data_10253_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 10253
_Entry.PDB_ID 2COA
_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 6 6 SER H H 6 8.337 8.924 -0.587 1
1 2 . 1 1 1 A 6 6 SER HA H 6 4.597 4.161 0.436 1
1 5 . 1 1 1 A 6 6 SER C C 6 174.637 174.640 -0.003 1
1 6 . 1 1 1 A 6 6 SER CA C 6 58.469 60.835 -2.366 1
1 7 . 1 1 1 A 6 6 SER CB C 6 64.221 63.779 0.442 1
1 8 . 1 1 1 A 6 6 SER N N 6 117.887 120.379 -2.492 1
1 9 . 1 1 1 A 7 7 GLY H H 7 8.280 7.360 0.920 1
1 10 . 1 1 1 A 7 7 GLY HA2 H 7 4.063 4.110 -0.047 1
1 11 . 1 1 1 A 7 7 GLY HA3 H 7 4.063 4.110 -0.047 1
1 12 . 1 1 1 A 7 7 GLY C C 7 173.724 172.522 1.202 1
1 13 . 1 1 1 A 7 7 GLY CA C 7 44.941 45.294 -0.353 1
1 14 . 1 1 1 A 7 7 GLY N N 7 110.151 107.134 3.017 1
1 15 . 1 1 1 A 8 8 THR H H 8 8.212 8.526 -0.314 1
1 16 . 1 1 1 A 8 8 THR HA H 8 4.173 4.491 -0.318 1
1 21 . 1 1 1 A 8 8 THR C C 8 174.723 174.620 0.103 1
1 22 . 1 1 1 A 8 8 THR CA C 8 63.622 63.931 -0.309 1
1 23 . 1 1 1 A 8 8 THR CB C 8 69.460 69.261 0.199 1
1 25 . 1 1 1 A 8 8 THR N N 8 116.817 118.575 -1.758 1
1 26 . 1 1 1 A 9 9 LEU H H 9 9.374 8.878 0.496 1
1 27 . 1 1 1 A 9 9 LEU HA H 9 4.302 4.227 0.075 1
1 37 . 1 1 1 A 9 9 LEU C C 9 177.468 176.516 0.952 1
1 38 . 1 1 1 A 9 9 LEU CA C 9 55.936 56.419 -0.483 1
1 39 . 1 1 1 A 9 9 LEU CB C 9 42.843 42.500 0.343 1
1 43 . 1 1 1 A 9 9 LEU N N 9 127.798 128.818 -1.020 1
1 44 . 1 1 1 A 10 10 ARG H H 10 7.512 7.256 0.256 1
1 45 . 1 1 1 A 10 10 ARG HA H 10 4.199 4.671 -0.472 1
1 52 . 1 1 1 A 10 10 ARG C C 10 172.501 173.951 -1.450 1
1 53 . 1 1 1 A 10 10 ARG CA C 10 56.165 54.432 1.733 1
1 54 . 1 1 1 A 10 10 ARG CB C 10 32.442 33.336 -0.894 1
1 57 . 1 1 1 A 10 10 ARG N N 10 117.979 117.423 0.556 1
1 58 . 1 1 1 A 11 11 GLU H H 11 8.434 8.714 -0.280 1
1 59 . 1 1 1 A 11 11 GLU HA H 11 5.993 5.625 0.368 1
1 64 . 1 1 1 A 11 11 GLU C C 11 174.800 174.594 0.206 1
1 65 . 1 1 1 A 11 11 GLU CA C 11 54.570 55.165 -0.595 1
1 66 . 1 1 1 A 11 11 GLU CB C 11 34.245 33.013 1.232 1
1 68 . 1 1 1 A 11 11 GLU N N 11 120.782 121.521 -0.739 1
1 69 . 1 1 1 A 12 12 GLY H H 12 8.131 7.629 0.502 1
1 70 . 1 1 1 A 12 12 GLY HA2 H 12 4.714 3.560 1.154 1
1 71 . 1 1 1 A 12 12 GLY HA3 H 12 3.763 4.125 -0.362 1
1 72 . 1 1 1 A 12 12 GLY C C 12 171.060 171.875 -0.815 1
1 73 . 1 1 1 A 12 12 GLY CA C 12 45.241 45.016 0.225 1
1 74 . 1 1 1 A 12 12 GLY N N 12 107.457 106.228 1.229 1
1 75 . 1 1 1 A 13 13 TRP H H 13 8.783 8.519 0.264 1
1 76 . 1 1 1 A 13 13 TRP HA H 13 5.152 4.894 0.258 1
1 85 . 1 1 1 A 13 13 TRP C C 13 177.528 176.534 0.994 1
1 86 . 1 1 1 A 13 13 TRP CA C 13 57.783 58.762 -0.979 1
1 87 . 1 1 1 A 13 13 TRP CB C 13 30.222 30.051 0.171 1
1 93 . 1 1 1 A 13 13 TRP N N 13 120.792 121.380 -0.588 1
1 95 . 1 1 1 A 14 14 VAL H H 14 9.179 8.759 0.420 1
1 96 . 1 1 1 A 14 14 VAL HA H 14 4.072 4.592 -0.520 1
1 104 . 1 1 1 A 14 14 VAL C C 14 174.981 173.526 1.455 1
1 105 . 1 1 1 A 14 14 VAL CA C 14 61.741 60.321 1.420 1
1 106 . 1 1 1 A 14 14 VAL CB C 14 35.143 35.241 -0.098 1
1 109 . 1 1 1 A 14 14 VAL N N 14 125.476 122.815 2.661 1
1 110 . 1 1 1 A 15 15 VAL H H 15 8.403 8.829 -0.426 1
1 111 . 1 1 1 A 15 15 VAL HA H 15 5.532 5.334 0.198 1
1 119 . 1 1 1 A 15 15 VAL C C 15 175.078 174.367 0.711 1
1 120 . 1 1 1 A 15 15 VAL CA C 15 59.489 59.399 0.090 1
1 121 . 1 1 1 A 15 15 VAL CB C 15 34.210 34.972 -0.762 1
1 124 . 1 1 1 A 15 15 VAL N N 15 126.189 127.492 -1.303 1
1 125 . 1 1 1 A 16 16 HIS H H 16 9.122 8.679 0.443 1
1 126 . 1 1 1 A 16 16 HIS HA H 16 5.823 5.788 0.035 1
1 131 . 1 1 1 A 16 16 HIS C C 16 172.998 172.351 0.647 1
1 132 . 1 1 1 A 16 16 HIS CA C 16 56.253 53.812 2.441 1
1 133 . 1 1 1 A 16 16 HIS CB C 16 34.273 33.328 0.945 1
1 136 . 1 1 1 A 16 16 HIS N N 16 121.152 120.906 0.246 1
1 137 . 1 1 1 A 17 17 TYR H H 17 8.465 8.685 -0.220 1
1 138 . 1 1 1 A 17 17 TYR HA H 17 5.096 4.929 0.167 1
1 145 . 1 1 1 A 17 17 TYR C C 17 173.640 172.829 0.811 1
1 146 . 1 1 1 A 17 17 TYR CA C 17 56.903 56.198 0.705 1
1 147 . 1 1 1 A 17 17 TYR CB C 17 40.103 40.450 -0.347 1
1 152 . 1 1 1 A 17 17 TYR N N 17 115.558 116.698 -1.140 1
1 153 . 1 1 1 A 18 18 SER H H 18 9.122 8.840 0.282 1
1 154 . 1 1 1 A 18 18 SER HA H 18 6.144 5.415 0.729 1
1 157 . 1 1 1 A 18 18 SER C C 18 173.204 175.015 -1.811 1
1 158 . 1 1 1 A 18 18 SER CA C 18 56.640 56.473 0.167 1
1 159 . 1 1 1 A 18 18 SER CB C 18 68.788 66.299 2.489 1
1 160 . 1 1 1 A 18 18 SER N N 18 118.846 115.506 3.340 1
1 161 . 1 1 1 A 19 19 ASN H H 19 9.053 8.818 0.235 1
1 162 . 1 1 1 A 19 19 ASN HA H 19 4.473 5.011 -0.538 1
1 167 . 1 1 1 A 19 19 ASN C C 19 175.396 175.823 -0.427 1
1 168 . 1 1 1 A 19 19 ASN CA C 19 55.373 52.241 3.132 1
1 169 . 1 1 1 A 19 19 ASN CB C 19 36.900 38.190 -1.290 1
1 170 . 1 1 1 A 19 19 ASN N N 19 113.712 117.820 -4.108 1
1 172 . 1 1 1 A 20 20 LYS H H 20 7.677 8.319 -0.642 1
1 173 . 1 1 1 A 20 20 LYS HA H 20 4.413 4.701 -0.288 1
1 182 . 1 1 1 A 20 20 LYS C C 20 176.078 177.583 -1.505 1
1 183 . 1 1 1 A 20 20 LYS CA C 20 55.679 57.524 -1.845 1
1 184 . 1 1 1 A 20 20 LYS CB C 20 33.023 35.610 -2.587 1
1 188 . 1 1 1 A 20 20 LYS N N 20 117.213 119.466 -2.253 1
1 189 . 1 1 1 A 21 21 ASP H H 21 7.395 7.390 0.005 1
1 190 . 1 1 1 A 21 21 ASP HA H 21 4.808 4.731 0.077 1
1 193 . 1 1 1 A 21 21 ASP C C 21 176.413 176.218 0.195 1
1 194 . 1 1 1 A 21 21 ASP CA C 21 53.983 54.013 -0.030 1
1 195 . 1 1 1 A 21 21 ASP CB C 21 41.199 42.794 -1.595 1
1 196 . 1 1 1 A 21 21 ASP N N 21 119.879 116.518 3.361 1
1 197 . 1 1 1 A 22 22 THR H H 22 8.593 8.057 0.536 1
1 198 . 1 1 1 A 22 22 THR HA H 22 4.352 4.053 0.299 1
1 203 . 1 1 1 A 22 22 THR C C 22 172.913 174.740 -1.827 1
1 204 . 1 1 1 A 22 22 THR CA C 22 62.691 62.989 -0.298 1
1 205 . 1 1 1 A 22 22 THR CB C 22 68.332 66.430 1.902 1
1 207 . 1 1 1 A 22 22 THR N N 22 116.299 112.837 3.462 1
1 208 . 1 1 1 A 23 23 LEU H H 23 7.645 7.933 -0.288 1
1 209 . 1 1 1 A 23 23 LEU HA H 23 4.318 4.384 -0.066 1
1 219 . 1 1 1 A 23 23 LEU C C 23 176.692 176.678 0.014 1
1 220 . 1 1 1 A 23 23 LEU CA C 23 54.617 53.930 0.687 1
1 221 . 1 1 1 A 23 23 LEU CB C 23 41.939 41.298 0.641 1
1 225 . 1 1 1 A 23 23 LEU N N 23 123.606 121.096 2.510 1
1 226 . 1 1 1 A 24 24 ARG H H 24 8.563 7.954 0.609 1
1 227 . 1 1 1 A 24 24 ARG HA H 24 4.373 4.505 -0.132 1
1 235 . 1 1 1 A 24 24 ARG C C 24 176.584 176.006 0.578 1
1 236 . 1 1 1 A 24 24 ARG CA C 24 57.854 57.286 0.568 1
1 237 . 1 1 1 A 24 24 ARG CB C 24 31.126 30.367 0.759 1
1 240 . 1 1 1 A 24 24 ARG N N 24 127.152 123.344 3.808 1
1 242 . 1 1 1 A 25 25 LYS H H 25 8.633 9.030 -0.397 1
1 243 . 1 1 1 A 25 25 LYS HA H 25 4.513 4.531 -0.018 1
1 251 . 1 1 1 A 25 25 LYS C C 25 173.567 174.377 -0.810 1
1 252 . 1 1 1 A 25 25 LYS CA C 25 54.792 54.653 0.139 1
1 253 . 1 1 1 A 25 25 LYS CB C 25 37.416 33.862 3.554 1
1 257 . 1 1 1 A 25 25 LYS N N 25 122.682 125.332 -2.650 1
1 258 . 1 1 1 A 26 26 ARG H H 26 8.303 8.793 -0.490 1
1 259 . 1 1 1 A 26 26 ARG HA H 26 5.153 4.997 0.156 1
1 266 . 1 1 1 A 26 26 ARG C C 26 174.554 174.890 -0.336 1
1 267 . 1 1 1 A 26 26 ARG CA C 26 55.083 54.718 0.365 1
1 268 . 1 1 1 A 26 26 ARG CB C 26 32.789 31.922 0.867 1
1 271 . 1 1 1 A 26 26 ARG N N 26 121.819 125.442 -3.623 1
1 272 . 1 1 1 A 27 27 HIS H H 27 8.793 8.854 -0.061 1
1 273 . 1 1 1 A 27 27 HIS HA H 27 5.155 5.593 -0.438 1
1 278 . 1 1 1 A 27 27 HIS CA C 27 56.904 54.985 1.919 1
1 279 . 1 1 1 A 27 27 HIS CB C 27 34.683 31.458 3.225 1
1 282 . 1 1 1 A 27 27 HIS N N 27 122.102 120.775 1.327 1
1 283 . 1 1 1 A 28 28 TYR H H 28 9.273 8.454 0.819 1
1 284 . 1 1 1 A 28 28 TYR HA H 28 4.332 4.330 0.002 1
1 291 . 1 1 1 A 28 28 TYR C C 28 174.730 174.759 -0.029 1
1 292 . 1 1 1 A 28 28 TYR CA C 28 58.680 57.234 1.446 1
1 293 . 1 1 1 A 28 28 TYR CB C 28 38.673 37.910 0.763 1
1 298 . 1 1 1 A 28 28 TYR N N 28 125.605 121.287 4.318 1
1 299 . 1 1 1 A 29 29 TRP H H 29 9.273 8.705 0.568 1
1 300 . 1 1 1 A 29 29 TRP HA H 29 5.543 4.876 0.667 1
1 309 . 1 1 1 A 29 29 TRP C C 29 176.172 176.848 -0.676 1
1 310 . 1 1 1 A 29 29 TRP CA C 29 56.658 58.091 -1.433 1
1 311 . 1 1 1 A 29 29 TRP CB C 29 32.154 30.297 1.857 1
1 317 . 1 1 1 A 29 29 TRP N N 29 131.340 128.397 2.943 1
1 318 . 1 1 1 A 30 30 ARG H H 30 9.164 9.367 -0.203 1
1 319 . 1 1 1 A 30 30 ARG HA H 30 5.302 5.172 0.130 1
1 327 . 1 1 1 A 30 30 ARG C C 30 174.774 174.445 0.329 1
1 328 . 1 1 1 A 30 30 ARG CA C 30 56.271 54.997 1.274 1
1 329 . 1 1 1 A 30 30 ARG CB C 30 34.203 32.730 1.473 1
1 332 . 1 1 1 A 30 30 ARG N N 30 116.040 122.902 -6.862 1
1 334 . 1 1 1 A 31 31 LEU H H 31 9.273 9.334 -0.061 1
1 335 . 1 1 1 A 31 31 LEU HA H 31 5.324 5.328 -0.004 1
1 345 . 1 1 1 A 31 31 LEU C C 31 174.488 174.701 -0.213 1
1 346 . 1 1 1 A 31 31 LEU CA C 31 53.807 53.357 0.450 1
1 347 . 1 1 1 A 31 31 LEU CB C 31 46.667 45.645 1.022 1
1 351 . 1 1 1 A 31 31 LEU N N 31 127.075 127.510 -0.435 1
1 352 . 1 1 1 A 32 32 ASP H H 32 8.854 8.813 0.041 1
1 353 . 1 1 1 A 32 32 ASP HA H 32 4.902 5.082 -0.180 1
1 356 . 1 1 1 A 32 32 ASP C C 32 173.474 176.388 -2.914 1
1 357 . 1 1 1 A 32 32 ASP CA C 32 53.104 52.342 0.762 1
1 358 . 1 1 1 A 32 32 ASP CB C 32 42.931 44.659 -1.728 1
1 359 . 1 1 1 A 32 32 ASP N N 32 129.349 125.340 4.009 1
1 360 . 1 1 1 A 33 33 CYS H H 33 8.153 8.856 -0.703 1
1 361 . 1 1 1 A 33 33 CYS HA H 33 4.323 4.352 -0.029 1
1 364 . 1 1 1 A 33 33 CYS C C 33 174.476 174.372 0.104 1
1 365 . 1 1 1 A 33 33 CYS CA C 33 59.853 59.803 0.050 1
1 366 . 1 1 1 A 33 33 CYS CB C 33 27.508 26.937 0.571 1
1 367 . 1 1 1 A 33 33 CYS N N 33 108.439 119.219 -10.780 1
1 368 . 1 1 1 A 34 34 LYS H H 34 9.144 7.748 1.396 1
1 369 . 1 1 1 A 34 34 LYS HA H 34 4.616 4.444 0.172 1
1 378 . 1 1 1 A 34 34 LYS C C 34 177.601 176.241 1.360 1
1 379 . 1 1 1 A 34 34 LYS CA C 34 57.185 56.817 0.368 1
1 380 . 1 1 1 A 34 34 LYS CB C 34 35.623 35.222 0.401 1
1 384 . 1 1 1 A 34 34 LYS N N 34 119.884 118.201 1.683 1
1 385 . 1 1 1 A 35 35 CYS H H 35 9.102 7.653 1.449 1
1 386 . 1 1 1 A 35 35 CYS HA H 35 4.935 4.765 0.170 1
1 389 . 1 1 1 A 35 35 CYS C C 35 172.283 172.517 -0.234 1
1 390 . 1 1 1 A 35 35 CYS CA C 35 57.748 58.143 -0.395 1
1 391 . 1 1 1 A 35 35 CYS CB C 35 31.537 32.339 -0.802 1
1 392 . 1 1 1 A 35 35 CYS N N 35 120.317 114.587 5.730 1
1 393 . 1 1 1 A 36 36 ILE H H 36 8.213 8.957 -0.744 1
1 394 . 1 1 1 A 36 36 ILE HA H 36 4.617 4.822 -0.205 1
1 404 . 1 1 1 A 36 36 ILE C C 36 175.312 176.229 -0.917 1
1 405 . 1 1 1 A 36 36 ILE CA C 36 60.967 60.318 0.649 1
1 406 . 1 1 1 A 36 36 ILE CB C 36 39.718 38.787 0.931 1
1 410 . 1 1 1 A 36 36 ILE N N 36 121.905 121.555 0.350 1
1 411 . 1 1 1 A 37 37 THR H H 37 9.076 8.651 0.425 1
1 412 . 1 1 1 A 37 37 THR HA H 37 4.364 4.437 -0.073 1
1 417 . 1 1 1 A 37 37 THR CA C 37 61.834 61.589 0.245 1
1 418 . 1 1 1 A 37 37 THR CB C 37 69.237 70.169 -0.932 1
1 420 . 1 1 1 A 37 37 THR N N 37 122.500 120.413 2.087 1
1 421 . 1 1 1 A 38 38 LEU H H 38 8.263 8.478 -0.215 1
1 422 . 1 1 1 A 38 38 LEU HA H 38 4.445 4.958 -0.513 1
1 432 . 1 1 1 A 38 38 LEU CA C 38 55.611 53.611 2.000 1
1 433 . 1 1 1 A 38 38 LEU CB C 38 42.702 44.914 -2.212 1
1 437 . 1 1 1 A 38 38 LEU N N 38 126.987 122.198 4.789 1
1 438 . 1 1 1 A 39 39 PHE H H 39 9.520 9.263 0.257 1
1 439 . 1 1 1 A 39 39 PHE HA H 39 4.998 5.084 -0.086 1
1 447 . 1 1 1 A 39 39 PHE CA C 39 57.331 56.544 0.787 1
1 448 . 1 1 1 A 39 39 PHE CB C 39 42.453 38.855 3.598 1
1 454 . 1 1 1 A 39 39 PHE N N 39 120.545 124.141 -3.596 1
1 455 . 1 1 1 A 40 40 GLN H H 40 9.878 8.887 0.991 1
1 456 . 1 1 1 A 40 40 GLN HA H 40 4.376 4.220 0.156 1
1 463 . 1 1 1 A 40 40 GLN CA C 40 59.513 58.703 0.810 1
1 464 . 1 1 1 A 40 40 GLN CB C 40 29.317 28.824 0.493 1
1 467 . 1 1 1 A 41 41 ASN H H 41 7.732 8.058 -0.326 1
1 468 . 1 1 1 A 41 41 ASN HA H 41 4.812 5.635 -0.823 1
1 473 . 1 1 1 A 41 41 ASN CA C 41 52.618 51.838 0.780 1
1 474 . 1 1 1 A 41 41 ASN CB C 41 39.362 42.837 -3.475 1
1 475 . 1 1 1 A 41 41 ASN N N 41 107.613 114.378 -6.765 1
1 477 . 1 1 1 A 42 42 ASN HA H 42 3.476 4.263 -0.787 1
1 482 . 1 1 1 A 42 42 ASN C C 42 173.607 177.751 -4.144 1
1 483 . 1 1 1 A 42 42 ASN CA C 42 54.888 55.813 -0.925 1
1 484 . 1 1 1 A 42 42 ASN CB C 42 35.613 38.452 -2.839 1
1 486 . 1 1 1 A 43 43 THR H H 43 8.394 7.694 0.700 1
1 487 . 1 1 1 A 43 43 THR HA H 43 4.403 4.139 0.264 1
1 492 . 1 1 1 A 43 43 THR C C 43 174.464 174.928 -0.464 1
1 493 . 1 1 1 A 43 43 THR CA C 43 61.978 65.548 -3.570 1
1 494 . 1 1 1 A 43 43 THR CB C 43 70.036 68.427 1.609 1
1 496 . 1 1 1 A 43 43 THR N N 43 111.795 110.657 1.138 1
1 497 . 1 1 1 A 44 44 THR H H 44 8.058 7.633 0.425 1
1 498 . 1 1 1 A 44 44 THR HA H 44 4.464 4.311 0.153 1
1 503 . 1 1 1 A 44 44 THR CA C 44 61.599 62.562 -0.963 1
1 504 . 1 1 1 A 44 44 THR CB C 44 69.137 69.589 -0.452 1
1 506 . 1 1 1 A 44 44 THR N N 44 116.514 116.675 -0.161 1
1 507 . 1 1 1 A 45 45 ASN H H 45 6.653 8.917 -2.264 1
1 508 . 1 1 1 A 45 45 ASN HA H 45 4.945 4.855 0.090 1
1 513 . 1 1 1 A 45 45 ASN CA C 45 53.227 54.755 -1.528 1
1 514 . 1 1 1 A 45 45 ASN CB C 45 38.483 39.941 -1.458 1
1 516 . 1 1 1 A 46 46 ARG H H 46 8.213 7.615 0.598 1
1 517 . 1 1 1 A 46 46 ARG HA H 46 4.583 4.750 -0.167 1
1 524 . 1 1 1 A 46 46 ARG CA C 46 55.487 54.761 0.726 1
1 525 . 1 1 1 A 46 46 ARG CB C 46 31.153 31.478 -0.325 1
1 528 . 1 1 1 A 46 46 ARG N N 46 121.652 115.653 5.999 1
1 529 . 1 1 1 A 47 47 TYR H H 47 7.973 8.520 -0.547 1
1 536 . 1 1 1 A 47 47 TYR CB C 47 39.356 40.778 -1.422 1
1 541 . 1 1 1 A 48 48 TYR H H 48 9.023 8.966 0.057 1
1 542 . 1 1 1 A 48 48 TYR HA H 48 4.662 3.883 0.779 1
1 549 . 1 1 1 A 48 48 TYR CB C 48 39.863 39.463 0.400 1
1 554 . 1 1 1 A 48 48 TYR N N 48 121.223 121.561 -0.338 1
1 555 . 1 1 1 A 49 49 LYS H H 49 7.134 7.422 -0.288 1
1 556 . 1 1 1 A 49 49 LYS HA H 49 4.283 4.549 -0.266 1
1 565 . 1 1 1 A 49 49 LYS CA C 49 55.167 54.657 0.510 1
1 566 . 1 1 1 A 49 49 LYS CB C 49 36.699 35.851 0.848 1
1 570 . 1 1 1 A 49 49 LYS N N 49 117.339 114.420 2.919 1
1 571 . 1 1 1 A 50 50 GLU H H 50 8.411 8.882 -0.471 1
1 572 . 1 1 1 A 50 50 GLU HA H 50 4.583 5.198 -0.615 1
1 577 . 1 1 1 A 50 50 GLU CA C 50 54.592 54.720 -0.128 1
1 578 . 1 1 1 A 50 50 GLU CB C 50 33.263 33.215 0.048 1
1 580 . 1 1 1 A 50 50 GLU N N 50 123.825 120.000 3.825 1
1 581 . 1 1 1 A 51 51 ILE H H 51 9.225 8.912 0.313 1
1 582 . 1 1 1 A 51 51 ILE HA H 51 4.277 4.614 -0.337 1
1 592 . 1 1 1 A 51 51 ILE CA C 51 58.182 58.230 -0.048 1
1 593 . 1 1 1 A 51 51 ILE CB C 51 39.663 38.473 1.190 1
1 597 . 1 1 1 A 51 51 ILE N N 51 125.271 126.736 -1.465 1
1 598 . 1 1 1 A 52 52 PRO HA H 52 4.543 4.617 -0.074 1
1 605 . 1 1 1 A 52 52 PRO C C 52 178.340 178.028 0.312 1
1 606 . 1 1 1 A 52 52 PRO CA C 52 62.726 62.891 -0.165 1
1 607 . 1 1 1 A 52 52 PRO CB C 52 32.003 31.732 0.271 1
1 610 . 1 1 1 A 53 53 LEU H H 53 8.723 8.513 0.210 1
1 611 . 1 1 1 A 53 53 LEU HA H 53 3.891 3.881 0.010 1
1 621 . 1 1 1 A 53 53 LEU C C 53 179.673 179.059 0.614 1
1 622 . 1 1 1 A 53 53 LEU CA C 53 58.205 57.583 0.622 1
1 623 . 1 1 1 A 53 53 LEU CB C 53 40.171 41.458 -1.287 1
1 627 . 1 1 1 A 53 53 LEU N N 53 125.150 124.313 0.837 1
1 628 . 1 1 1 A 54 54 SER H H 54 8.360 8.126 0.234 1
1 629 . 1 1 1 A 54 54 SER HA H 54 4.164 4.096 0.068 1
1 632 . 1 1 1 A 54 54 SER C C 54 175.517 177.279 -1.762 1
1 633 . 1 1 1 A 54 54 SER CA C 54 60.193 61.428 -1.235 1
1 634 . 1 1 1 A 54 54 SER CB C 54 62.617 62.818 -0.201 1
1 635 . 1 1 1 A 54 54 SER N N 54 111.266 114.517 -3.251 1
1 636 . 1 1 1 A 55 55 GLU H H 55 7.666 8.334 -0.668 1
1 637 . 1 1 1 A 55 55 GLU HA H 55 4.363 4.075 0.288 1
1 642 . 1 1 1 A 55 55 GLU C C 55 176.753 177.947 -1.194 1
1 643 . 1 1 1 A 55 55 GLU CA C 55 56.200 59.049 -2.849 1
1 644 . 1 1 1 A 55 55 GLU CB C 55 30.526 29.221 1.305 1
1 646 . 1 1 1 A 55 55 GLU N N 55 119.485 120.049 -0.564 1
1 647 . 1 1 1 A 56 56 ILE H H 56 7.601 7.498 0.103 1
1 648 . 1 1 1 A 56 56 ILE HA H 56 3.793 3.931 -0.138 1
1 658 . 1 1 1 A 56 56 ILE C C 56 175.142 176.034 -0.892 1
1 659 . 1 1 1 A 56 56 ILE CA C 56 63.518 62.304 1.214 1
1 660 . 1 1 1 A 56 56 ILE CB C 56 37.169 37.944 -0.775 1
1 664 . 1 1 1 A 56 56 ILE N N 56 120.430 120.118 0.312 1
1 665 . 1 1 1 A 57 57 LEU H H 57 9.263 9.238 0.025 1
1 666 . 1 1 1 A 57 57 LEU HA H 57 4.343 4.398 -0.055 1
1 676 . 1 1 1 A 57 57 LEU C C 57 177.898 176.528 1.370 1
1 677 . 1 1 1 A 57 57 LEU CA C 57 56.569 55.754 0.815 1
1 678 . 1 1 1 A 57 57 LEU CB C 57 41.980 42.874 -0.894 1
1 682 . 1 1 1 A 57 57 LEU N N 57 129.464 128.893 0.571 1
1 683 . 1 1 1 A 58 58 THR H H 58 7.414 7.289 0.125 1
1 684 . 1 1 1 A 58 58 THR HA H 58 4.512 4.848 -0.336 1
1 689 . 1 1 1 A 58 58 THR C C 58 171.314 172.724 -1.410 1
1 690 . 1 1 1 A 58 58 THR CA C 58 60.562 61.236 -0.674 1
1 691 . 1 1 1 A 58 58 THR CB C 58 70.803 73.384 -2.581 1
1 693 . 1 1 1 A 58 58 THR N N 58 109.129 110.754 -1.625 1
1 694 . 1 1 1 A 59 59 VAL H H 59 8.152 8.490 -0.338 1
1 695 . 1 1 1 A 59 59 VAL HA H 59 5.061 5.036 0.025 1
1 703 . 1 1 1 A 59 59 VAL C C 59 174.985 174.956 0.029 1
1 704 . 1 1 1 A 59 59 VAL CA C 59 61.354 61.208 0.146 1
1 705 . 1 1 1 A 59 59 VAL CB C 59 33.855 34.067 -0.212 1
1 708 . 1 1 1 A 59 59 VAL N N 59 123.676 124.678 -1.002 1
1 709 . 1 1 1 A 60 60 GLU H H 60 9.074 8.675 0.399 1
1 710 . 1 1 1 A 60 60 GLU HA H 60 4.977 4.864 0.113 1
1 715 . 1 1 1 A 60 60 GLU C C 60 176.063 175.421 0.642 1
1 716 . 1 1 1 A 60 60 GLU CA C 60 53.807 54.381 -0.574 1
1 717 . 1 1 1 A 60 60 GLU CB C 60 33.739 33.426 0.313 1
1 719 . 1 1 1 A 60 60 GLU N N 60 125.125 125.930 -0.805 1
1 720 . 1 1 1 A 61 61 SER H H 61 8.763 8.633 0.130 1
1 721 . 1 1 1 A 61 61 SER HA H 61 4.452 4.948 -0.496 1
1 724 . 1 1 1 A 61 61 SER C C 61 173.288 174.460 -1.172 1
1 725 . 1 1 1 A 61 61 SER CA C 61 59.384 56.931 2.453 1
1 726 . 1 1 1 A 61 61 SER CB C 61 63.390 65.075 -1.685 1
1 727 . 1 1 1 A 61 61 SER N N 61 117.523 114.977 2.546 1
1 728 . 1 1 1 A 62 62 ALA H H 62 7.293 8.683 -1.390 1
1 729 . 1 1 1 A 62 62 ALA HA H 62 3.817 4.360 -0.543 1
1 733 . 1 1 1 A 62 62 ALA C C 62 176.717 177.854 -1.137 1
1 734 . 1 1 1 A 62 62 ALA CA C 62 53.966 53.107 0.859 1
1 735 . 1 1 1 A 62 62 ALA CB C 62 18.640 18.710 -0.070 1
1 736 . 1 1 1 A 62 62 ALA N N 62 122.650 125.927 -3.277 1
1 737 . 1 1 1 A 63 63 GLN H H 63 8.736 8.549 0.187 1
1 738 . 1 1 1 A 63 63 GLN HA H 63 4.445 4.737 -0.292 1
1 745 . 1 1 1 A 63 63 GLN C C 63 173.700 175.336 -1.636 1
1 746 . 1 1 1 A 63 63 GLN CA C 63 56.376 55.795 0.581 1
1 747 . 1 1 1 A 63 63 GLN CB C 63 31.515 31.004 0.511 1
1 749 . 1 1 1 A 63 63 GLN N N 63 120.251 119.651 0.600 1
1 751 . 1 1 1 A 64 64 ASN H H 64 9.272 7.756 1.516 1
1 752 . 1 1 1 A 64 64 ASN HA H 64 4.906 5.093 -0.187 1
1 757 . 1 1 1 A 64 64 ASN C C 64 174.754 175.032 -0.278 1
1 758 . 1 1 1 A 64 64 ASN CA C 64 51.837 52.270 -0.433 1
1 759 . 1 1 1 A 64 64 ASN CB C 64 38.156 40.203 -2.047 1
1 760 . 1 1 1 A 64 64 ASN N N 64 122.346 118.674 3.672 1
1 762 . 1 1 1 A 65 65 PHE H H 65 8.854 9.214 -0.360 1
1 763 . 1 1 1 A 65 65 PHE HA H 65 4.947 5.146 -0.199 1
1 771 . 1 1 1 A 65 65 PHE C C 65 177.274 176.243 1.031 1
1 772 . 1 1 1 A 65 65 PHE CA C 65 57.519 56.876 0.643 1
1 773 . 1 1 1 A 65 65 PHE CB C 65 38.485 38.678 -0.193 1
1 779 . 1 1 1 A 65 65 PHE N N 65 123.638 125.510 -1.872 1
1 780 . 1 1 1 A 66 66 SER H H 66 8.163 8.010 0.153 1
1 781 . 1 1 1 A 66 66 SER HA H 66 4.393 4.553 -0.160 1
1 784 . 1 1 1 A 66 66 SER C C 66 175.699 176.033 -0.334 1
1 785 . 1 1 1 A 66 66 SER CA C 66 60.791 61.086 -0.295 1
1 786 . 1 1 1 A 66 66 SER CB C 66 64.591 63.534 1.057 1
1 787 . 1 1 1 A 66 66 SER N N 66 113.913 116.544 -2.631 1
1 788 . 1 1 1 A 67 67 LEU H H 67 8.574 7.832 0.742 1
1 789 . 1 1 1 A 67 67 LEU HA H 67 4.302 3.765 0.537 1
1 799 . 1 1 1 A 67 67 LEU C C 67 176.269 177.321 -1.052 1
1 800 . 1 1 1 A 67 67 LEU CA C 67 55.601 58.189 -2.588 1
1 801 . 1 1 1 A 67 67 LEU CB C 67 42.021 41.896 0.125 1
1 805 . 1 1 1 A 67 67 LEU N N 67 121.264 119.874 1.390 1
1 806 . 1 1 1 A 68 68 VAL H H 68 6.921 7.538 -0.617 1
1 807 . 1 1 1 A 68 68 VAL HA H 68 4.473 4.131 0.342 1
1 815 . 1 1 1 A 68 68 VAL C C 68 173.809 174.940 -1.131 1
1 816 . 1 1 1 A 68 68 VAL CA C 68 58.047 60.736 -2.689 1
1 817 . 1 1 1 A 68 68 VAL CB C 68 32.295 31.737 0.558 1
1 820 . 1 1 1 A 68 68 VAL N N 68 111.287 115.659 -4.372 1
1 821 . 1 1 1 A 69 69 PRO HA H 69 4.658 4.632 0.026 1
1 828 . 1 1 1 A 69 69 PRO CA C 69 61.747 61.654 0.093 1
1 829 . 1 1 1 A 69 69 PRO CB C 69 30.693 32.445 -1.752 1
1 832 . 1 1 1 A 70 70 PRO HA H 70 4.414 4.359 0.055 1
1 839 . 1 1 1 A 70 70 PRO CA C 70 63.997 64.210 -0.213 1
1 840 . 1 1 1 A 70 70 PRO CB C 70 31.602 31.552 0.050 1
1 843 . 1 1 1 A 71 71 GLY H H 71 8.824 8.184 0.640 1
1 844 . 1 1 1 A 71 71 GLY HA2 H 71 3.703 4.024 -0.321 1
1 845 . 1 1 1 A 71 71 GLY HA3 H 71 4.193 4.025 0.168 1
1 846 . 1 1 1 A 71 71 GLY C C 71 174.052 172.985 1.067 1
1 847 . 1 1 1 A 71 71 GLY CA C 71 45.065 45.554 -0.489 1
1 848 . 1 1 1 A 71 71 GLY N N 71 111.845 106.194 5.651 1
1 849 . 1 1 1 A 72 72 THR H H 72 7.597 7.143 0.454 1
1 850 . 1 1 1 A 72 72 THR HA H 72 4.133 4.667 -0.534 1
1 855 . 1 1 1 A 72 72 THR CA C 72 63.129 60.959 2.170 1
1 856 . 1 1 1 A 72 72 THR CB C 72 69.560 71.726 -2.166 1
1 858 . 1 1 1 A 72 72 THR N N 72 117.485 114.438 3.047 1
1 859 . 1 1 1 A 73 73 ASN H H 73 9.280 8.511 0.769 1
1 860 . 1 1 1 A 73 73 ASN HA H 73 4.786 4.638 0.148 1
1 865 . 1 1 1 A 73 73 ASN CA C 73 52.009 52.248 -0.239 1
1 866 . 1 1 1 A 73 73 ASN CB C 73 37.553 38.357 -0.804 1
1 867 . 1 1 1 A 73 73 ASN N N 73 127.641 126.085 1.556 1
1 869 . 1 1 1 A 74 74 PRO HA H 74 4.752 4.815 -0.063 1
1 876 . 1 1 1 A 74 74 PRO C C 74 175.190 176.441 -1.251 1
1 877 . 1 1 1 A 74 74 PRO CA C 74 63.395 62.512 0.883 1
1 878 . 1 1 1 A 74 74 PRO CB C 74 33.164 33.470 -0.306 1
1 881 . 1 1 1 A 75 75 HIS H H 75 8.025 8.775 -0.750 1
1 882 . 1 1 1 A 75 75 HIS HA H 75 5.047 5.107 -0.060 1
1 887 . 1 1 1 A 75 75 HIS C C 75 172.562 175.642 -3.080 1
1 888 . 1 1 1 A 75 75 HIS CA C 75 54.336 53.499 0.837 1
1 889 . 1 1 1 A 75 75 HIS CB C 75 30.956 33.466 -2.510 1
1 892 . 1 1 1 A 75 75 HIS N N 75 116.198 116.600 -0.402 1
1 893 . 1 1 1 A 76 76 CYS H H 76 8.343 9.400 -1.057 1
1 894 . 1 1 1 A 76 76 CYS HA H 76 4.594 4.420 0.174 1
1 897 . 1 1 1 A 76 76 CYS C C 76 175.651 174.813 0.838 1
1 898 . 1 1 1 A 76 76 CYS CA C 76 61.066 61.163 -0.097 1
1 899 . 1 1 1 A 76 76 CYS CB C 76 30.193 28.640 1.553 1
1 900 . 1 1 1 A 76 76 CYS N N 76 113.289 118.022 -4.733 1
1 901 . 1 1 1 A 77 77 PHE H H 77 8.433 8.006 0.427 1
1 902 . 1 1 1 A 77 77 PHE HA H 77 5.105 5.353 -0.248 1
1 910 . 1 1 1 A 77 77 PHE C C 77 171.822 172.985 -1.163 1
1 911 . 1 1 1 A 77 77 PHE CA C 77 56.874 55.685 1.189 1
1 912 . 1 1 1 A 77 77 PHE CB C 77 39.393 43.005 -3.612 1
1 918 . 1 1 1 A 77 77 PHE N N 77 114.874 114.721 0.153 1
1 919 . 1 1 1 A 78 78 GLU H H 78 9.823 9.200 0.623 1
1 920 . 1 1 1 A 78 78 GLU HA H 78 5.333 5.290 0.043 1
1 925 . 1 1 1 A 78 78 GLU C C 78 175.602 175.584 0.018 1
1 926 . 1 1 1 A 78 78 GLU CA C 78 54.212 54.664 -0.452 1
1 927 . 1 1 1 A 78 78 GLU CB C 78 31.702 32.653 -0.951 1
1 929 . 1 1 1 A 78 78 GLU N N 78 121.074 119.017 2.057 1
1 930 . 1 1 1 A 79 79 ILE H H 79 9.093 9.023 0.070 1
1 931 . 1 1 1 A 79 79 ILE HA H 79 4.637 4.558 0.079 1
1 941 . 1 1 1 A 79 79 ILE C C 79 174.476 175.216 -0.740 1
1 942 . 1 1 1 A 79 79 ILE CA C 79 60.932 60.636 0.296 1
1 943 . 1 1 1 A 79 79 ILE CB C 79 40.803 37.488 3.315 1
1 947 . 1 1 1 A 79 79 ILE N N 79 121.382 124.579 -3.197 1
1 948 . 1 1 1 A 80 80 VAL H H 80 8.841 7.892 0.949 1
1 949 . 1 1 1 A 80 80 VAL HA H 80 4.425 3.870 0.555 1
1 957 . 1 1 1 A 80 80 VAL C C 80 175.930 175.503 0.427 1
1 958 . 1 1 1 A 80 80 VAL CA C 80 63.324 63.348 -0.024 1
1 959 . 1 1 1 A 80 80 VAL CB C 80 32.783 31.359 1.424 1
1 962 . 1 1 1 A 80 80 VAL N N 80 128.970 127.188 1.782 1
1 963 . 1 1 1 A 81 81 THR H H 81 8.303 7.884 0.419 1
1 964 . 1 1 1 A 81 81 THR HA H 81 5.264 4.734 0.530 1
1 969 . 1 1 1 A 81 81 THR C C 81 173.664 174.349 -0.685 1
1 970 . 1 1 1 A 81 81 THR CA C 81 59.540 59.905 -0.365 1
1 971 . 1 1 1 A 81 81 THR CB C 81 72.197 70.950 1.247 1
1 973 . 1 1 1 A 81 81 THR N N 81 118.077 118.315 -0.238 1
1 974 . 1 1 1 A 82 82 ALA H H 82 9.586 8.470 1.116 1
1 975 . 1 1 1 A 82 82 ALA HA H 82 4.093 4.479 -0.386 1
1 979 . 1 1 1 A 82 82 ALA C C 82 178.667 177.678 0.989 1
1 980 . 1 1 1 A 82 82 ALA CA C 82 55.321 52.554 2.767 1
1 981 . 1 1 1 A 82 82 ALA CB C 82 18.094 18.769 -0.675 1
1 982 . 1 1 1 A 82 82 ALA N N 82 122.493 123.063 -0.570 1
1 983 . 1 1 1 A 83 83 ASN H H 83 7.923 8.443 -0.520 1
1 984 . 1 1 1 A 83 83 ASN HA H 83 4.808 5.103 -0.295 1
1 989 . 1 1 1 A 83 83 ASN C C 83 174.766 174.503 0.263 1
1 990 . 1 1 1 A 83 83 ASN CA C 83 53.333 54.754 -1.421 1
1 991 . 1 1 1 A 83 83 ASN CB C 83 40.335 41.825 -1.490 1
1 992 . 1 1 1 A 83 83 ASN N N 83 110.765 116.042 -5.277 1
1 994 . 1 1 1 A 84 84 ALA H H 84 7.352 7.165 0.187 1
1 995 . 1 1 1 A 84 84 ALA HA H 84 4.625 4.513 0.112 1
1 999 . 1 1 1 A 84 84 ALA C C 84 176.547 175.096 1.451 1
1 1000 . 1 1 1 A 84 84 ALA CA C 84 52.858 51.842 1.016 1
1 1001 . 1 1 1 A 84 84 ALA CB C 84 21.233 22.114 -0.881 1
1 1002 . 1 1 1 A 84 84 ALA N N 84 119.599 117.725 1.874 1
1 1003 . 1 1 1 A 85 85 THR H H 85 8.374 8.626 -0.252 1
1 1004 . 1 1 1 A 85 85 THR HA H 85 5.014 4.544 0.470 1
1 1009 . 1 1 1 A 85 85 THR C C 85 171.568 174.034 -2.466 1
1 1010 . 1 1 1 A 85 85 THR CA C 85 61.618 62.367 -0.749 1
1 1011 . 1 1 1 A 85 85 THR CB C 85 70.850 69.439 1.411 1
1 1013 . 1 1 1 A 85 85 THR N N 85 119.032 113.777 5.255 1
1 1014 . 1 1 1 A 86 86 TYR H H 86 9.006 8.986 0.020 1
1 1015 . 1 1 1 A 86 86 TYR HA H 86 4.658 4.849 -0.191 1
1 1022 . 1 1 1 A 86 86 TYR C C 86 173.773 175.349 -1.576 1
1 1023 . 1 1 1 A 86 86 TYR CA C 86 56.938 57.938 -1.000 1
1 1024 . 1 1 1 A 86 86 TYR CB C 86 39.513 39.973 -0.460 1
1 1029 . 1 1 1 A 86 86 TYR N N 86 123.494 127.184 -3.690 1
1 1030 . 1 1 1 A 87 87 PHE H H 87 9.263 8.798 0.465 1
1 1031 . 1 1 1 A 87 87 PHE HA H 87 4.127 4.664 -0.537 1
1 1039 . 1 1 1 A 87 87 PHE C C 87 176.369 173.948 2.421 1
1 1040 . 1 1 1 A 87 87 PHE CA C 87 57.238 55.782 1.456 1
1 1041 . 1 1 1 A 87 87 PHE CB C 87 37.086 38.395 -1.309 1
1 1047 . 1 1 1 A 87 87 PHE N N 87 125.384 119.906 5.478 1
1 1048 . 1 1 1 A 88 88 VAL H H 88 9.023 8.433 0.590 1
1 1049 . 1 1 1 A 88 88 VAL HA H 88 4.162 4.740 -0.578 1
1 1057 . 1 1 1 A 88 88 VAL C C 88 176.390 175.846 0.544 1
1 1058 . 1 1 1 A 88 88 VAL CA C 88 63.975 60.575 3.400 1
1 1059 . 1 1 1 A 88 88 VAL CB C 88 32.378 32.326 0.052 1
1 1062 . 1 1 1 A 88 88 VAL N N 88 127.348 124.903 2.445 1
1 1063 . 1 1 1 A 89 89 GLY H H 89 9.233 7.728 1.505 1
1 1064 . 1 1 1 A 89 89 GLY HA2 H 89 4.293 4.150 0.143 1
1 1065 . 1 1 1 A 89 89 GLY HA3 H 89 4.186 4.218 -0.032 1
1 1066 . 1 1 1 A 89 89 GLY C C 89 172.378 172.057 0.321 1
1 1067 . 1 1 1 A 89 89 GLY CA C 89 43.798 46.197 -2.399 1
1 1068 . 1 1 1 A 89 89 GLY N N 89 116.041 112.667 3.374 1
1 1069 . 1 1 1 A 90 90 GLU H H 90 8.532 8.620 -0.088 1
1 1070 . 1 1 1 A 90 90 GLU HA H 90 4.794 4.431 0.363 1
1 1075 . 1 1 1 A 90 90 GLU C C 90 174.221 176.054 -1.833 1
1 1076 . 1 1 1 A 90 90 GLU CA C 90 56.393 55.590 0.803 1
1 1077 . 1 1 1 A 90 90 GLU CB C 90 33.182 30.748 2.434 1
1 1079 . 1 1 1 A 90 90 GLU N N 90 120.905 120.353 0.552 1
1 1080 . 1 1 1 A 91 91 MET H H 91 8.450 8.495 -0.045 1
1 1081 . 1 1 1 A 91 91 MET HA H 91 4.904 5.024 -0.120 1
1 1089 . 1 1 1 A 91 91 MET C C 91 173.373 174.190 -0.817 1
1 1090 . 1 1 1 A 91 91 MET CA C 91 52.277 53.153 -0.876 1
1 1091 . 1 1 1 A 91 91 MET CB C 91 32.789 33.978 -1.189 1
1 1094 . 1 1 1 A 91 91 MET N N 91 125.173 118.735 6.438 1
1 1095 . 1 1 1 A 92 92 PRO HA H 92 4.358 4.624 -0.266 1
1 1102 . 1 1 1 A 92 92 PRO C C 92 177.589 176.246 1.343 1
1 1103 . 1 1 1 A 92 92 PRO CA C 92 63.143 63.150 -0.007 1
1 1104 . 1 1 1 A 92 92 PRO CB C 92 32.083 31.120 0.963 1
1 1107 . 1 1 1 A 93 93 GLY H H 93 8.330 8.173 0.157 1
1 1108 . 1 1 1 A 93 93 GLY HA2 H 93 3.943 4.112 -0.169 1
1 1109 . 1 1 1 A 93 93 GLY HA3 H 93 4.045 4.113 -0.068 1
1 1110 . 1 1 1 A 93 93 GLY C C 93 174.730 173.006 1.724 1
1 1111 . 1 1 1 A 93 93 GLY CA C 93 45.276 45.623 -0.347 1
1 1112 . 1 1 1 A 93 93 GLY N N 93 109.420 109.460 -0.040 1
1 1113 . 1 1 1 A 94 94 GLY H H 94 8.331 8.863 -0.532 1
1 1114 . 1 1 1 A 94 94 GLY HA2 H 94 3.973 4.121 -0.148 1
1 1115 . 1 1 1 A 94 94 GLY HA3 H 94 3.973 4.123 -0.150 1
1 1116 . 1 1 1 A 94 94 GLY C C 94 174.100 172.696 1.404 1
1 1117 . 1 1 1 A 94 94 GLY CA C 94 45.333 45.224 0.109 1
1 1118 . 1 1 1 A 94 94 GLY N N 94 108.483 110.428 -1.945 1
1 1119 . 1 1 1 A 95 95 THR H H 95 8.095 8.681 -0.586 1
1 1120 . 1 1 1 A 95 95 THR HA H 95 4.643 4.997 -0.354 1
1 1125 . 1 1 1 A 95 95 THR C C 95 173.155 171.514 1.641 1
1 1126 . 1 1 1 A 95 95 THR CA C 95 59.922 58.522 1.400 1
1 1127 . 1 1 1 A 95 95 THR CB C 95 69.871 70.749 -0.878 1
1 1129 . 1 1 1 A 95 95 THR N N 95 115.860 114.452 1.408 1
1 1130 . 1 1 1 A 96 96 PRO HA H 96 4.400 4.198 0.202 1
1 1137 . 1 1 1 A 96 96 PRO C C 96 177.565 176.909 0.656 1
1 1138 . 1 1 1 A 96 96 PRO CA C 96 64.047 63.514 0.533 1
1 1139 . 1 1 1 A 96 96 PRO CB C 96 31.816 32.440 -0.624 1
1 1142 . 1 1 1 A 97 97 GLY H H 97 8.572 8.780 -0.208 1
1 1143 . 1 1 1 A 97 97 GLY HA2 H 97 4.007 4.171 -0.164 1
1 1144 . 1 1 1 A 97 97 GLY HA3 H 97 4.007 4.173 -0.166 1
1 1145 . 1 1 1 A 97 97 GLY C C 97 174.609 174.917 -0.308 1
1 1146 . 1 1 1 A 97 97 GLY CA C 97 45.276 44.508 0.768 1
1 1147 . 1 1 1 A 97 97 GLY N N 97 110.233 110.718 -0.485 1
1 1148 . 1 1 1 A 98 98 GLY H H 98 8.119 8.652 -0.533 1
1 1149 . 1 1 1 A 98 98 GLY HA2 H 98 4.086 3.821 0.265 1
1 1150 . 1 1 1 A 98 98 GLY HA3 H 98 4.200 3.822 0.378 1
1 1151 . 1 1 1 A 98 98 GLY CA C 98 44.876 47.043 -2.167 1
1 1152 . 1 1 1 A 98 98 GLY N N 98 108.845 113.675 -4.830 1
1 1153 . 1 1 1 A 99 99 PRO HA H 99 4.494 4.538 -0.044 1
1 1160 . 1 1 1 A 99 99 PRO C C 99 177.468 177.487 -0.019 1
1 1161 . 1 1 1 A 99 99 PRO CA C 99 63.500 62.668 0.832 1
1 1162 . 1 1 1 A 99 99 PRO CB C 99 32.013 32.318 -0.305 1
1 1165 . 1 1 1 A 100 100 SER H H 100 8.472 8.644 -0.172 1
1 1166 . 1 1 1 A 100 100 SER HA H 100 4.513 4.190 0.323 1
1 1169 . 1 1 1 A 100 100 SER C C 100 175.408 175.505 -0.097 1
1 1170 . 1 1 1 A 100 100 SER CA C 100 58.557 59.453 -0.896 1
1 1171 . 1 1 1 A 100 100 SER CB C 100 63.918 64.281 -0.363 1
1 1172 . 1 1 1 A 100 100 SER N N 100 116.038 119.105 -3.067 1
1 1173 . 1 1 1 A 101 101 GLY H H 101 8.427 8.762 -0.335 1
1 1174 . 1 1 1 A 101 101 GLY HA2 H 101 4.064 3.956 0.108 1
1 1175 . 1 1 1 A 101 101 GLY HA3 H 101 4.064 3.956 0.108 1
1 1176 . 1 1 1 A 101 101 GLY C C 101 174.730 173.465 1.265 1
1 1177 . 1 1 1 A 101 101 GLY CA C 101 45.575 46.475 -0.900 1
1 1178 . 1 1 1 A 101 101 GLY N N 101 110.558 111.527 -0.969 1
1 1179 . 1 1 1 A 102 102 GLN H H 102 8.416 7.689 0.727 1
1 1180 . 1 1 1 A 102 102 GLN HA H 102 4.383 4.850 -0.467 1
1 1187 . 1 1 1 A 102 102 GLN C C 102 177.346 174.170 3.176 1
1 1188 . 1 1 1 A 102 102 GLN CA C 102 57.080 55.419 1.661 1
1 1189 . 1 1 1 A 102 102 GLN CB C 102 29.235 32.081 -2.846 1
1 1191 . 1 1 1 A 102 102 GLN N N 102 120.112 118.669 1.443 1
1 1193 . 1 1 1 A 103 103 GLY H H 103 8.713 8.582 0.131 1
1 1194 . 1 1 1 A 103 103 GLY HA2 H 103 4.193 4.163 0.030 1
1 1195 . 1 1 1 A 103 103 GLY HA3 H 103 4.078 4.178 -0.100 1
1 1196 . 1 1 1 A 103 103 GLY C C 103 175.602 174.363 1.239 1
1 1197 . 1 1 1 A 103 103 GLY CA C 103 46.120 45.399 0.721 1
1 1198 . 1 1 1 A 103 103 GLY N N 103 109.817 112.725 -2.908 1
1 1199 . 1 1 1 A 104 104 ALA H H 104 8.366 7.628 0.738 1
1 1200 . 1 1 1 A 104 104 ALA HA H 104 4.449 4.658 -0.209 1
1 1204 . 1 1 1 A 104 104 ALA C C 104 179.188 178.256 0.932 1
1 1205 . 1 1 1 A 104 104 ALA CA C 104 54.230 53.100 1.130 1
1 1206 . 1 1 1 A 104 104 ALA CB C 104 19.080 20.319 -1.239 1
1 1207 . 1 1 1 A 104 104 ALA N N 104 124.808 119.983 4.825 1
1 1208 . 1 1 1 A 105 105 GLU H H 105 8.576 8.806 -0.230 1
1 1209 . 1 1 1 A 105 105 GLU HA H 105 4.161 4.090 0.071 1
1 1214 . 1 1 1 A 105 105 GLU C C 105 179.200 179.121 0.079 1
1 1215 . 1 1 1 A 105 105 GLU CA C 105 59.173 59.105 0.068 1
1 1216 . 1 1 1 A 105 105 GLU CB C 105 29.194 29.736 -0.542 1
1 1218 . 1 1 1 A 105 105 GLU N N 105 119.238 118.694 0.544 1
1 1219 . 1 1 1 A 106 106 ALA H H 106 8.381 8.283 0.098 1
1 1220 . 1 1 1 A 106 106 ALA HA H 106 4.283 4.128 0.155 1
1 1224 . 1 1 1 A 106 106 ALA C C 106 180.048 179.891 0.157 1
1 1225 . 1 1 1 A 106 106 ALA CA C 106 54.687 55.548 -0.861 1
1 1226 . 1 1 1 A 106 106 ALA CB C 106 18.341 18.886 -0.545 1
1 1227 . 1 1 1 A 106 106 ALA N N 106 123.327 123.369 -0.042 1
1 1228 . 1 1 1 A 107 107 ALA H H 107 8.123 8.305 -0.182 1
1 1229 . 1 1 1 A 107 107 ALA HA H 107 4.554 4.417 0.137 1
1 1233 . 1 1 1 A 107 107 ALA C C 107 179.757 179.929 -0.172 1
1 1234 . 1 1 1 A 107 107 ALA CA C 107 55.355 55.486 -0.131 1
1 1235 . 1 1 1 A 107 107 ALA CB C 107 18.939 18.269 0.670 1
1 1236 . 1 1 1 A 107 107 ALA N N 107 120.740 120.248 0.492 1
1 1237 . 1 1 1 A 108 108 ARG H H 108 8.403 7.725 0.678 1
1 1238 . 1 1 1 A 108 108 ARG HA H 108 4.254 4.043 0.211 1
1 1245 . 1 1 1 A 108 108 ARG C C 108 179.111 179.434 -0.323 1
1 1246 . 1 1 1 A 108 108 ARG CA C 108 59.015 59.253 -0.238 1
1 1247 . 1 1 1 A 108 108 ARG CB C 108 29.752 30.096 -0.344 1
1 1250 . 1 1 1 A 108 108 ARG N N 108 119.531 117.860 1.671 1
1 1251 . 1 1 1 A 109 109 GLY H H 109 8.182 8.758 -0.576 1
1 1252 . 1 1 1 A 109 109 GLY HA2 H 109 3.822 3.674 0.148 1
1 1253 . 1 1 1 A 109 109 GLY HA3 H 109 3.822 3.712 0.110 1
1 1254 . 1 1 1 A 109 109 GLY C C 109 177.020 176.594 0.426 1
1 1255 . 1 1 1 A 109 109 GLY CA C 109 46.718 47.444 -0.726 1
1 1256 . 1 1 1 A 109 109 GLY N N 109 107.331 107.855 -0.524 1
1 1257 . 1 1 1 A 110 110 TRP H H 110 7.925 7.829 0.096 1
1 1258 . 1 1 1 A 110 110 TRP HA H 110 3.963 4.494 -0.531 1
1 1267 . 1 1 1 A 110 110 TRP C C 110 176.691 178.302 -1.611 1
1 1268 . 1 1 1 A 110 110 TRP CA C 110 62.041 60.918 1.123 1
1 1269 . 1 1 1 A 110 110 TRP CB C 110 28.989 28.561 0.428 1
1 1275 . 1 1 1 A 110 110 TRP N N 110 122.304 121.732 0.572 1
1 1277 . 1 1 1 A 111 111 GLU H H 111 7.946 7.720 0.226 1
1 1278 . 1 1 1 A 111 111 GLU HA H 111 2.594 2.930 -0.336 1
1 1283 . 1 1 1 A 111 111 GLU C C 111 177.976 179.128 -1.152 1
1 1284 . 1 1 1 A 111 111 GLU CA C 111 60.193 59.022 1.171 1
1 1285 . 1 1 1 A 111 111 GLU CB C 111 29.277 29.218 0.059 1
1 1287 . 1 1 1 A 111 111 GLU N N 111 121.755 119.135 2.620 1
1 1288 . 1 1 1 A 112 112 THR H H 112 7.993 7.584 0.409 1
1 1289 . 1 1 1 A 112 112 THR HA H 112 3.722 3.834 -0.112 1
1 1294 . 1 1 1 A 112 112 THR C C 112 176.038 175.722 0.316 1
1 1295 . 1 1 1 A 112 112 THR CA C 112 66.104 66.478 -0.374 1
1 1296 . 1 1 1 A 112 112 THR CB C 112 68.885 68.825 0.060 1
1 1298 . 1 1 1 A 112 112 THR N N 112 112.247 116.441 -4.194 1
1 1299 . 1 1 1 A 113 113 ALA H H 113 7.742 8.467 -0.725 1
1 1300 . 1 1 1 A 113 113 ALA HA H 113 4.029 3.970 0.059 1
1 1304 . 1 1 1 A 113 113 ALA C C 113 180.545 179.897 0.648 1
1 1305 . 1 1 1 A 113 113 ALA CA C 113 55.127 55.202 -0.075 1
1 1306 . 1 1 1 A 113 113 ALA CB C 113 18.854 18.370 0.484 1
1 1307 . 1 1 1 A 113 113 ALA N N 113 123.134 122.808 0.326 1
1 1308 . 1 1 1 A 114 114 ILE H H 114 8.472 8.567 -0.095 1
1 1309 . 1 1 1 A 114 114 ILE HA H 114 3.613 3.764 -0.151 1
1 1319 . 1 1 1 A 114 114 ILE C C 114 176.947 177.946 -0.999 1
1 1320 . 1 1 1 A 114 114 ILE CA C 114 66.016 65.081 0.935 1
1 1321 . 1 1 1 A 114 114 ILE CB C 114 38.335 37.945 0.390 1
1 1325 . 1 1 1 A 114 114 ILE N N 114 118.276 117.781 0.495 1
1 1326 . 1 1 1 A 115 115 ARG H H 115 8.181 7.975 0.206 1
1 1327 . 1 1 1 A 115 115 ARG HA H 115 3.835 3.876 -0.041 1
1 1334 . 1 1 1 A 115 115 ARG C C 115 179.588 178.971 0.617 1
1 1335 . 1 1 1 A 115 115 ARG CA C 115 61.072 60.258 0.814 1
1 1336 . 1 1 1 A 115 115 ARG CB C 115 29.975 29.962 0.013 1
1 1339 . 1 1 1 A 115 115 ARG N N 115 117.921 119.345 -1.424 1
1 1340 . 1 1 1 A 116 116 GLN H H 116 8.395 8.335 0.060 1
1 1341 . 1 1 1 A 116 116 GLN HA H 116 4.030 4.080 -0.050 1
1 1348 . 1 1 1 A 116 116 GLN C C 116 178.716 178.764 -0.048 1
1 1349 . 1 1 1 A 116 116 GLN CA C 116 58.790 58.798 -0.008 1
1 1350 . 1 1 1 A 116 116 GLN CB C 116 28.248 28.218 0.030 1
1 1352 . 1 1 1 A 116 116 GLN N N 116 116.842 118.827 -1.985 1
1 1354 . 1 1 1 A 117 117 ALA H H 117 7.902 8.272 -0.370 1
1 1355 . 1 1 1 A 117 117 ALA HA H 117 4.143 4.136 0.007 1
1 1359 . 1 1 1 A 117 117 ALA C C 117 179.685 180.214 -0.529 1
1 1360 . 1 1 1 A 117 117 ALA CA C 117 54.476 54.968 -0.492 1
1 1361 . 1 1 1 A 117 117 ALA CB C 117 18.300 18.271 0.029 1
1 1362 . 1 1 1 A 117 117 ALA N N 117 122.828 122.698 0.130 1
1 1363 . 1 1 1 A 118 118 LEU H H 118 7.904 8.217 -0.313 1
1 1364 . 1 1 1 A 118 118 LEU HA H 118 4.119 4.101 0.018 1
1 1374 . 1 1 1 A 118 118 LEU C C 118 178.437 178.764 -0.327 1
1 1375 . 1 1 1 A 118 118 LEU CA C 118 56.781 57.184 -0.403 1
1 1376 . 1 1 1 A 118 118 LEU CB C 118 42.371 41.667 0.704 1
1 1380 . 1 1 1 A 118 118 LEU N N 118 117.632 120.085 -2.453 1
1 1381 . 1 1 1 A 119 119 MET H H 119 7.673 8.178 -0.505 1
1 1382 . 1 1 1 A 119 119 MET HA H 119 4.442 4.204 0.238 1
1 1390 . 1 1 1 A 119 119 MET C C 119 176.680 178.344 -1.664 1
1 1391 . 1 1 1 A 119 119 MET CA C 119 56.432 58.225 -1.793 1
1 1392 . 1 1 1 A 119 119 MET CB C 119 32.769 31.845 0.924 1
1 1395 . 1 1 1 A 119 119 MET N N 119 117.286 117.679 -0.393 1
1 1396 . 1 1 1 A 120 120 SER H H 120 7.878 7.651 0.227 1
1 1397 . 1 1 1 A 120 120 SER HA H 120 4.500 4.210 0.290 1
1 1400 . 1 1 1 A 120 120 SER C C 120 174.742 175.758 -1.016 1
1 1401 . 1 1 1 A 120 120 SER CA C 120 58.962 61.061 -2.099 1
1 1402 . 1 1 1 A 120 120 SER CB C 120 63.853 62.824 1.029 1
1 1403 . 1 1 1 A 120 120 SER N N 120 115.064 114.619 0.445 1
1 1404 . 1 1 1 A 121 121 GLY H H 121 8.059 8.013 0.046 1
1 1405 . 1 1 1 A 121 121 GLY HA2 H 121 4.231 4.020 0.211 1
1 1406 . 1 1 1 A 121 121 GLY HA3 H 121 4.112 4.020 0.092 1
1 1407 . 1 1 1 A 121 121 GLY C C 121 172.065 174.678 -2.613 1
1 1408 . 1 1 1 A 121 121 GLY CA C 121 45.030 45.074 -0.044 1
1 1409 . 1 1 1 A 121 121 GLY N N 121 110.271 109.175 1.096 1
1 1410 . 1 1 1 A 122 122 PRO HA H 122 4.496 4.507 -0.011 1
1 1417 . 1 1 1 A 122 122 PRO CA C 122 63.399 63.793 -0.394 1
1 1418 . 1 1 1 A 122 122 PRO CB C 122 32.186 31.899 0.287 1
1 1 . 2 1 1 A 6 6 SER H H 6 8.337 8.720 -0.383 1
1 2 . 2 1 1 A 6 6 SER HA H 6 4.597 4.823 -0.226 1
1 5 . 2 1 1 A 6 6 SER C C 6 174.637 174.009 0.628 1
1 6 . 2 1 1 A 6 6 SER CA C 6 58.469 57.728 0.741 1
1 7 . 2 1 1 A 6 6 SER CB C 6 64.221 64.073 0.148 1
1 8 . 2 1 1 A 6 6 SER N N 6 117.887 120.793 -2.906 1
1 9 . 2 1 1 A 7 7 GLY H H 7 8.280 8.556 -0.276 1
1 10 . 2 1 1 A 7 7 GLY HA2 H 7 4.063 4.234 -0.171 1
1 11 . 2 1 1 A 7 7 GLY HA3 H 7 4.063 4.236 -0.173 1
1 12 . 2 1 1 A 7 7 GLY C C 7 173.724 173.109 0.615 1
1 13 . 2 1 1 A 7 7 GLY CA C 7 44.941 44.893 0.048 1
1 14 . 2 1 1 A 7 7 GLY N N 7 110.151 113.832 -3.681 1
1 15 . 2 1 1 A 8 8 THR H H 8 8.212 8.517 -0.305 1
1 16 . 2 1 1 A 8 8 THR HA H 8 4.173 4.601 -0.428 1
1 21 . 2 1 1 A 8 8 THR C C 8 174.723 173.993 0.730 1
1 22 . 2 1 1 A 8 8 THR CA C 8 63.622 63.803 -0.181 1
1 23 . 2 1 1 A 8 8 THR CB C 8 69.460 68.750 0.710 1
1 25 . 2 1 1 A 8 8 THR N N 8 116.817 116.629 0.188 1
1 26 . 2 1 1 A 9 9 LEU H H 9 9.374 8.983 0.391 1
1 27 . 2 1 1 A 9 9 LEU HA H 9 4.302 4.157 0.145 1
1 37 . 2 1 1 A 9 9 LEU C C 9 177.468 176.601 0.867 1
1 38 . 2 1 1 A 9 9 LEU CA C 9 55.936 56.654 -0.718 1
1 39 . 2 1 1 A 9 9 LEU CB C 9 42.843 42.487 0.356 1
1 43 . 2 1 1 A 9 9 LEU N N 9 127.798 128.555 -0.757 1
1 44 . 2 1 1 A 10 10 ARG H H 10 7.512 7.478 0.034 1
1 45 . 2 1 1 A 10 10 ARG HA H 10 4.199 4.696 -0.497 1
1 52 . 2 1 1 A 10 10 ARG C C 10 172.501 173.906 -1.405 1
1 53 . 2 1 1 A 10 10 ARG CA C 10 56.165 54.319 1.846 1
1 54 . 2 1 1 A 10 10 ARG CB C 10 32.442 33.404 -0.962 1
1 57 . 2 1 1 A 10 10 ARG N N 10 117.979 116.125 1.854 1
1 58 . 2 1 1 A 11 11 GLU H H 11 8.434 8.669 -0.235 1
1 59 . 2 1 1 A 11 11 GLU HA H 11 5.993 5.606 0.387 1
1 64 . 2 1 1 A 11 11 GLU C C 11 174.800 174.417 0.383 1
1 65 . 2 1 1 A 11 11 GLU CA C 11 54.570 54.969 -0.399 1
1 66 . 2 1 1 A 11 11 GLU CB C 11 34.245 32.946 1.299 1
1 68 . 2 1 1 A 11 11 GLU N N 11 120.782 121.421 -0.639 1
1 69 . 2 1 1 A 12 12 GLY H H 12 8.131 7.716 0.415 1
1 70 . 2 1 1 A 12 12 GLY HA2 H 12 4.714 3.330 1.384 1
1 71 . 2 1 1 A 12 12 GLY HA3 H 12 3.763 4.085 -0.322 1
1 72 . 2 1 1 A 12 12 GLY C C 12 171.060 172.426 -1.366 1
1 73 . 2 1 1 A 12 12 GLY CA C 12 45.241 44.162 1.079 1
1 74 . 2 1 1 A 12 12 GLY N N 12 107.457 106.227 1.230 1
1 75 . 2 1 1 A 13 13 TRP H H 13 8.783 8.622 0.161 1
1 76 . 2 1 1 A 13 13 TRP HA H 13 5.152 4.869 0.283 1
1 85 . 2 1 1 A 13 13 TRP C C 13 177.528 176.553 0.975 1
1 86 . 2 1 1 A 13 13 TRP CA C 13 57.783 58.772 -0.989 1
1 87 . 2 1 1 A 13 13 TRP CB C 13 30.222 30.189 0.033 1
1 93 . 2 1 1 A 13 13 TRP N N 13 120.792 121.375 -0.583 1
1 95 . 2 1 1 A 14 14 VAL H H 14 9.179 8.976 0.203 1
1 96 . 2 1 1 A 14 14 VAL HA H 14 4.072 4.600 -0.528 1
1 104 . 2 1 1 A 14 14 VAL C C 14 174.981 173.590 1.391 1
1 105 . 2 1 1 A 14 14 VAL CA C 14 61.741 60.295 1.446 1
1 106 . 2 1 1 A 14 14 VAL CB C 14 35.143 35.312 -0.169 1
1 109 . 2 1 1 A 14 14 VAL N N 14 125.476 122.941 2.535 1
1 110 . 2 1 1 A 15 15 VAL H H 15 8.403 8.846 -0.443 1
1 111 . 2 1 1 A 15 15 VAL HA H 15 5.532 5.112 0.420 1
1 119 . 2 1 1 A 15 15 VAL C C 15 175.078 174.282 0.796 1
1 120 . 2 1 1 A 15 15 VAL CA C 15 59.489 59.372 0.117 1
1 121 . 2 1 1 A 15 15 VAL CB C 15 34.210 34.890 -0.680 1
1 124 . 2 1 1 A 15 15 VAL N N 15 126.189 127.022 -0.833 1
1 125 . 2 1 1 A 16 16 HIS H H 16 9.122 8.837 0.285 1
1 126 . 2 1 1 A 16 16 HIS HA H 16 5.823 5.861 -0.038 1
1 131 . 2 1 1 A 16 16 HIS C C 16 172.998 172.546 0.452 1
1 132 . 2 1 1 A 16 16 HIS CA C 16 56.253 53.882 2.371 1
1 133 . 2 1 1 A 16 16 HIS CB C 16 34.273 32.914 1.359 1
1 136 . 2 1 1 A 16 16 HIS N N 16 121.152 121.132 0.020 1
1 137 . 2 1 1 A 17 17 TYR H H 17 8.465 8.555 -0.090 1
1 138 . 2 1 1 A 17 17 TYR HA H 17 5.096 4.658 0.438 1
1 145 . 2 1 1 A 17 17 TYR C C 17 173.640 173.114 0.526 1
1 146 . 2 1 1 A 17 17 TYR CA C 17 56.903 56.454 0.449 1
1 147 . 2 1 1 A 17 17 TYR CB C 17 40.103 40.261 -0.158 1
1 152 . 2 1 1 A 17 17 TYR N N 17 115.558 116.190 -0.632 1
1 153 . 2 1 1 A 18 18 SER H H 18 9.122 8.538 0.584 1
1 154 . 2 1 1 A 18 18 SER HA H 18 6.144 5.101 1.043 1
1 157 . 2 1 1 A 18 18 SER C C 18 173.204 175.431 -2.227 1
1 158 . 2 1 1 A 18 18 SER CA C 18 56.640 56.867 -0.227 1
1 159 . 2 1 1 A 18 18 SER CB C 18 68.788 66.486 2.302 1
1 160 . 2 1 1 A 18 18 SER N N 18 118.846 115.925 2.921 1
1 161 . 2 1 1 A 19 19 ASN H H 19 9.053 8.737 0.316 1
1 162 . 2 1 1 A 19 19 ASN HA H 19 4.473 4.981 -0.508 1
1 167 . 2 1 1 A 19 19 ASN C C 19 175.396 175.789 -0.393 1
1 168 . 2 1 1 A 19 19 ASN CA C 19 55.373 52.267 3.106 1
1 169 . 2 1 1 A 19 19 ASN CB C 19 36.900 38.172 -1.272 1
1 170 . 2 1 1 A 19 19 ASN N N 19 113.712 117.750 -4.038 1
1 172 . 2 1 1 A 20 20 LYS H H 20 7.677 7.880 -0.203 1
1 173 . 2 1 1 A 20 20 LYS HA H 20 4.413 4.677 -0.264 1
1 182 . 2 1 1 A 20 20 LYS C C 20 176.078 177.230 -1.152 1
1 183 . 2 1 1 A 20 20 LYS CA C 20 55.679 57.511 -1.832 1
1 184 . 2 1 1 A 20 20 LYS CB C 20 33.023 35.540 -2.517 1
1 188 . 2 1 1 A 20 20 LYS N N 20 117.213 119.535 -2.322 1
1 189 . 2 1 1 A 21 21 ASP H H 21 7.395 7.804 -0.409 1
1 190 . 2 1 1 A 21 21 ASP HA H 21 4.808 4.833 -0.025 1
1 193 . 2 1 1 A 21 21 ASP C C 21 176.413 175.928 0.485 1
1 194 . 2 1 1 A 21 21 ASP CA C 21 53.983 53.611 0.372 1
1 195 . 2 1 1 A 21 21 ASP CB C 21 41.199 42.251 -1.052 1
1 196 . 2 1 1 A 21 21 ASP N N 21 119.879 116.510 3.369 1
1 197 . 2 1 1 A 22 22 THR H H 22 8.593 8.130 0.463 1
1 198 . 2 1 1 A 22 22 THR HA H 22 4.352 4.219 0.133 1
1 203 . 2 1 1 A 22 22 THR C C 22 172.913 173.748 -0.835 1
1 204 . 2 1 1 A 22 22 THR CA C 22 62.691 62.952 -0.261 1
1 205 . 2 1 1 A 22 22 THR CB C 22 68.332 66.456 1.876 1
1 207 . 2 1 1 A 22 22 THR N N 22 116.299 112.620 3.679 1
1 208 . 2 1 1 A 23 23 LEU H H 23 7.645 7.969 -0.324 1
1 209 . 2 1 1 A 23 23 LEU HA H 23 4.318 4.403 -0.085 1
1 219 . 2 1 1 A 23 23 LEU C C 23 176.692 175.718 0.974 1
1 220 . 2 1 1 A 23 23 LEU CA C 23 54.617 54.158 0.459 1
1 221 . 2 1 1 A 23 23 LEU CB C 23 41.939 40.119 1.820 1
1 225 . 2 1 1 A 23 23 LEU N N 23 123.606 122.813 0.793 1
1 226 . 2 1 1 A 24 24 ARG H H 24 8.563 8.088 0.475 1
1 227 . 2 1 1 A 24 24 ARG HA H 24 4.373 4.660 -0.287 1
1 235 . 2 1 1 A 24 24 ARG C C 24 176.584 175.643 0.941 1
1 236 . 2 1 1 A 24 24 ARG CA C 24 57.854 55.999 1.855 1
1 237 . 2 1 1 A 24 24 ARG CB C 24 31.126 29.593 1.533 1
1 240 . 2 1 1 A 24 24 ARG N N 24 127.152 124.526 2.626 1
1 242 . 2 1 1 A 25 25 LYS H H 25 8.633 8.405 0.228 1
1 243 . 2 1 1 A 25 25 LYS HA H 25 4.513 4.946 -0.433 1
1 251 . 2 1 1 A 25 25 LYS C C 25 173.567 174.508 -0.941 1
1 252 . 2 1 1 A 25 25 LYS CA C 25 54.792 54.661 0.131 1
1 253 . 2 1 1 A 25 25 LYS CB C 25 37.416 35.084 2.332 1
1 257 . 2 1 1 A 25 25 LYS N N 25 122.682 120.899 1.783 1
1 258 . 2 1 1 A 26 26 ARG H H 26 8.303 8.856 -0.553 1
1 259 . 2 1 1 A 26 26 ARG HA H 26 5.153 5.143 0.010 1
1 266 . 2 1 1 A 26 26 ARG C C 26 174.554 175.325 -0.771 1
1 267 . 2 1 1 A 26 26 ARG CA C 26 55.083 54.805 0.278 1
1 268 . 2 1 1 A 26 26 ARG CB C 26 32.789 31.531 1.258 1
1 271 . 2 1 1 A 26 26 ARG N N 26 121.819 124.560 -2.741 1
1 272 . 2 1 1 A 27 27 HIS H H 27 8.793 9.475 -0.682 1
1 273 . 2 1 1 A 27 27 HIS HA H 27 5.155 5.313 -0.158 1
1 278 . 2 1 1 A 27 27 HIS CA C 27 56.904 54.558 2.346 1
1 279 . 2 1 1 A 27 27 HIS CB C 27 34.683 32.086 2.597 1
1 282 . 2 1 1 A 27 27 HIS N N 27 122.102 120.551 1.551 1
1 283 . 2 1 1 A 28 28 TYR H H 28 9.273 8.195 1.078 1
1 284 . 2 1 1 A 28 28 TYR HA H 28 4.332 4.335 -0.003 1
1 291 . 2 1 1 A 28 28 TYR C C 28 174.730 175.225 -0.495 1
1 292 . 2 1 1 A 28 28 TYR CA C 28 58.680 57.465 1.215 1
1 293 . 2 1 1 A 28 28 TYR CB C 28 38.673 38.033 0.640 1
1 298 . 2 1 1 A 28 28 TYR N N 28 125.605 121.273 4.332 1
1 299 . 2 1 1 A 29 29 TRP H H 29 9.273 9.052 0.221 1
1 300 . 2 1 1 A 29 29 TRP HA H 29 5.543 4.882 0.661 1
1 309 . 2 1 1 A 29 29 TRP C C 29 176.172 176.771 -0.599 1
1 310 . 2 1 1 A 29 29 TRP CA C 29 56.658 57.044 -0.386 1
1 311 . 2 1 1 A 29 29 TRP CB C 29 32.154 30.872 1.282 1
1 317 . 2 1 1 A 29 29 TRP N N 29 131.340 128.324 3.016 1
1 318 . 2 1 1 A 30 30 ARG H H 30 9.164 9.228 -0.064 1
1 319 . 2 1 1 A 30 30 ARG HA H 30 5.302 5.431 -0.129 1
1 327 . 2 1 1 A 30 30 ARG C C 30 174.774 174.461 0.313 1
1 328 . 2 1 1 A 30 30 ARG CA C 30 56.271 54.905 1.366 1
1 329 . 2 1 1 A 30 30 ARG CB C 30 34.203 33.729 0.474 1
1 332 . 2 1 1 A 30 30 ARG N N 30 116.040 121.004 -4.964 1
1 334 . 2 1 1 A 31 31 LEU H H 31 9.273 9.621 -0.348 1
1 335 . 2 1 1 A 31 31 LEU HA H 31 5.324 5.375 -0.051 1
1 345 . 2 1 1 A 31 31 LEU C C 31 174.488 174.374 0.114 1
1 346 . 2 1 1 A 31 31 LEU CA C 31 53.807 53.561 0.246 1
1 347 . 2 1 1 A 31 31 LEU CB C 31 46.667 45.579 1.088 1
1 351 . 2 1 1 A 31 31 LEU N N 31 127.075 126.714 0.361 1
1 352 . 2 1 1 A 32 32 ASP H H 32 8.854 9.025 -0.171 1
1 353 . 2 1 1 A 32 32 ASP HA H 32 4.902 5.053 -0.151 1
1 356 . 2 1 1 A 32 32 ASP C C 32 173.474 176.899 -3.425 1
1 357 . 2 1 1 A 32 32 ASP CA C 32 53.104 52.416 0.688 1
1 358 . 2 1 1 A 32 32 ASP CB C 32 42.931 43.855 -0.924 1
1 359 . 2 1 1 A 32 32 ASP N N 32 129.349 125.685 3.664 1
1 360 . 2 1 1 A 33 33 CYS H H 33 8.153 8.773 -0.620 1
1 361 . 2 1 1 A 33 33 CYS HA H 33 4.323 4.318 0.005 1
1 364 . 2 1 1 A 33 33 CYS C C 33 174.476 174.372 0.104 1
1 365 . 2 1 1 A 33 33 CYS CA C 33 59.853 59.888 -0.035 1
1 366 . 2 1 1 A 33 33 CYS CB C 33 27.508 26.932 0.576 1
1 367 . 2 1 1 A 33 33 CYS N N 33 108.439 118.864 -10.425 1
1 368 . 2 1 1 A 34 34 LYS H H 34 9.144 7.760 1.384 1
1 369 . 2 1 1 A 34 34 LYS HA H 34 4.616 4.451 0.165 1
1 378 . 2 1 1 A 34 34 LYS C C 34 177.601 176.269 1.332 1
1 379 . 2 1 1 A 34 34 LYS CA C 34 57.185 56.767 0.418 1
1 380 . 2 1 1 A 34 34 LYS CB C 34 35.623 35.136 0.487 1
1 384 . 2 1 1 A 34 34 LYS N N 34 119.884 118.210 1.674 1
1 385 . 2 1 1 A 35 35 CYS H H 35 9.102 7.671 1.431 1
1 386 . 2 1 1 A 35 35 CYS HA H 35 4.935 4.800 0.135 1
1 389 . 2 1 1 A 35 35 CYS C C 35 172.283 172.627 -0.344 1
1 390 . 2 1 1 A 35 35 CYS CA C 35 57.748 58.281 -0.533 1
1 391 . 2 1 1 A 35 35 CYS CB C 35 31.537 32.593 -1.056 1
1 392 . 2 1 1 A 35 35 CYS N N 35 120.317 114.612 5.705 1
1 393 . 2 1 1 A 36 36 ILE H H 36 8.213 9.109 -0.896 1
1 394 . 2 1 1 A 36 36 ILE HA H 36 4.617 4.983 -0.366 1
1 404 . 2 1 1 A 36 36 ILE C C 36 175.312 175.170 0.142 1
1 405 . 2 1 1 A 36 36 ILE CA C 36 60.967 60.457 0.510 1
1 406 . 2 1 1 A 36 36 ILE CB C 36 39.718 38.520 1.198 1
1 410 . 2 1 1 A 36 36 ILE N N 36 121.905 121.766 0.139 1
1 411 . 2 1 1 A 37 37 THR H H 37 9.076 8.711 0.365 1
1 412 . 2 1 1 A 37 37 THR HA H 37 4.364 4.523 -0.159 1
1 417 . 2 1 1 A 37 37 THR CA C 37 61.834 62.274 -0.440 1
1 418 . 2 1 1 A 37 37 THR CB C 37 69.237 70.124 -0.887 1
1 420 . 2 1 1 A 37 37 THR N N 37 122.500 123.605 -1.105 1
1 421 . 2 1 1 A 38 38 LEU H H 38 8.263 8.688 -0.425 1
1 422 . 2 1 1 A 38 38 LEU HA H 38 4.445 5.020 -0.575 1
1 432 . 2 1 1 A 38 38 LEU CA C 38 55.611 52.727 2.884 1
1 433 . 2 1 1 A 38 38 LEU CB C 38 42.702 45.485 -2.783 1
1 437 . 2 1 1 A 38 38 LEU N N 38 126.987 123.758 3.229 1
1 438 . 2 1 1 A 39 39 PHE H H 39 9.520 8.652 0.868 1
1 439 . 2 1 1 A 39 39 PHE HA H 39 4.998 4.942 0.056 1
1 447 . 2 1 1 A 39 39 PHE CA C 39 57.331 56.386 0.945 1
1 448 . 2 1 1 A 39 39 PHE CB C 39 42.453 41.454 0.999 1
1 454 . 2 1 1 A 39 39 PHE N N 39 120.545 119.456 1.089 1
1 455 . 2 1 1 A 40 40 GLN H H 40 9.878 8.739 1.139 1
1 456 . 2 1 1 A 40 40 GLN HA H 40 4.376 4.144 0.232 1
1 463 . 2 1 1 A 40 40 GLN CA C 40 59.513 58.465 1.048 1
1 464 . 2 1 1 A 40 40 GLN CB C 40 29.317 28.345 0.972 1
1 467 . 2 1 1 A 41 41 ASN H H 41 7.732 7.934 -0.202 1
1 468 . 2 1 1 A 41 41 ASN HA H 41 4.812 5.119 -0.307 1
1 473 . 2 1 1 A 41 41 ASN CA C 41 52.618 51.689 0.929 1
1 474 . 2 1 1 A 41 41 ASN CB C 41 39.362 42.795 -3.433 1
1 475 . 2 1 1 A 41 41 ASN N N 41 107.613 116.257 -8.644 1
1 477 . 2 1 1 A 42 42 ASN HA H 42 3.476 3.978 -0.502 1
1 482 . 2 1 1 A 42 42 ASN C C 42 173.607 176.995 -3.388 1
1 483 . 2 1 1 A 42 42 ASN CA C 42 54.888 55.312 -0.424 1
1 484 . 2 1 1 A 42 42 ASN CB C 42 35.613 38.297 -2.684 1
1 486 . 2 1 1 A 43 43 THR H H 43 8.394 7.927 0.467 1
1 487 . 2 1 1 A 43 43 THR HA H 43 4.403 4.013 0.390 1
1 492 . 2 1 1 A 43 43 THR C C 43 174.464 175.114 -0.650 1
1 493 . 2 1 1 A 43 43 THR CA C 43 61.978 65.741 -3.763 1
1 494 . 2 1 1 A 43 43 THR CB C 43 70.036 68.296 1.740 1
1 496 . 2 1 1 A 43 43 THR N N 43 111.795 112.725 -0.930 1
1 497 . 2 1 1 A 44 44 THR H H 44 8.058 7.588 0.470 1
1 498 . 2 1 1 A 44 44 THR HA H 44 4.464 4.328 0.136 1
1 503 . 2 1 1 A 44 44 THR CA C 44 61.599 62.571 -0.972 1
1 504 . 2 1 1 A 44 44 THR CB C 44 69.137 69.152 -0.015 1
1 506 . 2 1 1 A 44 44 THR N N 44 116.514 116.653 -0.139 1
1 507 . 2 1 1 A 45 45 ASN H H 45 6.653 8.969 -2.316 1
1 508 . 2 1 1 A 45 45 ASN HA H 45 4.945 4.932 0.013 1
1 513 . 2 1 1 A 45 45 ASN CA C 45 53.227 54.476 -1.249 1
1 514 . 2 1 1 A 45 45 ASN CB C 45 38.483 40.514 -2.031 1
1 516 . 2 1 1 A 46 46 ARG H H 46 8.213 7.841 0.372 1
1 517 . 2 1 1 A 46 46 ARG HA H 46 4.583 4.623 -0.040 1
1 524 . 2 1 1 A 46 46 ARG CA C 46 55.487 55.475 0.012 1
1 525 . 2 1 1 A 46 46 ARG CB C 46 31.153 31.280 -0.127 1
1 528 . 2 1 1 A 46 46 ARG N N 46 121.652 119.948 1.704 1
1 529 . 2 1 1 A 47 47 TYR H H 47 7.973 9.059 -1.086 1
1 536 . 2 1 1 A 47 47 TYR CB C 47 39.356 39.332 0.024 1
1 541 . 2 1 1 A 48 48 TYR H H 48 9.023 8.325 0.698 1
1 542 . 2 1 1 A 48 48 TYR HA H 48 4.662 4.308 0.354 1
1 549 . 2 1 1 A 48 48 TYR CB C 48 39.863 40.769 -0.906 1
1 554 . 2 1 1 A 48 48 TYR N N 48 121.223 119.885 1.338 1
1 555 . 2 1 1 A 49 49 LYS H H 49 7.134 7.479 -0.345 1
1 556 . 2 1 1 A 49 49 LYS HA H 49 4.283 4.549 -0.266 1
1 565 . 2 1 1 A 49 49 LYS CA C 49 55.167 55.421 -0.254 1
1 566 . 2 1 1 A 49 49 LYS CB C 49 36.699 36.054 0.645 1
1 570 . 2 1 1 A 49 49 LYS N N 49 117.339 118.121 -0.782 1
1 571 . 2 1 1 A 50 50 GLU H H 50 8.411 9.106 -0.695 1
1 572 . 2 1 1 A 50 50 GLU HA H 50 4.583 5.117 -0.534 1
1 577 . 2 1 1 A 50 50 GLU CA C 50 54.592 54.765 -0.173 1
1 578 . 2 1 1 A 50 50 GLU CB C 50 33.263 32.525 0.738 1
1 580 . 2 1 1 A 50 50 GLU N N 50 123.825 125.178 -1.353 1
1 581 . 2 1 1 A 51 51 ILE H H 51 9.225 9.115 0.110 1
1 582 . 2 1 1 A 51 51 ILE HA H 51 4.277 4.623 -0.346 1
1 592 . 2 1 1 A 51 51 ILE CA C 51 58.182 58.238 -0.056 1
1 593 . 2 1 1 A 51 51 ILE CB C 51 39.663 38.503 1.160 1
1 597 . 2 1 1 A 51 51 ILE N N 51 125.271 127.015 -1.744 1
1 598 . 2 1 1 A 52 52 PRO HA H 52 4.543 4.637 -0.094 1
1 605 . 2 1 1 A 52 52 PRO C C 52 178.340 178.048 0.292 1
1 606 . 2 1 1 A 52 52 PRO CA C 52 62.726 62.884 -0.158 1
1 607 . 2 1 1 A 52 52 PRO CB C 52 32.003 31.736 0.267 1
1 610 . 2 1 1 A 53 53 LEU H H 53 8.723 8.521 0.202 1
1 611 . 2 1 1 A 53 53 LEU HA H 53 3.891 3.899 -0.008 1
1 621 . 2 1 1 A 53 53 LEU C C 53 179.673 178.939 0.734 1
1 622 . 2 1 1 A 53 53 LEU CA C 53 58.205 57.558 0.647 1
1 623 . 2 1 1 A 53 53 LEU CB C 53 40.171 41.463 -1.292 1
1 627 . 2 1 1 A 53 53 LEU N N 53 125.150 124.350 0.800 1
1 628 . 2 1 1 A 54 54 SER H H 54 8.360 8.314 0.046 1
1 629 . 2 1 1 A 54 54 SER HA H 54 4.164 4.107 0.057 1
1 632 . 2 1 1 A 54 54 SER C C 54 175.517 177.145 -1.628 1
1 633 . 2 1 1 A 54 54 SER CA C 54 60.193 61.577 -1.384 1
1 634 . 2 1 1 A 54 54 SER CB C 54 62.617 62.299 0.318 1
1 635 . 2 1 1 A 54 54 SER N N 54 111.266 113.538 -2.272 1
1 636 . 2 1 1 A 55 55 GLU H H 55 7.666 8.108 -0.442 1
1 637 . 2 1 1 A 55 55 GLU HA H 55 4.363 4.108 0.255 1
1 642 . 2 1 1 A 55 55 GLU C C 55 176.753 177.877 -1.124 1
1 643 . 2 1 1 A 55 55 GLU CA C 55 56.200 58.958 -2.758 1
1 644 . 2 1 1 A 55 55 GLU CB C 55 30.526 29.258 1.268 1
1 646 . 2 1 1 A 55 55 GLU N N 55 119.485 120.512 -1.027 1
1 647 . 2 1 1 A 56 56 ILE H H 56 7.601 7.054 0.547 1
1 648 . 2 1 1 A 56 56 ILE HA H 56 3.793 3.943 -0.150 1
1 658 . 2 1 1 A 56 56 ILE C C 56 175.142 175.983 -0.841 1
1 659 . 2 1 1 A 56 56 ILE CA C 56 63.518 62.174 1.344 1
1 660 . 2 1 1 A 56 56 ILE CB C 56 37.169 37.924 -0.755 1
1 664 . 2 1 1 A 56 56 ILE N N 56 120.430 120.524 -0.094 1
1 665 . 2 1 1 A 57 57 LEU H H 57 9.263 9.302 -0.039 1
1 666 . 2 1 1 A 57 57 LEU HA H 57 4.343 4.394 -0.051 1
1 676 . 2 1 1 A 57 57 LEU C C 57 177.898 176.535 1.363 1
1 677 . 2 1 1 A 57 57 LEU CA C 57 56.569 55.940 0.629 1
1 678 . 2 1 1 A 57 57 LEU CB C 57 41.980 42.665 -0.685 1
1 682 . 2 1 1 A 57 57 LEU N N 57 129.464 128.929 0.535 1
1 683 . 2 1 1 A 58 58 THR H H 58 7.414 7.369 0.045 1
1 684 . 2 1 1 A 58 58 THR HA H 58 4.512 4.877 -0.365 1
1 689 . 2 1 1 A 58 58 THR C C 58 171.314 172.730 -1.416 1
1 690 . 2 1 1 A 58 58 THR CA C 58 60.562 61.245 -0.683 1
1 691 . 2 1 1 A 58 58 THR CB C 58 70.803 73.373 -2.570 1
1 693 . 2 1 1 A 58 58 THR N N 58 109.129 110.874 -1.745 1
1 694 . 2 1 1 A 59 59 VAL H H 59 8.152 8.514 -0.362 1
1 695 . 2 1 1 A 59 59 VAL HA H 59 5.061 5.024 0.037 1
1 703 . 2 1 1 A 59 59 VAL C C 59 174.985 174.978 0.007 1
1 704 . 2 1 1 A 59 59 VAL CA C 59 61.354 61.197 0.157 1
1 705 . 2 1 1 A 59 59 VAL CB C 59 33.855 33.791 0.064 1
1 708 . 2 1 1 A 59 59 VAL N N 59 123.676 124.711 -1.035 1
1 709 . 2 1 1 A 60 60 GLU H H 60 9.074 8.638 0.436 1
1 710 . 2 1 1 A 60 60 GLU HA H 60 4.977 4.867 0.110 1
1 715 . 2 1 1 A 60 60 GLU C C 60 176.063 175.433 0.630 1
1 716 . 2 1 1 A 60 60 GLU CA C 60 53.807 54.397 -0.590 1
1 717 . 2 1 1 A 60 60 GLU CB C 60 33.739 33.417 0.322 1
1 719 . 2 1 1 A 60 60 GLU N N 60 125.125 126.065 -0.940 1
1 720 . 2 1 1 A 61 61 SER H H 61 8.763 8.781 -0.018 1
1 721 . 2 1 1 A 61 61 SER HA H 61 4.452 4.937 -0.485 1
1 724 . 2 1 1 A 61 61 SER C C 61 173.288 174.217 -0.929 1
1 725 . 2 1 1 A 61 61 SER CA C 61 59.384 57.870 1.514 1
1 726 . 2 1 1 A 61 61 SER CB C 61 63.390 64.477 -1.087 1
1 727 . 2 1 1 A 61 61 SER N N 61 117.523 118.769 -1.246 1
1 728 . 2 1 1 A 62 62 ALA H H 62 7.293 8.668 -1.375 1
1 729 . 2 1 1 A 62 62 ALA HA H 62 3.817 4.310 -0.493 1
1 733 . 2 1 1 A 62 62 ALA C C 62 176.717 177.804 -1.087 1
1 734 . 2 1 1 A 62 62 ALA CA C 62 53.966 52.996 0.970 1
1 735 . 2 1 1 A 62 62 ALA CB C 62 18.640 18.474 0.166 1
1 736 . 2 1 1 A 62 62 ALA N N 62 122.650 126.177 -3.527 1
1 737 . 2 1 1 A 63 63 GLN H H 63 8.736 8.083 0.653 1
1 738 . 2 1 1 A 63 63 GLN HA H 63 4.445 4.769 -0.324 1
1 745 . 2 1 1 A 63 63 GLN C C 63 173.700 175.220 -1.520 1
1 746 . 2 1 1 A 63 63 GLN CA C 63 56.376 55.797 0.579 1
1 747 . 2 1 1 A 63 63 GLN CB C 63 31.515 31.085 0.430 1
1 749 . 2 1 1 A 63 63 GLN N N 63 120.251 119.446 0.805 1
1 751 . 2 1 1 A 64 64 ASN H H 64 9.272 7.714 1.558 1
1 752 . 2 1 1 A 64 64 ASN HA H 64 4.906 5.163 -0.257 1
1 757 . 2 1 1 A 64 64 ASN C C 64 174.754 174.898 -0.144 1
1 758 . 2 1 1 A 64 64 ASN CA C 64 51.837 52.297 -0.460 1
1 759 . 2 1 1 A 64 64 ASN CB C 64 38.156 40.235 -2.079 1
1 760 . 2 1 1 A 64 64 ASN N N 64 122.346 118.701 3.645 1
1 762 . 2 1 1 A 65 65 PHE H H 65 8.854 9.285 -0.431 1
1 763 . 2 1 1 A 65 65 PHE HA H 65 4.947 5.156 -0.209 1
1 771 . 2 1 1 A 65 65 PHE C C 65 177.274 176.336 0.938 1
1 772 . 2 1 1 A 65 65 PHE CA C 65 57.519 57.008 0.511 1
1 773 . 2 1 1 A 65 65 PHE CB C 65 38.485 38.774 -0.289 1
1 779 . 2 1 1 A 65 65 PHE N N 65 123.638 125.183 -1.545 1
1 780 . 2 1 1 A 66 66 SER H H 66 8.163 8.154 0.009 1
1 781 . 2 1 1 A 66 66 SER HA H 66 4.393 4.516 -0.123 1
1 784 . 2 1 1 A 66 66 SER C C 66 175.699 176.972 -1.273 1
1 785 . 2 1 1 A 66 66 SER CA C 66 60.791 60.868 -0.077 1
1 786 . 2 1 1 A 66 66 SER CB C 66 64.591 63.438 1.153 1
1 787 . 2 1 1 A 66 66 SER N N 66 113.913 115.851 -1.938 1
1 788 . 2 1 1 A 67 67 LEU H H 67 8.574 7.779 0.795 1
1 789 . 2 1 1 A 67 67 LEU HA H 67 4.302 3.781 0.521 1
1 799 . 2 1 1 A 67 67 LEU C C 67 176.269 177.325 -1.056 1
1 800 . 2 1 1 A 67 67 LEU CA C 67 55.601 58.215 -2.614 1
1 801 . 2 1 1 A 67 67 LEU CB C 67 42.021 41.995 0.026 1
1 805 . 2 1 1 A 67 67 LEU N N 67 121.264 120.575 0.689 1
1 806 . 2 1 1 A 68 68 VAL H H 68 6.921 7.661 -0.740 1
1 807 . 2 1 1 A 68 68 VAL HA H 68 4.473 4.151 0.322 1
1 815 . 2 1 1 A 68 68 VAL C C 68 173.809 174.878 -1.069 1
1 816 . 2 1 1 A 68 68 VAL CA C 68 58.047 60.365 -2.318 1
1 817 . 2 1 1 A 68 68 VAL CB C 68 32.295 32.277 0.018 1
1 820 . 2 1 1 A 68 68 VAL N N 68 111.287 115.512 -4.225 1
1 821 . 2 1 1 A 69 69 PRO HA H 69 4.658 4.632 0.026 1
1 828 . 2 1 1 A 69 69 PRO CA C 69 61.747 61.677 0.070 1
1 829 . 2 1 1 A 69 69 PRO CB C 69 30.693 32.484 -1.791 1
1 832 . 2 1 1 A 70 70 PRO HA H 70 4.414 4.405 0.009 1
1 839 . 2 1 1 A 70 70 PRO CA C 70 63.997 64.532 -0.535 1
1 840 . 2 1 1 A 70 70 PRO CB C 70 31.602 31.755 -0.153 1
1 843 . 2 1 1 A 71 71 GLY H H 71 8.824 8.501 0.323 1
1 844 . 2 1 1 A 71 71 GLY HA2 H 71 3.703 3.942 -0.239 1
1 845 . 2 1 1 A 71 71 GLY HA3 H 71 4.193 3.944 0.249 1
1 846 . 2 1 1 A 71 71 GLY C C 71 174.052 174.012 0.040 1
1 847 . 2 1 1 A 71 71 GLY CA C 71 45.065 45.414 -0.349 1
1 848 . 2 1 1 A 71 71 GLY N N 71 111.845 106.341 5.504 1
1 849 . 2 1 1 A 72 72 THR H H 72 7.597 7.307 0.290 1
1 850 . 2 1 1 A 72 72 THR HA H 72 4.133 4.291 -0.158 1
1 855 . 2 1 1 A 72 72 THR CA C 72 63.129 62.419 0.710 1
1 856 . 2 1 1 A 72 72 THR CB C 72 69.560 69.386 0.174 1
1 858 . 2 1 1 A 72 72 THR N N 72 117.485 115.205 2.280 1
1 859 . 2 1 1 A 73 73 ASN H H 73 9.280 8.568 0.712 1
1 860 . 2 1 1 A 73 73 ASN HA H 73 4.786 4.620 0.166 1
1 865 . 2 1 1 A 73 73 ASN CA C 73 52.009 52.296 -0.287 1
1 866 . 2 1 1 A 73 73 ASN CB C 73 37.553 38.214 -0.661 1
1 867 . 2 1 1 A 73 73 ASN N N 73 127.641 125.918 1.723 1
1 869 . 2 1 1 A 74 74 PRO HA H 74 4.752 4.863 -0.111 1
1 876 . 2 1 1 A 74 74 PRO C C 74 175.190 176.449 -1.259 1
1 877 . 2 1 1 A 74 74 PRO CA C 74 63.395 62.529 0.866 1
1 878 . 2 1 1 A 74 74 PRO CB C 74 33.164 33.266 -0.102 1
1 881 . 2 1 1 A 75 75 HIS H H 75 8.025 8.730 -0.705 1
1 882 . 2 1 1 A 75 75 HIS HA H 75 5.047 5.107 -0.060 1
1 887 . 2 1 1 A 75 75 HIS C C 75 172.562 175.653 -3.091 1
1 888 . 2 1 1 A 75 75 HIS CA C 75 54.336 53.483 0.853 1
1 889 . 2 1 1 A 75 75 HIS CB C 75 30.956 33.103 -2.147 1
1 892 . 2 1 1 A 75 75 HIS N N 75 116.198 116.742 -0.544 1
1 893 . 2 1 1 A 76 76 CYS H H 76 8.343 9.464 -1.121 1
1 894 . 2 1 1 A 76 76 CYS HA H 76 4.594 4.458 0.136 1
1 897 . 2 1 1 A 76 76 CYS C C 76 175.651 174.736 0.915 1
1 898 . 2 1 1 A 76 76 CYS CA C 76 61.066 61.151 -0.085 1
1 899 . 2 1 1 A 76 76 CYS CB C 76 30.193 28.695 1.498 1
1 900 . 2 1 1 A 76 76 CYS N N 76 113.289 118.478 -5.189 1
1 901 . 2 1 1 A 77 77 PHE H H 77 8.433 8.134 0.299 1
1 902 . 2 1 1 A 77 77 PHE HA H 77 5.105 5.414 -0.309 1
1 910 . 2 1 1 A 77 77 PHE C C 77 171.822 172.985 -1.163 1
1 911 . 2 1 1 A 77 77 PHE CA C 77 56.874 55.667 1.207 1
1 912 . 2 1 1 A 77 77 PHE CB C 77 39.393 43.024 -3.631 1
1 918 . 2 1 1 A 77 77 PHE N N 77 114.874 114.723 0.151 1
1 919 . 2 1 1 A 78 78 GLU H H 78 9.823 9.182 0.641 1
1 920 . 2 1 1 A 78 78 GLU HA H 78 5.333 5.102 0.231 1
1 925 . 2 1 1 A 78 78 GLU C C 78 175.602 175.524 0.078 1
1 926 . 2 1 1 A 78 78 GLU CA C 78 54.212 54.845 -0.633 1
1 927 . 2 1 1 A 78 78 GLU CB C 78 31.702 32.631 -0.929 1
1 929 . 2 1 1 A 78 78 GLU N N 78 121.074 118.864 2.210 1
1 930 . 2 1 1 A 79 79 ILE H H 79 9.093 8.994 0.099 1
1 931 . 2 1 1 A 79 79 ILE HA H 79 4.637 4.607 0.030 1
1 941 . 2 1 1 A 79 79 ILE C C 79 174.476 175.170 -0.694 1
1 942 . 2 1 1 A 79 79 ILE CA C 79 60.932 60.792 0.140 1
1 943 . 2 1 1 A 79 79 ILE CB C 79 40.803 37.315 3.488 1
1 947 . 2 1 1 A 79 79 ILE N N 79 121.382 125.220 -3.838 1
1 948 . 2 1 1 A 80 80 VAL H H 80 8.841 7.896 0.945 1
1 949 . 2 1 1 A 80 80 VAL HA H 80 4.425 3.857 0.568 1
1 957 . 2 1 1 A 80 80 VAL C C 80 175.930 175.457 0.473 1
1 958 . 2 1 1 A 80 80 VAL CA C 80 63.324 63.290 0.034 1
1 959 . 2 1 1 A 80 80 VAL CB C 80 32.783 31.275 1.508 1
1 962 . 2 1 1 A 80 80 VAL N N 80 128.970 126.951 2.019 1
1 963 . 2 1 1 A 81 81 THR H H 81 8.303 7.836 0.467 1
1 964 . 2 1 1 A 81 81 THR HA H 81 5.264 4.788 0.476 1
1 969 . 2 1 1 A 81 81 THR C C 81 173.664 174.250 -0.586 1
1 970 . 2 1 1 A 81 81 THR CA C 81 59.540 59.909 -0.369 1
1 971 . 2 1 1 A 81 81 THR CB C 81 72.197 70.896 1.301 1
1 973 . 2 1 1 A 81 81 THR N N 81 118.077 118.386 -0.309 1
1 974 . 2 1 1 A 82 82 ALA H H 82 9.586 8.436 1.150 1
1 975 . 2 1 1 A 82 82 ALA HA H 82 4.093 4.491 -0.398 1
1 979 . 2 1 1 A 82 82 ALA C C 82 178.667 177.714 0.953 1
1 980 . 2 1 1 A 82 82 ALA CA C 82 55.321 52.562 2.759 1
1 981 . 2 1 1 A 82 82 ALA CB C 82 18.094 18.826 -0.732 1
1 982 . 2 1 1 A 82 82 ALA N N 82 122.493 122.857 -0.364 1
1 983 . 2 1 1 A 83 83 ASN H H 83 7.923 8.456 -0.533 1
1 984 . 2 1 1 A 83 83 ASN HA H 83 4.808 5.109 -0.301 1
1 989 . 2 1 1 A 83 83 ASN C C 83 174.766 174.407 0.359 1
1 990 . 2 1 1 A 83 83 ASN CA C 83 53.333 54.798 -1.465 1
1 991 . 2 1 1 A 83 83 ASN CB C 83 40.335 41.813 -1.478 1
1 992 . 2 1 1 A 83 83 ASN N N 83 110.765 116.477 -5.712 1
1 994 . 2 1 1 A 84 84 ALA H H 84 7.352 7.186 0.166 1
1 995 . 2 1 1 A 84 84 ALA HA H 84 4.625 4.566 0.059 1
1 999 . 2 1 1 A 84 84 ALA C C 84 176.547 175.464 1.083 1
1 1000 . 2 1 1 A 84 84 ALA CA C 84 52.858 51.758 1.100 1
1 1001 . 2 1 1 A 84 84 ALA CB C 84 21.233 22.160 -0.927 1
1 1002 . 2 1 1 A 84 84 ALA N N 84 119.599 118.084 1.515 1
1 1003 . 2 1 1 A 85 85 THR H H 85 8.374 8.631 -0.257 1
1 1004 . 2 1 1 A 85 85 THR HA H 85 5.014 4.478 0.536 1
1 1009 . 2 1 1 A 85 85 THR C C 85 171.568 174.266 -2.698 1
1 1010 . 2 1 1 A 85 85 THR CA C 85 61.618 63.062 -1.444 1
1 1011 . 2 1 1 A 85 85 THR CB C 85 70.850 68.709 2.141 1
1 1013 . 2 1 1 A 85 85 THR N N 85 119.032 114.326 4.706 1
1 1014 . 2 1 1 A 86 86 TYR H H 86 9.006 8.983 0.023 1
1 1015 . 2 1 1 A 86 86 TYR HA H 86 4.658 4.808 -0.150 1
1 1022 . 2 1 1 A 86 86 TYR C C 86 173.773 175.201 -1.428 1
1 1023 . 2 1 1 A 86 86 TYR CA C 86 56.938 57.538 -0.600 1
1 1024 . 2 1 1 A 86 86 TYR CB C 86 39.513 40.112 -0.599 1
1 1029 . 2 1 1 A 86 86 TYR N N 86 123.494 127.115 -3.621 1
1 1030 . 2 1 1 A 87 87 PHE H H 87 9.263 8.601 0.662 1
1 1031 . 2 1 1 A 87 87 PHE HA H 87 4.127 4.666 -0.539 1
1 1039 . 2 1 1 A 87 87 PHE C C 87 176.369 173.901 2.468 1
1 1040 . 2 1 1 A 87 87 PHE CA C 87 57.238 55.810 1.428 1
1 1041 . 2 1 1 A 87 87 PHE CB C 87 37.086 38.625 -1.539 1
1 1047 . 2 1 1 A 87 87 PHE N N 87 125.384 119.911 5.473 1
1 1048 . 2 1 1 A 88 88 VAL H H 88 9.023 8.377 0.646 1
1 1049 . 2 1 1 A 88 88 VAL HA H 88 4.162 4.579 -0.417 1
1 1057 . 2 1 1 A 88 88 VAL C C 88 176.390 175.678 0.712 1
1 1058 . 2 1 1 A 88 88 VAL CA C 88 63.975 60.524 3.451 1
1 1059 . 2 1 1 A 88 88 VAL CB C 88 32.378 32.529 -0.151 1
1 1062 . 2 1 1 A 88 88 VAL N N 88 127.348 124.390 2.958 1
1 1063 . 2 1 1 A 89 89 GLY H H 89 9.233 7.980 1.253 1
1 1064 . 2 1 1 A 89 89 GLY HA2 H 89 4.293 4.239 0.054 1
1 1065 . 2 1 1 A 89 89 GLY HA3 H 89 4.186 4.299 -0.113 1
1 1066 . 2 1 1 A 89 89 GLY C C 89 172.378 172.134 0.244 1
1 1067 . 2 1 1 A 89 89 GLY CA C 89 43.798 46.204 -2.406 1
1 1068 . 2 1 1 A 89 89 GLY N N 89 116.041 112.767 3.274 1
1 1069 . 2 1 1 A 90 90 GLU H H 90 8.532 8.827 -0.295 1
1 1070 . 2 1 1 A 90 90 GLU HA H 90 4.794 5.061 -0.267 1
1 1075 . 2 1 1 A 90 90 GLU C C 90 174.221 174.622 -0.401 1
1 1076 . 2 1 1 A 90 90 GLU CA C 90 56.393 54.816 1.577 1
1 1077 . 2 1 1 A 90 90 GLU CB C 90 33.182 33.081 0.101 1
1 1079 . 2 1 1 A 90 90 GLU N N 90 120.905 120.289 0.616 1
1 1080 . 2 1 1 A 91 91 MET H H 91 8.450 8.561 -0.111 1
1 1081 . 2 1 1 A 91 91 MET HA H 91 4.904 5.159 -0.255 1
1 1089 . 2 1 1 A 91 91 MET C C 91 173.373 174.175 -0.802 1
1 1090 . 2 1 1 A 91 91 MET CA C 91 52.277 53.128 -0.851 1
1 1091 . 2 1 1 A 91 91 MET CB C 91 32.789 34.273 -1.484 1
1 1094 . 2 1 1 A 91 91 MET N N 91 125.173 118.622 6.551 1
1 1095 . 2 1 1 A 92 92 PRO HA H 92 4.358 4.659 -0.301 1
1 1102 . 2 1 1 A 92 92 PRO C C 92 177.589 176.526 1.063 1
1 1103 . 2 1 1 A 92 92 PRO CA C 92 63.143 62.752 0.391 1
1 1104 . 2 1 1 A 92 92 PRO CB C 92 32.083 32.667 -0.584 1
1 1107 . 2 1 1 A 93 93 GLY H H 93 8.330 8.129 0.201 1
1 1108 . 2 1 1 A 93 93 GLY HA2 H 93 3.943 4.319 -0.376 1
1 1109 . 2 1 1 A 93 93 GLY HA3 H 93 4.045 4.324 -0.279 1
1 1110 . 2 1 1 A 93 93 GLY C C 93 174.730 172.655 2.075 1
1 1111 . 2 1 1 A 93 93 GLY CA C 93 45.276 45.616 -0.340 1
1 1112 . 2 1 1 A 93 93 GLY N N 93 109.420 107.404 2.016 1
1 1113 . 2 1 1 A 94 94 GLY H H 94 8.331 8.520 -0.189 1
1 1114 . 2 1 1 A 94 94 GLY HA2 H 94 3.973 4.172 -0.199 1
1 1115 . 2 1 1 A 94 94 GLY HA3 H 94 3.973 4.175 -0.202 1
1 1116 . 2 1 1 A 94 94 GLY C C 94 174.100 172.340 1.760 1
1 1117 . 2 1 1 A 94 94 GLY CA C 94 45.333 45.263 0.070 1
1 1118 . 2 1 1 A 94 94 GLY N N 94 108.483 106.939 1.544 1
1 1119 . 2 1 1 A 95 95 THR H H 95 8.095 8.616 -0.521 1
1 1120 . 2 1 1 A 95 95 THR HA H 95 4.643 4.995 -0.352 1
1 1125 . 2 1 1 A 95 95 THR C C 95 173.155 174.394 -1.239 1
1 1126 . 2 1 1 A 95 95 THR CA C 95 59.922 58.391 1.531 1
1 1127 . 2 1 1 A 95 95 THR CB C 95 69.871 69.876 -0.005 1
1 1129 . 2 1 1 A 95 95 THR N N 95 115.860 115.808 0.052 1
1 1130 . 2 1 1 A 96 96 PRO HA H 96 4.400 4.468 -0.068 1
1 1137 . 2 1 1 A 96 96 PRO C C 96 177.565 177.239 0.326 1
1 1138 . 2 1 1 A 96 96 PRO CA C 96 64.047 63.868 0.179 1
1 1139 . 2 1 1 A 96 96 PRO CB C 96 31.816 31.721 0.095 1
1 1142 . 2 1 1 A 97 97 GLY H H 97 8.572 8.131 0.441 1
1 1143 . 2 1 1 A 97 97 GLY HA2 H 97 4.007 3.943 0.064 1
1 1144 . 2 1 1 A 97 97 GLY HA3 H 97 4.007 3.943 0.064 1
1 1145 . 2 1 1 A 97 97 GLY C C 97 174.609 174.774 -0.165 1
1 1146 . 2 1 1 A 97 97 GLY CA C 97 45.276 45.995 -0.719 1
1 1147 . 2 1 1 A 97 97 GLY N N 97 110.233 106.659 3.574 1
1 1148 . 2 1 1 A 98 98 GLY H H 98 8.119 7.114 1.005 1
1 1149 . 2 1 1 A 98 98 GLY HA2 H 98 4.086 4.112 -0.026 1
1 1150 . 2 1 1 A 98 98 GLY HA3 H 98 4.200 4.113 0.087 1
1 1151 . 2 1 1 A 98 98 GLY CA C 98 44.876 45.357 -0.481 1
1 1152 . 2 1 1 A 98 98 GLY N N 98 108.845 106.404 2.441 1
1 1153 . 2 1 1 A 99 99 PRO HA H 99 4.494 4.486 0.008 1
1 1160 . 2 1 1 A 99 99 PRO C C 99 177.468 177.579 -0.111 1
1 1161 . 2 1 1 A 99 99 PRO CA C 99 63.500 63.963 -0.463 1
1 1162 . 2 1 1 A 99 99 PRO CB C 99 32.013 31.886 0.127 1
1 1165 . 2 1 1 A 100 100 SER H H 100 8.472 8.525 -0.053 1
1 1166 . 2 1 1 A 100 100 SER HA H 100 4.513 4.186 0.327 1
1 1169 . 2 1 1 A 100 100 SER C C 100 175.408 176.275 -0.867 1
1 1170 . 2 1 1 A 100 100 SER CA C 100 58.557 62.298 -3.741 1
1 1171 . 2 1 1 A 100 100 SER CB C 100 63.918 62.329 1.589 1
1 1172 . 2 1 1 A 100 100 SER N N 100 116.038 114.548 1.490 1
1 1173 . 2 1 1 A 101 101 GLY H H 101 8.427 8.397 0.030 1
1 1174 . 2 1 1 A 101 101 GLY HA2 H 101 4.064 3.915 0.149 1
1 1175 . 2 1 1 A 101 101 GLY HA3 H 101 4.064 3.918 0.146 1
1 1176 . 2 1 1 A 101 101 GLY C C 101 174.730 174.640 0.090 1
1 1177 . 2 1 1 A 101 101 GLY CA C 101 45.575 47.084 -1.509 1
1 1178 . 2 1 1 A 101 101 GLY N N 101 110.558 108.103 2.455 1
1 1179 . 2 1 1 A 102 102 GLN H H 102 8.416 8.582 -0.166 1
1 1180 . 2 1 1 A 102 102 GLN HA H 102 4.383 4.605 -0.222 1
1 1187 . 2 1 1 A 102 102 GLN C C 102 177.346 175.854 1.492 1
1 1188 . 2 1 1 A 102 102 GLN CA C 102 57.080 57.132 -0.052 1
1 1189 . 2 1 1 A 102 102 GLN CB C 102 29.235 31.455 -2.220 1
1 1191 . 2 1 1 A 102 102 GLN N N 102 120.112 121.827 -1.715 1
1 1193 . 2 1 1 A 103 103 GLY H H 103 8.713 7.809 0.904 1
1 1194 . 2 1 1 A 103 103 GLY HA2 H 103 4.193 4.068 0.125 1
1 1195 . 2 1 1 A 103 103 GLY HA3 H 103 4.078 4.072 0.006 1
1 1196 . 2 1 1 A 103 103 GLY C C 103 175.602 173.248 2.354 1
1 1197 . 2 1 1 A 103 103 GLY CA C 103 46.120 44.655 1.465 1
1 1198 . 2 1 1 A 103 103 GLY N N 103 109.817 108.681 1.136 1
1 1199 . 2 1 1 A 104 104 ALA H H 104 8.366 8.776 -0.410 1
1 1200 . 2 1 1 A 104 104 ALA HA H 104 4.449 4.653 -0.204 1
1 1204 . 2 1 1 A 104 104 ALA C C 104 179.188 177.405 1.783 1
1 1205 . 2 1 1 A 104 104 ALA CA C 104 54.230 51.119 3.111 1
1 1206 . 2 1 1 A 104 104 ALA CB C 104 19.080 21.641 -2.561 1
1 1207 . 2 1 1 A 104 104 ALA N N 104 124.808 121.413 3.395 1
1 1208 . 2 1 1 A 105 105 GLU H H 105 8.576 8.975 -0.399 1
1 1209 . 2 1 1 A 105 105 GLU HA H 105 4.161 4.073 0.088 1
1 1214 . 2 1 1 A 105 105 GLU C C 105 179.200 178.540 0.660 1
1 1215 . 2 1 1 A 105 105 GLU CA C 105 59.173 59.120 0.053 1
1 1216 . 2 1 1 A 105 105 GLU CB C 105 29.194 28.829 0.365 1
1 1218 . 2 1 1 A 105 105 GLU N N 105 119.238 116.566 2.672 1
1 1219 . 2 1 1 A 106 106 ALA H H 106 8.381 8.356 0.025 1
1 1220 . 2 1 1 A 106 106 ALA HA H 106 4.283 4.132 0.151 1
1 1224 . 2 1 1 A 106 106 ALA C C 106 180.048 179.865 0.183 1
1 1225 . 2 1 1 A 106 106 ALA CA C 106 54.687 55.553 -0.866 1
1 1226 . 2 1 1 A 106 106 ALA CB C 106 18.341 18.949 -0.608 1
1 1227 . 2 1 1 A 106 106 ALA N N 106 123.327 122.618 0.709 1
1 1228 . 2 1 1 A 107 107 ALA H H 107 8.123 7.989 0.134 1
1 1229 . 2 1 1 A 107 107 ALA HA H 107 4.554 4.399 0.155 1
1 1233 . 2 1 1 A 107 107 ALA C C 107 179.757 179.939 -0.182 1
1 1234 . 2 1 1 A 107 107 ALA CA C 107 55.355 55.543 -0.188 1
1 1235 . 2 1 1 A 107 107 ALA CB C 107 18.939 18.436 0.503 1
1 1236 . 2 1 1 A 107 107 ALA N N 107 120.740 120.274 0.466 1
1 1237 . 2 1 1 A 108 108 ARG H H 108 8.403 8.108 0.295 1
1 1238 . 2 1 1 A 108 108 ARG HA H 108 4.254 4.075 0.179 1
1 1245 . 2 1 1 A 108 108 ARG C C 108 179.111 179.796 -0.685 1
1 1246 . 2 1 1 A 108 108 ARG CA C 108 59.015 59.252 -0.237 1
1 1247 . 2 1 1 A 108 108 ARG CB C 108 29.752 30.032 -0.280 1
1 1250 . 2 1 1 A 108 108 ARG N N 108 119.531 118.045 1.486 1
1 1251 . 2 1 1 A 109 109 GLY H H 109 8.182 8.827 -0.645 1
1 1252 . 2 1 1 A 109 109 GLY HA2 H 109 3.822 3.709 0.113 1
1 1253 . 2 1 1 A 109 109 GLY HA3 H 109 3.822 3.731 0.091 1
1 1254 . 2 1 1 A 109 109 GLY C C 109 177.020 176.811 0.209 1
1 1255 . 2 1 1 A 109 109 GLY CA C 109 46.718 47.234 -0.516 1
1 1256 . 2 1 1 A 109 109 GLY N N 109 107.331 108.220 -0.889 1
1 1257 . 2 1 1 A 110 110 TRP H H 110 7.925 8.199 -0.274 1
1 1258 . 2 1 1 A 110 110 TRP HA H 110 3.963 4.604 -0.641 1
1 1267 . 2 1 1 A 110 110 TRP C C 110 176.691 177.847 -1.156 1
1 1268 . 2 1 1 A 110 110 TRP CA C 110 62.041 60.385 1.656 1
1 1269 . 2 1 1 A 110 110 TRP CB C 110 28.989 28.721 0.268 1
1 1275 . 2 1 1 A 110 110 TRP N N 110 122.304 121.446 0.858 1
1 1277 . 2 1 1 A 111 111 GLU H H 111 7.946 7.619 0.327 1
1 1278 . 2 1 1 A 111 111 GLU HA H 111 2.594 3.222 -0.628 1
1 1283 . 2 1 1 A 111 111 GLU C C 111 177.976 179.081 -1.105 1
1 1284 . 2 1 1 A 111 111 GLU CA C 111 60.193 58.877 1.316 1
1 1285 . 2 1 1 A 111 111 GLU CB C 111 29.277 29.349 -0.072 1
1 1287 . 2 1 1 A 111 111 GLU N N 111 121.755 119.178 2.577 1
1 1288 . 2 1 1 A 112 112 THR H H 112 7.993 7.662 0.331 1
1 1289 . 2 1 1 A 112 112 THR HA H 112 3.722 3.812 -0.090 1
1 1294 . 2 1 1 A 112 112 THR C C 112 176.038 175.865 0.173 1
1 1295 . 2 1 1 A 112 112 THR CA C 112 66.104 66.441 -0.337 1
1 1296 . 2 1 1 A 112 112 THR CB C 112 68.885 68.706 0.179 1
1 1298 . 2 1 1 A 112 112 THR N N 112 112.247 116.575 -4.328 1
1 1299 . 2 1 1 A 113 113 ALA H H 113 7.742 8.259 -0.517 1
1 1300 . 2 1 1 A 113 113 ALA HA H 113 4.029 3.958 0.071 1
1 1304 . 2 1 1 A 113 113 ALA C C 113 180.545 179.905 0.640 1
1 1305 . 2 1 1 A 113 113 ALA CA C 113 55.127 55.310 -0.183 1
1 1306 . 2 1 1 A 113 113 ALA CB C 113 18.854 18.398 0.456 1
1 1307 . 2 1 1 A 113 113 ALA N N 113 123.134 122.810 0.324 1
1 1308 . 2 1 1 A 114 114 ILE H H 114 8.472 8.385 0.087 1
1 1309 . 2 1 1 A 114 114 ILE HA H 114 3.613 3.757 -0.144 1
1 1319 . 2 1 1 A 114 114 ILE C C 114 176.947 177.892 -0.945 1
1 1320 . 2 1 1 A 114 114 ILE CA C 114 66.016 65.062 0.954 1
1 1321 . 2 1 1 A 114 114 ILE CB C 114 38.335 37.949 0.386 1
1 1325 . 2 1 1 A 114 114 ILE N N 114 118.276 118.009 0.267 1
1 1326 . 2 1 1 A 115 115 ARG H H 115 8.181 8.067 0.114 1
1 1327 . 2 1 1 A 115 115 ARG HA H 115 3.835 3.898 -0.063 1
1 1334 . 2 1 1 A 115 115 ARG C C 115 179.588 179.041 0.547 1
1 1335 . 2 1 1 A 115 115 ARG CA C 115 61.072 60.226 0.846 1
1 1336 . 2 1 1 A 115 115 ARG CB C 115 29.975 30.024 -0.049 1
1 1339 . 2 1 1 A 115 115 ARG N N 115 117.921 119.263 -1.342 1
1 1340 . 2 1 1 A 116 116 GLN H H 116 8.395 8.557 -0.162 1
1 1341 . 2 1 1 A 116 116 GLN HA H 116 4.030 4.064 -0.034 1
1 1348 . 2 1 1 A 116 116 GLN C C 116 178.716 178.886 -0.170 1
1 1349 . 2 1 1 A 116 116 GLN CA C 116 58.790 58.872 -0.082 1
1 1350 . 2 1 1 A 116 116 GLN CB C 116 28.248 28.399 -0.151 1
1 1352 . 2 1 1 A 116 116 GLN N N 116 116.842 118.853 -2.011 1
1 1354 . 2 1 1 A 117 117 ALA H H 117 7.902 8.240 -0.338 1
1 1355 . 2 1 1 A 117 117 ALA HA H 117 4.143 4.143 0.000 1
1 1359 . 2 1 1 A 117 117 ALA C C 117 179.685 180.230 -0.545 1
1 1360 . 2 1 1 A 117 117 ALA CA C 117 54.476 54.933 -0.457 1
1 1361 . 2 1 1 A 117 117 ALA CB C 117 18.300 18.349 -0.049 1
1 1362 . 2 1 1 A 117 117 ALA N N 117 122.828 123.078 -0.250 1
1 1363 . 2 1 1 A 118 118 LEU H H 118 7.904 8.099 -0.195 1
1 1364 . 2 1 1 A 118 118 LEU HA H 118 4.119 4.111 0.008 1
1 1374 . 2 1 1 A 118 118 LEU C C 118 178.437 178.578 -0.141 1
1 1375 . 2 1 1 A 118 118 LEU CA C 118 56.781 57.060 -0.279 1
1 1376 . 2 1 1 A 118 118 LEU CB C 118 42.371 41.908 0.463 1
1 1380 . 2 1 1 A 118 118 LEU N N 118 117.632 120.246 -2.614 1
1 1381 . 2 1 1 A 119 119 MET H H 119 7.673 8.209 -0.536 1
1 1382 . 2 1 1 A 119 119 MET HA H 119 4.442 4.233 0.209 1
1 1390 . 2 1 1 A 119 119 MET C C 119 176.680 178.852 -2.172 1
1 1391 . 2 1 1 A 119 119 MET CA C 119 56.432 57.811 -1.379 1
1 1392 . 2 1 1 A 119 119 MET CB C 119 32.769 31.439 1.330 1
1 1395 . 2 1 1 A 119 119 MET N N 119 117.286 117.978 -0.692 1
1 1396 . 2 1 1 A 120 120 SER H H 120 7.878 7.843 0.035 1
1 1397 . 2 1 1 A 120 120 SER HA H 120 4.500 4.268 0.232 1
1 1400 . 2 1 1 A 120 120 SER C C 120 174.742 175.013 -0.271 1
1 1401 . 2 1 1 A 120 120 SER CA C 120 58.962 62.252 -3.290 1
1 1402 . 2 1 1 A 120 120 SER CB C 120 63.853 62.456 1.397 1
1 1403 . 2 1 1 A 120 120 SER N N 120 115.064 115.916 -0.852 1
1 1404 . 2 1 1 A 121 121 GLY H H 121 8.059 7.908 0.151 1
1 1405 . 2 1 1 A 121 121 GLY HA2 H 121 4.231 4.242 -0.011 1
1 1406 . 2 1 1 A 121 121 GLY HA3 H 121 4.112 4.242 -0.130 1
1 1407 . 2 1 1 A 121 121 GLY C C 121 172.065 172.309 -0.244 1
1 1408 . 2 1 1 A 121 121 GLY CA C 121 45.030 46.121 -1.091 1
1 1409 . 2 1 1 A 121 121 GLY N N 121 110.271 107.995 2.276 1
1 1410 . 2 1 1 A 122 122 PRO HA H 122 4.496 4.719 -0.223 1
1 1417 . 2 1 1 A 122 122 PRO CA C 122 63.399 62.513 0.886 1
1 1418 . 2 1 1 A 122 122 PRO CB C 122 32.186 33.212 -1.026 1
1 1 . 3 1 1 A 6 6 SER H H 6 8.337 8.644 -0.307 1
1 2 . 3 1 1 A 6 6 SER HA H 6 4.597 4.534 0.063 1
1 5 . 3 1 1 A 6 6 SER C C 6 174.637 175.190 -0.553 1
1 6 . 3 1 1 A 6 6 SER CA C 6 58.469 58.846 -0.377 1
1 7 . 3 1 1 A 6 6 SER CB C 6 64.221 64.059 0.162 1
1 8 . 3 1 1 A 6 6 SER N N 6 117.887 120.436 -2.549 1
1 9 . 3 1 1 A 7 7 GLY H H 7 8.280 8.457 -0.177 1
1 10 . 3 1 1 A 7 7 GLY HA2 H 7 4.063 3.937 0.126 1
1 11 . 3 1 1 A 7 7 GLY HA3 H 7 4.063 3.938 0.125 1
1 12 . 3 1 1 A 7 7 GLY C C 7 173.724 174.396 -0.672 1
1 13 . 3 1 1 A 7 7 GLY CA C 7 44.941 45.402 -0.461 1
1 14 . 3 1 1 A 7 7 GLY N N 7 110.151 111.962 -1.811 1
1 15 . 3 1 1 A 8 8 THR H H 8 8.212 8.178 0.034 1
1 16 . 3 1 1 A 8 8 THR HA H 8 4.173 4.652 -0.479 1
1 21 . 3 1 1 A 8 8 THR C C 8 174.723 174.482 0.241 1
1 22 . 3 1 1 A 8 8 THR CA C 8 63.622 63.601 0.021 1
1 23 . 3 1 1 A 8 8 THR CB C 8 69.460 68.570 0.890 1
1 25 . 3 1 1 A 8 8 THR N N 8 116.817 116.390 0.427 1
1 26 . 3 1 1 A 9 9 LEU H H 9 9.374 8.672 0.702 1
1 27 . 3 1 1 A 9 9 LEU HA H 9 4.302 4.021 0.281 1
1 37 . 3 1 1 A 9 9 LEU C C 9 177.468 176.585 0.883 1
1 38 . 3 1 1 A 9 9 LEU CA C 9 55.936 57.632 -1.696 1
1 39 . 3 1 1 A 9 9 LEU CB C 9 42.843 42.126 0.717 1
1 43 . 3 1 1 A 9 9 LEU N N 9 127.798 128.752 -0.954 1
1 44 . 3 1 1 A 10 10 ARG H H 10 7.512 7.261 0.251 1
1 45 . 3 1 1 A 10 10 ARG HA H 10 4.199 4.710 -0.511 1
1 52 . 3 1 1 A 10 10 ARG C C 10 172.501 174.047 -1.546 1
1 53 . 3 1 1 A 10 10 ARG CA C 10 56.165 54.382 1.783 1
1 54 . 3 1 1 A 10 10 ARG CB C 10 32.442 33.405 -0.963 1
1 57 . 3 1 1 A 10 10 ARG N N 10 117.979 116.197 1.782 1
1 58 . 3 1 1 A 11 11 GLU H H 11 8.434 8.767 -0.333 1
1 59 . 3 1 1 A 11 11 GLU HA H 11 5.993 5.532 0.461 1
1 64 . 3 1 1 A 11 11 GLU C C 11 174.800 174.634 0.166 1
1 65 . 3 1 1 A 11 11 GLU CA C 11 54.570 55.183 -0.613 1
1 66 . 3 1 1 A 11 11 GLU CB C 11 34.245 33.228 1.017 1
1 68 . 3 1 1 A 11 11 GLU N N 11 120.782 122.319 -1.537 1
1 69 . 3 1 1 A 12 12 GLY H H 12 8.131 7.984 0.147 1
1 70 . 3 1 1 A 12 12 GLY HA2 H 12 4.714 3.276 1.438 1
1 71 . 3 1 1 A 12 12 GLY HA3 H 12 3.763 4.124 -0.361 1
1 72 . 3 1 1 A 12 12 GLY C C 12 171.060 171.698 -0.638 1
1 73 . 3 1 1 A 12 12 GLY CA C 12 45.241 45.123 0.118 1
1 74 . 3 1 1 A 12 12 GLY N N 12 107.457 106.299 1.158 1
1 75 . 3 1 1 A 13 13 TRP H H 13 8.783 8.570 0.213 1
1 76 . 3 1 1 A 13 13 TRP HA H 13 5.152 4.879 0.273 1
1 85 . 3 1 1 A 13 13 TRP C C 13 177.528 176.565 0.963 1
1 86 . 3 1 1 A 13 13 TRP CA C 13 57.783 58.799 -1.016 1
1 87 . 3 1 1 A 13 13 TRP CB C 13 30.222 29.754 0.468 1
1 93 . 3 1 1 A 13 13 TRP N N 13 120.792 121.360 -0.568 1
1 95 . 3 1 1 A 14 14 VAL H H 14 9.179 9.004 0.175 1
1 96 . 3 1 1 A 14 14 VAL HA H 14 4.072 4.587 -0.515 1
1 104 . 3 1 1 A 14 14 VAL C C 14 174.981 173.533 1.448 1
1 105 . 3 1 1 A 14 14 VAL CA C 14 61.741 60.153 1.588 1
1 106 . 3 1 1 A 14 14 VAL CB C 14 35.143 34.982 0.161 1
1 109 . 3 1 1 A 14 14 VAL N N 14 125.476 123.122 2.354 1
1 110 . 3 1 1 A 15 15 VAL H H 15 8.403 8.863 -0.460 1
1 111 . 3 1 1 A 15 15 VAL HA H 15 5.532 5.452 0.080 1
1 119 . 3 1 1 A 15 15 VAL C C 15 175.078 174.175 0.903 1
1 120 . 3 1 1 A 15 15 VAL CA C 15 59.489 59.883 -0.394 1
1 121 . 3 1 1 A 15 15 VAL CB C 15 34.210 35.171 -0.961 1
1 124 . 3 1 1 A 15 15 VAL N N 15 126.189 126.007 0.182 1
1 125 . 3 1 1 A 16 16 HIS H H 16 9.122 8.550 0.572 1
1 126 . 3 1 1 A 16 16 HIS HA H 16 5.823 5.816 0.007 1
1 131 . 3 1 1 A 16 16 HIS C C 16 172.998 172.750 0.248 1
1 132 . 3 1 1 A 16 16 HIS CA C 16 56.253 54.173 2.080 1
1 133 . 3 1 1 A 16 16 HIS CB C 16 34.273 32.804 1.469 1
1 136 . 3 1 1 A 16 16 HIS N N 16 121.152 119.902 1.250 1
1 137 . 3 1 1 A 17 17 TYR H H 17 8.465 8.644 -0.179 1
1 138 . 3 1 1 A 17 17 TYR HA H 17 5.096 4.772 0.324 1
1 145 . 3 1 1 A 17 17 TYR C C 17 173.640 173.118 0.522 1
1 146 . 3 1 1 A 17 17 TYR CA C 17 56.903 56.698 0.205 1
1 147 . 3 1 1 A 17 17 TYR CB C 17 40.103 40.276 -0.173 1
1 152 . 3 1 1 A 17 17 TYR N N 17 115.558 116.562 -1.004 1
1 153 . 3 1 1 A 18 18 SER H H 18 9.122 8.534 0.588 1
1 154 . 3 1 1 A 18 18 SER HA H 18 6.144 5.284 0.860 1
1 157 . 3 1 1 A 18 18 SER C C 18 173.204 175.665 -2.461 1
1 158 . 3 1 1 A 18 18 SER CA C 18 56.640 56.938 -0.298 1
1 159 . 3 1 1 A 18 18 SER CB C 18 68.788 66.430 2.358 1
1 160 . 3 1 1 A 18 18 SER N N 18 118.846 116.178 2.668 1
1 161 . 3 1 1 A 19 19 ASN H H 19 9.053 8.788 0.265 1
1 162 . 3 1 1 A 19 19 ASN HA H 19 4.473 4.858 -0.385 1
1 167 . 3 1 1 A 19 19 ASN C C 19 175.396 174.719 0.677 1
1 168 . 3 1 1 A 19 19 ASN CA C 19 55.373 52.507 2.866 1
1 169 . 3 1 1 A 19 19 ASN CB C 19 36.900 38.075 -1.175 1
1 170 . 3 1 1 A 19 19 ASN N N 19 113.712 117.685 -3.973 1
1 172 . 3 1 1 A 20 20 LYS H H 20 7.677 7.443 0.234 1
1 173 . 3 1 1 A 20 20 LYS HA H 20 4.413 4.434 -0.021 1
1 182 . 3 1 1 A 20 20 LYS C C 20 176.078 177.532 -1.454 1
1 183 . 3 1 1 A 20 20 LYS CA C 20 55.679 56.969 -1.290 1
1 184 . 3 1 1 A 20 20 LYS CB C 20 33.023 34.745 -1.722 1
1 188 . 3 1 1 A 20 20 LYS N N 20 117.213 118.126 -0.913 1
1 189 . 3 1 1 A 21 21 ASP H H 21 7.395 7.492 -0.097 1
1 190 . 3 1 1 A 21 21 ASP HA H 21 4.808 4.736 0.072 1
1 193 . 3 1 1 A 21 21 ASP C C 21 176.413 176.145 0.268 1
1 194 . 3 1 1 A 21 21 ASP CA C 21 53.983 53.910 0.073 1
1 195 . 3 1 1 A 21 21 ASP CB C 21 41.199 42.464 -1.265 1
1 196 . 3 1 1 A 21 21 ASP N N 21 119.879 115.874 4.005 1
1 197 . 3 1 1 A 22 22 THR H H 22 8.593 8.079 0.514 1
1 198 . 3 1 1 A 22 22 THR HA H 22 4.352 4.231 0.121 1
1 203 . 3 1 1 A 22 22 THR C C 22 172.913 173.695 -0.782 1
1 204 . 3 1 1 A 22 22 THR CA C 22 62.691 62.949 -0.258 1
1 205 . 3 1 1 A 22 22 THR CB C 22 68.332 66.448 1.884 1
1 207 . 3 1 1 A 22 22 THR N N 22 116.299 112.900 3.399 1
1 208 . 3 1 1 A 23 23 LEU H H 23 7.645 7.941 -0.296 1
1 209 . 3 1 1 A 23 23 LEU HA H 23 4.318 4.342 -0.024 1
1 219 . 3 1 1 A 23 23 LEU C C 23 176.692 175.564 1.128 1
1 220 . 3 1 1 A 23 23 LEU CA C 23 54.617 54.053 0.564 1
1 221 . 3 1 1 A 23 23 LEU CB C 23 41.939 40.163 1.776 1
1 225 . 3 1 1 A 23 23 LEU N N 23 123.606 121.976 1.630 1
1 226 . 3 1 1 A 24 24 ARG H H 24 8.563 7.605 0.958 1
1 227 . 3 1 1 A 24 24 ARG HA H 24 4.373 4.586 -0.213 1
1 235 . 3 1 1 A 24 24 ARG C C 24 176.584 175.589 0.995 1
1 236 . 3 1 1 A 24 24 ARG CA C 24 57.854 56.045 1.809 1
1 237 . 3 1 1 A 24 24 ARG CB C 24 31.126 29.949 1.177 1
1 240 . 3 1 1 A 24 24 ARG N N 24 127.152 123.669 3.483 1
1 242 . 3 1 1 A 25 25 LYS H H 25 8.633 8.286 0.347 1
1 243 . 3 1 1 A 25 25 LYS HA H 25 4.513 4.919 -0.406 1
1 251 . 3 1 1 A 25 25 LYS C C 25 173.567 174.536 -0.969 1
1 252 . 3 1 1 A 25 25 LYS CA C 25 54.792 54.945 -0.153 1
1 253 . 3 1 1 A 25 25 LYS CB C 25 37.416 34.681 2.735 1
1 257 . 3 1 1 A 25 25 LYS N N 25 122.682 121.004 1.678 1
1 258 . 3 1 1 A 26 26 ARG H H 26 8.303 8.890 -0.587 1
1 259 . 3 1 1 A 26 26 ARG HA H 26 5.153 5.252 -0.099 1
1 266 . 3 1 1 A 26 26 ARG C C 26 174.554 175.274 -0.720 1
1 267 . 3 1 1 A 26 26 ARG CA C 26 55.083 54.713 0.370 1
1 268 . 3 1 1 A 26 26 ARG CB C 26 32.789 32.033 0.756 1
1 271 . 3 1 1 A 26 26 ARG N N 26 121.819 124.338 -2.519 1
1 272 . 3 1 1 A 27 27 HIS H H 27 8.793 9.455 -0.662 1
1 273 . 3 1 1 A 27 27 HIS HA H 27 5.155 5.585 -0.430 1
1 278 . 3 1 1 A 27 27 HIS CA C 27 56.904 54.622 2.282 1
1 279 . 3 1 1 A 27 27 HIS CB C 27 34.683 32.288 2.395 1
1 282 . 3 1 1 A 27 27 HIS N N 27 122.102 120.797 1.305 1
1 283 . 3 1 1 A 28 28 TYR H H 28 9.273 8.287 0.986 1
1 284 . 3 1 1 A 28 28 TYR HA H 28 4.332 4.353 -0.021 1
1 291 . 3 1 1 A 28 28 TYR C C 28 174.730 175.262 -0.532 1
1 292 . 3 1 1 A 28 28 TYR CA C 28 58.680 56.757 1.923 1
1 293 . 3 1 1 A 28 28 TYR CB C 28 38.673 37.788 0.885 1
1 298 . 3 1 1 A 28 28 TYR N N 28 125.605 121.166 4.439 1
1 299 . 3 1 1 A 29 29 TRP H H 29 9.273 8.990 0.283 1
1 300 . 3 1 1 A 29 29 TRP HA H 29 5.543 4.843 0.700 1
1 309 . 3 1 1 A 29 29 TRP C C 29 176.172 176.725 -0.553 1
1 310 . 3 1 1 A 29 29 TRP CA C 29 56.658 57.317 -0.659 1
1 311 . 3 1 1 A 29 29 TRP CB C 29 32.154 30.006 2.148 1
1 317 . 3 1 1 A 29 29 TRP N N 29 131.340 128.148 3.192 1
1 318 . 3 1 1 A 30 30 ARG H H 30 9.164 9.057 0.107 1
1 319 . 3 1 1 A 30 30 ARG HA H 30 5.302 5.362 -0.060 1
1 327 . 3 1 1 A 30 30 ARG C C 30 174.774 174.477 0.297 1
1 328 . 3 1 1 A 30 30 ARG CA C 30 56.271 54.671 1.600 1
1 329 . 3 1 1 A 30 30 ARG CB C 30 34.203 33.976 0.227 1
1 332 . 3 1 1 A 30 30 ARG N N 30 116.040 120.627 -4.587 1
1 334 . 3 1 1 A 31 31 LEU H H 31 9.273 9.594 -0.321 1
1 335 . 3 1 1 A 31 31 LEU HA H 31 5.324 5.457 -0.133 1
1 345 . 3 1 1 A 31 31 LEU C C 31 174.488 174.396 0.092 1
1 346 . 3 1 1 A 31 31 LEU CA C 31 53.807 53.477 0.330 1
1 347 . 3 1 1 A 31 31 LEU CB C 31 46.667 45.744 0.923 1
1 351 . 3 1 1 A 31 31 LEU N N 31 127.075 126.771 0.304 1
1 352 . 3 1 1 A 32 32 ASP H H 32 8.854 8.865 -0.011 1
1 353 . 3 1 1 A 32 32 ASP HA H 32 4.902 5.098 -0.196 1
1 356 . 3 1 1 A 32 32 ASP C C 32 173.474 176.769 -3.295 1
1 357 . 3 1 1 A 32 32 ASP CA C 32 53.104 52.239 0.865 1
1 358 . 3 1 1 A 32 32 ASP CB C 32 42.931 43.964 -1.033 1
1 359 . 3 1 1 A 32 32 ASP N N 32 129.349 125.789 3.560 1
1 360 . 3 1 1 A 33 33 CYS H H 33 8.153 8.811 -0.658 1
1 361 . 3 1 1 A 33 33 CYS HA H 33 4.323 4.322 0.001 1
1 364 . 3 1 1 A 33 33 CYS C C 33 174.476 174.472 0.004 1
1 365 . 3 1 1 A 33 33 CYS CA C 33 59.853 60.231 -0.378 1
1 366 . 3 1 1 A 33 33 CYS CB C 33 27.508 26.861 0.647 1
1 367 . 3 1 1 A 33 33 CYS N N 33 108.439 119.226 -10.787 1
1 368 . 3 1 1 A 34 34 LYS H H 34 9.144 7.733 1.411 1
1 369 . 3 1 1 A 34 34 LYS HA H 34 4.616 4.384 0.232 1
1 378 . 3 1 1 A 34 34 LYS C C 34 177.601 176.391 1.210 1
1 379 . 3 1 1 A 34 34 LYS CA C 34 57.185 56.830 0.355 1
1 380 . 3 1 1 A 34 34 LYS CB C 34 35.623 34.877 0.746 1
1 384 . 3 1 1 A 34 34 LYS N N 34 119.884 118.390 1.494 1
1 385 . 3 1 1 A 35 35 CYS H H 35 9.102 7.750 1.352 1
1 386 . 3 1 1 A 35 35 CYS HA H 35 4.935 4.786 0.149 1
1 389 . 3 1 1 A 35 35 CYS C C 35 172.283 172.309 -0.026 1
1 390 . 3 1 1 A 35 35 CYS CA C 35 57.748 56.815 0.933 1
1 391 . 3 1 1 A 35 35 CYS CB C 35 31.537 30.455 1.082 1
1 392 . 3 1 1 A 35 35 CYS N N 35 120.317 113.862 6.455 1
1 393 . 3 1 1 A 36 36 ILE H H 36 8.213 8.822 -0.609 1
1 394 . 3 1 1 A 36 36 ILE HA H 36 4.617 4.848 -0.231 1
1 404 . 3 1 1 A 36 36 ILE C C 36 175.312 175.109 0.203 1
1 405 . 3 1 1 A 36 36 ILE CA C 36 60.967 60.375 0.592 1
1 406 . 3 1 1 A 36 36 ILE CB C 36 39.718 38.998 0.720 1
1 410 . 3 1 1 A 36 36 ILE N N 36 121.905 119.692 2.213 1
1 411 . 3 1 1 A 37 37 THR H H 37 9.076 8.695 0.381 1
1 412 . 3 1 1 A 37 37 THR HA H 37 4.364 4.423 -0.059 1
1 417 . 3 1 1 A 37 37 THR CA C 37 61.834 62.130 -0.296 1
1 418 . 3 1 1 A 37 37 THR CB C 37 69.237 70.059 -0.822 1
1 420 . 3 1 1 A 37 37 THR N N 37 122.500 123.433 -0.933 1
1 421 . 3 1 1 A 38 38 LEU H H 38 8.263 7.899 0.364 1
1 422 . 3 1 1 A 38 38 LEU HA H 38 4.445 5.072 -0.627 1
1 432 . 3 1 1 A 38 38 LEU CA C 38 55.611 53.014 2.597 1
1 433 . 3 1 1 A 38 38 LEU CB C 38 42.702 45.406 -2.704 1
1 437 . 3 1 1 A 38 38 LEU N N 38 126.987 123.533 3.454 1
1 438 . 3 1 1 A 39 39 PHE H H 39 9.520 8.870 0.650 1
1 439 . 3 1 1 A 39 39 PHE HA H 39 4.998 5.035 -0.037 1
1 447 . 3 1 1 A 39 39 PHE CA C 39 57.331 56.333 0.998 1
1 448 . 3 1 1 A 39 39 PHE CB C 39 42.453 40.929 1.524 1
1 454 . 3 1 1 A 39 39 PHE N N 39 120.545 120.557 -0.012 1
1 455 . 3 1 1 A 40 40 GLN H H 40 9.878 8.916 0.962 1
1 456 . 3 1 1 A 40 40 GLN HA H 40 4.376 4.209 0.167 1
1 463 . 3 1 1 A 40 40 GLN CA C 40 59.513 60.051 -0.538 1
1 464 . 3 1 1 A 40 40 GLN CB C 40 29.317 28.848 0.469 1
1 467 . 3 1 1 A 41 41 ASN H H 41 7.732 8.517 -0.785 1
1 468 . 3 1 1 A 41 41 ASN HA H 41 4.812 5.462 -0.650 1
1 473 . 3 1 1 A 41 41 ASN CA C 41 52.618 51.930 0.688 1
1 474 . 3 1 1 A 41 41 ASN CB C 41 39.362 41.313 -1.951 1
1 475 . 3 1 1 A 41 41 ASN N N 41 107.613 115.470 -7.857 1
1 477 . 3 1 1 A 42 42 ASN HA H 42 3.476 4.064 -0.588 1
1 482 . 3 1 1 A 42 42 ASN C C 42 173.607 175.483 -1.876 1
1 483 . 3 1 1 A 42 42 ASN CA C 42 54.888 54.898 -0.010 1
1 484 . 3 1 1 A 42 42 ASN CB C 42 35.613 37.757 -2.144 1
1 486 . 3 1 1 A 43 43 THR H H 43 8.394 7.641 0.753 1
1 487 . 3 1 1 A 43 43 THR HA H 43 4.403 4.609 -0.206 1
1 492 . 3 1 1 A 43 43 THR C C 43 174.464 173.772 0.692 1
1 493 . 3 1 1 A 43 43 THR CA C 43 61.978 60.090 1.888 1
1 494 . 3 1 1 A 43 43 THR CB C 43 70.036 68.786 1.250 1
1 496 . 3 1 1 A 43 43 THR N N 43 111.795 106.387 5.408 1
1 497 . 3 1 1 A 44 44 THR H H 44 8.058 8.116 -0.058 1
1 498 . 3 1 1 A 44 44 THR HA H 44 4.464 4.714 -0.250 1
1 503 . 3 1 1 A 44 44 THR CA C 44 61.599 60.374 1.225 1
1 504 . 3 1 1 A 44 44 THR CB C 44 69.137 70.977 -1.840 1
1 506 . 3 1 1 A 44 44 THR N N 44 116.514 117.472 -0.958 1
1 507 . 3 1 1 A 45 45 ASN H H 45 6.653 8.501 -1.848 1
1 508 . 3 1 1 A 45 45 ASN HA H 45 4.945 4.749 0.196 1
1 513 . 3 1 1 A 45 45 ASN CA C 45 53.227 52.272 0.955 1
1 514 . 3 1 1 A 45 45 ASN CB C 45 38.483 39.467 -0.984 1
1 516 . 3 1 1 A 46 46 ARG H H 46 8.213 7.937 0.276 1
1 517 . 3 1 1 A 46 46 ARG HA H 46 4.583 4.331 0.252 1
1 524 . 3 1 1 A 46 46 ARG CA C 46 55.487 56.846 -1.359 1
1 525 . 3 1 1 A 46 46 ARG CB C 46 31.153 30.722 0.431 1
1 528 . 3 1 1 A 46 46 ARG N N 46 121.652 120.570 1.082 1
1 529 . 3 1 1 A 47 47 TYR H H 47 7.973 8.750 -0.777 1
1 536 . 3 1 1 A 47 47 TYR CB C 47 39.356 39.158 0.198 1
1 541 . 3 1 1 A 48 48 TYR H H 48 9.023 8.867 0.156 1
1 542 . 3 1 1 A 48 48 TYR HA H 48 4.662 4.436 0.226 1
1 549 . 3 1 1 A 48 48 TYR CB C 48 39.863 39.719 0.144 1
1 554 . 3 1 1 A 48 48 TYR N N 48 121.223 119.995 1.228 1
1 555 . 3 1 1 A 49 49 LYS H H 49 7.134 6.980 0.154 1
1 556 . 3 1 1 A 49 49 LYS HA H 49 4.283 4.458 -0.175 1
1 565 . 3 1 1 A 49 49 LYS CA C 49 55.167 54.429 0.738 1
1 566 . 3 1 1 A 49 49 LYS CB C 49 36.699 35.186 1.513 1
1 570 . 3 1 1 A 49 49 LYS N N 49 117.339 120.052 -2.713 1
1 571 . 3 1 1 A 50 50 GLU H H 50 8.411 9.005 -0.594 1
1 572 . 3 1 1 A 50 50 GLU HA H 50 4.583 5.060 -0.477 1
1 577 . 3 1 1 A 50 50 GLU CA C 50 54.592 54.600 -0.008 1
1 578 . 3 1 1 A 50 50 GLU CB C 50 33.263 33.293 -0.030 1
1 580 . 3 1 1 A 50 50 GLU N N 50 123.825 125.902 -2.077 1
1 581 . 3 1 1 A 51 51 ILE H H 51 9.225 8.950 0.275 1
1 582 . 3 1 1 A 51 51 ILE HA H 51 4.277 4.601 -0.324 1
1 592 . 3 1 1 A 51 51 ILE CA C 51 58.182 58.138 0.044 1
1 593 . 3 1 1 A 51 51 ILE CB C 51 39.663 38.322 1.341 1
1 597 . 3 1 1 A 51 51 ILE N N 51 125.271 126.471 -1.200 1
1 598 . 3 1 1 A 52 52 PRO HA H 52 4.543 4.666 -0.123 1
1 605 . 3 1 1 A 52 52 PRO C C 52 178.340 178.139 0.201 1
1 606 . 3 1 1 A 52 52 PRO CA C 52 62.726 62.830 -0.104 1
1 607 . 3 1 1 A 52 52 PRO CB C 52 32.003 31.853 0.150 1
1 610 . 3 1 1 A 53 53 LEU H H 53 8.723 8.032 0.691 1
1 611 . 3 1 1 A 53 53 LEU HA H 53 3.891 3.879 0.012 1
1 621 . 3 1 1 A 53 53 LEU C C 53 179.673 179.067 0.606 1
1 622 . 3 1 1 A 53 53 LEU CA C 53 58.205 57.485 0.720 1
1 623 . 3 1 1 A 53 53 LEU CB C 53 40.171 41.359 -1.188 1
1 627 . 3 1 1 A 53 53 LEU N N 53 125.150 123.959 1.191 1
1 628 . 3 1 1 A 54 54 SER H H 54 8.360 8.088 0.272 1
1 629 . 3 1 1 A 54 54 SER HA H 54 4.164 4.100 0.064 1
1 632 . 3 1 1 A 54 54 SER C C 54 175.517 177.232 -1.715 1
1 633 . 3 1 1 A 54 54 SER CA C 54 60.193 61.398 -1.205 1
1 634 . 3 1 1 A 54 54 SER CB C 54 62.617 62.882 -0.265 1
1 635 . 3 1 1 A 54 54 SER N N 54 111.266 114.051 -2.785 1
1 636 . 3 1 1 A 55 55 GLU H H 55 7.666 7.862 -0.196 1
1 637 . 3 1 1 A 55 55 GLU HA H 55 4.363 4.132 0.231 1
1 642 . 3 1 1 A 55 55 GLU C C 55 176.753 177.739 -0.986 1
1 643 . 3 1 1 A 55 55 GLU CA C 55 56.200 59.031 -2.831 1
1 644 . 3 1 1 A 55 55 GLU CB C 55 30.526 29.432 1.094 1
1 646 . 3 1 1 A 55 55 GLU N N 55 119.485 119.599 -0.114 1
1 647 . 3 1 1 A 56 56 ILE H H 56 7.601 7.236 0.365 1
1 648 . 3 1 1 A 56 56 ILE HA H 56 3.793 3.930 -0.137 1
1 658 . 3 1 1 A 56 56 ILE C C 56 175.142 176.012 -0.870 1
1 659 . 3 1 1 A 56 56 ILE CA C 56 63.518 62.504 1.014 1
1 660 . 3 1 1 A 56 56 ILE CB C 56 37.169 38.106 -0.937 1
1 664 . 3 1 1 A 56 56 ILE N N 56 120.430 119.915 0.515 1
1 665 . 3 1 1 A 57 57 LEU H H 57 9.263 9.250 0.013 1
1 666 . 3 1 1 A 57 57 LEU HA H 57 4.343 4.368 -0.025 1
1 676 . 3 1 1 A 57 57 LEU C C 57 177.898 176.511 1.387 1
1 677 . 3 1 1 A 57 57 LEU CA C 57 56.569 55.918 0.651 1
1 678 . 3 1 1 A 57 57 LEU CB C 57 41.980 42.559 -0.579 1
1 682 . 3 1 1 A 57 57 LEU N N 57 129.464 129.108 0.356 1
1 683 . 3 1 1 A 58 58 THR H H 58 7.414 7.367 0.047 1
1 684 . 3 1 1 A 58 58 THR HA H 58 4.512 4.892 -0.380 1
1 689 . 3 1 1 A 58 58 THR C C 58 171.314 172.715 -1.401 1
1 690 . 3 1 1 A 58 58 THR CA C 58 60.562 61.339 -0.777 1
1 691 . 3 1 1 A 58 58 THR CB C 58 70.803 73.311 -2.508 1
1 693 . 3 1 1 A 58 58 THR N N 58 109.129 110.495 -1.366 1
1 694 . 3 1 1 A 59 59 VAL H H 59 8.152 8.434 -0.282 1
1 695 . 3 1 1 A 59 59 VAL HA H 59 5.061 5.102 -0.041 1
1 703 . 3 1 1 A 59 59 VAL C C 59 174.985 174.756 0.229 1
1 704 . 3 1 1 A 59 59 VAL CA C 59 61.354 61.153 0.201 1
1 705 . 3 1 1 A 59 59 VAL CB C 59 33.855 34.201 -0.346 1
1 708 . 3 1 1 A 59 59 VAL N N 59 123.676 124.031 -0.355 1
1 709 . 3 1 1 A 60 60 GLU H H 60 9.074 8.780 0.294 1
1 710 . 3 1 1 A 60 60 GLU HA H 60 4.977 4.878 0.099 1
1 715 . 3 1 1 A 60 60 GLU C C 60 176.063 175.140 0.923 1
1 716 . 3 1 1 A 60 60 GLU CA C 60 53.807 54.378 -0.571 1
1 717 . 3 1 1 A 60 60 GLU CB C 60 33.739 33.450 0.289 1
1 719 . 3 1 1 A 60 60 GLU N N 60 125.125 126.194 -1.069 1
1 720 . 3 1 1 A 61 61 SER H H 61 8.763 8.780 -0.017 1
1 721 . 3 1 1 A 61 61 SER HA H 61 4.452 5.012 -0.560 1
1 724 . 3 1 1 A 61 61 SER C C 61 173.288 174.172 -0.884 1
1 725 . 3 1 1 A 61 61 SER CA C 61 59.384 58.018 1.366 1
1 726 . 3 1 1 A 61 61 SER CB C 61 63.390 64.533 -1.143 1
1 727 . 3 1 1 A 61 61 SER N N 61 117.523 118.357 -0.834 1
1 728 . 3 1 1 A 62 62 ALA H H 62 7.293 8.826 -1.533 1
1 729 . 3 1 1 A 62 62 ALA HA H 62 3.817 4.382 -0.565 1
1 733 . 3 1 1 A 62 62 ALA C C 62 176.717 177.757 -1.040 1
1 734 . 3 1 1 A 62 62 ALA CA C 62 53.966 53.113 0.853 1
1 735 . 3 1 1 A 62 62 ALA CB C 62 18.640 18.833 -0.193 1
1 736 . 3 1 1 A 62 62 ALA N N 62 122.650 127.513 -4.863 1
1 737 . 3 1 1 A 63 63 GLN H H 63 8.736 8.069 0.667 1
1 738 . 3 1 1 A 63 63 GLN HA H 63 4.445 4.463 -0.018 1
1 745 . 3 1 1 A 63 63 GLN C C 63 173.700 174.861 -1.161 1
1 746 . 3 1 1 A 63 63 GLN CA C 63 56.376 55.567 0.809 1
1 747 . 3 1 1 A 63 63 GLN CB C 63 31.515 30.966 0.549 1
1 749 . 3 1 1 A 63 63 GLN N N 63 120.251 119.667 0.584 1
1 751 . 3 1 1 A 64 64 ASN H H 64 9.272 7.635 1.637 1
1 752 . 3 1 1 A 64 64 ASN HA H 64 4.906 4.942 -0.036 1
1 757 . 3 1 1 A 64 64 ASN C C 64 174.754 174.474 0.280 1
1 758 . 3 1 1 A 64 64 ASN CA C 64 51.837 52.111 -0.274 1
1 759 . 3 1 1 A 64 64 ASN CB C 64 38.156 40.306 -2.150 1
1 760 . 3 1 1 A 64 64 ASN N N 64 122.346 118.530 3.816 1
1 762 . 3 1 1 A 65 65 PHE H H 65 8.854 9.093 -0.239 1
1 763 . 3 1 1 A 65 65 PHE HA H 65 4.947 5.180 -0.233 1
1 771 . 3 1 1 A 65 65 PHE C C 65 177.274 176.152 1.122 1
1 772 . 3 1 1 A 65 65 PHE CA C 65 57.519 56.617 0.902 1
1 773 . 3 1 1 A 65 65 PHE CB C 65 38.485 38.695 -0.210 1
1 779 . 3 1 1 A 65 65 PHE N N 65 123.638 125.258 -1.620 1
1 780 . 3 1 1 A 66 66 SER H H 66 8.163 8.257 -0.094 1
1 781 . 3 1 1 A 66 66 SER HA H 66 4.393 4.657 -0.264 1
1 784 . 3 1 1 A 66 66 SER C C 66 175.699 175.576 0.123 1
1 785 . 3 1 1 A 66 66 SER CA C 66 60.791 60.325 0.466 1
1 786 . 3 1 1 A 66 66 SER CB C 66 64.591 64.082 0.509 1
1 787 . 3 1 1 A 66 66 SER N N 66 113.913 117.101 -3.188 1
1 788 . 3 1 1 A 67 67 LEU H H 67 8.574 7.855 0.719 1
1 789 . 3 1 1 A 67 67 LEU HA H 67 4.302 3.782 0.520 1
1 799 . 3 1 1 A 67 67 LEU C C 67 176.269 177.321 -1.052 1
1 800 . 3 1 1 A 67 67 LEU CA C 67 55.601 58.240 -2.639 1
1 801 . 3 1 1 A 67 67 LEU CB C 67 42.021 41.919 0.102 1
1 805 . 3 1 1 A 67 67 LEU N N 67 121.264 120.065 1.199 1
1 806 . 3 1 1 A 68 68 VAL H H 68 6.921 7.577 -0.656 1
1 807 . 3 1 1 A 68 68 VAL HA H 68 4.473 4.099 0.374 1
1 815 . 3 1 1 A 68 68 VAL C C 68 173.809 175.196 -1.387 1
1 816 . 3 1 1 A 68 68 VAL CA C 68 58.047 60.940 -2.893 1
1 817 . 3 1 1 A 68 68 VAL CB C 68 32.295 31.619 0.676 1
1 820 . 3 1 1 A 68 68 VAL N N 68 111.287 115.989 -4.702 1
1 821 . 3 1 1 A 69 69 PRO HA H 69 4.658 4.623 0.035 1
1 828 . 3 1 1 A 69 69 PRO CA C 69 61.747 61.656 0.091 1
1 829 . 3 1 1 A 69 69 PRO CB C 69 30.693 32.384 -1.691 1
1 832 . 3 1 1 A 70 70 PRO HA H 70 4.414 4.360 0.054 1
1 839 . 3 1 1 A 70 70 PRO CA C 70 63.997 64.208 -0.211 1
1 840 . 3 1 1 A 70 70 PRO CB C 70 31.602 31.555 0.047 1
1 843 . 3 1 1 A 71 71 GLY H H 71 8.824 8.172 0.652 1
1 844 . 3 1 1 A 71 71 GLY HA2 H 71 3.703 4.026 -0.323 1
1 845 . 3 1 1 A 71 71 GLY HA3 H 71 4.193 4.027 0.166 1
1 846 . 3 1 1 A 71 71 GLY C C 71 174.052 172.992 1.060 1
1 847 . 3 1 1 A 71 71 GLY CA C 71 45.065 45.542 -0.477 1
1 848 . 3 1 1 A 71 71 GLY N N 71 111.845 106.128 5.717 1
1 849 . 3 1 1 A 72 72 THR H H 72 7.597 7.136 0.461 1
1 850 . 3 1 1 A 72 72 THR HA H 72 4.133 4.658 -0.525 1
1 855 . 3 1 1 A 72 72 THR CA C 72 63.129 60.999 2.130 1
1 856 . 3 1 1 A 72 72 THR CB C 72 69.560 71.568 -2.008 1
1 858 . 3 1 1 A 72 72 THR N N 72 117.485 114.369 3.116 1
1 859 . 3 1 1 A 73 73 ASN H H 73 9.280 8.495 0.785 1
1 860 . 3 1 1 A 73 73 ASN HA H 73 4.786 4.598 0.188 1
1 865 . 3 1 1 A 73 73 ASN CA C 73 52.009 52.170 -0.161 1
1 866 . 3 1 1 A 73 73 ASN CB C 73 37.553 38.243 -0.690 1
1 867 . 3 1 1 A 73 73 ASN N N 73 127.641 125.949 1.692 1
1 869 . 3 1 1 A 74 74 PRO HA H 74 4.752 4.795 -0.043 1
1 876 . 3 1 1 A 74 74 PRO C C 74 175.190 176.447 -1.257 1
1 877 . 3 1 1 A 74 74 PRO CA C 74 63.395 62.448 0.947 1
1 878 . 3 1 1 A 74 74 PRO CB C 74 33.164 32.919 0.245 1
1 881 . 3 1 1 A 75 75 HIS H H 75 8.025 8.686 -0.661 1
1 882 . 3 1 1 A 75 75 HIS HA H 75 5.047 4.999 0.048 1
1 887 . 3 1 1 A 75 75 HIS C C 75 172.562 175.540 -2.978 1
1 888 . 3 1 1 A 75 75 HIS CA C 75 54.336 53.655 0.681 1
1 889 . 3 1 1 A 75 75 HIS CB C 75 30.956 32.963 -2.007 1
1 892 . 3 1 1 A 75 75 HIS N N 75 116.198 116.714 -0.516 1
1 893 . 3 1 1 A 76 76 CYS H H 76 8.343 9.521 -1.178 1
1 894 . 3 1 1 A 76 76 CYS HA H 76 4.594 4.464 0.130 1
1 897 . 3 1 1 A 76 76 CYS C C 76 175.651 174.590 1.061 1
1 898 . 3 1 1 A 76 76 CYS CA C 76 61.066 60.736 0.330 1
1 899 . 3 1 1 A 76 76 CYS CB C 76 30.193 29.415 0.778 1
1 900 . 3 1 1 A 76 76 CYS N N 76 113.289 118.521 -5.232 1
1 901 . 3 1 1 A 77 77 PHE H H 77 8.433 8.052 0.381 1
1 902 . 3 1 1 A 77 77 PHE HA H 77 5.105 5.320 -0.215 1
1 910 . 3 1 1 A 77 77 PHE C C 77 171.822 172.895 -1.073 1
1 911 . 3 1 1 A 77 77 PHE CA C 77 56.874 55.910 0.964 1
1 912 . 3 1 1 A 77 77 PHE CB C 77 39.393 42.611 -3.218 1
1 918 . 3 1 1 A 77 77 PHE N N 77 114.874 114.980 -0.106 1
1 919 . 3 1 1 A 78 78 GLU H H 78 9.823 9.138 0.685 1
1 920 . 3 1 1 A 78 78 GLU HA H 78 5.333 5.171 0.162 1
1 925 . 3 1 1 A 78 78 GLU C C 78 175.602 175.588 0.014 1
1 926 . 3 1 1 A 78 78 GLU CA C 78 54.212 54.645 -0.433 1
1 927 . 3 1 1 A 78 78 GLU CB C 78 31.702 32.757 -1.055 1
1 929 . 3 1 1 A 78 78 GLU N N 78 121.074 119.008 2.066 1
1 930 . 3 1 1 A 79 79 ILE H H 79 9.093 9.046 0.047 1
1 931 . 3 1 1 A 79 79 ILE HA H 79 4.637 4.601 0.036 1
1 941 . 3 1 1 A 79 79 ILE C C 79 174.476 175.367 -0.891 1
1 942 . 3 1 1 A 79 79 ILE CA C 79 60.932 60.730 0.202 1
1 943 . 3 1 1 A 79 79 ILE CB C 79 40.803 37.362 3.441 1
1 947 . 3 1 1 A 79 79 ILE N N 79 121.382 124.848 -3.466 1
1 948 . 3 1 1 A 80 80 VAL H H 80 8.841 7.871 0.970 1
1 949 . 3 1 1 A 80 80 VAL HA H 80 4.425 3.853 0.572 1
1 957 . 3 1 1 A 80 80 VAL C C 80 175.930 175.388 0.542 1
1 958 . 3 1 1 A 80 80 VAL CA C 80 63.324 63.093 0.231 1
1 959 . 3 1 1 A 80 80 VAL CB C 80 32.783 31.133 1.650 1
1 962 . 3 1 1 A 80 80 VAL N N 80 128.970 127.238 1.732 1
1 963 . 3 1 1 A 81 81 THR H H 81 8.303 7.727 0.576 1
1 964 . 3 1 1 A 81 81 THR HA H 81 5.264 4.654 0.610 1
1 969 . 3 1 1 A 81 81 THR C C 81 173.664 174.551 -0.887 1
1 970 . 3 1 1 A 81 81 THR CA C 81 59.540 60.050 -0.510 1
1 971 . 3 1 1 A 81 81 THR CB C 81 72.197 71.274 0.923 1
1 973 . 3 1 1 A 81 81 THR N N 81 118.077 118.723 -0.646 1
1 974 . 3 1 1 A 82 82 ALA H H 82 9.586 8.441 1.145 1
1 975 . 3 1 1 A 82 82 ALA HA H 82 4.093 4.460 -0.367 1
1 979 . 3 1 1 A 82 82 ALA C C 82 178.667 177.717 0.950 1
1 980 . 3 1 1 A 82 82 ALA CA C 82 55.321 52.720 2.601 1
1 981 . 3 1 1 A 82 82 ALA CB C 82 18.094 18.394 -0.300 1
1 982 . 3 1 1 A 82 82 ALA N N 82 122.493 123.084 -0.591 1
1 983 . 3 1 1 A 83 83 ASN H H 83 7.923 8.447 -0.524 1
1 984 . 3 1 1 A 83 83 ASN HA H 83 4.808 5.105 -0.297 1
1 989 . 3 1 1 A 83 83 ASN C C 83 174.766 174.467 0.299 1
1 990 . 3 1 1 A 83 83 ASN CA C 83 53.333 54.774 -1.441 1
1 991 . 3 1 1 A 83 83 ASN CB C 83 40.335 41.681 -1.346 1
1 992 . 3 1 1 A 83 83 ASN N N 83 110.765 115.999 -5.234 1
1 994 . 3 1 1 A 84 84 ALA H H 84 7.352 7.236 0.116 1
1 995 . 3 1 1 A 84 84 ALA HA H 84 4.625 4.580 0.045 1
1 999 . 3 1 1 A 84 84 ALA C C 84 176.547 175.420 1.127 1
1 1000 . 3 1 1 A 84 84 ALA CA C 84 52.858 51.793 1.065 1
1 1001 . 3 1 1 A 84 84 ALA CB C 84 21.233 22.154 -0.921 1
1 1002 . 3 1 1 A 84 84 ALA N N 84 119.599 117.755 1.844 1
1 1003 . 3 1 1 A 85 85 THR H H 85 8.374 8.653 -0.279 1
1 1004 . 3 1 1 A 85 85 THR HA H 85 5.014 4.558 0.456 1
