 103 103 LEU HA H 103 4.540 4.073 0.467 1
1 1189 . 12 1 1 A 103 103 LEU C C 103 176.956 176.211 0.745 1
1 1190 . 12 1 1 A 103 103 LEU CA C 103 54.755 56.906 -2.151 1
1 1191 . 12 1 1 A 103 103 LEU CB C 103 42.929 40.747 2.182 1
1 1195 . 12 1 1 A 103 103 LEU N N 103 126.246 116.922 9.324 1
1 1196 . 12 1 1 A 104 104 THR H H 104 8.201 8.213 -0.012 1
1 1197 . 12 1 1 A 104 104 THR HA H 104 4.624 4.706 -0.082 1
1 1202 . 12 1 1 A 104 104 THR C C 104 172.954 173.677 -0.723 1
1 1203 . 12 1 1 A 104 104 THR CA C 104 59.483 60.087 -0.604 1
1 1204 . 12 1 1 A 104 104 THR CB C 104 69.761 69.219 0.542 1
1 1206 . 12 1 1 A 104 104 THR N N 104 117.263 116.220 1.043 1
1 1207 . 12 1 1 A 105 105 PRO HA H 105 4.399 4.693 -0.294 1
1 1213 . 12 1 1 A 105 105 PRO CA C 105 63.495 62.497 0.998 1
1 1214 . 12 1 1 A 105 105 PRO CB C 105 32.096 33.190 -1.094 1
1 1217 . 12 1 1 A 106 106 GLU H H 106 8.519 8.635 -0.116 1
1 1218 . 12 1 1 A 106 106 GLU HA H 106 4.197 4.644 -0.447 1
1 1221 . 12 1 1 A 106 106 GLU C C 106 176.110 175.608 0.502 1
1 1222 . 12 1 1 A 106 106 GLU CA C 106 56.743 55.689 1.054 1
1 1223 . 12 1 1 A 106 106 GLU CB C 106 30.137 29.665 0.472 1
1 1225 . 12 1 1 A 106 106 GLU N N 106 120.609 115.532 5.077 1
1 1226 . 12 1 1 A 107 107 ALA H H 107 8.241 7.799 0.442 1
1 1227 . 12 1 1 A 107 107 ALA HA H 107 4.317 4.647 -0.330 1
1 1231 . 12 1 1 A 107 107 ALA C C 107 177.299 176.397 0.902 1
1 1232 . 12 1 1 A 107 107 ALA CA C 107 52.203 52.071 0.132 1
1 1233 . 12 1 1 A 107 107 ALA CB C 107 19.392 20.169 -0.777 1
1 1234 . 12 1 1 A 107 107 ALA N N 107 124.849 121.472 3.377 1
1 1235 . 12 1 1 A 108 108 MET H H 108 8.284 8.801 -0.517 1
1 1236 . 12 1 1 A 108 108 MET HA H 108 4.792 4.556 0.236 1
1 1244 . 12 1 1 A 108 108 MET C C 108 174.337 175.644 -1.307 1
1 1245 . 12 1 1 A 108 108 MET CA C 108 53.258 54.373 -1.115 1
1 1246 . 12 1 1 A 108 108 MET CB C 108 32.608 32.058 0.550 1
1 1249 . 12 1 1 A 108 108 MET N N 108 121.025 123.104 -2.079 1
1 1250 . 12 1 1 A 109 109 PRO HA H 109 4.408 4.717 -0.309 1
1 1256 . 12 1 1 A 109 109 PRO C C 109 176.412 175.607 0.805 1
1 1257 . 12 1 1 A 109 109 PRO CA C 109 63.290 62.442 0.848 1
1 1258 . 12 1 1 A 109 109 PRO CB C 109 32.077 31.671 0.406 1
1 1261 . 12 1 1 A 110 110 ASP H H 110 8.417 8.637 -0.220 1
1 1262 . 12 1 1 A 110 110 ASP HA H 110 4.573 4.901 -0.328 1
1 1265 . 12 1 1 A 110 110 ASP C C 110 176.508 175.249 1.259 1
1 1266 . 12 1 1 A 110 110 ASP CA C 110 54.085 52.703 1.382 1
1 1267 . 12 1 1 A 110 110 ASP CB C 110 41.075 41.158 -0.083 1
1 1268 . 12 1 1 A 110 110 ASP N N 110 120.239 122.745 -2.506 1
1 1269 . 12 1 1 A 111 111 LEU H H 111 8.279 8.793 -0.514 1
1 1270 . 12 1 1 A 111 111 LEU HA H 111 4.319 4.397 -0.078 1
1 1280 . 12 1 1 A 111 111 LEU C C 111 177.551 175.021 2.530 1
1 1281 . 12 1 1 A 111 111 LEU CA C 111 55.581 54.517 1.064 1
1 1282 . 12 1 1 A 111 111 LEU CB C 111 42.360 39.980 2.380 1
1 1286 . 12 1 1 A 111 111 LEU N N 111 123.318 127.345 -4.027 1
1 1287 . 12 1 1 A 112 112 ASN H H 112 8.487 7.867 0.620 1
1 1288 . 12 1 1 A 112 112 ASN HA H 112 4.725 5.025 -0.300 1
1 1293 . 12 1 1 A 112 112 ASN C C 112 175.454 173.290 2.164 1
1 1294 . 12 1 1 A 112 112 ASN CA C 112 53.610 53.678 -0.068 1
1 1295 . 12 1 1 A 112 112 ASN CB C 112 39.116 39.820 -0.704 1
1 1296 . 12 1 1 A 112 112 ASN N N 112 118.752 120.899 -2.147 1
1 1298 . 12 1 1 A 115 115 GLY H H 115 8.205 8.401 -0.196 1
1 1299 . 12 1 1 A 115 115 GLY HA2 H 115 4.126 4.237 -0.111 1
1 1300 . 12 1 1 A 115 115 GLY HA3 H 115 4.126 4.238 -0.112 1
1 1301 . 12 1 1 A 115 115 GLY CA C 115 44.727 45.591 -0.864 1
1 1302 . 12 1 1 A 116 116 PRO HA H 116 4.485 4.324 0.161 1
1 1309 . 12 1 1 A 116 116 PRO CA C 116 63.298 64.756 -1.458 1
1 1310 . 12 1 1 A 116 116 PRO CB C 116 32.077 31.900 0.177 1
1 1313 . 12 1 1 A 117 117 SER H H 117 8.532 8.029 0.503 1
1 1 . 13 1 1 A 7 7 GLY HA2 H 7 3.960 4.406 -0.446 1
1 2 . 13 1 1 A 7 7 GLY HA3 H 7 3.960 4.406 -0.446 1
1 3 . 13 1 1 A 7 7 GLY C C 7 174.009 172.704 1.305 1
1 4 . 13 1 1 A 7 7 GLY CA C 7 45.374 45.176 0.198 1
1 5 . 13 1 1 A 8 8 ALA H H 8 8.163 8.397 -0.234 1
1 6 . 13 1 1 A 8 8 ALA HA H 8 4.381 5.191 -0.810 1
1 10 . 13 1 1 A 8 8 ALA C C 8 178.078 175.698 2.380 1
1 11 . 13 1 1 A 8 8 ALA CA C 8 52.677 51.580 1.097 1
1 12 . 13 1 1 A 8 8 ALA CB C 8 19.368 21.628 -2.260 1
1 13 . 13 1 1 A 8 8 ALA N N 8 123.721 121.916 1.805 1
1 14 . 13 1 1 A 9 9 THR H H 9 8.142 8.685 -0.543 1
1 15 . 13 1 1 A 9 9 THR HA H 9 4.353 4.820 -0.467 1
1 20 . 13 1 1 A 9 9 THR C C 9 174.597 172.906 1.691 1
1 21 . 13 1 1 A 9 9 THR CA C 9 62.093 61.797 0.296 1
1 22 . 13 1 1 A 9 9 THR CB C 9 69.948 71.238 -1.290 1
1 24 . 13 1 1 A 9 9 THR N N 9 113.761 115.900 -2.139 1
1 25 . 13 1 1 A 10 10 LEU H H 10 8.218 8.987 -0.769 1
1 26 . 13 1 1 A 10 10 LEU HA H 10 4.169 5.024 -0.855 1
1 36 . 13 1 1 A 10 10 LEU C C 10 176.110 175.804 0.306 1
1 37 . 13 1 1 A 10 10 LEU CA C 10 61.099 53.328 7.771 1
1 38 . 13 1 1 A 10 10 LEU CB C 10 38.686 45.664 -6.978 1
1 42 . 13 1 1 A 10 10 LEU N N 10 123.516 129.437 -5.921 1
1 43 . 13 1 1 A 11 11 LYS H H 11 8.496 8.537 -0.041 1
1 44 . 13 1 1 A 11 11 LYS HA H 11 4.891 5.069 -0.178 1
1 49 . 13 1 1 A 11 11 LYS C C 11 175.794 174.353 1.441 1
1 50 . 13 1 1 A 11 11 LYS CA C 11 55.652 55.003 0.649 1
1 51 . 13 1 1 A 11 11 LYS CB C 11 29.444 35.947 -6.503 1
1 52 . 13 1 1 A 11 11 LYS N N 11 125.141 119.643 5.498 1
1 53 . 13 1 1 A 12 12 GLN HA H 12 4.315 5.060 -0.745 1
1 54 . 13 1 1 A 12 12 GLN C C 12 176.300 174.038 2.262 1
1 55 . 13 1 1 A 12 12 GLN CA C 12 56.286 54.288 1.998 1
1 56 . 13 1 1 A 12 12 GLN CB C 12 32.901 31.628 1.273 1
1 57 . 13 1 1 A 13 13 LEU H H 13 8.410 8.708 -0.298 1
1 58 . 13 1 1 A 13 13 LEU HA H 13 4.348 5.061 -0.713 1
1 67 . 13 1 1 A 13 13 LEU C C 13 177.120 175.313 1.807 1
1 68 . 13 1 1 A 13 13 LEU CA C 13 55.142 54.610 0.532 1
1 69 . 13 1 1 A 13 13 LEU CB C 13 42.352 42.318 0.034 1
1 73 . 13 1 1 A 13 13 LEU N N 13 124.340 128.674 -4.334 1
1 74 . 13 1 1 A 14 14 ASP H H 14 8.250 8.759 -0.509 1
1 75 . 13 1 1 A 14 14 ASP HA H 14 4.540 5.153 -0.613 1
1 78 . 13 1 1 A 14 14 ASP C C 14 176.769 174.972 1.797 1
1 79 . 13 1 1 A 14 14 ASP CA C 14 54.772 53.253 1.519 1
1 80 . 13 1 1 A 14 14 ASP CB C 14 41.322 43.968 -2.646 1
1 81 . 13 1 1 A 14 14 ASP N N 14 120.493 123.719 -3.226 1
1 82 . 13 1 1 A 15 15 GLY H H 15 8.428 8.951 -0.523 1
1 83 . 13 1 1 A 15 15 GLY HA2 H 15 4.089 3.972 0.117 1
1 84 . 13 1 1 A 15 15 GLY HA3 H 15 3.874 3.972 -0.098 1
1 85 . 13 1 1 A 15 15 GLY C C 15 174.122 173.397 0.725 1
1 86 . 13 1 1 A 15 15 GLY CA C 15 45.972 46.634 -0.662 1
1 87 . 13 1 1 A 15 15 GLY N N 15 108.670 108.098 0.572 1
1 88 . 13 1 1 A 16 16 ILE H H 16 7.727 7.413 0.314 1
1 89 . 13 1 1 A 16 16 ILE HA H 16 4.705 4.766 -0.061 1
1 99 . 13 1 1 A 16 16 ILE C C 16 175.807 174.121 1.686 1
1 100 . 13 1 1 A 16 16 ILE CA C 16 60.703 59.908 0.795 1
1 101 . 13 1 1 A 16 16 ILE CB C 16 38.509 39.691 -1.182 1
1 105 . 13 1 1 A 16 16 ILE N N 16 120.267 120.958 -0.691 1
1 106 . 13 1 1 A 17 17 HIS H H 17 9.101 8.754 0.347 1
1 107 . 13 1 1 A 17 17 HIS HA H 17 4.782 5.451 -0.669 1
1 112 . 13 1 1 A 17 17 HIS C C 17 173.051 173.566 -0.515 1
1 113 . 13 1 1 A 17 17 HIS CA C 17 55.353 53.560 1.793 1
1 114 . 13 1 1 A 17 17 HIS CB C 17 32.468 32.649 -0.181 1
1 117 . 13 1 1 A 17 17 HIS N N 17 125.061 127.918 -2.857 1
1 118 . 13 1 1 A 18 18 VAL H H 18 8.427 8.730 -0.303 1
1 119 . 13 1 1 A 18 18 VAL HA H 18 4.375 4.193 0.182 1
1 127 . 13 1 1 A 18 18 VAL C C 18 174.702 175.149 -0.447 1
1 128 . 13 1 1 A 18 18 VAL CA C 18 62.035 61.648 0.387 1
1 129 . 13 1 1 A 18 18 VAL CB C 18 32.325 32.321 0.004 1
1 132 . 13 1 1 A 18 18 VAL N N 18 127.069 127.423 -0.354 1
1 133 . 13 1 1 A 19 19 THR H H 19 9.272 8.608 0.664 1
1 134 . 13 1 1 A 19 19 THR HA H 19 4.512 4.734 -0.222 1
1 139 . 13 1 1 A 19 19 THR C C 19 172.784 173.285 -0.501 1
1 140 . 13 1 1 A 19 19 THR CA C 19 62.512 61.795 0.717 1
1 141 . 13 1 1 A 19 19 THR CB C 19 70.663 69.934 0.729 1
1 143 . 13 1 1 A 19 19 THR N N 19 126.619 123.383 3.236 1
1 144 . 13 1 1 A 20 20 ILE H H 20 8.737 9.188 -0.451 1
1 145 . 13 1 1 A 20 20 ILE HA H 20 4.870 4.629 0.241 1
1 155 . 13 1 1 A 20 20 ILE C C 20 175.315 174.755 0.560 1
1 156 . 13 1 1 A 20 20 ILE CA C 20 60.157 60.089 0.068 1
1 157 . 13 1 1 A 20 20 ILE CB C 20 38.603 38.544 0.059 1
1 161 . 13 1 1 A 20 20 ILE N N 20 128.114 128.628 -0.514 1
1 162 . 13 1 1 A 21 21 LEU H H 21 8.902 9.003 -0.101 1
1 163 . 13 1 1 A 21 21 LEU HA H 21 4.804 4.927 -0.123 1
1 173 . 13 1 1 A 21 21 LEU C C 21 175.565 175.201 0.364 1
1 174 . 13 1 1 A 21 21 LEU CA C 21 52.731 53.358 -0.627 1
1 175 . 13 1 1 A 21 21 LEU CB C 21 43.947 42.824 1.123 1
1 179 . 13 1 1 A 21 21 LEU N N 21 125.457 127.833 -2.376 1
1 180 . 13 1 1 A 22 22 HIS H H 22 8.577 9.005 -0.428 1
1 181 . 13 1 1 A 22 22 HIS HA H 22 5.013 5.053 -0.040 1
1 186 . 13 1 1 A 22 22 HIS C C 22 174.258 175.141 -0.883 1
1 187 . 13 1 1 A 22 22 HIS CA C 22 55.880 54.884 0.996 1
1 188 . 13 1 1 A 22 22 HIS CB C 22 30.901 30.361 0.540 1
1 191 . 13 1 1 A 22 22 HIS N N 22 122.595 123.855 -1.260 1
1 192 . 13 1 1 A 23 23 LYS H H 23 8.712 10.078 -1.366 1
1 193 . 13 1 1 A 23 23 LYS HA H 23 4.880 5.032 -0.152 1
1 202 . 13 1 1 A 23 23 LYS C C 23 174.265 175.321 -1.056 1
1 203 . 13 1 1 A 23 23 LYS CA C 23 54.314 54.055 0.259 1
1 204 . 13 1 1 A 23 23 LYS CB C 23 36.068 36.262 -0.194 1
1 208 . 13 1 1 A 23 23 LYS N N 23 120.814 121.144 -0.330 1
1 209 . 13 1 1 A 24 24 GLU H H 24 8.360 8.507 -0.147 1
1 210 . 13 1 1 A 24 24 GLU HA H 24 4.350 4.663 -0.313 1
1 215 . 13 1 1 A 24 24 GLU C C 24 177.843 176.859 0.984 1
1 216 . 13 1 1 A 24 24 GLU CA C 24 55.601 54.708 0.893 1
1 217 . 13 1 1 A 24 24 GLU CB C 24 30.512 31.515 -1.003 1
1 219 . 13 1 1 A 24 24 GLU N N 24 117.859 119.535 -1.676 1
1 220 . 13 1 1 A 25 25 GLU H H 25 9.146 8.798 0.348 1
1 221 . 13 1 1 A 25 25 GLU HA H 25 3.924 3.982 -0.058 1
1 226 . 13 1 1 A 25 25 GLU C C 25 177.809 177.716 0.093 1
1 227 . 13 1 1 A 25 25 GLU CA C 25 58.568 58.726 -0.158 1
1 228 . 13 1 1 A 25 25 GLU CB C 25 29.313 29.297 0.016 1
1 230 . 13 1 1 A 25 25 GLU N N 25 124.543 121.868 2.675 1
1 231 . 13 1 1 A 26 26 GLY H H 26 8.242 8.800 -0.558 1
1 232 . 13 1 1 A 26 26 GLY HA2 H 26 4.287 3.956 0.331 1
1 233 . 13 1 1 A 26 26 GLY HA3 H 26 3.407 3.956 -0.549 1
1 234 . 13 1 1 A 26 26 GLY C C 26 174.234 175.186 -0.952 1
1 235 . 13 1 1 A 26 26 GLY CA C 26 46.113 46.708 -0.595 1
1 236 . 13 1 1 A 26 26 GLY N N 26 115.394 113.905 1.489 1
1 237 . 13 1 1 A 27 27 ALA H H 27 7.432 8.258 -0.826 1
1 238 . 13 1 1 A 27 27 ALA HA H 27 4.402 4.302 0.100 1
1 242 . 13 1 1 A 27 27 ALA C C 27 178.138 178.257 -0.119 1
1 243 . 13 1 1 A 27 27 ALA CA C 27 52.273 52.885 -0.612 1
1 244 . 13 1 1 A 27 27 ALA CB C 27 20.214 19.689 0.525 1
1 245 . 13 1 1 A 27 27 ALA N N 27 122.323 122.467 -0.144 1
1 246 . 13 1 1 A 28 28 GLY H H 28 8.624 7.820 0.804 1
1 247 . 13 1 1 A 28 28 GLY HA2 H 28 4.134 4.095 0.039 1
1 248 . 13 1 1 A 28 28 GLY HA3 H 28 3.953 4.133 -0.180 1
1 249 . 13 1 1 A 28 28 GLY C C 28 174.069 174.823 -0.754 1
1 250 . 13 1 1 A 28 28 GLY CA C 28 44.546 44.493 0.053 1
1 251 . 13 1 1 A 28 28 GLY N N 28 107.593 105.430 2.163 1
1 252 . 13 1 1 A 29 29 LEU H H 29 7.934 8.579 -0.645 1
1 253 . 13 1 1 A 29 29 LEU HA H 29 4.059 4.374 -0.315 1
1 263 . 13 1 1 A 29 29 LEU C C 29 177.548 176.891 0.657 1
1 264 . 13 1 1 A 29 29 LEU CA C 29 56.298 56.294 0.004 1
1 265 . 13 1 1 A 29 29 LEU CB C 29 41.940 42.847 -0.907 1
1 269 . 13 1 1 A 29 29 LEU N N 29 115.495 121.259 -5.764 1
1 270 . 13 1 1 A 30 30 GLY H H 30 8.669 7.950 0.719 1
1 271 . 13 1 1 A 30 30 GLY HA2 H 30 4.264 4.126 0.138 1
1 272 . 13 1 1 A 30 30 GLY HA3 H 30 4.001 4.287 -0.286 1
1 273 . 13 1 1 A 30 30 GLY C C 30 175.296 173.160 2.136 1
1 274 . 13 1 1 A 30 30 GLY CA C 30 46.368 45.086 1.282 1
1 275 . 13 1 1 A 30 30 GLY N N 30 103.121 106.079 -2.958 1
1 276 . 13 1 1 A 31 31 PHE H H 31 7.044 7.405 -0.361 1
1 277 . 13 1 1 A 31 31 PHE HA H 31 4.541 4.292 0.249 1
1 285 . 13 1 1 A 31 31 PHE C C 31 171.141 172.585 -1.444 1
1 286 . 13 1 1 A 31 31 PHE CA C 31 55.704 55.119 0.585 1
1 287 . 13 1 1 A 31 31 PHE CB C 31 40.745 41.916 -1.171 1
1 293 . 13 1 1 A 31 31 PHE N N 31 115.404 114.962 0.442 1
1 294 . 13 1 1 A 32 32 SER H H 32 8.752 8.858 -0.106 1
1 295 . 13 1 1 A 32 32 SER HA H 32 4.990 4.801 0.189 1
1 298 . 13 1 1 A 32 32 SER C C 32 175.049 173.722 1.327 1
1 299 . 13 1 1 A 32 32 SER CA C 32 55.001 55.691 -0.690 1
1 300 . 13 1 1 A 32 32 SER CB C 32 67.170 65.956 1.214 1
1 301 . 13 1 1 A 32 32 SER N N 32 113.639 113.481 0.158 1
1 302 . 13 1 1 A 33 33 LEU H H 33 8.639 8.381 0.258 1
1 303 . 13 1 1 A 33 33 LEU HA H 33 5.573 5.370 0.203 1
1 313 . 13 1 1 A 33 33 LEU C C 33 175.827 175.810 0.017 1
1 314 . 13 1 1 A 33 33 LEU CA C 33 53.620 53.464 0.156 1
1 315 . 13 1 1 A 33 33 LEU CB C 33 45.399 45.157 0.242 1
1 319 . 13 1 1 A 33 33 LEU N N 33 118.936 120.323 -1.387 1
1 320 . 13 1 1 A 34 34 ALA H H 34 9.410 8.872 0.538 1
1 321 . 13 1 1 A 34 34 ALA HA H 34 4.749 5.062 -0.313 1
1 325 . 13 1 1 A 34 34 ALA C C 34 176.231 177.222 -0.991 1
1 326 . 13 1 1 A 34 34 ALA CA C 34 50.425 51.203 -0.778 1
1 327 . 13 1 1 A 34 34 ALA CB C 34 22.518 22.840 -0.322 1
1 328 . 13 1 1 A 34 34 ALA N N 34 124.395 121.460 2.935 1
1 329 . 13 1 1 A 35 35 GLY H H 35 8.130 8.626 -0.496 1
1 330 . 13 1 1 A 35 35 GLY HA2 H 35 4.712 4.068 0.644 1
1 331 . 13 1 1 A 35 35 GLY HA3 H 35 3.955 4.112 -0.157 1
1 332 . 13 1 1 A 35 35 GLY C C 35 174.750 173.002 1.748 1
1 333 . 13 1 1 A 35 35 GLY CA C 35 44.494 44.975 -0.481 1
1 334 . 13 1 1 A 35 35 GLY N N 35 103.650 107.872 -4.222 1
1 335 . 13 1 1 A 36 36 GLY H H 36 8.217 7.850 0.367 1
1 336 . 13 1 1 A 36 36 GLY HA2 H 36 4.494 4.353 0.141 1
1 337 . 13 1 1 A 36 36 GLY HA3 H 36 3.836 4.389 -0.553 1
1 338 . 13 1 1 A 36 36 GLY C C 36 174.410 174.137 0.273 1
1 339 . 13 1 1 A 36 36 GLY CA C 36 45.462 45.819 -0.357 1
1 340 . 13 1 1 A 36 36 GLY N N 36 122.114 108.771 13.343 1
1 341 . 13 1 1 A 37 37 ALA H H 37 8.963 8.587 0.376 1
1 342 . 13 1 1 A 37 37 ALA HA H 37 3.998 4.115 -0.117 1
1 346 . 13 1 1 A 37 37 ALA C C 37 176.935 179.193 -2.258 1
1 347 . 13 1 1 A 37 37 ALA CA C 37 55.308 54.591 0.717 1
1 348 . 13 1 1 A 37 37 ALA CB C 37 18.822 18.375 0.447 1
1 349 . 13 1 1 A 37 37 ALA N N 37 123.418 121.801 1.617 1
1 350 . 13 1 1 A 38 38 ASP H H 38 10.586 8.238 2.348 1
1 351 . 13 1 1 A 38 38 ASP HA H 38 4.485 4.341 0.144 1
1 354 . 13 1 1 A 38 38 ASP C C 38 175.309 176.502 -1.193 1
1 355 . 13 1 1 A 38 38 ASP CA C 38 52.730 56.354 -3.624 1
1 356 . 13 1 1 A 38 38 ASP CB C 38 38.689 40.998 -2.309 1
1 357 . 13 1 1 A 38 38 ASP N N 38 111.480 118.057 -6.577 1
1 358 . 13 1 1 A 39 39 LEU H H 39 7.789 7.688 0.101 1
1 359 . 13 1 1 A 39 39 LEU HA H 39 4.699 4.352 0.347 1
1 369 . 13 1 1 A 39 39 LEU C C 39 176.377 177.744 -1.367 1
1 370 . 13 1 1 A 39 39 LEU CA C 39 52.952 54.295 -1.343 1
1 371 . 13 1 1 A 39 39 LEU CB C 39 43.294 42.153 1.141 1
1 375 . 13 1 1 A 39 39 LEU N N 39 122.545 121.070 1.475 1
1 376 . 13 1 1 A 40 40 GLU H H 40 8.331 8.555 -0.224 1
1 377 . 13 1 1 A 40 40 GLU HA H 40 3.978 4.140 -0.162 1
1 382 . 13 1 1 A 40 40 GLU C C 40 176.887 177.232 -0.345 1
1 383 . 13 1 1 A 40 40 GLU CA C 40 59.066 59.160 -0.094 1
1 384 . 13 1 1 A 40 40 GLU CB C 40 29.523 29.957 -0.434 1
1 386 . 13 1 1 A 40 40 GLU N N 40 118.036 119.997 -1.961 1
1 387 . 13 1 1 A 41 41 ASN H H 41 7.890 7.692 0.198 1
1 388 . 13 1 1 A 41 41 ASN HA H 41 4.820 4.980 -0.160 1
1 393 . 13 1 1 A 41 41 ASN CA C 41 52.316 51.657 0.659 1
1 394 . 13 1 1 A 41 41 ASN CB C 41 37.409 36.529 0.880 1
1 395 . 13 1 1 A 41 41 ASN N N 41 115.196 118.449 -3.253 1
1 397 . 13 1 1 A 42 42 LYS H H 42 7.943 7.884 0.059 1
1 398 . 13 1 1 A 42 42 LYS HA H 42 4.328 4.411 -0.083 1
1 407 . 13 1 1 A 42 42 LYS C C 42 177.081 177.311 -0.230 1
1 408 . 13 1 1 A 42 42 LYS CA C 42 56.567 59.797 -3.230 1
1 409 . 13 1 1 A 42 42 LYS CB C 42 33.120 32.380 0.740 1
1 413 . 13 1 1 A 42 42 LYS N N 42 120.612 125.555 -4.943 1
1 414 . 13 1 1 A 43 43 VAL H H 43 7.456 7.601 -0.145 1
1 415 . 13 1 1 A 43 43 VAL HA H 43 4.059 4.277 -0.218 1
1 423 . 13 1 1 A 43 43 VAL CA C 43 61.330 61.697 -0.367 1
1 424 . 13 1 1 A 43 43 VAL CB C 43 32.819 32.420 0.399 1
1 427 . 13 1 1 A 43 43 VAL N N 43 118.284 118.855 -0.571 1
1 428 . 13 1 1 A 44 44 ILE H H 44 8.481 8.600 -0.119 1
1 429 . 13 1 1 A 44 44 ILE HA H 44 4.913 4.616 0.297 1
1 439 . 13 1 1 A 44 44 ILE C C 44 176.719 175.736 0.983 1
1 440 . 13 1 1 A 44 44 ILE CA C 44 59.946 62.084 -2.138 1
1 441 . 13 1 1 A 44 44 ILE CB C 44 35.784 38.399 -2.615 1
1 445 . 13 1 1 A 44 44 ILE N N 44 127.089 129.322 -2.233 1
1 446 . 13 1 1 A 45 45 THR H H 45 8.906 9.309 -0.403 1
1 447 . 13 1 1 A 45 45 THR HA H 45 5.400 5.129 0.271 1
1 452 . 13 1 1 A 45 45 THR CA C 45 58.528 59.528 -1.000 1
1 453 . 13 1 1 A 45 45 THR CB C 45 73.760 72.324 1.436 1
1 455 . 13 1 1 A 45 45 THR N N 45 116.832 116.497 0.335 1
1 456 . 13 1 1 A 46 46 VAL H H 46 8.336 8.939 -0.603 1
1 457 . 13 1 1 A 46 46 VAL HA H 46 4.059 4.297 -0.238 1
1 465 . 13 1 1 A 46 46 VAL C C 46 176.648 176.378 0.270 1
1 466 . 13 1 1 A 46 46 VAL CA C 46 63.058 62.649 0.409 1
1 467 . 13 1 1 A 46 46 VAL CB C 46 31.601 30.885 0.716 1
1 470 . 13 1 1 A 46 46 VAL N N 46 118.542 122.357 -3.815 1
1 471 . 13 1 1 A 47 47 HIS H H 47 9.382 8.432 0.950 1
1 472 . 13 1 1 A 47 47 HIS HA H 47 4.628 4.188 0.440 1
1 477 . 13 1 1 A 47 47 HIS C C 47 174.339 174.051 0.288 1
1 478 . 13 1 1 A 47 47 HIS CA C 47 57.764 59.917 -2.153 1
1 479 . 13 1 1 A 47 47 HIS CB C 47 31.453 30.557 0.896 1
1 482 . 13 1 1 A 47 47 HIS N N 47 133.900 128.242 5.658 1
1 483 . 13 1 1 A 48 48 ARG H H 48 7.135 7.317 -0.182 1
1 484 . 13 1 1 A 48 48 ARG HA H 48 4.360 4.813 -0.453 1
1 491 . 13 1 1 A 48 48 ARG C C 48 173.877 174.793 -0.916 1
1 492 . 13 1 1 A 48 48 ARG CA C 48 54.385 54.752 -0.367 1
1 493 . 13 1 1 A 48 48 ARG CB C 48 33.996 35.225 -1.229 1
1 496 . 13 1 1 A 48 48 ARG N N 48 114.736 117.420 -2.684 1
1 497 . 13 1 1 A 49 49 VAL H H 49 8.690 8.626 0.064 1
1 498 . 13 1 1 A 49 49 VAL HA H 49 4.015 4.450 -0.435 1
1 506 . 13 1 1 A 49 49 VAL C C 49 176.255 175.560 0.695 1
1 507 . 13 1 1 A 49 49 VAL CA C 49 61.882 61.663 0.219 1
1 508 . 13 1 1 A 49 49 VAL CB C 49 32.261 33.227 -0.966 1
1 511 . 13 1 1 A 49 49 VAL N N 49 122.844 122.402 0.442 1
1 512 . 13 1 1 A 50 50 PHE H H 50 7.866 8.379 -0.513 1
1 513 . 13 1 1 A 50 50 PHE HA H 50 4.866 4.512 0.354 1
1 521 . 13 1 1 A 50 50 PHE C C 50 174.847 176.168 -1.321 1
1 522 . 13 1 1 A 50 50 PHE CA C 50 54.596 57.530 -2.934 1
1 523 . 13 1 1 A 50 50 PHE CB C 50 36.558 39.123 -2.565 1
1 529 . 13 1 1 A 50 50 PHE N N 50 128.498 127.437 1.061 1
1 530 . 13 1 1 A 51 51 PRO HA H 51 4.386 4.555 -0.169 1
1 537 . 13 1 1 A 51 51 PRO C C 51 177.321 176.557 0.764 1
1 538 . 13 1 1 A 51 51 PRO CA C 51 64.381 64.509 -0.128 1
1 539 . 13 1 1 A 51 51 PRO CB C 51 31.773 32.227 -0.454 1
1 542 . 13 1 1 A 52 52 ASN H H 52 8.814 8.392 0.422 1
1 543 . 13 1 1 A 52 52 ASN HA H 52 4.496 5.093 -0.597 1
1 548 . 13 1 1 A 52 52 ASN C C 52 174.823 174.511 0.312 1
1 549 . 13 1 1 A 52 52 ASN CA C 52 54.719 52.119 2.600 1
1 550 . 13 1 1 A 52 52 ASN CB C 52 38.109 39.349 -1.240 1
1 551 . 13 1 1 A 52 52 ASN N N 52 116.145 113.243 2.902 1
1 553 . 13 1 1 A 53 53 GLY H H 53 7.730 8.245 -0.515 1
1 554 . 13 1 1 A 53 53 GLY HA2 H 53 4.430 4.383 0.047 1
1 555 . 13 1 1 A 53 53 GLY HA3 H 53 4.089 4.404 -0.315 1
1 556 . 13 1 1 A 53 53 GLY C C 53 174.810 173.959 0.851 1
1 557 . 13 1 1 A 53 53 GLY CA C 53 44.987 45.907 -0.920 1
1 558 . 13 1 1 A 53 53 GLY N N 53 106.196 110.286 -4.090 1
1 559 . 13 1 1 A 54 54 LEU H H 54 8.764 9.101 -0.337 1
1 560 . 13 1 1 A 54 54 LEU HA H 54 4.041 4.261 -0.220 1
1 570 . 13 1 1 A 54 54 LEU C C 54 179.712 178.848 0.864 1
1 571 . 13 1 1 A 54 54 LEU CA C 54 58.310 57.395 0.915 1
1 572 . 13 1 1 A 54 54 LEU CB C 54 42.390 42.066 0.324 1
1 576 . 13 1 1 A 54 54 LEU N N 54 118.836 119.810 -0.974 1
1 577 . 13 1 1 A 55 55 ALA H H 55 7.593 7.788 -0.195 1
1 578 . 13 1 1 A 55 55 ALA HA H 55 4.275 4.022 0.253 1
1 582 . 13 1 1 A 55 55 ALA C C 55 181.307 178.724 2.583 1
1 583 . 13 1 1 A 55 55 ALA CA C 55 54.825 54.272 0.553 1
1 584 . 13 1 1 A 55 55 ALA CB C 55 18.345 18.354 -0.009 1
1 585 . 13 1 1 A 55 55 ALA N N 55 118.782 122.230 -3.448 1
1 586 . 13 1 1 A 56 56 SER H H 56 9.339 7.854 1.485 1
1 587 . 13 1 1 A 56 56 SER HA H 56 4.023 4.378 -0.355 1
1 589 . 13 1 1 A 56 56 SER C C 56 176.392 176.743 -0.351 1
1 590 . 13 1 1 A 56 56 SER CA C 56 60.984 60.488 0.496 1
1 591 . 13 1 1 A 56 56 SER CB C 56 62.987 63.644 -0.657 1
1 592 . 13 1 1 A 56 56 SER N N 56 117.631 112.634 4.997 1
1 593 . 13 1 1 A 57 57 GLN H H 57 7.942 8.543 -0.601 1
1 594 . 13 1 1 A 57 57 GLN HA H 57 4.034 4.216 -0.182 1
1 601 . 13 1 1 A 57 57 GLN C C 57 177.400 178.398 -0.998 1
1 602 . 13 1 1 A 57 57 GLN CA C 57 58.362 58.369 -0.007 1
1 603 . 13 1 1 A 57 57 GLN CB C 57 28.801 29.378 -0.577 1
1 605 . 13 1 1 A 57 57 GLN N N 57 118.162 119.780 -1.618 1
1 607 . 13 1 1 A 58 58 GLU H H 58 7.683 9.121 -1.438 1
1 608 . 13 1 1 A 58 58 GLU HA H 58 4.163 4.110 0.053 1
1 613 . 13 1 1 A 58 58 GLU C C 58 179.248 176.662 2.586 1
1 614 . 13 1 1 A 58 58 GLU CA C 58 59.559 58.695 0.864 1
1 615 . 13 1 1 A 58 58 GLU CB C 58 29.317 29.884 -0.567 1
1 617 . 13 1 1 A 58 58 GLU N N 58 119.877 120.417 -0.540 1
1 618 . 13 1 1 A 59 59 GLY H H 59 7.446 7.793 -0.347 1
1 619 . 13 1 1 A 59 59 GLY HA2 H 59 4.100 3.970 0.130 1
1 620 . 13 1 1 A 59 59 GLY HA3 H 59 3.770 3.981 -0.211 1
1 621 . 13 1 1 A 59 59 GLY C C 59 175.432 175.134 0.298 1
1 622 . 13 1 1 A 59 59 GLY CA C 59 46.817 45.272 1.545 1
1 623 . 13 1 1 A 59 59 GLY N N 59 102.653 107.867 -5.214 1
1 624 . 13 1 1 A 60 60 THR H H 60 8.343 7.942 0.401 1
1 625 . 13 1 1 A 60 60 THR HA H 60 4.037 4.295 -0.258 1
1 630 . 13 1 1 A 60 60 THR C C 60 175.843 174.232 1.611 1
1 631 . 13 1 1 A 60 60 THR CA C 60 64.792 64.805 -0.013 1
1 632 . 13 1 1 A 60 60 THR CB C 60 69.325 69.578 -0.253 1
1 634 . 13 1 1 A 60 60 THR N N 60 113.863 112.593 1.270 1
1 635 . 13 1 1 A 61 61 ILE H H 61 8.802 7.576 1.226 1
1 636 . 13 1 1 A 61 61 ILE HA H 61 3.631 4.098 -0.467 1
1 646 . 13 1 1 A 61 61 ILE C C 61 174.198 174.429 -0.231 1
1 647 . 13 1 1 A 61 61 ILE CA C 61 62.938 60.729 2.209 1
1 648 . 13 1 1 A 61 61 ILE CB C 61 37.225 36.399 0.826 1
1 652 . 13 1 1 A 61 61 ILE N N 61 126.153 120.178 5.975 1
1 653 . 13 1 1 A 62 62 GLN H H 62 7.124 9.642 -2.518 1
1 654 . 13 1 1 A 62 62 GLN HA H 62 4.500 4.709 -0.209 1
1 661 . 13 1 1 A 62 62 GLN C C 62 174.556 175.190 -0.634 1
1 662 . 13 1 1 A 62 62 GLN CA C 62 53.364 54.166 -0.802 1
1 663 . 13 1 1 A 62 62 GLN CB C 62 32.196 31.738 0.458 1
1 665 . 13 1 1 A 62 62 GLN N N 62 123.730 126.667 -2.937 1
1 667 . 13 1 1 A 63 63 LYS H H 63 8.399 8.629 -0.230 1
1 668 . 13 1 1 A 63 63 LYS HA H 63 3.464 4.347 -0.883 1
1 677 . 13 1 1 A 63 63 LYS CA C 63 57.905 58.341 -0.436 1
1 678 . 13 1 1 A 63 63 LYS CB C 63 32.260 32.121 0.139 1
1 682 . 13 1 1 A 63 63 LYS N N 63 121.381 124.619 -3.238 1
1 683 . 13 1 1 A 64 64 GLY H H 64 9.265 8.600 0.665 1
1 684 . 13 1 1 A 64 64 GLY HA2 H 64 4.415 4.048 0.367 1
1 685 . 13 1 1 A 64 64 GLY HA3 H 64 3.639 4.054 -0.415 1
1 686 . 13 1 1 A 64 64 GLY CA C 64 44.881 45.029 -0.148 1
1 687 . 13 1 1 A 64 64 GLY N N 64 113.750 115.036 -1.286 1
1 688 . 13 1 1 A 65 65 ASN H H 65 7.594 8.285 -0.691 1
1 689 . 13 1 1 A 65 65 ASN HA H 65 4.798 4.877 -0.079 1
1 694 . 13 1 1 A 65 65 ASN C C 65 175.042 174.048 0.994 1
1 695 . 13 1 1 A 65 65 ASN CA C 65 53.047 53.205 -0.158 1
1 696 . 13 1 1 A 65 65 ASN CB C 65 38.153 40.144 -1.991 1
1 697 . 13 1 1 A 65 65 ASN N N 65 117.999 119.745 -1.746 1
1 699 . 13 1 1 A 66 66 GLU H H 66 8.538 8.559 -0.021 1
1 700 . 13 1 1 A 66 66 GLU HA H 66 4.634 4.917 -0.283 1
1 705 . 13 1 1 A 66 66 GLU C C 66 176.620 174.832 1.788 1
1 706 . 13 1 1 A 66 66 GLU CA C 66 55.863 54.773 1.090 1
1 707 . 13 1 1 A 66 66 GLU CB C 66 30.899 32.058 -1.159 1
1 709 . 13 1 1 A 66 66 GLU N N 66 122.233 121.657 0.576 1
1 710 . 13 1 1 A 67 67 VAL H H 67 8.452 8.915 -0.463 1
1 711 . 13 1 1 A 67 67 VAL HA H 67 4.172 4.087 0.085 1
1 719 . 13 1 1 A 67 67 VAL C C 67 174.641 175.473 -0.832 1
1 720 . 13 1 1 A 67 67 VAL CA C 67 61.856 62.990 -1.134 1
1 721 . 13 1 1 A 67 67 VAL CB C 67 31.066 31.498 -0.432 1
1 724 . 13 1 1 A 67 67 VAL N N 67 126.311 127.863 -1.552 1
1 725 . 13 1 1 A 68 68 LEU H H 68 9.000 8.968 0.032 1
1 726 . 13 1 1 A 68 68 LEU HA H 68 4.390 4.325 0.065 1
1 736 . 13 1 1 A 68 68 LEU C C 68 178.924 177.101 1.823 1
1 737 . 13 1 1 A 68 68 LEU CA C 68 56.990 56.104 0.886 1
1 738 . 13 1 1 A 68 68 LEU CB C 68 42.392 42.527 -0.135 1
1 742 . 13 1 1 A 68 68 LEU N N 68 127.175 129.093 -1.918 1
1 743 . 13 1 1 A 69 69 SER H H 69 7.666 7.804 -0.138 1
1 744 . 13 1 1 A 69 69 SER HA H 69 5.144 4.986 0.158 1
1 747 . 13 1 1 A 69 69 SER C C 69 172.722 172.547 0.175 1
1 748 . 13 1 1 A 69 69 SER CA C 69 57.606 57.288 0.318 1
1 749 . 13 1 1 A 69 69 SER CB C 69 64.511 66.563 -2.052 1
1 750 . 13 1 1 A 69 69 SER N N 69 110.346 109.388 0.958 1
1 751 . 13 1 1 A 70 70 ILE H H 70 7.965 8.658 -0.693 1
1 752 . 13 1 1 A 70 70 ILE HA H 70 4.548 4.702 -0.154 1
1 762 . 13 1 1 A 70 70 ILE C C 70 174.993 175.276 -0.283 1
1 763 . 13 1 1 A 70 70 ILE CA C 70 60.897 60.278 0.619 1
1 764 . 13 1 1 A 70 70 ILE CB C 70 41.186 40.820 0.366 1
1 768 . 13 1 1 A 70 70 ILE N N 70 119.579 121.242 -1.663 1
1 769 . 13 1 1 A 71 71 ASN H H 71 9.839 10.516 -0.677 1
1 770 . 13 1 1 A 71 71 ASN HA H 71 4.485 4.415 0.070 1
1 775 . 13 1 1 A 71 71 ASN C C 71 174.975 174.809 0.166 1
1 776 . 13 1 1 A 71 71 ASN CA C 71 54.085 54.250 -0.165 1
1 777 . 13 1 1 A 71 71 ASN CB C 71 36.255 37.330 -1.075 1
1 778 . 13 1 1 A 71 71 ASN N N 71 126.963 127.047 -0.084 1
1 780 . 13 1 1 A 72 72 GLY H H 72 8.911 8.455 0.456 1
1 781 . 13 1 1 A 72 72 GLY HA2 H 72 4.149 3.963 0.186 1
1 782 . 13 1 1 A 72 72 GLY HA3 H 72 3.507 3.963 -0.456 1
1 783 . 13 1 1 A 72 72 GLY C C 72 173.594 173.611 -0.017 1
1 784 . 13 1 1 A 72 72 GLY CA C 72 45.162 45.206 -0.044 1
1 785 . 13 1 1 A 72 72 GLY N N 72 103.020 104.566 -1.546 1
1 786 . 13 1 1 A 73 73 LYS H H 73 7.922 7.630 0.292 1
1 787 . 13 1 1 A 73 73 LYS HA H 73 4.485 4.628 -0.143 1
1 796 . 13 1 1 A 73 73 LYS C C 73 175.036 175.744 -0.708 1
1 797 . 13 1 1 A 73 73 LYS CA C 73 54.719 55.004 -0.285 1
1 798 . 13 1 1 A 73 73 LYS CB C 73 32.137 33.883 -1.746 1
1 802 . 13 1 1 A 73 73 LYS N N 73 122.413 122.556 -0.143 1
1 803 . 13 1 1 A 74 74 SER H H 74 8.585 8.757 -0.172 1
1 804 . 13 1 1 A 74 74 SER HA H 74 4.452 4.641 -0.189 1
1 807 . 13 1 1 A 74 74 SER C C 74 175.965 174.283 1.682 1
1 808 . 13 1 1 A 74 74 SER CA C 74 58.028 58.586 -0.558 1
1 809 . 13 1 1 A 74 74 SER CB C 74 63.799 64.032 -0.233 1
1 810 . 13 1 1 A 74 74 SER N N 74 118.737 122.418 -3.681 1
1 811 . 13 1 1 A 75 75 LEU H H 75 8.015 8.260 -0.245 1
1 812 . 13 1 1 A 75 75 LEU HA H 75 4.661 4.467 0.194 1
1 822 . 13 1 1 A 75 75 LEU C C 75 178.117 177.579 0.538 1
1 823 . 13 1 1 A 75 75 LEU CA C 75 53.980 54.558 -0.578 1
1 824 . 13 1 1 A 75 75 LEU CB C 75 40.830 41.092 -0.262 1
1 828 . 13 1 1 A 75 75 LEU N N 75 125.425 125.897 -0.472 1
1 829 . 13 1 1 A 76 76 LYS H H 76 8.099 8.611 -0.512 1
1 830 . 13 1 1 A 76 76 LYS HA H 76 4.210 4.418 -0.208 1
1 839 . 13 1 1 A 76 76 LYS C C 76 178.487 176.755 1.732 1
1 840 . 13 1 1 A 76 76 LYS CA C 76 58.010 55.449 2.561 1
1 841 . 13 1 1 A 76 76 LYS CB C 76 31.683 31.652 0.031 1
1 845 . 13 1 1 A 76 76 LYS N N 76 124.064 120.166 3.898 1
1 846 . 13 1 1 A 77 77 GLY H H 77 8.859 7.834 1.025 1
1 847 . 13 1 1 A 77 77 GLY HA2 H 77 4.110 4.052 0.058 1
1 848 . 13 1 1 A 77 77 GLY HA3 H 77 3.869 4.055 -0.186 1
1 849 . 13 1 1 A 77 77 GLY C C 77 174.335 174.754 -0.419 1
1 850 . 13 1 1 A 77 77 GLY CA C 77 46.232 44.996 1.236 1
1 851 . 13 1 1 A 77 77 GLY N N 77 115.659 108.713 6.946 1
1 852 . 13 1 1 A 78 78 THR H H 78 7.654 7.745 -0.091 1
1 853 . 13 1 1 A 78 78 THR HA H 78 4.624 4.127 0.497 1
1 858 . 13 1 1 A 78 78 THR C C 78 177.272 174.725 2.547 1
1 859 . 13 1 1 A 78 78 THR CA C 78 61.794 63.339 -1.545 1
1 860 . 13 1 1 A 78 78 THR CB C 78 70.595 69.120 1.475 1
1 862 . 13 1 1 A 78 78 THR N N 78 112.847 116.570 -3.723 1
1 863 . 13 1 1 A 79 79 THR H H 79 8.813 8.555 0.258 1
1 864 . 13 1 1 A 79 79 THR HA H 79 4.395 4.634 -0.239 1
1 869 . 13 1 1 A 79 79 THR C C 79 174.503 175.521 -1.018 1
1 870 . 13 1 1 A 79 79 THR CA C 79 61.724 60.998 0.726 1
1 871 . 13 1 1 A 79 79 THR CB C 79 71.007 70.930 0.077 1
1 873 . 13 1 1 A 79 79 THR N N 79 114.123 118.481 -4.358 1
1 874 . 13 1 1 A 80 80 HIS H H 80 10.266 9.205 1.061 1
1 875 . 13 1 1 A 80 80 HIS HA H 80 4.331 4.208 0.123 1
1 880 . 13 1 1 A 80 80 HIS C C 80 177.075 177.048 0.027 1
1 881 . 13 1 1 A 80 80 HIS CA C 80 61.338 59.937 1.401 1
1 882 . 13 1 1 A 80 80 HIS CB C 80 28.651 30.303 -1.652 1
1 885 . 13 1 1 A 80 80 HIS N N 80 122.776 122.223 0.553 1
1 886 . 13 1 1 A 81 81 HIS H H 81 9.335 8.018 1.317 1
1 887 . 13 1 1 A 81 81 HIS HA H 81 4.078 4.074 0.004 1
1 892 . 13 1 1 A 81 81 HIS C C 81 178.269 176.646 1.623 1
1 893 . 13 1 1 A 81 81 HIS CA C 81 60.210 59.127 1.083 1
1 894 . 13 1 1 A 81 81 HIS CB C 81 29.569 30.283 -0.714 1
1 897 . 13 1 1 A 81 81 HIS N N 81 114.733 118.738 -4.005 1
1 898 . 13 1 1 A 82 82 ASP H H 82 7.741 8.100 -0.359 1
1 899 . 13 1 1 A 82 82 ASP HA H 82 4.452 3.898 0.554 1
1 902 . 13 1 1 A 82 82 ASP C C 82 178.683 179.073 -0.390 1
1 903 . 13 1 1 A 82 82 ASP CA C 82 57.148 57.138 0.010 1
1 904 . 13 1 1 A 82 82 ASP CB C 82 39.522 40.352 -0.830 1
1 905 . 13 1 1 A 82 82 ASP N N 82 121.407 118.054 3.353 1
1 906 . 13 1 1 A 83 83 ALA H H 83 8.502 8.320 0.182 1
1 907 . 13 1 1 A 83 83 ALA HA H 83 3.939 4.061 -0.122 1
1 911 . 13 1 1 A 83 83 ALA C C 83 179.361 179.399 -0.038 1
1 912 . 13 1 1 A 83 83 ALA CA C 83 55.635 54.982 0.653 1
1 913 . 13 1 1 A 83 83 ALA CB C 83 18.124 18.839 -0.715 1
1 914 . 13 1 1 A 83 83 ALA N N 83 125.049 122.704 2.345 1
1 915 . 13 1 1 A 84 84 LEU H H 84 8.100 8.040 0.060 1
1 916 . 13 1 1 A 84 84 LEU HA H 84 3.792 3.854 -0.062 1
1 926 . 13 1 1 A 84 84 LEU C C 84 180.173 178.996 1.177 1
1 927 . 13 1 1 A 84 84 LEU CA C 84 57.932 58.019 -0.087 1
1 928 . 13 1 1 A 84 84 LEU CB C 84 41.157 41.635 -0.478 1
1 932 . 13 1 1 A 84 84 LEU N N 84 117.139 118.298 -1.159 1
1 933 . 13 1 1 A 85 85 ALA H H 85 7.715 8.663 -0.948 1
1 934 . 13 1 1 A 85 85 ALA HA H 85 4.061 4.144 -0.083 1
1 938 . 13 1 1 A 85 85 ALA C C 85 180.380 179.916 0.464 1
1 939 . 13 1 1 A 85 85 ALA CA C 85 55.212 55.346 -0.134 1
1 940 . 13 1 1 A 85 85 ALA CB C 85 17.803 18.288 -0.485 1
1 941 . 13 1 1 A 85 85 ALA N N 85 122.448 121.107 1.341 1
1 942 . 13 1 1 A 86 86 ILE H H 86 7.669 7.895 -0.226 1
1 943 . 13 1 1 A 86 86 ILE HA H 86 3.678 3.708 -0.030 1
1 953 . 13 1 1 A 86 86 ILE C C 86 178.692 178.606 0.086 1
1 954 . 13 1 1 A 86 86 ILE CA C 86 65.226 64.861 0.365 1
1 955 . 13 1 1 A 86 86 ILE CB C 86 38.099 37.701 0.398 1
1 959 . 13 1 1 A 86 86 ILE N N 86 121.804 117.861 3.943 1
1 960 . 13 1 1 A 87 87 LEU H H 87 7.922 8.566 -0.644 1
1 961 . 13 1 1 A 87 87 LEU HA H 87 3.903 4.006 -0.103 1
1 971 . 13 1 1 A 87 87 LEU C C 87 178.610 178.733 -0.123 1
1 972 . 13 1 1 A 87 87 LEU CA C 87 58.221 58.162 0.059 1
1 973 . 13 1 1 A 87 87 LEU CB C 87 42.344 41.307 1.037 1
1 977 . 13 1 1 A 87 87 LEU N N 87 121.947 121.240 0.707 1
1 978 . 13 1 1 A 88 88 ARG H H 88 8.317 8.237 0.080 1
1 979 . 13 1 1 A 88 88 ARG HA H 88 4.060 4.194 -0.134 1
1 986 . 13 1 1 A 88 88 ARG C C 88 180.698 177.308 3.390 1
1 987 . 13 1 1 A 88 88 ARG CA C 88 59.383 58.650 0.733 1
1 988 . 13 1 1 A 88 88 ARG CB C 88 30.055 29.948 0.107 1
1 991 . 13 1 1 A 88 88 ARG N N 88 119.343 119.670 -0.327 1
1 992 . 13 1 1 A 89 89 GLN H H 89 8.270 7.722 0.548 1
1 993 . 13 1 1 A 89 89 GLN HA H 89 4.122 4.265 -0.143 1
1 1000 . 13 1 1 A 89 89 GLN C C 89 177.955 178.381 -0.426 1
1 1001 . 13 1 1 A 89 89 GLN CA C 89 58.714 57.721 0.993 1
1 1002 . 13 1 1 A 89 89 GLN CB C 89 28.160 29.377 -1.217 1
1 1004 . 13 1 1 A 89 89 GLN N N 89 121.097 117.452 3.645 1
1 1006 . 13 1 1 A 90 90 ALA H H 90 7.558 7.677 -0.119 1
1 1007 . 13 1 1 A 90 90 ALA HA H 90 4.123 4.164 -0.041 1
1 1011 . 13 1 1 A 90 90 ALA C C 90 178.076 177.968 0.108 1
1 1012 . 13 1 1 A 90 90 ALA CA C 90 52.942 53.981 -1.039 1
1 1013 . 13 1 1 A 90 90 ALA CB C 90 18.015 18.247 -0.232 1
1 1014 . 13 1 1 A 90 90 ALA N N 90 119.652 121.894 -2.242 1
1 1015 . 13 1 1 A 91 91 ARG H H 91 7.768 7.635 0.133 1
1 1016 . 13 1 1 A 91 91 ARG HA H 91 4.065 4.348 -0.283 1
1 1022 . 13 1 1 A 91 91 ARG C C 91 177.858 177.869 -0.011 1
1 1023 . 13 1 1 A 91 91 ARG CA C 91 58.573 56.501 2.072 1
1 1024 . 13 1 1 A 91 91 ARG CB C 91 30.384 30.571 -0.187 1
1 1027 . 13 1 1 A 91 91 ARG N N 91 118.081 116.673 1.408 1
1 1028 . 13 1 1 A 92 92 GLU H H 92 7.691 8.084 -0.393 1
1 1029 . 13 1 1 A 92 92 GLU HA H 92 4.123 4.133 -0.010 1
1 1034 . 13 1 1 A 92 92 GLU C C 92 174.459 176.711 -2.252 1
1 1035 . 13 1 1 A 92 92 GLU CA C 92 61.565 60.910 0.655 1
1 1036 . 13 1 1 A 92 92 GLU CB C 92 27.583 28.747 -1.164 1
1 1038 . 13 1 1 A 92 92 GLU N N 92 118.447 118.495 -0.048 1
1 1039 . 13 1 1 A 93 93 PRO HA H 93 4.716 4.592 0.124 1
1 1046 . 13 1 1 A 93 93 PRO C C 93 176.221 176.156 0.065 1
1 1047 . 13 1 1 A 93 93 PRO CA C 93 63.149 62.330 0.819 1
1 1048 . 13 1 1 A 93 93 PRO CB C 93 32.571 33.178 -0.607 1
1 1051 . 13 1 1 A 94 94 ARG H H 94 8.434 8.918 -0.484 1
1 1052 . 13 1 1 A 94 94 ARG HA H 94 4.232 4.497 -0.265 1
1 1058 . 13 1 1 A 94 94 ARG C C 94 175.323 176.014 -0.691 1
1 1059 . 13 1 1 A 94 94 ARG CA C 94 56.972 56.408 0.564 1
1 1060 . 13 1 1 A 94 94 ARG CB C 94 30.448 31.963 -1.515 1
1 1063 . 13 1 1 A 94 94 ARG N N 94 115.987 118.649 -2.662 1
1 1064 . 13 1 1 A 95 95 GLN H H 95 7.246 7.620 -0.374 1
1 1065 . 13 1 1 A 95 95 GLN HA H 95 5.251 5.269 -0.018 1
1 1072 . 13 1 1 A 95 95 GLN C C 95 174.786 174.011 0.775 1
1 1073 . 13 1 1 A 95 95 GLN CA C 95 54.209 54.004 0.205 1
1 1074 . 13 1 1 A 95 95 GLN CB C 95 32.384 32.453 -0.069 1
1 1076 . 13 1 1 A 95 95 GLN N N 95 115.998 120.308 -4.310 1
1 1078 . 13 1 1 A 96 96 ALA H H 96 8.739 8.743 -0.004 1
1 1079 . 13 1 1 A 96 96 ALA HA H 96 5.412 5.207 0.205 1
1 1083 . 13 1 1 A 96 96 ALA C C 96 175.258 175.659 -0.401 1
1 1084 . 13 1 1 A 96 96 ALA CA C 96 50.355 50.630 -0.275 1
1 1085 . 13 1 1 A 96 96 ALA CB C 96 24.270 22.334 1.936 1
1 1086 . 13 1 1 A 96 96 ALA N N 96 126.197 126.166 0.031 1
1 1087 . 13 1 1 A 97 97 VAL H H 97 8.568 8.700 -0.132 1
1 1088 . 13 1 1 A 97 97 VAL HA H 97 4.804 4.731 0.073 1
1 1096 . 13 1 1 A 97 97 VAL C C 97 175.982 174.836 1.146 1
1 1097 . 13 1 1 A 97 97 VAL CA C 97 61.442 61.300 0.142 1
1 1098 . 13 1 1 A 97 97 VAL CB C 97 33.413 33.423 -0.010 1
1 1101 . 13 1 1 A 97 97 VAL N N 97 120.702 122.618 -1.916 1
1 1102 . 13 1 1 A 98 98 ILE H H 98 9.753 8.534 1.219 1
1 1103 . 13 1 1 A 98 98 ILE HA H 98 4.826 5.013 -0.187 1
1 1113 . 13 1 1 A 98 98 ILE C C 98 174.292 174.530 -0.238 1
1 1114 . 13 1 1 A 98 98 ILE CA C 98 59.981 59.686 0.295 1
1 1115 . 13 1 1 A 98 98 ILE CB C 98 40.608 40.793 -0.185 1
1 1119 . 13 1 1 A 98 98 ILE N N 98 131.738 127.174 4.564 1
1 1120 . 13 1 1 A 99 99 VAL H H 99 8.493 8.436 0.057 1
1 1121 . 13 1 1 A 99 99 VAL HA H 99 5.201 4.837 0.364 1
1 1129 . 13 1 1 A 99 99 VAL C C 99 176.557 175.449 1.108 1
1 1130 . 13 1 1 A 99 99 VAL CA C 99 61.495 60.705 0.790 1
1 1131 . 13 1 1 A 99 99 VAL CB C 99 32.327 32.962 -0.635 1
1 1134 . 13 1 1 A 99 99 VAL N N 99 129.537 128.595 0.942 1
1 1135 . 13 1 1 A 100 100 THR H H 100 9.050 8.473 0.577 1
1 1136 . 13 1 1 A 100 100 THR HA H 100 5.606 5.295 0.311 1
1 1141 . 13 1 1 A 100 100 THR C C 100 172.815 172.866 -0.051 1
1 1142 . 13 1 1 A 100 100 THR CA C 100 59.049 59.527 -0.478 1
1 1143 . 13 1 1 A 100 100 THR CB C 100 73.966 72.648 1.318 1
1 1145 . 13 1 1 A 100 100 THR N N 100 117.469 117.419 0.050 1
1 1146 . 13 1 1 A 101 101 ARG H H 101 8.773 8.703 0.070 1
1 1147 . 13 1 1 A 101 101 ARG HA H 101 4.989 5.067 -0.078 1
1 1155 . 13 1 1 A 101 101 ARG C C 101 174.738 174.958 -0.220 1
1 1156 . 13 1 1 A 101 101 ARG CA C 101 54.825 54.454 0.371 1
1 1157 . 13 1 1 A 101 101 ARG CB C 101 34.636 34.014 0.622 1
1 1160 . 13 1 1 A 101 101 ARG N N 101 117.532 120.033 -2.501 1
1 1162 . 13 1 1 A 102 102 LYS H H 102 8.616 8.388 0.228 1
1 1163 . 13 1 1 A 102 102 LYS HA H 102 4.232 4.319 -0.087 1
1 1171 . 13 1 1 A 102 102 LYS C C 102 175.935 176.396 -0.461 1
1 1172 . 13 1 1 A 102 102 LYS CA C 102 56.549 56.854 -0.305 1
1 1173 . 13 1 1 A 102 102 LYS CB C 102 33.266 32.724 0.542 1
1 1177 . 13 1 1 A 102 102 LYS N N 102 126.899 122.055 4.844 1
1 1178 . 13 1 1 A 103 103 LEU H H 103 8.424 8.633 -0.209 1
1 1179 . 13 1 1 A 103 103 LEU HA H 103 4.540 4.801 -0.261 1
1 1189 . 13 1 1 A 103 103 LEU C C 103 176.956 176.215 0.741 1
1 1190 . 13 1 1 A 103 103 LEU CA C 103 54.755 53.447 1.308 1
1 1191 . 13 1 1 A 103 103 LEU CB C 103 42.929 43.144 -0.215 1
1 1195 . 13 1 1 A 103 103 LEU N N 103 126.246 126.409 -0.163 1
1 1196 . 13 1 1 A 104 104 THR H H 104 8.201 8.528 -0.327 1
1 1197 . 13 1 1 A 104 104 THR HA H 104 4.624 4.407 0.217 1
1 1202 . 13 1 1 A 104 104 THR C C 104 172.954 173.910 -0.956 1
1 1203 . 13 1 1 A 104 104 THR CA C 104 59.483 60.839 -1.356 1
1 1204 . 13 1 1 A 104 104 THR CB C 104 69.761 69.028 0.733 1
1 1206 . 13 1 1 A 104 104 THR N N 104 117.263 115.110 2.153 1
1 1207 . 13 1 1 A 105 105 PRO HA H 105 4.399 4.677 -0.278 1
1 1213 . 13 1 1 A 105 105 PRO CA C 105 63.495 62.579 0.916 1
1 1214 . 13 1 1 A 105 105 PRO CB C 105 32.096 32.903 -0.807 1
1 1217 . 13 1 1 A 106 106 GLU H H 106 8.519 8.574 -0.055 1
1 1218 . 13 1 1 A 106 106 GLU HA H 106 4.197 4.801 -0.604 1
1 1221 . 13 1 1 A 106 106 GLU C C 106 176.110 176.156 -0.046 1
1 1222 . 13 1 1 A 106 106 GLU CA C 106 56.743 54.577 2.166 1
1 1223 . 13 1 1 A 106 106 GLU CB C 106 30.137 33.182 -3.045 1
1 1225 . 13 1 1 A 106 106 GLU N N 106 120.609 120.404 0.205 1
1 1226 . 13 1 1 A 107 107 ALA H H 107 8.241 8.442 -0.201 1
1 1227 . 13 1 1 A 107 107 ALA HA H 107 4.317 4.313 0.004 1
1 1231 . 13 1 1 A 107 107 ALA C C 107 177.299 177.076 0.223 1
1 1232 . 13 1 1 A 107 107 ALA CA C 107 52.203 53.043 -0.840 1
1 1233 . 13 1 1 A 107 107 ALA CB C 107 19.392 18.882 0.510 1
1 1234 . 13 1 1 A 107 107 ALA N N 107 124.849 126.004 -1.155 1
1 1235 . 13 1 1 A 108 108 MET H H 108 8.284 8.599 -0.315 1
1 1236 . 13 1 1 A 108 108 MET HA H 108 4.792 4.867 -0.075 1
1 1244 . 13 1 1 A 108 108 MET C C 108 174.337 174.189 0.148 1
1 1245 . 13 1 1 A 108 108 MET CA C 108 53.258 52.885 0.373 1
1 1246 . 13 1 1 A 108 108 MET CB C 108 32.608 36.261 -3.653 1
1 1249 . 13 1 1 A 108 108 MET N N 108 121.025 121.549 -0.524 1
1 1250 . 13 1 1 A 109 109 PRO HA H 109 4.408 4.630 -0.222 1
1 1256 . 13 1 1 A 109 109 PRO C C 109 176.412 175.142 1.270 1
1 1257 . 13 1 1 A 109 109 PRO CA C 109 63.290 62.276 1.014 1
1 1258 . 13 1 1 A 109 109 PRO CB C 109 32.077 33.059 -0.982 1
1 1261 . 13 1 1 A 110 110 ASP H H 110 8.417 8.612 -0.195 1
1 1262 . 13 1 1 A 110 110 ASP HA H 110 4.573 5.063 -0.490 1
1 1265 . 13 1 1 A 110 110 ASP C C 110 176.508 175.591 0.917 1
1 1266 . 13 1 1 A 110 110 ASP CA C 110 54.085 52.818 1.267 1
1 1267 . 13 1 1 A 110 110 ASP CB C 110 41.075 41.784 -0.709 1
1 1268 . 13 1 1 A 110 110 ASP N N 110 120.239 121.303 -1.064 1
1 1269 . 13 1 1 A 111 111 LEU H H 111 8.279 8.709 -0.430 1
1 1270 . 13 1 1 A 111 111 LEU HA H 111 4.319 4.377 -0.058 1
1 1280 . 13 1 1 A 111 111 LEU C C 111 177.551 176.859 0.692 1
1 1281 . 13 1 1 A 111 111 LEU CA C 111 55.581 54.570 1.011 1
1 1282 . 13 1 1 A 111 111 LEU CB C 111 42.360 42.650 -0.290 1
1 1286 . 13 1 1 A 111 111 LEU N N 111 123.318 127.048 -3.730 1
1 1287 . 13 1 1 A 112 112 ASN H H 112 8.487 8.853 -0.366 1
1 1288 . 13 1 1 A 112 112 ASN HA H 112 4.725 4.614 0.111 1
1 1293 . 13 1 1 A 112 112 ASN C C 112 175.454 173.476 1.978 1
1 1294 . 13 1 1 A 112 112 ASN CA C 112 53.610 55.537 -1.927 1
1 1295 . 13 1 1 A 112 112 ASN CB C 112 39.116 37.810 1.306 1
1 1296 . 13 1 1 A 112 112 ASN N N 112 118.752 118.058 0.694 1
1 1298 . 13 1 1 A 115 115 GLY H H 115 8.205 8.340 -0.135 1
1 1299 . 13 1 1 A 115 115 GLY HA2 H 115 4.126 4.218 -0.092 1
1 1300 . 13 1 1 A 115 115 GLY HA3 H 115 4.126 4.218 -0.092 1
1 1301 . 13 1 1 A 115 115 GLY CA C 115 44.727 45.098 -0.371 1
1 1302 . 13 1 1 A 116 116 PRO HA H 116 4.485 4.758 -0.273 1
1 1309 . 13 1 1 A 116 116 PRO CA C 116 63.298 62.547 0.751 1
1 1310 . 13 1 1 A 116 116 PRO CB C 116 32.077 33.202 -1.125 1
1 1313 . 13 1 1 A 117 117 SER H H 117 8.532 8.845 -0.313 1
1 1 . 14 1 1 A 7 7 GLY HA2 H 7 3.960 3.846 0.114 1
1 2 . 14 1 1 A 7 7 GLY HA3 H 7 3.960 3.846 0.114 1
1 3 . 14 1 1 A 7 7 GLY C C 7 174.009 174.414 -0.405 1
1 4 . 14 1 1 A 7 7 GLY CA C 7 45.374 47.191 -1.817 1
1 5 . 14 1 1 A 8 8 ALA H H 8 8.163 7.726 0.437 1
1 6 . 14 1 1 A 8 8 ALA HA H 8 4.381 4.073 0.308 1
1 10 . 14 1 1 A 8 8 ALA C C 8 178.078 176.657 1.421 1
1 11 . 14 1 1 A 8 8 ALA CA C 8 52.677 54.377 -1.700 1
1 12 . 14 1 1 A 8 8 ALA CB C 8 19.368 18.113 1.255 1
1 13 . 14 1 1 A 8 8 ALA N N 8 123.721 120.323 3.398 1
1 14 . 14 1 1 A 9 9 THR H H 9 8.142 8.764 -0.622 1
1 15 . 14 1 1 A 9 9 THR HA H 9 4.353 3.914 0.439 1
1 20 . 14 1 1 A 9 9 THR C C 9 174.597 173.161 1.436 1
1 21 . 14 1 1 A 9 9 THR CA C 9 62.093 62.272 -0.179 1
1 22 . 14 1 1 A 9 9 THR CB C 9 69.948 67.475 2.473 1
1 24 . 14 1 1 A 9 9 THR N N 9 113.761 109.068 4.693 1
1 25 . 14 1 1 A 10 10 LEU H H 10 8.218 7.923 0.295 1
1 26 . 14 1 1 A 10 10 LEU HA H 10 4.169 4.717 -0.548 1
1 36 . 14 1 1 A 10 10 LEU C C 10 176.110 176.382 -0.272 1
1 37 . 14 1 1 A 10 10 LEU CA C 10 61.099 54.115 6.984 1
1 38 . 14 1 1 A 10 10 LEU CB C 10 38.686 45.625 -6.939 1
1 42 . 14 1 1 A 10 10 LEU N N 10 123.516 122.907 0.609 1
1 43 . 14 1 1 A 11 11 LYS H H 11 8.496 8.490 0.006 1
1 44 . 14 1 1 A 11 11 LYS HA H 11 4.891 4.284 0.607 1
1 49 . 14 1 1 A 11 11 LYS C C 11 175.794 177.238 -1.444 1
1 50 . 14 1 1 A 11 11 LYS CA C 11 55.652 56.322 -0.670 1
1 51 . 14 1 1 A 11 11 LYS CB C 11 29.444 32.969 -3.525 1
1 52 . 14 1 1 A 11 11 LYS N N 11 125.141 124.414 0.727 1
1 53 . 14 1 1 A 12 12 GLN HA H 12 4.315 4.211 0.104 1
