data_10263_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 10263
_Entry.PDB_ID 2DN7
_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 2 2 SER C C 2 174.723 173.654 1.069 1
1 2 . 1 1 1 A 2 2 SER CA C 2 58.446 59.044 -0.598 1
1 3 . 1 1 1 A 2 2 SER CB C 2 63.566 61.761 1.805 1
1 4 . 1 1 1 A 3 3 SER H H 3 8.350 8.601 -0.251 1
1 5 . 1 1 1 A 3 3 SER C C 3 173.961 174.366 -0.405 1
1 6 . 1 1 1 A 3 3 SER CA C 3 58.428 58.976 -0.548 1
1 7 . 1 1 1 A 3 3 SER CB C 3 63.937 60.969 2.968 1
1 8 . 1 1 1 A 3 3 SER N N 3 117.923 113.176 4.747 1
1 9 . 1 1 1 A 4 4 GLY H H 4 8.050 8.140 -0.090 1
1 10 . 1 1 1 A 4 4 GLY C C 4 179.009 174.870 4.139 1
1 11 . 1 1 1 A 4 4 GLY CA C 4 46.174 46.206 -0.032 1
1 12 . 1 1 1 A 4 4 GLY N N 4 116.890 110.629 6.261 1
1 13 . 1 1 1 A 7 7 GLY HA2 H 7 4.340 4.088 0.252 1
1 14 . 1 1 1 A 7 7 GLY HA3 H 7 3.629 4.089 -0.460 1
1 15 . 1 1 1 A 7 7 GLY CA C 7 44.381 44.339 0.042 1
1 16 . 1 1 1 A 8 8 PRO HA H 8 4.476 4.530 -0.054 1
1 23 . 1 1 1 A 8 8 PRO C C 8 176.235 177.270 -1.035 1
1 24 . 1 1 1 A 8 8 PRO CA C 8 62.995 62.590 0.405 1
1 25 . 1 1 1 A 8 8 PRO CB C 8 33.266 32.672 0.594 1
1 28 . 1 1 1 A 9 9 GLY H H 9 8.585 8.377 0.208 1
1 29 . 1 1 1 A 9 9 GLY HA2 H 9 4.326 4.125 0.201 1
1 30 . 1 1 1 A 9 9 GLY HA3 H 9 4.009 4.133 -0.124 1
1 31 . 1 1 1 A 9 9 GLY C C 9 172.998 172.993 0.005 1
1 32 . 1 1 1 A 9 9 GLY CA C 9 44.393 44.288 0.105 1
1 33 . 1 1 1 A 9 9 GLY N N 9 106.004 107.704 -1.700 1
1 34 . 1 1 1 A 10 10 ARG H H 10 8.548 8.530 0.018 1
1 35 . 1 1 1 A 10 10 ARG HA H 10 4.654 5.111 -0.457 1
1 41 . 1 1 1 A 10 10 ARG C C 10 175.780 174.707 1.073 1
1 42 . 1 1 1 A 10 10 ARG CA C 10 54.708 54.349 0.359 1
1 43 . 1 1 1 A 10 10 ARG CB C 10 31.448 31.738 -0.290 1
1 45 . 1 1 1 A 10 10 ARG N N 10 119.407 118.957 0.450 1
1 46 . 1 1 1 A 11 11 PRO HA H 11 4.611 4.616 -0.005 1
1 53 . 1 1 1 A 11 11 PRO C C 11 173.510 175.577 -2.067 1
1 54 . 1 1 1 A 11 11 PRO CA C 11 62.360 62.699 -0.339 1
1 55 . 1 1 1 A 11 11 PRO CB C 11 33.402 32.279 1.123 1
1 58 . 1 1 1 A 12 12 THR H H 12 7.572 8.500 -0.928 1
1 59 . 1 1 1 A 12 12 THR HA H 12 3.796 4.436 -0.640 1
1 64 . 1 1 1 A 12 12 THR C C 12 172.337 173.346 -1.009 1
1 65 . 1 1 1 A 12 12 THR CA C 12 61.778 61.660 0.118 1
1 66 . 1 1 1 A 12 12 THR CB C 12 70.561 68.773 1.788 1
1 68 . 1 1 1 A 12 12 THR N N 12 109.653 117.315 -7.662 1
1 69 . 1 1 1 A 13 13 MET H H 13 5.605 8.330 -2.725 1
1 70 . 1 1 1 A 13 13 MET HA H 13 5.091 4.898 0.193 1
1 78 . 1 1 1 A 13 13 MET C C 13 172.639 174.897 -2.258 1
1 79 . 1 1 1 A 13 13 MET CA C 13 54.168 53.563 0.605 1
1 80 . 1 1 1 A 13 13 MET CB C 13 37.632 34.273 3.359 1
1 83 . 1 1 1 A 13 13 MET N N 13 121.634 126.799 -5.165 1
1 84 . 1 1 1 A 14 14 MET H H 14 9.254 9.129 0.125 1
1 85 . 1 1 1 A 14 14 MET HA H 14 4.662 5.171 -0.509 1
1 93 . 1 1 1 A 14 14 MET C C 14 174.388 174.809 -0.421 1
1 94 . 1 1 1 A 14 14 MET CA C 14 54.673 54.306 0.367 1
1 95 . 1 1 1 A 14 14 MET CB C 14 34.907 35.103 -0.196 1
1 98 . 1 1 1 A 14 14 MET N N 14 125.746 123.891 1.855 1
1 99 . 1 1 1 A 15 15 ILE H H 15 8.555 9.245 -0.690 1
1 100 . 1 1 1 A 15 15 ILE HA H 15 4.882 5.032 -0.150 1
1 110 . 1 1 1 A 15 15 ILE C C 15 174.962 174.973 -0.011 1
1 111 . 1 1 1 A 15 15 ILE CA C 15 60.685 60.814 -0.129 1
1 112 . 1 1 1 A 15 15 ILE CB C 15 40.878 39.131 1.747 1
1 116 . 1 1 1 A 15 15 ILE N N 15 121.623 126.341 -4.718 1
1 117 . 1 1 1 A 16 16 SER H H 16 8.703 8.846 -0.143 1
1 118 . 1 1 1 A 16 16 SER HA H 16 4.922 5.072 -0.150 1
1 121 . 1 1 1 A 16 16 SER C C 16 173.860 173.240 0.620 1
1 122 . 1 1 1 A 16 16 SER CA C 16 56.524 57.451 -0.927 1
1 123 . 1 1 1 A 16 16 SER CB C 16 65.004 65.625 -0.621 1
1 124 . 1 1 1 A 16 16 SER N N 16 122.261 125.306 -3.045 1
1 125 . 1 1 1 A 17 17 THR H H 17 8.759 8.668 0.091 1
1 126 . 1 1 1 A 17 17 THR HA H 17 4.885 4.706 0.179 1
1 131 . 1 1 1 A 17 17 THR C C 17 175.018 174.646 0.372 1
1 132 . 1 1 1 A 17 17 THR CA C 17 60.315 61.104 -0.789 1
1 133 . 1 1 1 A 17 17 THR CB C 17 69.799 69.873 -0.074 1
1 135 . 1 1 1 A 17 17 THR N N 17 115.660 117.435 -1.775 1
1 136 . 1 1 1 A 18 18 THR H H 18 8.038 8.872 -0.834 1
1 137 . 1 1 1 A 18 18 THR HA H 18 4.596 4.420 0.176 1
1 142 . 1 1 1 A 18 18 THR CA C 18 60.707 62.228 -1.521 1
1 143 . 1 1 1 A 18 18 THR CB C 18 71.082 69.490 1.592 1
1 145 . 1 1 1 A 18 18 THR N N 18 112.362 115.566 -3.204 1
1 146 . 1 1 1 A 19 19 ALA H H 19 8.545 7.450 1.095 1
1 147 . 1 1 1 A 19 19 ALA HA H 19 4.412 4.356 0.056 1
1 151 . 1 1 1 A 19 19 ALA C C 19 177.034 177.169 -0.135 1
1 152 . 1 1 1 A 19 19 ALA CA C 19 52.264 51.975 0.289 1
1 153 . 1 1 1 A 19 19 ALA CB C 19 19.292 19.619 -0.327 1
1 154 . 1 1 1 A 19 19 ALA N N 19 119.589 123.526 -3.937 1
1 155 . 1 1 1 A 20 20 MET H H 20 8.145 8.600 -0.455 1
1 156 . 1 1 1 A 20 20 MET HA H 20 4.447 4.156 0.291 1
1 164 . 1 1 1 A 20 20 MET C C 20 175.676 176.836 -1.160 1
1 165 . 1 1 1 A 20 20 MET CA C 20 55.764 55.933 -0.169 1
1 166 . 1 1 1 A 20 20 MET CB C 20 31.495 32.318 -0.823 1
1 169 . 1 1 1 A 20 20 MET N N 20 116.950 120.112 -3.162 1
1 170 . 1 1 1 A 21 21 ASN H H 21 8.275 9.010 -0.735 1
1 171 . 1 1 1 A 21 21 ASN HA H 21 4.452 4.361 0.091 1
1 176 . 1 1 1 A 21 21 ASN C C 21 174.100 173.799 0.301 1
1 177 . 1 1 1 A 21 21 ASN CA C 21 54.320 54.622 -0.302 1
1 178 . 1 1 1 A 21 21 ASN CB C 21 37.234 37.155 0.079 1
1 179 . 1 1 1 A 21 21 ASN N N 21 113.198 119.239 -6.041 1
1 181 . 1 1 1 A 22 22 THR H H 22 7.071 7.078 -0.007 1
1 182 . 1 1 1 A 22 22 THR HA H 22 5.218 5.376 -0.158 1
1 187 . 1 1 1 A 22 22 THR C C 22 173.301 173.153 0.148 1
1 188 . 1 1 1 A 22 22 THR CA C 22 59.399 60.350 -0.951 1
1 189 . 1 1 1 A 22 22 THR CB C 22 72.714 72.083 0.631 1
1 191 . 1 1 1 A 22 22 THR N N 22 107.603 107.577 0.026 1
1 192 . 1 1 1 A 23 23 ALA H H 23 8.687 8.973 -0.286 1
1 193 . 1 1 1 A 23 23 ALA HA H 23 4.925 5.141 -0.216 1
1 197 . 1 1 1 A 23 23 ALA C C 23 174.100 175.403 -1.303 1
1 198 . 1 1 1 A 23 23 ALA CA C 23 50.812 50.106 0.706 1
1 199 . 1 1 1 A 23 23 ALA CB C 23 21.122 21.398 -0.276 1
1 200 . 1 1 1 A 23 23 ALA N N 23 121.937 125.445 -3.508 1
1 201 . 1 1 1 A 24 24 LEU H H 24 8.833 8.719 0.114 1
1 202 . 1 1 1 A 24 24 LEU HA H 24 4.673 4.602 0.071 1
1 212 . 1 1 1 A 24 24 LEU C C 24 175.140 174.549 0.591 1
1 213 . 1 1 1 A 24 24 LEU CA C 24 54.320 54.678 -0.358 1
1 214 . 1 1 1 A 24 24 LEU CB C 24 42.518 43.442 -0.924 1
1 218 . 1 1 1 A 24 24 LEU N N 24 123.721 126.260 -2.539 1
1 219 . 1 1 1 A 25 25 LEU H H 25 9.176 9.109 0.067 1
1 220 . 1 1 1 A 25 25 LEU HA H 25 5.112 5.033 0.079 1
1 230 . 1 1 1 A 25 25 LEU C C 25 176.414 175.880 0.534 1
1 231 . 1 1 1 A 25 25 LEU CA C 25 54.108 53.123 0.985 1
1 232 . 1 1 1 A 25 25 LEU CB C 25 43.230 43.104 0.126 1
1 236 . 1 1 1 A 25 25 LEU N N 25 128.589 128.650 -0.061 1
1 237 . 1 1 1 A 26 26 GLN H H 26 8.556 8.491 0.065 1
1 238 . 1 1 1 A 26 26 GLN HA H 26 4.737 4.938 -0.201 1
1 245 . 1 1 1 A 26 26 GLN C C 26 174.372 174.230 0.142 1
1 246 . 1 1 1 A 26 26 GLN CA C 26 56.365 54.481 1.884 1
1 247 . 1 1 1 A 26 26 GLN CB C 26 33.320 31.935 1.385 1
1 249 . 1 1 1 A 26 26 GLN N N 26 119.630 122.861 -3.231 1
1 251 . 1 1 1 A 27 27 TRP H H 27 8.080 8.247 -0.167 1
1 252 . 1 1 1 A 27 27 TRP HA H 27 5.441 5.769 -0.328 1
1 261 . 1 1 1 A 27 27 TRP CA C 27 55.957 54.390 1.567 1
1 262 . 1 1 1 A 27 27 TRP CB C 27 32.517 32.221 0.296 1
1 268 . 1 1 1 A 27 27 TRP N N 27 121.276 121.563 -0.287 1
1 270 . 1 1 1 A 28 28 HIS H H 28 8.262 8.493 -0.231 1
1 271 . 1 1 1 A 28 28 HIS HA H 28 4.997 5.021 -0.024 1
1 275 . 1 1 1 A 28 28 HIS CA C 28 53.028 53.935 -0.907 1
1 276 . 1 1 1 A 28 28 HIS CB C 28 32.832 32.913 -0.081 1
1 278 . 1 1 1 A 28 28 HIS N N 28 116.245 116.836 -0.591 1
1 279 . 1 1 1 A 29 29 PRO HA H 29 4.984 4.716 0.268 1
1 286 . 1 1 1 A 29 29 PRO CA C 29 61.498 62.099 -0.601 1
1 287 . 1 1 1 A 29 29 PRO CB C 29 30.709 32.217 -1.508 1
1 290 . 1 1 1 A 30 30 PRO HA H 30 4.449 4.689 -0.240 1
1 297 . 1 1 1 A 30 30 PRO C C 30 175.733 176.473 -0.740 1
1 298 . 1 1 1 A 30 30 PRO CA C 30 62.245 62.593 -0.348 1
1 299 . 1 1 1 A 30 30 PRO CB C 30 32.083 33.522 -1.439 1
1 302 . 1 1 1 A 31 31 LYS H H 31 8.403 8.774 -0.371 1
1 303 . 1 1 1 A 31 31 LYS HA H 31 4.084 4.435 -0.351 1
1 312 . 1 1 1 A 31 31 LYS C C 31 177.166 178.389 -1.223 1
1 313 . 1 1 1 A 31 31 LYS CA C 31 57.866 57.532 0.334 1
1 314 . 1 1 1 A 31 31 LYS CB C 31 32.698 34.056 -1.358 1
1 318 . 1 1 1 A 31 31 LYS N N 31 121.693 121.303 0.390 1
1 319 . 1 1 1 A 32 32 GLU H H 32 8.102 7.832 0.270 1
1 320 . 1 1 1 A 32 32 GLU HA H 32 4.365 4.441 -0.076 1
1 325 . 1 1 1 A 32 32 GLU C C 32 174.248 176.212 -1.964 1
1 326 . 1 1 1 A 32 32 GLU CA C 32 55.448 55.886 -0.438 1
1 327 . 1 1 1 A 32 32 GLU CB C 32 29.405 30.252 -0.847 1
1 329 . 1 1 1 A 32 32 GLU N N 32 118.742 116.850 1.892 1
1 330 . 1 1 1 A 33 33 LEU H H 33 8.420 7.573 0.847 1
1 331 . 1 1 1 A 33 33 LEU HA H 33 4.499 4.732 -0.233 1
1 341 . 1 1 1 A 33 33 LEU C C 33 173.036 174.976 -1.940 1
1 342 . 1 1 1 A 33 33 LEU CA C 33 52.863 51.881 0.982 1
1 343 . 1 1 1 A 33 33 LEU CB C 33 42.535 43.334 -0.799 1
1 347 . 1 1 1 A 33 33 LEU N N 33 125.181 123.840 1.341 1
1 348 . 1 1 1 A 34 34 PRO HA H 34 4.488 4.512 -0.024 1
1 355 . 1 1 1 A 34 34 PRO C C 34 177.544 176.576 0.968 1
1 356 . 1 1 1 A 34 34 PRO CA C 34 62.889 63.059 -0.170 1
1 357 . 1 1 1 A 34 34 PRO CB C 34 31.472 30.922 0.550 1
1 360 . 1 1 1 A 35 35 GLY H H 35 8.397 7.990 0.407 1
1 361 . 1 1 1 A 35 35 GLY HA2 H 35 4.059 4.146 -0.087 1
1 362 . 1 1 1 A 35 35 GLY HA3 H 35 3.716 4.146 -0.430 1
1 363 . 1 1 1 A 35 35 GLY C C 35 173.356 171.515 1.841 1
1 364 . 1 1 1 A 35 35 GLY CA C 35 45.892 44.760 1.132 1
1 365 . 1 1 1 A 35 35 GLY N N 35 110.524 111.881 -1.357 1
1 366 . 1 1 1 A 36 36 GLU H H 36 8.091 8.711 -0.620 1
1 367 . 1 1 1 A 36 36 GLU HA H 36 4.371 5.116 -0.745 1
1 372 . 1 1 1 A 36 36 GLU C C 36 174.864 175.083 -0.219 1
1 373 . 1 1 1 A 36 36 GLU CA C 36 55.201 54.674 0.527 1
1 374 . 1 1 1 A 36 36 GLU CB C 36 31.878 33.781 -1.903 1
1 376 . 1 1 1 A 36 36 GLU N N 36 122.202 122.800 -0.598 1
1 377 . 1 1 1 A 37 37 LEU H H 37 8.307 8.683 -0.376 1
1 378 . 1 1 1 A 37 37 LEU HA H 37 4.288 4.273 0.015 1
1 388 . 1 1 1 A 37 37 LEU C C 37 176.702 176.031 0.671 1
1 389 . 1 1 1 A 37 37 LEU CA C 37 55.342 56.428 -1.086 1
1 390 . 1 1 1 A 37 37 LEU CB C 37 42.715 42.157 0.558 1
1 394 . 1 1 1 A 37 37 LEU N N 37 123.204 127.162 -3.958 1
1 395 . 1 1 1 A 38 38 LEU H H 38 8.909 8.787 0.122 1
1 396 . 1 1 1 A 38 38 LEU HA H 38 4.640 4.636 0.004 1
1 406 . 1 1 1 A 38 38 LEU C C 38 177.202 176.695 0.507 1
1 407 . 1 1 1 A 38 38 LEU CA C 38 54.390 55.122 -0.732 1
1 408 . 1 1 1 A 38 38 LEU CB C 38 43.770 43.428 0.342 1
1 412 . 1 1 1 A 38 38 LEU N N 38 123.021 127.667 -4.646 1
1 413 . 1 1 1 A 39 39 GLY H H 39 7.113 6.956 0.157 1
1 414 . 1 1 1 A 39 39 GLY HA2 H 39 4.816 3.579 1.237 1
1 415 . 1 1 1 A 39 39 GLY HA3 H 39 3.276 3.920 -0.644 1
1 416 . 1 1 1 A 39 39 GLY C C 39 169.863 170.353 -0.490 1
1 417 . 1 1 1 A 39 39 GLY CA C 39 44.622 45.468 -0.846 1
1 418 . 1 1 1 A 39 39 GLY N N 39 104.137 103.970 0.167 1
1 419 . 1 1 1 A 40 40 TYR H H 40 8.318 8.952 -0.634 1
1 420 . 1 1 1 A 40 40 TYR HA H 40 5.414 5.108 0.306 1
1 425 . 1 1 1 A 40 40 TYR C C 40 174.448 172.136 2.312 1
1 426 . 1 1 1 A 40 40 TYR CA C 40 56.178 56.636 -0.458 1
1 427 . 1 1 1 A 40 40 TYR CB C 40 44.191 40.517 3.674 1
1 430 . 1 1 1 A 40 40 TYR N N 40 114.036 115.579 -1.543 1
1 431 . 1 1 1 A 41 41 ARG H H 41 9.347 8.785 0.562 1
1 432 . 1 1 1 A 41 41 ARG HA H 41 5.092 5.434 -0.342 1
1 440 . 1 1 1 A 41 41 ARG C C 41 174.097 174.131 -0.034 1
1 441 . 1 1 1 A 41 41 ARG CA C 41 56.100 54.333 1.767 1
1 442 . 1 1 1 A 41 41 ARG CB C 41 34.508 32.884 1.624 1
1 445 . 1 1 1 A 41 41 ARG N N 41 122.231 121.109 1.122 1
1 447 . 1 1 1 A 42 42 LEU H H 42 9.546 8.967 0.579 1
1 448 . 1 1 1 A 42 42 LEU HA H 42 5.459 5.207 0.252 1
1 458 . 1 1 1 A 42 42 LEU C C 42 174.913 174.815 0.098 1
1 459 . 1 1 1 A 42 42 LEU CA C 42 52.997 53.486 -0.489 1
1 460 . 1 1 1 A 42 42 LEU CB C 42 46.413 45.930 0.483 1
1 464 . 1 1 1 A 42 42 LEU N N 42 132.335 127.107 5.228 1
1 465 . 1 1 1 A 43 43 GLN H H 43 9.502 9.334 0.168 1
1 466 . 1 1 1 A 43 43 GLN HA H 43 5.847 5.231 0.616 1
1 473 . 1 1 1 A 43 43 GLN C C 43 175.329 174.189 1.140 1
1 474 . 1 1 1 A 43 43 GLN CA C 43 54.005 54.464 -0.459 1
1 475 . 1 1 1 A 43 43 GLN CB C 43 33.429 31.980 1.449 1
1 477 . 1 1 1 A 43 43 GLN N N 43 123.932 125.526 -1.594 1
1 479 . 1 1 1 A 44 44 TYR H H 44 8.615 8.527 0.088 1
1 480 . 1 1 1 A 44 44 TYR HA H 44 5.783 5.552 0.231 1
1 487 . 1 1 1 A 44 44 TYR C C 44 174.058 173.440 0.618 1
1 488 . 1 1 1 A 44 44 TYR CA C 44 55.942 56.344 -0.402 1
1 489 . 1 1 1 A 44 44 TYR CB C 44 43.052 41.409 1.643 1
1 494 . 1 1 1 A 44 44 TYR N N 44 117.355 119.530 -2.175 1
1 495 . 1 1 1 A 45 45 CYS H H 45 8.377 8.183 0.194 1
1 496 . 1 1 1 A 45 45 CYS HA H 45 4.772 5.017 -0.245 1
1 499 . 1 1 1 A 45 45 CYS C C 45 173.205 173.745 -0.540 1
1 500 . 1 1 1 A 45 45 CYS CA C 45 55.960 57.813 -1.853 1
1 501 . 1 1 1 A 45 45 CYS CB C 45 30.665 31.544 -0.879 1
1 502 . 1 1 1 A 45 45 CYS N N 45 115.140 118.708 -3.568 1
1 503 . 1 1 1 A 46 46 ARG H H 46 9.165 8.474 0.691 1
1 504 . 1 1 1 A 46 46 ARG HA H 46 4.068 3.887 0.181 1
1 511 . 1 1 1 A 46 46 ARG C C 46 178.440 177.416 1.024 1
1 512 . 1 1 1 A 46 46 ARG CA C 46 56.401 55.546 0.855 1
1 513 . 1 1 1 A 46 46 ARG CB C 46 31.878 30.767 1.111 1
1 516 . 1 1 1 A 46 46 ARG N N 46 121.803 122.494 -0.691 1
1 517 . 1 1 1 A 47 47 ALA H H 47 8.273 8.137 0.136 1
1 518 . 1 1 1 A 47 47 ALA HA H 47 3.891 4.151 -0.260 1
1 522 . 1 1 1 A 47 47 ALA C C 47 177.599 177.499 0.100 1
1 523 . 1 1 1 A 47 47 ALA CA C 47 54.796 53.496 1.300 1
1 524 . 1 1 1 A 47 47 ALA CB C 47 18.287 18.701 -0.414 1
1 525 . 1 1 1 A 47 47 ALA N N 47 123.895 123.858 0.037 1
1 526 . 1 1 1 A 48 48 ASP H H 48 8.036 8.117 -0.081 1
1 527 . 1 1 1 A 48 48 ASP HA H 48 4.453 4.798 -0.345 1
1 530 . 1 1 1 A 48 48 ASP C C 48 175.836 175.940 -0.104 1
1 531 . 1 1 1 A 48 48 ASP CA C 48 53.368 53.263 0.105 1
1 532 . 1 1 1 A 48 48 ASP CB C 48 39.964 41.650 -1.686 1
1 533 . 1 1 1 A 48 48 ASP N N 48 112.576 117.335 -4.759 1
1 534 . 1 1 1 A 49 49 GLU H H 49 7.495 7.472 0.023 1
1 535 . 1 1 1 A 49 49 GLU HA H 49 4.308 4.605 -0.297 1
1 540 . 1 1 1 A 49 49 GLU C C 49 175.756 175.818 -0.062 1
1 541 . 1 1 1 A 49 49 GLU CA C 49 56.224 54.901 1.323 1
1 542 . 1 1 1 A 49 49 GLU CB C 49 32.248 31.323 0.925 1
1 544 . 1 1 1 A 49 49 GLU N N 49 120.609 119.385 1.224 1
1 545 . 1 1 1 A 50 50 ALA H H 50 8.416 8.425 -0.009 1
1 546 . 1 1 1 A 50 50 ALA HA H 50 4.200 4.429 -0.229 1
1 550 . 1 1 1 A 50 50 ALA C C 50 177.433 176.402 1.031 1
1 551 . 1 1 1 A 50 50 ALA CA C 50 53.297 52.087 1.210 1
1 552 . 1 1 1 A 50 50 ALA CB C 50 19.474 19.881 -0.407 1
1 553 . 1 1 1 A 50 50 ALA N N 50 124.065 124.327 -0.262 1
1 554 . 1 1 1 A 51 51 ARG H H 51 7.648 7.724 -0.076 1
1 555 . 1 1 1 A 51 51 ARG HA H 51 4.747 4.590 0.157 1
1 562 . 1 1 1 A 51 51 ARG C C 51 173.400 173.614 -0.214 1
1 563 . 1 1 1 A 51 51 ARG CA C 51 52.592 52.757 -0.165 1
1 564 . 1 1 1 A 51 51 ARG CB C 51 31.212 30.748 0.464 1
1 567 . 1 1 1 A 51 51 ARG N N 51 117.798 118.826 -1.028 1
1 568 . 1 1 1 A 52 52 PRO HA H 52 4.212 4.512 -0.300 1
1 575 . 1 1 1 A 52 52 PRO C C 52 176.380 176.540 -0.160 1
1 576 . 1 1 1 A 52 52 PRO CA C 52 62.360 62.570 -0.210 1
1 577 . 1 1 1 A 52 52 PRO CB C 52 32.331 32.260 0.071 1
1 580 . 1 1 1 A 53 53 ASN H H 53 8.127 8.192 -0.065 1
1 581 . 1 1 1 A 53 53 ASN HA H 53 4.651 4.765 -0.114 1
1 586 . 1 1 1 A 53 53 ASN C C 53 174.354 174.511 -0.157 1
1 587 . 1 1 1 A 53 53 ASN CA C 53 53.136 52.616 0.520 1
1 588 . 1 1 1 A 53 53 ASN CB C 53 39.666 38.110 1.556 1
1 589 . 1 1 1 A 53 53 ASN N N 53 119.405 119.530 -0.125 1
1 591 . 1 1 1 A 54 54 THR H H 54 8.425 8.637 -0.212 1
1 592 . 1 1 1 A 54 54 THR HA H 54 5.306 4.527 0.779 1
1 597 . 1 1 1 A 54 54 THR C C 54 173.850 174.091 -0.241 1
1 598 . 1 1 1 A 54 54 THR CA C 54 61.881 62.967 -1.086 1
1 599 . 1 1 1 A 54 54 THR CB C 54 70.573 69.816 0.757 1
1 601 . 1 1 1 A 54 54 THR N N 54 118.968 121.560 -2.592 1
1 602 . 1 1 1 A 55 55 ILE H H 55 9.354 8.303 1.051 1
1 603 . 1 1 1 A 55 55 ILE HA H 55 4.051 4.473 -0.422 1
1 613 . 1 1 1 A 55 55 ILE C C 55 172.975 173.472 -0.497 1
1 614 . 1 1 1 A 55 55 ILE CA C 55 61.003 59.932 1.071 1
1 615 . 1 1 1 A 55 55 ILE CB C 55 41.619 42.040 -0.421 1
1 619 . 1 1 1 A 55 55 ILE N N 55 127.961 124.953 3.008 1
1 620 . 1 1 1 A 56 56 ASP H H 56 8.132 8.711 -0.579 1
1 621 . 1 1 1 A 56 56 ASP HA H 56 5.334 5.156 0.178 1
1 624 . 1 1 1 A 56 56 ASP C C 56 174.969 174.666 0.303 1
1 625 . 1 1 1 A 56 56 ASP CA C 56 53.702 52.600 1.102 1
1 626 . 1 1 1 A 56 56 ASP CB C 56 43.251 42.278 0.973 1
1 627 . 1 1 1 A 56 56 ASP N N 56 125.882 127.115 -1.233 1
1 628 . 1 1 1 A 57 57 PHE H H 57 8.955 8.921 0.034 1
1 629 . 1 1 1 A 57 57 PHE HA H 57 4.915 5.072 -0.157 1
1 637 . 1 1 1 A 57 57 PHE C C 57 177.361 175.834 1.527 1
1 638 . 1 1 1 A 57 57 PHE CA C 57 57.458 56.283 1.175 1
1 639 . 1 1 1 A 57 57 PHE CB C 57 43.737 43.499 0.238 1
1 645 . 1 1 1 A 57 57 PHE N N 57 118.872 123.940 -5.068 1
1 646 . 1 1 1 A 58 58 GLY H H 58 9.552 9.205 0.347 1
1 647 . 1 1 1 A 58 58 GLY HA2 H 58 4.662 4.130 0.532 1
1 648 . 1 1 1 A 58 58 GLY HA3 H 58 4.126 4.195 -0.069 1
1 649 . 1 1 1 A 58 58 GLY C C 58 174.760 175.045 -0.285 1
1 650 . 1 1 1 A 58 58 GLY CA C 58 44.680 45.132 -0.452 1
1 651 . 1 1 1 A 58 58 GLY N N 58 111.551 109.875 1.676 1
1 652 . 1 1 1 A 59 59 LYS H H 59 8.211 8.659 -0.448 1
1 653 . 1 1 1 A 59 59 LYS HA H 59 3.782 3.642 0.140 1
1 662 . 1 1 1 A 59 59 LYS C C 59 176.154 178.023 -1.869 1
1 663 . 1 1 1 A 59 59 LYS CA C 59 59.080 58.696 0.384 1
1 664 . 1 1 1 A 59 59 LYS CB C 59 32.516 31.745 0.771 1
1 668 . 1 1 1 A 59 59 LYS N N 59 115.953 120.585 -4.632 1
1 669 . 1 1 1 A 60 60 ASP H H 60 8.634 8.088 0.546 1
1 670 . 1 1 1 A 60 60 ASP HA H 60 4.882 4.528 0.354 1
1 673 . 1 1 1 A 60 60 ASP C C 60 176.039 177.140 -1.101 1
1 674 . 1 1 1 A 60 60 ASP CA C 60 54.327 56.685 -2.358 1
1 675 . 1 1 1 A 60 60 ASP CB C 60 41.461 40.618 0.843 1
1 676 . 1 1 1 A 60 60 ASP N N 60 117.261 118.608 -1.347 1
1 677 . 1 1 1 A 61 61 ASP H H 61 7.500 8.504 -1.004 1
1 678 . 1 1 1 A 61 61 ASP HA H 61 4.591 4.650 -0.059 1
1 681 . 1 1 1 A 61 61 ASP C C 61 175.140 175.822 -0.682 1
1 682 . 1 1 1 A 61 61 ASP CA C 61 55.342 54.160 1.182 1
1 683 . 1 1 1 A 61 61 ASP CB C 61 42.475 40.057 2.418 1
1 684 . 1 1 1 A 61 61 ASP N N 61 122.319 118.739 3.580 1
1 685 . 1 1 1 A 62 62 GLN H H 62 8.239 7.894 0.345 1
1 686 . 1 1 1 A 62 62 GLN HA H 62 2.569 3.573 -1.004 1
1 693 . 1 1 1 A 62 62 GLN C C 62 172.652 173.557 -0.905 1
1 694 . 1 1 1 A 62 62 GLN CA C 62 54.038 55.388 -1.350 1
1 695 . 1 1 1 A 62 62 GLN CB C 62 31.481 29.323 2.158 1
1 697 . 1 1 1 A 62 62 GLN N N 62 117.458 123.367 -5.909 1
1 699 . 1 1 1 A 63 63 HIS H H 63 6.338 6.763 -0.425 1
1 700 . 1 1 1 A 63 63 HIS HA H 63 4.423 4.431 -0.008 1
1 704 . 1 1 1 A 63 63 HIS C C 63 173.031 172.504 0.527 1
1 705 . 1 1 1 A 63 63 HIS CA C 63 54.743 54.099 0.644 1
1 706 . 1 1 1 A 63 63 HIS CB C 63 32.661 31.166 1.495 1
1 708 . 1 1 1 A 63 63 HIS N N 63 113.589 116.130 -2.541 1
1 709 . 1 1 1 A 64 64 PHE H H 64 8.549 9.032 -0.483 1
1 710 . 1 1 1 A 64 64 PHE HA H 64 4.578 5.178 -0.600 1
1 718 . 1 1 1 A 64 64 PHE C C 64 173.015 173.319 -0.304 1
1 719 . 1 1 1 A 64 64 PHE CA C 64 58.516 57.050 1.466 1
1 720 . 1 1 1 A 64 64 PHE CB C 64 43.525 43.182 0.343 1
1 726 . 1 1 1 A 64 64 PHE N N 64 118.214 119.983 -1.769 1
1 727 . 1 1 1 A 65 65 THR H H 65 7.150 7.899 -0.749 1
1 728 . 1 1 1 A 65 65 THR HA H 65 4.930 4.709 0.221 1
1 733 . 1 1 1 A 65 65 THR C C 65 172.457 173.109 -0.652 1
1 734 . 1 1 1 A 65 65 THR CA C 65 61.690 61.520 0.170 1
1 735 . 1 1 1 A 65 65 THR CB C 65 69.593 69.482 0.111 1
1 737 . 1 1 1 A 65 65 THR N N 65 123.198 118.913 4.285 1
1 738 . 1 1 1 A 66 66 VAL H H 66 8.888 8.496 0.392 1
1 739 . 1 1 1 A 66 66 VAL HA H 66 4.018 4.801 -0.783 1
1 747 . 1 1 1 A 66 66 VAL C C 66 174.868 175.269 -0.401 1
1 748 . 1 1 1 A 66 66 VAL CA C 66 61.178 60.443 0.735 1
1 749 . 1 1 1 A 66 66 VAL CB C 66 33.114 33.333 -0.219 1
1 752 . 1 1 1 A 66 66 VAL N N 66 126.840 128.426 -1.586 1
1 753 . 1 1 1 A 67 67 THR H H 67 8.174 8.480 -0.306 1
1 754 . 1 1 1 A 67 67 THR HA H 67 4.816 5.053 -0.237 1
1 759 . 1 1 1 A 67 67 THR C C 67 174.494 174.273 0.221 1
1 760 . 1 1 1 A 67 67 THR CA C 67 59.786 59.546 0.240 1
1 761 . 1 1 1 A 67 67 THR CB C 67 70.887 71.658 -0.771 1
1 763 . 1 1 1 A 67 67 THR N N 67 116.127 117.139 -1.012 1
1 764 . 1 1 1 A 68 68 GLY H H 68 8.570 8.842 -0.272 1
1 765 . 1 1 1 A 68 68 GLY HA2 H 68 3.970 4.003 -0.033 1
1 766 . 1 1 1 A 68 68 GLY HA3 H 68 3.819 4.019 -0.200 1
1 767 . 1 1 1 A 68 68 GLY C C 68 175.636 174.623 1.013 1
1 768 . 1 1 1 A 68 68 GLY CA C 68 46.397 45.160 1.237 1
1 769 . 1 1 1 A 68 68 GLY N N 68 107.146 113.117 -5.971 1
1 770 . 1 1 1 A 69 69 LEU H H 69 8.007 7.507 0.500 1
1 771 . 1 1 1 A 69 69 LEU HA H 69 4.154 4.257 -0.103 1
1 781 . 1 1 1 A 69 69 LEU C C 69 176.830 176.532 0.298 1
1 782 . 1 1 1 A 69 69 LEU CA C 69 54.602 55.223 -0.621 1
1 783 . 1 1 1 A 69 69 LEU CB C 69 41.149 41.908 -0.759 1
1 787 . 1 1 1 A 69 69 LEU N N 69 118.433 122.822 -4.389 1
1 788 . 1 1 1 A 70 70 HIS H H 70 8.866 8.371 0.495 1
1 789 . 1 1 1 A 70 70 HIS HA H 70 4.663 4.677 -0.014 1
1 793 . 1 1 1 A 70 70 HIS C C 70 176.667 175.834 0.833 1
1 794 . 1 1 1 A 70 70 HIS CA C 70 55.464 57.153 -1.689 1
1 795 . 1 1 1 A 70 70 HIS CB C 70 32.125 30.050 2.075 1
1 797 . 1 1 1 A 70 70 HIS N N 70 122.457 122.366 0.091 1
1 798 . 1 1 1 A 71 71 LYS H H 71 8.716 8.635 0.081 1
1 799 . 1 1 1 A 71 71 LYS HA H 71 4.320 4.516 -0.196 1
1 808 . 1 1 1 A 71 71 LYS C C 71 178.110 176.760 1.350 1
1 809 . 1 1 1 A 71 71 LYS CA C 71 57.035 56.331 0.704 1
1 810 . 1 1 1 A 71 71 LYS CB C 71 33.580 33.025 0.555 1
1 814 . 1 1 1 A 71 71 LYS N N 71 123.173 123.990 -0.817 1
1 815 . 1 1 1 A 72 72 GLY H H 72 7.709 8.757 -1.048 1
1 816 . 1 1 1 A 72 72 GLY HA2 H 72 3.800 3.916 -0.116 1
1 817 . 1 1 1 A 72 72 GLY HA3 H 72 3.769 3.921 -0.152 1
1 818 . 1 1 1 A 72 72 GLY C C 72 174.231 173.783 0.448 1
1 819 . 1 1 1 A 72 72 GLY CA C 72 47.866 46.421 1.445 1
1 820 . 1 1 1 A 72 72 GLY N N 72 114.881 110.332 4.549 1
1 821 . 1 1 1 A 73 73 THR H H 73 8.162 7.567 0.595 1
1 822 . 1 1 1 A 73 73 THR HA H 73 4.584 4.739 -0.155 1
1 827 . 1 1 1 A 73 73 THR C C 73 172.208 173.397 -1.189 1
1 828 . 1 1 1 A 73 73 THR CA C 73 62.307 61.241 1.066 1
1 829 . 1 1 1 A 73 73 THR CB C 73 72.123 71.889 0.234 1
1 831 . 1 1 1 A 73 73 THR N N 73 114.225 114.323 -0.098 1
1 832 . 1 1 1 A 74 74 THR H H 74 8.743 8.801 -0.058 1
1 833 . 1 1 1 A 74 74 THR HA H 74 5.138 4.913 0.225 1
1 838 . 1 1 1 A 74 74 THR C C 74 173.376 173.341 0.035 1
1 839 . 1 1 1 A 74 74 THR CA C 74 62.724 63.037 -0.313 1
1 840 . 1 1 1 A 74 74 THR CB C 74 69.202 69.653 -0.451 1
1 842 . 1 1 1 A 74 74 THR N N 74 123.376 121.488 1.888 1
1 843 . 1 1 1 A 75 75 TYR H H 75 9.549 9.098 0.451 1
1 844 . 1 1 1 A 75 75 TYR HA H 75 4.892 5.215 -0.323 1
1 851 . 1 1 1 A 75 75 TYR C C 75 173.991 175.416 -1.425 1
1 852 . 1 1 1 A 75 75 TYR CA C 75 57.740 56.071 1.669 1
1 853 . 1 1 1 A 75 75 TYR CB C 75 44.580 42.878 1.702 1
1 858 . 1 1 1 A 75 75 TYR N N 75 126.916 125.853 1.063 1
1 859 . 1 1 1 A 76 76 ILE H H 76 8.769 8.704 0.065 1
1 860 . 1 1 1 A 76 76 ILE HA H 76 4.663 4.907 -0.244 1
1 870 . 1 1 1 A 76 76 ILE C C 76 174.683 175.302 -0.619 1
1 871 . 1 1 1 A 76 76 ILE CA C 76 60.455 60.727 -0.272 1
1 872 . 1 1 1 A 76 76 ILE CB C 76 40.284 39.947 0.337 1
1 876 . 1 1 1 A 76 76 ILE N N 76 119.407 120.722 -1.315 1
1 877 . 1 1 1 A 77 77 PHE H H 77 8.894 9.022 -0.128 1
1 878 . 1 1 1 A 77 77 PHE HA H 77 5.160 5.075 0.085 1
1 886 . 1 1 1 A 77 77 PHE C C 77 174.794 175.597 -0.803 1
1 887 . 1 1 1 A 77 77 PHE CA C 77 56.831 57.638 -0.807 1
1 888 . 1 1 1 A 77 77 PHE CB C 77 43.132 41.052 2.080 1
1 894 . 1 1 1 A 77 77 PHE N N 77 124.622 127.366 -2.744 1
1 895 . 1 1 1 A 78 78 ARG H H 78 9.407 9.322 0.085 1
1 896 . 1 1 1 A 78 78 ARG HA H 78 5.689 5.750 -0.061 1
1 904 . 1 1 1 A 78 78 ARG C C 78 174.376 174.721 -0.345 1
1 905 . 1 1 1 A 78 78 ARG CA C 78 54.530 54.626 -0.096 1
1 906 . 1 1 1 A 78 78 ARG CB C 78 34.473 33.925 0.548 1
1 909 . 1 1 1 A 78 78 ARG N N 78 120.055 121.048 -0.993 1
1 911 . 1 1 1 A 79 79 LEU H H 79 9.132 8.620 0.512 1
1 912 . 1 1 1 A 79 79 LEU HA H 79 5.398 5.007 0.391 1
1 922 . 1 1 1 A 79 79 LEU C C 79 174.006 174.224 -0.218 1
1 923 . 1 1 1 A 79 79 LEU CA C 79 53.401 53.306 0.095 1
1 924 . 1 1 1 A 79 79 LEU CB C 79 48.116 46.557 1.559 1
1 928 . 1 1 1 A 79 79 LEU N N 79 124.907 124.187 0.720 1
1 929 . 1 1 1 A 80 80 ALA H H 80 8.737 8.041 0.696 1
1 930 . 1 1 1 A 80 80 ALA HA H 80 4.871 5.047 -0.176 1
1 934 . 1 1 1 A 80 80 ALA C C 80 176.057 175.737 0.320 1
1 935 . 1 1 1 A 80 80 ALA CA C 80 50.353 51.026 -0.673 1
1 936 . 1 1 1 A 80 80 ALA CB C 80 23.972 23.525 0.447 1
1 937 . 1 1 1 A 80 80 ALA N N 80 128.220 125.972 2.248 1
1 938 . 1 1 1 A 81 81 ALA H H 81 9.890 8.601 1.289 1
1 939 . 1 1 1 A 81 81 ALA HA H 81 4.794 5.171 -0.377 1
1 943 . 1 1 1 A 81 81 ALA C C 81 174.655 176.033 -1.378 1
1 944 . 1 1 1 A 81 81 ALA CA C 81 50.300 50.921 -0.621 1
1 945 . 1 1 1 A 81 81 ALA CB C 81 21.369 20.972 0.397 1
1 946 . 1 1 1 A 81 81 ALA N N 81 123.682 123.179 0.503 1
1 947 . 1 1 1 A 82 82 LYS H H 82 7.965 8.830 -0.865 1
1 948 . 1 1 1 A 82 82 LYS HA H 82 4.974 5.416 -0.442 1
1 957 . 1 1 1 A 82 82 LYS C C 82 175.671 175.231 0.440 1
1 958 . 1 1 1 A 82 82 LYS CA C 82 54.664 54.694 -0.030 1
1 959 . 1 1 1 A 82 82 LYS CB C 82 36.677 35.428 1.249 1
1 963 . 1 1 1 A 82 82 LYS N N 82 118.164 122.462 -4.298 1
1 964 . 1 1 1 A 83 83 ASN H H 83 8.663 8.894 -0.231 1
1 965 . 1 1 1 A 83 83 ASN HA H 83 5.113 5.070 0.043 1
1 970 . 1 1 1 A 83 83 ASN C C 83 176.582 176.828 -0.246 1
1 971 . 1 1 1 A 83 83 ASN CA C 83 51.746 50.662 1.084 1
1 972 . 1 1 1 A 83 83 ASN CB C 83 40.357 40.201 0.156 1
1 973 . 1 1 1 A 83 83 ASN N N 83 124.784 123.952 0.832 1
1 975 . 1 1 1 A 84 84 ARG H H 84 8.873 8.737 0.136 1
1 976 . 1 1 1 A 84 84 ARG HA H 84 3.940 4.010 -0.070 1
1 983 . 1 1 1 A 84 84 ARG C C 84 176.735 177.469 -0.734 1
1 984 . 1 1 1 A 84 84 ARG CA C 84 59.327 59.019 0.308 1
1 985 . 1 1 1 A 84 84 ARG CB C 84 29.282 29.921 -0.639 1
1 988 . 1 1 1 A 84 84 ARG N N 84 117.891 119.267 -1.376 1
1 989 . 1 1 1 A 85 85 ALA H H 85 7.645 7.782 -0.137 1
1 990 . 1 1 1 A 85 85 ALA HA H 85 4.276 4.307 -0.031 1
1 994 . 1 1 1 A 85 85 ALA C C 85 177.479 177.052 0.427 1
1 995 . 1 1 1 A 85 85 ALA CA C 85 52.818 52.683 0.135 1
1 996 . 1 1 1 A 85 85 ALA CB C 85 18.806 19.897 -1.091 1
1 997 . 1 1 1 A 85 85 ALA N N 85 120.306 120.617 -0.311 1
1 998 . 1 1 1 A 86 86 GLY H H 86 7.693 7.518 0.175 1
1 999 . 1 1 1 A 86 86 GLY HA2 H 86 4.456 4.111 0.345 1
1 1000 . 1 1 1 A 86 86 GLY HA3 H 86 3.649 4.114 -0.465 1
1 1001 . 1 1 1 A 86 86 GLY C C 86 172.068 172.412 -0.344 1
1 1002 . 1 1 1 A 86 86 GLY CA C 86 44.375 44.352 0.023 1
1 1003 . 1 1 1 A 86 86 GLY N N 86 106.594 103.850 2.744 1
1 1004 . 1 1 1 A 87 87 LEU H H 87 8.203 8.370 -0.167 1
1 1005 . 1 1 1 A 87 87 LEU HA H 87 4.629 4.843 -0.214 1
1 1015 . 1 1 1 A 87 87 LEU C C 87 179.155 176.290 2.865 1
1 1016 . 1 1 1 A 87 87 LEU CA C 87 54.814 54.749 0.065 1
1 1017 . 1 1 1 A 87 87 LEU CB C 87 43.454 42.339 1.115 1
1 1021 . 1 1 1 A 87 87 LEU N N 87 120.879 122.065 -1.186 1
1 1022 . 1 1 1 A 88 88 GLY H H 88 8.492 8.254 0.238 1
1 1023 . 1 1 1 A 88 88 GLY HA2 H 88 4.339 4.175 0.164 1
1 1024 . 1 1 1 A 88 88 GLY HA3 H 88 4.122 4.182 -0.060 1
1 1025 . 1 1 1 A 88 88 GLY C C 88 173.030 173.430 -0.400 1
1 1026 . 1 1 1 A 88 88 GLY CA C 88 43.970 44.651 -0.681 1
1 1027 . 1 1 1 A 88 88 GLY N N 88 109.903 110.299 -0.396 1
1 1028 . 1 1 1 A 89 89 GLU H H 89 7.638 8.817 -1.179 1
1 1029 . 1 1 1 A 89 89 GLU HA H 89 4.103 4.254 -0.151 1
1 1034 . 1 1 1 A 89 89 GLU C C 89 177.511 175.957 1.554 1
1 1035 . 1 1 1 A 89 89 GLU CA C 89 56.659 57.170 -0.511 1
1 1036 . 1 1 1 A 89 89 GLU CB C 89 31.324 30.664 0.660 1
1 1038 . 1 1 1 A 89 89 GLU N N 89 117.551 121.993 -4.442 1
1 1039 . 1 1 1 A 90 90 GLU H H 90 8.734 8.713 0.021 1
1 1040 . 1 1 1 A 90 90 GLU HA H 90 4.651 5.360 -0.709 1
1 1045 . 1 1 1 A 90 90 GLU C C 90 177.452 174.649 2.803 1
1 1046 . 1 1 1 A 90 90 GLU CA C 90 55.987 55.000 0.987 1
1 1047 . 1 1 1 A 90 90 GLU CB C 90 31.135 33.293 -2.158 1
1 1049 . 1 1 1 A 90 90 GLU N N 90 121.553 120.081 1.472 1
1 1050 . 1 1 1 A 91 91 PHE H H 91 9.411 9.233 0.178 1
1 1051 . 1 1 1 A 91 91 PHE HA H 91 4.665 5.028 -0.363 1
1 1059 . 1 1 1 A 91 91 PHE C C 91 173.944 174.311 -0.367 1
1 1060 . 1 1 1 A 91 91 PHE CA C 91 57.687 57.829 -0.142 1
1 1061 . 1 1 1 A 91 91 PHE CB C 91 40.890 41.596 -0.706 1
1 1067 . 1 1 1 A 91 91 PHE N N 91 125.459 124.526 0.933 1
1 1068 . 1 1 1 A 92 92 GLU H H 92 8.043 8.331 -0.288 1
1 1069 . 1 1 1 A 92 92 GLU HA H 92 5.424 5.276 0.148 1
1 1074 . 1 1 1 A 92 92 GLU C C 92 174.295 174.651 -0.356 1
1 1075 . 1 1 1 A 92 92 GLU CA C 92 54.378 54.691 -0.313 1
1 1076 . 1 1 1 A 92 92 GLU CB C 92 33.662 33.421 0.241 1
1 1078 . 1 1 1 A 92 92 GLU N N 92 128.905 127.698 1.207 1
1 1079 . 1 1 1 A 93 93 LYS H H 93 9.142 8.632 0.510 1
1 1080 . 1 1 1 A 93 93 LYS HA H 93 4.541 5.168 -0.627 1
1 1089 . 1 1 1 A 93 93 LYS C C 93 173.366 173.966 -0.600 1
1 1090 . 1 1 1 A 93 93 LYS CA C 93 55.343 55.652 -0.309 1
1 1091 . 1 1 1 A 93 93 LYS CB C 93 37.317 35.975 1.342 1
1 1095 . 1 1 1 A 93 93 LYS N N 93 125.231 127.024 -1.793 1
1 1096 . 1 1 1 A 94 94 GLU H H 94 8.655 9.221 -0.566 1
1 1097 . 1 1 1 A 94 94 GLU HA H 94 5.558 5.437 0.121 1
1 1102 . 1 1 1 A 94 94 GLU C C 94 176.238 175.593 0.645 1
1 1103 . 1 1 1 A 94 94 GLU CA C 94 54.632 55.050 -0.418 1
1 1104 . 1 1 1 A 94 94 GLU CB C 94 32.166 33.021 -0.855 1
1 1106 . 1 1 1 A 94 94 GLU N N 94 127.232 128.177 -0.945 1
1 1107 . 1 1 1 A 95 95 ILE H H 95 9.302 8.848 0.454 1
1 1108 . 1 1 1 A 95 95 ILE HA H 95 4.794 5.250 -0.456 1
1 1118 . 1 1 1 A 95 95 ILE C C 95 173.138 174.456 -1.318 1
1 1119 . 1 1 1 A 95 95 ILE CA C 95 58.570 58.360 0.210 1
1 1120 . 1 1 1 A 95 95 ILE CB C 95 42.420 42.807 -0.387 1
1 1124 . 1 1 1 A 95 95 ILE N N 95 120.711 121.110 -0.399 1
1 1125 . 1 1 1 A 96 96 ARG H H 96 8.589 8.754 -0.165 1
1 1126 . 1 1 1 A 96 96 ARG HA H 96 5.373 4.760 0.613 1
1 1133 . 1 1 1 A 96 96 ARG C C 96 177.147 175.025 2.122 1
1 1134 . 1 1 1 A 96 96 ARG CA C 96 54.045 55.275 -1.230 1
1 1135 . 1 1 1 A 96 96 ARG CB C 96 32.001 33.827 -1.826 1
1 1138 . 1 1 1 A 96 96 ARG N N 96 124.445 121.972 2.473 1
1 1139 . 1 1 1 A 97 97 THR H H 97 9.243 8.596 0.647 1
1 1140 . 1 1 1 A 97 97 THR HA H 97 4.459 4.670 -0.211 1
1 1145 . 1 1 1 A 97 97 THR C C 97 172.745 173.937 -1.192 1
1 1146 . 1 1 1 A 97 97 THR CA C 97 59.637 60.668 -1.031 1
1 1147 . 1 1 1 A 97 97 THR CB C 97 67.687 68.817 -1.130 1
1 1149 . 1 1 1 A 97 97 THR N N 97 119.370 118.533 0.837 1
1 1150 . 1 1 1 A 98 98 PRO HA H 98 4.494 4.711 -0.217 1
1 1157 . 1 1 1 A 98 98 PRO CA C 98 63.117 62.691 0.426 1
1 1158 . 1 1 1 A 98 98 PRO CB C 98 32.500 31.867 0.633 1
1 1161 . 1 1 1 A 99 99 GLU H H 99 8.534 8.394 0.140 1
1 1162 . 1 1 1 A 99 99 GLU HA H 99 4.195 4.367 -0.172 1
1 1167 . 1 1 1 A 99 99 GLU C C 99 175.881 175.875 0.006 1
1 1168 . 1 1 1 A 99 99 GLU CA C 99 56.330 55.840 0.490 1
1 1169 . 1 1 1 A 99 99 GLU CB C 99 31.062 30.416 0.646 1
1 1171 . 1 1 1 A 99 99 GLU N N 99 119.688 119.029 0.659 1
1 1172 . 1 1 1 A 100 100 ASP H H 100 8.536 8.583 -0.047 1
1 1173 . 1 1 1 A 100 100 ASP HA H 100 4.607 4.770 -0.163 1
1 1176 . 1 1 1 A 100 100 ASP C C 100 176.012 175.966 0.046 1
1 1177 . 1 1 1 A 100 100 ASP CA C 100 54.109 53.999 0.110 1
1 1178 . 1 1 1 A 100 100 ASP CB C 100 41.562 42.058 -0.496 1
1 1179 . 1 1 1 A 100 100 ASP N N 100 119.803 120.274 -0.471 1
1 1180 . 1 1 1 A 101 101 LEU H H 101 8.403 9.046 -0.643 1
1 1181 . 1 1 1 A 101 101 LEU HA H 101 4.426 4.485 -0.059 1
1 1191 . 1 1 1 A 101 101 LEU C C 101 177.534 176.678 0.856 1
1 1192 . 1 1 1 A 101 101 LEU CA C 101 55.113 56.745 -1.632 1
1 1193 . 1 1 1 A 101 101 LEU CB C 101 42.156 43.983 -1.827 1
1 1197 . 1 1 1 A 101 101 LEU N N 101 123.876 123.578 0.298 1
1 1198 . 1 1 1 A 102 102 SER H H 102 8.413 8.052 0.361 1
1 1199 . 1 1 1 A 102 102 SER HA H 102 4.434 4.122 0.312 1
1 1202 . 1 1 1 A 102 102 SER C C 102 174.674 174.119 0.555 1
1 1203 . 1 1 1 A 102 102 SER CA C 102 58.798 59.425 -0.627 1
1 1204 . 1 1 1 A 102 102 SER CB C 102 63.854 61.366 2.488 1
1 1205 . 1 1 1 A 102 102 SER N N 102 116.667 113.799 2.868 1
1 1206 . 1 1 1 A 103 103 GLY H H 103 8.213 8.144 0.069 1
1 1207 . 1 1 1 A 103 103 GLY HA2 H 103 4.164 4.045 0.119 1
1 1208 . 1 1 1 A 103 103 GLY HA3 H 103 4.057 4.045 0.012 1
1 1209 . 1 1 1 A 103 103 GLY C C 103 171.822 172.948 -1.126 1
1 1210 . 1 1 1 A 103 103 GLY CA C 103 44.658 44.611 0.047 1
1 1211 . 1 1 1 A 103 103 GLY N N 103 110.592 108.122 2.470 1
1 1212 . 1 1 1 A 104 104 PRO HA H 104 4.475 4.692 -0.217 1
1 1219 . 1 1 1 A 104 104 PRO C C 104 177.445 177.004 0.441 1
1 1220 . 1 1 1 A 104 104 PRO CA C 104 63.312 62.834 0.478 1
1 1221 . 1 1 1 A 104 104 PRO CB C 104 32.190 32.060 0.130 1
1 1224 . 1 1 1 A 105 105 SER H H 105 8.538 8.781 -0.243 1
1 1225 . 1 1 1 A 105 105 SER HA H 105 4.541 4.718 -0.177 1
1 1228 . 1 1 1 A 105 105 SER C C 105 174.616 173.931 0.685 1
1 1229 . 1 1 1 A 105 105 SER CA C 105 58.270 57.639 0.631 1
1 1230 . 1 1 1 A 105 105 SER CB C 105 63.895 63.565 0.330 1
1 1231 . 1 1 1 A 105 105 SER N N 105 116.446 118.471 -2.025 1
1 1232 . 1 1 1 A 106 106 SER H H 106 8.350 7.611 0.739 1
1 1233 . 1 1 1 A 106 106 SER HA H 106 4.541 4.381 0.160 1
1 1236 . 1 1 1 A 106 106 SER C C 106 174.530 174.468 0.062 1
1 1237 . 1 1 1 A 106 106 SER CA C 106 58.357 59.359 -1.002 1
1 1238 . 1 1 1 A 106 106 SER CB C 106 64.020 63.935 0.085 1
1 1239 . 1 1 1 A 106 106 SER N N 106 117.448 117.354 0.094 1
1 1 . 2 1 1 A 2 2 SER C C 2 174.723 176.026 -1.303 1
1 2 . 2 1 1 A 2 2 SER CA C 2 58.446 59.956 -1.510 1
1 3 . 2 1 1 A 2 2 SER CB C 2 63.566 64.505 -0.939 1
1 4 . 2 1 1 A 3 3 SER H H 3 8.350 8.201 0.149 1
1 5 . 2 1 1 A 3 3 SER C C 3 173.961 174.303 -0.342 1
1 6 . 2 1 1 A 3 3 SER CA C 3 58.428 59.593 -1.165 1
1 7 . 2 1 1 A 3 3 SER CB C 3 63.937 65.473 -1.536 1
1 8 . 2 1 1 A 3 3 SER N N 3 117.923 114.151 3.772 1
1 9 . 2 1 1 A 4 4 GLY H H 4 8.050 7.469 0.581 1
1 10 . 2 1 1 A 4 4 GLY C C 4 179.009 172.529 6.480 1
1 11 . 2 1 1 A 4 4 GLY CA C 4 46.174 45.058 1.116 1
1 12 . 2 1 1 A 4 4 GLY N N 4 116.890 107.353 9.537 1
1 13 . 2 1 1 A 7 7 GLY HA2 H 7 4.340 4.094 0.246 1
1 14 . 2 1 1 A 7 7 GLY HA3 H 7 3.629 4.096 -0.467 1
1 15 . 2 1 1 A 7 7 GLY CA C 7 44.381 45.094 -0.713 1
1 16 . 2 1 1 A 8 8 PRO HA H 8 4.476 4.542 -0.066 1
1 23 . 2 1 1 A 8 8 PRO C C 8 176.235 177.231 -0.996 1
1 24 . 2 1 1 A 8 8 PRO CA C 8 62.995 62.580 0.415 1
1 25 . 2 1 1 A 8 8 PRO CB C 8 33.266 32.288 0.978 1
1 28 . 2 1 1 A 9 9 GLY H H 9 8.585 8.417 0.168 1
1 29 . 2 1 1 A 9 9 GLY HA2 H 9 4.326 4.106 0.220 1
1 30 . 2 1 1 A 9 9 GLY HA3 H 9 4.009 4.113 -0.104 1
1 31 . 2 1 1 A 9 9 GLY C C 9 172.998 172.989 0.009 1
1 32 . 2 1 1 A 9 9 GLY CA C 9 44.393 44.313 0.080 1
1 33 . 2 1 1 A 9 9 GLY N N 9 106.004 107.717 -1.713 1
1 34 . 2 1 1 A 10 10 ARG H H 10 8.548 8.350 0.198 1
1 35 . 2 1 1 A 10 10 ARG HA H 10 4.654 4.975 -0.321 1
1 41 . 2 1 1 A 10 10 ARG C C 10 175.780 174.847 0.933 1
1 42 . 2 1 1 A 10 10 ARG CA C 10 54.708 54.565 0.143 1
1 43 . 2 1 1 A 10 10 ARG CB C 10 31.448 31.467 -0.019 1
1 45 . 2 1 1 A 10 10 ARG N N 10 119.407 118.983 0.424 1
1 46 . 2 1 1 A 11 11 PRO HA H 11 4.611 4.581 0.030 1
1 53 . 2 1 1 A 11 11 PRO C C 11 173.510 175.602 -2.092 1
1 54 . 2 1 1 A 11 11 PRO CA C 11 62.360 62.683 -0.323 1
1 55 . 2 1 1 A 11 11 PRO CB C 11 33.402 32.225 1.177 1
1 58 . 2 1 1 A 12 12 THR H H 12 7.572 8.456 -0.884 1
1 59 . 2 1 1 A 12 12 THR HA H 12 3.796 4.139 -0.343 1
1 64 . 2 1 1 A 12 12 THR C C 12 172.337 173.262 -0.925 1
1 65 . 2 1 1 A 12 12 THR CA C 12 61.778 61.646 0.132 1
1 66 . 2 1 1 A 12 12 THR CB C 12 70.561 68.679 1.882 1
1 68 . 2 1 1 A 12 12 THR N N 12 109.653 117.294 -7.641 1
1 69 . 2 1 1 A 13 13 MET H H 13 5.605 8.298 -2.693 1
1 70 . 2 1 1 A 13 13 MET HA H 13 5.091 4.920 0.171 1
1 78 . 2 1 1 A 13 13 MET C C 13 172.639 174.865 -2.226 1
1 79 . 2 1 1 A 13 13 MET CA C 13 54.168 53.643 0.525 1
1 80 . 2 1 1 A 13 13 MET CB C 13 37.632 34.418 3.214 1
1 83 . 2 1 1 A 13 13 MET N N 13 121.634 126.844 -5.210 1
1 84 . 2 1 1 A 14 14 MET H H 14 9.254 9.289 -0.035 1
1 85 . 2 1 1 A 14 14 MET HA H 14 4.662 5.247 -0.585 1
1 93 . 2 1 1 A 14 14 MET C C 14 174.388 174.671 -0.283 1
1 94 . 2 1 1 A 14 14 MET CA C 14 54.673 54.253 0.420 1
1 95 . 2 1 1 A 14 14 MET CB C 14 34.907 34.781 0.126 1
1 98 . 2 1 1 A 14 14 MET N N 14 125.746 124.241 1.505 1
1 99 . 2 1 1 A 15 15 ILE H H 15 8.555 9.180 -0.625 1
1 100 . 2 1 1 A 15 15 ILE HA H 15 4.882 5.164 -0.282 1
1 110 . 2 1 1 A 15 15 ILE C C 15 174.962 174.959 0.003 1
1 111 . 2 1 1 A 15 15 ILE CA C 15 60.685 60.451 0.234 1
1 112 . 2 1 1 A 15 15 ILE CB C 15 40.878 38.895 1.983 1
1 116 . 2 1 1 A 15 15 ILE N N 15 121.623 126.134 -4.511 1
1 117 . 2 1 1 A 16 16 SER H H 16 8.703 8.983 -0.280 1
1 118 . 2 1 1 A 16 16 SER HA H 16 4.922 5.048 -0.126 1
1 121 . 2 1 1 A 16 16 SER C C 16 173.860 173.283 0.577 1
1 122 . 2 1 1 A 16 16 SER CA C 16 56.524 57.230 -0.706 1
1 123 . 2 1 1 A 16 16 SER CB C 16 65.004 65.803 -0.799 1
1 124 . 2 1 1 A 16 16 SER N N 16 122.261 124.779 -2.518 1
1 125 . 2 1 1 A 17 17 THR H H 17 8.759 8.672 0.087 1
1 126 . 2 1 1 A 17 17 THR HA H 17 4.885 4.810 0.075 1
1 131 . 2 1 1 A 17 17 THR C C 17 175.018 174.513 0.505 1
1 132 . 2 1 1 A 17 17 THR CA C 17 60.315 60.852 -0.537 1
1 133 . 2 1 1 A 17 17 THR CB C 17 69.799 70.153 -0.354 1
1 135 . 2 1 1 A 17 17 THR N N 17 115.660 116.322 -0.662 1
1 136 . 2 1 1 A 18 18 THR H H 18 8.038 8.802 -0.764 1
1 137 . 2 1 1 A 18 18 THR HA H 18 4.596 4.426 0.170 1
1 142 . 2 1 1 A 18 18 THR CA C 18 60.707 62.171 -1.464 1
1 143 . 2 1 1 A 18 18 THR CB C 18 71.082 69.785 1.297 1
1 145 . 2 1 1 A 18 18 THR N N 18 112.362 115.038 -2.676 1
1 146 . 2 1 1 A 19 19 ALA H H 19 8.545 7.405 1.140 1
1 147 . 2 1 1 A 19 19 ALA HA H 19 4.412 4.336 0.076 1
1 151 . 2 1 1 A 19 19 ALA C C 19 177.034 177.018 0.016 1
1 152 . 2 1 1 A 19 19 ALA CA C 19 52.264 51.930 0.334 1
1 153 . 2 1 1 A 19 19 ALA CB C 19 19.292 20.323 -1.031 1
1 154 . 2 1 1 A 19 19 ALA N N 19 119.589 123.762 -4.173 1
1 155 . 2 1 1 A 20 20 MET H H 20 8.145 8.495 -0.350 1
1 156 . 2 1 1 A 20 20 MET HA H 20 4.447 4.397 0.050 1
1 164 . 2 1 1 A 20 20 MET C C 20 175.676 176.517 -0.841 1
1 165 . 2 1 1 A 20 20 MET CA C 20 55.764 54.712 1.052 1
1 166 . 2 1 1 A 20 20 MET CB C 20 31.495 32.191 -0.696 1
1 169 . 2 1 1 A 20 20 MET N N 20 116.950 118.295 -1.345 1
1 170 . 2 1 1 A 21 21 ASN H H 21 8.275 8.884 -0.609 1
1 171 . 2 1 1 A 21 21 ASN HA H 21 4.452 4.349 0.103 1
1 176 . 2 1 1 A 21 21 ASN C C 21 174.100 173.822 0.278 1
1 177 . 2 1 1 A 21 21 ASN CA C 21 54.320 54.435 -0.115 1
1 178 . 2 1 1 A 21 21 ASN CB C 21 37.234 37.363 -0.129 1
1 179 . 2 1 1 A 21 21 ASN N N 21 113.198 118.576 -5.378 1
1 181 . 2 1 1 A 22 22 THR H H 22 7.071 7.453 -0.382 1
1 182 . 2 1 1 A 22 22 THR HA H 22 5.218 5.397 -0.179 1
1 187 . 2 1 1 A 22 22 THR C C 22 173.301 173.198 0.103 1
1 188 . 2 1 1 A 22 22 THR CA C 22 59.399 60.199 -0.800 1
1 189 . 2 1 1 A 22 22 THR CB C 22 72.714 72.016 0.698 1
1 191 . 2 1 1 A 22 22 THR N N 22 107.603 107.682 -0.079 1
1 192 . 2 1 1 A 23 23 ALA H H 23 8.687 8.928 -0.241 1
1 193 . 2 1 1 A 23 23 ALA HA H 23 4.925 5.150 -0.225 1
1 197 . 2 1 1 A 23 23 ALA C C 23 174.100 175.452 -1.352 1
1 198 . 2 1 1 A 23 23 ALA CA C 23 50.812 50.113 0.699 1
1 199 . 2 1 1 A 23 23 ALA CB C 23 21.122 21.355 -0.233 1
1 200 . 2 1 1 A 23 23 ALA N N 23 121.937 125.433 -3.496 1
1 201 . 2 1 1 A 24 24 LEU H H 24 8.833 8.921 -0.088 1
1 202 . 2 1 1 A 24 24 LEU HA H 24 4.673 4.588 0.085 1
1 212 . 2 1 1 A 24 24 LEU C C 24 175.140 174.508 0.632 1
1 213 . 2 1 1 A 24 24 LEU CA C 24 54.320 54.691 -0.371 1
1 214 . 2 1 1 A 24 24 LEU CB C 24 42.518 43.224 -0.706 1
1 218 . 2 1 1 A 24 24 LEU N N 24 123.721 126.427 -2.706 1
1 219 . 2 1 1 A 25 25 LEU H H 25 9.176 9.131 0.045 1
1 220 . 2 1 1 A 25 25 LEU HA H 25 5.112 5.066 0.046 1
1 230 . 2 1 1 A 25 25 LEU C C 25 176.414 176.023 0.391 1
1 231 . 2 1 1 A 25 25 LEU CA C 25 54.108 53.245 0.863 1
1 232 . 2 1 1 A 25 25 LEU CB C 25 43.230 43.107 0.123 1
1 236 . 2 1 1 A 25 25 LEU N N 25 128.589 128.676 -0.087 1
1 237 . 2 1 1 A 26 26 GLN H H 26 8.556 8.665 -0.109 1
1 238 . 2 1 1 A 26 26 GLN HA H 26 4.737 4.939 -0.202 1
1 245 . 2 1 1 A 26 26 GLN C C 26 174.372 174.271 0.101 1
1 246 . 2 1 1 A 26 26 GLN CA C 26 56.365 54.447 1.918 1
1 247 . 2 1 1 A 26 26 GLN CB C 26 33.320 31.832 1.488 1
1 249 . 2 1 1 A 26 26 GLN N N 26 119.630 122.875 -3.245 1
1 251 . 2 1 1 A 27 27 TRP H H 27 8.080 8.227 -0.147 1
1 252 . 2 1 1 A 27 27 TRP HA H 27 5.441 5.778 -0.337 1
1 261 . 2 1 1 A 27 27 TRP CA C 27 55.957 54.456 1.501 1
1 262 . 2 1 1 A 27 27 TRP CB C 27 32.517 32.219 0.298 1
1 268 . 2 1 1 A 27 27 TRP N N 27 121.276 121.893 -0.617 1
1 270 . 2 1 1 A 28 28 HIS H H 28 8.262 8.557 -0.295 1
1 271 . 2 1 1 A 28 28 HIS HA H 28 4.997 5.010 -0.013 1
1 275 . 2 1 1 A 28 28 HIS CA C 28 53.028 53.922 -0.894 1
1 276 . 2 1 1 A 28 28 HIS CB C 28 32.832 32.848 -0.016 1
1 278 . 2 1 1 A 28 28 HIS N N 28 116.245 116.829 -0.584 1
1 279 . 2 1 1 A 29 29 PRO HA H 29 4.984 4.708 0.276 1
1 286 . 2 1 1 A 29 29 PRO CA C 29 61.498 62.107 -0.609 1
1 287 . 2 1 1 A 29 29 PRO CB C 29 30.709 32.116 -1.407 1
1 290 . 2 1 1 A 30 30 PRO HA H 30 4.449 4.680 -0.231 1
1 297 . 2 1 1 A 30 30 PRO C C 30 175.733 176.881 -1.148 1
1 298 . 2 1 1 A 30 30 PRO CA C 30 62.245 62.541 -0.296 1
1 299 . 2 1 1 A 30 30 PRO CB C 30 32.083 33.433 -1.350 1
1 302 . 2 1 1 A 31 31 LYS H H 31 8.403 8.888 -0.485 1
1 303 . 2 1 1 A 31 31 LYS HA H 31 4.084 4.522 -0.438 1
1 312 . 2 1 1 A 31 31 LYS C C 31 177.166 177.503 -0.337 1
1 313 . 2 1 1 A 31 31 LYS CA C 31 57.866 56.571 1.295 1
1 314 . 2 1 1 A 31 31 LYS CB C 31 32.698 33.876 -1.178 1
1 318 . 2 1 1 A 31 31 LYS N N 31 121.693 119.628 2.065 1
1 319 . 2 1 1 A 32 32 GLU H H 32 8.102 7.901 0.201 1
1 320 . 2 1 1 A 32 32 GLU HA H 32 4.365 4.538 -0.173 1
1 325 . 2 1 1 A 32 32 GLU C C 32 174.248 176.039 -1.791 1
1 326 . 2 1 1 A 32 32 GLU CA C 32 55.448 55.708 -0.260 1
1 327 . 2 1 1 A 32 32 GLU CB C 32 29.405 29.697 -0.292 1
1 329 . 2 1 1 A 32 32 GLU N N 32 118.742 116.552 2.190 1
1 330 . 2 1 1 A 33 33 LEU H H 33 8.420 7.530 0.890 1
1 331 . 2 1 1 A 33 33 LEU HA H 33 4.499 4.674 -0.175 1
1 341 . 2 1 1 A 33 33 LEU C C 33 173.036 175.029 -1.993 1
1 342 . 2 1 1 A 33 33 LEU CA C 33 52.863 52.218 0.645 1
1 343 . 2 1 1 A 33 33 LEU CB C 33 42.535 43.237 -0.702 1
1 347 . 2 1 1 A 33 33 LEU N N 33 125.181 123.979 1.202 1
1 348 . 2 1 1 A 34 34 PRO HA H 34 4.488 4.487 0.001 1
1 355 . 2 1 1 A 34 34 PRO C C 34 177.544 176.640 0.904 1
1 356 . 2 1 1 A 34 34 PRO CA C 34 62.889 63.121 -0.232 1
1 357 . 2 1 1 A 34 34 PRO CB C 34 31.472 30.859 0.613 1
1 360 . 2 1 1 A 35 35 GLY H H 35 8.397 8.009 0.388 1
1 361 . 2 1 1 A 35 35 GLY HA2 H 35 4.059 4.131 -0.072 1
1 362 . 2 1 1 A 35 35 GLY HA3 H 35 3.716 4.132 -0.416 1
1 363 . 2 1 1 A 35 35 GLY C C 35 173.356 171.555 1.801 1
1 364 . 2 1 1 A 35 35 GLY CA C 35 45.892 44.775 1.117 1
1 365 . 2 1 1 A 35 35 GLY N N 35 110.524 112.000 -1.476 1
1 366 . 2 1 1 A 36 36 GLU H H 36 8.091 8.712 -0.621 1
1 367 . 2 1 1 A 36 36 GLU HA H 36 4.371 5.163 -0.792 1
1 372 . 2 1 1 A 36 36 GLU C C 36 174.864 174.901 -0.037 1
1 373 . 2 1 1 A 36 36 GLU CA C 36 55.201 54.714 0.487 1
1 374 . 2 1 1 A 36 36 GLU CB C 36 31.878 33.721 -1.843 1
1 376 . 2 1 1 A 36 36 GLU N N 36 122.202 123.394 -1.192 1
1 377 . 2 1 1 A 37 37 LEU H H 37 8.307 8.687 -0.380 1
1 378 . 2 1 1 A 37 37 LEU HA H 37 4.288 4.267 0.021 1
1 388 . 2 1 1 A 37 37 LEU C C 37 176.702 176.021 0.681 1
1 389 . 2 1 1 A 37 37 LEU CA C 37 55.342 56.323 -0.981 1
1 390 . 2 1 1 A 37 37 LEU CB C 37 42.715 42.195 0.520 1
1 394 . 2 1 1 A 37 37 LEU N N 37 123.204 126.972 -3.768 1
1 395 . 2 1 1 A 38 38 LEU H H 38 8.909 8.763 0.146 1
1 396 . 2 1 1 A 38 38 LEU HA H 38 4.640 4.650 -0.010 1
1 406 . 2 1 1 A 38 38 LEU C C 38 177.202 176.761 0.441 1
1 407 . 2 1 1 A 38 38 LEU CA C 38 54.390 55.136 -0.746 1
1 408 . 2 1 1 A 38 38 LEU CB C 38 43.770 43.552 0.218 1
1 412 . 2 1 1 A 38 38 LEU N N 38 123.021 127.246 -4.225 1
1 413 . 2 1 1 A 39 39 GLY H H 39 7.113 6.954 0.159 1
1 414 . 2 1 1 A 39 39 GLY HA2 H 39 4.816 3.587 1.229 1
1 415 . 2 1 1 A 39 39 GLY HA3 H 39 3.276 3.920 -0.644 1
1 416 . 2 1 1 A 39 39 GLY C C 39 169.863 170.383 -0.520 1
1 417 . 2 1 1 A 39 39 GLY CA C 39 44.622 45.453 -0.831 1
1 418 . 2 1 1 A 39 39 GLY N N 39 104.137 104.015 0.122 1
1 419 . 2 1 1 A 40 40 TYR H H 40 8.318 8.984 -0.666 1
1 420 . 2 1 1 A 40 40 TYR HA H 40 5.414 5.195 0.219 1
1 425 . 2 1 1 A 40 40 TYR C C 40 174.448 172.135 2.313 1
1 426 . 2 1 1 A 40 40 TYR CA C 40 56.178 56.404 -0.226 1
1 427 . 2 1 1 A 40 40 TYR CB C 40 44.191 40.704 3.487 1
1 430 . 2 1 1 A 40 40 TYR N N 40 114.036 115.368 -1.332 1
1 431 . 2 1 1 A 41 41 ARG H H 41 9.347 8.382 0.965 1
1 432 . 2 1 1 A 41 41 ARG HA H 41 5.092 5.436 -0.344 1
1 440 . 2 1 1 A 41 41 ARG C C 41 174.097 174.112 -0.015 1
1 441 . 2 1 1 A 41 41 ARG CA C 41 56.100 54.334 1.766 1
1 442 . 2 1 1 A 41 41 ARG CB C 41 34.508 33.064 1.444 1
1 445 . 2 1 1 A 41 41 ARG N N 41 122.231 121.112 1.119 1
1 447 . 2 1 1 A 42 42 LEU H H 42 9.546 9.066 0.480 1
1 448 . 2 1 1 A 42 42 LEU HA H 42 5.459 5.287 0.172 1
1 458 . 2 1 1 A 42 42 LEU C C 42 174.913 174.698 0.215 1
1 459 . 2 1 1 A 42 42 LEU CA C 42 52.997 53.355 -0.358 1
1 460 . 2 1 1 A 42 42 LEU CB C 42 46.413 45.811 0.602 1
1 464 . 2 1 1 A 42 42 LEU N N 42 132.335 127.143 5.192 1
1 465 . 2 1 1 A 43 43 GLN H H 43 9.502 9.265 0.237 1
1 466 . 2 1 1 A 43 43 GLN HA H 43 5.847 5.370 0.477 1
1 473 . 2 1 1 A 43 43 GLN C C 43 175.329 174.034 1.295 1
1 474 . 2 1 1 A 43 43 GLN CA C 43 54.005 54.400 -0.395 1
1 475 . 2 1 1 A 43 43 GLN CB C 43 33.429 32.200 1.229 1
1 477 . 2 1 1 A 43 43 GLN N N 43 123.932 125.215 -1.283 1
1 479 . 2 1 1 A 44 44 TYR H H 44 8.615 8.509 0.106 1
1 480 . 2 1 1 A 44 44 TYR HA H 44 5.783 5.630 0.153 1
1 487 . 2 1 1 A 44 44 TYR C C 44 174.058 173.506 0.552 1
1 488 . 2 1 1 A 44 44 TYR CA C 44 55.942 56.389 -0.447 1
1 489 . 2 1 1 A 44 44 TYR CB C 44 43.052 41.307 1.745 1
1 494 . 2 1 1 A 44 44 TYR N N 44 117.355 119.496 -2.141 1
1 495 . 2 1 1 A 45 45 CYS H H 45 8.377 8.251 0.126 1
1 496 . 2 1 1 A 45 45 CYS HA H 45 4.772 5.115 -0.343 1
1 499 . 2 1 1 A 45 45 CYS C C 45 173.205 173.885 -0.680 1
1 500 . 2 1 1 A 45 45 CYS CA C 45 55.960 56.888 -0.928 1
1 501 . 2 1 1 A 45 45 CYS CB C 45 30.665 31.365 -0.700 1
1 502 . 2 1 1 A 45 45 CYS N N 45 115.140 118.336 -3.196 1
1 503 . 2 1 1 A 46 46 ARG H H 46 9.165 8.187 0.978 1
1 504 . 2 1 1 A 46 46 ARG HA H 46 4.068 3.908 0.160 1
1 511 . 2 1 1 A 46 46 ARG C C 46 178.440 177.512 0.928 1
1 512 . 2 1 1 A 46 46 ARG CA C 46 56.401 55.748 0.653 1
1 513 . 2 1 1 A 46 46 ARG CB C 46 31.878 30.829 1.049 1
1 516 . 2 1 1 A 46 46 ARG N N 46 121.803 121.297 0.506 1
1 517 . 2 1 1 A 47 47 ALA H H 47 8.273 8.095 0.178 1
1 518 . 2 1 1 A 47 47 ALA HA H 47 3.891 4.147 -0.256 1
1 522 . 2 1 1 A 47 47 ALA C C 47 177.599 177.281 0.318 1
1 523 . 2 1 1 A 47 47 ALA CA C 47 54.796 53.401 1.395 1
1 524 . 2 1 1 A 47 47 ALA CB C 47 18.287 18.574 -0.287 1
1 525 . 2 1 1 A 47 47 ALA N N 47 123.895 123.763 0.132 1
1 526 . 2 1 1 A 48 48 ASP H H 48 8.036 8.148 -0.112 1
1 527 . 2 1 1 A 48 48 ASP HA H 48 4.453 4.826 -0.373 1
1 530 . 2 1 1 A 48 48 ASP C C 48 175.836 175.635 0.201 1
1 531 . 2 1 1 A 48 48 ASP CA C 48 53.368 52.926 0.442 1
1 532 . 2 1 1 A 48 48 ASP CB C 48 39.964 41.276 -1.312 1
1 533 . 2 1 1 A 48 48 ASP N N 48 112.576 117.641 -5.065 1
1 534 . 2 1 1 A 49 49 GLU H H 49 7.495 7.366 0.129 1
1 535 . 2 1 1 A 49 49 GLU HA H 49 4.308 4.719 -0.411 1
1 540 . 2 1 1 A 49 49 GLU C C 49 175.756 175.362 0.394 1
1 541 . 2 1 1 A 49 49 GLU CA C 49 56.224 54.913 1.311 1
1 542 . 2 1 1 A 49 49 GLU CB C 49 32.248 32.622 -0.374 1
1 544 . 2 1 1 A 49 49 GLU N N 49 120.609 119.466 1.143 1
1 545 . 2 1 1 A 50 50 ALA H H 50 8.416 8.380 0.036 1
1 546 . 2 1 1 A 50 50 ALA HA H 50 4.200 4.462 -0.262 1
1 550 . 2 1 1 A 50 50 ALA C C 50 177.433 176.756 0.677 1
1 551 . 2 1 1 A 50 50 ALA CA C 50 53.297 52.270 1.027 1
1 552 . 2 1 1 A 50 50 ALA CB C 50 19.474 20.081 -0.607 1
1 553 . 2 1 1 A 50 50 ALA N N 50 124.065 123.970 0.095 1
1 554 . 2 1 1 A 51 51 ARG H H 51 7.648 7.551 0.097 1
1 555 . 2 1 1 A 51 51 ARG HA H 51 4.747 4.652 0.095 1
1 562 . 2 1 1 A 51 51 ARG C C 51 173.400 174.148 -0.748 1
1 563 . 2 1 1 A 51 51 ARG CA C 51 52.592 52.565 0.027 1
1 564 . 2 1 1 A 51 51 ARG CB C 51 31.212 31.503 -0.291 1
1 567 . 2 1 1 A 51 51 ARG N N 51 117.798 119.558 -1.760 1
1 568 . 2 1 1 A 52 52 PRO HA H 52 4.212 4.448 -0.236 1
1 575 . 2 1 1 A 52 52 PRO C C 52 176.380 176.068 0.312 1
1 576 . 2 1 1 A 52 52 PRO CA C 52 62.360 62.654 -0.294 1
1 577 . 2 1 1 A 52 52 PRO CB C 52 32.331 32.004 0.327 1
1 580 . 2 1 1 A 53 53 ASN H H 53 8.127 7.792 0.335 1
1 581 . 2 1 1 A 53 53 ASN HA H 53 4.651 4.797 -0.146 1
1 586 . 2 1 1 A 53 53 ASN C C 53 174.354 174.363 -0.009 1
1 587 . 2 1 1 A 53 53 ASN CA C 53 53.136 52.384 0.752 1
1 588 . 2 1 1 A 53 53 ASN CB C 53 39.666 38.426 1.240 1
1 589 . 2 1 1 A 53 53 ASN N N 53 119.405 119.815 -0.410 1
1 591 . 2 1 1 A 54 54 THR H H 54 8.425 8.682 -0.257 1
1 592 . 2 1 1 A 54 54 THR HA H 54 5.306 4.635 0.671 1
1 597 . 2 1 1 A 54 54 THR C C 54 173.850 174.212 -0.362 1
1 598 . 2 1 1 A 54 54 THR CA C 54 61.881 62.734 -0.853 1
1 599 . 2 1 1 A 54 54 THR CB C 54 70.573 69.744 0.829 1
1 601 . 2 1 1 A 54 54 THR N N 54 118.968 120.752 -1.784 1
1 602 . 2 1 1 A 55 55 ILE H H 55 9.354 8.512 0.842 1
1 603 . 2 1 1 A 55 55 ILE HA H 55 4.051 4.511 -0.460 1
1 613 . 2 1 1 A 55 55 ILE C C 55 172.975 173.369 -0.394 1
1 614 . 2 1 1 A 55 55 ILE CA C 55 61.003 59.815 1.188 1
1 615 . 2 1 1 A 55 55 ILE CB C 55 41.619 42.124 -0.505 1
1 619 . 2 1 1 A 55 55 ILE N N 55 127.961 125.684 2.277 1
1 620 . 2 1 1 A 56 56 ASP H H 56 8.132 8.684 -0.552 1
1 621 . 2 1 1 A 56 56 ASP HA H 56 5.334 5.233 0.101 1
1 624 . 2 1 1 A 56 56 ASP C C 56 174.969 174.534 0.435 1
1 625 . 2 1 1 A 56 56 ASP CA C 56 53.702 52.606 1.096 1
1 626 . 2 1 1 A 56 56 ASP CB C 56 43.251 42.964 0.287 1
1 627 . 2 1 1 A 56 56 ASP N N 56 125.882 126.885 -1.003 1
1 628 . 2 1 1 A 57 57 PHE H H 57 8.955 8.815 0.140 1
1 629 . 2 1 1 A 57 57 PHE HA H 57 4.915 5.025 -0.110 1
1 637 . 2 1 1 A 57 57 PHE C C 57 177.361 175.508 1.853 1
1 638 . 2 1 1 A 57 57 PHE CA C 57 57.458 56.501 0.957 1
1 639 . 2 1 1 A 57 57 PHE CB C 57 43.737 43.592 0.145 1
1 645 . 2 1 1 A 57 57 PHE N N 57 118.872 123.442 -4.570 1
1 646 . 2 1 1 A 58 58 GLY H H 58 9.552 9.195 0.357 1
1 647 . 2 1 1 A 58 58 GLY HA2 H 58 4.662 4.137 0.525 1
1 648 . 2 1 1 A 58 58 GLY HA3 H 58 4.126 4.199 -0.073 1
1 649 . 2 1 1 A 58 58 GLY C C 58 174.760 174.971 -0.211 1
1 650 . 2 1 1 A 58 58 GLY CA C 58 44.680 45.076 -0.396 1
1 651 . 2 1 1 A 58 58 GLY N N 58 111.551 109.660 1.891 1
1 652 . 2 1 1 A 59 59 LYS H H 59 8.211 8.663 -0.452 1
1 653 . 2 1 1 A 59 59 LYS HA H 59 3.782 3.670 0.112 1
1 662 . 2 1 1 A 59 59 LYS C C 59 176.154 177.975 -1.821 1
1 663 . 2 1 1 A 59 59 LYS CA C 59 59.080 58.677 0.403 1
1 664 . 2 1 1 A 59 59 LYS CB C 59 32.516 31.757 0.759 1
1 668 . 2 1 1 A 59 59 LYS N N 59 115.953 120.546 -4.593 1
1 669 . 2 1 1 A 60 60 ASP H H 60 8.634 7.952 0.682 1
1 670 . 2 1 1 A 60 60 ASP HA H 60 4.882 4.544 0.338 1
1 673 . 2 1 1 A 60 60 ASP C C 60 176.039 177.115 -1.076 1
1 674 . 2 1 1 A 60 60 ASP CA C 60 54.327 56.582 -2.255 1
1 675 . 2 1 1 A 60 60 ASP CB C 60 41.461 40.861 0.600 1
1 676 . 2 1 1 A 60 60 ASP N N 60 117.261 118.576 -1.315 1
1 677 . 2 1 1 A 61 61 ASP H H 61 7.500 8.432 -0.932 1
1 678 . 2 1 1 A 61 61 ASP HA H 61 4.591 4.657 -0.066 1
1 681 . 2 1 1 A 61 61 ASP C C 61 175.140 175.781 -0.641 1
1 682 . 2 1 1 A 61 61 ASP CA C 61 55.342 53.742 1.600 1
1 683 . 2 1 1 A 61 61 ASP CB C 61 42.475 40.027 2.448 1
1 684 . 2 1 1 A 61 61 ASP N N 61 122.319 118.764 3.555 1
1 685 . 2 1 1 A 62 62 GLN H H 62 8.239 8.006 0.233 1
1 686 . 2 1 1 A 62 62 GLN HA H 62 2.569 3.581 -1.012 1