1 1009 . 3 1 1 A 85 85 THR C C 85 171.568 174.479 -2.911 1
1 1010 . 3 1 1 A 85 85 THR CA C 85 61.618 63.018 -1.400 1
1 1011 . 3 1 1 A 85 85 THR CB C 85 70.850 68.806 2.044 1
1 1013 . 3 1 1 A 85 85 THR N N 85 119.032 114.426 4.606 1
1 1014 . 3 1 1 A 86 86 TYR H H 86 9.006 9.019 -0.013 1
1 1015 . 3 1 1 A 86 86 TYR HA H 86 4.658 5.001 -0.343 1
1 1022 . 3 1 1 A 86 86 TYR C C 86 173.773 175.384 -1.611 1
1 1023 . 3 1 1 A 86 86 TYR CA C 86 56.938 57.582 -0.644 1
1 1024 . 3 1 1 A 86 86 TYR CB C 86 39.513 40.264 -0.751 1
1 1029 . 3 1 1 A 86 86 TYR N N 86 123.494 127.241 -3.747 1
1 1030 . 3 1 1 A 87 87 PHE H H 87 9.263 8.679 0.584 1
1 1031 . 3 1 1 A 87 87 PHE HA H 87 4.127 4.649 -0.522 1
1 1039 . 3 1 1 A 87 87 PHE C C 87 176.369 173.914 2.455 1
1 1040 . 3 1 1 A 87 87 PHE CA C 87 57.238 55.919 1.319 1
1 1041 . 3 1 1 A 87 87 PHE CB C 87 37.086 38.707 -1.621 1
1 1047 . 3 1 1 A 87 87 PHE N N 87 125.384 119.711 5.673 1
1 1048 . 3 1 1 A 88 88 VAL H H 88 9.023 8.428 0.595 1
1 1049 . 3 1 1 A 88 88 VAL HA H 88 4.162 4.846 -0.684 1
1 1057 . 3 1 1 A 88 88 VAL C C 88 176.390 175.830 0.560 1
1 1058 . 3 1 1 A 88 88 VAL CA C 88 63.975 60.477 3.498 1
1 1059 . 3 1 1 A 88 88 VAL CB C 88 32.378 32.861 -0.483 1
1 1062 . 3 1 1 A 88 88 VAL N N 88 127.348 125.054 2.294 1
1 1063 . 3 1 1 A 89 89 GLY H H 89 9.233 7.651 1.582 1
1 1064 . 3 1 1 A 89 89 GLY HA2 H 89 4.293 4.117 0.176 1
1 1065 . 3 1 1 A 89 89 GLY HA3 H 89 4.186 4.186 0.000 1
1 1066 . 3 1 1 A 89 89 GLY C C 89 172.378 172.470 -0.092 1
1 1067 . 3 1 1 A 89 89 GLY CA C 89 43.798 46.023 -2.225 1
1 1068 . 3 1 1 A 89 89 GLY N N 89 116.041 112.720 3.321 1
1 1069 . 3 1 1 A 90 90 GLU H H 90 8.532 8.408 0.124 1
1 1070 . 3 1 1 A 90 90 GLU HA H 90 4.794 4.378 0.416 1
1 1075 . 3 1 1 A 90 90 GLU C C 90 174.221 175.574 -1.353 1
1 1076 . 3 1 1 A 90 90 GLU CA C 90 56.393 56.421 -0.028 1
1 1077 . 3 1 1 A 90 90 GLU CB C 90 33.182 30.668 2.514 1
1 1079 . 3 1 1 A 90 90 GLU N N 90 120.905 121.571 -0.666 1
1 1080 . 3 1 1 A 91 91 MET H H 91 8.450 8.782 -0.332 1
1 1081 . 3 1 1 A 91 91 MET HA H 91 4.904 5.075 -0.171 1
1 1089 . 3 1 1 A 91 91 MET C C 91 173.373 173.389 -0.016 1
1 1090 . 3 1 1 A 91 91 MET CA C 91 52.277 52.610 -0.333 1
1 1091 . 3 1 1 A 91 91 MET CB C 91 32.789 35.230 -2.441 1
1 1094 . 3 1 1 A 91 91 MET N N 91 125.173 119.361 5.812 1
1 1095 . 3 1 1 A 92 92 PRO HA H 92 4.358 4.273 0.085 1
1 1102 . 3 1 1 A 92 92 PRO C C 92 177.589 176.357 1.232 1
1 1103 . 3 1 1 A 92 92 PRO CA C 92 63.143 63.429 -0.286 1
1 1104 . 3 1 1 A 92 92 PRO CB C 92 32.083 32.412 -0.329 1
1 1107 . 3 1 1 A 93 93 GLY H H 93 8.330 8.365 -0.035 1
1 1108 . 3 1 1 A 93 93 GLY HA2 H 93 3.943 4.184 -0.241 1
1 1109 . 3 1 1 A 93 93 GLY HA3 H 93 4.045 4.185 -0.140 1
1 1110 . 3 1 1 A 93 93 GLY C C 93 174.730 173.936 0.794 1
1 1111 . 3 1 1 A 93 93 GLY CA C 93 45.276 45.366 -0.090 1
1 1112 . 3 1 1 A 93 93 GLY N N 93 109.420 109.948 -0.528 1
1 1113 . 3 1 1 A 94 94 GLY H H 94 8.331 8.879 -0.548 1
1 1114 . 3 1 1 A 94 94 GLY HA2 H 94 3.973 3.869 0.104 1
1 1115 . 3 1 1 A 94 94 GLY HA3 H 94 3.973 3.870 0.103 1
1 1116 . 3 1 1 A 94 94 GLY C C 94 174.100 173.426 0.674 1
1 1117 . 3 1 1 A 94 94 GLY CA C 94 45.333 46.820 -1.487 1
1 1118 . 3 1 1 A 94 94 GLY N N 94 108.483 111.353 -2.870 1
1 1119 . 3 1 1 A 95 95 THR H H 95 8.095 7.983 0.112 1
1 1120 . 3 1 1 A 95 95 THR HA H 95 4.643 5.047 -0.404 1
1 1125 . 3 1 1 A 95 95 THR C C 95 173.155 172.644 0.511 1
1 1126 . 3 1 1 A 95 95 THR CA C 95 59.922 58.533 1.389 1
1 1127 . 3 1 1 A 95 95 THR CB C 95 69.871 69.903 -0.032 1
1 1129 . 3 1 1 A 95 95 THR N N 95 115.860 113.750 2.110 1
1 1130 . 3 1 1 A 96 96 PRO HA H 96 4.400 4.618 -0.218 1
1 1137 . 3 1 1 A 96 96 PRO C C 96 177.565 176.590 0.975 1
1 1138 . 3 1 1 A 96 96 PRO CA C 96 64.047 63.142 0.905 1
1 1139 . 3 1 1 A 96 96 PRO CB C 96 31.816 33.187 -1.371 1
1 1142 . 3 1 1 A 97 97 GLY H H 97 8.572 8.253 0.319 1
1 1143 . 3 1 1 A 97 97 GLY HA2 H 97 4.007 4.041 -0.034 1
1 1144 . 3 1 1 A 97 97 GLY HA3 H 97 4.007 4.041 -0.034 1
1 1145 . 3 1 1 A 97 97 GLY C C 97 174.609 174.280 0.329 1
1 1146 . 3 1 1 A 97 97 GLY CA C 97 45.276 45.838 -0.562 1
1 1147 . 3 1 1 A 97 97 GLY N N 97 110.233 109.045 1.188 1
1 1148 . 3 1 1 A 98 98 GLY H H 98 8.119 7.755 0.364 1
1 1149 . 3 1 1 A 98 98 GLY HA2 H 98 4.086 4.058 0.028 1
1 1150 . 3 1 1 A 98 98 GLY HA3 H 98 4.200 4.059 0.141 1
1 1151 . 3 1 1 A 98 98 GLY CA C 98 44.876 44.247 0.629 1
1 1152 . 3 1 1 A 98 98 GLY N N 98 108.845 105.865 2.980 1
1 1153 . 3 1 1 A 99 99 PRO HA H 99 4.494 4.506 -0.012 1
1 1160 . 3 1 1 A 99 99 PRO C C 99 177.468 176.224 1.244 1
1 1161 . 3 1 1 A 99 99 PRO CA C 99 63.500 63.907 -0.407 1
1 1162 . 3 1 1 A 99 99 PRO CB C 99 32.013 31.624 0.389 1
1 1165 . 3 1 1 A 100 100 SER H H 100 8.472 7.798 0.674 1
1 1166 . 3 1 1 A 100 100 SER HA H 100 4.513 5.121 -0.608 1
1 1169 . 3 1 1 A 100 100 SER C C 100 175.408 173.271 2.137 1
1 1170 . 3 1 1 A 100 100 SER CA C 100 58.557 57.710 0.847 1
1 1171 . 3 1 1 A 100 100 SER CB C 100 63.918 67.201 -3.283 1
1 1172 . 3 1 1 A 100 100 SER N N 100 116.038 114.893 1.145 1
1 1173 . 3 1 1 A 101 101 GLY H H 101 8.427 8.149 0.278 1
1 1174 . 3 1 1 A 101 101 GLY HA2 H 101 4.064 4.180 -0.116 1
1 1175 . 3 1 1 A 101 101 GLY HA3 H 101 4.064 4.181 -0.117 1
1 1176 . 3 1 1 A 101 101 GLY C C 101 174.730 173.043 1.687 1
1 1177 . 3 1 1 A 101 101 GLY CA C 101 45.575 44.979 0.596 1
1 1178 . 3 1 1 A 101 101 GLY N N 101 110.558 109.914 0.644 1
1 1179 . 3 1 1 A 102 102 GLN H H 102 8.416 8.431 -0.015 1
1 1180 . 3 1 1 A 102 102 GLN HA H 102 4.383 4.308 0.075 1
1 1187 . 3 1 1 A 102 102 GLN C C 102 177.346 175.888 1.458 1
1 1188 . 3 1 1 A 102 102 GLN CA C 102 57.080 56.784 0.296 1
1 1189 . 3 1 1 A 102 102 GLN CB C 102 29.235 30.108 -0.873 1
1 1191 . 3 1 1 A 102 102 GLN N N 102 120.112 122.992 -2.880 1
1 1193 . 3 1 1 A 103 103 GLY H H 103 8.713 8.293 0.420 1
1 1194 . 3 1 1 A 103 103 GLY HA2 H 103 4.193 4.252 -0.059 1
1 1195 . 3 1 1 A 103 103 GLY HA3 H 103 4.078 4.267 -0.189 1
1 1196 . 3 1 1 A 103 103 GLY C C 103 175.602 173.914 1.688 1
1 1197 . 3 1 1 A 103 103 GLY CA C 103 46.120 44.308 1.812 1
1 1198 . 3 1 1 A 103 103 GLY N N 103 109.817 107.317 2.500 1
1 1199 . 3 1 1 A 104 104 ALA H H 104 8.366 8.464 -0.098 1
1 1200 . 3 1 1 A 104 104 ALA HA H 104 4.449 4.466 -0.017 1
1 1204 . 3 1 1 A 104 104 ALA C C 104 179.188 178.514 0.674 1
1 1205 . 3 1 1 A 104 104 ALA CA C 104 54.230 53.088 1.142 1
1 1206 . 3 1 1 A 104 104 ALA CB C 104 19.080 20.323 -1.243 1
1 1207 . 3 1 1 A 104 104 ALA N N 104 124.808 121.166 3.642 1
1 1208 . 3 1 1 A 105 105 GLU H H 105 8.576 8.760 -0.184 1
1 1209 . 3 1 1 A 105 105 GLU HA H 105 4.161 4.111 0.050 1
1 1214 . 3 1 1 A 105 105 GLU C C 105 179.200 179.138 0.062 1
1 1215 . 3 1 1 A 105 105 GLU CA C 105 59.173 59.220 -0.047 1
1 1216 . 3 1 1 A 105 105 GLU CB C 105 29.194 28.677 0.517 1
1 1218 . 3 1 1 A 105 105 GLU N N 105 119.238 118.113 1.125 1
1 1219 . 3 1 1 A 106 106 ALA H H 106 8.381 8.128 0.253 1
1 1220 . 3 1 1 A 106 106 ALA HA H 106 4.283 4.117 0.166 1
1 1224 . 3 1 1 A 106 106 ALA C C 106 180.048 179.917 0.131 1
1 1225 . 3 1 1 A 106 106 ALA CA C 106 54.687 55.536 -0.849 1
1 1226 . 3 1 1 A 106 106 ALA CB C 106 18.341 18.873 -0.532 1
1 1227 . 3 1 1 A 106 106 ALA N N 106 123.327 122.669 0.658 1
1 1228 . 3 1 1 A 107 107 ALA H H 107 8.123 8.250 -0.127 1
1 1229 . 3 1 1 A 107 107 ALA HA H 107 4.554 4.368 0.186 1
1 1233 . 3 1 1 A 107 107 ALA C C 107 179.757 179.843 -0.086 1
1 1234 . 3 1 1 A 107 107 ALA CA C 107 55.355 55.410 -0.055 1
1 1235 . 3 1 1 A 107 107 ALA CB C 107 18.939 18.136 0.803 1
1 1236 . 3 1 1 A 107 107 ALA N N 107 120.740 120.155 0.585 1
1 1237 . 3 1 1 A 108 108 ARG H H 108 8.403 8.160 0.243 1
1 1238 . 3 1 1 A 108 108 ARG HA H 108 4.254 4.131 0.123 1
1 1245 . 3 1 1 A 108 108 ARG C C 108 179.111 179.742 -0.631 1
1 1246 . 3 1 1 A 108 108 ARG CA C 108 59.015 59.242 -0.227 1
1 1247 . 3 1 1 A 108 108 ARG CB C 108 29.752 30.008 -0.256 1
1 1250 . 3 1 1 A 108 108 ARG N N 108 119.531 117.818 1.713 1
1 1251 . 3 1 1 A 109 109 GLY H H 109 8.182 8.670 -0.488 1
1 1252 . 3 1 1 A 109 109 GLY HA2 H 109 3.822 3.633 0.189 1
1 1253 . 3 1 1 A 109 109 GLY HA3 H 109 3.822 3.659 0.163 1
1 1254 . 3 1 1 A 109 109 GLY C C 109 177.020 176.411 0.609 1
1 1255 . 3 1 1 A 109 109 GLY CA C 109 46.718 47.306 -0.588 1
1 1256 . 3 1 1 A 109 109 GLY N N 109 107.331 108.310 -0.979 1
1 1257 . 3 1 1 A 110 110 TRP H H 110 7.925 7.974 -0.049 1
1 1258 . 3 1 1 A 110 110 TRP HA H 110 3.963 4.560 -0.597 1
1 1267 . 3 1 1 A 110 110 TRP C C 110 176.691 178.086 -1.395 1
1 1268 . 3 1 1 A 110 110 TRP CA C 110 62.041 60.247 1.794 1
1 1269 . 3 1 1 A 110 110 TRP CB C 110 28.989 29.206 -0.217 1
1 1275 . 3 1 1 A 110 110 TRP N N 110 122.304 122.048 0.256 1
1 1277 . 3 1 1 A 111 111 GLU H H 111 7.946 7.779 0.167 1
1 1278 . 3 1 1 A 111 111 GLU HA H 111 2.594 3.043 -0.449 1
1 1283 . 3 1 1 A 111 111 GLU C C 111 177.976 178.965 -0.989 1
1 1284 . 3 1 1 A 111 111 GLU CA C 111 60.193 58.810 1.383 1
1 1285 . 3 1 1 A 111 111 GLU CB C 111 29.277 29.299 -0.022 1
1 1287 . 3 1 1 A 111 111 GLU N N 111 121.755 119.158 2.597 1
1 1288 . 3 1 1 A 112 112 THR H H 112 7.993 7.767 0.226 1
1 1289 . 3 1 1 A 112 112 THR HA H 112 3.722 3.810 -0.088 1
1 1294 . 3 1 1 A 112 112 THR C C 112 176.038 175.792 0.246 1
1 1295 . 3 1 1 A 112 112 THR CA C 112 66.104 66.616 -0.512 1
1 1296 . 3 1 1 A 112 112 THR CB C 112 68.885 68.557 0.328 1
1 1298 . 3 1 1 A 112 112 THR N N 112 112.247 116.076 -3.829 1
1 1299 . 3 1 1 A 113 113 ALA H H 113 7.742 8.449 -0.707 1
1 1300 . 3 1 1 A 113 113 ALA HA H 113 4.029 3.962 0.067 1
1 1304 . 3 1 1 A 113 113 ALA C C 113 180.545 179.891 0.654 1
1 1305 . 3 1 1 A 113 113 ALA CA C 113 55.127 55.306 -0.179 1
1 1306 . 3 1 1 A 113 113 ALA CB C 113 18.854 18.376 0.478 1
1 1307 . 3 1 1 A 113 113 ALA N N 113 123.134 122.693 0.441 1
1 1308 . 3 1 1 A 114 114 ILE H H 114 8.472 8.517 -0.045 1
1 1309 . 3 1 1 A 114 114 ILE HA H 114 3.613 3.717 -0.104 1
1 1319 . 3 1 1 A 114 114 ILE C C 114 176.947 178.208 -1.261 1
1 1320 . 3 1 1 A 114 114 ILE CA C 114 66.016 65.312 0.704 1
1 1321 . 3 1 1 A 114 114 ILE CB C 114 38.335 37.897 0.438 1
1 1325 . 3 1 1 A 114 114 ILE N N 114 118.276 117.851 0.425 1
1 1326 . 3 1 1 A 115 115 ARG H H 115 8.181 7.894 0.287 1
1 1327 . 3 1 1 A 115 115 ARG HA H 115 3.835 3.960 -0.125 1
1 1334 . 3 1 1 A 115 115 ARG C C 115 179.588 179.107 0.481 1
1 1335 . 3 1 1 A 115 115 ARG CA C 115 61.072 59.886 1.186 1
1 1336 . 3 1 1 A 115 115 ARG CB C 115 29.975 29.717 0.258 1
1 1339 . 3 1 1 A 115 115 ARG N N 115 117.921 120.028 -2.107 1
1 1340 . 3 1 1 A 116 116 GLN H H 116 8.395 8.548 -0.153 1
1 1341 . 3 1 1 A 116 116 GLN HA H 116 4.030 4.055 -0.025 1
1 1348 . 3 1 1 A 116 116 GLN C C 116 178.716 178.991 -0.275 1
1 1349 . 3 1 1 A 116 116 GLN CA C 116 58.790 58.846 -0.056 1
1 1350 . 3 1 1 A 116 116 GLN CB C 116 28.248 28.444 -0.196 1
1 1352 . 3 1 1 A 116 116 GLN N N 116 116.842 118.912 -2.070 1
1 1354 . 3 1 1 A 117 117 ALA H H 117 7.902 8.135 -0.233 1
1 1355 . 3 1 1 A 117 117 ALA HA H 117 4.143 4.134 0.009 1
1 1359 . 3 1 1 A 117 117 ALA C C 117 179.685 180.148 -0.463 1
1 1360 . 3 1 1 A 117 117 ALA CA C 117 54.476 54.920 -0.444 1
1 1361 . 3 1 1 A 117 117 ALA CB C 117 18.300 18.368 -0.068 1
1 1362 . 3 1 1 A 117 117 ALA N N 117 122.828 123.007 -0.179 1
1 1363 . 3 1 1 A 118 118 LEU H H 118 7.904 7.777 0.127 1
1 1364 . 3 1 1 A 118 118 LEU HA H 118 4.119 4.105 0.014 1
1 1374 . 3 1 1 A 118 118 LEU C C 118 178.437 178.750 -0.313 1
1 1375 . 3 1 1 A 118 118 LEU CA C 118 56.781 57.052 -0.271 1
1 1376 . 3 1 1 A 118 118 LEU CB C 118 42.371 41.896 0.475 1
1 1380 . 3 1 1 A 118 118 LEU N N 118 117.632 120.199 -2.567 1
1 1381 . 3 1 1 A 119 119 MET H H 119 7.673 8.198 -0.525 1
1 1382 . 3 1 1 A 119 119 MET HA H 119 4.442 4.219 0.223 1
1 1390 . 3 1 1 A 119 119 MET C C 119 176.680 178.222 -1.542 1
1 1391 . 3 1 1 A 119 119 MET CA C 119 56.432 57.974 -1.542 1
1 1392 . 3 1 1 A 119 119 MET CB C 119 32.769 31.843 0.926 1
1 1395 . 3 1 1 A 119 119 MET N N 119 117.286 117.705 -0.419 1
1 1396 . 3 1 1 A 120 120 SER H H 120 7.878 7.526 0.352 1
1 1397 . 3 1 1 A 120 120 SER HA H 120 4.500 4.217 0.283 1
1 1400 . 3 1 1 A 120 120 SER C C 120 174.742 175.681 -0.939 1
1 1401 . 3 1 1 A 120 120 SER CA C 120 58.962 60.971 -2.009 1
1 1402 . 3 1 1 A 120 120 SER CB C 120 63.853 62.648 1.205 1
1 1403 . 3 1 1 A 120 120 SER N N 120 115.064 114.970 0.094 1
1 1404 . 3 1 1 A 121 121 GLY H H 121 8.059 8.010 0.049 1
1 1405 . 3 1 1 A 121 121 GLY HA2 H 121 4.231 3.872 0.359 1
1 1406 . 3 1 1 A 121 121 GLY HA3 H 121 4.112 3.872 0.240 1
1 1407 . 3 1 1 A 121 121 GLY C C 121 172.065 173.239 -1.174 1
1 1408 . 3 1 1 A 121 121 GLY CA C 121 45.030 46.262 -1.232 1
1 1409 . 3 1 1 A 121 121 GLY N N 121 110.271 107.181 3.090 1
1 1410 . 3 1 1 A 122 122 PRO HA H 122 4.496 4.378 0.118 1
1 1417 . 3 1 1 A 122 122 PRO CA C 122 63.399 63.151 0.248 1
1 1418 . 3 1 1 A 122 122 PRO CB C 122 32.186 32.354 -0.168 1
1 1 . 4 1 1 A 6 6 SER H H 6 8.337 8.574 -0.237 1
1 2 . 4 1 1 A 6 6 SER HA H 6 4.597 4.861 -0.264 1
1 5 . 4 1 1 A 6 6 SER C C 6 174.637 174.416 0.221 1
1 6 . 4 1 1 A 6 6 SER CA C 6 58.469 57.320 1.149 1
1 7 . 4 1 1 A 6 6 SER CB C 6 64.221 67.261 -3.040 1
1 8 . 4 1 1 A 6 6 SER N N 6 117.887 116.783 1.104 1
1 9 . 4 1 1 A 7 7 GLY H H 7 8.280 8.556 -0.276 1
1 10 . 4 1 1 A 7 7 GLY HA2 H 7 4.063 3.862 0.201 1
1 11 . 4 1 1 A 7 7 GLY HA3 H 7 4.063 3.864 0.199 1
1 12 . 4 1 1 A 7 7 GLY C C 7 173.724 173.843 -0.119 1
1 13 . 4 1 1 A 7 7 GLY CA C 7 44.941 47.335 -2.394 1
1 14 . 4 1 1 A 7 7 GLY N N 7 110.151 110.420 -0.269 1
1 15 . 4 1 1 A 8 8 THR H H 8 8.212 8.577 -0.365 1
1 16 . 4 1 1 A 8 8 THR HA H 8 4.173 5.139 -0.966 1
1 21 . 4 1 1 A 8 8 THR C C 8 174.723 174.037 0.686 1
1 22 . 4 1 1 A 8 8 THR CA C 8 63.622 62.358 1.264 1
1 23 . 4 1 1 A 8 8 THR CB C 8 69.460 70.087 -0.627 1
1 25 . 4 1 1 A 8 8 THR N N 8 116.817 118.206 -1.389 1
1 26 . 4 1 1 A 9 9 LEU H H 9 9.374 9.394 -0.020 1
1 27 . 4 1 1 A 9 9 LEU HA H 9 4.302 4.282 0.020 1
1 37 . 4 1 1 A 9 9 LEU C C 9 177.468 176.623 0.845 1
1 38 . 4 1 1 A 9 9 LEU CA C 9 55.936 55.990 -0.054 1
1 39 . 4 1 1 A 9 9 LEU CB C 9 42.843 42.798 0.045 1
1 43 . 4 1 1 A 9 9 LEU N N 9 127.798 127.953 -0.155 1
1 44 . 4 1 1 A 10 10 ARG H H 10 7.512 7.366 0.146 1
1 45 . 4 1 1 A 10 10 ARG HA H 10 4.199 4.690 -0.491 1
1 52 . 4 1 1 A 10 10 ARG C C 10 172.501 173.996 -1.495 1
1 53 . 4 1 1 A 10 10 ARG CA C 10 56.165 54.343 1.822 1
1 54 . 4 1 1 A 10 10 ARG CB C 10 32.442 33.333 -0.891 1
1 57 . 4 1 1 A 10 10 ARG N N 10 117.979 116.965 1.014 1
1 58 . 4 1 1 A 11 11 GLU H H 11 8.434 8.698 -0.264 1
1 59 . 4 1 1 A 11 11 GLU HA H 11 5.993 5.558 0.435 1
1 64 . 4 1 1 A 11 11 GLU C C 11 174.800 174.539 0.261 1
1 65 . 4 1 1 A 11 11 GLU CA C 11 54.570 55.073 -0.503 1
1 66 . 4 1 1 A 11 11 GLU CB C 11 34.245 33.175 1.070 1
1 68 . 4 1 1 A 11 11 GLU N N 11 120.782 121.458 -0.676 1
1 69 . 4 1 1 A 12 12 GLY H H 12 8.131 7.742 0.389 1
1 70 . 4 1 1 A 12 12 GLY HA2 H 12 4.714 3.391 1.323 1
1 71 . 4 1 1 A 12 12 GLY HA3 H 12 3.763 4.114 -0.351 1
1 72 . 4 1 1 A 12 12 GLY C C 12 171.060 171.892 -0.832 1
1 73 . 4 1 1 A 12 12 GLY CA C 12 45.241 44.967 0.274 1
1 74 . 4 1 1 A 12 12 GLY N N 12 107.457 106.133 1.324 1
1 75 . 4 1 1 A 13 13 TRP H H 13 8.783 8.525 0.258 1
1 76 . 4 1 1 A 13 13 TRP HA H 13 5.152 4.934 0.218 1
1 85 . 4 1 1 A 13 13 TRP C C 13 177.528 176.642 0.886 1
1 86 . 4 1 1 A 13 13 TRP CA C 13 57.783 58.742 -0.959 1
1 87 . 4 1 1 A 13 13 TRP CB C 13 30.222 30.173 0.049 1
1 93 . 4 1 1 A 13 13 TRP N N 13 120.792 121.431 -0.639 1
1 95 . 4 1 1 A 14 14 VAL H H 14 9.179 9.055 0.124 1
1 96 . 4 1 1 A 14 14 VAL HA H 14 4.072 4.507 -0.435 1
1 104 . 4 1 1 A 14 14 VAL C C 14 174.981 173.419 1.562 1
1 105 . 4 1 1 A 14 14 VAL CA C 14 61.741 60.361 1.380 1
1 106 . 4 1 1 A 14 14 VAL CB C 14 35.143 35.347 -0.204 1
1 109 . 4 1 1 A 14 14 VAL N N 14 125.476 122.887 2.589 1
1 110 . 4 1 1 A 15 15 VAL H H 15 8.403 8.866 -0.463 1
1 111 . 4 1 1 A 15 15 VAL HA H 15 5.532 5.026 0.506 1
1 119 . 4 1 1 A 15 15 VAL C C 15 175.078 174.573 0.505 1
1 120 . 4 1 1 A 15 15 VAL CA C 15 59.489 59.708 -0.219 1
1 121 . 4 1 1 A 15 15 VAL CB C 15 34.210 34.391 -0.181 1
1 124 . 4 1 1 A 15 15 VAL N N 15 126.189 127.943 -1.754 1
1 125 . 4 1 1 A 16 16 HIS H H 16 9.122 9.192 -0.070 1
1 126 . 4 1 1 A 16 16 HIS HA H 16 5.823 5.775 0.048 1
1 131 . 4 1 1 A 16 16 HIS C C 16 172.998 172.519 0.479 1
1 132 . 4 1 1 A 16 16 HIS CA C 16 56.253 53.850 2.403 1
1 133 . 4 1 1 A 16 16 HIS CB C 16 34.273 33.511 0.762 1
1 136 . 4 1 1 A 16 16 HIS N N 16 121.152 121.147 0.005 1
1 137 . 4 1 1 A 17 17 TYR H H 17 8.465 8.521 -0.056 1
1 138 . 4 1 1 A 17 17 TYR HA H 17 5.096 4.697 0.399 1
1 145 . 4 1 1 A 17 17 TYR C C 17 173.640 173.030 0.610 1
1 146 . 4 1 1 A 17 17 TYR CA C 17 56.903 56.555 0.348 1
1 147 . 4 1 1 A 17 17 TYR CB C 17 40.103 40.163 -0.060 1
1 152 . 4 1 1 A 17 17 TYR N N 17 115.558 116.407 -0.849 1
1 153 . 4 1 1 A 18 18 SER H H 18 9.122 8.587 0.535 1
1 154 . 4 1 1 A 18 18 SER HA H 18 6.144 5.279 0.865 1
1 157 . 4 1 1 A 18 18 SER C C 18 173.204 175.394 -2.190 1
1 158 . 4 1 1 A 18 18 SER CA C 18 56.640 56.900 -0.260 1
1 159 . 4 1 1 A 18 18 SER CB C 18 68.788 66.390 2.398 1
1 160 . 4 1 1 A 18 18 SER N N 18 118.846 115.969 2.877 1
1 161 . 4 1 1 A 19 19 ASN H H 19 9.053 8.765 0.288 1
1 162 . 4 1 1 A 19 19 ASN HA H 19 4.473 4.968 -0.495 1
1 167 . 4 1 1 A 19 19 ASN C C 19 175.396 175.900 -0.504 1
1 168 . 4 1 1 A 19 19 ASN CA C 19 55.373 52.265 3.108 1
1 169 . 4 1 1 A 19 19 ASN CB C 19 36.900 38.101 -1.201 1
1 170 . 4 1 1 A 19 19 ASN N N 19 113.712 117.755 -4.043 1
1 172 . 4 1 1 A 20 20 LYS H H 20 7.677 8.114 -0.437 1
1 173 . 4 1 1 A 20 20 LYS HA H 20 4.413 4.619 -0.206 1
1 182 . 4 1 1 A 20 20 LYS C C 20 176.078 176.863 -0.785 1
1 183 . 4 1 1 A 20 20 LYS CA C 20 55.679 56.865 -1.186 1
1 184 . 4 1 1 A 20 20 LYS CB C 20 33.023 34.698 -1.675 1
1 188 . 4 1 1 A 20 20 LYS N N 20 117.213 116.800 0.413 1
1 189 . 4 1 1 A 21 21 ASP H H 21 7.395 7.890 -0.495 1
1 190 . 4 1 1 A 21 21 ASP HA H 21 4.808 4.752 0.056 1
1 193 . 4 1 1 A 21 21 ASP C C 21 176.413 176.277 0.136 1
1 194 . 4 1 1 A 21 21 ASP CA C 21 53.983 54.017 -0.034 1
1 195 . 4 1 1 A 21 21 ASP CB C 21 41.199 42.997 -1.798 1
1 196 . 4 1 1 A 21 21 ASP N N 21 119.879 117.908 1.971 1
1 197 . 4 1 1 A 22 22 THR H H 22 8.593 8.052 0.541 1
1 198 . 4 1 1 A 22 22 THR HA H 22 4.352 4.083 0.269 1
1 203 . 4 1 1 A 22 22 THR C C 22 172.913 173.765 -0.852 1
1 204 . 4 1 1 A 22 22 THR CA C 22 62.691 62.887 -0.196 1
1 205 . 4 1 1 A 22 22 THR CB C 22 68.332 66.379 1.953 1
1 207 . 4 1 1 A 22 22 THR N N 22 116.299 112.837 3.462 1
1 208 . 4 1 1 A 23 23 LEU H H 23 7.645 7.934 -0.289 1
1 209 . 4 1 1 A 23 23 LEU HA H 23 4.318 4.419 -0.101 1
1 219 . 4 1 1 A 23 23 LEU C C 23 176.692 175.868 0.824 1
1 220 . 4 1 1 A 23 23 LEU CA C 23 54.617 53.864 0.753 1
1 221 . 4 1 1 A 23 23 LEU CB C 23 41.939 40.036 1.903 1
1 225 . 4 1 1 A 23 23 LEU N N 23 123.606 121.951 1.655 1
1 226 . 4 1 1 A 24 24 ARG H H 24 8.563 7.568 0.995 1
1 227 . 4 1 1 A 24 24 ARG HA H 24 4.373 4.556 -0.183 1
1 235 . 4 1 1 A 24 24 ARG C C 24 176.584 175.887 0.697 1
1 236 . 4 1 1 A 24 24 ARG CA C 24 57.854 56.213 1.641 1
1 237 . 4 1 1 A 24 24 ARG CB C 24 31.126 30.538 0.588 1
1 240 . 4 1 1 A 24 24 ARG N N 24 127.152 122.725 4.427 1
1 242 . 4 1 1 A 25 25 LYS H H 25 8.633 8.347 0.286 1
1 243 . 4 1 1 A 25 25 LYS HA H 25 4.513 4.928 -0.415 1
1 251 . 4 1 1 A 25 25 LYS C C 25 173.567 174.639 -1.072 1
1 252 . 4 1 1 A 25 25 LYS CA C 25 54.792 54.423 0.369 1
1 253 . 4 1 1 A 25 25 LYS CB C 25 37.416 35.018 2.398 1
1 257 . 4 1 1 A 25 25 LYS N N 25 122.682 120.541 2.141 1
1 258 . 4 1 1 A 26 26 ARG H H 26 8.303 8.832 -0.529 1
1 259 . 4 1 1 A 26 26 ARG HA H 26 5.153 5.072 0.081 1
1 266 . 4 1 1 A 26 26 ARG C C 26 174.554 175.446 -0.892 1
1 267 . 4 1 1 A 26 26 ARG CA C 26 55.083 55.224 -0.141 1
1 268 . 4 1 1 A 26 26 ARG CB C 26 32.789 31.304 1.485 1
1 271 . 4 1 1 A 26 26 ARG N N 26 121.819 125.223 -3.404 1
1 272 . 4 1 1 A 27 27 HIS H H 27 8.793 9.330 -0.537 1
1 273 . 4 1 1 A 27 27 HIS HA H 27 5.155 5.569 -0.414 1
1 278 . 4 1 1 A 27 27 HIS CA C 27 56.904 54.645 2.259 1
1 279 . 4 1 1 A 27 27 HIS CB C 27 34.683 32.204 2.479 1
1 282 . 4 1 1 A 27 27 HIS N N 27 122.102 120.734 1.368 1
1 283 . 4 1 1 A 28 28 TYR H H 28 9.273 8.342 0.931 1
1 284 . 4 1 1 A 28 28 TYR HA H 28 4.332 4.397 -0.065 1
1 291 . 4 1 1 A 28 28 TYR C C 28 174.730 175.266 -0.536 1
1 292 . 4 1 1 A 28 28 TYR CA C 28 58.680 57.249 1.431 1
1 293 . 4 1 1 A 28 28 TYR CB C 28 38.673 37.918 0.755 1
1 298 . 4 1 1 A 28 28 TYR N N 28 125.605 121.272 4.333 1
1 299 . 4 1 1 A 29 29 TRP H H 29 9.273 9.024 0.249 1
1 300 . 4 1 1 A 29 29 TRP HA H 29 5.543 4.864 0.679 1
1 309 . 4 1 1 A 29 29 TRP C C 29 176.172 176.563 -0.391 1
1 310 . 4 1 1 A 29 29 TRP CA C 29 56.658 56.784 -0.126 1
1 311 . 4 1 1 A 29 29 TRP CB C 29 32.154 30.209 1.945 1
1 317 . 4 1 1 A 29 29 TRP N N 29 131.340 128.192 3.148 1
1 318 . 4 1 1 A 30 30 ARG H H 30 9.164 9.187 -0.023 1
1 319 . 4 1 1 A 30 30 ARG HA H 30 5.302 5.497 -0.195 1
1 327 . 4 1 1 A 30 30 ARG C C 30 174.774 174.528 0.246 1
1 328 . 4 1 1 A 30 30 ARG CA C 30 56.271 54.818 1.453 1
1 329 . 4 1 1 A 30 30 ARG CB C 30 34.203 33.935 0.268 1
1 332 . 4 1 1 A 30 30 ARG N N 30 116.040 120.575 -4.535 1
1 334 . 4 1 1 A 31 31 LEU H H 31 9.273 9.372 -0.099 1
1 335 . 4 1 1 A 31 31 LEU HA H 31 5.324 5.435 -0.111 1
1 345 . 4 1 1 A 31 31 LEU C C 31 174.488 174.520 -0.032 1
1 346 . 4 1 1 A 31 31 LEU CA C 31 53.807 53.494 0.313 1
1 347 . 4 1 1 A 31 31 LEU CB C 31 46.667 45.811 0.856 1
1 351 . 4 1 1 A 31 31 LEU N N 31 127.075 126.857 0.218 1
1 352 . 4 1 1 A 32 32 ASP H H 32 8.854 8.705 0.149 1
1 353 . 4 1 1 A 32 32 ASP HA H 32 4.902 5.100 -0.198 1
1 356 . 4 1 1 A 32 32 ASP C C 32 173.474 176.511 -3.037 1
1 357 . 4 1 1 A 32 32 ASP CA C 32 53.104 52.258 0.846 1
1 358 . 4 1 1 A 32 32 ASP CB C 32 42.931 44.682 -1.751 1
1 359 . 4 1 1 A 32 32 ASP N N 32 129.349 125.358 3.991 1
1 360 . 4 1 1 A 33 33 CYS H H 33 8.153 8.775 -0.622 1
1 361 . 4 1 1 A 33 33 CYS HA H 33 4.323 4.557 -0.234 1
1 364 . 4 1 1 A 33 33 CYS C C 33 174.476 175.651 -1.175 1
1 365 . 4 1 1 A 33 33 CYS CA C 33 59.853 59.382 0.471 1
1 366 . 4 1 1 A 33 33 CYS CB C 33 27.508 27.833 -0.325 1
1 367 . 4 1 1 A 33 33 CYS N N 33 108.439 119.503 -11.064 1
1 368 . 4 1 1 A 34 34 LYS H H 34 9.144 7.756 1.388 1
1 369 . 4 1 1 A 34 34 LYS HA H 34 4.616 4.455 0.161 1
1 378 . 4 1 1 A 34 34 LYS C C 34 177.601 176.346 1.255 1
1 379 . 4 1 1 A 34 34 LYS CA C 34 57.185 56.857 0.328 1
1 380 . 4 1 1 A 34 34 LYS CB C 34 35.623 35.225 0.398 1
1 384 . 4 1 1 A 34 34 LYS N N 34 119.884 119.799 0.085 1
1 385 . 4 1 1 A 35 35 CYS H H 35 9.102 7.774 1.328 1
1 386 . 4 1 1 A 35 35 CYS HA H 35 4.935 4.853 0.082 1
1 389 . 4 1 1 A 35 35 CYS C C 35 172.283 172.340 -0.057 1
1 390 . 4 1 1 A 35 35 CYS CA C 35 57.748 56.776 0.972 1
1 391 . 4 1 1 A 35 35 CYS CB C 35 31.537 30.845 0.692 1
1 392 . 4 1 1 A 35 35 CYS N N 35 120.317 113.933 6.384 1
1 393 . 4 1 1 A 36 36 ILE H H 36 8.213 9.219 -1.006 1
1 394 . 4 1 1 A 36 36 ILE HA H 36 4.617 4.899 -0.282 1
1 404 . 4 1 1 A 36 36 ILE C C 36 175.312 175.126 0.186 1
1 405 . 4 1 1 A 36 36 ILE CA C 36 60.967 60.539 0.428 1
1 406 . 4 1 1 A 36 36 ILE CB C 36 39.718 38.306 1.412 1
1 410 . 4 1 1 A 36 36 ILE N N 36 121.905 120.480 1.425 1
1 411 . 4 1 1 A 37 37 THR H H 37 9.076 8.876 0.200 1
1 412 . 4 1 1 A 37 37 THR HA H 37 4.364 4.603 -0.239 1
1 417 . 4 1 1 A 37 37 THR CA C 37 61.834 62.372 -0.538 1
1 418 . 4 1 1 A 37 37 THR CB C 37 69.237 70.199 -0.962 1
1 420 . 4 1 1 A 37 37 THR N N 37 122.500 123.686 -1.186 1
1 421 . 4 1 1 A 38 38 LEU H H 38 8.263 8.796 -0.533 1
1 422 . 4 1 1 A 38 38 LEU HA H 38 4.445 5.044 -0.599 1
1 432 . 4 1 1 A 38 38 LEU CA C 38 55.611 52.934 2.677 1
1 433 . 4 1 1 A 38 38 LEU CB C 38 42.702 45.792 -3.090 1
1 437 . 4 1 1 A 38 38 LEU N N 38 126.987 123.709 3.278 1
1 438 . 4 1 1 A 39 39 PHE H H 39 9.520 8.389 1.131 1
1 439 . 4 1 1 A 39 39 PHE HA H 39 4.998 4.991 0.007 1
1 447 . 4 1 1 A 39 39 PHE CA C 39 57.331 56.286 1.045 1
1 448 . 4 1 1 A 39 39 PHE CB C 39 42.453 41.012 1.441 1
1 454 . 4 1 1 A 39 39 PHE N N 39 120.545 119.539 1.006 1
1 455 . 4 1 1 A 40 40 GLN H H 40 9.878 8.895 0.983 1
1 456 . 4 1 1 A 40 40 GLN HA H 40 4.376 3.986 0.390 1
1 463 . 4 1 1 A 40 40 GLN CA C 40 59.513 59.577 -0.064 1
1 464 . 4 1 1 A 40 40 GLN CB C 40 29.317 28.892 0.425 1
1 467 . 4 1 1 A 41 41 ASN H H 41 7.732 8.104 -0.372 1
1 468 . 4 1 1 A 41 41 ASN HA H 41 4.812 5.606 -0.794 1
1 473 . 4 1 1 A 41 41 ASN CA C 41 52.618 51.955 0.663 1
1 474 . 4 1 1 A 41 41 ASN CB C 41 39.362 42.106 -2.744 1
1 475 . 4 1 1 A 41 41 ASN N N 41 107.613 114.853 -7.240 1
1 477 . 4 1 1 A 42 42 ASN HA H 42 3.476 4.132 -0.656 1
1 482 . 4 1 1 A 42 42 ASN C C 42 173.607 177.576 -3.969 1
1 483 . 4 1 1 A 42 42 ASN CA C 42 54.888 55.001 -0.113 1
1 484 . 4 1 1 A 42 42 ASN CB C 42 35.613 38.840 -3.227 1
1 486 . 4 1 1 A 43 43 THR H H 43 8.394 7.952 0.442 1
1 487 . 4 1 1 A 43 43 THR HA H 43 4.403 4.142 0.261 1
1 492 . 4 1 1 A 43 43 THR C C 43 174.464 175.133 -0.669 1
1 493 . 4 1 1 A 43 43 THR CA C 43 61.978 64.384 -2.406 1
1 494 . 4 1 1 A 43 43 THR CB C 43 70.036 68.986 1.050 1
1 496 . 4 1 1 A 43 43 THR N N 43 111.795 114.366 -2.571 1
1 497 . 4 1 1 A 44 44 THR H H 44 8.058 7.549 0.509 1
1 498 . 4 1 1 A 44 44 THR HA H 44 4.464 4.391 0.073 1
1 503 . 4 1 1 A 44 44 THR CA C 44 61.599 62.710 -1.111 1
1 504 . 4 1 1 A 44 44 THR CB C 44 69.137 69.189 -0.052 1
1 506 . 4 1 1 A 44 44 THR N N 44 116.514 116.264 0.250 1
1 507 . 4 1 1 A 45 45 ASN H H 45 6.653 8.948 -2.295 1
1 508 . 4 1 1 A 45 45 ASN HA H 45 4.945 4.993 -0.048 1
1 513 . 4 1 1 A 45 45 ASN CA C 45 53.227 54.828 -1.601 1
1 514 . 4 1 1 A 45 45 ASN CB C 45 38.483 39.867 -1.384 1
1 516 . 4 1 1 A 46 46 ARG H H 46 8.213 7.866 0.347 1
1 517 . 4 1 1 A 46 46 ARG HA H 46 4.583 4.563 0.020 1
1 524 . 4 1 1 A 46 46 ARG CA C 46 55.487 56.411 -0.924 1
1 525 . 4 1 1 A 46 46 ARG CB C 46 31.153 30.635 0.518 1
1 528 . 4 1 1 A 46 46 ARG N N 46 121.652 118.509 3.143 1
1 529 . 4 1 1 A 47 47 TYR H H 47 7.973 8.947 -0.974 1
1 536 . 4 1 1 A 47 47 TYR CB C 47 39.356 39.331 0.025 1
1 541 . 4 1 1 A 48 48 TYR H H 48 9.023 8.400 0.623 1
1 542 . 4 1 1 A 48 48 TYR HA H 48 4.662 4.236 0.426 1
1 549 . 4 1 1 A 48 48 TYR CB C 48 39.863 40.274 -0.411 1
1 554 . 4 1 1 A 48 48 TYR N N 48 121.223 120.850 0.373 1
1 555 . 4 1 1 A 49 49 LYS H H 49 7.134 7.230 -0.096 1
1 556 . 4 1 1 A 49 49 LYS HA H 49 4.283 4.403 -0.120 1
1 565 . 4 1 1 A 49 49 LYS CA C 49 55.167 55.467 -0.300 1
1 566 . 4 1 1 A 49 49 LYS CB C 49 36.699 35.973 0.726 1
1 570 . 4 1 1 A 49 49 LYS N N 49 117.339 118.002 -0.663 1
1 571 . 4 1 1 A 50 50 GLU H H 50 8.411 9.192 -0.781 1
1 572 . 4 1 1 A 50 50 GLU HA H 50 4.583 5.003 -0.420 1
1 577 . 4 1 1 A 50 50 GLU CA C 50 54.592 54.999 -0.407 1
1 578 . 4 1 1 A 50 50 GLU CB C 50 33.263 32.246 1.017 1
1 580 . 4 1 1 A 50 50 GLU N N 50 123.825 126.042 -2.217 1
1 581 . 4 1 1 A 51 51 ILE H H 51 9.225 8.960 0.265 1
1 582 . 4 1 1 A 51 51 ILE HA H 51 4.277 4.612 -0.335 1
1 592 . 4 1 1 A 51 51 ILE CA C 51 58.182 58.099 0.083 1
1 593 . 4 1 1 A 51 51 ILE CB C 51 39.663 38.459 1.204 1
1 597 . 4 1 1 A 51 51 ILE N N 51 125.271 126.852 -1.581 1
1 598 . 4 1 1 A 52 52 PRO HA H 52 4.543 4.653 -0.110 1
1 605 . 4 1 1 A 52 52 PRO C C 52 178.340 178.066 0.274 1
1 606 . 4 1 1 A 52 52 PRO CA C 52 62.726 62.913 -0.187 1
1 607 . 4 1 1 A 52 52 PRO CB C 52 32.003 31.753 0.250 1
1 610 . 4 1 1 A 53 53 LEU H H 53 8.723 8.529 0.194 1
1 611 . 4 1 1 A 53 53 LEU HA H 53 3.891 3.942 -0.051 1
1 621 . 4 1 1 A 53 53 LEU C C 53 179.673 178.859 0.814 1
1 622 . 4 1 1 A 53 53 LEU CA C 53 58.205 57.522 0.683 1
1 623 . 4 1 1 A 53 53 LEU CB C 53 40.171 41.713 -1.542 1
1 627 . 4 1 1 A 53 53 LEU N N 53 125.150 124.329 0.821 1
1 628 . 4 1 1 A 54 54 SER H H 54 8.360 8.036 0.324 1
1 629 . 4 1 1 A 54 54 SER HA H 54 4.164 4.134 0.030 1
1 632 . 4 1 1 A 54 54 SER C C 54 175.517 177.485 -1.968 1
1 633 . 4 1 1 A 54 54 SER CA C 54 60.193 61.369 -1.176 1
1 634 . 4 1 1 A 54 54 SER CB C 54 62.617 62.727 -0.110 1
1 635 . 4 1 1 A 54 54 SER N N 54 111.266 114.788 -3.522 1
1 636 . 4 1 1 A 55 55 GLU H H 55 7.666 8.057 -0.391 1
1 637 . 4 1 1 A 55 55 GLU HA H 55 4.363 4.077 0.286 1
1 642 . 4 1 1 A 55 55 GLU C C 55 176.753 177.925 -1.172 1
1 643 . 4 1 1 A 55 55 GLU CA C 55 56.200 59.187 -2.987 1
1 644 . 4 1 1 A 55 55 GLU CB C 55 30.526 29.318 1.208 1
1 646 . 4 1 1 A 55 55 GLU N N 55 119.485 120.507 -1.022 1
1 647 . 4 1 1 A 56 56 ILE H H 56 7.601 7.098 0.503 1
1 648 . 4 1 1 A 56 56 ILE HA H 56 3.793 3.956 -0.163 1
1 658 . 4 1 1 A 56 56 ILE C C 56 175.142 175.963 -0.821 1
1 659 . 4 1 1 A 56 56 ILE CA C 56 63.518 62.217 1.301 1
1 660 . 4 1 1 A 56 56 ILE CB C 56 37.169 37.997 -0.828 1
1 664 . 4 1 1 A 56 56 ILE N N 56 120.430 120.177 0.253 1
1 665 . 4 1 1 A 57 57 LEU H H 57 9.263 9.322 -0.059 1
1 666 . 4 1 1 A 57 57 LEU HA H 57 4.343 4.403 -0.060 1
1 676 . 4 1 1 A 57 57 LEU C C 57 177.898 176.541 1.357 1
1 677 . 4 1 1 A 57 57 LEU CA C 57 56.569 55.952 0.617 1
1 678 . 4 1 1 A 57 57 LEU CB C 57 41.980 42.575 -0.595 1
1 682 . 4 1 1 A 57 57 LEU N N 57 129.464 128.962 0.502 1
1 683 . 4 1 1 A 58 58 THR H H 58 7.414 7.351 0.063 1
1 684 . 4 1 1 A 58 58 THR HA H 58 4.512 4.904 -0.392 1
1 689 . 4 1 1 A 58 58 THR C C 58 171.314 172.721 -1.407 1
1 690 . 4 1 1 A 58 58 THR CA C 58 60.562 61.295 -0.733 1
1 691 . 4 1 1 A 58 58 THR CB C 58 70.803 73.331 -2.528 1
1 693 . 4 1 1 A 58 58 THR N N 58 109.129 110.741 -1.612 1
1 694 . 4 1 1 A 59 59 VAL H H 59 8.152 8.493 -0.341 1
1 695 . 4 1 1 A 59 59 VAL HA H 59 5.061 5.020 0.041 1
1 703 . 4 1 1 A 59 59 VAL C C 59 174.985 174.983 0.002 1
1 704 . 4 1 1 A 59 59 VAL CA C 59 61.354 61.142 0.212 1
1 705 . 4 1 1 A 59 59 VAL CB C 59 33.855 34.044 -0.189 1
1 708 . 4 1 1 A 59 59 VAL N N 59 123.676 124.347 -0.671 1
1 709 . 4 1 1 A 60 60 GLU H H 60 9.074 8.836 0.238 1
1 710 . 4 1 1 A 60 60 GLU HA H 60 4.977 4.881 0.096 1
1 715 . 4 1 1 A 60 60 GLU C C 60 176.063 174.810 1.253 1
1 716 . 4 1 1 A 60 60 GLU CA C 60 53.807 54.377 -0.570 1
1 717 . 4 1 1 A 60 60 GLU CB C 60 33.739 33.369 0.370 1
1 719 . 4 1 1 A 60 60 GLU N N 60 125.125 126.150 -1.025 1
1 720 . 4 1 1 A 61 61 SER H H 61 8.763 8.856 -0.093 1
1 721 . 4 1 1 A 61 61 SER HA H 61 4.452 5.026 -0.574 1
1 724 . 4 1 1 A 61 61 SER C C 61 173.288 174.085 -0.797 1
1 725 . 4 1 1 A 61 61 SER CA C 61 59.384 57.764 1.620 1
1 726 . 4 1 1 A 61 61 SER CB C 61 63.390 64.520 -1.130 1
1 727 . 4 1 1 A 61 61 SER N N 61 117.523 118.431 -0.908 1
1 728 . 4 1 1 A 62 62 ALA H H 62 7.293 8.765 -1.472 1
1 729 . 4 1 1 A 62 62 ALA HA H 62 3.817 4.207 -0.390 1
1 733 . 4 1 1 A 62 62 ALA C C 62 176.717 177.638 -0.921 1
1 734 . 4 1 1 A 62 62 ALA CA C 62 53.966 53.003 0.963 1
1 735 . 4 1 1 A 62 62 ALA CB C 62 18.640 18.652 -0.012 1
1 736 . 4 1 1 A 62 62 ALA N N 62 122.650 127.213 -4.563 1
1 737 . 4 1 1 A 63 63 GLN H H 63 8.736 8.134 0.602 1
1 738 . 4 1 1 A 63 63 GLN HA H 63 4.445 4.718 -0.273 1
1 745 . 4 1 1 A 63 63 GLN C C 63 173.700 174.946 -1.246 1
1 746 . 4 1 1 A 63 63 GLN CA C 63 56.376 55.717 0.659 1
1 747 . 4 1 1 A 63 63 GLN CB C 63 31.515 31.012 0.503 1
1 749 . 4 1 1 A 63 63 GLN N N 63 120.251 119.682 0.569 1
1 751 . 4 1 1 A 64 64 ASN H H 64 9.272 7.123 2.149 1
1 752 . 4 1 1 A 64 64 ASN HA H 64 4.906 5.159 -0.253 1
1 757 . 4 1 1 A 64 64 ASN C C 64 174.754 174.979 -0.225 1
1 758 . 4 1 1 A 64 64 ASN CA C 64 51.837 52.037 -0.200 1
1 759 . 4 1 1 A 64 64 ASN CB C 64 38.156 41.551 -3.395 1
1 760 . 4 1 1 A 64 64 ASN N N 64 122.346 118.138 4.208 1
1 762 . 4 1 1 A 65 65 PHE H H 65 8.854 9.117 -0.263 1
1 763 . 4 1 1 A 65 65 PHE HA H 65 4.947 5.197 -0.250 1
1 771 . 4 1 1 A 65 65 PHE C C 65 177.274 176.502 0.772 1
1 772 . 4 1 1 A 65 65 PHE CA C 65 57.519 57.250 0.269 1
1 773 . 4 1 1 A 65 65 PHE CB C 65 38.485 39.044 -0.559 1
1 779 . 4 1 1 A 65 65 PHE N N 65 123.638 125.226 -1.588 1
1 780 . 4 1 1 A 66 66 SER H H 66 8.163 8.201 -0.038 1
1 781 . 4 1 1 A 66 66 SER HA H 66 4.393 4.294 0.099 1
1 784 . 4 1 1 A 66 66 SER C C 66 175.699 177.397 -1.698 1
1 785 . 4 1 1 A 66 66 SER CA C 66 60.791 61.210 -0.419 1
1 786 . 4 1 1 A 66 66 SER CB C 66 64.591 63.106 1.485 1
1 787 . 4 1 1 A 66 66 SER N N 66 113.913 116.761 -2.848 1
1 788 . 4 1 1 A 67 67 LEU H H 67 8.574 7.818 0.756 1
1 789 . 4 1 1 A 67 67 LEU HA H 67 4.302 3.743 0.559 1
1 799 . 4 1 1 A 67 67 LEU C C 67 176.269 177.300 -1.031 1
1 800 . 4 1 1 A 67 67 LEU CA C 67 55.601 58.201 -2.600 1
1 801 . 4 1 1 A 67 67 LEU CB C 67 42.021 41.853 0.168 1
1 805 . 4 1 1 A 67 67 LEU N N 67 121.264 120.888 0.376 1
1 806 . 4 1 1 A 68 68 VAL H H 68 6.921 7.606 -0.685 1
1 807 . 4 1 1 A 68 68 VAL HA H 68 4.473 4.136 0.337 1
1 815 . 4 1 1 A 68 68 VAL C C 68 173.809 174.940 -1.131 1
1 816 . 4 1 1 A 68 68 VAL CA C 68 58.047 60.587 -2.540 1
1 817 . 4 1 1 A 68 68 VAL CB C 68 32.295 31.984 0.311 1
1 820 . 4 1 1 A 68 68 VAL N N 68 111.287 115.245 -3.958 1
1 821 . 4 1 1 A 69 69 PRO HA H 69 4.658 4.627 0.031 1
1 828 . 4 1 1 A 69 69 PRO CA C 69 61.747 61.684 0.063 1
1 829 . 4 1 1 A 69 69 PRO CB C 69 30.693 32.504 -1.811 1
1 832 . 4 1 1 A 70 70 PRO HA H 70 4.414 4.359 0.055 1
1 839 . 4 1 1 A 70 70 PRO CA C 70 63.997 64.566 -0.569 1
1 840 . 4 1 1 A 70 70 PRO CB C 70 31.602 31.737 -0.135 1
1 843 . 4 1 1 A 71 71 GLY H H 71 8.824 8.490 0.334 1
1 844 . 4 1 1 A 71 71 GLY HA2 H 71 3.703 3.931 -0.228 1
1 845 . 4 1 1 A 71 71 GLY HA3 H 71 4.193 3.932 0.261 1
1 846 . 4 1 1 A 71 71 GLY C C 71 174.052 174.034 0.018 1
1 847 . 4 1 1 A 71 71 GLY CA C 71 45.065 45.594 -0.529 1
1 848 . 4 1 1 A 71 71 GLY N N 71 111.845 106.377 5.468 1
1 849 . 4 1 1 A 72 72 THR H H 72 7.597 7.243 0.354 1
1 850 . 4 1 1 A 72 72 THR HA H 72 4.133 4.308 -0.175 1
1 855 . 4 1 1 A 72 72 THR CA C 72 63.129 62.744 0.385 1
1 856 . 4 1 1 A 72 72 THR CB C 72 69.560 69.267 0.293 1
1 858 . 4 1 1 A 72 72 THR N N 72 117.485 115.320 2.165 1
1 859 . 4 1 1 A 73 73 ASN H H 73 9.280 8.568 0.712 1
1 860 . 4 1 1 A 73 73 ASN HA H 73 4.786 4.607 0.179 1
1 865 . 4 1 1 A 73 73 ASN CA C 73 52.009 52.280 -0.271 1
1 866 . 4 1 1 A 73 73 ASN CB C 73 37.553 38.248 -0.695 1
1 867 . 4 1 1 A 73 73 ASN N N 73 127.641 125.819 1.822 1
1 869 . 4 1 1 A 74 74 PRO HA H 74 4.752 4.928 -0.176 1
1 876 . 4 1 1 A 74 74 PRO C C 74 175.190 176.644 -1.454 1
1 877 . 4 1 1 A 74 74 PRO CA C 74 63.395 62.522 0.873 1
1 878 . 4 1 1 A 74 74 PRO CB C 74 33.164 33.328 -0.164 1
1 881 . 4 1 1 A 75 75 HIS H H 75 8.025 9.084 -1.059 1
1 882 . 4 1 1 A 75 75 HIS HA H 75 5.047 5.185 -0.138 1
1 887 . 4 1 1 A 75 75 HIS C C 75 172.562 175.404 -2.842 1
1 888 . 4 1 1 A 75 75 HIS CA C 75 54.336 53.610 0.726 1
1 889 . 4 1 1 A 75 75 HIS CB C 75 30.956 33.189 -2.233 1
1 892 . 4 1 1 A 75 75 HIS N N 75 116.198 116.780 -0.582 1
1 893 . 4 1 1 A 76 76 CYS H H 76 8.343 9.358 -1.015 1
1 894 . 4 1 1 A 76 76 CYS HA H 76 4.594 4.405 0.189 1
1 897 . 4 1 1 A 76 76 CYS C C 76 175.651 174.799 0.852 1
1 898 . 4 1 1 A 76 76 CYS CA C 76 61.066 61.335 -0.269 1
1 899 . 4 1 1 A 76 76 CYS CB C 76 30.193 28.258 1.935 1
1 900 . 4 1 1 A 76 76 CYS N N 76 113.289 118.082 -4.793 1
1 901 . 4 1 1 A 77 77 PHE H H 77 8.433 7.902 0.531 1
1 902 . 4 1 1 A 77 77 PHE HA H 77 5.105 5.382 -0.277 1
1 910 . 4 1 1 A 77 77 PHE C C 77 171.822 172.973 -1.151 1
1 911 . 4 1 1 A 77 77 PHE CA C 77 56.874 55.652 1.222 1
1 912 . 4 1 1 A 77 77 PHE CB C 77 39.393 42.929 -3.536 1
1 918 . 4 1 1 A 77 77 PHE N N 77 114.874 114.620 0.254 1
1 919 . 4 1 1 A 78 78 GLU H H 78 9.823 9.192 0.631 1
1 920 . 4 1 1 A 78 78 GLU HA H 78 5.333 5.206 0.127 1
1 925 . 4 1 1 A 78 78 GLU C C 78 175.602 175.546 0.056 1
1 926 . 4 1 1 A 78 78 GLU CA C 78 54.212 54.850 -0.638 1
1 927 . 4 1 1 A 78 78 GLU CB C 78 31.702 32.565 -0.863 1
1 929 . 4 1 1 A 78 78 GLU N N 78 121.074 119.175 1.899 1
1 930 . 4 1 1 A 79 79 ILE H H 79 9.093 9.085 0.008 1
1 931 . 4 1 1 A 79 79 ILE HA H 79 4.637 4.574 0.063 1
1 941 . 4 1 1 A 79 79 ILE C C 79 174.476 175.443 -0.967 1
1 942 . 4 1 1 A 79 79 ILE CA C 79 60.932 60.604 0.328 1
1 943 . 4 1 1 A 79 79 ILE CB C 79 40.803 37.315 3.488 1
1 947 . 4 1 1 A 79 79 ILE N N 79 121.382 125.195 -3.813 1
1 948 . 4 1 1 A 80 80 VAL H H 80 8.841 8.009 0.832 1
1 949 . 4 1 1 A 80 80 VAL HA H 80 4.425 3.934 0.491 1
1 957 . 4 1 1 A 80 80 VAL C C 80 175.930 175.514 0.416 1
1 958 . 4 1 1 A 80 80 VAL CA C 80 63.324 63.111 0.213 1
1 959 . 4 1 1 A 80 80 VAL CB C 80 32.783 31.233 1.550 1
1 962 . 4 1 1 A 80 80 VAL N N 80 128.970 128.103 0.867 1
1 963 . 4 1 1 A 81 81 THR H H 81 8.303 7.841 0.462 1
1 964 . 4 1 1 A 81 81 THR HA H 81 5.264 4.775 0.489 1
1 969 . 4 1 1 A 81 81 THR C C 81 173.664 174.518 -0.854 1
1 970 . 4 1 1 A 81 81 THR CA C 81 59.540 59.715 -0.175 1
1 971 . 4 1 1 A 81 81 THR CB C 81 72.197 71.630 0.567 1
1 973 . 4 1 1 A 81 81 THR N N 81 118.077 118.305 -0.228 1
1 974 . 4 1 1 A 82 82 ALA H H 82 9.586 8.514 1.072 1
1 975 . 4 1 1 A 82 82 ALA HA H 82 4.093 4.417 -0.324 1
1 979 . 4 1 1 A 82 82 ALA C C 82 178.667 177.690 0.977 1
1 980 . 4 1 1 A 82 82 ALA CA C 82 55.321 52.756 2.565 1
1 981 . 4 1 1 A 82 82 ALA CB C 82 18.094 18.189 -0.095 1
1 982 . 4 1 1 A 82 82 ALA N N 82 122.493 123.140 -0.647 1
1 983 . 4 1 1 A 83 83 ASN H H 83 7.923 8.469 -0.546 1
1 984 . 4 1 1 A 83 83 ASN HA H 83 4.808 5.113 -0.305 1
1 989 . 4 1 1 A 83 83 ASN C C 83 174.766 174.512 0.254 1
1 990 . 4 1 1 A 83 83 ASN CA C 83 53.333 54.794 -1.461 1
1 991 . 4 1 1 A 83 83 ASN CB C 83 40.335 41.708 -1.373 1
1 992 . 4 1 1 A 83 83 ASN N N 83 110.765 115.918 -5.153 1
1 994 . 4 1 1 A 84 84 ALA H H 84 7.352 7.174 0.178 1
1 995 . 4 1 1 A 84 84 ALA HA H 84 4.625 4.531 0.094 1
1 999 . 4 1 1 A 84 84 ALA C C 84 176.547 175.181 1.366 1
1 1000 . 4 1 1 A 84 84 ALA CA C 84 52.858 51.862 0.996 1
1 1001 . 4 1 1 A 84 84 ALA CB C 84 21.233 22.070 -0.837 1
1 1002 . 4 1 1 A 84 84 ALA N N 84 119.599 117.993 1.606 1
1 1003 . 4 1 1 A 85 85 THR H H 85 8.374 8.661 -0.287 1
1 1004 . 4 1 1 A 85 85 THR HA H 85 5.014 4.616 0.398 1
1 1009 . 4 1 1 A 85 85 THR C C 85 171.568 174.366 -2.798 1
1 1010 . 4 1 1 A 85 85 THR CA C 85 61.618 62.883 -1.265 1
1 1011 . 4 1 1 A 85 85 THR CB C 85 70.850 68.998 1.852 1
1 1013 . 4 1 1 A 85 85 THR N N 85 119.032 113.845 5.187 1
1 1014 . 4 1 1 A 86 86 TYR H H 86 9.006 9.079 -0.073 1
1 1015 . 4 1 1 A 86 86 TYR HA H 86 4.658 4.994 -0.336 1
1 1022 . 4 1 1 A 86 86 TYR C C 86 173.773 175.329 -1.556 1
1 1023 . 4 1 1 A 86 86 TYR CA C 86 56.938 57.481 -0.543 1
1 1024 . 4 1 1 A 86 86 TYR CB C 86 39.513 40.473 -0.960 1
1 1029 . 4 1 1 A 86 86 TYR N N 86 123.494 127.058 -3.564 1
1 1030 . 4 1 1 A 87 87 PHE H H 87 9.263 8.637 0.626 1
1 1031 . 4 1 1 A 87 87 PHE HA H 87 4.127 4.576 -0.449 1
1 1039 . 4 1 1 A 87 87 PHE C C 87 176.369 174.148 2.221 1
1 1040 . 4 1 1 A 87 87 PHE CA C 87 57.238 55.474 1.764 1
1 1041 . 4 1 1 A 87 87 PHE CB C 87 37.086 38.252 -1.166 1
1 1047 . 4 1 1 A 87 87 PHE N N 87 125.384 119.722 5.662 1
1 1048 . 4 1 1 A 88 88 VAL H H 88 9.023 8.384 0.639 1
1 1049 . 4 1 1 A 88 88 VAL HA H 88 4.162 4.740 -0.578 1
1 1057 . 4 1 1 A 88 88 VAL C C 88 176.390 175.710 0.680 1
1 1058 . 4 1 1 A 88 88 VAL CA C 88 63.975 60.568 3.407 1
1 1059 . 4 1 1 A 88 88 VAL CB C 88 32.378 32.626 -0.248 1
1 1062 . 4 1 1 A 88 88 VAL N N 88 127.348 124.141 3.207 1
1 1063 . 4 1 1 A 89 89 GLY H H 89 9.233 7.822 1.411 1
1 1064 . 4 1 1 A 89 89 GLY HA2 H 89 4.293 4.137 0.156 1
1 1065 . 4 1 1 A 89 89 GLY HA3 H 89 4.186 4.220 -0.034 1
1 1066 . 4 1 1 A 89 89 GLY C C 89 172.378 172.230 0.148 1
1 1067 . 4 1 1 A 89 89 GLY CA C 89 43.798 46.317 -2.519 1
1 1068 . 4 1 1 A 89 89 GLY N N 89 116.041 112.509 3.532 1
1 1069 . 4 1 1 A 90 90 GLU H H 90 8.532 8.796 -0.264 1
1 1070 . 4 1 1 A 90 90 GLU HA H 90 4.794 4.879 -0.085 1
1 1075 . 4 1 1 A 90 90 GLU C C 90 174.221 175.080 -0.859 1
1 1076 . 4 1 1 A 90 90 GLU CA C 90 56.393 54.462 1.931 1
1 1077 . 4 1 1 A 90 90 GLU CB C 90 33.182 31.736 1.446 1
1 1079 . 4 1 1 A 90 90 GLU N N 90 120.905 121.547 -0.642 1
1 1080 . 4 1 1 A 91 91 MET H H 91 8.450 8.756 -0.306 1
1 1081 . 4 1 1 A 91 91 MET HA H 91 4.904 5.225 -0.321 1
1 1089 . 4 1 1 A 91 91 MET C C 91 173.373 173.673 -0.300 1
1 1090 . 4 1 1 A 91 91 MET CA C 91 52.277 52.457 -0.180 1
1 1091 . 4 1 1 A 91 91 MET CB C 91 32.789 34.422 -1.633 1
1 1094 . 4 1 1 A 91 91 MET N N 91 125.173 116.529 8.644 1
1 1095 . 4 1 1 A 92 92 PRO HA H 92 4.358 4.626 -0.268 1
1 1102 . 4 1 1 A 92 92 PRO C C 92 177.589 177.502 0.087 1
1 1103 . 4 1 1 A 92 92 PRO CA C 92 63.143 62.721 0.422 1
1 1104 . 4 1 1 A 92 92 PRO CB C 92 32.083 31.580 0.503 1
1 1107 . 4 1 1 A 93 93 GLY H H 93 8.330 8.592 -0.262 1
1 1108 . 4 1 1 A 93 93 GLY HA2 H 93 3.943 3.846 0.097 1
1 1109 . 4 1 1 A 93 93 GLY HA3 H 93 4.045 3.853 0.192 1
1 1110 . 4 1 1 A 93 93 GLY C C 93 174.730 174.809 -0.079 1
1 1111 . 4 1 1 A 93 93 GLY CA C 93 45.276 46.905 -1.629 1
1 1112 . 4 1 1 A 93 93 GLY N N 93 109.420 110.701 -1.281 1
1 1113 . 4 1 1 A 94 94 GLY H H 94 8.331 7.954 0.377 1
1 1114 . 4 1 1 A 94 94 GLY HA2 H 94 3.973 4.024 -0.051 1
1 1115 . 4 1 1 A 94 94 GLY HA3 H 94 3.973 4.027 -0.054 1
1 1116 . 4 1 1 A 94 94 GLY C C 94 174.100 173.934 0.166 1
1 1117 . 4 1 1 A 94 94 GLY CA C 94 45.333 45.677 -0.344 1
1 1118 . 4 1 1 A 94 94 GLY N N 94 108.483 106.356 2.127 1
1 1119 . 4 1 1 A 95 95 THR H H 95 8.095 8.168 -0.073 1
1 1120 . 4 1 1 A 95 95 THR HA H 95 4.643 4.571 0.072 1
1 1125 . 4 1 1 A 95 95 THR C C 95 173.155 173.961 -0.806 1
1 1126 . 4 1 1 A 95 95 THR CA C 95 59.922 60.640 -0.718 1
1 1127 . 4 1 1 A 95 95 THR CB C 95 69.871 68.978 0.893 1
1 1129 . 4 1 1 A 95 95 THR N N 95 115.860 117.902 -2.042 1
1 1130 . 4 1 1 A 96 96 PRO HA H 96 4.400 4.246 0.154 1
1 1137 . 4 1 1 A 96 96 PRO C C 96 177.565 176.999 0.566 1
1 1138 . 4 1 1 A 96 96 PRO CA C 96 64.047 63.638 0.409 1
1 1139 . 4 1 1 A 96 96 PRO CB C 96 31.816 31.726 0.090 1
1 1142 . 4 1 1 A 97 97 GLY H H 97 8.572 8.547 0.025 1
1 1143 . 4 1 1 A 97 97 GLY HA2 H 97 4.007 4.141 -0.134 1
1 1144 . 4 1 1 A 97 97 GLY HA3 H 97 4.007 4.143 -0.136 1
1 1145 . 4 1 1 A 97 97 GLY C C 97 174.609 174.458 0.151 1
1 1146 . 4 1 1 A 97 97 GLY CA C 97 45.276 44.468 0.808 1
1 1147 . 4 1 1 A 97 97 GLY N N 97 110.233 112.323 -2.090 1
1 1148 . 4 1 1 A 98 98 GLY H H 98 8.119 8.454 -0.335 1
1 1149 . 4 1 1 A 98 98 GLY HA2 H 98 4.086 3.883 0.203 1
1 1150 . 4 1 1 A 98 98 GLY HA3 H 98 4.200 3.889 0.311 1
1 1151 . 4 1 1 A 98 98 GLY CA C 98 44.876 44.891 -0.015 1
1 1152 . 4 1 1 A 98 98 GLY N N 98 108.845 113.389 -4.544 1
1 1153 . 4 1 1 A 99 99 PRO HA H 99 4.494 4.513 -0.019 1
1 1160 . 4 1 1 A 99 99 PRO C C 99 177.468 177.819 -0.351 1
1 1161 . 4 1 1 A 99 99 PRO CA C 99 63.500 62.225 1.275 1
1 1162 . 4 1 1 A 99 99 PRO CB C 99 32.013 29.952 2.061 1
1 1165 . 4 1 1 A 100 100 SER H H 100 8.472 8.369 0.103 1
1 1166 . 4 1 1 A 100 100 SER HA H 100 4.513 4.170 0.343 1
1 1169 . 4 1 1 A 100 100 SER C C 100 175.408 175.196 0.212 1
1 1170 . 4 1 1 A 100 100 SER CA C 100 58.557 61.632 -3.075 1
1 1171 . 4 1 1 A 100 100 SER CB C 100 63.918 63.370 0.548 1
1 1172 . 4 1 1 A 100 100 SER N N 100 116.038 119.355 -3.317 1
1 1173 . 4 1 1 A 101 101 GLY H H 101 8.427 7.915 0.512 1
1 1174 . 4 1 1 A 101 101 GLY HA2 H 101 4.064 3.911 0.153 1
1 1175 . 4 1 1 A 101 101 GLY HA3 H 101 4.064 3.920 0.144 1
1 1176 . 4 1 1 A 101 101 GLY C C 101 174.730 175.061 -0.331 1
1 1177 . 4 1 1 A 101 101 GLY CA C 101 45.575 46.544 -0.969 1
1 1178 . 4 1 1 A 101 101 GLY N N 101 110.558 108.621 1.937 1
1 1179 . 4 1 1 A 102 102 GLN H H 102 8.416 8.366 0.050 1
1 1180 . 4 1 1 A 102 102 GLN HA H 102 4.383 4.142 0.241 1
1 1187 . 4 1 1 A 102 102 GLN C C 102 177.346 176.774 0.572 1
1 1188 . 4 1 1 A 102 102 GLN CA C 102 57.080 58.218 -1.138 1
1 1189 . 4 1 1 A 102 102 GLN CB C 102 29.235 28.400 0.835 1
1 1191 . 4 1 1 A 102 102 GLN N N 102 120.112 118.465 1.647 1
1 1193 . 4 1 1 A 103 103 GLY H H 103 8.713 8.323 0.390 1
1 1194 . 4 1 1 A 103 103 GLY HA2 H 103 4.193 3.917 0.276 1
1 1195 . 4 1 1 A 103 103 GLY HA3 H 103 4.078 3.934 0.144 1
1 1196 . 4 1 1 A 103 103 GLY C C 103 175.602 174.566 1.036 1
1 1197 . 4 1 1 A 103 103 GLY CA C 103 46.120 47.161 -1.041 1
1 1198 . 4 1 1 A 103 103 GLY N N 103 109.817 108.520 1.297 1
1 1199 . 4 1 1 A 104 104 ALA H H 104 8.366 7.775 0.591 1
1 1200 . 4 1 1 A 104 104 ALA HA H 104 4.449 4.685 -0.236 1
1 1204 . 4 1 1 A 104 104 ALA C C 104 179.188 178.191 0.997 1
1 1205 . 4 1 1 A 104 104 ALA CA C 104 54.230 53.168 1.062 1
1 1206 . 4 1 1 A 104 104 ALA CB C 104 19.080 20.581 -1.501 1
1 1207 . 4 1 1 A 104 104 ALA N N 104 124.808 120.559 4.249 1
1 1208 . 4 1 1 A 105 105 GLU H H 105 8.576 8.835 -0.259 1
1 1209 . 4 1 1 A 105 105 GLU HA H 105 4.161 4.116 0.045 1
1 1214 . 4 1 1 A 105 105 GLU C C 105 179.200 179.325 -0.125 1
1 1215 . 4 1 1 A 105 105 GLU CA C 105 59.173 59.160 0.013 1
1 1216 . 4 1 1 A 105 105 GLU CB C 105 29.194 29.076 0.118 1
1 1218 . 4 1 1 A 105 105 GLU N N 105 119.238 118.661 0.577 1
1 1219 . 4 1 1 A 106 106 ALA H H 106 8.381 7.997 0.384 1
1 1220 . 4 1 1 A 106 106 ALA HA H 106 4.283 4.233 0.050 1
1 1224 . 4 1 1 A 106 106 ALA C C 106 180.048 179.848 0.200 1
1 1225 . 4 1 1 A 106 106 ALA CA C 106 54.687 55.092 -0.405 1
1 1226 . 4 1 1 A 106 106 ALA CB C 106 18.341 18.459 -0.118 1
1 1227 . 4 1 1 A 106 106 ALA N N 106 123.327 123.407 -0.080 1
1 1228 . 4 1 1 A 107 107 ALA H H 107 8.123 8.218 -0.095 1
1 1229 . 4 1 1 A 107 107 ALA HA H 107 4.554 4.321 0.233 1
1 1233 . 4 1 1 A 107 107 ALA C C 107 179.757 179.899 -0.142 1
1 1234 . 4 1 1 A 107 107 ALA CA C 107 55.355 55.636 -0.281 1
1 1235 . 4 1 1 A 107 107 ALA CB C 107 18.939 18.513 0.426 1
1 1236 . 4 1 1 A 107 107 ALA N N 107 120.740 120.028 0.712 1
1 1237 . 4 1 1 A 108 108 ARG H H 108 8.403 7.908 0.495 1
1 1238 . 4 1 1 A 108 108 ARG HA H 108 4.254 4.188 0.066 1
1 1245 . 4 1 1 A 108 108 ARG C C 108 179.111 178.771 0.340 1
1 1246 . 4 1 1 A 108 108 ARG CA C 108 59.015 58.435 0.580 1
1 1247 . 4 1 1 A 108 108 ARG CB C 108 29.752 29.876 -0.124 1
1 1250 . 4 1 1 A 108 108 ARG N N 108 119.531 117.193 2.338 1
1 1251 . 4 1 1 A 109 109 GLY H H 109 8.182 7.965 0.217 1
1 1252 . 4 1 1 A 109 109 GLY HA2 H 109 3.822 3.604 0.218 1
1 1253 . 4 1 1 A 109 109 GLY HA3 H 109 3.822 3.623 0.199 1
1 1254 . 4 1 1 A 109 109 GLY C C 109 177.020 176.580 0.440 1
1 1255 . 4 1 1 A 109 109 GLY CA C 109 46.718 47.331 -0.613 1
1 1256 . 4 1 1 A 109 109 GLY N N 109 107.331 108.127 -0.796 1
1 1257 . 4 1 1 A 110 110 TRP H H 110 7.925 8.076 -0.151 1
1 1258 . 4 1 1 A 110 110 TRP HA H 110 3.963 4.595 -0.632 1
1 1267 . 4 1 1 A 110 110 TRP C C 110 176.691 177.905 -1.214 1
1 1268 . 4 1 1 A 110 110 TRP CA C 110 62.041 60.580 1.461 1
1 1269 . 4 1 1 A 110 110 TRP CB C 110 28.989 28.699 0.290 1
1 1275 . 4 1 1 A 110 110 TRP N N 110 122.304 122.002 0.302 1
1 1277 . 4 1 1 A 111 111 GLU H H 111 7.946 7.871 0.075 1
1 1278 . 4 1 1 A 111 111 GLU HA H 111 2.594 2.820 -0.226 1
1 1283 . 4 1 1 A 111 111 GLU C C 111 177.976 179.064 -1.088 1
1 1284 . 4 1 1 A 111 111 GLU CA C 111 60.193 58.979 1.214 1
1 1285 . 4 1 1 A 111 111 GLU CB C 111 29.277 29.280 -0.003 1
1 1287 . 4 1 1 A 111 111 GLU N N 111 121.755 119.066 2.689 1
1 1288 . 4 1 1 A 112 112 THR H H 112 7.993 7.516 0.477 1
1 1289 . 4 1 1 A 112 112 THR HA H 112 3.722 3.812 -0.090 1
1 1294 . 4 1 1 A 112 112 THR C C 112 176.038 175.807 0.231 1
1 1295 . 4 1 1 A 112 112 THR CA C 112 66.104 66.475 -0.371 1
1 1296 . 4 1 1 A 112 112 THR CB C 112 68.885 68.780 0.105 1
1 1298 . 4 1 1 A 112 112 THR N N 112 112.247 116.433 -4.186 1
1 1299 . 4 1 1 A 113 113 ALA H H 113 7.742 8.263 -0.521 1
1 1300 . 4 1 1 A 113 113 ALA HA H 113 4.029 3.981 0.048 1
1 1304 . 4 1 1 A 113 113 ALA C C 113 180.545 179.934 0.611 1
1 1305 . 4 1 1 A 113 113 ALA CA C 113 55.127 55.168 -0.041 1
1 1306 . 4 1 1 A 113 113 ALA CB C 113 18.854 18.360 0.494 1
1 1307 . 4 1 1 A 113 113 ALA N N 113 123.134 122.793 0.341 1
1 1308 . 4 1 1 A 114 114 ILE H H 114 8.472 8.492 -0.020 1
1 1309 . 4 1 1 A 114 114 ILE HA H 114 3.613 3.743 -0.130 1
1 1319 . 4 1 1 A 114 114 ILE C C 114 176.947 178.027 -1.080 1
1 1320 . 4 1 1 A 114 114 ILE CA C 114 66.016 65.204 0.812 1
1 1321 . 4 1 1 A 114 114 ILE CB C 114 38.335 37.824 0.511 1
1 1325 . 4 1 1 A 114 114 ILE N N 114 118.276 117.874 0.402 1
1 1326 . 4 1 1 A 115 115 ARG H H 115 8.181 7.952 0.229 1
1 1327 . 4 1 1 A 115 115 ARG HA H 115 3.835 3.889 -0.054 1
1 1334 . 4 1 1 A 115 115 ARG C C 115 179.588 179.110 0.478 1
1 1335 . 4 1 1 A 115 115 ARG CA C 115 61.072 60.045 1.027 1
1 1336 . 4 1 1 A 115 115 ARG CB C 115 29.975 29.860 0.115 1
1 1339 . 4 1 1 A 115 115 ARG N N 115 117.921 119.208 -1.287 1
1 1340 . 4 1 1 A 116 116 GLN H H 116 8.395 8.421 -0.026 1
1 1341 . 4 1 1 A 116 116 GLN HA H 116 4.030 4.061 -0.031 1
1 1348 . 4 1 1 A 116 116 GLN C C 116 178.716 178.778 -0.062 1
1 1349 . 4 1 1 A 116 116 GLN CA C 116 58.790 58.874 -0.084 1
1 1350 . 4 1 1 A 116 116 GLN CB C 116 28.248 28.468 -0.220 1
1 1352 . 4 1 1 A 116 116 GLN N N 116 116.842 118.816 -1.974 1
1 1354 . 4 1 1 A 117 117 ALA H H 117 7.902 8.308 -0.406 1
1 1355 . 4 1 1 A 117 117 ALA HA H 117 4.143 4.138 0.005 1
1 1359 . 4 1 1 A 117 117 ALA C C 117 179.685 180.176 -0.491 1
1 1360 . 4 1 1 A 117 117 ALA CA C 117 54.476 54.967 -0.491 1
1 1361 . 4 1 1 A 117 117 ALA CB C 117 18.300 18.382 -0.082 1
1 1362 . 4 1 1 A 117 117 ALA N N 117 122.828 122.817 0.011 1
1 1363 . 4 1 1 A 118 118 LEU H H 118 7.904 8.107 -0.203 1
1 1364 . 4 1 1 A 118 118 LEU HA H 118 4.119 4.105 0.014 1
1 1374 . 4 1 1 A 118 118 LEU C C 118 178.437 178.723 -0.286 1
1 1375 . 4 1 1 A 118 118 LEU CA C 118 56.781 57.178 -0.397 1
1 1376 . 4 1 1 A 118 118 LEU CB C 118 42.371 41.798 0.573 1
1 1380 . 4 1 1 A 118 118 LEU N N 118 117.632 120.107 -2.475 1
1 1381 . 4 1 1 A 119 119 MET H H 119 7.673 8.015 -0.342 1
1 1382 . 4 1 1 A 119 119 MET HA H 119 4.442 4.196 0.246 1
1 1390 . 4 1 1 A 119 119 MET C C 119 176.680 177.703 -1.023 1
1 1391 . 4 1 1 A 119 119 MET CA C 119 56.432 58.016 -1.584 1
1 1392 . 4 1 1 A 119 119 MET CB C 119 32.769 32.108 0.661 1
1 1395 . 4 1 1 A 119 119 MET N N 119 117.286 117.200 0.086 1
1 1396 . 4 1 1 A 120 120 SER H H 120 7.878 7.374 0.504 1
1 1397 . 4 1 1 A 120 120 SER HA H 120 4.500 4.539 -0.039 1
1 1400 . 4 1 1 A 120 120 SER C C 120 174.742 174.799 -0.057 1
1 1401 . 4 1 1 A 120 120 SER CA C 120 58.962 58.458 0.504 1
1 1402 . 4 1 1 A 120 120 SER CB C 120 63.853 63.410 0.443 1
1 1403 . 4 1 1 A 120 120 SER N N 120 115.064 114.253 0.811 1
1 1404 . 4 1 1 A 121 121 GLY H H 121 8.059 8.587 -0.528 1
1 1405 . 4 1 1 A 121 121 GLY HA2 H 121 4.231 3.806 0.425 1
1 1406 . 4 1 1 A 121 121 GLY HA3 H 121 4.112 3.806 0.306 1
1 1407 . 4 1 1 A 121 121 GLY C C 121 172.065 173.909 -1.844 1
1 1408 . 4 1 1 A 121 121 GLY CA C 121 45.030 46.893 -1.863 1
1 1409 . 4 1 1 A 121 121 GLY N N 121 110.271 109.084 1.187 1
1 1410 . 4 1 1 A 122 122 PRO HA H 122 4.496 4.529 -0.033 1
1 1417 . 4 1 1 A 122 122 PRO CA C 122 63.399 62.892 0.507 1
1 1418 . 4 1 1 A 122 122 PRO CB C 122 32.186 31.824 0.362 1
1 1 . 5 1 1 A 6 6 SER H H 6 8.337 8.915 -0.578 1
1 2 . 5 1 1 A 6 6 SER HA H 6 4.597 5.532 -0.935 1
1 5 . 5 1 1 A 6 6 SER C C 6 174.637 173.058 1.579 1
1 6 . 5 1 1 A 6 6 SER CA C 6 58.469 56.611 1.858 1
1 7 . 5 1 1 A 6 6 SER CB C 6 64.221 66.698 -2.477 1
1 8 . 5 1 1 A 6 6 SER N N 6 117.887 117.462 0.425 1
1 9 . 5 1 1 A 7 7 GLY H H 7 8.280 8.416 -0.136 1
1 10 . 5 1 1 A 7 7 GLY HA2 H 7 4.063 4.151 -0.088 1
1 11 . 5 1 1 A 7 7 GLY HA3 H 7 4.063 4.155 -0.092 1
1 12 . 5 1 1 A 7 7 GLY C C 7 173.724 172.792 0.932 1
1 13 . 5 1 1 A 7 7 GLY CA C 7 44.941 44.913 0.028 1
1 14 . 5 1 1 A 7 7 GLY N N 7 110.151 112.627 -2.476 1
1 15 . 5 1 1 A 8 8 THR H H 8 8.212 8.586 -0.374 1
1 16 . 5 1 1 A 8 8 THR HA H 8 4.173 4.474 -0.301 1
1 21 . 5 1 1 A 8 8 THR C C 8 174.723 174.243 0.480 1
1 22 . 5 1 1 A 8 8 THR CA C 8 63.622 63.583 0.039 1
1 23 . 5 1 1 A 8 8 THR CB C 8 69.460 68.902 0.558 1
1 25 . 5 1 1 A 8 8 THR N N 8 116.817 116.591 0.226 1
1 26 . 5 1 1 A 9 9 LEU H H 9 9.374 9.143 0.231 1
1 27 . 5 1 1 A 9 9 LEU HA H 9 4.302 4.293 0.009 1
1 37 . 5 1 1 A 9 9 LEU C C 9 177.468 176.615 0.853 1
1 38 . 5 1 1 A 9 9 LEU CA C 9 55.936 56.123 -0.187 1
1 39 . 5 1 1 A 9 9 LEU CB C 9 42.843 42.725 0.118 1
1 43 . 5 1 1 A 9 9 LEU N N 9 127.798 129.000 -1.202 1
1 44 . 5 1 1 A 10 10 ARG H H 10 7.512 7.343 0.169 1
1 45 . 5 1 1 A 10 10 ARG HA H 10 4.199 4.729 -0.530 1
1 52 . 5 1 1 A 10 10 ARG C C 10 172.501 174.005 -1.504 1
1 53 . 5 1 1 A 10 10 ARG CA C 10 56.165 54.510 1.655 1
1 54 . 5 1 1 A 10 10 ARG CB C 10 32.442 33.503 -1.061 1
1 57 . 5 1 1 A 10 10 ARG N N 10 117.979 117.393 0.586 1
1 58 . 5 1 1 A 11 11 GLU H H 11 8.434 8.759 -0.325 1
1 59 . 5 1 1 A 11 11 GLU HA H 11 5.993 5.443 0.550 1
1 64 . 5 1 1 A 11 11 GLU C C 11 174.800 174.642 0.158 1
1 65 . 5 1 1 A 11 11 GLU CA C 11 54.570 55.170 -0.600 1
1 66 . 5 1 1 A 11 11 GLU CB C 11 34.245 33.086 1.159 1
1 68 . 5 1 1 A 11 11 GLU N N 11 120.782 121.878 -1.096 1
1 69 . 5 1 1 A 12 12 GLY H H 12 8.131 7.797 0.334 1
1 70 . 5 1 1 A 12 12 GLY HA2 H 12 4.714 3.807 0.907 1
1 71 . 5 1 1 A 12 12 GLY HA3 H 12 3.763 4.216 -0.453 1
1 72 . 5 1 1 A 12 12 GLY C C 12 171.060 171.686 -0.626 1
1 73 . 5 1 1 A 12 12 GLY CA C 12 45.241 45.387 -0.146 1
1 74 . 5 1 1 A 12 12 GLY N N 12 107.457 106.590 0.867 1
1 75 . 5 1 1 A 13 13 TRP H H 13 8.783 8.638 0.145 1
1 76 . 5 1 1 A 13 13 TRP HA H 13 5.152 4.892 0.260 1
1 85 . 5 1 1 A 13 13 TRP C C 13 177.528 176.499 1.029 1
1 86 . 5 1 1 A 13 13 TRP CA C 13 57.783 58.678 -0.895 1
1 87 . 5 1 1 A 13 13 TRP CB C 13 30.222 29.918 0.304 1
1 93 . 5 1 1 A 13 13 TRP N N 13 120.792 121.360 -0.568 1
1 95 . 5 1 1 A 14 14 VAL H H 14 9.179 8.606 0.573 1
1 96 . 5 1 1 A 14 14 VAL HA H 14 4.072 4.445 -0.373 1
1 104 . 5 1 1 A 14 14 VAL C C 14 174.981 173.449 1.532 1
1 105 . 5 1 1 A 14 14 VAL CA C 14 61.741 60.310 1.431 1
1 106 . 5 1 1 A 14 14 VAL CB C 14 35.143 35.016 0.127 1
1 109 . 5 1 1 A 14 14 VAL N N 14 125.476 122.887 2.589 1
1 110 . 5 1 1 A 15 15 VAL H H 15 8.403 8.816 -0.413 1
1 111 . 5 1 1 A 15 15 VAL HA H 15 5.532 5.190 0.342 1
1 119 . 5 1 1 A 15 15 VAL C C 15 175.078 174.271 0.807 1
1 120 . 5 1 1 A 15 15 VAL CA C 15 59.489 59.816 -0.327 1
1 121 . 5 1 1 A 15 15 VAL CB C 15 34.210 35.099 -0.889 1
1 124 . 5 1 1 A 15 15 VAL N N 15 126.189 127.544 -1.355 1
1 125 . 5 1 1 A 16 16 HIS H H 16 9.122 9.153 -0.031 1
1 126 . 5 1 1 A 16 16 HIS HA H 16 5.823 5.822 0.001 1
1 131 . 5 1 1 A 16 16 HIS C C 16 172.998 172.736 0.262 1
1 132 . 5 1 1 A 16 16 HIS CA C 16 56.253 54.095 2.158 1
1 133 . 5 1 1 A 16 16 HIS CB C 16 34.273 33.008 1.265 1
1 136 . 5 1 1 A 16 16 HIS N N 16 121.152 120.178 0.974 1
1 137 . 5 1 1 A 17 17 TYR H H 17 8.465 8.540 -0.075 1
1 138 . 5 1 1 A 17 17 TYR HA H 17 5.096 4.633 0.463 1
1 145 . 5 1 1 A 17 17 TYR C C 17 173.640 172.989 0.651 1
1 146 . 5 1 1 A 17 17 TYR CA C 17 56.903 56.607 0.296 1
1 147 . 5 1 1 A 17 17 TYR CB C 17 40.103 40.418 -0.315 1
1 152 . 5 1 1 A 17 17 TYR N N 17 115.558 116.486 -0.928 1
1 153 . 5 1 1 A 18 18 SER H H 18 9.122 8.454 0.668 1
1 154 . 5 1 1 A 18 18 SER HA H 18 6.144 5.334 0.810 1
1 157 . 5 1 1 A 18 18 SER C C 18 173.204 175.709 -2.505 1
1 158 . 5 1 1 A 18 18 SER CA C 18 56.640 57.039 -0.399 1
1 159 . 5 1 1 A 18 18 SER CB C 18 68.788 66.223 2.565 1
1 160 . 5 1 1 A 18 18 SER N N 18 118.846 116.246 2.600 1
1 161 . 5 1 1 A 19 19 ASN H H 19 9.053 8.486 0.567 1
1 162 . 5 1 1 A 19 19 ASN HA H 19 4.473 4.863 -0.390 1
1 167 . 5 1 1 A 19 19 ASN C C 19 175.396 175.922 -0.526 1
1 168 . 5 1 1 A 19 19 ASN CA C 19 55.373 52.706 2.667 1
1 169 . 5 1 1 A 19 19 ASN CB C 19 36.900 37.958 -1.058 1
1 170 . 5 1 1 A 19 19 ASN N N 19 113.712 117.399 -3.687 1
1 172 . 5 1 1 A 20 20 LYS H H 20 7.677 8.329 -0.652 1
1 173 . 5 1 1 A 20 20 LYS HA H 20 4.413 4.663 -0.250 1
1 182 . 5 1 1 A 20 20 LYS C C 20 176.078 177.417 -1.339 1
1 183 . 5 1 1 A 20 20 LYS CA C 20 55.679 57.513 -1.834 1
1 184 . 5 1 1 A 20 20 LYS CB C 20 33.023 35.121 -2.098 1
1 188 . 5 1 1 A 20 20 LYS N N 20 117.213 119.452 -2.239 1
1 189 . 5 1 1 A 21 21 ASP H H 21 7.395 7.881 -0.486 1
1 190 . 5 1 1 A 21 21 ASP HA H 21 4.808 4.745 0.063 1
1 193 . 5 1 1 A 21 21 ASP C C 21 176.413 176.140 0.273 1
1 194 . 5 1 1 A 21 21 ASP CA C 21 53.983 53.929 0.054 1
1 195 . 5 1 1 A 21 21 ASP CB C 21 41.199 43.024 -1.825 1
1 196 . 5 1 1 A 21 21 ASP N N 21 119.879 116.349 3.530 1
1 197 . 5 1 1 A 22 22 THR H H 22 8.593 7.730 0.863 1
1 198 . 5 1 1 A 22 22 THR HA H 22 4.352 4.210 0.142 1
1 203 . 5 1 1 A 22 22 THR C C 22 172.913 174.798 -1.885 1
1 204 . 5 1 1 A 22 22 THR CA C 22 62.691 62.914 -0.223 1
1 205 . 5 1 1 A 22 22 THR CB C 22 68.332 66.427 1.905 1
1 207 . 5 1 1 A 22 22 THR N N 22 116.299 112.885 3.414 1
1 208 . 5 1 1 A 23 23 LEU H H 23 7.645 7.959 -0.314 1
1 209 . 5 1 1 A 23 23 LEU HA H 23 4.318 4.471 -0.153 1
1 219 . 5 1 1 A 23 23 LEU C C 23 176.692 176.501 0.191 1
1 220 . 5 1 1 A 23 23 LEU CA C 23 54.617 53.742 0.875 1
1 221 . 5 1 1 A 23 23 LEU CB C 23 41.939 41.170 0.769 1
1 225 . 5 1 1 A 23 23 LEU N N 23 123.606 120.939 2.667 1
1 226 . 5 1 1 A 24 24 ARG H H 24 8.563 7.912 0.651 1
1 227 . 5 1 1 A 24 24 ARG HA H 24 4.373 4.548 -0.175 1
1 235 . 5 1 1 A 24 24 ARG C C 24 176.584 175.887 0.697 1
1 236 . 5 1 1 A 24 24 ARG CA C 24 57.854 56.340 1.514 1
1 237 . 5 1 1 A 24 24 ARG CB C 24 31.126 30.607 0.519 1
1 240 . 5 1 1 A 24 24 ARG N N 24 127.152 123.437 3.715 1
1 242 . 5 1 1 A 25 25 LYS H H 25 8.633 8.393 0.240 1
1 243 . 5 1 1 A 25 25 LYS HA H 25 4.513 4.943 -0.430 1
1 251 . 5 1 1 A 25 25 LYS C C 25 173.567 174.644 -1.077 1
1 252 . 5 1 1 A 25 25 LYS CA C 25 54.792 54.504 0.288 1
1 253 . 5 1 1 A 25 25 LYS CB C 25 37.416 35.028 2.388 1
1 257 . 5 1 1 A 25 25 LYS N N 25 122.682 121.043 1.639 1
1 258 . 5 1 1 A 26 26 ARG H H 26 8.303 8.807 -0.504 1
1 259 . 5 1 1 A 26 26 ARG HA H 26 5.153 4.910 0.243 1
1 266 . 5 1 1 A 26 26 ARG C C 26 174.554 175.172 -0.618 1
1 267 . 5 1 1 A 26 26 ARG CA C 26 55.083 55.315 -0.232 1
1 268 . 5 1 1 A 26 26 ARG CB C 26 32.789 31.399 1.390 1
1 271 . 5 1 1 A 26 26 ARG N N 26 121.819 124.924 -3.105 1
1 272 . 5 1 1 A 27 27 HIS H H 27 8.793 8.884 -0.091 1
1 273 . 5 1 1 A 27 27 HIS HA H 27 5.155 5.350 -0.195 1
1 278 . 5 1 1 A 27 27 HIS CA C 27 56.904 55.013 1.891 1
1 279 . 5 1 1 A 27 27 HIS CB C 27 34.683 31.531 3.152 1
1 282 . 5 1 1 A 27 27 HIS N N 27 122.102 120.252 1.850 1
1 283 . 5 1 1 A 28 28 TYR H H 28 9.273 8.286 0.987 1
1 284 . 5 1 1 A 28 28 TYR HA H 28 4.332 4.275 0.057 1
1 291 . 5 1 1 A 28 28 TYR C C 28 174.730 175.131 -0.401 1
1 292 . 5 1 1 A 28 28 TYR CA C 28 58.680 57.499 1.181 1
1 293 . 5 1 1 A 28 28 TYR CB C 28 38.673 38.148 0.525 1
1 298 . 5 1 1 A 28 28 TYR N N 28 125.605 121.387 4.218 1
1 299 . 5 1 1 A 29 29 TRP H H 29 9.273 8.701 0.572 1
1 300 . 5 1 1 A 29 29 TRP HA H 29 5.543 4.795 0.748 1
1 309 . 5 1 1 A 29 29 TRP C C 29 176.172 176.463 -0.291 1
1 310 . 5 1 1 A 29 29 TRP CA C 29 56.658 56.688 -0.030 1
1 311 . 5 1 1 A 29 29 TRP CB C 29 32.154 30.483 1.671 1
1 317 . 5 1 1 A 29 29 TRP N N 29 131.340 128.242 3.098 1
1 318 . 5 1 1 A 30 30 ARG H H 30 9.164 9.007 0.157 1
1 319 . 5 1 1 A 30 30 ARG HA H 30 5.302 5.322 -0.020 1
1 327 . 5 1 1 A 30 30 ARG C C 30 174.774 174.433 0.341 1
1 328 . 5 1 1 A 30 30 ARG CA C 30 56.271 54.642 1.629 1
1 329 . 5 1 1 A 30 30 ARG CB C 30 34.203 33.894 0.309 1
1 332 . 5 1 1 A 30 30 ARG N N 30 116.040 120.689 -4.649 1
1 334 . 5 1 1 A 31 31 LEU H H 31 9.273 9.279 -0.006 1
1 335 . 5 1 1 A 31 31 LEU HA H 31 5.324 5.401 -0.077 1
1 345 . 5 1 1 A 31 31 LEU C C 31 174.488 174.518 -0.030 1
1 346 . 5 1 1 A 31 31 LEU CA C 31 53.807 53.494 0.313 1
1 347 . 5 1 1 A 31 31 LEU CB C 31 46.667 45.964 0.703 1
1 351 . 5 1 1 A 31 31 LEU N N 31 127.075 127.005 0.070 1
1 352 . 5 1 1 A 32 32 ASP H H 32 8.854 8.669 0.185 1
1 353 . 5 1 1 A 32 32 ASP HA H 32 4.902 5.104 -0.202 1
1 356 . 5 1 1 A 32 32 ASP C C 32 173.474 176.418 -2.944 1
1 357 . 5 1 1 A 32 32 ASP CA C 32 53.104 52.264 0.840 1
1 358 . 5 1 1 A 32 32 ASP CB C 32 42.931 44.329 -1.398 1
1 359 . 5 1 1 A 32 32 ASP N N 32 129.349 125.340 4.009 1
1 360 . 5 1 1 A 33 33 CYS H H 33 8.153 8.844 -0.691 1
1 361 . 5 1 1 A 33 33 CYS HA H 33 4.323 4.358 -0.035 1
1 364 . 5 1 1 A 33 33 CYS C C 33 174.476 174.376 0.100 1
1 365 . 5 1 1 A 33 33 CYS CA C 33 59.853 59.803 0.050 1
1 366 . 5 1 1 A 33 33 CYS CB C 33 27.508 26.942 0.566 1
1 367 . 5 1 1 A 33 33 CYS N N 33 108.439 118.885 -10.446 1
1 368 . 5 1 1 A 34 34 LYS H H 34 9.144 7.755 1.389 1
1 369 . 5 1 1 A 34 34 LYS HA H 34 4.616 4.450 0.166 1
1 378 . 5 1 1 A 34 34 LYS C C 34 177.601 176.353 1.248 1
1 379 . 5 1 1 A 34 34 LYS CA C 34 57.185 56.898 0.287 1
1 380 . 5 1 1 A 34 34 LYS CB C 34 35.623 34.975 0.648 1
1 384 . 5 1 1 A 34 34 LYS N N 34 119.884 118.203 1.681 1
1 385 . 5 1 1 A 35 35 CYS H H 35 9.102 7.753 1.349 1
1 386 . 5 1 1 A 35 35 CYS HA H 35 4.935 4.847 0.088 1
1 389 . 5 1 1 A 35 35 CYS C C 35 172.283 172.304 -0.021 1
1 390 . 5 1 1 A 35 35 CYS CA C 35 57.748 56.756 0.992 1
1 391 . 5 1 1 A 35 35 CYS CB C 35 31.537 30.872 0.665 1
1 392 . 5 1 1 A 35 35 CYS N N 35 120.317 113.954 6.363 1
1 393 . 5 1 1 A 36 36 ILE H H 36 8.213 9.045 -0.832 1
1 394 . 5 1 1 A 36 36 ILE HA H 36 4.617 5.021 -0.404 1
1 404 . 5 1 1 A 36 36 ILE C C 36 175.312 175.051 0.261 1
1 405 . 5 1 1 A 36 36 ILE CA C 36 60.967 60.444 0.523 1
1 406 . 5 1 1 A 36 36 ILE CB C 36 39.718 38.635 1.083 1
1 410 . 5 1 1 A 36 36 ILE N N 36 121.905 120.239 1.666 1
1 411 . 5 1 1 A 37 37 THR H H 37 9.076 8.782 0.294 1
1 412 . 5 1 1 A 37 37 THR HA H 37 4.364 4.514 -0.150 1
1 417 . 5 1 1 A 37 37 THR CA C 37 61.834 62.073 -0.239 1
1 418 . 5 1 1 A 37 37 THR CB C 37 69.237 70.021 -0.784 1
1 420 . 5 1 1 A 37 37 THR N N 37 122.500 123.324 -0.824 1
1 421 . 5 1 1 A 38 38 LEU H H 38 8.263 8.195 0.068 1
1 422 . 5 1 1 A 38 38 LEU HA H 38 4.445 5.000 -0.555 1
1 432 . 5 1 1 A 38 38 LEU CA C 38 55.611 52.798 2.813 1
1 433 . 5 1 1 A 38 38 LEU CB C 38 42.702 45.431 -2.729 1
1 437 . 5 1 1 A 38 38 LEU N N 38 126.987 123.576 3.411 1
1 438 . 5 1 1 A 39 39 PHE H H 39 9.520 8.568 0.952 1
1 439 . 5 1 1 A 39 39 PHE HA H 39 4.998 4.962 0.036 1
1 447 . 5 1 1 A 39 39 PHE CA C 39 57.331 56.519 0.812 1
1 448 . 5 1 1 A 39 39 PHE CB C 39 42.453 42.347 0.106 1
1 454 . 5 1 1 A 39 39 PHE N N 39 120.545 119.056 1.489 1
1 455 . 5 1 1 A 40 40 GLN H H 40 9.878 8.878 1.000 1
1 456 . 5 1 1 A 40 40 GLN HA H 40 4.376 4.180 0.196 1
1 463 . 5 1 1 A 40 40 GLN CA C 40 59.513 59.194 0.319 1
1 464 . 5 1 1 A 40 40 GLN CB C 40 29.317 28.914 0.403 1
1 467 . 5 1 1 A 41 41 ASN H H 41 7.732 8.018 -0.286 1
1 468 . 5 1 1 A 41 41 ASN HA H 41 4.812 5.190 -0.378 1
1 473 . 5 1 1 A 41 41 ASN CA C 41 52.618 51.834 0.784 1
1 474 . 5 1 1 A 41 41 ASN CB C 41 39.362 41.470 -2.108 1
1 475 . 5 1 1 A 41 41 ASN N N 41 107.613 113.782 -6.169 1
1 477 . 5 1 1 A 42 42 ASN HA H 42 3.476 4.035 -0.559 1
1 482 . 5 1 1 A 42 42 ASN C C 42 173.607 175.563 -1.956 1
1 483 . 5 1 1 A 42 42 ASN CA C 42 54.888 55.027 -0.139 1
1 484 . 5 1 1 A 42 42 ASN CB C 42 35.613 37.477 -1.864 1
1 486 . 5 1 1 A 43 43 THR H H 43 8.394 7.547 0.847 1
1 487 . 5 1 1 A 43 43 THR HA H 43 4.403 4.654 -0.251 1
1 492 . 5 1 1 A 43 43 THR C C 43 174.464 173.412 1.052 1
1 493 . 5 1 1 A 43 43 THR CA C 43 61.978 60.733 1.245 1
1 494 . 5 1 1 A 43 43 THR CB C 43 70.036 68.939 1.097 1
1 496 . 5 1 1 A 43 43 THR N N 43 111.795 106.985 4.810 1
1 497 . 5 1 1 A 44 44 THR H H 44 8.058 7.430 0.628 1
1 498 . 5 1 1 A 44 44 THR HA H 44 4.464 4.843 -0.379 1
1 503 . 5 1 1 A 44 44 THR CA C 44 61.599 59.758 1.841 1
1 504 . 5 1 1 A 44 44 THR CB C 44 69.137 70.960 -1.823 1
1 506 . 5 1 1 A 44 44 THR N N 44 116.514 115.450 1.064 1
1 507 . 5 1 1 A 45 45 ASN H H 45 6.653 8.987 -2.334 1
1 508 . 5 1 1 A 45 45 ASN HA H 45 4.945 4.806 0.139 1
1 513 . 5 1 1 A 45 45 ASN CA C 45 53.227 54.518 -1.291 1
1 514 . 5 1 1 A 45 45 ASN CB C 45 38.483 39.302 -0.819 1
1 516 . 5 1 1 A 46 46 ARG H H 46 8.213 7.938 0.275 1
1 517 . 5 1 1 A 46 46 ARG HA H 46 4.583 4.791 -0.208 1
1 524 . 5 1 1 A 46 46 ARG CA C 46 55.487 54.631 0.856 1
1 525 . 5 1 1 A 46 46 ARG CB C 46 31.153 32.382 -1.229 1
1 528 . 5 1 1 A 46 46 ARG N N 46 121.652 119.240 2.412 1
1 529 . 5 1 1 A 47 47 TYR H H 47 7.973 8.992 -1.019 1
1 536 . 5 1 1 A 47 47 TYR CB C 47 39.356 39.523 -0.167 1
1 541 . 5 1 1 A 48 48 TYR H H 48 9.023 8.594 0.429 1
1 542 . 5 1 1 A 48 48 TYR HA H 48 4.662 4.322 0.340 1
1 549 . 5 1 1 A 48 48 TYR CB C 48 39.863 40.565 -0.702 1
1 554 . 5 1 1 A 48 48 TYR N N 48 121.223 119.955 1.268 1
1 555 . 5 1 1 A 49 49 LYS H H 49 7.134 7.585 -0.451 1
1 556 . 5 1 1 A 49 49 LYS HA H 49 4.283 4.710 -0.427 1
1 565 . 5 1 1 A 49 49 LYS CA C 49 55.167 55.924 -0.757 1
1 566 . 5 1 1 A 49 49 LYS CB C 49 36.699 36.095 0.604 1
1 570 . 5 1 1 A 49 49 LYS N N 49 117.339 118.423 -1.084 1
1 571 . 5 1 1 A 50 50 GLU H H 50 8.411 9.141 -0.730 1
1 572 . 5 1 1 A 50 50 GLU HA H 50 4.583 5.055 -0.472 1
1 577 . 5 1 1 A 50 50 GLU CA C 50 54.592 55.319 -0.727 1
1 578 . 5 1 1 A 50 50 GLU CB C 50 33.263 32.052 1.211 1
1 580 . 5 1 1 A 50 50 GLU N N 50 123.825 127.195 -3.370 1
1 581 . 5 1 1 A 51 51 ILE H H 51 9.225 9.178 0.047 1
1 582 . 5 1 1 A 51 51 ILE HA H 51 4.277 4.644 -0.367 1
1 592 . 5 1 1 A 51 51 ILE CA C 51 58.182 58.136 0.046 1
1 593 . 5 1 1 A 51 51 ILE CB C 51 39.663 38.517 1.146 1
1 597 . 5 1 1 A 51 51 ILE N N 51 125.271 126.519 -1.248 1
1 598 . 5 1 1 A 52 52 PRO HA H 52 4.543 4.625 -0.082 1
1 605 . 5 1 1 A 52 52 PRO C C 52 178.340 177.988 0.352 1
1 606 . 5 1 1 A 52 52 PRO CA C 52 62.726 62.937 -0.211 1
1 607 . 5 1 1 A 52 52 PRO CB C 52 32.003 31.706 0.297 1
1 610 . 5 1 1 A 53 53 LEU H H 53 8.723 8.515 0.208 1
1 611 . 5 1 1 A 53 53 LEU HA H 53 3.891 3.872 0.019 1
1 621 . 5 1 1 A 53 53 LEU C C 53 179.673 179.048 0.625 1
1 622 . 5 1 1 A 53 53 LEU CA C 53 58.205 57.517 0.688 1
1 623 . 5 1 1 A 53 53 LEU CB C 53 40.171 41.348 -1.177 1
1 627 . 5 1 1 A 53 53 LEU N N 53 125.150 124.491 0.659 1
1 628 . 5 1 1 A 54 54 SER H H 54 8.360 8.124 0.236 1
1 629 . 5 1 1 A 54 54 SER HA H 54 4.164 4.076 0.088 1
1 632 . 5 1 1 A 54 54 SER C C 54 175.517 177.325 -1.808 1
1 633 . 5 1 1 A 54 54 SER CA C 54 60.193 61.447 -1.254 1
1 634 . 5 1 1 A 54 54 SER CB C 54 62.617 62.835 -0.218 1
1 635 . 5 1 1 A 54 54 SER N N 54 111.266 114.333 -3.067 1
1 636 . 5 1 1 A 55 55 GLU H H 55 7.666 8.383 -0.717 1
1 637 . 5 1 1 A 55 55 GLU HA H 55 4.363 4.153 0.210 1
1 642 . 5 1 1 A 55 55 GLU C C 55 176.753 177.827 -1.074 1
1 643 . 5 1 1 A 55 55 GLU CA C 55 56.200 59.074 -2.874 1
1 644 . 5 1 1 A 55 55 GLU CB C 55 30.526 29.191 1.335 1
1 646 . 5 1 1 A 55 55 GLU N N 55 119.485 119.588 -0.103 1
1 647 . 5 1 1 A 56 56 ILE H H 56 7.601 7.077 0.524 1
1 648 . 5 1 1 A 56 56 ILE HA H 56 3.793 3.922 -0.129 1
1 658 . 5 1 1 A 56 56 ILE C C 56 175.142 175.799 -0.657 1
1 659 . 5 1 1 A 56 56 ILE CA C 56 63.518 62.416 1.102 1
1 660 . 5 1 1 A 56 56 ILE CB C 56 37.169 38.026 -0.857 1
1 664 . 5 1 1 A 56 56 ILE N N 56 120.430 119.975 0.455 1
1 665 . 5 1 1 A 57 57 LEU H H 57 9.263 9.286 -0.023 1
1 666 . 5 1 1 A 57 57 LEU HA H 57 4.343 4.382 -0.039 1
1 676 . 5 1 1 A 57 57 LEU C C 57 177.898 176.554 1.344 1
1 677 . 5 1 1 A 57 57 LEU CA C 57 56.569 55.882 0.687 1
1 678 . 5 1 1 A 57 57 LEU CB C 57 41.980 42.486 -0.506 1
1 682 . 5 1 1 A 57 57 LEU N N 57 129.464 128.950 0.514 1
1 683 . 5 1 1 A 58 58 THR H H 58 7.414 7.352 0.062 1
1 684 . 5 1 1 A 58 58 THR HA H 58 4.512 4.926 -0.414 1
1 689 . 5 1 1 A 58 58 THR C C 58 171.314 172.714 -1.400 1
1 690 . 5 1 1 A 58 58 THR CA C 58 60.562 61.285 -0.723 1
1 691 . 5 1 1 A 58 58 THR CB C 58 70.803 73.353 -2.550 1
1 693 . 5 1 1 A 58 58 THR N N 58 109.129 110.303 -1.174 1
1 694 . 5 1 1 A 59 59 VAL H H 59 8.152 8.369 -0.217 1
1 695 . 5 1 1 A 59 59 VAL HA H 59 5.061 5.024 0.037 1
1 703 . 5 1 1 A 59 59 VAL C C 59 174.985 174.800 0.185 1
1 704 . 5 1 1 A 59 59 VAL CA C 59 61.354 61.331 0.023 1
1 705 . 5 1 1 A 59 59 VAL CB C 59 33.855 34.543 -0.688 1
1 708 . 5 1 1 A 59 59 VAL N N 59 123.676 123.420 0.256 1
1 709 . 5 1 1 A 60 60 GLU H H 60 9.074 8.563 0.511 1
1 710 . 5 1 1 A 60 60 GLU HA H 60 4.977 4.875 0.102 1
1 715 . 5 1 1 A 60 60 GLU C C 60 176.063 175.375 0.688 1
1 716 . 5 1 1 A 60 60 GLU CA C 60 53.807 54.205 -0.398 1
1 717 . 5 1 1 A 60 60 GLU CB C 60 33.739 33.722 0.017 1
1 719 . 5 1 1 A 60 60 GLU N N 60 125.125 125.832 -0.707 1
1 720 . 5 1 1 A 61 61 SER H H 61 8.763 8.588 0.175 1
1 721 . 5 1 1 A 61 61 SER HA H 61 4.452 4.979 -0.527 1
1 724 . 5 1 1 A 61 61 SER C C 61 173.288 174.393 -1.105 1
1 725 . 5 1 1 A 61 61 SER CA C 61 59.384 56.993 2.391 1
1 726 . 5 1 1 A 61 61 SER CB C 61 63.390 65.106 -1.716 1
1 727 . 5 1 1 A 61 61 SER N N 61 117.523 115.018 2.505 1
1 728 . 5 1 1 A 62 62 ALA H H 62 7.293 8.890 -1.597 1
1 729 . 5 1 1 A 62 62 ALA HA H 62 3.817 4.415 -0.598 1
1 733 . 5 1 1 A 62 62 ALA C C 62 176.717 177.931 -1.214 1
1 734 . 5 1 1 A 62 62 ALA CA C 62 53.966 53.015 0.951 1
1 735 . 5 1 1 A 62 62 ALA CB C 62 18.640 18.595 0.045 1
1 736 . 5 1 1 A 62 62 ALA N N 62 122.650 125.751 -3.101 1
1 737 . 5 1 1 A 63 63 GLN H H 63 8.736 8.203 0.533 1
1 738 . 5 1 1 A 63 63 GLN HA H 63 4.445 4.713 -0.268 1
1 745 . 5 1 1 A 63 63 GLN C C 63 173.700 174.662 -0.962 1
1 746 . 5 1 1 A 63 63 GLN CA C 63 56.376 55.624 0.752 1
1 747 . 5 1 1 A 63 63 GLN CB C 63 31.515 31.023 0.492 1
1 749 . 5 1 1 A 63 63 GLN N N 63 120.251 119.349 0.902 1
1 751 . 5 1 1 A 64 64 ASN H H 64 9.272 7.182 2.090 1
1 752 . 5 1 1 A 64 64 ASN HA H 64 4.906 5.107 -0.201 1
1 757 . 5 1 1 A 64 64 ASN C C 64 174.754 174.210 0.544 1
1 758 . 5 1 1 A 64 64 ASN CA C 64 51.837 52.074 -0.237 1
1 759 . 5 1 1 A 64 64 ASN CB C 64 38.156 41.549 -3.393 1
1 760 . 5 1 1 A 64 64 ASN N N 64 122.346 118.669 3.677 1
1 762 . 5 1 1 A 65 65 PHE H H 65 8.854 9.130 -0.276 1
1 763 . 5 1 1 A 65 65 PHE HA H 65 4.947 5.221 -0.274 1
1 771 . 5 1 1 A 65 65 PHE C C 65 177.274 176.469 0.805 1
1 772 . 5 1 1 A 65 65 PHE CA C 65 57.519 56.688 0.831 1
1 773 . 5 1 1 A 65 65 PHE CB C 65 38.485 38.810 -0.325 1
1 779 . 5 1 1 A 65 65 PHE N N 65 123.638 125.109 -1.471 1
1 780 . 5 1 1 A 66 66 SER H H 66 8.163 8.105 0.058 1
1 781 . 5 1 1 A 66 66 SER HA H 66 4.393 4.391 0.002 1
1 784 . 5 1 1 A 66 66 SER C C 66 175.699 177.131 -1.432 1
1 785 . 5 1 1 A 66 66 SER CA C 66 60.791 60.998 -0.207 1
1 786 . 5 1 1 A 66 66 SER CB C 66 64.591 63.300 1.291 1
1 787 . 5 1 1 A 66 66 SER N N 66 113.913 116.205 -2.292 1
1 788 . 5 1 1 A 67 67 LEU H H 67 8.574 7.801 0.773 1
1 789 . 5 1 1 A 67 67 LEU HA H 67 4.302 3.803 0.499 1
1 799 . 5 1 1 A 67 67 LEU C C 67 176.269 177.354 -1.085 1
1 800 . 5 1 1 A 67 67 LEU CA C 67 55.601 58.223 -2.622 1
1 801 . 5 1 1 A 67 67 LEU CB C 67 42.021 41.828 0.193 1
1 805 . 5 1 1 A 67 67 LEU N N 67 121.264 121.107 0.157 1
1 806 . 5 1 1 A 68 68 VAL H H 68 6.921 7.564 -0.643 1
1 807 . 5 1 1 A 68 68 VAL HA H 68 4.473 4.164 0.309 1
1 815 . 5 1 1 A 68 68 VAL C C 68 173.809 174.943 -1.134 1
1 816 . 5 1 1 A 68 68 VAL CA C 68 58.047 60.920 -2.873 1
1 817 . 5 1 1 A 68 68 VAL CB C 68 32.295 31.794 0.501 1
1 820 . 5 1 1 A 68 68 VAL N N 68 111.287 115.572 -4.285 1
1 821 . 5 1 1 A 69 69 PRO HA H 69 4.658 4.705 -0.047 1
1 828 . 5 1 1 A 69 69 PRO CA C 69 61.747 61.528 0.219 1
1 829 . 5 1 1 A 69 69 PRO CB C 69 30.693 31.744 -1.051 1
1 832 . 5 1 1 A 70 70 PRO HA H 70 4.414 4.234 0.180 1
1 839 . 5 1 1 A 70 70 PRO CA C 70 63.997 63.896 0.101 1
1 840 . 5 1 1 A 70 70 PRO CB C 70 31.602 31.332 0.270 1
1 843 . 5 1 1 A 71 71 GLY H H 71 8.824 8.912 -0.088 1
1 844 . 5 1 1 A 71 71 GLY HA2 H 71 3.703 3.896 -0.193 1
1 845 . 5 1 1 A 71 71 GLY HA3 H 71 4.193 3.905 0.288 1
1 846 . 5 1 1 A 71 71 GLY C C 71 174.052 174.760 -0.708 1
1 847 . 5 1 1 A 71 71 GLY CA C 71 45.065 45.082 -0.017 1
1 848 . 5 1 1 A 71 71 GLY N N 71 111.845 112.731 -0.886 1
1 849 . 5 1 1 A 72 72 THR H H 72 7.597 7.227 0.370 1
1 850 . 5 1 1 A 72 72 THR HA H 72 4.133 4.118 0.015 1
1 855 . 5 1 1 A 72 72 THR CA C 72 63.129 63.208 -0.079 1
1 856 . 5 1 1 A 72 72 THR CB C 72 69.560 68.860 0.700 1
1 858 . 5 1 1 A 72 72 THR N N 72 117.485 116.333 1.152 1
1 859 . 5 1 1 A 73 73 ASN H H 73 9.280 8.548 0.732 1
1 860 . 5 1 1 A 73 73 ASN HA H 73 4.786 4.685 0.101 1
1 865 . 5 1 1 A 73 73 ASN CA C 73 52.009 51.741 0.268 1
1 866 . 5 1 1 A 73 73 ASN CB C 73 37.553 38.559 -1.006 1
1 867 . 5 1 1 A 73 73 ASN N N 73 127.641 124.552 3.089 1
1 869 . 5 1 1 A 74 74 PRO HA H 74 4.752 4.770 -0.018 1
1 876 . 5 1 1 A 74 74 PRO C C 74 175.190 176.620 -1.430 1
1 877 . 5 1 1 A 74 74 PRO CA C 74 63.395 62.444 0.951 1
1 878 . 5 1 1 A 74 74 PRO CB C 74 33.164 32.392 0.772 1
1 881 . 5 1 1 A 75 75 HIS H H 75 8.025 8.566 -0.541 1
1 882 . 5 1 1 A 75 75 HIS HA H 75 5.047 5.135 -0.088 1
1 887 . 5 1 1 A 75 75 HIS C C 75 172.562 175.308 -2.746 1
1 888 . 5 1 1 A 75 75 HIS CA C 75 54.336 53.900 0.436 1
1 889 . 5 1 1 A 75 75 HIS CB C 75 30.956 33.025 -2.069 1
1 892 . 5 1 1 A 75 75 HIS N N 75 116.198 117.459 -1.261 1
1 893 . 5 1 1 A 76 76 CYS H H 76 8.343 9.508 -1.165 1
1 894 . 5 1 1 A 76 76 CYS HA H 76 4.594 4.525 0.069 1
1 897 . 5 1 1 A 76 76 CYS C C 76 175.651 175.187 0.464 1
1 898 . 5 1 1 A 76 76 CYS CA C 76 61.066 61.146 -0.080 1
1 899 . 5 1 1 A 76 76 CYS CB C 76 30.193 29.139 1.054 1
1 900 . 5 1 1 A 76 76 CYS N N 76 113.289 118.058 -4.769 1
1 901 . 5 1 1 A 77 77 PHE H H 77 8.433 7.991 0.442 1
1 902 . 5 1 1 A 77 77 PHE HA H 77 5.105 5.345 -0.240 1
1 910 . 5 1 1 A 77 77 PHE C C 77 171.822 172.804 -0.982 1
1 911 . 5 1 1 A 77 77 PHE CA C 77 56.874 55.734 1.140 1
1 912 . 5 1 1 A 77 77 PHE CB C 77 39.393 42.871 -3.478 1
1 918 . 5 1 1 A 77 77 PHE N N 77 114.874 115.956 -1.082 1
1 919 . 5 1 1 A 78 78 GLU H H 78 9.823 9.183 0.640 1
1 920 . 5 1 1 A 78 78 GLU HA H 78 5.333 4.965 0.368 1
1 925 . 5 1 1 A 78 78 GLU C C 78 175.602 175.417 0.185 1
1 926 . 5 1 1 A 78 78 GLU CA C 78 54.212 54.627 -0.415 1
1 927 . 5 1 1 A 78 78 GLU CB C 78 31.702 32.678 -0.976 1
1 929 . 5 1 1 A 78 78 GLU N N 78 121.074 119.017 2.057 1
1 930 . 5 1 1 A 79 79 ILE H H 79 9.093 8.985 0.108 1
1 931 . 5 1 1 A 79 79 ILE HA H 79 4.637 4.549 0.088 1
1 941 . 5 1 1 A 79 79 ILE C C 79 174.476 175.388 -0.912 1
1 942 . 5 1 1 A 79 79 ILE CA C 79 60.932 60.567 0.365 1
1 943 . 5 1 1 A 79 79 ILE CB C 79 40.803 37.597 3.206 1
1 947 . 5 1 1 A 79 79 ILE N N 79 121.382 124.155 -2.773 1
1 948 . 5 1 1 A 80 80 VAL H H 80 8.841 7.964 0.877 1
1 949 . 5 1 1 A 80 80 VAL HA H 80 4.425 3.906 0.519 1
1 957 . 5 1 1 A 80 80 VAL C C 80 175.930 175.240 0.690 1
1 958 . 5 1 1 A 80 80 VAL CA C 80 63.324 63.069 0.255 1
1 959 . 5 1 1 A 80 80 VAL CB C 80 32.783 31.035 1.748 1
1 962 . 5 1 1 A 80 80 VAL N N 80 128.970 127.928 1.042 1
1 963 . 5 1 1 A 81 81 THR H H 81 8.303 7.893 0.410 1
1 964 . 5 1 1 A 81 81 THR HA H 81 5.264 4.637 0.627 1
1 969 . 5 1 1 A 81 81 THR C C 81 173.664 174.744 -1.080 1
1 970 . 5 1 1 A 81 81 THR CA C 81 59.540 59.995 -0.455 1
1 971 . 5 1 1 A 81 81 THR CB C 81 72.197 71.563 0.634 1
1 973 . 5 1 1 A 81 81 THR N N 81 118.077 118.782 -0.705 1
1 974 . 5 1 1 A 82 82 ALA H H 82 9.586 8.650 0.936 1
1 975 . 5 1 1 A 82 82 ALA HA H 82 4.093 4.219 -0.126 1
1 979 . 5 1 1 A 82 82 ALA C C 82 178.667 178.272 0.395 1
1 980 . 5 1 1 A 82 82 ALA CA C 82 55.321 53.520 1.801 1
1 981 . 5 1 1 A 82 82 ALA CB C 82 18.094 18.812 -0.718 1
1 982 . 5 1 1 A 82 82 ALA N N 82 122.493 123.997 -1.504 1
1 983 . 5 1 1 A 83 83 ASN H H 83 7.923 8.180 -0.257 1
1 984 . 5 1 1 A 83 83 ASN HA H 83 4.808 4.964 -0.156 1
1 989 . 5 1 1 A 83 83 ASN C C 83 174.766 174.931 -0.165 1
1 990 . 5 1 1 A 83 83 ASN CA C 83 53.333 54.770 -1.437 1
1 991 . 5 1 1 A 83 83 ASN CB C 83 40.335 40.849 -0.514 1
1 992 . 5 1 1 A 83 83 ASN N N 83 110.765 115.699 -4.934 1
1 994 . 5 1 1 A 84 84 ALA H H 84 7.352 7.290 0.062 1
1 995 . 5 1 1 A 84 84 ALA HA H 84 4.625 4.516 0.109 1
1 999 . 5 1 1 A 84 84 ALA C C 84 176.547 175.203 1.344 1
1 1000 . 5 1 1 A 84 84 ALA CA C 84 52.858 51.814 1.044 1
1 1001 . 5 1 1 A 84 84 ALA CB C 84 21.233 22.050 -0.817 1
1 1002 . 5 1 1 A 84 84 ALA N N 84 119.599 117.532 2.067 1
1 1003 . 5 1 1 A 85 85 THR H H 85 8.374 8.642 -0.268 1
1 1004 . 5 1 1 A 85 85 THR HA H 85 5.014 4.547 0.467 1
1 1009 . 5 1 1 A 85 85 THR C C 85 171.568 174.349 -2.781 1
1 1010 . 5 1 1 A 85 85 THR CA C 85 61.618 62.954 -1.336 1
1 1011 . 5 1 1 A 85 85 THR CB C 85 70.850 68.988 1.862 1
1 1013 . 5 1 1 A 85 85 THR N N 85 119.032 113.655 5.377 1
1 1014 . 5 1 1 A 86 86 TYR H H 86 9.006 9.008 -0.002 1
1 1015 . 5 1 1 A 86 86 TYR HA H 86 4.658 5.068 -0.410 1
1 1022 . 5 1 1 A 86 86 TYR C C 86 173.773 175.226 -1.453 1
1 1023 . 5 1 1 A 86 86 TYR CA C 86 56.938 57.433 -0.495 1
1 1024 . 5 1 1 A 86 86 TYR CB C 86 39.513 40.520 -1.007 1
1 1029 . 5 1 1 A 86 86 TYR N N 86 123.494 126.988 -3.494 1
1 1030 . 5 1 1 A 87 87 PHE H H 87 9.263 8.393 0.870 1
1 1031 . 5 1 1 A 87 87 PHE HA H 87 4.127 4.822 -0.695 1
1 1039 . 5 1 1 A 87 87 PHE C C 87 176.369 174.014 2.355 1
1 1040 . 5 1 1 A 87 87 PHE CA C 87 57.238 56.027 1.211 1
1 1041 . 5 1 1 A 87 87 PHE CB C 87 37.086 40.264 -3.178 1
1 1047 . 5 1 1 A 87 87 PHE N N 87 125.384 118.996 6.388 1
1 1048 . 5 1 1 A 88 88 VAL H H 88 9.023 8.524 0.499 1
1 1049 . 5 1 1 A 88 88 VAL HA H 88 4.162 4.998 -0.836 1
1 1057 . 5 1 1 A 88 88 VAL C C 88 176.390 175.394 0.996 1
1 1058 . 5 1 1 A 88 88 VAL CA C 88 63.975 60.513 3.462 1
1 1059 . 5 1 1 A 88 88 VAL CB C 88 32.378 33.830 -1.452 1
1 1062 . 5 1 1 A 88 88 VAL N N 88 127.348 122.894 4.454 1
1 1063 . 5 1 1 A 89 89 GLY H H 89 9.233 8.221 1.012 1
1 1064 . 5 1 1 A 89 89 GLY HA2 H 89 4.293 4.162 0.131 1
1 1065 . 5 1 1 A 89 89 GLY HA3 H 89 4.186 4.229 -0.043 1
1 1066 . 5 1 1 A 89 89 GLY C C 89 172.378 173.045 -0.667 1
1 1067 . 5 1 1 A 89 89 GLY CA C 89 43.798 46.224 -2.426 1
1 1068 . 5 1 1 A 89 89 GLY N N 89 116.041 112.498 3.543 1
1 1069 . 5 1 1 A 90 90 GLU H H 90 8.532 8.087 0.445 1
1 1070 . 5 1 1 A 90 90 GLU HA H 90 4.794 4.310 0.484 1
1 1075 . 5 1 1 A 90 90 GLU C C 90 174.221 176.022 -1.801 1
1 1076 . 5 1 1 A 90 90 GLU CA C 90 56.393 55.700 0.693 1
1 1077 . 5 1 1 A 90 90 GLU CB C 90 33.182 30.474 2.708 1
1 1079 . 5 1 1 A 90 90 GLU N N 90 120.905 122.109 -1.204 1
1 1080 . 5 1 1 A 91 91 MET H H 91 8.450 8.756 -0.306 1
1 1081 . 5 1 1 A 91 91 MET HA H 91 4.904 4.971 -0.067 1
1 1089 . 5 1 1 A 91 91 MET C C 91 173.373 173.184 0.189 1
1 1090 . 5 1 1 A 91 91 MET CA C 91 52.277 53.499 -1.222 1
1 1091 . 5 1 1 A 91 91 MET CB C 91 32.789 35.539 -2.750 1
1 1094 . 5 1 1 A 91 91 MET N N 91 125.173 115.308 9.865 1
1 1095 . 5 1 1 A 92 92 PRO HA H 92 4.358 4.521 -0.163 1
1 1102 . 5 1 1 A 92 92 PRO C C 92 177.589 176.073 1.516 1
1 1103 . 5 1 1 A 92 92 PRO CA C 92 63.143 63.337 -0.194 1
1 1104 . 5 1 1 A 92 92 PRO CB C 92 32.083 31.523 0.560 1
1 1107 . 5 1 1 A 93 93 GLY H H 93 8.330 8.244 0.086 1
1 1108 . 5 1 1 A 93 93 GLY HA2 H 93 3.943 4.183 -0.240 1
1 1109 . 5 1 1 A 93 93 GLY HA3 H 93 4.045 4.184 -0.139 1
1 1110 . 5 1 1 A 93 93 GLY C C 93 174.730 173.717 1.013 1
1 1111 . 5 1 1 A 93 93 GLY CA C 93 45.276 45.897 -0.621 1
1 1112 . 5 1 1 A 93 93 GLY N N 93 109.420 109.563 -0.143 1
1 1113 . 5 1 1 A 94 94 GLY H H 94 8.331 8.216 0.115 1
1 1114 . 5 1 1 A 94 94 GLY HA2 H 94 3.973 3.889 0.084 1
1 1115 . 5 1 1 A 94 94 GLY HA3 H 94 3.973 3.891 0.082 1
1 1116 . 5 1 1 A 94 94 GLY C C 94 174.100 174.647 -0.547 1
1 1117 . 5 1 1 A 94 94 GLY CA C 94 45.333 46.963 -1.630 1
1 1118 . 5 1 1 A 94 94 GLY N N 94 108.483 107.996 0.487 1
1 1119 . 5 1 1 A 95 95 THR H H 95 8.095 7.785 0.310 1
1 1120 . 5 1 1 A 95 95 THR HA H 95 4.643 4.588 0.055 1
1 1125 . 5 1 1 A 95 95 THR C C 95 173.155 173.070 0.085 1
1 1126 . 5 1 1 A 95 95 THR CA C 95 59.922 60.060 -0.138 1
1 1127 . 5 1 1 A 95 95 THR CB C 95 69.871 69.418 0.453 1
1 1129 . 5 1 1 A 95 95 THR N N 95 115.860 109.732 6.128 1
1 1130 . 5 1 1 A 96 96 PRO HA H 96 4.400 4.263 0.137 1
1 1137 . 5 1 1 A 96 96 PRO C C 96 177.565 177.129 0.436 1
1 1138 . 5 1 1 A 96 96 PRO CA C 96 64.047 63.794 0.253 1
1 1139 . 5 1 1 A 96 96 PRO CB C 96 31.816 31.363 0.453 1
1 1142 . 5 1 1 A 97 97 GLY H H 97 8.572 8.589 -0.017 1
1 1143 . 5 1 1 A 97 97 GLY HA2 H 97 4.007 3.898 0.109 1
1 1144 . 5 1 1 A 97 97 GLY HA3 H 97 4.007 3.899 0.108 1
1 1145 . 5 1 1 A 97 97 GLY C C 97 174.609 174.207 0.402 1
1 1146 . 5 1 1 A 97 97 GLY CA C 97 45.276 44.345 0.931 1
1 1147 . 5 1 1 A 97 97 GLY N N 97 110.233 115.689 -5.456 1
1 1148 . 5 1 1 A 98 98 GLY H H 98 8.119 8.682 -0.563 1
1 1149 . 5 1 1 A 98 98 GLY HA2 H 98 4.086 3.931 0.155 1
1 1150 . 5 1 1 A 98 98 GLY HA3 H 98 4.200 3.934 0.266 1
1 1151 . 5 1 1 A 98 98 GLY CA C 98 44.876 45.219 -0.343 1
1 1152 . 5 1 1 A 98 98 GLY N N 98 108.845 108.867 -0.022 1
1 1153 . 5 1 1 A 99 99 PRO HA H 99 4.494 4.592 -0.098 1
1 1160 . 5 1 1 A 99 99 PRO C C 99 177.468 177.272 0.196 1
1 1161 . 5 1 1 A 99 99 PRO CA C 99 63.500 62.605 0.895 1
1 1162 . 5 1 1 A 99 99 PRO CB C 99 32.013 32.383 -0.370 1
1 1165 . 5 1 1 A 100 100 SER H H 100 8.472 8.784 -0.312 1
1 1166 . 5 1 1 A 100 100 SER HA H 100 4.513 4.304 0.209 1
1 1169 . 5 1 1 A 100 100 SER C C 100 175.408 174.679 0.729 1
1 1170 . 5 1 1 A 100 100 SER CA C 100 58.557 60.202 -1.645 1
1 1171 . 5 1 1 A 100 100 SER CB C 100 63.918 63.603 0.315 1
1 1172 . 5 1 1 A 100 100 SER N N 100 116.038 118.536 -2.498 1
1 1173 . 5 1 1 A 101 101 GLY H H 101 8.427 7.736 0.691 1
1 1174 . 5 1 1 A 101 101 GLY HA2 H 101 4.064 3.965 0.099 1
1 1175 . 5 1 1 A 101 101 GLY HA3 H 101 4.064 3.982 0.082 1
1 1176 . 5 1 1 A 101 101 GLY C C 101 174.730 174.789 -0.059 1
1 1177 . 5 1 1 A 101 101 GLY CA C 101 45.575 45.449 0.126 1
1 1178 . 5 1 1 A 101 101 GLY N N 101 110.558 109.250 1.308 1
1 1179 . 5 1 1 A 102 102 GLN H H 102 8.416 8.229 0.187 1
1 1180 . 5 1 1 A 102 102 GLN HA H 102 4.383 4.076 0.307 1
1 1187 . 5 1 1 A 102 102 GLN C C 102 177.346 176.050 1.296 1
1 1188 . 5 1 1 A 102 102 GLN CA C 102 57.080 58.975 -1.895 1
1 1189 . 5 1 1 A 102 102 GLN CB C 102 29.235 28.628 0.607 1
1 1191 . 5 1 1 A 102 102 GLN N N 102 120.112 121.241 -1.129 1
1 1193 . 5 1 1 A 103 103 GLY H H 103 8.713 7.878 0.835 1
1 1194 . 5 1 1 A 103 103 GLY HA2 H 103 4.193 3.958 0.235 1
1 1195 . 5 1 1 A 103 103 GLY HA3 H 103 4.078 3.972 0.106 1
1 1196 . 5 1 1 A 103 103 GLY C C 103 175.602 174.561 1.041 1
1 1197 . 5 1 1 A 103 103 GLY CA C 103 46.120 45.400 0.720 1
1 1198 . 5 1 1 A 103 103 GLY N N 103 109.817 107.235 2.582 1
1 1199 . 5 1 1 A 104 104 ALA H H 104 8.366 8.530 -0.164 1
1 1200 . 5 1 1 A 104 104 ALA HA H 104 4.449 4.612 -0.163 1
1 1204 . 5 1 1 A 104 104 ALA C C 104 179.188 178.316 0.872 1
1 1205 . 5 1 1 A 104 104 ALA CA C 104 54.230 52.969 1.261 1
1 1206 . 5 1 1 A 104 104 ALA CB C 104 19.080 20.239 -1.159 1
1 1207 . 5 1 1 A 104 104 ALA N N 104 124.808 124.447 0.361 1
1 1208 . 5 1 1 A 105 105 GLU H H 105 8.576 8.784 -0.208 1
1 1209 . 5 1 1 A 105 105 GLU HA H 105 4.161 4.091 0.070 1
1 1214 . 5 1 1 A 105 105 GLU C C 105 179.200 179.169 0.031 1
1 1215 . 5 1 1 A 105 105 GLU CA C 105 59.173 58.952 0.221 1
1 1216 . 5 1 1 A 105 105 GLU CB C 105 29.194 29.395 -0.201 1
1 1218 . 5 1 1 A 105 105 GLU N N 105 119.238 118.810 0.428 1
1 1219 . 5 1 1 A 106 106 ALA H H 106 8.381 8.245 0.136 1
1 1220 . 5 1 1 A 106 106 ALA HA H 106 4.283 4.101 0.182 1
1 1224 . 5 1 1 A 106 106 ALA C C 106 180.048 180.189 -0.141 1
1 1225 . 5 1 1 A 106 106 ALA CA C 106 54.687 55.560 -0.873 1
1 1226 . 5 1 1 A 106 106 ALA CB C 106 18.341 18.815 -0.474 1
1 1227 . 5 1 1 A 106 106 ALA N N 106 123.327 123.438 -0.111 1
1 1228 . 5 1 1 A 107 107 ALA H H 107 8.123 8.238 -0.115 1
1 1229 . 5 1 1 A 107 107 ALA HA H 107 4.554 4.433 0.121 1
1 1233 . 5 1 1 A 107 107 ALA C C 107 179.757 179.836 -0.079 1
1 1234 . 5 1 1 A 107 107 ALA CA C 107 55.355 55.458 -0.103 1
1 1235 . 5 1 1 A 107 107 ALA CB C 107 18.939 18.216 0.723 1
1 1236 . 5 1 1 A 107 107 ALA N N 107 120.740 120.120 0.620 1
1 1237 . 5 1 1 A 108 108 ARG H H 108 8.403 7.631 0.772 1
1 1238 . 5 1 1 A 108 108 ARG HA H 108 4.254 4.027 0.227 1
1 1245 . 5 1 1 A 108 108 ARG C C 108 179.111 179.489 -0.378 1
1 1246 . 5 1 1 A 108 108 ARG CA C 108 59.015 59.236 -0.221 1
1 1247 . 5 1 1 A 108 108 ARG CB C 108 29.752 30.104 -0.352 1
1 1250 . 5 1 1 A 108 108 ARG N N 108 119.531 117.940 1.591 1
1 1251 . 5 1 1 A 109 109 GLY H H 109 8.182 8.751 -0.569 1
1 1252 . 5 1 1 A 109 109 GLY HA2 H 109 3.822 3.656 0.166 1
1 1253 . 5 1 1 A 109 109 GLY HA3 H 109 3.822 3.703 0.119 1
1 1254 . 5 1 1 A 109 109 GLY C C 109 177.020 176.607 0.413 1
1 1255 . 5 1 1 A 109 109 GLY CA C 109 46.718 47.419 -0.701 1
1 1256 . 5 1 1 A 109 109 GLY N N 109 107.331 107.829 -0.498 1
1 1257 . 5 1 1 A 110 110 TRP H H 110 7.925 7.746 0.179 1
1 1258 . 5 1 1 A 110 110 TRP HA H 110 3.963 4.441 -0.478 1
1 1267 . 5 1 1 A 110 110 TRP C C 110 176.691 177.886 -1.195 1
1 1268 . 5 1 1 A 110 110 TRP CA C 110 62.041 61.199 0.842 1
1 1269 . 5 1 1 A 110 110 TRP CB C 110 28.989 28.474 0.515 1
1 1275 . 5 1 1 A 110 110 TRP N N 110 122.304 121.643 0.661 1
1 1277 . 5 1 1 A 111 111 GLU H H 111 7.946 7.779 0.167 1
1 1278 . 5 1 1 A 111 111 GLU HA H 111 2.594 3.192 -0.598 1
1 1283 . 5 1 1 A 111 111 GLU C C 111 177.976 179.005 -1.029 1
1 1284 . 5 1 1 A 111 111 GLU CA C 111 60.193 59.089 1.104 1
1 1285 . 5 1 1 A 111 111 GLU CB C 111 29.277 29.309 -0.032 1
1 1287 . 5 1 1 A 111 111 GLU N N 111 121.755 119.253 2.502 1
1 1288 . 5 1 1 A 112 112 THR H H 112 7.993 7.647 0.346 1
1 1289 . 5 1 1 A 112 112 THR HA H 112 3.722 3.820 -0.098 1
1 1294 . 5 1 1 A 112 112 THR C C 112 176.038 175.877 0.161 1
1 1295 . 5 1 1 A 112 112 THR CA C 112 66.104 66.564 -0.460 1
1 1296 . 5 1 1 A 112 112 THR CB C 112 68.885 68.750 0.135 1
1 1298 . 5 1 1 A 112 112 THR N N 112 112.247 116.419 -4.172 1
1 1299 . 5 1 1 A 113 113 ALA H H 113 7.742 8.348 -0.606 1
1 1300 . 5 1 1 A 113 113 ALA HA H 113 4.029 3.986 0.043 1
1 1304 . 5 1 1 A 113 113 ALA C C 113 180.545 180.027 0.518 1
1 1305 . 5 1 1 A 113 113 ALA CA C 113 55.127 55.349 -0.222 1
1 1306 . 5 1 1 A 113 113 ALA CB C 113 18.854 18.426 0.428 1
1 1307 . 5 1 1 A 113 113 ALA N N 113 123.134 122.579 0.555 1
1 1308 . 5 1 1 A 114 114 ILE H H 114 8.472 8.466 0.006 1
1 1309 . 5 1 1 A 114 114 ILE HA H 114 3.613 3.772 -0.159 1
1 1319 . 5 1 1 A 114 114 ILE C C 114 176.947 178.077 -1.130 1
1 1320 . 5 1 1 A 114 114 ILE CA C 114 66.016 65.123 0.893 1
1 1321 . 5 1 1 A 114 114 ILE CB C 114 38.335 37.999 0.336 1
1 1325 . 5 1 1 A 114 114 ILE N N 114 118.276 117.794 0.482 1
1 1326 . 5 1 1 A 115 115 ARG H H 115 8.181 7.878 0.303 1
1 1327 . 5 1 1 A 115 115 ARG HA H 115 3.835 3.936 -0.101 1
1 1334 . 5 1 1 A 115 115 ARG C C 115 179.588 179.107 0.481 1
1 1335 . 5 1 1 A 115 115 ARG CA C 115 61.072 59.995 1.077 1
1 1336 . 5 1 1 A 115 115 ARG CB C 115 29.975 29.789 0.186 1
1 1339 . 5 1 1 A 115 115 ARG N N 115 117.921 119.449 -1.528 1
1 1340 . 5 1 1 A 116 116 GLN H H 116 8.395 8.602 -0.207 1
1 1341 . 5 1 1 A 116 116 GLN HA H 116 4.030 4.060 -0.030 1
1 1348 . 5 1 1 A 116 116 GLN C C 116 178.716 178.844 -0.128 1
1 1349 . 5 1 1 A 116 116 GLN CA C 116 58.790 58.867 -0.077 1
1 1350 . 5 1 1 A 116 116 GLN CB C 116 28.248 28.449 -0.201 1
1 1352 . 5 1 1 A 116 116 GLN N N 116 116.842 118.964 -2.122 1
1 1354 . 5 1 1 A 117 117 ALA H H 117 7.902 8.156 -0.254 1
1 1355 . 5 1 1 A 117 117 ALA HA H 117 4.143 4.139 0.004 1
1 1359 . 5 1 1 A 117 117 ALA C C 117 179.685 180.081 -0.396 1
1 1360 . 5 1 1 A 117 117 ALA CA C 117 54.476 54.954 -0.478 1
1 1361 . 5 1 1 A 117 117 ALA CB C 117 18.300 18.370 -0.070 1
1 1362 . 5 1 1 A 117 117 ALA N N 117 122.828 123.021 -0.193 1
1 1363 . 5 1 1 A 118 118 LEU H H 118 7.904 7.830 0.074 1
1 1364 . 5 1 1 A 118 118 LEU HA H 118 4.119 4.100 0.019 1
1 1374 . 5 1 1 A 118 118 LEU C C 118 178.437 178.675 -0.238 1
1 1375 . 5 1 1 A 118 118 LEU CA C 118 56.781 57.181 -0.400 1
1 1376 . 5 1 1 A 118 118 LEU CB C 118 42.371 41.696 0.675 1
1 1380 . 5 1 1 A 118 118 LEU N N 118 117.632 120.099 -2.467 1
1 1381 . 5 1 1 A 119 119 MET H H 119 7.673 8.030 -0.357 1
1 1382 . 5 1 1 A 119 119 MET HA H 119 4.442 4.180 0.262 1
1 1390 . 5 1 1 A 119 119 MET C C 119 176.680 177.417 -0.737 1
1 1391 . 5 1 1 A 119 119 MET CA C 119 56.432 58.461 -2.029 1
1 1392 . 5 1 1 A 119 119 MET CB C 119 32.769 32.156 0.613 1
1 1395 . 5 1 1 A 119 119 MET N N 119 117.286 117.905 -0.619 1
1 1396 . 5 1 1 A 120 120 SER H H 120 7.878 7.312 0.566 1
1 1397 . 5 1 1 A 120 120 SER HA H 120 4.500 4.523 -0.023 1
1 1400 . 5 1 1 A 120 120 SER C C 120 174.742 175.507 -0.765 1
1 1401 . 5 1 1 A 120 120 SER CA C 120 58.962 59.437 -0.475 1
1 1402 . 5 1 1 A 120 120 SER CB C 120 63.853 64.774 -0.921 1
1 1403 . 5 1 1 A 120 120 SER N N 120 115.064 112.883 2.181 1
1 1404 . 5 1 1 A 121 121 GLY H H 121 8.059 8.049 0.010 1
1 1405 . 5 1 1 A 121 121 GLY HA2 H 121 4.231 4.025 0.206 1
1 1406 . 5 1 1 A 121 121 GLY HA3 H 121 4.112 4.026 0.086 1
1 1407 . 5 1 1 A 121 121 GLY C C 121 172.065 174.752 -2.687 1
1 1408 . 5 1 1 A 121 121 GLY CA C 121 45.030 45.882 -0.852 1
1 1409 . 5 1 1 A 121 121 GLY N N 121 110.271 108.863 1.408 1
1 1410 . 5 1 1 A 122 122 PRO HA H 122 4.496 4.530 -0.034 1
1 1417 . 5 1 1 A 122 122 PRO CA C 122 63.399 63.586 -0.187 1
1 1418 . 5 1 1 A 122 122 PRO CB C 122 32.186 32.082 0.104 1
1 1 . 6 1 1 A 6 6 SER H H 6 8.337 9.112 -0.775 1
1 2 . 6 1 1 A 6 6 SER HA H 6 4.597 5.100 -0.503 1
1 5 . 6 1 1 A 6 6 SER C C 6 174.637 174.550 0.087 1
1 6 . 6 1 1 A 6 6 SER CA C 6 58.469 57.332 1.137 1
1 7 . 6 1 1 A 6 6 SER CB C 6 64.221 65.031 -0.810 1
1 8 . 6 1 1 A 6 6 SER N N 6 117.887 124.154 -6.267 1
1 9 . 6 1 1 A 7 7 GLY H H 7 8.280 8.739 -0.459 1
1 10 . 6 1 1 A 7 7 GLY HA2 H 7 4.063 4.036 0.027 1
1 11 . 6 1 1 A 7 7 GLY HA3 H 7 4.063 4.038 0.025 1
1 12 . 6 1 1 A 7 7 GLY C C 7 173.724 173.958 -0.234 1
1 13 . 6 1 1 A 7 7 GLY CA C 7 44.941 44.702 0.239 1
1 14 . 6 1 1 A 7 7 GLY N N 7 110.151 113.357 -3.206 1
1 15 . 6 1 1 A 8 8 THR H H 8 8.212 8.159 0.053 1
1 16 . 6 1 1 A 8 8 THR HA H 8 4.173 4.914 -0.741 1
1 21 . 6 1 1 A 8 8 THR C C 8 174.723 174.062 0.661 1
1 22 . 6 1 1 A 8 8 THR CA C 8 63.622 63.478 0.144 1
1 23 . 6 1 1 A 8 8 THR CB C 8 69.460 69.003 0.457 1
1 25 . 6 1 1 A 8 8 THR N N 8 116.817 116.433 0.384 1
1 26 . 6 1 1 A 9 9 LEU H H 9 9.374 9.246 0.128 1
1 27 . 6 1 1 A 9 9 LEU HA H 9 4.302 4.249 0.053 1
1 37 . 6 1 1 A 9 9 LEU C C 9 177.468 176.578 0.890 1
1 38 . 6 1 1 A 9 9 LEU CA C 9 55.936 56.378 -0.442 1
1 39 . 6 1 1 A 9 9 LEU CB C 9 42.843 42.594 0.249 1
1 43 . 6 1 1 A 9 9 LEU N N 9 127.798 128.557 -0.759 1
1 44 . 6 1 1 A 10 10 ARG H H 10 7.512 7.295 0.217 1
1 45 . 6 1 1 A 10 10 ARG HA H 10 4.199 4.639 -0.440 1
1 52 . 6 1 1 A 10 10 ARG C C 10 172.501 173.919 -1.418 1
1 53 . 6 1 1 A 10 10 ARG CA C 10 56.165 54.410 1.755 1
1 54 . 6 1 1 A 10 10 ARG CB C 10 32.442 33.266 -0.824 1
1 57 . 6 1 1 A 10 10 ARG N N 10 117.979 117.080 0.899 1
1 58 . 6 1 1 A 11 11 GLU H H 11 8.434 8.693 -0.259 1
1 59 . 6 1 1 A 11 11 GLU HA H 11 5.993 5.701 0.292 1
1 64 . 6 1 1 A 11 11 GLU C C 11 174.800 174.611 0.189 1
1 65 . 6 1 1 A 11 11 GLU CA C 11 54.570 55.202 -0.632 1
1 66 . 6 1 1 A 11 11 GLU CB C 11 34.245 33.139 1.106 1
1 68 . 6 1 1 A 11 11 GLU N N 11 120.782 122.291 -1.509 1
1 69 . 6 1 1 A 12 12 GLY H H 12 8.131 7.902 0.229 1
1 70 . 6 1 1 A 12 12 GLY HA2 H 12 4.714 3.503 1.211 1
1 71 . 6 1 1 A 12 12 GLY HA3 H 12 3.763 4.113 -0.350 1
1 72 . 6 1 1 A 12 12 GLY C C 12 171.060 171.646 -0.586 1
1 73 . 6 1 1 A 12 12 GLY CA C 12 45.241 45.115 0.126 1
1 74 . 6 1 1 A 12 12 GLY N N 12 107.457 106.295 1.162 1
1 75 . 6 1 1 A 13 13 TRP H H 13 8.783 8.555 0.228 1
1 76 . 6 1 1 A 13 13 TRP HA H 13 5.152 4.820 0.332 1
1 85 . 6 1 1 A 13 13 TRP C C 13 177.528 176.508 1.020 1
1 86 . 6 1 1 A 13 13 TRP CA C 13 57.783 58.765 -0.982 1
1 87 . 6 1 1 A 13 13 TRP CB C 13 30.222 29.922 0.300 1
1 93 . 6 1 1 A 13 13 TRP N N 13 120.792 121.269 -0.477 1
1 95 . 6 1 1 A 14 14 VAL H H 14 9.179 8.576 0.603 1
1 96 . 6 1 1 A 14 14 VAL HA H 14 4.072 4.509 -0.437 1
1 104 . 6 1 1 A 14 14 VAL C C 14 174.981 173.434 1.547 1
1 105 . 6 1 1 A 14 14 VAL CA C 14 61.741 59.976 1.765 1
1 106 . 6 1 1 A 14 14 VAL CB C 14 35.143 35.139 0.004 1
1 109 . 6 1 1 A 14 14 VAL N N 14 125.476 122.903 2.573 1
1 110 . 6 1 1 A 15 15 VAL H H 15 8.403 8.737 -0.334 1
1 111 . 6 1 1 A 15 15 VAL HA H 15 5.532 5.078 0.454 1
1 119 . 6 1 1 A 15 15 VAL C C 15 175.078 174.206 0.872 1
1 120 . 6 1 1 A 15 15 VAL CA C 15 59.489 59.380 0.109 1
1 121 . 6 1 1 A 15 15 VAL CB C 15 34.210 34.999 -0.789 1
1 124 . 6 1 1 A 15 15 VAL N N 15 126.189 125.441 0.748 1
1 125 . 6 1 1 A 16 16 HIS H H 16 9.122 8.768 0.354 1
1 126 . 6 1 1 A 16 16 HIS HA H 16 5.823 5.844 -0.021 1
1 131 . 6 1 1 A 16 16 HIS C C 16 172.998 172.524 0.474 1
1 132 . 6 1 1 A 16 16 HIS CA C 16 56.253 53.732 2.521 1
1 133 . 6 1 1 A 16 16 HIS CB C 16 34.273 33.325 0.948 1
1 136 . 6 1 1 A 16 16 HIS N N 16 121.152 120.929 0.223 1
1 137 . 6 1 1 A 17 17 TYR H H 17 8.465 8.625 -0.160 1
1 138 . 6 1 1 A 17 17 TYR HA H 17 5.096 4.696 0.400 1
1 145 . 6 1 1 A 17 17 TYR C C 17 173.640 172.195 1.445 1
1 146 . 6 1 1 A 17 17 TYR CA C 17 56.903 56.612 0.291 1
1 147 . 6 1 1 A 17 17 TYR CB C 17 40.103 40.210 -0.107 1
1 152 . 6 1 1 A 17 17 TYR N N 17 115.558 116.345 -0.787 1
1 153 . 6 1 1 A 18 18 SER H H 18 9.122 8.706 0.416 1
1 154 . 6 1 1 A 18 18 SER HA H 18 6.144 5.320 0.824 1
1 157 . 6 1 1 A 18 18 SER C C 18 173.204 175.518 -2.314 1
1 158 . 6 1 1 A 18 18 SER CA C 18 56.640 57.204 -0.564 1
1 159 . 6 1 1 A 18 18 SER CB C 18 68.788 65.103 3.685 1
1 160 . 6 1 1 A 18 18 SER N N 18 118.846 117.179 1.667 1
1 161 . 6 1 1 A 19 19 ASN H H 19 9.053 9.024 0.029 1
1 162 . 6 1 1 A 19 19 ASN HA H 19 4.473 4.637 -0.164 1
1 167 . 6 1 1 A 19 19 ASN C C 19 175.396 175.977 -0.581 1
1 168 . 6 1 1 A 19 19 ASN CA C 19 55.373 53.111 2.262 1
1 169 . 6 1 1 A 19 19 ASN CB C 19 36.900 37.401 -0.501 1
1 170 . 6 1 1 A 19 19 ASN N N 19 113.712 120.335 -6.623 1
1 172 . 6 1 1 A 20 20 LYS H H 20 7.677 8.280 -0.603 1
1 173 . 6 1 1 A 20 20 LYS HA H 20 4.413 4.517 -0.104 1
1 182 . 6 1 1 A 20 20 LYS C C 20 176.078 177.450 -1.372 1
1 183 . 6 1 1 A 20 20 LYS CA C 20 55.679 57.625 -1.946 1
1 184 . 6 1 1 A 20 20 LYS CB C 20 33.023 34.154 -1.131 1
1 188 . 6 1 1 A 20 20 LYS N N 20 117.213 120.086 -2.873 1
1 189 . 6 1 1 A 21 21 ASP H H 21 7.395 7.941 -0.546 1
1 190 . 6 1 1 A 21 21 ASP HA H 21 4.808 4.860 -0.052 1
1 193 . 6 1 1 A 21 21 ASP C C 21 176.413 176.088 0.325 1
1 194 . 6 1 1 A 21 21 ASP CA C 21 53.983 53.038 0.945 1
1 195 . 6 1 1 A 21 21 ASP CB C 21 41.199 42.121 -0.922 1
1 196 . 6 1 1 A 21 21 ASP N N 21 119.879 117.381 2.498 1
1 197 . 6 1 1 A 22 22 THR H H 22 8.593 8.054 0.539 1
1 198 . 6 1 1 A 22 22 THR HA H 22 4.352 4.372 -0.020 1
1 203 . 6 1 1 A 22 22 THR C C 22 172.913 173.663 -0.750 1
1 204 . 6 1 1 A 22 22 THR CA C 22 62.691 62.925 -0.234 1
1 205 . 6 1 1 A 22 22 THR CB C 22 68.332 66.637 1.695 1
1 207 . 6 1 1 A 22 22 THR N N 22 116.299 114.428 1.871 1
1 208 . 6 1 1 A 23 23 LEU H H 23 7.645 7.981 -0.336 1
1 209 . 6 1 1 A 23 23 LEU HA H 23 4.318 4.453 -0.135 1
1 219 . 6 1 1 A 23 23 LEU C C 23 176.692 175.665 1.027 1
1 220 . 6 1 1 A 23 23 LEU CA C 23 54.617 54.063 0.554 1
1 221 . 6 1 1 A 23 23 LEU CB C 23 41.939 40.331 1.608 1
1 225 . 6 1 1 A 23 23 LEU N N 23 123.606 121.802 1.804 1
1 226 . 6 1 1 A 24 24 ARG H H 24 8.563 7.581 0.982 1
1 227 . 6 1 1 A 24 24 ARG HA H 24 4.373 4.395 -0.022 1
1 235 . 6 1 1 A 24 24 ARG C C 24 176.584 175.715 0.869 1
1 236 . 6 1 1 A 24 24 ARG CA C 24 57.854 56.166 1.688 1
1 237 . 6 1 1 A 24 24 ARG CB C 24 31.126 29.936 1.190 1
1 240 . 6 1 1 A 24 24 ARG N N 24 127.152 123.607 3.545 1
1 242 . 6 1 1 A 25 25 LYS H H 25 8.633 8.240 0.393 1
1 243 . 6 1 1 A 25 25 LYS HA H 25 4.513 4.963 -0.450 1
1 251 . 6 1 1 A 25 25 LYS C C 25 173.567 174.629 -1.062 1
1 252 . 6 1 1 A 25 25 LYS CA C 25 54.792 54.528 0.264 1
1 253 . 6 1 1 A 25 25 LYS CB C 25 37.416 34.981 2.435 1
1 257 . 6 1 1 A 25 25 LYS N N 25 122.682 120.931 1.751 1
1 258 . 6 1 1 A 26 26 ARG H H 26 8.303 8.844 -0.541 1
1 259 . 6 1 1 A 26 26 ARG HA H 26 5.153 5.015 0.138 1
1 266 . 6 1 1 A 26 26 ARG C C 26 174.554 175.072 -0.518 1
1 267 . 6 1 1 A 26 26 ARG CA C 26 55.083 55.180 -0.097 1
1 268 . 6 1 1 A 26 26 ARG CB C 26 32.789 31.525 1.264 1
1 271 . 6 1 1 A 26 26 ARG N N 26 121.819 125.171 -3.352 1
1 272 . 6 1 1 A 27 27 HIS H H 27 8.793 9.092 -0.299 1
1 273 . 6 1 1 A 27 27 HIS HA H 27 5.155 5.315 -0.160 1
1 278 . 6 1 1 A 27 27 HIS CA C 27 56.904 54.945 1.959 1
1 279 . 6 1 1 A 27 27 HIS CB C 27 34.683 31.351 3.332 1
1 282 . 6 1 1 A 27 27 HIS N N 27 122.102 120.129 1.973 1
1 283 . 6 1 1 A 28 28 TYR H H 28 9.273 8.203 1.070 1
1 284 . 6 1 1 A 28 28 TYR HA H 28 4.332 4.314 0.018 1
1 291 . 6 1 1 A 28 28 TYR C C 28 174.730 175.180 -0.450 1
1 292 . 6 1 1 A 28 28 TYR CA C 28 58.680 57.690 0.990 1
1 293 . 6 1 1 A 28 28 TYR CB C 28 38.673 38.304 0.369 1
1 298 . 6 1 1 A 28 28 TYR N N 28 125.605 121.516 4.089 1
1 299 . 6 1 1 A 29 29 TRP H H 29 9.273 8.982 0.291 1
1 300 . 6 1 1 A 29 29 TRP HA H 29 5.543 4.919 0.624 1
1 309 . 6 1 1 A 29 29 TRP C C 29 176.172 176.537 -0.365 1
1 310 . 6 1 1 A 29 29 TRP CA C 29 56.658 56.773 -0.115 1
1 311 . 6 1 1 A 29 29 TRP CB C 29 32.154 30.785 1.369 1
1 317 . 6 1 1 A 29 29 TRP N N 29 131.340 128.376 2.964 1
1 318 . 6 1 1 A 30 30 ARG H H 30 9.164 9.192 -0.028 1
1 319 . 6 1 1 A 30 30 ARG HA H 30 5.302 5.541 -0.239 1
1 327 . 6 1 1 A 30 30 ARG C C 30 174.774 174.502 0.272 1
1 328 . 6 1 1 A 30 30 ARG CA C 30 56.271 54.740 1.531 1
1 329 . 6 1 1 A 30 30 ARG CB C 30 34.203 33.960 0.243 1
1 332 . 6 1 1 A 30 30 ARG N N 30 116.040 120.796 -4.756 1
1 334 . 6 1 1 A 31 31 LEU H H 31 9.273 9.589 -0.316 1
1 335 . 6 1 1 A 31 31 LEU HA H 31 5.324 5.406 -0.082 1
1 345 . 6 1 1 A 31 31 LEU C C 31 174.488 174.570 -0.082 1
1 346 . 6 1 1 A 31 31 LEU CA C 31 53.807 53.518 0.289 1
1 347 . 6 1 1 A 31 31 LEU CB C 31 46.667 45.767 0.900 1
1 351 . 6 1 1 A 31 31 LEU N N 31 127.075 127.047 0.028 1
1 352 . 6 1 1 A 32 32 ASP H H 32 8.854 8.707 0.147 1
1 353 . 6 1 1 A 32 32 ASP HA H 32 4.902 5.119 -0.217 1
1 356 . 6 1 1 A 32 32 ASP C C 32 173.474 176.534 -3.060 1
1 357 . 6 1 1 A 32 32 ASP CA C 32 53.104 52.299 0.805 1
1 358 . 6 1 1 A 32 32 ASP CB C 32 42.931 44.516 -1.585 1
1 359 . 6 1 1 A 32 32 ASP N N 32 129.349 125.354 3.995 1
1 360 . 6 1 1 A 33 33 CYS H H 33 8.153 8.872 -0.719 1
1 361 . 6 1 1 A 33 33 CYS HA H 33 4.323 4.352 -0.029 1
1 364 . 6 1 1 A 33 33 CYS C C 33 174.476 174.425 0.051 1
1 365 . 6 1 1 A 33 33 CYS CA C 33 59.853 60.046 -0.193 1
1 366 . 6 1 1 A 33 33 CYS CB C 33 27.508 27.083 0.425 1
1 367 . 6 1 1 A 33 33 CYS N N 33 108.439 119.232 -10.793 1
1 368 . 6 1 1 A 34 34 LYS H H 34 9.144 7.746 1.398 1
1 369 . 6 1 1 A 34 34 LYS HA H 34 4.616 4.411 0.205 1
1 378 . 6 1 1 A 34 34 LYS C C 34 177.601 176.228 1.373 1
1 379 . 6 1 1 A 34 34 LYS CA C 34 57.185 56.813 0.372 1
1 380 . 6 1 1 A 34 34 LYS CB C 34 35.623 35.061 0.562 1
1 384 . 6 1 1 A 34 34 LYS N N 34 119.884 118.408 1.476 1
1 385 . 6 1 1 A 35 35 CYS H H 35 9.102 7.678 1.424 1
1 386 . 6 1 1 A 35 35 CYS HA H 35 4.935 4.781 0.154 1
1 389 . 6 1 1 A 35 35 CYS C C 35 172.283 172.575 -0.292 1
1 390 . 6 1 1 A 35 35 CYS CA C 35 57.748 58.212 -0.464 1
1 391 . 6 1 1 A 35 35 CYS CB C 35 31.537 32.249 -0.712 1
1 392 . 6 1 1 A 35 35 CYS N N 35 120.317 114.206 6.111 1
1 393 . 6 1 1 A 36 36 ILE H H 36 8.213 8.938 -0.725 1
1 394 . 6 1 1 A 36 36 ILE HA H 36 4.617 5.020 -0.403 1
1 404 . 6 1 1 A 36 36 ILE C C 36 175.312 175.074 0.238 1
1 405 . 6 1 1 A 36 36 ILE CA C 36 60.967 60.484 0.483 1
1 406 . 6 1 1 A 36 36 ILE CB C 36 39.718 38.554 1.164 1
1 410 . 6 1 1 A 36 36 ILE N N 36 121.905 121.861 0.044 1
1 411 . 6 1 1 A 37 37 THR H H 37 9.076 8.834 0.242 1
1 412 . 6 1 1 A 37 37 THR HA H 37 4.364 4.724 -0.360 1
1 417 . 6 1 1 A 37 37 THR CA C 37 61.834 62.093 -0.259 1
1 418 . 6 1 1 A 37 37 THR CB C 37 69.237 70.110 -0.873 1
1 420 . 6 1 1 A 37 37 THR N N 37 122.500 123.544 -1.044 1
1 421 . 6 1 1 A 38 38 LEU H H 38 8.263 8.681 -0.418 1
1 422 . 6 1 1 A 38 38 LEU HA H 38 4.445 5.059 -0.614 1
1 432 . 6 1 1 A 38 38 LEU CA C 38 55.611 52.865 2.746 1
1 433 . 6 1 1 A 38 38 LEU CB C 38 42.702 45.896 -3.194 1
1 437 . 6 1 1 A 38 38 LEU N N 38 126.987 123.875 3.112 1
1 438 . 6 1 1 A 39 39 PHE H H 39 9.520 8.397 1.123 1
1 439 . 6 1 1 A 39 39 PHE HA H 39 4.998 4.980 0.018 1
1 447 . 6 1 1 A 39 39 PHE CA C 39 57.331 56.519 0.812 1
1 448 . 6 1 1 A 39 39 PHE CB C 39 42.453 42.833 -0.380 1
1 454 . 6 1 1 A 39 39 PHE N N 39 120.545 118.932 1.613 1
1 455 . 6 1 1 A 40 40 GLN H H 40 9.878 8.892 0.986 1
1 456 . 6 1 1 A 40 40 GLN HA H 40 4.376 4.328 0.048 1
1 463 . 6 1 1 A 40 40 GLN CA C 40 59.513 59.607 -0.094 1
1 464 . 6 1 1 A 40 40 GLN CB C 40 29.317 29.044 0.273 1
1 467 . 6 1 1 A 41 41 ASN H H 41 7.732 8.199 -0.467 1
1 468 . 6 1 1 A 41 41 ASN HA H 41 4.812 5.266 -0.454 1
1 473 . 6 1 1 A 41 41 ASN CA C 41 52.618 51.533 1.085 1
1 474 . 6 1 1 A 41 41 ASN CB C 41 39.362 41.826 -2.464 1
1 475 . 6 1 1 A 41 41 ASN N N 41 107.613 113.891 -6.278 1
1 477 . 6 1 1 A 42 42 ASN HA H 42 3.476 3.997 -0.521 1
1 482 . 6 1 1 A 42 42 ASN C C 42 173.607 175.554 -1.947 1
1 483 . 6 1 1 A 42 42 ASN CA C 42 54.888 55.033 -0.145 1
1 484 . 6 1 1 A 42 42 ASN CB C 42 35.613 37.596 -1.983 1
1 486 . 6 1 1 A 43 43 THR H H 43 8.394 7.563 0.831 1
1 487 . 6 1 1 A 43 43 THR HA H 43 4.403 4.643 -0.240 1
1 492 . 6 1 1 A 43 43 THR C C 43 174.464 173.408 1.056 1