1 54 . 14 1 1 A 12 12 GLN C C 12 176.300 176.298 0.002 1
1 55 . 14 1 1 A 12 12 GLN CA C 12 56.286 58.077 -1.791 1
1 56 . 14 1 1 A 12 12 GLN CB C 12 32.901 29.051 3.850 1
1 57 . 14 1 1 A 13 13 LEU H H 13 8.410 7.950 0.460 1
1 58 . 14 1 1 A 13 13 LEU HA H 13 4.348 4.284 0.064 1
1 67 . 14 1 1 A 13 13 LEU C C 13 177.120 175.643 1.477 1
1 68 . 14 1 1 A 13 13 LEU CA C 13 55.142 54.992 0.150 1
1 69 . 14 1 1 A 13 13 LEU CB C 13 42.352 42.154 0.198 1
1 73 . 14 1 1 A 13 13 LEU N N 13 124.340 119.423 4.917 1
1 74 . 14 1 1 A 14 14 ASP H H 14 8.250 9.291 -1.041 1
1 75 . 14 1 1 A 14 14 ASP HA H 14 4.540 4.313 0.227 1
1 78 . 14 1 1 A 14 14 ASP C C 14 176.769 176.470 0.299 1
1 79 . 14 1 1 A 14 14 ASP CA C 14 54.772 56.486 -1.714 1
1 80 . 14 1 1 A 14 14 ASP CB C 14 41.322 40.063 1.259 1
1 81 . 14 1 1 A 14 14 ASP N N 14 120.493 124.110 -3.617 1
1 82 . 14 1 1 A 15 15 GLY H H 15 8.428 8.628 -0.200 1
1 83 . 14 1 1 A 15 15 GLY HA2 H 15 4.089 3.933 0.156 1
1 84 . 14 1 1 A 15 15 GLY HA3 H 15 3.874 3.939 -0.065 1
1 85 . 14 1 1 A 15 15 GLY C C 15 174.122 174.262 -0.140 1
1 86 . 14 1 1 A 15 15 GLY CA C 15 45.972 45.882 0.090 1
1 87 . 14 1 1 A 15 15 GLY N N 15 108.670 105.998 2.672 1
1 88 . 14 1 1 A 16 16 ILE H H 16 7.727 7.843 -0.116 1
1 89 . 14 1 1 A 16 16 ILE HA H 16 4.705 4.363 0.342 1
1 99 . 14 1 1 A 16 16 ILE C C 16 175.807 174.807 1.000 1
1 100 . 14 1 1 A 16 16 ILE CA C 16 60.703 60.787 -0.084 1
1 101 . 14 1 1 A 16 16 ILE CB C 16 38.509 39.151 -0.642 1
1 105 . 14 1 1 A 16 16 ILE N N 16 120.267 121.351 -1.084 1
1 106 . 14 1 1 A 17 17 HIS H H 17 9.101 8.641 0.460 1
1 107 . 14 1 1 A 17 17 HIS HA H 17 4.782 5.218 -0.436 1
1 112 . 14 1 1 A 17 17 HIS C C 17 173.051 174.253 -1.202 1
1 113 . 14 1 1 A 17 17 HIS CA C 17 55.353 53.911 1.442 1
1 114 . 14 1 1 A 17 17 HIS CB C 17 32.468 32.740 -0.272 1
1 117 . 14 1 1 A 17 17 HIS N N 17 125.061 126.952 -1.891 1
1 118 . 14 1 1 A 18 18 VAL H H 18 8.427 8.512 -0.085 1
1 119 . 14 1 1 A 18 18 VAL HA H 18 4.375 4.208 0.167 1
1 127 . 14 1 1 A 18 18 VAL C C 18 174.702 175.542 -0.840 1
1 128 . 14 1 1 A 18 18 VAL CA C 18 62.035 61.504 0.531 1
1 129 . 14 1 1 A 18 18 VAL CB C 18 32.325 32.813 -0.488 1
1 132 . 14 1 1 A 18 18 VAL N N 18 127.069 123.828 3.241 1
1 133 . 14 1 1 A 19 19 THR H H 19 9.272 8.142 1.130 1
1 134 . 14 1 1 A 19 19 THR HA H 19 4.512 4.883 -0.371 1
1 139 . 14 1 1 A 19 19 THR C C 19 172.784 172.950 -0.166 1
1 140 . 14 1 1 A 19 19 THR CA C 19 62.512 61.720 0.792 1
1 141 . 14 1 1 A 19 19 THR CB C 19 70.663 71.376 -0.713 1
1 143 . 14 1 1 A 19 19 THR N N 19 126.619 117.460 9.159 1
1 144 . 14 1 1 A 20 20 ILE H H 20 8.737 9.183 -0.446 1
1 145 . 14 1 1 A 20 20 ILE HA H 20 4.870 4.777 0.093 1
1 155 . 14 1 1 A 20 20 ILE C C 20 175.315 174.958 0.357 1
1 156 . 14 1 1 A 20 20 ILE CA C 20 60.157 59.570 0.587 1
1 157 . 14 1 1 A 20 20 ILE CB C 20 38.603 38.574 0.029 1
1 161 . 14 1 1 A 20 20 ILE N N 20 128.114 128.696 -0.582 1
1 162 . 14 1 1 A 21 21 LEU H H 21 8.902 8.603 0.299 1
1 163 . 14 1 1 A 21 21 LEU HA H 21 4.804 5.025 -0.221 1
1 173 . 14 1 1 A 21 21 LEU C C 21 175.565 175.375 0.190 1
1 174 . 14 1 1 A 21 21 LEU CA C 21 52.731 52.642 0.089 1
1 175 . 14 1 1 A 21 21 LEU CB C 21 43.947 43.661 0.286 1
1 179 . 14 1 1 A 21 21 LEU N N 21 125.457 127.902 -2.445 1
1 180 . 14 1 1 A 22 22 HIS H H 22 8.577 8.856 -0.279 1
1 181 . 14 1 1 A 22 22 HIS HA H 22 5.013 4.989 0.024 1
1 186 . 14 1 1 A 22 22 HIS C C 22 174.258 175.267 -1.009 1
1 187 . 14 1 1 A 22 22 HIS CA C 22 55.880 55.871 0.009 1
1 188 . 14 1 1 A 22 22 HIS CB C 22 30.901 30.200 0.701 1
1 191 . 14 1 1 A 22 22 HIS N N 22 122.595 123.821 -1.226 1
1 192 . 14 1 1 A 23 23 LYS H H 23 8.712 9.297 -0.585 1
1 193 . 14 1 1 A 23 23 LYS HA H 23 4.880 5.054 -0.174 1
1 202 . 14 1 1 A 23 23 LYS C C 23 174.265 174.720 -0.455 1
1 203 . 14 1 1 A 23 23 LYS CA C 23 54.314 54.223 0.091 1
1 204 . 14 1 1 A 23 23 LYS CB C 23 36.068 36.282 -0.214 1
1 208 . 14 1 1 A 23 23 LYS N N 23 120.814 120.954 -0.140 1
1 209 . 14 1 1 A 24 24 GLU H H 24 8.360 8.620 -0.260 1
1 210 . 14 1 1 A 24 24 GLU HA H 24 4.350 4.853 -0.503 1
1 215 . 14 1 1 A 24 24 GLU C C 24 177.843 176.579 1.264 1
1 216 . 14 1 1 A 24 24 GLU CA C 24 55.601 54.526 1.075 1
1 217 . 14 1 1 A 24 24 GLU CB C 24 30.512 32.776 -2.264 1
1 219 . 14 1 1 A 24 24 GLU N N 24 117.859 117.597 0.262 1
1 220 . 14 1 1 A 25 25 GLU H H 25 9.146 8.815 0.331 1
1 221 . 14 1 1 A 25 25 GLU HA H 25 3.924 4.019 -0.095 1
1 226 . 14 1 1 A 25 25 GLU C C 25 177.809 177.600 0.209 1
1 227 . 14 1 1 A 25 25 GLU CA C 25 58.568 58.285 0.283 1
1 228 . 14 1 1 A 25 25 GLU CB C 25 29.313 29.145 0.168 1
1 230 . 14 1 1 A 25 25 GLU N N 25 124.543 121.864 2.679 1
1 231 . 14 1 1 A 26 26 GLY H H 26 8.242 8.621 -0.379 1
1 232 . 14 1 1 A 26 26 GLY HA2 H 26 4.287 4.051 0.236 1
1 233 . 14 1 1 A 26 26 GLY HA3 H 26 3.407 4.052 -0.645 1
1 234 . 14 1 1 A 26 26 GLY C C 26 174.234 175.081 -0.847 1
1 235 . 14 1 1 A 26 26 GLY CA C 26 46.113 46.108 0.005 1
1 236 . 14 1 1 A 26 26 GLY N N 26 115.394 114.242 1.152 1
1 237 . 14 1 1 A 27 27 ALA H H 27 7.432 8.071 -0.639 1
1 238 . 14 1 1 A 27 27 ALA HA H 27 4.402 4.302 0.100 1
1 242 . 14 1 1 A 27 27 ALA C C 27 178.138 178.234 -0.096 1
1 243 . 14 1 1 A 27 27 ALA CA C 27 52.273 52.527 -0.254 1
1 244 . 14 1 1 A 27 27 ALA CB C 27 20.214 20.046 0.168 1
1 245 . 14 1 1 A 27 27 ALA N N 27 122.323 122.005 0.318 1
1 246 . 14 1 1 A 28 28 GLY H H 28 8.624 7.874 0.750 1
1 247 . 14 1 1 A 28 28 GLY HA2 H 28 4.134 4.067 0.067 1
1 248 . 14 1 1 A 28 28 GLY HA3 H 28 3.953 4.107 -0.154 1
1 249 . 14 1 1 A 28 28 GLY C C 28 174.069 174.844 -0.775 1
1 250 . 14 1 1 A 28 28 GLY CA C 28 44.546 44.676 -0.130 1
1 251 . 14 1 1 A 28 28 GLY N N 28 107.593 106.022 1.571 1
1 252 . 14 1 1 A 29 29 LEU H H 29 7.934 8.609 -0.675 1
1 253 . 14 1 1 A 29 29 LEU HA H 29 4.059 4.348 -0.289 1
1 263 . 14 1 1 A 29 29 LEU C C 29 177.548 176.892 0.656 1
1 264 . 14 1 1 A 29 29 LEU CA C 29 56.298 56.238 0.060 1
1 265 . 14 1 1 A 29 29 LEU CB C 29 41.940 42.741 -0.801 1
1 269 . 14 1 1 A 29 29 LEU N N 29 115.495 121.408 -5.913 1
1 270 . 14 1 1 A 30 30 GLY H H 30 8.669 7.939 0.730 1
1 271 . 14 1 1 A 30 30 GLY HA2 H 30 4.264 4.115 0.149 1
1 272 . 14 1 1 A 30 30 GLY HA3 H 30 4.001 4.267 -0.266 1
1 273 . 14 1 1 A 30 30 GLY C C 30 175.296 173.091 2.205 1
1 274 . 14 1 1 A 30 30 GLY CA C 30 46.368 45.027 1.341 1
1 275 . 14 1 1 A 30 30 GLY N N 30 103.121 106.313 -3.192 1
1 276 . 14 1 1 A 31 31 PHE H H 31 7.044 7.348 -0.304 1
1 277 . 14 1 1 A 31 31 PHE HA H 31 4.541 4.400 0.141 1
1 285 . 14 1 1 A 31 31 PHE C C 31 171.141 172.417 -1.276 1
1 286 . 14 1 1 A 31 31 PHE CA C 31 55.704 55.223 0.481 1
1 287 . 14 1 1 A 31 31 PHE CB C 31 40.745 41.657 -0.912 1
1 293 . 14 1 1 A 31 31 PHE N N 31 115.404 114.914 0.490 1
1 294 . 14 1 1 A 32 32 SER H H 32 8.752 8.732 0.020 1
1 295 . 14 1 1 A 32 32 SER HA H 32 4.990 4.870 0.120 1
1 298 . 14 1 1 A 32 32 SER C C 32 175.049 172.656 2.393 1
1 299 . 14 1 1 A 32 32 SER CA C 32 55.001 55.670 -0.669 1
1 300 . 14 1 1 A 32 32 SER CB C 32 67.170 66.513 0.657 1
1 301 . 14 1 1 A 32 32 SER N N 32 113.639 114.800 -1.161 1
1 302 . 14 1 1 A 33 33 LEU H H 33 8.639 8.523 0.116 1
1 303 . 14 1 1 A 33 33 LEU HA H 33 5.573 5.142 0.431 1
1 313 . 14 1 1 A 33 33 LEU C C 33 175.827 175.528 0.299 1
1 314 . 14 1 1 A 33 33 LEU CA C 33 53.620 53.583 0.037 1
1 315 . 14 1 1 A 33 33 LEU CB C 33 45.399 44.541 0.858 1
1 319 . 14 1 1 A 33 33 LEU N N 33 118.936 123.279 -4.343 1
1 320 . 14 1 1 A 34 34 ALA H H 34 9.410 8.612 0.798 1
1 321 . 14 1 1 A 34 34 ALA HA H 34 4.749 5.048 -0.299 1
1 325 . 14 1 1 A 34 34 ALA C C 34 176.231 177.450 -1.219 1
1 326 . 14 1 1 A 34 34 ALA CA C 34 50.425 51.217 -0.792 1
1 327 . 14 1 1 A 34 34 ALA CB C 34 22.518 23.082 -0.564 1
1 328 . 14 1 1 A 34 34 ALA N N 34 124.395 121.164 3.231 1
1 329 . 14 1 1 A 35 35 GLY H H 35 8.130 8.746 -0.616 1
1 330 . 14 1 1 A 35 35 GLY HA2 H 35 4.712 4.030 0.682 1
1 331 . 14 1 1 A 35 35 GLY HA3 H 35 3.955 4.056 -0.101 1
1 332 . 14 1 1 A 35 35 GLY C C 35 174.750 173.348 1.402 1
1 333 . 14 1 1 A 35 35 GLY CA C 35 44.494 45.106 -0.612 1
1 334 . 14 1 1 A 35 35 GLY N N 35 103.650 107.956 -4.306 1
1 335 . 14 1 1 A 36 36 GLY H H 36 8.217 7.762 0.455 1
1 336 . 14 1 1 A 36 36 GLY HA2 H 36 4.494 4.312 0.182 1
1 337 . 14 1 1 A 36 36 GLY HA3 H 36 3.836 4.347 -0.511 1
1 338 . 14 1 1 A 36 36 GLY C C 36 174.410 173.726 0.684 1
1 339 . 14 1 1 A 36 36 GLY CA C 36 45.462 46.094 -0.632 1
1 340 . 14 1 1 A 36 36 GLY N N 36 122.114 108.893 13.221 1
1 341 . 14 1 1 A 37 37 ALA H H 37 8.963 8.656 0.307 1
1 342 . 14 1 1 A 37 37 ALA HA H 37 3.998 4.223 -0.225 1
1 346 . 14 1 1 A 37 37 ALA C C 37 176.935 178.931 -1.996 1
1 347 . 14 1 1 A 37 37 ALA CA C 37 55.308 53.543 1.765 1
1 348 . 14 1 1 A 37 37 ALA CB C 37 18.822 19.167 -0.345 1
1 349 . 14 1 1 A 37 37 ALA N N 37 123.418 121.914 1.504 1
1 350 . 14 1 1 A 38 38 ASP H H 38 10.586 7.953 2.633 1
1 351 . 14 1 1 A 38 38 ASP HA H 38 4.485 4.532 -0.047 1
1 354 . 14 1 1 A 38 38 ASP C C 38 175.309 176.348 -1.039 1
1 355 . 14 1 1 A 38 38 ASP CA C 38 52.730 56.150 -3.420 1
1 356 . 14 1 1 A 38 38 ASP CB C 38 38.689 41.123 -2.434 1
1 357 . 14 1 1 A 38 38 ASP N N 38 111.480 117.584 -6.104 1
1 358 . 14 1 1 A 39 39 LEU H H 39 7.789 7.831 -0.042 1
1 359 . 14 1 1 A 39 39 LEU HA H 39 4.699 4.413 0.286 1
1 369 . 14 1 1 A 39 39 LEU C C 39 176.377 177.724 -1.347 1
1 370 . 14 1 1 A 39 39 LEU CA C 39 52.952 54.212 -1.260 1
1 371 . 14 1 1 A 39 39 LEU CB C 39 43.294 42.184 1.110 1
1 375 . 14 1 1 A 39 39 LEU N N 39 122.545 121.391 1.154 1
1 376 . 14 1 1 A 40 40 GLU H H 40 8.331 8.575 -0.244 1
1 377 . 14 1 1 A 40 40 GLU HA H 40 3.978 4.174 -0.196 1
1 382 . 14 1 1 A 40 40 GLU C C 40 176.887 177.192 -0.305 1
1 383 . 14 1 1 A 40 40 GLU CA C 40 59.066 59.221 -0.155 1
1 384 . 14 1 1 A 40 40 GLU CB C 40 29.523 30.025 -0.502 1
1 386 . 14 1 1 A 40 40 GLU N N 40 118.036 120.106 -2.070 1
1 387 . 14 1 1 A 41 41 ASN H H 41 7.890 7.701 0.189 1
1 388 . 14 1 1 A 41 41 ASN HA H 41 4.820 4.984 -0.164 1
1 393 . 14 1 1 A 41 41 ASN CA C 41 52.316 51.630 0.686 1
1 394 . 14 1 1 A 41 41 ASN CB C 41 37.409 36.467 0.942 1
1 395 . 14 1 1 A 41 41 ASN N N 41 115.196 118.468 -3.272 1
1 397 . 14 1 1 A 42 42 LYS H H 42 7.943 7.952 -0.009 1
1 398 . 14 1 1 A 42 42 LYS HA H 42 4.328 4.553 -0.225 1
1 407 . 14 1 1 A 42 42 LYS C C 42 177.081 176.307 0.774 1
1 408 . 14 1 1 A 42 42 LYS CA C 42 56.567 58.334 -1.767 1
1 409 . 14 1 1 A 42 42 LYS CB C 42 33.120 32.545 0.575 1
1 413 . 14 1 1 A 42 42 LYS N N 42 120.612 125.233 -4.621 1
1 414 . 14 1 1 A 43 43 VAL H H 43 7.456 7.570 -0.114 1
1 415 . 14 1 1 A 43 43 VAL HA H 43 4.059 4.401 -0.342 1
1 423 . 14 1 1 A 43 43 VAL CA C 43 61.330 61.506 -0.176 1
1 424 . 14 1 1 A 43 43 VAL CB C 43 32.819 33.389 -0.570 1
1 427 . 14 1 1 A 43 43 VAL N N 43 118.284 116.583 1.701 1
1 428 . 14 1 1 A 44 44 ILE H H 44 8.481 8.834 -0.353 1
1 429 . 14 1 1 A 44 44 ILE HA H 44 4.913 4.594 0.319 1
1 439 . 14 1 1 A 44 44 ILE C C 44 176.719 175.956 0.763 1
1 440 . 14 1 1 A 44 44 ILE CA C 44 59.946 62.135 -2.189 1
1 441 . 14 1 1 A 44 44 ILE CB C 44 35.784 36.878 -1.094 1
1 445 . 14 1 1 A 44 44 ILE N N 44 127.089 128.164 -1.075 1
1 446 . 14 1 1 A 45 45 THR H H 45 8.906 8.445 0.461 1
1 447 . 14 1 1 A 45 45 THR HA H 45 5.400 5.230 0.170 1
1 452 . 14 1 1 A 45 45 THR CA C 45 58.528 60.245 -1.717 1
1 453 . 14 1 1 A 45 45 THR CB C 45 73.760 71.433 2.327 1
1 455 . 14 1 1 A 45 45 THR N N 45 116.832 119.397 -2.565 1
1 456 . 14 1 1 A 46 46 VAL H H 46 8.336 8.687 -0.351 1
1 457 . 14 1 1 A 46 46 VAL HA H 46 4.059 4.240 -0.181 1
1 465 . 14 1 1 A 46 46 VAL C C 46 176.648 176.683 -0.035 1
1 466 . 14 1 1 A 46 46 VAL CA C 46 63.058 62.987 0.071 1
1 467 . 14 1 1 A 46 46 VAL CB C 46 31.601 30.936 0.665 1
1 470 . 14 1 1 A 46 46 VAL N N 46 118.542 122.113 -3.571 1
1 471 . 14 1 1 A 47 47 HIS H H 47 9.382 8.540 0.842 1
1 472 . 14 1 1 A 47 47 HIS HA H 47 4.628 4.179 0.449 1
1 477 . 14 1 1 A 47 47 HIS C C 47 174.339 174.207 0.132 1
1 478 . 14 1 1 A 47 47 HIS CA C 47 57.764 59.915 -2.151 1
1 479 . 14 1 1 A 47 47 HIS CB C 47 31.453 30.691 0.762 1
1 482 . 14 1 1 A 47 47 HIS N N 47 133.900 128.254 5.646 1
1 483 . 14 1 1 A 48 48 ARG H H 48 7.135 7.718 -0.583 1
1 484 . 14 1 1 A 48 48 ARG HA H 48 4.360 4.713 -0.353 1
1 491 . 14 1 1 A 48 48 ARG C C 48 173.877 174.678 -0.801 1
1 492 . 14 1 1 A 48 48 ARG CA C 48 54.385 54.798 -0.413 1
1 493 . 14 1 1 A 48 48 ARG CB C 48 33.996 35.010 -1.014 1
1 496 . 14 1 1 A 48 48 ARG N N 48 114.736 117.740 -3.004 1
1 497 . 14 1 1 A 49 49 VAL H H 49 8.690 8.580 0.110 1
1 498 . 14 1 1 A 49 49 VAL HA H 49 4.015 4.430 -0.415 1
1 506 . 14 1 1 A 49 49 VAL C C 49 176.255 175.547 0.708 1
1 507 . 14 1 1 A 49 49 VAL CA C 49 61.882 61.704 0.178 1
1 508 . 14 1 1 A 49 49 VAL CB C 49 32.261 33.350 -1.089 1
1 511 . 14 1 1 A 49 49 VAL N N 49 122.844 122.465 0.379 1
1 512 . 14 1 1 A 50 50 PHE H H 50 7.866 8.313 -0.447 1
1 513 . 14 1 1 A 50 50 PHE HA H 50 4.866 4.483 0.383 1
1 521 . 14 1 1 A 50 50 PHE C C 50 174.847 176.312 -1.465 1
1 522 . 14 1 1 A 50 50 PHE CA C 50 54.596 57.508 -2.912 1
1 523 . 14 1 1 A 50 50 PHE CB C 50 36.558 39.116 -2.558 1
1 529 . 14 1 1 A 50 50 PHE N N 50 128.498 127.416 1.082 1
1 530 . 14 1 1 A 51 51 PRO HA H 51 4.386 4.547 -0.161 1
1 537 . 14 1 1 A 51 51 PRO C C 51 177.321 176.672 0.649 1
1 538 . 14 1 1 A 51 51 PRO CA C 51 64.381 64.514 -0.133 1
1 539 . 14 1 1 A 51 51 PRO CB C 51 31.773 32.245 -0.472 1
1 542 . 14 1 1 A 52 52 ASN H H 52 8.814 8.546 0.268 1
1 543 . 14 1 1 A 52 52 ASN HA H 52 4.496 5.001 -0.505 1
1 548 . 14 1 1 A 52 52 ASN C C 52 174.823 174.693 0.130 1
1 549 . 14 1 1 A 52 52 ASN CA C 52 54.719 52.221 2.498 1
1 550 . 14 1 1 A 52 52 ASN CB C 52 38.109 39.252 -1.143 1
1 551 . 14 1 1 A 52 52 ASN N N 52 116.145 116.216 -0.071 1
1 553 . 14 1 1 A 53 53 GLY H H 53 7.730 8.240 -0.510 1
1 554 . 14 1 1 A 53 53 GLY HA2 H 53 4.430 4.382 0.048 1
1 555 . 14 1 1 A 53 53 GLY HA3 H 53 4.089 4.402 -0.313 1
1 556 . 14 1 1 A 53 53 GLY C C 53 174.810 173.982 0.828 1
1 557 . 14 1 1 A 53 53 GLY CA C 53 44.987 45.939 -0.952 1
1 558 . 14 1 1 A 53 53 GLY N N 53 106.196 110.714 -4.518 1
1 559 . 14 1 1 A 54 54 LEU H H 54 8.764 9.032 -0.268 1
1 560 . 14 1 1 A 54 54 LEU HA H 54 4.041 4.285 -0.244 1
1 570 . 14 1 1 A 54 54 LEU C C 54 179.712 178.386 1.326 1
1 571 . 14 1 1 A 54 54 LEU CA C 54 58.310 57.413 0.897 1
1 572 . 14 1 1 A 54 54 LEU CB C 54 42.390 42.179 0.211 1
1 576 . 14 1 1 A 54 54 LEU N N 54 118.836 119.860 -1.024 1
1 577 . 14 1 1 A 55 55 ALA H H 55 7.593 7.896 -0.303 1
1 578 . 14 1 1 A 55 55 ALA HA H 55 4.275 3.878 0.397 1
1 582 . 14 1 1 A 55 55 ALA C C 55 181.307 179.642 1.665 1
1 583 . 14 1 1 A 55 55 ALA CA C 55 54.825 55.472 -0.647 1
1 584 . 14 1 1 A 55 55 ALA CB C 55 18.345 18.438 -0.093 1
1 585 . 14 1 1 A 55 55 ALA N N 55 118.782 121.389 -2.607 1
1 586 . 14 1 1 A 56 56 SER H H 56 9.339 7.972 1.367 1
1 587 . 14 1 1 A 56 56 SER HA H 56 4.023 4.174 -0.151 1
1 589 . 14 1 1 A 56 56 SER C C 56 176.392 177.368 -0.976 1
1 590 . 14 1 1 A 56 56 SER CA C 56 60.984 61.422 -0.438 1
1 591 . 14 1 1 A 56 56 SER CB C 56 62.987 62.766 0.221 1
1 592 . 14 1 1 A 56 56 SER N N 56 117.631 113.182 4.449 1
1 593 . 14 1 1 A 57 57 GLN H H 57 7.942 7.940 0.002 1
1 594 . 14 1 1 A 57 57 GLN HA H 57 4.034 4.054 -0.020 1
1 601 . 14 1 1 A 57 57 GLN C C 57 177.400 179.015 -1.615 1
1 602 . 14 1 1 A 57 57 GLN CA C 57 58.362 59.042 -0.680 1
1 603 . 14 1 1 A 57 57 GLN CB C 57 28.801 28.216 0.585 1
1 605 . 14 1 1 A 57 57 GLN N N 57 118.162 121.396 -3.234 1
1 607 . 14 1 1 A 58 58 GLU H H 58 7.683 8.672 -0.989 1
1 608 . 14 1 1 A 58 58 GLU HA H 58 4.163 4.074 0.089 1
1 613 . 14 1 1 A 58 58 GLU C C 58 179.248 177.019 2.229 1
1 614 . 14 1 1 A 58 58 GLU CA C 58 59.559 58.266 1.293 1
1 615 . 14 1 1 A 58 58 GLU CB C 58 29.317 29.785 -0.468 1
1 617 . 14 1 1 A 58 58 GLU N N 58 119.877 117.559 2.318 1
1 618 . 14 1 1 A 59 59 GLY H H 59 7.446 7.666 -0.220 1
1 619 . 14 1 1 A 59 59 GLY HA2 H 59 4.100 3.984 0.116 1
1 620 . 14 1 1 A 59 59 GLY HA3 H 59 3.770 3.988 -0.218 1
1 621 . 14 1 1 A 59 59 GLY C C 59 175.432 175.485 -0.053 1
1 622 . 14 1 1 A 59 59 GLY CA C 59 46.817 45.453 1.364 1
1 623 . 14 1 1 A 59 59 GLY N N 59 102.653 107.471 -4.818 1
1 624 . 14 1 1 A 60 60 THR H H 60 8.343 8.024 0.319 1
1 625 . 14 1 1 A 60 60 THR HA H 60 4.037 4.076 -0.039 1
1 630 . 14 1 1 A 60 60 THR C C 60 175.843 174.862 0.981 1
1 631 . 14 1 1 A 60 60 THR CA C 60 64.792 65.589 -0.797 1
1 632 . 14 1 1 A 60 60 THR CB C 60 69.325 69.351 -0.026 1
1 634 . 14 1 1 A 60 60 THR N N 60 113.863 113.509 0.354 1
1 635 . 14 1 1 A 61 61 ILE H H 61 8.802 7.632 1.170 1
1 636 . 14 1 1 A 61 61 ILE HA H 61 3.631 4.115 -0.484 1
1 646 . 14 1 1 A 61 61 ILE C C 61 174.198 174.479 -0.281 1
1 647 . 14 1 1 A 61 61 ILE CA C 61 62.938 60.986 1.952 1
1 648 . 14 1 1 A 61 61 ILE CB C 61 37.225 36.287 0.938 1
1 652 . 14 1 1 A 61 61 ILE N N 61 126.153 119.572 6.581 1
1 653 . 14 1 1 A 62 62 GLN H H 62 7.124 9.104 -1.980 1
1 654 . 14 1 1 A 62 62 GLN HA H 62 4.500 4.603 -0.103 1
1 661 . 14 1 1 A 62 62 GLN C C 62 174.556 175.509 -0.953 1
1 662 . 14 1 1 A 62 62 GLN CA C 62 53.364 54.443 -1.079 1
1 663 . 14 1 1 A 62 62 GLN CB C 62 32.196 30.858 1.338 1
1 665 . 14 1 1 A 62 62 GLN N N 62 123.730 126.436 -2.706 1
1 667 . 14 1 1 A 63 63 LYS H H 63 8.399 8.620 -0.221 1
1 668 . 14 1 1 A 63 63 LYS HA H 63 3.464 4.438 -0.974 1
1 677 . 14 1 1 A 63 63 LYS CA C 63 57.905 58.353 -0.448 1
1 678 . 14 1 1 A 63 63 LYS CB C 63 32.260 32.004 0.256 1
1 682 . 14 1 1 A 63 63 LYS N N 63 121.381 124.654 -3.273 1
1 683 . 14 1 1 A 64 64 GLY H H 64 9.265 8.629 0.636 1
1 684 . 14 1 1 A 64 64 GLY HA2 H 64 4.415 4.006 0.409 1
1 685 . 14 1 1 A 64 64 GLY HA3 H 64 3.639 4.018 -0.379 1
1 686 . 14 1 1 A 64 64 GLY CA C 64 44.881 45.062 -0.181 1
1 687 . 14 1 1 A 64 64 GLY N N 64 113.750 115.413 -1.663 1
1 688 . 14 1 1 A 65 65 ASN H H 65 7.594 7.693 -0.099 1
1 689 . 14 1 1 A 65 65 ASN HA H 65 4.798 4.988 -0.190 1
1 694 . 14 1 1 A 65 65 ASN C C 65 175.042 174.673 0.369 1
1 695 . 14 1 1 A 65 65 ASN CA C 65 53.047 52.296 0.751 1
1 696 . 14 1 1 A 65 65 ASN CB C 65 38.153 40.125 -1.972 1
1 697 . 14 1 1 A 65 65 ASN N N 65 117.999 118.775 -0.776 1
1 699 . 14 1 1 A 66 66 GLU H H 66 8.538 8.606 -0.068 1
1 700 . 14 1 1 A 66 66 GLU HA H 66 4.634 4.503 0.131 1
1 705 . 14 1 1 A 66 66 GLU C C 66 176.620 175.743 0.877 1
1 706 . 14 1 1 A 66 66 GLU CA C 66 55.863 56.855 -0.992 1
1 707 . 14 1 1 A 66 66 GLU CB C 66 30.899 30.429 0.470 1
1 709 . 14 1 1 A 66 66 GLU N N 66 122.233 123.724 -1.491 1
1 710 . 14 1 1 A 67 67 VAL H H 67 8.452 9.230 -0.778 1
1 711 . 14 1 1 A 67 67 VAL HA H 67 4.172 4.239 -0.067 1
1 719 . 14 1 1 A 67 67 VAL C C 67 174.641 175.885 -1.244 1
1 720 . 14 1 1 A 67 67 VAL CA C 67 61.856 62.420 -0.564 1
1 721 . 14 1 1 A 67 67 VAL CB C 67 31.066 30.925 0.141 1
1 724 . 14 1 1 A 67 67 VAL N N 67 126.311 127.463 -1.152 1
1 725 . 14 1 1 A 68 68 LEU H H 68 9.000 8.510 0.490 1
1 726 . 14 1 1 A 68 68 LEU HA H 68 4.390 4.072 0.318 1
1 736 . 14 1 1 A 68 68 LEU C C 68 178.924 176.826 2.098 1
1 737 . 14 1 1 A 68 68 LEU CA C 68 56.990 58.054 -1.064 1
1 738 . 14 1 1 A 68 68 LEU CB C 68 42.392 42.226 0.166 1
1 742 . 14 1 1 A 68 68 LEU N N 68 127.175 130.253 -3.078 1
1 743 . 14 1 1 A 69 69 SER H H 69 7.666 7.896 -0.230 1
1 744 . 14 1 1 A 69 69 SER HA H 69 5.144 4.876 0.268 1
1 747 . 14 1 1 A 69 69 SER C C 69 172.722 172.500 0.222 1
1 748 . 14 1 1 A 69 69 SER CA C 69 57.606 57.270 0.336 1
1 749 . 14 1 1 A 69 69 SER CB C 69 64.511 66.772 -2.261 1
1 750 . 14 1 1 A 69 69 SER N N 69 110.346 109.308 1.038 1
1 751 . 14 1 1 A 70 70 ILE H H 70 7.965 8.500 -0.535 1
1 752 . 14 1 1 A 70 70 ILE HA H 70 4.548 4.945 -0.397 1
1 762 . 14 1 1 A 70 70 ILE C C 70 174.993 176.224 -1.231 1
1 763 . 14 1 1 A 70 70 ILE CA C 70 60.897 60.178 0.719 1
1 764 . 14 1 1 A 70 70 ILE CB C 70 41.186 40.556 0.630 1
1 768 . 14 1 1 A 70 70 ILE N N 70 119.579 120.306 -0.727 1
1 769 . 14 1 1 A 71 71 ASN H H 71 9.839 10.539 -0.700 1
1 770 . 14 1 1 A 71 71 ASN HA H 71 4.485 4.437 0.048 1
1 775 . 14 1 1 A 71 71 ASN C C 71 174.975 175.190 -0.215 1
1 776 . 14 1 1 A 71 71 ASN CA C 71 54.085 54.355 -0.270 1
1 777 . 14 1 1 A 71 71 ASN CB C 71 36.255 36.947 -0.692 1
1 778 . 14 1 1 A 71 71 ASN N N 71 126.963 127.462 -0.499 1
1 780 . 14 1 1 A 72 72 GLY H H 72 8.911 8.433 0.478 1
1 781 . 14 1 1 A 72 72 GLY HA2 H 72 4.149 3.897 0.252 1
1 782 . 14 1 1 A 72 72 GLY HA3 H 72 3.507 3.898 -0.391 1
1 783 . 14 1 1 A 72 72 GLY C C 72 173.594 173.569 0.025 1
1 784 . 14 1 1 A 72 72 GLY CA C 72 45.162 45.401 -0.239 1
1 785 . 14 1 1 A 72 72 GLY N N 72 103.020 104.446 -1.426 1
1 786 . 14 1 1 A 73 73 LYS H H 73 7.922 7.788 0.134 1
1 787 . 14 1 1 A 73 73 LYS HA H 73 4.485 4.599 -0.114 1
1 796 . 14 1 1 A 73 73 LYS C C 73 175.036 175.820 -0.784 1
1 797 . 14 1 1 A 73 73 LYS CA C 73 54.719 55.128 -0.409 1
1 798 . 14 1 1 A 73 73 LYS CB C 73 32.137 33.845 -1.708 1
1 802 . 14 1 1 A 73 73 LYS N N 73 122.413 122.445 -0.032 1
1 803 . 14 1 1 A 74 74 SER H H 74 8.585 8.782 -0.197 1
1 804 . 14 1 1 A 74 74 SER HA H 74 4.452 4.663 -0.211 1
1 807 . 14 1 1 A 74 74 SER C C 74 175.965 174.184 1.781 1
1 808 . 14 1 1 A 74 74 SER CA C 74 58.028 58.562 -0.534 1
1 809 . 14 1 1 A 74 74 SER CB C 74 63.799 63.923 -0.124 1
1 810 . 14 1 1 A 74 74 SER N N 74 118.737 124.310 -5.573 1
1 811 . 14 1 1 A 75 75 LEU H H 75 8.015 8.227 -0.212 1
1 812 . 14 1 1 A 75 75 LEU HA H 75 4.661 4.458 0.203 1
1 822 . 14 1 1 A 75 75 LEU C C 75 178.117 177.466 0.651 1
1 823 . 14 1 1 A 75 75 LEU CA C 75 53.980 54.568 -0.588 1
1 824 . 14 1 1 A 75 75 LEU CB C 75 40.830 41.085 -0.255 1
1 828 . 14 1 1 A 75 75 LEU N N 75 125.425 125.577 -0.152 1
1 829 . 14 1 1 A 76 76 LYS H H 76 8.099 8.617 -0.518 1
1 830 . 14 1 1 A 76 76 LYS HA H 76 4.210 4.421 -0.211 1
1 839 . 14 1 1 A 76 76 LYS C C 76 178.487 176.756 1.731 1
1 840 . 14 1 1 A 76 76 LYS CA C 76 58.010 55.467 2.543 1
1 841 . 14 1 1 A 76 76 LYS CB C 76 31.683 31.693 -0.010 1
1 845 . 14 1 1 A 76 76 LYS N N 76 124.064 120.194 3.870 1
1 846 . 14 1 1 A 77 77 GLY H H 77 8.859 7.843 1.016 1
1 847 . 14 1 1 A 77 77 GLY HA2 H 77 4.110 4.057 0.053 1
1 848 . 14 1 1 A 77 77 GLY HA3 H 77 3.869 4.060 -0.191 1
1 849 . 14 1 1 A 77 77 GLY C C 77 174.335 174.799 -0.464 1
1 850 . 14 1 1 A 77 77 GLY CA C 77 46.232 45.052 1.180 1
1 851 . 14 1 1 A 77 77 GLY N N 77 115.659 108.713 6.946 1
1 852 . 14 1 1 A 78 78 THR H H 78 7.654 7.750 -0.096 1
1 853 . 14 1 1 A 78 78 THR HA H 78 4.624 4.163 0.461 1
1 858 . 14 1 1 A 78 78 THR C C 78 177.272 174.836 2.436 1
1 859 . 14 1 1 A 78 78 THR CA C 78 61.794 63.244 -1.450 1
1 860 . 14 1 1 A 78 78 THR CB C 78 70.595 69.195 1.400 1
1 862 . 14 1 1 A 78 78 THR N N 78 112.847 116.632 -3.785 1
1 863 . 14 1 1 A 79 79 THR H H 79 8.813 8.611 0.202 1
1 864 . 14 1 1 A 79 79 THR HA H 79 4.395 4.718 -0.323 1
1 869 . 14 1 1 A 79 79 THR C C 79 174.503 175.416 -0.913 1
1 870 . 14 1 1 A 79 79 THR CA C 79 61.724 60.828 0.896 1
1 871 . 14 1 1 A 79 79 THR CB C 79 71.007 70.963 0.044 1
1 873 . 14 1 1 A 79 79 THR N N 79 114.123 117.778 -3.655 1
1 874 . 14 1 1 A 80 80 HIS H H 80 10.266 9.229 1.037 1
1 875 . 14 1 1 A 80 80 HIS HA H 80 4.331 4.236 0.095 1
1 880 . 14 1 1 A 80 80 HIS C C 80 177.075 176.786 0.289 1
1 881 . 14 1 1 A 80 80 HIS CA C 80 61.338 60.124 1.214 1
1 882 . 14 1 1 A 80 80 HIS CB C 80 28.651 30.732 -2.081 1
1 885 . 14 1 1 A 80 80 HIS N N 80 122.776 122.258 0.518 1
1 886 . 14 1 1 A 81 81 HIS H H 81 9.335 8.150 1.185 1
1 887 . 14 1 1 A 81 81 HIS HA H 81 4.078 4.097 -0.019 1
1 892 . 14 1 1 A 81 81 HIS C C 81 178.269 176.664 1.605 1
1 893 . 14 1 1 A 81 81 HIS CA C 81 60.210 59.841 0.369 1
1 894 . 14 1 1 A 81 81 HIS CB C 81 29.569 29.895 -0.326 1
1 897 . 14 1 1 A 81 81 HIS N N 81 114.733 118.886 -4.153 1
1 898 . 14 1 1 A 82 82 ASP H H 82 7.741 8.134 -0.393 1
1 899 . 14 1 1 A 82 82 ASP HA H 82 4.452 4.190 0.262 1
1 902 . 14 1 1 A 82 82 ASP C C 82 178.683 178.917 -0.234 1
1 903 . 14 1 1 A 82 82 ASP CA C 82 57.148 57.253 -0.105 1
1 904 . 14 1 1 A 82 82 ASP CB C 82 39.522 40.501 -0.979 1
1 905 . 14 1 1 A 82 82 ASP N N 82 121.407 118.180 3.227 1
1 906 . 14 1 1 A 83 83 ALA H H 83 8.502 8.230 0.272 1
1 907 . 14 1 1 A 83 83 ALA HA H 83 3.939 4.175 -0.236 1
1 911 . 14 1 1 A 83 83 ALA C C 83 179.361 179.593 -0.232 1
1 912 . 14 1 1 A 83 83 ALA CA C 83 55.635 54.771 0.864 1
1 913 . 14 1 1 A 83 83 ALA CB C 83 18.124 18.653 -0.529 1
1 914 . 14 1 1 A 83 83 ALA N N 83 125.049 122.958 2.091 1
1 915 . 14 1 1 A 84 84 LEU H H 84 8.100 8.448 -0.348 1
1 916 . 14 1 1 A 84 84 LEU HA H 84 3.792 3.795 -0.003 1
1 926 . 14 1 1 A 84 84 LEU C C 84 180.173 178.980 1.193 1
1 927 . 14 1 1 A 84 84 LEU CA C 84 57.932 57.942 -0.010 1
1 928 . 14 1 1 A 84 84 LEU CB C 84 41.157 41.593 -0.436 1
1 932 . 14 1 1 A 84 84 LEU N N 84 117.139 118.646 -1.507 1
1 933 . 14 1 1 A 85 85 ALA H H 85 7.715 8.567 -0.852 1
1 934 . 14 1 1 A 85 85 ALA HA H 85 4.061 4.161 -0.100 1
1 938 . 14 1 1 A 85 85 ALA C C 85 180.380 179.766 0.614 1
1 939 . 14 1 1 A 85 85 ALA CA C 85 55.212 55.418 -0.206 1
1 940 . 14 1 1 A 85 85 ALA CB C 85 17.803 18.347 -0.544 1
1 941 . 14 1 1 A 85 85 ALA N N 85 122.448 121.099 1.349 1
1 942 . 14 1 1 A 86 86 ILE H H 86 7.669 7.839 -0.170 1
1 943 . 14 1 1 A 86 86 ILE HA H 86 3.678 3.707 -0.029 1
1 953 . 14 1 1 A 86 86 ILE C C 86 178.692 178.719 -0.027 1
1 954 . 14 1 1 A 86 86 ILE CA C 86 65.226 64.781 0.445 1
1 955 . 14 1 1 A 86 86 ILE CB C 86 38.099 37.786 0.313 1
1 959 . 14 1 1 A 86 86 ILE N N 86 121.804 117.899 3.905 1
1 960 . 14 1 1 A 87 87 LEU H H 87 7.922 8.384 -0.462 1
1 961 . 14 1 1 A 87 87 LEU HA H 87 3.903 4.040 -0.137 1
1 971 . 14 1 1 A 87 87 LEU C C 87 178.610 178.722 -0.112 1
1 972 . 14 1 1 A 87 87 LEU CA C 87 58.221 58.063 0.158 1
1 973 . 14 1 1 A 87 87 LEU CB C 87 42.344 41.481 0.863 1
1 977 . 14 1 1 A 87 87 LEU N N 87 121.947 121.624 0.323 1
1 978 . 14 1 1 A 88 88 ARG H H 88 8.317 8.284 0.033 1
1 979 . 14 1 1 A 88 88 ARG HA H 88 4.060 4.198 -0.138 1
1 986 . 14 1 1 A 88 88 ARG C C 88 180.698 177.333 3.365 1
1 987 . 14 1 1 A 88 88 ARG CA C 88 59.383 58.527 0.856 1
1 988 . 14 1 1 A 88 88 ARG CB C 88 30.055 29.946 0.109 1
1 991 . 14 1 1 A 88 88 ARG N N 88 119.343 119.639 -0.296 1
1 992 . 14 1 1 A 89 89 GLN H H 89 8.270 7.680 0.590 1
1 993 . 14 1 1 A 89 89 GLN HA H 89 4.122 4.264 -0.142 1
1 1000 . 14 1 1 A 89 89 GLN C C 89 177.955 178.302 -0.347 1
1 1001 . 14 1 1 A 89 89 GLN CA C 89 58.714 57.724 0.990 1
1 1002 . 14 1 1 A 89 89 GLN CB C 89 28.160 29.260 -1.100 1
1 1004 . 14 1 1 A 89 89 GLN N N 89 121.097 117.456 3.641 1
1 1006 . 14 1 1 A 90 90 ALA H H 90 7.558 7.564 -0.006 1
1 1007 . 14 1 1 A 90 90 ALA HA H 90 4.123 4.177 -0.054 1
1 1011 . 14 1 1 A 90 90 ALA C C 90 178.076 178.160 -0.084 1
1 1012 . 14 1 1 A 90 90 ALA CA C 90 52.942 53.951 -1.009 1
1 1013 . 14 1 1 A 90 90 ALA CB C 90 18.015 18.272 -0.257 1
1 1014 . 14 1 1 A 90 90 ALA N N 90 119.652 121.832 -2.180 1
1 1015 . 14 1 1 A 91 91 ARG H H 91 7.768 8.115 -0.347 1
1 1016 . 14 1 1 A 91 91 ARG HA H 91 4.065 4.310 -0.245 1
1 1022 . 14 1 1 A 91 91 ARG C C 91 177.858 177.451 0.407 1
1 1023 . 14 1 1 A 91 91 ARG CA C 91 58.573 57.403 1.170 1
1 1024 . 14 1 1 A 91 91 ARG CB C 91 30.384 30.707 -0.323 1
1 1027 . 14 1 1 A 91 91 ARG N N 91 118.081 116.850 1.231 1
1 1028 . 14 1 1 A 92 92 GLU H H 92 7.691 8.100 -0.409 1
1 1029 . 14 1 1 A 92 92 GLU HA H 92 4.123 4.228 -0.105 1
1 1034 . 14 1 1 A 92 92 GLU C C 92 174.459 176.610 -2.151 1
1 1035 . 14 1 1 A 92 92 GLU CA C 92 61.565 60.807 0.758 1
1 1036 . 14 1 1 A 92 92 GLU CB C 92 27.583 29.106 -1.523 1
1 1038 . 14 1 1 A 92 92 GLU N N 92 118.447 118.328 0.119 1
1 1039 . 14 1 1 A 93 93 PRO HA H 93 4.716 4.600 0.116 1
1 1046 . 14 1 1 A 93 93 PRO C C 93 176.221 176.854 -0.633 1
1 1047 . 14 1 1 A 93 93 PRO CA C 93 63.149 62.555 0.594 1
1 1048 . 14 1 1 A 93 93 PRO CB C 93 32.571 33.141 -0.570 1
1 1051 . 14 1 1 A 94 94 ARG H H 94 8.434 8.992 -0.558 1
1 1052 . 14 1 1 A 94 94 ARG HA H 94 4.232 4.388 -0.156 1
1 1058 . 14 1 1 A 94 94 ARG C C 94 175.323 175.835 -0.512 1
1 1059 . 14 1 1 A 94 94 ARG CA C 94 56.972 56.690 0.282 1
1 1060 . 14 1 1 A 94 94 ARG CB C 94 30.448 30.690 -0.242 1
1 1063 . 14 1 1 A 94 94 ARG N N 94 115.987 119.349 -3.362 1
1 1064 . 14 1 1 A 95 95 GLN H H 95 7.246 7.586 -0.340 1
1 1065 . 14 1 1 A 95 95 GLN HA H 95 5.251 5.131 0.120 1
1 1072 . 14 1 1 A 95 95 GLN C C 95 174.786 173.775 1.011 1
1 1073 . 14 1 1 A 95 95 GLN CA C 95 54.209 55.087 -0.878 1
1 1074 . 14 1 1 A 95 95 GLN CB C 95 32.384 32.234 0.150 1
1 1076 . 14 1 1 A 95 95 GLN N N 95 115.998 119.945 -3.947 1
1 1078 . 14 1 1 A 96 96 ALA H H 96 8.739 8.666 0.073 1
1 1079 . 14 1 1 A 96 96 ALA HA H 96 5.412 5.364 0.048 1
1 1083 . 14 1 1 A 96 96 ALA C C 96 175.258 175.788 -0.530 1
1 1084 . 14 1 1 A 96 96 ALA CA C 96 50.355 50.218 0.137 1
1 1085 . 14 1 1 A 96 96 ALA CB C 96 24.270 21.800 2.470 1
1 1086 . 14 1 1 A 96 96 ALA N N 96 126.197 126.200 -0.003 1
1 1087 . 14 1 1 A 97 97 VAL H H 97 8.568 8.788 -0.220 1
1 1088 . 14 1 1 A 97 97 VAL HA H 97 4.804 4.722 0.082 1
1 1096 . 14 1 1 A 97 97 VAL C C 97 175.982 175.140 0.842 1
1 1097 . 14 1 1 A 97 97 VAL CA C 97 61.442 61.352 0.090 1
1 1098 . 14 1 1 A 97 97 VAL CB C 97 33.413 33.013 0.400 1
1 1101 . 14 1 1 A 97 97 VAL N N 97 120.702 122.910 -2.208 1
1 1102 . 14 1 1 A 98 98 ILE H H 98 9.753 8.489 1.264 1
1 1103 . 14 1 1 A 98 98 ILE HA H 98 4.826 5.024 -0.198 1
1 1113 . 14 1 1 A 98 98 ILE C C 98 174.292 174.622 -0.330 1
1 1114 . 14 1 1 A 98 98 ILE CA C 98 59.981 59.796 0.185 1
1 1115 . 14 1 1 A 98 98 ILE CB C 98 40.608 41.679 -1.071 1
1 1119 . 14 1 1 A 98 98 ILE N N 98 131.738 126.804 4.934 1
1 1120 . 14 1 1 A 99 99 VAL H H 99 8.493 8.478 0.015 1
1 1121 . 14 1 1 A 99 99 VAL HA H 99 5.201 4.833 0.368 1
1 1129 . 14 1 1 A 99 99 VAL C C 99 176.557 175.255 1.302 1
1 1130 . 14 1 1 A 99 99 VAL CA C 99 61.495 60.817 0.678 1
1 1131 . 14 1 1 A 99 99 VAL CB C 99 32.327 33.068 -0.741 1
1 1134 . 14 1 1 A 99 99 VAL N N 99 129.537 128.588 0.949 1
1 1135 . 14 1 1 A 100 100 THR H H 100 9.050 8.973 0.077 1
1 1136 . 14 1 1 A 100 100 THR HA H 100 5.606 5.258 0.348 1
1 1141 . 14 1 1 A 100 100 THR C C 100 172.815 173.054 -0.239 1
1 1142 . 14 1 1 A 100 100 THR CA C 100 59.049 59.436 -0.387 1
1 1143 . 14 1 1 A 100 100 THR CB C 100 73.966 72.530 1.436 1
1 1145 . 14 1 1 A 100 100 THR N N 100 117.469 117.104 0.365 1
1 1146 . 14 1 1 A 101 101 ARG H H 101 8.773 8.721 0.052 1
1 1147 . 14 1 1 A 101 101 ARG HA H 101 4.989 5.039 -0.050 1
1 1155 . 14 1 1 A 101 101 ARG C C 101 174.738 175.019 -0.281 1
1 1156 . 14 1 1 A 101 101 ARG CA C 101 54.825 54.316 0.509 1
1 1157 . 14 1 1 A 101 101 ARG CB C 101 34.636 34.001 0.635 1
1 1160 . 14 1 1 A 101 101 ARG N N 101 117.532 120.029 -2.497 1
1 1162 . 14 1 1 A 102 102 LYS H H 102 8.616 8.287 0.329 1
1 1163 . 14 1 1 A 102 102 LYS HA H 102 4.232 4.381 -0.149 1
1 1171 . 14 1 1 A 102 102 LYS C C 102 175.935 175.984 -0.049 1
1 1172 . 14 1 1 A 102 102 LYS CA C 102 56.549 56.330 0.219 1
1 1173 . 14 1 1 A 102 102 LYS CB C 102 33.266 32.449 0.817 1
1 1177 . 14 1 1 A 102 102 LYS N N 102 126.899 121.985 4.914 1
1 1178 . 14 1 1 A 103 103 LEU H H 103 8.424 8.580 -0.156 1
1 1179 . 14 1 1 A 103 103 LEU HA H 103 4.540 4.616 -0.076 1
1 1189 . 14 1 1 A 103 103 LEU C C 103 176.956 176.246 0.710 1
1 1190 . 14 1 1 A 103 103 LEU CA C 103 54.755 54.184 0.571 1
1 1191 . 14 1 1 A 103 103 LEU CB C 103 42.929 42.352 0.577 1
1 1195 . 14 1 1 A 103 103 LEU N N 103 126.246 126.504 -0.258 1
1 1196 . 14 1 1 A 104 104 THR H H 104 8.201 8.366 -0.165 1
1 1197 . 14 1 1 A 104 104 THR HA H 104 4.624 4.364 0.260 1
1 1202 . 14 1 1 A 104 104 THR C C 104 172.954 174.136 -1.182 1
1 1203 . 14 1 1 A 104 104 THR CA C 104 59.483 60.910 -1.427 1
1 1204 . 14 1 1 A 104 104 THR CB C 104 69.761 69.145 0.616 1
1 1206 . 14 1 1 A 104 104 THR N N 104 117.263 115.026 2.237 1
1 1207 . 14 1 1 A 105 105 PRO HA H 105 4.399 4.690 -0.291 1
1 1213 . 14 1 1 A 105 105 PRO CA C 105 63.495 62.580 0.915 1
1 1214 . 14 1 1 A 105 105 PRO CB C 105 32.096 32.872 -0.776 1
1 1217 . 14 1 1 A 106 106 GLU H H 106 8.519 8.675 -0.156 1
1 1218 . 14 1 1 A 106 106 GLU HA H 106 4.197 5.146 -0.949 1
1 1221 . 14 1 1 A 106 106 GLU C C 106 176.110 174.711 1.399 1
1 1222 . 14 1 1 A 106 106 GLU CA C 106 56.743 54.423 2.320 1
1 1223 . 14 1 1 A 106 106 GLU CB C 106 30.137 33.646 -3.509 1
1 1225 . 14 1 1 A 106 106 GLU N N 106 120.609 117.208 3.401 1
1 1226 . 14 1 1 A 107 107 ALA H H 107 8.241 8.416 -0.175 1
1 1227 . 14 1 1 A 107 107 ALA HA H 107 4.317 5.177 -0.860 1
1 1231 . 14 1 1 A 107 107 ALA C C 107 177.299 176.449 0.850 1
1 1232 . 14 1 1 A 107 107 ALA CA C 107 52.203 50.614 1.589 1
1 1233 . 14 1 1 A 107 107 ALA CB C 107 19.392 20.677 -1.285 1
1 1234 . 14 1 1 A 107 107 ALA N N 107 124.849 123.326 1.523 1
1 1235 . 14 1 1 A 108 108 MET H H 108 8.284 8.514 -0.230 1
1 1236 . 14 1 1 A 108 108 MET HA H 108 4.792 4.831 -0.039 1
1 1244 . 14 1 1 A 108 108 MET C C 108 174.337 174.528 -0.191 1
1 1245 . 14 1 1 A 108 108 MET CA C 108 53.258 53.775 -0.517 1
1 1246 . 14 1 1 A 108 108 MET CB C 108 32.608 33.753 -1.145 1
1 1249 . 14 1 1 A 108 108 MET N N 108 121.025 121.856 -0.831 1
1 1250 . 14 1 1 A 109 109 PRO HA H 109 4.408 4.479 -0.071 1
1 1256 . 14 1 1 A 109 109 PRO C C 109 176.412 176.208 0.204 1
1 1257 . 14 1 1 A 109 109 PRO CA C 109 63.290 65.165 -1.875 1
1 1258 . 14 1 1 A 109 109 PRO CB C 109 32.077 31.951 0.126 1
1 1261 . 14 1 1 A 110 110 ASP H H 110 8.417 7.552 0.865 1
1 1262 . 14 1 1 A 110 110 ASP HA H 110 4.573 4.895 -0.322 1
1 1265 . 14 1 1 A 110 110 ASP C C 110 176.508 175.096 1.412 1
1 1266 . 14 1 1 A 110 110 ASP CA C 110 54.085 53.168 0.917 1
1 1267 . 14 1 1 A 110 110 ASP CB C 110 41.075 44.078 -3.003 1
1 1268 . 14 1 1 A 110 110 ASP N N 110 120.239 116.822 3.417 1
1 1269 . 14 1 1 A 111 111 LEU H H 111 8.279 8.790 -0.511 1
1 1270 . 14 1 1 A 111 111 LEU HA H 111 4.319 4.228 0.091 1
1 1280 . 14 1 1 A 111 111 LEU C C 111 177.551 177.199 0.352 1
1 1281 . 14 1 1 A 111 111 LEU CA C 111 55.581 57.243 -1.662 1
1 1282 . 14 1 1 A 111 111 LEU CB C 111 42.360 41.871 0.489 1
1 1286 . 14 1 1 A 111 111 LEU N N 111 123.318 122.432 0.886 1
1 1287 . 14 1 1 A 112 112 ASN H H 112 8.487 8.116 0.371 1
1 1288 . 14 1 1 A 112 112 ASN HA H 112 4.725 4.705 0.020 1
1 1293 . 14 1 1 A 112 112 ASN C C 112 175.454 174.935 0.519 1
1 1294 . 14 1 1 A 112 112 ASN CA C 112 53.610 53.595 0.015 1
1 1295 . 14 1 1 A 112 112 ASN CB C 112 39.116 38.134 0.982 1
1 1296 . 14 1 1 A 112 112 ASN N N 112 118.752 117.586 1.166 1
1 1298 . 14 1 1 A 115 115 GLY H H 115 8.205 8.510 -0.305 1
1 1299 . 14 1 1 A 115 115 GLY HA2 H 115 4.126 4.401 -0.275 1
1 1300 . 14 1 1 A 115 115 GLY HA3 H 115 4.126 4.401 -0.275 1
1 1301 . 14 1 1 A 115 115 GLY CA C 115 44.727 45.466 -0.739 1
1 1302 . 14 1 1 A 116 116 PRO HA H 116 4.485 4.524 -0.039 1
1 1309 . 14 1 1 A 116 116 PRO CA C 116 63.298 62.972 0.326 1
1 1310 . 14 1 1 A 116 116 PRO CB C 116 32.077 32.691 -0.614 1
1 1313 . 14 1 1 A 117 117 SER H H 117 8.532 8.494 0.038 1
1 1 . 15 1 1 A 7 7 GLY HA2 H 7 3.960 4.401 -0.441 1
1 2 . 15 1 1 A 7 7 GLY HA3 H 7 3.960 4.403 -0.443 1
1 3 . 15 1 1 A 7 7 GLY C C 7 174.009 174.259 -0.250 1
1 4 . 15 1 1 A 7 7 GLY CA C 7 45.374 44.246 1.128 1
1 5 . 15 1 1 A 8 8 ALA H H 8 8.163 8.999 -0.836 1
1 6 . 15 1 1 A 8 8 ALA HA H 8 4.381 3.930 0.451 1
1 10 . 15 1 1 A 8 8 ALA C C 8 178.078 176.802 1.276 1
1 11 . 15 1 1 A 8 8 ALA CA C 8 52.677 54.648 -1.971 1
1 12 . 15 1 1 A 8 8 ALA CB C 8 19.368 18.152 1.216 1
1 13 . 15 1 1 A 8 8 ALA N N 8 123.721 121.570 2.151 1
1 14 . 15 1 1 A 9 9 THR H H 9 8.142 8.743 -0.601 1
1 15 . 15 1 1 A 9 9 THR HA H 9 4.353 4.431 -0.078 1
1 20 . 15 1 1 A 9 9 THR C C 9 174.597 173.474 1.123 1
1 21 . 15 1 1 A 9 9 THR CA C 9 62.093 63.291 -1.198 1
1 22 . 15 1 1 A 9 9 THR CB C 9 69.948 67.825 2.123 1
1 24 . 15 1 1 A 9 9 THR N N 9 113.761 109.083 4.678 1
1 25 . 15 1 1 A 10 10 LEU H H 10 8.218 8.639 -0.421 1
1 26 . 15 1 1 A 10 10 LEU HA H 10 4.169 4.408 -0.239 1
1 36 . 15 1 1 A 10 10 LEU C C 10 176.110 176.487 -0.377 1
1 37 . 15 1 1 A 10 10 LEU CA C 10 61.099 54.898 6.201 1
1 38 . 15 1 1 A 10 10 LEU CB C 10 38.686 40.723 -2.037 1
1 42 . 15 1 1 A 10 10 LEU N N 10 123.516 126.846 -3.330 1
1 43 . 15 1 1 A 11 11 LYS H H 11 8.496 8.279 0.217 1
1 44 . 15 1 1 A 11 11 LYS HA H 11 4.891 4.519 0.372 1
1 49 . 15 1 1 A 11 11 LYS C C 11 175.794 176.082 -0.288 1
1 50 . 15 1 1 A 11 11 LYS CA C 11 55.652 57.596 -1.944 1
1 51 . 15 1 1 A 11 11 LYS CB C 11 29.444 34.833 -5.389 1
1 52 . 15 1 1 A 11 11 LYS N N 11 125.141 124.679 0.462 1
1 53 . 15 1 1 A 12 12 GLN HA H 12 4.315 4.177 0.138 1
1 54 . 15 1 1 A 12 12 GLN C C 12 176.300 175.464 0.836 1
1 55 . 15 1 1 A 12 12 GLN CA C 12 56.286 56.874 -0.588 1
1 56 . 15 1 1 A 12 12 GLN CB C 12 32.901 29.513 3.388 1
1 57 . 15 1 1 A 13 13 LEU H H 13 8.410 8.514 -0.104 1
1 58 . 15 1 1 A 13 13 LEU HA H 13 4.348 4.751 -0.403 1
1 67 . 15 1 1 A 13 13 LEU C C 13 177.120 176.419 0.701 1
1 68 . 15 1 1 A 13 13 LEU CA C 13 55.142 52.807 2.335 1
1 69 . 15 1 1 A 13 13 LEU CB C 13 42.352 44.517 -2.165 1
1 73 . 15 1 1 A 13 13 LEU N N 13 124.340 128.356 -4.016 1
1 74 . 15 1 1 A 14 14 ASP H H 14 8.250 9.391 -1.141 1
1 75 . 15 1 1 A 14 14 ASP HA H 14 4.540 4.507 0.033 1
1 78 . 15 1 1 A 14 14 ASP C C 14 176.769 175.934 0.835 1
1 79 . 15 1 1 A 14 14 ASP CA C 14 54.772 55.719 -0.947 1
1 80 . 15 1 1 A 14 14 ASP CB C 14 41.322 40.872 0.450 1
1 81 . 15 1 1 A 14 14 ASP N N 14 120.493 123.763 -3.270 1
1 82 . 15 1 1 A 15 15 GLY H H 15 8.428 8.585 -0.157 1
1 83 . 15 1 1 A 15 15 GLY HA2 H 15 4.089 3.953 0.136 1
1 84 . 15 1 1 A 15 15 GLY HA3 H 15 3.874 3.969 -0.095 1
1 85 . 15 1 1 A 15 15 GLY C C 15 174.122 174.175 -0.053 1
1 86 . 15 1 1 A 15 15 GLY CA C 15 45.972 46.021 -0.049 1
1 87 . 15 1 1 A 15 15 GLY N N 15 108.670 106.456 2.214 1
1 88 . 15 1 1 A 16 16 ILE H H 16 7.727 7.790 -0.063 1
1 89 . 15 1 1 A 16 16 ILE HA H 16 4.705 4.656 0.049 1
1 99 . 15 1 1 A 16 16 ILE C C 16 175.807 175.082 0.725 1
1 100 . 15 1 1 A 16 16 ILE CA C 16 60.703 59.878 0.825 1
1 101 . 15 1 1 A 16 16 ILE CB C 16 38.509 39.942 -1.433 1
1 105 . 15 1 1 A 16 16 ILE N N 16 120.267 119.850 0.417 1
1 106 . 15 1 1 A 17 17 HIS H H 17 9.101 9.106 -0.005 1
1 107 . 15 1 1 A 17 17 HIS HA H 17 4.782 5.209 -0.427 1
1 112 . 15 1 1 A 17 17 HIS C C 17 173.051 174.005 -0.954 1
1 113 . 15 1 1 A 17 17 HIS CA C 17 55.353 53.934 1.419 1
1 114 . 15 1 1 A 17 17 HIS CB C 17 32.468 32.324 0.144 1
1 117 . 15 1 1 A 17 17 HIS N N 17 125.061 123.013 2.048 1
1 118 . 15 1 1 A 18 18 VAL H H 18 8.427 8.770 -0.343 1
1 119 . 15 1 1 A 18 18 VAL HA H 18 4.375 4.271 0.104 1
1 127 . 15 1 1 A 18 18 VAL C C 18 174.702 175.308 -0.606 1
1 128 . 15 1 1 A 18 18 VAL CA C 18 62.035 62.469 -0.434 1
1 129 . 15 1 1 A 18 18 VAL CB C 18 32.325 32.234 0.091 1
1 132 . 15 1 1 A 18 18 VAL N N 18 127.069 126.639 0.430 1
1 133 . 15 1 1 A 19 19 THR H H 19 9.272 8.301 0.971 1
1 134 . 15 1 1 A 19 19 THR HA H 19 4.512 4.864 -0.352 1
1 139 . 15 1 1 A 19 19 THR C C 19 172.784 173.248 -0.464 1
1 140 . 15 1 1 A 19 19 THR CA C 19 62.512 61.761 0.751 1
1 141 . 15 1 1 A 19 19 THR CB C 19 70.663 70.425 0.238 1
1 143 . 15 1 1 A 19 19 THR N N 19 126.619 122.260 4.359 1
1 144 . 15 1 1 A 20 20 ILE H H 20 8.737 9.203 -0.466 1
1 145 . 15 1 1 A 20 20 ILE HA H 20 4.870 4.654 0.216 1
1 155 . 15 1 1 A 20 20 ILE C C 20 175.315 174.606 0.709 1
1 156 . 15 1 1 A 20 20 ILE CA C 20 60.157 60.197 -0.040 1
1 157 . 15 1 1 A 20 20 ILE CB C 20 38.603 38.313 0.290 1
1 161 . 15 1 1 A 20 20 ILE N N 20 128.114 128.323 -0.209 1
1 162 . 15 1 1 A 21 21 LEU H H 21 8.902 8.836 0.066 1
1 163 . 15 1 1 A 21 21 LEU HA H 21 4.804 4.805 -0.001 1
1 173 . 15 1 1 A 21 21 LEU C C 21 175.565 175.753 -0.188 1
1 174 . 15 1 1 A 21 21 LEU CA C 21 52.731 53.850 -1.119 1
1 175 . 15 1 1 A 21 21 LEU CB C 21 43.947 43.407 0.540 1
1 179 . 15 1 1 A 21 21 LEU N N 21 125.457 128.582 -3.125 1
1 180 . 15 1 1 A 22 22 HIS H H 22 8.577 9.119 -0.542 1
1 181 . 15 1 1 A 22 22 HIS HA H 22 5.013 5.139 -0.126 1
1 186 . 15 1 1 A 22 22 HIS C C 22 174.258 174.838 -0.580 1
1 187 . 15 1 1 A 22 22 HIS CA C 22 55.880 54.190 1.690 1
1 188 . 15 1 1 A 22 22 HIS CB C 22 30.901 30.849 0.052 1
1 191 . 15 1 1 A 22 22 HIS N N 22 122.595 123.345 -0.750 1
1 192 . 15 1 1 A 23 23 LYS H H 23 8.712 9.504 -0.792 1
1 193 . 15 1 1 A 23 23 LYS HA H 23 4.880 4.992 -0.112 1
1 202 . 15 1 1 A 23 23 LYS C C 23 174.265 175.461 -1.196 1
1 203 . 15 1 1 A 23 23 LYS CA C 23 54.314 54.200 0.114 1
1 204 . 15 1 1 A 23 23 LYS CB C 23 36.068 36.049 0.019 1
1 208 . 15 1 1 A 23 23 LYS N N 23 120.814 120.837 -0.023 1
1 209 . 15 1 1 A 24 24 GLU H H 24 8.360 8.429 -0.069 1
1 210 . 15 1 1 A 24 24 GLU HA H 24 4.350 4.520 -0.170 1
1 215 . 15 1 1 A 24 24 GLU C C 24 177.843 176.813 1.030 1
1 216 . 15 1 1 A 24 24 GLU CA C 24 55.601 55.592 0.009 1
1 217 . 15 1 1 A 24 24 GLU CB C 24 30.512 30.984 -0.472 1
1 219 . 15 1 1 A 24 24 GLU N N 24 117.859 119.816 -1.957 1
1 220 . 15 1 1 A 25 25 GLU H H 25 9.146 8.828 0.318 1
1 221 . 15 1 1 A 25 25 GLU HA H 25 3.924 3.987 -0.063 1
1 226 . 15 1 1 A 25 25 GLU C C 25 177.809 177.704 0.105 1
1 227 . 15 1 1 A 25 25 GLU CA C 25 58.568 58.788 -0.220 1
1 228 . 15 1 1 A 25 25 GLU CB C 25 29.313 29.202 0.111 1
1 230 . 15 1 1 A 25 25 GLU N N 25 124.543 121.975 2.568 1
1 231 . 15 1 1 A 26 26 GLY H H 26 8.242 8.806 -0.564 1
1 232 . 15 1 1 A 26 26 GLY HA2 H 26 4.287 3.993 0.294 1
1 233 . 15 1 1 A 26 26 GLY HA3 H 26 3.407 3.996 -0.589 1
1 234 . 15 1 1 A 26 26 GLY C C 26 174.234 175.075 -0.841 1
1 235 . 15 1 1 A 26 26 GLY CA C 26 46.113 46.062 0.051 1
1 236 . 15 1 1 A 26 26 GLY N N 26 115.394 114.353 1.041 1
1 237 . 15 1 1 A 27 27 ALA H H 27 7.432 8.477 -1.045 1
1 238 . 15 1 1 A 27 27 ALA HA H 27 4.402 4.299 0.103 1
1 242 . 15 1 1 A 27 27 ALA C C 27 178.138 178.269 -0.131 1
1 243 . 15 1 1 A 27 27 ALA CA C 27 52.273 52.895 -0.622 1
1 244 . 15 1 1 A 27 27 ALA CB C 27 20.214 19.697 0.517 1
1 245 . 15 1 1 A 27 27 ALA N N 27 122.323 122.410 -0.087 1
1 246 . 15 1 1 A 28 28 GLY H H 28 8.624 7.922 0.702 1
1 247 . 15 1 1 A 28 28 GLY HA2 H 28 4.134 4.038 0.096 1