1 693 . 2 1 1 A 62 62 GLN C C 62 172.652 173.587 -0.935 1
1 694 . 2 1 1 A 62 62 GLN CA C 62 54.038 55.468 -1.430 1
1 695 . 2 1 1 A 62 62 GLN CB C 62 31.481 29.181 2.300 1
1 697 . 2 1 1 A 62 62 GLN N N 62 117.458 123.153 -5.695 1
1 699 . 2 1 1 A 63 63 HIS H H 63 6.338 6.762 -0.424 1
1 700 . 2 1 1 A 63 63 HIS HA H 63 4.423 4.498 -0.075 1
1 704 . 2 1 1 A 63 63 HIS C C 63 173.031 172.657 0.374 1
1 705 . 2 1 1 A 63 63 HIS CA C 63 54.743 54.091 0.652 1
1 706 . 2 1 1 A 63 63 HIS CB C 63 32.661 31.194 1.467 1
1 708 . 2 1 1 A 63 63 HIS N N 63 113.589 116.037 -2.448 1
1 709 . 2 1 1 A 64 64 PHE H H 64 8.549 8.945 -0.396 1
1 710 . 2 1 1 A 64 64 PHE HA H 64 4.578 5.203 -0.625 1
1 718 . 2 1 1 A 64 64 PHE C C 64 173.015 173.483 -0.468 1
1 719 . 2 1 1 A 64 64 PHE CA C 64 58.516 56.899 1.617 1
1 720 . 2 1 1 A 64 64 PHE CB C 64 43.525 43.134 0.391 1
1 726 . 2 1 1 A 64 64 PHE N N 64 118.214 119.995 -1.781 1
1 727 . 2 1 1 A 65 65 THR H H 65 7.150 8.095 -0.945 1
1 728 . 2 1 1 A 65 65 THR HA H 65 4.930 4.636 0.294 1
1 733 . 2 1 1 A 65 65 THR C C 65 172.457 173.371 -0.914 1
1 734 . 2 1 1 A 65 65 THR CA C 65 61.690 61.671 0.019 1
1 735 . 2 1 1 A 65 65 THR CB C 65 69.593 69.480 0.113 1
1 737 . 2 1 1 A 65 65 THR N N 65 123.198 119.640 3.558 1
1 738 . 2 1 1 A 66 66 VAL H H 66 8.888 8.587 0.301 1
1 739 . 2 1 1 A 66 66 VAL HA H 66 4.018 4.744 -0.726 1
1 747 . 2 1 1 A 66 66 VAL C C 66 174.868 175.383 -0.515 1
1 748 . 2 1 1 A 66 66 VAL CA C 66 61.178 60.586 0.592 1
1 749 . 2 1 1 A 66 66 VAL CB C 66 33.114 33.130 -0.016 1
1 752 . 2 1 1 A 66 66 VAL N N 66 126.840 128.446 -1.606 1
1 753 . 2 1 1 A 67 67 THR H H 67 8.174 8.514 -0.340 1
1 754 . 2 1 1 A 67 67 THR HA H 67 4.816 5.026 -0.210 1
1 759 . 2 1 1 A 67 67 THR C C 67 174.494 174.297 0.197 1
1 760 . 2 1 1 A 67 67 THR CA C 67 59.786 59.531 0.255 1
1 761 . 2 1 1 A 67 67 THR CB C 67 70.887 71.600 -0.713 1
1 763 . 2 1 1 A 67 67 THR N N 67 116.127 117.134 -1.007 1
1 764 . 2 1 1 A 68 68 GLY H H 68 8.570 8.678 -0.108 1
1 765 . 2 1 1 A 68 68 GLY HA2 H 68 3.970 4.016 -0.046 1
1 766 . 2 1 1 A 68 68 GLY HA3 H 68 3.819 4.031 -0.212 1
1 767 . 2 1 1 A 68 68 GLY C C 68 175.636 174.666 0.970 1
1 768 . 2 1 1 A 68 68 GLY CA C 68 46.397 45.172 1.225 1
1 769 . 2 1 1 A 68 68 GLY N N 68 107.146 113.097 -5.951 1
1 770 . 2 1 1 A 69 69 LEU H H 69 8.007 7.521 0.486 1
1 771 . 2 1 1 A 69 69 LEU HA H 69 4.154 4.279 -0.125 1
1 781 . 2 1 1 A 69 69 LEU C C 69 176.830 176.346 0.484 1
1 782 . 2 1 1 A 69 69 LEU CA C 69 54.602 54.839 -0.237 1
1 783 . 2 1 1 A 69 69 LEU CB C 69 41.149 42.021 -0.872 1
1 787 . 2 1 1 A 69 69 LEU N N 69 118.433 123.031 -4.598 1
1 788 . 2 1 1 A 70 70 HIS H H 70 8.866 8.814 0.052 1
1 789 . 2 1 1 A 70 70 HIS HA H 70 4.663 4.541 0.122 1
1 793 . 2 1 1 A 70 70 HIS C C 70 176.667 175.801 0.866 1
1 794 . 2 1 1 A 70 70 HIS CA C 70 55.464 57.534 -2.070 1
1 795 . 2 1 1 A 70 70 HIS CB C 70 32.125 30.082 2.043 1
1 797 . 2 1 1 A 70 70 HIS N N 70 122.457 122.655 -0.198 1
1 798 . 2 1 1 A 71 71 LYS H H 71 8.716 8.616 0.100 1
1 799 . 2 1 1 A 71 71 LYS HA H 71 4.320 4.175 0.145 1
1 808 . 2 1 1 A 71 71 LYS C C 71 178.110 176.752 1.358 1
1 809 . 2 1 1 A 71 71 LYS CA C 71 57.035 56.374 0.661 1
1 810 . 2 1 1 A 71 71 LYS CB C 71 33.580 32.977 0.603 1
1 814 . 2 1 1 A 71 71 LYS N N 71 123.173 123.648 -0.475 1
1 815 . 2 1 1 A 72 72 GLY H H 72 7.709 8.795 -1.086 1
1 816 . 2 1 1 A 72 72 GLY HA2 H 72 3.800 3.915 -0.115 1
1 817 . 2 1 1 A 72 72 GLY HA3 H 72 3.769 3.920 -0.151 1
1 818 . 2 1 1 A 72 72 GLY C C 72 174.231 173.825 0.406 1
1 819 . 2 1 1 A 72 72 GLY CA C 72 47.866 46.401 1.465 1
1 820 . 2 1 1 A 72 72 GLY N N 72 114.881 110.489 4.392 1
1 821 . 2 1 1 A 73 73 THR H H 73 8.162 7.819 0.343 1
1 822 . 2 1 1 A 73 73 THR HA H 73 4.584 4.734 -0.150 1
1 827 . 2 1 1 A 73 73 THR C C 73 172.208 173.423 -1.215 1
1 828 . 2 1 1 A 73 73 THR CA C 73 62.307 61.330 0.977 1
1 829 . 2 1 1 A 73 73 THR CB C 73 72.123 71.690 0.433 1
1 831 . 2 1 1 A 73 73 THR N N 73 114.225 114.342 -0.117 1
1 832 . 2 1 1 A 74 74 THR H H 74 8.743 8.791 -0.048 1
1 833 . 2 1 1 A 74 74 THR HA H 74 5.138 4.973 0.165 1
1 838 . 2 1 1 A 74 74 THR C C 74 173.376 173.346 0.030 1
1 839 . 2 1 1 A 74 74 THR CA C 74 62.724 62.846 -0.122 1
1 840 . 2 1 1 A 74 74 THR CB C 74 69.202 70.077 -0.875 1
1 842 . 2 1 1 A 74 74 THR N N 74 123.376 120.837 2.539 1
1 843 . 2 1 1 A 75 75 TYR H H 75 9.549 9.014 0.535 1
1 844 . 2 1 1 A 75 75 TYR HA H 75 4.892 5.203 -0.311 1
1 851 . 2 1 1 A 75 75 TYR C C 75 173.991 175.410 -1.419 1
1 852 . 2 1 1 A 75 75 TYR CA C 75 57.740 55.961 1.779 1
1 853 . 2 1 1 A 75 75 TYR CB C 75 44.580 43.339 1.241 1
1 858 . 2 1 1 A 75 75 TYR N N 75 126.916 124.415 2.501 1
1 859 . 2 1 1 A 76 76 ILE H H 76 8.769 8.927 -0.158 1
1 860 . 2 1 1 A 76 76 ILE HA H 76 4.663 4.967 -0.304 1
1 870 . 2 1 1 A 76 76 ILE C C 76 174.683 175.255 -0.572 1
1 871 . 2 1 1 A 76 76 ILE CA C 76 60.455 60.741 -0.286 1
1 872 . 2 1 1 A 76 76 ILE CB C 76 40.284 39.992 0.292 1
1 876 . 2 1 1 A 76 76 ILE N N 76 119.407 120.748 -1.341 1
1 877 . 2 1 1 A 77 77 PHE H H 77 8.894 8.939 -0.045 1
1 878 . 2 1 1 A 77 77 PHE HA H 77 5.160 5.111 0.049 1
1 886 . 2 1 1 A 77 77 PHE C C 77 174.794 175.444 -0.650 1
1 887 . 2 1 1 A 77 77 PHE CA C 77 56.831 57.467 -0.636 1
1 888 . 2 1 1 A 77 77 PHE CB C 77 43.132 41.123 2.009 1
1 894 . 2 1 1 A 77 77 PHE N N 77 124.622 127.183 -2.561 1
1 895 . 2 1 1 A 78 78 ARG H H 78 9.407 9.316 0.091 1
1 896 . 2 1 1 A 78 78 ARG HA H 78 5.689 5.614 0.075 1
1 904 . 2 1 1 A 78 78 ARG C C 78 174.376 174.495 -0.119 1
1 905 . 2 1 1 A 78 78 ARG CA C 78 54.530 54.655 -0.125 1
1 906 . 2 1 1 A 78 78 ARG CB C 78 34.473 33.733 0.740 1
1 909 . 2 1 1 A 78 78 ARG N N 78 120.055 120.911 -0.856 1
1 911 . 2 1 1 A 79 79 LEU H H 79 9.132 9.145 -0.013 1
1 912 . 2 1 1 A 79 79 LEU HA H 79 5.398 5.177 0.221 1
1 922 . 2 1 1 A 79 79 LEU C C 79 174.006 174.400 -0.394 1
1 923 . 2 1 1 A 79 79 LEU CA C 79 53.401 53.235 0.166 1
1 924 . 2 1 1 A 79 79 LEU CB C 79 48.116 46.528 1.588 1
1 928 . 2 1 1 A 79 79 LEU N N 79 124.907 125.344 -0.437 1
1 929 . 2 1 1 A 80 80 ALA H H 80 8.737 8.107 0.630 1
1 930 . 2 1 1 A 80 80 ALA HA H 80 4.871 5.007 -0.136 1
1 934 . 2 1 1 A 80 80 ALA C C 80 176.057 175.691 0.366 1
1 935 . 2 1 1 A 80 80 ALA CA C 80 50.353 51.218 -0.865 1
1 936 . 2 1 1 A 80 80 ALA CB C 80 23.972 23.067 0.905 1
1 937 . 2 1 1 A 80 80 ALA N N 80 128.220 125.837 2.383 1
1 938 . 2 1 1 A 81 81 ALA H H 81 9.890 8.641 1.249 1
1 939 . 2 1 1 A 81 81 ALA HA H 81 4.794 5.014 -0.220 1
1 943 . 2 1 1 A 81 81 ALA C C 81 174.655 176.378 -1.723 1
1 944 . 2 1 1 A 81 81 ALA CA C 81 50.300 51.281 -0.981 1
1 945 . 2 1 1 A 81 81 ALA CB C 81 21.369 20.657 0.712 1
1 946 . 2 1 1 A 81 81 ALA N N 81 123.682 123.727 -0.045 1
1 947 . 2 1 1 A 82 82 LYS H H 82 7.965 8.732 -0.767 1
1 948 . 2 1 1 A 82 82 LYS HA H 82 4.974 5.326 -0.352 1
1 957 . 2 1 1 A 82 82 LYS C C 82 175.671 175.094 0.577 1
1 958 . 2 1 1 A 82 82 LYS CA C 82 54.664 54.743 -0.079 1
1 959 . 2 1 1 A 82 82 LYS CB C 82 36.677 35.605 1.072 1
1 963 . 2 1 1 A 82 82 LYS N N 82 118.164 122.235 -4.071 1
1 964 . 2 1 1 A 83 83 ASN H H 83 8.663 8.806 -0.143 1
1 965 . 2 1 1 A 83 83 ASN HA H 83 5.113 5.116 -0.003 1
1 970 . 2 1 1 A 83 83 ASN C C 83 176.582 175.976 0.606 1
1 971 . 2 1 1 A 83 83 ASN CA C 83 51.746 50.672 1.074 1
1 972 . 2 1 1 A 83 83 ASN CB C 83 40.357 40.188 0.169 1
1 973 . 2 1 1 A 83 83 ASN N N 83 124.784 123.972 0.812 1
1 975 . 2 1 1 A 84 84 ARG H H 84 8.873 8.916 -0.043 1
1 976 . 2 1 1 A 84 84 ARG HA H 84 3.940 3.947 -0.007 1
1 983 . 2 1 1 A 84 84 ARG C C 84 176.735 177.684 -0.949 1
1 984 . 2 1 1 A 84 84 ARG CA C 84 59.327 58.920 0.407 1
1 985 . 2 1 1 A 84 84 ARG CB C 84 29.282 29.821 -0.539 1
1 988 . 2 1 1 A 84 84 ARG N N 84 117.891 120.059 -2.168 1
1 989 . 2 1 1 A 85 85 ALA H H 85 7.645 7.844 -0.199 1
1 990 . 2 1 1 A 85 85 ALA HA H 85 4.276 4.268 0.008 1
1 994 . 2 1 1 A 85 85 ALA C C 85 177.479 177.230 0.249 1
1 995 . 2 1 1 A 85 85 ALA CA C 85 52.818 52.898 -0.080 1
1 996 . 2 1 1 A 85 85 ALA CB C 85 18.806 19.596 -0.790 1
1 997 . 2 1 1 A 85 85 ALA N N 85 120.306 119.568 0.738 1
1 998 . 2 1 1 A 86 86 GLY H H 86 7.693 7.638 0.055 1
1 999 . 2 1 1 A 86 86 GLY HA2 H 86 4.456 4.122 0.334 1
1 1000 . 2 1 1 A 86 86 GLY HA3 H 86 3.649 4.125 -0.476 1
1 1001 . 2 1 1 A 86 86 GLY C C 86 172.068 172.360 -0.292 1
1 1002 . 2 1 1 A 86 86 GLY CA C 86 44.375 44.090 0.285 1
1 1003 . 2 1 1 A 86 86 GLY N N 86 106.594 103.837 2.757 1
1 1004 . 2 1 1 A 87 87 LEU H H 87 8.203 8.463 -0.260 1
1 1005 . 2 1 1 A 87 87 LEU HA H 87 4.629 4.727 -0.098 1
1 1015 . 2 1 1 A 87 87 LEU C C 87 179.155 176.685 2.470 1
1 1016 . 2 1 1 A 87 87 LEU CA C 87 54.814 55.391 -0.577 1
1 1017 . 2 1 1 A 87 87 LEU CB C 87 43.454 42.440 1.014 1
1 1021 . 2 1 1 A 87 87 LEU N N 87 120.879 122.214 -1.335 1
1 1022 . 2 1 1 A 88 88 GLY H H 88 8.492 8.282 0.210 1
1 1023 . 2 1 1 A 88 88 GLY HA2 H 88 4.339 4.159 0.180 1
1 1024 . 2 1 1 A 88 88 GLY HA3 H 88 4.122 4.166 -0.044 1
1 1025 . 2 1 1 A 88 88 GLY C C 88 173.030 173.464 -0.434 1
1 1026 . 2 1 1 A 88 88 GLY CA C 88 43.970 44.576 -0.606 1
1 1027 . 2 1 1 A 88 88 GLY N N 88 109.903 110.668 -0.765 1
1 1028 . 2 1 1 A 89 89 GLU H H 89 7.638 8.958 -1.320 1
1 1029 . 2 1 1 A 89 89 GLU HA H 89 4.103 4.315 -0.212 1
1 1034 . 2 1 1 A 89 89 GLU C C 89 177.511 175.415 2.096 1
1 1035 . 2 1 1 A 89 89 GLU CA C 89 56.659 56.883 -0.224 1
1 1036 . 2 1 1 A 89 89 GLU CB C 89 31.324 30.925 0.399 1
1 1038 . 2 1 1 A 89 89 GLU N N 89 117.551 122.051 -4.500 1
1 1039 . 2 1 1 A 90 90 GLU H H 90 8.734 8.879 -0.145 1
1 1040 . 2 1 1 A 90 90 GLU HA H 90 4.651 5.370 -0.719 1
1 1045 . 2 1 1 A 90 90 GLU C C 90 177.452 174.889 2.563 1
1 1046 . 2 1 1 A 90 90 GLU CA C 90 55.987 54.785 1.202 1
1 1047 . 2 1 1 A 90 90 GLU CB C 90 31.135 33.719 -2.584 1
1 1049 . 2 1 1 A 90 90 GLU N N 90 121.553 118.974 2.579 1
1 1050 . 2 1 1 A 91 91 PHE H H 91 9.411 9.358 0.053 1
1 1051 . 2 1 1 A 91 91 PHE HA H 91 4.665 4.949 -0.284 1
1 1059 . 2 1 1 A 91 91 PHE C C 91 173.944 174.757 -0.813 1
1 1060 . 2 1 1 A 91 91 PHE CA C 91 57.687 58.386 -0.699 1
1 1061 . 2 1 1 A 91 91 PHE CB C 91 40.890 40.601 0.289 1
1 1067 . 2 1 1 A 91 91 PHE N N 91 125.459 125.306 0.153 1
1 1068 . 2 1 1 A 92 92 GLU H H 92 8.043 8.153 -0.110 1
1 1069 . 2 1 1 A 92 92 GLU HA H 92 5.424 5.265 0.159 1
1 1074 . 2 1 1 A 92 92 GLU C C 92 174.295 174.513 -0.218 1
1 1075 . 2 1 1 A 92 92 GLU CA C 92 54.378 54.589 -0.211 1
1 1076 . 2 1 1 A 92 92 GLU CB C 92 33.662 33.474 0.188 1
1 1078 . 2 1 1 A 92 92 GLU N N 92 128.905 126.842 2.063 1
1 1079 . 2 1 1 A 93 93 LYS H H 93 9.142 8.447 0.695 1
1 1080 . 2 1 1 A 93 93 LYS HA H 93 4.541 5.054 -0.513 1
1 1089 . 2 1 1 A 93 93 LYS C C 93 173.366 173.885 -0.519 1
1 1090 . 2 1 1 A 93 93 LYS CA C 93 55.343 55.753 -0.410 1
1 1091 . 2 1 1 A 93 93 LYS CB C 93 37.317 36.245 1.072 1
1 1095 . 2 1 1 A 93 93 LYS N N 93 125.231 126.037 -0.806 1
1 1096 . 2 1 1 A 94 94 GLU H H 94 8.655 9.186 -0.531 1
1 1097 . 2 1 1 A 94 94 GLU HA H 94 5.558 5.391 0.167 1
1 1102 . 2 1 1 A 94 94 GLU C C 94 176.238 175.572 0.666 1
1 1103 . 2 1 1 A 94 94 GLU CA C 94 54.632 55.048 -0.416 1
1 1104 . 2 1 1 A 94 94 GLU CB C 94 32.166 33.171 -1.005 1
1 1106 . 2 1 1 A 94 94 GLU N N 94 127.232 127.741 -0.509 1
1 1107 . 2 1 1 A 95 95 ILE H H 95 9.302 8.784 0.518 1
1 1108 . 2 1 1 A 95 95 ILE HA H 95 4.794 5.233 -0.439 1
1 1118 . 2 1 1 A 95 95 ILE C C 95 173.138 174.454 -1.316 1
1 1119 . 2 1 1 A 95 95 ILE CA C 95 58.570 58.435 0.135 1
1 1120 . 2 1 1 A 95 95 ILE CB C 95 42.420 42.779 -0.359 1
1 1124 . 2 1 1 A 95 95 ILE N N 95 120.711 121.085 -0.374 1
1 1125 . 2 1 1 A 96 96 ARG H H 96 8.589 8.744 -0.155 1
1 1126 . 2 1 1 A 96 96 ARG HA H 96 5.373 4.851 0.522 1
1 1133 . 2 1 1 A 96 96 ARG C C 96 177.147 174.914 2.233 1
1 1134 . 2 1 1 A 96 96 ARG CA C 96 54.045 55.364 -1.319 1
1 1135 . 2 1 1 A 96 96 ARG CB C 96 32.001 33.593 -1.592 1
1 1138 . 2 1 1 A 96 96 ARG N N 96 124.445 121.592 2.853 1
1 1139 . 2 1 1 A 97 97 THR H H 97 9.243 8.607 0.636 1
1 1140 . 2 1 1 A 97 97 THR HA H 97 4.459 4.591 -0.132 1
1 1145 . 2 1 1 A 97 97 THR C C 97 172.745 173.904 -1.159 1
1 1146 . 2 1 1 A 97 97 THR CA C 97 59.637 60.682 -1.045 1
1 1147 . 2 1 1 A 97 97 THR CB C 97 67.687 68.902 -1.215 1
1 1149 . 2 1 1 A 97 97 THR N N 97 119.370 118.822 0.548 1
1 1150 . 2 1 1 A 98 98 PRO HA H 98 4.494 4.546 -0.052 1
1 1157 . 2 1 1 A 98 98 PRO CA C 98 63.117 62.725 0.392 1
1 1158 . 2 1 1 A 98 98 PRO CB C 98 32.500 32.417 0.083 1
1 1161 . 2 1 1 A 99 99 GLU H H 99 8.534 8.456 0.078 1
1 1162 . 2 1 1 A 99 99 GLU HA H 99 4.195 4.677 -0.482 1
1 1167 . 2 1 1 A 99 99 GLU C C 99 175.881 175.867 0.014 1
1 1168 . 2 1 1 A 99 99 GLU CA C 99 56.330 56.654 -0.324 1
1 1169 . 2 1 1 A 99 99 GLU CB C 99 31.062 30.595 0.467 1
1 1171 . 2 1 1 A 99 99 GLU N N 99 119.688 122.195 -2.507 1
1 1172 . 2 1 1 A 100 100 ASP H H 100 8.536 8.630 -0.094 1
1 1173 . 2 1 1 A 100 100 ASP HA H 100 4.607 5.228 -0.621 1
1 1176 . 2 1 1 A 100 100 ASP C C 100 176.012 173.601 2.411 1
1 1177 . 2 1 1 A 100 100 ASP CA C 100 54.109 52.854 1.255 1
1 1178 . 2 1 1 A 100 100 ASP CB C 100 41.562 45.655 -4.093 1
1 1179 . 2 1 1 A 100 100 ASP N N 100 119.803 119.837 -0.034 1
1 1180 . 2 1 1 A 101 101 LEU H H 101 8.403 8.740 -0.337 1
1 1181 . 2 1 1 A 101 101 LEU HA H 101 4.426 4.876 -0.450 1
1 1191 . 2 1 1 A 101 101 LEU C C 101 177.534 176.141 1.393 1
1 1192 . 2 1 1 A 101 101 LEU CA C 101 55.113 53.723 1.390 1
1 1193 . 2 1 1 A 101 101 LEU CB C 101 42.156 44.126 -1.970 1
1 1197 . 2 1 1 A 101 101 LEU N N 101 123.876 124.102 -0.226 1
1 1198 . 2 1 1 A 102 102 SER H H 102 8.413 8.574 -0.161 1
1 1199 . 2 1 1 A 102 102 SER HA H 102 4.434 4.295 0.139 1
1 1202 . 2 1 1 A 102 102 SER C C 102 174.674 174.850 -0.176 1
1 1203 . 2 1 1 A 102 102 SER CA C 102 58.798 60.421 -1.623 1
1 1204 . 2 1 1 A 102 102 SER CB C 102 63.854 63.059 0.795 1
1 1205 . 2 1 1 A 102 102 SER N N 102 116.667 122.810 -6.143 1
1 1206 . 2 1 1 A 103 103 GLY H H 103 8.213 8.479 -0.266 1
1 1207 . 2 1 1 A 103 103 GLY HA2 H 103 4.164 4.138 0.026 1
1 1208 . 2 1 1 A 103 103 GLY HA3 H 103 4.057 4.139 -0.082 1
1 1209 . 2 1 1 A 103 103 GLY C C 103 171.822 172.406 -0.584 1
1 1210 . 2 1 1 A 103 103 GLY CA C 103 44.658 44.742 -0.084 1
1 1211 . 2 1 1 A 103 103 GLY N N 103 110.592 111.571 -0.979 1
1 1212 . 2 1 1 A 104 104 PRO HA H 104 4.475 4.721 -0.246 1
1 1219 . 2 1 1 A 104 104 PRO C C 104 177.445 175.961 1.484 1
1 1220 . 2 1 1 A 104 104 PRO CA C 104 63.312 62.462 0.850 1
1 1221 . 2 1 1 A 104 104 PRO CB C 104 32.190 29.854 2.336 1
1 1224 . 2 1 1 A 105 105 SER H H 105 8.538 8.468 0.070 1
1 1225 . 2 1 1 A 105 105 SER HA H 105 4.541 4.899 -0.358 1
1 1228 . 2 1 1 A 105 105 SER C C 105 174.616 173.810 0.806 1
1 1229 . 2 1 1 A 105 105 SER CA C 105 58.270 58.838 -0.568 1
1 1230 . 2 1 1 A 105 105 SER CB C 105 63.895 64.267 -0.372 1
1 1231 . 2 1 1 A 105 105 SER N N 105 116.446 119.843 -3.397 1
1 1232 . 2 1 1 A 106 106 SER H H 106 8.350 8.652 -0.302 1
1 1233 . 2 1 1 A 106 106 SER HA H 106 4.541 5.269 -0.728 1
1 1236 . 2 1 1 A 106 106 SER C C 106 174.530 174.090 0.440 1
1 1237 . 2 1 1 A 106 106 SER CA C 106 58.357 56.704 1.653 1
1 1238 . 2 1 1 A 106 106 SER CB C 106 64.020 65.691 -1.671 1
1 1239 . 2 1 1 A 106 106 SER N N 106 117.448 120.141 -2.693 1
1 1 . 3 1 1 A 2 2 SER C C 2 174.723 174.130 0.593 1
1 2 . 3 1 1 A 2 2 SER CA C 2 58.446 57.101 1.345 1
1 3 . 3 1 1 A 2 2 SER CB C 2 63.566 63.197 0.369 1
1 4 . 3 1 1 A 3 3 SER H H 3 8.350 8.152 0.198 1
1 5 . 3 1 1 A 3 3 SER C C 3 173.961 174.776 -0.815 1
1 6 . 3 1 1 A 3 3 SER CA C 3 58.428 59.054 -0.626 1
1 7 . 3 1 1 A 3 3 SER CB C 3 63.937 61.048 2.889 1
1 8 . 3 1 1 A 3 3 SER N N 3 117.923 116.940 0.983 1
1 9 . 3 1 1 A 4 4 GLY H H 4 8.050 8.041 0.009 1
1 10 . 3 1 1 A 4 4 GLY C C 4 179.009 174.301 4.708 1
1 11 . 3 1 1 A 4 4 GLY CA C 4 46.174 46.817 -0.643 1
1 12 . 3 1 1 A 4 4 GLY N N 4 116.890 110.536 6.354 1
1 13 . 3 1 1 A 7 7 GLY HA2 H 7 4.340 4.103 0.237 1
1 14 . 3 1 1 A 7 7 GLY HA3 H 7 3.629 4.104 -0.475 1
1 15 . 3 1 1 A 7 7 GLY CA C 7 44.381 44.805 -0.424 1
1 16 . 3 1 1 A 8 8 PRO HA H 8 4.476 4.521 -0.045 1
1 23 . 3 1 1 A 8 8 PRO C C 8 176.235 176.863 -0.628 1
1 24 . 3 1 1 A 8 8 PRO CA C 8 62.995 62.593 0.402 1
1 25 . 3 1 1 A 8 8 PRO CB C 8 33.266 32.404 0.862 1
1 28 . 3 1 1 A 9 9 GLY H H 9 8.585 8.394 0.191 1
1 29 . 3 1 1 A 9 9 GLY HA2 H 9 4.326 4.133 0.193 1
1 30 . 3 1 1 A 9 9 GLY HA3 H 9 4.009 4.140 -0.131 1
1 31 . 3 1 1 A 9 9 GLY C C 9 172.998 173.120 -0.122 1
1 32 . 3 1 1 A 9 9 GLY CA C 9 44.393 44.155 0.238 1
1 33 . 3 1 1 A 9 9 GLY N N 9 106.004 107.851 -1.847 1
1 34 . 3 1 1 A 10 10 ARG H H 10 8.548 8.365 0.183 1
1 35 . 3 1 1 A 10 10 ARG HA H 10 4.654 4.841 -0.187 1
1 41 . 3 1 1 A 10 10 ARG C C 10 175.780 174.924 0.856 1
1 42 . 3 1 1 A 10 10 ARG CA C 10 54.708 54.713 -0.005 1
1 43 . 3 1 1 A 10 10 ARG CB C 10 31.448 31.073 0.375 1
1 45 . 3 1 1 A 10 10 ARG N N 10 119.407 117.191 2.216 1
1 46 . 3 1 1 A 11 11 PRO HA H 11 4.611 4.598 0.013 1
1 53 . 3 1 1 A 11 11 PRO C C 11 173.510 175.591 -2.081 1
1 54 . 3 1 1 A 11 11 PRO CA C 11 62.360 62.705 -0.345 1
1 55 . 3 1 1 A 11 11 PRO CB C 11 33.402 32.221 1.181 1
1 58 . 3 1 1 A 12 12 THR H H 12 7.572 7.994 -0.422 1
1 59 . 3 1 1 A 12 12 THR HA H 12 3.796 4.302 -0.506 1
1 64 . 3 1 1 A 12 12 THR C C 12 172.337 173.438 -1.101 1
1 65 . 3 1 1 A 12 12 THR CA C 12 61.778 61.575 0.203 1
1 66 . 3 1 1 A 12 12 THR CB C 12 70.561 68.588 1.973 1
1 68 . 3 1 1 A 12 12 THR N N 12 109.653 117.378 -7.725 1
1 69 . 3 1 1 A 13 13 MET H H 13 5.605 8.639 -3.034 1
1 70 . 3 1 1 A 13 13 MET HA H 13 5.091 5.037 0.054 1
1 78 . 3 1 1 A 13 13 MET C C 13 172.639 174.953 -2.314 1
1 79 . 3 1 1 A 13 13 MET CA C 13 54.168 53.933 0.235 1
1 80 . 3 1 1 A 13 13 MET CB C 13 37.632 34.733 2.899 1
1 83 . 3 1 1 A 13 13 MET N N 13 121.634 127.048 -5.414 1
1 84 . 3 1 1 A 14 14 MET H H 14 9.254 9.025 0.229 1
1 85 . 3 1 1 A 14 14 MET HA H 14 4.662 5.085 -0.423 1
1 93 . 3 1 1 A 14 14 MET C C 14 174.388 174.796 -0.408 1
1 94 . 3 1 1 A 14 14 MET CA C 14 54.673 54.523 0.150 1
1 95 . 3 1 1 A 14 14 MET CB C 14 34.907 35.109 -0.202 1
1 98 . 3 1 1 A 14 14 MET N N 14 125.746 123.673 2.073 1
1 99 . 3 1 1 A 15 15 ILE H H 15 8.555 9.237 -0.682 1
1 100 . 3 1 1 A 15 15 ILE HA H 15 4.882 4.952 -0.070 1
1 110 . 3 1 1 A 15 15 ILE C C 15 174.962 175.005 -0.043 1
1 111 . 3 1 1 A 15 15 ILE CA C 15 60.685 60.635 0.050 1
1 112 . 3 1 1 A 15 15 ILE CB C 15 40.878 39.123 1.755 1
1 116 . 3 1 1 A 15 15 ILE N N 15 121.623 126.151 -4.528 1
1 117 . 3 1 1 A 16 16 SER H H 16 8.703 8.922 -0.219 1
1 118 . 3 1 1 A 16 16 SER HA H 16 4.922 4.991 -0.069 1
1 121 . 3 1 1 A 16 16 SER C C 16 173.860 173.058 0.802 1
1 122 . 3 1 1 A 16 16 SER CA C 16 56.524 57.325 -0.801 1
1 123 . 3 1 1 A 16 16 SER CB C 16 65.004 65.806 -0.802 1
1 124 . 3 1 1 A 16 16 SER N N 16 122.261 124.598 -2.337 1
1 125 . 3 1 1 A 17 17 THR H H 17 8.759 8.611 0.148 1
1 126 . 3 1 1 A 17 17 THR HA H 17 4.885 4.801 0.084 1
1 131 . 3 1 1 A 17 17 THR C C 17 175.018 174.598 0.420 1
1 132 . 3 1 1 A 17 17 THR CA C 17 60.315 61.087 -0.772 1
1 133 . 3 1 1 A 17 17 THR CB C 17 69.799 69.998 -0.199 1
1 135 . 3 1 1 A 17 17 THR N N 17 115.660 116.761 -1.101 1
1 136 . 3 1 1 A 18 18 THR H H 18 8.038 8.400 -0.362 1
1 137 . 3 1 1 A 18 18 THR HA H 18 4.596 4.379 0.217 1
1 142 . 3 1 1 A 18 18 THR CA C 18 60.707 62.154 -1.447 1
1 143 . 3 1 1 A 18 18 THR CB C 18 71.082 69.466 1.616 1
1 145 . 3 1 1 A 18 18 THR N N 18 112.362 115.902 -3.540 1
1 146 . 3 1 1 A 19 19 ALA H H 19 8.545 7.541 1.004 1
1 147 . 3 1 1 A 19 19 ALA HA H 19 4.412 4.369 0.043 1
1 151 . 3 1 1 A 19 19 ALA C C 19 177.034 177.049 -0.015 1
1 152 . 3 1 1 A 19 19 ALA CA C 19 52.264 51.832 0.432 1
1 153 . 3 1 1 A 19 19 ALA CB C 19 19.292 20.584 -1.292 1
1 154 . 3 1 1 A 19 19 ALA N N 19 119.589 123.224 -3.635 1
1 155 . 3 1 1 A 20 20 MET H H 20 8.145 8.489 -0.344 1
1 156 . 3 1 1 A 20 20 MET HA H 20 4.447 4.324 0.123 1
1 164 . 3 1 1 A 20 20 MET C C 20 175.676 176.843 -1.167 1
1 165 . 3 1 1 A 20 20 MET CA C 20 55.764 55.556 0.208 1
1 166 . 3 1 1 A 20 20 MET CB C 20 31.495 32.629 -1.134 1
1 169 . 3 1 1 A 20 20 MET N N 20 116.950 119.530 -2.580 1
1 170 . 3 1 1 A 21 21 ASN H H 21 8.275 8.952 -0.677 1
1 171 . 3 1 1 A 21 21 ASN HA H 21 4.452 4.351 0.101 1
1 176 . 3 1 1 A 21 21 ASN C C 21 174.100 173.760 0.340 1
1 177 . 3 1 1 A 21 21 ASN CA C 21 54.320 54.573 -0.253 1
1 178 . 3 1 1 A 21 21 ASN CB C 21 37.234 37.216 0.018 1
1 179 . 3 1 1 A 21 21 ASN N N 21 113.198 119.455 -6.257 1
1 181 . 3 1 1 A 22 22 THR H H 22 7.071 7.080 -0.009 1
1 182 . 3 1 1 A 22 22 THR HA H 22 5.218 5.305 -0.087 1
1 187 . 3 1 1 A 22 22 THR C C 22 173.301 173.054 0.247 1
1 188 . 3 1 1 A 22 22 THR CA C 22 59.399 60.252 -0.853 1
1 189 . 3 1 1 A 22 22 THR CB C 22 72.714 71.649 1.065 1
1 191 . 3 1 1 A 22 22 THR N N 22 107.603 108.037 -0.434 1
1 192 . 3 1 1 A 23 23 ALA H H 23 8.687 8.807 -0.120 1
1 193 . 3 1 1 A 23 23 ALA HA H 23 4.925 5.055 -0.130 1
1 197 . 3 1 1 A 23 23 ALA C C 23 174.100 175.516 -1.416 1
1 198 . 3 1 1 A 23 23 ALA CA C 23 50.812 50.251 0.561 1
1 199 . 3 1 1 A 23 23 ALA CB C 23 21.122 21.044 0.078 1
1 200 . 3 1 1 A 23 23 ALA N N 23 121.937 126.300 -4.363 1
1 201 . 3 1 1 A 24 24 LEU H H 24 8.833 8.960 -0.127 1
1 202 . 3 1 1 A 24 24 LEU HA H 24 4.673 4.490 0.183 1
1 212 . 3 1 1 A 24 24 LEU C C 24 175.140 174.695 0.445 1
1 213 . 3 1 1 A 24 24 LEU CA C 24 54.320 55.050 -0.730 1
1 214 . 3 1 1 A 24 24 LEU CB C 24 42.518 43.103 -0.585 1
1 218 . 3 1 1 A 24 24 LEU N N 24 123.721 126.867 -3.146 1
1 219 . 3 1 1 A 25 25 LEU H H 25 9.176 9.024 0.152 1
1 220 . 3 1 1 A 25 25 LEU HA H 25 5.112 5.104 0.008 1
1 230 . 3 1 1 A 25 25 LEU C C 25 176.414 176.212 0.202 1
1 231 . 3 1 1 A 25 25 LEU CA C 25 54.108 53.042 1.066 1
1 232 . 3 1 1 A 25 25 LEU CB C 25 43.230 43.423 -0.193 1
1 236 . 3 1 1 A 25 25 LEU N N 25 128.589 128.515 0.074 1
1 237 . 3 1 1 A 26 26 GLN H H 26 8.556 8.589 -0.033 1
1 238 . 3 1 1 A 26 26 GLN HA H 26 4.737 4.956 -0.219 1
1 245 . 3 1 1 A 26 26 GLN C C 26 174.372 174.273 0.099 1
1 246 . 3 1 1 A 26 26 GLN CA C 26 56.365 54.452 1.913 1
1 247 . 3 1 1 A 26 26 GLN CB C 26 33.320 31.827 1.493 1
1 249 . 3 1 1 A 26 26 GLN N N 26 119.630 122.838 -3.208 1
1 251 . 3 1 1 A 27 27 TRP H H 27 8.080 8.171 -0.091 1
1 252 . 3 1 1 A 27 27 TRP HA H 27 5.441 5.817 -0.376 1
1 261 . 3 1 1 A 27 27 TRP CA C 27 55.957 54.522 1.435 1
1 262 . 3 1 1 A 27 27 TRP CB C 27 32.517 32.280 0.237 1
1 268 . 3 1 1 A 27 27 TRP N N 27 121.276 121.707 -0.431 1
1 270 . 3 1 1 A 28 28 HIS H H 28 8.262 8.758 -0.496 1
1 271 . 3 1 1 A 28 28 HIS HA H 28 4.997 5.016 -0.019 1
1 275 . 3 1 1 A 28 28 HIS CA C 28 53.028 53.945 -0.917 1
1 276 . 3 1 1 A 28 28 HIS CB C 28 32.832 32.727 0.105 1
1 278 . 3 1 1 A 28 28 HIS N N 28 116.245 116.857 -0.612 1
1 279 . 3 1 1 A 29 29 PRO HA H 29 4.984 4.722 0.262 1
1 286 . 3 1 1 A 29 29 PRO CA C 29 61.498 62.079 -0.581 1
1 287 . 3 1 1 A 29 29 PRO CB C 29 30.709 32.181 -1.472 1
1 290 . 3 1 1 A 30 30 PRO HA H 30 4.449 4.701 -0.252 1
1 297 . 3 1 1 A 30 30 PRO C C 30 175.733 176.526 -0.793 1
1 298 . 3 1 1 A 30 30 PRO CA C 30 62.245 62.719 -0.474 1
1 299 . 3 1 1 A 30 30 PRO CB C 30 32.083 33.122 -1.039 1
1 302 . 3 1 1 A 31 31 LYS H H 31 8.403 8.726 -0.323 1
1 303 . 3 1 1 A 31 31 LYS HA H 31 4.084 4.453 -0.369 1
1 312 . 3 1 1 A 31 31 LYS C C 31 177.166 178.319 -1.153 1
1 313 . 3 1 1 A 31 31 LYS CA C 31 57.866 57.710 0.156 1
1 314 . 3 1 1 A 31 31 LYS CB C 31 32.698 33.425 -0.727 1
1 318 . 3 1 1 A 31 31 LYS N N 31 121.693 122.033 -0.340 1
1 319 . 3 1 1 A 32 32 GLU H H 32 8.102 7.707 0.395 1
1 320 . 3 1 1 A 32 32 GLU HA H 32 4.365 4.460 -0.095 1
1 325 . 3 1 1 A 32 32 GLU C C 32 174.248 176.236 -1.988 1
1 326 . 3 1 1 A 32 32 GLU CA C 32 55.448 55.856 -0.408 1
1 327 . 3 1 1 A 32 32 GLU CB C 32 29.405 30.250 -0.845 1
1 329 . 3 1 1 A 32 32 GLU N N 32 118.742 117.121 1.621 1
1 330 . 3 1 1 A 33 33 LEU H H 33 8.420 7.534 0.886 1
1 331 . 3 1 1 A 33 33 LEU HA H 33 4.499 4.616 -0.117 1
1 341 . 3 1 1 A 33 33 LEU C C 33 173.036 175.041 -2.005 1
1 342 . 3 1 1 A 33 33 LEU CA C 33 52.863 52.608 0.255 1
1 343 . 3 1 1 A 33 33 LEU CB C 33 42.535 42.888 -0.353 1
1 347 . 3 1 1 A 33 33 LEU N N 33 125.181 123.833 1.348 1
1 348 . 3 1 1 A 34 34 PRO HA H 34 4.488 4.480 0.008 1
1 355 . 3 1 1 A 34 34 PRO C C 34 177.544 176.834 0.710 1
1 356 . 3 1 1 A 34 34 PRO CA C 34 62.889 63.216 -0.327 1
1 357 . 3 1 1 A 34 34 PRO CB C 34 31.472 30.884 0.588 1
1 360 . 3 1 1 A 35 35 GLY H H 35 8.397 8.058 0.339 1
1 361 . 3 1 1 A 35 35 GLY HA2 H 35 4.059 4.114 -0.055 1
1 362 . 3 1 1 A 35 35 GLY HA3 H 35 3.716 4.115 -0.399 1
1 363 . 3 1 1 A 35 35 GLY C C 35 173.356 172.194 1.162 1
1 364 . 3 1 1 A 35 35 GLY CA C 35 45.892 44.871 1.021 1
1 365 . 3 1 1 A 35 35 GLY N N 35 110.524 112.032 -1.508 1
1 366 . 3 1 1 A 36 36 GLU H H 36 8.091 8.546 -0.455 1
1 367 . 3 1 1 A 36 36 GLU HA H 36 4.371 5.108 -0.737 1
1 372 . 3 1 1 A 36 36 GLU C C 36 174.864 174.356 0.508 1
1 373 . 3 1 1 A 36 36 GLU CA C 36 55.201 54.536 0.665 1
1 374 . 3 1 1 A 36 36 GLU CB C 36 31.878 33.026 -1.148 1
1 376 . 3 1 1 A 36 36 GLU N N 36 122.202 120.359 1.843 1
1 377 . 3 1 1 A 37 37 LEU H H 37 8.307 8.692 -0.385 1
1 378 . 3 1 1 A 37 37 LEU HA H 37 4.288 4.299 -0.011 1
1 388 . 3 1 1 A 37 37 LEU C C 37 176.702 176.005 0.697 1
1 389 . 3 1 1 A 37 37 LEU CA C 37 55.342 56.193 -0.851 1
1 390 . 3 1 1 A 37 37 LEU CB C 37 42.715 42.226 0.489 1
1 394 . 3 1 1 A 37 37 LEU N N 37 123.204 124.463 -1.259 1
1 395 . 3 1 1 A 38 38 LEU H H 38 8.909 8.732 0.177 1
1 396 . 3 1 1 A 38 38 LEU HA H 38 4.640 4.718 -0.078 1
1 406 . 3 1 1 A 38 38 LEU C C 38 177.202 176.521 0.681 1
1 407 . 3 1 1 A 38 38 LEU CA C 38 54.390 54.751 -0.361 1
1 408 . 3 1 1 A 38 38 LEU CB C 38 43.770 43.550 0.220 1
1 412 . 3 1 1 A 38 38 LEU N N 38 123.021 127.238 -4.217 1
1 413 . 3 1 1 A 39 39 GLY H H 39 7.113 6.922 0.191 1
1 414 . 3 1 1 A 39 39 GLY HA2 H 39 4.816 3.590 1.226 1
1 415 . 3 1 1 A 39 39 GLY HA3 H 39 3.276 3.920 -0.644 1
1 416 . 3 1 1 A 39 39 GLY C C 39 169.863 170.306 -0.443 1
1 417 . 3 1 1 A 39 39 GLY CA C 39 44.622 45.347 -0.725 1
1 418 . 3 1 1 A 39 39 GLY N N 39 104.137 104.607 -0.470 1
1 419 . 3 1 1 A 40 40 TYR H H 40 8.318 8.821 -0.503 1
1 420 . 3 1 1 A 40 40 TYR HA H 40 5.414 5.111 0.303 1
1 425 . 3 1 1 A 40 40 TYR C C 40 174.448 172.144 2.304 1
1 426 . 3 1 1 A 40 40 TYR CA C 40 56.178 56.628 -0.450 1
1 427 . 3 1 1 A 40 40 TYR CB C 40 44.191 40.427 3.764 1
1 430 . 3 1 1 A 40 40 TYR N N 40 114.036 115.540 -1.504 1
1 431 . 3 1 1 A 41 41 ARG H H 41 9.347 8.762 0.585 1
1 432 . 3 1 1 A 41 41 ARG HA H 41 5.092 5.457 -0.365 1
1 440 . 3 1 1 A 41 41 ARG C C 41 174.097 174.030 0.067 1
1 441 . 3 1 1 A 41 41 ARG CA C 41 56.100 54.223 1.877 1
1 442 . 3 1 1 A 41 41 ARG CB C 41 34.508 33.367 1.141 1
1 445 . 3 1 1 A 41 41 ARG N N 41 122.231 121.108 1.123 1
1 447 . 3 1 1 A 42 42 LEU H H 42 9.546 9.036 0.510 1
1 448 . 3 1 1 A 42 42 LEU HA H 42 5.459 5.186 0.273 1
1 458 . 3 1 1 A 42 42 LEU C C 42 174.913 174.662 0.251 1
1 459 . 3 1 1 A 42 42 LEU CA C 42 52.997 53.487 -0.490 1
1 460 . 3 1 1 A 42 42 LEU CB C 42 46.413 46.027 0.386 1
1 464 . 3 1 1 A 42 42 LEU N N 42 132.335 126.691 5.644 1
1 465 . 3 1 1 A 43 43 GLN H H 43 9.502 9.242 0.260 1
1 466 . 3 1 1 A 43 43 GLN HA H 43 5.847 5.342 0.505 1
1 473 . 3 1 1 A 43 43 GLN C C 43 175.329 174.021 1.308 1
1 474 . 3 1 1 A 43 43 GLN CA C 43 54.005 54.373 -0.368 1
1 475 . 3 1 1 A 43 43 GLN CB C 43 33.429 31.747 1.682 1
1 477 . 3 1 1 A 43 43 GLN N N 43 123.932 125.310 -1.378 1
1 479 . 3 1 1 A 44 44 TYR H H 44 8.615 8.452 0.163 1
1 480 . 3 1 1 A 44 44 TYR HA H 44 5.783 5.788 -0.005 1
1 487 . 3 1 1 A 44 44 TYR C C 44 174.058 173.502 0.556 1
1 488 . 3 1 1 A 44 44 TYR CA C 44 55.942 55.794 0.148 1
1 489 . 3 1 1 A 44 44 TYR CB C 44 43.052 41.558 1.494 1
1 494 . 3 1 1 A 44 44 TYR N N 44 117.355 119.501 -2.146 1
1 495 . 3 1 1 A 45 45 CYS H H 45 8.377 8.446 -0.069 1
1 496 . 3 1 1 A 45 45 CYS HA H 45 4.772 5.132 -0.360 1
1 499 . 3 1 1 A 45 45 CYS C C 45 173.205 173.801 -0.596 1
1 500 . 3 1 1 A 45 45 CYS CA C 45 55.960 56.894 -0.934 1
1 501 . 3 1 1 A 45 45 CYS CB C 45 30.665 31.267 -0.602 1
1 502 . 3 1 1 A 45 45 CYS N N 45 115.140 118.939 -3.799 1
1 503 . 3 1 1 A 46 46 ARG H H 46 9.165 8.512 0.653 1
1 504 . 3 1 1 A 46 46 ARG HA H 46 4.068 3.905 0.163 1
1 511 . 3 1 1 A 46 46 ARG C C 46 178.440 177.425 1.015 1
1 512 . 3 1 1 A 46 46 ARG CA C 46 56.401 55.784 0.617 1
1 513 . 3 1 1 A 46 46 ARG CB C 46 31.878 30.771 1.107 1
1 516 . 3 1 1 A 46 46 ARG N N 46 121.803 121.263 0.540 1
1 517 . 3 1 1 A 47 47 ALA H H 47 8.273 8.217 0.056 1
1 518 . 3 1 1 A 47 47 ALA HA H 47 3.891 4.183 -0.292 1
1 522 . 3 1 1 A 47 47 ALA C C 47 177.599 177.104 0.495 1
1 523 . 3 1 1 A 47 47 ALA CA C 47 54.796 53.238 1.558 1
1 524 . 3 1 1 A 47 47 ALA CB C 47 18.287 18.569 -0.282 1
1 525 . 3 1 1 A 47 47 ALA N N 47 123.895 123.802 0.093 1
1 526 . 3 1 1 A 48 48 ASP H H 48 8.036 7.920 0.116 1
1 527 . 3 1 1 A 48 48 ASP HA H 48 4.453 4.841 -0.388 1
1 530 . 3 1 1 A 48 48 ASP C C 48 175.836 175.138 0.698 1
1 531 . 3 1 1 A 48 48 ASP CA C 48 53.368 53.989 -0.621 1
1 532 . 3 1 1 A 48 48 ASP CB C 48 39.964 42.595 -2.631 1
1 533 . 3 1 1 A 48 48 ASP N N 48 112.576 117.545 -4.969 1
1 534 . 3 1 1 A 49 49 GLU H H 49 7.495 7.508 -0.013 1
1 535 . 3 1 1 A 49 49 GLU HA H 49 4.308 4.770 -0.462 1
1 540 . 3 1 1 A 49 49 GLU C C 49 175.756 175.674 0.082 1
1 541 . 3 1 1 A 49 49 GLU CA C 49 56.224 54.911 1.313 1
1 542 . 3 1 1 A 49 49 GLU CB C 49 32.248 32.369 -0.121 1
1 544 . 3 1 1 A 49 49 GLU N N 49 120.609 118.614 1.995 1
1 545 . 3 1 1 A 50 50 ALA H H 50 8.416 8.393 0.023 1
1 546 . 3 1 1 A 50 50 ALA HA H 50 4.200 4.481 -0.281 1
1 550 . 3 1 1 A 50 50 ALA C C 50 177.433 176.484 0.949 1
1 551 . 3 1 1 A 50 50 ALA CA C 50 53.297 51.986 1.311 1
1 552 . 3 1 1 A 50 50 ALA CB C 50 19.474 19.988 -0.514 1
1 553 . 3 1 1 A 50 50 ALA N N 50 124.065 123.847 0.218 1
1 554 . 3 1 1 A 51 51 ARG H H 51 7.648 7.758 -0.110 1
1 555 . 3 1 1 A 51 51 ARG HA H 51 4.747 4.633 0.114 1
1 562 . 3 1 1 A 51 51 ARG C C 51 173.400 173.504 -0.104 1
1 563 . 3 1 1 A 51 51 ARG CA C 51 52.592 53.165 -0.573 1
1 564 . 3 1 1 A 51 51 ARG CB C 51 31.212 30.862 0.350 1
1 567 . 3 1 1 A 51 51 ARG N N 51 117.798 118.902 -1.104 1
1 568 . 3 1 1 A 52 52 PRO HA H 52 4.212 4.456 -0.244 1
1 575 . 3 1 1 A 52 52 PRO C C 52 176.380 176.791 -0.411 1
1 576 . 3 1 1 A 52 52 PRO CA C 52 62.360 62.591 -0.231 1
1 577 . 3 1 1 A 52 52 PRO CB C 52 32.331 32.093 0.238 1
1 580 . 3 1 1 A 53 53 ASN H H 53 8.127 8.154 -0.027 1
1 581 . 3 1 1 A 53 53 ASN HA H 53 4.651 4.691 -0.040 1
1 586 . 3 1 1 A 53 53 ASN C C 53 174.354 174.756 -0.402 1
1 587 . 3 1 1 A 53 53 ASN CA C 53 53.136 52.878 0.258 1
1 588 . 3 1 1 A 53 53 ASN CB C 53 39.666 37.952 1.714 1
1 589 . 3 1 1 A 53 53 ASN N N 53 119.405 120.290 -0.885 1
1 591 . 3 1 1 A 54 54 THR H H 54 8.425 8.521 -0.096 1
1 592 . 3 1 1 A 54 54 THR HA H 54 5.306 4.513 0.793 1
1 597 . 3 1 1 A 54 54 THR C C 54 173.850 174.130 -0.280 1
1 598 . 3 1 1 A 54 54 THR CA C 54 61.881 62.704 -0.823 1
1 599 . 3 1 1 A 54 54 THR CB C 54 70.573 69.821 0.752 1
1 601 . 3 1 1 A 54 54 THR N N 54 118.968 119.174 -0.206 1
1 602 . 3 1 1 A 55 55 ILE H H 55 9.354 8.561 0.793 1
1 603 . 3 1 1 A 55 55 ILE HA H 55 4.051 4.599 -0.548 1
1 613 . 3 1 1 A 55 55 ILE C C 55 172.975 173.388 -0.413 1
1 614 . 3 1 1 A 55 55 ILE CA C 55 61.003 59.730 1.273 1
1 615 . 3 1 1 A 55 55 ILE CB C 55 41.619 42.080 -0.461 1
1 619 . 3 1 1 A 55 55 ILE N N 55 127.961 126.413 1.548 1
1 620 . 3 1 1 A 56 56 ASP H H 56 8.132 8.690 -0.558 1
1 621 . 3 1 1 A 56 56 ASP HA H 56 5.334 5.290 0.044 1
1 624 . 3 1 1 A 56 56 ASP C C 56 174.969 174.549 0.420 1
1 625 . 3 1 1 A 56 56 ASP CA C 56 53.702 52.627 1.075 1
1 626 . 3 1 1 A 56 56 ASP CB C 56 43.251 43.089 0.162 1
1 627 . 3 1 1 A 56 56 ASP N N 56 125.882 126.799 -0.917 1
1 628 . 3 1 1 A 57 57 PHE H H 57 8.955 8.802 0.153 1
1 629 . 3 1 1 A 57 57 PHE HA H 57 4.915 5.042 -0.127 1
1 637 . 3 1 1 A 57 57 PHE C C 57 177.361 175.499 1.862 1
1 638 . 3 1 1 A 57 57 PHE CA C 57 57.458 56.481 0.977 1
1 639 . 3 1 1 A 57 57 PHE CB C 57 43.737 43.698 0.039 1
1 645 . 3 1 1 A 57 57 PHE N N 57 118.872 123.077 -4.205 1
1 646 . 3 1 1 A 58 58 GLY H H 58 9.552 9.246 0.306 1
1 647 . 3 1 1 A 58 58 GLY HA2 H 58 4.662 4.135 0.527 1
1 648 . 3 1 1 A 58 58 GLY HA3 H 58 4.126 4.203 -0.077 1
1 649 . 3 1 1 A 58 58 GLY C C 58 174.760 174.923 -0.163 1
1 650 . 3 1 1 A 58 58 GLY CA C 58 44.680 45.011 -0.331 1
1 651 . 3 1 1 A 58 58 GLY N N 58 111.551 109.789 1.762 1
1 652 . 3 1 1 A 59 59 LYS H H 59 8.211 8.657 -0.446 1
1 653 . 3 1 1 A 59 59 LYS HA H 59 3.782 3.685 0.097 1
1 662 . 3 1 1 A 59 59 LYS C C 59 176.154 178.222 -2.068 1
1 663 . 3 1 1 A 59 59 LYS CA C 59 59.080 58.687 0.393 1
1 664 . 3 1 1 A 59 59 LYS CB C 59 32.516 31.790 0.726 1
1 668 . 3 1 1 A 59 59 LYS N N 59 115.953 120.524 -4.571 1
1 669 . 3 1 1 A 60 60 ASP H H 60 8.634 8.219 0.415 1
1 670 . 3 1 1 A 60 60 ASP HA H 60 4.882 4.404 0.478 1
1 673 . 3 1 1 A 60 60 ASP C C 60 176.039 176.258 -0.219 1
1 674 . 3 1 1 A 60 60 ASP CA C 60 54.327 57.218 -2.891 1
1 675 . 3 1 1 A 60 60 ASP CB C 60 41.461 41.266 0.195 1
1 676 . 3 1 1 A 60 60 ASP N N 60 117.261 120.257 -2.996 1
1 677 . 3 1 1 A 61 61 ASP H H 61 7.500 8.460 -0.960 1
1 678 . 3 1 1 A 61 61 ASP HA H 61 4.591 4.658 -0.067 1
1 681 . 3 1 1 A 61 61 ASP C C 61 175.140 175.887 -0.747 1
1 682 . 3 1 1 A 61 61 ASP CA C 61 55.342 53.970 1.372 1
1 683 . 3 1 1 A 61 61 ASP CB C 61 42.475 40.078 2.397 1
1 684 . 3 1 1 A 61 61 ASP N N 61 122.319 118.646 3.673 1
1 685 . 3 1 1 A 62 62 GLN H H 62 8.239 7.962 0.277 1
1 686 . 3 1 1 A 62 62 GLN HA H 62 2.569 3.594 -1.025 1
1 693 . 3 1 1 A 62 62 GLN C C 62 172.652 173.540 -0.888 1
1 694 . 3 1 1 A 62 62 GLN CA C 62 54.038 55.437 -1.399 1
1 695 . 3 1 1 A 62 62 GLN CB C 62 31.481 29.200 2.281 1
1 697 . 3 1 1 A 62 62 GLN N N 62 117.458 123.361 -5.903 1
1 699 . 3 1 1 A 63 63 HIS H H 63 6.338 6.749 -0.411 1
1 700 . 3 1 1 A 63 63 HIS HA H 63 4.423 4.522 -0.099 1
1 704 . 3 1 1 A 63 63 HIS C C 63 173.031 172.625 0.406 1
1 705 . 3 1 1 A 63 63 HIS CA C 63 54.743 54.092 0.651 1
1 706 . 3 1 1 A 63 63 HIS CB C 63 32.661 31.432 1.229 1
1 708 . 3 1 1 A 63 63 HIS N N 63 113.589 116.034 -2.445 1
1 709 . 3 1 1 A 64 64 PHE H H 64 8.549 9.125 -0.576 1
1 710 . 3 1 1 A 64 64 PHE HA H 64 4.578 5.128 -0.550 1
1 718 . 3 1 1 A 64 64 PHE C C 64 173.015 173.543 -0.528 1
1 719 . 3 1 1 A 64 64 PHE CA C 64 58.516 57.247 1.269 1
1 720 . 3 1 1 A 64 64 PHE CB C 64 43.525 43.095 0.430 1
1 726 . 3 1 1 A 64 64 PHE N N 64 118.214 119.840 -1.626 1
1 727 . 3 1 1 A 65 65 THR H H 65 7.150 8.126 -0.976 1
1 728 . 3 1 1 A 65 65 THR HA H 65 4.930 4.692 0.238 1
1 733 . 3 1 1 A 65 65 THR C C 65 172.457 173.422 -0.965 1
1 734 . 3 1 1 A 65 65 THR CA C 65 61.690 61.650 0.040 1
1 735 . 3 1 1 A 65 65 THR CB C 65 69.593 69.538 0.055 1
1 737 . 3 1 1 A 65 65 THR N N 65 123.198 119.989 3.209 1
1 738 . 3 1 1 A 66 66 VAL H H 66 8.888 8.498 0.390 1
1 739 . 3 1 1 A 66 66 VAL HA H 66 4.018 4.687 -0.669 1
1 747 . 3 1 1 A 66 66 VAL C C 66 174.868 175.324 -0.456 1
1 748 . 3 1 1 A 66 66 VAL CA C 66 61.178 60.627 0.551 1
1 749 . 3 1 1 A 66 66 VAL CB C 66 33.114 33.117 -0.003 1
1 752 . 3 1 1 A 66 66 VAL N N 66 126.840 128.700 -1.860 1
1 753 . 3 1 1 A 67 67 THR H H 67 8.174 8.541 -0.367 1
1 754 . 3 1 1 A 67 67 THR HA H 67 4.816 5.017 -0.201 1
1 759 . 3 1 1 A 67 67 THR C C 67 174.494 174.262 0.232 1
1 760 . 3 1 1 A 67 67 THR CA C 67 59.786 59.516 0.270 1
1 761 . 3 1 1 A 67 67 THR CB C 67 70.887 71.609 -0.722 1
1 763 . 3 1 1 A 67 67 THR N N 67 116.127 117.057 -0.930 1
1 764 . 3 1 1 A 68 68 GLY H H 68 8.570 8.822 -0.252 1
1 765 . 3 1 1 A 68 68 GLY HA2 H 68 3.970 3.999 -0.029 1
1 766 . 3 1 1 A 68 68 GLY HA3 H 68 3.819 4.014 -0.195 1
1 767 . 3 1 1 A 68 68 GLY C C 68 175.636 174.773 0.863 1
1 768 . 3 1 1 A 68 68 GLY CA C 68 46.397 45.016 1.381 1
1 769 . 3 1 1 A 68 68 GLY N N 68 107.146 113.222 -6.076 1
1 770 . 3 1 1 A 69 69 LEU H H 69 8.007 7.444 0.563 1
1 771 . 3 1 1 A 69 69 LEU HA H 69 4.154 4.232 -0.078 1
1 781 . 3 1 1 A 69 69 LEU C C 69 176.830 176.371 0.459 1
1 782 . 3 1 1 A 69 69 LEU CA C 69 54.602 54.922 -0.320 1
1 783 . 3 1 1 A 69 69 LEU CB C 69 41.149 42.101 -0.952 1
1 787 . 3 1 1 A 69 69 LEU N N 69 118.433 122.758 -4.325 1
1 788 . 3 1 1 A 70 70 HIS H H 70 8.866 8.787 0.079 1
1 789 . 3 1 1 A 70 70 HIS HA H 70 4.663 4.617 0.046 1
1 793 . 3 1 1 A 70 70 HIS C C 70 176.667 175.593 1.074 1
1 794 . 3 1 1 A 70 70 HIS CA C 70 55.464 57.322 -1.858 1
1 795 . 3 1 1 A 70 70 HIS CB C 70 32.125 29.671 2.454 1
1 797 . 3 1 1 A 70 70 HIS N N 70 122.457 123.073 -0.616 1
1 798 . 3 1 1 A 71 71 LYS H H 71 8.716 8.592 0.124 1
1 799 . 3 1 1 A 71 71 LYS HA H 71 4.320 4.108 0.212 1
1 808 . 3 1 1 A 71 71 LYS C C 71 178.110 176.722 1.388 1
1 809 . 3 1 1 A 71 71 LYS CA C 71 57.035 56.364 0.671 1
1 810 . 3 1 1 A 71 71 LYS CB C 71 33.580 32.875 0.705 1
1 814 . 3 1 1 A 71 71 LYS N N 71 123.173 124.124 -0.951 1
1 815 . 3 1 1 A 72 72 GLY H H 72 7.709 9.033 -1.324 1
1 816 . 3 1 1 A 72 72 GLY HA2 H 72 3.800 3.917 -0.117 1
1 817 . 3 1 1 A 72 72 GLY HA3 H 72 3.769 3.922 -0.153 1
1 818 . 3 1 1 A 72 72 GLY C C 72 174.231 173.878 0.353 1
1 819 . 3 1 1 A 72 72 GLY CA C 72 47.866 46.426 1.440 1
1 820 . 3 1 1 A 72 72 GLY N N 72 114.881 110.375 4.506 1
1 821 . 3 1 1 A 73 73 THR H H 73 8.162 7.689 0.473 1
1 822 . 3 1 1 A 73 73 THR HA H 73 4.584 4.683 -0.099 1
1 827 . 3 1 1 A 73 73 THR C C 73 172.208 173.402 -1.194 1
1 828 . 3 1 1 A 73 73 THR CA C 73 62.307 61.254 1.053 1
1 829 . 3 1 1 A 73 73 THR CB C 73 72.123 71.881 0.242 1
1 831 . 3 1 1 A 73 73 THR N N 73 114.225 114.423 -0.198 1
1 832 . 3 1 1 A 74 74 THR H H 74 8.743 8.783 -0.040 1
1 833 . 3 1 1 A 74 74 THR HA H 74 5.138 4.852 0.286 1
1 838 . 3 1 1 A 74 74 THR C C 74 173.376 173.610 -0.234 1
1 839 . 3 1 1 A 74 74 THR CA C 74 62.724 63.067 -0.343 1
1 840 . 3 1 1 A 74 74 THR CB C 74 69.202 69.634 -0.432 1
1 842 . 3 1 1 A 74 74 THR N N 74 123.376 121.319 2.057 1
1 843 . 3 1 1 A 75 75 TYR H H 75 9.549 9.145 0.404 1
1 844 . 3 1 1 A 75 75 TYR HA H 75 4.892 5.225 -0.333 1
1 851 . 3 1 1 A 75 75 TYR C C 75 173.991 175.302 -1.311 1
1 852 . 3 1 1 A 75 75 TYR CA C 75 57.740 56.063 1.677 1
1 853 . 3 1 1 A 75 75 TYR CB C 75 44.580 43.363 1.217 1
1 858 . 3 1 1 A 75 75 TYR N N 75 126.916 125.806 1.110 1
1 859 . 3 1 1 A 76 76 ILE H H 76 8.769 9.283 -0.514 1
1 860 . 3 1 1 A 76 76 ILE HA H 76 4.663 5.002 -0.339 1
1 870 . 3 1 1 A 76 76 ILE C C 76 174.683 175.338 -0.655 1
1 871 . 3 1 1 A 76 76 ILE CA C 76 60.455 60.693 -0.238 1
1 872 . 3 1 1 A 76 76 ILE CB C 76 40.284 40.421 -0.137 1
1 876 . 3 1 1 A 76 76 ILE N N 76 119.407 120.777 -1.370 1
1 877 . 3 1 1 A 77 77 PHE H H 77 8.894 9.261 -0.367 1
1 878 . 3 1 1 A 77 77 PHE HA H 77 5.160 5.165 -0.005 1
1 886 . 3 1 1 A 77 77 PHE C C 77 174.794 175.323 -0.529 1
1 887 . 3 1 1 A 77 77 PHE CA C 77 56.831 57.346 -0.515 1
1 888 . 3 1 1 A 77 77 PHE CB C 77 43.132 41.549 1.583 1
1 894 . 3 1 1 A 77 77 PHE N N 77 124.622 126.454 -1.832 1
1 895 . 3 1 1 A 78 78 ARG H H 78 9.407 9.148 0.259 1
1 896 . 3 1 1 A 78 78 ARG HA H 78 5.689 5.632 0.057 1
1 904 . 3 1 1 A 78 78 ARG C C 78 174.376 174.489 -0.113 1
1 905 . 3 1 1 A 78 78 ARG CA C 78 54.530 54.622 -0.092 1
1 906 . 3 1 1 A 78 78 ARG CB C 78 34.473 33.774 0.699 1
1 909 . 3 1 1 A 78 78 ARG N N 78 120.055 120.907 -0.852 1
1 911 . 3 1 1 A 79 79 LEU H H 79 9.132 8.729 0.403 1
1 912 . 3 1 1 A 79 79 LEU HA H 79 5.398 5.126 0.272 1
1 922 . 3 1 1 A 79 79 LEU C C 79 174.006 174.322 -0.316 1
1 923 . 3 1 1 A 79 79 LEU CA C 79 53.401 53.219 0.182 1
1 924 . 3 1 1 A 79 79 LEU CB C 79 48.116 46.563 1.553 1
1 928 . 3 1 1 A 79 79 LEU N N 79 124.907 124.636 0.271 1
1 929 . 3 1 1 A 80 80 ALA H H 80 8.737 8.061 0.676 1
1 930 . 3 1 1 A 80 80 ALA HA H 80 4.871 5.019 -0.148 1
1 934 . 3 1 1 A 80 80 ALA C C 80 176.057 175.604 0.453 1
1 935 . 3 1 1 A 80 80 ALA CA C 80 50.353 51.243 -0.890 1
1 936 . 3 1 1 A 80 80 ALA CB C 80 23.972 23.492 0.480 1
1 937 . 3 1 1 A 80 80 ALA N N 80 128.220 125.383 2.837 1
1 938 . 3 1 1 A 81 81 ALA H H 81 9.890 8.598 1.292 1
1 939 . 3 1 1 A 81 81 ALA HA H 81 4.794 5.081 -0.287 1
1 943 . 3 1 1 A 81 81 ALA C C 81 174.655 176.114 -1.459 1
1 944 . 3 1 1 A 81 81 ALA CA C 81 50.300 51.075 -0.775 1
1 945 . 3 1 1 A 81 81 ALA CB C 81 21.369 20.773 0.596 1
1 946 . 3 1 1 A 81 81 ALA N N 81 123.682 123.332 0.350 1
1 947 . 3 1 1 A 82 82 LYS H H 82 7.965 8.648 -0.683 1
1 948 . 3 1 1 A 82 82 LYS HA H 82 4.974 5.172 -0.198 1
1 957 . 3 1 1 A 82 82 LYS C C 82 175.671 175.134 0.537 1
1 958 . 3 1 1 A 82 82 LYS CA C 82 54.664 54.766 -0.102 1
1 959 . 3 1 1 A 82 82 LYS CB C 82 36.677 35.476 1.201 1
1 963 . 3 1 1 A 82 82 LYS N N 82 118.164 122.348 -4.184 1
1 964 . 3 1 1 A 83 83 ASN H H 83 8.663 8.611 0.052 1
1 965 . 3 1 1 A 83 83 ASN HA H 83 5.113 5.060 0.053 1
1 970 . 3 1 1 A 83 83 ASN C C 83 176.582 176.469 0.113 1
1 971 . 3 1 1 A 83 83 ASN CA C 83 51.746 50.683 1.063 1
1 972 . 3 1 1 A 83 83 ASN CB C 83 40.357 40.141 0.216 1
1 973 . 3 1 1 A 83 83 ASN N N 83 124.784 124.092 0.692 1
1 975 . 3 1 1 A 84 84 ARG H H 84 8.873 8.743 0.130 1
1 976 . 3 1 1 A 84 84 ARG HA H 84 3.940 3.953 -0.013 1
1 983 . 3 1 1 A 84 84 ARG C C 84 176.735 177.635 -0.900 1
1 984 . 3 1 1 A 84 84 ARG CA C 84 59.327 59.615 -0.288 1
1 985 . 3 1 1 A 84 84 ARG CB C 84 29.282 29.873 -0.591 1
1 988 . 3 1 1 A 84 84 ARG N N 84 117.891 118.744 -0.853 1
1 989 . 3 1 1 A 85 85 ALA H H 85 7.645 7.797 -0.152 1
1 990 . 3 1 1 A 85 85 ALA HA H 85 4.276 4.275 0.001 1
1 994 . 3 1 1 A 85 85 ALA C C 85 177.479 177.364 0.115 1
1 995 . 3 1 1 A 85 85 ALA CA C 85 52.818 52.409 0.409 1
1 996 . 3 1 1 A 85 85 ALA CB C 85 18.806 19.383 -0.577 1
1 997 . 3 1 1 A 85 85 ALA N N 85 120.306 119.752 0.554 1
1 998 . 3 1 1 A 86 86 GLY H H 86 7.693 7.917 -0.224 1
1 999 . 3 1 1 A 86 86 GLY HA2 H 86 4.456 4.042 0.414 1
1 1000 . 3 1 1 A 86 86 GLY HA3 H 86 3.649 4.044 -0.395 1
1 1001 . 3 1 1 A 86 86 GLY C C 86 172.068 172.803 -0.735 1
1 1002 . 3 1 1 A 86 86 GLY CA C 86 44.375 43.669 0.706 1
1 1003 . 3 1 1 A 86 86 GLY N N 86 106.594 104.727 1.867 1
1 1004 . 3 1 1 A 87 87 LEU H H 87 8.203 8.509 -0.306 1
1 1005 . 3 1 1 A 87 87 LEU HA H 87 4.629 4.676 -0.047 1
1 1015 . 3 1 1 A 87 87 LEU C C 87 179.155 176.479 2.676 1
1 1016 . 3 1 1 A 87 87 LEU CA C 87 54.814 55.528 -0.714 1
1 1017 . 3 1 1 A 87 87 LEU CB C 87 43.454 42.468 0.986 1
1 1021 . 3 1 1 A 87 87 LEU N N 87 120.879 122.183 -1.304 1
1 1022 . 3 1 1 A 88 88 GLY H H 88 8.492 8.220 0.272 1
1 1023 . 3 1 1 A 88 88 GLY HA2 H 88 4.339 4.155 0.184 1
1 1024 . 3 1 1 A 88 88 GLY HA3 H 88 4.122 4.162 -0.040 1
1 1025 . 3 1 1 A 88 88 GLY C C 88 173.030 173.348 -0.318 1
1 1026 . 3 1 1 A 88 88 GLY CA C 88 43.970 44.668 -0.698 1
1 1027 . 3 1 1 A 88 88 GLY N N 88 109.903 110.219 -0.316 1
1 1028 . 3 1 1 A 89 89 GLU H H 89 7.638 9.005 -1.367 1
1 1029 . 3 1 1 A 89 89 GLU HA H 89 4.103 4.257 -0.154 1
1 1034 . 3 1 1 A 89 89 GLU C C 89 177.511 175.777 1.734 1
1 1035 . 3 1 1 A 89 89 GLU CA C 89 56.659 57.045 -0.386 1
1 1036 . 3 1 1 A 89 89 GLU CB C 89 31.324 30.769 0.555 1
1 1038 . 3 1 1 A 89 89 GLU N N 89 117.551 122.090 -4.539 1
1 1039 . 3 1 1 A 90 90 GLU H H 90 8.734 8.971 -0.237 1
1 1040 . 3 1 1 A 90 90 GLU HA H 90 4.651 5.297 -0.646 1
1 1045 . 3 1 1 A 90 90 GLU C C 90 177.452 174.248 3.204 1
1 1046 . 3 1 1 A 90 90 GLU CA C 90 55.987 54.546 1.441 1
1 1047 . 3 1 1 A 90 90 GLU CB C 90 31.135 33.316 -2.181 1
1 1049 . 3 1 1 A 90 90 GLU N N 90 121.553 118.225 3.328 1
1 1050 . 3 1 1 A 91 91 PHE H H 91 9.411 8.984 0.427 1
1 1051 . 3 1 1 A 91 91 PHE HA H 91 4.665 5.127 -0.462 1
1 1059 . 3 1 1 A 91 91 PHE C C 91 173.944 174.216 -0.272 1
1 1060 . 3 1 1 A 91 91 PHE CA C 91 57.687 57.113 0.574 1
1 1061 . 3 1 1 A 91 91 PHE CB C 91 40.890 42.144 -1.254 1
1 1067 . 3 1 1 A 91 91 PHE N N 91 125.459 125.080 0.379 1
1 1068 . 3 1 1 A 92 92 GLU H H 92 8.043 8.232 -0.189 1
1 1069 . 3 1 1 A 92 92 GLU HA H 92 5.424 5.327 0.097 1
1 1074 . 3 1 1 A 92 92 GLU C C 92 174.295 174.623 -0.328 1
1 1075 . 3 1 1 A 92 92 GLU CA C 92 54.378 54.703 -0.325 1
1 1076 . 3 1 1 A 92 92 GLU CB C 92 33.662 33.229 0.433 1
1 1078 . 3 1 1 A 92 92 GLU N N 92 128.905 127.325 1.580 1
1 1079 . 3 1 1 A 93 93 LYS H H 93 9.142 8.728 0.414 1
1 1080 . 3 1 1 A 93 93 LYS HA H 93 4.541 5.127 -0.586 1
1 1089 . 3 1 1 A 93 93 LYS C C 93 173.366 173.989 -0.623 1
1 1090 . 3 1 1 A 93 93 LYS CA C 93 55.343 55.457 -0.114 1
1 1091 . 3 1 1 A 93 93 LYS CB C 93 37.317 36.262 1.055 1
1 1095 . 3 1 1 A 93 93 LYS N N 93 125.231 126.873 -1.642 1
1 1096 . 3 1 1 A 94 94 GLU H H 94 8.655 9.187 -0.532 1
1 1097 . 3 1 1 A 94 94 GLU HA H 94 5.558 5.567 -0.009 1
1 1102 . 3 1 1 A 94 94 GLU C C 94 176.238 175.476 0.762 1
1 1103 . 3 1 1 A 94 94 GLU CA C 94 54.632 55.053 -0.421 1
1 1104 . 3 1 1 A 94 94 GLU CB C 94 32.166 33.220 -1.054 1
1 1106 . 3 1 1 A 94 94 GLU N N 94 127.232 127.539 -0.307 1
1 1107 . 3 1 1 A 95 95 ILE H H 95 9.302 9.134 0.168 1
1 1108 . 3 1 1 A 95 95 ILE HA H 95 4.794 5.227 -0.433 1
1 1118 . 3 1 1 A 95 95 ILE C C 95 173.138 174.589 -1.451 1
1 1119 . 3 1 1 A 95 95 ILE CA C 95 58.570 58.655 -0.085 1
1 1120 . 3 1 1 A 95 95 ILE CB C 95 42.420 42.445 -0.025 1
1 1124 . 3 1 1 A 95 95 ILE N N 95 120.711 121.122 -0.411 1
1 1125 . 3 1 1 A 96 96 ARG H H 96 8.589 8.693 -0.104 1
1 1126 . 3 1 1 A 96 96 ARG HA H 96 5.373 4.763 0.610 1
1 1133 . 3 1 1 A 96 96 ARG C C 96 177.147 175.003 2.144 1
1 1134 . 3 1 1 A 96 96 ARG CA C 96 54.045 55.353 -1.308 1
1 1135 . 3 1 1 A 96 96 ARG CB C 96 32.001 33.435 -1.434 1
1 1138 . 3 1 1 A 96 96 ARG N N 96 124.445 121.579 2.866 1
1 1139 . 3 1 1 A 97 97 THR H H 97 9.243 8.441 0.802 1
1 1140 . 3 1 1 A 97 97 THR HA H 97 4.459 4.595 -0.136 1
1 1145 . 3 1 1 A 97 97 THR C C 97 172.745 173.862 -1.117 1
1 1146 . 3 1 1 A 97 97 THR CA C 97 59.637 60.654 -1.017 1
1 1147 . 3 1 1 A 97 97 THR CB C 97 67.687 68.884 -1.197 1
1 1149 . 3 1 1 A 97 97 THR N N 97 119.370 118.846 0.524 1
1 1150 . 3 1 1 A 98 98 PRO HA H 98 4.494 4.570 -0.076 1
1 1157 . 3 1 1 A 98 98 PRO CA C 98 63.117 62.763 0.354 1
1 1158 . 3 1 1 A 98 98 PRO CB C 98 32.500 32.566 -0.066 1
1 1161 . 3 1 1 A 99 99 GLU H H 99 8.534 8.459 0.075 1
1 1162 . 3 1 1 A 99 99 GLU HA H 99 4.195 4.678 -0.483 1
1 1167 . 3 1 1 A 99 99 GLU C C 99 175.881 175.705 0.176 1
1 1168 . 3 1 1 A 99 99 GLU CA C 99 56.330 56.616 -0.286 1
1 1169 . 3 1 1 A 99 99 GLU CB C 99 31.062 30.602 0.460 1
1 1171 . 3 1 1 A 99 99 GLU N N 99 119.688 121.894 -2.206 1
1 1172 . 3 1 1 A 100 100 ASP H H 100 8.536 8.813 -0.277 1
1 1173 . 3 1 1 A 100 100 ASP HA H 100 4.607 5.021 -0.414 1
1 1176 . 3 1 1 A 100 100 ASP C C 100 176.012 175.843 0.169 1
1 1177 . 3 1 1 A 100 100 ASP CA C 100 54.109 52.773 1.336 1
1 1178 . 3 1 1 A 100 100 ASP CB C 100 41.562 44.903 -3.341 1
1 1179 . 3 1 1 A 100 100 ASP N N 100 119.803 120.207 -0.404 1
1 1180 . 3 1 1 A 101 101 LEU H H 101 8.403 8.478 -0.075 1
1 1181 . 3 1 1 A 101 101 LEU HA H 101 4.426 4.446 -0.020 1
1 1191 . 3 1 1 A 101 101 LEU C C 101 177.534 177.306 0.228 1
1 1192 . 3 1 1 A 101 101 LEU CA C 101 55.113 53.993 1.120 1
1 1193 . 3 1 1 A 101 101 LEU CB C 101 42.156 43.634 -1.478 1
1 1197 . 3 1 1 A 101 101 LEU N N 101 123.876 120.689 3.187 1
1 1198 . 3 1 1 A 102 102 SER H H 102 8.413 9.092 -0.679 1
1 1199 . 3 1 1 A 102 102 SER HA H 102 4.434 4.494 -0.060 1
1 1202 . 3 1 1 A 102 102 SER C C 102 174.674 174.312 0.362 1
1 1203 . 3 1 1 A 102 102 SER CA C 102 58.798 59.623 -0.825 1
1 1204 . 3 1 1 A 102 102 SER CB C 102 63.854 64.759 -0.905 1
1 1205 . 3 1 1 A 102 102 SER N N 102 116.667 114.799 1.868 1
1 1206 . 3 1 1 A 103 103 GLY H H 103 8.213 7.296 0.917 1
1 1207 . 3 1 1 A 103 103 GLY HA2 H 103 4.164 4.107 0.057 1
1 1208 . 3 1 1 A 103 103 GLY HA3 H 103 4.057 4.107 -0.050 1
1 1209 . 3 1 1 A 103 103 GLY C C 103 171.822 173.652 -1.830 1
1 1210 . 3 1 1 A 103 103 GLY CA C 103 44.658 44.997 -0.339 1
1 1211 . 3 1 1 A 103 103 GLY N N 103 110.592 107.075 3.517 1
1 1212 . 3 1 1 A 104 104 PRO HA H 104 4.475 4.524 -0.049 1
1 1219 . 3 1 1 A 104 104 PRO C C 104 177.445 176.375 1.070 1
1 1220 . 3 1 1 A 104 104 PRO CA C 104 63.312 63.704 -0.392 1
1 1221 . 3 1 1 A 104 104 PRO CB C 104 32.190 31.738 0.452 1
1 1224 . 3 1 1 A 105 105 SER H H 105 8.538 7.748 0.790 1
1 1225 . 3 1 1 A 105 105 SER HA H 105 4.541 4.360 0.181 1
1 1228 . 3 1 1 A 105 105 SER C C 105 174.616 173.856 0.760 1
1 1229 . 3 1 1 A 105 105 SER CA C 105 58.270 60.605 -2.335 1
1 1230 . 3 1 1 A 105 105 SER CB C 105 63.895 63.907 -0.012 1
1 1231 . 3 1 1 A 105 105 SER N N 105 116.446 116.195 0.251 1
1 1232 . 3 1 1 A 106 106 SER H H 106 8.350 8.796 -0.446 1
1 1233 . 3 1 1 A 106 106 SER HA H 106 4.541 5.412 -0.871 1
1 1236 . 3 1 1 A 106 106 SER C C 106 174.530 173.371 1.159 1
1 1237 . 3 1 1 A 106 106 SER CA C 106 58.357 56.192 2.165 1
1 1238 . 3 1 1 A 106 106 SER CB C 106 64.020 66.558 -2.538 1
1 1239 . 3 1 1 A 106 106 SER N N 106 117.448 120.480 -3.032 1
1 1 . 4 1 1 A 2 2 SER C C 2 174.723 174.329 0.394 1
1 2 . 4 1 1 A 2 2 SER CA C 2 58.446 58.711 -0.265 1
1 3 . 4 1 1 A 2 2 SER CB C 2 63.566 64.008 -0.442 1
1 4 . 4 1 1 A 3 3 SER H H 3 8.350 8.602 -0.252 1
1 5 . 4 1 1 A 3 3 SER C C 3 173.961 173.645 0.316 1
1 6 . 4 1 1 A 3 3 SER CA C 3 58.428 56.193 2.235 1
1 7 . 4 1 1 A 3 3 SER CB C 3 63.937 66.200 -2.263 1
1 8 . 4 1 1 A 3 3 SER N N 3 117.923 116.143 1.780 1
1 9 . 4 1 1 A 4 4 GLY H H 4 8.050 8.591 -0.541 1
1 10 . 4 1 1 A 4 4 GLY C C 4 179.009 174.622 4.387 1
1 11 . 4 1 1 A 4 4 GLY CA C 4 46.174 45.392 0.782 1
1 12 . 4 1 1 A 4 4 GLY N N 4 116.890 110.396 6.494 1
1 13 . 4 1 1 A 7 7 GLY HA2 H 7 4.340 4.183 0.157 1
1 14 . 4 1 1 A 7 7 GLY HA3 H 7 3.629 4.184 -0.555 1
1 15 . 4 1 1 A 7 7 GLY CA C 7 44.381 45.180 -0.799 1
1 16 . 4 1 1 A 8 8 PRO HA H 8 4.476 4.535 -0.059 1
1 23 . 4 1 1 A 8 8 PRO C C 8 176.235 177.487 -1.252 1
1 24 . 4 1 1 A 8 8 PRO CA C 8 62.995 62.605 0.390 1
1 25 . 4 1 1 A 8 8 PRO CB C 8 33.266 32.301 0.965 1
1 28 . 4 1 1 A 9 9 GLY H H 9 8.585 8.409 0.176 1
1 29 . 4 1 1 A 9 9 GLY HA2 H 9 4.326 4.114 0.212 1
1 30 . 4 1 1 A 9 9 GLY HA3 H 9 4.009 4.122 -0.113 1
1 31 . 4 1 1 A 9 9 GLY C C 9 172.998 173.452 -0.454 1
1 32 . 4 1 1 A 9 9 GLY CA C 9 44.393 44.296 0.097 1
1 33 . 4 1 1 A 9 9 GLY N N 9 106.004 107.588 -1.584 1
1 34 . 4 1 1 A 10 10 ARG H H 10 8.548 8.423 0.125 1
1 35 . 4 1 1 A 10 10 ARG HA H 10 4.654 4.809 -0.155 1
1 41 . 4 1 1 A 10 10 ARG C C 10 175.780 174.129 1.651 1
1 42 . 4 1 1 A 10 10 ARG CA C 10 54.708 52.755 1.953 1
1 43 . 4 1 1 A 10 10 ARG CB C 10 31.448 30.932 0.516 1
1 45 . 4 1 1 A 10 10 ARG N N 10 119.407 121.485 -2.078 1
1 46 . 4 1 1 A 11 11 PRO HA H 11 4.611 4.607 0.004 1
1 53 . 4 1 1 A 11 11 PRO C C 11 173.510 175.689 -2.179 1
1 54 . 4 1 1 A 11 11 PRO CA C 11 62.360 62.698 -0.338 1
1 55 . 4 1 1 A 11 11 PRO CB C 11 33.402 32.261 1.141 1
1 58 . 4 1 1 A 12 12 THR H H 12 7.572 8.489 -0.917 1
1 59 . 4 1 1 A 12 12 THR HA H 12 3.796 4.375 -0.579 1
1 64 . 4 1 1 A 12 12 THR C C 12 172.337 173.330 -0.993 1
1 65 . 4 1 1 A 12 12 THR CA C 12 61.778 61.654 0.124 1
1 66 . 4 1 1 A 12 12 THR CB C 12 70.561 68.618 1.943 1
1 68 . 4 1 1 A 12 12 THR N N 12 109.653 117.365 -7.712 1
1 69 . 4 1 1 A 13 13 MET H H 13 5.605 8.610 -3.005 1
1 70 . 4 1 1 A 13 13 MET HA H 13 5.091 4.974 0.117 1
1 78 . 4 1 1 A 13 13 MET C C 13 172.639 174.996 -2.357 1
1 79 . 4 1 1 A 13 13 MET CA C 13 54.168 53.649 0.519 1
1 80 . 4 1 1 A 13 13 MET CB C 13 37.632 34.716 2.916 1
1 83 . 4 1 1 A 13 13 MET N N 13 121.634 126.918 -5.284 1
1 84 . 4 1 1 A 14 14 MET H H 14 9.254 9.008 0.246 1
1 85 . 4 1 1 A 14 14 MET HA H 14 4.662 5.128 -0.466 1
1 93 . 4 1 1 A 14 14 MET C C 14 174.388 174.725 -0.337 1
1 94 . 4 1 1 A 14 14 MET CA C 14 54.673 54.416 0.257 1
1 95 . 4 1 1 A 14 14 MET CB C 14 34.907 35.057 -0.150 1
1 98 . 4 1 1 A 14 14 MET N N 14 125.746 123.861 1.885 1
1 99 . 4 1 1 A 15 15 ILE H H 15 8.555 9.195 -0.640 1
1 100 . 4 1 1 A 15 15 ILE HA H 15 4.882 5.137 -0.255 1
1 110 . 4 1 1 A 15 15 ILE C C 15 174.962 175.071 -0.109 1
1 111 . 4 1 1 A 15 15 ILE CA C 15 60.685 60.411 0.274 1
1 112 . 4 1 1 A 15 15 ILE CB C 15 40.878 39.025 1.853 1
1 116 . 4 1 1 A 15 15 ILE N N 15 121.623 125.834 -4.211 1
1 117 . 4 1 1 A 16 16 SER H H 16 8.703 8.943 -0.240 1