1 493 . 6 1 1 A 43 43 THR CA C 43 61.978 60.732 1.246 1
1 494 . 6 1 1 A 43 43 THR CB C 43 70.036 68.609 1.427 1
1 496 . 6 1 1 A 43 43 THR N N 43 111.795 106.947 4.848 1
1 497 . 6 1 1 A 44 44 THR H H 44 8.058 7.385 0.673 1
1 498 . 6 1 1 A 44 44 THR HA H 44 4.464 4.807 -0.343 1
1 503 . 6 1 1 A 44 44 THR CA C 44 61.599 59.772 1.827 1
1 504 . 6 1 1 A 44 44 THR CB C 44 69.137 71.008 -1.871 1
1 506 . 6 1 1 A 44 44 THR N N 44 116.514 115.835 0.679 1
1 507 . 6 1 1 A 45 45 ASN H H 45 6.653 8.744 -2.091 1
1 508 . 6 1 1 A 45 45 ASN HA H 45 4.945 4.780 0.165 1
1 513 . 6 1 1 A 45 45 ASN CA C 45 53.227 55.431 -2.204 1
1 514 . 6 1 1 A 45 45 ASN CB C 45 38.483 38.365 0.118 1
1 516 . 6 1 1 A 46 46 ARG H H 46 8.213 8.134 0.079 1
1 517 . 6 1 1 A 46 46 ARG HA H 46 4.583 4.418 0.165 1
1 524 . 6 1 1 A 46 46 ARG CA C 46 55.487 55.217 0.270 1
1 525 . 6 1 1 A 46 46 ARG CB C 46 31.153 31.888 -0.735 1
1 528 . 6 1 1 A 46 46 ARG N N 46 121.652 118.737 2.915 1
1 529 . 6 1 1 A 47 47 TYR H H 47 7.973 8.826 -0.853 1
1 536 . 6 1 1 A 47 47 TYR CB C 47 39.356 40.731 -1.375 1
1 541 . 6 1 1 A 48 48 TYR H H 48 9.023 8.910 0.113 1
1 542 . 6 1 1 A 48 48 TYR HA H 48 4.662 4.242 0.420 1
1 549 . 6 1 1 A 48 48 TYR CB C 48 39.863 40.602 -0.739 1
1 554 . 6 1 1 A 48 48 TYR N N 48 121.223 119.444 1.779 1
1 555 . 6 1 1 A 49 49 LYS H H 49 7.134 7.363 -0.229 1
1 556 . 6 1 1 A 49 49 LYS HA H 49 4.283 4.586 -0.303 1
1 565 . 6 1 1 A 49 49 LYS CA C 49 55.167 55.641 -0.474 1
1 566 . 6 1 1 A 49 49 LYS CB C 49 36.699 36.241 0.458 1
1 570 . 6 1 1 A 49 49 LYS N N 49 117.339 118.100 -0.761 1
1 571 . 6 1 1 A 50 50 GLU H H 50 8.411 9.231 -0.820 1
1 572 . 6 1 1 A 50 50 GLU HA H 50 4.583 4.944 -0.361 1
1 577 . 6 1 1 A 50 50 GLU CA C 50 54.592 54.983 -0.391 1
1 578 . 6 1 1 A 50 50 GLU CB C 50 33.263 31.942 1.321 1
1 580 . 6 1 1 A 50 50 GLU N N 50 123.825 126.137 -2.312 1
1 581 . 6 1 1 A 51 51 ILE H H 51 9.225 8.944 0.281 1
1 582 . 6 1 1 A 51 51 ILE HA H 51 4.277 4.645 -0.368 1
1 592 . 6 1 1 A 51 51 ILE CA C 51 58.182 58.054 0.128 1
1 593 . 6 1 1 A 51 51 ILE CB C 51 39.663 38.374 1.289 1
1 597 . 6 1 1 A 51 51 ILE N N 51 125.271 126.881 -1.610 1
1 598 . 6 1 1 A 52 52 PRO HA H 52 4.543 4.663 -0.120 1
1 605 . 6 1 1 A 52 52 PRO C C 52 178.340 178.108 0.232 1
1 606 . 6 1 1 A 52 52 PRO CA C 52 62.726 62.962 -0.236 1
1 607 . 6 1 1 A 52 52 PRO CB C 52 32.003 31.718 0.285 1
1 610 . 6 1 1 A 53 53 LEU H H 53 8.723 8.535 0.188 1
1 611 . 6 1 1 A 53 53 LEU HA H 53 3.891 3.968 -0.077 1
1 621 . 6 1 1 A 53 53 LEU C C 53 179.673 179.003 0.670 1
1 622 . 6 1 1 A 53 53 LEU CA C 53 58.205 57.536 0.669 1
1 623 . 6 1 1 A 53 53 LEU CB C 53 40.171 41.751 -1.580 1
1 627 . 6 1 1 A 53 53 LEU N N 53 125.150 124.376 0.774 1
1 628 . 6 1 1 A 54 54 SER H H 54 8.360 8.289 0.071 1
1 629 . 6 1 1 A 54 54 SER HA H 54 4.164 4.153 0.011 1
1 632 . 6 1 1 A 54 54 SER C C 54 175.517 177.046 -1.529 1
1 633 . 6 1 1 A 54 54 SER CA C 54 60.193 61.553 -1.360 1
1 634 . 6 1 1 A 54 54 SER CB C 54 62.617 62.775 -0.158 1
1 635 . 6 1 1 A 54 54 SER N N 54 111.266 115.490 -4.224 1
1 636 . 6 1 1 A 55 55 GLU H H 55 7.666 8.083 -0.417 1
1 637 . 6 1 1 A 55 55 GLU HA H 55 4.363 4.088 0.275 1
1 642 . 6 1 1 A 55 55 GLU C C 55 176.753 177.909 -1.156 1
1 643 . 6 1 1 A 55 55 GLU CA C 55 56.200 59.148 -2.948 1
1 644 . 6 1 1 A 55 55 GLU CB C 55 30.526 29.115 1.411 1
1 646 . 6 1 1 A 55 55 GLU N N 55 119.485 119.766 -0.281 1
1 647 . 6 1 1 A 56 56 ILE H H 56 7.601 7.099 0.502 1
1 648 . 6 1 1 A 56 56 ILE HA H 56 3.793 3.947 -0.154 1
1 658 . 6 1 1 A 56 56 ILE C C 56 175.142 175.812 -0.670 1
1 659 . 6 1 1 A 56 56 ILE CA C 56 63.518 62.417 1.101 1
1 660 . 6 1 1 A 56 56 ILE CB C 56 37.169 38.137 -0.968 1
1 664 . 6 1 1 A 56 56 ILE N N 56 120.430 120.182 0.248 1
1 665 . 6 1 1 A 57 57 LEU H H 57 9.263 9.302 -0.039 1
1 666 . 6 1 1 A 57 57 LEU HA H 57 4.343 4.376 -0.033 1
1 676 . 6 1 1 A 57 57 LEU C C 57 177.898 176.564 1.334 1
1 677 . 6 1 1 A 57 57 LEU CA C 57 56.569 55.917 0.652 1
1 678 . 6 1 1 A 57 57 LEU CB C 57 41.980 42.521 -0.541 1
1 682 . 6 1 1 A 57 57 LEU N N 57 129.464 129.120 0.344 1
1 683 . 6 1 1 A 58 58 THR H H 58 7.414 7.396 0.018 1
1 684 . 6 1 1 A 58 58 THR HA H 58 4.512 4.928 -0.416 1
1 689 . 6 1 1 A 58 58 THR C C 58 171.314 172.754 -1.440 1
1 690 . 6 1 1 A 58 58 THR CA C 58 60.562 61.318 -0.756 1
1 691 . 6 1 1 A 58 58 THR CB C 58 70.803 73.368 -2.565 1
1 693 . 6 1 1 A 58 58 THR N N 58 109.129 110.299 -1.170 1
1 694 . 6 1 1 A 59 59 VAL H H 59 8.152 8.464 -0.312 1
1 695 . 6 1 1 A 59 59 VAL HA H 59 5.061 4.996 0.065 1
1 703 . 6 1 1 A 59 59 VAL C C 59 174.985 175.073 -0.088 1
1 704 . 6 1 1 A 59 59 VAL CA C 59 61.354 61.188 0.166 1
1 705 . 6 1 1 A 59 59 VAL CB C 59 33.855 34.272 -0.417 1
1 708 . 6 1 1 A 59 59 VAL N N 59 123.676 124.456 -0.780 1
1 709 . 6 1 1 A 60 60 GLU H H 60 9.074 8.811 0.263 1
1 710 . 6 1 1 A 60 60 GLU HA H 60 4.977 4.851 0.126 1
1 715 . 6 1 1 A 60 60 GLU C C 60 176.063 175.514 0.549 1
1 716 . 6 1 1 A 60 60 GLU CA C 60 53.807 54.443 -0.636 1
1 717 . 6 1 1 A 60 60 GLU CB C 60 33.739 33.311 0.428 1
1 719 . 6 1 1 A 60 60 GLU N N 60 125.125 126.272 -1.147 1
1 720 . 6 1 1 A 61 61 SER H H 61 8.763 8.531 0.232 1
1 721 . 6 1 1 A 61 61 SER HA H 61 4.452 4.823 -0.371 1
1 724 . 6 1 1 A 61 61 SER C C 61 173.288 174.465 -1.177 1
1 725 . 6 1 1 A 61 61 SER CA C 61 59.384 57.142 2.242 1
1 726 . 6 1 1 A 61 61 SER CB C 61 63.390 65.044 -1.654 1
1 727 . 6 1 1 A 61 61 SER N N 61 117.523 115.278 2.245 1
1 728 . 6 1 1 A 62 62 ALA H H 62 7.293 8.860 -1.567 1
1 729 . 6 1 1 A 62 62 ALA HA H 62 3.817 4.300 -0.483 1
1 733 . 6 1 1 A 62 62 ALA C C 62 176.717 178.031 -1.314 1
1 734 . 6 1 1 A 62 62 ALA CA C 62 53.966 52.983 0.983 1
1 735 . 6 1 1 A 62 62 ALA CB C 62 18.640 18.437 0.203 1
1 736 . 6 1 1 A 62 62 ALA N N 62 122.650 125.650 -3.000 1
1 737 . 6 1 1 A 63 63 GLN H H 63 8.736 8.491 0.245 1
1 738 . 6 1 1 A 63 63 GLN HA H 63 4.445 4.596 -0.151 1
1 745 . 6 1 1 A 63 63 GLN C C 63 173.700 175.211 -1.511 1
1 746 . 6 1 1 A 63 63 GLN CA C 63 56.376 55.624 0.752 1
1 747 . 6 1 1 A 63 63 GLN CB C 63 31.515 30.953 0.562 1
1 749 . 6 1 1 A 63 63 GLN N N 63 120.251 119.612 0.639 1
1 751 . 6 1 1 A 64 64 ASN H H 64 9.272 7.697 1.575 1
1 752 . 6 1 1 A 64 64 ASN HA H 64 4.906 4.919 -0.013 1
1 757 . 6 1 1 A 64 64 ASN C C 64 174.754 175.112 -0.358 1
1 758 . 6 1 1 A 64 64 ASN CA C 64 51.837 52.291 -0.454 1
1 759 . 6 1 1 A 64 64 ASN CB C 64 38.156 38.903 -0.747 1
1 760 . 6 1 1 A 64 64 ASN N N 64 122.346 118.617 3.729 1
1 762 . 6 1 1 A 65 65 PHE H H 65 8.854 8.919 -0.065 1
1 763 . 6 1 1 A 65 65 PHE HA H 65 4.947 5.118 -0.171 1
1 771 . 6 1 1 A 65 65 PHE C C 65 177.274 176.037 1.237 1
1 772 . 6 1 1 A 65 65 PHE CA C 65 57.519 57.013 0.506 1
1 773 . 6 1 1 A 65 65 PHE CB C 65 38.485 38.391 0.094 1
1 779 . 6 1 1 A 65 65 PHE N N 65 123.638 125.795 -2.157 1
1 780 . 6 1 1 A 66 66 SER H H 66 8.163 7.863 0.300 1
1 781 . 6 1 1 A 66 66 SER HA H 66 4.393 4.497 -0.104 1
1 784 . 6 1 1 A 66 66 SER C C 66 175.699 177.003 -1.304 1
1 785 . 6 1 1 A 66 66 SER CA C 66 60.791 60.062 0.729 1
1 786 . 6 1 1 A 66 66 SER CB C 66 64.591 63.834 0.757 1
1 787 . 6 1 1 A 66 66 SER N N 66 113.913 114.314 -0.401 1
1 788 . 6 1 1 A 67 67 LEU H H 67 8.574 7.779 0.795 1
1 789 . 6 1 1 A 67 67 LEU HA H 67 4.302 3.738 0.564 1
1 799 . 6 1 1 A 67 67 LEU C C 67 176.269 177.301 -1.032 1
1 800 . 6 1 1 A 67 67 LEU CA C 67 55.601 58.131 -2.530 1
1 801 . 6 1 1 A 67 67 LEU CB C 67 42.021 41.756 0.265 1
1 805 . 6 1 1 A 67 67 LEU N N 67 121.264 121.000 0.264 1
1 806 . 6 1 1 A 68 68 VAL H H 68 6.921 7.504 -0.583 1
1 807 . 6 1 1 A 68 68 VAL HA H 68 4.473 4.075 0.398 1
1 815 . 6 1 1 A 68 68 VAL C C 68 173.809 174.907 -1.098 1
1 816 . 6 1 1 A 68 68 VAL CA C 68 58.047 60.883 -2.836 1
1 817 . 6 1 1 A 68 68 VAL CB C 68 32.295 31.569 0.726 1
1 820 . 6 1 1 A 68 68 VAL N N 68 111.287 115.458 -4.171 1
1 821 . 6 1 1 A 69 69 PRO HA H 69 4.658 4.602 0.056 1
1 828 . 6 1 1 A 69 69 PRO CA C 69 61.747 61.588 0.159 1
1 829 . 6 1 1 A 69 69 PRO CB C 69 30.693 32.474 -1.781 1
1 832 . 6 1 1 A 70 70 PRO HA H 70 4.414 4.386 0.028 1
1 839 . 6 1 1 A 70 70 PRO CA C 70 63.997 64.568 -0.571 1
1 840 . 6 1 1 A 70 70 PRO CB C 70 31.602 31.751 -0.149 1
1 843 . 6 1 1 A 71 71 GLY H H 71 8.824 8.482 0.342 1
1 844 . 6 1 1 A 71 71 GLY HA2 H 71 3.703 3.930 -0.227 1
1 845 . 6 1 1 A 71 71 GLY HA3 H 71 4.193 3.932 0.261 1
1 846 . 6 1 1 A 71 71 GLY C C 71 174.052 174.010 0.042 1
1 847 . 6 1 1 A 71 71 GLY CA C 71 45.065 45.487 -0.422 1
1 848 . 6 1 1 A 71 71 GLY N N 71 111.845 106.321 5.524 1
1 849 . 6 1 1 A 72 72 THR H H 72 7.597 7.289 0.308 1
1 850 . 6 1 1 A 72 72 THR HA H 72 4.133 4.302 -0.169 1
1 855 . 6 1 1 A 72 72 THR CA C 72 63.129 62.431 0.698 1
1 856 . 6 1 1 A 72 72 THR CB C 72 69.560 69.529 0.031 1
1 858 . 6 1 1 A 72 72 THR N N 72 117.485 115.084 2.401 1
1 859 . 6 1 1 A 73 73 ASN H H 73 9.280 8.532 0.748 1
1 860 . 6 1 1 A 73 73 ASN HA H 73 4.786 4.665 0.121 1
1 865 . 6 1 1 A 73 73 ASN CA C 73 52.009 52.181 -0.172 1
1 866 . 6 1 1 A 73 73 ASN CB C 73 37.553 37.880 -0.327 1
1 867 . 6 1 1 A 73 73 ASN N N 73 127.641 125.422 2.219 1
1 869 . 6 1 1 A 74 74 PRO HA H 74 4.752 4.889 -0.137 1
1 876 . 6 1 1 A 74 74 PRO C C 74 175.190 176.392 -1.202 1
1 877 . 6 1 1 A 74 74 PRO CA C 74 63.395 62.521 0.874 1
1 878 . 6 1 1 A 74 74 PRO CB C 74 33.164 33.291 -0.127 1
1 881 . 6 1 1 A 75 75 HIS H H 75 8.025 9.066 -1.041 1
1 882 . 6 1 1 A 75 75 HIS HA H 75 5.047 5.354 -0.307 1
1 887 . 6 1 1 A 75 75 HIS C C 75 172.562 175.239 -2.677 1
1 888 . 6 1 1 A 75 75 HIS CA C 75 54.336 53.880 0.456 1
1 889 . 6 1 1 A 75 75 HIS CB C 75 30.956 33.151 -2.195 1
1 892 . 6 1 1 A 75 75 HIS N N 75 116.198 116.777 -0.579 1
1 893 . 6 1 1 A 76 76 CYS H H 76 8.343 9.398 -1.055 1
1 894 . 6 1 1 A 76 76 CYS HA H 76 4.594 4.419 0.175 1
1 897 . 6 1 1 A 76 76 CYS C C 76 175.651 174.905 0.746 1
1 898 . 6 1 1 A 76 76 CYS CA C 76 61.066 61.086 -0.020 1
1 899 . 6 1 1 A 76 76 CYS CB C 76 30.193 28.615 1.578 1
1 900 . 6 1 1 A 76 76 CYS N N 76 113.289 118.125 -4.836 1
1 901 . 6 1 1 A 77 77 PHE H H 77 8.433 7.375 1.058 1
1 902 . 6 1 1 A 77 77 PHE HA H 77 5.105 5.269 -0.164 1
1 910 . 6 1 1 A 77 77 PHE C C 77 171.822 172.960 -1.138 1
1 911 . 6 1 1 A 77 77 PHE CA C 77 56.874 55.785 1.089 1
1 912 . 6 1 1 A 77 77 PHE CB C 77 39.393 42.880 -3.487 1
1 918 . 6 1 1 A 77 77 PHE N N 77 114.874 114.418 0.456 1
1 919 . 6 1 1 A 78 78 GLU H H 78 9.823 9.176 0.647 1
1 920 . 6 1 1 A 78 78 GLU HA H 78 5.333 5.071 0.262 1
1 925 . 6 1 1 A 78 78 GLU C C 78 175.602 175.484 0.118 1
1 926 . 6 1 1 A 78 78 GLU CA C 78 54.212 55.077 -0.865 1
1 927 . 6 1 1 A 78 78 GLU CB C 78 31.702 32.496 -0.794 1
1 929 . 6 1 1 A 78 78 GLU N N 78 121.074 118.831 2.243 1
1 930 . 6 1 1 A 79 79 ILE H H 79 9.093 9.097 -0.004 1
1 931 . 6 1 1 A 79 79 ILE HA H 79 4.637 4.587 0.050 1
1 941 . 6 1 1 A 79 79 ILE C C 79 174.476 175.108 -0.632 1
1 942 . 6 1 1 A 79 79 ILE CA C 79 60.932 60.696 0.236 1
1 943 . 6 1 1 A 79 79 ILE CB C 79 40.803 37.075 3.728 1
1 947 . 6 1 1 A 79 79 ILE N N 79 121.382 125.874 -4.492 1
1 948 . 6 1 1 A 80 80 VAL H H 80 8.841 7.828 1.013 1
1 949 . 6 1 1 A 80 80 VAL HA H 80 4.425 3.838 0.587 1
1 957 . 6 1 1 A 80 80 VAL C C 80 175.930 175.357 0.573 1
1 958 . 6 1 1 A 80 80 VAL CA C 80 63.324 63.070 0.254 1
1 959 . 6 1 1 A 80 80 VAL CB C 80 32.783 31.167 1.616 1
1 962 . 6 1 1 A 80 80 VAL N N 80 128.970 127.033 1.937 1
1 963 . 6 1 1 A 81 81 THR H H 81 8.303 8.035 0.268 1
1 964 . 6 1 1 A 81 81 THR HA H 81 5.264 4.621 0.643 1
1 969 . 6 1 1 A 81 81 THR C C 81 173.664 174.928 -1.264 1
1 970 . 6 1 1 A 81 81 THR CA C 81 59.540 59.998 -0.458 1
1 971 . 6 1 1 A 81 81 THR CB C 81 72.197 71.668 0.529 1
1 973 . 6 1 1 A 81 81 THR N N 81 118.077 118.533 -0.456 1
1 974 . 6 1 1 A 82 82 ALA H H 82 9.586 8.593 0.993 1
1 975 . 6 1 1 A 82 82 ALA HA H 82 4.093 4.299 -0.206 1
1 979 . 6 1 1 A 82 82 ALA C C 82 178.667 177.795 0.872 1
1 980 . 6 1 1 A 82 82 ALA CA C 82 55.321 53.181 2.140 1
1 981 . 6 1 1 A 82 82 ALA CB C 82 18.094 18.119 -0.025 1
1 982 . 6 1 1 A 82 82 ALA N N 82 122.493 124.075 -1.582 1
1 983 . 6 1 1 A 83 83 ASN H H 83 7.923 8.417 -0.494 1
1 984 . 6 1 1 A 83 83 ASN HA H 83 4.808 5.070 -0.262 1
1 989 . 6 1 1 A 83 83 ASN C C 83 174.766 174.623 0.143 1
1 990 . 6 1 1 A 83 83 ASN CA C 83 53.333 54.763 -1.430 1
1 991 . 6 1 1 A 83 83 ASN CB C 83 40.335 41.564 -1.229 1
1 992 . 6 1 1 A 83 83 ASN N N 83 110.765 115.546 -4.781 1
1 994 . 6 1 1 A 84 84 ALA H H 84 7.352 7.160 0.192 1
1 995 . 6 1 1 A 84 84 ALA HA H 84 4.625 4.469 0.156 1
1 999 . 6 1 1 A 84 84 ALA C C 84 176.547 174.888 1.659 1
1 1000 . 6 1 1 A 84 84 ALA CA C 84 52.858 51.771 1.087 1
1 1001 . 6 1 1 A 84 84 ALA CB C 84 21.233 21.649 -0.416 1
1 1002 . 6 1 1 A 84 84 ALA N N 84 119.599 117.513 2.086 1
1 1003 . 6 1 1 A 85 85 THR H H 85 8.374 8.778 -0.404 1
1 1004 . 6 1 1 A 85 85 THR HA H 85 5.014 4.643 0.371 1
1 1009 . 6 1 1 A 85 85 THR C C 85 171.568 173.776 -2.208 1
1 1010 . 6 1 1 A 85 85 THR CA C 85 61.618 61.833 -0.215 1
1 1011 . 6 1 1 A 85 85 THR CB C 85 70.850 69.267 1.583 1
1 1013 . 6 1 1 A 85 85 THR N N 85 119.032 113.266 5.766 1
1 1014 . 6 1 1 A 86 86 TYR H H 86 9.006 8.889 0.117 1
1 1015 . 6 1 1 A 86 86 TYR HA H 86 4.658 4.709 -0.051 1
1 1022 . 6 1 1 A 86 86 TYR C C 86 173.773 175.592 -1.819 1
1 1023 . 6 1 1 A 86 86 TYR CA C 86 56.938 58.539 -1.601 1
1 1024 . 6 1 1 A 86 86 TYR CB C 86 39.513 39.539 -0.026 1
1 1029 . 6 1 1 A 86 86 TYR N N 86 123.494 127.460 -3.966 1
1 1030 . 6 1 1 A 87 87 PHE H H 87 9.263 8.902 0.361 1
1 1031 . 6 1 1 A 87 87 PHE HA H 87 4.127 4.643 -0.516 1
1 1039 . 6 1 1 A 87 87 PHE C C 87 176.369 174.392 1.977 1
1 1040 . 6 1 1 A 87 87 PHE CA C 87 57.238 55.586 1.652 1
1 1041 . 6 1 1 A 87 87 PHE CB C 87 37.086 38.031 -0.945 1
1 1047 . 6 1 1 A 87 87 PHE N N 87 125.384 119.949 5.435 1
1 1048 . 6 1 1 A 88 88 VAL H H 88 9.023 8.288 0.735 1
1 1049 . 6 1 1 A 88 88 VAL HA H 88 4.162 4.446 -0.284 1
1 1057 . 6 1 1 A 88 88 VAL C C 88 176.390 175.445 0.945 1
1 1058 . 6 1 1 A 88 88 VAL CA C 88 63.975 62.141 1.834 1
1 1059 . 6 1 1 A 88 88 VAL CB C 88 32.378 30.495 1.883 1
1 1062 . 6 1 1 A 88 88 VAL N N 88 127.348 124.474 2.874 1
1 1063 . 6 1 1 A 89 89 GLY H H 89 9.233 7.988 1.245 1
1 1064 . 6 1 1 A 89 89 GLY HA2 H 89 4.293 4.081 0.212 1
1 1065 . 6 1 1 A 89 89 GLY HA3 H 89 4.186 4.148 0.038 1
1 1066 . 6 1 1 A 89 89 GLY C C 89 172.378 173.818 -1.440 1
1 1067 . 6 1 1 A 89 89 GLY CA C 89 43.798 44.617 -0.819 1
1 1068 . 6 1 1 A 89 89 GLY N N 89 116.041 115.447 0.594 1
1 1069 . 6 1 1 A 90 90 GLU H H 90 8.532 8.482 0.050 1
1 1070 . 6 1 1 A 90 90 GLU HA H 90 4.794 4.477 0.317 1
1 1075 . 6 1 1 A 90 90 GLU C C 90 174.221 176.515 -2.294 1
1 1076 . 6 1 1 A 90 90 GLU CA C 90 56.393 57.085 -0.692 1
1 1077 . 6 1 1 A 90 90 GLU CB C 90 33.182 30.839 2.343 1
1 1079 . 6 1 1 A 90 90 GLU N N 90 120.905 120.298 0.607 1
1 1080 . 6 1 1 A 91 91 MET H H 91 8.450 7.724 0.726 1
1 1081 . 6 1 1 A 91 91 MET HA H 91 4.904 4.759 0.145 1
1 1089 . 6 1 1 A 91 91 MET C C 91 173.373 173.239 0.134 1
1 1090 . 6 1 1 A 91 91 MET CA C 91 52.277 53.735 -1.458 1
1 1091 . 6 1 1 A 91 91 MET CB C 91 32.789 34.945 -2.156 1
1 1094 . 6 1 1 A 91 91 MET N N 91 125.173 116.290 8.883 1
1 1095 . 6 1 1 A 92 92 PRO HA H 92 4.358 4.267 0.091 1
1 1102 . 6 1 1 A 92 92 PRO C C 92 177.589 177.295 0.294 1
1 1103 . 6 1 1 A 92 92 PRO CA C 92 63.143 63.635 -0.492 1
1 1104 . 6 1 1 A 92 92 PRO CB C 92 32.083 31.752 0.331 1
1 1107 . 6 1 1 A 93 93 GLY H H 93 8.330 8.735 -0.405 1
1 1108 . 6 1 1 A 93 93 GLY HA2 H 93 3.943 3.792 0.151 1
1 1109 . 6 1 1 A 93 93 GLY HA3 H 93 4.045 3.794 0.251 1
1 1110 . 6 1 1 A 93 93 GLY C C 93 174.730 174.163 0.567 1
1 1111 . 6 1 1 A 93 93 GLY CA C 93 45.276 45.419 -0.143 1
1 1112 . 6 1 1 A 93 93 GLY N N 93 109.420 113.071 -3.651 1
1 1113 . 6 1 1 A 94 94 GLY H H 94 8.331 8.666 -0.335 1
1 1114 . 6 1 1 A 94 94 GLY HA2 H 94 3.973 4.093 -0.120 1
1 1115 . 6 1 1 A 94 94 GLY HA3 H 94 3.973 4.094 -0.121 1
1 1116 . 6 1 1 A 94 94 GLY C C 94 174.100 173.157 0.943 1
1 1117 . 6 1 1 A 94 94 GLY CA C 94 45.333 44.198 1.135 1
1 1118 . 6 1 1 A 94 94 GLY N N 94 108.483 108.337 0.146 1
1 1119 . 6 1 1 A 95 95 THR H H 95 8.095 8.171 -0.076 1
1 1120 . 6 1 1 A 95 95 THR HA H 95 4.643 4.850 -0.207 1
1 1125 . 6 1 1 A 95 95 THR C C 95 173.155 175.340 -2.185 1
1 1126 . 6 1 1 A 95 95 THR CA C 95 59.922 59.291 0.631 1
1 1127 . 6 1 1 A 95 95 THR CB C 95 69.871 69.563 0.308 1
1 1129 . 6 1 1 A 95 95 THR N N 95 115.860 111.963 3.897 1
1 1130 . 6 1 1 A 96 96 PRO HA H 96 4.400 4.461 -0.061 1
1 1137 . 6 1 1 A 96 96 PRO C C 96 177.565 177.891 -0.326 1
1 1138 . 6 1 1 A 96 96 PRO CA C 96 64.047 63.608 0.439 1
1 1139 . 6 1 1 A 96 96 PRO CB C 96 31.816 32.181 -0.365 1
1 1142 . 6 1 1 A 97 97 GLY H H 97 8.572 8.238 0.334 1
1 1143 . 6 1 1 A 97 97 GLY HA2 H 97 4.007 3.802 0.205 1
1 1144 . 6 1 1 A 97 97 GLY HA3 H 97 4.007 3.803 0.204 1
1 1145 . 6 1 1 A 97 97 GLY C C 97 174.609 174.662 -0.053 1
1 1146 . 6 1 1 A 97 97 GLY CA C 97 45.276 47.225 -1.949 1
1 1147 . 6 1 1 A 97 97 GLY N N 97 110.233 110.315 -0.082 1
1 1148 . 6 1 1 A 98 98 GLY H H 98 8.119 8.052 0.067 1
1 1149 . 6 1 1 A 98 98 GLY HA2 H 98 4.086 4.187 -0.101 1
1 1150 . 6 1 1 A 98 98 GLY HA3 H 98 4.200 4.187 0.013 1
1 1151 . 6 1 1 A 98 98 GLY CA C 98 44.876 46.143 -1.267 1
1 1152 . 6 1 1 A 98 98 GLY N N 98 108.845 111.498 -2.653 1
1 1153 . 6 1 1 A 99 99 PRO HA H 99 4.494 4.403 0.091 1
1 1160 . 6 1 1 A 99 99 PRO C C 99 177.468 176.138 1.330 1
1 1161 . 6 1 1 A 99 99 PRO CA C 99 63.500 64.346 -0.846 1
1 1162 . 6 1 1 A 99 99 PRO CB C 99 32.013 31.761 0.252 1
1 1165 . 6 1 1 A 100 100 SER H H 100 8.472 7.789 0.683 1
1 1166 . 6 1 1 A 100 100 SER HA H 100 4.513 4.834 -0.321 1
1 1169 . 6 1 1 A 100 100 SER C C 100 175.408 173.357 2.051 1
1 1170 . 6 1 1 A 100 100 SER CA C 100 58.557 56.882 1.675 1
1 1171 . 6 1 1 A 100 100 SER CB C 100 63.918 64.490 -0.572 1
1 1172 . 6 1 1 A 100 100 SER N N 100 116.038 112.995 3.043 1
1 1173 . 6 1 1 A 101 101 GLY H H 101 8.427 8.380 0.047 1
1 1174 . 6 1 1 A 101 101 GLY HA2 H 101 4.064 4.148 -0.084 1
1 1175 . 6 1 1 A 101 101 GLY HA3 H 101 4.064 4.151 -0.087 1
1 1176 . 6 1 1 A 101 101 GLY C C 101 174.730 173.053 1.677 1
1 1177 . 6 1 1 A 101 101 GLY CA C 101 45.575 45.601 -0.026 1
1 1178 . 6 1 1 A 101 101 GLY N N 101 110.558 113.204 -2.646 1
1 1179 . 6 1 1 A 102 102 GLN H H 102 8.416 8.742 -0.326 1
1 1180 . 6 1 1 A 102 102 GLN HA H 102 4.383 4.578 -0.195 1
1 1187 . 6 1 1 A 102 102 GLN C C 102 177.346 175.392 1.954 1
1 1188 . 6 1 1 A 102 102 GLN CA C 102 57.080 54.943 2.137 1
1 1189 . 6 1 1 A 102 102 GLN CB C 102 29.235 27.270 1.965 1
1 1191 . 6 1 1 A 102 102 GLN N N 102 120.112 123.214 -3.102 1
1 1193 . 6 1 1 A 103 103 GLY H H 103 8.713 8.704 0.009 1
1 1194 . 6 1 1 A 103 103 GLY HA2 H 103 4.193 4.207 -0.014 1
1 1195 . 6 1 1 A 103 103 GLY HA3 H 103 4.078 4.224 -0.146 1
1 1196 . 6 1 1 A 103 103 GLY C C 103 175.602 174.460 1.142 1
1 1197 . 6 1 1 A 103 103 GLY CA C 103 46.120 46.085 0.035 1
1 1198 . 6 1 1 A 103 103 GLY N N 103 109.817 111.403 -1.586 1
1 1199 . 6 1 1 A 104 104 ALA H H 104 8.366 7.776 0.590 1
1 1200 . 6 1 1 A 104 104 ALA HA H 104 4.449 4.664 -0.215 1
1 1204 . 6 1 1 A 104 104 ALA C C 104 179.188 178.283 0.905 1
1 1205 . 6 1 1 A 104 104 ALA CA C 104 54.230 53.090 1.140 1
1 1206 . 6 1 1 A 104 104 ALA CB C 104 19.080 20.515 -1.435 1
1 1207 . 6 1 1 A 104 104 ALA N N 104 124.808 121.043 3.765 1
1 1208 . 6 1 1 A 105 105 GLU H H 105 8.576 8.804 -0.228 1
1 1209 . 6 1 1 A 105 105 GLU HA H 105 4.161 4.161 0.000 1
1 1214 . 6 1 1 A 105 105 GLU C C 105 179.200 179.350 -0.150 1
1 1215 . 6 1 1 A 105 105 GLU CA C 105 59.173 59.040 0.133 1
1 1216 . 6 1 1 A 105 105 GLU CB C 105 29.194 29.913 -0.719 1
1 1218 . 6 1 1 A 105 105 GLU N N 105 119.238 117.948 1.290 1
1 1219 . 6 1 1 A 106 106 ALA H H 106 8.381 8.344 0.037 1
1 1220 . 6 1 1 A 106 106 ALA HA H 106 4.283 4.134 0.149 1
1 1224 . 6 1 1 A 106 106 ALA C C 106 180.048 179.942 0.106 1
1 1225 . 6 1 1 A 106 106 ALA CA C 106 54.687 55.579 -0.892 1
1 1226 . 6 1 1 A 106 106 ALA CB C 106 18.341 18.787 -0.446 1
1 1227 . 6 1 1 A 106 106 ALA N N 106 123.327 123.558 -0.231 1
1 1228 . 6 1 1 A 107 107 ALA H H 107 8.123 8.282 -0.159 1
1 1229 . 6 1 1 A 107 107 ALA HA H 107 4.554 4.253 0.301 1
1 1233 . 6 1 1 A 107 107 ALA C C 107 179.757 180.357 -0.600 1
1 1234 . 6 1 1 A 107 107 ALA CA C 107 55.355 55.530 -0.175 1
1 1235 . 6 1 1 A 107 107 ALA CB C 107 18.939 18.460 0.479 1
1 1236 . 6 1 1 A 107 107 ALA N N 107 120.740 120.311 0.429 1
1 1237 . 6 1 1 A 108 108 ARG H H 108 8.403 8.258 0.145 1
1 1238 . 6 1 1 A 108 108 ARG HA H 108 4.254 4.117 0.137 1
1 1245 . 6 1 1 A 108 108 ARG C C 108 179.111 179.613 -0.502 1
1 1246 . 6 1 1 A 108 108 ARG CA C 108 59.015 59.206 -0.191 1
1 1247 . 6 1 1 A 108 108 ARG CB C 108 29.752 30.215 -0.463 1
1 1250 . 6 1 1 A 108 108 ARG N N 108 119.531 117.936 1.595 1
1 1251 . 6 1 1 A 109 109 GLY H H 109 8.182 8.821 -0.639 1
1 1252 . 6 1 1 A 109 109 GLY HA2 H 109 3.822 3.720 0.102 1
1 1253 . 6 1 1 A 109 109 GLY HA3 H 109 3.822 3.743 0.079 1
1 1254 . 6 1 1 A 109 109 GLY C C 109 177.020 176.745 0.275 1
1 1255 . 6 1 1 A 109 109 GLY CA C 109 46.718 47.374 -0.656 1
1 1256 . 6 1 1 A 109 109 GLY N N 109 107.331 107.848 -0.517 1
1 1257 . 6 1 1 A 110 110 TRP H H 110 7.925 7.896 0.029 1
1 1258 . 6 1 1 A 110 110 TRP HA H 110 3.963 4.615 -0.652 1
1 1267 . 6 1 1 A 110 110 TRP C C 110 176.691 178.080 -1.389 1
1 1268 . 6 1 1 A 110 110 TRP CA C 110 62.041 60.670 1.371 1
1 1269 . 6 1 1 A 110 110 TRP CB C 110 28.989 28.427 0.562 1
1 1275 . 6 1 1 A 110 110 TRP N N 110 122.304 121.785 0.519 1
1 1277 . 6 1 1 A 111 111 GLU H H 111 7.946 7.766 0.180 1
1 1278 . 6 1 1 A 111 111 GLU HA H 111 2.594 2.817 -0.223 1
1 1283 . 6 1 1 A 111 111 GLU C C 111 177.976 179.185 -1.209 1
1 1284 . 6 1 1 A 111 111 GLU CA C 111 60.193 58.876 1.317 1
1 1285 . 6 1 1 A 111 111 GLU CB C 111 29.277 29.367 -0.090 1
1 1287 . 6 1 1 A 111 111 GLU N N 111 121.755 119.106 2.649 1
1 1288 . 6 1 1 A 112 112 THR H H 112 7.993 7.691 0.302 1
1 1289 . 6 1 1 A 112 112 THR HA H 112 3.722 3.780 -0.058 1
1 1294 . 6 1 1 A 112 112 THR C C 112 176.038 175.882 0.156 1
1 1295 . 6 1 1 A 112 112 THR CA C 112 66.104 66.485 -0.381 1
1 1296 . 6 1 1 A 112 112 THR CB C 112 68.885 68.677 0.208 1
1 1298 . 6 1 1 A 112 112 THR N N 112 112.247 116.067 -3.820 1
1 1299 . 6 1 1 A 113 113 ALA H H 113 7.742 8.108 -0.366 1
1 1300 . 6 1 1 A 113 113 ALA HA H 113 4.029 3.962 0.067 1
1 1304 . 6 1 1 A 113 113 ALA C C 113 180.545 179.848 0.697 1
1 1305 . 6 1 1 A 113 113 ALA CA C 113 55.127 55.321 -0.194 1
1 1306 . 6 1 1 A 113 113 ALA CB C 113 18.854 18.414 0.440 1
1 1307 . 6 1 1 A 113 113 ALA N N 113 123.134 122.602 0.532 1
1 1308 . 6 1 1 A 114 114 ILE H H 114 8.472 8.562 -0.090 1
1 1309 . 6 1 1 A 114 114 ILE HA H 114 3.613 3.759 -0.146 1
1 1319 . 6 1 1 A 114 114 ILE C C 114 176.947 177.928 -0.981 1
1 1320 . 6 1 1 A 114 114 ILE CA C 114 66.016 65.261 0.755 1
1 1321 . 6 1 1 A 114 114 ILE CB C 114 38.335 37.858 0.477 1
1 1325 . 6 1 1 A 114 114 ILE N N 114 118.276 117.890 0.386 1
1 1326 . 6 1 1 A 115 115 ARG H H 115 8.181 8.065 0.116 1
1 1327 . 6 1 1 A 115 115 ARG HA H 115 3.835 3.908 -0.073 1
1 1334 . 6 1 1 A 115 115 ARG C C 115 179.588 179.081 0.507 1
1 1335 . 6 1 1 A 115 115 ARG CA C 115 61.072 60.191 0.881 1
1 1336 . 6 1 1 A 115 115 ARG CB C 115 29.975 30.014 -0.039 1
1 1339 . 6 1 1 A 115 115 ARG N N 115 117.921 119.205 -1.284 1
1 1340 . 6 1 1 A 116 116 GLN H H 116 8.395 8.366 0.029 1
1 1341 . 6 1 1 A 116 116 GLN HA H 116 4.030 4.061 -0.031 1
1 1348 . 6 1 1 A 116 116 GLN C C 116 178.716 178.928 -0.212 1
1 1349 . 6 1 1 A 116 116 GLN CA C 116 58.790 58.858 -0.068 1
1 1350 . 6 1 1 A 116 116 GLN CB C 116 28.248 28.443 -0.195 1
1 1352 . 6 1 1 A 116 116 GLN N N 116 116.842 118.779 -1.937 1
1 1354 . 6 1 1 A 117 117 ALA H H 117 7.902 8.241 -0.339 1
1 1355 . 6 1 1 A 117 117 ALA HA H 117 4.143 4.145 -0.002 1
1 1359 . 6 1 1 A 117 117 ALA C C 117 179.685 180.130 -0.445 1
1 1360 . 6 1 1 A 117 117 ALA CA C 117 54.476 54.956 -0.480 1
1 1361 . 6 1 1 A 117 117 ALA CB C 117 18.300 18.383 -0.083 1
1 1362 . 6 1 1 A 117 117 ALA N N 117 122.828 123.006 -0.178 1
1 1363 . 6 1 1 A 118 118 LEU H H 118 7.904 8.224 -0.320 1
1 1364 . 6 1 1 A 118 118 LEU HA H 118 4.119 4.113 0.006 1
1 1374 . 6 1 1 A 118 118 LEU C C 118 178.437 178.573 -0.136 1
1 1375 . 6 1 1 A 118 118 LEU CA C 118 56.781 57.060 -0.279 1
1 1376 . 6 1 1 A 118 118 LEU CB C 118 42.371 41.919 0.452 1
1 1380 . 6 1 1 A 118 118 LEU N N 118 117.632 120.266 -2.634 1
1 1381 . 6 1 1 A 119 119 MET H H 119 7.673 8.155 -0.482 1
1 1382 . 6 1 1 A 119 119 MET HA H 119 4.442 4.220 0.222 1
1 1390 . 6 1 1 A 119 119 MET C C 119 176.680 177.941 -1.261 1
1 1391 . 6 1 1 A 119 119 MET CA C 119 56.432 57.945 -1.513 1
1 1392 . 6 1 1 A 119 119 MET CB C 119 32.769 31.670 1.099 1
1 1395 . 6 1 1 A 119 119 MET N N 119 117.286 117.658 -0.372 1
1 1396 . 6 1 1 A 120 120 SER H H 120 7.878 7.316 0.562 1
1 1397 . 6 1 1 A 120 120 SER HA H 120 4.500 4.336 0.164 1
1 1400 . 6 1 1 A 120 120 SER C C 120 174.742 175.372 -0.630 1
1 1401 . 6 1 1 A 120 120 SER CA C 120 58.962 60.381 -1.419 1
1 1402 . 6 1 1 A 120 120 SER CB C 120 63.853 62.821 1.032 1
1 1403 . 6 1 1 A 120 120 SER N N 120 115.064 111.660 3.404 1
1 1404 . 6 1 1 A 121 121 GLY H H 121 8.059 7.841 0.218 1
1 1405 . 6 1 1 A 121 121 GLY HA2 H 121 4.231 4.014 0.217 1
1 1406 . 6 1 1 A 121 121 GLY HA3 H 121 4.112 4.014 0.098 1
1 1407 . 6 1 1 A 121 121 GLY C C 121 172.065 173.185 -1.120 1
1 1408 . 6 1 1 A 121 121 GLY CA C 121 45.030 45.134 -0.104 1
1 1409 . 6 1 1 A 121 121 GLY N N 121 110.271 110.225 0.046 1
1 1410 . 6 1 1 A 122 122 PRO HA H 122 4.496 4.260 0.236 1
1 1417 . 6 1 1 A 122 122 PRO CA C 122 63.399 63.493 -0.094 1
1 1418 . 6 1 1 A 122 122 PRO CB C 122 32.186 32.170 0.016 1
1 1 . 7 1 1 A 6 6 SER H H 6 8.337 8.619 -0.282 1
1 2 . 7 1 1 A 6 6 SER HA H 6 4.597 4.695 -0.098 1
1 5 . 7 1 1 A 6 6 SER C C 6 174.637 174.278 0.359 1
1 6 . 7 1 1 A 6 6 SER CA C 6 58.469 58.087 0.382 1
1 7 . 7 1 1 A 6 6 SER CB C 6 64.221 63.396 0.825 1
1 8 . 7 1 1 A 6 6 SER N N 6 117.887 114.618 3.269 1
1 9 . 7 1 1 A 7 7 GLY H H 7 8.280 7.949 0.331 1
1 10 . 7 1 1 A 7 7 GLY HA2 H 7 4.063 3.953 0.110 1
1 11 . 7 1 1 A 7 7 GLY HA3 H 7 4.063 3.954 0.109 1
1 12 . 7 1 1 A 7 7 GLY C C 7 173.724 174.507 -0.783 1
1 13 . 7 1 1 A 7 7 GLY CA C 7 44.941 45.493 -0.552 1
1 14 . 7 1 1 A 7 7 GLY N N 7 110.151 109.203 0.948 1
1 15 . 7 1 1 A 8 8 THR H H 8 8.212 8.009 0.203 1
1 16 . 7 1 1 A 8 8 THR HA H 8 4.173 4.690 -0.517 1
1 21 . 7 1 1 A 8 8 THR C C 8 174.723 174.011 0.712 1
1 22 . 7 1 1 A 8 8 THR CA C 8 63.622 62.738 0.884 1
1 23 . 7 1 1 A 8 8 THR CB C 8 69.460 69.569 -0.109 1
1 25 . 7 1 1 A 8 8 THR N N 8 116.817 116.531 0.286 1
1 26 . 7 1 1 A 9 9 LEU H H 9 9.374 9.450 -0.076 1
1 27 . 7 1 1 A 9 9 LEU HA H 9 4.302 4.356 -0.054 1
1 37 . 7 1 1 A 9 9 LEU C C 9 177.468 176.738 0.730 1
1 38 . 7 1 1 A 9 9 LEU CA C 9 55.936 56.039 -0.103 1
1 39 . 7 1 1 A 9 9 LEU CB C 9 42.843 42.499 0.344 1
1 43 . 7 1 1 A 9 9 LEU N N 9 127.798 127.587 0.211 1
1 44 . 7 1 1 A 10 10 ARG H H 10 7.512 7.545 -0.033 1
1 45 . 7 1 1 A 10 10 ARG HA H 10 4.199 4.720 -0.521 1
1 52 . 7 1 1 A 10 10 ARG C C 10 172.501 174.014 -1.513 1
1 53 . 7 1 1 A 10 10 ARG CA C 10 56.165 54.551 1.614 1
1 54 . 7 1 1 A 10 10 ARG CB C 10 32.442 33.537 -1.095 1
1 57 . 7 1 1 A 10 10 ARG N N 10 117.979 117.259 0.720 1
1 58 . 7 1 1 A 11 11 GLU H H 11 8.434 8.804 -0.370 1
1 59 . 7 1 1 A 11 11 GLU HA H 11 5.993 5.573 0.420 1
1 64 . 7 1 1 A 11 11 GLU C C 11 174.800 174.628 0.172 1
1 65 . 7 1 1 A 11 11 GLU CA C 11 54.570 55.089 -0.519 1
1 66 . 7 1 1 A 11 11 GLU CB C 11 34.245 33.106 1.139 1
1 68 . 7 1 1 A 11 11 GLU N N 11 120.782 121.870 -1.088 1
1 69 . 7 1 1 A 12 12 GLY H H 12 8.131 7.676 0.455 1
1 70 . 7 1 1 A 12 12 GLY HA2 H 12 4.714 3.663 1.051 1
1 71 . 7 1 1 A 12 12 GLY HA3 H 12 3.763 4.167 -0.404 1
1 72 . 7 1 1 A 12 12 GLY C C 12 171.060 171.903 -0.843 1
1 73 . 7 1 1 A 12 12 GLY CA C 12 45.241 45.227 0.014 1
1 74 . 7 1 1 A 12 12 GLY N N 12 107.457 106.366 1.091 1
1 75 . 7 1 1 A 13 13 TRP H H 13 8.783 8.607 0.176 1
1 76 . 7 1 1 A 13 13 TRP HA H 13 5.152 4.883 0.269 1
1 85 . 7 1 1 A 13 13 TRP C C 13 177.528 176.591 0.937 1
1 86 . 7 1 1 A 13 13 TRP CA C 13 57.783 58.591 -0.808 1
1 87 . 7 1 1 A 13 13 TRP CB C 13 30.222 30.243 -0.021 1
1 93 . 7 1 1 A 13 13 TRP N N 13 120.792 121.472 -0.680 1
1 95 . 7 1 1 A 14 14 VAL H H 14 9.179 9.049 0.130 1
1 96 . 7 1 1 A 14 14 VAL HA H 14 4.072 4.507 -0.435 1
1 104 . 7 1 1 A 14 14 VAL C C 14 174.981 173.516 1.465 1
1 105 . 7 1 1 A 14 14 VAL CA C 14 61.741 60.443 1.298 1
1 106 . 7 1 1 A 14 14 VAL CB C 14 35.143 35.374 -0.231 1
1 109 . 7 1 1 A 14 14 VAL N N 14 125.476 122.767 2.709 1
1 110 . 7 1 1 A 15 15 VAL H H 15 8.403 8.887 -0.484 1
1 111 . 7 1 1 A 15 15 VAL HA H 15 5.532 5.323 0.209 1
1 119 . 7 1 1 A 15 15 VAL C C 15 175.078 174.648 0.430 1
1 120 . 7 1 1 A 15 15 VAL CA C 15 59.489 59.726 -0.237 1
1 121 . 7 1 1 A 15 15 VAL CB C 15 34.210 34.322 -0.112 1
1 124 . 7 1 1 A 15 15 VAL N N 15 126.189 127.959 -1.770 1
1 125 . 7 1 1 A 16 16 HIS H H 16 9.122 8.900 0.222 1
1 126 . 7 1 1 A 16 16 HIS HA H 16 5.823 5.840 -0.017 1
1 131 . 7 1 1 A 16 16 HIS C C 16 172.998 172.451 0.547 1
1 132 . 7 1 1 A 16 16 HIS CA C 16 56.253 53.682 2.571 1
1 133 . 7 1 1 A 16 16 HIS CB C 16 34.273 33.425 0.848 1
1 136 . 7 1 1 A 16 16 HIS N N 16 121.152 121.005 0.147 1
1 137 . 7 1 1 A 17 17 TYR H H 17 8.465 8.563 -0.098 1
1 138 . 7 1 1 A 17 17 TYR HA H 17 5.096 4.698 0.398 1
1 145 . 7 1 1 A 17 17 TYR C C 17 173.640 172.669 0.971 1
1 146 . 7 1 1 A 17 17 TYR CA C 17 56.903 56.099 0.804 1
1 147 . 7 1 1 A 17 17 TYR CB C 17 40.103 40.472 -0.369 1
1 152 . 7 1 1 A 17 17 TYR N N 17 115.558 116.456 -0.898 1
1 153 . 7 1 1 A 18 18 SER H H 18 9.122 8.663 0.459 1
1 154 . 7 1 1 A 18 18 SER HA H 18 6.144 5.404 0.740 1
1 157 . 7 1 1 A 18 18 SER C C 18 173.204 175.131 -1.927 1
1 158 . 7 1 1 A 18 18 SER CA C 18 56.640 56.462 0.178 1
1 159 . 7 1 1 A 18 18 SER CB C 18 68.788 66.351 2.437 1
1 160 . 7 1 1 A 18 18 SER N N 18 118.846 115.446 3.400 1
1 161 . 7 1 1 A 19 19 ASN H H 19 9.053 8.810 0.243 1
1 162 . 7 1 1 A 19 19 ASN HA H 19 4.473 4.900 -0.427 1
1 167 . 7 1 1 A 19 19 ASN C C 19 175.396 174.855 0.541 1
1 168 . 7 1 1 A 19 19 ASN CA C 19 55.373 52.257 3.116 1
1 169 . 7 1 1 A 19 19 ASN CB C 19 36.900 38.073 -1.173 1
1 170 . 7 1 1 A 19 19 ASN N N 19 113.712 117.752 -4.040 1
1 172 . 7 1 1 A 20 20 LYS H H 20 7.677 7.791 -0.114 1
1 173 . 7 1 1 A 20 20 LYS HA H 20 4.413 4.430 -0.017 1
1 182 . 7 1 1 A 20 20 LYS C C 20 176.078 177.476 -1.398 1
1 183 . 7 1 1 A 20 20 LYS CA C 20 55.679 56.838 -1.159 1
1 184 . 7 1 1 A 20 20 LYS CB C 20 33.023 35.307 -2.284 1
1 188 . 7 1 1 A 20 20 LYS N N 20 117.213 118.089 -0.876 1
1 189 . 7 1 1 A 21 21 ASP H H 21 7.395 7.847 -0.452 1
1 190 . 7 1 1 A 21 21 ASP HA H 21 4.808 4.746 0.062 1
1 193 . 7 1 1 A 21 21 ASP C C 21 176.413 175.958 0.455 1
1 194 . 7 1 1 A 21 21 ASP CA C 21 53.983 53.833 0.150 1
1 195 . 7 1 1 A 21 21 ASP CB C 21 41.199 42.510 -1.311 1
1 196 . 7 1 1 A 21 21 ASP N N 21 119.879 116.023 3.856 1
1 197 . 7 1 1 A 22 22 THR H H 22 8.593 8.069 0.524 1
1 198 . 7 1 1 A 22 22 THR HA H 22 4.352 4.137 0.215 1
1 203 . 7 1 1 A 22 22 THR C C 22 172.913 174.725 -1.812 1
1 204 . 7 1 1 A 22 22 THR CA C 22 62.691 62.921 -0.230 1
1 205 . 7 1 1 A 22 22 THR CB C 22 68.332 66.445 1.887 1
1 207 . 7 1 1 A 22 22 THR N N 22 116.299 112.774 3.525 1
1 208 . 7 1 1 A 23 23 LEU H H 23 7.645 7.837 -0.192 1
1 209 . 7 1 1 A 23 23 LEU HA H 23 4.318 4.320 -0.002 1
1 219 . 7 1 1 A 23 23 LEU C C 23 176.692 176.386 0.306 1
1 220 . 7 1 1 A 23 23 LEU CA C 23 54.617 54.068 0.549 1
1 221 . 7 1 1 A 23 23 LEU CB C 23 41.939 41.323 0.616 1
1 225 . 7 1 1 A 23 23 LEU N N 23 123.606 121.041 2.565 1
1 226 . 7 1 1 A 24 24 ARG H H 24 8.563 7.649 0.914 1
1 227 . 7 1 1 A 24 24 ARG HA H 24 4.373 4.591 -0.218 1
1 235 . 7 1 1 A 24 24 ARG C C 24 176.584 175.845 0.739 1
1 236 . 7 1 1 A 24 24 ARG CA C 24 57.854 56.238 1.616 1
1 237 . 7 1 1 A 24 24 ARG CB C 24 31.126 30.736 0.390 1
1 240 . 7 1 1 A 24 24 ARG N N 24 127.152 125.733 1.419 1
1 242 . 7 1 1 A 25 25 LYS H H 25 8.633 8.919 -0.286 1
1 243 . 7 1 1 A 25 25 LYS HA H 25 4.513 4.758 -0.245 1
1 251 . 7 1 1 A 25 25 LYS C C 25 173.567 174.709 -1.142 1
1 252 . 7 1 1 A 25 25 LYS CA C 25 54.792 55.119 -0.327 1
1 253 . 7 1 1 A 25 25 LYS CB C 25 37.416 33.959 3.457 1
1 257 . 7 1 1 A 25 25 LYS N N 25 122.682 125.232 -2.550 1
1 258 . 7 1 1 A 26 26 ARG H H 26 8.303 8.830 -0.527 1
1 259 . 7 1 1 A 26 26 ARG HA H 26 5.153 5.029 0.124 1
1 266 . 7 1 1 A 26 26 ARG C C 26 174.554 175.144 -0.590 1
1 267 . 7 1 1 A 26 26 ARG CA C 26 55.083 54.860 0.223 1
1 268 . 7 1 1 A 26 26 ARG CB C 26 32.789 31.543 1.246 1
1 271 . 7 1 1 A 26 26 ARG N N 26 121.819 124.800 -2.981 1
1 272 . 7 1 1 A 27 27 HIS H H 27 8.793 8.904 -0.111 1
1 273 . 7 1 1 A 27 27 HIS HA H 27 5.155 5.410 -0.255 1
1 278 . 7 1 1 A 27 27 HIS CA C 27 56.904 54.843 2.061 1
1 279 . 7 1 1 A 27 27 HIS CB C 27 34.683 31.357 3.326 1
1 282 . 7 1 1 A 27 27 HIS N N 27 122.102 120.642 1.460 1
1 283 . 7 1 1 A 28 28 TYR H H 28 9.273 8.189 1.084 1
1 284 . 7 1 1 A 28 28 TYR HA H 28 4.332 4.260 0.072 1
1 291 . 7 1 1 A 28 28 TYR C C 28 174.730 174.726 0.004 1
1 292 . 7 1 1 A 28 28 TYR CA C 28 58.680 57.117 1.563 1
1 293 . 7 1 1 A 28 28 TYR CB C 28 38.673 37.828 0.845 1
1 298 . 7 1 1 A 28 28 TYR N N 28 125.605 121.094 4.511 1
1 299 . 7 1 1 A 29 29 TRP H H 29 9.273 8.785 0.488 1
1 300 . 7 1 1 A 29 29 TRP HA H 29 5.543 4.792 0.751 1
1 309 . 7 1 1 A 29 29 TRP C C 29 176.172 176.670 -0.498 1
1 310 . 7 1 1 A 29 29 TRP CA C 29 56.658 58.004 -1.346 1
1 311 . 7 1 1 A 29 29 TRP CB C 29 32.154 30.001 2.153 1
1 317 . 7 1 1 A 29 29 TRP N N 29 131.340 128.347 2.993 1
1 318 . 7 1 1 A 30 30 ARG H H 30 9.164 9.275 -0.111 1
1 319 . 7 1 1 A 30 30 ARG HA H 30 5.302 5.150 0.152 1
1 327 . 7 1 1 A 30 30 ARG C C 30 174.774 174.362 0.412 1
1 328 . 7 1 1 A 30 30 ARG CA C 30 56.271 55.096 1.175 1
1 329 . 7 1 1 A 30 30 ARG CB C 30 34.203 32.650 1.553 1
1 332 . 7 1 1 A 30 30 ARG N N 30 116.040 122.981 -6.941 1
1 334 . 7 1 1 A 31 31 LEU H H 31 9.273 9.332 -0.059 1
1 335 . 7 1 1 A 31 31 LEU HA H 31 5.324 5.373 -0.049 1
1 345 . 7 1 1 A 31 31 LEU C C 31 174.488 174.602 -0.114 1
1 346 . 7 1 1 A 31 31 LEU CA C 31 53.807 53.481 0.326 1
1 347 . 7 1 1 A 31 31 LEU CB C 31 46.667 45.921 0.746 1
1 351 . 7 1 1 A 31 31 LEU N N 31 127.075 127.340 -0.265 1
1 352 . 7 1 1 A 32 32 ASP H H 32 8.854 8.827 0.027 1
1 353 . 7 1 1 A 32 32 ASP HA H 32 4.902 5.107 -0.205 1
1 356 . 7 1 1 A 32 32 ASP C C 32 173.474 176.494 -3.020 1
1 357 . 7 1 1 A 32 32 ASP CA C 32 53.104 52.290 0.814 1
1 358 . 7 1 1 A 32 32 ASP CB C 32 42.931 44.513 -1.582 1
1 359 . 7 1 1 A 32 32 ASP N N 32 129.349 125.497 3.852 1
1 360 . 7 1 1 A 33 33 CYS H H 33 8.153 8.785 -0.632 1
1 361 . 7 1 1 A 33 33 CYS HA H 33 4.323 4.555 -0.232 1
1 364 . 7 1 1 A 33 33 CYS C C 33 174.476 175.651 -1.175 1
1 365 . 7 1 1 A 33 33 CYS CA C 33 59.853 59.670 0.183 1
1 366 . 7 1 1 A 33 33 CYS CB C 33 27.508 27.975 -0.467 1
1 367 . 7 1 1 A 33 33 CYS N N 33 108.439 119.606 -11.167 1
1 368 . 7 1 1 A 34 34 LYS H H 34 9.144 7.757 1.387 1
1 369 . 7 1 1 A 34 34 LYS HA H 34 4.616 4.430 0.186 1
1 378 . 7 1 1 A 34 34 LYS C C 34 177.601 176.229 1.372 1
1 379 . 7 1 1 A 34 34 LYS CA C 34 57.185 56.776 0.409 1
1 380 . 7 1 1 A 34 34 LYS CB C 34 35.623 35.237 0.386 1
1 384 . 7 1 1 A 34 34 LYS N N 34 119.884 119.744 0.140 1
1 385 . 7 1 1 A 35 35 CYS H H 35 9.102 7.637 1.465 1
1 386 . 7 1 1 A 35 35 CYS HA H 35 4.935 4.747 0.188 1
1 389 . 7 1 1 A 35 35 CYS C C 35 172.283 172.450 -0.167 1
1 390 . 7 1 1 A 35 35 CYS CA C 35 57.748 58.103 -0.355 1
1 391 . 7 1 1 A 35 35 CYS CB C 35 31.537 32.359 -0.822 1
1 392 . 7 1 1 A 35 35 CYS N N 35 120.317 114.574 5.743 1
1 393 . 7 1 1 A 36 36 ILE H H 36 8.213 8.903 -0.690 1
1 394 . 7 1 1 A 36 36 ILE HA H 36 4.617 4.799 -0.182 1
1 404 . 7 1 1 A 36 36 ILE C C 36 175.312 176.181 -0.869 1
1 405 . 7 1 1 A 36 36 ILE CA C 36 60.967 60.218 0.749 1
1 406 . 7 1 1 A 36 36 ILE CB C 36 39.718 38.505 1.213 1
1 410 . 7 1 1 A 36 36 ILE N N 36 121.905 121.765 0.140 1
1 411 . 7 1 1 A 37 37 THR H H 37 9.076 8.494 0.582 1
1 412 . 7 1 1 A 37 37 THR HA H 37 4.364 4.357 0.007 1
1 417 . 7 1 1 A 37 37 THR CA C 37 61.834 61.566 0.268 1
1 418 . 7 1 1 A 37 37 THR CB C 37 69.237 70.063 -0.826 1
1 420 . 7 1 1 A 37 37 THR N N 37 122.500 120.560 1.940 1
1 421 . 7 1 1 A 38 38 LEU H H 38 8.263 8.624 -0.361 1
1 422 . 7 1 1 A 38 38 LEU HA H 38 4.445 4.841 -0.396 1
1 432 . 7 1 1 A 38 38 LEU CA C 38 55.611 53.615 1.996 1
1 433 . 7 1 1 A 38 38 LEU CB C 38 42.702 44.563 -1.861 1
1 437 . 7 1 1 A 38 38 LEU N N 38 126.987 121.913 5.074 1
1 438 . 7 1 1 A 39 39 PHE H H 39 9.520 9.292 0.228 1
1 439 . 7 1 1 A 39 39 PHE HA H 39 4.998 5.003 -0.005 1
1 447 . 7 1 1 A 39 39 PHE CA C 39 57.331 56.896 0.435 1
1 448 . 7 1 1 A 39 39 PHE CB C 39 42.453 38.538 3.915 1
1 454 . 7 1 1 A 39 39 PHE N N 39 120.545 124.385 -3.840 1
1 455 . 7 1 1 A 40 40 GLN H H 40 9.878 8.749 1.129 1
1 456 . 7 1 1 A 40 40 GLN HA H 40 4.376 4.133 0.243 1
1 463 . 7 1 1 A 40 40 GLN CA C 40 59.513 59.433 0.080 1
1 464 . 7 1 1 A 40 40 GLN CB C 40 29.317 28.860 0.457 1
1 467 . 7 1 1 A 41 41 ASN H H 41 7.732 7.968 -0.236 1
1 468 . 7 1 1 A 41 41 ASN HA H 41 4.812 5.297 -0.485 1
1 473 . 7 1 1 A 41 41 ASN CA C 41 52.618 52.069 0.549 1
1 474 . 7 1 1 A 41 41 ASN CB C 41 39.362 41.963 -2.601 1
1 475 . 7 1 1 A 41 41 ASN N N 41 107.613 116.024 -8.411 1
1 477 . 7 1 1 A 42 42 ASN HA H 42 3.476 4.344 -0.868 1
1 482 . 7 1 1 A 42 42 ASN C C 42 173.607 175.720 -2.113 1
1 483 . 7 1 1 A 42 42 ASN CA C 42 54.888 54.593 0.295 1
1 484 . 7 1 1 A 42 42 ASN CB C 42 35.613 37.971 -2.358 1
1 486 . 7 1 1 A 43 43 THR H H 43 8.394 7.768 0.626 1
1 487 . 7 1 1 A 43 43 THR HA H 43 4.403 4.674 -0.271 1
1 492 . 7 1 1 A 43 43 THR C C 43 174.464 173.366 1.098 1
1 493 . 7 1 1 A 43 43 THR CA C 43 61.978 60.356 1.622 1
1 494 . 7 1 1 A 43 43 THR CB C 43 70.036 68.777 1.259 1
1 496 . 7 1 1 A 43 43 THR N N 43 111.795 107.048 4.747 1
1 497 . 7 1 1 A 44 44 THR H H 44 8.058 7.628 0.430 1
1 498 . 7 1 1 A 44 44 THR HA H 44 4.464 4.888 -0.424 1
1 503 . 7 1 1 A 44 44 THR CA C 44 61.599 59.897 1.702 1
1 504 . 7 1 1 A 44 44 THR CB C 44 69.137 71.485 -2.348 1
1 506 . 7 1 1 A 44 44 THR N N 44 116.514 116.582 -0.068 1
1 507 . 7 1 1 A 45 45 ASN H H 45 6.653 8.511 -1.858 1
1 508 . 7 1 1 A 45 45 ASN HA H 45 4.945 4.689 0.256 1
1 513 . 7 1 1 A 45 45 ASN CA C 45 53.227 52.504 0.723 1
1 514 . 7 1 1 A 45 45 ASN CB C 45 38.483 39.459 -0.976 1
1 516 . 7 1 1 A 46 46 ARG H H 46 8.213 8.441 -0.228 1
1 517 . 7 1 1 A 46 46 ARG HA H 46 4.583 4.318 0.265 1
1 524 . 7 1 1 A 46 46 ARG CA C 46 55.487 57.172 -1.685 1
1 525 . 7 1 1 A 46 46 ARG CB C 46 31.153 30.576 0.577 1
1 528 . 7 1 1 A 46 46 ARG N N 46 121.652 119.908 1.744 1
1 529 . 7 1 1 A 47 47 TYR H H 47 7.973 8.385 -0.412 1
1 536 . 7 1 1 A 47 47 TYR CB C 47 39.356 38.743 0.613 1
1 541 . 7 1 1 A 48 48 TYR H H 48 9.023 8.769 0.254 1
1 542 . 7 1 1 A 48 48 TYR HA H 48 4.662 4.262 0.400 1
1 549 . 7 1 1 A 48 48 TYR CB C 48 39.863 40.156 -0.293 1
1 554 . 7 1 1 A 48 48 TYR N N 48 121.223 121.833 -0.610 1
1 555 . 7 1 1 A 49 49 LYS H H 49 7.134 7.732 -0.598 1
1 556 . 7 1 1 A 49 49 LYS HA H 49 4.283 4.567 -0.284 1
1 565 . 7 1 1 A 49 49 LYS CA C 49 55.167 54.406 0.761 1
1 566 . 7 1 1 A 49 49 LYS CB C 49 36.699 35.843 0.856 1
1 570 . 7 1 1 A 49 49 LYS N N 49 117.339 118.490 -1.151 1
1 571 . 7 1 1 A 50 50 GLU H H 50 8.411 8.830 -0.419 1
1 572 . 7 1 1 A 50 50 GLU HA H 50 4.583 5.047 -0.464 1
1 577 . 7 1 1 A 50 50 GLU CA C 50 54.592 54.892 -0.300 1
1 578 . 7 1 1 A 50 50 GLU CB C 50 33.263 32.844 0.419 1
1 580 . 7 1 1 A 50 50 GLU N N 50 123.825 124.782 -0.957 1
1 581 . 7 1 1 A 51 51 ILE H H 51 9.225 8.798 0.427 1
1 582 . 7 1 1 A 51 51 ILE HA H 51 4.277 4.568 -0.291 1
1 592 . 7 1 1 A 51 51 ILE CA C 51 58.182 58.086 0.096 1
1 593 . 7 1 1 A 51 51 ILE CB C 51 39.663 38.308 1.355 1
1 597 . 7 1 1 A 51 51 ILE N N 51 125.271 126.662 -1.391 1
1 598 . 7 1 1 A 52 52 PRO HA H 52 4.543 4.620 -0.077 1
1 605 . 7 1 1 A 52 52 PRO C C 52 178.340 178.009 0.331 1
1 606 . 7 1 1 A 52 52 PRO CA C 52 62.726 62.921 -0.195 1
1 607 . 7 1 1 A 52 52 PRO CB C 52 32.003 31.728 0.275 1
1 610 . 7 1 1 A 53 53 LEU H H 53 8.723 8.507 0.216 1
1 611 . 7 1 1 A 53 53 LEU HA H 53 3.891 3.878 0.013 1
1 621 . 7 1 1 A 53 53 LEU C C 53 179.673 178.927 0.746 1
1 622 . 7 1 1 A 53 53 LEU CA C 53 58.205 57.598 0.607 1
1 623 . 7 1 1 A 53 53 LEU CB C 53 40.171 41.587 -1.416 1
1 627 . 7 1 1 A 53 53 LEU N N 53 125.150 124.273 0.877 1
1 628 . 7 1 1 A 54 54 SER H H 54 8.360 8.134 0.226 1
1 629 . 7 1 1 A 54 54 SER HA H 54 4.164 4.108 0.056 1
1 632 . 7 1 1 A 54 54 SER C C 54 175.517 177.068 -1.551 1
1 633 . 7 1 1 A 54 54 SER CA C 54 60.193 61.730 -1.537 1
1 634 . 7 1 1 A 54 54 SER CB C 54 62.617 62.650 -0.033 1
1 635 . 7 1 1 A 54 54 SER N N 54 111.266 115.900 -4.634 1
1 636 . 7 1 1 A 55 55 GLU H H 55 7.666 8.239 -0.573 1
1 637 . 7 1 1 A 55 55 GLU HA H 55 4.363 4.059 0.304 1
1 642 . 7 1 1 A 55 55 GLU C C 55 176.753 178.001 -1.248 1
1 643 . 7 1 1 A 55 55 GLU CA C 55 56.200 59.085 -2.885 1
1 644 . 7 1 1 A 55 55 GLU CB C 55 30.526 29.267 1.259 1
1 646 . 7 1 1 A 55 55 GLU N N 55 119.485 119.630 -0.145 1
1 647 . 7 1 1 A 56 56 ILE H H 56 7.601 6.983 0.618 1
1 648 . 7 1 1 A 56 56 ILE HA H 56 3.793 3.929 -0.136 1
1 658 . 7 1 1 A 56 56 ILE C C 56 175.142 175.951 -0.809 1
1 659 . 7 1 1 A 56 56 ILE CA C 56 63.518 62.219 1.299 1
1 660 . 7 1 1 A 56 56 ILE CB C 56 37.169 37.937 -0.768 1
1 664 . 7 1 1 A 56 56 ILE N N 56 120.430 120.075 0.355 1
1 665 . 7 1 1 A 57 57 LEU H H 57 9.263 9.284 -0.021 1
1 666 . 7 1 1 A 57 57 LEU HA H 57 4.343 4.396 -0.053 1
1 676 . 7 1 1 A 57 57 LEU C C 57 177.898 176.528 1.370 1
1 677 . 7 1 1 A 57 57 LEU CA C 57 56.569 55.933 0.636 1
1 678 . 7 1 1 A 57 57 LEU CB C 57 41.980 42.582 -0.602 1
1 682 . 7 1 1 A 57 57 LEU N N 57 129.464 129.028 0.436 1
1 683 . 7 1 1 A 58 58 THR H H 58 7.414 7.314 0.100 1
1 684 . 7 1 1 A 58 58 THR HA H 58 4.512 4.861 -0.349 1
1 689 . 7 1 1 A 58 58 THR C C 58 171.314 172.644 -1.330 1
1 690 . 7 1 1 A 58 58 THR CA C 58 60.562 61.267 -0.705 1
1 691 . 7 1 1 A 58 58 THR CB C 58 70.803 73.394 -2.591 1
1 693 . 7 1 1 A 58 58 THR N N 58 109.129 110.310 -1.181 1
1 694 . 7 1 1 A 59 59 VAL H H 59 8.152 8.481 -0.329 1
1 695 . 7 1 1 A 59 59 VAL HA H 59 5.061 5.091 -0.030 1
1 703 . 7 1 1 A 59 59 VAL C C 59 174.985 174.942 0.043 1
1 704 . 7 1 1 A 59 59 VAL CA C 59 61.354 61.160 0.194 1
1 705 . 7 1 1 A 59 59 VAL CB C 59 33.855 34.152 -0.297 1
1 708 . 7 1 1 A 59 59 VAL N N 59 123.676 124.328 -0.652 1
1 709 . 7 1 1 A 60 60 GLU H H 60 9.074 8.761 0.313 1
1 710 . 7 1 1 A 60 60 GLU HA H 60 4.977 4.875 0.102 1
1 715 . 7 1 1 A 60 60 GLU C C 60 176.063 175.264 0.799 1
1 716 . 7 1 1 A 60 60 GLU CA C 60 53.807 54.383 -0.576 1
1 717 . 7 1 1 A 60 60 GLU CB C 60 33.739 33.582 0.157 1
1 719 . 7 1 1 A 60 60 GLU N N 60 125.125 126.058 -0.933 1
1 720 . 7 1 1 A 61 61 SER H H 61 8.763 8.748 0.015 1
1 721 . 7 1 1 A 61 61 SER HA H 61 4.452 4.977 -0.525 1
1 724 . 7 1 1 A 61 61 SER C C 61 173.288 174.225 -0.937 1
1 725 . 7 1 1 A 61 61 SER CA C 61 59.384 57.814 1.570 1
1 726 . 7 1 1 A 61 61 SER CB C 61 63.390 64.522 -1.132 1
1 727 . 7 1 1 A 61 61 SER N N 61 117.523 118.290 -0.767 1
1 728 . 7 1 1 A 62 62 ALA H H 62 7.293 8.650 -1.357 1
1 729 . 7 1 1 A 62 62 ALA HA H 62 3.817 4.269 -0.452 1
1 733 . 7 1 1 A 62 62 ALA C C 62 176.717 177.797 -1.080 1
1 734 . 7 1 1 A 62 62 ALA CA C 62 53.966 52.992 0.974 1
1 735 . 7 1 1 A 62 62 ALA CB C 62 18.640 18.525 0.115 1
1 736 . 7 1 1 A 62 62 ALA N N 62 122.650 126.022 -3.372 1
1 737 . 7 1 1 A 63 63 GLN H H 63 8.736 8.029 0.707 1
1 738 . 7 1 1 A 63 63 GLN HA H 63 4.445 4.742 -0.297 1
1 745 . 7 1 1 A 63 63 GLN C C 63 173.700 175.198 -1.498 1
1 746 . 7 1 1 A 63 63 GLN CA C 63 56.376 55.778 0.598 1
1 747 . 7 1 1 A 63 63 GLN CB C 63 31.515 31.069 0.446 1
1 749 . 7 1 1 A 63 63 GLN N N 63 120.251 119.438 0.813 1
1 751 . 7 1 1 A 64 64 ASN H H 64 9.272 7.201 2.071 1
1 752 . 7 1 1 A 64 64 ASN HA H 64 4.906 5.153 -0.247 1
1 757 . 7 1 1 A 64 64 ASN C C 64 174.754 175.029 -0.275 1
1 758 . 7 1 1 A 64 64 ASN CA C 64 51.837 52.057 -0.220 1
1 759 . 7 1 1 A 64 64 ASN CB C 64 38.156 40.334 -2.178 1
1 760 . 7 1 1 A 64 64 ASN N N 64 122.346 118.688 3.658 1
1 762 . 7 1 1 A 65 65 PHE H H 65 8.854 9.224 -0.370 1
1 763 . 7 1 1 A 65 65 PHE HA H 65 4.947 5.201 -0.254 1
1 771 . 7 1 1 A 65 65 PHE C C 65 177.274 176.359 0.915 1
1 772 . 7 1 1 A 65 65 PHE CA C 65 57.519 57.020 0.499 1
1 773 . 7 1 1 A 65 65 PHE CB C 65 38.485 38.788 -0.303 1
1 779 . 7 1 1 A 65 65 PHE N N 65 123.638 125.529 -1.891 1
1 780 . 7 1 1 A 66 66 SER H H 66 8.163 8.124 0.039 1
1 781 . 7 1 1 A 66 66 SER HA H 66 4.393 4.455 -0.062 1
1 784 . 7 1 1 A 66 66 SER C C 66 175.699 177.144 -1.445 1
1 785 . 7 1 1 A 66 66 SER CA C 66 60.791 61.139 -0.348 1
1 786 . 7 1 1 A 66 66 SER CB C 66 64.591 63.184 1.407 1
1 787 . 7 1 1 A 66 66 SER N N 66 113.913 115.892 -1.979 1
1 788 . 7 1 1 A 67 67 LEU H H 67 8.574 7.852 0.722 1
1 789 . 7 1 1 A 67 67 LEU HA H 67 4.302 3.768 0.534 1
1 799 . 7 1 1 A 67 67 LEU C C 67 176.269 177.334 -1.065 1
1 800 . 7 1 1 A 67 67 LEU CA C 67 55.601 58.198 -2.597 1
1 801 . 7 1 1 A 67 67 LEU CB C 67 42.021 41.938 0.083 1
1 805 . 7 1 1 A 67 67 LEU N N 67 121.264 120.904 0.360 1
1 806 . 7 1 1 A 68 68 VAL H H 68 6.921 7.608 -0.687 1
1 807 . 7 1 1 A 68 68 VAL HA H 68 4.473 4.173 0.300 1
1 815 . 7 1 1 A 68 68 VAL C C 68 173.809 174.966 -1.157 1
1 816 . 7 1 1 A 68 68 VAL CA C 68 58.047 60.646 -2.599 1
1 817 . 7 1 1 A 68 68 VAL CB C 68 32.295 31.990 0.305 1
1 820 . 7 1 1 A 68 68 VAL N N 68 111.287 115.602 -4.315 1
1 821 . 7 1 1 A 69 69 PRO HA H 69 4.658 4.647 0.011 1
1 828 . 7 1 1 A 69 69 PRO CA C 69 61.747 61.608 0.139 1
1 829 . 7 1 1 A 69 69 PRO CB C 69 30.693 32.424 -1.731 1
1 832 . 7 1 1 A 70 70 PRO HA H 70 4.414 4.358 0.056 1
1 839 . 7 1 1 A 70 70 PRO CA C 70 63.997 64.214 -0.217 1
1 840 . 7 1 1 A 70 70 PRO CB C 70 31.602 31.552 0.050 1
1 843 . 7 1 1 A 71 71 GLY H H 71 8.824 8.190 0.634 1
1 844 . 7 1 1 A 71 71 GLY HA2 H 71 3.703 4.036 -0.333 1
1 845 . 7 1 1 A 71 71 GLY HA3 H 71 4.193 4.037 0.156 1
1 846 . 7 1 1 A 71 71 GLY C C 71 174.052 173.004 1.048 1
1 847 . 7 1 1 A 71 71 GLY CA C 71 45.065 45.608 -0.543 1
1 848 . 7 1 1 A 71 71 GLY N N 71 111.845 106.149 5.696 1
1 849 . 7 1 1 A 72 72 THR H H 72 7.597 7.126 0.471 1
1 850 . 7 1 1 A 72 72 THR HA H 72 4.133 4.730 -0.597 1
1 855 . 7 1 1 A 72 72 THR CA C 72 63.129 61.005 2.124 1
1 856 . 7 1 1 A 72 72 THR CB C 72 69.560 71.816 -2.256 1
1 858 . 7 1 1 A 72 72 THR N N 72 117.485 114.507 2.978 1
1 859 . 7 1 1 A 73 73 ASN H H 73 9.280 8.558 0.722 1
1 860 . 7 1 1 A 73 73 ASN HA H 73 4.786 4.651 0.135 1
1 865 . 7 1 1 A 73 73 ASN CA C 73 52.009 52.203 -0.194 1
1 866 . 7 1 1 A 73 73 ASN CB C 73 37.553 38.316 -0.763 1
1 867 . 7 1 1 A 73 73 ASN N N 73 127.641 126.050 1.591 1
1 869 . 7 1 1 A 74 74 PRO HA H 74 4.752 4.847 -0.095 1
1 876 . 7 1 1 A 74 74 PRO C C 74 175.190 176.428 -1.238 1
1 877 . 7 1 1 A 74 74 PRO CA C 74 63.395 62.531 0.864 1
1 878 . 7 1 1 A 74 74 PRO CB C 74 33.164 33.324 -0.160 1
1 881 . 7 1 1 A 75 75 HIS H H 75 8.025 8.702 -0.677 1
1 882 . 7 1 1 A 75 75 HIS HA H 75 5.047 5.055 -0.008 1
1 887 . 7 1 1 A 75 75 HIS C C 75 172.562 175.417 -2.855 1
1 888 . 7 1 1 A 75 75 HIS CA C 75 54.336 53.511 0.825 1
1 889 . 7 1 1 A 75 75 HIS CB C 75 30.956 33.353 -2.397 1
1 892 . 7 1 1 A 75 75 HIS N N 75 116.198 116.665 -0.467 1
1 893 . 7 1 1 A 76 76 CYS H H 76 8.343 9.398 -1.055 1
1 894 . 7 1 1 A 76 76 CYS HA H 76 4.594 4.464 0.130 1
1 897 . 7 1 1 A 76 76 CYS C C 76 175.651 175.240 0.411 1
1 898 . 7 1 1 A 76 76 CYS CA C 76 61.066 61.150 -0.084 1
1 899 . 7 1 1 A 76 76 CYS CB C 76 30.193 29.541 0.652 1
1 900 . 7 1 1 A 76 76 CYS N N 76 113.289 118.009 -4.720 1
1 901 . 7 1 1 A 77 77 PHE H H 77 8.433 7.770 0.663 1
1 902 . 7 1 1 A 77 77 PHE HA H 77 5.105 5.276 -0.171 1
1 910 . 7 1 1 A 77 77 PHE C C 77 171.822 172.807 -0.985 1
1 911 . 7 1 1 A 77 77 PHE CA C 77 56.874 55.715 1.159 1
1 912 . 7 1 1 A 77 77 PHE CB C 77 39.393 42.700 -3.307 1
1 918 . 7 1 1 A 77 77 PHE N N 77 114.874 115.635 -0.761 1
1 919 . 7 1 1 A 78 78 GLU H H 78 9.823 9.202 0.621 1
1 920 . 7 1 1 A 78 78 GLU HA H 78 5.333 5.279 0.054 1
1 925 . 7 1 1 A 78 78 GLU C C 78 175.602 175.455 0.147 1
1 926 . 7 1 1 A 78 78 GLU CA C 78 54.212 54.642 -0.430 1
1 927 . 7 1 1 A 78 78 GLU CB C 78 31.702 32.733 -1.031 1
1 929 . 7 1 1 A 78 78 GLU N N 78 121.074 119.131 1.943 1
1 930 . 7 1 1 A 79 79 ILE H H 79 9.093 9.054 0.039 1
1 931 . 7 1 1 A 79 79 ILE HA H 79 4.637 4.559 0.078 1
1 941 . 7 1 1 A 79 79 ILE C C 79 174.476 175.212 -0.736 1
1 942 . 7 1 1 A 79 79 ILE CA C 79 60.932 60.612 0.320 1
1 943 . 7 1 1 A 79 79 ILE CB C 79 40.803 37.614 3.189 1
1 947 . 7 1 1 A 79 79 ILE N N 79 121.382 124.133 -2.751 1
1 948 . 7 1 1 A 80 80 VAL H H 80 8.841 7.918 0.923 1
1 949 . 7 1 1 A 80 80 VAL HA H 80 4.425 3.864 0.561 1
1 957 . 7 1 1 A 80 80 VAL C C 80 175.930 175.409 0.521 1
1 958 . 7 1 1 A 80 80 VAL CA C 80 63.324 63.287 0.037 1
1 959 . 7 1 1 A 80 80 VAL CB C 80 32.783 31.272 1.511 1
1 962 . 7 1 1 A 80 80 VAL N N 80 128.970 127.661 1.309 1
1 963 . 7 1 1 A 81 81 THR H H 81 8.303 7.992 0.311 1
1 964 . 7 1 1 A 81 81 THR HA H 81 5.264 4.701 0.563 1
1 969 . 7 1 1 A 81 81 THR C C 81 173.664 174.584 -0.920 1
1 970 . 7 1 1 A 81 81 THR CA C 81 59.540 59.867 -0.327 1
1 971 . 7 1 1 A 81 81 THR CB C 81 72.197 71.646 0.551 1
1 973 . 7 1 1 A 81 81 THR N N 81 118.077 118.773 -0.696 1
1 974 . 7 1 1 A 82 82 ALA H H 82 9.586 8.497 1.089 1
1 975 . 7 1 1 A 82 82 ALA HA H 82 4.093 4.414 -0.321 1
1 979 . 7 1 1 A 82 82 ALA C C 82 178.667 177.686 0.981 1
1 980 . 7 1 1 A 82 82 ALA CA C 82 55.321 52.779 2.542 1
1 981 . 7 1 1 A 82 82 ALA CB C 82 18.094 18.089 0.005 1
1 982 . 7 1 1 A 82 82 ALA N N 82 122.493 123.432 -0.939 1
1 983 . 7 1 1 A 83 83 ASN H H 83 7.923 8.472 -0.549 1
1 984 . 7 1 1 A 83 83 ASN HA H 83 4.808 5.103 -0.295 1
1 989 . 7 1 1 A 83 83 ASN C C 83 174.766 174.507 0.259 1
1 990 . 7 1 1 A 83 83 ASN CA C 83 53.333 54.653 -1.320 1
1 991 . 7 1 1 A 83 83 ASN CB C 83 40.335 41.826 -1.491 1
1 992 . 7 1 1 A 83 83 ASN N N 83 110.765 116.057 -5.292 1
1 994 . 7 1 1 A 84 84 ALA H H 84 7.352 7.166 0.186 1
1 995 . 7 1 1 A 84 84 ALA HA H 84 4.625 4.511 0.114 1
1 999 . 7 1 1 A 84 84 ALA C C 84 176.547 175.118 1.429 1
1 1000 . 7 1 1 A 84 84 ALA CA C 84 52.858 51.840 1.018 1
1 1001 . 7 1 1 A 84 84 ALA CB C 84 21.233 22.067 -0.834 1
1 1002 . 7 1 1 A 84 84 ALA N N 84 119.599 117.703 1.896 1
1 1003 . 7 1 1 A 85 85 THR H H 85 8.374 8.621 -0.247 1
1 1004 . 7 1 1 A 85 85 THR HA H 85 5.014 4.598 0.416 1
1 1009 . 7 1 1 A 85 85 THR C C 85 171.568 174.138 -2.570 1
1 1010 . 7 1 1 A 85 85 THR CA C 85 61.618 62.504 -0.886 1
1 1011 . 7 1 1 A 85 85 THR CB C 85 70.850 69.457 1.393 1
1 1013 . 7 1 1 A 85 85 THR N N 85 119.032 113.362 5.670 1
1 1014 . 7 1 1 A 86 86 TYR H H 86 9.006 9.021 -0.015 1
1 1015 . 7 1 1 A 86 86 TYR HA H 86 4.658 4.847 -0.189 1
1 1022 . 7 1 1 A 86 86 TYR C C 86 173.773 175.331 -1.558 1
1 1023 . 7 1 1 A 86 86 TYR CA C 86 56.938 57.732 -0.794 1
1 1024 . 7 1 1 A 86 86 TYR CB C 86 39.513 40.137 -0.624 1
1 1029 . 7 1 1 A 86 86 TYR N N 86 123.494 127.239 -3.745 1
1 1030 . 7 1 1 A 87 87 PHE H H 87 9.263 8.875 0.388 1
1 1031 . 7 1 1 A 87 87 PHE HA H 87 4.127 4.511 -0.384 1
1 1039 . 7 1 1 A 87 87 PHE C C 87 176.369 174.154 2.215 1
1 1040 . 7 1 1 A 87 87 PHE CA C 87 57.238 55.436 1.802 1
1 1041 . 7 1 1 A 87 87 PHE CB C 87 37.086 38.147 -1.061 1
1 1047 . 7 1 1 A 87 87 PHE N N 87 125.384 119.668 5.716 1
1 1048 . 7 1 1 A 88 88 VAL H H 88 9.023 8.324 0.699 1
1 1049 . 7 1 1 A 88 88 VAL HA H 88 4.162 4.626 -0.464 1
1 1057 . 7 1 1 A 88 88 VAL C C 88 176.390 176.053 0.337 1
1 1058 . 7 1 1 A 88 88 VAL CA C 88 63.975 60.618 3.357 1
1 1059 . 7 1 1 A 88 88 VAL CB C 88 32.378 32.125 0.253 1
1 1062 . 7 1 1 A 88 88 VAL N N 88 127.348 124.933 2.415 1
1 1063 . 7 1 1 A 89 89 GLY H H 89 9.233 7.862 1.371 1
1 1064 . 7 1 1 A 89 89 GLY HA2 H 89 4.293 4.162 0.131 1
1 1065 . 7 1 1 A 89 89 GLY HA3 H 89 4.186 4.213 -0.027 1
1 1066 . 7 1 1 A 89 89 GLY C C 89 172.378 173.473 -1.095 1
1 1067 . 7 1 1 A 89 89 GLY CA C 89 43.798 45.693 -1.895 1
1 1068 . 7 1 1 A 89 89 GLY N N 89 116.041 112.762 3.279 1
1 1069 . 7 1 1 A 90 90 GLU H H 90 8.532 8.542 -0.010 1
1 1070 . 7 1 1 A 90 90 GLU HA H 90 4.794 4.303 0.491 1
1 1075 . 7 1 1 A 90 90 GLU C C 90 174.221 176.437 -2.216 1
1 1076 . 7 1 1 A 90 90 GLU CA C 90 56.393 56.564 -0.171 1
1 1077 . 7 1 1 A 90 90 GLU CB C 90 33.182 30.023 3.159 1
1 1079 . 7 1 1 A 90 90 GLU N N 90 120.905 119.119 1.786 1
1 1080 . 7 1 1 A 91 91 MET H H 91 8.450 8.461 -0.011 1
1 1081 . 7 1 1 A 91 91 MET HA H 91 4.904 5.145 -0.241 1
1 1089 . 7 1 1 A 91 91 MET C C 91 173.373 174.392 -1.019 1
1 1090 . 7 1 1 A 91 91 MET CA C 91 52.277 53.041 -0.764 1
1 1091 . 7 1 1 A 91 91 MET CB C 91 32.789 34.009 -1.220 1
1 1094 . 7 1 1 A 91 91 MET N N 91 125.173 117.565 7.608 1
1 1095 . 7 1 1 A 92 92 PRO HA H 92 4.358 4.521 -0.163 1
1 1102 . 7 1 1 A 92 92 PRO C C 92 177.589 177.409 0.180 1
1 1103 . 7 1 1 A 92 92 PRO CA C 92 63.143 62.400 0.743 1
1 1104 . 7 1 1 A 92 92 PRO CB C 92 32.083 32.960 -0.877 1
1 1107 . 7 1 1 A 93 93 GLY H H 93 8.330 8.614 -0.284 1
1 1108 . 7 1 1 A 93 93 GLY HA2 H 93 3.943 3.793 0.150 1
1 1109 . 7 1 1 A 93 93 GLY HA3 H 93 4.045 3.796 0.249 1
1 1110 . 7 1 1 A 93 93 GLY C C 93 174.730 174.804 -0.074 1
1 1111 . 7 1 1 A 93 93 GLY CA C 93 45.276 47.255 -1.979 1
1 1112 . 7 1 1 A 93 93 GLY N N 93 109.420 107.464 1.956 1
1 1113 . 7 1 1 A 94 94 GLY H H 94 8.331 7.739 0.592 1
1 1114 . 7 1 1 A 94 94 GLY HA2 H 94 3.973 3.939 0.034 1
1 1115 . 7 1 1 A 94 94 GLY HA3 H 94 3.973 3.940 0.033 1
1 1116 . 7 1 1 A 94 94 GLY C C 94 174.100 173.907 0.193 1
1 1117 . 7 1 1 A 94 94 GLY CA C 94 45.333 45.583 -0.250 1
1 1118 . 7 1 1 A 94 94 GLY N N 94 108.483 106.378 2.105 1
1 1119 . 7 1 1 A 95 95 THR H H 95 8.095 8.150 -0.055 1
1 1120 . 7 1 1 A 95 95 THR HA H 95 4.643 4.676 -0.033 1
1 1125 . 7 1 1 A 95 95 THR C C 95 173.155 173.556 -0.401 1
1 1126 . 7 1 1 A 95 95 THR CA C 95 59.922 60.079 -0.157 1
1 1127 . 7 1 1 A 95 95 THR CB C 95 69.871 69.482 0.389 1
1 1129 . 7 1 1 A 95 95 THR N N 95 115.860 114.224 1.636 1
1 1130 . 7 1 1 A 96 96 PRO HA H 96 4.400 4.301 0.099 1
1 1137 . 7 1 1 A 96 96 PRO C C 96 177.565 176.222 1.343 1
1 1138 . 7 1 1 A 96 96 PRO CA C 96 64.047 63.540 0.507 1
1 1139 . 7 1 1 A 96 96 PRO CB C 96 31.816 31.855 -0.039 1
1 1142 . 7 1 1 A 97 97 GLY H H 97 8.572 8.379 0.193 1
1 1143 . 7 1 1 A 97 97 GLY HA2 H 97 4.007 4.140 -0.133 1
1 1144 . 7 1 1 A 97 97 GLY HA3 H 97 4.007 4.145 -0.138 1
1 1145 . 7 1 1 A 97 97 GLY C C 97 174.609 172.945 1.664 1
1 1146 . 7 1 1 A 97 97 GLY CA C 97 45.276 44.636 0.640 1
1 1147 . 7 1 1 A 97 97 GLY N N 97 110.233 110.060 0.173 1
1 1148 . 7 1 1 A 98 98 GLY H H 98 8.119 8.401 -0.282 1
1 1149 . 7 1 1 A 98 98 GLY HA2 H 98 4.086 4.162 -0.076 1
1 1150 . 7 1 1 A 98 98 GLY HA3 H 98 4.200 4.168 0.032 1
1 1151 . 7 1 1 A 98 98 GLY CA C 98 44.876 44.398 0.478 1
1 1152 . 7 1 1 A 98 98 GLY N N 98 108.845 109.067 -0.222 1
1 1153 . 7 1 1 A 99 99 PRO HA H 99 4.494 4.488 0.006 1
1 1160 . 7 1 1 A 99 99 PRO C C 99 177.468 177.534 -0.066 1
1 1161 . 7 1 1 A 99 99 PRO CA C 99 63.500 64.019 -0.519 1
1 1162 . 7 1 1 A 99 99 PRO CB C 99 32.013 31.938 0.075 1
1 1165 . 7 1 1 A 100 100 SER H H 100 8.472 8.045 0.427 1
1 1166 . 7 1 1 A 100 100 SER HA H 100 4.513 4.080 0.433 1
1 1169 . 7 1 1 A 100 100 SER C C 100 175.408 173.715 1.693 1
1 1170 . 7 1 1 A 100 100 SER CA C 100 58.557 59.253 -0.696 1
1 1171 . 7 1 1 A 100 100 SER CB C 100 63.918 61.401 2.517 1
1 1172 . 7 1 1 A 100 100 SER N N 100 116.038 114.053 1.985 1
1 1173 . 7 1 1 A 101 101 GLY H H 101 8.427 7.998 0.429 1
1 1174 . 7 1 1 A 101 101 GLY HA2 H 101 4.064 4.105 -0.041 1
1 1175 . 7 1 1 A 101 101 GLY HA3 H 101 4.064 4.112 -0.048 1
1 1176 . 7 1 1 A 101 101 GLY C C 101 174.730 174.915 -0.185 1
1 1177 . 7 1 1 A 101 101 GLY CA C 101 45.575 44.450 1.125 1
1 1178 . 7 1 1 A 101 101 GLY N N 101 110.558 109.241 1.317 1
1 1179 . 7 1 1 A 102 102 GLN H H 102 8.416 8.646 -0.230 1
1 1180 . 7 1 1 A 102 102 GLN HA H 102 4.383 3.990 0.393 1
1 1187 . 7 1 1 A 102 102 GLN C C 102 177.346 176.906 0.440 1
1 1188 . 7 1 1 A 102 102 GLN CA C 102 57.080 57.781 -0.701 1
1 1189 . 7 1 1 A 102 102 GLN CB C 102 29.235 29.050 0.185 1
1 1191 . 7 1 1 A 102 102 GLN N N 102 120.112 118.139 1.973 1
1 1193 . 7 1 1 A 103 103 GLY H H 103 8.713 8.271 0.442 1
1 1194 . 7 1 1 A 103 103 GLY HA2 H 103 4.193 3.997 0.196 1
1 1195 . 7 1 1 A 103 103 GLY HA3 H 103 4.078 4.011 0.067 1
1 1196 . 7 1 1 A 103 103 GLY C C 103 175.602 174.297 1.305 1
1 1197 . 7 1 1 A 103 103 GLY CA C 103 46.120 46.583 -0.463 1
1 1198 . 7 1 1 A 103 103 GLY N N 103 109.817 107.193 2.624 1
1 1199 . 7 1 1 A 104 104 ALA H H 104 8.366 7.795 0.571 1
1 1200 . 7 1 1 A 104 104 ALA HA H 104 4.449 4.721 -0.272 1
1 1204 . 7 1 1 A 104 104 ALA C C 104 179.188 178.611 0.577 1
1 1205 . 7 1 1 A 104 104 ALA CA C 104 54.230 53.114 1.116 1
1 1206 . 7 1 1 A 104 104 ALA CB C 104 19.080 20.632 -1.552 1
1 1207 . 7 1 1 A 104 104 ALA N N 104 124.808 120.475 4.333 1
1 1208 . 7 1 1 A 105 105 GLU H H 105 8.576 8.300 0.276 1
1 1209 . 7 1 1 A 105 105 GLU HA H 105 4.161 4.134 0.027 1
1 1214 . 7 1 1 A 105 105 GLU C C 105 179.200 179.135 0.065 1
1 1215 . 7 1 1 A 105 105 GLU CA C 105 59.173 59.457 -0.284 1
1 1216 . 7 1 1 A 105 105 GLU CB C 105 29.194 29.287 -0.093 1
1 1218 . 7 1 1 A 105 105 GLU N N 105 119.238 117.247 1.991 1
1 1219 . 7 1 1 A 106 106 ALA H H 106 8.381 8.212 0.169 1
1 1220 . 7 1 1 A 106 106 ALA HA H 106 4.283 4.073 0.210 1
1 1224 . 7 1 1 A 106 106 ALA C C 106 180.048 180.018 0.030 1
1 1225 . 7 1 1 A 106 106 ALA CA C 106 54.687 55.240 -0.553 1
1 1226 . 7 1 1 A 106 106 ALA CB C 106 18.341 18.788 -0.447 1
1 1227 . 7 1 1 A 106 106 ALA N N 106 123.327 121.968 1.359 1
1 1228 . 7 1 1 A 107 107 ALA H H 107 8.123 8.224 -0.101 1
1 1229 . 7 1 1 A 107 107 ALA HA H 107 4.554 4.446 0.108 1
1 1233 . 7 1 1 A 107 107 ALA C C 107 179.757 179.955 -0.198 1
1 1234 . 7 1 1 A 107 107 ALA CA C 107 55.355 55.471 -0.116 1
1 1235 . 7 1 1 A 107 107 ALA CB C 107 18.939 18.228 0.711 1
1 1236 . 7 1 1 A 107 107 ALA N N 107 120.740 120.171 0.569 1
1 1237 . 7 1 1 A 108 108 ARG H H 108 8.403 7.730 0.673 1
1 1238 . 7 1 1 A 108 108 ARG HA H 108 4.254 4.089 0.165 1
1 1245 . 7 1 1 A 108 108 ARG C C 108 179.111 179.830 -0.719 1
1 1246 . 7 1 1 A 108 108 ARG CA C 108 59.015 59.237 -0.222 1
1 1247 . 7 1 1 A 108 108 ARG CB C 108 29.752 30.010 -0.258 1
1 1250 . 7 1 1 A 108 108 ARG N N 108 119.531 118.030 1.501 1
1 1251 . 7 1 1 A 109 109 GLY H H 109 8.182 8.131 0.051 1
1 1252 . 7 1 1 A 109 109 GLY HA2 H 109 3.822 3.611 0.211 1
1 1253 . 7 1 1 A 109 109 GLY HA3 H 109 3.822 3.669 0.153 1
1 1254 . 7 1 1 A 109 109 GLY C C 109 177.020 176.300 0.720 1
1 1255 . 7 1 1 A 109 109 GLY CA C 109 46.718 47.161 -0.443 1
1 1256 . 7 1 1 A 109 109 GLY N N 109 107.331 108.102 -0.771 1
1 1257 . 7 1 1 A 110 110 TRP H H 110 7.925 7.994 -0.069 1
1 1258 . 7 1 1 A 110 110 TRP HA H 110 3.963 4.482 -0.519 1
1 1267 . 7 1 1 A 110 110 TRP C C 110 176.691 178.039 -1.348 1
1 1268 . 7 1 1 A 110 110 TRP CA C 110 62.041 60.922 1.119 1
1 1269 . 7 1 1 A 110 110 TRP CB C 110 28.989 28.399 0.590 1
1 1275 . 7 1 1 A 110 110 TRP N N 110 122.304 120.630 1.674 1
1 1277 . 7 1 1 A 111 111 GLU H H 111 7.946 7.777 0.169 1
1 1278 . 7 1 1 A 111 111 GLU HA H 111 2.594 2.667 -0.073 1
1 1283 . 7 1 1 A 111 111 GLU C C 111 177.976 179.023 -1.047 1
1 1284 . 7 1 1 A 111 111 GLU CA C 111 60.193 58.950 1.243 1
1 1285 . 7 1 1 A 111 111 GLU CB C 111 29.277 29.300 -0.023 1
1 1287 . 7 1 1 A 111 111 GLU N N 111 121.755 119.102 2.653 1
1 1288 . 7 1 1 A 112 112 THR H H 112 7.993 7.653 0.340 1
1 1289 . 7 1 1 A 112 112 THR HA H 112 3.722 3.825 -0.103 1
1 1294 . 7 1 1 A 112 112 THR C C 112 176.038 175.878 0.160 1
1 1295 . 7 1 1 A 112 112 THR CA C 112 66.104 66.559 -0.455 1
1 1296 . 7 1 1 A 112 112 THR CB C 112 68.885 68.703 0.182 1
1 1298 . 7 1 1 A 112 112 THR N N 112 112.247 116.504 -4.257 1
1 1299 . 7 1 1 A 113 113 ALA H H 113 7.742 8.433 -0.691 1
1 1300 . 7 1 1 A 113 113 ALA HA H 113 4.029 3.995 0.034 1
1 1304 . 7 1 1 A 113 113 ALA C C 113 180.545 180.057 0.488 1
1 1305 . 7 1 1 A 113 113 ALA CA C 113 55.127 55.346 -0.219 1
1 1306 . 7 1 1 A 113 113 ALA CB C 113 18.854 18.478 0.376 1
1 1307 . 7 1 1 A 113 113 ALA N N 113 123.134 122.819 0.315 1
1 1308 . 7 1 1 A 114 114 ILE H H 114 8.472 8.510 -0.038 1
1 1309 . 7 1 1 A 114 114 ILE HA H 114 3.613 3.772 -0.159 1
1 1319 . 7 1 1 A 114 114 ILE C C 114 176.947 178.089 -1.142 1
1 1320 . 7 1 1 A 114 114 ILE CA C 114 66.016 65.204 0.812 1
1 1321 . 7 1 1 A 114 114 ILE CB C 114 38.335 37.973 0.362 1
1 1325 . 7 1 1 A 114 114 ILE N N 114 118.276 118.151 0.125 1
1 1326 . 7 1 1 A 115 115 ARG H H 115 8.181 7.941 0.240 1
1 1327 . 7 1 1 A 115 115 ARG HA H 115 3.835 3.914 -0.079 1
1 1334 . 7 1 1 A 115 115 ARG C C 115 179.588 179.134 0.454 1
1 1335 . 7 1 1 A 115 115 ARG CA C 115 61.072 60.059 1.013 1
1 1336 . 7 1 1 A 115 115 ARG CB C 115 29.975 29.890 0.085 1
1 1339 . 7 1 1 A 115 115 ARG N N 115 117.921 119.285 -1.364 1
1 1340 . 7 1 1 A 116 116 GLN H H 116 8.395 8.521 -0.126 1
1 1341 . 7 1 1 A 116 116 GLN HA H 116 4.030 4.071 -0.041 1
1 1348 . 7 1 1 A 116 116 GLN C C 116 178.716 178.823 -0.107 1
1 1349 . 7 1 1 A 116 116 GLN CA C 116 58.790 58.878 -0.088 1
1 1350 . 7 1 1 A 116 116 GLN CB C 116 28.248 28.460 -0.212 1
1 1352 . 7 1 1 A 116 116 GLN N N 116 116.842 118.862 -2.020 1
1 1354 . 7 1 1 A 117 117 ALA H H 117 7.902 8.240 -0.338 1
1 1355 . 7 1 1 A 117 117 ALA HA H 117 4.143 4.145 -0.002 1
1 1359 . 7 1 1 A 117 117 ALA C C 117 179.685 180.046 -0.361 1
1 1360 . 7 1 1 A 117 117 ALA CA C 117 54.476 54.991 -0.515 1
1 1361 . 7 1 1 A 117 117 ALA CB C 117 18.300 18.331 -0.031 1
1 1362 . 7 1 1 A 117 117 ALA N N 117 122.828 122.820 0.008 1
1 1363 . 7 1 1 A 118 118 LEU H H 118 7.904 8.090 -0.186 1
1 1364 . 7 1 1 A 118 118 LEU HA H 118 4.119 4.090 0.029 1
1 1374 . 7 1 1 A 118 118 LEU C C 118 178.437 178.762 -0.325 1
1 1375 . 7 1 1 A 118 118 LEU CA C 118 56.781 57.188 -0.407 1
1 1376 . 7 1 1 A 118 118 LEU CB C 118 42.371 41.698 0.673 1
1 1380 . 7 1 1 A 118 118 LEU N N 118 117.632 120.082 -2.450 1
1 1381 . 7 1 1 A 119 119 MET H H 119 7.673 8.162 -0.489 1
1 1382 . 7 1 1 A 119 119 MET HA H 119 4.442 4.189 0.253 1
1 1390 . 7 1 1 A 119 119 MET C C 119 176.680 178.694 -2.014 1
1 1391 . 7 1 1 A 119 119 MET CA C 119 56.432 57.961 -1.529 1
1 1392 . 7 1 1 A 119 119 MET CB C 119 32.769 31.937 0.832 1
1 1395 . 7 1 1 A 119 119 MET N N 119 117.286 117.865 -0.579 1
1 1396 . 7 1 1 A 120 120 SER H H 120 7.878 7.754 0.124 1
1 1397 . 7 1 1 A 120 120 SER HA H 120 4.500 4.156 0.344 1
1 1400 . 7 1 1 A 120 120 SER C C 120 174.742 177.168 -2.426 1
1 1401 . 7 1 1 A 120 120 SER CA C 120 58.962 62.688 -3.726 1
1 1402 . 7 1 1 A 120 120 SER CB C 120 63.853 62.666 1.187 1
1 1403 . 7 1 1 A 120 120 SER N N 120 115.064 118.329 -3.265 1
1 1404 . 7 1 1 A 121 121 GLY H H 121 8.059 8.362 -0.303 1
1 1405 . 7 1 1 A 121 121 GLY HA2 H 121 4.231 3.777 0.454 1
1 1406 . 7 1 1 A 121 121 GLY HA3 H 121 4.112 3.777 0.335 1
1 1407 . 7 1 1 A 121 121 GLY C C 121 172.065 173.788 -1.723 1
1 1408 . 7 1 1 A 121 121 GLY CA C 121 45.030 45.123 -0.093 1
1 1409 . 7 1 1 A 121 121 GLY N N 121 110.271 109.865 0.406 1
1 1410 . 7 1 1 A 122 122 PRO HA H 122 4.496 4.694 -0.198 1
1 1417 . 7 1 1 A 122 122 PRO CA C 122 63.399 62.397 1.002 1
1 1418 . 7 1 1 A 122 122 PRO CB C 122 32.186 30.688 1.498 1
1 1 . 8 1 1 A 6 6 SER H H 6 8.337 7.659 0.678 1
1 2 . 8 1 1 A 6 6 SER HA H 6 4.597 5.029 -0.432 1
1 5 . 8 1 1 A 6 6 SER C C 6 174.637 173.671 0.966 1
1 6 . 8 1 1 A 6 6 SER CA C 6 58.469 56.182 2.287 1
1 7 . 8 1 1 A 6 6 SER CB C 6 64.221 66.124 -1.903 1
1 8 . 8 1 1 A 6 6 SER N N 6 117.887 111.583 6.304 1
1 9 . 8 1 1 A 7 7 GLY H H 7 8.280 8.416 -0.136 1
1 10 . 8 1 1 A 7 7 GLY HA2 H 7 4.063 4.168 -0.105 1
1 11 . 8 1 1 A 7 7 GLY HA3 H 7 4.063 4.170 -0.107 1
1 12 . 8 1 1 A 7 7 GLY C C 7 173.724 173.085 0.639 1
1 13 . 8 1 1 A 7 7 GLY CA C 7 44.941 44.247 0.694 1
1 14 . 8 1 1 A 7 7 GLY N N 7 110.151 108.960 1.191 1
1 15 . 8 1 1 A 8 8 THR H H 8 8.212 8.517 -0.305 1
1 16 . 8 1 1 A 8 8 THR HA H 8 4.173 4.299 -0.126 1
1 21 . 8 1 1 A 8 8 THR C C 8 174.723 173.839 0.884 1
1 22 . 8 1 1 A 8 8 THR CA C 8 63.622 63.096 0.526 1
1 23 . 8 1 1 A 8 8 THR CB C 8 69.460 69.039 0.421 1
1 25 . 8 1 1 A 8 8 THR N N 8 116.817 115.452 1.365 1
1 26 . 8 1 1 A 9 9 LEU H H 9 9.374 8.564 0.810 1
1 27 . 8 1 1 A 9 9 LEU HA H 9 4.302 3.943 0.359 1
1 37 . 8 1 1 A 9 9 LEU C C 9 177.468 176.374 1.094 1
1 38 . 8 1 1 A 9 9 LEU CA C 9 55.936 58.117 -2.181 1
1 39 . 8 1 1 A 9 9 LEU CB C 9 42.843 41.910 0.933 1
1 43 . 8 1 1 A 9 9 LEU N N 9 127.798 128.710 -0.912 1
1 44 . 8 1 1 A 10 10 ARG H H 10 7.512 7.323 0.189 1
1 45 . 8 1 1 A 10 10 ARG HA H 10 4.199 4.738 -0.539 1
1 52 . 8 1 1 A 10 10 ARG C C 10 172.501 174.218 -1.717 1
1 53 . 8 1 1 A 10 10 ARG CA C 10 56.165 54.261 1.904 1
1 54 . 8 1 1 A 10 10 ARG CB C 10 32.442 33.361 -0.919 1
1 57 . 8 1 1 A 10 10 ARG N N 10 117.979 116.071 1.908 1
1 58 . 8 1 1 A 11 11 GLU H H 11 8.434 8.614 -0.180 1
1 59 . 8 1 1 A 11 11 GLU HA H 11 5.993 5.521 0.472 1
1 64 . 8 1 1 A 11 11 GLU C C 11 174.800 175.094 -0.294 1
1 65 . 8 1 1 A 11 11 GLU CA C 11 54.570 55.166 -0.596 1
1 66 . 8 1 1 A 11 11 GLU CB C 11 34.245 33.389 0.856 1
1 68 . 8 1 1 A 11 11 GLU N N 11 120.782 123.237 -2.455 1
1 69 . 8 1 1 A 12 12 GLY H H 12 8.131 7.563 0.568 1
1 70 . 8 1 1 A 12 12 GLY HA2 H 12 4.714 3.502 1.212 1
1 71 . 8 1 1 A 12 12 GLY HA3 H 12 3.763 4.127 -0.364 1
1 72 . 8 1 1 A 12 12 GLY C C 12 171.060 172.575 -1.515 1
1 73 . 8 1 1 A 12 12 GLY CA C 12 45.241 44.352 0.889 1
1 74 . 8 1 1 A 12 12 GLY N N 12 107.457 107.535 -0.078 1
1 75 . 8 1 1 A 13 13 TRP H H 13 8.783 8.486 0.297 1
1 76 . 8 1 1 A 13 13 TRP HA H 13 5.152 4.870 0.282 1
1 85 . 8 1 1 A 13 13 TRP C C 13 177.528 176.631 0.897 1
1 86 . 8 1 1 A 13 13 TRP CA C 13 57.783 58.791 -1.008 1
1 87 . 8 1 1 A 13 13 TRP CB C 13 30.222 29.961 0.261 1
1 93 . 8 1 1 A 13 13 TRP N N 13 120.792 121.422 -0.630 1
1 95 . 8 1 1 A 14 14 VAL H H 14 9.179 9.151 0.028 1
1 96 . 8 1 1 A 14 14 VAL HA H 14 4.072 4.502 -0.430 1
1 104 . 8 1 1 A 14 14 VAL C C 14 174.981 173.415 1.566 1
1 105 . 8 1 1 A 14 14 VAL CA C 14 61.741 60.403 1.338 1
1 106 . 8 1 1 A 14 14 VAL CB C 14 35.143 34.978 0.165 1
1 109 . 8 1 1 A 14 14 VAL N N 14 125.476 123.209 2.267 1
1 110 . 8 1 1 A 15 15 VAL H H 15 8.403 8.869 -0.466 1
1 111 . 8 1 1 A 15 15 VAL HA H 15 5.532 5.167 0.365 1
1 119 . 8 1 1 A 15 15 VAL C C 15 175.078 174.518 0.560 1
1 120 . 8 1 1 A 15 15 VAL CA C 15 59.489 59.677 -0.188 1
1 121 . 8 1 1 A 15 15 VAL CB C 15 34.210 34.515 -0.305 1
1 124 . 8 1 1 A 15 15 VAL N N 15 126.189 128.116 -1.927 1
1 125 . 8 1 1 A 16 16 HIS H H 16 9.122 8.779 0.343 1
1 126 . 8 1 1 A 16 16 HIS HA H 16 5.823 5.834 -0.011 1
1 131 . 8 1 1 A 16 16 HIS C C 16 172.998 172.568 0.430 1
1 132 . 8 1 1 A 16 16 HIS CA C 16 56.253 53.807 2.446 1
1 133 . 8 1 1 A 16 16 HIS CB C 16 34.273 33.389 0.884 1
1 136 . 8 1 1 A 16 16 HIS N N 16 121.152 121.160 -0.008 1
1 137 . 8 1 1 A 17 17 TYR H H 17 8.465 8.617 -0.152 1
1 138 . 8 1 1 A 17 17 TYR HA H 17 5.096 4.733 0.363 1
1 145 . 8 1 1 A 17 17 TYR C C 17 173.640 172.974 0.666 1
1 146 . 8 1 1 A 17 17 TYR CA C 17 56.903 56.530 0.373 1
1 147 . 8 1 1 A 17 17 TYR CB C 17 40.103 40.319 -0.216 1
1 152 . 8 1 1 A 17 17 TYR N N 17 115.558 116.312 -0.754 1
1 153 . 8 1 1 A 18 18 SER H H 18 9.122 8.671 0.451 1
1 154 . 8 1 1 A 18 18 SER HA H 18 6.144 5.134 1.010 1
1 157 . 8 1 1 A 18 18 SER C C 18 173.204 175.582 -2.378 1
1 158 . 8 1 1 A 18 18 SER CA C 18 56.640 56.790 -0.150 1
1 159 . 8 1 1 A 18 18 SER CB C 18 68.788 66.502 2.286 1
1 160 . 8 1 1 A 18 18 SER N N 18 118.846 116.001 2.845 1
1 161 . 8 1 1 A 19 19 ASN H H 19 9.053 8.870 0.183 1
1 162 . 8 1 1 A 19 19 ASN HA H 19 4.473 5.035 -0.562 1
1 167 . 8 1 1 A 19 19 ASN C C 19 175.396 175.724 -0.328 1
1 168 . 8 1 1 A 19 19 ASN CA C 19 55.373 52.638 2.735 1
1 169 . 8 1 1 A 19 19 ASN CB C 19 36.900 38.157 -1.257 1
1 170 . 8 1 1 A 19 19 ASN N N 19 113.712 117.704 -3.992 1
1 172 . 8 1 1 A 20 20 LYS H H 20 7.677 8.356 -0.679 1
1 173 . 8 1 1 A 20 20 LYS HA H 20 4.413 4.688 -0.275 1
1 182 . 8 1 1 A 20 20 LYS C C 20 176.078 177.353 -1.275 1
1 183 . 8 1 1 A 20 20 LYS CA C 20 55.679 57.524 -1.845 1
1 184 . 8 1 1 A 20 20 LYS CB C 20 33.023 35.645 -2.622 1
1 188 . 8 1 1 A 20 20 LYS N N 20 117.213 119.511 -2.298 1
1 189 . 8 1 1 A 21 21 ASP H H 21 7.395 7.420 -0.025 1
1 190 . 8 1 1 A 21 21 ASP HA H 21 4.808 4.776 0.032 1
1 193 . 8 1 1 A 21 21 ASP C C 21 176.413 175.879 0.534 1
1 194 . 8 1 1 A 21 21 ASP CA C 21 53.983 53.664 0.319 1
1 195 . 8 1 1 A 21 21 ASP CB C 21 41.199 41.946 -0.747 1
1 196 . 8 1 1 A 21 21 ASP N N 21 119.879 116.454 3.425 1
1 197 . 8 1 1 A 22 22 THR H H 22 8.593 8.130 0.463 1
1 198 . 8 1 1 A 22 22 THR HA H 22 4.352 4.346 0.006 1
1 203 . 8 1 1 A 22 22 THR C C 22 172.913 173.742 -0.829 1
1 204 . 8 1 1 A 22 22 THR CA C 22 62.691 62.947 -0.256 1
1 205 . 8 1 1 A 22 22 THR CB C 22 68.332 66.632 1.700 1
1 207 . 8 1 1 A 22 22 THR N N 22 116.299 112.463 3.836 1
1 208 . 8 1 1 A 23 23 LEU H H 23 7.645 8.051 -0.406 1
1 209 . 8 1 1 A 23 23 LEU HA H 23 4.318 4.339 -0.021 1
1 219 . 8 1 1 A 23 23 LEU C C 23 176.692 175.620 1.072 1
1 220 . 8 1 1 A 23 23 LEU CA C 23 54.617 54.223 0.394 1
1 221 . 8 1 1 A 23 23 LEU CB C 23 41.939 40.127 1.812 1
1 225 . 8 1 1 A 23 23 LEU N N 23 123.606 122.084 1.522 1
1 226 . 8 1 1 A 24 24 ARG H H 24 8.563 7.922 0.641 1
1 227 . 8 1 1 A 24 24 ARG HA H 24 4.373 4.628 -0.255 1
1 235 . 8 1 1 A 24 24 ARG C C 24 176.584 175.649 0.935 1
1 236 . 8 1 1 A 24 24 ARG CA C 24 57.854 56.007 1.847 1
1 237 . 8 1 1 A 24 24 ARG CB C 24 31.126 29.647 1.479 1
1 240 . 8 1 1 A 24 24 ARG N N 24 127.152 124.531 2.621 1
1 242 . 8 1 1 A 25 25 LYS H H 25 8.633 8.366 0.267 1
1 243 . 8 1 1 A 25 25 LYS HA H 25 4.513 4.963 -0.450 1
1 251 . 8 1 1 A 25 25 LYS C C 25 173.567 174.559 -0.992 1
1 252 . 8 1 1 A 25 25 LYS CA C 25 54.792 54.632 0.160 1
1 253 . 8 1 1 A 25 25 LYS CB C 25 37.416 35.112 2.304 1
1 257 . 8 1 1 A 25 25 LYS N N 25 122.682 120.914 1.768 1
1 258 . 8 1 1 A 26 26 ARG H H 26 8.303 8.882 -0.579 1
1 259 . 8 1 1 A 26 26 ARG HA H 26 5.153 5.099 0.054 1
1 266 . 8 1 1 A 26 26 ARG C C 26 174.554 175.410 -0.856 1
1 267 . 8 1 1 A 26 26 ARG CA C 26 55.083 54.882 0.201 1
1 268 . 8 1 1 A 26 26 ARG CB C 26 32.789 31.543 1.246 1
1 271 . 8 1 1 A 26 26 ARG N N 26 121.819 124.602 -2.783 1
1 272 . 8 1 1 A 27 27 HIS H H 27 8.793 9.318 -0.525 1
1 273 . 8 1 1 A 27 27 HIS HA H 27 5.155 5.582 -0.427 1
1 278 . 8 1 1 A 27 27 HIS CA C 27 56.904 54.768 2.136 1
1 279 . 8 1 1 A 27 27 HIS CB C 27 34.683 32.244 2.439 1
1 282 . 8 1 1 A 27 27 HIS N N 27 122.102 120.676 1.426 1
1 283 . 8 1 1 A 28 28 TYR H H 28 9.273 8.301 0.972 1
1 284 . 8 1 1 A 28 28 TYR HA H 28 4.332 4.255 0.077 1
1 291 . 8 1 1 A 28 28 TYR C C 28 174.730 175.086 -0.356 1
1 292 . 8 1 1 A 28 28 TYR CA C 28 58.680 57.552 1.128 1
1 293 . 8 1 1 A 28 28 TYR CB C 28 38.673 37.910 0.763 1
1 298 . 8 1 1 A 28 28 TYR N N 28 125.605 121.281 4.324 1
1 299 . 8 1 1 A 29 29 TRP H H 29 9.273 9.079 0.194 1
1 300 . 8 1 1 A 29 29 TRP HA H 29 5.543 4.879 0.664 1
1 309 . 8 1 1 A 29 29 TRP C C 29 176.172 176.684 -0.512 1
1 310 . 8 1 1 A 29 29 TRP CA C 29 56.658 57.175 -0.517 1
1 311 . 8 1 1 A 29 29 TRP CB C 29 32.154 30.797 1.357 1
1 317 . 8 1 1 A 29 29 TRP N N 29 131.340 128.306 3.034 1
1 318 . 8 1 1 A 30 30 ARG H H 30 9.164 8.983 0.181 1
1 319 . 8 1 1 A 30 30 ARG HA H 30 5.302 5.300 0.002 1
1 327 . 8 1 1 A 30 30 ARG C C 30 174.774 174.322 0.452 1
1 328 . 8 1 1 A 30 30 ARG CA C 30 56.271 54.868 1.403 1
1 329 . 8 1 1 A 30 30 ARG CB C 30 34.203 33.305 0.898 1
1 332 . 8 1 1 A 30 30 ARG N N 30 116.040 121.500 -5.460 1
1 334 . 8 1 1 A 31 31 LEU H H 31 9.273 9.614 -0.341 1
1 335 . 8 1 1 A 31 31 LEU HA H 31 5.324 5.398 -0.074 1
1 345 . 8 1 1 A 31 31 LEU C C 31 174.488 174.457 0.031 1
1 346 . 8 1 1 A 31 31 LEU CA C 31 53.807 53.461 0.346 1
1 347 . 8 1 1 A 31 31 LEU CB C 31 46.667 45.706 0.961 1
1 351 . 8 1 1 A 31 31 LEU N N 31 127.075 127.004 0.071 1
1 352 . 8 1 1 A 32 32 ASP H H 32 8.854 8.943 -0.089 1
1 353 . 8 1 1 A 32 32 ASP HA H 32 4.902 5.074 -0.172 1
1 356 . 8 1 1 A 32 32 ASP C C 32 173.474 176.853 -3.379 1
1 357 . 8 1 1 A 32 32 ASP CA C 32 53.104 52.233 0.871 1
1 358 . 8 1 1 A 32 32 ASP CB C 32 42.931 44.060 -1.129 1
1 359 . 8 1 1 A 32 32 ASP N N 32 129.349 125.695 3.654 1
1 360 . 8 1 1 A 33 33 CYS H H 33 8.153 8.752 -0.599 1
1 361 . 8 1 1 A 33 33 CYS HA H 33 4.323 4.532 -0.209 1
1 364 . 8 1 1 A 33 33 CYS C C 33 174.476 175.631 -1.155 1
1 365 . 8 1 1 A 33 33 CYS CA C 33 59.853 59.576 0.277 1
1 366 . 8 1 1 A 33 33 CYS CB C 33 27.508 27.816 -0.308 1
1 367 . 8 1 1 A 33 33 CYS N N 33 108.439 119.543 -11.104 1
1 368 . 8 1 1 A 34 34 LYS H H 34 9.144 7.735 1.409 1
1 369 . 8 1 1 A 34 34 LYS HA H 34 4.616 4.447 0.169 1
1 378 . 8 1 1 A 34 34 LYS C C 34 177.601 176.070 1.531 1
1 379 . 8 1 1 A 34 34 LYS CA C 34 57.185 56.835 0.350 1
1 380 . 8 1 1 A 34 34 LYS CB C 34 35.623 35.316 0.307 1
1 384 . 8 1 1 A 34 34 LYS N N 34 119.884 119.627 0.257 1
1 385 . 8 1 1 A 35 35 CYS H H 35 9.102 7.631 1.471 1
1 386 . 8 1 1 A 35 35 CYS HA H 35 4.935 4.771 0.164 1
1 389 . 8 1 1 A 35 35 CYS C C 35 172.283 172.462 -0.179 1
1 390 . 8 1 1 A 35 35 CYS CA C 35 57.748 58.069 -0.321 1
1 391 . 8 1 1 A 35 35 CYS CB C 35 31.537 32.266 -0.729 1
1 392 . 8 1 1 A 35 35 CYS N N 35 120.317 114.629 5.688 1
1 393 . 8 1 1 A 36 36 ILE H H 36 8.213 8.670 -0.457 1
1 394 . 8 1 1 A 36 36 ILE HA H 36 4.617 4.772 -0.155 1
1 404 . 8 1 1 A 36 36 ILE C C 36 175.312 175.022 0.290 1
1 405 . 8 1 1 A 36 36 ILE CA C 36 60.967 60.341 0.626 1
1 406 . 8 1 1 A 36 36 ILE CB C 36 39.718 38.923 0.795 1
1 410 . 8 1 1 A 36 36 ILE N N 36 121.905 121.720 0.185 1
1 411 . 8 1 1 A 37 37 THR H H 37 9.076 8.623 0.453 1
1 412 . 8 1 1 A 37 37 THR HA H 37 4.364 4.385 -0.021 1
1 417 . 8 1 1 A 37 37 THR CA C 37 61.834 62.476 -0.642 1
1 418 . 8 1 1 A 37 37 THR CB C 37 69.237 69.904 -0.667 1
1 420 . 8 1 1 A 37 37 THR N N 37 122.500 123.476 -0.976 1
1 421 . 8 1 1 A 38 38 LEU H H 38 8.263 8.029 0.234 1
1 422 . 8 1 1 A 38 38 LEU HA H 38 4.445 5.012 -0.567 1
1 432 . 8 1 1 A 38 38 LEU CA C 38 55.611 53.675 1.936 1
1 433 . 8 1 1 A 38 38 LEU CB C 38 42.702 44.370 -1.668 1
1 437 . 8 1 1 A 38 38 LEU N N 38 126.987 125.221 1.766 1
1 438 . 8 1 1 A 39 39 PHE H H 39 9.520 8.776 0.744 1
1 439 . 8 1 1 A 39 39 PHE HA H 39 4.998 5.072 -0.074 1
1 447 . 8 1 1 A 39 39 PHE CA C 39 57.331 56.254 1.077 1
1 448 . 8 1 1 A 39 39 PHE CB C 39 42.453 40.287 2.166 1
1 454 . 8 1 1 A 39 39 PHE N N 39 120.545 121.676 -1.131 1
1 455 . 8 1 1 A 40 40 GLN H H 40 9.878 9.112 0.766 1
1 456 . 8 1 1 A 40 40 GLN HA H 40 4.376 4.333 0.043 1
1 463 . 8 1 1 A 40 40 GLN CA C 40 59.513 58.908 0.605 1
1 464 . 8 1 1 A 40 40 GLN CB C 40 29.317 28.819 0.498 1
1 467 . 8 1 1 A 41 41 ASN H H 41 7.732 7.868 -0.136 1
1 468 . 8 1 1 A 41 41 ASN HA H 41 4.812 5.213 -0.401 1
1 473 . 8 1 1 A 41 41 ASN CA C 41 52.618 51.770 0.848 1
1 474 . 8 1 1 A 41 41 ASN CB C 41 39.362 41.447 -2.085 1
1 475 . 8 1 1 A 41 41 ASN N N 41 107.613 112.188 -4.575 1
1 477 . 8 1 1 A 42 42 ASN HA H 42 3.476 3.935 -0.459 1
1 482 . 8 1 1 A 42 42 ASN C C 42 173.607 175.896 -2.289 1
1 483 . 8 1 1 A 42 42 ASN CA C 42 54.888 55.054 -0.166 1
1 484 . 8 1 1 A 42 42 ASN CB C 42 35.613 37.950 -2.337 1
1 486 . 8 1 1 A 43 43 THR H H 43 8.394 7.563 0.831 1
1 487 . 8 1 1 A 43 43 THR HA H 43 4.403 4.713 -0.310 1
1 492 . 8 1 1 A 43 43 THR C C 43 174.464 173.681 0.783 1
1 493 . 8 1 1 A 43 43 THR CA C 43 61.978 60.455 1.523 1
1 494 . 8 1 1 A 43 43 THR CB C 43 70.036 68.782 1.254 1
1 496 . 8 1 1 A 43 43 THR N N 43 111.795 105.158 6.637 1
1 497 . 8 1 1 A 44 44 THR H H 44 8.058 7.734 0.324 1
1 498 . 8 1 1 A 44 44 THR HA H 44 4.464 4.776 -0.312 1
1 503 . 8 1 1 A 44 44 THR CA C 44 61.599 59.901 1.698 1
1 504 . 8 1 1 A 44 44 THR CB C 44 69.137 70.580 -1.443 1
1 506 . 8 1 1 A 44 44 THR N N 44 116.514 116.254 0.260 1
1 507 . 8 1 1 A 45 45 ASN H H 45 6.653 8.925 -2.272 1
1 508 . 8 1 1 A 45 45 ASN HA H 45 4.945 4.463 0.482 1
1 513 . 8 1 1 A 45 45 ASN CA C 45 53.227 56.601 -3.374 1
1 514 . 8 1 1 A 45 45 ASN CB C 45 38.483 38.983 -0.500 1
1 516 . 8 1 1 A 46 46 ARG H H 46 8.213 7.875 0.338 1
1 517 . 8 1 1 A 46 46 ARG HA H 46 4.583 4.733 -0.150 1
1 524 . 8 1 1 A 46 46 ARG CA C 46 55.487 54.084 1.403 1
1 525 . 8 1 1 A 46 46 ARG CB C 46 31.153 34.939 -3.786 1
1 528 . 8 1 1 A 46 46 ARG N N 46 121.652 116.068 5.584 1
1 529 . 8 1 1 A 47 47 TYR H H 47 7.973 8.842 -0.869 1
1 536 . 8 1 1 A 47 47 TYR CB C 47 39.356 39.709 -0.353 1
1 541 . 8 1 1 A 48 48 TYR H H 48 9.023 8.951 0.072 1
1 542 . 8 1 1 A 48 48 TYR HA H 48 4.662 4.622 0.040 1
1 549 . 8 1 1 A 48 48 TYR CB C 48 39.863 39.958 -0.095 1
1 554 . 8 1 1 A 48 48 TYR N N 48 121.223 119.306 1.917 1
1 555 . 8 1 1 A 49 49 LYS H H 49 7.134 7.228 -0.094 1
1 556 . 8 1 1 A 49 49 LYS HA H 49 4.283 4.581 -0.298 1
1 565 . 8 1 1 A 49 49 LYS CA C 49 55.167 54.739 0.428 1
1 566 . 8 1 1 A 49 49 LYS CB C 49 36.699 35.328 1.371 1
1 570 . 8 1 1 A 49 49 LYS N N 49 117.339 116.127 1.212 1
1 571 . 8 1 1 A 50 50 GLU H H 50 8.411 8.917 -0.506 1
1 572 . 8 1 1 A 50 50 GLU HA H 50 4.583 4.887 -0.304 1
1 577 . 8 1 1 A 50 50 GLU CA C 50 54.592 54.607 -0.015 1
1 578 . 8 1 1 A 50 50 GLU CB C 50 33.263 33.289 -0.026 1
1 580 . 8 1 1 A 50 50 GLU N N 50 123.825 119.783 4.042 1
1 581 . 8 1 1 A 51 51 ILE H H 51 9.225 8.972 0.253 1
1 582 . 8 1 1 A 51 51 ILE HA H 51 4.277 4.619 -0.342 1
1 592 . 8 1 1 A 51 51 ILE CA C 51 58.182 58.173 0.009 1
1 593 . 8 1 1 A 51 51 ILE CB C 51 39.663 38.271 1.392 1
1 597 . 8 1 1 A 51 51 ILE N N 51 125.271 126.564 -1.293 1
1 598 . 8 1 1 A 52 52 PRO HA H 52 4.543 4.892 -0.349 1
1 605 . 8 1 1 A 52 52 PRO C C 52 178.340 178.140 0.200 1
1 606 . 8 1 1 A 52 52 PRO CA C 52 62.726 62.882 -0.156 1
1 607 . 8 1 1 A 52 52 PRO CB C 52 32.003 31.733 0.270 1
1 610 . 8 1 1 A 53 53 LEU H H 53 8.723 8.508 0.215 1
1 611 . 8 1 1 A 53 53 LEU HA H 53 3.891 3.883 0.008 1
1 621 . 8 1 1 A 53 53 LEU C C 53 179.673 178.938 0.735 1
1 622 . 8 1 1 A 53 53 LEU CA C 53 58.205 57.544 0.661 1
1 623 . 8 1 1 A 53 53 LEU CB C 53 40.171 41.425 -1.254 1
1 627 . 8 1 1 A 53 53 LEU N N 53 125.150 124.274 0.876 1
1 628 . 8 1 1 A 54 54 SER H H 54 8.360 8.077 0.283 1
1 629 . 8 1 1 A 54 54 SER HA H 54 4.164 4.111 0.053 1
1 632 . 8 1 1 A 54 54 SER C C 54 175.517 177.348 -1.831 1
1 633 . 8 1 1 A 54 54 SER CA C 54 60.193 61.397 -1.204 1
1 634 . 8 1 1 A 54 54 SER CB C 54 62.617 62.777 -0.160 1
1 635 . 8 1 1 A 54 54 SER N N 54 111.266 114.478 -3.212 1
1 636 . 8 1 1 A 55 55 GLU H H 55 7.666 8.024 -0.358 1
1 637 . 8 1 1 A 55 55 GLU HA H 55 4.363 4.086 0.277 1
1 642 . 8 1 1 A 55 55 GLU C C 55 176.753 177.819 -1.066 1
1 643 . 8 1 1 A 55 55 GLU CA C 55 56.200 59.038 -2.838 1
1 644 . 8 1 1 A 55 55 GLU CB C 55 30.526 29.179 1.347 1
1 646 . 8 1 1 A 55 55 GLU N N 55 119.485 120.085 -0.600 1
1 647 . 8 1 1 A 56 56 ILE H H 56 7.601 7.159 0.442 1
1 648 . 8 1 1 A 56 56 ILE HA H 56 3.793 3.921 -0.128 1
1 658 . 8 1 1 A 56 56 ILE C C 56 175.142 175.962 -0.820 1
1 659 . 8 1 1 A 56 56 ILE CA C 56 63.518 62.336 1.182 1
1 660 . 8 1 1 A 56 56 ILE CB C 56 37.169 38.064 -0.895 1
1 664 . 8 1 1 A 56 56 ILE N N 56 120.430 120.077 0.353 1
1 665 . 8 1 1 A 57 57 LEU H H 57 9.263 9.236 0.027 1
1 666 . 8 1 1 A 57 57 LEU HA H 57 4.343 4.393 -0.050 1
1 676 . 8 1 1 A 57 57 LEU C C 57 177.898 176.518 1.380 1
1 677 . 8 1 1 A 57 57 LEU CA C 57 56.569 55.932 0.637 1
1 678 . 8 1 1 A 57 57 LEU CB C 57 41.980 42.482 -0.502 1
1 682 . 8 1 1 A 57 57 LEU N N 57 129.464 129.118 0.346 1
1 683 . 8 1 1 A 58 58 THR H H 58 7.414 7.331 0.083 1
1 684 . 8 1 1 A 58 58 THR HA H 58 4.512 4.844 -0.332 1
1 689 . 8 1 1 A 58 58 THR C C 58 171.314 172.726 -1.412 1
1 690 . 8 1 1 A 58 58 THR CA C 58 60.562 61.233 -0.671 1
1 691 . 8 1 1 A 58 58 THR CB C 58 70.803 73.533 -2.730 1
1 693 . 8 1 1 A 58 58 THR N N 58 109.129 110.700 -1.571 1
1 694 . 8 1 1 A 59 59 VAL H H 59 8.152 8.515 -0.363 1
1 695 . 8 1 1 A 59 59 VAL HA H 59 5.061 5.044 0.017 1
1 703 . 8 1 1 A 59 59 VAL C C 59 174.985 174.987 -0.002 1
1 704 . 8 1 1 A 59 59 VAL CA C 59 61.354 61.204 0.150 1
1 705 . 8 1 1 A 59 59 VAL CB C 59 33.855 33.787 0.068 1
1 708 . 8 1 1 A 59 59 VAL N N 59 123.676 124.807 -1.131 1
1 709 . 8 1 1 A 60 60 GLU H H 60 9.074 8.773 0.301 1
1 710 . 8 1 1 A 60 60 GLU HA H 60 4.977 4.876 0.101 1
1 715 . 8 1 1 A 60 60 GLU C C 60 176.063 175.541 0.522 1
1 716 . 8 1 1 A 60 60 GLU CA C 60 53.807 54.395 -0.588 1
1 717 . 8 1 1 A 60 60 GLU CB C 60 33.739 33.624 0.115 1
1 719 . 8 1 1 A 60 60 GLU N N 60 125.125 125.952 -0.827 1
1 720 . 8 1 1 A 61 61 SER H H 61 8.763 8.590 0.173 1
1 721 . 8 1 1 A 61 61 SER HA H 61 4.452 4.909 -0.457 1
1 724 . 8 1 1 A 61 61 SER C C 61 173.288 174.626 -1.338 1
1 725 . 8 1 1 A 61 61 SER CA C 61 59.384 57.175 2.209 1
1 726 . 8 1 1 A 61 61 SER CB C 61 63.390 65.162 -1.772 1
1 727 . 8 1 1 A 61 61 SER N N 61 117.523 114.990 2.533 1
1 728 . 8 1 1 A 62 62 ALA H H 62 7.293 8.761 -1.468 1
1 729 . 8 1 1 A 62 62 ALA HA H 62 3.817 4.581 -0.764 1
1 733 . 8 1 1 A 62 62 ALA C C 62 176.717 178.140 -1.423 1
1 734 . 8 1 1 A 62 62 ALA CA C 62 53.966 53.217 0.749 1
1 735 . 8 1 1 A 62 62 ALA CB C 62 18.640 18.729 -0.089 1
1 736 . 8 1 1 A 62 62 ALA N N 62 122.650 125.533 -2.883 1
1 737 . 8 1 1 A 63 63 GLN H H 63 8.736 8.574 0.162 1
1 738 . 8 1 1 A 63 63 GLN HA H 63 4.445 4.497 -0.052 1
1 745 . 8 1 1 A 63 63 GLN C C 63 173.700 174.761 -1.061 1
1 746 . 8 1 1 A 63 63 GLN CA C 63 56.376 55.568 0.808 1
1 747 . 8 1 1 A 63 63 GLN CB C 63 31.515 30.943 0.572 1
1 749 . 8 1 1 A 63 63 GLN N N 63 120.251 119.442 0.809 1
1 751 . 8 1 1 A 64 64 ASN H H 64 9.272 7.115 2.157 1
1 752 . 8 1 1 A 64 64 ASN HA H 64 4.906 4.892 0.014 1
1 757 . 8 1 1 A 64 64 ASN C C 64 174.754 175.043 -0.289 1
1 758 . 8 1 1 A 64 64 ASN CA C 64 51.837 52.188 -0.351 1
1 759 . 8 1 1 A 64 64 ASN CB C 64 38.156 39.718 -1.562 1
1 760 . 8 1 1 A 64 64 ASN N N 64 122.346 118.843 3.503 1
1 762 . 8 1 1 A 65 65 PHE H H 65 8.854 8.840 0.014 1
1 763 . 8 1 1 A 65 65 PHE HA H 65 4.947 5.099 -0.152 1
1 771 . 8 1 1 A 65 65 PHE C C 65 177.274 176.322 0.952 1
1 772 . 8 1 1 A 65 65 PHE CA C 65 57.519 57.083 0.436 1
1 773 . 8 1 1 A 65 65 PHE CB C 65 38.485 38.643 -0.158 1
1 779 . 8 1 1 A 65 65 PHE N N 65 123.638 125.468 -1.830 1
1 780 . 8 1 1 A 66 66 SER H H 66 8.163 7.788 0.375 1
1 781 . 8 1 1 A 66 66 SER HA H 66 4.393 4.413 -0.020 1
1 784 . 8 1 1 A 66 66 SER C C 66 175.699 177.250 -1.551 1
1 785 . 8 1 1 A 66 66 SER CA C 66 60.791 61.020 -0.229 1
1 786 . 8 1 1 A 66 66 SER CB C 66 64.591 63.172 1.419 1
1 787 . 8 1 1 A 66 66 SER N N 66 113.913 115.852 -1.939 1
1 788 . 8 1 1 A 67 67 LEU H H 67 8.574 7.792 0.782 1
1 789 . 8 1 1 A 67 67 LEU HA H 67 4.302 3.745 0.557 1
1 799 . 8 1 1 A 67 67 LEU C C 67 176.269 177.302 -1.033 1
1 800 . 8 1 1 A 67 67 LEU CA C 67 55.601 58.215 -2.614 1
1 801 . 8 1 1 A 67 67 LEU CB C 67 42.021 41.880 0.141 1
1 805 . 8 1 1 A 67 67 LEU N N 67 121.264 120.901 0.363 1
1 806 . 8 1 1 A 68 68 VAL H H 68 6.921 7.558 -0.637 1
1 807 . 8 1 1 A 68 68 VAL HA H 68 4.473 4.121 0.352 1
1 815 . 8 1 1 A 68 68 VAL C C 68 173.809 174.910 -1.101 1
1 816 . 8 1 1 A 68 68 VAL CA C 68 58.047 60.598 -2.551 1
1 817 . 8 1 1 A 68 68 VAL CB C 68 32.295 31.938 0.357 1
1 820 . 8 1 1 A 68 68 VAL N N 68 111.287 115.080 -3.793 1
1 821 . 8 1 1 A 69 69 PRO HA H 69 4.658 4.613 0.045 1
1 828 . 8 1 1 A 69 69 PRO CA C 69 61.747 61.600 0.147 1
1 829 . 8 1 1 A 69 69 PRO CB C 69 30.693 32.482 -1.789 1
1 832 . 8 1 1 A 70 70 PRO HA H 70 4.414 4.356 0.058 1
1 839 . 8 1 1 A 70 70 PRO CA C 70 63.997 64.557 -0.560 1
1 840 . 8 1 1 A 70 70 PRO CB C 70 31.602 31.742 -0.140 1
1 843 . 8 1 1 A 71 71 GLY H H 71 8.824 8.466 0.358 1
1 844 . 8 1 1 A 71 71 GLY HA2 H 71 3.703 3.916 -0.213 1
1 845 . 8 1 1 A 71 71 GLY HA3 H 71 4.193 3.919 0.274 1
1 846 . 8 1 1 A 71 71 GLY C C 71 174.052 174.011 0.041 1
1 847 . 8 1 1 A 71 71 GLY CA C 71 45.065 45.538 -0.473 1
1 848 . 8 1 1 A 71 71 GLY N N 71 111.845 106.412 5.433 1
1 849 . 8 1 1 A 72 72 THR H H 72 7.597 7.215 0.382 1
1 850 . 8 1 1 A 72 72 THR HA H 72 4.133 4.230 -0.097 1
1 855 . 8 1 1 A 72 72 THR CA C 72 63.129 62.636 0.493 1
1 856 . 8 1 1 A 72 72 THR CB C 72 69.560 69.128 0.432 1
1 858 . 8 1 1 A 72 72 THR N N 72 117.485 115.145 2.340 1
1 859 . 8 1 1 A 73 73 ASN H H 73 9.280 8.526 0.754 1
1 860 . 8 1 1 A 73 73 ASN HA H 73 4.786 4.537 0.249 1
1 865 . 8 1 1 A 73 73 ASN CA C 73 52.009 52.256 -0.247 1
1 866 . 8 1 1 A 73 73 ASN CB C 73 37.553 38.431 -0.878 1
1 867 . 8 1 1 A 73 73 ASN N N 73 127.641 125.852 1.789 1
1 869 . 8 1 1 A 74 74 PRO HA H 74 4.752 4.679 0.073 1
1 876 . 8 1 1 A 74 74 PRO C C 74 175.190 176.367 -1.177 1
1 877 . 8 1 1 A 74 74 PRO CA C 74 63.395 62.345 1.050 1
1 878 . 8 1 1 A 74 74 PRO CB C 74 33.164 32.634 0.530 1
1 881 . 8 1 1 A 75 75 HIS H H 75 8.025 8.817 -0.792 1
1 882 . 8 1 1 A 75 75 HIS HA H 75 5.047 5.131 -0.084 1
1 887 . 8 1 1 A 75 75 HIS C C 75 172.562 175.684 -3.122 1
1 888 . 8 1 1 A 75 75 HIS CA C 75 54.336 53.576 0.760 1
1 889 . 8 1 1 A 75 75 HIS CB C 75 30.956 33.359 -2.403 1
1 892 . 8 1 1 A 75 75 HIS N N 75 116.198 116.942 -0.744 1
1 893 . 8 1 1 A 76 76 CYS H H 76 8.343 9.437 -1.094 1
1 894 . 8 1 1 A 76 76 CYS HA H 76 4.594 4.458 0.136 1
1 897 . 8 1 1 A 76 76 CYS C C 76 175.651 174.825 0.826 1
1 898 . 8 1 1 A 76 76 CYS CA C 76 61.066 61.211 -0.145 1
1 899 . 8 1 1 A 76 76 CYS CB C 76 30.193 28.857 1.336 1
1 900 . 8 1 1 A 76 76 CYS N N 76 113.289 118.049 -4.760 1
1 901 . 8 1 1 A 77 77 PHE H H 77 8.433 7.798 0.635 1
1 902 . 8 1 1 A 77 77 PHE HA H 77 5.105 5.391 -0.286 1
1 910 . 8 1 1 A 77 77 PHE C C 77 171.822 173.100 -1.278 1
1 911 . 8 1 1 A 77 77 PHE CA C 77 56.874 55.779 1.095 1
1 912 . 8 1 1 A 77 77 PHE CB C 77 39.393 43.000 -3.607 1
1 918 . 8 1 1 A 77 77 PHE N N 77 114.874 114.642 0.232 1
1 919 . 8 1 1 A 78 78 GLU H H 78 9.823 9.242 0.581 1
1 920 . 8 1 1 A 78 78 GLU HA H 78 5.333 5.187 0.146 1
1 925 . 8 1 1 A 78 78 GLU C C 78 175.602 175.512 0.090 1
1 926 . 8 1 1 A 78 78 GLU CA C 78 54.212 55.111 -0.899 1
1 927 . 8 1 1 A 78 78 GLU CB C 78 31.702 32.374 -0.672 1
1 929 . 8 1 1 A 78 78 GLU N N 78 121.074 119.112 1.962 1
1 930 . 8 1 1 A 79 79 ILE H H 79 9.093 9.129 -0.036 1
1 931 . 8 1 1 A 79 79 ILE HA H 79 4.637 4.617 0.020 1
1 941 . 8 1 1 A 79 79 ILE C C 79 174.476 175.170 -0.694 1
1 942 . 8 1 1 A 79 79 ILE CA C 79 60.932 60.795 0.137 1
1 943 . 8 1 1 A 79 79 ILE CB C 79 40.803 37.235 3.568 1
1 947 . 8 1 1 A 79 79 ILE N N 79 121.382 125.646 -4.264 1
1 948 . 8 1 1 A 80 80 VAL H H 80 8.841 7.877 0.964 1
1 949 . 8 1 1 A 80 80 VAL HA H 80 4.425 3.853 0.572 1
1 957 . 8 1 1 A 80 80 VAL C C 80 175.930 175.360 0.570 1
1 958 . 8 1 1 A 80 80 VAL CA C 80 63.324 63.143 0.181 1
1 959 . 8 1 1 A 80 80 VAL CB C 80 32.783 31.210 1.573 1
1 962 . 8 1 1 A 80 80 VAL N N 80 128.970 127.117 1.853 1
1 963 . 8 1 1 A 81 81 THR H H 81 8.303 7.910 0.393 1
1 964 . 8 1 1 A 81 81 THR HA H 81 5.264 4.607 0.657 1
1 969 . 8 1 1 A 81 81 THR C C 81 173.664 174.690 -1.026 1
1 970 . 8 1 1 A 81 81 THR CA C 81 59.540 60.058 -0.518 1
1 971 . 8 1 1 A 81 81 THR CB C 81 72.197 71.551 0.646 1
1 973 . 8 1 1 A 81 81 THR N N 81 118.077 118.709 -0.632 1
1 974 . 8 1 1 A 82 82 ALA H H 82 9.586 8.476 1.110 1
1 975 . 8 1 1 A 82 82 ALA HA H 82 4.093 4.352 -0.259 1
1 979 . 8 1 1 A 82 82 ALA C C 82 178.667 177.678 0.989 1
1 980 . 8 1 1 A 82 82 ALA CA C 82 55.321 52.853 2.468 1
1 981 . 8 1 1 A 82 82 ALA CB C 82 18.094 18.142 -0.048 1
1 982 . 8 1 1 A 82 82 ALA N N 82 122.493 123.769 -1.276 1
1 983 . 8 1 1 A 83 83 ASN H H 83 7.923 8.445 -0.522 1
1 984 . 8 1 1 A 83 83 ASN HA H 83 4.808 5.101 -0.293 1
1 989 . 8 1 1 A 83 83 ASN C C 83 174.766 174.506 0.260 1
1 990 . 8 1 1 A 83 83 ASN CA C 83 53.333 54.637 -1.304 1
1 991 . 8 1 1 A 83 83 ASN CB C 83 40.335 41.827 -1.492 1
1 992 . 8 1 1 A 83 83 ASN N N 83 110.765 116.042 -5.277 1
1 994 . 8 1 1 A 84 84 ALA H H 84 7.352 7.156 0.196 1
1 995 . 8 1 1 A 84 84 ALA HA H 84 4.625 4.481 0.144 1
1 999 . 8 1 1 A 84 84 ALA C C 84 176.547 174.943 1.604 1
1 1000 . 8 1 1 A 84 84 ALA CA C 84 52.858 51.827 1.031 1
1 1001 . 8 1 1 A 84 84 ALA CB C 84 21.233 21.911 -0.678 1
1 1002 . 8 1 1 A 84 84 ALA N N 84 119.599 117.692 1.907 1
1 1003 . 8 1 1 A 85 85 THR H H 85 8.374 8.698 -0.324 1
1 1004 . 8 1 1 A 85 85 THR HA H 85 5.014 4.524 0.490 1
1 1009 . 8 1 1 A 85 85 THR C C 85 171.568 173.805 -2.237 1
1 1010 . 8 1 1 A 85 85 THR CA C 85 61.618 62.005 -0.387 1
1 1011 . 8 1 1 A 85 85 THR CB C 85 70.850 69.382 1.468 1
1 1013 . 8 1 1 A 85 85 THR N N 85 119.032 113.492 5.540 1
1 1014 . 8 1 1 A 86 86 TYR H H 86 9.006 8.922 0.084 1
1 1015 . 8 1 1 A 86 86 TYR HA H 86 4.658 4.715 -0.057 1
1 1022 . 8 1 1 A 86 86 TYR C C 86 173.773 175.278 -1.505 1
1 1023 . 8 1 1 A 86 86 TYR CA C 86 56.938 57.813 -0.875 1
1 1024 . 8 1 1 A 86 86 TYR CB C 86 39.513 39.920 -0.407 1
1 1029 . 8 1 1 A 86 86 TYR N N 86 123.494 127.016 -3.522 1
1 1030 . 8 1 1 A 87 87 PHE H H 87 9.263 8.642 0.621 1
1 1031 . 8 1 1 A 87 87 PHE HA H 87 4.127 4.659 -0.532 1
1 1039 . 8 1 1 A 87 87 PHE C C 87 176.369 174.177 2.192 1
1 1040 . 8 1 1 A 87 87 PHE CA C 87 57.238 55.535 1.703 1
1 1041 . 8 1 1 A 87 87 PHE CB C 87 37.086 38.276 -1.190 1
1 1047 . 8 1 1 A 87 87 PHE N N 87 125.384 119.922 5.462 1
1 1048 . 8 1 1 A 88 88 VAL H H 88 9.023 8.300 0.723 1
1 1049 . 8 1 1 A 88 88 VAL HA H 88 4.162 4.575 -0.413 1
1 1057 . 8 1 1 A 88 88 VAL C C 88 176.390 175.763 0.627 1
1 1058 . 8 1 1 A 88 88 VAL CA C 88 63.975 60.658 3.317 1
1 1059 . 8 1 1 A 88 88 VAL CB C 88 32.378 31.496 0.882 1
1 1062 . 8 1 1 A 88 88 VAL N N 88 127.348 124.266 3.082 1
1 1063 . 8 1 1 A 89 89 GLY H H 89 9.233 8.080 1.153 1
1 1064 . 8 1 1 A 89 89 GLY HA2 H 89 4.293 4.188 0.105 1
1 1065 . 8 1 1 A 89 89 GLY HA3 H 89 4.186 4.270 -0.084 1
1 1066 . 8 1 1 A 89 89 GLY C C 89 172.378 172.298 0.080 1
1 1067 . 8 1 1 A 89 89 GLY CA C 89 43.798 46.295 -2.497 1
1 1068 . 8 1 1 A 89 89 GLY N N 89 116.041 113.131 2.910 1
1 1069 . 8 1 1 A 90 90 GLU H H 90 8.532 8.818 -0.286 1
1 1070 . 8 1 1 A 90 90 GLU HA H 90 4.794 5.055 -0.261 1
1 1075 . 8 1 1 A 90 90 GLU C C 90 174.221 174.911 -0.690 1
1 1076 . 8 1 1 A 90 90 GLU CA C 90 56.393 54.722 1.671 1
1 1077 . 8 1 1 A 90 90 GLU CB C 90 33.182 32.962 0.220 1
1 1079 . 8 1 1 A 90 90 GLU N N 90 120.905 121.058 -0.153 1
1 1080 . 8 1 1 A 91 91 MET H H 91 8.450 8.547 -0.097 1
1 1081 . 8 1 1 A 91 91 MET HA H 91 4.904 4.895 0.009 1
1 1089 . 8 1 1 A 91 91 MET C C 91 173.373 174.017 -0.644 1
1 1090 . 8 1 1 A 91 91 MET CA C 91 52.277 53.992 -1.715 1
1 1091 . 8 1 1 A 91 91 MET CB C 91 32.789 33.075 -0.286 1
1 1094 . 8 1 1 A 91 91 MET N N 91 125.173 120.431 4.742 1
1 1095 . 8 1 1 A 92 92 PRO HA H 92 4.358 4.243 0.115 1
1 1102 . 8 1 1 A 92 92 PRO C C 92 177.589 176.818 0.771 1
1 1103 . 8 1 1 A 92 92 PRO CA C 92 63.143 63.521 -0.378 1
1 1104 . 8 1 1 A 92 92 PRO CB C 92 32.083 31.421 0.662 1
1 1107 . 8 1 1 A 93 93 GLY H H 93 8.330 8.012 0.318 1
1 1108 . 8 1 1 A 93 93 GLY HA2 H 93 3.943 4.128 -0.185 1
1 1109 . 8 1 1 A 93 93 GLY HA3 H 93 4.045 4.129 -0.084 1
1 1110 . 8 1 1 A 93 93 GLY C C 93 174.730 173.195 1.535 1
1 1111 . 8 1 1 A 93 93 GLY CA C 93 45.276 44.721 0.555 1
1 1112 . 8 1 1 A 93 93 GLY N N 93 109.420 110.909 -1.489 1
1 1113 . 8 1 1 A 94 94 GLY H H 94 8.331 8.266 0.065 1
1 1114 . 8 1 1 A 94 94 GLY HA2 H 94 3.973 4.129 -0.156 1
1 1115 . 8 1 1 A 94 94 GLY HA3 H 94 3.973 4.129 -0.156 1
1 1116 . 8 1 1 A 94 94 GLY C C 94 174.100 171.720 2.380 1
1 1117 . 8 1 1 A 94 94 GLY CA C 94 45.333 44.568 0.765 1
1 1118 . 8 1 1 A 94 94 GLY N N 94 108.483 109.959 -1.476 1
1 1119 . 8 1 1 A 95 95 THR H H 95 8.095 8.693 -0.598 1
1 1120 . 8 1 1 A 95 95 THR HA H 95 4.643 5.199 -0.556 1
1 1125 . 8 1 1 A 95 95 THR C C 95 173.155 171.538 1.617 1
1 1126 . 8 1 1 A 95 95 THR CA C 95 59.922 58.370 1.552 1
1 1127 . 8 1 1 A 95 95 THR CB C 95 69.871 71.020 -1.149 1
1 1129 . 8 1 1 A 95 95 THR N N 95 115.860 110.860 5.000 1
1 1130 . 8 1 1 A 96 96 PRO HA H 96 4.400 4.663 -0.263 1
1 1137 . 8 1 1 A 96 96 PRO C C 96 177.565 176.071 1.494 1
1 1138 . 8 1 1 A 96 96 PRO CA C 96 64.047 62.414 1.633 1
1 1139 . 8 1 1 A 96 96 PRO CB C 96 31.816 30.228 1.588 1
1 1142 . 8 1 1 A 97 97 GLY H H 97 8.572 7.754 0.818 1
1 1143 . 8 1 1 A 97 97 GLY HA2 H 97 4.007 4.230 -0.223 1
1 1144 . 8 1 1 A 97 97 GLY HA3 H 97 4.007 4.232 -0.225 1
1 1145 . 8 1 1 A 97 97 GLY C C 97 174.609 173.070 1.539 1
1 1146 . 8 1 1 A 97 97 GLY CA C 97 45.276 45.633 -0.357 1
1 1147 . 8 1 1 A 97 97 GLY N N 97 110.233 109.518 0.715 1
1 1148 . 8 1 1 A 98 98 GLY H H 98 8.119 8.391 -0.272 1
1 1149 . 8 1 1 A 98 98 GLY HA2 H 98 4.086 4.122 -0.036 1
1 1150 . 8 1 1 A 98 98 GLY HA3 H 98 4.200 4.122 0.078 1
1 1151 . 8 1 1 A 98 98 GLY CA C 98 44.876 44.482 0.394 1
1 1152 . 8 1 1 A 98 98 GLY N N 98 108.845 108.090 0.755 1
1 1153 . 8 1 1 A 99 99 PRO HA H 99 4.494 4.486 0.008 1
1 1160 . 8 1 1 A 99 99 PRO C C 99 177.468 176.745 0.723 1
1 1161 . 8 1 1 A 99 99 PRO CA C 99 63.500 62.907 0.593 1
1 1162 . 8 1 1 A 99 99 PRO CB C 99 32.013 32.006 0.007 1
1 1165 . 8 1 1 A 100 100 SER H H 100 8.472 8.585 -0.113 1
1 1166 . 8 1 1 A 100 100 SER HA H 100 4.513 4.114 0.399 1
1 1169 . 8 1 1 A 100 100 SER C C 100 175.408 174.989 0.419 1
1 1170 . 8 1 1 A 100 100 SER CA C 100 58.557 59.603 -1.046 1
1 1171 . 8 1 1 A 100 100 SER CB C 100 63.918 63.137 0.781 1
1 1172 . 8 1 1 A 100 100 SER N N 100 116.038 118.317 -2.279 1
1 1173 . 8 1 1 A 101 101 GLY H H 101 8.427 8.600 -0.173 1
1 1174 . 8 1 1 A 101 101 GLY HA2 H 101 4.064 3.967 0.097 1
1 1175 . 8 1 1 A 101 101 GLY HA3 H 101 4.064 3.975 0.089 1
1 1176 . 8 1 1 A 101 101 GLY C C 101 174.730 174.880 -0.150 1
1 1177 . 8 1 1 A 101 101 GLY CA C 101 45.575 45.407 0.168 1
1 1178 . 8 1 1 A 101 101 GLY N N 101 110.558 114.209 -3.651 1
1 1179 . 8 1 1 A 102 102 GLN H H 102 8.416 8.051 0.365 1
1 1180 . 8 1 1 A 102 102 GLN HA H 102 4.383 4.265 0.118 1
1 1187 . 8 1 1 A 102 102 GLN C C 102 177.346 176.549 0.797 1
1 1188 . 8 1 1 A 102 102 GLN CA C 102 57.080 56.781 0.299 1
1 1189 . 8 1 1 A 102 102 GLN CB C 102 29.235 27.263 1.972 1
1 1191 . 8 1 1 A 102 102 GLN N N 102 120.112 120.675 -0.563 1
1 1193 . 8 1 1 A 103 103 GLY H H 103 8.713 8.427 0.286 1
1 1194 . 8 1 1 A 103 103 GLY HA2 H 103 4.193 4.041 0.152 1
1 1195 . 8 1 1 A 103 103 GLY HA3 H 103 4.078 4.054 0.024 1
1 1196 . 8 1 1 A 103 103 GLY C C 103 175.602 172.244 3.358 1
1 1197 . 8 1 1 A 103 103 GLY CA C 103 46.120 44.950 1.170 1
1 1198 . 8 1 1 A 103 103 GLY N N 103 109.817 114.336 -4.519 1
1 1199 . 8 1 1 A 104 104 ALA H H 104 8.366 8.275 0.091 1
1 1200 . 8 1 1 A 104 104 ALA HA H 104 4.449 4.575 -0.126 1
1 1204 . 8 1 1 A 104 104 ALA C C 104 179.188 176.797 2.391 1
1 1205 . 8 1 1 A 104 104 ALA CA C 104 54.230 51.123 3.107 1
1 1206 . 8 1 1 A 104 104 ALA CB C 104 19.080 21.759 -2.679 1
1 1207 . 8 1 1 A 104 104 ALA N N 104 124.808 120.331 4.477 1
1 1208 . 8 1 1 A 105 105 GLU H H 105 8.576 9.024 -0.448 1
1 1209 . 8 1 1 A 105 105 GLU HA H 105 4.161 4.034 0.127 1
1 1214 . 8 1 1 A 105 105 GLU C C 105 179.200 178.774 0.426 1
1 1215 . 8 1 1 A 105 105 GLU CA C 105 59.173 59.710 -0.537 1
1 1216 . 8 1 1 A 105 105 GLU CB C 105 29.194 29.216 -0.022 1
1 1218 . 8 1 1 A 105 105 GLU N N 105 119.238 117.644 1.594 1
1 1219 . 8 1 1 A 106 106 ALA H H 106 8.381 8.312 0.069 1
1 1220 . 8 1 1 A 106 106 ALA HA H 106 4.283 4.120 0.163 1
1 1224 . 8 1 1 A 106 106 ALA C C 106 180.048 180.003 0.045 1
1 1225 . 8 1 1 A 106 106 ALA CA C 106 54.687 55.570 -0.883 1
1 1226 . 8 1 1 A 106 106 ALA CB C 106 18.341 18.861 -0.520 1
1 1227 . 8 1 1 A 106 106 ALA N N 106 123.327 122.433 0.894 1
1 1228 . 8 1 1 A 107 107 ALA H H 107 8.123 8.252 -0.129 1
1 1229 . 8 1 1 A 107 107 ALA HA H 107 4.554 4.286 0.268 1
1 1233 . 8 1 1 A 107 107 ALA C C 107 179.757 180.401 -0.644 1
1 1234 . 8 1 1 A 107 107 ALA CA C 107 55.355 55.594 -0.239 1
1 1235 . 8 1 1 A 107 107 ALA CB C 107 18.939 18.249 0.690 1
1 1236 . 8 1 1 A 107 107 ALA N N 107 120.740 119.856 0.884 1
1 1237 . 8 1 1 A 108 108 ARG H H 108 8.403 8.242 0.161 1
1 1238 . 8 1 1 A 108 108 ARG HA H 108 4.254 4.172 0.082 1
1 1245 . 8 1 1 A 108 108 ARG C C 108 179.111 179.911 -0.800 1
1 1246 . 8 1 1 A 108 108 ARG CA C 108 59.015 59.269 -0.254 1
1 1247 . 8 1 1 A 108 108 ARG CB C 108 29.752 29.920 -0.168 1
1 1250 . 8 1 1 A 108 108 ARG N N 108 119.531 117.609 1.922 1
1 1251 . 8 1 1 A 109 109 GLY H H 109 8.182 8.766 -0.584 1
1 1252 . 8 1 1 A 109 109 GLY HA2 H 109 3.822 3.655 0.167 1
1 1253 . 8 1 1 A 109 109 GLY HA3 H 109 3.822 3.677 0.145 1
1 1254 . 8 1 1 A 109 109 GLY C C 109 177.020 176.766 0.254 1
1 1255 . 8 1 1 A 109 109 GLY CA C 109 46.718 47.217 -0.499 1
1 1256 . 8 1 1 A 109 109 GLY N N 109 107.331 108.009 -0.678 1
1 1257 . 8 1 1 A 110 110 TRP H H 110 7.925 7.835 0.090 1
1 1258 . 8 1 1 A 110 110 TRP HA H 110 3.963 4.577 -0.614 1
1 1267 . 8 1 1 A 110 110 TRP C C 110 176.691 177.927 -1.236 1
1 1268 . 8 1 1 A 110 110 TRP CA C 110 62.041 60.714 1.327 1
1 1269 . 8 1 1 A 110 110 TRP CB C 110 28.989 28.387 0.602 1
1 1275 . 8 1 1 A 110 110 TRP N N 110 122.304 121.342 0.962 1
1 1277 . 8 1 1 A 111 111 GLU H H 111 7.946 7.695 0.251 1
1 1278 . 8 1 1 A 111 111 GLU HA H 111 2.594 3.015 -0.421 1
1 1283 . 8 1 1 A 111 111 GLU C C 111 177.976 179.076 -1.100 1
1 1284 . 8 1 1 A 111 111 GLU CA C 111 60.193 59.081 1.112 1
1 1285 . 8 1 1 A 111 111 GLU CB C 111 29.277 29.384 -0.107 1
1 1287 . 8 1 1 A 111 111 GLU N N 111 121.755 119.051 2.704 1
1 1288 . 8 1 1 A 112 112 THR H H 112 7.993 7.649 0.344 1
1 1289 . 8 1 1 A 112 112 THR HA H 112 3.722 3.822 -0.100 1
1 1294 . 8 1 1 A 112 112 THR C C 112 176.038 175.909 0.129 1
1 1295 . 8 1 1 A 112 112 THR CA C 112 66.104 66.522 -0.418 1
1 1296 . 8 1 1 A 112 112 THR CB C 112 68.885 68.735 0.150 1
1 1298 . 8 1 1 A 112 112 THR N N 112 112.247 116.225 -3.978 1
1 1299 . 8 1 1 A 113 113 ALA H H 113 7.742 8.127 -0.385 1
1 1300 . 8 1 1 A 113 113 ALA HA H 113 4.029 3.972 0.057 1
1 1304 . 8 1 1 A 113 113 ALA C C 113 180.545 180.032 0.513 1
1 1305 . 8 1 1 A 113 113 ALA CA C 113 55.127 55.221 -0.094 1
1 1306 . 8 1 1 A 113 113 ALA CB C 113 18.854 18.398 0.456 1
1 1307 . 8 1 1 A 113 113 ALA N N 113 123.134 122.767 0.367 1
1 1308 . 8 1 1 A 114 114 ILE H H 114 8.472 8.496 -0.024 1
1 1309 . 8 1 1 A 114 114 ILE HA H 114 3.613 3.726 -0.113 1
1 1319 . 8 1 1 A 114 114 ILE C C 114 176.947 178.063 -1.116 1
1 1320 . 8 1 1 A 114 114 ILE CA C 114 66.016 65.165 0.851 1
1 1321 . 8 1 1 A 114 114 ILE CB C 114 38.335 37.909 0.426 1
1 1325 . 8 1 1 A 114 114 ILE N N 114 118.276 118.088 0.188 1
1 1326 . 8 1 1 A 115 115 ARG H H 115 8.181 7.949 0.232 1
1 1327 . 8 1 1 A 115 115 ARG HA H 115 3.835 3.897 -0.062 1
1 1334 . 8 1 1 A 115 115 ARG C C 115 179.588 179.095 0.493 1
1 1335 . 8 1 1 A 115 115 ARG CA C 115 61.072 59.931 1.141 1
1 1336 . 8 1 1 A 115 115 ARG CB C 115 29.975 29.839 0.136 1
1 1339 . 8 1 1 A 115 115 ARG N N 115 117.921 119.523 -1.602 1
1 1340 . 8 1 1 A 116 116 GLN H H 116 8.395 8.415 -0.020 1
1 1341 . 8 1 1 A 116 116 GLN HA H 116 4.030 4.052 -0.022 1
1 1348 . 8 1 1 A 116 116 GLN C C 116 178.716 178.902 -0.186 1
1 1349 . 8 1 1 A 116 116 GLN CA C 116 58.790 58.861 -0.071 1
1 1350 . 8 1 1 A 116 116 GLN CB C 116 28.248 28.451 -0.203 1
1 1352 . 8 1 1 A 116 116 GLN N N 116 116.842 118.994 -2.152 1
1 1354 . 8 1 1 A 117 117 ALA H H 117 7.902 8.100 -0.198 1
1 1355 . 8 1 1 A 117 117 ALA HA H 117 4.143 4.128 0.015 1
1 1359 . 8 1 1 A 117 117 ALA C C 117 179.685 180.193 -0.508 1
1 1360 . 8 1 1 A 117 117 ALA CA C 117 54.476 54.974 -0.498 1
1 1361 . 8 1 1 A 117 117 ALA CB C 117 18.300 18.306 -0.006 1
1 1362 . 8 1 1 A 117 117 ALA N N 117 122.828 122.979 -0.151 1
1 1363 . 8 1 1 A 118 118 LEU H H 118 7.904 8.009 -0.105 1
1 1364 . 8 1 1 A 118 118 LEU HA H 118 4.119 4.094 0.025 1
1 1374 . 8 1 1 A 118 118 LEU C C 118 178.437 178.757 -0.320 1
1 1375 . 8 1 1 A 118 118 LEU CA C 118 56.781 57.175 -0.394 1
1 1376 . 8 1 1 A 118 118 LEU CB C 118 42.371 41.788 0.583 1
1 1380 . 8 1 1 A 118 118 LEU N N 118 117.632 120.120 -2.488 1
1 1381 . 8 1 1 A 119 119 MET H H 119 7.673 8.135 -0.462 1
1 1382 . 8 1 1 A 119 119 MET HA H 119 4.442 4.203 0.239 1
1 1390 . 8 1 1 A 119 119 MET C C 119 176.680 178.049 -1.369 1
1 1391 . 8 1 1 A 119 119 MET CA C 119 56.432 58.059 -1.627 1
1 1392 . 8 1 1 A 119 119 MET CB C 119 32.769 31.814 0.955 1
1 1395 . 8 1 1 A 119 119 MET N N 119 117.286 117.683 -0.397 1
1 1396 . 8 1 1 A 120 120 SER H H 120 7.878 7.519 0.359 1
1 1397 . 8 1 1 A 120 120 SER HA H 120 4.500 4.324 0.176 1
1 1400 . 8 1 1 A 120 120 SER C C 120 174.742 174.755 -0.013 1
1 1401 . 8 1 1 A 120 120 SER CA C 120 58.962 59.626 -0.664 1