1 248 . 15 1 1 A 28 28 GLY HA3 H 28 3.953 4.077 -0.124 1
1 249 . 15 1 1 A 28 28 GLY C C 28 174.069 175.042 -0.973 1
1 250 . 15 1 1 A 28 28 GLY CA C 28 44.546 44.670 -0.124 1
1 251 . 15 1 1 A 28 28 GLY N N 28 107.593 105.392 2.201 1
1 252 . 15 1 1 A 29 29 LEU H H 29 7.934 8.515 -0.581 1
1 253 . 15 1 1 A 29 29 LEU HA H 29 4.059 4.335 -0.276 1
1 263 . 15 1 1 A 29 29 LEU C C 29 177.548 176.826 0.722 1
1 264 . 15 1 1 A 29 29 LEU CA C 29 56.298 56.307 -0.009 1
1 265 . 15 1 1 A 29 29 LEU CB C 29 41.940 42.661 -0.721 1
1 269 . 15 1 1 A 29 29 LEU N N 29 115.495 121.308 -5.813 1
1 270 . 15 1 1 A 30 30 GLY H H 30 8.669 7.800 0.869 1
1 271 . 15 1 1 A 30 30 GLY HA2 H 30 4.264 4.084 0.180 1
1 272 . 15 1 1 A 30 30 GLY HA3 H 30 4.001 4.130 -0.129 1
1 273 . 15 1 1 A 30 30 GLY C C 30 175.296 173.190 2.106 1
1 274 . 15 1 1 A 30 30 GLY CA C 30 46.368 45.067 1.301 1
1 275 . 15 1 1 A 30 30 GLY N N 30 103.121 105.991 -2.870 1
1 276 . 15 1 1 A 31 31 PHE H H 31 7.044 7.271 -0.227 1
1 277 . 15 1 1 A 31 31 PHE HA H 31 4.541 4.777 -0.236 1
1 285 . 15 1 1 A 31 31 PHE C C 31 171.141 172.339 -1.198 1
1 286 . 15 1 1 A 31 31 PHE CA C 31 55.704 55.160 0.544 1
1 287 . 15 1 1 A 31 31 PHE CB C 31 40.745 41.942 -1.197 1
1 293 . 15 1 1 A 31 31 PHE N N 31 115.404 115.298 0.106 1
1 294 . 15 1 1 A 32 32 SER H H 32 8.752 8.780 -0.028 1
1 295 . 15 1 1 A 32 32 SER HA H 32 4.990 4.840 0.150 1
1 298 . 15 1 1 A 32 32 SER C C 32 175.049 173.298 1.751 1
1 299 . 15 1 1 A 32 32 SER CA C 32 55.001 56.976 -1.975 1
1 300 . 15 1 1 A 32 32 SER CB C 32 67.170 66.461 0.709 1
1 301 . 15 1 1 A 32 32 SER N N 32 113.639 115.980 -2.341 1
1 302 . 15 1 1 A 33 33 LEU H H 33 8.639 8.295 0.344 1
1 303 . 15 1 1 A 33 33 LEU HA H 33 5.573 5.231 0.342 1
1 313 . 15 1 1 A 33 33 LEU C C 33 175.827 175.499 0.328 1
1 314 . 15 1 1 A 33 33 LEU CA C 33 53.620 53.759 -0.139 1
1 315 . 15 1 1 A 33 33 LEU CB C 33 45.399 43.873 1.526 1
1 319 . 15 1 1 A 33 33 LEU N N 33 118.936 123.335 -4.399 1
1 320 . 15 1 1 A 34 34 ALA H H 34 9.410 8.836 0.574 1
1 321 . 15 1 1 A 34 34 ALA HA H 34 4.749 5.136 -0.387 1
1 325 . 15 1 1 A 34 34 ALA C C 34 176.231 176.842 -0.611 1
1 326 . 15 1 1 A 34 34 ALA CA C 34 50.425 51.478 -1.053 1
1 327 . 15 1 1 A 34 34 ALA CB C 34 22.518 23.083 -0.565 1
1 328 . 15 1 1 A 34 34 ALA N N 34 124.395 121.891 2.504 1
1 329 . 15 1 1 A 35 35 GLY H H 35 8.130 8.717 -0.587 1
1 330 . 15 1 1 A 35 35 GLY HA2 H 35 4.712 4.137 0.575 1
1 331 . 15 1 1 A 35 35 GLY HA3 H 35 3.955 4.168 -0.213 1
1 332 . 15 1 1 A 35 35 GLY C C 35 174.750 173.018 1.732 1
1 333 . 15 1 1 A 35 35 GLY CA C 35 44.494 44.594 -0.100 1
1 334 . 15 1 1 A 35 35 GLY N N 35 103.650 107.137 -3.487 1
1 335 . 15 1 1 A 36 36 GLY H H 36 8.217 8.436 -0.219 1
1 336 . 15 1 1 A 36 36 GLY HA2 H 36 4.494 4.302 0.192 1
1 337 . 15 1 1 A 36 36 GLY HA3 H 36 3.836 4.327 -0.491 1
1 338 . 15 1 1 A 36 36 GLY C C 36 174.410 174.168 0.242 1
1 339 . 15 1 1 A 36 36 GLY CA C 36 45.462 45.495 -0.033 1
1 340 . 15 1 1 A 36 36 GLY N N 36 122.114 108.646 13.468 1
1 341 . 15 1 1 A 37 37 ALA H H 37 8.963 8.577 0.386 1
1 342 . 15 1 1 A 37 37 ALA HA H 37 3.998 4.077 -0.079 1
1 346 . 15 1 1 A 37 37 ALA C C 37 176.935 179.079 -2.144 1
1 347 . 15 1 1 A 37 37 ALA CA C 37 55.308 54.791 0.517 1
1 348 . 15 1 1 A 37 37 ALA CB C 37 18.822 18.400 0.422 1
1 349 . 15 1 1 A 37 37 ALA N N 37 123.418 123.236 0.182 1
1 350 . 15 1 1 A 38 38 ASP H H 38 10.586 8.227 2.359 1
1 351 . 15 1 1 A 38 38 ASP HA H 38 4.485 4.326 0.159 1
1 354 . 15 1 1 A 38 38 ASP C C 38 175.309 176.549 -1.240 1
1 355 . 15 1 1 A 38 38 ASP CA C 38 52.730 56.535 -3.805 1
1 356 . 15 1 1 A 38 38 ASP CB C 38 38.689 41.014 -2.325 1
1 357 . 15 1 1 A 38 38 ASP N N 38 111.480 118.208 -6.728 1
1 358 . 15 1 1 A 39 39 LEU H H 39 7.789 7.633 0.156 1
1 359 . 15 1 1 A 39 39 LEU HA H 39 4.699 4.315 0.384 1
1 369 . 15 1 1 A 39 39 LEU C C 39 176.377 178.028 -1.651 1
1 370 . 15 1 1 A 39 39 LEU CA C 39 52.952 54.364 -1.412 1
1 371 . 15 1 1 A 39 39 LEU CB C 39 43.294 41.998 1.296 1
1 375 . 15 1 1 A 39 39 LEU N N 39 122.545 121.210 1.335 1
1 376 . 15 1 1 A 40 40 GLU H H 40 8.331 8.618 -0.287 1
1 377 . 15 1 1 A 40 40 GLU HA H 40 3.978 4.083 -0.105 1
1 382 . 15 1 1 A 40 40 GLU C C 40 176.887 177.337 -0.450 1
1 383 . 15 1 1 A 40 40 GLU CA C 40 59.066 59.650 -0.584 1
1 384 . 15 1 1 A 40 40 GLU CB C 40 29.523 29.825 -0.302 1
1 386 . 15 1 1 A 40 40 GLU N N 40 118.036 120.567 -2.531 1
1 387 . 15 1 1 A 41 41 ASN H H 41 7.890 7.715 0.175 1
1 388 . 15 1 1 A 41 41 ASN HA H 41 4.820 4.973 -0.153 1
1 393 . 15 1 1 A 41 41 ASN CA C 41 52.316 52.037 0.279 1
1 394 . 15 1 1 A 41 41 ASN CB C 41 37.409 37.389 0.020 1
1 395 . 15 1 1 A 41 41 ASN N N 41 115.196 118.555 -3.359 1
1 397 . 15 1 1 A 42 42 LYS H H 42 7.943 8.514 -0.571 1
1 398 . 15 1 1 A 42 42 LYS HA H 42 4.328 4.471 -0.143 1
1 407 . 15 1 1 A 42 42 LYS C C 42 177.081 177.480 -0.399 1
1 408 . 15 1 1 A 42 42 LYS CA C 42 56.567 59.806 -3.239 1
1 409 . 15 1 1 A 42 42 LYS CB C 42 33.120 32.332 0.788 1
1 413 . 15 1 1 A 42 42 LYS N N 42 120.612 125.723 -5.111 1
1 414 . 15 1 1 A 43 43 VAL H H 43 7.456 7.607 -0.151 1
1 415 . 15 1 1 A 43 43 VAL HA H 43 4.059 4.279 -0.220 1
1 423 . 15 1 1 A 43 43 VAL CA C 43 61.330 61.534 -0.204 1
1 424 . 15 1 1 A 43 43 VAL CB C 43 32.819 32.480 0.339 1
1 427 . 15 1 1 A 43 43 VAL N N 43 118.284 118.531 -0.247 1
1 428 . 15 1 1 A 44 44 ILE H H 44 8.481 8.600 -0.119 1
1 429 . 15 1 1 A 44 44 ILE HA H 44 4.913 4.654 0.259 1
1 439 . 15 1 1 A 44 44 ILE C C 44 176.719 175.809 0.910 1
1 440 . 15 1 1 A 44 44 ILE CA C 44 59.946 62.089 -2.143 1
1 441 . 15 1 1 A 44 44 ILE CB C 44 35.784 38.425 -2.641 1
1 445 . 15 1 1 A 44 44 ILE N N 44 127.089 128.963 -1.874 1
1 446 . 15 1 1 A 45 45 THR H H 45 8.906 9.722 -0.816 1
1 447 . 15 1 1 A 45 45 THR HA H 45 5.400 5.120 0.280 1
1 452 . 15 1 1 A 45 45 THR CA C 45 58.528 59.297 -0.769 1
1 453 . 15 1 1 A 45 45 THR CB C 45 73.760 72.170 1.590 1
1 455 . 15 1 1 A 45 45 THR N N 45 116.832 116.501 0.331 1
1 456 . 15 1 1 A 46 46 VAL H H 46 8.336 8.482 -0.146 1
1 457 . 15 1 1 A 46 46 VAL HA H 46 4.059 4.321 -0.262 1
1 465 . 15 1 1 A 46 46 VAL C C 46 176.648 176.560 0.088 1
1 466 . 15 1 1 A 46 46 VAL CA C 46 63.058 63.023 0.035 1
1 467 . 15 1 1 A 46 46 VAL CB C 46 31.601 30.869 0.732 1
1 470 . 15 1 1 A 46 46 VAL N N 46 118.542 122.735 -4.193 1
1 471 . 15 1 1 A 47 47 HIS H H 47 9.382 8.985 0.397 1
1 472 . 15 1 1 A 47 47 HIS HA H 47 4.628 4.160 0.468 1
1 477 . 15 1 1 A 47 47 HIS C C 47 174.339 174.258 0.081 1
1 478 . 15 1 1 A 47 47 HIS CA C 47 57.764 60.148 -2.384 1
1 479 . 15 1 1 A 47 47 HIS CB C 47 31.453 30.517 0.936 1
1 482 . 15 1 1 A 47 47 HIS N N 47 133.900 128.938 4.962 1
1 483 . 15 1 1 A 48 48 ARG H H 48 7.135 7.410 -0.275 1
1 484 . 15 1 1 A 48 48 ARG HA H 48 4.360 4.670 -0.310 1
1 491 . 15 1 1 A 48 48 ARG C C 48 173.877 173.901 -0.024 1
1 492 . 15 1 1 A 48 48 ARG CA C 48 54.385 55.002 -0.617 1
1 493 . 15 1 1 A 48 48 ARG CB C 48 33.996 33.496 0.500 1
1 496 . 15 1 1 A 48 48 ARG N N 48 114.736 118.248 -3.512 1
1 497 . 15 1 1 A 49 49 VAL H H 49 8.690 8.899 -0.209 1
1 498 . 15 1 1 A 49 49 VAL HA H 49 4.015 4.341 -0.326 1
1 506 . 15 1 1 A 49 49 VAL C C 49 176.255 175.746 0.509 1
1 507 . 15 1 1 A 49 49 VAL CA C 49 61.882 61.477 0.405 1
1 508 . 15 1 1 A 49 49 VAL CB C 49 32.261 31.825 0.436 1
1 511 . 15 1 1 A 49 49 VAL N N 49 122.844 125.293 -2.449 1
1 512 . 15 1 1 A 50 50 PHE H H 50 7.866 8.566 -0.700 1
1 513 . 15 1 1 A 50 50 PHE HA H 50 4.866 4.450 0.416 1
1 521 . 15 1 1 A 50 50 PHE C C 50 174.847 176.099 -1.252 1
1 522 . 15 1 1 A 50 50 PHE CA C 50 54.596 57.509 -2.913 1
1 523 . 15 1 1 A 50 50 PHE CB C 50 36.558 39.232 -2.674 1
1 529 . 15 1 1 A 50 50 PHE N N 50 128.498 127.788 0.710 1
1 530 . 15 1 1 A 51 51 PRO HA H 51 4.386 4.572 -0.186 1
1 537 . 15 1 1 A 51 51 PRO C C 51 177.321 176.645 0.676 1
1 538 . 15 1 1 A 51 51 PRO CA C 51 64.381 64.594 -0.213 1
1 539 . 15 1 1 A 51 51 PRO CB C 51 31.773 31.993 -0.220 1
1 542 . 15 1 1 A 52 52 ASN H H 52 8.814 8.552 0.262 1
1 543 . 15 1 1 A 52 52 ASN HA H 52 4.496 4.991 -0.495 1
1 548 . 15 1 1 A 52 52 ASN C C 52 174.823 174.677 0.146 1
1 549 . 15 1 1 A 52 52 ASN CA C 52 54.719 52.220 2.499 1
1 550 . 15 1 1 A 52 52 ASN CB C 52 38.109 39.203 -1.094 1
1 551 . 15 1 1 A 52 52 ASN N N 52 116.145 116.126 0.019 1
1 553 . 15 1 1 A 53 53 GLY H H 53 7.730 8.216 -0.486 1
1 554 . 15 1 1 A 53 53 GLY HA2 H 53 4.430 4.284 0.146 1
1 555 . 15 1 1 A 53 53 GLY HA3 H 53 4.089 4.294 -0.205 1
1 556 . 15 1 1 A 53 53 GLY C C 53 174.810 173.991 0.819 1
1 557 . 15 1 1 A 53 53 GLY CA C 53 44.987 45.778 -0.791 1
1 558 . 15 1 1 A 53 53 GLY N N 53 106.196 110.669 -4.473 1
1 559 . 15 1 1 A 54 54 LEU H H 54 8.764 9.181 -0.417 1
1 560 . 15 1 1 A 54 54 LEU HA H 54 4.041 4.084 -0.043 1
1 570 . 15 1 1 A 54 54 LEU C C 54 179.712 178.566 1.146 1
1 571 . 15 1 1 A 54 54 LEU CA C 54 58.310 57.825 0.485 1
1 572 . 15 1 1 A 54 54 LEU CB C 54 42.390 41.917 0.473 1
1 576 . 15 1 1 A 54 54 LEU N N 54 118.836 120.036 -1.200 1
1 577 . 15 1 1 A 55 55 ALA H H 55 7.593 8.026 -0.433 1
1 578 . 15 1 1 A 55 55 ALA HA H 55 4.275 3.994 0.281 1
1 582 . 15 1 1 A 55 55 ALA C C 55 181.307 180.051 1.256 1
1 583 . 15 1 1 A 55 55 ALA CA C 55 54.825 55.688 -0.863 1
1 584 . 15 1 1 A 55 55 ALA CB C 55 18.345 18.646 -0.301 1
1 585 . 15 1 1 A 55 55 ALA N N 55 118.782 121.637 -2.855 1
1 586 . 15 1 1 A 56 56 SER H H 56 9.339 8.269 1.070 1
1 587 . 15 1 1 A 56 56 SER HA H 56 4.023 4.070 -0.047 1
1 589 . 15 1 1 A 56 56 SER C C 56 176.392 177.136 -0.744 1
1 590 . 15 1 1 A 56 56 SER CA C 56 60.984 60.984 0.000 1
1 591 . 15 1 1 A 56 56 SER CB C 56 62.987 63.067 -0.080 1
1 592 . 15 1 1 A 56 56 SER N N 56 117.631 112.614 5.017 1
1 593 . 15 1 1 A 57 57 GLN H H 57 7.942 7.592 0.350 1
1 594 . 15 1 1 A 57 57 GLN HA H 57 4.034 4.140 -0.106 1
1 601 . 15 1 1 A 57 57 GLN C C 57 177.400 178.168 -0.768 1
1 602 . 15 1 1 A 57 57 GLN CA C 57 58.362 58.769 -0.407 1
1 603 . 15 1 1 A 57 57 GLN CB C 57 28.801 28.191 0.610 1
1 605 . 15 1 1 A 57 57 GLN N N 57 118.162 121.714 -3.552 1
1 607 . 15 1 1 A 58 58 GLU H H 58 7.683 9.020 -1.337 1
1 608 . 15 1 1 A 58 58 GLU HA H 58 4.163 4.087 0.076 1
1 613 . 15 1 1 A 58 58 GLU C C 58 179.248 176.708 2.540 1
1 614 . 15 1 1 A 58 58 GLU CA C 58 59.559 58.805 0.754 1
1 615 . 15 1 1 A 58 58 GLU CB C 58 29.317 29.523 -0.206 1
1 617 . 15 1 1 A 58 58 GLU N N 58 119.877 119.195 0.682 1
1 618 . 15 1 1 A 59 59 GLY H H 59 7.446 8.012 -0.566 1
1 619 . 15 1 1 A 59 59 GLY HA2 H 59 4.100 3.972 0.128 1
1 620 . 15 1 1 A 59 59 GLY HA3 H 59 3.770 3.983 -0.213 1
1 621 . 15 1 1 A 59 59 GLY C C 59 175.432 174.971 0.461 1
1 622 . 15 1 1 A 59 59 GLY CA C 59 46.817 45.359 1.458 1
1 623 . 15 1 1 A 59 59 GLY N N 59 102.653 107.775 -5.122 1
1 624 . 15 1 1 A 60 60 THR H H 60 8.343 7.946 0.397 1
1 625 . 15 1 1 A 60 60 THR HA H 60 4.037 4.255 -0.218 1
1 630 . 15 1 1 A 60 60 THR C C 60 175.843 174.468 1.375 1
1 631 . 15 1 1 A 60 60 THR CA C 60 64.792 64.926 -0.134 1
1 632 . 15 1 1 A 60 60 THR CB C 60 69.325 69.665 -0.340 1
1 634 . 15 1 1 A 60 60 THR N N 60 113.863 112.909 0.954 1
1 635 . 15 1 1 A 61 61 ILE H H 61 8.802 7.525 1.277 1
1 636 . 15 1 1 A 61 61 ILE HA H 61 3.631 4.067 -0.436 1
1 646 . 15 1 1 A 61 61 ILE C C 61 174.198 174.440 -0.242 1
1 647 . 15 1 1 A 61 61 ILE CA C 61 62.938 60.927 2.011 1
1 648 . 15 1 1 A 61 61 ILE CB C 61 37.225 36.132 1.093 1
1 652 . 15 1 1 A 61 61 ILE N N 61 126.153 120.037 6.116 1
1 653 . 15 1 1 A 62 62 GLN H H 62 7.124 9.579 -2.455 1
1 654 . 15 1 1 A 62 62 GLN HA H 62 4.500 4.698 -0.198 1
1 661 . 15 1 1 A 62 62 GLN C C 62 174.556 175.333 -0.777 1
1 662 . 15 1 1 A 62 62 GLN CA C 62 53.364 54.183 -0.819 1
1 663 . 15 1 1 A 62 62 GLN CB C 62 32.196 31.649 0.547 1
1 665 . 15 1 1 A 62 62 GLN N N 62 123.730 126.720 -2.990 1
1 667 . 15 1 1 A 63 63 LYS H H 63 8.399 8.607 -0.208 1
1 668 . 15 1 1 A 63 63 LYS HA H 63 3.464 4.234 -0.770 1
1 677 . 15 1 1 A 63 63 LYS CA C 63 57.905 58.359 -0.454 1
1 678 . 15 1 1 A 63 63 LYS CB C 63 32.260 31.997 0.263 1
1 682 . 15 1 1 A 63 63 LYS N N 63 121.381 124.800 -3.419 1
1 683 . 15 1 1 A 64 64 GLY H H 64 9.265 8.524 0.741 1
1 684 . 15 1 1 A 64 64 GLY HA2 H 64 4.415 4.036 0.379 1
1 685 . 15 1 1 A 64 64 GLY HA3 H 64 3.639 4.049 -0.410 1
1 686 . 15 1 1 A 64 64 GLY CA C 64 44.881 45.070 -0.189 1
1 687 . 15 1 1 A 64 64 GLY N N 64 113.750 115.009 -1.259 1
1 688 . 15 1 1 A 65 65 ASN H H 65 7.594 8.298 -0.704 1
1 689 . 15 1 1 A 65 65 ASN HA H 65 4.798 4.853 -0.055 1
1 694 . 15 1 1 A 65 65 ASN C C 65 175.042 173.834 1.208 1
1 695 . 15 1 1 A 65 65 ASN CA C 65 53.047 53.125 -0.078 1
1 696 . 15 1 1 A 65 65 ASN CB C 65 38.153 40.176 -2.023 1
1 697 . 15 1 1 A 65 65 ASN N N 65 117.999 119.721 -1.722 1
1 699 . 15 1 1 A 66 66 GLU H H 66 8.538 8.507 0.031 1
1 700 . 15 1 1 A 66 66 GLU HA H 66 4.634 4.947 -0.313 1
1 705 . 15 1 1 A 66 66 GLU C C 66 176.620 174.873 1.747 1
1 706 . 15 1 1 A 66 66 GLU CA C 66 55.863 54.961 0.902 1
1 707 . 15 1 1 A 66 66 GLU CB C 66 30.899 32.354 -1.455 1
1 709 . 15 1 1 A 66 66 GLU N N 66 122.233 121.915 0.318 1
1 710 . 15 1 1 A 67 67 VAL H H 67 8.452 9.016 -0.564 1
1 711 . 15 1 1 A 67 67 VAL HA H 67 4.172 4.213 -0.041 1
1 719 . 15 1 1 A 67 67 VAL C C 67 174.641 175.463 -0.822 1
1 720 . 15 1 1 A 67 67 VAL CA C 67 61.856 62.754 -0.898 1
1 721 . 15 1 1 A 67 67 VAL CB C 67 31.066 31.965 -0.899 1
1 724 . 15 1 1 A 67 67 VAL N N 67 126.311 127.770 -1.459 1
1 725 . 15 1 1 A 68 68 LEU H H 68 9.000 8.954 0.046 1
1 726 . 15 1 1 A 68 68 LEU HA H 68 4.390 4.359 0.031 1
1 736 . 15 1 1 A 68 68 LEU C C 68 178.924 177.096 1.828 1
1 737 . 15 1 1 A 68 68 LEU CA C 68 56.990 56.061 0.929 1
1 738 . 15 1 1 A 68 68 LEU CB C 68 42.392 42.505 -0.113 1
1 742 . 15 1 1 A 68 68 LEU N N 68 127.175 128.952 -1.777 1
1 743 . 15 1 1 A 69 69 SER H H 69 7.666 7.824 -0.158 1
1 744 . 15 1 1 A 69 69 SER HA H 69 5.144 5.125 0.019 1
1 747 . 15 1 1 A 69 69 SER C C 69 172.722 172.304 0.418 1
1 748 . 15 1 1 A 69 69 SER CA C 69 57.606 57.402 0.204 1
1 749 . 15 1 1 A 69 69 SER CB C 69 64.511 66.200 -1.689 1
1 750 . 15 1 1 A 69 69 SER N N 69 110.346 109.322 1.024 1
1 751 . 15 1 1 A 70 70 ILE H H 70 7.965 8.496 -0.531 1
1 752 . 15 1 1 A 70 70 ILE HA H 70 4.548 4.876 -0.328 1
1 762 . 15 1 1 A 70 70 ILE C C 70 174.993 176.194 -1.201 1
1 763 . 15 1 1 A 70 70 ILE CA C 70 60.897 60.203 0.694 1
1 764 . 15 1 1 A 70 70 ILE CB C 70 41.186 40.505 0.681 1
1 768 . 15 1 1 A 70 70 ILE N N 70 119.579 121.216 -1.637 1
1 769 . 15 1 1 A 71 71 ASN H H 71 9.839 10.402 -0.563 1
1 770 . 15 1 1 A 71 71 ASN HA H 71 4.485 4.396 0.089 1
1 775 . 15 1 1 A 71 71 ASN C C 71 174.975 174.571 0.404 1
1 776 . 15 1 1 A 71 71 ASN CA C 71 54.085 54.207 -0.122 1
1 777 . 15 1 1 A 71 71 ASN CB C 71 36.255 37.369 -1.114 1
1 778 . 15 1 1 A 71 71 ASN N N 71 126.963 125.674 1.289 1
1 780 . 15 1 1 A 72 72 GLY H H 72 8.911 8.385 0.526 1
1 781 . 15 1 1 A 72 72 GLY HA2 H 72 4.149 3.913 0.236 1
1 782 . 15 1 1 A 72 72 GLY HA3 H 72 3.507 3.914 -0.407 1
1 783 . 15 1 1 A 72 72 GLY C C 72 173.594 174.226 -0.632 1
1 784 . 15 1 1 A 72 72 GLY CA C 72 45.162 45.110 0.052 1
1 785 . 15 1 1 A 72 72 GLY N N 72 103.020 105.115 -2.095 1
1 786 . 15 1 1 A 73 73 LYS H H 73 7.922 7.763 0.159 1
1 787 . 15 1 1 A 73 73 LYS HA H 73 4.485 4.250 0.235 1
1 796 . 15 1 1 A 73 73 LYS C C 73 175.036 175.608 -0.572 1
1 797 . 15 1 1 A 73 73 LYS CA C 73 54.719 55.887 -1.168 1
1 798 . 15 1 1 A 73 73 LYS CB C 73 32.137 32.374 -0.237 1
1 802 . 15 1 1 A 73 73 LYS N N 73 122.413 120.914 1.499 1
1 803 . 15 1 1 A 74 74 SER H H 74 8.585 8.797 -0.212 1
1 804 . 15 1 1 A 74 74 SER HA H 74 4.452 4.774 -0.322 1
1 807 . 15 1 1 A 74 74 SER C C 74 175.965 173.884 2.081 1
1 808 . 15 1 1 A 74 74 SER CA C 74 58.028 58.914 -0.886 1
1 809 . 15 1 1 A 74 74 SER CB C 74 63.799 63.794 0.005 1
1 810 . 15 1 1 A 74 74 SER N N 74 118.737 122.024 -3.287 1
1 811 . 15 1 1 A 75 75 LEU H H 75 8.015 8.331 -0.316 1
1 812 . 15 1 1 A 75 75 LEU HA H 75 4.661 4.439 0.222 1
1 822 . 15 1 1 A 75 75 LEU C C 75 178.117 177.456 0.661 1
1 823 . 15 1 1 A 75 75 LEU CA C 75 53.980 54.608 -0.628 1
1 824 . 15 1 1 A 75 75 LEU CB C 75 40.830 40.740 0.090 1
1 828 . 15 1 1 A 75 75 LEU N N 75 125.425 126.688 -1.263 1
1 829 . 15 1 1 A 76 76 LYS H H 76 8.099 8.211 -0.112 1
1 830 . 15 1 1 A 76 76 LYS HA H 76 4.210 4.418 -0.208 1
1 839 . 15 1 1 A 76 76 LYS C C 76 178.487 176.755 1.732 1
1 840 . 15 1 1 A 76 76 LYS CA C 76 58.010 55.456 2.554 1
1 841 . 15 1 1 A 76 76 LYS CB C 76 31.683 31.643 0.040 1
1 845 . 15 1 1 A 76 76 LYS N N 76 124.064 120.065 3.999 1
1 846 . 15 1 1 A 77 77 GLY H H 77 8.859 7.842 1.017 1
1 847 . 15 1 1 A 77 77 GLY HA2 H 77 4.110 4.057 0.053 1
1 848 . 15 1 1 A 77 77 GLY HA3 H 77 3.869 4.062 -0.193 1
1 849 . 15 1 1 A 77 77 GLY C C 77 174.335 174.835 -0.500 1
1 850 . 15 1 1 A 77 77 GLY CA C 77 46.232 44.933 1.299 1
1 851 . 15 1 1 A 77 77 GLY N N 77 115.659 108.707 6.952 1
1 852 . 15 1 1 A 78 78 THR H H 78 7.654 7.742 -0.088 1
1 853 . 15 1 1 A 78 78 THR HA H 78 4.624 4.150 0.474 1
1 858 . 15 1 1 A 78 78 THR C C 78 177.272 174.881 2.391 1
1 859 . 15 1 1 A 78 78 THR CA C 78 61.794 63.241 -1.447 1
1 860 . 15 1 1 A 78 78 THR CB C 78 70.595 69.169 1.426 1
1 862 . 15 1 1 A 78 78 THR N N 78 112.847 116.556 -3.709 1
1 863 . 15 1 1 A 79 79 THR H H 79 8.813 8.608 0.205 1
1 864 . 15 1 1 A 79 79 THR HA H 79 4.395 4.688 -0.293 1
1 869 . 15 1 1 A 79 79 THR C C 79 174.503 175.417 -0.914 1
1 870 . 15 1 1 A 79 79 THR CA C 79 61.724 60.819 0.905 1
1 871 . 15 1 1 A 79 79 THR CB C 79 71.007 71.280 -0.273 1
1 873 . 15 1 1 A 79 79 THR N N 79 114.123 117.903 -3.780 1
1 874 . 15 1 1 A 80 80 HIS H H 80 10.266 9.202 1.064 1
1 875 . 15 1 1 A 80 80 HIS HA H 80 4.331 4.200 0.131 1
1 880 . 15 1 1 A 80 80 HIS C C 80 177.075 176.965 0.110 1
1 881 . 15 1 1 A 80 80 HIS CA C 80 61.338 60.169 1.169 1
1 882 . 15 1 1 A 80 80 HIS CB C 80 28.651 30.320 -1.669 1
1 885 . 15 1 1 A 80 80 HIS N N 80 122.776 121.895 0.881 1
1 886 . 15 1 1 A 81 81 HIS H H 81 9.335 8.028 1.307 1
1 887 . 15 1 1 A 81 81 HIS HA H 81 4.078 4.065 0.013 1
1 892 . 15 1 1 A 81 81 HIS C C 81 178.269 176.694 1.575 1
1 893 . 15 1 1 A 81 81 HIS CA C 81 60.210 59.887 0.323 1
1 894 . 15 1 1 A 81 81 HIS CB C 81 29.569 30.002 -0.433 1
1 897 . 15 1 1 A 81 81 HIS N N 81 114.733 118.818 -4.085 1
1 898 . 15 1 1 A 82 82 ASP H H 82 7.741 8.014 -0.273 1
1 899 . 15 1 1 A 82 82 ASP HA H 82 4.452 3.930 0.522 1
1 902 . 15 1 1 A 82 82 ASP C C 82 178.683 178.739 -0.056 1
1 903 . 15 1 1 A 82 82 ASP CA C 82 57.148 57.159 -0.011 1
1 904 . 15 1 1 A 82 82 ASP CB C 82 39.522 40.349 -0.827 1
1 905 . 15 1 1 A 82 82 ASP N N 82 121.407 117.945 3.462 1
1 906 . 15 1 1 A 83 83 ALA H H 83 8.502 7.858 0.644 1
1 907 . 15 1 1 A 83 83 ALA HA H 83 3.939 4.126 -0.187 1
1 911 . 15 1 1 A 83 83 ALA C C 83 179.361 179.384 -0.023 1
1 912 . 15 1 1 A 83 83 ALA CA C 83 55.635 54.949 0.686 1
1 913 . 15 1 1 A 83 83 ALA CB C 83 18.124 19.027 -0.903 1
1 914 . 15 1 1 A 83 83 ALA N N 83 125.049 122.696 2.353 1
1 915 . 15 1 1 A 84 84 LEU H H 84 8.100 8.503 -0.403 1
1 916 . 15 1 1 A 84 84 LEU HA H 84 3.792 3.855 -0.063 1
1 926 . 15 1 1 A 84 84 LEU C C 84 180.173 179.272 0.901 1
1 927 . 15 1 1 A 84 84 LEU CA C 84 57.932 58.029 -0.097 1
1 928 . 15 1 1 A 84 84 LEU CB C 84 41.157 41.445 -0.288 1
1 932 . 15 1 1 A 84 84 LEU N N 84 117.139 118.198 -1.059 1
1 933 . 15 1 1 A 85 85 ALA H H 85 7.715 8.717 -1.002 1
1 934 . 15 1 1 A 85 85 ALA HA H 85 4.061 4.147 -0.086 1
1 938 . 15 1 1 A 85 85 ALA C C 85 180.380 179.926 0.454 1
1 939 . 15 1 1 A 85 85 ALA CA C 85 55.212 55.374 -0.162 1
1 940 . 15 1 1 A 85 85 ALA CB C 85 17.803 18.513 -0.710 1
1 941 . 15 1 1 A 85 85 ALA N N 85 122.448 121.406 1.042 1
1 942 . 15 1 1 A 86 86 ILE H H 86 7.669 7.775 -0.106 1
1 943 . 15 1 1 A 86 86 ILE HA H 86 3.678 3.669 0.009 1
1 953 . 15 1 1 A 86 86 ILE C C 86 178.692 178.323 0.369 1
1 954 . 15 1 1 A 86 86 ILE CA C 86 65.226 65.095 0.131 1
1 955 . 15 1 1 A 86 86 ILE CB C 86 38.099 37.784 0.315 1
1 959 . 15 1 1 A 86 86 ILE N N 86 121.804 117.883 3.921 1
1 960 . 15 1 1 A 87 87 LEU H H 87 7.922 8.525 -0.603 1
1 961 . 15 1 1 A 87 87 LEU HA H 87 3.903 3.940 -0.037 1
1 971 . 15 1 1 A 87 87 LEU C C 87 178.610 178.648 -0.038 1
1 972 . 15 1 1 A 87 87 LEU CA C 87 58.221 58.128 0.093 1
1 973 . 15 1 1 A 87 87 LEU CB C 87 42.344 41.675 0.669 1
1 977 . 15 1 1 A 87 87 LEU N N 87 121.947 121.009 0.938 1
1 978 . 15 1 1 A 88 88 ARG H H 88 8.317 8.747 -0.430 1
1 979 . 15 1 1 A 88 88 ARG HA H 88 4.060 4.021 0.039 1
1 986 . 15 1 1 A 88 88 ARG C C 88 180.698 177.803 2.895 1
1 987 . 15 1 1 A 88 88 ARG CA C 88 59.383 58.258 1.125 1
1 988 . 15 1 1 A 88 88 ARG CB C 88 30.055 30.065 -0.010 1
1 991 . 15 1 1 A 88 88 ARG N N 88 119.343 118.256 1.087 1
1 992 . 15 1 1 A 89 89 GLN H H 89 8.270 8.087 0.183 1
1 993 . 15 1 1 A 89 89 GLN HA H 89 4.122 4.082 0.040 1
1 1000 . 15 1 1 A 89 89 GLN C C 89 177.955 178.616 -0.661 1
1 1001 . 15 1 1 A 89 89 GLN CA C 89 58.714 58.588 0.126 1
1 1002 . 15 1 1 A 89 89 GLN CB C 89 28.160 27.769 0.391 1
1 1004 . 15 1 1 A 89 89 GLN N N 89 121.097 118.291 2.806 1
1 1006 . 15 1 1 A 90 90 ALA H H 90 7.558 7.636 -0.078 1
1 1007 . 15 1 1 A 90 90 ALA HA H 90 4.123 4.174 -0.051 1
1 1011 . 15 1 1 A 90 90 ALA C C 90 178.076 178.012 0.064 1
1 1012 . 15 1 1 A 90 90 ALA CA C 90 52.942 53.879 -0.937 1
1 1013 . 15 1 1 A 90 90 ALA CB C 90 18.015 18.306 -0.291 1
1 1014 . 15 1 1 A 90 90 ALA N N 90 119.652 121.435 -1.783 1
1 1015 . 15 1 1 A 91 91 ARG H H 91 7.768 7.639 0.129 1
1 1016 . 15 1 1 A 91 91 ARG HA H 91 4.065 4.343 -0.278 1
1 1022 . 15 1 1 A 91 91 ARG C C 91 177.858 177.730 0.128 1
1 1023 . 15 1 1 A 91 91 ARG CA C 91 58.573 56.407 2.166 1
1 1024 . 15 1 1 A 91 91 ARG CB C 91 30.384 30.494 -0.110 1
1 1027 . 15 1 1 A 91 91 ARG N N 91 118.081 116.588 1.493 1
1 1028 . 15 1 1 A 92 92 GLU H H 92 7.691 8.032 -0.341 1
1 1029 . 15 1 1 A 92 92 GLU HA H 92 4.123 4.152 -0.029 1
1 1034 . 15 1 1 A 92 92 GLU C C 92 174.459 176.676 -2.217 1
1 1035 . 15 1 1 A 92 92 GLU CA C 92 61.565 60.795 0.770 1
1 1036 . 15 1 1 A 92 92 GLU CB C 92 27.583 29.013 -1.430 1
1 1038 . 15 1 1 A 92 92 GLU N N 92 118.447 118.023 0.424 1
1 1039 . 15 1 1 A 93 93 PRO HA H 93 4.716 4.550 0.166 1
1 1046 . 15 1 1 A 93 93 PRO C C 93 176.221 176.301 -0.080 1
1 1047 . 15 1 1 A 93 93 PRO CA C 93 63.149 62.338 0.811 1
1 1048 . 15 1 1 A 93 93 PRO CB C 93 32.571 33.176 -0.605 1
1 1051 . 15 1 1 A 94 94 ARG H H 94 8.434 8.882 -0.448 1
1 1052 . 15 1 1 A 94 94 ARG HA H 94 4.232 4.528 -0.296 1
1 1058 . 15 1 1 A 94 94 ARG C C 94 175.323 175.966 -0.643 1
1 1059 . 15 1 1 A 94 94 ARG CA C 94 56.972 56.379 0.593 1
1 1060 . 15 1 1 A 94 94 ARG CB C 94 30.448 31.957 -1.509 1
1 1063 . 15 1 1 A 94 94 ARG N N 94 115.987 118.698 -2.711 1
1 1064 . 15 1 1 A 95 95 GLN H H 95 7.246 7.612 -0.366 1
1 1065 . 15 1 1 A 95 95 GLN HA H 95 5.251 5.262 -0.011 1
1 1072 . 15 1 1 A 95 95 GLN C C 95 174.786 173.709 1.077 1
1 1073 . 15 1 1 A 95 95 GLN CA C 95 54.209 54.597 -0.388 1
1 1074 . 15 1 1 A 95 95 GLN CB C 95 32.384 32.369 0.015 1
1 1076 . 15 1 1 A 95 95 GLN N N 95 115.998 119.953 -3.955 1
1 1078 . 15 1 1 A 96 96 ALA H H 96 8.739 8.088 0.651 1
1 1079 . 15 1 1 A 96 96 ALA HA H 96 5.412 5.194 0.218 1
1 1083 . 15 1 1 A 96 96 ALA C C 96 175.258 175.894 -0.636 1
1 1084 . 15 1 1 A 96 96 ALA CA C 96 50.355 50.629 -0.274 1
1 1085 . 15 1 1 A 96 96 ALA CB C 96 24.270 23.140 1.130 1
1 1086 . 15 1 1 A 96 96 ALA N N 96 126.197 125.099 1.098 1
1 1087 . 15 1 1 A 97 97 VAL H H 97 8.568 8.713 -0.145 1
1 1088 . 15 1 1 A 97 97 VAL HA H 97 4.804 4.720 0.084 1
1 1096 . 15 1 1 A 97 97 VAL C C 97 175.982 174.736 1.246 1
1 1097 . 15 1 1 A 97 97 VAL CA C 97 61.442 61.279 0.163 1
1 1098 . 15 1 1 A 97 97 VAL CB C 97 33.413 33.493 -0.080 1
1 1101 . 15 1 1 A 97 97 VAL N N 97 120.702 119.953 0.749 1
1 1102 . 15 1 1 A 98 98 ILE H H 98 9.753 8.786 0.967 1
1 1103 . 15 1 1 A 98 98 ILE HA H 98 4.826 5.054 -0.228 1
1 1113 . 15 1 1 A 98 98 ILE C C 98 174.292 174.588 -0.296 1
1 1114 . 15 1 1 A 98 98 ILE CA C 98 59.981 59.714 0.267 1
1 1115 . 15 1 1 A 98 98 ILE CB C 98 40.608 40.541 0.067 1
1 1119 . 15 1 1 A 98 98 ILE N N 98 131.738 127.843 3.895 1
1 1120 . 15 1 1 A 99 99 VAL H H 99 8.493 8.590 -0.097 1
1 1121 . 15 1 1 A 99 99 VAL HA H 99 5.201 4.755 0.446 1
1 1129 . 15 1 1 A 99 99 VAL C C 99 176.557 175.411 1.146 1
1 1130 . 15 1 1 A 99 99 VAL CA C 99 61.495 61.030 0.465 1
1 1131 . 15 1 1 A 99 99 VAL CB C 99 32.327 32.591 -0.264 1
1 1134 . 15 1 1 A 99 99 VAL N N 99 129.537 129.363 0.174 1
1 1135 . 15 1 1 A 100 100 THR H H 100 9.050 8.545 0.505 1
1 1136 . 15 1 1 A 100 100 THR HA H 100 5.606 5.164 0.442 1
1 1141 . 15 1 1 A 100 100 THR C C 100 172.815 173.267 -0.452 1
1 1142 . 15 1 1 A 100 100 THR CA C 100 59.049 59.399 -0.350 1
1 1143 . 15 1 1 A 100 100 THR CB C 100 73.966 71.885 2.081 1
1 1145 . 15 1 1 A 100 100 THR N N 100 117.469 117.613 -0.144 1
1 1146 . 15 1 1 A 101 101 ARG H H 101 8.773 8.781 -0.008 1
1 1147 . 15 1 1 A 101 101 ARG HA H 101 4.989 4.768 0.221 1
1 1155 . 15 1 1 A 101 101 ARG C C 101 174.738 175.010 -0.272 1
1 1156 . 15 1 1 A 101 101 ARG CA C 101 54.825 54.016 0.809 1
1 1157 . 15 1 1 A 101 101 ARG CB C 101 34.636 32.749 1.887 1
1 1160 . 15 1 1 A 101 101 ARG N N 101 117.532 121.026 -3.494 1
1 1162 . 15 1 1 A 102 102 LYS H H 102 8.616 8.017 0.599 1
1 1163 . 15 1 1 A 102 102 LYS HA H 102 4.232 4.630 -0.398 1
1 1171 . 15 1 1 A 102 102 LYS C C 102 175.935 175.187 0.748 1
1 1172 . 15 1 1 A 102 102 LYS CA C 102 56.549 56.298 0.251 1
1 1173 . 15 1 1 A 102 102 LYS CB C 102 33.266 33.176 0.090 1
1 1177 . 15 1 1 A 102 102 LYS N N 102 126.899 122.558 4.341 1
1 1178 . 15 1 1 A 103 103 LEU H H 103 8.424 8.557 -0.133 1
1 1179 . 15 1 1 A 103 103 LEU HA H 103 4.540 4.817 -0.277 1
1 1189 . 15 1 1 A 103 103 LEU C C 103 176.956 176.265 0.691 1
1 1190 . 15 1 1 A 103 103 LEU CA C 103 54.755 53.264 1.491 1
1 1191 . 15 1 1 A 103 103 LEU CB C 103 42.929 44.651 -1.722 1
1 1195 . 15 1 1 A 103 103 LEU N N 103 126.246 127.585 -1.339 1
1 1196 . 15 1 1 A 104 104 THR H H 104 8.201 8.198 0.003 1
1 1197 . 15 1 1 A 104 104 THR HA H 104 4.624 4.379 0.245 1
1 1202 . 15 1 1 A 104 104 THR C C 104 172.954 175.001 -2.047 1
1 1203 . 15 1 1 A 104 104 THR CA C 104 59.483 60.822 -1.339 1
1 1204 . 15 1 1 A 104 104 THR CB C 104 69.761 68.802 0.959 1
1 1206 . 15 1 1 A 104 104 THR N N 104 117.263 113.936 3.327 1
1 1207 . 15 1 1 A 105 105 PRO HA H 105 4.399 4.333 0.066 1
1 1213 . 15 1 1 A 105 105 PRO CA C 105 63.495 65.842 -2.347 1
1 1214 . 15 1 1 A 105 105 PRO CB C 105 32.096 31.691 0.405 1
1 1217 . 15 1 1 A 106 106 GLU H H 106 8.519 8.069 0.450 1
1 1218 . 15 1 1 A 106 106 GLU HA H 106 4.197 4.141 0.056 1
1 1221 . 15 1 1 A 106 106 GLU C C 106 176.110 175.279 0.831 1
1 1222 . 15 1 1 A 106 106 GLU CA C 106 56.743 58.421 -1.678 1
1 1223 . 15 1 1 A 106 106 GLU CB C 106 30.137 28.616 1.521 1
1 1225 . 15 1 1 A 106 106 GLU N N 106 120.609 116.811 3.798 1
1 1226 . 15 1 1 A 107 107 ALA H H 107 8.241 8.088 0.153 1
1 1227 . 15 1 1 A 107 107 ALA HA H 107 4.317 4.875 -0.558 1
1 1231 . 15 1 1 A 107 107 ALA C C 107 177.299 175.733 1.566 1
1 1232 . 15 1 1 A 107 107 ALA CA C 107 52.203 50.902 1.301 1
1 1233 . 15 1 1 A 107 107 ALA CB C 107 19.392 22.350 -2.958 1
1 1234 . 15 1 1 A 107 107 ALA N N 107 124.849 122.034 2.815 1
1 1235 . 15 1 1 A 108 108 MET H H 108 8.284 8.816 -0.532 1
1 1236 . 15 1 1 A 108 108 MET HA H 108 4.792 4.962 -0.170 1
1 1244 . 15 1 1 A 108 108 MET C C 108 174.337 174.108 0.229 1
1 1245 . 15 1 1 A 108 108 MET CA C 108 53.258 52.990 0.268 1
1 1246 . 15 1 1 A 108 108 MET CB C 108 32.608 36.074 -3.466 1
1 1249 . 15 1 1 A 108 108 MET N N 108 121.025 120.170 0.855 1
1 1250 . 15 1 1 A 109 109 PRO HA H 109 4.408 4.773 -0.365 1
1 1256 . 15 1 1 A 109 109 PRO C C 109 176.412 176.033 0.379 1
1 1257 . 15 1 1 A 109 109 PRO CA C 109 63.290 62.614 0.676 1
1 1258 . 15 1 1 A 109 109 PRO CB C 109 32.077 32.414 -0.337 1
1 1261 . 15 1 1 A 110 110 ASP H H 110 8.417 8.443 -0.026 1
1 1262 . 15 1 1 A 110 110 ASP HA H 110 4.573 5.203 -0.630 1
1 1265 . 15 1 1 A 110 110 ASP C C 110 176.508 175.627 0.881 1
1 1266 . 15 1 1 A 110 110 ASP CA C 110 54.085 52.728 1.357 1
1 1267 . 15 1 1 A 110 110 ASP CB C 110 41.075 43.206 -2.131 1
1 1268 . 15 1 1 A 110 110 ASP N N 110 120.239 118.574 1.665 1
1 1269 . 15 1 1 A 111 111 LEU H H 111 8.279 8.536 -0.257 1
1 1270 . 15 1 1 A 111 111 LEU HA H 111 4.319 4.409 -0.090 1
1 1280 . 15 1 1 A 111 111 LEU C C 111 177.551 177.043 0.508 1
1 1281 . 15 1 1 A 111 111 LEU CA C 111 55.581 54.522 1.059 1
1 1282 . 15 1 1 A 111 111 LEU CB C 111 42.360 42.367 -0.007 1
1 1286 . 15 1 1 A 111 111 LEU N N 111 123.318 123.793 -0.475 1
1 1287 . 15 1 1 A 112 112 ASN H H 112 8.487 8.565 -0.078 1
1 1288 . 15 1 1 A 112 112 ASN HA H 112 4.725 4.994 -0.269 1
1 1293 . 15 1 1 A 112 112 ASN C C 112 175.454 175.123 0.331 1
1 1294 . 15 1 1 A 112 112 ASN CA C 112 53.610 53.363 0.247 1
1 1295 . 15 1 1 A 112 112 ASN CB C 112 39.116 40.102 -0.986 1
1 1296 . 15 1 1 A 112 112 ASN N N 112 118.752 119.244 -0.492 1
1 1298 . 15 1 1 A 115 115 GLY H H 115 8.205 8.436 -0.231 1
1 1299 . 15 1 1 A 115 115 GLY HA2 H 115 4.126 4.300 -0.174 1
1 1300 . 15 1 1 A 115 115 GLY HA3 H 115 4.126 4.300 -0.174 1
1 1301 . 15 1 1 A 115 115 GLY CA C 115 44.727 44.986 -0.259 1
1 1302 . 15 1 1 A 116 116 PRO HA H 116 4.485 4.713 -0.228 1
1 1309 . 15 1 1 A 116 116 PRO CA C 116 63.298 62.519 0.779 1
1 1310 . 15 1 1 A 116 116 PRO CB C 116 32.077 33.369 -1.292 1
1 1313 . 15 1 1 A 117 117 SER H H 117 8.532 8.736 -0.204 1
1 1 . 16 1 1 A 7 7 GLY HA2 H 7 3.960 4.463 -0.503 1
1 2 . 16 1 1 A 7 7 GLY HA3 H 7 3.960 4.464 -0.504 1
1 3 . 16 1 1 A 7 7 GLY C C 7 174.009 172.460 1.549 1
1 4 . 16 1 1 A 7 7 GLY CA C 7 45.374 45.390 -0.016 1
1 5 . 16 1 1 A 8 8 ALA H H 8 8.163 8.496 -0.333 1
1 6 . 16 1 1 A 8 8 ALA HA H 8 4.381 4.758 -0.377 1
1 10 . 16 1 1 A 8 8 ALA C C 8 178.078 176.237 1.841 1
1 11 . 16 1 1 A 8 8 ALA CA C 8 52.677 51.386 1.291 1
1 12 . 16 1 1 A 8 8 ALA CB C 8 19.368 22.275 -2.907 1
1 13 . 16 1 1 A 8 8 ALA N N 8 123.721 122.738 0.983 1
1 14 . 16 1 1 A 9 9 THR H H 9 8.142 8.454 -0.312 1
1 15 . 16 1 1 A 9 9 THR HA H 9 4.353 3.869 0.484 1
1 20 . 16 1 1 A 9 9 THR C C 9 174.597 173.344 1.253 1
1 21 . 16 1 1 A 9 9 THR CA C 9 62.093 62.456 -0.363 1
1 22 . 16 1 1 A 9 9 THR CB C 9 69.948 66.973 2.975 1
1 24 . 16 1 1 A 9 9 THR N N 9 113.761 110.956 2.805 1
1 25 . 16 1 1 A 10 10 LEU H H 10 8.218 7.677 0.541 1
1 26 . 16 1 1 A 10 10 LEU HA H 10 4.169 4.800 -0.631 1
1 36 . 16 1 1 A 10 10 LEU C C 10 176.110 175.420 0.690 1
1 37 . 16 1 1 A 10 10 LEU CA C 10 61.099 54.385 6.714 1
1 38 . 16 1 1 A 10 10 LEU CB C 10 38.686 43.558 -4.872 1
1 42 . 16 1 1 A 10 10 LEU N N 10 123.516 121.401 2.115 1
1 43 . 16 1 1 A 11 11 LYS H H 11 8.496 8.849 -0.353 1
1 44 . 16 1 1 A 11 11 LYS HA H 11 4.891 5.040 -0.149 1
1 49 . 16 1 1 A 11 11 LYS C C 11 175.794 175.985 -0.191 1
1 50 . 16 1 1 A 11 11 LYS CA C 11 55.652 55.458 0.194 1
1 51 . 16 1 1 A 11 11 LYS CB C 11 29.444 34.220 -4.776 1
1 52 . 16 1 1 A 11 11 LYS N N 11 125.141 124.499 0.642 1
1 53 . 16 1 1 A 12 12 GLN HA H 12 4.315 4.543 -0.228 1
1 54 . 16 1 1 A 12 12 GLN C C 12 176.300 175.048 1.252 1
1 55 . 16 1 1 A 12 12 GLN CA C 12 56.286 55.637 0.649 1
1 56 . 16 1 1 A 12 12 GLN CB C 12 32.901 30.470 2.431 1
1 57 . 16 1 1 A 13 13 LEU H H 13 8.410 9.396 -0.986 1
1 58 . 16 1 1 A 13 13 LEU HA H 13 4.348 3.967 0.381 1
1 67 . 16 1 1 A 13 13 LEU C C 13 177.120 175.700 1.420 1
1 68 . 16 1 1 A 13 13 LEU CA C 13 55.142 56.309 -1.167 1
1 69 . 16 1 1 A 13 13 LEU CB C 13 42.352 41.220 1.132 1
1 73 . 16 1 1 A 13 13 LEU N N 13 124.340 128.312 -3.972 1
1 74 . 16 1 1 A 14 14 ASP H H 14 8.250 8.631 -0.381 1
1 75 . 16 1 1 A 14 14 ASP HA H 14 4.540 4.161 0.379 1
1 78 . 16 1 1 A 14 14 ASP C C 14 176.769 175.179 1.590 1
1 79 . 16 1 1 A 14 14 ASP CA C 14 54.772 54.932 -0.160 1
1 80 . 16 1 1 A 14 14 ASP CB C 14 41.322 39.211 2.111 1
1 81 . 16 1 1 A 14 14 ASP N N 14 120.493 119.369 1.124 1
1 82 . 16 1 1 A 15 15 GLY H H 15 8.428 8.188 0.240 1
1 83 . 16 1 1 A 15 15 GLY HA2 H 15 4.089 4.067 0.022 1
1 84 . 16 1 1 A 15 15 GLY HA3 H 15 3.874 4.097 -0.223 1
1 85 . 16 1 1 A 15 15 GLY C C 15 174.122 172.232 1.890 1
1 86 . 16 1 1 A 15 15 GLY CA C 15 45.972 45.176 0.796 1
1 87 . 16 1 1 A 15 15 GLY N N 15 108.670 107.475 1.195 1
1 88 . 16 1 1 A 16 16 ILE H H 16 7.727 8.867 -1.140 1
1 89 . 16 1 1 A 16 16 ILE HA H 16 4.705 4.609 0.096 1
1 99 . 16 1 1 A 16 16 ILE C C 16 175.807 174.877 0.930 1
1 100 . 16 1 1 A 16 16 ILE CA C 16 60.703 59.238 1.465 1
1 101 . 16 1 1 A 16 16 ILE CB C 16 38.509 40.286 -1.777 1
1 105 . 16 1 1 A 16 16 ILE N N 16 120.267 126.736 -6.469 1
1 106 . 16 1 1 A 17 17 HIS H H 17 9.101 8.133 0.968 1
1 107 . 16 1 1 A 17 17 HIS HA H 17 4.782 5.043 -0.261 1
1 112 . 16 1 1 A 17 17 HIS C C 17 173.051 174.709 -1.658 1
1 113 . 16 1 1 A 17 17 HIS CA C 17 55.353 54.462 0.891 1
1 114 . 16 1 1 A 17 17 HIS CB C 17 32.468 32.961 -0.493 1
1 117 . 16 1 1 A 17 17 HIS N N 17 125.061 123.662 1.399 1
1 118 . 16 1 1 A 18 18 VAL H H 18 8.427 8.800 -0.373 1
1 119 . 16 1 1 A 18 18 VAL HA H 18 4.375 4.048 0.327 1
1 127 . 16 1 1 A 18 18 VAL C C 18 174.702 175.449 -0.747 1
1 128 . 16 1 1 A 18 18 VAL CA C 18 62.035 63.611 -1.576 1
1 129 . 16 1 1 A 18 18 VAL CB C 18 32.325 31.930 0.395 1
1 132 . 16 1 1 A 18 18 VAL N N 18 127.069 125.511 1.558 1
1 133 . 16 1 1 A 19 19 THR H H 19 9.272 8.444 0.828 1
1 134 . 16 1 1 A 19 19 THR HA H 19 4.512 4.921 -0.409 1
1 139 . 16 1 1 A 19 19 THR C C 19 172.784 173.658 -0.874 1
1 140 . 16 1 1 A 19 19 THR CA C 19 62.512 62.073 0.439 1
1 141 . 16 1 1 A 19 19 THR CB C 19 70.663 69.939 0.724 1
1 143 . 16 1 1 A 19 19 THR N N 19 126.619 122.942 3.677 1
1 144 . 16 1 1 A 20 20 ILE H H 20 8.737 9.298 -0.561 1
1 145 . 16 1 1 A 20 20 ILE HA H 20 4.870 4.606 0.264 1
1 155 . 16 1 1 A 20 20 ILE C C 20 175.315 174.377 0.938 1
1 156 . 16 1 1 A 20 20 ILE CA C 20 60.157 60.440 -0.283 1
1 157 . 16 1 1 A 20 20 ILE CB C 20 38.603 38.704 -0.101 1
1 161 . 16 1 1 A 20 20 ILE N N 20 128.114 128.588 -0.474 1
1 162 . 16 1 1 A 21 21 LEU H H 21 8.902 8.767 0.135 1
1 163 . 16 1 1 A 21 21 LEU HA H 21 4.804 4.924 -0.120 1
1 173 . 16 1 1 A 21 21 LEU C C 21 175.565 175.166 0.399 1
1 174 . 16 1 1 A 21 21 LEU CA C 21 52.731 53.509 -0.778 1
1 175 . 16 1 1 A 21 21 LEU CB C 21 43.947 42.672 1.275 1
1 179 . 16 1 1 A 21 21 LEU N N 21 125.457 128.367 -2.910 1
1 180 . 16 1 1 A 22 22 HIS H H 22 8.577 8.961 -0.384 1
1 181 . 16 1 1 A 22 22 HIS HA H 22 5.013 5.000 0.013 1
1 186 . 16 1 1 A 22 22 HIS C C 22 174.258 174.937 -0.679 1
1 187 . 16 1 1 A 22 22 HIS CA C 22 55.880 55.082 0.798 1
1 188 . 16 1 1 A 22 22 HIS CB C 22 30.901 29.649 1.252 1
1 191 . 16 1 1 A 22 22 HIS N N 22 122.595 124.050 -1.455 1
1 192 . 16 1 1 A 23 23 LYS H H 23 8.712 9.976 -1.264 1
1 193 . 16 1 1 A 23 23 LYS HA H 23 4.880 5.153 -0.273 1
1 202 . 16 1 1 A 23 23 LYS C C 23 174.265 175.337 -1.072 1
1 203 . 16 1 1 A 23 23 LYS CA C 23 54.314 53.974 0.340 1
1 204 . 16 1 1 A 23 23 LYS CB C 23 36.068 36.298 -0.230 1
1 208 . 16 1 1 A 23 23 LYS N N 23 120.814 120.825 -0.011 1
1 209 . 16 1 1 A 24 24 GLU H H 24 8.360 8.472 -0.112 1
1 210 . 16 1 1 A 24 24 GLU HA H 24 4.350 4.638 -0.288 1
1 215 . 16 1 1 A 24 24 GLU C C 24 177.843 176.931 0.912 1
1 216 . 16 1 1 A 24 24 GLU CA C 24 55.601 54.708 0.893 1
1 217 . 16 1 1 A 24 24 GLU CB C 24 30.512 31.405 -0.893 1
1 219 . 16 1 1 A 24 24 GLU N N 24 117.859 119.340 -1.481 1
1 220 . 16 1 1 A 25 25 GLU H H 25 9.146 8.837 0.309 1
1 221 . 16 1 1 A 25 25 GLU HA H 25 3.924 4.044 -0.120 1
1 226 . 16 1 1 A 25 25 GLU C C 25 177.809 177.567 0.242 1
1 227 . 16 1 1 A 25 25 GLU CA C 25 58.568 58.750 -0.182 1
1 228 . 16 1 1 A 25 25 GLU CB C 25 29.313 29.079 0.234 1
1 230 . 16 1 1 A 25 25 GLU N N 25 124.543 121.677 2.866 1
1 231 . 16 1 1 A 26 26 GLY H H 26 8.242 8.837 -0.595 1
1 232 . 16 1 1 A 26 26 GLY HA2 H 26 4.287 4.030 0.257 1
1 233 . 16 1 1 A 26 26 GLY HA3 H 26 3.407 4.031 -0.624 1
1 234 . 16 1 1 A 26 26 GLY C C 26 174.234 175.099 -0.865 1
1 235 . 16 1 1 A 26 26 GLY CA C 26 46.113 46.499 -0.386 1
1 236 . 16 1 1 A 26 26 GLY N N 26 115.394 114.071 1.323 1
1 237 . 16 1 1 A 27 27 ALA H H 27 7.432 8.120 -0.688 1
1 238 . 16 1 1 A 27 27 ALA HA H 27 4.402 4.306 0.096 1
1 242 . 16 1 1 A 27 27 ALA C C 27 178.138 177.948 0.190 1
1 243 . 16 1 1 A 27 27 ALA CA C 27 52.273 52.766 -0.493 1
1 244 . 16 1 1 A 27 27 ALA CB C 27 20.214 19.846 0.368 1
1 245 . 16 1 1 A 27 27 ALA N N 27 122.323 122.409 -0.086 1
1 246 . 16 1 1 A 28 28 GLY H H 28 8.624 7.820 0.804 1
1 247 . 16 1 1 A 28 28 GLY HA2 H 28 4.134 4.080 0.054 1
1 248 . 16 1 1 A 28 28 GLY HA3 H 28 3.953 4.118 -0.165 1
1 249 . 16 1 1 A 28 28 GLY C C 28 174.069 174.775 -0.706 1
1 250 . 16 1 1 A 28 28 GLY CA C 28 44.546 44.346 0.200 1
1 251 . 16 1 1 A 28 28 GLY N N 28 107.593 105.511 2.082 1
1 252 . 16 1 1 A 29 29 LEU H H 29 7.934 8.542 -0.608 1
1 253 . 16 1 1 A 29 29 LEU HA H 29 4.059 4.369 -0.310 1
1 263 . 16 1 1 A 29 29 LEU C C 29 177.548 176.902 0.646 1
1 264 . 16 1 1 A 29 29 LEU CA C 29 56.298 56.168 0.130 1
1 265 . 16 1 1 A 29 29 LEU CB C 29 41.940 42.727 -0.787 1
1 269 . 16 1 1 A 29 29 LEU N N 29 115.495 121.196 -5.701 1
1 270 . 16 1 1 A 30 30 GLY H H 30 8.669 7.999 0.670 1
1 271 . 16 1 1 A 30 30 GLY HA2 H 30 4.264 4.106 0.158 1
1 272 . 16 1 1 A 30 30 GLY HA3 H 30 4.001 4.198 -0.197 1
1 273 . 16 1 1 A 30 30 GLY C C 30 175.296 173.100 2.196 1
1 274 . 16 1 1 A 30 30 GLY CA C 30 46.368 44.984 1.384 1
1 275 . 16 1 1 A 30 30 GLY N N 30 103.121 105.960 -2.839 1
1 276 . 16 1 1 A 31 31 PHE H H 31 7.044 7.316 -0.272 1
1 277 . 16 1 1 A 31 31 PHE HA H 31 4.541 4.410 0.131 1
1 285 . 16 1 1 A 31 31 PHE C C 31 171.141 172.390 -1.249 1
1 286 . 16 1 1 A 31 31 PHE CA C 31 55.704 55.225 0.479 1
1 287 . 16 1 1 A 31 31 PHE CB C 31 40.745 41.745 -1.000 1
1 293 . 16 1 1 A 31 31 PHE N N 31 115.404 114.883 0.521 1
1 294 . 16 1 1 A 32 32 SER H H 32 8.752 8.871 -0.119 1
1 295 . 16 1 1 A 32 32 SER HA H 32 4.990 4.863 0.127 1
1 298 . 16 1 1 A 32 32 SER C C 32 175.049 172.518 2.531 1
1 299 . 16 1 1 A 32 32 SER CA C 32 55.001 55.667 -0.666 1
1 300 . 16 1 1 A 32 32 SER CB C 32 67.170 66.470 0.700 1
1 301 . 16 1 1 A 32 32 SER N N 32 113.639 114.860 -1.221 1
1 302 . 16 1 1 A 33 33 LEU H H 33 8.639 8.496 0.143 1
1 303 . 16 1 1 A 33 33 LEU HA H 33 5.573 5.192 0.381 1
1 313 . 16 1 1 A 33 33 LEU C C 33 175.827 175.567 0.260 1
1 314 . 16 1 1 A 33 33 LEU CA C 33 53.620 53.550 0.070 1
1 315 . 16 1 1 A 33 33 LEU CB C 33 45.399 44.486 0.913 1
1 319 . 16 1 1 A 33 33 LEU N N 33 118.936 123.249 -4.313 1
1 320 . 16 1 1 A 34 34 ALA H H 34 9.410 9.019 0.391 1
1 321 . 16 1 1 A 34 34 ALA HA H 34 4.749 5.191 -0.442 1
1 325 . 16 1 1 A 34 34 ALA C C 34 176.231 176.788 -0.557 1
1 326 . 16 1 1 A 34 34 ALA CA C 34 50.425 51.325 -0.900 1
1 327 . 16 1 1 A 34 34 ALA CB C 34 22.518 22.960 -0.442 1
1 328 . 16 1 1 A 34 34 ALA N N 34 124.395 122.047 2.348 1
1 329 . 16 1 1 A 35 35 GLY H H 35 8.130 8.768 -0.638 1
1 330 . 16 1 1 A 35 35 GLY HA2 H 35 4.712 4.169 0.543 1
1 331 . 16 1 1 A 35 35 GLY HA3 H 35 3.955 4.176 -0.221 1
1 332 . 16 1 1 A 35 35 GLY C C 35 174.750 173.036 1.714 1
1 333 . 16 1 1 A 35 35 GLY CA C 35 44.494 44.999 -0.505 1
1 334 . 16 1 1 A 35 35 GLY N N 35 103.650 107.699 -4.049 1
1 335 . 16 1 1 A 36 36 GLY H H 36 8.217 8.018 0.199 1
1 336 . 16 1 1 A 36 36 GLY HA2 H 36 4.494 4.345 0.149 1
1 337 . 16 1 1 A 36 36 GLY HA3 H 36 3.836 4.396 -0.560 1
1 338 . 16 1 1 A 36 36 GLY C C 36 174.410 174.239 0.171 1
1 339 . 16 1 1 A 36 36 GLY CA C 36 45.462 45.887 -0.425 1
1 340 . 16 1 1 A 36 36 GLY N N 36 122.114 108.043 14.071 1
1 341 . 16 1 1 A 37 37 ALA H H 37 8.963 8.712 0.251 1
1 342 . 16 1 1 A 37 37 ALA HA H 37 3.998 4.084 -0.086 1
1 346 . 16 1 1 A 37 37 ALA C C 37 176.935 179.160 -2.225 1
1 347 . 16 1 1 A 37 37 ALA CA C 37 55.308 54.610 0.698 1
1 348 . 16 1 1 A 37 37 ALA CB C 37 18.822 18.249 0.573 1
1 349 . 16 1 1 A 37 37 ALA N N 37 123.418 122.620 0.798 1
1 350 . 16 1 1 A 38 38 ASP H H 38 10.586 8.231 2.355 1
1 351 . 16 1 1 A 38 38 ASP HA H 38 4.485 4.335 0.150 1
1 354 . 16 1 1 A 38 38 ASP C C 38 175.309 176.421 -1.112 1
1 355 . 16 1 1 A 38 38 ASP CA C 38 52.730 56.423 -3.693 1
1 356 . 16 1 1 A 38 38 ASP CB C 38 38.689 41.127 -2.438 1
1 357 . 16 1 1 A 38 38 ASP N N 38 111.480 118.189 -6.709 1
1 358 . 16 1 1 A 39 39 LEU H H 39 7.789 7.888 -0.099 1
1 359 . 16 1 1 A 39 39 LEU HA H 39 4.699 4.421 0.278 1
1 369 . 16 1 1 A 39 39 LEU C C 39 176.377 177.530 -1.153 1
1 370 . 16 1 1 A 39 39 LEU CA C 39 52.952 54.197 -1.245 1
1 371 . 16 1 1 A 39 39 LEU CB C 39 43.294 42.259 1.035 1
1 375 . 16 1 1 A 39 39 LEU N N 39 122.545 120.745 1.800 1
1 376 . 16 1 1 A 40 40 GLU H H 40 8.331 8.592 -0.261 1
1 377 . 16 1 1 A 40 40 GLU HA H 40 3.978 4.205 -0.227 1
1 382 . 16 1 1 A 40 40 GLU C C 40 176.887 177.114 -0.227 1
1 383 . 16 1 1 A 40 40 GLU CA C 40 59.066 58.941 0.125 1
1 384 . 16 1 1 A 40 40 GLU CB C 40 29.523 30.129 -0.606 1
1 386 . 16 1 1 A 40 40 GLU N N 40 118.036 120.192 -2.156 1
1 387 . 16 1 1 A 41 41 ASN H H 41 7.890 7.685 0.205 1
1 388 . 16 1 1 A 41 41 ASN HA H 41 4.820 4.992 -0.172 1
1 393 . 16 1 1 A 41 41 ASN CA C 41 52.316 51.621 0.695 1
1 394 . 16 1 1 A 41 41 ASN CB C 41 37.409 36.439 0.970 1
1 395 . 16 1 1 A 41 41 ASN N N 41 115.196 118.402 -3.206 1
1 397 . 16 1 1 A 42 42 LYS H H 42 7.943 7.962 -0.019 1
1 398 . 16 1 1 A 42 42 LYS HA H 42 4.328 4.226 0.102 1
1 407 . 16 1 1 A 42 42 LYS C C 42 177.081 177.295 -0.214 1
1 408 . 16 1 1 A 42 42 LYS CA C 42 56.567 59.658 -3.091 1
1 409 . 16 1 1 A 42 42 LYS CB C 42 33.120 32.305 0.815 1
1 413 . 16 1 1 A 42 42 LYS N N 42 120.612 125.552 -4.940 1
1 414 . 16 1 1 A 43 43 VAL H H 43 7.456 7.666 -0.210 1
1 415 . 16 1 1 A 43 43 VAL HA H 43 4.059 4.480 -0.421 1
1 423 . 16 1 1 A 43 43 VAL CA C 43 61.330 60.965 0.365 1
1 424 . 16 1 1 A 43 43 VAL CB C 43 32.819 32.410 0.409 1
1 427 . 16 1 1 A 43 43 VAL N N 43 118.284 118.493 -0.209 1
1 428 . 16 1 1 A 44 44 ILE H H 44 8.481 8.648 -0.167 1
1 429 . 16 1 1 A 44 44 ILE HA H 44 4.913 4.620 0.293 1