1 118 . 4 1 1 A 16 16 SER HA H 16 4.922 4.992 -0.070 1
1 121 . 4 1 1 A 16 16 SER C C 16 173.860 173.178 0.682 1
1 122 . 4 1 1 A 16 16 SER CA C 16 56.524 57.342 -0.818 1
1 123 . 4 1 1 A 16 16 SER CB C 16 65.004 65.819 -0.815 1
1 124 . 4 1 1 A 16 16 SER N N 16 122.261 124.589 -2.328 1
1 125 . 4 1 1 A 17 17 THR H H 17 8.759 8.625 0.134 1
1 126 . 4 1 1 A 17 17 THR HA H 17 4.885 4.719 0.166 1
1 131 . 4 1 1 A 17 17 THR C C 17 175.018 174.535 0.483 1
1 132 . 4 1 1 A 17 17 THR CA C 17 60.315 61.186 -0.871 1
1 133 . 4 1 1 A 17 17 THR CB C 17 69.799 70.007 -0.208 1
1 135 . 4 1 1 A 17 17 THR N N 17 115.660 116.792 -1.132 1
1 136 . 4 1 1 A 18 18 THR H H 18 8.038 8.378 -0.340 1
1 137 . 4 1 1 A 18 18 THR HA H 18 4.596 4.427 0.169 1
1 142 . 4 1 1 A 18 18 THR CA C 18 60.707 62.179 -1.472 1
1 143 . 4 1 1 A 18 18 THR CB C 18 71.082 69.706 1.376 1
1 145 . 4 1 1 A 18 18 THR N N 18 112.362 115.595 -3.233 1
1 146 . 4 1 1 A 19 19 ALA H H 19 8.545 7.513 1.032 1
1 147 . 4 1 1 A 19 19 ALA HA H 19 4.412 4.421 -0.009 1
1 151 . 4 1 1 A 19 19 ALA C C 19 177.034 177.057 -0.023 1
1 152 . 4 1 1 A 19 19 ALA CA C 19 52.264 51.657 0.607 1
1 153 . 4 1 1 A 19 19 ALA CB C 19 19.292 20.601 -1.309 1
1 154 . 4 1 1 A 19 19 ALA N N 19 119.589 123.618 -4.029 1
1 155 . 4 1 1 A 20 20 MET H H 20 8.145 8.499 -0.354 1
1 156 . 4 1 1 A 20 20 MET HA H 20 4.447 4.343 0.104 1
1 164 . 4 1 1 A 20 20 MET C C 20 175.676 176.516 -0.840 1
1 165 . 4 1 1 A 20 20 MET CA C 20 55.764 54.981 0.783 1
1 166 . 4 1 1 A 20 20 MET CB C 20 31.495 32.218 -0.723 1
1 169 . 4 1 1 A 20 20 MET N N 20 116.950 117.797 -0.847 1
1 170 . 4 1 1 A 21 21 ASN H H 21 8.275 8.924 -0.649 1
1 171 . 4 1 1 A 21 21 ASN HA H 21 4.452 4.323 0.129 1
1 176 . 4 1 1 A 21 21 ASN C C 21 174.100 173.732 0.368 1
1 177 . 4 1 1 A 21 21 ASN CA C 21 54.320 54.552 -0.232 1
1 178 . 4 1 1 A 21 21 ASN CB C 21 37.234 37.388 -0.154 1
1 179 . 4 1 1 A 21 21 ASN N N 21 113.198 118.444 -5.246 1
1 181 . 4 1 1 A 22 22 THR H H 22 7.071 7.092 -0.021 1
1 182 . 4 1 1 A 22 22 THR HA H 22 5.218 5.317 -0.099 1
1 187 . 4 1 1 A 22 22 THR C C 22 173.301 173.070 0.231 1
1 188 . 4 1 1 A 22 22 THR CA C 22 59.399 60.106 -0.707 1
1 189 . 4 1 1 A 22 22 THR CB C 22 72.714 71.603 1.111 1
1 191 . 4 1 1 A 22 22 THR N N 22 107.603 108.311 -0.708 1
1 192 . 4 1 1 A 23 23 ALA H H 23 8.687 8.888 -0.201 1
1 193 . 4 1 1 A 23 23 ALA HA H 23 4.925 5.097 -0.172 1
1 197 . 4 1 1 A 23 23 ALA C C 23 174.100 175.634 -1.534 1
1 198 . 4 1 1 A 23 23 ALA CA C 23 50.812 50.000 0.812 1
1 199 . 4 1 1 A 23 23 ALA CB C 23 21.122 21.268 -0.146 1
1 200 . 4 1 1 A 23 23 ALA N N 23 121.937 126.715 -4.778 1
1 201 . 4 1 1 A 24 24 LEU H H 24 8.833 8.937 -0.104 1
1 202 . 4 1 1 A 24 24 LEU HA H 24 4.673 4.655 0.018 1
1 212 . 4 1 1 A 24 24 LEU C C 24 175.140 174.471 0.669 1
1 213 . 4 1 1 A 24 24 LEU CA C 24 54.320 54.535 -0.215 1
1 214 . 4 1 1 A 24 24 LEU CB C 24 42.518 43.660 -1.142 1
1 218 . 4 1 1 A 24 24 LEU N N 24 123.721 126.416 -2.695 1
1 219 . 4 1 1 A 25 25 LEU H H 25 9.176 8.923 0.253 1
1 220 . 4 1 1 A 25 25 LEU HA H 25 5.112 4.975 0.137 1
1 230 . 4 1 1 A 25 25 LEU C C 25 176.414 175.735 0.679 1
1 231 . 4 1 1 A 25 25 LEU CA C 25 54.108 53.030 1.078 1
1 232 . 4 1 1 A 25 25 LEU CB C 25 43.230 43.026 0.204 1
1 236 . 4 1 1 A 25 25 LEU N N 25 128.589 128.477 0.112 1
1 237 . 4 1 1 A 26 26 GLN H H 26 8.556 8.811 -0.255 1
1 238 . 4 1 1 A 26 26 GLN HA H 26 4.737 4.820 -0.083 1
1 245 . 4 1 1 A 26 26 GLN C C 26 174.372 174.260 0.112 1
1 246 . 4 1 1 A 26 26 GLN CA C 26 56.365 54.394 1.971 1
1 247 . 4 1 1 A 26 26 GLN CB C 26 33.320 31.623 1.697 1
1 249 . 4 1 1 A 26 26 GLN N N 26 119.630 123.003 -3.373 1
1 251 . 4 1 1 A 27 27 TRP H H 27 8.080 8.205 -0.125 1
1 252 . 4 1 1 A 27 27 TRP HA H 27 5.441 5.735 -0.294 1
1 261 . 4 1 1 A 27 27 TRP CA C 27 55.957 54.338 1.619 1
1 262 . 4 1 1 A 27 27 TRP CB C 27 32.517 32.227 0.290 1
1 268 . 4 1 1 A 27 27 TRP N N 27 121.276 121.721 -0.445 1
1 270 . 4 1 1 A 28 28 HIS H H 28 8.262 8.604 -0.342 1
1 271 . 4 1 1 A 28 28 HIS HA H 28 4.997 5.016 -0.019 1
1 275 . 4 1 1 A 28 28 HIS CA C 28 53.028 53.951 -0.923 1
1 276 . 4 1 1 A 28 28 HIS CB C 28 32.832 32.844 -0.012 1
1 278 . 4 1 1 A 28 28 HIS N N 28 116.245 116.841 -0.596 1
1 279 . 4 1 1 A 29 29 PRO HA H 29 4.984 4.683 0.301 1
1 286 . 4 1 1 A 29 29 PRO CA C 29 61.498 62.125 -0.627 1
1 287 . 4 1 1 A 29 29 PRO CB C 29 30.709 32.455 -1.746 1
1 290 . 4 1 1 A 30 30 PRO HA H 30 4.449 4.684 -0.235 1
1 297 . 4 1 1 A 30 30 PRO C C 30 175.733 176.423 -0.690 1
1 298 . 4 1 1 A 30 30 PRO CA C 30 62.245 62.623 -0.378 1
1 299 . 4 1 1 A 30 30 PRO CB C 30 32.083 33.363 -1.280 1
1 302 . 4 1 1 A 31 31 LYS H H 31 8.403 8.647 -0.244 1
1 303 . 4 1 1 A 31 31 LYS HA H 31 4.084 4.459 -0.375 1
1 312 . 4 1 1 A 31 31 LYS C C 31 177.166 178.193 -1.027 1
1 313 . 4 1 1 A 31 31 LYS CA C 31 57.866 56.991 0.875 1
1 314 . 4 1 1 A 31 31 LYS CB C 31 32.698 33.617 -0.919 1
1 318 . 4 1 1 A 31 31 LYS N N 31 121.693 121.358 0.335 1
1 319 . 4 1 1 A 32 32 GLU H H 32 8.102 7.785 0.317 1
1 320 . 4 1 1 A 32 32 GLU HA H 32 4.365 4.404 -0.039 1
1 325 . 4 1 1 A 32 32 GLU C C 32 174.248 176.539 -2.291 1
1 326 . 4 1 1 A 32 32 GLU CA C 32 55.448 56.290 -0.842 1
1 327 . 4 1 1 A 32 32 GLU CB C 32 29.405 30.259 -0.854 1
1 329 . 4 1 1 A 32 32 GLU N N 32 118.742 116.825 1.917 1
1 330 . 4 1 1 A 33 33 LEU H H 33 8.420 7.464 0.956 1
1 331 . 4 1 1 A 33 33 LEU HA H 33 4.499 4.550 -0.051 1
1 341 . 4 1 1 A 33 33 LEU C C 33 173.036 175.123 -2.087 1
1 342 . 4 1 1 A 33 33 LEU CA C 33 52.863 52.912 -0.049 1
1 343 . 4 1 1 A 33 33 LEU CB C 33 42.535 42.749 -0.214 1
1 347 . 4 1 1 A 33 33 LEU N N 33 125.181 123.909 1.272 1
1 348 . 4 1 1 A 34 34 PRO HA H 34 4.488 4.478 0.010 1
1 355 . 4 1 1 A 34 34 PRO C C 34 177.544 177.000 0.544 1
1 356 . 4 1 1 A 34 34 PRO CA C 34 62.889 63.230 -0.341 1
1 357 . 4 1 1 A 34 34 PRO CB C 34 31.472 30.892 0.580 1
1 360 . 4 1 1 A 35 35 GLY H H 35 8.397 8.054 0.343 1
1 361 . 4 1 1 A 35 35 GLY HA2 H 35 4.059 4.115 -0.056 1
1 362 . 4 1 1 A 35 35 GLY HA3 H 35 3.716 4.116 -0.400 1
1 363 . 4 1 1 A 35 35 GLY C C 35 173.356 172.194 1.162 1
1 364 . 4 1 1 A 35 35 GLY CA C 35 45.892 44.882 1.010 1
1 365 . 4 1 1 A 35 35 GLY N N 35 110.524 112.268 -1.744 1
1 366 . 4 1 1 A 36 36 GLU H H 36 8.091 8.545 -0.454 1
1 367 . 4 1 1 A 36 36 GLU HA H 36 4.371 5.100 -0.729 1
1 372 . 4 1 1 A 36 36 GLU C C 36 174.864 174.389 0.475 1
1 373 . 4 1 1 A 36 36 GLU CA C 36 55.201 54.532 0.669 1
1 374 . 4 1 1 A 36 36 GLU CB C 36 31.878 33.049 -1.171 1
1 376 . 4 1 1 A 36 36 GLU N N 36 122.202 120.339 1.863 1
1 377 . 4 1 1 A 37 37 LEU H H 37 8.307 8.714 -0.407 1
1 378 . 4 1 1 A 37 37 LEU HA H 37 4.288 4.311 -0.023 1
1 388 . 4 1 1 A 37 37 LEU C C 37 176.702 175.949 0.753 1
1 389 . 4 1 1 A 37 37 LEU CA C 37 55.342 55.740 -0.398 1
1 390 . 4 1 1 A 37 37 LEU CB C 37 42.715 42.425 0.290 1
1 394 . 4 1 1 A 37 37 LEU N N 37 123.204 124.374 -1.170 1
1 395 . 4 1 1 A 38 38 LEU H H 38 8.909 8.768 0.141 1
1 396 . 4 1 1 A 38 38 LEU HA H 38 4.640 4.738 -0.098 1
1 406 . 4 1 1 A 38 38 LEU C C 38 177.202 176.187 1.015 1
1 407 . 4 1 1 A 38 38 LEU CA C 38 54.390 54.585 -0.195 1
1 408 . 4 1 1 A 38 38 LEU CB C 38 43.770 43.246 0.524 1
1 412 . 4 1 1 A 38 38 LEU N N 38 123.021 127.553 -4.532 1
1 413 . 4 1 1 A 39 39 GLY H H 39 7.113 6.887 0.226 1
1 414 . 4 1 1 A 39 39 GLY HA2 H 39 4.816 3.598 1.218 1
1 415 . 4 1 1 A 39 39 GLY HA3 H 39 3.276 3.935 -0.659 1
1 416 . 4 1 1 A 39 39 GLY C C 39 169.863 170.345 -0.482 1
1 417 . 4 1 1 A 39 39 GLY CA C 39 44.622 45.334 -0.712 1
1 418 . 4 1 1 A 39 39 GLY N N 39 104.137 105.195 -1.058 1
1 419 . 4 1 1 A 40 40 TYR H H 40 8.318 8.840 -0.522 1
1 420 . 4 1 1 A 40 40 TYR HA H 40 5.414 5.106 0.308 1
1 425 . 4 1 1 A 40 40 TYR C C 40 174.448 172.133 2.315 1
1 426 . 4 1 1 A 40 40 TYR CA C 40 56.178 56.560 -0.382 1
1 427 . 4 1 1 A 40 40 TYR CB C 40 44.191 40.679 3.512 1
1 430 . 4 1 1 A 40 40 TYR N N 40 114.036 115.627 -1.591 1
1 431 . 4 1 1 A 41 41 ARG H H 41 9.347 8.718 0.629 1
1 432 . 4 1 1 A 41 41 ARG HA H 41 5.092 5.456 -0.364 1
1 440 . 4 1 1 A 41 41 ARG C C 41 174.097 174.120 -0.023 1
1 441 . 4 1 1 A 41 41 ARG CA C 41 56.100 54.330 1.770 1
1 442 . 4 1 1 A 41 41 ARG CB C 41 34.508 33.062 1.446 1
1 445 . 4 1 1 A 41 41 ARG N N 41 122.231 121.116 1.115 1
1 447 . 4 1 1 A 42 42 LEU H H 42 9.546 9.150 0.396 1
1 448 . 4 1 1 A 42 42 LEU HA H 42 5.459 5.261 0.198 1
1 458 . 4 1 1 A 42 42 LEU C C 42 174.913 174.662 0.251 1
1 459 . 4 1 1 A 42 42 LEU CA C 42 52.997 53.418 -0.421 1
1 460 . 4 1 1 A 42 42 LEU CB C 42 46.413 45.949 0.464 1
1 464 . 4 1 1 A 42 42 LEU N N 42 132.335 127.151 5.184 1
1 465 . 4 1 1 A 43 43 GLN H H 43 9.502 9.284 0.218 1
1 466 . 4 1 1 A 43 43 GLN HA H 43 5.847 5.335 0.512 1
1 473 . 4 1 1 A 43 43 GLN C C 43 175.329 174.024 1.305 1
1 474 . 4 1 1 A 43 43 GLN CA C 43 54.005 54.315 -0.310 1
1 475 . 4 1 1 A 43 43 GLN CB C 43 33.429 32.089 1.340 1
1 477 . 4 1 1 A 43 43 GLN N N 43 123.932 125.324 -1.392 1
1 479 . 4 1 1 A 44 44 TYR H H 44 8.615 8.501 0.114 1
1 480 . 4 1 1 A 44 44 TYR HA H 44 5.783 5.741 0.042 1
1 487 . 4 1 1 A 44 44 TYR C C 44 174.058 173.528 0.530 1
1 488 . 4 1 1 A 44 44 TYR CA C 44 55.942 56.045 -0.103 1
1 489 . 4 1 1 A 44 44 TYR CB C 44 43.052 41.661 1.391 1
1 494 . 4 1 1 A 44 44 TYR N N 44 117.355 119.645 -2.290 1
1 495 . 4 1 1 A 45 45 CYS H H 45 8.377 8.299 0.078 1
1 496 . 4 1 1 A 45 45 CYS HA H 45 4.772 5.125 -0.353 1
1 499 . 4 1 1 A 45 45 CYS C C 45 173.205 173.726 -0.521 1
1 500 . 4 1 1 A 45 45 CYS CA C 45 55.960 56.869 -0.909 1
1 501 . 4 1 1 A 45 45 CYS CB C 45 30.665 31.338 -0.673 1
1 502 . 4 1 1 A 45 45 CYS N N 45 115.140 118.347 -3.207 1
1 503 . 4 1 1 A 46 46 ARG H H 46 9.165 8.500 0.665 1
1 504 . 4 1 1 A 46 46 ARG HA H 46 4.068 3.789 0.279 1
1 511 . 4 1 1 A 46 46 ARG C C 46 178.440 177.477 0.963 1
1 512 . 4 1 1 A 46 46 ARG CA C 46 56.401 55.491 0.910 1
1 513 . 4 1 1 A 46 46 ARG CB C 46 31.878 30.719 1.159 1
1 516 . 4 1 1 A 46 46 ARG N N 46 121.803 121.301 0.502 1
1 517 . 4 1 1 A 47 47 ALA H H 47 8.273 8.374 -0.101 1
1 518 . 4 1 1 A 47 47 ALA HA H 47 3.891 4.129 -0.238 1
1 522 . 4 1 1 A 47 47 ALA C C 47 177.599 177.343 0.256 1
1 523 . 4 1 1 A 47 47 ALA CA C 47 54.796 53.486 1.310 1
1 524 . 4 1 1 A 47 47 ALA CB C 47 18.287 18.547 -0.260 1
1 525 . 4 1 1 A 47 47 ALA N N 47 123.895 123.798 0.097 1
1 526 . 4 1 1 A 48 48 ASP H H 48 8.036 7.997 0.039 1
1 527 . 4 1 1 A 48 48 ASP HA H 48 4.453 4.772 -0.319 1
1 530 . 4 1 1 A 48 48 ASP C C 48 175.836 175.900 -0.064 1
1 531 . 4 1 1 A 48 48 ASP CA C 48 53.368 52.876 0.492 1
1 532 . 4 1 1 A 48 48 ASP CB C 48 39.964 41.153 -1.189 1
1 533 . 4 1 1 A 48 48 ASP N N 48 112.576 117.347 -4.771 1
1 534 . 4 1 1 A 49 49 GLU H H 49 7.495 7.395 0.100 1
1 535 . 4 1 1 A 49 49 GLU HA H 49 4.308 4.391 -0.083 1
1 540 . 4 1 1 A 49 49 GLU C C 49 175.756 175.774 -0.018 1
1 541 . 4 1 1 A 49 49 GLU CA C 49 56.224 55.427 0.797 1
1 542 . 4 1 1 A 49 49 GLU CB C 49 32.248 30.476 1.772 1
1 544 . 4 1 1 A 49 49 GLU N N 49 120.609 119.464 1.145 1
1 545 . 4 1 1 A 50 50 ALA H H 50 8.416 8.575 -0.159 1
1 546 . 4 1 1 A 50 50 ALA HA H 50 4.200 4.493 -0.293 1
1 550 . 4 1 1 A 50 50 ALA C C 50 177.433 177.425 0.008 1
1 551 . 4 1 1 A 50 50 ALA CA C 50 53.297 52.355 0.942 1
1 552 . 4 1 1 A 50 50 ALA CB C 50 19.474 20.779 -1.305 1
1 553 . 4 1 1 A 50 50 ALA N N 50 124.065 123.169 0.896 1
1 554 . 4 1 1 A 51 51 ARG H H 51 7.648 7.587 0.061 1
1 555 . 4 1 1 A 51 51 ARG HA H 51 4.747 4.750 -0.003 1
1 562 . 4 1 1 A 51 51 ARG C C 51 173.400 173.503 -0.103 1
1 563 . 4 1 1 A 51 51 ARG CA C 51 52.592 52.490 0.102 1
1 564 . 4 1 1 A 51 51 ARG CB C 51 31.212 32.142 -0.930 1
1 567 . 4 1 1 A 51 51 ARG N N 51 117.798 117.804 -0.006 1
1 568 . 4 1 1 A 52 52 PRO HA H 52 4.212 4.449 -0.237 1
1 575 . 4 1 1 A 52 52 PRO C C 52 176.380 175.662 0.718 1
1 576 . 4 1 1 A 52 52 PRO CA C 52 62.360 62.658 -0.298 1
1 577 . 4 1 1 A 52 52 PRO CB C 52 32.331 32.416 -0.085 1
1 580 . 4 1 1 A 53 53 ASN H H 53 8.127 8.314 -0.187 1
1 581 . 4 1 1 A 53 53 ASN HA H 53 4.651 4.870 -0.219 1
1 586 . 4 1 1 A 53 53 ASN C C 53 174.354 174.360 -0.006 1
1 587 . 4 1 1 A 53 53 ASN CA C 53 53.136 52.367 0.769 1
1 588 . 4 1 1 A 53 53 ASN CB C 53 39.666 38.387 1.279 1
1 589 . 4 1 1 A 53 53 ASN N N 53 119.405 119.682 -0.277 1
1 591 . 4 1 1 A 54 54 THR H H 54 8.425 8.606 -0.181 1
1 592 . 4 1 1 A 54 54 THR HA H 54 5.306 4.493 0.813 1
1 597 . 4 1 1 A 54 54 THR C C 54 173.850 174.297 -0.447 1
1 598 . 4 1 1 A 54 54 THR CA C 54 61.881 63.274 -1.393 1
1 599 . 4 1 1 A 54 54 THR CB C 54 70.573 69.643 0.930 1
1 601 . 4 1 1 A 54 54 THR N N 54 118.968 121.003 -2.035 1
1 602 . 4 1 1 A 55 55 ILE H H 55 9.354 8.364 0.990 1
1 603 . 4 1 1 A 55 55 ILE HA H 55 4.051 4.491 -0.440 1
1 613 . 4 1 1 A 55 55 ILE C C 55 172.975 173.253 -0.278 1
1 614 . 4 1 1 A 55 55 ILE CA C 55 61.003 59.786 1.217 1
1 615 . 4 1 1 A 55 55 ILE CB C 55 41.619 41.933 -0.314 1
1 619 . 4 1 1 A 55 55 ILE N N 55 127.961 125.116 2.845 1
1 620 . 4 1 1 A 56 56 ASP H H 56 8.132 8.653 -0.521 1
1 621 . 4 1 1 A 56 56 ASP HA H 56 5.334 5.137 0.197 1
1 624 . 4 1 1 A 56 56 ASP C C 56 174.969 174.622 0.347 1
1 625 . 4 1 1 A 56 56 ASP CA C 56 53.702 52.529 1.173 1
1 626 . 4 1 1 A 56 56 ASP CB C 56 43.251 43.039 0.212 1
1 627 . 4 1 1 A 56 56 ASP N N 56 125.882 127.030 -1.148 1
1 628 . 4 1 1 A 57 57 PHE H H 57 8.955 8.927 0.028 1
1 629 . 4 1 1 A 57 57 PHE HA H 57 4.915 5.115 -0.200 1
1 637 . 4 1 1 A 57 57 PHE C C 57 177.361 175.674 1.687 1
1 638 . 4 1 1 A 57 57 PHE CA C 57 57.458 56.196 1.262 1
1 639 . 4 1 1 A 57 57 PHE CB C 57 43.737 43.740 -0.003 1
1 645 . 4 1 1 A 57 57 PHE N N 57 118.872 123.865 -4.993 1
1 646 . 4 1 1 A 58 58 GLY H H 58 9.552 9.250 0.302 1
1 647 . 4 1 1 A 58 58 GLY HA2 H 58 4.662 4.216 0.446 1
1 648 . 4 1 1 A 58 58 GLY HA3 H 58 4.126 4.280 -0.154 1
1 649 . 4 1 1 A 58 58 GLY C C 58 174.760 175.000 -0.240 1
1 650 . 4 1 1 A 58 58 GLY CA C 58 44.680 44.802 -0.122 1
1 651 . 4 1 1 A 58 58 GLY N N 58 111.551 109.331 2.220 1
1 652 . 4 1 1 A 59 59 LYS H H 59 8.211 8.679 -0.468 1
1 653 . 4 1 1 A 59 59 LYS HA H 59 3.782 3.679 0.103 1
1 662 . 4 1 1 A 59 59 LYS C C 59 176.154 178.031 -1.877 1
1 663 . 4 1 1 A 59 59 LYS CA C 59 59.080 58.817 0.263 1
1 664 . 4 1 1 A 59 59 LYS CB C 59 32.516 31.752 0.764 1
1 668 . 4 1 1 A 59 59 LYS N N 59 115.953 120.546 -4.593 1
1 669 . 4 1 1 A 60 60 ASP H H 60 8.634 8.118 0.516 1
1 670 . 4 1 1 A 60 60 ASP HA H 60 4.882 4.537 0.345 1
1 673 . 4 1 1 A 60 60 ASP C C 60 176.039 177.173 -1.134 1
1 674 . 4 1 1 A 60 60 ASP CA C 60 54.327 56.725 -2.398 1
1 675 . 4 1 1 A 60 60 ASP CB C 60 41.461 40.688 0.773 1
1 676 . 4 1 1 A 60 60 ASP N N 60 117.261 118.606 -1.345 1
1 677 . 4 1 1 A 61 61 ASP H H 61 7.500 8.388 -0.888 1
1 678 . 4 1 1 A 61 61 ASP HA H 61 4.591 4.711 -0.120 1
1 681 . 4 1 1 A 61 61 ASP C C 61 175.140 175.762 -0.622 1
1 682 . 4 1 1 A 61 61 ASP CA C 61 55.342 53.816 1.526 1
1 683 . 4 1 1 A 61 61 ASP CB C 61 42.475 39.688 2.787 1
1 684 . 4 1 1 A 61 61 ASP N N 61 122.319 118.517 3.802 1
1 685 . 4 1 1 A 62 62 GLN H H 62 8.239 7.968 0.271 1
1 686 . 4 1 1 A 62 62 GLN HA H 62 2.569 3.656 -1.087 1
1 693 . 4 1 1 A 62 62 GLN C C 62 172.652 173.934 -1.282 1
1 694 . 4 1 1 A 62 62 GLN CA C 62 54.038 55.589 -1.551 1
1 695 . 4 1 1 A 62 62 GLN CB C 62 31.481 29.244 2.237 1
1 697 . 4 1 1 A 62 62 GLN N N 62 117.458 123.265 -5.807 1
1 699 . 4 1 1 A 63 63 HIS H H 63 6.338 6.807 -0.469 1
1 700 . 4 1 1 A 63 63 HIS HA H 63 4.423 4.404 0.019 1
1 704 . 4 1 1 A 63 63 HIS C C 63 173.031 172.753 0.278 1
1 705 . 4 1 1 A 63 63 HIS CA C 63 54.743 53.651 1.092 1
1 706 . 4 1 1 A 63 63 HIS CB C 63 32.661 31.963 0.698 1
1 708 . 4 1 1 A 63 63 HIS N N 63 113.589 115.813 -2.224 1
1 709 . 4 1 1 A 64 64 PHE H H 64 8.549 9.085 -0.536 1
1 710 . 4 1 1 A 64 64 PHE HA H 64 4.578 5.056 -0.478 1
1 718 . 4 1 1 A 64 64 PHE C C 64 173.015 173.607 -0.592 1
1 719 . 4 1 1 A 64 64 PHE CA C 64 58.516 57.793 0.723 1
1 720 . 4 1 1 A 64 64 PHE CB C 64 43.525 42.990 0.535 1
1 726 . 4 1 1 A 64 64 PHE N N 64 118.214 119.621 -1.407 1
1 727 . 4 1 1 A 65 65 THR H H 65 7.150 8.111 -0.961 1
1 728 . 4 1 1 A 65 65 THR HA H 65 4.930 4.671 0.259 1
1 733 . 4 1 1 A 65 65 THR C C 65 172.457 173.700 -1.243 1
1 734 . 4 1 1 A 65 65 THR CA C 65 61.690 61.820 -0.130 1
1 735 . 4 1 1 A 65 65 THR CB C 65 69.593 69.499 0.094 1
1 737 . 4 1 1 A 65 65 THR N N 65 123.198 120.667 2.531 1
1 738 . 4 1 1 A 66 66 VAL H H 66 8.888 8.725 0.163 1
1 739 . 4 1 1 A 66 66 VAL HA H 66 4.018 4.756 -0.738 1
1 747 . 4 1 1 A 66 66 VAL C C 66 174.868 175.512 -0.644 1
1 748 . 4 1 1 A 66 66 VAL CA C 66 61.178 60.752 0.426 1
1 749 . 4 1 1 A 66 66 VAL CB C 66 33.114 33.093 0.021 1
1 752 . 4 1 1 A 66 66 VAL N N 66 126.840 128.317 -1.477 1
1 753 . 4 1 1 A 67 67 THR H H 67 8.174 8.508 -0.334 1
1 754 . 4 1 1 A 67 67 THR HA H 67 4.816 4.968 -0.152 1
1 759 . 4 1 1 A 67 67 THR C C 67 174.494 174.286 0.208 1
1 760 . 4 1 1 A 67 67 THR CA C 67 59.786 59.501 0.285 1
1 761 . 4 1 1 A 67 67 THR CB C 67 70.887 71.653 -0.766 1
1 763 . 4 1 1 A 67 67 THR N N 67 116.127 117.123 -0.996 1
1 764 . 4 1 1 A 68 68 GLY H H 68 8.570 8.330 0.240 1
1 765 . 4 1 1 A 68 68 GLY HA2 H 68 3.970 4.008 -0.038 1
1 766 . 4 1 1 A 68 68 GLY HA3 H 68 3.819 4.018 -0.199 1
1 767 . 4 1 1 A 68 68 GLY C C 68 175.636 174.727 0.909 1
1 768 . 4 1 1 A 68 68 GLY CA C 68 46.397 45.197 1.200 1
1 769 . 4 1 1 A 68 68 GLY N N 68 107.146 113.132 -5.986 1
1 770 . 4 1 1 A 69 69 LEU H H 69 8.007 7.446 0.561 1
1 771 . 4 1 1 A 69 69 LEU HA H 69 4.154 4.246 -0.092 1
1 781 . 4 1 1 A 69 69 LEU C C 69 176.830 176.315 0.515 1
1 782 . 4 1 1 A 69 69 LEU CA C 69 54.602 54.785 -0.183 1
1 783 . 4 1 1 A 69 69 LEU CB C 69 41.149 41.986 -0.837 1
1 787 . 4 1 1 A 69 69 LEU N N 69 118.433 122.602 -4.169 1
1 788 . 4 1 1 A 70 70 HIS H H 70 8.866 8.458 0.408 1
1 789 . 4 1 1 A 70 70 HIS HA H 70 4.663 4.546 0.117 1
1 793 . 4 1 1 A 70 70 HIS C C 70 176.667 175.783 0.884 1
1 794 . 4 1 1 A 70 70 HIS CA C 70 55.464 57.521 -2.057 1
1 795 . 4 1 1 A 70 70 HIS CB C 70 32.125 30.249 1.876 1
1 797 . 4 1 1 A 70 70 HIS N N 70 122.457 122.631 -0.174 1
1 798 . 4 1 1 A 71 71 LYS H H 71 8.716 8.622 0.094 1
1 799 . 4 1 1 A 71 71 LYS HA H 71 4.320 4.478 -0.158 1
1 808 . 4 1 1 A 71 71 LYS C C 71 178.110 176.748 1.362 1
1 809 . 4 1 1 A 71 71 LYS CA C 71 57.035 56.337 0.698 1
1 810 . 4 1 1 A 71 71 LYS CB C 71 33.580 32.970 0.610 1
1 814 . 4 1 1 A 71 71 LYS N N 71 123.173 123.095 0.078 1
1 815 . 4 1 1 A 72 72 GLY H H 72 7.709 8.715 -1.006 1
1 816 . 4 1 1 A 72 72 GLY HA2 H 72 3.800 3.917 -0.117 1
1 817 . 4 1 1 A 72 72 GLY HA3 H 72 3.769 3.925 -0.156 1
1 818 . 4 1 1 A 72 72 GLY C C 72 174.231 174.054 0.177 1
1 819 . 4 1 1 A 72 72 GLY CA C 72 47.866 46.428 1.438 1
1 820 . 4 1 1 A 72 72 GLY N N 72 114.881 110.874 4.007 1
1 821 . 4 1 1 A 73 73 THR H H 73 8.162 7.548 0.614 1
1 822 . 4 1 1 A 73 73 THR HA H 73 4.584 4.642 -0.058 1
1 827 . 4 1 1 A 73 73 THR C C 73 172.208 173.456 -1.248 1
1 828 . 4 1 1 A 73 73 THR CA C 73 62.307 61.265 1.042 1
1 829 . 4 1 1 A 73 73 THR CB C 73 72.123 71.643 0.480 1
1 831 . 4 1 1 A 73 73 THR N N 73 114.225 114.596 -0.371 1
1 832 . 4 1 1 A 74 74 THR H H 74 8.743 8.742 0.001 1
1 833 . 4 1 1 A 74 74 THR HA H 74 5.138 4.954 0.184 1
1 838 . 4 1 1 A 74 74 THR C C 74 173.376 173.566 -0.190 1
1 839 . 4 1 1 A 74 74 THR CA C 74 62.724 63.012 -0.288 1
1 840 . 4 1 1 A 74 74 THR CB C 74 69.202 69.517 -0.315 1
1 842 . 4 1 1 A 74 74 THR N N 74 123.376 121.015 2.361 1
1 843 . 4 1 1 A 75 75 TYR H H 75 9.549 9.346 0.203 1
1 844 . 4 1 1 A 75 75 TYR HA H 75 4.892 5.189 -0.297 1
1 851 . 4 1 1 A 75 75 TYR C C 75 173.991 175.346 -1.355 1
1 852 . 4 1 1 A 75 75 TYR CA C 75 57.740 56.107 1.633 1
1 853 . 4 1 1 A 75 75 TYR CB C 75 44.580 42.999 1.581 1
1 858 . 4 1 1 A 75 75 TYR N N 75 126.916 124.907 2.009 1
1 859 . 4 1 1 A 76 76 ILE H H 76 8.769 8.916 -0.147 1
1 860 . 4 1 1 A 76 76 ILE HA H 76 4.663 4.845 -0.182 1
1 870 . 4 1 1 A 76 76 ILE C C 76 174.683 175.180 -0.497 1
1 871 . 4 1 1 A 76 76 ILE CA C 76 60.455 60.722 -0.267 1
1 872 . 4 1 1 A 76 76 ILE CB C 76 40.284 40.100 0.184 1
1 876 . 4 1 1 A 76 76 ILE N N 76 119.407 120.727 -1.320 1
1 877 . 4 1 1 A 77 77 PHE H H 77 8.894 8.961 -0.067 1
1 878 . 4 1 1 A 77 77 PHE HA H 77 5.160 5.102 0.058 1
1 886 . 4 1 1 A 77 77 PHE C C 77 174.794 175.371 -0.577 1
1 887 . 4 1 1 A 77 77 PHE CA C 77 56.831 57.479 -0.648 1
1 888 . 4 1 1 A 77 77 PHE CB C 77 43.132 41.240 1.892 1
1 894 . 4 1 1 A 77 77 PHE N N 77 124.622 127.166 -2.544 1
1 895 . 4 1 1 A 78 78 ARG H H 78 9.407 9.237 0.170 1
1 896 . 4 1 1 A 78 78 ARG HA H 78 5.689 5.617 0.072 1
1 904 . 4 1 1 A 78 78 ARG C C 78 174.376 174.288 0.088 1
1 905 . 4 1 1 A 78 78 ARG CA C 78 54.530 54.602 -0.072 1
1 906 . 4 1 1 A 78 78 ARG CB C 78 34.473 33.704 0.769 1
1 909 . 4 1 1 A 78 78 ARG N N 78 120.055 120.923 -0.868 1
1 911 . 4 1 1 A 79 79 LEU H H 79 9.132 8.809 0.323 1
1 912 . 4 1 1 A 79 79 LEU HA H 79 5.398 5.223 0.175 1
1 922 . 4 1 1 A 79 79 LEU C C 79 174.006 174.378 -0.372 1
1 923 . 4 1 1 A 79 79 LEU CA C 79 53.401 53.221 0.180 1
1 924 . 4 1 1 A 79 79 LEU CB C 79 48.116 46.518 1.598 1
1 928 . 4 1 1 A 79 79 LEU N N 79 124.907 126.437 -1.530 1
1 929 . 4 1 1 A 80 80 ALA H H 80 8.737 8.107 0.630 1
1 930 . 4 1 1 A 80 80 ALA HA H 80 4.871 5.002 -0.131 1
1 934 . 4 1 1 A 80 80 ALA C C 80 176.057 175.729 0.328 1
1 935 . 4 1 1 A 80 80 ALA CA C 80 50.353 51.232 -0.879 1
1 936 . 4 1 1 A 80 80 ALA CB C 80 23.972 23.490 0.482 1
1 937 . 4 1 1 A 80 80 ALA N N 80 128.220 125.700 2.520 1
1 938 . 4 1 1 A 81 81 ALA H H 81 9.890 8.573 1.317 1
1 939 . 4 1 1 A 81 81 ALA HA H 81 4.794 5.058 -0.264 1
1 943 . 4 1 1 A 81 81 ALA C C 81 174.655 176.138 -1.483 1
1 944 . 4 1 1 A 81 81 ALA CA C 81 50.300 51.072 -0.772 1
1 945 . 4 1 1 A 81 81 ALA CB C 81 21.369 20.697 0.672 1
1 946 . 4 1 1 A 81 81 ALA N N 81 123.682 123.305 0.377 1
1 947 . 4 1 1 A 82 82 LYS H H 82 7.965 8.672 -0.707 1
1 948 . 4 1 1 A 82 82 LYS HA H 82 4.974 5.301 -0.327 1
1 957 . 4 1 1 A 82 82 LYS C C 82 175.671 175.140 0.531 1
1 958 . 4 1 1 A 82 82 LYS CA C 82 54.664 54.798 -0.134 1
1 959 . 4 1 1 A 82 82 LYS CB C 82 36.677 35.382 1.295 1
1 963 . 4 1 1 A 82 82 LYS N N 82 118.164 122.300 -4.136 1
1 964 . 4 1 1 A 83 83 ASN H H 83 8.663 8.865 -0.202 1
1 965 . 4 1 1 A 83 83 ASN HA H 83 5.113 5.062 0.051 1
1 970 . 4 1 1 A 83 83 ASN C C 83 176.582 176.441 0.141 1
1 971 . 4 1 1 A 83 83 ASN CA C 83 51.746 50.737 1.009 1
1 972 . 4 1 1 A 83 83 ASN CB C 83 40.357 40.170 0.187 1
1 973 . 4 1 1 A 83 83 ASN N N 83 124.784 124.114 0.670 1
1 975 . 4 1 1 A 84 84 ARG H H 84 8.873 8.835 0.038 1
1 976 . 4 1 1 A 84 84 ARG HA H 84 3.940 3.912 0.028 1
1 983 . 4 1 1 A 84 84 ARG C C 84 176.735 178.020 -1.285 1
1 984 . 4 1 1 A 84 84 ARG CA C 84 59.327 59.962 -0.635 1
1 985 . 4 1 1 A 84 84 ARG CB C 84 29.282 29.996 -0.714 1
1 988 . 4 1 1 A 84 84 ARG N N 84 117.891 119.279 -1.388 1
1 989 . 4 1 1 A 85 85 ALA H H 85 7.645 7.794 -0.149 1
1 990 . 4 1 1 A 85 85 ALA HA H 85 4.276 4.176 0.100 1
1 994 . 4 1 1 A 85 85 ALA C C 85 177.479 177.364 0.115 1
1 995 . 4 1 1 A 85 85 ALA CA C 85 52.818 52.819 -0.001 1
1 996 . 4 1 1 A 85 85 ALA CB C 85 18.806 19.539 -0.733 1
1 997 . 4 1 1 A 85 85 ALA N N 85 120.306 120.238 0.068 1
1 998 . 4 1 1 A 86 86 GLY H H 86 7.693 7.767 -0.074 1
1 999 . 4 1 1 A 86 86 GLY HA2 H 86 4.456 4.068 0.388 1
1 1000 . 4 1 1 A 86 86 GLY HA3 H 86 3.649 4.070 -0.421 1
1 1001 . 4 1 1 A 86 86 GLY C C 86 172.068 172.496 -0.428 1
1 1002 . 4 1 1 A 86 86 GLY CA C 86 44.375 43.862 0.513 1
1 1003 . 4 1 1 A 86 86 GLY N N 86 106.594 104.352 2.242 1
1 1004 . 4 1 1 A 87 87 LEU H H 87 8.203 8.334 -0.131 1
1 1005 . 4 1 1 A 87 87 LEU HA H 87 4.629 4.781 -0.152 1
1 1015 . 4 1 1 A 87 87 LEU C C 87 179.155 176.419 2.736 1
1 1016 . 4 1 1 A 87 87 LEU CA C 87 54.814 54.702 0.112 1
1 1017 . 4 1 1 A 87 87 LEU CB C 87 43.454 42.291 1.163 1
1 1021 . 4 1 1 A 87 87 LEU N N 87 120.879 121.870 -0.991 1
1 1022 . 4 1 1 A 88 88 GLY H H 88 8.492 8.299 0.193 1
1 1023 . 4 1 1 A 88 88 GLY HA2 H 88 4.339 4.182 0.157 1
1 1024 . 4 1 1 A 88 88 GLY HA3 H 88 4.122 4.189 -0.067 1
1 1025 . 4 1 1 A 88 88 GLY C C 88 173.030 173.452 -0.422 1
1 1026 . 4 1 1 A 88 88 GLY CA C 88 43.970 44.608 -0.638 1
1 1027 . 4 1 1 A 88 88 GLY N N 88 109.903 109.767 0.136 1
1 1028 . 4 1 1 A 89 89 GLU H H 89 7.638 8.868 -1.230 1
1 1029 . 4 1 1 A 89 89 GLU HA H 89 4.103 4.298 -0.195 1
1 1034 . 4 1 1 A 89 89 GLU C C 89 177.511 175.766 1.745 1
1 1035 . 4 1 1 A 89 89 GLU CA C 89 56.659 56.849 -0.190 1
1 1036 . 4 1 1 A 89 89 GLU CB C 89 31.324 30.830 0.494 1
1 1038 . 4 1 1 A 89 89 GLU N N 89 117.551 121.631 -4.080 1
1 1039 . 4 1 1 A 90 90 GLU H H 90 8.734 9.035 -0.301 1
1 1040 . 4 1 1 A 90 90 GLU HA H 90 4.651 5.491 -0.840 1
1 1045 . 4 1 1 A 90 90 GLU C C 90 177.452 174.329 3.123 1
1 1046 . 4 1 1 A 90 90 GLU CA C 90 55.987 54.615 1.372 1
1 1047 . 4 1 1 A 90 90 GLU CB C 90 31.135 33.314 -2.179 1
1 1049 . 4 1 1 A 90 90 GLU N N 90 121.553 117.890 3.663 1
1 1050 . 4 1 1 A 91 91 PHE H H 91 9.411 9.001 0.410 1
1 1051 . 4 1 1 A 91 91 PHE HA H 91 4.665 5.023 -0.358 1
1 1059 . 4 1 1 A 91 91 PHE C C 91 173.944 174.208 -0.264 1
1 1060 . 4 1 1 A 91 91 PHE CA C 91 57.687 57.748 -0.061 1
1 1061 . 4 1 1 A 91 91 PHE CB C 91 40.890 41.527 -0.637 1
1 1067 . 4 1 1 A 91 91 PHE N N 91 125.459 124.967 0.492 1
1 1068 . 4 1 1 A 92 92 GLU H H 92 8.043 8.369 -0.326 1
1 1069 . 4 1 1 A 92 92 GLU HA H 92 5.424 5.266 0.158 1
1 1074 . 4 1 1 A 92 92 GLU C C 92 174.295 174.793 -0.498 1
1 1075 . 4 1 1 A 92 92 GLU CA C 92 54.378 54.683 -0.305 1
1 1076 . 4 1 1 A 92 92 GLU CB C 92 33.662 33.356 0.306 1
1 1078 . 4 1 1 A 92 92 GLU N N 92 128.905 127.717 1.188 1
1 1079 . 4 1 1 A 93 93 LYS H H 93 9.142 8.441 0.701 1
1 1080 . 4 1 1 A 93 93 LYS HA H 93 4.541 5.087 -0.546 1
1 1089 . 4 1 1 A 93 93 LYS C C 93 173.366 173.934 -0.568 1
1 1090 . 4 1 1 A 93 93 LYS CA C 93 55.343 55.733 -0.390 1
1 1091 . 4 1 1 A 93 93 LYS CB C 93 37.317 36.227 1.090 1
1 1095 . 4 1 1 A 93 93 LYS N N 93 125.231 126.529 -1.298 1
1 1096 . 4 1 1 A 94 94 GLU H H 94 8.655 9.229 -0.574 1
1 1097 . 4 1 1 A 94 94 GLU HA H 94 5.558 5.407 0.151 1
1 1102 . 4 1 1 A 94 94 GLU C C 94 176.238 175.666 0.572 1
1 1103 . 4 1 1 A 94 94 GLU CA C 94 54.632 55.225 -0.593 1
1 1104 . 4 1 1 A 94 94 GLU CB C 94 32.166 32.995 -0.829 1
1 1106 . 4 1 1 A 94 94 GLU N N 94 127.232 128.137 -0.905 1
1 1107 . 4 1 1 A 95 95 ILE H H 95 9.302 8.853 0.449 1
1 1108 . 4 1 1 A 95 95 ILE HA H 95 4.794 5.251 -0.457 1
1 1118 . 4 1 1 A 95 95 ILE C C 95 173.138 174.396 -1.258 1
1 1119 . 4 1 1 A 95 95 ILE CA C 95 58.570 58.327 0.243 1
1 1120 . 4 1 1 A 95 95 ILE CB C 95 42.420 42.834 -0.414 1
1 1124 . 4 1 1 A 95 95 ILE N N 95 120.711 121.163 -0.452 1
1 1125 . 4 1 1 A 96 96 ARG H H 96 8.589 8.738 -0.149 1
1 1126 . 4 1 1 A 96 96 ARG HA H 96 5.373 4.774 0.599 1
1 1133 . 4 1 1 A 96 96 ARG C C 96 177.147 174.882 2.265 1
1 1134 . 4 1 1 A 96 96 ARG CA C 96 54.045 55.352 -1.307 1
1 1135 . 4 1 1 A 96 96 ARG CB C 96 32.001 33.656 -1.655 1
1 1138 . 4 1 1 A 96 96 ARG N N 96 124.445 121.606 2.839 1
1 1139 . 4 1 1 A 97 97 THR H H 97 9.243 8.437 0.806 1
1 1140 . 4 1 1 A 97 97 THR HA H 97 4.459 4.604 -0.145 1
1 1145 . 4 1 1 A 97 97 THR C C 97 172.745 173.961 -1.216 1
1 1146 . 4 1 1 A 97 97 THR CA C 97 59.637 60.847 -1.210 1
1 1147 . 4 1 1 A 97 97 THR CB C 97 67.687 68.741 -1.054 1
1 1149 . 4 1 1 A 97 97 THR N N 97 119.370 117.891 1.479 1
1 1150 . 4 1 1 A 98 98 PRO HA H 98 4.494 4.772 -0.278 1
1 1157 . 4 1 1 A 98 98 PRO CA C 98 63.117 62.581 0.536 1
1 1158 . 4 1 1 A 98 98 PRO CB C 98 32.500 31.723 0.777 1
1 1161 . 4 1 1 A 99 99 GLU H H 99 8.534 8.619 -0.085 1
1 1162 . 4 1 1 A 99 99 GLU HA H 99 4.195 4.470 -0.275 1
1 1167 . 4 1 1 A 99 99 GLU C C 99 175.881 177.015 -1.134 1
1 1168 . 4 1 1 A 99 99 GLU CA C 99 56.330 56.280 0.050 1
1 1169 . 4 1 1 A 99 99 GLU CB C 99 31.062 30.765 0.297 1
1 1171 . 4 1 1 A 99 99 GLU N N 99 119.688 119.788 -0.100 1
1 1172 . 4 1 1 A 100 100 ASP H H 100 8.536 9.211 -0.675 1
1 1173 . 4 1 1 A 100 100 ASP HA H 100 4.607 4.326 0.281 1
1 1176 . 4 1 1 A 100 100 ASP C C 100 176.012 177.907 -1.895 1
1 1177 . 4 1 1 A 100 100 ASP CA C 100 54.109 57.204 -3.095 1
1 1178 . 4 1 1 A 100 100 ASP CB C 100 41.562 40.051 1.511 1
1 1179 . 4 1 1 A 100 100 ASP N N 100 119.803 123.273 -3.470 1
1 1180 . 4 1 1 A 101 101 LEU H H 101 8.403 8.012 0.391 1
1 1181 . 4 1 1 A 101 101 LEU HA H 101 4.426 3.972 0.454 1
1 1191 . 4 1 1 A 101 101 LEU C C 101 177.534 177.438 0.096 1
1 1192 . 4 1 1 A 101 101 LEU CA C 101 55.113 58.628 -3.515 1
1 1193 . 4 1 1 A 101 101 LEU CB C 101 42.156 42.087 0.069 1
1 1197 . 4 1 1 A 101 101 LEU N N 101 123.876 121.752 2.124 1
1 1198 . 4 1 1 A 102 102 SER H H 102 8.413 7.762 0.651 1
1 1199 . 4 1 1 A 102 102 SER HA H 102 4.434 4.407 0.027 1
1 1202 . 4 1 1 A 102 102 SER C C 102 174.674 173.995 0.679 1
1 1203 . 4 1 1 A 102 102 SER CA C 102 58.798 58.904 -0.106 1
1 1204 . 4 1 1 A 102 102 SER CB C 102 63.854 63.603 0.251 1
1 1205 . 4 1 1 A 102 102 SER N N 102 116.667 115.129 1.538 1
1 1206 . 4 1 1 A 103 103 GLY H H 103 8.213 8.515 -0.302 1
1 1207 . 4 1 1 A 103 103 GLY HA2 H 103 4.164 4.104 0.060 1
1 1208 . 4 1 1 A 103 103 GLY HA3 H 103 4.057 4.104 -0.047 1
1 1209 . 4 1 1 A 103 103 GLY C C 103 171.822 172.675 -0.853 1
1 1210 . 4 1 1 A 103 103 GLY CA C 103 44.658 44.287 0.371 1
1 1211 . 4 1 1 A 103 103 GLY N N 103 110.592 113.071 -2.479 1
1 1212 . 4 1 1 A 104 104 PRO HA H 104 4.475 4.596 -0.121 1
1 1219 . 4 1 1 A 104 104 PRO C C 104 177.445 177.867 -0.422 1
1 1220 . 4 1 1 A 104 104 PRO CA C 104 63.312 62.802 0.510 1
1 1221 . 4 1 1 A 104 104 PRO CB C 104 32.190 31.800 0.390 1
1 1224 . 4 1 1 A 105 105 SER H H 105 8.538 8.921 -0.383 1
1 1225 . 4 1 1 A 105 105 SER HA H 105 4.541 4.197 0.344 1
1 1228 . 4 1 1 A 105 105 SER C C 105 174.616 175.040 -0.424 1
1 1229 . 4 1 1 A 105 105 SER CA C 105 58.270 61.273 -3.003 1
1 1230 . 4 1 1 A 105 105 SER CB C 105 63.895 62.972 0.923 1
1 1231 . 4 1 1 A 105 105 SER N N 105 116.446 120.748 -4.302 1
1 1232 . 4 1 1 A 106 106 SER H H 106 8.350 7.736 0.614 1
1 1233 . 4 1 1 A 106 106 SER HA H 106 4.541 4.334 0.207 1
1 1236 . 4 1 1 A 106 106 SER C C 106 174.530 175.753 -1.223 1
1 1237 . 4 1 1 A 106 106 SER CA C 106 58.357 58.042 0.315 1
1 1238 . 4 1 1 A 106 106 SER CB C 106 64.020 63.684 0.336 1
1 1239 . 4 1 1 A 106 106 SER N N 106 117.448 116.184 1.264 1
1 1 . 5 1 1 A 2 2 SER C C 2 174.723 174.363 0.360 1
1 2 . 5 1 1 A 2 2 SER CA C 2 58.446 62.043 -3.597 1
1 3 . 5 1 1 A 2 2 SER CB C 2 63.566 63.257 0.309 1
1 4 . 5 1 1 A 3 3 SER H H 3 8.350 8.220 0.130 1
1 5 . 5 1 1 A 3 3 SER C C 3 173.961 173.650 0.311 1
1 6 . 5 1 1 A 3 3 SER CA C 3 58.428 57.114 1.314 1
1 7 . 5 1 1 A 3 3 SER CB C 3 63.937 64.838 -0.901 1
1 8 . 5 1 1 A 3 3 SER N N 3 117.923 115.269 2.654 1
1 9 . 5 1 1 A 4 4 GLY H H 4 8.050 8.385 -0.335 1
1 10 . 5 1 1 A 4 4 GLY C C 4 179.009 172.104 6.905 1
1 11 . 5 1 1 A 4 4 GLY CA C 4 46.174 43.998 2.176 1
1 12 . 5 1 1 A 4 4 GLY N N 4 116.890 114.219 2.671 1
1 13 . 5 1 1 A 7 7 GLY HA2 H 7 4.340 4.158 0.182 1
1 14 . 5 1 1 A 7 7 GLY HA3 H 7 3.629 4.159 -0.530 1
1 15 . 5 1 1 A 7 7 GLY CA C 7 44.381 44.162 0.219 1
1 16 . 5 1 1 A 8 8 PRO HA H 8 4.476 4.539 -0.063 1
1 23 . 5 1 1 A 8 8 PRO C C 8 176.235 177.329 -1.094 1
1 24 . 5 1 1 A 8 8 PRO CA C 8 62.995 62.593 0.402 1
1 25 . 5 1 1 A 8 8 PRO CB C 8 33.266 32.919 0.347 1
1 28 . 5 1 1 A 9 9 GLY H H 9 8.585 8.388 0.197 1
1 29 . 5 1 1 A 9 9 GLY HA2 H 9 4.326 4.123 0.203 1
1 30 . 5 1 1 A 9 9 GLY HA3 H 9 4.009 4.128 -0.119 1
1 31 . 5 1 1 A 9 9 GLY C C 9 172.998 173.094 -0.096 1
1 32 . 5 1 1 A 9 9 GLY CA C 9 44.393 44.159 0.234 1
1 33 . 5 1 1 A 9 9 GLY N N 9 106.004 107.711 -1.707 1
1 34 . 5 1 1 A 10 10 ARG H H 10 8.548 8.424 0.124 1
1 35 . 5 1 1 A 10 10 ARG HA H 10 4.654 4.913 -0.259 1
1 41 . 5 1 1 A 10 10 ARG C C 10 175.780 174.820 0.960 1
1 42 . 5 1 1 A 10 10 ARG CA C 10 54.708 54.545 0.163 1
1 43 . 5 1 1 A 10 10 ARG CB C 10 31.448 31.296 0.152 1
1 45 . 5 1 1 A 10 10 ARG N N 10 119.407 118.463 0.944 1
1 46 . 5 1 1 A 11 11 PRO HA H 11 4.611 4.575 0.036 1
1 53 . 5 1 1 A 11 11 PRO C C 11 173.510 175.393 -1.883 1
1 54 . 5 1 1 A 11 11 PRO CA C 11 62.360 62.621 -0.261 1
1 55 . 5 1 1 A 11 11 PRO CB C 11 33.402 32.255 1.147 1
1 58 . 5 1 1 A 12 12 THR H H 12 7.572 8.459 -0.887 1
1 59 . 5 1 1 A 12 12 THR HA H 12 3.796 4.248 -0.452 1
1 64 . 5 1 1 A 12 12 THR C C 12 172.337 173.272 -0.935 1
1 65 . 5 1 1 A 12 12 THR CA C 12 61.778 61.367 0.411 1
1 66 . 5 1 1 A 12 12 THR CB C 12 70.561 68.595 1.966 1
1 68 . 5 1 1 A 12 12 THR N N 12 109.653 117.029 -7.376 1
1 69 . 5 1 1 A 13 13 MET H H 13 5.605 8.565 -2.960 1
1 70 . 5 1 1 A 13 13 MET HA H 13 5.091 4.987 0.104 1
1 78 . 5 1 1 A 13 13 MET C C 13 172.639 175.070 -2.431 1
1 79 . 5 1 1 A 13 13 MET CA C 13 54.168 53.701 0.467 1
1 80 . 5 1 1 A 13 13 MET CB C 13 37.632 34.657 2.975 1
1 83 . 5 1 1 A 13 13 MET N N 13 121.634 126.913 -5.279 1
1 84 . 5 1 1 A 14 14 MET H H 14 9.254 9.194 0.060 1
1 85 . 5 1 1 A 14 14 MET HA H 14 4.662 5.227 -0.565 1
1 93 . 5 1 1 A 14 14 MET C C 14 174.388 174.833 -0.445 1
1 94 . 5 1 1 A 14 14 MET CA C 14 54.673 54.481 0.192 1
1 95 . 5 1 1 A 14 14 MET CB C 14 34.907 35.114 -0.207 1
1 98 . 5 1 1 A 14 14 MET N N 14 125.746 123.881 1.865 1
1 99 . 5 1 1 A 15 15 ILE H H 15 8.555 9.206 -0.651 1
1 100 . 5 1 1 A 15 15 ILE HA H 15 4.882 5.028 -0.146 1
1 110 . 5 1 1 A 15 15 ILE C C 15 174.962 175.023 -0.061 1
1 111 . 5 1 1 A 15 15 ILE CA C 15 60.685 60.720 -0.035 1
1 112 . 5 1 1 A 15 15 ILE CB C 15 40.878 38.979 1.899 1
1 116 . 5 1 1 A 15 15 ILE N N 15 121.623 126.213 -4.590 1
1 117 . 5 1 1 A 16 16 SER H H 16 8.703 8.780 -0.077 1
1 118 . 5 1 1 A 16 16 SER HA H 16 4.922 5.042 -0.120 1
1 121 . 5 1 1 A 16 16 SER C C 16 173.860 173.313 0.547 1
1 122 . 5 1 1 A 16 16 SER CA C 16 56.524 57.317 -0.793 1
1 123 . 5 1 1 A 16 16 SER CB C 16 65.004 65.760 -0.756 1
1 124 . 5 1 1 A 16 16 SER N N 16 122.261 124.891 -2.630 1
1 125 . 5 1 1 A 17 17 THR H H 17 8.759 8.610 0.149 1
1 126 . 5 1 1 A 17 17 THR HA H 17 4.885 4.750 0.135 1
1 131 . 5 1 1 A 17 17 THR C C 17 175.018 174.513 0.505 1
1 132 . 5 1 1 A 17 17 THR CA C 17 60.315 60.997 -0.682 1
1 133 . 5 1 1 A 17 17 THR CB C 17 69.799 70.124 -0.325 1
1 135 . 5 1 1 A 17 17 THR N N 17 115.660 116.833 -1.173 1
1 136 . 5 1 1 A 18 18 THR H H 18 8.038 8.308 -0.270 1
1 137 . 5 1 1 A 18 18 THR HA H 18 4.596 4.477 0.119 1
1 142 . 5 1 1 A 18 18 THR CA C 18 60.707 62.241 -1.534 1
1 143 . 5 1 1 A 18 18 THR CB C 18 71.082 69.914 1.168 1
1 145 . 5 1 1 A 18 18 THR N N 18 112.362 114.712 -2.350 1
1 146 . 5 1 1 A 19 19 ALA H H 19 8.545 7.685 0.860 1
1 147 . 5 1 1 A 19 19 ALA HA H 19 4.412 4.428 -0.016 1
1 151 . 5 1 1 A 19 19 ALA C C 19 177.034 177.493 -0.459 1
1 152 . 5 1 1 A 19 19 ALA CA C 19 52.264 51.367 0.897 1
1 153 . 5 1 1 A 19 19 ALA CB C 19 19.292 21.258 -1.966 1
1 154 . 5 1 1 A 19 19 ALA N N 19 119.589 123.704 -4.115 1
1 155 . 5 1 1 A 20 20 MET H H 20 8.145 8.602 -0.457 1
1 156 . 5 1 1 A 20 20 MET HA H 20 4.447 4.095 0.352 1
1 164 . 5 1 1 A 20 20 MET C C 20 175.676 176.612 -0.936 1
1 165 . 5 1 1 A 20 20 MET CA C 20 55.764 55.327 0.437 1
1 166 . 5 1 1 A 20 20 MET CB C 20 31.495 31.943 -0.448 1
1 169 . 5 1 1 A 20 20 MET N N 20 116.950 119.521 -2.571 1
1 170 . 5 1 1 A 21 21 ASN H H 21 8.275 9.010 -0.735 1
1 171 . 5 1 1 A 21 21 ASN HA H 21 4.452 4.367 0.085 1
1 176 . 5 1 1 A 21 21 ASN C C 21 174.100 173.778 0.322 1
1 177 . 5 1 1 A 21 21 ASN CA C 21 54.320 54.532 -0.212 1
1 178 . 5 1 1 A 21 21 ASN CB C 21 37.234 37.209 0.025 1
1 179 . 5 1 1 A 21 21 ASN N N 21 113.198 118.772 -5.574 1
1 181 . 5 1 1 A 22 22 THR H H 22 7.071 7.079 -0.008 1
1 182 . 5 1 1 A 22 22 THR HA H 22 5.218 5.352 -0.134 1
1 187 . 5 1 1 A 22 22 THR C C 22 173.301 173.047 0.254 1
1 188 . 5 1 1 A 22 22 THR CA C 22 59.399 60.483 -1.084 1
1 189 . 5 1 1 A 22 22 THR CB C 22 72.714 71.676 1.038 1
1 191 . 5 1 1 A 22 22 THR N N 22 107.603 107.872 -0.269 1
1 192 . 5 1 1 A 23 23 ALA H H 23 8.687 8.830 -0.143 1
1 193 . 5 1 1 A 23 23 ALA HA H 23 4.925 5.094 -0.169 1
1 197 . 5 1 1 A 23 23 ALA C C 23 174.100 175.723 -1.623 1
1 198 . 5 1 1 A 23 23 ALA CA C 23 50.812 50.120 0.692 1
1 199 . 5 1 1 A 23 23 ALA CB C 23 21.122 21.305 -0.183 1
1 200 . 5 1 1 A 23 23 ALA N N 23 121.937 126.429 -4.492 1
1 201 . 5 1 1 A 24 24 LEU H H 24 8.833 8.818 0.015 1
1 202 . 5 1 1 A 24 24 LEU HA H 24 4.673 4.477 0.196 1
1 212 . 5 1 1 A 24 24 LEU C C 24 175.140 174.957 0.183 1
1 213 . 5 1 1 A 24 24 LEU CA C 24 54.320 55.230 -0.910 1
1 214 . 5 1 1 A 24 24 LEU CB C 24 42.518 42.990 -0.472 1
1 218 . 5 1 1 A 24 24 LEU N N 24 123.721 126.303 -2.582 1
1 219 . 5 1 1 A 25 25 LEU H H 25 9.176 8.965 0.211 1
1 220 . 5 1 1 A 25 25 LEU HA H 25 5.112 5.065 0.047 1
1 230 . 5 1 1 A 25 25 LEU C C 25 176.414 175.810 0.604 1
1 231 . 5 1 1 A 25 25 LEU CA C 25 54.108 53.153 0.955 1
1 232 . 5 1 1 A 25 25 LEU CB C 25 43.230 43.604 -0.374 1
1 236 . 5 1 1 A 25 25 LEU N N 25 128.589 127.791 0.798 1
1 237 . 5 1 1 A 26 26 GLN H H 26 8.556 8.561 -0.005 1
1 238 . 5 1 1 A 26 26 GLN HA H 26 4.737 4.890 -0.153 1
1 245 . 5 1 1 A 26 26 GLN C C 26 174.372 174.346 0.026 1
1 246 . 5 1 1 A 26 26 GLN CA C 26 56.365 54.391 1.974 1
1 247 . 5 1 1 A 26 26 GLN CB C 26 33.320 31.884 1.436 1
1 249 . 5 1 1 A 26 26 GLN N N 26 119.630 122.939 -3.309 1
1 251 . 5 1 1 A 27 27 TRP H H 27 8.080 8.053 0.027 1
1 252 . 5 1 1 A 27 27 TRP HA H 27 5.441 5.961 -0.520 1
1 261 . 5 1 1 A 27 27 TRP CA C 27 55.957 54.710 1.247 1
1 262 . 5 1 1 A 27 27 TRP CB C 27 32.517 32.379 0.138 1
1 268 . 5 1 1 A 27 27 TRP N N 27 121.276 121.598 -0.322 1
1 270 . 5 1 1 A 28 28 HIS H H 28 8.262 8.686 -0.424 1
1 271 . 5 1 1 A 28 28 HIS HA H 28 4.997 4.997 0.000 1
1 275 . 5 1 1 A 28 28 HIS CA C 28 53.028 53.934 -0.906 1
1 276 . 5 1 1 A 28 28 HIS CB C 28 32.832 32.563 0.269 1
1 278 . 5 1 1 A 28 28 HIS N N 28 116.245 118.025 -1.780 1
1 279 . 5 1 1 A 29 29 PRO HA H 29 4.984 4.659 0.325 1
1 286 . 5 1 1 A 29 29 PRO CA C 29 61.498 62.159 -0.661 1
1 287 . 5 1 1 A 29 29 PRO CB C 29 30.709 32.466 -1.757 1
1 290 . 5 1 1 A 30 30 PRO HA H 30 4.449 4.664 -0.215 1
1 297 . 5 1 1 A 30 30 PRO C C 30 175.733 176.679 -0.946 1
1 298 . 5 1 1 A 30 30 PRO CA C 30 62.245 62.711 -0.466 1
1 299 . 5 1 1 A 30 30 PRO CB C 30 32.083 32.740 -0.657 1
1 302 . 5 1 1 A 31 31 LYS H H 31 8.403 8.833 -0.430 1
1 303 . 5 1 1 A 31 31 LYS HA H 31 4.084 4.396 -0.312 1
1 312 . 5 1 1 A 31 31 LYS C C 31 177.166 178.354 -1.188 1
1 313 . 5 1 1 A 31 31 LYS CA C 31 57.866 58.221 -0.355 1
1 314 . 5 1 1 A 31 31 LYS CB C 31 32.698 33.089 -0.391 1
1 318 . 5 1 1 A 31 31 LYS N N 31 121.693 122.917 -1.224 1
1 319 . 5 1 1 A 32 32 GLU H H 32 8.102 7.797 0.305 1
1 320 . 5 1 1 A 32 32 GLU HA H 32 4.365 4.420 -0.055 1
1 325 . 5 1 1 A 32 32 GLU C C 32 174.248 176.337 -2.089 1
1 326 . 5 1 1 A 32 32 GLU CA C 32 55.448 56.197 -0.749 1
1 327 . 5 1 1 A 32 32 GLU CB C 32 29.405 30.291 -0.886 1
1 329 . 5 1 1 A 32 32 GLU N N 32 118.742 117.069 1.673 1
1 330 . 5 1 1 A 33 33 LEU H H 33 8.420 7.513 0.907 1
1 331 . 5 1 1 A 33 33 LEU HA H 33 4.499 4.656 -0.157 1
1 341 . 5 1 1 A 33 33 LEU C C 33 173.036 175.042 -2.006 1
1 342 . 5 1 1 A 33 33 LEU CA C 33 52.863 52.426 0.437 1
1 343 . 5 1 1 A 33 33 LEU CB C 33 42.535 42.968 -0.433 1
1 347 . 5 1 1 A 33 33 LEU N N 33 125.181 123.738 1.443 1
1 348 . 5 1 1 A 34 34 PRO HA H 34 4.488 4.482 0.006 1
1 355 . 5 1 1 A 34 34 PRO C C 34 177.544 176.680 0.864 1
1 356 . 5 1 1 A 34 34 PRO CA C 34 62.889 63.209 -0.320 1
1 357 . 5 1 1 A 34 34 PRO CB C 34 31.472 30.892 0.580 1
1 360 . 5 1 1 A 35 35 GLY H H 35 8.397 8.402 -0.005 1
1 361 . 5 1 1 A 35 35 GLY HA2 H 35 4.059 4.126 -0.067 1
1 362 . 5 1 1 A 35 35 GLY HA3 H 35 3.716 4.127 -0.411 1
1 363 . 5 1 1 A 35 35 GLY C C 35 173.356 171.624 1.732 1
1 364 . 5 1 1 A 35 35 GLY CA C 35 45.892 44.812 1.080 1
1 365 . 5 1 1 A 35 35 GLY N N 35 110.524 112.026 -1.502 1
1 366 . 5 1 1 A 36 36 GLU H H 36 8.091 8.647 -0.556 1
1 367 . 5 1 1 A 36 36 GLU HA H 36 4.371 5.131 -0.760 1
1 372 . 5 1 1 A 36 36 GLU C C 36 174.864 174.881 -0.017 1
1 373 . 5 1 1 A 36 36 GLU CA C 36 55.201 54.811 0.390 1
1 374 . 5 1 1 A 36 36 GLU CB C 36 31.878 33.730 -1.852 1
1 376 . 5 1 1 A 36 36 GLU N N 36 122.202 123.432 -1.230 1
1 377 . 5 1 1 A 37 37 LEU H H 37 8.307 8.698 -0.391 1
1 378 . 5 1 1 A 37 37 LEU HA H 37 4.288 4.267 0.021 1
1 388 . 5 1 1 A 37 37 LEU C C 37 176.702 175.915 0.787 1
1 389 . 5 1 1 A 37 37 LEU CA C 37 55.342 56.197 -0.855 1
1 390 . 5 1 1 A 37 37 LEU CB C 37 42.715 42.025 0.690 1
1 394 . 5 1 1 A 37 37 LEU N N 37 123.204 126.979 -3.775 1
1 395 . 5 1 1 A 38 38 LEU H H 38 8.909 8.806 0.103 1
1 396 . 5 1 1 A 38 38 LEU HA H 38 4.640 4.724 -0.084 1
1 406 . 5 1 1 A 38 38 LEU C C 38 177.202 176.817 0.385 1
1 407 . 5 1 1 A 38 38 LEU CA C 38 54.390 54.981 -0.591 1
1 408 . 5 1 1 A 38 38 LEU CB C 38 43.770 43.347 0.423 1
1 412 . 5 1 1 A 38 38 LEU N N 38 123.021 127.785 -4.764 1
1 413 . 5 1 1 A 39 39 GLY H H 39 7.113 6.933 0.180 1
1 414 . 5 1 1 A 39 39 GLY HA2 H 39 4.816 3.546 1.270 1
1 415 . 5 1 1 A 39 39 GLY HA3 H 39 3.276 3.889 -0.613 1
1 416 . 5 1 1 A 39 39 GLY C C 39 169.863 170.400 -0.537 1
1 417 . 5 1 1 A 39 39 GLY CA C 39 44.622 45.432 -0.810 1
1 418 . 5 1 1 A 39 39 GLY N N 39 104.137 104.042 0.095 1
1 419 . 5 1 1 A 40 40 TYR H H 40 8.318 8.871 -0.553 1
1 420 . 5 1 1 A 40 40 TYR HA H 40 5.414 5.089 0.325 1
1 425 . 5 1 1 A 40 40 TYR C C 40 174.448 172.126 2.322 1
1 426 . 5 1 1 A 40 40 TYR CA C 40 56.178 56.554 -0.376 1
1 427 . 5 1 1 A 40 40 TYR CB C 40 44.191 40.631 3.560 1
1 430 . 5 1 1 A 40 40 TYR N N 40 114.036 115.410 -1.374 1
1 431 . 5 1 1 A 41 41 ARG H H 41 9.347 8.860 0.487 1
1 432 . 5 1 1 A 41 41 ARG HA H 41 5.092 5.467 -0.375 1
1 440 . 5 1 1 A 41 41 ARG C C 41 174.097 174.093 0.004 1
1 441 . 5 1 1 A 41 41 ARG CA C 41 56.100 54.323 1.777 1
1 442 . 5 1 1 A 41 41 ARG CB C 41 34.508 32.873 1.635 1
1 445 . 5 1 1 A 41 41 ARG N N 41 122.231 121.063 1.168 1
1 447 . 5 1 1 A 42 42 LEU H H 42 9.546 9.015 0.531 1
1 448 . 5 1 1 A 42 42 LEU HA H 42 5.459 5.026 0.433 1
1 458 . 5 1 1 A 42 42 LEU C C 42 174.913 174.841 0.072 1
1 459 . 5 1 1 A 42 42 LEU CA C 42 52.997 53.480 -0.483 1
1 460 . 5 1 1 A 42 42 LEU CB C 42 46.413 45.676 0.737 1
1 464 . 5 1 1 A 42 42 LEU N N 42 132.335 127.134 5.201 1
1 465 . 5 1 1 A 43 43 GLN H H 43 9.502 9.358 0.144 1
1 466 . 5 1 1 A 43 43 GLN HA H 43 5.847 5.315 0.532 1
1 473 . 5 1 1 A 43 43 GLN C C 43 175.329 174.231 1.098 1
1 474 . 5 1 1 A 43 43 GLN CA C 43 54.005 54.529 -0.524 1
1 475 . 5 1 1 A 43 43 GLN CB C 43 33.429 31.131 2.298 1
1 477 . 5 1 1 A 43 43 GLN N N 43 123.932 125.866 -1.934 1
1 479 . 5 1 1 A 44 44 TYR H H 44 8.615 8.011 0.604 1
1 480 . 5 1 1 A 44 44 TYR HA H 44 5.783 5.601 0.182 1
1 487 . 5 1 1 A 44 44 TYR C C 44 174.058 173.472 0.586 1
1 488 . 5 1 1 A 44 44 TYR CA C 44 55.942 56.293 -0.351 1
1 489 . 5 1 1 A 44 44 TYR CB C 44 43.052 41.286 1.766 1
1 494 . 5 1 1 A 44 44 TYR N N 44 117.355 119.509 -2.154 1
1 495 . 5 1 1 A 45 45 CYS H H 45 8.377 8.234 0.143 1
1 496 . 5 1 1 A 45 45 CYS HA H 45 4.772 5.149 -0.377 1
1 499 . 5 1 1 A 45 45 CYS C C 45 173.205 173.857 -0.652 1
1 500 . 5 1 1 A 45 45 CYS CA C 45 55.960 57.030 -1.070 1
1 501 . 5 1 1 A 45 45 CYS CB C 45 30.665 31.233 -0.568 1
1 502 . 5 1 1 A 45 45 CYS N N 45 115.140 118.568 -3.428 1
1 503 . 5 1 1 A 46 46 ARG H H 46 9.165 8.526 0.639 1
1 504 . 5 1 1 A 46 46 ARG HA H 46 4.068 3.729 0.339 1
1 511 . 5 1 1 A 46 46 ARG C C 46 178.440 177.337 1.103 1
1 512 . 5 1 1 A 46 46 ARG CA C 46 56.401 55.886 0.515 1
1 513 . 5 1 1 A 46 46 ARG CB C 46 31.878 30.973 0.905 1
1 516 . 5 1 1 A 46 46 ARG N N 46 121.803 121.427 0.376 1
1 517 . 5 1 1 A 47 47 ALA H H 47 8.273 8.147 0.126 1
1 518 . 5 1 1 A 47 47 ALA HA H 47 3.891 4.083 -0.192 1
1 522 . 5 1 1 A 47 47 ALA C C 47 177.599 177.276 0.323 1
1 523 . 5 1 1 A 47 47 ALA CA C 47 54.796 53.541 1.255 1
1 524 . 5 1 1 A 47 47 ALA CB C 47 18.287 18.647 -0.360 1
1 525 . 5 1 1 A 47 47 ALA N N 47 123.895 123.768 0.127 1
1 526 . 5 1 1 A 48 48 ASP H H 48 8.036 8.020 0.016 1
1 527 . 5 1 1 A 48 48 ASP HA H 48 4.453 4.778 -0.325 1
1 530 . 5 1 1 A 48 48 ASP C C 48 175.836 175.820 0.016 1
1 531 . 5 1 1 A 48 48 ASP CA C 48 53.368 52.855 0.513 1
1 532 . 5 1 1 A 48 48 ASP CB C 48 39.964 41.165 -1.201 1
1 533 . 5 1 1 A 48 48 ASP N N 48 112.576 117.309 -4.733 1
1 534 . 5 1 1 A 49 49 GLU H H 49 7.495 7.243 0.252 1
1 535 . 5 1 1 A 49 49 GLU HA H 49 4.308 4.383 -0.075 1
1 540 . 5 1 1 A 49 49 GLU C C 49 175.756 175.789 -0.033 1
1 541 . 5 1 1 A 49 49 GLU CA C 49 56.224 55.440 0.784 1
1 542 . 5 1 1 A 49 49 GLU CB C 49 32.248 30.419 1.829 1
1 544 . 5 1 1 A 49 49 GLU N N 49 120.609 119.661 0.948 1
1 545 . 5 1 1 A 50 50 ALA H H 50 8.416 8.601 -0.185 1
1 546 . 5 1 1 A 50 50 ALA HA H 50 4.200 4.497 -0.297 1
1 550 . 5 1 1 A 50 50 ALA C C 50 177.433 177.270 0.163 1
1 551 . 5 1 1 A 50 50 ALA CA C 50 53.297 52.279 1.018 1
1 552 . 5 1 1 A 50 50 ALA CB C 50 19.474 20.679 -1.205 1
1 553 . 5 1 1 A 50 50 ALA N N 50 124.065 123.164 0.901 1
1 554 . 5 1 1 A 51 51 ARG H H 51 7.648 7.591 0.057 1
1 555 . 5 1 1 A 51 51 ARG HA H 51 4.747 4.680 0.067 1
1 562 . 5 1 1 A 51 51 ARG C C 51 173.400 173.513 -0.113 1
1 563 . 5 1 1 A 51 51 ARG CA C 51 52.592 52.552 0.040 1
1 564 . 5 1 1 A 51 51 ARG CB C 51 31.212 32.325 -1.113 1
1 567 . 5 1 1 A 51 51 ARG N N 51 117.798 117.603 0.195 1
1 568 . 5 1 1 A 52 52 PRO HA H 52 4.212 4.458 -0.246 1
1 575 . 5 1 1 A 52 52 PRO C C 52 176.380 175.664 0.716 1
1 576 . 5 1 1 A 52 52 PRO CA C 52 62.360 62.587 -0.227 1
1 577 . 5 1 1 A 52 52 PRO CB C 52 32.331 32.371 -0.040 1
1 580 . 5 1 1 A 53 53 ASN H H 53 8.127 7.926 0.201 1
1 581 . 5 1 1 A 53 53 ASN HA H 53 4.651 4.848 -0.197 1
1 586 . 5 1 1 A 53 53 ASN C C 53 174.354 174.235 0.119 1
1 587 . 5 1 1 A 53 53 ASN CA C 53 53.136 52.336 0.800 1
1 588 . 5 1 1 A 53 53 ASN CB C 53 39.666 38.310 1.356 1
1 589 . 5 1 1 A 53 53 ASN N N 53 119.405 119.589 -0.184 1
1 591 . 5 1 1 A 54 54 THR H H 54 8.425 8.632 -0.207 1
1 592 . 5 1 1 A 54 54 THR HA H 54 5.306 4.535 0.771 1
1 597 . 5 1 1 A 54 54 THR C C 54 173.850 174.155 -0.305 1
1 598 . 5 1 1 A 54 54 THR CA C 54 61.881 63.072 -1.191 1
1 599 . 5 1 1 A 54 54 THR CB C 54 70.573 69.806 0.767 1
1 601 . 5 1 1 A 54 54 THR N N 54 118.968 121.357 -2.389 1
1 602 . 5 1 1 A 55 55 ILE H H 55 9.354 8.516 0.838 1
1 603 . 5 1 1 A 55 55 ILE HA H 55 4.051 4.515 -0.464 1
1 613 . 5 1 1 A 55 55 ILE C C 55 172.975 173.395 -0.420 1
1 614 . 5 1 1 A 55 55 ILE CA C 55 61.003 59.901 1.102 1
1 615 . 5 1 1 A 55 55 ILE CB C 55 41.619 42.045 -0.426 1
1 619 . 5 1 1 A 55 55 ILE N N 55 127.961 124.634 3.327 1
1 620 . 5 1 1 A 56 56 ASP H H 56 8.132 8.745 -0.613 1
1 621 . 5 1 1 A 56 56 ASP HA H 56 5.334 5.149 0.185 1
1 624 . 5 1 1 A 56 56 ASP C C 56 174.969 174.624 0.345 1
1 625 . 5 1 1 A 56 56 ASP CA C 56 53.702 52.724 0.978 1
1 626 . 5 1 1 A 56 56 ASP CB C 56 43.251 42.392 0.859 1
1 627 . 5 1 1 A 56 56 ASP N N 56 125.882 127.187 -1.305 1
1 628 . 5 1 1 A 57 57 PHE H H 57 8.955 8.806 0.149 1
1 629 . 5 1 1 A 57 57 PHE HA H 57 4.915 5.038 -0.123 1
1 637 . 5 1 1 A 57 57 PHE C C 57 177.361 175.639 1.722 1
1 638 . 5 1 1 A 57 57 PHE CA C 57 57.458 56.391 1.067 1
1 639 . 5 1 1 A 57 57 PHE CB C 57 43.737 43.526 0.211 1
1 645 . 5 1 1 A 57 57 PHE N N 57 118.872 123.868 -4.996 1
1 646 . 5 1 1 A 58 58 GLY H H 58 9.552 9.161 0.391 1
1 647 . 5 1 1 A 58 58 GLY HA2 H 58 4.662 4.107 0.555 1
1 648 . 5 1 1 A 58 58 GLY HA3 H 58 4.126 4.184 -0.058 1
1 649 . 5 1 1 A 58 58 GLY C C 58 174.760 174.929 -0.169 1
1 650 . 5 1 1 A 58 58 GLY CA C 58 44.680 45.080 -0.400 1
1 651 . 5 1 1 A 58 58 GLY N N 58 111.551 109.787 1.764 1
1 652 . 5 1 1 A 59 59 LYS H H 59 8.211 8.662 -0.451 1
1 653 . 5 1 1 A 59 59 LYS HA H 59 3.782 3.691 0.091 1
1 662 . 5 1 1 A 59 59 LYS C C 59 176.154 178.264 -2.110 1
1 663 . 5 1 1 A 59 59 LYS CA C 59 59.080 58.647 0.433 1
1 664 . 5 1 1 A 59 59 LYS CB C 59 32.516 31.845 0.671 1
1 668 . 5 1 1 A 59 59 LYS N N 59 115.953 120.477 -4.524 1
1 669 . 5 1 1 A 60 60 ASP H H 60 8.634 8.084 0.550 1
1 670 . 5 1 1 A 60 60 ASP HA H 60 4.882 4.409 0.473 1
1 673 . 5 1 1 A 60 60 ASP C C 60 176.039 176.051 -0.012 1
1 674 . 5 1 1 A 60 60 ASP CA C 60 54.327 57.158 -2.831 1
1 675 . 5 1 1 A 60 60 ASP CB C 60 41.461 41.196 0.265 1
1 676 . 5 1 1 A 60 60 ASP N N 60 117.261 120.485 -3.224 1
1 677 . 5 1 1 A 61 61 ASP H H 61 7.500 8.372 -0.872 1
1 678 . 5 1 1 A 61 61 ASP HA H 61 4.591 4.662 -0.071 1
1 681 . 5 1 1 A 61 61 ASP C C 61 175.140 175.841 -0.701 1
1 682 . 5 1 1 A 61 61 ASP CA C 61 55.342 54.072 1.270 1
1 683 . 5 1 1 A 61 61 ASP CB C 61 42.475 40.306 2.169 1
1 684 . 5 1 1 A 61 61 ASP N N 61 122.319 118.982 3.337 1
1 685 . 5 1 1 A 62 62 GLN H H 62 8.239 7.902 0.337 1
1 686 . 5 1 1 A 62 62 GLN HA H 62 2.569 3.762 -1.193 1
1 693 . 5 1 1 A 62 62 GLN C C 62 172.652 173.558 -0.906 1
1 694 . 5 1 1 A 62 62 GLN CA C 62 54.038 55.381 -1.343 1
1 695 . 5 1 1 A 62 62 GLN CB C 62 31.481 29.232 2.249 1
1 697 . 5 1 1 A 62 62 GLN N N 62 117.458 123.469 -6.011 1
1 699 . 5 1 1 A 63 63 HIS H H 63 6.338 6.735 -0.397 1
1 700 . 5 1 1 A 63 63 HIS HA H 63 4.423 4.327 0.096 1
1 704 . 5 1 1 A 63 63 HIS C C 63 173.031 172.690 0.341 1
1 705 . 5 1 1 A 63 63 HIS CA C 63 54.743 54.006 0.737 1
1 706 . 5 1 1 A 63 63 HIS CB C 63 32.661 31.278 1.383 1
1 708 . 5 1 1 A 63 63 HIS N N 63 113.589 115.801 -2.212 1
1 709 . 5 1 1 A 64 64 PHE H H 64 8.549 9.105 -0.556 1
1 710 . 5 1 1 A 64 64 PHE HA H 64 4.578 5.036 -0.458 1
1 718 . 5 1 1 A 64 64 PHE C C 64 173.015 173.518 -0.503 1
1 719 . 5 1 1 A 64 64 PHE CA C 64 58.516 57.491 1.025 1
1 720 . 5 1 1 A 64 64 PHE CB C 64 43.525 42.949 0.576 1
1 726 . 5 1 1 A 64 64 PHE N N 64 118.214 119.667 -1.453 1
1 727 . 5 1 1 A 65 65 THR H H 65 7.150 8.029 -0.879 1
1 728 . 5 1 1 A 65 65 THR HA H 65 4.930 4.687 0.243 1
1 733 . 5 1 1 A 65 65 THR C C 65 172.457 173.382 -0.925 1
1 734 . 5 1 1 A 65 65 THR CA C 65 61.690 61.701 -0.011 1
1 735 . 5 1 1 A 65 65 THR CB C 65 69.593 69.214 0.379 1
1 737 . 5 1 1 A 65 65 THR N N 65 123.198 119.722 3.476 1
1 738 . 5 1 1 A 66 66 VAL H H 66 8.888 8.740 0.148 1
1 739 . 5 1 1 A 66 66 VAL HA H 66 4.018 4.727 -0.709 1
1 747 . 5 1 1 A 66 66 VAL C C 66 174.868 175.531 -0.663 1
1 748 . 5 1 1 A 66 66 VAL CA C 66 61.178 60.901 0.277 1
1 749 . 5 1 1 A 66 66 VAL CB C 66 33.114 32.939 0.175 1
1 752 . 5 1 1 A 66 66 VAL N N 66 126.840 128.560 -1.720 1
1 753 . 5 1 1 A 67 67 THR H H 67 8.174 8.513 -0.339 1
1 754 . 5 1 1 A 67 67 THR HA H 67 4.816 5.039 -0.223 1
1 759 . 5 1 1 A 67 67 THR C C 67 174.494 174.266 0.228 1
1 760 . 5 1 1 A 67 67 THR CA C 67 59.786 59.534 0.252 1
1 761 . 5 1 1 A 67 67 THR CB C 67 70.887 71.703 -0.816 1
1 763 . 5 1 1 A 67 67 THR N N 67 116.127 116.978 -0.851 1
1 764 . 5 1 1 A 68 68 GLY H H 68 8.570 8.524 0.046 1
1 765 . 5 1 1 A 68 68 GLY HA2 H 68 3.970 4.011 -0.041 1
1 766 . 5 1 1 A 68 68 GLY HA3 H 68 3.819 4.020 -0.201 1
1 767 . 5 1 1 A 68 68 GLY C C 68 175.636 174.648 0.988 1
1 768 . 5 1 1 A 68 68 GLY CA C 68 46.397 45.248 1.149 1
1 769 . 5 1 1 A 68 68 GLY N N 68 107.146 113.064 -5.918 1
1 770 . 5 1 1 A 69 69 LEU H H 69 8.007 7.414 0.593 1
1 771 . 5 1 1 A 69 69 LEU HA H 69 4.154 4.243 -0.089 1
1 781 . 5 1 1 A 69 69 LEU C C 69 176.830 176.557 0.273 1
1 782 . 5 1 1 A 69 69 LEU CA C 69 54.602 55.192 -0.590 1
1 783 . 5 1 1 A 69 69 LEU CB C 69 41.149 42.134 -0.985 1
1 787 . 5 1 1 A 69 69 LEU N N 69 118.433 122.986 -4.553 1
1 788 . 5 1 1 A 70 70 HIS H H 70 8.866 8.340 0.526 1
1 789 . 5 1 1 A 70 70 HIS HA H 70 4.663 4.632 0.031 1
1 793 . 5 1 1 A 70 70 HIS C C 70 176.667 175.701 0.966 1
1 794 . 5 1 1 A 70 70 HIS CA C 70 55.464 56.845 -1.381 1
1 795 . 5 1 1 A 70 70 HIS CB C 70 32.125 29.580 2.545 1
1 797 . 5 1 1 A 70 70 HIS N N 70 122.457 122.842 -0.385 1
1 798 . 5 1 1 A 71 71 LYS H H 71 8.716 8.561 0.155 1
1 799 . 5 1 1 A 71 71 LYS HA H 71 4.320 4.150 0.170 1
1 808 . 5 1 1 A 71 71 LYS C C 71 178.110 176.735 1.375 1
1 809 . 5 1 1 A 71 71 LYS CA C 71 57.035 56.191 0.844 1
1 810 . 5 1 1 A 71 71 LYS CB C 71 33.580 33.071 0.509 1
1 814 . 5 1 1 A 71 71 LYS N N 71 123.173 124.443 -1.270 1
1 815 . 5 1 1 A 72 72 GLY H H 72 7.709 9.016 -1.307 1
1 816 . 5 1 1 A 72 72 GLY HA2 H 72 3.800 3.900 -0.100 1