1 1402 . 8 1 1 A 120 120 SER CB C 120 63.853 64.280 -0.427 1
1 1403 . 8 1 1 A 120 120 SER N N 120 115.064 112.794 2.270 1
1 1404 . 8 1 1 A 121 121 GLY H H 121 8.059 8.040 0.019 1
1 1405 . 8 1 1 A 121 121 GLY HA2 H 121 4.231 3.896 0.335 1
1 1406 . 8 1 1 A 121 121 GLY HA3 H 121 4.112 3.898 0.214 1
1 1407 . 8 1 1 A 121 121 GLY C C 121 172.065 173.853 -1.788 1
1 1408 . 8 1 1 A 121 121 GLY CA C 121 45.030 46.780 -1.750 1
1 1409 . 8 1 1 A 121 121 GLY N N 121 110.271 110.680 -0.409 1
1 1410 . 8 1 1 A 122 122 PRO HA H 122 4.496 4.657 -0.161 1
1 1417 . 8 1 1 A 122 122 PRO CA C 122 63.399 62.670 0.729 1
1 1418 . 8 1 1 A 122 122 PRO CB C 122 32.186 31.285 0.901 1
1 1 . 9 1 1 A 6 6 SER H H 6 8.337 7.605 0.732 1
1 2 . 9 1 1 A 6 6 SER HA H 6 4.597 4.799 -0.202 1
1 5 . 9 1 1 A 6 6 SER C C 6 174.637 174.508 0.129 1
1 6 . 9 1 1 A 6 6 SER CA C 6 58.469 55.883 2.586 1
1 7 . 9 1 1 A 6 6 SER CB C 6 64.221 65.896 -1.675 1
1 8 . 9 1 1 A 6 6 SER N N 6 117.887 117.648 0.239 1
1 9 . 9 1 1 A 7 7 GLY H H 7 8.280 8.654 -0.374 1
1 10 . 9 1 1 A 7 7 GLY HA2 H 7 4.063 4.000 0.063 1
1 11 . 9 1 1 A 7 7 GLY HA3 H 7 4.063 4.003 0.060 1
1 12 . 9 1 1 A 7 7 GLY C C 7 173.724 174.619 -0.895 1
1 13 . 9 1 1 A 7 7 GLY CA C 7 44.941 44.853 0.088 1
1 14 . 9 1 1 A 7 7 GLY N N 7 110.151 112.045 -1.894 1
1 15 . 9 1 1 A 8 8 THR H H 8 8.212 7.984 0.228 1
1 16 . 9 1 1 A 8 8 THR HA H 8 4.173 4.342 -0.169 1
1 21 . 9 1 1 A 8 8 THR C C 8 174.723 174.616 0.107 1
1 22 . 9 1 1 A 8 8 THR CA C 8 63.622 63.986 -0.364 1
1 23 . 9 1 1 A 8 8 THR CB C 8 69.460 69.495 -0.035 1
1 25 . 9 1 1 A 8 8 THR N N 8 116.817 117.094 -0.277 1
1 26 . 9 1 1 A 9 9 LEU H H 9 9.374 8.986 0.388 1
1 27 . 9 1 1 A 9 9 LEU HA H 9 4.302 4.299 0.003 1
1 37 . 9 1 1 A 9 9 LEU C C 9 177.468 176.559 0.909 1
1 38 . 9 1 1 A 9 9 LEU CA C 9 55.936 55.934 0.002 1
1 39 . 9 1 1 A 9 9 LEU CB C 9 42.843 42.743 0.100 1
1 43 . 9 1 1 A 9 9 LEU N N 9 127.798 128.289 -0.491 1
1 44 . 9 1 1 A 10 10 ARG H H 10 7.512 7.343 0.169 1
1 45 . 9 1 1 A 10 10 ARG HA H 10 4.199 4.693 -0.494 1
1 52 . 9 1 1 A 10 10 ARG C C 10 172.501 173.977 -1.476 1
1 53 . 9 1 1 A 10 10 ARG CA C 10 56.165 54.412 1.753 1
1 54 . 9 1 1 A 10 10 ARG CB C 10 32.442 33.440 -0.998 1
1 57 . 9 1 1 A 10 10 ARG N N 10 117.979 117.248 0.731 1
1 58 . 9 1 1 A 11 11 GLU H H 11 8.434 8.799 -0.365 1
1 59 . 9 1 1 A 11 11 GLU HA H 11 5.993 5.607 0.386 1
1 64 . 9 1 1 A 11 11 GLU C C 11 174.800 174.527 0.273 1
1 65 . 9 1 1 A 11 11 GLU CA C 11 54.570 55.101 -0.531 1
1 66 . 9 1 1 A 11 11 GLU CB C 11 34.245 33.154 1.091 1
1 68 . 9 1 1 A 11 11 GLU N N 11 120.782 121.478 -0.696 1
1 69 . 9 1 1 A 12 12 GLY H H 12 8.131 7.858 0.273 1
1 70 . 9 1 1 A 12 12 GLY HA2 H 12 4.714 3.573 1.141 1
1 71 . 9 1 1 A 12 12 GLY HA3 H 12 3.763 4.157 -0.394 1
1 72 . 9 1 1 A 12 12 GLY C C 12 171.060 171.718 -0.658 1
1 73 . 9 1 1 A 12 12 GLY CA C 12 45.241 45.239 0.002 1
1 74 . 9 1 1 A 12 12 GLY N N 12 107.457 106.141 1.316 1
1 75 . 9 1 1 A 13 13 TRP H H 13 8.783 8.621 0.162 1
1 76 . 9 1 1 A 13 13 TRP HA H 13 5.152 4.969 0.183 1
1 85 . 9 1 1 A 13 13 TRP C C 13 177.528 176.714 0.814 1
1 86 . 9 1 1 A 13 13 TRP CA C 13 57.783 58.769 -0.986 1
1 87 . 9 1 1 A 13 13 TRP CB C 13 30.222 30.205 0.017 1
1 93 . 9 1 1 A 13 13 TRP N N 13 120.792 121.471 -0.679 1
1 95 . 9 1 1 A 14 14 VAL H H 14 9.179 9.028 0.151 1
1 96 . 9 1 1 A 14 14 VAL HA H 14 4.072 4.547 -0.475 1
1 104 . 9 1 1 A 14 14 VAL C C 14 174.981 173.733 1.248 1
1 105 . 9 1 1 A 14 14 VAL CA C 14 61.741 60.227 1.514 1
1 106 . 9 1 1 A 14 14 VAL CB C 14 35.143 35.311 -0.168 1
1 109 . 9 1 1 A 14 14 VAL N N 14 125.476 122.788 2.688 1
1 110 . 9 1 1 A 15 15 VAL H H 15 8.403 8.821 -0.418 1
1 111 . 9 1 1 A 15 15 VAL HA H 15 5.532 5.421 0.111 1
1 119 . 9 1 1 A 15 15 VAL C C 15 175.078 174.241 0.837 1
1 120 . 9 1 1 A 15 15 VAL CA C 15 59.489 59.434 0.055 1
1 121 . 9 1 1 A 15 15 VAL CB C 15 34.210 35.086 -0.876 1
1 124 . 9 1 1 A 15 15 VAL N N 15 126.189 127.136 -0.947 1
1 125 . 9 1 1 A 16 16 HIS H H 16 9.122 8.913 0.209 1
1 126 . 9 1 1 A 16 16 HIS HA H 16 5.823 5.784 0.039 1
1 131 . 9 1 1 A 16 16 HIS C C 16 172.998 172.591 0.407 1
1 132 . 9 1 1 A 16 16 HIS CA C 16 56.253 53.871 2.382 1
1 133 . 9 1 1 A 16 16 HIS CB C 16 34.273 32.662 1.611 1
1 136 . 9 1 1 A 16 16 HIS N N 16 121.152 120.802 0.350 1
1 137 . 9 1 1 A 17 17 TYR H H 17 8.465 8.656 -0.191 1
1 138 . 9 1 1 A 17 17 TYR HA H 17 5.096 4.782 0.314 1
1 145 . 9 1 1 A 17 17 TYR C C 17 173.640 173.187 0.453 1
1 146 . 9 1 1 A 17 17 TYR CA C 17 56.903 56.369 0.534 1
1 147 . 9 1 1 A 17 17 TYR CB C 17 40.103 40.071 0.032 1
1 152 . 9 1 1 A 17 17 TYR N N 17 115.558 116.292 -0.734 1
1 153 . 9 1 1 A 18 18 SER H H 18 9.122 8.754 0.368 1
1 154 . 9 1 1 A 18 18 SER HA H 18 6.144 5.313 0.831 1
1 157 . 9 1 1 A 18 18 SER C C 18 173.204 175.398 -2.194 1
1 158 . 9 1 1 A 18 18 SER CA C 18 56.640 56.903 -0.263 1
1 159 . 9 1 1 A 18 18 SER CB C 18 68.788 66.381 2.407 1
1 160 . 9 1 1 A 18 18 SER N N 18 118.846 115.789 3.057 1
1 161 . 9 1 1 A 19 19 ASN H H 19 9.053 8.776 0.277 1
1 162 . 9 1 1 A 19 19 ASN HA H 19 4.473 5.052 -0.579 1
1 167 . 9 1 1 A 19 19 ASN C C 19 175.396 176.265 -0.869 1
1 168 . 9 1 1 A 19 19 ASN CA C 19 55.373 52.234 3.139 1
1 169 . 9 1 1 A 19 19 ASN CB C 19 36.900 38.087 -1.187 1
1 170 . 9 1 1 A 19 19 ASN N N 19 113.712 117.901 -4.189 1
1 172 . 9 1 1 A 20 20 LYS H H 20 7.677 8.357 -0.680 1
1 173 . 9 1 1 A 20 20 LYS HA H 20 4.413 4.668 -0.255 1
1 182 . 9 1 1 A 20 20 LYS C C 20 176.078 177.449 -1.371 1
1 183 . 9 1 1 A 20 20 LYS CA C 20 55.679 57.613 -1.934 1
1 184 . 9 1 1 A 20 20 LYS CB C 20 33.023 35.296 -2.273 1
1 188 . 9 1 1 A 20 20 LYS N N 20 117.213 119.476 -2.263 1
1 189 . 9 1 1 A 21 21 ASP H H 21 7.395 8.002 -0.607 1
1 190 . 9 1 1 A 21 21 ASP HA H 21 4.808 4.845 -0.037 1
1 193 . 9 1 1 A 21 21 ASP C C 21 176.413 176.086 0.327 1
1 194 . 9 1 1 A 21 21 ASP CA C 21 53.983 52.895 1.088 1
1 195 . 9 1 1 A 21 21 ASP CB C 21 41.199 41.952 -0.753 1
1 196 . 9 1 1 A 21 21 ASP N N 21 119.879 117.428 2.451 1
1 197 . 9 1 1 A 22 22 THR H H 22 8.593 8.174 0.419 1
1 198 . 9 1 1 A 22 22 THR HA H 22 4.352 4.267 0.085 1
1 203 . 9 1 1 A 22 22 THR C C 22 172.913 173.698 -0.785 1
1 204 . 9 1 1 A 22 22 THR CA C 22 62.691 62.904 -0.213 1
1 205 . 9 1 1 A 22 22 THR CB C 22 68.332 66.387 1.945 1
1 207 . 9 1 1 A 22 22 THR N N 22 116.299 114.483 1.816 1
1 208 . 9 1 1 A 23 23 LEU H H 23 7.645 8.003 -0.358 1
1 209 . 9 1 1 A 23 23 LEU HA H 23 4.318 4.414 -0.096 1
1 219 . 9 1 1 A 23 23 LEU C C 23 176.692 175.726 0.966 1
1 220 . 9 1 1 A 23 23 LEU CA C 23 54.617 53.998 0.619 1
1 221 . 9 1 1 A 23 23 LEU CB C 23 41.939 40.133 1.806 1
1 225 . 9 1 1 A 23 23 LEU N N 23 123.606 122.039 1.567 1
1 226 . 9 1 1 A 24 24 ARG H H 24 8.563 8.095 0.468 1
1 227 . 9 1 1 A 24 24 ARG HA H 24 4.373 4.546 -0.173 1
1 235 . 9 1 1 A 24 24 ARG C C 24 176.584 175.281 1.303 1
1 236 . 9 1 1 A 24 24 ARG CA C 24 57.854 55.960 1.894 1
1 237 . 9 1 1 A 24 24 ARG CB C 24 31.126 29.756 1.370 1
1 240 . 9 1 1 A 24 24 ARG N N 24 127.152 123.623 3.529 1
1 242 . 9 1 1 A 25 25 LYS H H 25 8.633 8.469 0.164 1
1 243 . 9 1 1 A 25 25 LYS HA H 25 4.513 4.874 -0.361 1
1 251 . 9 1 1 A 25 25 LYS C C 25 173.567 174.493 -0.926 1
1 252 . 9 1 1 A 25 25 LYS CA C 25 54.792 54.841 -0.049 1
1 253 . 9 1 1 A 25 25 LYS CB C 25 37.416 34.389 3.027 1
1 257 . 9 1 1 A 25 25 LYS N N 25 122.682 121.097 1.585 1
1 258 . 9 1 1 A 26 26 ARG H H 26 8.303 8.739 -0.436 1
1 259 . 9 1 1 A 26 26 ARG HA H 26 5.153 5.313 -0.160 1
1 266 . 9 1 1 A 26 26 ARG C C 26 174.554 174.776 -0.222 1
1 267 . 9 1 1 A 26 26 ARG CA C 26 55.083 54.328 0.755 1
1 268 . 9 1 1 A 26 26 ARG CB C 26 32.789 32.921 -0.132 1
1 271 . 9 1 1 A 26 26 ARG N N 26 121.819 124.018 -2.199 1
1 272 . 9 1 1 A 27 27 HIS H H 27 8.793 9.395 -0.602 1
1 273 . 9 1 1 A 27 27 HIS HA H 27 5.155 5.638 -0.483 1
1 278 . 9 1 1 A 27 27 HIS CA C 27 56.904 55.102 1.802 1
1 279 . 9 1 1 A 27 27 HIS CB C 27 34.683 31.511 3.172 1
1 282 . 9 1 1 A 27 27 HIS N N 27 122.102 120.529 1.573 1
1 283 . 9 1 1 A 28 28 TYR H H 28 9.273 8.003 1.270 1
1 284 . 9 1 1 A 28 28 TYR HA H 28 4.332 4.285 0.047 1
1 291 . 9 1 1 A 28 28 TYR C C 28 174.730 174.889 -0.159 1
1 292 . 9 1 1 A 28 28 TYR CA C 28 58.680 57.008 1.672 1
1 293 . 9 1 1 A 28 28 TYR CB C 28 38.673 37.771 0.902 1
1 298 . 9 1 1 A 28 28 TYR N N 28 125.605 121.181 4.424 1
1 299 . 9 1 1 A 29 29 TRP H H 29 9.273 8.923 0.350 1
1 300 . 9 1 1 A 29 29 TRP HA H 29 5.543 4.895 0.648 1
1 309 . 9 1 1 A 29 29 TRP C C 29 176.172 176.816 -0.644 1
1 310 . 9 1 1 A 29 29 TRP CA C 29 56.658 57.867 -1.209 1
1 311 . 9 1 1 A 29 29 TRP CB C 29 32.154 30.691 1.463 1
1 317 . 9 1 1 A 29 29 TRP N N 29 131.340 128.299 3.041 1
1 318 . 9 1 1 A 30 30 ARG H H 30 9.164 9.222 -0.058 1
1 319 . 9 1 1 A 30 30 ARG HA H 30 5.302 5.220 0.082 1
1 327 . 9 1 1 A 30 30 ARG C C 30 174.774 174.402 0.372 1
1 328 . 9 1 1 A 30 30 ARG CA C 30 56.271 55.038 1.233 1
1 329 . 9 1 1 A 30 30 ARG CB C 30 34.203 32.891 1.312 1
1 332 . 9 1 1 A 30 30 ARG N N 30 116.040 122.103 -6.063 1
1 334 . 9 1 1 A 31 31 LEU H H 31 9.273 9.310 -0.037 1
1 335 . 9 1 1 A 31 31 LEU HA H 31 5.324 5.352 -0.028 1
1 345 . 9 1 1 A 31 31 LEU C C 31 174.488 174.612 -0.124 1
1 346 . 9 1 1 A 31 31 LEU CA C 31 53.807 53.484 0.323 1
1 347 . 9 1 1 A 31 31 LEU CB C 31 46.667 46.181 0.486 1
1 351 . 9 1 1 A 31 31 LEU N N 31 127.075 127.509 -0.434 1
1 352 . 9 1 1 A 32 32 ASP H H 32 8.854 8.618 0.236 1
1 353 . 9 1 1 A 32 32 ASP HA H 32 4.902 5.068 -0.166 1
1 356 . 9 1 1 A 32 32 ASP C C 32 173.474 176.454 -2.980 1
1 357 . 9 1 1 A 32 32 ASP CA C 32 53.104 52.335 0.769 1
1 358 . 9 1 1 A 32 32 ASP CB C 32 42.931 44.677 -1.746 1
1 359 . 9 1 1 A 32 32 ASP N N 32 129.349 125.033 4.316 1
1 360 . 9 1 1 A 33 33 CYS H H 33 8.153 8.761 -0.608 1
1 361 . 9 1 1 A 33 33 CYS HA H 33 4.323 4.540 -0.217 1
1 364 . 9 1 1 A 33 33 CYS C C 33 174.476 175.721 -1.245 1
1 365 . 9 1 1 A 33 33 CYS CA C 33 59.853 59.733 0.120 1
1 366 . 9 1 1 A 33 33 CYS CB C 33 27.508 27.934 -0.426 1
1 367 . 9 1 1 A 33 33 CYS N N 33 108.439 119.353 -10.914 1
1 368 . 9 1 1 A 34 34 LYS H H 34 9.144 7.743 1.401 1
1 369 . 9 1 1 A 34 34 LYS HA H 34 4.616 4.439 0.177 1
1 378 . 9 1 1 A 34 34 LYS C C 34 177.601 176.343 1.258 1
1 379 . 9 1 1 A 34 34 LYS CA C 34 57.185 56.886 0.299 1
1 380 . 9 1 1 A 34 34 LYS CB C 34 35.623 35.069 0.554 1
1 384 . 9 1 1 A 34 34 LYS N N 34 119.884 119.027 0.857 1
1 385 . 9 1 1 A 35 35 CYS H H 35 9.102 7.753 1.349 1
1 386 . 9 1 1 A 35 35 CYS HA H 35 4.935 4.794 0.141 1
1 389 . 9 1 1 A 35 35 CYS C C 35 172.283 172.289 -0.006 1
1 390 . 9 1 1 A 35 35 CYS CA C 35 57.748 56.850 0.898 1
1 391 . 9 1 1 A 35 35 CYS CB C 35 31.537 30.732 0.805 1
1 392 . 9 1 1 A 35 35 CYS N N 35 120.317 113.937 6.380 1
1 393 . 9 1 1 A 36 36 ILE H H 36 8.213 8.928 -0.715 1
1 394 . 9 1 1 A 36 36 ILE HA H 36 4.617 4.772 -0.155 1
1 404 . 9 1 1 A 36 36 ILE C C 36 175.312 175.194 0.118 1
1 405 . 9 1 1 A 36 36 ILE CA C 36 60.967 60.392 0.575 1
1 406 . 9 1 1 A 36 36 ILE CB C 36 39.718 38.229 1.489 1
1 410 . 9 1 1 A 36 36 ILE N N 36 121.905 119.849 2.056 1
1 411 . 9 1 1 A 37 37 THR H H 37 9.076 8.649 0.427 1
1 412 . 9 1 1 A 37 37 THR HA H 37 4.364 4.529 -0.165 1
1 417 . 9 1 1 A 37 37 THR CA C 37 61.834 62.621 -0.787 1
1 418 . 9 1 1 A 37 37 THR CB C 37 69.237 70.007 -0.770 1
1 420 . 9 1 1 A 37 37 THR N N 37 122.500 123.544 -1.044 1
1 421 . 9 1 1 A 38 38 LEU H H 38 8.263 8.866 -0.603 1
1 422 . 9 1 1 A 38 38 LEU HA H 38 4.445 5.204 -0.759 1
1 432 . 9 1 1 A 38 38 LEU CA C 38 55.611 53.269 2.342 1
1 433 . 9 1 1 A 38 38 LEU CB C 38 42.702 45.246 -2.544 1
1 437 . 9 1 1 A 38 38 LEU N N 38 126.987 124.696 2.291 1
1 438 . 9 1 1 A 39 39 PHE H H 39 9.520 8.885 0.635 1
1 439 . 9 1 1 A 39 39 PHE HA H 39 4.998 5.112 -0.114 1
1 447 . 9 1 1 A 39 39 PHE CA C 39 57.331 56.295 1.036 1
1 448 . 9 1 1 A 39 39 PHE CB C 39 42.453 41.040 1.413 1
1 454 . 9 1 1 A 39 39 PHE N N 39 120.545 120.795 -0.250 1
1 455 . 9 1 1 A 40 40 GLN H H 40 9.878 8.979 0.899 1
1 456 . 9 1 1 A 40 40 GLN HA H 40 4.376 4.109 0.267 1
1 463 . 9 1 1 A 40 40 GLN CA C 40 59.513 58.691 0.822 1
1 464 . 9 1 1 A 40 40 GLN CB C 40 29.317 28.920 0.397 1
1 467 . 9 1 1 A 41 41 ASN H H 41 7.732 8.019 -0.287 1
1 468 . 9 1 1 A 41 41 ASN HA H 41 4.812 5.432 -0.620 1
1 473 . 9 1 1 A 41 41 ASN CA C 41 52.618 52.494 0.124 1
1 474 . 9 1 1 A 41 41 ASN CB C 41 39.362 41.996 -2.634 1
1 475 . 9 1 1 A 41 41 ASN N N 41 107.613 114.713 -7.100 1
1 477 . 9 1 1 A 42 42 ASN HA H 42 3.476 4.030 -0.554 1
1 482 . 9 1 1 A 42 42 ASN C C 42 173.607 175.532 -1.925 1
1 483 . 9 1 1 A 42 42 ASN CA C 42 54.888 55.507 -0.619 1
1 484 . 9 1 1 A 42 42 ASN CB C 42 35.613 37.534 -1.921 1
1 486 . 9 1 1 A 43 43 THR H H 43 8.394 7.575 0.819 1
1 487 . 9 1 1 A 43 43 THR HA H 43 4.403 4.655 -0.252 1
1 492 . 9 1 1 A 43 43 THR C C 43 174.464 173.437 1.027 1
1 493 . 9 1 1 A 43 43 THR CA C 43 61.978 60.339 1.639 1
1 494 . 9 1 1 A 43 43 THR CB C 43 70.036 68.838 1.198 1
1 496 . 9 1 1 A 43 43 THR N N 43 111.795 106.303 5.492 1
1 497 . 9 1 1 A 44 44 THR H H 44 8.058 7.739 0.319 1
1 498 . 9 1 1 A 44 44 THR HA H 44 4.464 4.837 -0.373 1
1 503 . 9 1 1 A 44 44 THR CA C 44 61.599 59.958 1.641 1
1 504 . 9 1 1 A 44 44 THR CB C 44 69.137 70.721 -1.584 1
1 506 . 9 1 1 A 44 44 THR N N 44 116.514 117.021 -0.507 1
1 507 . 9 1 1 A 45 45 ASN H H 45 6.653 8.756 -2.103 1
1 508 . 9 1 1 A 45 45 ASN HA H 45 4.945 4.411 0.534 1
1 513 . 9 1 1 A 45 45 ASN CA C 45 53.227 57.195 -3.968 1
1 514 . 9 1 1 A 45 45 ASN CB C 45 38.483 38.559 -0.076 1
1 516 . 9 1 1 A 46 46 ARG H H 46 8.213 7.942 0.271 1
1 517 . 9 1 1 A 46 46 ARG HA H 46 4.583 4.800 -0.217 1
1 524 . 9 1 1 A 46 46 ARG CA C 46 55.487 54.036 1.451 1
1 525 . 9 1 1 A 46 46 ARG CB C 46 31.153 33.421 -2.268 1
1 528 . 9 1 1 A 46 46 ARG N N 46 121.652 117.446 4.206 1
1 529 . 9 1 1 A 47 47 TYR H H 47 7.973 8.886 -0.913 1
1 536 . 9 1 1 A 47 47 TYR CB C 47 39.356 39.852 -0.496 1
1 541 . 9 1 1 A 48 48 TYR H H 48 9.023 8.496 0.527 1
1 542 . 9 1 1 A 48 48 TYR HA H 48 4.662 4.341 0.321 1
1 549 . 9 1 1 A 48 48 TYR CB C 48 39.863 40.737 -0.874 1
1 554 . 9 1 1 A 48 48 TYR N N 48 121.223 120.535 0.688 1
1 555 . 9 1 1 A 49 49 LYS H H 49 7.134 7.818 -0.684 1
1 556 . 9 1 1 A 49 49 LYS HA H 49 4.283 4.702 -0.419 1
1 565 . 9 1 1 A 49 49 LYS CA C 49 55.167 54.624 0.543 1
1 566 . 9 1 1 A 49 49 LYS CB C 49 36.699 36.113 0.586 1
1 570 . 9 1 1 A 49 49 LYS N N 49 117.339 118.409 -1.070 1
1 571 . 9 1 1 A 50 50 GLU H H 50 8.411 8.759 -0.348 1
1 572 . 9 1 1 A 50 50 GLU HA H 50 4.583 4.851 -0.268 1
1 577 . 9 1 1 A 50 50 GLU CA C 50 54.592 55.340 -0.748 1
1 578 . 9 1 1 A 50 50 GLU CB C 50 33.263 33.364 -0.101 1
1 580 . 9 1 1 A 50 50 GLU N N 50 123.825 123.889 -0.064 1
1 581 . 9 1 1 A 51 51 ILE H H 51 9.225 9.089 0.136 1
1 582 . 9 1 1 A 51 51 ILE HA H 51 4.277 4.609 -0.332 1
1 592 . 9 1 1 A 51 51 ILE CA C 51 58.182 58.055 0.127 1
1 593 . 9 1 1 A 51 51 ILE CB C 51 39.663 38.696 0.967 1
1 597 . 9 1 1 A 51 51 ILE N N 51 125.271 126.455 -1.184 1
1 598 . 9 1 1 A 52 52 PRO HA H 52 4.543 4.630 -0.087 1
1 605 . 9 1 1 A 52 52 PRO C C 52 178.340 178.069 0.271 1
1 606 . 9 1 1 A 52 52 PRO CA C 52 62.726 62.928 -0.202 1
1 607 . 9 1 1 A 52 52 PRO CB C 52 32.003 31.729 0.274 1
1 610 . 9 1 1 A 53 53 LEU H H 53 8.723 8.504 0.219 1
1 611 . 9 1 1 A 53 53 LEU HA H 53 3.891 3.881 0.010 1
1 621 . 9 1 1 A 53 53 LEU C C 53 179.673 178.875 0.798 1
1 622 . 9 1 1 A 53 53 LEU CA C 53 58.205 57.631 0.574 1
1 623 . 9 1 1 A 53 53 LEU CB C 53 40.171 41.502 -1.331 1
1 627 . 9 1 1 A 53 53 LEU N N 53 125.150 124.245 0.905 1
1 628 . 9 1 1 A 54 54 SER H H 54 8.360 8.053 0.307 1
1 629 . 9 1 1 A 54 54 SER HA H 54 4.164 4.072 0.092 1
1 632 . 9 1 1 A 54 54 SER C C 54 175.517 177.191 -1.674 1
1 633 . 9 1 1 A 54 54 SER CA C 54 60.193 61.798 -1.605 1
1 634 . 9 1 1 A 54 54 SER CB C 54 62.617 62.682 -0.065 1
1 635 . 9 1 1 A 54 54 SER N N 54 111.266 115.449 -4.183 1
1 636 . 9 1 1 A 55 55 GLU H H 55 7.666 8.223 -0.557 1
1 637 . 9 1 1 A 55 55 GLU HA H 55 4.363 4.092 0.271 1
1 642 . 9 1 1 A 55 55 GLU C C 55 176.753 177.901 -1.148 1
1 643 . 9 1 1 A 55 55 GLU CA C 55 56.200 58.888 -2.688 1
1 644 . 9 1 1 A 55 55 GLU CB C 55 30.526 29.220 1.306 1
1 646 . 9 1 1 A 55 55 GLU N N 55 119.485 119.586 -0.101 1
1 647 . 9 1 1 A 56 56 ILE H H 56 7.601 7.099 0.502 1
1 648 . 9 1 1 A 56 56 ILE HA H 56 3.793 3.920 -0.127 1
1 658 . 9 1 1 A 56 56 ILE C C 56 175.142 175.809 -0.667 1
1 659 . 9 1 1 A 56 56 ILE CA C 56 63.518 62.268 1.250 1
1 660 . 9 1 1 A 56 56 ILE CB C 56 37.169 37.950 -0.781 1
1 664 . 9 1 1 A 56 56 ILE N N 56 120.430 120.256 0.174 1
1 665 . 9 1 1 A 57 57 LEU H H 57 9.263 9.287 -0.024 1
1 666 . 9 1 1 A 57 57 LEU HA H 57 4.343 4.379 -0.036 1
1 676 . 9 1 1 A 57 57 LEU C C 57 177.898 176.585 1.313 1
1 677 . 9 1 1 A 57 57 LEU CA C 57 56.569 55.943 0.626 1
1 678 . 9 1 1 A 57 57 LEU CB C 57 41.980 42.459 -0.479 1
1 682 . 9 1 1 A 57 57 LEU N N 57 129.464 129.062 0.402 1
1 683 . 9 1 1 A 58 58 THR H H 58 7.414 7.287 0.127 1
1 684 . 9 1 1 A 58 58 THR HA H 58 4.512 5.001 -0.489 1
1 689 . 9 1 1 A 58 58 THR C C 58 171.314 172.806 -1.492 1
1 690 . 9 1 1 A 58 58 THR CA C 58 60.562 61.386 -0.824 1
1 691 . 9 1 1 A 58 58 THR CB C 58 70.803 73.357 -2.554 1
1 693 . 9 1 1 A 58 58 THR N N 58 109.129 110.592 -1.463 1
1 694 . 9 1 1 A 59 59 VAL H H 59 8.152 8.380 -0.228 1
1 695 . 9 1 1 A 59 59 VAL HA H 59 5.061 5.019 0.042 1
1 703 . 9 1 1 A 59 59 VAL C C 59 174.985 174.868 0.117 1
1 704 . 9 1 1 A 59 59 VAL CA C 59 61.354 61.333 0.021 1
1 705 . 9 1 1 A 59 59 VAL CB C 59 33.855 34.465 -0.610 1
1 708 . 9 1 1 A 59 59 VAL N N 59 123.676 123.368 0.308 1
1 709 . 9 1 1 A 60 60 GLU H H 60 9.074 8.568 0.506 1
1 710 . 9 1 1 A 60 60 GLU HA H 60 4.977 4.865 0.112 1
1 715 . 9 1 1 A 60 60 GLU C C 60 176.063 175.553 0.510 1
1 716 . 9 1 1 A 60 60 GLU CA C 60 53.807 54.272 -0.465 1
1 717 . 9 1 1 A 60 60 GLU CB C 60 33.739 33.752 -0.013 1
1 719 . 9 1 1 A 60 60 GLU N N 60 125.125 125.665 -0.540 1
1 720 . 9 1 1 A 61 61 SER H H 61 8.763 8.673 0.090 1
1 721 . 9 1 1 A 61 61 SER HA H 61 4.452 4.873 -0.421 1
1 724 . 9 1 1 A 61 61 SER C C 61 173.288 174.249 -0.961 1
1 725 . 9 1 1 A 61 61 SER CA C 61 59.384 58.149 1.235 1
1 726 . 9 1 1 A 61 61 SER CB C 61 63.390 64.178 -0.788 1
1 727 . 9 1 1 A 61 61 SER N N 61 117.523 117.788 -0.265 1
1 728 . 9 1 1 A 62 62 ALA H H 62 7.293 8.827 -1.534 1
1 729 . 9 1 1 A 62 62 ALA HA H 62 3.817 4.313 -0.496 1
1 733 . 9 1 1 A 62 62 ALA C C 62 176.717 177.837 -1.120 1
1 734 . 9 1 1 A 62 62 ALA CA C 62 53.966 53.100 0.866 1
1 735 . 9 1 1 A 62 62 ALA CB C 62 18.640 18.669 -0.029 1
1 736 . 9 1 1 A 62 62 ALA N N 62 122.650 125.970 -3.320 1
1 737 . 9 1 1 A 63 63 GLN H H 63 8.736 8.122 0.614 1
1 738 . 9 1 1 A 63 63 GLN HA H 63 4.445 4.770 -0.325 1
1 745 . 9 1 1 A 63 63 GLN C C 63 173.700 174.783 -1.083 1
1 746 . 9 1 1 A 63 63 GLN CA C 63 56.376 55.781 0.595 1
1 747 . 9 1 1 A 63 63 GLN CB C 63 31.515 31.027 0.488 1
1 749 . 9 1 1 A 63 63 GLN N N 63 120.251 119.427 0.824 1
1 751 . 9 1 1 A 64 64 ASN H H 64 9.272 7.177 2.095 1
1 752 . 9 1 1 A 64 64 ASN HA H 64 4.906 5.131 -0.225 1
1 757 . 9 1 1 A 64 64 ASN C C 64 174.754 174.669 0.085 1
1 758 . 9 1 1 A 64 64 ASN CA C 64 51.837 52.043 -0.206 1
1 759 . 9 1 1 A 64 64 ASN CB C 64 38.156 40.519 -2.363 1
1 760 . 9 1 1 A 64 64 ASN N N 64 122.346 118.605 3.741 1
1 762 . 9 1 1 A 65 65 PHE H H 65 8.854 9.130 -0.276 1
1 763 . 9 1 1 A 65 65 PHE HA H 65 4.947 5.149 -0.202 1
1 771 . 9 1 1 A 65 65 PHE C C 65 177.274 176.470 0.804 1
1 772 . 9 1 1 A 65 65 PHE CA C 65 57.519 57.112 0.407 1
1 773 . 9 1 1 A 65 65 PHE CB C 65 38.485 39.027 -0.542 1
1 779 . 9 1 1 A 65 65 PHE N N 65 123.638 125.416 -1.778 1
1 780 . 9 1 1 A 66 66 SER H H 66 8.163 8.141 0.022 1
1 781 . 9 1 1 A 66 66 SER HA H 66 4.393 4.262 0.131 1
1 784 . 9 1 1 A 66 66 SER C C 66 175.699 177.281 -1.582 1
1 785 . 9 1 1 A 66 66 SER CA C 66 60.791 61.184 -0.393 1
1 786 . 9 1 1 A 66 66 SER CB C 66 64.591 63.126 1.465 1
1 787 . 9 1 1 A 66 66 SER N N 66 113.913 116.279 -2.366 1
1 788 . 9 1 1 A 67 67 LEU H H 67 8.574 7.775 0.799 1
1 789 . 9 1 1 A 67 67 LEU HA H 67 4.302 3.823 0.479 1
1 799 . 9 1 1 A 67 67 LEU C C 67 176.269 177.316 -1.047 1
1 800 . 9 1 1 A 67 67 LEU CA C 67 55.601 58.194 -2.593 1
1 801 . 9 1 1 A 67 67 LEU CB C 67 42.021 41.914 0.107 1
1 805 . 9 1 1 A 67 67 LEU N N 67 121.264 121.309 -0.045 1
1 806 . 9 1 1 A 68 68 VAL H H 68 6.921 7.644 -0.723 1
1 807 . 9 1 1 A 68 68 VAL HA H 68 4.473 4.180 0.293 1
1 815 . 9 1 1 A 68 68 VAL C C 68 173.809 174.875 -1.066 1
1 816 . 9 1 1 A 68 68 VAL CA C 68 58.047 60.329 -2.282 1
1 817 . 9 1 1 A 68 68 VAL CB C 68 32.295 32.361 -0.066 1
1 820 . 9 1 1 A 68 68 VAL N N 68 111.287 115.505 -4.218 1
1 821 . 9 1 1 A 69 69 PRO HA H 69 4.658 4.702 -0.044 1
1 828 . 9 1 1 A 69 69 PRO CA C 69 61.747 61.536 0.211 1
1 829 . 9 1 1 A 69 69 PRO CB C 69 30.693 31.755 -1.062 1
1 832 . 9 1 1 A 70 70 PRO HA H 70 4.414 4.242 0.172 1
1 839 . 9 1 1 A 70 70 PRO CA C 70 63.997 63.882 0.115 1
1 840 . 9 1 1 A 70 70 PRO CB C 70 31.602 31.302 0.300 1
1 843 . 9 1 1 A 71 71 GLY H H 71 8.824 8.923 -0.099 1
1 844 . 9 1 1 A 71 71 GLY HA2 H 71 3.703 3.889 -0.186 1
1 845 . 9 1 1 A 71 71 GLY HA3 H 71 4.193 3.896 0.297 1
1 846 . 9 1 1 A 71 71 GLY C C 71 174.052 174.677 -0.625 1
1 847 . 9 1 1 A 71 71 GLY CA C 71 45.065 45.114 -0.049 1
1 848 . 9 1 1 A 71 71 GLY N N 71 111.845 112.899 -1.054 1
1 849 . 9 1 1 A 72 72 THR H H 72 7.597 7.210 0.387 1
1 850 . 9 1 1 A 72 72 THR HA H 72 4.133 4.103 0.030 1
1 855 . 9 1 1 A 72 72 THR CA C 72 63.129 63.159 -0.030 1
1 856 . 9 1 1 A 72 72 THR CB C 72 69.560 68.942 0.618 1
1 858 . 9 1 1 A 72 72 THR N N 72 117.485 116.358 1.127 1
1 859 . 9 1 1 A 73 73 ASN H H 73 9.280 8.604 0.676 1
1 860 . 9 1 1 A 73 73 ASN HA H 73 4.786 4.611 0.175 1
1 865 . 9 1 1 A 73 73 ASN CA C 73 52.009 52.051 -0.042 1
1 866 . 9 1 1 A 73 73 ASN CB C 73 37.553 38.345 -0.792 1
1 867 . 9 1 1 A 73 73 ASN N N 73 127.641 125.064 2.577 1
1 869 . 9 1 1 A 74 74 PRO HA H 74 4.752 4.831 -0.079 1
1 876 . 9 1 1 A 74 74 PRO C C 74 175.190 176.461 -1.271 1
1 877 . 9 1 1 A 74 74 PRO CA C 74 63.395 62.492 0.903 1
1 878 . 9 1 1 A 74 74 PRO CB C 74 33.164 32.706 0.458 1
1 881 . 9 1 1 A 75 75 HIS H H 75 8.025 8.801 -0.776 1
1 882 . 9 1 1 A 75 75 HIS HA H 75 5.047 5.068 -0.021 1
1 887 . 9 1 1 A 75 75 HIS C C 75 172.562 175.766 -3.204 1
1 888 . 9 1 1 A 75 75 HIS CA C 75 54.336 53.569 0.767 1
1 889 . 9 1 1 A 75 75 HIS CB C 75 30.956 33.594 -2.638 1
1 892 . 9 1 1 A 75 75 HIS N N 75 116.198 117.070 -0.872 1
1 893 . 9 1 1 A 76 76 CYS H H 76 8.343 9.442 -1.099 1
1 894 . 9 1 1 A 76 76 CYS HA H 76 4.594 4.445 0.149 1
1 897 . 9 1 1 A 76 76 CYS C C 76 175.651 174.905 0.746 1
1 898 . 9 1 1 A 76 76 CYS CA C 76 61.066 61.394 -0.328 1
1 899 . 9 1 1 A 76 76 CYS CB C 76 30.193 28.503 1.690 1
1 900 . 9 1 1 A 76 76 CYS N N 76 113.289 118.064 -4.775 1
1 901 . 9 1 1 A 77 77 PHE H H 77 8.433 7.364 1.069 1
1 902 . 9 1 1 A 77 77 PHE HA H 77 5.105 5.355 -0.250 1
1 910 . 9 1 1 A 77 77 PHE C C 77 171.822 172.982 -1.160 1
1 911 . 9 1 1 A 77 77 PHE CA C 77 56.874 55.673 1.201 1
1 912 . 9 1 1 A 77 77 PHE CB C 77 39.393 42.912 -3.519 1
1 918 . 9 1 1 A 77 77 PHE N N 77 114.874 114.701 0.173 1
1 919 . 9 1 1 A 78 78 GLU H H 78 9.823 9.226 0.597 1
1 920 . 9 1 1 A 78 78 GLU HA H 78 5.333 5.155 0.178 1
1 925 . 9 1 1 A 78 78 GLU C C 78 175.602 175.573 0.029 1
1 926 . 9 1 1 A 78 78 GLU CA C 78 54.212 54.666 -0.454 1
1 927 . 9 1 1 A 78 78 GLU CB C 78 31.702 32.625 -0.923 1
1 929 . 9 1 1 A 78 78 GLU N N 78 121.074 119.160 1.914 1
1 930 . 9 1 1 A 79 79 ILE H H 79 9.093 9.003 0.090 1
1 931 . 9 1 1 A 79 79 ILE HA H 79 4.637 4.560 0.077 1
1 941 . 9 1 1 A 79 79 ILE C C 79 174.476 175.149 -0.673 1
1 942 . 9 1 1 A 79 79 ILE CA C 79 60.932 60.725 0.207 1
1 943 . 9 1 1 A 79 79 ILE CB C 79 40.803 37.475 3.328 1
1 947 . 9 1 1 A 79 79 ILE N N 79 121.382 124.964 -3.582 1
1 948 . 9 1 1 A 80 80 VAL H H 80 8.841 7.802 1.039 1
1 949 . 9 1 1 A 80 80 VAL HA H 80 4.425 3.841 0.584 1
1 957 . 9 1 1 A 80 80 VAL C C 80 175.930 175.294 0.636 1
1 958 . 9 1 1 A 80 80 VAL CA C 80 63.324 63.149 0.175 1
1 959 . 9 1 1 A 80 80 VAL CB C 80 32.783 31.117 1.666 1
1 962 . 9 1 1 A 80 80 VAL N N 80 128.970 127.141 1.829 1
1 963 . 9 1 1 A 81 81 THR H H 81 8.303 7.945 0.358 1
1 964 . 9 1 1 A 81 81 THR HA H 81 5.264 4.616 0.648 1
1 969 . 9 1 1 A 81 81 THR C C 81 173.664 174.656 -0.992 1
1 970 . 9 1 1 A 81 81 THR CA C 81 59.540 59.940 -0.400 1
1 971 . 9 1 1 A 81 81 THR CB C 81 72.197 71.564 0.633 1
1 973 . 9 1 1 A 81 81 THR N N 81 118.077 118.472 -0.395 1
1 974 . 9 1 1 A 82 82 ALA H H 82 9.586 8.519 1.067 1
1 975 . 9 1 1 A 82 82 ALA HA H 82 4.093 4.310 -0.217 1
1 979 . 9 1 1 A 82 82 ALA C C 82 178.667 177.953 0.714 1
1 980 . 9 1 1 A 82 82 ALA CA C 82 55.321 53.196 2.125 1
1 981 . 9 1 1 A 82 82 ALA CB C 82 18.094 18.758 -0.664 1
1 982 . 9 1 1 A 82 82 ALA N N 82 122.493 123.637 -1.144 1
1 983 . 9 1 1 A 83 83 ASN H H 83 7.923 8.335 -0.412 1
1 984 . 9 1 1 A 83 83 ASN HA H 83 4.808 5.025 -0.217 1
1 989 . 9 1 1 A 83 83 ASN C C 83 174.766 174.715 0.051 1
1 990 . 9 1 1 A 83 83 ASN CA C 83 53.333 54.751 -1.418 1
1 991 . 9 1 1 A 83 83 ASN CB C 83 40.335 41.375 -1.040 1
1 992 . 9 1 1 A 83 83 ASN N N 83 110.765 115.582 -4.817 1
1 994 . 9 1 1 A 84 84 ALA H H 84 7.352 7.091 0.261 1
1 995 . 9 1 1 A 84 84 ALA HA H 84 4.625 4.481 0.144 1
1 999 . 9 1 1 A 84 84 ALA C C 84 176.547 174.959 1.588 1
1 1000 . 9 1 1 A 84 84 ALA CA C 84 52.858 51.822 1.036 1
1 1001 . 9 1 1 A 84 84 ALA CB C 84 21.233 21.841 -0.608 1
1 1002 . 9 1 1 A 84 84 ALA N N 84 119.599 117.457 2.142 1
1 1003 . 9 1 1 A 85 85 THR H H 85 8.374 8.734 -0.360 1
1 1004 . 9 1 1 A 85 85 THR HA H 85 5.014 4.492 0.522 1
1 1009 . 9 1 1 A 85 85 THR C C 85 171.568 173.916 -2.348 1
1 1010 . 9 1 1 A 85 85 THR CA C 85 61.618 62.051 -0.433 1
1 1011 . 9 1 1 A 85 85 THR CB C 85 70.850 69.531 1.319 1
1 1013 . 9 1 1 A 85 85 THR N N 85 119.032 113.739 5.293 1
1 1014 . 9 1 1 A 86 86 TYR H H 86 9.006 9.053 -0.047 1
1 1015 . 9 1 1 A 86 86 TYR HA H 86 4.658 4.983 -0.325 1
1 1022 . 9 1 1 A 86 86 TYR C C 86 173.773 175.277 -1.504 1
1 1023 . 9 1 1 A 86 86 TYR CA C 86 56.938 57.671 -0.733 1
1 1024 . 9 1 1 A 86 86 TYR CB C 86 39.513 40.116 -0.603 1
1 1029 . 9 1 1 A 86 86 TYR N N 86 123.494 127.307 -3.813 1
1 1030 . 9 1 1 A 87 87 PHE H H 87 9.263 8.919 0.344 1
1 1031 . 9 1 1 A 87 87 PHE HA H 87 4.127 4.647 -0.520 1
1 1039 . 9 1 1 A 87 87 PHE C C 87 176.369 174.320 2.049 1
1 1040 . 9 1 1 A 87 87 PHE CA C 87 57.238 55.779 1.459 1
1 1041 . 9 1 1 A 87 87 PHE CB C 87 37.086 38.397 -1.311 1
1 1047 . 9 1 1 A 87 87 PHE N N 87 125.384 119.958 5.426 1
1 1048 . 9 1 1 A 88 88 VAL H H 88 9.023 8.142 0.881 1
1 1049 . 9 1 1 A 88 88 VAL HA H 88 4.162 4.535 -0.373 1
1 1057 . 9 1 1 A 88 88 VAL C C 88 176.390 176.049 0.341 1
1 1058 . 9 1 1 A 88 88 VAL CA C 88 63.975 61.467 2.508 1
1 1059 . 9 1 1 A 88 88 VAL CB C 88 32.378 31.649 0.729 1
1 1062 . 9 1 1 A 88 88 VAL N N 88 127.348 124.088 3.260 1
1 1063 . 9 1 1 A 89 89 GLY H H 89 9.233 8.266 0.967 1
1 1064 . 9 1 1 A 89 89 GLY HA2 H 89 4.293 4.198 0.095 1
1 1065 . 9 1 1 A 89 89 GLY HA3 H 89 4.186 4.291 -0.105 1
1 1066 . 9 1 1 A 89 89 GLY C C 89 172.378 171.368 1.010 1
1 1067 . 9 1 1 A 89 89 GLY CA C 89 43.798 46.223 -2.425 1
1 1068 . 9 1 1 A 89 89 GLY N N 89 116.041 112.490 3.551 1
1 1069 . 9 1 1 A 90 90 GLU H H 90 8.532 8.804 -0.272 1
1 1070 . 9 1 1 A 90 90 GLU HA H 90 4.794 5.060 -0.266 1
1 1075 . 9 1 1 A 90 90 GLU C C 90 174.221 175.290 -1.069 1
1 1076 . 9 1 1 A 90 90 GLU CA C 90 56.393 54.569 1.824 1
1 1077 . 9 1 1 A 90 90 GLU CB C 90 33.182 33.107 0.075 1
1 1079 . 9 1 1 A 90 90 GLU N N 90 120.905 123.897 -2.992 1
1 1080 . 9 1 1 A 91 91 MET H H 91 8.450 8.575 -0.125 1
1 1081 . 9 1 1 A 91 91 MET HA H 91 4.904 4.792 0.112 1
1 1089 . 9 1 1 A 91 91 MET C C 91 173.373 174.474 -1.101 1
1 1090 . 9 1 1 A 91 91 MET CA C 91 52.277 54.746 -2.469 1
1 1091 . 9 1 1 A 91 91 MET CB C 91 32.789 32.100 0.689 1
1 1094 . 9 1 1 A 91 91 MET N N 91 125.173 123.609 1.564 1
1 1095 . 9 1 1 A 92 92 PRO HA H 92 4.358 4.273 0.085 1
1 1102 . 9 1 1 A 92 92 PRO C C 92 177.589 177.513 0.076 1
1 1103 . 9 1 1 A 92 92 PRO CA C 92 63.143 63.587 -0.444 1
1 1104 . 9 1 1 A 92 92 PRO CB C 92 32.083 31.093 0.990 1
1 1107 . 9 1 1 A 93 93 GLY H H 93 8.330 8.236 0.094 1
1 1108 . 9 1 1 A 93 93 GLY HA2 H 93 3.943 4.027 -0.084 1
1 1109 . 9 1 1 A 93 93 GLY HA3 H 93 4.045 4.032 0.013 1
1 1110 . 9 1 1 A 93 93 GLY C C 93 174.730 173.162 1.568 1
1 1111 . 9 1 1 A 93 93 GLY CA C 93 45.276 44.648 0.628 1
1 1112 . 9 1 1 A 93 93 GLY N N 93 109.420 113.029 -3.609 1
1 1113 . 9 1 1 A 94 94 GLY H H 94 8.331 8.487 -0.156 1
1 1114 . 9 1 1 A 94 94 GLY HA2 H 94 3.973 4.184 -0.211 1
1 1115 . 9 1 1 A 94 94 GLY HA3 H 94 3.973 4.188 -0.215 1
1 1116 . 9 1 1 A 94 94 GLY C C 94 174.100 173.176 0.924 1
1 1117 . 9 1 1 A 94 94 GLY CA C 94 45.333 45.395 -0.062 1
1 1118 . 9 1 1 A 94 94 GLY N N 94 108.483 109.219 -0.736 1
1 1119 . 9 1 1 A 95 95 THR H H 95 8.095 8.642 -0.547 1
1 1120 . 9 1 1 A 95 95 THR HA H 95 4.643 4.470 0.173 1
1 1125 . 9 1 1 A 95 95 THR C C 95 173.155 173.865 -0.710 1
1 1126 . 9 1 1 A 95 95 THR CA C 95 59.922 60.622 -0.700 1
1 1127 . 9 1 1 A 95 95 THR CB C 95 69.871 68.626 1.245 1
1 1129 . 9 1 1 A 95 95 THR N N 95 115.860 112.286 3.574 1
1 1130 . 9 1 1 A 96 96 PRO HA H 96 4.400 4.282 0.118 1
1 1137 . 9 1 1 A 96 96 PRO C C 96 177.565 177.381 0.184 1
1 1138 . 9 1 1 A 96 96 PRO CA C 96 64.047 63.734 0.313 1
1 1139 . 9 1 1 A 96 96 PRO CB C 96 31.816 31.276 0.540 1
1 1142 . 9 1 1 A 97 97 GLY H H 97 8.572 8.776 -0.204 1
1 1143 . 9 1 1 A 97 97 GLY HA2 H 97 4.007 3.974 0.033 1
1 1144 . 9 1 1 A 97 97 GLY HA3 H 97 4.007 3.976 0.031 1
1 1145 . 9 1 1 A 97 97 GLY C C 97 174.609 173.408 1.201 1
1 1146 . 9 1 1 A 97 97 GLY CA C 97 45.276 44.753 0.523 1
1 1147 . 9 1 1 A 97 97 GLY N N 97 110.233 112.612 -2.379 1
1 1148 . 9 1 1 A 98 98 GLY H H 98 8.119 8.203 -0.084 1
1 1149 . 9 1 1 A 98 98 GLY HA2 H 98 4.086 4.173 -0.087 1
1 1150 . 9 1 1 A 98 98 GLY HA3 H 98 4.200 4.178 0.022 1
1 1151 . 9 1 1 A 98 98 GLY CA C 98 44.876 45.331 -0.455 1
1 1152 . 9 1 1 A 98 98 GLY N N 98 108.845 107.614 1.231 1
1 1153 . 9 1 1 A 99 99 PRO HA H 99 4.494 4.529 -0.035 1
1 1160 . 9 1 1 A 99 99 PRO C C 99 177.468 177.842 -0.374 1
1 1161 . 9 1 1 A 99 99 PRO CA C 99 63.500 63.831 -0.331 1
1 1162 . 9 1 1 A 99 99 PRO CB C 99 32.013 31.847 0.166 1
1 1165 . 9 1 1 A 100 100 SER H H 100 8.472 8.548 -0.076 1
1 1166 . 9 1 1 A 100 100 SER HA H 100 4.513 4.241 0.272 1
1 1169 . 9 1 1 A 100 100 SER C C 100 175.408 175.651 -0.243 1
1 1170 . 9 1 1 A 100 100 SER CA C 100 58.557 62.242 -3.685 1
1 1171 . 9 1 1 A 100 100 SER CB C 100 63.918 63.299 0.619 1
1 1172 . 9 1 1 A 100 100 SER N N 100 116.038 114.543 1.495 1
1 1173 . 9 1 1 A 101 101 GLY H H 101 8.427 7.613 0.814 1
1 1174 . 9 1 1 A 101 101 GLY HA2 H 101 4.064 4.213 -0.149 1
1 1175 . 9 1 1 A 101 101 GLY HA3 H 101 4.064 4.226 -0.162 1
1 1176 . 9 1 1 A 101 101 GLY C C 101 174.730 172.756 1.974 1
1 1177 . 9 1 1 A 101 101 GLY CA C 101 45.575 45.828 -0.253 1
1 1178 . 9 1 1 A 101 101 GLY N N 101 110.558 105.156 5.402 1
1 1179 . 9 1 1 A 102 102 GLN H H 102 8.416 8.230 0.186 1
1 1180 . 9 1 1 A 102 102 GLN HA H 102 4.383 4.998 -0.615 1
1 1187 . 9 1 1 A 102 102 GLN C C 102 177.346 174.570 2.776 1
1 1188 . 9 1 1 A 102 102 GLN CA C 102 57.080 55.467 1.613 1
1 1189 . 9 1 1 A 102 102 GLN CB C 102 29.235 31.895 -2.660 1
1 1191 . 9 1 1 A 102 102 GLN N N 102 120.112 122.476 -2.364 1
1 1193 . 9 1 1 A 103 103 GLY H H 103 8.713 8.434 0.279 1
1 1194 . 9 1 1 A 103 103 GLY HA2 H 103 4.193 4.271 -0.078 1
1 1195 . 9 1 1 A 103 103 GLY HA3 H 103 4.078 4.284 -0.206 1
1 1196 . 9 1 1 A 103 103 GLY C C 103 175.602 173.433 2.169 1
1 1197 . 9 1 1 A 103 103 GLY CA C 103 46.120 45.894 0.226 1
1 1198 . 9 1 1 A 103 103 GLY N N 103 109.817 111.374 -1.557 1
1 1199 . 9 1 1 A 104 104 ALA H H 104 8.366 8.348 0.018 1
1 1200 . 9 1 1 A 104 104 ALA HA H 104 4.449 4.468 -0.019 1
1 1204 . 9 1 1 A 104 104 ALA C C 104 179.188 178.909 0.279 1
1 1205 . 9 1 1 A 104 104 ALA CA C 104 54.230 53.108 1.122 1
1 1206 . 9 1 1 A 104 104 ALA CB C 104 19.080 19.753 -0.673 1
1 1207 . 9 1 1 A 104 104 ALA N N 104 124.808 121.144 3.664 1
1 1208 . 9 1 1 A 105 105 GLU H H 105 8.576 8.176 0.400 1
1 1209 . 9 1 1 A 105 105 GLU HA H 105 4.161 4.099 0.062 1
1 1214 . 9 1 1 A 105 105 GLU C C 105 179.200 178.915 0.285 1
1 1215 . 9 1 1 A 105 105 GLU CA C 105 59.173 59.188 -0.015 1
1 1216 . 9 1 1 A 105 105 GLU CB C 105 29.194 29.562 -0.368 1
1 1218 . 9 1 1 A 105 105 GLU N N 105 119.238 117.015 2.223 1
1 1219 . 9 1 1 A 106 106 ALA H H 106 8.381 8.270 0.111 1
1 1220 . 9 1 1 A 106 106 ALA HA H 106 4.283 4.106 0.177 1
1 1224 . 9 1 1 A 106 106 ALA C C 106 180.048 180.013 0.035 1
1 1225 . 9 1 1 A 106 106 ALA CA C 106 54.687 55.482 -0.795 1
1 1226 . 9 1 1 A 106 106 ALA CB C 106 18.341 18.885 -0.544 1
1 1227 . 9 1 1 A 106 106 ALA N N 106 123.327 121.461 1.866 1
1 1228 . 9 1 1 A 107 107 ALA H H 107 8.123 7.959 0.164 1
1 1229 . 9 1 1 A 107 107 ALA HA H 107 4.554 4.282 0.272 1
1 1233 . 9 1 1 A 107 107 ALA C C 107 179.757 180.273 -0.516 1
1 1234 . 9 1 1 A 107 107 ALA CA C 107 55.355 55.596 -0.241 1
1 1235 . 9 1 1 A 107 107 ALA CB C 107 18.939 18.328 0.611 1
1 1236 . 9 1 1 A 107 107 ALA N N 107 120.740 119.813 0.927 1
1 1237 . 9 1 1 A 108 108 ARG H H 108 8.403 8.052 0.351 1
1 1238 . 9 1 1 A 108 108 ARG HA H 108 4.254 4.107 0.147 1
1 1245 . 9 1 1 A 108 108 ARG C C 108 179.111 179.570 -0.459 1
1 1246 . 9 1 1 A 108 108 ARG CA C 108 59.015 59.307 -0.292 1
1 1247 . 9 1 1 A 108 108 ARG CB C 108 29.752 29.989 -0.237 1
1 1250 . 9 1 1 A 108 108 ARG N N 108 119.531 118.204 1.327 1
1 1251 . 9 1 1 A 109 109 GLY H H 109 8.182 8.401 -0.219 1
1 1252 . 9 1 1 A 109 109 GLY HA2 H 109 3.822 3.673 0.149 1
1 1253 . 9 1 1 A 109 109 GLY HA3 H 109 3.822 3.695 0.127 1
1 1254 . 9 1 1 A 109 109 GLY C C 109 177.020 176.333 0.687 1
1 1255 . 9 1 1 A 109 109 GLY CA C 109 46.718 47.362 -0.644 1
1 1256 . 9 1 1 A 109 109 GLY N N 109 107.331 108.287 -0.956 1
1 1257 . 9 1 1 A 110 110 TRP H H 110 7.925 7.797 0.128 1
1 1258 . 9 1 1 A 110 110 TRP HA H 110 3.963 4.547 -0.584 1
1 1267 . 9 1 1 A 110 110 TRP C C 110 176.691 177.946 -1.255 1
1 1268 . 9 1 1 A 110 110 TRP CA C 110 62.041 60.424 1.617 1
1 1269 . 9 1 1 A 110 110 TRP CB C 110 28.989 28.967 0.022 1
1 1275 . 9 1 1 A 110 110 TRP N N 110 122.304 122.070 0.234 1
1 1277 . 9 1 1 A 111 111 GLU H H 111 7.946 7.733 0.213 1
1 1278 . 9 1 1 A 111 111 GLU HA H 111 2.594 2.948 -0.354 1
1 1283 . 9 1 1 A 111 111 GLU C C 111 177.976 178.997 -1.021 1
1 1284 . 9 1 1 A 111 111 GLU CA C 111 60.193 59.006 1.187 1
1 1285 . 9 1 1 A 111 111 GLU CB C 111 29.277 29.269 0.008 1
1 1287 . 9 1 1 A 111 111 GLU N N 111 121.755 118.970 2.785 1
1 1288 . 9 1 1 A 112 112 THR H H 112 7.993 7.660 0.333 1
1 1289 . 9 1 1 A 112 112 THR HA H 112 3.722 3.789 -0.067 1
1 1294 . 9 1 1 A 112 112 THR C C 112 176.038 175.873 0.165 1
1 1295 . 9 1 1 A 112 112 THR CA C 112 66.104 66.605 -0.501 1
1 1296 . 9 1 1 A 112 112 THR CB C 112 68.885 68.650 0.235 1
1 1298 . 9 1 1 A 112 112 THR N N 112 112.247 116.097 -3.850 1
1 1299 . 9 1 1 A 113 113 ALA H H 113 7.742 8.349 -0.607 1
1 1300 . 9 1 1 A 113 113 ALA HA H 113 4.029 3.950 0.079 1
1 1304 . 9 1 1 A 113 113 ALA C C 113 180.545 179.838 0.707 1
1 1305 . 9 1 1 A 113 113 ALA CA C 113 55.127 55.310 -0.183 1
1 1306 . 9 1 1 A 113 113 ALA CB C 113 18.854 18.395 0.459 1
1 1307 . 9 1 1 A 113 113 ALA N N 113 123.134 122.585 0.549 1
1 1308 . 9 1 1 A 114 114 ILE H H 114 8.472 8.525 -0.053 1
1 1309 . 9 1 1 A 114 114 ILE HA H 114 3.613 3.741 -0.128 1
1 1319 . 9 1 1 A 114 114 ILE C C 114 176.947 177.924 -0.977 1
1 1320 . 9 1 1 A 114 114 ILE CA C 114 66.016 65.051 0.965 1
1 1321 . 9 1 1 A 114 114 ILE CB C 114 38.335 37.895 0.440 1
1 1325 . 9 1 1 A 114 114 ILE N N 114 118.276 117.640 0.636 1
1 1326 . 9 1 1 A 115 115 ARG H H 115 8.181 8.044 0.137 1
1 1327 . 9 1 1 A 115 115 ARG HA H 115 3.835 3.919 -0.084 1
1 1334 . 9 1 1 A 115 115 ARG C C 115 179.588 179.152 0.436 1
1 1335 . 9 1 1 A 115 115 ARG CA C 115 61.072 60.232 0.840 1
1 1336 . 9 1 1 A 115 115 ARG CB C 115 29.975 30.022 -0.047 1
1 1339 . 9 1 1 A 115 115 ARG N N 115 117.921 119.179 -1.258 1
1 1340 . 9 1 1 A 116 116 GLN H H 116 8.395 8.433 -0.038 1
1 1341 . 9 1 1 A 116 116 GLN HA H 116 4.030 4.056 -0.026 1
1 1348 . 9 1 1 A 116 116 GLN C C 116 178.716 179.098 -0.382 1
1 1349 . 9 1 1 A 116 116 GLN CA C 116 58.790 58.833 -0.043 1
1 1350 . 9 1 1 A 116 116 GLN CB C 116 28.248 28.460 -0.212 1
1 1352 . 9 1 1 A 116 116 GLN N N 116 116.842 118.777 -1.935 1
1 1354 . 9 1 1 A 117 117 ALA H H 117 7.902 8.098 -0.196 1
1 1355 . 9 1 1 A 117 117 ALA HA H 117 4.143 4.131 0.012 1
1 1359 . 9 1 1 A 117 117 ALA C C 117 179.685 180.200 -0.515 1
1 1360 . 9 1 1 A 117 117 ALA CA C 117 54.476 54.972 -0.496 1
1 1361 . 9 1 1 A 117 117 ALA CB C 117 18.300 18.363 -0.063 1
1 1362 . 9 1 1 A 117 117 ALA N N 117 122.828 123.146 -0.318 1
1 1363 . 9 1 1 A 118 118 LEU H H 118 7.904 8.142 -0.238 1
1 1364 . 9 1 1 A 118 118 LEU HA H 118 4.119 4.096 0.023 1
1 1374 . 9 1 1 A 118 118 LEU C C 118 178.437 178.752 -0.315 1
1 1375 . 9 1 1 A 118 118 LEU CA C 118 56.781 57.170 -0.389 1
1 1376 . 9 1 1 A 118 118 LEU CB C 118 42.371 41.801 0.570 1
1 1380 . 9 1 1 A 118 118 LEU N N 118 117.632 120.227 -2.595 1
1 1381 . 9 1 1 A 119 119 MET H H 119 7.673 8.119 -0.446 1
1 1382 . 9 1 1 A 119 119 MET HA H 119 4.442 4.196 0.246 1
1 1390 . 9 1 1 A 119 119 MET C C 119 176.680 178.217 -1.537 1
1 1391 . 9 1 1 A 119 119 MET CA C 119 56.432 58.028 -1.596 1
1 1392 . 9 1 1 A 119 119 MET CB C 119 32.769 31.711 1.058 1
1 1395 . 9 1 1 A 119 119 MET N N 119 117.286 117.487 -0.201 1
1 1396 . 9 1 1 A 120 120 SER H H 120 7.878 7.517 0.361 1
1 1397 . 9 1 1 A 120 120 SER HA H 120 4.500 4.223 0.277 1
1 1400 . 9 1 1 A 120 120 SER C C 120 174.742 176.921 -2.179 1
1 1401 . 9 1 1 A 120 120 SER CA C 120 58.962 60.992 -2.030 1
1 1402 . 9 1 1 A 120 120 SER CB C 120 63.853 62.679 1.174 1
1 1403 . 9 1 1 A 120 120 SER N N 120 115.064 115.370 -0.306 1
1 1404 . 9 1 1 A 121 121 GLY H H 121 8.059 8.240 -0.181 1
1 1405 . 9 1 1 A 121 121 GLY HA2 H 121 4.231 3.761 0.470 1
1 1406 . 9 1 1 A 121 121 GLY HA3 H 121 4.112 3.762 0.350 1
1 1407 . 9 1 1 A 121 121 GLY C C 121 172.065 174.781 -2.716 1
1 1408 . 9 1 1 A 121 121 GLY CA C 121 45.030 47.913 -2.883 1
1 1409 . 9 1 1 A 121 121 GLY N N 121 110.271 108.972 1.299 1
1 1410 . 9 1 1 A 122 122 PRO HA H 122 4.496 4.291 0.205 1
1 1417 . 9 1 1 A 122 122 PRO CA C 122 63.399 65.056 -1.657 1
1 1418 . 9 1 1 A 122 122 PRO CB C 122 32.186 31.791 0.395 1
1 1 . 10 1 1 A 6 6 SER H H 6 8.337 8.494 -0.157 1
1 2 . 10 1 1 A 6 6 SER HA H 6 4.597 4.474 0.123 1
1 5 . 10 1 1 A 6 6 SER C C 6 174.637 175.073 -0.436 1
1 6 . 10 1 1 A 6 6 SER CA C 6 58.469 58.897 -0.428 1
1 7 . 10 1 1 A 6 6 SER CB C 6 64.221 64.129 0.092 1
1 8 . 10 1 1 A 6 6 SER N N 6 117.887 119.806 -1.919 1
1 9 . 10 1 1 A 7 7 GLY H H 7 8.280 8.465 -0.185 1
1 10 . 10 1 1 A 7 7 GLY HA2 H 7 4.063 4.125 -0.062 1
1 11 . 10 1 1 A 7 7 GLY HA3 H 7 4.063 4.128 -0.065 1
1 12 . 10 1 1 A 7 7 GLY C C 7 173.724 173.971 -0.247 1
1 13 . 10 1 1 A 7 7 GLY CA C 7 44.941 45.725 -0.784 1
1 14 . 10 1 1 A 7 7 GLY N N 7 110.151 110.960 -0.809 1
1 15 . 10 1 1 A 8 8 THR H H 8 8.212 7.714 0.498 1
1 16 . 10 1 1 A 8 8 THR HA H 8 4.173 4.569 -0.396 1
1 21 . 10 1 1 A 8 8 THR C C 8 174.723 173.875 0.848 1
1 22 . 10 1 1 A 8 8 THR CA C 8 63.622 63.503 0.119 1
1 23 . 10 1 1 A 8 8 THR CB C 8 69.460 69.016 0.444 1
1 25 . 10 1 1 A 8 8 THR N N 8 116.817 114.946 1.871 1
1 26 . 10 1 1 A 9 9 LEU H H 9 9.374 9.030 0.344 1
1 27 . 10 1 1 A 9 9 LEU HA H 9 4.302 4.258 0.044 1
1 37 . 10 1 1 A 9 9 LEU C C 9 177.468 176.485 0.983 1
1 38 . 10 1 1 A 9 9 LEU CA C 9 55.936 56.152 -0.216 1
1 39 . 10 1 1 A 9 9 LEU CB C 9 42.843 42.748 0.095 1
1 43 . 10 1 1 A 9 9 LEU N N 9 127.798 128.515 -0.717 1
1 44 . 10 1 1 A 10 10 ARG H H 10 7.512 7.232 0.280 1
1 45 . 10 1 1 A 10 10 ARG HA H 10 4.199 4.595 -0.396 1
1 52 . 10 1 1 A 10 10 ARG C C 10 172.501 173.973 -1.472 1
1 53 . 10 1 1 A 10 10 ARG CA C 10 56.165 54.380 1.785 1
1 54 . 10 1 1 A 10 10 ARG CB C 10 32.442 33.206 -0.764 1
1 57 . 10 1 1 A 10 10 ARG N N 10 117.979 116.501 1.478 1
1 58 . 10 1 1 A 11 11 GLU H H 11 8.434 8.723 -0.289 1
1 59 . 10 1 1 A 11 11 GLU HA H 11 5.993 5.763 0.230 1
1 64 . 10 1 1 A 11 11 GLU C C 11 174.800 174.700 0.100 1
1 65 . 10 1 1 A 11 11 GLU CA C 11 54.570 55.226 -0.656 1
1 66 . 10 1 1 A 11 11 GLU CB C 11 34.245 33.254 0.991 1
1 68 . 10 1 1 A 11 11 GLU N N 11 120.782 121.250 -0.468 1
1 69 . 10 1 1 A 12 12 GLY H H 12 8.131 8.256 -0.125 1
1 70 . 10 1 1 A 12 12 GLY HA2 H 12 4.714 3.581 1.133 1
1 71 . 10 1 1 A 12 12 GLY HA3 H 12 3.763 4.181 -0.418 1
1 72 . 10 1 1 A 12 12 GLY C C 12 171.060 171.784 -0.724 1
1 73 . 10 1 1 A 12 12 GLY CA C 12 45.241 45.099 0.142 1
1 74 . 10 1 1 A 12 12 GLY N N 12 107.457 106.363 1.094 1
1 75 . 10 1 1 A 13 13 TRP H H 13 8.783 8.560 0.223 1
1 76 . 10 1 1 A 13 13 TRP HA H 13 5.152 4.815 0.337 1
1 85 . 10 1 1 A 13 13 TRP C C 13 177.528 176.476 1.052 1
1 86 . 10 1 1 A 13 13 TRP CA C 13 57.783 58.768 -0.985 1
1 87 . 10 1 1 A 13 13 TRP CB C 13 30.222 29.905 0.317 1
1 93 . 10 1 1 A 13 13 TRP N N 13 120.792 121.343 -0.551 1
1 95 . 10 1 1 A 14 14 VAL H H 14 9.179 8.973 0.206 1
1 96 . 10 1 1 A 14 14 VAL HA H 14 4.072 4.502 -0.430 1
1 104 . 10 1 1 A 14 14 VAL C C 14 174.981 173.391 1.590 1
1 105 . 10 1 1 A 14 14 VAL CA C 14 61.741 60.141 1.600 1
1 106 . 10 1 1 A 14 14 VAL CB C 14 35.143 34.996 0.147 1
1 109 . 10 1 1 A 14 14 VAL N N 14 125.476 122.886 2.590 1
1 110 . 10 1 1 A 15 15 VAL H H 15 8.403 8.720 -0.317 1
1 111 . 10 1 1 A 15 15 VAL HA H 15 5.532 5.352 0.180 1
1 119 . 10 1 1 A 15 15 VAL C C 15 175.078 174.171 0.907 1
1 120 . 10 1 1 A 15 15 VAL CA C 15 59.489 59.889 -0.400 1
1 121 . 10 1 1 A 15 15 VAL CB C 15 34.210 34.980 -0.770 1
1 124 . 10 1 1 A 15 15 VAL N N 15 126.189 127.010 -0.821 1
1 125 . 10 1 1 A 16 16 HIS H H 16 9.122 8.400 0.722 1
1 126 . 10 1 1 A 16 16 HIS HA H 16 5.823 5.382 0.441 1
1 131 . 10 1 1 A 16 16 HIS C C 16 172.998 172.478 0.520 1
1 132 . 10 1 1 A 16 16 HIS CA C 16 56.253 54.095 2.158 1
1 133 . 10 1 1 A 16 16 HIS CB C 16 34.273 32.858 1.415 1
1 136 . 10 1 1 A 16 16 HIS N N 16 121.152 119.464 1.688 1
1 137 . 10 1 1 A 17 17 TYR H H 17 8.465 8.634 -0.169 1
1 138 . 10 1 1 A 17 17 TYR HA H 17 5.096 4.903 0.193 1
1 145 . 10 1 1 A 17 17 TYR C C 17 173.640 172.975 0.665 1
1 146 . 10 1 1 A 17 17 TYR CA C 17 56.903 56.001 0.902 1
1 147 . 10 1 1 A 17 17 TYR CB C 17 40.103 41.107 -1.004 1
1 152 . 10 1 1 A 17 17 TYR N N 17 115.558 117.080 -1.522 1
1 153 . 10 1 1 A 18 18 SER H H 18 9.122 8.726 0.396 1
1 154 . 10 1 1 A 18 18 SER HA H 18 6.144 5.345 0.799 1
1 157 . 10 1 1 A 18 18 SER C C 18 173.204 175.177 -1.973 1
1 158 . 10 1 1 A 18 18 SER CA C 18 56.640 56.679 -0.039 1
1 159 . 10 1 1 A 18 18 SER CB C 18 68.788 66.012 2.776 1
1 160 . 10 1 1 A 18 18 SER N N 18 118.846 115.964 2.882 1
1 161 . 10 1 1 A 19 19 ASN H H 19 9.053 8.660 0.393 1
1 162 . 10 1 1 A 19 19 ASN HA H 19 4.473 4.905 -0.432 1
1 167 . 10 1 1 A 19 19 ASN C C 19 175.396 174.972 0.424 1
1 168 . 10 1 1 A 19 19 ASN CA C 19 55.373 52.249 3.124 1
1 169 . 10 1 1 A 19 19 ASN CB C 19 36.900 38.072 -1.172 1
1 170 . 10 1 1 A 19 19 ASN N N 19 113.712 117.843 -4.131 1
1 172 . 10 1 1 A 20 20 LYS H H 20 7.677 7.833 -0.156 1
1 173 . 10 1 1 A 20 20 LYS HA H 20 4.413 4.500 -0.087 1
1 182 . 10 1 1 A 20 20 LYS C C 20 176.078 177.521 -1.443 1
1 183 . 10 1 1 A 20 20 LYS CA C 20 55.679 56.945 -1.266 1
1 184 . 10 1 1 A 20 20 LYS CB C 20 33.023 35.228 -2.205 1
1 188 . 10 1 1 A 20 20 LYS N N 20 117.213 118.466 -1.253 1
1 189 . 10 1 1 A 21 21 ASP H H 21 7.395 7.908 -0.513 1
1 190 . 10 1 1 A 21 21 ASP HA H 21 4.808 4.761 0.047 1
1 193 . 10 1 1 A 21 21 ASP C C 21 176.413 175.985 0.428 1
1 194 . 10 1 1 A 21 21 ASP CA C 21 53.983 53.835 0.148 1
1 195 . 10 1 1 A 21 21 ASP CB C 21 41.199 42.534 -1.335 1
1 196 . 10 1 1 A 21 21 ASP N N 21 119.879 115.741 4.138 1
1 197 . 10 1 1 A 22 22 THR H H 22 8.593 8.094 0.499 1
1 198 . 10 1 1 A 22 22 THR HA H 22 4.352 4.108 0.244 1
1 203 . 10 1 1 A 22 22 THR C C 22 172.913 173.946 -1.033 1
1 204 . 10 1 1 A 22 22 THR CA C 22 62.691 62.885 -0.194 1
1 205 . 10 1 1 A 22 22 THR CB C 22 68.332 66.420 1.912 1
1 207 . 10 1 1 A 22 22 THR N N 22 116.299 112.828 3.471 1
1 208 . 10 1 1 A 23 23 LEU H H 23 7.645 7.943 -0.298 1
1 209 . 10 1 1 A 23 23 LEU HA H 23 4.318 4.428 -0.110 1
1 219 . 10 1 1 A 23 23 LEU C C 23 176.692 175.717 0.975 1
1 220 . 10 1 1 A 23 23 LEU CA C 23 54.617 53.766 0.851 1
1 221 . 10 1 1 A 23 23 LEU CB C 23 41.939 40.395 1.544 1
1 225 . 10 1 1 A 23 23 LEU N N 23 123.606 121.671 1.935 1
1 226 . 10 1 1 A 24 24 ARG H H 24 8.563 7.435 1.128 1
1 227 . 10 1 1 A 24 24 ARG HA H 24 4.373 4.506 -0.133 1
1 235 . 10 1 1 A 24 24 ARG C C 24 176.584 175.928 0.656 1
1 236 . 10 1 1 A 24 24 ARG CA C 24 57.854 56.722 1.132 1
1 237 . 10 1 1 A 24 24 ARG CB C 24 31.126 30.253 0.873 1
1 240 . 10 1 1 A 24 24 ARG N N 24 127.152 121.945 5.207 1
1 242 . 10 1 1 A 25 25 LYS H H 25 8.633 8.675 -0.042 1
1 243 . 10 1 1 A 25 25 LYS HA H 25 4.513 4.670 -0.157 1
1 251 . 10 1 1 A 25 25 LYS C C 25 173.567 174.418 -0.851 1
1 252 . 10 1 1 A 25 25 LYS CA C 25 54.792 54.951 -0.159 1
1 253 . 10 1 1 A 25 25 LYS CB C 25 37.416 33.640 3.776 1
1 257 . 10 1 1 A 25 25 LYS N N 25 122.682 125.209 -2.527 1
1 258 . 10 1 1 A 26 26 ARG H H 26 8.303 8.812 -0.509 1
1 259 . 10 1 1 A 26 26 ARG HA H 26 5.153 4.898 0.255 1
1 266 . 10 1 1 A 26 26 ARG C C 26 174.554 175.138 -0.584 1
1 267 . 10 1 1 A 26 26 ARG CA C 26 55.083 54.846 0.237 1
1 268 . 10 1 1 A 26 26 ARG CB C 26 32.789 31.670 1.119 1
1 271 . 10 1 1 A 26 26 ARG N N 26 121.819 125.291 -3.472 1
1 272 . 10 1 1 A 27 27 HIS H H 27 8.793 8.792 0.001 1
1 273 . 10 1 1 A 27 27 HIS HA H 27 5.155 5.386 -0.231 1
1 278 . 10 1 1 A 27 27 HIS CA C 27 56.904 54.794 2.110 1
1 279 . 10 1 1 A 27 27 HIS CB C 27 34.683 31.416 3.267 1
1 282 . 10 1 1 A 27 27 HIS N N 27 122.102 120.591 1.511 1
1 283 . 10 1 1 A 28 28 TYR H H 28 9.273 8.314 0.959 1
1 284 . 10 1 1 A 28 28 TYR HA H 28 4.332 4.273 0.059 1
1 291 . 10 1 1 A 28 28 TYR C C 28 174.730 175.035 -0.305 1
1 292 . 10 1 1 A 28 28 TYR CA C 28 58.680 57.213 1.467 1
1 293 . 10 1 1 A 28 28 TYR CB C 28 38.673 37.831 0.842 1
1 298 . 10 1 1 A 28 28 TYR N N 28 125.605 121.305 4.300 1
1 299 . 10 1 1 A 29 29 TRP H H 29 9.273 8.924 0.349 1
1 300 . 10 1 1 A 29 29 TRP HA H 29 5.543 4.946 0.597 1
1 309 . 10 1 1 A 29 29 TRP C C 29 176.172 176.783 -0.611 1
1 310 . 10 1 1 A 29 29 TRP CA C 29 56.658 57.371 -0.713 1
1 311 . 10 1 1 A 29 29 TRP CB C 29 32.154 30.730 1.424 1
1 317 . 10 1 1 A 29 29 TRP N N 29 131.340 128.312 3.028 1
1 318 . 10 1 1 A 30 30 ARG H H 30 9.164 9.355 -0.191 1
1 319 . 10 1 1 A 30 30 ARG HA H 30 5.302 5.397 -0.095 1
1 327 . 10 1 1 A 30 30 ARG C C 30 174.774 174.420 0.354 1
1 328 . 10 1 1 A 30 30 ARG CA C 30 56.271 55.033 1.238 1
1 329 . 10 1 1 A 30 30 ARG CB C 30 34.203 33.476 0.727 1
1 332 . 10 1 1 A 30 30 ARG N N 30 116.040 121.813 -5.773 1
1 334 . 10 1 1 A 31 31 LEU H H 31 9.273 9.663 -0.390 1
1 335 . 10 1 1 A 31 31 LEU HA H 31 5.324 5.392 -0.068 1
1 345 . 10 1 1 A 31 31 LEU C C 31 174.488 174.498 -0.010 1
1 346 . 10 1 1 A 31 31 LEU CA C 31 53.807 53.462 0.345 1
1 347 . 10 1 1 A 31 31 LEU CB C 31 46.667 45.596 1.071 1
1 351 . 10 1 1 A 31 31 LEU N N 31 127.075 127.401 -0.326 1
1 352 . 10 1 1 A 32 32 ASP H H 32 8.854 8.854 0.000 1
1 353 . 10 1 1 A 32 32 ASP HA H 32 4.902 5.092 -0.190 1
1 356 . 10 1 1 A 32 32 ASP C C 32 173.474 176.598 -3.124 1
1 357 . 10 1 1 A 32 32 ASP CA C 32 53.104 52.230 0.874 1
1 358 . 10 1 1 A 32 32 ASP CB C 32 42.931 44.106 -1.175 1
1 359 . 10 1 1 A 32 32 ASP N N 32 129.349 125.331 4.018 1
1 360 . 10 1 1 A 33 33 CYS H H 33 8.153 8.828 -0.675 1
1 361 . 10 1 1 A 33 33 CYS HA H 33 4.323 4.398 -0.075 1
1 364 . 10 1 1 A 33 33 CYS C C 33 174.476 174.299 0.177 1
1 365 . 10 1 1 A 33 33 CYS CA C 33 59.853 59.769 0.084 1
1 366 . 10 1 1 A 33 33 CYS CB C 33 27.508 26.575 0.933 1
1 367 . 10 1 1 A 33 33 CYS N N 33 108.439 118.879 -10.440 1
1 368 . 10 1 1 A 34 34 LYS H H 34 9.144 7.760 1.384 1
1 369 . 10 1 1 A 34 34 LYS HA H 34 4.616 4.454 0.162 1
1 378 . 10 1 1 A 34 34 LYS C C 34 177.601 176.246 1.355 1
1 379 . 10 1 1 A 34 34 LYS CA C 34 57.185 56.848 0.337 1
1 380 . 10 1 1 A 34 34 LYS CB C 34 35.623 35.160 0.463 1
1 384 . 10 1 1 A 34 34 LYS N N 34 119.884 118.224 1.660 1
1 385 . 10 1 1 A 35 35 CYS H H 35 9.102 7.769 1.333 1
1 386 . 10 1 1 A 35 35 CYS HA H 35 4.935 4.837 0.098 1
1 389 . 10 1 1 A 35 35 CYS C C 35 172.283 172.302 -0.019 1
1 390 . 10 1 1 A 35 35 CYS CA C 35 57.748 56.859 0.889 1
1 391 . 10 1 1 A 35 35 CYS CB C 35 31.537 30.752 0.785 1
1 392 . 10 1 1 A 35 35 CYS N N 35 120.317 113.928 6.389 1
1 393 . 10 1 1 A 36 36 ILE H H 36 8.213 8.974 -0.761 1
1 394 . 10 1 1 A 36 36 ILE HA H 36 4.617 4.944 -0.327 1
1 404 . 10 1 1 A 36 36 ILE C C 36 175.312 175.079 0.233 1
1 405 . 10 1 1 A 36 36 ILE CA C 36 60.967 60.374 0.593 1
1 406 . 10 1 1 A 36 36 ILE CB C 36 39.718 38.757 0.961 1
1 410 . 10 1 1 A 36 36 ILE N N 36 121.905 119.546 2.359 1
1 411 . 10 1 1 A 37 37 THR H H 37 9.076 8.784 0.292 1
1 412 . 10 1 1 A 37 37 THR HA H 37 4.364 4.585 -0.221 1
1 417 . 10 1 1 A 37 37 THR CA C 37 61.834 62.474 -0.640 1
1 418 . 10 1 1 A 37 37 THR CB C 37 69.237 70.133 -0.896 1
1 420 . 10 1 1 A 37 37 THR N N 37 122.500 123.515 -1.015 1
1 421 . 10 1 1 A 38 38 LEU H H 38 8.263 8.411 -0.148 1
1 422 . 10 1 1 A 38 38 LEU HA H 38 4.445 5.178 -0.733 1
1 432 . 10 1 1 A 38 38 LEU CA C 38 55.611 53.003 2.608 1
1 433 . 10 1 1 A 38 38 LEU CB C 38 42.702 45.670 -2.968 1
1 437 . 10 1 1 A 38 38 LEU N N 38 126.987 124.110 2.877 1
1 438 . 10 1 1 A 39 39 PHE H H 39 9.520 8.549 0.971 1
1 439 . 10 1 1 A 39 39 PHE HA H 39 4.998 5.126 -0.128 1
1 447 . 10 1 1 A 39 39 PHE CA C 39 57.331 56.292 1.039 1
1 448 . 10 1 1 A 39 39 PHE CB C 39 42.453 41.096 1.357 1
1 454 . 10 1 1 A 39 39 PHE N N 39 120.545 120.379 0.166 1
1 455 . 10 1 1 A 40 40 GLN H H 40 9.878 8.645 1.233 1
1 456 . 10 1 1 A 40 40 GLN HA H 40 4.376 4.165 0.211 1
1 463 . 10 1 1 A 40 40 GLN CA C 40 59.513 58.248 1.265 1
1 464 . 10 1 1 A 40 40 GLN CB C 40 29.317 28.410 0.907 1
1 467 . 10 1 1 A 41 41 ASN H H 41 7.732 7.986 -0.254 1
1 468 . 10 1 1 A 41 41 ASN HA H 41 4.812 5.178 -0.366 1
1 473 . 10 1 1 A 41 41 ASN CA C 41 52.618 51.945 0.673 1
1 474 . 10 1 1 A 41 41 ASN CB C 41 39.362 42.093 -2.731 1
1 475 . 10 1 1 A 41 41 ASN N N 41 107.613 116.448 -8.835 1
1 477 . 10 1 1 A 42 42 ASN HA H 42 3.476 4.339 -0.863 1
1 482 . 10 1 1 A 42 42 ASN C C 42 173.607 178.040 -4.433 1
1 483 . 10 1 1 A 42 42 ASN CA C 42 54.888 55.645 -0.757 1
1 484 . 10 1 1 A 42 42 ASN CB C 42 35.613 38.101 -2.488 1
1 486 . 10 1 1 A 43 43 THR H H 43 8.394 7.779 0.615 1
1 487 . 10 1 1 A 43 43 THR HA H 43 4.403 4.145 0.258 1
1 492 . 10 1 1 A 43 43 THR C C 43 174.464 174.911 -0.447 1
1 493 . 10 1 1 A 43 43 THR CA C 43 61.978 65.703 -3.725 1
1 494 . 10 1 1 A 43 43 THR CB C 43 70.036 68.433 1.603 1
1 496 . 10 1 1 A 43 43 THR N N 43 111.795 110.305 1.490 1
1 497 . 10 1 1 A 44 44 THR H H 44 8.058 7.680 0.378 1
1 498 . 10 1 1 A 44 44 THR HA H 44 4.464 4.257 0.207 1
1 503 . 10 1 1 A 44 44 THR CA C 44 61.599 62.691 -1.092 1
1 504 . 10 1 1 A 44 44 THR CB C 44 69.137 69.304 -0.167 1
1 506 . 10 1 1 A 44 44 THR N N 44 116.514 116.532 -0.018 1
1 507 . 10 1 1 A 45 45 ASN H H 45 6.653 8.906 -2.253 1
1 508 . 10 1 1 A 45 45 ASN HA H 45 4.945 4.848 0.097 1
1 513 . 10 1 1 A 45 45 ASN CA C 45 53.227 55.164 -1.937 1
1 514 . 10 1 1 A 45 45 ASN CB C 45 38.483 39.348 -0.865 1
1 516 . 10 1 1 A 46 46 ARG H H 46 8.213 7.623 0.590 1
1 517 . 10 1 1 A 46 46 ARG HA H 46 4.583 4.465 0.118 1
1 524 . 10 1 1 A 46 46 ARG CA C 46 55.487 55.846 -0.359 1
1 525 . 10 1 1 A 46 46 ARG CB C 46 31.153 30.787 0.366 1
1 528 . 10 1 1 A 46 46 ARG N N 46 121.652 116.734 4.918 1
1 529 . 10 1 1 A 47 47 TYR H H 47 7.973 8.755 -0.782 1
1 536 . 10 1 1 A 47 47 TYR CB C 47 39.356 39.493 -0.137 1
1 541 . 10 1 1 A 48 48 TYR H H 48 9.023 8.568 0.455 1
1 542 . 10 1 1 A 48 48 TYR HA H 48 4.662 3.851 0.811 1
1 549 . 10 1 1 A 48 48 TYR CB C 48 39.863 39.332 0.531 1
1 554 . 10 1 1 A 48 48 TYR N N 48 121.223 122.233 -1.010 1
1 555 . 10 1 1 A 49 49 LYS H H 49 7.134 7.718 -0.584 1
1 556 . 10 1 1 A 49 49 LYS HA H 49 4.283 4.656 -0.373 1
1 565 . 10 1 1 A 49 49 LYS CA C 49 55.167 54.421 0.746 1
1 566 . 10 1 1 A 49 49 LYS CB C 49 36.699 35.724 0.975 1
1 570 . 10 1 1 A 49 49 LYS N N 49 117.339 114.418 2.921 1
1 571 . 10 1 1 A 50 50 GLU H H 50 8.411 8.598 -0.187 1
1 572 . 10 1 1 A 50 50 GLU HA H 50 4.583 4.799 -0.216 1
1 577 . 10 1 1 A 50 50 GLU CA C 50 54.592 55.337 -0.745 1
1 578 . 10 1 1 A 50 50 GLU CB C 50 33.263 33.511 -0.248 1
1 580 . 10 1 1 A 50 50 GLU N N 50 123.825 119.332 4.493 1
1 581 . 10 1 1 A 51 51 ILE H H 51 9.225 9.205 0.020 1
1 582 . 10 1 1 A 51 51 ILE HA H 51 4.277 4.613 -0.336 1
1 592 . 10 1 1 A 51 51 ILE CA C 51 58.182 58.153 0.029 1
1 593 . 10 1 1 A 51 51 ILE CB C 51 39.663 38.292 1.371 1
1 597 . 10 1 1 A 51 51 ILE N N 51 125.271 126.417 -1.146 1
1 598 . 10 1 1 A 52 52 PRO HA H 52 4.543 4.638 -0.095 1
1 605 . 10 1 1 A 52 52 PRO C C 52 178.340 178.081 0.259 1
1 606 . 10 1 1 A 52 52 PRO CA C 52 62.726 62.905 -0.179 1
1 607 . 10 1 1 A 52 52 PRO CB C 52 32.003 31.735 0.268 1
1 610 . 10 1 1 A 53 53 LEU H H 53 8.723 8.515 0.208 1
1 611 . 10 1 1 A 53 53 LEU HA H 53 3.891 3.871 0.020 1
1 621 . 10 1 1 A 53 53 LEU C C 53 179.673 179.061 0.612 1
1 622 . 10 1 1 A 53 53 LEU CA C 53 58.205 57.490 0.715 1
1 623 . 10 1 1 A 53 53 LEU CB C 53 40.171 41.325 -1.154 1
1 627 . 10 1 1 A 53 53 LEU N N 53 125.150 124.219 0.931 1
1 628 . 10 1 1 A 54 54 SER H H 54 8.360 8.128 0.232 1
1 629 . 10 1 1 A 54 54 SER HA H 54 4.164 4.065 0.099 1
1 632 . 10 1 1 A 54 54 SER C C 54 175.517 177.359 -1.842 1
1 633 . 10 1 1 A 54 54 SER CA C 54 60.193 61.458 -1.265 1
1 634 . 10 1 1 A 54 54 SER CB C 54 62.617 62.849 -0.232 1
1 635 . 10 1 1 A 54 54 SER N N 54 111.266 114.424 -3.158 1
1 636 . 10 1 1 A 55 55 GLU H H 55 7.666 8.229 -0.563 1
1 637 . 10 1 1 A 55 55 GLU HA H 55 4.363 4.087 0.276 1
1 642 . 10 1 1 A 55 55 GLU C C 55 176.753 177.990 -1.237 1
1 643 . 10 1 1 A 55 55 GLU CA C 55 56.200 58.992 -2.792 1
1 644 . 10 1 1 A 55 55 GLU CB C 55 30.526 29.292 1.234 1
1 646 . 10 1 1 A 55 55 GLU N N 55 119.485 120.124 -0.639 1
1 647 . 10 1 1 A 56 56 ILE H H 56 7.601 7.034 0.567 1
1 648 . 10 1 1 A 56 56 ILE HA H 56 3.793 3.922 -0.129 1
1 658 . 10 1 1 A 56 56 ILE C C 56 175.142 175.922 -0.780 1
1 659 . 10 1 1 A 56 56 ILE CA C 56 63.518 62.369 1.149 1
1 660 . 10 1 1 A 56 56 ILE CB C 56 37.169 37.840 -0.671 1
1 664 . 10 1 1 A 56 56 ILE N N 56 120.430 120.136 0.294 1
1 665 . 10 1 1 A 57 57 LEU H H 57 9.263 9.294 -0.031 1
1 666 . 10 1 1 A 57 57 LEU HA H 57 4.343 4.402 -0.059 1
1 676 . 10 1 1 A 57 57 LEU C C 57 177.898 176.492 1.406 1
1 677 . 10 1 1 A 57 57 LEU CA C 57 56.569 55.824 0.745 1
1 678 . 10 1 1 A 57 57 LEU CB C 57 41.980 42.704 -0.724 1
1 682 . 10 1 1 A 57 57 LEU N N 57 129.464 128.910 0.554 1
1 683 . 10 1 1 A 58 58 THR H H 58 7.414 7.247 0.167 1
1 684 . 10 1 1 A 58 58 THR HA H 58 4.512 4.917 -0.405 1
1 689 . 10 1 1 A 58 58 THR C C 58 171.314 172.641 -1.327 1
1 690 . 10 1 1 A 58 58 THR CA C 58 60.562 61.248 -0.686 1
1 691 . 10 1 1 A 58 58 THR CB C 58 70.803 73.204 -2.401 1
1 693 . 10 1 1 A 58 58 THR N N 58 109.129 110.291 -1.162 1
1 694 . 10 1 1 A 59 59 VAL H H 59 8.152 8.475 -0.323 1
1 695 . 10 1 1 A 59 59 VAL HA H 59 5.061 5.128 -0.067 1
1 703 . 10 1 1 A 59 59 VAL C C 59 174.985 174.950 0.035 1
1 704 . 10 1 1 A 59 59 VAL CA C 59 61.354 61.159 0.195 1
1 705 . 10 1 1 A 59 59 VAL CB C 59 33.855 33.979 -0.124 1
1 708 . 10 1 1 A 59 59 VAL N N 59 123.676 124.663 -0.987 1
1 709 . 10 1 1 A 60 60 GLU H H 60 9.074 8.675 0.399 1
1 710 . 10 1 1 A 60 60 GLU HA H 60 4.977 4.852 0.125 1
1 715 . 10 1 1 A 60 60 GLU C C 60 176.063 175.233 0.830 1
1 716 . 10 1 1 A 60 60 GLU CA C 60 53.807 54.365 -0.558 1
1 717 . 10 1 1 A 60 60 GLU CB C 60 33.739 33.573 0.166 1
1 719 . 10 1 1 A 60 60 GLU N N 60 125.125 126.207 -1.082 1
1 720 . 10 1 1 A 61 61 SER H H 61 8.763 8.756 0.007 1
1 721 . 10 1 1 A 61 61 SER HA H 61 4.452 5.004 -0.552 1
1 724 . 10 1 1 A 61 61 SER C C 61 173.288 174.158 -0.870 1
1 725 . 10 1 1 A 61 61 SER CA C 61 59.384 58.045 1.339 1
1 726 . 10 1 1 A 61 61 SER CB C 61 63.390 64.482 -1.092 1
1 727 . 10 1 1 A 61 61 SER N N 61 117.523 118.337 -0.814 1
1 728 . 10 1 1 A 62 62 ALA H H 62 7.293 8.969 -1.676 1
1 729 . 10 1 1 A 62 62 ALA HA H 62 3.817 4.406 -0.589 1
1 733 . 10 1 1 A 62 62 ALA C C 62 176.717 177.773 -1.056 1
1 734 . 10 1 1 A 62 62 ALA CA C 62 53.966 53.038 0.928 1
1 735 . 10 1 1 A 62 62 ALA CB C 62 18.640 18.548 0.092 1
1 736 . 10 1 1 A 62 62 ALA N N 62 122.650 126.790 -4.140 1
1 737 . 10 1 1 A 63 63 GLN H H 63 8.736 8.162 0.574 1
1 738 . 10 1 1 A 63 63 GLN HA H 63 4.445 4.675 -0.230 1
1 745 . 10 1 1 A 63 63 GLN C C 63 173.700 174.822 -1.122 1
1 746 . 10 1 1 A 63 63 GLN CA C 63 56.376 55.694 0.682 1
1 747 . 10 1 1 A 63 63 GLN CB C 63 31.515 30.991 0.524 1
1 749 . 10 1 1 A 63 63 GLN N N 63 120.251 119.425 0.826 1
1 751 . 10 1 1 A 64 64 ASN H H 64 9.272 7.157 2.115 1
1 752 . 10 1 1 A 64 64 ASN HA H 64 4.906 5.071 -0.165 1
1 757 . 10 1 1 A 64 64 ASN C C 64 174.754 175.026 -0.272 1
1 758 . 10 1 1 A 64 64 ASN CA C 64 51.837 51.933 -0.096 1
1 759 . 10 1 1 A 64 64 ASN CB C 64 38.156 40.145 -1.989 1
1 760 . 10 1 1 A 64 64 ASN N N 64 122.346 118.562 3.784 1
1 762 . 10 1 1 A 65 65 PHE H H 65 8.854 9.044 -0.190 1
1 763 . 10 1 1 A 65 65 PHE HA H 65 4.947 5.124 -0.177 1
1 771 . 10 1 1 A 65 65 PHE C C 65 177.274 175.908 1.366 1
1 772 . 10 1 1 A 65 65 PHE CA C 65 57.519 57.226 0.293 1
1 773 . 10 1 1 A 65 65 PHE CB C 65 38.485 38.840 -0.355 1
1 779 . 10 1 1 A 65 65 PHE N N 65 123.638 125.869 -2.231 1
1 780 . 10 1 1 A 66 66 SER H H 66 8.163 8.235 -0.072 1
1 781 . 10 1 1 A 66 66 SER HA H 66 4.393 4.496 -0.103 1
1 784 . 10 1 1 A 66 66 SER C C 66 175.699 173.628 2.071 1
1 785 . 10 1 1 A 66 66 SER CA C 66 60.791 58.919 1.872 1
1 786 . 10 1 1 A 66 66 SER CB C 66 64.591 62.785 1.806 1
1 787 . 10 1 1 A 66 66 SER N N 66 113.913 115.210 -1.297 1
1 788 . 10 1 1 A 67 67 LEU H H 67 8.574 7.745 0.829 1
1 789 . 10 1 1 A 67 67 LEU HA H 67 4.302 4.380 -0.078 1
1 799 . 10 1 1 A 67 67 LEU C C 67 176.269 176.618 -0.349 1
1 800 . 10 1 1 A 67 67 LEU CA C 67 55.601 55.940 -0.339 1
1 801 . 10 1 1 A 67 67 LEU CB C 67 42.021 43.816 -1.795 1
1 805 . 10 1 1 A 67 67 LEU N N 67 121.264 121.086 0.178 1
1 806 . 10 1 1 A 68 68 VAL H H 68 6.921 7.588 -0.667 1
1 807 . 10 1 1 A 68 68 VAL HA H 68 4.473 4.177 0.296 1
1 815 . 10 1 1 A 68 68 VAL C C 68 173.809 174.996 -1.187 1
1 816 . 10 1 1 A 68 68 VAL CA C 68 58.047 60.570 -2.523 1
1 817 . 10 1 1 A 68 68 VAL CB C 68 32.295 32.072 0.223 1
1 820 . 10 1 1 A 68 68 VAL N N 68 111.287 115.964 -4.677 1
1 821 . 10 1 1 A 69 69 PRO HA H 69 4.658 4.705 -0.047 1
1 828 . 10 1 1 A 69 69 PRO CA C 69 61.747 61.519 0.228 1
1 829 . 10 1 1 A 69 69 PRO CB C 69 30.693 31.637 -0.944 1
1 832 . 10 1 1 A 70 70 PRO HA H 70 4.414 4.256 0.158 1
1 839 . 10 1 1 A 70 70 PRO CA C 70 63.997 63.765 0.232 1
1 840 . 10 1 1 A 70 70 PRO CB C 70 31.602 31.255 0.347 1
1 843 . 10 1 1 A 71 71 GLY H H 71 8.824 8.881 -0.057 1
1 844 . 10 1 1 A 71 71 GLY HA2 H 71 3.703 3.890 -0.187 1
1 845 . 10 1 1 A 71 71 GLY HA3 H 71 4.193 3.896 0.297 1
1 846 . 10 1 1 A 71 71 GLY C C 71 174.052 174.524 -0.472 1
1 847 . 10 1 1 A 71 71 GLY CA C 71 45.065 45.136 -0.071 1
1 848 . 10 1 1 A 71 71 GLY N N 71 111.845 112.805 -0.960 1
1 849 . 10 1 1 A 72 72 THR H H 72 7.597 7.205 0.392 1
1 850 . 10 1 1 A 72 72 THR HA H 72 4.133 4.123 0.010 1
1 855 . 10 1 1 A 72 72 THR CA C 72 63.129 63.486 -0.357 1
1 856 . 10 1 1 A 72 72 THR CB C 72 69.560 68.840 0.720 1
1 858 . 10 1 1 A 72 72 THR N N 72 117.485 115.670 1.815 1
1 859 . 10 1 1 A 73 73 ASN H H 73 9.280 8.500 0.780 1
1 860 . 10 1 1 A 73 73 ASN HA H 73 4.786 4.605 0.181 1
1 865 . 10 1 1 A 73 73 ASN CA C 73 52.009 52.063 -0.054 1
1 866 . 10 1 1 A 73 73 ASN CB C 73 37.553 38.364 -0.811 1
1 867 . 10 1 1 A 73 73 ASN N N 73 127.641 125.341 2.300 1
1 869 . 10 1 1 A 74 74 PRO HA H 74 4.752 4.789 -0.037 1
1 876 . 10 1 1 A 74 74 PRO C C 74 175.190 176.432 -1.242 1
1 877 . 10 1 1 A 74 74 PRO CA C 74 63.395 62.488 0.907 1
1 878 . 10 1 1 A 74 74 PRO CB C 74 33.164 32.817 0.347 1
1 881 . 10 1 1 A 75 75 HIS H H 75 8.025 8.828 -0.803 1
1 882 . 10 1 1 A 75 75 HIS HA H 75 5.047 5.010 0.037 1
1 887 . 10 1 1 A 75 75 HIS C C 75 172.562 175.777 -3.215 1
1 888 . 10 1 1 A 75 75 HIS CA C 75 54.336 53.826 0.510 1
1 889 . 10 1 1 A 75 75 HIS CB C 75 30.956 33.050 -2.094 1
1 892 . 10 1 1 A 75 75 HIS N N 75 116.198 116.927 -0.729 1
1 893 . 10 1 1 A 76 76 CYS H H 76 8.343 9.283 -0.940 1
1 894 . 10 1 1 A 76 76 CYS HA H 76 4.594 4.514 0.080 1
1 897 . 10 1 1 A 76 76 CYS C C 76 175.651 175.296 0.355 1
1 898 . 10 1 1 A 76 76 CYS CA C 76 61.066 61.594 -0.528 1
1 899 . 10 1 1 A 76 76 CYS CB C 76 30.193 29.159 1.034 1
1 900 . 10 1 1 A 76 76 CYS N N 76 113.289 118.302 -5.013 1
1 901 . 10 1 1 A 77 77 PHE H H 77 8.433 8.046 0.387 1
1 902 . 10 1 1 A 77 77 PHE HA H 77 5.105 5.511 -0.406 1
1 910 . 10 1 1 A 77 77 PHE C C 77 171.822 173.182 -1.360 1
1 911 . 10 1 1 A 77 77 PHE CA C 77 56.874 55.575 1.299 1
1 912 . 10 1 1 A 77 77 PHE CB C 77 39.393 42.920 -3.527 1
1 918 . 10 1 1 A 77 77 PHE N N 77 114.874 116.151 -1.277 1
1 919 . 10 1 1 A 78 78 GLU H H 78 9.823 9.111 0.712 1
1 920 . 10 1 1 A 78 78 GLU HA H 78 5.333 5.128 0.205 1
1 925 . 10 1 1 A 78 78 GLU C C 78 175.602 175.510 0.092 1
1 926 . 10 1 1 A 78 78 GLU CA C 78 54.212 54.943 -0.731 1
1 927 . 10 1 1 A 78 78 GLU CB C 78 31.702 32.628 -0.926 1
1 929 . 10 1 1 A 78 78 GLU N N 78 121.074 118.810 2.264 1
1 930 . 10 1 1 A 79 79 ILE H H 79 9.093 9.063 0.030 1
1 931 . 10 1 1 A 79 79 ILE HA H 79 4.637 4.621 0.016 1
1 941 . 10 1 1 A 79 79 ILE C C 79 174.476 175.228 -0.752 1
1 942 . 10 1 1 A 79 79 ILE CA C 79 60.932 60.778 0.154 1
1 943 . 10 1 1 A 79 79 ILE CB C 79 40.803 37.342 3.461 1
1 947 . 10 1 1 A 79 79 ILE N N 79 121.382 125.492 -4.110 1
1 948 . 10 1 1 A 80 80 VAL H H 80 8.841 7.920 0.921 1
1 949 . 10 1 1 A 80 80 VAL HA H 80 4.425 3.897 0.528 1
1 957 . 10 1 1 A 80 80 VAL C C 80 175.930 175.382 0.548 1
1 958 . 10 1 1 A 80 80 VAL CA C 80 63.324 63.242 0.082 1
1 959 . 10 1 1 A 80 80 VAL CB C 80 32.783 31.157 1.626 1
1 962 . 10 1 1 A 80 80 VAL N N 80 128.970 127.146 1.824 1
1 963 . 10 1 1 A 81 81 THR H H 81 8.303 7.727 0.576 1
1 964 . 10 1 1 A 81 81 THR HA H 81 5.264 4.732 0.532 1
1 969 . 10 1 1 A 81 81 THR C C 81 173.664 174.531 -0.867 1
1 970 . 10 1 1 A 81 81 THR CA C 81 59.540 59.904 -0.364 1
1 971 . 10 1 1 A 81 81 THR CB C 81 72.197 71.036 1.161 1
1 973 . 10 1 1 A 81 81 THR N N 81 118.077 118.372 -0.295 1
1 974 . 10 1 1 A 82 82 ALA H H 82 9.586 8.483 1.103 1
1 975 . 10 1 1 A 82 82 ALA HA H 82 4.093 4.464 -0.371 1
1 979 . 10 1 1 A 82 82 ALA C C 82 178.667 177.682 0.985 1
1 980 . 10 1 1 A 82 82 ALA CA C 82 55.321 52.683 2.638 1
1 981 . 10 1 1 A 82 82 ALA CB C 82 18.094 18.441 -0.347 1
1 982 . 10 1 1 A 82 82 ALA N N 82 122.493 123.295 -0.802 1
1 983 . 10 1 1 A 83 83 ASN H H 83 7.923 8.471 -0.548 1
1 984 . 10 1 1 A 83 83 ASN HA H 83 4.808 5.115 -0.307 1
1 989 . 10 1 1 A 83 83 ASN C C 83 174.766 174.458 0.308 1
1 990 . 10 1 1 A 83 83 ASN CA C 83 53.333 54.816 -1.483 1
1 991 . 10 1 1 A 83 83 ASN CB C 83 40.335 41.730 -1.395 1
1 992 . 10 1 1 A 83 83 ASN N N 83 110.765 116.445 -5.680 1
1 994 . 10 1 1 A 84 84 ALA H H 84 7.352 7.122 0.230 1
1 995 . 10 1 1 A 84 84 ALA HA H 84 4.625 4.579 0.046 1
1 999 . 10 1 1 A 84 84 ALA C C 84 176.547 175.534 1.013 1
1 1000 . 10 1 1 A 84 84 ALA CA C 84 52.858 51.769 1.089 1
1 1001 . 10 1 1 A 84 84 ALA CB C 84 21.233 22.185 -0.952 1
1 1002 . 10 1 1 A 84 84 ALA N N 84 119.599 118.086 1.513 1
1 1003 . 10 1 1 A 85 85 THR H H 85 8.374 8.635 -0.261 1
1 1004 . 10 1 1 A 85 85 THR HA H 85 5.014 4.419 0.595 1
1 1009 . 10 1 1 A 85 85 THR C C 85 171.568 174.244 -2.676 1
1 1010 . 10 1 1 A 85 85 THR CA C 85 61.618 63.654 -2.036 1
1 1011 . 10 1 1 A 85 85 THR CB C 85 70.850 68.799 2.051 1
1 1013 . 10 1 1 A 85 85 THR N N 85 119.032 114.623 4.409 1
1 1014 . 10 1 1 A 86 86 TYR H H 86 9.006 9.054 -0.048 1
1 1015 . 10 1 1 A 86 86 TYR HA H 86 4.658 4.856 -0.198 1
1 1022 . 10 1 1 A 86 86 TYR C C 86 173.773 175.369 -1.596 1
1 1023 . 10 1 1 A 86 86 TYR CA C 86 56.938 57.698 -0.760 1
1 1024 . 10 1 1 A 86 86 TYR CB C 86 39.513 40.190 -0.677 1
1 1029 . 10 1 1 A 86 86 TYR N N 86 123.494 127.487 -3.993 1
1 1030 . 10 1 1 A 87 87 PHE H H 87 9.263 8.780 0.483 1
1 1031 . 10 1 1 A 87 87 PHE HA H 87 4.127 4.669 -0.542 1
1 1039 . 10 1 1 A 87 87 PHE C C 87 176.369 174.271 2.098 1
1 1040 . 10 1 1 A 87 87 PHE CA C 87 57.238 55.473 1.765 1
1 1041 . 10 1 1 A 87 87 PHE CB C 87 37.086 38.077 -0.991 1
1 1047 . 10 1 1 A 87 87 PHE N N 87 125.384 119.724 5.660 1
1 1048 . 10 1 1 A 88 88 VAL H H 88 9.023 8.292 0.731 1
1 1049 . 10 1 1 A 88 88 VAL HA H 88 4.162 4.512 -0.350 1
1 1057 . 10 1 1 A 88 88 VAL C C 88 176.390 175.801 0.589 1
1 1058 . 10 1 1 A 88 88 VAL CA C 88 63.975 60.859 3.116 1
1 1059 . 10 1 1 A 88 88 VAL CB C 88 32.378 32.522 -0.144 1
1 1062 . 10 1 1 A 88 88 VAL N N 88 127.348 123.919 3.429 1
1 1063 . 10 1 1 A 89 89 GLY H H 89 9.233 8.105 1.128 1
1 1064 . 10 1 1 A 89 89 GLY HA2 H 89 4.293 4.171 0.122 1
1 1065 . 10 1 1 A 89 89 GLY HA3 H 89 4.186 4.219 -0.033 1
1 1066 . 10 1 1 A 89 89 GLY C C 89 172.378 171.723 0.655 1
1 1067 . 10 1 1 A 89 89 GLY CA C 89 43.798 46.331 -2.533 1
1 1068 . 10 1 1 A 89 89 GLY N N 89 116.041 112.545 3.496 1
1 1069 . 10 1 1 A 90 90 GLU H H 90 8.532 8.125 0.407 1
1 1070 . 10 1 1 A 90 90 GLU HA H 90 4.794 4.716 0.078 1
1 1075 . 10 1 1 A 90 90 GLU C C 90 174.221 176.750 -2.529 1
1 1076 . 10 1 1 A 90 90 GLU CA C 90 56.393 55.445 0.948 1
1 1077 . 10 1 1 A 90 90 GLU CB C 90 33.182 31.152 2.030 1
1 1079 . 10 1 1 A 90 90 GLU N N 90 120.905 123.042 -2.137 1
1 1080 . 10 1 1 A 91 91 MET H H 91 8.450 8.618 -0.168 1
1 1081 . 10 1 1 A 91 91 MET HA H 91 4.904 4.682 0.222 1
1 1089 . 10 1 1 A 91 91 MET C C 91 173.373 174.400 -1.027 1
1 1090 . 10 1 1 A 91 91 MET CA C 91 52.277 55.143 -2.866 1
1 1091 . 10 1 1 A 91 91 MET CB C 91 32.789 32.221 0.568 1
1 1094 . 10 1 1 A 91 91 MET N N 91 125.173 123.587 1.586 1
1 1095 . 10 1 1 A 92 92 PRO HA H 92 4.358 4.236 0.122 1
1 1102 . 10 1 1 A 92 92 PRO C C 92 177.589 176.943 0.646 1
1 1103 . 10 1 1 A 92 92 PRO CA C 92 63.143 63.799 -0.656 1
1 1104 . 10 1 1 A 92 92 PRO CB C 92 32.083 31.230 0.853 1
1 1107 . 10 1 1 A 93 93 GLY H H 93 8.330 8.507 -0.177 1
1 1108 . 10 1 1 A 93 93 GLY HA2 H 93 3.943 4.104 -0.161 1
1 1109 . 10 1 1 A 93 93 GLY HA3 H 93 4.045 4.106 -0.061 1
1 1110 . 10 1 1 A 93 93 GLY C C 93 174.730 173.172 1.558 1
1 1111 . 10 1 1 A 93 93 GLY CA C 93 45.276 44.749 0.527 1
1 1112 . 10 1 1 A 93 93 GLY N N 93 109.420 111.780 -2.360 1
1 1113 . 10 1 1 A 94 94 GLY H H 94 8.331 8.321 0.010 1
1 1114 . 10 1 1 A 94 94 GLY HA2 H 94 3.973 4.097 -0.124 1
1 1115 . 10 1 1 A 94 94 GLY HA3 H 94 3.973 4.098 -0.125 1
1 1116 . 10 1 1 A 94 94 GLY C C 94 174.100 172.334 1.766 1
1 1117 . 10 1 1 A 94 94 GLY CA C 94 45.333 45.306 0.027 1
1 1118 . 10 1 1 A 94 94 GLY N N 94 108.483 110.116 -1.633 1
1 1119 . 10 1 1 A 95 95 THR H H 95 8.095 8.704 -0.609 1
1 1120 . 10 1 1 A 95 95 THR HA H 95 4.643 4.928 -0.285 1
1 1125 . 10 1 1 A 95 95 THR C C 95 173.155 172.957 0.198 1
1 1126 . 10 1 1 A 95 95 THR CA C 95 59.922 59.003 0.919 1
1 1127 . 10 1 1 A 95 95 THR CB C 95 69.871 69.535 0.336 1
1 1129 . 10 1 1 A 95 95 THR N N 95 115.860 112.841 3.019 1
1 1130 . 10 1 1 A 96 96 PRO HA H 96 4.400 4.533 -0.133 1
1 1137 . 10 1 1 A 96 96 PRO C C 96 177.565 176.442 1.123 1
1 1138 . 10 1 1 A 96 96 PRO CA C 96 64.047 63.150 0.897 1
1 1139 . 10 1 1 A 96 96 PRO CB C 96 31.816 32.586 -0.770 1
1 1142 . 10 1 1 A 97 97 GLY H H 97 8.572 8.289 0.283 1
1 1143 . 10 1 1 A 97 97 GLY HA2 H 97 4.007 4.131 -0.124 1
1 1144 . 10 1 1 A 97 97 GLY HA3 H 97 4.007 4.131 -0.124 1
1 1145 . 10 1 1 A 97 97 GLY C C 97 174.609 173.504 1.105 1
1 1146 . 10 1 1 A 97 97 GLY CA C 97 45.276 45.742 -0.466 1
1 1147 . 10 1 1 A 97 97 GLY N N 97 110.233 109.113 1.120 1
1 1148 . 10 1 1 A 98 98 GLY H H 98 8.119 8.565 -0.446 1
1 1149 . 10 1 1 A 98 98 GLY HA2 H 98 4.086 4.158 -0.072 1
1 1150 . 10 1 1 A 98 98 GLY HA3 H 98 4.200 4.158 0.042 1
1 1151 . 10 1 1 A 98 98 GLY CA C 98 44.876 44.858 0.018 1
1 1152 . 10 1 1 A 98 98 GLY N N 98 108.845 114.069 -5.224 1
1 1153 . 10 1 1 A 99 99 PRO HA H 99 4.494 4.267 0.227 1
1 1160 . 10 1 1 A 99 99 PRO C C 99 177.468 177.224 0.244 1
1 1161 . 10 1 1 A 99 99 PRO CA C 99 63.500 63.610 -0.110 1
1 1162 . 10 1 1 A 99 99 PRO CB C 99 32.013 32.120 -0.107 1
1 1165 . 10 1 1 A 100 100 SER H H 100 8.472 8.949 -0.477 1
1 1166 . 10 1 1 A 100 100 SER HA H 100 4.513 4.149 0.364 1
1 1169 . 10 1 1 A 100 100 SER C C 100 175.408 173.900 1.508 1
1 1170 . 10 1 1 A 100 100 SER CA C 100 58.557 59.261 -0.704 1
1 1171 . 10 1 1 A 100 100 SER CB C 100 63.918 62.104 1.814 1
1 1172 . 10 1 1 A 100 100 SER N N 100 116.038 117.999 -1.961 1
1 1173 . 10 1 1 A 101 101 GLY H H 101 8.427 8.048 0.379 1
1 1174 . 10 1 1 A 101 101 GLY HA2 H 101 4.064 4.059 0.005 1
1 1175 . 10 1 1 A 101 101 GLY HA3 H 101 4.064 4.060 0.004 1
1 1176 . 10 1 1 A 101 101 GLY C C 101 174.730 173.301 1.429 1
1 1177 . 10 1 1 A 101 101 GLY CA C 101 45.575 44.505 1.070 1
1 1178 . 10 1 1 A 101 101 GLY N N 101 110.558 109.524 1.034 1
1 1179 . 10 1 1 A 102 102 GLN H H 102 8.416 8.453 -0.037 1
1 1180 . 10 1 1 A 102 102 GLN HA H 102 4.383 4.359 0.024 1
1 1187 . 10 1 1 A 102 102 GLN C C 102 177.346 176.396 0.950 1
1 1188 . 10 1 1 A 102 102 GLN CA C 102 57.080 56.587 0.493 1
1 1189 . 10 1 1 A 102 102 GLN CB C 102 29.235 27.668 1.567 1
1 1191 . 10 1 1 A 102 102 GLN N N 102 120.112 119.412 0.700 1
1 1193 . 10 1 1 A 103 103 GLY H H 103 8.713 8.277 0.436 1
1 1194 . 10 1 1 A 103 103 GLY HA2 H 103 4.193 4.126 0.067 1
1 1195 . 10 1 1 A 103 103 GLY HA3 H 103 4.078 4.145 -0.067 1
1 1196 . 10 1 1 A 103 103 GLY C C 103 175.602 174.065 1.537 1
1 1197 . 10 1 1 A 103 103 GLY CA C 103 46.120 45.876 0.244 1
1 1198 . 10 1 1 A 103 103 GLY N N 103 109.817 113.796 -3.979 1
1 1199 . 10 1 1 A 104 104 ALA H H 104 8.366 7.751 0.615 1
1 1200 . 10 1 1 A 104 104 ALA HA H 104 4.449 4.690 -0.241 1
1 1204 . 10 1 1 A 104 104 ALA C C 104 179.188 178.539 0.649 1
1 1205 . 10 1 1 A 104 104 ALA CA C 104 54.230 53.110 1.120 1
1 1206 . 10 1 1 A 104 104 ALA CB C 104 19.080 20.406 -1.326 1
1 1207 . 10 1 1 A 104 104 ALA N N 104 124.808 120.415 4.393 1
1 1208 . 10 1 1 A 105 105 GLU H H 105 8.576 8.319 0.257 1
1 1209 . 10 1 1 A 105 105 GLU HA H 105 4.161 4.143 0.018 1
1 1214 . 10 1 1 A 105 105 GLU C C 105 179.200 179.173 0.027 1
1 1215 . 10 1 1 A 105 105 GLU CA C 105 59.173 59.431 -0.258 1
1 1216 . 10 1 1 A 105 105 GLU CB C 105 29.194 29.098 0.096 1
1 1218 . 10 1 1 A 105 105 GLU N N 105 119.238 117.274 1.964 1
1 1219 . 10 1 1 A 106 106 ALA H H 106 8.381 8.190 0.191 1
1 1220 . 10 1 1 A 106 106 ALA HA H 106 4.283 4.144 0.139 1
1 1224 . 10 1 1 A 106 106 ALA C C 106 180.048 180.117 -0.069 1
1 1225 . 10 1 1 A 106 106 ALA CA C 106 54.687 55.171 -0.484 1
1 1226 . 10 1 1 A 106 106 ALA CB C 106 18.341 18.667 -0.326 1
1 1227 . 10 1 1 A 106 106 ALA N N 106 123.327 122.125 1.202 1
1 1228 . 10 1 1 A 107 107 ALA H H 107 8.123 8.093 0.030 1
1 1229 . 10 1 1 A 107 107 ALA HA H 107 4.554 4.419 0.135 1
1 1233 . 10 1 1 A 107 107 ALA C C 107 179.757 179.969 -0.212 1
1 1234 . 10 1 1 A 107 107 ALA CA C 107 55.355 55.401 -0.046 1
1 1235 . 10 1 1 A 107 107 ALA CB C 107 18.939 18.233 0.706 1
1 1236 . 10 1 1 A 107 107 ALA N N 107 120.740 120.602 0.138 1
1 1237 . 10 1 1 A 108 108 ARG H H 108 8.403 7.858 0.545 1
1 1238 . 10 1 1 A 108 108 ARG HA H 108 4.254 4.103 0.151 1
1 1245 . 10 1 1 A 108 108 ARG C C 108 179.111 179.835 -0.724 1
1 1246 . 10 1 1 A 108 108 ARG CA C 108 59.015 59.241 -0.226 1
1 1247 . 10 1 1 A 108 108 ARG CB C 108 29.752 29.799 -0.047 1
1 1250 . 10 1 1 A 108 108 ARG N N 108 119.531 118.042 1.489 1
1 1251 . 10 1 1 A 109 109 GLY H H 109 8.182 8.063 0.119 1
1 1252 . 10 1 1 A 109 109 GLY HA2 H 109 3.822 3.666 0.156 1
1 1253 . 10 1 1 A 109 109 GLY HA3 H 109 3.822 3.691 0.131 1
1 1254 . 10 1 1 A 109 109 GLY C C 109 177.020 176.598 0.422 1
1 1255 . 10 1 1 A 109 109 GLY CA C 109 46.718 47.168 -0.450 1
1 1256 . 10 1 1 A 109 109 GLY N N 109 107.331 107.982 -0.651 1
1 1257 . 10 1 1 A 110 110 TRP H H 110 7.925 8.288 -0.363 1
1 1258 . 10 1 1 A 110 110 TRP HA H 110 3.963 4.521 -0.558 1
1 1267 . 10 1 1 A 110 110 TRP C C 110 176.691 177.764 -1.073 1
1 1268 . 10 1 1 A 110 110 TRP CA C 110 62.041 60.900 1.141 1
1 1269 . 10 1 1 A 110 110 TRP CB C 110 28.989 28.186 0.803 1
1 1275 . 10 1 1 A 110 110 TRP N N 110 122.304 120.966 1.338 1
1 1277 . 10 1 1 A 111 111 GLU H H 111 7.946 7.588 0.358 1
1 1278 . 10 1 1 A 111 111 GLU HA H 111 2.594 3.028 -0.434 1
1 1283 . 10 1 1 A 111 111 GLU C C 111 177.976 179.052 -1.076 1
1 1284 . 10 1 1 A 111 111 GLU CA C 111 60.193 58.874 1.319 1
1 1285 . 10 1 1 A 111 111 GLU CB C 111 29.277 29.195 0.082 1
1 1287 . 10 1 1 A 111 111 GLU N N 111 121.755 119.138 2.617 1
1 1288 . 10 1 1 A 112 112 THR H H 112 7.993 7.567 0.426 1
1 1289 . 10 1 1 A 112 112 THR HA H 112 3.722 3.825 -0.103 1
1 1294 . 10 1 1 A 112 112 THR C C 112 176.038 175.769 0.269 1
1 1295 . 10 1 1 A 112 112 THR CA C 112 66.104 66.462 -0.358 1
1 1296 . 10 1 1 A 112 112 THR CB C 112 68.885 68.771 0.114 1
1 1298 . 10 1 1 A 112 112 THR N N 112 112.247 116.444 -4.197 1
1 1299 . 10 1 1 A 113 113 ALA H H 113 7.742 8.335 -0.593 1
1 1300 . 10 1 1 A 113 113 ALA HA H 113 4.029 3.965 0.064 1
1 1304 . 10 1 1 A 113 113 ALA C C 113 180.545 179.846 0.699 1
1 1305 . 10 1 1 A 113 113 ALA CA C 113 55.127 55.196 -0.069 1
1 1306 . 10 1 1 A 113 113 ALA CB C 113 18.854 18.350 0.504 1
1 1307 . 10 1 1 A 113 113 ALA N N 113 123.134 122.799 0.335 1
1 1308 . 10 1 1 A 114 114 ILE H H 114 8.472 8.515 -0.043 1
1 1309 . 10 1 1 A 114 114 ILE HA H 114 3.613 3.730 -0.117 1
1 1319 . 10 1 1 A 114 114 ILE C C 114 176.947 177.969 -1.022 1
1 1320 . 10 1 1 A 114 114 ILE CA C 114 66.016 65.011 1.005 1
1 1321 . 10 1 1 A 114 114 ILE CB C 114 38.335 37.952 0.383 1
1 1325 . 10 1 1 A 114 114 ILE N N 114 118.276 117.648 0.628 1
1 1326 . 10 1 1 A 115 115 ARG H H 115 8.181 7.971 0.210 1
1 1327 . 10 1 1 A 115 115 ARG HA H 115 3.835 3.913 -0.078 1
1 1334 . 10 1 1 A 115 115 ARG C C 115 179.588 179.229 0.359 1
1 1335 . 10 1 1 A 115 115 ARG CA C 115 61.072 60.171 0.901 1
1 1336 . 10 1 1 A 115 115 ARG CB C 115 29.975 29.983 -0.008 1
1 1339 . 10 1 1 A 115 115 ARG N N 115 117.921 119.273 -1.352 1
1 1340 . 10 1 1 A 116 116 GLN H H 116 8.395 8.478 -0.083 1
1 1341 . 10 1 1 A 116 116 GLN HA H 116 4.030 4.062 -0.032 1
1 1348 . 10 1 1 A 116 116 GLN C C 116 178.716 178.763 -0.047 1
1 1349 . 10 1 1 A 116 116 GLN CA C 116 58.790 58.863 -0.073 1
1 1350 . 10 1 1 A 116 116 GLN CB C 116 28.248 28.480 -0.232 1
1 1352 . 10 1 1 A 116 116 GLN N N 116 116.842 118.794 -1.952 1
1 1354 . 10 1 1 A 117 117 ALA H H 117 7.902 8.275 -0.373 1
1 1355 . 10 1 1 A 117 117 ALA HA H 117 4.143 4.132 0.011 1
1 1359 . 10 1 1 A 117 117 ALA C C 117 179.685 180.252 -0.567 1
1 1360 . 10 1 1 A 117 117 ALA CA C 117 54.476 54.956 -0.480 1
1 1361 . 10 1 1 A 117 117 ALA CB C 117 18.300 18.229 0.071 1
1 1362 . 10 1 1 A 117 117 ALA N N 117 122.828 122.694 0.134 1
1 1363 . 10 1 1 A 118 118 LEU H H 118 7.904 8.136 -0.232 1
1 1364 . 10 1 1 A 118 118 LEU HA H 118 4.119 4.104 0.015 1
1 1374 . 10 1 1 A 118 118 LEU C C 118 178.437 178.765 -0.328 1
1 1375 . 10 1 1 A 118 118 LEU CA C 118 56.781 57.185 -0.404 1
1 1376 . 10 1 1 A 118 118 LEU CB C 118 42.371 41.769 0.602 1
1 1380 . 10 1 1 A 118 118 LEU N N 118 117.632 120.262 -2.630 1
1 1381 . 10 1 1 A 119 119 MET H H 119 7.673 8.161 -0.488 1
1 1382 . 10 1 1 A 119 119 MET HA H 119 4.442 4.207 0.235 1
1 1390 . 10 1 1 A 119 119 MET C C 119 176.680 178.067 -1.387 1
1 1391 . 10 1 1 A 119 119 MET CA C 119 56.432 57.978 -1.546 1
1 1392 . 10 1 1 A 119 119 MET CB C 119 32.769 31.846 0.923 1
1 1395 . 10 1 1 A 119 119 MET N N 119 117.286 117.687 -0.401 1
1 1396 . 10 1 1 A 120 120 SER H H 120 7.878 7.975 -0.097 1
1 1397 . 10 1 1 A 120 120 SER HA H 120 4.500 4.194 0.306 1
1 1400 . 10 1 1 A 120 120 SER C C 120 174.742 176.638 -1.896 1
1 1401 . 10 1 1 A 120 120 SER CA C 120 58.962 61.185 -2.223 1
1 1402 . 10 1 1 A 120 120 SER CB C 120 63.853 62.253 1.600 1
1 1403 . 10 1 1 A 120 120 SER N N 120 115.064 114.011 1.053 1
1 1404 . 10 1 1 A 121 121 GLY H H 121 8.059 8.253 -0.194 1
1 1405 . 10 1 1 A 121 121 GLY HA2 H 121 4.231 3.743 0.488 1
1 1406 . 10 1 1 A 121 121 GLY HA3 H 121 4.112 3.744 0.368 1
1 1407 . 10 1 1 A 121 121 GLY C C 121 172.065 174.736 -2.671 1
1 1408 . 10 1 1 A 121 121 GLY CA C 121 45.030 47.944 -2.914 1
1 1409 . 10 1 1 A 121 121 GLY N N 121 110.271 110.166 0.105 1
1 1410 . 10 1 1 A 122 122 PRO HA H 122 4.496 4.315 0.181 1
1 1417 . 10 1 1 A 122 122 PRO CA C 122 63.399 64.974 -1.575 1
1 1418 . 10 1 1 A 122 122 PRO CB C 122 32.186 31.812 0.374 1
1 1 . 11 1 1 A 6 6 SER H H 6 8.337 8.607 -0.270 1
1 2 . 11 1 1 A 6 6 SER HA H 6 4.597 4.760 -0.163 1
1 5 . 11 1 1 A 6 6 SER C C 6 174.637 174.410 0.227 1
1 6 . 11 1 1 A 6 6 SER CA C 6 58.469 56.885 1.584 1
1 7 . 11 1 1 A 6 6 SER CB C 6 64.221 64.247 -0.026 1
1 8 . 11 1 1 A 6 6 SER N N 6 117.887 121.031 -3.144 1
1 9 . 11 1 1 A 7 7 GLY H H 7 8.280 8.879 -0.599 1
1 10 . 11 1 1 A 7 7 GLY HA2 H 7 4.063 3.854 0.209 1
1 11 . 11 1 1 A 7 7 GLY HA3 H 7 4.063 3.855 0.208 1
1 12 . 11 1 1 A 7 7 GLY C C 7 173.724 173.914 -0.190 1
1 13 . 11 1 1 A 7 7 GLY CA C 7 44.941 46.970 -2.029 1
1 14 . 11 1 1 A 7 7 GLY N N 7 110.151 115.765 -5.614 1
1 15 . 11 1 1 A 8 8 THR H H 8 8.212 8.880 -0.668 1
1 16 . 11 1 1 A 8 8 THR HA H 8 4.173 4.256 -0.083 1
1 21 . 11 1 1 A 8 8 THR C C 8 174.723 175.099 -0.376 1
1 22 . 11 1 1 A 8 8 THR CA C 8 63.622 63.901 -0.279 1
1 23 . 11 1 1 A 8 8 THR CB C 8 69.460 69.106 0.354 1
1 25 . 11 1 1 A 8 8 THR N N 8 116.817 119.608 -2.791 1
1 26 . 11 1 1 A 9 9 LEU H H 9 9.374 8.928 0.446 1
1 27 . 11 1 1 A 9 9 LEU HA H 9 4.302 4.157 0.145 1
1 37 . 11 1 1 A 9 9 LEU C C 9 177.468 176.444 1.024 1
1 38 . 11 1 1 A 9 9 LEU CA C 9 55.936 56.472 -0.536 1
1 39 . 11 1 1 A 9 9 LEU CB C 9 42.843 42.472 0.371 1
1 43 . 11 1 1 A 9 9 LEU N N 9 127.798 128.817 -1.019 1
1 44 . 11 1 1 A 10 10 ARG H H 10 7.512 7.209 0.303 1
1 45 . 11 1 1 A 10 10 ARG HA H 10 4.199 4.669 -0.470 1
1 52 . 11 1 1 A 10 10 ARG C C 10 172.501 173.887 -1.386 1
1 53 . 11 1 1 A 10 10 ARG CA C 10 56.165 54.410 1.755 1
1 54 . 11 1 1 A 10 10 ARG CB C 10 32.442 33.425 -0.983 1
1 57 . 11 1 1 A 10 10 ARG N N 10 117.979 117.363 0.616 1
1 58 . 11 1 1 A 11 11 GLU H H 11 8.434 8.761 -0.327 1
1 59 . 11 1 1 A 11 11 GLU HA H 11 5.993 5.604 0.389 1
1 64 . 11 1 1 A 11 11 GLU C C 11 174.800 174.624 0.176 1
1 65 . 11 1 1 A 11 11 GLU CA C 11 54.570 54.967 -0.397 1
1 66 . 11 1 1 A 11 11 GLU CB C 11 34.245 33.007 1.238 1
1 68 . 11 1 1 A 11 11 GLU N N 11 120.782 121.540 -0.758 1
1 69 . 11 1 1 A 12 12 GLY H H 12 8.131 7.775 0.356 1
1 70 . 11 1 1 A 12 12 GLY HA2 H 12 4.714 3.991 0.723 1
1 71 . 11 1 1 A 12 12 GLY HA3 H 12 3.763 4.244 -0.481 1
1 72 . 11 1 1 A 12 12 GLY C C 12 171.060 171.753 -0.693 1
1 73 . 11 1 1 A 12 12 GLY CA C 12 45.241 45.610 -0.369 1
1 74 . 11 1 1 A 12 12 GLY N N 12 107.457 106.557 0.900 1
1 75 . 11 1 1 A 13 13 TRP H H 13 8.783 8.671 0.112 1
1 76 . 11 1 1 A 13 13 TRP HA H 13 5.152 4.983 0.169 1
1 85 . 11 1 1 A 13 13 TRP C C 13 177.528 176.599 0.929 1
1 86 . 11 1 1 A 13 13 TRP CA C 13 57.783 58.656 -0.873 1
1 87 . 11 1 1 A 13 13 TRP CB C 13 30.222 29.897 0.325 1
1 93 . 11 1 1 A 13 13 TRP N N 13 120.792 121.541 -0.749 1
1 95 . 11 1 1 A 14 14 VAL H H 14 9.179 8.854 0.325 1
1 96 . 11 1 1 A 14 14 VAL HA H 14 4.072 4.583 -0.511 1
1 104 . 11 1 1 A 14 14 VAL C C 14 174.981 173.546 1.435 1
1 105 . 11 1 1 A 14 14 VAL CA C 14 61.741 59.984 1.757 1
1 106 . 11 1 1 A 14 14 VAL CB C 14 35.143 35.271 -0.128 1
1 109 . 11 1 1 A 14 14 VAL N N 14 125.476 122.987 2.489 1
1 110 . 11 1 1 A 15 15 VAL H H 15 8.403 8.357 0.046 1
1 111 . 11 1 1 A 15 15 VAL HA H 15 5.532 5.277 0.255 1
1 119 . 11 1 1 A 15 15 VAL C C 15 175.078 174.127 0.951 1
1 120 . 11 1 1 A 15 15 VAL CA C 15 59.489 59.535 -0.046 1
1 121 . 11 1 1 A 15 15 VAL CB C 15 34.210 35.370 -1.160 1
1 124 . 11 1 1 A 15 15 VAL N N 15 126.189 125.040 1.149 1
1 125 . 11 1 1 A 16 16 HIS H H 16 9.122 8.831 0.291 1
1 126 . 11 1 1 A 16 16 HIS HA H 16 5.823 5.914 -0.091 1
1 131 . 11 1 1 A 16 16 HIS C C 16 172.998 172.622 0.376 1
1 132 . 11 1 1 A 16 16 HIS CA C 16 56.253 53.909 2.344 1
1 133 . 11 1 1 A 16 16 HIS CB C 16 34.273 33.165 1.108 1
1 136 . 11 1 1 A 16 16 HIS N N 16 121.152 120.703 0.449 1
1 137 . 11 1 1 A 17 17 TYR H H 17 8.465 8.602 -0.137 1
1 138 . 11 1 1 A 17 17 TYR HA H 17 5.096 4.683 0.413 1
1 145 . 11 1 1 A 17 17 TYR C C 17 173.640 172.264 1.376 1
1 146 . 11 1 1 A 17 17 TYR CA C 17 56.903 56.508 0.395 1
1 147 . 11 1 1 A 17 17 TYR CB C 17 40.103 40.281 -0.178 1
1 152 . 11 1 1 A 17 17 TYR N N 17 115.558 116.410 -0.852 1
1 153 . 11 1 1 A 18 18 SER H H 18 9.122 8.706 0.416 1
1 154 . 11 1 1 A 18 18 SER HA H 18 6.144 5.353 0.791 1
1 157 . 11 1 1 A 18 18 SER C C 18 173.204 175.094 -1.890 1
1 158 . 11 1 1 A 18 18 SER CA C 18 56.640 57.218 -0.578 1
1 159 . 11 1 1 A 18 18 SER CB C 18 68.788 65.253 3.535 1
1 160 . 11 1 1 A 18 18 SER N N 18 118.846 117.044 1.802 1
1 161 . 11 1 1 A 19 19 ASN H H 19 9.053 8.889 0.164 1
1 162 . 11 1 1 A 19 19 ASN HA H 19 4.473 4.966 -0.493 1
1 167 . 11 1 1 A 19 19 ASN C C 19 175.396 174.852 0.544 1
1 168 . 11 1 1 A 19 19 ASN CA C 19 55.373 52.596 2.777 1
1 169 . 11 1 1 A 19 19 ASN CB C 19 36.900 38.062 -1.162 1
1 170 . 11 1 1 A 19 19 ASN N N 19 113.712 119.375 -5.663 1
1 172 . 11 1 1 A 20 20 LYS H H 20 7.677 7.878 -0.201 1
1 173 . 11 1 1 A 20 20 LYS HA H 20 4.413 4.480 -0.067 1
1 182 . 11 1 1 A 20 20 LYS C C 20 176.078 176.284 -0.206 1
1 183 . 11 1 1 A 20 20 LYS CA C 20 55.679 56.793 -1.114 1
1 184 . 11 1 1 A 20 20 LYS CB C 20 33.023 35.268 -2.245 1
1 188 . 11 1 1 A 20 20 LYS N N 20 117.213 118.269 -1.056 1
1 189 . 11 1 1 A 21 21 ASP H H 21 7.395 7.991 -0.596 1
1 190 . 11 1 1 A 21 21 ASP HA H 21 4.808 4.843 -0.035 1
1 193 . 11 1 1 A 21 21 ASP C C 21 176.413 176.181 0.232 1
1 194 . 11 1 1 A 21 21 ASP CA C 21 53.983 53.599 0.384 1
1 195 . 11 1 1 A 21 21 ASP CB C 21 41.199 42.705 -1.506 1
1 196 . 11 1 1 A 21 21 ASP N N 21 119.879 117.052 2.827 1
1 197 . 11 1 1 A 22 22 THR H H 22 8.593 7.666 0.927 1
1 198 . 11 1 1 A 22 22 THR HA H 22 4.352 4.066 0.286 1
1 203 . 11 1 1 A 22 22 THR C C 22 172.913 174.807 -1.894 1
1 204 . 11 1 1 A 22 22 THR CA C 22 62.691 62.924 -0.233 1
1 205 . 11 1 1 A 22 22 THR CB C 22 68.332 66.400 1.932 1
1 207 . 11 1 1 A 22 22 THR N N 22 116.299 113.924 2.375 1
1 208 . 11 1 1 A 23 23 LEU H H 23 7.645 7.921 -0.276 1
1 209 . 11 1 1 A 23 23 LEU HA H 23 4.318 4.393 -0.075 1
1 219 . 11 1 1 A 23 23 LEU C C 23 176.692 176.648 0.044 1
1 220 . 11 1 1 A 23 23 LEU CA C 23 54.617 53.970 0.647 1
1 221 . 11 1 1 A 23 23 LEU CB C 23 41.939 41.263 0.676 1
1 225 . 11 1 1 A 23 23 LEU N N 23 123.606 121.165 2.441 1
1 226 . 11 1 1 A 24 24 ARG H H 24 8.563 7.481 1.082 1
1 227 . 11 1 1 A 24 24 ARG HA H 24 4.373 4.565 -0.192 1
1 235 . 11 1 1 A 24 24 ARG C C 24 176.584 175.816 0.768 1
1 236 . 11 1 1 A 24 24 ARG CA C 24 57.854 56.259 1.595 1
1 237 . 11 1 1 A 24 24 ARG CB C 24 31.126 30.587 0.539 1
1 240 . 11 1 1 A 24 24 ARG N N 24 127.152 122.651 4.501 1
1 242 . 11 1 1 A 25 25 LYS H H 25 8.633 8.389 0.244 1
1 243 . 11 1 1 A 25 25 LYS HA H 25 4.513 4.949 -0.436 1
1 251 . 11 1 1 A 25 25 LYS C C 25 173.567 174.649 -1.082 1
1 252 . 11 1 1 A 25 25 LYS CA C 25 54.792 54.458 0.334 1
1 253 . 11 1 1 A 25 25 LYS CB C 25 37.416 35.118 2.298 1
1 257 . 11 1 1 A 25 25 LYS N N 25 122.682 121.061 1.621 1
1 258 . 11 1 1 A 26 26 ARG H H 26 8.303 8.829 -0.526 1
1 259 . 11 1 1 A 26 26 ARG HA H 26 5.153 5.126 0.027 1
1 266 . 11 1 1 A 26 26 ARG C C 26 174.554 175.113 -0.559 1
1 267 . 11 1 1 A 26 26 ARG CA C 26 55.083 55.194 -0.111 1
1 268 . 11 1 1 A 26 26 ARG CB C 26 32.789 31.693 1.096 1
1 271 . 11 1 1 A 26 26 ARG N N 26 121.819 125.069 -3.250 1
1 272 . 11 1 1 A 27 27 HIS H H 27 8.793 9.201 -0.408 1
1 273 . 11 1 1 A 27 27 HIS HA H 27 5.155 5.648 -0.493 1
1 278 . 11 1 1 A 27 27 HIS CA C 27 56.904 54.916 1.988 1
1 279 . 11 1 1 A 27 27 HIS CB C 27 34.683 31.344 3.339 1
1 282 . 11 1 1 A 27 27 HIS N N 27 122.102 120.321 1.781 1
1 283 . 11 1 1 A 28 28 TYR H H 28 9.273 8.431 0.842 1
1 284 . 11 1 1 A 28 28 TYR HA H 28 4.332 4.262 0.070 1
1 291 . 11 1 1 A 28 28 TYR C C 28 174.730 174.666 0.064 1
1 292 . 11 1 1 A 28 28 TYR CA C 28 58.680 57.609 1.071 1
1 293 . 11 1 1 A 28 28 TYR CB C 28 38.673 38.293 0.380 1
1 298 . 11 1 1 A 28 28 TYR N N 28 125.605 121.180 4.425 1
1 299 . 11 1 1 A 29 29 TRP H H 29 9.273 8.888 0.385 1
1 300 . 11 1 1 A 29 29 TRP HA H 29 5.543 4.899 0.644 1
1 309 . 11 1 1 A 29 29 TRP C C 29 176.172 176.546 -0.374 1
1 310 . 11 1 1 A 29 29 TRP CA C 29 56.658 57.631 -0.973 1
1 311 . 11 1 1 A 29 29 TRP CB C 29 32.154 30.308 1.846 1
1 317 . 11 1 1 A 29 29 TRP N N 29 131.340 128.397 2.943 1
1 318 . 11 1 1 A 30 30 ARG H H 30 9.164 9.391 -0.227 1
1 319 . 11 1 1 A 30 30 ARG HA H 30 5.302 5.088 0.214 1
1 327 . 11 1 1 A 30 30 ARG C C 30 174.774 174.378 0.396 1
1 328 . 11 1 1 A 30 30 ARG CA C 30 56.271 55.025 1.246 1
1 329 . 11 1 1 A 30 30 ARG CB C 30 34.203 32.557 1.646 1
1 332 . 11 1 1 A 30 30 ARG N N 30 116.040 122.849 -6.809 1
1 334 . 11 1 1 A 31 31 LEU H H 31 9.273 9.127 0.146 1
1 335 . 11 1 1 A 31 31 LEU HA H 31 5.324 5.323 0.001 1
1 345 . 11 1 1 A 31 31 LEU C C 31 174.488 174.695 -0.207 1
1 346 . 11 1 1 A 31 31 LEU CA C 31 53.807 53.376 0.431 1
1 347 . 11 1 1 A 31 31 LEU CB C 31 46.667 45.651 1.016 1
1 351 . 11 1 1 A 31 31 LEU N N 31 127.075 127.495 -0.420 1
1 352 . 11 1 1 A 32 32 ASP H H 32 8.854 8.766 0.088 1
1 353 . 11 1 1 A 32 32 ASP HA H 32 4.902 5.076 -0.174 1
1 356 . 11 1 1 A 32 32 ASP C C 32 173.474 176.379 -2.905 1
1 357 . 11 1 1 A 32 32 ASP CA C 32 53.104 52.339 0.765 1
1 358 . 11 1 1 A 32 32 ASP CB C 32 42.931 44.682 -1.751 1
1 359 . 11 1 1 A 32 32 ASP N N 32 129.349 125.221 4.128 1
1 360 . 11 1 1 A 33 33 CYS H H 33 8.153 8.869 -0.716 1
1 361 . 11 1 1 A 33 33 CYS HA H 33 4.323 4.352 -0.029 1
1 364 . 11 1 1 A 33 33 CYS C C 33 174.476 174.390 0.086 1
1 365 . 11 1 1 A 33 33 CYS CA C 33 59.853 59.816 0.037 1
1 366 . 11 1 1 A 33 33 CYS CB C 33 27.508 26.945 0.563 1
1 367 . 11 1 1 A 33 33 CYS N N 33 108.439 119.217 -10.778 1
1 368 . 11 1 1 A 34 34 LYS H H 34 9.144 7.729 1.415 1
1 369 . 11 1 1 A 34 34 LYS HA H 34 4.616 4.448 0.168 1
1 378 . 11 1 1 A 34 34 LYS C C 34 177.601 176.216 1.385 1
1 379 . 11 1 1 A 34 34 LYS CA C 34 57.185 56.822 0.363 1
1 380 . 11 1 1 A 34 34 LYS CB C 34 35.623 35.130 0.493 1
1 384 . 11 1 1 A 34 34 LYS N N 34 119.884 118.424 1.460 1
1 385 . 11 1 1 A 35 35 CYS H H 35 9.102 7.768 1.334 1
1 386 . 11 1 1 A 35 35 CYS HA H 35 4.935 4.809 0.126 1
1 389 . 11 1 1 A 35 35 CYS C C 35 172.283 172.371 -0.088 1
1 390 . 11 1 1 A 35 35 CYS CA C 35 57.748 56.844 0.904 1
1 391 . 11 1 1 A 35 35 CYS CB C 35 31.537 30.493 1.044 1
1 392 . 11 1 1 A 35 35 CYS N N 35 120.317 113.930 6.387 1
1 393 . 11 1 1 A 36 36 ILE H H 36 8.213 9.084 -0.871 1
1 394 . 11 1 1 A 36 36 ILE HA H 36 4.617 4.711 -0.094 1
1 404 . 11 1 1 A 36 36 ILE C C 36 175.312 176.091 -0.779 1
1 405 . 11 1 1 A 36 36 ILE CA C 36 60.967 60.478 0.489 1
1 406 . 11 1 1 A 36 36 ILE CB C 36 39.718 38.373 1.345 1
1 410 . 11 1 1 A 36 36 ILE N N 36 121.905 119.767 2.138 1
1 411 . 11 1 1 A 37 37 THR H H 37 9.076 8.432 0.644 1
1 412 . 11 1 1 A 37 37 THR HA H 37 4.364 4.341 0.023 1
1 417 . 11 1 1 A 37 37 THR CA C 37 61.834 62.175 -0.341 1
1 418 . 11 1 1 A 37 37 THR CB C 37 69.237 69.980 -0.743 1
1 420 . 11 1 1 A 37 37 THR N N 37 122.500 120.551 1.949 1
1 421 . 11 1 1 A 38 38 LEU H H 38 8.263 8.993 -0.730 1
1 422 . 11 1 1 A 38 38 LEU HA H 38 4.445 4.737 -0.292 1
1 432 . 11 1 1 A 38 38 LEU CA C 38 55.611 53.228 2.383 1
1 433 . 11 1 1 A 38 38 LEU CB C 38 42.702 43.517 -0.815 1
1 437 . 11 1 1 A 38 38 LEU N N 38 126.987 123.516 3.471 1
1 438 . 11 1 1 A 39 39 PHE H H 39 9.520 9.264 0.256 1
1 439 . 11 1 1 A 39 39 PHE HA H 39 4.998 4.922 0.076 1
1 447 . 11 1 1 A 39 39 PHE CA C 39 57.331 57.305 0.026 1
1 448 . 11 1 1 A 39 39 PHE CB C 39 42.453 38.645 3.808 1
1 454 . 11 1 1 A 39 39 PHE N N 39 120.545 124.603 -4.058 1
1 455 . 11 1 1 A 40 40 GLN H H 40 9.878 8.887 0.991 1
1 456 . 11 1 1 A 40 40 GLN HA H 40 4.376 4.090 0.286 1
1 463 . 11 1 1 A 40 40 GLN CA C 40 59.513 59.929 -0.416 1
1 464 . 11 1 1 A 40 40 GLN CB C 40 29.317 28.744 0.573 1
1 467 . 11 1 1 A 41 41 ASN H H 41 7.732 8.328 -0.596 1
1 468 . 11 1 1 A 41 41 ASN HA H 41 4.812 5.529 -0.717 1
1 473 . 11 1 1 A 41 41 ASN CA C 41 52.618 52.027 0.591 1
1 474 . 11 1 1 A 41 41 ASN CB C 41 39.362 41.727 -2.365 1
1 475 . 11 1 1 A 41 41 ASN N N 41 107.613 114.985 -7.372 1
1 477 . 11 1 1 A 42 42 ASN HA H 42 3.476 4.050 -0.574 1
1 482 . 11 1 1 A 42 42 ASN C C 42 173.607 175.888 -2.281 1
1 483 . 11 1 1 A 42 42 ASN CA C 42 54.888 55.194 -0.306 1
1 484 . 11 1 1 A 42 42 ASN CB C 42 35.613 38.693 -3.080 1
1 486 . 11 1 1 A 43 43 THR H H 43 8.394 7.559 0.835 1
1 487 . 11 1 1 A 43 43 THR HA H 43 4.403 4.439 -0.036 1
1 492 . 11 1 1 A 43 43 THR C C 43 174.464 173.500 0.964 1
1 493 . 11 1 1 A 43 43 THR CA C 43 61.978 61.210 0.768 1
1 494 . 11 1 1 A 43 43 THR CB C 43 70.036 68.748 1.288 1
1 496 . 11 1 1 A 43 43 THR N N 43 111.795 107.183 4.612 1
1 497 . 11 1 1 A 44 44 THR H H 44 8.058 7.677 0.381 1
1 498 . 11 1 1 A 44 44 THR HA H 44 4.464 4.803 -0.339 1
1 503 . 11 1 1 A 44 44 THR CA C 44 61.599 60.034 1.565 1
1 504 . 11 1 1 A 44 44 THR CB C 44 69.137 70.839 -1.702 1
1 506 . 11 1 1 A 44 44 THR N N 44 116.514 115.842 0.672 1
1 507 . 11 1 1 A 45 45 ASN H H 45 6.653 8.689 -2.036 1
1 508 . 11 1 1 A 45 45 ASN HA H 45 4.945 4.856 0.089 1
1 513 . 11 1 1 A 45 45 ASN CA C 45 53.227 55.474 -2.247 1
1 514 . 11 1 1 A 45 45 ASN CB C 45 38.483 39.035 -0.552 1
1 516 . 11 1 1 A 46 46 ARG H H 46 8.213 7.867 0.346 1
1 517 . 11 1 1 A 46 46 ARG HA H 46 4.583 4.501 0.082 1
1 524 . 11 1 1 A 46 46 ARG CA C 46 55.487 55.055 0.432 1
1 525 . 11 1 1 A 46 46 ARG CB C 46 31.153 31.222 -0.069 1
1 528 . 11 1 1 A 46 46 ARG N N 46 121.652 118.140 3.512 1
1 529 . 11 1 1 A 47 47 TYR H H 47 7.973 8.848 -0.875 1
1 536 . 11 1 1 A 47 47 TYR CB C 47 39.356 39.417 -0.061 1
1 541 . 11 1 1 A 48 48 TYR H H 48 9.023 8.762 0.261 1
1 542 . 11 1 1 A 48 48 TYR HA H 48 4.662 4.359 0.303 1
1 549 . 11 1 1 A 48 48 TYR CB C 48 39.863 40.800 -0.937 1
1 554 . 11 1 1 A 48 48 TYR N N 48 121.223 120.648 0.575 1
1 555 . 11 1 1 A 49 49 LYS H H 49 7.134 7.801 -0.667 1
1 556 . 11 1 1 A 49 49 LYS HA H 49 4.283 4.618 -0.335 1
1 565 . 11 1 1 A 49 49 LYS CA C 49 55.167 54.731 0.436 1
1 566 . 11 1 1 A 49 49 LYS CB C 49 36.699 36.163 0.536 1
1 570 . 11 1 1 A 49 49 LYS N N 49 117.339 118.472 -1.133 1
1 571 . 11 1 1 A 50 50 GLU H H 50 8.411 8.885 -0.474 1
1 572 . 11 1 1 A 50 50 GLU HA H 50 4.583 5.067 -0.484 1
1 577 . 11 1 1 A 50 50 GLU CA C 50 54.592 55.056 -0.464 1
1 578 . 11 1 1 A 50 50 GLU CB C 50 33.263 33.381 -0.118 1
1 580 . 11 1 1 A 50 50 GLU N N 50 123.825 124.115 -0.290 1
1 581 . 11 1 1 A 51 51 ILE H H 51 9.225 8.809 0.416 1
1 582 . 11 1 1 A 51 51 ILE HA H 51 4.277 4.681 -0.404 1
1 592 . 11 1 1 A 51 51 ILE CA C 51 58.182 58.123 0.059 1
1 593 . 11 1 1 A 51 51 ILE CB C 51 39.663 38.575 1.088 1
1 597 . 11 1 1 A 51 51 ILE N N 51 125.271 126.318 -1.047 1
1 598 . 11 1 1 A 52 52 PRO HA H 52 4.543 4.660 -0.117 1
1 605 . 11 1 1 A 52 52 PRO C C 52 178.340 178.115 0.225 1
1 606 . 11 1 1 A 52 52 PRO CA C 52 62.726 62.991 -0.265 1
1 607 . 11 1 1 A 52 52 PRO CB C 52 32.003 31.770 0.233 1
1 610 . 11 1 1 A 53 53 LEU H H 53 8.723 8.056 0.667 1
1 611 . 11 1 1 A 53 53 LEU HA H 53 3.891 3.903 -0.012 1
1 621 . 11 1 1 A 53 53 LEU C C 53 179.673 179.093 0.580 1
1 622 . 11 1 1 A 53 53 LEU CA C 53 58.205 57.545 0.660 1
1 623 . 11 1 1 A 53 53 LEU CB C 53 40.171 41.441 -1.270 1
1 627 . 11 1 1 A 53 53 LEU N N 53 125.150 124.202 0.948 1
1 628 . 11 1 1 A 54 54 SER H H 54 8.360 8.095 0.265 1
1 629 . 11 1 1 A 54 54 SER HA H 54 4.164 4.134 0.030 1
1 632 . 11 1 1 A 54 54 SER C C 54 175.517 177.360 -1.843 1
1 633 . 11 1 1 A 54 54 SER CA C 54 60.193 61.350 -1.157 1
1 634 . 11 1 1 A 54 54 SER CB C 54 62.617 62.838 -0.221 1
1 635 . 11 1 1 A 54 54 SER N N 54 111.266 114.511 -3.245 1
1 636 . 11 1 1 A 55 55 GLU H H 55 7.666 8.012 -0.346 1
1 637 . 11 1 1 A 55 55 GLU HA H 55 4.363 4.165 0.198 1
1 642 . 11 1 1 A 55 55 GLU C C 55 176.753 177.826 -1.073 1
1 643 . 11 1 1 A 55 55 GLU CA C 55 56.200 58.958 -2.758 1
1 644 . 11 1 1 A 55 55 GLU CB C 55 30.526 29.191 1.335 1
1 646 . 11 1 1 A 55 55 GLU N N 55 119.485 119.764 -0.279 1
1 647 . 11 1 1 A 56 56 ILE H H 56 7.601 7.174 0.427 1
1 648 . 11 1 1 A 56 56 ILE HA H 56 3.793 3.947 -0.154 1
1 658 . 11 1 1 A 56 56 ILE C C 56 175.142 175.837 -0.695 1
1 659 . 11 1 1 A 56 56 ILE CA C 56 63.518 62.381 1.137 1
1 660 . 11 1 1 A 56 56 ILE CB C 56 37.169 38.090 -0.921 1
1 664 . 11 1 1 A 56 56 ILE N N 56 120.430 120.002 0.428 1
1 665 . 11 1 1 A 57 57 LEU H H 57 9.263 9.312 -0.049 1
1 666 . 11 1 1 A 57 57 LEU HA H 57 4.343 4.387 -0.044 1
1 676 . 11 1 1 A 57 57 LEU C C 57 177.898 176.552 1.346 1
1 677 . 11 1 1 A 57 57 LEU CA C 57 56.569 55.958 0.611 1
1 678 . 11 1 1 A 57 57 LEU CB C 57 41.980 42.491 -0.511 1
1 682 . 11 1 1 A 57 57 LEU N N 57 129.464 129.128 0.336 1
1 683 . 11 1 1 A 58 58 THR H H 58 7.414 7.359 0.055 1
1 684 . 11 1 1 A 58 58 THR HA H 58 4.512 4.925 -0.413 1
1 689 . 11 1 1 A 58 58 THR C C 58 171.314 172.765 -1.451 1
1 690 . 11 1 1 A 58 58 THR CA C 58 60.562 61.318 -0.756 1
1 691 . 11 1 1 A 58 58 THR CB C 58 70.803 73.495 -2.692 1
1 693 . 11 1 1 A 58 58 THR N N 58 109.129 110.314 -1.185 1
1 694 . 11 1 1 A 59 59 VAL H H 59 8.152 8.418 -0.266 1
1 695 . 11 1 1 A 59 59 VAL HA H 59 5.061 4.927 0.134 1
1 703 . 11 1 1 A 59 59 VAL C C 59 174.985 174.796 0.189 1
1 704 . 11 1 1 A 59 59 VAL CA C 59 61.354 61.282 0.072 1
1 705 . 11 1 1 A 59 59 VAL CB C 59 33.855 33.888 -0.033 1
1 708 . 11 1 1 A 59 59 VAL N N 59 123.676 124.283 -0.607 1
1 709 . 11 1 1 A 60 60 GLU H H 60 9.074 8.965 0.109 1
1 710 . 11 1 1 A 60 60 GLU HA H 60 4.977 4.823 0.154 1
1 715 . 11 1 1 A 60 60 GLU C C 60 176.063 175.416 0.647 1
1 716 . 11 1 1 A 60 60 GLU CA C 60 53.807 54.457 -0.650 1
1 717 . 11 1 1 A 60 60 GLU CB C 60 33.739 32.994 0.745 1
1 719 . 11 1 1 A 60 60 GLU N N 60 125.125 126.799 -1.674 1
1 720 . 11 1 1 A 61 61 SER H H 61 8.763 8.591 0.172 1
1 721 . 11 1 1 A 61 61 SER HA H 61 4.452 4.952 -0.500 1
1 724 . 11 1 1 A 61 61 SER C C 61 173.288 174.174 -0.886 1
1 725 . 11 1 1 A 61 61 SER CA C 61 59.384 58.327 1.057 1
1 726 . 11 1 1 A 61 61 SER CB C 61 63.390 64.175 -0.785 1
1 727 . 11 1 1 A 61 61 SER N N 61 117.523 118.621 -1.098 1
1 728 . 11 1 1 A 62 62 ALA H H 62 7.293 8.797 -1.504 1
1 729 . 11 1 1 A 62 62 ALA HA H 62 3.817 4.216 -0.399 1
1 733 . 11 1 1 A 62 62 ALA C C 62 176.717 177.795 -1.078 1
1 734 . 11 1 1 A 62 62 ALA CA C 62 53.966 52.940 1.026 1
1 735 . 11 1 1 A 62 62 ALA CB C 62 18.640 18.487 0.153 1
1 736 . 11 1 1 A 62 62 ALA N N 62 122.650 125.926 -3.276 1
1 737 . 11 1 1 A 63 63 GLN H H 63 8.736 8.017 0.719 1
1 738 . 11 1 1 A 63 63 GLN HA H 63 4.445 4.830 -0.385 1
1 745 . 11 1 1 A 63 63 GLN C C 63 173.700 175.307 -1.607 1
1 746 . 11 1 1 A 63 63 GLN CA C 63 56.376 55.828 0.548 1
1 747 . 11 1 1 A 63 63 GLN CB C 63 31.515 31.039 0.476 1
1 749 . 11 1 1 A 63 63 GLN N N 63 120.251 119.469 0.782 1
1 751 . 11 1 1 A 64 64 ASN H H 64 9.272 7.697 1.575 1
1 752 . 11 1 1 A 64 64 ASN HA H 64 4.906 5.077 -0.171 1
1 757 . 11 1 1 A 64 64 ASN C C 64 174.754 175.025 -0.271 1
1 758 . 11 1 1 A 64 64 ASN CA C 64 51.837 52.383 -0.546 1
1 759 . 11 1 1 A 64 64 ASN CB C 64 38.156 39.448 -1.292 1
1 760 . 11 1 1 A 64 64 ASN N N 64 122.346 118.756 3.590 1
1 762 . 11 1 1 A 65 65 PHE H H 65 8.854 9.207 -0.353 1
1 763 . 11 1 1 A 65 65 PHE HA H 65 4.947 5.154 -0.207 1
1 771 . 11 1 1 A 65 65 PHE C C 65 177.274 176.343 0.931 1
1 772 . 11 1 1 A 65 65 PHE CA C 65 57.519 57.145 0.374 1
1 773 . 11 1 1 A 65 65 PHE CB C 65 38.485 38.688 -0.203 1
1 779 . 11 1 1 A 65 65 PHE N N 65 123.638 125.475 -1.837 1
1 780 . 11 1 1 A 66 66 SER H H 66 8.163 8.133 0.030 1
1 781 . 11 1 1 A 66 66 SER HA H 66 4.393 4.429 -0.036 1
1 784 . 11 1 1 A 66 66 SER C C 66 175.699 177.004 -1.305 1
1 785 . 11 1 1 A 66 66 SER CA C 66 60.791 61.104 -0.313 1
1 786 . 11 1 1 A 66 66 SER CB C 66 64.591 63.179 1.412 1
1 787 . 11 1 1 A 66 66 SER N N 66 113.913 115.881 -1.968 1
1 788 . 11 1 1 A 67 67 LEU H H 67 8.574 7.880 0.694 1
1 789 . 11 1 1 A 67 67 LEU HA H 67 4.302 3.806 0.496 1
1 799 . 11 1 1 A 67 67 LEU C C 67 176.269 177.315 -1.046 1
1 800 . 11 1 1 A 67 67 LEU CA C 67 55.601 58.195 -2.594 1
1 801 . 11 1 1 A 67 67 LEU CB C 67 42.021 41.861 0.160 1
1 805 . 11 1 1 A 67 67 LEU N N 67 121.264 120.985 0.279 1
1 806 . 11 1 1 A 68 68 VAL H H 68 6.921 7.518 -0.597 1
1 807 . 11 1 1 A 68 68 VAL HA H 68 4.473 4.124 0.349 1
1 815 . 11 1 1 A 68 68 VAL C C 68 173.809 175.009 -1.200 1
1 816 . 11 1 1 A 68 68 VAL CA C 68 58.047 60.884 -2.837 1
1 817 . 11 1 1 A 68 68 VAL CB C 68 32.295 31.724 0.571 1
1 820 . 11 1 1 A 68 68 VAL N N 68 111.287 115.856 -4.569 1
1 821 . 11 1 1 A 69 69 PRO HA H 69 4.658 4.697 -0.039 1
1 828 . 11 1 1 A 69 69 PRO CA C 69 61.747 61.498 0.249 1
1 829 . 11 1 1 A 69 69 PRO CB C 69 30.693 31.710 -1.017 1
1 832 . 11 1 1 A 70 70 PRO HA H 70 4.414 4.276 0.138 1
1 839 . 11 1 1 A 70 70 PRO CA C 70 63.997 63.791 0.206 1
1 840 . 11 1 1 A 70 70 PRO CB C 70 31.602 31.273 0.329 1
1 843 . 11 1 1 A 71 71 GLY H H 71 8.824 8.937 -0.113 1
1 844 . 11 1 1 A 71 71 GLY HA2 H 71 3.703 3.937 -0.234 1
1 845 . 11 1 1 A 71 71 GLY HA3 H 71 4.193 3.937 0.256 1
1 846 . 11 1 1 A 71 71 GLY C C 71 174.052 174.550 -0.498 1
1 847 . 11 1 1 A 71 71 GLY CA C 71 45.065 45.143 -0.078 1
1 848 . 11 1 1 A 71 71 GLY N N 71 111.845 112.853 -1.008 1
1 849 . 11 1 1 A 72 72 THR H H 72 7.597 7.234 0.363 1
1 850 . 11 1 1 A 72 72 THR HA H 72 4.133 4.127 0.006 1
1 855 . 11 1 1 A 72 72 THR CA C 72 63.129 63.489 -0.360 1
1 856 . 11 1 1 A 72 72 THR CB C 72 69.560 68.989 0.571 1
1 858 . 11 1 1 A 72 72 THR N N 72 117.485 115.739 1.746 1
1 859 . 11 1 1 A 73 73 ASN H H 73 9.280 8.580 0.700 1
1 860 . 11 1 1 A 73 73 ASN HA H 73 4.786 4.611 0.175 1
1 865 . 11 1 1 A 73 73 ASN CA C 73 52.009 52.298 -0.289 1
1 866 . 11 1 1 A 73 73 ASN CB C 73 37.553 38.253 -0.700 1
1 867 . 11 1 1 A 73 73 ASN N N 73 127.641 125.244 2.397 1
1 869 . 11 1 1 A 74 74 PRO HA H 74 4.752 4.971 -0.219 1
1 876 . 11 1 1 A 74 74 PRO C C 74 175.190 176.364 -1.174 1
1 877 . 11 1 1 A 74 74 PRO CA C 74 63.395 62.583 0.812 1
1 878 . 11 1 1 A 74 74 PRO CB C 74 33.164 33.372 -0.208 1
1 881 . 11 1 1 A 75 75 HIS H H 75 8.025 9.025 -1.000 1
1 882 . 11 1 1 A 75 75 HIS HA H 75 5.047 5.325 -0.278 1
1 887 . 11 1 1 A 75 75 HIS C C 75 172.562 174.792 -2.230 1
1 888 . 11 1 1 A 75 75 HIS CA C 75 54.336 54.114 0.222 1
1 889 . 11 1 1 A 75 75 HIS CB C 75 30.956 32.938 -1.982 1
1 892 . 11 1 1 A 75 75 HIS N N 75 116.198 116.731 -0.533 1
1 893 . 11 1 1 A 76 76 CYS H H 76 8.343 9.209 -0.866 1
1 894 . 11 1 1 A 76 76 CYS HA H 76 4.594 4.387 0.207 1
1 897 . 11 1 1 A 76 76 CYS C C 76 175.651 175.239 0.412 1
1 898 . 11 1 1 A 76 76 CYS CA C 76 61.066 60.816 0.250 1
1 899 . 11 1 1 A 76 76 CYS CB C 76 30.193 27.899 2.294 1
1 900 . 11 1 1 A 76 76 CYS N N 76 113.289 117.988 -4.699 1
1 901 . 11 1 1 A 77 77 PHE H H 77 8.433 7.102 1.331 1
1 902 . 11 1 1 A 77 77 PHE HA H 77 5.105 5.235 -0.130 1
1 910 . 11 1 1 A 77 77 PHE C C 77 171.822 173.009 -1.187 1
1 911 . 11 1 1 A 77 77 PHE CA C 77 56.874 55.890 0.984 1
1 912 . 11 1 1 A 77 77 PHE CB C 77 39.393 42.590 -3.197 1
1 918 . 11 1 1 A 77 77 PHE N N 77 114.874 116.604 -1.730 1
1 919 . 11 1 1 A 78 78 GLU H H 78 9.823 9.162 0.661 1
1 920 . 11 1 1 A 78 78 GLU HA H 78 5.333 5.067 0.266 1
1 925 . 11 1 1 A 78 78 GLU C C 78 175.602 175.516 0.086 1
1 926 . 11 1 1 A 78 78 GLU CA C 78 54.212 54.877 -0.665 1
1 927 . 11 1 1 A 78 78 GLU CB C 78 31.702 32.622 -0.920 1
1 929 . 11 1 1 A 78 78 GLU N N 78 121.074 118.800 2.274 1
1 930 . 11 1 1 A 79 79 ILE H H 79 9.093 9.184 -0.091 1
1 931 . 11 1 1 A 79 79 ILE HA H 79 4.637 4.622 0.015 1
1 941 . 11 1 1 A 79 79 ILE C C 79 174.476 175.256 -0.780 1
1 942 . 11 1 1 A 79 79 ILE CA C 79 60.932 60.839 0.093 1
1 943 . 11 1 1 A 79 79 ILE CB C 79 40.803 37.258 3.545 1
1 947 . 11 1 1 A 79 79 ILE N N 79 121.382 125.285 -3.903 1
1 948 . 11 1 1 A 80 80 VAL H H 80 8.841 7.867 0.974 1
1 949 . 11 1 1 A 80 80 VAL HA H 80 4.425 3.848 0.577 1
1 957 . 11 1 1 A 80 80 VAL C C 80 175.930 175.219 0.711 1
1 958 . 11 1 1 A 80 80 VAL CA C 80 63.324 63.067 0.257 1