1 439 . 16 1 1 A 44 44 ILE C C 44 176.719 175.869 0.850 1
1 440 . 16 1 1 A 44 44 ILE CA C 44 59.946 61.915 -1.969 1
1 441 . 16 1 1 A 44 44 ILE CB C 44 35.784 38.294 -2.510 1
1 445 . 16 1 1 A 44 44 ILE N N 44 127.089 129.381 -2.292 1
1 446 . 16 1 1 A 45 45 THR H H 45 8.906 9.599 -0.693 1
1 447 . 16 1 1 A 45 45 THR HA H 45 5.400 5.046 0.354 1
1 452 . 16 1 1 A 45 45 THR CA C 45 58.528 59.271 -0.743 1
1 453 . 16 1 1 A 45 45 THR CB C 45 73.760 72.047 1.713 1
1 455 . 16 1 1 A 45 45 THR N N 45 116.832 117.111 -0.279 1
1 456 . 16 1 1 A 46 46 VAL H H 46 8.336 8.931 -0.595 1
1 457 . 16 1 1 A 46 46 VAL HA H 46 4.059 4.195 -0.136 1
1 465 . 16 1 1 A 46 46 VAL C C 46 176.648 176.512 0.136 1
1 466 . 16 1 1 A 46 46 VAL CA C 46 63.058 63.142 -0.084 1
1 467 . 16 1 1 A 46 46 VAL CB C 46 31.601 30.857 0.744 1
1 470 . 16 1 1 A 46 46 VAL N N 46 118.542 122.486 -3.944 1
1 471 . 16 1 1 A 47 47 HIS H H 47 9.382 8.612 0.770 1
1 472 . 16 1 1 A 47 47 HIS HA H 47 4.628 4.200 0.428 1
1 477 . 16 1 1 A 47 47 HIS C C 47 174.339 174.272 0.067 1
1 478 . 16 1 1 A 47 47 HIS CA C 47 57.764 59.899 -2.135 1
1 479 . 16 1 1 A 47 47 HIS CB C 47 31.453 30.544 0.909 1
1 482 . 16 1 1 A 47 47 HIS N N 47 133.900 128.266 5.634 1
1 483 . 16 1 1 A 48 48 ARG H H 48 7.135 7.870 -0.735 1
1 484 . 16 1 1 A 48 48 ARG HA H 48 4.360 4.871 -0.511 1
1 491 . 16 1 1 A 48 48 ARG C C 48 173.877 174.568 -0.691 1
1 492 . 16 1 1 A 48 48 ARG CA C 48 54.385 55.423 -1.038 1
1 493 . 16 1 1 A 48 48 ARG CB C 48 33.996 34.724 -0.728 1
1 496 . 16 1 1 A 48 48 ARG N N 48 114.736 117.972 -3.236 1
1 497 . 16 1 1 A 49 49 VAL H H 49 8.690 8.716 -0.026 1
1 498 . 16 1 1 A 49 49 VAL HA H 49 4.015 4.506 -0.491 1
1 506 . 16 1 1 A 49 49 VAL C C 49 176.255 175.604 0.651 1
1 507 . 16 1 1 A 49 49 VAL CA C 49 61.882 61.647 0.235 1
1 508 . 16 1 1 A 49 49 VAL CB C 49 32.261 33.074 -0.813 1
1 511 . 16 1 1 A 49 49 VAL N N 49 122.844 122.612 0.232 1
1 512 . 16 1 1 A 50 50 PHE H H 50 7.866 8.586 -0.720 1
1 513 . 16 1 1 A 50 50 PHE HA H 50 4.866 4.536 0.330 1
1 521 . 16 1 1 A 50 50 PHE C C 50 174.847 176.345 -1.498 1
1 522 . 16 1 1 A 50 50 PHE CA C 50 54.596 57.533 -2.937 1
1 523 . 16 1 1 A 50 50 PHE CB C 50 36.558 39.162 -2.604 1
1 529 . 16 1 1 A 50 50 PHE N N 50 128.498 127.435 1.063 1
1 530 . 16 1 1 A 51 51 PRO HA H 51 4.386 4.562 -0.176 1
1 537 . 16 1 1 A 51 51 PRO C C 51 177.321 176.521 0.800 1
1 538 . 16 1 1 A 51 51 PRO CA C 51 64.381 64.516 -0.135 1
1 539 . 16 1 1 A 51 51 PRO CB C 51 31.773 32.234 -0.461 1
1 542 . 16 1 1 A 52 52 ASN H H 52 8.814 8.402 0.412 1
1 543 . 16 1 1 A 52 52 ASN HA H 52 4.496 5.098 -0.602 1
1 548 . 16 1 1 A 52 52 ASN C C 52 174.823 174.501 0.322 1
1 549 . 16 1 1 A 52 52 ASN CA C 52 54.719 52.118 2.601 1
1 550 . 16 1 1 A 52 52 ASN CB C 52 38.109 39.484 -1.375 1
1 551 . 16 1 1 A 52 52 ASN N N 52 116.145 113.440 2.705 1
1 553 . 16 1 1 A 53 53 GLY H H 53 7.730 8.285 -0.555 1
1 554 . 16 1 1 A 53 53 GLY HA2 H 53 4.430 4.363 0.067 1
1 555 . 16 1 1 A 53 53 GLY HA3 H 53 4.089 4.377 -0.288 1
1 556 . 16 1 1 A 53 53 GLY C C 53 174.810 174.166 0.644 1
1 557 . 16 1 1 A 53 53 GLY CA C 53 44.987 45.782 -0.795 1
1 558 . 16 1 1 A 53 53 GLY N N 53 106.196 109.722 -3.526 1
1 559 . 16 1 1 A 54 54 LEU H H 54 8.764 9.147 -0.383 1
1 560 . 16 1 1 A 54 54 LEU HA H 54 4.041 4.172 -0.131 1
1 570 . 16 1 1 A 54 54 LEU C C 54 179.712 178.781 0.931 1
1 571 . 16 1 1 A 54 54 LEU CA C 54 58.310 57.654 0.656 1
1 572 . 16 1 1 A 54 54 LEU CB C 54 42.390 41.830 0.560 1
1 576 . 16 1 1 A 54 54 LEU N N 54 118.836 119.741 -0.905 1
1 577 . 16 1 1 A 55 55 ALA H H 55 7.593 7.969 -0.376 1
1 578 . 16 1 1 A 55 55 ALA HA H 55 4.275 3.885 0.390 1
1 582 . 16 1 1 A 55 55 ALA C C 55 181.307 180.070 1.237 1
1 583 . 16 1 1 A 55 55 ALA CA C 55 54.825 55.239 -0.414 1
1 584 . 16 1 1 A 55 55 ALA CB C 55 18.345 18.059 0.286 1
1 585 . 16 1 1 A 55 55 ALA N N 55 118.782 121.882 -3.100 1
1 586 . 16 1 1 A 56 56 SER H H 56 9.339 8.009 1.330 1
1 587 . 16 1 1 A 56 56 SER HA H 56 4.023 4.173 -0.150 1
1 589 . 16 1 1 A 56 56 SER C C 56 176.392 177.137 -0.745 1
1 590 . 16 1 1 A 56 56 SER CA C 56 60.984 61.438 -0.454 1
1 591 . 16 1 1 A 56 56 SER CB C 56 62.987 63.078 -0.091 1
1 592 . 16 1 1 A 56 56 SER N N 56 117.631 114.162 3.469 1
1 593 . 16 1 1 A 57 57 GLN H H 57 7.942 7.473 0.469 1
1 594 . 16 1 1 A 57 57 GLN HA H 57 4.034 4.053 -0.019 1
1 601 . 16 1 1 A 57 57 GLN C C 57 177.400 178.564 -1.164 1
1 602 . 16 1 1 A 57 57 GLN CA C 57 58.362 58.978 -0.616 1
1 603 . 16 1 1 A 57 57 GLN CB C 57 28.801 28.573 0.228 1
1 605 . 16 1 1 A 57 57 GLN N N 57 118.162 121.987 -3.825 1
1 607 . 16 1 1 A 58 58 GLU H H 58 7.683 8.672 -0.989 1
1 608 . 16 1 1 A 58 58 GLU HA H 58 4.163 4.081 0.082 1
1 613 . 16 1 1 A 58 58 GLU C C 58 179.248 176.888 2.360 1
1 614 . 16 1 1 A 58 58 GLU CA C 58 59.559 58.128 1.431 1
1 615 . 16 1 1 A 58 58 GLU CB C 58 29.317 29.644 -0.327 1
1 617 . 16 1 1 A 58 58 GLU N N 58 119.877 118.890 0.987 1
1 618 . 16 1 1 A 59 59 GLY H H 59 7.446 7.876 -0.430 1
1 619 . 16 1 1 A 59 59 GLY HA2 H 59 4.100 4.006 0.094 1
1 620 . 16 1 1 A 59 59 GLY HA3 H 59 3.770 4.008 -0.238 1
1 621 . 16 1 1 A 59 59 GLY C C 59 175.432 175.684 -0.252 1
1 622 . 16 1 1 A 59 59 GLY CA C 59 46.817 45.685 1.132 1
1 623 . 16 1 1 A 59 59 GLY N N 59 102.653 107.611 -4.958 1
1 624 . 16 1 1 A 60 60 THR H H 60 8.343 8.116 0.227 1
1 625 . 16 1 1 A 60 60 THR HA H 60 4.037 4.114 -0.077 1
1 630 . 16 1 1 A 60 60 THR C C 60 175.843 174.814 1.029 1
1 631 . 16 1 1 A 60 60 THR CA C 60 64.792 65.864 -1.072 1
1 632 . 16 1 1 A 60 60 THR CB C 60 69.325 68.743 0.582 1
1 634 . 16 1 1 A 60 60 THR N N 60 113.863 114.210 -0.347 1
1 635 . 16 1 1 A 61 61 ILE H H 61 8.802 7.739 1.063 1
1 636 . 16 1 1 A 61 61 ILE HA H 61 3.631 4.108 -0.477 1
1 646 . 16 1 1 A 61 61 ILE C C 61 174.198 174.498 -0.300 1
1 647 . 16 1 1 A 61 61 ILE CA C 61 62.938 61.019 1.919 1
1 648 . 16 1 1 A 61 61 ILE CB C 61 37.225 36.208 1.017 1
1 652 . 16 1 1 A 61 61 ILE N N 61 126.153 119.573 6.580 1
1 653 . 16 1 1 A 62 62 GLN H H 62 7.124 8.254 -1.130 1
1 654 . 16 1 1 A 62 62 GLN HA H 62 4.500 4.697 -0.197 1
1 661 . 16 1 1 A 62 62 GLN C C 62 174.556 175.262 -0.706 1
1 662 . 16 1 1 A 62 62 GLN CA C 62 53.364 54.242 -0.878 1
1 663 . 16 1 1 A 62 62 GLN CB C 62 32.196 31.508 0.688 1
1 665 . 16 1 1 A 62 62 GLN N N 62 123.730 126.774 -3.044 1
1 667 . 16 1 1 A 63 63 LYS H H 63 8.399 8.629 -0.230 1
1 668 . 16 1 1 A 63 63 LYS HA H 63 3.464 4.206 -0.742 1
1 677 . 16 1 1 A 63 63 LYS CA C 63 57.905 58.371 -0.466 1
1 678 . 16 1 1 A 63 63 LYS CB C 63 32.260 32.049 0.211 1
1 682 . 16 1 1 A 63 63 LYS N N 63 121.381 124.853 -3.472 1
1 683 . 16 1 1 A 64 64 GLY H H 64 9.265 8.469 0.796 1
1 684 . 16 1 1 A 64 64 GLY HA2 H 64 4.415 4.017 0.398 1
1 685 . 16 1 1 A 64 64 GLY HA3 H 64 3.639 4.019 -0.380 1
1 686 . 16 1 1 A 64 64 GLY CA C 64 44.881 45.114 -0.233 1
1 687 . 16 1 1 A 64 64 GLY N N 64 113.750 115.006 -1.256 1
1 688 . 16 1 1 A 65 65 ASN H H 65 7.594 8.483 -0.889 1
1 689 . 16 1 1 A 65 65 ASN HA H 65 4.798 4.830 -0.032 1
1 694 . 16 1 1 A 65 65 ASN C C 65 175.042 173.747 1.295 1
1 695 . 16 1 1 A 65 65 ASN CA C 65 53.047 53.211 -0.164 1
1 696 . 16 1 1 A 65 65 ASN CB C 65 38.153 40.194 -2.041 1
1 697 . 16 1 1 A 65 65 ASN N N 65 117.999 119.949 -1.950 1
1 699 . 16 1 1 A 66 66 GLU H H 66 8.538 8.595 -0.057 1
1 700 . 16 1 1 A 66 66 GLU HA H 66 4.634 4.952 -0.318 1
1 705 . 16 1 1 A 66 66 GLU C C 66 176.620 175.271 1.349 1
1 706 . 16 1 1 A 66 66 GLU CA C 66 55.863 54.684 1.179 1
1 707 . 16 1 1 A 66 66 GLU CB C 66 30.899 32.845 -1.946 1
1 709 . 16 1 1 A 66 66 GLU N N 66 122.233 120.694 1.539 1
1 710 . 16 1 1 A 67 67 VAL H H 67 8.452 8.709 -0.257 1
1 711 . 16 1 1 A 67 67 VAL HA H 67 4.172 4.173 -0.001 1
1 719 . 16 1 1 A 67 67 VAL C C 67 174.641 175.483 -0.842 1
1 720 . 16 1 1 A 67 67 VAL CA C 67 61.856 62.789 -0.933 1
1 721 . 16 1 1 A 67 67 VAL CB C 67 31.066 30.758 0.308 1
1 724 . 16 1 1 A 67 67 VAL N N 67 126.311 127.797 -1.486 1
1 725 . 16 1 1 A 68 68 LEU H H 68 9.000 8.836 0.164 1
1 726 . 16 1 1 A 68 68 LEU HA H 68 4.390 4.121 0.269 1
1 736 . 16 1 1 A 68 68 LEU C C 68 178.924 176.845 2.079 1
1 737 . 16 1 1 A 68 68 LEU CA C 68 56.990 56.840 0.150 1
1 738 . 16 1 1 A 68 68 LEU CB C 68 42.392 42.216 0.176 1
1 742 . 16 1 1 A 68 68 LEU N N 68 127.175 130.068 -2.893 1
1 743 . 16 1 1 A 69 69 SER H H 69 7.666 7.839 -0.173 1
1 744 . 16 1 1 A 69 69 SER HA H 69 5.144 5.063 0.081 1
1 747 . 16 1 1 A 69 69 SER C C 69 172.722 172.243 0.479 1
1 748 . 16 1 1 A 69 69 SER CA C 69 57.606 57.241 0.365 1
1 749 . 16 1 1 A 69 69 SER CB C 69 64.511 66.755 -2.244 1
1 750 . 16 1 1 A 69 69 SER N N 69 110.346 109.103 1.243 1
1 751 . 16 1 1 A 70 70 ILE H H 70 7.965 8.919 -0.954 1
1 752 . 16 1 1 A 70 70 ILE HA H 70 4.548 4.564 -0.016 1
1 762 . 16 1 1 A 70 70 ILE C C 70 174.993 176.196 -1.203 1
1 763 . 16 1 1 A 70 70 ILE CA C 70 60.897 60.192 0.705 1
1 764 . 16 1 1 A 70 70 ILE CB C 70 41.186 40.521 0.665 1
1 768 . 16 1 1 A 70 70 ILE N N 70 119.579 120.433 -0.854 1
1 769 . 16 1 1 A 71 71 ASN H H 71 9.839 10.100 -0.261 1
1 770 . 16 1 1 A 71 71 ASN HA H 71 4.485 4.411 0.074 1
1 775 . 16 1 1 A 71 71 ASN C C 71 174.975 174.647 0.328 1
1 776 . 16 1 1 A 71 71 ASN CA C 71 54.085 54.190 -0.105 1
1 777 . 16 1 1 A 71 71 ASN CB C 71 36.255 37.299 -1.044 1
1 778 . 16 1 1 A 71 71 ASN N N 71 126.963 125.464 1.499 1
1 780 . 16 1 1 A 72 72 GLY H H 72 8.911 8.439 0.472 1
1 781 . 16 1 1 A 72 72 GLY HA2 H 72 4.149 3.897 0.252 1
1 782 . 16 1 1 A 72 72 GLY HA3 H 72 3.507 3.897 -0.390 1
1 783 . 16 1 1 A 72 72 GLY C C 72 173.594 173.447 0.147 1
1 784 . 16 1 1 A 72 72 GLY CA C 72 45.162 45.409 -0.247 1
1 785 . 16 1 1 A 72 72 GLY N N 72 103.020 105.167 -2.147 1
1 786 . 16 1 1 A 73 73 LYS H H 73 7.922 7.871 0.051 1
1 787 . 16 1 1 A 73 73 LYS HA H 73 4.485 4.609 -0.124 1
1 796 . 16 1 1 A 73 73 LYS C C 73 175.036 175.515 -0.479 1
1 797 . 16 1 1 A 73 73 LYS CA C 73 54.719 54.819 -0.100 1
1 798 . 16 1 1 A 73 73 LYS CB C 73 32.137 34.338 -2.201 1
1 802 . 16 1 1 A 73 73 LYS N N 73 122.413 122.313 0.100 1
1 803 . 16 1 1 A 74 74 SER H H 74 8.585 8.840 -0.255 1
1 804 . 16 1 1 A 74 74 SER HA H 74 4.452 4.729 -0.277 1
1 807 . 16 1 1 A 74 74 SER C C 74 175.965 174.060 1.905 1
1 808 . 16 1 1 A 74 74 SER CA C 74 58.028 58.556 -0.528 1
1 809 . 16 1 1 A 74 74 SER CB C 74 63.799 63.977 -0.178 1
1 810 . 16 1 1 A 74 74 SER N N 74 118.737 124.637 -5.900 1
1 811 . 16 1 1 A 75 75 LEU H H 75 8.015 8.298 -0.283 1
1 812 . 16 1 1 A 75 75 LEU HA H 75 4.661 4.512 0.149 1
1 822 . 16 1 1 A 75 75 LEU C C 75 178.117 177.582 0.535 1
1 823 . 16 1 1 A 75 75 LEU CA C 75 53.980 54.541 -0.561 1
1 824 . 16 1 1 A 75 75 LEU CB C 75 40.830 41.080 -0.250 1
1 828 . 16 1 1 A 75 75 LEU N N 75 125.425 125.660 -0.235 1
1 829 . 16 1 1 A 76 76 LYS H H 76 8.099 8.612 -0.513 1
1 830 . 16 1 1 A 76 76 LYS HA H 76 4.210 4.424 -0.214 1
1 839 . 16 1 1 A 76 76 LYS C C 76 178.487 176.759 1.728 1
1 840 . 16 1 1 A 76 76 LYS CA C 76 58.010 55.453 2.557 1
1 841 . 16 1 1 A 76 76 LYS CB C 76 31.683 31.657 0.026 1
1 845 . 16 1 1 A 76 76 LYS N N 76 124.064 120.163 3.901 1
1 846 . 16 1 1 A 77 77 GLY H H 77 8.859 7.843 1.016 1
1 847 . 16 1 1 A 77 77 GLY HA2 H 77 4.110 4.059 0.051 1
1 848 . 16 1 1 A 77 77 GLY HA3 H 77 3.869 4.063 -0.194 1
1 849 . 16 1 1 A 77 77 GLY C C 77 174.335 174.902 -0.567 1
1 850 . 16 1 1 A 77 77 GLY CA C 77 46.232 44.934 1.298 1
1 851 . 16 1 1 A 77 77 GLY N N 77 115.659 108.712 6.947 1
1 852 . 16 1 1 A 78 78 THR H H 78 7.654 7.754 -0.100 1
1 853 . 16 1 1 A 78 78 THR HA H 78 4.624 4.164 0.460 1
1 858 . 16 1 1 A 78 78 THR C C 78 177.272 174.789 2.483 1
1 859 . 16 1 1 A 78 78 THR CA C 78 61.794 63.226 -1.432 1
1 860 . 16 1 1 A 78 78 THR CB C 78 70.595 69.197 1.398 1
1 862 . 16 1 1 A 78 78 THR N N 78 112.847 116.561 -3.714 1
1 863 . 16 1 1 A 79 79 THR H H 79 8.813 8.632 0.181 1
1 864 . 16 1 1 A 79 79 THR HA H 79 4.395 4.733 -0.338 1
1 869 . 16 1 1 A 79 79 THR C C 79 174.503 175.495 -0.992 1
1 870 . 16 1 1 A 79 79 THR CA C 79 61.724 60.857 0.867 1
1 871 . 16 1 1 A 79 79 THR CB C 79 71.007 71.104 -0.097 1
1 873 . 16 1 1 A 79 79 THR N N 79 114.123 117.743 -3.620 1
1 874 . 16 1 1 A 80 80 HIS H H 80 10.266 9.237 1.029 1
1 875 . 16 1 1 A 80 80 HIS HA H 80 4.331 4.235 0.096 1
1 880 . 16 1 1 A 80 80 HIS C C 80 177.075 177.091 -0.016 1
1 881 . 16 1 1 A 80 80 HIS CA C 80 61.338 59.596 1.742 1
1 882 . 16 1 1 A 80 80 HIS CB C 80 28.651 30.273 -1.622 1
1 885 . 16 1 1 A 80 80 HIS N N 80 122.776 122.211 0.565 1
1 886 . 16 1 1 A 81 81 HIS H H 81 9.335 7.989 1.346 1
1 887 . 16 1 1 A 81 81 HIS HA H 81 4.078 4.087 -0.009 1
1 892 . 16 1 1 A 81 81 HIS C C 81 178.269 176.720 1.549 1
1 893 . 16 1 1 A 81 81 HIS CA C 81 60.210 58.802 1.408 1
1 894 . 16 1 1 A 81 81 HIS CB C 81 29.569 30.305 -0.736 1
1 897 . 16 1 1 A 81 81 HIS N N 81 114.733 118.514 -3.781 1
1 898 . 16 1 1 A 82 82 ASP H H 82 7.741 8.269 -0.528 1
1 899 . 16 1 1 A 82 82 ASP HA H 82 4.452 4.101 0.351 1
1 902 . 16 1 1 A 82 82 ASP C C 82 178.683 179.083 -0.400 1
1 903 . 16 1 1 A 82 82 ASP CA C 82 57.148 57.253 -0.105 1
1 904 . 16 1 1 A 82 82 ASP CB C 82 39.522 40.469 -0.947 1
1 905 . 16 1 1 A 82 82 ASP N N 82 121.407 118.226 3.181 1
1 906 . 16 1 1 A 83 83 ALA H H 83 8.502 8.089 0.413 1
1 907 . 16 1 1 A 83 83 ALA HA H 83 3.939 4.084 -0.145 1
1 911 . 16 1 1 A 83 83 ALA C C 83 179.361 179.473 -0.112 1
1 912 . 16 1 1 A 83 83 ALA CA C 83 55.635 55.009 0.626 1
1 913 . 16 1 1 A 83 83 ALA CB C 83 18.124 18.822 -0.698 1
1 914 . 16 1 1 A 83 83 ALA N N 83 125.049 122.878 2.171 1
1 915 . 16 1 1 A 84 84 LEU H H 84 8.100 7.862 0.238 1
1 916 . 16 1 1 A 84 84 LEU HA H 84 3.792 3.777 0.015 1
1 926 . 16 1 1 A 84 84 LEU C C 84 180.173 179.297 0.876 1
1 927 . 16 1 1 A 84 84 LEU CA C 84 57.932 58.002 -0.070 1
1 928 . 16 1 1 A 84 84 LEU CB C 84 41.157 41.583 -0.426 1
1 932 . 16 1 1 A 84 84 LEU N N 84 117.139 118.306 -1.167 1
1 933 . 16 1 1 A 85 85 ALA H H 85 7.715 8.545 -0.830 1
1 934 . 16 1 1 A 85 85 ALA HA H 85 4.061 4.133 -0.072 1
1 938 . 16 1 1 A 85 85 ALA C C 85 180.380 179.997 0.383 1
1 939 . 16 1 1 A 85 85 ALA CA C 85 55.212 55.354 -0.142 1
1 940 . 16 1 1 A 85 85 ALA CB C 85 17.803 18.417 -0.614 1
1 941 . 16 1 1 A 85 85 ALA N N 85 122.448 120.551 1.897 1
1 942 . 16 1 1 A 86 86 ILE H H 86 7.669 7.844 -0.175 1
1 943 . 16 1 1 A 86 86 ILE HA H 86 3.678 3.720 -0.042 1
1 953 . 16 1 1 A 86 86 ILE C C 86 178.692 178.805 -0.113 1
1 954 . 16 1 1 A 86 86 ILE CA C 86 65.226 64.923 0.303 1
1 955 . 16 1 1 A 86 86 ILE CB C 86 38.099 37.762 0.337 1
1 959 . 16 1 1 A 86 86 ILE N N 86 121.804 117.947 3.857 1
1 960 . 16 1 1 A 87 87 LEU H H 87 7.922 8.394 -0.472 1
1 961 . 16 1 1 A 87 87 LEU HA H 87 3.903 4.008 -0.105 1
1 971 . 16 1 1 A 87 87 LEU C C 87 178.610 178.695 -0.085 1
1 972 . 16 1 1 A 87 87 LEU CA C 87 58.221 58.140 0.081 1
1 973 . 16 1 1 A 87 87 LEU CB C 87 42.344 41.448 0.896 1
1 977 . 16 1 1 A 87 87 LEU N N 87 121.947 121.291 0.656 1
1 978 . 16 1 1 A 88 88 ARG H H 88 8.317 8.190 0.127 1
1 979 . 16 1 1 A 88 88 ARG HA H 88 4.060 4.174 -0.114 1
1 986 . 16 1 1 A 88 88 ARG C C 88 180.698 177.291 3.407 1
1 987 . 16 1 1 A 88 88 ARG CA C 88 59.383 58.567 0.816 1
1 988 . 16 1 1 A 88 88 ARG CB C 88 30.055 29.756 0.299 1
1 991 . 16 1 1 A 88 88 ARG N N 88 119.343 119.439 -0.096 1
1 992 . 16 1 1 A 89 89 GLN H H 89 8.270 7.678 0.592 1
1 993 . 16 1 1 A 89 89 GLN HA H 89 4.122 4.233 -0.111 1
1 1000 . 16 1 1 A 89 89 GLN C C 89 177.955 178.257 -0.302 1
1 1001 . 16 1 1 A 89 89 GLN CA C 89 58.714 57.416 1.298 1
1 1002 . 16 1 1 A 89 89 GLN CB C 89 28.160 29.132 -0.972 1
1 1004 . 16 1 1 A 89 89 GLN N N 89 121.097 117.527 3.570 1
1 1006 . 16 1 1 A 90 90 ALA H H 90 7.558 7.531 0.027 1
1 1007 . 16 1 1 A 90 90 ALA HA H 90 4.123 4.175 -0.052 1
1 1011 . 16 1 1 A 90 90 ALA C C 90 178.076 178.111 -0.035 1
1 1012 . 16 1 1 A 90 90 ALA CA C 90 52.942 53.891 -0.949 1
1 1013 . 16 1 1 A 90 90 ALA CB C 90 18.015 18.310 -0.295 1
1 1014 . 16 1 1 A 90 90 ALA N N 90 119.652 121.754 -2.102 1
1 1015 . 16 1 1 A 91 91 ARG H H 91 7.768 8.090 -0.322 1
1 1016 . 16 1 1 A 91 91 ARG HA H 91 4.065 4.265 -0.200 1
1 1022 . 16 1 1 A 91 91 ARG C C 91 177.858 177.583 0.275 1
1 1023 . 16 1 1 A 91 91 ARG CA C 91 58.573 57.469 1.104 1
1 1024 . 16 1 1 A 91 91 ARG CB C 91 30.384 30.842 -0.458 1
1 1027 . 16 1 1 A 91 91 ARG N N 91 118.081 116.972 1.109 1
1 1028 . 16 1 1 A 92 92 GLU H H 92 7.691 7.999 -0.308 1
1 1029 . 16 1 1 A 92 92 GLU HA H 92 4.123 4.141 -0.018 1
1 1034 . 16 1 1 A 92 92 GLU C C 92 174.459 176.706 -2.247 1
1 1035 . 16 1 1 A 92 92 GLU CA C 92 61.565 60.820 0.745 1
1 1036 . 16 1 1 A 92 92 GLU CB C 92 27.583 28.934 -1.351 1
1 1038 . 16 1 1 A 92 92 GLU N N 92 118.447 118.601 -0.154 1
1 1039 . 16 1 1 A 93 93 PRO HA H 93 4.716 4.557 0.159 1
1 1046 . 16 1 1 A 93 93 PRO C C 93 176.221 176.294 -0.073 1
1 1047 . 16 1 1 A 93 93 PRO CA C 93 63.149 62.364 0.785 1
1 1048 . 16 1 1 A 93 93 PRO CB C 93 32.571 33.178 -0.607 1
1 1051 . 16 1 1 A 94 94 ARG H H 94 8.434 8.870 -0.436 1
1 1052 . 16 1 1 A 94 94 ARG HA H 94 4.232 4.507 -0.275 1
1 1058 . 16 1 1 A 94 94 ARG C C 94 175.323 175.693 -0.370 1
1 1059 . 16 1 1 A 94 94 ARG CA C 94 56.972 56.356 0.616 1
1 1060 . 16 1 1 A 94 94 ARG CB C 94 30.448 31.947 -1.499 1
1 1063 . 16 1 1 A 94 94 ARG N N 94 115.987 118.288 -2.301 1
1 1064 . 16 1 1 A 95 95 GLN H H 95 7.246 7.551 -0.305 1
1 1065 . 16 1 1 A 95 95 GLN HA H 95 5.251 5.252 -0.001 1
1 1072 . 16 1 1 A 95 95 GLN C C 95 174.786 173.685 1.101 1
1 1073 . 16 1 1 A 95 95 GLN CA C 95 54.209 54.272 -0.063 1
1 1074 . 16 1 1 A 95 95 GLN CB C 95 32.384 32.301 0.083 1
1 1076 . 16 1 1 A 95 95 GLN N N 95 115.998 120.286 -4.288 1
1 1078 . 16 1 1 A 96 96 ALA H H 96 8.739 8.732 0.007 1
1 1079 . 16 1 1 A 96 96 ALA HA H 96 5.412 5.303 0.109 1
1 1083 . 16 1 1 A 96 96 ALA C C 96 175.258 175.806 -0.548 1
1 1084 . 16 1 1 A 96 96 ALA CA C 96 50.355 50.487 -0.132 1
1 1085 . 16 1 1 A 96 96 ALA CB C 96 24.270 22.005 2.265 1
1 1086 . 16 1 1 A 96 96 ALA N N 96 126.197 126.370 -0.173 1
1 1087 . 16 1 1 A 97 97 VAL H H 97 8.568 8.840 -0.272 1
1 1088 . 16 1 1 A 97 97 VAL HA H 97 4.804 4.661 0.143 1
1 1096 . 16 1 1 A 97 97 VAL C C 97 175.982 174.861 1.121 1
1 1097 . 16 1 1 A 97 97 VAL CA C 97 61.442 61.479 -0.037 1
1 1098 . 16 1 1 A 97 97 VAL CB C 97 33.413 32.855 0.558 1
1 1101 . 16 1 1 A 97 97 VAL N N 97 120.702 123.205 -2.503 1
1 1102 . 16 1 1 A 98 98 ILE H H 98 9.753 8.561 1.192 1
1 1103 . 16 1 1 A 98 98 ILE HA H 98 4.826 4.956 -0.130 1
1 1113 . 16 1 1 A 98 98 ILE C C 98 174.292 174.735 -0.443 1
1 1114 . 16 1 1 A 98 98 ILE CA C 98 59.981 59.437 0.544 1
1 1115 . 16 1 1 A 98 98 ILE CB C 98 40.608 41.287 -0.679 1
1 1119 . 16 1 1 A 98 98 ILE N N 98 131.738 127.468 4.270 1
1 1120 . 16 1 1 A 99 99 VAL H H 99 8.493 8.295 0.198 1
1 1121 . 16 1 1 A 99 99 VAL HA H 99 5.201 4.760 0.441 1
1 1129 . 16 1 1 A 99 99 VAL C C 99 176.557 175.201 1.356 1
1 1130 . 16 1 1 A 99 99 VAL CA C 99 61.495 60.920 0.575 1
1 1131 . 16 1 1 A 99 99 VAL CB C 99 32.327 33.122 -0.795 1
1 1134 . 16 1 1 A 99 99 VAL N N 99 129.537 128.256 1.281 1
1 1135 . 16 1 1 A 100 100 THR H H 100 9.050 9.009 0.041 1
1 1136 . 16 1 1 A 100 100 THR HA H 100 5.606 5.571 0.035 1
1 1141 . 16 1 1 A 100 100 THR C C 100 172.815 173.436 -0.621 1
1 1142 . 16 1 1 A 100 100 THR CA C 100 59.049 59.865 -0.816 1
1 1143 . 16 1 1 A 100 100 THR CB C 100 73.966 71.640 2.326 1
1 1145 . 16 1 1 A 100 100 THR N N 100 117.469 117.717 -0.248 1
1 1146 . 16 1 1 A 101 101 ARG H H 101 8.773 8.948 -0.175 1
1 1147 . 16 1 1 A 101 101 ARG HA H 101 4.989 4.888 0.101 1
1 1155 . 16 1 1 A 101 101 ARG C C 101 174.738 175.604 -0.866 1
1 1156 . 16 1 1 A 101 101 ARG CA C 101 54.825 54.720 0.105 1
1 1157 . 16 1 1 A 101 101 ARG CB C 101 34.636 33.374 1.262 1
1 1160 . 16 1 1 A 101 101 ARG N N 101 117.532 122.076 -4.544 1
1 1162 . 16 1 1 A 102 102 LYS H H 102 8.616 8.244 0.372 1
1 1163 . 16 1 1 A 102 102 LYS HA H 102 4.232 4.253 -0.021 1
1 1171 . 16 1 1 A 102 102 LYS C C 102 175.935 176.580 -0.645 1
1 1172 . 16 1 1 A 102 102 LYS CA C 102 56.549 57.063 -0.514 1
1 1173 . 16 1 1 A 102 102 LYS CB C 102 33.266 32.721 0.545 1
1 1177 . 16 1 1 A 102 102 LYS N N 102 126.899 122.110 4.789 1
1 1178 . 16 1 1 A 103 103 LEU H H 103 8.424 8.530 -0.106 1
1 1179 . 16 1 1 A 103 103 LEU HA H 103 4.540 4.817 -0.277 1
1 1189 . 16 1 1 A 103 103 LEU C C 103 176.956 176.448 0.508 1
1 1190 . 16 1 1 A 103 103 LEU CA C 103 54.755 53.408 1.347 1
1 1191 . 16 1 1 A 103 103 LEU CB C 103 42.929 43.053 -0.124 1
1 1195 . 16 1 1 A 103 103 LEU N N 103 126.246 126.346 -0.100 1
1 1196 . 16 1 1 A 104 104 THR H H 104 8.201 8.127 0.074 1
1 1197 . 16 1 1 A 104 104 THR HA H 104 4.624 4.418 0.206 1
1 1202 . 16 1 1 A 104 104 THR C C 104 172.954 175.052 -2.098 1
1 1203 . 16 1 1 A 104 104 THR CA C 104 59.483 60.819 -1.336 1
1 1204 . 16 1 1 A 104 104 THR CB C 104 69.761 69.091 0.670 1
1 1206 . 16 1 1 A 104 104 THR N N 104 117.263 113.890 3.373 1
1 1207 . 16 1 1 A 105 105 PRO HA H 105 4.399 4.411 -0.012 1
1 1213 . 16 1 1 A 105 105 PRO CA C 105 63.495 65.176 -1.681 1
1 1214 . 16 1 1 A 105 105 PRO CB C 105 32.096 31.780 0.316 1
1 1217 . 16 1 1 A 106 106 GLU H H 106 8.519 7.555 0.964 1
1 1218 . 16 1 1 A 106 106 GLU HA H 106 4.197 4.661 -0.464 1
1 1221 . 16 1 1 A 106 106 GLU C C 106 176.110 173.781 2.329 1
1 1222 . 16 1 1 A 106 106 GLU CA C 106 56.743 55.610 1.133 1
1 1223 . 16 1 1 A 106 106 GLU CB C 106 30.137 31.543 -1.406 1
1 1225 . 16 1 1 A 106 106 GLU N N 106 120.609 112.690 7.919 1
1 1226 . 16 1 1 A 107 107 ALA H H 107 8.241 8.468 -0.227 1
1 1227 . 16 1 1 A 107 107 ALA HA H 107 4.317 4.967 -0.650 1
1 1231 . 16 1 1 A 107 107 ALA C C 107 177.299 176.148 1.151 1
1 1232 . 16 1 1 A 107 107 ALA CA C 107 52.203 50.231 1.972 1
1 1233 . 16 1 1 A 107 107 ALA CB C 107 19.392 23.050 -3.658 1
1 1234 . 16 1 1 A 107 107 ALA N N 107 124.849 122.660 2.189 1
1 1235 . 16 1 1 A 108 108 MET H H 108 8.284 8.443 -0.159 1
1 1236 . 16 1 1 A 108 108 MET HA H 108 4.792 4.390 0.402 1
1 1244 . 16 1 1 A 108 108 MET C C 108 174.337 174.784 -0.447 1
1 1245 . 16 1 1 A 108 108 MET CA C 108 53.258 54.040 -0.782 1
1 1246 . 16 1 1 A 108 108 MET CB C 108 32.608 33.364 -0.756 1
1 1249 . 16 1 1 A 108 108 MET N N 108 121.025 119.314 1.711 1
1 1250 . 16 1 1 A 109 109 PRO HA H 109 4.408 4.536 -0.128 1
1 1256 . 16 1 1 A 109 109 PRO C C 109 176.412 175.079 1.333 1
1 1257 . 16 1 1 A 109 109 PRO CA C 109 63.290 62.241 1.049 1
1 1258 . 16 1 1 A 109 109 PRO CB C 109 32.077 32.965 -0.888 1
1 1261 . 16 1 1 A 110 110 ASP H H 110 8.417 8.445 -0.028 1
1 1262 . 16 1 1 A 110 110 ASP HA H 110 4.573 4.979 -0.406 1
1 1265 . 16 1 1 A 110 110 ASP C C 110 176.508 175.795 0.713 1
1 1266 . 16 1 1 A 110 110 ASP CA C 110 54.085 53.665 0.420 1
1 1267 . 16 1 1 A 110 110 ASP CB C 110 41.075 41.955 -0.880 1
1 1268 . 16 1 1 A 110 110 ASP N N 110 120.239 120.297 -0.058 1
1 1269 . 16 1 1 A 111 111 LEU H H 111 8.279 8.767 -0.488 1
1 1270 . 16 1 1 A 111 111 LEU HA H 111 4.319 4.404 -0.085 1
1 1280 . 16 1 1 A 111 111 LEU C C 111 177.551 176.885 0.666 1
1 1281 . 16 1 1 A 111 111 LEU CA C 111 55.581 54.584 0.997 1
1 1282 . 16 1 1 A 111 111 LEU CB C 111 42.360 42.705 -0.345 1
1 1286 . 16 1 1 A 111 111 LEU N N 111 123.318 125.598 -2.280 1
1 1287 . 16 1 1 A 112 112 ASN H H 112 8.487 8.832 -0.345 1
1 1288 . 16 1 1 A 112 112 ASN HA H 112 4.725 4.638 0.087 1
1 1293 . 16 1 1 A 112 112 ASN C C 112 175.454 173.585 1.869 1
1 1294 . 16 1 1 A 112 112 ASN CA C 112 53.610 55.922 -2.312 1
1 1295 . 16 1 1 A 112 112 ASN CB C 112 39.116 37.812 1.304 1
1 1296 . 16 1 1 A 112 112 ASN N N 112 118.752 118.222 0.530 1
1 1298 . 16 1 1 A 115 115 GLY H H 115 8.205 8.948 -0.743 1
1 1299 . 16 1 1 A 115 115 GLY HA2 H 115 4.126 3.942 0.184 1
1 1300 . 16 1 1 A 115 115 GLY HA3 H 115 4.126 3.942 0.184 1
1 1301 . 16 1 1 A 115 115 GLY CA C 115 44.727 46.640 -1.913 1
1 1302 . 16 1 1 A 116 116 PRO HA H 116 4.485 4.286 0.199 1
1 1309 . 16 1 1 A 116 116 PRO CA C 116 63.298 65.149 -1.851 1
1 1310 . 16 1 1 A 116 116 PRO CB C 116 32.077 31.526 0.551 1
1 1313 . 16 1 1 A 117 117 SER H H 117 8.532 8.001 0.531 1
1 1 . 17 1 1 A 7 7 GLY HA2 H 7 3.960 3.817 0.143 1
1 2 . 17 1 1 A 7 7 GLY HA3 H 7 3.960 3.817 0.143 1
1 3 . 17 1 1 A 7 7 GLY C C 7 174.009 175.308 -1.299 1
1 4 . 17 1 1 A 7 7 GLY CA C 7 45.374 46.864 -1.490 1
1 5 . 17 1 1 A 8 8 ALA H H 8 8.163 7.669 0.494 1
1 6 . 17 1 1 A 8 8 ALA HA H 8 4.381 4.437 -0.056 1
1 10 . 17 1 1 A 8 8 ALA C C 8 178.078 177.984 0.094 1
1 11 . 17 1 1 A 8 8 ALA CA C 8 52.677 53.430 -0.753 1
1 12 . 17 1 1 A 8 8 ALA CB C 8 19.368 20.314 -0.946 1
1 13 . 17 1 1 A 8 8 ALA N N 8 123.721 123.206 0.515 1
1 14 . 17 1 1 A 9 9 THR H H 9 8.142 7.857 0.285 1
1 15 . 17 1 1 A 9 9 THR HA H 9 4.353 4.388 -0.035 1
1 20 . 17 1 1 A 9 9 THR C C 9 174.597 174.731 -0.134 1
1 21 . 17 1 1 A 9 9 THR CA C 9 62.093 63.425 -1.332 1
1 22 . 17 1 1 A 9 9 THR CB C 9 69.948 68.282 1.666 1
1 24 . 17 1 1 A 9 9 THR N N 9 113.761 111.762 1.999 1
1 25 . 17 1 1 A 10 10 LEU H H 10 8.218 8.608 -0.390 1
1 26 . 17 1 1 A 10 10 LEU HA H 10 4.169 4.338 -0.169 1
1 36 . 17 1 1 A 10 10 LEU C C 10 176.110 177.190 -1.080 1
1 37 . 17 1 1 A 10 10 LEU CA C 10 61.099 56.159 4.940 1
1 38 . 17 1 1 A 10 10 LEU CB C 10 38.686 42.645 -3.959 1
1 42 . 17 1 1 A 10 10 LEU N N 10 123.516 125.592 -2.076 1
1 43 . 17 1 1 A 11 11 LYS H H 11 8.496 8.014 0.482 1
1 44 . 17 1 1 A 11 11 LYS HA H 11 4.891 4.623 0.268 1
1 49 . 17 1 1 A 11 11 LYS C C 11 175.794 175.791 0.003 1
1 50 . 17 1 1 A 11 11 LYS CA C 11 55.652 54.953 0.699 1
1 51 . 17 1 1 A 11 11 LYS CB C 11 29.444 35.914 -6.470 1
1 52 . 17 1 1 A 11 11 LYS N N 11 125.141 117.365 7.776 1
1 53 . 17 1 1 A 12 12 GLN HA H 12 4.315 3.902 0.413 1
1 54 . 17 1 1 A 12 12 GLN C C 12 176.300 174.763 1.537 1
1 55 . 17 1 1 A 12 12 GLN CA C 12 56.286 56.526 -0.240 1
1 56 . 17 1 1 A 12 12 GLN CB C 12 32.901 27.504 5.397 1
1 57 . 17 1 1 A 13 13 LEU H H 13 8.410 8.165 0.245 1
1 58 . 17 1 1 A 13 13 LEU HA H 13 4.348 4.795 -0.447 1
1 67 . 17 1 1 A 13 13 LEU C C 13 177.120 176.155 0.965 1
1 68 . 17 1 1 A 13 13 LEU CA C 13 55.142 53.429 1.713 1
1 69 . 17 1 1 A 13 13 LEU CB C 13 42.352 43.719 -1.367 1
1 73 . 17 1 1 A 13 13 LEU N N 13 124.340 121.971 2.369 1
1 74 . 17 1 1 A 14 14 ASP H H 14 8.250 8.831 -0.581 1
1 75 . 17 1 1 A 14 14 ASP HA H 14 4.540 4.655 -0.115 1
1 78 . 17 1 1 A 14 14 ASP C C 14 176.769 175.553 1.216 1
1 79 . 17 1 1 A 14 14 ASP CA C 14 54.772 55.342 -0.570 1
1 80 . 17 1 1 A 14 14 ASP CB C 14 41.322 41.023 0.299 1
1 81 . 17 1 1 A 14 14 ASP N N 14 120.493 123.862 -3.369 1
1 82 . 17 1 1 A 15 15 GLY H H 15 8.428 8.693 -0.265 1
1 83 . 17 1 1 A 15 15 GLY HA2 H 15 4.089 4.032 0.057 1
1 84 . 17 1 1 A 15 15 GLY HA3 H 15 3.874 4.032 -0.158 1
1 85 . 17 1 1 A 15 15 GLY C C 15 174.122 173.729 0.393 1
1 86 . 17 1 1 A 15 15 GLY CA C 15 45.972 45.948 0.024 1
1 87 . 17 1 1 A 15 15 GLY N N 15 108.670 108.786 -0.116 1
1 88 . 17 1 1 A 16 16 ILE H H 16 7.727 7.602 0.125 1
1 89 . 17 1 1 A 16 16 ILE HA H 16 4.705 4.523 0.182 1
1 99 . 17 1 1 A 16 16 ILE C C 16 175.807 175.128 0.679 1
1 100 . 17 1 1 A 16 16 ILE CA C 16 60.703 59.917 0.786 1
1 101 . 17 1 1 A 16 16 ILE CB C 16 38.509 39.600 -1.091 1
1 105 . 17 1 1 A 16 16 ILE N N 16 120.267 120.392 -0.125 1
1 106 . 17 1 1 A 17 17 HIS H H 17 9.101 8.487 0.614 1
1 107 . 17 1 1 A 17 17 HIS HA H 17 4.782 5.428 -0.646 1
1 112 . 17 1 1 A 17 17 HIS C C 17 173.051 173.979 -0.928 1
1 113 . 17 1 1 A 17 17 HIS CA C 17 55.353 53.776 1.577 1
1 114 . 17 1 1 A 17 17 HIS CB C 17 32.468 31.936 0.532 1
1 117 . 17 1 1 A 17 17 HIS N N 17 125.061 122.696 2.365 1
1 118 . 17 1 1 A 18 18 VAL H H 18 8.427 8.731 -0.304 1
1 119 . 17 1 1 A 18 18 VAL HA H 18 4.375 4.317 0.058 1
1 127 . 17 1 1 A 18 18 VAL C C 18 174.702 175.542 -0.840 1
1 128 . 17 1 1 A 18 18 VAL CA C 18 62.035 61.562 0.473 1
1 129 . 17 1 1 A 18 18 VAL CB C 18 32.325 32.907 -0.582 1
1 132 . 17 1 1 A 18 18 VAL N N 18 127.069 121.610 5.459 1
1 133 . 17 1 1 A 19 19 THR H H 19 9.272 8.143 1.129 1
1 134 . 17 1 1 A 19 19 THR HA H 19 4.512 4.951 -0.439 1
1 139 . 17 1 1 A 19 19 THR C C 19 172.784 173.023 -0.239 1
1 140 . 17 1 1 A 19 19 THR CA C 19 62.512 61.896 0.616 1
1 141 . 17 1 1 A 19 19 THR CB C 19 70.663 70.977 -0.314 1
1 143 . 17 1 1 A 19 19 THR N N 19 126.619 117.294 9.325 1
1 144 . 17 1 1 A 20 20 ILE H H 20 8.737 9.238 -0.501 1
1 145 . 17 1 1 A 20 20 ILE HA H 20 4.870 4.612 0.258 1
1 155 . 17 1 1 A 20 20 ILE C C 20 175.315 174.587 0.728 1
1 156 . 17 1 1 A 20 20 ILE CA C 20 60.157 60.176 -0.019 1
1 157 . 17 1 1 A 20 20 ILE CB C 20 38.603 38.121 0.482 1
1 161 . 17 1 1 A 20 20 ILE N N 20 128.114 128.960 -0.846 1
1 162 . 17 1 1 A 21 21 LEU H H 21 8.902 8.856 0.046 1
1 163 . 17 1 1 A 21 21 LEU HA H 21 4.804 4.755 0.049 1
1 173 . 17 1 1 A 21 21 LEU C C 21 175.565 175.490 0.075 1
1 174 . 17 1 1 A 21 21 LEU CA C 21 52.731 53.718 -0.987 1
1 175 . 17 1 1 A 21 21 LEU CB C 21 43.947 43.208 0.739 1
1 179 . 17 1 1 A 21 21 LEU N N 21 125.457 128.595 -3.138 1
1 180 . 17 1 1 A 22 22 HIS H H 22 8.577 9.074 -0.497 1
1 181 . 17 1 1 A 22 22 HIS HA H 22 5.013 5.100 -0.087 1
1 186 . 17 1 1 A 22 22 HIS C C 22 174.258 174.735 -0.477 1
1 187 . 17 1 1 A 22 22 HIS CA C 22 55.880 54.824 1.056 1
1 188 . 17 1 1 A 22 22 HIS CB C 22 30.901 30.544 0.357 1
1 191 . 17 1 1 A 22 22 HIS N N 22 122.595 124.395 -1.800 1
1 192 . 17 1 1 A 23 23 LYS H H 23 8.712 9.596 -0.884 1
1 193 . 17 1 1 A 23 23 LYS HA H 23 4.880 4.879 0.001 1
1 202 . 17 1 1 A 23 23 LYS C C 23 174.265 174.818 -0.553 1
1 203 . 17 1 1 A 23 23 LYS CA C 23 54.314 54.348 -0.034 1
1 204 . 17 1 1 A 23 23 LYS CB C 23 36.068 35.975 0.093 1
1 208 . 17 1 1 A 23 23 LYS N N 23 120.814 121.187 -0.373 1
1 209 . 17 1 1 A 24 24 GLU H H 24 8.360 8.528 -0.168 1
1 210 . 17 1 1 A 24 24 GLU HA H 24 4.350 4.784 -0.434 1
1 215 . 17 1 1 A 24 24 GLU C C 24 177.843 176.598 1.245 1
1 216 . 17 1 1 A 24 24 GLU CA C 24 55.601 54.774 0.827 1
1 217 . 17 1 1 A 24 24 GLU CB C 24 30.512 32.388 -1.876 1
1 219 . 17 1 1 A 24 24 GLU N N 24 117.859 119.316 -1.457 1
1 220 . 17 1 1 A 25 25 GLU H H 25 9.146 8.786 0.360 1
1 221 . 17 1 1 A 25 25 GLU HA H 25 3.924 4.334 -0.410 1
1 226 . 17 1 1 A 25 25 GLU C C 25 177.809 177.512 0.297 1
1 227 . 17 1 1 A 25 25 GLU CA C 25 58.568 58.512 0.056 1
1 228 . 17 1 1 A 25 25 GLU CB C 25 29.313 29.015 0.298 1
1 230 . 17 1 1 A 25 25 GLU N N 25 124.543 121.532 3.011 1
1 231 . 17 1 1 A 26 26 GLY H H 26 8.242 8.888 -0.646 1
1 232 . 17 1 1 A 26 26 GLY HA2 H 26 4.287 4.049 0.238 1
1 233 . 17 1 1 A 26 26 GLY HA3 H 26 3.407 4.050 -0.643 1
1 234 . 17 1 1 A 26 26 GLY C C 26 174.234 175.163 -0.929 1
1 235 . 17 1 1 A 26 26 GLY CA C 26 46.113 45.987 0.126 1
1 236 . 17 1 1 A 26 26 GLY N N 26 115.394 114.134 1.260 1
1 237 . 17 1 1 A 27 27 ALA H H 27 7.432 8.067 -0.635 1
1 238 . 17 1 1 A 27 27 ALA HA H 27 4.402 4.303 0.099 1
1 242 . 17 1 1 A 27 27 ALA C C 27 178.138 178.029 0.109 1
1 243 . 17 1 1 A 27 27 ALA CA C 27 52.273 52.871 -0.598 1
1 244 . 17 1 1 A 27 27 ALA CB C 27 20.214 19.856 0.358 1
1 245 . 17 1 1 A 27 27 ALA N N 27 122.323 122.092 0.231 1
1 246 . 17 1 1 A 28 28 GLY H H 28 8.624 7.805 0.819 1
1 247 . 17 1 1 A 28 28 GLY HA2 H 28 4.134 4.084 0.050 1
1 248 . 17 1 1 A 28 28 GLY HA3 H 28 3.953 4.122 -0.169 1
1 249 . 17 1 1 A 28 28 GLY C C 28 174.069 174.780 -0.711 1
1 250 . 17 1 1 A 28 28 GLY CA C 28 44.546 44.492 0.054 1
1 251 . 17 1 1 A 28 28 GLY N N 28 107.593 105.454 2.139 1
1 252 . 17 1 1 A 29 29 LEU H H 29 7.934 8.559 -0.625 1
1 253 . 17 1 1 A 29 29 LEU HA H 29 4.059 4.427 -0.368 1
1 263 . 17 1 1 A 29 29 LEU C C 29 177.548 176.952 0.596 1
1 264 . 17 1 1 A 29 29 LEU CA C 29 56.298 56.120 0.178 1
1 265 . 17 1 1 A 29 29 LEU CB C 29 41.940 42.875 -0.935 1
1 269 . 17 1 1 A 29 29 LEU N N 29 115.495 121.198 -5.703 1
1 270 . 17 1 1 A 30 30 GLY H H 30 8.669 8.066 0.603 1
1 271 . 17 1 1 A 30 30 GLY HA2 H 30 4.264 4.097 0.167 1
1 272 . 17 1 1 A 30 30 GLY HA3 H 30 4.001 4.232 -0.231 1
1 273 . 17 1 1 A 30 30 GLY C C 30 175.296 173.065 2.231 1
1 274 . 17 1 1 A 30 30 GLY CA C 30 46.368 45.088 1.280 1
1 275 . 17 1 1 A 30 30 GLY N N 30 103.121 106.080 -2.959 1
1 276 . 17 1 1 A 31 31 PHE H H 31 7.044 7.394 -0.350 1
1 277 . 17 1 1 A 31 31 PHE HA H 31 4.541 4.425 0.116 1
1 285 . 17 1 1 A 31 31 PHE C C 31 171.141 172.681 -1.540 1
1 286 . 17 1 1 A 31 31 PHE CA C 31 55.704 55.238 0.466 1
1 287 . 17 1 1 A 31 31 PHE CB C 31 40.745 41.822 -1.077 1
1 293 . 17 1 1 A 31 31 PHE N N 31 115.404 115.272 0.132 1
1 294 . 17 1 1 A 32 32 SER H H 32 8.752 8.877 -0.125 1
1 295 . 17 1 1 A 32 32 SER HA H 32 4.990 4.959 0.031 1
1 298 . 17 1 1 A 32 32 SER C C 32 175.049 173.418 1.631 1
1 299 . 17 1 1 A 32 32 SER CA C 32 55.001 56.004 -1.003 1
1 300 . 17 1 1 A 32 32 SER CB C 32 67.170 66.313 0.857 1
1 301 . 17 1 1 A 32 32 SER N N 32 113.639 114.065 -0.426 1
1 302 . 17 1 1 A 33 33 LEU H H 33 8.639 8.440 0.199 1
1 303 . 17 1 1 A 33 33 LEU HA H 33 5.573 5.396 0.177 1
1 313 . 17 1 1 A 33 33 LEU C C 33 175.827 175.760 0.067 1
1 314 . 17 1 1 A 33 33 LEU CA C 33 53.620 53.520 0.100 1
1 315 . 17 1 1 A 33 33 LEU CB C 33 45.399 45.263 0.136 1
1 319 . 17 1 1 A 33 33 LEU N N 33 118.936 120.137 -1.201 1
1 320 . 17 1 1 A 34 34 ALA H H 34 9.410 8.917 0.493 1
1 321 . 17 1 1 A 34 34 ALA HA H 34 4.749 5.058 -0.309 1
1 325 . 17 1 1 A 34 34 ALA C C 34 176.231 176.782 -0.551 1
1 326 . 17 1 1 A 34 34 ALA CA C 34 50.425 51.249 -0.824 1
1 327 . 17 1 1 A 34 34 ALA CB C 34 22.518 22.974 -0.456 1
1 328 . 17 1 1 A 34 34 ALA N N 34 124.395 121.837 2.558 1
1 329 . 17 1 1 A 35 35 GLY H H 35 8.130 8.438 -0.308 1
1 330 . 17 1 1 A 35 35 GLY HA2 H 35 4.712 4.037 0.675 1
1 331 . 17 1 1 A 35 35 GLY HA3 H 35 3.955 4.096 -0.141 1
1 332 . 17 1 1 A 35 35 GLY C C 35 174.750 172.940 1.810 1
1 333 . 17 1 1 A 35 35 GLY CA C 35 44.494 44.848 -0.354 1
1 334 . 17 1 1 A 35 35 GLY N N 35 103.650 107.515 -3.865 1
1 335 . 17 1 1 A 36 36 GLY H H 36 8.217 7.847 0.370 1
1 336 . 17 1 1 A 36 36 GLY HA2 H 36 4.494 4.318 0.176 1
1 337 . 17 1 1 A 36 36 GLY HA3 H 36 3.836 4.336 -0.500 1
1 338 . 17 1 1 A 36 36 GLY C C 36 174.410 174.164 0.246 1
1 339 . 17 1 1 A 36 36 GLY CA C 36 45.462 45.906 -0.444 1
1 340 . 17 1 1 A 36 36 GLY N N 36 122.114 107.750 14.364 1
1 341 . 17 1 1 A 37 37 ALA H H 37 8.963 8.564 0.399 1
1 342 . 17 1 1 A 37 37 ALA HA H 37 3.998 4.034 -0.036 1
1 346 . 17 1 1 A 37 37 ALA C C 37 176.935 179.118 -2.183 1
1 347 . 17 1 1 A 37 37 ALA CA C 37 55.308 54.606 0.702 1
1 348 . 17 1 1 A 37 37 ALA CB C 37 18.822 18.305 0.517 1
1 349 . 17 1 1 A 37 37 ALA N N 37 123.418 122.284 1.134 1
1 350 . 17 1 1 A 38 38 ASP H H 38 10.586 8.207 2.379 1
1 351 . 17 1 1 A 38 38 ASP HA H 38 4.485 4.334 0.151 1
1 354 . 17 1 1 A 38 38 ASP C C 38 175.309 176.534 -1.225 1
1 355 . 17 1 1 A 38 38 ASP CA C 38 52.730 56.417 -3.687 1
1 356 . 17 1 1 A 38 38 ASP CB C 38 38.689 41.019 -2.330 1
1 357 . 17 1 1 A 38 38 ASP N N 38 111.480 117.691 -6.211 1
1 358 . 17 1 1 A 39 39 LEU H H 39 7.789 7.603 0.186 1
1 359 . 17 1 1 A 39 39 LEU HA H 39 4.699 4.300 0.399 1
1 369 . 17 1 1 A 39 39 LEU C C 39 176.377 177.990 -1.613 1
1 370 . 17 1 1 A 39 39 LEU CA C 39 52.952 54.285 -1.333 1
1 371 . 17 1 1 A 39 39 LEU CB C 39 43.294 41.975 1.319 1
1 375 . 17 1 1 A 39 39 LEU N N 39 122.545 121.241 1.304 1
1 376 . 17 1 1 A 40 40 GLU H H 40 8.331 8.618 -0.287 1
1 377 . 17 1 1 A 40 40 GLU HA H 40 3.978 4.090 -0.112 1
1 382 . 17 1 1 A 40 40 GLU C C 40 176.887 177.063 -0.176 1
1 383 . 17 1 1 A 40 40 GLU CA C 40 59.066 59.494 -0.428 1
1 384 . 17 1 1 A 40 40 GLU CB C 40 29.523 29.939 -0.416 1
1 386 . 17 1 1 A 40 40 GLU N N 40 118.036 120.561 -2.525 1
1 387 . 17 1 1 A 41 41 ASN H H 41 7.890 7.980 -0.090 1
1 388 . 17 1 1 A 41 41 ASN HA H 41 4.820 4.747 0.073 1
1 393 . 17 1 1 A 41 41 ASN CA C 41 52.316 52.498 -0.182 1
1 394 . 17 1 1 A 41 41 ASN CB C 41 37.409 38.218 -0.809 1
1 395 . 17 1 1 A 41 41 ASN N N 41 115.196 116.098 -0.902 1
1 397 . 17 1 1 A 42 42 LYS H H 42 7.943 8.658 -0.715 1
1 398 . 17 1 1 A 42 42 LYS HA H 42 4.328 4.255 0.073 1
1 407 . 17 1 1 A 42 42 LYS C C 42 177.081 177.070 0.011 1
1 408 . 17 1 1 A 42 42 LYS CA C 42 56.567 59.109 -2.542 1
1 409 . 17 1 1 A 42 42 LYS CB C 42 33.120 32.740 0.380 1
1 413 . 17 1 1 A 42 42 LYS N N 42 120.612 125.451 -4.839 1
1 414 . 17 1 1 A 43 43 VAL H H 43 7.456 7.584 -0.128 1
1 415 . 17 1 1 A 43 43 VAL HA H 43 4.059 4.139 -0.080 1
1 423 . 17 1 1 A 43 43 VAL CA C 43 61.330 62.116 -0.786 1
1 424 . 17 1 1 A 43 43 VAL CB C 43 32.819 32.540 0.279 1
1 427 . 17 1 1 A 43 43 VAL N N 43 118.284 119.089 -0.805 1
1 428 . 17 1 1 A 44 44 ILE H H 44 8.481 8.488 -0.007 1
1 429 . 17 1 1 A 44 44 ILE HA H 44 4.913 4.578 0.335 1
1 439 . 17 1 1 A 44 44 ILE C C 44 176.719 175.631 1.088 1
1 440 . 17 1 1 A 44 44 ILE CA C 44 59.946 61.753 -1.807 1
1 441 . 17 1 1 A 44 44 ILE CB C 44 35.784 38.544 -2.760 1
1 445 . 17 1 1 A 44 44 ILE N N 44 127.089 128.312 -1.223 1
1 446 . 17 1 1 A 45 45 THR H H 45 8.906 9.412 -0.506 1
1 447 . 17 1 1 A 45 45 THR HA H 45 5.400 5.157 0.243 1
1 452 . 17 1 1 A 45 45 THR CA C 45 58.528 59.297 -0.769 1
1 453 . 17 1 1 A 45 45 THR CB C 45 73.760 72.162 1.598 1
1 455 . 17 1 1 A 45 45 THR N N 45 116.832 116.183 0.649 1
1 456 . 17 1 1 A 46 46 VAL H H 46 8.336 8.518 -0.182 1
1 457 . 17 1 1 A 46 46 VAL HA H 46 4.059 4.286 -0.227 1
1 465 . 17 1 1 A 46 46 VAL C C 46 176.648 176.552 0.096 1
1 466 . 17 1 1 A 46 46 VAL CA C 46 63.058 62.856 0.202 1
1 467 . 17 1 1 A 46 46 VAL CB C 46 31.601 30.838 0.763 1
1 470 . 17 1 1 A 46 46 VAL N N 46 118.542 122.730 -4.188 1
1 471 . 17 1 1 A 47 47 HIS H H 47 9.382 8.921 0.461 1
1 472 . 17 1 1 A 47 47 HIS HA H 47 4.628 4.182 0.446 1
1 477 . 17 1 1 A 47 47 HIS C C 47 174.339 174.224 0.115 1
1 478 . 17 1 1 A 47 47 HIS CA C 47 57.764 60.118 -2.354 1
1 479 . 17 1 1 A 47 47 HIS CB C 47 31.453 30.716 0.737 1
1 482 . 17 1 1 A 47 47 HIS N N 47 133.900 128.389 5.511 1
1 483 . 17 1 1 A 48 48 ARG H H 48 7.135 7.750 -0.615 1
1 484 . 17 1 1 A 48 48 ARG HA H 48 4.360 4.809 -0.449 1
1 491 . 17 1 1 A 48 48 ARG C C 48 173.877 174.669 -0.792 1
1 492 . 17 1 1 A 48 48 ARG CA C 48 54.385 54.847 -0.462 1
1 493 . 17 1 1 A 48 48 ARG CB C 48 33.996 34.918 -0.922 1
1 496 . 17 1 1 A 48 48 ARG N N 48 114.736 117.819 -3.083 1
1 497 . 17 1 1 A 49 49 VAL H H 49 8.690 8.605 0.085 1
1 498 . 17 1 1 A 49 49 VAL HA H 49 4.015 4.448 -0.433 1
1 506 . 17 1 1 A 49 49 VAL C C 49 176.255 175.473 0.782 1
1 507 . 17 1 1 A 49 49 VAL CA C 49 61.882 61.636 0.246 1
1 508 . 17 1 1 A 49 49 VAL CB C 49 32.261 33.527 -1.266 1
1 511 . 17 1 1 A 49 49 VAL N N 49 122.844 122.620 0.224 1
1 512 . 17 1 1 A 50 50 PHE H H 50 7.866 8.290 -0.424 1
1 513 . 17 1 1 A 50 50 PHE HA H 50 4.866 4.510 0.356 1
1 521 . 17 1 1 A 50 50 PHE C C 50 174.847 176.309 -1.462 1
1 522 . 17 1 1 A 50 50 PHE CA C 50 54.596 57.521 -2.925 1
1 523 . 17 1 1 A 50 50 PHE CB C 50 36.558 39.120 -2.562 1
1 529 . 17 1 1 A 50 50 PHE N N 50 128.498 127.137 1.361 1
1 530 . 17 1 1 A 51 51 PRO HA H 51 4.386 4.551 -0.165 1
1 537 . 17 1 1 A 51 51 PRO C C 51 177.321 176.636 0.685 1
1 538 . 17 1 1 A 51 51 PRO CA C 51 64.381 64.544 -0.163 1
1 539 . 17 1 1 A 51 51 PRO CB C 51 31.773 32.229 -0.456 1
1 542 . 17 1 1 A 52 52 ASN H H 52 8.814 8.537 0.277 1
1 543 . 17 1 1 A 52 52 ASN HA H 52 4.496 5.002 -0.506 1
1 548 . 17 1 1 A 52 52 ASN C C 52 174.823 174.730 0.093 1
1 549 . 17 1 1 A 52 52 ASN CA C 52 54.719 52.221 2.498 1
1 550 . 17 1 1 A 52 52 ASN CB C 52 38.109 39.157 -1.048 1
1 551 . 17 1 1 A 52 52 ASN N N 52 116.145 116.478 -0.333 1
1 553 . 17 1 1 A 53 53 GLY H H 53 7.730 8.283 -0.553 1
1 554 . 17 1 1 A 53 53 GLY HA2 H 53 4.430 4.384 0.046 1
1 555 . 17 1 1 A 53 53 GLY HA3 H 53 4.089 4.410 -0.321 1
1 556 . 17 1 1 A 53 53 GLY C C 53 174.810 174.093 0.717 1
1 557 . 17 1 1 A 53 53 GLY CA C 53 44.987 45.912 -0.925 1
1 558 . 17 1 1 A 53 53 GLY N N 53 106.196 110.703 -4.507 1
1 559 . 17 1 1 A 54 54 LEU H H 54 8.764 8.918 -0.154 1
1 560 . 17 1 1 A 54 54 LEU HA H 54 4.041 4.278 -0.237 1
1 570 . 17 1 1 A 54 54 LEU C C 54 179.712 178.720 0.992 1
1 571 . 17 1 1 A 54 54 LEU CA C 54 58.310 57.674 0.636 1
1 572 . 17 1 1 A 54 54 LEU CB C 54 42.390 42.170 0.220 1
1 576 . 17 1 1 A 54 54 LEU N N 54 118.836 119.227 -0.391 1
1 577 . 17 1 1 A 55 55 ALA H H 55 7.593 8.174 -0.581 1
1 578 . 17 1 1 A 55 55 ALA HA H 55 4.275 3.903 0.372 1
1 582 . 17 1 1 A 55 55 ALA C C 55 181.307 179.216 2.091 1
1 583 . 17 1 1 A 55 55 ALA CA C 55 54.825 54.808 0.017 1
1 584 . 17 1 1 A 55 55 ALA CB C 55 18.345 18.554 -0.209 1
1 585 . 17 1 1 A 55 55 ALA N N 55 118.782 121.584 -2.802 1
1 586 . 17 1 1 A 56 56 SER H H 56 9.339 7.708 1.631 1
1 587 . 17 1 1 A 56 56 SER HA H 56 4.023 4.350 -0.327 1
1 589 . 17 1 1 A 56 56 SER C C 56 176.392 177.084 -0.692 1
1 590 . 17 1 1 A 56 56 SER CA C 56 60.984 61.469 -0.485 1
1 591 . 17 1 1 A 56 56 SER CB C 56 62.987 63.087 -0.100 1
1 592 . 17 1 1 A 56 56 SER N N 56 117.631 112.864 4.767 1
1 593 . 17 1 1 A 57 57 GLN H H 57 7.942 7.465 0.477 1
1 594 . 17 1 1 A 57 57 GLN HA H 57 4.034 4.026 0.008 1
1 601 . 17 1 1 A 57 57 GLN C C 57 177.400 178.564 -1.164 1
1 602 . 17 1 1 A 57 57 GLN CA C 57 58.362 58.788 -0.426 1
1 603 . 17 1 1 A 57 57 GLN CB C 57 28.801 28.601 0.200 1
1 605 . 17 1 1 A 57 57 GLN N N 57 118.162 121.844 -3.682 1
1 607 . 17 1 1 A 58 58 GLU H H 58 7.683 8.703 -1.020 1
1 608 . 17 1 1 A 58 58 GLU HA H 58 4.163 4.063 0.100 1
1 613 . 17 1 1 A 58 58 GLU C C 58 179.248 176.914 2.334 1
1 614 . 17 1 1 A 58 58 GLU CA C 58 59.559 58.313 1.246 1
1 615 . 17 1 1 A 58 58 GLU CB C 58 29.317 29.861 -0.544 1
1 617 . 17 1 1 A 58 58 GLU N N 58 119.877 118.489 1.388 1
1 618 . 17 1 1 A 59 59 GLY H H 59 7.446 7.350 0.096 1
1 619 . 17 1 1 A 59 59 GLY HA2 H 59 4.100 3.985 0.115 1
1 620 . 17 1 1 A 59 59 GLY HA3 H 59 3.770 3.992 -0.222 1
1 621 . 17 1 1 A 59 59 GLY C C 59 175.432 175.725 -0.293 1
1 622 . 17 1 1 A 59 59 GLY CA C 59 46.817 45.327 1.490 1
1 623 . 17 1 1 A 59 59 GLY N N 59 102.653 107.409 -4.756 1
1 624 . 17 1 1 A 60 60 THR H H 60 8.343 8.063 0.280 1
1 625 . 17 1 1 A 60 60 THR HA H 60 4.037 4.197 -0.160 1
1 630 . 17 1 1 A 60 60 THR C C 60 175.843 174.845 0.998 1