1 817 . 5 1 1 A 72 72 GLY HA3 H 72 3.769 3.907 -0.138 1
1 818 . 5 1 1 A 72 72 GLY C C 72 174.231 173.845 0.386 1
1 819 . 5 1 1 A 72 72 GLY CA C 72 47.866 46.362 1.504 1
1 820 . 5 1 1 A 72 72 GLY N N 72 114.881 110.217 4.664 1
1 821 . 5 1 1 A 73 73 THR H H 73 8.162 7.751 0.411 1
1 822 . 5 1 1 A 73 73 THR HA H 73 4.584 4.915 -0.331 1
1 827 . 5 1 1 A 73 73 THR C C 73 172.208 173.375 -1.167 1
1 828 . 5 1 1 A 73 73 THR CA C 73 62.307 61.177 1.130 1
1 829 . 5 1 1 A 73 73 THR CB C 73 72.123 72.348 -0.225 1
1 831 . 5 1 1 A 73 73 THR N N 73 114.225 114.249 -0.024 1
1 832 . 5 1 1 A 74 74 THR H H 74 8.743 8.662 0.081 1
1 833 . 5 1 1 A 74 74 THR HA H 74 5.138 5.144 -0.006 1
1 838 . 5 1 1 A 74 74 THR C C 74 173.376 173.054 0.322 1
1 839 . 5 1 1 A 74 74 THR CA C 74 62.724 62.103 0.621 1
1 840 . 5 1 1 A 74 74 THR CB C 74 69.202 71.327 -2.125 1
1 842 . 5 1 1 A 74 74 THR N N 74 123.376 119.163 4.213 1
1 843 . 5 1 1 A 75 75 TYR H H 75 9.549 9.231 0.318 1
1 844 . 5 1 1 A 75 75 TYR HA H 75 4.892 5.229 -0.337 1
1 851 . 5 1 1 A 75 75 TYR C C 75 173.991 175.341 -1.350 1
1 852 . 5 1 1 A 75 75 TYR CA C 75 57.740 56.040 1.700 1
1 853 . 5 1 1 A 75 75 TYR CB C 75 44.580 43.486 1.094 1
1 858 . 5 1 1 A 75 75 TYR N N 75 126.916 122.883 4.033 1
1 859 . 5 1 1 A 76 76 ILE H H 76 8.769 8.876 -0.107 1
1 860 . 5 1 1 A 76 76 ILE HA H 76 4.663 5.011 -0.348 1
1 870 . 5 1 1 A 76 76 ILE C C 76 174.683 175.316 -0.633 1
1 871 . 5 1 1 A 76 76 ILE CA C 76 60.455 60.771 -0.316 1
1 872 . 5 1 1 A 76 76 ILE CB C 76 40.284 40.001 0.283 1
1 876 . 5 1 1 A 76 76 ILE N N 76 119.407 120.837 -1.430 1
1 877 . 5 1 1 A 77 77 PHE H H 77 8.894 9.134 -0.240 1
1 878 . 5 1 1 A 77 77 PHE HA H 77 5.160 5.103 0.057 1
1 886 . 5 1 1 A 77 77 PHE C C 77 174.794 175.430 -0.636 1
1 887 . 5 1 1 A 77 77 PHE CA C 77 56.831 57.631 -0.800 1
1 888 . 5 1 1 A 77 77 PHE CB C 77 43.132 41.101 2.031 1
1 894 . 5 1 1 A 77 77 PHE N N 77 124.622 127.304 -2.682 1
1 895 . 5 1 1 A 78 78 ARG H H 78 9.407 9.123 0.284 1
1 896 . 5 1 1 A 78 78 ARG HA H 78 5.689 5.574 0.115 1
1 904 . 5 1 1 A 78 78 ARG C C 78 174.376 174.303 0.073 1
1 905 . 5 1 1 A 78 78 ARG CA C 78 54.530 54.618 -0.088 1
1 906 . 5 1 1 A 78 78 ARG CB C 78 34.473 33.704 0.769 1
1 909 . 5 1 1 A 78 78 ARG N N 78 120.055 121.110 -1.055 1
1 911 . 5 1 1 A 79 79 LEU H H 79 9.132 9.151 -0.019 1
1 912 . 5 1 1 A 79 79 LEU HA H 79 5.398 5.232 0.166 1
1 922 . 5 1 1 A 79 79 LEU C C 79 174.006 174.373 -0.367 1
1 923 . 5 1 1 A 79 79 LEU CA C 79 53.401 53.198 0.203 1
1 924 . 5 1 1 A 79 79 LEU CB C 79 48.116 46.543 1.573 1
1 928 . 5 1 1 A 79 79 LEU N N 79 124.907 126.067 -1.160 1
1 929 . 5 1 1 A 80 80 ALA H H 80 8.737 8.055 0.682 1
1 930 . 5 1 1 A 80 80 ALA HA H 80 4.871 5.045 -0.174 1
1 934 . 5 1 1 A 80 80 ALA C C 80 176.057 175.698 0.359 1
1 935 . 5 1 1 A 80 80 ALA CA C 80 50.353 51.122 -0.769 1
1 936 . 5 1 1 A 80 80 ALA CB C 80 23.972 23.330 0.642 1
1 937 . 5 1 1 A 80 80 ALA N N 80 128.220 125.909 2.311 1
1 938 . 5 1 1 A 81 81 ALA H H 81 9.890 8.630 1.260 1
1 939 . 5 1 1 A 81 81 ALA HA H 81 4.794 5.007 -0.213 1
1 943 . 5 1 1 A 81 81 ALA C C 81 174.655 176.290 -1.635 1
1 944 . 5 1 1 A 81 81 ALA CA C 81 50.300 51.211 -0.911 1
1 945 . 5 1 1 A 81 81 ALA CB C 81 21.369 20.664 0.705 1
1 946 . 5 1 1 A 81 81 ALA N N 81 123.682 123.474 0.208 1
1 947 . 5 1 1 A 82 82 LYS H H 82 7.965 8.631 -0.666 1
1 948 . 5 1 1 A 82 82 LYS HA H 82 4.974 5.423 -0.449 1
1 957 . 5 1 1 A 82 82 LYS C C 82 175.671 175.155 0.516 1
1 958 . 5 1 1 A 82 82 LYS CA C 82 54.664 54.775 -0.111 1
1 959 . 5 1 1 A 82 82 LYS CB C 82 36.677 35.633 1.044 1
1 963 . 5 1 1 A 82 82 LYS N N 82 118.164 122.362 -4.198 1
1 964 . 5 1 1 A 83 83 ASN H H 83 8.663 8.784 -0.121 1
1 965 . 5 1 1 A 83 83 ASN HA H 83 5.113 5.065 0.048 1
1 970 . 5 1 1 A 83 83 ASN C C 83 176.582 176.636 -0.054 1
1 971 . 5 1 1 A 83 83 ASN CA C 83 51.746 50.735 1.011 1
1 972 . 5 1 1 A 83 83 ASN CB C 83 40.357 40.176 0.181 1
1 973 . 5 1 1 A 83 83 ASN N N 83 124.784 124.068 0.716 1
1 975 . 5 1 1 A 84 84 ARG H H 84 8.873 8.757 0.116 1
1 976 . 5 1 1 A 84 84 ARG HA H 84 3.940 3.967 -0.027 1
1 983 . 5 1 1 A 84 84 ARG C C 84 176.735 178.017 -1.282 1
1 984 . 5 1 1 A 84 84 ARG CA C 84 59.327 59.414 -0.087 1
1 985 . 5 1 1 A 84 84 ARG CB C 84 29.282 29.936 -0.654 1
1 988 . 5 1 1 A 84 84 ARG N N 84 117.891 119.361 -1.470 1
1 989 . 5 1 1 A 85 85 ALA H H 85 7.645 7.804 -0.159 1
1 990 . 5 1 1 A 85 85 ALA HA H 85 4.276 4.267 0.009 1
1 994 . 5 1 1 A 85 85 ALA C C 85 177.479 177.129 0.350 1
1 995 . 5 1 1 A 85 85 ALA CA C 85 52.818 52.837 -0.019 1
1 996 . 5 1 1 A 85 85 ALA CB C 85 18.806 19.574 -0.768 1
1 997 . 5 1 1 A 85 85 ALA N N 85 120.306 120.379 -0.073 1
1 998 . 5 1 1 A 86 86 GLY H H 86 7.693 7.565 0.128 1
1 999 . 5 1 1 A 86 86 GLY HA2 H 86 4.456 4.087 0.369 1
1 1000 . 5 1 1 A 86 86 GLY HA3 H 86 3.649 4.089 -0.440 1
1 1001 . 5 1 1 A 86 86 GLY C C 86 172.068 172.544 -0.476 1
1 1002 . 5 1 1 A 86 86 GLY CA C 86 44.375 44.029 0.346 1
1 1003 . 5 1 1 A 86 86 GLY N N 86 106.594 103.772 2.822 1
1 1004 . 5 1 1 A 87 87 LEU H H 87 8.203 8.453 -0.250 1
1 1005 . 5 1 1 A 87 87 LEU HA H 87 4.629 4.716 -0.087 1
1 1015 . 5 1 1 A 87 87 LEU C C 87 179.155 176.777 2.378 1
1 1016 . 5 1 1 A 87 87 LEU CA C 87 54.814 55.378 -0.564 1
1 1017 . 5 1 1 A 87 87 LEU CB C 87 43.454 42.539 0.915 1
1 1021 . 5 1 1 A 87 87 LEU N N 87 120.879 122.454 -1.575 1
1 1022 . 5 1 1 A 88 88 GLY H H 88 8.492 8.093 0.399 1
1 1023 . 5 1 1 A 88 88 GLY HA2 H 88 4.339 4.135 0.204 1
1 1024 . 5 1 1 A 88 88 GLY HA3 H 88 4.122 4.142 -0.020 1
1 1025 . 5 1 1 A 88 88 GLY C C 88 173.030 173.351 -0.321 1
1 1026 . 5 1 1 A 88 88 GLY CA C 88 43.970 44.569 -0.599 1
1 1027 . 5 1 1 A 88 88 GLY N N 88 109.903 110.646 -0.743 1
1 1028 . 5 1 1 A 89 89 GLU H H 89 7.638 8.753 -1.115 1
1 1029 . 5 1 1 A 89 89 GLU HA H 89 4.103 4.384 -0.281 1
1 1034 . 5 1 1 A 89 89 GLU C C 89 177.511 175.825 1.686 1
1 1035 . 5 1 1 A 89 89 GLU CA C 89 56.659 56.701 -0.042 1
1 1036 . 5 1 1 A 89 89 GLU CB C 89 31.324 30.634 0.690 1
1 1038 . 5 1 1 A 89 89 GLU N N 89 117.551 122.841 -5.290 1
1 1039 . 5 1 1 A 90 90 GLU H H 90 8.734 9.098 -0.364 1
1 1040 . 5 1 1 A 90 90 GLU HA H 90 4.651 5.365 -0.714 1
1 1045 . 5 1 1 A 90 90 GLU C C 90 177.452 174.789 2.663 1
1 1046 . 5 1 1 A 90 90 GLU CA C 90 55.987 54.727 1.260 1
1 1047 . 5 1 1 A 90 90 GLU CB C 90 31.135 33.220 -2.085 1
1 1049 . 5 1 1 A 90 90 GLU N N 90 121.553 118.404 3.149 1
1 1050 . 5 1 1 A 91 91 PHE H H 91 9.411 9.290 0.121 1
1 1051 . 5 1 1 A 91 91 PHE HA H 91 4.665 4.878 -0.213 1
1 1059 . 5 1 1 A 91 91 PHE C C 91 173.944 174.735 -0.791 1
1 1060 . 5 1 1 A 91 91 PHE CA C 91 57.687 58.539 -0.852 1
1 1061 . 5 1 1 A 91 91 PHE CB C 91 40.890 40.531 0.359 1
1 1067 . 5 1 1 A 91 91 PHE N N 91 125.459 125.108 0.351 1
1 1068 . 5 1 1 A 92 92 GLU H H 92 8.043 7.816 0.227 1
1 1069 . 5 1 1 A 92 92 GLU HA H 92 5.424 5.342 0.082 1
1 1074 . 5 1 1 A 92 92 GLU C C 92 174.295 174.140 0.155 1
1 1075 . 5 1 1 A 92 92 GLU CA C 92 54.378 54.821 -0.443 1
1 1076 . 5 1 1 A 92 92 GLU CB C 92 33.662 33.209 0.453 1
1 1078 . 5 1 1 A 92 92 GLU N N 92 128.905 126.269 2.636 1
1 1079 . 5 1 1 A 93 93 LYS H H 93 9.142 9.036 0.106 1
1 1080 . 5 1 1 A 93 93 LYS HA H 93 4.541 5.262 -0.721 1
1 1089 . 5 1 1 A 93 93 LYS C C 93 173.366 173.991 -0.625 1
1 1090 . 5 1 1 A 93 93 LYS CA C 93 55.343 55.106 0.237 1
1 1091 . 5 1 1 A 93 93 LYS CB C 93 37.317 36.350 0.967 1
1 1095 . 5 1 1 A 93 93 LYS N N 93 125.231 127.699 -2.468 1
1 1096 . 5 1 1 A 94 94 GLU H H 94 8.655 9.157 -0.502 1
1 1097 . 5 1 1 A 94 94 GLU HA H 94 5.558 5.273 0.285 1
1 1102 . 5 1 1 A 94 94 GLU C C 94 176.238 175.635 0.603 1
1 1103 . 5 1 1 A 94 94 GLU CA C 94 54.632 55.134 -0.502 1
1 1104 . 5 1 1 A 94 94 GLU CB C 94 32.166 32.299 -0.133 1
1 1106 . 5 1 1 A 94 94 GLU N N 94 127.232 128.180 -0.948 1
1 1107 . 5 1 1 A 95 95 ILE H H 95 9.302 8.894 0.408 1
1 1108 . 5 1 1 A 95 95 ILE HA H 95 4.794 5.300 -0.506 1
1 1118 . 5 1 1 A 95 95 ILE C C 95 173.138 174.338 -1.200 1
1 1119 . 5 1 1 A 95 95 ILE CA C 95 58.570 58.550 0.020 1
1 1120 . 5 1 1 A 95 95 ILE CB C 95 42.420 42.716 -0.296 1
1 1124 . 5 1 1 A 95 95 ILE N N 95 120.711 121.744 -1.033 1
1 1125 . 5 1 1 A 96 96 ARG H H 96 8.589 8.795 -0.206 1
1 1126 . 5 1 1 A 96 96 ARG HA H 96 5.373 4.929 0.444 1
1 1133 . 5 1 1 A 96 96 ARG C C 96 177.147 175.136 2.011 1
1 1134 . 5 1 1 A 96 96 ARG CA C 96 54.045 54.985 -0.940 1
1 1135 . 5 1 1 A 96 96 ARG CB C 96 32.001 33.889 -1.888 1
1 1138 . 5 1 1 A 96 96 ARG N N 96 124.445 121.949 2.496 1
1 1139 . 5 1 1 A 97 97 THR H H 97 9.243 8.951 0.292 1
1 1140 . 5 1 1 A 97 97 THR HA H 97 4.459 4.690 -0.231 1
1 1145 . 5 1 1 A 97 97 THR C C 97 172.745 173.773 -1.028 1
1 1146 . 5 1 1 A 97 97 THR CA C 97 59.637 60.686 -1.049 1
1 1147 . 5 1 1 A 97 97 THR CB C 97 67.687 68.842 -1.155 1
1 1149 . 5 1 1 A 97 97 THR N N 97 119.370 117.922 1.448 1
1 1150 . 5 1 1 A 98 98 PRO HA H 98 4.494 4.676 -0.182 1
1 1157 . 5 1 1 A 98 98 PRO CA C 98 63.117 62.888 0.229 1
1 1158 . 5 1 1 A 98 98 PRO CB C 98 32.500 31.666 0.834 1
1 1161 . 5 1 1 A 99 99 GLU H H 99 8.534 8.847 -0.313 1
1 1162 . 5 1 1 A 99 99 GLU HA H 99 4.195 3.994 0.201 1
1 1167 . 5 1 1 A 99 99 GLU C C 99 175.881 176.193 -0.312 1
1 1168 . 5 1 1 A 99 99 GLU CA C 99 56.330 59.161 -2.831 1
1 1169 . 5 1 1 A 99 99 GLU CB C 99 31.062 29.730 1.332 1
1 1171 . 5 1 1 A 99 99 GLU N N 99 119.688 123.410 -3.722 1
1 1172 . 5 1 1 A 100 100 ASP H H 100 8.536 7.658 0.878 1
1 1173 . 5 1 1 A 100 100 ASP HA H 100 4.607 4.805 -0.198 1
1 1176 . 5 1 1 A 100 100 ASP C C 100 176.012 175.916 0.096 1
1 1177 . 5 1 1 A 100 100 ASP CA C 100 54.109 53.318 0.791 1
1 1178 . 5 1 1 A 100 100 ASP CB C 100 41.562 43.654 -2.092 1
1 1179 . 5 1 1 A 100 100 ASP N N 100 119.803 114.503 5.300 1
1 1180 . 5 1 1 A 101 101 LEU H H 101 8.403 8.789 -0.386 1
1 1181 . 5 1 1 A 101 101 LEU HA H 101 4.426 4.074 0.352 1
1 1191 . 5 1 1 A 101 101 LEU C C 101 177.534 176.320 1.214 1
1 1192 . 5 1 1 A 101 101 LEU CA C 101 55.113 57.182 -2.069 1
1 1193 . 5 1 1 A 101 101 LEU CB C 101 42.156 41.713 0.443 1
1 1197 . 5 1 1 A 101 101 LEU N N 101 123.876 121.199 2.677 1
1 1198 . 5 1 1 A 102 102 SER H H 102 8.413 7.894 0.519 1
1 1199 . 5 1 1 A 102 102 SER HA H 102 4.434 4.644 -0.210 1
1 1202 . 5 1 1 A 102 102 SER C C 102 174.674 173.539 1.135 1
1 1203 . 5 1 1 A 102 102 SER CA C 102 58.798 57.015 1.783 1
1 1204 . 5 1 1 A 102 102 SER CB C 102 63.854 63.520 0.334 1
1 1205 . 5 1 1 A 102 102 SER N N 102 116.667 115.599 1.068 1
1 1206 . 5 1 1 A 103 103 GLY H H 103 8.213 8.406 -0.193 1
1 1207 . 5 1 1 A 103 103 GLY HA2 H 103 4.164 4.057 0.107 1
1 1208 . 5 1 1 A 103 103 GLY HA3 H 103 4.057 4.057 0.000 1
1 1209 . 5 1 1 A 103 103 GLY C C 103 171.822 173.957 -2.135 1
1 1210 . 5 1 1 A 103 103 GLY CA C 103 44.658 45.366 -0.708 1
1 1211 . 5 1 1 A 103 103 GLY N N 103 110.592 114.063 -3.471 1
1 1212 . 5 1 1 A 104 104 PRO HA H 104 4.475 4.318 0.157 1
1 1219 . 5 1 1 A 104 104 PRO C C 104 177.445 177.117 0.328 1
1 1220 . 5 1 1 A 104 104 PRO CA C 104 63.312 64.930 -1.618 1
1 1221 . 5 1 1 A 104 104 PRO CB C 104 32.190 31.002 1.188 1
1 1224 . 5 1 1 A 105 105 SER H H 105 8.538 7.944 0.594 1
1 1225 . 5 1 1 A 105 105 SER HA H 105 4.541 4.389 0.152 1
1 1228 . 5 1 1 A 105 105 SER C C 105 174.616 174.396 0.220 1
1 1229 . 5 1 1 A 105 105 SER CA C 105 58.270 58.611 -0.341 1
1 1230 . 5 1 1 A 105 105 SER CB C 105 63.895 63.239 0.656 1
1 1231 . 5 1 1 A 105 105 SER N N 105 116.446 111.359 5.087 1
1 1232 . 5 1 1 A 106 106 SER H H 106 8.350 8.671 -0.321 1
1 1233 . 5 1 1 A 106 106 SER HA H 106 4.541 5.262 -0.721 1
1 1236 . 5 1 1 A 106 106 SER C C 106 174.530 174.001 0.529 1
1 1237 . 5 1 1 A 106 106 SER CA C 106 58.357 57.215 1.142 1
1 1238 . 5 1 1 A 106 106 SER CB C 106 64.020 65.280 -1.260 1
1 1239 . 5 1 1 A 106 106 SER N N 106 117.448 120.576 -3.128 1
1 1 . 6 1 1 A 2 2 SER C C 2 174.723 174.815 -0.092 1
1 2 . 6 1 1 A 2 2 SER CA C 2 58.446 57.630 0.816 1
1 3 . 6 1 1 A 2 2 SER CB C 2 63.566 64.488 -0.922 1
1 4 . 6 1 1 A 3 3 SER H H 3 8.350 9.116 -0.766 1
1 5 . 6 1 1 A 3 3 SER C C 3 173.961 174.304 -0.343 1
1 6 . 6 1 1 A 3 3 SER CA C 3 58.428 59.760 -1.332 1
1 7 . 6 1 1 A 3 3 SER CB C 3 63.937 63.752 0.185 1
1 8 . 6 1 1 A 3 3 SER N N 3 117.923 118.957 -1.034 1
1 9 . 6 1 1 A 4 4 GLY H H 4 8.050 7.413 0.637 1
1 10 . 6 1 1 A 4 4 GLY C C 4 179.009 171.934 7.075 1
1 11 . 6 1 1 A 4 4 GLY CA C 4 46.174 45.426 0.748 1
1 12 . 6 1 1 A 4 4 GLY N N 4 116.890 106.562 10.328 1
1 13 . 6 1 1 A 7 7 GLY HA2 H 7 4.340 4.166 0.174 1
1 14 . 6 1 1 A 7 7 GLY HA3 H 7 3.629 4.167 -0.538 1
1 15 . 6 1 1 A 7 7 GLY CA C 7 44.381 45.249 -0.868 1
1 16 . 6 1 1 A 8 8 PRO HA H 8 4.476 4.494 -0.018 1
1 23 . 6 1 1 A 8 8 PRO C C 8 176.235 177.287 -1.052 1
1 24 . 6 1 1 A 8 8 PRO CA C 8 62.995 62.598 0.397 1
1 25 . 6 1 1 A 8 8 PRO CB C 8 33.266 32.719 0.547 1
1 28 . 6 1 1 A 9 9 GLY H H 9 8.585 8.374 0.211 1
1 29 . 6 1 1 A 9 9 GLY HA2 H 9 4.326 4.127 0.199 1
1 30 . 6 1 1 A 9 9 GLY HA3 H 9 4.009 4.135 -0.126 1
1 31 . 6 1 1 A 9 9 GLY C C 9 172.998 173.011 -0.013 1
1 32 . 6 1 1 A 9 9 GLY CA C 9 44.393 44.295 0.098 1
1 33 . 6 1 1 A 9 9 GLY N N 9 106.004 107.710 -1.706 1
1 34 . 6 1 1 A 10 10 ARG H H 10 8.548 8.580 -0.032 1
1 35 . 6 1 1 A 10 10 ARG HA H 10 4.654 5.110 -0.456 1
1 41 . 6 1 1 A 10 10 ARG C C 10 175.780 174.693 1.087 1
1 42 . 6 1 1 A 10 10 ARG CA C 10 54.708 54.349 0.359 1
1 43 . 6 1 1 A 10 10 ARG CB C 10 31.448 31.745 -0.297 1
1 45 . 6 1 1 A 10 10 ARG N N 10 119.407 118.774 0.633 1
1 46 . 6 1 1 A 11 11 PRO HA H 11 4.611 4.617 -0.006 1
1 53 . 6 1 1 A 11 11 PRO C C 11 173.510 175.565 -2.055 1
1 54 . 6 1 1 A 11 11 PRO CA C 11 62.360 62.685 -0.325 1
1 55 . 6 1 1 A 11 11 PRO CB C 11 33.402 32.223 1.179 1
1 58 . 6 1 1 A 12 12 THR H H 12 7.572 7.973 -0.401 1
1 59 . 6 1 1 A 12 12 THR HA H 12 3.796 4.357 -0.561 1
1 64 . 6 1 1 A 12 12 THR C C 12 172.337 173.470 -1.133 1
1 65 . 6 1 1 A 12 12 THR CA C 12 61.778 61.579 0.199 1
1 66 . 6 1 1 A 12 12 THR CB C 12 70.561 68.835 1.726 1
1 68 . 6 1 1 A 12 12 THR N N 12 109.653 117.595 -7.942 1
1 69 . 6 1 1 A 13 13 MET H H 13 5.605 8.565 -2.960 1
1 70 . 6 1 1 A 13 13 MET HA H 13 5.091 4.988 0.103 1
1 78 . 6 1 1 A 13 13 MET C C 13 172.639 174.978 -2.339 1
1 79 . 6 1 1 A 13 13 MET CA C 13 54.168 53.685 0.483 1
1 80 . 6 1 1 A 13 13 MET CB C 13 37.632 34.639 2.993 1
1 83 . 6 1 1 A 13 13 MET N N 13 121.634 126.958 -5.324 1
1 84 . 6 1 1 A 14 14 MET H H 14 9.254 9.280 -0.026 1
1 85 . 6 1 1 A 14 14 MET HA H 14 4.662 5.006 -0.344 1
1 93 . 6 1 1 A 14 14 MET C C 14 174.388 174.887 -0.499 1
1 94 . 6 1 1 A 14 14 MET CA C 14 54.673 54.522 0.151 1
1 95 . 6 1 1 A 14 14 MET CB C 14 34.907 35.065 -0.158 1
1 98 . 6 1 1 A 14 14 MET N N 14 125.746 123.709 2.037 1
1 99 . 6 1 1 A 15 15 ILE H H 15 8.555 9.046 -0.491 1
1 100 . 6 1 1 A 15 15 ILE HA H 15 4.882 4.770 0.112 1
1 110 . 6 1 1 A 15 15 ILE C C 15 174.962 174.923 0.039 1
1 111 . 6 1 1 A 15 15 ILE CA C 15 60.685 61.107 -0.422 1
1 112 . 6 1 1 A 15 15 ILE CB C 15 40.878 37.904 2.974 1
1 116 . 6 1 1 A 15 15 ILE N N 15 121.623 125.972 -4.349 1
1 117 . 6 1 1 A 16 16 SER H H 16 8.703 9.096 -0.393 1
1 118 . 6 1 1 A 16 16 SER HA H 16 4.922 5.017 -0.095 1
1 121 . 6 1 1 A 16 16 SER C C 16 173.860 173.134 0.726 1
1 122 . 6 1 1 A 16 16 SER CA C 16 56.524 56.633 -0.109 1
1 123 . 6 1 1 A 16 16 SER CB C 16 65.004 64.877 0.127 1
1 124 . 6 1 1 A 16 16 SER N N 16 122.261 122.597 -0.336 1
1 125 . 6 1 1 A 17 17 THR H H 17 8.759 8.759 0.000 1
1 126 . 6 1 1 A 17 17 THR HA H 17 4.885 4.825 0.060 1
1 131 . 6 1 1 A 17 17 THR C C 17 175.018 174.769 0.249 1
1 132 . 6 1 1 A 17 17 THR CA C 17 60.315 60.866 -0.551 1
1 133 . 6 1 1 A 17 17 THR CB C 17 69.799 69.610 0.189 1
1 135 . 6 1 1 A 17 17 THR N N 17 115.660 118.306 -2.646 1
1 136 . 6 1 1 A 18 18 THR H H 18 8.038 8.778 -0.740 1
1 137 . 6 1 1 A 18 18 THR HA H 18 4.596 4.400 0.196 1
1 142 . 6 1 1 A 18 18 THR CA C 18 60.707 62.342 -1.635 1
1 143 . 6 1 1 A 18 18 THR CB C 18 71.082 69.587 1.495 1
1 145 . 6 1 1 A 18 18 THR N N 18 112.362 116.016 -3.654 1
1 146 . 6 1 1 A 19 19 ALA H H 19 8.545 7.672 0.873 1
1 147 . 6 1 1 A 19 19 ALA HA H 19 4.412 4.344 0.068 1
1 151 . 6 1 1 A 19 19 ALA C C 19 177.034 177.242 -0.208 1
1 152 . 6 1 1 A 19 19 ALA CA C 19 52.264 52.040 0.224 1
1 153 . 6 1 1 A 19 19 ALA CB C 19 19.292 19.790 -0.498 1
1 154 . 6 1 1 A 19 19 ALA N N 19 119.589 123.577 -3.988 1
1 155 . 6 1 1 A 20 20 MET H H 20 8.145 8.478 -0.333 1
1 156 . 6 1 1 A 20 20 MET HA H 20 4.447 4.329 0.118 1
1 164 . 6 1 1 A 20 20 MET C C 20 175.676 176.534 -0.858 1
1 165 . 6 1 1 A 20 20 MET CA C 20 55.764 54.626 1.138 1
1 166 . 6 1 1 A 20 20 MET CB C 20 31.495 32.125 -0.630 1
1 169 . 6 1 1 A 20 20 MET N N 20 116.950 119.598 -2.648 1
1 170 . 6 1 1 A 21 21 ASN H H 21 8.275 8.977 -0.702 1
1 171 . 6 1 1 A 21 21 ASN HA H 21 4.452 4.354 0.098 1
1 176 . 6 1 1 A 21 21 ASN C C 21 174.100 173.724 0.376 1
1 177 . 6 1 1 A 21 21 ASN CA C 21 54.320 54.635 -0.315 1
1 178 . 6 1 1 A 21 21 ASN CB C 21 37.234 37.108 0.126 1
1 179 . 6 1 1 A 21 21 ASN N N 21 113.198 118.474 -5.276 1
1 181 . 6 1 1 A 22 22 THR H H 22 7.071 7.123 -0.052 1
1 182 . 6 1 1 A 22 22 THR HA H 22 5.218 5.280 -0.062 1
1 187 . 6 1 1 A 22 22 THR C C 22 173.301 173.011 0.290 1
1 188 . 6 1 1 A 22 22 THR CA C 22 59.399 60.020 -0.621 1
1 189 . 6 1 1 A 22 22 THR CB C 22 72.714 71.797 0.917 1
1 191 . 6 1 1 A 22 22 THR N N 22 107.603 108.453 -0.850 1
1 192 . 6 1 1 A 23 23 ALA H H 23 8.687 8.824 -0.137 1
1 193 . 6 1 1 A 23 23 ALA HA H 23 4.925 5.041 -0.116 1
1 197 . 6 1 1 A 23 23 ALA C C 23 174.100 175.879 -1.779 1
1 198 . 6 1 1 A 23 23 ALA CA C 23 50.812 50.056 0.756 1
1 199 . 6 1 1 A 23 23 ALA CB C 23 21.122 21.151 -0.029 1
1 200 . 6 1 1 A 23 23 ALA N N 23 121.937 126.494 -4.557 1
1 201 . 6 1 1 A 24 24 LEU H H 24 8.833 9.087 -0.254 1
1 202 . 6 1 1 A 24 24 LEU HA H 24 4.673 4.421 0.252 1
1 212 . 6 1 1 A 24 24 LEU C C 24 175.140 174.640 0.500 1
1 213 . 6 1 1 A 24 24 LEU CA C 24 54.320 55.054 -0.734 1
1 214 . 6 1 1 A 24 24 LEU CB C 24 42.518 43.047 -0.529 1
1 218 . 6 1 1 A 24 24 LEU N N 24 123.721 126.288 -2.567 1
1 219 . 6 1 1 A 25 25 LEU H H 25 9.176 8.854 0.322 1
1 220 . 6 1 1 A 25 25 LEU HA H 25 5.112 4.972 0.140 1
1 230 . 6 1 1 A 25 25 LEU C C 25 176.414 175.826 0.588 1
1 231 . 6 1 1 A 25 25 LEU CA C 25 54.108 53.091 1.017 1
1 232 . 6 1 1 A 25 25 LEU CB C 25 43.230 42.791 0.439 1
1 236 . 6 1 1 A 25 25 LEU N N 25 128.589 128.298 0.291 1
1 237 . 6 1 1 A 26 26 GLN H H 26 8.556 8.469 0.087 1
1 238 . 6 1 1 A 26 26 GLN HA H 26 4.737 4.949 -0.212 1
1 245 . 6 1 1 A 26 26 GLN C C 26 174.372 174.244 0.128 1
1 246 . 6 1 1 A 26 26 GLN CA C 26 56.365 54.438 1.927 1
1 247 . 6 1 1 A 26 26 GLN CB C 26 33.320 31.786 1.534 1
1 249 . 6 1 1 A 26 26 GLN N N 26 119.630 123.038 -3.408 1
1 251 . 6 1 1 A 27 27 TRP H H 27 8.080 8.214 -0.134 1
1 252 . 6 1 1 A 27 27 TRP HA H 27 5.441 5.839 -0.398 1
1 261 . 6 1 1 A 27 27 TRP CA C 27 55.957 54.506 1.451 1
1 262 . 6 1 1 A 27 27 TRP CB C 27 32.517 32.269 0.248 1
1 268 . 6 1 1 A 27 27 TRP N N 27 121.276 121.551 -0.275 1
1 270 . 6 1 1 A 28 28 HIS H H 28 8.262 8.679 -0.417 1
1 271 . 6 1 1 A 28 28 HIS HA H 28 4.997 5.049 -0.052 1
1 275 . 6 1 1 A 28 28 HIS CA C 28 53.028 53.919 -0.891 1
1 276 . 6 1 1 A 28 28 HIS CB C 28 32.832 32.526 0.306 1
1 278 . 6 1 1 A 28 28 HIS N N 28 116.245 116.846 -0.601 1
1 279 . 6 1 1 A 29 29 PRO HA H 29 4.984 4.686 0.298 1
1 286 . 6 1 1 A 29 29 PRO CA C 29 61.498 62.078 -0.580 1
1 287 . 6 1 1 A 29 29 PRO CB C 29 30.709 32.289 -1.580 1
1 290 . 6 1 1 A 30 30 PRO HA H 30 4.449 4.687 -0.238 1
1 297 . 6 1 1 A 30 30 PRO C C 30 175.733 176.881 -1.148 1
1 298 . 6 1 1 A 30 30 PRO CA C 30 62.245 62.553 -0.308 1
1 299 . 6 1 1 A 30 30 PRO CB C 30 32.083 33.478 -1.395 1
1 302 . 6 1 1 A 31 31 LYS H H 31 8.403 8.832 -0.429 1
1 303 . 6 1 1 A 31 31 LYS HA H 31 4.084 4.467 -0.383 1
1 312 . 6 1 1 A 31 31 LYS C C 31 177.166 177.190 -0.024 1
1 313 . 6 1 1 A 31 31 LYS CA C 31 57.866 56.815 1.051 1
1 314 . 6 1 1 A 31 31 LYS CB C 31 32.698 33.629 -0.931 1
1 318 . 6 1 1 A 31 31 LYS N N 31 121.693 119.582 2.111 1
1 319 . 6 1 1 A 32 32 GLU H H 32 8.102 7.888 0.214 1
1 320 . 6 1 1 A 32 32 GLU HA H 32 4.365 4.438 -0.073 1
1 325 . 6 1 1 A 32 32 GLU C C 32 174.248 176.514 -2.266 1
1 326 . 6 1 1 A 32 32 GLU CA C 32 55.448 56.059 -0.611 1
1 327 . 6 1 1 A 32 32 GLU CB C 32 29.405 30.437 -1.032 1
1 329 . 6 1 1 A 32 32 GLU N N 32 118.742 116.973 1.769 1
1 330 . 6 1 1 A 33 33 LEU H H 33 8.420 7.467 0.953 1
1 331 . 6 1 1 A 33 33 LEU HA H 33 4.499 4.567 -0.068 1
1 341 . 6 1 1 A 33 33 LEU C C 33 173.036 175.071 -2.035 1
1 342 . 6 1 1 A 33 33 LEU CA C 33 52.863 52.787 0.076 1
1 343 . 6 1 1 A 33 33 LEU CB C 33 42.535 42.687 -0.152 1
1 347 . 6 1 1 A 33 33 LEU N N 33 125.181 123.952 1.229 1
1 348 . 6 1 1 A 34 34 PRO HA H 34 4.488 4.438 0.050 1
1 355 . 6 1 1 A 34 34 PRO C C 34 177.544 177.009 0.535 1
1 356 . 6 1 1 A 34 34 PRO CA C 34 62.889 63.226 -0.337 1
1 357 . 6 1 1 A 34 34 PRO CB C 34 31.472 30.886 0.586 1
1 360 . 6 1 1 A 35 35 GLY H H 35 8.397 8.107 0.290 1
1 361 . 6 1 1 A 35 35 GLY HA2 H 35 4.059 4.114 -0.055 1
1 362 . 6 1 1 A 35 35 GLY HA3 H 35 3.716 4.114 -0.398 1
1 363 . 6 1 1 A 35 35 GLY C C 35 173.356 172.285 1.071 1
1 364 . 6 1 1 A 35 35 GLY CA C 35 45.892 44.884 1.008 1
1 365 . 6 1 1 A 35 35 GLY N N 35 110.524 112.281 -1.757 1
1 366 . 6 1 1 A 36 36 GLU H H 36 8.091 8.551 -0.460 1
1 367 . 6 1 1 A 36 36 GLU HA H 36 4.371 5.060 -0.689 1
1 372 . 6 1 1 A 36 36 GLU C C 36 174.864 174.269 0.595 1
1 373 . 6 1 1 A 36 36 GLU CA C 36 55.201 54.620 0.581 1
1 374 . 6 1 1 A 36 36 GLU CB C 36 31.878 33.160 -1.282 1
1 376 . 6 1 1 A 36 36 GLU N N 36 122.202 120.377 1.825 1
1 377 . 6 1 1 A 37 37 LEU H H 37 8.307 8.681 -0.374 1
1 378 . 6 1 1 A 37 37 LEU HA H 37 4.288 4.400 -0.112 1
1 388 . 6 1 1 A 37 37 LEU C C 37 176.702 175.943 0.759 1
1 389 . 6 1 1 A 37 37 LEU CA C 37 55.342 55.389 -0.047 1
1 390 . 6 1 1 A 37 37 LEU CB C 37 42.715 42.871 -0.156 1
1 394 . 6 1 1 A 37 37 LEU N N 37 123.204 123.927 -0.723 1
1 395 . 6 1 1 A 38 38 LEU H H 38 8.909 8.751 0.158 1
1 396 . 6 1 1 A 38 38 LEU HA H 38 4.640 4.719 -0.079 1
1 406 . 6 1 1 A 38 38 LEU C C 38 177.202 176.575 0.627 1
1 407 . 6 1 1 A 38 38 LEU CA C 38 54.390 54.905 -0.515 1
1 408 . 6 1 1 A 38 38 LEU CB C 38 43.770 43.469 0.301 1
1 412 . 6 1 1 A 38 38 LEU N N 38 123.021 127.234 -4.213 1
1 413 . 6 1 1 A 39 39 GLY H H 39 7.113 6.945 0.168 1
1 414 . 6 1 1 A 39 39 GLY HA2 H 39 4.816 3.583 1.233 1
1 415 . 6 1 1 A 39 39 GLY HA3 H 39 3.276 3.931 -0.655 1
1 416 . 6 1 1 A 39 39 GLY C C 39 169.863 170.317 -0.454 1
1 417 . 6 1 1 A 39 39 GLY CA C 39 44.622 45.364 -0.742 1
1 418 . 6 1 1 A 39 39 GLY N N 39 104.137 104.380 -0.243 1
1 419 . 6 1 1 A 40 40 TYR H H 40 8.318 8.914 -0.596 1
1 420 . 6 1 1 A 40 40 TYR HA H 40 5.414 5.096 0.318 1
1 425 . 6 1 1 A 40 40 TYR C C 40 174.448 172.139 2.309 1
1 426 . 6 1 1 A 40 40 TYR CA C 40 56.178 56.556 -0.378 1
1 427 . 6 1 1 A 40 40 TYR CB C 40 44.191 40.649 3.542 1
1 430 . 6 1 1 A 40 40 TYR N N 40 114.036 115.591 -1.555 1
1 431 . 6 1 1 A 41 41 ARG H H 41 9.347 8.782 0.565 1
1 432 . 6 1 1 A 41 41 ARG HA H 41 5.092 5.434 -0.342 1
1 440 . 6 1 1 A 41 41 ARG C C 41 174.097 174.108 -0.011 1
1 441 . 6 1 1 A 41 41 ARG CA C 41 56.100 54.327 1.773 1
1 442 . 6 1 1 A 41 41 ARG CB C 41 34.508 33.139 1.369 1
1 445 . 6 1 1 A 41 41 ARG N N 41 122.231 121.119 1.112 1
1 447 . 6 1 1 A 42 42 LEU H H 42 9.546 9.174 0.372 1
1 448 . 6 1 1 A 42 42 LEU HA H 42 5.459 5.310 0.149 1
1 458 . 6 1 1 A 42 42 LEU C C 42 174.913 174.684 0.229 1
1 459 . 6 1 1 A 42 42 LEU CA C 42 52.997 53.371 -0.374 1
1 460 . 6 1 1 A 42 42 LEU CB C 42 46.413 45.714 0.699 1
1 464 . 6 1 1 A 42 42 LEU N N 42 132.335 127.587 4.748 1
1 465 . 6 1 1 A 43 43 GLN H H 43 9.502 9.296 0.206 1
1 466 . 6 1 1 A 43 43 GLN HA H 43 5.847 5.240 0.607 1
1 473 . 6 1 1 A 43 43 GLN C C 43 175.329 174.038 1.291 1
1 474 . 6 1 1 A 43 43 GLN CA C 43 54.005 54.443 -0.438 1
1 475 . 6 1 1 A 43 43 GLN CB C 43 33.429 32.129 1.300 1
1 477 . 6 1 1 A 43 43 GLN N N 43 123.932 125.379 -1.447 1
1 479 . 6 1 1 A 44 44 TYR H H 44 8.615 8.482 0.133 1
1 480 . 6 1 1 A 44 44 TYR HA H 44 5.783 5.711 0.072 1
1 487 . 6 1 1 A 44 44 TYR C C 44 174.058 173.536 0.522 1
1 488 . 6 1 1 A 44 44 TYR CA C 44 55.942 56.341 -0.399 1
1 489 . 6 1 1 A 44 44 TYR CB C 44 43.052 41.430 1.622 1
1 494 . 6 1 1 A 44 44 TYR N N 44 117.355 119.504 -2.149 1
1 495 . 6 1 1 A 45 45 CYS H H 45 8.377 8.198 0.179 1
1 496 . 6 1 1 A 45 45 CYS HA H 45 4.772 5.105 -0.333 1
1 499 . 6 1 1 A 45 45 CYS C C 45 173.205 173.796 -0.591 1
1 500 . 6 1 1 A 45 45 CYS CA C 45 55.960 56.842 -0.882 1
1 501 . 6 1 1 A 45 45 CYS CB C 45 30.665 31.348 -0.683 1
1 502 . 6 1 1 A 45 45 CYS N N 45 115.140 118.500 -3.360 1
1 503 . 6 1 1 A 46 46 ARG H H 46 9.165 8.615 0.550 1
1 504 . 6 1 1 A 46 46 ARG HA H 46 4.068 3.631 0.437 1
1 511 . 6 1 1 A 46 46 ARG C C 46 178.440 177.470 0.970 1
1 512 . 6 1 1 A 46 46 ARG CA C 46 56.401 55.410 0.991 1
1 513 . 6 1 1 A 46 46 ARG CB C 46 31.878 30.798 1.080 1
1 516 . 6 1 1 A 46 46 ARG N N 46 121.803 121.004 0.799 1
1 517 . 6 1 1 A 47 47 ALA H H 47 8.273 8.356 -0.083 1
1 518 . 6 1 1 A 47 47 ALA HA H 47 3.891 4.126 -0.235 1
1 522 . 6 1 1 A 47 47 ALA C C 47 177.599 177.079 0.520 1
1 523 . 6 1 1 A 47 47 ALA CA C 47 54.796 53.296 1.500 1
1 524 . 6 1 1 A 47 47 ALA CB C 47 18.287 18.505 -0.218 1
1 525 . 6 1 1 A 47 47 ALA N N 47 123.895 123.725 0.170 1
1 526 . 6 1 1 A 48 48 ASP H H 48 8.036 7.893 0.143 1
1 527 . 6 1 1 A 48 48 ASP HA H 48 4.453 4.831 -0.378 1
1 530 . 6 1 1 A 48 48 ASP C C 48 175.836 175.260 0.576 1
1 531 . 6 1 1 A 48 48 ASP CA C 48 53.368 53.791 -0.423 1
1 532 . 6 1 1 A 48 48 ASP CB C 48 39.964 42.530 -2.566 1
1 533 . 6 1 1 A 48 48 ASP N N 48 112.576 117.588 -5.012 1
1 534 . 6 1 1 A 49 49 GLU H H 49 7.495 7.478 0.017 1
1 535 . 6 1 1 A 49 49 GLU HA H 49 4.308 4.576 -0.268 1
1 540 . 6 1 1 A 49 49 GLU C C 49 175.756 175.673 0.083 1
1 541 . 6 1 1 A 49 49 GLU CA C 49 56.224 54.950 1.274 1
1 542 . 6 1 1 A 49 49 GLU CB C 49 32.248 31.229 1.019 1
1 544 . 6 1 1 A 49 49 GLU N N 49 120.609 118.563 2.046 1
1 545 . 6 1 1 A 50 50 ALA H H 50 8.416 8.547 -0.131 1
1 546 . 6 1 1 A 50 50 ALA HA H 50 4.200 4.485 -0.285 1
1 550 . 6 1 1 A 50 50 ALA C C 50 177.433 177.080 0.353 1
1 551 . 6 1 1 A 50 50 ALA CA C 50 53.297 52.533 0.764 1
1 552 . 6 1 1 A 50 50 ALA CB C 50 19.474 20.694 -1.220 1
1 553 . 6 1 1 A 50 50 ALA N N 50 124.065 124.259 -0.194 1
1 554 . 6 1 1 A 51 51 ARG H H 51 7.648 7.657 -0.009 1
1 555 . 6 1 1 A 51 51 ARG HA H 51 4.747 4.764 -0.017 1
1 562 . 6 1 1 A 51 51 ARG C C 51 173.400 174.438 -1.038 1
1 563 . 6 1 1 A 51 51 ARG CA C 51 52.592 53.725 -1.133 1
1 564 . 6 1 1 A 51 51 ARG CB C 51 31.212 32.112 -0.900 1
1 567 . 6 1 1 A 51 51 ARG N N 51 117.798 116.132 1.666 1
1 568 . 6 1 1 A 52 52 PRO HA H 52 4.212 4.444 -0.232 1
1 575 . 6 1 1 A 52 52 PRO C C 52 176.380 175.885 0.495 1
1 576 . 6 1 1 A 52 52 PRO CA C 52 62.360 62.565 -0.205 1
1 577 . 6 1 1 A 52 52 PRO CB C 52 32.331 32.254 0.077 1
1 580 . 6 1 1 A 53 53 ASN H H 53 8.127 7.855 0.272 1
1 581 . 6 1 1 A 53 53 ASN HA H 53 4.651 4.809 -0.158 1
1 586 . 6 1 1 A 53 53 ASN C C 53 174.354 174.259 0.095 1
1 587 . 6 1 1 A 53 53 ASN CA C 53 53.136 52.423 0.713 1
1 588 . 6 1 1 A 53 53 ASN CB C 53 39.666 38.416 1.250 1
1 589 . 6 1 1 A 53 53 ASN N N 53 119.405 119.754 -0.349 1
1 591 . 6 1 1 A 54 54 THR H H 54 8.425 8.605 -0.180 1
1 592 . 6 1 1 A 54 54 THR HA H 54 5.306 4.369 0.937 1
1 597 . 6 1 1 A 54 54 THR C C 54 173.850 174.148 -0.298 1
1 598 . 6 1 1 A 54 54 THR CA C 54 61.881 63.724 -1.843 1
1 599 . 6 1 1 A 54 54 THR CB C 54 70.573 68.849 1.724 1
1 601 . 6 1 1 A 54 54 THR N N 54 118.968 121.329 -2.361 1
1 602 . 6 1 1 A 55 55 ILE H H 55 9.354 8.778 0.576 1
1 603 . 6 1 1 A 55 55 ILE HA H 55 4.051 4.631 -0.580 1
1 613 . 6 1 1 A 55 55 ILE C C 55 172.975 173.510 -0.535 1
1 614 . 6 1 1 A 55 55 ILE CA C 55 61.003 59.652 1.351 1
1 615 . 6 1 1 A 55 55 ILE CB C 55 41.619 42.016 -0.397 1
1 619 . 6 1 1 A 55 55 ILE N N 55 127.961 126.581 1.380 1
1 620 . 6 1 1 A 56 56 ASP H H 56 8.132 8.711 -0.579 1
1 621 . 6 1 1 A 56 56 ASP HA H 56 5.334 5.304 0.030 1
1 624 . 6 1 1 A 56 56 ASP C C 56 174.969 174.659 0.310 1
1 625 . 6 1 1 A 56 56 ASP CA C 56 53.702 52.806 0.896 1
1 626 . 6 1 1 A 56 56 ASP CB C 56 43.251 43.021 0.230 1
1 627 . 6 1 1 A 56 56 ASP N N 56 125.882 126.996 -1.114 1
1 628 . 6 1 1 A 57 57 PHE H H 57 8.955 8.796 0.159 1
1 629 . 6 1 1 A 57 57 PHE HA H 57 4.915 5.039 -0.124 1
1 637 . 6 1 1 A 57 57 PHE C C 57 177.361 175.564 1.797 1
1 638 . 6 1 1 A 57 57 PHE CA C 57 57.458 56.484 0.974 1
1 639 . 6 1 1 A 57 57 PHE CB C 57 43.737 43.202 0.535 1
1 645 . 6 1 1 A 57 57 PHE N N 57 118.872 122.748 -3.876 1
1 646 . 6 1 1 A 58 58 GLY H H 58 9.552 9.002 0.550 1
1 647 . 6 1 1 A 58 58 GLY HA2 H 58 4.662 4.077 0.585 1
1 648 . 6 1 1 A 58 58 GLY HA3 H 58 4.126 4.137 -0.011 1
1 649 . 6 1 1 A 58 58 GLY C C 58 174.760 175.051 -0.291 1
1 650 . 6 1 1 A 58 58 GLY CA C 58 44.680 45.353 -0.673 1
1 651 . 6 1 1 A 58 58 GLY N N 58 111.551 110.796 0.755 1
1 652 . 6 1 1 A 59 59 LYS H H 59 8.211 8.696 -0.485 1
1 653 . 6 1 1 A 59 59 LYS HA H 59 3.782 3.635 0.147 1
1 662 . 6 1 1 A 59 59 LYS C C 59 176.154 178.091 -1.937 1
1 663 . 6 1 1 A 59 59 LYS CA C 59 59.080 58.369 0.711 1
1 664 . 6 1 1 A 59 59 LYS CB C 59 32.516 31.910 0.606 1
1 668 . 6 1 1 A 59 59 LYS N N 59 115.953 120.491 -4.538 1
1 669 . 6 1 1 A 60 60 ASP H H 60 8.634 7.935 0.699 1
1 670 . 6 1 1 A 60 60 ASP HA H 60 4.882 4.584 0.298 1
1 673 . 6 1 1 A 60 60 ASP C C 60 176.039 176.985 -0.946 1
1 674 . 6 1 1 A 60 60 ASP CA C 60 54.327 56.352 -2.025 1
1 675 . 6 1 1 A 60 60 ASP CB C 60 41.461 41.153 0.308 1
1 676 . 6 1 1 A 60 60 ASP N N 60 117.261 118.312 -1.051 1
1 677 . 6 1 1 A 61 61 ASP H H 61 7.500 8.139 -0.639 1
1 678 . 6 1 1 A 61 61 ASP HA H 61 4.591 4.656 -0.065 1
1 681 . 6 1 1 A 61 61 ASP C C 61 175.140 175.915 -0.775 1
1 682 . 6 1 1 A 61 61 ASP CA C 61 55.342 54.085 1.257 1
1 683 . 6 1 1 A 61 61 ASP CB C 61 42.475 40.298 2.177 1
1 684 . 6 1 1 A 61 61 ASP N N 61 122.319 119.030 3.289 1
1 685 . 6 1 1 A 62 62 GLN H H 62 8.239 7.953 0.286 1
1 686 . 6 1 1 A 62 62 GLN HA H 62 2.569 3.606 -1.037 1
1 693 . 6 1 1 A 62 62 GLN C C 62 172.652 173.388 -0.736 1
1 694 . 6 1 1 A 62 62 GLN CA C 62 54.038 55.393 -1.355 1
1 695 . 6 1 1 A 62 62 GLN CB C 62 31.481 29.138 2.343 1
1 697 . 6 1 1 A 62 62 GLN N N 62 117.458 123.409 -5.951 1
1 699 . 6 1 1 A 63 63 HIS H H 63 6.338 6.744 -0.406 1
1 700 . 6 1 1 A 63 63 HIS HA H 63 4.423 4.424 -0.001 1
1 704 . 6 1 1 A 63 63 HIS C C 63 173.031 172.699 0.332 1
1 705 . 6 1 1 A 63 63 HIS CA C 63 54.743 54.019 0.724 1
1 706 . 6 1 1 A 63 63 HIS CB C 63 32.661 31.119 1.542 1
1 708 . 6 1 1 A 63 63 HIS N N 63 113.589 115.773 -2.184 1
1 709 . 6 1 1 A 64 64 PHE H H 64 8.549 9.004 -0.455 1
1 710 . 6 1 1 A 64 64 PHE HA H 64 4.578 5.091 -0.513 1
1 718 . 6 1 1 A 64 64 PHE C C 64 173.015 173.768 -0.753 1
1 719 . 6 1 1 A 64 64 PHE CA C 64 58.516 57.361 1.155 1
1 720 . 6 1 1 A 64 64 PHE CB C 64 43.525 43.023 0.502 1
1 726 . 6 1 1 A 64 64 PHE N N 64 118.214 119.885 -1.671 1
1 727 . 6 1 1 A 65 65 THR H H 65 7.150 7.973 -0.823 1
1 728 . 6 1 1 A 65 65 THR HA H 65 4.930 4.674 0.256 1
1 733 . 6 1 1 A 65 65 THR C C 65 172.457 173.639 -1.182 1
1 734 . 6 1 1 A 65 65 THR CA C 65 61.690 61.669 0.021 1
1 735 . 6 1 1 A 65 65 THR CB C 65 69.593 69.341 0.252 1
1 737 . 6 1 1 A 65 65 THR N N 65 123.198 120.528 2.670 1
1 738 . 6 1 1 A 66 66 VAL H H 66 8.888 8.430 0.458 1
1 739 . 6 1 1 A 66 66 VAL HA H 66 4.018 4.836 -0.818 1
1 747 . 6 1 1 A 66 66 VAL C C 66 174.868 175.298 -0.430 1
1 748 . 6 1 1 A 66 66 VAL CA C 66 61.178 60.525 0.653 1
1 749 . 6 1 1 A 66 66 VAL CB C 66 33.114 33.590 -0.476 1
1 752 . 6 1 1 A 66 66 VAL N N 66 126.840 127.583 -0.743 1
1 753 . 6 1 1 A 67 67 THR H H 67 8.174 8.570 -0.396 1
1 754 . 6 1 1 A 67 67 THR HA H 67 4.816 4.999 -0.183 1
1 759 . 6 1 1 A 67 67 THR C C 67 174.494 174.201 0.293 1
1 760 . 6 1 1 A 67 67 THR CA C 67 59.786 59.552 0.234 1
1 761 . 6 1 1 A 67 67 THR CB C 67 70.887 71.709 -0.822 1
1 763 . 6 1 1 A 67 67 THR N N 67 116.127 116.945 -0.818 1
1 764 . 6 1 1 A 68 68 GLY H H 68 8.570 8.529 0.041 1
1 765 . 6 1 1 A 68 68 GLY HA2 H 68 3.970 4.020 -0.050 1
1 766 . 6 1 1 A 68 68 GLY HA3 H 68 3.819 4.028 -0.209 1
1 767 . 6 1 1 A 68 68 GLY C C 68 175.636 174.863 0.773 1
1 768 . 6 1 1 A 68 68 GLY CA C 68 46.397 45.050 1.347 1
1 769 . 6 1 1 A 68 68 GLY N N 68 107.146 113.203 -6.057 1
1 770 . 6 1 1 A 69 69 LEU H H 69 8.007 7.632 0.375 1
1 771 . 6 1 1 A 69 69 LEU HA H 69 4.154 4.267 -0.113 1
1 781 . 6 1 1 A 69 69 LEU C C 69 176.830 176.318 0.512 1
1 782 . 6 1 1 A 69 69 LEU CA C 69 54.602 54.820 -0.218 1
1 783 . 6 1 1 A 69 69 LEU CB C 69 41.149 41.913 -0.764 1
1 787 . 6 1 1 A 69 69 LEU N N 69 118.433 122.566 -4.133 1
1 788 . 6 1 1 A 70 70 HIS H H 70 8.866 8.784 0.082 1
1 789 . 6 1 1 A 70 70 HIS HA H 70 4.663 4.695 -0.032 1
1 793 . 6 1 1 A 70 70 HIS C C 70 176.667 175.481 1.186 1
1 794 . 6 1 1 A 70 70 HIS CA C 70 55.464 57.017 -1.553 1
1 795 . 6 1 1 A 70 70 HIS CB C 70 32.125 30.232 1.893 1
1 797 . 6 1 1 A 70 70 HIS N N 70 122.457 123.301 -0.844 1
1 798 . 6 1 1 A 71 71 LYS H H 71 8.716 8.804 -0.088 1
1 799 . 6 1 1 A 71 71 LYS HA H 71 4.320 4.281 0.039 1
1 808 . 6 1 1 A 71 71 LYS C C 71 178.110 177.649 0.461 1
1 809 . 6 1 1 A 71 71 LYS CA C 71 57.035 58.297 -1.262 1
1 810 . 6 1 1 A 71 71 LYS CB C 71 33.580 32.763 0.817 1
1 814 . 6 1 1 A 71 71 LYS N N 71 123.173 123.010 0.163 1
1 815 . 6 1 1 A 72 72 GLY H H 72 7.709 8.774 -1.065 1
1 816 . 6 1 1 A 72 72 GLY HA2 H 72 3.800 3.915 -0.115 1
1 817 . 6 1 1 A 72 72 GLY HA3 H 72 3.769 3.921 -0.152 1
1 818 . 6 1 1 A 72 72 GLY C C 72 174.231 173.937 0.294 1
1 819 . 6 1 1 A 72 72 GLY CA C 72 47.866 46.433 1.433 1
1 820 . 6 1 1 A 72 72 GLY N N 72 114.881 111.992 2.889 1
1 821 . 6 1 1 A 73 73 THR H H 73 8.162 7.536 0.626 1
1 822 . 6 1 1 A 73 73 THR HA H 73 4.584 4.775 -0.191 1
1 827 . 6 1 1 A 73 73 THR C C 73 172.208 173.333 -1.125 1
1 828 . 6 1 1 A 73 73 THR CA C 73 62.307 61.372 0.935 1
1 829 . 6 1 1 A 73 73 THR CB C 73 72.123 71.824 0.299 1
1 831 . 6 1 1 A 73 73 THR N N 73 114.225 114.472 -0.247 1
1 832 . 6 1 1 A 74 74 THR H H 74 8.743 8.812 -0.069 1
1 833 . 6 1 1 A 74 74 THR HA H 74 5.138 5.032 0.106 1
1 838 . 6 1 1 A 74 74 THR C C 74 173.376 173.162 0.214 1
1 839 . 6 1 1 A 74 74 THR CA C 74 62.724 62.606 0.118 1
1 840 . 6 1 1 A 74 74 THR CB C 74 69.202 69.791 -0.589 1
1 842 . 6 1 1 A 74 74 THR N N 74 123.376 121.708 1.668 1
1 843 . 6 1 1 A 75 75 TYR H H 75 9.549 9.232 0.317 1
1 844 . 6 1 1 A 75 75 TYR HA H 75 4.892 5.237 -0.345 1
1 851 . 6 1 1 A 75 75 TYR C C 75 173.991 175.435 -1.444 1
1 852 . 6 1 1 A 75 75 TYR CA C 75 57.740 56.074 1.666 1
1 853 . 6 1 1 A 75 75 TYR CB C 75 44.580 42.942 1.638 1
1 858 . 6 1 1 A 75 75 TYR N N 75 126.916 125.149 1.767 1
1 859 . 6 1 1 A 76 76 ILE H H 76 8.769 8.872 -0.103 1
1 860 . 6 1 1 A 76 76 ILE HA H 76 4.663 4.841 -0.178 1
1 870 . 6 1 1 A 76 76 ILE C C 76 174.683 175.177 -0.494 1
1 871 . 6 1 1 A 76 76 ILE CA C 76 60.455 60.695 -0.240 1
1 872 . 6 1 1 A 76 76 ILE CB C 76 40.284 39.919 0.365 1
1 876 . 6 1 1 A 76 76 ILE N N 76 119.407 120.755 -1.348 1
1 877 . 6 1 1 A 77 77 PHE H H 77 8.894 9.073 -0.179 1
1 878 . 6 1 1 A 77 77 PHE HA H 77 5.160 5.090 0.070 1
1 886 . 6 1 1 A 77 77 PHE C C 77 174.794 175.659 -0.865 1
1 887 . 6 1 1 A 77 77 PHE CA C 77 56.831 57.548 -0.717 1
1 888 . 6 1 1 A 77 77 PHE CB C 77 43.132 40.691 2.441 1
1 894 . 6 1 1 A 77 77 PHE N N 77 124.622 127.404 -2.782 1
1 895 . 6 1 1 A 78 78 ARG H H 78 9.407 9.268 0.139 1
1 896 . 6 1 1 A 78 78 ARG HA H 78 5.689 5.791 -0.102 1
1 904 . 6 1 1 A 78 78 ARG C C 78 174.376 174.599 -0.223 1
1 905 . 6 1 1 A 78 78 ARG CA C 78 54.530 54.731 -0.201 1
1 906 . 6 1 1 A 78 78 ARG CB C 78 34.473 34.051 0.422 1
1 909 . 6 1 1 A 78 78 ARG N N 78 120.055 121.390 -1.335 1
1 911 . 6 1 1 A 79 79 LEU H H 79 9.132 8.643 0.489 1
1 912 . 6 1 1 A 79 79 LEU HA H 79 5.398 5.003 0.395 1
1 922 . 6 1 1 A 79 79 LEU C C 79 174.006 174.228 -0.222 1
1 923 . 6 1 1 A 79 79 LEU CA C 79 53.401 53.328 0.073 1
1 924 . 6 1 1 A 79 79 LEU CB C 79 48.116 46.607 1.509 1
1 928 . 6 1 1 A 79 79 LEU N N 79 124.907 124.074 0.833 1
1 929 . 6 1 1 A 80 80 ALA H H 80 8.737 7.999 0.738 1
1 930 . 6 1 1 A 80 80 ALA HA H 80 4.871 5.030 -0.159 1
1 934 . 6 1 1 A 80 80 ALA C C 80 176.057 175.746 0.311 1
1 935 . 6 1 1 A 80 80 ALA CA C 80 50.353 51.191 -0.838 1
1 936 . 6 1 1 A 80 80 ALA CB C 80 23.972 23.164 0.808 1
1 937 . 6 1 1 A 80 80 ALA N N 80 128.220 125.813 2.407 1
1 938 . 6 1 1 A 81 81 ALA H H 81 9.890 8.633 1.257 1
1 939 . 6 1 1 A 81 81 ALA HA H 81 4.794 5.023 -0.229 1
1 943 . 6 1 1 A 81 81 ALA C C 81 174.655 176.312 -1.657 1
1 944 . 6 1 1 A 81 81 ALA CA C 81 50.300 51.152 -0.852 1
1 945 . 6 1 1 A 81 81 ALA CB C 81 21.369 20.601 0.768 1
1 946 . 6 1 1 A 81 81 ALA N N 81 123.682 123.628 0.054 1
1 947 . 6 1 1 A 82 82 LYS H H 82 7.965 8.777 -0.812 1
1 948 . 6 1 1 A 82 82 LYS HA H 82 4.974 5.112 -0.138 1
1 957 . 6 1 1 A 82 82 LYS C C 82 175.671 175.184 0.487 1
1 958 . 6 1 1 A 82 82 LYS CA C 82 54.664 54.701 -0.037 1
1 959 . 6 1 1 A 82 82 LYS CB C 82 36.677 35.423 1.254 1
1 963 . 6 1 1 A 82 82 LYS N N 82 118.164 122.261 -4.097 1
1 964 . 6 1 1 A 83 83 ASN H H 83 8.663 8.786 -0.123 1
1 965 . 6 1 1 A 83 83 ASN HA H 83 5.113 5.106 0.007 1
1 970 . 6 1 1 A 83 83 ASN C C 83 176.582 176.091 0.491 1
1 971 . 6 1 1 A 83 83 ASN CA C 83 51.746 50.732 1.014 1
1 972 . 6 1 1 A 83 83 ASN CB C 83 40.357 40.172 0.185 1
1 973 . 6 1 1 A 83 83 ASN N N 83 124.784 124.309 0.475 1
1 975 . 6 1 1 A 84 84 ARG H H 84 8.873 8.921 -0.048 1
1 976 . 6 1 1 A 84 84 ARG HA H 84 3.940 3.933 0.007 1
1 983 . 6 1 1 A 84 84 ARG C C 84 176.735 177.615 -0.880 1
1 984 . 6 1 1 A 84 84 ARG CA C 84 59.327 59.788 -0.461 1
1 985 . 6 1 1 A 84 84 ARG CB C 84 29.282 29.813 -0.531 1
1 988 . 6 1 1 A 84 84 ARG N N 84 117.891 119.793 -1.902 1
1 989 . 6 1 1 A 85 85 ALA H H 85 7.645 7.812 -0.167 1
1 990 . 6 1 1 A 85 85 ALA HA H 85 4.276 4.167 0.109 1
1 994 . 6 1 1 A 85 85 ALA C C 85 177.479 177.320 0.159 1
1 995 . 6 1 1 A 85 85 ALA CA C 85 52.818 53.094 -0.276 1
1 996 . 6 1 1 A 85 85 ALA CB C 85 18.806 19.455 -0.649 1
1 997 . 6 1 1 A 85 85 ALA N N 85 120.306 119.831 0.475 1
1 998 . 6 1 1 A 86 86 GLY H H 86 7.693 7.546 0.147 1
1 999 . 6 1 1 A 86 86 GLY HA2 H 86 4.456 4.085 0.371 1
1 1000 . 6 1 1 A 86 86 GLY HA3 H 86 3.649 4.087 -0.438 1
1 1001 . 6 1 1 A 86 86 GLY C C 86 172.068 172.553 -0.485 1
1 1002 . 6 1 1 A 86 86 GLY CA C 86 44.375 44.027 0.348 1
1 1003 . 6 1 1 A 86 86 GLY N N 86 106.594 103.793 2.801 1
1 1004 . 6 1 1 A 87 87 LEU H H 87 8.203 8.456 -0.253 1
1 1005 . 6 1 1 A 87 87 LEU HA H 87 4.629 4.550 0.079 1
1 1015 . 6 1 1 A 87 87 LEU C C 87 179.155 176.485 2.670 1
1 1016 . 6 1 1 A 87 87 LEU CA C 87 54.814 55.305 -0.491 1
1 1017 . 6 1 1 A 87 87 LEU CB C 87 43.454 42.541 0.913 1
1 1021 . 6 1 1 A 87 87 LEU N N 87 120.879 122.443 -1.564 1
1 1022 . 6 1 1 A 88 88 GLY H H 88 8.492 8.293 0.199 1
1 1023 . 6 1 1 A 88 88 GLY HA2 H 88 4.339 4.188 0.151 1
1 1024 . 6 1 1 A 88 88 GLY HA3 H 88 4.122 4.195 -0.073 1
1 1025 . 6 1 1 A 88 88 GLY C C 88 173.030 173.312 -0.282 1
1 1026 . 6 1 1 A 88 88 GLY CA C 88 43.970 44.656 -0.686 1
1 1027 . 6 1 1 A 88 88 GLY N N 88 109.903 109.458 0.445 1
1 1028 . 6 1 1 A 89 89 GLU H H 89 7.638 8.935 -1.297 1
1 1029 . 6 1 1 A 89 89 GLU HA H 89 4.103 4.273 -0.170 1
1 1034 . 6 1 1 A 89 89 GLU C C 89 177.511 175.703 1.808 1
1 1035 . 6 1 1 A 89 89 GLU CA C 89 56.659 57.205 -0.546 1
1 1036 . 6 1 1 A 89 89 GLU CB C 89 31.324 30.723 0.601 1
1 1038 . 6 1 1 A 89 89 GLU N N 89 117.551 121.746 -4.195 1
1 1039 . 6 1 1 A 90 90 GLU H H 90 8.734 8.956 -0.222 1
1 1040 . 6 1 1 A 90 90 GLU HA H 90 4.651 5.365 -0.714 1
1 1045 . 6 1 1 A 90 90 GLU C C 90 177.452 174.408 3.044 1
1 1046 . 6 1 1 A 90 90 GLU CA C 90 55.987 54.567 1.420 1
1 1047 . 6 1 1 A 90 90 GLU CB C 90 31.135 33.315 -2.180 1
1 1049 . 6 1 1 A 90 90 GLU N N 90 121.553 118.274 3.279 1
1 1050 . 6 1 1 A 91 91 PHE H H 91 9.411 9.070 0.341 1
1 1051 . 6 1 1 A 91 91 PHE HA H 91 4.665 5.056 -0.391 1
1 1059 . 6 1 1 A 91 91 PHE C C 91 173.944 174.341 -0.397 1
1 1060 . 6 1 1 A 91 91 PHE CA C 91 57.687 57.710 -0.023 1
1 1061 . 6 1 1 A 91 91 PHE CB C 91 40.890 41.864 -0.974 1
1 1067 . 6 1 1 A 91 91 PHE N N 91 125.459 125.029 0.430 1
1 1068 . 6 1 1 A 92 92 GLU H H 92 8.043 8.296 -0.253 1
1 1069 . 6 1 1 A 92 92 GLU HA H 92 5.424 5.314 0.110 1
1 1074 . 6 1 1 A 92 92 GLU C C 92 174.295 174.582 -0.287 1
1 1075 . 6 1 1 A 92 92 GLU CA C 92 54.378 54.799 -0.421 1
1 1076 . 6 1 1 A 92 92 GLU CB C 92 33.662 33.326 0.336 1
1 1078 . 6 1 1 A 92 92 GLU N N 92 128.905 127.276 1.629 1
1 1079 . 6 1 1 A 93 93 LYS H H 93 9.142 8.762 0.380 1
1 1080 . 6 1 1 A 93 93 LYS HA H 93 4.541 5.206 -0.665 1
1 1089 . 6 1 1 A 93 93 LYS C C 93 173.366 173.907 -0.541 1
1 1090 . 6 1 1 A 93 93 LYS CA C 93 55.343 55.503 -0.160 1
1 1091 . 6 1 1 A 93 93 LYS CB C 93 37.317 36.149 1.168 1
1 1095 . 6 1 1 A 93 93 LYS N N 93 125.231 127.103 -1.872 1
1 1096 . 6 1 1 A 94 94 GLU H H 94 8.655 9.213 -0.558 1
1 1097 . 6 1 1 A 94 94 GLU HA H 94 5.558 5.383 0.175 1
1 1102 . 6 1 1 A 94 94 GLU C C 94 176.238 175.640 0.598 1
1 1103 . 6 1 1 A 94 94 GLU CA C 94 54.632 55.246 -0.614 1
1 1104 . 6 1 1 A 94 94 GLU CB C 94 32.166 32.995 -0.829 1
1 1106 . 6 1 1 A 94 94 GLU N N 94 127.232 128.195 -0.963 1
1 1107 . 6 1 1 A 95 95 ILE H H 95 9.302 8.833 0.469 1
1 1108 . 6 1 1 A 95 95 ILE HA H 95 4.794 5.275 -0.481 1
1 1118 . 6 1 1 A 95 95 ILE C C 95 173.138 174.468 -1.330 1
1 1119 . 6 1 1 A 95 95 ILE CA C 95 58.570 58.435 0.135 1
1 1120 . 6 1 1 A 95 95 ILE CB C 95 42.420 42.771 -0.351 1
1 1124 . 6 1 1 A 95 95 ILE N N 95 120.711 121.075 -0.364 1
1 1125 . 6 1 1 A 96 96 ARG H H 96 8.589 8.746 -0.157 1
1 1126 . 6 1 1 A 96 96 ARG HA H 96 5.373 4.862 0.511 1
1 1133 . 6 1 1 A 96 96 ARG C C 96 177.147 174.863 2.284 1
1 1134 . 6 1 1 A 96 96 ARG CA C 96 54.045 55.276 -1.231 1
1 1135 . 6 1 1 A 96 96 ARG CB C 96 32.001 33.834 -1.833 1
1 1138 . 6 1 1 A 96 96 ARG N N 96 124.445 121.800 2.645 1
1 1139 . 6 1 1 A 97 97 THR H H 97 9.243 8.525 0.718 1
1 1140 . 6 1 1 A 97 97 THR HA H 97 4.459 4.594 -0.135 1
1 1145 . 6 1 1 A 97 97 THR C C 97 172.745 173.894 -1.149 1
1 1146 . 6 1 1 A 97 97 THR CA C 97 59.637 60.712 -1.075 1
1 1147 . 6 1 1 A 97 97 THR CB C 97 67.687 69.016 -1.329 1
1 1149 . 6 1 1 A 97 97 THR N N 97 119.370 118.599 0.771 1
1 1150 . 6 1 1 A 98 98 PRO HA H 98 4.494 4.663 -0.169 1
1 1157 . 6 1 1 A 98 98 PRO CA C 98 63.117 62.746 0.371 1
1 1158 . 6 1 1 A 98 98 PRO CB C 98 32.500 31.710 0.790 1
1 1161 . 6 1 1 A 99 99 GLU H H 99 8.534 8.276 0.258 1
1 1162 . 6 1 1 A 99 99 GLU HA H 99 4.195 4.433 -0.238 1
1 1167 . 6 1 1 A 99 99 GLU C C 99 175.881 176.200 -0.319 1
1 1168 . 6 1 1 A 99 99 GLU CA C 99 56.330 56.732 -0.402 1
1 1169 . 6 1 1 A 99 99 GLU CB C 99 31.062 30.683 0.379 1
1 1171 . 6 1 1 A 99 99 GLU N N 99 119.688 122.260 -2.572 1
1 1172 . 6 1 1 A 100 100 ASP H H 100 8.536 8.604 -0.068 1
1 1173 . 6 1 1 A 100 100 ASP HA H 100 4.607 4.984 -0.377 1
1 1176 . 6 1 1 A 100 100 ASP C C 100 176.012 175.826 0.186 1
1 1177 . 6 1 1 A 100 100 ASP CA C 100 54.109 53.749 0.360 1
1 1178 . 6 1 1 A 100 100 ASP CB C 100 41.562 42.324 -0.762 1
1 1179 . 6 1 1 A 100 100 ASP N N 100 119.803 122.340 -2.537 1
1 1180 . 6 1 1 A 101 101 LEU H H 101 8.403 8.502 -0.099 1
1 1181 . 6 1 1 A 101 101 LEU HA H 101 4.426 4.879 -0.453 1
1 1191 . 6 1 1 A 101 101 LEU C C 101 177.534 176.327 1.207 1
1 1192 . 6 1 1 A 101 101 LEU CA C 101 55.113 53.332 1.781 1
1 1193 . 6 1 1 A 101 101 LEU CB C 101 42.156 43.232 -1.076 1
1 1197 . 6 1 1 A 101 101 LEU N N 101 123.876 121.864 2.012 1
1 1198 . 6 1 1 A 102 102 SER H H 102 8.413 8.717 -0.304 1
1 1199 . 6 1 1 A 102 102 SER HA H 102 4.434 5.310 -0.876 1
1 1202 . 6 1 1 A 102 102 SER C C 102 174.674 173.050 1.624 1
1 1203 . 6 1 1 A 102 102 SER CA C 102 58.798 57.503 1.295 1
1 1204 . 6 1 1 A 102 102 SER CB C 102 63.854 65.890 -2.036 1
1 1205 . 6 1 1 A 102 102 SER N N 102 116.667 115.514 1.153 1
1 1206 . 6 1 1 A 103 103 GLY H H 103 8.213 8.430 -0.217 1
1 1207 . 6 1 1 A 103 103 GLY HA2 H 103 4.164 4.208 -0.044 1
1 1208 . 6 1 1 A 103 103 GLY HA3 H 103 4.057 4.208 -0.151 1
1 1209 . 6 1 1 A 103 103 GLY C C 103 171.822 173.430 -1.608 1
1 1210 . 6 1 1 A 103 103 GLY CA C 103 44.658 45.459 -0.801 1
1 1211 . 6 1 1 A 103 103 GLY N N 103 110.592 109.669 0.923 1
1 1212 . 6 1 1 A 104 104 PRO HA H 104 4.475 4.608 -0.133 1
1 1219 . 6 1 1 A 104 104 PRO C C 104 177.445 176.391 1.054 1
1 1220 . 6 1 1 A 104 104 PRO CA C 104 63.312 63.748 -0.436 1
1 1221 . 6 1 1 A 104 104 PRO CB C 104 32.190 31.731 0.459 1
1 1224 . 6 1 1 A 105 105 SER H H 105 8.538 7.742 0.796 1
1 1225 . 6 1 1 A 105 105 SER HA H 105 4.541 4.424 0.117 1
1 1228 . 6 1 1 A 105 105 SER C C 105 174.616 174.096 0.520 1
1 1229 . 6 1 1 A 105 105 SER CA C 105 58.270 58.075 0.195 1
1 1230 . 6 1 1 A 105 105 SER CB C 105 63.895 63.682 0.213 1
1 1231 . 6 1 1 A 105 105 SER N N 105 116.446 113.608 2.838 1
1 1232 . 6 1 1 A 106 106 SER H H 106 8.350 8.607 -0.257 1
1 1233 . 6 1 1 A 106 106 SER HA H 106 4.541 5.036 -0.495 1
1 1236 . 6 1 1 A 106 106 SER C C 106 174.530 173.089 1.441 1
1 1237 . 6 1 1 A 106 106 SER CA C 106 58.357 56.301 2.056 1
1 1238 . 6 1 1 A 106 106 SER CB C 106 64.020 65.384 -1.364 1
1 1239 . 6 1 1 A 106 106 SER N N 106 117.448 118.034 -0.586 1
1 1 . 7 1 1 A 2 2 SER C C 2 174.723 174.000 0.723 1
1 2 . 7 1 1 A 2 2 SER CA C 2 58.446 59.353 -0.907 1
1 3 . 7 1 1 A 2 2 SER CB C 2 63.566 65.663 -2.097 1
1 4 . 7 1 1 A 3 3 SER H H 3 8.350 8.098 0.252 1
1 5 . 7 1 1 A 3 3 SER C C 3 173.961 173.913 0.048 1
1 6 . 7 1 1 A 3 3 SER CA C 3 58.428 57.773 0.655 1
1 7 . 7 1 1 A 3 3 SER CB C 3 63.937 65.254 -1.317 1
1 8 . 7 1 1 A 3 3 SER N N 3 117.923 116.338 1.585 1
1 9 . 7 1 1 A 4 4 GLY H H 4 8.050 8.155 -0.105 1
1 10 . 7 1 1 A 4 4 GLY C C 4 179.009 173.710 5.299 1
1 11 . 7 1 1 A 4 4 GLY CA C 4 46.174 44.690 1.484 1
1 12 . 7 1 1 A 4 4 GLY N N 4 116.890 108.794 8.096 1
1 13 . 7 1 1 A 7 7 GLY HA2 H 7 4.340 4.391 -0.051 1
1 14 . 7 1 1 A 7 7 GLY HA3 H 7 3.629 4.391 -0.762 1
1 15 . 7 1 1 A 7 7 GLY CA C 7 44.381 44.201 0.180 1
1 16 . 7 1 1 A 8 8 PRO HA H 8 4.476 4.545 -0.069 1
1 23 . 7 1 1 A 8 8 PRO C C 8 176.235 177.437 -1.202 1
1 24 . 7 1 1 A 8 8 PRO CA C 8 62.995 62.740 0.255 1
1 25 . 7 1 1 A 8 8 PRO CB C 8 33.266 32.181 1.085 1
1 28 . 7 1 1 A 9 9 GLY H H 9 8.585 8.434 0.151 1
1 29 . 7 1 1 A 9 9 GLY HA2 H 9 4.326 4.102 0.224 1
1 30 . 7 1 1 A 9 9 GLY HA3 H 9 4.009 4.110 -0.101 1
1 31 . 7 1 1 A 9 9 GLY C C 9 172.998 173.447 -0.449 1
1 32 . 7 1 1 A 9 9 GLY CA C 9 44.393 44.350 0.043 1
1 33 . 7 1 1 A 9 9 GLY N N 9 106.004 107.564 -1.560 1
1 34 . 7 1 1 A 10 10 ARG H H 10 8.548 8.371 0.177 1
1 35 . 7 1 1 A 10 10 ARG HA H 10 4.654 4.847 -0.193 1
1 41 . 7 1 1 A 10 10 ARG C C 10 175.780 173.974 1.806 1
1 42 . 7 1 1 A 10 10 ARG CA C 10 54.708 52.748 1.960 1
1 43 . 7 1 1 A 10 10 ARG CB C 10 31.448 31.257 0.191 1
1 45 . 7 1 1 A 10 10 ARG N N 10 119.407 121.631 -2.224 1
1 46 . 7 1 1 A 11 11 PRO HA H 11 4.611 4.611 0.000 1
1 53 . 7 1 1 A 11 11 PRO C C 11 173.510 175.579 -2.069 1
1 54 . 7 1 1 A 11 11 PRO CA C 11 62.360 62.696 -0.336 1
1 55 . 7 1 1 A 11 11 PRO CB C 11 33.402 32.276 1.126 1
1 58 . 7 1 1 A 12 12 THR H H 12 7.572 8.488 -0.916 1
1 59 . 7 1 1 A 12 12 THR HA H 12 3.796 4.349 -0.553 1
1 64 . 7 1 1 A 12 12 THR C C 12 172.337 173.395 -1.058 1
1 65 . 7 1 1 A 12 12 THR CA C 12 61.778 61.759 0.019 1
1 66 . 7 1 1 A 12 12 THR CB C 12 70.561 68.677 1.884 1
1 68 . 7 1 1 A 12 12 THR N N 12 109.653 117.332 -7.679 1
1 69 . 7 1 1 A 13 13 MET H H 13 5.605 8.505 -2.900 1
1 70 . 7 1 1 A 13 13 MET HA H 13 5.091 4.931 0.160 1
1 78 . 7 1 1 A 13 13 MET C C 13 172.639 175.002 -2.363 1
1 79 . 7 1 1 A 13 13 MET CA C 13 54.168 53.611 0.557 1
1 80 . 7 1 1 A 13 13 MET CB C 13 37.632 34.495 3.137 1
1 83 . 7 1 1 A 13 13 MET N N 13 121.634 126.982 -5.348 1
1 84 . 7 1 1 A 14 14 MET H H 14 9.254 8.992 0.262 1
1 85 . 7 1 1 A 14 14 MET HA H 14 4.662 5.145 -0.483 1
1 93 . 7 1 1 A 14 14 MET C C 14 174.388 174.647 -0.259 1
1 94 . 7 1 1 A 14 14 MET CA C 14 54.673 54.447 0.226 1
1 95 . 7 1 1 A 14 14 MET CB C 14 34.907 35.083 -0.176 1
1 98 . 7 1 1 A 14 14 MET N N 14 125.746 123.825 1.921 1
1 99 . 7 1 1 A 15 15 ILE H H 15 8.555 9.233 -0.678 1
1 100 . 7 1 1 A 15 15 ILE HA H 15 4.882 5.026 -0.144 1
1 110 . 7 1 1 A 15 15 ILE C C 15 174.962 174.997 -0.035 1
1 111 . 7 1 1 A 15 15 ILE CA C 15 60.685 60.409 0.276 1
1 112 . 7 1 1 A 15 15 ILE CB C 15 40.878 38.596 2.282 1
1 116 . 7 1 1 A 15 15 ILE N N 15 121.623 126.148 -4.525 1
1 117 . 7 1 1 A 16 16 SER H H 16 8.703 8.963 -0.260 1
1 118 . 7 1 1 A 16 16 SER HA H 16 4.922 5.015 -0.093 1
1 121 . 7 1 1 A 16 16 SER C C 16 173.860 173.286 0.574 1
1 122 . 7 1 1 A 16 16 SER CA C 16 56.524 57.291 -0.767 1
1 123 . 7 1 1 A 16 16 SER CB C 16 65.004 65.314 -0.310 1
1 124 . 7 1 1 A 16 16 SER N N 16 122.261 125.082 -2.821 1
1 125 . 7 1 1 A 17 17 THR H H 17 8.759 8.678 0.081 1
1 126 . 7 1 1 A 17 17 THR HA H 17 4.885 4.720 0.165 1
1 131 . 7 1 1 A 17 17 THR C C 17 175.018 174.545 0.473 1
1 132 . 7 1 1 A 17 17 THR CA C 17 60.315 61.191 -0.876 1
1 133 . 7 1 1 A 17 17 THR CB C 17 69.799 69.975 -0.176 1
1 135 . 7 1 1 A 17 17 THR N N 17 115.660 117.010 -1.350 1
1 136 . 7 1 1 A 18 18 THR H H 18 8.038 8.786 -0.748 1
1 137 . 7 1 1 A 18 18 THR HA H 18 4.596 4.442 0.154 1
1 142 . 7 1 1 A 18 18 THR CA C 18 60.707 62.253 -1.546 1
1 143 . 7 1 1 A 18 18 THR CB C 18 71.082 69.773 1.309 1
1 145 . 7 1 1 A 18 18 THR N N 18 112.362 115.284 -2.922 1
1 146 . 7 1 1 A 19 19 ALA H H 19 8.545 7.424 1.121 1
1 147 . 7 1 1 A 19 19 ALA HA H 19 4.412 4.340 0.072 1
1 151 . 7 1 1 A 19 19 ALA C C 19 177.034 177.490 -0.456 1
1 152 . 7 1 1 A 19 19 ALA CA C 19 52.264 51.746 0.518 1
1 153 . 7 1 1 A 19 19 ALA CB C 19 19.292 20.473 -1.181 1
1 154 . 7 1 1 A 19 19 ALA N N 19 119.589 123.649 -4.060 1
1 155 . 7 1 1 A 20 20 MET H H 20 8.145 8.573 -0.428 1
1 156 . 7 1 1 A 20 20 MET HA H 20 4.447 4.090 0.357 1
1 164 . 7 1 1 A 20 20 MET C C 20 175.676 176.740 -1.064 1
1 165 . 7 1 1 A 20 20 MET CA C 20 55.764 55.460 0.304 1
1 166 . 7 1 1 A 20 20 MET CB C 20 31.495 31.923 -0.428 1
1 169 . 7 1 1 A 20 20 MET N N 20 116.950 119.990 -3.040 1
1 170 . 7 1 1 A 21 21 ASN H H 21 8.275 8.992 -0.717 1
1 171 . 7 1 1 A 21 21 ASN HA H 21 4.452 4.391 0.061 1
1 176 . 7 1 1 A 21 21 ASN C C 21 174.100 173.778 0.322 1
1 177 . 7 1 1 A 21 21 ASN CA C 21 54.320 54.550 -0.230 1
1 178 . 7 1 1 A 21 21 ASN CB C 21 37.234 37.116 0.118 1
1 179 . 7 1 1 A 21 21 ASN N N 21 113.198 118.471 -5.273 1
1 181 . 7 1 1 A 22 22 THR H H 22 7.071 7.100 -0.029 1
1 182 . 7 1 1 A 22 22 THR HA H 22 5.218 5.413 -0.195 1
1 187 . 7 1 1 A 22 22 THR C C 22 173.301 173.221 0.080 1
1 188 . 7 1 1 A 22 22 THR CA C 22 59.399 60.302 -0.903 1
1 189 . 7 1 1 A 22 22 THR CB C 22 72.714 72.034 0.680 1
1 191 . 7 1 1 A 22 22 THR N N 22 107.603 108.055 -0.452 1
1 192 . 7 1 1 A 23 23 ALA H H 23 8.687 8.764 -0.077 1
1 193 . 7 1 1 A 23 23 ALA HA H 23 4.925 5.170 -0.245 1
1 197 . 7 1 1 A 23 23 ALA C C 23 174.100 175.363 -1.263 1
1 198 . 7 1 1 A 23 23 ALA CA C 23 50.812 50.067 0.745 1
1 199 . 7 1 1 A 23 23 ALA CB C 23 21.122 21.565 -0.443 1
1 200 . 7 1 1 A 23 23 ALA N N 23 121.937 125.432 -3.495 1
1 201 . 7 1 1 A 24 24 LEU H H 24 8.833 8.910 -0.077 1
1 202 . 7 1 1 A 24 24 LEU HA H 24 4.673 4.501 0.172 1
1 212 . 7 1 1 A 24 24 LEU C C 24 175.140 174.539 0.601 1
1 213 . 7 1 1 A 24 24 LEU CA C 24 54.320 54.882 -0.562 1
1 214 . 7 1 1 A 24 24 LEU CB C 24 42.518 43.161 -0.643 1
1 218 . 7 1 1 A 24 24 LEU N N 24 123.721 126.237 -2.516 1
1 219 . 7 1 1 A 25 25 LEU H H 25 9.176 8.860 0.316 1
1 220 . 7 1 1 A 25 25 LEU HA H 25 5.112 4.982 0.130 1
1 230 . 7 1 1 A 25 25 LEU C C 25 176.414 175.889 0.525 1
1 231 . 7 1 1 A 25 25 LEU CA C 25 54.108 53.053 1.055 1
1 232 . 7 1 1 A 25 25 LEU CB C 25 43.230 42.989 0.241 1
1 236 . 7 1 1 A 25 25 LEU N N 25 128.589 128.301 0.288 1
1 237 . 7 1 1 A 26 26 GLN H H 26 8.556 8.757 -0.201 1