1 959 . 11 1 1 A 80 80 VAL CB C 80 32.783 31.044 1.739 1
1 962 . 11 1 1 A 80 80 VAL N N 80 128.970 127.141 1.829 1
1 963 . 11 1 1 A 81 81 THR H H 81 8.303 7.939 0.364 1
1 964 . 11 1 1 A 81 81 THR HA H 81 5.264 4.663 0.601 1
1 969 . 11 1 1 A 81 81 THR C C 81 173.664 174.722 -1.058 1
1 970 . 11 1 1 A 81 81 THR CA C 81 59.540 60.077 -0.537 1
1 971 . 11 1 1 A 81 81 THR CB C 81 72.197 71.437 0.760 1
1 973 . 11 1 1 A 81 81 THR N N 81 118.077 118.526 -0.449 1
1 974 . 11 1 1 A 82 82 ALA H H 82 9.586 8.506 1.080 1
1 975 . 11 1 1 A 82 82 ALA HA H 82 4.093 4.345 -0.252 1
1 979 . 11 1 1 A 82 82 ALA C C 82 178.667 177.720 0.947 1
1 980 . 11 1 1 A 82 82 ALA CA C 82 55.321 53.076 2.245 1
1 981 . 11 1 1 A 82 82 ALA CB C 82 18.094 18.224 -0.130 1
1 982 . 11 1 1 A 82 82 ALA N N 82 122.493 123.810 -1.317 1
1 983 . 11 1 1 A 83 83 ASN H H 83 7.923 8.035 -0.112 1
1 984 . 11 1 1 A 83 83 ASN HA H 83 4.808 5.078 -0.270 1
1 989 . 11 1 1 A 83 83 ASN C C 83 174.766 174.519 0.247 1
1 990 . 11 1 1 A 83 83 ASN CA C 83 53.333 54.777 -1.444 1
1 991 . 11 1 1 A 83 83 ASN CB C 83 40.335 41.654 -1.319 1
1 992 . 11 1 1 A 83 83 ASN N N 83 110.765 115.876 -5.111 1
1 994 . 11 1 1 A 84 84 ALA H H 84 7.352 7.133 0.219 1
1 995 . 11 1 1 A 84 84 ALA HA H 84 4.625 4.479 0.146 1
1 999 . 11 1 1 A 84 84 ALA C C 84 176.547 174.951 1.596 1
1 1000 . 11 1 1 A 84 84 ALA CA C 84 52.858 51.821 1.037 1
1 1001 . 11 1 1 A 84 84 ALA CB C 84 21.233 21.963 -0.730 1
1 1002 . 11 1 1 A 84 84 ALA N N 84 119.599 117.557 2.042 1
1 1003 . 11 1 1 A 85 85 THR H H 85 8.374 8.719 -0.345 1
1 1004 . 11 1 1 A 85 85 THR HA H 85 5.014 4.552 0.462 1
1 1009 . 11 1 1 A 85 85 THR C C 85 171.568 173.979 -2.411 1
1 1010 . 11 1 1 A 85 85 THR CA C 85 61.618 62.076 -0.458 1
1 1011 . 11 1 1 A 85 85 THR CB C 85 70.850 69.413 1.437 1
1 1013 . 11 1 1 A 85 85 THR N N 85 119.032 113.533 5.499 1
1 1014 . 11 1 1 A 86 86 TYR H H 86 9.006 8.915 0.091 1
1 1015 . 11 1 1 A 86 86 TYR HA H 86 4.658 4.949 -0.291 1
1 1022 . 11 1 1 A 86 86 TYR C C 86 173.773 175.596 -1.823 1
1 1023 . 11 1 1 A 86 86 TYR CA C 86 56.938 58.044 -1.106 1
1 1024 . 11 1 1 A 86 86 TYR CB C 86 39.513 39.784 -0.271 1
1 1029 . 11 1 1 A 86 86 TYR N N 86 123.494 127.316 -3.822 1
1 1030 . 11 1 1 A 87 87 PHE H H 87 9.263 9.092 0.171 1
1 1031 . 11 1 1 A 87 87 PHE HA H 87 4.127 4.678 -0.551 1
1 1039 . 11 1 1 A 87 87 PHE C C 87 176.369 174.281 2.088 1
1 1040 . 11 1 1 A 87 87 PHE CA C 87 57.238 55.519 1.719 1
1 1041 . 11 1 1 A 87 87 PHE CB C 87 37.086 38.175 -1.089 1
1 1047 . 11 1 1 A 87 87 PHE N N 87 125.384 119.695 5.689 1
1 1048 . 11 1 1 A 88 88 VAL H H 88 9.023 8.194 0.829 1
1 1049 . 11 1 1 A 88 88 VAL HA H 88 4.162 4.677 -0.515 1
1 1057 . 11 1 1 A 88 88 VAL C C 88 176.390 176.162 0.228 1
1 1058 . 11 1 1 A 88 88 VAL CA C 88 63.975 61.652 2.323 1
1 1059 . 11 1 1 A 88 88 VAL CB C 88 32.378 31.574 0.804 1
1 1062 . 11 1 1 A 88 88 VAL N N 88 127.348 123.954 3.394 1
1 1063 . 11 1 1 A 89 89 GLY H H 89 9.233 8.411 0.822 1
1 1064 . 11 1 1 A 89 89 GLY HA2 H 89 4.293 4.101 0.192 1
1 1065 . 11 1 1 A 89 89 GLY HA3 H 89 4.186 4.213 -0.027 1
1 1066 . 11 1 1 A 89 89 GLY C C 89 172.378 171.571 0.807 1
1 1067 . 11 1 1 A 89 89 GLY CA C 89 43.798 46.156 -2.358 1
1 1068 . 11 1 1 A 89 89 GLY N N 89 116.041 112.664 3.377 1
1 1069 . 11 1 1 A 90 90 GLU H H 90 8.532 8.100 0.432 1
1 1070 . 11 1 1 A 90 90 GLU HA H 90 4.794 4.811 -0.017 1
1 1075 . 11 1 1 A 90 90 GLU C C 90 174.221 175.918 -1.697 1
1 1076 . 11 1 1 A 90 90 GLU CA C 90 56.393 55.343 1.050 1
1 1077 . 11 1 1 A 90 90 GLU CB C 90 33.182 31.541 1.641 1
1 1079 . 11 1 1 A 90 90 GLU N N 90 120.905 122.698 -1.793 1
1 1080 . 11 1 1 A 91 91 MET H H 91 8.450 8.881 -0.431 1
1 1081 . 11 1 1 A 91 91 MET HA H 91 4.904 5.196 -0.292 1
1 1089 . 11 1 1 A 91 91 MET C C 91 173.373 173.718 -0.345 1
1 1090 . 11 1 1 A 91 91 MET CA C 91 52.277 52.508 -0.231 1
1 1091 . 11 1 1 A 91 91 MET CB C 91 32.789 34.438 -1.649 1
1 1094 . 11 1 1 A 91 91 MET N N 91 125.173 122.083 3.090 1
1 1095 . 11 1 1 A 92 92 PRO HA H 92 4.358 4.320 0.038 1
1 1102 . 11 1 1 A 92 92 PRO C C 92 177.589 176.582 1.007 1
1 1103 . 11 1 1 A 92 92 PRO CA C 92 63.143 63.723 -0.580 1
1 1104 . 11 1 1 A 92 92 PRO CB C 92 32.083 31.517 0.566 1
1 1107 . 11 1 1 A 93 93 GLY H H 93 8.330 8.417 -0.087 1
1 1108 . 11 1 1 A 93 93 GLY HA2 H 93 3.943 4.101 -0.158 1
1 1109 . 11 1 1 A 93 93 GLY HA3 H 93 4.045 4.107 -0.062 1
1 1110 . 11 1 1 A 93 93 GLY C C 93 174.730 174.214 0.516 1
1 1111 . 11 1 1 A 93 93 GLY CA C 93 45.276 45.307 -0.031 1
1 1112 . 11 1 1 A 93 93 GLY N N 93 109.420 111.200 -1.780 1
1 1113 . 11 1 1 A 94 94 GLY H H 94 8.331 8.326 0.005 1
1 1114 . 11 1 1 A 94 94 GLY HA2 H 94 3.973 3.955 0.018 1
1 1115 . 11 1 1 A 94 94 GLY HA3 H 94 3.973 3.956 0.017 1
1 1116 . 11 1 1 A 94 94 GLY C C 94 174.100 173.542 0.558 1
1 1117 . 11 1 1 A 94 94 GLY CA C 94 45.333 45.748 -0.415 1
1 1118 . 11 1 1 A 94 94 GLY N N 94 108.483 109.601 -1.118 1
1 1119 . 11 1 1 A 95 95 THR H H 95 8.095 8.486 -0.391 1
1 1120 . 11 1 1 A 95 95 THR HA H 95 4.643 4.858 -0.215 1
1 1125 . 11 1 1 A 95 95 THR C C 95 173.155 172.989 0.166 1
1 1126 . 11 1 1 A 95 95 THR CA C 95 59.922 59.955 -0.033 1
1 1127 . 11 1 1 A 95 95 THR CB C 95 69.871 69.092 0.779 1
1 1129 . 11 1 1 A 95 95 THR N N 95 115.860 115.490 0.370 1
1 1130 . 11 1 1 A 96 96 PRO HA H 96 4.400 4.716 -0.316 1
1 1137 . 11 1 1 A 96 96 PRO C C 96 177.565 175.684 1.881 1
1 1138 . 11 1 1 A 96 96 PRO CA C 96 64.047 62.270 1.777 1
1 1139 . 11 1 1 A 96 96 PRO CB C 96 31.816 29.655 2.161 1
1 1142 . 11 1 1 A 97 97 GLY H H 97 8.572 8.047 0.525 1
1 1143 . 11 1 1 A 97 97 GLY HA2 H 97 4.007 4.107 -0.100 1
1 1144 . 11 1 1 A 97 97 GLY HA3 H 97 4.007 4.107 -0.100 1
1 1145 . 11 1 1 A 97 97 GLY C C 97 174.609 173.264 1.345 1
1 1146 . 11 1 1 A 97 97 GLY CA C 97 45.276 45.080 0.196 1
1 1147 . 11 1 1 A 97 97 GLY N N 97 110.233 109.992 0.241 1
1 1148 . 11 1 1 A 98 98 GLY H H 98 8.119 7.890 0.229 1
1 1149 . 11 1 1 A 98 98 GLY HA2 H 98 4.086 4.248 -0.162 1
1 1150 . 11 1 1 A 98 98 GLY HA3 H 98 4.200 4.250 -0.050 1
1 1151 . 11 1 1 A 98 98 GLY CA C 98 44.876 45.970 -1.094 1
1 1152 . 11 1 1 A 98 98 GLY N N 98 108.845 110.416 -1.571 1
1 1153 . 11 1 1 A 99 99 PRO HA H 99 4.494 4.472 0.022 1
1 1160 . 11 1 1 A 99 99 PRO C C 99 177.468 175.157 2.311 1
1 1161 . 11 1 1 A 99 99 PRO CA C 99 63.500 63.920 -0.420 1
1 1162 . 11 1 1 A 99 99 PRO CB C 99 32.013 31.387 0.626 1
1 1165 . 11 1 1 A 100 100 SER H H 100 8.472 7.478 0.994 1
1 1166 . 11 1 1 A 100 100 SER HA H 100 4.513 4.968 -0.455 1
1 1169 . 11 1 1 A 100 100 SER C C 100 175.408 173.817 1.591 1
1 1170 . 11 1 1 A 100 100 SER CA C 100 58.557 56.615 1.942 1
1 1171 . 11 1 1 A 100 100 SER CB C 100 63.918 65.573 -1.655 1
1 1172 . 11 1 1 A 100 100 SER N N 100 116.038 110.277 5.761 1
1 1173 . 11 1 1 A 101 101 GLY H H 101 8.427 9.125 -0.698 1
1 1174 . 11 1 1 A 101 101 GLY HA2 H 101 4.064 4.267 -0.203 1
1 1175 . 11 1 1 A 101 101 GLY HA3 H 101 4.064 4.267 -0.203 1
1 1176 . 11 1 1 A 101 101 GLY C C 101 174.730 172.271 2.459 1
1 1177 . 11 1 1 A 101 101 GLY CA C 101 45.575 44.155 1.420 1
1 1178 . 11 1 1 A 101 101 GLY N N 101 110.558 111.127 -0.569 1
1 1179 . 11 1 1 A 102 102 GLN H H 102 8.416 8.775 -0.359 1
1 1180 . 11 1 1 A 102 102 GLN HA H 102 4.383 4.973 -0.590 1
1 1187 . 11 1 1 A 102 102 GLN C C 102 177.346 175.312 2.034 1
1 1188 . 11 1 1 A 102 102 GLN CA C 102 57.080 54.571 2.509 1
1 1189 . 11 1 1 A 102 102 GLN CB C 102 29.235 32.565 -3.330 1
1 1191 . 11 1 1 A 102 102 GLN N N 102 120.112 119.378 0.734 1
1 1193 . 11 1 1 A 103 103 GLY H H 103 8.713 8.566 0.147 1
1 1194 . 11 1 1 A 103 103 GLY HA2 H 103 4.193 4.052 0.141 1
1 1195 . 11 1 1 A 103 103 GLY HA3 H 103 4.078 4.068 0.010 1
1 1196 . 11 1 1 A 103 103 GLY C C 103 175.602 173.883 1.719 1
1 1197 . 11 1 1 A 103 103 GLY CA C 103 46.120 46.169 -0.049 1
1 1198 . 11 1 1 A 103 103 GLY N N 103 109.817 113.998 -4.181 1
1 1199 . 11 1 1 A 104 104 ALA H H 104 8.366 7.813 0.553 1
1 1200 . 11 1 1 A 104 104 ALA HA H 104 4.449 4.685 -0.236 1
1 1204 . 11 1 1 A 104 104 ALA C C 104 179.188 178.100 1.088 1
1 1205 . 11 1 1 A 104 104 ALA CA C 104 54.230 53.098 1.132 1
1 1206 . 11 1 1 A 104 104 ALA CB C 104 19.080 20.395 -1.315 1
1 1207 . 11 1 1 A 104 104 ALA N N 104 124.808 120.285 4.523 1
1 1208 . 11 1 1 A 105 105 GLU H H 105 8.576 8.811 -0.235 1
1 1209 . 11 1 1 A 105 105 GLU HA H 105 4.161 4.127 0.034 1
1 1214 . 11 1 1 A 105 105 GLU C C 105 179.200 178.891 0.309 1
1 1215 . 11 1 1 A 105 105 GLU CA C 105 59.173 59.093 0.080 1
1 1216 . 11 1 1 A 105 105 GLU CB C 105 29.194 30.195 -1.001 1
1 1218 . 11 1 1 A 105 105 GLU N N 105 119.238 118.377 0.861 1
1 1219 . 11 1 1 A 106 106 ALA H H 106 8.381 8.240 0.141 1
1 1220 . 11 1 1 A 106 106 ALA HA H 106 4.283 4.130 0.153 1
1 1224 . 11 1 1 A 106 106 ALA C C 106 180.048 179.916 0.132 1
1 1225 . 11 1 1 A 106 106 ALA CA C 106 54.687 55.235 -0.548 1
1 1226 . 11 1 1 A 106 106 ALA CB C 106 18.341 18.619 -0.278 1
1 1227 . 11 1 1 A 106 106 ALA N N 106 123.327 122.901 0.426 1
1 1228 . 11 1 1 A 107 107 ALA H H 107 8.123 8.140 -0.017 1
1 1229 . 11 1 1 A 107 107 ALA HA H 107 4.554 4.305 0.249 1
1 1233 . 11 1 1 A 107 107 ALA C C 107 179.757 179.973 -0.216 1
1 1234 . 11 1 1 A 107 107 ALA CA C 107 55.355 55.636 -0.281 1
1 1235 . 11 1 1 A 107 107 ALA CB C 107 18.939 18.581 0.358 1
1 1236 . 11 1 1 A 107 107 ALA N N 107 120.740 120.715 0.025 1
1 1237 . 11 1 1 A 108 108 ARG H H 108 8.403 8.071 0.332 1
1 1238 . 11 1 1 A 108 108 ARG HA H 108 4.254 4.207 0.047 1
1 1245 . 11 1 1 A 108 108 ARG C C 108 179.111 178.804 0.307 1
1 1246 . 11 1 1 A 108 108 ARG CA C 108 59.015 58.491 0.524 1
1 1247 . 11 1 1 A 108 108 ARG CB C 108 29.752 30.121 -0.369 1
1 1250 . 11 1 1 A 108 108 ARG N N 108 119.531 117.184 2.347 1
1 1251 . 11 1 1 A 109 109 GLY H H 109 8.182 8.070 0.112 1
1 1252 . 11 1 1 A 109 109 GLY HA2 H 109 3.822 3.629 0.193 1
1 1253 . 11 1 1 A 109 109 GLY HA3 H 109 3.822 3.653 0.169 1
1 1254 . 11 1 1 A 109 109 GLY C C 109 177.020 176.483 0.537 1
1 1255 . 11 1 1 A 109 109 GLY CA C 109 46.718 47.330 -0.612 1
1 1256 . 11 1 1 A 109 109 GLY N N 109 107.331 108.731 -1.400 1
1 1257 . 11 1 1 A 110 110 TRP H H 110 7.925 8.140 -0.215 1
1 1258 . 11 1 1 A 110 110 TRP HA H 110 3.963 4.628 -0.665 1
1 1267 . 11 1 1 A 110 110 TRP C C 110 176.691 178.049 -1.358 1
1 1268 . 11 1 1 A 110 110 TRP CA C 110 62.041 60.606 1.435 1
1 1269 . 11 1 1 A 110 110 TRP CB C 110 28.989 28.918 0.071 1
1 1275 . 11 1 1 A 110 110 TRP N N 110 122.304 122.136 0.168 1
1 1277 . 11 1 1 A 111 111 GLU H H 111 7.946 7.932 0.014 1
1 1278 . 11 1 1 A 111 111 GLU HA H 111 2.594 2.969 -0.375 1
1 1283 . 11 1 1 A 111 111 GLU C C 111 177.976 179.120 -1.144 1
1 1284 . 11 1 1 A 111 111 GLU CA C 111 60.193 59.106 1.087 1
1 1285 . 11 1 1 A 111 111 GLU CB C 111 29.277 29.430 -0.153 1
1 1287 . 11 1 1 A 111 111 GLU N N 111 121.755 119.211 2.544 1
1 1288 . 11 1 1 A 112 112 THR H H 112 7.993 7.700 0.293 1
1 1289 . 11 1 1 A 112 112 THR HA H 112 3.722 3.819 -0.097 1
1 1294 . 11 1 1 A 112 112 THR C C 112 176.038 175.872 0.166 1
1 1295 . 11 1 1 A 112 112 THR CA C 112 66.104 66.552 -0.448 1
1 1296 . 11 1 1 A 112 112 THR CB C 112 68.885 68.689 0.196 1
1 1298 . 11 1 1 A 112 112 THR N N 112 112.247 116.513 -4.266 1
1 1299 . 11 1 1 A 113 113 ALA H H 113 7.742 8.171 -0.429 1
1 1300 . 11 1 1 A 113 113 ALA HA H 113 4.029 3.979 0.050 1
1 1304 . 11 1 1 A 113 113 ALA C C 113 180.545 179.944 0.601 1
1 1305 . 11 1 1 A 113 113 ALA CA C 113 55.127 55.110 0.017 1
1 1306 . 11 1 1 A 113 113 ALA CB C 113 18.854 18.408 0.446 1
1 1307 . 11 1 1 A 113 113 ALA N N 113 123.134 122.712 0.422 1
1 1308 . 11 1 1 A 114 114 ILE H H 114 8.472 8.560 -0.088 1
1 1309 . 11 1 1 A 114 114 ILE HA H 114 3.613 3.740 -0.127 1
1 1319 . 11 1 1 A 114 114 ILE C C 114 176.947 178.007 -1.060 1
1 1320 . 11 1 1 A 114 114 ILE CA C 114 66.016 65.161 0.855 1
1 1321 . 11 1 1 A 114 114 ILE CB C 114 38.335 37.967 0.368 1
1 1325 . 11 1 1 A 114 114 ILE N N 114 118.276 118.069 0.207 1
1 1326 . 11 1 1 A 115 115 ARG H H 115 8.181 7.923 0.258 1
1 1327 . 11 1 1 A 115 115 ARG HA H 115 3.835 3.872 -0.037 1
1 1334 . 11 1 1 A 115 115 ARG C C 115 179.588 179.063 0.525 1
1 1335 . 11 1 1 A 115 115 ARG CA C 115 61.072 59.999 1.073 1
1 1336 . 11 1 1 A 115 115 ARG CB C 115 29.975 29.847 0.128 1
1 1339 . 11 1 1 A 115 115 ARG N N 115 117.921 119.164 -1.243 1
1 1340 . 11 1 1 A 116 116 GLN H H 116 8.395 8.573 -0.178 1
1 1341 . 11 1 1 A 116 116 GLN HA H 116 4.030 4.063 -0.033 1
1 1348 . 11 1 1 A 116 116 GLN C C 116 178.716 178.676 0.040 1
1 1349 . 11 1 1 A 116 116 GLN CA C 116 58.790 58.878 -0.088 1
1 1350 . 11 1 1 A 116 116 GLN CB C 116 28.248 28.433 -0.185 1
1 1352 . 11 1 1 A 116 116 GLN N N 116 116.842 118.901 -2.059 1
1 1354 . 11 1 1 A 117 117 ALA H H 117 7.902 8.252 -0.350 1
1 1355 . 11 1 1 A 117 117 ALA HA H 117 4.143 4.136 0.007 1
1 1359 . 11 1 1 A 117 117 ALA C C 117 179.685 180.204 -0.519 1
1 1360 . 11 1 1 A 117 117 ALA CA C 117 54.476 54.933 -0.457 1
1 1361 . 11 1 1 A 117 117 ALA CB C 117 18.300 18.318 -0.018 1
1 1362 . 11 1 1 A 117 117 ALA N N 117 122.828 122.894 -0.066 1
1 1363 . 11 1 1 A 118 118 LEU H H 118 7.904 8.081 -0.177 1
1 1364 . 11 1 1 A 118 118 LEU HA H 118 4.119 4.104 0.015 1
1 1374 . 11 1 1 A 118 118 LEU C C 118 178.437 178.614 -0.177 1
1 1375 . 11 1 1 A 118 118 LEU CA C 118 56.781 57.065 -0.284 1
1 1376 . 11 1 1 A 118 118 LEU CB C 118 42.371 41.908 0.463 1
1 1380 . 11 1 1 A 118 118 LEU N N 118 117.632 120.107 -2.475 1
1 1381 . 11 1 1 A 119 119 MET H H 119 7.673 8.127 -0.454 1
1 1382 . 11 1 1 A 119 119 MET HA H 119 4.442 4.246 0.196 1
1 1390 . 11 1 1 A 119 119 MET C C 119 176.680 177.546 -0.866 1
1 1391 . 11 1 1 A 119 119 MET CA C 119 56.432 57.755 -1.323 1
1 1392 . 11 1 1 A 119 119 MET CB C 119 32.769 31.677 1.092 1
1 1395 . 11 1 1 A 119 119 MET N N 119 117.286 117.165 0.121 1
1 1396 . 11 1 1 A 120 120 SER H H 120 7.878 7.372 0.506 1
1 1397 . 11 1 1 A 120 120 SER HA H 120 4.500 4.640 -0.140 1
1 1400 . 11 1 1 A 120 120 SER C C 120 174.742 174.684 0.058 1
1 1401 . 11 1 1 A 120 120 SER CA C 120 58.962 58.317 0.645 1
1 1402 . 11 1 1 A 120 120 SER CB C 120 63.853 62.737 1.116 1
1 1403 . 11 1 1 A 120 120 SER N N 120 115.064 112.709 2.355 1
1 1404 . 11 1 1 A 121 121 GLY H H 121 8.059 8.323 -0.264 1
1 1405 . 11 1 1 A 121 121 GLY HA2 H 121 4.231 4.072 0.159 1
1 1406 . 11 1 1 A 121 121 GLY HA3 H 121 4.112 4.072 0.040 1
1 1407 . 11 1 1 A 121 121 GLY C C 121 172.065 174.521 -2.456 1
1 1408 . 11 1 1 A 121 121 GLY CA C 121 45.030 44.283 0.747 1
1 1409 . 11 1 1 A 121 121 GLY N N 121 110.271 109.668 0.603 1
1 1410 . 11 1 1 A 122 122 PRO HA H 122 4.496 4.540 -0.044 1
1 1417 . 11 1 1 A 122 122 PRO CA C 122 63.399 63.875 -0.476 1
1 1418 . 11 1 1 A 122 122 PRO CB C 122 32.186 32.022 0.164 1
1 1 . 12 1 1 A 6 6 SER H H 6 8.337 7.695 0.642 1
1 2 . 12 1 1 A 6 6 SER HA H 6 4.597 4.760 -0.163 1
1 5 . 12 1 1 A 6 6 SER C C 6 174.637 173.345 1.292 1
1 6 . 12 1 1 A 6 6 SER CA C 6 58.469 57.388 1.081 1
1 7 . 12 1 1 A 6 6 SER CB C 6 64.221 65.394 -1.173 1
1 8 . 12 1 1 A 6 6 SER N N 6 117.887 117.036 0.851 1
1 9 . 12 1 1 A 7 7 GLY H H 7 8.280 8.528 -0.248 1
1 10 . 12 1 1 A 7 7 GLY HA2 H 7 4.063 4.084 -0.021 1
1 11 . 12 1 1 A 7 7 GLY HA3 H 7 4.063 4.085 -0.022 1
1 12 . 12 1 1 A 7 7 GLY C C 7 173.724 173.422 0.302 1
1 13 . 12 1 1 A 7 7 GLY CA C 7 44.941 44.487 0.454 1
1 14 . 12 1 1 A 7 7 GLY N N 7 110.151 111.939 -1.788 1
1 15 . 12 1 1 A 8 8 THR H H 8 8.212 8.162 0.050 1
1 16 . 12 1 1 A 8 8 THR HA H 8 4.173 4.391 -0.218 1
1 21 . 12 1 1 A 8 8 THR C C 8 174.723 174.040 0.683 1
1 22 . 12 1 1 A 8 8 THR CA C 8 63.622 63.600 0.022 1
1 23 . 12 1 1 A 8 8 THR CB C 8 69.460 69.140 0.320 1
1 25 . 12 1 1 A 8 8 THR N N 8 116.817 116.622 0.195 1
1 26 . 12 1 1 A 9 9 LEU H H 9 9.374 9.257 0.117 1
1 27 . 12 1 1 A 9 9 LEU HA H 9 4.302 4.281 0.021 1
1 37 . 12 1 1 A 9 9 LEU C C 9 177.468 176.641 0.827 1
1 38 . 12 1 1 A 9 9 LEU CA C 9 55.936 56.096 -0.160 1
1 39 . 12 1 1 A 9 9 LEU CB C 9 42.843 42.555 0.288 1
1 43 . 12 1 1 A 9 9 LEU N N 9 127.798 128.457 -0.659 1
1 44 . 12 1 1 A 10 10 ARG H H 10 7.512 7.374 0.138 1
1 45 . 12 1 1 A 10 10 ARG HA H 10 4.199 4.709 -0.510 1
1 52 . 12 1 1 A 10 10 ARG C C 10 172.501 174.048 -1.547 1
1 53 . 12 1 1 A 10 10 ARG CA C 10 56.165 54.428 1.737 1
1 54 . 12 1 1 A 10 10 ARG CB C 10 32.442 33.356 -0.914 1
1 57 . 12 1 1 A 10 10 ARG N N 10 117.979 117.735 0.244 1
1 58 . 12 1 1 A 11 11 GLU H H 11 8.434 8.753 -0.319 1
1 59 . 12 1 1 A 11 11 GLU HA H 11 5.993 5.690 0.303 1
1 64 . 12 1 1 A 11 11 GLU C C 11 174.800 174.557 0.243 1
1 65 . 12 1 1 A 11 11 GLU CA C 11 54.570 55.076 -0.506 1
1 66 . 12 1 1 A 11 11 GLU CB C 11 34.245 33.146 1.099 1
1 68 . 12 1 1 A 11 11 GLU N N 11 120.782 121.959 -1.177 1
1 69 . 12 1 1 A 12 12 GLY H H 12 8.131 7.783 0.348 1
1 70 . 12 1 1 A 12 12 GLY HA2 H 12 4.714 3.480 1.234 1
1 71 . 12 1 1 A 12 12 GLY HA3 H 12 3.763 4.146 -0.383 1
1 72 . 12 1 1 A 12 12 GLY C C 12 171.060 171.898 -0.838 1
1 73 . 12 1 1 A 12 12 GLY CA C 12 45.241 45.114 0.127 1
1 74 . 12 1 1 A 12 12 GLY N N 12 107.457 106.061 1.396 1
1 75 . 12 1 1 A 13 13 TRP H H 13 8.783 8.599 0.184 1
1 76 . 12 1 1 A 13 13 TRP HA H 13 5.152 4.941 0.211 1
1 85 . 12 1 1 A 13 13 TRP C C 13 177.528 176.681 0.847 1
1 86 . 12 1 1 A 13 13 TRP CA C 13 57.783 58.826 -1.043 1
1 87 . 12 1 1 A 13 13 TRP CB C 13 30.222 30.116 0.106 1
1 93 . 12 1 1 A 13 13 TRP N N 13 120.792 121.557 -0.765 1
1 95 . 12 1 1 A 14 14 VAL H H 14 9.179 9.002 0.177 1
1 96 . 12 1 1 A 14 14 VAL HA H 14 4.072 4.558 -0.486 1
1 104 . 12 1 1 A 14 14 VAL C C 14 174.981 173.570 1.411 1
1 105 . 12 1 1 A 14 14 VAL CA C 14 61.741 60.450 1.291 1
1 106 . 12 1 1 A 14 14 VAL CB C 14 35.143 35.373 -0.230 1
1 109 . 12 1 1 A 14 14 VAL N N 14 125.476 122.973 2.503 1
1 110 . 12 1 1 A 15 15 VAL H H 15 8.403 8.911 -0.508 1
1 111 . 12 1 1 A 15 15 VAL HA H 15 5.532 5.272 0.260 1
1 119 . 12 1 1 A 15 15 VAL C C 15 175.078 174.428 0.650 1
1 120 . 12 1 1 A 15 15 VAL CA C 15 59.489 59.629 -0.140 1
1 121 . 12 1 1 A 15 15 VAL CB C 15 34.210 34.772 -0.562 1
1 124 . 12 1 1 A 15 15 VAL N N 15 126.189 127.889 -1.700 1
1 125 . 12 1 1 A 16 16 HIS H H 16 9.122 8.514 0.608 1
1 126 . 12 1 1 A 16 16 HIS HA H 16 5.823 5.804 0.019 1
1 131 . 12 1 1 A 16 16 HIS C C 16 172.998 172.466 0.532 1
1 132 . 12 1 1 A 16 16 HIS CA C 16 56.253 53.885 2.368 1
1 133 . 12 1 1 A 16 16 HIS CB C 16 34.273 32.972 1.301 1
1 136 . 12 1 1 A 16 16 HIS N N 16 121.152 120.805 0.347 1
1 137 . 12 1 1 A 17 17 TYR H H 17 8.465 8.749 -0.284 1
1 138 . 12 1 1 A 17 17 TYR HA H 17 5.096 4.769 0.327 1
1 145 . 12 1 1 A 17 17 TYR C C 17 173.640 172.262 1.378 1
1 146 . 12 1 1 A 17 17 TYR CA C 17 56.903 56.304 0.599 1
1 147 . 12 1 1 A 17 17 TYR CB C 17 40.103 40.563 -0.460 1
1 152 . 12 1 1 A 17 17 TYR N N 17 115.558 116.563 -1.005 1
1 153 . 12 1 1 A 18 18 SER H H 18 9.122 8.726 0.396 1
1 154 . 12 1 1 A 18 18 SER HA H 18 6.144 5.277 0.867 1
1 157 . 12 1 1 A 18 18 SER C C 18 173.204 175.226 -2.022 1
1 158 . 12 1 1 A 18 18 SER CA C 18 56.640 57.286 -0.646 1
1 159 . 12 1 1 A 18 18 SER CB C 18 68.788 65.467 3.321 1
1 160 . 12 1 1 A 18 18 SER N N 18 118.846 116.920 1.926 1
1 161 . 12 1 1 A 19 19 ASN H H 19 9.053 8.746 0.307 1
1 162 . 12 1 1 A 19 19 ASN HA H 19 4.473 5.070 -0.597 1
1 167 . 12 1 1 A 19 19 ASN C C 19 175.396 174.991 0.405 1
1 168 . 12 1 1 A 19 19 ASN CA C 19 55.373 52.148 3.225 1
1 169 . 12 1 1 A 19 19 ASN CB C 19 36.900 38.068 -1.168 1
1 170 . 12 1 1 A 19 19 ASN N N 19 113.712 118.445 -4.733 1
1 172 . 12 1 1 A 20 20 LYS H H 20 7.677 7.812 -0.135 1
1 173 . 12 1 1 A 20 20 LYS HA H 20 4.413 4.452 -0.039 1
1 182 . 12 1 1 A 20 20 LYS C C 20 176.078 177.504 -1.426 1
1 183 . 12 1 1 A 20 20 LYS CA C 20 55.679 56.936 -1.257 1
1 184 . 12 1 1 A 20 20 LYS CB C 20 33.023 35.064 -2.041 1
1 188 . 12 1 1 A 20 20 LYS N N 20 117.213 118.277 -1.064 1
1 189 . 12 1 1 A 21 21 ASP H H 21 7.395 7.917 -0.522 1
1 190 . 12 1 1 A 21 21 ASP HA H 21 4.808 4.783 0.025 1
1 193 . 12 1 1 A 21 21 ASP C C 21 176.413 176.090 0.323 1
1 194 . 12 1 1 A 21 21 ASP CA C 21 53.983 53.746 0.237 1
1 195 . 12 1 1 A 21 21 ASP CB C 21 41.199 42.704 -1.505 1
1 196 . 12 1 1 A 21 21 ASP N N 21 119.879 116.040 3.839 1
1 197 . 12 1 1 A 22 22 THR H H 22 8.593 8.145 0.448 1
1 198 . 12 1 1 A 22 22 THR HA H 22 4.352 4.207 0.145 1
1 203 . 12 1 1 A 22 22 THR C C 22 172.913 174.802 -1.889 1
1 204 . 12 1 1 A 22 22 THR CA C 22 62.691 62.993 -0.302 1
1 205 . 12 1 1 A 22 22 THR CB C 22 68.332 66.502 1.830 1
1 207 . 12 1 1 A 22 22 THR N N 22 116.299 112.870 3.429 1
1 208 . 12 1 1 A 23 23 LEU H H 23 7.645 7.883 -0.238 1
1 209 . 12 1 1 A 23 23 LEU HA H 23 4.318 4.363 -0.045 1
1 219 . 12 1 1 A 23 23 LEU C C 23 176.692 176.454 0.238 1
1 220 . 12 1 1 A 23 23 LEU CA C 23 54.617 53.909 0.708 1
1 221 . 12 1 1 A 23 23 LEU CB C 23 41.939 41.483 0.456 1
1 225 . 12 1 1 A 23 23 LEU N N 23 123.606 120.538 3.068 1
1 226 . 12 1 1 A 24 24 ARG H H 24 8.563 8.112 0.451 1
1 227 . 12 1 1 A 24 24 ARG HA H 24 4.373 4.542 -0.169 1
1 235 . 12 1 1 A 24 24 ARG C C 24 176.584 175.875 0.709 1
1 236 . 12 1 1 A 24 24 ARG CA C 24 57.854 56.451 1.403 1
1 237 . 12 1 1 A 24 24 ARG CB C 24 31.126 30.552 0.574 1
1 240 . 12 1 1 A 24 24 ARG N N 24 127.152 125.053 2.099 1
1 242 . 12 1 1 A 25 25 LYS H H 25 8.633 8.395 0.238 1
1 243 . 12 1 1 A 25 25 LYS HA H 25 4.513 4.850 -0.337 1
1 251 . 12 1 1 A 25 25 LYS C C 25 173.567 174.350 -0.783 1
1 252 . 12 1 1 A 25 25 LYS CA C 25 54.792 54.151 0.641 1
1 253 . 12 1 1 A 25 25 LYS CB C 25 37.416 35.086 2.330 1
1 257 . 12 1 1 A 25 25 LYS N N 25 122.682 120.100 2.582 1
1 258 . 12 1 1 A 26 26 ARG H H 26 8.303 8.862 -0.559 1
1 259 . 12 1 1 A 26 26 ARG HA H 26 5.153 4.992 0.161 1
1 266 . 12 1 1 A 26 26 ARG C C 26 174.554 175.307 -0.753 1
1 267 . 12 1 1 A 26 26 ARG CA C 26 55.083 54.664 0.419 1
1 268 . 12 1 1 A 26 26 ARG CB C 26 32.789 31.787 1.002 1
1 271 . 12 1 1 A 26 26 ARG N N 26 121.819 124.426 -2.607 1
1 272 . 12 1 1 A 27 27 HIS H H 27 8.793 9.063 -0.270 1
1 273 . 12 1 1 A 27 27 HIS HA H 27 5.155 5.514 -0.359 1
1 278 . 12 1 1 A 27 27 HIS CA C 27 56.904 54.811 2.093 1
1 279 . 12 1 1 A 27 27 HIS CB C 27 34.683 32.036 2.647 1
1 282 . 12 1 1 A 27 27 HIS N N 27 122.102 120.727 1.375 1
1 283 . 12 1 1 A 28 28 TYR H H 28 9.273 8.192 1.081 1
1 284 . 12 1 1 A 28 28 TYR HA H 28 4.332 4.330 0.002 1
1 291 . 12 1 1 A 28 28 TYR C C 28 174.730 175.047 -0.317 1
1 292 . 12 1 1 A 28 28 TYR CA C 28 58.680 56.674 2.006 1
1 293 . 12 1 1 A 28 28 TYR CB C 28 38.673 37.712 0.961 1
1 298 . 12 1 1 A 28 28 TYR N N 28 125.605 121.229 4.376 1
1 299 . 12 1 1 A 29 29 TRP H H 29 9.273 8.819 0.454 1
1 300 . 12 1 1 A 29 29 TRP HA H 29 5.543 4.813 0.730 1
1 309 . 12 1 1 A 29 29 TRP C C 29 176.172 176.793 -0.621 1
1 310 . 12 1 1 A 29 29 TRP CA C 29 56.658 57.408 -0.750 1
1 311 . 12 1 1 A 29 29 TRP CB C 29 32.154 30.427 1.727 1
1 317 . 12 1 1 A 29 29 TRP N N 29 131.340 128.073 3.267 1
1 318 . 12 1 1 A 30 30 ARG H H 30 9.164 9.052 0.112 1
1 319 . 12 1 1 A 30 30 ARG HA H 30 5.302 5.500 -0.198 1
1 327 . 12 1 1 A 30 30 ARG C C 30 174.774 174.433 0.341 1
1 328 . 12 1 1 A 30 30 ARG CA C 30 56.271 54.889 1.382 1
1 329 . 12 1 1 A 30 30 ARG CB C 30 34.203 33.558 0.645 1
1 332 . 12 1 1 A 30 30 ARG N N 30 116.040 121.464 -5.424 1
1 334 . 12 1 1 A 31 31 LEU H H 31 9.273 9.433 -0.160 1
1 335 . 12 1 1 A 31 31 LEU HA H 31 5.324 5.363 -0.039 1
1 345 . 12 1 1 A 31 31 LEU C C 31 174.488 174.526 -0.038 1
1 346 . 12 1 1 A 31 31 LEU CA C 31 53.807 53.526 0.281 1
1 347 . 12 1 1 A 31 31 LEU CB C 31 46.667 46.225 0.442 1
1 351 . 12 1 1 A 31 31 LEU N N 31 127.075 127.230 -0.155 1
1 352 . 12 1 1 A 32 32 ASP H H 32 8.854 8.507 0.347 1
1 353 . 12 1 1 A 32 32 ASP HA H 32 4.902 5.089 -0.187 1
1 356 . 12 1 1 A 32 32 ASP C C 32 173.474 175.165 -1.691 1
1 357 . 12 1 1 A 32 32 ASP CA C 32 53.104 52.819 0.285 1
1 358 . 12 1 1 A 32 32 ASP CB C 32 42.931 44.637 -1.706 1
1 359 . 12 1 1 A 32 32 ASP N N 32 129.349 123.804 5.545 1
1 360 . 12 1 1 A 33 33 CYS H H 33 8.153 8.660 -0.507 1
1 361 . 12 1 1 A 33 33 CYS HA H 33 4.323 4.552 -0.229 1
1 364 . 12 1 1 A 33 33 CYS C C 33 174.476 175.308 -0.832 1
1 365 . 12 1 1 A 33 33 CYS CA C 33 59.853 58.657 1.196 1
1 366 . 12 1 1 A 33 33 CYS CB C 33 27.508 28.416 -0.908 1
1 367 . 12 1 1 A 33 33 CYS N N 33 108.439 120.323 -11.884 1
1 368 . 12 1 1 A 34 34 LYS H H 34 9.144 7.762 1.382 1
1 369 . 12 1 1 A 34 34 LYS HA H 34 4.616 4.452 0.164 1
1 378 . 12 1 1 A 34 34 LYS C C 34 177.601 176.090 1.511 1
1 379 . 12 1 1 A 34 34 LYS CA C 34 57.185 56.853 0.332 1
1 380 . 12 1 1 A 34 34 LYS CB C 34 35.623 35.162 0.461 1
1 384 . 12 1 1 A 34 34 LYS N N 34 119.884 117.659 2.225 1
1 385 . 12 1 1 A 35 35 CYS H H 35 9.102 7.650 1.452 1
1 386 . 12 1 1 A 35 35 CYS HA H 35 4.935 4.763 0.172 1
1 389 . 12 1 1 A 35 35 CYS C C 35 172.283 172.471 -0.188 1
1 390 . 12 1 1 A 35 35 CYS CA C 35 57.748 58.142 -0.394 1
1 391 . 12 1 1 A 35 35 CYS CB C 35 31.537 32.240 -0.703 1
1 392 . 12 1 1 A 35 35 CYS N N 35 120.317 114.485 5.832 1
1 393 . 12 1 1 A 36 36 ILE H H 36 8.213 8.841 -0.628 1
1 394 . 12 1 1 A 36 36 ILE HA H 36 4.617 4.817 -0.200 1
1 404 . 12 1 1 A 36 36 ILE C C 36 175.312 175.181 0.131 1
1 405 . 12 1 1 A 36 36 ILE CA C 36 60.967 60.272 0.695 1
1 406 . 12 1 1 A 36 36 ILE CB C 36 39.718 38.637 1.081 1
1 410 . 12 1 1 A 36 36 ILE N N 36 121.905 121.820 0.085 1
1 411 . 12 1 1 A 37 37 THR H H 37 9.076 8.666 0.410 1
1 412 . 12 1 1 A 37 37 THR HA H 37 4.364 4.363 0.001 1
1 417 . 12 1 1 A 37 37 THR CA C 37 61.834 62.505 -0.671 1
1 418 . 12 1 1 A 37 37 THR CB C 37 69.237 69.901 -0.664 1
1 420 . 12 1 1 A 37 37 THR N N 37 122.500 123.546 -1.046 1
1 421 . 12 1 1 A 38 38 LEU H H 38 8.263 8.727 -0.464 1
1 422 . 12 1 1 A 38 38 LEU HA H 38 4.445 4.833 -0.388 1
1 432 . 12 1 1 A 38 38 LEU CA C 38 55.611 52.766 2.845 1
1 433 . 12 1 1 A 38 38 LEU CB C 38 42.702 43.760 -1.058 1
1 437 . 12 1 1 A 38 38 LEU N N 38 126.987 125.587 1.400 1
1 438 . 12 1 1 A 39 39 PHE H H 39 9.520 8.896 0.624 1
1 439 . 12 1 1 A 39 39 PHE HA H 39 4.998 5.109 -0.111 1
1 447 . 12 1 1 A 39 39 PHE CA C 39 57.331 56.175 1.156 1
1 448 . 12 1 1 A 39 39 PHE CB C 39 42.453 39.525 2.928 1
1 454 . 12 1 1 A 39 39 PHE N N 39 120.545 123.982 -3.437 1
1 455 . 12 1 1 A 40 40 GLN H H 40 9.878 8.758 1.120 1
1 456 . 12 1 1 A 40 40 GLN HA H 40 4.376 4.349 0.027 1
1 463 . 12 1 1 A 40 40 GLN CA C 40 59.513 58.689 0.824 1
1 464 . 12 1 1 A 40 40 GLN CB C 40 29.317 28.621 0.696 1
1 467 . 12 1 1 A 41 41 ASN H H 41 7.732 7.992 -0.260 1
1 468 . 12 1 1 A 41 41 ASN HA H 41 4.812 5.513 -0.701 1
1 473 . 12 1 1 A 41 41 ASN CA C 41 52.618 51.803 0.815 1
1 474 . 12 1 1 A 41 41 ASN CB C 41 39.362 42.641 -3.279 1
1 475 . 12 1 1 A 41 41 ASN N N 41 107.613 116.660 -9.047 1
1 477 . 12 1 1 A 42 42 ASN HA H 42 3.476 4.319 -0.843 1
1 482 . 12 1 1 A 42 42 ASN C C 42 173.607 176.248 -2.641 1
1 483 . 12 1 1 A 42 42 ASN CA C 42 54.888 53.909 0.979 1
1 484 . 12 1 1 A 42 42 ASN CB C 42 35.613 38.569 -2.956 1
1 486 . 12 1 1 A 43 43 THR H H 43 8.394 7.579 0.815 1
1 487 . 12 1 1 A 43 43 THR HA H 43 4.403 4.584 -0.181 1
1 492 . 12 1 1 A 43 43 THR C C 43 174.464 174.660 -0.196 1
1 493 . 12 1 1 A 43 43 THR CA C 43 61.978 61.684 0.294 1
1 494 . 12 1 1 A 43 43 THR CB C 43 70.036 70.698 -0.662 1
1 496 . 12 1 1 A 43 43 THR N N 43 111.795 106.567 5.228 1
1 497 . 12 1 1 A 44 44 THR H H 44 8.058 7.646 0.412 1
1 498 . 12 1 1 A 44 44 THR HA H 44 4.464 4.274 0.190 1
1 503 . 12 1 1 A 44 44 THR CA C 44 61.599 62.643 -1.044 1
1 504 . 12 1 1 A 44 44 THR CB C 44 69.137 69.315 -0.178 1
1 506 . 12 1 1 A 44 44 THR N N 44 116.514 117.304 -0.790 1
1 507 . 12 1 1 A 45 45 ASN H H 45 6.653 9.114 -2.461 1
1 508 . 12 1 1 A 45 45 ASN HA H 45 4.945 4.535 0.410 1
1 513 . 12 1 1 A 45 45 ASN CA C 45 53.227 56.217 -2.990 1
1 514 . 12 1 1 A 45 45 ASN CB C 45 38.483 37.920 0.563 1
1 516 . 12 1 1 A 46 46 ARG H H 46 8.213 7.805 0.408 1
1 517 . 12 1 1 A 46 46 ARG HA H 46 4.583 4.974 -0.391 1
1 524 . 12 1 1 A 46 46 ARG CA C 46 55.487 54.245 1.242 1
1 525 . 12 1 1 A 46 46 ARG CB C 46 31.153 31.767 -0.614 1
1 528 . 12 1 1 A 46 46 ARG N N 46 121.652 116.510 5.142 1
1 529 . 12 1 1 A 47 47 TYR H H 47 7.973 8.743 -0.770 1
1 536 . 12 1 1 A 47 47 TYR CB C 47 39.356 40.814 -1.458 1
1 541 . 12 1 1 A 48 48 TYR H H 48 9.023 9.151 -0.128 1
1 542 . 12 1 1 A 48 48 TYR HA H 48 4.662 4.393 0.269 1
1 549 . 12 1 1 A 48 48 TYR CB C 48 39.863 40.433 -0.570 1
1 554 . 12 1 1 A 48 48 TYR N N 48 121.223 121.321 -0.098 1
1 555 . 12 1 1 A 49 49 LYS H H 49 7.134 7.511 -0.377 1
1 556 . 12 1 1 A 49 49 LYS HA H 49 4.283 4.724 -0.441 1
1 565 . 12 1 1 A 49 49 LYS CA C 49 55.167 55.104 0.063 1
1 566 . 12 1 1 A 49 49 LYS CB C 49 36.699 35.484 1.215 1
1 570 . 12 1 1 A 49 49 LYS N N 49 117.339 114.755 2.584 1
1 571 . 12 1 1 A 50 50 GLU H H 50 8.411 8.617 -0.206 1
1 572 . 12 1 1 A 50 50 GLU HA H 50 4.583 4.948 -0.365 1
1 577 . 12 1 1 A 50 50 GLU CA C 50 54.592 54.823 -0.231 1
1 578 . 12 1 1 A 50 50 GLU CB C 50 33.263 33.512 -0.249 1
1 580 . 12 1 1 A 50 50 GLU N N 50 123.825 119.310 4.515 1
1 581 . 12 1 1 A 51 51 ILE H H 51 9.225 9.106 0.119 1
1 582 . 12 1 1 A 51 51 ILE HA H 51 4.277 4.633 -0.356 1
1 592 . 12 1 1 A 51 51 ILE CA C 51 58.182 58.165 0.017 1
1 593 . 12 1 1 A 51 51 ILE CB C 51 39.663 38.420 1.243 1
1 597 . 12 1 1 A 51 51 ILE N N 51 125.271 126.760 -1.489 1
1 598 . 12 1 1 A 52 52 PRO HA H 52 4.543 4.606 -0.063 1
1 605 . 12 1 1 A 52 52 PRO C C 52 178.340 178.035 0.305 1
1 606 . 12 1 1 A 52 52 PRO CA C 52 62.726 62.882 -0.156 1
1 607 . 12 1 1 A 52 52 PRO CB C 52 32.003 31.720 0.283 1
1 610 . 12 1 1 A 53 53 LEU H H 53 8.723 8.512 0.211 1
1 611 . 12 1 1 A 53 53 LEU HA H 53 3.891 3.894 -0.003 1
1 621 . 12 1 1 A 53 53 LEU C C 53 179.673 178.960 0.713 1
1 622 . 12 1 1 A 53 53 LEU CA C 53 58.205 57.561 0.644 1
1 623 . 12 1 1 A 53 53 LEU CB C 53 40.171 41.460 -1.289 1
1 627 . 12 1 1 A 53 53 LEU N N 53 125.150 124.358 0.792 1
1 628 . 12 1 1 A 54 54 SER H H 54 8.360 8.094 0.266 1
1 629 . 12 1 1 A 54 54 SER HA H 54 4.164 4.142 0.022 1
1 632 . 12 1 1 A 54 54 SER C C 54 175.517 177.325 -1.808 1
1 633 . 12 1 1 A 54 54 SER CA C 54 60.193 61.336 -1.143 1
1 634 . 12 1 1 A 54 54 SER CB C 54 62.617 62.825 -0.208 1
1 635 . 12 1 1 A 54 54 SER N N 54 111.266 114.534 -3.268 1
1 636 . 12 1 1 A 55 55 GLU H H 55 7.666 8.130 -0.464 1
1 637 . 12 1 1 A 55 55 GLU HA H 55 4.363 4.150 0.213 1
1 642 . 12 1 1 A 55 55 GLU C C 55 176.753 177.801 -1.048 1
1 643 . 12 1 1 A 55 55 GLU CA C 55 56.200 58.990 -2.790 1
1 644 . 12 1 1 A 55 55 GLU CB C 55 30.526 29.181 1.345 1
1 646 . 12 1 1 A 55 55 GLU N N 55 119.485 119.466 0.019 1
1 647 . 12 1 1 A 56 56 ILE H H 56 7.601 7.184 0.417 1
1 648 . 12 1 1 A 56 56 ILE HA H 56 3.793 3.955 -0.162 1
1 658 . 12 1 1 A 56 56 ILE C C 56 175.142 176.012 -0.870 1
1 659 . 12 1 1 A 56 56 ILE CA C 56 63.518 62.395 1.123 1
1 660 . 12 1 1 A 56 56 ILE CB C 56 37.169 37.977 -0.808 1
1 664 . 12 1 1 A 56 56 ILE N N 56 120.430 120.097 0.333 1
1 665 . 12 1 1 A 57 57 LEU H H 57 9.263 9.246 0.017 1
1 666 . 12 1 1 A 57 57 LEU HA H 57 4.343 4.394 -0.051 1
1 676 . 12 1 1 A 57 57 LEU C C 57 177.898 176.538 1.360 1
1 677 . 12 1 1 A 57 57 LEU CA C 57 56.569 55.957 0.612 1
1 678 . 12 1 1 A 57 57 LEU CB C 57 41.980 42.640 -0.660 1
1 682 . 12 1 1 A 57 57 LEU N N 57 129.464 128.949 0.515 1
1 683 . 12 1 1 A 58 58 THR H H 58 7.414 7.322 0.092 1
1 684 . 12 1 1 A 58 58 THR HA H 58 4.512 4.843 -0.331 1
1 689 . 12 1 1 A 58 58 THR C C 58 171.314 172.720 -1.406 1
1 690 . 12 1 1 A 58 58 THR CA C 58 60.562 61.233 -0.671 1
1 691 . 12 1 1 A 58 58 THR CB C 58 70.803 73.387 -2.584 1
1 693 . 12 1 1 A 58 58 THR N N 58 109.129 110.715 -1.586 1
1 694 . 12 1 1 A 59 59 VAL H H 59 8.152 8.507 -0.355 1
1 695 . 12 1 1 A 59 59 VAL HA H 59 5.061 5.083 -0.022 1
1 703 . 12 1 1 A 59 59 VAL C C 59 174.985 174.993 -0.008 1
1 704 . 12 1 1 A 59 59 VAL CA C 59 61.354 61.140 0.214 1
1 705 . 12 1 1 A 59 59 VAL CB C 59 33.855 33.861 -0.006 1
1 708 . 12 1 1 A 59 59 VAL N N 59 123.676 124.697 -1.021 1
1 709 . 12 1 1 A 60 60 GLU H H 60 9.074 8.703 0.371 1
1 710 . 12 1 1 A 60 60 GLU HA H 60 4.977 4.852 0.125 1
1 715 . 12 1 1 A 60 60 GLU C C 60 176.063 175.392 0.671 1
1 716 . 12 1 1 A 60 60 GLU CA C 60 53.807 54.260 -0.453 1
1 717 . 12 1 1 A 60 60 GLU CB C 60 33.739 33.715 0.024 1
1 719 . 12 1 1 A 60 60 GLU N N 60 125.125 126.042 -0.917 1
1 720 . 12 1 1 A 61 61 SER H H 61 8.763 8.531 0.232 1
1 721 . 12 1 1 A 61 61 SER HA H 61 4.452 5.092 -0.640 1
1 724 . 12 1 1 A 61 61 SER C C 61 173.288 174.536 -1.248 1
1 725 . 12 1 1 A 61 61 SER CA C 61 59.384 56.722 2.662 1
1 726 . 12 1 1 A 61 61 SER CB C 61 63.390 65.149 -1.759 1
1 727 . 12 1 1 A 61 61 SER N N 61 117.523 114.669 2.854 1
1 728 . 12 1 1 A 62 62 ALA H H 62 7.293 9.044 -1.751 1
1 729 . 12 1 1 A 62 62 ALA HA H 62 3.817 4.469 -0.652 1
1 733 . 12 1 1 A 62 62 ALA C C 62 176.717 178.022 -1.305 1
1 734 . 12 1 1 A 62 62 ALA CA C 62 53.966 53.078 0.888 1
1 735 . 12 1 1 A 62 62 ALA CB C 62 18.640 18.854 -0.214 1
1 736 . 12 1 1 A 62 62 ALA N N 62 122.650 125.949 -3.299 1
1 737 . 12 1 1 A 63 63 GLN H H 63 8.736 8.266 0.470 1
1 738 . 12 1 1 A 63 63 GLN HA H 63 4.445 4.657 -0.212 1
1 745 . 12 1 1 A 63 63 GLN C C 63 173.700 174.695 -0.995 1
1 746 . 12 1 1 A 63 63 GLN CA C 63 56.376 55.617 0.759 1
1 747 . 12 1 1 A 63 63 GLN CB C 63 31.515 30.969 0.546 1
1 749 . 12 1 1 A 63 63 GLN N N 63 120.251 119.320 0.931 1
1 751 . 12 1 1 A 64 64 ASN H H 64 9.272 7.113 2.159 1
1 752 . 12 1 1 A 64 64 ASN HA H 64 4.906 5.112 -0.206 1
1 757 . 12 1 1 A 64 64 ASN C C 64 174.754 174.905 -0.151 1
1 758 . 12 1 1 A 64 64 ASN CA C 64 51.837 51.940 -0.103 1
1 759 . 12 1 1 A 64 64 ASN CB C 64 38.156 40.875 -2.719 1
1 760 . 12 1 1 A 64 64 ASN N N 64 122.346 118.511 3.835 1
1 762 . 12 1 1 A 65 65 PHE H H 65 8.854 9.059 -0.205 1
1 763 . 12 1 1 A 65 65 PHE HA H 65 4.947 5.055 -0.108 1
1 771 . 12 1 1 A 65 65 PHE C C 65 177.274 176.197 1.077 1
1 772 . 12 1 1 A 65 65 PHE CA C 65 57.519 57.309 0.210 1
1 773 . 12 1 1 A 65 65 PHE CB C 65 38.485 38.799 -0.314 1
1 779 . 12 1 1 A 65 65 PHE N N 65 123.638 125.402 -1.764 1
1 780 . 12 1 1 A 66 66 SER H H 66 8.163 8.092 0.071 1
1 781 . 12 1 1 A 66 66 SER HA H 66 4.393 4.763 -0.370 1
1 784 . 12 1 1 A 66 66 SER C C 66 175.699 174.518 1.181 1
1 785 . 12 1 1 A 66 66 SER CA C 66 60.791 58.120 2.671 1
1 786 . 12 1 1 A 66 66 SER CB C 66 64.591 63.126 1.465 1
1 787 . 12 1 1 A 66 66 SER N N 66 113.913 116.386 -2.473 1
1 788 . 12 1 1 A 67 67 LEU H H 67 8.574 7.696 0.878 1
1 789 . 12 1 1 A 67 67 LEU HA H 67 4.302 4.400 -0.098 1
1 799 . 12 1 1 A 67 67 LEU C C 67 176.269 176.506 -0.237 1
1 800 . 12 1 1 A 67 67 LEU CA C 67 55.601 55.779 -0.178 1
1 801 . 12 1 1 A 67 67 LEU CB C 67 42.021 43.755 -1.734 1
1 805 . 12 1 1 A 67 67 LEU N N 67 121.264 119.645 1.619 1
1 806 . 12 1 1 A 68 68 VAL H H 68 6.921 7.598 -0.677 1
1 807 . 12 1 1 A 68 68 VAL HA H 68 4.473 4.141 0.332 1
1 815 . 12 1 1 A 68 68 VAL C C 68 173.809 174.978 -1.169 1
1 816 . 12 1 1 A 68 68 VAL CA C 68 58.047 60.478 -2.431 1
1 817 . 12 1 1 A 68 68 VAL CB C 68 32.295 32.182 0.113 1
1 820 . 12 1 1 A 68 68 VAL N N 68 111.287 115.895 -4.608 1
1 821 . 12 1 1 A 69 69 PRO HA H 69 4.658 4.618 0.040 1
1 828 . 12 1 1 A 69 69 PRO CA C 69 61.747 61.663 0.084 1
1 829 . 12 1 1 A 69 69 PRO CB C 69 30.693 32.478 -1.785 1
1 832 . 12 1 1 A 70 70 PRO HA H 70 4.414 4.377 0.037 1
1 839 . 12 1 1 A 70 70 PRO CA C 70 63.997 64.520 -0.523 1
1 840 . 12 1 1 A 70 70 PRO CB C 70 31.602 31.744 -0.142 1
1 843 . 12 1 1 A 71 71 GLY H H 71 8.824 8.480 0.344 1
1 844 . 12 1 1 A 71 71 GLY HA2 H 71 3.703 3.930 -0.227 1
1 845 . 12 1 1 A 71 71 GLY HA3 H 71 4.193 3.931 0.262 1
1 846 . 12 1 1 A 71 71 GLY C C 71 174.052 173.996 0.056 1
1 847 . 12 1 1 A 71 71 GLY CA C 71 45.065 45.478 -0.413 1
1 848 . 12 1 1 A 71 71 GLY N N 71 111.845 106.326 5.519 1
1 849 . 12 1 1 A 72 72 THR H H 72 7.597 7.271 0.326 1
1 850 . 12 1 1 A 72 72 THR HA H 72 4.133 4.255 -0.122 1
1 855 . 12 1 1 A 72 72 THR CA C 72 63.129 62.386 0.743 1
1 856 . 12 1 1 A 72 72 THR CB C 72 69.560 69.371 0.189 1
1 858 . 12 1 1 A 72 72 THR N N 72 117.485 115.194 2.291 1
1 859 . 12 1 1 A 73 73 ASN H H 73 9.280 8.555 0.725 1
1 860 . 12 1 1 A 73 73 ASN HA H 73 4.786 4.574 0.212 1
1 865 . 12 1 1 A 73 73 ASN CA C 73 52.009 52.281 -0.272 1
1 866 . 12 1 1 A 73 73 ASN CB C 73 37.553 38.168 -0.615 1
1 867 . 12 1 1 A 73 73 ASN N N 73 127.641 125.759 1.882 1
1 869 . 12 1 1 A 74 74 PRO HA H 74 4.752 4.796 -0.044 1
1 876 . 12 1 1 A 74 74 PRO C C 74 175.190 176.381 -1.191 1
1 877 . 12 1 1 A 74 74 PRO CA C 74 63.395 62.456 0.939 1
1 878 . 12 1 1 A 74 74 PRO CB C 74 33.164 32.829 0.335 1
1 881 . 12 1 1 A 75 75 HIS H H 75 8.025 8.954 -0.929 1
1 882 . 12 1 1 A 75 75 HIS HA H 75 5.047 5.107 -0.060 1
1 887 . 12 1 1 A 75 75 HIS C C 75 172.562 175.550 -2.988 1
1 888 . 12 1 1 A 75 75 HIS CA C 75 54.336 53.529 0.807 1
1 889 . 12 1 1 A 75 75 HIS CB C 75 30.956 33.475 -2.519 1
1 892 . 12 1 1 A 75 75 HIS N N 75 116.198 116.797 -0.599 1
1 893 . 12 1 1 A 76 76 CYS H H 76 8.343 9.470 -1.127 1
1 894 . 12 1 1 A 76 76 CYS HA H 76 4.594 4.458 0.136 1
1 897 . 12 1 1 A 76 76 CYS C C 76 175.651 174.811 0.840 1
1 898 . 12 1 1 A 76 76 CYS CA C 76 61.066 61.211 -0.145 1
1 899 . 12 1 1 A 76 76 CYS CB C 76 30.193 28.413 1.780 1
1 900 . 12 1 1 A 76 76 CYS N N 76 113.289 118.089 -4.800 1
1 901 . 12 1 1 A 77 77 PHE H H 77 8.433 8.177 0.256 1
1 902 . 12 1 1 A 77 77 PHE HA H 77 5.105 5.445 -0.340 1
1 910 . 12 1 1 A 77 77 PHE C C 77 171.822 173.118 -1.296 1
1 911 . 12 1 1 A 77 77 PHE CA C 77 56.874 55.593 1.281 1
1 912 . 12 1 1 A 77 77 PHE CB C 77 39.393 43.121 -3.728 1
1 918 . 12 1 1 A 77 77 PHE N N 77 114.874 114.847 0.027 1
1 919 . 12 1 1 A 78 78 GLU H H 78 9.823 9.122 0.701 1
1 920 . 12 1 1 A 78 78 GLU HA H 78 5.333 5.221 0.112 1
1 925 . 12 1 1 A 78 78 GLU C C 78 175.602 175.534 0.068 1
1 926 . 12 1 1 A 78 78 GLU CA C 78 54.212 54.802 -0.590 1
1 927 . 12 1 1 A 78 78 GLU CB C 78 31.702 32.585 -0.883 1
1 929 . 12 1 1 A 78 78 GLU N N 78 121.074 118.820 2.254 1
1 930 . 12 1 1 A 79 79 ILE H H 79 9.093 9.015 0.078 1
1 931 . 12 1 1 A 79 79 ILE HA H 79 4.637 4.596 0.041 1
1 941 . 12 1 1 A 79 79 ILE C C 79 174.476 175.240 -0.764 1
1 942 . 12 1 1 A 79 79 ILE CA C 79 60.932 60.719 0.213 1
1 943 . 12 1 1 A 79 79 ILE CB C 79 40.803 37.453 3.350 1
1 947 . 12 1 1 A 79 79 ILE N N 79 121.382 125.104 -3.722 1
1 948 . 12 1 1 A 80 80 VAL H H 80 8.841 7.970 0.871 1
1 949 . 12 1 1 A 80 80 VAL HA H 80 4.425 3.831 0.594 1
1 957 . 12 1 1 A 80 80 VAL C C 80 175.930 175.365 0.565 1
1 958 . 12 1 1 A 80 80 VAL CA C 80 63.324 63.191 0.133 1
1 959 . 12 1 1 A 80 80 VAL CB C 80 32.783 31.191 1.592 1
1 962 . 12 1 1 A 80 80 VAL N N 80 128.970 127.628 1.342 1
1 963 . 12 1 1 A 81 81 THR H H 81 8.303 7.977 0.326 1
1 964 . 12 1 1 A 81 81 THR HA H 81 5.264 4.686 0.578 1
1 969 . 12 1 1 A 81 81 THR C C 81 173.664 174.808 -1.144 1
1 970 . 12 1 1 A 81 81 THR CA C 81 59.540 59.866 -0.326 1
1 971 . 12 1 1 A 81 81 THR CB C 81 72.197 71.816 0.381 1
1 973 . 12 1 1 A 81 81 THR N N 81 118.077 118.399 -0.322 1
1 974 . 12 1 1 A 82 82 ALA H H 82 9.586 8.638 0.948 1
1 975 . 12 1 1 A 82 82 ALA HA H 82 4.093 4.296 -0.203 1
1 979 . 12 1 1 A 82 82 ALA C C 82 178.667 177.827 0.840 1
1 980 . 12 1 1 A 82 82 ALA CA C 82 55.321 53.175 2.146 1
1 981 . 12 1 1 A 82 82 ALA CB C 82 18.094 18.613 -0.519 1
1 982 . 12 1 1 A 82 82 ALA N N 82 122.493 123.867 -1.374 1
1 983 . 12 1 1 A 83 83 ASN H H 83 7.923 8.332 -0.409 1
1 984 . 12 1 1 A 83 83 ASN HA H 83 4.808 5.040 -0.232 1
1 989 . 12 1 1 A 83 83 ASN C C 83 174.766 174.720 0.046 1
1 990 . 12 1 1 A 83 83 ASN CA C 83 53.333 54.759 -1.426 1
1 991 . 12 1 1 A 83 83 ASN CB C 83 40.335 41.495 -1.160 1
1 992 . 12 1 1 A 83 83 ASN N N 83 110.765 115.477 -4.712 1
1 994 . 12 1 1 A 84 84 ALA H H 84 7.352 7.141 0.211 1
1 995 . 12 1 1 A 84 84 ALA HA H 84 4.625 4.462 0.163 1
1 999 . 12 1 1 A 84 84 ALA C C 84 176.547 174.875 1.672 1
1 1000 . 12 1 1 A 84 84 ALA CA C 84 52.858 51.769 1.089 1
1 1001 . 12 1 1 A 84 84 ALA CB C 84 21.233 21.723 -0.490 1
1 1002 . 12 1 1 A 84 84 ALA N N 84 119.599 117.480 2.119 1
1 1003 . 12 1 1 A 85 85 THR H H 85 8.374 8.752 -0.378 1
1 1004 . 12 1 1 A 85 85 THR HA H 85 5.014 4.580 0.434 1
1 1009 . 12 1 1 A 85 85 THR C C 85 171.568 174.016 -2.448 1
1 1010 . 12 1 1 A 85 85 THR CA C 85 61.618 61.950 -0.332 1
1 1011 . 12 1 1 A 85 85 THR CB C 85 70.850 69.390 1.460 1
1 1013 . 12 1 1 A 85 85 THR N N 85 119.032 113.472 5.560 1
1 1014 . 12 1 1 A 86 86 TYR H H 86 9.006 8.973 0.033 1
1 1015 . 12 1 1 A 86 86 TYR HA H 86 4.658 5.008 -0.350 1
1 1022 . 12 1 1 A 86 86 TYR C C 86 173.773 175.578 -1.805 1
1 1023 . 12 1 1 A 86 86 TYR CA C 86 56.938 57.936 -0.998 1
1 1024 . 12 1 1 A 86 86 TYR CB C 86 39.513 40.106 -0.593 1
1 1029 . 12 1 1 A 86 86 TYR N N 86 123.494 127.104 -3.610 1
1 1030 . 12 1 1 A 87 87 PHE H H 87 9.263 9.030 0.233 1
1 1031 . 12 1 1 A 87 87 PHE HA H 87 4.127 4.878 -0.751 1
1 1039 . 12 1 1 A 87 87 PHE C C 87 176.369 174.225 2.144 1
1 1040 . 12 1 1 A 87 87 PHE CA C 87 57.238 55.963 1.275 1
1 1041 . 12 1 1 A 87 87 PHE CB C 87 37.086 38.983 -1.897 1
1 1047 . 12 1 1 A 87 87 PHE N N 87 125.384 119.770 5.614 1
1 1048 . 12 1 1 A 88 88 VAL H H 88 9.023 8.542 0.481 1
1 1049 . 12 1 1 A 88 88 VAL HA H 88 4.162 4.544 -0.382 1
1 1057 . 12 1 1 A 88 88 VAL C C 88 176.390 175.637 0.753 1
1 1058 . 12 1 1 A 88 88 VAL CA C 88 63.975 60.544 3.431 1
1 1059 . 12 1 1 A 88 88 VAL CB C 88 32.378 32.153 0.225 1
1 1062 . 12 1 1 A 88 88 VAL N N 88 127.348 124.597 2.751 1
1 1063 . 12 1 1 A 89 89 GLY H H 89 9.233 7.930 1.303 1
1 1064 . 12 1 1 A 89 89 GLY HA2 H 89 4.293 4.198 0.095 1
1 1065 . 12 1 1 A 89 89 GLY HA3 H 89 4.186 4.267 -0.081 1
1 1066 . 12 1 1 A 89 89 GLY C C 89 172.378 171.533 0.845 1
1 1067 . 12 1 1 A 89 89 GLY CA C 89 43.798 46.094 -2.296 1
1 1068 . 12 1 1 A 89 89 GLY N N 89 116.041 112.615 3.426 1
1 1069 . 12 1 1 A 90 90 GLU H H 90 8.532 8.020 0.512 1
1 1070 . 12 1 1 A 90 90 GLU HA H 90 4.794 4.920 -0.126 1
1 1075 . 12 1 1 A 90 90 GLU C C 90 174.221 174.789 -0.568 1
1 1076 . 12 1 1 A 90 90 GLU CA C 90 56.393 54.897 1.496 1
1 1077 . 12 1 1 A 90 90 GLU CB C 90 33.182 33.639 -0.457 1
1 1079 . 12 1 1 A 90 90 GLU N N 90 120.905 119.380 1.525 1
1 1080 . 12 1 1 A 91 91 MET H H 91 8.450 8.698 -0.248 1
1 1081 . 12 1 1 A 91 91 MET HA H 91 4.904 5.099 -0.195 1
1 1089 . 12 1 1 A 91 91 MET C C 91 173.373 174.079 -0.706 1
1 1090 . 12 1 1 A 91 91 MET CA C 91 52.277 53.269 -0.992 1
1 1091 . 12 1 1 A 91 91 MET CB C 91 32.789 34.150 -1.361 1
1 1094 . 12 1 1 A 91 91 MET N N 91 125.173 122.759 2.414 1
1 1095 . 12 1 1 A 92 92 PRO HA H 92 4.358 4.364 -0.006 1
1 1102 . 12 1 1 A 92 92 PRO C C 92 177.589 176.936 0.653 1
1 1103 . 12 1 1 A 92 92 PRO CA C 92 63.143 63.589 -0.446 1
1 1104 . 12 1 1 A 92 92 PRO CB C 92 32.083 31.555 0.528 1
1 1107 . 12 1 1 A 93 93 GLY H H 93 8.330 8.166 0.164 1
1 1108 . 12 1 1 A 93 93 GLY HA2 H 93 3.943 4.084 -0.141 1
1 1109 . 12 1 1 A 93 93 GLY HA3 H 93 4.045 4.085 -0.040 1
1 1110 . 12 1 1 A 93 93 GLY C C 93 174.730 173.679 1.051 1
1 1111 . 12 1 1 A 93 93 GLY CA C 93 45.276 45.240 0.036 1
1 1112 . 12 1 1 A 93 93 GLY N N 93 109.420 110.387 -0.967 1
1 1113 . 12 1 1 A 94 94 GLY H H 94 8.331 7.909 0.422 1
1 1114 . 12 1 1 A 94 94 GLY HA2 H 94 3.973 4.062 -0.089 1
1 1115 . 12 1 1 A 94 94 GLY HA3 H 94 3.973 4.063 -0.090 1
1 1116 . 12 1 1 A 94 94 GLY C C 94 174.100 172.400 1.700 1
1 1117 . 12 1 1 A 94 94 GLY CA C 94 45.333 45.410 -0.077 1
1 1118 . 12 1 1 A 94 94 GLY N N 94 108.483 107.943 0.540 1
1 1119 . 12 1 1 A 95 95 THR H H 95 8.095 8.778 -0.683 1
1 1120 . 12 1 1 A 95 95 THR HA H 95 4.643 5.175 -0.532 1
1 1125 . 12 1 1 A 95 95 THR C C 95 173.155 171.854 1.301 1
1 1126 . 12 1 1 A 95 95 THR CA C 95 59.922 58.178 1.744 1
1 1127 . 12 1 1 A 95 95 THR CB C 95 69.871 70.516 -0.645 1
1 1129 . 12 1 1 A 95 95 THR N N 95 115.860 110.725 5.135 1
1 1130 . 12 1 1 A 96 96 PRO HA H 96 4.400 4.661 -0.261 1
1 1137 . 12 1 1 A 96 96 PRO C C 96 177.565 176.246 1.319 1
1 1138 . 12 1 1 A 96 96 PRO CA C 96 64.047 62.253 1.794 1
1 1139 . 12 1 1 A 96 96 PRO CB C 96 31.816 29.734 2.082 1
1 1142 . 12 1 1 A 97 97 GLY H H 97 8.572 7.941 0.631 1
1 1143 . 12 1 1 A 97 97 GLY HA2 H 97 4.007 4.070 -0.063 1
1 1144 . 12 1 1 A 97 97 GLY HA3 H 97 4.007 4.070 -0.063 1
1 1145 . 12 1 1 A 97 97 GLY C C 97 174.609 174.524 0.085 1
1 1146 . 12 1 1 A 97 97 GLY CA C 97 45.276 45.851 -0.575 1
1 1147 . 12 1 1 A 97 97 GLY N N 97 110.233 108.434 1.799 1
1 1148 . 12 1 1 A 98 98 GLY H H 98 8.119 7.412 0.707 1
1 1149 . 12 1 1 A 98 98 GLY HA2 H 98 4.086 4.254 -0.168 1
1 1150 . 12 1 1 A 98 98 GLY HA3 H 98 4.200 4.254 -0.054 1
1 1151 . 12 1 1 A 98 98 GLY CA C 98 44.876 45.557 -0.681 1
1 1152 . 12 1 1 A 98 98 GLY N N 98 108.845 104.125 4.720 1
1 1153 . 12 1 1 A 99 99 PRO HA H 99 4.494 4.656 -0.162 1
1 1160 . 12 1 1 A 99 99 PRO C C 99 177.468 176.484 0.984 1
1 1161 . 12 1 1 A 99 99 PRO CA C 99 63.500 62.660 0.840 1
1 1162 . 12 1 1 A 99 99 PRO CB C 99 32.013 32.876 -0.863 1
1 1165 . 12 1 1 A 100 100 SER H H 100 8.472 8.482 -0.010 1
1 1166 . 12 1 1 A 100 100 SER HA H 100 4.513 5.161 -0.648 1
1 1169 . 12 1 1 A 100 100 SER C C 100 175.408 173.430 1.978 1
1 1170 . 12 1 1 A 100 100 SER CA C 100 58.557 56.170 2.387 1
1 1171 . 12 1 1 A 100 100 SER CB C 100 63.918 65.900 -1.982 1
1 1172 . 12 1 1 A 100 100 SER N N 100 116.038 113.159 2.879 1
1 1173 . 12 1 1 A 101 101 GLY H H 101 8.427 8.586 -0.159 1
1 1174 . 12 1 1 A 101 101 GLY HA2 H 101 4.064 4.217 -0.153 1
1 1175 . 12 1 1 A 101 101 GLY HA3 H 101 4.064 4.219 -0.155 1
1 1176 . 12 1 1 A 101 101 GLY C C 101 174.730 173.125 1.605 1
1 1177 . 12 1 1 A 101 101 GLY CA C 101 45.575 44.555 1.020 1
1 1178 . 12 1 1 A 101 101 GLY N N 101 110.558 108.127 2.431 1
1 1179 . 12 1 1 A 102 102 GLN H H 102 8.416 8.467 -0.051 1
1 1180 . 12 1 1 A 102 102 GLN HA H 102 4.383 4.475 -0.092 1
1 1187 . 12 1 1 A 102 102 GLN C C 102 177.346 175.936 1.410 1
1 1188 . 12 1 1 A 102 102 GLN CA C 102 57.080 55.351 1.729 1
1 1189 . 12 1 1 A 102 102 GLN CB C 102 29.235 27.198 2.037 1
1 1191 . 12 1 1 A 102 102 GLN N N 102 120.112 120.840 -0.728 1
1 1193 . 12 1 1 A 103 103 GLY H H 103 8.713 8.444 0.269 1
1 1194 . 12 1 1 A 103 103 GLY HA2 H 103 4.193 4.217 -0.024 1
1 1195 . 12 1 1 A 103 103 GLY HA3 H 103 4.078 4.235 -0.157 1
1 1196 . 12 1 1 A 103 103 GLY C C 103 175.602 174.540 1.062 1
1 1197 . 12 1 1 A 103 103 GLY CA C 103 46.120 45.840 0.280 1
1 1198 . 12 1 1 A 103 103 GLY N N 103 109.817 111.185 -1.368 1
1 1199 . 12 1 1 A 104 104 ALA H H 104 8.366 7.783 0.583 1
1 1200 . 12 1 1 A 104 104 ALA HA H 104 4.449 4.663 -0.214 1
1 1204 . 12 1 1 A 104 104 ALA C C 104 179.188 178.329 0.859 1
1 1205 . 12 1 1 A 104 104 ALA CA C 104 54.230 53.092 1.138 1
1 1206 . 12 1 1 A 104 104 ALA CB C 104 19.080 20.390 -1.310 1
1 1207 . 12 1 1 A 104 104 ALA N N 104 124.808 121.047 3.761 1
1 1208 . 12 1 1 A 105 105 GLU H H 105 8.576 8.805 -0.229 1
1 1209 . 12 1 1 A 105 105 GLU HA H 105 4.161 4.110 0.051 1
1 1214 . 12 1 1 A 105 105 GLU C C 105 179.200 179.118 0.082 1
1 1215 . 12 1 1 A 105 105 GLU CA C 105 59.173 59.092 0.081 1
1 1216 . 12 1 1 A 105 105 GLU CB C 105 29.194 29.276 -0.082 1
1 1218 . 12 1 1 A 105 105 GLU N N 105 119.238 118.977 0.261 1
1 1219 . 12 1 1 A 106 106 ALA H H 106 8.381 8.177 0.204 1
1 1220 . 12 1 1 A 106 106 ALA HA H 106 4.283 4.115 0.168 1
1 1224 . 12 1 1 A 106 106 ALA C C 106 180.048 179.843 0.205 1
1 1225 . 12 1 1 A 106 106 ALA CA C 106 54.687 55.148 -0.461 1
1 1226 . 12 1 1 A 106 106 ALA CB C 106 18.341 18.846 -0.505 1
1 1227 . 12 1 1 A 106 106 ALA N N 106 123.327 123.287 0.040 1
1 1228 . 12 1 1 A 107 107 ALA H H 107 8.123 8.210 -0.087 1
1 1229 . 12 1 1 A 107 107 ALA HA H 107 4.554 4.317 0.237 1
1 1233 . 12 1 1 A 107 107 ALA C C 107 179.757 179.938 -0.181 1
1 1234 . 12 1 1 A 107 107 ALA CA C 107 55.355 55.596 -0.241 1
1 1235 . 12 1 1 A 107 107 ALA CB C 107 18.939 18.253 0.686 1
1 1236 . 12 1 1 A 107 107 ALA N N 107 120.740 120.562 0.178 1
1 1237 . 12 1 1 A 108 108 ARG H H 108 8.403 8.245 0.158 1
1 1238 . 12 1 1 A 108 108 ARG HA H 108 4.254 4.170 0.084 1
1 1245 . 12 1 1 A 108 108 ARG C C 108 179.111 178.687 0.424 1
1 1246 . 12 1 1 A 108 108 ARG CA C 108 59.015 58.500 0.515 1
1 1247 . 12 1 1 A 108 108 ARG CB C 108 29.752 30.040 -0.288 1
1 1250 . 12 1 1 A 108 108 ARG N N 108 119.531 117.255 2.276 1
1 1251 . 12 1 1 A 109 109 GLY H H 109 8.182 8.088 0.094 1
1 1252 . 12 1 1 A 109 109 GLY HA2 H 109 3.822 3.611 0.211 1
1 1253 . 12 1 1 A 109 109 GLY HA3 H 109 3.822 3.635 0.187 1
1 1254 . 12 1 1 A 109 109 GLY C C 109 177.020 176.536 0.484 1
1 1255 . 12 1 1 A 109 109 GLY CA C 109 46.718 47.304 -0.586 1
1 1256 . 12 1 1 A 109 109 GLY N N 109 107.331 108.447 -1.116 1
1 1257 . 12 1 1 A 110 110 TRP H H 110 7.925 8.097 -0.172 1
1 1258 . 12 1 1 A 110 110 TRP HA H 110 3.963 4.605 -0.642 1
1 1267 . 12 1 1 A 110 110 TRP C C 110 176.691 177.927 -1.236 1
1 1268 . 12 1 1 A 110 110 TRP CA C 110 62.041 60.318 1.723 1
1 1269 . 12 1 1 A 110 110 TRP CB C 110 28.989 28.983 0.006 1
1 1275 . 12 1 1 A 110 110 TRP N N 110 122.304 121.891 0.413 1
1 1277 . 12 1 1 A 111 111 GLU H H 111 7.946 7.651 0.295 1
1 1278 . 12 1 1 A 111 111 GLU HA H 111 2.594 2.992 -0.398 1
1 1283 . 12 1 1 A 111 111 GLU C C 111 177.976 179.153 -1.177 1
1 1284 . 12 1 1 A 111 111 GLU CA C 111 60.193 58.872 1.321 1
1 1285 . 12 1 1 A 111 111 GLU CB C 111 29.277 29.372 -0.095 1
1 1287 . 12 1 1 A 111 111 GLU N N 111 121.755 119.062 2.693 1
1 1288 . 12 1 1 A 112 112 THR H H 112 7.993 7.544 0.449 1
1 1289 . 12 1 1 A 112 112 THR HA H 112 3.722 3.814 -0.092 1
1 1294 . 12 1 1 A 112 112 THR C C 112 176.038 175.875 0.163 1
1 1295 . 12 1 1 A 112 112 THR CA C 112 66.104 66.622 -0.518 1
1 1296 . 12 1 1 A 112 112 THR CB C 112 68.885 68.770 0.115 1
1 1298 . 12 1 1 A 112 112 THR N N 112 112.247 116.586 -4.339 1
1 1299 . 12 1 1 A 113 113 ALA H H 113 7.742 8.369 -0.627 1
1 1300 . 12 1 1 A 113 113 ALA HA H 113 4.029 3.979 0.050 1
1 1304 . 12 1 1 A 113 113 ALA C C 113 180.545 179.946 0.599 1
1 1305 . 12 1 1 A 113 113 ALA CA C 113 55.127 55.231 -0.104 1
1 1306 . 12 1 1 A 113 113 ALA CB C 113 18.854 18.408 0.446 1
1 1307 . 12 1 1 A 113 113 ALA N N 113 123.134 122.653 0.481 1
1 1308 . 12 1 1 A 114 114 ILE H H 114 8.472 8.505 -0.033 1
1 1309 . 12 1 1 A 114 114 ILE HA H 114 3.613 3.734 -0.121 1
1 1319 . 12 1 1 A 114 114 ILE C C 114 176.947 178.295 -1.348 1
1 1320 . 12 1 1 A 114 114 ILE CA C 114 66.016 65.318 0.698 1
1 1321 . 12 1 1 A 114 114 ILE CB C 114 38.335 37.917 0.418 1
1 1325 . 12 1 1 A 114 114 ILE N N 114 118.276 117.854 0.422 1
1 1326 . 12 1 1 A 115 115 ARG H H 115 8.181 7.720 0.461 1
1 1327 . 12 1 1 A 115 115 ARG HA H 115 3.835 3.942 -0.107 1
1 1334 . 12 1 1 A 115 115 ARG C C 115 179.588 179.170 0.418 1
1 1335 . 12 1 1 A 115 115 ARG CA C 115 61.072 59.828 1.244 1
1 1336 . 12 1 1 A 115 115 ARG CB C 115 29.975 29.715 0.260 1
1 1339 . 12 1 1 A 115 115 ARG N N 115 117.921 119.999 -2.078 1
1 1340 . 12 1 1 A 116 116 GLN H H 116 8.395 8.424 -0.029 1
1 1341 . 12 1 1 A 116 116 GLN HA H 116 4.030 4.056 -0.026 1
1 1348 . 12 1 1 A 116 116 GLN C C 116 178.716 178.892 -0.176 1
1 1349 . 12 1 1 A 116 116 GLN CA C 116 58.790 58.841 -0.051 1
1 1350 . 12 1 1 A 116 116 GLN CB C 116 28.248 28.476 -0.228 1
1 1352 . 12 1 1 A 116 116 GLN N N 116 116.842 118.865 -2.023 1
1 1354 . 12 1 1 A 117 117 ALA H H 117 7.902 8.062 -0.160 1
1 1355 . 12 1 1 A 117 117 ALA HA H 117 4.143 4.133 0.010 1
1 1359 . 12 1 1 A 117 117 ALA C C 117 179.685 180.257 -0.572 1
1 1360 . 12 1 1 A 117 117 ALA CA C 117 54.476 54.904 -0.428 1
1 1361 . 12 1 1 A 117 117 ALA CB C 117 18.300 18.355 -0.055 1
1 1362 . 12 1 1 A 117 117 ALA N N 117 122.828 122.937 -0.109 1
1 1363 . 12 1 1 A 118 118 LEU H H 118 7.904 7.774 0.130 1
1 1364 . 12 1 1 A 118 118 LEU HA H 118 4.119 4.126 -0.007 1
1 1374 . 12 1 1 A 118 118 LEU C C 118 178.437 178.710 -0.273 1
1 1375 . 12 1 1 A 118 118 LEU CA C 118 56.781 57.040 -0.259 1
1 1376 . 12 1 1 A 118 118 LEU CB C 118 42.371 41.843 0.528 1
1 1380 . 12 1 1 A 118 118 LEU N N 118 117.632 120.270 -2.638 1
1 1381 . 12 1 1 A 119 119 MET H H 119 7.673 8.199 -0.526 1
1 1382 . 12 1 1 A 119 119 MET HA H 119 4.442 4.215 0.227 1
1 1390 . 12 1 1 A 119 119 MET C C 119 176.680 177.964 -1.284 1
1 1391 . 12 1 1 A 119 119 MET CA C 119 56.432 57.882 -1.450 1
1 1392 . 12 1 1 A 119 119 MET CB C 119 32.769 31.736 1.033 1
1 1395 . 12 1 1 A 119 119 MET N N 119 117.286 117.725 -0.439 1
1 1396 . 12 1 1 A 120 120 SER H H 120 7.878 7.243 0.635 1
1 1397 . 12 1 1 A 120 120 SER HA H 120 4.500 4.468 0.032 1
1 1400 . 12 1 1 A 120 120 SER C C 120 174.742 174.510 0.232 1
1 1401 . 12 1 1 A 120 120 SER CA C 120 58.962 59.173 -0.211 1
1 1402 . 12 1 1 A 120 120 SER CB C 120 63.853 63.867 -0.014 1
1 1403 . 12 1 1 A 120 120 SER N N 120 115.064 112.892 2.172 1
1 1404 . 12 1 1 A 121 121 GLY H H 121 8.059 8.065 -0.006 1
1 1405 . 12 1 1 A 121 121 GLY HA2 H 121 4.231 3.884 0.347 1
1 1406 . 12 1 1 A 121 121 GLY HA3 H 121 4.112 3.885 0.227 1
1 1407 . 12 1 1 A 121 121 GLY C C 121 172.065 175.605 -3.540 1
1 1408 . 12 1 1 A 121 121 GLY CA C 121 45.030 46.944 -1.914 1
1 1409 . 12 1 1 A 121 121 GLY N N 121 110.271 108.842 1.429 1
1 1410 . 12 1 1 A 122 122 PRO HA H 122 4.496 4.432 0.064 1
1 1417 . 12 1 1 A 122 122 PRO CA C 122 63.399 63.743 -0.344 1
1 1418 . 12 1 1 A 122 122 PRO CB C 122 32.186 32.200 -0.014 1
1 1 . 13 1 1 A 6 6 SER H H 6 8.337 7.889 0.448 1
1 2 . 13 1 1 A 6 6 SER HA H 6 4.597 4.688 -0.091 1
1 5 . 13 1 1 A 6 6 SER C C 6 174.637 174.295 0.342 1
1 6 . 13 1 1 A 6 6 SER CA C 6 58.469 57.435 1.034 1
1 7 . 13 1 1 A 6 6 SER CB C 6 64.221 63.469 0.752 1
1 8 . 13 1 1 A 6 6 SER N N 6 117.887 113.634 4.253 1
1 9 . 13 1 1 A 7 7 GLY H H 7 8.280 8.143 0.137 1
1 10 . 13 1 1 A 7 7 GLY HA2 H 7 4.063 3.947 0.116 1
1 11 . 13 1 1 A 7 7 GLY HA3 H 7 4.063 3.950 0.113 1
1 12 . 13 1 1 A 7 7 GLY C C 7 173.724 173.465 0.259 1
1 13 . 13 1 1 A 7 7 GLY CA C 7 44.941 45.885 -0.944 1
1 14 . 13 1 1 A 7 7 GLY N N 7 110.151 110.061 0.090 1
1 15 . 13 1 1 A 8 8 THR H H 8 8.212 7.754 0.458 1
1 16 . 13 1 1 A 8 8 THR HA H 8 4.173 4.854 -0.681 1
1 21 . 13 1 1 A 8 8 THR C C 8 174.723 173.771 0.952 1
1 22 . 13 1 1 A 8 8 THR CA C 8 63.622 61.171 2.451 1
1 23 . 13 1 1 A 8 8 THR CB C 8 69.460 72.451 -2.991 1
1 25 . 13 1 1 A 8 8 THR N N 8 116.817 114.601 2.216 1
1 26 . 13 1 1 A 9 9 LEU H H 9 9.374 9.146 0.228 1
1 27 . 13 1 1 A 9 9 LEU HA H 9 4.302 4.299 0.003 1
1 37 . 13 1 1 A 9 9 LEU C C 9 177.468 176.662 0.806 1
1 38 . 13 1 1 A 9 9 LEU CA C 9 55.936 56.006 -0.070 1
1 39 . 13 1 1 A 9 9 LEU CB C 9 42.843 42.530 0.313 1
1 43 . 13 1 1 A 9 9 LEU N N 9 127.798 126.915 0.883 1
1 44 . 13 1 1 A 10 10 ARG H H 10 7.512 7.480 0.032 1
1 45 . 13 1 1 A 10 10 ARG HA H 10 4.199 4.677 -0.478 1
1 52 . 13 1 1 A 10 10 ARG C C 10 172.501 173.989 -1.488 1
1 53 . 13 1 1 A 10 10 ARG CA C 10 56.165 54.445 1.720 1
1 54 . 13 1 1 A 10 10 ARG CB C 10 32.442 33.288 -0.846 1
1 57 . 13 1 1 A 10 10 ARG N N 10 117.979 117.103 0.876 1
1 58 . 13 1 1 A 11 11 GLU H H 11 8.434 8.759 -0.325 1
1 59 . 13 1 1 A 11 11 GLU HA H 11 5.993 5.576 0.417 1
1 64 . 13 1 1 A 11 11 GLU C C 11 174.800 174.646 0.154 1
1 65 . 13 1 1 A 11 11 GLU CA C 11 54.570 55.212 -0.642 1
1 66 . 13 1 1 A 11 11 GLU CB C 11 34.245 33.127 1.118 1
1 68 . 13 1 1 A 11 11 GLU N N 11 120.782 122.336 -1.554 1
1 69 . 13 1 1 A 12 12 GLY H H 12 8.131 7.931 0.200 1
1 70 . 13 1 1 A 12 12 GLY HA2 H 12 4.714 3.314 1.400 1
1 71 . 13 1 1 A 12 12 GLY HA3 H 12 3.763 4.081 -0.318 1
1 72 . 13 1 1 A 12 12 GLY C C 12 171.060 171.627 -0.567 1
1 73 . 13 1 1 A 12 12 GLY CA C 12 45.241 44.992 0.249 1
1 74 . 13 1 1 A 12 12 GLY N N 12 107.457 106.220 1.237 1
1 75 . 13 1 1 A 13 13 TRP H H 13 8.783 8.442 0.341 1
1 76 . 13 1 1 A 13 13 TRP HA H 13 5.152 4.832 0.320 1
1 85 . 13 1 1 A 13 13 TRP C C 13 177.528 176.482 1.046 1
1 86 . 13 1 1 A 13 13 TRP CA C 13 57.783 58.774 -0.991 1
1 87 . 13 1 1 A 13 13 TRP CB C 13 30.222 29.924 0.298 1
1 93 . 13 1 1 A 13 13 TRP N N 13 120.792 121.325 -0.533 1
1 95 . 13 1 1 A 14 14 VAL H H 14 9.179 8.696 0.483 1
1 96 . 13 1 1 A 14 14 VAL HA H 14 4.072 4.453 -0.381 1
1 104 . 13 1 1 A 14 14 VAL C C 14 174.981 173.422 1.559 1
1 105 . 13 1 1 A 14 14 VAL CA C 14 61.741 60.345 1.396 1
1 106 . 13 1 1 A 14 14 VAL CB C 14 35.143 35.327 -0.184 1
1 109 . 13 1 1 A 14 14 VAL N N 14 125.476 123.135 2.341 1
1 110 . 13 1 1 A 15 15 VAL H H 15 8.403 8.762 -0.359 1
1 111 . 13 1 1 A 15 15 VAL HA H 15 5.532 5.404 0.128 1
1 119 . 13 1 1 A 15 15 VAL C C 15 175.078 174.323 0.755 1
1 120 . 13 1 1 A 15 15 VAL CA C 15 59.489 59.967 -0.478 1
1 121 . 13 1 1 A 15 15 VAL CB C 15 34.210 34.802 -0.592 1
1 124 . 13 1 1 A 15 15 VAL N N 15 126.189 127.656 -1.467 1
1 125 . 13 1 1 A 16 16 HIS H H 16 9.122 8.491 0.631 1
1 126 . 13 1 1 A 16 16 HIS HA H 16 5.823 5.425 0.398 1
1 131 . 13 1 1 A 16 16 HIS C C 16 172.998 172.489 0.509 1
1 132 . 13 1 1 A 16 16 HIS CA C 16 56.253 54.169 2.084 1
1 133 . 13 1 1 A 16 16 HIS CB C 16 34.273 32.897 1.376 1
1 136 . 13 1 1 A 16 16 HIS N N 16 121.152 120.114 1.038 1
1 137 . 13 1 1 A 17 17 TYR H H 17 8.465 8.597 -0.132 1
1 138 . 13 1 1 A 17 17 TYR HA H 17 5.096 4.917 0.179 1
1 145 . 13 1 1 A 17 17 TYR C C 17 173.640 172.499 1.141 1
1 146 . 13 1 1 A 17 17 TYR CA C 17 56.903 56.165 0.738 1
1 147 . 13 1 1 A 17 17 TYR CB C 17 40.103 40.452 -0.349 1
1 152 . 13 1 1 A 17 17 TYR N N 17 115.558 116.835 -1.277 1
1 153 . 13 1 1 A 18 18 SER H H 18 9.122 8.717 0.405 1
1 154 . 13 1 1 A 18 18 SER HA H 18 6.144 5.565 0.579 1
1 157 . 13 1 1 A 18 18 SER C C 18 173.204 174.215 -1.011 1
1 158 . 13 1 1 A 18 18 SER CA C 18 56.640 57.088 -0.448 1
1 159 . 13 1 1 A 18 18 SER CB C 18 68.788 66.224 2.564 1
1 160 . 13 1 1 A 18 18 SER N N 18 118.846 116.409 2.437 1
1 161 . 13 1 1 A 19 19 ASN H H 19 9.053 8.805 0.248 1
1 162 . 13 1 1 A 19 19 ASN HA H 19 4.473 5.042 -0.569 1
1 167 . 13 1 1 A 19 19 ASN C C 19 175.396 175.829 -0.433 1
1 168 . 13 1 1 A 19 19 ASN CA C 19 55.373 52.229 3.144 1
1 169 . 13 1 1 A 19 19 ASN CB C 19 36.900 38.170 -1.270 1
1 170 . 13 1 1 A 19 19 ASN N N 19 113.712 118.159 -4.447 1
1 172 . 13 1 1 A 20 20 LYS H H 20 7.677 8.383 -0.706 1
1 173 . 13 1 1 A 20 20 LYS HA H 20 4.413 4.697 -0.284 1
1 182 . 13 1 1 A 20 20 LYS C C 20 176.078 177.484 -1.406 1
1 183 . 13 1 1 A 20 20 LYS CA C 20 55.679 57.548 -1.869 1
1 184 . 13 1 1 A 20 20 LYS CB C 20 33.023 35.572 -2.549 1
1 188 . 13 1 1 A 20 20 LYS N N 20 117.213 119.616 -2.403 1
1 189 . 13 1 1 A 21 21 ASP H H 21 7.395 7.927 -0.532 1
1 190 . 13 1 1 A 21 21 ASP HA H 21 4.808 4.786 0.022 1
1 193 . 13 1 1 A 21 21 ASP C C 21 176.413 176.206 0.207 1
1 194 . 13 1 1 A 21 21 ASP CA C 21 53.983 53.932 0.051 1
1 195 . 13 1 1 A 21 21 ASP CB C 21 41.199 42.970 -1.771 1
1 196 . 13 1 1 A 21 21 ASP N N 21 119.879 116.336 3.543 1
1 197 . 13 1 1 A 22 22 THR H H 22 8.593 8.098 0.495 1
1 198 . 13 1 1 A 22 22 THR HA H 22 4.352 4.039 0.313 1
1 203 . 13 1 1 A 22 22 THR C C 22 172.913 174.706 -1.793 1
1 204 . 13 1 1 A 22 22 THR CA C 22 62.691 62.961 -0.270 1
1 205 . 13 1 1 A 22 22 THR CB C 22 68.332 66.451 1.881 1
1 207 . 13 1 1 A 22 22 THR N N 22 116.299 112.881 3.418 1
1 208 . 13 1 1 A 23 23 LEU H H 23 7.645 7.957 -0.312 1
1 209 . 13 1 1 A 23 23 LEU HA H 23 4.318 4.465 -0.147 1
1 219 . 13 1 1 A 23 23 LEU C C 23 176.692 176.502 0.190 1
1 220 . 13 1 1 A 23 23 LEU CA C 23 54.617 53.634 0.983 1
1 221 . 13 1 1 A 23 23 LEU CB C 23 41.939 41.317 0.622 1
1 225 . 13 1 1 A 23 23 LEU N N 23 123.606 120.912 2.694 1
1 226 . 13 1 1 A 24 24 ARG H H 24 8.563 7.873 0.690 1
1 227 . 13 1 1 A 24 24 ARG HA H 24 4.373 4.540 -0.167 1
1 235 . 13 1 1 A 24 24 ARG C C 24 176.584 176.024 0.560 1
1 236 . 13 1 1 A 24 24 ARG CA C 24 57.854 57.066 0.788 1
1 237 . 13 1 1 A 24 24 ARG CB C 24 31.126 30.436 0.690 1
1 240 . 13 1 1 A 24 24 ARG N N 24 127.152 123.205 3.947 1
1 242 . 13 1 1 A 25 25 LYS H H 25 8.633 8.869 -0.236 1
1 243 . 13 1 1 A 25 25 LYS HA H 25 4.513 4.770 -0.257 1
1 251 . 13 1 1 A 25 25 LYS C C 25 173.567 174.460 -0.893 1
1 252 . 13 1 1 A 25 25 LYS CA C 25 54.792 54.567 0.225 1
1 253 . 13 1 1 A 25 25 LYS CB C 25 37.416 34.982 2.434 1
1 257 . 13 1 1 A 25 25 LYS N N 25 122.682 124.978 -2.296 1
1 258 . 13 1 1 A 26 26 ARG H H 26 8.303 8.712 -0.409 1
1 259 . 13 1 1 A 26 26 ARG HA H 26 5.153 5.069 0.084 1
1 266 . 13 1 1 A 26 26 ARG C C 26 174.554 174.822 -0.268 1
1 267 . 13 1 1 A 26 26 ARG CA C 26 55.083 54.536 0.547 1
1 268 . 13 1 1 A 26 26 ARG CB C 26 32.789 32.267 0.522 1
1 271 . 13 1 1 A 26 26 ARG N N 26 121.819 124.078 -2.259 1
1 272 . 13 1 1 A 27 27 HIS H H 27 8.793 8.720 0.073 1
1 273 . 13 1 1 A 27 27 HIS HA H 27 5.155 5.440 -0.285 1
1 278 . 13 1 1 A 27 27 HIS CA C 27 56.904 55.102 1.802 1
1 279 . 13 1 1 A 27 27 HIS CB C 27 34.683 31.358 3.325 1
1 282 . 13 1 1 A 27 27 HIS N N 27 122.102 120.564 1.538 1
1 283 . 13 1 1 A 28 28 TYR H H 28 9.273 8.565 0.708 1
1 284 . 13 1 1 A 28 28 TYR HA H 28 4.332 4.347 -0.015 1
1 291 . 13 1 1 A 28 28 TYR C C 28 174.730 175.315 -0.585 1
1 292 . 13 1 1 A 28 28 TYR CA C 28 58.680 57.066 1.614 1
1 293 . 13 1 1 A 28 28 TYR CB C 28 38.673 37.850 0.823 1
1 298 . 13 1 1 A 28 28 TYR N N 28 125.605 122.018 3.587 1
1 299 . 13 1 1 A 29 29 TRP H H 29 9.273 8.770 0.503 1
1 300 . 13 1 1 A 29 29 TRP HA H 29 5.543 4.909 0.634 1
1 309 . 13 1 1 A 29 29 TRP C C 29 176.172 176.652 -0.480 1
1 310 . 13 1 1 A 29 29 TRP CA C 29 56.658 57.179 -0.521 1
1 311 . 13 1 1 A 29 29 TRP CB C 29 32.154 30.428 1.726 1
1 317 . 13 1 1 A 29 29 TRP N N 29 131.340 128.294 3.046 1
1 318 . 13 1 1 A 30 30 ARG H H 30 9.164 9.143 0.021 1
1 319 . 13 1 1 A 30 30 ARG HA H 30 5.302 5.480 -0.178 1
1 327 . 13 1 1 A 30 30 ARG C C 30 174.774 174.505 0.269 1
1 328 . 13 1 1 A 30 30 ARG CA C 30 56.271 54.722 1.549 1
1 329 . 13 1 1 A 30 30 ARG CB C 30 34.203 33.997 0.206 1
1 332 . 13 1 1 A 30 30 ARG N N 30 116.040 120.841 -4.801 1
1 334 . 13 1 1 A 31 31 LEU H H 31 9.273 9.455 -0.182 1
1 335 . 13 1 1 A 31 31 LEU HA H 31 5.324 5.434 -0.110 1
1 345 . 13 1 1 A 31 31 LEU C C 31 174.488 174.503 -0.015 1
1 346 . 13 1 1 A 31 31 LEU CA C 31 53.807 53.496 0.311 1
1 347 . 13 1 1 A 31 31 LEU CB C 31 46.667 45.692 0.975 1
1 351 . 13 1 1 A 31 31 LEU N N 31 127.075 127.049 0.026 1
1 352 . 13 1 1 A 32 32 ASP H H 32 8.854 8.866 -0.012 1
1 353 . 13 1 1 A 32 32 ASP HA H 32 4.902 5.101 -0.199 1
1 356 . 13 1 1 A 32 32 ASP C C 32 173.474 176.627 -3.153 1
1 357 . 13 1 1 A 32 32 ASP CA C 32 53.104 52.245 0.859 1
1 358 . 13 1 1 A 32 32 ASP CB C 32 42.931 44.198 -1.267 1
1 359 . 13 1 1 A 32 32 ASP N N 32 129.349 125.652 3.697 1
1 360 . 13 1 1 A 33 33 CYS H H 33 8.153 8.773 -0.620 1
1 361 . 13 1 1 A 33 33 CYS HA H 33 4.323 4.548 -0.225 1
1 364 . 13 1 1 A 33 33 CYS C C 33 174.476 175.652 -1.176 1
1 365 . 13 1 1 A 33 33 CYS CA C 33 59.853 59.466 0.387 1
1 366 . 13 1 1 A 33 33 CYS CB C 33 27.508 27.882 -0.374 1
1 367 . 13 1 1 A 33 33 CYS N N 33 108.439 119.622 -11.183 1
1 368 . 13 1 1 A 34 34 LYS H H 34 9.144 7.769 1.375 1
1 369 . 13 1 1 A 34 34 LYS HA H 34 4.616 4.470 0.146 1
1 378 . 13 1 1 A 34 34 LYS C C 34 177.601 176.100 1.501 1
1 379 . 13 1 1 A 34 34 LYS CA C 34 57.185 56.857 0.328 1
1 380 . 13 1 1 A 34 34 LYS CB C 34 35.623 35.167 0.456 1
1 384 . 13 1 1 A 34 34 LYS N N 34 119.884 119.750 0.134 1
1 385 . 13 1 1 A 35 35 CYS H H 35 9.102 7.665 1.437 1
1 386 . 13 1 1 A 35 35 CYS HA H 35 4.935 4.782 0.153 1
1 389 . 13 1 1 A 35 35 CYS C C 35 172.283 172.496 -0.213 1
1 390 . 13 1 1 A 35 35 CYS CA C 35 57.748 58.162 -0.414 1
1 391 . 13 1 1 A 35 35 CYS CB C 35 31.537 32.300 -0.763 1
1 392 . 13 1 1 A 35 35 CYS N N 35 120.317 114.508 5.809 1
1 393 . 13 1 1 A 36 36 ILE H H 36 8.213 8.967 -0.754 1
1 394 . 13 1 1 A 36 36 ILE HA H 36 4.617 4.930 -0.313 1
1 404 . 13 1 1 A 36 36 ILE C C 36 175.312 175.300 0.012 1
1 405 . 13 1 1 A 36 36 ILE CA C 36 60.967 60.344 0.623 1
1 406 . 13 1 1 A 36 36 ILE CB C 36 39.718 38.570 1.148 1
1 410 . 13 1 1 A 36 36 ILE N N 36 121.905 121.805 0.100 1
1 411 . 13 1 1 A 37 37 THR H H 37 9.076 8.773 0.303 1
1 412 . 13 1 1 A 37 37 THR HA H 37 4.364 4.545 -0.181 1
1 417 . 13 1 1 A 37 37 THR CA C 37 61.834 62.517 -0.683 1
1 418 . 13 1 1 A 37 37 THR CB C 37 69.237 70.209 -0.972 1
1 420 . 13 1 1 A 37 37 THR N N 37 122.500 123.622 -1.122 1
1 421 . 13 1 1 A 38 38 LEU H H 38 8.263 8.431 -0.168 1
1 422 . 13 1 1 A 38 38 LEU HA H 38 4.445 5.108 -0.663 1
1 432 . 13 1 1 A 38 38 LEU CA C 38 55.611 52.950 2.661 1
1 433 . 13 1 1 A 38 38 LEU CB C 38 42.702 45.853 -3.151 1
1 437 . 13 1 1 A 38 38 LEU N N 38 126.987 123.896 3.091 1
1 438 . 13 1 1 A 39 39 PHE H H 39 9.520 8.736 0.784 1
1 439 . 13 1 1 A 39 39 PHE HA H 39 4.998 5.016 -0.018 1
1 447 . 13 1 1 A 39 39 PHE CA C 39 57.331 56.298 1.033 1
1 448 . 13 1 1 A 39 39 PHE CB C 39 42.453 41.193 1.260 1
1 454 . 13 1 1 A 39 39 PHE N N 39 120.545 119.645 0.900 1
1 455 . 13 1 1 A 40 40 GLN H H 40 9.878 8.963 0.915 1
1 456 . 13 1 1 A 40 40 GLN HA H 40 4.376 4.013 0.363 1
1 463 . 13 1 1 A 40 40 GLN CA C 40 59.513 58.774 0.739 1
1 464 . 13 1 1 A 40 40 GLN CB C 40 29.317 28.807 0.510 1
1 467 . 13 1 1 A 41 41 ASN H H 41 7.732 8.002 -0.270 1
1 468 . 13 1 1 A 41 41 ASN HA H 41 4.812 5.546 -0.734 1
1 473 . 13 1 1 A 41 41 ASN CA C 41 52.618 51.898 0.720 1
1 474 . 13 1 1 A 41 41 ASN CB C 41 39.362 42.684 -3.322 1
1 475 . 13 1 1 A 41 41 ASN N N 41 107.613 114.369 -6.756 1
1 477 . 13 1 1 A 42 42 ASN HA H 42 3.476 4.179 -0.703 1
1 482 . 13 1 1 A 42 42 ASN C C 42 173.607 177.426 -3.819 1
1 483 . 13 1 1 A 42 42 ASN CA C 42 54.888 55.300 -0.412 1
1 484 . 13 1 1 A 42 42 ASN CB C 42 35.613 38.125 -2.512 1
1 486 . 13 1 1 A 43 43 THR H H 43 8.394 7.700 0.694 1
1 487 . 13 1 1 A 43 43 THR HA H 43 4.403 4.247 0.156 1
1 492 . 13 1 1 A 43 43 THR C C 43 174.464 174.787 -0.323 1
1 493 . 13 1 1 A 43 43 THR CA C 43 61.978 64.569 -2.591 1
1 494 . 13 1 1 A 43 43 THR CB C 43 70.036 69.019 1.017 1
1 496 . 13 1 1 A 43 43 THR N N 43 111.795 109.530 2.265 1
1 497 . 13 1 1 A 44 44 THR H H 44 8.058 7.644 0.414 1
1 498 . 13 1 1 A 44 44 THR HA H 44 4.464 4.252 0.212 1
1 503 . 13 1 1 A 44 44 THR CA C 44 61.599 62.645 -1.046 1
1 504 . 13 1 1 A 44 44 THR CB C 44 69.137 69.333 -0.196 1
1 506 . 13 1 1 A 44 44 THR N N 44 116.514 116.457 0.057 1
1 507 . 13 1 1 A 45 45 ASN H H 45 6.653 8.895 -2.242 1
1 508 . 13 1 1 A 45 45 ASN HA H 45 4.945 4.851 0.094 1
1 513 . 13 1 1 A 45 45 ASN CA C 45 53.227 55.322 -2.095 1
1 514 . 13 1 1 A 45 45 ASN CB C 45 38.483 38.859 -0.376 1
1 516 . 13 1 1 A 46 46 ARG H H 46 8.213 7.802 0.411 1
1 517 . 13 1 1 A 46 46 ARG HA H 46 4.583 4.627 -0.044 1
1 524 . 13 1 1 A 46 46 ARG CA C 46 55.487 55.383 0.104 1
1 525 . 13 1 1 A 46 46 ARG CB C 46 31.153 31.542 -0.389 1
1 528 . 13 1 1 A 46 46 ARG N N 46 121.652 120.500 1.152 1
1 529 . 13 1 1 A 47 47 TYR H H 47 7.973 8.913 -0.940 1
1 536 . 13 1 1 A 47 47 TYR CB C 47 39.356 39.189 0.167 1
1 541 . 13 1 1 A 48 48 TYR H H 48 9.023 8.431 0.592 1
1 542 . 13 1 1 A 48 48 TYR HA H 48 4.662 4.387 0.275 1
1 549 . 13 1 1 A 48 48 TYR CB C 48 39.863 40.581 -0.718 1
1 554 . 13 1 1 A 48 48 TYR N N 48 121.223 120.980 0.243 1
1 555 . 13 1 1 A 49 49 LYS H H 49 7.134 7.458 -0.324 1
1 556 . 13 1 1 A 49 49 LYS HA H 49 4.283 4.492 -0.209 1
1 565 . 13 1 1 A 49 49 LYS CA C 49 55.167 55.389 -0.222 1
1 566 . 13 1 1 A 49 49 LYS CB C 49 36.699 36.123 0.576 1
1 570 . 13 1 1 A 49 49 LYS N N 49 117.339 117.965 -0.626 1
1 571 . 13 1 1 A 50 50 GLU H H 50 8.411 9.018 -0.607 1
1 572 . 13 1 1 A 50 50 GLU HA H 50 4.583 5.121 -0.538 1
1 577 . 13 1 1 A 50 50 GLU CA C 50 54.592 54.656 -0.064 1
1 578 . 13 1 1 A 50 50 GLU CB C 50 33.263 32.992 0.271 1
1 580 . 13 1 1 A 50 50 GLU N N 50 123.825 124.798 -0.973 1
1 581 . 13 1 1 A 51 51 ILE H H 51 9.225 9.160 0.065 1
1 582 . 13 1 1 A 51 51 ILE HA H 51 4.277 4.628 -0.351 1
1 592 . 13 1 1 A 51 51 ILE CA C 51 58.182 58.188 -0.006 1
1 593 . 13 1 1 A 51 51 ILE CB C 51 39.663 38.434 1.229 1
1 597 . 13 1 1 A 51 51 ILE N N 51 125.271 126.807 -1.536 1
1 598 . 13 1 1 A 52 52 PRO HA H 52 4.543 4.639 -0.096 1
1 605 . 13 1 1 A 52 52 PRO C C 52 178.340 178.099 0.241 1
1 606 . 13 1 1 A 52 52 PRO CA C 52 62.726 62.904 -0.178 1
1 607 . 13 1 1 A 52 52 PRO CB C 52 32.003 31.747 0.256 1
1 610 . 13 1 1 A 53 53 LEU H H 53 8.723 8.527 0.196 1
1 611 . 13 1 1 A 53 53 LEU HA H 53 3.891 3.905 -0.014 1
1 621 . 13 1 1 A 53 53 LEU C C 53 179.673 179.078 0.595 1
1 622 . 13 1 1 A 53 53 LEU CA C 53 58.205 57.535 0.670 1
1 623 . 13 1 1 A 53 53 LEU CB C 53 40.171 41.426 -1.255 1
1 627 . 13 1 1 A 53 53 LEU N N 53 125.150 124.324 0.826 1
1 628 . 13 1 1 A 54 54 SER H H 54 8.360 8.135 0.225 1
1 629 . 13 1 1 A 54 54 SER HA H 54 4.164 4.091 0.073 1
1 632 . 13 1 1 A 54 54 SER C C 54 175.517 177.487 -1.970 1
1 633 . 13 1 1 A 54 54 SER CA C 54 60.193 61.450 -1.257 1
1 634 . 13 1 1 A 54 54 SER CB C 54 62.617 62.929 -0.312 1
1 635 . 13 1 1 A 54 54 SER N N 54 111.266 114.399 -3.133 1
1 636 . 13 1 1 A 55 55 GLU H H 55 7.666 8.089 -0.423 1
1 637 . 13 1 1 A 55 55 GLU HA H 55 4.363 4.093 0.270 1
1 642 . 13 1 1 A 55 55 GLU C C 55 176.753 177.919 -1.166 1
1 643 . 13 1 1 A 55 55 GLU CA C 55 56.200 59.180 -2.980 1
1 644 . 13 1 1 A 55 55 GLU CB C 55 30.526 29.093 1.433 1
1 646 . 13 1 1 A 55 55 GLU N N 55 119.485 120.212 -0.727 1
1 647 . 13 1 1 A 56 56 ILE H H 56 7.601 7.176 0.425 1
1 648 . 13 1 1 A 56 56 ILE HA H 56 3.793 3.955 -0.162 1
1 658 . 13 1 1 A 56 56 ILE C C 56 175.142 175.919 -0.777 1
1 659 . 13 1 1 A 56 56 ILE CA C 56 63.518 62.552 0.966 1
1 660 . 13 1 1 A 56 56 ILE CB C 56 37.169 37.934 -0.765 1
1 664 . 13 1 1 A 56 56 ILE N N 56 120.430 119.978 0.452 1
1 665 . 13 1 1 A 57 57 LEU H H 57 9.263 9.306 -0.043 1
1 666 . 13 1 1 A 57 57 LEU HA H 57 4.343 4.359 -0.016 1
1 676 . 13 1 1 A 57 57 LEU C C 57 177.898 176.603 1.295 1
1 677 . 13 1 1 A 57 57 LEU CA C 57 56.569 55.989 0.580 1
1 678 . 13 1 1 A 57 57 LEU CB C 57 41.980 42.526 -0.546 1
1 682 . 13 1 1 A 57 57 LEU N N 57 129.464 129.346 0.118 1
1 683 . 13 1 1 A 58 58 THR H H 58 7.414 7.294 0.120 1
1 684 . 13 1 1 A 58 58 THR HA H 58 4.512 4.985 -0.473 1
1 689 . 13 1 1 A 58 58 THR C C 58 171.314 172.710 -1.396 1
1 690 . 13 1 1 A 58 58 THR CA C 58 60.562 61.234 -0.672 1
1 691 . 13 1 1 A 58 58 THR CB C 58 70.803 73.374 -2.571 1
1 693 . 13 1 1 A 58 58 THR N N 58 109.129 110.383 -1.254 1
1 694 . 13 1 1 A 59 59 VAL H H 59 8.152 8.398 -0.246 1
1 695 . 13 1 1 A 59 59 VAL HA H 59 5.061 5.097 -0.036 1
1 703 . 13 1 1 A 59 59 VAL C C 59 174.985 174.883 0.102 1
1 704 . 13 1 1 A 59 59 VAL CA C 59 61.354 61.294 0.060 1
1 705 . 13 1 1 A 59 59 VAL CB C 59 33.855 34.561 -0.706 1
1 708 . 13 1 1 A 59 59 VAL N N 59 123.676 123.136 0.540 1
1 709 . 13 1 1 A 60 60 GLU H H 60 9.074 8.618 0.456 1
1 710 . 13 1 1 A 60 60 GLU HA H 60 4.977 4.873 0.104 1
1 715 . 13 1 1 A 60 60 GLU C C 60 176.063 175.582 0.481 1
1 716 . 13 1 1 A 60 60 GLU CA C 60 53.807 54.303 -0.496 1
1 717 . 13 1 1 A 60 60 GLU CB C 60 33.739 33.656 0.083 1
1 719 . 13 1 1 A 60 60 GLU N N 60 125.125 125.706 -0.581 1
1 720 . 13 1 1 A 61 61 SER H H 61 8.763 8.691 0.072 1
1 721 . 13 1 1 A 61 61 SER HA H 61 4.452 4.930 -0.478 1
1 724 . 13 1 1 A 61 61 SER C C 61 173.288 174.221 -0.933 1
1 725 . 13 1 1 A 61 61 SER CA C 61 59.384 58.255 1.129 1
1 726 . 13 1 1 A 61 61 SER CB C 61 63.390 64.070 -0.680 1
1 727 . 13 1 1 A 61 61 SER N N 61 117.523 117.857 -0.334 1
1 728 . 13 1 1 A 62 62 ALA H H 62 7.293 8.957 -1.664 1
1 729 . 13 1 1 A 62 62 ALA HA H 62 3.817 4.397 -0.580 1
1 733 . 13 1 1 A 62 62 ALA C C 62 176.717 177.677 -0.960 1
1 734 . 13 1 1 A 62 62 ALA CA C 62 53.966 53.076 0.890 1
1 735 . 13 1 1 A 62 62 ALA CB C 62 18.640 18.568 0.072 1
1 736 . 13 1 1 A 62 62 ALA N N 62 122.650 126.129 -3.479 1
1 737 . 13 1 1 A 63 63 GLN H H 63 8.736 8.630 0.106 1
1 738 . 13 1 1 A 63 63 GLN HA H 63 4.445 4.763 -0.318 1
1 745 . 13 1 1 A 63 63 GLN C C 63 173.700 175.006 -1.306 1
1 746 . 13 1 1 A 63 63 GLN CA C 63 56.376 55.836 0.540 1
1 747 . 13 1 1 A 63 63 GLN CB C 63 31.515 31.048 0.467 1
1 749 . 13 1 1 A 63 63 GLN N N 63 120.251 119.777 0.474 1
1 751 . 13 1 1 A 64 64 ASN H H 64 9.272 7.720 1.552 1
1 752 . 13 1 1 A 64 64 ASN HA H 64 4.906 5.210 -0.304 1
1 757 . 13 1 1 A 64 64 ASN C C 64 174.754 175.280 -0.526 1
1 758 . 13 1 1 A 64 64 ASN CA C 64 51.837 52.190 -0.353 1
1 759 . 13 1 1 A 64 64 ASN CB C 64 38.156 41.413 -3.257 1
1 760 . 13 1 1 A 64 64 ASN N N 64 122.346 118.918 3.428 1
1 762 . 13 1 1 A 65 65 PHE H H 65 8.854 9.042 -0.188 1
1 763 . 13 1 1 A 65 65 PHE HA H 65 4.947 5.122 -0.175 1
1 771 . 13 1 1 A 65 65 PHE C C 65 177.274 176.367 0.907 1
1 772 . 13 1 1 A 65 65 PHE CA C 65 57.519 57.328 0.191 1
1 773 . 13 1 1 A 65 65 PHE CB C 65 38.485 39.077 -0.592 1
1 779 . 13 1 1 A 65 65 PHE N N 65 123.638 125.162 -1.524 1
1 780 . 13 1 1 A 66 66 SER H H 66 8.163 8.142 0.021 1
1 781 . 13 1 1 A 66 66 SER HA H 66 4.393 4.266 0.127 1
1 784 . 13 1 1 A 66 66 SER C C 66 175.699 177.388 -1.689 1
1 785 . 13 1 1 A 66 66 SER CA C 66 60.791 61.096 -0.305 1
1 786 . 13 1 1 A 66 66 SER CB C 66 64.591 63.212 1.379 1
1 787 . 13 1 1 A 66 66 SER N N 66 113.913 116.599 -2.686 1
1 788 . 13 1 1 A 67 67 LEU H H 67 8.574 7.727 0.847 1
1 789 . 13 1 1 A 67 67 LEU HA H 67 4.302 3.750 0.552 1
1 799 . 13 1 1 A 67 67 LEU C C 67 176.269 177.233 -0.964 1
1 800 . 13 1 1 A 67 67 LEU CA C 67 55.601 58.208 -2.607 1
1 801 . 13 1 1 A 67 67 LEU CB C 67 42.021 41.804 0.217 1
1 805 . 13 1 1 A 67 67 LEU N N 67 121.264 120.788 0.476 1
1 806 . 13 1 1 A 68 68 VAL H H 68 6.921 7.592 -0.671 1
1 807 . 13 1 1 A 68 68 VAL HA H 68 4.473 4.164 0.309 1
1 815 . 13 1 1 A 68 68 VAL C C 68 173.809 174.960 -1.151 1
1 816 . 13 1 1 A 68 68 VAL CA C 68 58.047 60.641 -2.594 1
1 817 . 13 1 1 A 68 68 VAL CB C 68 32.295 31.839 0.456 1
1 820 . 13 1 1 A 68 68 VAL N N 68 111.287 115.111 -3.824 1
1 821 . 13 1 1 A 69 69 PRO HA H 69 4.658 4.706 -0.048 1
1 828 . 13 1 1 A 69 69 PRO CA C 69 61.747 61.533 0.214 1
1 829 . 13 1 1 A 69 69 PRO CB C 69 30.693 31.693 -1.000 1
1 832 . 13 1 1 A 70 70 PRO HA H 70 4.414 4.248 0.166 1
1 839 . 13 1 1 A 70 70 PRO CA C 70 63.997 63.665 0.332 1
1 840 . 13 1 1 A 70 70 PRO CB C 70 31.602 31.232 0.370 1
1 843 . 13 1 1 A 71 71 GLY H H 71 8.824 8.872 -0.048 1
1 844 . 13 1 1 A 71 71 GLY HA2 H 71 3.703 3.904 -0.201 1
1 845 . 13 1 1 A 71 71 GLY HA3 H 71 4.193 3.912 0.281 1
1 846 . 13 1 1 A 71 71 GLY C C 71 174.052 174.672 -0.620 1
1 847 . 13 1 1 A 71 71 GLY CA C 71 45.065 45.156 -0.091 1
1 848 . 13 1 1 A 71 71 GLY N N 71 111.845 112.917 -1.072 1
1 849 . 13 1 1 A 72 72 THR H H 72 7.597 7.289 0.308 1
1 850 . 13 1 1 A 72 72 THR HA H 72 4.133 4.125 0.008 1
1 855 . 13 1 1 A 72 72 THR CA C 72 63.129 63.268 -0.139 1
1 856 . 13 1 1 A 72 72 THR CB C 72 69.560 69.001 0.559 1
1 858 . 13 1 1 A 72 72 THR N N 72 117.485 115.938 1.547 1
1 859 . 13 1 1 A 73 73 ASN H H 73 9.280 8.528 0.752 1
1 860 . 13 1 1 A 73 73 ASN HA H 73 4.786 4.580 0.206 1
1 865 . 13 1 1 A 73 73 ASN CA C 73 52.009 52.125 -0.116 1
1 866 . 13 1 1 A 73 73 ASN CB C 73 37.553 38.410 -0.857 1
1 867 . 13 1 1 A 73 73 ASN N N 73 127.641 125.211 2.430 1
1 869 . 13 1 1 A 74 74 PRO HA H 74 4.752 4.812 -0.060 1
1 876 . 13 1 1 A 74 74 PRO C C 74 175.190 176.674 -1.484 1
1 877 . 13 1 1 A 74 74 PRO CA C 74 63.395 62.523 0.872 1
1 878 . 13 1 1 A 74 74 PRO CB C 74 33.164 33.092 0.072 1
1 881 . 13 1 1 A 75 75 HIS H H 75 8.025 8.918 -0.893 1
1 882 . 13 1 1 A 75 75 HIS HA H 75 5.047 5.146 -0.099 1
1 887 . 13 1 1 A 75 75 HIS C C 75 172.562 174.669 -2.107 1
1 888 . 13 1 1 A 75 75 HIS CA C 75 54.336 53.461 0.875 1
1 889 . 13 1 1 A 75 75 HIS CB C 75 30.956 33.202 -2.246 1
1 892 . 13 1 1 A 75 75 HIS N N 75 116.198 116.813 -0.615 1
1 893 . 13 1 1 A 76 76 CYS H H 76 8.343 9.389 -1.046 1
1 894 . 13 1 1 A 76 76 CYS HA H 76 4.594 4.583 0.011 1
1 897 . 13 1 1 A 76 76 CYS C C 76 175.651 175.142 0.509 1
1 898 . 13 1 1 A 76 76 CYS CA C 76 61.066 60.581 0.485 1
1 899 . 13 1 1 A 76 76 CYS CB C 76 30.193 29.931 0.262 1
1 900 . 13 1 1 A 76 76 CYS N N 76 113.289 117.736 -4.447 1
1 901 . 13 1 1 A 77 77 PHE H H 77 8.433 8.135 0.298 1
1 902 . 13 1 1 A 77 77 PHE HA H 77 5.105 5.435 -0.330 1
1 910 . 13 1 1 A 77 77 PHE C C 77 171.822 172.727 -0.905 1
1 911 . 13 1 1 A 77 77 PHE CA C 77 56.874 55.743 1.131 1
1 912 . 13 1 1 A 77 77 PHE CB C 77 39.393 42.643 -3.250 1
1 918 . 13 1 1 A 77 77 PHE N N 77 114.874 116.492 -1.618 1
1 919 . 13 1 1 A 78 78 GLU H H 78 9.823 9.205 0.618 1
1 920 . 13 1 1 A 78 78 GLU HA H 78 5.333 5.340 -0.007 1
1 925 . 13 1 1 A 78 78 GLU C C 78 175.602 175.393 0.209 1
1 926 . 13 1 1 A 78 78 GLU CA C 78 54.212 54.729 -0.517 1
1 927 . 13 1 1 A 78 78 GLU CB C 78 31.702 32.642 -0.940 1
1 929 . 13 1 1 A 78 78 GLU N N 78 121.074 119.137 1.937 1
1 930 . 13 1 1 A 79 79 ILE H H 79 9.093 9.027 0.066 1
1 931 . 13 1 1 A 79 79 ILE HA H 79 4.637 4.587 0.050 1
1 941 . 13 1 1 A 79 79 ILE C C 79 174.476 174.972 -0.496 1
1 942 . 13 1 1 A 79 79 ILE CA C 79 60.932 60.692 0.240 1
1 943 . 13 1 1 A 79 79 ILE CB C 79 40.803 37.589 3.214 1
1 947 . 13 1 1 A 79 79 ILE N N 79 121.382 124.133 -2.751 1
1 948 . 13 1 1 A 80 80 VAL H H 80 8.841 7.795 1.046 1
1 949 . 13 1 1 A 80 80 VAL HA H 80 4.425 3.767 0.658 1
1 957 . 13 1 1 A 80 80 VAL C C 80 175.930 175.010 0.920 1
1 958 . 13 1 1 A 80 80 VAL CA C 80 63.324 63.081 0.243 1
1 959 . 13 1 1 A 80 80 VAL CB C 80 32.783 31.118 1.665 1
1 962 . 13 1 1 A 80 80 VAL N N 80 128.970 127.053 1.917 1
1 963 . 13 1 1 A 81 81 THR H H 81 8.303 7.801 0.502 1
1 964 . 13 1 1 A 81 81 THR HA H 81 5.264 4.588 0.676 1
1 969 . 13 1 1 A 81 81 THR C C 81 173.664 174.743 -1.079 1
1 970 . 13 1 1 A 81 81 THR CA C 81 59.540 60.187 -0.647 1
1 971 . 13 1 1 A 81 81 THR CB C 81 72.197 71.264 0.933 1
1 973 . 13 1 1 A 81 81 THR N N 81 118.077 118.861 -0.784 1
1 974 . 13 1 1 A 82 82 ALA H H 82 9.586 8.465 1.121 1
1 975 . 13 1 1 A 82 82 ALA HA H 82 4.093 4.335 -0.242 1
1 979 . 13 1 1 A 82 82 ALA C C 82 178.667 177.660 1.007 1
1 980 . 13 1 1 A 82 82 ALA CA C 82 55.321 52.968 2.353 1
1 981 . 13 1 1 A 82 82 ALA CB C 82 18.094 18.153 -0.059 1
1 982 . 13 1 1 A 82 82 ALA N N 82 122.493 123.802 -1.309 1
1 983 . 13 1 1 A 83 83 ASN H H 83 7.923 8.413 -0.490 1
1 984 . 13 1 1 A 83 83 ASN HA H 83 4.808 5.081 -0.273 1
1 989 . 13 1 1 A 83 83 ASN C C 83 174.766 174.486 0.280 1
1 990 . 13 1 1 A 83 83 ASN CA C 83 53.333 54.745 -1.412 1
1 991 . 13 1 1 A 83 83 ASN CB C 83 40.335 41.656 -1.321 1
1 992 . 13 1 1 A 83 83 ASN N N 83 110.765 115.860 -5.095 1
1 994 . 13 1 1 A 84 84 ALA H H 84 7.352 7.041 0.311 1
1 995 . 13 1 1 A 84 84 ALA HA H 84 4.625 4.481 0.144 1
1 999 . 13 1 1 A 84 84 ALA C C 84 176.547 175.071 1.476 1
1 1000 . 13 1 1 A 84 84 ALA CA C 84 52.858 51.767 1.091 1
1 1001 . 13 1 1 A 84 84 ALA CB C 84 21.233 22.097 -0.864 1
1 1002 . 13 1 1 A 84 84 ALA N N 84 119.599 117.549 2.050 1
1 1003 . 13 1 1 A 85 85 THR H H 85 8.374 8.628 -0.254 1
1 1004 . 13 1 1 A 85 85 THR HA H 85 5.014 4.384 0.630 1
1 1009 . 13 1 1 A 85 85 THR C C 85 171.568 173.931 -2.363 1
1 1010 . 13 1 1 A 85 85 THR CA C 85 61.618 62.328 -0.710 1
1 1011 . 13 1 1 A 85 85 THR CB C 85 70.850 69.121 1.729 1
1 1013 . 13 1 1 A 85 85 THR N N 85 119.032 113.838 5.194 1
1 1014 . 13 1 1 A 86 86 TYR H H 86 9.006 8.891 0.115 1
1 1015 . 13 1 1 A 86 86 TYR HA H 86 4.658 5.043 -0.385 1
1 1022 . 13 1 1 A 86 86 TYR C C 86 173.773 175.376 -1.603 1
1 1023 . 13 1 1 A 86 86 TYR CA C 86 56.938 57.947 -1.009 1
1 1024 . 13 1 1 A 86 86 TYR CB C 86 39.513 39.981 -0.468 1
1 1029 . 13 1 1 A 86 86 TYR N N 86 123.494 127.342 -3.848 1
1 1030 . 13 1 1 A 87 87 PHE H H 87 9.263 9.124 0.139 1
1 1031 . 13 1 1 A 87 87 PHE HA H 87 4.127 4.718 -0.591 1
1 1039 . 13 1 1 A 87 87 PHE C C 87 176.369 174.044 2.325 1
1 1040 . 13 1 1 A 87 87 PHE CA C 87 57.238 55.755 1.483 1
1 1041 . 13 1 1 A 87 87 PHE CB C 87 37.086 38.298 -1.212 1
1 1047 . 13 1 1 A 87 87 PHE N N 87 125.384 119.898 5.486 1
1 1048 . 13 1 1 A 88 88 VAL H H 88 9.023 8.325 0.698 1
1 1049 . 13 1 1 A 88 88 VAL HA H 88 4.162 4.563 -0.401 1
1 1057 . 13 1 1 A 88 88 VAL C C 88 176.390 175.888 0.502 1
1 1058 . 13 1 1 A 88 88 VAL CA C 88 63.975 60.585 3.390 1
1 1059 . 13 1 1 A 88 88 VAL CB C 88 32.378 31.776 0.602 1
1 1062 . 13 1 1 A 88 88 VAL N N 88 127.348 124.347 3.001 1
1 1063 . 13 1 1 A 89 89 GLY H H 89 9.233 8.034 1.199 1
1 1064 . 13 1 1 A 89 89 GLY HA2 H 89 4.293 4.082 0.211 1
1 1065 . 13 1 1 A 89 89 GLY HA3 H 89 4.186 4.143 0.043 1
1 1066 . 13 1 1 A 89 89 GLY C C 89 172.378 172.621 -0.243 1
1 1067 . 13 1 1 A 89 89 GLY CA C 89 43.798 46.153 -2.355 1
1 1068 . 13 1 1 A 89 89 GLY N N 89 116.041 112.817 3.224 1
1 1069 . 13 1 1 A 90 90 GLU H H 90 8.532 8.475 0.057 1
1 1070 . 13 1 1 A 90 90 GLU HA H 90 4.794 4.273 0.521 1
1 1075 . 13 1 1 A 90 90 GLU C C 90 174.221 176.236 -2.015 1
1 1076 . 13 1 1 A 90 90 GLU CA C 90 56.393 56.981 -0.588 1
1 1077 . 13 1 1 A 90 90 GLU CB C 90 33.182 30.662 2.520 1
1 1079 . 13 1 1 A 90 90 GLU N N 90 120.905 122.127 -1.222 1
1 1080 . 13 1 1 A 91 91 MET H H 91 8.450 8.738 -0.288 1
1 1081 . 13 1 1 A 91 91 MET HA H 91 4.904 4.888 0.016 1
1 1089 . 13 1 1 A 91 91 MET C C 91 173.373 173.774 -0.401 1
1 1090 . 13 1 1 A 91 91 MET CA C 91 52.277 53.262 -0.985 1
1 1091 . 13 1 1 A 91 91 MET CB C 91 32.789 34.041 -1.252 1
1 1094 . 13 1 1 A 91 91 MET N N 91 125.173 124.172 1.001 1
1 1095 . 13 1 1 A 92 92 PRO HA H 92 4.358 4.519 -0.161 1
1 1102 . 13 1 1 A 92 92 PRO C C 92 177.589 176.640 0.949 1
1 1103 . 13 1 1 A 92 92 PRO CA C 92 63.143 62.515 0.628 1
1 1104 . 13 1 1 A 92 92 PRO CB C 92 32.083 32.266 -0.183 1
1 1107 . 13 1 1 A 93 93 GLY H H 93 8.330 8.309 0.021 1
1 1108 . 13 1 1 A 93 93 GLY HA2 H 93 3.943 3.929 0.014 1
1 1109 . 13 1 1 A 93 93 GLY HA3 H 93 4.045 3.932 0.113 1
1 1110 . 13 1 1 A 93 93 GLY C C 93 174.730 173.441 1.289 1
1 1111 . 13 1 1 A 93 93 GLY CA C 93 45.276 46.218 -0.942 1
1 1112 . 13 1 1 A 93 93 GLY N N 93 109.420 109.242 0.178 1
1 1113 . 13 1 1 A 94 94 GLY H H 94 8.331 8.589 -0.258 1
1 1114 . 13 1 1 A 94 94 GLY HA2 H 94 3.973 4.215 -0.242 1
1 1115 . 13 1 1 A 94 94 GLY HA3 H 94 3.973 4.217 -0.244 1
1 1116 . 13 1 1 A 94 94 GLY C C 94 174.100 173.081 1.019 1
1 1117 . 13 1 1 A 94 94 GLY CA C 94 45.333 43.838 1.495 1
1 1118 . 13 1 1 A 94 94 GLY N N 94 108.483 112.712 -4.229 1
1 1119 . 13 1 1 A 95 95 THR H H 95 8.095 8.548 -0.453 1
1 1120 . 13 1 1 A 95 95 THR HA H 95 4.643 4.784 -0.141 1
1 1125 . 13 1 1 A 95 95 THR C C 95 173.155 173.242 -0.087 1
1 1126 . 13 1 1 A 95 95 THR CA C 95 59.922 60.276 -0.354 1
1 1127 . 13 1 1 A 95 95 THR CB C 95 69.871 69.117 0.754 1
1 1129 . 13 1 1 A 95 95 THR N N 95 115.860 111.936 3.924 1
1 1130 . 13 1 1 A 96 96 PRO HA H 96 4.400 4.271 0.129 1
1 1137 . 13 1 1 A 96 96 PRO C C 96 177.565 176.891 0.674 1
1 1138 . 13 1 1 A 96 96 PRO CA C 96 64.047 63.653 0.394 1
1 1139 . 13 1 1 A 96 96 PRO CB C 96 31.816 31.387 0.429 1
1 1142 . 13 1 1 A 97 97 GLY H H 97 8.572 8.347 0.225 1
1 1143 . 13 1 1 A 97 97 GLY HA2 H 97 4.007 4.175 -0.168 1
1 1144 . 13 1 1 A 97 97 GLY HA3 H 97 4.007 4.186 -0.179 1
1 1145 . 13 1 1 A 97 97 GLY C C 97 174.609 173.295 1.314 1
1 1146 . 13 1 1 A 97 97 GLY CA C 97 45.276 45.407 -0.131 1
1 1147 . 13 1 1 A 97 97 GLY N N 97 110.233 111.059 -0.826 1
1 1148 . 13 1 1 A 98 98 GLY H H 98 8.119 8.331 -0.212 1
1 1149 . 13 1 1 A 98 98 GLY HA2 H 98 4.086 4.179 -0.093 1
1 1150 . 13 1 1 A 98 98 GLY HA3 H 98 4.200 4.205 -0.005 1
1 1151 . 13 1 1 A 98 98 GLY CA C 98 44.876 45.581 -0.705 1
1 1152 . 13 1 1 A 98 98 GLY N N 98 108.845 110.898 -2.053 1
1 1153 . 13 1 1 A 99 99 PRO HA H 99 4.494 4.617 -0.123 1
1 1160 . 13 1 1 A 99 99 PRO C C 99 177.468 176.488 0.980 1
1 1161 . 13 1 1 A 99 99 PRO CA C 99 63.500 63.493 0.007 1
1 1162 . 13 1 1 A 99 99 PRO CB C 99 32.013 32.014 -0.001 1
1 1165 . 13 1 1 A 100 100 SER H H 100 8.472 7.887 0.585 1
1 1166 . 13 1 1 A 100 100 SER HA H 100 4.513 4.579 -0.066 1
1 1169 . 13 1 1 A 100 100 SER C C 100 175.408 174.852 0.556 1
1 1170 . 13 1 1 A 100 100 SER CA C 100 58.557 59.590 -1.033 1
1 1171 . 13 1 1 A 100 100 SER CB C 100 63.918 64.906 -0.988 1
1 1172 . 13 1 1 A 100 100 SER N N 100 116.038 115.961 0.077 1
1 1173 . 13 1 1 A 101 101 GLY H H 101 8.427 8.682 -0.255 1
1 1174 . 13 1 1 A 101 101 GLY HA2 H 101 4.064 3.910 0.154 1
1 1175 . 13 1 1 A 101 101 GLY HA3 H 101 4.064 3.916 0.148 1
1 1176 . 13 1 1 A 101 101 GLY C C 101 174.730 173.783 0.947 1
1 1177 . 13 1 1 A 101 101 GLY CA C 101 45.575 46.937 -1.362 1
1 1178 . 13 1 1 A 101 101 GLY N N 101 110.558 110.899 -0.341 1
1 1179 . 13 1 1 A 102 102 GLN H H 102 8.416 8.412 0.004 1
1 1180 . 13 1 1 A 102 102 GLN HA H 102 4.383 5.137 -0.754 1
1 1187 . 13 1 1 A 102 102 GLN C C 102 177.346 174.839 2.507 1
1 1188 . 13 1 1 A 102 102 GLN CA C 102 57.080 54.322 2.758 1
1 1189 . 13 1 1 A 102 102 GLN CB C 102 29.235 32.551 -3.316 1
1 1191 . 13 1 1 A 102 102 GLN N N 102 120.112 122.750 -2.638 1
1 1193 . 13 1 1 A 103 103 GLY H H 103 8.713 8.370 0.343 1
1 1194 . 13 1 1 A 103 103 GLY HA2 H 103 4.193 4.275 -0.082 1
1 1195 . 13 1 1 A 103 103 GLY HA3 H 103 4.078 4.280 -0.202 1
1 1196 . 13 1 1 A 103 103 GLY C C 103 175.602 173.772 1.830 1
1 1197 . 13 1 1 A 103 103 GLY CA C 103 46.120 45.371 0.749 1
1 1198 . 13 1 1 A 103 103 GLY N N 103 109.817 108.745 1.072 1
1 1199 . 13 1 1 A 104 104 ALA H H 104 8.366 8.526 -0.160 1
1 1200 . 13 1 1 A 104 104 ALA HA H 104 4.449 4.294 0.155 1
1 1204 . 13 1 1 A 104 104 ALA C C 104 179.188 179.586 -0.398 1
1 1205 . 13 1 1 A 104 104 ALA CA C 104 54.230 54.366 -0.136 1
1 1206 . 13 1 1 A 104 104 ALA CB C 104 19.080 19.277 -0.197 1
1 1207 . 13 1 1 A 104 104 ALA N N 104 124.808 126.113 -1.305 1
1 1208 . 13 1 1 A 105 105 GLU H H 105 8.576 8.217 0.359 1
1 1209 . 13 1 1 A 105 105 GLU HA H 105 4.161 4.100 0.061 1
1 1214 . 13 1 1 A 105 105 GLU C C 105 179.200 178.854 0.346 1
1 1215 . 13 1 1 A 105 105 GLU CA C 105 59.173 59.033 0.140 1
1 1216 . 13 1 1 A 105 105 GLU CB C 105 29.194 29.439 -0.245 1
1 1218 . 13 1 1 A 105 105 GLU N N 105 119.238 116.906 2.332 1
1 1219 . 13 1 1 A 106 106 ALA H H 106 8.381 8.204 0.177 1
1 1220 . 13 1 1 A 106 106 ALA HA H 106 4.283 4.174 0.109 1
1 1224 . 13 1 1 A 106 106 ALA C C 106 180.048 179.644 0.404 1
1 1225 . 13 1 1 A 106 106 ALA CA C 106 54.687 55.072 -0.385 1
1 1226 . 13 1 1 A 106 106 ALA CB C 106 18.341 18.540 -0.199 1
1 1227 . 13 1 1 A 106 106 ALA N N 106 123.327 121.425 1.902 1
1 1228 . 13 1 1 A 107 107 ALA H H 107 8.123 7.838 0.285 1
1 1229 . 13 1 1 A 107 107 ALA HA H 107 4.554 4.485 0.069 1
1 1233 . 13 1 1 A 107 107 ALA C C 107 179.757 179.661 0.096 1
1 1234 . 13 1 1 A 107 107 ALA CA C 107 55.355 55.186 0.169 1
1 1235 . 13 1 1 A 107 107 ALA CB C 107 18.939 19.174 -0.235 1
1 1236 . 13 1 1 A 107 107 ALA N N 107 120.740 119.831 0.909 1
1 1237 . 13 1 1 A 108 108 ARG H H 108 8.403 8.370 0.033 1
1 1238 . 13 1 1 A 108 108 ARG HA H 108 4.254 4.159 0.095 1
1 1245 . 13 1 1 A 108 108 ARG C C 108 179.111 178.484 0.627 1
1 1246 . 13 1 1 A 108 108 ARG CA C 108 59.015 58.370 0.645 1
1 1247 . 13 1 1 A 108 108 ARG CB C 108 29.752 29.725 0.027 1
1 1250 . 13 1 1 A 108 108 ARG N N 108 119.531 116.999 2.532 1
1 1251 . 13 1 1 A 109 109 GLY H H 109 8.182 8.171 0.011 1
1 1252 . 13 1 1 A 109 109 GLY HA2 H 109 3.822 3.612 0.210 1
1 1253 . 13 1 1 A 109 109 GLY HA3 H 109 3.822 3.628 0.194 1
1 1254 . 13 1 1 A 109 109 GLY C C 109 177.020 176.636 0.384 1
1 1255 . 13 1 1 A 109 109 GLY CA C 109 46.718 47.281 -0.563 1
1 1256 . 13 1 1 A 109 109 GLY N N 109 107.331 108.279 -0.948 1
1 1257 . 13 1 1 A 110 110 TRP H H 110 7.925 8.034 -0.109 1
1 1258 . 13 1 1 A 110 110 TRP HA H 110 3.963 4.517 -0.554 1
1 1267 . 13 1 1 A 110 110 TRP C C 110 176.691 177.855 -1.164 1
1 1268 . 13 1 1 A 110 110 TRP CA C 110 62.041 60.667 1.374 1
1 1269 . 13 1 1 A 110 110 TRP CB C 110 28.989 28.456 0.533 1
1 1275 . 13 1 1 A 110 110 TRP N N 110 122.304 121.712 0.592 1
1 1277 . 13 1 1 A 111 111 GLU H H 111 7.946 7.540 0.406 1
1 1278 . 13 1 1 A 111 111 GLU HA H 111 2.594 3.107 -0.513 1
1 1283 . 13 1 1 A 111 111 GLU C C 111 177.976 179.082 -1.106 1
1 1284 . 13 1 1 A 111 111 GLU CA C 111 60.193 58.995 1.198 1
1 1285 . 13 1 1 A 111 111 GLU CB C 111 29.277 29.347 -0.070 1
1 1287 . 13 1 1 A 111 111 GLU N N 111 121.755 118.996 2.759 1
1 1288 . 13 1 1 A 112 112 THR H H 112 7.993 7.499 0.494 1
1 1289 . 13 1 1 A 112 112 THR HA H 112 3.722 3.836 -0.114 1
1 1294 . 13 1 1 A 112 112 THR C C 112 176.038 175.837 0.201 1
1 1295 . 13 1 1 A 112 112 THR CA C 112 66.104 66.455 -0.351 1
1 1296 . 13 1 1 A 112 112 THR CB C 112 68.885 68.715 0.170 1
1 1298 . 13 1 1 A 112 112 THR N N 112 112.247 116.467 -4.220 1
1 1299 . 13 1 1 A 113 113 ALA H H 113 7.742 8.221 -0.479 1
1 1300 . 13 1 1 A 113 113 ALA HA H 113 4.029 3.960 0.069 1
1 1304 . 13 1 1 A 113 113 ALA C C 113 180.545 179.838 0.707 1
1 1305 . 13 1 1 A 113 113 ALA CA C 113 55.127 55.167 -0.040 1
1 1306 . 13 1 1 A 113 113 ALA CB C 113 18.854 18.340 0.514 1
1 1307 . 13 1 1 A 113 113 ALA N N 113 123.134 122.793 0.341 1
1 1308 . 13 1 1 A 114 114 ILE H H 114 8.472 8.507 -0.035 1
1 1309 . 13 1 1 A 114 114 ILE HA H 114 3.613 3.720 -0.107 1
1 1319 . 13 1 1 A 114 114 ILE C C 114 176.947 178.039 -1.092 1
1 1320 . 13 1 1 A 114 114 ILE CA C 114 66.016 65.197 0.819 1
1 1321 . 13 1 1 A 114 114 ILE CB C 114 38.335 37.959 0.376 1
1 1325 . 13 1 1 A 114 114 ILE N N 114 118.276 117.626 0.650 1
1 1326 . 13 1 1 A 115 115 ARG H H 115 8.181 7.915 0.266 1
1 1327 . 13 1 1 A 115 115 ARG HA H 115 3.835 3.905 -0.070 1
1 1334 . 13 1 1 A 115 115 ARG C C 115 179.588 179.208 0.380 1
1 1335 . 13 1 1 A 115 115 ARG CA C 115 61.072 60.069 1.003 1
1 1336 . 13 1 1 A 115 115 ARG CB C 115 29.975 29.910 0.065 1
1 1339 . 13 1 1 A 115 115 ARG N N 115 117.921 119.355 -1.434 1
1 1340 . 13 1 1 A 116 116 GLN H H 116 8.395 8.459 -0.064 1
1 1341 . 13 1 1 A 116 116 GLN HA H 116 4.030 4.053 -0.023 1
1 1348 . 13 1 1 A 116 116 GLN C C 116 178.716 179.078 -0.362 1
1 1349 . 13 1 1 A 116 116 GLN CA C 116 58.790 58.871 -0.081 1
1 1350 . 13 1 1 A 116 116 GLN CB C 116 28.248 28.458 -0.210 1
1 1352 . 13 1 1 A 116 116 GLN N N 116 116.842 118.880 -2.038 1
1 1354 . 13 1 1 A 117 117 ALA H H 117 7.902 8.147 -0.245 1
1 1355 . 13 1 1 A 117 117 ALA HA H 117 4.143 4.124 0.019 1
1 1359 . 13 1 1 A 117 117 ALA C C 117 179.685 180.181 -0.496 1
1 1360 . 13 1 1 A 117 117 ALA CA C 117 54.476 54.954 -0.478 1
1 1361 . 13 1 1 A 117 117 ALA CB C 117 18.300 18.377 -0.077 1
1 1362 . 13 1 1 A 117 117 ALA N N 117 122.828 122.681 0.147 1
1 1363 . 13 1 1 A 118 118 LEU H H 118 7.904 8.134 -0.230 1
1 1364 . 13 1 1 A 118 118 LEU HA H 118 4.119 4.101 0.018 1
1 1374 . 13 1 1 A 118 118 LEU C C 118 178.437 178.677 -0.240 1
1 1375 . 13 1 1 A 118 118 LEU CA C 118 56.781 57.186 -0.405 1
1 1376 . 13 1 1 A 118 118 LEU CB C 118 42.371 41.760 0.611 1
1 1380 . 13 1 1 A 118 118 LEU N N 118 117.632 120.272 -2.640 1
1 1381 . 13 1 1 A 119 119 MET H H 119 7.673 7.964 -0.291 1
1 1382 . 13 1 1 A 119 119 MET HA H 119 4.442 4.176 0.266 1
1 1390 . 13 1 1 A 119 119 MET C C 119 176.680 178.163 -1.483 1
1 1391 . 13 1 1 A 119 119 MET CA C 119 56.432 58.335 -1.903 1
1 1392 . 13 1 1 A 119 119 MET CB C 119 32.769 32.105 0.664 1
1 1395 . 13 1 1 A 119 119 MET N N 119 117.286 117.566 -0.280 1
1 1396 . 13 1 1 A 120 120 SER H H 120 7.878 7.487 0.391 1
1 1397 . 13 1 1 A 120 120 SER HA H 120 4.500 4.346 0.154 1
1 1400 . 13 1 1 A 120 120 SER C C 120 174.742 175.503 -0.761 1
1 1401 . 13 1 1 A 120 120 SER CA C 120 58.962 61.178 -2.216 1
1 1402 . 13 1 1 A 120 120 SER CB C 120 63.853 62.691 1.162 1
1 1403 . 13 1 1 A 120 120 SER N N 120 115.064 114.854 0.210 1
1 1404 . 13 1 1 A 121 121 GLY H H 121 8.059 7.669 0.390 1
1 1405 . 13 1 1 A 121 121 GLY HA2 H 121 4.231 4.074 0.157 1
1 1406 . 13 1 1 A 121 121 GLY HA3 H 121 4.112 4.075 0.037 1
1 1407 . 13 1 1 A 121 121 GLY C C 121 172.065 173.040 -0.975 1
1 1408 . 13 1 1 A 121 121 GLY CA C 121 45.030 44.423 0.607 1
1 1409 . 13 1 1 A 121 121 GLY N N 121 110.271 109.288 0.983 1
1 1410 . 13 1 1 A 122 122 PRO HA H 122 4.496 4.654 -0.158 1
1 1417 . 13 1 1 A 122 122 PRO CA C 122 63.399 62.611 0.788 1
1 1418 . 13 1 1 A 122 122 PRO CB C 122 32.186 31.035 1.151 1
1 1 . 14 1 1 A 6 6 SER H H 6 8.337 9.062 -0.725 1
1 2 . 14 1 1 A 6 6 SER HA H 6 4.597 5.079 -0.482 1
1 5 . 14 1 1 A 6 6 SER C C 6 174.637 174.636 0.001 1
1 6 . 14 1 1 A 6 6 SER CA C 6 58.469 56.884 1.585 1
1 7 . 14 1 1 A 6 6 SER CB C 6 64.221 64.630 -0.409 1
1 8 . 14 1 1 A 6 6 SER N N 6 117.887 123.683 -5.796 1
1 9 . 14 1 1 A 7 7 GLY H H 7 8.280 8.405 -0.125 1
1 10 . 14 1 1 A 7 7 GLY HA2 H 7 4.063 4.127 -0.064 1
1 11 . 14 1 1 A 7 7 GLY HA3 H 7 4.063 4.129 -0.066 1
1 12 . 14 1 1 A 7 7 GLY C C 7 173.724 173.441 0.283 1
1 13 . 14 1 1 A 7 7 GLY CA C 7 44.941 44.179 0.762 1
1 14 . 14 1 1 A 7 7 GLY N N 7 110.151 112.574 -2.423 1
1 15 . 14 1 1 A 8 8 THR H H 8 8.212 8.539 -0.327 1
1 16 . 14 1 1 A 8 8 THR HA H 8 4.173 4.347 -0.174 1
1 21 . 14 1 1 A 8 8 THR C C 8 174.723 174.125 0.598 1
1 22 . 14 1 1 A 8 8 THR CA C 8 63.622 63.608 0.014 1
1 23 . 14 1 1 A 8 8 THR CB C 8 69.460 68.773 0.687 1
1 25 . 14 1 1 A 8 8 THR N N 8 116.817 115.700 1.117 1
1 26 . 14 1 1 A 9 9 LEU H H 9 9.374 9.442 -0.068 1
1 27 . 14 1 1 A 9 9 LEU HA H 9 4.302 4.352 -0.050 1
1 37 . 14 1 1 A 9 9 LEU C C 9 177.468 176.700 0.768 1
1 38 . 14 1 1 A 9 9 LEU CA C 9 55.936 55.973 -0.037 1
1 39 . 14 1 1 A 9 9 LEU CB C 9 42.843 42.736 0.107 1
1 43 . 14 1 1 A 9 9 LEU N N 9 127.798 128.822 -1.024 1
1 44 . 14 1 1 A 10 10 ARG H H 10 7.512 7.632 -0.120 1
1 45 . 14 1 1 A 10 10 ARG HA H 10 4.199 4.728 -0.529 1
1 52 . 14 1 1 A 10 10 ARG C C 10 172.501 174.020 -1.519 1
1 53 . 14 1 1 A 10 10 ARG CA C 10 56.165 54.532 1.633 1
1 54 . 14 1 1 A 10 10 ARG CB C 10 32.442 33.546 -1.104 1
1 57 . 14 1 1 A 10 10 ARG N N 10 117.979 117.484 0.495 1
1 58 . 14 1 1 A 11 11 GLU H H 11 8.434 8.751 -0.317 1
1 59 . 14 1 1 A 11 11 GLU HA H 11 5.993 5.471 0.522 1
1 64 . 14 1 1 A 11 11 GLU C C 11 174.800 174.612 0.188 1
1 65 . 14 1 1 A 11 11 GLU CA C 11 54.570 54.996 -0.426 1
1 66 . 14 1 1 A 11 11 GLU CB C 11 34.245 33.103 1.142 1
1 68 . 14 1 1 A 11 11 GLU N N 11 120.782 122.097 -1.315 1
1 69 . 14 1 1 A 12 12 GLY H H 12 8.131 7.802 0.329 1
1 70 . 14 1 1 A 12 12 GLY HA2 H 12 4.714 4.134 0.580 1
1 71 . 14 1 1 A 12 12 GLY HA3 H 12 3.763 4.320 -0.557 1
1 72 . 14 1 1 A 12 12 GLY C C 12 171.060 172.104 -1.044 1
1 73 . 14 1 1 A 12 12 GLY CA C 12 45.241 45.586 -0.345 1
1 74 . 14 1 1 A 12 12 GLY N N 12 107.457 106.492 0.965 1
1 75 . 14 1 1 A 13 13 TRP H H 13 8.783 8.930 -0.147 1
1 76 . 14 1 1 A 13 13 TRP HA H 13 5.152 5.062 0.090 1
1 85 . 14 1 1 A 13 13 TRP C C 13 177.528 176.773 0.755 1
1 86 . 14 1 1 A 13 13 TRP CA C 13 57.783 58.941 -1.158 1
1 87 . 14 1 1 A 13 13 TRP CB C 13 30.222 30.150 0.072 1
1 93 . 14 1 1 A 13 13 TRP N N 13 120.792 121.901 -1.109 1
1 95 . 14 1 1 A 14 14 VAL H H 14 9.179 9.256 -0.077 1
1 96 . 14 1 1 A 14 14 VAL HA H 14 4.072 4.603 -0.531 1
1 104 . 14 1 1 A 14 14 VAL C C 14 174.981 173.394 1.587 1
1 105 . 14 1 1 A 14 14 VAL CA C 14 61.741 60.377 1.364 1
1 106 . 14 1 1 A 14 14 VAL CB C 14 35.143 35.039 0.104 1
1 109 . 14 1 1 A 14 14 VAL N N 14 125.476 123.193 2.283 1
1 110 . 14 1 1 A 15 15 VAL H H 15 8.403 8.752 -0.349 1
1 111 . 14 1 1 A 15 15 VAL HA H 15 5.532 5.288 0.244 1
1 119 . 14 1 1 A 15 15 VAL C C 15 175.078 174.299 0.779 1
1 120 . 14 1 1 A 15 15 VAL CA C 15 59.489 59.718 -0.229 1
1 121 . 14 1 1 A 15 15 VAL CB C 15 34.210 34.676 -0.466 1
1 124 . 14 1 1 A 15 15 VAL N N 15 126.189 126.898 -0.709 1
1 125 . 14 1 1 A 16 16 HIS H H 16 9.122 8.526 0.596 1
1 126 . 14 1 1 A 16 16 HIS HA H 16 5.823 5.650 0.173 1
1 131 . 14 1 1 A 16 16 HIS C C 16 172.998 172.708 0.290 1
1 132 . 14 1 1 A 16 16 HIS CA C 16 56.253 54.132 2.121 1
1 133 . 14 1 1 A 16 16 HIS CB C 16 34.273 32.446 1.827 1
1 136 . 14 1 1 A 16 16 HIS N N 16 121.152 120.363 0.789 1
1 137 . 14 1 1 A 17 17 TYR H H 17 8.465 8.614 -0.149 1
1 138 . 14 1 1 A 17 17 TYR HA H 17 5.096 4.641 0.455 1
1 145 . 14 1 1 A 17 17 TYR C C 17 173.640 173.183 0.457 1
1 146 . 14 1 1 A 17 17 TYR CA C 17 56.903 56.591 0.312 1
1 147 . 14 1 1 A 17 17 TYR CB C 17 40.103 40.557 -0.454 1
1 152 . 14 1 1 A 17 17 TYR N N 17 115.558 116.462 -0.904 1
1 153 . 14 1 1 A 18 18 SER H H 18 9.122 8.517 0.605 1
1 154 . 14 1 1 A 18 18 SER HA H 18 6.144 5.291 0.853 1
1 157 . 14 1 1 A 18 18 SER C C 18 173.204 175.400 -2.196 1
1 158 . 14 1 1 A 18 18 SER CA C 18 56.640 56.955 -0.315 1
1 159 . 14 1 1 A 18 18 SER CB C 18 68.788 66.298 2.490 1
1 160 . 14 1 1 A 18 18 SER N N 18 118.846 116.031 2.815 1
1 161 . 14 1 1 A 19 19 ASN H H 19 9.053 8.695 0.358 1
1 162 . 14 1 1 A 19 19 ASN HA H 19 4.473 4.986 -0.513 1
1 167 . 14 1 1 A 19 19 ASN C C 19 175.396 175.931 -0.535 1
1 168 . 14 1 1 A 19 19 ASN CA C 19 55.373 52.103 3.270 1
1 169 . 14 1 1 A 19 19 ASN CB C 19 36.900 38.003 -1.103 1
1 170 . 14 1 1 A 19 19 ASN N N 19 113.712 117.670 -3.958 1
1 172 . 14 1 1 A 20 20 LYS H H 20 7.677 8.071 -0.394 1
1 173 . 14 1 1 A 20 20 LYS HA H 20 4.413 4.612 -0.199 1
1 182 . 14 1 1 A 20 20 LYS C C 20 176.078 176.883 -0.805 1
1 183 . 14 1 1 A 20 20 LYS CA C 20 55.679 56.857 -1.178 1
1 184 . 14 1 1 A 20 20 LYS CB C 20 33.023 34.479 -1.456 1
1 188 . 14 1 1 A 20 20 LYS N N 20 117.213 116.804 0.409 1
1 189 . 14 1 1 A 21 21 ASP H H 21 7.395 7.877 -0.482 1
1 190 . 14 1 1 A 21 21 ASP HA H 21 4.808 4.750 0.058 1
1 193 . 14 1 1 A 21 21 ASP C C 21 176.413 176.277 0.136 1
1 194 . 14 1 1 A 21 21 ASP CA C 21 53.983 53.942 0.041 1
1 195 . 14 1 1 A 21 21 ASP CB C 21 41.199 42.941 -1.742 1
1 196 . 14 1 1 A 21 21 ASP N N 21 119.879 117.624 2.255 1
1 197 . 14 1 1 A 22 22 THR H H 22 8.593 8.072 0.521 1
1 198 . 14 1 1 A 22 22 THR HA H 22 4.352 4.148 0.204 1
1 203 . 14 1 1 A 22 22 THR C C 22 172.913 174.837 -1.924 1
1 204 . 14 1 1 A 22 22 THR CA C 22 62.691 62.965 -0.274 1
1 205 . 14 1 1 A 22 22 THR CB C 22 68.332 66.473 1.859 1
1 207 . 14 1 1 A 22 22 THR N N 22 116.299 112.898 3.401 1
1 208 . 14 1 1 A 23 23 LEU H H 23 7.645 7.903 -0.258 1
1 209 . 14 1 1 A 23 23 LEU HA H 23 4.318 4.357 -0.039 1
1 219 . 14 1 1 A 23 23 LEU C C 23 176.692 176.702 -0.010 1
1 220 . 14 1 1 A 23 23 LEU CA C 23 54.617 54.003 0.614 1
1 221 . 14 1 1 A 23 23 LEU CB C 23 41.939 41.375 0.564 1
1 225 . 14 1 1 A 23 23 LEU N N 23 123.606 121.097 2.509 1
1 226 . 14 1 1 A 24 24 ARG H H 24 8.563 7.560 1.003 1
1 227 . 14 1 1 A 24 24 ARG HA H 24 4.373 4.536 -0.163 1
1 235 . 14 1 1 A 24 24 ARG C C 24 176.584 176.371 0.213 1
1 236 . 14 1 1 A 24 24 ARG CA C 24 57.854 56.916 0.938 1
1 237 . 14 1 1 A 24 24 ARG CB C 24 31.126 30.466 0.660 1
1 240 . 14 1 1 A 24 24 ARG N N 24 127.152 124.057 3.095 1
1 242 . 14 1 1 A 25 25 LYS H H 25 8.633 8.515 0.118 1
1 243 . 14 1 1 A 25 25 LYS HA H 25 4.513 4.954 -0.441 1
1 251 . 14 1 1 A 25 25 LYS C C 25 173.567 174.207 -0.640 1
1 252 . 14 1 1 A 25 25 LYS CA C 25 54.792 54.526 0.266 1
1 253 . 14 1 1 A 25 25 LYS CB C 25 37.416 35.709 1.707 1
1 257 . 14 1 1 A 25 25 LYS N N 25 122.682 121.194 1.488 1
1 258 . 14 1 1 A 26 26 ARG H H 26 8.303 8.997 -0.694 1
1 259 . 14 1 1 A 26 26 ARG HA H 26 5.153 5.207 -0.054 1
1 266 . 14 1 1 A 26 26 ARG C C 26 174.554 175.150 -0.596 1
1 267 . 14 1 1 A 26 26 ARG CA C 26 55.083 54.690 0.393 1
1 268 . 14 1 1 A 26 26 ARG CB C 26 32.789 31.967 0.822 1
1 271 . 14 1 1 A 26 26 ARG N N 26 121.819 124.419 -2.600 1
1 272 . 14 1 1 A 27 27 HIS H H 27 8.793 9.028 -0.235 1
1 273 . 14 1 1 A 27 27 HIS HA H 27 5.155 5.116 0.039 1
1 278 . 14 1 1 A 27 27 HIS CA C 27 56.904 54.858 2.046 1
1 279 . 14 1 1 A 27 27 HIS CB C 27 34.683 34.071 0.612 1
1 282 . 14 1 1 A 27 27 HIS N N 27 122.102 124.656 -2.554 1
1 283 . 14 1 1 A 28 28 TYR H H 28 9.273 8.162 1.111 1
1 284 . 14 1 1 A 28 28 TYR HA H 28 4.332 4.264 0.068 1
1 291 . 14 1 1 A 28 28 TYR C C 28 174.730 174.680 0.050 1
1 292 . 14 1 1 A 28 28 TYR CA C 28 58.680 56.290 2.390 1
1 293 . 14 1 1 A 28 28 TYR CB C 28 38.673 36.957 1.716 1
1 298 . 14 1 1 A 28 28 TYR N N 28 125.605 124.059 1.546 1
1 299 . 14 1 1 A 29 29 TRP H H 29 9.273 9.108 0.165 1
1 300 . 14 1 1 A 29 29 TRP HA H 29 5.543 4.605 0.938 1
1 309 . 14 1 1 A 29 29 TRP C C 29 176.172 176.772 -0.600 1
1 310 . 14 1 1 A 29 29 TRP CA C 29 56.658 58.543 -1.885 1
1 311 . 14 1 1 A 29 29 TRP CB C 29 32.154 29.854 2.300 1
1 317 . 14 1 1 A 29 29 TRP N N 29 131.340 127.441 3.899 1
1 318 . 14 1 1 A 30 30 ARG H H 30 9.164 9.378 -0.214 1
1 319 . 14 1 1 A 30 30 ARG HA H 30 5.302 5.212 0.090 1
1 327 . 14 1 1 A 30 30 ARG C C 30 174.774 174.347 0.427 1
1 328 . 14 1 1 A 30 30 ARG CA C 30 56.271 55.015 1.256 1
1 329 . 14 1 1 A 30 30 ARG CB C 30 34.203 32.558 1.645 1
1 332 . 14 1 1 A 30 30 ARG N N 30 116.040 123.705 -7.665 1
1 334 . 14 1 1 A 31 31 LEU H H 31 9.273 9.247 0.026 1
1 335 . 14 1 1 A 31 31 LEU HA H 31 5.324 5.328 -0.004 1
1 345 . 14 1 1 A 31 31 LEU C C 31 174.488 174.638 -0.150 1
1 346 . 14 1 1 A 31 31 LEU CA C 31 53.807 53.487 0.320 1
1 347 . 14 1 1 A 31 31 LEU CB C 31 46.667 45.352 1.315 1
1 351 . 14 1 1 A 31 31 LEU N N 31 127.075 127.466 -0.391 1
1 352 . 14 1 1 A 32 32 ASP H H 32 8.854 8.828 0.026 1
1 353 . 14 1 1 A 32 32 ASP HA H 32 4.902 5.110 -0.208 1