1 631 . 17 1 1 A 60 60 THR CA C 60 64.792 65.648 -0.856 1
1 632 . 17 1 1 A 60 60 THR CB C 60 69.325 69.025 0.300 1
1 634 . 17 1 1 A 60 60 THR N N 60 113.863 113.689 0.174 1
1 635 . 17 1 1 A 61 61 ILE H H 61 8.802 7.687 1.115 1
1 636 . 17 1 1 A 61 61 ILE HA H 61 3.631 4.078 -0.447 1
1 646 . 17 1 1 A 61 61 ILE C C 61 174.198 174.427 -0.229 1
1 647 . 17 1 1 A 61 61 ILE CA C 61 62.938 60.939 1.999 1
1 648 . 17 1 1 A 61 61 ILE CB C 61 37.225 36.188 1.037 1
1 652 . 17 1 1 A 61 61 ILE N N 61 126.153 119.418 6.735 1
1 653 . 17 1 1 A 62 62 GLN H H 62 7.124 9.532 -2.408 1
1 654 . 17 1 1 A 62 62 GLN HA H 62 4.500 4.606 -0.106 1
1 661 . 17 1 1 A 62 62 GLN C C 62 174.556 175.427 -0.871 1
1 662 . 17 1 1 A 62 62 GLN CA C 62 53.364 54.372 -1.008 1
1 663 . 17 1 1 A 62 62 GLN CB C 62 32.196 30.997 1.199 1
1 665 . 17 1 1 A 62 62 GLN N N 62 123.730 126.473 -2.743 1
1 667 . 17 1 1 A 63 63 LYS H H 63 8.399 8.636 -0.237 1
1 668 . 17 1 1 A 63 63 LYS HA H 63 3.464 4.187 -0.723 1
1 677 . 17 1 1 A 63 63 LYS CA C 63 57.905 58.328 -0.423 1
1 678 . 17 1 1 A 63 63 LYS CB C 63 32.260 32.086 0.174 1
1 682 . 17 1 1 A 63 63 LYS N N 63 121.381 124.711 -3.330 1
1 683 . 17 1 1 A 64 64 GLY H H 64 9.265 8.648 0.617 1
1 684 . 17 1 1 A 64 64 GLY HA2 H 64 4.415 4.048 0.367 1
1 685 . 17 1 1 A 64 64 GLY HA3 H 64 3.639 4.054 -0.415 1
1 686 . 17 1 1 A 64 64 GLY CA C 64 44.881 45.052 -0.171 1
1 687 . 17 1 1 A 64 64 GLY N N 64 113.750 115.152 -1.402 1
1 688 . 17 1 1 A 65 65 ASN H H 65 7.594 8.406 -0.812 1
1 689 . 17 1 1 A 65 65 ASN HA H 65 4.798 4.810 -0.012 1
1 694 . 17 1 1 A 65 65 ASN C C 65 175.042 173.890 1.152 1
1 695 . 17 1 1 A 65 65 ASN CA C 65 53.047 53.325 -0.278 1
1 696 . 17 1 1 A 65 65 ASN CB C 65 38.153 40.159 -2.006 1
1 697 . 17 1 1 A 65 65 ASN N N 65 117.999 119.884 -1.885 1
1 699 . 17 1 1 A 66 66 GLU H H 66 8.538 8.512 0.026 1
1 700 . 17 1 1 A 66 66 GLU HA H 66 4.634 4.784 -0.150 1
1 705 . 17 1 1 A 66 66 GLU C C 66 176.620 175.144 1.476 1
1 706 . 17 1 1 A 66 66 GLU CA C 66 55.863 54.747 1.116 1
1 707 . 17 1 1 A 66 66 GLU CB C 66 30.899 31.598 -0.699 1
1 709 . 17 1 1 A 66 66 GLU N N 66 122.233 121.762 0.471 1
1 710 . 17 1 1 A 67 67 VAL H H 67 8.452 8.942 -0.490 1
1 711 . 17 1 1 A 67 67 VAL HA H 67 4.172 4.118 0.054 1
1 719 . 17 1 1 A 67 67 VAL C C 67 174.641 175.457 -0.816 1
1 720 . 17 1 1 A 67 67 VAL CA C 67 61.856 62.988 -1.132 1
1 721 . 17 1 1 A 67 67 VAL CB C 67 31.066 31.191 -0.125 1
1 724 . 17 1 1 A 67 67 VAL N N 67 126.311 127.794 -1.483 1
1 725 . 17 1 1 A 68 68 LEU H H 68 9.000 8.772 0.228 1
1 726 . 17 1 1 A 68 68 LEU HA H 68 4.390 4.221 0.169 1
1 736 . 17 1 1 A 68 68 LEU C C 68 178.924 176.943 1.981 1
1 737 . 17 1 1 A 68 68 LEU CA C 68 56.990 56.535 0.455 1
1 738 . 17 1 1 A 68 68 LEU CB C 68 42.392 42.618 -0.226 1
1 742 . 17 1 1 A 68 68 LEU N N 68 127.175 129.702 -2.527 1
1 743 . 17 1 1 A 69 69 SER H H 69 7.666 7.725 -0.059 1
1 744 . 17 1 1 A 69 69 SER HA H 69 5.144 4.905 0.239 1
1 747 . 17 1 1 A 69 69 SER C C 69 172.722 172.240 0.482 1
1 748 . 17 1 1 A 69 69 SER CA C 69 57.606 57.322 0.284 1
1 749 . 17 1 1 A 69 69 SER CB C 69 64.511 66.328 -1.817 1
1 750 . 17 1 1 A 69 69 SER N N 69 110.346 108.883 1.463 1
1 751 . 17 1 1 A 70 70 ILE H H 70 7.965 8.408 -0.443 1
1 752 . 17 1 1 A 70 70 ILE HA H 70 4.548 4.863 -0.315 1
1 762 . 17 1 1 A 70 70 ILE C C 70 174.993 175.905 -0.912 1
1 763 . 17 1 1 A 70 70 ILE CA C 70 60.897 60.176 0.721 1
1 764 . 17 1 1 A 70 70 ILE CB C 70 41.186 40.465 0.721 1
1 768 . 17 1 1 A 70 70 ILE N N 70 119.579 120.773 -1.194 1
1 769 . 17 1 1 A 71 71 ASN H H 71 9.839 10.707 -0.868 1
1 770 . 17 1 1 A 71 71 ASN HA H 71 4.485 4.444 0.041 1
1 775 . 17 1 1 A 71 71 ASN C C 71 174.975 175.357 -0.382 1
1 776 . 17 1 1 A 71 71 ASN CA C 71 54.085 54.436 -0.351 1
1 777 . 17 1 1 A 71 71 ASN CB C 71 36.255 36.854 -0.599 1
1 778 . 17 1 1 A 71 71 ASN N N 71 126.963 127.362 -0.399 1
1 780 . 17 1 1 A 72 72 GLY H H 72 8.911 8.410 0.501 1
1 781 . 17 1 1 A 72 72 GLY HA2 H 72 4.149 3.899 0.250 1
1 782 . 17 1 1 A 72 72 GLY HA3 H 72 3.507 3.901 -0.394 1
1 783 . 17 1 1 A 72 72 GLY C C 72 173.594 173.679 -0.085 1
1 784 . 17 1 1 A 72 72 GLY CA C 72 45.162 45.297 -0.135 1
1 785 . 17 1 1 A 72 72 GLY N N 72 103.020 105.270 -2.250 1
1 786 . 17 1 1 A 73 73 LYS H H 73 7.922 7.873 0.049 1
1 787 . 17 1 1 A 73 73 LYS HA H 73 4.485 4.576 -0.091 1
1 796 . 17 1 1 A 73 73 LYS C C 73 175.036 175.671 -0.635 1
1 797 . 17 1 1 A 73 73 LYS CA C 73 54.719 55.415 -0.696 1
1 798 . 17 1 1 A 73 73 LYS CB C 73 32.137 33.485 -1.348 1
1 802 . 17 1 1 A 73 73 LYS N N 73 122.413 122.728 -0.315 1
1 803 . 17 1 1 A 74 74 SER H H 74 8.585 8.693 -0.108 1
1 804 . 17 1 1 A 74 74 SER HA H 74 4.452 4.667 -0.215 1
1 807 . 17 1 1 A 74 74 SER C C 74 175.965 174.212 1.753 1
1 808 . 17 1 1 A 74 74 SER CA C 74 58.028 58.661 -0.633 1
1 809 . 17 1 1 A 74 74 SER CB C 74 63.799 63.851 -0.052 1
1 810 . 17 1 1 A 74 74 SER N N 74 118.737 124.153 -5.416 1
1 811 . 17 1 1 A 75 75 LEU H H 75 8.015 8.212 -0.197 1
1 812 . 17 1 1 A 75 75 LEU HA H 75 4.661 4.478 0.183 1
1 822 . 17 1 1 A 75 75 LEU C C 75 178.117 177.606 0.511 1
1 823 . 17 1 1 A 75 75 LEU CA C 75 53.980 54.611 -0.631 1
1 824 . 17 1 1 A 75 75 LEU CB C 75 40.830 41.082 -0.252 1
1 828 . 17 1 1 A 75 75 LEU N N 75 125.425 125.628 -0.203 1
1 829 . 17 1 1 A 76 76 LYS H H 76 8.099 8.600 -0.501 1
1 830 . 17 1 1 A 76 76 LYS HA H 76 4.210 4.415 -0.205 1
1 839 . 17 1 1 A 76 76 LYS C C 76 178.487 176.754 1.733 1
1 840 . 17 1 1 A 76 76 LYS CA C 76 58.010 55.468 2.542 1
1 841 . 17 1 1 A 76 76 LYS CB C 76 31.683 31.650 0.033 1
1 845 . 17 1 1 A 76 76 LYS N N 76 124.064 120.339 3.725 1
1 846 . 17 1 1 A 77 77 GLY H H 77 8.859 7.828 1.031 1
1 847 . 17 1 1 A 77 77 GLY HA2 H 77 4.110 4.042 0.068 1
1 848 . 17 1 1 A 77 77 GLY HA3 H 77 3.869 4.044 -0.175 1
1 849 . 17 1 1 A 77 77 GLY C C 77 174.335 174.814 -0.479 1
1 850 . 17 1 1 A 77 77 GLY CA C 77 46.232 45.039 1.193 1
1 851 . 17 1 1 A 77 77 GLY N N 77 115.659 108.711 6.948 1
1 852 . 17 1 1 A 78 78 THR H H 78 7.654 7.735 -0.081 1
1 853 . 17 1 1 A 78 78 THR HA H 78 4.624 4.131 0.493 1
1 858 . 17 1 1 A 78 78 THR C C 78 177.272 174.724 2.548 1
1 859 . 17 1 1 A 78 78 THR CA C 78 61.794 63.242 -1.448 1
1 860 . 17 1 1 A 78 78 THR CB C 78 70.595 69.186 1.409 1
1 862 . 17 1 1 A 78 78 THR N N 78 112.847 116.561 -3.714 1
1 863 . 17 1 1 A 79 79 THR H H 79 8.813 8.551 0.262 1
1 864 . 17 1 1 A 79 79 THR HA H 79 4.395 4.736 -0.341 1
1 869 . 17 1 1 A 79 79 THR C C 79 174.503 175.382 -0.879 1
1 870 . 17 1 1 A 79 79 THR CA C 79 61.724 60.809 0.915 1
1 871 . 17 1 1 A 79 79 THR CB C 79 71.007 70.972 0.035 1
1 873 . 17 1 1 A 79 79 THR N N 79 114.123 117.886 -3.763 1
1 874 . 17 1 1 A 80 80 HIS H H 80 10.266 9.205 1.061 1
1 875 . 17 1 1 A 80 80 HIS HA H 80 4.331 4.227 0.104 1
1 880 . 17 1 1 A 80 80 HIS C C 80 177.075 176.761 0.314 1
1 881 . 17 1 1 A 80 80 HIS CA C 80 61.338 60.145 1.193 1
1 882 . 17 1 1 A 80 80 HIS CB C 80 28.651 30.730 -2.079 1
1 885 . 17 1 1 A 80 80 HIS N N 80 122.776 121.920 0.856 1
1 886 . 17 1 1 A 81 81 HIS H H 81 9.335 8.180 1.155 1
1 887 . 17 1 1 A 81 81 HIS HA H 81 4.078 4.037 0.041 1
1 892 . 17 1 1 A 81 81 HIS C C 81 178.269 176.496 1.773 1
1 893 . 17 1 1 A 81 81 HIS CA C 81 60.210 59.848 0.362 1
1 894 . 17 1 1 A 81 81 HIS CB C 81 29.569 29.947 -0.378 1
1 897 . 17 1 1 A 81 81 HIS N N 81 114.733 118.937 -4.204 1
1 898 . 17 1 1 A 82 82 ASP H H 82 7.741 7.901 -0.160 1
1 899 . 17 1 1 A 82 82 ASP HA H 82 4.452 3.738 0.714 1
1 902 . 17 1 1 A 82 82 ASP C C 82 178.683 178.556 0.127 1
1 903 . 17 1 1 A 82 82 ASP CA C 82 57.148 56.902 0.246 1
1 904 . 17 1 1 A 82 82 ASP CB C 82 39.522 40.360 -0.838 1
1 905 . 17 1 1 A 82 82 ASP N N 82 121.407 117.805 3.602 1
1 906 . 17 1 1 A 83 83 ALA H H 83 8.502 8.176 0.326 1
1 907 . 17 1 1 A 83 83 ALA HA H 83 3.939 4.182 -0.243 1
1 911 . 17 1 1 A 83 83 ALA C C 83 179.361 179.424 -0.063 1
1 912 . 17 1 1 A 83 83 ALA CA C 83 55.635 54.462 1.173 1
1 913 . 17 1 1 A 83 83 ALA CB C 83 18.124 18.719 -0.595 1
1 914 . 17 1 1 A 83 83 ALA N N 83 125.049 122.492 2.557 1
1 915 . 17 1 1 A 84 84 LEU H H 84 8.100 8.750 -0.650 1
1 916 . 17 1 1 A 84 84 LEU HA H 84 3.792 3.818 -0.026 1
1 926 . 17 1 1 A 84 84 LEU C C 84 180.173 179.007 1.166 1
1 927 . 17 1 1 A 84 84 LEU CA C 84 57.932 57.945 -0.013 1
1 928 . 17 1 1 A 84 84 LEU CB C 84 41.157 41.505 -0.348 1
1 932 . 17 1 1 A 84 84 LEU N N 84 117.139 118.475 -1.336 1
1 933 . 17 1 1 A 85 85 ALA H H 85 7.715 8.718 -1.003 1
1 934 . 17 1 1 A 85 85 ALA HA H 85 4.061 4.095 -0.034 1
1 938 . 17 1 1 A 85 85 ALA C C 85 180.380 179.567 0.813 1
1 939 . 17 1 1 A 85 85 ALA CA C 85 55.212 55.374 -0.162 1
1 940 . 17 1 1 A 85 85 ALA CB C 85 17.803 18.557 -0.754 1
1 941 . 17 1 1 A 85 85 ALA N N 85 122.448 121.335 1.113 1
1 942 . 17 1 1 A 86 86 ILE H H 86 7.669 7.751 -0.082 1
1 943 . 17 1 1 A 86 86 ILE HA H 86 3.678 3.682 -0.004 1
1 953 . 17 1 1 A 86 86 ILE C C 86 178.692 178.610 0.082 1
1 954 . 17 1 1 A 86 86 ILE CA C 86 65.226 64.618 0.608 1
1 955 . 17 1 1 A 86 86 ILE CB C 86 38.099 37.749 0.350 1
1 959 . 17 1 1 A 86 86 ILE N N 86 121.804 117.785 4.019 1
1 960 . 17 1 1 A 87 87 LEU H H 87 7.922 8.454 -0.532 1
1 961 . 17 1 1 A 87 87 LEU HA H 87 3.903 4.002 -0.099 1
1 971 . 17 1 1 A 87 87 LEU C C 87 178.610 178.746 -0.136 1
1 972 . 17 1 1 A 87 87 LEU CA C 87 58.221 58.157 0.064 1
1 973 . 17 1 1 A 87 87 LEU CB C 87 42.344 41.347 0.997 1
1 977 . 17 1 1 A 87 87 LEU N N 87 121.947 121.594 0.353 1
1 978 . 17 1 1 A 88 88 ARG H H 88 8.317 8.370 -0.053 1
1 979 . 17 1 1 A 88 88 ARG HA H 88 4.060 4.204 -0.144 1
1 986 . 17 1 1 A 88 88 ARG C C 88 180.698 177.249 3.449 1
1 987 . 17 1 1 A 88 88 ARG CA C 88 59.383 58.456 0.927 1
1 988 . 17 1 1 A 88 88 ARG CB C 88 30.055 29.924 0.131 1
1 991 . 17 1 1 A 88 88 ARG N N 88 119.343 119.667 -0.324 1
1 992 . 17 1 1 A 89 89 GLN H H 89 8.270 7.722 0.548 1
1 993 . 17 1 1 A 89 89 GLN HA H 89 4.122 4.217 -0.095 1
1 1000 . 17 1 1 A 89 89 GLN C C 89 177.955 178.313 -0.358 1
1 1001 . 17 1 1 A 89 89 GLN CA C 89 58.714 57.598 1.116 1
1 1002 . 17 1 1 A 89 89 GLN CB C 89 28.160 29.168 -1.008 1
1 1004 . 17 1 1 A 89 89 GLN N N 89 121.097 117.516 3.581 1
1 1006 . 17 1 1 A 90 90 ALA H H 90 7.558 7.607 -0.049 1
1 1007 . 17 1 1 A 90 90 ALA HA H 90 4.123 4.193 -0.070 1
1 1011 . 17 1 1 A 90 90 ALA C C 90 178.076 177.873 0.203 1
1 1012 . 17 1 1 A 90 90 ALA CA C 90 52.942 53.810 -0.868 1
1 1013 . 17 1 1 A 90 90 ALA CB C 90 18.015 18.319 -0.304 1
1 1014 . 17 1 1 A 90 90 ALA N N 90 119.652 121.600 -1.948 1
1 1015 . 17 1 1 A 91 91 ARG H H 91 7.768 7.681 0.087 1
1 1016 . 17 1 1 A 91 91 ARG HA H 91 4.065 4.384 -0.319 1
1 1022 . 17 1 1 A 91 91 ARG C C 91 177.858 177.937 -0.079 1
1 1023 . 17 1 1 A 91 91 ARG CA C 91 58.573 56.530 2.043 1
1 1024 . 17 1 1 A 91 91 ARG CB C 91 30.384 30.442 -0.058 1
1 1027 . 17 1 1 A 91 91 ARG N N 91 118.081 116.561 1.520 1
1 1028 . 17 1 1 A 92 92 GLU H H 92 7.691 8.264 -0.573 1
1 1029 . 17 1 1 A 92 92 GLU HA H 92 4.123 4.081 0.042 1
1 1034 . 17 1 1 A 92 92 GLU C C 92 174.459 176.847 -2.388 1
1 1035 . 17 1 1 A 92 92 GLU CA C 92 61.565 60.094 1.471 1
1 1036 . 17 1 1 A 92 92 GLU CB C 92 27.583 28.844 -1.261 1
1 1038 . 17 1 1 A 92 92 GLU N N 92 118.447 117.798 0.649 1
1 1039 . 17 1 1 A 93 93 PRO HA H 93 4.716 4.576 0.140 1
1 1046 . 17 1 1 A 93 93 PRO C C 93 176.221 176.563 -0.342 1
1 1047 . 17 1 1 A 93 93 PRO CA C 93 63.149 62.546 0.603 1
1 1048 . 17 1 1 A 93 93 PRO CB C 93 32.571 33.039 -0.468 1
1 1051 . 17 1 1 A 94 94 ARG H H 94 8.434 9.012 -0.578 1
1 1052 . 17 1 1 A 94 94 ARG HA H 94 4.232 4.291 -0.059 1
1 1058 . 17 1 1 A 94 94 ARG C C 94 175.323 176.013 -0.690 1
1 1059 . 17 1 1 A 94 94 ARG CA C 94 56.972 57.009 -0.037 1
1 1060 . 17 1 1 A 94 94 ARG CB C 94 30.448 31.056 -0.608 1
1 1063 . 17 1 1 A 94 94 ARG N N 94 115.987 119.486 -3.499 1
1 1064 . 17 1 1 A 95 95 GLN H H 95 7.246 7.607 -0.361 1
1 1065 . 17 1 1 A 95 95 GLN HA H 95 5.251 5.346 -0.095 1
1 1072 . 17 1 1 A 95 95 GLN C C 95 174.786 173.680 1.106 1
1 1073 . 17 1 1 A 95 95 GLN CA C 95 54.209 54.362 -0.153 1
1 1074 . 17 1 1 A 95 95 GLN CB C 95 32.384 32.287 0.097 1
1 1076 . 17 1 1 A 95 95 GLN N N 95 115.998 119.579 -3.581 1
1 1078 . 17 1 1 A 96 96 ALA H H 96 8.739 8.424 0.315 1
1 1079 . 17 1 1 A 96 96 ALA HA H 96 5.412 5.147 0.265 1
1 1083 . 17 1 1 A 96 96 ALA C C 96 175.258 175.822 -0.564 1
1 1084 . 17 1 1 A 96 96 ALA CA C 96 50.355 50.932 -0.577 1
1 1085 . 17 1 1 A 96 96 ALA CB C 96 24.270 22.602 1.668 1
1 1086 . 17 1 1 A 96 96 ALA N N 96 126.197 125.691 0.506 1
1 1087 . 17 1 1 A 97 97 VAL H H 97 8.568 8.746 -0.178 1
1 1088 . 17 1 1 A 97 97 VAL HA H 97 4.804 4.725 0.079 1
1 1096 . 17 1 1 A 97 97 VAL C C 97 175.982 175.187 0.795 1
1 1097 . 17 1 1 A 97 97 VAL CA C 97 61.442 61.396 0.046 1
1 1098 . 17 1 1 A 97 97 VAL CB C 97 33.413 33.295 0.118 1
1 1101 . 17 1 1 A 97 97 VAL N N 97 120.702 122.887 -2.185 1
1 1102 . 17 1 1 A 98 98 ILE H H 98 9.753 8.570 1.183 1
1 1103 . 17 1 1 A 98 98 ILE HA H 98 4.826 4.979 -0.153 1
1 1113 . 17 1 1 A 98 98 ILE C C 98 174.292 174.560 -0.268 1
1 1114 . 17 1 1 A 98 98 ILE CA C 98 59.981 59.927 0.054 1
1 1115 . 17 1 1 A 98 98 ILE CB C 98 40.608 40.656 -0.048 1
1 1119 . 17 1 1 A 98 98 ILE N N 98 131.738 127.419 4.319 1
1 1120 . 17 1 1 A 99 99 VAL H H 99 8.493 8.668 -0.175 1
1 1121 . 17 1 1 A 99 99 VAL HA H 99 5.201 4.605 0.596 1
1 1129 . 17 1 1 A 99 99 VAL C C 99 176.557 175.285 1.272 1
1 1130 . 17 1 1 A 99 99 VAL CA C 99 61.495 61.045 0.450 1
1 1131 . 17 1 1 A 99 99 VAL CB C 99 32.327 32.501 -0.174 1
1 1134 . 17 1 1 A 99 99 VAL N N 99 129.537 129.229 0.308 1
1 1135 . 17 1 1 A 100 100 THR H H 100 9.050 8.708 0.342 1
1 1136 . 17 1 1 A 100 100 THR HA H 100 5.606 5.236 0.370 1
1 1141 . 17 1 1 A 100 100 THR C C 100 172.815 173.018 -0.203 1
1 1142 . 17 1 1 A 100 100 THR CA C 100 59.049 59.128 -0.079 1
1 1143 . 17 1 1 A 100 100 THR CB C 100 73.966 71.868 2.098 1
1 1145 . 17 1 1 A 100 100 THR N N 100 117.469 117.036 0.433 1
1 1146 . 17 1 1 A 101 101 ARG H H 101 8.773 8.566 0.207 1
1 1147 . 17 1 1 A 101 101 ARG HA H 101 4.989 4.810 0.179 1
1 1155 . 17 1 1 A 101 101 ARG C C 101 174.738 176.331 -1.593 1
1 1156 . 17 1 1 A 101 101 ARG CA C 101 54.825 54.422 0.403 1
1 1157 . 17 1 1 A 101 101 ARG CB C 101 34.636 32.278 2.358 1
1 1160 . 17 1 1 A 101 101 ARG N N 101 117.532 121.091 -3.559 1
1 1162 . 17 1 1 A 102 102 LYS H H 102 8.616 8.203 0.413 1
1 1163 . 17 1 1 A 102 102 LYS HA H 102 4.232 4.662 -0.430 1
1 1171 . 17 1 1 A 102 102 LYS C C 102 175.935 175.438 0.497 1
1 1172 . 17 1 1 A 102 102 LYS CA C 102 56.549 56.360 0.189 1
1 1173 . 17 1 1 A 102 102 LYS CB C 102 33.266 32.943 0.323 1
1 1177 . 17 1 1 A 102 102 LYS N N 102 126.899 121.787 5.112 1
1 1178 . 17 1 1 A 103 103 LEU H H 103 8.424 8.523 -0.099 1
1 1179 . 17 1 1 A 103 103 LEU HA H 103 4.540 4.907 -0.367 1
1 1189 . 17 1 1 A 103 103 LEU C C 103 176.956 176.356 0.600 1
1 1190 . 17 1 1 A 103 103 LEU CA C 103 54.755 53.359 1.396 1
1 1191 . 17 1 1 A 103 103 LEU CB C 103 42.929 43.243 -0.314 1
1 1195 . 17 1 1 A 103 103 LEU N N 103 126.246 126.107 0.139 1
1 1196 . 17 1 1 A 104 104 THR H H 104 8.201 8.261 -0.060 1
1 1197 . 17 1 1 A 104 104 THR HA H 104 4.624 4.423 0.201 1
1 1202 . 17 1 1 A 104 104 THR C C 104 172.954 174.285 -1.331 1
1 1203 . 17 1 1 A 104 104 THR CA C 104 59.483 60.911 -1.428 1
1 1204 . 17 1 1 A 104 104 THR CB C 104 69.761 69.041 0.720 1
1 1206 . 17 1 1 A 104 104 THR N N 104 117.263 114.856 2.407 1
1 1207 . 17 1 1 A 105 105 PRO HA H 105 4.399 4.568 -0.169 1
1 1213 . 17 1 1 A 105 105 PRO CA C 105 63.495 62.225 1.270 1
1 1214 . 17 1 1 A 105 105 PRO CB C 105 32.096 32.862 -0.766 1
1 1217 . 17 1 1 A 106 106 GLU H H 106 8.519 8.507 0.012 1
1 1218 . 17 1 1 A 106 106 GLU HA H 106 4.197 5.033 -0.836 1
1 1221 . 17 1 1 A 106 106 GLU C C 106 176.110 175.032 1.078 1
1 1222 . 17 1 1 A 106 106 GLU CA C 106 56.743 54.877 1.866 1
1 1223 . 17 1 1 A 106 106 GLU CB C 106 30.137 32.748 -2.611 1
1 1225 . 17 1 1 A 106 106 GLU N N 106 120.609 117.939 2.670 1
1 1226 . 17 1 1 A 107 107 ALA H H 107 8.241 8.764 -0.523 1
1 1227 . 17 1 1 A 107 107 ALA HA H 107 4.317 5.008 -0.691 1
1 1231 . 17 1 1 A 107 107 ALA C C 107 177.299 176.697 0.602 1
1 1232 . 17 1 1 A 107 107 ALA CA C 107 52.203 51.238 0.965 1
1 1233 . 17 1 1 A 107 107 ALA CB C 107 19.392 20.333 -0.941 1
1 1234 . 17 1 1 A 107 107 ALA N N 107 124.849 125.759 -0.910 1
1 1235 . 17 1 1 A 108 108 MET H H 108 8.284 8.470 -0.186 1
1 1236 . 17 1 1 A 108 108 MET HA H 108 4.792 5.013 -0.221 1
1 1244 . 17 1 1 A 108 108 MET C C 108 174.337 173.646 0.691 1
1 1245 . 17 1 1 A 108 108 MET CA C 108 53.258 53.348 -0.090 1
1 1246 . 17 1 1 A 108 108 MET CB C 108 32.608 33.267 -0.659 1
1 1249 . 17 1 1 A 108 108 MET N N 108 121.025 122.259 -1.234 1
1 1250 . 17 1 1 A 109 109 PRO HA H 109 4.408 4.652 -0.244 1
1 1256 . 17 1 1 A 109 109 PRO C C 109 176.412 175.133 1.279 1
1 1257 . 17 1 1 A 109 109 PRO CA C 109 63.290 62.452 0.838 1
1 1258 . 17 1 1 A 109 109 PRO CB C 109 32.077 33.385 -1.308 1
1 1261 . 17 1 1 A 110 110 ASP H H 110 8.417 8.821 -0.404 1
1 1262 . 17 1 1 A 110 110 ASP HA H 110 4.573 4.918 -0.345 1
1 1265 . 17 1 1 A 110 110 ASP C C 110 176.508 175.218 1.290 1
1 1266 . 17 1 1 A 110 110 ASP CA C 110 54.085 53.341 0.744 1
1 1267 . 17 1 1 A 110 110 ASP CB C 110 41.075 41.120 -0.045 1
1 1268 . 17 1 1 A 110 110 ASP N N 110 120.239 121.258 -1.019 1
1 1269 . 17 1 1 A 111 111 LEU H H 111 8.279 8.595 -0.316 1
1 1270 . 17 1 1 A 111 111 LEU HA H 111 4.319 4.356 -0.037 1
1 1280 . 17 1 1 A 111 111 LEU C C 111 177.551 176.733 0.818 1
1 1281 . 17 1 1 A 111 111 LEU CA C 111 55.581 54.598 0.983 1
1 1282 . 17 1 1 A 111 111 LEU CB C 111 42.360 42.656 -0.296 1
1 1286 . 17 1 1 A 111 111 LEU N N 111 123.318 126.841 -3.523 1
1 1287 . 17 1 1 A 112 112 ASN H H 112 8.487 8.858 -0.371 1
1 1288 . 17 1 1 A 112 112 ASN HA H 112 4.725 4.562 0.163 1
1 1293 . 17 1 1 A 112 112 ASN C C 112 175.454 174.246 1.208 1
1 1294 . 17 1 1 A 112 112 ASN CA C 112 53.610 55.538 -1.928 1
1 1295 . 17 1 1 A 112 112 ASN CB C 112 39.116 37.844 1.272 1
1 1296 . 17 1 1 A 112 112 ASN N N 112 118.752 118.464 0.288 1
1 1298 . 17 1 1 A 115 115 GLY H H 115 8.205 8.653 -0.448 1
1 1299 . 17 1 1 A 115 115 GLY HA2 H 115 4.126 4.026 0.100 1
1 1300 . 17 1 1 A 115 115 GLY HA3 H 115 4.126 4.026 0.100 1
1 1301 . 17 1 1 A 115 115 GLY CA C 115 44.727 45.035 -0.308 1
1 1302 . 17 1 1 A 116 116 PRO HA H 116 4.485 4.505 -0.020 1
1 1309 . 17 1 1 A 116 116 PRO CA C 116 63.298 62.725 0.573 1
1 1310 . 17 1 1 A 116 116 PRO CB C 116 32.077 32.512 -0.435 1
1 1313 . 17 1 1 A 117 117 SER H H 117 8.532 8.946 -0.414 1
1 1 . 18 1 1 A 7 7 GLY HA2 H 7 3.960 4.418 -0.458 1
1 2 . 18 1 1 A 7 7 GLY HA3 H 7 3.960 4.418 -0.458 1
1 3 . 18 1 1 A 7 7 GLY C C 7 174.009 172.790 1.219 1
1 4 . 18 1 1 A 7 7 GLY CA C 7 45.374 45.132 0.242 1
1 5 . 18 1 1 A 8 8 ALA H H 8 8.163 8.494 -0.331 1
1 6 . 18 1 1 A 8 8 ALA HA H 8 4.381 5.324 -0.943 1
1 10 . 18 1 1 A 8 8 ALA C C 8 178.078 175.709 2.369 1
1 11 . 18 1 1 A 8 8 ALA CA C 8 52.677 51.125 1.552 1
1 12 . 18 1 1 A 8 8 ALA CB C 8 19.368 23.779 -4.411 1
1 13 . 18 1 1 A 8 8 ALA N N 8 123.721 121.828 1.893 1
1 14 . 18 1 1 A 9 9 THR H H 9 8.142 8.757 -0.615 1
1 15 . 18 1 1 A 9 9 THR HA H 9 4.353 4.766 -0.413 1
1 20 . 18 1 1 A 9 9 THR C C 9 174.597 172.672 1.925 1
1 21 . 18 1 1 A 9 9 THR CA C 9 62.093 60.418 1.675 1
1 22 . 18 1 1 A 9 9 THR CB C 9 69.948 70.477 -0.529 1
1 24 . 18 1 1 A 9 9 THR N N 9 113.761 113.683 0.078 1
1 25 . 18 1 1 A 10 10 LEU H H 10 8.218 8.762 -0.544 1
1 26 . 18 1 1 A 10 10 LEU HA H 10 4.169 4.834 -0.665 1
1 36 . 18 1 1 A 10 10 LEU C C 10 176.110 176.832 -0.722 1
1 37 . 18 1 1 A 10 10 LEU CA C 10 61.099 53.304 7.795 1
1 38 . 18 1 1 A 10 10 LEU CB C 10 38.686 43.566 -4.880 1
1 42 . 18 1 1 A 10 10 LEU N N 10 123.516 124.619 -1.103 1
1 43 . 18 1 1 A 11 11 LYS H H 11 8.496 9.088 -0.592 1
1 44 . 18 1 1 A 11 11 LYS HA H 11 4.891 4.513 0.378 1
1 49 . 18 1 1 A 11 11 LYS C C 11 175.794 175.222 0.572 1
1 50 . 18 1 1 A 11 11 LYS CA C 11 55.652 57.661 -2.009 1
1 51 . 18 1 1 A 11 11 LYS CB C 11 29.444 35.425 -5.981 1
1 52 . 18 1 1 A 11 11 LYS N N 11 125.141 122.762 2.379 1
1 53 . 18 1 1 A 12 12 GLN HA H 12 4.315 4.848 -0.533 1
1 54 . 18 1 1 A 12 12 GLN C C 12 176.300 174.008 2.292 1
1 55 . 18 1 1 A 12 12 GLN CA C 12 56.286 55.280 1.006 1
1 56 . 18 1 1 A 12 12 GLN CB C 12 32.901 32.634 0.267 1
1 57 . 18 1 1 A 13 13 LEU H H 13 8.410 8.650 -0.240 1
1 58 . 18 1 1 A 13 13 LEU HA H 13 4.348 4.497 -0.149 1
1 67 . 18 1 1 A 13 13 LEU C C 13 177.120 175.238 1.882 1
1 68 . 18 1 1 A 13 13 LEU CA C 13 55.142 54.285 0.857 1
1 69 . 18 1 1 A 13 13 LEU CB C 13 42.352 44.898 -2.546 1
1 73 . 18 1 1 A 13 13 LEU N N 13 124.340 123.624 0.716 1
1 74 . 18 1 1 A 14 14 ASP H H 14 8.250 9.196 -0.946 1
1 75 . 18 1 1 A 14 14 ASP HA H 14 4.540 4.645 -0.105 1
1 78 . 18 1 1 A 14 14 ASP C C 14 176.769 175.342 1.427 1
1 79 . 18 1 1 A 14 14 ASP CA C 14 54.772 54.363 0.409 1
1 80 . 18 1 1 A 14 14 ASP CB C 14 41.322 40.044 1.278 1
1 81 . 18 1 1 A 14 14 ASP N N 14 120.493 127.150 -6.657 1
1 82 . 18 1 1 A 15 15 GLY H H 15 8.428 8.735 -0.307 1
1 83 . 18 1 1 A 15 15 GLY HA2 H 15 4.089 3.889 0.200 1
1 84 . 18 1 1 A 15 15 GLY HA3 H 15 3.874 3.896 -0.022 1
1 85 . 18 1 1 A 15 15 GLY C C 15 174.122 173.789 0.333 1
1 86 . 18 1 1 A 15 15 GLY CA C 15 45.972 46.916 -0.944 1
1 87 . 18 1 1 A 15 15 GLY N N 15 108.670 109.504 -0.834 1
1 88 . 18 1 1 A 16 16 ILE H H 16 7.727 7.248 0.479 1
1 89 . 18 1 1 A 16 16 ILE HA H 16 4.705 4.953 -0.248 1
1 99 . 18 1 1 A 16 16 ILE C C 16 175.807 174.034 1.773 1
1 100 . 18 1 1 A 16 16 ILE CA C 16 60.703 59.971 0.732 1
1 101 . 18 1 1 A 16 16 ILE CB C 16 38.509 39.442 -0.933 1
1 105 . 18 1 1 A 16 16 ILE N N 16 120.267 121.224 -0.957 1
1 106 . 18 1 1 A 17 17 HIS H H 17 9.101 8.587 0.514 1
1 107 . 18 1 1 A 17 17 HIS HA H 17 4.782 5.332 -0.550 1
1 112 . 18 1 1 A 17 17 HIS C C 17 173.051 173.741 -0.690 1
1 113 . 18 1 1 A 17 17 HIS CA C 17 55.353 53.026 2.327 1
1 114 . 18 1 1 A 17 17 HIS CB C 17 32.468 32.648 -0.180 1
1 117 . 18 1 1 A 17 17 HIS N N 17 125.061 127.791 -2.730 1
1 118 . 18 1 1 A 18 18 VAL H H 18 8.427 8.416 0.011 1
1 119 . 18 1 1 A 18 18 VAL HA H 18 4.375 4.036 0.339 1
1 127 . 18 1 1 A 18 18 VAL C C 18 174.702 174.499 0.203 1
1 128 . 18 1 1 A 18 18 VAL CA C 18 62.035 62.434 -0.399 1
1 129 . 18 1 1 A 18 18 VAL CB C 18 32.325 32.544 -0.219 1
1 132 . 18 1 1 A 18 18 VAL N N 18 127.069 127.594 -0.525 1
1 133 . 18 1 1 A 19 19 THR H H 19 9.272 8.600 0.672 1
1 134 . 18 1 1 A 19 19 THR HA H 19 4.512 4.860 -0.348 1
1 139 . 18 1 1 A 19 19 THR C C 19 172.784 173.382 -0.598 1
1 140 . 18 1 1 A 19 19 THR CA C 19 62.512 61.880 0.632 1
1 141 . 18 1 1 A 19 19 THR CB C 19 70.663 70.219 0.444 1
1 143 . 18 1 1 A 19 19 THR N N 19 126.619 122.295 4.324 1
1 144 . 18 1 1 A 20 20 ILE H H 20 8.737 8.990 -0.253 1
1 145 . 18 1 1 A 20 20 ILE HA H 20 4.870 4.546 0.324 1
1 155 . 18 1 1 A 20 20 ILE C C 20 175.315 175.017 0.298 1
1 156 . 18 1 1 A 20 20 ILE CA C 20 60.157 60.177 -0.020 1
1 157 . 18 1 1 A 20 20 ILE CB C 20 38.603 37.356 1.247 1
1 161 . 18 1 1 A 20 20 ILE N N 20 128.114 128.621 -0.507 1
1 162 . 18 1 1 A 21 21 LEU H H 21 8.902 8.905 -0.003 1
1 163 . 18 1 1 A 21 21 LEU HA H 21 4.804 4.872 -0.068 1
1 173 . 18 1 1 A 21 21 LEU C C 21 175.565 175.463 0.102 1
1 174 . 18 1 1 A 21 21 LEU CA C 21 52.731 53.684 -0.953 1
1 175 . 18 1 1 A 21 21 LEU CB C 21 43.947 43.437 0.510 1
1 179 . 18 1 1 A 21 21 LEU N N 21 125.457 128.935 -3.478 1
1 180 . 18 1 1 A 22 22 HIS H H 22 8.577 9.094 -0.517 1
1 181 . 18 1 1 A 22 22 HIS HA H 22 5.013 5.113 -0.100 1
1 186 . 18 1 1 A 22 22 HIS C C 22 174.258 175.052 -0.794 1
1 187 . 18 1 1 A 22 22 HIS CA C 22 55.880 54.660 1.220 1
1 188 . 18 1 1 A 22 22 HIS CB C 22 30.901 30.596 0.305 1
1 191 . 18 1 1 A 22 22 HIS N N 22 122.595 124.029 -1.434 1
1 192 . 18 1 1 A 23 23 LYS H H 23 8.712 9.788 -1.076 1
1 193 . 18 1 1 A 23 23 LYS HA H 23 4.880 5.020 -0.140 1
1 202 . 18 1 1 A 23 23 LYS C C 23 174.265 175.193 -0.928 1
1 203 . 18 1 1 A 23 23 LYS CA C 23 54.314 54.193 0.121 1
1 204 . 18 1 1 A 23 23 LYS CB C 23 36.068 35.825 0.243 1
1 208 . 18 1 1 A 23 23 LYS N N 23 120.814 121.183 -0.369 1
1 209 . 18 1 1 A 24 24 GLU H H 24 8.360 8.525 -0.165 1
1 210 . 18 1 1 A 24 24 GLU HA H 24 4.350 4.751 -0.401 1
1 215 . 18 1 1 A 24 24 GLU C C 24 177.843 176.733 1.110 1
1 216 . 18 1 1 A 24 24 GLU CA C 24 55.601 54.831 0.770 1
1 217 . 18 1 1 A 24 24 GLU CB C 24 30.512 31.972 -1.460 1
1 219 . 18 1 1 A 24 24 GLU N N 24 117.859 119.575 -1.716 1
1 220 . 18 1 1 A 25 25 GLU H H 25 9.146 8.802 0.344 1
1 221 . 18 1 1 A 25 25 GLU HA H 25 3.924 4.047 -0.123 1
1 226 . 18 1 1 A 25 25 GLU C C 25 177.809 177.516 0.293 1
1 227 . 18 1 1 A 25 25 GLU CA C 25 58.568 58.608 -0.040 1
1 228 . 18 1 1 A 25 25 GLU CB C 25 29.313 29.113 0.200 1
1 230 . 18 1 1 A 25 25 GLU N N 25 124.543 121.564 2.979 1
1 231 . 18 1 1 A 26 26 GLY H H 26 8.242 8.812 -0.570 1
1 232 . 18 1 1 A 26 26 GLY HA2 H 26 4.287 3.997 0.290 1
1 233 . 18 1 1 A 26 26 GLY HA3 H 26 3.407 3.997 -0.590 1
1 234 . 18 1 1 A 26 26 GLY C C 26 174.234 175.374 -1.140 1
1 235 . 18 1 1 A 26 26 GLY CA C 26 46.113 46.586 -0.473 1
1 236 . 18 1 1 A 26 26 GLY N N 26 115.394 114.037 1.357 1
1 237 . 18 1 1 A 27 27 ALA H H 27 7.432 7.921 -0.489 1
1 238 . 18 1 1 A 27 27 ALA HA H 27 4.402 4.303 0.099 1
1 242 . 18 1 1 A 27 27 ALA C C 27 178.138 178.256 -0.118 1
1 243 . 18 1 1 A 27 27 ALA CA C 27 52.273 52.240 0.033 1
1 244 . 18 1 1 A 27 27 ALA CB C 27 20.214 19.862 0.352 1
1 245 . 18 1 1 A 27 27 ALA N N 27 122.323 122.568 -0.245 1
1 246 . 18 1 1 A 28 28 GLY H H 28 8.624 7.894 0.730 1
1 247 . 18 1 1 A 28 28 GLY HA2 H 28 4.134 4.107 0.027 1
1 248 . 18 1 1 A 28 28 GLY HA3 H 28 3.953 4.141 -0.188 1
1 249 . 18 1 1 A 28 28 GLY C C 28 174.069 175.115 -1.046 1
1 250 . 18 1 1 A 28 28 GLY CA C 28 44.546 44.741 -0.195 1
1 251 . 18 1 1 A 28 28 GLY N N 28 107.593 106.450 1.143 1
1 252 . 18 1 1 A 29 29 LEU H H 29 7.934 8.680 -0.746 1
1 253 . 18 1 1 A 29 29 LEU HA H 29 4.059 4.177 -0.118 1
1 263 . 18 1 1 A 29 29 LEU C C 29 177.548 176.821 0.727 1
1 264 . 18 1 1 A 29 29 LEU CA C 29 56.298 56.926 -0.628 1
1 265 . 18 1 1 A 29 29 LEU CB C 29 41.940 42.694 -0.754 1
1 269 . 18 1 1 A 29 29 LEU N N 29 115.495 122.472 -6.977 1
1 270 . 18 1 1 A 30 30 GLY H H 30 8.669 7.961 0.708 1
1 271 . 18 1 1 A 30 30 GLY HA2 H 30 4.264 4.113 0.151 1
1 272 . 18 1 1 A 30 30 GLY HA3 H 30 4.001 4.238 -0.237 1
1 273 . 18 1 1 A 30 30 GLY C C 30 175.296 173.182 2.114 1
1 274 . 18 1 1 A 30 30 GLY CA C 30 46.368 45.206 1.162 1
1 275 . 18 1 1 A 30 30 GLY N N 30 103.121 106.045 -2.924 1
1 276 . 18 1 1 A 31 31 PHE H H 31 7.044 7.479 -0.435 1
1 277 . 18 1 1 A 31 31 PHE HA H 31 4.541 4.244 0.297 1
1 285 . 18 1 1 A 31 31 PHE C C 31 171.141 172.652 -1.511 1
1 286 . 18 1 1 A 31 31 PHE CA C 31 55.704 55.153 0.551 1
1 287 . 18 1 1 A 31 31 PHE CB C 31 40.745 41.911 -1.166 1
1 293 . 18 1 1 A 31 31 PHE N N 31 115.404 115.226 0.178 1
1 294 . 18 1 1 A 32 32 SER H H 32 8.752 8.754 -0.002 1
1 295 . 18 1 1 A 32 32 SER HA H 32 4.990 4.738 0.252 1
1 298 . 18 1 1 A 32 32 SER C C 32 175.049 173.358 1.691 1
1 299 . 18 1 1 A 32 32 SER CA C 32 55.001 55.627 -0.626 1
1 300 . 18 1 1 A 32 32 SER CB C 32 67.170 65.978 1.192 1
1 301 . 18 1 1 A 32 32 SER N N 32 113.639 113.462 0.177 1
1 302 . 18 1 1 A 33 33 LEU H H 33 8.639 8.396 0.243 1
1 303 . 18 1 1 A 33 33 LEU HA H 33 5.573 5.194 0.379 1
1 313 . 18 1 1 A 33 33 LEU C C 33 175.827 175.809 0.018 1
1 314 . 18 1 1 A 33 33 LEU CA C 33 53.620 53.558 0.062 1
1 315 . 18 1 1 A 33 33 LEU CB C 33 45.399 44.589 0.810 1
1 319 . 18 1 1 A 33 33 LEU N N 33 118.936 120.523 -1.587 1
1 320 . 18 1 1 A 34 34 ALA H H 34 9.410 9.016 0.394 1
1 321 . 18 1 1 A 34 34 ALA HA H 34 4.749 5.257 -0.508 1
1 325 . 18 1 1 A 34 34 ALA C C 34 176.231 176.089 0.142 1
1 326 . 18 1 1 A 34 34 ALA CA C 34 50.425 51.343 -0.918 1
1 327 . 18 1 1 A 34 34 ALA CB C 34 22.518 23.202 -0.684 1
1 328 . 18 1 1 A 34 34 ALA N N 34 124.395 122.992 1.403 1
1 329 . 18 1 1 A 35 35 GLY H H 35 8.130 8.791 -0.661 1
1 330 . 18 1 1 A 35 35 GLY HA2 H 35 4.712 4.207 0.505 1
1 331 . 18 1 1 A 35 35 GLY HA3 H 35 3.955 4.214 -0.259 1
1 332 . 18 1 1 A 35 35 GLY C C 35 174.750 172.906 1.844 1
1 333 . 18 1 1 A 35 35 GLY CA C 35 44.494 44.221 0.273 1
1 334 . 18 1 1 A 35 35 GLY N N 35 103.650 108.505 -4.855 1
1 335 . 18 1 1 A 36 36 GLY H H 36 8.217 8.280 -0.063 1
1 336 . 18 1 1 A 36 36 GLY HA2 H 36 4.494 4.277 0.217 1
1 337 . 18 1 1 A 36 36 GLY HA3 H 36 3.836 4.325 -0.489 1
1 338 . 18 1 1 A 36 36 GLY C C 36 174.410 174.630 -0.220 1
1 339 . 18 1 1 A 36 36 GLY CA C 36 45.462 46.029 -0.567 1
1 340 . 18 1 1 A 36 36 GLY N N 36 122.114 107.137 14.977 1
1 341 . 18 1 1 A 37 37 ALA H H 37 8.963 9.194 -0.231 1
1 342 . 18 1 1 A 37 37 ALA HA H 37 3.998 4.000 -0.002 1
1 346 . 18 1 1 A 37 37 ALA C C 37 176.935 179.079 -2.144 1
1 347 . 18 1 1 A 37 37 ALA CA C 37 55.308 54.678 0.630 1
1 348 . 18 1 1 A 37 37 ALA CB C 37 18.822 18.399 0.423 1
1 349 . 18 1 1 A 37 37 ALA N N 37 123.418 125.563 -2.145 1
1 350 . 18 1 1 A 38 38 ASP H H 38 10.586 8.189 2.397 1
1 351 . 18 1 1 A 38 38 ASP HA H 38 4.485 4.367 0.118 1
1 354 . 18 1 1 A 38 38 ASP C C 38 175.309 176.401 -1.092 1
1 355 . 18 1 1 A 38 38 ASP CA C 38 52.730 56.395 -3.665 1
1 356 . 18 1 1 A 38 38 ASP CB C 38 38.689 41.032 -2.343 1
1 357 . 18 1 1 A 38 38 ASP N N 38 111.480 117.683 -6.203 1
1 358 . 18 1 1 A 39 39 LEU H H 39 7.789 8.373 -0.584 1
1 359 . 18 1 1 A 39 39 LEU HA H 39 4.699 4.415 0.284 1
1 369 . 18 1 1 A 39 39 LEU C C 39 176.377 178.018 -1.641 1
1 370 . 18 1 1 A 39 39 LEU CA C 39 52.952 54.062 -1.110 1
1 371 . 18 1 1 A 39 39 LEU CB C 39 43.294 42.504 0.790 1
1 375 . 18 1 1 A 39 39 LEU N N 39 122.545 120.732 1.813 1
1 376 . 18 1 1 A 40 40 GLU H H 40 8.331 8.515 -0.184 1
1 377 . 18 1 1 A 40 40 GLU HA H 40 3.978 4.063 -0.085 1
1 382 . 18 1 1 A 40 40 GLU C C 40 176.887 176.761 0.126 1
1 383 . 18 1 1 A 40 40 GLU CA C 40 59.066 59.306 -0.240 1
1 384 . 18 1 1 A 40 40 GLU CB C 40 29.523 29.676 -0.153 1
1 386 . 18 1 1 A 40 40 GLU N N 40 118.036 120.161 -2.125 1
1 387 . 18 1 1 A 41 41 ASN H H 41 7.890 7.857 0.033 1
1 388 . 18 1 1 A 41 41 ASN HA H 41 4.820 4.870 -0.050 1
1 393 . 18 1 1 A 41 41 ASN CA C 41 52.316 52.362 -0.046 1
1 394 . 18 1 1 A 41 41 ASN CB C 41 37.409 39.618 -2.209 1
1 395 . 18 1 1 A 41 41 ASN N N 41 115.196 117.116 -1.920 1
1 397 . 18 1 1 A 42 42 LYS H H 42 7.943 9.091 -1.148 1
1 398 . 18 1 1 A 42 42 LYS HA H 42 4.328 4.485 -0.157 1
1 407 . 18 1 1 A 42 42 LYS C C 42 177.081 175.805 1.276 1
1 408 . 18 1 1 A 42 42 LYS CA C 42 56.567 57.017 -0.450 1
1 409 . 18 1 1 A 42 42 LYS CB C 42 33.120 33.336 -0.216 1
1 413 . 18 1 1 A 42 42 LYS N N 42 120.612 122.982 -2.370 1
1 414 . 18 1 1 A 43 43 VAL H H 43 7.456 7.539 -0.083 1
1 415 . 18 1 1 A 43 43 VAL HA H 43 4.059 4.315 -0.256 1
1 423 . 18 1 1 A 43 43 VAL CA C 43 61.330 61.783 -0.453 1
1 424 . 18 1 1 A 43 43 VAL CB C 43 32.819 32.691 0.128 1
1 427 . 18 1 1 A 43 43 VAL N N 43 118.284 120.064 -1.780 1
1 428 . 18 1 1 A 44 44 ILE H H 44 8.481 8.771 -0.290 1
1 429 . 18 1 1 A 44 44 ILE HA H 44 4.913 4.653 0.260 1
1 439 . 18 1 1 A 44 44 ILE C C 44 176.719 175.778 0.941 1
1 440 . 18 1 1 A 44 44 ILE CA C 44 59.946 62.148 -2.202 1
1 441 . 18 1 1 A 44 44 ILE CB C 44 35.784 36.881 -1.097 1
1 445 . 18 1 1 A 44 44 ILE N N 44 127.089 128.575 -1.486 1
1 446 . 18 1 1 A 45 45 THR H H 45 8.906 9.113 -0.207 1
1 447 . 18 1 1 A 45 45 THR HA H 45 5.400 5.560 -0.160 1
1 452 . 18 1 1 A 45 45 THR CA C 45 58.528 59.858 -1.330 1
1 453 . 18 1 1 A 45 45 THR CB C 45 73.760 71.526 2.234 1
1 455 . 18 1 1 A 45 45 THR N N 45 116.832 119.257 -2.425 1
1 456 . 18 1 1 A 46 46 VAL H H 46 8.336 8.626 -0.290 1
1 457 . 18 1 1 A 46 46 VAL HA H 46 4.059 4.164 -0.105 1
1 465 . 18 1 1 A 46 46 VAL C C 46 176.648 176.844 -0.196 1
1 466 . 18 1 1 A 46 46 VAL CA C 46 63.058 63.226 -0.168 1
1 467 . 18 1 1 A 46 46 VAL CB C 46 31.601 30.850 0.751 1
1 470 . 18 1 1 A 46 46 VAL N N 46 118.542 122.430 -3.888 1
1 471 . 18 1 1 A 47 47 HIS H H 47 9.382 8.450 0.932 1
1 472 . 18 1 1 A 47 47 HIS HA H 47 4.628 4.188 0.440 1
1 477 . 18 1 1 A 47 47 HIS C C 47 174.339 174.486 -0.147 1
1 478 . 18 1 1 A 47 47 HIS CA C 47 57.764 60.104 -2.340 1
1 479 . 18 1 1 A 47 47 HIS CB C 47 31.453 30.638 0.815 1
1 482 . 18 1 1 A 47 47 HIS N N 47 133.900 128.140 5.760 1
1 483 . 18 1 1 A 48 48 ARG H H 48 7.135 7.800 -0.665 1
1 484 . 18 1 1 A 48 48 ARG HA H 48 4.360 4.765 -0.405 1
1 491 . 18 1 1 A 48 48 ARG C C 48 173.877 174.597 -0.720 1
1 492 . 18 1 1 A 48 48 ARG CA C 48 54.385 54.846 -0.461 1
1 493 . 18 1 1 A 48 48 ARG CB C 48 33.996 34.519 -0.523 1
1 496 . 18 1 1 A 48 48 ARG N N 48 114.736 117.923 -3.187 1
1 497 . 18 1 1 A 49 49 VAL H H 49 8.690 8.853 -0.163 1
1 498 . 18 1 1 A 49 49 VAL HA H 49 4.015 4.388 -0.373 1
1 506 . 18 1 1 A 49 49 VAL C C 49 176.255 175.628 0.627 1
1 507 . 18 1 1 A 49 49 VAL CA C 49 61.882 61.538 0.344 1
1 508 . 18 1 1 A 49 49 VAL CB C 49 32.261 32.448 -0.187 1
1 511 . 18 1 1 A 49 49 VAL N N 49 122.844 122.172 0.672 1
1 512 . 18 1 1 A 50 50 PHE H H 50 7.866 8.282 -0.416 1
1 513 . 18 1 1 A 50 50 PHE HA H 50 4.866 4.515 0.351 1
1 521 . 18 1 1 A 50 50 PHE C C 50 174.847 176.327 -1.480 1
1 522 . 18 1 1 A 50 50 PHE CA C 50 54.596 57.517 -2.921 1
1 523 . 18 1 1 A 50 50 PHE CB C 50 36.558 38.978 -2.420 1
1 529 . 18 1 1 A 50 50 PHE N N 50 128.498 127.660 0.838 1
1 530 . 18 1 1 A 51 51 PRO HA H 51 4.386 4.555 -0.169 1
1 537 . 18 1 1 A 51 51 PRO C C 51 177.321 176.646 0.675 1
1 538 . 18 1 1 A 51 51 PRO CA C 51 64.381 64.509 -0.128 1
1 539 . 18 1 1 A 51 51 PRO CB C 51 31.773 32.226 -0.453 1
1 542 . 18 1 1 A 52 52 ASN H H 52 8.814 8.554 0.260 1
1 543 . 18 1 1 A 52 52 ASN HA H 52 4.496 5.021 -0.525 1
1 548 . 18 1 1 A 52 52 ASN C C 52 174.823 174.686 0.137 1
1 549 . 18 1 1 A 52 52 ASN CA C 52 54.719 52.225 2.494 1
1 550 . 18 1 1 A 52 52 ASN CB C 52 38.109 39.244 -1.135 1
1 551 . 18 1 1 A 52 52 ASN N N 52 116.145 116.235 -0.090 1
1 553 . 18 1 1 A 53 53 GLY H H 53 7.730 8.232 -0.502 1
1 554 . 18 1 1 A 53 53 GLY HA2 H 53 4.430 4.357 0.073 1
1 555 . 18 1 1 A 53 53 GLY HA3 H 53 4.089 4.374 -0.285 1
1 556 . 18 1 1 A 53 53 GLY C C 53 174.810 173.888 0.922 1
1 557 . 18 1 1 A 53 53 GLY CA C 53 44.987 45.917 -0.930 1
1 558 . 18 1 1 A 53 53 GLY N N 53 106.196 110.695 -4.499 1
1 559 . 18 1 1 A 54 54 LEU H H 54 8.764 8.949 -0.185 1
1 560 . 18 1 1 A 54 54 LEU HA H 54 4.041 4.128 -0.087 1
1 570 . 18 1 1 A 54 54 LEU C C 54 179.712 178.753 0.959 1
1 571 . 18 1 1 A 54 54 LEU CA C 54 58.310 57.828 0.482 1
1 572 . 18 1 1 A 54 54 LEU CB C 54 42.390 41.968 0.422 1
1 576 . 18 1 1 A 54 54 LEU N N 54 118.836 119.732 -0.896 1
1 577 . 18 1 1 A 55 55 ALA H H 55 7.593 7.896 -0.303 1
1 578 . 18 1 1 A 55 55 ALA HA H 55 4.275 3.809 0.466 1
1 582 . 18 1 1 A 55 55 ALA C C 55 181.307 179.607 1.700 1
1 583 . 18 1 1 A 55 55 ALA CA C 55 54.825 54.924 -0.099 1
1 584 . 18 1 1 A 55 55 ALA CB C 55 18.345 18.044 0.301 1
1 585 . 18 1 1 A 55 55 ALA N N 55 118.782 121.486 -2.704 1
1 586 . 18 1 1 A 56 56 SER H H 56 9.339 7.883 1.456 1
1 587 . 18 1 1 A 56 56 SER HA H 56 4.023 4.212 -0.189 1
1 589 . 18 1 1 A 56 56 SER C C 56 176.392 177.409 -1.017 1
1 590 . 18 1 1 A 56 56 SER CA C 56 60.984 61.456 -0.472 1
1 591 . 18 1 1 A 56 56 SER CB C 56 62.987 62.767 0.220 1
1 592 . 18 1 1 A 56 56 SER N N 56 117.631 113.196 4.435 1
1 593 . 18 1 1 A 57 57 GLN H H 57 7.942 7.419 0.523 1
1 594 . 18 1 1 A 57 57 GLN HA H 57 4.034 3.969 0.065 1
1 601 . 18 1 1 A 57 57 GLN C C 57 177.400 178.493 -1.093 1
1 602 . 18 1 1 A 57 57 GLN CA C 57 58.362 59.033 -0.671 1
1 603 . 18 1 1 A 57 57 GLN CB C 57 28.801 28.469 0.332 1
1 605 . 18 1 1 A 57 57 GLN N N 57 118.162 121.793 -3.631 1
1 607 . 18 1 1 A 58 58 GLU H H 58 7.683 8.639 -0.956 1
1 608 . 18 1 1 A 58 58 GLU HA H 58 4.163 4.072 0.091 1
1 613 . 18 1 1 A 58 58 GLU C C 58 179.248 176.722 2.526 1
1 614 . 18 1 1 A 58 58 GLU CA C 58 59.559 58.795 0.764 1
1 615 . 18 1 1 A 58 58 GLU CB C 58 29.317 29.523 -0.206 1
1 617 . 18 1 1 A 58 58 GLU N N 58 119.877 120.148 -0.271 1
1 618 . 18 1 1 A 59 59 GLY H H 59 7.446 7.442 0.004 1
1 619 . 18 1 1 A 59 59 GLY HA2 H 59 4.100 3.901 0.199 1
1 620 . 18 1 1 A 59 59 GLY HA3 H 59 3.770 3.904 -0.134 1
1 621 . 18 1 1 A 59 59 GLY C C 59 175.432 175.006 0.426 1
1 622 . 18 1 1 A 59 59 GLY CA C 59 46.817 45.739 1.078 1
1 623 . 18 1 1 A 59 59 GLY N N 59 102.653 107.485 -4.832 1
1 624 . 18 1 1 A 60 60 THR H H 60 8.343 8.026 0.317 1
1 625 . 18 1 1 A 60 60 THR HA H 60 4.037 4.096 -0.059 1
1 630 . 18 1 1 A 60 60 THR C C 60 175.843 175.003 0.840 1
1 631 . 18 1 1 A 60 60 THR CA C 60 64.792 65.812 -1.020 1
1 632 . 18 1 1 A 60 60 THR CB C 60 69.325 68.973 0.352 1
1 634 . 18 1 1 A 60 60 THR N N 60 113.863 113.573 0.290 1
1 635 . 18 1 1 A 61 61 ILE H H 61 8.802 7.586 1.216 1
1 636 . 18 1 1 A 61 61 ILE HA H 61 3.631 4.060 -0.429 1
1 646 . 18 1 1 A 61 61 ILE C C 61 174.198 174.478 -0.280 1
1 647 . 18 1 1 A 61 61 ILE CA C 61 62.938 61.035 1.903 1
1 648 . 18 1 1 A 61 61 ILE CB C 61 37.225 36.175 1.050 1
1 652 . 18 1 1 A 61 61 ILE N N 61 126.153 119.851 6.302 1
1 653 . 18 1 1 A 62 62 GLN H H 62 7.124 9.400 -2.276 1
1 654 . 18 1 1 A 62 62 GLN HA H 62 4.500 4.553 -0.053 1
1 661 . 18 1 1 A 62 62 GLN C C 62 174.556 175.448 -0.892 1
1 662 . 18 1 1 A 62 62 GLN CA C 62 53.364 54.271 -0.907 1
1 663 . 18 1 1 A 62 62 GLN CB C 62 32.196 30.750 1.446 1
1 665 . 18 1 1 A 62 62 GLN N N 62 123.730 126.490 -2.760 1
1 667 . 18 1 1 A 63 63 LYS H H 63 8.399 8.529 -0.130 1
1 668 . 18 1 1 A 63 63 LYS HA H 63 3.464 4.547 -1.083 1
1 677 . 18 1 1 A 63 63 LYS CA C 63 57.905 56.839 1.066 1
1 678 . 18 1 1 A 63 63 LYS CB C 63 32.260 32.255 0.005 1
1 682 . 18 1 1 A 63 63 LYS N N 63 121.381 122.877 -1.496 1
1 683 . 18 1 1 A 64 64 GLY H H 64 9.265 9.143 0.122 1
1 684 . 18 1 1 A 64 64 GLY HA2 H 64 4.415 4.020 0.395 1
1 685 . 18 1 1 A 64 64 GLY HA3 H 64 3.639 4.023 -0.384 1
1 686 . 18 1 1 A 64 64 GLY CA C 64 44.881 44.996 -0.115 1
1 687 . 18 1 1 A 64 64 GLY N N 64 113.750 113.056 0.694 1
1 688 . 18 1 1 A 65 65 ASN H H 65 7.594 8.462 -0.868 1
1 689 . 18 1 1 A 65 65 ASN HA H 65 4.798 4.693 0.105 1
1 694 . 18 1 1 A 65 65 ASN C C 65 175.042 174.245 0.797 1
1 695 . 18 1 1 A 65 65 ASN CA C 65 53.047 54.163 -1.116 1
1 696 . 18 1 1 A 65 65 ASN CB C 65 38.153 39.476 -1.323 1
1 697 . 18 1 1 A 65 65 ASN N N 65 117.999 120.372 -2.373 1
1 699 . 18 1 1 A 66 66 GLU H H 66 8.538 8.685 -0.147 1
1 700 . 18 1 1 A 66 66 GLU HA H 66 4.634 4.490 0.144 1
1 705 . 18 1 1 A 66 66 GLU C C 66 176.620 175.540 1.080 1
1 706 . 18 1 1 A 66 66 GLU CA C 66 55.863 55.447 0.416 1
1 707 . 18 1 1 A 66 66 GLU CB C 66 30.899 30.309 0.590 1
1 709 . 18 1 1 A 66 66 GLU N N 66 122.233 123.275 -1.042 1
1 710 . 18 1 1 A 67 67 VAL H H 67 8.452 9.057 -0.605 1
1 711 . 18 1 1 A 67 67 VAL HA H 67 4.172 4.148 0.024 1
1 719 . 18 1 1 A 67 67 VAL C C 67 174.641 175.581 -0.940 1
1 720 . 18 1 1 A 67 67 VAL CA C 67 61.856 62.816 -0.960 1
1 721 . 18 1 1 A 67 67 VAL CB C 67 31.066 30.366 0.700 1
1 724 . 18 1 1 A 67 67 VAL N N 67 126.311 128.238 -1.927 1
1 725 . 18 1 1 A 68 68 LEU H H 68 9.000 8.697 0.303 1
1 726 . 18 1 1 A 68 68 LEU HA H 68 4.390 3.949 0.441 1
1 736 . 18 1 1 A 68 68 LEU C C 68 178.924 176.814 2.110 1
1 737 . 18 1 1 A 68 68 LEU CA C 68 56.990 57.855 -0.865 1
1 738 . 18 1 1 A 68 68 LEU CB C 68 42.392 41.995 0.397 1
1 742 . 18 1 1 A 68 68 LEU N N 68 127.175 130.143 -2.968 1
1 743 . 18 1 1 A 69 69 SER H H 69 7.666 7.956 -0.290 1
1 744 . 18 1 1 A 69 69 SER HA H 69 5.144 5.098 0.046 1
1 747 . 18 1 1 A 69 69 SER C C 69 172.722 172.310 0.412 1
1 748 . 18 1 1 A 69 69 SER CA C 69 57.606 57.140 0.466 1
1 749 . 18 1 1 A 69 69 SER CB C 69 64.511 66.884 -2.373 1
1 750 . 18 1 1 A 69 69 SER N N 69 110.346 109.065 1.281 1
1 751 . 18 1 1 A 70 70 ILE H H 70 7.965 8.719 -0.754 1
1 752 . 18 1 1 A 70 70 ILE HA H 70 4.548 4.574 -0.026 1
1 762 . 18 1 1 A 70 70 ILE C C 70 174.993 176.205 -1.212 1
1 763 . 18 1 1 A 70 70 ILE CA C 70 60.897 60.255 0.642 1
1 764 . 18 1 1 A 70 70 ILE CB C 70 41.186 40.083 1.103 1
1 768 . 18 1 1 A 70 70 ILE N N 70 119.579 120.735 -1.156 1
1 769 . 18 1 1 A 71 71 ASN H H 71 9.839 10.078 -0.239 1
1 770 . 18 1 1 A 71 71 ASN HA H 71 4.485 4.422 0.063 1
1 775 . 18 1 1 A 71 71 ASN C C 71 174.975 174.722 0.253 1
1 776 . 18 1 1 A 71 71 ASN CA C 71 54.085 54.314 -0.229 1
1 777 . 18 1 1 A 71 71 ASN CB C 71 36.255 37.578 -1.323 1
1 778 . 18 1 1 A 71 71 ASN N N 71 126.963 125.081 1.882 1
1 780 . 18 1 1 A 72 72 GLY H H 72 8.911 8.511 0.400 1
1 781 . 18 1 1 A 72 72 GLY HA2 H 72 4.149 4.079 0.070 1
1 782 . 18 1 1 A 72 72 GLY HA3 H 72 3.507 4.079 -0.572 1
1 783 . 18 1 1 A 72 72 GLY C C 72 173.594 174.353 -0.759 1
1 784 . 18 1 1 A 72 72 GLY CA C 72 45.162 44.924 0.238 1
1 785 . 18 1 1 A 72 72 GLY N N 72 103.020 105.477 -2.457 1
1 786 . 18 1 1 A 73 73 LYS H H 73 7.922 7.594 0.328 1
1 787 . 18 1 1 A 73 73 LYS HA H 73 4.485 4.600 -0.115 1
1 796 . 18 1 1 A 73 73 LYS C C 73 175.036 176.059 -1.023 1
1 797 . 18 1 1 A 73 73 LYS CA C 73 54.719 55.347 -0.628 1
1 798 . 18 1 1 A 73 73 LYS CB C 73 32.137 33.630 -1.493 1
1 802 . 18 1 1 A 73 73 LYS N N 73 122.413 122.715 -0.302 1
1 803 . 18 1 1 A 74 74 SER H H 74 8.585 8.651 -0.066 1
1 804 . 18 1 1 A 74 74 SER HA H 74 4.452 4.778 -0.326 1
1 807 . 18 1 1 A 74 74 SER C C 74 175.965 174.318 1.647 1
1 808 . 18 1 1 A 74 74 SER CA C 74 58.028 57.596 0.432 1
1 809 . 18 1 1 A 74 74 SER CB C 74 63.799 64.449 -0.650 1
1 810 . 18 1 1 A 74 74 SER N N 74 118.737 119.218 -0.481 1
1 811 . 18 1 1 A 75 75 LEU H H 75 8.015 8.348 -0.333 1
1 812 . 18 1 1 A 75 75 LEU HA H 75 4.661 4.514 0.147 1
1 822 . 18 1 1 A 75 75 LEU C C 75 178.117 177.343 0.774 1
1 823 . 18 1 1 A 75 75 LEU CA C 75 53.980 54.391 -0.411 1
1 824 . 18 1 1 A 75 75 LEU CB C 75 40.830 41.349 -0.519 1
1 828 . 18 1 1 A 75 75 LEU N N 75 125.425 123.757 1.668 1
1 829 . 18 1 1 A 76 76 LYS H H 76 8.099 8.621 -0.522 1
1 830 . 18 1 1 A 76 76 LYS HA H 76 4.210 4.422 -0.212 1
1 839 . 18 1 1 A 76 76 LYS C C 76 178.487 176.757 1.730 1