1 238 . 7 1 1 A 26 26 GLN HA H 26 4.737 4.879 -0.142 1
1 245 . 7 1 1 A 26 26 GLN C C 26 174.372 174.277 0.095 1
1 246 . 7 1 1 A 26 26 GLN CA C 26 56.365 54.462 1.903 1
1 247 . 7 1 1 A 26 26 GLN CB C 26 33.320 31.894 1.426 1
1 249 . 7 1 1 A 26 26 GLN N N 26 119.630 123.020 -3.390 1
1 251 . 7 1 1 A 27 27 TRP H H 27 8.080 8.075 0.005 1
1 252 . 7 1 1 A 27 27 TRP HA H 27 5.441 5.745 -0.304 1
1 261 . 7 1 1 A 27 27 TRP CA C 27 55.957 54.345 1.612 1
1 262 . 7 1 1 A 27 27 TRP CB C 27 32.517 32.224 0.293 1
1 268 . 7 1 1 A 27 27 TRP N N 27 121.276 121.710 -0.434 1
1 270 . 7 1 1 A 28 28 HIS H H 28 8.262 8.587 -0.325 1
1 271 . 7 1 1 A 28 28 HIS HA H 28 4.997 5.007 -0.010 1
1 275 . 7 1 1 A 28 28 HIS CA C 28 53.028 53.921 -0.893 1
1 276 . 7 1 1 A 28 28 HIS CB C 28 32.832 32.798 0.034 1
1 278 . 7 1 1 A 28 28 HIS N N 28 116.245 116.812 -0.567 1
1 279 . 7 1 1 A 29 29 PRO HA H 29 4.984 4.685 0.299 1
1 286 . 7 1 1 A 29 29 PRO CA C 29 61.498 62.085 -0.587 1
1 287 . 7 1 1 A 29 29 PRO CB C 29 30.709 32.298 -1.589 1
1 290 . 7 1 1 A 30 30 PRO HA H 30 4.449 4.698 -0.249 1
1 297 . 7 1 1 A 30 30 PRO C C 30 175.733 177.003 -1.270 1
1 298 . 7 1 1 A 30 30 PRO CA C 30 62.245 62.702 -0.457 1
1 299 . 7 1 1 A 30 30 PRO CB C 30 32.083 32.828 -0.745 1
1 302 . 7 1 1 A 31 31 LYS H H 31 8.403 8.869 -0.466 1
1 303 . 7 1 1 A 31 31 LYS HA H 31 4.084 4.427 -0.343 1
1 312 . 7 1 1 A 31 31 LYS C C 31 177.166 177.347 -0.181 1
1 313 . 7 1 1 A 31 31 LYS CA C 31 57.866 57.124 0.742 1
1 314 . 7 1 1 A 31 31 LYS CB C 31 32.698 32.963 -0.265 1
1 318 . 7 1 1 A 31 31 LYS N N 31 121.693 120.224 1.469 1
1 319 . 7 1 1 A 32 32 GLU H H 32 8.102 7.753 0.349 1
1 320 . 7 1 1 A 32 32 GLU HA H 32 4.365 4.516 -0.151 1
1 325 . 7 1 1 A 32 32 GLU C C 32 174.248 176.130 -1.882 1
1 326 . 7 1 1 A 32 32 GLU CA C 32 55.448 55.605 -0.157 1
1 327 . 7 1 1 A 32 32 GLU CB C 32 29.405 29.722 -0.317 1
1 329 . 7 1 1 A 32 32 GLU N N 32 118.742 116.844 1.898 1
1 330 . 7 1 1 A 33 33 LEU H H 33 8.420 7.527 0.893 1
1 331 . 7 1 1 A 33 33 LEU HA H 33 4.499 4.653 -0.154 1
1 341 . 7 1 1 A 33 33 LEU C C 33 173.036 175.031 -1.995 1
1 342 . 7 1 1 A 33 33 LEU CA C 33 52.863 52.311 0.552 1
1 343 . 7 1 1 A 33 33 LEU CB C 33 42.535 43.149 -0.614 1
1 347 . 7 1 1 A 33 33 LEU N N 33 125.181 123.915 1.266 1
1 348 . 7 1 1 A 34 34 PRO HA H 34 4.488 4.480 0.008 1
1 355 . 7 1 1 A 34 34 PRO C C 34 177.544 176.991 0.553 1
1 356 . 7 1 1 A 34 34 PRO CA C 34 62.889 63.276 -0.387 1
1 357 . 7 1 1 A 34 34 PRO CB C 34 31.472 30.898 0.574 1
1 360 . 7 1 1 A 35 35 GLY H H 35 8.397 8.048 0.349 1
1 361 . 7 1 1 A 35 35 GLY HA2 H 35 4.059 4.116 -0.057 1
1 362 . 7 1 1 A 35 35 GLY HA3 H 35 3.716 4.116 -0.400 1
1 363 . 7 1 1 A 35 35 GLY C C 35 173.356 172.193 1.163 1
1 364 . 7 1 1 A 35 35 GLY CA C 35 45.892 44.873 1.019 1
1 365 . 7 1 1 A 35 35 GLY N N 35 110.524 112.258 -1.734 1
1 366 . 7 1 1 A 36 36 GLU H H 36 8.091 8.548 -0.457 1
1 367 . 7 1 1 A 36 36 GLU HA H 36 4.371 5.110 -0.739 1
1 372 . 7 1 1 A 36 36 GLU C C 36 174.864 174.365 0.499 1
1 373 . 7 1 1 A 36 36 GLU CA C 36 55.201 54.595 0.606 1
1 374 . 7 1 1 A 36 36 GLU CB C 36 31.878 33.002 -1.124 1
1 376 . 7 1 1 A 36 36 GLU N N 36 122.202 120.354 1.848 1
1 377 . 7 1 1 A 37 37 LEU H H 37 8.307 8.694 -0.387 1
1 378 . 7 1 1 A 37 37 LEU HA H 37 4.288 4.283 0.005 1
1 388 . 7 1 1 A 37 37 LEU C C 37 176.702 176.005 0.697 1
1 389 . 7 1 1 A 37 37 LEU CA C 37 55.342 56.270 -0.928 1
1 390 . 7 1 1 A 37 37 LEU CB C 37 42.715 42.304 0.411 1
1 394 . 7 1 1 A 37 37 LEU N N 37 123.204 124.336 -1.132 1
1 395 . 7 1 1 A 38 38 LEU H H 38 8.909 8.685 0.224 1
1 396 . 7 1 1 A 38 38 LEU HA H 38 4.640 4.720 -0.080 1
1 406 . 7 1 1 A 38 38 LEU C C 38 177.202 176.837 0.365 1
1 407 . 7 1 1 A 38 38 LEU CA C 38 54.390 54.885 -0.495 1
1 408 . 7 1 1 A 38 38 LEU CB C 38 43.770 43.526 0.244 1
1 412 . 7 1 1 A 38 38 LEU N N 38 123.021 126.884 -3.863 1
1 413 . 7 1 1 A 39 39 GLY H H 39 7.113 6.965 0.148 1
1 414 . 7 1 1 A 39 39 GLY HA2 H 39 4.816 3.551 1.265 1
1 415 . 7 1 1 A 39 39 GLY HA3 H 39 3.276 3.894 -0.618 1
1 416 . 7 1 1 A 39 39 GLY C C 39 169.863 170.362 -0.499 1
1 417 . 7 1 1 A 39 39 GLY CA C 39 44.622 45.437 -0.815 1
1 418 . 7 1 1 A 39 39 GLY N N 39 104.137 104.275 -0.138 1
1 419 . 7 1 1 A 40 40 TYR H H 40 8.318 8.875 -0.557 1
1 420 . 7 1 1 A 40 40 TYR HA H 40 5.414 5.100 0.314 1
1 425 . 7 1 1 A 40 40 TYR C C 40 174.448 172.147 2.301 1
1 426 . 7 1 1 A 40 40 TYR CA C 40 56.178 56.570 -0.392 1
1 427 . 7 1 1 A 40 40 TYR CB C 40 44.191 40.674 3.517 1
1 430 . 7 1 1 A 40 40 TYR N N 40 114.036 115.397 -1.361 1
1 431 . 7 1 1 A 41 41 ARG H H 41 9.347 8.431 0.916 1
1 432 . 7 1 1 A 41 41 ARG HA H 41 5.092 5.447 -0.355 1
1 440 . 7 1 1 A 41 41 ARG C C 41 174.097 174.117 -0.020 1
1 441 . 7 1 1 A 41 41 ARG CA C 41 56.100 54.203 1.897 1
1 442 . 7 1 1 A 41 41 ARG CB C 41 34.508 33.159 1.349 1
1 445 . 7 1 1 A 41 41 ARG N N 41 122.231 121.203 1.028 1
1 447 . 7 1 1 A 42 42 LEU H H 42 9.546 9.035 0.511 1
1 448 . 7 1 1 A 42 42 LEU HA H 42 5.459 5.246 0.213 1
1 458 . 7 1 1 A 42 42 LEU C C 42 174.913 174.658 0.255 1
1 459 . 7 1 1 A 42 42 LEU CA C 42 52.997 53.398 -0.401 1
1 460 . 7 1 1 A 42 42 LEU CB C 42 46.413 45.876 0.537 1
1 464 . 7 1 1 A 42 42 LEU N N 42 132.335 127.034 5.301 1
1 465 . 7 1 1 A 43 43 GLN H H 43 9.502 9.248 0.254 1
1 466 . 7 1 1 A 43 43 GLN HA H 43 5.847 5.401 0.446 1
1 473 . 7 1 1 A 43 43 GLN C C 43 175.329 174.083 1.246 1
1 474 . 7 1 1 A 43 43 GLN CA C 43 54.005 54.473 -0.468 1
1 475 . 7 1 1 A 43 43 GLN CB C 43 33.429 31.681 1.748 1
1 477 . 7 1 1 A 43 43 GLN N N 43 123.932 125.393 -1.461 1
1 479 . 7 1 1 A 44 44 TYR H H 44 8.615 8.512 0.103 1
1 480 . 7 1 1 A 44 44 TYR HA H 44 5.783 5.714 0.069 1
1 487 . 7 1 1 A 44 44 TYR C C 44 174.058 173.495 0.563 1
1 488 . 7 1 1 A 44 44 TYR CA C 44 55.942 55.857 0.085 1
1 489 . 7 1 1 A 44 44 TYR CB C 44 43.052 41.614 1.438 1
1 494 . 7 1 1 A 44 44 TYR N N 44 117.355 119.706 -2.351 1
1 495 . 7 1 1 A 45 45 CYS H H 45 8.377 8.313 0.064 1
1 496 . 7 1 1 A 45 45 CYS HA H 45 4.772 5.152 -0.380 1
1 499 . 7 1 1 A 45 45 CYS C C 45 173.205 173.861 -0.656 1
1 500 . 7 1 1 A 45 45 CYS CA C 45 55.960 56.867 -0.907 1
1 501 . 7 1 1 A 45 45 CYS CB C 45 30.665 31.186 -0.521 1
1 502 . 7 1 1 A 45 45 CYS N N 45 115.140 118.819 -3.679 1
1 503 . 7 1 1 A 46 46 ARG H H 46 9.165 8.558 0.607 1
1 504 . 7 1 1 A 46 46 ARG HA H 46 4.068 3.712 0.356 1
1 511 . 7 1 1 A 46 46 ARG C C 46 178.440 177.407 1.033 1
1 512 . 7 1 1 A 46 46 ARG CA C 46 56.401 55.724 0.677 1
1 513 . 7 1 1 A 46 46 ARG CB C 46 31.878 30.781 1.097 1
1 516 . 7 1 1 A 46 46 ARG N N 46 121.803 121.456 0.347 1
1 517 . 7 1 1 A 47 47 ALA H H 47 8.273 8.290 -0.017 1
1 518 . 7 1 1 A 47 47 ALA HA H 47 3.891 4.032 -0.141 1
1 522 . 7 1 1 A 47 47 ALA C C 47 177.599 177.411 0.188 1
1 523 . 7 1 1 A 47 47 ALA CA C 47 54.796 53.746 1.050 1
1 524 . 7 1 1 A 47 47 ALA CB C 47 18.287 18.591 -0.304 1
1 525 . 7 1 1 A 47 47 ALA N N 47 123.895 123.804 0.091 1
1 526 . 7 1 1 A 48 48 ASP H H 48 8.036 7.966 0.070 1
1 527 . 7 1 1 A 48 48 ASP HA H 48 4.453 4.778 -0.325 1
1 530 . 7 1 1 A 48 48 ASP C C 48 175.836 175.792 0.044 1
1 531 . 7 1 1 A 48 48 ASP CA C 48 53.368 52.792 0.576 1
1 532 . 7 1 1 A 48 48 ASP CB C 48 39.964 41.078 -1.114 1
1 533 . 7 1 1 A 48 48 ASP N N 48 112.576 117.214 -4.638 1
1 534 . 7 1 1 A 49 49 GLU H H 49 7.495 7.299 0.196 1
1 535 . 7 1 1 A 49 49 GLU HA H 49 4.308 4.384 -0.076 1
1 540 . 7 1 1 A 49 49 GLU C C 49 175.756 175.790 -0.034 1
1 541 . 7 1 1 A 49 49 GLU CA C 49 56.224 55.369 0.855 1
1 542 . 7 1 1 A 49 49 GLU CB C 49 32.248 30.443 1.805 1
1 544 . 7 1 1 A 49 49 GLU N N 49 120.609 119.640 0.969 1
1 545 . 7 1 1 A 50 50 ALA H H 50 8.416 8.622 -0.206 1
1 546 . 7 1 1 A 50 50 ALA HA H 50 4.200 4.498 -0.298 1
1 550 . 7 1 1 A 50 50 ALA C C 50 177.433 177.016 0.417 1
1 551 . 7 1 1 A 50 50 ALA CA C 50 53.297 52.225 1.072 1
1 552 . 7 1 1 A 50 50 ALA CB C 50 19.474 20.821 -1.347 1
1 553 . 7 1 1 A 50 50 ALA N N 50 124.065 123.066 0.999 1
1 554 . 7 1 1 A 51 51 ARG H H 51 7.648 7.774 -0.126 1
1 555 . 7 1 1 A 51 51 ARG HA H 51 4.747 4.798 -0.051 1
1 562 . 7 1 1 A 51 51 ARG C C 51 173.400 173.711 -0.311 1
1 563 . 7 1 1 A 51 51 ARG CA C 51 52.592 53.927 -1.335 1
1 564 . 7 1 1 A 51 51 ARG CB C 51 31.212 33.011 -1.799 1
1 567 . 7 1 1 A 51 51 ARG N N 51 117.798 115.698 2.100 1
1 568 . 7 1 1 A 52 52 PRO HA H 52 4.212 4.444 -0.232 1
1 575 . 7 1 1 A 52 52 PRO C C 52 176.380 175.806 0.574 1
1 576 . 7 1 1 A 52 52 PRO CA C 52 62.360 62.596 -0.236 1
1 577 . 7 1 1 A 52 52 PRO CB C 52 32.331 32.205 0.126 1
1 580 . 7 1 1 A 53 53 ASN H H 53 8.127 8.266 -0.139 1
1 581 . 7 1 1 A 53 53 ASN HA H 53 4.651 4.821 -0.170 1
1 586 . 7 1 1 A 53 53 ASN C C 53 174.354 174.301 0.053 1
1 587 . 7 1 1 A 53 53 ASN CA C 53 53.136 52.383 0.753 1
1 588 . 7 1 1 A 53 53 ASN CB C 53 39.666 38.327 1.339 1
1 589 . 7 1 1 A 53 53 ASN N N 53 119.405 119.674 -0.269 1
1 591 . 7 1 1 A 54 54 THR H H 54 8.425 8.582 -0.157 1
1 592 . 7 1 1 A 54 54 THR HA H 54 5.306 4.464 0.842 1
1 597 . 7 1 1 A 54 54 THR C C 54 173.850 174.218 -0.368 1
1 598 . 7 1 1 A 54 54 THR CA C 54 61.881 63.489 -1.608 1
1 599 . 7 1 1 A 54 54 THR CB C 54 70.573 69.349 1.224 1
1 601 . 7 1 1 A 54 54 THR N N 54 118.968 121.103 -2.135 1
1 602 . 7 1 1 A 55 55 ILE H H 55 9.354 8.445 0.909 1
1 603 . 7 1 1 A 55 55 ILE HA H 55 4.051 4.462 -0.411 1
1 613 . 7 1 1 A 55 55 ILE C C 55 172.975 173.357 -0.382 1
1 614 . 7 1 1 A 55 55 ILE CA C 55 61.003 59.805 1.198 1
1 615 . 7 1 1 A 55 55 ILE CB C 55 41.619 42.174 -0.555 1
1 619 . 7 1 1 A 55 55 ILE N N 55 127.961 125.823 2.138 1
1 620 . 7 1 1 A 56 56 ASP H H 56 8.132 8.720 -0.588 1
1 621 . 7 1 1 A 56 56 ASP HA H 56 5.334 5.170 0.164 1
1 624 . 7 1 1 A 56 56 ASP C C 56 174.969 174.599 0.370 1
1 625 . 7 1 1 A 56 56 ASP CA C 56 53.702 52.654 1.048 1
1 626 . 7 1 1 A 56 56 ASP CB C 56 43.251 42.848 0.403 1
1 627 . 7 1 1 A 56 56 ASP N N 56 125.882 126.984 -1.102 1
1 628 . 7 1 1 A 57 57 PHE H H 57 8.955 8.778 0.177 1
1 629 . 7 1 1 A 57 57 PHE HA H 57 4.915 5.041 -0.126 1
1 637 . 7 1 1 A 57 57 PHE C C 57 177.361 175.549 1.812 1
1 638 . 7 1 1 A 57 57 PHE CA C 57 57.458 56.483 0.975 1
1 639 . 7 1 1 A 57 57 PHE CB C 57 43.737 43.509 0.228 1
1 645 . 7 1 1 A 57 57 PHE N N 57 118.872 123.450 -4.578 1
1 646 . 7 1 1 A 58 58 GLY H H 58 9.552 9.183 0.369 1
1 647 . 7 1 1 A 58 58 GLY HA2 H 58 4.662 4.110 0.552 1
1 648 . 7 1 1 A 58 58 GLY HA3 H 58 4.126 4.187 -0.061 1
1 649 . 7 1 1 A 58 58 GLY C C 58 174.760 174.934 -0.174 1
1 650 . 7 1 1 A 58 58 GLY CA C 58 44.680 45.067 -0.387 1
1 651 . 7 1 1 A 58 58 GLY N N 58 111.551 109.772 1.779 1
1 652 . 7 1 1 A 59 59 LYS H H 59 8.211 8.664 -0.453 1
1 653 . 7 1 1 A 59 59 LYS HA H 59 3.782 3.699 0.083 1
1 662 . 7 1 1 A 59 59 LYS C C 59 176.154 177.974 -1.820 1
1 663 . 7 1 1 A 59 59 LYS CA C 59 59.080 58.679 0.401 1
1 664 . 7 1 1 A 59 59 LYS CB C 59 32.516 31.811 0.705 1
1 668 . 7 1 1 A 59 59 LYS N N 59 115.953 120.477 -4.524 1
1 669 . 7 1 1 A 60 60 ASP H H 60 8.634 7.960 0.674 1
1 670 . 7 1 1 A 60 60 ASP HA H 60 4.882 4.552 0.330 1
1 673 . 7 1 1 A 60 60 ASP C C 60 176.039 177.222 -1.183 1
1 674 . 7 1 1 A 60 60 ASP CA C 60 54.327 56.596 -2.269 1
1 675 . 7 1 1 A 60 60 ASP CB C 60 41.461 40.828 0.633 1
1 676 . 7 1 1 A 60 60 ASP N N 60 117.261 118.452 -1.191 1
1 677 . 7 1 1 A 61 61 ASP H H 61 7.500 8.280 -0.780 1
1 678 . 7 1 1 A 61 61 ASP HA H 61 4.591 4.652 -0.061 1
1 681 . 7 1 1 A 61 61 ASP C C 61 175.140 175.911 -0.771 1
1 682 . 7 1 1 A 61 61 ASP CA C 61 55.342 54.079 1.263 1
1 683 . 7 1 1 A 61 61 ASP CB C 61 42.475 40.502 1.973 1
1 684 . 7 1 1 A 61 61 ASP N N 61 122.319 119.016 3.303 1
1 685 . 7 1 1 A 62 62 GLN H H 62 8.239 7.901 0.338 1
1 686 . 7 1 1 A 62 62 GLN HA H 62 2.569 3.615 -1.046 1
1 693 . 7 1 1 A 62 62 GLN C C 62 172.652 173.512 -0.860 1
1 694 . 7 1 1 A 62 62 GLN CA C 62 54.038 55.415 -1.377 1
1 695 . 7 1 1 A 62 62 GLN CB C 62 31.481 29.174 2.307 1
1 697 . 7 1 1 A 62 62 GLN N N 62 117.458 123.456 -5.998 1
1 699 . 7 1 1 A 63 63 HIS H H 63 6.338 6.716 -0.378 1
1 700 . 7 1 1 A 63 63 HIS HA H 63 4.423 4.355 0.068 1
1 704 . 7 1 1 A 63 63 HIS C C 63 173.031 172.488 0.543 1
1 705 . 7 1 1 A 63 63 HIS CA C 63 54.743 53.952 0.791 1
1 706 . 7 1 1 A 63 63 HIS CB C 63 32.661 31.410 1.251 1
1 708 . 7 1 1 A 63 63 HIS N N 63 113.589 115.603 -2.014 1
1 709 . 7 1 1 A 64 64 PHE H H 64 8.549 9.169 -0.620 1
1 710 . 7 1 1 A 64 64 PHE HA H 64 4.578 5.198 -0.620 1
1 718 . 7 1 1 A 64 64 PHE C C 64 173.015 173.323 -0.308 1
1 719 . 7 1 1 A 64 64 PHE CA C 64 58.516 57.229 1.287 1
1 720 . 7 1 1 A 64 64 PHE CB C 64 43.525 43.176 0.349 1
1 726 . 7 1 1 A 64 64 PHE N N 64 118.214 119.580 -1.366 1
1 727 . 7 1 1 A 65 65 THR H H 65 7.150 7.831 -0.681 1
1 728 . 7 1 1 A 65 65 THR HA H 65 4.930 4.756 0.174 1
1 733 . 7 1 1 A 65 65 THR C C 65 172.457 173.080 -0.623 1
1 734 . 7 1 1 A 65 65 THR CA C 65 61.690 61.427 0.263 1
1 735 . 7 1 1 A 65 65 THR CB C 65 69.593 69.665 -0.072 1
1 737 . 7 1 1 A 65 65 THR N N 65 123.198 118.886 4.312 1
1 738 . 7 1 1 A 66 66 VAL H H 66 8.888 8.476 0.412 1
1 739 . 7 1 1 A 66 66 VAL HA H 66 4.018 4.740 -0.722 1
1 747 . 7 1 1 A 66 66 VAL C C 66 174.868 175.295 -0.427 1
1 748 . 7 1 1 A 66 66 VAL CA C 66 61.178 60.581 0.597 1
1 749 . 7 1 1 A 66 66 VAL CB C 66 33.114 33.048 0.066 1
1 752 . 7 1 1 A 66 66 VAL N N 66 126.840 128.365 -1.525 1
1 753 . 7 1 1 A 67 67 THR H H 67 8.174 8.500 -0.326 1
1 754 . 7 1 1 A 67 67 THR HA H 67 4.816 4.974 -0.158 1
1 759 . 7 1 1 A 67 67 THR C C 67 174.494 174.244 0.250 1
1 760 . 7 1 1 A 67 67 THR CA C 67 59.786 59.534 0.252 1
1 761 . 7 1 1 A 67 67 THR CB C 67 70.887 71.681 -0.794 1
1 763 . 7 1 1 A 67 67 THR N N 67 116.127 117.100 -0.973 1
1 764 . 7 1 1 A 68 68 GLY H H 68 8.570 8.698 -0.128 1
1 765 . 7 1 1 A 68 68 GLY HA2 H 68 3.970 4.004 -0.034 1
1 766 . 7 1 1 A 68 68 GLY HA3 H 68 3.819 4.018 -0.199 1
1 767 . 7 1 1 A 68 68 GLY C C 68 175.636 174.246 1.390 1
1 768 . 7 1 1 A 68 68 GLY CA C 68 46.397 45.050 1.347 1
1 769 . 7 1 1 A 68 68 GLY N N 68 107.146 112.788 -5.642 1
1 770 . 7 1 1 A 69 69 LEU H H 69 8.007 7.799 0.208 1
1 771 . 7 1 1 A 69 69 LEU HA H 69 4.154 4.316 -0.162 1
1 781 . 7 1 1 A 69 69 LEU C C 69 176.830 176.628 0.202 1
1 782 . 7 1 1 A 69 69 LEU CA C 69 54.602 55.431 -0.829 1
1 783 . 7 1 1 A 69 69 LEU CB C 69 41.149 42.305 -1.156 1
1 787 . 7 1 1 A 69 69 LEU N N 69 118.433 123.144 -4.711 1
1 788 . 7 1 1 A 70 70 HIS H H 70 8.866 8.689 0.177 1
1 789 . 7 1 1 A 70 70 HIS HA H 70 4.663 4.841 -0.178 1
1 793 . 7 1 1 A 70 70 HIS C C 70 176.667 175.213 1.454 1
1 794 . 7 1 1 A 70 70 HIS CA C 70 55.464 56.180 -0.716 1
1 795 . 7 1 1 A 70 70 HIS CB C 70 32.125 30.195 1.930 1
1 797 . 7 1 1 A 70 70 HIS N N 70 122.457 121.521 0.936 1
1 798 . 7 1 1 A 71 71 LYS H H 71 8.716 8.793 -0.077 1
1 799 . 7 1 1 A 71 71 LYS HA H 71 4.320 4.283 0.037 1
1 808 . 7 1 1 A 71 71 LYS C C 71 178.110 177.678 0.432 1
1 809 . 7 1 1 A 71 71 LYS CA C 71 57.035 58.143 -1.108 1
1 810 . 7 1 1 A 71 71 LYS CB C 71 33.580 32.767 0.813 1
1 814 . 7 1 1 A 71 71 LYS N N 71 123.173 123.347 -0.174 1
1 815 . 7 1 1 A 72 72 GLY H H 72 7.709 8.909 -1.200 1
1 816 . 7 1 1 A 72 72 GLY HA2 H 72 3.800 3.900 -0.100 1
1 817 . 7 1 1 A 72 72 GLY HA3 H 72 3.769 3.907 -0.138 1
1 818 . 7 1 1 A 72 72 GLY C C 72 174.231 173.867 0.364 1
1 819 . 7 1 1 A 72 72 GLY CA C 72 47.866 46.429 1.437 1
1 820 . 7 1 1 A 72 72 GLY N N 72 114.881 111.952 2.929 1
1 821 . 7 1 1 A 73 73 THR H H 73 8.162 7.507 0.655 1
1 822 . 7 1 1 A 73 73 THR HA H 73 4.584 4.772 -0.188 1
1 827 . 7 1 1 A 73 73 THR C C 73 172.208 173.511 -1.303 1
1 828 . 7 1 1 A 73 73 THR CA C 73 62.307 61.331 0.976 1
1 829 . 7 1 1 A 73 73 THR CB C 73 72.123 71.731 0.392 1
1 831 . 7 1 1 A 73 73 THR N N 73 114.225 114.460 -0.235 1
1 832 . 7 1 1 A 74 74 THR H H 74 8.743 8.819 -0.076 1
1 833 . 7 1 1 A 74 74 THR HA H 74 5.138 5.010 0.128 1
1 838 . 7 1 1 A 74 74 THR C C 74 173.376 173.389 -0.013 1
1 839 . 7 1 1 A 74 74 THR CA C 74 62.724 62.917 -0.193 1
1 840 . 7 1 1 A 74 74 THR CB C 74 69.202 69.931 -0.729 1
1 842 . 7 1 1 A 74 74 THR N N 74 123.376 121.000 2.376 1
1 843 . 7 1 1 A 75 75 TYR H H 75 9.549 9.223 0.326 1
1 844 . 7 1 1 A 75 75 TYR HA H 75 4.892 5.243 -0.351 1
1 851 . 7 1 1 A 75 75 TYR C C 75 173.991 175.401 -1.410 1
1 852 . 7 1 1 A 75 75 TYR CA C 75 57.740 56.134 1.606 1
1 853 . 7 1 1 A 75 75 TYR CB C 75 44.580 43.108 1.472 1
1 858 . 7 1 1 A 75 75 TYR N N 75 126.916 124.775 2.141 1
1 859 . 7 1 1 A 76 76 ILE H H 76 8.769 8.940 -0.171 1
1 860 . 7 1 1 A 76 76 ILE HA H 76 4.663 4.912 -0.249 1
1 870 . 7 1 1 A 76 76 ILE C C 76 174.683 175.228 -0.545 1
1 871 . 7 1 1 A 76 76 ILE CA C 76 60.455 60.756 -0.301 1
1 872 . 7 1 1 A 76 76 ILE CB C 76 40.284 39.990 0.294 1
1 876 . 7 1 1 A 76 76 ILE N N 76 119.407 120.888 -1.481 1
1 877 . 7 1 1 A 77 77 PHE H H 77 8.894 9.008 -0.114 1
1 878 . 7 1 1 A 77 77 PHE HA H 77 5.160 5.134 0.026 1
1 886 . 7 1 1 A 77 77 PHE C C 77 174.794 175.323 -0.529 1
1 887 . 7 1 1 A 77 77 PHE CA C 77 56.831 57.444 -0.613 1
1 888 . 7 1 1 A 77 77 PHE CB C 77 43.132 41.095 2.037 1
1 894 . 7 1 1 A 77 77 PHE N N 77 124.622 127.043 -2.421 1
1 895 . 7 1 1 A 78 78 ARG H H 78 9.407 9.235 0.172 1
1 896 . 7 1 1 A 78 78 ARG HA H 78 5.689 5.625 0.064 1
1 904 . 7 1 1 A 78 78 ARG C C 78 174.376 174.358 0.018 1
1 905 . 7 1 1 A 78 78 ARG CA C 78 54.530 54.730 -0.200 1
1 906 . 7 1 1 A 78 78 ARG CB C 78 34.473 33.549 0.924 1
1 909 . 7 1 1 A 78 78 ARG N N 78 120.055 121.116 -1.061 1
1 911 . 7 1 1 A 79 79 LEU H H 79 9.132 9.149 -0.017 1
1 912 . 7 1 1 A 79 79 LEU HA H 79 5.398 5.270 0.128 1
1 922 . 7 1 1 A 79 79 LEU C C 79 174.006 174.522 -0.516 1
1 923 . 7 1 1 A 79 79 LEU CA C 79 53.401 53.216 0.185 1
1 924 . 7 1 1 A 79 79 LEU CB C 79 48.116 46.244 1.872 1
1 928 . 7 1 1 A 79 79 LEU N N 79 124.907 127.539 -2.632 1
1 929 . 7 1 1 A 80 80 ALA H H 80 8.737 8.238 0.499 1
1 930 . 7 1 1 A 80 80 ALA HA H 80 4.871 5.028 -0.157 1
1 934 . 7 1 1 A 80 80 ALA C C 80 176.057 175.722 0.335 1
1 935 . 7 1 1 A 80 80 ALA CA C 80 50.353 51.127 -0.774 1
1 936 . 7 1 1 A 80 80 ALA CB C 80 23.972 23.601 0.371 1
1 937 . 7 1 1 A 80 80 ALA N N 80 128.220 126.030 2.190 1
1 938 . 7 1 1 A 81 81 ALA H H 81 9.890 8.613 1.277 1
1 939 . 7 1 1 A 81 81 ALA HA H 81 4.794 5.113 -0.319 1
1 943 . 7 1 1 A 81 81 ALA C C 81 174.655 176.063 -1.408 1
1 944 . 7 1 1 A 81 81 ALA CA C 81 50.300 51.187 -0.887 1
1 945 . 7 1 1 A 81 81 ALA CB C 81 21.369 20.784 0.585 1
1 946 . 7 1 1 A 81 81 ALA N N 81 123.682 123.434 0.248 1
1 947 . 7 1 1 A 82 82 LYS H H 82 7.965 8.735 -0.770 1
1 948 . 7 1 1 A 82 82 LYS HA H 82 4.974 5.178 -0.204 1
1 957 . 7 1 1 A 82 82 LYS C C 82 175.671 175.080 0.591 1
1 958 . 7 1 1 A 82 82 LYS CA C 82 54.664 54.844 -0.180 1
1 959 . 7 1 1 A 82 82 LYS CB C 82 36.677 35.620 1.057 1
1 963 . 7 1 1 A 82 82 LYS N N 82 118.164 122.184 -4.020 1
1 964 . 7 1 1 A 83 83 ASN H H 83 8.663 8.739 -0.076 1
1 965 . 7 1 1 A 83 83 ASN HA H 83 5.113 5.068 0.045 1
1 970 . 7 1 1 A 83 83 ASN C C 83 176.582 176.522 0.060 1
1 971 . 7 1 1 A 83 83 ASN CA C 83 51.746 50.721 1.025 1
1 972 . 7 1 1 A 83 83 ASN CB C 83 40.357 40.194 0.163 1
1 973 . 7 1 1 A 83 83 ASN N N 83 124.784 124.070 0.714 1
1 975 . 7 1 1 A 84 84 ARG H H 84 8.873 8.827 0.046 1
1 976 . 7 1 1 A 84 84 ARG HA H 84 3.940 3.954 -0.014 1
1 983 . 7 1 1 A 84 84 ARG C C 84 176.735 177.931 -1.196 1
1 984 . 7 1 1 A 84 84 ARG CA C 84 59.327 59.613 -0.286 1
1 985 . 7 1 1 A 84 84 ARG CB C 84 29.282 29.922 -0.640 1
1 988 . 7 1 1 A 84 84 ARG N N 84 117.891 119.292 -1.401 1
1 989 . 7 1 1 A 85 85 ALA H H 85 7.645 7.829 -0.184 1
1 990 . 7 1 1 A 85 85 ALA HA H 85 4.276 4.280 -0.004 1
1 994 . 7 1 1 A 85 85 ALA C C 85 177.479 177.208 0.271 1
1 995 . 7 1 1 A 85 85 ALA CA C 85 52.818 52.601 0.217 1
1 996 . 7 1 1 A 85 85 ALA CB C 85 18.806 19.506 -0.700 1
1 997 . 7 1 1 A 85 85 ALA N N 85 120.306 119.910 0.396 1
1 998 . 7 1 1 A 86 86 GLY H H 86 7.693 7.787 -0.094 1
1 999 . 7 1 1 A 86 86 GLY HA2 H 86 4.456 4.052 0.404 1
1 1000 . 7 1 1 A 86 86 GLY HA3 H 86 3.649 4.055 -0.406 1
1 1001 . 7 1 1 A 86 86 GLY C C 86 172.068 172.603 -0.535 1
1 1002 . 7 1 1 A 86 86 GLY CA C 86 44.375 43.860 0.515 1
1 1003 . 7 1 1 A 86 86 GLY N N 86 106.594 104.454 2.140 1
1 1004 . 7 1 1 A 87 87 LEU H H 87 8.203 8.507 -0.304 1
1 1005 . 7 1 1 A 87 87 LEU HA H 87 4.629 4.639 -0.010 1
1 1015 . 7 1 1 A 87 87 LEU C C 87 179.155 176.546 2.609 1
1 1016 . 7 1 1 A 87 87 LEU CA C 87 54.814 55.459 -0.645 1
1 1017 . 7 1 1 A 87 87 LEU CB C 87 43.454 42.520 0.934 1
1 1021 . 7 1 1 A 87 87 LEU N N 87 120.879 122.034 -1.155 1
1 1022 . 7 1 1 A 88 88 GLY H H 88 8.492 8.266 0.226 1
1 1023 . 7 1 1 A 88 88 GLY HA2 H 88 4.339 4.183 0.156 1
1 1024 . 7 1 1 A 88 88 GLY HA3 H 88 4.122 4.190 -0.068 1
1 1025 . 7 1 1 A 88 88 GLY C C 88 173.030 173.450 -0.420 1
1 1026 . 7 1 1 A 88 88 GLY CA C 88 43.970 44.637 -0.667 1
1 1027 . 7 1 1 A 88 88 GLY N N 88 109.903 110.104 -0.201 1
1 1028 . 7 1 1 A 89 89 GLU H H 89 7.638 8.876 -1.238 1
1 1029 . 7 1 1 A 89 89 GLU HA H 89 4.103 4.286 -0.183 1
1 1034 . 7 1 1 A 89 89 GLU C C 89 177.511 175.703 1.808 1
1 1035 . 7 1 1 A 89 89 GLU CA C 89 56.659 56.875 -0.216 1
1 1036 . 7 1 1 A 89 89 GLU CB C 89 31.324 30.864 0.460 1
1 1038 . 7 1 1 A 89 89 GLU N N 89 117.551 121.546 -3.995 1
1 1039 . 7 1 1 A 90 90 GLU H H 90 8.734 8.942 -0.208 1
1 1040 . 7 1 1 A 90 90 GLU HA H 90 4.651 5.266 -0.615 1
1 1045 . 7 1 1 A 90 90 GLU C C 90 177.452 174.520 2.932 1
1 1046 . 7 1 1 A 90 90 GLU CA C 90 55.987 54.680 1.307 1
1 1047 . 7 1 1 A 90 90 GLU CB C 90 31.135 33.366 -2.231 1
1 1049 . 7 1 1 A 90 90 GLU N N 90 121.553 117.746 3.807 1
1 1050 . 7 1 1 A 91 91 PHE H H 91 9.411 9.185 0.226 1
1 1051 . 7 1 1 A 91 91 PHE HA H 91 4.665 5.020 -0.355 1
1 1059 . 7 1 1 A 91 91 PHE C C 91 173.944 174.602 -0.658 1
1 1060 . 7 1 1 A 91 91 PHE CA C 91 57.687 58.290 -0.603 1
1 1061 . 7 1 1 A 91 91 PHE CB C 91 40.890 41.319 -0.429 1
1 1067 . 7 1 1 A 91 91 PHE N N 91 125.459 124.959 0.500 1
1 1068 . 7 1 1 A 92 92 GLU H H 92 8.043 8.190 -0.147 1
1 1069 . 7 1 1 A 92 92 GLU HA H 92 5.424 5.433 -0.009 1
1 1074 . 7 1 1 A 92 92 GLU C C 92 174.295 174.514 -0.219 1
1 1075 . 7 1 1 A 92 92 GLU CA C 92 54.378 54.997 -0.619 1
1 1076 . 7 1 1 A 92 92 GLU CB C 92 33.662 33.475 0.187 1
1 1078 . 7 1 1 A 92 92 GLU N N 92 128.905 127.091 1.814 1
1 1079 . 7 1 1 A 93 93 LYS H H 93 9.142 8.770 0.372 1
1 1080 . 7 1 1 A 93 93 LYS HA H 93 4.541 5.189 -0.648 1
1 1089 . 7 1 1 A 93 93 LYS C C 93 173.366 173.904 -0.538 1
1 1090 . 7 1 1 A 93 93 LYS CA C 93 55.343 55.507 -0.164 1
1 1091 . 7 1 1 A 93 93 LYS CB C 93 37.317 36.036 1.281 1
1 1095 . 7 1 1 A 93 93 LYS N N 93 125.231 127.203 -1.972 1
1 1096 . 7 1 1 A 94 94 GLU H H 94 8.655 9.209 -0.554 1
1 1097 . 7 1 1 A 94 94 GLU HA H 94 5.558 5.347 0.211 1
1 1102 . 7 1 1 A 94 94 GLU C C 94 176.238 175.634 0.604 1
1 1103 . 7 1 1 A 94 94 GLU CA C 94 54.632 55.173 -0.541 1
1 1104 . 7 1 1 A 94 94 GLU CB C 94 32.166 32.878 -0.712 1
1 1106 . 7 1 1 A 94 94 GLU N N 94 127.232 128.161 -0.929 1
1 1107 . 7 1 1 A 95 95 ILE H H 95 9.302 8.875 0.427 1
1 1108 . 7 1 1 A 95 95 ILE HA H 95 4.794 5.245 -0.451 1
1 1118 . 7 1 1 A 95 95 ILE C C 95 173.138 174.566 -1.428 1
1 1119 . 7 1 1 A 95 95 ILE CA C 95 58.570 58.480 0.090 1
1 1120 . 7 1 1 A 95 95 ILE CB C 95 42.420 42.690 -0.270 1
1 1124 . 7 1 1 A 95 95 ILE N N 95 120.711 121.158 -0.447 1
1 1125 . 7 1 1 A 96 96 ARG H H 96 8.589 8.718 -0.129 1
1 1126 . 7 1 1 A 96 96 ARG HA H 96 5.373 4.885 0.488 1
1 1133 . 7 1 1 A 96 96 ARG C C 96 177.147 174.861 2.286 1
1 1134 . 7 1 1 A 96 96 ARG CA C 96 54.045 55.470 -1.425 1
1 1135 . 7 1 1 A 96 96 ARG CB C 96 32.001 33.638 -1.637 1
1 1138 . 7 1 1 A 96 96 ARG N N 96 124.445 121.591 2.854 1
1 1139 . 7 1 1 A 97 97 THR H H 97 9.243 8.638 0.605 1
1 1140 . 7 1 1 A 97 97 THR HA H 97 4.459 4.659 -0.200 1
1 1145 . 7 1 1 A 97 97 THR C C 97 172.745 173.748 -1.003 1
1 1146 . 7 1 1 A 97 97 THR CA C 97 59.637 60.649 -1.012 1
1 1147 . 7 1 1 A 97 97 THR CB C 97 67.687 68.873 -1.186 1
1 1149 . 7 1 1 A 97 97 THR N N 97 119.370 118.377 0.993 1
1 1150 . 7 1 1 A 98 98 PRO HA H 98 4.494 4.595 -0.101 1
1 1157 . 7 1 1 A 98 98 PRO CA C 98 63.117 62.506 0.611 1
1 1158 . 7 1 1 A 98 98 PRO CB C 98 32.500 32.742 -0.242 1
1 1161 . 7 1 1 A 99 99 GLU H H 99 8.534 8.489 0.045 1
1 1162 . 7 1 1 A 99 99 GLU HA H 99 4.195 4.993 -0.798 1
1 1167 . 7 1 1 A 99 99 GLU C C 99 175.881 176.308 -0.427 1
1 1168 . 7 1 1 A 99 99 GLU CA C 99 56.330 54.752 1.578 1
1 1169 . 7 1 1 A 99 99 GLU CB C 99 31.062 32.529 -1.467 1
1 1171 . 7 1 1 A 99 99 GLU N N 99 119.688 119.297 0.391 1
1 1172 . 7 1 1 A 100 100 ASP H H 100 8.536 8.972 -0.436 1
1 1173 . 7 1 1 A 100 100 ASP HA H 100 4.607 4.251 0.356 1
1 1176 . 7 1 1 A 100 100 ASP C C 100 176.012 176.066 -0.054 1
1 1177 . 7 1 1 A 100 100 ASP CA C 100 54.109 57.539 -3.430 1
1 1178 . 7 1 1 A 100 100 ASP CB C 100 41.562 40.697 0.865 1
1 1179 . 7 1 1 A 100 100 ASP N N 100 119.803 123.019 -3.216 1
1 1180 . 7 1 1 A 101 101 LEU H H 101 8.403 8.045 0.358 1
1 1181 . 7 1 1 A 101 101 LEU HA H 101 4.426 3.989 0.437 1
1 1191 . 7 1 1 A 101 101 LEU C C 101 177.534 177.040 0.494 1
1 1192 . 7 1 1 A 101 101 LEU CA C 101 55.113 55.660 -0.547 1
1 1193 . 7 1 1 A 101 101 LEU CB C 101 42.156 40.770 1.386 1
1 1197 . 7 1 1 A 101 101 LEU N N 101 123.876 120.002 3.874 1
1 1198 . 7 1 1 A 102 102 SER H H 102 8.413 7.957 0.456 1
1 1199 . 7 1 1 A 102 102 SER HA H 102 4.434 4.650 -0.216 1
1 1202 . 7 1 1 A 102 102 SER C C 102 174.674 174.631 0.043 1
1 1203 . 7 1 1 A 102 102 SER CA C 102 58.798 57.556 1.242 1
1 1204 . 7 1 1 A 102 102 SER CB C 102 63.854 63.279 0.575 1
1 1205 . 7 1 1 A 102 102 SER N N 102 116.667 114.393 2.274 1
1 1206 . 7 1 1 A 103 103 GLY H H 103 8.213 8.196 0.017 1
1 1207 . 7 1 1 A 103 103 GLY HA2 H 103 4.164 4.134 0.030 1
1 1208 . 7 1 1 A 103 103 GLY HA3 H 103 4.057 4.135 -0.078 1
1 1209 . 7 1 1 A 103 103 GLY C C 103 171.822 173.753 -1.931 1
1 1210 . 7 1 1 A 103 103 GLY CA C 103 44.658 44.601 0.057 1
1 1211 . 7 1 1 A 103 103 GLY N N 103 110.592 114.033 -3.441 1
1 1212 . 7 1 1 A 104 104 PRO HA H 104 4.475 4.508 -0.033 1
1 1219 . 7 1 1 A 104 104 PRO C C 104 177.445 175.781 1.664 1
1 1220 . 7 1 1 A 104 104 PRO CA C 104 63.312 63.843 -0.531 1
1 1221 . 7 1 1 A 104 104 PRO CB C 104 32.190 31.646 0.544 1
1 1224 . 7 1 1 A 105 105 SER H H 105 8.538 7.766 0.772 1
1 1225 . 7 1 1 A 105 105 SER HA H 105 4.541 4.936 -0.395 1
1 1228 . 7 1 1 A 105 105 SER C C 105 174.616 172.358 2.258 1
1 1229 . 7 1 1 A 105 105 SER CA C 105 58.270 56.034 2.236 1
1 1230 . 7 1 1 A 105 105 SER CB C 105 63.895 66.044 -2.149 1
1 1231 . 7 1 1 A 105 105 SER N N 105 116.446 115.317 1.129 1
1 1232 . 7 1 1 A 106 106 SER H H 106 8.350 8.695 -0.345 1
1 1233 . 7 1 1 A 106 106 SER HA H 106 4.541 4.956 -0.415 1
1 1236 . 7 1 1 A 106 106 SER C C 106 174.530 172.262 2.268 1
1 1237 . 7 1 1 A 106 106 SER CA C 106 58.357 57.393 0.964 1
1 1238 . 7 1 1 A 106 106 SER CB C 106 64.020 65.804 -1.784 1
1 1239 . 7 1 1 A 106 106 SER N N 106 117.448 115.971 1.477 1
1 1 . 8 1 1 A 2 2 SER C C 2 174.723 173.983 0.740 1
1 2 . 8 1 1 A 2 2 SER CA C 2 58.446 58.859 -0.413 1
1 3 . 8 1 1 A 2 2 SER CB C 2 63.566 63.456 0.110 1
1 4 . 8 1 1 A 3 3 SER H H 3 8.350 9.038 -0.688 1
1 5 . 8 1 1 A 3 3 SER C C 3 173.961 173.758 0.203 1
1 6 . 8 1 1 A 3 3 SER CA C 3 58.428 57.634 0.794 1
1 7 . 8 1 1 A 3 3 SER CB C 3 63.937 66.166 -2.229 1
1 8 . 8 1 1 A 3 3 SER N N 3 117.923 124.074 -6.151 1
1 9 . 8 1 1 A 4 4 GLY H H 4 8.050 8.788 -0.738 1
1 10 . 8 1 1 A 4 4 GLY C C 4 179.009 173.069 5.940 1
1 11 . 8 1 1 A 4 4 GLY CA C 4 46.174 44.781 1.393 1
1 12 . 8 1 1 A 4 4 GLY N N 4 116.890 112.365 4.525 1
1 13 . 8 1 1 A 7 7 GLY HA2 H 7 4.340 4.150 0.190 1
1 14 . 8 1 1 A 7 7 GLY HA3 H 7 3.629 4.151 -0.522 1
1 15 . 8 1 1 A 7 7 GLY CA C 7 44.381 44.749 -0.368 1
1 16 . 8 1 1 A 8 8 PRO HA H 8 4.476 4.565 -0.089 1
1 23 . 8 1 1 A 8 8 PRO C C 8 176.235 177.233 -0.998 1
1 24 . 8 1 1 A 8 8 PRO CA C 8 62.995 62.622 0.373 1
1 25 . 8 1 1 A 8 8 PRO CB C 8 33.266 32.616 0.650 1
1 28 . 8 1 1 A 9 9 GLY H H 9 8.585 8.470 0.115 1
1 29 . 8 1 1 A 9 9 GLY HA2 H 9 4.326 4.103 0.223 1
1 30 . 8 1 1 A 9 9 GLY HA3 H 9 4.009 4.110 -0.101 1
1 31 . 8 1 1 A 9 9 GLY C C 9 172.998 173.396 -0.398 1
1 32 . 8 1 1 A 9 9 GLY CA C 9 44.393 44.358 0.035 1
1 33 . 8 1 1 A 9 9 GLY N N 9 106.004 108.075 -2.071 1
1 34 . 8 1 1 A 10 10 ARG H H 10 8.548 8.057 0.491 1
1 35 . 8 1 1 A 10 10 ARG HA H 10 4.654 4.467 0.187 1
1 41 . 8 1 1 A 10 10 ARG C C 10 175.780 175.481 0.299 1
1 42 . 8 1 1 A 10 10 ARG CA C 10 54.708 55.100 -0.392 1
1 43 . 8 1 1 A 10 10 ARG CB C 10 31.448 30.504 0.944 1
1 45 . 8 1 1 A 10 10 ARG N N 10 119.407 118.745 0.662 1
1 46 . 8 1 1 A 11 11 PRO HA H 11 4.611 4.577 0.034 1
1 53 . 8 1 1 A 11 11 PRO C C 11 173.510 175.863 -2.353 1
1 54 . 8 1 1 A 11 11 PRO CA C 11 62.360 62.683 -0.323 1
1 55 . 8 1 1 A 11 11 PRO CB C 11 33.402 32.107 1.295 1
1 58 . 8 1 1 A 12 12 THR H H 12 7.572 8.452 -0.880 1
1 59 . 8 1 1 A 12 12 THR HA H 12 3.796 4.214 -0.418 1
1 64 . 8 1 1 A 12 12 THR C C 12 172.337 173.240 -0.903 1
1 65 . 8 1 1 A 12 12 THR CA C 12 61.778 61.876 -0.098 1
1 66 . 8 1 1 A 12 12 THR CB C 12 70.561 68.478 2.083 1
1 68 . 8 1 1 A 12 12 THR N N 12 109.653 117.746 -8.093 1
1 69 . 8 1 1 A 13 13 MET H H 13 5.605 8.288 -2.683 1
1 70 . 8 1 1 A 13 13 MET HA H 13 5.091 4.893 0.198 1
1 78 . 8 1 1 A 13 13 MET C C 13 172.639 175.074 -2.435 1
1 79 . 8 1 1 A 13 13 MET CA C 13 54.168 53.774 0.394 1
1 80 . 8 1 1 A 13 13 MET CB C 13 37.632 34.340 3.292 1
1 83 . 8 1 1 A 13 13 MET N N 13 121.634 126.837 -5.203 1
1 84 . 8 1 1 A 14 14 MET H H 14 9.254 9.261 -0.007 1
1 85 . 8 1 1 A 14 14 MET HA H 14 4.662 5.184 -0.522 1
1 93 . 8 1 1 A 14 14 MET C C 14 174.388 174.894 -0.506 1
1 94 . 8 1 1 A 14 14 MET CA C 14 54.673 54.460 0.213 1
1 95 . 8 1 1 A 14 14 MET CB C 14 34.907 35.097 -0.190 1
1 98 . 8 1 1 A 14 14 MET N N 14 125.746 123.903 1.843 1
1 99 . 8 1 1 A 15 15 ILE H H 15 8.555 9.237 -0.682 1
1 100 . 8 1 1 A 15 15 ILE HA H 15 4.882 5.086 -0.204 1
1 110 . 8 1 1 A 15 15 ILE C C 15 174.962 174.967 -0.005 1
1 111 . 8 1 1 A 15 15 ILE CA C 15 60.685 60.376 0.309 1
1 112 . 8 1 1 A 15 15 ILE CB C 15 40.878 39.551 1.327 1
1 116 . 8 1 1 A 15 15 ILE N N 15 121.623 126.236 -4.613 1
1 117 . 8 1 1 A 16 16 SER H H 16 8.703 8.949 -0.246 1
1 118 . 8 1 1 A 16 16 SER HA H 16 4.922 5.063 -0.141 1
1 121 . 8 1 1 A 16 16 SER C C 16 173.860 172.844 1.016 1
1 122 . 8 1 1 A 16 16 SER CA C 16 56.524 57.355 -0.831 1
1 123 . 8 1 1 A 16 16 SER CB C 16 65.004 66.083 -1.079 1
1 124 . 8 1 1 A 16 16 SER N N 16 122.261 124.224 -1.963 1
1 125 . 8 1 1 A 17 17 THR H H 17 8.759 8.668 0.091 1
1 126 . 8 1 1 A 17 17 THR HA H 17 4.885 5.101 -0.216 1
1 131 . 8 1 1 A 17 17 THR C C 17 175.018 174.030 0.988 1
1 132 . 8 1 1 A 17 17 THR CA C 17 60.315 60.599 -0.284 1
1 133 . 8 1 1 A 17 17 THR CB C 17 69.799 70.257 -0.458 1
1 135 . 8 1 1 A 17 17 THR N N 17 115.660 114.374 1.286 1
1 136 . 8 1 1 A 18 18 THR H H 18 8.038 8.723 -0.685 1
1 137 . 8 1 1 A 18 18 THR HA H 18 4.596 4.439 0.157 1
1 142 . 8 1 1 A 18 18 THR CA C 18 60.707 63.928 -3.221 1
1 143 . 8 1 1 A 18 18 THR CB C 18 71.082 71.231 -0.149 1
1 145 . 8 1 1 A 18 18 THR N N 18 112.362 118.289 -5.927 1
1 146 . 8 1 1 A 19 19 ALA H H 19 8.545 7.794 0.751 1
1 147 . 8 1 1 A 19 19 ALA HA H 19 4.412 4.424 -0.012 1
1 151 . 8 1 1 A 19 19 ALA C C 19 177.034 176.889 0.145 1
1 152 . 8 1 1 A 19 19 ALA CA C 19 52.264 51.617 0.647 1
1 153 . 8 1 1 A 19 19 ALA CB C 19 19.292 21.003 -1.711 1
1 154 . 8 1 1 A 19 19 ALA N N 19 119.589 122.728 -3.139 1
1 155 . 8 1 1 A 20 20 MET H H 20 8.145 8.479 -0.334 1
1 156 . 8 1 1 A 20 20 MET HA H 20 4.447 4.562 -0.115 1
1 164 . 8 1 1 A 20 20 MET C C 20 175.676 176.325 -0.649 1
1 165 . 8 1 1 A 20 20 MET CA C 20 55.764 54.392 1.372 1
1 166 . 8 1 1 A 20 20 MET CB C 20 31.495 32.087 -0.592 1
1 169 . 8 1 1 A 20 20 MET N N 20 116.950 118.411 -1.461 1
1 170 . 8 1 1 A 21 21 ASN H H 21 8.275 8.871 -0.596 1
1 171 . 8 1 1 A 21 21 ASN HA H 21 4.452 4.321 0.131 1
1 176 . 8 1 1 A 21 21 ASN C C 21 174.100 173.937 0.163 1
1 177 . 8 1 1 A 21 21 ASN CA C 21 54.320 54.377 -0.057 1
1 178 . 8 1 1 A 21 21 ASN CB C 21 37.234 37.208 0.026 1
1 179 . 8 1 1 A 21 21 ASN N N 21 113.198 119.513 -6.315 1
1 181 . 8 1 1 A 22 22 THR H H 22 7.071 7.401 -0.330 1
1 182 . 8 1 1 A 22 22 THR HA H 22 5.218 5.368 -0.150 1
1 187 . 8 1 1 A 22 22 THR C C 22 173.301 172.554 0.747 1
1 188 . 8 1 1 A 22 22 THR CA C 22 59.399 60.772 -1.373 1
1 189 . 8 1 1 A 22 22 THR CB C 22 72.714 71.748 0.966 1
1 191 . 8 1 1 A 22 22 THR N N 22 107.603 107.955 -0.352 1
1 192 . 8 1 1 A 23 23 ALA H H 23 8.687 8.711 -0.024 1
1 193 . 8 1 1 A 23 23 ALA HA H 23 4.925 4.999 -0.074 1
1 197 . 8 1 1 A 23 23 ALA C C 23 174.100 175.763 -1.663 1
1 198 . 8 1 1 A 23 23 ALA CA C 23 50.812 50.104 0.708 1
1 199 . 8 1 1 A 23 23 ALA CB C 23 21.122 21.110 0.012 1
1 200 . 8 1 1 A 23 23 ALA N N 23 121.937 125.954 -4.017 1
1 201 . 8 1 1 A 24 24 LEU H H 24 8.833 9.151 -0.318 1
1 202 . 8 1 1 A 24 24 LEU HA H 24 4.673 4.523 0.150 1
1 212 . 8 1 1 A 24 24 LEU C C 24 175.140 174.653 0.487 1
1 213 . 8 1 1 A 24 24 LEU CA C 24 54.320 54.834 -0.514 1
1 214 . 8 1 1 A 24 24 LEU CB C 24 42.518 42.789 -0.271 1
1 218 . 8 1 1 A 24 24 LEU N N 24 123.721 126.922 -3.201 1
1 219 . 8 1 1 A 25 25 LEU H H 25 9.176 8.908 0.268 1
1 220 . 8 1 1 A 25 25 LEU HA H 25 5.112 4.884 0.228 1
1 230 . 8 1 1 A 25 25 LEU C C 25 176.414 175.751 0.663 1
1 231 . 8 1 1 A 25 25 LEU CA C 25 54.108 53.483 0.625 1
1 232 . 8 1 1 A 25 25 LEU CB C 25 43.230 43.949 -0.719 1
1 236 . 8 1 1 A 25 25 LEU N N 25 128.589 128.969 -0.380 1
1 237 . 8 1 1 A 26 26 GLN H H 26 8.556 8.648 -0.092 1
1 238 . 8 1 1 A 26 26 GLN HA H 26 4.737 4.871 -0.134 1
1 245 . 8 1 1 A 26 26 GLN C C 26 174.372 174.268 0.104 1
1 246 . 8 1 1 A 26 26 GLN CA C 26 56.365 54.423 1.942 1
1 247 . 8 1 1 A 26 26 GLN CB C 26 33.320 31.820 1.500 1
1 249 . 8 1 1 A 26 26 GLN N N 26 119.630 122.639 -3.009 1
1 251 . 8 1 1 A 27 27 TRP H H 27 8.080 8.233 -0.153 1
1 252 . 8 1 1 A 27 27 TRP HA H 27 5.441 5.828 -0.387 1
1 261 . 8 1 1 A 27 27 TRP CA C 27 55.957 54.531 1.426 1
1 262 . 8 1 1 A 27 27 TRP CB C 27 32.517 32.264 0.253 1
1 268 . 8 1 1 A 27 27 TRP N N 27 121.276 121.726 -0.450 1
1 270 . 8 1 1 A 28 28 HIS H H 28 8.262 8.617 -0.355 1
1 271 . 8 1 1 A 28 28 HIS HA H 28 4.997 5.020 -0.023 1
1 275 . 8 1 1 A 28 28 HIS CA C 28 53.028 53.945 -0.917 1
1 276 . 8 1 1 A 28 28 HIS CB C 28 32.832 32.873 -0.041 1
1 278 . 8 1 1 A 28 28 HIS N N 28 116.245 116.848 -0.603 1
1 279 . 8 1 1 A 29 29 PRO HA H 29 4.984 4.651 0.333 1
1 286 . 8 1 1 A 29 29 PRO CA C 29 61.498 62.143 -0.645 1
1 287 . 8 1 1 A 29 29 PRO CB C 29 30.709 32.441 -1.732 1
1 290 . 8 1 1 A 30 30 PRO HA H 30 4.449 4.683 -0.234 1
1 297 . 8 1 1 A 30 30 PRO C C 30 175.733 176.741 -1.008 1
1 298 . 8 1 1 A 30 30 PRO CA C 30 62.245 62.529 -0.284 1
1 299 . 8 1 1 A 30 30 PRO CB C 30 32.083 33.446 -1.363 1
1 302 . 8 1 1 A 31 31 LYS H H 31 8.403 8.888 -0.485 1
1 303 . 8 1 1 A 31 31 LYS HA H 31 4.084 4.561 -0.477 1
1 312 . 8 1 1 A 31 31 LYS C C 31 177.166 177.463 -0.297 1
1 313 . 8 1 1 A 31 31 LYS CA C 31 57.866 57.166 0.700 1
1 314 . 8 1 1 A 31 31 LYS CB C 31 32.698 33.991 -1.293 1
1 318 . 8 1 1 A 31 31 LYS N N 31 121.693 119.528 2.165 1
1 319 . 8 1 1 A 32 32 GLU H H 32 8.102 7.822 0.280 1
1 320 . 8 1 1 A 32 32 GLU HA H 32 4.365 4.453 -0.088 1
1 325 . 8 1 1 A 32 32 GLU C C 32 174.248 175.590 -1.342 1
1 326 . 8 1 1 A 32 32 GLU CA C 32 55.448 56.105 -0.657 1
1 327 . 8 1 1 A 32 32 GLU CB C 32 29.405 29.993 -0.588 1
1 329 . 8 1 1 A 32 32 GLU N N 32 118.742 116.839 1.903 1
1 330 . 8 1 1 A 33 33 LEU H H 33 8.420 7.494 0.926 1
1 331 . 8 1 1 A 33 33 LEU HA H 33 4.499 4.784 -0.285 1
1 341 . 8 1 1 A 33 33 LEU C C 33 173.036 174.782 -1.746 1
1 342 . 8 1 1 A 33 33 LEU CA C 33 52.863 51.505 1.358 1
1 343 . 8 1 1 A 33 33 LEU CB C 33 42.535 43.850 -1.315 1
1 347 . 8 1 1 A 33 33 LEU N N 33 125.181 122.955 2.226 1
1 348 . 8 1 1 A 34 34 PRO HA H 34 4.488 4.424 0.064 1
1 355 . 8 1 1 A 34 34 PRO C C 34 177.544 176.992 0.552 1
1 356 . 8 1 1 A 34 34 PRO CA C 34 62.889 63.514 -0.625 1
1 357 . 8 1 1 A 34 34 PRO CB C 34 31.472 31.171 0.301 1
1 360 . 8 1 1 A 35 35 GLY H H 35 8.397 8.607 -0.210 1
1 361 . 8 1 1 A 35 35 GLY HA2 H 35 4.059 4.097 -0.038 1
1 362 . 8 1 1 A 35 35 GLY HA3 H 35 3.716 4.097 -0.381 1
1 363 . 8 1 1 A 35 35 GLY C C 35 173.356 172.393 0.963 1
1 364 . 8 1 1 A 35 35 GLY CA C 35 45.892 44.855 1.037 1
1 365 . 8 1 1 A 35 35 GLY N N 35 110.524 112.709 -2.185 1
1 366 . 8 1 1 A 36 36 GLU H H 36 8.091 8.510 -0.419 1
1 367 . 8 1 1 A 36 36 GLU HA H 36 4.371 5.115 -0.744 1
1 372 . 8 1 1 A 36 36 GLU C C 36 174.864 173.939 0.925 1
1 373 . 8 1 1 A 36 36 GLU CA C 36 55.201 54.779 0.422 1
1 374 . 8 1 1 A 36 36 GLU CB C 36 31.878 33.138 -1.260 1
1 376 . 8 1 1 A 36 36 GLU N N 36 122.202 120.339 1.863 1
1 377 . 8 1 1 A 37 37 LEU H H 37 8.307 8.637 -0.330 1
1 378 . 8 1 1 A 37 37 LEU HA H 37 4.288 4.491 -0.203 1
1 388 . 8 1 1 A 37 37 LEU C C 37 176.702 175.862 0.840 1
1 389 . 8 1 1 A 37 37 LEU CA C 37 55.342 55.044 0.298 1
1 390 . 8 1 1 A 37 37 LEU CB C 37 42.715 43.411 -0.696 1
1 394 . 8 1 1 A 37 37 LEU N N 37 123.204 123.479 -0.275 1
1 395 . 8 1 1 A 38 38 LEU H H 38 8.909 8.733 0.176 1
1 396 . 8 1 1 A 38 38 LEU HA H 38 4.640 4.762 -0.122 1
1 406 . 8 1 1 A 38 38 LEU C C 38 177.202 176.146 1.056 1
1 407 . 8 1 1 A 38 38 LEU CA C 38 54.390 54.547 -0.157 1
1 408 . 8 1 1 A 38 38 LEU CB C 38 43.770 43.462 0.308 1
1 412 . 8 1 1 A 38 38 LEU N N 38 123.021 127.209 -4.188 1
1 413 . 8 1 1 A 39 39 GLY H H 39 7.113 6.875 0.238 1
1 414 . 8 1 1 A 39 39 GLY HA2 H 39 4.816 3.571 1.245 1
1 415 . 8 1 1 A 39 39 GLY HA3 H 39 3.276 3.920 -0.644 1
1 416 . 8 1 1 A 39 39 GLY C C 39 169.863 170.321 -0.458 1
1 417 . 8 1 1 A 39 39 GLY CA C 39 44.622 45.275 -0.653 1
1 418 . 8 1 1 A 39 39 GLY N N 39 104.137 105.031 -0.894 1
1 419 . 8 1 1 A 40 40 TYR H H 40 8.318 8.828 -0.510 1
1 420 . 8 1 1 A 40 40 TYR HA H 40 5.414 5.117 0.297 1
1 425 . 8 1 1 A 40 40 TYR C C 40 174.448 172.131 2.317 1
1 426 . 8 1 1 A 40 40 TYR CA C 40 56.178 56.545 -0.367 1
1 427 . 8 1 1 A 40 40 TYR CB C 40 44.191 40.619 3.572 1
1 430 . 8 1 1 A 40 40 TYR N N 40 114.036 115.584 -1.548 1
1 431 . 8 1 1 A 41 41 ARG H H 41 9.347 8.840 0.507 1
1 432 . 8 1 1 A 41 41 ARG HA H 41 5.092 5.438 -0.346 1
1 440 . 8 1 1 A 41 41 ARG C C 41 174.097 174.286 -0.189 1
1 441 . 8 1 1 A 41 41 ARG CA C 41 56.100 54.214 1.886 1
1 442 . 8 1 1 A 41 41 ARG CB C 41 34.508 33.124 1.384 1
1 445 . 8 1 1 A 41 41 ARG N N 41 122.231 121.127 1.104 1
1 447 . 8 1 1 A 42 42 LEU H H 42 9.546 9.238 0.308 1
1 448 . 8 1 1 A 42 42 LEU HA H 42 5.459 5.246 0.213 1
1 458 . 8 1 1 A 42 42 LEU C C 42 174.913 174.808 0.105 1
1 459 . 8 1 1 A 42 42 LEU CA C 42 52.997 53.407 -0.410 1
1 460 . 8 1 1 A 42 42 LEU CB C 42 46.413 45.698 0.715 1
1 464 . 8 1 1 A 42 42 LEU N N 42 132.335 127.646 4.689 1
1 465 . 8 1 1 A 43 43 GLN H H 43 9.502 9.354 0.148 1
1 466 . 8 1 1 A 43 43 GLN HA H 43 5.847 5.313 0.534 1
1 473 . 8 1 1 A 43 43 GLN C C 43 175.329 173.990 1.339 1
1 474 . 8 1 1 A 43 43 GLN CA C 43 54.005 54.412 -0.407 1
1 475 . 8 1 1 A 43 43 GLN CB C 43 33.429 31.207 2.222 1
1 477 . 8 1 1 A 43 43 GLN N N 43 123.932 125.524 -1.592 1
1 479 . 8 1 1 A 44 44 TYR H H 44 8.615 8.546 0.069 1
1 480 . 8 1 1 A 44 44 TYR HA H 44 5.783 5.903 -0.120 1
1 487 . 8 1 1 A 44 44 TYR C C 44 174.058 173.509 0.549 1
1 488 . 8 1 1 A 44 44 TYR CA C 44 55.942 55.571 0.371 1
1 489 . 8 1 1 A 44 44 TYR CB C 44 43.052 42.096 0.956 1
1 494 . 8 1 1 A 44 44 TYR N N 44 117.355 119.963 -2.608 1
1 495 . 8 1 1 A 45 45 CYS H H 45 8.377 8.371 0.006 1
1 496 . 8 1 1 A 45 45 CYS HA H 45 4.772 5.035 -0.263 1
1 499 . 8 1 1 A 45 45 CYS C C 45 173.205 173.665 -0.460 1
1 500 . 8 1 1 A 45 45 CYS CA C 45 55.960 56.887 -0.927 1
1 501 . 8 1 1 A 45 45 CYS CB C 45 30.665 31.258 -0.593 1
1 502 . 8 1 1 A 45 45 CYS N N 45 115.140 118.309 -3.169 1
1 503 . 8 1 1 A 46 46 ARG H H 46 9.165 8.555 0.610 1
1 504 . 8 1 1 A 46 46 ARG HA H 46 4.068 4.017 0.051 1
1 511 . 8 1 1 A 46 46 ARG C C 46 178.440 177.602 0.838 1
1 512 . 8 1 1 A 46 46 ARG CA C 46 56.401 55.575 0.826 1
1 513 . 8 1 1 A 46 46 ARG CB C 46 31.878 30.837 1.041 1
1 516 . 8 1 1 A 46 46 ARG N N 46 121.803 121.378 0.425 1
1 517 . 8 1 1 A 47 47 ALA H H 47 8.273 8.283 -0.010 1
1 518 . 8 1 1 A 47 47 ALA HA H 47 3.891 4.091 -0.200 1
1 522 . 8 1 1 A 47 47 ALA C C 47 177.599 177.207 0.392 1
1 523 . 8 1 1 A 47 47 ALA CA C 47 54.796 53.509 1.287 1
1 524 . 8 1 1 A 47 47 ALA CB C 47 18.287 18.531 -0.244 1
1 525 . 8 1 1 A 47 47 ALA N N 47 123.895 123.824 0.071 1
1 526 . 8 1 1 A 48 48 ASP H H 48 8.036 8.097 -0.061 1
1 527 . 8 1 1 A 48 48 ASP HA H 48 4.453 4.792 -0.339 1
1 530 . 8 1 1 A 48 48 ASP C C 48 175.836 175.848 -0.012 1
1 531 . 8 1 1 A 48 48 ASP CA C 48 53.368 52.911 0.457 1
1 532 . 8 1 1 A 48 48 ASP CB C 48 39.964 41.385 -1.421 1
1 533 . 8 1 1 A 48 48 ASP N N 48 112.576 117.633 -5.057 1
1 534 . 8 1 1 A 49 49 GLU H H 49 7.495 7.548 -0.053 1
1 535 . 8 1 1 A 49 49 GLU HA H 49 4.308 4.501 -0.193 1
1 540 . 8 1 1 A 49 49 GLU C C 49 175.756 175.567 0.189 1
1 541 . 8 1 1 A 49 49 GLU CA C 49 56.224 55.059 1.165 1
1 542 . 8 1 1 A 49 49 GLU CB C 49 32.248 30.808 1.440 1
1 544 . 8 1 1 A 49 49 GLU N N 49 120.609 119.668 0.941 1
1 545 . 8 1 1 A 50 50 ALA H H 50 8.416 8.543 -0.127 1
1 546 . 8 1 1 A 50 50 ALA HA H 50 4.200 4.561 -0.361 1
1 550 . 8 1 1 A 50 50 ALA C C 50 177.433 177.164 0.269 1
1 551 . 8 1 1 A 50 50 ALA CA C 50 53.297 52.352 0.945 1
1 552 . 8 1 1 A 50 50 ALA CB C 50 19.474 20.872 -1.398 1
1 553 . 8 1 1 A 50 50 ALA N N 50 124.065 123.359 0.706 1
1 554 . 8 1 1 A 51 51 ARG H H 51 7.648 7.703 -0.055 1
1 555 . 8 1 1 A 51 51 ARG HA H 51 4.747 4.664 0.083 1
1 562 . 8 1 1 A 51 51 ARG C C 51 173.400 173.555 -0.155 1
1 563 . 8 1 1 A 51 51 ARG CA C 51 52.592 52.075 0.517 1
1 564 . 8 1 1 A 51 51 ARG CB C 51 31.212 31.338 -0.126 1
1 567 . 8 1 1 A 51 51 ARG N N 51 117.798 117.903 -0.105 1
1 568 . 8 1 1 A 52 52 PRO HA H 52 4.212 4.450 -0.238 1
1 575 . 8 1 1 A 52 52 PRO C C 52 176.380 176.467 -0.087 1
1 576 . 8 1 1 A 52 52 PRO CA C 52 62.360 62.672 -0.312 1
1 577 . 8 1 1 A 52 52 PRO CB C 52 32.331 31.985 0.346 1
1 580 . 8 1 1 A 53 53 ASN H H 53 8.127 7.830 0.297 1
1 581 . 8 1 1 A 53 53 ASN HA H 53 4.651 4.747 -0.096 1
1 586 . 8 1 1 A 53 53 ASN C C 53 174.354 174.472 -0.118 1
1 587 . 8 1 1 A 53 53 ASN CA C 53 53.136 52.604 0.532 1
1 588 . 8 1 1 A 53 53 ASN CB C 53 39.666 38.245 1.421 1
1 589 . 8 1 1 A 53 53 ASN N N 53 119.405 119.847 -0.442 1
1 591 . 8 1 1 A 54 54 THR H H 54 8.425 8.556 -0.131 1
1 592 . 8 1 1 A 54 54 THR HA H 54 5.306 4.428 0.878 1
1 597 . 8 1 1 A 54 54 THR C C 54 173.850 174.305 -0.455 1
1 598 . 8 1 1 A 54 54 THR CA C 54 61.881 63.407 -1.526 1
1 599 . 8 1 1 A 54 54 THR CB C 54 70.573 69.208 1.365 1
1 601 . 8 1 1 A 54 54 THR N N 54 118.968 121.639 -2.671 1
1 602 . 8 1 1 A 55 55 ILE H H 55 9.354 8.688 0.666 1
1 603 . 8 1 1 A 55 55 ILE HA H 55 4.051 4.613 -0.562 1
1 613 . 8 1 1 A 55 55 ILE C C 55 172.975 173.466 -0.491 1
1 614 . 8 1 1 A 55 55 ILE CA C 55 61.003 59.762 1.241 1
1 615 . 8 1 1 A 55 55 ILE CB C 55 41.619 42.123 -0.504 1
1 619 . 8 1 1 A 55 55 ILE N N 55 127.961 126.325 1.636 1
1 620 . 8 1 1 A 56 56 ASP H H 56 8.132 8.676 -0.544 1
1 621 . 8 1 1 A 56 56 ASP HA H 56 5.334 5.386 -0.052 1
1 624 . 8 1 1 A 56 56 ASP C C 56 174.969 174.676 0.293 1
1 625 . 8 1 1 A 56 56 ASP CA C 56 53.702 52.702 1.000 1
1 626 . 8 1 1 A 56 56 ASP CB C 56 43.251 43.164 0.087 1
1 627 . 8 1 1 A 56 56 ASP N N 56 125.882 126.989 -1.107 1
1 628 . 8 1 1 A 57 57 PHE H H 57 8.955 8.832 0.123 1
1 629 . 8 1 1 A 57 57 PHE HA H 57 4.915 4.972 -0.057 1
1 637 . 8 1 1 A 57 57 PHE C C 57 177.361 175.499 1.862 1
1 638 . 8 1 1 A 57 57 PHE CA C 57 57.458 56.659 0.799 1
1 639 . 8 1 1 A 57 57 PHE CB C 57 43.737 43.508 0.229 1
1 645 . 8 1 1 A 57 57 PHE N N 57 118.872 122.742 -3.870 1
1 646 . 8 1 1 A 58 58 GLY H H 58 9.552 8.789 0.763 1
1 647 . 8 1 1 A 58 58 GLY HA2 H 58 4.662 4.118 0.544 1
1 648 . 8 1 1 A 58 58 GLY HA3 H 58 4.126 4.195 -0.069 1
1 649 . 8 1 1 A 58 58 GLY C C 58 174.760 174.925 -0.165 1
1 650 . 8 1 1 A 58 58 GLY CA C 58 44.680 44.983 -0.303 1
1 651 . 8 1 1 A 58 58 GLY N N 58 111.551 109.653 1.898 1
1 652 . 8 1 1 A 59 59 LYS H H 59 8.211 8.669 -0.458 1
1 653 . 8 1 1 A 59 59 LYS HA H 59 3.782 3.653 0.129 1
1 662 . 8 1 1 A 59 59 LYS C C 59 176.154 178.021 -1.867 1
1 663 . 8 1 1 A 59 59 LYS CA C 59 59.080 58.723 0.357 1
1 664 . 8 1 1 A 59 59 LYS CB C 59 32.516 31.802 0.714 1
1 668 . 8 1 1 A 59 59 LYS N N 59 115.953 120.263 -4.310 1
1 669 . 8 1 1 A 60 60 ASP H H 60 8.634 8.145 0.489 1
1 670 . 8 1 1 A 60 60 ASP HA H 60 4.882 4.515 0.367 1
1 673 . 8 1 1 A 60 60 ASP C C 60 176.039 177.173 -1.134 1
1 674 . 8 1 1 A 60 60 ASP CA C 60 54.327 56.811 -2.484 1
1 675 . 8 1 1 A 60 60 ASP CB C 60 41.461 40.600 0.861 1
1 676 . 8 1 1 A 60 60 ASP N N 60 117.261 118.599 -1.338 1
1 677 . 8 1 1 A 61 61 ASP H H 61 7.500 8.228 -0.728 1
1 678 . 8 1 1 A 61 61 ASP HA H 61 4.591 4.762 -0.171 1
1 681 . 8 1 1 A 61 61 ASP C C 61 175.140 175.840 -0.700 1
1 682 . 8 1 1 A 61 61 ASP CA C 61 55.342 53.753 1.589 1
1 683 . 8 1 1 A 61 61 ASP CB C 61 42.475 39.801 2.674 1
1 684 . 8 1 1 A 61 61 ASP N N 61 122.319 119.007 3.312 1
1 685 . 8 1 1 A 62 62 GLN H H 62 8.239 7.965 0.274 1
1 686 . 8 1 1 A 62 62 GLN HA H 62 2.569 3.675 -1.106 1
1 693 . 8 1 1 A 62 62 GLN C C 62 172.652 173.689 -1.037 1
1 694 . 8 1 1 A 62 62 GLN CA C 62 54.038 55.623 -1.585 1
1 695 . 8 1 1 A 62 62 GLN CB C 62 31.481 29.162 2.319 1
1 697 . 8 1 1 A 62 62 GLN N N 62 117.458 123.182 -5.724 1
1 699 . 8 1 1 A 63 63 HIS H H 63 6.338 6.809 -0.471 1
1 700 . 8 1 1 A 63 63 HIS HA H 63 4.423 4.014 0.409 1
1 704 . 8 1 1 A 63 63 HIS C C 63 173.031 172.648 0.383 1
1 705 . 8 1 1 A 63 63 HIS CA C 63 54.743 53.934 0.809 1
1 706 . 8 1 1 A 63 63 HIS CB C 63 32.661 31.442 1.219 1
1 708 . 8 1 1 A 63 63 HIS N N 63 113.589 115.831 -2.242 1
1 709 . 8 1 1 A 64 64 PHE H H 64 8.549 8.672 -0.123 1
1 710 . 8 1 1 A 64 64 PHE HA H 64 4.578 5.165 -0.587 1
1 718 . 8 1 1 A 64 64 PHE C C 64 173.015 173.771 -0.756 1
1 719 . 8 1 1 A 64 64 PHE CA C 64 58.516 57.045 1.471 1
1 720 . 8 1 1 A 64 64 PHE CB C 64 43.525 42.635 0.890 1
1 726 . 8 1 1 A 64 64 PHE N N 64 118.214 120.477 -2.263 1
1 727 . 8 1 1 A 65 65 THR H H 65 7.150 8.431 -1.281 1
1 728 . 8 1 1 A 65 65 THR HA H 65 4.930 4.552 0.378 1
1 733 . 8 1 1 A 65 65 THR C C 65 172.457 173.722 -1.265 1
1 734 . 8 1 1 A 65 65 THR CA C 65 61.690 62.158 -0.468 1
1 735 . 8 1 1 A 65 65 THR CB C 65 69.593 69.062 0.531 1
1 737 . 8 1 1 A 65 65 THR N N 65 123.198 122.643 0.555 1
1 738 . 8 1 1 A 66 66 VAL H H 66 8.888 8.951 -0.063 1
1 739 . 8 1 1 A 66 66 VAL HA H 66 4.018 4.729 -0.711 1
1 747 . 8 1 1 A 66 66 VAL C C 66 174.868 175.319 -0.451 1
1 748 . 8 1 1 A 66 66 VAL CA C 66 61.178 60.520 0.658 1
1 749 . 8 1 1 A 66 66 VAL CB C 66 33.114 33.219 -0.105 1
1 752 . 8 1 1 A 66 66 VAL N N 66 126.840 128.449 -1.609 1
1 753 . 8 1 1 A 67 67 THR H H 67 8.174 8.474 -0.300 1
1 754 . 8 1 1 A 67 67 THR HA H 67 4.816 5.081 -0.265 1
1 759 . 8 1 1 A 67 67 THR C C 67 174.494 174.274 0.220 1
1 760 . 8 1 1 A 67 67 THR CA C 67 59.786 59.541 0.245 1
1 761 . 8 1 1 A 67 67 THR CB C 67 70.887 71.658 -0.771 1
1 763 . 8 1 1 A 67 67 THR N N 67 116.127 117.125 -0.998 1
1 764 . 8 1 1 A 68 68 GLY H H 68 8.570 8.849 -0.279 1
1 765 . 8 1 1 A 68 68 GLY HA2 H 68 3.970 4.018 -0.048 1
1 766 . 8 1 1 A 68 68 GLY HA3 H 68 3.819 4.024 -0.205 1
1 767 . 8 1 1 A 68 68 GLY C C 68 175.636 174.474 1.162 1
1 768 . 8 1 1 A 68 68 GLY CA C 68 46.397 45.178 1.219 1
1 769 . 8 1 1 A 68 68 GLY N N 68 107.146 113.045 -5.899 1
1 770 . 8 1 1 A 69 69 LEU H H 69 8.007 7.354 0.653 1
1 771 . 8 1 1 A 69 69 LEU HA H 69 4.154 4.301 -0.147 1
1 781 . 8 1 1 A 69 69 LEU C C 69 176.830 176.524 0.306 1
1 782 . 8 1 1 A 69 69 LEU CA C 69 54.602 55.102 -0.500 1
1 783 . 8 1 1 A 69 69 LEU CB C 69 41.149 41.963 -0.814 1
1 787 . 8 1 1 A 69 69 LEU N N 69 118.433 122.911 -4.478 1
1 788 . 8 1 1 A 70 70 HIS H H 70 8.866 8.285 0.581 1
1 789 . 8 1 1 A 70 70 HIS HA H 70 4.663 4.713 -0.050 1
1 793 . 8 1 1 A 70 70 HIS C C 70 176.667 175.870 0.797 1
1 794 . 8 1 1 A 70 70 HIS CA C 70 55.464 57.019 -1.555 1
1 795 . 8 1 1 A 70 70 HIS CB C 70 32.125 30.246 1.879 1
1 797 . 8 1 1 A 70 70 HIS N N 70 122.457 121.645 0.812 1
1 798 . 8 1 1 A 71 71 LYS H H 71 8.716 8.614 0.102 1
1 799 . 8 1 1 A 71 71 LYS HA H 71 4.320 4.584 -0.264 1
1 808 . 8 1 1 A 71 71 LYS C C 71 178.110 176.790 1.320 1
1 809 . 8 1 1 A 71 71 LYS CA C 71 57.035 56.108 0.927 1
1 810 . 8 1 1 A 71 71 LYS CB C 71 33.580 33.094 0.486 1
1 814 . 8 1 1 A 71 71 LYS N N 71 123.173 123.228 -0.055 1
1 815 . 8 1 1 A 72 72 GLY H H 72 7.709 9.104 -1.395 1
1 816 . 8 1 1 A 72 72 GLY HA2 H 72 3.800 3.908 -0.108 1
1 817 . 8 1 1 A 72 72 GLY HA3 H 72 3.769 3.916 -0.147 1
1 818 . 8 1 1 A 72 72 GLY C C 72 174.231 173.940 0.291 1
1 819 . 8 1 1 A 72 72 GLY CA C 72 47.866 46.450 1.416 1
1 820 . 8 1 1 A 72 72 GLY N N 72 114.881 110.399 4.482 1
1 821 . 8 1 1 A 73 73 THR H H 73 8.162 7.581 0.581 1
1 822 . 8 1 1 A 73 73 THR HA H 73 4.584 4.634 -0.050 1
1 827 . 8 1 1 A 73 73 THR C C 73 172.208 173.304 -1.096 1
1 828 . 8 1 1 A 73 73 THR CA C 73 62.307 61.166 1.141 1
1 829 . 8 1 1 A 73 73 THR CB C 73 72.123 71.838 0.285 1
1 831 . 8 1 1 A 73 73 THR N N 73 114.225 114.374 -0.149 1
1 832 . 8 1 1 A 74 74 THR H H 74 8.743 8.743 0.000 1
1 833 . 8 1 1 A 74 74 THR HA H 74 5.138 4.788 0.350 1
1 838 . 8 1 1 A 74 74 THR C C 74 173.376 173.404 -0.028 1
1 839 . 8 1 1 A 74 74 THR CA C 74 62.724 62.970 -0.246 1
1 840 . 8 1 1 A 74 74 THR CB C 74 69.202 69.712 -0.510 1
1 842 . 8 1 1 A 74 74 THR N N 74 123.376 121.182 2.194 1
1 843 . 8 1 1 A 75 75 TYR H H 75 9.549 9.039 0.510 1
1 844 . 8 1 1 A 75 75 TYR HA H 75 4.892 5.238 -0.346 1
1 851 . 8 1 1 A 75 75 TYR C C 75 173.991 175.385 -1.394 1
1 852 . 8 1 1 A 75 75 TYR CA C 75 57.740 56.002 1.738 1
1 853 . 8 1 1 A 75 75 TYR CB C 75 44.580 43.213 1.367 1
1 858 . 8 1 1 A 75 75 TYR N N 75 126.916 124.730 2.186 1
1 859 . 8 1 1 A 76 76 ILE H H 76 8.769 8.974 -0.205 1
1 860 . 8 1 1 A 76 76 ILE HA H 76 4.663 4.873 -0.210 1
1 870 . 8 1 1 A 76 76 ILE C C 76 174.683 175.206 -0.523 1
1 871 . 8 1 1 A 76 76 ILE CA C 76 60.455 60.746 -0.291 1
1 872 . 8 1 1 A 76 76 ILE CB C 76 40.284 39.965 0.319 1
1 876 . 8 1 1 A 76 76 ILE N N 76 119.407 120.800 -1.393 1
1 877 . 8 1 1 A 77 77 PHE H H 77 8.894 8.943 -0.049 1
1 878 . 8 1 1 A 77 77 PHE HA H 77 5.160 5.100 0.060 1
1 886 . 8 1 1 A 77 77 PHE C C 77 174.794 175.430 -0.636 1
1 887 . 8 1 1 A 77 77 PHE CA C 77 56.831 57.447 -0.616 1
1 888 . 8 1 1 A 77 77 PHE CB C 77 43.132 40.998 2.134 1
1 894 . 8 1 1 A 77 77 PHE N N 77 124.622 127.102 -2.480 1
1 895 . 8 1 1 A 78 78 ARG H H 78 9.407 9.157 0.250 1
1 896 . 8 1 1 A 78 78 ARG HA H 78 5.689 5.639 0.050 1
1 904 . 8 1 1 A 78 78 ARG C C 78 174.376 174.323 0.053 1
1 905 . 8 1 1 A 78 78 ARG CA C 78 54.530 54.736 -0.206 1
1 906 . 8 1 1 A 78 78 ARG CB C 78 34.473 33.190 1.283 1
1 909 . 8 1 1 A 78 78 ARG N N 78 120.055 121.312 -1.257 1
1 911 . 8 1 1 A 79 79 LEU H H 79 9.132 9.211 -0.079 1
1 912 . 8 1 1 A 79 79 LEU HA H 79 5.398 5.215 0.183 1
1 922 . 8 1 1 A 79 79 LEU C C 79 174.006 174.523 -0.517 1
1 923 . 8 1 1 A 79 79 LEU CA C 79 53.401 53.247 0.154 1
1 924 . 8 1 1 A 79 79 LEU CB C 79 48.116 46.702 1.414 1
1 928 . 8 1 1 A 79 79 LEU N N 79 124.907 127.092 -2.185 1
1 929 . 8 1 1 A 80 80 ALA H H 80 8.737 8.346 0.391 1
1 930 . 8 1 1 A 80 80 ALA HA H 80 4.871 5.186 -0.315 1
1 934 . 8 1 1 A 80 80 ALA C C 80 176.057 175.637 0.420 1
1 935 . 8 1 1 A 80 80 ALA CA C 80 50.353 50.472 -0.119 1
1 936 . 8 1 1 A 80 80 ALA CB C 80 23.972 23.107 0.865 1
1 937 . 8 1 1 A 80 80 ALA N N 80 128.220 127.000 1.220 1
1 938 . 8 1 1 A 81 81 ALA H H 81 9.890 8.674 1.216 1
1 939 . 8 1 1 A 81 81 ALA HA H 81 4.794 5.038 -0.244 1
1 943 . 8 1 1 A 81 81 ALA C C 81 174.655 176.188 -1.533 1
1 944 . 8 1 1 A 81 81 ALA CA C 81 50.300 51.071 -0.771 1
1 945 . 8 1 1 A 81 81 ALA CB C 81 21.369 20.688 0.681 1
1 946 . 8 1 1 A 81 81 ALA N N 81 123.682 123.163 0.519 1
1 947 . 8 1 1 A 82 82 LYS H H 82 7.965 8.641 -0.676 1