1 356 . 14 1 1 A 32 32 ASP C C 32 173.474 176.878 -3.404 1
1 357 . 14 1 1 A 32 32 ASP CA C 32 53.104 52.195 0.909 1
1 358 . 14 1 1 A 32 32 ASP CB C 32 42.931 44.068 -1.137 1
1 359 . 14 1 1 A 32 32 ASP N N 32 129.349 125.740 3.609 1
1 360 . 14 1 1 A 33 33 CYS H H 33 8.153 8.771 -0.618 1
1 361 . 14 1 1 A 33 33 CYS HA H 33 4.323 4.554 -0.231 1
1 364 . 14 1 1 A 33 33 CYS C C 33 174.476 175.641 -1.165 1
1 365 . 14 1 1 A 33 33 CYS CA C 33 59.853 59.474 0.379 1
1 366 . 14 1 1 A 33 33 CYS CB C 33 27.508 27.872 -0.364 1
1 367 . 14 1 1 A 33 33 CYS N N 33 108.439 119.665 -11.226 1
1 368 . 14 1 1 A 34 34 LYS H H 34 9.144 7.744 1.400 1
1 369 . 14 1 1 A 34 34 LYS HA H 34 4.616 4.451 0.165 1
1 378 . 14 1 1 A 34 34 LYS C C 34 177.601 176.340 1.261 1
1 379 . 14 1 1 A 34 34 LYS CA C 34 57.185 56.895 0.290 1
1 380 . 14 1 1 A 34 34 LYS CB C 34 35.623 35.165 0.458 1
1 384 . 14 1 1 A 34 34 LYS N N 34 119.884 119.760 0.124 1
1 385 . 14 1 1 A 35 35 CYS H H 35 9.102 7.740 1.362 1
1 386 . 14 1 1 A 35 35 CYS HA H 35 4.935 4.806 0.129 1
1 389 . 14 1 1 A 35 35 CYS C C 35 172.283 172.305 -0.022 1
1 390 . 14 1 1 A 35 35 CYS CA C 35 57.748 56.755 0.993 1
1 391 . 14 1 1 A 35 35 CYS CB C 35 31.537 30.709 0.828 1
1 392 . 14 1 1 A 35 35 CYS N N 35 120.317 113.941 6.376 1
1 393 . 14 1 1 A 36 36 ILE H H 36 8.213 8.944 -0.731 1
1 394 . 14 1 1 A 36 36 ILE HA H 36 4.617 4.876 -0.259 1
1 404 . 14 1 1 A 36 36 ILE C C 36 175.312 174.906 0.406 1
1 405 . 14 1 1 A 36 36 ILE CA C 36 60.967 60.501 0.466 1
1 406 . 14 1 1 A 36 36 ILE CB C 36 39.718 38.664 1.054 1
1 410 . 14 1 1 A 36 36 ILE N N 36 121.905 120.280 1.625 1
1 411 . 14 1 1 A 37 37 THR H H 37 9.076 8.974 0.102 1
1 412 . 14 1 1 A 37 37 THR HA H 37 4.364 4.596 -0.232 1
1 417 . 14 1 1 A 37 37 THR CA C 37 61.834 61.895 -0.061 1
1 418 . 14 1 1 A 37 37 THR CB C 37 69.237 70.233 -0.996 1
1 420 . 14 1 1 A 37 37 THR N N 37 122.500 123.229 -0.729 1
1 421 . 14 1 1 A 38 38 LEU H H 38 8.263 8.834 -0.571 1
1 422 . 14 1 1 A 38 38 LEU HA H 38 4.445 5.061 -0.616 1
1 432 . 14 1 1 A 38 38 LEU CA C 38 55.611 52.916 2.695 1
1 433 . 14 1 1 A 38 38 LEU CB C 38 42.702 45.072 -2.370 1
1 437 . 14 1 1 A 38 38 LEU N N 38 126.987 124.532 2.455 1
1 438 . 14 1 1 A 39 39 PHE H H 39 9.520 8.679 0.841 1
1 439 . 14 1 1 A 39 39 PHE HA H 39 4.998 5.014 -0.016 1
1 447 . 14 1 1 A 39 39 PHE CA C 39 57.331 56.330 1.001 1
1 448 . 14 1 1 A 39 39 PHE CB C 39 42.453 41.000 1.453 1
1 454 . 14 1 1 A 39 39 PHE N N 39 120.545 119.705 0.840 1
1 455 . 14 1 1 A 40 40 GLN H H 40 9.878 8.864 1.014 1
1 456 . 14 1 1 A 40 40 GLN HA H 40 4.376 3.581 0.795 1
1 463 . 14 1 1 A 40 40 GLN CA C 40 59.513 59.259 0.254 1
1 464 . 14 1 1 A 40 40 GLN CB C 40 29.317 28.959 0.358 1
1 467 . 14 1 1 A 41 41 ASN H H 41 7.732 7.945 -0.213 1
1 468 . 14 1 1 A 41 41 ASN HA H 41 4.812 5.350 -0.538 1
1 473 . 14 1 1 A 41 41 ASN CA C 41 52.618 51.376 1.242 1
1 474 . 14 1 1 A 41 41 ASN CB C 41 39.362 41.436 -2.074 1
1 475 . 14 1 1 A 41 41 ASN N N 41 107.613 112.444 -4.831 1
1 477 . 14 1 1 A 42 42 ASN HA H 42 3.476 4.247 -0.771 1
1 482 . 14 1 1 A 42 42 ASN C C 42 173.607 175.727 -2.120 1
1 483 . 14 1 1 A 42 42 ASN CA C 42 54.888 55.524 -0.636 1
1 484 . 14 1 1 A 42 42 ASN CB C 42 35.613 37.572 -1.959 1
1 486 . 14 1 1 A 43 43 THR H H 43 8.394 7.656 0.738 1
1 487 . 14 1 1 A 43 43 THR HA H 43 4.403 4.577 -0.174 1
1 492 . 14 1 1 A 43 43 THR C C 43 174.464 173.446 1.018 1
1 493 . 14 1 1 A 43 43 THR CA C 43 61.978 60.932 1.046 1
1 494 . 14 1 1 A 43 43 THR CB C 43 70.036 68.561 1.475 1
1 496 . 14 1 1 A 43 43 THR N N 43 111.795 107.129 4.666 1
1 497 . 14 1 1 A 44 44 THR H H 44 8.058 7.294 0.764 1
1 498 . 14 1 1 A 44 44 THR HA H 44 4.464 4.849 -0.385 1
1 503 . 14 1 1 A 44 44 THR CA C 44 61.599 59.588 2.011 1
1 504 . 14 1 1 A 44 44 THR CB C 44 69.137 71.031 -1.894 1
1 506 . 14 1 1 A 44 44 THR N N 44 116.514 115.537 0.977 1
1 507 . 14 1 1 A 45 45 ASN H H 45 6.653 8.656 -2.003 1
1 508 . 14 1 1 A 45 45 ASN HA H 45 4.945 4.993 -0.048 1
1 513 . 14 1 1 A 45 45 ASN CA C 45 53.227 55.169 -1.942 1
1 514 . 14 1 1 A 45 45 ASN CB C 45 38.483 40.086 -1.603 1
1 516 . 14 1 1 A 46 46 ARG H H 46 8.213 7.795 0.418 1
1 517 . 14 1 1 A 46 46 ARG HA H 46 4.583 4.732 -0.149 1
1 524 . 14 1 1 A 46 46 ARG CA C 46 55.487 55.051 0.436 1
1 525 . 14 1 1 A 46 46 ARG CB C 46 31.153 31.642 -0.489 1
1 528 . 14 1 1 A 46 46 ARG N N 46 121.652 117.674 3.978 1
1 529 . 14 1 1 A 47 47 TYR H H 47 7.973 8.866 -0.893 1
1 536 . 14 1 1 A 47 47 TYR CB C 47 39.356 39.405 -0.049 1
1 541 . 14 1 1 A 48 48 TYR H H 48 9.023 8.701 0.322 1
1 542 . 14 1 1 A 48 48 TYR HA H 48 4.662 4.351 0.311 1
1 549 . 14 1 1 A 48 48 TYR CB C 48 39.863 40.741 -0.878 1
1 554 . 14 1 1 A 48 48 TYR N N 48 121.223 120.314 0.909 1
1 555 . 14 1 1 A 49 49 LYS H H 49 7.134 7.829 -0.695 1
1 556 . 14 1 1 A 49 49 LYS HA H 49 4.283 4.685 -0.402 1
1 565 . 14 1 1 A 49 49 LYS CA C 49 55.167 55.007 0.160 1
1 566 . 14 1 1 A 49 49 LYS CB C 49 36.699 36.203 0.496 1
1 570 . 14 1 1 A 49 49 LYS N N 49 117.339 118.500 -1.161 1
1 571 . 14 1 1 A 50 50 GLU H H 50 8.411 8.961 -0.550 1
1 572 . 14 1 1 A 50 50 GLU HA H 50 4.583 5.078 -0.495 1
1 577 . 14 1 1 A 50 50 GLU CA C 50 54.592 54.994 -0.402 1
1 578 . 14 1 1 A 50 50 GLU CB C 50 33.263 32.799 0.464 1
1 580 . 14 1 1 A 50 50 GLU N N 50 123.825 124.679 -0.854 1
1 581 . 14 1 1 A 51 51 ILE H H 51 9.225 9.093 0.132 1
1 582 . 14 1 1 A 51 51 ILE HA H 51 4.277 4.645 -0.368 1
1 592 . 14 1 1 A 51 51 ILE CA C 51 58.182 58.134 0.048 1
1 593 . 14 1 1 A 51 51 ILE CB C 51 39.663 38.299 1.364 1
1 597 . 14 1 1 A 51 51 ILE N N 51 125.271 126.942 -1.671 1
1 598 . 14 1 1 A 52 52 PRO HA H 52 4.543 4.602 -0.059 1
1 605 . 14 1 1 A 52 52 PRO C C 52 178.340 178.077 0.263 1
1 606 . 14 1 1 A 52 52 PRO CA C 52 62.726 62.879 -0.153 1
1 607 . 14 1 1 A 52 52 PRO CB C 52 32.003 31.713 0.290 1
1 610 . 14 1 1 A 53 53 LEU H H 53 8.723 8.509 0.214 1
1 611 . 14 1 1 A 53 53 LEU HA H 53 3.891 3.868 0.023 1
1 621 . 14 1 1 A 53 53 LEU C C 53 179.673 179.068 0.605 1
1 622 . 14 1 1 A 53 53 LEU CA C 53 58.205 57.449 0.756 1
1 623 . 14 1 1 A 53 53 LEU CB C 53 40.171 41.258 -1.087 1
1 627 . 14 1 1 A 53 53 LEU N N 53 125.150 124.333 0.817 1
1 628 . 14 1 1 A 54 54 SER H H 54 8.360 8.123 0.237 1
1 629 . 14 1 1 A 54 54 SER HA H 54 4.164 4.068 0.096 1
1 632 . 14 1 1 A 54 54 SER C C 54 175.517 177.378 -1.861 1
1 633 . 14 1 1 A 54 54 SER CA C 54 60.193 61.434 -1.241 1
1 634 . 14 1 1 A 54 54 SER CB C 54 62.617 62.800 -0.183 1
1 635 . 14 1 1 A 54 54 SER N N 54 111.266 114.196 -2.930 1
1 636 . 14 1 1 A 55 55 GLU H H 55 7.666 8.321 -0.655 1
1 637 . 14 1 1 A 55 55 GLU HA H 55 4.363 4.106 0.257 1
1 642 . 14 1 1 A 55 55 GLU C C 55 176.753 177.917 -1.164 1
1 643 . 14 1 1 A 55 55 GLU CA C 55 56.200 58.911 -2.711 1
1 644 . 14 1 1 A 55 55 GLU CB C 55 30.526 29.230 1.296 1
1 646 . 14 1 1 A 55 55 GLU N N 55 119.485 119.927 -0.442 1
1 647 . 14 1 1 A 56 56 ILE H H 56 7.601 7.070 0.531 1
1 648 . 14 1 1 A 56 56 ILE HA H 56 3.793 3.945 -0.152 1
1 658 . 14 1 1 A 56 56 ILE C C 56 175.142 176.011 -0.869 1
1 659 . 14 1 1 A 56 56 ILE CA C 56 63.518 62.330 1.188 1
1 660 . 14 1 1 A 56 56 ILE CB C 56 37.169 37.910 -0.741 1
1 664 . 14 1 1 A 56 56 ILE N N 56 120.430 120.342 0.088 1
1 665 . 14 1 1 A 57 57 LEU H H 57 9.263 9.256 0.007 1
1 666 . 14 1 1 A 57 57 LEU HA H 57 4.343 4.400 -0.057 1
1 676 . 14 1 1 A 57 57 LEU C C 57 177.898 176.540 1.358 1
1 677 . 14 1 1 A 57 57 LEU CA C 57 56.569 55.802 0.767 1
1 678 . 14 1 1 A 57 57 LEU CB C 57 41.980 42.752 -0.772 1
1 682 . 14 1 1 A 57 57 LEU N N 57 129.464 128.908 0.556 1
1 683 . 14 1 1 A 58 58 THR H H 58 7.414 7.281 0.133 1
1 684 . 14 1 1 A 58 58 THR HA H 58 4.512 4.881 -0.369 1
1 689 . 14 1 1 A 58 58 THR C C 58 171.314 172.739 -1.425 1
1 690 . 14 1 1 A 58 58 THR CA C 58 60.562 61.207 -0.645 1
1 691 . 14 1 1 A 58 58 THR CB C 58 70.803 73.415 -2.612 1
1 693 . 14 1 1 A 58 58 THR N N 58 109.129 110.747 -1.618 1
1 694 . 14 1 1 A 59 59 VAL H H 59 8.152 8.503 -0.351 1
1 695 . 14 1 1 A 59 59 VAL HA H 59 5.061 5.013 0.048 1
1 703 . 14 1 1 A 59 59 VAL C C 59 174.985 175.054 -0.069 1
1 704 . 14 1 1 A 59 59 VAL CA C 59 61.354 61.202 0.152 1
1 705 . 14 1 1 A 59 59 VAL CB C 59 33.855 34.061 -0.206 1
1 708 . 14 1 1 A 59 59 VAL N N 59 123.676 124.742 -1.066 1
1 709 . 14 1 1 A 60 60 GLU H H 60 9.074 8.648 0.426 1
1 710 . 14 1 1 A 60 60 GLU HA H 60 4.977 4.857 0.120 1
1 715 . 14 1 1 A 60 60 GLU C C 60 176.063 175.318 0.745 1
1 716 . 14 1 1 A 60 60 GLU CA C 60 53.807 54.220 -0.413 1
1 717 . 14 1 1 A 60 60 GLU CB C 60 33.739 33.730 0.009 1
1 719 . 14 1 1 A 60 60 GLU N N 60 125.125 126.168 -1.043 1
1 720 . 14 1 1 A 61 61 SER H H 61 8.763 8.493 0.270 1
1 721 . 14 1 1 A 61 61 SER HA H 61 4.452 5.104 -0.652 1
1 724 . 14 1 1 A 61 61 SER C C 61 173.288 174.509 -1.221 1
1 725 . 14 1 1 A 61 61 SER CA C 61 59.384 56.620 2.764 1
1 726 . 14 1 1 A 61 61 SER CB C 61 63.390 65.147 -1.757 1
1 727 . 14 1 1 A 61 61 SER N N 61 117.523 114.490 3.033 1
1 728 . 14 1 1 A 62 62 ALA H H 62 7.293 9.050 -1.757 1
1 729 . 14 1 1 A 62 62 ALA HA H 62 3.817 4.342 -0.525 1
1 733 . 14 1 1 A 62 62 ALA C C 62 176.717 177.804 -1.087 1
1 734 . 14 1 1 A 62 62 ALA CA C 62 53.966 53.048 0.918 1
1 735 . 14 1 1 A 62 62 ALA CB C 62 18.640 18.653 -0.013 1
1 736 . 14 1 1 A 62 62 ALA N N 62 122.650 125.799 -3.149 1
1 737 . 14 1 1 A 63 63 GLN H H 63 8.736 8.078 0.658 1
1 738 . 14 1 1 A 63 63 GLN HA H 63 4.445 4.727 -0.282 1
1 745 . 14 1 1 A 63 63 GLN C C 63 173.700 174.820 -1.120 1
1 746 . 14 1 1 A 63 63 GLN CA C 63 56.376 55.676 0.700 1
1 747 . 14 1 1 A 63 63 GLN CB C 63 31.515 30.982 0.533 1
1 749 . 14 1 1 A 63 63 GLN N N 63 120.251 119.376 0.875 1
1 751 . 14 1 1 A 64 64 ASN H H 64 9.272 7.030 2.242 1
1 752 . 14 1 1 A 64 64 ASN HA H 64 4.906 5.040 -0.134 1
1 757 . 14 1 1 A 64 64 ASN C C 64 174.754 174.554 0.200 1
1 758 . 14 1 1 A 64 64 ASN CA C 64 51.837 51.953 -0.116 1
1 759 . 14 1 1 A 64 64 ASN CB C 64 38.156 40.184 -2.028 1
1 760 . 14 1 1 A 64 64 ASN N N 64 122.346 118.826 3.520 1
1 762 . 14 1 1 A 65 65 PHE H H 65 8.854 9.088 -0.234 1
1 763 . 14 1 1 A 65 65 PHE HA H 65 4.947 5.223 -0.276 1
1 771 . 14 1 1 A 65 65 PHE C C 65 177.274 176.472 0.802 1
1 772 . 14 1 1 A 65 65 PHE CA C 65 57.519 56.912 0.607 1
1 773 . 14 1 1 A 65 65 PHE CB C 65 38.485 38.808 -0.323 1
1 779 . 14 1 1 A 65 65 PHE N N 65 123.638 125.298 -1.660 1
1 780 . 14 1 1 A 66 66 SER H H 66 8.163 8.119 0.044 1
1 781 . 14 1 1 A 66 66 SER HA H 66 4.393 4.445 -0.052 1
1 784 . 14 1 1 A 66 66 SER C C 66 175.699 177.112 -1.413 1
1 785 . 14 1 1 A 66 66 SER CA C 66 60.791 61.031 -0.240 1
1 786 . 14 1 1 A 66 66 SER CB C 66 64.591 63.285 1.306 1
1 787 . 14 1 1 A 66 66 SER N N 66 113.913 115.915 -2.002 1
1 788 . 14 1 1 A 67 67 LEU H H 67 8.574 7.868 0.706 1
1 789 . 14 1 1 A 67 67 LEU HA H 67 4.302 3.795 0.507 1
1 799 . 14 1 1 A 67 67 LEU C C 67 176.269 177.364 -1.095 1
1 800 . 14 1 1 A 67 67 LEU CA C 67 55.601 58.230 -2.629 1
1 801 . 14 1 1 A 67 67 LEU CB C 67 42.021 41.864 0.157 1
1 805 . 14 1 1 A 67 67 LEU N N 67 121.264 120.950 0.314 1
1 806 . 14 1 1 A 68 68 VAL H H 68 6.921 7.601 -0.680 1
1 807 . 14 1 1 A 68 68 VAL HA H 68 4.473 4.181 0.292 1
1 815 . 14 1 1 A 68 68 VAL C C 68 173.809 174.947 -1.138 1
1 816 . 14 1 1 A 68 68 VAL CA C 68 58.047 60.796 -2.749 1
1 817 . 14 1 1 A 68 68 VAL CB C 68 32.295 31.854 0.441 1
1 820 . 14 1 1 A 68 68 VAL N N 68 111.287 115.774 -4.487 1
1 821 . 14 1 1 A 69 69 PRO HA H 69 4.658 4.709 -0.051 1
1 828 . 14 1 1 A 69 69 PRO CA C 69 61.747 61.540 0.207 1
1 829 . 14 1 1 A 69 69 PRO CB C 69 30.693 31.771 -1.078 1
1 832 . 14 1 1 A 70 70 PRO HA H 70 4.414 4.239 0.175 1
1 839 . 14 1 1 A 70 70 PRO CA C 70 63.997 63.893 0.104 1
1 840 . 14 1 1 A 70 70 PRO CB C 70 31.602 31.310 0.292 1
1 843 . 14 1 1 A 71 71 GLY H H 71 8.824 8.920 -0.096 1
1 844 . 14 1 1 A 71 71 GLY HA2 H 71 3.703 3.894 -0.191 1
1 845 . 14 1 1 A 71 71 GLY HA3 H 71 4.193 3.901 0.292 1
1 846 . 14 1 1 A 71 71 GLY C C 71 174.052 174.687 -0.635 1
1 847 . 14 1 1 A 71 71 GLY CA C 71 45.065 45.120 -0.055 1
1 848 . 14 1 1 A 71 71 GLY N N 71 111.845 112.879 -1.034 1
1 849 . 14 1 1 A 72 72 THR H H 72 7.597 7.237 0.360 1
1 850 . 14 1 1 A 72 72 THR HA H 72 4.133 4.099 0.034 1
1 855 . 14 1 1 A 72 72 THR CA C 72 63.129 63.366 -0.237 1
1 856 . 14 1 1 A 72 72 THR CB C 72 69.560 68.850 0.710 1
1 858 . 14 1 1 A 72 72 THR N N 72 117.485 116.429 1.056 1
1 859 . 14 1 1 A 73 73 ASN H H 73 9.280 8.543 0.737 1
1 860 . 14 1 1 A 73 73 ASN HA H 73 4.786 4.611 0.175 1
1 865 . 14 1 1 A 73 73 ASN CA C 73 52.009 52.071 -0.062 1
1 866 . 14 1 1 A 73 73 ASN CB C 73 37.553 38.209 -0.656 1
1 867 . 14 1 1 A 73 73 ASN N N 73 127.641 125.432 2.209 1
1 869 . 14 1 1 A 74 74 PRO HA H 74 4.752 4.822 -0.070 1
1 876 . 14 1 1 A 74 74 PRO C C 74 175.190 176.506 -1.316 1
1 877 . 14 1 1 A 74 74 PRO CA C 74 63.395 62.498 0.897 1
1 878 . 14 1 1 A 74 74 PRO CB C 74 33.164 32.623 0.541 1
1 881 . 14 1 1 A 75 75 HIS H H 75 8.025 8.655 -0.630 1
1 882 . 14 1 1 A 75 75 HIS HA H 75 5.047 4.982 0.065 1
1 887 . 14 1 1 A 75 75 HIS C C 75 172.562 175.759 -3.197 1
1 888 . 14 1 1 A 75 75 HIS CA C 75 54.336 53.737 0.599 1
1 889 . 14 1 1 A 75 75 HIS CB C 75 30.956 33.219 -2.263 1
1 892 . 14 1 1 A 75 75 HIS N N 75 116.198 116.886 -0.688 1
1 893 . 14 1 1 A 76 76 CYS H H 76 8.343 9.506 -1.163 1
1 894 . 14 1 1 A 76 76 CYS HA H 76 4.594 4.456 0.138 1
1 897 . 14 1 1 A 76 76 CYS C C 76 175.651 174.864 0.787 1
1 898 . 14 1 1 A 76 76 CYS CA C 76 61.066 61.205 -0.139 1
1 899 . 14 1 1 A 76 76 CYS CB C 76 30.193 28.686 1.507 1
1 900 . 14 1 1 A 76 76 CYS N N 76 113.289 118.024 -4.735 1
1 901 . 14 1 1 A 77 77 PHE H H 77 8.433 7.626 0.807 1
1 902 . 14 1 1 A 77 77 PHE HA H 77 5.105 5.388 -0.283 1
1 910 . 14 1 1 A 77 77 PHE C C 77 171.822 172.981 -1.159 1
1 911 . 14 1 1 A 77 77 PHE CA C 77 56.874 55.693 1.181 1
1 912 . 14 1 1 A 77 77 PHE CB C 77 39.393 43.002 -3.609 1
1 918 . 14 1 1 A 77 77 PHE N N 77 114.874 114.789 0.085 1
1 919 . 14 1 1 A 78 78 GLU H H 78 9.823 9.149 0.674 1
1 920 . 14 1 1 A 78 78 GLU HA H 78 5.333 5.103 0.230 1
1 925 . 14 1 1 A 78 78 GLU C C 78 175.602 175.537 0.065 1
1 926 . 14 1 1 A 78 78 GLU CA C 78 54.212 54.786 -0.574 1
1 927 . 14 1 1 A 78 78 GLU CB C 78 31.702 32.678 -0.976 1
1 929 . 14 1 1 A 78 78 GLU N N 78 121.074 119.025 2.049 1
1 930 . 14 1 1 A 79 79 ILE H H 79 9.093 9.026 0.067 1
1 931 . 14 1 1 A 79 79 ILE HA H 79 4.637 4.608 0.029 1
1 941 . 14 1 1 A 79 79 ILE C C 79 174.476 175.431 -0.955 1
1 942 . 14 1 1 A 79 79 ILE CA C 79 60.932 60.609 0.323 1
1 943 . 14 1 1 A 79 79 ILE CB C 79 40.803 37.404 3.399 1
1 947 . 14 1 1 A 79 79 ILE N N 79 121.382 125.080 -3.698 1
1 948 . 14 1 1 A 80 80 VAL H H 80 8.841 8.004 0.837 1
1 949 . 14 1 1 A 80 80 VAL HA H 80 4.425 3.930 0.495 1
1 957 . 14 1 1 A 80 80 VAL C C 80 175.930 175.369 0.561 1
1 958 . 14 1 1 A 80 80 VAL CA C 80 63.324 63.220 0.104 1
1 959 . 14 1 1 A 80 80 VAL CB C 80 32.783 31.073 1.710 1
1 962 . 14 1 1 A 80 80 VAL N N 80 128.970 128.159 0.811 1
1 963 . 14 1 1 A 81 81 THR H H 81 8.303 7.803 0.500 1
1 964 . 14 1 1 A 81 81 THR HA H 81 5.264 4.717 0.547 1
1 969 . 14 1 1 A 81 81 THR C C 81 173.664 174.506 -0.842 1
1 970 . 14 1 1 A 81 81 THR CA C 81 59.540 59.891 -0.351 1
1 971 . 14 1 1 A 81 81 THR CB C 81 72.197 71.015 1.182 1
1 973 . 14 1 1 A 81 81 THR N N 81 118.077 118.461 -0.384 1
1 974 . 14 1 1 A 82 82 ALA H H 82 9.586 8.484 1.102 1
1 975 . 14 1 1 A 82 82 ALA HA H 82 4.093 4.358 -0.265 1
1 979 . 14 1 1 A 82 82 ALA C C 82 178.667 177.785 0.882 1
1 980 . 14 1 1 A 82 82 ALA CA C 82 55.321 53.119 2.202 1
1 981 . 14 1 1 A 82 82 ALA CB C 82 18.094 18.712 -0.618 1
1 982 . 14 1 1 A 82 82 ALA N N 82 122.493 123.402 -0.909 1
1 983 . 14 1 1 A 83 83 ASN H H 83 7.923 8.427 -0.504 1
1 984 . 14 1 1 A 83 83 ASN HA H 83 4.808 5.074 -0.266 1
1 989 . 14 1 1 A 83 83 ASN C C 83 174.766 174.610 0.156 1
1 990 . 14 1 1 A 83 83 ASN CA C 83 53.333 54.881 -1.548 1
1 991 . 14 1 1 A 83 83 ASN CB C 83 40.335 41.564 -1.229 1
1 992 . 14 1 1 A 83 83 ASN N N 83 110.765 115.601 -4.836 1
1 994 . 14 1 1 A 84 84 ALA H H 84 7.352 7.153 0.199 1
1 995 . 14 1 1 A 84 84 ALA HA H 84 4.625 4.501 0.124 1
1 999 . 14 1 1 A 84 84 ALA C C 84 176.547 175.113 1.434 1
1 1000 . 14 1 1 A 84 84 ALA CA C 84 52.858 51.798 1.060 1
1 1001 . 14 1 1 A 84 84 ALA CB C 84 21.233 22.068 -0.835 1
1 1002 . 14 1 1 A 84 84 ALA N N 84 119.599 117.609 1.990 1
1 1003 . 14 1 1 A 85 85 THR H H 85 8.374 8.659 -0.285 1
1 1004 . 14 1 1 A 85 85 THR HA H 85 5.014 4.573 0.441 1
1 1009 . 14 1 1 A 85 85 THR C C 85 171.568 174.250 -2.682 1
1 1010 . 14 1 1 A 85 85 THR CA C 85 61.618 62.622 -1.004 1
1 1011 . 14 1 1 A 85 85 THR CB C 85 70.850 69.247 1.603 1
1 1013 . 14 1 1 A 85 85 THR N N 85 119.032 113.915 5.117 1
1 1014 . 14 1 1 A 86 86 TYR H H 86 9.006 9.074 -0.068 1
1 1015 . 14 1 1 A 86 86 TYR HA H 86 4.658 4.900 -0.242 1
1 1022 . 14 1 1 A 86 86 TYR C C 86 173.773 175.318 -1.545 1
1 1023 . 14 1 1 A 86 86 TYR CA C 86 56.938 57.615 -0.677 1
1 1024 . 14 1 1 A 86 86 TYR CB C 86 39.513 40.228 -0.715 1
1 1029 . 14 1 1 A 86 86 TYR N N 86 123.494 127.085 -3.591 1
1 1030 . 14 1 1 A 87 87 PHE H H 87 9.263 8.797 0.466 1
1 1031 . 14 1 1 A 87 87 PHE HA H 87 4.127 4.681 -0.554 1
1 1039 . 14 1 1 A 87 87 PHE C C 87 176.369 174.262 2.107 1
1 1040 . 14 1 1 A 87 87 PHE CA C 87 57.238 55.843 1.395 1
1 1041 . 14 1 1 A 87 87 PHE CB C 87 37.086 38.622 -1.536 1
1 1047 . 14 1 1 A 87 87 PHE N N 87 125.384 119.746 5.638 1
1 1048 . 14 1 1 A 88 88 VAL H H 88 9.023 8.188 0.835 1
1 1049 . 14 1 1 A 88 88 VAL HA H 88 4.162 4.575 -0.413 1
1 1057 . 14 1 1 A 88 88 VAL C C 88 176.390 175.675 0.715 1
1 1058 . 14 1 1 A 88 88 VAL CA C 88 63.975 60.588 3.387 1
1 1059 . 14 1 1 A 88 88 VAL CB C 88 32.378 32.666 -0.288 1
1 1062 . 14 1 1 A 88 88 VAL N N 88 127.348 124.352 2.996 1
1 1063 . 14 1 1 A 89 89 GLY H H 89 9.233 7.877 1.356 1
1 1064 . 14 1 1 A 89 89 GLY HA2 H 89 4.293 4.179 0.114 1
1 1065 . 14 1 1 A 89 89 GLY HA3 H 89 4.186 4.249 -0.063 1
1 1066 . 14 1 1 A 89 89 GLY C C 89 172.378 171.327 1.051 1
1 1067 . 14 1 1 A 89 89 GLY CA C 89 43.798 46.117 -2.319 1
1 1068 . 14 1 1 A 89 89 GLY N N 89 116.041 112.070 3.971 1
1 1069 . 14 1 1 A 90 90 GLU H H 90 8.532 8.749 -0.217 1
1 1070 . 14 1 1 A 90 90 GLU HA H 90 4.794 5.011 -0.217 1
1 1075 . 14 1 1 A 90 90 GLU C C 90 174.221 175.186 -0.965 1
1 1076 . 14 1 1 A 90 90 GLU CA C 90 56.393 54.848 1.545 1
1 1077 . 14 1 1 A 90 90 GLU CB C 90 33.182 33.403 -0.221 1
1 1079 . 14 1 1 A 90 90 GLU N N 90 120.905 124.108 -3.203 1
1 1080 . 14 1 1 A 91 91 MET H H 91 8.450 8.754 -0.304 1
1 1081 . 14 1 1 A 91 91 MET HA H 91 4.904 5.142 -0.238 1
1 1089 . 14 1 1 A 91 91 MET C C 91 173.373 174.027 -0.654 1
1 1090 . 14 1 1 A 91 91 MET CA C 91 52.277 53.269 -0.992 1
1 1091 . 14 1 1 A 91 91 MET CB C 91 32.789 34.220 -1.431 1
1 1094 . 14 1 1 A 91 91 MET N N 91 125.173 124.688 0.485 1
1 1095 . 14 1 1 A 92 92 PRO HA H 92 4.358 4.900 -0.542 1
1 1102 . 14 1 1 A 92 92 PRO C C 92 177.589 177.328 0.261 1
1 1103 . 14 1 1 A 92 92 PRO CA C 92 63.143 62.965 0.178 1
1 1104 . 14 1 1 A 92 92 PRO CB C 92 32.083 31.874 0.209 1
1 1107 . 14 1 1 A 93 93 GLY H H 93 8.330 8.537 -0.207 1
1 1108 . 14 1 1 A 93 93 GLY HA2 H 93 3.943 3.891 0.052 1
1 1109 . 14 1 1 A 93 93 GLY HA3 H 93 4.045 3.894 0.151 1
1 1110 . 14 1 1 A 93 93 GLY C C 93 174.730 175.480 -0.750 1
1 1111 . 14 1 1 A 93 93 GLY CA C 93 45.276 46.070 -0.794 1
1 1112 . 14 1 1 A 93 93 GLY N N 93 109.420 109.970 -0.550 1
1 1113 . 14 1 1 A 94 94 GLY H H 94 8.331 8.097 0.234 1
1 1114 . 14 1 1 A 94 94 GLY HA2 H 94 3.973 3.987 -0.014 1
1 1115 . 14 1 1 A 94 94 GLY HA3 H 94 3.973 3.990 -0.017 1
1 1116 . 14 1 1 A 94 94 GLY C C 94 174.100 174.352 -0.252 1
1 1117 . 14 1 1 A 94 94 GLY CA C 94 45.333 45.164 0.169 1
1 1118 . 14 1 1 A 94 94 GLY N N 94 108.483 108.007 0.476 1
1 1119 . 14 1 1 A 95 95 THR H H 95 8.095 7.826 0.269 1
1 1120 . 14 1 1 A 95 95 THR HA H 95 4.643 4.358 0.285 1
1 1125 . 14 1 1 A 95 95 THR C C 95 173.155 175.161 -2.006 1
1 1126 . 14 1 1 A 95 95 THR CA C 95 59.922 60.795 -0.873 1
1 1127 . 14 1 1 A 95 95 THR CB C 95 69.871 68.815 1.056 1
1 1129 . 14 1 1 A 95 95 THR N N 95 115.860 114.334 1.526 1
1 1130 . 14 1 1 A 96 96 PRO HA H 96 4.400 4.470 -0.070 1
1 1137 . 14 1 1 A 96 96 PRO C C 96 177.565 177.466 0.099 1
1 1138 . 14 1 1 A 96 96 PRO CA C 96 64.047 63.866 0.181 1
1 1139 . 14 1 1 A 96 96 PRO CB C 96 31.816 31.770 0.046 1
1 1142 . 14 1 1 A 97 97 GLY H H 97 8.572 8.236 0.336 1
1 1143 . 14 1 1 A 97 97 GLY HA2 H 97 4.007 3.912 0.095 1
1 1144 . 14 1 1 A 97 97 GLY HA3 H 97 4.007 3.913 0.094 1
1 1145 . 14 1 1 A 97 97 GLY C C 97 174.609 174.568 0.041 1
1 1146 . 14 1 1 A 97 97 GLY CA C 97 45.276 46.725 -1.449 1
1 1147 . 14 1 1 A 97 97 GLY N N 97 110.233 107.656 2.577 1
1 1148 . 14 1 1 A 98 98 GLY H H 98 8.119 7.449 0.670 1
1 1149 . 14 1 1 A 98 98 GLY HA2 H 98 4.086 4.049 0.037 1
1 1150 . 14 1 1 A 98 98 GLY HA3 H 98 4.200 4.049 0.151 1
1 1151 . 14 1 1 A 98 98 GLY CA C 98 44.876 44.478 0.398 1
1 1152 . 14 1 1 A 98 98 GLY N N 98 108.845 105.829 3.016 1
1 1153 . 14 1 1 A 99 99 PRO HA H 99 4.494 4.708 -0.214 1
1 1160 . 14 1 1 A 99 99 PRO C C 99 177.468 175.044 2.424 1
1 1161 . 14 1 1 A 99 99 PRO CA C 99 63.500 62.408 1.092 1
1 1162 . 14 1 1 A 99 99 PRO CB C 99 32.013 29.912 2.101 1
1 1165 . 14 1 1 A 100 100 SER H H 100 8.472 8.293 0.179 1
1 1166 . 14 1 1 A 100 100 SER HA H 100 4.513 5.321 -0.808 1
1 1169 . 14 1 1 A 100 100 SER C C 100 175.408 173.163 2.245 1
1 1170 . 14 1 1 A 100 100 SER CA C 100 58.557 56.610 1.947 1
1 1171 . 14 1 1 A 100 100 SER CB C 100 63.918 65.460 -1.542 1
1 1172 . 14 1 1 A 100 100 SER N N 100 116.038 119.459 -3.421 1
1 1173 . 14 1 1 A 101 101 GLY H H 101 8.427 8.405 0.022 1
1 1174 . 14 1 1 A 101 101 GLY HA2 H 101 4.064 4.233 -0.169 1
1 1175 . 14 1 1 A 101 101 GLY HA3 H 101 4.064 4.235 -0.171 1
1 1176 . 14 1 1 A 101 101 GLY C C 101 174.730 173.911 0.819 1
1 1177 . 14 1 1 A 101 101 GLY CA C 101 45.575 46.066 -0.491 1
1 1178 . 14 1 1 A 101 101 GLY N N 101 110.558 113.405 -2.847 1
1 1179 . 14 1 1 A 102 102 GLN H H 102 8.416 8.899 -0.483 1
1 1180 . 14 1 1 A 102 102 GLN HA H 102 4.383 4.368 0.015 1
1 1187 . 14 1 1 A 102 102 GLN C C 102 177.346 176.192 1.154 1
1 1188 . 14 1 1 A 102 102 GLN CA C 102 57.080 57.415 -0.335 1
1 1189 . 14 1 1 A 102 102 GLN CB C 102 29.235 30.477 -1.242 1
1 1191 . 14 1 1 A 102 102 GLN N N 102 120.112 120.086 0.026 1
1 1193 . 14 1 1 A 103 103 GLY H H 103 8.713 8.293 0.420 1
1 1194 . 14 1 1 A 103 103 GLY HA2 H 103 4.193 3.915 0.278 1
1 1195 . 14 1 1 A 103 103 GLY HA3 H 103 4.078 3.933 0.145 1
1 1196 . 14 1 1 A 103 103 GLY C C 103 175.602 174.595 1.007 1
1 1197 . 14 1 1 A 103 103 GLY CA C 103 46.120 47.179 -1.059 1
1 1198 . 14 1 1 A 103 103 GLY N N 103 109.817 107.545 2.272 1
1 1199 . 14 1 1 A 104 104 ALA H H 104 8.366 7.821 0.545 1
1 1200 . 14 1 1 A 104 104 ALA HA H 104 4.449 4.680 -0.231 1
1 1204 . 14 1 1 A 104 104 ALA C C 104 179.188 178.280 0.908 1
1 1205 . 14 1 1 A 104 104 ALA CA C 104 54.230 53.164 1.066 1
1 1206 . 14 1 1 A 104 104 ALA CB C 104 19.080 20.583 -1.503 1
1 1207 . 14 1 1 A 104 104 ALA N N 104 124.808 121.084 3.724 1
1 1208 . 14 1 1 A 105 105 GLU H H 105 8.576 8.289 0.287 1
1 1209 . 14 1 1 A 105 105 GLU HA H 105 4.161 4.236 -0.075 1
1 1214 . 14 1 1 A 105 105 GLU C C 105 179.200 179.369 -0.169 1
1 1215 . 14 1 1 A 105 105 GLU CA C 105 59.173 58.417 0.756 1
1 1216 . 14 1 1 A 105 105 GLU CB C 105 29.194 30.017 -0.823 1
1 1218 . 14 1 1 A 105 105 GLU N N 105 119.238 116.261 2.977 1
1 1219 . 14 1 1 A 106 106 ALA H H 106 8.381 7.976 0.405 1
1 1220 . 14 1 1 A 106 106 ALA HA H 106 4.283 4.165 0.118 1
1 1224 . 14 1 1 A 106 106 ALA C C 106 180.048 179.598 0.450 1
1 1225 . 14 1 1 A 106 106 ALA CA C 106 54.687 54.898 -0.211 1
1 1226 . 14 1 1 A 106 106 ALA CB C 106 18.341 18.140 0.201 1
1 1227 . 14 1 1 A 106 106 ALA N N 106 123.327 123.219 0.108 1
1 1228 . 14 1 1 A 107 107 ALA H H 107 8.123 7.720 0.403 1
1 1229 . 14 1 1 A 107 107 ALA HA H 107 4.554 4.499 0.055 1
1 1233 . 14 1 1 A 107 107 ALA C C 107 179.757 179.684 0.073 1
1 1234 . 14 1 1 A 107 107 ALA CA C 107 55.355 55.256 0.099 1
1 1235 . 14 1 1 A 107 107 ALA CB C 107 18.939 19.430 -0.491 1
1 1236 . 14 1 1 A 107 107 ALA N N 107 120.740 120.166 0.574 1
1 1237 . 14 1 1 A 108 108 ARG H H 108 8.403 7.781 0.622 1
1 1238 . 14 1 1 A 108 108 ARG HA H 108 4.254 4.183 0.071 1
1 1245 . 14 1 1 A 108 108 ARG C C 108 179.111 178.751 0.360 1
1 1246 . 14 1 1 A 108 108 ARG CA C 108 59.015 58.477 0.538 1
1 1247 . 14 1 1 A 108 108 ARG CB C 108 29.752 30.186 -0.434 1
1 1250 . 14 1 1 A 108 108 ARG N N 108 119.531 117.116 2.415 1
1 1251 . 14 1 1 A 109 109 GLY H H 109 8.182 8.166 0.016 1
1 1252 . 14 1 1 A 109 109 GLY HA2 H 109 3.822 3.629 0.193 1
1 1253 . 14 1 1 A 109 109 GLY HA3 H 109 3.822 3.676 0.146 1
1 1254 . 14 1 1 A 109 109 GLY C C 109 177.020 176.498 0.522 1
1 1255 . 14 1 1 A 109 109 GLY CA C 109 46.718 47.208 -0.490 1
1 1256 . 14 1 1 A 109 109 GLY N N 109 107.331 108.878 -1.547 1
1 1257 . 14 1 1 A 110 110 TRP H H 110 7.925 8.237 -0.312 1
1 1258 . 14 1 1 A 110 110 TRP HA H 110 3.963 4.537 -0.574 1
1 1267 . 14 1 1 A 110 110 TRP C C 110 176.691 178.026 -1.335 1
1 1268 . 14 1 1 A 110 110 TRP CA C 110 62.041 61.070 0.971 1
1 1269 . 14 1 1 A 110 110 TRP CB C 110 28.989 28.377 0.612 1
1 1275 . 14 1 1 A 110 110 TRP N N 110 122.304 121.303 1.001 1
1 1277 . 14 1 1 A 111 111 GLU H H 111 7.946 7.816 0.130 1
1 1278 . 14 1 1 A 111 111 GLU HA H 111 2.594 2.980 -0.386 1
1 1283 . 14 1 1 A 111 111 GLU C C 111 177.976 179.120 -1.144 1
1 1284 . 14 1 1 A 111 111 GLU CA C 111 60.193 59.186 1.007 1
1 1285 . 14 1 1 A 111 111 GLU CB C 111 29.277 29.296 -0.019 1
1 1287 . 14 1 1 A 111 111 GLU N N 111 121.755 119.260 2.495 1
1 1288 . 14 1 1 A 112 112 THR H H 112 7.993 7.534 0.459 1
1 1289 . 14 1 1 A 112 112 THR HA H 112 3.722 3.858 -0.136 1
1 1294 . 14 1 1 A 112 112 THR C C 112 176.038 175.726 0.312 1
1 1295 . 14 1 1 A 112 112 THR CA C 112 66.104 66.597 -0.493 1
1 1296 . 14 1 1 A 112 112 THR CB C 112 68.885 68.847 0.038 1
1 1298 . 14 1 1 A 112 112 THR N N 112 112.247 116.561 -4.314 1
1 1299 . 14 1 1 A 113 113 ALA H H 113 7.742 8.369 -0.627 1
1 1300 . 14 1 1 A 113 113 ALA HA H 113 4.029 3.985 0.044 1
1 1304 . 14 1 1 A 113 113 ALA C C 113 180.545 180.017 0.528 1
1 1305 . 14 1 1 A 113 113 ALA CA C 113 55.127 55.156 -0.029 1
1 1306 . 14 1 1 A 113 113 ALA CB C 113 18.854 18.414 0.440 1
1 1307 . 14 1 1 A 113 113 ALA N N 113 123.134 122.761 0.373 1
1 1308 . 14 1 1 A 114 114 ILE H H 114 8.472 8.598 -0.126 1
1 1309 . 14 1 1 A 114 114 ILE HA H 114 3.613 3.771 -0.158 1
1 1319 . 14 1 1 A 114 114 ILE C C 114 176.947 178.085 -1.138 1
1 1320 . 14 1 1 A 114 114 ILE CA C 114 66.016 65.294 0.722 1
1 1321 . 14 1 1 A 114 114 ILE CB C 114 38.335 37.993 0.342 1
1 1325 . 14 1 1 A 114 114 ILE N N 114 118.276 117.798 0.478 1
1 1326 . 14 1 1 A 115 115 ARG H H 115 8.181 7.783 0.398 1
1 1327 . 14 1 1 A 115 115 ARG HA H 115 3.835 3.946 -0.111 1
1 1334 . 14 1 1 A 115 115 ARG C C 115 179.588 179.166 0.422 1
1 1335 . 14 1 1 A 115 115 ARG CA C 115 61.072 60.040 1.032 1
1 1336 . 14 1 1 A 115 115 ARG CB C 115 29.975 29.755 0.220 1
1 1339 . 14 1 1 A 115 115 ARG N N 115 117.921 119.765 -1.844 1
1 1340 . 14 1 1 A 116 116 GLN H H 116 8.395 8.647 -0.252 1
1 1341 . 14 1 1 A 116 116 GLN HA H 116 4.030 4.063 -0.033 1
1 1348 . 14 1 1 A 116 116 GLN C C 116 178.716 179.076 -0.360 1
1 1349 . 14 1 1 A 116 116 GLN CA C 116 58.790 58.788 0.002 1
1 1350 . 14 1 1 A 116 116 GLN CB C 116 28.248 28.460 -0.212 1
1 1352 . 14 1 1 A 116 116 GLN N N 116 116.842 118.728 -1.886 1
1 1354 . 14 1 1 A 117 117 ALA H H 117 7.902 7.939 -0.037 1
1 1355 . 14 1 1 A 117 117 ALA HA H 117 4.143 4.142 0.001 1
1 1359 . 14 1 1 A 117 117 ALA C C 117 179.685 180.206 -0.521 1
1 1360 . 14 1 1 A 117 117 ALA CA C 117 54.476 54.987 -0.511 1
1 1361 . 14 1 1 A 117 117 ALA CB C 117 18.300 18.328 -0.028 1
1 1362 . 14 1 1 A 117 117 ALA N N 117 122.828 123.072 -0.244 1
1 1363 . 14 1 1 A 118 118 LEU H H 118 7.904 7.858 0.046 1
1 1364 . 14 1 1 A 118 118 LEU HA H 118 4.119 4.101 0.018 1
1 1374 . 14 1 1 A 118 118 LEU C C 118 178.437 178.760 -0.323 1
1 1375 . 14 1 1 A 118 118 LEU CA C 118 56.781 57.177 -0.396 1
1 1376 . 14 1 1 A 118 118 LEU CB C 118 42.371 41.803 0.568 1
1 1380 . 14 1 1 A 118 118 LEU N N 118 117.632 120.124 -2.492 1
1 1381 . 14 1 1 A 119 119 MET H H 119 7.673 8.131 -0.458 1
1 1382 . 14 1 1 A 119 119 MET HA H 119 4.442 4.211 0.231 1
1 1390 . 14 1 1 A 119 119 MET C C 119 176.680 177.777 -1.097 1
1 1391 . 14 1 1 A 119 119 MET CA C 119 56.432 57.914 -1.482 1
1 1392 . 14 1 1 A 119 119 MET CB C 119 32.769 31.850 0.919 1
1 1395 . 14 1 1 A 119 119 MET N N 119 117.286 117.695 -0.409 1
1 1396 . 14 1 1 A 120 120 SER H H 120 7.878 7.440 0.438 1
1 1397 . 14 1 1 A 120 120 SER HA H 120 4.500 4.464 0.036 1
1 1400 . 14 1 1 A 120 120 SER C C 120 174.742 174.497 0.245 1
1 1401 . 14 1 1 A 120 120 SER CA C 120 58.962 59.206 -0.244 1
1 1402 . 14 1 1 A 120 120 SER CB C 120 63.853 64.663 -0.810 1
1 1403 . 14 1 1 A 120 120 SER N N 120 115.064 111.707 3.357 1
1 1404 . 14 1 1 A 121 121 GLY H H 121 8.059 7.937 0.122 1
1 1405 . 14 1 1 A 121 121 GLY HA2 H 121 4.231 4.073 0.158 1
1 1406 . 14 1 1 A 121 121 GLY HA3 H 121 4.112 4.073 0.039 1
1 1407 . 14 1 1 A 121 121 GLY C C 121 172.065 174.026 -1.961 1
1 1408 . 14 1 1 A 121 121 GLY CA C 121 45.030 44.484 0.546 1
1 1409 . 14 1 1 A 121 121 GLY N N 121 110.271 109.411 0.860 1
1 1410 . 14 1 1 A 122 122 PRO HA H 122 4.496 4.539 -0.043 1
1 1417 . 14 1 1 A 122 122 PRO CA C 122 63.399 63.553 -0.154 1
1 1418 . 14 1 1 A 122 122 PRO CB C 122 32.186 32.136 0.050 1
1 1 . 15 1 1 A 6 6 SER H H 6 8.337 8.590 -0.253 1
1 2 . 15 1 1 A 6 6 SER HA H 6 4.597 5.377 -0.780 1
1 5 . 15 1 1 A 6 6 SER C C 6 174.637 173.310 1.327 1
1 6 . 15 1 1 A 6 6 SER CA C 6 58.469 57.293 1.176 1
1 7 . 15 1 1 A 6 6 SER CB C 6 64.221 66.625 -2.404 1
1 8 . 15 1 1 A 6 6 SER N N 6 117.887 116.447 1.440 1
1 9 . 15 1 1 A 7 7 GLY H H 7 8.280 8.307 -0.027 1
1 10 . 15 1 1 A 7 7 GLY HA2 H 7 4.063 4.186 -0.123 1
1 11 . 15 1 1 A 7 7 GLY HA3 H 7 4.063 4.187 -0.124 1
1 12 . 15 1 1 A 7 7 GLY C C 7 173.724 174.542 -0.818 1
1 13 . 15 1 1 A 7 7 GLY CA C 7 44.941 45.410 -0.469 1
1 14 . 15 1 1 A 7 7 GLY N N 7 110.151 110.162 -0.011 1
1 15 . 15 1 1 A 8 8 THR H H 8 8.212 7.783 0.429 1
1 16 . 15 1 1 A 8 8 THR HA H 8 4.173 4.372 -0.199 1
1 21 . 15 1 1 A 8 8 THR C C 8 174.723 174.022 0.701 1
1 22 . 15 1 1 A 8 8 THR CA C 8 63.622 63.644 -0.022 1
1 23 . 15 1 1 A 8 8 THR CB C 8 69.460 69.311 0.149 1
1 25 . 15 1 1 A 8 8 THR N N 8 116.817 116.069 0.748 1
1 26 . 15 1 1 A 9 9 LEU H H 9 9.374 8.972 0.402 1
1 27 . 15 1 1 A 9 9 LEU HA H 9 4.302 4.276 0.026 1
1 37 . 15 1 1 A 9 9 LEU C C 9 177.468 176.519 0.949 1
1 38 . 15 1 1 A 9 9 LEU CA C 9 55.936 56.212 -0.276 1
1 39 . 15 1 1 A 9 9 LEU CB C 9 42.843 42.824 0.019 1
1 43 . 15 1 1 A 9 9 LEU N N 9 127.798 128.675 -0.877 1
1 44 . 15 1 1 A 10 10 ARG H H 10 7.512 7.532 -0.020 1
1 45 . 15 1 1 A 10 10 ARG HA H 10 4.199 4.722 -0.523 1
1 52 . 15 1 1 A 10 10 ARG C C 10 172.501 173.957 -1.456 1
1 53 . 15 1 1 A 10 10 ARG CA C 10 56.165 54.418 1.747 1
1 54 . 15 1 1 A 10 10 ARG CB C 10 32.442 33.460 -1.018 1
1 57 . 15 1 1 A 10 10 ARG N N 10 117.979 116.597 1.382 1
1 58 . 15 1 1 A 11 11 GLU H H 11 8.434 8.766 -0.332 1
1 59 . 15 1 1 A 11 11 GLU HA H 11 5.993 5.629 0.364 1
1 64 . 15 1 1 A 11 11 GLU C C 11 174.800 174.598 0.202 1
1 65 . 15 1 1 A 11 11 GLU CA C 11 54.570 55.180 -0.610 1
1 66 . 15 1 1 A 11 11 GLU CB C 11 34.245 33.142 1.103 1
1 68 . 15 1 1 A 11 11 GLU N N 11 120.782 121.335 -0.553 1
1 69 . 15 1 1 A 12 12 GLY H H 12 8.131 8.043 0.088 1
1 70 . 15 1 1 A 12 12 GLY HA2 H 12 4.714 3.501 1.213 1
1 71 . 15 1 1 A 12 12 GLY HA3 H 12 3.763 4.143 -0.380 1
1 72 . 15 1 1 A 12 12 GLY C C 12 171.060 171.651 -0.591 1
1 73 . 15 1 1 A 12 12 GLY CA C 12 45.241 45.205 0.036 1
1 74 . 15 1 1 A 12 12 GLY N N 12 107.457 106.261 1.196 1
1 75 . 15 1 1 A 13 13 TRP H H 13 8.783 8.559 0.224 1
1 76 . 15 1 1 A 13 13 TRP HA H 13 5.152 4.920 0.232 1
1 85 . 15 1 1 A 13 13 TRP C C 13 177.528 176.617 0.911 1
1 86 . 15 1 1 A 13 13 TRP CA C 13 57.783 58.775 -0.992 1
1 87 . 15 1 1 A 13 13 TRP CB C 13 30.222 30.178 0.044 1
1 93 . 15 1 1 A 13 13 TRP N N 13 120.792 121.328 -0.536 1
1 95 . 15 1 1 A 14 14 VAL H H 14 9.179 8.830 0.349 1
1 96 . 15 1 1 A 14 14 VAL HA H 14 4.072 4.586 -0.514 1
1 104 . 15 1 1 A 14 14 VAL C C 14 174.981 173.547 1.434 1
1 105 . 15 1 1 A 14 14 VAL CA C 14 61.741 60.012 1.729 1
1 106 . 15 1 1 A 14 14 VAL CB C 14 35.143 35.244 -0.101 1
1 109 . 15 1 1 A 14 14 VAL N N 14 125.476 122.938 2.538 1
1 110 . 15 1 1 A 15 15 VAL H H 15 8.403 8.793 -0.390 1
1 111 . 15 1 1 A 15 15 VAL HA H 15 5.532 5.340 0.192 1
1 119 . 15 1 1 A 15 15 VAL C C 15 175.078 173.975 1.103 1
1 120 . 15 1 1 A 15 15 VAL CA C 15 59.489 59.598 -0.109 1
1 121 . 15 1 1 A 15 15 VAL CB C 15 34.210 35.510 -1.300 1
1 124 . 15 1 1 A 15 15 VAL N N 15 126.189 124.654 1.535 1
1 125 . 15 1 1 A 16 16 HIS H H 16 9.122 8.563 0.559 1
1 126 . 15 1 1 A 16 16 HIS HA H 16 5.823 5.475 0.348 1
1 131 . 15 1 1 A 16 16 HIS C C 16 172.998 172.780 0.218 1
1 132 . 15 1 1 A 16 16 HIS CA C 16 56.253 53.986 2.267 1
1 133 . 15 1 1 A 16 16 HIS CB C 16 34.273 32.849 1.424 1
1 136 . 15 1 1 A 16 16 HIS N N 16 121.152 120.073 1.079 1
1 137 . 15 1 1 A 17 17 TYR H H 17 8.465 8.665 -0.200 1
1 138 . 15 1 1 A 17 17 TYR HA H 17 5.096 4.838 0.258 1
1 145 . 15 1 1 A 17 17 TYR C C 17 173.640 173.259 0.381 1
1 146 . 15 1 1 A 17 17 TYR CA C 17 56.903 56.759 0.144 1
1 147 . 15 1 1 A 17 17 TYR CB C 17 40.103 40.403 -0.300 1
1 152 . 15 1 1 A 17 17 TYR N N 17 115.558 116.594 -1.036 1
1 153 . 15 1 1 A 18 18 SER H H 18 9.122 8.659 0.463 1
1 154 . 15 1 1 A 18 18 SER HA H 18 6.144 5.293 0.851 1
1 157 . 15 1 1 A 18 18 SER C C 18 173.204 175.316 -2.112 1
1 158 . 15 1 1 A 18 18 SER CA C 18 56.640 57.091 -0.451 1
1 159 . 15 1 1 A 18 18 SER CB C 18 68.788 66.266 2.522 1
1 160 . 15 1 1 A 18 18 SER N N 18 118.846 116.142 2.704 1
1 161 . 15 1 1 A 19 19 ASN H H 19 9.053 8.693 0.360 1
1 162 . 15 1 1 A 19 19 ASN HA H 19 4.473 5.022 -0.549 1
1 167 . 15 1 1 A 19 19 ASN C C 19 175.396 175.964 -0.568 1
1 168 . 15 1 1 A 19 19 ASN CA C 19 55.373 52.129 3.244 1
1 169 . 15 1 1 A 19 19 ASN CB C 19 36.900 38.118 -1.218 1
1 170 . 15 1 1 A 19 19 ASN N N 19 113.712 117.805 -4.093 1
1 172 . 15 1 1 A 20 20 LYS H H 20 7.677 8.113 -0.436 1
1 173 . 15 1 1 A 20 20 LYS HA H 20 4.413 4.639 -0.226 1
1 182 . 15 1 1 A 20 20 LYS C C 20 176.078 176.883 -0.805 1
1 183 . 15 1 1 A 20 20 LYS CA C 20 55.679 56.870 -1.191 1
1 184 . 15 1 1 A 20 20 LYS CB C 20 33.023 34.470 -1.447 1
1 188 . 15 1 1 A 20 20 LYS N N 20 117.213 117.037 0.176 1
1 189 . 15 1 1 A 21 21 ASP H H 21 7.395 7.863 -0.468 1
1 190 . 15 1 1 A 21 21 ASP HA H 21 4.808 4.810 -0.002 1
1 193 . 15 1 1 A 21 21 ASP C C 21 176.413 175.888 0.525 1
1 194 . 15 1 1 A 21 21 ASP CA C 21 53.983 53.806 0.177 1
1 195 . 15 1 1 A 21 21 ASP CB C 21 41.199 42.101 -0.902 1
1 196 . 15 1 1 A 21 21 ASP N N 21 119.879 117.994 1.885 1
1 197 . 15 1 1 A 22 22 THR H H 22 8.593 8.105 0.488 1
1 198 . 15 1 1 A 22 22 THR HA H 22 4.352 4.167 0.185 1
1 203 . 15 1 1 A 22 22 THR C C 22 172.913 173.679 -0.766 1
1 204 . 15 1 1 A 22 22 THR CA C 22 62.691 62.919 -0.228 1
1 205 . 15 1 1 A 22 22 THR CB C 22 68.332 66.544 1.788 1
1 207 . 15 1 1 A 22 22 THR N N 22 116.299 112.676 3.623 1
1 208 . 15 1 1 A 23 23 LEU H H 23 7.645 7.968 -0.323 1
1 209 . 15 1 1 A 23 23 LEU HA H 23 4.318 4.380 -0.062 1
1 219 . 15 1 1 A 23 23 LEU C C 23 176.692 175.780 0.912 1
1 220 . 15 1 1 A 23 23 LEU CA C 23 54.617 54.095 0.522 1
1 221 . 15 1 1 A 23 23 LEU CB C 23 41.939 40.281 1.658 1
1 225 . 15 1 1 A 23 23 LEU N N 23 123.606 122.102 1.504 1
1 226 . 15 1 1 A 24 24 ARG H H 24 8.563 7.645 0.918 1
1 227 . 15 1 1 A 24 24 ARG HA H 24 4.373 4.453 -0.080 1
1 235 . 15 1 1 A 24 24 ARG C C 24 176.584 175.857 0.727 1
1 236 . 15 1 1 A 24 24 ARG CA C 24 57.854 56.566 1.288 1
1 237 . 15 1 1 A 24 24 ARG CB C 24 31.126 30.418 0.708 1
1 240 . 15 1 1 A 24 24 ARG N N 24 127.152 123.346 3.806 1
1 242 . 15 1 1 A 25 25 LYS H H 25 8.633 8.275 0.358 1
1 243 . 15 1 1 A 25 25 LYS HA H 25 4.513 4.947 -0.434 1
1 251 . 15 1 1 A 25 25 LYS C C 25 173.567 174.141 -0.574 1
1 252 . 15 1 1 A 25 25 LYS CA C 25 54.792 54.320 0.472 1
1 253 . 15 1 1 A 25 25 LYS CB C 25 37.416 35.749 1.667 1
1 257 . 15 1 1 A 25 25 LYS N N 25 122.682 120.776 1.906 1
1 258 . 15 1 1 A 26 26 ARG H H 26 8.303 8.662 -0.359 1
1 259 . 15 1 1 A 26 26 ARG HA H 26 5.153 5.266 -0.113 1
1 266 . 15 1 1 A 26 26 ARG C C 26 174.554 174.707 -0.153 1
1 267 . 15 1 1 A 26 26 ARG CA C 26 55.083 54.421 0.662 1
1 268 . 15 1 1 A 26 26 ARG CB C 26 32.789 32.899 -0.110 1
1 271 . 15 1 1 A 26 26 ARG N N 26 121.819 123.090 -1.271 1
1 272 . 15 1 1 A 27 27 HIS H H 27 8.793 9.189 -0.396 1
1 273 . 15 1 1 A 27 27 HIS HA H 27 5.155 5.490 -0.335 1
1 278 . 15 1 1 A 27 27 HIS CA C 27 56.904 55.115 1.789 1
1 279 . 15 1 1 A 27 27 HIS CB C 27 34.683 31.524 3.159 1
1 282 . 15 1 1 A 27 27 HIS N N 27 122.102 120.705 1.397 1
1 283 . 15 1 1 A 28 28 TYR H H 28 9.273 8.141 1.132 1
1 284 . 15 1 1 A 28 28 TYR HA H 28 4.332 4.248 0.084 1
1 291 . 15 1 1 A 28 28 TYR C C 28 174.730 174.925 -0.195 1
1 292 . 15 1 1 A 28 28 TYR CA C 28 58.680 57.301 1.379 1
1 293 . 15 1 1 A 28 28 TYR CB C 28 38.673 37.844 0.829 1
1 298 . 15 1 1 A 28 28 TYR N N 28 125.605 121.491 4.114 1
1 299 . 15 1 1 A 29 29 TRP H H 29 9.273 8.916 0.357 1
1 300 . 15 1 1 A 29 29 TRP HA H 29 5.543 4.898 0.645 1
1 309 . 15 1 1 A 29 29 TRP C C 29 176.172 176.911 -0.739 1
1 310 . 15 1 1 A 29 29 TRP CA C 29 56.658 57.489 -0.831 1
1 311 . 15 1 1 A 29 29 TRP CB C 29 32.154 30.812 1.342 1
1 317 . 15 1 1 A 29 29 TRP N N 29 131.340 128.307 3.033 1
1 318 . 15 1 1 A 30 30 ARG H H 30 9.164 9.271 -0.107 1
1 319 . 15 1 1 A 30 30 ARG HA H 30 5.302 5.181 0.121 1
1 327 . 15 1 1 A 30 30 ARG C C 30 174.774 174.319 0.455 1
1 328 . 15 1 1 A 30 30 ARG CA C 30 56.271 55.054 1.217 1
1 329 . 15 1 1 A 30 30 ARG CB C 30 34.203 32.917 1.286 1
1 332 . 15 1 1 A 30 30 ARG N N 30 116.040 122.115 -6.075 1
1 334 . 15 1 1 A 31 31 LEU H H 31 9.273 9.467 -0.194 1
1 335 . 15 1 1 A 31 31 LEU HA H 31 5.324 5.359 -0.035 1
1 345 . 15 1 1 A 31 31 LEU C C 31 174.488 174.311 0.177 1
1 346 . 15 1 1 A 31 31 LEU CA C 31 53.807 53.538 0.269 1
1 347 . 15 1 1 A 31 31 LEU CB C 31 46.667 45.528 1.139 1
1 351 . 15 1 1 A 31 31 LEU N N 31 127.075 126.794 0.281 1
1 352 . 15 1 1 A 32 32 ASP H H 32 8.854 8.726 0.128 1
1 353 . 15 1 1 A 32 32 ASP HA H 32 4.902 5.046 -0.144 1
1 356 . 15 1 1 A 32 32 ASP C C 32 173.474 176.940 -3.466 1
1 357 . 15 1 1 A 32 32 ASP CA C 32 53.104 52.236 0.868 1
1 358 . 15 1 1 A 32 32 ASP CB C 32 42.931 44.056 -1.125 1
1 359 . 15 1 1 A 32 32 ASP N N 32 129.349 125.438 3.911 1
1 360 . 15 1 1 A 33 33 CYS H H 33 8.153 8.787 -0.634 1
1 361 . 15 1 1 A 33 33 CYS HA H 33 4.323 4.323 0.000 1
1 364 . 15 1 1 A 33 33 CYS C C 33 174.476 174.639 -0.163 1
1 365 . 15 1 1 A 33 33 CYS CA C 33 59.853 60.726 -0.873 1
1 366 . 15 1 1 A 33 33 CYS CB C 33 27.508 27.078 0.430 1
1 367 . 15 1 1 A 33 33 CYS N N 33 108.439 118.932 -10.493 1
1 368 . 15 1 1 A 34 34 LYS H H 34 9.144 7.838 1.306 1
1 369 . 15 1 1 A 34 34 LYS HA H 34 4.616 4.358 0.258 1
1 378 . 15 1 1 A 34 34 LYS C C 34 177.601 176.351 1.250 1
1 379 . 15 1 1 A 34 34 LYS CA C 34 57.185 56.882 0.303 1
1 380 . 15 1 1 A 34 34 LYS CB C 34 35.623 34.368 1.255 1
1 384 . 15 1 1 A 34 34 LYS N N 34 119.884 118.101 1.783 1
1 385 . 15 1 1 A 35 35 CYS H H 35 9.102 7.732 1.370 1
1 386 . 15 1 1 A 35 35 CYS HA H 35 4.935 4.835 0.100 1
1 389 . 15 1 1 A 35 35 CYS C C 35 172.283 172.305 -0.022 1
1 390 . 15 1 1 A 35 35 CYS CA C 35 57.748 56.748 1.000 1
1 391 . 15 1 1 A 35 35 CYS CB C 35 31.537 30.692 0.845 1
1 392 . 15 1 1 A 35 35 CYS N N 35 120.317 113.421 6.896 1
1 393 . 15 1 1 A 36 36 ILE H H 36 8.213 8.903 -0.690 1
1 394 . 15 1 1 A 36 36 ILE HA H 36 4.617 4.999 -0.382 1
1 404 . 15 1 1 A 36 36 ILE C C 36 175.312 175.257 0.055 1
1 405 . 15 1 1 A 36 36 ILE CA C 36 60.967 60.498 0.469 1
1 406 . 15 1 1 A 36 36 ILE CB C 36 39.718 38.005 1.713 1
1 410 . 15 1 1 A 36 36 ILE N N 36 121.905 120.840 1.065 1
1 411 . 15 1 1 A 37 37 THR H H 37 9.076 8.658 0.418 1
1 412 . 15 1 1 A 37 37 THR HA H 37 4.364 4.511 -0.147 1
1 417 . 15 1 1 A 37 37 THR CA C 37 61.834 62.322 -0.488 1
1 418 . 15 1 1 A 37 37 THR CB C 37 69.237 70.069 -0.832 1
1 420 . 15 1 1 A 37 37 THR N N 37 122.500 123.684 -1.184 1
1 421 . 15 1 1 A 38 38 LEU H H 38 8.263 8.806 -0.543 1
1 422 . 15 1 1 A 38 38 LEU HA H 38 4.445 5.202 -0.757 1
1 432 . 15 1 1 A 38 38 LEU CA C 38 55.611 53.622 1.989 1
1 433 . 15 1 1 A 38 38 LEU CB C 38 42.702 45.494 -2.792 1
1 437 . 15 1 1 A 38 38 LEU N N 38 126.987 123.551 3.436 1
1 438 . 15 1 1 A 39 39 PHE H H 39 9.520 8.663 0.857 1
1 439 . 15 1 1 A 39 39 PHE HA H 39 4.998 5.042 -0.044 1
1 447 . 15 1 1 A 39 39 PHE CA C 39 57.331 56.324 1.007 1
1 448 . 15 1 1 A 39 39 PHE CB C 39 42.453 41.134 1.319 1
1 454 . 15 1 1 A 39 39 PHE N N 39 120.545 120.577 -0.032 1
1 455 . 15 1 1 A 40 40 GLN H H 40 9.878 8.989 0.889 1
1 456 . 15 1 1 A 40 40 GLN HA H 40 4.376 4.024 0.352 1
1 463 . 15 1 1 A 40 40 GLN CA C 40 59.513 59.776 -0.263 1
1 464 . 15 1 1 A 40 40 GLN CB C 40 29.317 28.899 0.418 1
1 467 . 15 1 1 A 41 41 ASN H H 41 7.732 8.033 -0.301 1
1 468 . 15 1 1 A 41 41 ASN HA H 41 4.812 5.491 -0.679 1
1 473 . 15 1 1 A 41 41 ASN CA C 41 52.618 51.411 1.207 1
1 474 . 15 1 1 A 41 41 ASN CB C 41 39.362 40.978 -1.616 1
1 475 . 15 1 1 A 41 41 ASN N N 41 107.613 113.239 -5.626 1
1 477 . 15 1 1 A 42 42 ASN HA H 42 3.476 4.126 -0.650 1
1 482 . 15 1 1 A 42 42 ASN C C 42 173.607 175.673 -2.066 1
1 483 . 15 1 1 A 42 42 ASN CA C 42 54.888 55.258 -0.370 1
1 484 . 15 1 1 A 42 42 ASN CB C 42 35.613 37.495 -1.882 1
1 486 . 15 1 1 A 43 43 THR H H 43 8.394 7.981 0.413 1
1 487 . 15 1 1 A 43 43 THR HA H 43 4.403 4.581 -0.178 1
1 492 . 15 1 1 A 43 43 THR C C 43 174.464 173.563 0.901 1
1 493 . 15 1 1 A 43 43 THR CA C 43 61.978 61.006 0.972 1
1 494 . 15 1 1 A 43 43 THR CB C 43 70.036 69.557 0.479 1
1 496 . 15 1 1 A 43 43 THR N N 43 111.795 113.569 -1.774 1
1 497 . 15 1 1 A 44 44 THR H H 44 8.058 7.864 0.194 1
1 498 . 15 1 1 A 44 44 THR HA H 44 4.464 4.783 -0.319 1
1 503 . 15 1 1 A 44 44 THR CA C 44 61.599 60.483 1.116 1
1 504 . 15 1 1 A 44 44 THR CB C 44 69.137 69.903 -0.766 1
1 506 . 15 1 1 A 44 44 THR N N 44 116.514 118.329 -1.815 1
1 507 . 15 1 1 A 45 45 ASN H H 45 6.653 8.788 -2.135 1
1 508 . 15 1 1 A 45 45 ASN HA H 45 4.945 4.630 0.315 1
1 513 . 15 1 1 A 45 45 ASN CA C 45 53.227 56.578 -3.351 1
1 514 . 15 1 1 A 45 45 ASN CB C 45 38.483 38.706 -0.223 1
1 516 . 15 1 1 A 46 46 ARG H H 46 8.213 7.838 0.375 1
1 517 . 15 1 1 A 46 46 ARG HA H 46 4.583 4.494 0.089 1
1 524 . 15 1 1 A 46 46 ARG CA C 46 55.487 56.158 -0.671 1
1 525 . 15 1 1 A 46 46 ARG CB C 46 31.153 30.309 0.844 1
1 528 . 15 1 1 A 46 46 ARG N N 46 121.652 117.869 3.783 1
1 529 . 15 1 1 A 47 47 TYR H H 47 7.973 8.882 -0.909 1
1 536 . 15 1 1 A 47 47 TYR CB C 47 39.356 39.612 -0.256 1
1 541 . 15 1 1 A 48 48 TYR H H 48 9.023 8.873 0.150 1
1 542 . 15 1 1 A 48 48 TYR HA H 48 4.662 4.370 0.292 1
1 549 . 15 1 1 A 48 48 TYR CB C 48 39.863 40.453 -0.590 1
1 554 . 15 1 1 A 48 48 TYR N N 48 121.223 120.710 0.513 1
1 555 . 15 1 1 A 49 49 LYS H H 49 7.134 7.673 -0.539 1
1 556 . 15 1 1 A 49 49 LYS HA H 49 4.283 4.748 -0.465 1
1 565 . 15 1 1 A 49 49 LYS CA C 49 55.167 55.392 -0.225 1
1 566 . 15 1 1 A 49 49 LYS CB C 49 36.699 36.115 0.584 1
1 570 . 15 1 1 A 49 49 LYS N N 49 117.339 118.322 -0.983 1
1 571 . 15 1 1 A 50 50 GLU H H 50 8.411 8.750 -0.339 1
1 572 . 15 1 1 A 50 50 GLU HA H 50 4.583 4.939 -0.356 1
1 577 . 15 1 1 A 50 50 GLU CA C 50 54.592 55.229 -0.637 1
1 578 . 15 1 1 A 50 50 GLU CB C 50 33.263 32.935 0.328 1
1 580 . 15 1 1 A 50 50 GLU N N 50 123.825 123.689 0.136 1
1 581 . 15 1 1 A 51 51 ILE H H 51 9.225 8.959 0.266 1
1 582 . 15 1 1 A 51 51 ILE HA H 51 4.277 4.621 -0.344 1
1 592 . 15 1 1 A 51 51 ILE CA C 51 58.182 58.110 0.072 1
1 593 . 15 1 1 A 51 51 ILE CB C 51 39.663 38.267 1.396 1
1 597 . 15 1 1 A 51 51 ILE N N 51 125.271 126.614 -1.343 1
1 598 . 15 1 1 A 52 52 PRO HA H 52 4.543 4.597 -0.054 1
1 605 . 15 1 1 A 52 52 PRO C C 52 178.340 178.009 0.331 1
1 606 . 15 1 1 A 52 52 PRO CA C 52 62.726 62.871 -0.145 1
1 607 . 15 1 1 A 52 52 PRO CB C 52 32.003 31.695 0.308 1
1 610 . 15 1 1 A 53 53 LEU H H 53 8.723 8.504 0.219 1
1 611 . 15 1 1 A 53 53 LEU HA H 53 3.891 3.875 0.016 1
1 621 . 15 1 1 A 53 53 LEU C C 53 179.673 178.986 0.687 1
1 622 . 15 1 1 A 53 53 LEU CA C 53 58.205 57.595 0.610 1
1 623 . 15 1 1 A 53 53 LEU CB C 53 40.171 41.463 -1.292 1
1 627 . 15 1 1 A 53 53 LEU N N 53 125.150 124.343 0.807 1
1 628 . 15 1 1 A 54 54 SER H H 54 8.360 8.108 0.252 1
1 629 . 15 1 1 A 54 54 SER HA H 54 4.164 4.065 0.099 1
1 632 . 15 1 1 A 54 54 SER C C 54 175.517 177.382 -1.865 1
1 633 . 15 1 1 A 54 54 SER CA C 54 60.193 61.442 -1.249 1
1 634 . 15 1 1 A 54 54 SER CB C 54 62.617 62.853 -0.236 1
1 635 . 15 1 1 A 54 54 SER N N 54 111.266 114.499 -3.233 1
1 636 . 15 1 1 A 55 55 GLU H H 55 7.666 8.209 -0.543 1
1 637 . 15 1 1 A 55 55 GLU HA H 55 4.363 4.108 0.255 1
1 642 . 15 1 1 A 55 55 GLU C C 55 176.753 177.824 -1.071 1
1 643 . 15 1 1 A 55 55 GLU CA C 55 56.200 59.189 -2.989 1
1 644 . 15 1 1 A 55 55 GLU CB C 55 30.526 29.065 1.461 1
1 646 . 15 1 1 A 55 55 GLU N N 55 119.485 120.175 -0.690 1
1 647 . 15 1 1 A 56 56 ILE H H 56 7.601 7.126 0.475 1
1 648 . 15 1 1 A 56 56 ILE HA H 56 3.793 3.921 -0.128 1
1 658 . 15 1 1 A 56 56 ILE C C 56 175.142 176.072 -0.930 1
1 659 . 15 1 1 A 56 56 ILE CA C 56 63.518 62.514 1.004 1
1 660 . 15 1 1 A 56 56 ILE CB C 56 37.169 37.906 -0.737 1
1 664 . 15 1 1 A 56 56 ILE N N 56 120.430 119.869 0.561 1
1 665 . 15 1 1 A 57 57 LEU H H 57 9.263 9.302 -0.039 1
1 666 . 15 1 1 A 57 57 LEU HA H 57 4.343 4.362 -0.019 1
1 676 . 15 1 1 A 57 57 LEU C C 57 177.898 176.540 1.358 1
1 677 . 15 1 1 A 57 57 LEU CA C 57 56.569 55.876 0.693 1
1 678 . 15 1 1 A 57 57 LEU CB C 57 41.980 42.585 -0.605 1
1 682 . 15 1 1 A 57 57 LEU N N 57 129.464 129.327 0.137 1
1 683 . 15 1 1 A 58 58 THR H H 58 7.414 7.355 0.059 1
1 684 . 15 1 1 A 58 58 THR HA H 58 4.512 4.871 -0.359 1
1 689 . 15 1 1 A 58 58 THR C C 58 171.314 172.722 -1.408 1
1 690 . 15 1 1 A 58 58 THR CA C 58 60.562 61.267 -0.705 1
1 691 . 15 1 1 A 58 58 THR CB C 58 70.803 73.460 -2.657 1
1 693 . 15 1 1 A 58 58 THR N N 58 109.129 110.890 -1.761 1
1 694 . 15 1 1 A 59 59 VAL H H 59 8.152 8.496 -0.344 1
1 695 . 15 1 1 A 59 59 VAL HA H 59 5.061 5.074 -0.013 1
1 703 . 15 1 1 A 59 59 VAL C C 59 174.985 174.993 -0.008 1
1 704 . 15 1 1 A 59 59 VAL CA C 59 61.354 61.146 0.208 1
1 705 . 15 1 1 A 59 59 VAL CB C 59 33.855 33.950 -0.095 1
1 708 . 15 1 1 A 59 59 VAL N N 59 123.676 124.640 -0.964 1
1 709 . 15 1 1 A 60 60 GLU H H 60 9.074 8.782 0.292 1
1 710 . 15 1 1 A 60 60 GLU HA H 60 4.977 4.853 0.124 1
1 715 . 15 1 1 A 60 60 GLU C C 60 176.063 175.039 1.024 1
1 716 . 15 1 1 A 60 60 GLU CA C 60 53.807 54.226 -0.419 1
1 717 . 15 1 1 A 60 60 GLU CB C 60 33.739 33.714 0.025 1
1 719 . 15 1 1 A 60 60 GLU N N 60 125.125 126.084 -0.959 1
1 720 . 15 1 1 A 61 61 SER H H 61 8.763 8.803 -0.040 1
1 721 . 15 1 1 A 61 61 SER HA H 61 4.452 5.011 -0.559 1
1 724 . 15 1 1 A 61 61 SER C C 61 173.288 174.213 -0.925 1
1 725 . 15 1 1 A 61 61 SER CA C 61 59.384 57.988 1.396 1
1 726 . 15 1 1 A 61 61 SER CB C 61 63.390 64.552 -1.162 1
1 727 . 15 1 1 A 61 61 SER N N 61 117.523 118.470 -0.947 1
1 728 . 15 1 1 A 62 62 ALA H H 62 7.293 8.773 -1.480 1
1 729 . 15 1 1 A 62 62 ALA HA H 62 3.817 4.233 -0.416 1
1 733 . 15 1 1 A 62 62 ALA C C 62 176.717 177.627 -0.910 1
1 734 . 15 1 1 A 62 62 ALA CA C 62 53.966 52.995 0.971 1
1 735 . 15 1 1 A 62 62 ALA CB C 62 18.640 18.817 -0.177 1
1 736 . 15 1 1 A 62 62 ALA N N 62 122.650 127.628 -4.978 1
1 737 . 15 1 1 A 63 63 GLN H H 63 8.736 8.241 0.495 1
1 738 . 15 1 1 A 63 63 GLN HA H 63 4.445 4.702 -0.257 1
1 745 . 15 1 1 A 63 63 GLN C C 63 173.700 174.767 -1.067 1
1 746 . 15 1 1 A 63 63 GLN CA C 63 56.376 55.710 0.666 1
1 747 . 15 1 1 A 63 63 GLN CB C 63 31.515 30.999 0.516 1
1 749 . 15 1 1 A 63 63 GLN N N 63 120.251 119.699 0.552 1
1 751 . 15 1 1 A 64 64 ASN H H 64 9.272 7.222 2.050 1
1 752 . 15 1 1 A 64 64 ASN HA H 64 4.906 5.087 -0.181 1
1 757 . 15 1 1 A 64 64 ASN C C 64 174.754 174.994 -0.240 1
1 758 . 15 1 1 A 64 64 ASN CA C 64 51.837 51.891 -0.054 1
1 759 . 15 1 1 A 64 64 ASN CB C 64 38.156 40.467 -2.311 1
1 760 . 15 1 1 A 64 64 ASN N N 64 122.346 118.453 3.893 1
1 762 . 15 1 1 A 65 65 PHE H H 65 8.854 9.045 -0.191 1
1 763 . 15 1 1 A 65 65 PHE HA H 65 4.947 5.184 -0.237 1
1 771 . 15 1 1 A 65 65 PHE C C 65 177.274 176.384 0.890 1
1 772 . 15 1 1 A 65 65 PHE CA C 65 57.519 57.169 0.350 1
1 773 . 15 1 1 A 65 65 PHE CB C 65 38.485 38.979 -0.494 1
1 779 . 15 1 1 A 65 65 PHE N N 65 123.638 125.594 -1.956 1
1 780 . 15 1 1 A 66 66 SER H H 66 8.163 8.148 0.015 1
1 781 . 15 1 1 A 66 66 SER HA H 66 4.393 4.298 0.095 1
1 784 . 15 1 1 A 66 66 SER C C 66 175.699 177.407 -1.708 1
1 785 . 15 1 1 A 66 66 SER CA C 66 60.791 61.277 -0.486 1
1 786 . 15 1 1 A 66 66 SER CB C 66 64.591 63.088 1.503 1
1 787 . 15 1 1 A 66 66 SER N N 66 113.913 116.332 -2.419 1
1 788 . 15 1 1 A 67 67 LEU H H 67 8.574 7.809 0.765 1
1 789 . 15 1 1 A 67 67 LEU HA H 67 4.302 3.773 0.529 1
1 799 . 15 1 1 A 67 67 LEU C C 67 176.269 177.337 -1.068 1
1 800 . 15 1 1 A 67 67 LEU CA C 67 55.601 58.198 -2.597 1
1 801 . 15 1 1 A 67 67 LEU CB C 67 42.021 41.896 0.125 1
1 805 . 15 1 1 A 67 67 LEU N N 67 121.264 120.938 0.326 1
1 806 . 15 1 1 A 68 68 VAL H H 68 6.921 7.577 -0.656 1
1 807 . 15 1 1 A 68 68 VAL HA H 68 4.473 4.165 0.308 1
1 815 . 15 1 1 A 68 68 VAL C C 68 173.809 174.953 -1.144 1
1 816 . 15 1 1 A 68 68 VAL CA C 68 58.047 60.648 -2.601 1
1 817 . 15 1 1 A 68 68 VAL CB C 68 32.295 31.977 0.318 1
1 820 . 15 1 1 A 68 68 VAL N N 68 111.287 115.428 -4.141 1
1 821 . 15 1 1 A 69 69 PRO HA H 69 4.658 4.637 0.021 1
1 828 . 15 1 1 A 69 69 PRO CA C 69 61.747 61.659 0.088 1
1 829 . 15 1 1 A 69 69 PRO CB C 69 30.693 32.449 -1.756 1
1 832 . 15 1 1 A 70 70 PRO HA H 70 4.414 4.345 0.069 1
1 839 . 15 1 1 A 70 70 PRO CA C 70 63.997 64.176 -0.179 1
1 840 . 15 1 1 A 70 70 PRO CB C 70 31.602 31.550 0.052 1
1 843 . 15 1 1 A 71 71 GLY H H 71 8.824 8.193 0.631 1
1 844 . 15 1 1 A 71 71 GLY HA2 H 71 3.703 4.015 -0.312 1
1 845 . 15 1 1 A 71 71 GLY HA3 H 71 4.193 4.018 0.175 1
1 846 . 15 1 1 A 71 71 GLY C C 71 174.052 172.973 1.079 1
1 847 . 15 1 1 A 71 71 GLY CA C 71 45.065 45.525 -0.460 1
1 848 . 15 1 1 A 71 71 GLY N N 71 111.845 106.200 5.645 1
1 849 . 15 1 1 A 72 72 THR H H 72 7.597 7.138 0.459 1
1 850 . 15 1 1 A 72 72 THR HA H 72 4.133 4.654 -0.521 1
1 855 . 15 1 1 A 72 72 THR CA C 72 63.129 60.911 2.218 1
1 856 . 15 1 1 A 72 72 THR CB C 72 69.560 71.805 -2.245 1
1 858 . 15 1 1 A 72 72 THR N N 72 117.485 114.386 3.099 1
1 859 . 15 1 1 A 73 73 ASN H H 73 9.280 8.498 0.782 1
1 860 . 15 1 1 A 73 73 ASN HA H 73 4.786 4.617 0.169 1
1 865 . 15 1 1 A 73 73 ASN CA C 73 52.009 52.221 -0.212 1
1 866 . 15 1 1 A 73 73 ASN CB C 73 37.553 38.401 -0.848 1
1 867 . 15 1 1 A 73 73 ASN N N 73 127.641 125.411 2.230 1
1 869 . 15 1 1 A 74 74 PRO HA H 74 4.752 4.891 -0.139 1
1 876 . 15 1 1 A 74 74 PRO C C 74 175.190 176.658 -1.468 1
1 877 . 15 1 1 A 74 74 PRO CA C 74 63.395 62.504 0.891 1
1 878 . 15 1 1 A 74 74 PRO CB C 74 33.164 33.191 -0.027 1
1 881 . 15 1 1 A 75 75 HIS H H 75 8.025 9.094 -1.069 1
1 882 . 15 1 1 A 75 75 HIS HA H 75 5.047 5.129 -0.082 1
1 887 . 15 1 1 A 75 75 HIS C C 75 172.562 175.422 -2.860 1
1 888 . 15 1 1 A 75 75 HIS CA C 75 54.336 53.717 0.619 1
1 889 . 15 1 1 A 75 75 HIS CB C 75 30.956 33.237 -2.281 1
1 892 . 15 1 1 A 75 75 HIS N N 75 116.198 116.601 -0.403 1
1 893 . 15 1 1 A 76 76 CYS H H 76 8.343 9.411 -1.068 1
1 894 . 15 1 1 A 76 76 CYS HA H 76 4.594 4.465 0.129 1
1 897 . 15 1 1 A 76 76 CYS C C 76 175.651 174.851 0.800 1
1 898 . 15 1 1 A 76 76 CYS CA C 76 61.066 61.230 -0.164 1
1 899 . 15 1 1 A 76 76 CYS CB C 76 30.193 28.381 1.812 1
1 900 . 15 1 1 A 76 76 CYS N N 76 113.289 118.120 -4.831 1
1 901 . 15 1 1 A 77 77 PHE H H 77 8.433 8.026 0.407 1
1 902 . 15 1 1 A 77 77 PHE HA H 77 5.105 5.405 -0.300 1
1 910 . 15 1 1 A 77 77 PHE C C 77 171.822 173.027 -1.205 1
1 911 . 15 1 1 A 77 77 PHE CA C 77 56.874 55.663 1.211 1
1 912 . 15 1 1 A 77 77 PHE CB C 77 39.393 43.100 -3.707 1
1 918 . 15 1 1 A 77 77 PHE N N 77 114.874 114.756 0.118 1
1 919 . 15 1 1 A 78 78 GLU H H 78 9.823 9.175 0.648 1
1 920 . 15 1 1 A 78 78 GLU HA H 78 5.333 5.153 0.180 1
1 925 . 15 1 1 A 78 78 GLU C C 78 175.602 175.486 0.116 1
1 926 . 15 1 1 A 78 78 GLU CA C 78 54.212 55.081 -0.869 1
1 927 . 15 1 1 A 78 78 GLU CB C 78 31.702 32.559 -0.857 1
1 929 . 15 1 1 A 78 78 GLU N N 78 121.074 118.880 2.194 1
1 930 . 15 1 1 A 79 79 ILE H H 79 9.093 9.093 0.000 1
1 931 . 15 1 1 A 79 79 ILE HA H 79 4.637 4.606 0.031 1
1 941 . 15 1 1 A 79 79 ILE C C 79 174.476 175.177 -0.701 1
1 942 . 15 1 1 A 79 79 ILE CA C 79 60.932 60.767 0.165 1
1 943 . 15 1 1 A 79 79 ILE CB C 79 40.803 37.326 3.477 1
1 947 . 15 1 1 A 79 79 ILE N N 79 121.382 125.311 -3.929 1
1 948 . 15 1 1 A 80 80 VAL H H 80 8.841 7.878 0.963 1
1 949 . 15 1 1 A 80 80 VAL HA H 80 4.425 3.867 0.558 1
1 957 . 15 1 1 A 80 80 VAL C C 80 175.930 175.314 0.616 1
1 958 . 15 1 1 A 80 80 VAL CA C 80 63.324 63.165 0.159 1
1 959 . 15 1 1 A 80 80 VAL CB C 80 32.783 31.121 1.662 1
1 962 . 15 1 1 A 80 80 VAL N N 80 128.970 127.200 1.770 1
1 963 . 15 1 1 A 81 81 THR H H 81 8.303 7.856 0.447 1
1 964 . 15 1 1 A 81 81 THR HA H 81 5.264 4.650 0.614 1
1 969 . 15 1 1 A 81 81 THR C C 81 173.664 174.564 -0.900 1
1 970 . 15 1 1 A 81 81 THR CA C 81 59.540 59.982 -0.442 1
1 971 . 15 1 1 A 81 81 THR CB C 81 72.197 71.480 0.717 1
1 973 . 15 1 1 A 81 81 THR N N 81 118.077 118.702 -0.625 1
1 974 . 15 1 1 A 82 82 ALA H H 82 9.586 8.464 1.122 1
1 975 . 15 1 1 A 82 82 ALA HA H 82 4.093 4.441 -0.348 1
1 979 . 15 1 1 A 82 82 ALA C C 82 178.667 177.672 0.995 1
1 980 . 15 1 1 A 82 82 ALA CA C 82 55.321 52.711 2.610 1
1 981 . 15 1 1 A 82 82 ALA CB C 82 18.094 18.165 -0.071 1
1 982 . 15 1 1 A 82 82 ALA N N 82 122.493 123.245 -0.752 1
1 983 . 15 1 1 A 83 83 ASN H H 83 7.923 8.444 -0.521 1
1 984 . 15 1 1 A 83 83 ASN HA H 83 4.808 5.098 -0.290 1
1 989 . 15 1 1 A 83 83 ASN C C 83 174.766 174.494 0.272 1
1 990 . 15 1 1 A 83 83 ASN CA C 83 53.333 54.621 -1.288 1
1 991 . 15 1 1 A 83 83 ASN CB C 83 40.335 41.809 -1.474 1
1 992 . 15 1 1 A 83 83 ASN N N 83 110.765 115.918 -5.153 1
1 994 . 15 1 1 A 84 84 ALA H H 84 7.352 7.171 0.181 1
1 995 . 15 1 1 A 84 84 ALA HA H 84 4.625 4.528 0.097 1
1 999 . 15 1 1 A 84 84 ALA C C 84 176.547 175.139 1.408 1
1 1000 . 15 1 1 A 84 84 ALA CA C 84 52.858 51.884 0.974 1
1 1001 . 15 1 1 A 84 84 ALA CB C 84 21.233 22.100 -0.867 1
1 1002 . 15 1 1 A 84 84 ALA N N 84 119.599 117.741 1.858 1
1 1003 . 15 1 1 A 85 85 THR H H 85 8.374 8.633 -0.259 1
1 1004 . 15 1 1 A 85 85 THR HA H 85 5.014 4.592 0.422 1
1 1009 . 15 1 1 A 85 85 THR C C 85 171.568 174.189 -2.621 1
1 1010 . 15 1 1 A 85 85 THR CA C 85 61.618 62.710 -1.092 1
1 1011 . 15 1 1 A 85 85 THR CB C 85 70.850 69.208 1.642 1
1 1013 . 15 1 1 A 85 85 THR N N 85 119.032 113.851 5.181 1
1 1014 . 15 1 1 A 86 86 TYR H H 86 9.006 9.083 -0.077 1
1 1015 . 15 1 1 A 86 86 TYR HA H 86 4.658 4.907 -0.249 1
1 1022 . 15 1 1 A 86 86 TYR C C 86 173.773 175.234 -1.461 1
1 1023 . 15 1 1 A 86 86 TYR CA C 86 56.938 57.541 -0.603 1
1 1024 . 15 1 1 A 86 86 TYR CB C 86 39.513 40.235 -0.722 1
1 1029 . 15 1 1 A 86 86 TYR N N 86 123.494 127.018 -3.524 1
1 1030 . 15 1 1 A 87 87 PHE H H 87 9.263 8.696 0.567 1
1 1031 . 15 1 1 A 87 87 PHE HA H 87 4.127 4.678 -0.551 1
1 1039 . 15 1 1 A 87 87 PHE C C 87 176.369 174.127 2.242 1
1 1040 . 15 1 1 A 87 87 PHE CA C 87 57.238 55.517 1.721 1
1 1041 . 15 1 1 A 87 87 PHE CB C 87 37.086 38.286 -1.200 1
1 1047 . 15 1 1 A 87 87 PHE N N 87 125.384 119.970 5.414 1
1 1048 . 15 1 1 A 88 88 VAL H H 88 9.023 8.306 0.717 1
1 1049 . 15 1 1 A 88 88 VAL HA H 88 4.162 4.414 -0.252 1
1 1057 . 15 1 1 A 88 88 VAL C C 88 176.390 175.816 0.574 1
1 1058 . 15 1 1 A 88 88 VAL CA C 88 63.975 60.602 3.373 1
1 1059 . 15 1 1 A 88 88 VAL CB C 88 32.378 31.593 0.785 1
1 1062 . 15 1 1 A 88 88 VAL N N 88 127.348 124.216 3.132 1
1 1063 . 15 1 1 A 89 89 GLY H H 89 9.233 7.716 1.517 1
1 1064 . 15 1 1 A 89 89 GLY HA2 H 89 4.293 4.205 0.088 1
1 1065 . 15 1 1 A 89 89 GLY HA3 H 89 4.186 4.268 -0.082 1
1 1066 . 15 1 1 A 89 89 GLY C C 89 172.378 171.442 0.936 1
1 1067 . 15 1 1 A 89 89 GLY CA C 89 43.798 46.252 -2.454 1
1 1068 . 15 1 1 A 89 89 GLY N N 89 116.041 112.681 3.360 1
1 1069 . 15 1 1 A 90 90 GLU H H 90 8.532 8.446 0.086 1
1 1070 . 15 1 1 A 90 90 GLU HA H 90 4.794 5.004 -0.210 1
1 1075 . 15 1 1 A 90 90 GLU C C 90 174.221 175.247 -1.026 1
1 1076 . 15 1 1 A 90 90 GLU CA C 90 56.393 54.883 1.510 1
1 1077 . 15 1 1 A 90 90 GLU CB C 90 33.182 33.141 0.041 1
1 1079 . 15 1 1 A 90 90 GLU N N 90 120.905 124.006 -3.101 1
1 1080 . 15 1 1 A 91 91 MET H H 91 8.450 8.682 -0.232 1
1 1081 . 15 1 1 A 91 91 MET HA H 91 4.904 5.178 -0.274 1
1 1089 . 15 1 1 A 91 91 MET C C 91 173.373 174.327 -0.954 1
1 1090 . 15 1 1 A 91 91 MET CA C 91 52.277 52.680 -0.403 1
1 1091 . 15 1 1 A 91 91 MET CB C 91 32.789 34.471 -1.682 1
1 1094 . 15 1 1 A 91 91 MET N N 91 125.173 123.287 1.886 1
1 1095 . 15 1 1 A 92 92 PRO HA H 92 4.358 4.224 0.134 1
1 1102 . 15 1 1 A 92 92 PRO C C 92 177.589 176.848 0.741 1
1 1103 . 15 1 1 A 92 92 PRO CA C 92 63.143 63.499 -0.356 1
1 1104 . 15 1 1 A 92 92 PRO CB C 92 32.083 32.604 -0.521 1
1 1107 . 15 1 1 A 93 93 GLY H H 93 8.330 8.466 -0.136 1
1 1108 . 15 1 1 A 93 93 GLY HA2 H 93 3.943 4.125 -0.182 1
1 1109 . 15 1 1 A 93 93 GLY HA3 H 93 4.045 4.129 -0.084 1
1 1110 . 15 1 1 A 93 93 GLY C C 93 174.730 173.055 1.675 1
1 1111 . 15 1 1 A 93 93 GLY CA C 93 45.276 44.451 0.825 1
1 1112 . 15 1 1 A 93 93 GLY N N 93 109.420 109.874 -0.454 1
1 1113 . 15 1 1 A 94 94 GLY H H 94 8.331 8.521 -0.190 1
1 1114 . 15 1 1 A 94 94 GLY HA2 H 94 3.973 4.297 -0.324 1
1 1115 . 15 1 1 A 94 94 GLY HA3 H 94 3.973 4.299 -0.326 1
1 1116 . 15 1 1 A 94 94 GLY C C 94 174.100 172.514 1.586 1
1 1117 . 15 1 1 A 94 94 GLY CA C 94 45.333 45.098 0.235 1
1 1118 . 15 1 1 A 94 94 GLY N N 94 108.483 109.350 -0.867 1
1 1119 . 15 1 1 A 95 95 THR H H 95 8.095 8.560 -0.465 1
1 1120 . 15 1 1 A 95 95 THR HA H 95 4.643 4.900 -0.257 1
1 1125 . 15 1 1 A 95 95 THR C C 95 173.155 175.120 -1.965 1
1 1126 . 15 1 1 A 95 95 THR CA C 95 59.922 59.806 0.116 1
1 1127 . 15 1 1 A 95 95 THR CB C 95 69.871 69.265 0.606 1
1 1129 . 15 1 1 A 95 95 THR N N 95 115.860 113.942 1.918 1
1 1130 . 15 1 1 A 96 96 PRO HA H 96 4.400 4.489 -0.089 1
1 1137 . 15 1 1 A 96 96 PRO C C 96 177.565 177.224 0.341 1
1 1138 . 15 1 1 A 96 96 PRO CA C 96 64.047 63.943 0.104 1
1 1139 . 15 1 1 A 96 96 PRO CB C 96 31.816 31.625 0.191 1
1 1142 . 15 1 1 A 97 97 GLY H H 97 8.572 8.260 0.312 1
1 1143 . 15 1 1 A 97 97 GLY HA2 H 97 4.007 4.006 0.001 1
1 1144 . 15 1 1 A 97 97 GLY HA3 H 97 4.007 4.007 0.000 1
1 1145 . 15 1 1 A 97 97 GLY C C 97 174.609 173.802 0.807 1
1 1146 . 15 1 1 A 97 97 GLY CA C 97 45.276 46.721 -1.445 1
1 1147 . 15 1 1 A 97 97 GLY N N 97 110.233 106.700 3.533 1
1 1148 . 15 1 1 A 98 98 GLY H H 98 8.119 7.674 0.445 1
1 1149 . 15 1 1 A 98 98 GLY HA2 H 98 4.086 4.250 -0.164 1
1 1150 . 15 1 1 A 98 98 GLY HA3 H 98 4.200 4.252 -0.052 1
1 1151 . 15 1 1 A 98 98 GLY CA C 98 44.876 43.936 0.940 1
1 1152 . 15 1 1 A 98 98 GLY N N 98 108.845 107.354 1.491 1
1 1153 . 15 1 1 A 99 99 PRO HA H 99 4.494 4.316 0.178 1
1 1160 . 15 1 1 A 99 99 PRO C C 99 177.468 177.653 -0.185 1
1 1161 . 15 1 1 A 99 99 PRO CA C 99 63.500 64.648 -1.148 1
1 1162 . 15 1 1 A 99 99 PRO CB C 99 32.013 31.755 0.258 1
1 1165 . 15 1 1 A 100 100 SER H H 100 8.472 8.110 0.362 1
1 1166 . 15 1 1 A 100 100 SER HA H 100 4.513 4.088 0.425 1
1 1169 . 15 1 1 A 100 100 SER C C 100 175.408 173.167 2.241 1
1 1170 . 15 1 1 A 100 100 SER CA C 100 58.557 59.290 -0.733 1
1 1171 . 15 1 1 A 100 100 SER CB C 100 63.918 62.075 1.843 1
1 1172 . 15 1 1 A 100 100 SER N N 100 116.038 113.573 2.465 1
1 1173 . 15 1 1 A 101 101 GLY H H 101 8.427 7.674 0.753 1
1 1174 . 15 1 1 A 101 101 GLY HA2 H 101 4.064 4.084 -0.020 1
1 1175 . 15 1 1 A 101 101 GLY HA3 H 101 4.064 4.094 -0.030 1
1 1176 . 15 1 1 A 101 101 GLY C C 101 174.730 173.952 0.778 1
1 1177 . 15 1 1 A 101 101 GLY CA C 101 45.575 45.939 -0.364 1
1 1178 . 15 1 1 A 101 101 GLY N N 101 110.558 106.933 3.625 1
1 1179 . 15 1 1 A 102 102 GLN H H 102 8.416 8.501 -0.085 1
1 1180 . 15 1 1 A 102 102 GLN HA H 102 4.383 4.449 -0.066 1
1 1187 . 15 1 1 A 102 102 GLN C C 102 177.346 177.147 0.199 1
1 1188 . 15 1 1 A 102 102 GLN CA C 102 57.080 55.708 1.372 1
1 1189 . 15 1 1 A 102 102 GLN CB C 102 29.235 30.364 -1.129 1
1 1191 . 15 1 1 A 102 102 GLN N N 102 120.112 121.510 -1.398 1
1 1193 . 15 1 1 A 103 103 GLY H H 103 8.713 8.219 0.494 1
1 1194 . 15 1 1 A 103 103 GLY HA2 H 103 4.193 3.918 0.275 1
1 1195 . 15 1 1 A 103 103 GLY HA3 H 103 4.078 3.938 0.140 1
1 1196 . 15 1 1 A 103 103 GLY C C 103 175.602 174.707 0.895 1
1 1197 . 15 1 1 A 103 103 GLY CA C 103 46.120 47.175 -1.055 1
1 1198 . 15 1 1 A 103 103 GLY N N 103 109.817 109.587 0.230 1
1 1199 . 15 1 1 A 104 104 ALA H H 104 8.366 7.762 0.604 1
1 1200 . 15 1 1 A 104 104 ALA HA H 104 4.449 4.700 -0.251 1
1 1204 . 15 1 1 A 104 104 ALA C C 104 179.188 178.136 1.052 1
1 1205 . 15 1 1 A 104 104 ALA CA C 104 54.230 53.198 1.032 1
1 1206 . 15 1 1 A 104 104 ALA CB C 104 19.080 21.206 -2.126 1
1 1207 . 15 1 1 A 104 104 ALA N N 104 124.808 120.739 4.069 1
1 1208 . 15 1 1 A 105 105 GLU H H 105 8.576 8.612 -0.036 1
1 1209 . 15 1 1 A 105 105 GLU HA H 105 4.161 4.278 -0.117 1
1 1214 . 15 1 1 A 105 105 GLU C C 105 179.200 178.987 0.213 1
1 1215 . 15 1 1 A 105 105 GLU CA C 105 59.173 58.809 0.364 1
1 1216 . 15 1 1 A 105 105 GLU CB C 105 29.194 30.604 -1.410 1
1 1218 . 15 1 1 A 105 105 GLU N N 105 119.238 118.029 1.209 1
1 1219 . 15 1 1 A 106 106 ALA H H 106 8.381 7.668 0.713 1
1 1220 . 15 1 1 A 106 106 ALA HA H 106 4.283 4.211 0.072 1
1 1224 . 15 1 1 A 106 106 ALA C C 106 180.048 179.935 0.113 1
1 1225 . 15 1 1 A 106 106 ALA CA C 106 54.687 55.133 -0.446 1
1 1226 . 15 1 1 A 106 106 ALA CB C 106 18.341 18.208 0.133 1
1 1227 . 15 1 1 A 106 106 ALA N N 106 123.327 123.578 -0.251 1
1 1228 . 15 1 1 A 107 107 ALA H H 107 8.123 8.276 -0.153 1
1 1229 . 15 1 1 A 107 107 ALA HA H 107 4.554 4.305 0.249 1
1 1233 . 15 1 1 A 107 107 ALA C C 107 179.757 180.274 -0.517 1
1 1234 . 15 1 1 A 107 107 ALA CA C 107 55.355 55.639 -0.284 1
1 1235 . 15 1 1 A 107 107 ALA CB C 107 18.939 18.331 0.608 1
1 1236 . 15 1 1 A 107 107 ALA N N 107 120.740 120.307 0.433 1
1 1237 . 15 1 1 A 108 108 ARG H H 108 8.403 8.255 0.148 1
1 1238 . 15 1 1 A 108 108 ARG HA H 108 4.254 4.032 0.222 1
1 1245 . 15 1 1 A 108 108 ARG C C 108 179.111 179.612 -0.501 1
1 1246 . 15 1 1 A 108 108 ARG CA C 108 59.015 59.251 -0.236 1
1 1247 . 15 1 1 A 108 108 ARG CB C 108 29.752 30.009 -0.257 1
1 1250 . 15 1 1 A 108 108 ARG N N 108 119.531 118.044 1.487 1
1 1251 . 15 1 1 A 109 109 GLY H H 109 8.182 8.168 0.014 1
1 1252 . 15 1 1 A 109 109 GLY HA2 H 109 3.822 3.710 0.112 1
1 1253 . 15 1 1 A 109 109 GLY HA3 H 109 3.822 3.734 0.088 1
1 1254 . 15 1 1 A 109 109 GLY C C 109 177.020 176.590 0.430 1
1 1255 . 15 1 1 A 109 109 GLY CA C 109 46.718 47.309 -0.591 1
1 1256 . 15 1 1 A 109 109 GLY N N 109 107.331 108.117 -0.786 1
1 1257 . 15 1 1 A 110 110 TRP H H 110 7.925 7.885 0.040 1
1 1258 . 15 1 1 A 110 110 TRP HA H 110 3.963 4.359 -0.396 1
1 1267 . 15 1 1 A 110 110 TRP C C 110 176.691 177.886 -1.195 1
1 1268 . 15 1 1 A 110 110 TRP CA C 110 62.041 61.457 0.584 1
1 1269 . 15 1 1 A 110 110 TRP CB C 110 28.989 28.206 0.783 1
1 1275 . 15 1 1 A 110 110 TRP N N 110 122.304 121.430 0.874 1
1 1277 . 15 1 1 A 111 111 GLU H H 111 7.946 7.673 0.273 1
1 1278 . 15 1 1 A 111 111 GLU HA H 111 2.594 3.040 -0.446 1
1 1283 . 15 1 1 A 111 111 GLU C C 111 177.976 179.094 -1.118 1
1 1284 . 15 1 1 A 111 111 GLU CA C 111 60.193 59.108 1.085 1
1 1285 . 15 1 1 A 111 111 GLU CB C 111 29.277 29.336 -0.059 1
1 1287 . 15 1 1 A 111 111 GLU N N 111 121.755 119.097 2.658 1
1 1288 . 15 1 1 A 112 112 THR H H 112 7.993 7.554 0.439 1
1 1289 . 15 1 1 A 112 112 THR HA H 112 3.722 3.832 -0.110 1
1 1294 . 15 1 1 A 112 112 THR C C 112 176.038 175.768 0.270 1
1 1295 . 15 1 1 A 112 112 THR CA C 112 66.104 66.568 -0.464 1
1 1296 . 15 1 1 A 112 112 THR CB C 112 68.885 68.825 0.060 1
1 1298 . 15 1 1 A 112 112 THR N N 112 112.247 116.456 -4.209 1
1 1299 . 15 1 1 A 113 113 ALA H H 113 7.742 8.331 -0.589 1
1 1300 . 15 1 1 A 113 113 ALA HA H 113 4.029 3.949 0.080 1
1 1304 . 15 1 1 A 113 113 ALA C C 113 180.545 179.784 0.761 1
1 1305 . 15 1 1 A 113 113 ALA CA C 113 55.127 55.310 -0.183 1
1 1306 . 15 1 1 A 113 113 ALA CB C 113 18.854 18.373 0.481 1
1 1307 . 15 1 1 A 113 113 ALA N N 113 123.134 122.753 0.381 1
1 1308 . 15 1 1 A 114 114 ILE H H 114 8.472 8.496 -0.024 1
1 1309 . 15 1 1 A 114 114 ILE HA H 114 3.613 3.730 -0.117 1
1 1319 . 15 1 1 A 114 114 ILE C C 114 176.947 178.000 -1.053 1
1 1320 . 15 1 1 A 114 114 ILE CA C 114 66.016 65.177 0.839 1
1 1321 . 15 1 1 A 114 114 ILE CB C 114 38.335 37.870 0.465 1
1 1325 . 15 1 1 A 114 114 ILE N N 114 118.276 117.736 0.540 1
1 1326 . 15 1 1 A 115 115 ARG H H 115 8.181 8.057 0.124 1
1 1327 . 15 1 1 A 115 115 ARG HA H 115 3.835 3.904 -0.069 1
1 1334 . 15 1 1 A 115 115 ARG C C 115 179.588 179.109 0.479 1
1 1335 . 15 1 1 A 115 115 ARG CA C 115 61.072 60.215 0.857 1
1 1336 . 15 1 1 A 115 115 ARG CB C 115 29.975 29.996 -0.021 1
1 1339 . 15 1 1 A 115 115 ARG N N 115 117.921 119.124 -1.203 1
1 1340 . 15 1 1 A 116 116 GLN H H 116 8.395 8.405 -0.010 1
1 1341 . 15 1 1 A 116 116 GLN HA H 116 4.030 4.042 -0.012 1
1 1348 . 15 1 1 A 116 116 GLN C C 116 178.716 179.066 -0.350 1
1 1349 . 15 1 1 A 116 116 GLN CA C 116 58.790 58.841 -0.051 1
1 1350 . 15 1 1 A 116 116 GLN CB C 116 28.248 28.558 -0.310 1
1 1352 . 15 1 1 A 116 116 GLN N N 116 116.842 118.842 -2.000 1
1 1354 . 15 1 1 A 117 117 ALA H H 117 7.902 7.994 -0.092 1
1 1355 . 15 1 1 A 117 117 ALA HA H 117 4.143 4.137 0.006 1
1 1359 . 15 1 1 A 117 117 ALA C C 117 179.685 180.192 -0.507 1
1 1360 . 15 1 1 A 117 117 ALA CA C 117 54.476 54.958 -0.482 1
1 1361 . 15 1 1 A 117 117 ALA CB C 117 18.300 18.366 -0.066 1
1 1362 . 15 1 1 A 117 117 ALA N N 117 122.828 123.222 -0.394 1
1 1363 . 15 1 1 A 118 118 LEU H H 118 7.904 8.056 -0.152 1
1 1364 . 15 1 1 A 118 118 LEU HA H 118 4.119 4.099 0.020 1
1 1374 . 15 1 1 A 118 118 LEU C C 118 178.437 178.719 -0.282 1
1 1375 . 15 1 1 A 118 118 LEU CA C 118 56.781 57.171 -0.390 1
1 1376 . 15 1 1 A 118 118 LEU CB C 118 42.371 41.793 0.578 1
1 1380 . 15 1 1 A 118 118 LEU N N 118 117.632 120.265 -2.633 1
1 1381 . 15 1 1 A 119 119 MET H H 119 7.673 8.026 -0.353 1
1 1382 . 15 1 1 A 119 119 MET HA H 119 4.442 4.248 0.194 1
1 1390 . 15 1 1 A 119 119 MET C C 119 176.680 177.451 -0.771 1
1 1391 . 15 1 1 A 119 119 MET CA C 119 56.432 57.738 -1.306 1
1 1392 . 15 1 1 A 119 119 MET CB C 119 32.769 31.692 1.077 1
1 1395 . 15 1 1 A 119 119 MET N N 119 117.286 117.234 0.052 1
1 1396 . 15 1 1 A 120 120 SER H H 120 7.878 7.848 0.030 1
1 1397 . 15 1 1 A 120 120 SER HA H 120 4.500 4.432 0.068 1
1 1400 . 15 1 1 A 120 120 SER C C 120 174.742 175.738 -0.996 1
1 1401 . 15 1 1 A 120 120 SER CA C 120 58.962 58.156 0.806 1
1 1402 . 15 1 1 A 120 120 SER CB C 120 63.853 62.924 0.929 1
1 1403 . 15 1 1 A 120 120 SER N N 120 115.064 113.435 1.629 1
1 1404 . 15 1 1 A 121 121 GLY H H 121 8.059 8.358 -0.299 1
1 1405 . 15 1 1 A 121 121 GLY HA2 H 121 4.231 3.836 0.395 1
1 1406 . 15 1 1 A 121 121 GLY HA3 H 121 4.112 3.837 0.275 1
1 1407 . 15 1 1 A 121 121 GLY C C 121 172.065 174.863 -2.798 1
1 1408 . 15 1 1 A 121 121 GLY CA C 121 45.030 47.971 -2.941 1
1 1409 . 15 1 1 A 121 121 GLY N N 121 110.271 111.022 -0.751 1
1 1410 . 15 1 1 A 122 122 PRO HA H 122 4.496 4.508 -0.012 1
1 1417 . 15 1 1 A 122 122 PRO CA C 122 63.399 62.883 0.516 1
1 1418 . 15 1 1 A 122 122 PRO CB C 122 32.186 31.834 0.352 1
1 1 . 16 1 1 A 6 6 SER H H 6 8.337 7.785 0.552 1
1 2 . 16 1 1 A 6 6 SER HA H 6 4.597 4.236 0.361 1
1 5 . 16 1 1 A 6 6 SER C C 6 174.637 174.017 0.620 1
1 6 . 16 1 1 A 6 6 SER CA C 6 58.469 59.311 -0.842 1
1 7 . 16 1 1 A 6 6 SER CB C 6 64.221 63.439 0.782 1
1 8 . 16 1 1 A 6 6 SER N N 6 117.887 116.242 1.645 1
1 9 . 16 1 1 A 7 7 GLY H H 7 8.280 8.577 -0.297 1
1 10 . 16 1 1 A 7 7 GLY HA2 H 7 4.063 4.192 -0.129 1
1 11 . 16 1 1 A 7 7 GLY HA3 H 7 4.063 4.196 -0.133 1
1 12 . 16 1 1 A 7 7 GLY C C 7 173.724 173.092 0.632 1
1 13 . 16 1 1 A 7 7 GLY CA C 7 44.941 44.085 0.856 1
1 14 . 16 1 1 A 7 7 GLY N N 7 110.151 113.776 -3.625 1
1 15 . 16 1 1 A 8 8 THR H H 8 8.212 8.540 -0.328 1
1 16 . 16 1 1 A 8 8 THR HA H 8 4.173 4.620 -0.447 1
1 21 . 16 1 1 A 8 8 THR C C 8 174.723 174.077 0.646 1
1 22 . 16 1 1 A 8 8 THR CA C 8 63.622 63.518 0.104 1
1 23 . 16 1 1 A 8 8 THR CB C 8 69.460 68.811 0.649 1
1 25 . 16 1 1 A 8 8 THR N N 8 116.817 116.096 0.721 1
1 26 . 16 1 1 A 9 9 LEU H H 9 9.374 8.763 0.611 1
1 27 . 16 1 1 A 9 9 LEU HA H 9 4.302 4.163 0.139 1
1 37 . 16 1 1 A 9 9 LEU C C 9 177.468 176.631 0.837 1
1 38 . 16 1 1 A 9 9 LEU CA C 9 55.936 56.666 -0.730 1
1 39 . 16 1 1 A 9 9 LEU CB C 9 42.843 42.331 0.512 1
1 43 . 16 1 1 A 9 9 LEU N N 9 127.798 128.883 -1.085 1
1 44 . 16 1 1 A 10 10 ARG H H 10 7.512 7.490 0.022 1
1 45 . 16 1 1 A 10 10 ARG HA H 10 4.199 4.690 -0.491 1
1 52 . 16 1 1 A 10 10 ARG C C 10 172.501 174.005 -1.504 1
1 53 . 16 1 1 A 10 10 ARG CA C 10 56.165 54.636 1.529 1
1 54 . 16 1 1 A 10 10 ARG CB C 10 32.442 33.372 -0.930 1
1 57 . 16 1 1 A 10 10 ARG N N 10 117.979 117.225 0.754 1
1 58 . 16 1 1 A 11 11 GLU H H 11 8.434 8.779 -0.345 1
1 59 . 16 1 1 A 11 11 GLU HA H 11 5.993 5.620 0.373 1
1 64 . 16 1 1 A 11 11 GLU C C 11 174.800 174.742 0.058 1
1 65 . 16 1 1 A 11 11 GLU CA C 11 54.570 55.328 -0.758 1
1 66 . 16 1 1 A 11 11 GLU CB C 11 34.245 33.147 1.098 1
1 68 . 16 1 1 A 11 11 GLU N N 11 120.782 122.429 -1.647 1
1 69 . 16 1 1 A 12 12 GLY H H 12 8.131 8.176 -0.045 1
1 70 . 16 1 1 A 12 12 GLY HA2 H 12 4.714 3.340 1.374 1
1 71 . 16 1 1 A 12 12 GLY HA3 H 12 3.763 4.102 -0.339 1
1 72 . 16 1 1 A 12 12 GLY C C 12 171.060 171.611 -0.551 1
1 73 . 16 1 1 A 12 12 GLY CA C 12 45.241 45.125 0.116 1
1 74 . 16 1 1 A 12 12 GLY N N 12 107.457 106.449 1.008 1
1 75 . 16 1 1 A 13 13 TRP H H 13 8.783 8.410 0.373 1
1 76 . 16 1 1 A 13 13 TRP HA H 13 5.152 4.785 0.367 1
1 85 . 16 1 1 A 13 13 TRP C C 13 177.528 176.481 1.047 1
1 86 . 16 1 1 A 13 13 TRP CA C 13 57.783 58.619 -0.836 1
1 87 . 16 1 1 A 13 13 TRP CB C 13 30.222 30.013 0.209 1
1 93 . 16 1 1 A 13 13 TRP N N 13 120.792 121.234 -0.442 1
1 95 . 16 1 1 A 14 14 VAL H H 14 9.179 8.749 0.430 1
1 96 . 16 1 1 A 14 14 VAL HA H 14 4.072 4.487 -0.415 1
1 104 . 16 1 1 A 14 14 VAL C C 14 174.981 173.488 1.493 1
1 105 . 16 1 1 A 14 14 VAL CA C 14 61.741 60.250 1.491 1
1 106 . 16 1 1 A 14 14 VAL CB C 14 35.143 35.122 0.021 1
1 109 . 16 1 1 A 14 14 VAL N N 14 125.476 122.850 2.626 1
1 110 . 16 1 1 A 15 15 VAL H H 15 8.403 8.824 -0.421 1
1 111 . 16 1 1 A 15 15 VAL HA H 15 5.532 5.152 0.380 1
1 119 . 16 1 1 A 15 15 VAL C C 15 175.078 174.310 0.768 1
1 120 . 16 1 1 A 15 15 VAL CA C 15 59.489 59.817 -0.328 1
1 121 . 16 1 1 A 15 15 VAL CB C 15 34.210 35.008 -0.798 1
1 124 . 16 1 1 A 15 15 VAL N N 15 126.189 127.284 -1.095 1
1 125 . 16 1 1 A 16 16 HIS H H 16 9.122 8.938 0.184 1
1 126 . 16 1 1 A 16 16 HIS HA H 16 5.823 5.809 0.014 1
1 131 . 16 1 1 A 16 16 HIS C C 16 172.998 172.738 0.260 1
1 132 . 16 1 1 A 16 16 HIS CA C 16 56.253 54.073 2.180 1
1 133 . 16 1 1 A 16 16 HIS CB C 16 34.273 32.929 1.344 1
1 136 . 16 1 1 A 16 16 HIS N N 16 121.152 120.624 0.528 1
1 137 . 16 1 1 A 17 17 TYR H H 17 8.465 8.686 -0.221 1
1 138 . 16 1 1 A 17 17 TYR HA H 17 5.096 4.764 0.332 1
1 145 . 16 1 1 A 17 17 TYR C C 17 173.640 173.293 0.347 1
1 146 . 16 1 1 A 17 17 TYR CA C 17 56.903 56.725 0.178 1
1 147 . 16 1 1 A 17 17 TYR CB C 17 40.103 40.258 -0.155 1
1 152 . 16 1 1 A 17 17 TYR N N 17 115.558 116.579 -1.021 1
1 153 . 16 1 1 A 18 18 SER H H 18 9.122 8.531 0.591 1
1 154 . 16 1 1 A 18 18 SER HA H 18 6.144 5.325 0.819 1
1 157 . 16 1 1 A 18 18 SER C C 18 173.204 175.559 -2.355 1
1 158 . 16 1 1 A 18 18 SER CA C 18 56.640 57.117 -0.477 1
1 159 . 16 1 1 A 18 18 SER CB C 18 68.788 66.465 2.323 1
1 160 . 16 1 1 A 18 18 SER N N 18 118.846 116.253 2.593 1
1 161 . 16 1 1 A 19 19 ASN H H 19 9.053 8.765 0.288 1
1 162 . 16 1 1 A 19 19 ASN HA H 19 4.473 4.989 -0.516 1
1 167 . 16 1 1 A 19 19 ASN C C 19 175.396 174.866 0.530 1
1 168 . 16 1 1 A 19 19 ASN CA C 19 55.373 52.237 3.136 1
1 169 . 16 1 1 A 19 19 ASN CB C 19 36.900 37.858 -0.958 1
1 170 . 16 1 1 A 19 19 ASN N N 19 113.712 117.691 -3.979 1
1 172 . 16 1 1 A 20 20 LYS H H 20 7.677 7.416 0.261 1
1 173 . 16 1 1 A 20 20 LYS HA H 20 4.413 4.386 0.027 1
1 182 . 16 1 1 A 20 20 LYS C C 20 176.078 177.625 -1.547 1
1 183 . 16 1 1 A 20 20 LYS CA C 20 55.679 56.847 -1.168 1
1 184 . 16 1 1 A 20 20 LYS CB C 20 33.023 34.736 -1.713 1
1 188 . 16 1 1 A 20 20 LYS N N 20 117.213 118.149 -0.936 1
1 189 . 16 1 1 A 21 21 ASP H H 21 7.395 7.358 0.037 1
1 190 . 16 1 1 A 21 21 ASP HA H 21 4.808 4.769 0.039 1
1 193 . 16 1 1 A 21 21 ASP C C 21 176.413 175.877 0.536 1
1 194 . 16 1 1 A 21 21 ASP CA C 21 53.983 53.791 0.192 1
1 195 . 16 1 1 A 21 21 ASP CB C 21 41.199 42.262 -1.063 1
1 196 . 16 1 1 A 21 21 ASP N N 21 119.879 116.032 3.847 1
1 197 . 16 1 1 A 22 22 THR H H 22 8.593 8.101 0.492 1
1 198 . 16 1 1 A 22 22 THR HA H 22 4.352 4.211 0.141 1
1 203 . 16 1 1 A 22 22 THR C C 22 172.913 174.884 -1.971 1
1 204 . 16 1 1 A 22 22 THR CA C 22 62.691 62.927 -0.236 1
1 205 . 16 1 1 A 22 22 THR CB C 22 68.332 66.500 1.832 1
1 207 . 16 1 1 A 22 22 THR N N 22 116.299 112.684 3.615 1
1 208 . 16 1 1 A 23 23 LEU H H 23 7.645 7.948 -0.303 1
1 209 . 16 1 1 A 23 23 LEU HA H 23 4.318 4.387 -0.069 1
1 219 . 16 1 1 A 23 23 LEU C C 23 176.692 176.621 0.071 1
1 220 . 16 1 1 A 23 23 LEU CA C 23 54.617 53.792 0.825 1
1 221 . 16 1 1 A 23 23 LEU CB C 23 41.939 41.466 0.473 1
1 225 . 16 1 1 A 23 23 LEU N N 23 123.606 120.623 2.983 1
1 226 . 16 1 1 A 24 24 ARG H H 24 8.563 7.932 0.631 1
1 227 . 16 1 1 A 24 24 ARG HA H 24 4.373 4.491 -0.118 1
1 235 . 16 1 1 A 24 24 ARG C C 24 176.584 176.228 0.356 1
1 236 . 16 1 1 A 24 24 ARG CA C 24 57.854 56.989 0.865 1
1 237 . 16 1 1 A 24 24 ARG CB C 24 31.126 30.404 0.722 1
1 240 . 16 1 1 A 24 24 ARG N N 24 127.152 124.427 2.725 1
1 242 . 16 1 1 A 25 25 LYS H H 25 8.633 8.424 0.209 1
1 243 . 16 1 1 A 25 25 LYS HA H 25 4.513 4.888 -0.375 1
1 251 . 16 1 1 A 25 25 LYS C C 25 173.567 174.332 -0.765 1
1 252 . 16 1 1 A 25 25 LYS CA C 25 54.792 54.252 0.540 1
1 253 . 16 1 1 A 25 25 LYS CB C 25 37.416 35.320 2.096 1
1 257 . 16 1 1 A 25 25 LYS N N 25 122.682 120.410 2.272 1
1 258 . 16 1 1 A 26 26 ARG H H 26 8.303 8.895 -0.592 1
1 259 . 16 1 1 A 26 26 ARG HA H 26 5.153 5.036 0.117 1
1 266 . 16 1 1 A 26 26 ARG C C 26 174.554 174.982 -0.428 1
1 267 . 16 1 1 A 26 26 ARG CA C 26 55.083 55.017 0.066 1
1 268 . 16 1 1 A 26 26 ARG CB C 26 32.789 31.549 1.240 1
1 271 . 16 1 1 A 26 26 ARG N N 26 121.819 124.924 -3.105 1
1 272 . 16 1 1 A 27 27 HIS H H 27 8.793 8.888 -0.095 1
1 273 . 16 1 1 A 27 27 HIS HA H 27 5.155 5.476 -0.321 1
1 278 . 16 1 1 A 27 27 HIS CA C 27 56.904 54.967 1.937 1
1 279 . 16 1 1 A 27 27 HIS CB C 27 34.683 31.227 3.456 1
1 282 . 16 1 1 A 27 27 HIS N N 27 122.102 120.311 1.791 1
1 283 . 16 1 1 A 28 28 TYR H H 28 9.273 8.335 0.938 1
1 284 . 16 1 1 A 28 28 TYR HA H 28 4.332 4.255 0.077 1
1 291 . 16 1 1 A 28 28 TYR C C 28 174.730 175.236 -0.506 1
1 292 . 16 1 1 A 28 28 TYR CA C 28 58.680 57.440 1.240 1
1 293 . 16 1 1 A 28 28 TYR CB C 28 38.673 38.138 0.535 1
1 298 . 16 1 1 A 28 28 TYR N N 28 125.605 121.465 4.140 1
1 299 . 16 1 1 A 29 29 TRP H H 29 9.273 8.891 0.382 1
1 300 . 16 1 1 A 29 29 TRP HA H 29 5.543 4.875 0.668 1
1 309 . 16 1 1 A 29 29 TRP C C 29 176.172 176.483 -0.311 1
1 310 . 16 1 1 A 29 29 TRP CA C 29 56.658 56.761 -0.103 1
1 311 . 16 1 1 A 29 29 TRP CB C 29 32.154 30.614 1.540 1
1 317 . 16 1 1 A 29 29 TRP N N 29 131.340 128.283 3.057 1
1 318 . 16 1 1 A 30 30 ARG H H 30 9.164 8.995 0.169 1
1 319 . 16 1 1 A 30 30 ARG HA H 30 5.302 5.525 -0.223 1
1 327 . 16 1 1 A 30 30 ARG C C 30 174.774 174.499 0.275 1
1 328 . 16 1 1 A 30 30 ARG CA C 30 56.271 54.813 1.458 1
1 329 . 16 1 1 A 30 30 ARG CB C 30 34.203 33.886 0.317 1
1 332 . 16 1 1 A 30 30 ARG N N 30 116.040 120.738 -4.698 1
1 334 . 16 1 1 A 31 31 LEU H H 31 9.273 9.567 -0.294 1
1 335 . 16 1 1 A 31 31 LEU HA H 31 5.324 5.405 -0.081 1
1 345 . 16 1 1 A 31 31 LEU C C 31 174.488 174.672 -0.184 1
1 346 . 16 1 1 A 31 31 LEU CA C 31 53.807 53.529 0.278 1
1 347 . 16 1 1 A 31 31 LEU CB C 31 46.667 45.672 0.995 1
1 351 . 16 1 1 A 31 31 LEU N N 31 127.075 127.384 -0.309 1
1 352 . 16 1 1 A 32 32 ASP H H 32 8.854 8.704 0.150 1
1 353 . 16 1 1 A 32 32 ASP HA H 32 4.902 5.104 -0.202 1
1 356 . 16 1 1 A 32 32 ASP C C 32 173.474 176.511 -3.037 1
1 357 . 16 1 1 A 32 32 ASP CA C 32 53.104 52.303 0.801 1
1 358 . 16 1 1 A 32 32 ASP CB C 32 42.931 44.072 -1.141 1
1 359 . 16 1 1 A 32 32 ASP N N 32 129.349 125.679 3.670 1
1 360 . 16 1 1 A 33 33 CYS H H 33 8.153 8.820 -0.667 1
1 361 . 16 1 1 A 33 33 CYS HA H 33 4.323 4.338 -0.015 1
1 364 . 16 1 1 A 33 33 CYS C C 33 174.476 174.682 -0.206 1
1 365 . 16 1 1 A 33 33 CYS CA C 33 59.853 60.737 -0.884 1
1 366 . 16 1 1 A 33 33 CYS CB C 33 27.508 27.088 0.420 1
1 367 . 16 1 1 A 33 33 CYS N N 33 108.439 119.148 -10.709 1
1 368 . 16 1 1 A 34 34 LYS H H 34 9.144 7.822 1.322 1
1 369 . 16 1 1 A 34 34 LYS HA H 34 4.616 4.375 0.241 1
1 378 . 16 1 1 A 34 34 LYS C C 34 177.601 176.353 1.248 1
1 379 . 16 1 1 A 34 34 LYS CA C 34 57.185 56.901 0.284 1
1 380 . 16 1 1 A 34 34 LYS CB C 34 35.623 34.368 1.255 1
1 384 . 16 1 1 A 34 34 LYS N N 34 119.884 118.171 1.713 1
1 385 . 16 1 1 A 35 35 CYS H H 35 9.102 7.763 1.339 1
1 386 . 16 1 1 A 35 35 CYS HA H 35 4.935 4.814 0.121 1
1 389 . 16 1 1 A 35 35 CYS C C 35 172.283 172.324 -0.041 1
1 390 . 16 1 1 A 35 35 CYS CA C 35 57.748 57.012 0.736 1
1 391 . 16 1 1 A 35 35 CYS CB C 35 31.537 30.495 1.042 1
1 392 . 16 1 1 A 35 35 CYS N N 35 120.317 114.125 6.192 1
1 393 . 16 1 1 A 36 36 ILE H H 36 8.213 8.971 -0.758 1
1 394 . 16 1 1 A 36 36 ILE HA H 36 4.617 4.832 -0.215 1
1 404 . 16 1 1 A 36 36 ILE C C 36 175.312 175.246 0.066 1
1 405 . 16 1 1 A 36 36 ILE CA C 36 60.967 60.453 0.514 1
1 406 . 16 1 1 A 36 36 ILE CB C 36 39.718 38.030 1.688 1
1 410 . 16 1 1 A 36 36 ILE N N 36 121.905 120.052 1.853 1
1 411 . 16 1 1 A 37 37 THR H H 37 9.076 8.686 0.390 1
1 412 . 16 1 1 A 37 37 THR HA H 37 4.364 4.542 -0.178 1
1 417 . 16 1 1 A 37 37 THR CA C 37 61.834 62.518 -0.684 1
1 418 . 16 1 1 A 37 37 THR CB C 37 69.237 70.046 -0.809 1
1 420 . 16 1 1 A 37 37 THR N N 37 122.500 123.683 -1.183 1
1 421 . 16 1 1 A 38 38 LEU H H 38 8.263 8.318 -0.055 1
1 422 . 16 1 1 A 38 38 LEU HA H 38 4.445 5.028 -0.583 1
1 432 . 16 1 1 A 38 38 LEU CA C 38 55.611 52.754 2.857 1
1 433 . 16 1 1 A 38 38 LEU CB C 38 42.702 45.581 -2.879 1
1 437 . 16 1 1 A 38 38 LEU N N 38 126.987 123.988 2.999 1
1 438 . 16 1 1 A 39 39 PHE H H 39 9.520 8.571 0.949 1
1 439 . 16 1 1 A 39 39 PHE HA H 39 4.998 4.943 0.055 1
1 447 . 16 1 1 A 39 39 PHE CA C 39 57.331 56.375 0.956 1
1 448 . 16 1 1 A 39 39 PHE CB C 39 42.453 41.622 0.831 1
1 454 . 16 1 1 A 39 39 PHE N N 39 120.545 119.022 1.523 1
1 455 . 16 1 1 A 40 40 GLN H H 40 9.878 8.996 0.882 1
1 456 . 16 1 1 A 40 40 GLN HA H 40 4.376 3.963 0.413 1
1 463 . 16 1 1 A 40 40 GLN CA C 40 59.513 59.922 -0.409 1
1 464 . 16 1 1 A 40 40 GLN CB C 40 29.317 28.906 0.411 1
1 467 . 16 1 1 A 41 41 ASN H H 41 7.732 8.047 -0.315 1
1 468 . 16 1 1 A 41 41 ASN HA H 41 4.812 5.314 -0.502 1
1 473 . 16 1 1 A 41 41 ASN CA C 41 52.618 51.636 0.982 1
1 474 . 16 1 1 A 41 41 ASN CB C 41 39.362 41.080 -1.718 1
1 475 . 16 1 1 A 41 41 ASN N N 41 107.613 113.074 -5.461 1
1 477 . 16 1 1 A 42 42 ASN HA H 42 3.476 4.289 -0.813 1
1 482 . 16 1 1 A 42 42 ASN C C 42 173.607 175.711 -2.104 1
1 483 . 16 1 1 A 42 42 ASN CA C 42 54.888 54.718 0.170 1
1 484 . 16 1 1 A 42 42 ASN CB C 42 35.613 37.780 -2.167 1
1 486 . 16 1 1 A 43 43 THR H H 43 8.394 7.999 0.395 1
1 487 . 16 1 1 A 43 43 THR HA H 43 4.403 4.562 -0.159 1
1 492 . 16 1 1 A 43 43 THR C C 43 174.464 173.779 0.685 1
1 493 . 16 1 1 A 43 43 THR CA C 43 61.978 61.447 0.531 1
1 494 . 16 1 1 A 43 43 THR CB C 43 70.036 69.305 0.731 1
1 496 . 16 1 1 A 43 43 THR N N 43 111.795 113.560 -1.765 1
1 497 . 16 1 1 A 44 44 THR H H 44 8.058 7.530 0.528 1
1 498 . 16 1 1 A 44 44 THR HA H 44 4.464 4.849 -0.385 1
1 503 . 16 1 1 A 44 44 THR CA C 44 61.599 59.704 1.895 1
1 504 . 16 1 1 A 44 44 THR CB C 44 69.137 71.257 -2.120 1
1 506 . 16 1 1 A 44 44 THR N N 44 116.514 117.446 -0.932 1
1 507 . 16 1 1 A 45 45 ASN H H 45 6.653 8.728 -2.075 1
1 508 . 16 1 1 A 45 45 ASN HA H 45 4.945 4.867 0.078 1
1 513 . 16 1 1 A 45 45 ASN CA C 45 53.227 54.721 -1.494 1
1 514 . 16 1 1 A 45 45 ASN CB C 45 38.483 38.832 -0.349 1
1 516 . 16 1 1 A 46 46 ARG H H 46 8.213 8.163 0.050 1
1 517 . 16 1 1 A 46 46 ARG HA H 46 4.583 4.282 0.301 1
1 524 . 16 1 1 A 46 46 ARG CA C 46 55.487 55.914 -0.427 1
1 525 . 16 1 1 A 46 46 ARG CB C 46 31.153 31.071 0.082 1
1 528 . 16 1 1 A 46 46 ARG N N 46 121.652 118.872 2.780 1
1 529 . 16 1 1 A 47 47 TYR H H 47 7.973 8.796 -0.823 1
1 536 . 16 1 1 A 47 47 TYR CB C 47 39.356 39.662 -0.306 1
1 541 . 16 1 1 A 48 48 TYR H H 48 9.023 8.342 0.681 1
1 542 . 16 1 1 A 48 48 TYR HA H 48 4.662 4.334 0.328 1
1 549 . 16 1 1 A 48 48 TYR CB C 48 39.863 40.958 -1.095 1
1 554 . 16 1 1 A 48 48 TYR N N 48 121.223 119.695 1.528 1
1 555 . 16 1 1 A 49 49 LYS H H 49 7.134 7.388 -0.254 1
1 556 . 16 1 1 A 49 49 LYS HA H 49 4.283 4.525 -0.242 1
1 565 . 16 1 1 A 49 49 LYS CA C 49 55.167 55.770 -0.603 1
1 566 . 16 1 1 A 49 49 LYS CB C 49 36.699 35.752 0.947 1
1 570 . 16 1 1 A 49 49 LYS N N 49 117.339 118.023 -0.684 1
1 571 . 16 1 1 A 50 50 GLU H H 50 8.411 9.252 -0.841 1
1 572 . 16 1 1 A 50 50 GLU HA H 50 4.583 5.015 -0.432 1
1 577 . 16 1 1 A 50 50 GLU CA C 50 54.592 54.775 -0.183 1
1 578 . 16 1 1 A 50 50 GLU CB C 50 33.263 31.867 1.396 1
1 580 . 16 1 1 A 50 50 GLU N N 50 123.825 127.506 -3.681 1
1 581 . 16 1 1 A 51 51 ILE H H 51 9.225 8.662 0.563 1
1 582 . 16 1 1 A 51 51 ILE HA H 51 4.277 4.638 -0.361 1
1 592 . 16 1 1 A 51 51 ILE CA C 51 58.182 58.183 -0.001 1
1 593 . 16 1 1 A 51 51 ILE CB C 51 39.663 38.346 1.317 1
1 597 . 16 1 1 A 51 51 ILE N N 51 125.271 126.825 -1.554 1
1 598 . 16 1 1 A 52 52 PRO HA H 52 4.543 4.629 -0.086 1
1 605 . 16 1 1 A 52 52 PRO C C 52 178.340 178.096 0.244 1
1 606 . 16 1 1 A 52 52 PRO CA C 52 62.726 62.904 -0.178 1
1 607 . 16 1 1 A 52 52 PRO CB C 52 32.003 31.742 0.261 1
1 610 . 16 1 1 A 53 53 LEU H H 53 8.723 8.534 0.189 1
1 611 . 16 1 1 A 53 53 LEU HA H 53 3.891 3.875 0.016 1
1 621 . 16 1 1 A 53 53 LEU C C 53 179.673 178.905 0.768 1
1 622 . 16 1 1 A 53 53 LEU CA C 53 58.205 57.302 0.903 1
1 623 . 16 1 1 A 53 53 LEU CB C 53 40.171 41.051 -0.880 1
1 627 . 16 1 1 A 53 53 LEU N N 53 125.150 124.312 0.838 1
1 628 . 16 1 1 A 54 54 SER H H 54 8.360 8.320 0.040 1
1 629 . 16 1 1 A 54 54 SER HA H 54 4.164 4.146 0.018 1
1 632 . 16 1 1 A 54 54 SER C C 54 175.517 177.403 -1.886 1
1 633 . 16 1 1 A 54 54 SER CA C 54 60.193 61.379 -1.186 1
1 634 . 16 1 1 A 54 54 SER CB C 54 62.617 62.306 0.311 1
1 635 . 16 1 1 A 54 54 SER N N 54 111.266 113.900 -2.634 1
1 636 . 16 1 1 A 55 55 GLU H H 55 7.666 8.261 -0.595 1
1 637 . 16 1 1 A 55 55 GLU HA H 55 4.363 4.183 0.180 1
1 642 . 16 1 1 A 55 55 GLU C C 55 176.753 177.769 -1.016 1
1 643 . 16 1 1 A 55 55 GLU CA C 55 56.200 58.873 -2.673 1
1 644 . 16 1 1 A 55 55 GLU CB C 55 30.526 29.209 1.317 1
1 646 . 16 1 1 A 55 55 GLU N N 55 119.485 119.604 -0.119 1
1 647 . 16 1 1 A 56 56 ILE H H 56 7.601 7.057 0.544 1
1 648 . 16 1 1 A 56 56 ILE HA H 56 3.793 3.947 -0.154 1
1 658 . 16 1 1 A 56 56 ILE C C 56 175.142 176.023 -0.881 1
1 659 . 16 1 1 A 56 56 ILE CA C 56 63.518 62.172 1.346 1
1 660 . 16 1 1 A 56 56 ILE CB C 56 37.169 38.022 -0.853 1
1 664 . 16 1 1 A 56 56 ILE N N 56 120.430 120.372 0.058 1
1 665 . 16 1 1 A 57 57 LEU H H 57 9.263 9.266 -0.003 1
1 666 . 16 1 1 A 57 57 LEU HA H 57 4.343 4.391 -0.048 1
1 676 . 16 1 1 A 57 57 LEU C C 57 177.898 176.491 1.407 1
1 677 . 16 1 1 A 57 57 LEU CA C 57 56.569 55.759 0.810 1
1 678 . 16 1 1 A 57 57 LEU CB C 57 41.980 42.729 -0.749 1
1 682 . 16 1 1 A 57 57 LEU N N 57 129.464 128.917 0.547 1
1 683 . 16 1 1 A 58 58 THR H H 58 7.414 7.226 0.188 1
1 684 . 16 1 1 A 58 58 THR HA H 58 4.512 4.893 -0.381 1
1 689 . 16 1 1 A 58 58 THR C C 58 171.314 172.635 -1.321 1
1 690 . 16 1 1 A 58 58 THR CA C 58 60.562 61.241 -0.679 1
1 691 . 16 1 1 A 58 58 THR CB C 58 70.803 73.246 -2.443 1
1 693 . 16 1 1 A 58 58 THR N N 58 109.129 110.300 -1.171 1
1 694 . 16 1 1 A 59 59 VAL H H 59 8.152 8.458 -0.306 1
1 695 . 16 1 1 A 59 59 VAL HA H 59 5.061 4.994 0.067 1
1 703 . 16 1 1 A 59 59 VAL C C 59 174.985 174.994 -0.009 1
1 704 . 16 1 1 A 59 59 VAL CA C 59 61.354 61.167 0.187 1
1 705 . 16 1 1 A 59 59 VAL CB C 59 33.855 34.058 -0.203 1
1 708 . 16 1 1 A 59 59 VAL N N 59 123.676 124.638 -0.962 1
1 709 . 16 1 1 A 60 60 GLU H H 60 9.074 8.739 0.335 1
1 710 . 16 1 1 A 60 60 GLU HA H 60 4.977 4.850 0.127 1
1 715 . 16 1 1 A 60 60 GLU C C 60 176.063 174.917 1.146 1
1 716 . 16 1 1 A 60 60 GLU CA C 60 53.807 54.246 -0.439 1
1 717 . 16 1 1 A 60 60 GLU CB C 60 33.739 33.452 0.287 1
1 719 . 16 1 1 A 60 60 GLU N N 60 125.125 126.013 -0.888 1
1 720 . 16 1 1 A 61 61 SER H H 61 8.763 8.818 -0.055 1
1 721 . 16 1 1 A 61 61 SER HA H 61 4.452 5.045 -0.593 1
1 724 . 16 1 1 A 61 61 SER C C 61 173.288 174.167 -0.879 1
1 725 . 16 1 1 A 61 61 SER CA C 61 59.384 57.717 1.667 1
1 726 . 16 1 1 A 61 61 SER CB C 61 63.390 64.656 -1.266 1
1 727 . 16 1 1 A 61 61 SER N N 61 117.523 118.288 -0.765 1
1 728 . 16 1 1 A 62 62 ALA H H 62 7.293 8.946 -1.653 1
1 729 . 16 1 1 A 62 62 ALA HA H 62 3.817 4.363 -0.546 1
1 733 . 16 1 1 A 62 62 ALA C C 62 176.717 177.855 -1.138 1
1 734 . 16 1 1 A 62 62 ALA CA C 62 53.966 52.997 0.969 1
1 735 . 16 1 1 A 62 62 ALA CB C 62 18.640 18.589 0.051 1
1 736 . 16 1 1 A 62 62 ALA N N 62 122.650 126.731 -4.081 1
1 737 . 16 1 1 A 63 63 GLN H H 63 8.736 8.205 0.531 1
1 738 . 16 1 1 A 63 63 GLN HA H 63 4.445 4.685 -0.240 1
1 745 . 16 1 1 A 63 63 GLN C C 63 173.700 175.124 -1.424 1
1 746 . 16 1 1 A 63 63 GLN CA C 63 56.376 55.671 0.705 1
1 747 . 16 1 1 A 63 63 GLN CB C 63 31.515 31.102 0.413 1
1 749 . 16 1 1 A 63 63 GLN N N 63 120.251 119.471 0.780 1
1 751 . 16 1 1 A 64 64 ASN H H 64 9.272 7.192 2.080 1
1 752 . 16 1 1 A 64 64 ASN HA H 64 4.906 5.113 -0.207 1
1 757 . 16 1 1 A 64 64 ASN C C 64 174.754 174.688 0.066 1
1 758 . 16 1 1 A 64 64 ASN CA C 64 51.837 52.036 -0.199 1
1 759 . 16 1 1 A 64 64 ASN CB C 64 38.156 40.161 -2.005 1
1 760 . 16 1 1 A 64 64 ASN N N 64 122.346 118.708 3.638 1
1 762 . 16 1 1 A 65 65 PHE H H 65 8.854 9.243 -0.389 1
1 763 . 16 1 1 A 65 65 PHE HA H 65 4.947 5.174 -0.227 1
1 771 . 16 1 1 A 65 65 PHE C C 65 177.274 176.346 0.928 1
1 772 . 16 1 1 A 65 65 PHE CA C 65 57.519 56.728 0.791 1
1 773 . 16 1 1 A 65 65 PHE CB C 65 38.485 38.648 -0.163 1
1 779 . 16 1 1 A 65 65 PHE N N 65 123.638 125.468 -1.830 1
1 780 . 16 1 1 A 66 66 SER H H 66 8.163 8.209 -0.046 1
1 781 . 16 1 1 A 66 66 SER HA H 66 4.393 4.535 -0.142 1
1 784 . 16 1 1 A 66 66 SER C C 66 175.699 176.800 -1.101 1
1 785 . 16 1 1 A 66 66 SER CA C 66 60.791 60.611 0.180 1
1 786 . 16 1 1 A 66 66 SER CB C 66 64.591 63.748 0.843 1
1 787 . 16 1 1 A 66 66 SER N N 66 113.913 115.850 -1.937 1
1 788 . 16 1 1 A 67 67 LEU H H 67 8.574 7.832 0.742 1
1 789 . 16 1 1 A 67 67 LEU HA H 67 4.302 3.808 0.494 1
1 799 . 16 1 1 A 67 67 LEU C C 67 176.269 177.345 -1.076 1
1 800 . 16 1 1 A 67 67 LEU CA C 67 55.601 58.158 -2.557 1
1 801 . 16 1 1 A 67 67 LEU CB C 67 42.021 41.892 0.129 1
1 805 . 16 1 1 A 67 67 LEU N N 67 121.264 120.531 0.733 1
1 806 . 16 1 1 A 68 68 VAL H H 68 6.921 7.576 -0.655 1
1 807 . 16 1 1 A 68 68 VAL HA H 68 4.473 4.162 0.311 1
1 815 . 16 1 1 A 68 68 VAL C C 68 173.809 174.951 -1.142 1
1 816 . 16 1 1 A 68 68 VAL CA C 68 58.047 60.687 -2.640 1
1 817 . 16 1 1 A 68 68 VAL CB C 68 32.295 31.825 0.470 1
1 820 . 16 1 1 A 68 68 VAL N N 68 111.287 115.848 -4.561 1
1 821 . 16 1 1 A 69 69 PRO HA H 69 4.658 4.715 -0.057 1
1 828 . 16 1 1 A 69 69 PRO CA C 69 61.747 61.528 0.219 1
1 829 . 16 1 1 A 69 69 PRO CB C 69 30.693 31.633 -0.940 1
1 832 . 16 1 1 A 70 70 PRO HA H 70 4.414 4.277 0.137 1
1 839 . 16 1 1 A 70 70 PRO CA C 70 63.997 63.689 0.308 1
1 840 . 16 1 1 A 70 70 PRO CB C 70 31.602 31.258 0.344 1
1 843 . 16 1 1 A 71 71 GLY H H 71 8.824 8.900 -0.076 1
1 844 . 16 1 1 A 71 71 GLY HA2 H 71 3.703 3.904 -0.201 1
1 845 . 16 1 1 A 71 71 GLY HA3 H 71 4.193 3.908 0.285 1
1 846 . 16 1 1 A 71 71 GLY C C 71 174.052 174.584 -0.532 1
1 847 . 16 1 1 A 71 71 GLY CA C 71 45.065 45.176 -0.111 1
1 848 . 16 1 1 A 71 71 GLY N N 71 111.845 112.868 -1.023 1
1 849 . 16 1 1 A 72 72 THR H H 72 7.597 7.232 0.365 1
1 850 . 16 1 1 A 72 72 THR HA H 72 4.133 4.124 0.009 1
1 855 . 16 1 1 A 72 72 THR CA C 72 63.129 63.474 -0.345 1
1 856 . 16 1 1 A 72 72 THR CB C 72 69.560 68.988 0.572 1
1 858 . 16 1 1 A 72 72 THR N N 72 117.485 115.691 1.794 1
1 859 . 16 1 1 A 73 73 ASN H H 73 9.280 8.505 0.775 1
1 860 . 16 1 1 A 73 73 ASN HA H 73 4.786 4.632 0.154 1
1 865 . 16 1 1 A 73 73 ASN CA C 73 52.009 52.084 -0.075 1
1 866 . 16 1 1 A 73 73 ASN CB C 73 37.553 38.306 -0.753 1
1 867 . 16 1 1 A 73 73 ASN N N 73 127.641 125.156 2.485 1
1 869 . 16 1 1 A 74 74 PRO HA H 74 4.752 4.887 -0.135 1
1 876 . 16 1 1 A 74 74 PRO C C 74 175.190 176.547 -1.357 1
1 877 . 16 1 1 A 74 74 PRO CA C 74 63.395 62.519 0.876 1
1 878 . 16 1 1 A 74 74 PRO CB C 74 33.164 33.436 -0.272 1
1 881 . 16 1 1 A 75 75 HIS H H 75 8.025 8.887 -0.862 1
1 882 . 16 1 1 A 75 75 HIS HA H 75 5.047 5.166 -0.119 1
1 887 . 16 1 1 A 75 75 HIS C C 75 172.562 175.037 -2.475 1
1 888 . 16 1 1 A 75 75 HIS CA C 75 54.336 53.568 0.768 1
1 889 . 16 1 1 A 75 75 HIS CB C 75 30.956 33.096 -2.140 1
1 892 . 16 1 1 A 75 75 HIS N N 75 116.198 116.535 -0.337 1
1 893 . 16 1 1 A 76 76 CYS H H 76 8.343 9.521 -1.178 1
1 894 . 16 1 1 A 76 76 CYS HA H 76 4.594 4.510 0.084 1
1 897 . 16 1 1 A 76 76 CYS C C 76 175.651 174.637 1.014 1
1 898 . 16 1 1 A 76 76 CYS CA C 76 61.066 60.933 0.133 1
1 899 . 16 1 1 A 76 76 CYS CB C 76 30.193 29.170 1.023 1
1 900 . 16 1 1 A 76 76 CYS N N 76 113.289 118.589 -5.300 1
1 901 . 16 1 1 A 77 77 PHE H H 77 8.433 8.347 0.086 1
1 902 . 16 1 1 A 77 77 PHE HA H 77 5.105 5.392 -0.287 1
1 910 . 16 1 1 A 77 77 PHE C C 77 171.822 172.836 -1.014 1
1 911 . 16 1 1 A 77 77 PHE CA C 77 56.874 55.649 1.225 1
1 912 . 16 1 1 A 77 77 PHE CB C 77 39.393 43.056 -3.663 1
1 918 . 16 1 1 A 77 77 PHE N N 77 114.874 114.875 -0.001 1
1 919 . 16 1 1 A 78 78 GLU H H 78 9.823 9.071 0.752 1
1 920 . 16 1 1 A 78 78 GLU HA H 78 5.333 5.069 0.264 1
1 925 . 16 1 1 A 78 78 GLU C C 78 175.602 175.472 0.130 1
1 926 . 16 1 1 A 78 78 GLU CA C 78 54.212 54.930 -0.718 1
1 927 . 16 1 1 A 78 78 GLU CB C 78 31.702 32.516 -0.814 1
1 929 . 16 1 1 A 78 78 GLU N N 78 121.074 119.027 2.047 1
1 930 . 16 1 1 A 79 79 ILE H H 79 9.093 9.074 0.019 1
1 931 . 16 1 1 A 79 79 ILE HA H 79 4.637 4.571 0.066 1
1 941 . 16 1 1 A 79 79 ILE C C 79 174.476 175.339 -0.863 1
1 942 . 16 1 1 A 79 79 ILE CA C 79 60.932 60.668 0.264 1
1 943 . 16 1 1 A 79 79 ILE CB C 79 40.803 37.251 3.552 1
1 947 . 16 1 1 A 79 79 ILE N N 79 121.382 125.347 -3.965 1
1 948 . 16 1 1 A 80 80 VAL H H 80 8.841 8.030 0.811 1
1 949 . 16 1 1 A 80 80 VAL HA H 80 4.425 3.944 0.481 1
1 957 . 16 1 1 A 80 80 VAL C C 80 175.930 175.288 0.642 1
1 958 . 16 1 1 A 80 80 VAL CA C 80 63.324 63.080 0.244 1
1 959 . 16 1 1 A 80 80 VAL CB C 80 32.783 31.002 1.781 1
1 962 . 16 1 1 A 80 80 VAL N N 80 128.970 128.132 0.838 1
1 963 . 16 1 1 A 81 81 THR H H 81 8.303 7.843 0.460 1
1 964 . 16 1 1 A 81 81 THR HA H 81 5.264 4.707 0.557 1
1 969 . 16 1 1 A 81 81 THR C C 81 173.664 174.433 -0.769 1
1 970 . 16 1 1 A 81 81 THR CA C 81 59.540 59.923 -0.383 1
1 971 . 16 1 1 A 81 81 THR CB C 81 72.197 70.814 1.383 1
1 973 . 16 1 1 A 81 81 THR N N 81 118.077 118.689 -0.612 1
1 974 . 16 1 1 A 82 82 ALA H H 82 9.586 8.468 1.118 1
1 975 . 16 1 1 A 82 82 ALA HA H 82 4.093 4.486 -0.393 1
1 979 . 16 1 1 A 82 82 ALA C C 82 178.667 177.678 0.989 1
1 980 . 16 1 1 A 82 82 ALA CA C 82 55.321 52.567 2.754 1
1 981 . 16 1 1 A 82 82 ALA CB C 82 18.094 18.631 -0.537 1
1 982 . 16 1 1 A 82 82 ALA N N 82 122.493 123.042 -0.549 1
1 983 . 16 1 1 A 83 83 ASN H H 83 7.923 8.447 -0.524 1
1 984 . 16 1 1 A 83 83 ASN HA H 83 4.808 5.098 -0.290 1
1 989 . 16 1 1 A 83 83 ASN C C 83 174.766 174.511 0.255 1
1 990 . 16 1 1 A 83 83 ASN CA C 83 53.333 54.753 -1.420 1
1 991 . 16 1 1 A 83 83 ASN CB C 83 40.335 41.821 -1.486 1
1 992 . 16 1 1 A 83 83 ASN N N 83 110.765 116.392 -5.627 1
1 994 . 16 1 1 A 84 84 ALA H H 84 7.352 7.031 0.321 1
1 995 . 16 1 1 A 84 84 ALA HA H 84 4.625 4.499 0.126 1
1 999 . 16 1 1 A 84 84 ALA C C 84 176.547 174.923 1.624 1
1 1000 . 16 1 1 A 84 84 ALA CA C 84 52.858 51.841 1.017 1
1 1001 . 16 1 1 A 84 84 ALA CB C 84 21.233 21.776 -0.543 1
1 1002 . 16 1 1 A 84 84 ALA N N 84 119.599 117.696 1.903 1
1 1003 . 16 1 1 A 85 85 THR H H 85 8.374 8.739 -0.365 1
1 1004 . 16 1 1 A 85 85 THR HA H 85 5.014 4.630 0.384 1
1 1009 . 16 1 1 A 85 85 THR C C 85 171.568 174.092 -2.524 1
1 1010 . 16 1 1 A 85 85 THR CA C 85 61.618 62.041 -0.423 1
1 1011 . 16 1 1 A 85 85 THR CB C 85 70.850 69.713 1.137 1
1 1013 . 16 1 1 A 85 85 THR N N 85 119.032 113.773 5.259 1
1 1014 . 16 1 1 A 86 86 TYR H H 86 9.006 9.100 -0.094 1
1 1015 . 16 1 1 A 86 86 TYR HA H 86 4.658 4.880 -0.222 1
1 1022 . 16 1 1 A 86 86 TYR C C 86 173.773 175.408 -1.635 1
1 1023 . 16 1 1 A 86 86 TYR CA C 86 56.938 57.743 -0.805 1
1 1024 . 16 1 1 A 86 86 TYR CB C 86 39.513 40.118 -0.605 1
1 1029 . 16 1 1 A 86 86 TYR N N 86 123.494 127.061 -3.567 1
1 1030 . 16 1 1 A 87 87 PHE H H 87 9.263 8.658 0.605 1
1 1031 . 16 1 1 A 87 87 PHE HA H 87 4.127 4.679 -0.552 1
1 1039 . 16 1 1 A 87 87 PHE C C 87 176.369 173.978 2.391 1
1 1040 . 16 1 1 A 87 87 PHE CA C 87 57.238 55.834 1.404 1
1 1041 . 16 1 1 A 87 87 PHE CB C 87 37.086 38.574 -1.488 1
1 1047 . 16 1 1 A 87 87 PHE N N 87 125.384 119.695 5.689 1
1 1048 . 16 1 1 A 88 88 VAL H H 88 9.023 8.487 0.536 1
1 1049 . 16 1 1 A 88 88 VAL HA H 88 4.162 4.820 -0.658 1
1 1057 . 16 1 1 A 88 88 VAL C C 88 176.390 175.752 0.638 1
1 1058 . 16 1 1 A 88 88 VAL CA C 88 63.975 60.530 3.445 1
1 1059 . 16 1 1 A 88 88 VAL CB C 88 32.378 32.408 -0.030 1
1 1062 . 16 1 1 A 88 88 VAL N N 88 127.348 124.904 2.444 1
1 1063 . 16 1 1 A 89 89 GLY H H 89 9.233 8.296 0.937 1
1 1064 . 16 1 1 A 89 89 GLY HA2 H 89 4.293 4.201 0.092 1
1 1065 . 16 1 1 A 89 89 GLY HA3 H 89 4.186 4.246 -0.060 1
1 1066 . 16 1 1 A 89 89 GLY C C 89 172.378 171.746 0.632 1
1 1067 . 16 1 1 A 89 89 GLY CA C 89 43.798 46.325 -2.527 1
1 1068 . 16 1 1 A 89 89 GLY N N 89 116.041 112.832 3.209 1
1 1069 . 16 1 1 A 90 90 GLU H H 90 8.532 8.305 0.227 1
1 1070 . 16 1 1 A 90 90 GLU HA H 90 4.794 4.754 0.040 1
1 1075 . 16 1 1 A 90 90 GLU C C 90 174.221 176.116 -1.895 1
1 1076 . 16 1 1 A 90 90 GLU CA C 90 56.393 55.514 0.879 1
1 1077 . 16 1 1 A 90 90 GLU CB C 90 33.182 31.519 1.663 1
1 1079 . 16 1 1 A 90 90 GLU N N 90 120.905 123.656 -2.751 1
1 1080 . 16 1 1 A 91 91 MET H H 91 8.450 8.552 -0.102 1
1 1081 . 16 1 1 A 91 91 MET HA H 91 4.904 5.037 -0.133 1
1 1089 . 16 1 1 A 91 91 MET C C 91 173.373 173.994 -0.621 1
1 1090 . 16 1 1 A 91 91 MET CA C 91 52.277 53.088 -0.811 1
1 1091 . 16 1 1 A 91 91 MET CB C 91 32.789 34.121 -1.332 1
1 1094 . 16 1 1 A 91 91 MET N N 91 125.173 123.322 1.851 1
1 1095 . 16 1 1 A 92 92 PRO HA H 92 4.358 4.497 -0.139 1
1 1102 . 16 1 1 A 92 92 PRO C C 92 177.589 176.963 0.626 1
1 1103 . 16 1 1 A 92 92 PRO CA C 92 63.143 62.740 0.403 1
1 1104 . 16 1 1 A 92 92 PRO CB C 92 32.083 30.016 2.067 1
1 1107 . 16 1 1 A 93 93 GLY H H 93 8.330 7.879 0.451 1
1 1108 . 16 1 1 A 93 93 GLY HA2 H 93 3.943 4.098 -0.155 1
1 1109 . 16 1 1 A 93 93 GLY HA3 H 93 4.045 4.102 -0.057 1
1 1110 . 16 1 1 A 93 93 GLY C C 93 174.730 174.698 0.032 1
1 1111 . 16 1 1 A 93 93 GLY CA C 93 45.276 45.177 0.099 1
1 1112 . 16 1 1 A 93 93 GLY N N 93 109.420 112.302 -2.882 1
1 1113 . 16 1 1 A 94 94 GLY H H 94 8.331 7.865 0.466 1
1 1114 . 16 1 1 A 94 94 GLY HA2 H 94 3.973 4.006 -0.033 1
1 1115 . 16 1 1 A 94 94 GLY HA3 H 94 3.973 4.008 -0.035 1
1 1116 . 16 1 1 A 94 94 GLY C C 94 174.100 172.792 1.308 1
1 1117 . 16 1 1 A 94 94 GLY CA C 94 45.333 45.419 -0.086 1
1 1118 . 16 1 1 A 94 94 GLY N N 94 108.483 108.583 -0.100 1
1 1119 . 16 1 1 A 95 95 THR H H 95 8.095 8.638 -0.543 1
1 1120 . 16 1 1 A 95 95 THR HA H 95 4.643 5.032 -0.389 1
1 1125 . 16 1 1 A 95 95 THR C C 95 173.155 171.581 1.574 1
1 1126 . 16 1 1 A 95 95 THR CA C 95 59.922 58.429 1.493 1
1 1127 . 16 1 1 A 95 95 THR CB C 95 69.871 70.663 -0.792 1
1 1129 . 16 1 1 A 95 95 THR N N 95 115.860 111.529 4.331 1
1 1130 . 16 1 1 A 96 96 PRO HA H 96 4.400 4.721 -0.321 1
1 1137 . 16 1 1 A 96 96 PRO C C 96 177.565 175.912 1.653 1
1 1138 . 16 1 1 A 96 96 PRO CA C 96 64.047 62.267 1.780 1
1 1139 . 16 1 1 A 96 96 PRO CB C 96 31.816 29.968 1.848 1
1 1142 . 16 1 1 A 97 97 GLY H H 97 8.572 7.953 0.619 1
1 1143 . 16 1 1 A 97 97 GLY HA2 H 97 4.007 4.112 -0.105 1
1 1144 . 16 1 1 A 97 97 GLY HA3 H 97 4.007 4.113 -0.106 1
1 1145 . 16 1 1 A 97 97 GLY C C 97 174.609 174.090 0.519 1
1 1146 . 16 1 1 A 97 97 GLY CA C 97 45.276 45.457 -0.181 1
1 1147 . 16 1 1 A 97 97 GLY N N 97 110.233 109.056 1.177 1
1 1148 . 16 1 1 A 98 98 GLY H H 98 8.119 7.994 0.125 1
1 1149 . 16 1 1 A 98 98 GLY HA2 H 98 4.086 4.116 -0.030 1
1 1150 . 16 1 1 A 98 98 GLY HA3 H 98 4.200 4.119 0.081 1
1 1151 . 16 1 1 A 98 98 GLY CA C 98 44.876 46.337 -1.461 1
1 1152 . 16 1 1 A 98 98 GLY N N 98 108.845 111.165 -2.320 1
1 1153 . 16 1 1 A 99 99 PRO HA H 99 4.494 4.629 -0.135 1
1 1160 . 16 1 1 A 99 99 PRO C C 99 177.468 175.294 2.174 1
1 1161 . 16 1 1 A 99 99 PRO CA C 99 63.500 62.746 0.754 1
1 1162 . 16 1 1 A 99 99 PRO CB C 99 32.013 32.485 -0.472 1
1 1165 . 16 1 1 A 100 100 SER H H 100 8.472 8.378 0.094 1
1 1166 . 16 1 1 A 100 100 SER HA H 100 4.513 4.917 -0.404 1
1 1169 . 16 1 1 A 100 100 SER C C 100 175.408 175.007 0.401 1
1 1170 . 16 1 1 A 100 100 SER CA C 100 58.557 57.352 1.205 1
1 1171 . 16 1 1 A 100 100 SER CB C 100 63.918 66.436 -2.518 1
1 1172 . 16 1 1 A 100 100 SER N N 100 116.038 116.712 -0.674 1
1 1173 . 16 1 1 A 101 101 GLY H H 101 8.427 8.561 -0.134 1
1 1174 . 16 1 1 A 101 101 GLY HA2 H 101 4.064 3.870 0.194 1
1 1175 . 16 1 1 A 101 101 GLY HA3 H 101 4.064 3.875 0.189 1
1 1176 . 16 1 1 A 101 101 GLY C C 101 174.730 174.122 0.608 1
1 1177 . 16 1 1 A 101 101 GLY CA C 101 45.575 47.317 -1.742 1
1 1178 . 16 1 1 A 101 101 GLY N N 101 110.558 111.344 -0.786 1
1 1179 . 16 1 1 A 102 102 GLN H H 102 8.416 7.939 0.477 1
1 1180 . 16 1 1 A 102 102 GLN HA H 102 4.383 4.404 -0.021 1
1 1187 . 16 1 1 A 102 102 GLN C C 102 177.346 176.514 0.832 1
1 1188 . 16 1 1 A 102 102 GLN CA C 102 57.080 55.577 1.503 1
1 1189 . 16 1 1 A 102 102 GLN CB C 102 29.235 29.926 -0.691 1
1 1191 . 16 1 1 A 102 102 GLN N N 102 120.112 124.543 -4.431 1
1 1193 . 16 1 1 A 103 103 GLY H H 103 8.713 8.536 0.177 1
1 1194 . 16 1 1 A 103 103 GLY HA2 H 103 4.193 4.109 0.084 1
1 1195 . 16 1 1 A 103 103 GLY HA3 H 103 4.078 4.123 -0.045 1
1 1196 . 16 1 1 A 103 103 GLY C C 103 175.602 173.363 2.239 1
1 1197 . 16 1 1 A 103 103 GLY CA C 103 46.120 44.831 1.289 1
1 1198 . 16 1 1 A 103 103 GLY N N 103 109.817 109.665 0.152 1
1 1199 . 16 1 1 A 104 104 ALA H H 104 8.366 8.471 -0.105 1
1 1200 . 16 1 1 A 104 104 ALA HA H 104 4.449 4.393 0.056 1
1 1204 . 16 1 1 A 104 104 ALA C C 104 179.188 178.627 0.561 1
1 1205 . 16 1 1 A 104 104 ALA CA C 104 54.230 52.047 2.183 1
1 1206 . 16 1 1 A 104 104 ALA CB C 104 19.080 20.387 -1.307 1
1 1207 . 16 1 1 A 104 104 ALA N N 104 124.808 122.243 2.565 1
1 1208 . 16 1 1 A 105 105 GLU H H 105 8.576 8.949 -0.373 1
1 1209 . 16 1 1 A 105 105 GLU HA H 105 4.161 4.042 0.119 1
1 1214 . 16 1 1 A 105 105 GLU C C 105 179.200 178.791 0.409 1
1 1215 . 16 1 1 A 105 105 GLU CA C 105 59.173 59.804 -0.631 1
1 1216 . 16 1 1 A 105 105 GLU CB C 105 29.194 29.322 -0.128 1
1 1218 . 16 1 1 A 105 105 GLU N N 105 119.238 117.603 1.635 1
1 1219 . 16 1 1 A 106 106 ALA H H 106 8.381 8.307 0.074 1
1 1220 . 16 1 1 A 106 106 ALA HA H 106 4.283 4.107 0.176 1
1 1224 . 16 1 1 A 106 106 ALA C C 106 180.048 179.700 0.348 1
1 1225 . 16 1 1 A 106 106 ALA CA C 106 54.687 55.381 -0.694 1
1 1226 . 16 1 1 A 106 106 ALA CB C 106 18.341 18.986 -0.645 1