1 840 . 18 1 1 A 76 76 LYS CA C 76 58.010 55.459 2.551 1
1 841 . 18 1 1 A 76 76 LYS CB C 76 31.683 31.635 0.048 1
1 845 . 18 1 1 A 76 76 LYS N N 76 124.064 120.190 3.874 1
1 846 . 18 1 1 A 77 77 GLY H H 77 8.859 7.847 1.012 1
1 847 . 18 1 1 A 77 77 GLY HA2 H 77 4.110 4.066 0.044 1
1 848 . 18 1 1 A 77 77 GLY HA3 H 77 3.869 4.069 -0.200 1
1 849 . 18 1 1 A 77 77 GLY C C 77 174.335 174.715 -0.380 1
1 850 . 18 1 1 A 77 77 GLY CA C 77 46.232 44.940 1.292 1
1 851 . 18 1 1 A 77 77 GLY N N 77 115.659 108.698 6.961 1
1 852 . 18 1 1 A 78 78 THR H H 78 7.654 7.729 -0.075 1
1 853 . 18 1 1 A 78 78 THR HA H 78 4.624 4.164 0.460 1
1 858 . 18 1 1 A 78 78 THR C C 78 177.272 174.848 2.424 1
1 859 . 18 1 1 A 78 78 THR CA C 78 61.794 63.113 -1.319 1
1 860 . 18 1 1 A 78 78 THR CB C 78 70.595 69.241 1.354 1
1 862 . 18 1 1 A 78 78 THR N N 78 112.847 116.581 -3.734 1
1 863 . 18 1 1 A 79 79 THR H H 79 8.813 8.694 0.119 1
1 864 . 18 1 1 A 79 79 THR HA H 79 4.395 4.664 -0.269 1
1 869 . 18 1 1 A 79 79 THR C C 79 174.503 175.402 -0.899 1
1 870 . 18 1 1 A 79 79 THR CA C 79 61.724 61.027 0.697 1
1 871 . 18 1 1 A 79 79 THR CB C 79 71.007 71.203 -0.196 1
1 873 . 18 1 1 A 79 79 THR N N 79 114.123 117.567 -3.444 1
1 874 . 18 1 1 A 80 80 HIS H H 80 10.266 9.157 1.109 1
1 875 . 18 1 1 A 80 80 HIS HA H 80 4.331 4.445 -0.114 1
1 880 . 18 1 1 A 80 80 HIS C C 80 177.075 177.008 0.067 1
1 881 . 18 1 1 A 80 80 HIS CA C 80 61.338 59.977 1.361 1
1 882 . 18 1 1 A 80 80 HIS CB C 80 28.651 29.781 -1.130 1
1 885 . 18 1 1 A 80 80 HIS N N 80 122.776 121.802 0.974 1
1 886 . 18 1 1 A 81 81 HIS H H 81 9.335 7.957 1.378 1
1 887 . 18 1 1 A 81 81 HIS HA H 81 4.078 4.063 0.015 1
1 892 . 18 1 1 A 81 81 HIS C C 81 178.269 176.824 1.445 1
1 893 . 18 1 1 A 81 81 HIS CA C 81 60.210 59.440 0.770 1
1 894 . 18 1 1 A 81 81 HIS CB C 81 29.569 30.247 -0.678 1
1 897 . 18 1 1 A 81 81 HIS N N 81 114.733 118.845 -4.112 1
1 898 . 18 1 1 A 82 82 ASP H H 82 7.741 8.247 -0.506 1
1 899 . 18 1 1 A 82 82 ASP HA H 82 4.452 4.172 0.280 1
1 902 . 18 1 1 A 82 82 ASP C C 82 178.683 179.010 -0.327 1
1 903 . 18 1 1 A 82 82 ASP CA C 82 57.148 57.517 -0.369 1
1 904 . 18 1 1 A 82 82 ASP CB C 82 39.522 40.391 -0.869 1
1 905 . 18 1 1 A 82 82 ASP N N 82 121.407 117.934 3.473 1
1 906 . 18 1 1 A 83 83 ALA H H 83 8.502 7.649 0.853 1
1 907 . 18 1 1 A 83 83 ALA HA H 83 3.939 4.091 -0.152 1
1 911 . 18 1 1 A 83 83 ALA C C 83 179.361 179.372 -0.011 1
1 912 . 18 1 1 A 83 83 ALA CA C 83 55.635 54.950 0.685 1
1 913 . 18 1 1 A 83 83 ALA CB C 83 18.124 18.803 -0.679 1
1 914 . 18 1 1 A 83 83 ALA N N 83 125.049 122.804 2.245 1
1 915 . 18 1 1 A 84 84 LEU H H 84 8.100 7.992 0.108 1
1 916 . 18 1 1 A 84 84 LEU HA H 84 3.792 3.764 0.028 1
1 926 . 18 1 1 A 84 84 LEU C C 84 180.173 179.229 0.944 1
1 927 . 18 1 1 A 84 84 LEU CA C 84 57.932 57.982 -0.050 1
1 928 . 18 1 1 A 84 84 LEU CB C 84 41.157 41.529 -0.372 1
1 932 . 18 1 1 A 84 84 LEU N N 84 117.139 118.310 -1.171 1
1 933 . 18 1 1 A 85 85 ALA H H 85 7.715 8.725 -1.010 1
1 934 . 18 1 1 A 85 85 ALA HA H 85 4.061 4.137 -0.076 1
1 938 . 18 1 1 A 85 85 ALA C C 85 180.380 179.950 0.430 1
1 939 . 18 1 1 A 85 85 ALA CA C 85 55.212 55.352 -0.140 1
1 940 . 18 1 1 A 85 85 ALA CB C 85 17.803 18.505 -0.702 1
1 941 . 18 1 1 A 85 85 ALA N N 85 122.448 120.650 1.798 1
1 942 . 18 1 1 A 86 86 ILE H H 86 7.669 7.842 -0.173 1
1 943 . 18 1 1 A 86 86 ILE HA H 86 3.678 3.756 -0.078 1
1 953 . 18 1 1 A 86 86 ILE C C 86 178.692 178.849 -0.157 1
1 954 . 18 1 1 A 86 86 ILE CA C 86 65.226 64.656 0.570 1
1 955 . 18 1 1 A 86 86 ILE CB C 86 38.099 37.762 0.337 1
1 959 . 18 1 1 A 86 86 ILE N N 86 121.804 117.852 3.952 1
1 960 . 18 1 1 A 87 87 LEU H H 87 7.922 8.445 -0.523 1
1 961 . 18 1 1 A 87 87 LEU HA H 87 3.903 4.062 -0.159 1
1 971 . 18 1 1 A 87 87 LEU C C 87 178.610 178.902 -0.292 1
1 972 . 18 1 1 A 87 87 LEU CA C 87 58.221 57.857 0.364 1
1 973 . 18 1 1 A 87 87 LEU CB C 87 42.344 41.374 0.970 1
1 977 . 18 1 1 A 87 87 LEU N N 87 121.947 122.018 -0.071 1
1 978 . 18 1 1 A 88 88 ARG H H 88 8.317 8.283 0.034 1
1 979 . 18 1 1 A 88 88 ARG HA H 88 4.060 4.191 -0.131 1
1 986 . 18 1 1 A 88 88 ARG C C 88 180.698 177.370 3.328 1
1 987 . 18 1 1 A 88 88 ARG CA C 88 59.383 58.410 0.973 1
1 988 . 18 1 1 A 88 88 ARG CB C 88 30.055 30.027 0.028 1
1 991 . 18 1 1 A 88 88 ARG N N 88 119.343 119.844 -0.501 1
1 992 . 18 1 1 A 89 89 GLN H H 89 8.270 7.637 0.633 1
1 993 . 18 1 1 A 89 89 GLN HA H 89 4.122 4.179 -0.057 1
1 1000 . 18 1 1 A 89 89 GLN C C 89 177.955 178.309 -0.354 1
1 1001 . 18 1 1 A 89 89 GLN CA C 89 58.714 57.907 0.807 1
1 1002 . 18 1 1 A 89 89 GLN CB C 89 28.160 29.128 -0.968 1
1 1004 . 18 1 1 A 89 89 GLN N N 89 121.097 117.572 3.525 1
1 1006 . 18 1 1 A 90 90 ALA H H 90 7.558 7.429 0.129 1
1 1007 . 18 1 1 A 90 90 ALA HA H 90 4.123 4.182 -0.059 1
1 1011 . 18 1 1 A 90 90 ALA C C 90 178.076 178.058 0.018 1
1 1012 . 18 1 1 A 90 90 ALA CA C 90 52.942 53.871 -0.929 1
1 1013 . 18 1 1 A 90 90 ALA CB C 90 18.015 18.307 -0.292 1
1 1014 . 18 1 1 A 90 90 ALA N N 90 119.652 121.815 -2.163 1
1 1015 . 18 1 1 A 91 91 ARG H H 91 7.768 7.652 0.116 1
1 1016 . 18 1 1 A 91 91 ARG HA H 91 4.065 4.380 -0.315 1
1 1022 . 18 1 1 A 91 91 ARG C C 91 177.858 177.830 0.028 1
1 1023 . 18 1 1 A 91 91 ARG CA C 91 58.573 56.439 2.134 1
1 1024 . 18 1 1 A 91 91 ARG CB C 91 30.384 30.497 -0.113 1
1 1027 . 18 1 1 A 91 91 ARG N N 91 118.081 116.603 1.478 1
1 1028 . 18 1 1 A 92 92 GLU H H 92 7.691 8.023 -0.332 1
1 1029 . 18 1 1 A 92 92 GLU HA H 92 4.123 4.145 -0.022 1
1 1034 . 18 1 1 A 92 92 GLU C C 92 174.459 176.686 -2.227 1
1 1035 . 18 1 1 A 92 92 GLU CA C 92 61.565 60.792 0.773 1
1 1036 . 18 1 1 A 92 92 GLU CB C 92 27.583 29.058 -1.475 1
1 1038 . 18 1 1 A 92 92 GLU N N 92 118.447 118.052 0.395 1
1 1039 . 18 1 1 A 93 93 PRO HA H 93 4.716 4.574 0.142 1
1 1046 . 18 1 1 A 93 93 PRO C C 93 176.221 176.153 0.068 1
1 1047 . 18 1 1 A 93 93 PRO CA C 93 63.149 62.321 0.828 1
1 1048 . 18 1 1 A 93 93 PRO CB C 93 32.571 33.188 -0.617 1
1 1051 . 18 1 1 A 94 94 ARG H H 94 8.434 8.975 -0.541 1
1 1052 . 18 1 1 A 94 94 ARG HA H 94 4.232 4.469 -0.237 1
1 1058 . 18 1 1 A 94 94 ARG C C 94 175.323 176.119 -0.796 1
1 1059 . 18 1 1 A 94 94 ARG CA C 94 56.972 56.544 0.428 1
1 1060 . 18 1 1 A 94 94 ARG CB C 94 30.448 31.872 -1.424 1
1 1063 . 18 1 1 A 94 94 ARG N N 94 115.987 118.675 -2.688 1
1 1064 . 18 1 1 A 95 95 GLN H H 95 7.246 7.617 -0.371 1
1 1065 . 18 1 1 A 95 95 GLN HA H 95 5.251 5.347 -0.096 1
1 1072 . 18 1 1 A 95 95 GLN C C 95 174.786 173.675 1.111 1
1 1073 . 18 1 1 A 95 95 GLN CA C 95 54.209 54.256 -0.047 1
1 1074 . 18 1 1 A 95 95 GLN CB C 95 32.384 32.279 0.105 1
1 1076 . 18 1 1 A 95 95 GLN N N 95 115.998 119.562 -3.564 1
1 1078 . 18 1 1 A 96 96 ALA H H 96 8.739 8.257 0.482 1
1 1079 . 18 1 1 A 96 96 ALA HA H 96 5.412 5.115 0.297 1
1 1083 . 18 1 1 A 96 96 ALA C C 96 175.258 175.953 -0.695 1
1 1084 . 18 1 1 A 96 96 ALA CA C 96 50.355 50.912 -0.557 1
1 1085 . 18 1 1 A 96 96 ALA CB C 96 24.270 22.975 1.295 1
1 1086 . 18 1 1 A 96 96 ALA N N 96 126.197 125.416 0.781 1
1 1087 . 18 1 1 A 97 97 VAL H H 97 8.568 8.786 -0.218 1
1 1088 . 18 1 1 A 97 97 VAL HA H 97 4.804 4.572 0.232 1
1 1096 . 18 1 1 A 97 97 VAL C C 97 175.982 174.654 1.328 1
1 1097 . 18 1 1 A 97 97 VAL CA C 97 61.442 61.231 0.211 1
1 1098 . 18 1 1 A 97 97 VAL CB C 97 33.413 33.357 0.056 1
1 1101 . 18 1 1 A 97 97 VAL N N 97 120.702 120.577 0.125 1
1 1102 . 18 1 1 A 98 98 ILE H H 98 9.753 8.543 1.210 1
1 1103 . 18 1 1 A 98 98 ILE HA H 98 4.826 4.881 -0.055 1
1 1113 . 18 1 1 A 98 98 ILE C C 98 174.292 174.726 -0.434 1
1 1114 . 18 1 1 A 98 98 ILE CA C 98 59.981 59.799 0.182 1
1 1115 . 18 1 1 A 98 98 ILE CB C 98 40.608 39.809 0.799 1
1 1119 . 18 1 1 A 98 98 ILE N N 98 131.738 128.276 3.462 1
1 1120 . 18 1 1 A 99 99 VAL H H 99 8.493 8.922 -0.429 1
1 1121 . 18 1 1 A 99 99 VAL HA H 99 5.201 4.597 0.604 1
1 1129 . 18 1 1 A 99 99 VAL C C 99 176.557 175.287 1.270 1
1 1130 . 18 1 1 A 99 99 VAL CA C 99 61.495 61.512 -0.017 1
1 1131 . 18 1 1 A 99 99 VAL CB C 99 32.327 32.029 0.298 1
1 1134 . 18 1 1 A 99 99 VAL N N 99 129.537 129.052 0.485 1
1 1135 . 18 1 1 A 100 100 THR H H 100 9.050 8.948 0.102 1
1 1136 . 18 1 1 A 100 100 THR HA H 100 5.606 5.636 -0.030 1
1 1141 . 18 1 1 A 100 100 THR C C 100 172.815 172.590 0.225 1
1 1142 . 18 1 1 A 100 100 THR CA C 100 59.049 59.634 -0.585 1
1 1143 . 18 1 1 A 100 100 THR CB C 100 73.966 73.073 0.893 1
1 1145 . 18 1 1 A 100 100 THR N N 100 117.469 117.207 0.262 1
1 1146 . 18 1 1 A 101 101 ARG H H 101 8.773 8.682 0.091 1
1 1147 . 18 1 1 A 101 101 ARG HA H 101 4.989 5.155 -0.166 1
1 1155 . 18 1 1 A 101 101 ARG C C 101 174.738 174.962 -0.224 1
1 1156 . 18 1 1 A 101 101 ARG CA C 101 54.825 54.306 0.519 1
1 1157 . 18 1 1 A 101 101 ARG CB C 101 34.636 33.998 0.638 1
1 1160 . 18 1 1 A 101 101 ARG N N 101 117.532 119.836 -2.304 1
1 1162 . 18 1 1 A 102 102 LYS H H 102 8.616 8.299 0.317 1
1 1163 . 18 1 1 A 102 102 LYS HA H 102 4.232 4.304 -0.072 1
1 1171 . 18 1 1 A 102 102 LYS C C 102 175.935 175.639 0.296 1
1 1172 . 18 1 1 A 102 102 LYS CA C 102 56.549 56.398 0.151 1
1 1173 . 18 1 1 A 102 102 LYS CB C 102 33.266 32.486 0.780 1
1 1177 . 18 1 1 A 102 102 LYS N N 102 126.899 121.983 4.916 1
1 1178 . 18 1 1 A 103 103 LEU H H 103 8.424 8.702 -0.278 1
1 1179 . 18 1 1 A 103 103 LEU HA H 103 4.540 4.808 -0.268 1
1 1189 . 18 1 1 A 103 103 LEU C C 103 176.956 176.411 0.545 1
1 1190 . 18 1 1 A 103 103 LEU CA C 103 54.755 53.628 1.127 1
1 1191 . 18 1 1 A 103 103 LEU CB C 103 42.929 43.724 -0.795 1
1 1195 . 18 1 1 A 103 103 LEU N N 103 126.246 126.380 -0.134 1
1 1196 . 18 1 1 A 104 104 THR H H 104 8.201 8.447 -0.246 1
1 1197 . 18 1 1 A 104 104 THR HA H 104 4.624 4.387 0.237 1
1 1202 . 18 1 1 A 104 104 THR C C 104 172.954 174.107 -1.153 1
1 1203 . 18 1 1 A 104 104 THR CA C 104 59.483 60.905 -1.422 1
1 1204 . 18 1 1 A 104 104 THR CB C 104 69.761 69.014 0.747 1
1 1206 . 18 1 1 A 104 104 THR N N 104 117.263 116.110 1.153 1
1 1207 . 18 1 1 A 105 105 PRO HA H 105 4.399 4.707 -0.308 1
1 1213 . 18 1 1 A 105 105 PRO CA C 105 63.495 62.460 1.035 1
1 1214 . 18 1 1 A 105 105 PRO CB C 105 32.096 33.363 -1.267 1
1 1217 . 18 1 1 A 106 106 GLU H H 106 8.519 8.704 -0.185 1
1 1218 . 18 1 1 A 106 106 GLU HA H 106 4.197 5.086 -0.889 1
1 1221 . 18 1 1 A 106 106 GLU C C 106 176.110 174.727 1.383 1
1 1222 . 18 1 1 A 106 106 GLU CA C 106 56.743 55.491 1.252 1
1 1223 . 18 1 1 A 106 106 GLU CB C 106 30.137 33.076 -2.939 1
1 1225 . 18 1 1 A 106 106 GLU N N 106 120.609 116.975 3.634 1
1 1226 . 18 1 1 A 107 107 ALA H H 107 8.241 8.493 -0.252 1
1 1227 . 18 1 1 A 107 107 ALA HA H 107 4.317 4.883 -0.566 1
1 1231 . 18 1 1 A 107 107 ALA C C 107 177.299 175.973 1.326 1
1 1232 . 18 1 1 A 107 107 ALA CA C 107 52.203 51.843 0.360 1
1 1233 . 18 1 1 A 107 107 ALA CB C 107 19.392 22.181 -2.789 1
1 1234 . 18 1 1 A 107 107 ALA N N 107 124.849 120.619 4.230 1
1 1235 . 18 1 1 A 108 108 MET H H 108 8.284 8.759 -0.475 1
1 1236 . 18 1 1 A 108 108 MET HA H 108 4.792 4.538 0.254 1
1 1244 . 18 1 1 A 108 108 MET C C 108 174.337 175.649 -1.312 1
1 1245 . 18 1 1 A 108 108 MET CA C 108 53.258 56.600 -3.342 1
1 1246 . 18 1 1 A 108 108 MET CB C 108 32.608 35.080 -2.472 1
1 1249 . 18 1 1 A 108 108 MET N N 108 121.025 119.513 1.512 1
1 1250 . 18 1 1 A 109 109 PRO HA H 109 4.408 4.677 -0.269 1
1 1256 . 18 1 1 A 109 109 PRO C C 109 176.412 175.690 0.722 1
1 1257 . 18 1 1 A 109 109 PRO CA C 109 63.290 62.458 0.832 1
1 1258 . 18 1 1 A 109 109 PRO CB C 109 32.077 29.874 2.203 1
1 1261 . 18 1 1 A 110 110 ASP H H 110 8.417 7.917 0.500 1
1 1262 . 18 1 1 A 110 110 ASP HA H 110 4.573 5.394 -0.821 1
1 1265 . 18 1 1 A 110 110 ASP C C 110 176.508 175.267 1.241 1
1 1266 . 18 1 1 A 110 110 ASP CA C 110 54.085 52.466 1.619 1
1 1267 . 18 1 1 A 110 110 ASP CB C 110 41.075 44.169 -3.094 1
1 1268 . 18 1 1 A 110 110 ASP N N 110 120.239 117.913 2.326 1
1 1269 . 18 1 1 A 111 111 LEU H H 111 8.279 8.603 -0.324 1
1 1270 . 18 1 1 A 111 111 LEU HA H 111 4.319 4.212 0.107 1
1 1280 . 18 1 1 A 111 111 LEU C C 111 177.551 177.017 0.534 1
1 1281 . 18 1 1 A 111 111 LEU CA C 111 55.581 57.298 -1.717 1
1 1282 . 18 1 1 A 111 111 LEU CB C 111 42.360 41.721 0.639 1
1 1286 . 18 1 1 A 111 111 LEU N N 111 123.318 123.986 -0.668 1
1 1287 . 18 1 1 A 112 112 ASN H H 112 8.487 8.178 0.309 1
1 1288 . 18 1 1 A 112 112 ASN HA H 112 4.725 4.342 0.383 1
1 1293 . 18 1 1 A 112 112 ASN C C 112 175.454 173.926 1.528 1
1 1294 . 18 1 1 A 112 112 ASN CA C 112 53.610 53.959 -0.349 1
1 1295 . 18 1 1 A 112 112 ASN CB C 112 39.116 37.031 2.085 1
1 1296 . 18 1 1 A 112 112 ASN N N 112 118.752 117.978 0.774 1
1 1298 . 18 1 1 A 115 115 GLY H H 115 8.205 8.513 -0.308 1
1 1299 . 18 1 1 A 115 115 GLY HA2 H 115 4.126 4.318 -0.192 1
1 1300 . 18 1 1 A 115 115 GLY HA3 H 115 4.126 4.318 -0.192 1
1 1301 . 18 1 1 A 115 115 GLY CA C 115 44.727 44.737 -0.010 1
1 1302 . 18 1 1 A 116 116 PRO HA H 116 4.485 4.638 -0.153 1
1 1309 . 18 1 1 A 116 116 PRO CA C 116 63.298 62.392 0.906 1
1 1310 . 18 1 1 A 116 116 PRO CB C 116 32.077 33.243 -1.166 1
1 1313 . 18 1 1 A 117 117 SER H H 117 8.532 8.752 -0.220 1
1 1 . 19 1 1 A 7 7 GLY HA2 H 7 3.960 4.223 -0.263 1
1 2 . 19 1 1 A 7 7 GLY HA3 H 7 3.960 4.224 -0.264 1
1 3 . 19 1 1 A 7 7 GLY C C 7 174.009 172.292 1.717 1
1 4 . 19 1 1 A 7 7 GLY CA C 7 45.374 44.493 0.881 1
1 5 . 19 1 1 A 8 8 ALA H H 8 8.163 8.383 -0.220 1
1 6 . 19 1 1 A 8 8 ALA HA H 8 4.381 4.569 -0.188 1
1 10 . 19 1 1 A 8 8 ALA C C 8 178.078 177.069 1.009 1
1 11 . 19 1 1 A 8 8 ALA CA C 8 52.677 51.907 0.770 1
1 12 . 19 1 1 A 8 8 ALA CB C 8 19.368 19.581 -0.213 1
1 13 . 19 1 1 A 8 8 ALA N N 8 123.721 123.446 0.275 1
1 14 . 19 1 1 A 9 9 THR H H 9 8.142 8.659 -0.517 1
1 15 . 19 1 1 A 9 9 THR HA H 9 4.353 4.760 -0.407 1
1 20 . 19 1 1 A 9 9 THR C C 9 174.597 173.754 0.843 1
1 21 . 19 1 1 A 9 9 THR CA C 9 62.093 60.147 1.946 1
1 22 . 19 1 1 A 9 9 THR CB C 9 69.948 70.842 -0.894 1
1 24 . 19 1 1 A 9 9 THR N N 9 113.761 118.625 -4.864 1
1 25 . 19 1 1 A 10 10 LEU H H 10 8.218 8.470 -0.252 1
1 26 . 19 1 1 A 10 10 LEU HA H 10 4.169 4.570 -0.401 1
1 36 . 19 1 1 A 10 10 LEU C C 10 176.110 175.174 0.936 1
1 37 . 19 1 1 A 10 10 LEU CA C 10 61.099 53.711 7.388 1
1 38 . 19 1 1 A 10 10 LEU CB C 10 38.686 40.938 -2.252 1
1 42 . 19 1 1 A 10 10 LEU N N 10 123.516 127.439 -3.923 1
1 43 . 19 1 1 A 11 11 LYS H H 11 8.496 7.518 0.978 1
1 44 . 19 1 1 A 11 11 LYS HA H 11 4.891 4.797 0.094 1
1 49 . 19 1 1 A 11 11 LYS C C 11 175.794 174.259 1.535 1
1 50 . 19 1 1 A 11 11 LYS CA C 11 55.652 55.906 -0.254 1
1 51 . 19 1 1 A 11 11 LYS CB C 11 29.444 36.694 -7.250 1
1 52 . 19 1 1 A 11 11 LYS N N 11 125.141 123.754 1.387 1
1 53 . 19 1 1 A 12 12 GLN HA H 12 4.315 4.531 -0.216 1
1 54 . 19 1 1 A 12 12 GLN C C 12 176.300 176.033 0.267 1
1 55 . 19 1 1 A 12 12 GLN CA C 12 56.286 56.224 0.062 1
1 56 . 19 1 1 A 12 12 GLN CB C 12 32.901 30.182 2.719 1
1 57 . 19 1 1 A 13 13 LEU H H 13 8.410 8.093 0.317 1
1 58 . 19 1 1 A 13 13 LEU HA H 13 4.348 3.969 0.379 1
1 67 . 19 1 1 A 13 13 LEU C C 13 177.120 175.258 1.862 1
1 68 . 19 1 1 A 13 13 LEU CA C 13 55.142 55.808 -0.666 1
1 69 . 19 1 1 A 13 13 LEU CB C 13 42.352 41.013 1.339 1
1 73 . 19 1 1 A 13 13 LEU N N 13 124.340 120.120 4.220 1
1 74 . 19 1 1 A 14 14 ASP H H 14 8.250 8.360 -0.110 1
1 75 . 19 1 1 A 14 14 ASP HA H 14 4.540 4.753 -0.213 1
1 78 . 19 1 1 A 14 14 ASP C C 14 176.769 176.724 0.045 1
1 79 . 19 1 1 A 14 14 ASP CA C 14 54.772 54.949 -0.177 1
1 80 . 19 1 1 A 14 14 ASP CB C 14 41.322 43.325 -2.003 1
1 81 . 19 1 1 A 14 14 ASP N N 14 120.493 126.653 -6.160 1
1 82 . 19 1 1 A 15 15 GLY H H 15 8.428 8.229 0.199 1
1 83 . 19 1 1 A 15 15 GLY HA2 H 15 4.089 3.965 0.124 1
1 84 . 19 1 1 A 15 15 GLY HA3 H 15 3.874 3.996 -0.122 1
1 85 . 19 1 1 A 15 15 GLY C C 15 174.122 174.462 -0.340 1
1 86 . 19 1 1 A 15 15 GLY CA C 15 45.972 46.461 -0.489 1
1 87 . 19 1 1 A 15 15 GLY N N 15 108.670 107.742 0.928 1
1 88 . 19 1 1 A 16 16 ILE H H 16 7.727 7.918 -0.191 1
1 89 . 19 1 1 A 16 16 ILE HA H 16 4.705 4.006 0.699 1
1 99 . 19 1 1 A 16 16 ILE C C 16 175.807 175.166 0.641 1
1 100 . 19 1 1 A 16 16 ILE CA C 16 60.703 60.917 -0.214 1
1 101 . 19 1 1 A 16 16 ILE CB C 16 38.509 39.092 -0.583 1
1 105 . 19 1 1 A 16 16 ILE N N 16 120.267 121.756 -1.489 1
1 106 . 19 1 1 A 17 17 HIS H H 17 9.101 8.073 1.028 1
1 107 . 19 1 1 A 17 17 HIS HA H 17 4.782 5.710 -0.928 1
1 112 . 19 1 1 A 17 17 HIS C C 17 173.051 173.727 -0.676 1
1 113 . 19 1 1 A 17 17 HIS CA C 17 55.353 53.404 1.949 1
1 114 . 19 1 1 A 17 17 HIS CB C 17 32.468 32.649 -0.181 1
1 117 . 19 1 1 A 17 17 HIS N N 17 125.061 123.567 1.494 1
1 118 . 19 1 1 A 18 18 VAL H H 18 8.427 8.821 -0.394 1
1 119 . 19 1 1 A 18 18 VAL HA H 18 4.375 4.297 0.078 1
1 127 . 19 1 1 A 18 18 VAL C C 18 174.702 175.257 -0.555 1
1 128 . 19 1 1 A 18 18 VAL CA C 18 62.035 61.959 0.076 1
1 129 . 19 1 1 A 18 18 VAL CB C 18 32.325 32.283 0.042 1
1 132 . 19 1 1 A 18 18 VAL N N 18 127.069 124.578 2.491 1
1 133 . 19 1 1 A 19 19 THR H H 19 9.272 8.337 0.935 1
1 134 . 19 1 1 A 19 19 THR HA H 19 4.512 5.094 -0.582 1
1 139 . 19 1 1 A 19 19 THR C C 19 172.784 173.444 -0.660 1
1 140 . 19 1 1 A 19 19 THR CA C 19 62.512 61.746 0.766 1
1 141 . 19 1 1 A 19 19 THR CB C 19 70.663 70.857 -0.194 1
1 143 . 19 1 1 A 19 19 THR N N 19 126.619 121.479 5.140 1
1 144 . 19 1 1 A 20 20 ILE H H 20 8.737 9.206 -0.469 1
1 145 . 19 1 1 A 20 20 ILE HA H 20 4.870 4.588 0.282 1
1 155 . 19 1 1 A 20 20 ILE C C 20 175.315 174.511 0.804 1
1 156 . 19 1 1 A 20 20 ILE CA C 20 60.157 60.492 -0.335 1
1 157 . 19 1 1 A 20 20 ILE CB C 20 38.603 39.055 -0.452 1
1 161 . 19 1 1 A 20 20 ILE N N 20 128.114 128.511 -0.397 1
1 162 . 19 1 1 A 21 21 LEU H H 21 8.902 8.842 0.060 1
1 163 . 19 1 1 A 21 21 LEU HA H 21 4.804 4.843 -0.039 1
1 173 . 19 1 1 A 21 21 LEU C C 21 175.565 176.024 -0.459 1
1 174 . 19 1 1 A 21 21 LEU CA C 21 52.731 53.938 -1.207 1
1 175 . 19 1 1 A 21 21 LEU CB C 21 43.947 43.784 0.163 1
1 179 . 19 1 1 A 21 21 LEU N N 21 125.457 128.421 -2.964 1
1 180 . 19 1 1 A 22 22 HIS H H 22 8.577 9.098 -0.521 1
1 181 . 19 1 1 A 22 22 HIS HA H 22 5.013 5.164 -0.151 1
1 186 . 19 1 1 A 22 22 HIS C C 22 174.258 174.875 -0.617 1
1 187 . 19 1 1 A 22 22 HIS CA C 22 55.880 54.022 1.858 1
1 188 . 19 1 1 A 22 22 HIS CB C 22 30.901 31.358 -0.457 1
1 191 . 19 1 1 A 22 22 HIS N N 22 122.595 122.969 -0.374 1
1 192 . 19 1 1 A 23 23 LYS H H 23 8.712 9.960 -1.248 1
1 193 . 19 1 1 A 23 23 LYS HA H 23 4.880 4.957 -0.077 1
1 202 . 19 1 1 A 23 23 LYS C C 23 174.265 175.263 -0.998 1
1 203 . 19 1 1 A 23 23 LYS CA C 23 54.314 54.284 0.030 1
1 204 . 19 1 1 A 23 23 LYS CB C 23 36.068 36.094 -0.026 1
1 208 . 19 1 1 A 23 23 LYS N N 23 120.814 120.947 -0.133 1
1 209 . 19 1 1 A 24 24 GLU H H 24 8.360 8.440 -0.080 1
1 210 . 19 1 1 A 24 24 GLU HA H 24 4.350 4.399 -0.049 1
1 215 . 19 1 1 A 24 24 GLU C C 24 177.843 177.107 0.736 1
1 216 . 19 1 1 A 24 24 GLU CA C 24 55.601 56.244 -0.643 1
1 217 . 19 1 1 A 24 24 GLU CB C 24 30.512 30.673 -0.161 1
1 219 . 19 1 1 A 24 24 GLU N N 24 117.859 120.096 -2.237 1
1 220 . 19 1 1 A 25 25 GLU H H 25 9.146 8.798 0.348 1
1 221 . 19 1 1 A 25 25 GLU HA H 25 3.924 3.900 0.024 1
1 226 . 19 1 1 A 25 25 GLU C C 25 177.809 177.790 0.019 1
1 227 . 19 1 1 A 25 25 GLU CA C 25 58.568 58.716 -0.148 1
1 228 . 19 1 1 A 25 25 GLU CB C 25 29.313 29.285 0.028 1
1 230 . 19 1 1 A 25 25 GLU N N 25 124.543 122.678 1.865 1
1 231 . 19 1 1 A 26 26 GLY H H 26 8.242 8.965 -0.723 1
1 232 . 19 1 1 A 26 26 GLY HA2 H 26 4.287 3.991 0.296 1
1 233 . 19 1 1 A 26 26 GLY HA3 H 26 3.407 3.993 -0.586 1
1 234 . 19 1 1 A 26 26 GLY C C 26 174.234 175.034 -0.800 1
1 235 . 19 1 1 A 26 26 GLY CA C 26 46.113 46.052 0.061 1
1 236 . 19 1 1 A 26 26 GLY N N 26 115.394 114.041 1.353 1
1 237 . 19 1 1 A 27 27 ALA H H 27 7.432 8.899 -1.467 1
1 238 . 19 1 1 A 27 27 ALA HA H 27 4.402 4.280 0.122 1
1 242 . 19 1 1 A 27 27 ALA C C 27 178.138 178.244 -0.106 1
1 243 . 19 1 1 A 27 27 ALA CA C 27 52.273 52.922 -0.649 1
1 244 . 19 1 1 A 27 27 ALA CB C 27 20.214 19.643 0.571 1
1 245 . 19 1 1 A 27 27 ALA N N 27 122.323 122.677 -0.354 1
1 246 . 19 1 1 A 28 28 GLY H H 28 8.624 7.925 0.699 1
1 247 . 19 1 1 A 28 28 GLY HA2 H 28 4.134 4.060 0.074 1
1 248 . 19 1 1 A 28 28 GLY HA3 H 28 3.953 4.108 -0.155 1
1 249 . 19 1 1 A 28 28 GLY C C 28 174.069 174.894 -0.825 1
1 250 . 19 1 1 A 28 28 GLY CA C 28 44.546 44.634 -0.088 1
1 251 . 19 1 1 A 28 28 GLY N N 28 107.593 105.326 2.267 1
1 252 . 19 1 1 A 29 29 LEU H H 29 7.934 8.575 -0.641 1
1 253 . 19 1 1 A 29 29 LEU HA H 29 4.059 4.406 -0.347 1
1 263 . 19 1 1 A 29 29 LEU C C 29 177.548 176.985 0.563 1
1 264 . 19 1 1 A 29 29 LEU CA C 29 56.298 55.928 0.370 1
1 265 . 19 1 1 A 29 29 LEU CB C 29 41.940 42.812 -0.872 1
1 269 . 19 1 1 A 29 29 LEU N N 29 115.495 121.422 -5.927 1
1 270 . 19 1 1 A 30 30 GLY H H 30 8.669 8.066 0.603 1
1 271 . 19 1 1 A 30 30 GLY HA2 H 30 4.264 4.064 0.200 1
1 272 . 19 1 1 A 30 30 GLY HA3 H 30 4.001 4.145 -0.144 1
1 273 . 19 1 1 A 30 30 GLY C C 30 175.296 173.148 2.148 1
1 274 . 19 1 1 A 30 30 GLY CA C 30 46.368 44.980 1.388 1
1 275 . 19 1 1 A 30 30 GLY N N 30 103.121 106.011 -2.890 1
1 276 . 19 1 1 A 31 31 PHE H H 31 7.044 7.237 -0.193 1
1 277 . 19 1 1 A 31 31 PHE HA H 31 4.541 4.636 -0.095 1
1 285 . 19 1 1 A 31 31 PHE C C 31 171.141 172.301 -1.160 1
1 286 . 19 1 1 A 31 31 PHE CA C 31 55.704 55.339 0.365 1
1 287 . 19 1 1 A 31 31 PHE CB C 31 40.745 41.331 -0.586 1
1 293 . 19 1 1 A 31 31 PHE N N 31 115.404 114.927 0.477 1
1 294 . 19 1 1 A 32 32 SER H H 32 8.752 8.949 -0.197 1
1 295 . 19 1 1 A 32 32 SER HA H 32 4.990 4.957 0.033 1
1 298 . 19 1 1 A 32 32 SER C C 32 175.049 173.404 1.645 1
1 299 . 19 1 1 A 32 32 SER CA C 32 55.001 55.800 -0.799 1
1 300 . 19 1 1 A 32 32 SER CB C 32 67.170 66.116 1.054 1
1 301 . 19 1 1 A 32 32 SER N N 32 113.639 114.003 -0.364 1
1 302 . 19 1 1 A 33 33 LEU H H 33 8.639 8.495 0.144 1
1 303 . 19 1 1 A 33 33 LEU HA H 33 5.573 5.144 0.429 1
1 313 . 19 1 1 A 33 33 LEU C C 33 175.827 175.411 0.416 1
1 314 . 19 1 1 A 33 33 LEU CA C 33 53.620 53.500 0.120 1
1 315 . 19 1 1 A 33 33 LEU CB C 33 45.399 44.497 0.902 1
1 319 . 19 1 1 A 33 33 LEU N N 33 118.936 121.137 -2.201 1
1 320 . 19 1 1 A 34 34 ALA H H 34 9.410 8.914 0.496 1
1 321 . 19 1 1 A 34 34 ALA HA H 34 4.749 4.872 -0.123 1
1 325 . 19 1 1 A 34 34 ALA C C 34 176.231 176.618 -0.387 1
1 326 . 19 1 1 A 34 34 ALA CA C 34 50.425 51.102 -0.677 1
1 327 . 19 1 1 A 34 34 ALA CB C 34 22.518 22.772 -0.254 1
1 328 . 19 1 1 A 34 34 ALA N N 34 124.395 122.414 1.981 1
1 329 . 19 1 1 A 35 35 GLY H H 35 8.130 8.673 -0.543 1
1 330 . 19 1 1 A 35 35 GLY HA2 H 35 4.712 4.110 0.602 1
1 331 . 19 1 1 A 35 35 GLY HA3 H 35 3.955 4.151 -0.196 1
1 332 . 19 1 1 A 35 35 GLY C C 35 174.750 172.930 1.820 1
1 333 . 19 1 1 A 35 35 GLY CA C 35 44.494 44.906 -0.412 1
1 334 . 19 1 1 A 35 35 GLY N N 35 103.650 107.543 -3.893 1
1 335 . 19 1 1 A 36 36 GLY H H 36 8.217 7.952 0.265 1
1 336 . 19 1 1 A 36 36 GLY HA2 H 36 4.494 4.253 0.241 1
1 337 . 19 1 1 A 36 36 GLY HA3 H 36 3.836 4.298 -0.462 1
1 338 . 19 1 1 A 36 36 GLY C C 36 174.410 174.429 -0.019 1
1 339 . 19 1 1 A 36 36 GLY CA C 36 45.462 45.939 -0.477 1
1 340 . 19 1 1 A 36 36 GLY N N 36 122.114 107.678 14.436 1
1 341 . 19 1 1 A 37 37 ALA H H 37 8.963 8.757 0.206 1
1 342 . 19 1 1 A 37 37 ALA HA H 37 3.998 4.050 -0.052 1
1 346 . 19 1 1 A 37 37 ALA C C 37 176.935 179.141 -2.206 1
1 347 . 19 1 1 A 37 37 ALA CA C 37 55.308 54.626 0.682 1
1 348 . 19 1 1 A 37 37 ALA CB C 37 18.822 18.263 0.559 1
1 349 . 19 1 1 A 37 37 ALA N N 37 123.418 122.806 0.612 1
1 350 . 19 1 1 A 38 38 ASP H H 38 10.586 8.245 2.341 1
1 351 . 19 1 1 A 38 38 ASP HA H 38 4.485 4.364 0.121 1
1 354 . 19 1 1 A 38 38 ASP C C 38 175.309 176.534 -1.225 1
1 355 . 19 1 1 A 38 38 ASP CA C 38 52.730 56.415 -3.685 1
1 356 . 19 1 1 A 38 38 ASP CB C 38 38.689 40.955 -2.266 1
1 357 . 19 1 1 A 38 38 ASP N N 38 111.480 117.644 -6.164 1
1 358 . 19 1 1 A 39 39 LEU H H 39 7.789 7.626 0.163 1
1 359 . 19 1 1 A 39 39 LEU HA H 39 4.699 4.353 0.346 1
1 369 . 19 1 1 A 39 39 LEU C C 39 176.377 177.958 -1.581 1
1 370 . 19 1 1 A 39 39 LEU CA C 39 52.952 54.290 -1.338 1
1 371 . 19 1 1 A 39 39 LEU CB C 39 43.294 41.940 1.354 1
1 375 . 19 1 1 A 39 39 LEU N N 39 122.545 121.280 1.265 1
1 376 . 19 1 1 A 40 40 GLU H H 40 8.331 8.685 -0.354 1
1 377 . 19 1 1 A 40 40 GLU HA H 40 3.978 4.022 -0.044 1
1 382 . 19 1 1 A 40 40 GLU C C 40 176.887 177.102 -0.215 1
1 383 . 19 1 1 A 40 40 GLU CA C 40 59.066 59.758 -0.692 1
1 384 . 19 1 1 A 40 40 GLU CB C 40 29.523 29.740 -0.217 1
1 386 . 19 1 1 A 40 40 GLU N N 40 118.036 120.615 -2.579 1
1 387 . 19 1 1 A 41 41 ASN H H 41 7.890 8.048 -0.158 1
1 388 . 19 1 1 A 41 41 ASN HA H 41 4.820 4.817 0.003 1
1 393 . 19 1 1 A 41 41 ASN CA C 41 52.316 52.306 0.010 1
1 394 . 19 1 1 A 41 41 ASN CB C 41 37.409 38.277 -0.868 1
1 395 . 19 1 1 A 41 41 ASN N N 41 115.196 116.093 -0.897 1
1 397 . 19 1 1 A 42 42 LYS H H 42 7.943 8.586 -0.643 1
1 398 . 19 1 1 A 42 42 LYS HA H 42 4.328 4.183 0.145 1
1 407 . 19 1 1 A 42 42 LYS C C 42 177.081 177.245 -0.164 1
1 408 . 19 1 1 A 42 42 LYS CA C 42 56.567 59.249 -2.682 1
1 409 . 19 1 1 A 42 42 LYS CB C 42 33.120 32.611 0.509 1
1 413 . 19 1 1 A 42 42 LYS N N 42 120.612 125.301 -4.689 1
1 414 . 19 1 1 A 43 43 VAL H H 43 7.456 7.559 -0.103 1
1 415 . 19 1 1 A 43 43 VAL HA H 43 4.059 4.129 -0.070 1
1 423 . 19 1 1 A 43 43 VAL CA C 43 61.330 62.329 -0.999 1
1 424 . 19 1 1 A 43 43 VAL CB C 43 32.819 32.586 0.233 1
1 427 . 19 1 1 A 43 43 VAL N N 43 118.284 118.530 -0.246 1
1 428 . 19 1 1 A 44 44 ILE H H 44 8.481 8.481 0.000 1
1 429 . 19 1 1 A 44 44 ILE HA H 44 4.913 4.642 0.271 1
1 439 . 19 1 1 A 44 44 ILE C C 44 176.719 175.888 0.831 1
1 440 . 19 1 1 A 44 44 ILE CA C 44 59.946 61.426 -1.480 1
1 441 . 19 1 1 A 44 44 ILE CB C 44 35.784 37.773 -1.989 1
1 445 . 19 1 1 A 44 44 ILE N N 44 127.089 127.754 -0.665 1
1 446 . 19 1 1 A 45 45 THR H H 45 8.906 9.450 -0.544 1
1 447 . 19 1 1 A 45 45 THR HA H 45 5.400 5.036 0.364 1
1 452 . 19 1 1 A 45 45 THR CA C 45 58.528 59.487 -0.959 1
1 453 . 19 1 1 A 45 45 THR CB C 45 73.760 71.655 2.105 1
1 455 . 19 1 1 A 45 45 THR N N 45 116.832 117.427 -0.595 1
1 456 . 19 1 1 A 46 46 VAL H H 46 8.336 8.763 -0.427 1
1 457 . 19 1 1 A 46 46 VAL HA H 46 4.059 4.216 -0.157 1
1 465 . 19 1 1 A 46 46 VAL C C 46 176.648 176.609 0.039 1
1 466 . 19 1 1 A 46 46 VAL CA C 46 63.058 63.195 -0.137 1
1 467 . 19 1 1 A 46 46 VAL CB C 46 31.601 30.916 0.685 1
1 470 . 19 1 1 A 46 46 VAL N N 46 118.542 122.490 -3.948 1
1 471 . 19 1 1 A 47 47 HIS H H 47 9.382 8.624 0.758 1
1 472 . 19 1 1 A 47 47 HIS HA H 47 4.628 4.185 0.443 1
1 477 . 19 1 1 A 47 47 HIS C C 47 174.339 174.183 0.156 1
1 478 . 19 1 1 A 47 47 HIS CA C 47 57.764 59.899 -2.135 1
1 479 . 19 1 1 A 47 47 HIS CB C 47 31.453 30.479 0.974 1
1 482 . 19 1 1 A 47 47 HIS N N 47 133.900 128.229 5.671 1
1 483 . 19 1 1 A 48 48 ARG H H 48 7.135 7.842 -0.707 1
1 484 . 19 1 1 A 48 48 ARG HA H 48 4.360 4.780 -0.420 1
1 491 . 19 1 1 A 48 48 ARG C C 48 173.877 174.716 -0.839 1
1 492 . 19 1 1 A 48 48 ARG CA C 48 54.385 54.794 -0.409 1
1 493 . 19 1 1 A 48 48 ARG CB C 48 33.996 34.716 -0.720 1
1 496 . 19 1 1 A 48 48 ARG N N 48 114.736 117.566 -2.830 1
1 497 . 19 1 1 A 49 49 VAL H H 49 8.690 8.757 -0.067 1
1 498 . 19 1 1 A 49 49 VAL HA H 49 4.015 4.486 -0.471 1
1 506 . 19 1 1 A 49 49 VAL C C 49 176.255 175.551 0.704 1
1 507 . 19 1 1 A 49 49 VAL CA C 49 61.882 61.650 0.232 1
1 508 . 19 1 1 A 49 49 VAL CB C 49 32.261 32.720 -0.459 1
1 511 . 19 1 1 A 49 49 VAL N N 49 122.844 122.406 0.438 1
1 512 . 19 1 1 A 50 50 PHE H H 50 7.866 8.756 -0.890 1
1 513 . 19 1 1 A 50 50 PHE HA H 50 4.866 4.513 0.353 1
1 521 . 19 1 1 A 50 50 PHE C C 50 174.847 176.332 -1.485 1
1 522 . 19 1 1 A 50 50 PHE CA C 50 54.596 57.518 -2.922 1
1 523 . 19 1 1 A 50 50 PHE CB C 50 36.558 39.147 -2.589 1
1 529 . 19 1 1 A 50 50 PHE N N 50 128.498 127.559 0.939 1
1 530 . 19 1 1 A 51 51 PRO HA H 51 4.386 4.552 -0.166 1
1 537 . 19 1 1 A 51 51 PRO C C 51 177.321 176.677 0.644 1
1 538 . 19 1 1 A 51 51 PRO CA C 51 64.381 64.520 -0.139 1
1 539 . 19 1 1 A 51 51 PRO CB C 51 31.773 32.238 -0.465 1
1 542 . 19 1 1 A 52 52 ASN H H 52 8.814 8.546 0.268 1
1 543 . 19 1 1 A 52 52 ASN HA H 52 4.496 5.004 -0.508 1
1 548 . 19 1 1 A 52 52 ASN C C 52 174.823 174.681 0.142 1
1 549 . 19 1 1 A 52 52 ASN CA C 52 54.719 52.224 2.495 1
1 550 . 19 1 1 A 52 52 ASN CB C 52 38.109 39.258 -1.149 1
1 551 . 19 1 1 A 52 52 ASN N N 52 116.145 116.242 -0.097 1
1 553 . 19 1 1 A 53 53 GLY H H 53 7.730 8.235 -0.505 1
1 554 . 19 1 1 A 53 53 GLY HA2 H 53 4.430 4.303 0.127 1
1 555 . 19 1 1 A 53 53 GLY HA3 H 53 4.089 4.320 -0.231 1
1 556 . 19 1 1 A 53 53 GLY C C 53 174.810 173.934 0.876 1
1 557 . 19 1 1 A 53 53 GLY CA C 53 44.987 45.728 -0.741 1
1 558 . 19 1 1 A 53 53 GLY N N 53 106.196 110.457 -4.261 1
1 559 . 19 1 1 A 54 54 LEU H H 54 8.764 9.079 -0.315 1
1 560 . 19 1 1 A 54 54 LEU HA H 54 4.041 4.090 -0.049 1
1 570 . 19 1 1 A 54 54 LEU C C 54 179.712 178.704 1.008 1
1 571 . 19 1 1 A 54 54 LEU CA C 54 58.310 57.836 0.474 1
1 572 . 19 1 1 A 54 54 LEU CB C 54 42.390 42.049 0.341 1
1 576 . 19 1 1 A 54 54 LEU N N 54 118.836 119.660 -0.824 1
1 577 . 19 1 1 A 55 55 ALA H H 55 7.593 8.373 -0.780 1
1 578 . 19 1 1 A 55 55 ALA HA H 55 4.275 3.889 0.386 1
1 582 . 19 1 1 A 55 55 ALA C C 55 181.307 179.670 1.637 1
1 583 . 19 1 1 A 55 55 ALA CA C 55 54.825 54.746 0.079 1
1 584 . 19 1 1 A 55 55 ALA CB C 55 18.345 18.469 -0.124 1
1 585 . 19 1 1 A 55 55 ALA N N 55 118.782 121.229 -2.447 1
1 586 . 19 1 1 A 56 56 SER H H 56 9.339 7.854 1.485 1
1 587 . 19 1 1 A 56 56 SER HA H 56 4.023 4.331 -0.308 1
1 589 . 19 1 1 A 56 56 SER C C 56 176.392 176.763 -0.371 1
1 590 . 19 1 1 A 56 56 SER CA C 56 60.984 61.304 -0.320 1
1 591 . 19 1 1 A 56 56 SER CB C 56 62.987 63.401 -0.414 1
1 592 . 19 1 1 A 56 56 SER N N 56 117.631 112.885 4.746 1
1 593 . 19 1 1 A 57 57 GLN H H 57 7.942 7.454 0.488 1
1 594 . 19 1 1 A 57 57 GLN HA H 57 4.034 4.232 -0.198 1
1 601 . 19 1 1 A 57 57 GLN C C 57 177.400 178.211 -0.811 1
1 602 . 19 1 1 A 57 57 GLN CA C 57 58.362 58.714 -0.352 1
1 603 . 19 1 1 A 57 57 GLN CB C 57 28.801 28.202 0.599 1
1 605 . 19 1 1 A 57 57 GLN N N 57 118.162 121.624 -3.462 1
1 607 . 19 1 1 A 58 58 GLU H H 58 7.683 9.349 -1.666 1
1 608 . 19 1 1 A 58 58 GLU HA H 58 4.163 4.059 0.104 1
1 613 . 19 1 1 A 58 58 GLU C C 58 179.248 176.678 2.570 1
1 614 . 19 1 1 A 58 58 GLU CA C 58 59.559 58.586 0.973 1
1 615 . 19 1 1 A 58 58 GLU CB C 58 29.317 29.201 0.116 1
1 617 . 19 1 1 A 58 58 GLU N N 58 119.877 119.781 0.096 1
1 618 . 19 1 1 A 59 59 GLY H H 59 7.446 7.674 -0.228 1
1 619 . 19 1 1 A 59 59 GLY HA2 H 59 4.100 3.958 0.142 1
1 620 . 19 1 1 A 59 59 GLY HA3 H 59 3.770 3.960 -0.190 1
1 621 . 19 1 1 A 59 59 GLY C C 59 175.432 175.165 0.267 1
1 622 . 19 1 1 A 59 59 GLY CA C 59 46.817 45.488 1.329 1
1 623 . 19 1 1 A 59 59 GLY N N 59 102.653 107.650 -4.997 1
1 624 . 19 1 1 A 60 60 THR H H 60 8.343 7.979 0.364 1
1 625 . 19 1 1 A 60 60 THR HA H 60 4.037 4.132 -0.095 1
1 630 . 19 1 1 A 60 60 THR C C 60 175.843 174.591 1.252 1
1 631 . 19 1 1 A 60 60 THR CA C 60 64.792 65.509 -0.717 1
1 632 . 19 1 1 A 60 60 THR CB C 60 69.325 69.405 -0.080 1
1 634 . 19 1 1 A 60 60 THR N N 60 113.863 113.011 0.852 1
1 635 . 19 1 1 A 61 61 ILE H H 61 8.802 7.656 1.146 1
1 636 . 19 1 1 A 61 61 ILE HA H 61 3.631 4.092 -0.461 1
1 646 . 19 1 1 A 61 61 ILE C C 61 174.198 174.412 -0.214 1
1 647 . 19 1 1 A 61 61 ILE CA C 61 62.938 60.797 2.141 1
1 648 . 19 1 1 A 61 61 ILE CB C 61 37.225 36.203 1.022 1
1 652 . 19 1 1 A 61 61 ILE N N 61 126.153 119.416 6.737 1
1 653 . 19 1 1 A 62 62 GLN H H 62 7.124 9.427 -2.303 1
1 654 . 19 1 1 A 62 62 GLN HA H 62 4.500 4.592 -0.092 1
1 661 . 19 1 1 A 62 62 GLN C C 62 174.556 175.396 -0.840 1
1 662 . 19 1 1 A 62 62 GLN CA C 62 53.364 54.368 -1.004 1
1 663 . 19 1 1 A 62 62 GLN CB C 62 32.196 31.047 1.149 1
1 665 . 19 1 1 A 62 62 GLN N N 62 123.730 126.447 -2.717 1
1 667 . 19 1 1 A 63 63 LYS H H 63 8.399 8.527 -0.128 1
1 668 . 19 1 1 A 63 63 LYS HA H 63 3.464 4.344 -0.880 1
1 677 . 19 1 1 A 63 63 LYS CA C 63 57.905 56.904 1.001 1
1 678 . 19 1 1 A 63 63 LYS CB C 63 32.260 32.253 0.007 1
1 682 . 19 1 1 A 63 63 LYS N N 63 121.381 124.343 -2.962 1
1 683 . 19 1 1 A 64 64 GLY H H 64 9.265 9.075 0.190 1
1 684 . 19 1 1 A 64 64 GLY HA2 H 64 4.415 4.020 0.395 1
1 685 . 19 1 1 A 64 64 GLY HA3 H 64 3.639 4.026 -0.387 1
1 686 . 19 1 1 A 64 64 GLY CA C 64 44.881 45.031 -0.150 1
1 687 . 19 1 1 A 64 64 GLY N N 64 113.750 113.091 0.659 1
1 688 . 19 1 1 A 65 65 ASN H H 65 7.594 8.407 -0.813 1
1 689 . 19 1 1 A 65 65 ASN HA H 65 4.798 4.715 0.083 1
1 694 . 19 1 1 A 65 65 ASN C C 65 175.042 173.853 1.189 1
1 695 . 19 1 1 A 65 65 ASN CA C 65 53.047 53.864 -0.817 1
1 696 . 19 1 1 A 65 65 ASN CB C 65 38.153 39.699 -1.546 1
1 697 . 19 1 1 A 65 65 ASN N N 65 117.999 120.245 -2.246 1
1 699 . 19 1 1 A 66 66 GLU H H 66 8.538 8.573 -0.035 1
1 700 . 19 1 1 A 66 66 GLU HA H 66 4.634 4.701 -0.067 1
1 705 . 19 1 1 A 66 66 GLU C C 66 176.620 175.007 1.613 1
1 706 . 19 1 1 A 66 66 GLU CA C 66 55.863 54.988 0.875 1
1 707 . 19 1 1 A 66 66 GLU CB C 66 30.899 31.147 -0.248 1
1 709 . 19 1 1 A 66 66 GLU N N 66 122.233 122.008 0.225 1
1 710 . 19 1 1 A 67 67 VAL H H 67 8.452 9.421 -0.969 1
1 711 . 19 1 1 A 67 67 VAL HA H 67 4.172 4.030 0.142 1
1 719 . 19 1 1 A 67 67 VAL C C 67 174.641 175.472 -0.831 1
1 720 . 19 1 1 A 67 67 VAL CA C 67 61.856 63.162 -1.306 1
1 721 . 19 1 1 A 67 67 VAL CB C 67 31.066 31.523 -0.457 1
1 724 . 19 1 1 A 67 67 VAL N N 67 126.311 127.828 -1.517 1
1 725 . 19 1 1 A 68 68 LEU H H 68 9.000 8.900 0.100 1
1 726 . 19 1 1 A 68 68 LEU HA H 68 4.390 4.341 0.049 1
1 736 . 19 1 1 A 68 68 LEU C C 68 178.924 177.017 1.907 1
1 737 . 19 1 1 A 68 68 LEU CA C 68 56.990 56.101 0.889 1
1 738 . 19 1 1 A 68 68 LEU CB C 68 42.392 42.485 -0.093 1
1 742 . 19 1 1 A 68 68 LEU N N 68 127.175 129.062 -1.887 1
1 743 . 19 1 1 A 69 69 SER H H 69 7.666 7.829 -0.163 1
1 744 . 19 1 1 A 69 69 SER HA H 69 5.144 4.897 0.247 1
1 747 . 19 1 1 A 69 69 SER C C 69 172.722 172.374 0.348 1
1 748 . 19 1 1 A 69 69 SER CA C 69 57.606 57.463 0.143 1
1 749 . 19 1 1 A 69 69 SER CB C 69 64.511 65.972 -1.461 1
1 750 . 19 1 1 A 69 69 SER N N 69 110.346 109.293 1.053 1
1 751 . 19 1 1 A 70 70 ILE H H 70 7.965 8.288 -0.323 1
1 752 . 19 1 1 A 70 70 ILE HA H 70 4.548 4.899 -0.351 1
1 762 . 19 1 1 A 70 70 ILE C C 70 174.993 176.141 -1.148 1
1 763 . 19 1 1 A 70 70 ILE CA C 70 60.897 60.168 0.729 1
1 764 . 19 1 1 A 70 70 ILE CB C 70 41.186 40.592 0.594 1
1 768 . 19 1 1 A 70 70 ILE N N 70 119.579 120.922 -1.343 1
1 769 . 19 1 1 A 71 71 ASN H H 71 9.839 10.611 -0.772 1
1 770 . 19 1 1 A 71 71 ASN HA H 71 4.485 4.427 0.058 1
1 775 . 19 1 1 A 71 71 ASN C C 71 174.975 174.734 0.241 1
1 776 . 19 1 1 A 71 71 ASN CA C 71 54.085 54.376 -0.291 1
1 777 . 19 1 1 A 71 71 ASN CB C 71 36.255 37.690 -1.435 1
1 778 . 19 1 1 A 71 71 ASN N N 71 126.963 124.882 2.081 1
1 780 . 19 1 1 A 72 72 GLY H H 72 8.911 8.417 0.494 1
1 781 . 19 1 1 A 72 72 GLY HA2 H 72 4.149 3.922 0.227 1
1 782 . 19 1 1 A 72 72 GLY HA3 H 72 3.507 3.924 -0.417 1
1 783 . 19 1 1 A 72 72 GLY C C 72 173.594 173.529 0.065 1
1 784 . 19 1 1 A 72 72 GLY CA C 72 45.162 45.383 -0.221 1
1 785 . 19 1 1 A 72 72 GLY N N 72 103.020 105.298 -2.278 1
1 786 . 19 1 1 A 73 73 LYS H H 73 7.922 7.446 0.476 1
1 787 . 19 1 1 A 73 73 LYS HA H 73 4.485 4.593 -0.108 1
1 796 . 19 1 1 A 73 73 LYS C C 73 175.036 175.932 -0.896 1
1 797 . 19 1 1 A 73 73 LYS CA C 73 54.719 55.082 -0.363 1
1 798 . 19 1 1 A 73 73 LYS CB C 73 32.137 34.308 -2.171 1
1 802 . 19 1 1 A 73 73 LYS N N 73 122.413 122.369 0.044 1
1 803 . 19 1 1 A 74 74 SER H H 74 8.585 8.575 0.010 1
1 804 . 19 1 1 A 74 74 SER HA H 74 4.452 4.588 -0.136 1
1 807 . 19 1 1 A 74 74 SER C C 74 175.965 174.620 1.345 1
1 808 . 19 1 1 A 74 74 SER CA C 74 58.028 59.079 -1.051 1
1 809 . 19 1 1 A 74 74 SER CB C 74 63.799 63.755 0.044 1
1 810 . 19 1 1 A 74 74 SER N N 74 118.737 123.634 -4.897 1
1 811 . 19 1 1 A 75 75 LEU H H 75 8.015 8.234 -0.219 1
1 812 . 19 1 1 A 75 75 LEU HA H 75 4.661 4.454 0.207 1
1 822 . 19 1 1 A 75 75 LEU C C 75 178.117 177.586 0.531 1
1 823 . 19 1 1 A 75 75 LEU CA C 75 53.980 54.528 -0.548 1
1 824 . 19 1 1 A 75 75 LEU CB C 75 40.830 41.090 -0.260 1
1 828 . 19 1 1 A 75 75 LEU N N 75 125.425 125.181 0.244 1
1 829 . 19 1 1 A 76 76 LYS H H 76 8.099 8.610 -0.511 1
1 830 . 19 1 1 A 76 76 LYS HA H 76 4.210 4.419 -0.209 1
1 839 . 19 1 1 A 76 76 LYS C C 76 178.487 176.758 1.729 1
1 840 . 19 1 1 A 76 76 LYS CA C 76 58.010 55.451 2.559 1
1 841 . 19 1 1 A 76 76 LYS CB C 76 31.683 31.655 0.028 1
1 845 . 19 1 1 A 76 76 LYS N N 76 124.064 120.168 3.896 1
1 846 . 19 1 1 A 77 77 GLY H H 77 8.859 7.837 1.022 1
1 847 . 19 1 1 A 77 77 GLY HA2 H 77 4.110 4.054 0.056 1
1 848 . 19 1 1 A 77 77 GLY HA3 H 77 3.869 4.055 -0.186 1
1 849 . 19 1 1 A 77 77 GLY C C 77 174.335 174.718 -0.383 1
1 850 . 19 1 1 A 77 77 GLY CA C 77 46.232 44.923 1.309 1
1 851 . 19 1 1 A 77 77 GLY N N 77 115.659 108.709 6.950 1
1 852 . 19 1 1 A 78 78 THR H H 78 7.654 7.723 -0.069 1
1 853 . 19 1 1 A 78 78 THR HA H 78 4.624 4.161 0.463 1
1 858 . 19 1 1 A 78 78 THR C C 78 177.272 174.798 2.474 1
1 859 . 19 1 1 A 78 78 THR CA C 78 61.794 63.280 -1.486 1
1 860 . 19 1 1 A 78 78 THR CB C 78 70.595 69.210 1.385 1
1 862 . 19 1 1 A 78 78 THR N N 78 112.847 116.758 -3.911 1
1 863 . 19 1 1 A 79 79 THR H H 79 8.813 8.504 0.309 1
1 864 . 19 1 1 A 79 79 THR HA H 79 4.395 4.545 -0.150 1
1 869 . 19 1 1 A 79 79 THR C C 79 174.503 175.416 -0.913 1
1 870 . 19 1 1 A 79 79 THR CA C 79 61.724 61.256 0.468 1
1 871 . 19 1 1 A 79 79 THR CB C 79 71.007 70.834 0.173 1
1 873 . 19 1 1 A 79 79 THR N N 79 114.123 118.131 -4.008 1
1 874 . 19 1 1 A 80 80 HIS H H 80 10.266 8.961 1.305 1
1 875 . 19 1 1 A 80 80 HIS HA H 80 4.331 4.405 -0.074 1
1 880 . 19 1 1 A 80 80 HIS C C 80 177.075 176.919 0.156 1
1 881 . 19 1 1 A 80 80 HIS CA C 80 61.338 59.297 2.041 1
1 882 . 19 1 1 A 80 80 HIS CB C 80 28.651 29.828 -1.177 1
1 885 . 19 1 1 A 80 80 HIS N N 80 122.776 121.234 1.542 1
1 886 . 19 1 1 A 81 81 HIS H H 81 9.335 8.085 1.250 1
1 887 . 19 1 1 A 81 81 HIS HA H 81 4.078 4.132 -0.054 1
1 892 . 19 1 1 A 81 81 HIS C C 81 178.269 176.628 1.641 1
1 893 . 19 1 1 A 81 81 HIS CA C 81 60.210 59.629 0.581 1
1 894 . 19 1 1 A 81 81 HIS CB C 81 29.569 30.096 -0.527 1
1 897 . 19 1 1 A 81 81 HIS N N 81 114.733 118.999 -4.266 1
1 898 . 19 1 1 A 82 82 ASP H H 82 7.741 8.130 -0.389 1
1 899 . 19 1 1 A 82 82 ASP HA H 82 4.452 4.311 0.141 1
1 902 . 19 1 1 A 82 82 ASP C C 82 178.683 178.683 0.000 1
1 903 . 19 1 1 A 82 82 ASP CA C 82 57.148 57.515 -0.367 1
1 904 . 19 1 1 A 82 82 ASP CB C 82 39.522 40.376 -0.854 1
1 905 . 19 1 1 A 82 82 ASP N N 82 121.407 118.135 3.272 1
1 906 . 19 1 1 A 83 83 ALA H H 83 8.502 7.821 0.681 1
1 907 . 19 1 1 A 83 83 ALA HA H 83 3.939 4.247 -0.308 1
1 911 . 19 1 1 A 83 83 ALA C C 83 179.361 180.027 -0.666 1
1 912 . 19 1 1 A 83 83 ALA CA C 83 55.635 54.430 1.205 1
1 913 . 19 1 1 A 83 83 ALA CB C 83 18.124 18.860 -0.736 1
1 914 . 19 1 1 A 83 83 ALA N N 83 125.049 122.616 2.433 1
1 915 . 19 1 1 A 84 84 LEU H H 84 8.100 8.263 -0.163 1
1 916 . 19 1 1 A 84 84 LEU HA H 84 3.792 3.971 -0.179 1
1 926 . 19 1 1 A 84 84 LEU C C 84 180.173 178.459 1.714 1
1 927 . 19 1 1 A 84 84 LEU CA C 84 57.932 57.714 0.218 1
1 928 . 19 1 1 A 84 84 LEU CB C 84 41.157 41.315 -0.158 1
1 932 . 19 1 1 A 84 84 LEU N N 84 117.139 119.937 -2.798 1
1 933 . 19 1 1 A 85 85 ALA H H 85 7.715 9.312 -1.597 1
1 934 . 19 1 1 A 85 85 ALA HA H 85 4.061 4.052 0.009 1
1 938 . 19 1 1 A 85 85 ALA C C 85 180.380 179.918 0.462 1
1 939 . 19 1 1 A 85 85 ALA CA C 85 55.212 55.367 -0.155 1
1 940 . 19 1 1 A 85 85 ALA CB C 85 17.803 18.605 -0.802 1
1 941 . 19 1 1 A 85 85 ALA N N 85 122.448 120.644 1.804 1
1 942 . 19 1 1 A 86 86 ILE H H 86 7.669 7.794 -0.125 1
1 943 . 19 1 1 A 86 86 ILE HA H 86 3.678 3.712 -0.034 1
1 953 . 19 1 1 A 86 86 ILE C C 86 178.692 178.226 0.466 1
1 954 . 19 1 1 A 86 86 ILE CA C 86 65.226 64.956 0.270 1
1 955 . 19 1 1 A 86 86 ILE CB C 86 38.099 37.914 0.185 1
1 959 . 19 1 1 A 86 86 ILE N N 86 121.804 117.874 3.930 1
1 960 . 19 1 1 A 87 87 LEU H H 87 7.922 8.249 -0.327 1
1 961 . 19 1 1 A 87 87 LEU HA H 87 3.903 3.926 -0.023 1
1 971 . 19 1 1 A 87 87 LEU C C 87 178.610 178.581 0.029 1
1 972 . 19 1 1 A 87 87 LEU CA C 87 58.221 58.139 0.082 1
1 973 . 19 1 1 A 87 87 LEU CB C 87 42.344 41.707 0.637 1
1 977 . 19 1 1 A 87 87 LEU N N 87 121.947 120.806 1.141 1
1 978 . 19 1 1 A 88 88 ARG H H 88 8.317 8.878 -0.561 1
1 979 . 19 1 1 A 88 88 ARG HA H 88 4.060 4.035 0.025 1
1 986 . 19 1 1 A 88 88 ARG C C 88 180.698 177.857 2.841 1
1 987 . 19 1 1 A 88 88 ARG CA C 88 59.383 58.028 1.355 1
1 988 . 19 1 1 A 88 88 ARG CB C 88 30.055 29.533 0.522 1
1 991 . 19 1 1 A 88 88 ARG N N 88 119.343 118.161 1.182 1
1 992 . 19 1 1 A 89 89 GLN H H 89 8.270 7.996 0.274 1
1 993 . 19 1 1 A 89 89 GLN HA H 89 4.122 4.072 0.050 1
1 1000 . 19 1 1 A 89 89 GLN C C 89 177.955 178.197 -0.242 1
1 1001 . 19 1 1 A 89 89 GLN CA C 89 58.714 58.479 0.235 1
1 1002 . 19 1 1 A 89 89 GLN CB C 89 28.160 28.078 0.082 1
1 1004 . 19 1 1 A 89 89 GLN N N 89 121.097 117.935 3.162 1
1 1006 . 19 1 1 A 90 90 ALA H H 90 7.558 7.915 -0.357 1
1 1007 . 19 1 1 A 90 90 ALA HA H 90 4.123 4.177 -0.054 1
1 1011 . 19 1 1 A 90 90 ALA C C 90 178.076 178.213 -0.137 1
1 1012 . 19 1 1 A 90 90 ALA CA C 90 52.942 53.765 -0.823 1
1 1013 . 19 1 1 A 90 90 ALA CB C 90 18.015 18.308 -0.293 1
1 1014 . 19 1 1 A 90 90 ALA N N 90 119.652 121.629 -1.977 1
1 1015 . 19 1 1 A 91 91 ARG H H 91 7.768 8.134 -0.366 1
1 1016 . 19 1 1 A 91 91 ARG HA H 91 4.065 4.264 -0.199 1
1 1022 . 19 1 1 A 91 91 ARG C C 91 177.858 177.655 0.203 1
1 1023 . 19 1 1 A 91 91 ARG CA C 91 58.573 57.451 1.122 1
1 1024 . 19 1 1 A 91 91 ARG CB C 91 30.384 30.674 -0.290 1
1 1027 . 19 1 1 A 91 91 ARG N N 91 118.081 117.617 0.464 1