1 948 . 8 1 1 A 82 82 LYS HA H 82 4.974 5.382 -0.408 1
1 957 . 8 1 1 A 82 82 LYS C C 82 175.671 175.157 0.514 1
1 958 . 8 1 1 A 82 82 LYS CA C 82 54.664 54.721 -0.057 1
1 959 . 8 1 1 A 82 82 LYS CB C 82 36.677 35.617 1.060 1
1 963 . 8 1 1 A 82 82 LYS N N 82 118.164 122.362 -4.198 1
1 964 . 8 1 1 A 83 83 ASN H H 83 8.663 8.946 -0.283 1
1 965 . 8 1 1 A 83 83 ASN HA H 83 5.113 5.173 -0.060 1
1 970 . 8 1 1 A 83 83 ASN C C 83 176.582 175.953 0.629 1
1 971 . 8 1 1 A 83 83 ASN CA C 83 51.746 50.737 1.009 1
1 972 . 8 1 1 A 83 83 ASN CB C 83 40.357 40.168 0.189 1
1 973 . 8 1 1 A 83 83 ASN N N 83 124.784 124.297 0.487 1
1 975 . 8 1 1 A 84 84 ARG H H 84 8.873 8.863 0.010 1
1 976 . 8 1 1 A 84 84 ARG HA H 84 3.940 3.940 0.000 1
1 983 . 8 1 1 A 84 84 ARG C C 84 176.735 177.864 -1.129 1
1 984 . 8 1 1 A 84 84 ARG CA C 84 59.327 59.697 -0.370 1
1 985 . 8 1 1 A 84 84 ARG CB C 84 29.282 29.855 -0.573 1
1 988 . 8 1 1 A 84 84 ARG N N 84 117.891 120.173 -2.282 1
1 989 . 8 1 1 A 85 85 ALA H H 85 7.645 7.809 -0.164 1
1 990 . 8 1 1 A 85 85 ALA HA H 85 4.276 4.185 0.091 1
1 994 . 8 1 1 A 85 85 ALA C C 85 177.479 177.325 0.154 1
1 995 . 8 1 1 A 85 85 ALA CA C 85 52.818 53.063 -0.245 1
1 996 . 8 1 1 A 85 85 ALA CB C 85 18.806 19.440 -0.634 1
1 997 . 8 1 1 A 85 85 ALA N N 85 120.306 119.777 0.529 1
1 998 . 8 1 1 A 86 86 GLY H H 86 7.693 7.609 0.084 1
1 999 . 8 1 1 A 86 86 GLY HA2 H 86 4.456 4.090 0.366 1
1 1000 . 8 1 1 A 86 86 GLY HA3 H 86 3.649 4.092 -0.443 1
1 1001 . 8 1 1 A 86 86 GLY C C 86 172.068 172.386 -0.318 1
1 1002 . 8 1 1 A 86 86 GLY CA C 86 44.375 44.065 0.310 1
1 1003 . 8 1 1 A 86 86 GLY N N 86 106.594 103.766 2.828 1
1 1004 . 8 1 1 A 87 87 LEU H H 87 8.203 8.456 -0.253 1
1 1005 . 8 1 1 A 87 87 LEU HA H 87 4.629 4.616 0.013 1
1 1015 . 8 1 1 A 87 87 LEU C C 87 179.155 176.505 2.650 1
1 1016 . 8 1 1 A 87 87 LEU CA C 87 54.814 55.305 -0.491 1
1 1017 . 8 1 1 A 87 87 LEU CB C 87 43.454 42.594 0.860 1
1 1021 . 8 1 1 A 87 87 LEU N N 87 120.879 122.449 -1.570 1
1 1022 . 8 1 1 A 88 88 GLY H H 88 8.492 8.496 -0.004 1
1 1023 . 8 1 1 A 88 88 GLY HA2 H 88 4.339 4.187 0.152 1
1 1024 . 8 1 1 A 88 88 GLY HA3 H 88 4.122 4.194 -0.072 1
1 1025 . 8 1 1 A 88 88 GLY C C 88 173.030 173.427 -0.397 1
1 1026 . 8 1 1 A 88 88 GLY CA C 88 43.970 44.661 -0.691 1
1 1027 . 8 1 1 A 88 88 GLY N N 88 109.903 109.861 0.042 1
1 1028 . 8 1 1 A 89 89 GLU H H 89 7.638 9.018 -1.380 1
1 1029 . 8 1 1 A 89 89 GLU HA H 89 4.103 4.275 -0.172 1
1 1034 . 8 1 1 A 89 89 GLU C C 89 177.511 175.755 1.756 1
1 1035 . 8 1 1 A 89 89 GLU CA C 89 56.659 56.972 -0.313 1
1 1036 . 8 1 1 A 89 89 GLU CB C 89 31.324 30.818 0.506 1
1 1038 . 8 1 1 A 89 89 GLU N N 89 117.551 121.728 -4.177 1
1 1039 . 8 1 1 A 90 90 GLU H H 90 8.734 8.942 -0.208 1
1 1040 . 8 1 1 A 90 90 GLU HA H 90 4.651 5.326 -0.675 1
1 1045 . 8 1 1 A 90 90 GLU C C 90 177.452 174.548 2.904 1
1 1046 . 8 1 1 A 90 90 GLU CA C 90 55.987 54.721 1.266 1
1 1047 . 8 1 1 A 90 90 GLU CB C 90 31.135 33.291 -2.156 1
1 1049 . 8 1 1 A 90 90 GLU N N 90 121.553 117.936 3.617 1
1 1050 . 8 1 1 A 91 91 PHE H H 91 9.411 9.333 0.078 1
1 1051 . 8 1 1 A 91 91 PHE HA H 91 4.665 4.875 -0.210 1
1 1059 . 8 1 1 A 91 91 PHE C C 91 173.944 174.771 -0.827 1
1 1060 . 8 1 1 A 91 91 PHE CA C 91 57.687 58.575 -0.888 1
1 1061 . 8 1 1 A 91 91 PHE CB C 91 40.890 40.376 0.514 1
1 1067 . 8 1 1 A 91 91 PHE N N 91 125.459 125.081 0.378 1
1 1068 . 8 1 1 A 92 92 GLU H H 92 8.043 8.007 0.036 1
1 1069 . 8 1 1 A 92 92 GLU HA H 92 5.424 5.253 0.171 1
1 1074 . 8 1 1 A 92 92 GLU C C 92 174.295 174.549 -0.254 1
1 1075 . 8 1 1 A 92 92 GLU CA C 92 54.378 54.716 -0.338 1
1 1076 . 8 1 1 A 92 92 GLU CB C 92 33.662 33.349 0.313 1
1 1078 . 8 1 1 A 92 92 GLU N N 92 128.905 126.703 2.202 1
1 1079 . 8 1 1 A 93 93 LYS H H 93 9.142 8.529 0.613 1
1 1080 . 8 1 1 A 93 93 LYS HA H 93 4.541 5.084 -0.543 1
1 1089 . 8 1 1 A 93 93 LYS C C 93 173.366 173.984 -0.618 1
1 1090 . 8 1 1 A 93 93 LYS CA C 93 55.343 55.634 -0.291 1
1 1091 . 8 1 1 A 93 93 LYS CB C 93 37.317 35.974 1.343 1
1 1095 . 8 1 1 A 93 93 LYS N N 93 125.231 126.856 -1.625 1
1 1096 . 8 1 1 A 94 94 GLU H H 94 8.655 9.149 -0.494 1
1 1097 . 8 1 1 A 94 94 GLU HA H 94 5.558 5.329 0.229 1
1 1102 . 8 1 1 A 94 94 GLU C C 94 176.238 175.587 0.651 1
1 1103 . 8 1 1 A 94 94 GLU CA C 94 54.632 55.079 -0.447 1
1 1104 . 8 1 1 A 94 94 GLU CB C 94 32.166 32.917 -0.751 1
1 1106 . 8 1 1 A 94 94 GLU N N 94 127.232 128.140 -0.908 1
1 1107 . 8 1 1 A 95 95 ILE H H 95 9.302 8.856 0.446 1
1 1108 . 8 1 1 A 95 95 ILE HA H 95 4.794 5.267 -0.473 1
1 1118 . 8 1 1 A 95 95 ILE C C 95 173.138 174.588 -1.450 1
1 1119 . 8 1 1 A 95 95 ILE CA C 95 58.570 58.689 -0.119 1
1 1120 . 8 1 1 A 95 95 ILE CB C 95 42.420 42.455 -0.035 1
1 1124 . 8 1 1 A 95 95 ILE N N 95 120.711 121.030 -0.319 1
1 1125 . 8 1 1 A 96 96 ARG H H 96 8.589 8.712 -0.123 1
1 1126 . 8 1 1 A 96 96 ARG HA H 96 5.373 4.735 0.638 1
1 1133 . 8 1 1 A 96 96 ARG C C 96 177.147 174.870 2.277 1
1 1134 . 8 1 1 A 96 96 ARG CA C 96 54.045 55.417 -1.372 1
1 1135 . 8 1 1 A 96 96 ARG CB C 96 32.001 33.741 -1.740 1
1 1138 . 8 1 1 A 96 96 ARG N N 96 124.445 121.597 2.848 1
1 1139 . 8 1 1 A 97 97 THR H H 97 9.243 8.471 0.772 1
1 1140 . 8 1 1 A 97 97 THR HA H 97 4.459 4.718 -0.259 1
1 1145 . 8 1 1 A 97 97 THR C C 97 172.745 173.695 -0.950 1
1 1146 . 8 1 1 A 97 97 THR CA C 97 59.637 60.636 -0.999 1
1 1147 . 8 1 1 A 97 97 THR CB C 97 67.687 68.942 -1.255 1
1 1149 . 8 1 1 A 97 97 THR N N 97 119.370 117.939 1.431 1
1 1150 . 8 1 1 A 98 98 PRO HA H 98 4.494 4.722 -0.228 1
1 1157 . 8 1 1 A 98 98 PRO CA C 98 63.117 62.586 0.531 1
1 1158 . 8 1 1 A 98 98 PRO CB C 98 32.500 31.772 0.728 1
1 1161 . 8 1 1 A 99 99 GLU H H 99 8.534 8.437 0.097 1
1 1162 . 8 1 1 A 99 99 GLU HA H 99 4.195 4.494 -0.299 1
1 1167 . 8 1 1 A 99 99 GLU C C 99 175.881 176.000 -0.119 1
1 1168 . 8 1 1 A 99 99 GLU CA C 99 56.330 55.842 0.488 1
1 1169 . 8 1 1 A 99 99 GLU CB C 99 31.062 30.412 0.650 1
1 1171 . 8 1 1 A 99 99 GLU N N 99 119.688 119.729 -0.041 1
1 1172 . 8 1 1 A 100 100 ASP H H 100 8.536 9.098 -0.562 1
1 1173 . 8 1 1 A 100 100 ASP HA H 100 4.607 4.252 0.355 1
1 1176 . 8 1 1 A 100 100 ASP C C 100 176.012 176.032 -0.020 1
1 1177 . 8 1 1 A 100 100 ASP CA C 100 54.109 57.779 -3.670 1
1 1178 . 8 1 1 A 100 100 ASP CB C 100 41.562 40.724 0.838 1
1 1179 . 8 1 1 A 100 100 ASP N N 100 119.803 121.188 -1.385 1
1 1180 . 8 1 1 A 101 101 LEU H H 101 8.403 8.037 0.366 1
1 1181 . 8 1 1 A 101 101 LEU HA H 101 4.426 3.952 0.474 1
1 1191 . 8 1 1 A 101 101 LEU C C 101 177.534 175.326 2.208 1
1 1192 . 8 1 1 A 101 101 LEU CA C 101 55.113 55.791 -0.678 1
1 1193 . 8 1 1 A 101 101 LEU CB C 101 42.156 40.786 1.370 1
1 1197 . 8 1 1 A 101 101 LEU N N 101 123.876 119.860 4.016 1
1 1198 . 8 1 1 A 102 102 SER H H 102 8.413 7.584 0.829 1
1 1199 . 8 1 1 A 102 102 SER HA H 102 4.434 5.054 -0.620 1
1 1202 . 8 1 1 A 102 102 SER C C 102 174.674 173.269 1.405 1
1 1203 . 8 1 1 A 102 102 SER CA C 102 58.798 56.301 2.497 1
1 1204 . 8 1 1 A 102 102 SER CB C 102 63.854 66.027 -2.173 1
1 1205 . 8 1 1 A 102 102 SER N N 102 116.667 110.123 6.544 1
1 1206 . 8 1 1 A 103 103 GLY H H 103 8.213 8.285 -0.072 1
1 1207 . 8 1 1 A 103 103 GLY HA2 H 103 4.164 4.172 -0.008 1
1 1208 . 8 1 1 A 103 103 GLY HA3 H 103 4.057 4.172 -0.115 1
1 1209 . 8 1 1 A 103 103 GLY C C 103 171.822 172.975 -1.153 1
1 1210 . 8 1 1 A 103 103 GLY CA C 103 44.658 45.563 -0.905 1
1 1211 . 8 1 1 A 103 103 GLY N N 103 110.592 107.172 3.420 1
1 1212 . 8 1 1 A 104 104 PRO HA H 104 4.475 4.626 -0.151 1
1 1219 . 8 1 1 A 104 104 PRO C C 104 177.445 177.121 0.324 1
1 1220 . 8 1 1 A 104 104 PRO CA C 104 63.312 62.387 0.925 1
1 1221 . 8 1 1 A 104 104 PRO CB C 104 32.190 30.304 1.886 1
1 1224 . 8 1 1 A 105 105 SER H H 105 8.538 7.831 0.707 1
1 1225 . 8 1 1 A 105 105 SER HA H 105 4.541 4.490 0.051 1
1 1228 . 8 1 1 A 105 105 SER C C 105 174.616 174.425 0.191 1
1 1229 . 8 1 1 A 105 105 SER CA C 105 58.270 59.989 -1.719 1
1 1230 . 8 1 1 A 105 105 SER CB C 105 63.895 63.995 -0.100 1
1 1231 . 8 1 1 A 105 105 SER N N 105 116.446 119.972 -3.526 1
1 1232 . 8 1 1 A 106 106 SER H H 106 8.350 8.438 -0.088 1
1 1233 . 8 1 1 A 106 106 SER HA H 106 4.541 4.940 -0.399 1
1 1236 . 8 1 1 A 106 106 SER C C 106 174.530 174.452 0.078 1
1 1237 . 8 1 1 A 106 106 SER CA C 106 58.357 56.802 1.555 1
1 1238 . 8 1 1 A 106 106 SER CB C 106 64.020 66.175 -2.155 1
1 1239 . 8 1 1 A 106 106 SER N N 106 117.448 115.593 1.855 1
1 1 . 9 1 1 A 2 2 SER C C 2 174.723 174.399 0.324 1
1 2 . 9 1 1 A 2 2 SER CA C 2 58.446 59.038 -0.592 1
1 3 . 9 1 1 A 2 2 SER CB C 2 63.566 61.021 2.545 1
1 4 . 9 1 1 A 3 3 SER H H 3 8.350 7.787 0.563 1
1 5 . 9 1 1 A 3 3 SER C C 3 173.961 174.140 -0.179 1
1 6 . 9 1 1 A 3 3 SER CA C 3 58.428 58.674 -0.246 1
1 7 . 9 1 1 A 3 3 SER CB C 3 63.937 63.451 0.486 1
1 8 . 9 1 1 A 3 3 SER N N 3 117.923 117.772 0.151 1
1 9 . 9 1 1 A 4 4 GLY H H 4 8.050 8.198 -0.148 1
1 10 . 9 1 1 A 4 4 GLY C C 4 179.009 174.797 4.212 1
1 11 . 9 1 1 A 4 4 GLY CA C 4 46.174 46.225 -0.051 1
1 12 . 9 1 1 A 4 4 GLY N N 4 116.890 114.453 2.437 1
1 13 . 9 1 1 A 7 7 GLY HA2 H 7 4.340 4.107 0.233 1
1 14 . 9 1 1 A 7 7 GLY HA3 H 7 3.629 4.108 -0.479 1
1 15 . 9 1 1 A 7 7 GLY CA C 7 44.381 44.919 -0.538 1
1 16 . 9 1 1 A 8 8 PRO HA H 8 4.476 4.517 -0.041 1
1 23 . 9 1 1 A 8 8 PRO C C 8 176.235 177.166 -0.931 1
1 24 . 9 1 1 A 8 8 PRO CA C 8 62.995 62.622 0.373 1
1 25 . 9 1 1 A 8 8 PRO CB C 8 33.266 32.660 0.606 1
1 28 . 9 1 1 A 9 9 GLY H H 9 8.585 8.478 0.107 1
1 29 . 9 1 1 A 9 9 GLY HA2 H 9 4.326 4.115 0.211 1
1 30 . 9 1 1 A 9 9 GLY HA3 H 9 4.009 4.122 -0.113 1
1 31 . 9 1 1 A 9 9 GLY C C 9 172.998 173.442 -0.444 1
1 32 . 9 1 1 A 9 9 GLY CA C 9 44.393 44.206 0.187 1
1 33 . 9 1 1 A 9 9 GLY N N 9 106.004 108.071 -2.067 1
1 34 . 9 1 1 A 10 10 ARG H H 10 8.548 8.391 0.157 1
1 35 . 9 1 1 A 10 10 ARG HA H 10 4.654 4.472 0.182 1
1 41 . 9 1 1 A 10 10 ARG C C 10 175.780 175.501 0.279 1
1 42 . 9 1 1 A 10 10 ARG CA C 10 54.708 55.085 -0.377 1
1 43 . 9 1 1 A 10 10 ARG CB C 10 31.448 30.544 0.904 1
1 45 . 9 1 1 A 10 10 ARG N N 10 119.407 118.700 0.707 1
1 46 . 9 1 1 A 11 11 PRO HA H 11 4.611 4.622 -0.011 1
1 53 . 9 1 1 A 11 11 PRO C C 11 173.510 175.722 -2.212 1
1 54 . 9 1 1 A 11 11 PRO CA C 11 62.360 62.732 -0.372 1
1 55 . 9 1 1 A 11 11 PRO CB C 11 33.402 32.185 1.217 1
1 58 . 9 1 1 A 12 12 THR H H 12 7.572 8.022 -0.450 1
1 59 . 9 1 1 A 12 12 THR HA H 12 3.796 4.353 -0.557 1
1 64 . 9 1 1 A 12 12 THR C C 12 172.337 173.412 -1.075 1
1 65 . 9 1 1 A 12 12 THR CA C 12 61.778 61.640 0.138 1
1 66 . 9 1 1 A 12 12 THR CB C 12 70.561 68.584 1.977 1
1 68 . 9 1 1 A 12 12 THR N N 12 109.653 117.319 -7.666 1
1 69 . 9 1 1 A 13 13 MET H H 13 5.605 8.625 -3.020 1
1 70 . 9 1 1 A 13 13 MET HA H 13 5.091 4.975 0.116 1
1 78 . 9 1 1 A 13 13 MET C C 13 172.639 174.897 -2.258 1
1 79 . 9 1 1 A 13 13 MET CA C 13 54.168 53.828 0.340 1
1 80 . 9 1 1 A 13 13 MET CB C 13 37.632 34.679 2.953 1
1 83 . 9 1 1 A 13 13 MET N N 13 121.634 126.984 -5.350 1
1 84 . 9 1 1 A 14 14 MET H H 14 9.254 9.227 0.027 1
1 85 . 9 1 1 A 14 14 MET HA H 14 4.662 5.061 -0.399 1
1 93 . 9 1 1 A 14 14 MET C C 14 174.388 174.760 -0.372 1
1 94 . 9 1 1 A 14 14 MET CA C 14 54.673 54.499 0.174 1
1 95 . 9 1 1 A 14 14 MET CB C 14 34.907 35.186 -0.279 1
1 98 . 9 1 1 A 14 14 MET N N 14 125.746 123.642 2.104 1
1 99 . 9 1 1 A 15 15 ILE H H 15 8.555 9.132 -0.577 1
1 100 . 9 1 1 A 15 15 ILE HA H 15 4.882 4.892 -0.010 1
1 110 . 9 1 1 A 15 15 ILE C C 15 174.962 175.030 -0.068 1
1 111 . 9 1 1 A 15 15 ILE CA C 15 60.685 60.688 -0.003 1
1 112 . 9 1 1 A 15 15 ILE CB C 15 40.878 39.041 1.837 1
1 116 . 9 1 1 A 15 15 ILE N N 15 121.623 125.861 -4.238 1
1 117 . 9 1 1 A 16 16 SER H H 16 8.703 8.868 -0.165 1
1 118 . 9 1 1 A 16 16 SER HA H 16 4.922 5.083 -0.161 1
1 121 . 9 1 1 A 16 16 SER C C 16 173.860 172.803 1.057 1
1 122 . 9 1 1 A 16 16 SER CA C 16 56.524 57.337 -0.813 1
1 123 . 9 1 1 A 16 16 SER CB C 16 65.004 66.083 -1.079 1
1 124 . 9 1 1 A 16 16 SER N N 16 122.261 124.081 -1.820 1
1 125 . 9 1 1 A 17 17 THR H H 17 8.759 8.614 0.145 1
1 126 . 9 1 1 A 17 17 THR HA H 17 4.885 5.160 -0.275 1
1 131 . 9 1 1 A 17 17 THR C C 17 175.018 174.068 0.950 1
1 132 . 9 1 1 A 17 17 THR CA C 17 60.315 60.327 -0.012 1
1 133 . 9 1 1 A 17 17 THR CB C 17 69.799 70.543 -0.744 1
1 135 . 9 1 1 A 17 17 THR N N 17 115.660 114.335 1.325 1
1 136 . 9 1 1 A 18 18 THR H H 18 8.038 8.728 -0.690 1
1 137 . 9 1 1 A 18 18 THR HA H 18 4.596 4.446 0.150 1
1 142 . 9 1 1 A 18 18 THR CA C 18 60.707 63.680 -2.973 1
1 143 . 9 1 1 A 18 18 THR CB C 18 71.082 71.313 -0.231 1
1 145 . 9 1 1 A 18 18 THR N N 18 112.362 118.246 -5.884 1
1 146 . 9 1 1 A 19 19 ALA H H 19 8.545 7.240 1.305 1
1 147 . 9 1 1 A 19 19 ALA HA H 19 4.412 4.492 -0.080 1
1 151 . 9 1 1 A 19 19 ALA C C 19 177.034 176.935 0.099 1
1 152 . 9 1 1 A 19 19 ALA CA C 19 52.264 51.152 1.112 1
1 153 . 9 1 1 A 19 19 ALA CB C 19 19.292 21.517 -2.225 1
1 154 . 9 1 1 A 19 19 ALA N N 19 119.589 121.082 -1.493 1
1 155 . 9 1 1 A 20 20 MET H H 20 8.145 8.458 -0.313 1
1 156 . 9 1 1 A 20 20 MET HA H 20 4.447 4.534 -0.087 1
1 164 . 9 1 1 A 20 20 MET C C 20 175.676 176.386 -0.710 1
1 165 . 9 1 1 A 20 20 MET CA C 20 55.764 54.474 1.290 1
1 166 . 9 1 1 A 20 20 MET CB C 20 31.495 32.218 -0.723 1
1 169 . 9 1 1 A 20 20 MET N N 20 116.950 118.382 -1.432 1
1 170 . 9 1 1 A 21 21 ASN H H 21 8.275 8.871 -0.596 1
1 171 . 9 1 1 A 21 21 ASN HA H 21 4.452 4.331 0.121 1
1 176 . 9 1 1 A 21 21 ASN C C 21 174.100 173.824 0.276 1
1 177 . 9 1 1 A 21 21 ASN CA C 21 54.320 54.386 -0.066 1
1 178 . 9 1 1 A 21 21 ASN CB C 21 37.234 37.307 -0.073 1
1 179 . 9 1 1 A 21 21 ASN N N 21 113.198 118.583 -5.385 1
1 181 . 9 1 1 A 22 22 THR H H 22 7.071 7.416 -0.345 1
1 182 . 9 1 1 A 22 22 THR HA H 22 5.218 5.372 -0.154 1
1 187 . 9 1 1 A 22 22 THR C C 22 173.301 172.842 0.459 1
1 188 . 9 1 1 A 22 22 THR CA C 22 59.399 60.648 -1.249 1
1 189 . 9 1 1 A 22 22 THR CB C 22 72.714 71.762 0.952 1
1 191 . 9 1 1 A 22 22 THR N N 22 107.603 107.732 -0.129 1
1 192 . 9 1 1 A 23 23 ALA H H 23 8.687 8.708 -0.021 1
1 193 . 9 1 1 A 23 23 ALA HA H 23 4.925 4.994 -0.069 1
1 197 . 9 1 1 A 23 23 ALA C C 23 174.100 175.701 -1.601 1
1 198 . 9 1 1 A 23 23 ALA CA C 23 50.812 50.017 0.795 1
1 199 . 9 1 1 A 23 23 ALA CB C 23 21.122 21.052 0.070 1
1 200 . 9 1 1 A 23 23 ALA N N 23 121.937 126.039 -4.102 1
1 201 . 9 1 1 A 24 24 LEU H H 24 8.833 9.106 -0.273 1
1 202 . 9 1 1 A 24 24 LEU HA H 24 4.673 4.534 0.139 1
1 212 . 9 1 1 A 24 24 LEU C C 24 175.140 174.491 0.649 1
1 213 . 9 1 1 A 24 24 LEU CA C 24 54.320 54.762 -0.442 1
1 214 . 9 1 1 A 24 24 LEU CB C 24 42.518 42.802 -0.284 1
1 218 . 9 1 1 A 24 24 LEU N N 24 123.721 126.956 -3.235 1
1 219 . 9 1 1 A 25 25 LEU H H 25 9.176 8.927 0.249 1
1 220 . 9 1 1 A 25 25 LEU HA H 25 5.112 4.991 0.121 1
1 230 . 9 1 1 A 25 25 LEU C C 25 176.414 175.737 0.677 1
1 231 . 9 1 1 A 25 25 LEU CA C 25 54.108 53.452 0.656 1
1 232 . 9 1 1 A 25 25 LEU CB C 25 43.230 43.716 -0.486 1
1 236 . 9 1 1 A 25 25 LEU N N 25 128.589 129.218 -0.629 1
1 237 . 9 1 1 A 26 26 GLN H H 26 8.556 8.486 0.070 1
1 238 . 9 1 1 A 26 26 GLN HA H 26 4.737 4.930 -0.193 1
1 245 . 9 1 1 A 26 26 GLN C C 26 174.372 174.237 0.135 1
1 246 . 9 1 1 A 26 26 GLN CA C 26 56.365 54.455 1.910 1
1 247 . 9 1 1 A 26 26 GLN CB C 26 33.320 31.786 1.534 1
1 249 . 9 1 1 A 26 26 GLN N N 26 119.630 123.094 -3.464 1
1 251 . 9 1 1 A 27 27 TRP H H 27 8.080 8.327 -0.247 1
1 252 . 9 1 1 A 27 27 TRP HA H 27 5.441 5.840 -0.399 1
1 261 . 9 1 1 A 27 27 TRP CA C 27 55.957 54.525 1.432 1
1 262 . 9 1 1 A 27 27 TRP CB C 27 32.517 32.273 0.244 1
1 268 . 9 1 1 A 27 27 TRP N N 27 121.276 121.634 -0.358 1
1 270 . 9 1 1 A 28 28 HIS H H 28 8.262 8.720 -0.458 1
1 271 . 9 1 1 A 28 28 HIS HA H 28 4.997 5.003 -0.006 1
1 275 . 9 1 1 A 28 28 HIS CA C 28 53.028 53.960 -0.932 1
1 276 . 9 1 1 A 28 28 HIS CB C 28 32.832 32.848 -0.016 1
1 278 . 9 1 1 A 28 28 HIS N N 28 116.245 117.403 -1.158 1
1 279 . 9 1 1 A 29 29 PRO HA H 29 4.984 4.691 0.293 1
1 286 . 9 1 1 A 29 29 PRO CA C 29 61.498 62.077 -0.579 1
1 287 . 9 1 1 A 29 29 PRO CB C 29 30.709 32.223 -1.514 1
1 290 . 9 1 1 A 30 30 PRO HA H 30 4.449 4.684 -0.235 1
1 297 . 9 1 1 A 30 30 PRO C C 30 175.733 176.503 -0.770 1
1 298 . 9 1 1 A 30 30 PRO CA C 30 62.245 62.587 -0.342 1
1 299 . 9 1 1 A 30 30 PRO CB C 30 32.083 33.534 -1.451 1
1 302 . 9 1 1 A 31 31 LYS H H 31 8.403 8.751 -0.348 1
1 303 . 9 1 1 A 31 31 LYS HA H 31 4.084 4.376 -0.292 1
1 312 . 9 1 1 A 31 31 LYS C C 31 177.166 178.235 -1.069 1
1 313 . 9 1 1 A 31 31 LYS CA C 31 57.866 57.730 0.136 1
1 314 . 9 1 1 A 31 31 LYS CB C 31 32.698 33.696 -0.998 1
1 318 . 9 1 1 A 31 31 LYS N N 31 121.693 121.236 0.457 1
1 319 . 9 1 1 A 32 32 GLU H H 32 8.102 7.752 0.350 1
1 320 . 9 1 1 A 32 32 GLU HA H 32 4.365 4.498 -0.133 1
1 325 . 9 1 1 A 32 32 GLU C C 32 174.248 175.720 -1.472 1
1 326 . 9 1 1 A 32 32 GLU CA C 32 55.448 56.112 -0.664 1
1 327 . 9 1 1 A 32 32 GLU CB C 32 29.405 29.996 -0.591 1
1 329 . 9 1 1 A 32 32 GLU N N 32 118.742 116.793 1.949 1
1 330 . 9 1 1 A 33 33 LEU H H 33 8.420 7.536 0.884 1
1 331 . 9 1 1 A 33 33 LEU HA H 33 4.499 4.784 -0.285 1
1 341 . 9 1 1 A 33 33 LEU C C 33 173.036 174.855 -1.819 1
1 342 . 9 1 1 A 33 33 LEU CA C 33 52.863 51.657 1.206 1
1 343 . 9 1 1 A 33 33 LEU CB C 33 42.535 43.536 -1.001 1
1 347 . 9 1 1 A 33 33 LEU N N 33 125.181 123.185 1.996 1
1 348 . 9 1 1 A 34 34 PRO HA H 34 4.488 4.487 0.001 1
1 355 . 9 1 1 A 34 34 PRO C C 34 177.544 176.694 0.850 1
1 356 . 9 1 1 A 34 34 PRO CA C 34 62.889 63.124 -0.235 1
1 357 . 9 1 1 A 34 34 PRO CB C 34 31.472 30.862 0.610 1
1 360 . 9 1 1 A 35 35 GLY H H 35 8.397 8.010 0.387 1
1 361 . 9 1 1 A 35 35 GLY HA2 H 35 4.059 4.129 -0.070 1
1 362 . 9 1 1 A 35 35 GLY HA3 H 35 3.716 4.129 -0.413 1
1 363 . 9 1 1 A 35 35 GLY C C 35 173.356 171.566 1.790 1
1 364 . 9 1 1 A 35 35 GLY CA C 35 45.892 44.741 1.151 1
1 365 . 9 1 1 A 35 35 GLY N N 35 110.524 111.952 -1.428 1
1 366 . 9 1 1 A 36 36 GLU H H 36 8.091 8.704 -0.613 1
1 367 . 9 1 1 A 36 36 GLU HA H 36 4.371 5.138 -0.767 1
1 372 . 9 1 1 A 36 36 GLU C C 36 174.864 175.054 -0.190 1
1 373 . 9 1 1 A 36 36 GLU CA C 36 55.201 54.676 0.525 1
1 374 . 9 1 1 A 36 36 GLU CB C 36 31.878 33.747 -1.869 1
1 376 . 9 1 1 A 36 36 GLU N N 36 122.202 123.337 -1.135 1
1 377 . 9 1 1 A 37 37 LEU H H 37 8.307 8.662 -0.355 1
1 378 . 9 1 1 A 37 37 LEU HA H 37 4.288 4.291 -0.003 1
1 388 . 9 1 1 A 37 37 LEU C C 37 176.702 176.020 0.682 1
1 389 . 9 1 1 A 37 37 LEU CA C 37 55.342 56.246 -0.904 1
1 390 . 9 1 1 A 37 37 LEU CB C 37 42.715 42.338 0.377 1
1 394 . 9 1 1 A 37 37 LEU N N 37 123.204 127.188 -3.984 1
1 395 . 9 1 1 A 38 38 LEU H H 38 8.909 8.699 0.210 1
1 396 . 9 1 1 A 38 38 LEU HA H 38 4.640 4.743 -0.103 1
1 406 . 9 1 1 A 38 38 LEU C C 38 177.202 176.587 0.615 1
1 407 . 9 1 1 A 38 38 LEU CA C 38 54.390 54.912 -0.522 1
1 408 . 9 1 1 A 38 38 LEU CB C 38 43.770 43.463 0.307 1
1 412 . 9 1 1 A 38 38 LEU N N 38 123.021 126.900 -3.879 1
1 413 . 9 1 1 A 39 39 GLY H H 39 7.113 6.939 0.174 1
1 414 . 9 1 1 A 39 39 GLY HA2 H 39 4.816 3.611 1.205 1
1 415 . 9 1 1 A 39 39 GLY HA3 H 39 3.276 3.940 -0.664 1
1 416 . 9 1 1 A 39 39 GLY C C 39 169.863 170.311 -0.448 1
1 417 . 9 1 1 A 39 39 GLY CA C 39 44.622 45.389 -0.767 1
1 418 . 9 1 1 A 39 39 GLY N N 39 104.137 104.392 -0.255 1
1 419 . 9 1 1 A 40 40 TYR H H 40 8.318 8.924 -0.606 1
1 420 . 9 1 1 A 40 40 TYR HA H 40 5.414 5.209 0.205 1
1 425 . 9 1 1 A 40 40 TYR C C 40 174.448 172.226 2.222 1
1 426 . 9 1 1 A 40 40 TYR CA C 40 56.178 56.396 -0.218 1
1 427 . 9 1 1 A 40 40 TYR CB C 40 44.191 40.802 3.389 1
1 430 . 9 1 1 A 40 40 TYR N N 40 114.036 115.258 -1.222 1
1 431 . 9 1 1 A 41 41 ARG H H 41 9.347 8.774 0.573 1
1 432 . 9 1 1 A 41 41 ARG HA H 41 5.092 5.435 -0.343 1
1 440 . 9 1 1 A 41 41 ARG C C 41 174.097 174.022 0.075 1
1 441 . 9 1 1 A 41 41 ARG CA C 41 56.100 54.242 1.858 1
1 442 . 9 1 1 A 41 41 ARG CB C 41 34.508 33.240 1.268 1
1 445 . 9 1 1 A 41 41 ARG N N 41 122.231 121.117 1.114 1
1 447 . 9 1 1 A 42 42 LEU H H 42 9.546 9.182 0.364 1
1 448 . 9 1 1 A 42 42 LEU HA H 42 5.459 5.316 0.143 1
1 458 . 9 1 1 A 42 42 LEU C C 42 174.913 174.698 0.215 1
1 459 . 9 1 1 A 42 42 LEU CA C 42 52.997 53.425 -0.428 1
1 460 . 9 1 1 A 42 42 LEU CB C 42 46.413 45.960 0.453 1
1 464 . 9 1 1 A 42 42 LEU N N 42 132.335 127.108 5.227 1
1 465 . 9 1 1 A 43 43 GLN H H 43 9.502 9.254 0.248 1
1 466 . 9 1 1 A 43 43 GLN HA H 43 5.847 5.266 0.581 1
1 473 . 9 1 1 A 43 43 GLN C C 43 175.329 173.817 1.512 1
1 474 . 9 1 1 A 43 43 GLN CA C 43 54.005 54.493 -0.488 1
1 475 . 9 1 1 A 43 43 GLN CB C 43 33.429 31.615 1.814 1
1 477 . 9 1 1 A 43 43 GLN N N 43 123.932 125.177 -1.245 1
1 479 . 9 1 1 A 44 44 TYR H H 44 8.615 8.552 0.063 1
1 480 . 9 1 1 A 44 44 TYR HA H 44 5.783 5.791 -0.008 1
1 487 . 9 1 1 A 44 44 TYR C C 44 174.058 173.592 0.466 1
1 488 . 9 1 1 A 44 44 TYR CA C 44 55.942 55.571 0.371 1
1 489 . 9 1 1 A 44 44 TYR CB C 44 43.052 41.791 1.261 1
1 494 . 9 1 1 A 44 44 TYR N N 44 117.355 119.897 -2.542 1
1 495 . 9 1 1 A 45 45 CYS H H 45 8.377 8.286 0.091 1
1 496 . 9 1 1 A 45 45 CYS HA H 45 4.772 5.107 -0.335 1
1 499 . 9 1 1 A 45 45 CYS C C 45 173.205 173.811 -0.606 1
1 500 . 9 1 1 A 45 45 CYS CA C 45 55.960 56.816 -0.856 1
1 501 . 9 1 1 A 45 45 CYS CB C 45 30.665 31.215 -0.550 1
1 502 . 9 1 1 A 45 45 CYS N N 45 115.140 118.805 -3.665 1
1 503 . 9 1 1 A 46 46 ARG H H 46 9.165 8.241 0.924 1
1 504 . 9 1 1 A 46 46 ARG HA H 46 4.068 3.896 0.172 1
1 511 . 9 1 1 A 46 46 ARG C C 46 178.440 177.407 1.033 1
1 512 . 9 1 1 A 46 46 ARG CA C 46 56.401 56.125 0.276 1
1 513 . 9 1 1 A 46 46 ARG CB C 46 31.878 31.104 0.774 1
1 516 . 9 1 1 A 46 46 ARG N N 46 121.803 121.238 0.565 1
1 517 . 9 1 1 A 47 47 ALA H H 47 8.273 8.181 0.092 1
1 518 . 9 1 1 A 47 47 ALA HA H 47 3.891 4.179 -0.288 1
1 522 . 9 1 1 A 47 47 ALA C C 47 177.599 177.415 0.184 1
1 523 . 9 1 1 A 47 47 ALA CA C 47 54.796 53.318 1.478 1
1 524 . 9 1 1 A 47 47 ALA CB C 47 18.287 18.567 -0.280 1
1 525 . 9 1 1 A 47 47 ALA N N 47 123.895 123.850 0.045 1
1 526 . 9 1 1 A 48 48 ASP H H 48 8.036 8.156 -0.120 1
1 527 . 9 1 1 A 48 48 ASP HA H 48 4.453 4.813 -0.360 1
1 530 . 9 1 1 A 48 48 ASP C C 48 175.836 176.033 -0.197 1
1 531 . 9 1 1 A 48 48 ASP CA C 48 53.368 53.441 -0.073 1
1 532 . 9 1 1 A 48 48 ASP CB C 48 39.964 42.133 -2.169 1
1 533 . 9 1 1 A 48 48 ASP N N 48 112.576 117.644 -5.068 1
1 534 . 9 1 1 A 49 49 GLU H H 49 7.495 7.410 0.085 1
1 535 . 9 1 1 A 49 49 GLU HA H 49 4.308 4.415 -0.107 1
1 540 . 9 1 1 A 49 49 GLU C C 49 175.756 175.978 -0.222 1
1 541 . 9 1 1 A 49 49 GLU CA C 49 56.224 55.411 0.813 1
1 542 . 9 1 1 A 49 49 GLU CB C 49 32.248 30.684 1.564 1
1 544 . 9 1 1 A 49 49 GLU N N 49 120.609 119.374 1.235 1
1 545 . 9 1 1 A 50 50 ALA H H 50 8.416 8.486 -0.070 1
1 546 . 9 1 1 A 50 50 ALA HA H 50 4.200 4.519 -0.319 1
1 550 . 9 1 1 A 50 50 ALA C C 50 177.433 176.626 0.807 1
1 551 . 9 1 1 A 50 50 ALA CA C 50 53.297 52.099 1.198 1
1 552 . 9 1 1 A 50 50 ALA CB C 50 19.474 20.575 -1.101 1
1 553 . 9 1 1 A 50 50 ALA N N 50 124.065 123.521 0.544 1
1 554 . 9 1 1 A 51 51 ARG H H 51 7.648 7.666 -0.018 1
1 555 . 9 1 1 A 51 51 ARG HA H 51 4.747 4.597 0.150 1
1 562 . 9 1 1 A 51 51 ARG C C 51 173.400 173.532 -0.132 1
1 563 . 9 1 1 A 51 51 ARG CA C 51 52.592 52.547 0.045 1
1 564 . 9 1 1 A 51 51 ARG CB C 51 31.212 30.991 0.221 1
1 567 . 9 1 1 A 51 51 ARG N N 51 117.798 118.785 -0.987 1
1 568 . 9 1 1 A 52 52 PRO HA H 52 4.212 4.438 -0.226 1
1 575 . 9 1 1 A 52 52 PRO C C 52 176.380 176.427 -0.047 1
1 576 . 9 1 1 A 52 52 PRO CA C 52 62.360 62.632 -0.272 1
1 577 . 9 1 1 A 52 52 PRO CB C 52 32.331 32.062 0.269 1
1 580 . 9 1 1 A 53 53 ASN H H 53 8.127 8.216 -0.089 1
1 581 . 9 1 1 A 53 53 ASN HA H 53 4.651 4.754 -0.103 1
1 586 . 9 1 1 A 53 53 ASN C C 53 174.354 174.554 -0.200 1
1 587 . 9 1 1 A 53 53 ASN CA C 53 53.136 52.550 0.586 1
1 588 . 9 1 1 A 53 53 ASN CB C 53 39.666 38.107 1.559 1
1 589 . 9 1 1 A 53 53 ASN N N 53 119.405 120.011 -0.606 1
1 591 . 9 1 1 A 54 54 THR H H 54 8.425 8.564 -0.139 1
1 592 . 9 1 1 A 54 54 THR HA H 54 5.306 4.482 0.824 1
1 597 . 9 1 1 A 54 54 THR C C 54 173.850 174.443 -0.593 1
1 598 . 9 1 1 A 54 54 THR CA C 54 61.881 63.669 -1.788 1
1 599 . 9 1 1 A 54 54 THR CB C 54 70.573 69.209 1.364 1
1 601 . 9 1 1 A 54 54 THR N N 54 118.968 121.668 -2.700 1
1 602 . 9 1 1 A 55 55 ILE H H 55 9.354 8.730 0.624 1
1 603 . 9 1 1 A 55 55 ILE HA H 55 4.051 4.506 -0.455 1
1 613 . 9 1 1 A 55 55 ILE C C 55 172.975 173.450 -0.475 1
1 614 . 9 1 1 A 55 55 ILE CA C 55 61.003 59.763 1.240 1
1 615 . 9 1 1 A 55 55 ILE CB C 55 41.619 42.009 -0.390 1
1 619 . 9 1 1 A 55 55 ILE N N 55 127.961 126.342 1.619 1
1 620 . 9 1 1 A 56 56 ASP H H 56 8.132 8.693 -0.561 1
1 621 . 9 1 1 A 56 56 ASP HA H 56 5.334 5.291 0.043 1
1 624 . 9 1 1 A 56 56 ASP C C 56 174.969 174.748 0.221 1
1 625 . 9 1 1 A 56 56 ASP CA C 56 53.702 52.785 0.917 1
1 626 . 9 1 1 A 56 56 ASP CB C 56 43.251 42.898 0.353 1
1 627 . 9 1 1 A 56 56 ASP N N 56 125.882 126.929 -1.047 1
1 628 . 9 1 1 A 57 57 PHE H H 57 8.955 8.808 0.147 1
1 629 . 9 1 1 A 57 57 PHE HA H 57 4.915 5.010 -0.095 1
1 637 . 9 1 1 A 57 57 PHE C C 57 177.361 175.535 1.826 1
1 638 . 9 1 1 A 57 57 PHE CA C 57 57.458 56.653 0.805 1
1 639 . 9 1 1 A 57 57 PHE CB C 57 43.737 43.424 0.313 1
1 645 . 9 1 1 A 57 57 PHE N N 57 118.872 122.622 -3.750 1
1 646 . 9 1 1 A 58 58 GLY H H 58 9.552 8.738 0.814 1
1 647 . 9 1 1 A 58 58 GLY HA2 H 58 4.662 4.120 0.542 1
1 648 . 9 1 1 A 58 58 GLY HA3 H 58 4.126 4.181 -0.055 1
1 649 . 9 1 1 A 58 58 GLY C C 58 174.760 174.952 -0.192 1
1 650 . 9 1 1 A 58 58 GLY CA C 58 44.680 45.126 -0.446 1
1 651 . 9 1 1 A 58 58 GLY N N 58 111.551 110.033 1.518 1
1 652 . 9 1 1 A 59 59 LYS H H 59 8.211 8.685 -0.474 1
1 653 . 9 1 1 A 59 59 LYS HA H 59 3.782 3.653 0.129 1
1 662 . 9 1 1 A 59 59 LYS C C 59 176.154 178.304 -2.150 1
1 663 . 9 1 1 A 59 59 LYS CA C 59 59.080 58.803 0.277 1
1 664 . 9 1 1 A 59 59 LYS CB C 59 32.516 31.760 0.756 1
1 668 . 9 1 1 A 59 59 LYS N N 59 115.953 120.506 -4.553 1
1 669 . 9 1 1 A 60 60 ASP H H 60 8.634 8.081 0.553 1
1 670 . 9 1 1 A 60 60 ASP HA H 60 4.882 4.403 0.479 1
1 673 . 9 1 1 A 60 60 ASP C C 60 176.039 176.094 -0.055 1
1 674 . 9 1 1 A 60 60 ASP CA C 60 54.327 57.258 -2.931 1
1 675 . 9 1 1 A 60 60 ASP CB C 60 41.461 41.110 0.351 1
1 676 . 9 1 1 A 60 60 ASP N N 60 117.261 120.062 -2.801 1
1 677 . 9 1 1 A 61 61 ASP H H 61 7.500 8.361 -0.861 1
1 678 . 9 1 1 A 61 61 ASP HA H 61 4.591 4.709 -0.118 1
1 681 . 9 1 1 A 61 61 ASP C C 61 175.140 175.767 -0.627 1
1 682 . 9 1 1 A 61 61 ASP CA C 61 55.342 53.607 1.735 1
1 683 . 9 1 1 A 61 61 ASP CB C 61 42.475 39.599 2.876 1
1 684 . 9 1 1 A 61 61 ASP N N 61 122.319 118.980 3.339 1
1 685 . 9 1 1 A 62 62 GLN H H 62 8.239 7.993 0.246 1
1 686 . 9 1 1 A 62 62 GLN HA H 62 2.569 3.572 -1.003 1
1 693 . 9 1 1 A 62 62 GLN C C 62 172.652 173.928 -1.276 1
1 694 . 9 1 1 A 62 62 GLN CA C 62 54.038 55.599 -1.561 1
1 695 . 9 1 1 A 62 62 GLN CB C 62 31.481 29.223 2.258 1
1 697 . 9 1 1 A 62 62 GLN N N 62 117.458 123.130 -5.672 1
1 699 . 9 1 1 A 63 63 HIS H H 63 6.338 6.811 -0.473 1
1 700 . 9 1 1 A 63 63 HIS HA H 63 4.423 4.576 -0.153 1
1 704 . 9 1 1 A 63 63 HIS C C 63 173.031 172.666 0.365 1
1 705 . 9 1 1 A 63 63 HIS CA C 63 54.743 54.063 0.680 1
1 706 . 9 1 1 A 63 63 HIS CB C 63 32.661 31.407 1.254 1
1 708 . 9 1 1 A 63 63 HIS N N 63 113.589 115.882 -2.293 1
1 709 . 9 1 1 A 64 64 PHE H H 64 8.549 8.763 -0.214 1
1 710 . 9 1 1 A 64 64 PHE HA H 64 4.578 5.203 -0.625 1
1 718 . 9 1 1 A 64 64 PHE C C 64 173.015 173.820 -0.805 1
1 719 . 9 1 1 A 64 64 PHE CA C 64 58.516 56.569 1.947 1
1 720 . 9 1 1 A 64 64 PHE CB C 64 43.525 42.960 0.565 1
1 726 . 9 1 1 A 64 64 PHE N N 64 118.214 120.865 -2.651 1
1 727 . 9 1 1 A 65 65 THR H H 65 7.150 8.329 -1.179 1
1 728 . 9 1 1 A 65 65 THR HA H 65 4.930 4.556 0.374 1
1 733 . 9 1 1 A 65 65 THR C C 65 172.457 173.796 -1.339 1
1 734 . 9 1 1 A 65 65 THR CA C 65 61.690 62.109 -0.419 1
1 735 . 9 1 1 A 65 65 THR CB C 65 69.593 68.927 0.666 1
1 737 . 9 1 1 A 65 65 THR N N 65 123.198 120.976 2.222 1
1 738 . 9 1 1 A 66 66 VAL H H 66 8.888 8.507 0.381 1
1 739 . 9 1 1 A 66 66 VAL HA H 66 4.018 4.694 -0.676 1
1 747 . 9 1 1 A 66 66 VAL C C 66 174.868 175.463 -0.595 1
1 748 . 9 1 1 A 66 66 VAL CA C 66 61.178 60.705 0.473 1
1 749 . 9 1 1 A 66 66 VAL CB C 66 33.114 33.049 0.065 1
1 752 . 9 1 1 A 66 66 VAL N N 66 126.840 128.140 -1.300 1
1 753 . 9 1 1 A 67 67 THR H H 67 8.174 8.516 -0.342 1
1 754 . 9 1 1 A 67 67 THR HA H 67 4.816 5.081 -0.265 1
1 759 . 9 1 1 A 67 67 THR C C 67 174.494 174.251 0.243 1
1 760 . 9 1 1 A 67 67 THR CA C 67 59.786 59.536 0.250 1
1 761 . 9 1 1 A 67 67 THR CB C 67 70.887 71.652 -0.765 1
1 763 . 9 1 1 A 67 67 THR N N 67 116.127 117.126 -0.999 1
1 764 . 9 1 1 A 68 68 GLY H H 68 8.570 8.751 -0.181 1
1 765 . 9 1 1 A 68 68 GLY HA2 H 68 3.970 4.013 -0.043 1
1 766 . 9 1 1 A 68 68 GLY HA3 H 68 3.819 4.014 -0.195 1
1 767 . 9 1 1 A 68 68 GLY C C 68 175.636 174.671 0.965 1
1 768 . 9 1 1 A 68 68 GLY CA C 68 46.397 45.081 1.316 1
1 769 . 9 1 1 A 68 68 GLY N N 68 107.146 113.113 -5.967 1
1 770 . 9 1 1 A 69 69 LEU H H 69 8.007 7.246 0.761 1
1 771 . 9 1 1 A 69 69 LEU HA H 69 4.154 4.213 -0.059 1
1 781 . 9 1 1 A 69 69 LEU C C 69 176.830 176.380 0.450 1
1 782 . 9 1 1 A 69 69 LEU CA C 69 54.602 54.880 -0.278 1
1 783 . 9 1 1 A 69 69 LEU CB C 69 41.149 42.098 -0.949 1
1 787 . 9 1 1 A 69 69 LEU N N 69 118.433 122.990 -4.557 1
1 788 . 9 1 1 A 70 70 HIS H H 70 8.866 8.737 0.129 1
1 789 . 9 1 1 A 70 70 HIS HA H 70 4.663 4.676 -0.013 1
1 793 . 9 1 1 A 70 70 HIS C C 70 176.667 175.524 1.143 1
1 794 . 9 1 1 A 70 70 HIS CA C 70 55.464 57.137 -1.673 1
1 795 . 9 1 1 A 70 70 HIS CB C 70 32.125 30.254 1.871 1
1 797 . 9 1 1 A 70 70 HIS N N 70 122.457 123.310 -0.853 1
1 798 . 9 1 1 A 71 71 LYS H H 71 8.716 8.802 -0.086 1
1 799 . 9 1 1 A 71 71 LYS HA H 71 4.320 4.298 0.022 1
1 808 . 9 1 1 A 71 71 LYS C C 71 178.110 177.653 0.457 1
1 809 . 9 1 1 A 71 71 LYS CA C 71 57.035 57.967 -0.932 1
1 810 . 9 1 1 A 71 71 LYS CB C 71 33.580 32.943 0.637 1
1 814 . 9 1 1 A 71 71 LYS N N 71 123.173 123.084 0.089 1
1 815 . 9 1 1 A 72 72 GLY H H 72 7.709 8.909 -1.200 1
1 816 . 9 1 1 A 72 72 GLY HA2 H 72 3.800 3.907 -0.107 1
1 817 . 9 1 1 A 72 72 GLY HA3 H 72 3.769 3.914 -0.145 1
1 818 . 9 1 1 A 72 72 GLY C C 72 174.231 173.861 0.370 1
1 819 . 9 1 1 A 72 72 GLY CA C 72 47.866 46.390 1.476 1
1 820 . 9 1 1 A 72 72 GLY N N 72 114.881 111.887 2.994 1
1 821 . 9 1 1 A 73 73 THR H H 73 8.162 7.550 0.612 1
1 822 . 9 1 1 A 73 73 THR HA H 73 4.584 4.669 -0.085 1
1 827 . 9 1 1 A 73 73 THR C C 73 172.208 173.413 -1.205 1
1 828 . 9 1 1 A 73 73 THR CA C 73 62.307 61.200 1.107 1
1 829 . 9 1 1 A 73 73 THR CB C 73 72.123 71.850 0.273 1
1 831 . 9 1 1 A 73 73 THR N N 73 114.225 114.408 -0.183 1
1 832 . 9 1 1 A 74 74 THR H H 74 8.743 8.668 0.075 1
1 833 . 9 1 1 A 74 74 THR HA H 74 5.138 4.953 0.185 1
1 838 . 9 1 1 A 74 74 THR C C 74 173.376 173.162 0.214 1
1 839 . 9 1 1 A 74 74 THR CA C 74 62.724 62.682 0.042 1
1 840 . 9 1 1 A 74 74 THR CB C 74 69.202 69.918 -0.716 1
1 842 . 9 1 1 A 74 74 THR N N 74 123.376 121.343 2.033 1
1 843 . 9 1 1 A 75 75 TYR H H 75 9.549 9.248 0.301 1
1 844 . 9 1 1 A 75 75 TYR HA H 75 4.892 5.211 -0.319 1
1 851 . 9 1 1 A 75 75 TYR C C 75 173.991 175.237 -1.246 1
1 852 . 9 1 1 A 75 75 TYR CA C 75 57.740 55.972 1.768 1
1 853 . 9 1 1 A 75 75 TYR CB C 75 44.580 43.501 1.079 1
1 858 . 9 1 1 A 75 75 TYR N N 75 126.916 123.415 3.501 1
1 859 . 9 1 1 A 76 76 ILE H H 76 8.769 8.794 -0.025 1
1 860 . 9 1 1 A 76 76 ILE HA H 76 4.663 4.926 -0.263 1
1 870 . 9 1 1 A 76 76 ILE C C 76 174.683 175.281 -0.598 1
1 871 . 9 1 1 A 76 76 ILE CA C 76 60.455 60.759 -0.304 1
1 872 . 9 1 1 A 76 76 ILE CB C 76 40.284 39.991 0.293 1
1 876 . 9 1 1 A 76 76 ILE N N 76 119.407 120.831 -1.424 1
1 877 . 9 1 1 A 77 77 PHE H H 77 8.894 9.078 -0.184 1
1 878 . 9 1 1 A 77 77 PHE HA H 77 5.160 5.080 0.080 1
1 886 . 9 1 1 A 77 77 PHE C C 77 174.794 175.572 -0.778 1
1 887 . 9 1 1 A 77 77 PHE CA C 77 56.831 57.662 -0.831 1
1 888 . 9 1 1 A 77 77 PHE CB C 77 43.132 40.977 2.155 1
1 894 . 9 1 1 A 77 77 PHE N N 77 124.622 127.372 -2.750 1
1 895 . 9 1 1 A 78 78 ARG H H 78 9.407 8.972 0.435 1
1 896 . 9 1 1 A 78 78 ARG HA H 78 5.689 5.772 -0.083 1
1 904 . 9 1 1 A 78 78 ARG C C 78 174.376 174.577 -0.201 1
1 905 . 9 1 1 A 78 78 ARG CA C 78 54.530 54.744 -0.214 1
1 906 . 9 1 1 A 78 78 ARG CB C 78 34.473 33.710 0.763 1
1 909 . 9 1 1 A 78 78 ARG N N 78 120.055 121.196 -1.141 1
1 911 . 9 1 1 A 79 79 LEU H H 79 9.132 8.912 0.220 1
1 912 . 9 1 1 A 79 79 LEU HA H 79 5.398 5.111 0.287 1
1 922 . 9 1 1 A 79 79 LEU C C 79 174.006 174.328 -0.322 1
1 923 . 9 1 1 A 79 79 LEU CA C 79 53.401 53.325 0.076 1
1 924 . 9 1 1 A 79 79 LEU CB C 79 48.116 46.571 1.545 1
1 928 . 9 1 1 A 79 79 LEU N N 79 124.907 124.937 -0.030 1
1 929 . 9 1 1 A 80 80 ALA H H 80 8.737 7.905 0.832 1
1 930 . 9 1 1 A 80 80 ALA HA H 80 4.871 4.959 -0.088 1
1 934 . 9 1 1 A 80 80 ALA C C 80 176.057 175.756 0.301 1
1 935 . 9 1 1 A 80 80 ALA CA C 80 50.353 51.273 -0.920 1
1 936 . 9 1 1 A 80 80 ALA CB C 80 23.972 23.200 0.772 1
1 937 . 9 1 1 A 80 80 ALA N N 80 128.220 125.372 2.848 1
1 938 . 9 1 1 A 81 81 ALA H H 81 9.890 8.634 1.256 1
1 939 . 9 1 1 A 81 81 ALA HA H 81 4.794 4.966 -0.172 1
1 943 . 9 1 1 A 81 81 ALA C C 81 174.655 176.344 -1.689 1
1 944 . 9 1 1 A 81 81 ALA CA C 81 50.300 51.362 -1.062 1
1 945 . 9 1 1 A 81 81 ALA CB C 81 21.369 20.624 0.745 1
1 946 . 9 1 1 A 81 81 ALA N N 81 123.682 123.604 0.078 1
1 947 . 9 1 1 A 82 82 LYS H H 82 7.965 8.582 -0.617 1
1 948 . 9 1 1 A 82 82 LYS HA H 82 4.974 5.316 -0.342 1
1 957 . 9 1 1 A 82 82 LYS C C 82 175.671 175.082 0.589 1
1 958 . 9 1 1 A 82 82 LYS CA C 82 54.664 54.845 -0.181 1
1 959 . 9 1 1 A 82 82 LYS CB C 82 36.677 35.630 1.047 1
1 963 . 9 1 1 A 82 82 LYS N N 82 118.164 122.338 -4.174 1
1 964 . 9 1 1 A 83 83 ASN H H 83 8.663 8.903 -0.240 1
1 965 . 9 1 1 A 83 83 ASN HA H 83 5.113 5.077 0.036 1
1 970 . 9 1 1 A 83 83 ASN C C 83 176.582 176.460 0.122 1
1 971 . 9 1 1 A 83 83 ASN CA C 83 51.746 50.728 1.018 1
1 972 . 9 1 1 A 83 83 ASN CB C 83 40.357 40.179 0.178 1
1 973 . 9 1 1 A 83 83 ASN N N 83 124.784 124.291 0.493 1
1 975 . 9 1 1 A 84 84 ARG H H 84 8.873 8.760 0.113 1
1 976 . 9 1 1 A 84 84 ARG HA H 84 3.940 3.921 0.019 1
1 983 . 9 1 1 A 84 84 ARG C C 84 176.735 178.210 -1.475 1
1 984 . 9 1 1 A 84 84 ARG CA C 84 59.327 59.938 -0.611 1
1 985 . 9 1 1 A 84 84 ARG CB C 84 29.282 29.998 -0.716 1
1 988 . 9 1 1 A 84 84 ARG N N 84 117.891 119.246 -1.355 1
1 989 . 9 1 1 A 85 85 ALA H H 85 7.645 7.824 -0.179 1
1 990 . 9 1 1 A 85 85 ALA HA H 85 4.276 4.188 0.088 1
1 994 . 9 1 1 A 85 85 ALA C C 85 177.479 177.395 0.084 1
1 995 . 9 1 1 A 85 85 ALA CA C 85 52.818 53.082 -0.264 1
1 996 . 9 1 1 A 85 85 ALA CB C 85 18.806 19.562 -0.756 1
1 997 . 9 1 1 A 85 85 ALA N N 85 120.306 120.750 -0.444 1
1 998 . 9 1 1 A 86 86 GLY H H 86 7.693 7.476 0.217 1
1 999 . 9 1 1 A 86 86 GLY HA2 H 86 4.456 4.131 0.325 1
1 1000 . 9 1 1 A 86 86 GLY HA3 H 86 3.649 4.132 -0.483 1
1 1001 . 9 1 1 A 86 86 GLY C C 86 172.068 172.475 -0.407 1
1 1002 . 9 1 1 A 86 86 GLY CA C 86 44.375 44.129 0.246 1
1 1003 . 9 1 1 A 86 86 GLY N N 86 106.594 103.919 2.675 1
1 1004 . 9 1 1 A 87 87 LEU H H 87 8.203 8.462 -0.259 1
1 1005 . 9 1 1 A 87 87 LEU HA H 87 4.629 4.705 -0.076 1
1 1015 . 9 1 1 A 87 87 LEU C C 87 179.155 176.506 2.649 1
1 1016 . 9 1 1 A 87 87 LEU CA C 87 54.814 55.171 -0.357 1
1 1017 . 9 1 1 A 87 87 LEU CB C 87 43.454 42.609 0.845 1
1 1021 . 9 1 1 A 87 87 LEU N N 87 120.879 122.305 -1.426 1
1 1022 . 9 1 1 A 88 88 GLY H H 88 8.492 8.417 0.075 1
1 1023 . 9 1 1 A 88 88 GLY HA2 H 88 4.339 4.186 0.153 1
1 1024 . 9 1 1 A 88 88 GLY HA3 H 88 4.122 4.194 -0.072 1
1 1025 . 9 1 1 A 88 88 GLY C C 88 173.030 173.308 -0.278 1
1 1026 . 9 1 1 A 88 88 GLY CA C 88 43.970 44.665 -0.695 1
1 1027 . 9 1 1 A 88 88 GLY N N 88 109.903 109.844 0.059 1
1 1028 . 9 1 1 A 89 89 GLU H H 89 7.638 8.990 -1.352 1
1 1029 . 9 1 1 A 89 89 GLU HA H 89 4.103 4.304 -0.201 1
1 1034 . 9 1 1 A 89 89 GLU C C 89 177.511 175.790 1.721 1
1 1035 . 9 1 1 A 89 89 GLU CA C 89 56.659 57.066 -0.407 1
1 1036 . 9 1 1 A 89 89 GLU CB C 89 31.324 30.750 0.574 1
1 1038 . 9 1 1 A 89 89 GLU N N 89 117.551 121.718 -4.167 1
1 1039 . 9 1 1 A 90 90 GLU H H 90 8.734 9.046 -0.312 1
1 1040 . 9 1 1 A 90 90 GLU HA H 90 4.651 5.361 -0.710 1
1 1045 . 9 1 1 A 90 90 GLU C C 90 177.452 174.151 3.301 1
1 1046 . 9 1 1 A 90 90 GLU CA C 90 55.987 54.661 1.326 1
1 1047 . 9 1 1 A 90 90 GLU CB C 90 31.135 33.425 -2.290 1
1 1049 . 9 1 1 A 90 90 GLU N N 90 121.553 117.968 3.585 1
1 1050 . 9 1 1 A 91 91 PHE H H 91 9.411 8.956 0.455 1
1 1051 . 9 1 1 A 91 91 PHE HA H 91 4.665 5.200 -0.535 1
1 1059 . 9 1 1 A 91 91 PHE C C 91 173.944 173.662 0.282 1
1 1060 . 9 1 1 A 91 91 PHE CA C 91 57.687 56.548 1.139 1
1 1061 . 9 1 1 A 91 91 PHE CB C 91 40.890 41.992 -1.102 1
1 1067 . 9 1 1 A 91 91 PHE N N 91 125.459 124.798 0.661 1
1 1068 . 9 1 1 A 92 92 GLU H H 92 8.043 8.594 -0.551 1
1 1069 . 9 1 1 A 92 92 GLU HA H 92 5.424 5.360 0.064 1
1 1074 . 9 1 1 A 92 92 GLU C C 92 174.295 174.709 -0.414 1
1 1075 . 9 1 1 A 92 92 GLU CA C 92 54.378 54.909 -0.531 1
1 1076 . 9 1 1 A 92 92 GLU CB C 92 33.662 32.865 0.797 1
1 1078 . 9 1 1 A 92 92 GLU N N 92 128.905 127.760 1.145 1
1 1079 . 9 1 1 A 93 93 LYS H H 93 9.142 8.982 0.160 1
1 1080 . 9 1 1 A 93 93 LYS HA H 93 4.541 5.311 -0.770 1
1 1089 . 9 1 1 A 93 93 LYS C C 93 173.366 174.067 -0.701 1
1 1090 . 9 1 1 A 93 93 LYS CA C 93 55.343 55.104 0.239 1
1 1091 . 9 1 1 A 93 93 LYS CB C 93 37.317 36.346 0.971 1
1 1095 . 9 1 1 A 93 93 LYS N N 93 125.231 127.585 -2.354 1
1 1096 . 9 1 1 A 94 94 GLU H H 94 8.655 9.193 -0.538 1
1 1097 . 9 1 1 A 94 94 GLU HA H 94 5.558 5.417 0.141 1
1 1102 . 9 1 1 A 94 94 GLU C C 94 176.238 175.894 0.344 1
1 1103 . 9 1 1 A 94 94 GLU CA C 94 54.632 55.443 -0.811 1
1 1104 . 9 1 1 A 94 94 GLU CB C 94 32.166 32.002 0.164 1
1 1106 . 9 1 1 A 94 94 GLU N N 94 127.232 127.863 -0.631 1
1 1107 . 9 1 1 A 95 95 ILE H H 95 9.302 9.016 0.286 1
1 1108 . 9 1 1 A 95 95 ILE HA H 95 4.794 5.155 -0.361 1
1 1118 . 9 1 1 A 95 95 ILE C C 95 173.138 174.391 -1.253 1
1 1119 . 9 1 1 A 95 95 ILE CA C 95 58.570 58.297 0.273 1
1 1120 . 9 1 1 A 95 95 ILE CB C 95 42.420 42.807 -0.387 1
1 1124 . 9 1 1 A 95 95 ILE N N 95 120.711 120.443 0.268 1
1 1125 . 9 1 1 A 96 96 ARG H H 96 8.589 8.735 -0.146 1
1 1126 . 9 1 1 A 96 96 ARG HA H 96 5.373 4.762 0.611 1
1 1133 . 9 1 1 A 96 96 ARG C C 96 177.147 175.036 2.111 1
1 1134 . 9 1 1 A 96 96 ARG CA C 96 54.045 55.278 -1.233 1
1 1135 . 9 1 1 A 96 96 ARG CB C 96 32.001 33.840 -1.839 1
1 1138 . 9 1 1 A 96 96 ARG N N 96 124.445 122.002 2.443 1
1 1139 . 9 1 1 A 97 97 THR H H 97 9.243 8.537 0.706 1
1 1140 . 9 1 1 A 97 97 THR HA H 97 4.459 4.598 -0.139 1
1 1145 . 9 1 1 A 97 97 THR C C 97 172.745 173.857 -1.112 1
1 1146 . 9 1 1 A 97 97 THR CA C 97 59.637 60.589 -0.952 1
1 1147 . 9 1 1 A 97 97 THR CB C 97 67.687 69.012 -1.325 1
1 1149 . 9 1 1 A 97 97 THR N N 97 119.370 118.571 0.799 1
1 1150 . 9 1 1 A 98 98 PRO HA H 98 4.494 4.681 -0.187 1
1 1157 . 9 1 1 A 98 98 PRO CA C 98 63.117 62.727 0.390 1
1 1158 . 9 1 1 A 98 98 PRO CB C 98 32.500 31.683 0.817 1
1 1161 . 9 1 1 A 99 99 GLU H H 99 8.534 8.439 0.095 1
1 1162 . 9 1 1 A 99 99 GLU HA H 99 4.195 4.337 -0.142 1
1 1167 . 9 1 1 A 99 99 GLU C C 99 175.881 175.984 -0.103 1
1 1168 . 9 1 1 A 99 99 GLU CA C 99 56.330 56.590 -0.260 1
1 1169 . 9 1 1 A 99 99 GLU CB C 99 31.062 30.461 0.601 1
1 1171 . 9 1 1 A 99 99 GLU N N 99 119.688 120.617 -0.929 1
1 1172 . 9 1 1 A 100 100 ASP H H 100 8.536 8.753 -0.217 1
1 1173 . 9 1 1 A 100 100 ASP HA H 100 4.607 4.754 -0.147 1
1 1176 . 9 1 1 A 100 100 ASP C C 100 176.012 176.299 -0.287 1
1 1177 . 9 1 1 A 100 100 ASP CA C 100 54.109 55.463 -1.354 1
1 1178 . 9 1 1 A 100 100 ASP CB C 100 41.562 42.459 -0.897 1
1 1179 . 9 1 1 A 100 100 ASP N N 100 119.803 120.142 -0.339 1
1 1180 . 9 1 1 A 101 101 LEU H H 101 8.403 7.574 0.829 1
1 1181 . 9 1 1 A 101 101 LEU HA H 101 4.426 4.186 0.240 1
1 1191 . 9 1 1 A 101 101 LEU C C 101 177.534 175.549 1.985 1
1 1192 . 9 1 1 A 101 101 LEU CA C 101 55.113 55.996 -0.883 1
1 1193 . 9 1 1 A 101 101 LEU CB C 101 42.156 42.428 -0.272 1
1 1197 . 9 1 1 A 101 101 LEU N N 101 123.876 120.472 3.404 1
1 1198 . 9 1 1 A 102 102 SER H H 102 8.413 8.777 -0.364 1
1 1199 . 9 1 1 A 102 102 SER HA H 102 4.434 5.184 -0.750 1
1 1202 . 9 1 1 A 102 102 SER C C 102 174.674 174.125 0.549 1
1 1203 . 9 1 1 A 102 102 SER CA C 102 58.798 57.274 1.524 1
1 1204 . 9 1 1 A 102 102 SER CB C 102 63.854 66.150 -2.296 1
1 1205 . 9 1 1 A 102 102 SER N N 102 116.667 124.780 -8.113 1
1 1206 . 9 1 1 A 103 103 GLY H H 103 8.213 8.420 -0.207 1
1 1207 . 9 1 1 A 103 103 GLY HA2 H 103 4.164 4.218 -0.054 1
1 1208 . 9 1 1 A 103 103 GLY HA3 H 103 4.057 4.219 -0.162 1
1 1209 . 9 1 1 A 103 103 GLY C C 103 171.822 173.014 -1.192 1
1 1210 . 9 1 1 A 103 103 GLY CA C 103 44.658 43.719 0.939 1
1 1211 . 9 1 1 A 103 103 GLY N N 103 110.592 109.195 1.397 1
1 1212 . 9 1 1 A 104 104 PRO HA H 104 4.475 4.720 -0.245 1
1 1219 . 9 1 1 A 104 104 PRO C C 104 177.445 176.076 1.369 1
1 1220 . 9 1 1 A 104 104 PRO CA C 104 63.312 62.290 1.022 1
1 1221 . 9 1 1 A 104 104 PRO CB C 104 32.190 29.747 2.443 1
1 1224 . 9 1 1 A 105 105 SER H H 105 8.538 8.381 0.157 1
1 1225 . 9 1 1 A 105 105 SER HA H 105 4.541 4.761 -0.220 1
1 1228 . 9 1 1 A 105 105 SER C C 105 174.616 173.449 1.167 1
1 1229 . 9 1 1 A 105 105 SER CA C 105 58.270 58.129 0.141 1
1 1230 . 9 1 1 A 105 105 SER CB C 105 63.895 62.905 0.990 1
1 1231 . 9 1 1 A 105 105 SER N N 105 116.446 120.416 -3.970 1
1 1232 . 9 1 1 A 106 106 SER H H 106 8.350 8.288 0.062 1
1 1233 . 9 1 1 A 106 106 SER HA H 106 4.541 5.202 -0.661 1
1 1236 . 9 1 1 A 106 106 SER C C 106 174.530 173.249 1.281 1
1 1237 . 9 1 1 A 106 106 SER CA C 106 58.357 56.314 2.043 1
1 1238 . 9 1 1 A 106 106 SER CB C 106 64.020 65.170 -1.150 1
1 1239 . 9 1 1 A 106 106 SER N N 106 117.448 120.212 -2.764 1
1 1 . 10 1 1 A 2 2 SER C C 2 174.723 174.951 -0.228 1
1 2 . 10 1 1 A 2 2 SER CA C 2 58.446 61.870 -3.424 1
1 3 . 10 1 1 A 2 2 SER CB C 2 63.566 63.681 -0.115 1
1 4 . 10 1 1 A 3 3 SER H H 3 8.350 7.746 0.604 1
1 5 . 10 1 1 A 3 3 SER C C 3 173.961 174.559 -0.598 1
1 6 . 10 1 1 A 3 3 SER CA C 3 58.428 58.459 -0.031 1
1 7 . 10 1 1 A 3 3 SER CB C 3 63.937 63.436 0.501 1
1 8 . 10 1 1 A 3 3 SER N N 3 117.923 115.320 2.603 1
1 9 . 10 1 1 A 4 4 GLY H H 4 8.050 8.595 -0.545 1
1 10 . 10 1 1 A 4 4 GLY C C 4 179.009 173.140 5.869 1
1 11 . 10 1 1 A 4 4 GLY CA C 4 46.174 45.584 0.590 1
1 12 . 10 1 1 A 4 4 GLY N N 4 116.890 114.975 1.915 1
1 13 . 10 1 1 A 7 7 GLY HA2 H 7 4.340 4.160 0.180 1
1 14 . 10 1 1 A 7 7 GLY HA3 H 7 3.629 4.161 -0.532 1
1 15 . 10 1 1 A 7 7 GLY CA C 7 44.381 44.244 0.137 1
1 16 . 10 1 1 A 8 8 PRO HA H 8 4.476 4.556 -0.080 1
1 23 . 10 1 1 A 8 8 PRO C C 8 176.235 177.285 -1.050 1
1 24 . 10 1 1 A 8 8 PRO CA C 8 62.995 62.605 0.390 1
1 25 . 10 1 1 A 8 8 PRO CB C 8 33.266 32.759 0.507 1
1 28 . 10 1 1 A 9 9 GLY H H 9 8.585 8.446 0.139 1
1 29 . 10 1 1 A 9 9 GLY HA2 H 9 4.326 4.109 0.217 1
1 30 . 10 1 1 A 9 9 GLY HA3 H 9 4.009 4.109 -0.100 1
1 31 . 10 1 1 A 9 9 GLY C C 9 172.998 173.158 -0.160 1
1 32 . 10 1 1 A 9 9 GLY CA C 9 44.393 44.150 0.243 1
1 33 . 10 1 1 A 9 9 GLY N N 9 106.004 107.944 -1.940 1
1 34 . 10 1 1 A 10 10 ARG H H 10 8.548 8.304 0.244 1
1 35 . 10 1 1 A 10 10 ARG HA H 10 4.654 4.601 0.053 1
1 41 . 10 1 1 A 10 10 ARG C C 10 175.780 175.200 0.580 1
1 42 . 10 1 1 A 10 10 ARG CA C 10 54.708 54.799 -0.091 1
1 43 . 10 1 1 A 10 10 ARG CB C 10 31.448 30.651 0.797 1
1 45 . 10 1 1 A 10 10 ARG N N 10 119.407 117.616 1.791 1
1 46 . 10 1 1 A 11 11 PRO HA H 11 4.611 4.544 0.067 1
1 53 . 10 1 1 A 11 11 PRO C C 11 173.510 175.496 -1.986 1
1 54 . 10 1 1 A 11 11 PRO CA C 11 62.360 62.631 -0.271 1
1 55 . 10 1 1 A 11 11 PRO CB C 11 33.402 32.199 1.203 1
1 58 . 10 1 1 A 12 12 THR H H 12 7.572 7.902 -0.330 1
1 59 . 10 1 1 A 12 12 THR HA H 12 3.796 4.179 -0.383 1
1 64 . 10 1 1 A 12 12 THR C C 12 172.337 173.452 -1.115 1
1 65 . 10 1 1 A 12 12 THR CA C 12 61.778 61.456 0.322 1
1 66 . 10 1 1 A 12 12 THR CB C 12 70.561 68.610 1.951 1
1 68 . 10 1 1 A 12 12 THR N N 12 109.653 117.255 -7.602 1
1 69 . 10 1 1 A 13 13 MET H H 13 5.605 8.693 -3.088 1
1 70 . 10 1 1 A 13 13 MET HA H 13 5.091 5.093 -0.002 1
1 78 . 10 1 1 A 13 13 MET C C 13 172.639 175.065 -2.426 1
1 79 . 10 1 1 A 13 13 MET CA C 13 54.168 53.860 0.308 1
1 80 . 10 1 1 A 13 13 MET CB C 13 37.632 34.906 2.726 1
1 83 . 10 1 1 A 13 13 MET N N 13 121.634 127.014 -5.380 1
1 84 . 10 1 1 A 14 14 MET H H 14 9.254 9.320 -0.066 1
1 85 . 10 1 1 A 14 14 MET HA H 14 4.662 5.181 -0.519 1
1 93 . 10 1 1 A 14 14 MET C C 14 174.388 174.963 -0.575 1
1 94 . 10 1 1 A 14 14 MET CA C 14 54.673 54.566 0.107 1
1 95 . 10 1 1 A 14 14 MET CB C 14 34.907 35.298 -0.391 1
1 98 . 10 1 1 A 14 14 MET N N 14 125.746 123.818 1.928 1
1 99 . 10 1 1 A 15 15 ILE H H 15 8.555 9.174 -0.619 1
1 100 . 10 1 1 A 15 15 ILE HA H 15 4.882 5.120 -0.238 1
1 110 . 10 1 1 A 15 15 ILE C C 15 174.962 175.106 -0.144 1
1 111 . 10 1 1 A 15 15 ILE CA C 15 60.685 61.009 -0.324 1
1 112 . 10 1 1 A 15 15 ILE CB C 15 40.878 38.867 2.011 1
1 116 . 10 1 1 A 15 15 ILE N N 15 121.623 126.009 -4.386 1
1 117 . 10 1 1 A 16 16 SER H H 16 8.703 8.895 -0.192 1
1 118 . 10 1 1 A 16 16 SER HA H 16 4.922 5.115 -0.193 1
1 121 . 10 1 1 A 16 16 SER C C 16 173.860 173.016 0.844 1
1 122 . 10 1 1 A 16 16 SER CA C 16 56.524 56.583 -0.059 1
1 123 . 10 1 1 A 16 16 SER CB C 16 65.004 65.043 -0.039 1
1 124 . 10 1 1 A 16 16 SER N N 16 122.261 122.844 -0.583 1
1 125 . 10 1 1 A 17 17 THR H H 17 8.759 8.631 0.128 1
1 126 . 10 1 1 A 17 17 THR HA H 17 4.885 4.839 0.046 1
1 131 . 10 1 1 A 17 17 THR C C 17 175.018 174.775 0.243 1
1 132 . 10 1 1 A 17 17 THR CA C 17 60.315 60.874 -0.559 1
1 133 . 10 1 1 A 17 17 THR CB C 17 69.799 69.658 0.141 1
1 135 . 10 1 1 A 17 17 THR N N 17 115.660 117.224 -1.564 1
1 136 . 10 1 1 A 18 18 THR H H 18 8.038 8.796 -0.758 1
1 137 . 10 1 1 A 18 18 THR HA H 18 4.596 4.380 0.216 1
1 142 . 10 1 1 A 18 18 THR CA C 18 60.707 62.325 -1.618 1
1 143 . 10 1 1 A 18 18 THR CB C 18 71.082 69.441 1.641 1
1 145 . 10 1 1 A 18 18 THR N N 18 112.362 116.032 -3.670 1
1 146 . 10 1 1 A 19 19 ALA H H 19 8.545 7.759 0.786 1
1 147 . 10 1 1 A 19 19 ALA HA H 19 4.412 4.330 0.082 1
1 151 . 10 1 1 A 19 19 ALA C C 19 177.034 177.133 -0.099 1
1 152 . 10 1 1 A 19 19 ALA CA C 19 52.264 51.955 0.309 1
1 153 . 10 1 1 A 19 19 ALA CB C 19 19.292 19.957 -0.665 1
1 154 . 10 1 1 A 19 19 ALA N N 19 119.589 123.691 -4.102 1
1 155 . 10 1 1 A 20 20 MET H H 20 8.145 8.492 -0.347 1
1 156 . 10 1 1 A 20 20 MET HA H 20 4.447 4.376 0.071 1
1 164 . 10 1 1 A 20 20 MET C C 20 175.676 176.550 -0.874 1
1 165 . 10 1 1 A 20 20 MET CA C 20 55.764 54.714 1.050 1
1 166 . 10 1 1 A 20 20 MET CB C 20 31.495 32.257 -0.762 1
1 169 . 10 1 1 A 20 20 MET N N 20 116.950 119.466 -2.516 1
1 170 . 10 1 1 A 21 21 ASN H H 21 8.275 8.933 -0.658 1
1 171 . 10 1 1 A 21 21 ASN HA H 21 4.452 4.364 0.088 1
1 176 . 10 1 1 A 21 21 ASN C C 21 174.100 173.792 0.308 1
1 177 . 10 1 1 A 21 21 ASN CA C 21 54.320 54.612 -0.292 1
1 178 . 10 1 1 A 21 21 ASN CB C 21 37.234 37.157 0.077 1
1 179 . 10 1 1 A 21 21 ASN N N 21 113.198 118.460 -5.262 1
1 181 . 10 1 1 A 22 22 THR H H 22 7.071 7.465 -0.394 1
1 182 . 10 1 1 A 22 22 THR HA H 22 5.218 5.390 -0.172 1
1 187 . 10 1 1 A 22 22 THR C C 22 173.301 172.937 0.364 1
1 188 . 10 1 1 A 22 22 THR CA C 22 59.399 60.402 -1.003 1
1 189 . 10 1 1 A 22 22 THR CB C 22 72.714 71.853 0.861 1
1 191 . 10 1 1 A 22 22 THR N N 22 107.603 107.809 -0.206 1
1 192 . 10 1 1 A 23 23 ALA H H 23 8.687 8.785 -0.098 1
1 193 . 10 1 1 A 23 23 ALA HA H 23 4.925 5.070 -0.145 1
1 197 . 10 1 1 A 23 23 ALA C C 23 174.100 175.962 -1.862 1
1 198 . 10 1 1 A 23 23 ALA CA C 23 50.812 50.026 0.786 1
1 199 . 10 1 1 A 23 23 ALA CB C 23 21.122 21.206 -0.084 1
1 200 . 10 1 1 A 23 23 ALA N N 23 121.937 125.853 -3.916 1
1 201 . 10 1 1 A 24 24 LEU H H 24 8.833 8.927 -0.094 1
1 202 . 10 1 1 A 24 24 LEU HA H 24 4.673 4.472 0.201 1
1 212 . 10 1 1 A 24 24 LEU C C 24 175.140 174.831 0.309 1
1 213 . 10 1 1 A 24 24 LEU CA C 24 54.320 55.200 -0.880 1
1 214 . 10 1 1 A 24 24 LEU CB C 24 42.518 42.945 -0.427 1
1 218 . 10 1 1 A 24 24 LEU N N 24 123.721 126.286 -2.565 1
1 219 . 10 1 1 A 25 25 LEU H H 25 9.176 8.610 0.566 1
1 220 . 10 1 1 A 25 25 LEU HA H 25 5.112 5.052 0.060 1
1 230 . 10 1 1 A 25 25 LEU C C 25 176.414 176.109 0.305 1
1 231 . 10 1 1 A 25 25 LEU CA C 25 54.108 52.873 1.235 1
1 232 . 10 1 1 A 25 25 LEU CB C 25 43.230 43.661 -0.431 1
1 236 . 10 1 1 A 25 25 LEU N N 25 128.589 128.050 0.539 1
1 237 . 10 1 1 A 26 26 GLN H H 26 8.556 8.586 -0.030 1
1 238 . 10 1 1 A 26 26 GLN HA H 26 4.737 4.917 -0.180 1
1 245 . 10 1 1 A 26 26 GLN C C 26 174.372 174.131 0.241 1
1 246 . 10 1 1 A 26 26 GLN CA C 26 56.365 54.464 1.901 1
1 247 . 10 1 1 A 26 26 GLN CB C 26 33.320 31.851 1.469 1
1 249 . 10 1 1 A 26 26 GLN N N 26 119.630 122.653 -3.023 1
1 251 . 10 1 1 A 27 27 TRP H H 27 8.080 8.265 -0.185 1
1 252 . 10 1 1 A 27 27 TRP HA H 27 5.441 5.901 -0.460 1
1 261 . 10 1 1 A 27 27 TRP CA C 27 55.957 54.589 1.368 1
1 262 . 10 1 1 A 27 27 TRP CB C 27 32.517 32.253 0.264 1
1 268 . 10 1 1 A 27 27 TRP N N 27 121.276 121.716 -0.440 1
1 270 . 10 1 1 A 28 28 HIS H H 28 8.262 8.682 -0.420 1
1 271 . 10 1 1 A 28 28 HIS HA H 28 4.997 5.064 -0.067 1
1 275 . 10 1 1 A 28 28 HIS CA C 28 53.028 53.979 -0.951 1
1 276 . 10 1 1 A 28 28 HIS CB C 28 32.832 32.880 -0.048 1
1 278 . 10 1 1 A 28 28 HIS N N 28 116.245 117.087 -0.842 1
1 279 . 10 1 1 A 29 29 PRO HA H 29 4.984 4.660 0.324 1
1 286 . 10 1 1 A 29 29 PRO CA C 29 61.498 62.105 -0.607 1
1 287 . 10 1 1 A 29 29 PRO CB C 29 30.709 32.420 -1.711 1
1 290 . 10 1 1 A 30 30 PRO HA H 30 4.449 4.655 -0.206 1
1 297 . 10 1 1 A 30 30 PRO C C 30 175.733 176.054 -0.321 1
1 298 . 10 1 1 A 30 30 PRO CA C 30 62.245 62.469 -0.224 1
1 299 . 10 1 1 A 30 30 PRO CB C 30 32.083 33.413 -1.330 1
1 302 . 10 1 1 A 31 31 LYS H H 31 8.403 8.150 0.253 1
1 303 . 10 1 1 A 31 31 LYS HA H 31 4.084 4.473 -0.389 1
1 312 . 10 1 1 A 31 31 LYS C C 31 177.166 177.302 -0.136 1
1 313 . 10 1 1 A 31 31 LYS CA C 31 57.866 57.552 0.314 1
1 314 . 10 1 1 A 31 31 LYS CB C 31 32.698 34.026 -1.328 1
1 318 . 10 1 1 A 31 31 LYS N N 31 121.693 118.221 3.472 1
1 319 . 10 1 1 A 32 32 GLU H H 32 8.102 7.693 0.409 1
1 320 . 10 1 1 A 32 32 GLU HA H 32 4.365 4.507 -0.142 1
1 325 . 10 1 1 A 32 32 GLU C C 32 174.248 175.734 -1.486 1
1 326 . 10 1 1 A 32 32 GLU CA C 32 55.448 56.174 -0.726 1
1 327 . 10 1 1 A 32 32 GLU CB C 32 29.405 30.008 -0.603 1
1 329 . 10 1 1 A 32 32 GLU N N 32 118.742 117.771 0.971 1
1 330 . 10 1 1 A 33 33 LEU H H 33 8.420 7.526 0.894 1
1 331 . 10 1 1 A 33 33 LEU HA H 33 4.499 4.814 -0.315 1
1 341 . 10 1 1 A 33 33 LEU C C 33 173.036 174.783 -1.747 1
1 342 . 10 1 1 A 33 33 LEU CA C 33 52.863 51.304 1.559 1
1 343 . 10 1 1 A 33 33 LEU CB C 33 42.535 43.678 -1.143 1
1 347 . 10 1 1 A 33 33 LEU N N 33 125.181 122.910 2.271 1
1 348 . 10 1 1 A 34 34 PRO HA H 34 4.488 4.479 0.009 1
1 355 . 10 1 1 A 34 34 PRO C C 34 177.544 176.645 0.899 1
1 356 . 10 1 1 A 34 34 PRO CA C 34 62.889 63.202 -0.313 1
1 357 . 10 1 1 A 34 34 PRO CB C 34 31.472 30.897 0.575 1
1 360 . 10 1 1 A 35 35 GLY H H 35 8.397 8.388 0.009 1
1 361 . 10 1 1 A 35 35 GLY HA2 H 35 4.059 4.122 -0.063 1
1 362 . 10 1 1 A 35 35 GLY HA3 H 35 3.716 4.123 -0.407 1
1 363 . 10 1 1 A 35 35 GLY C C 35 173.356 172.127 1.229 1
1 364 . 10 1 1 A 35 35 GLY CA C 35 45.892 44.782 1.110 1
1 365 . 10 1 1 A 35 35 GLY N N 35 110.524 111.988 -1.464 1
1 366 . 10 1 1 A 36 36 GLU H H 36 8.091 8.491 -0.400 1
1 367 . 10 1 1 A 36 36 GLU HA H 36 4.371 5.190 -0.819 1
1 372 . 10 1 1 A 36 36 GLU C C 36 174.864 174.849 0.015 1
1 373 . 10 1 1 A 36 36 GLU CA C 36 55.201 54.608 0.593 1
1 374 . 10 1 1 A 36 36 GLU CB C 36 31.878 33.107 -1.229 1
1 376 . 10 1 1 A 36 36 GLU N N 36 122.202 120.159 2.043 1
1 377 . 10 1 1 A 37 37 LEU H H 37 8.307 8.687 -0.380 1