1 1227 . 16 1 1 A 106 106 ALA N N 106 123.327 121.573 1.754 1
1 1228 . 16 1 1 A 107 107 ALA H H 107 8.123 7.910 0.213 1
1 1229 . 16 1 1 A 107 107 ALA HA H 107 4.554 4.466 0.088 1
1 1233 . 16 1 1 A 107 107 ALA C C 107 179.757 179.694 0.063 1
1 1234 . 16 1 1 A 107 107 ALA CA C 107 55.355 55.300 0.055 1
1 1235 . 16 1 1 A 107 107 ALA CB C 107 18.939 19.188 -0.249 1
1 1236 . 16 1 1 A 107 107 ALA N N 107 120.740 120.269 0.471 1
1 1237 . 16 1 1 A 108 108 ARG H H 108 8.403 8.282 0.121 1
1 1238 . 16 1 1 A 108 108 ARG HA H 108 4.254 4.155 0.099 1
1 1245 . 16 1 1 A 108 108 ARG C C 108 179.111 178.759 0.352 1
1 1246 . 16 1 1 A 108 108 ARG CA C 108 59.015 58.603 0.412 1
1 1247 . 16 1 1 A 108 108 ARG CB C 108 29.752 30.051 -0.299 1
1 1250 . 16 1 1 A 108 108 ARG N N 108 119.531 117.282 2.249 1
1 1251 . 16 1 1 A 109 109 GLY H H 109 8.182 8.831 -0.649 1
1 1252 . 16 1 1 A 109 109 GLY HA2 H 109 3.822 3.652 0.170 1
1 1253 . 16 1 1 A 109 109 GLY HA3 H 109 3.822 3.676 0.146 1
1 1254 . 16 1 1 A 109 109 GLY C C 109 177.020 176.494 0.526 1
1 1255 . 16 1 1 A 109 109 GLY CA C 109 46.718 47.223 -0.505 1
1 1256 . 16 1 1 A 109 109 GLY N N 109 107.331 108.673 -1.342 1
1 1257 . 16 1 1 A 110 110 TRP H H 110 7.925 8.196 -0.271 1
1 1258 . 16 1 1 A 110 110 TRP HA H 110 3.963 4.518 -0.555 1
1 1267 . 16 1 1 A 110 110 TRP C C 110 176.691 177.715 -1.024 1
1 1268 . 16 1 1 A 110 110 TRP CA C 110 62.041 60.654 1.387 1
1 1269 . 16 1 1 A 110 110 TRP CB C 110 28.989 28.465 0.524 1
1 1275 . 16 1 1 A 110 110 TRP N N 110 122.304 121.037 1.267 1
1 1277 . 16 1 1 A 111 111 GLU H H 111 7.946 7.542 0.404 1
1 1278 . 16 1 1 A 111 111 GLU HA H 111 2.594 3.041 -0.447 1
1 1283 . 16 1 1 A 111 111 GLU C C 111 177.976 179.031 -1.055 1
1 1284 . 16 1 1 A 111 111 GLU CA C 111 60.193 58.727 1.466 1
1 1285 . 16 1 1 A 111 111 GLU CB C 111 29.277 29.340 -0.063 1
1 1287 . 16 1 1 A 111 111 GLU N N 111 121.755 118.988 2.767 1
1 1288 . 16 1 1 A 112 112 THR H H 112 7.993 7.681 0.312 1
1 1289 . 16 1 1 A 112 112 THR HA H 112 3.722 3.821 -0.099 1
1 1294 . 16 1 1 A 112 112 THR C C 112 176.038 175.896 0.142 1
1 1295 . 16 1 1 A 112 112 THR CA C 112 66.104 66.565 -0.461 1
1 1296 . 16 1 1 A 112 112 THR CB C 112 68.885 68.737 0.148 1
1 1298 . 16 1 1 A 112 112 THR N N 112 112.247 116.636 -4.389 1
1 1299 . 16 1 1 A 113 113 ALA H H 113 7.742 8.271 -0.529 1
1 1300 . 16 1 1 A 113 113 ALA HA H 113 4.029 3.968 0.061 1
1 1304 . 16 1 1 A 113 113 ALA C C 113 180.545 179.842 0.703 1
1 1305 . 16 1 1 A 113 113 ALA CA C 113 55.127 55.190 -0.063 1
1 1306 . 16 1 1 A 113 113 ALA CB C 113 18.854 18.326 0.528 1
1 1307 . 16 1 1 A 113 113 ALA N N 113 123.134 122.791 0.343 1
1 1308 . 16 1 1 A 114 114 ILE H H 114 8.472 8.488 -0.016 1
1 1309 . 16 1 1 A 114 114 ILE HA H 114 3.613 3.765 -0.152 1
1 1319 . 16 1 1 A 114 114 ILE C C 114 176.947 177.981 -1.034 1
1 1320 . 16 1 1 A 114 114 ILE CA C 114 66.016 65.011 1.005 1
1 1321 . 16 1 1 A 114 114 ILE CB C 114 38.335 38.071 0.264 1
1 1325 . 16 1 1 A 114 114 ILE N N 114 118.276 117.865 0.411 1
1 1326 . 16 1 1 A 115 115 ARG H H 115 8.181 8.016 0.165 1
1 1327 . 16 1 1 A 115 115 ARG HA H 115 3.835 3.900 -0.065 1
1 1334 . 16 1 1 A 115 115 ARG C C 115 179.588 178.949 0.639 1
1 1335 . 16 1 1 A 115 115 ARG CA C 115 61.072 60.089 0.983 1
1 1336 . 16 1 1 A 115 115 ARG CB C 115 29.975 29.852 0.123 1
1 1339 . 16 1 1 A 115 115 ARG N N 115 117.921 119.466 -1.545 1
1 1340 . 16 1 1 A 116 116 GLN H H 116 8.395 8.378 0.017 1
1 1341 . 16 1 1 A 116 116 GLN HA H 116 4.030 3.996 0.034 1
1 1348 . 16 1 1 A 116 116 GLN C C 116 178.716 178.572 0.144 1
1 1349 . 16 1 1 A 116 116 GLN CA C 116 58.790 58.599 0.191 1
1 1350 . 16 1 1 A 116 116 GLN CB C 116 28.248 28.381 -0.133 1
1 1352 . 16 1 1 A 116 116 GLN N N 116 116.842 118.828 -1.986 1
1 1354 . 16 1 1 A 117 117 ALA H H 117 7.902 7.897 0.005 1
1 1355 . 16 1 1 A 117 117 ALA HA H 117 4.143 4.089 0.054 1
1 1359 . 16 1 1 A 117 117 ALA C C 117 179.685 180.356 -0.671 1
1 1360 . 16 1 1 A 117 117 ALA CA C 117 54.476 54.218 0.258 1
1 1361 . 16 1 1 A 117 117 ALA CB C 117 18.300 18.301 -0.001 1
1 1362 . 16 1 1 A 117 117 ALA N N 117 122.828 122.246 0.582 1
1 1363 . 16 1 1 A 118 118 LEU H H 118 7.904 7.970 -0.066 1
1 1364 . 16 1 1 A 118 118 LEU HA H 118 4.119 4.151 -0.032 1
1 1374 . 16 1 1 A 118 118 LEU C C 118 178.437 178.758 -0.321 1
1 1375 . 16 1 1 A 118 118 LEU CA C 118 56.781 57.045 -0.264 1
1 1376 . 16 1 1 A 118 118 LEU CB C 118 42.371 41.842 0.529 1
1 1380 . 16 1 1 A 118 118 LEU N N 118 117.632 120.503 -2.871 1
1 1381 . 16 1 1 A 119 119 MET H H 119 7.673 7.801 -0.128 1
1 1382 . 16 1 1 A 119 119 MET HA H 119 4.442 4.279 0.163 1
1 1390 . 16 1 1 A 119 119 MET C C 119 176.680 178.175 -1.495 1
1 1391 . 16 1 1 A 119 119 MET CA C 119 56.432 57.719 -1.287 1
1 1392 . 16 1 1 A 119 119 MET CB C 119 32.769 31.177 1.592 1
1 1395 . 16 1 1 A 119 119 MET N N 119 117.286 118.061 -0.775 1
1 1396 . 16 1 1 A 120 120 SER H H 120 7.878 7.646 0.232 1
1 1397 . 16 1 1 A 120 120 SER HA H 120 4.500 4.221 0.279 1
1 1400 . 16 1 1 A 120 120 SER C C 120 174.742 175.766 -1.024 1
1 1401 . 16 1 1 A 120 120 SER CA C 120 58.962 61.043 -2.081 1
1 1402 . 16 1 1 A 120 120 SER CB C 120 63.853 62.828 1.025 1
1 1403 . 16 1 1 A 120 120 SER N N 120 115.064 114.808 0.256 1
1 1404 . 16 1 1 A 121 121 GLY H H 121 8.059 7.833 0.226 1
1 1405 . 16 1 1 A 121 121 GLY HA2 H 121 4.231 4.023 0.208 1
1 1406 . 16 1 1 A 121 121 GLY HA3 H 121 4.112 4.023 0.089 1
1 1407 . 16 1 1 A 121 121 GLY C C 121 172.065 173.273 -1.208 1
1 1408 . 16 1 1 A 121 121 GLY CA C 121 45.030 44.901 0.129 1
1 1409 . 16 1 1 A 121 121 GLY N N 121 110.271 109.384 0.887 1
1 1410 . 16 1 1 A 122 122 PRO HA H 122 4.496 4.706 -0.210 1
1 1417 . 16 1 1 A 122 122 PRO CA C 122 63.399 62.436 0.963 1
1 1418 . 16 1 1 A 122 122 PRO CB C 122 32.186 29.764 2.422 1
1 1 . 17 1 1 A 6 6 SER H H 6 8.337 8.863 -0.526 1
1 2 . 17 1 1 A 6 6 SER HA H 6 4.597 4.047 0.550 1
1 5 . 17 1 1 A 6 6 SER C C 6 174.637 173.389 1.248 1
1 6 . 17 1 1 A 6 6 SER CA C 6 58.469 59.074 -0.605 1
1 7 . 17 1 1 A 6 6 SER CB C 6 64.221 61.869 2.352 1
1 8 . 17 1 1 A 6 6 SER N N 6 117.887 119.617 -1.730 1
1 9 . 17 1 1 A 7 7 GLY H H 7 8.280 8.310 -0.030 1
1 10 . 17 1 1 A 7 7 GLY HA2 H 7 4.063 4.141 -0.078 1
1 11 . 17 1 1 A 7 7 GLY HA3 H 7 4.063 4.144 -0.081 1
1 12 . 17 1 1 A 7 7 GLY C C 7 173.724 172.480 1.244 1
1 13 . 17 1 1 A 7 7 GLY CA C 7 44.941 44.958 -0.017 1
1 14 . 17 1 1 A 7 7 GLY N N 7 110.151 106.903 3.248 1
1 15 . 17 1 1 A 8 8 THR H H 8 8.212 8.506 -0.294 1
1 16 . 17 1 1 A 8 8 THR HA H 8 4.173 5.420 -1.247 1
1 21 . 17 1 1 A 8 8 THR C C 8 174.723 173.969 0.754 1
1 22 . 17 1 1 A 8 8 THR CA C 8 63.622 61.421 2.201 1
1 23 . 17 1 1 A 8 8 THR CB C 8 69.460 70.919 -1.459 1
1 25 . 17 1 1 A 8 8 THR N N 8 116.817 115.207 1.610 1
1 26 . 17 1 1 A 9 9 LEU H H 9 9.374 9.264 0.110 1
1 27 . 17 1 1 A 9 9 LEU HA H 9 4.302 4.292 0.010 1
1 37 . 17 1 1 A 9 9 LEU C C 9 177.468 176.693 0.775 1
1 38 . 17 1 1 A 9 9 LEU CA C 9 55.936 56.197 -0.261 1
1 39 . 17 1 1 A 9 9 LEU CB C 9 42.843 42.746 0.097 1
1 43 . 17 1 1 A 9 9 LEU N N 9 127.798 127.492 0.306 1
1 44 . 17 1 1 A 10 10 ARG H H 10 7.512 7.407 0.105 1
1 45 . 17 1 1 A 10 10 ARG HA H 10 4.199 4.766 -0.567 1
1 52 . 17 1 1 A 10 10 ARG C C 10 172.501 174.139 -1.638 1
1 53 . 17 1 1 A 10 10 ARG CA C 10 56.165 54.408 1.757 1
1 54 . 17 1 1 A 10 10 ARG CB C 10 32.442 33.532 -1.090 1
1 57 . 17 1 1 A 10 10 ARG N N 10 117.979 116.864 1.115 1
1 58 . 17 1 1 A 11 11 GLU H H 11 8.434 8.832 -0.398 1
1 59 . 17 1 1 A 11 11 GLU HA H 11 5.993 5.676 0.317 1
1 64 . 17 1 1 A 11 11 GLU C C 11 174.800 174.572 0.228 1
1 65 . 17 1 1 A 11 11 GLU CA C 11 54.570 55.158 -0.588 1
1 66 . 17 1 1 A 11 11 GLU CB C 11 34.245 33.189 1.056 1
1 68 . 17 1 1 A 11 11 GLU N N 11 120.782 121.268 -0.486 1
1 69 . 17 1 1 A 12 12 GLY H H 12 8.131 7.873 0.258 1
1 70 . 17 1 1 A 12 12 GLY HA2 H 12 4.714 3.534 1.180 1
1 71 . 17 1 1 A 12 12 GLY HA3 H 12 3.763 4.110 -0.347 1
1 72 . 17 1 1 A 12 12 GLY C C 12 171.060 171.878 -0.818 1
1 73 . 17 1 1 A 12 12 GLY CA C 12 45.241 44.908 0.333 1
1 74 . 17 1 1 A 12 12 GLY N N 12 107.457 106.226 1.231 1
1 75 . 17 1 1 A 13 13 TRP H H 13 8.783 8.469 0.314 1
1 76 . 17 1 1 A 13 13 TRP HA H 13 5.152 4.916 0.236 1
1 85 . 17 1 1 A 13 13 TRP C C 13 177.528 176.715 0.813 1
1 86 . 17 1 1 A 13 13 TRP CA C 13 57.783 58.726 -0.943 1
1 87 . 17 1 1 A 13 13 TRP CB C 13 30.222 30.180 0.042 1
1 93 . 17 1 1 A 13 13 TRP N N 13 120.792 121.307 -0.515 1
1 95 . 17 1 1 A 14 14 VAL H H 14 9.179 8.904 0.275 1
1 96 . 17 1 1 A 14 14 VAL HA H 14 4.072 4.625 -0.553 1
1 104 . 17 1 1 A 14 14 VAL C C 14 174.981 173.524 1.457 1
1 105 . 17 1 1 A 14 14 VAL CA C 14 61.741 60.110 1.631 1
1 106 . 17 1 1 A 14 14 VAL CB C 14 35.143 35.272 -0.129 1
1 109 . 17 1 1 A 14 14 VAL N N 14 125.476 122.792 2.684 1
1 110 . 17 1 1 A 15 15 VAL H H 15 8.403 8.852 -0.449 1
1 111 . 17 1 1 A 15 15 VAL HA H 15 5.532 5.269 0.263 1
1 119 . 17 1 1 A 15 15 VAL C C 15 175.078 174.369 0.709 1
1 120 . 17 1 1 A 15 15 VAL CA C 15 59.489 59.389 0.100 1
1 121 . 17 1 1 A 15 15 VAL CB C 15 34.210 35.007 -0.797 1
1 124 . 17 1 1 A 15 15 VAL N N 15 126.189 125.904 0.285 1
1 125 . 17 1 1 A 16 16 HIS H H 16 9.122 8.498 0.624 1
1 126 . 17 1 1 A 16 16 HIS HA H 16 5.823 5.887 -0.064 1
1 131 . 17 1 1 A 16 16 HIS C C 16 172.998 172.492 0.506 1
1 132 . 17 1 1 A 16 16 HIS CA C 16 56.253 53.941 2.312 1
1 133 . 17 1 1 A 16 16 HIS CB C 16 34.273 33.178 1.095 1
1 136 . 17 1 1 A 16 16 HIS N N 16 121.152 120.996 0.156 1
1 137 . 17 1 1 A 17 17 TYR H H 17 8.465 8.774 -0.309 1
1 138 . 17 1 1 A 17 17 TYR HA H 17 5.096 4.866 0.230 1
1 145 . 17 1 1 A 17 17 TYR C C 17 173.640 172.904 0.736 1
1 146 . 17 1 1 A 17 17 TYR CA C 17 56.903 56.315 0.588 1
1 147 . 17 1 1 A 17 17 TYR CB C 17 40.103 39.946 0.157 1
1 152 . 17 1 1 A 17 17 TYR N N 17 115.558 116.503 -0.945 1
1 153 . 17 1 1 A 18 18 SER H H 18 9.122 8.141 0.981 1
1 154 . 17 1 1 A 18 18 SER HA H 18 6.144 5.521 0.623 1
1 157 . 17 1 1 A 18 18 SER C C 18 173.204 176.351 -3.147 1
1 158 . 17 1 1 A 18 18 SER CA C 18 56.640 56.531 0.109 1
1 159 . 17 1 1 A 18 18 SER CB C 18 68.788 66.774 2.014 1
1 160 . 17 1 1 A 18 18 SER N N 18 118.846 115.547 3.299 1
1 161 . 17 1 1 A 19 19 ASN H H 19 9.053 9.214 -0.161 1
1 162 . 17 1 1 A 19 19 ASN HA H 19 4.473 4.640 -0.167 1
1 167 . 17 1 1 A 19 19 ASN C C 19 175.396 177.343 -1.947 1
1 168 . 17 1 1 A 19 19 ASN CA C 19 55.373 55.701 -0.328 1
1 169 . 17 1 1 A 19 19 ASN CB C 19 36.900 37.640 -0.740 1
1 170 . 17 1 1 A 19 19 ASN N N 19 113.712 117.953 -4.241 1
1 172 . 17 1 1 A 20 20 LYS H H 20 7.677 7.976 -0.299 1
1 173 . 17 1 1 A 20 20 LYS HA H 20 4.413 4.290 0.123 1
1 182 . 17 1 1 A 20 20 LYS C C 20 176.078 176.781 -0.703 1
1 183 . 17 1 1 A 20 20 LYS CA C 20 55.679 58.425 -2.746 1
1 184 . 17 1 1 A 20 20 LYS CB C 20 33.023 32.931 0.092 1
1 188 . 17 1 1 A 20 20 LYS N N 20 117.213 117.895 -0.682 1
1 189 . 17 1 1 A 21 21 ASP H H 21 7.395 8.049 -0.654 1
1 190 . 17 1 1 A 21 21 ASP HA H 21 4.808 4.849 -0.041 1
1 193 . 17 1 1 A 21 21 ASP C C 21 176.413 176.443 -0.030 1
1 194 . 17 1 1 A 21 21 ASP CA C 21 53.983 53.177 0.806 1
1 195 . 17 1 1 A 21 21 ASP CB C 21 41.199 39.441 1.758 1
1 196 . 17 1 1 A 21 21 ASP N N 21 119.879 119.380 0.499 1
1 197 . 17 1 1 A 22 22 THR H H 22 8.593 7.748 0.845 1
1 198 . 17 1 1 A 22 22 THR HA H 22 4.352 4.485 -0.133 1
1 203 . 17 1 1 A 22 22 THR C C 22 172.913 174.793 -1.880 1
1 204 . 17 1 1 A 22 22 THR CA C 22 62.691 61.464 1.227 1
1 205 . 17 1 1 A 22 22 THR CB C 22 68.332 68.428 -0.096 1
1 207 . 17 1 1 A 22 22 THR N N 22 116.299 114.333 1.966 1
1 208 . 17 1 1 A 23 23 LEU H H 23 7.645 7.529 0.116 1
1 209 . 17 1 1 A 23 23 LEU HA H 23 4.318 4.388 -0.070 1
1 219 . 17 1 1 A 23 23 LEU C C 23 176.692 176.903 -0.211 1
1 220 . 17 1 1 A 23 23 LEU CA C 23 54.617 54.276 0.341 1
1 221 . 17 1 1 A 23 23 LEU CB C 23 41.939 41.129 0.810 1
1 225 . 17 1 1 A 23 23 LEU N N 23 123.606 120.937 2.669 1
1 226 . 17 1 1 A 24 24 ARG H H 24 8.563 7.463 1.100 1
1 227 . 17 1 1 A 24 24 ARG HA H 24 4.373 4.396 -0.023 1
1 235 . 17 1 1 A 24 24 ARG C C 24 176.584 175.707 0.877 1
1 236 . 17 1 1 A 24 24 ARG CA C 24 57.854 56.948 0.906 1
1 237 . 17 1 1 A 24 24 ARG CB C 24 31.126 30.387 0.739 1
1 240 . 17 1 1 A 24 24 ARG N N 24 127.152 122.758 4.394 1
1 242 . 17 1 1 A 25 25 LYS H H 25 8.633 8.338 0.295 1
1 243 . 17 1 1 A 25 25 LYS HA H 25 4.513 4.893 -0.380 1
1 251 . 17 1 1 A 25 25 LYS C C 25 173.567 174.614 -1.047 1
1 252 . 17 1 1 A 25 25 LYS CA C 25 54.792 54.940 -0.148 1
1 253 . 17 1 1 A 25 25 LYS CB C 25 37.416 34.242 3.174 1
1 257 . 17 1 1 A 25 25 LYS N N 25 122.682 121.586 1.096 1
1 258 . 17 1 1 A 26 26 ARG H H 26 8.303 8.866 -0.563 1
1 259 . 17 1 1 A 26 26 ARG HA H 26 5.153 5.435 -0.282 1
1 266 . 17 1 1 A 26 26 ARG C C 26 174.554 175.009 -0.455 1
1 267 . 17 1 1 A 26 26 ARG CA C 26 55.083 54.849 0.234 1
1 268 . 17 1 1 A 26 26 ARG CB C 26 32.789 31.852 0.937 1
1 271 . 17 1 1 A 26 26 ARG N N 26 121.819 124.830 -3.011 1
1 272 . 17 1 1 A 27 27 HIS H H 27 8.793 9.280 -0.487 1
1 273 . 17 1 1 A 27 27 HIS HA H 27 5.155 5.628 -0.473 1
1 278 . 17 1 1 A 27 27 HIS CA C 27 56.904 54.978 1.926 1
1 279 . 17 1 1 A 27 27 HIS CB C 27 34.683 31.388 3.295 1
1 282 . 17 1 1 A 27 27 HIS N N 27 122.102 120.537 1.565 1
1 283 . 17 1 1 A 28 28 TYR H H 28 9.273 8.033 1.240 1
1 284 . 17 1 1 A 28 28 TYR HA H 28 4.332 4.302 0.030 1
1 291 . 17 1 1 A 28 28 TYR C C 28 174.730 175.121 -0.391 1
1 292 . 17 1 1 A 28 28 TYR CA C 28 58.680 57.199 1.481 1
1 293 . 17 1 1 A 28 28 TYR CB C 28 38.673 37.945 0.728 1
1 298 . 17 1 1 A 28 28 TYR N N 28 125.605 121.131 4.474 1
1 299 . 17 1 1 A 29 29 TRP H H 29 9.273 9.013 0.260 1
1 300 . 17 1 1 A 29 29 TRP HA H 29 5.543 4.874 0.669 1
1 309 . 17 1 1 A 29 29 TRP C C 29 176.172 176.695 -0.523 1
1 310 . 17 1 1 A 29 29 TRP CA C 29 56.658 57.019 -0.361 1
1 311 . 17 1 1 A 29 29 TRP CB C 29 32.154 30.920 1.234 1
1 317 . 17 1 1 A 29 29 TRP N N 29 131.340 128.302 3.038 1
1 318 . 17 1 1 A 30 30 ARG H H 30 9.164 9.265 -0.101 1
1 319 . 17 1 1 A 30 30 ARG HA H 30 5.302 5.328 -0.026 1
1 327 . 17 1 1 A 30 30 ARG C C 30 174.774 174.392 0.382 1
1 328 . 17 1 1 A 30 30 ARG CA C 30 56.271 54.878 1.393 1
1 329 . 17 1 1 A 30 30 ARG CB C 30 34.203 33.311 0.892 1
1 332 . 17 1 1 A 30 30 ARG N N 30 116.040 121.415 -5.375 1
1 334 . 17 1 1 A 31 31 LEU H H 31 9.273 9.396 -0.123 1
1 335 . 17 1 1 A 31 31 LEU HA H 31 5.324 5.461 -0.137 1
1 345 . 17 1 1 A 31 31 LEU C C 31 174.488 174.510 -0.022 1
1 346 . 17 1 1 A 31 31 LEU CA C 31 53.807 53.494 0.313 1
1 347 . 17 1 1 A 31 31 LEU CB C 31 46.667 45.901 0.766 1
1 351 . 17 1 1 A 31 31 LEU N N 31 127.075 127.058 0.017 1
1 352 . 17 1 1 A 32 32 ASP H H 32 8.854 8.638 0.216 1
1 353 . 17 1 1 A 32 32 ASP HA H 32 4.902 5.090 -0.188 1
1 356 . 17 1 1 A 32 32 ASP C C 32 173.474 176.565 -3.091 1
1 357 . 17 1 1 A 32 32 ASP CA C 32 53.104 52.286 0.818 1
1 358 . 17 1 1 A 32 32 ASP CB C 32 42.931 44.261 -1.330 1
1 359 . 17 1 1 A 32 32 ASP N N 32 129.349 125.511 3.838 1
1 360 . 17 1 1 A 33 33 CYS H H 33 8.153 8.787 -0.634 1
1 361 . 17 1 1 A 33 33 CYS HA H 33 4.323 4.424 -0.101 1
1 364 . 17 1 1 A 33 33 CYS C C 33 174.476 175.605 -1.129 1
1 365 . 17 1 1 A 33 33 CYS CA C 33 59.853 60.048 -0.195 1
1 366 . 17 1 1 A 33 33 CYS CB C 33 27.508 27.772 -0.264 1
1 367 . 17 1 1 A 33 33 CYS N N 33 108.439 119.681 -11.242 1
1 368 . 17 1 1 A 34 34 LYS H H 34 9.144 7.842 1.302 1
1 369 . 17 1 1 A 34 34 LYS HA H 34 4.616 4.361 0.255 1
1 378 . 17 1 1 A 34 34 LYS C C 34 177.601 176.360 1.241 1
1 379 . 17 1 1 A 34 34 LYS CA C 34 57.185 56.892 0.293 1
1 380 . 17 1 1 A 34 34 LYS CB C 34 35.623 34.359 1.264 1
1 384 . 17 1 1 A 34 34 LYS N N 34 119.884 117.643 2.241 1
1 385 . 17 1 1 A 35 35 CYS H H 35 9.102 7.740 1.362 1
1 386 . 17 1 1 A 35 35 CYS HA H 35 4.935 4.794 0.141 1
1 389 . 17 1 1 A 35 35 CYS C C 35 172.283 172.304 -0.021 1
1 390 . 17 1 1 A 35 35 CYS CA C 35 57.748 56.836 0.912 1
1 391 . 17 1 1 A 35 35 CYS CB C 35 31.537 30.460 1.077 1
1 392 . 17 1 1 A 35 35 CYS N N 35 120.317 113.424 6.893 1
1 393 . 17 1 1 A 36 36 ILE H H 36 8.213 8.964 -0.751 1
1 394 . 17 1 1 A 36 36 ILE HA H 36 4.617 4.885 -0.268 1
1 404 . 17 1 1 A 36 36 ILE C C 36 175.312 175.266 0.046 1
1 405 . 17 1 1 A 36 36 ILE CA C 36 60.967 60.295 0.672 1
1 406 . 17 1 1 A 36 36 ILE CB C 36 39.718 38.323 1.395 1
1 410 . 17 1 1 A 36 36 ILE N N 36 121.905 119.794 2.111 1
1 411 . 17 1 1 A 37 37 THR H H 37 9.076 8.703 0.373 1
1 412 . 17 1 1 A 37 37 THR HA H 37 4.364 4.548 -0.184 1
1 417 . 17 1 1 A 37 37 THR CA C 37 61.834 62.757 -0.923 1
1 418 . 17 1 1 A 37 37 THR CB C 37 69.237 70.233 -0.996 1
1 420 . 17 1 1 A 37 37 THR N N 37 122.500 123.560 -1.060 1
1 421 . 17 1 1 A 38 38 LEU H H 38 8.263 8.769 -0.506 1
1 422 . 17 1 1 A 38 38 LEU HA H 38 4.445 4.971 -0.526 1
1 432 . 17 1 1 A 38 38 LEU CA C 38 55.611 53.653 1.958 1
1 433 . 17 1 1 A 38 38 LEU CB C 38 42.702 45.522 -2.820 1
1 437 . 17 1 1 A 38 38 LEU N N 38 126.987 123.819 3.168 1
1 438 . 17 1 1 A 39 39 PHE H H 39 9.520 8.614 0.906 1
1 439 . 17 1 1 A 39 39 PHE HA H 39 4.998 5.046 -0.048 1
1 447 . 17 1 1 A 39 39 PHE CA C 39 57.331 56.291 1.040 1
1 448 . 17 1 1 A 39 39 PHE CB C 39 42.453 40.545 1.908 1
1 454 . 17 1 1 A 39 39 PHE N N 39 120.545 121.165 -0.620 1
1 455 . 17 1 1 A 40 40 GLN H H 40 9.878 8.748 1.130 1
1 456 . 17 1 1 A 40 40 GLN HA H 40 4.376 4.189 0.187 1
1 463 . 17 1 1 A 40 40 GLN CA C 40 59.513 58.379 1.134 1
1 464 . 17 1 1 A 40 40 GLN CB C 40 29.317 28.477 0.840 1
1 467 . 17 1 1 A 41 41 ASN H H 41 7.732 8.051 -0.319 1
1 468 . 17 1 1 A 41 41 ASN HA H 41 4.812 5.430 -0.618 1
1 473 . 17 1 1 A 41 41 ASN CA C 41 52.618 52.298 0.320 1
1 474 . 17 1 1 A 41 41 ASN CB C 41 39.362 41.792 -2.430 1
1 475 . 17 1 1 A 41 41 ASN N N 41 107.613 115.292 -7.679 1
1 477 . 17 1 1 A 42 42 ASN HA H 42 3.476 3.868 -0.392 1
1 482 . 17 1 1 A 42 42 ASN C C 42 173.607 175.660 -2.053 1
1 483 . 17 1 1 A 42 42 ASN CA C 42 54.888 55.335 -0.447 1
1 484 . 17 1 1 A 42 42 ASN CB C 42 35.613 37.937 -2.324 1
1 486 . 17 1 1 A 43 43 THR H H 43 8.394 7.831 0.563 1
1 487 . 17 1 1 A 43 43 THR HA H 43 4.403 4.625 -0.222 1
1 492 . 17 1 1 A 43 43 THR C C 43 174.464 172.267 2.197 1
1 493 . 17 1 1 A 43 43 THR CA C 43 61.978 60.998 0.980 1
1 494 . 17 1 1 A 43 43 THR CB C 43 70.036 69.012 1.024 1
1 496 . 17 1 1 A 43 43 THR N N 43 111.795 113.004 -1.209 1
1 497 . 17 1 1 A 44 44 THR H H 44 8.058 8.431 -0.373 1
1 498 . 17 1 1 A 44 44 THR HA H 44 4.464 5.072 -0.608 1
1 503 . 17 1 1 A 44 44 THR CA C 44 61.599 59.498 2.101 1
1 504 . 17 1 1 A 44 44 THR CB C 44 69.137 71.882 -2.745 1
1 506 . 17 1 1 A 44 44 THR N N 44 116.514 121.096 -4.582 1
1 507 . 17 1 1 A 45 45 ASN H H 45 6.653 8.462 -1.809 1
1 508 . 17 1 1 A 45 45 ASN HA H 45 4.945 4.701 0.244 1
1 513 . 17 1 1 A 45 45 ASN CA C 45 53.227 52.526 0.701 1
1 514 . 17 1 1 A 45 45 ASN CB C 45 38.483 39.469 -0.986 1
1 516 . 17 1 1 A 46 46 ARG H H 46 8.213 8.481 -0.268 1
1 517 . 17 1 1 A 46 46 ARG HA H 46 4.583 4.322 0.261 1
1 524 . 17 1 1 A 46 46 ARG CA C 46 55.487 57.415 -1.928 1
1 525 . 17 1 1 A 46 46 ARG CB C 46 31.153 30.460 0.693 1
1 528 . 17 1 1 A 46 46 ARG N N 46 121.652 119.879 1.773 1
1 529 . 17 1 1 A 47 47 TYR H H 47 7.973 8.588 -0.615 1
1 536 . 17 1 1 A 47 47 TYR CB C 47 39.356 39.041 0.315 1
1 541 . 17 1 1 A 48 48 TYR H H 48 9.023 8.345 0.678 1
1 542 . 17 1 1 A 48 48 TYR HA H 48 4.662 4.284 0.378 1
1 549 . 17 1 1 A 48 48 TYR CB C 48 39.863 40.364 -0.501 1
1 554 . 17 1 1 A 48 48 TYR N N 48 121.223 121.619 -0.396 1
1 555 . 17 1 1 A 49 49 LYS H H 49 7.134 7.305 -0.171 1
1 556 . 17 1 1 A 49 49 LYS HA H 49 4.283 4.696 -0.413 1
1 565 . 17 1 1 A 49 49 LYS CA C 49 55.167 54.946 0.221 1
1 566 . 17 1 1 A 49 49 LYS CB C 49 36.699 36.132 0.567 1
1 570 . 17 1 1 A 49 49 LYS N N 49 117.339 118.537 -1.198 1
1 571 . 17 1 1 A 50 50 GLU H H 50 8.411 8.850 -0.439 1
1 572 . 17 1 1 A 50 50 GLU HA H 50 4.583 4.977 -0.394 1
1 577 . 17 1 1 A 50 50 GLU CA C 50 54.592 55.012 -0.420 1
1 578 . 17 1 1 A 50 50 GLU CB C 50 33.263 33.304 -0.041 1
1 580 . 17 1 1 A 50 50 GLU N N 50 123.825 124.190 -0.365 1
1 581 . 17 1 1 A 51 51 ILE H H 51 9.225 9.050 0.175 1
1 582 . 17 1 1 A 51 51 ILE HA H 51 4.277 4.654 -0.377 1
1 592 . 17 1 1 A 51 51 ILE CA C 51 58.182 58.068 0.114 1
1 593 . 17 1 1 A 51 51 ILE CB C 51 39.663 38.514 1.149 1
1 597 . 17 1 1 A 51 51 ILE N N 51 125.271 126.461 -1.190 1
1 598 . 17 1 1 A 52 52 PRO HA H 52 4.543 4.616 -0.073 1
1 605 . 17 1 1 A 52 52 PRO C C 52 178.340 178.039 0.301 1
1 606 . 17 1 1 A 52 52 PRO CA C 52 62.726 62.864 -0.138 1
1 607 . 17 1 1 A 52 52 PRO CB C 52 32.003 31.653 0.350 1
1 610 . 17 1 1 A 53 53 LEU H H 53 8.723 8.522 0.201 1
1 611 . 17 1 1 A 53 53 LEU HA H 53 3.891 3.891 0.000 1
1 621 . 17 1 1 A 53 53 LEU C C 53 179.673 178.878 0.795 1
1 622 . 17 1 1 A 53 53 LEU CA C 53 58.205 57.574 0.631 1
1 623 . 17 1 1 A 53 53 LEU CB C 53 40.171 41.508 -1.337 1
1 627 . 17 1 1 A 53 53 LEU N N 53 125.150 124.373 0.777 1
1 628 . 17 1 1 A 54 54 SER H H 54 8.360 8.344 0.016 1
1 629 . 17 1 1 A 54 54 SER HA H 54 4.164 4.087 0.077 1
1 632 . 17 1 1 A 54 54 SER C C 54 175.517 177.156 -1.639 1
1 633 . 17 1 1 A 54 54 SER CA C 54 60.193 61.460 -1.267 1
1 634 . 17 1 1 A 54 54 SER CB C 54 62.617 62.251 0.366 1
1 635 . 17 1 1 A 54 54 SER N N 54 111.266 113.331 -2.065 1
1 636 . 17 1 1 A 55 55 GLU H H 55 7.666 8.090 -0.424 1
1 637 . 17 1 1 A 55 55 GLU HA H 55 4.363 4.205 0.158 1
1 642 . 17 1 1 A 55 55 GLU C C 55 176.753 177.603 -0.850 1
1 643 . 17 1 1 A 55 55 GLU CA C 55 56.200 58.853 -2.653 1
1 644 . 17 1 1 A 55 55 GLU CB C 55 30.526 29.503 1.023 1
1 646 . 17 1 1 A 55 55 GLU N N 55 119.485 119.278 0.207 1
1 647 . 17 1 1 A 56 56 ILE H H 56 7.601 7.086 0.515 1
1 648 . 17 1 1 A 56 56 ILE HA H 56 3.793 3.929 -0.136 1
1 658 . 17 1 1 A 56 56 ILE C C 56 175.142 175.974 -0.832 1
1 659 . 17 1 1 A 56 56 ILE CA C 56 63.518 62.460 1.058 1
1 660 . 17 1 1 A 56 56 ILE CB C 56 37.169 38.073 -0.904 1
1 664 . 17 1 1 A 56 56 ILE N N 56 120.430 120.544 -0.114 1
1 665 . 17 1 1 A 57 57 LEU H H 57 9.263 9.303 -0.040 1
1 666 . 17 1 1 A 57 57 LEU HA H 57 4.343 4.376 -0.033 1
1 676 . 17 1 1 A 57 57 LEU C C 57 177.898 176.516 1.382 1
1 677 . 17 1 1 A 57 57 LEU CA C 57 56.569 55.905 0.664 1
1 678 . 17 1 1 A 57 57 LEU CB C 57 41.980 42.475 -0.495 1
1 682 . 17 1 1 A 57 57 LEU N N 57 129.464 129.067 0.397 1
1 683 . 17 1 1 A 58 58 THR H H 58 7.414 7.339 0.075 1
1 684 . 17 1 1 A 58 58 THR HA H 58 4.512 4.853 -0.341 1
1 689 . 17 1 1 A 58 58 THR C C 58 171.314 172.717 -1.403 1
1 690 . 17 1 1 A 58 58 THR CA C 58 60.562 61.259 -0.697 1
1 691 . 17 1 1 A 58 58 THR CB C 58 70.803 73.289 -2.486 1
1 693 . 17 1 1 A 58 58 THR N N 58 109.129 110.594 -1.465 1
1 694 . 17 1 1 A 59 59 VAL H H 59 8.152 8.444 -0.292 1
1 695 . 17 1 1 A 59 59 VAL HA H 59 5.061 5.077 -0.016 1
1 703 . 17 1 1 A 59 59 VAL C C 59 174.985 174.911 0.074 1
1 704 . 17 1 1 A 59 59 VAL CA C 59 61.354 61.132 0.222 1
1 705 . 17 1 1 A 59 59 VAL CB C 59 33.855 34.131 -0.276 1
1 708 . 17 1 1 A 59 59 VAL N N 59 123.676 124.576 -0.900 1
1 709 . 17 1 1 A 60 60 GLU H H 60 9.074 8.739 0.335 1
1 710 . 17 1 1 A 60 60 GLU HA H 60 4.977 4.872 0.105 1
1 715 . 17 1 1 A 60 60 GLU C C 60 176.063 175.295 0.768 1
1 716 . 17 1 1 A 60 60 GLU CA C 60 53.807 54.395 -0.588 1
1 717 . 17 1 1 A 60 60 GLU CB C 60 33.739 33.460 0.279 1
1 719 . 17 1 1 A 60 60 GLU N N 60 125.125 126.061 -0.936 1
1 720 . 17 1 1 A 61 61 SER H H 61 8.763 8.726 0.037 1
1 721 . 17 1 1 A 61 61 SER HA H 61 4.452 5.013 -0.561 1
1 724 . 17 1 1 A 61 61 SER C C 61 173.288 174.144 -0.856 1
1 725 . 17 1 1 A 61 61 SER CA C 61 59.384 58.102 1.282 1
1 726 . 17 1 1 A 61 61 SER CB C 61 63.390 64.528 -1.138 1
1 727 . 17 1 1 A 61 61 SER N N 61 117.523 118.358 -0.835 1
1 728 . 17 1 1 A 62 62 ALA H H 62 7.293 8.944 -1.651 1
1 729 . 17 1 1 A 62 62 ALA HA H 62 3.817 4.361 -0.544 1
1 733 . 17 1 1 A 62 62 ALA C C 62 176.717 177.804 -1.087 1
1 734 . 17 1 1 A 62 62 ALA CA C 62 53.966 53.089 0.877 1
1 735 . 17 1 1 A 62 62 ALA CB C 62 18.640 18.506 0.134 1
1 736 . 17 1 1 A 62 62 ALA N N 62 122.650 126.438 -3.788 1
1 737 . 17 1 1 A 63 63 GLN H H 63 8.736 8.063 0.673 1
1 738 . 17 1 1 A 63 63 GLN HA H 63 4.445 4.698 -0.253 1
1 745 . 17 1 1 A 63 63 GLN C C 63 173.700 175.145 -1.445 1
1 746 . 17 1 1 A 63 63 GLN CA C 63 56.376 55.758 0.618 1
1 747 . 17 1 1 A 63 63 GLN CB C 63 31.515 30.996 0.519 1
1 749 . 17 1 1 A 63 63 GLN N N 63 120.251 119.435 0.816 1
1 751 . 17 1 1 A 64 64 ASN H H 64 9.272 7.738 1.534 1
1 752 . 17 1 1 A 64 64 ASN HA H 64 4.906 5.065 -0.159 1
1 757 . 17 1 1 A 64 64 ASN C C 64 174.754 174.482 0.272 1
1 758 . 17 1 1 A 64 64 ASN CA C 64 51.837 52.286 -0.449 1
1 759 . 17 1 1 A 64 64 ASN CB C 64 38.156 40.430 -2.274 1
1 760 . 17 1 1 A 64 64 ASN N N 64 122.346 118.766 3.580 1
1 762 . 17 1 1 A 65 65 PHE H H 65 8.854 9.278 -0.424 1
1 763 . 17 1 1 A 65 65 PHE HA H 65 4.947 5.137 -0.190 1
1 771 . 17 1 1 A 65 65 PHE C C 65 177.274 176.366 0.908 1
1 772 . 17 1 1 A 65 65 PHE CA C 65 57.519 56.511 1.008 1
1 773 . 17 1 1 A 65 65 PHE CB C 65 38.485 38.750 -0.265 1
1 779 . 17 1 1 A 65 65 PHE N N 65 123.638 124.980 -1.342 1
1 780 . 17 1 1 A 66 66 SER H H 66 8.163 8.235 -0.072 1
1 781 . 17 1 1 A 66 66 SER HA H 66 4.393 4.547 -0.154 1
1 784 . 17 1 1 A 66 66 SER C C 66 175.699 176.808 -1.109 1
1 785 . 17 1 1 A 66 66 SER CA C 66 60.791 59.930 0.861 1
1 786 . 17 1 1 A 66 66 SER CB C 66 64.591 63.880 0.711 1
1 787 . 17 1 1 A 66 66 SER N N 66 113.913 116.562 -2.649 1
1 788 . 17 1 1 A 67 67 LEU H H 67 8.574 7.645 0.929 1
1 789 . 17 1 1 A 67 67 LEU HA H 67 4.302 3.985 0.317 1
1 799 . 17 1 1 A 67 67 LEU C C 67 176.269 177.099 -0.830 1
1 800 . 17 1 1 A 67 67 LEU CA C 67 55.601 57.962 -2.361 1
1 801 . 17 1 1 A 67 67 LEU CB C 67 42.021 42.017 0.004 1
1 805 . 17 1 1 A 67 67 LEU N N 67 121.264 120.205 1.059 1
1 806 . 17 1 1 A 68 68 VAL H H 68 6.921 7.551 -0.630 1
1 807 . 17 1 1 A 68 68 VAL HA H 68 4.473 4.160 0.313 1
1 815 . 17 1 1 A 68 68 VAL C C 68 173.809 174.940 -1.131 1
1 816 . 17 1 1 A 68 68 VAL CA C 68 58.047 60.908 -2.861 1
1 817 . 17 1 1 A 68 68 VAL CB C 68 32.295 31.773 0.522 1
1 820 . 17 1 1 A 68 68 VAL N N 68 111.287 115.794 -4.507 1
1 821 . 17 1 1 A 69 69 PRO HA H 69 4.658 4.631 0.027 1
1 828 . 17 1 1 A 69 69 PRO CA C 69 61.747 61.603 0.144 1
1 829 . 17 1 1 A 69 69 PRO CB C 69 30.693 32.445 -1.752 1
1 832 . 17 1 1 A 70 70 PRO HA H 70 4.414 4.350 0.064 1
1 839 . 17 1 1 A 70 70 PRO CA C 70 63.997 64.260 -0.263 1
1 840 . 17 1 1 A 70 70 PRO CB C 70 31.602 31.547 0.055 1
1 843 . 17 1 1 A 71 71 GLY H H 71 8.824 8.173 0.651 1
1 844 . 17 1 1 A 71 71 GLY HA2 H 71 3.703 4.032 -0.329 1
1 845 . 17 1 1 A 71 71 GLY HA3 H 71 4.193 4.033 0.160 1
1 846 . 17 1 1 A 71 71 GLY C C 71 174.052 172.950 1.102 1
1 847 . 17 1 1 A 71 71 GLY CA C 71 45.065 45.554 -0.489 1
1 848 . 17 1 1 A 71 71 GLY N N 71 111.845 106.120 5.725 1
1 849 . 17 1 1 A 72 72 THR H H 72 7.597 7.144 0.453 1
1 850 . 17 1 1 A 72 72 THR HA H 72 4.133 4.692 -0.559 1
1 855 . 17 1 1 A 72 72 THR CA C 72 63.129 60.937 2.192 1
1 856 . 17 1 1 A 72 72 THR CB C 72 69.560 71.679 -2.119 1
1 858 . 17 1 1 A 72 72 THR N N 72 117.485 114.441 3.044 1
1 859 . 17 1 1 A 73 73 ASN H H 73 9.280 8.525 0.755 1
1 860 . 17 1 1 A 73 73 ASN HA H 73 4.786 4.610 0.176 1
1 865 . 17 1 1 A 73 73 ASN CA C 73 52.009 52.239 -0.230 1
1 866 . 17 1 1 A 73 73 ASN CB C 73 37.553 38.359 -0.806 1
1 867 . 17 1 1 A 73 73 ASN N N 73 127.641 125.783 1.858 1
1 869 . 17 1 1 A 74 74 PRO HA H 74 4.752 4.809 -0.057 1
1 876 . 17 1 1 A 74 74 PRO C C 74 175.190 176.417 -1.227 1
1 877 . 17 1 1 A 74 74 PRO CA C 74 63.395 62.526 0.869 1
1 878 . 17 1 1 A 74 74 PRO CB C 74 33.164 33.144 0.020 1
1 881 . 17 1 1 A 75 75 HIS H H 75 8.025 8.729 -0.704 1
1 882 . 17 1 1 A 75 75 HIS HA H 75 5.047 5.065 -0.018 1
1 887 . 17 1 1 A 75 75 HIS C C 75 172.562 175.815 -3.253 1
1 888 . 17 1 1 A 75 75 HIS CA C 75 54.336 53.637 0.699 1
1 889 . 17 1 1 A 75 75 HIS CB C 75 30.956 33.538 -2.582 1
1 892 . 17 1 1 A 75 75 HIS N N 75 116.198 116.893 -0.695 1
1 893 . 17 1 1 A 76 76 CYS H H 76 8.343 9.413 -1.070 1
1 894 . 17 1 1 A 76 76 CYS HA H 76 4.594 4.424 0.170 1
1 897 . 17 1 1 A 76 76 CYS C C 76 175.651 174.842 0.809 1
1 898 . 17 1 1 A 76 76 CYS CA C 76 61.066 61.377 -0.311 1
1 899 . 17 1 1 A 76 76 CYS CB C 76 30.193 28.096 2.097 1
1 900 . 17 1 1 A 76 76 CYS N N 76 113.289 118.035 -4.746 1
1 901 . 17 1 1 A 77 77 PHE H H 77 8.433 7.593 0.840 1
1 902 . 17 1 1 A 77 77 PHE HA H 77 5.105 5.462 -0.357 1
1 910 . 17 1 1 A 77 77 PHE C C 77 171.822 173.205 -1.383 1
1 911 . 17 1 1 A 77 77 PHE CA C 77 56.874 55.617 1.257 1
1 912 . 17 1 1 A 77 77 PHE CB C 77 39.393 43.028 -3.635 1
1 918 . 17 1 1 A 77 77 PHE N N 77 114.874 114.801 0.073 1
1 919 . 17 1 1 A 78 78 GLU H H 78 9.823 9.201 0.622 1
1 920 . 17 1 1 A 78 78 GLU HA H 78 5.333 5.085 0.248 1
1 925 . 17 1 1 A 78 78 GLU C C 78 175.602 175.500 0.102 1
1 926 . 17 1 1 A 78 78 GLU CA C 78 54.212 54.935 -0.723 1
1 927 . 17 1 1 A 78 78 GLU CB C 78 31.702 32.686 -0.984 1
1 929 . 17 1 1 A 78 78 GLU N N 78 121.074 118.872 2.202 1
1 930 . 17 1 1 A 79 79 ILE H H 79 9.093 9.004 0.089 1
1 931 . 17 1 1 A 79 79 ILE HA H 79 4.637 4.610 0.027 1
1 941 . 17 1 1 A 79 79 ILE C C 79 174.476 175.148 -0.672 1
1 942 . 17 1 1 A 79 79 ILE CA C 79 60.932 60.788 0.144 1
1 943 . 17 1 1 A 79 79 ILE CB C 79 40.803 37.333 3.470 1
1 947 . 17 1 1 A 79 79 ILE N N 79 121.382 125.284 -3.902 1
1 948 . 17 1 1 A 80 80 VAL H H 80 8.841 7.844 0.997 1
1 949 . 17 1 1 A 80 80 VAL HA H 80 4.425 3.786 0.639 1
1 957 . 17 1 1 A 80 80 VAL C C 80 175.930 175.347 0.583 1
1 958 . 17 1 1 A 80 80 VAL CA C 80 63.324 63.220 0.104 1
1 959 . 17 1 1 A 80 80 VAL CB C 80 32.783 31.318 1.465 1
1 962 . 17 1 1 A 80 80 VAL N N 80 128.970 126.938 2.032 1
1 963 . 17 1 1 A 81 81 THR H H 81 8.303 7.727 0.576 1
1 964 . 17 1 1 A 81 81 THR HA H 81 5.264 4.635 0.629 1
1 969 . 17 1 1 A 81 81 THR C C 81 173.664 174.359 -0.695 1
1 970 . 17 1 1 A 81 81 THR CA C 81 59.540 59.886 -0.346 1
1 971 . 17 1 1 A 81 81 THR CB C 81 72.197 70.701 1.496 1
1 973 . 17 1 1 A 81 81 THR N N 81 118.077 118.484 -0.407 1
1 974 . 17 1 1 A 82 82 ALA H H 82 9.586 8.453 1.133 1
1 975 . 17 1 1 A 82 82 ALA HA H 82 4.093 4.305 -0.212 1
1 979 . 17 1 1 A 82 82 ALA C C 82 178.667 177.973 0.694 1
1 980 . 17 1 1 A 82 82 ALA CA C 82 55.321 53.040 2.281 1
1 981 . 17 1 1 A 82 82 ALA CB C 82 18.094 19.255 -1.161 1
1 982 . 17 1 1 A 82 82 ALA N N 82 122.493 123.151 -0.658 1
1 983 . 17 1 1 A 83 83 ASN H H 83 7.923 8.326 -0.403 1
1 984 . 17 1 1 A 83 83 ASN HA H 83 4.808 5.019 -0.211 1
1 989 . 17 1 1 A 83 83 ASN C C 83 174.766 174.733 0.033 1
1 990 . 17 1 1 A 83 83 ASN CA C 83 53.333 54.726 -1.393 1
1 991 . 17 1 1 A 83 83 ASN CB C 83 40.335 41.302 -0.967 1
1 992 . 17 1 1 A 83 83 ASN N N 83 110.765 115.243 -4.478 1
1 994 . 17 1 1 A 84 84 ALA H H 84 7.352 7.243 0.109 1
1 995 . 17 1 1 A 84 84 ALA HA H 84 4.625 4.483 0.142 1
1 999 . 17 1 1 A 84 84 ALA C C 84 176.547 175.250 1.297 1
1 1000 . 17 1 1 A 84 84 ALA CA C 84 52.858 51.806 1.052 1
1 1001 . 17 1 1 A 84 84 ALA CB C 84 21.233 22.062 -0.829 1
1 1002 . 17 1 1 A 84 84 ALA N N 84 119.599 117.493 2.106 1
1 1003 . 17 1 1 A 85 85 THR H H 85 8.374 8.651 -0.277 1
1 1004 . 17 1 1 A 85 85 THR HA H 85 5.014 4.402 0.612 1
1 1009 . 17 1 1 A 85 85 THR C C 85 171.568 173.889 -2.321 1
1 1010 . 17 1 1 A 85 85 THR CA C 85 61.618 62.599 -0.981 1
1 1011 . 17 1 1 A 85 85 THR CB C 85 70.850 69.044 1.806 1
1 1013 . 17 1 1 A 85 85 THR N N 85 119.032 113.873 5.159 1
1 1014 . 17 1 1 A 86 86 TYR H H 86 9.006 8.876 0.130 1
1 1015 . 17 1 1 A 86 86 TYR HA H 86 4.658 4.872 -0.214 1
1 1022 . 17 1 1 A 86 86 TYR C C 86 173.773 175.320 -1.547 1
1 1023 . 17 1 1 A 86 86 TYR CA C 86 56.938 57.991 -1.053 1
1 1024 . 17 1 1 A 86 86 TYR CB C 86 39.513 39.823 -0.310 1
1 1029 . 17 1 1 A 86 86 TYR N N 86 123.494 126.967 -3.473 1
1 1030 . 17 1 1 A 87 87 PHE H H 87 9.263 9.081 0.182 1
1 1031 . 17 1 1 A 87 87 PHE HA H 87 4.127 4.697 -0.570 1
1 1039 . 17 1 1 A 87 87 PHE C C 87 176.369 174.318 2.051 1
1 1040 . 17 1 1 A 87 87 PHE CA C 87 57.238 55.848 1.390 1
1 1041 . 17 1 1 A 87 87 PHE CB C 87 37.086 38.501 -1.415 1
1 1047 . 17 1 1 A 87 87 PHE N N 87 125.384 119.983 5.401 1
1 1048 . 17 1 1 A 88 88 VAL H H 88 9.023 8.291 0.732 1
1 1049 . 17 1 1 A 88 88 VAL HA H 88 4.162 4.598 -0.436 1
1 1057 . 17 1 1 A 88 88 VAL C C 88 176.390 175.944 0.446 1
1 1058 . 17 1 1 A 88 88 VAL CA C 88 63.975 60.914 3.061 1
1 1059 . 17 1 1 A 88 88 VAL CB C 88 32.378 31.824 0.554 1
1 1062 . 17 1 1 A 88 88 VAL N N 88 127.348 124.198 3.150 1
1 1063 . 17 1 1 A 89 89 GLY H H 89 9.233 8.039 1.194 1
1 1064 . 17 1 1 A 89 89 GLY HA2 H 89 4.293 4.188 0.105 1
1 1065 . 17 1 1 A 89 89 GLY HA3 H 89 4.186 4.262 -0.076 1
1 1066 . 17 1 1 A 89 89 GLY C C 89 172.378 171.385 0.993 1
1 1067 . 17 1 1 A 89 89 GLY CA C 89 43.798 46.165 -2.367 1
1 1068 . 17 1 1 A 89 89 GLY N N 89 116.041 112.549 3.492 1
1 1069 . 17 1 1 A 90 90 GLU H H 90 8.532 8.389 0.143 1
1 1070 . 17 1 1 A 90 90 GLU HA H 90 4.794 5.082 -0.288 1
1 1075 . 17 1 1 A 90 90 GLU C C 90 174.221 175.581 -1.360 1
1 1076 . 17 1 1 A 90 90 GLU CA C 90 56.393 54.944 1.449 1
1 1077 . 17 1 1 A 90 90 GLU CB C 90 33.182 33.170 0.012 1
1 1079 . 17 1 1 A 90 90 GLU N N 90 120.905 123.651 -2.746 1
1 1080 . 17 1 1 A 91 91 MET H H 91 8.450 8.650 -0.200 1
1 1081 . 17 1 1 A 91 91 MET HA H 91 4.904 5.145 -0.241 1
1 1089 . 17 1 1 A 91 91 MET C C 91 173.373 173.973 -0.600 1
1 1090 . 17 1 1 A 91 91 MET CA C 91 52.277 52.864 -0.587 1
1 1091 . 17 1 1 A 91 91 MET CB C 91 32.789 34.412 -1.623 1
1 1094 . 17 1 1 A 91 91 MET N N 91 125.173 122.022 3.151 1
1 1095 . 17 1 1 A 92 92 PRO HA H 92 4.358 4.639 -0.281 1
1 1102 . 17 1 1 A 92 92 PRO C C 92 177.589 175.814 1.775 1
1 1103 . 17 1 1 A 92 92 PRO CA C 92 63.143 63.435 -0.292 1
1 1104 . 17 1 1 A 92 92 PRO CB C 92 32.083 31.659 0.424 1
1 1107 . 17 1 1 A 93 93 GLY H H 93 8.330 7.998 0.332 1
1 1108 . 17 1 1 A 93 93 GLY HA2 H 93 3.943 4.106 -0.163 1
1 1109 . 17 1 1 A 93 93 GLY HA3 H 93 4.045 4.108 -0.063 1
1 1110 . 17 1 1 A 93 93 GLY C C 93 174.730 171.917 2.813 1
1 1111 . 17 1 1 A 93 93 GLY CA C 93 45.276 45.484 -0.208 1
1 1112 . 17 1 1 A 93 93 GLY N N 93 109.420 109.336 0.084 1
1 1113 . 17 1 1 A 94 94 GLY H H 94 8.331 8.388 -0.057 1
1 1114 . 17 1 1 A 94 94 GLY HA2 H 94 3.973 4.191 -0.218 1
1 1115 . 17 1 1 A 94 94 GLY HA3 H 94 3.973 4.192 -0.219 1
1 1116 . 17 1 1 A 94 94 GLY C C 94 174.100 172.814 1.286 1
1 1117 . 17 1 1 A 94 94 GLY CA C 94 45.333 45.671 -0.338 1
1 1118 . 17 1 1 A 94 94 GLY N N 94 108.483 108.394 0.089 1
1 1119 . 17 1 1 A 95 95 THR H H 95 8.095 8.562 -0.467 1
1 1120 . 17 1 1 A 95 95 THR HA H 95 4.643 4.891 -0.248 1
1 1125 . 17 1 1 A 95 95 THR C C 95 173.155 175.143 -1.988 1
1 1126 . 17 1 1 A 95 95 THR CA C 95 59.922 59.887 0.035 1
1 1127 . 17 1 1 A 95 95 THR CB C 95 69.871 69.209 0.662 1
1 1129 . 17 1 1 A 95 95 THR N N 95 115.860 115.785 0.075 1
1 1130 . 17 1 1 A 96 96 PRO HA H 96 4.400 4.445 -0.045 1
1 1137 . 17 1 1 A 96 96 PRO C C 96 177.565 177.449 0.116 1
1 1138 . 17 1 1 A 96 96 PRO CA C 96 64.047 63.726 0.321 1
1 1139 . 17 1 1 A 96 96 PRO CB C 96 31.816 32.022 -0.206 1
1 1142 . 17 1 1 A 97 97 GLY H H 97 8.572 8.029 0.543 1
1 1143 . 17 1 1 A 97 97 GLY HA2 H 97 4.007 4.000 0.007 1
1 1144 . 17 1 1 A 97 97 GLY HA3 H 97 4.007 4.000 0.007 1
1 1145 . 17 1 1 A 97 97 GLY C C 97 174.609 174.539 0.070 1
1 1146 . 17 1 1 A 97 97 GLY CA C 97 45.276 46.166 -0.890 1
1 1147 . 17 1 1 A 97 97 GLY N N 97 110.233 109.459 0.774 1
1 1148 . 17 1 1 A 98 98 GLY H H 98 8.119 8.074 0.045 1
1 1149 . 17 1 1 A 98 98 GLY HA2 H 98 4.086 4.120 -0.034 1
1 1150 . 17 1 1 A 98 98 GLY HA3 H 98 4.200 4.124 0.076 1
1 1151 . 17 1 1 A 98 98 GLY CA C 98 44.876 44.011 0.865 1
1 1152 . 17 1 1 A 98 98 GLY N N 98 108.845 108.484 0.361 1
1 1153 . 17 1 1 A 99 99 PRO HA H 99 4.494 4.400 0.094 1
1 1160 . 17 1 1 A 99 99 PRO C C 99 177.468 176.316 1.152 1
1 1161 . 17 1 1 A 99 99 PRO CA C 99 63.500 64.642 -1.142 1
1 1162 . 17 1 1 A 99 99 PRO CB C 99 32.013 32.189 -0.176 1
1 1165 . 17 1 1 A 100 100 SER H H 100 8.472 7.719 0.753 1
1 1166 . 17 1 1 A 100 100 SER HA H 100 4.513 4.837 -0.324 1
1 1169 . 17 1 1 A 100 100 SER C C 100 175.408 173.372 2.036 1
1 1170 . 17 1 1 A 100 100 SER CA C 100 58.557 56.730 1.827 1
1 1171 . 17 1 1 A 100 100 SER CB C 100 63.918 65.595 -1.677 1
1 1172 . 17 1 1 A 100 100 SER N N 100 116.038 111.886 4.152 1
1 1173 . 17 1 1 A 101 101 GLY H H 101 8.427 8.681 -0.254 1
1 1174 . 17 1 1 A 101 101 GLY HA2 H 101 4.064 4.226 -0.162 1
1 1175 . 17 1 1 A 101 101 GLY HA3 H 101 4.064 4.227 -0.163 1
1 1176 . 17 1 1 A 101 101 GLY C C 101 174.730 172.985 1.745 1
1 1177 . 17 1 1 A 101 101 GLY CA C 101 45.575 45.466 0.109 1
1 1178 . 17 1 1 A 101 101 GLY N N 101 110.558 113.338 -2.780 1
1 1179 . 17 1 1 A 102 102 GLN H H 102 8.416 8.403 0.013 1
1 1180 . 17 1 1 A 102 102 GLN HA H 102 4.383 4.246 0.137 1
1 1187 . 17 1 1 A 102 102 GLN C C 102 177.346 175.917 1.429 1
1 1188 . 17 1 1 A 102 102 GLN CA C 102 57.080 55.640 1.440 1
1 1189 . 17 1 1 A 102 102 GLN CB C 102 29.235 29.231 0.004 1
1 1191 . 17 1 1 A 102 102 GLN N N 102 120.112 119.359 0.753 1
1 1193 . 17 1 1 A 103 103 GLY H H 103 8.713 8.438 0.275 1
1 1194 . 17 1 1 A 103 103 GLY HA2 H 103 4.193 4.378 -0.185 1
1 1195 . 17 1 1 A 103 103 GLY HA3 H 103 4.078 4.390 -0.312 1
1 1196 . 17 1 1 A 103 103 GLY C C 103 175.602 173.196 2.406 1
1 1197 . 17 1 1 A 103 103 GLY CA C 103 46.120 45.650 0.470 1
1 1198 . 17 1 1 A 103 103 GLY N N 103 109.817 107.799 2.018 1
1 1199 . 17 1 1 A 104 104 ALA H H 104 8.366 8.255 0.111 1
1 1200 . 17 1 1 A 104 104 ALA HA H 104 4.449 4.521 -0.072 1
1 1204 . 17 1 1 A 104 104 ALA C C 104 179.188 178.501 0.687 1
1 1205 . 17 1 1 A 104 104 ALA CA C 104 54.230 53.047 1.183 1
1 1206 . 17 1 1 A 104 104 ALA CB C 104 19.080 20.146 -1.066 1
1 1207 . 17 1 1 A 104 104 ALA N N 104 124.808 120.811 3.997 1
1 1208 . 17 1 1 A 105 105 GLU H H 105 8.576 8.278 0.298 1
1 1209 . 17 1 1 A 105 105 GLU HA H 105 4.161 4.109 0.052 1
1 1214 . 17 1 1 A 105 105 GLU C C 105 179.200 178.881 0.319 1
1 1215 . 17 1 1 A 105 105 GLU CA C 105 59.173 59.173 0.000 1
1 1216 . 17 1 1 A 105 105 GLU CB C 105 29.194 29.574 -0.380 1
1 1218 . 17 1 1 A 105 105 GLU N N 105 119.238 117.578 1.660 1
1 1219 . 17 1 1 A 106 106 ALA H H 106 8.381 8.248 0.133 1
1 1220 . 17 1 1 A 106 106 ALA HA H 106 4.283 4.103 0.180 1
1 1224 . 17 1 1 A 106 106 ALA C C 106 180.048 180.001 0.047 1
1 1225 . 17 1 1 A 106 106 ALA CA C 106 54.687 55.555 -0.868 1
1 1226 . 17 1 1 A 106 106 ALA CB C 106 18.341 18.755 -0.414 1
1 1227 . 17 1 1 A 106 106 ALA N N 106 123.327 121.478 1.849 1
1 1228 . 17 1 1 A 107 107 ALA H H 107 8.123 8.250 -0.127 1
1 1229 . 17 1 1 A 107 107 ALA HA H 107 4.554 4.392 0.162 1
1 1233 . 17 1 1 A 107 107 ALA C C 107 179.757 179.720 0.037 1
1 1234 . 17 1 1 A 107 107 ALA CA C 107 55.355 55.480 -0.125 1
1 1235 . 17 1 1 A 107 107 ALA CB C 107 18.939 18.269 0.670 1
1 1236 . 17 1 1 A 107 107 ALA N N 107 120.740 120.298 0.442 1
1 1237 . 17 1 1 A 108 108 ARG H H 108 8.403 7.747 0.656 1
1 1238 . 17 1 1 A 108 108 ARG HA H 108 4.254 4.047 0.207 1
1 1245 . 17 1 1 A 108 108 ARG C C 108 179.111 179.182 -0.071 1
1 1246 . 17 1 1 A 108 108 ARG CA C 108 59.015 59.235 -0.220 1
1 1247 . 17 1 1 A 108 108 ARG CB C 108 29.752 29.962 -0.210 1
1 1250 . 17 1 1 A 108 108 ARG N N 108 119.531 117.845 1.686 1
1 1251 . 17 1 1 A 109 109 GLY H H 109 8.182 8.892 -0.710 1
1 1252 . 17 1 1 A 109 109 GLY HA2 H 109 3.822 3.642 0.180 1
1 1253 . 17 1 1 A 109 109 GLY HA3 H 109 3.822 3.687 0.135 1
1 1254 . 17 1 1 A 109 109 GLY C C 109 177.020 176.157 0.863 1
1 1255 . 17 1 1 A 109 109 GLY CA C 109 46.718 47.336 -0.618 1
1 1256 . 17 1 1 A 109 109 GLY N N 109 107.331 107.768 -0.437 1
1 1257 . 17 1 1 A 110 110 TRP H H 110 7.925 7.452 0.473 1
1 1258 . 17 1 1 A 110 110 TRP HA H 110 3.963 4.610 -0.647 1
1 1267 . 17 1 1 A 110 110 TRP C C 110 176.691 178.264 -1.573 1
1 1268 . 17 1 1 A 110 110 TRP CA C 110 62.041 60.295 1.746 1
1 1269 . 17 1 1 A 110 110 TRP CB C 110 28.989 28.894 0.095 1
1 1275 . 17 1 1 A 110 110 TRP N N 110 122.304 122.132 0.172 1
1 1277 . 17 1 1 A 111 111 GLU H H 111 7.946 7.900 0.046 1
1 1278 . 17 1 1 A 111 111 GLU HA H 111 2.594 2.841 -0.247 1
1 1283 . 17 1 1 A 111 111 GLU C C 111 177.976 179.185 -1.209 1
1 1284 . 17 1 1 A 111 111 GLU CA C 111 60.193 58.970 1.223 1
1 1285 . 17 1 1 A 111 111 GLU CB C 111 29.277 29.428 -0.151 1
1 1287 . 17 1 1 A 111 111 GLU N N 111 121.755 119.283 2.472 1
1 1288 . 17 1 1 A 112 112 THR H H 112 7.993 7.778 0.215 1
1 1289 . 17 1 1 A 112 112 THR HA H 112 3.722 3.833 -0.111 1
1 1294 . 17 1 1 A 112 112 THR C C 112 176.038 175.931 0.107 1
1 1295 . 17 1 1 A 112 112 THR CA C 112 66.104 66.528 -0.424 1
1 1296 . 17 1 1 A 112 112 THR CB C 112 68.885 68.438 0.447 1
1 1298 . 17 1 1 A 112 112 THR N N 112 112.247 115.343 -3.096 1
1 1299 . 17 1 1 A 113 113 ALA H H 113 7.742 8.406 -0.664 1
1 1300 . 17 1 1 A 113 113 ALA HA H 113 4.029 3.992 0.037 1
1 1304 . 17 1 1 A 113 113 ALA C C 113 180.545 180.051 0.494 1
1 1305 . 17 1 1 A 113 113 ALA CA C 113 55.127 55.314 -0.187 1
1 1306 . 17 1 1 A 113 113 ALA CB C 113 18.854 18.482 0.372 1
1 1307 . 17 1 1 A 113 113 ALA N N 113 123.134 122.627 0.507 1
1 1308 . 17 1 1 A 114 114 ILE H H 114 8.472 8.571 -0.099 1
1 1309 . 17 1 1 A 114 114 ILE HA H 114 3.613 3.737 -0.124 1
1 1319 . 17 1 1 A 114 114 ILE C C 114 176.947 178.259 -1.312 1
1 1320 . 17 1 1 A 114 114 ILE CA C 114 66.016 65.321 0.695 1
1 1321 . 17 1 1 A 114 114 ILE CB C 114 38.335 37.891 0.444 1
1 1325 . 17 1 1 A 114 114 ILE N N 114 118.276 118.032 0.244 1
1 1326 . 17 1 1 A 115 115 ARG H H 115 8.181 7.893 0.288 1
1 1327 . 17 1 1 A 115 115 ARG HA H 115 3.835 3.941 -0.106 1
1 1334 . 17 1 1 A 115 115 ARG C C 115 179.588 178.925 0.663 1
1 1335 . 17 1 1 A 115 115 ARG CA C 115 61.072 59.981 1.091 1
1 1336 . 17 1 1 A 115 115 ARG CB C 115 29.975 29.729 0.246 1
1 1339 . 17 1 1 A 115 115 ARG N N 115 117.921 119.960 -2.039 1
1 1340 . 17 1 1 A 116 116 GLN H H 116 8.395 8.362 0.033 1
1 1341 . 17 1 1 A 116 116 GLN HA H 116 4.030 4.018 0.012 1
1 1348 . 17 1 1 A 116 116 GLN C C 116 178.716 178.652 0.064 1
1 1349 . 17 1 1 A 116 116 GLN CA C 116 58.790 58.676 0.114 1
1 1350 . 17 1 1 A 116 116 GLN CB C 116 28.248 28.409 -0.161 1
1 1352 . 17 1 1 A 116 116 GLN N N 116 116.842 118.710 -1.868 1
1 1354 . 17 1 1 A 117 117 ALA H H 117 7.902 7.910 -0.008 1
1 1355 . 17 1 1 A 117 117 ALA HA H 117 4.143 4.101 0.042 1
1 1359 . 17 1 1 A 117 117 ALA C C 117 179.685 180.301 -0.616 1
1 1360 . 17 1 1 A 117 117 ALA CA C 117 54.476 54.144 0.332 1
1 1361 . 17 1 1 A 117 117 ALA CB C 117 18.300 18.251 0.049 1
1 1362 . 17 1 1 A 117 117 ALA N N 117 122.828 122.315 0.513 1
1 1363 . 17 1 1 A 118 118 LEU H H 118 7.904 7.942 -0.038 1
1 1364 . 17 1 1 A 118 118 LEU HA H 118 4.119 4.134 -0.015 1
1 1374 . 17 1 1 A 118 118 LEU C C 118 178.437 178.676 -0.239 1
1 1375 . 17 1 1 A 118 118 LEU CA C 118 56.781 56.946 -0.165 1
1 1376 . 17 1 1 A 118 118 LEU CB C 118 42.371 42.014 0.357 1
1 1380 . 17 1 1 A 118 118 LEU N N 118 117.632 120.539 -2.907 1
1 1381 . 17 1 1 A 119 119 MET H H 119 7.673 7.759 -0.086 1
1 1382 . 17 1 1 A 119 119 MET HA H 119 4.442 4.369 0.073 1
1 1390 . 17 1 1 A 119 119 MET C C 119 176.680 178.113 -1.433 1
1 1391 . 17 1 1 A 119 119 MET CA C 119 56.432 57.372 -0.940 1
1 1392 . 17 1 1 A 119 119 MET CB C 119 32.769 31.395 1.374 1
1 1395 . 17 1 1 A 119 119 MET N N 119 117.286 117.947 -0.661 1
1 1396 . 17 1 1 A 120 120 SER H H 120 7.878 7.929 -0.051 1
1 1397 . 17 1 1 A 120 120 SER HA H 120 4.500 4.300 0.200 1
1 1400 . 17 1 1 A 120 120 SER C C 120 174.742 176.918 -2.176 1
1 1401 . 17 1 1 A 120 120 SER CA C 120 58.962 61.036 -2.074 1
1 1402 . 17 1 1 A 120 120 SER CB C 120 63.853 62.664 1.189 1
1 1403 . 17 1 1 A 120 120 SER N N 120 115.064 115.850 -0.786 1
1 1404 . 17 1 1 A 121 121 GLY H H 121 8.059 8.298 -0.239 1
1 1405 . 17 1 1 A 121 121 GLY HA2 H 121 4.231 3.743 0.488 1
1 1406 . 17 1 1 A 121 121 GLY HA3 H 121 4.112 3.743 0.369 1
1 1407 . 17 1 1 A 121 121 GLY C C 121 172.065 174.506 -2.441 1
1 1408 . 17 1 1 A 121 121 GLY CA C 121 45.030 47.996 -2.966 1
1 1409 . 17 1 1 A 121 121 GLY N N 121 110.271 109.004 1.267 1
1 1410 . 17 1 1 A 122 122 PRO HA H 122 4.496 4.656 -0.160 1
1 1417 . 17 1 1 A 122 122 PRO CA C 122 63.399 62.493 0.906 1
1 1418 . 17 1 1 A 122 122 PRO CB C 122 32.186 29.789 2.397 1
1 1 . 18 1 1 A 6 6 SER H H 6 8.337 8.244 0.093 1
1 2 . 18 1 1 A 6 6 SER HA H 6 4.597 4.160 0.437 1
1 5 . 18 1 1 A 6 6 SER C C 6 174.637 173.712 0.925 1
1 6 . 18 1 1 A 6 6 SER CA C 6 58.469 59.068 -0.599 1
1 7 . 18 1 1 A 6 6 SER CB C 6 64.221 61.052 3.169 1
1 8 . 18 1 1 A 6 6 SER N N 6 117.887 115.943 1.944 1
1 9 . 18 1 1 A 7 7 GLY H H 7 8.280 7.779 0.501 1
1 10 . 18 1 1 A 7 7 GLY HA2 H 7 4.063 4.149 -0.086 1
1 11 . 18 1 1 A 7 7 GLY HA3 H 7 4.063 4.149 -0.086 1
1 12 . 18 1 1 A 7 7 GLY C C 7 173.724 172.297 1.427 1
1 13 . 18 1 1 A 7 7 GLY CA C 7 44.941 46.169 -1.228 1
1 14 . 18 1 1 A 7 7 GLY N N 7 110.151 108.870 1.281 1
1 15 . 18 1 1 A 8 8 THR H H 8 8.212 8.300 -0.088 1
1 16 . 18 1 1 A 8 8 THR HA H 8 4.173 4.902 -0.729 1
1 21 . 18 1 1 A 8 8 THR C C 8 174.723 174.055 0.668 1
1 22 . 18 1 1 A 8 8 THR CA C 8 63.622 63.277 0.345 1
1 23 . 18 1 1 A 8 8 THR CB C 8 69.460 69.376 0.084 1
1 25 . 18 1 1 A 8 8 THR N N 8 116.817 117.861 -1.044 1
1 26 . 18 1 1 A 9 9 LEU H H 9 9.374 9.349 0.025 1
1 27 . 18 1 1 A 9 9 LEU HA H 9 4.302 4.350 -0.048 1
1 37 . 18 1 1 A 9 9 LEU C C 9 177.468 176.734 0.734 1
1 38 . 18 1 1 A 9 9 LEU CA C 9 55.936 55.970 -0.034 1
1 39 . 18 1 1 A 9 9 LEU CB C 9 42.843 42.784 0.059 1
1 43 . 18 1 1 A 9 9 LEU N N 9 127.798 128.054 -0.256 1
1 44 . 18 1 1 A 10 10 ARG H H 10 7.512 7.517 -0.005 1
1 45 . 18 1 1 A 10 10 ARG HA H 10 4.199 4.733 -0.534 1
1 52 . 18 1 1 A 10 10 ARG C C 10 172.501 174.190 -1.689 1
1 53 . 18 1 1 A 10 10 ARG CA C 10 56.165 54.525 1.640 1
1 54 . 18 1 1 A 10 10 ARG CB C 10 32.442 33.454 -1.012 1
1 57 . 18 1 1 A 10 10 ARG N N 10 117.979 117.393 0.586 1
1 58 . 18 1 1 A 11 11 GLU H H 11 8.434 8.726 -0.292 1
1 59 . 18 1 1 A 11 11 GLU HA H 11 5.993 5.430 0.563 1
1 64 . 18 1 1 A 11 11 GLU C C 11 174.800 174.542 0.258 1
1 65 . 18 1 1 A 11 11 GLU CA C 11 54.570 55.108 -0.538 1
1 66 . 18 1 1 A 11 11 GLU CB C 11 34.245 33.350 0.895 1
1 68 . 18 1 1 A 11 11 GLU N N 11 120.782 121.904 -1.122 1
1 69 . 18 1 1 A 12 12 GLY H H 12 8.131 7.424 0.707 1
1 70 . 18 1 1 A 12 12 GLY HA2 H 12 4.714 3.513 1.201 1
1 71 . 18 1 1 A 12 12 GLY HA3 H 12 3.763 4.093 -0.330 1
1 72 . 18 1 1 A 12 12 GLY C C 12 171.060 172.275 -1.215 1
1 73 . 18 1 1 A 12 12 GLY CA C 12 45.241 44.575 0.666 1
1 74 . 18 1 1 A 12 12 GLY N N 12 107.457 106.513 0.944 1
1 75 . 18 1 1 A 13 13 TRP H H 13 8.783 8.476 0.307 1
1 76 . 18 1 1 A 13 13 TRP HA H 13 5.152 4.832 0.320 1
1 85 . 18 1 1 A 13 13 TRP C C 13 177.528 176.504 1.024 1
1 86 . 18 1 1 A 13 13 TRP CA C 13 57.783 58.619 -0.836 1
1 87 . 18 1 1 A 13 13 TRP CB C 13 30.222 30.408 -0.186 1
1 93 . 18 1 1 A 13 13 TRP N N 13 120.792 121.306 -0.514 1
1 95 . 18 1 1 A 14 14 VAL H H 14 9.179 8.653 0.526 1
1 96 . 18 1 1 A 14 14 VAL HA H 14 4.072 4.554 -0.482 1
1 104 . 18 1 1 A 14 14 VAL C C 14 174.981 173.492 1.489 1
1 105 . 18 1 1 A 14 14 VAL CA C 14 61.741 60.081 1.660 1
1 106 . 18 1 1 A 14 14 VAL CB C 14 35.143 35.270 -0.127 1
1 109 . 18 1 1 A 14 14 VAL N N 14 125.476 122.596 2.880 1
1 110 . 18 1 1 A 15 15 VAL H H 15 8.403 8.809 -0.406 1
1 111 . 18 1 1 A 15 15 VAL HA H 15 5.532 5.436 0.096 1
1 119 . 18 1 1 A 15 15 VAL C C 15 175.078 174.240 0.838 1
1 120 . 18 1 1 A 15 15 VAL CA C 15 59.489 59.466 0.023 1
1 121 . 18 1 1 A 15 15 VAL CB C 15 34.210 34.962 -0.752 1
1 124 . 18 1 1 A 15 15 VAL N N 15 126.189 126.051 0.138 1
1 125 . 18 1 1 A 16 16 HIS H H 16 9.122 8.742 0.380 1
1 126 . 18 1 1 A 16 16 HIS HA H 16 5.823 5.658 0.165 1
1 131 . 18 1 1 A 16 16 HIS C C 16 172.998 172.472 0.526 1
1 132 . 18 1 1 A 16 16 HIS CA C 16 56.253 53.897 2.356 1
1 133 . 18 1 1 A 16 16 HIS CB C 16 34.273 32.733 1.540 1
1 136 . 18 1 1 A 16 16 HIS N N 16 121.152 120.769 0.383 1
1 137 . 18 1 1 A 17 17 TYR H H 17 8.465 8.637 -0.172 1
1 138 . 18 1 1 A 17 17 TYR HA H 17 5.096 4.860 0.236 1
1 145 . 18 1 1 A 17 17 TYR C C 17 173.640 172.798 0.842 1
1 146 . 18 1 1 A 17 17 TYR CA C 17 56.903 56.096 0.807 1
1 147 . 18 1 1 A 17 17 TYR CB C 17 40.103 40.302 -0.199 1
1 152 . 18 1 1 A 17 17 TYR N N 17 115.558 116.537 -0.979 1
1 153 . 18 1 1 A 18 18 SER H H 18 9.122 8.782 0.340 1
1 154 . 18 1 1 A 18 18 SER HA H 18 6.144 5.329 0.815 1
1 157 . 18 1 1 A 18 18 SER C C 18 173.204 174.933 -1.729 1
1 158 . 18 1 1 A 18 18 SER CA C 18 56.640 56.297 0.343 1
1 159 . 18 1 1 A 18 18 SER CB C 18 68.788 65.457 3.331 1
1 160 . 18 1 1 A 18 18 SER N N 18 118.846 115.525 3.321 1
1 161 . 18 1 1 A 19 19 ASN H H 19 9.053 8.688 0.365 1
1 162 . 18 1 1 A 19 19 ASN HA H 19 4.473 4.952 -0.479 1
1 167 . 18 1 1 A 19 19 ASN C C 19 175.396 175.687 -0.291 1
1 168 . 18 1 1 A 19 19 ASN CA C 19 55.373 52.284 3.089 1
1 169 . 18 1 1 A 19 19 ASN CB C 19 36.900 38.098 -1.198 1
1 170 . 18 1 1 A 19 19 ASN N N 19 113.712 117.932 -4.220 1
1 172 . 18 1 1 A 20 20 LYS H H 20 7.677 7.877 -0.200 1
1 173 . 18 1 1 A 20 20 LYS HA H 20 4.413 4.690 -0.277 1
1 182 . 18 1 1 A 20 20 LYS C C 20 176.078 177.318 -1.240 1
1 183 . 18 1 1 A 20 20 LYS CA C 20 55.679 57.536 -1.857 1
1 184 . 18 1 1 A 20 20 LYS CB C 20 33.023 35.649 -2.626 1
1 188 . 18 1 1 A 20 20 LYS N N 20 117.213 119.526 -2.313 1
1 189 . 18 1 1 A 21 21 ASP H H 21 7.395 7.837 -0.442 1
1 190 . 18 1 1 A 21 21 ASP HA H 21 4.808 4.788 0.020 1
1 193 . 18 1 1 A 21 21 ASP C C 21 176.413 175.879 0.534 1
1 194 . 18 1 1 A 21 21 ASP CA C 21 53.983 53.660 0.323 1
1 195 . 18 1 1 A 21 21 ASP CB C 21 41.199 42.088 -0.889 1
1 196 . 18 1 1 A 21 21 ASP N N 21 119.879 116.424 3.455 1
1 197 . 18 1 1 A 22 22 THR H H 22 8.593 8.100 0.493 1
1 198 . 18 1 1 A 22 22 THR HA H 22 4.352 4.138 0.214 1
1 203 . 18 1 1 A 22 22 THR C C 22 172.913 173.973 -1.060 1
1 204 . 18 1 1 A 22 22 THR CA C 22 62.691 62.929 -0.238 1
1 205 . 18 1 1 A 22 22 THR CB C 22 68.332 66.514 1.818 1
1 207 . 18 1 1 A 22 22 THR N N 22 116.299 112.628 3.671 1
1 208 . 18 1 1 A 23 23 LEU H H 23 7.645 7.949 -0.304 1
1 209 . 18 1 1 A 23 23 LEU HA H 23 4.318 4.435 -0.117 1
1 219 . 18 1 1 A 23 23 LEU C C 23 176.692 175.784 0.908 1
1 220 . 18 1 1 A 23 23 LEU CA C 23 54.617 53.934 0.683 1
1 221 . 18 1 1 A 23 23 LEU CB C 23 41.939 40.020 1.919 1
1 225 . 18 1 1 A 23 23 LEU N N 23 123.606 121.827 1.779 1
1 226 . 18 1 1 A 24 24 ARG H H 24 8.563 7.426 1.137 1
1 227 . 18 1 1 A 24 24 ARG HA H 24 4.373 4.517 -0.144 1
1 235 . 18 1 1 A 24 24 ARG C C 24 176.584 175.906 0.678 1
1 236 . 18 1 1 A 24 24 ARG CA C 24 57.854 57.002 0.852 1
1 237 . 18 1 1 A 24 24 ARG CB C 24 31.126 30.315 0.811 1
1 240 . 18 1 1 A 24 24 ARG N N 24 127.152 121.789 5.363 1
1 242 . 18 1 1 A 25 25 LYS H H 25 8.633 8.928 -0.295 1
1 243 . 18 1 1 A 25 25 LYS HA H 25 4.513 4.692 -0.179 1
1 251 . 18 1 1 A 25 25 LYS C C 25 173.567 174.444 -0.877 1
1 252 . 18 1 1 A 25 25 LYS CA C 25 54.792 54.687 0.105 1
1 253 . 18 1 1 A 25 25 LYS CB C 25 37.416 34.604 2.812 1
1 257 . 18 1 1 A 25 25 LYS N N 25 122.682 125.183 -2.501 1
1 258 . 18 1 1 A 26 26 ARG H H 26 8.303 8.583 -0.280 1
1 259 . 18 1 1 A 26 26 ARG HA H 26 5.153 5.112 0.041 1
1 266 . 18 1 1 A 26 26 ARG C C 26 174.554 174.720 -0.166 1
1 267 . 18 1 1 A 26 26 ARG CA C 26 55.083 54.451 0.632 1
1 268 . 18 1 1 A 26 26 ARG CB C 26 32.789 32.842 -0.053 1
1 271 . 18 1 1 A 26 26 ARG N N 26 121.819 123.965 -2.146 1
1 272 . 18 1 1 A 27 27 HIS H H 27 8.793 8.810 -0.017 1
1 273 . 18 1 1 A 27 27 HIS HA H 27 5.155 5.378 -0.223 1
1 278 . 18 1 1 A 27 27 HIS CA C 27 56.904 55.031 1.873 1
1 279 . 18 1 1 A 27 27 HIS CB C 27 34.683 31.540 3.143 1
1 282 . 18 1 1 A 27 27 HIS N N 27 122.102 120.687 1.415 1
1 283 . 18 1 1 A 28 28 TYR H H 28 9.273 8.321 0.952 1
1 284 . 18 1 1 A 28 28 TYR HA H 28 4.332 4.353 -0.021 1
1 291 . 18 1 1 A 28 28 TYR C C 28 174.730 175.155 -0.425 1
1 292 . 18 1 1 A 28 28 TYR CA C 28 58.680 56.707 1.973 1
1 293 . 18 1 1 A 28 28 TYR CB C 28 38.673 37.745 0.928 1
1 298 . 18 1 1 A 28 28 TYR N N 28 125.605 121.496 4.109 1
1 299 . 18 1 1 A 29 29 TRP H H 29 9.273 8.646 0.627 1
1 300 . 18 1 1 A 29 29 TRP HA H 29 5.543 4.854 0.689 1
1 309 . 18 1 1 A 29 29 TRP C C 29 176.172 176.809 -0.637 1
1 310 . 18 1 1 A 29 29 TRP CA C 29 56.658 57.404 -0.746 1
1 311 . 18 1 1 A 29 29 TRP CB C 29 32.154 30.360 1.794 1
1 317 . 18 1 1 A 29 29 TRP N N 29 131.340 128.100 3.240 1
1 318 . 18 1 1 A 30 30 ARG H H 30 9.164 9.114 0.050 1
1 319 . 18 1 1 A 30 30 ARG HA H 30 5.302 5.424 -0.122 1
1 327 . 18 1 1 A 30 30 ARG C C 30 174.774 174.424 0.350 1
1 328 . 18 1 1 A 30 30 ARG CA C 30 56.271 54.763 1.508 1
1 329 . 18 1 1 A 30 30 ARG CB C 30 34.203 33.894 0.309 1
1 332 . 18 1 1 A 30 30 ARG N N 30 116.040 121.211 -5.171 1
1 334 . 18 1 1 A 31 31 LEU H H 31 9.273 9.364 -0.091 1
1 335 . 18 1 1 A 31 31 LEU HA H 31 5.324 5.398 -0.074 1
1 345 . 18 1 1 A 31 31 LEU C C 31 174.488 174.617 -0.129 1
1 346 . 18 1 1 A 31 31 LEU CA C 31 53.807 53.525 0.282 1
1 347 . 18 1 1 A 31 31 LEU CB C 31 46.667 45.965 0.702 1
1 351 . 18 1 1 A 31 31 LEU N N 31 127.075 127.086 -0.011 1
1 352 . 18 1 1 A 32 32 ASP H H 32 8.854 8.832 0.022 1
1 353 . 18 1 1 A 32 32 ASP HA H 32 4.902 5.127 -0.225 1
1 356 . 18 1 1 A 32 32 ASP C C 32 173.474 176.628 -3.154 1
1 357 . 18 1 1 A 32 32 ASP CA C 32 53.104 52.317 0.787 1
1 358 . 18 1 1 A 32 32 ASP CB C 32 42.931 44.569 -1.638 1
1 359 . 18 1 1 A 32 32 ASP N N 32 129.349 125.374 3.975 1
1 360 . 18 1 1 A 33 33 CYS H H 33 8.153 8.790 -0.637 1
1 361 . 18 1 1 A 33 33 CYS HA H 33 4.323 4.563 -0.240 1
1 364 . 18 1 1 A 33 33 CYS C C 33 174.476 175.651 -1.175 1
1 365 . 18 1 1 A 33 33 CYS CA C 33 59.853 59.481 0.372 1
1 366 . 18 1 1 A 33 33 CYS CB C 33 27.508 27.864 -0.356 1
1 367 . 18 1 1 A 33 33 CYS N N 33 108.439 119.650 -11.211 1
1 368 . 18 1 1 A 34 34 LYS H H 34 9.144 7.762 1.382 1
1 369 . 18 1 1 A 34 34 LYS HA H 34 4.616 4.457 0.159 1
1 378 . 18 1 1 A 34 34 LYS C C 34 177.601 176.094 1.507 1
1 379 . 18 1 1 A 34 34 LYS CA C 34 57.185 56.859 0.326 1
1 380 . 18 1 1 A 34 34 LYS CB C 34 35.623 35.245 0.378 1
1 384 . 18 1 1 A 34 34 LYS N N 34 119.884 119.777 0.107 1
1 385 . 18 1 1 A 35 35 CYS H H 35 9.102 7.663 1.439 1
1 386 . 18 1 1 A 35 35 CYS HA H 35 4.935 4.793 0.142 1
1 389 . 18 1 1 A 35 35 CYS C C 35 172.283 172.482 -0.199 1
1 390 . 18 1 1 A 35 35 CYS CA C 35 57.748 58.100 -0.352 1
1 391 . 18 1 1 A 35 35 CYS CB C 35 31.537 32.307 -0.770 1
1 392 . 18 1 1 A 35 35 CYS N N 35 120.317 114.503 5.814 1
1 393 . 18 1 1 A 36 36 ILE H H 36 8.213 8.969 -0.756 1
1 394 . 18 1 1 A 36 36 ILE HA H 36 4.617 4.837 -0.220 1
1 404 . 18 1 1 A 36 36 ILE C C 36 175.312 175.207 0.105 1
1 405 . 18 1 1 A 36 36 ILE CA C 36 60.967 60.314 0.653 1
1 406 . 18 1 1 A 36 36 ILE CB C 36 39.718 38.576 1.142 1
1 410 . 18 1 1 A 36 36 ILE N N 36 121.905 121.783 0.122 1
1 411 . 18 1 1 A 37 37 THR H H 37 9.076 8.697 0.379 1
1 412 . 18 1 1 A 37 37 THR HA H 37 4.364 4.569 -0.205 1
1 417 . 18 1 1 A 37 37 THR CA C 37 61.834 62.095 -0.261 1
1 418 . 18 1 1 A 37 37 THR CB C 37 69.237 70.189 -0.952 1
1 420 . 18 1 1 A 37 37 THR N N 37 122.500 123.658 -1.158 1
1 421 . 18 1 1 A 38 38 LEU H H 38 8.263 8.521 -0.258 1
1 422 . 18 1 1 A 38 38 LEU HA H 38 4.445 5.061 -0.616 1
1 432 . 18 1 1 A 38 38 LEU CA C 38 55.611 53.090 2.521 1
1 433 . 18 1 1 A 38 38 LEU CB C 38 42.702 45.642 -2.940 1
1 437 . 18 1 1 A 38 38 LEU N N 38 126.987 123.641 3.346 1
1 438 . 18 1 1 A 39 39 PHE H H 39 9.520 8.559 0.961 1
1 439 . 18 1 1 A 39 39 PHE HA H 39 4.998 5.017 -0.019 1
1 447 . 18 1 1 A 39 39 PHE CA C 39 57.331 56.303 1.028 1
1 448 . 18 1 1 A 39 39 PHE CB C 39 42.453 41.049 1.404 1
1 454 . 18 1 1 A 39 39 PHE N N 39 120.545 120.431 0.114 1
1 455 . 18 1 1 A 40 40 GLN H H 40 9.878 8.957 0.921 1
1 456 . 18 1 1 A 40 40 GLN HA H 40 4.376 4.089 0.287 1
1 463 . 18 1 1 A 40 40 GLN CA C 40 59.513 59.526 -0.013 1
1 464 . 18 1 1 A 40 40 GLN CB C 40 29.317 29.010 0.307 1
1 467 . 18 1 1 A 41 41 ASN H H 41 7.732 8.040 -0.308 1
1 468 . 18 1 1 A 41 41 ASN HA H 41 4.812 5.436 -0.624 1
1 473 . 18 1 1 A 41 41 ASN CA C 41 52.618 51.284 1.334 1
1 474 . 18 1 1 A 41 41 ASN CB C 41 39.362 41.704 -2.342 1
1 475 . 18 1 1 A 41 41 ASN N N 41 107.613 112.548 -4.935 1
1 477 . 18 1 1 A 42 42 ASN HA H 42 3.476 4.230 -0.754 1
1 482 . 18 1 1 A 42 42 ASN C C 42 173.607 175.522 -1.915 1
1 483 . 18 1 1 A 42 42 ASN CA C 42 54.888 55.356 -0.468 1
1 484 . 18 1 1 A 42 42 ASN CB C 42 35.613 37.622 -2.009 1
1 486 . 18 1 1 A 43 43 THR H H 43 8.394 7.524 0.870 1
1 487 . 18 1 1 A 43 43 THR HA H 43 4.403 4.671 -0.268 1
1 492 . 18 1 1 A 43 43 THR C C 43 174.464 173.730 0.734 1
1 493 . 18 1 1 A 43 43 THR CA C 43 61.978 60.483 1.495 1
1 494 . 18 1 1 A 43 43 THR CB C 43 70.036 68.788 1.248 1
1 496 . 18 1 1 A 43 43 THR N N 43 111.795 106.274 5.521 1
1 497 . 18 1 1 A 44 44 THR H H 44 8.058 7.826 0.232 1
1 498 . 18 1 1 A 44 44 THR HA H 44 4.464 4.783 -0.319 1
1 503 . 18 1 1 A 44 44 THR CA C 44 61.599 60.749 0.850 1
1 504 . 18 1 1 A 44 44 THR CB C 44 69.137 69.975 -0.838 1
1 506 . 18 1 1 A 44 44 THR N N 44 116.514 116.103 0.411 1
1 507 . 18 1 1 A 45 45 ASN H H 45 6.653 8.945 -2.292 1
1 508 . 18 1 1 A 45 45 ASN HA H 45 4.945 4.372 0.573 1
1 513 . 18 1 1 A 45 45 ASN CA C 45 53.227 57.079 -3.852 1
1 514 . 18 1 1 A 45 45 ASN CB C 45 38.483 38.585 -0.102 1
1 516 . 18 1 1 A 46 46 ARG H H 46 8.213 7.831 0.382 1
1 517 . 18 1 1 A 46 46 ARG HA H 46 4.583 4.966 -0.383 1
1 524 . 18 1 1 A 46 46 ARG CA C 46 55.487 55.130 0.357 1
1 525 . 18 1 1 A 46 46 ARG CB C 46 31.153 32.441 -1.288 1
1 528 . 18 1 1 A 46 46 ARG N N 46 121.652 115.031 6.621 1
1 529 . 18 1 1 A 47 47 TYR H H 47 7.973 8.785 -0.812 1
1 536 . 18 1 1 A 47 47 TYR CB C 47 39.356 39.525 -0.169 1
1 541 . 18 1 1 A 48 48 TYR H H 48 9.023 8.536 0.487 1
1 542 . 18 1 1 A 48 48 TYR HA H 48 4.662 4.307 0.355 1
1 549 . 18 1 1 A 48 48 TYR CB C 48 39.863 40.758 -0.895 1
1 554 . 18 1 1 A 48 48 TYR N N 48 121.223 119.945 1.278 1
1 555 . 18 1 1 A 49 49 LYS H H 49 7.134 7.484 -0.350 1
1 556 . 18 1 1 A 49 49 LYS HA H 49 4.283 4.552 -0.269 1
1 565 . 18 1 1 A 49 49 LYS CA C 49 55.167 55.409 -0.242 1
1 566 . 18 1 1 A 49 49 LYS CB C 49 36.699 36.319 0.380 1
1 570 . 18 1 1 A 49 49 LYS N N 49 117.339 118.016 -0.677 1
1 571 . 18 1 1 A 50 50 GLU H H 50 8.411 9.100 -0.689 1
1 572 . 18 1 1 A 50 50 GLU HA H 50 4.583 5.132 -0.549 1
1 577 . 18 1 1 A 50 50 GLU CA C 50 54.592 54.630 -0.038 1
1 578 . 18 1 1 A 50 50 GLU CB C 50 33.263 32.989 0.274 1
1 580 . 18 1 1 A 50 50 GLU N N 50 123.825 124.773 -0.948 1
1 581 . 18 1 1 A 51 51 ILE H H 51 9.225 9.115 0.110 1
1 582 . 18 1 1 A 51 51 ILE HA H 51 4.277 4.593 -0.316 1
1 592 . 18 1 1 A 51 51 ILE CA C 51 58.182 58.145 0.037 1
1 593 . 18 1 1 A 51 51 ILE CB C 51 39.663 38.486 1.177 1
1 597 . 18 1 1 A 51 51 ILE N N 51 125.271 127.088 -1.817 1
1 598 . 18 1 1 A 52 52 PRO HA H 52 4.543 4.681 -0.138 1
1 605 . 18 1 1 A 52 52 PRO C C 52 178.340 178.139 0.201 1
1 606 . 18 1 1 A 52 52 PRO CA C 52 62.726 62.899 -0.173 1
1 607 . 18 1 1 A 52 52 PRO CB C 52 32.003 31.936 0.067 1
1 610 . 18 1 1 A 53 53 LEU H H 53 8.723 8.499 0.224 1
1 611 . 18 1 1 A 53 53 LEU HA H 53 3.891 3.894 -0.003 1
1 621 . 18 1 1 A 53 53 LEU C C 53 179.673 179.136 0.537 1
1 622 . 18 1 1 A 53 53 LEU CA C 53 58.205 57.603 0.602 1
1 623 . 18 1 1 A 53 53 LEU CB C 53 40.171 41.311 -1.140 1
1 627 . 18 1 1 A 53 53 LEU N N 53 125.150 124.115 1.035 1
1 628 . 18 1 1 A 54 54 SER H H 54 8.360 8.313 0.047 1
1 629 . 18 1 1 A 54 54 SER HA H 54 4.164 4.276 -0.112 1
1 632 . 18 1 1 A 54 54 SER C C 54 175.517 177.401 -1.884 1
1 633 . 18 1 1 A 54 54 SER CA C 54 60.193 61.337 -1.144 1
1 634 . 18 1 1 A 54 54 SER CB C 54 62.617 62.278 0.339 1
1 635 . 18 1 1 A 54 54 SER N N 54 111.266 113.725 -2.459 1
1 636 . 18 1 1 A 55 55 GLU H H 55 7.666 7.783 -0.117 1
1 637 . 18 1 1 A 55 55 GLU HA H 55 4.363 4.158 0.205 1
1 642 . 18 1 1 A 55 55 GLU C C 55 176.753 177.762 -1.009 1
1 643 . 18 1 1 A 55 55 GLU CA C 55 56.200 58.866 -2.666 1
1 644 . 18 1 1 A 55 55 GLU CB C 55 30.526 29.183 1.343 1
1 646 . 18 1 1 A 55 55 GLU N N 55 119.485 119.466 0.019 1
1 647 . 18 1 1 A 56 56 ILE H H 56 7.601 7.081 0.520 1
1 648 . 18 1 1 A 56 56 ILE HA H 56 3.793 3.926 -0.133 1
1 658 . 18 1 1 A 56 56 ILE C C 56 175.142 175.963 -0.821 1
1 659 . 18 1 1 A 56 56 ILE CA C 56 63.518 62.379 1.139 1
1 660 . 18 1 1 A 56 56 ILE CB C 56 37.169 38.026 -0.857 1
1 664 . 18 1 1 A 56 56 ILE N N 56 120.430 120.189 0.241 1
1 665 . 18 1 1 A 57 57 LEU H H 57 9.263 9.300 -0.037 1
1 666 . 18 1 1 A 57 57 LEU HA H 57 4.343 4.387 -0.044 1
1 676 . 18 1 1 A 57 57 LEU C C 57 177.898 176.493 1.405 1
1 677 . 18 1 1 A 57 57 LEU CA C 57 56.569 55.920 0.649 1
1 678 . 18 1 1 A 57 57 LEU CB C 57 41.980 42.446 -0.466 1
1 682 . 18 1 1 A 57 57 LEU N N 57 129.464 129.074 0.390 1
1 683 . 18 1 1 A 58 58 THR H H 58 7.414 7.317 0.097 1
1 684 . 18 1 1 A 58 58 THR HA H 58 4.512 4.859 -0.347 1
1 689 . 18 1 1 A 58 58 THR C C 58 171.314 172.715 -1.401 1
1 690 . 18 1 1 A 58 58 THR CA C 58 60.562 61.303 -0.741 1
1 691 . 18 1 1 A 58 58 THR CB C 58 70.803 73.220 -2.417 1
1 693 . 18 1 1 A 58 58 THR N N 58 109.129 110.694 -1.565 1
1 694 . 18 1 1 A 59 59 VAL H H 59 8.152 8.483 -0.331 1
1 695 . 18 1 1 A 59 59 VAL HA H 59 5.061 5.136 -0.075 1
1 703 . 18 1 1 A 59 59 VAL C C 59 174.985 175.044 -0.059 1
1 704 . 18 1 1 A 59 59 VAL CA C 59 61.354 61.164 0.190 1
1 705 . 18 1 1 A 59 59 VAL CB C 59 33.855 33.905 -0.050 1
1 708 . 18 1 1 A 59 59 VAL N N 59 123.676 124.197 -0.521 1
1 709 . 18 1 1 A 60 60 GLU H H 60 9.074 8.759 0.315 1
1 710 . 18 1 1 A 60 60 GLU HA H 60 4.977 4.865 0.112 1
1 715 . 18 1 1 A 60 60 GLU C C 60 176.063 175.321 0.742 1
1 716 . 18 1 1 A 60 60 GLU CA C 60 53.807 54.304 -0.497 1
1 717 . 18 1 1 A 60 60 GLU CB C 60 33.739 33.656 0.083 1
1 719 . 18 1 1 A 60 60 GLU N N 60 125.125 125.923 -0.798 1
1 720 . 18 1 1 A 61 61 SER H H 61 8.763 8.683 0.080 1
1 721 . 18 1 1 A 61 61 SER HA H 61 4.452 4.945 -0.493 1
1 724 . 18 1 1 A 61 61 SER C C 61 173.288 174.228 -0.940 1
1 725 . 18 1 1 A 61 61 SER CA C 61 59.384 57.768 1.616 1
1 726 . 18 1 1 A 61 61 SER CB C 61 63.390 64.445 -1.055 1
1 727 . 18 1 1 A 61 61 SER N N 61 117.523 118.153 -0.630 1
1 728 . 18 1 1 A 62 62 ALA H H 62 7.293 8.970 -1.677 1
1 729 . 18 1 1 A 62 62 ALA HA H 62 3.817 4.400 -0.583 1
1 733 . 18 1 1 A 62 62 ALA C C 62 176.717 178.059 -1.342 1
1 734 . 18 1 1 A 62 62 ALA CA C 62 53.966 53.068 0.898 1
1 735 . 18 1 1 A 62 62 ALA CB C 62 18.640 18.481 0.159 1
1 736 . 18 1 1 A 62 62 ALA N N 62 122.650 125.681 -3.031 1
1 737 . 18 1 1 A 63 63 GLN H H 63 8.736 8.032 0.704 1
1 738 . 18 1 1 A 63 63 GLN HA H 63 4.445 4.669 -0.224 1
1 745 . 18 1 1 A 63 63 GLN C C 63 173.700 175.161 -1.461 1
1 746 . 18 1 1 A 63 63 GLN CA C 63 56.376 55.751 0.625 1
1 747 . 18 1 1 A 63 63 GLN CB C 63 31.515 30.979 0.536 1
1 749 . 18 1 1 A 63 63 GLN N N 63 120.251 119.626 0.625 1
1 751 . 18 1 1 A 64 64 ASN H H 64 9.272 7.744 1.528 1
1 752 . 18 1 1 A 64 64 ASN HA H 64 4.906 5.079 -0.173 1
1 757 . 18 1 1 A 64 64 ASN C C 64 174.754 174.913 -0.159 1
1 758 . 18 1 1 A 64 64 ASN CA C 64 51.837 52.359 -0.522 1
1 759 . 18 1 1 A 64 64 ASN CB C 64 38.156 40.282 -2.126 1
1 760 . 18 1 1 A 64 64 ASN N N 64 122.346 118.792 3.554 1
1 762 . 18 1 1 A 65 65 PHE H H 65 8.854 9.261 -0.407 1
1 763 . 18 1 1 A 65 65 PHE HA H 65 4.947 5.160 -0.213 1
1 771 . 18 1 1 A 65 65 PHE C C 65 177.274 175.708 1.566 1
1 772 . 18 1 1 A 65 65 PHE CA C 65 57.519 56.828 0.691 1
1 773 . 18 1 1 A 65 65 PHE CB C 65 38.485 38.683 -0.198 1
1 779 . 18 1 1 A 65 65 PHE N N 65 123.638 125.191 -1.553 1
1 780 . 18 1 1 A 66 66 SER H H 66 8.163 8.188 -0.025 1
1 781 . 18 1 1 A 66 66 SER HA H 66 4.393 4.481 -0.088 1
1 784 . 18 1 1 A 66 66 SER C C 66 175.699 177.021 -1.322 1
1 785 . 18 1 1 A 66 66 SER CA C 66 60.791 60.531 0.260 1
1 786 . 18 1 1 A 66 66 SER CB C 66 64.591 63.716 0.875 1
1 787 . 18 1 1 A 66 66 SER N N 66 113.913 114.268 -0.355 1
1 788 . 18 1 1 A 67 67 LEU H H 67 8.574 7.776 0.798 1
1 789 . 18 1 1 A 67 67 LEU HA H 67 4.302 3.798 0.504 1
1 799 . 18 1 1 A 67 67 LEU C C 67 176.269 177.250 -0.981 1
1 800 . 18 1 1 A 67 67 LEU CA C 67 55.601 58.228 -2.627 1
1 801 . 18 1 1 A 67 67 LEU CB C 67 42.021 41.992 0.029 1
1 805 . 18 1 1 A 67 67 LEU N N 67 121.264 120.713 0.551 1
1 806 . 18 1 1 A 68 68 VAL H H 68 6.921 7.603 -0.682 1
1 807 . 18 1 1 A 68 68 VAL HA H 68 4.473 4.164 0.309 1
1 815 . 18 1 1 A 68 68 VAL C C 68 173.809 174.898 -1.089 1
1 816 . 18 1 1 A 68 68 VAL CA C 68 58.047 60.557 -2.510 1
1 817 . 18 1 1 A 68 68 VAL CB C 68 32.295 32.160 0.135 1
1 820 . 18 1 1 A 68 68 VAL N N 68 111.287 115.560 -4.273 1
1 821 . 18 1 1 A 69 69 PRO HA H 69 4.658 4.716 -0.058 1
1 828 . 18 1 1 A 69 69 PRO CA C 69 61.747 61.529 0.218 1
1 829 . 18 1 1 A 69 69 PRO CB C 69 30.693 31.619 -0.926 1
1 832 . 18 1 1 A 70 70 PRO HA H 70 4.414 4.264 0.150 1
1 839 . 18 1 1 A 70 70 PRO CA C 70 63.997 63.661 0.336 1
1 840 . 18 1 1 A 70 70 PRO CB C 70 31.602 31.227 0.375 1
1 843 . 18 1 1 A 71 71 GLY H H 71 8.824 8.878 -0.054 1
1 844 . 18 1 1 A 71 71 GLY HA2 H 71 3.703 3.909 -0.206 1
1 845 . 18 1 1 A 71 71 GLY HA3 H 71 4.193 3.916 0.277 1
1 846 . 18 1 1 A 71 71 GLY C C 71 174.052 174.707 -0.655 1
1 847 . 18 1 1 A 71 71 GLY CA C 71 45.065 45.185 -0.120 1
1 848 . 18 1 1 A 71 71 GLY N N 71 111.845 112.910 -1.065 1
1 849 . 18 1 1 A 72 72 THR H H 72 7.597 7.263 0.334 1
1 850 . 18 1 1 A 72 72 THR HA H 72 4.133 4.125 0.008 1
1 855 . 18 1 1 A 72 72 THR CA C 72 63.129 63.452 -0.323 1
1 856 . 18 1 1 A 72 72 THR CB C 72 69.560 68.985 0.575 1
1 858 . 18 1 1 A 72 72 THR N N 72 117.485 115.551 1.934 1
1 859 . 18 1 1 A 73 73 ASN H H 73 9.280 8.523 0.757 1
1 860 . 18 1 1 A 73 73 ASN HA H 73 4.786 4.612 0.174 1
1 865 . 18 1 1 A 73 73 ASN CA C 73 52.009 52.061 -0.052 1
1 866 . 18 1 1 A 73 73 ASN CB C 73 37.553 38.419 -0.866 1
1 867 . 18 1 1 A 73 73 ASN N N 73 127.641 125.323 2.318 1
1 869 . 18 1 1 A 74 74 PRO HA H 74 4.752 4.800 -0.048 1
1 876 . 18 1 1 A 74 74 PRO C C 74 175.190 176.388 -1.198 1
1 877 . 18 1 1 A 74 74 PRO CA C 74 63.395 62.505 0.890 1
1 878 . 18 1 1 A 74 74 PRO CB C 74 33.164 33.401 -0.237 1
1 881 . 18 1 1 A 75 75 HIS H H 75 8.025 8.851 -0.826 1
1 882 . 18 1 1 A 75 75 HIS HA H 75 5.047 5.139 -0.092 1
1 887 . 18 1 1 A 75 75 HIS C C 75 172.562 175.217 -2.655 1
1 888 . 18 1 1 A 75 75 HIS CA C 75 54.336 53.523 0.813 1
1 889 . 18 1 1 A 75 75 HIS CB C 75 30.956 33.401 -2.445 1
1 892 . 18 1 1 A 75 75 HIS N N 75 116.198 116.614 -0.416 1
1 893 . 18 1 1 A 76 76 CYS H H 76 8.343 9.343 -1.000 1
1 894 . 18 1 1 A 76 76 CYS HA H 76 4.594 4.466 0.128 1
1 897 . 18 1 1 A 76 76 CYS C C 76 175.651 175.178 0.473 1
1 898 . 18 1 1 A 76 76 CYS CA C 76 61.066 61.011 0.055 1
1 899 . 18 1 1 A 76 76 CYS CB C 76 30.193 29.427 0.766 1
1 900 . 18 1 1 A 76 76 CYS N N 76 113.289 118.115 -4.826 1
1 901 . 18 1 1 A 77 77 PHE H H 77 8.433 8.071 0.362 1
1 902 . 18 1 1 A 77 77 PHE HA H 77 5.105 5.408 -0.303 1
1 910 . 18 1 1 A 77 77 PHE C C 77 171.822 173.027 -1.205 1
1 911 . 18 1 1 A 77 77 PHE CA C 77 56.874 55.667 1.207 1
1 912 . 18 1 1 A 77 77 PHE CB C 77 39.393 42.969 -3.576 1
1 918 . 18 1 1 A 77 77 PHE N N 77 114.874 116.144 -1.270 1
1 919 . 18 1 1 A 78 78 GLU H H 78 9.823 9.215 0.608 1
1 920 . 18 1 1 A 78 78 GLU HA H 78 5.333 5.297 0.036 1
1 925 . 18 1 1 A 78 78 GLU C C 78 175.602 175.408 0.194 1
1 926 . 18 1 1 A 78 78 GLU CA C 78 54.212 54.515 -0.303 1
1 927 . 18 1 1 A 78 78 GLU CB C 78 31.702 32.839 -1.137 1
1 929 . 18 1 1 A 78 78 GLU N N 78 121.074 118.991 2.083 1
1 930 . 18 1 1 A 79 79 ILE H H 79 9.093 9.055 0.038 1
1 931 . 18 1 1 A 79 79 ILE HA H 79 4.637 4.549 0.088 1
1 941 . 18 1 1 A 79 79 ILE C C 79 174.476 175.199 -0.723 1
1 942 . 18 1 1 A 79 79 ILE CA C 79 60.932 60.668 0.264 1
1 943 . 18 1 1 A 79 79 ILE CB C 79 40.803 37.667 3.136 1
1 947 . 18 1 1 A 79 79 ILE N N 79 121.382 124.112 -2.730 1
1 948 . 18 1 1 A 80 80 VAL H H 80 8.841 7.871 0.970 1
1 949 . 18 1 1 A 80 80 VAL HA H 80 4.425 3.842 0.583 1
1 957 . 18 1 1 A 80 80 VAL C C 80 175.930 175.521 0.409 1
1 958 . 18 1 1 A 80 80 VAL CA C 80 63.324 63.255 0.069 1
1 959 . 18 1 1 A 80 80 VAL CB C 80 32.783 31.287 1.496 1
1 962 . 18 1 1 A 80 80 VAL N N 80 128.970 127.122 1.848 1
1 963 . 18 1 1 A 81 81 THR H H 81 8.303 8.020 0.283 1
1 964 . 18 1 1 A 81 81 THR HA H 81 5.264 4.697 0.567 1
1 969 . 18 1 1 A 81 81 THR C C 81 173.664 174.734 -1.070 1
1 970 . 18 1 1 A 81 81 THR CA C 81 59.540 59.858 -0.318 1
1 971 . 18 1 1 A 81 81 THR CB C 81 72.197 71.671 0.526 1
1 973 . 18 1 1 A 81 81 THR N N 81 118.077 118.655 -0.578 1
1 974 . 18 1 1 A 82 82 ALA H H 82 9.586 8.487 1.099 1
1 975 . 18 1 1 A 82 82 ALA HA H 82 4.093 4.355 -0.262 1
1 979 . 18 1 1 A 82 82 ALA C C 82 178.667 177.679 0.988 1
1 980 . 18 1 1 A 82 82 ALA CA C 82 55.321 52.850 2.471 1
1 981 . 18 1 1 A 82 82 ALA CB C 82 18.094 18.139 -0.045 1
1 982 . 18 1 1 A 82 82 ALA N N 82 122.493 123.752 -1.259 1
1 983 . 18 1 1 A 83 83 ASN H H 83 7.923 8.453 -0.530 1
1 984 . 18 1 1 A 83 83 ASN HA H 83 4.808 5.100 -0.292 1
1 989 . 18 1 1 A 83 83 ASN C C 83 174.766 174.499 0.267 1
1 990 . 18 1 1 A 83 83 ASN CA C 83 53.333 54.617 -1.284 1
1 991 . 18 1 1 A 83 83 ASN CB C 83 40.335 41.822 -1.487 1
1 992 . 18 1 1 A 83 83 ASN N N 83 110.765 115.925 -5.160 1
1 994 . 18 1 1 A 84 84 ALA H H 84 7.352 7.231 0.121 1
1 995 . 18 1 1 A 84 84 ALA HA H 84 4.625 4.513 0.112 1
1 999 . 18 1 1 A 84 84 ALA C C 84 176.547 175.100 1.447 1
1 1000 . 18 1 1 A 84 84 ALA CA C 84 52.858 51.832 1.026 1
1 1001 . 18 1 1 A 84 84 ALA CB C 84 21.233 22.062 -0.829 1
1 1002 . 18 1 1 A 84 84 ALA N N 84 119.599 117.755 1.844 1
1 1003 . 18 1 1 A 85 85 THR H H 85 8.374 8.667 -0.293 1
1 1004 . 18 1 1 A 85 85 THR HA H 85 5.014 4.556 0.458 1
1 1009 . 18 1 1 A 85 85 THR C C 85 171.568 174.019 -2.451 1
1 1010 . 18 1 1 A 85 85 THR CA C 85 61.618 62.417 -0.799 1
1 1011 . 18 1 1 A 85 85 THR CB C 85 70.850 69.469 1.381 1
1 1013 . 18 1 1 A 85 85 THR N N 85 119.032 113.969 5.063 1
1 1014 . 18 1 1 A 86 86 TYR H H 86 9.006 8.996 0.010 1
1 1015 . 18 1 1 A 86 86 TYR HA H 86 4.658 4.885 -0.227 1
1 1022 . 18 1 1 A 86 86 TYR C C 86 173.773 175.336 -1.563 1
1 1023 . 18 1 1 A 86 86 TYR CA C 86 56.938 58.006 -1.068 1
1 1024 . 18 1 1 A 86 86 TYR CB C 86 39.513 39.878 -0.365 1
1 1029 . 18 1 1 A 86 86 TYR N N 86 123.494 127.154 -3.660 1
1 1030 . 18 1 1 A 87 87 PHE H H 87 9.263 8.924 0.339 1
1 1031 . 18 1 1 A 87 87 PHE HA H 87 4.127 4.605 -0.478 1
1 1039 . 18 1 1 A 87 87 PHE C C 87 176.369 174.233 2.136 1
1 1040 . 18 1 1 A 87 87 PHE CA C 87 57.238 55.588 1.650 1
1 1041 . 18 1 1 A 87 87 PHE CB C 87 37.086 38.281 -1.195 1
1 1047 . 18 1 1 A 87 87 PHE N N 87 125.384 119.942 5.442 1
1 1048 . 18 1 1 A 88 88 VAL H H 88 9.023 8.391 0.632 1
1 1049 . 18 1 1 A 88 88 VAL HA H 88 4.162 4.738 -0.576 1
1 1057 . 18 1 1 A 88 88 VAL C C 88 176.390 175.734 0.656 1
1 1058 . 18 1 1 A 88 88 VAL CA C 88 63.975 60.616 3.359 1
1 1059 . 18 1 1 A 88 88 VAL CB C 88 32.378 32.693 -0.315 1
1 1062 . 18 1 1 A 88 88 VAL N N 88 127.348 124.194 3.154 1
1 1063 . 18 1 1 A 89 89 GLY H H 89 9.233 7.766 1.467 1
1 1064 . 18 1 1 A 89 89 GLY HA2 H 89 4.293 4.182 0.111 1
1 1065 . 18 1 1 A 89 89 GLY HA3 H 89 4.186 4.232 -0.046 1
1 1066 . 18 1 1 A 89 89 GLY C C 89 172.378 171.698 0.680 1
1 1067 . 18 1 1 A 89 89 GLY CA C 89 43.798 46.262 -2.464 1
1 1068 . 18 1 1 A 89 89 GLY N N 89 116.041 112.501 3.540 1
1 1069 . 18 1 1 A 90 90 GLU H H 90 8.532 8.272 0.260 1
1 1070 . 18 1 1 A 90 90 GLU HA H 90 4.794 4.848 -0.054 1
1 1075 . 18 1 1 A 90 90 GLU C C 90 174.221 176.215 -1.994 1
1 1076 . 18 1 1 A 90 90 GLU CA C 90 56.393 55.035 1.358 1
1 1077 . 18 1 1 A 90 90 GLU CB C 90 33.182 31.823 1.359 1
1 1079 . 18 1 1 A 90 90 GLU N N 90 120.905 123.684 -2.779 1
1 1080 . 18 1 1 A 91 91 MET H H 91 8.450 8.314 0.136 1
1 1081 . 18 1 1 A 91 91 MET HA H 91 4.904 5.006 -0.102 1
1 1089 . 18 1 1 A 91 91 MET C C 91 173.373 174.273 -0.900 1
1 1090 . 18 1 1 A 91 91 MET CA C 91 52.277 53.370 -1.093 1
1 1091 . 18 1 1 A 91 91 MET CB C 91 32.789 34.090 -1.301 1
1 1094 . 18 1 1 A 91 91 MET N N 91 125.173 123.066 2.107 1
1 1095 . 18 1 1 A 92 92 PRO HA H 92 4.358 4.717 -0.359 1
1 1102 . 18 1 1 A 92 92 PRO C C 92 177.589 175.783 1.806 1
1 1103 . 18 1 1 A 92 92 PRO CA C 92 63.143 62.939 0.204 1
1 1104 . 18 1 1 A 92 92 PRO CB C 92 32.083 32.237 -0.154 1
1 1107 . 18 1 1 A 93 93 GLY H H 93 8.330 8.063 0.267 1
1 1108 . 18 1 1 A 93 93 GLY HA2 H 93 3.943 4.220 -0.277 1
1 1109 . 18 1 1 A 93 93 GLY HA3 H 93 4.045 4.226 -0.181 1
1 1110 . 18 1 1 A 93 93 GLY C C 93 174.730 172.241 2.489 1
1 1111 . 18 1 1 A 93 93 GLY CA C 93 45.276 45.820 -0.544 1
1 1112 . 18 1 1 A 93 93 GLY N N 93 109.420 107.797 1.623 1
1 1113 . 18 1 1 A 94 94 GLY H H 94 8.331 8.312 0.019 1
1 1114 . 18 1 1 A 94 94 GLY HA2 H 94 3.973 4.169 -0.196 1
1 1115 . 18 1 1 A 94 94 GLY HA3 H 94 3.973 4.170 -0.197 1
1 1116 . 18 1 1 A 94 94 GLY C C 94 174.100 173.035 1.065 1
1 1117 . 18 1 1 A 94 94 GLY CA C 94 45.333 45.754 -0.421 1
1 1118 . 18 1 1 A 94 94 GLY N N 94 108.483 109.926 -1.443 1
1 1119 . 18 1 1 A 95 95 THR H H 95 8.095 7.868 0.227 1
1 1120 . 18 1 1 A 95 95 THR HA H 95 4.643 5.043 -0.400 1
1 1125 . 18 1 1 A 95 95 THR C C 95 173.155 174.018 -0.863 1
1 1126 . 18 1 1 A 95 95 THR CA C 95 59.922 58.506 1.416 1
1 1127 . 18 1 1 A 95 95 THR CB C 95 69.871 70.735 -0.864 1
1 1129 . 18 1 1 A 95 95 THR N N 95 115.860 110.424 5.436 1
1 1130 . 18 1 1 A 96 96 PRO HA H 96 4.400 4.478 -0.078 1
1 1137 . 18 1 1 A 96 96 PRO C C 96 177.565 177.411 0.154 1
1 1138 . 18 1 1 A 96 96 PRO CA C 96 64.047 63.465 0.582 1
1 1139 . 18 1 1 A 96 96 PRO CB C 96 31.816 32.061 -0.245 1
1 1142 . 18 1 1 A 97 97 GLY H H 97 8.572 7.979 0.593 1
1 1143 . 18 1 1 A 97 97 GLY HA2 H 97 4.007 3.943 0.064 1
1 1144 . 18 1 1 A 97 97 GLY HA3 H 97 4.007 3.945 0.062 1
1 1145 . 18 1 1 A 97 97 GLY C C 97 174.609 174.689 -0.080 1
1 1146 . 18 1 1 A 97 97 GLY CA C 97 45.276 46.432 -1.156 1
1 1147 . 18 1 1 A 97 97 GLY N N 97 110.233 109.498 0.735 1
1 1148 . 18 1 1 A 98 98 GLY H H 98 8.119 8.324 -0.205 1
1 1149 . 18 1 1 A 98 98 GLY HA2 H 98 4.086 4.268 -0.182 1
1 1150 . 18 1 1 A 98 98 GLY HA3 H 98 4.200 4.268 -0.068 1
1 1151 . 18 1 1 A 98 98 GLY CA C 98 44.876 44.038 0.838 1
1 1152 . 18 1 1 A 98 98 GLY N N 98 108.845 111.005 -2.160 1
1 1153 . 18 1 1 A 99 99 PRO HA H 99 4.494 4.405 0.089 1
1 1160 . 18 1 1 A 99 99 PRO C C 99 177.468 177.232 0.236 1
1 1161 . 18 1 1 A 99 99 PRO CA C 99 63.500 64.883 -1.383 1
1 1162 . 18 1 1 A 99 99 PRO CB C 99 32.013 32.094 -0.081 1
1 1165 . 18 1 1 A 100 100 SER H H 100 8.472 8.087 0.385 1
1 1166 . 18 1 1 A 100 100 SER HA H 100 4.513 4.452 0.061 1
1 1169 . 18 1 1 A 100 100 SER C C 100 175.408 173.723 1.685 1
1 1170 . 18 1 1 A 100 100 SER CA C 100 58.557 57.823 0.734 1
1 1171 . 18 1 1 A 100 100 SER CB C 100 63.918 61.963 1.955 1
1 1172 . 18 1 1 A 100 100 SER N N 100 116.038 113.139 2.899 1
1 1173 . 18 1 1 A 101 101 GLY H H 101 8.427 7.937 0.490 1
1 1174 . 18 1 1 A 101 101 GLY HA2 H 101 4.064 4.263 -0.199 1
1 1175 . 18 1 1 A 101 101 GLY HA3 H 101 4.064 4.264 -0.200 1
1 1176 . 18 1 1 A 101 101 GLY C C 101 174.730 171.428 3.302 1
1 1177 . 18 1 1 A 101 101 GLY CA C 101 45.575 46.119 -0.544 1
1 1178 . 18 1 1 A 101 101 GLY N N 101 110.558 113.770 -3.212 1
1 1179 . 18 1 1 A 102 102 GLN H H 102 8.416 8.686 -0.270 1
1 1180 . 18 1 1 A 102 102 GLN HA H 102 4.383 4.990 -0.607 1
1 1187 . 18 1 1 A 102 102 GLN C C 102 177.346 174.974 2.372 1
1 1188 . 18 1 1 A 102 102 GLN CA C 102 57.080 55.150 1.930 1
1 1189 . 18 1 1 A 102 102 GLN CB C 102 29.235 32.213 -2.978 1
1 1191 . 18 1 1 A 102 102 GLN N N 102 120.112 121.154 -1.042 1
1 1193 . 18 1 1 A 103 103 GLY H H 103 8.713 8.685 0.028 1
1 1194 . 18 1 1 A 103 103 GLY HA2 H 103 4.193 4.042 0.151 1
1 1195 . 18 1 1 A 103 103 GLY HA3 H 103 4.078 4.060 0.018 1
1 1196 . 18 1 1 A 103 103 GLY C C 103 175.602 173.889 1.713 1
1 1197 . 18 1 1 A 103 103 GLY CA C 103 46.120 46.375 -0.255 1
1 1198 . 18 1 1 A 103 103 GLY N N 103 109.817 113.393 -3.576 1
1 1199 . 18 1 1 A 104 104 ALA H H 104 8.366 7.801 0.565 1
1 1200 . 18 1 1 A 104 104 ALA HA H 104 4.449 4.680 -0.231 1
1 1204 . 18 1 1 A 104 104 ALA C C 104 179.188 178.049 1.139 1
1 1205 . 18 1 1 A 104 104 ALA CA C 104 54.230 53.102 1.128 1
1 1206 . 18 1 1 A 104 104 ALA CB C 104 19.080 20.722 -1.642 1
1 1207 . 18 1 1 A 104 104 ALA N N 104 124.808 120.310 4.498 1
1 1208 . 18 1 1 A 105 105 GLU H H 105 8.576 8.735 -0.159 1
1 1209 . 18 1 1 A 105 105 GLU HA H 105 4.161 4.135 0.026 1
1 1214 . 18 1 1 A 105 105 GLU C C 105 179.200 179.311 -0.111 1
1 1215 . 18 1 1 A 105 105 GLU CA C 105 59.173 59.096 0.077 1
1 1216 . 18 1 1 A 105 105 GLU CB C 105 29.194 29.832 -0.638 1
1 1218 . 18 1 1 A 105 105 GLU N N 105 119.238 117.993 1.245 1
1 1219 . 18 1 1 A 106 106 ALA H H 106 8.381 8.271 0.110 1
1 1220 . 18 1 1 A 106 106 ALA HA H 106 4.283 4.106 0.177 1
1 1224 . 18 1 1 A 106 106 ALA C C 106 180.048 180.218 -0.170 1
1 1225 . 18 1 1 A 106 106 ALA CA C 106 54.687 55.521 -0.834 1
1 1226 . 18 1 1 A 106 106 ALA CB C 106 18.341 18.803 -0.462 1
1 1227 . 18 1 1 A 106 106 ALA N N 106 123.327 123.547 -0.220 1
1 1228 . 18 1 1 A 107 107 ALA H H 107 8.123 8.309 -0.186 1
1 1229 . 18 1 1 A 107 107 ALA HA H 107 4.554 4.435 0.119 1
1 1233 . 18 1 1 A 107 107 ALA C C 107 179.757 180.151 -0.394 1
1 1234 . 18 1 1 A 107 107 ALA CA C 107 55.355 55.508 -0.153 1
1 1235 . 18 1 1 A 107 107 ALA CB C 107 18.939 18.531 0.408 1
1 1236 . 18 1 1 A 107 107 ALA N N 107 120.740 120.219 0.521 1
1 1237 . 18 1 1 A 108 108 ARG H H 108 8.403 8.264 0.139 1
1 1238 . 18 1 1 A 108 108 ARG HA H 108 4.254 4.166 0.088 1
1 1245 . 18 1 1 A 108 108 ARG C C 108 179.111 179.920 -0.809 1
1 1246 . 18 1 1 A 108 108 ARG CA C 108 59.015 59.347 -0.332 1
1 1247 . 18 1 1 A 108 108 ARG CB C 108 29.752 30.068 -0.316 1
1 1250 . 18 1 1 A 108 108 ARG N N 108 119.531 118.083 1.448 1
1 1251 . 18 1 1 A 109 109 GLY H H 109 8.182 8.630 -0.448 1
1 1252 . 18 1 1 A 109 109 GLY HA2 H 109 3.822 3.646 0.176 1
1 1253 . 18 1 1 A 109 109 GLY HA3 H 109 3.822 3.717 0.105 1
1 1254 . 18 1 1 A 109 109 GLY C C 109 177.020 176.771 0.249 1
1 1255 . 18 1 1 A 109 109 GLY CA C 109 46.718 47.155 -0.437 1
1 1256 . 18 1 1 A 109 109 GLY N N 109 107.331 107.893 -0.562 1
1 1257 . 18 1 1 A 110 110 TRP H H 110 7.925 7.724 0.201 1
1 1258 . 18 1 1 A 110 110 TRP HA H 110 3.963 4.652 -0.689 1
1 1267 . 18 1 1 A 110 110 TRP C C 110 176.691 178.232 -1.541 1
1 1268 . 18 1 1 A 110 110 TRP CA C 110 62.041 60.107 1.934 1
1 1269 . 18 1 1 A 110 110 TRP CB C 110 28.989 28.649 0.340 1
1 1275 . 18 1 1 A 110 110 TRP N N 110 122.304 121.926 0.378 1
1 1277 . 18 1 1 A 111 111 GLU H H 111 7.946 7.925 0.021 1
1 1278 . 18 1 1 A 111 111 GLU HA H 111 2.594 2.961 -0.367 1
1 1283 . 18 1 1 A 111 111 GLU C C 111 177.976 179.004 -1.028 1
1 1284 . 18 1 1 A 111 111 GLU CA C 111 60.193 58.970 1.223 1
1 1285 . 18 1 1 A 111 111 GLU CB C 111 29.277 29.291 -0.014 1
1 1287 . 18 1 1 A 111 111 GLU N N 111 121.755 119.144 2.611 1
1 1288 . 18 1 1 A 112 112 THR H H 112 7.993 7.433 0.560 1
1 1289 . 18 1 1 A 112 112 THR HA H 112 3.722 3.889 -0.167 1
1 1294 . 18 1 1 A 112 112 THR C C 112 176.038 175.676 0.362 1
1 1295 . 18 1 1 A 112 112 THR CA C 112 66.104 66.397 -0.293 1
1 1296 . 18 1 1 A 112 112 THR CB C 112 68.885 69.131 -0.246 1
1 1298 . 18 1 1 A 112 112 THR N N 112 112.247 116.138 -3.891 1
1 1299 . 18 1 1 A 113 113 ALA H H 113 7.742 8.508 -0.766 1
1 1300 . 18 1 1 A 113 113 ALA HA H 113 4.029 3.997 0.032 1
1 1304 . 18 1 1 A 113 113 ALA C C 113 180.545 179.870 0.675 1
1 1305 . 18 1 1 A 113 113 ALA CA C 113 55.127 55.167 -0.040 1
1 1306 . 18 1 1 A 113 113 ALA CB C 113 18.854 18.471 0.383 1
1 1307 . 18 1 1 A 113 113 ALA N N 113 123.134 122.768 0.366 1
1 1308 . 18 1 1 A 114 114 ILE H H 114 8.472 8.496 -0.024 1
1 1309 . 18 1 1 A 114 114 ILE HA H 114 3.613 3.773 -0.160 1
1 1319 . 18 1 1 A 114 114 ILE C C 114 176.947 178.041 -1.094 1
1 1320 . 18 1 1 A 114 114 ILE CA C 114 66.016 65.190 0.826 1
1 1321 . 18 1 1 A 114 114 ILE CB C 114 38.335 37.958 0.377 1
1 1325 . 18 1 1 A 114 114 ILE N N 114 118.276 117.909 0.367 1
1 1326 . 18 1 1 A 115 115 ARG H H 115 8.181 8.312 -0.131 1
1 1327 . 18 1 1 A 115 115 ARG HA H 115 3.835 3.901 -0.066 1
1 1334 . 18 1 1 A 115 115 ARG C C 115 179.588 179.124 0.464 1
1 1335 . 18 1 1 A 115 115 ARG CA C 115 61.072 60.073 0.999 1
1 1336 . 18 1 1 A 115 115 ARG CB C 115 29.975 29.850 0.125 1
1 1339 . 18 1 1 A 115 115 ARG N N 115 117.921 119.278 -1.357 1
1 1340 . 18 1 1 A 116 116 GLN H H 116 8.395 8.459 -0.064 1
1 1341 . 18 1 1 A 116 116 GLN HA H 116 4.030 4.074 -0.044 1
1 1348 . 18 1 1 A 116 116 GLN C C 116 178.716 178.681 0.035 1
1 1349 . 18 1 1 A 116 116 GLN CA C 116 58.790 58.889 -0.099 1
1 1350 . 18 1 1 A 116 116 GLN CB C 116 28.248 28.483 -0.235 1
1 1352 . 18 1 1 A 116 116 GLN N N 116 116.842 118.832 -1.990 1
1 1354 . 18 1 1 A 117 117 ALA H H 117 7.902 8.285 -0.383 1
1 1355 . 18 1 1 A 117 117 ALA HA H 117 4.143 4.143 0.000 1
1 1359 . 18 1 1 A 117 117 ALA C C 117 179.685 180.292 -0.607 1
1 1360 . 18 1 1 A 117 117 ALA CA C 117 54.476 54.936 -0.460 1
1 1361 . 18 1 1 A 117 117 ALA CB C 117 18.300 18.375 -0.075 1
1 1362 . 18 1 1 A 117 117 ALA N N 117 122.828 122.845 -0.017 1
1 1363 . 18 1 1 A 118 118 LEU H H 118 7.904 8.050 -0.146 1
1 1364 . 18 1 1 A 118 118 LEU HA H 118 4.119 4.111 0.008 1
1 1374 . 18 1 1 A 118 118 LEU C C 118 178.437 178.582 -0.145 1
1 1375 . 18 1 1 A 118 118 LEU CA C 118 56.781 57.061 -0.280 1
1 1376 . 18 1 1 A 118 118 LEU CB C 118 42.371 41.910 0.461 1
1 1380 . 18 1 1 A 118 118 LEU N N 118 117.632 120.216 -2.584 1
1 1381 . 18 1 1 A 119 119 MET H H 119 7.673 8.063 -0.390 1
1 1382 . 18 1 1 A 119 119 MET HA H 119 4.442 4.241 0.201 1
1 1390 . 18 1 1 A 119 119 MET C C 119 176.680 177.130 -0.450 1
1 1391 . 18 1 1 A 119 119 MET CA C 119 56.432 57.809 -1.377 1
1 1392 . 18 1 1 A 119 119 MET CB C 119 32.769 32.336 0.433 1
1 1395 . 18 1 1 A 119 119 MET N N 119 117.286 117.178 0.108 1
1 1396 . 18 1 1 A 120 120 SER H H 120 7.878 7.412 0.466 1
1 1397 . 18 1 1 A 120 120 SER HA H 120 4.500 4.541 -0.041 1
1 1400 . 18 1 1 A 120 120 SER C C 120 174.742 174.571 0.171 1
1 1401 . 18 1 1 A 120 120 SER CA C 120 58.962 57.489 1.473 1
1 1402 . 18 1 1 A 120 120 SER CB C 120 63.853 63.623 0.230 1
1 1403 . 18 1 1 A 120 120 SER N N 120 115.064 108.438 6.626 1
1 1404 . 18 1 1 A 121 121 GLY H H 121 8.059 8.346 -0.287 1
1 1405 . 18 1 1 A 121 121 GLY HA2 H 121 4.231 3.976 0.255 1
1 1406 . 18 1 1 A 121 121 GLY HA3 H 121 4.112 3.977 0.135 1
1 1407 . 18 1 1 A 121 121 GLY C C 121 172.065 173.365 -1.300 1
1 1408 . 18 1 1 A 121 121 GLY CA C 121 45.030 45.368 -0.338 1
1 1409 . 18 1 1 A 121 121 GLY N N 121 110.271 110.514 -0.243 1
1 1410 . 18 1 1 A 122 122 PRO HA H 122 4.496 4.478 0.018 1
1 1417 . 18 1 1 A 122 122 PRO CA C 122 63.399 62.729 0.670 1
1 1418 . 18 1 1 A 122 122 PRO CB C 122 32.186 32.216 -0.030 1
1 1 . 19 1 1 A 6 6 SER H H 6 8.337 7.630 0.707 1
1 2 . 19 1 1 A 6 6 SER HA H 6 4.597 4.857 -0.260 1
1 5 . 19 1 1 A 6 6 SER C C 6 174.637 172.697 1.940 1
1 6 . 19 1 1 A 6 6 SER CA C 6 58.469 56.842 1.627 1
1 7 . 19 1 1 A 6 6 SER CB C 6 64.221 65.137 -0.916 1
1 8 . 19 1 1 A 6 6 SER N N 6 117.887 118.918 -1.031 1
1 9 . 19 1 1 A 7 7 GLY H H 7 8.280 8.834 -0.554 1
1 10 . 19 1 1 A 7 7 GLY HA2 H 7 4.063 4.042 0.021 1
1 11 . 19 1 1 A 7 7 GLY HA3 H 7 4.063 4.046 0.017 1
1 12 . 19 1 1 A 7 7 GLY C C 7 173.724 173.385 0.339 1
1 13 . 19 1 1 A 7 7 GLY CA C 7 44.941 45.291 -0.350 1
1 14 . 19 1 1 A 7 7 GLY N N 7 110.151 114.312 -4.161 1
1 15 . 19 1 1 A 8 8 THR H H 8 8.212 7.586 0.626 1
1 16 . 19 1 1 A 8 8 THR HA H 8 4.173 5.212 -1.039 1
1 21 . 19 1 1 A 8 8 THR C C 8 174.723 174.264 0.459 1
1 22 . 19 1 1 A 8 8 THR CA C 8 63.622 61.006 2.616 1
1 23 . 19 1 1 A 8 8 THR CB C 8 69.460 71.852 -2.392 1
1 25 . 19 1 1 A 8 8 THR N N 8 116.817 113.438 3.379 1
1 26 . 19 1 1 A 9 9 LEU H H 9 9.374 8.726 0.648 1
1 27 . 19 1 1 A 9 9 LEU HA H 9 4.302 4.124 0.178 1
1 37 . 19 1 1 A 9 9 LEU C C 9 177.468 176.621 0.847 1
1 38 . 19 1 1 A 9 9 LEU CA C 9 55.936 56.825 -0.889 1
1 39 . 19 1 1 A 9 9 LEU CB C 9 42.843 42.322 0.521 1
1 43 . 19 1 1 A 9 9 LEU N N 9 127.798 127.218 0.580 1
1 44 . 19 1 1 A 10 10 ARG H H 10 7.512 7.252 0.260 1
1 45 . 19 1 1 A 10 10 ARG HA H 10 4.199 4.636 -0.437 1
1 52 . 19 1 1 A 10 10 ARG C C 10 172.501 173.943 -1.442 1
1 53 . 19 1 1 A 10 10 ARG CA C 10 56.165 54.398 1.767 1
1 54 . 19 1 1 A 10 10 ARG CB C 10 32.442 33.251 -0.809 1
1 57 . 19 1 1 A 10 10 ARG N N 10 117.979 116.616 1.363 1
1 58 . 19 1 1 A 11 11 GLU H H 11 8.434 8.675 -0.241 1
1 59 . 19 1 1 A 11 11 GLU HA H 11 5.993 5.569 0.424 1
1 64 . 19 1 1 A 11 11 GLU C C 11 174.800 174.617 0.183 1
1 65 . 19 1 1 A 11 11 GLU CA C 11 54.570 55.152 -0.582 1
1 66 . 19 1 1 A 11 11 GLU CB C 11 34.245 33.212 1.033 1
1 68 . 19 1 1 A 11 11 GLU N N 11 120.782 122.263 -1.481 1
1 69 . 19 1 1 A 12 12 GLY H H 12 8.131 7.926 0.205 1
1 70 . 19 1 1 A 12 12 GLY HA2 H 12 4.714 3.323 1.391 1
1 71 . 19 1 1 A 12 12 GLY HA3 H 12 3.763 4.096 -0.333 1
1 72 . 19 1 1 A 12 12 GLY C C 12 171.060 171.645 -0.585 1
1 73 . 19 1 1 A 12 12 GLY CA C 12 45.241 44.957 0.284 1
1 74 . 19 1 1 A 12 12 GLY N N 12 107.457 106.199 1.258 1
1 75 . 19 1 1 A 13 13 TRP H H 13 8.783 8.413 0.370 1
1 76 . 19 1 1 A 13 13 TRP HA H 13 5.152 4.801 0.351 1
1 85 . 19 1 1 A 13 13 TRP C C 13 177.528 176.536 0.992 1
1 86 . 19 1 1 A 13 13 TRP CA C 13 57.783 58.750 -0.967 1
1 87 . 19 1 1 A 13 13 TRP CB C 13 30.222 29.760 0.462 1
1 93 . 19 1 1 A 13 13 TRP N N 13 120.792 121.365 -0.573 1
1 95 . 19 1 1 A 14 14 VAL H H 14 9.179 8.487 0.692 1
1 96 . 19 1 1 A 14 14 VAL HA H 14 4.072 4.617 -0.545 1
1 104 . 19 1 1 A 14 14 VAL C C 14 174.981 173.355 1.626 1
1 105 . 19 1 1 A 14 14 VAL CA C 14 61.741 60.225 1.516 1
1 106 . 19 1 1 A 14 14 VAL CB C 14 35.143 35.005 0.138 1
1 109 . 19 1 1 A 14 14 VAL N N 14 125.476 123.285 2.191 1
1 110 . 19 1 1 A 15 15 VAL H H 15 8.403 8.707 -0.304 1
1 111 . 19 1 1 A 15 15 VAL HA H 15 5.532 5.455 0.077 1
1 119 . 19 1 1 A 15 15 VAL C C 15 175.078 174.330 0.748 1
1 120 . 19 1 1 A 15 15 VAL CA C 15 59.489 59.252 0.237 1
1 121 . 19 1 1 A 15 15 VAL CB C 15 34.210 35.154 -0.944 1
1 124 . 19 1 1 A 15 15 VAL N N 15 126.189 124.060 2.129 1
1 125 . 19 1 1 A 16 16 HIS H H 16 9.122 8.667 0.455 1
1 126 . 19 1 1 A 16 16 HIS HA H 16 5.823 5.599 0.224 1
1 131 . 19 1 1 A 16 16 HIS C C 16 172.998 172.528 0.470 1
1 132 . 19 1 1 A 16 16 HIS CA C 16 56.253 53.830 2.423 1
1 133 . 19 1 1 A 16 16 HIS CB C 16 34.273 33.849 0.424 1
1 136 . 19 1 1 A 16 16 HIS N N 16 121.152 120.874 0.278 1
1 137 . 19 1 1 A 17 17 TYR H H 17 8.465 8.753 -0.288 1
1 138 . 19 1 1 A 17 17 TYR HA H 17 5.096 4.880 0.216 1
1 145 . 19 1 1 A 17 17 TYR C C 17 173.640 173.198 0.442 1
1 146 . 19 1 1 A 17 17 TYR CA C 17 56.903 56.658 0.245 1
1 147 . 19 1 1 A 17 17 TYR CB C 17 40.103 40.467 -0.364 1
1 152 . 19 1 1 A 17 17 TYR N N 17 115.558 116.620 -1.062 1
1 153 . 19 1 1 A 18 18 SER H H 18 9.122 8.665 0.457 1
1 154 . 19 1 1 A 18 18 SER HA H 18 6.144 5.281 0.863 1
1 157 . 19 1 1 A 18 18 SER C C 18 173.204 175.442 -2.238 1
1 158 . 19 1 1 A 18 18 SER CA C 18 56.640 56.973 -0.333 1
1 159 . 19 1 1 A 18 18 SER CB C 18 68.788 66.376 2.412 1
1 160 . 19 1 1 A 18 18 SER N N 18 118.846 116.100 2.746 1
1 161 . 19 1 1 A 19 19 ASN H H 19 9.053 8.771 0.282 1
1 162 . 19 1 1 A 19 19 ASN HA H 19 4.473 4.957 -0.484 1
1 167 . 19 1 1 A 19 19 ASN C C 19 175.396 175.659 -0.263 1
1 168 . 19 1 1 A 19 19 ASN CA C 19 55.373 52.178 3.195 1
1 169 . 19 1 1 A 19 19 ASN CB C 19 36.900 38.130 -1.230 1
1 170 . 19 1 1 A 19 19 ASN N N 19 113.712 117.879 -4.167 1
1 172 . 19 1 1 A 20 20 LYS H H 20 7.677 7.876 -0.199 1
1 173 . 19 1 1 A 20 20 LYS HA H 20 4.413 4.678 -0.265 1
1 182 . 19 1 1 A 20 20 LYS C C 20 176.078 177.335 -1.257 1
1 183 . 19 1 1 A 20 20 LYS CA C 20 55.679 57.653 -1.974 1
1 184 . 19 1 1 A 20 20 LYS CB C 20 33.023 35.583 -2.560 1
1 188 . 19 1 1 A 20 20 LYS N N 20 117.213 119.467 -2.254 1
1 189 . 19 1 1 A 21 21 ASP H H 21 7.395 7.675 -0.280 1
1 190 . 19 1 1 A 21 21 ASP HA H 21 4.808 4.658 0.150 1
1 193 . 19 1 1 A 21 21 ASP C C 21 176.413 176.738 -0.325 1
1 194 . 19 1 1 A 21 21 ASP CA C 21 53.983 54.214 -0.231 1
1 195 . 19 1 1 A 21 21 ASP CB C 21 41.199 42.367 -1.168 1
1 196 . 19 1 1 A 21 21 ASP N N 21 119.879 116.093 3.786 1
1 197 . 19 1 1 A 22 22 THR H H 22 8.593 8.065 0.528 1
1 198 . 19 1 1 A 22 22 THR HA H 22 4.352 4.118 0.234 1
1 203 . 19 1 1 A 22 22 THR C C 22 172.913 173.735 -0.822 1
1 204 . 19 1 1 A 22 22 THR CA C 22 62.691 63.001 -0.310 1
1 205 . 19 1 1 A 22 22 THR CB C 22 68.332 66.477 1.855 1
1 207 . 19 1 1 A 22 22 THR N N 22 116.299 114.181 2.118 1
1 208 . 19 1 1 A 23 23 LEU H H 23 7.645 8.357 -0.712 1
1 209 . 19 1 1 A 23 23 LEU HA H 23 4.318 4.437 -0.119 1
1 219 . 19 1 1 A 23 23 LEU C C 23 176.692 175.408 1.284 1
1 220 . 19 1 1 A 23 23 LEU CA C 23 54.617 53.871 0.746 1
1 221 . 19 1 1 A 23 23 LEU CB C 23 41.939 40.835 1.104 1
1 225 . 19 1 1 A 23 23 LEU N N 23 123.606 122.181 1.425 1
1 226 . 19 1 1 A 24 24 ARG H H 24 8.563 7.861 0.702 1
1 227 . 19 1 1 A 24 24 ARG HA H 24 4.373 4.497 -0.124 1
1 235 . 19 1 1 A 24 24 ARG C C 24 176.584 175.540 1.044 1
1 236 . 19 1 1 A 24 24 ARG CA C 24 57.854 56.865 0.989 1
1 237 . 19 1 1 A 24 24 ARG CB C 24 31.126 30.161 0.965 1
1 240 . 19 1 1 A 24 24 ARG N N 24 127.152 122.906 4.246 1
1 242 . 19 1 1 A 25 25 LYS H H 25 8.633 8.925 -0.292 1
1 243 . 19 1 1 A 25 25 LYS HA H 25 4.513 4.516 -0.003 1
1 251 . 19 1 1 A 25 25 LYS C C 25 173.567 174.804 -1.237 1
1 252 . 19 1 1 A 25 25 LYS CA C 25 54.792 55.592 -0.800 1
1 253 . 19 1 1 A 25 25 LYS CB C 25 37.416 32.982 4.434 1
1 257 . 19 1 1 A 25 25 LYS N N 25 122.682 126.017 -3.335 1
1 258 . 19 1 1 A 26 26 ARG H H 26 8.303 8.521 -0.218 1
1 259 . 19 1 1 A 26 26 ARG HA H 26 5.153 5.125 0.028 1
1 266 . 19 1 1 A 26 26 ARG C C 26 174.554 174.914 -0.360 1
1 267 . 19 1 1 A 26 26 ARG CA C 26 55.083 54.604 0.479 1
1 268 . 19 1 1 A 26 26 ARG CB C 26 32.789 32.006 0.783 1
1 271 . 19 1 1 A 26 26 ARG N N 26 121.819 125.615 -3.796 1
1 272 . 19 1 1 A 27 27 HIS H H 27 8.793 8.877 -0.084 1
1 273 . 19 1 1 A 27 27 HIS HA H 27 5.155 5.451 -0.296 1
1 278 . 19 1 1 A 27 27 HIS CA C 27 56.904 55.095 1.809 1
1 279 . 19 1 1 A 27 27 HIS CB C 27 34.683 31.540 3.143 1
1 282 . 19 1 1 A 27 27 HIS N N 27 122.102 120.810 1.292 1
1 283 . 19 1 1 A 28 28 TYR H H 28 9.273 8.587 0.686 1
1 284 . 19 1 1 A 28 28 TYR HA H 28 4.332 4.432 -0.100 1
1 291 . 19 1 1 A 28 28 TYR C C 28 174.730 175.328 -0.598 1
1 292 . 19 1 1 A 28 28 TYR CA C 28 58.680 57.351 1.329 1
1 293 . 19 1 1 A 28 28 TYR CB C 28 38.673 38.072 0.601 1
1 298 . 19 1 1 A 28 28 TYR N N 28 125.605 121.512 4.093 1
1 299 . 19 1 1 A 29 29 TRP H H 29 9.273 8.774 0.499 1
1 300 . 19 1 1 A 29 29 TRP HA H 29 5.543 4.922 0.621 1
1 309 . 19 1 1 A 29 29 TRP C C 29 176.172 176.765 -0.593 1
1 310 . 19 1 1 A 29 29 TRP CA C 29 56.658 57.236 -0.578 1
1 311 . 19 1 1 A 29 29 TRP CB C 29 32.154 30.402 1.752 1
1 317 . 19 1 1 A 29 29 TRP N N 29 131.340 128.370 2.970 1
1 318 . 19 1 1 A 30 30 ARG H H 30 9.164 9.282 -0.118 1
1 319 . 19 1 1 A 30 30 ARG HA H 30 5.302 5.433 -0.131 1
1 327 . 19 1 1 A 30 30 ARG C C 30 174.774 174.512 0.262 1
1 328 . 19 1 1 A 30 30 ARG CA C 30 56.271 54.749 1.522 1
1 329 . 19 1 1 A 30 30 ARG CB C 30 34.203 33.949 0.254 1
1 332 . 19 1 1 A 30 30 ARG N N 30 116.040 120.867 -4.827 1
1 334 . 19 1 1 A 31 31 LEU H H 31 9.273 9.612 -0.339 1
1 335 . 19 1 1 A 31 31 LEU HA H 31 5.324 5.423 -0.099 1
1 345 . 19 1 1 A 31 31 LEU C C 31 174.488 174.549 -0.061 1
1 346 . 19 1 1 A 31 31 LEU CA C 31 53.807 53.503 0.304 1
1 347 . 19 1 1 A 31 31 LEU CB C 31 46.667 45.597 1.070 1
1 351 . 19 1 1 A 31 31 LEU N N 31 127.075 127.040 0.035 1
1 352 . 19 1 1 A 32 32 ASP H H 32 8.854 8.746 0.108 1
1 353 . 19 1 1 A 32 32 ASP HA H 32 4.902 5.097 -0.195 1
1 356 . 19 1 1 A 32 32 ASP C C 32 173.474 176.527 -3.053 1
1 357 . 19 1 1 A 32 32 ASP CA C 32 53.104 52.271 0.833 1
1 358 . 19 1 1 A 32 32 ASP CB C 32 42.931 44.268 -1.337 1
1 359 . 19 1 1 A 32 32 ASP N N 32 129.349 125.347 4.002 1
1 360 . 19 1 1 A 33 33 CYS H H 33 8.153 8.892 -0.739 1
1 361 . 19 1 1 A 33 33 CYS HA H 33 4.323 4.305 0.018 1
1 364 . 19 1 1 A 33 33 CYS C C 33 174.476 174.589 -0.113 1
1 365 . 19 1 1 A 33 33 CYS CA C 33 59.853 60.494 -0.641 1
1 366 . 19 1 1 A 33 33 CYS CB C 33 27.508 26.921 0.587 1
1 367 . 19 1 1 A 33 33 CYS N N 33 108.439 119.133 -10.694 1
1 368 . 19 1 1 A 34 34 LYS H H 34 9.144 7.820 1.324 1
1 369 . 19 1 1 A 34 34 LYS HA H 34 4.616 4.362 0.254 1
1 378 . 19 1 1 A 34 34 LYS C C 34 177.601 176.249 1.352 1
1 379 . 19 1 1 A 34 34 LYS CA C 34 57.185 56.807 0.378 1
1 380 . 19 1 1 A 34 34 LYS CB C 34 35.623 34.451 1.172 1
1 384 . 19 1 1 A 34 34 LYS N N 34 119.884 117.957 1.927 1
1 385 . 19 1 1 A 35 35 CYS H H 35 9.102 7.656 1.446 1
1 386 . 19 1 1 A 35 35 CYS HA H 35 4.935 4.758 0.177 1
1 389 . 19 1 1 A 35 35 CYS C C 35 172.283 172.605 -0.322 1
1 390 . 19 1 1 A 35 35 CYS CA C 35 57.748 58.153 -0.405 1
1 391 . 19 1 1 A 35 35 CYS CB C 35 31.537 32.334 -0.797 1
1 392 . 19 1 1 A 35 35 CYS N N 35 120.317 114.068 6.249 1
1 393 . 19 1 1 A 36 36 ILE H H 36 8.213 8.979 -0.766 1
1 394 . 19 1 1 A 36 36 ILE HA H 36 4.617 4.905 -0.288 1
1 404 . 19 1 1 A 36 36 ILE C C 36 175.312 175.288 0.024 1
1 405 . 19 1 1 A 36 36 ILE CA C 36 60.967 60.340 0.627 1
1 406 . 19 1 1 A 36 36 ILE CB C 36 39.718 38.565 1.153 1
1 410 . 19 1 1 A 36 36 ILE N N 36 121.905 121.792 0.113 1
1 411 . 19 1 1 A 37 37 THR H H 37 9.076 8.747 0.329 1
1 412 . 19 1 1 A 37 37 THR HA H 37 4.364 4.495 -0.131 1
1 417 . 19 1 1 A 37 37 THR CA C 37 61.834 62.252 -0.418 1
1 418 . 19 1 1 A 37 37 THR CB C 37 69.237 70.168 -0.931 1
1 420 . 19 1 1 A 37 37 THR N N 37 122.500 123.599 -1.099 1
1 421 . 19 1 1 A 38 38 LEU H H 38 8.263 8.711 -0.448 1
1 422 . 19 1 1 A 38 38 LEU HA H 38 4.445 5.140 -0.695 1
1 432 . 19 1 1 A 38 38 LEU CA C 38 55.611 52.987 2.624 1
1 433 . 19 1 1 A 38 38 LEU CB C 38 42.702 45.875 -3.173 1
1 437 . 19 1 1 A 38 38 LEU N N 38 126.987 123.631 3.356 1
1 438 . 19 1 1 A 39 39 PHE H H 39 9.520 8.830 0.690 1
1 439 . 19 1 1 A 39 39 PHE HA H 39 4.998 5.157 -0.159 1
1 447 . 19 1 1 A 39 39 PHE CA C 39 57.331 56.375 0.956 1
1 448 . 19 1 1 A 39 39 PHE CB C 39 42.453 41.797 0.656 1
1 454 . 19 1 1 A 39 39 PHE N N 39 120.545 119.942 0.603 1
1 455 . 19 1 1 A 40 40 GLN H H 40 9.878 9.050 0.828 1
1 456 . 19 1 1 A 40 40 GLN HA H 40 4.376 4.046 0.330 1
1 463 . 19 1 1 A 40 40 GLN CA C 40 59.513 58.914 0.599 1
1 464 . 19 1 1 A 40 40 GLN CB C 40 29.317 28.782 0.535 1
1 467 . 19 1 1 A 41 41 ASN H H 41 7.732 8.058 -0.326 1
1 468 . 19 1 1 A 41 41 ASN HA H 41 4.812 5.581 -0.769 1
1 473 . 19 1 1 A 41 41 ASN CA C 41 52.618 51.805 0.813 1
1 474 . 19 1 1 A 41 41 ASN CB C 41 39.362 42.508 -3.146 1
1 475 . 19 1 1 A 41 41 ASN N N 41 107.613 114.529 -6.916 1
1 477 . 19 1 1 A 42 42 ASN HA H 42 3.476 4.012 -0.536 1
1 482 . 19 1 1 A 42 42 ASN C C 42 173.607 177.525 -3.918 1
1 483 . 19 1 1 A 42 42 ASN CA C 42 54.888 55.555 -0.667 1
1 484 . 19 1 1 A 42 42 ASN CB C 42 35.613 38.455 -2.842 1
1 486 . 19 1 1 A 43 43 THR H H 43 8.394 7.856 0.538 1
1 487 . 19 1 1 A 43 43 THR HA H 43 4.403 4.055 0.348 1
1 492 . 19 1 1 A 43 43 THR C C 43 174.464 174.973 -0.509 1
1 493 . 19 1 1 A 43 43 THR CA C 43 61.978 65.862 -3.884 1
1 494 . 19 1 1 A 43 43 THR CB C 43 70.036 68.359 1.677 1
1 496 . 19 1 1 A 43 43 THR N N 43 111.795 111.061 0.734 1
1 497 . 19 1 1 A 44 44 THR H H 44 8.058 7.571 0.487 1
1 498 . 19 1 1 A 44 44 THR HA H 44 4.464 4.316 0.148 1
1 503 . 19 1 1 A 44 44 THR CA C 44 61.599 62.595 -0.996 1
1 504 . 19 1 1 A 44 44 THR CB C 44 69.137 69.216 -0.079 1
1 506 . 19 1 1 A 44 44 THR N N 44 116.514 116.475 0.039 1
1 507 . 19 1 1 A 45 45 ASN H H 45 6.653 8.852 -2.199 1
1 508 . 19 1 1 A 45 45 ASN HA H 45 4.945 4.918 0.027 1
1 513 . 19 1 1 A 45 45 ASN CA C 45 53.227 55.041 -1.814 1
1 514 . 19 1 1 A 45 45 ASN CB C 45 38.483 39.338 -0.855 1
1 516 . 19 1 1 A 46 46 ARG H H 46 8.213 7.916 0.297 1
1 517 . 19 1 1 A 46 46 ARG HA H 46 4.583 4.592 -0.009 1
1 524 . 19 1 1 A 46 46 ARG CA C 46 55.487 56.208 -0.721 1
1 525 . 19 1 1 A 46 46 ARG CB C 46 31.153 31.312 -0.159 1
1 528 . 19 1 1 A 46 46 ARG N N 46 121.652 118.506 3.146 1
1 529 . 19 1 1 A 47 47 TYR H H 47 7.973 8.550 -0.577 1
1 536 . 19 1 1 A 47 47 TYR CB C 47 39.356 41.366 -2.010 1
1 541 . 19 1 1 A 48 48 TYR H H 48 9.023 9.009 0.014 1
1 542 . 19 1 1 A 48 48 TYR HA H 48 4.662 4.426 0.236 1
1 549 . 19 1 1 A 48 48 TYR CB C 48 39.863 40.809 -0.946 1
1 554 . 19 1 1 A 48 48 TYR N N 48 121.223 120.114 1.109 1
1 555 . 19 1 1 A 49 49 LYS H H 49 7.134 7.730 -0.596 1
1 556 . 19 1 1 A 49 49 LYS HA H 49 4.283 4.806 -0.523 1
1 565 . 19 1 1 A 49 49 LYS CA C 49 55.167 55.546 -0.379 1
1 566 . 19 1 1 A 49 49 LYS CB C 49 36.699 36.207 0.492 1
1 570 . 19 1 1 A 49 49 LYS N N 49 117.339 118.404 -1.065 1
1 571 . 19 1 1 A 50 50 GLU H H 50 8.411 9.194 -0.783 1
1 572 . 19 1 1 A 50 50 GLU HA H 50 4.583 4.905 -0.322 1
1 577 . 19 1 1 A 50 50 GLU CA C 50 54.592 55.104 -0.512 1
1 578 . 19 1 1 A 50 50 GLU CB C 50 33.263 32.149 1.114 1
1 580 . 19 1 1 A 50 50 GLU N N 50 123.825 125.397 -1.572 1
1 581 . 19 1 1 A 51 51 ILE H H 51 9.225 8.851 0.374 1
1 582 . 19 1 1 A 51 51 ILE HA H 51 4.277 4.557 -0.280 1
1 592 . 19 1 1 A 51 51 ILE CA C 51 58.182 58.194 -0.012 1
1 593 . 19 1 1 A 51 51 ILE CB C 51 39.663 38.404 1.259 1
1 597 . 19 1 1 A 51 51 ILE N N 51 125.271 126.624 -1.353 1
1 598 . 19 1 1 A 52 52 PRO HA H 52 4.543 4.635 -0.092 1
1 605 . 19 1 1 A 52 52 PRO C C 52 178.340 178.052 0.288 1
1 606 . 19 1 1 A 52 52 PRO CA C 52 62.726 62.885 -0.159 1
1 607 . 19 1 1 A 52 52 PRO CB C 52 32.003 31.744 0.259 1
1 610 . 19 1 1 A 53 53 LEU H H 53 8.723 8.511 0.212 1
1 611 . 19 1 1 A 53 53 LEU HA H 53 3.891 3.929 -0.038 1
1 621 . 19 1 1 A 53 53 LEU C C 53 179.673 178.887 0.786 1
1 622 . 19 1 1 A 53 53 LEU CA C 53 58.205 57.516 0.689 1
1 623 . 19 1 1 A 53 53 LEU CB C 53 40.171 41.665 -1.494 1
1 627 . 19 1 1 A 53 53 LEU N N 53 125.150 124.339 0.811 1
1 628 . 19 1 1 A 54 54 SER H H 54 8.360 8.026 0.334 1
1 629 . 19 1 1 A 54 54 SER HA H 54 4.164 4.117 0.047 1
1 632 . 19 1 1 A 54 54 SER C C 54 175.517 177.509 -1.992 1
1 633 . 19 1 1 A 54 54 SER CA C 54 60.193 61.404 -1.211 1
1 634 . 19 1 1 A 54 54 SER CB C 54 62.617 62.723 -0.106 1
1 635 . 19 1 1 A 54 54 SER N N 54 111.266 114.703 -3.437 1
1 636 . 19 1 1 A 55 55 GLU H H 55 7.666 7.955 -0.289 1
1 637 . 19 1 1 A 55 55 GLU HA H 55 4.363 4.034 0.329 1
1 642 . 19 1 1 A 55 55 GLU C C 55 176.753 177.898 -1.145 1
1 643 . 19 1 1 A 55 55 GLU CA C 55 56.200 59.129 -2.929 1
1 644 . 19 1 1 A 55 55 GLU CB C 55 30.526 29.306 1.220 1
1 646 . 19 1 1 A 55 55 GLU N N 55 119.485 120.206 -0.721 1
1 647 . 19 1 1 A 56 56 ILE H H 56 7.601 7.091 0.510 1
1 648 . 19 1 1 A 56 56 ILE HA H 56 3.793 3.925 -0.132 1
1 658 . 19 1 1 A 56 56 ILE C C 56 175.142 175.928 -0.786 1
1 659 . 19 1 1 A 56 56 ILE CA C 56 63.518 62.367 1.151 1
1 660 . 19 1 1 A 56 56 ILE CB C 56 37.169 37.963 -0.794 1
1 664 . 19 1 1 A 56 56 ILE N N 56 120.430 120.262 0.168 1
1 665 . 19 1 1 A 57 57 LEU H H 57 9.263 9.307 -0.044 1
1 666 . 19 1 1 A 57 57 LEU HA H 57 4.343 4.373 -0.030 1
1 676 . 19 1 1 A 57 57 LEU C C 57 177.898 176.553 1.345 1
1 677 . 19 1 1 A 57 57 LEU CA C 57 56.569 55.895 0.674 1
1 678 . 19 1 1 A 57 57 LEU CB C 57 41.980 42.477 -0.497 1
1 682 . 19 1 1 A 57 57 LEU N N 57 129.464 129.299 0.165 1
1 683 . 19 1 1 A 58 58 THR H H 58 7.414 7.384 0.030 1
1 684 . 19 1 1 A 58 58 THR HA H 58 4.512 4.895 -0.383 1
1 689 . 19 1 1 A 58 58 THR C C 58 171.314 172.752 -1.438 1
1 690 . 19 1 1 A 58 58 THR CA C 58 60.562 61.261 -0.699 1
1 691 . 19 1 1 A 58 58 THR CB C 58 70.803 73.535 -2.732 1
1 693 . 19 1 1 A 58 58 THR N N 58 109.129 110.819 -1.690 1
1 694 . 19 1 1 A 59 59 VAL H H 59 8.152 8.504 -0.352 1
1 695 . 19 1 1 A 59 59 VAL HA H 59 5.061 5.111 -0.050 1
1 703 . 19 1 1 A 59 59 VAL C C 59 174.985 175.018 -0.033 1
1 704 . 19 1 1 A 59 59 VAL CA C 59 61.354 61.216 0.138 1
1 705 . 19 1 1 A 59 59 VAL CB C 59 33.855 34.069 -0.214 1
1 708 . 19 1 1 A 59 59 VAL N N 59 123.676 124.851 -1.175 1
1 709 . 19 1 1 A 60 60 GLU H H 60 9.074 8.802 0.272 1
1 710 . 19 1 1 A 60 60 GLU HA H 60 4.977 4.869 0.108 1
1 715 . 19 1 1 A 60 60 GLU C C 60 176.063 174.948 1.115 1
1 716 . 19 1 1 A 60 60 GLU CA C 60 53.807 54.224 -0.417 1
1 717 . 19 1 1 A 60 60 GLU CB C 60 33.739 33.578 0.161 1
1 719 . 19 1 1 A 60 60 GLU N N 60 125.125 126.149 -1.024 1
1 720 . 19 1 1 A 61 61 SER H H 61 8.763 8.825 -0.062 1
1 721 . 19 1 1 A 61 61 SER HA H 61 4.452 5.032 -0.580 1
1 724 . 19 1 1 A 61 61 SER C C 61 173.288 174.027 -0.739 1
1 725 . 19 1 1 A 61 61 SER CA C 61 59.384 57.780 1.604 1
1 726 . 19 1 1 A 61 61 SER CB C 61 63.390 64.578 -1.188 1
1 727 . 19 1 1 A 61 61 SER N N 61 117.523 118.143 -0.620 1