1 1028 . 19 1 1 A 92 92 GLU H H 92 7.691 7.883 -0.192 1
1 1029 . 19 1 1 A 92 92 GLU HA H 92 4.123 4.165 -0.042 1
1 1034 . 19 1 1 A 92 92 GLU C C 92 174.459 176.721 -2.262 1
1 1035 . 19 1 1 A 92 92 GLU CA C 92 61.565 60.862 0.703 1
1 1036 . 19 1 1 A 92 92 GLU CB C 92 27.583 28.830 -1.247 1
1 1038 . 19 1 1 A 92 92 GLU N N 92 118.447 119.181 -0.734 1
1 1039 . 19 1 1 A 93 93 PRO HA H 93 4.716 4.547 0.169 1
1 1046 . 19 1 1 A 93 93 PRO C C 93 176.221 176.454 -0.233 1
1 1047 . 19 1 1 A 93 93 PRO CA C 93 63.149 62.510 0.639 1
1 1048 . 19 1 1 A 93 93 PRO CB C 93 32.571 32.806 -0.235 1
1 1051 . 19 1 1 A 94 94 ARG H H 94 8.434 9.091 -0.657 1
1 1052 . 19 1 1 A 94 94 ARG HA H 94 4.232 4.580 -0.348 1
1 1058 . 19 1 1 A 94 94 ARG C C 94 175.323 175.932 -0.609 1
1 1059 . 19 1 1 A 94 94 ARG CA C 94 56.972 57.055 -0.083 1
1 1060 . 19 1 1 A 94 94 ARG CB C 94 30.448 30.877 -0.429 1
1 1063 . 19 1 1 A 94 94 ARG N N 94 115.987 119.257 -3.270 1
1 1064 . 19 1 1 A 95 95 GLN H H 95 7.246 7.649 -0.403 1
1 1065 . 19 1 1 A 95 95 GLN HA H 95 5.251 5.306 -0.055 1
1 1072 . 19 1 1 A 95 95 GLN C C 95 174.786 173.647 1.139 1
1 1073 . 19 1 1 A 95 95 GLN CA C 95 54.209 54.503 -0.294 1
1 1074 . 19 1 1 A 95 95 GLN CB C 95 32.384 32.506 -0.122 1
1 1076 . 19 1 1 A 95 95 GLN N N 95 115.998 119.520 -3.522 1
1 1078 . 19 1 1 A 96 96 ALA H H 96 8.739 8.233 0.506 1
1 1079 . 19 1 1 A 96 96 ALA HA H 96 5.412 5.212 0.200 1
1 1083 . 19 1 1 A 96 96 ALA C C 96 175.258 175.627 -0.369 1
1 1084 . 19 1 1 A 96 96 ALA CA C 96 50.355 50.450 -0.095 1
1 1085 . 19 1 1 A 96 96 ALA CB C 96 24.270 23.475 0.795 1
1 1086 . 19 1 1 A 96 96 ALA N N 96 126.197 125.447 0.750 1
1 1087 . 19 1 1 A 97 97 VAL H H 97 8.568 8.596 -0.028 1
1 1088 . 19 1 1 A 97 97 VAL HA H 97 4.804 4.903 -0.099 1
1 1096 . 19 1 1 A 97 97 VAL C C 97 175.982 174.923 1.059 1
1 1097 . 19 1 1 A 97 97 VAL CA C 97 61.442 61.187 0.255 1
1 1098 . 19 1 1 A 97 97 VAL CB C 97 33.413 34.129 -0.716 1
1 1101 . 19 1 1 A 97 97 VAL N N 97 120.702 119.399 1.303 1
1 1102 . 19 1 1 A 98 98 ILE H H 98 9.753 8.388 1.365 1
1 1103 . 19 1 1 A 98 98 ILE HA H 98 4.826 4.948 -0.122 1
1 1113 . 19 1 1 A 98 98 ILE C C 98 174.292 174.565 -0.273 1
1 1114 . 19 1 1 A 98 98 ILE CA C 98 59.981 60.028 -0.047 1
1 1115 . 19 1 1 A 98 98 ILE CB C 98 40.608 41.571 -0.963 1
1 1119 . 19 1 1 A 98 98 ILE N N 98 131.738 126.802 4.936 1
1 1120 . 19 1 1 A 99 99 VAL H H 99 8.493 8.590 -0.097 1
1 1121 . 19 1 1 A 99 99 VAL HA H 99 5.201 4.770 0.431 1
1 1129 . 19 1 1 A 99 99 VAL C C 99 176.557 175.291 1.266 1
1 1130 . 19 1 1 A 99 99 VAL CA C 99 61.495 60.766 0.729 1
1 1131 . 19 1 1 A 99 99 VAL CB C 99 32.327 32.794 -0.467 1
1 1134 . 19 1 1 A 99 99 VAL N N 99 129.537 128.827 0.710 1
1 1135 . 19 1 1 A 100 100 THR H H 100 9.050 8.406 0.644 1
1 1136 . 19 1 1 A 100 100 THR HA H 100 5.606 5.165 0.441 1
1 1141 . 19 1 1 A 100 100 THR C C 100 172.815 172.809 0.006 1
1 1142 . 19 1 1 A 100 100 THR CA C 100 59.049 59.472 -0.423 1
1 1143 . 19 1 1 A 100 100 THR CB C 100 73.966 72.038 1.928 1
1 1145 . 19 1 1 A 100 100 THR N N 100 117.469 117.362 0.107 1
1 1146 . 19 1 1 A 101 101 ARG H H 101 8.773 8.751 0.022 1
1 1147 . 19 1 1 A 101 101 ARG HA H 101 4.989 4.576 0.413 1
1 1155 . 19 1 1 A 101 101 ARG C C 101 174.738 174.612 0.126 1
1 1156 . 19 1 1 A 101 101 ARG CA C 101 54.825 53.672 1.153 1
1 1157 . 19 1 1 A 101 101 ARG CB C 101 34.636 33.852 0.784 1
1 1160 . 19 1 1 A 101 101 ARG N N 101 117.532 120.605 -3.073 1
1 1162 . 19 1 1 A 102 102 LYS H H 102 8.616 8.707 -0.091 1
1 1163 . 19 1 1 A 102 102 LYS HA H 102 4.232 4.746 -0.514 1
1 1171 . 19 1 1 A 102 102 LYS C C 102 175.935 176.122 -0.187 1
1 1172 . 19 1 1 A 102 102 LYS CA C 102 56.549 56.160 0.389 1
1 1173 . 19 1 1 A 102 102 LYS CB C 102 33.266 33.593 -0.327 1
1 1177 . 19 1 1 A 102 102 LYS N N 102 126.899 123.413 3.486 1
1 1178 . 19 1 1 A 103 103 LEU H H 103 8.424 8.691 -0.267 1
1 1179 . 19 1 1 A 103 103 LEU HA H 103 4.540 4.355 0.185 1
1 1189 . 19 1 1 A 103 103 LEU C C 103 176.956 176.753 0.203 1
1 1190 . 19 1 1 A 103 103 LEU CA C 103 54.755 55.502 -0.747 1
1 1191 . 19 1 1 A 103 103 LEU CB C 103 42.929 42.657 0.272 1
1 1195 . 19 1 1 A 103 103 LEU N N 103 126.246 123.620 2.626 1
1 1196 . 19 1 1 A 104 104 THR H H 104 8.201 7.574 0.627 1
1 1197 . 19 1 1 A 104 104 THR HA H 104 4.624 4.347 0.277 1
1 1202 . 19 1 1 A 104 104 THR C C 104 172.954 174.245 -1.291 1
1 1203 . 19 1 1 A 104 104 THR CA C 104 59.483 60.884 -1.401 1
1 1204 . 19 1 1 A 104 104 THR CB C 104 69.761 68.849 0.912 1
1 1206 . 19 1 1 A 104 104 THR N N 104 117.263 112.891 4.372 1
1 1207 . 19 1 1 A 105 105 PRO HA H 105 4.399 4.530 -0.131 1
1 1213 . 19 1 1 A 105 105 PRO CA C 105 63.495 62.223 1.272 1
1 1214 . 19 1 1 A 105 105 PRO CB C 105 32.096 32.318 -0.222 1
1 1217 . 19 1 1 A 106 106 GLU H H 106 8.519 8.488 0.031 1
1 1218 . 19 1 1 A 106 106 GLU HA H 106 4.197 4.474 -0.277 1
1 1221 . 19 1 1 A 106 106 GLU C C 106 176.110 177.223 -1.113 1
1 1222 . 19 1 1 A 106 106 GLU CA C 106 56.743 56.487 0.256 1
1 1223 . 19 1 1 A 106 106 GLU CB C 106 30.137 30.767 -0.630 1
1 1225 . 19 1 1 A 106 106 GLU N N 106 120.609 120.567 0.042 1
1 1226 . 19 1 1 A 107 107 ALA H H 107 8.241 8.710 -0.469 1
1 1227 . 19 1 1 A 107 107 ALA HA H 107 4.317 4.418 -0.101 1
1 1231 . 19 1 1 A 107 107 ALA C C 107 177.299 177.239 0.060 1
1 1232 . 19 1 1 A 107 107 ALA CA C 107 52.203 54.136 -1.933 1
1 1233 . 19 1 1 A 107 107 ALA CB C 107 19.392 19.440 -0.048 1
1 1234 . 19 1 1 A 107 107 ALA N N 107 124.849 123.521 1.328 1
1 1235 . 19 1 1 A 108 108 MET H H 108 8.284 7.774 0.510 1
1 1236 . 19 1 1 A 108 108 MET HA H 108 4.792 4.878 -0.086 1
1 1244 . 19 1 1 A 108 108 MET C C 108 174.337 173.929 0.408 1
1 1245 . 19 1 1 A 108 108 MET CA C 108 53.258 52.958 0.300 1
1 1246 . 19 1 1 A 108 108 MET CB C 108 32.608 33.086 -0.478 1
1 1249 . 19 1 1 A 108 108 MET N N 108 121.025 114.868 6.157 1
1 1250 . 19 1 1 A 109 109 PRO HA H 109 4.408 4.611 -0.203 1
1 1256 . 19 1 1 A 109 109 PRO C C 109 176.412 175.368 1.044 1
1 1257 . 19 1 1 A 109 109 PRO CA C 109 63.290 62.659 0.631 1
1 1258 . 19 1 1 A 109 109 PRO CB C 109 32.077 29.455 2.622 1
1 1261 . 19 1 1 A 110 110 ASP H H 110 8.417 8.476 -0.059 1
1 1262 . 19 1 1 A 110 110 ASP HA H 110 4.573 4.823 -0.250 1
1 1265 . 19 1 1 A 110 110 ASP C C 110 176.508 175.297 1.211 1
1 1266 . 19 1 1 A 110 110 ASP CA C 110 54.085 53.768 0.317 1
1 1267 . 19 1 1 A 110 110 ASP CB C 110 41.075 41.955 -0.880 1
1 1268 . 19 1 1 A 110 110 ASP N N 110 120.239 121.681 -1.442 1
1 1269 . 19 1 1 A 111 111 LEU H H 111 8.279 8.779 -0.500 1
1 1270 . 19 1 1 A 111 111 LEU HA H 111 4.319 3.866 0.453 1
1 1280 . 19 1 1 A 111 111 LEU C C 111 177.551 178.338 -0.787 1
1 1281 . 19 1 1 A 111 111 LEU CA C 111 55.581 58.008 -2.427 1
1 1282 . 19 1 1 A 111 111 LEU CB C 111 42.360 41.848 0.512 1
1 1286 . 19 1 1 A 111 111 LEU N N 111 123.318 125.059 -1.741 1
1 1287 . 19 1 1 A 112 112 ASN H H 112 8.487 7.913 0.574 1
1 1288 . 19 1 1 A 112 112 ASN HA H 112 4.725 4.744 -0.019 1
1 1293 . 19 1 1 A 112 112 ASN C C 112 175.454 174.911 0.543 1
1 1294 . 19 1 1 A 112 112 ASN CA C 112 53.610 55.078 -1.468 1
1 1295 . 19 1 1 A 112 112 ASN CB C 112 39.116 39.141 -0.025 1
1 1296 . 19 1 1 A 112 112 ASN N N 112 118.752 115.609 3.143 1
1 1298 . 19 1 1 A 115 115 GLY H H 115 8.205 8.402 -0.197 1
1 1299 . 19 1 1 A 115 115 GLY HA2 H 115 4.126 4.188 -0.062 1
1 1300 . 19 1 1 A 115 115 GLY HA3 H 115 4.126 4.188 -0.062 1
1 1301 . 19 1 1 A 115 115 GLY CA C 115 44.727 45.583 -0.856 1
1 1302 . 19 1 1 A 116 116 PRO HA H 116 4.485 4.681 -0.196 1
1 1309 . 19 1 1 A 116 116 PRO CA C 116 63.298 62.455 0.843 1
1 1310 . 19 1 1 A 116 116 PRO CB C 116 32.077 33.338 -1.261 1
1 1313 . 19 1 1 A 117 117 SER H H 117 8.532 8.473 0.059 1
1 1 . 20 1 1 A 7 7 GLY HA2 H 7 3.960 4.024 -0.064 1
1 2 . 20 1 1 A 7 7 GLY HA3 H 7 3.960 4.025 -0.065 1
1 3 . 20 1 1 A 7 7 GLY C C 7 174.009 172.213 1.796 1
1 4 . 20 1 1 A 7 7 GLY CA C 7 45.374 44.688 0.686 1
1 5 . 20 1 1 A 8 8 ALA H H 8 8.163 8.215 -0.052 1
1 6 . 20 1 1 A 8 8 ALA HA H 8 4.381 4.968 -0.587 1
1 10 . 20 1 1 A 8 8 ALA C C 8 178.078 175.334 2.744 1
1 11 . 20 1 1 A 8 8 ALA CA C 8 52.677 51.518 1.159 1
1 12 . 20 1 1 A 8 8 ALA CB C 8 19.368 23.271 -3.903 1
1 13 . 20 1 1 A 8 8 ALA N N 8 123.721 120.325 3.396 1
1 14 . 20 1 1 A 9 9 THR H H 9 8.142 8.621 -0.479 1
1 15 . 20 1 1 A 9 9 THR HA H 9 4.353 5.023 -0.670 1
1 20 . 20 1 1 A 9 9 THR C C 9 174.597 173.499 1.098 1
1 21 . 20 1 1 A 9 9 THR CA C 9 62.093 61.321 0.772 1
1 22 . 20 1 1 A 9 9 THR CB C 9 69.948 72.095 -2.147 1
1 24 . 20 1 1 A 9 9 THR N N 9 113.761 114.467 -0.706 1
1 25 . 20 1 1 A 10 10 LEU H H 10 8.218 8.712 -0.494 1
1 26 . 20 1 1 A 10 10 LEU HA H 10 4.169 4.976 -0.807 1
1 36 . 20 1 1 A 10 10 LEU C C 10 176.110 174.962 1.148 1
1 37 . 20 1 1 A 10 10 LEU CA C 10 61.099 53.694 7.405 1
1 38 . 20 1 1 A 10 10 LEU CB C 10 38.686 46.562 -7.876 1
1 42 . 20 1 1 A 10 10 LEU N N 10 123.516 125.347 -1.831 1
1 43 . 20 1 1 A 11 11 LYS H H 11 8.496 8.650 -0.154 1
1 44 . 20 1 1 A 11 11 LYS HA H 11 4.891 5.234 -0.343 1
1 49 . 20 1 1 A 11 11 LYS C C 11 175.794 174.902 0.892 1
1 50 . 20 1 1 A 11 11 LYS CA C 11 55.652 54.772 0.880 1
1 51 . 20 1 1 A 11 11 LYS CB C 11 29.444 36.656 -7.212 1
1 52 . 20 1 1 A 11 11 LYS N N 11 125.141 124.134 1.007 1
1 53 . 20 1 1 A 12 12 GLN HA H 12 4.315 4.765 -0.450 1
1 54 . 20 1 1 A 12 12 GLN C C 12 176.300 173.842 2.458 1
1 55 . 20 1 1 A 12 12 GLN CA C 12 56.286 55.613 0.673 1
1 56 . 20 1 1 A 12 12 GLN CB C 12 32.901 28.898 4.003 1
1 57 . 20 1 1 A 13 13 LEU H H 13 8.410 8.142 0.268 1
1 58 . 20 1 1 A 13 13 LEU HA H 13 4.348 4.611 -0.263 1
1 67 . 20 1 1 A 13 13 LEU C C 13 177.120 173.824 3.296 1
1 68 . 20 1 1 A 13 13 LEU CA C 13 55.142 53.794 1.348 1
1 69 . 20 1 1 A 13 13 LEU CB C 13 42.352 45.250 -2.898 1
1 73 . 20 1 1 A 13 13 LEU N N 13 124.340 122.080 2.260 1
1 74 . 20 1 1 A 14 14 ASP H H 14 8.250 8.576 -0.326 1
1 75 . 20 1 1 A 14 14 ASP HA H 14 4.540 4.552 -0.012 1
1 78 . 20 1 1 A 14 14 ASP C C 14 176.769 176.986 -0.217 1
1 79 . 20 1 1 A 14 14 ASP CA C 14 54.772 54.780 -0.008 1
1 80 . 20 1 1 A 14 14 ASP CB C 14 41.322 42.170 -0.848 1
1 81 . 20 1 1 A 14 14 ASP N N 14 120.493 123.329 -2.836 1
1 82 . 20 1 1 A 15 15 GLY H H 15 8.428 8.479 -0.051 1
1 83 . 20 1 1 A 15 15 GLY HA2 H 15 4.089 3.800 0.289 1
1 84 . 20 1 1 A 15 15 GLY HA3 H 15 3.874 3.805 0.069 1
1 85 . 20 1 1 A 15 15 GLY C C 15 174.122 173.703 0.419 1
1 86 . 20 1 1 A 15 15 GLY CA C 15 45.972 47.196 -1.224 1
1 87 . 20 1 1 A 15 15 GLY N N 15 108.670 109.527 -0.857 1
1 88 . 20 1 1 A 16 16 ILE H H 16 7.727 7.548 0.179 1
1 89 . 20 1 1 A 16 16 ILE HA H 16 4.705 4.931 -0.226 1
1 99 . 20 1 1 A 16 16 ILE C C 16 175.807 174.932 0.875 1
1 100 . 20 1 1 A 16 16 ILE CA C 16 60.703 59.297 1.406 1
1 101 . 20 1 1 A 16 16 ILE CB C 16 38.509 41.202 -2.693 1
1 105 . 20 1 1 A 16 16 ILE N N 16 120.267 119.965 0.302 1
1 106 . 20 1 1 A 17 17 HIS H H 17 9.101 8.417 0.684 1
1 107 . 20 1 1 A 17 17 HIS HA H 17 4.782 5.250 -0.468 1
1 112 . 20 1 1 A 17 17 HIS C C 17 173.051 174.182 -1.131 1
1 113 . 20 1 1 A 17 17 HIS CA C 17 55.353 54.562 0.791 1
1 114 . 20 1 1 A 17 17 HIS CB C 17 32.468 32.909 -0.441 1
1 117 . 20 1 1 A 17 17 HIS N N 17 125.061 126.694 -1.633 1
1 118 . 20 1 1 A 18 18 VAL H H 18 8.427 8.479 -0.052 1
1 119 . 20 1 1 A 18 18 VAL HA H 18 4.375 4.170 0.205 1
1 127 . 20 1 1 A 18 18 VAL C C 18 174.702 175.172 -0.470 1
1 128 . 20 1 1 A 18 18 VAL CA C 18 62.035 62.096 -0.061 1
1 129 . 20 1 1 A 18 18 VAL CB C 18 32.325 32.048 0.277 1
1 132 . 20 1 1 A 18 18 VAL N N 18 127.069 127.787 -0.718 1
1 133 . 20 1 1 A 19 19 THR H H 19 9.272 8.527 0.745 1
1 134 . 20 1 1 A 19 19 THR HA H 19 4.512 4.909 -0.397 1
1 139 . 20 1 1 A 19 19 THR C C 19 172.784 173.028 -0.244 1
1 140 . 20 1 1 A 19 19 THR CA C 19 62.512 60.104 2.408 1
1 141 . 20 1 1 A 19 19 THR CB C 19 70.663 71.043 -0.380 1
1 143 . 20 1 1 A 19 19 THR N N 19 126.619 121.668 4.951 1
1 144 . 20 1 1 A 20 20 ILE H H 20 8.737 9.315 -0.578 1
1 145 . 20 1 1 A 20 20 ILE HA H 20 4.870 4.551 0.319 1
1 155 . 20 1 1 A 20 20 ILE C C 20 175.315 174.118 1.197 1
1 156 . 20 1 1 A 20 20 ILE CA C 20 60.157 60.411 -0.254 1
1 157 . 20 1 1 A 20 20 ILE CB C 20 38.603 39.495 -0.892 1
1 161 . 20 1 1 A 20 20 ILE N N 20 128.114 128.281 -0.167 1
1 162 . 20 1 1 A 21 21 LEU H H 21 8.902 8.502 0.400 1
1 163 . 20 1 1 A 21 21 LEU HA H 21 4.804 4.814 -0.010 1
1 173 . 20 1 1 A 21 21 LEU C C 21 175.565 175.137 0.428 1
1 174 . 20 1 1 A 21 21 LEU CA C 21 52.731 52.921 -0.190 1
1 175 . 20 1 1 A 21 21 LEU CB C 21 43.947 43.964 -0.017 1
1 179 . 20 1 1 A 21 21 LEU N N 21 125.457 127.805 -2.348 1
1 180 . 20 1 1 A 22 22 HIS H H 22 8.577 8.809 -0.232 1
1 181 . 20 1 1 A 22 22 HIS HA H 22 5.013 5.046 -0.033 1
1 186 . 20 1 1 A 22 22 HIS C C 22 174.258 174.887 -0.629 1
1 187 . 20 1 1 A 22 22 HIS CA C 22 55.880 54.688 1.192 1
1 188 . 20 1 1 A 22 22 HIS CB C 22 30.901 29.823 1.078 1
1 191 . 20 1 1 A 22 22 HIS N N 22 122.595 123.811 -1.216 1
1 192 . 20 1 1 A 23 23 LYS H H 23 8.712 10.046 -1.334 1
1 193 . 20 1 1 A 23 23 LYS HA H 23 4.880 5.163 -0.283 1
1 202 . 20 1 1 A 23 23 LYS C C 23 174.265 175.522 -1.257 1
1 203 . 20 1 1 A 23 23 LYS CA C 23 54.314 54.198 0.116 1
1 204 . 20 1 1 A 23 23 LYS CB C 23 36.068 35.785 0.283 1
1 208 . 20 1 1 A 23 23 LYS N N 23 120.814 121.045 -0.231 1
1 209 . 20 1 1 A 24 24 GLU H H 24 8.360 8.540 -0.180 1
1 210 . 20 1 1 A 24 24 GLU HA H 24 4.350 4.655 -0.305 1
1 215 . 20 1 1 A 24 24 GLU C C 24 177.843 176.776 1.067 1
1 216 . 20 1 1 A 24 24 GLU CA C 24 55.601 54.773 0.828 1
1 217 . 20 1 1 A 24 24 GLU CB C 24 30.512 31.383 -0.871 1
1 219 . 20 1 1 A 24 24 GLU N N 24 117.859 118.900 -1.041 1
1 220 . 20 1 1 A 25 25 GLU H H 25 9.146 8.688 0.458 1
1 221 . 20 1 1 A 25 25 GLU HA H 25 3.924 3.888 0.036 1
1 226 . 20 1 1 A 25 25 GLU C C 25 177.809 177.734 0.075 1
1 227 . 20 1 1 A 25 25 GLU CA C 25 58.568 58.855 -0.287 1
1 228 . 20 1 1 A 25 25 GLU CB C 25 29.313 29.580 -0.267 1
1 230 . 20 1 1 A 25 25 GLU N N 25 124.543 121.908 2.635 1
1 231 . 20 1 1 A 26 26 GLY H H 26 8.242 8.882 -0.640 1
1 232 . 20 1 1 A 26 26 GLY HA2 H 26 4.287 3.911 0.376 1
1 233 . 20 1 1 A 26 26 GLY HA3 H 26 3.407 3.911 -0.504 1
1 234 . 20 1 1 A 26 26 GLY C C 26 174.234 175.358 -1.124 1
1 235 . 20 1 1 A 26 26 GLY CA C 26 46.113 47.014 -0.901 1
1 236 . 20 1 1 A 26 26 GLY N N 26 115.394 114.568 0.826 1
1 237 . 20 1 1 A 27 27 ALA H H 27 7.432 8.669 -1.237 1
1 238 . 20 1 1 A 27 27 ALA HA H 27 4.402 4.255 0.147 1
1 242 . 20 1 1 A 27 27 ALA C C 27 178.138 178.220 -0.082 1
1 243 . 20 1 1 A 27 27 ALA CA C 27 52.273 53.018 -0.745 1
1 244 . 20 1 1 A 27 27 ALA CB C 27 20.214 19.494 0.720 1
1 245 . 20 1 1 A 27 27 ALA N N 27 122.323 122.609 -0.286 1
1 246 . 20 1 1 A 28 28 GLY H H 28 8.624 7.809 0.815 1
1 247 . 20 1 1 A 28 28 GLY HA2 H 28 4.134 4.077 0.057 1
1 248 . 20 1 1 A 28 28 GLY HA3 H 28 3.953 4.106 -0.153 1
1 249 . 20 1 1 A 28 28 GLY C C 28 174.069 175.006 -0.937 1
1 250 . 20 1 1 A 28 28 GLY CA C 28 44.546 44.309 0.237 1
1 251 . 20 1 1 A 28 28 GLY N N 28 107.593 105.339 2.254 1
1 252 . 20 1 1 A 29 29 LEU H H 29 7.934 8.566 -0.632 1
1 253 . 20 1 1 A 29 29 LEU HA H 29 4.059 4.443 -0.384 1
1 263 . 20 1 1 A 29 29 LEU C C 29 177.548 176.988 0.560 1
1 264 . 20 1 1 A 29 29 LEU CA C 29 56.298 56.064 0.234 1
1 265 . 20 1 1 A 29 29 LEU CB C 29 41.940 42.615 -0.675 1
1 269 . 20 1 1 A 29 29 LEU N N 29 115.495 121.276 -5.781 1
1 270 . 20 1 1 A 30 30 GLY H H 30 8.669 7.981 0.688 1
1 271 . 20 1 1 A 30 30 GLY HA2 H 30 4.264 4.088 0.176 1
1 272 . 20 1 1 A 30 30 GLY HA3 H 30 4.001 4.162 -0.161 1
1 273 . 20 1 1 A 30 30 GLY C C 30 175.296 173.235 2.061 1
1 274 . 20 1 1 A 30 30 GLY CA C 30 46.368 45.091 1.277 1
1 275 . 20 1 1 A 30 30 GLY N N 30 103.121 106.290 -3.169 1
1 276 . 20 1 1 A 31 31 PHE H H 31 7.044 7.468 -0.424 1
1 277 . 20 1 1 A 31 31 PHE HA H 31 4.541 4.500 0.041 1
1 285 . 20 1 1 A 31 31 PHE C C 31 171.141 173.033 -1.892 1
1 286 . 20 1 1 A 31 31 PHE CA C 31 55.704 55.060 0.644 1
1 287 . 20 1 1 A 31 31 PHE CB C 31 40.745 42.080 -1.335 1
1 293 . 20 1 1 A 31 31 PHE N N 31 115.404 115.595 -0.191 1
1 294 . 20 1 1 A 32 32 SER H H 32 8.752 8.679 0.073 1
1 295 . 20 1 1 A 32 32 SER HA H 32 4.990 4.921 0.069 1
1 298 . 20 1 1 A 32 32 SER C C 32 175.049 172.991 2.058 1
1 299 . 20 1 1 A 32 32 SER CA C 32 55.001 56.979 -1.978 1
1 300 . 20 1 1 A 32 32 SER CB C 32 67.170 66.632 0.538 1
1 301 . 20 1 1 A 32 32 SER N N 32 113.639 115.858 -2.219 1
1 302 . 20 1 1 A 33 33 LEU H H 33 8.639 8.532 0.107 1
1 303 . 20 1 1 A 33 33 LEU HA H 33 5.573 5.124 0.449 1
1 313 . 20 1 1 A 33 33 LEU C C 33 175.827 175.726 0.101 1
1 314 . 20 1 1 A 33 33 LEU CA C 33 53.620 53.612 0.008 1
1 315 . 20 1 1 A 33 33 LEU CB C 33 45.399 44.188 1.211 1
1 319 . 20 1 1 A 33 33 LEU N N 33 118.936 122.797 -3.861 1
1 320 . 20 1 1 A 34 34 ALA H H 34 9.410 8.705 0.705 1
1 321 . 20 1 1 A 34 34 ALA HA H 34 4.749 5.167 -0.418 1
1 325 . 20 1 1 A 34 34 ALA C C 34 176.231 177.984 -1.753 1
1 326 . 20 1 1 A 34 34 ALA CA C 34 50.425 51.021 -0.596 1
1 327 . 20 1 1 A 34 34 ALA CB C 34 22.518 22.651 -0.133 1
1 328 . 20 1 1 A 34 34 ALA N N 34 124.395 122.183 2.212 1
1 329 . 20 1 1 A 35 35 GLY H H 35 8.130 8.657 -0.527 1
1 330 . 20 1 1 A 35 35 GLY HA2 H 35 4.712 3.851 0.861 1
1 331 . 20 1 1 A 35 35 GLY HA3 H 35 3.955 3.930 0.025 1
1 332 . 20 1 1 A 35 35 GLY C C 35 174.750 173.686 1.064 1
1 333 . 20 1 1 A 35 35 GLY CA C 35 44.494 45.347 -0.853 1
1 334 . 20 1 1 A 35 35 GLY N N 35 103.650 108.350 -4.700 1
1 335 . 20 1 1 A 36 36 GLY H H 36 8.217 7.941 0.276 1
1 336 . 20 1 1 A 36 36 GLY HA2 H 36 4.494 4.369 0.125 1
1 337 . 20 1 1 A 36 36 GLY HA3 H 36 3.836 4.379 -0.543 1
1 338 . 20 1 1 A 36 36 GLY C C 36 174.410 173.797 0.613 1
1 339 . 20 1 1 A 36 36 GLY CA C 36 45.462 46.026 -0.564 1
1 340 . 20 1 1 A 36 36 GLY N N 36 122.114 109.037 13.077 1
1 341 . 20 1 1 A 37 37 ALA H H 37 8.963 8.497 0.466 1
1 342 . 20 1 1 A 37 37 ALA HA H 37 3.998 4.356 -0.358 1
1 346 . 20 1 1 A 37 37 ALA C C 37 176.935 178.742 -1.807 1
1 347 . 20 1 1 A 37 37 ALA CA C 37 55.308 53.849 1.459 1
1 348 . 20 1 1 A 37 37 ALA CB C 37 18.822 19.953 -1.131 1
1 349 . 20 1 1 A 37 37 ALA N N 37 123.418 122.761 0.657 1
1 350 . 20 1 1 A 38 38 ASP H H 38 10.586 8.119 2.467 1
1 351 . 20 1 1 A 38 38 ASP HA H 38 4.485 4.551 -0.066 1
1 354 . 20 1 1 A 38 38 ASP C C 38 175.309 176.530 -1.221 1
1 355 . 20 1 1 A 38 38 ASP CA C 38 52.730 56.111 -3.381 1
1 356 . 20 1 1 A 38 38 ASP CB C 38 38.689 41.158 -2.469 1
1 357 . 20 1 1 A 38 38 ASP N N 38 111.480 118.391 -6.911 1
1 358 . 20 1 1 A 39 39 LEU H H 39 7.789 7.501 0.288 1
1 359 . 20 1 1 A 39 39 LEU HA H 39 4.699 4.323 0.376 1
1 369 . 20 1 1 A 39 39 LEU C C 39 176.377 178.166 -1.789 1
1 370 . 20 1 1 A 39 39 LEU CA C 39 52.952 54.428 -1.476 1
1 371 . 20 1 1 A 39 39 LEU CB C 39 43.294 42.094 1.200 1
1 375 . 20 1 1 A 39 39 LEU N N 39 122.545 121.880 0.665 1
1 376 . 20 1 1 A 40 40 GLU H H 40 8.331 8.736 -0.405 1
1 377 . 20 1 1 A 40 40 GLU HA H 40 3.978 4.000 -0.022 1
1 382 . 20 1 1 A 40 40 GLU C C 40 176.887 176.522 0.365 1
1 383 . 20 1 1 A 40 40 GLU CA C 40 59.066 59.764 -0.698 1
1 384 . 20 1 1 A 40 40 GLU CB C 40 29.523 29.530 -0.007 1
1 386 . 20 1 1 A 40 40 GLU N N 40 118.036 120.246 -2.210 1
1 387 . 20 1 1 A 41 41 ASN H H 41 7.890 7.971 -0.081 1
1 388 . 20 1 1 A 41 41 ASN HA H 41 4.820 5.076 -0.256 1
1 393 . 20 1 1 A 41 41 ASN CA C 41 52.316 51.074 1.242 1
1 394 . 20 1 1 A 41 41 ASN CB C 41 37.409 40.243 -2.834 1
1 395 . 20 1 1 A 41 41 ASN N N 41 115.196 115.901 -0.705 1
1 397 . 20 1 1 A 42 42 LYS H H 42 7.943 8.860 -0.917 1
1 398 . 20 1 1 A 42 42 LYS HA H 42 4.328 4.615 -0.287 1
1 407 . 20 1 1 A 42 42 LYS C C 42 177.081 175.897 1.184 1
1 408 . 20 1 1 A 42 42 LYS CA C 42 56.567 57.343 -0.776 1
1 409 . 20 1 1 A 42 42 LYS CB C 42 33.120 34.753 -1.633 1
1 413 . 20 1 1 A 42 42 LYS N N 42 120.612 121.214 -0.602 1
1 414 . 20 1 1 A 43 43 VAL H H 43 7.456 7.598 -0.142 1
1 415 . 20 1 1 A 43 43 VAL HA H 43 4.059 4.261 -0.202 1
1 423 . 20 1 1 A 43 43 VAL CA C 43 61.330 61.596 -0.266 1
1 424 . 20 1 1 A 43 43 VAL CB C 43 32.819 32.309 0.510 1
1 427 . 20 1 1 A 43 43 VAL N N 43 118.284 118.765 -0.481 1
1 428 . 20 1 1 A 44 44 ILE H H 44 8.481 8.618 -0.137 1
1 429 . 20 1 1 A 44 44 ILE HA H 44 4.913 4.323 0.590 1
1 439 . 20 1 1 A 44 44 ILE C C 44 176.719 175.832 0.887 1
1 440 . 20 1 1 A 44 44 ILE CA C 44 59.946 62.090 -2.144 1
1 441 . 20 1 1 A 44 44 ILE CB C 44 35.784 38.359 -2.575 1
1 445 . 20 1 1 A 44 44 ILE N N 44 127.089 129.659 -2.570 1
1 446 . 20 1 1 A 45 45 THR H H 45 8.906 8.593 0.313 1
1 447 . 20 1 1 A 45 45 THR HA H 45 5.400 5.105 0.295 1
1 452 . 20 1 1 A 45 45 THR CA C 45 58.528 59.425 -0.897 1
1 453 . 20 1 1 A 45 45 THR CB C 45 73.760 72.122 1.638 1
1 455 . 20 1 1 A 45 45 THR N N 45 116.832 116.388 0.444 1
1 456 . 20 1 1 A 46 46 VAL H H 46 8.336 8.611 -0.275 1
1 457 . 20 1 1 A 46 46 VAL HA H 46 4.059 4.254 -0.195 1
1 465 . 20 1 1 A 46 46 VAL C C 46 176.648 176.462 0.186 1
1 466 . 20 1 1 A 46 46 VAL CA C 46 63.058 62.985 0.073 1
1 467 . 20 1 1 A 46 46 VAL CB C 46 31.601 30.837 0.764 1
1 470 . 20 1 1 A 46 46 VAL N N 46 118.542 122.627 -4.085 1
1 471 . 20 1 1 A 47 47 HIS H H 47 9.382 8.509 0.873 1
1 472 . 20 1 1 A 47 47 HIS HA H 47 4.628 4.200 0.428 1
1 477 . 20 1 1 A 47 47 HIS C C 47 174.339 174.610 -0.271 1
1 478 . 20 1 1 A 47 47 HIS CA C 47 57.764 59.947 -2.183 1
1 479 . 20 1 1 A 47 47 HIS CB C 47 31.453 30.555 0.898 1
1 482 . 20 1 1 A 47 47 HIS N N 47 133.900 128.360 5.540 1
1 483 . 20 1 1 A 48 48 ARG H H 48 7.135 7.754 -0.619 1
1 484 . 20 1 1 A 48 48 ARG HA H 48 4.360 4.757 -0.397 1
1 491 . 20 1 1 A 48 48 ARG C C 48 173.877 174.703 -0.826 1
1 492 . 20 1 1 A 48 48 ARG CA C 48 54.385 55.043 -0.658 1
1 493 . 20 1 1 A 48 48 ARG CB C 48 33.996 34.721 -0.725 1
1 496 . 20 1 1 A 48 48 ARG N N 48 114.736 117.730 -2.994 1
1 497 . 20 1 1 A 49 49 VAL H H 49 8.690 8.698 -0.008 1
1 498 . 20 1 1 A 49 49 VAL HA H 49 4.015 4.527 -0.512 1
1 506 . 20 1 1 A 49 49 VAL C C 49 176.255 175.591 0.664 1
1 507 . 20 1 1 A 49 49 VAL CA C 49 61.882 61.700 0.182 1
1 508 . 20 1 1 A 49 49 VAL CB C 49 32.261 33.438 -1.177 1
1 511 . 20 1 1 A 49 49 VAL N N 49 122.844 122.528 0.316 1
1 512 . 20 1 1 A 50 50 PHE H H 50 7.866 8.510 -0.644 1
1 513 . 20 1 1 A 50 50 PHE HA H 50 4.866 4.503 0.363 1
1 521 . 20 1 1 A 50 50 PHE C C 50 174.847 176.165 -1.318 1
1 522 . 20 1 1 A 50 50 PHE CA C 50 54.596 57.529 -2.933 1
1 523 . 20 1 1 A 50 50 PHE CB C 50 36.558 39.130 -2.572 1
1 529 . 20 1 1 A 50 50 PHE N N 50 128.498 127.409 1.089 1
1 530 . 20 1 1 A 51 51 PRO HA H 51 4.386 4.548 -0.162 1
1 537 . 20 1 1 A 51 51 PRO C C 51 177.321 176.760 0.561 1
1 538 . 20 1 1 A 51 51 PRO CA C 51 64.381 64.541 -0.160 1
1 539 . 20 1 1 A 51 51 PRO CB C 51 31.773 32.146 -0.373 1
1 542 . 20 1 1 A 52 52 ASN H H 52 8.814 8.492 0.322 1
1 543 . 20 1 1 A 52 52 ASN HA H 52 4.496 5.012 -0.516 1
1 548 . 20 1 1 A 52 52 ASN C C 52 174.823 174.784 0.039 1
1 549 . 20 1 1 A 52 52 ASN CA C 52 54.719 52.137 2.582 1
1 550 . 20 1 1 A 52 52 ASN CB C 52 38.109 39.322 -1.213 1
1 551 . 20 1 1 A 52 52 ASN N N 52 116.145 116.386 -0.241 1
1 553 . 20 1 1 A 53 53 GLY H H 53 7.730 8.236 -0.506 1
1 554 . 20 1 1 A 53 53 GLY HA2 H 53 4.430 4.314 0.116 1
1 555 . 20 1 1 A 53 53 GLY HA3 H 53 4.089 4.329 -0.240 1
1 556 . 20 1 1 A 53 53 GLY C C 53 174.810 174.030 0.780 1
1 557 . 20 1 1 A 53 53 GLY CA C 53 44.987 45.867 -0.880 1
1 558 . 20 1 1 A 53 53 GLY N N 53 106.196 111.424 -5.228 1
1 559 . 20 1 1 A 54 54 LEU H H 54 8.764 9.135 -0.371 1
1 560 . 20 1 1 A 54 54 LEU HA H 54 4.041 4.127 -0.086 1
1 570 . 20 1 1 A 54 54 LEU C C 54 179.712 178.604 1.108 1
1 571 . 20 1 1 A 54 54 LEU CA C 54 58.310 57.867 0.443 1
1 572 . 20 1 1 A 54 54 LEU CB C 54 42.390 42.090 0.300 1
1 576 . 20 1 1 A 54 54 LEU N N 54 118.836 119.738 -0.902 1
1 577 . 20 1 1 A 55 55 ALA H H 55 7.593 8.188 -0.595 1
1 578 . 20 1 1 A 55 55 ALA HA H 55 4.275 3.893 0.382 1
1 582 . 20 1 1 A 55 55 ALA C C 55 181.307 179.833 1.474 1
1 583 . 20 1 1 A 55 55 ALA CA C 55 54.825 55.214 -0.389 1
1 584 . 20 1 1 A 55 55 ALA CB C 55 18.345 18.170 0.175 1
1 585 . 20 1 1 A 55 55 ALA N N 55 118.782 121.401 -2.619 1
1 586 . 20 1 1 A 56 56 SER H H 56 9.339 7.987 1.352 1
1 587 . 20 1 1 A 56 56 SER HA H 56 4.023 4.175 -0.152 1
1 589 . 20 1 1 A 56 56 SER C C 56 176.392 177.322 -0.930 1
1 590 . 20 1 1 A 56 56 SER CA C 56 60.984 61.861 -0.877 1
1 591 . 20 1 1 A 56 56 SER CB C 56 62.987 62.860 0.127 1
1 592 . 20 1 1 A 56 56 SER N N 56 117.631 114.204 3.427 1
1 593 . 20 1 1 A 57 57 GLN H H 57 7.942 7.510 0.432 1
1 594 . 20 1 1 A 57 57 GLN HA H 57 4.034 3.964 0.070 1
1 601 . 20 1 1 A 57 57 GLN C C 57 177.400 178.102 -0.702 1
1 602 . 20 1 1 A 57 57 GLN CA C 57 58.362 59.061 -0.699 1
1 603 . 20 1 1 A 57 57 GLN CB C 57 28.801 28.265 0.536 1
1 605 . 20 1 1 A 57 57 GLN N N 57 118.162 121.934 -3.772 1
1 607 . 20 1 1 A 58 58 GLU H H 58 7.683 8.383 -0.700 1
1 608 . 20 1 1 A 58 58 GLU HA H 58 4.163 4.143 0.020 1
1 613 . 20 1 1 A 58 58 GLU C C 58 179.248 176.714 2.534 1
1 614 . 20 1 1 A 58 58 GLU CA C 58 59.559 58.476 1.083 1
1 615 . 20 1 1 A 58 58 GLU CB C 58 29.317 29.723 -0.406 1
1 617 . 20 1 1 A 58 58 GLU N N 58 119.877 119.527 0.350 1
1 618 . 20 1 1 A 59 59 GLY H H 59 7.446 7.836 -0.390 1
1 619 . 20 1 1 A 59 59 GLY HA2 H 59 4.100 3.969 0.131 1
1 620 . 20 1 1 A 59 59 GLY HA3 H 59 3.770 3.974 -0.204 1
1 621 . 20 1 1 A 59 59 GLY C C 59 175.432 175.318 0.114 1
1 622 . 20 1 1 A 59 59 GLY CA C 59 46.817 45.316 1.501 1
1 623 . 20 1 1 A 59 59 GLY N N 59 102.653 107.918 -5.265 1
1 624 . 20 1 1 A 60 60 THR H H 60 8.343 8.111 0.232 1
1 625 . 20 1 1 A 60 60 THR HA H 60 4.037 4.104 -0.067 1
1 630 . 20 1 1 A 60 60 THR C C 60 175.843 174.450 1.393 1
1 631 . 20 1 1 A 60 60 THR CA C 60 64.792 65.827 -1.035 1
1 632 . 20 1 1 A 60 60 THR CB C 60 69.325 68.923 0.402 1
1 634 . 20 1 1 A 60 60 THR N N 60 113.863 113.266 0.597 1
1 635 . 20 1 1 A 61 61 ILE H H 61 8.802 7.803 0.999 1
1 636 . 20 1 1 A 61 61 ILE HA H 61 3.631 4.122 -0.491 1
1 646 . 20 1 1 A 61 61 ILE C C 61 174.198 174.492 -0.294 1
1 647 . 20 1 1 A 61 61 ILE CA C 61 62.938 60.439 2.499 1
1 648 . 20 1 1 A 61 61 ILE CB C 61 37.225 36.842 0.383 1
1 652 . 20 1 1 A 61 61 ILE N N 61 126.153 119.087 7.066 1
1 653 . 20 1 1 A 62 62 GLN H H 62 7.124 9.408 -2.284 1
1 654 . 20 1 1 A 62 62 GLN HA H 62 4.500 4.690 -0.190 1
1 661 . 20 1 1 A 62 62 GLN C C 62 174.556 175.495 -0.939 1
1 662 . 20 1 1 A 62 62 GLN CA C 62 53.364 54.039 -0.675 1
1 663 . 20 1 1 A 62 62 GLN CB C 62 32.196 31.093 1.103 1
1 665 . 20 1 1 A 62 62 GLN N N 62 123.730 126.704 -2.974 1
1 667 . 20 1 1 A 63 63 LYS H H 63 8.399 8.498 -0.099 1
1 668 . 20 1 1 A 63 63 LYS HA H 63 3.464 4.554 -1.090 1
1 677 . 20 1 1 A 63 63 LYS CA C 63 57.905 56.785 1.120 1
1 678 . 20 1 1 A 63 63 LYS CB C 63 32.260 32.277 -0.017 1
1 682 . 20 1 1 A 63 63 LYS N N 63 121.381 123.272 -1.891 1
1 683 . 20 1 1 A 64 64 GLY H H 64 9.265 9.202 0.063 1
1 684 . 20 1 1 A 64 64 GLY HA2 H 64 4.415 4.009 0.406 1
1 685 . 20 1 1 A 64 64 GLY HA3 H 64 3.639 4.010 -0.371 1
1 686 . 20 1 1 A 64 64 GLY CA C 64 44.881 45.038 -0.157 1
1 687 . 20 1 1 A 64 64 GLY N N 64 113.750 112.979 0.771 1
1 688 . 20 1 1 A 65 65 ASN H H 65 7.594 8.270 -0.676 1
1 689 . 20 1 1 A 65 65 ASN HA H 65 4.798 4.701 0.097 1
1 694 . 20 1 1 A 65 65 ASN C C 65 175.042 173.806 1.236 1
1 695 . 20 1 1 A 65 65 ASN CA C 65 53.047 53.820 -0.773 1
1 696 . 20 1 1 A 65 65 ASN CB C 65 38.153 39.756 -1.603 1
1 697 . 20 1 1 A 65 65 ASN N N 65 117.999 120.180 -2.181 1
1 699 . 20 1 1 A 66 66 GLU H H 66 8.538 8.620 -0.082 1
1 700 . 20 1 1 A 66 66 GLU HA H 66 4.634 4.897 -0.263 1
1 705 . 20 1 1 A 66 66 GLU C C 66 176.620 175.130 1.490 1
1 706 . 20 1 1 A 66 66 GLU CA C 66 55.863 55.048 0.815 1
1 707 . 20 1 1 A 66 66 GLU CB C 66 30.899 32.346 -1.447 1
1 709 . 20 1 1 A 66 66 GLU N N 66 122.233 122.086 0.147 1
1 710 . 20 1 1 A 67 67 VAL H H 67 8.452 8.999 -0.547 1
1 711 . 20 1 1 A 67 67 VAL HA H 67 4.172 4.230 -0.058 1
1 719 . 20 1 1 A 67 67 VAL C C 67 174.641 175.535 -0.894 1
1 720 . 20 1 1 A 67 67 VAL CA C 67 61.856 62.599 -0.743 1
1 721 . 20 1 1 A 67 67 VAL CB C 67 31.066 32.019 -0.953 1
1 724 . 20 1 1 A 67 67 VAL N N 67 126.311 127.477 -1.166 1
1 725 . 20 1 1 A 68 68 LEU H H 68 9.000 9.043 -0.043 1
1 726 . 20 1 1 A 68 68 LEU HA H 68 4.390 4.325 0.065 1
1 736 . 20 1 1 A 68 68 LEU C C 68 178.924 177.000 1.924 1
1 737 . 20 1 1 A 68 68 LEU CA C 68 56.990 56.047 0.943 1
1 738 . 20 1 1 A 68 68 LEU CB C 68 42.392 42.564 -0.172 1
1 742 . 20 1 1 A 68 68 LEU N N 68 127.175 129.242 -2.067 1
1 743 . 20 1 1 A 69 69 SER H H 69 7.666 7.879 -0.213 1
1 744 . 20 1 1 A 69 69 SER HA H 69 5.144 4.988 0.156 1
1 747 . 20 1 1 A 69 69 SER C C 69 172.722 172.343 0.379 1
1 748 . 20 1 1 A 69 69 SER CA C 69 57.606 57.289 0.317 1
1 749 . 20 1 1 A 69 69 SER CB C 69 64.511 66.594 -2.083 1
1 750 . 20 1 1 A 69 69 SER N N 69 110.346 109.307 1.039 1
1 751 . 20 1 1 A 70 70 ILE H H 70 7.965 8.527 -0.562 1
1 752 . 20 1 1 A 70 70 ILE HA H 70 4.548 4.716 -0.168 1
1 762 . 20 1 1 A 70 70 ILE C C 70 174.993 175.999 -1.006 1
1 763 . 20 1 1 A 70 70 ILE CA C 70 60.897 60.259 0.638 1
1 764 . 20 1 1 A 70 70 ILE CB C 70 41.186 40.620 0.566 1
1 768 . 20 1 1 A 70 70 ILE N N 70 119.579 120.704 -1.125 1
1 769 . 20 1 1 A 71 71 ASN H H 71 9.839 10.329 -0.490 1
1 770 . 20 1 1 A 71 71 ASN HA H 71 4.485 4.412 0.073 1
1 775 . 20 1 1 A 71 71 ASN C C 71 174.975 174.694 0.281 1
1 776 . 20 1 1 A 71 71 ASN CA C 71 54.085 54.370 -0.285 1
1 777 . 20 1 1 A 71 71 ASN CB C 71 36.255 37.446 -1.191 1
1 778 . 20 1 1 A 71 71 ASN N N 71 126.963 125.027 1.936 1
1 780 . 20 1 1 A 72 72 GLY H H 72 8.911 8.465 0.446 1
1 781 . 20 1 1 A 72 72 GLY HA2 H 72 4.149 3.938 0.211 1
1 782 . 20 1 1 A 72 72 GLY HA3 H 72 3.507 3.939 -0.432 1
1 783 . 20 1 1 A 72 72 GLY C C 72 173.594 173.558 0.036 1
1 784 . 20 1 1 A 72 72 GLY CA C 72 45.162 45.286 -0.124 1
1 785 . 20 1 1 A 72 72 GLY N N 72 103.020 105.331 -2.311 1
1 786 . 20 1 1 A 73 73 LYS H H 73 7.922 7.559 0.363 1
1 787 . 20 1 1 A 73 73 LYS HA H 73 4.485 4.602 -0.117 1
1 796 . 20 1 1 A 73 73 LYS C C 73 175.036 175.708 -0.672 1
1 797 . 20 1 1 A 73 73 LYS CA C 73 54.719 54.882 -0.163 1
1 798 . 20 1 1 A 73 73 LYS CB C 73 32.137 34.166 -2.029 1
1 802 . 20 1 1 A 73 73 LYS N N 73 122.413 122.323 0.090 1
1 803 . 20 1 1 A 74 74 SER H H 74 8.585 8.752 -0.167 1
1 804 . 20 1 1 A 74 74 SER HA H 74 4.452 4.593 -0.141 1
1 807 . 20 1 1 A 74 74 SER C C 74 175.965 174.029 1.936 1
1 808 . 20 1 1 A 74 74 SER CA C 74 58.028 58.558 -0.530 1
1 809 . 20 1 1 A 74 74 SER CB C 74 63.799 64.130 -0.331 1
1 810 . 20 1 1 A 74 74 SER N N 74 118.737 124.287 -5.550 1
1 811 . 20 1 1 A 75 75 LEU H H 75 8.015 8.222 -0.207 1
1 812 . 20 1 1 A 75 75 LEU HA H 75 4.661 4.489 0.172 1
1 822 . 20 1 1 A 75 75 LEU C C 75 178.117 177.389 0.728 1
1 823 . 20 1 1 A 75 75 LEU CA C 75 53.980 54.545 -0.565 1
1 824 . 20 1 1 A 75 75 LEU CB C 75 40.830 41.140 -0.310 1
1 828 . 20 1 1 A 75 75 LEU N N 75 125.425 124.848 0.577 1
1 829 . 20 1 1 A 76 76 LYS H H 76 8.099 8.605 -0.506 1
1 830 . 20 1 1 A 76 76 LYS HA H 76 4.210 4.420 -0.210 1
1 839 . 20 1 1 A 76 76 LYS C C 76 178.487 176.754 1.733 1
1 840 . 20 1 1 A 76 76 LYS CA C 76 58.010 55.463 2.547 1
1 841 . 20 1 1 A 76 76 LYS CB C 76 31.683 31.675 0.008 1
1 845 . 20 1 1 A 76 76 LYS N N 76 124.064 120.191 3.873 1
1 846 . 20 1 1 A 77 77 GLY H H 77 8.859 7.837 1.022 1
1 847 . 20 1 1 A 77 77 GLY HA2 H 77 4.110 4.055 0.055 1
1 848 . 20 1 1 A 77 77 GLY HA3 H 77 3.869 4.058 -0.189 1
1 849 . 20 1 1 A 77 77 GLY C C 77 174.335 174.795 -0.460 1
1 850 . 20 1 1 A 77 77 GLY CA C 77 46.232 44.999 1.233 1
1 851 . 20 1 1 A 77 77 GLY N N 77 115.659 108.711 6.948 1
1 852 . 20 1 1 A 78 78 THR H H 78 7.654 7.741 -0.087 1
1 853 . 20 1 1 A 78 78 THR HA H 78 4.624 4.150 0.474 1
1 858 . 20 1 1 A 78 78 THR C C 78 177.272 174.874 2.398 1
1 859 . 20 1 1 A 78 78 THR CA C 78 61.794 63.333 -1.539 1
1 860 . 20 1 1 A 78 78 THR CB C 78 70.595 69.186 1.409 1
1 862 . 20 1 1 A 78 78 THR N N 78 112.847 116.555 -3.708 1
1 863 . 20 1 1 A 79 79 THR H H 79 8.813 8.595 0.218 1
1 864 . 20 1 1 A 79 79 THR HA H 79 4.395 4.725 -0.330 1
1 869 . 20 1 1 A 79 79 THR C C 79 174.503 175.448 -0.945 1
1 870 . 20 1 1 A 79 79 THR CA C 79 61.724 60.756 0.968 1
1 871 . 20 1 1 A 79 79 THR CB C 79 71.007 71.299 -0.292 1
1 873 . 20 1 1 A 79 79 THR N N 79 114.123 118.526 -4.403 1
1 874 . 20 1 1 A 80 80 HIS H H 80 10.266 9.180 1.086 1
1 875 . 20 1 1 A 80 80 HIS HA H 80 4.331 4.202 0.129 1
1 880 . 20 1 1 A 80 80 HIS C C 80 177.075 177.001 0.074 1
1 881 . 20 1 1 A 80 80 HIS CA C 80 61.338 59.710 1.628 1
1 882 . 20 1 1 A 80 80 HIS CB C 80 28.651 30.131 -1.480 1
1 885 . 20 1 1 A 80 80 HIS N N 80 122.776 121.801 0.975 1
1 886 . 20 1 1 A 81 81 HIS H H 81 9.335 8.022 1.313 1
1 887 . 20 1 1 A 81 81 HIS HA H 81 4.078 4.099 -0.021 1
1 892 . 20 1 1 A 81 81 HIS C C 81 178.269 176.815 1.454 1
1 893 . 20 1 1 A 81 81 HIS CA C 81 60.210 59.916 0.294 1
1 894 . 20 1 1 A 81 81 HIS CB C 81 29.569 29.998 -0.429 1
1 897 . 20 1 1 A 81 81 HIS N N 81 114.733 118.762 -4.029 1
1 898 . 20 1 1 A 82 82 ASP H H 82 7.741 8.081 -0.340 1
1 899 . 20 1 1 A 82 82 ASP HA H 82 4.452 3.947 0.505 1
1 902 . 20 1 1 A 82 82 ASP C C 82 178.683 178.956 -0.273 1
1 903 . 20 1 1 A 82 82 ASP CA C 82 57.148 57.014 0.134 1
1 904 . 20 1 1 A 82 82 ASP CB C 82 39.522 40.441 -0.919 1
1 905 . 20 1 1 A 82 82 ASP N N 82 121.407 117.986 3.421 1
1 906 . 20 1 1 A 83 83 ALA H H 83 8.502 7.784 0.718 1
1 907 . 20 1 1 A 83 83 ALA HA H 83 3.939 4.142 -0.203 1
1 911 . 20 1 1 A 83 83 ALA C C 83 179.361 179.410 -0.049 1
1 912 . 20 1 1 A 83 83 ALA CA C 83 55.635 54.871 0.764 1
1 913 . 20 1 1 A 83 83 ALA CB C 83 18.124 18.862 -0.738 1
1 914 . 20 1 1 A 83 83 ALA N N 83 125.049 122.807 2.242 1
1 915 . 20 1 1 A 84 84 LEU H H 84 8.100 8.492 -0.392 1
1 916 . 20 1 1 A 84 84 LEU HA H 84 3.792 3.839 -0.047 1
1 926 . 20 1 1 A 84 84 LEU C C 84 180.173 179.088 1.085 1
1 927 . 20 1 1 A 84 84 LEU CA C 84 57.932 57.952 -0.020 1
1 928 . 20 1 1 A 84 84 LEU CB C 84 41.157 41.463 -0.306 1
1 932 . 20 1 1 A 84 84 LEU N N 84 117.139 118.277 -1.138 1
1 933 . 20 1 1 A 85 85 ALA H H 85 7.715 8.753 -1.038 1
1 934 . 20 1 1 A 85 85 ALA HA H 85 4.061 4.147 -0.086 1
1 938 . 20 1 1 A 85 85 ALA C C 85 180.380 179.742 0.638 1
1 939 . 20 1 1 A 85 85 ALA CA C 85 55.212 55.386 -0.174 1
1 940 . 20 1 1 A 85 85 ALA CB C 85 17.803 18.553 -0.750 1
1 941 . 20 1 1 A 85 85 ALA N N 85 122.448 121.388 1.060 1
1 942 . 20 1 1 A 86 86 ILE H H 86 7.669 7.834 -0.165 1
1 943 . 20 1 1 A 86 86 ILE HA H 86 3.678 3.696 -0.018 1
1 953 . 20 1 1 A 86 86 ILE C C 86 178.692 178.388 0.304 1
1 954 . 20 1 1 A 86 86 ILE CA C 86 65.226 64.947 0.279 1
1 955 . 20 1 1 A 86 86 ILE CB C 86 38.099 37.828 0.271 1
1 959 . 20 1 1 A 86 86 ILE N N 86 121.804 117.913 3.891 1
1 960 . 20 1 1 A 87 87 LEU H H 87 7.922 8.931 -1.009 1
1 961 . 20 1 1 A 87 87 LEU HA H 87 3.903 3.998 -0.095 1
1 971 . 20 1 1 A 87 87 LEU C C 87 178.610 178.512 0.098 1
1 972 . 20 1 1 A 87 87 LEU CA C 87 58.221 58.172 0.049 1
1 973 . 20 1 1 A 87 87 LEU CB C 87 42.344 41.522 0.822 1
1 977 . 20 1 1 A 87 87 LEU N N 87 121.947 120.797 1.150 1
1 978 . 20 1 1 A 88 88 ARG H H 88 8.317 8.770 -0.453 1
1 979 . 20 1 1 A 88 88 ARG HA H 88 4.060 4.017 0.043 1
1 986 . 20 1 1 A 88 88 ARG C C 88 180.698 177.834 2.864 1
1 987 . 20 1 1 A 88 88 ARG CA C 88 59.383 58.293 1.090 1
1 988 . 20 1 1 A 88 88 ARG CB C 88 30.055 30.020 0.035 1
1 991 . 20 1 1 A 88 88 ARG N N 88 119.343 118.236 1.107 1
1 992 . 20 1 1 A 89 89 GLN H H 89 8.270 8.111 0.159 1
1 993 . 20 1 1 A 89 89 GLN HA H 89 4.122 4.481 -0.359 1
1 1000 . 20 1 1 A 89 89 GLN C C 89 177.955 178.623 -0.668 1
1 1001 . 20 1 1 A 89 89 GLN CA C 89 58.714 58.653 0.061 1
1 1002 . 20 1 1 A 89 89 GLN CB C 89 28.160 27.738 0.422 1
1 1004 . 20 1 1 A 89 89 GLN N N 89 121.097 118.237 2.860 1
1 1006 . 20 1 1 A 90 90 ALA H H 90 7.558 7.692 -0.134 1
1 1007 . 20 1 1 A 90 90 ALA HA H 90 4.123 4.180 -0.057 1
1 1011 . 20 1 1 A 90 90 ALA C C 90 178.076 177.977 0.099 1
1 1012 . 20 1 1 A 90 90 ALA CA C 90 52.942 53.882 -0.940 1
1 1013 . 20 1 1 A 90 90 ALA CB C 90 18.015 18.294 -0.279 1
1 1014 . 20 1 1 A 90 90 ALA N N 90 119.652 121.446 -1.794 1
1 1015 . 20 1 1 A 91 91 ARG H H 91 7.768 7.620 0.148 1
1 1016 . 20 1 1 A 91 91 ARG HA H 91 4.065 4.331 -0.266 1
1 1022 . 20 1 1 A 91 91 ARG C C 91 177.858 177.799 0.059 1
1 1023 . 20 1 1 A 91 91 ARG CA C 91 58.573 56.574 1.999 1
1 1024 . 20 1 1 A 91 91 ARG CB C 91 30.384 30.724 -0.340 1
1 1027 . 20 1 1 A 91 91 ARG N N 91 118.081 116.382 1.699 1
1 1028 . 20 1 1 A 92 92 GLU H H 92 7.691 8.029 -0.338 1
1 1029 . 20 1 1 A 92 92 GLU HA H 92 4.123 4.171 -0.048 1
1 1034 . 20 1 1 A 92 92 GLU C C 92 174.459 176.733 -2.274 1
1 1035 . 20 1 1 A 92 92 GLU CA C 92 61.565 60.790 0.775 1
1 1036 . 20 1 1 A 92 92 GLU CB C 92 27.583 28.835 -1.252 1
1 1038 . 20 1 1 A 92 92 GLU N N 92 118.447 118.079 0.368 1
1 1039 . 20 1 1 A 93 93 PRO HA H 93 4.716 4.552 0.164 1
1 1046 . 20 1 1 A 93 93 PRO C C 93 176.221 176.440 -0.219 1
1 1047 . 20 1 1 A 93 93 PRO CA C 93 63.149 62.559 0.590 1
1 1048 . 20 1 1 A 93 93 PRO CB C 93 32.571 33.002 -0.431 1
1 1051 . 20 1 1 A 94 94 ARG H H 94 8.434 9.019 -0.585 1
1 1052 . 20 1 1 A 94 94 ARG HA H 94 4.232 4.317 -0.085 1
1 1058 . 20 1 1 A 94 94 ARG C C 94 175.323 175.988 -0.665 1
1 1059 . 20 1 1 A 94 94 ARG CA C 94 56.972 56.930 0.042 1
1 1060 . 20 1 1 A 94 94 ARG CB C 94 30.448 31.079 -0.631 1
1 1063 . 20 1 1 A 94 94 ARG N N 94 115.987 119.048 -3.061 1
1 1064 . 20 1 1 A 95 95 GLN H H 95 7.246 7.607 -0.361 1
1 1065 . 20 1 1 A 95 95 GLN HA H 95 5.251 5.306 -0.055 1
1 1072 . 20 1 1 A 95 95 GLN C C 95 174.786 173.660 1.126 1
1 1073 . 20 1 1 A 95 95 GLN CA C 95 54.209 54.401 -0.192 1
1 1074 . 20 1 1 A 95 95 GLN CB C 95 32.384 32.361 0.023 1
1 1076 . 20 1 1 A 95 95 GLN N N 95 115.998 120.157 -4.159 1
1 1078 . 20 1 1 A 96 96 ALA H H 96 8.739 8.543 0.196 1
1 1079 . 20 1 1 A 96 96 ALA HA H 96 5.412 5.527 -0.115 1
1 1083 . 20 1 1 A 96 96 ALA C C 96 175.258 175.716 -0.458 1
1 1084 . 20 1 1 A 96 96 ALA CA C 96 50.355 49.968 0.387 1
1 1085 . 20 1 1 A 96 96 ALA CB C 96 24.270 23.064 1.206 1
1 1086 . 20 1 1 A 96 96 ALA N N 96 126.197 126.748 -0.551 1
1 1087 . 20 1 1 A 97 97 VAL H H 97 8.568 8.966 -0.398 1
1 1088 . 20 1 1 A 97 97 VAL HA H 97 4.804 4.717 0.087 1
1 1096 . 20 1 1 A 97 97 VAL C C 97 175.982 174.639 1.343 1
1 1097 . 20 1 1 A 97 97 VAL CA C 97 61.442 61.381 0.061 1
1 1098 . 20 1 1 A 97 97 VAL CB C 97 33.413 33.837 -0.424 1
1 1101 . 20 1 1 A 97 97 VAL N N 97 120.702 120.343 0.359 1
1 1102 . 20 1 1 A 98 98 ILE H H 98 9.753 8.549 1.204 1
1 1103 . 20 1 1 A 98 98 ILE HA H 98 4.826 5.172 -0.346 1
1 1113 . 20 1 1 A 98 98 ILE C C 98 174.292 174.836 -0.544 1
1 1114 . 20 1 1 A 98 98 ILE CA C 98 59.981 59.550 0.431 1
1 1115 . 20 1 1 A 98 98 ILE CB C 98 40.608 41.348 -0.740 1
1 1119 . 20 1 1 A 98 98 ILE N N 98 131.738 127.293 4.445 1
1 1120 . 20 1 1 A 99 99 VAL H H 99 8.493 8.294 0.199 1
1 1121 . 20 1 1 A 99 99 VAL HA H 99 5.201 4.771 0.430 1
1 1129 . 20 1 1 A 99 99 VAL C C 99 176.557 175.284 1.273 1
1 1130 . 20 1 1 A 99 99 VAL CA C 99 61.495 60.961 0.534 1
1 1131 . 20 1 1 A 99 99 VAL CB C 99 32.327 33.274 -0.947 1
1 1134 . 20 1 1 A 99 99 VAL N N 99 129.537 127.269 2.268 1
1 1135 . 20 1 1 A 100 100 THR H H 100 9.050 9.020 0.030 1
1 1136 . 20 1 1 A 100 100 THR HA H 100 5.606 5.357 0.249 1
1 1141 . 20 1 1 A 100 100 THR C C 100 172.815 173.249 -0.434 1
1 1142 . 20 1 1 A 100 100 THR CA C 100 59.049 59.211 -0.162 1
1 1143 . 20 1 1 A 100 100 THR CB C 100 73.966 71.807 2.159 1
1 1145 . 20 1 1 A 100 100 THR N N 100 117.469 117.488 -0.019 1
1 1146 . 20 1 1 A 101 101 ARG H H 101 8.773 8.505 0.268 1
1 1147 . 20 1 1 A 101 101 ARG HA H 101 4.989 4.760 0.229 1
1 1155 . 20 1 1 A 101 101 ARG C C 101 174.738 176.515 -1.777 1
1 1156 . 20 1 1 A 101 101 ARG CA C 101 54.825 54.458 0.367 1
1 1157 . 20 1 1 A 101 101 ARG CB C 101 34.636 32.127 2.509 1
1 1160 . 20 1 1 A 101 101 ARG N N 101 117.532 121.145 -3.613 1
1 1162 . 20 1 1 A 102 102 LYS H H 102 8.616 8.056 0.560 1
1 1163 . 20 1 1 A 102 102 LYS HA H 102 4.232 4.439 -0.207 1
1 1171 . 20 1 1 A 102 102 LYS C C 102 175.935 175.146 0.789 1
1 1172 . 20 1 1 A 102 102 LYS CA C 102 56.549 56.206 0.343 1
1 1173 . 20 1 1 A 102 102 LYS CB C 102 33.266 32.686 0.580 1
1 1177 . 20 1 1 A 102 102 LYS N N 102 126.899 121.853 5.046 1
1 1178 . 20 1 1 A 103 103 LEU H H 103 8.424 8.782 -0.358 1
1 1179 . 20 1 1 A 103 103 LEU HA H 103 4.540 4.992 -0.452 1
1 1189 . 20 1 1 A 103 103 LEU C C 103 176.956 175.700 1.256 1
1 1190 . 20 1 1 A 103 103 LEU CA C 103 54.755 53.434 1.321 1
1 1191 . 20 1 1 A 103 103 LEU CB C 103 42.929 44.751 -1.822 1
1 1195 . 20 1 1 A 103 103 LEU N N 103 126.246 125.940 0.306 1
1 1196 . 20 1 1 A 104 104 THR H H 104 8.201 8.415 -0.214 1
1 1197 . 20 1 1 A 104 104 THR HA H 104 4.624 4.685 -0.061 1
1 1202 . 20 1 1 A 104 104 THR C C 104 172.954 172.919 0.035 1
1 1203 . 20 1 1 A 104 104 THR CA C 104 59.483 58.752 0.731 1
1 1204 . 20 1 1 A 104 104 THR CB C 104 69.761 68.896 0.865 1
1 1206 . 20 1 1 A 104 104 THR N N 104 117.263 117.918 -0.655 1
1 1207 . 20 1 1 A 105 105 PRO HA H 105 4.399 4.605 -0.206 1
1 1213 . 20 1 1 A 105 105 PRO CA C 105 63.495 62.546 0.949 1
1 1214 . 20 1 1 A 105 105 PRO CB C 105 32.096 32.362 -0.266 1
1 1217 . 20 1 1 A 106 106 GLU H H 106 8.519 8.342 0.177 1
1 1218 . 20 1 1 A 106 106 GLU HA H 106 4.197 4.402 -0.205 1
1 1221 . 20 1 1 A 106 106 GLU C C 106 176.110 175.807 0.303 1
1 1222 . 20 1 1 A 106 106 GLU CA C 106 56.743 55.651 1.092 1
1 1223 . 20 1 1 A 106 106 GLU CB C 106 30.137 30.474 -0.337 1
1 1225 . 20 1 1 A 106 106 GLU N N 106 120.609 119.745 0.864 1
1 1226 . 20 1 1 A 107 107 ALA H H 107 8.241 8.430 -0.189 1
1 1227 . 20 1 1 A 107 107 ALA HA H 107 4.317 4.369 -0.052 1
1 1231 . 20 1 1 A 107 107 ALA C C 107 177.299 177.506 -0.207 1
1 1232 . 20 1 1 A 107 107 ALA CA C 107 52.203 53.049 -0.846 1
1 1233 . 20 1 1 A 107 107 ALA CB C 107 19.392 21.039 -1.647 1