1 378 . 10 1 1 A 37 37 LEU HA H 37 4.288 4.271 0.017 1
1 388 . 10 1 1 A 37 37 LEU C C 37 176.702 176.002 0.700 1
1 389 . 10 1 1 A 37 37 LEU CA C 37 55.342 56.787 -1.445 1
1 390 . 10 1 1 A 37 37 LEU CB C 37 42.715 42.138 0.577 1
1 394 . 10 1 1 A 37 37 LEU N N 37 123.204 126.178 -2.974 1
1 395 . 10 1 1 A 38 38 LEU H H 38 8.909 8.669 0.240 1
1 396 . 10 1 1 A 38 38 LEU HA H 38 4.640 4.637 0.003 1
1 406 . 10 1 1 A 38 38 LEU C C 38 177.202 176.718 0.484 1
1 407 . 10 1 1 A 38 38 LEU CA C 38 54.390 55.140 -0.750 1
1 408 . 10 1 1 A 38 38 LEU CB C 38 43.770 43.570 0.200 1
1 412 . 10 1 1 A 38 38 LEU N N 38 123.021 126.921 -3.900 1
1 413 . 10 1 1 A 39 39 GLY H H 39 7.113 6.971 0.142 1
1 414 . 10 1 1 A 39 39 GLY HA2 H 39 4.816 3.568 1.248 1
1 415 . 10 1 1 A 39 39 GLY HA3 H 39 3.276 3.916 -0.640 1
1 416 . 10 1 1 A 39 39 GLY C C 39 169.863 170.381 -0.518 1
1 417 . 10 1 1 A 39 39 GLY CA C 39 44.622 45.538 -0.916 1
1 418 . 10 1 1 A 39 39 GLY N N 39 104.137 103.922 0.215 1
1 419 . 10 1 1 A 40 40 TYR H H 40 8.318 8.937 -0.619 1
1 420 . 10 1 1 A 40 40 TYR HA H 40 5.414 5.100 0.314 1
1 425 . 10 1 1 A 40 40 TYR C C 40 174.448 172.191 2.257 1
1 426 . 10 1 1 A 40 40 TYR CA C 40 56.178 56.571 -0.393 1
1 427 . 10 1 1 A 40 40 TYR CB C 40 44.191 40.659 3.532 1
1 430 . 10 1 1 A 40 40 TYR N N 40 114.036 115.405 -1.369 1
1 431 . 10 1 1 A 41 41 ARG H H 41 9.347 8.810 0.537 1
1 432 . 10 1 1 A 41 41 ARG HA H 41 5.092 5.362 -0.270 1
1 440 . 10 1 1 A 41 41 ARG C C 41 174.097 174.061 0.036 1
1 441 . 10 1 1 A 41 41 ARG CA C 41 56.100 54.167 1.933 1
1 442 . 10 1 1 A 41 41 ARG CB C 41 34.508 32.691 1.817 1
1 445 . 10 1 1 A 41 41 ARG N N 41 122.231 121.235 0.996 1
1 447 . 10 1 1 A 42 42 LEU H H 42 9.546 9.128 0.418 1
1 448 . 10 1 1 A 42 42 LEU HA H 42 5.459 5.270 0.189 1
1 458 . 10 1 1 A 42 42 LEU C C 42 174.913 174.738 0.175 1
1 459 . 10 1 1 A 42 42 LEU CA C 42 52.997 53.402 -0.405 1
1 460 . 10 1 1 A 42 42 LEU CB C 42 46.413 45.658 0.755 1
1 464 . 10 1 1 A 42 42 LEU N N 42 132.335 127.609 4.726 1
1 465 . 10 1 1 A 43 43 GLN H H 43 9.502 9.096 0.406 1
1 466 . 10 1 1 A 43 43 GLN HA H 43 5.847 5.236 0.611 1
1 473 . 10 1 1 A 43 43 GLN C C 43 175.329 174.099 1.230 1
1 474 . 10 1 1 A 43 43 GLN CA C 43 54.005 54.501 -0.496 1
1 475 . 10 1 1 A 43 43 GLN CB C 43 33.429 31.536 1.893 1
1 477 . 10 1 1 A 43 43 GLN N N 43 123.932 125.424 -1.492 1
1 479 . 10 1 1 A 44 44 TYR H H 44 8.615 8.539 0.076 1
1 480 . 10 1 1 A 44 44 TYR HA H 44 5.783 5.780 0.003 1
1 487 . 10 1 1 A 44 44 TYR C C 44 174.058 173.494 0.564 1
1 488 . 10 1 1 A 44 44 TYR CA C 44 55.942 55.893 0.049 1
1 489 . 10 1 1 A 44 44 TYR CB C 44 43.052 41.696 1.356 1
1 494 . 10 1 1 A 44 44 TYR N N 44 117.355 119.857 -2.502 1
1 495 . 10 1 1 A 45 45 CYS H H 45 8.377 8.325 0.052 1
1 496 . 10 1 1 A 45 45 CYS HA H 45 4.772 5.094 -0.322 1
1 499 . 10 1 1 A 45 45 CYS C C 45 173.205 173.818 -0.613 1
1 500 . 10 1 1 A 45 45 CYS CA C 45 55.960 57.012 -1.052 1
1 501 . 10 1 1 A 45 45 CYS CB C 45 30.665 31.141 -0.476 1
1 502 . 10 1 1 A 45 45 CYS N N 45 115.140 118.304 -3.164 1
1 503 . 10 1 1 A 46 46 ARG H H 46 9.165 8.516 0.649 1
1 504 . 10 1 1 A 46 46 ARG HA H 46 4.068 3.700 0.368 1
1 511 . 10 1 1 A 46 46 ARG C C 46 178.440 177.435 1.005 1
1 512 . 10 1 1 A 46 46 ARG CA C 46 56.401 56.030 0.371 1
1 513 . 10 1 1 A 46 46 ARG CB C 46 31.878 31.043 0.835 1
1 516 . 10 1 1 A 46 46 ARG N N 46 121.803 121.252 0.551 1
1 517 . 10 1 1 A 47 47 ALA H H 47 8.273 8.164 0.109 1
1 518 . 10 1 1 A 47 47 ALA HA H 47 3.891 4.132 -0.241 1
1 522 . 10 1 1 A 47 47 ALA C C 47 177.599 177.152 0.447 1
1 523 . 10 1 1 A 47 47 ALA CA C 47 54.796 53.344 1.452 1
1 524 . 10 1 1 A 47 47 ALA CB C 47 18.287 18.475 -0.188 1
1 525 . 10 1 1 A 47 47 ALA N N 47 123.895 123.734 0.161 1
1 526 . 10 1 1 A 48 48 ASP H H 48 8.036 7.877 0.159 1
1 527 . 10 1 1 A 48 48 ASP HA H 48 4.453 4.808 -0.355 1
1 530 . 10 1 1 A 48 48 ASP C C 48 175.836 175.344 0.492 1
1 531 . 10 1 1 A 48 48 ASP CA C 48 53.368 53.909 -0.541 1
1 532 . 10 1 1 A 48 48 ASP CB C 48 39.964 42.346 -2.382 1
1 533 . 10 1 1 A 48 48 ASP N N 48 112.576 117.619 -5.043 1
1 534 . 10 1 1 A 49 49 GLU H H 49 7.495 7.448 0.047 1
1 535 . 10 1 1 A 49 49 GLU HA H 49 4.308 4.590 -0.282 1
1 540 . 10 1 1 A 49 49 GLU C C 49 175.756 175.733 0.023 1
1 541 . 10 1 1 A 49 49 GLU CA C 49 56.224 55.013 1.211 1
1 542 . 10 1 1 A 49 49 GLU CB C 49 32.248 30.848 1.400 1
1 544 . 10 1 1 A 49 49 GLU N N 49 120.609 118.918 1.691 1
1 545 . 10 1 1 A 50 50 ALA H H 50 8.416 8.484 -0.068 1
1 546 . 10 1 1 A 50 50 ALA HA H 50 4.200 4.482 -0.282 1
1 550 . 10 1 1 A 50 50 ALA C C 50 177.433 177.152 0.281 1
1 551 . 10 1 1 A 50 50 ALA CA C 50 53.297 52.244 1.053 1
1 552 . 10 1 1 A 50 50 ALA CB C 50 19.474 20.583 -1.109 1
1 553 . 10 1 1 A 50 50 ALA N N 50 124.065 123.533 0.532 1
1 554 . 10 1 1 A 51 51 ARG H H 51 7.648 7.638 0.010 1
1 555 . 10 1 1 A 51 51 ARG HA H 51 4.747 4.687 0.060 1
1 562 . 10 1 1 A 51 51 ARG C C 51 173.400 173.368 0.032 1
1 563 . 10 1 1 A 51 51 ARG CA C 51 52.592 52.285 0.307 1
1 564 . 10 1 1 A 51 51 ARG CB C 51 31.212 31.945 -0.733 1
1 567 . 10 1 1 A 51 51 ARG N N 51 117.798 118.363 -0.565 1
1 568 . 10 1 1 A 52 52 PRO HA H 52 4.212 4.443 -0.231 1
1 575 . 10 1 1 A 52 52 PRO C C 52 176.380 176.605 -0.225 1
1 576 . 10 1 1 A 52 52 PRO CA C 52 62.360 62.576 -0.216 1
1 577 . 10 1 1 A 52 52 PRO CB C 52 32.331 32.038 0.293 1
1 580 . 10 1 1 A 53 53 ASN H H 53 8.127 7.850 0.277 1
1 581 . 10 1 1 A 53 53 ASN HA H 53 4.651 4.707 -0.056 1
1 586 . 10 1 1 A 53 53 ASN C C 53 174.354 174.540 -0.186 1
1 587 . 10 1 1 A 53 53 ASN CA C 53 53.136 52.583 0.553 1
1 588 . 10 1 1 A 53 53 ASN CB C 53 39.666 38.075 1.591 1
1 589 . 10 1 1 A 53 53 ASN N N 53 119.405 119.768 -0.363 1
1 591 . 10 1 1 A 54 54 THR H H 54 8.425 8.511 -0.086 1
1 592 . 10 1 1 A 54 54 THR HA H 54 5.306 4.461 0.845 1
1 597 . 10 1 1 A 54 54 THR C C 54 173.850 174.280 -0.430 1
1 598 . 10 1 1 A 54 54 THR CA C 54 61.881 63.494 -1.613 1
1 599 . 10 1 1 A 54 54 THR CB C 54 70.573 69.302 1.271 1
1 601 . 10 1 1 A 54 54 THR N N 54 118.968 121.615 -2.647 1
1 602 . 10 1 1 A 55 55 ILE H H 55 9.354 8.466 0.888 1
1 603 . 10 1 1 A 55 55 ILE HA H 55 4.051 4.482 -0.431 1
1 613 . 10 1 1 A 55 55 ILE C C 55 172.975 173.532 -0.557 1
1 614 . 10 1 1 A 55 55 ILE CA C 55 61.003 59.810 1.193 1
1 615 . 10 1 1 A 55 55 ILE CB C 55 41.619 42.236 -0.617 1
1 619 . 10 1 1 A 55 55 ILE N N 55 127.961 125.831 2.130 1
1 620 . 10 1 1 A 56 56 ASP H H 56 8.132 8.738 -0.606 1
1 621 . 10 1 1 A 56 56 ASP HA H 56 5.334 5.278 0.056 1
1 624 . 10 1 1 A 56 56 ASP C C 56 174.969 174.758 0.211 1
1 625 . 10 1 1 A 56 56 ASP CA C 56 53.702 52.792 0.910 1
1 626 . 10 1 1 A 56 56 ASP CB C 56 43.251 42.939 0.312 1
1 627 . 10 1 1 A 56 56 ASP N N 56 125.882 127.260 -1.378 1
1 628 . 10 1 1 A 57 57 PHE H H 57 8.955 8.687 0.268 1
1 629 . 10 1 1 A 57 57 PHE HA H 57 4.915 5.012 -0.097 1
1 637 . 10 1 1 A 57 57 PHE C C 57 177.361 175.517 1.844 1
1 638 . 10 1 1 A 57 57 PHE CA C 57 57.458 56.628 0.830 1
1 639 . 10 1 1 A 57 57 PHE CB C 57 43.737 43.336 0.401 1
1 645 . 10 1 1 A 57 57 PHE N N 57 118.872 122.927 -4.055 1
1 646 . 10 1 1 A 58 58 GLY H H 58 9.552 9.181 0.371 1
1 647 . 10 1 1 A 58 58 GLY HA2 H 58 4.662 4.136 0.526 1
1 648 . 10 1 1 A 58 58 GLY HA3 H 58 4.126 4.197 -0.071 1
1 649 . 10 1 1 A 58 58 GLY C C 58 174.760 174.962 -0.202 1
1 650 . 10 1 1 A 58 58 GLY CA C 58 44.680 45.167 -0.487 1
1 651 . 10 1 1 A 58 58 GLY N N 58 111.551 109.940 1.611 1
1 652 . 10 1 1 A 59 59 LYS H H 59 8.211 8.250 -0.039 1
1 653 . 10 1 1 A 59 59 LYS HA H 59 3.782 3.646 0.136 1
1 662 . 10 1 1 A 59 59 LYS C C 59 176.154 178.210 -2.056 1
1 663 . 10 1 1 A 59 59 LYS CA C 59 59.080 58.679 0.401 1
1 664 . 10 1 1 A 59 59 LYS CB C 59 32.516 31.785 0.731 1
1 668 . 10 1 1 A 59 59 LYS N N 59 115.953 120.564 -4.611 1
1 669 . 10 1 1 A 60 60 ASP H H 60 8.634 8.139 0.495 1
1 670 . 10 1 1 A 60 60 ASP HA H 60 4.882 4.412 0.470 1
1 673 . 10 1 1 A 60 60 ASP C C 60 176.039 176.031 0.008 1
1 674 . 10 1 1 A 60 60 ASP CA C 60 54.327 57.224 -2.897 1
1 675 . 10 1 1 A 60 60 ASP CB C 60 41.461 41.232 0.229 1
1 676 . 10 1 1 A 60 60 ASP N N 60 117.261 119.930 -2.669 1
1 677 . 10 1 1 A 61 61 ASP H H 61 7.500 8.378 -0.878 1
1 678 . 10 1 1 A 61 61 ASP HA H 61 4.591 4.696 -0.105 1
1 681 . 10 1 1 A 61 61 ASP C C 61 175.140 175.785 -0.645 1
1 682 . 10 1 1 A 61 61 ASP CA C 61 55.342 53.911 1.431 1
1 683 . 10 1 1 A 61 61 ASP CB C 61 42.475 39.975 2.500 1
1 684 . 10 1 1 A 61 61 ASP N N 61 122.319 118.997 3.322 1
1 685 . 10 1 1 A 62 62 GLN H H 62 8.239 7.916 0.323 1
1 686 . 10 1 1 A 62 62 GLN HA H 62 2.569 3.608 -1.039 1
1 693 . 10 1 1 A 62 62 GLN C C 62 172.652 173.650 -0.998 1
1 694 . 10 1 1 A 62 62 GLN CA C 62 54.038 55.539 -1.501 1
1 695 . 10 1 1 A 62 62 GLN CB C 62 31.481 29.429 2.052 1
1 697 . 10 1 1 A 62 62 GLN N N 62 117.458 123.175 -5.717 1
1 699 . 10 1 1 A 63 63 HIS H H 63 6.338 6.779 -0.441 1
1 700 . 10 1 1 A 63 63 HIS HA H 63 4.423 4.478 -0.055 1
1 704 . 10 1 1 A 63 63 HIS C C 63 173.031 172.688 0.343 1
1 705 . 10 1 1 A 63 63 HIS CA C 63 54.743 54.050 0.693 1
1 706 . 10 1 1 A 63 63 HIS CB C 63 32.661 31.284 1.377 1
1 708 . 10 1 1 A 63 63 HIS N N 63 113.589 116.083 -2.494 1
1 709 . 10 1 1 A 64 64 PHE H H 64 8.549 8.811 -0.262 1
1 710 . 10 1 1 A 64 64 PHE HA H 64 4.578 5.167 -0.589 1
1 718 . 10 1 1 A 64 64 PHE C C 64 173.015 173.663 -0.648 1
1 719 . 10 1 1 A 64 64 PHE CA C 64 58.516 56.894 1.622 1
1 720 . 10 1 1 A 64 64 PHE CB C 64 43.525 43.031 0.494 1
1 726 . 10 1 1 A 64 64 PHE N N 64 118.214 120.080 -1.866 1
1 727 . 10 1 1 A 65 65 THR H H 65 7.150 8.084 -0.934 1
1 728 . 10 1 1 A 65 65 THR HA H 65 4.930 4.707 0.223 1
1 733 . 10 1 1 A 65 65 THR C C 65 172.457 173.775 -1.318 1
1 734 . 10 1 1 A 65 65 THR CA C 65 61.690 61.771 -0.081 1
1 735 . 10 1 1 A 65 65 THR CB C 65 69.593 69.281 0.312 1
1 737 . 10 1 1 A 65 65 THR N N 65 123.198 120.866 2.332 1
1 738 . 10 1 1 A 66 66 VAL H H 66 8.888 8.515 0.373 1
1 739 . 10 1 1 A 66 66 VAL HA H 66 4.018 4.806 -0.788 1
1 747 . 10 1 1 A 66 66 VAL C C 66 174.868 175.340 -0.472 1
1 748 . 10 1 1 A 66 66 VAL CA C 66 61.178 60.533 0.645 1
1 749 . 10 1 1 A 66 66 VAL CB C 66 33.114 33.261 -0.147 1
1 752 . 10 1 1 A 66 66 VAL N N 66 126.840 128.040 -1.200 1
1 753 . 10 1 1 A 67 67 THR H H 67 8.174 8.541 -0.367 1
1 754 . 10 1 1 A 67 67 THR HA H 67 4.816 4.976 -0.160 1
1 759 . 10 1 1 A 67 67 THR C C 67 174.494 174.246 0.248 1
1 760 . 10 1 1 A 67 67 THR CA C 67 59.786 59.542 0.244 1
1 761 . 10 1 1 A 67 67 THR CB C 67 70.887 71.667 -0.780 1
1 763 . 10 1 1 A 67 67 THR N N 67 116.127 117.057 -0.930 1
1 764 . 10 1 1 A 68 68 GLY H H 68 8.570 8.603 -0.033 1
1 765 . 10 1 1 A 68 68 GLY HA2 H 68 3.970 4.018 -0.048 1
1 766 . 10 1 1 A 68 68 GLY HA3 H 68 3.819 4.019 -0.200 1
1 767 . 10 1 1 A 68 68 GLY C C 68 175.636 174.616 1.020 1
1 768 . 10 1 1 A 68 68 GLY CA C 68 46.397 45.080 1.317 1
1 769 . 10 1 1 A 68 68 GLY N N 68 107.146 113.001 -5.855 1
1 770 . 10 1 1 A 69 69 LEU H H 69 8.007 7.478 0.529 1
1 771 . 10 1 1 A 69 69 LEU HA H 69 4.154 4.228 -0.074 1
1 781 . 10 1 1 A 69 69 LEU C C 69 176.830 176.445 0.385 1
1 782 . 10 1 1 A 69 69 LEU CA C 69 54.602 54.843 -0.241 1
1 783 . 10 1 1 A 69 69 LEU CB C 69 41.149 42.136 -0.987 1
1 787 . 10 1 1 A 69 69 LEU N N 69 118.433 122.890 -4.457 1
1 788 . 10 1 1 A 70 70 HIS H H 70 8.866 8.757 0.109 1
1 789 . 10 1 1 A 70 70 HIS HA H 70 4.663 4.707 -0.044 1
1 793 . 10 1 1 A 70 70 HIS C C 70 176.667 175.262 1.405 1
1 794 . 10 1 1 A 70 70 HIS CA C 70 55.464 56.505 -1.041 1
1 795 . 10 1 1 A 70 70 HIS CB C 70 32.125 29.862 2.263 1
1 797 . 10 1 1 A 70 70 HIS N N 70 122.457 123.036 -0.579 1
1 798 . 10 1 1 A 71 71 LYS H H 71 8.716 8.733 -0.017 1
1 799 . 10 1 1 A 71 71 LYS HA H 71 4.320 4.270 0.050 1
1 808 . 10 1 1 A 71 71 LYS C C 71 178.110 177.628 0.482 1
1 809 . 10 1 1 A 71 71 LYS CA C 71 57.035 57.831 -0.796 1
1 810 . 10 1 1 A 71 71 LYS CB C 71 33.580 32.937 0.643 1
1 814 . 10 1 1 A 71 71 LYS N N 71 123.173 123.721 -0.548 1
1 815 . 10 1 1 A 72 72 GLY H H 72 7.709 8.655 -0.946 1
1 816 . 10 1 1 A 72 72 GLY HA2 H 72 3.800 3.897 -0.097 1
1 817 . 10 1 1 A 72 72 GLY HA3 H 72 3.769 3.904 -0.135 1
1 818 . 10 1 1 A 72 72 GLY C C 72 174.231 173.824 0.407 1
1 819 . 10 1 1 A 72 72 GLY CA C 72 47.866 46.374 1.492 1
1 820 . 10 1 1 A 72 72 GLY N N 72 114.881 111.661 3.220 1
1 821 . 10 1 1 A 73 73 THR H H 73 8.162 7.615 0.547 1
1 822 . 10 1 1 A 73 73 THR HA H 73 4.584 4.849 -0.265 1
1 827 . 10 1 1 A 73 73 THR C C 73 172.208 173.489 -1.281 1
1 828 . 10 1 1 A 73 73 THR CA C 73 62.307 61.243 1.064 1
1 829 . 10 1 1 A 73 73 THR CB C 73 72.123 72.023 0.100 1
1 831 . 10 1 1 A 73 73 THR N N 73 114.225 114.232 -0.007 1
1 832 . 10 1 1 A 74 74 THR H H 74 8.743 8.811 -0.068 1
1 833 . 10 1 1 A 74 74 THR HA H 74 5.138 4.985 0.153 1
1 838 . 10 1 1 A 74 74 THR C C 74 173.376 173.239 0.137 1
1 839 . 10 1 1 A 74 74 THR CA C 74 62.724 62.472 0.252 1
1 840 . 10 1 1 A 74 74 THR CB C 74 69.202 70.559 -1.357 1
1 842 . 10 1 1 A 74 74 THR N N 74 123.376 120.804 2.572 1
1 843 . 10 1 1 A 75 75 TYR H H 75 9.549 9.049 0.500 1
1 844 . 10 1 1 A 75 75 TYR HA H 75 4.892 5.222 -0.330 1
1 851 . 10 1 1 A 75 75 TYR C C 75 173.991 175.243 -1.252 1
1 852 . 10 1 1 A 75 75 TYR CA C 75 57.740 55.980 1.760 1
1 853 . 10 1 1 A 75 75 TYR CB C 75 44.580 43.041 1.539 1
1 858 . 10 1 1 A 75 75 TYR N N 75 126.916 123.363 3.553 1
1 859 . 10 1 1 A 76 76 ILE H H 76 8.769 8.839 -0.070 1
1 860 . 10 1 1 A 76 76 ILE HA H 76 4.663 4.910 -0.247 1
1 870 . 10 1 1 A 76 76 ILE C C 76 174.683 175.196 -0.513 1
1 871 . 10 1 1 A 76 76 ILE CA C 76 60.455 60.579 -0.124 1
1 872 . 10 1 1 A 76 76 ILE CB C 76 40.284 40.651 -0.367 1
1 876 . 10 1 1 A 76 76 ILE N N 76 119.407 120.568 -1.161 1
1 877 . 10 1 1 A 77 77 PHE H H 77 8.894 9.258 -0.364 1
1 878 . 10 1 1 A 77 77 PHE HA H 77 5.160 5.206 -0.046 1
1 886 . 10 1 1 A 77 77 PHE C C 77 174.794 175.141 -0.347 1
1 887 . 10 1 1 A 77 77 PHE CA C 77 56.831 57.109 -0.278 1
1 888 . 10 1 1 A 77 77 PHE CB C 77 43.132 41.788 1.344 1
1 894 . 10 1 1 A 77 77 PHE N N 77 124.622 126.402 -1.780 1
1 895 . 10 1 1 A 78 78 ARG H H 78 9.407 8.900 0.507 1
1 896 . 10 1 1 A 78 78 ARG HA H 78 5.689 5.524 0.165 1
1 904 . 10 1 1 A 78 78 ARG C C 78 174.376 174.337 0.039 1
1 905 . 10 1 1 A 78 78 ARG CA C 78 54.530 54.645 -0.115 1
1 906 . 10 1 1 A 78 78 ARG CB C 78 34.473 33.643 0.830 1
1 909 . 10 1 1 A 78 78 ARG N N 78 120.055 121.308 -1.253 1
1 911 . 10 1 1 A 79 79 LEU H H 79 9.132 9.106 0.026 1
1 912 . 10 1 1 A 79 79 LEU HA H 79 5.398 5.217 0.181 1
1 922 . 10 1 1 A 79 79 LEU C C 79 174.006 174.462 -0.456 1
1 923 . 10 1 1 A 79 79 LEU CA C 79 53.401 53.152 0.249 1
1 924 . 10 1 1 A 79 79 LEU CB C 79 48.116 46.655 1.461 1
1 928 . 10 1 1 A 79 79 LEU N N 79 124.907 125.942 -1.035 1
1 929 . 10 1 1 A 80 80 ALA H H 80 8.737 8.191 0.546 1
1 930 . 10 1 1 A 80 80 ALA HA H 80 4.871 5.203 -0.332 1
1 934 . 10 1 1 A 80 80 ALA C C 80 176.057 175.676 0.381 1
1 935 . 10 1 1 A 80 80 ALA CA C 80 50.353 50.735 -0.382 1
1 936 . 10 1 1 A 80 80 ALA CB C 80 23.972 23.229 0.743 1
1 937 . 10 1 1 A 80 80 ALA N N 80 128.220 126.537 1.683 1
1 938 . 10 1 1 A 81 81 ALA H H 81 9.890 8.639 1.251 1
1 939 . 10 1 1 A 81 81 ALA HA H 81 4.794 5.064 -0.270 1
1 943 . 10 1 1 A 81 81 ALA C C 81 174.655 176.130 -1.475 1
1 944 . 10 1 1 A 81 81 ALA CA C 81 50.300 51.074 -0.774 1
1 945 . 10 1 1 A 81 81 ALA CB C 81 21.369 20.706 0.663 1
1 946 . 10 1 1 A 81 81 ALA N N 81 123.682 123.230 0.452 1
1 947 . 10 1 1 A 82 82 LYS H H 82 7.965 8.689 -0.724 1
1 948 . 10 1 1 A 82 82 LYS HA H 82 4.974 5.376 -0.402 1
1 957 . 10 1 1 A 82 82 LYS C C 82 175.671 175.166 0.505 1
1 958 . 10 1 1 A 82 82 LYS CA C 82 54.664 54.739 -0.075 1
1 959 . 10 1 1 A 82 82 LYS CB C 82 36.677 35.577 1.100 1
1 963 . 10 1 1 A 82 82 LYS N N 82 118.164 122.352 -4.188 1
1 964 . 10 1 1 A 83 83 ASN H H 83 8.663 8.697 -0.034 1
1 965 . 10 1 1 A 83 83 ASN HA H 83 5.113 5.082 0.031 1
1 970 . 10 1 1 A 83 83 ASN C C 83 176.582 176.483 0.099 1
1 971 . 10 1 1 A 83 83 ASN CA C 83 51.746 50.739 1.007 1
1 972 . 10 1 1 A 83 83 ASN CB C 83 40.357 40.118 0.239 1
1 973 . 10 1 1 A 83 83 ASN N N 83 124.784 124.087 0.697 1
1 975 . 10 1 1 A 84 84 ARG H H 84 8.873 8.761 0.112 1
1 976 . 10 1 1 A 84 84 ARG HA H 84 3.940 3.945 -0.005 1
1 983 . 10 1 1 A 84 84 ARG C C 84 176.735 177.955 -1.220 1
1 984 . 10 1 1 A 84 84 ARG CA C 84 59.327 59.477 -0.150 1
1 985 . 10 1 1 A 84 84 ARG CB C 84 29.282 29.941 -0.659 1
1 988 . 10 1 1 A 84 84 ARG N N 84 117.891 119.113 -1.222 1
1 989 . 10 1 1 A 85 85 ALA H H 85 7.645 7.789 -0.144 1
1 990 . 10 1 1 A 85 85 ALA HA H 85 4.276 4.261 0.015 1
1 994 . 10 1 1 A 85 85 ALA C C 85 177.479 177.042 0.437 1
1 995 . 10 1 1 A 85 85 ALA CA C 85 52.818 52.697 0.121 1
1 996 . 10 1 1 A 85 85 ALA CB C 85 18.806 19.543 -0.737 1
1 997 . 10 1 1 A 85 85 ALA N N 85 120.306 120.171 0.135 1
1 998 . 10 1 1 A 86 86 GLY H H 86 7.693 7.567 0.126 1
1 999 . 10 1 1 A 86 86 GLY HA2 H 86 4.456 4.054 0.402 1
1 1000 . 10 1 1 A 86 86 GLY HA3 H 86 3.649 4.056 -0.407 1
1 1001 . 10 1 1 A 86 86 GLY C C 86 172.068 172.648 -0.580 1
1 1002 . 10 1 1 A 86 86 GLY CA C 86 44.375 43.902 0.473 1
1 1003 . 10 1 1 A 86 86 GLY N N 86 106.594 104.072 2.522 1
1 1004 . 10 1 1 A 87 87 LEU H H 87 8.203 8.518 -0.315 1
1 1005 . 10 1 1 A 87 87 LEU HA H 87 4.629 4.646 -0.017 1
1 1015 . 10 1 1 A 87 87 LEU C C 87 179.155 176.532 2.623 1
1 1016 . 10 1 1 A 87 87 LEU CA C 87 54.814 55.461 -0.647 1
1 1017 . 10 1 1 A 87 87 LEU CB C 87 43.454 42.526 0.928 1
1 1021 . 10 1 1 A 87 87 LEU N N 87 120.879 122.187 -1.308 1
1 1022 . 10 1 1 A 88 88 GLY H H 88 8.492 8.361 0.131 1
1 1023 . 10 1 1 A 88 88 GLY HA2 H 88 4.339 4.192 0.147 1
1 1024 . 10 1 1 A 88 88 GLY HA3 H 88 4.122 4.198 -0.076 1
1 1025 . 10 1 1 A 88 88 GLY C C 88 173.030 173.341 -0.311 1
1 1026 . 10 1 1 A 88 88 GLY CA C 88 43.970 44.658 -0.688 1
1 1027 . 10 1 1 A 88 88 GLY N N 88 109.903 110.374 -0.471 1
1 1028 . 10 1 1 A 89 89 GLU H H 89 7.638 8.847 -1.209 1
1 1029 . 10 1 1 A 89 89 GLU HA H 89 4.103 4.257 -0.154 1
1 1034 . 10 1 1 A 89 89 GLU C C 89 177.511 175.810 1.701 1
1 1035 . 10 1 1 A 89 89 GLU CA C 89 56.659 57.197 -0.538 1
1 1036 . 10 1 1 A 89 89 GLU CB C 89 31.324 30.756 0.568 1
1 1038 . 10 1 1 A 89 89 GLU N N 89 117.551 121.853 -4.302 1
1 1039 . 10 1 1 A 90 90 GLU H H 90 8.734 9.061 -0.327 1
1 1040 . 10 1 1 A 90 90 GLU HA H 90 4.651 5.325 -0.674 1
1 1045 . 10 1 1 A 90 90 GLU C C 90 177.452 174.841 2.611 1
1 1046 . 10 1 1 A 90 90 GLU CA C 90 55.987 54.654 1.333 1
1 1047 . 10 1 1 A 90 90 GLU CB C 90 31.135 33.145 -2.010 1
1 1049 . 10 1 1 A 90 90 GLU N N 90 121.553 118.340 3.213 1
1 1050 . 10 1 1 A 91 91 PHE H H 91 9.411 9.324 0.087 1
1 1051 . 10 1 1 A 91 91 PHE HA H 91 4.665 4.812 -0.147 1
1 1059 . 10 1 1 A 91 91 PHE C C 91 173.944 174.898 -0.954 1
1 1060 . 10 1 1 A 91 91 PHE CA C 91 57.687 58.705 -1.018 1
1 1061 . 10 1 1 A 91 91 PHE CB C 91 40.890 40.173 0.717 1
1 1067 . 10 1 1 A 91 91 PHE N N 91 125.459 124.907 0.552 1
1 1068 . 10 1 1 A 92 92 GLU H H 92 8.043 7.723 0.320 1
1 1069 . 10 1 1 A 92 92 GLU HA H 92 5.424 5.060 0.364 1
1 1074 . 10 1 1 A 92 92 GLU C C 92 174.295 173.934 0.361 1
1 1075 . 10 1 1 A 92 92 GLU CA C 92 54.378 54.887 -0.509 1
1 1076 . 10 1 1 A 92 92 GLU CB C 92 33.662 32.705 0.957 1
1 1078 . 10 1 1 A 92 92 GLU N N 92 128.905 126.122 2.783 1
1 1079 . 10 1 1 A 93 93 LYS H H 93 9.142 9.047 0.095 1
1 1080 . 10 1 1 A 93 93 LYS HA H 93 4.541 5.104 -0.563 1
1 1089 . 10 1 1 A 93 93 LYS C C 93 173.366 173.867 -0.501 1
1 1090 . 10 1 1 A 93 93 LYS CA C 93 55.343 54.945 0.398 1
1 1091 . 10 1 1 A 93 93 LYS CB C 93 37.317 36.231 1.086 1
1 1095 . 10 1 1 A 93 93 LYS N N 93 125.231 127.635 -2.404 1
1 1096 . 10 1 1 A 94 94 GLU H H 94 8.655 9.112 -0.457 1
1 1097 . 10 1 1 A 94 94 GLU HA H 94 5.558 5.349 0.209 1
1 1102 . 10 1 1 A 94 94 GLU C C 94 176.238 175.674 0.564 1
1 1103 . 10 1 1 A 94 94 GLU CA C 94 54.632 55.270 -0.638 1
1 1104 . 10 1 1 A 94 94 GLU CB C 94 32.166 32.387 -0.221 1
1 1106 . 10 1 1 A 94 94 GLU N N 94 127.232 127.989 -0.757 1
1 1107 . 10 1 1 A 95 95 ILE H H 95 9.302 8.903 0.399 1
1 1108 . 10 1 1 A 95 95 ILE HA H 95 4.794 5.168 -0.374 1
1 1118 . 10 1 1 A 95 95 ILE C C 95 173.138 174.222 -1.084 1
1 1119 . 10 1 1 A 95 95 ILE CA C 95 58.570 58.262 0.308 1
1 1120 . 10 1 1 A 95 95 ILE CB C 95 42.420 42.823 -0.403 1
1 1124 . 10 1 1 A 95 95 ILE N N 95 120.711 120.268 0.443 1
1 1125 . 10 1 1 A 96 96 ARG H H 96 8.589 8.750 -0.161 1
1 1126 . 10 1 1 A 96 96 ARG HA H 96 5.373 4.782 0.591 1
1 1133 . 10 1 1 A 96 96 ARG C C 96 177.147 175.046 2.101 1
1 1134 . 10 1 1 A 96 96 ARG CA C 96 54.045 55.043 -0.998 1
1 1135 . 10 1 1 A 96 96 ARG CB C 96 32.001 33.974 -1.973 1
1 1138 . 10 1 1 A 96 96 ARG N N 96 124.445 121.872 2.573 1
1 1139 . 10 1 1 A 97 97 THR H H 97 9.243 8.631 0.612 1
1 1140 . 10 1 1 A 97 97 THR HA H 97 4.459 4.612 -0.153 1
1 1145 . 10 1 1 A 97 97 THR C C 97 172.745 173.878 -1.133 1
1 1146 . 10 1 1 A 97 97 THR CA C 97 59.637 60.591 -0.954 1
1 1147 . 10 1 1 A 97 97 THR CB C 97 67.687 68.986 -1.299 1
1 1149 . 10 1 1 A 97 97 THR N N 97 119.370 118.270 1.100 1
1 1150 . 10 1 1 A 98 98 PRO HA H 98 4.494 4.781 -0.287 1
1 1157 . 10 1 1 A 98 98 PRO CA C 98 63.117 62.688 0.429 1
1 1158 . 10 1 1 A 98 98 PRO CB C 98 32.500 31.730 0.770 1
1 1161 . 10 1 1 A 99 99 GLU H H 99 8.534 8.371 0.163 1
1 1162 . 10 1 1 A 99 99 GLU HA H 99 4.195 4.226 -0.031 1
1 1167 . 10 1 1 A 99 99 GLU C C 99 175.881 175.723 0.158 1
1 1168 . 10 1 1 A 99 99 GLU CA C 99 56.330 56.599 -0.269 1
1 1169 . 10 1 1 A 99 99 GLU CB C 99 31.062 29.814 1.248 1
1 1171 . 10 1 1 A 99 99 GLU N N 99 119.688 119.021 0.667 1
1 1172 . 10 1 1 A 100 100 ASP H H 100 8.536 8.569 -0.033 1
1 1173 . 10 1 1 A 100 100 ASP HA H 100 4.607 4.543 0.064 1
1 1176 . 10 1 1 A 100 100 ASP C C 100 176.012 175.442 0.570 1
1 1177 . 10 1 1 A 100 100 ASP CA C 100 54.109 54.270 -0.161 1
1 1178 . 10 1 1 A 100 100 ASP CB C 100 41.562 41.317 0.245 1
1 1179 . 10 1 1 A 100 100 ASP N N 100 119.803 123.447 -3.644 1
1 1180 . 10 1 1 A 101 101 LEU H H 101 8.403 8.388 0.015 1
1 1181 . 10 1 1 A 101 101 LEU HA H 101 4.426 5.007 -0.581 1
1 1191 . 10 1 1 A 101 101 LEU C C 101 177.534 174.778 2.756 1
1 1192 . 10 1 1 A 101 101 LEU CA C 101 55.113 53.370 1.743 1
1 1193 . 10 1 1 A 101 101 LEU CB C 101 42.156 44.885 -2.729 1
1 1197 . 10 1 1 A 101 101 LEU N N 101 123.876 123.880 -0.004 1
1 1198 . 10 1 1 A 102 102 SER H H 102 8.413 8.940 -0.527 1
1 1199 . 10 1 1 A 102 102 SER HA H 102 4.434 5.479 -1.045 1
1 1202 . 10 1 1 A 102 102 SER C C 102 174.674 173.172 1.502 1
1 1203 . 10 1 1 A 102 102 SER CA C 102 58.798 56.198 2.600 1
1 1204 . 10 1 1 A 102 102 SER CB C 102 63.854 66.413 -2.559 1
1 1205 . 10 1 1 A 102 102 SER N N 102 116.667 119.815 -3.148 1
1 1206 . 10 1 1 A 103 103 GLY H H 103 8.213 8.329 -0.116 1
1 1207 . 10 1 1 A 103 103 GLY HA2 H 103 4.164 4.136 0.028 1
1 1208 . 10 1 1 A 103 103 GLY HA3 H 103 4.057 4.136 -0.079 1
1 1209 . 10 1 1 A 103 103 GLY C C 103 171.822 173.181 -1.359 1
1 1210 . 10 1 1 A 103 103 GLY CA C 103 44.658 44.161 0.497 1
1 1211 . 10 1 1 A 103 103 GLY N N 103 110.592 111.720 -1.128 1
1 1212 . 10 1 1 A 104 104 PRO HA H 104 4.475 4.673 -0.198 1
1 1219 . 10 1 1 A 104 104 PRO C C 104 177.445 177.430 0.015 1
1 1220 . 10 1 1 A 104 104 PRO CA C 104 63.312 62.642 0.670 1
1 1221 . 10 1 1 A 104 104 PRO CB C 104 32.190 31.667 0.523 1
1 1224 . 10 1 1 A 105 105 SER H H 105 8.538 8.762 -0.224 1
1 1225 . 10 1 1 A 105 105 SER HA H 105 4.541 4.381 0.160 1
1 1228 . 10 1 1 A 105 105 SER C C 105 174.616 174.502 0.114 1
1 1229 . 10 1 1 A 105 105 SER CA C 105 58.270 61.106 -2.836 1
1 1230 . 10 1 1 A 105 105 SER CB C 105 63.895 63.168 0.727 1
1 1231 . 10 1 1 A 105 105 SER N N 105 116.446 120.206 -3.760 1
1 1232 . 10 1 1 A 106 106 SER H H 106 8.350 7.570 0.780 1
1 1233 . 10 1 1 A 106 106 SER HA H 106 4.541 4.444 0.097 1
1 1236 . 10 1 1 A 106 106 SER C C 106 174.530 174.589 -0.059 1
1 1237 . 10 1 1 A 106 106 SER CA C 106 58.357 58.123 0.234 1
1 1238 . 10 1 1 A 106 106 SER CB C 106 64.020 63.739 0.281 1
1 1239 . 10 1 1 A 106 106 SER N N 106 117.448 112.569 4.879 1
1 1 . 11 1 1 A 2 2 SER C C 2 174.723 173.632 1.091 1
1 2 . 11 1 1 A 2 2 SER CA C 2 58.446 57.670 0.776 1
1 3 . 11 1 1 A 2 2 SER CB C 2 63.566 65.647 -2.081 1
1 4 . 11 1 1 A 3 3 SER H H 3 8.350 8.789 -0.439 1
1 5 . 11 1 1 A 3 3 SER C C 3 173.961 174.783 -0.822 1
1 6 . 11 1 1 A 3 3 SER CA C 3 58.428 57.249 1.179 1
1 7 . 11 1 1 A 3 3 SER CB C 3 63.937 63.938 -0.001 1
1 8 . 11 1 1 A 3 3 SER N N 3 117.923 121.105 -3.182 1
1 9 . 11 1 1 A 4 4 GLY H H 4 8.050 8.969 -0.919 1
1 10 . 11 1 1 A 4 4 GLY C C 4 179.009 173.605 5.404 1
1 11 . 11 1 1 A 4 4 GLY CA C 4 46.174 47.420 -1.246 1
1 12 . 11 1 1 A 4 4 GLY N N 4 116.890 116.270 0.620 1
1 13 . 11 1 1 A 7 7 GLY HA2 H 7 4.340 4.154 0.186 1
1 14 . 11 1 1 A 7 7 GLY HA3 H 7 3.629 4.155 -0.526 1
1 15 . 11 1 1 A 7 7 GLY CA C 7 44.381 44.626 -0.245 1
1 16 . 11 1 1 A 8 8 PRO HA H 8 4.476 4.557 -0.081 1
1 23 . 11 1 1 A 8 8 PRO C C 8 176.235 177.091 -0.856 1
1 24 . 11 1 1 A 8 8 PRO CA C 8 62.995 62.613 0.382 1
1 25 . 11 1 1 A 8 8 PRO CB C 8 33.266 32.978 0.288 1
1 28 . 11 1 1 A 9 9 GLY H H 9 8.585 8.475 0.110 1
1 29 . 11 1 1 A 9 9 GLY HA2 H 9 4.326 4.111 0.215 1
1 30 . 11 1 1 A 9 9 GLY HA3 H 9 4.009 4.114 -0.105 1
1 31 . 11 1 1 A 9 9 GLY C C 9 172.998 173.452 -0.454 1
1 32 . 11 1 1 A 9 9 GLY CA C 9 44.393 44.200 0.193 1
1 33 . 11 1 1 A 9 9 GLY N N 9 106.004 107.308 -1.304 1
1 34 . 11 1 1 A 10 10 ARG H H 10 8.548 8.429 0.119 1
1 35 . 11 1 1 A 10 10 ARG HA H 10 4.654 4.453 0.201 1
1 41 . 11 1 1 A 10 10 ARG C C 10 175.780 175.540 0.240 1
1 42 . 11 1 1 A 10 10 ARG CA C 10 54.708 55.303 -0.595 1
1 43 . 11 1 1 A 10 10 ARG CB C 10 31.448 30.640 0.808 1
1 45 . 11 1 1 A 10 10 ARG N N 10 119.407 119.226 0.181 1
1 46 . 11 1 1 A 11 11 PRO HA H 11 4.611 4.532 0.079 1
1 53 . 11 1 1 A 11 11 PRO C C 11 173.510 175.617 -2.107 1
1 54 . 11 1 1 A 11 11 PRO CA C 11 62.360 62.581 -0.221 1
1 55 . 11 1 1 A 11 11 PRO CB C 11 33.402 32.088 1.314 1
1 58 . 11 1 1 A 12 12 THR H H 12 7.572 8.382 -0.810 1
1 59 . 11 1 1 A 12 12 THR HA H 12 3.796 3.960 -0.164 1
1 64 . 11 1 1 A 12 12 THR C C 12 172.337 173.129 -0.792 1
1 65 . 11 1 1 A 12 12 THR CA C 12 61.778 61.705 0.073 1
1 66 . 11 1 1 A 12 12 THR CB C 12 70.561 68.429 2.132 1
1 68 . 11 1 1 A 12 12 THR N N 12 109.653 117.590 -7.937 1
1 69 . 11 1 1 A 13 13 MET H H 13 5.605 7.882 -2.277 1
1 70 . 11 1 1 A 13 13 MET HA H 13 5.091 4.878 0.213 1
1 78 . 11 1 1 A 13 13 MET C C 13 172.639 174.880 -2.241 1
1 79 . 11 1 1 A 13 13 MET CA C 13 54.168 53.613 0.555 1
1 80 . 11 1 1 A 13 13 MET CB C 13 37.632 34.456 3.176 1
1 83 . 11 1 1 A 13 13 MET N N 13 121.634 126.696 -5.062 1
1 84 . 11 1 1 A 14 14 MET H H 14 9.254 9.190 0.064 1
1 85 . 11 1 1 A 14 14 MET HA H 14 4.662 5.240 -0.578 1
1 93 . 11 1 1 A 14 14 MET C C 14 174.388 174.758 -0.370 1
1 94 . 11 1 1 A 14 14 MET CA C 14 54.673 54.233 0.440 1
1 95 . 11 1 1 A 14 14 MET CB C 14 34.907 34.699 0.208 1
1 98 . 11 1 1 A 14 14 MET N N 14 125.746 124.183 1.563 1
1 99 . 11 1 1 A 15 15 ILE H H 15 8.555 8.988 -0.433 1
1 100 . 11 1 1 A 15 15 ILE HA H 15 4.882 4.780 0.102 1
1 110 . 11 1 1 A 15 15 ILE C C 15 174.962 175.174 -0.212 1
1 111 . 11 1 1 A 15 15 ILE CA C 15 60.685 60.487 0.198 1
1 112 . 11 1 1 A 15 15 ILE CB C 15 40.878 38.219 2.659 1
1 116 . 11 1 1 A 15 15 ILE N N 15 121.623 125.884 -4.261 1
1 117 . 11 1 1 A 16 16 SER H H 16 8.703 8.998 -0.295 1
1 118 . 11 1 1 A 16 16 SER HA H 16 4.922 5.092 -0.170 1
1 121 . 11 1 1 A 16 16 SER C C 16 173.860 173.055 0.805 1
1 122 . 11 1 1 A 16 16 SER CA C 16 56.524 57.175 -0.651 1
1 123 . 11 1 1 A 16 16 SER CB C 16 65.004 65.638 -0.634 1
1 124 . 11 1 1 A 16 16 SER N N 16 122.261 124.847 -2.586 1
1 125 . 11 1 1 A 17 17 THR H H 17 8.759 8.628 0.131 1
1 126 . 11 1 1 A 17 17 THR HA H 17 4.885 4.868 0.017 1
1 131 . 11 1 1 A 17 17 THR C C 17 175.018 174.477 0.541 1
1 132 . 11 1 1 A 17 17 THR CA C 17 60.315 60.723 -0.408 1
1 133 . 11 1 1 A 17 17 THR CB C 17 69.799 70.154 -0.355 1
1 135 . 11 1 1 A 17 17 THR N N 17 115.660 115.462 0.198 1
1 136 . 11 1 1 A 18 18 THR H H 18 8.038 8.813 -0.775 1
1 137 . 11 1 1 A 18 18 THR HA H 18 4.596 4.442 0.154 1
1 142 . 11 1 1 A 18 18 THR CA C 18 60.707 62.220 -1.513 1
1 143 . 11 1 1 A 18 18 THR CB C 18 71.082 69.702 1.380 1
1 145 . 11 1 1 A 18 18 THR N N 18 112.362 115.195 -2.833 1
1 146 . 11 1 1 A 19 19 ALA H H 19 8.545 7.438 1.107 1
1 147 . 11 1 1 A 19 19 ALA HA H 19 4.412 4.434 -0.022 1
1 151 . 11 1 1 A 19 19 ALA C C 19 177.034 177.160 -0.126 1
1 152 . 11 1 1 A 19 19 ALA CA C 19 52.264 51.652 0.612 1
1 153 . 11 1 1 A 19 19 ALA CB C 19 19.292 20.974 -1.682 1
1 154 . 11 1 1 A 19 19 ALA N N 19 119.589 123.635 -4.046 1
1 155 . 11 1 1 A 20 20 MET H H 20 8.145 8.484 -0.339 1
1 156 . 11 1 1 A 20 20 MET HA H 20 4.447 4.346 0.101 1
1 164 . 11 1 1 A 20 20 MET C C 20 175.676 176.535 -0.859 1
1 165 . 11 1 1 A 20 20 MET CA C 20 55.764 54.743 1.021 1
1 166 . 11 1 1 A 20 20 MET CB C 20 31.495 32.191 -0.696 1
1 169 . 11 1 1 A 20 20 MET N N 20 116.950 118.648 -1.698 1
1 170 . 11 1 1 A 21 21 ASN H H 21 8.275 8.997 -0.722 1
1 171 . 11 1 1 A 21 21 ASN HA H 21 4.452 4.367 0.085 1
1 176 . 11 1 1 A 21 21 ASN C C 21 174.100 173.813 0.287 1
1 177 . 11 1 1 A 21 21 ASN CA C 21 54.320 54.656 -0.336 1
1 178 . 11 1 1 A 21 21 ASN CB C 21 37.234 37.237 -0.003 1
1 179 . 11 1 1 A 21 21 ASN N N 21 113.198 118.536 -5.338 1
1 181 . 11 1 1 A 22 22 THR H H 22 7.071 7.433 -0.362 1
1 182 . 11 1 1 A 22 22 THR HA H 22 5.218 5.416 -0.198 1
1 187 . 11 1 1 A 22 22 THR C C 22 173.301 172.926 0.375 1
1 188 . 11 1 1 A 22 22 THR CA C 22 59.399 60.369 -0.970 1
1 189 . 11 1 1 A 22 22 THR CB C 22 72.714 72.018 0.696 1
1 191 . 11 1 1 A 22 22 THR N N 22 107.603 107.667 -0.064 1
1 192 . 11 1 1 A 23 23 ALA H H 23 8.687 8.883 -0.196 1
1 193 . 11 1 1 A 23 23 ALA HA H 23 4.925 5.142 -0.217 1
1 197 . 11 1 1 A 23 23 ALA C C 23 174.100 175.393 -1.293 1
1 198 . 11 1 1 A 23 23 ALA CA C 23 50.812 50.102 0.710 1
1 199 . 11 1 1 A 23 23 ALA CB C 23 21.122 21.594 -0.472 1
1 200 . 11 1 1 A 23 23 ALA N N 23 121.937 125.372 -3.435 1
1 201 . 11 1 1 A 24 24 LEU H H 24 8.833 9.088 -0.255 1
1 202 . 11 1 1 A 24 24 LEU HA H 24 4.673 4.503 0.170 1
1 212 . 11 1 1 A 24 24 LEU C C 24 175.140 174.665 0.475 1
1 213 . 11 1 1 A 24 24 LEU CA C 24 54.320 54.961 -0.641 1
1 214 . 11 1 1 A 24 24 LEU CB C 24 42.518 43.009 -0.491 1
1 218 . 11 1 1 A 24 24 LEU N N 24 123.721 126.219 -2.498 1
1 219 . 11 1 1 A 25 25 LEU H H 25 9.176 9.030 0.146 1
1 220 . 11 1 1 A 25 25 LEU HA H 25 5.112 5.036 0.076 1
1 230 . 11 1 1 A 25 25 LEU C C 25 176.414 175.698 0.716 1
1 231 . 11 1 1 A 25 25 LEU CA C 25 54.108 53.093 1.015 1
1 232 . 11 1 1 A 25 25 LEU CB C 25 43.230 42.975 0.255 1
1 236 . 11 1 1 A 25 25 LEU N N 25 128.589 128.482 0.107 1
1 237 . 11 1 1 A 26 26 GLN H H 26 8.556 8.422 0.134 1
1 238 . 11 1 1 A 26 26 GLN HA H 26 4.737 4.846 -0.109 1
1 245 . 11 1 1 A 26 26 GLN C C 26 174.372 174.236 0.136 1
1 246 . 11 1 1 A 26 26 GLN CA C 26 56.365 54.421 1.944 1
1 247 . 11 1 1 A 26 26 GLN CB C 26 33.320 31.855 1.465 1
1 249 . 11 1 1 A 26 26 GLN N N 26 119.630 122.855 -3.225 1
1 251 . 11 1 1 A 27 27 TRP H H 27 8.080 7.895 0.185 1
1 252 . 11 1 1 A 27 27 TRP HA H 27 5.441 5.779 -0.338 1
1 261 . 11 1 1 A 27 27 TRP CA C 27 55.957 54.391 1.566 1
1 262 . 11 1 1 A 27 27 TRP CB C 27 32.517 32.225 0.292 1
1 268 . 11 1 1 A 27 27 TRP N N 27 121.276 121.687 -0.411 1
1 270 . 11 1 1 A 28 28 HIS H H 28 8.262 8.585 -0.323 1
1 271 . 11 1 1 A 28 28 HIS HA H 28 4.997 5.013 -0.016 1
1 275 . 11 1 1 A 28 28 HIS CA C 28 53.028 53.927 -0.899 1
1 276 . 11 1 1 A 28 28 HIS CB C 28 32.832 32.849 -0.017 1
1 278 . 11 1 1 A 28 28 HIS N N 28 116.245 116.825 -0.580 1
1 279 . 11 1 1 A 29 29 PRO HA H 29 4.984 4.660 0.324 1
1 286 . 11 1 1 A 29 29 PRO CA C 29 61.498 62.081 -0.583 1
1 287 . 11 1 1 A 29 29 PRO CB C 29 30.709 32.414 -1.705 1
1 290 . 11 1 1 A 30 30 PRO HA H 30 4.449 4.706 -0.257 1
1 297 . 11 1 1 A 30 30 PRO C C 30 175.733 176.345 -0.612 1
1 298 . 11 1 1 A 30 30 PRO CA C 30 62.245 62.448 -0.203 1
1 299 . 11 1 1 A 30 30 PRO CB C 30 32.083 33.417 -1.334 1
1 302 . 11 1 1 A 31 31 LYS H H 31 8.403 8.643 -0.240 1
1 303 . 11 1 1 A 31 31 LYS HA H 31 4.084 4.453 -0.369 1
1 312 . 11 1 1 A 31 31 LYS C C 31 177.166 178.110 -0.944 1
1 313 . 11 1 1 A 31 31 LYS CA C 31 57.866 56.834 1.032 1
1 314 . 11 1 1 A 31 31 LYS CB C 31 32.698 34.535 -1.837 1
1 318 . 11 1 1 A 31 31 LYS N N 31 121.693 120.057 1.636 1
1 319 . 11 1 1 A 32 32 GLU H H 32 8.102 7.896 0.206 1
1 320 . 11 1 1 A 32 32 GLU HA H 32 4.365 4.508 -0.143 1
1 325 . 11 1 1 A 32 32 GLU C C 32 174.248 175.972 -1.724 1
1 326 . 11 1 1 A 32 32 GLU CA C 32 55.448 55.669 -0.221 1
1 327 . 11 1 1 A 32 32 GLU CB C 32 29.405 29.909 -0.504 1
1 329 . 11 1 1 A 32 32 GLU N N 32 118.742 117.001 1.741 1
1 330 . 11 1 1 A 33 33 LEU H H 33 8.420 7.526 0.894 1
1 331 . 11 1 1 A 33 33 LEU HA H 33 4.499 4.696 -0.197 1
1 341 . 11 1 1 A 33 33 LEU C C 33 173.036 174.988 -1.952 1
1 342 . 11 1 1 A 33 33 LEU CA C 33 52.863 52.019 0.844 1
1 343 . 11 1 1 A 33 33 LEU CB C 33 42.535 43.189 -0.654 1
1 347 . 11 1 1 A 33 33 LEU N N 33 125.181 123.954 1.227 1
1 348 . 11 1 1 A 34 34 PRO HA H 34 4.488 4.510 -0.022 1
1 355 . 11 1 1 A 34 34 PRO C C 34 177.544 176.590 0.954 1
1 356 . 11 1 1 A 34 34 PRO CA C 34 62.889 63.087 -0.198 1
1 357 . 11 1 1 A 34 34 PRO CB C 34 31.472 30.914 0.558 1
1 360 . 11 1 1 A 35 35 GLY H H 35 8.397 7.999 0.398 1
1 361 . 11 1 1 A 35 35 GLY HA2 H 35 4.059 4.133 -0.074 1
1 362 . 11 1 1 A 35 35 GLY HA3 H 35 3.716 4.133 -0.417 1
1 363 . 11 1 1 A 35 35 GLY C C 35 173.356 171.455 1.901 1
1 364 . 11 1 1 A 35 35 GLY CA C 35 45.892 44.682 1.210 1
1 365 . 11 1 1 A 35 35 GLY N N 35 110.524 111.958 -1.434 1
1 366 . 11 1 1 A 36 36 GLU H H 36 8.091 8.695 -0.604 1
1 367 . 11 1 1 A 36 36 GLU HA H 36 4.371 5.072 -0.701 1
1 372 . 11 1 1 A 36 36 GLU C C 36 174.864 175.322 -0.458 1
1 373 . 11 1 1 A 36 36 GLU CA C 36 55.201 54.733 0.468 1
1 374 . 11 1 1 A 36 36 GLU CB C 36 31.878 33.606 -1.728 1
1 376 . 11 1 1 A 36 36 GLU N N 36 122.202 122.954 -0.752 1
1 377 . 11 1 1 A 37 37 LEU H H 37 8.307 8.659 -0.352 1
1 378 . 11 1 1 A 37 37 LEU HA H 37 4.288 4.280 0.008 1
1 388 . 11 1 1 A 37 37 LEU C C 37 176.702 175.972 0.730 1
1 389 . 11 1 1 A 37 37 LEU CA C 37 55.342 56.655 -1.313 1
1 390 . 11 1 1 A 37 37 LEU CB C 37 42.715 42.041 0.674 1
1 394 . 11 1 1 A 37 37 LEU N N 37 123.204 127.292 -4.088 1
1 395 . 11 1 1 A 38 38 LEU H H 38 8.909 8.793 0.116 1
1 396 . 11 1 1 A 38 38 LEU HA H 38 4.640 4.730 -0.090 1
1 406 . 11 1 1 A 38 38 LEU C C 38 177.202 176.282 0.920 1
1 407 . 11 1 1 A 38 38 LEU CA C 38 54.390 54.628 -0.238 1
1 408 . 11 1 1 A 38 38 LEU CB C 38 43.770 43.508 0.262 1
1 412 . 11 1 1 A 38 38 LEU N N 38 123.021 127.221 -4.200 1
1 413 . 11 1 1 A 39 39 GLY H H 39 7.113 6.909 0.204 1
1 414 . 11 1 1 A 39 39 GLY HA2 H 39 4.816 3.564 1.252 1
1 415 . 11 1 1 A 39 39 GLY HA3 H 39 3.276 3.913 -0.637 1
1 416 . 11 1 1 A 39 39 GLY C C 39 169.863 170.328 -0.465 1
1 417 . 11 1 1 A 39 39 GLY CA C 39 44.622 45.319 -0.697 1
1 418 . 11 1 1 A 39 39 GLY N N 39 104.137 104.929 -0.792 1
1 419 . 11 1 1 A 40 40 TYR H H 40 8.318 9.096 -0.778 1
1 420 . 11 1 1 A 40 40 TYR HA H 40 5.414 5.123 0.291 1
1 425 . 11 1 1 A 40 40 TYR C C 40 174.448 172.161 2.287 1
1 426 . 11 1 1 A 40 40 TYR CA C 40 56.178 56.534 -0.356 1
1 427 . 11 1 1 A 40 40 TYR CB C 40 44.191 40.633 3.558 1
1 430 . 11 1 1 A 40 40 TYR N N 40 114.036 115.416 -1.380 1
1 431 . 11 1 1 A 41 41 ARG H H 41 9.347 8.391 0.956 1
1 432 . 11 1 1 A 41 41 ARG HA H 41 5.092 5.417 -0.325 1
1 440 . 11 1 1 A 41 41 ARG C C 41 174.097 174.112 -0.015 1
1 441 . 11 1 1 A 41 41 ARG CA C 41 56.100 54.212 1.888 1
1 442 . 11 1 1 A 41 41 ARG CB C 41 34.508 32.837 1.671 1
1 445 . 11 1 1 A 41 41 ARG N N 41 122.231 121.209 1.022 1
1 447 . 11 1 1 A 42 42 LEU H H 42 9.546 9.104 0.442 1
1 448 . 11 1 1 A 42 42 LEU HA H 42 5.459 5.320 0.139 1
1 458 . 11 1 1 A 42 42 LEU C C 42 174.913 174.702 0.211 1
1 459 . 11 1 1 A 42 42 LEU CA C 42 52.997 53.356 -0.359 1
1 460 . 11 1 1 A 42 42 LEU CB C 42 46.413 45.656 0.757 1
1 464 . 11 1 1 A 42 42 LEU N N 42 132.335 127.577 4.758 1
1 465 . 11 1 1 A 43 43 GLN H H 43 9.502 9.247 0.255 1
1 466 . 11 1 1 A 43 43 GLN HA H 43 5.847 5.253 0.594 1
1 473 . 11 1 1 A 43 43 GLN C C 43 175.329 174.017 1.312 1
1 474 . 11 1 1 A 43 43 GLN CA C 43 54.005 54.468 -0.463 1
1 475 . 11 1 1 A 43 43 GLN CB C 43 33.429 31.794 1.635 1
1 477 . 11 1 1 A 43 43 GLN N N 43 123.932 125.371 -1.439 1
1 479 . 11 1 1 A 44 44 TYR H H 44 8.615 8.508 0.107 1
1 480 . 11 1 1 A 44 44 TYR HA H 44 5.783 5.617 0.166 1
1 487 . 11 1 1 A 44 44 TYR C C 44 174.058 173.466 0.592 1
1 488 . 11 1 1 A 44 44 TYR CA C 44 55.942 55.986 -0.044 1
1 489 . 11 1 1 A 44 44 TYR CB C 44 43.052 41.569 1.483 1
1 494 . 11 1 1 A 44 44 TYR N N 44 117.355 119.621 -2.266 1
1 495 . 11 1 1 A 45 45 CYS H H 45 8.377 8.287 0.090 1
1 496 . 11 1 1 A 45 45 CYS HA H 45 4.772 5.105 -0.333 1
1 499 . 11 1 1 A 45 45 CYS C C 45 173.205 173.852 -0.647 1
1 500 . 11 1 1 A 45 45 CYS CA C 45 55.960 56.882 -0.922 1
1 501 . 11 1 1 A 45 45 CYS CB C 45 30.665 31.314 -0.649 1
1 502 . 11 1 1 A 45 45 CYS N N 45 115.140 118.316 -3.176 1
1 503 . 11 1 1 A 46 46 ARG H H 46 9.165 8.386 0.779 1
1 504 . 11 1 1 A 46 46 ARG HA H 46 4.068 3.771 0.297 1
1 511 . 11 1 1 A 46 46 ARG C C 46 178.440 177.553 0.887 1
1 512 . 11 1 1 A 46 46 ARG CA C 46 56.401 55.674 0.727 1
1 513 . 11 1 1 A 46 46 ARG CB C 46 31.878 30.779 1.099 1
1 516 . 11 1 1 A 46 46 ARG N N 46 121.803 121.289 0.514 1
1 517 . 11 1 1 A 47 47 ALA H H 47 8.273 8.133 0.140 1
1 518 . 11 1 1 A 47 47 ALA HA H 47 3.891 4.017 -0.126 1
1 522 . 11 1 1 A 47 47 ALA C C 47 177.599 177.233 0.366 1
1 523 . 11 1 1 A 47 47 ALA CA C 47 54.796 53.803 0.993 1
1 524 . 11 1 1 A 47 47 ALA CB C 47 18.287 18.528 -0.241 1
1 525 . 11 1 1 A 47 47 ALA N N 47 123.895 123.780 0.115 1
1 526 . 11 1 1 A 48 48 ASP H H 48 8.036 8.234 -0.198 1
1 527 . 11 1 1 A 48 48 ASP HA H 48 4.453 4.828 -0.375 1
1 530 . 11 1 1 A 48 48 ASP C C 48 175.836 175.607 0.229 1
1 531 . 11 1 1 A 48 48 ASP CA C 48 53.368 52.958 0.410 1
1 532 . 11 1 1 A 48 48 ASP CB C 48 39.964 41.414 -1.450 1
1 533 . 11 1 1 A 48 48 ASP N N 48 112.576 117.756 -5.180 1
1 534 . 11 1 1 A 49 49 GLU H H 49 7.495 7.472 0.023 1
1 535 . 11 1 1 A 49 49 GLU HA H 49 4.308 4.688 -0.380 1
1 540 . 11 1 1 A 49 49 GLU C C 49 175.756 176.110 -0.354 1
1 541 . 11 1 1 A 49 49 GLU CA C 49 56.224 55.151 1.073 1
1 542 . 11 1 1 A 49 49 GLU CB C 49 32.248 32.054 0.194 1
1 544 . 11 1 1 A 49 49 GLU N N 49 120.609 119.677 0.932 1
1 545 . 11 1 1 A 50 50 ALA H H 50 8.416 8.603 -0.187 1
1 546 . 11 1 1 A 50 50 ALA HA H 50 4.200 4.306 -0.106 1
1 550 . 11 1 1 A 50 50 ALA C C 50 177.433 177.153 0.280 1
1 551 . 11 1 1 A 50 50 ALA CA C 50 53.297 52.652 0.645 1
1 552 . 11 1 1 A 50 50 ALA CB C 50 19.474 19.801 -0.327 1
1 553 . 11 1 1 A 50 50 ALA N N 50 124.065 127.522 -3.457 1
1 554 . 11 1 1 A 51 51 ARG H H 51 7.648 7.626 0.022 1
1 555 . 11 1 1 A 51 51 ARG HA H 51 4.747 4.607 0.140 1
1 562 . 11 1 1 A 51 51 ARG C C 51 173.400 173.555 -0.155 1
1 563 . 11 1 1 A 51 51 ARG CA C 51 52.592 52.746 -0.154 1
1 564 . 11 1 1 A 51 51 ARG CB C 51 31.212 30.723 0.489 1
1 567 . 11 1 1 A 51 51 ARG N N 51 117.798 118.944 -1.146 1
1 568 . 11 1 1 A 52 52 PRO HA H 52 4.212 4.466 -0.254 1
1 575 . 11 1 1 A 52 52 PRO C C 52 176.380 176.492 -0.112 1
1 576 . 11 1 1 A 52 52 PRO CA C 52 62.360 62.580 -0.220 1
1 577 . 11 1 1 A 52 52 PRO CB C 52 32.331 32.117 0.214 1
1 580 . 11 1 1 A 53 53 ASN H H 53 8.127 7.732 0.395 1
1 581 . 11 1 1 A 53 53 ASN HA H 53 4.651 4.771 -0.120 1
1 586 . 11 1 1 A 53 53 ASN C C 53 174.354 174.495 -0.141 1
1 587 . 11 1 1 A 53 53 ASN CA C 53 53.136 52.632 0.504 1
1 588 . 11 1 1 A 53 53 ASN CB C 53 39.666 38.314 1.352 1
1 589 . 11 1 1 A 53 53 ASN N N 53 119.405 119.929 -0.524 1
1 591 . 11 1 1 A 54 54 THR H H 54 8.425 8.571 -0.146 1
1 592 . 11 1 1 A 54 54 THR HA H 54 5.306 4.407 0.899 1
1 597 . 11 1 1 A 54 54 THR C C 54 173.850 174.148 -0.298 1
1 598 . 11 1 1 A 54 54 THR CA C 54 61.881 63.441 -1.560 1
1 599 . 11 1 1 A 54 54 THR CB C 54 70.573 69.239 1.334 1
1 601 . 11 1 1 A 54 54 THR N N 54 118.968 121.665 -2.697 1
1 602 . 11 1 1 A 55 55 ILE H H 55 9.354 8.811 0.543 1
1 603 . 11 1 1 A 55 55 ILE HA H 55 4.051 4.612 -0.561 1
1 613 . 11 1 1 A 55 55 ILE C C 55 172.975 173.518 -0.543 1
1 614 . 11 1 1 A 55 55 ILE CA C 55 61.003 59.633 1.370 1
1 615 . 11 1 1 A 55 55 ILE CB C 55 41.619 42.018 -0.399 1
1 619 . 11 1 1 A 55 55 ILE N N 55 127.961 126.559 1.402 1
1 620 . 11 1 1 A 56 56 ASP H H 56 8.132 8.643 -0.511 1
1 621 . 11 1 1 A 56 56 ASP HA H 56 5.334 5.195 0.139 1
1 624 . 11 1 1 A 56 56 ASP C C 56 174.969 174.692 0.277 1
1 625 . 11 1 1 A 56 56 ASP CA C 56 53.702 52.828 0.874 1
1 626 . 11 1 1 A 56 56 ASP CB C 56 43.251 42.948 0.303 1
1 627 . 11 1 1 A 56 56 ASP N N 56 125.882 126.815 -0.933 1
1 628 . 11 1 1 A 57 57 PHE H H 57 8.955 8.747 0.208 1
1 629 . 11 1 1 A 57 57 PHE HA H 57 4.915 5.079 -0.164 1
1 637 . 11 1 1 A 57 57 PHE C C 57 177.361 175.498 1.863 1
1 638 . 11 1 1 A 57 57 PHE CA C 57 57.458 56.539 0.919 1
1 639 . 11 1 1 A 57 57 PHE CB C 57 43.737 43.172 0.565 1
1 645 . 11 1 1 A 57 57 PHE N N 57 118.872 122.912 -4.040 1
1 646 . 11 1 1 A 58 58 GLY H H 58 9.552 9.109 0.443 1
1 647 . 11 1 1 A 58 58 GLY HA2 H 58 4.662 4.093 0.569 1
1 648 . 11 1 1 A 58 58 GLY HA3 H 58 4.126 4.173 -0.047 1
1 649 . 11 1 1 A 58 58 GLY C C 58 174.760 174.934 -0.174 1
1 650 . 11 1 1 A 58 58 GLY CA C 58 44.680 44.962 -0.282 1
1 651 . 11 1 1 A 58 58 GLY N N 58 111.551 110.311 1.240 1
1 652 . 11 1 1 A 59 59 LYS H H 59 8.211 8.656 -0.445 1
1 653 . 11 1 1 A 59 59 LYS HA H 59 3.782 3.684 0.098 1
1 662 . 11 1 1 A 59 59 LYS C C 59 176.154 178.133 -1.979 1
1 663 . 11 1 1 A 59 59 LYS CA C 59 59.080 58.822 0.258 1
1 664 . 11 1 1 A 59 59 LYS CB C 59 32.516 31.777 0.739 1
1 668 . 11 1 1 A 59 59 LYS N N 59 115.953 120.255 -4.302 1
1 669 . 11 1 1 A 60 60 ASP H H 60 8.634 8.773 -0.139 1
1 670 . 11 1 1 A 60 60 ASP HA H 60 4.882 4.409 0.473 1
1 673 . 11 1 1 A 60 60 ASP C C 60 176.039 176.527 -0.488 1
1 674 . 11 1 1 A 60 60 ASP CA C 60 54.327 57.081 -2.754 1
1 675 . 11 1 1 A 60 60 ASP CB C 60 41.461 40.035 1.426 1
1 676 . 11 1 1 A 60 60 ASP N N 60 117.261 119.410 -2.149 1
1 677 . 11 1 1 A 61 61 ASP H H 61 7.500 8.193 -0.693 1
1 678 . 11 1 1 A 61 61 ASP HA H 61 4.591 4.668 -0.077 1
1 681 . 11 1 1 A 61 61 ASP C C 61 175.140 175.922 -0.782 1
1 682 . 11 1 1 A 61 61 ASP CA C 61 55.342 54.007 1.335 1
1 683 . 11 1 1 A 61 61 ASP CB C 61 42.475 40.104 2.371 1
1 684 . 11 1 1 A 61 61 ASP N N 61 122.319 119.050 3.269 1
1 685 . 11 1 1 A 62 62 GLN H H 62 8.239 8.041 0.198 1
1 686 . 11 1 1 A 62 62 GLN HA H 62 2.569 3.845 -1.276 1
1 693 . 11 1 1 A 62 62 GLN C C 62 172.652 173.794 -1.142 1
1 694 . 11 1 1 A 62 62 GLN CA C 62 54.038 55.600 -1.562 1
1 695 . 11 1 1 A 62 62 GLN CB C 62 31.481 29.366 2.115 1
1 697 . 11 1 1 A 62 62 GLN N N 62 117.458 123.497 -6.039 1
1 699 . 11 1 1 A 63 63 HIS H H 63 6.338 6.787 -0.449 1
1 700 . 11 1 1 A 63 63 HIS HA H 63 4.423 4.357 0.066 1
1 704 . 11 1 1 A 63 63 HIS C C 63 173.031 172.467 0.564 1
1 705 . 11 1 1 A 63 63 HIS CA C 63 54.743 54.066 0.677 1
1 706 . 11 1 1 A 63 63 HIS CB C 63 32.661 31.242 1.419 1
1 708 . 11 1 1 A 63 63 HIS N N 63 113.589 116.093 -2.504 1
1 709 . 11 1 1 A 64 64 PHE H H 64 8.549 9.110 -0.561 1
1 710 . 11 1 1 A 64 64 PHE HA H 64 4.578 5.150 -0.572 1
1 718 . 11 1 1 A 64 64 PHE C C 64 173.015 173.423 -0.408 1
1 719 . 11 1 1 A 64 64 PHE CA C 64 58.516 56.937 1.579 1
1 720 . 11 1 1 A 64 64 PHE CB C 64 43.525 43.233 0.292 1
1 726 . 11 1 1 A 64 64 PHE N N 64 118.214 120.033 -1.819 1
1 727 . 11 1 1 A 65 65 THR H H 65 7.150 8.008 -0.858 1
1 728 . 11 1 1 A 65 65 THR HA H 65 4.930 4.775 0.155 1
1 733 . 11 1 1 A 65 65 THR C C 65 172.457 173.205 -0.748 1
1 734 . 11 1 1 A 65 65 THR CA C 65 61.690 61.653 0.037 1
1 735 . 11 1 1 A 65 65 THR CB C 65 69.593 69.343 0.250 1
1 737 . 11 1 1 A 65 65 THR N N 65 123.198 119.555 3.643 1
1 738 . 11 1 1 A 66 66 VAL H H 66 8.888 8.508 0.380 1
1 739 . 11 1 1 A 66 66 VAL HA H 66 4.018 4.811 -0.793 1
1 747 . 11 1 1 A 66 66 VAL C C 66 174.868 175.238 -0.370 1
1 748 . 11 1 1 A 66 66 VAL CA C 66 61.178 60.302 0.876 1
1 749 . 11 1 1 A 66 66 VAL CB C 66 33.114 33.382 -0.268 1
1 752 . 11 1 1 A 66 66 VAL N N 66 126.840 128.412 -1.572 1
1 753 . 11 1 1 A 67 67 THR H H 67 8.174 8.526 -0.352 1
1 754 . 11 1 1 A 67 67 THR HA H 67 4.816 5.038 -0.222 1
1 759 . 11 1 1 A 67 67 THR C C 67 174.494 174.278 0.216 1
1 760 . 11 1 1 A 67 67 THR CA C 67 59.786 59.526 0.260 1
1 761 . 11 1 1 A 67 67 THR CB C 67 70.887 71.621 -0.734 1
1 763 . 11 1 1 A 67 67 THR N N 67 116.127 117.064 -0.937 1
1 764 . 11 1 1 A 68 68 GLY H H 68 8.570 9.032 -0.462 1
1 765 . 11 1 1 A 68 68 GLY HA2 H 68 3.970 4.023 -0.053 1
1 766 . 11 1 1 A 68 68 GLY HA3 H 68 3.819 4.033 -0.214 1
1 767 . 11 1 1 A 68 68 GLY C C 68 175.636 174.647 0.989 1
1 768 . 11 1 1 A 68 68 GLY CA C 68 46.397 44.957 1.440 1
1 769 . 11 1 1 A 68 68 GLY N N 68 107.146 112.993 -5.847 1
1 770 . 11 1 1 A 69 69 LEU H H 69 8.007 7.641 0.366 1
1 771 . 11 1 1 A 69 69 LEU HA H 69 4.154 4.242 -0.088 1
1 781 . 11 1 1 A 69 69 LEU C C 69 176.830 176.551 0.279 1
1 782 . 11 1 1 A 69 69 LEU CA C 69 54.602 55.255 -0.653 1
1 783 . 11 1 1 A 69 69 LEU CB C 69 41.149 41.922 -0.773 1
1 787 . 11 1 1 A 69 69 LEU N N 69 118.433 123.167 -4.734 1
1 788 . 11 1 1 A 70 70 HIS H H 70 8.866 8.744 0.122 1
1 789 . 11 1 1 A 70 70 HIS HA H 70 4.663 4.658 0.005 1
1 793 . 11 1 1 A 70 70 HIS C C 70 176.667 175.549 1.118 1
1 794 . 11 1 1 A 70 70 HIS CA C 70 55.464 56.920 -1.456 1
1 795 . 11 1 1 A 70 70 HIS CB C 70 32.125 29.944 2.181 1
1 797 . 11 1 1 A 70 70 HIS N N 70 122.457 122.127 0.330 1
1 798 . 11 1 1 A 71 71 LYS H H 71 8.716 8.636 0.080 1
1 799 . 11 1 1 A 71 71 LYS HA H 71 4.320 4.131 0.189 1
1 808 . 11 1 1 A 71 71 LYS C C 71 178.110 176.858 1.252 1
1 809 . 11 1 1 A 71 71 LYS CA C 71 57.035 56.572 0.463 1
1 810 . 11 1 1 A 71 71 LYS CB C 71 33.580 32.706 0.874 1
1 814 . 11 1 1 A 71 71 LYS N N 71 123.173 124.053 -0.880 1
1 815 . 11 1 1 A 72 72 GLY H H 72 7.709 8.869 -1.160 1
1 816 . 11 1 1 A 72 72 GLY HA2 H 72 3.800 3.923 -0.123 1
1 817 . 11 1 1 A 72 72 GLY HA3 H 72 3.769 3.929 -0.160 1
1 818 . 11 1 1 A 72 72 GLY C C 72 174.231 173.968 0.263 1
1 819 . 11 1 1 A 72 72 GLY CA C 72 47.866 46.377 1.489 1
1 820 . 11 1 1 A 72 72 GLY N N 72 114.881 111.216 3.665 1
1 821 . 11 1 1 A 73 73 THR H H 73 8.162 7.713 0.449 1
1 822 . 11 1 1 A 73 73 THR HA H 73 4.584 4.685 -0.101 1
1 827 . 11 1 1 A 73 73 THR C C 73 172.208 173.284 -1.076 1
1 828 . 11 1 1 A 73 73 THR CA C 73 62.307 61.278 1.029 1
1 829 . 11 1 1 A 73 73 THR CB C 73 72.123 71.856 0.267 1
1 831 . 11 1 1 A 73 73 THR N N 73 114.225 114.461 -0.236 1
1 832 . 11 1 1 A 74 74 THR H H 74 8.743 8.718 0.025 1
1 833 . 11 1 1 A 74 74 THR HA H 74 5.138 4.854 0.284 1
1 838 . 11 1 1 A 74 74 THR C C 74 173.376 173.279 0.097 1
1 839 . 11 1 1 A 74 74 THR CA C 74 62.724 62.990 -0.266 1
1 840 . 11 1 1 A 74 74 THR CB C 74 69.202 69.647 -0.445 1
1 842 . 11 1 1 A 74 74 THR N N 74 123.376 121.261 2.115 1
1 843 . 11 1 1 A 75 75 TYR H H 75 9.549 9.088 0.461 1
1 844 . 11 1 1 A 75 75 TYR HA H 75 4.892 5.206 -0.314 1
1 851 . 11 1 1 A 75 75 TYR C C 75 173.991 175.306 -1.315 1
1 852 . 11 1 1 A 75 75 TYR CA C 75 57.740 55.957 1.783 1
1 853 . 11 1 1 A 75 75 TYR CB C 75 44.580 43.387 1.193 1
1 858 . 11 1 1 A 75 75 TYR N N 75 126.916 124.540 2.376 1
1 859 . 11 1 1 A 76 76 ILE H H 76 8.769 8.763 0.006 1
1 860 . 11 1 1 A 76 76 ILE HA H 76 4.663 4.915 -0.252 1
1 870 . 11 1 1 A 76 76 ILE C C 76 174.683 175.096 -0.413 1
1 871 . 11 1 1 A 76 76 ILE CA C 76 60.455 60.811 -0.356 1
1 872 . 11 1 1 A 76 76 ILE CB C 76 40.284 40.154 0.130 1
1 876 . 11 1 1 A 76 76 ILE N N 76 119.407 120.828 -1.421 1
1 877 . 11 1 1 A 77 77 PHE H H 77 8.894 8.940 -0.046 1
1 878 . 11 1 1 A 77 77 PHE HA H 77 5.160 5.167 -0.007 1
1 886 . 11 1 1 A 77 77 PHE C C 77 174.794 175.433 -0.639 1
1 887 . 11 1 1 A 77 77 PHE CA C 77 56.831 57.483 -0.652 1
1 888 . 11 1 1 A 77 77 PHE CB C 77 43.132 41.177 1.955 1
1 894 . 11 1 1 A 77 77 PHE N N 77 124.622 127.126 -2.504 1
1 895 . 11 1 1 A 78 78 ARG H H 78 9.407 9.120 0.287 1
1 896 . 11 1 1 A 78 78 ARG HA H 78 5.689 5.706 -0.017 1
1 904 . 11 1 1 A 78 78 ARG C C 78 174.376 174.654 -0.278 1
1 905 . 11 1 1 A 78 78 ARG CA C 78 54.530 54.618 -0.088 1
1 906 . 11 1 1 A 78 78 ARG CB C 78 34.473 34.184 0.289 1
1 909 . 11 1 1 A 78 78 ARG N N 78 120.055 120.703 -0.648 1
1 911 . 11 1 1 A 79 79 LEU H H 79 9.132 9.003 0.129 1
1 912 . 11 1 1 A 79 79 LEU HA H 79 5.398 5.037 0.361 1
1 922 . 11 1 1 A 79 79 LEU C C 79 174.006 174.262 -0.256 1
1 923 . 11 1 1 A 79 79 LEU CA C 79 53.401 53.342 0.059 1
1 924 . 11 1 1 A 79 79 LEU CB C 79 48.116 46.583 1.533 1
1 928 . 11 1 1 A 79 79 LEU N N 79 124.907 124.518 0.389 1
1 929 . 11 1 1 A 80 80 ALA H H 80 8.737 7.980 0.757 1
1 930 . 11 1 1 A 80 80 ALA HA H 80 4.871 5.006 -0.135 1
1 934 . 11 1 1 A 80 80 ALA C C 80 176.057 175.791 0.266 1
1 935 . 11 1 1 A 80 80 ALA CA C 80 50.353 51.256 -0.903 1
1 936 . 11 1 1 A 80 80 ALA CB C 80 23.972 23.087 0.885 1
1 937 . 11 1 1 A 80 80 ALA N N 80 128.220 125.507 2.713 1
1 938 . 11 1 1 A 81 81 ALA H H 81 9.890 8.637 1.253 1
1 939 . 11 1 1 A 81 81 ALA HA H 81 4.794 5.072 -0.278 1
1 943 . 11 1 1 A 81 81 ALA C C 81 174.655 176.178 -1.523 1
1 944 . 11 1 1 A 81 81 ALA CA C 81 50.300 51.004 -0.704 1
1 945 . 11 1 1 A 81 81 ALA CB C 81 21.369 20.638 0.731 1
1 946 . 11 1 1 A 81 81 ALA N N 81 123.682 123.526 0.156 1
1 947 . 11 1 1 A 82 82 LYS H H 82 7.965 8.992 -1.027 1
1 948 . 11 1 1 A 82 82 LYS HA H 82 4.974 4.973 0.001 1
1 957 . 11 1 1 A 82 82 LYS C C 82 175.671 175.476 0.195 1
1 958 . 11 1 1 A 82 82 LYS CA C 82 54.664 54.652 0.012 1
1 959 . 11 1 1 A 82 82 LYS CB C 82 36.677 34.646 2.031 1
1 963 . 11 1 1 A 82 82 LYS N N 82 118.164 122.749 -4.585 1
1 964 . 11 1 1 A 83 83 ASN H H 83 8.663 8.480 0.183 1
1 965 . 11 1 1 A 83 83 ASN HA H 83 5.113 5.096 0.017 1
1 970 . 11 1 1 A 83 83 ASN C C 83 176.582 175.958 0.624 1
1 971 . 11 1 1 A 83 83 ASN CA C 83 51.746 50.644 1.102 1
1 972 . 11 1 1 A 83 83 ASN CB C 83 40.357 40.133 0.224 1
1 973 . 11 1 1 A 83 83 ASN N N 83 124.784 124.275 0.509 1
1 975 . 11 1 1 A 84 84 ARG H H 84 8.873 8.849 0.024 1
1 976 . 11 1 1 A 84 84 ARG HA H 84 3.940 3.959 -0.019 1
1 983 . 11 1 1 A 84 84 ARG C C 84 176.735 177.322 -0.587 1
1 984 . 11 1 1 A 84 84 ARG CA C 84 59.327 58.618 0.709 1
1 985 . 11 1 1 A 84 84 ARG CB C 84 29.282 30.105 -0.823 1
1 988 . 11 1 1 A 84 84 ARG N N 84 117.891 119.681 -1.790 1
1 989 . 11 1 1 A 85 85 ALA H H 85 7.645 7.583 0.062 1
1 990 . 11 1 1 A 85 85 ALA HA H 85 4.276 4.299 -0.023 1
1 994 . 11 1 1 A 85 85 ALA C C 85 177.479 177.016 0.463 1
1 995 . 11 1 1 A 85 85 ALA CA C 85 52.818 52.584 0.234 1
1 996 . 11 1 1 A 85 85 ALA CB C 85 18.806 20.077 -1.271 1
1 997 . 11 1 1 A 85 85 ALA N N 85 120.306 119.178 1.128 1
1 998 . 11 1 1 A 86 86 GLY H H 86 7.693 7.516 0.177 1
1 999 . 11 1 1 A 86 86 GLY HA2 H 86 4.456 4.084 0.372 1
1 1000 . 11 1 1 A 86 86 GLY HA3 H 86 3.649 4.087 -0.438 1
1 1001 . 11 1 1 A 86 86 GLY C C 86 172.068 172.579 -0.511 1
1 1002 . 11 1 1 A 86 86 GLY CA C 86 44.375 43.935 0.440 1
1 1003 . 11 1 1 A 86 86 GLY N N 86 106.594 103.693 2.901 1
1 1004 . 11 1 1 A 87 87 LEU H H 87 8.203 8.535 -0.332 1
1 1005 . 11 1 1 A 87 87 LEU HA H 87 4.629 4.747 -0.118 1
1 1015 . 11 1 1 A 87 87 LEU C C 87 179.155 176.562 2.593 1
1 1016 . 11 1 1 A 87 87 LEU CA C 87 54.814 55.582 -0.768 1
1 1017 . 11 1 1 A 87 87 LEU CB C 87 43.454 42.461 0.993 1
1 1021 . 11 1 1 A 87 87 LEU N N 87 120.879 122.309 -1.430 1
1 1022 . 11 1 1 A 88 88 GLY H H 88 8.492 8.071 0.421 1
1 1023 . 11 1 1 A 88 88 GLY HA2 H 88 4.339 4.144 0.195 1
1 1024 . 11 1 1 A 88 88 GLY HA3 H 88 4.122 4.151 -0.029 1
1 1025 . 11 1 1 A 88 88 GLY C C 88 173.030 173.296 -0.266 1
1 1026 . 11 1 1 A 88 88 GLY CA C 88 43.970 44.554 -0.584 1
1 1027 . 11 1 1 A 88 88 GLY N N 88 109.903 110.676 -0.773 1