1 728 . 19 1 1 A 62 62 ALA H H 62 7.293 8.845 -1.552 1
1 729 . 19 1 1 A 62 62 ALA HA H 62 3.817 4.238 -0.421 1
1 733 . 19 1 1 A 62 62 ALA C C 62 176.717 177.636 -0.919 1
1 734 . 19 1 1 A 62 62 ALA CA C 62 53.966 52.990 0.976 1
1 735 . 19 1 1 A 62 62 ALA CB C 62 18.640 18.803 -0.163 1
1 736 . 19 1 1 A 62 62 ALA N N 62 122.650 127.575 -4.925 1
1 737 . 19 1 1 A 63 63 GLN H H 63 8.736 8.517 0.219 1
1 738 . 19 1 1 A 63 63 GLN HA H 63 4.445 4.743 -0.298 1
1 745 . 19 1 1 A 63 63 GLN C C 63 173.700 174.898 -1.198 1
1 746 . 19 1 1 A 63 63 GLN CA C 63 56.376 55.726 0.650 1
1 747 . 19 1 1 A 63 63 GLN CB C 63 31.515 31.120 0.395 1
1 749 . 19 1 1 A 63 63 GLN N N 63 120.251 119.707 0.544 1
1 751 . 19 1 1 A 64 64 ASN H H 64 9.272 7.617 1.655 1
1 752 . 19 1 1 A 64 64 ASN HA H 64 4.906 5.060 -0.154 1
1 757 . 19 1 1 A 64 64 ASN C C 64 174.754 174.859 -0.105 1
1 758 . 19 1 1 A 64 64 ASN CA C 64 51.837 51.865 -0.028 1
1 759 . 19 1 1 A 64 64 ASN CB C 64 38.156 40.158 -2.002 1
1 760 . 19 1 1 A 64 64 ASN N N 64 122.346 118.461 3.885 1
1 762 . 19 1 1 A 65 65 PHE H H 65 8.854 9.085 -0.231 1
1 763 . 19 1 1 A 65 65 PHE HA H 65 4.947 5.163 -0.216 1
1 771 . 19 1 1 A 65 65 PHE C C 65 177.274 176.475 0.799 1
1 772 . 19 1 1 A 65 65 PHE CA C 65 57.519 57.188 0.331 1
1 773 . 19 1 1 A 65 65 PHE CB C 65 38.485 38.924 -0.439 1
1 779 . 19 1 1 A 65 65 PHE N N 65 123.638 125.686 -2.048 1
1 780 . 19 1 1 A 66 66 SER H H 66 8.163 8.145 0.018 1
1 781 . 19 1 1 A 66 66 SER HA H 66 4.393 4.293 0.100 1
1 784 . 19 1 1 A 66 66 SER C C 66 175.699 177.202 -1.503 1
1 785 . 19 1 1 A 66 66 SER CA C 66 60.791 61.212 -0.421 1
1 786 . 19 1 1 A 66 66 SER CB C 66 64.591 63.166 1.425 1
1 787 . 19 1 1 A 66 66 SER N N 66 113.913 116.292 -2.379 1
1 788 . 19 1 1 A 67 67 LEU H H 67 8.574 7.793 0.781 1
1 789 . 19 1 1 A 67 67 LEU HA H 67 4.302 3.791 0.511 1
1 799 . 19 1 1 A 67 67 LEU C C 67 176.269 177.354 -1.085 1
1 800 . 19 1 1 A 67 67 LEU CA C 67 55.601 58.215 -2.614 1
1 801 . 19 1 1 A 67 67 LEU CB C 67 42.021 41.861 0.160 1
1 805 . 19 1 1 A 67 67 LEU N N 67 121.264 121.112 0.152 1
1 806 . 19 1 1 A 68 68 VAL H H 68 6.921 7.575 -0.654 1
1 807 . 19 1 1 A 68 68 VAL HA H 68 4.473 4.169 0.304 1
1 815 . 19 1 1 A 68 68 VAL C C 68 173.809 174.932 -1.123 1
1 816 . 19 1 1 A 68 68 VAL CA C 68 58.047 60.810 -2.763 1
1 817 . 19 1 1 A 68 68 VAL CB C 68 32.295 31.835 0.460 1
1 820 . 19 1 1 A 68 68 VAL N N 68 111.287 115.719 -4.432 1
1 821 . 19 1 1 A 69 69 PRO HA H 69 4.658 4.633 0.025 1
1 828 . 19 1 1 A 69 69 PRO CA C 69 61.747 61.590 0.157 1
1 829 . 19 1 1 A 69 69 PRO CB C 69 30.693 32.411 -1.718 1
1 832 . 19 1 1 A 70 70 PRO HA H 70 4.414 4.371 0.043 1
1 839 . 19 1 1 A 70 70 PRO CA C 70 63.997 64.395 -0.398 1
1 840 . 19 1 1 A 70 70 PRO CB C 70 31.602 31.580 0.022 1
1 843 . 19 1 1 A 71 71 GLY H H 71 8.824 8.218 0.606 1
1 844 . 19 1 1 A 71 71 GLY HA2 H 71 3.703 3.997 -0.294 1
1 845 . 19 1 1 A 71 71 GLY HA3 H 71 4.193 4.001 0.192 1
1 846 . 19 1 1 A 71 71 GLY C C 71 174.052 172.984 1.068 1
1 847 . 19 1 1 A 71 71 GLY CA C 71 45.065 45.417 -0.352 1
1 848 . 19 1 1 A 71 71 GLY N N 71 111.845 106.147 5.698 1
1 849 . 19 1 1 A 72 72 THR H H 72 7.597 7.155 0.442 1
1 850 . 19 1 1 A 72 72 THR HA H 72 4.133 4.659 -0.526 1
1 855 . 19 1 1 A 72 72 THR CA C 72 63.129 60.817 2.312 1
1 856 . 19 1 1 A 72 72 THR CB C 72 69.560 71.625 -2.065 1
1 858 . 19 1 1 A 72 72 THR N N 72 117.485 114.351 3.134 1
1 859 . 19 1 1 A 73 73 ASN H H 73 9.280 8.488 0.792 1
1 860 . 19 1 1 A 73 73 ASN HA H 73 4.786 4.604 0.182 1
1 865 . 19 1 1 A 73 73 ASN CA C 73 52.009 52.207 -0.198 1
1 866 . 19 1 1 A 73 73 ASN CB C 73 37.553 38.300 -0.747 1
1 867 . 19 1 1 A 73 73 ASN N N 73 127.641 125.409 2.232 1
1 869 . 19 1 1 A 74 74 PRO HA H 74 4.752 4.867 -0.115 1
1 876 . 19 1 1 A 74 74 PRO C C 74 175.190 176.437 -1.247 1
1 877 . 19 1 1 A 74 74 PRO CA C 74 63.395 62.482 0.913 1
1 878 . 19 1 1 A 74 74 PRO CB C 74 33.164 33.209 -0.045 1
1 881 . 19 1 1 A 75 75 HIS H H 75 8.025 8.977 -0.952 1
1 882 . 19 1 1 A 75 75 HIS HA H 75 5.047 5.165 -0.118 1
1 887 . 19 1 1 A 75 75 HIS C C 75 172.562 175.800 -3.238 1
1 888 . 19 1 1 A 75 75 HIS CA C 75 54.336 53.750 0.586 1
1 889 . 19 1 1 A 75 75 HIS CB C 75 30.956 33.375 -2.419 1
1 892 . 19 1 1 A 75 75 HIS N N 75 116.198 116.648 -0.450 1
1 893 . 19 1 1 A 76 76 CYS H H 76 8.343 9.404 -1.061 1
1 894 . 19 1 1 A 76 76 CYS HA H 76 4.594 4.460 0.134 1
1 897 . 19 1 1 A 76 76 CYS C C 76 175.651 174.863 0.788 1
1 898 . 19 1 1 A 76 76 CYS CA C 76 61.066 61.507 -0.441 1
1 899 . 19 1 1 A 76 76 CYS CB C 76 30.193 27.918 2.275 1
1 900 . 19 1 1 A 76 76 CYS N N 76 113.289 118.184 -4.895 1
1 901 . 19 1 1 A 77 77 PHE H H 77 8.433 7.945 0.488 1
1 902 . 19 1 1 A 77 77 PHE HA H 77 5.105 5.443 -0.338 1
1 910 . 19 1 1 A 77 77 PHE C C 77 171.822 172.995 -1.173 1
1 911 . 19 1 1 A 77 77 PHE CA C 77 56.874 55.607 1.267 1
1 912 . 19 1 1 A 77 77 PHE CB C 77 39.393 42.733 -3.340 1
1 918 . 19 1 1 A 77 77 PHE N N 77 114.874 114.687 0.187 1
1 919 . 19 1 1 A 78 78 GLU H H 78 9.823 9.187 0.636 1
1 920 . 19 1 1 A 78 78 GLU HA H 78 5.333 5.166 0.167 1
1 925 . 19 1 1 A 78 78 GLU C C 78 175.602 175.462 0.140 1
1 926 . 19 1 1 A 78 78 GLU CA C 78 54.212 54.744 -0.532 1
1 927 . 19 1 1 A 78 78 GLU CB C 78 31.702 32.725 -1.023 1
1 929 . 19 1 1 A 78 78 GLU N N 78 121.074 118.677 2.397 1
1 930 . 19 1 1 A 79 79 ILE H H 79 9.093 9.002 0.091 1
1 931 . 19 1 1 A 79 79 ILE HA H 79 4.637 4.559 0.078 1
1 941 . 19 1 1 A 79 79 ILE C C 79 174.476 175.043 -0.567 1
1 942 . 19 1 1 A 79 79 ILE CA C 79 60.932 60.739 0.193 1
1 943 . 19 1 1 A 79 79 ILE CB C 79 40.803 37.439 3.364 1
1 947 . 19 1 1 A 79 79 ILE N N 79 121.382 125.028 -3.646 1
1 948 . 19 1 1 A 80 80 VAL H H 80 8.841 7.895 0.946 1
1 949 . 19 1 1 A 80 80 VAL HA H 80 4.425 3.867 0.558 1
1 957 . 19 1 1 A 80 80 VAL C C 80 175.930 175.348 0.582 1
1 958 . 19 1 1 A 80 80 VAL CA C 80 63.324 63.318 0.006 1
1 959 . 19 1 1 A 80 80 VAL CB C 80 32.783 31.285 1.498 1
1 962 . 19 1 1 A 80 80 VAL N N 80 128.970 126.920 2.050 1
1 963 . 19 1 1 A 81 81 THR H H 81 8.303 7.766 0.537 1
1 964 . 19 1 1 A 81 81 THR HA H 81 5.264 4.727 0.537 1
1 969 . 19 1 1 A 81 81 THR C C 81 173.664 174.320 -0.656 1
1 970 . 19 1 1 A 81 81 THR CA C 81 59.540 59.918 -0.378 1
1 971 . 19 1 1 A 81 81 THR CB C 81 72.197 70.935 1.262 1
1 973 . 19 1 1 A 81 81 THR N N 81 118.077 118.463 -0.386 1
1 974 . 19 1 1 A 82 82 ALA H H 82 9.586 8.462 1.124 1
1 975 . 19 1 1 A 82 82 ALA HA H 82 4.093 4.490 -0.397 1
1 979 . 19 1 1 A 82 82 ALA C C 82 178.667 177.717 0.950 1
1 980 . 19 1 1 A 82 82 ALA CA C 82 55.321 52.522 2.799 1
1 981 . 19 1 1 A 82 82 ALA CB C 82 18.094 18.789 -0.695 1
1 982 . 19 1 1 A 82 82 ALA N N 82 122.493 122.890 -0.397 1
1 983 . 19 1 1 A 83 83 ASN H H 83 7.923 8.461 -0.538 1
1 984 . 19 1 1 A 83 83 ASN HA H 83 4.808 5.115 -0.307 1
1 989 . 19 1 1 A 83 83 ASN C C 83 174.766 174.415 0.351 1
1 990 . 19 1 1 A 83 83 ASN CA C 83 53.333 54.795 -1.462 1
1 991 . 19 1 1 A 83 83 ASN CB C 83 40.335 41.820 -1.485 1
1 992 . 19 1 1 A 83 83 ASN N N 83 110.765 116.329 -5.564 1
1 994 . 19 1 1 A 84 84 ALA H H 84 7.352 7.209 0.143 1
1 995 . 19 1 1 A 84 84 ALA HA H 84 4.625 4.594 0.031 1
1 999 . 19 1 1 A 84 84 ALA C C 84 176.547 175.518 1.029 1
1 1000 . 19 1 1 A 84 84 ALA CA C 84 52.858 51.758 1.100 1
1 1001 . 19 1 1 A 84 84 ALA CB C 84 21.233 22.189 -0.956 1
1 1002 . 19 1 1 A 84 84 ALA N N 84 119.599 117.939 1.660 1
1 1003 . 19 1 1 A 85 85 THR H H 85 8.374 8.630 -0.256 1
1 1004 . 19 1 1 A 85 85 THR HA H 85 5.014 4.394 0.620 1
1 1009 . 19 1 1 A 85 85 THR C C 85 171.568 174.268 -2.700 1
1 1010 . 19 1 1 A 85 85 THR CA C 85 61.618 63.590 -1.972 1
1 1011 . 19 1 1 A 85 85 THR CB C 85 70.850 68.894 1.956 1
1 1013 . 19 1 1 A 85 85 THR N N 85 119.032 114.616 4.416 1
1 1014 . 19 1 1 A 86 86 TYR H H 86 9.006 9.044 -0.038 1
1 1015 . 19 1 1 A 86 86 TYR HA H 86 4.658 4.840 -0.182 1
1 1022 . 19 1 1 A 86 86 TYR C C 86 173.773 175.294 -1.521 1
1 1023 . 19 1 1 A 86 86 TYR CA C 86 56.938 57.654 -0.716 1
1 1024 . 19 1 1 A 86 86 TYR CB C 86 39.513 40.087 -0.574 1
1 1029 . 19 1 1 A 86 86 TYR N N 86 123.494 127.433 -3.939 1
1 1030 . 19 1 1 A 87 87 PHE H H 87 9.263 8.792 0.471 1
1 1031 . 19 1 1 A 87 87 PHE HA H 87 4.127 4.687 -0.560 1
1 1039 . 19 1 1 A 87 87 PHE C C 87 176.369 174.207 2.162 1
1 1040 . 19 1 1 A 87 87 PHE CA C 87 57.238 55.518 1.720 1
1 1041 . 19 1 1 A 87 87 PHE CB C 87 37.086 38.168 -1.082 1
1 1047 . 19 1 1 A 87 87 PHE N N 87 125.384 119.951 5.433 1
1 1048 . 19 1 1 A 88 88 VAL H H 88 9.023 8.288 0.735 1
1 1049 . 19 1 1 A 88 88 VAL HA H 88 4.162 4.809 -0.647 1
1 1057 . 19 1 1 A 88 88 VAL C C 88 176.390 175.738 0.652 1
1 1058 . 19 1 1 A 88 88 VAL CA C 88 63.975 60.694 3.281 1
1 1059 . 19 1 1 A 88 88 VAL CB C 88 32.378 32.102 0.276 1
1 1062 . 19 1 1 A 88 88 VAL N N 88 127.348 124.315 3.033 1
1 1063 . 19 1 1 A 89 89 GLY H H 89 9.233 7.995 1.238 1
1 1064 . 19 1 1 A 89 89 GLY HA2 H 89 4.293 4.247 0.046 1
1 1065 . 19 1 1 A 89 89 GLY HA3 H 89 4.186 4.319 -0.133 1
1 1066 . 19 1 1 A 89 89 GLY C C 89 172.378 172.139 0.239 1
1 1067 . 19 1 1 A 89 89 GLY CA C 89 43.798 46.212 -2.414 1
1 1068 . 19 1 1 A 89 89 GLY N N 89 116.041 112.543 3.498 1
1 1069 . 19 1 1 A 90 90 GLU H H 90 8.532 8.651 -0.119 1
1 1070 . 19 1 1 A 90 90 GLU HA H 90 4.794 4.959 -0.165 1
1 1075 . 19 1 1 A 90 90 GLU C C 90 174.221 174.320 -0.099 1
1 1076 . 19 1 1 A 90 90 GLU CA C 90 56.393 54.970 1.423 1
1 1077 . 19 1 1 A 90 90 GLU CB C 90 33.182 32.647 0.535 1
1 1079 . 19 1 1 A 90 90 GLU N N 90 120.905 118.828 2.077 1
1 1080 . 19 1 1 A 91 91 MET H H 91 8.450 8.598 -0.148 1
1 1081 . 19 1 1 A 91 91 MET HA H 91 4.904 5.180 -0.276 1
1 1089 . 19 1 1 A 91 91 MET C C 91 173.373 174.011 -0.638 1
1 1090 . 19 1 1 A 91 91 MET CA C 91 52.277 53.078 -0.801 1
1 1091 . 19 1 1 A 91 91 MET CB C 91 32.789 34.155 -1.366 1
1 1094 . 19 1 1 A 91 91 MET N N 91 125.173 118.921 6.252 1
1 1095 . 19 1 1 A 92 92 PRO HA H 92 4.358 4.373 -0.015 1
1 1102 . 19 1 1 A 92 92 PRO C C 92 177.589 176.733 0.856 1
1 1103 . 19 1 1 A 92 92 PRO CA C 92 63.143 63.649 -0.506 1
1 1104 . 19 1 1 A 92 92 PRO CB C 92 32.083 31.344 0.739 1
1 1107 . 19 1 1 A 93 93 GLY H H 93 8.330 8.550 -0.220 1
1 1108 . 19 1 1 A 93 93 GLY HA2 H 93 3.943 4.090 -0.147 1
1 1109 . 19 1 1 A 93 93 GLY HA3 H 93 4.045 4.093 -0.048 1
1 1110 . 19 1 1 A 93 93 GLY C C 93 174.730 175.102 -0.372 1
1 1111 . 19 1 1 A 93 93 GLY CA C 93 45.276 45.691 -0.415 1
1 1112 . 19 1 1 A 93 93 GLY N N 93 109.420 111.511 -2.091 1
1 1113 . 19 1 1 A 94 94 GLY H H 94 8.331 8.152 0.179 1
1 1114 . 19 1 1 A 94 94 GLY HA2 H 94 3.973 3.860 0.113 1
1 1115 . 19 1 1 A 94 94 GLY HA3 H 94 3.973 3.862 0.111 1
1 1116 . 19 1 1 A 94 94 GLY C C 94 174.100 174.555 -0.455 1
1 1117 . 19 1 1 A 94 94 GLY CA C 94 45.333 47.146 -1.813 1
1 1118 . 19 1 1 A 94 94 GLY N N 94 108.483 108.668 -0.185 1
1 1119 . 19 1 1 A 95 95 THR H H 95 8.095 7.697 0.398 1
1 1120 . 19 1 1 A 95 95 THR HA H 95 4.643 4.455 0.188 1
1 1125 . 19 1 1 A 95 95 THR C C 95 173.155 173.846 -0.691 1
1 1126 . 19 1 1 A 95 95 THR CA C 95 59.922 60.615 -0.693 1
1 1127 . 19 1 1 A 95 95 THR CB C 95 69.871 68.487 1.384 1
1 1129 . 19 1 1 A 95 95 THR N N 95 115.860 112.231 3.629 1
1 1130 . 19 1 1 A 96 96 PRO HA H 96 4.400 4.436 -0.036 1
1 1137 . 19 1 1 A 96 96 PRO C C 96 177.565 177.577 -0.012 1
1 1138 . 19 1 1 A 96 96 PRO CA C 96 64.047 62.973 1.074 1
1 1139 . 19 1 1 A 96 96 PRO CB C 96 31.816 29.790 2.026 1
1 1142 . 19 1 1 A 97 97 GLY H H 97 8.572 8.659 -0.087 1
1 1143 . 19 1 1 A 97 97 GLY HA2 H 97 4.007 4.062 -0.055 1
1 1144 . 19 1 1 A 97 97 GLY HA3 H 97 4.007 4.064 -0.057 1
1 1145 . 19 1 1 A 97 97 GLY C C 97 174.609 174.577 0.032 1
1 1146 . 19 1 1 A 97 97 GLY CA C 97 45.276 45.405 -0.129 1
1 1147 . 19 1 1 A 97 97 GLY N N 97 110.233 112.964 -2.731 1
1 1148 . 19 1 1 A 98 98 GLY H H 98 8.119 8.101 0.018 1
1 1149 . 19 1 1 A 98 98 GLY HA2 H 98 4.086 4.076 0.010 1
1 1150 . 19 1 1 A 98 98 GLY HA3 H 98 4.200 4.078 0.122 1
1 1151 . 19 1 1 A 98 98 GLY CA C 98 44.876 44.032 0.844 1
1 1152 . 19 1 1 A 98 98 GLY N N 98 108.845 108.082 0.763 1
1 1153 . 19 1 1 A 99 99 PRO HA H 99 4.494 4.409 0.085 1
1 1160 . 19 1 1 A 99 99 PRO C C 99 177.468 176.472 0.996 1
1 1161 . 19 1 1 A 99 99 PRO CA C 99 63.500 64.838 -1.338 1
1 1162 . 19 1 1 A 99 99 PRO CB C 99 32.013 32.112 -0.099 1
1 1165 . 19 1 1 A 100 100 SER H H 100 8.472 7.582 0.890 1
1 1166 . 19 1 1 A 100 100 SER HA H 100 4.513 4.801 -0.288 1
1 1169 . 19 1 1 A 100 100 SER C C 100 175.408 173.666 1.742 1
1 1170 . 19 1 1 A 100 100 SER CA C 100 58.557 57.679 0.878 1
1 1171 . 19 1 1 A 100 100 SER CB C 100 63.918 66.915 -2.997 1
1 1172 . 19 1 1 A 100 100 SER N N 100 116.038 112.626 3.412 1
1 1173 . 19 1 1 A 101 101 GLY H H 101 8.427 8.612 -0.185 1
1 1174 . 19 1 1 A 101 101 GLY HA2 H 101 4.064 3.998 0.066 1
1 1175 . 19 1 1 A 101 101 GLY HA3 H 101 4.064 4.017 0.047 1
1 1176 . 19 1 1 A 101 101 GLY C C 101 174.730 173.355 1.375 1
1 1177 . 19 1 1 A 101 101 GLY CA C 101 45.575 45.534 0.041 1
1 1178 . 19 1 1 A 101 101 GLY N N 101 110.558 110.896 -0.338 1
1 1179 . 19 1 1 A 102 102 GLN H H 102 8.416 7.720 0.696 1
1 1180 . 19 1 1 A 102 102 GLN HA H 102 4.383 4.824 -0.441 1
1 1187 . 19 1 1 A 102 102 GLN C C 102 177.346 174.243 3.103 1
1 1188 . 19 1 1 A 102 102 GLN CA C 102 57.080 55.439 1.641 1
1 1189 . 19 1 1 A 102 102 GLN CB C 102 29.235 32.283 -3.048 1
1 1191 . 19 1 1 A 102 102 GLN N N 102 120.112 118.291 1.821 1
1 1193 . 19 1 1 A 103 103 GLY H H 103 8.713 8.363 0.350 1
1 1194 . 19 1 1 A 103 103 GLY HA2 H 103 4.193 4.439 -0.246 1
1 1195 . 19 1 1 A 103 103 GLY HA3 H 103 4.078 4.456 -0.378 1
1 1196 . 19 1 1 A 103 103 GLY C C 103 175.602 174.034 1.568 1
1 1197 . 19 1 1 A 103 103 GLY CA C 103 46.120 45.406 0.714 1
1 1198 . 19 1 1 A 103 103 GLY N N 103 109.817 111.339 -1.522 1
1 1199 . 19 1 1 A 104 104 ALA H H 104 8.366 8.678 -0.312 1
1 1200 . 19 1 1 A 104 104 ALA HA H 104 4.449 4.363 0.086 1
1 1204 . 19 1 1 A 104 104 ALA C C 104 179.188 178.962 0.226 1
1 1205 . 19 1 1 A 104 104 ALA CA C 104 54.230 53.582 0.648 1
1 1206 . 19 1 1 A 104 104 ALA CB C 104 19.080 19.636 -0.556 1
1 1207 . 19 1 1 A 104 104 ALA N N 104 124.808 122.737 2.071 1
1 1208 . 19 1 1 A 105 105 GLU H H 105 8.576 8.268 0.308 1
1 1209 . 19 1 1 A 105 105 GLU HA H 105 4.161 4.096 0.065 1
1 1214 . 19 1 1 A 105 105 GLU C C 105 179.200 179.281 -0.081 1
1 1215 . 19 1 1 A 105 105 GLU CA C 105 59.173 59.212 -0.039 1
1 1216 . 19 1 1 A 105 105 GLU CB C 105 29.194 28.919 0.275 1
1 1218 . 19 1 1 A 105 105 GLU N N 105 119.238 117.903 1.335 1
1 1219 . 19 1 1 A 106 106 ALA H H 106 8.381 8.141 0.240 1
1 1220 . 19 1 1 A 106 106 ALA HA H 106 4.283 4.126 0.157 1
1 1224 . 19 1 1 A 106 106 ALA C C 106 180.048 179.764 0.284 1
1 1225 . 19 1 1 A 106 106 ALA CA C 106 54.687 55.549 -0.862 1
1 1226 . 19 1 1 A 106 106 ALA CB C 106 18.341 18.883 -0.542 1
1 1227 . 19 1 1 A 106 106 ALA N N 106 123.327 123.385 -0.058 1
1 1228 . 19 1 1 A 107 107 ALA H H 107 8.123 8.186 -0.063 1
1 1229 . 19 1 1 A 107 107 ALA HA H 107 4.554 4.380 0.174 1
1 1233 . 19 1 1 A 107 107 ALA C C 107 179.757 179.829 -0.072 1
1 1234 . 19 1 1 A 107 107 ALA CA C 107 55.355 55.528 -0.173 1
1 1235 . 19 1 1 A 107 107 ALA CB C 107 18.939 18.552 0.387 1
1 1236 . 19 1 1 A 107 107 ALA N N 107 120.740 120.487 0.253 1
1 1237 . 19 1 1 A 108 108 ARG H H 108 8.403 8.082 0.321 1
1 1238 . 19 1 1 A 108 108 ARG HA H 108 4.254 4.073 0.181 1
1 1245 . 19 1 1 A 108 108 ARG C C 108 179.111 179.593 -0.482 1
1 1246 . 19 1 1 A 108 108 ARG CA C 108 59.015 59.250 -0.235 1
1 1247 . 19 1 1 A 108 108 ARG CB C 108 29.752 30.009 -0.257 1
1 1250 . 19 1 1 A 108 108 ARG N N 108 119.531 118.031 1.500 1
1 1251 . 19 1 1 A 109 109 GLY H H 109 8.182 8.873 -0.691 1
1 1252 . 19 1 1 A 109 109 GLY HA2 H 109 3.822 3.660 0.162 1
1 1253 . 19 1 1 A 109 109 GLY HA3 H 109 3.822 3.683 0.139 1
1 1254 . 19 1 1 A 109 109 GLY C C 109 177.020 176.146 0.874 1
1 1255 . 19 1 1 A 109 109 GLY CA C 109 46.718 47.283 -0.565 1
1 1256 . 19 1 1 A 109 109 GLY N N 109 107.331 108.285 -0.954 1
1 1257 . 19 1 1 A 110 110 TRP H H 110 7.925 7.680 0.245 1
1 1258 . 19 1 1 A 110 110 TRP HA H 110 3.963 4.523 -0.560 1
1 1267 . 19 1 1 A 110 110 TRP C C 110 176.691 178.162 -1.471 1
1 1268 . 19 1 1 A 110 110 TRP CA C 110 62.041 59.971 2.070 1
1 1269 . 19 1 1 A 110 110 TRP CB C 110 28.989 29.557 -0.568 1
1 1275 . 19 1 1 A 110 110 TRP N N 110 122.304 122.159 0.145 1
1 1277 . 19 1 1 A 111 111 GLU H H 111 7.946 7.603 0.343 1
1 1278 . 19 1 1 A 111 111 GLU HA H 111 2.594 3.048 -0.454 1
1 1283 . 19 1 1 A 111 111 GLU C C 111 177.976 178.811 -0.835 1
1 1284 . 19 1 1 A 111 111 GLU CA C 111 60.193 58.921 1.272 1
1 1285 . 19 1 1 A 111 111 GLU CB C 111 29.277 29.333 -0.056 1
1 1287 . 19 1 1 A 111 111 GLU N N 111 121.755 119.063 2.692 1
1 1288 . 19 1 1 A 112 112 THR H H 112 7.993 7.774 0.219 1
1 1289 . 19 1 1 A 112 112 THR HA H 112 3.722 3.819 -0.097 1
1 1294 . 19 1 1 A 112 112 THR C C 112 176.038 175.918 0.120 1
1 1295 . 19 1 1 A 112 112 THR CA C 112 66.104 66.692 -0.588 1
1 1296 . 19 1 1 A 112 112 THR CB C 112 68.885 68.343 0.542 1
1 1298 . 19 1 1 A 112 112 THR N N 112 112.247 115.288 -3.041 1
1 1299 . 19 1 1 A 113 113 ALA H H 113 7.742 8.427 -0.685 1
1 1300 . 19 1 1 A 113 113 ALA HA H 113 4.029 3.975 0.054 1
1 1304 . 19 1 1 A 113 113 ALA C C 113 180.545 179.948 0.597 1
1 1305 . 19 1 1 A 113 113 ALA CA C 113 55.127 55.296 -0.169 1
1 1306 . 19 1 1 A 113 113 ALA CB C 113 18.854 18.454 0.400 1
1 1307 . 19 1 1 A 113 113 ALA N N 113 123.134 122.597 0.537 1
1 1308 . 19 1 1 A 114 114 ILE H H 114 8.472 8.436 0.036 1
1 1309 . 19 1 1 A 114 114 ILE HA H 114 3.613 3.752 -0.139 1
1 1319 . 19 1 1 A 114 114 ILE C C 114 176.947 178.151 -1.204 1
1 1320 . 19 1 1 A 114 114 ILE CA C 114 66.016 65.136 0.880 1
1 1321 . 19 1 1 A 114 114 ILE CB C 114 38.335 37.815 0.520 1
1 1325 . 19 1 1 A 114 114 ILE N N 114 118.276 117.806 0.470 1
1 1326 . 19 1 1 A 115 115 ARG H H 115 8.181 8.044 0.137 1
1 1327 . 19 1 1 A 115 115 ARG HA H 115 3.835 3.944 -0.109 1
1 1334 . 19 1 1 A 115 115 ARG C C 115 179.588 179.033 0.555 1
1 1335 . 19 1 1 A 115 115 ARG CA C 115 61.072 59.954 1.118 1
1 1336 . 19 1 1 A 115 115 ARG CB C 115 29.975 29.820 0.155 1
1 1339 . 19 1 1 A 115 115 ARG N N 115 117.921 119.356 -1.435 1
1 1340 . 19 1 1 A 116 116 GLN H H 116 8.395 8.354 0.041 1
1 1341 . 19 1 1 A 116 116 GLN HA H 116 4.030 4.016 0.014 1
1 1348 . 19 1 1 A 116 116 GLN C C 116 178.716 178.673 0.043 1
1 1349 . 19 1 1 A 116 116 GLN CA C 116 58.790 58.694 0.096 1
1 1350 . 19 1 1 A 116 116 GLN CB C 116 28.248 28.394 -0.146 1
1 1352 . 19 1 1 A 116 116 GLN N N 116 116.842 118.753 -1.911 1
1 1354 . 19 1 1 A 117 117 ALA H H 117 7.902 8.123 -0.221 1
1 1355 . 19 1 1 A 117 117 ALA HA H 117 4.143 4.092 0.051 1
1 1359 . 19 1 1 A 117 117 ALA C C 117 179.685 180.278 -0.593 1
1 1360 . 19 1 1 A 117 117 ALA CA C 117 54.476 54.145 0.331 1
1 1361 . 19 1 1 A 117 117 ALA CB C 117 18.300 18.281 0.019 1
1 1362 . 19 1 1 A 117 117 ALA N N 117 122.828 122.585 0.243 1
1 1363 . 19 1 1 A 118 118 LEU H H 118 7.904 7.982 -0.078 1
1 1364 . 19 1 1 A 118 118 LEU HA H 118 4.119 4.125 -0.006 1
1 1374 . 19 1 1 A 118 118 LEU C C 118 178.437 178.765 -0.328 1
1 1375 . 19 1 1 A 118 118 LEU CA C 118 56.781 56.966 -0.185 1
1 1376 . 19 1 1 A 118 118 LEU CB C 118 42.371 41.889 0.482 1
1 1380 . 19 1 1 A 118 118 LEU N N 118 117.632 120.284 -2.652 1
1 1381 . 19 1 1 A 119 119 MET H H 119 7.673 7.877 -0.204 1
1 1382 . 19 1 1 A 119 119 MET HA H 119 4.442 4.364 0.078 1
1 1390 . 19 1 1 A 119 119 MET C C 119 176.680 178.198 -1.518 1
1 1391 . 19 1 1 A 119 119 MET CA C 119 56.432 57.465 -1.033 1
1 1392 . 19 1 1 A 119 119 MET CB C 119 32.769 31.259 1.510 1
1 1395 . 19 1 1 A 119 119 MET N N 119 117.286 117.874 -0.588 1
1 1396 . 19 1 1 A 120 120 SER H H 120 7.878 7.880 -0.002 1
1 1397 . 19 1 1 A 120 120 SER HA H 120 4.500 4.310 0.190 1
1 1400 . 19 1 1 A 120 120 SER C C 120 174.742 174.701 0.041 1
1 1401 . 19 1 1 A 120 120 SER CA C 120 58.962 59.622 -0.660 1
1 1402 . 19 1 1 A 120 120 SER CB C 120 63.853 63.932 -0.079 1
1 1403 . 19 1 1 A 120 120 SER N N 120 115.064 114.117 0.947 1
1 1404 . 19 1 1 A 121 121 GLY H H 121 8.059 7.207 0.852 1
1 1405 . 19 1 1 A 121 121 GLY HA2 H 121 4.231 4.072 0.159 1
1 1406 . 19 1 1 A 121 121 GLY HA3 H 121 4.112 4.073 0.039 1
1 1407 . 19 1 1 A 121 121 GLY C C 121 172.065 173.796 -1.731 1
1 1408 . 19 1 1 A 121 121 GLY CA C 121 45.030 44.181 0.849 1
1 1409 . 19 1 1 A 121 121 GLY N N 121 110.271 107.187 3.084 1
1 1410 . 19 1 1 A 122 122 PRO HA H 122 4.496 4.502 -0.006 1
1 1417 . 19 1 1 A 122 122 PRO CA C 122 63.399 63.301 0.098 1
1 1418 . 19 1 1 A 122 122 PRO CB C 122 32.186 32.085 0.101 1
1 1 . 20 1 1 A 6 6 SER H H 6 8.337 7.685 0.652 1
1 2 . 20 1 1 A 6 6 SER HA H 6 4.597 4.808 -0.211 1
1 5 . 20 1 1 A 6 6 SER C C 6 174.637 174.199 0.438 1
1 6 . 20 1 1 A 6 6 SER CA C 6 58.469 56.617 1.852 1
1 7 . 20 1 1 A 6 6 SER CB C 6 64.221 65.102 -0.881 1
1 8 . 20 1 1 A 6 6 SER N N 6 117.887 119.039 -1.152 1
1 9 . 20 1 1 A 7 7 GLY H H 7 8.280 8.707 -0.427 1
1 10 . 20 1 1 A 7 7 GLY HA2 H 7 4.063 3.916 0.147 1
1 11 . 20 1 1 A 7 7 GLY HA3 H 7 4.063 3.918 0.145 1
1 12 . 20 1 1 A 7 7 GLY C C 7 173.724 174.133 -0.409 1
1 13 . 20 1 1 A 7 7 GLY CA C 7 44.941 45.528 -0.587 1
1 14 . 20 1 1 A 7 7 GLY N N 7 110.151 115.116 -4.965 1
1 15 . 20 1 1 A 8 8 THR H H 8 8.212 7.737 0.475 1
1 16 . 20 1 1 A 8 8 THR HA H 8 4.173 4.448 -0.275 1
1 21 . 20 1 1 A 8 8 THR C C 8 174.723 174.723 0.000 1
1 22 . 20 1 1 A 8 8 THR CA C 8 63.622 63.714 -0.092 1
1 23 . 20 1 1 A 8 8 THR CB C 8 69.460 68.636 0.824 1
1 25 . 20 1 1 A 8 8 THR N N 8 116.817 115.715 1.102 1
1 26 . 20 1 1 A 9 9 LEU H H 9 9.374 8.863 0.511 1
1 27 . 20 1 1 A 9 9 LEU HA H 9 4.302 4.031 0.271 1
1 37 . 20 1 1 A 9 9 LEU C C 9 177.468 176.447 1.021 1
1 38 . 20 1 1 A 9 9 LEU CA C 9 55.936 57.905 -1.969 1
1 39 . 20 1 1 A 9 9 LEU CB C 9 42.843 42.107 0.736 1
1 43 . 20 1 1 A 9 9 LEU N N 9 127.798 128.838 -1.040 1
1 44 . 20 1 1 A 10 10 ARG H H 10 7.512 7.878 -0.366 1
1 45 . 20 1 1 A 10 10 ARG HA H 10 4.199 4.768 -0.569 1
1 52 . 20 1 1 A 10 10 ARG C C 10 172.501 174.526 -2.025 1
1 53 . 20 1 1 A 10 10 ARG CA C 10 56.165 54.028 2.137 1
1 54 . 20 1 1 A 10 10 ARG CB C 10 32.442 33.461 -1.019 1
1 57 . 20 1 1 A 10 10 ARG N N 10 117.979 116.787 1.192 1
1 58 . 20 1 1 A 11 11 GLU H H 11 8.434 8.506 -0.072 1
1 59 . 20 1 1 A 11 11 GLU HA H 11 5.993 5.472 0.521 1
1 64 . 20 1 1 A 11 11 GLU C C 11 174.800 175.112 -0.312 1
1 65 . 20 1 1 A 11 11 GLU CA C 11 54.570 55.316 -0.746 1
1 66 . 20 1 1 A 11 11 GLU CB C 11 34.245 33.889 0.356 1
1 68 . 20 1 1 A 11 11 GLU N N 11 120.782 123.967 -3.185 1
1 69 . 20 1 1 A 12 12 GLY H H 12 8.131 7.668 0.463 1
1 70 . 20 1 1 A 12 12 GLY HA2 H 12 4.714 3.549 1.165 1
1 71 . 20 1 1 A 12 12 GLY HA3 H 12 3.763 4.133 -0.370 1
1 72 . 20 1 1 A 12 12 GLY C C 12 171.060 172.648 -1.588 1
1 73 . 20 1 1 A 12 12 GLY CA C 12 45.241 44.420 0.821 1
1 74 . 20 1 1 A 12 12 GLY N N 12 107.457 107.655 -0.198 1
1 75 . 20 1 1 A 13 13 TRP H H 13 8.783 8.521 0.262 1
1 76 . 20 1 1 A 13 13 TRP HA H 13 5.152 5.176 -0.024 1
1 85 . 20 1 1 A 13 13 TRP C C 13 177.528 176.574 0.954 1
1 86 . 20 1 1 A 13 13 TRP CA C 13 57.783 58.701 -0.918 1
1 87 . 20 1 1 A 13 13 TRP CB C 13 30.222 30.177 0.045 1
1 93 . 20 1 1 A 13 13 TRP N N 13 120.792 121.579 -0.787 1
1 95 . 20 1 1 A 14 14 VAL H H 14 9.179 9.166 0.013 1
1 96 . 20 1 1 A 14 14 VAL HA H 14 4.072 4.633 -0.561 1
1 104 . 20 1 1 A 14 14 VAL C C 14 174.981 173.507 1.474 1
1 105 . 20 1 1 A 14 14 VAL CA C 14 61.741 60.133 1.608 1
1 106 . 20 1 1 A 14 14 VAL CB C 14 35.143 35.211 -0.068 1
1 109 . 20 1 1 A 14 14 VAL N N 14 125.476 122.931 2.545 1
1 110 . 20 1 1 A 15 15 VAL H H 15 8.403 8.872 -0.469 1
1 111 . 20 1 1 A 15 15 VAL HA H 15 5.532 5.206 0.326 1
1 119 . 20 1 1 A 15 15 VAL C C 15 175.078 174.412 0.666 1
1 120 . 20 1 1 A 15 15 VAL CA C 15 59.489 59.716 -0.227 1
1 121 . 20 1 1 A 15 15 VAL CB C 15 34.210 34.799 -0.589 1
1 124 . 20 1 1 A 15 15 VAL N N 15 126.189 126.452 -0.263 1
1 125 . 20 1 1 A 16 16 HIS H H 16 9.122 9.030 0.092 1
1 126 . 20 1 1 A 16 16 HIS HA H 16 5.823 5.660 0.163 1
1 131 . 20 1 1 A 16 16 HIS C C 16 172.998 172.587 0.411 1
1 132 . 20 1 1 A 16 16 HIS CA C 16 56.253 54.080 2.173 1
1 133 . 20 1 1 A 16 16 HIS CB C 16 34.273 32.766 1.507 1
1 136 . 20 1 1 A 16 16 HIS N N 16 121.152 120.759 0.393 1
1 137 . 20 1 1 A 17 17 TYR H H 17 8.465 8.572 -0.107 1
1 138 . 20 1 1 A 17 17 TYR HA H 17 5.096 4.723 0.373 1
1 145 . 20 1 1 A 17 17 TYR C C 17 173.640 172.847 0.793 1
1 146 . 20 1 1 A 17 17 TYR CA C 17 56.903 56.349 0.554 1
1 147 . 20 1 1 A 17 17 TYR CB C 17 40.103 40.587 -0.484 1
1 152 . 20 1 1 A 17 17 TYR N N 17 115.558 116.693 -1.135 1
1 153 . 20 1 1 A 18 18 SER H H 18 9.122 8.639 0.483 1
1 154 . 20 1 1 A 18 18 SER HA H 18 6.144 5.302 0.842 1
1 157 . 20 1 1 A 18 18 SER C C 18 173.204 175.830 -2.626 1
1 158 . 20 1 1 A 18 18 SER CA C 18 56.640 56.604 0.036 1
1 159 . 20 1 1 A 18 18 SER CB C 18 68.788 66.206 2.582 1
1 160 . 20 1 1 A 18 18 SER N N 18 118.846 116.050 2.796 1
1 161 . 20 1 1 A 19 19 ASN H H 19 9.053 8.937 0.116 1
1 162 . 20 1 1 A 19 19 ASN HA H 19 4.473 4.759 -0.286 1
1 167 . 20 1 1 A 19 19 ASN C C 19 175.396 174.697 0.699 1
1 168 . 20 1 1 A 19 19 ASN CA C 19 55.373 52.847 2.526 1
1 169 . 20 1 1 A 19 19 ASN CB C 19 36.900 37.832 -0.932 1
1 170 . 20 1 1 A 19 19 ASN N N 19 113.712 117.602 -3.890 1
1 172 . 20 1 1 A 20 20 LYS H H 20 7.677 7.868 -0.191 1
1 173 . 20 1 1 A 20 20 LYS HA H 20 4.413 4.404 0.009 1
1 182 . 20 1 1 A 20 20 LYS C C 20 176.078 177.472 -1.394 1
1 183 . 20 1 1 A 20 20 LYS CA C 20 55.679 56.790 -1.111 1
1 184 . 20 1 1 A 20 20 LYS CB C 20 33.023 34.822 -1.799 1
1 188 . 20 1 1 A 20 20 LYS N N 20 117.213 117.981 -0.768 1
1 189 . 20 1 1 A 21 21 ASP H H 21 7.395 7.865 -0.470 1
1 190 . 20 1 1 A 21 21 ASP HA H 21 4.808 4.763 0.045 1
1 193 . 20 1 1 A 21 21 ASP C C 21 176.413 176.280 0.133 1
1 194 . 20 1 1 A 21 21 ASP CA C 21 53.983 53.939 0.044 1
1 195 . 20 1 1 A 21 21 ASP CB C 21 41.199 42.945 -1.746 1
1 196 . 20 1 1 A 21 21 ASP N N 21 119.879 116.317 3.562 1
1 197 . 20 1 1 A 22 22 THR H H 22 8.593 7.856 0.737 1
1 198 . 20 1 1 A 22 22 THR HA H 22 4.352 4.233 0.119 1
1 203 . 20 1 1 A 22 22 THR C C 22 172.913 174.877 -1.964 1
1 204 . 20 1 1 A 22 22 THR CA C 22 62.691 62.972 -0.281 1
1 205 . 20 1 1 A 22 22 THR CB C 22 68.332 66.449 1.883 1
1 207 . 20 1 1 A 22 22 THR N N 22 116.299 112.902 3.397 1
1 208 . 20 1 1 A 23 23 LEU H H 23 7.645 7.924 -0.279 1
1 209 . 20 1 1 A 23 23 LEU HA H 23 4.318 4.311 0.007 1
1 219 . 20 1 1 A 23 23 LEU C C 23 176.692 176.510 0.182 1
1 220 . 20 1 1 A 23 23 LEU CA C 23 54.617 54.009 0.608 1
1 221 . 20 1 1 A 23 23 LEU CB C 23 41.939 41.305 0.634 1
1 225 . 20 1 1 A 23 23 LEU N N 23 123.606 121.601 2.005 1
1 226 . 20 1 1 A 24 24 ARG H H 24 8.563 7.627 0.936 1
1 227 . 20 1 1 A 24 24 ARG HA H 24 4.373 4.478 -0.105 1
1 235 . 20 1 1 A 24 24 ARG C C 24 176.584 176.095 0.489 1
1 236 . 20 1 1 A 24 24 ARG CA C 24 57.854 56.402 1.452 1
1 237 . 20 1 1 A 24 24 ARG CB C 24 31.126 30.640 0.486 1
1 240 . 20 1 1 A 24 24 ARG N N 24 127.152 124.239 2.913 1
1 242 . 20 1 1 A 25 25 LYS H H 25 8.633 8.426 0.207 1
1 243 . 20 1 1 A 25 25 LYS HA H 25 4.513 4.903 -0.390 1
1 251 . 20 1 1 A 25 25 LYS C C 25 173.567 174.542 -0.975 1
1 252 . 20 1 1 A 25 25 LYS CA C 25 54.792 54.279 0.513 1
1 253 . 20 1 1 A 25 25 LYS CB C 25 37.416 35.385 2.031 1
1 257 . 20 1 1 A 25 25 LYS N N 25 122.682 120.633 2.049 1
1 258 . 20 1 1 A 26 26 ARG H H 26 8.303 8.861 -0.558 1
1 259 . 20 1 1 A 26 26 ARG HA H 26 5.153 5.139 0.014 1
1 266 . 20 1 1 A 26 26 ARG C C 26 174.554 175.064 -0.510 1
1 267 . 20 1 1 A 26 26 ARG CA C 26 55.083 55.032 0.051 1
1 268 . 20 1 1 A 26 26 ARG CB C 26 32.789 31.424 1.365 1
1 271 . 20 1 1 A 26 26 ARG N N 26 121.819 125.182 -3.363 1
1 272 . 20 1 1 A 27 27 HIS H H 27 8.793 9.101 -0.308 1
1 273 . 20 1 1 A 27 27 HIS HA H 27 5.155 5.532 -0.377 1
1 278 . 20 1 1 A 27 27 HIS CA C 27 56.904 54.989 1.915 1
1 279 . 20 1 1 A 27 27 HIS CB C 27 34.683 31.559 3.124 1
1 282 . 20 1 1 A 27 27 HIS N N 27 122.102 120.290 1.812 1
1 283 . 20 1 1 A 28 28 TYR H H 28 9.273 8.327 0.946 1
1 284 . 20 1 1 A 28 28 TYR HA H 28 4.332 4.377 -0.045 1
1 291 . 20 1 1 A 28 28 TYR C C 28 174.730 175.260 -0.530 1
1 292 . 20 1 1 A 28 28 TYR CA C 28 58.680 57.383 1.297 1
1 293 . 20 1 1 A 28 28 TYR CB C 28 38.673 37.963 0.710 1
1 298 . 20 1 1 A 28 28 TYR N N 28 125.605 121.567 4.038 1
1 299 . 20 1 1 A 29 29 TRP H H 29 9.273 8.965 0.308 1
1 300 . 20 1 1 A 29 29 TRP HA H 29 5.543 4.833 0.710 1
1 309 . 20 1 1 A 29 29 TRP C C 29 176.172 176.492 -0.320 1
1 310 . 20 1 1 A 29 29 TRP CA C 29 56.658 56.865 -0.207 1
1 311 . 20 1 1 A 29 29 TRP CB C 29 32.154 30.381 1.773 1
1 317 . 20 1 1 A 29 29 TRP N N 29 131.340 128.177 3.163 1
1 318 . 20 1 1 A 30 30 ARG H H 30 9.164 8.793 0.371 1
1 319 . 20 1 1 A 30 30 ARG HA H 30 5.302 5.496 -0.194 1
1 327 . 20 1 1 A 30 30 ARG C C 30 174.774 174.445 0.329 1
1 328 . 20 1 1 A 30 30 ARG CA C 30 56.271 54.986 1.285 1
1 329 . 20 1 1 A 30 30 ARG CB C 30 34.203 33.944 0.259 1
1 332 . 20 1 1 A 30 30 ARG N N 30 116.040 120.556 -4.516 1
1 334 . 20 1 1 A 31 31 LEU H H 31 9.273 9.689 -0.416 1
1 335 . 20 1 1 A 31 31 LEU HA H 31 5.324 5.357 -0.033 1
1 345 . 20 1 1 A 31 31 LEU C C 31 174.488 174.600 -0.112 1
1 346 . 20 1 1 A 31 31 LEU CA C 31 53.807 53.445 0.362 1
1 347 . 20 1 1 A 31 31 LEU CB C 31 46.667 45.890 0.777 1
1 351 . 20 1 1 A 31 31 LEU N N 31 127.075 127.206 -0.131 1
1 352 . 20 1 1 A 32 32 ASP H H 32 8.854 8.541 0.313 1
1 353 . 20 1 1 A 32 32 ASP HA H 32 4.902 5.059 -0.157 1
1 356 . 20 1 1 A 32 32 ASP C C 32 173.474 175.984 -2.510 1
1 357 . 20 1 1 A 32 32 ASP CA C 32 53.104 52.651 0.453 1
1 358 . 20 1 1 A 32 32 ASP CB C 32 42.931 44.320 -1.389 1
1 359 . 20 1 1 A 32 32 ASP N N 32 129.349 124.185 5.164 1
1 360 . 20 1 1 A 33 33 CYS H H 33 8.153 8.877 -0.724 1
1 361 . 20 1 1 A 33 33 CYS HA H 33 4.323 4.462 -0.139 1
1 364 . 20 1 1 A 33 33 CYS C C 33 174.476 174.376 0.100 1
1 365 . 20 1 1 A 33 33 CYS CA C 33 59.853 59.728 0.125 1
1 366 . 20 1 1 A 33 33 CYS CB C 33 27.508 26.711 0.797 1
1 367 . 20 1 1 A 33 33 CYS N N 33 108.439 121.245 -12.806 1
1 368 . 20 1 1 A 34 34 LYS H H 34 9.144 7.774 1.370 1
1 369 . 20 1 1 A 34 34 LYS HA H 34 4.616 4.455 0.161 1
1 378 . 20 1 1 A 34 34 LYS C C 34 177.601 176.358 1.243 1
1 379 . 20 1 1 A 34 34 LYS CA C 34 57.185 56.857 0.328 1
1 380 . 20 1 1 A 34 34 LYS CB C 34 35.623 35.081 0.542 1
1 384 . 20 1 1 A 34 34 LYS N N 34 119.884 118.430 1.454 1
1 385 . 20 1 1 A 35 35 CYS H H 35 9.102 7.752 1.350 1
1 386 . 20 1 1 A 35 35 CYS HA H 35 4.935 4.788 0.147 1
1 389 . 20 1 1 A 35 35 CYS C C 35 172.283 172.288 -0.005 1
1 390 . 20 1 1 A 35 35 CYS CA C 35 57.748 56.865 0.883 1
1 391 . 20 1 1 A 35 35 CYS CB C 35 31.537 30.496 1.041 1
1 392 . 20 1 1 A 35 35 CYS N N 35 120.317 113.875 6.442 1
1 393 . 20 1 1 A 36 36 ILE H H 36 8.213 8.959 -0.746 1
1 394 . 20 1 1 A 36 36 ILE HA H 36 4.617 4.830 -0.213 1
1 404 . 20 1 1 A 36 36 ILE C C 36 175.312 175.060 0.252 1
1 405 . 20 1 1 A 36 36 ILE CA C 36 60.967 60.453 0.514 1
1 406 . 20 1 1 A 36 36 ILE CB C 36 39.718 38.659 1.059 1
1 410 . 20 1 1 A 36 36 ILE N N 36 121.905 120.147 1.758 1
1 411 . 20 1 1 A 37 37 THR H H 37 9.076 8.915 0.161 1
1 412 . 20 1 1 A 37 37 THR HA H 37 4.364 4.446 -0.082 1
1 417 . 20 1 1 A 37 37 THR CA C 37 61.834 62.410 -0.576 1
1 418 . 20 1 1 A 37 37 THR CB C 37 69.237 69.977 -0.740 1
1 420 . 20 1 1 A 37 37 THR N N 37 122.500 123.441 -0.941 1
1 421 . 20 1 1 A 38 38 LEU H H 38 8.263 8.308 -0.045 1
1 422 . 20 1 1 A 38 38 LEU HA H 38 4.445 5.045 -0.600 1
1 432 . 20 1 1 A 38 38 LEU CA C 38 55.611 53.747 1.864 1
1 433 . 20 1 1 A 38 38 LEU CB C 38 42.702 44.242 -1.540 1
1 437 . 20 1 1 A 38 38 LEU N N 38 126.987 124.926 2.061 1
1 438 . 20 1 1 A 39 39 PHE H H 39 9.520 9.076 0.444 1
1 439 . 20 1 1 A 39 39 PHE HA H 39 4.998 5.090 -0.092 1
1 447 . 20 1 1 A 39 39 PHE CA C 39 57.331 56.308 1.023 1
1 448 . 20 1 1 A 39 39 PHE CB C 39 42.453 41.310 1.143 1
1 454 . 20 1 1 A 39 39 PHE N N 39 120.545 121.567 -1.022 1
1 455 . 20 1 1 A 40 40 GLN H H 40 9.878 8.924 0.954 1
1 456 . 20 1 1 A 40 40 GLN HA H 40 4.376 4.238 0.138 1
1 463 . 20 1 1 A 40 40 GLN CA C 40 59.513 59.499 0.014 1
1 464 . 20 1 1 A 40 40 GLN CB C 40 29.317 28.852 0.465 1
1 467 . 20 1 1 A 41 41 ASN H H 41 7.732 8.137 -0.405 1
1 468 . 20 1 1 A 41 41 ASN HA H 41 4.812 5.345 -0.533 1
1 473 . 20 1 1 A 41 41 ASN CA C 41 52.618 51.847 0.771 1
1 474 . 20 1 1 A 41 41 ASN CB C 41 39.362 42.279 -2.917 1
1 475 . 20 1 1 A 41 41 ASN N N 41 107.613 115.997 -8.384 1
1 477 . 20 1 1 A 42 42 ASN HA H 42 3.476 3.536 -0.060 1
1 482 . 20 1 1 A 42 42 ASN C C 42 173.607 175.527 -1.920 1
1 483 . 20 1 1 A 42 42 ASN CA C 42 54.888 55.191 -0.303 1
1 484 . 20 1 1 A 42 42 ASN CB C 42 35.613 37.300 -1.687 1
1 486 . 20 1 1 A 43 43 THR H H 43 8.394 7.933 0.461 1
1 487 . 20 1 1 A 43 43 THR HA H 43 4.403 4.539 -0.136 1
1 492 . 20 1 1 A 43 43 THR C C 43 174.464 173.199 1.265 1
1 493 . 20 1 1 A 43 43 THR CA C 43 61.978 60.857 1.121 1
1 494 . 20 1 1 A 43 43 THR CB C 43 70.036 69.835 0.201 1
1 496 . 20 1 1 A 43 43 THR N N 43 111.795 113.579 -1.784 1
1 497 . 20 1 1 A 44 44 THR H H 44 8.058 7.661 0.397 1
1 498 . 20 1 1 A 44 44 THR HA H 44 4.464 4.608 -0.144 1
1 503 . 20 1 1 A 44 44 THR CA C 44 61.599 61.347 0.252 1
1 504 . 20 1 1 A 44 44 THR CB C 44 69.137 69.687 -0.550 1
1 506 . 20 1 1 A 44 44 THR N N 44 116.514 118.464 -1.950 1
1 507 . 20 1 1 A 45 45 ASN H H 45 6.653 9.128 -2.475 1
1 508 . 20 1 1 A 45 45 ASN HA H 45 4.945 4.347 0.598 1
1 513 . 20 1 1 A 45 45 ASN CA C 45 53.227 57.032 -3.805 1
1 514 . 20 1 1 A 45 45 ASN CB C 45 38.483 38.762 -0.279 1
1 516 . 20 1 1 A 46 46 ARG H H 46 8.213 7.979 0.234 1
1 517 . 20 1 1 A 46 46 ARG HA H 46 4.583 4.878 -0.295 1
1 524 . 20 1 1 A 46 46 ARG CA C 46 55.487 54.784 0.703 1
1 525 . 20 1 1 A 46 46 ARG CB C 46 31.153 31.846 -0.693 1
1 528 . 20 1 1 A 46 46 ARG N N 46 121.652 117.858 3.794 1
1 529 . 20 1 1 A 47 47 TYR H H 47 7.973 8.545 -0.572 1
1 536 . 20 1 1 A 47 47 TYR CB C 47 39.356 40.776 -1.420 1
1 541 . 20 1 1 A 48 48 TYR H H 48 9.023 8.534 0.489 1
1 542 . 20 1 1 A 48 48 TYR HA H 48 4.662 3.935 0.727 1
1 549 . 20 1 1 A 48 48 TYR CB C 48 39.863 39.359 0.504 1
1 554 . 20 1 1 A 48 48 TYR N N 48 121.223 121.660 -0.437 1
1 555 . 20 1 1 A 49 49 LYS H H 49 7.134 7.629 -0.495 1
1 556 . 20 1 1 A 49 49 LYS HA H 49 4.283 4.603 -0.320 1
1 565 . 20 1 1 A 49 49 LYS CA C 49 55.167 54.923 0.244 1
1 566 . 20 1 1 A 49 49 LYS CB C 49 36.699 35.573 1.126 1
1 570 . 20 1 1 A 49 49 LYS N N 49 117.339 114.371 2.968 1
1 571 . 20 1 1 A 50 50 GLU H H 50 8.411 8.550 -0.139 1
1 572 . 20 1 1 A 50 50 GLU HA H 50 4.583 5.047 -0.464 1
1 577 . 20 1 1 A 50 50 GLU CA C 50 54.592 54.637 -0.045 1
1 578 . 20 1 1 A 50 50 GLU CB C 50 33.263 32.935 0.328 1
1 580 . 20 1 1 A 50 50 GLU N N 50 123.825 119.122 4.703 1
1 581 . 20 1 1 A 51 51 ILE H H 51 9.225 9.078 0.147 1
1 582 . 20 1 1 A 51 51 ILE HA H 51 4.277 4.615 -0.338 1
1 592 . 20 1 1 A 51 51 ILE CA C 51 58.182 58.111 0.071 1
1 593 . 20 1 1 A 51 51 ILE CB C 51 39.663 38.502 1.161 1
1 597 . 20 1 1 A 51 51 ILE N N 51 125.271 127.081 -1.810 1
1 598 . 20 1 1 A 52 52 PRO HA H 52 4.543 4.665 -0.122 1
1 605 . 20 1 1 A 52 52 PRO C C 52 178.340 178.133 0.207 1
1 606 . 20 1 1 A 52 52 PRO CA C 52 62.726 62.952 -0.226 1
1 607 . 20 1 1 A 52 52 PRO CB C 52 32.003 31.857 0.146 1
1 610 . 20 1 1 A 53 53 LEU H H 53 8.723 8.524 0.199 1
1 611 . 20 1 1 A 53 53 LEU HA H 53 3.891 3.896 -0.005 1
1 621 . 20 1 1 A 53 53 LEU C C 53 179.673 178.972 0.701 1
1 622 . 20 1 1 A 53 53 LEU CA C 53 58.205 57.541 0.664 1
1 623 . 20 1 1 A 53 53 LEU CB C 53 40.171 41.422 -1.251 1
1 627 . 20 1 1 A 53 53 LEU N N 53 125.150 124.140 1.010 1
1 628 . 20 1 1 A 54 54 SER H H 54 8.360 8.321 0.039 1
1 629 . 20 1 1 A 54 54 SER HA H 54 4.164 4.124 0.040 1
1 632 . 20 1 1 A 54 54 SER C C 54 175.517 177.377 -1.860 1
1 633 . 20 1 1 A 54 54 SER CA C 54 60.193 61.381 -1.188 1
1 634 . 20 1 1 A 54 54 SER CB C 54 62.617 62.321 0.296 1
1 635 . 20 1 1 A 54 54 SER N N 54 111.266 113.594 -2.328 1
1 636 . 20 1 1 A 55 55 GLU H H 55 7.666 7.904 -0.238 1
1 637 . 20 1 1 A 55 55 GLU HA H 55 4.363 4.241 0.122 1
1 642 . 20 1 1 A 55 55 GLU C C 55 176.753 177.792 -1.039 1
1 643 . 20 1 1 A 55 55 GLU CA C 55 56.200 58.840 -2.640 1
1 644 . 20 1 1 A 55 55 GLU CB C 55 30.526 29.430 1.096 1
1 646 . 20 1 1 A 55 55 GLU N N 55 119.485 119.531 -0.046 1
1 647 . 20 1 1 A 56 56 ILE H H 56 7.601 6.921 0.680 1
1 648 . 20 1 1 A 56 56 ILE HA H 56 3.793 3.958 -0.165 1
1 658 . 20 1 1 A 56 56 ILE C C 56 175.142 175.812 -0.670 1
1 659 . 20 1 1 A 56 56 ILE CA C 56 63.518 62.092 1.426 1
1 660 . 20 1 1 A 56 56 ILE CB C 56 37.169 37.990 -0.821 1
1 664 . 20 1 1 A 56 56 ILE N N 56 120.430 120.248 0.182 1
1 665 . 20 1 1 A 57 57 LEU H H 57 9.263 9.333 -0.070 1
1 666 . 20 1 1 A 57 57 LEU HA H 57 4.343 4.394 -0.051 1
1 676 . 20 1 1 A 57 57 LEU C C 57 177.898 176.519 1.379 1
1 677 . 20 1 1 A 57 57 LEU CA C 57 56.569 55.920 0.649 1
1 678 . 20 1 1 A 57 57 LEU CB C 57 41.980 42.479 -0.499 1
1 682 . 20 1 1 A 57 57 LEU N N 57 129.464 129.044 0.420 1
1 683 . 20 1 1 A 58 58 THR H H 58 7.414 7.354 0.060 1
1 684 . 20 1 1 A 58 58 THR HA H 58 4.512 4.843 -0.331 1
1 689 . 20 1 1 A 58 58 THR C C 58 171.314 172.723 -1.409 1
1 690 . 20 1 1 A 58 58 THR CA C 58 60.562 61.230 -0.668 1
1 691 . 20 1 1 A 58 58 THR CB C 58 70.803 73.528 -2.725 1
1 693 . 20 1 1 A 58 58 THR N N 58 109.129 110.703 -1.574 1
1 694 . 20 1 1 A 59 59 VAL H H 59 8.152 8.503 -0.351 1
1 695 . 20 1 1 A 59 59 VAL HA H 59 5.061 4.982 0.079 1
1 703 . 20 1 1 A 59 59 VAL C C 59 174.985 175.041 -0.056 1
1 704 . 20 1 1 A 59 59 VAL CA C 59 61.354 61.195 0.159 1
1 705 . 20 1 1 A 59 59 VAL CB C 59 33.855 33.916 -0.061 1
1 708 . 20 1 1 A 59 59 VAL N N 59 123.676 124.700 -1.024 1
1 709 . 20 1 1 A 60 60 GLU H H 60 9.074 8.670 0.404 1
1 710 . 20 1 1 A 60 60 GLU HA H 60 4.977 4.832 0.145 1
1 715 . 20 1 1 A 60 60 GLU C C 60 176.063 175.396 0.667 1
1 716 . 20 1 1 A 60 60 GLU CA C 60 53.807 54.339 -0.532 1
1 717 . 20 1 1 A 60 60 GLU CB C 60 33.739 33.696 0.043 1
1 719 . 20 1 1 A 60 60 GLU N N 60 125.125 125.836 -0.711 1
1 720 . 20 1 1 A 61 61 SER H H 61 8.763 8.563 0.200 1
1 721 . 20 1 1 A 61 61 SER HA H 61 4.452 4.952 -0.500 1
1 724 . 20 1 1 A 61 61 SER C C 61 173.288 174.454 -1.166 1
1 725 . 20 1 1 A 61 61 SER CA C 61 59.384 56.901 2.483 1
1 726 . 20 1 1 A 61 61 SER CB C 61 63.390 65.144 -1.754 1
1 727 . 20 1 1 A 61 61 SER N N 61 117.523 114.803 2.720 1
1 728 . 20 1 1 A 62 62 ALA H H 62 7.293 8.875 -1.582 1
1 729 . 20 1 1 A 62 62 ALA HA H 62 3.817 4.312 -0.495 1
1 733 . 20 1 1 A 62 62 ALA C C 62 176.717 177.917 -1.200 1
1 734 . 20 1 1 A 62 62 ALA CA C 62 53.966 53.027 0.939 1
1 735 . 20 1 1 A 62 62 ALA CB C 62 18.640 18.817 -0.177 1
1 736 . 20 1 1 A 62 62 ALA N N 62 122.650 125.900 -3.250 1
1 737 . 20 1 1 A 63 63 GLN H H 63 8.736 8.029 0.707 1
1 738 . 20 1 1 A 63 63 GLN HA H 63 4.445 4.744 -0.299 1
1 745 . 20 1 1 A 63 63 GLN C C 63 173.700 175.289 -1.589 1
1 746 . 20 1 1 A 63 63 GLN CA C 63 56.376 55.752 0.624 1
1 747 . 20 1 1 A 63 63 GLN CB C 63 31.515 31.018 0.497 1
1 749 . 20 1 1 A 63 63 GLN N N 63 120.251 119.474 0.777 1
1 751 . 20 1 1 A 64 64 ASN H H 64 9.272 7.197 2.075 1
1 752 . 20 1 1 A 64 64 ASN HA H 64 4.906 5.128 -0.222 1
1 757 . 20 1 1 A 64 64 ASN C C 64 174.754 174.679 0.075 1
1 758 . 20 1 1 A 64 64 ASN CA C 64 51.837 52.180 -0.343 1
1 759 . 20 1 1 A 64 64 ASN CB C 64 38.156 39.819 -1.663 1
1 760 . 20 1 1 A 64 64 ASN N N 64 122.346 118.789 3.557 1
1 762 . 20 1 1 A 65 65 PHE H H 65 8.854 9.253 -0.399 1
1 763 . 20 1 1 A 65 65 PHE HA H 65 4.947 5.164 -0.217 1
1 771 . 20 1 1 A 65 65 PHE C C 65 177.274 175.943 1.331 1
1 772 . 20 1 1 A 65 65 PHE CA C 65 57.519 56.953 0.566 1
1 773 . 20 1 1 A 65 65 PHE CB C 65 38.485 38.594 -0.109 1
1 779 . 20 1 1 A 65 65 PHE N N 65 123.638 125.334 -1.696 1
1 780 . 20 1 1 A 66 66 SER H H 66 8.163 8.035 0.128 1
1 781 . 20 1 1 A 66 66 SER HA H 66 4.393 4.484 -0.091 1
1 784 . 20 1 1 A 66 66 SER C C 66 175.699 177.173 -1.474 1
1 785 . 20 1 1 A 66 66 SER CA C 66 60.791 60.467 0.324 1
1 786 . 20 1 1 A 66 66 SER CB C 66 64.591 63.638 0.953 1
1 787 . 20 1 1 A 66 66 SER N N 66 113.913 113.859 0.054 1
1 788 . 20 1 1 A 67 67 LEU H H 67 8.574 7.688 0.886 1
1 789 . 20 1 1 A 67 67 LEU HA H 67 4.302 3.900 0.402 1
1 799 . 20 1 1 A 67 67 LEU C C 67 176.269 177.124 -0.855 1
1 800 . 20 1 1 A 67 67 LEU CA C 67 55.601 58.187 -2.586 1
1 801 . 20 1 1 A 67 67 LEU CB C 67 42.021 41.836 0.185 1
1 805 . 20 1 1 A 67 67 LEU N N 67 121.264 120.594 0.670 1
1 806 . 20 1 1 A 68 68 VAL H H 68 6.921 7.555 -0.634 1
1 807 . 20 1 1 A 68 68 VAL HA H 68 4.473 4.141 0.332 1
1 815 . 20 1 1 A 68 68 VAL C C 68 173.809 174.931 -1.122 1
1 816 . 20 1 1 A 68 68 VAL CA C 68 58.047 60.903 -2.856 1
1 817 . 20 1 1 A 68 68 VAL CB C 68 32.295 31.804 0.491 1
1 820 . 20 1 1 A 68 68 VAL N N 68 111.287 115.581 -4.294 1
1 821 . 20 1 1 A 69 69 PRO HA H 69 4.658 4.635 0.023 1
1 828 . 20 1 1 A 69 69 PRO CA C 69 61.747 61.620 0.127 1
1 829 . 20 1 1 A 69 69 PRO CB C 69 30.693 32.392 -1.699 1
1 832 . 20 1 1 A 70 70 PRO HA H 70 4.414 4.359 0.055 1
1 839 . 20 1 1 A 70 70 PRO CA C 70 63.997 64.211 -0.214 1
1 840 . 20 1 1 A 70 70 PRO CB C 70 31.602 31.557 0.045 1
1 843 . 20 1 1 A 71 71 GLY H H 71 8.824 8.191 0.633 1
1 844 . 20 1 1 A 71 71 GLY HA2 H 71 3.703 4.026 -0.323 1
1 845 . 20 1 1 A 71 71 GLY HA3 H 71 4.193 4.026 0.167 1
1 846 . 20 1 1 A 71 71 GLY C C 71 174.052 172.978 1.074 1
1 847 . 20 1 1 A 71 71 GLY CA C 71 45.065 45.537 -0.472 1
1 848 . 20 1 1 A 71 71 GLY N N 71 111.845 106.142 5.703 1
1 849 . 20 1 1 A 72 72 THR H H 72 7.597 7.179 0.418 1
1 850 . 20 1 1 A 72 72 THR HA H 72 4.133 4.692 -0.559 1
1 855 . 20 1 1 A 72 72 THR CA C 72 63.129 60.886 2.243 1
1 856 . 20 1 1 A 72 72 THR CB C 72 69.560 71.920 -2.360 1
1 858 . 20 1 1 A 72 72 THR N N 72 117.485 114.405 3.080 1
1 859 . 20 1 1 A 73 73 ASN H H 73 9.280 8.562 0.718 1
1 860 . 20 1 1 A 73 73 ASN HA H 73 4.786 4.638 0.148 1
1 865 . 20 1 1 A 73 73 ASN CA C 73 52.009 52.253 -0.244 1
1 866 . 20 1 1 A 73 73 ASN CB C 73 37.553 38.363 -0.810 1
1 867 . 20 1 1 A 73 73 ASN N N 73 127.641 125.436 2.205 1
1 869 . 20 1 1 A 74 74 PRO HA H 74 4.752 4.857 -0.105 1
1 876 . 20 1 1 A 74 74 PRO C C 74 175.190 176.409 -1.219 1
1 877 . 20 1 1 A 74 74 PRO CA C 74 63.395 62.553 0.842 1
1 878 . 20 1 1 A 74 74 PRO CB C 74 33.164 32.998 0.166 1
1 881 . 20 1 1 A 75 75 HIS H H 75 8.025 8.936 -0.911 1
1 882 . 20 1 1 A 75 75 HIS HA H 75 5.047 5.108 -0.061 1
1 887 . 20 1 1 A 75 75 HIS C C 75 172.562 175.629 -3.067 1
1 888 . 20 1 1 A 75 75 HIS CA C 75 54.336 53.771 0.565 1
1 889 . 20 1 1 A 75 75 HIS CB C 75 30.956 33.443 -2.487 1
1 892 . 20 1 1 A 75 75 HIS N N 75 116.198 116.761 -0.563 1
1 893 . 20 1 1 A 76 76 CYS H H 76 8.343 9.372 -1.029 1
1 894 . 20 1 1 A 76 76 CYS HA H 76 4.594 4.406 0.188 1
1 897 . 20 1 1 A 76 76 CYS C C 76 175.651 174.808 0.843 1
1 898 . 20 1 1 A 76 76 CYS CA C 76 61.066 61.353 -0.287 1
1 899 . 20 1 1 A 76 76 CYS CB C 76 30.193 28.010 2.183 1
1 900 . 20 1 1 A 76 76 CYS N N 76 113.289 118.136 -4.847 1
1 901 . 20 1 1 A 77 77 PHE H H 77 8.433 7.689 0.744 1
1 902 . 20 1 1 A 77 77 PHE HA H 77 5.105 5.474 -0.369 1
1 910 . 20 1 1 A 77 77 PHE C C 77 171.822 173.075 -1.253 1
1 911 . 20 1 1 A 77 77 PHE CA C 77 56.874 55.557 1.317 1
1 912 . 20 1 1 A 77 77 PHE CB C 77 39.393 42.819 -3.426 1
1 918 . 20 1 1 A 77 77 PHE N N 77 114.874 114.833 0.041 1
1 919 . 20 1 1 A 78 78 GLU H H 78 9.823 9.103 0.720 1
1 920 . 20 1 1 A 78 78 GLU HA H 78 5.333 5.042 0.291 1
1 925 . 20 1 1 A 78 78 GLU C C 78 175.602 175.472 0.130 1
1 926 . 20 1 1 A 78 78 GLU CA C 78 54.212 55.007 -0.795 1
1 927 . 20 1 1 A 78 78 GLU CB C 78 31.702 32.425 -0.723 1
1 929 . 20 1 1 A 78 78 GLU N N 78 121.074 118.833 2.241 1
1 930 . 20 1 1 A 79 79 ILE H H 79 9.093 9.095 -0.002 1
1 931 . 20 1 1 A 79 79 ILE HA H 79 4.637 4.564 0.073 1
1 941 . 20 1 1 A 79 79 ILE C C 79 174.476 175.346 -0.870 1
1 942 . 20 1 1 A 79 79 ILE CA C 79 60.932 60.683 0.249 1
1 943 . 20 1 1 A 79 79 ILE CB C 79 40.803 37.271 3.532 1
1 947 . 20 1 1 A 79 79 ILE N N 79 121.382 125.626 -4.244 1
1 948 . 20 1 1 A 80 80 VAL H H 80 8.841 7.968 0.873 1
1 949 . 20 1 1 A 80 80 VAL HA H 80 4.425 3.904 0.521 1
1 957 . 20 1 1 A 80 80 VAL C C 80 175.930 175.212 0.718 1
1 958 . 20 1 1 A 80 80 VAL CA C 80 63.324 63.076 0.248 1
1 959 . 20 1 1 A 80 80 VAL CB C 80 32.783 31.027 1.756 1
1 962 . 20 1 1 A 80 80 VAL N N 80 128.970 128.165 0.805 1
1 963 . 20 1 1 A 81 81 THR H H 81 8.303 8.016 0.287 1
1 964 . 20 1 1 A 81 81 THR HA H 81 5.264 4.655 0.609 1
1 969 . 20 1 1 A 81 81 THR C C 81 173.664 174.554 -0.890 1
1 970 . 20 1 1 A 81 81 THR CA C 81 59.540 60.080 -0.540 1
1 971 . 20 1 1 A 81 81 THR CB C 81 72.197 71.295 0.902 1
1 973 . 20 1 1 A 81 81 THR N N 81 118.077 118.592 -0.515 1
1 974 . 20 1 1 A 82 82 ALA H H 82 9.586 8.481 1.105 1
1 975 . 20 1 1 A 82 82 ALA HA H 82 4.093 4.305 -0.212 1
1 979 . 20 1 1 A 82 82 ALA C C 82 178.667 177.897 0.770 1
1 980 . 20 1 1 A 82 82 ALA CA C 82 55.321 53.185 2.136 1
1 981 . 20 1 1 A 82 82 ALA CB C 82 18.094 18.814 -0.720 1
1 982 . 20 1 1 A 82 82 ALA N N 82 122.493 123.615 -1.122 1
1 983 . 20 1 1 A 83 83 ASN H H 83 7.923 8.341 -0.418 1
1 984 . 20 1 1 A 83 83 ASN HA H 83 4.808 5.025 -0.217 1
1 989 . 20 1 1 A 83 83 ASN C C 83 174.766 174.709 0.057 1
1 990 . 20 1 1 A 83 83 ASN CA C 83 53.333 54.739 -1.406 1
1 991 . 20 1 1 A 83 83 ASN CB C 83 40.335 41.369 -1.034 1
1 992 . 20 1 1 A 83 83 ASN N N 83 110.765 115.331 -4.566 1
1 994 . 20 1 1 A 84 84 ALA H H 84 7.352 7.169 0.183 1
1 995 . 20 1 1 A 84 84 ALA HA H 84 4.625 4.477 0.148 1
1 999 . 20 1 1 A 84 84 ALA C C 84 176.547 174.874 1.673 1
1 1000 . 20 1 1 A 84 84 ALA CA C 84 52.858 51.827 1.031 1
1 1001 . 20 1 1 A 84 84 ALA CB C 84 21.233 21.842 -0.609 1
1 1002 . 20 1 1 A 84 84 ALA N N 84 119.599 117.514 2.085 1
1 1003 . 20 1 1 A 85 85 THR H H 85 8.374 8.755 -0.381 1
1 1004 . 20 1 1 A 85 85 THR HA H 85 5.014 4.555 0.459 1
1 1009 . 20 1 1 A 85 85 THR C C 85 171.568 173.958 -2.390 1
1 1010 . 20 1 1 A 85 85 THR CA C 85 61.618 62.005 -0.387 1
1 1011 . 20 1 1 A 85 85 THR CB C 85 70.850 69.593 1.257 1
1 1013 . 20 1 1 A 85 85 THR N N 85 119.032 113.525 5.507 1
1 1014 . 20 1 1 A 86 86 TYR H H 86 9.006 8.992 0.014 1
1 1015 . 20 1 1 A 86 86 TYR HA H 86 4.658 4.842 -0.184 1
1 1022 . 20 1 1 A 86 86 TYR C C 86 173.773 175.368 -1.595 1
1 1023 . 20 1 1 A 86 86 TYR CA C 86 56.938 57.914 -0.976 1
1 1024 . 20 1 1 A 86 86 TYR CB C 86 39.513 40.118 -0.605 1
1 1029 . 20 1 1 A 86 86 TYR N N 86 123.494 127.139 -3.645 1
1 1030 . 20 1 1 A 87 87 PHE H H 87 9.263 8.755 0.508 1
1 1031 . 20 1 1 A 87 87 PHE HA H 87 4.127 4.713 -0.586 1
1 1039 . 20 1 1 A 87 87 PHE C C 87 176.369 174.256 2.113 1
1 1040 . 20 1 1 A 87 87 PHE CA C 87 57.238 55.575 1.663 1
1 1041 . 20 1 1 A 87 87 PHE CB C 87 37.086 38.363 -1.277 1
1 1047 . 20 1 1 A 87 87 PHE N N 87 125.384 119.743 5.641 1
1 1048 . 20 1 1 A 88 88 VAL H H 88 9.023 8.188 0.835 1
1 1049 . 20 1 1 A 88 88 VAL HA H 88 4.162 4.733 -0.571 1
1 1057 . 20 1 1 A 88 88 VAL C C 88 176.390 175.870 0.520 1
1 1058 . 20 1 1 A 88 88 VAL CA C 88 63.975 60.901 3.074 1
1 1059 . 20 1 1 A 88 88 VAL CB C 88 32.378 31.765 0.613 1
1 1062 . 20 1 1 A 88 88 VAL N N 88 127.348 123.974 3.374 1
1 1063 . 20 1 1 A 89 89 GLY H H 89 9.233 7.872 1.361 1
1 1064 . 20 1 1 A 89 89 GLY HA2 H 89 4.293 4.192 0.101 1
1 1065 . 20 1 1 A 89 89 GLY HA3 H 89 4.186 4.251 -0.065 1
1 1066 . 20 1 1 A 89 89 GLY C C 89 172.378 171.464 0.914 1
1 1067 . 20 1 1 A 89 89 GLY CA C 89 43.798 46.307 -2.509 1
1 1068 . 20 1 1 A 89 89 GLY N N 89 116.041 112.701 3.340 1
1 1069 . 20 1 1 A 90 90 GLU H H 90 8.532 8.326 0.206 1
1 1070 . 20 1 1 A 90 90 GLU HA H 90 4.794 5.031 -0.237 1
1 1075 . 20 1 1 A 90 90 GLU C C 90 174.221 175.265 -1.044 1
1 1076 . 20 1 1 A 90 90 GLU CA C 90 56.393 55.081 1.312 1
1 1077 . 20 1 1 A 90 90 GLU CB C 90 33.182 32.850 0.332 1
1 1079 . 20 1 1 A 90 90 GLU N N 90 120.905 123.659 -2.754 1
1 1080 . 20 1 1 A 91 91 MET H H 91 8.450 8.822 -0.372 1
1 1081 . 20 1 1 A 91 91 MET HA H 91 4.904 5.195 -0.291 1
1 1089 . 20 1 1 A 91 91 MET C C 91 173.373 173.491 -0.118 1
1 1090 . 20 1 1 A 91 91 MET CA C 91 52.277 52.103 0.174 1
1 1091 . 20 1 1 A 91 91 MET CB C 91 32.789 34.778 -1.989 1
1 1094 . 20 1 1 A 91 91 MET N N 91 125.173 121.762 3.411 1
1 1095 . 20 1 1 A 92 92 PRO HA H 92 4.358 4.287 0.071 1
1 1102 . 20 1 1 A 92 92 PRO C C 92 177.589 176.736 0.853 1
1 1103 . 20 1 1 A 92 92 PRO CA C 92 63.143 63.624 -0.481 1
1 1104 . 20 1 1 A 92 92 PRO CB C 92 32.083 31.414 0.669 1
1 1107 . 20 1 1 A 93 93 GLY H H 93 8.330 8.685 -0.355 1
1 1108 . 20 1 1 A 93 93 GLY HA2 H 93 3.943 4.080 -0.137 1
1 1109 . 20 1 1 A 93 93 GLY HA3 H 93 4.045 4.085 -0.040 1
1 1110 . 20 1 1 A 93 93 GLY C C 93 174.730 173.970 0.760 1
1 1111 . 20 1 1 A 93 93 GLY CA C 93 45.276 45.434 -0.158 1
1 1112 . 20 1 1 A 93 93 GLY N N 93 109.420 111.567 -2.147 1
1 1113 . 20 1 1 A 94 94 GLY H H 94 8.331 8.494 -0.163 1
1 1114 . 20 1 1 A 94 94 GLY HA2 H 94 3.973 3.898 0.075 1
1 1115 . 20 1 1 A 94 94 GLY HA3 H 94 3.973 3.912 0.061 1
1 1116 . 20 1 1 A 94 94 GLY C C 94 174.100 173.698 0.402 1
1 1117 . 20 1 1 A 94 94 GLY CA C 94 45.333 45.582 -0.249 1
1 1118 . 20 1 1 A 94 94 GLY N N 94 108.483 108.639 -0.156 1
1 1119 . 20 1 1 A 95 95 THR H H 95 8.095 8.046 0.049 1
1 1120 . 20 1 1 A 95 95 THR HA H 95 4.643 4.941 -0.298 1
1 1125 . 20 1 1 A 95 95 THR C C 95 173.155 172.426 0.729 1
1 1126 . 20 1 1 A 95 95 THR CA C 95 59.922 58.317 1.605 1
1 1127 . 20 1 1 A 95 95 THR CB C 95 69.871 69.752 0.119 1
1 1129 . 20 1 1 A 95 95 THR N N 95 115.860 112.087 3.773 1
1 1130 . 20 1 1 A 96 96 PRO HA H 96 4.400 4.371 0.029 1
1 1137 . 20 1 1 A 96 96 PRO C C 96 177.565 177.634 -0.069 1
1 1138 . 20 1 1 A 96 96 PRO CA C 96 64.047 63.536 0.511 1
1 1139 . 20 1 1 A 96 96 PRO CB C 96 31.816 30.604 1.212 1
1 1142 . 20 1 1 A 97 97 GLY H H 97 8.572 8.514 0.058 1
1 1143 . 20 1 1 A 97 97 GLY HA2 H 97 4.007 3.917 0.090 1
1 1144 . 20 1 1 A 97 97 GLY HA3 H 97 4.007 3.918 0.089 1
1 1145 . 20 1 1 A 97 97 GLY C C 97 174.609 173.812 0.797 1
1 1146 . 20 1 1 A 97 97 GLY CA C 97 45.276 46.232 -0.956 1
1 1147 . 20 1 1 A 97 97 GLY N N 97 110.233 113.129 -2.896 1
1 1148 . 20 1 1 A 98 98 GLY H H 98 8.119 8.123 -0.004 1
1 1149 . 20 1 1 A 98 98 GLY HA2 H 98 4.086 4.116 -0.030 1
1 1150 . 20 1 1 A 98 98 GLY HA3 H 98 4.200 4.118 0.082 1
1 1151 . 20 1 1 A 98 98 GLY CA C 98 44.876 45.141 -0.265 1
1 1152 . 20 1 1 A 98 98 GLY N N 98 108.845 109.514 -0.669 1
1 1153 . 20 1 1 A 99 99 PRO HA H 99 4.494 4.742 -0.248 1
1 1160 . 20 1 1 A 99 99 PRO C C 99 177.468 176.077 1.391 1
1 1161 . 20 1 1 A 99 99 PRO CA C 99 63.500 62.440 1.060 1
1 1162 . 20 1 1 A 99 99 PRO CB C 99 32.013 29.777 2.236 1
1 1165 . 20 1 1 A 100 100 SER H H 100 8.472 8.393 0.079 1
1 1166 . 20 1 1 A 100 100 SER HA H 100 4.513 4.820 -0.307 1
1 1169 . 20 1 1 A 100 100 SER C C 100 175.408 174.526 0.882 1
1 1170 . 20 1 1 A 100 100 SER CA C 100 58.557 57.586 0.971 1
1 1171 . 20 1 1 A 100 100 SER CB C 100 63.918 66.612 -2.694 1
1 1172 . 20 1 1 A 100 100 SER N N 100 116.038 119.765 -3.727 1
1 1173 . 20 1 1 A 101 101 GLY H H 101 8.427 8.773 -0.346 1
1 1174 . 20 1 1 A 101 101 GLY HA2 H 101 4.064 3.821 0.243 1
1 1175 . 20 1 1 A 101 101 GLY HA3 H 101 4.064 3.835 0.229 1
1 1176 . 20 1 1 A 101 101 GLY C C 101 174.730 174.132 0.598 1
1 1177 . 20 1 1 A 101 101 GLY CA C 101 45.575 47.295 -1.720 1
1 1178 . 20 1 1 A 101 101 GLY N N 101 110.558 112.087 -1.529 1
1 1179 . 20 1 1 A 102 102 GLN H H 102 8.416 7.849 0.567 1
1 1180 . 20 1 1 A 102 102 GLN HA H 102 4.383 4.428 -0.045 1
1 1187 . 20 1 1 A 102 102 GLN C C 102 177.346 175.595 1.751 1
1 1188 . 20 1 1 A 102 102 GLN CA C 102 57.080 55.921 1.159 1
1 1189 . 20 1 1 A 102 102 GLN CB C 102 29.235 29.887 -0.652 1
1 1191 . 20 1 1 A 102 102 GLN N N 102 120.112 125.036 -4.924 1
1 1193 . 20 1 1 A 103 103 GLY H H 103 8.713 8.387 0.326 1
1 1194 . 20 1 1 A 103 103 GLY HA2 H 103 4.193 4.386 -0.193 1
1 1195 . 20 1 1 A 103 103 GLY HA3 H 103 4.078 4.400 -0.322 1
1 1196 . 20 1 1 A 103 103 GLY C C 103 175.602 173.482 2.120 1
1 1197 . 20 1 1 A 103 103 GLY CA C 103 46.120 45.277 0.843 1
1 1198 . 20 1 1 A 103 103 GLY N N 103 109.817 112.420 -2.603 1
1 1199 . 20 1 1 A 104 104 ALA H H 104 8.366 8.239 0.127 1
1 1200 . 20 1 1 A 104 104 ALA HA H 104 4.449 4.475 -0.026 1
1 1204 . 20 1 1 A 104 104 ALA C C 104 179.188 178.557 0.631 1
1 1205 . 20 1 1 A 104 104 ALA CA C 104 54.230 53.024 1.206 1
1 1206 . 20 1 1 A 104 104 ALA CB C 104 19.080 20.182 -1.102 1
1 1207 . 20 1 1 A 104 104 ALA N N 104 124.808 120.885 3.923 1
1 1208 . 20 1 1 A 105 105 GLU H H 105 8.576 8.251 0.325 1
1 1209 . 20 1 1 A 105 105 GLU HA H 105 4.161 4.070 0.091 1
1 1214 . 20 1 1 A 105 105 GLU C C 105 179.200 178.901 0.299 1
1 1215 . 20 1 1 A 105 105 GLU CA C 105 59.173 59.059 0.114 1
1 1216 . 20 1 1 A 105 105 GLU CB C 105 29.194 29.454 -0.260 1
1 1218 . 20 1 1 A 105 105 GLU N N 105 119.238 117.533 1.705 1
1 1219 . 20 1 1 A 106 106 ALA H H 106 8.381 8.272 0.109 1
1 1220 . 20 1 1 A 106 106 ALA HA H 106 4.283 4.101 0.182 1
1 1224 . 20 1 1 A 106 106 ALA C C 106 180.048 179.639 0.409 1
1 1225 . 20 1 1 A 106 106 ALA CA C 106 54.687 55.081 -0.394 1
1 1226 . 20 1 1 A 106 106 ALA CB C 106 18.341 18.507 -0.166 1
1 1227 . 20 1 1 A 106 106 ALA N N 106 123.327 121.403 1.924 1
1 1228 . 20 1 1 A 107 107 ALA H H 107 8.123 7.753 0.370 1
1 1229 . 20 1 1 A 107 107 ALA HA H 107 4.554 4.430 0.124 1
1 1233 . 20 1 1 A 107 107 ALA C C 107 179.757 179.693 0.064 1
1 1234 . 20 1 1 A 107 107 ALA CA C 107 55.355 55.429 -0.074 1
1 1235 . 20 1 1 A 107 107 ALA CB C 107 18.939 18.942 -0.003 1
1 1236 . 20 1 1 A 107 107 ALA N N 107 120.740 120.213 0.527 1
1 1237 . 20 1 1 A 108 108 ARG H H 108 8.403 8.353 0.050 1
1 1238 . 20 1 1 A 108 108 ARG HA H 108 4.254 4.136 0.118 1
1 1245 . 20 1 1 A 108 108 ARG C C 108 179.111 178.621 0.490 1
1 1246 . 20 1 1 A 108 108 ARG CA C 108 59.015 58.303 0.712 1
1 1247 . 20 1 1 A 108 108 ARG CB C 108 29.752 29.630 0.122 1
1 1250 . 20 1 1 A 108 108 ARG N N 108 119.531 117.250 2.281 1
1 1251 . 20 1 1 A 109 109 GLY H H 109 8.182 8.190 -0.008 1
1 1252 . 20 1 1 A 109 109 GLY HA2 H 109 3.822 3.560 0.262 1
1 1253 . 20 1 1 A 109 109 GLY HA3 H 109 3.822 3.618 0.204 1
1 1254 . 20 1 1 A 109 109 GLY C C 109 177.020 176.725 0.295 1
1 1255 . 20 1 1 A 109 109 GLY CA C 109 46.718 47.087 -0.369 1
1 1256 . 20 1 1 A 109 109 GLY N N 109 107.331 108.217 -0.886 1
1 1257 . 20 1 1 A 110 110 TRP H H 110 7.925 8.010 -0.085 1
1 1258 . 20 1 1 A 110 110 TRP HA H 110 3.963 4.674 -0.711 1
1 1267 . 20 1 1 A 110 110 TRP C C 110 176.691 178.015 -1.324 1
1 1268 . 20 1 1 A 110 110 TRP CA C 110 62.041 60.248 1.793 1
1 1269 . 20 1 1 A 110 110 TRP CB C 110 28.989 28.800 0.189 1
1 1275 . 20 1 1 A 110 110 TRP N N 110 122.304 122.019 0.285 1
1 1277 . 20 1 1 A 111 111 GLU H H 111 7.946 7.737 0.209 1
1 1278 . 20 1 1 A 111 111 GLU HA H 111 2.594 3.103 -0.509 1
1 1283 . 20 1 1 A 111 111 GLU C C 111 177.976 179.096 -1.120 1
1 1284 . 20 1 1 A 111 111 GLU CA C 111 60.193 59.047 1.146 1
1 1285 . 20 1 1 A 111 111 GLU CB C 111 29.277 29.345 -0.068 1
1 1287 . 20 1 1 A 111 111 GLU N N 111 121.755 119.110 2.645 1
1 1288 . 20 1 1 A 112 112 THR H H 112 7.993 7.516 0.477 1
1 1289 . 20 1 1 A 112 112 THR HA H 112 3.722 3.819 -0.097 1
1 1294 . 20 1 1 A 112 112 THR C C 112 176.038 175.906 0.132 1
1 1295 . 20 1 1 A 112 112 THR CA C 112 66.104 66.512 -0.408 1
1 1296 . 20 1 1 A 112 112 THR CB C 112 68.885 68.684 0.201 1
1 1298 . 20 1 1 A 112 112 THR N N 112 112.247 116.418 -4.171 1
1 1299 . 20 1 1 A 113 113 ALA H H 113 7.742 8.077 -0.335 1
1 1300 . 20 1 1 A 113 113 ALA HA H 113 4.029 3.999 0.030 1
1 1304 . 20 1 1 A 113 113 ALA C C 113 180.545 179.932 0.613 1
1 1305 . 20 1 1 A 113 113 ALA CA C 113 55.127 55.233 -0.106 1
1 1306 . 20 1 1 A 113 113 ALA CB C 113 18.854 18.431 0.423 1
1 1307 . 20 1 1 A 113 113 ALA N N 113 123.134 122.819 0.315 1
1 1308 . 20 1 1 A 114 114 ILE H H 114 8.472 8.605 -0.133 1
1 1309 . 20 1 1 A 114 114 ILE HA H 114 3.613 3.773 -0.160 1
1 1319 . 20 1 1 A 114 114 ILE C C 114 176.947 178.301 -1.354 1
1 1320 . 20 1 1 A 114 114 ILE CA C 114 66.016 65.340 0.676 1
1 1321 . 20 1 1 A 114 114 ILE CB C 114 38.335 37.898 0.437 1
1 1325 . 20 1 1 A 114 114 ILE N N 114 118.276 117.908 0.368 1
1 1326 . 20 1 1 A 115 115 ARG H H 115 8.181 7.828 0.353 1
1 1327 . 20 1 1 A 115 115 ARG HA H 115 3.835 3.962 -0.127 1
1 1334 . 20 1 1 A 115 115 ARG C C 115 179.588 179.142 0.446 1
1 1335 . 20 1 1 A 115 115 ARG CA C 115 61.072 59.857 1.215 1
1 1336 . 20 1 1 A 115 115 ARG CB C 115 29.975 29.721 0.254 1
1 1339 . 20 1 1 A 115 115 ARG N N 115 117.921 120.036 -2.115 1
1 1340 . 20 1 1 A 116 116 GLN H H 116 8.395 8.486 -0.091 1
1 1341 . 20 1 1 A 116 116 GLN HA H 116 4.030 4.063 -0.033 1
1 1348 . 20 1 1 A 116 116 GLN C C 116 178.716 178.802 -0.086 1
1 1349 . 20 1 1 A 116 116 GLN CA C 116 58.790 58.880 -0.090 1
1 1350 . 20 1 1 A 116 116 GLN CB C 116 28.248 28.505 -0.257 1
1 1352 . 20 1 1 A 116 116 GLN N N 116 116.842 118.955 -2.113 1
1 1354 . 20 1 1 A 117 117 ALA H H 117 7.902 8.143 -0.241 1
1 1355 . 20 1 1 A 117 117 ALA HA H 117 4.143 4.151 -0.008 1
1 1359 . 20 1 1 A 117 117 ALA C C 117 179.685 180.314 -0.629 1
1 1360 . 20 1 1 A 117 117 ALA CA C 117 54.476 54.953 -0.477 1
1 1361 . 20 1 1 A 117 117 ALA CB C 117 18.300 18.342 -0.042 1
1 1362 . 20 1 1 A 117 117 ALA N N 117 122.828 122.881 -0.053 1
1 1363 . 20 1 1 A 118 118 LEU H H 118 7.904 7.890 0.014 1
1 1364 . 20 1 1 A 118 118 LEU HA H 118 4.119 4.123 -0.004 1
1 1374 . 20 1 1 A 118 118 LEU C C 118 178.437 178.850 -0.413 1
1 1375 . 20 1 1 A 118 118 LEU CA C 118 56.781 57.175 -0.394 1
1 1376 . 20 1 1 A 118 118 LEU CB C 118 42.371 41.831 0.540 1
1 1380 . 20 1 1 A 118 118 LEU N N 118 117.632 120.356 -2.724 1
1 1381 . 20 1 1 A 119 119 MET H H 119 7.673 8.071 -0.398 1
1 1382 . 20 1 1 A 119 119 MET HA H 119 4.442 4.240 0.202 1
1 1390 . 20 1 1 A 119 119 MET C C 119 176.680 177.094 -0.414 1
1 1391 . 20 1 1 A 119 119 MET CA C 119 56.432 57.765 -1.333 1
1 1392 . 20 1 1 A 119 119 MET CB C 119 32.769 31.792 0.977 1
1 1395 . 20 1 1 A 119 119 MET N N 119 117.286 117.238 0.048 1
1 1396 . 20 1 1 A 120 120 SER H H 120 7.878 7.357 0.521 1
1 1397 . 20 1 1 A 120 120 SER HA H 120 4.500 4.494 0.006 1
1 1400 . 20 1 1 A 120 120 SER C C 120 174.742 174.462 0.280 1
1 1401 . 20 1 1 A 120 120 SER CA C 120 58.962 58.439 0.523 1
1 1402 . 20 1 1 A 120 120 SER CB C 120 63.853 63.327 0.526 1
1 1403 . 20 1 1 A 120 120 SER N N 120 115.064 112.792 2.272 1
1 1404 . 20 1 1 A 121 121 GLY H H 121 8.059 8.128 -0.069 1
1 1405 . 20 1 1 A 121 121 GLY HA2 H 121 4.231 4.134 0.097 1
1 1406 . 20 1 1 A 121 121 GLY HA3 H 121 4.112 4.134 -0.022 1
1 1407 . 20 1 1 A 121 121 GLY C C 121 172.065 172.308 -0.243 1
1 1408 . 20 1 1 A 121 121 GLY CA C 121 45.030 43.846 1.184 1
1 1409 . 20 1 1 A 121 121 GLY N N 121 110.271 109.540 0.731 1
1 1410 . 20 1 1 A 122 122 PRO HA H 122 4.496 4.665 -0.169 1
1 1417 . 20 1 1 A 122 122 PRO CA C 122 63.399 62.786 0.613 1
1 1418 . 20 1 1 A 122 122 PRO CB C 122 32.186 31.688 0.498 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 97 1.238 1
2 1 1 1 "RMS(OBS, PRED)" CA 115 1.229 1
3 1 1 1 "RMS(OBS, PRED)" CB 105 1.413 1
4 1 1 1 "RMS(OBS, PRED)" H 108 0.598 1
5 1 1 1 "RMS(OBS, PRED)" HA 128 0.304 1
6 1 1 1 "RMS(OBS, PRED)" N 105 3.043 1
7 1 2 1 "RMS(OBS, PRED)" C 97 1.170 1
8 1 2 1 "RMS(OBS, PRED)" CA 115 1.306 1
9 1 2 1 "RMS(OBS, PRED)" CB 105 1.327 1
10 1 2 1 "RMS(OBS, PRED)" H 108 0.610 1
11 1 2 1 "RMS(OBS, PRED)" HA 128 0.298 1
12 1 2 1 "RMS(OBS, PRED)" N 105 2.847 1
13 1 3 1 "RMS(OBS, PRED)" C 97 1.131 1
14 1 3 1 "RMS(OBS, PRED)" CA 115 1.183 1
15 1 3 1 "RMS(OBS, PRED)" CB 105 1.308 1
16 1 3 1 "RMS(OBS, PRED)" H 108 0.592 1
17 1 3 1 "RMS(OBS, PRED)" HA 128 0.303 1
18 1 3 1 "RMS(OBS, PRED)" N 105 2.922 1
19 1 4 1 "RMS(OBS, PRED)" C 97 1.092 1
20 1 4 1 "RMS(OBS, PRED)" CA 115 1.228 1
21 1 4 1 "RMS(OBS, PRED)" CB 105 1.341 1
22 1 4 1 "RMS(OBS, PRED)" H 108 0.621 1
23 1 4 1 "RMS(OBS, PRED)" HA 128 0.309 1
24 1 4 1 "RMS(OBS, PRED)" N 105 2.944 1
25 1 5 1 "RMS(OBS, PRED)" C 97 1.104 1
26 1 5 1 "RMS(OBS, PRED)" CA 115 1.143 1
27 1 5 1 "RMS(OBS, PRED)" CB 105 1.337 1
28 1 5 1 "RMS(OBS, PRED)" H 108 0.626 1
29 1 5 1 "RMS(OBS, PRED)" HA 128 0.306 1
30 1 5 1 "RMS(OBS, PRED)" N 105 2.975 1
31 1 6 1 "RMS(OBS, PRED)" C 97 1.142 1
32 1 6 1 "RMS(OBS, PRED)" CA 115 1.128 1
33 1 6 1 "RMS(OBS, PRED)" CB 105 1.296 1
34 1 6 1 "RMS(OBS, PRED)" H 108 0.612 1
35 1 6 1 "RMS(OBS, PRED)" HA 128 0.283 1
36 1 6 1 "RMS(OBS, PRED)" N 105 3.055 1
37 1 7 1 "RMS(OBS, PRED)" C 97 1.147 1
38 1 7 1 "RMS(OBS, PRED)" CA 115 1.168 1
39 1 7 1 "RMS(OBS, PRED)" CB 105 1.378 1
40 1 7 1 "RMS(OBS, PRED)" H 108 0.587 1
41 1 7 1 "RMS(OBS, PRED)" HA 128 0.290 1
42 1 7 1 "RMS(OBS, PRED)" N 105 3.034 1
43 1 8 1 "RMS(OBS, PRED)" C 97 1.229 1
44 1 8 1 "RMS(OBS, PRED)" CA 115 1.255 1
45 1 8 1 "RMS(OBS, PRED)" CB 105 1.308 1
46 1 8 1 "RMS(OBS, PRED)" H 108 0.601 1
47 1 8 1 "RMS(OBS, PRED)" HA 128 0.297 1
48 1 8 1 "RMS(OBS, PRED)" N 105 2.995 1
49 1 9 1 "RMS(OBS, PRED)" C 97 1.171 1
50 1 9 1 "RMS(OBS, PRED)" CA 115 1.292 1
51 1 9 1 "RMS(OBS, PRED)" CB 105 1.293 1
52 1 9 1 "RMS(OBS, PRED)" H 108 0.607 1
53 1 9 1 "RMS(OBS, PRED)" HA 128 0.294 1
54 1 9 1 "RMS(OBS, PRED)" N 105 2.836 1
55 1 10 1 "RMS(OBS, PRED)" C 97 1.240 1
56 1 10 1 "RMS(OBS, PRED)" CA 115 1.229 1
57 1 10 1 "RMS(OBS, PRED)" CB 105 1.322 1
58 1 10 1 "RMS(OBS, PRED)" H 108 0.617 1
59 1 10 1 "RMS(OBS, PRED)" HA 128 0.286 1
60 1 10 1 "RMS(OBS, PRED)" N 105 2.974 1
61 1 11 1 "RMS(OBS, PRED)" C 97 1.159 1
62 1 11 1 "RMS(OBS, PRED)" CA 115 1.119 1
63 1 11 1 "RMS(OBS, PRED)" CB 105 1.367 1
64 1 11 1 "RMS(OBS, PRED)" H 108 0.609 1
65 1 11 1 "RMS(OBS, PRED)" HA 128 0.286 1
66 1 11 1 "RMS(OBS, PRED)" N 105 3.001 1
67 1 12 1 "RMS(OBS, PRED)" C 97 1.159 1
68 1 12 1 "RMS(OBS, PRED)" CA 115 1.215 1
69 1 12 1 "RMS(OBS, PRED)" CB 105 1.339 1
70 1 12 1 "RMS(OBS, PRED)" H 108 0.618 1
71 1 12 1 "RMS(OBS, PRED)" HA 128 0.299 1
72 1 12 1 "RMS(OBS, PRED)" N 105 3.086 1
73 1 13 1 "RMS(OBS, PRED)" C 97 1.143 1
74 1 13 1 "RMS(OBS, PRED)" CA 115 1.194 1
75 1 13 1 "RMS(OBS, PRED)" CB 105 1.341 1
76 1 13 1 "RMS(OBS, PRED)" H 108 0.581 1
77 1 13 1 "RMS(OBS, PRED)" HA 128 0.308 1
78 1 13 1 "RMS(OBS, PRED)" N 105 2.698 1
79 1 14 1 "RMS(OBS, PRED)" C 97 1.145 1
80 1 14 1 "RMS(OBS, PRED)" CA 115 1.166 1
81 1 14 1 "RMS(OBS, PRED)" CB 105 1.234 1
82 1 14 1 "RMS(OBS, PRED)" H 108 0.632 1
83 1 14 1 "RMS(OBS, PRED)" HA 128 0.311 1
84 1 14 1 "RMS(OBS, PRED)" N 105 2.845 1
85 1 15 1 "RMS(OBS, PRED)" C 97 1.151 1
86 1 15 1 "RMS(OBS, PRED)" CA 115 1.181 1
87 1 15 1 "RMS(OBS, PRED)" CB 105 1.281 1
88 1 15 1 "RMS(OBS, PRED)" H 108 0.609 1
89 1 15 1 "RMS(OBS, PRED)" HA 128 0.302 1
90 1 15 1 "RMS(OBS, PRED)" N 105 2.787 1
91 1 16 1 "RMS(OBS, PRED)" C 97 1.128 1
92 1 16 1 "RMS(OBS, PRED)" CA 115 1.175 1
93 1 16 1 "RMS(OBS, PRED)" CB 105 1.289 1
94 1 16 1 "RMS(OBS, PRED)" H 108 0.594 1
95 1 16 1 "RMS(OBS, PRED)" HA 128 0.294 1
96 1 16 1 "RMS(OBS, PRED)" N 105 2.768 1
97 1 17 1 "RMS(OBS, PRED)" C 97 1.289 1
98 1 17 1 "RMS(OBS, PRED)" CA 115 1.175 1
99 1 17 1 "RMS(OBS, PRED)" CB 105 1.329 1
100 1 17 1 "RMS(OBS, PRED)" H 108 0.604 1
101 1 17 1 "RMS(OBS, PRED)" HA 128 0.312 1
102 1 17 1 "RMS(OBS, PRED)" N 105 2.841 1
103 1 18 1 "RMS(OBS, PRED)" C 97 1.204 1
104 1 18 1 "RMS(OBS, PRED)" CA 115 1.189 1
105 1 18 1 "RMS(OBS, PRED)" CB 105 1.307 1
106 1 18 1 "RMS(OBS, PRED)" H 108 0.602 1
107 1 18 1 "RMS(OBS, PRED)" HA 128 0.307 1
108 1 18 1 "RMS(OBS, PRED)" N 105 2.918 1
109 1 19 1 "RMS(OBS, PRED)" C 97 1.191 1
110 1 19 1 "RMS(OBS, PRED)" CA 115 1.264 1
111 1 19 1 "RMS(OBS, PRED)" CB 105 1.452 1
112 1 19 1 "RMS(OBS, PRED)" H 108 0.604 1
113 1 19 1 "RMS(OBS, PRED)" HA 128 0.309 1
114 1 19 1 "RMS(OBS, PRED)" N 105 2.911 1
115 1 20 1 "RMS(OBS, PRED)" C 97 1.105 1
116 1 20 1 "RMS(OBS, PRED)" CA 115 1.186 1
117 1 20 1 "RMS(OBS, PRED)" CB 105 1.265 1
118 1 20 1 "RMS(OBS, PRED)" H 108 0.612 1
119 1 20 1 "RMS(OBS, PRED)" HA 128 0.295 1
120 1 20 1 "RMS(OBS, PRED)" N 105 3.094 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 6 6 SER H H 6 8.337 8.366 -0.029 2
1 2 . 1 1 A 6 6 SER HA H 6 4.597 4.739 -0.142 2
1 5 . 1 1 A 6 6 SER C C 6 174.637 174.070 0.567 2
1 6 . 1 1 A 6 6 SER CA C 6 58.469 57.726 0.743 2
1 7 . 1 1 A 6 6 SER CB C 6 64.221 64.570 -0.349 2
1 8 . 1 1 A 6 6 SER N N 6 117.887 118.263 -0.376 2
1 9 . 1 1 A 7 7 GLY H H 7 8.280 8.402 -0.122 2
1 10 . 1 1 A 7 7 GLY HA2 H 7 4.063 4.061 0.002 2
1 11 . 1 1 A 7 7 GLY HA3 H 7 4.063 4.063 0.000 2
1 12 . 1 1 A 7 7 GLY C C 7 173.724 173.549 0.175 2
1 13 . 1 1 A 7 7 GLY CA C 7 44.941 45.291 -0.350 2
1 14 . 1 1 A 7 7 GLY N N 7 110.151 111.499 -1.348 2
1 15 . 1 1 A 8 8 THR H H 8 8.212 8.228 -0.016 2
1 16 . 1 1 A 8 8 THR HA H 8 4.173 4.650 -0.477 2
1 21 . 1 1 A 8 8 THR C C 8 174.723 174.196 0.527 2
1 22 . 1 1 A 8 8 THR CA C 8 63.622 63.147 0.475 2
1 23 . 1 1 A 8 8 THR CB C 8 69.460 69.503 -0.043 2
1 25 . 1 1 A 8 8 THR N N 8 116.817 116.388 0.429 2
1 26 . 1 1 A 9 9 LEU H H 9 9.374 9.053 0.321 2
1 27 . 1 1 A 9 9 LEU HA H 9 4.302 4.221 0.082 2
1 37 . 1 1 A 9 9 LEU C C 9 177.468 176.588 0.880 2
1 38 . 1 1 A 9 9 LEU CA C 9 55.936 56.488 -0.552 2
1 39 . 1 1 A 9 9 LEU CB C 9 42.843 42.527 0.316 2
1 43 . 1 1 A 9 9 LEU N N 9 127.798 128.345 -0.547 2
1 44 . 1 1 A 10 10 ARG H H 10 7.512 7.411 0.101 2
1 45 . 1 1 A 10 10 ARG HA H 10 4.199 4.699 -0.500 2
1 52 . 1 1 A 10 10 ARG C C 10 172.501 174.036 -1.535 2
1 53 . 1 1 A 10 10 ARG CA C 10 56.165 54.411 1.754 2
1 54 . 1 1 A 10 10 ARG CB C 10 32.442 33.397 -0.955 2
1 57 . 1 1 A 10 10 ARG N N 10 117.979 116.971 1.008 2
1 58 . 1 1 A 11 11 GLU H H 11 8.434 8.727 -0.293 2
1 59 . 1 1 A 11 11 GLU HA H 11 5.993 5.583 0.410 2
1 64 . 1 1 A 11 11 GLU C C 11 174.800 174.650 0.150 2
1 65 . 1 1 A 11 11 GLU CA C 11 54.570 55.142 -0.572 2
1 66 . 1 1 A 11 11 GLU CB C 11 34.245 33.190 1.055 2
1 68 . 1 1 A 11 11 GLU N N 11 120.782 121.991 -1.209 2
1 69 . 1 1 A 12 12 GLY H H 12 8.131 7.826 0.305 2
1 70 . 1 1 A 12 12 GLY HA2 H 12 4.714 3.543 1.171 2
1 71 . 1 1 A 12 12 GLY HA3 H 12 3.763 4.144 -0.381 2
1 72 . 1 1 A 12 12 GLY C C 12 171.060 171.915 -0.855 2
1 73 . 1 1 A 12 12 GLY CA C 12 45.241 45.009 0.232 2
1 74 . 1 1 A 12 12 GLY N N 12 107.457 106.441 1.016 2
1 75 . 1 1 A 13 13 TRP H H 13 8.783 8.560 0.223 2
1 76 . 1 1 A 13 13 TRP HA H 13 5.152 4.904 0.248 2
1 85 . 1 1 A 13 13 TRP C C 13 177.528 176.584 0.944 2
1 86 . 1 1 A 13 13 TRP CA C 13 57.783 58.741 -0.958 2
1 87 . 1 1 A 13 13 TRP CB C 13 30.222 30.056 0.166 2
1 93 . 1 1 A 13 13 TRP N N 13 120.792 121.416 -0.624 2
1 95 . 1 1 A 14 14 VAL H H 14 9.179 8.889 0.290 2
1 96 . 1 1 A 14 14 VAL HA H 14 4.072 4.550 -0.478 2
1 104 . 1 1 A 14 14 VAL C C 14 174.981 173.493 1.488 2
1 105 . 1 1 A 14 14 VAL CA C 14 61.741 60.230 1.511 2
1 106 . 1 1 A 14 14 VAL CB C 14 35.143 35.191 -0.048 2
1 109 . 1 1 A 14 14 VAL N N 14 125.476 122.944 2.532 2
1 110 . 1 1 A 15 15 VAL H H 15 8.403 8.795 -0.392 2
1 111 . 1 1 A 15 15 VAL HA H 15 5.532 5.278 0.254 2
1 119 . 1 1 A 15 15 VAL C C 15 175.078 174.313 0.765 2
1 120 . 1 1 A 15 15 VAL CA C 15 59.489 59.619 -0.130 2
1 121 . 1 1 A 15 15 VAL CB C 15 34.210 34.924 -0.714 2
1 124 . 1 1 A 15 15 VAL N N 15 126.189 126.678 -0.489 2
1 125 . 1 1 A 16 16 HIS H H 16 9.122 8.749 0.373 2
1 126 . 1 1 A 16 16 HIS HA H 16 5.823 5.731 0.092 2
1 131 . 1 1 A 16 16 HIS C C 16 172.998 172.570 0.428 2
1 132 . 1 1 A 16 16 HIS CA C 16 56.253 53.945 2.308 2
1 133 . 1 1 A 16 16 HIS CB C 16 34.273 33.050 1.223 2
1 136 . 1 1 A 16 16 HIS N N 16 121.152 120.635 0.517 2
1 137 . 1 1 A 17 17 TYR H H 17 8.465 8.634 -0.169 2
1 138 . 1 1 A 17 17 TYR HA H 17 5.096 4.772 0.324 2
1 145 . 1 1 A 17 17 TYR C C 17 173.640 172.879 0.761 2
1 146 . 1 1 A 17 17 TYR CA C 17 56.903 56.430 0.473 2
1 147 . 1 1 A 17 17 TYR CB C 17 40.103 40.378 -0.275 2
1 152 . 1 1 A 17 17 TYR N N 17 115.558 116.531 -0.973 2
1 153 . 1 1 A 18 18 SER H H 18 9.122 8.628 0.494 2
1 154 . 1 1 A 18 18 SER HA H 18 6.144 5.323 0.821 2
1 157 . 1 1 A 18 18 SER C C 18 173.204 175.369 -2.165 2
1 158 . 1 1 A 18 18 SER CA C 18 56.640 56.871 -0.231 2
1 159 . 1 1 A 18 18 SER CB C 18 68.788 66.148 2.640 2
1 160 . 1 1 A 18 18 SER N N 18 118.846 116.111 2.735 2
1 161 . 1 1 A 19 19 ASN H H 19 9.053 8.797 0.256 2
1 162 . 1 1 A 19 19 ASN HA H 19 4.473 4.930 -0.457 2
1 167 . 1 1 A 19 19 ASN C C 19 175.396 175.588 -0.192 2
1 168 . 1 1 A 19 19 ASN CA C 19 55.373 52.546 2.827 2
1 169 . 1 1 A 19 19 ASN CB C 19 36.900 38.013 -1.113 2
1 170 . 1 1 A 19 19 ASN N N 19 113.712 118.023 -4.311 2
1 172 . 1 1 A 20 20 LYS H H 20 7.677 7.999 -0.322 2
1 173 . 1 1 A 20 20 LYS HA H 20 4.413 4.561 -0.148 2
1 182 . 1 1 A 20 20 LYS C C 20 176.078 177.272 -1.194 2
1 183 . 1 1 A 20 20 LYS CA C 20 55.679 57.259 -1.580 2
1 184 . 1 1 A 20 20 LYS CB C 20 33.023 34.996 -1.973 2
1 188 . 1 1 A 20 20 LYS N N 20 117.213 118.601 -1.388 2
1 189 . 1 1 A 21 21 ASP H H 21 7.395 7.797 -0.402 2
1 190 . 1 1 A 21 21 ASP HA H 21 4.808 4.779 0.029 2
1 193 . 1 1 A 21 21 ASP C C 21 176.413 176.128 0.285 2
1 194 . 1 1 A 21 21 ASP CA C 21 53.983 53.728 0.255 2
1 195 . 1 1 A 21 21 ASP CB C 21 41.199 42.356 -1.157 2
1 196 . 1 1 A 21 21 ASP N N 21 119.879 116.774 3.105 2
1 197 . 1 1 A 22 22 THR H H 22 8.593 8.026 0.567 2
1 198 . 1 1 A 22 22 THR HA H 22 4.352 4.192 0.160 2
1 203 . 1 1 A 22 22 THR C C 22 172.913 174.281 -1.368 2
1 204 . 1 1 A 22 22 THR CA C 22 62.691 62.866 -0.175 2
1 205 . 1 1 A 22 22 THR CB C 22 68.332 66.570 1.762 2
1 207 . 1 1 A 22 22 THR N N 22 116.299 113.152 3.147 2
1 208 . 1 1 A 23 23 LEU H H 23 7.645 7.944 -0.300 2
1 209 . 1 1 A 23 23 LEU HA H 23 4.318 4.394 -0.076 2
1 219 . 1 1 A 23 23 LEU C C 23 176.692 176.138 0.554 2
1 220 . 1 1 A 23 23 LEU CA C 23 54.617 53.968 0.649 2
1 221 . 1 1 A 23 23 LEU CB C 23 41.939 40.778 1.161 2
1 225 . 1 1 A 23 23 LEU N N 23 123.606 121.520 2.086 2
1 226 . 1 1 A 24 24 ARG H H 24 8.563 7.739 0.824 2
1 227 . 1 1 A 24 24 ARG HA H 24 4.373 4.527 -0.154 2
1 235 . 1 1 A 24 24 ARG C C 24 176.584 175.842 0.742 2
1 236 . 1 1 A 24 24 ARG CA C 24 57.854 56.522 1.332 2
1 237 . 1 1 A 24 24 ARG CB C 24 31.126 30.287 0.839 2
1 240 . 1 1 A 24 24 ARG N N 24 127.152 123.579 3.573 2
1 242 . 1 1 A 25 25 LYS H H 25 8.633 8.531 0.102 2
1 243 . 1 1 A 25 25 LYS HA H 25 4.513 4.843 -0.330 2
1 251 . 1 1 A 25 25 LYS C C 25 173.567 174.503 -0.936 2
1 252 . 1 1 A 25 25 LYS CA C 25 54.792 54.651 0.141 2
1 253 . 1 1 A 25 25 LYS CB C 25 37.416 34.747 2.669 2
1 257 . 1 1 A 25 25 LYS N N 25 122.682 122.207 0.475 2
1 258 . 1 1 A 26 26 ARG H H 26 8.303 8.804 -0.501 2
1 259 . 1 1 A 26 26 ARG HA H 26 5.153 5.112 0.041 2
1 266 . 1 1 A 26 26 ARG C C 26 174.554 175.072 -0.518 2
1 267 . 1 1 A 26 26 ARG CA C 26 55.083 54.816 0.267 2
1 268 . 1 1 A 26 26 ARG CB C 26 32.789 31.884 0.905 2
1 271 . 1 1 A 26 26 ARG N N 26 121.819 124.698 -2.879 2
1 272 . 1 1 A 27 27 HIS H H 27 8.793 9.083 -0.290 2
1 273 . 1 1 A 27 27 HIS HA H 27 5.155 5.471 -0.316 2
1 278 . 1 1 A 27 27 HIS CA C 27 56.904 54.907 1.997 2
1 279 . 1 1 A 27 27 HIS CB C 27 34.683 31.752 2.931 2
1 282 . 1 1 A 27 27 HIS N N 27 122.102 120.764 1.338 2
1 283 . 1 1 A 28 28 TYR H H 28 9.273 8.283 0.990 2
1 284 . 1 1 A 28 28 TYR HA H 28 4.332 4.312 0.020 2
1 291 . 1 1 A 28 28 TYR C C 28 174.730 175.065 -0.335 2
1 292 . 1 1 A 28 28 TYR CA C 28 58.680 57.190 1.490 2
1 293 . 1 1 A 28 28 TYR CB C 28 38.673 37.898 0.775 2
1 298 . 1 1 A 28 28 TYR N N 28 125.605 121.496 4.109 2
1 299 . 1 1 A 29 29 TRP H H 29 9.273 8.898 0.375 2
1 300 . 1 1 A 29 29 TRP HA H 29 5.543 4.859 0.684 2
1 309 . 1 1 A 29 29 TRP C C 29 176.172 176.689 -0.517 2
1 310 . 1 1 A 29 29 TRP CA C 29 56.658 57.332 -0.674 2
1 311 . 1 1 A 29 29 TRP CB C 29 32.154 30.469 1.685 2
1 317 . 1 1 A 29 29 TRP N N 29 131.340 128.234 3.106 2
1 318 . 1 1 A 30 30 ARG H H 30 9.164 9.178 -0.014 2
1 319 . 1 1 A 30 30 ARG HA H 30 5.302 5.353 -0.051 2
1 327 . 1 1 A 30 30 ARG C C 30 174.774 174.430 0.344 2
1 328 . 1 1 A 30 30 ARG CA C 30 56.271 54.885 1.386 2
1 329 . 1 1 A 30 30 ARG CB C 30 34.203 33.456 0.747 2
1 332 . 1 1 A 30 30 ARG N N 30 116.040 121.538 -5.498 2
1 334 . 1 1 A 31 31 LEU H H 31 9.273 9.453 -0.180 2
1 335 . 1 1 A 31 31 LEU HA H 31 5.324 5.388 -0.064 2
1 345 . 1 1 A 31 31 LEU C C 31 174.488 174.543 -0.055 2
1 346 . 1 1 A 31 31 LEU CA C 31 53.807 53.485 0.322 2
1 347 . 1 1 A 31 31 LEU CB C 31 46.667 45.769 0.898 2
1 351 . 1 1 A 31 31 LEU N N 31 127.075 127.148 -0.073 2
1 352 . 1 1 A 32 32 ASP H H 32 8.854 8.759 0.095 2
1 353 . 1 1 A 32 32 ASP HA H 32 4.902 5.090 -0.188 2
1 356 . 1 1 A 32 32 ASP C C 32 173.474 176.506 -3.032 2
1 357 . 1 1 A 32 32 ASP CA C 32 53.104 52.328 0.776 2
1 358 . 1 1 A 32 32 ASP CB C 32 42.931 44.325 -1.394 2
1 359 . 1 1 A 32 32 ASP N N 32 129.349 125.319 4.030 2
1 360 . 1 1 A 33 33 CYS H H 33 8.153 8.804 -0.651 2
1 361 . 1 1 A 33 33 CYS HA H 33 4.323 4.435 -0.112 2
1 364 . 1 1 A 33 33 CYS C C 33 174.476 174.975 -0.499 2
1 365 . 1 1 A 33 33 CYS CA C 33 59.853 59.826 0.027 2
1 366 . 1 1 A 33 33 CYS CB C 33 27.508 27.372 0.136 2
1 367 . 1 1 A 33 33 CYS N N 33 108.439 119.446 -11.007 2
1 368 . 1 1 A 34 34 LYS H H 34 9.144 7.768 1.376 2
1 369 . 1 1 A 34 34 LYS HA H 34 4.616 4.428 0.188 2
1 378 . 1 1 A 34 34 LYS C C 34 177.601 176.261 1.340 2
1 379 . 1 1 A 34 34 LYS CA C 34 57.185 56.848 0.337 2
1 380 . 1 1 A 34 34 LYS CB C 34 35.623 34.989 0.634 2
1 384 . 1 1 A 34 34 LYS N N 34 119.884 118.675 1.209 2
1 385 . 1 1 A 35 35 CYS H H 35 9.102 7.710 1.392 2
1 386 . 1 1 A 35 35 CYS HA H 35 4.935 4.796 0.139 2
1 389 . 1 1 A 35 35 CYS C C 35 172.283 172.406 -0.123 2
1 390 . 1 1 A 35 35 CYS CA C 35 57.748 57.424 0.324 2
1 391 . 1 1 A 35 35 CYS CB C 35 31.537 31.399 0.138 2
1 392 . 1 1 A 35 35 CYS N N 35 120.317 114.125 6.192 2
1 393 . 1 1 A 36 36 ILE H H 36 8.213 8.957 -0.744 2
1 394 . 1 1 A 36 36 ILE HA H 36 4.617 4.875 -0.258 2
1 404 . 1 1 A 36 36 ILE C C 36 175.312 175.302 0.010 2
1 405 . 1 1 A 36 36 ILE CA C 36 60.967 60.395 0.572 2
1 406 . 1 1 A 36 36 ILE CB C 36 39.718 38.531 1.187 2
1 410 . 1 1 A 36 36 ILE N N 36 121.905 120.828 1.077 2
1 411 . 1 1 A 37 37 THR H H 37 9.076 8.717 0.359 2
1 412 . 1 1 A 37 37 THR HA H 37 4.364 4.502 -0.138 2
1 417 . 1 1 A 37 37 THR CA C 37 61.834 62.256 -0.422 2
1 418 . 1 1 A 37 37 THR CB C 37 69.237 70.090 -0.853 2
1 420 . 1 1 A 37 37 THR N N 37 122.500 123.084 -0.584 2
1 421 . 1 1 A 38 38 LEU H H 38 8.263 8.554 -0.291 2
1 422 . 1 1 A 38 38 LEU HA H 38 4.445 5.029 -0.584 2
1 432 . 1 1 A 38 38 LEU CA C 38 55.611 53.161 2.450 2
1 433 . 1 1 A 38 38 LEU CB C 38 42.702 45.167 -2.465 2
1 437 . 1 1 A 38 38 LEU N N 38 126.987 123.884 3.103 2
1 438 . 1 1 A 39 39 PHE H H 39 9.520 8.776 0.744 2
1 439 . 1 1 A 39 39 PHE HA H 39 4.998 5.033 -0.035 2
1 447 . 1 1 A 39 39 PHE CA C 39 57.331 56.420 0.911 2
1 448 . 1 1 A 39 39 PHE CB C 39 42.453 40.811 1.642 2
1 454 . 1 1 A 39 39 PHE N N 39 120.545 120.978 -0.433 2
1 455 . 1 1 A 40 40 GLN H H 40 9.878 8.891 0.987 2
1 456 . 1 1 A 40 40 GLN HA H 40 4.376 4.119 0.257 2
1 463 . 1 1 A 40 40 GLN CA C 40 59.513 59.177 0.336 2
1 464 . 1 1 A 40 40 GLN CB C 40 29.317 28.797 0.520 2
1 467 . 1 1 A 41 41 ASN H H 41 7.732 8.065 -0.333 2
1 468 . 1 1 A 41 41 ASN HA H 41 4.812 5.397 -0.585 2
1 473 . 1 1 A 41 41 ASN CA C 41 52.618 51.822 0.796 2
1 474 . 1 1 A 41 41 ASN CB C 41 39.362 41.934 -2.572 2
1 475 . 1 1 A 41 41 ASN N N 41 107.613 114.557 -6.944 2
1 477 . 1 1 A 42 42 ASN HA H 42 3.476 4.099 -0.623 2
1 482 . 1 1 A 42 42 ASN C C 42 173.607 176.251 -2.644 2
1 483 . 1 1 A 42 42 ASN CA C 42 54.888 55.161 -0.273 2
1 484 . 1 1 A 42 42 ASN CB C 42 35.613 37.976 -2.363 2
1 486 . 1 1 A 43 43 THR H H 43 8.394 7.731 0.663 2
1 487 . 1 1 A 43 43 THR HA H 43 4.403 4.463 -0.060 2
1 492 . 1 1 A 43 43 THR C C 43 174.464 173.953 0.511 2
1 493 . 1 1 A 43 43 THR CA C 43 61.978 62.156 -0.178 2
1 494 . 1 1 A 43 43 THR CB C 43 70.036 68.938 1.098 2
1 496 . 1 1 A 43 43 THR N N 43 111.795 109.417 2.378 2
1 497 . 1 1 A 44 44 THR H H 44 8.058 7.681 0.377 2
1 498 . 1 1 A 44 44 THR HA H 44 4.464 4.637 -0.173 2
1 503 . 1 1 A 44 44 THR CA C 44 61.599 60.974 0.625 2
1 504 . 1 1 A 44 44 THR CB C 44 69.137 70.270 -1.133 2
1 506 . 1 1 A 44 44 THR N N 44 116.514 116.890 -0.376 2
1 507 . 1 1 A 45 45 ASN H H 45 6.653 8.821 -2.168 2
1 508 . 1 1 A 45 45 ASN HA H 45 4.945 4.730 0.215 2
1 513 . 1 1 A 45 45 ASN CA C 45 53.227 55.145 -1.918 2
1 514 . 1 1 A 45 45 ASN CB C 45 38.483 39.170 -0.687 2
1 516 . 1 1 A 46 46 ARG H H 46 8.213 7.934 0.279 2
1 517 . 1 1 A 46 46 ARG HA H 46 4.583 4.608 -0.025 2
1 524 . 1 1 A 46 46 ARG CA C 46 55.487 55.491 -0.004 2
1 525 . 1 1 A 46 46 ARG CB C 46 31.153 31.586 -0.433 2
1 528 . 1 1 A 46 46 ARG N N 46 121.652 118.183 3.469 2
1 529 . 1 1 A 47 47 TYR H H 47 7.973 8.774 -0.801 2
1 536 . 1 1 A 47 47 TYR CB C 47 39.356 39.773 -0.417 2
1 541 . 1 1 A 48 48 TYR H H 48 9.023 8.677 0.347 2
1 542 . 1 1 A 48 48 TYR HA H 48 4.662 4.282 0.380 2
1 549 . 1 1 A 48 48 TYR CB C 48 39.863 40.342 -0.479 2
1 554 . 1 1 A 48 48 TYR N N 48 121.223 120.630 0.593 2
1 555 . 1 1 A 49 49 LYS H H 49 7.134 7.518 -0.384 2
1 556 . 1 1 A 49 49 LYS HA H 49 4.283 4.611 -0.328 2
1 565 . 1 1 A 49 49 LYS CA C 49 55.167 55.097 0.070 2
1 566 . 1 1 A 49 49 LYS CB C 49 36.699 35.924 0.775 2
1 570 . 1 1 A 49 49 LYS N N 49 117.339 117.496 -0.157 2
1 571 . 1 1 A 50 50 GLU H H 50 8.411 8.942 -0.531 2
1 572 . 1 1 A 50 50 GLU HA H 50 4.583 5.010 -0.427 2
1 577 . 1 1 A 50 50 GLU CA C 50 54.592 54.924 -0.332 2
1 578 . 1 1 A 50 50 GLU CB C 50 33.263 32.857 0.406 2
1 580 . 1 1 A 50 50 GLU N N 50 123.825 123.791 0.034 2
1 581 . 1 1 A 51 51 ILE H H 51 9.225 9.000 0.225 2
1 582 . 1 1 A 51 51 ILE HA H 51 4.277 4.621 -0.344 2
1 592 . 1 1 A 51 51 ILE CA C 51 58.182 58.139 0.043 2
1 593 . 1 1 A 51 51 ILE CB C 51 39.663 38.423 1.240 2
1 597 . 1 1 A 51 51 ILE N N 51 125.271 126.705 -1.434 2
1 598 . 1 1 A 52 52 PRO HA H 52 4.543 4.649 -0.106 2
1 605 . 1 1 A 52 52 PRO C C 52 178.340 178.073 0.267 2
1 606 . 1 1 A 52 52 PRO CA C 52 62.726 62.904 -0.178 2
1 607 . 1 1 A 52 52 PRO CB C 52 32.003 31.750 0.253 2
1 610 . 1 1 A 53 53 LEU H H 53 8.723 8.469 0.254 2
1 611 . 1 1 A 53 53 LEU HA H 53 3.891 3.894 -0.003 2
1 621 . 1 1 A 53 53 LEU C C 53 179.673 178.987 0.686 2
1 622 . 1 1 A 53 53 LEU CA C 53 58.205 57.534 0.671 2
1 623 . 1 1 A 53 53 LEU CB C 53 40.171 41.447 -1.276 2
1 627 . 1 1 A 53 53 LEU N N 53 125.150 124.283 0.867 2
1 628 . 1 1 A 54 54 SER H H 54 8.360 8.162 0.198 2
1 629 . 1 1 A 54 54 SER HA H 54 4.164 4.114 0.050 2
1 632 . 1 1 A 54 54 SER C C 54 175.517 177.313 -1.796 2
1 633 . 1 1 A 54 54 SER CA C 54 60.193 61.456 -1.263 2
1 634 . 1 1 A 54 54 SER CB C 54 62.617 62.671 -0.054 2
1 635 . 1 1 A 54 54 SER N N 54 111.266 114.418 -3.152 2
1 636 . 1 1 A 55 55 GLU H H 55 7.666 8.115 -0.449 2
1 637 . 1 1 A 55 55 GLU HA H 55 4.363 4.120 0.243 2
1 642 . 1 1 A 55 55 GLU C C 55 176.753 177.852 -1.099 2
1 643 . 1 1 A 55 55 GLU CA C 55 56.200 59.012 -2.812 2
1 644 . 1 1 A 55 55 GLU CB C 55 30.526 29.244 1.282 2
1 646 . 1 1 A 55 55 GLU N N 55 119.485 119.854 -0.369 2
1 647 . 1 1 A 56 56 ILE H H 56 7.601 7.115 0.486 2
1 648 . 1 1 A 56 56 ILE HA H 56 3.793 3.936 -0.143 2
1 658 . 1 1 A 56 56 ILE C C 56 175.142 175.940 -0.798 2
1 659 . 1 1 A 56 56 ILE CA C 56 63.518 62.343 1.175 2
1 660 . 1 1 A 56 56 ILE CB C 56 37.169 37.991 -0.822 2
1 664 . 1 1 A 56 56 ILE N N 56 120.430 120.167 0.263 2
1 665 . 1 1 A 57 57 LEU H H 57 9.263 9.287 -0.024 2
1 666 . 1 1 A 57 57 LEU HA H 57 4.343 4.386 -0.043 2
1 676 . 1 1 A 57 57 LEU C C 57 177.898 176.535 1.363 2
1 677 . 1 1 A 57 57 LEU CA C 57 56.569 55.899 0.670 2
1 678 . 1 1 A 57 57 LEU CB C 57 41.980 42.575 -0.595 2
1 682 . 1 1 A 57 57 LEU N N 57 129.464 129.057 0.407 2
1 683 . 1 1 A 58 58 THR H H 58 7.414 7.327 0.087 2
1 684 . 1 1 A 58 58 THR HA H 58 4.512 4.892 -0.380 2
1 689 . 1 1 A 58 58 THR C C 58 171.314 172.719 -1.405 2
1 690 . 1 1 A 58 58 THR CA C 58 60.562 61.270 -0.708 2
1 691 . 1 1 A 58 58 THR CB C 58 70.803 73.378 -2.575 2
1 693 . 1 1 A 58 58 THR N N 58 109.129 110.576 -1.447 2
1 694 . 1 1 A 59 59 VAL H H 59 8.152 8.466 -0.314 2
1 695 . 1 1 A 59 59 VAL HA H 59 5.061 5.049 0.012 2
1 703 . 1 1 A 59 59 VAL C C 59 174.985 174.951 0.034 2
1 704 . 1 1 A 59 59 VAL CA C 59 61.354 61.201 0.153 2
1 705 . 1 1 A 59 59 VAL CB C 59 33.855 34.085 -0.230 2
1 708 . 1 1 A 59 59 VAL N N 59 123.676 124.363 -0.687 2
1 709 . 1 1 A 60 60 GLU H H 60 9.074 8.725 0.349 2
1 710 . 1 1 A 60 60 GLU HA H 60 4.977 4.862 0.116 2
1 715 . 1 1 A 60 60 GLU C C 60 176.063 175.295 0.768 2
1 716 . 1 1 A 60 60 GLU CA C 60 53.807 54.328 -0.521 2
1 717 . 1 1 A 60 60 GLU CB C 60 33.739 33.544 0.195 2
1 719 . 1 1 A 60 60 GLU N N 60 125.125 126.055 -0.930 2
1 720 . 1 1 A 61 61 SER H H 61 8.763 8.683 0.080 2
1 721 . 1 1 A 61 61 SER HA H 61 4.452 4.978 -0.526 2
1 724 . 1 1 A 61 61 SER C C 61 173.288 174.286 -0.998 2
1 725 . 1 1 A 61 61 SER CA C 61 59.384 57.604 1.780 2
1 726 . 1 1 A 61 61 SER CB C 61 63.390 64.677 -1.287 2
1 727 . 1 1 A 61 61 SER N N 61 117.523 117.104 0.419 2
1 728 . 1 1 A 62 62 ALA H H 62 7.293 8.855 -1.562 2
1 729 . 1 1 A 62 62 ALA HA H 62 3.817 4.344 -0.527 2
1 733 . 1 1 A 62 62 ALA C C 62 176.717 177.838 -1.121 2
1 734 . 1 1 A 62 62 ALA CA C 62 53.966 53.044 0.922 2
1 735 . 1 1 A 62 62 ALA CB C 62 18.640 18.637 0.003 2
1 736 . 1 1 A 62 62 ALA N N 62 122.650 126.315 -3.665 2
1 737 . 1 1 A 63 63 GLN H H 63 8.736 8.225 0.511 2
1 738 . 1 1 A 63 63 GLN HA H 63 4.445 4.695 -0.250 2
1 745 . 1 1 A 63 63 GLN C C 63 173.700 175.001 -1.301 2
1 746 . 1 1 A 63 63 GLN CA C 63 56.376 55.714 0.663 2
1 747 . 1 1 A 63 63 GLN CB C 63 31.515 31.016 0.499 2
1 749 . 1 1 A 63 63 GLN N N 63 120.251 119.525 0.726 2
1 751 . 1 1 A 64 64 ASN H H 64 9.272 7.401 1.871 2
1 752 . 1 1 A 64 64 ASN HA H 64 4.906 5.080 -0.174 2
1 757 . 1 1 A 64 64 ASN C C 64 174.754 174.843 -0.089 2
1 758 . 1 1 A 64 64 ASN CA C 64 51.837 52.119 -0.282 2
1 759 . 1 1 A 64 64 ASN CB C 64 38.156 40.335 -2.179 2
1 760 . 1 1 A 64 64 ASN N N 64 122.346 118.650 3.696 2
1 762 . 1 1 A 65 65 PHE H H 65 8.854 9.128 -0.274 2
1 763 . 1 1 A 65 65 PHE HA H 65 4.947 5.156 -0.209 2
1 771 . 1 1 A 65 65 PHE C C 65 177.274 176.270 1.004 2
1 772 . 1 1 A 65 65 PHE CA C 65 57.519 56.998 0.521 2
1 773 . 1 1 A 65 65 PHE CB C 65 38.485 38.782 -0.297 2
1 779 . 1 1 A 65 65 PHE N N 65 123.638 125.398 -1.760 2
1 780 . 1 1 A 66 66 SER H H 66 8.163 8.116 0.047 2
1 781 . 1 1 A 66 66 SER HA H 66 4.393 4.454 -0.061 2
1 784 . 1 1 A 66 66 SER C C 66 175.699 176.692 -0.993 2
1 785 . 1 1 A 66 66 SER CA C 66 60.791 60.609 0.181 2
1 786 . 1 1 A 66 66 SER CB C 66 64.591 63.380 1.211 2
1 787 . 1 1 A 66 66 SER N N 66 113.913 115.898 -1.985 2
1 788 . 1 1 A 67 67 LEU H H 67 8.574 7.787 0.787 2
1 789 . 1 1 A 67 67 LEU HA H 67 4.302 3.857 0.445 2
1 799 . 1 1 A 67 67 LEU C C 67 176.269 177.221 -0.952 2
1 800 . 1 1 A 67 67 LEU CA C 67 55.601 57.955 -2.354 2
1 801 . 1 1 A 67 67 LEU CB C 67 42.021 42.079 -0.058 2
1 805 . 1 1 A 67 67 LEU N N 67 121.264 120.709 0.555 2
1 806 . 1 1 A 68 68 VAL H H 68 6.921 7.580 -0.659 2
1 807 . 1 1 A 68 68 VAL HA H 68 4.473 4.149 0.324 2
1 815 . 1 1 A 68 68 VAL C C 68 173.809 174.952 -1.144 2
1 816 . 1 1 A 68 68 VAL CA C 68 58.047 60.694 -2.647 2
1 817 . 1 1 A 68 68 VAL CB C 68 32.295 31.916 0.379 2
1 820 . 1 1 A 68 68 VAL N N 68 111.287 115.608 -4.321 2
1 821 . 1 1 A 69 69 PRO HA H 69 4.658 4.659 -0.001 2
1 828 . 1 1 A 69 69 PRO CA C 69 61.747 61.591 0.156 2
1 829 . 1 1 A 69 69 PRO CB C 69 30.693 32.147 -1.454 2
1 832 . 1 1 A 70 70 PRO HA H 70 4.414 4.321 0.093 2
1 839 . 1 1 A 70 70 PRO CA C 70 63.997 64.133 -0.136 2
1 840 . 1 1 A 70 70 PRO CB C 70 31.602 31.491 0.111 2
1 843 . 1 1 A 71 71 GLY H H 71 8.824 8.548 0.276 2
1 844 . 1 1 A 71 71 GLY HA2 H 71 3.703 3.951 -0.248 2
1 845 . 1 1 A 71 71 GLY HA3 H 71 4.193 3.955 0.238 2
1 846 . 1 1 A 71 71 GLY C C 71 174.052 173.905 0.148 2
1 847 . 1 1 A 71 71 GLY CA C 71 45.065 45.368 -0.303 2
1 848 . 1 1 A 71 71 GLY N N 71 111.845 108.886 2.959 2
1 849 . 1 1 A 72 72 THR H H 72 7.597 7.212 0.385 2
1 850 . 1 1 A 72 72 THR HA H 72 4.133 4.354 -0.221 2
1 855 . 1 1 A 72 72 THR CA C 72 63.129 62.302 0.827 2
1 856 . 1 1 A 72 72 THR CB C 72 69.560 70.014 -0.454 2
1 858 . 1 1 A 72 72 THR N N 72 117.485 115.228 2.257 2
1 859 . 1 1 A 73 73 ASN H H 73 9.280 8.536 0.744 2
1 860 . 1 1 A 73 73 ASN HA H 73 4.786 4.615 0.171 2
1 865 . 1 1 A 73 73 ASN CA C 73 52.009 52.166 -0.157 2
1 866 . 1 1 A 73 73 ASN CB C 73 37.553 38.307 -0.754 2
1 867 . 1 1 A 73 73 ASN N N 73 127.641 125.511 2.130 2
1 869 . 1 1 A 74 74 PRO HA H 74 4.752 4.836 -0.084 2
1 876 . 1 1 A 74 74 PRO C C 74 175.190 176.473 -1.283 2
1 877 . 1 1 A 74 74 PRO CA C 74 63.395 62.499 0.896 2
1 878 . 1 1 A 74 74 PRO CB C 74 33.164 33.072 0.092 2
1 881 . 1 1 A 75 75 HIS H H 75 8.025 8.854 -0.829 2
1 882 . 1 1 A 75 75 HIS HA H 75 5.047 5.124 -0.077 2
1 887 . 1 1 A 75 75 HIS C C 75 172.562 175.456 -2.894 2
1 888 . 1 1 A 75 75 HIS CA C 75 54.336 53.666 0.670 2
1 889 . 1 1 A 75 75 HIS CB C 75 30.956 33.259 -2.303 2
1 892 . 1 1 A 75 75 HIS N N 75 116.198 116.798 -0.600 2
1 893 . 1 1 A 76 76 CYS H H 76 8.343 9.412 -1.069 2
1 894 . 1 1 A 76 76 CYS HA H 76 4.594 4.459 0.135 2
1 897 . 1 1 A 76 76 CYS C C 76 175.651 174.927 0.724 2
1 898 . 1 1 A 76 76 CYS CA C 76 61.066 61.160 -0.094 2
1 899 . 1 1 A 76 76 CYS CB C 76 30.193 28.738 1.455 2
1 900 . 1 1 A 76 76 CYS N N 76 113.289 118.136 -4.847 2
1 901 . 1 1 A 77 77 PHE H H 77 8.433 7.857 0.576 2
1 902 . 1 1 A 77 77 PHE HA H 77 5.105 5.385 -0.280 2
1 910 . 1 1 A 77 77 PHE C C 77 171.822 172.984 -1.162 2
1 911 . 1 1 A 77 77 PHE CA C 77 56.874 55.693 1.181 2
1 912 . 1 1 A 77 77 PHE CB C 77 39.393 42.896 -3.503 2
1 918 . 1 1 A 77 77 PHE N N 77 114.874 115.169 -0.295 2
1 919 . 1 1 A 78 78 GLU H H 78 9.823 9.172 0.651 2
1 920 . 1 1 A 78 78 GLU HA H 78 5.333 5.155 0.178 2
1 925 . 1 1 A 78 78 GLU C C 78 175.602 175.499 0.103 2
1 926 . 1 1 A 78 78 GLU CA C 78 54.212 54.824 -0.612 2
1 927 . 1 1 A 78 78 GLU CB C 78 31.702 32.621 -0.919 2
1 929 . 1 1 A 78 78 GLU N N 78 121.074 118.959 2.115 2
1 930 . 1 1 A 79 79 ILE H H 79 9.093 9.053 0.040 2
1 931 . 1 1 A 79 79 ILE HA H 79 4.637 4.585 0.052 2
1 941 . 1 1 A 79 79 ILE C C 79 174.476 175.230 -0.754 2
1 942 . 1 1 A 79 79 ILE CA C 79 60.932 60.705 0.227 2
1 943 . 1 1 A 79 79 ILE CB C 79 40.803 37.390 3.413 2
1 947 . 1 1 A 79 79 ILE N N 79 121.382 125.021 -3.639 2
1 948 . 1 1 A 80 80 VAL H H 80 8.841 7.905 0.936 2
1 949 . 1 1 A 80 80 VAL HA H 80 4.425 3.865 0.560 2
1 957 . 1 1 A 80 80 VAL C C 80 175.930 175.345 0.585 2
1 958 . 1 1 A 80 80 VAL CA C 80 63.324 63.174 0.150 2
1 959 . 1 1 A 80 80 VAL CB C 80 32.783 31.171 1.612 2
1 962 . 1 1 A 80 80 VAL N N 80 128.970 127.398 1.572 2
1 963 . 1 1 A 81 81 THR H H 81 8.303 7.877 0.426 2
1 964 . 1 1 A 81 81 THR HA H 81 5.264 4.679 0.584 2
1 969 . 1 1 A 81 81 THR C C 81 173.664 174.577 -0.913 2
1 970 . 1 1 A 81 81 THR CA C 81 59.540 59.950 -0.410 2
1 971 . 1 1 A 81 81 THR CB C 81 72.197 71.310 0.887 2
1 973 . 1 1 A 81 81 THR N N 81 118.077 118.560 -0.483 2
1 974 . 1 1 A 82 82 ALA H H 82 9.586 8.499 1.087 2
1 975 . 1 1 A 82 82 ALA HA H 82 4.093 4.381 -0.288 2
1 979 . 1 1 A 82 82 ALA C C 82 178.667 177.774 0.893 2
1 980 . 1 1 A 82 82 ALA CA C 82 55.321 52.901 2.420 2
1 981 . 1 1 A 82 82 ALA CB C 82 18.094 18.502 -0.408 2
1 982 . 1 1 A 82 82 ALA N N 82 122.493 123.446 -0.953 2
1 983 . 1 1 A 83 83 ASN H H 83 7.923 8.391 -0.468 2
1 984 . 1 1 A 83 83 ASN HA H 83 4.808 5.077 -0.269 2
1 989 . 1 1 A 83 83 ASN C C 83 174.766 174.566 0.200 2
1 990 . 1 1 A 83 83 ASN CA C 83 53.333 54.746 -1.413 2
1 991 . 1 1 A 83 83 ASN CB C 83 40.335 41.626 -1.290 2
1 992 . 1 1 A 83 83 ASN N N 83 110.765 115.888 -5.123 2
1 994 . 1 1 A 84 84 ALA H H 84 7.352 7.163 0.189 2
1 995 . 1 1 A 84 84 ALA HA H 84 4.625 4.512 0.113 2
1 999 . 1 1 A 84 84 ALA C C 84 176.547 175.131 1.416 2
1 1000 . 1 1 A 84 84 ALA CA C 84 52.858 51.810 1.048 2
1 1001 . 1 1 A 84 84 ALA CB C 84 21.233 22.004 -0.771 2
1 1002 . 1 1 A 84 84 ALA N N 84 119.599 117.694 1.905 2
1 1003 . 1 1 A 85 85 THR H H 85 8.374 8.676 -0.302 2
1 1004 . 1 1 A 85 85 THR HA H 85 5.014 4.532 0.482 2
1 1009 . 1 1 A 85 85 THR C C 85 171.568 174.098 -2.530 2
1 1010 . 1 1 A 85 85 THR CA C 85 61.618 62.533 -0.915 2
1 1011 . 1 1 A 85 85 THR CB C 85 70.850 69.223 1.627 2
1 1013 . 1 1 A 85 85 THR N N 85 119.032 113.844 5.188 2
1 1014 . 1 1 A 86 86 TYR H H 86 9.006 8.998 0.008 2
1 1015 . 1 1 A 86 86 TYR HA H 86 4.658 4.898 -0.240 2
1 1022 . 1 1 A 86 86 TYR C C 86 173.773 175.358 -1.585 2
1 1023 . 1 1 A 86 86 TYR CA C 86 56.938 57.791 -0.853 2
1 1024 . 1 1 A 86 86 TYR CB C 86 39.513 40.080 -0.567 2
1 1029 . 1 1 A 86 86 TYR N N 86 123.494 127.186 -3.692 2
1 1030 . 1 1 A 87 87 PHE H H 87 9.263 8.809 0.454 2
1 1031 . 1 1 A 87 87 PHE HA H 87 4.127 4.676 -0.549 2
1 1039 . 1 1 A 87 87 PHE C C 87 176.369 174.159 2.211 2
1 1040 . 1 1 A 87 87 PHE CA C 87 57.238 55.689 1.549 2
1 1041 . 1 1 A 87 87 PHE CB C 87 37.086 38.471 -1.385 2
1 1047 . 1 1 A 87 87 PHE N N 87 125.384 119.793 5.591 2
1 1048 . 1 1 A 88 88 VAL H H 88 9.023 8.335 0.688 2
1 1049 . 1 1 A 88 88 VAL HA H 88 4.162 4.653 -0.491 2
1 1057 . 1 1 A 88 88 VAL C C 88 176.390 175.789 0.601 2
1 1058 . 1 1 A 88 88 VAL CA C 88 63.975 60.801 3.174 2
1 1059 . 1 1 A 88 88 VAL CB C 88 32.378 32.151 0.227 2
1 1062 . 1 1 A 88 88 VAL N N 88 127.348 124.306 3.042 2
1 1063 . 1 1 A 89 89 GLY H H 89 9.233 7.982 1.251 2
1 1064 . 1 1 A 89 89 GLY HA2 H 89 4.293 4.169 0.124 2
1 1065 . 1 1 A 89 89 GLY HA3 H 89 4.186 4.237 -0.051 2
1 1066 . 1 1 A 89 89 GLY C C 89 172.378 172.077 0.301 2
1 1067 . 1 1 A 89 89 GLY CA C 89 43.798 46.108 -2.310 2
1 1068 . 1 1 A 89 89 GLY N N 89 116.041 112.775 3.266 2
1 1069 . 1 1 A 90 90 GLU H H 90 8.532 8.462 0.070 2
1 1070 . 1 1 A 90 90 GLU HA H 90 4.794 4.768 0.026 2
1 1075 . 1 1 A 90 90 GLU C C 90 174.221 175.606 -1.385 2
1 1076 . 1 1 A 90 90 GLU CA C 90 56.393 55.394 1.000 2
1 1077 . 1 1 A 90 90 GLU CB C 90 33.182 31.959 1.223 2
1 1079 . 1 1 A 90 90 GLU N N 90 120.905 121.954 -1.049 2
1 1080 . 1 1 A 91 91 MET H H 91 8.450 8.598 -0.148 2
1 1081 . 1 1 A 91 91 MET HA H 91 4.904 5.040 -0.136 2
1 1089 . 1 1 A 91 91 MET C C 91 173.373 173.940 -0.567 2
1 1090 . 1 1 A 91 91 MET CA C 91 52.277 53.250 -0.973 2
1 1091 . 1 1 A 91 91 MET CB C 91 32.789 34.133 -1.344 2
1 1094 . 1 1 A 91 91 MET N N 91 125.173 120.806 4.367 2
1 1095 . 1 1 A 92 92 PRO HA H 92 4.358 4.454 -0.096 2
1 1102 . 1 1 A 92 92 PRO C C 92 177.589 176.752 0.837 2
1 1103 . 1 1 A 92 92 PRO CA C 92 63.143 63.250 -0.107 2
1 1104 . 1 1 A 92 92 PRO CB C 92 32.083 31.712 0.371 2
1 1107 . 1 1 A 93 93 GLY H H 93 8.330 8.334 -0.004 2
1 1108 . 1 1 A 93 93 GLY HA2 H 93 3.943 4.061 -0.118 2
1 1109 . 1 1 A 93 93 GLY HA3 H 93 4.045 4.064 -0.019 2
1 1110 . 1 1 A 93 93 GLY C C 93 174.730 173.721 1.009 2
1 1111 . 1 1 A 93 93 GLY CA C 93 45.276 45.555 -0.279 2
1 1112 . 1 1 A 93 93 GLY N N 93 109.420 110.326 -0.906 2
1 1113 . 1 1 A 94 94 GLY H H 94 8.331 8.328 0.003 2
1 1114 . 1 1 A 94 94 GLY HA2 H 94 3.973 4.058 -0.085 2
1 1115 . 1 1 A 94 94 GLY HA3 H 94 3.973 4.060 -0.087 2
1 1116 . 1 1 A 94 94 GLY C C 94 174.100 173.206 0.894 2
1 1117 . 1 1 A 94 94 GLY CA C 94 45.333 45.491 -0.158 2
1 1118 . 1 1 A 94 94 GLY N N 94 108.483 108.945 -0.462 2
1 1119 . 1 1 A 95 95 THR H H 95 8.095 8.330 -0.235 2
1 1120 . 1 1 A 95 95 THR HA H 95 4.643 4.838 -0.195 2
1 1125 . 1 1 A 95 95 THR C C 95 173.155 173.411 -0.256 2
1 1126 . 1 1 A 95 95 THR CA C 95 59.922 59.414 0.508 2
1 1127 . 1 1 A 95 95 THR CB C 95 69.871 69.640 0.231 2
1 1129 . 1 1 A 95 95 THR N N 95 115.860 113.115 2.745 2
1 1130 . 1 1 A 96 96 PRO HA H 96 4.400 4.455 -0.055 2
1 1137 . 1 1 A 96 96 PRO C C 96 177.565 176.918 0.647 2
1 1138 . 1 1 A 96 96 PRO CA C 96 64.047 63.318 0.729 2
1 1139 . 1 1 A 96 96 PRO CB C 96 31.816 31.359 0.457 2
1 1142 . 1 1 A 97 97 GLY H H 97 8.572 8.285 0.287 2
1 1143 . 1 1 A 97 97 GLY HA2 H 97 4.007 4.039 -0.032 2
1 1144 . 1 1 A 97 97 GLY HA3 H 97 4.007 4.040 -0.033 2
1 1145 . 1 1 A 97 97 GLY C C 97 174.609 174.069 0.540 2
1 1146 . 1 1 A 97 97 GLY CA C 97 45.276 45.631 -0.355 2
1 1147 . 1 1 A 97 97 GLY N N 97 110.233 110.200 0.033 2
1 1148 . 1 1 A 98 98 GLY H H 98 8.119 8.082 0.037 2
1 1149 . 1 1 A 98 98 GLY HA2 H 98 4.086 4.114 -0.028 2
1 1150 . 1 1 A 98 98 GLY HA3 H 98 4.200 4.117 0.083 2
1 1151 . 1 1 A 98 98 GLY CA C 98 44.876 45.053 -0.176 2
1 1152 . 1 1 A 98 98 GLY N N 98 108.845 109.270 -0.425 2
1 1153 . 1 1 A 99 99 PRO HA H 99 4.494 4.508 -0.014 2
1 1160 . 1 1 A 99 99 PRO C C 99 177.468 176.704 0.764 2
1 1161 . 1 1 A 99 99 PRO CA C 99 63.500 63.538 -0.038 2
1 1162 . 1 1 A 99 99 PRO CB C 99 32.013 31.722 0.291 2
1 1165 . 1 1 A 100 100 SER H H 100 8.472 8.222 0.250 2
1 1166 . 1 1 A 100 100 SER HA H 100 4.513 4.567 -0.054 2
1 1169 . 1 1 A 100 100 SER C C 100 175.408 174.263 1.145 2
1 1170 . 1 1 A 100 100 SER CA C 100 58.557 58.699 -0.142 2
1 1171 . 1 1 A 100 100 SER CB C 100 63.918 64.332 -0.415 2
1 1172 . 1 1 A 100 100 SER N N 100 116.038 115.545 0.493 2
1 1173 . 1 1 A 101 101 GLY H H 101 8.427 8.332 0.095 2
1 1174 . 1 1 A 101 101 GLY HA2 H 101 4.064 4.065 -0.001 2
1 1175 . 1 1 A 101 101 GLY HA3 H 101 4.064 4.072 -0.007 2
1 1176 . 1 1 A 101 101 GLY C C 101 174.730 173.648 1.082 2
1 1177 . 1 1 A 101 101 GLY CA C 101 45.575 45.785 -0.210 2
1 1178 . 1 1 A 101 101 GLY N N 101 110.558 110.534 0.024 2
1 1179 . 1 1 A 102 102 GLN H H 102 8.416 8.354 0.062 2
1 1180 . 1 1 A 102 102 GLN HA H 102 4.383 4.523 -0.140 2
1 1187 . 1 1 A 102 102 GLN C C 102 177.346 175.761 1.585 2
1 1188 . 1 1 A 102 102 GLN CA C 102 57.080 56.159 0.921 2
1 1189 . 1 1 A 102 102 GLN CB C 102 29.235 30.026 -0.791 2
1 1191 . 1 1 A 102 102 GLN N N 102 120.112 121.003 -0.891 2
1 1193 . 1 1 A 103 103 GLY H H 103 8.713 8.365 0.348 2
1 1194 . 1 1 A 103 103 GLY HA2 H 103 4.193 4.137 0.056 2
1 1195 . 1 1 A 103 103 GLY HA3 H 103 4.078 4.151 -0.073 2
1 1196 . 1 1 A 103 103 GLY C C 103 175.602 173.931 1.671 2
1 1197 . 1 1 A 103 103 GLY CA C 103 46.120 45.779 0.341 2
1 1198 . 1 1 A 103 103 GLY N N 103 109.817 110.413 -0.596 2
1 1199 . 1 1 A 104 104 ALA H H 104 8.366 8.113 0.253 2
1 1200 . 1 1 A 104 104 ALA HA H 104 4.449 4.582 -0.133 2
1 1204 . 1 1 A 104 104 ALA C C 104 179.188 178.347 0.841 2
1 1205 . 1 1 A 104 104 ALA CA C 104 54.230 52.935 1.295 2
1 1206 . 1 1 A 104 104 ALA CB C 104 19.080 20.455 -1.375 2
1 1207 . 1 1 A 104 104 ALA N N 104 124.808 121.362 3.446 2
1 1208 . 1 1 A 105 105 GLU H H 105 8.576 8.600 -0.024 2
1 1209 . 1 1 A 105 105 GLU HA H 105 4.161 4.118 0.043 2
1 1214 . 1 1 A 105 105 GLU C C 105 179.200 179.051 0.149 2
1 1215 . 1 1 A 105 105 GLU CA C 105 59.173 59.159 0.014 2
1 1216 . 1 1 A 105 105 GLU CB C 105 29.194 29.471 -0.277 2
1 1218 . 1 1 A 105 105 GLU N N 105 119.238 117.757 1.481 2
1 1219 . 1 1 A 106 106 ALA H H 106 8.381 8.192 0.189 2
1 1220 . 1 1 A 106 106 ALA HA H 106 4.283 4.131 0.152 2
1 1224 . 1 1 A 106 106 ALA C C 106 180.048 179.903 0.145 2
1 1225 . 1 1 A 106 106 ALA CA C 106 54.687 55.345 -0.658 2
1 1226 . 1 1 A 106 106 ALA CB C 106 18.341 18.713 -0.372 2
1 1227 . 1 1 A 106 106 ALA N N 106 123.327 122.642 0.685 2
1 1228 . 1 1 A 107 107 ALA H H 107 8.123 8.120 0.003 2
1 1229 . 1 1 A 107 107 ALA HA H 107 4.554 4.382 0.172 2
1 1233 . 1 1 A 107 107 ALA C C 107 179.757 179.951 -0.194 2
1 1234 . 1 1 A 107 107 ALA CA C 107 55.355 55.484 -0.129 2
1 1235 . 1 1 A 107 107 ALA CB C 107 18.939 18.516 0.423 2
1 1236 . 1 1 A 107 107 ALA N N 107 120.740 120.232 0.508 2
1 1237 . 1 1 A 108 108 ARG H H 108 8.403 8.056 0.347 2
1 1238 . 1 1 A 108 108 ARG HA H 108 4.254 4.119 0.135 2
1 1245 . 1 1 A 108 108 ARG C C 108 179.111 179.320 -0.209 2
1 1246 . 1 1 A 108 108 ARG CA C 108 59.015 58.975 0.040 2
1 1247 . 1 1 A 108 108 ARG CB C 108 29.752 29.992 -0.240 2
1 1250 . 1 1 A 108 108 ARG N N 108 119.531 117.688 1.843 2
1 1251 . 1 1 A 109 109 GLY H H 109 8.182 8.462 -0.280 2
1 1252 . 1 1 A 109 109 GLY HA2 H 109 3.822 3.648 0.174 2
1 1253 . 1 1 A 109 109 GLY HA3 H 109 3.822 3.680 0.142 2
1 1254 . 1 1 A 109 109 GLY C C 109 177.020 176.539 0.481 2
1 1255 . 1 1 A 109 109 GLY CA C 109 46.718 47.277 -0.559 2
1 1256 . 1 1 A 109 109 GLY N N 109 107.331 108.193 -0.862 2
1 1257 . 1 1 A 110 110 TRP H H 110 7.925 7.954 -0.029 2
1 1258 . 1 1 A 110 110 TRP HA H 110 3.963 4.553 -0.590 2
1 1267 . 1 1 A 110 110 TRP C C 110 176.691 177.996 -1.305 2
1 1268 . 1 1 A 110 110 TRP CA C 110 62.041 60.618 1.423 2
1 1269 . 1 1 A 110 110 TRP CB C 110 28.989 28.667 0.322 2
1 1275 . 1 1 A 110 110 TRP N N 110 122.304 121.670 0.634 2
1 1277 . 1 1 A 111 111 GLU H H 111 7.946 7.732 0.214 2
1 1278 . 1 1 A 111 111 GLU HA H 111 2.594 2.988 -0.394 2
1 1283 . 1 1 A 111 111 GLU C C 111 177.976 179.064 -1.088 2
1 1284 . 1 1 A 111 111 GLU CA C 111 60.193 58.973 1.220 2
1 1285 . 1 1 A 111 111 GLU CB C 111 29.277 29.324 -0.047 2
1 1287 . 1 1 A 111 111 GLU N N 111 121.755 119.119 2.636 2
1 1288 . 1 1 A 112 112 THR H H 112 7.993 7.620 0.373 2
1 1289 . 1 1 A 112 112 THR HA H 112 3.722 3.823 -0.101 2
1 1294 . 1 1 A 112 112 THR C C 112 176.038 175.839 0.199 2
1 1295 . 1 1 A 112 112 THR CA C 112 66.104 66.535 -0.431 2
1 1296 . 1 1 A 112 112 THR CB C 112 68.885 68.717 0.168 2
1 1298 . 1 1 A 112 112 THR N N 112 112.247 116.284 -4.037 2
1 1299 . 1 1 A 113 113 ALA H H 113 7.742 8.314 -0.572 2
1 1300 . 1 1 A 113 113 ALA HA H 113 4.029 3.974 0.055 2
1 1304 . 1 1 A 113 113 ALA C C 113 180.545 179.922 0.623 2
1 1305 . 1 1 A 113 113 ALA CA C 113 55.127 55.245 -0.118 2
1 1306 . 1 1 A 113 113 ALA CB C 113 18.854 18.404 0.450 2
1 1307 . 1 1 A 113 113 ALA N N 113 123.134 122.726 0.408 2
1 1308 . 1 1 A 114 114 ILE H H 114 8.472 8.515 -0.043 2
1 1309 . 1 1 A 114 114 ILE HA H 114 3.613 3.749 -0.136 2
1 1319 . 1 1 A 114 114 ILE C C 114 176.947 178.064 -1.117 2
1 1320 . 1 1 A 114 114 ILE CA C 114 66.016 65.181 0.835 2
1 1321 . 1 1 A 114 114 ILE CB C 114 38.335 37.927 0.408 2
1 1325 . 1 1 A 114 114 ILE N N 114 118.276 117.866 0.410 2
1 1326 . 1 1 A 115 115 ARG H H 115 8.181 7.961 0.220 2
1 1327 . 1 1 A 115 115 ARG HA H 115 3.835 3.916 -0.081 2
1 1334 . 1 1 A 115 115 ARG C C 115 179.588 179.096 0.492 2
1 1335 . 1 1 A 115 115 ARG CA C 115 61.072 60.055 1.017 2
1 1336 . 1 1 A 115 115 ARG CB C 115 29.975 29.865 0.110 2
1 1339 . 1 1 A 115 115 ARG N N 115 117.921 119.463 -1.542 2
1 1340 . 1 1 A 116 116 GLN H H 116 8.395 8.461 -0.066 2
1 1341 . 1 1 A 116 116 GLN HA H 116 4.030 4.053 -0.023 2
1 1348 . 1 1 A 116 116 GLN C C 116 178.716 178.847 -0.131 2
1 1349 . 1 1 A 116 116 GLN CA C 116 58.790 58.825 -0.035 2
1 1350 . 1 1 A 116 116 GLN CB C 116 28.248 28.441 -0.193 2
1 1352 . 1 1 A 116 116 GLN N N 116 116.842 118.844 -2.002 2
1 1354 . 1 1 A 117 117 ALA H H 117 7.902 8.141 -0.239 2
1 1355 . 1 1 A 117 117 ALA HA H 117 4.143 4.131 0.012 2
1 1359 . 1 1 A 117 117 ALA C C 117 179.685 180.213 -0.528 2
1 1360 . 1 1 A 117 117 ALA CA C 117 54.476 54.836 -0.360 2
1 1361 . 1 1 A 117 117 ALA CB C 117 18.300 18.332 -0.032 2
1 1362 . 1 1 A 117 117 ALA N N 117 122.828 122.847 -0.019 2
1 1363 . 1 1 A 118 118 LEU H H 118 7.904 8.018 -0.114 2
1 1364 . 1 1 A 118 118 LEU HA H 118 4.119 4.110 0.009 2
1 1374 . 1 1 A 118 118 LEU C C 118 178.437 178.710 -0.273 2
1 1375 . 1 1 A 118 118 LEU CA C 118 56.781 57.113 -0.332 2
1 1376 . 1 1 A 118 118 LEU CB C 118 42.371 41.827 0.544 2
1 1380 . 1 1 A 118 118 LEU N N 118 117.632 120.231 -2.599 2
1 1381 . 1 1 A 119 119 MET H H 119 7.673 8.069 -0.396 2
1 1382 . 1 1 A 119 119 MET HA H 119 4.442 4.232 0.210 2
1 1390 . 1 1 A 119 119 MET C C 119 176.680 177.956 -1.276 2
1 1391 . 1 1 A 119 119 MET CA C 119 56.432 57.911 -1.479 2
1 1392 . 1 1 A 119 119 MET CB C 119 32.769 31.769 1.000 2
1 1395 . 1 1 A 119 119 MET N N 119 117.286 117.626 -0.340 2
1 1396 . 1 1 A 120 120 SER H H 120 7.878 7.570 0.308 2
1 1397 . 1 1 A 120 120 SER HA H 120 4.500 4.360 0.140 2
1 1400 . 1 1 A 120 120 SER C C 120 174.742 175.448 -0.706 2
1 1401 . 1 1 A 120 120 SER CA C 120 58.962 60.035 -1.073 2
1 1402 . 1 1 A 120 120 SER CB C 120 63.853 63.203 0.650 2
1 1403 . 1 1 A 120 120 SER N N 120 115.064 113.820 1.244 2
1 1404 . 1 1 A 121 121 GLY H H 121 8.059 8.073 -0.014 2
1 1405 . 1 1 A 121 121 GLY HA2 H 121 4.231 3.952 0.279 2
1 1406 . 1 1 A 121 121 GLY HA3 H 121 4.112 3.953 0.159 2
1 1407 . 1 1 A 121 121 GLY C C 121 172.065 173.927 -1.862 2
1 1408 . 1 1 A 121 121 GLY CA C 121 45.030 45.876 -0.846 2
1 1409 . 1 1 A 121 121 GLY N N 121 110.271 109.303 0.968 2
1 1410 . 1 1 A 122 122 PRO HA H 122 4.496 4.528 -0.032 2
1 1417 . 1 1 A 122 122 PRO CA C 122 63.399 63.247 0.152 2
1 1418 . 1 1 A 122 122 PRO CB C 122 32.186 31.694 0.492 2
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