1 1234 . 20 1 1 A 107 107 ALA N N 107 124.849 121.085 3.764 1
1 1235 . 20 1 1 A 108 108 MET H H 108 8.284 8.095 0.189 1
1 1236 . 20 1 1 A 108 108 MET HA H 108 4.792 4.118 0.674 1
1 1244 . 20 1 1 A 108 108 MET C C 108 174.337 175.197 -0.860 1
1 1245 . 20 1 1 A 108 108 MET CA C 108 53.258 56.142 -2.884 1
1 1246 . 20 1 1 A 108 108 MET CB C 108 32.608 31.116 1.492 1
1 1249 . 20 1 1 A 108 108 MET N N 108 121.025 117.155 3.870 1
1 1250 . 20 1 1 A 109 109 PRO HA H 109 4.408 4.754 -0.346 1
1 1256 . 20 1 1 A 109 109 PRO C C 109 176.412 175.560 0.852 1
1 1257 . 20 1 1 A 109 109 PRO CA C 109 63.290 62.761 0.529 1
1 1258 . 20 1 1 A 109 109 PRO CB C 109 32.077 32.528 -0.451 1
1 1261 . 20 1 1 A 110 110 ASP H H 110 8.417 8.709 -0.292 1
1 1262 . 20 1 1 A 110 110 ASP HA H 110 4.573 4.931 -0.358 1
1 1265 . 20 1 1 A 110 110 ASP C C 110 176.508 176.465 0.043 1
1 1266 . 20 1 1 A 110 110 ASP CA C 110 54.085 53.621 0.464 1
1 1267 . 20 1 1 A 110 110 ASP CB C 110 41.075 44.763 -3.688 1
1 1268 . 20 1 1 A 110 110 ASP N N 110 120.239 121.119 -0.880 1
1 1269 . 20 1 1 A 111 111 LEU H H 111 8.279 8.572 -0.293 1
1 1270 . 20 1 1 A 111 111 LEU HA H 111 4.319 3.858 0.461 1
1 1280 . 20 1 1 A 111 111 LEU C C 111 177.551 177.701 -0.150 1
1 1281 . 20 1 1 A 111 111 LEU CA C 111 55.581 58.237 -2.656 1
1 1282 . 20 1 1 A 111 111 LEU CB C 111 42.360 42.061 0.299 1
1 1286 . 20 1 1 A 111 111 LEU N N 111 123.318 125.597 -2.279 1
1 1287 . 20 1 1 A 112 112 ASN H H 112 8.487 7.813 0.674 1
1 1288 . 20 1 1 A 112 112 ASN HA H 112 4.725 4.768 -0.043 1
1 1293 . 20 1 1 A 112 112 ASN C C 112 175.454 173.962 1.492 1
1 1294 . 20 1 1 A 112 112 ASN CA C 112 53.610 53.236 0.374 1
1 1295 . 20 1 1 A 112 112 ASN CB C 112 39.116 40.134 -1.018 1
1 1296 . 20 1 1 A 112 112 ASN N N 112 118.752 115.365 3.387 1
1 1298 . 20 1 1 A 115 115 GLY H H 115 8.205 8.461 -0.256 1
1 1299 . 20 1 1 A 115 115 GLY HA2 H 115 4.126 4.225 -0.099 1
1 1300 . 20 1 1 A 115 115 GLY HA3 H 115 4.126 4.226 -0.100 1
1 1301 . 20 1 1 A 115 115 GLY CA C 115 44.727 44.276 0.451 1
1 1302 . 20 1 1 A 116 116 PRO HA H 116 4.485 4.751 -0.266 1
1 1309 . 20 1 1 A 116 116 PRO CA C 116 63.298 62.615 0.683 1
1 1310 . 20 1 1 A 116 116 PRO CB C 116 32.077 33.083 -1.006 1
1 1313 . 20 1 1 A 117 117 SER H H 117 8.532 8.860 -0.328 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 100 1.163 1
2 1 1 1 "RMS(OBS, PRED)" CA 108 1.314 1
3 1 1 1 "RMS(OBS, PRED)" CB 95 1.639 1
4 1 1 1 "RMS(OBS, PRED)" H 102 0.587 1
5 1 1 1 "RMS(OBS, PRED)" HA 121 0.275 1
6 1 1 1 "RMS(OBS, PRED)" N 100 3.341 1
7 1 2 1 "RMS(OBS, PRED)" C 100 1.145 1
8 1 2 1 "RMS(OBS, PRED)" CA 108 1.298 1
9 1 2 1 "RMS(OBS, PRED)" CB 95 1.443 1
10 1 2 1 "RMS(OBS, PRED)" H 102 0.627 1
11 1 2 1 "RMS(OBS, PRED)" HA 121 0.314 1
12 1 2 1 "RMS(OBS, PRED)" N 100 3.239 1
13 1 3 1 "RMS(OBS, PRED)" C 100 1.154 1
14 1 3 1 "RMS(OBS, PRED)" CA 108 1.230 1
15 1 3 1 "RMS(OBS, PRED)" CB 95 1.128 1
16 1 3 1 "RMS(OBS, PRED)" H 102 0.640 1
17 1 3 1 "RMS(OBS, PRED)" HA 121 0.287 1
18 1 3 1 "RMS(OBS, PRED)" N 100 3.360 1
19 1 4 1 "RMS(OBS, PRED)" C 100 1.125 1
20 1 4 1 "RMS(OBS, PRED)" CA 108 1.250 1
21 1 4 1 "RMS(OBS, PRED)" CB 95 1.439 1
22 1 4 1 "RMS(OBS, PRED)" H 102 0.620 1
23 1 4 1 "RMS(OBS, PRED)" HA 121 0.298 1
24 1 4 1 "RMS(OBS, PRED)" N 100 3.319 1
25 1 5 1 "RMS(OBS, PRED)" C 100 1.113 1
26 1 5 1 "RMS(OBS, PRED)" CA 108 1.298 1
27 1 5 1 "RMS(OBS, PRED)" CB 95 1.434 1
28 1 5 1 "RMS(OBS, PRED)" H 102 0.595 1
29 1 5 1 "RMS(OBS, PRED)" HA 121 0.301 1
30 1 5 1 "RMS(OBS, PRED)" N 100 3.235 1
31 1 6 1 "RMS(OBS, PRED)" C 100 1.123 1
32 1 6 1 "RMS(OBS, PRED)" CA 108 1.244 1
33 1 6 1 "RMS(OBS, PRED)" CB 95 1.174 1
34 1 6 1 "RMS(OBS, PRED)" H 102 0.594 1
35 1 6 1 "RMS(OBS, PRED)" HA 121 0.283 1
36 1 6 1 "RMS(OBS, PRED)" N 100 3.185 1
37 1 7 1 "RMS(OBS, PRED)" C 100 1.117 1
38 1 7 1 "RMS(OBS, PRED)" CA 108 1.332 1
39 1 7 1 "RMS(OBS, PRED)" CB 95 1.379 1
40 1 7 1 "RMS(OBS, PRED)" H 102 0.636 1
41 1 7 1 "RMS(OBS, PRED)" HA 121 0.305 1
42 1 7 1 "RMS(OBS, PRED)" N 100 3.313 1
43 1 8 1 "RMS(OBS, PRED)" C 100 1.160 1
44 1 8 1 "RMS(OBS, PRED)" CA 108 1.325 1
45 1 8 1 "RMS(OBS, PRED)" CB 95 1.389 1
46 1 8 1 "RMS(OBS, PRED)" H 102 0.655 1
47 1 8 1 "RMS(OBS, PRED)" HA 121 0.321 1
48 1 8 1 "RMS(OBS, PRED)" N 100 3.317 1
49 1 9 1 "RMS(OBS, PRED)" C 100 1.080 1
50 1 9 1 "RMS(OBS, PRED)" CA 108 1.233 1
51 1 9 1 "RMS(OBS, PRED)" CB 95 1.197 1
52 1 9 1 "RMS(OBS, PRED)" H 102 0.606 1
53 1 9 1 "RMS(OBS, PRED)" HA 121 0.306 1
54 1 9 1 "RMS(OBS, PRED)" N 100 3.315 1
55 1 10 1 "RMS(OBS, PRED)" C 100 1.186 1
56 1 10 1 "RMS(OBS, PRED)" CA 108 1.360 1
57 1 10 1 "RMS(OBS, PRED)" CB 95 1.457 1
58 1 10 1 "RMS(OBS, PRED)" H 102 0.609 1
59 1 10 1 "RMS(OBS, PRED)" HA 121 0.312 1
60 1 10 1 "RMS(OBS, PRED)" N 100 3.341 1
61 1 11 1 "RMS(OBS, PRED)" C 100 1.214 1
62 1 11 1 "RMS(OBS, PRED)" CA 108 1.361 1
63 1 11 1 "RMS(OBS, PRED)" CB 95 1.309 1
64 1 11 1 "RMS(OBS, PRED)" H 102 0.609 1
65 1 11 1 "RMS(OBS, PRED)" HA 121 0.290 1
66 1 11 1 "RMS(OBS, PRED)" N 100 3.372 1
67 1 12 1 "RMS(OBS, PRED)" C 100 1.256 1
68 1 12 1 "RMS(OBS, PRED)" CA 108 1.263 1
69 1 12 1 "RMS(OBS, PRED)" CB 95 1.432 1
70 1 12 1 "RMS(OBS, PRED)" H 102 0.637 1
71 1 12 1 "RMS(OBS, PRED)" HA 121 0.288 1
72 1 12 1 "RMS(OBS, PRED)" N 100 3.470 1
73 1 13 1 "RMS(OBS, PRED)" C 100 1.166 1
74 1 13 1 "RMS(OBS, PRED)" CA 108 1.334 1
75 1 13 1 "RMS(OBS, PRED)" CB 95 1.495 1
76 1 13 1 "RMS(OBS, PRED)" H 102 0.636 1
77 1 13 1 "RMS(OBS, PRED)" HA 121 0.313 1
78 1 13 1 "RMS(OBS, PRED)" N 100 3.169 1
79 1 14 1 "RMS(OBS, PRED)" C 100 1.081 1
80 1 14 1 "RMS(OBS, PRED)" CA 108 1.274 1
81 1 14 1 "RMS(OBS, PRED)" CB 95 1.420 1
82 1 14 1 "RMS(OBS, PRED)" H 102 0.608 1
83 1 14 1 "RMS(OBS, PRED)" HA 121 0.298 1
84 1 14 1 "RMS(OBS, PRED)" N 100 3.322 1
85 1 15 1 "RMS(OBS, PRED)" C 100 1.051 1
86 1 15 1 "RMS(OBS, PRED)" CA 108 1.299 1
87 1 15 1 "RMS(OBS, PRED)" CB 95 1.312 1
88 1 15 1 "RMS(OBS, PRED)" H 102 0.631 1
89 1 15 1 "RMS(OBS, PRED)" HA 121 0.276 1
90 1 15 1 "RMS(OBS, PRED)" N 100 3.179 1
91 1 16 1 "RMS(OBS, PRED)" C 100 1.179 1
92 1 16 1 "RMS(OBS, PRED)" CA 108 1.292 1
93 1 16 1 "RMS(OBS, PRED)" CB 95 1.410 1
94 1 16 1 "RMS(OBS, PRED)" H 102 0.614 1
95 1 16 1 "RMS(OBS, PRED)" HA 121 0.287 1
96 1 16 1 "RMS(OBS, PRED)" N 100 3.335 1
97 1 17 1 "RMS(OBS, PRED)" C 100 1.103 1
98 1 17 1 "RMS(OBS, PRED)" CA 108 1.178 1
99 1 17 1 "RMS(OBS, PRED)" CB 95 1.400 1
100 1 17 1 "RMS(OBS, PRED)" H 102 0.622 1
101 1 17 1 "RMS(OBS, PRED)" HA 121 0.291 1
102 1 17 1 "RMS(OBS, PRED)" N 100 3.384 1
103 1 18 1 "RMS(OBS, PRED)" C 100 1.173 1
104 1 18 1 "RMS(OBS, PRED)" CA 108 1.338 1
105 1 18 1 "RMS(OBS, PRED)" CB 95 1.473 1
106 1 18 1 "RMS(OBS, PRED)" H 102 0.635 1
107 1 18 1 "RMS(OBS, PRED)" HA 121 0.324 1
108 1 18 1 "RMS(OBS, PRED)" N 100 3.164 1
109 1 19 1 "RMS(OBS, PRED)" C 100 1.062 1
110 1 19 1 "RMS(OBS, PRED)" CA 108 1.300 1
111 1 19 1 "RMS(OBS, PRED)" CB 95 1.239 1
112 1 19 1 "RMS(OBS, PRED)" H 102 0.691 1
113 1 19 1 "RMS(OBS, PRED)" HA 121 0.284 1
114 1 19 1 "RMS(OBS, PRED)" N 100 3.311 1
115 1 20 1 "RMS(OBS, PRED)" C 100 1.200 1
116 1 20 1 "RMS(OBS, PRED)" CA 108 1.329 1
117 1 20 1 "RMS(OBS, PRED)" CB 95 1.732 1
118 1 20 1 "RMS(OBS, PRED)" H 102 0.635 1
119 1 20 1 "RMS(OBS, PRED)" HA 121 0.314 1
120 1 20 1 "RMS(OBS, PRED)" N 100 3.127 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 1 . 1 1 A 7 7 GLY HA2 H 7 3.960 4.155 -0.195 2
1 2 . 1 1 A 7 7 GLY HA3 H 7 3.960 4.155 -0.196 2
1 3 . 1 1 A 7 7 GLY C C 7 174.009 173.031 0.978 2
1 4 . 1 1 A 7 7 GLY CA C 7 45.374 45.479 -0.105 2
1 5 . 1 1 A 8 8 ALA H H 8 8.163 8.362 -0.199 2
1 6 . 1 1 A 8 8 ALA HA H 8 4.381 4.708 -0.327 2
1 10 . 1 1 A 8 8 ALA C C 8 178.078 176.292 1.786 2
1 11 . 1 1 A 8 8 ALA CA C 8 52.677 52.013 0.664 2
1 12 . 1 1 A 8 8 ALA CB C 8 19.368 20.931 -1.563 2
1 13 . 1 1 A 8 8 ALA N N 8 123.721 122.983 0.738 2
1 14 . 1 1 A 9 9 THR H H 9 8.142 8.541 -0.399 2
1 15 . 1 1 A 9 9 THR HA H 9 4.353 4.532 -0.179 2
1 20 . 1 1 A 9 9 THR C C 9 174.597 173.556 1.041 2
1 21 . 1 1 A 9 9 THR CA C 9 62.093 61.983 0.110 2
1 22 . 1 1 A 9 9 THR CB C 9 69.948 69.239 0.709 2
1 24 . 1 1 A 9 9 THR N N 9 113.761 114.053 -0.292 2
1 25 . 1 1 A 10 10 LEU H H 10 8.218 8.466 -0.248 2
1 26 . 1 1 A 10 10 LEU HA H 10 4.169 4.700 -0.531 2
1 36 . 1 1 A 10 10 LEU C C 10 176.110 176.159 -0.049 2
1 37 . 1 1 A 10 10 LEU CA C 10 61.099 54.137 6.962 2
1 38 . 1 1 A 10 10 LEU CB C 10 38.686 43.572 -4.886 2
1 42 . 1 1 A 10 10 LEU N N 10 123.516 125.504 -1.988 2
1 43 . 1 1 A 11 11 LYS H H 11 8.496 8.519 -0.023 2
1 44 . 1 1 A 11 11 LYS HA H 11 4.891 4.618 0.273 2
1 49 . 1 1 A 11 11 LYS C C 11 175.794 175.698 0.096 2
1 50 . 1 1 A 11 11 LYS CA C 11 55.652 56.202 -0.550 2
1 51 . 1 1 A 11 11 LYS CB C 11 29.444 34.572 -5.128 2
1 52 . 1 1 A 11 11 LYS N N 11 125.141 121.861 3.280 2
1 53 . 1 1 A 12 12 GLN HA H 12 4.315 4.608 -0.293 2
1 54 . 1 1 A 12 12 GLN C C 12 176.300 174.830 1.470 2
1 55 . 1 1 A 12 12 GLN CA C 12 56.286 55.702 0.584 2
1 56 . 1 1 A 12 12 GLN CB C 12 32.901 29.958 2.943 2
1 57 . 1 1 A 13 13 LEU H H 13 8.410 8.406 0.004 2
1 58 . 1 1 A 13 13 LEU HA H 13 4.348 4.527 -0.179 2
1 67 . 1 1 A 13 13 LEU C C 13 177.120 175.532 1.588 2
1 68 . 1 1 A 13 13 LEU CA C 13 55.142 54.421 0.721 2
1 69 . 1 1 A 13 13 LEU CB C 13 42.352 43.436 -1.084 2
1 73 . 1 1 A 13 13 LEU N N 13 124.340 123.713 0.627 2
1 74 . 1 1 A 14 14 ASP H H 14 8.250 8.931 -0.681 2
1 75 . 1 1 A 14 14 ASP HA H 14 4.540 4.584 -0.044 2
1 78 . 1 1 A 14 14 ASP C C 14 176.769 175.875 0.894 2
1 79 . 1 1 A 14 14 ASP CA C 14 54.772 54.919 -0.147 2
1 80 . 1 1 A 14 14 ASP CB C 14 41.322 40.873 0.449 2
1 81 . 1 1 A 14 14 ASP N N 14 120.493 124.438 -3.945 2
1 82 . 1 1 A 15 15 GLY H H 15 8.428 8.642 -0.214 2
1 83 . 1 1 A 15 15 GLY HA2 H 15 4.089 3.958 0.131 2
1 84 . 1 1 A 15 15 GLY HA3 H 15 3.874 3.968 -0.094 2
1 85 . 1 1 A 15 15 GLY C C 15 174.122 173.903 0.219 2
1 86 . 1 1 A 15 15 GLY CA C 15 45.972 46.318 -0.346 2
1 87 . 1 1 A 15 15 GLY N N 15 108.670 108.458 0.212 2
1 88 . 1 1 A 16 16 ILE H H 16 7.727 7.691 0.036 2
1 89 . 1 1 A 16 16 ILE HA H 16 4.705 4.528 0.177 2
1 99 . 1 1 A 16 16 ILE C C 16 175.807 174.657 1.150 2
1 100 . 1 1 A 16 16 ILE CA C 16 60.703 60.152 0.551 2
1 101 . 1 1 A 16 16 ILE CB C 16 38.509 39.654 -1.145 2
1 105 . 1 1 A 16 16 ILE N N 16 120.267 121.188 -0.921 2
1 106 . 1 1 A 17 17 HIS H H 17 9.101 8.636 0.465 2
1 107 . 1 1 A 17 17 HIS HA H 17 4.782 5.342 -0.560 2
1 112 . 1 1 A 17 17 HIS C C 17 173.051 173.812 -0.761 2
1 113 . 1 1 A 17 17 HIS CA C 17 55.353 53.688 1.665 2
1 114 . 1 1 A 17 17 HIS CB C 17 32.468 32.691 -0.223 2
1 117 . 1 1 A 17 17 HIS N N 17 125.061 125.946 -0.885 2
1 118 . 1 1 A 18 18 VAL H H 18 8.427 8.630 -0.203 2
1 119 . 1 1 A 18 18 VAL HA H 18 4.375 4.201 0.174 2
1 127 . 1 1 A 18 18 VAL C C 18 174.702 175.066 -0.364 2
1 128 . 1 1 A 18 18 VAL CA C 18 62.035 62.167 -0.132 2
1 129 . 1 1 A 18 18 VAL CB C 18 32.325 32.479 -0.154 2
1 132 . 1 1 A 18 18 VAL N N 18 127.069 126.310 0.759 2
1 133 . 1 1 A 19 19 THR H H 19 9.272 8.343 0.929 2
1 134 . 1 1 A 19 19 THR HA H 19 4.512 4.889 -0.377 2
1 139 . 1 1 A 19 19 THR C C 19 172.784 173.290 -0.506 2
1 140 . 1 1 A 19 19 THR CA C 19 62.512 61.686 0.826 2
1 141 . 1 1 A 19 19 THR CB C 19 70.663 70.528 0.135 2
1 143 . 1 1 A 19 19 THR N N 19 126.619 121.533 5.086 2
1 144 . 1 1 A 20 20 ILE H H 20 8.737 9.183 -0.446 2
1 145 . 1 1 A 20 20 ILE HA H 20 4.870 4.633 0.237 2
1 155 . 1 1 A 20 20 ILE C C 20 175.315 174.664 0.651 2
1 156 . 1 1 A 20 20 ILE CA C 20 60.157 60.213 -0.056 2
1 157 . 1 1 A 20 20 ILE CB C 20 38.603 38.339 0.264 2
1 161 . 1 1 A 20 20 ILE N N 20 128.114 128.516 -0.402 2
1 162 . 1 1 A 21 21 LEU H H 21 8.902 8.791 0.111 2
1 163 . 1 1 A 21 21 LEU HA H 21 4.804 4.895 -0.091 2
1 173 . 1 1 A 21 21 LEU C C 21 175.565 175.356 0.209 2
1 174 . 1 1 A 21 21 LEU CA C 21 52.731 53.420 -0.689 2
1 175 . 1 1 A 21 21 LEU CB C 21 43.947 43.297 0.650 2
1 179 . 1 1 A 21 21 LEU N N 21 125.457 128.445 -2.988 2
1 180 . 1 1 A 22 22 HIS H H 22 8.577 9.044 -0.467 2
1 181 . 1 1 A 22 22 HIS HA H 22 5.013 5.085 -0.072 2
1 186 . 1 1 A 22 22 HIS C C 22 174.258 174.979 -0.721 2
1 187 . 1 1 A 22 22 HIS CA C 22 55.880 54.801 1.079 2
1 188 . 1 1 A 22 22 HIS CB C 22 30.901 30.483 0.417 2
1 191 . 1 1 A 22 22 HIS N N 22 122.595 123.879 -1.284 2
1 192 . 1 1 A 23 23 LYS H H 23 8.712 9.723 -1.011 2
1 193 . 1 1 A 23 23 LYS HA H 23 4.880 5.014 -0.134 2
1 202 . 1 1 A 23 23 LYS C C 23 174.265 175.335 -1.070 2
1 203 . 1 1 A 23 23 LYS CA C 23 54.314 54.180 0.134 2
1 204 . 1 1 A 23 23 LYS CB C 23 36.068 36.096 -0.028 2
1 208 . 1 1 A 23 23 LYS N N 23 120.814 121.019 -0.205 2
1 209 . 1 1 A 24 24 GLU H H 24 8.360 8.484 -0.124 2
1 210 . 1 1 A 24 24 GLU HA H 24 4.350 4.629 -0.279 2
1 215 . 1 1 A 24 24 GLU C C 24 177.843 176.748 1.095 2
1 216 . 1 1 A 24 24 GLU CA C 24 55.601 55.071 0.530 2
1 217 . 1 1 A 24 24 GLU CB C 24 30.512 31.402 -0.890 2
1 219 . 1 1 A 24 24 GLU N N 24 117.859 119.393 -1.534 2
1 220 . 1 1 A 25 25 GLU H H 25 9.146 8.791 0.355 2
1 221 . 1 1 A 25 25 GLU HA H 25 3.924 4.062 -0.138 2
1 226 . 1 1 A 25 25 GLU C C 25 177.809 177.578 0.231 2
1 227 . 1 1 A 25 25 GLU CA C 25 58.568 58.601 -0.033 2
1 228 . 1 1 A 25 25 GLU CB C 25 29.313 29.159 0.154 2
1 230 . 1 1 A 25 25 GLU N N 25 124.543 121.882 2.662 2
1 231 . 1 1 A 26 26 GLY H H 26 8.242 8.823 -0.581 2
1 232 . 1 1 A 26 26 GLY HA2 H 26 4.287 4.010 0.277 2
1 233 . 1 1 A 26 26 GLY HA3 H 26 3.407 4.011 -0.604 2
1 234 . 1 1 A 26 26 GLY C C 26 174.234 175.208 -0.974 2
1 235 . 1 1 A 26 26 GLY CA C 26 46.113 46.259 -0.146 2
1 236 . 1 1 A 26 26 GLY N N 26 115.394 114.083 1.311 2
1 237 . 1 1 A 27 27 ALA H H 27 7.432 8.285 -0.853 2
1 238 . 1 1 A 27 27 ALA HA H 27 4.402 4.282 0.120 2
1 242 . 1 1 A 27 27 ALA C C 27 178.138 178.159 -0.021 2
1 243 . 1 1 A 27 27 ALA CA C 27 52.273 52.807 -0.534 2
1 244 . 1 1 A 27 27 ALA CB C 27 20.214 19.743 0.471 2
1 245 . 1 1 A 27 27 ALA N N 27 122.323 122.477 -0.154 2
1 246 . 1 1 A 28 28 GLY H H 28 8.624 7.849 0.775 2
1 247 . 1 1 A 28 28 GLY HA2 H 28 4.134 4.071 0.063 2
1 248 . 1 1 A 28 28 GLY HA3 H 28 3.953 4.109 -0.156 2
1 249 . 1 1 A 28 28 GLY C C 28 174.069 174.932 -0.863 2
1 250 . 1 1 A 28 28 GLY CA C 28 44.546 44.533 0.013 2
1 251 . 1 1 A 28 28 GLY N N 28 107.593 105.553 2.040 2
1 252 . 1 1 A 29 29 LEU H H 29 7.934 8.570 -0.636 2
1 253 . 1 1 A 29 29 LEU HA H 29 4.059 4.383 -0.324 2
1 263 . 1 1 A 29 29 LEU C C 29 177.548 176.938 0.610 2
1 264 . 1 1 A 29 29 LEU CA C 29 56.298 56.174 0.124 2
1 265 . 1 1 A 29 29 LEU CB C 29 41.940 42.815 -0.875 2
1 269 . 1 1 A 29 29 LEU N N 29 115.495 121.335 -5.840 2
1 270 . 1 1 A 30 30 GLY H H 30 8.669 8.010 0.659 2
1 271 . 1 1 A 30 30 GLY HA2 H 30 4.264 4.082 0.182 2
1 272 . 1 1 A 30 30 GLY HA3 H 30 4.001 4.183 -0.182 2
1 273 . 1 1 A 30 30 GLY C C 30 175.296 173.112 2.184 2
1 274 . 1 1 A 30 30 GLY CA C 30 46.368 45.049 1.319 2
1 275 . 1 1 A 30 30 GLY N N 30 103.121 106.109 -2.988 2
1 276 . 1 1 A 31 31 PHE H H 31 7.044 7.370 -0.326 2
1 277 . 1 1 A 31 31 PHE HA H 31 4.541 4.514 0.027 2
1 285 . 1 1 A 31 31 PHE C C 31 171.141 172.651 -1.510 2
1 286 . 1 1 A 31 31 PHE CA C 31 55.704 55.182 0.522 2
1 287 . 1 1 A 31 31 PHE CB C 31 40.745 41.835 -1.090 2
1 293 . 1 1 A 31 31 PHE N N 31 115.404 115.162 0.242 2
1 294 . 1 1 A 32 32 SER H H 32 8.752 8.884 -0.132 2
1 295 . 1 1 A 32 32 SER HA H 32 4.990 4.966 0.024 2
1 298 . 1 1 A 32 32 SER C C 32 175.049 173.050 1.999 2
1 299 . 1 1 A 32 32 SER CA C 32 55.001 56.031 -1.030 2
1 300 . 1 1 A 32 32 SER CB C 32 67.170 66.438 0.732 2
1 301 . 1 1 A 32 32 SER N N 32 113.639 114.737 -1.098 2
1 302 . 1 1 A 33 33 LEU H H 33 8.639 8.401 0.238 2
1 303 . 1 1 A 33 33 LEU HA H 33 5.573 5.178 0.395 2
1 313 . 1 1 A 33 33 LEU C C 33 175.827 175.602 0.225 2
1 314 . 1 1 A 33 33 LEU CA C 33 53.620 53.629 -0.009 2
1 315 . 1 1 A 33 33 LEU CB C 33 45.399 44.347 1.052 2
1 319 . 1 1 A 33 33 LEU N N 33 118.936 122.750 -3.814 2
1 320 . 1 1 A 34 34 ALA H H 34 9.410 8.915 0.495 2
1 321 . 1 1 A 34 34 ALA HA H 34 4.749 5.073 -0.324 2
1 325 . 1 1 A 34 34 ALA C C 34 176.231 176.883 -0.652 2
1 326 . 1 1 A 34 34 ALA CA C 34 50.425 51.237 -0.812 2
1 327 . 1 1 A 34 34 ALA CB C 34 22.518 22.926 -0.408 2
1 328 . 1 1 A 34 34 ALA N N 34 124.395 122.161 2.234 2
1 329 . 1 1 A 35 35 GLY H H 35 8.130 8.628 -0.498 2
1 330 . 1 1 A 35 35 GLY HA2 H 35 4.712 4.083 0.629 2
1 331 . 1 1 A 35 35 GLY HA3 H 35 3.955 4.120 -0.166 2
1 332 . 1 1 A 35 35 GLY C C 35 174.750 173.047 1.703 2
1 333 . 1 1 A 35 35 GLY CA C 35 44.494 44.852 -0.358 2
1 334 . 1 1 A 35 35 GLY N N 35 103.650 107.790 -4.140 2
1 335 . 1 1 A 36 36 GLY H H 36 8.217 8.090 0.127 2
1 336 . 1 1 A 36 36 GLY HA2 H 36 4.494 4.318 0.176 2
1 337 . 1 1 A 36 36 GLY HA3 H 36 3.836 4.350 -0.514 2
1 338 . 1 1 A 36 36 GLY C C 36 174.410 174.155 0.255 2
1 339 . 1 1 A 36 36 GLY CA C 36 45.462 45.885 -0.423 2
1 340 . 1 1 A 36 36 GLY N N 36 122.114 108.257 13.857 2
1 341 . 1 1 A 37 37 ALA H H 37 8.963 8.734 0.229 2
1 342 . 1 1 A 37 37 ALA HA H 37 3.998 4.125 -0.127 2
1 346 . 1 1 A 37 37 ALA C C 37 176.935 179.127 -2.192 2
1 347 . 1 1 A 37 37 ALA CA C 37 55.308 54.415 0.893 2
1 348 . 1 1 A 37 37 ALA CB C 37 18.822 18.681 0.141 2
1 349 . 1 1 A 37 37 ALA N N 37 123.418 122.658 0.760 2
1 350 . 1 1 A 38 38 ASP H H 38 10.586 8.182 2.404 2
1 351 . 1 1 A 38 38 ASP HA H 38 4.485 4.416 0.069 2
1 354 . 1 1 A 38 38 ASP C C 38 175.309 176.433 -1.124 2
1 355 . 1 1 A 38 38 ASP CA C 38 52.730 56.209 -3.479 2
1 356 . 1 1 A 38 38 ASP CB C 38 38.689 41.010 -2.321 2
1 357 . 1 1 A 38 38 ASP N N 38 111.480 117.976 -6.496 2
1 358 . 1 1 A 39 39 LEU H H 39 7.789 7.753 0.036 2
1 359 . 1 1 A 39 39 LEU HA H 39 4.699 4.405 0.294 2
1 369 . 1 1 A 39 39 LEU C C 39 176.377 177.791 -1.414 2
1 370 . 1 1 A 39 39 LEU CA C 39 52.952 54.172 -1.220 2
1 371 . 1 1 A 39 39 LEU CB C 39 43.294 42.229 1.065 2
1 375 . 1 1 A 39 39 LEU N N 39 122.545 121.143 1.402 2
1 376 . 1 1 A 40 40 GLU H H 40 8.331 8.625 -0.294 2
1 377 . 1 1 A 40 40 GLU HA H 40 3.978 4.148 -0.170 2
1 382 . 1 1 A 40 40 GLU C C 40 176.887 176.976 -0.089 2
1 383 . 1 1 A 40 40 GLU CA C 40 59.066 59.059 0.008 2
1 384 . 1 1 A 40 40 GLU CB C 40 29.523 29.955 -0.432 2
1 386 . 1 1 A 40 40 GLU N N 40 118.036 120.254 -2.218 2
1 387 . 1 1 A 41 41 ASN H H 41 7.890 7.839 0.051 2
1 388 . 1 1 A 41 41 ASN HA H 41 4.820 4.931 -0.111 2
1 393 . 1 1 A 41 41 ASN CA C 41 52.316 51.933 0.383 2
1 394 . 1 1 A 41 41 ASN CB C 41 37.409 37.808 -0.399 2
1 395 . 1 1 A 41 41 ASN N N 41 115.196 117.472 -2.276 2
1 397 . 1 1 A 42 42 LYS H H 42 7.943 8.375 -0.432 2
1 398 . 1 1 A 42 42 LYS HA H 42 4.328 4.331 -0.003 2
1 407 . 1 1 A 42 42 LYS C C 42 177.081 176.953 0.128 2
1 408 . 1 1 A 42 42 LYS CA C 42 56.567 58.839 -2.272 2
1 409 . 1 1 A 42 42 LYS CB C 42 33.120 32.819 0.301 2
1 413 . 1 1 A 42 42 LYS N N 42 120.612 124.454 -3.842 2
1 414 . 1 1 A 43 43 VAL H H 43 7.456 7.613 -0.157 2
1 415 . 1 1 A 43 43 VAL HA H 43 4.059 4.306 -0.247 2
1 423 . 1 1 A 43 43 VAL CA C 43 61.330 61.550 -0.220 2
1 424 . 1 1 A 43 43 VAL CB C 43 32.819 32.638 0.181 2
1 427 . 1 1 A 43 43 VAL N N 43 118.284 118.746 -0.462 2
1 428 . 1 1 A 44 44 ILE H H 44 8.481 8.636 -0.155 2
1 429 . 1 1 A 44 44 ILE HA H 44 4.913 4.563 0.350 2
1 439 . 1 1 A 44 44 ILE C C 44 176.719 175.856 0.863 2
1 440 . 1 1 A 44 44 ILE CA C 44 59.946 62.046 -2.100 2
1 441 . 1 1 A 44 44 ILE CB C 44 35.784 37.958 -2.174 2
1 445 . 1 1 A 44 44 ILE N N 44 127.089 129.165 -2.076 2
1 446 . 1 1 A 45 45 THR H H 45 8.906 9.327 -0.421 2
1 447 . 1 1 A 45 45 THR HA H 45 5.400 5.126 0.274 2
1 452 . 1 1 A 45 45 THR CA C 45 58.528 59.620 -1.092 2
1 453 . 1 1 A 45 45 THR CB C 45 73.760 71.895 1.865 2
1 455 . 1 1 A 45 45 THR N N 45 116.832 117.626 -0.794 2
1 456 . 1 1 A 46 46 VAL H H 46 8.336 8.718 -0.382 2
1 457 . 1 1 A 46 46 VAL HA H 46 4.059 4.229 -0.170 2
1 465 . 1 1 A 46 46 VAL C C 46 176.648 176.558 0.090 2
1 466 . 1 1 A 46 46 VAL CA C 46 63.058 63.045 0.013 2
1 467 . 1 1 A 46 46 VAL CB C 46 31.601 30.904 0.697 2
1 470 . 1 1 A 46 46 VAL N N 46 118.542 122.424 -3.882 2
1 471 . 1 1 A 47 47 HIS H H 47 9.382 8.643 0.739 2
1 472 . 1 1 A 47 47 HIS HA H 47 4.628 4.195 0.433 2
1 477 . 1 1 A 47 47 HIS C C 47 174.339 174.299 0.040 2
1 478 . 1 1 A 47 47 HIS CA C 47 57.764 59.962 -2.198 2
1 479 . 1 1 A 47 47 HIS CB C 47 31.453 30.585 0.868 2
1 482 . 1 1 A 47 47 HIS N N 47 133.900 128.333 5.567 2
1 483 . 1 1 A 48 48 ARG H H 48 7.135 7.744 -0.609 2
1 484 . 1 1 A 48 48 ARG HA H 48 4.360 4.766 -0.406 2
1 491 . 1 1 A 48 48 ARG C C 48 173.877 174.602 -0.725 2
1 492 . 1 1 A 48 48 ARG CA C 48 54.385 54.999 -0.614 2
1 493 . 1 1 A 48 48 ARG CB C 48 33.996 34.655 -0.659 2
1 496 . 1 1 A 48 48 ARG N N 48 114.736 117.727 -2.991 2
1 497 . 1 1 A 49 49 VAL H H 49 8.690 8.728 -0.038 2
1 498 . 1 1 A 49 49 VAL HA H 49 4.015 4.453 -0.438 2
1 506 . 1 1 A 49 49 VAL C C 49 176.255 175.582 0.673 2
1 507 . 1 1 A 49 49 VAL CA C 49 61.882 61.626 0.256 2
1 508 . 1 1 A 49 49 VAL CB C 49 32.261 33.057 -0.796 2
1 511 . 1 1 A 49 49 VAL N N 49 122.844 122.589 0.255 2
1 512 . 1 1 A 50 50 PHE H H 50 7.866 8.539 -0.673 2
1 513 . 1 1 A 50 50 PHE HA H 50 4.866 4.503 0.363 2
1 521 . 1 1 A 50 50 PHE C C 50 174.847 176.276 -1.429 2
1 522 . 1 1 A 50 50 PHE CA C 50 54.596 57.524 -2.928 2
1 523 . 1 1 A 50 50 PHE CB C 50 36.558 39.106 -2.548 2
1 529 . 1 1 A 50 50 PHE N N 50 128.498 127.430 1.068 2
1 530 . 1 1 A 51 51 PRO HA H 51 4.386 4.552 -0.166 2
1 537 . 1 1 A 51 51 PRO C C 51 177.321 176.659 0.662 2
1 538 . 1 1 A 51 51 PRO CA C 51 64.381 64.535 -0.154 2
1 539 . 1 1 A 51 51 PRO CB C 51 31.773 32.201 -0.428 2
1 542 . 1 1 A 52 52 ASN H H 52 8.814 8.506 0.308 2
1 543 . 1 1 A 52 52 ASN HA H 52 4.496 5.023 -0.527 2
1 548 . 1 1 A 52 52 ASN C C 52 174.823 174.641 0.182 2
1 549 . 1 1 A 52 52 ASN CA C 52 54.719 52.183 2.536 2
1 550 . 1 1 A 52 52 ASN CB C 52 38.109 39.272 -1.163 2
1 551 . 1 1 A 52 52 ASN N N 52 116.145 115.716 0.429 2
1 553 . 1 1 A 53 53 GLY H H 53 7.730 8.261 -0.530 2
1 554 . 1 1 A 53 53 GLY HA2 H 53 4.430 4.337 0.093 2
1 555 . 1 1 A 53 53 GLY HA3 H 53 4.089 4.353 -0.264 2
1 556 . 1 1 A 53 53 GLY C C 53 174.810 174.099 0.711 2
1 557 . 1 1 A 53 53 GLY CA C 53 44.987 45.806 -0.819 2
1 558 . 1 1 A 53 53 GLY N N 53 106.196 110.771 -4.575 2
1 559 . 1 1 A 54 54 LEU H H 54 8.764 9.061 -0.297 2
1 560 . 1 1 A 54 54 LEU HA H 54 4.041 4.167 -0.126 2
1 570 . 1 1 A 54 54 LEU C C 54 179.712 178.681 1.031 2
1 571 . 1 1 A 54 54 LEU CA C 54 58.310 57.667 0.643 2
1 572 . 1 1 A 54 54 LEU CB C 54 42.390 41.997 0.393 2
1 576 . 1 1 A 54 54 LEU N N 54 118.836 119.714 -0.878 2
1 577 . 1 1 A 55 55 ALA H H 55 7.593 8.224 -0.631 2
1 578 . 1 1 A 55 55 ALA HA H 55 4.275 3.919 0.356 2
1 582 . 1 1 A 55 55 ALA C C 55 181.307 179.657 1.650 2
1 583 . 1 1 A 55 55 ALA CA C 55 54.825 55.064 -0.239 2
1 584 . 1 1 A 55 55 ALA CB C 55 18.345 18.280 0.065 2
1 585 . 1 1 A 55 55 ALA N N 55 118.782 121.685 -2.903 2
1 586 . 1 1 A 56 56 SER H H 56 9.339 7.925 1.414 2
1 587 . 1 1 A 56 56 SER HA H 56 4.023 4.206 -0.183 2
1 589 . 1 1 A 56 56 SER C C 56 176.392 177.203 -0.811 2
1 590 . 1 1 A 56 56 SER CA C 56 60.984 61.354 -0.370 2
1 591 . 1 1 A 56 56 SER CB C 56 62.987 62.954 0.033 2
1 592 . 1 1 A 56 56 SER N N 56 117.631 113.352 4.279 2
1 593 . 1 1 A 57 57 GLN H H 57 7.942 7.741 0.201 2
1 594 . 1 1 A 57 57 GLN HA H 57 4.034 4.038 -0.004 2
1 601 . 1 1 A 57 57 GLN C C 57 177.400 178.538 -1.138 2
1 602 . 1 1 A 57 57 GLN CA C 57 58.362 58.902 -0.540 2
1 603 . 1 1 A 57 57 GLN CB C 57 28.801 28.480 0.321 2
1 605 . 1 1 A 57 57 GLN N N 57 118.162 121.632 -3.470 2
1 607 . 1 1 A 58 58 GLU H H 58 7.683 8.562 -0.879 2
1 608 . 1 1 A 58 58 GLU HA H 58 4.163 4.089 0.074 2
1 613 . 1 1 A 58 58 GLU C C 58 179.248 176.877 2.371 2
1 614 . 1 1 A 58 58 GLU CA C 58 59.559 58.429 1.130 2
1 615 . 1 1 A 58 58 GLU CB C 58 29.317 29.638 -0.321 2
1 617 . 1 1 A 58 58 GLU N N 58 119.877 119.128 0.749 2
1 618 . 1 1 A 59 59 GLY H H 59 7.446 7.574 -0.128 2
1 619 . 1 1 A 59 59 GLY HA2 H 59 4.100 3.958 0.142 2
1 620 . 1 1 A 59 59 GLY HA3 H 59 3.770 3.964 -0.194 2
1 621 . 1 1 A 59 59 GLY C C 59 175.432 175.202 0.230 2
1 622 . 1 1 A 59 59 GLY CA C 59 46.817 45.502 1.315 2
1 623 . 1 1 A 59 59 GLY N N 59 102.653 107.778 -5.125 2
1 624 . 1 1 A 60 60 THR H H 60 8.343 8.015 0.328 2
1 625 . 1 1 A 60 60 THR HA H 60 4.037 4.127 -0.090 2
1 630 . 1 1 A 60 60 THR C C 60 175.843 174.656 1.187 2
1 631 . 1 1 A 60 60 THR CA C 60 64.792 65.493 -0.701 2
1 632 . 1 1 A 60 60 THR CB C 60 69.325 69.199 0.126 2
1 634 . 1 1 A 60 60 THR N N 60 113.863 113.322 0.541 2
1 635 . 1 1 A 61 61 ILE H H 61 8.802 7.661 1.141 2
1 636 . 1 1 A 61 61 ILE HA H 61 3.631 4.119 -0.488 2
1 646 . 1 1 A 61 61 ILE C C 61 174.198 174.450 -0.251 2
1 647 . 1 1 A 61 61 ILE CA C 61 62.938 60.817 2.121 2
1 648 . 1 1 A 61 61 ILE CB C 61 37.225 36.325 0.900 2
1 652 . 1 1 A 61 61 ILE N N 61 126.153 119.606 6.547 2
1 653 . 1 1 A 62 62 GLN H H 62 7.124 9.080 -1.956 2
1 654 . 1 1 A 62 62 GLN HA H 62 4.500 4.652 -0.152 2
1 661 . 1 1 A 62 62 GLN C C 62 174.556 175.356 -0.800 2
1 662 . 1 1 A 62 62 GLN CA C 62 53.364 54.229 -0.865 2
1 663 . 1 1 A 62 62 GLN CB C 62 32.196 31.326 0.870 2
1 665 . 1 1 A 62 62 GLN N N 62 123.730 126.549 -2.819 2
1 667 . 1 1 A 63 63 LYS H H 63 8.399 8.565 -0.166 2
1 668 . 1 1 A 63 63 LYS HA H 63 3.464 4.341 -0.877 2
1 677 . 1 1 A 63 63 LYS CA C 63 57.905 57.657 0.247 2
1 678 . 1 1 A 63 63 LYS CB C 63 32.260 32.126 0.134 2
1 682 . 1 1 A 63 63 LYS N N 63 121.381 124.380 -2.999 2
1 683 . 1 1 A 64 64 GLY H H 64 9.265 8.902 0.363 2
1 684 . 1 1 A 64 64 GLY HA2 H 64 4.415 4.015 0.400 2
1 685 . 1 1 A 64 64 GLY HA3 H 64 3.639 4.022 -0.383 2
1 686 . 1 1 A 64 64 GLY CA C 64 44.881 45.097 -0.216 2
1 687 . 1 1 A 64 64 GLY N N 64 113.750 113.939 -0.189 2
1 688 . 1 1 A 65 65 ASN H H 65 7.594 8.309 -0.716 2
1 689 . 1 1 A 65 65 ASN HA H 65 4.798 4.798 0.000 2
1 694 . 1 1 A 65 65 ASN C C 65 175.042 174.076 0.966 2
1 695 . 1 1 A 65 65 ASN CA C 65 53.047 53.440 -0.393 2
1 696 . 1 1 A 65 65 ASN CB C 65 38.153 39.900 -1.747 2
1 697 . 1 1 A 65 65 ASN N N 65 117.999 119.808 -1.809 2
1 699 . 1 1 A 66 66 GLU H H 66 8.538 8.571 -0.033 2
1 700 . 1 1 A 66 66 GLU HA H 66 4.634 4.768 -0.134 2
1 705 . 1 1 A 66 66 GLU C C 66 176.620 175.263 1.357 2
1 706 . 1 1 A 66 66 GLU CA C 66 55.863 55.187 0.676 2
1 707 . 1 1 A 66 66 GLU CB C 66 30.899 31.505 -0.605 2
1 709 . 1 1 A 66 66 GLU N N 66 122.233 121.932 0.301 2
1 710 . 1 1 A 67 67 VAL H H 67 8.452 9.001 -0.549 2
1 711 . 1 1 A 67 67 VAL HA H 67 4.172 4.151 0.021 2
1 719 . 1 1 A 67 67 VAL C C 67 174.641 175.539 -0.898 2
1 720 . 1 1 A 67 67 VAL CA C 67 61.856 62.765 -0.909 2
1 721 . 1 1 A 67 67 VAL CB C 67 31.066 31.221 -0.155 2
1 724 . 1 1 A 67 67 VAL N N 67 126.311 127.210 -0.899 2
1 725 . 1 1 A 68 68 LEU H H 68 9.000 8.797 0.203 2
1 726 . 1 1 A 68 68 LEU HA H 68 4.390 4.200 0.190 2
1 736 . 1 1 A 68 68 LEU C C 68 178.924 176.918 2.006 2
1 737 . 1 1 A 68 68 LEU CA C 68 56.990 56.653 0.337 2
1 738 . 1 1 A 68 68 LEU CB C 68 42.392 42.430 -0.038 2
1 742 . 1 1 A 68 68 LEU N N 68 127.175 129.681 -2.506 2
1 743 . 1 1 A 69 69 SER H H 69 7.666 7.806 -0.140 2
1 744 . 1 1 A 69 69 SER HA H 69 5.144 4.983 0.161 2
1 747 . 1 1 A 69 69 SER C C 69 172.722 172.342 0.380 2
1 748 . 1 1 A 69 69 SER CA C 69 57.606 57.366 0.240 2
1 749 . 1 1 A 69 69 SER CB C 69 64.511 66.356 -1.845 2
1 750 . 1 1 A 69 69 SER N N 69 110.346 109.145 1.201 2
1 751 . 1 1 A 70 70 ILE H H 70 7.965 8.500 -0.535 2
1 752 . 1 1 A 70 70 ILE HA H 70 4.548 4.790 -0.242 2
1 762 . 1 1 A 70 70 ILE C C 70 174.993 176.082 -1.089 2
1 763 . 1 1 A 70 70 ILE CA C 70 60.897 60.235 0.662 2
1 764 . 1 1 A 70 70 ILE CB C 70 41.186 40.509 0.677 2
1 768 . 1 1 A 70 70 ILE N N 70 119.579 120.975 -1.396 2
1 769 . 1 1 A 71 71 ASN H H 71 9.839 10.426 -0.587 2
1 770 . 1 1 A 71 71 ASN HA H 71 4.485 4.415 0.070 2
1 775 . 1 1 A 71 71 ASN C C 71 174.975 174.816 0.159 2
1 776 . 1 1 A 71 71 ASN CA C 71 54.085 54.288 -0.203 2
1 777 . 1 1 A 71 71 ASN CB C 71 36.255 37.303 -1.048 2
1 778 . 1 1 A 71 71 ASN N N 71 126.963 125.803 1.160 2
1 780 . 1 1 A 72 72 GLY H H 72 8.911 8.437 0.474 2
1 781 . 1 1 A 72 72 GLY HA2 H 72 4.149 3.910 0.239 2
1 782 . 1 1 A 72 72 GLY HA3 H 72 3.507 3.911 -0.404 2
1 783 . 1 1 A 72 72 GLY C C 72 173.594 173.817 -0.223 2
1 784 . 1 1 A 72 72 GLY CA C 72 45.162 45.295 -0.133 2
1 785 . 1 1 A 72 72 GLY N N 72 103.020 105.000 -1.980 2
1 786 . 1 1 A 73 73 LYS H H 73 7.922 7.700 0.222 2
1 787 . 1 1 A 73 73 LYS HA H 73 4.485 4.492 -0.007 2
1 796 . 1 1 A 73 73 LYS C C 73 175.036 175.704 -0.668 2
1 797 . 1 1 A 73 73 LYS CA C 73 54.719 55.303 -0.584 2
1 798 . 1 1 A 73 73 LYS CB C 73 32.137 33.223 -1.086 2
1 802 . 1 1 A 73 73 LYS N N 73 122.413 121.900 0.513 2
1 803 . 1 1 A 74 74 SER H H 74 8.585 8.806 -0.221 2
1 804 . 1 1 A 74 74 SER HA H 74 4.452 4.710 -0.258 2
1 807 . 1 1 A 74 74 SER C C 74 175.965 174.089 1.876 2
1 808 . 1 1 A 74 74 SER CA C 74 58.028 58.516 -0.488 2
1 809 . 1 1 A 74 74 SER CB C 74 63.799 63.935 -0.136 2
1 810 . 1 1 A 74 74 SER N N 74 118.737 122.878 -4.141 2
1 811 . 1 1 A 75 75 LEU H H 75 8.015 8.300 -0.285 2
1 812 . 1 1 A 75 75 LEU HA H 75 4.661 4.443 0.218 2
1 822 . 1 1 A 75 75 LEU C C 75 178.117 177.503 0.614 2
1 823 . 1 1 A 75 75 LEU CA C 75 53.980 54.586 -0.606 2
1 824 . 1 1 A 75 75 LEU CB C 75 40.830 41.004 -0.174 2
1 828 . 1 1 A 75 75 LEU N N 75 125.425 125.778 -0.353 2
1 829 . 1 1 A 76 76 LYS H H 76 8.099 8.545 -0.446 2
1 830 . 1 1 A 76 76 LYS HA H 76 4.210 4.416 -0.206 2
1 839 . 1 1 A 76 76 LYS C C 76 178.487 176.765 1.722 2
1 840 . 1 1 A 76 76 LYS CA C 76 58.010 55.462 2.548 2
1 841 . 1 1 A 76 76 LYS CB C 76 31.683 31.653 0.030 2
1 845 . 1 1 A 76 76 LYS N N 76 124.064 120.221 3.843 2
1 846 . 1 1 A 77 77 GLY H H 77 8.859 7.843 1.016 2
1 847 . 1 1 A 77 77 GLY HA2 H 77 4.110 4.057 0.053 2
1 848 . 1 1 A 77 77 GLY HA3 H 77 3.869 4.060 -0.191 2
1 849 . 1 1 A 77 77 GLY C C 77 174.335 174.785 -0.450 2
1 850 . 1 1 A 77 77 GLY CA C 77 46.232 44.969 1.263 2
1 851 . 1 1 A 77 77 GLY N N 77 115.659 108.710 6.949 2
1 852 . 1 1 A 78 78 THR H H 78 7.654 7.750 -0.096 2
1 853 . 1 1 A 78 78 THR HA H 78 4.624 4.163 0.461 2
1 858 . 1 1 A 78 78 THR C C 78 177.272 174.817 2.455 2
1 859 . 1 1 A 78 78 THR CA C 78 61.794 63.229 -1.435 2
1 860 . 1 1 A 78 78 THR CB C 78 70.595 69.202 1.393 2
1 862 . 1 1 A 78 78 THR N N 78 112.847 116.598 -3.751 2
1 863 . 1 1 A 79 79 THR H H 79 8.813 8.592 0.221 2
1 864 . 1 1 A 79 79 THR HA H 79 4.395 4.682 -0.287 2
1 869 . 1 1 A 79 79 THR C C 79 174.503 175.456 -0.953 2
1 870 . 1 1 A 79 79 THR CA C 79 61.724 60.943 0.781 2
1 871 . 1 1 A 79 79 THR CB C 79 71.007 71.043 -0.036 2
1 873 . 1 1 A 79 79 THR N N 79 114.123 117.935 -3.812 2
1 874 . 1 1 A 80 80 HIS H H 80 10.266 9.171 1.095 2
1 875 . 1 1 A 80 80 HIS HA H 80 4.331 4.256 0.075 2
1 880 . 1 1 A 80 80 HIS C C 80 177.075 176.901 0.174 2
1 881 . 1 1 A 80 80 HIS CA C 80 61.338 59.963 1.375 2
1 882 . 1 1 A 80 80 HIS CB C 80 28.651 30.370 -1.719 2
1 885 . 1 1 A 80 80 HIS N N 80 122.776 121.886 0.890 2
1 886 . 1 1 A 81 81 HIS H H 81 9.335 8.103 1.232 2
1 887 . 1 1 A 81 81 HIS HA H 81 4.078 4.081 -0.003 2
1 892 . 1 1 A 81 81 HIS C C 81 178.269 176.657 1.612 2
1 893 . 1 1 A 81 81 HIS CA C 81 60.210 59.712 0.498 2
1 894 . 1 1 A 81 81 HIS CB C 81 29.569 30.010 -0.441 2
1 897 . 1 1 A 81 81 HIS N N 81 114.733 118.787 -4.054 2
1 898 . 1 1 A 82 82 ASP H H 82 7.741 8.124 -0.383 2
1 899 . 1 1 A 82 82 ASP HA H 82 4.452 4.101 0.351 2
1 902 . 1 1 A 82 82 ASP C C 82 178.683 178.804 -0.121 2
1 903 . 1 1 A 82 82 ASP CA C 82 57.148 57.262 -0.114 2
1 904 . 1 1 A 82 82 ASP CB C 82 39.522 40.400 -0.878 2
1 905 . 1 1 A 82 82 ASP N N 82 121.407 118.071 3.336 2
1 906 . 1 1 A 83 83 ALA H H 83 8.502 8.001 0.501 2
1 907 . 1 1 A 83 83 ALA HA H 83 3.939 4.138 -0.199 2
1 911 . 1 1 A 83 83 ALA C C 83 179.361 179.419 -0.058 2
1 912 . 1 1 A 83 83 ALA CA C 83 55.635 54.784 0.851 2
1 913 . 1 1 A 83 83 ALA CB C 83 18.124 18.938 -0.814 2
1 914 . 1 1 A 83 83 ALA N N 83 125.049 122.704 2.345 2
1 915 . 1 1 A 84 84 LEU H H 84 8.100 8.415 -0.315 2
1 916 . 1 1 A 84 84 LEU HA H 84 3.792 3.838 -0.046 2
1 926 . 1 1 A 84 84 LEU C C 84 180.173 179.052 1.121 2
1 927 . 1 1 A 84 84 LEU CA C 84 57.932 57.927 0.005 2
1 928 . 1 1 A 84 84 LEU CB C 84 41.157 41.495 -0.338 2
1 932 . 1 1 A 84 84 LEU N N 84 117.139 118.428 -1.289 2
1 933 . 1 1 A 85 85 ALA H H 85 7.715 8.803 -1.088 2
1 934 . 1 1 A 85 85 ALA HA H 85 4.061 4.120 -0.059 2
1 938 . 1 1 A 85 85 ALA C C 85 180.380 179.784 0.596 2
1 939 . 1 1 A 85 85 ALA CA C 85 55.212 55.392 -0.180 2
1 940 . 1 1 A 85 85 ALA CB C 85 17.803 18.541 -0.738 2
1 941 . 1 1 A 85 85 ALA N N 85 122.448 121.245 1.203 2
1 942 . 1 1 A 86 86 ILE H H 86 7.669 7.860 -0.191 2
1 943 . 1 1 A 86 86 ILE HA H 86 3.678 3.713 -0.035 2
1 953 . 1 1 A 86 86 ILE C C 86 178.692 178.645 0.047 2
1 954 . 1 1 A 86 86 ILE CA C 86 65.226 64.829 0.397 2
1 955 . 1 1 A 86 86 ILE CB C 86 38.099 37.777 0.322 2
1 959 . 1 1 A 86 86 ILE N N 86 121.804 117.867 3.937 2
1 960 . 1 1 A 87 87 LEU H H 87 7.922 8.455 -0.533 2
1 961 . 1 1 A 87 87 LEU HA H 87 3.903 4.011 -0.108 2
1 971 . 1 1 A 87 87 LEU C C 87 178.610 178.725 -0.115 2
1 972 . 1 1 A 87 87 LEU CA C 87 58.221 58.060 0.161 2
1 973 . 1 1 A 87 87 LEU CB C 87 42.344 41.517 0.827 2
1 977 . 1 1 A 87 87 LEU N N 87 121.947 121.418 0.529 2
1 978 . 1 1 A 88 88 ARG H H 88 8.317 8.386 -0.069 2
1 979 . 1 1 A 88 88 ARG HA H 88 4.060 4.157 -0.097 2
1 986 . 1 1 A 88 88 ARG C C 88 180.698 177.381 3.317 2
1 987 . 1 1 A 88 88 ARG CA C 88 59.383 58.494 0.889 2
1 988 . 1 1 A 88 88 ARG CB C 88 30.055 29.930 0.125 2
1 991 . 1 1 A 88 88 ARG N N 88 119.343 119.296 0.047 2
1 992 . 1 1 A 89 89 GLN H H 89 8.270 7.786 0.484 2
1 993 . 1 1 A 89 89 GLN HA H 89 4.122 4.210 -0.088 2
1 1000 . 1 1 A 89 89 GLN C C 89 177.955 178.176 -0.221 2
1 1001 . 1 1 A 89 89 GLN CA C 89 58.714 57.829 0.885 2
1 1002 . 1 1 A 89 89 GLN CB C 89 28.160 28.796 -0.636 2
1 1004 . 1 1 A 89 89 GLN N N 89 121.097 117.595 3.502 2
1 1006 . 1 1 A 90 90 ALA H H 90 7.558 7.601 -0.043 2
1 1007 . 1 1 A 90 90 ALA HA H 90 4.123 4.175 -0.052 2
1 1011 . 1 1 A 90 90 ALA C C 90 178.076 178.102 -0.026 2
1 1012 . 1 1 A 90 90 ALA CA C 90 52.942 53.828 -0.886 2
1 1013 . 1 1 A 90 90 ALA CB C 90 18.015 18.350 -0.335 2
1 1014 . 1 1 A 90 90 ALA N N 90 119.652 121.665 -2.012 2
1 1015 . 1 1 A 91 91 ARG H H 91 7.768 7.905 -0.137 2
1 1016 . 1 1 A 91 91 ARG HA H 91 4.065 4.314 -0.249 2
1 1022 . 1 1 A 91 91 ARG C C 91 177.858 177.724 0.134 2
1 1023 . 1 1 A 91 91 ARG CA C 91 58.573 57.029 1.544 2
1 1024 . 1 1 A 91 91 ARG CB C 91 30.384 30.648 -0.264 2
1 1027 . 1 1 A 91 91 ARG N N 91 118.081 116.903 1.178 2
1 1028 . 1 1 A 92 92 GLU H H 92 7.691 7.998 -0.307 2
1 1029 . 1 1 A 92 92 GLU HA H 92 4.123 4.162 -0.039 2
1 1034 . 1 1 A 92 92 GLU C C 92 174.459 176.693 -2.234 2
1 1035 . 1 1 A 92 92 GLU CA C 92 61.565 60.733 0.832 2
1 1036 . 1 1 A 92 92 GLU CB C 92 27.583 28.963 -1.380 2
1 1038 . 1 1 A 92 92 GLU N N 92 118.447 118.398 0.049 2
1 1039 . 1 1 A 93 93 PRO HA H 93 4.716 4.568 0.148 2
1 1046 . 1 1 A 93 93 PRO C C 93 176.221 176.395 -0.174 2
1 1047 . 1 1 A 93 93 PRO CA C 93 63.149 62.434 0.715 2
1 1048 . 1 1 A 93 93 PRO CB C 93 32.571 33.140 -0.569 2
1 1051 . 1 1 A 94 94 ARG H H 94 8.434 8.975 -0.541 2
1 1052 . 1 1 A 94 94 ARG HA H 94 4.232 4.491 -0.259 2
1 1058 . 1 1 A 94 94 ARG C C 94 175.323 175.963 -0.640 2
1 1059 . 1 1 A 94 94 ARG CA C 94 56.972 56.658 0.314 2
1 1060 . 1 1 A 94 94 ARG CB C 94 30.448 31.373 -0.925 2
1 1063 . 1 1 A 94 94 ARG N N 94 115.987 118.922 -2.935 2
1 1064 . 1 1 A 95 95 GLN H H 95 7.246 7.594 -0.348 2
1 1065 . 1 1 A 95 95 GLN HA H 95 5.251 5.273 -0.022 2
1 1072 . 1 1 A 95 95 GLN C C 95 174.786 173.692 1.094 2
1 1073 . 1 1 A 95 95 GLN CA C 95 54.209 54.447 -0.238 2
1 1074 . 1 1 A 95 95 GLN CB C 95 32.384 32.308 0.076 2
1 1076 . 1 1 A 95 95 GLN N N 95 115.998 119.877 -3.879 2
1 1078 . 1 1 A 96 96 ALA H H 96 8.739 8.431 0.308 2
1 1079 . 1 1 A 96 96 ALA HA H 96 5.412 5.230 0.182 2
1 1083 . 1 1 A 96 96 ALA C C 96 175.258 175.811 -0.553 2
1 1084 . 1 1 A 96 96 ALA CA C 96 50.355 50.642 -0.287 2
1 1085 . 1 1 A 96 96 ALA CB C 96 24.270 22.745 1.525 2
1 1086 . 1 1 A 96 96 ALA N N 96 126.197 125.718 0.479 2
1 1087 . 1 1 A 97 97 VAL H H 97 8.568 8.764 -0.196 2
1 1088 . 1 1 A 97 97 VAL HA H 97 4.804 4.730 0.074 2
1 1096 . 1 1 A 97 97 VAL C C 97 175.982 174.846 1.136 2
1 1097 . 1 1 A 97 97 VAL CA C 97 61.442 61.345 0.097 2
1 1098 . 1 1 A 97 97 VAL CB C 97 33.413 33.446 -0.033 2
1 1101 . 1 1 A 97 97 VAL N N 97 120.702 121.414 -0.712 2
1 1102 . 1 1 A 98 98 ILE H H 98 9.753 8.620 1.133 2
1 1103 . 1 1 A 98 98 ILE HA H 98 4.826 5.005 -0.179 2
1 1113 . 1 1 A 98 98 ILE C C 98 174.292 174.637 -0.345 2
1 1114 . 1 1 A 98 98 ILE CA C 98 59.981 59.766 0.215 2
1 1115 . 1 1 A 98 98 ILE CB C 98 40.608 40.803 -0.195 2
1 1119 . 1 1 A 98 98 ILE N N 98 131.738 127.328 4.410 2
1 1120 . 1 1 A 99 99 VAL H H 99 8.493 8.582 -0.089 2
1 1121 . 1 1 A 99 99 VAL HA H 99 5.201 4.712 0.489 2
1 1129 . 1 1 A 99 99 VAL C C 99 176.557 175.337 1.220 2
1 1130 . 1 1 A 99 99 VAL CA C 99 61.495 61.082 0.413 2
1 1131 . 1 1 A 99 99 VAL CB C 99 32.327 32.587 -0.260 2
1 1134 . 1 1 A 99 99 VAL N N 99 129.537 128.921 0.616 2
1 1135 . 1 1 A 100 100 THR H H 100 9.050 8.780 0.270 2
1 1136 . 1 1 A 100 100 THR HA H 100 5.606 5.351 0.255 2
1 1141 . 1 1 A 100 100 THR C C 100 172.815 172.985 -0.170 2
1 1142 . 1 1 A 100 100 THR CA C 100 59.049 59.455 -0.406 2
1 1143 . 1 1 A 100 100 THR CB C 100 73.966 72.212 1.754 2
1 1145 . 1 1 A 100 100 THR N N 100 117.469 117.309 0.160 2
1 1146 . 1 1 A 101 101 ARG H H 101 8.773 8.715 0.058 2
1 1147 . 1 1 A 101 101 ARG HA H 101 4.989 4.867 0.122 2
1 1155 . 1 1 A 101 101 ARG C C 101 174.738 175.506 -0.768 2
1 1156 . 1 1 A 101 101 ARG CA C 101 54.825 54.225 0.600 2
1 1157 . 1 1 A 101 101 ARG CB C 101 34.636 33.319 1.317 2
1 1160 . 1 1 A 101 101 ARG N N 101 117.532 120.731 -3.199 2
1 1162 . 1 1 A 102 102 LYS H H 102 8.616 8.359 0.257 2
1 1163 . 1 1 A 102 102 LYS HA H 102 4.232 4.459 -0.227 2
1 1171 . 1 1 A 102 102 LYS C C 102 175.935 175.751 0.184 2
1 1172 . 1 1 A 102 102 LYS CA C 102 56.549 56.515 0.034 2
1 1173 . 1 1 A 102 102 LYS CB C 102 33.266 32.750 0.516 2
1 1177 . 1 1 A 102 102 LYS N N 102 126.899 122.091 4.808 2
1 1178 . 1 1 A 103 103 LEU H H 103 8.424 8.643 -0.219 2
1 1179 . 1 1 A 103 103 LEU HA H 103 4.540 4.749 -0.209 2
1 1189 . 1 1 A 103 103 LEU C C 103 176.956 176.408 0.548 2
1 1190 . 1 1 A 103 103 LEU CA C 103 54.755 53.954 0.801 2
1 1191 . 1 1 A 103 103 LEU CB C 103 42.929 43.566 -0.637 2
1 1195 . 1 1 A 103 103 LEU N N 103 126.246 125.907 0.339 2
1 1196 . 1 1 A 104 104 THR H H 104 8.201 8.358 -0.157 2
1 1197 . 1 1 A 104 104 THR HA H 104 4.624 4.533 0.091 2
1 1202 . 1 1 A 104 104 THR C C 104 172.954 173.955 -1.001 2
1 1203 . 1 1 A 104 104 THR CA C 104 59.483 60.512 -1.029 2
1 1204 . 1 1 A 104 104 THR CB C 104 69.761 69.040 0.721 2
1 1206 . 1 1 A 104 104 THR N N 104 117.263 114.919 2.344 2
1 1207 . 1 1 A 105 105 PRO HA H 105 4.399 4.585 -0.186 2
1 1213 . 1 1 A 105 105 PRO CA C 105 63.495 63.026 0.469 2
1 1214 . 1 1 A 105 105 PRO CB C 105 32.096 32.729 -0.633 2
1 1217 . 1 1 A 106 106 GLU H H 106 8.519 8.459 0.060 2
1 1218 . 1 1 A 106 106 GLU HA H 106 4.197 4.665 -0.468 2
1 1221 . 1 1 A 106 106 GLU C C 106 176.110 175.683 0.427 2
1 1222 . 1 1 A 106 106 GLU CA C 106 56.743 55.911 0.832 2
1 1223 . 1 1 A 106 106 GLU CB C 106 30.137 31.262 -1.126 2
1 1225 . 1 1 A 106 106 GLU N N 106 120.609 117.561 3.048 2
1 1226 . 1 1 A 107 107 ALA H H 107 8.241 8.235 0.006 2
1 1227 . 1 1 A 107 107 ALA HA H 107 4.317 4.567 -0.250 2
1 1231 . 1 1 A 107 107 ALA C C 107 177.299 176.417 0.882 2
1 1232 . 1 1 A 107 107 ALA CA C 107 52.203 52.120 0.083 2
1 1233 . 1 1 A 107 107 ALA CB C 107 19.392 20.383 -0.991 2
1 1234 . 1 1 A 107 107 ALA N N 107 124.849 122.222 2.627 2
1 1235 . 1 1 A 108 108 MET H H 108 8.284 8.424 -0.140 2
1 1236 . 1 1 A 108 108 MET HA H 108 4.792 4.719 0.073 2
1 1244 . 1 1 A 108 108 MET C C 108 174.337 174.542 -0.205 2
1 1245 . 1 1 A 108 108 MET CA C 108 53.258 53.995 -0.737 2
1 1246 . 1 1 A 108 108 MET CB C 108 32.608 33.576 -0.968 2
1 1249 . 1 1 A 108 108 MET N N 108 121.025 119.580 1.445 2
1 1250 . 1 1 A 109 109 PRO HA H 109 4.408 4.669 -0.261 2
1 1256 . 1 1 A 109 109 PRO C C 109 176.412 175.631 0.781 2
1 1257 . 1 1 A 109 109 PRO CA C 109 63.290 62.621 0.669 2
1 1258 . 1 1 A 109 109 PRO CB C 109 32.077 31.954 0.123 2
1 1261 . 1 1 A 110 110 ASP H H 110 8.417 8.513 -0.096 2
1 1262 . 1 1 A 110 110 ASP HA H 110 4.573 4.943 -0.370 2
1 1265 . 1 1 A 110 110 ASP C C 110 176.508 175.580 0.928 2
1 1266 . 1 1 A 110 110 ASP CA C 110 54.085 53.356 0.729 2
1 1267 . 1 1 A 110 110 ASP CB C 110 41.075 42.406 -1.331 2
1 1268 . 1 1 A 110 110 ASP N N 110 120.239 120.972 -0.733 2
1 1269 . 1 1 A 111 111 LEU H H 111 8.279 8.655 -0.376 2
1 1270 . 1 1 A 111 111 LEU HA H 111 4.319 4.237 0.082 2
1 1280 . 1 1 A 111 111 LEU C C 111 177.551 176.545 1.006 2
1 1281 . 1 1 A 111 111 LEU CA C 111 55.581 56.015 -0.434 2
1 1282 . 1 1 A 111 111 LEU CB C 111 42.360 41.788 0.572 2
1 1286 . 1 1 A 111 111 LEU N N 111 123.318 125.886 -2.568 2
1 1287 . 1 1 A 112 112 ASN H H 112 8.487 8.208 0.279 2
1 1288 . 1 1 A 112 112 ASN HA H 112 4.725 4.813 -0.088 2
1 1293 . 1 1 A 112 112 ASN C C 112 175.454 174.107 1.347 2
1 1294 . 1 1 A 112 112 ASN CA C 112 53.610 53.731 -0.121 2
1 1295 . 1 1 A 112 112 ASN CB C 112 39.116 39.408 -0.292 2
1 1296 . 1 1 A 112 112 ASN N N 112 118.752 118.015 0.737 2
1 1298 . 1 1 A 115 115 GLY H H 115 8.205 8.474 -0.269 2
1 1299 . 1 1 A 115 115 GLY HA2 H 115 4.126 4.231 -0.105 2
1 1300 . 1 1 A 115 115 GLY HA3 H 115 4.126 4.231 -0.105 2
1 1301 . 1 1 A 115 115 GLY CA C 115 44.727 45.152 -0.425 2
1 1302 . 1 1 A 116 116 PRO HA H 116 4.485 4.646 -0.161 2
1 1309 . 1 1 A 116 116 PRO CA C 116 63.298 62.818 0.480 2
1 1310 . 1 1 A 116 116 PRO CB C 116 32.077 33.041 -0.964 2
1 1313 . 1 1 A 117 117 SER H H 117 8.532 8.600 -0.068 2
stop_
save_