1 1028 . 11 1 1 A 89 89 GLU H H 89 7.638 8.968 -1.330 1
1 1029 . 11 1 1 A 89 89 GLU HA H 89 4.103 4.273 -0.170 1
1 1034 . 11 1 1 A 89 89 GLU C C 89 177.511 175.792 1.719 1
1 1035 . 11 1 1 A 89 89 GLU CA C 89 56.659 56.849 -0.190 1
1 1036 . 11 1 1 A 89 89 GLU CB C 89 31.324 30.652 0.672 1
1 1038 . 11 1 1 A 89 89 GLU N N 89 117.551 122.585 -5.034 1
1 1039 . 11 1 1 A 90 90 GLU H H 90 8.734 8.702 0.032 1
1 1040 . 11 1 1 A 90 90 GLU HA H 90 4.651 5.334 -0.683 1
1 1045 . 11 1 1 A 90 90 GLU C C 90 177.452 175.251 2.201 1
1 1046 . 11 1 1 A 90 90 GLU CA C 90 55.987 54.959 1.028 1
1 1047 . 11 1 1 A 90 90 GLU CB C 90 31.135 33.008 -1.873 1
1 1049 . 11 1 1 A 90 90 GLU N N 90 121.553 119.993 1.560 1
1 1050 . 11 1 1 A 91 91 PHE H H 91 9.411 9.407 0.004 1
1 1051 . 11 1 1 A 91 91 PHE HA H 91 4.665 4.849 -0.184 1
1 1059 . 11 1 1 A 91 91 PHE C C 91 173.944 174.758 -0.814 1
1 1060 . 11 1 1 A 91 91 PHE CA C 91 57.687 58.657 -0.970 1
1 1061 . 11 1 1 A 91 91 PHE CB C 91 40.890 40.337 0.553 1
1 1067 . 11 1 1 A 91 91 PHE N N 91 125.459 125.504 -0.045 1
1 1068 . 11 1 1 A 92 92 GLU H H 92 8.043 8.012 0.031 1
1 1069 . 11 1 1 A 92 92 GLU HA H 92 5.424 5.161 0.263 1
1 1074 . 11 1 1 A 92 92 GLU C C 92 174.295 174.482 -0.187 1
1 1075 . 11 1 1 A 92 92 GLU CA C 92 54.378 54.639 -0.261 1
1 1076 . 11 1 1 A 92 92 GLU CB C 92 33.662 33.145 0.517 1
1 1078 . 11 1 1 A 92 92 GLU N N 92 128.905 126.747 2.158 1
1 1079 . 11 1 1 A 93 93 LYS H H 93 9.142 8.394 0.748 1
1 1080 . 11 1 1 A 93 93 LYS HA H 93 4.541 4.999 -0.458 1
1 1089 . 11 1 1 A 93 93 LYS C C 93 173.366 173.872 -0.506 1
1 1090 . 11 1 1 A 93 93 LYS CA C 93 55.343 55.484 -0.141 1
1 1091 . 11 1 1 A 93 93 LYS CB C 93 37.317 36.087 1.230 1
1 1095 . 11 1 1 A 93 93 LYS N N 93 125.231 126.754 -1.523 1
1 1096 . 11 1 1 A 94 94 GLU H H 94 8.655 9.174 -0.519 1
1 1097 . 11 1 1 A 94 94 GLU HA H 94 5.558 5.366 0.192 1
1 1102 . 11 1 1 A 94 94 GLU C C 94 176.238 175.572 0.666 1
1 1103 . 11 1 1 A 94 94 GLU CA C 94 54.632 55.051 -0.419 1
1 1104 . 11 1 1 A 94 94 GLU CB C 94 32.166 32.967 -0.801 1
1 1106 . 11 1 1 A 94 94 GLU N N 94 127.232 127.711 -0.479 1
1 1107 . 11 1 1 A 95 95 ILE H H 95 9.302 8.702 0.600 1
1 1108 . 11 1 1 A 95 95 ILE HA H 95 4.794 5.169 -0.375 1
1 1118 . 11 1 1 A 95 95 ILE C C 95 173.138 174.322 -1.184 1
1 1119 . 11 1 1 A 95 95 ILE CA C 95 58.570 58.303 0.267 1
1 1120 . 11 1 1 A 95 95 ILE CB C 95 42.420 42.869 -0.449 1
1 1124 . 11 1 1 A 95 95 ILE N N 95 120.711 120.658 0.053 1
1 1125 . 11 1 1 A 96 96 ARG H H 96 8.589 8.730 -0.141 1
1 1126 . 11 1 1 A 96 96 ARG HA H 96 5.373 4.750 0.623 1
1 1133 . 11 1 1 A 96 96 ARG C C 96 177.147 175.047 2.100 1
1 1134 . 11 1 1 A 96 96 ARG CA C 96 54.045 55.339 -1.294 1
1 1135 . 11 1 1 A 96 96 ARG CB C 96 32.001 33.661 -1.660 1
1 1138 . 11 1 1 A 96 96 ARG N N 96 124.445 121.926 2.519 1
1 1139 . 11 1 1 A 97 97 THR H H 97 9.243 8.449 0.794 1
1 1140 . 11 1 1 A 97 97 THR HA H 97 4.459 4.635 -0.176 1
1 1145 . 11 1 1 A 97 97 THR C C 97 172.745 173.856 -1.111 1
1 1146 . 11 1 1 A 97 97 THR CA C 97 59.637 60.561 -0.924 1
1 1147 . 11 1 1 A 97 97 THR CB C 97 67.687 68.908 -1.221 1
1 1149 . 11 1 1 A 97 97 THR N N 97 119.370 118.844 0.526 1
1 1150 . 11 1 1 A 98 98 PRO HA H 98 4.494 4.570 -0.076 1
1 1157 . 11 1 1 A 98 98 PRO CA C 98 63.117 62.722 0.395 1
1 1158 . 11 1 1 A 98 98 PRO CB C 98 32.500 32.495 0.005 1
1 1161 . 11 1 1 A 99 99 GLU H H 99 8.534 8.516 0.018 1
1 1162 . 11 1 1 A 99 99 GLU HA H 99 4.195 4.592 -0.397 1
1 1167 . 11 1 1 A 99 99 GLU C C 99 175.881 176.146 -0.265 1
1 1168 . 11 1 1 A 99 99 GLU CA C 99 56.330 56.323 0.007 1
1 1169 . 11 1 1 A 99 99 GLU CB C 99 31.062 30.643 0.419 1
1 1171 . 11 1 1 A 99 99 GLU N N 99 119.688 121.973 -2.285 1
1 1172 . 11 1 1 A 100 100 ASP H H 100 8.536 8.584 -0.048 1
1 1173 . 11 1 1 A 100 100 ASP HA H 100 4.607 4.766 -0.159 1
1 1176 . 11 1 1 A 100 100 ASP C C 100 176.012 175.569 0.443 1
1 1177 . 11 1 1 A 100 100 ASP CA C 100 54.109 53.643 0.466 1
1 1178 . 11 1 1 A 100 100 ASP CB C 100 41.562 41.778 -0.216 1
1 1179 . 11 1 1 A 100 100 ASP N N 100 119.803 122.030 -2.227 1
1 1180 . 11 1 1 A 101 101 LEU H H 101 8.403 8.451 -0.048 1
1 1181 . 11 1 1 A 101 101 LEU HA H 101 4.426 4.815 -0.389 1
1 1191 . 11 1 1 A 101 101 LEU C C 101 177.534 175.699 1.835 1
1 1192 . 11 1 1 A 101 101 LEU CA C 101 55.113 53.976 1.137 1
1 1193 . 11 1 1 A 101 101 LEU CB C 101 42.156 43.647 -1.491 1
1 1197 . 11 1 1 A 101 101 LEU N N 101 123.876 125.940 -2.064 1
1 1198 . 11 1 1 A 102 102 SER H H 102 8.413 8.638 -0.225 1
1 1199 . 11 1 1 A 102 102 SER HA H 102 4.434 5.253 -0.819 1
1 1202 . 11 1 1 A 102 102 SER C C 102 174.674 174.469 0.205 1
1 1203 . 11 1 1 A 102 102 SER CA C 102 58.798 56.771 2.027 1
1 1204 . 11 1 1 A 102 102 SER CB C 102 63.854 65.310 -1.456 1
1 1205 . 11 1 1 A 102 102 SER N N 102 116.667 120.673 -4.006 1
1 1206 . 11 1 1 A 103 103 GLY H H 103 8.213 8.288 -0.075 1
1 1207 . 11 1 1 A 103 103 GLY HA2 H 103 4.164 4.193 -0.029 1
1 1208 . 11 1 1 A 103 103 GLY HA3 H 103 4.057 4.193 -0.136 1
1 1209 . 11 1 1 A 103 103 GLY C C 103 171.822 174.302 -2.480 1
1 1210 . 11 1 1 A 103 103 GLY CA C 103 44.658 45.425 -0.767 1
1 1211 . 11 1 1 A 103 103 GLY N N 103 110.592 109.015 1.577 1
1 1212 . 11 1 1 A 104 104 PRO HA H 104 4.475 4.468 0.007 1
1 1219 . 11 1 1 A 104 104 PRO C C 104 177.445 175.877 1.568 1
1 1220 . 11 1 1 A 104 104 PRO CA C 104 63.312 64.116 -0.804 1
1 1221 . 11 1 1 A 104 104 PRO CB C 104 32.190 31.860 0.330 1
1 1224 . 11 1 1 A 105 105 SER H H 105 8.538 7.543 0.995 1
1 1225 . 11 1 1 A 105 105 SER HA H 105 4.541 4.795 -0.254 1
1 1228 . 11 1 1 A 105 105 SER C C 105 174.616 172.985 1.631 1
1 1229 . 11 1 1 A 105 105 SER CA C 105 58.270 56.690 1.580 1
1 1230 . 11 1 1 A 105 105 SER CB C 105 63.895 65.624 -1.729 1
1 1231 . 11 1 1 A 105 105 SER N N 105 116.446 112.831 3.615 1
1 1232 . 11 1 1 A 106 106 SER H H 106 8.350 8.839 -0.489 1
1 1233 . 11 1 1 A 106 106 SER HA H 106 4.541 4.791 -0.250 1
1 1236 . 11 1 1 A 106 106 SER C C 106 174.530 174.437 0.093 1
1 1237 . 11 1 1 A 106 106 SER CA C 106 58.357 58.604 -0.247 1
1 1238 . 11 1 1 A 106 106 SER CB C 106 64.020 63.888 0.132 1
1 1239 . 11 1 1 A 106 106 SER N N 106 117.448 121.244 -3.796 1
1 1 . 12 1 1 A 2 2 SER C C 2 174.723 173.188 1.535 1
1 2 . 12 1 1 A 2 2 SER CA C 2 58.446 59.157 -0.711 1
1 3 . 12 1 1 A 2 2 SER CB C 2 63.566 61.683 1.883 1
1 4 . 12 1 1 A 3 3 SER H H 3 8.350 7.939 0.411 1
1 5 . 12 1 1 A 3 3 SER C C 3 173.961 174.387 -0.426 1
1 6 . 12 1 1 A 3 3 SER CA C 3 58.428 56.870 1.558 1
1 7 . 12 1 1 A 3 3 SER CB C 3 63.937 65.609 -1.672 1
1 8 . 12 1 1 A 3 3 SER N N 3 117.923 114.844 3.079 1
1 9 . 12 1 1 A 4 4 GLY H H 4 8.050 8.567 -0.517 1
1 10 . 12 1 1 A 4 4 GLY C C 4 179.009 171.993 7.016 1
1 11 . 12 1 1 A 4 4 GLY CA C 4 46.174 44.112 2.062 1
1 12 . 12 1 1 A 4 4 GLY N N 4 116.890 108.771 8.119 1
1 13 . 12 1 1 A 7 7 GLY HA2 H 7 4.340 4.303 0.037 1
1 14 . 12 1 1 A 7 7 GLY HA3 H 7 3.629 4.303 -0.674 1
1 15 . 12 1 1 A 7 7 GLY CA C 7 44.381 45.055 -0.674 1
1 16 . 12 1 1 A 8 8 PRO HA H 8 4.476 4.488 -0.012 1
1 23 . 12 1 1 A 8 8 PRO C C 8 176.235 177.115 -0.880 1
1 24 . 12 1 1 A 8 8 PRO CA C 8 62.995 62.536 0.459 1
1 25 . 12 1 1 A 8 8 PRO CB C 8 33.266 32.255 1.011 1
1 28 . 12 1 1 A 9 9 GLY H H 9 8.585 8.403 0.182 1
1 29 . 12 1 1 A 9 9 GLY HA2 H 9 4.326 4.098 0.228 1
1 30 . 12 1 1 A 9 9 GLY HA3 H 9 4.009 4.104 -0.095 1
1 31 . 12 1 1 A 9 9 GLY C C 9 172.998 172.978 0.020 1
1 32 . 12 1 1 A 9 9 GLY CA C 9 44.393 44.310 0.083 1
1 33 . 12 1 1 A 9 9 GLY N N 9 106.004 107.576 -1.572 1
1 34 . 12 1 1 A 10 10 ARG H H 10 8.548 8.562 -0.014 1
1 35 . 12 1 1 A 10 10 ARG HA H 10 4.654 5.103 -0.449 1
1 41 . 12 1 1 A 10 10 ARG C C 10 175.780 174.528 1.252 1
1 42 . 12 1 1 A 10 10 ARG CA C 10 54.708 54.149 0.559 1
1 43 . 12 1 1 A 10 10 ARG CB C 10 31.448 31.987 -0.539 1
1 45 . 12 1 1 A 10 10 ARG N N 10 119.407 118.681 0.726 1
1 46 . 12 1 1 A 11 11 PRO HA H 11 4.611 4.392 0.219 1
1 53 . 12 1 1 A 11 11 PRO C C 11 173.510 175.442 -1.932 1
1 54 . 12 1 1 A 11 11 PRO CA C 11 62.360 62.484 -0.124 1
1 55 . 12 1 1 A 11 11 PRO CB C 11 33.402 32.150 1.252 1
1 58 . 12 1 1 A 12 12 THR H H 12 7.572 7.831 -0.259 1
1 59 . 12 1 1 A 12 12 THR HA H 12 3.796 4.122 -0.326 1
1 64 . 12 1 1 A 12 12 THR C C 12 172.337 173.143 -0.806 1
1 65 . 12 1 1 A 12 12 THR CA C 12 61.778 61.456 0.322 1
1 66 . 12 1 1 A 12 12 THR CB C 12 70.561 68.398 2.163 1
1 68 . 12 1 1 A 12 12 THR N N 12 109.653 117.112 -7.459 1
1 69 . 12 1 1 A 13 13 MET H H 13 5.605 8.404 -2.799 1
1 70 . 12 1 1 A 13 13 MET HA H 13 5.091 4.903 0.188 1
1 78 . 12 1 1 A 13 13 MET C C 13 172.639 174.966 -2.327 1
1 79 . 12 1 1 A 13 13 MET CA C 13 54.168 53.925 0.243 1
1 80 . 12 1 1 A 13 13 MET CB C 13 37.632 34.459 3.173 1
1 83 . 12 1 1 A 13 13 MET N N 13 121.634 126.864 -5.230 1
1 84 . 12 1 1 A 14 14 MET H H 14 9.254 8.966 0.288 1
1 85 . 12 1 1 A 14 14 MET HA H 14 4.662 5.188 -0.526 1
1 93 . 12 1 1 A 14 14 MET C C 14 174.388 174.781 -0.393 1
1 94 . 12 1 1 A 14 14 MET CA C 14 54.673 54.066 0.607 1
1 95 . 12 1 1 A 14 14 MET CB C 14 34.907 34.919 -0.012 1
1 98 . 12 1 1 A 14 14 MET N N 14 125.746 124.351 1.395 1
1 99 . 12 1 1 A 15 15 ILE H H 15 8.555 9.245 -0.690 1
1 100 . 12 1 1 A 15 15 ILE HA H 15 4.882 5.127 -0.245 1
1 110 . 12 1 1 A 15 15 ILE C C 15 174.962 174.901 0.061 1
1 111 . 12 1 1 A 15 15 ILE CA C 15 60.685 60.443 0.242 1
1 112 . 12 1 1 A 15 15 ILE CB C 15 40.878 39.029 1.849 1
1 116 . 12 1 1 A 15 15 ILE N N 15 121.623 125.887 -4.264 1
1 117 . 12 1 1 A 16 16 SER H H 16 8.703 8.754 -0.051 1
1 118 . 12 1 1 A 16 16 SER HA H 16 4.922 5.048 -0.126 1
1 121 . 12 1 1 A 16 16 SER C C 16 173.860 173.234 0.626 1
1 122 . 12 1 1 A 16 16 SER CA C 16 56.524 57.509 -0.985 1
1 123 . 12 1 1 A 16 16 SER CB C 16 65.004 65.700 -0.696 1
1 124 . 12 1 1 A 16 16 SER N N 16 122.261 124.923 -2.662 1
1 125 . 12 1 1 A 17 17 THR H H 17 8.759 8.651 0.108 1
1 126 . 12 1 1 A 17 17 THR HA H 17 4.885 4.851 0.034 1
1 131 . 12 1 1 A 17 17 THR C C 17 175.018 174.550 0.468 1
1 132 . 12 1 1 A 17 17 THR CA C 17 60.315 61.252 -0.937 1
1 133 . 12 1 1 A 17 17 THR CB C 17 69.799 70.011 -0.212 1
1 135 . 12 1 1 A 17 17 THR N N 17 115.660 117.449 -1.789 1
1 136 . 12 1 1 A 18 18 THR H H 18 8.038 8.368 -0.330 1
1 137 . 12 1 1 A 18 18 THR HA H 18 4.596 4.453 0.143 1
1 142 . 12 1 1 A 18 18 THR CA C 18 60.707 62.260 -1.553 1
1 143 . 12 1 1 A 18 18 THR CB C 18 71.082 69.784 1.298 1
1 145 . 12 1 1 A 18 18 THR N N 18 112.362 115.101 -2.739 1
1 146 . 12 1 1 A 19 19 ALA H H 19 8.545 7.611 0.934 1
1 147 . 12 1 1 A 19 19 ALA HA H 19 4.412 4.461 -0.049 1
1 151 . 12 1 1 A 19 19 ALA C C 19 177.034 176.960 0.074 1
1 152 . 12 1 1 A 19 19 ALA CA C 19 52.264 51.590 0.674 1
1 153 . 12 1 1 A 19 19 ALA CB C 19 19.292 20.811 -1.519 1
1 154 . 12 1 1 A 19 19 ALA N N 19 119.589 123.666 -4.077 1
1 155 . 12 1 1 A 20 20 MET H H 20 8.145 8.516 -0.371 1
1 156 . 12 1 1 A 20 20 MET HA H 20 4.447 4.354 0.093 1
1 164 . 12 1 1 A 20 20 MET C C 20 175.676 176.003 -0.327 1
1 165 . 12 1 1 A 20 20 MET CA C 20 55.764 56.061 -0.297 1
1 166 . 12 1 1 A 20 20 MET CB C 20 31.495 32.577 -1.082 1
1 169 . 12 1 1 A 20 20 MET N N 20 116.950 117.413 -0.463 1
1 170 . 12 1 1 A 21 21 ASN H H 21 8.275 8.919 -0.644 1
1 171 . 12 1 1 A 21 21 ASN HA H 21 4.452 4.276 0.176 1
1 176 . 12 1 1 A 21 21 ASN C C 21 174.100 173.751 0.349 1
1 177 . 12 1 1 A 21 21 ASN CA C 21 54.320 54.333 -0.013 1
1 178 . 12 1 1 A 21 21 ASN CB C 21 37.234 37.410 -0.176 1
1 179 . 12 1 1 A 21 21 ASN N N 21 113.198 116.939 -3.741 1
1 181 . 12 1 1 A 22 22 THR H H 22 7.071 7.000 0.071 1
1 182 . 12 1 1 A 22 22 THR HA H 22 5.218 5.395 -0.177 1
1 187 . 12 1 1 A 22 22 THR C C 22 173.301 172.875 0.426 1
1 188 . 12 1 1 A 22 22 THR CA C 22 59.399 60.461 -1.062 1
1 189 . 12 1 1 A 22 22 THR CB C 22 72.714 71.535 1.179 1
1 191 . 12 1 1 A 22 22 THR N N 22 107.603 107.714 -0.111 1
1 192 . 12 1 1 A 23 23 ALA H H 23 8.687 8.868 -0.181 1
1 193 . 12 1 1 A 23 23 ALA HA H 23 4.925 5.183 -0.258 1
1 197 . 12 1 1 A 23 23 ALA C C 23 174.100 175.330 -1.230 1
1 198 . 12 1 1 A 23 23 ALA CA C 23 50.812 49.920 0.892 1
1 199 . 12 1 1 A 23 23 ALA CB C 23 21.122 21.178 -0.056 1
1 200 . 12 1 1 A 23 23 ALA N N 23 121.937 127.511 -5.574 1
1 201 . 12 1 1 A 24 24 LEU H H 24 8.833 8.844 -0.011 1
1 202 . 12 1 1 A 24 24 LEU HA H 24 4.673 4.719 -0.046 1
1 212 . 12 1 1 A 24 24 LEU C C 24 175.140 174.575 0.565 1
1 213 . 12 1 1 A 24 24 LEU CA C 24 54.320 54.021 0.299 1
1 214 . 12 1 1 A 24 24 LEU CB C 24 42.518 44.188 -1.670 1
1 218 . 12 1 1 A 24 24 LEU N N 24 123.721 125.567 -1.846 1
1 219 . 12 1 1 A 25 25 LEU H H 25 9.176 8.771 0.405 1
1 220 . 12 1 1 A 25 25 LEU HA H 25 5.112 5.133 -0.021 1
1 230 . 12 1 1 A 25 25 LEU C C 25 176.414 176.002 0.412 1
1 231 . 12 1 1 A 25 25 LEU CA C 25 54.108 53.056 1.052 1
1 232 . 12 1 1 A 25 25 LEU CB C 25 43.230 43.043 0.187 1
1 236 . 12 1 1 A 25 25 LEU N N 25 128.589 128.456 0.133 1
1 237 . 12 1 1 A 26 26 GLN H H 26 8.556 8.454 0.102 1
1 238 . 12 1 1 A 26 26 GLN HA H 26 4.737 4.916 -0.179 1
1 245 . 12 1 1 A 26 26 GLN C C 26 174.372 174.216 0.156 1
1 246 . 12 1 1 A 26 26 GLN CA C 26 56.365 54.461 1.904 1
1 247 . 12 1 1 A 26 26 GLN CB C 26 33.320 31.760 1.560 1
1 249 . 12 1 1 A 26 26 GLN N N 26 119.630 123.089 -3.459 1
1 251 . 12 1 1 A 27 27 TRP H H 27 8.080 8.137 -0.057 1
1 252 . 12 1 1 A 27 27 TRP HA H 27 5.441 6.115 -0.674 1
1 261 . 12 1 1 A 27 27 TRP CA C 27 55.957 54.697 1.260 1
1 262 . 12 1 1 A 27 27 TRP CB C 27 32.517 32.630 -0.113 1
1 268 . 12 1 1 A 27 27 TRP N N 27 121.276 122.026 -0.750 1
1 270 . 12 1 1 A 28 28 HIS H H 28 8.262 8.559 -0.297 1
1 271 . 12 1 1 A 28 28 HIS HA H 28 4.997 5.634 -0.637 1
1 275 . 12 1 1 A 28 28 HIS CA C 28 53.028 53.380 -0.352 1
1 276 . 12 1 1 A 28 28 HIS CB C 28 32.832 32.738 0.094 1
1 278 . 12 1 1 A 28 28 HIS N N 28 116.245 116.567 -0.322 1
1 279 . 12 1 1 A 29 29 PRO HA H 29 4.984 4.675 0.309 1
1 286 . 12 1 1 A 29 29 PRO CA C 29 61.498 62.370 -0.872 1
1 287 . 12 1 1 A 29 29 PRO CB C 29 30.709 32.510 -1.801 1
1 290 . 12 1 1 A 30 30 PRO HA H 30 4.449 4.837 -0.388 1
1 297 . 12 1 1 A 30 30 PRO C C 30 175.733 176.598 -0.865 1
1 298 . 12 1 1 A 30 30 PRO CA C 30 62.245 62.783 -0.538 1
1 299 . 12 1 1 A 30 30 PRO CB C 30 32.083 33.137 -1.054 1
1 302 . 12 1 1 A 31 31 LYS H H 31 8.403 8.792 -0.389 1
1 303 . 12 1 1 A 31 31 LYS HA H 31 4.084 4.454 -0.370 1
1 312 . 12 1 1 A 31 31 LYS C C 31 177.166 178.437 -1.271 1
1 313 . 12 1 1 A 31 31 LYS CA C 31 57.866 57.758 0.108 1
1 314 . 12 1 1 A 31 31 LYS CB C 31 32.698 33.231 -0.533 1
1 318 . 12 1 1 A 31 31 LYS N N 31 121.693 121.639 0.054 1
1 319 . 12 1 1 A 32 32 GLU H H 32 8.102 7.814 0.288 1
1 320 . 12 1 1 A 32 32 GLU HA H 32 4.365 4.460 -0.095 1
1 325 . 12 1 1 A 32 32 GLU C C 32 174.248 176.118 -1.870 1
1 326 . 12 1 1 A 32 32 GLU CA C 32 55.448 55.953 -0.505 1
1 327 . 12 1 1 A 32 32 GLU CB C 32 29.405 30.159 -0.754 1
1 329 . 12 1 1 A 32 32 GLU N N 32 118.742 117.029 1.713 1
1 330 . 12 1 1 A 33 33 LEU H H 33 8.420 7.517 0.903 1
1 331 . 12 1 1 A 33 33 LEU HA H 33 4.499 4.677 -0.178 1
1 341 . 12 1 1 A 33 33 LEU C C 33 173.036 175.034 -1.998 1
1 342 . 12 1 1 A 33 33 LEU CA C 33 52.863 52.239 0.624 1
1 343 . 12 1 1 A 33 33 LEU CB C 33 42.535 43.157 -0.622 1
1 347 . 12 1 1 A 33 33 LEU N N 33 125.181 123.953 1.228 1
1 348 . 12 1 1 A 34 34 PRO HA H 34 4.488 4.444 0.044 1
1 355 . 12 1 1 A 34 34 PRO C C 34 177.544 177.015 0.529 1
1 356 . 12 1 1 A 34 34 PRO CA C 34 62.889 63.340 -0.451 1
1 357 . 12 1 1 A 34 34 PRO CB C 34 31.472 30.906 0.566 1
1 360 . 12 1 1 A 35 35 GLY H H 35 8.397 8.509 -0.112 1
1 361 . 12 1 1 A 35 35 GLY HA2 H 35 4.059 4.117 -0.058 1
1 362 . 12 1 1 A 35 35 GLY HA3 H 35 3.716 4.118 -0.402 1
1 363 . 12 1 1 A 35 35 GLY C C 35 173.356 172.187 1.169 1
1 364 . 12 1 1 A 35 35 GLY CA C 35 45.892 45.088 0.804 1
1 365 . 12 1 1 A 35 35 GLY N N 35 110.524 112.271 -1.747 1
1 366 . 12 1 1 A 36 36 GLU H H 36 8.091 8.528 -0.437 1
1 367 . 12 1 1 A 36 36 GLU HA H 36 4.371 5.022 -0.651 1
1 372 . 12 1 1 A 36 36 GLU C C 36 174.864 174.637 0.227 1
1 373 . 12 1 1 A 36 36 GLU CA C 36 55.201 54.885 0.316 1
1 374 . 12 1 1 A 36 36 GLU CB C 36 31.878 33.143 -1.265 1
1 376 . 12 1 1 A 36 36 GLU N N 36 122.202 120.445 1.757 1
1 377 . 12 1 1 A 37 37 LEU H H 37 8.307 8.720 -0.413 1
1 378 . 12 1 1 A 37 37 LEU HA H 37 4.288 4.298 -0.010 1
1 388 . 12 1 1 A 37 37 LEU C C 37 176.702 176.055 0.647 1
1 389 . 12 1 1 A 37 37 LEU CA C 37 55.342 56.601 -1.259 1
1 390 . 12 1 1 A 37 37 LEU CB C 37 42.715 42.195 0.520 1
1 394 . 12 1 1 A 37 37 LEU N N 37 123.204 125.466 -2.262 1
1 395 . 12 1 1 A 38 38 LEU H H 38 8.909 8.671 0.238 1
1 396 . 12 1 1 A 38 38 LEU HA H 38 4.640 4.610 0.030 1
1 406 . 12 1 1 A 38 38 LEU C C 38 177.202 176.717 0.485 1
1 407 . 12 1 1 A 38 38 LEU CA C 38 54.390 54.955 -0.565 1
1 408 . 12 1 1 A 38 38 LEU CB C 38 43.770 43.694 0.076 1
1 412 . 12 1 1 A 38 38 LEU N N 38 123.021 126.813 -3.792 1
1 413 . 12 1 1 A 39 39 GLY H H 39 7.113 6.990 0.123 1
1 414 . 12 1 1 A 39 39 GLY HA2 H 39 4.816 3.561 1.255 1
1 415 . 12 1 1 A 39 39 GLY HA3 H 39 3.276 3.909 -0.633 1
1 416 . 12 1 1 A 39 39 GLY C C 39 169.863 170.364 -0.501 1
1 417 . 12 1 1 A 39 39 GLY CA C 39 44.622 45.512 -0.890 1
1 418 . 12 1 1 A 39 39 GLY N N 39 104.137 103.993 0.144 1
1 419 . 12 1 1 A 40 40 TYR H H 40 8.318 8.906 -0.588 1
1 420 . 12 1 1 A 40 40 TYR HA H 40 5.414 5.089 0.325 1
1 425 . 12 1 1 A 40 40 TYR C C 40 174.448 172.175 2.273 1
1 426 . 12 1 1 A 40 40 TYR CA C 40 56.178 56.557 -0.379 1
1 427 . 12 1 1 A 40 40 TYR CB C 40 44.191 40.636 3.555 1
1 430 . 12 1 1 A 40 40 TYR N N 40 114.036 115.412 -1.376 1
1 431 . 12 1 1 A 41 41 ARG H H 41 9.347 8.862 0.485 1
1 432 . 12 1 1 A 41 41 ARG HA H 41 5.092 5.470 -0.378 1
1 440 . 12 1 1 A 41 41 ARG C C 41 174.097 174.136 -0.039 1
1 441 . 12 1 1 A 41 41 ARG CA C 41 56.100 54.378 1.722 1
1 442 . 12 1 1 A 41 41 ARG CB C 41 34.508 32.739 1.769 1
1 445 . 12 1 1 A 41 41 ARG N N 41 122.231 121.203 1.028 1
1 447 . 12 1 1 A 42 42 LEU H H 42 9.546 9.032 0.514 1
1 448 . 12 1 1 A 42 42 LEU HA H 42 5.459 5.283 0.176 1
1 458 . 12 1 1 A 42 42 LEU C C 42 174.913 174.633 0.280 1
1 459 . 12 1 1 A 42 42 LEU CA C 42 52.997 53.355 -0.358 1
1 460 . 12 1 1 A 42 42 LEU CB C 42 46.413 45.775 0.638 1
1 464 . 12 1 1 A 42 42 LEU N N 42 132.335 127.340 4.995 1
1 465 . 12 1 1 A 43 43 GLN H H 43 9.502 9.295 0.207 1
1 466 . 12 1 1 A 43 43 GLN HA H 43 5.847 5.151 0.696 1
1 473 . 12 1 1 A 43 43 GLN C C 43 175.329 174.037 1.292 1
1 474 . 12 1 1 A 43 43 GLN CA C 43 54.005 54.489 -0.484 1
1 475 . 12 1 1 A 43 43 GLN CB C 43 33.429 31.976 1.453 1
1 477 . 12 1 1 A 43 43 GLN N N 43 123.932 125.370 -1.438 1
1 479 . 12 1 1 A 44 44 TYR H H 44 8.615 8.438 0.177 1
1 480 . 12 1 1 A 44 44 TYR HA H 44 5.783 5.552 0.231 1
1 487 . 12 1 1 A 44 44 TYR C C 44 174.058 173.403 0.655 1
1 488 . 12 1 1 A 44 44 TYR CA C 44 55.942 56.277 -0.335 1
1 489 . 12 1 1 A 44 44 TYR CB C 44 43.052 41.330 1.722 1
1 494 . 12 1 1 A 44 44 TYR N N 44 117.355 119.503 -2.148 1
1 495 . 12 1 1 A 45 45 CYS H H 45 8.377 8.262 0.115 1
1 496 . 12 1 1 A 45 45 CYS HA H 45 4.772 5.030 -0.258 1
1 499 . 12 1 1 A 45 45 CYS C C 45 173.205 173.761 -0.556 1
1 500 . 12 1 1 A 45 45 CYS CA C 45 55.960 57.819 -1.859 1
1 501 . 12 1 1 A 45 45 CYS CB C 45 30.665 31.546 -0.881 1
1 502 . 12 1 1 A 45 45 CYS N N 45 115.140 118.589 -3.449 1
1 503 . 12 1 1 A 46 46 ARG H H 46 9.165 8.463 0.702 1
1 504 . 12 1 1 A 46 46 ARG HA H 46 4.068 3.839 0.229 1
1 511 . 12 1 1 A 46 46 ARG C C 46 178.440 177.443 0.997 1
1 512 . 12 1 1 A 46 46 ARG CA C 46 56.401 55.530 0.871 1
1 513 . 12 1 1 A 46 46 ARG CB C 46 31.878 30.772 1.106 1
1 516 . 12 1 1 A 46 46 ARG N N 46 121.803 122.495 -0.692 1
1 517 . 12 1 1 A 47 47 ALA H H 47 8.273 8.090 0.183 1
1 518 . 12 1 1 A 47 47 ALA HA H 47 3.891 4.229 -0.338 1
1 522 . 12 1 1 A 47 47 ALA C C 47 177.599 177.414 0.185 1
1 523 . 12 1 1 A 47 47 ALA CA C 47 54.796 53.233 1.563 1
1 524 . 12 1 1 A 47 47 ALA CB C 47 18.287 18.593 -0.306 1
1 525 . 12 1 1 A 47 47 ALA N N 47 123.895 123.745 0.150 1
1 526 . 12 1 1 A 48 48 ASP H H 48 8.036 7.900 0.136 1
1 527 . 12 1 1 A 48 48 ASP HA H 48 4.453 4.748 -0.295 1
1 530 . 12 1 1 A 48 48 ASP C C 48 175.836 175.870 -0.034 1
1 531 . 12 1 1 A 48 48 ASP CA C 48 53.368 53.817 -0.449 1
1 532 . 12 1 1 A 48 48 ASP CB C 48 39.964 42.365 -2.401 1
1 533 . 12 1 1 A 48 48 ASP N N 48 112.576 117.366 -4.790 1
1 534 . 12 1 1 A 49 49 GLU H H 49 7.495 7.752 -0.257 1
1 535 . 12 1 1 A 49 49 GLU HA H 49 4.308 4.540 -0.232 1
1 540 . 12 1 1 A 49 49 GLU C C 49 175.756 175.781 -0.025 1
1 541 . 12 1 1 A 49 49 GLU CA C 49 56.224 55.190 1.034 1
1 542 . 12 1 1 A 49 49 GLU CB C 49 32.248 30.984 1.264 1
1 544 . 12 1 1 A 49 49 GLU N N 49 120.609 118.163 2.446 1
1 545 . 12 1 1 A 50 50 ALA H H 50 8.416 8.405 0.011 1
1 546 . 12 1 1 A 50 50 ALA HA H 50 4.200 4.448 -0.248 1
1 550 . 12 1 1 A 50 50 ALA C C 50 177.433 176.793 0.640 1
1 551 . 12 1 1 A 50 50 ALA CA C 50 53.297 51.897 1.400 1
1 552 . 12 1 1 A 50 50 ALA CB C 50 19.474 20.564 -1.090 1
1 553 . 12 1 1 A 50 50 ALA N N 50 124.065 123.632 0.433 1
1 554 . 12 1 1 A 51 51 ARG H H 51 7.648 7.709 -0.061 1
1 555 . 12 1 1 A 51 51 ARG HA H 51 4.747 4.563 0.184 1
1 562 . 12 1 1 A 51 51 ARG C C 51 173.400 173.899 -0.499 1
1 563 . 12 1 1 A 51 51 ARG CA C 51 52.592 52.606 -0.014 1
1 564 . 12 1 1 A 51 51 ARG CB C 51 31.212 30.474 0.738 1
1 567 . 12 1 1 A 51 51 ARG N N 51 117.798 118.907 -1.109 1
1 568 . 12 1 1 A 52 52 PRO HA H 52 4.212 4.458 -0.246 1
1 575 . 12 1 1 A 52 52 PRO C C 52 176.380 176.478 -0.098 1
1 576 . 12 1 1 A 52 52 PRO CA C 52 62.360 62.504 -0.144 1
1 577 . 12 1 1 A 52 52 PRO CB C 52 32.331 32.261 0.070 1
1 580 . 12 1 1 A 53 53 ASN H H 53 8.127 8.204 -0.077 1
1 581 . 12 1 1 A 53 53 ASN HA H 53 4.651 4.712 -0.061 1
1 586 . 12 1 1 A 53 53 ASN C C 53 174.354 174.544 -0.190 1
1 587 . 12 1 1 A 53 53 ASN CA C 53 53.136 52.404 0.732 1
1 588 . 12 1 1 A 53 53 ASN CB C 53 39.666 38.005 1.661 1
1 589 . 12 1 1 A 53 53 ASN N N 53 119.405 119.942 -0.537 1
1 591 . 12 1 1 A 54 54 THR H H 54 8.425 8.084 0.341 1
1 592 . 12 1 1 A 54 54 THR HA H 54 5.306 4.391 0.915 1
1 597 . 12 1 1 A 54 54 THR C C 54 173.850 174.307 -0.457 1
1 598 . 12 1 1 A 54 54 THR CA C 54 61.881 63.617 -1.736 1
1 599 . 12 1 1 A 54 54 THR CB C 54 70.573 69.093 1.480 1
1 601 . 12 1 1 A 54 54 THR N N 54 118.968 121.460 -2.492 1
1 602 . 12 1 1 A 55 55 ILE H H 55 9.354 8.675 0.679 1
1 603 . 12 1 1 A 55 55 ILE HA H 55 4.051 4.603 -0.552 1
1 613 . 12 1 1 A 55 55 ILE C C 55 172.975 173.507 -0.532 1
1 614 . 12 1 1 A 55 55 ILE CA C 55 61.003 59.649 1.354 1
1 615 . 12 1 1 A 55 55 ILE CB C 55 41.619 42.044 -0.425 1
1 619 . 12 1 1 A 55 55 ILE N N 55 127.961 126.348 1.613 1
1 620 . 12 1 1 A 56 56 ASP H H 56 8.132 8.683 -0.551 1
1 621 . 12 1 1 A 56 56 ASP HA H 56 5.334 5.300 0.034 1
1 624 . 12 1 1 A 56 56 ASP C C 56 174.969 174.696 0.273 1
1 625 . 12 1 1 A 56 56 ASP CA C 56 53.702 52.809 0.893 1
1 626 . 12 1 1 A 56 56 ASP CB C 56 43.251 42.996 0.255 1
1 627 . 12 1 1 A 56 56 ASP N N 56 125.882 126.880 -0.998 1
1 628 . 12 1 1 A 57 57 PHE H H 57 8.955 8.712 0.243 1
1 629 . 12 1 1 A 57 57 PHE HA H 57 4.915 5.007 -0.092 1
1 637 . 12 1 1 A 57 57 PHE C C 57 177.361 175.485 1.876 1
1 638 . 12 1 1 A 57 57 PHE CA C 57 57.458 56.612 0.846 1
1 639 . 12 1 1 A 57 57 PHE CB C 57 43.737 43.567 0.170 1
1 645 . 12 1 1 A 57 57 PHE N N 57 118.872 123.041 -4.169 1
1 646 . 12 1 1 A 58 58 GLY H H 58 9.552 9.214 0.338 1
1 647 . 12 1 1 A 58 58 GLY HA2 H 58 4.662 4.135 0.527 1
1 648 . 12 1 1 A 58 58 GLY HA3 H 58 4.126 4.204 -0.078 1
1 649 . 12 1 1 A 58 58 GLY C C 58 174.760 174.910 -0.150 1
1 650 . 12 1 1 A 58 58 GLY CA C 58 44.680 45.058 -0.378 1
1 651 . 12 1 1 A 58 58 GLY N N 58 111.551 109.632 1.919 1
1 652 . 12 1 1 A 59 59 LYS H H 59 8.211 8.199 0.012 1
1 653 . 12 1 1 A 59 59 LYS HA H 59 3.782 3.666 0.116 1
1 662 . 12 1 1 A 59 59 LYS C C 59 176.154 178.328 -2.174 1
1 663 . 12 1 1 A 59 59 LYS CA C 59 59.080 58.719 0.361 1
1 664 . 12 1 1 A 59 59 LYS CB C 59 32.516 31.761 0.755 1
1 668 . 12 1 1 A 59 59 LYS N N 59 115.953 120.524 -4.571 1
1 669 . 12 1 1 A 60 60 ASP H H 60 8.634 8.053 0.581 1
1 670 . 12 1 1 A 60 60 ASP HA H 60 4.882 4.419 0.463 1
1 673 . 12 1 1 A 60 60 ASP C C 60 176.039 176.029 0.010 1
1 674 . 12 1 1 A 60 60 ASP CA C 60 54.327 57.292 -2.965 1
1 675 . 12 1 1 A 60 60 ASP CB C 60 41.461 41.239 0.222 1
1 676 . 12 1 1 A 60 60 ASP N N 60 117.261 119.964 -2.703 1
1 677 . 12 1 1 A 61 61 ASP H H 61 7.500 8.345 -0.845 1
1 678 . 12 1 1 A 61 61 ASP HA H 61 4.591 4.747 -0.156 1
1 681 . 12 1 1 A 61 61 ASP C C 61 175.140 175.940 -0.800 1
1 682 . 12 1 1 A 61 61 ASP CA C 61 55.342 53.815 1.527 1
1 683 . 12 1 1 A 61 61 ASP CB C 61 42.475 39.860 2.615 1
1 684 . 12 1 1 A 61 61 ASP N N 61 122.319 118.931 3.388 1
1 685 . 12 1 1 A 62 62 GLN H H 62 8.239 7.952 0.287 1
1 686 . 12 1 1 A 62 62 GLN HA H 62 2.569 3.851 -1.282 1
1 693 . 12 1 1 A 62 62 GLN C C 62 172.652 173.782 -1.130 1
1 694 . 12 1 1 A 62 62 GLN CA C 62 54.038 55.662 -1.624 1
1 695 . 12 1 1 A 62 62 GLN CB C 62 31.481 29.596 1.885 1
1 697 . 12 1 1 A 62 62 GLN N N 62 117.458 123.282 -5.824 1
1 699 . 12 1 1 A 63 63 HIS H H 63 6.338 6.825 -0.487 1
1 700 . 12 1 1 A 63 63 HIS HA H 63 4.423 4.328 0.095 1
1 704 . 12 1 1 A 63 63 HIS C C 63 173.031 172.673 0.358 1
1 705 . 12 1 1 A 63 63 HIS CA C 63 54.743 53.964 0.779 1
1 706 . 12 1 1 A 63 63 HIS CB C 63 32.661 31.314 1.347 1
1 708 . 12 1 1 A 63 63 HIS N N 63 113.589 116.108 -2.519 1
1 709 . 12 1 1 A 64 64 PHE H H 64 8.549 8.766 -0.217 1
1 710 . 12 1 1 A 64 64 PHE HA H 64 4.578 5.065 -0.487 1
1 718 . 12 1 1 A 64 64 PHE C C 64 173.015 173.647 -0.632 1
1 719 . 12 1 1 A 64 64 PHE CA C 64 58.516 57.447 1.069 1
1 720 . 12 1 1 A 64 64 PHE CB C 64 43.525 42.857 0.668 1
1 726 . 12 1 1 A 64 64 PHE N N 64 118.214 119.992 -1.778 1
1 727 . 12 1 1 A 65 65 THR H H 65 7.150 8.280 -1.130 1
1 728 . 12 1 1 A 65 65 THR HA H 65 4.930 4.636 0.294 1
1 733 . 12 1 1 A 65 65 THR C C 65 172.457 173.701 -1.244 1
1 734 . 12 1 1 A 65 65 THR CA C 65 61.690 61.781 -0.091 1
1 735 . 12 1 1 A 65 65 THR CB C 65 69.593 69.430 0.163 1
1 737 . 12 1 1 A 65 65 THR N N 65 123.198 121.569 1.629 1
1 738 . 12 1 1 A 66 66 VAL H H 66 8.888 8.691 0.197 1
1 739 . 12 1 1 A 66 66 VAL HA H 66 4.018 4.746 -0.728 1
1 747 . 12 1 1 A 66 66 VAL C C 66 174.868 175.310 -0.442 1
1 748 . 12 1 1 A 66 66 VAL CA C 66 61.178 60.593 0.585 1
1 749 . 12 1 1 A 66 66 VAL CB C 66 33.114 33.195 -0.081 1
1 752 . 12 1 1 A 66 66 VAL N N 66 126.840 127.708 -0.868 1
1 753 . 12 1 1 A 67 67 THR H H 67 8.174 8.543 -0.369 1
1 754 . 12 1 1 A 67 67 THR HA H 67 4.816 5.051 -0.235 1
1 759 . 12 1 1 A 67 67 THR C C 67 174.494 174.207 0.287 1
1 760 . 12 1 1 A 67 67 THR CA C 67 59.786 59.510 0.276 1
1 761 . 12 1 1 A 67 67 THR CB C 67 70.887 71.618 -0.731 1
1 763 . 12 1 1 A 67 67 THR N N 67 116.127 117.074 -0.947 1
1 764 . 12 1 1 A 68 68 GLY H H 68 8.570 8.879 -0.309 1
1 765 . 12 1 1 A 68 68 GLY HA2 H 68 3.970 4.009 -0.039 1
1 766 . 12 1 1 A 68 68 GLY HA3 H 68 3.819 4.010 -0.191 1
1 767 . 12 1 1 A 68 68 GLY C C 68 175.636 174.753 0.883 1
1 768 . 12 1 1 A 68 68 GLY CA C 68 46.397 45.087 1.310 1
1 769 . 12 1 1 A 68 68 GLY N N 68 107.146 113.214 -6.068 1
1 770 . 12 1 1 A 69 69 LEU H H 69 8.007 7.403 0.604 1
1 771 . 12 1 1 A 69 69 LEU HA H 69 4.154 4.174 -0.020 1
1 781 . 12 1 1 A 69 69 LEU C C 69 176.830 176.333 0.497 1
1 782 . 12 1 1 A 69 69 LEU CA C 69 54.602 54.834 -0.232 1
1 783 . 12 1 1 A 69 69 LEU CB C 69 41.149 42.107 -0.958 1
1 787 . 12 1 1 A 69 69 LEU N N 69 118.433 122.576 -4.143 1
1 788 . 12 1 1 A 70 70 HIS H H 70 8.866 8.694 0.172 1
1 789 . 12 1 1 A 70 70 HIS HA H 70 4.663 4.608 0.055 1
1 793 . 12 1 1 A 70 70 HIS C C 70 176.667 175.577 1.090 1
1 794 . 12 1 1 A 70 70 HIS CA C 70 55.464 57.250 -1.786 1
1 795 . 12 1 1 A 70 70 HIS CB C 70 32.125 29.842 2.283 1
1 797 . 12 1 1 A 70 70 HIS N N 70 122.457 123.058 -0.601 1
1 798 . 12 1 1 A 71 71 LYS H H 71 8.716 8.613 0.103 1
1 799 . 12 1 1 A 71 71 LYS HA H 71 4.320 4.122 0.198 1
1 808 . 12 1 1 A 71 71 LYS C C 71 178.110 176.722 1.388 1
1 809 . 12 1 1 A 71 71 LYS CA C 71 57.035 56.340 0.695 1
1 810 . 12 1 1 A 71 71 LYS CB C 71 33.580 32.984 0.596 1
1 814 . 12 1 1 A 71 71 LYS N N 71 123.173 123.678 -0.505 1
1 815 . 12 1 1 A 72 72 GLY H H 72 7.709 8.868 -1.159 1
1 816 . 12 1 1 A 72 72 GLY HA2 H 72 3.800 3.913 -0.113 1
1 817 . 12 1 1 A 72 72 GLY HA3 H 72 3.769 3.921 -0.152 1
1 818 . 12 1 1 A 72 72 GLY C C 72 174.231 173.780 0.451 1
1 819 . 12 1 1 A 72 72 GLY CA C 72 47.866 46.416 1.450 1
1 820 . 12 1 1 A 72 72 GLY N N 72 114.881 110.311 4.570 1
1 821 . 12 1 1 A 73 73 THR H H 73 8.162 7.626 0.536 1
1 822 . 12 1 1 A 73 73 THR HA H 73 4.584 4.671 -0.087 1
1 827 . 12 1 1 A 73 73 THR C C 73 172.208 173.437 -1.229 1
1 828 . 12 1 1 A 73 73 THR CA C 73 62.307 61.210 1.097 1
1 829 . 12 1 1 A 73 73 THR CB C 73 72.123 71.816 0.307 1
1 831 . 12 1 1 A 73 73 THR N N 73 114.225 114.424 -0.199 1
1 832 . 12 1 1 A 74 74 THR H H 74 8.743 8.738 0.005 1
1 833 . 12 1 1 A 74 74 THR HA H 74 5.138 4.818 0.320 1
1 838 . 12 1 1 A 74 74 THR C C 74 173.376 173.613 -0.237 1
1 839 . 12 1 1 A 74 74 THR CA C 74 62.724 62.963 -0.239 1
1 840 . 12 1 1 A 74 74 THR CB C 74 69.202 69.694 -0.492 1
1 842 . 12 1 1 A 74 74 THR N N 74 123.376 121.144 2.232 1
1 843 . 12 1 1 A 75 75 TYR H H 75 9.549 9.136 0.413 1
1 844 . 12 1 1 A 75 75 TYR HA H 75 4.892 5.244 -0.352 1
1 851 . 12 1 1 A 75 75 TYR C C 75 173.991 175.262 -1.271 1
1 852 . 12 1 1 A 75 75 TYR CA C 75 57.740 56.141 1.599 1
1 853 . 12 1 1 A 75 75 TYR CB C 75 44.580 43.405 1.175 1
1 858 . 12 1 1 A 75 75 TYR N N 75 126.916 124.053 2.863 1
1 859 . 12 1 1 A 76 76 ILE H H 76 8.769 9.167 -0.398 1
1 860 . 12 1 1 A 76 76 ILE HA H 76 4.663 4.982 -0.319 1
1 870 . 12 1 1 A 76 76 ILE C C 76 174.683 175.314 -0.631 1
1 871 . 12 1 1 A 76 76 ILE CA C 76 60.455 60.511 -0.056 1
1 872 . 12 1 1 A 76 76 ILE CB C 76 40.284 39.944 0.340 1
1 876 . 12 1 1 A 76 76 ILE N N 76 119.407 121.244 -1.837 1
1 877 . 12 1 1 A 77 77 PHE H H 77 8.894 9.158 -0.264 1
1 878 . 12 1 1 A 77 77 PHE HA H 77 5.160 5.133 0.027 1
1 886 . 12 1 1 A 77 77 PHE C C 77 174.794 175.266 -0.472 1
1 887 . 12 1 1 A 77 77 PHE CA C 77 56.831 57.366 -0.535 1
1 888 . 12 1 1 A 77 77 PHE CB C 77 43.132 41.408 1.724 1
1 894 . 12 1 1 A 77 77 PHE N N 77 124.622 126.684 -2.062 1
1 895 . 12 1 1 A 78 78 ARG H H 78 9.407 9.356 0.051 1
1 896 . 12 1 1 A 78 78 ARG HA H 78 5.689 5.607 0.082 1
1 904 . 12 1 1 A 78 78 ARG C C 78 174.376 174.368 0.008 1
1 905 . 12 1 1 A 78 78 ARG CA C 78 54.530 54.578 -0.048 1
1 906 . 12 1 1 A 78 78 ARG CB C 78 34.473 33.732 0.741 1
1 909 . 12 1 1 A 78 78 ARG N N 78 120.055 120.747 -0.692 1
1 911 . 12 1 1 A 79 79 LEU H H 79 9.132 8.680 0.452 1
1 912 . 12 1 1 A 79 79 LEU HA H 79 5.398 5.197 0.201 1
1 922 . 12 1 1 A 79 79 LEU C C 79 174.006 174.350 -0.344 1
1 923 . 12 1 1 A 79 79 LEU CA C 79 53.401 53.190 0.211 1
1 924 . 12 1 1 A 79 79 LEU CB C 79 48.116 46.541 1.575 1
1 928 . 12 1 1 A 79 79 LEU N N 79 124.907 125.679 -0.772 1
1 929 . 12 1 1 A 80 80 ALA H H 80 8.737 8.118 0.619 1
1 930 . 12 1 1 A 80 80 ALA HA H 80 4.871 4.993 -0.122 1
1 934 . 12 1 1 A 80 80 ALA C C 80 176.057 175.674 0.383 1
1 935 . 12 1 1 A 80 80 ALA CA C 80 50.353 51.151 -0.798 1
1 936 . 12 1 1 A 80 80 ALA CB C 80 23.972 23.333 0.639 1
1 937 . 12 1 1 A 80 80 ALA N N 80 128.220 125.864 2.356 1
1 938 . 12 1 1 A 81 81 ALA H H 81 9.890 8.605 1.285 1
1 939 . 12 1 1 A 81 81 ALA HA H 81 4.794 5.018 -0.224 1
1 943 . 12 1 1 A 81 81 ALA C C 81 174.655 176.178 -1.523 1
1 944 . 12 1 1 A 81 81 ALA CA C 81 50.300 51.103 -0.803 1
1 945 . 12 1 1 A 81 81 ALA CB C 81 21.369 20.638 0.731 1
1 946 . 12 1 1 A 81 81 ALA N N 81 123.682 123.387 0.295 1
1 947 . 12 1 1 A 82 82 LYS H H 82 7.965 8.798 -0.833 1
1 948 . 12 1 1 A 82 82 LYS HA H 82 4.974 5.157 -0.183 1
1 957 . 12 1 1 A 82 82 LYS C C 82 175.671 175.181 0.490 1
1 958 . 12 1 1 A 82 82 LYS CA C 82 54.664 54.693 -0.029 1
1 959 . 12 1 1 A 82 82 LYS CB C 82 36.677 35.405 1.272 1
1 963 . 12 1 1 A 82 82 LYS N N 82 118.164 122.239 -4.075 1
1 964 . 12 1 1 A 83 83 ASN H H 83 8.663 8.701 -0.038 1
1 965 . 12 1 1 A 83 83 ASN HA H 83 5.113 5.062 0.051 1
1 970 . 12 1 1 A 83 83 ASN C C 83 176.582 175.967 0.615 1
1 971 . 12 1 1 A 83 83 ASN CA C 83 51.746 50.688 1.058 1
1 972 . 12 1 1 A 83 83 ASN CB C 83 40.357 40.131 0.226 1
1 973 . 12 1 1 A 83 83 ASN N N 83 124.784 124.302 0.482 1
1 975 . 12 1 1 A 84 84 ARG H H 84 8.873 8.847 0.026 1
1 976 . 12 1 1 A 84 84 ARG HA H 84 3.940 3.955 -0.015 1
1 983 . 12 1 1 A 84 84 ARG C C 84 176.735 177.896 -1.161 1
1 984 . 12 1 1 A 84 84 ARG CA C 84 59.327 59.629 -0.302 1
1 985 . 12 1 1 A 84 84 ARG CB C 84 29.282 29.845 -0.563 1
1 988 . 12 1 1 A 84 84 ARG N N 84 117.891 119.906 -2.015 1
1 989 . 12 1 1 A 85 85 ALA H H 85 7.645 7.843 -0.198 1
1 990 . 12 1 1 A 85 85 ALA HA H 85 4.276 4.200 0.076 1
1 994 . 12 1 1 A 85 85 ALA C C 85 177.479 177.287 0.192 1
1 995 . 12 1 1 A 85 85 ALA CA C 85 52.818 52.987 -0.169 1
1 996 . 12 1 1 A 85 85 ALA CB C 85 18.806 19.464 -0.658 1
1 997 . 12 1 1 A 85 85 ALA N N 85 120.306 119.922 0.384 1
1 998 . 12 1 1 A 86 86 GLY H H 86 7.693 7.696 -0.003 1
1 999 . 12 1 1 A 86 86 GLY HA2 H 86 4.456 4.083 0.373 1
1 1000 . 12 1 1 A 86 86 GLY HA3 H 86 3.649 4.085 -0.436 1
1 1001 . 12 1 1 A 86 86 GLY C C 86 172.068 172.593 -0.525 1
1 1002 . 12 1 1 A 86 86 GLY CA C 86 44.375 44.038 0.337 1
1 1003 . 12 1 1 A 86 86 GLY N N 86 106.594 103.762 2.832 1
1 1004 . 12 1 1 A 87 87 LEU H H 87 8.203 8.457 -0.254 1
1 1005 . 12 1 1 A 87 87 LEU HA H 87 4.629 4.600 0.029 1
1 1015 . 12 1 1 A 87 87 LEU C C 87 179.155 176.499 2.656 1
1 1016 . 12 1 1 A 87 87 LEU CA C 87 54.814 55.457 -0.643 1
1 1017 . 12 1 1 A 87 87 LEU CB C 87 43.454 42.523 0.931 1
1 1021 . 12 1 1 A 87 87 LEU N N 87 120.879 122.426 -1.547 1
1 1022 . 12 1 1 A 88 88 GLY H H 88 8.492 8.288 0.204 1
1 1023 . 12 1 1 A 88 88 GLY HA2 H 88 4.339 4.192 0.147 1
1 1024 . 12 1 1 A 88 88 GLY HA3 H 88 4.122 4.197 -0.075 1
1 1025 . 12 1 1 A 88 88 GLY C C 88 173.030 173.311 -0.281 1
1 1026 . 12 1 1 A 88 88 GLY CA C 88 43.970 44.631 -0.661 1
1 1027 . 12 1 1 A 88 88 GLY N N 88 109.903 110.274 -0.371 1
1 1028 . 12 1 1 A 89 89 GLU H H 89 7.638 8.937 -1.299 1
1 1029 . 12 1 1 A 89 89 GLU HA H 89 4.103 4.270 -0.167 1
1 1034 . 12 1 1 A 89 89 GLU C C 89 177.511 175.693 1.818 1
1 1035 . 12 1 1 A 89 89 GLU CA C 89 56.659 57.197 -0.538 1
1 1036 . 12 1 1 A 89 89 GLU CB C 89 31.324 30.722 0.602 1
1 1038 . 12 1 1 A 89 89 GLU N N 89 117.551 121.845 -4.294 1
1 1039 . 12 1 1 A 90 90 GLU H H 90 8.734 8.988 -0.254 1
1 1040 . 12 1 1 A 90 90 GLU HA H 90 4.651 5.324 -0.673 1
1 1045 . 12 1 1 A 90 90 GLU C C 90 177.452 174.291 3.161 1
1 1046 . 12 1 1 A 90 90 GLU CA C 90 55.987 54.553 1.434 1
1 1047 . 12 1 1 A 90 90 GLU CB C 90 31.135 33.272 -2.137 1
1 1049 . 12 1 1 A 90 90 GLU N N 90 121.553 118.266 3.287 1
1 1050 . 12 1 1 A 91 91 PHE H H 91 9.411 9.014 0.397 1
1 1051 . 12 1 1 A 91 91 PHE HA H 91 4.665 5.052 -0.387 1
1 1059 . 12 1 1 A 91 91 PHE C C 91 173.944 174.192 -0.248 1
1 1060 . 12 1 1 A 91 91 PHE CA C 91 57.687 57.500 0.187 1
1 1061 . 12 1 1 A 91 91 PHE CB C 91 40.890 41.973 -1.083 1
1 1067 . 12 1 1 A 91 91 PHE N N 91 125.459 125.036 0.423 1
1 1068 . 12 1 1 A 92 92 GLU H H 92 8.043 8.127 -0.084 1
1 1069 . 12 1 1 A 92 92 GLU HA H 92 5.424 5.153 0.271 1
1 1074 . 12 1 1 A 92 92 GLU C C 92 174.295 174.441 -0.146 1
1 1075 . 12 1 1 A 92 92 GLU CA C 92 54.378 54.517 -0.139 1
1 1076 . 12 1 1 A 92 92 GLU CB C 92 33.662 33.277 0.385 1
1 1078 . 12 1 1 A 92 92 GLU N N 92 128.905 126.977 1.928 1
1 1079 . 12 1 1 A 93 93 LYS H H 93 9.142 8.535 0.607 1
1 1080 . 12 1 1 A 93 93 LYS HA H 93 4.541 5.067 -0.526 1
1 1089 . 12 1 1 A 93 93 LYS C C 93 173.366 173.988 -0.622 1
1 1090 . 12 1 1 A 93 93 LYS CA C 93 55.343 55.380 -0.037 1
1 1091 . 12 1 1 A 93 93 LYS CB C 93 37.317 36.114 1.203 1
1 1095 . 12 1 1 A 93 93 LYS N N 93 125.231 126.824 -1.593 1
1 1096 . 12 1 1 A 94 94 GLU H H 94 8.655 9.143 -0.488 1
1 1097 . 12 1 1 A 94 94 GLU HA H 94 5.558 5.408 0.150 1
1 1102 . 12 1 1 A 94 94 GLU C C 94 176.238 175.574 0.664 1
1 1103 . 12 1 1 A 94 94 GLU CA C 94 54.632 55.054 -0.422 1
1 1104 . 12 1 1 A 94 94 GLU CB C 94 32.166 33.174 -1.008 1
1 1106 . 12 1 1 A 94 94 GLU N N 94 127.232 127.425 -0.193 1
1 1107 . 12 1 1 A 95 95 ILE H H 95 9.302 9.014 0.288 1
1 1108 . 12 1 1 A 95 95 ILE HA H 95 4.794 5.228 -0.434 1
1 1118 . 12 1 1 A 95 95 ILE C C 95 173.138 174.500 -1.362 1
1 1119 . 12 1 1 A 95 95 ILE CA C 95 58.570 58.443 0.127 1
1 1120 . 12 1 1 A 95 95 ILE CB C 95 42.420 42.759 -0.339 1
1 1124 . 12 1 1 A 95 95 ILE N N 95 120.711 121.256 -0.545 1
1 1125 . 12 1 1 A 96 96 ARG H H 96 8.589 8.747 -0.158 1
1 1126 . 12 1 1 A 96 96 ARG HA H 96 5.373 4.766 0.607 1
1 1133 . 12 1 1 A 96 96 ARG C C 96 177.147 175.047 2.100 1
1 1134 . 12 1 1 A 96 96 ARG CA C 96 54.045 55.301 -1.256 1
1 1135 . 12 1 1 A 96 96 ARG CB C 96 32.001 33.799 -1.798 1
1 1138 . 12 1 1 A 96 96 ARG N N 96 124.445 121.637 2.808 1
1 1139 . 12 1 1 A 97 97 THR H H 97 9.243 8.548 0.695 1
1 1140 . 12 1 1 A 97 97 THR HA H 97 4.459 4.663 -0.204 1
1 1145 . 12 1 1 A 97 97 THR C C 97 172.745 174.029 -1.284 1
1 1146 . 12 1 1 A 97 97 THR CA C 97 59.637 60.652 -1.015 1
1 1147 . 12 1 1 A 97 97 THR CB C 97 67.687 68.799 -1.112 1
1 1149 . 12 1 1 A 97 97 THR N N 97 119.370 118.472 0.898 1
1 1150 . 12 1 1 A 98 98 PRO HA H 98 4.494 4.723 -0.229 1
1 1157 . 12 1 1 A 98 98 PRO CA C 98 63.117 62.745 0.372 1
1 1158 . 12 1 1 A 98 98 PRO CB C 98 32.500 31.901 0.599 1
1 1161 . 12 1 1 A 99 99 GLU H H 99 8.534 8.372 0.162 1
1 1162 . 12 1 1 A 99 99 GLU HA H 99 4.195 4.380 -0.185 1
1 1167 . 12 1 1 A 99 99 GLU C C 99 175.881 175.983 -0.102 1
1 1168 . 12 1 1 A 99 99 GLU CA C 99 56.330 55.878 0.452 1
1 1169 . 12 1 1 A 99 99 GLU CB C 99 31.062 30.617 0.445 1
1 1171 . 12 1 1 A 99 99 GLU N N 99 119.688 119.006 0.682 1
1 1172 . 12 1 1 A 100 100 ASP H H 100 8.536 8.593 -0.057 1
1 1173 . 12 1 1 A 100 100 ASP HA H 100 4.607 5.441 -0.834 1
1 1176 . 12 1 1 A 100 100 ASP C C 100 176.012 174.621 1.391 1
1 1177 . 12 1 1 A 100 100 ASP CA C 100 54.109 52.769 1.340 1
1 1178 . 12 1 1 A 100 100 ASP CB C 100 41.562 45.708 -4.146 1
1 1179 . 12 1 1 A 100 100 ASP N N 100 119.803 120.465 -0.662 1
1 1180 . 12 1 1 A 101 101 LEU H H 101 8.403 8.675 -0.272 1
1 1181 . 12 1 1 A 101 101 LEU HA H 101 4.426 4.786 -0.360 1
1 1191 . 12 1 1 A 101 101 LEU C C 101 177.534 175.335 2.199 1
1 1192 . 12 1 1 A 101 101 LEU CA C 101 55.113 54.515 0.598 1
1 1193 . 12 1 1 A 101 101 LEU CB C 101 42.156 45.681 -3.525 1
1 1197 . 12 1 1 A 101 101 LEU N N 101 123.876 123.299 0.577 1
1 1198 . 12 1 1 A 102 102 SER H H 102 8.413 8.869 -0.456 1
1 1199 . 12 1 1 A 102 102 SER HA H 102 4.434 4.463 -0.029 1
1 1202 . 12 1 1 A 102 102 SER C C 102 174.674 174.761 -0.087 1
1 1203 . 12 1 1 A 102 102 SER CA C 102 58.798 57.975 0.823 1
1 1204 . 12 1 1 A 102 102 SER CB C 102 63.854 63.928 -0.074 1
1 1205 . 12 1 1 A 102 102 SER N N 102 116.667 120.009 -3.342 1
1 1206 . 12 1 1 A 103 103 GLY H H 103 8.213 8.711 -0.498 1
1 1207 . 12 1 1 A 103 103 GLY HA2 H 103 4.164 4.121 0.043 1
1 1208 . 12 1 1 A 103 103 GLY HA3 H 103 4.057 4.121 -0.064 1
1 1209 . 12 1 1 A 103 103 GLY C C 103 171.822 174.239 -2.417 1
1 1210 . 12 1 1 A 103 103 GLY CA C 103 44.658 45.186 -0.528 1
1 1211 . 12 1 1 A 103 103 GLY N N 103 110.592 109.312 1.280 1
1 1212 . 12 1 1 A 104 104 PRO HA H 104 4.475 4.411 0.064 1
1 1219 . 12 1 1 A 104 104 PRO C C 104 177.445 176.704 0.741 1
1 1220 . 12 1 1 A 104 104 PRO CA C 104 63.312 64.275 -0.963 1
1 1221 . 12 1 1 A 104 104 PRO CB C 104 32.190 31.881 0.309 1
1 1224 . 12 1 1 A 105 105 SER H H 105 8.538 7.804 0.734 1
1 1225 . 12 1 1 A 105 105 SER HA H 105 4.541 4.381 0.160 1
1 1228 . 12 1 1 A 105 105 SER C C 105 174.616 174.862 -0.246 1
1 1229 . 12 1 1 A 105 105 SER CA C 105 58.270 58.652 -0.382 1
1 1230 . 12 1 1 A 105 105 SER CB C 105 63.895 63.359 0.536 1
1 1231 . 12 1 1 A 105 105 SER N N 105 116.446 114.733 1.713 1
1 1232 . 12 1 1 A 106 106 SER H H 106 8.350 8.892 -0.542 1
1 1233 . 12 1 1 A 106 106 SER HA H 106 4.541 4.495 0.046 1
1 1236 . 12 1 1 A 106 106 SER C C 106 174.530 175.840 -1.310 1
1 1237 . 12 1 1 A 106 106 SER CA C 106 58.357 58.517 -0.160 1
1 1238 . 12 1 1 A 106 106 SER CB C 106 64.020 64.142 -0.122 1
1 1239 . 12 1 1 A 106 106 SER N N 106 117.448 121.646 -4.198 1
1 1 . 13 1 1 A 2 2 SER C C 2 174.723 172.801 1.922 1
1 2 . 13 1 1 A 2 2 SER CA C 2 58.446 57.071 1.375 1
1 3 . 13 1 1 A 2 2 SER CB C 2 63.566 66.274 -2.708 1
1 4 . 13 1 1 A 3 3 SER H H 3 8.350 8.660 -0.310 1
1 5 . 13 1 1 A 3 3 SER C C 3 173.961 174.539 -0.578 1
1 6 . 13 1 1 A 3 3 SER CA C 3 58.428 58.983 -0.555 1
1 7 . 13 1 1 A 3 3 SER CB C 3 63.937 63.925 0.012 1
1 8 . 13 1 1 A 3 3 SER N N 3 117.923 121.630 -3.707 1
1 9 . 13 1 1 A 4 4 GLY H H 4 8.050 8.739 -0.689 1
1 10 . 13 1 1 A 4 4 GLY C C 4 179.009 175.426 3.583 1
1 11 . 13 1 1 A 4 4 GLY CA C 4 46.174 45.594 0.580 1
1 12 . 13 1 1 A 4 4 GLY N N 4 116.890 114.646 2.244 1
1 13 . 13 1 1 A 7 7 GLY HA2 H 7 4.340 4.287 0.053 1
1 14 . 13 1 1 A 7 7 GLY HA3 H 7 3.629 4.288 -0.659 1
1 15 . 13 1 1 A 7 7 GLY CA C 7 44.381 45.143 -0.762 1
1 16 . 13 1 1 A 8 8 PRO HA H 8 4.476 4.539 -0.063 1
1 23 . 13 1 1 A 8 8 PRO C C 8 176.235 177.457 -1.222 1
1 24 . 13 1 1 A 8 8 PRO CA C 8 62.995 62.725 0.270 1
1 25 . 13 1 1 A 8 8 PRO CB C 8 33.266 32.201 1.065 1
1 28 . 13 1 1 A 9 9 GLY H H 9 8.585 8.422 0.163 1
1 29 . 13 1 1 A 9 9 GLY HA2 H 9 4.326 4.101 0.225 1
1 30 . 13 1 1 A 9 9 GLY HA3 H 9 4.009 4.108 -0.099 1
1 31 . 13 1 1 A 9 9 GLY C C 9 172.998 173.417 -0.419 1
1 32 . 13 1 1 A 9 9 GLY CA C 9 44.393 44.341 0.052 1
1 33 . 13 1 1 A 9 9 GLY N N 9 106.004 107.456 -1.452 1
1 34 . 13 1 1 A 10 10 ARG H H 10 8.548 8.393 0.155 1
1 35 . 13 1 1 A 10 10 ARG HA H 10 4.654 4.845 -0.191 1
1 41 . 13 1 1 A 10 10 ARG C C 10 175.780 173.999 1.781 1
1 42 . 13 1 1 A 10 10 ARG CA C 10 54.708 52.632 2.076 1
1 43 . 13 1 1 A 10 10 ARG CB C 10 31.448 31.479 -0.031 1
1 45 . 13 1 1 A 10 10 ARG N N 10 119.407 121.908 -2.501 1
1 46 . 13 1 1 A 11 11 PRO HA H 11 4.611 4.559 0.052 1
1 53 . 13 1 1 A 11 11 PRO C C 11 173.510 175.727 -2.217 1
1 54 . 13 1 1 A 11 11 PRO CA C 11 62.360 62.657 -0.297 1
1 55 . 13 1 1 A 11 11 PRO CB C 11 33.402 32.297 1.105 1
1 58 . 13 1 1 A 12 12 THR H H 12 7.572 8.636 -1.064 1
1 59 . 13 1 1 A 12 12 THR HA H 12 3.796 4.390 -0.594 1
1 64 . 13 1 1 A 12 12 THR C C 12 172.337 173.209 -0.872 1
1 65 . 13 1 1 A 12 12 THR CA C 12 61.778 61.760 0.018 1
1 66 . 13 1 1 A 12 12 THR CB C 12 70.561 68.530 2.031 1
1 68 . 13 1 1 A 12 12 THR N N 12 109.653 117.515 -7.862 1
1 69 . 13 1 1 A 13 13 MET H H 13 5.605 8.645 -3.040 1
1 70 . 13 1 1 A 13 13 MET HA H 13 5.091 4.941 0.150 1
1 78 . 13 1 1 A 13 13 MET C C 13 172.639 174.932 -2.293 1
1 79 . 13 1 1 A 13 13 MET CA C 13 54.168 53.962 0.206 1
1 80 . 13 1 1 A 13 13 MET CB C 13 37.632 34.448 3.184 1
1 83 . 13 1 1 A 13 13 MET N N 13 121.634 126.810 -5.176 1
1 84 . 13 1 1 A 14 14 MET H H 14 9.254 8.949 0.305 1
1 85 . 13 1 1 A 14 14 MET HA H 14 4.662 5.196 -0.534 1
1 93 . 13 1 1 A 14 14 MET C C 14 174.388 174.697 -0.309 1
1 94 . 13 1 1 A 14 14 MET CA C 14 54.673 54.081 0.592 1
1 95 . 13 1 1 A 14 14 MET CB C 14 34.907 34.697 0.210 1
1 98 . 13 1 1 A 14 14 MET N N 14 125.746 124.372 1.374 1
1 99 . 13 1 1 A 15 15 ILE H H 15 8.555 9.158 -0.603 1
1 100 . 13 1 1 A 15 15 ILE HA H 15 4.882 5.004 -0.122 1
1 110 . 13 1 1 A 15 15 ILE C C 15 174.962 175.061 -0.099 1
1 111 . 13 1 1 A 15 15 ILE CA C 15 60.685 60.379 0.306 1
1 112 . 13 1 1 A 15 15 ILE CB C 15 40.878 38.561 2.317 1
1 116 . 13 1 1 A 15 15 ILE N N 15 121.623 125.855 -4.232 1
1 117 . 13 1 1 A 16 16 SER H H 16 8.703 8.736 -0.033 1
1 118 . 13 1 1 A 16 16 SER HA H 16 4.922 5.055 -0.133 1
1 121 . 13 1 1 A 16 16 SER C C 16 173.860 172.935 0.925 1
1 122 . 13 1 1 A 16 16 SER CA C 16 56.524 57.319 -0.795 1
1 123 . 13 1 1 A 16 16 SER CB C 16 65.004 65.871 -0.867 1
1 124 . 13 1 1 A 16 16 SER N N 16 122.261 124.078 -1.817 1
1 125 . 13 1 1 A 17 17 THR H H 17 8.759 8.563 0.196 1
1 126 . 13 1 1 A 17 17 THR HA H 17 4.885 5.007 -0.122 1
1 131 . 13 1 1 A 17 17 THR C C 17 175.018 174.492 0.526 1
1 132 . 13 1 1 A 17 17 THR CA C 17 60.315 60.711 -0.396 1
1 133 . 13 1 1 A 17 17 THR CB C 17 69.799 70.167 -0.368 1
1 135 . 13 1 1 A 17 17 THR N N 17 115.660 115.464 0.196 1
1 136 . 13 1 1 A 18 18 THR H H 18 8.038 8.765 -0.727 1
1 137 . 13 1 1 A 18 18 THR HA H 18 4.596 4.442 0.154 1
1 142 . 13 1 1 A 18 18 THR CA C 18 60.707 62.408 -1.701 1
1 143 . 13 1 1 A 18 18 THR CB C 18 71.082 69.879 1.203 1
1 145 . 13 1 1 A 18 18 THR N N 18 112.362 115.244 -2.882 1
1 146 . 13 1 1 A 19 19 ALA H H 19 8.545 7.355 1.190 1
1 147 . 13 1 1 A 19 19 ALA HA H 19 4.412 4.386 0.026 1
1 151 . 13 1 1 A 19 19 ALA C C 19 177.034 176.921 0.113 1
1 152 . 13 1 1 A 19 19 ALA CA C 19 52.264 51.839 0.425 1
1 153 . 13 1 1 A 19 19 ALA CB C 19 19.292 20.356 -1.064 1
1 154 . 13 1 1 A 19 19 ALA N N 19 119.589 123.336 -3.747 1
1 155 . 13 1 1 A 20 20 MET H H 20 8.145 8.494 -0.349 1
1 156 . 13 1 1 A 20 20 MET HA H 20 4.447 4.418 0.029 1
1 164 . 13 1 1 A 20 20 MET C C 20 175.676 176.066 -0.390 1
1 165 . 13 1 1 A 20 20 MET CA C 20 55.764 55.828 -0.064 1
1 166 . 13 1 1 A 20 20 MET CB C 20 31.495 32.484 -0.989 1
1 169 . 13 1 1 A 20 20 MET N N 20 116.950 116.724 0.226 1
1 170 . 13 1 1 A 21 21 ASN H H 21 8.275 8.907 -0.632 1
1 171 . 13 1 1 A 21 21 ASN HA H 21 4.452 4.314 0.138 1
1 176 . 13 1 1 A 21 21 ASN C C 21 174.100 173.790 0.310 1
1 177 . 13 1 1 A 21 21 ASN CA C 21 54.320 54.395 -0.075 1
1 178 . 13 1 1 A 21 21 ASN CB C 21 37.234 37.303 -0.069 1
1 179 . 13 1 1 A 21 21 ASN N N 21 113.198 116.925 -3.727 1
1 181 . 13 1 1 A 22 22 THR H H 22 7.071 7.453 -0.382 1
1 182 . 13 1 1 A 22 22 THR HA H 22 5.218 5.394 -0.176 1
1 187 . 13 1 1 A 22 22 THR C C 22 173.301 173.031 0.270 1
1 188 . 13 1 1 A 22 22 THR CA C 22 59.399 60.403 -1.004 1
1 189 . 13 1 1 A 22 22 THR CB C 22 72.714 71.930 0.784 1
1 191 . 13 1 1 A 22 22 THR N N 22 107.603 107.728 -0.125 1
1 192 . 13 1 1 A 23 23 ALA H H 23 8.687 8.939 -0.252 1
1 193 . 13 1 1 A 23 23 ALA HA H 23 4.925 5.067 -0.142 1
1 197 . 13 1 1 A 23 23 ALA C C 23 174.100 175.785 -1.685 1
1 198 . 13 1 1 A 23 23 ALA CA C 23 50.812 50.118 0.694 1
1 199 . 13 1 1 A 23 23 ALA CB C 23 21.122 21.293 -0.171 1
1 200 . 13 1 1 A 23 23 ALA N N 23 121.937 125.569 -3.632 1
1 201 . 13 1 1 A 24 24 LEU H H 24 8.833 9.015 -0.182 1
1 202 . 13 1 1 A 24 24 LEU HA H 24 4.673 4.517 0.156 1
1 212 . 13 1 1 A 24 24 LEU C C 24 175.140 174.679 0.461 1
1 213 . 13 1 1 A 24 24 LEU CA C 24 54.320 54.998 -0.678 1
1 214 . 13 1 1 A 24 24 LEU CB C 24 42.518 43.111 -0.593 1
1 218 . 13 1 1 A 24 24 LEU N N 24 123.721 126.277 -2.556 1
1 219 . 13 1 1 A 25 25 LEU H H 25 9.176 8.921 0.255 1
1 220 . 13 1 1 A 25 25 LEU HA H 25 5.112 5.059 0.053 1
1 230 . 13 1 1 A 25 25 LEU C C 25 176.414 176.048 0.366 1
1 231 . 13 1 1 A 25 25 LEU CA C 25 54.108 52.986 1.122 1
1 232 . 13 1 1 A 25 25 LEU CB C 25 43.230 43.640 -0.410 1
1 236 . 13 1 1 A 25 25 LEU N N 25 128.589 128.389 0.200 1
1 237 . 13 1 1 A 26 26 GLN H H 26 8.556 8.480 0.076 1
1 238 . 13 1 1 A 26 26 GLN HA H 26 4.737 4.912 -0.175 1
1 245 . 13 1 1 A 26 26 GLN C C 26 174.372 174.247 0.125 1
1 246 . 13 1 1 A 26 26 GLN CA C 26 56.365 54.449 1.916 1
1 247 . 13 1 1 A 26 26 GLN CB C 26 33.320 31.670 1.650 1
1 249 . 13 1 1 A 26 26 GLN N N 26 119.630 122.829 -3.199 1
1 251 . 13 1 1 A 27 27 TRP H H 27 8.080 8.097 -0.017 1
1 252 . 13 1 1 A 27 27 TRP HA H 27 5.441 6.177 -0.736 1
1 261 . 13 1 1 A 27 27 TRP CA C 27 55.957 54.622 1.335 1
1 262 . 13 1 1 A 27 27 TRP CB C 27 32.517 32.696 -0.179 1
1 268 . 13 1 1 A 27 27 TRP N N 27 121.276 121.976 -0.700 1
1 270 . 13 1 1 A 28 28 HIS H H 28 8.262 8.717 -0.455 1
1 271 . 13 1 1 A 28 28 HIS HA H 28 4.997 5.559 -0.562 1
1 275 . 13 1 1 A 28 28 HIS CA C 28 53.028 53.388 -0.360 1
1 276 . 13 1 1 A 28 28 HIS CB C 28 32.832 32.589 0.243 1
1 278 . 13 1 1 A 28 28 HIS N N 28 116.245 116.564 -0.319 1
1 279 . 13 1 1 A 29 29 PRO HA H 29 4.984 4.459 0.525 1
1 286 . 13 1 1 A 29 29 PRO CA C 29 61.498 61.996 -0.498 1
1 287 . 13 1 1 A 29 29 PRO CB C 29 30.709 32.354 -1.645 1
1 290 . 13 1 1 A 30 30 PRO HA H 30 4.449 4.494 -0.045 1
1 297 . 13 1 1 A 30 30 PRO C C 30 175.733 177.158 -1.425 1
1 298 . 13 1 1 A 30 30 PRO CA C 30 62.245 62.459 -0.214 1
1 299 . 13 1 1 A 30 30 PRO CB C 30 32.083 32.069 0.014 1
1 302 . 13 1 1 A 31 31 LYS H H 31 8.403 8.823 -0.420 1
1 303 . 13 1 1 A 31 31 LYS HA H 31 4.084 4.444 -0.360 1
1 312 . 13 1 1 A 31 31 LYS C C 31 177.166 178.324 -1.158 1
1 313 . 13 1 1 A 31 31 LYS CA C 31 57.866 58.221 -0.355 1
1 314 . 13 1 1 A 31 31 LYS CB C 31 32.698 32.822 -0.124 1
1 318 . 13 1 1 A 31 31 LYS N N 31 121.693 123.853 -2.160 1
1 319 . 13 1 1 A 32 32 GLU H H 32 8.102 7.787 0.315 1
1 320 . 13 1 1 A 32 32 GLU HA H 32 4.365 4.496 -0.131 1
1 325 . 13 1 1 A 32 32 GLU C C 32 174.248 176.244 -1.996 1
1 326 . 13 1 1 A 32 32 GLU CA C 32 55.448 55.637 -0.189 1
1 327 . 13 1 1 A 32 32 GLU CB C 32 29.405 29.990 -0.585 1
1 329 . 13 1 1 A 32 32 GLU N N 32 118.742 117.414 1.328 1
1 330 . 13 1 1 A 33 33 LEU H H 33 8.420 7.517 0.903 1
1 331 . 13 1 1 A 33 33 LEU HA H 33 4.499 4.602 -0.103 1
1 341 . 13 1 1 A 33 33 LEU C C 33 173.036 175.035 -1.999 1
1 342 . 13 1 1 A 33 33 LEU CA C 33 52.863 52.604 0.259 1
1 343 . 13 1 1 A 33 33 LEU CB C 33 42.535 42.709 -0.174 1
1 347 . 13 1 1 A 33 33 LEU N N 33 125.181 123.820 1.361 1
1 348 . 13 1 1 A 34 34 PRO HA H 34 4.488 4.476 0.012 1
1 355 . 13 1 1 A 34 34 PRO C C 34 177.544 176.847 0.697 1
1 356 . 13 1 1 A 34 34 PRO CA C 34 62.889 63.193 -0.304 1
1 357 . 13 1 1 A 34 34 PRO CB C 34 31.472 30.873 0.599 1
1 360 . 13 1 1 A 35 35 GLY H H 35 8.397 8.044 0.353 1
1 361 . 13 1 1 A 35 35 GLY HA2 H 35 4.059 4.115 -0.056 1
1 362 . 13 1 1 A 35 35 GLY HA3 H 35 3.716 4.117 -0.401 1
1 363 . 13 1 1 A 35 35 GLY C C 35 173.356 172.113 1.243 1
1 364 . 13 1 1 A 35 35 GLY CA C 35 45.892 45.037 0.855 1
1 365 . 13 1 1 A 35 35 GLY N N 35 110.524 112.270 -1.746 1
1 366 . 13 1 1 A 36 36 GLU H H 36 8.091 8.530 -0.439 1
1 367 . 13 1 1 A 36 36 GLU HA H 36 4.371 5.072 -0.701 1
1 372 . 13 1 1 A 36 36 GLU C C 36 174.864 174.438 0.426 1
1 373 . 13 1 1 A 36 36 GLU CA C 36 55.201 54.755 0.446 1
1 374 . 13 1 1 A 36 36 GLU CB C 36 31.878 33.082 -1.204 1
1 376 . 13 1 1 A 36 36 GLU N N 36 122.202 120.270 1.932 1
1 377 . 13 1 1 A 37 37 LEU H H 37 8.307 8.702 -0.395 1
1 378 . 13 1 1 A 37 37 LEU HA H 37 4.288 4.285 0.003 1
1 388 . 13 1 1 A 37 37 LEU C C 37 176.702 176.065 0.637 1
1 389 . 13 1 1 A 37 37 LEU CA C 37 55.342 56.367 -1.025 1
1 390 . 13 1 1 A 37 37 LEU CB C 37 42.715 42.220 0.495 1
1 394 . 13 1 1 A 37 37 LEU N N 37 123.204 124.689 -1.485 1
1 395 . 13 1 1 A 38 38 LEU H H 38 8.909 8.598 0.311 1
1 396 . 13 1 1 A 38 38 LEU HA H 38 4.640 4.597 0.043 1
1 406 . 13 1 1 A 38 38 LEU C C 38 177.202 176.797 0.405 1
1 407 . 13 1 1 A 38 38 LEU CA C 38 54.390 55.219 -0.829 1
1 408 . 13 1 1 A 38 38 LEU CB C 38 43.770 43.736 0.034 1
1 412 . 13 1 1 A 38 38 LEU N N 38 123.021 126.855 -3.834 1
1 413 . 13 1 1 A 39 39 GLY H H 39 7.113 6.942 0.171 1
1 414 . 13 1 1 A 39 39 GLY HA2 H 39 4.816 3.538 1.278 1
1 415 . 13 1 1 A 39 39 GLY HA3 H 39 3.276 3.880 -0.604 1
1 416 . 13 1 1 A 39 39 GLY C C 39 169.863 170.483 -0.620 1
1 417 . 13 1 1 A 39 39 GLY CA C 39 44.622 45.494 -0.872 1
1 418 . 13 1 1 A 39 39 GLY N N 39 104.137 103.668 0.469 1
1 419 . 13 1 1 A 40 40 TYR H H 40 8.318 8.839 -0.521 1
1 420 . 13 1 1 A 40 40 TYR HA H 40 5.414 5.138 0.276 1
1 425 . 13 1 1 A 40 40 TYR C C 40 174.448 172.218 2.230 1
1 426 . 13 1 1 A 40 40 TYR CA C 40 56.178 56.379 -0.201 1
1 427 . 13 1 1 A 40 40 TYR CB C 40 44.191 40.731 3.460 1
1 430 . 13 1 1 A 40 40 TYR N N 40 114.036 115.220 -1.184 1
1 431 . 13 1 1 A 41 41 ARG H H 41 9.347 8.788 0.559 1
1 432 . 13 1 1 A 41 41 ARG HA H 41 5.092 5.385 -0.293 1
1 440 . 13 1 1 A 41 41 ARG C C 41 174.097 174.016 0.081 1
1 441 . 13 1 1 A 41 41 ARG CA C 41 56.100 54.318 1.782 1
1 442 . 13 1 1 A 41 41 ARG CB C 41 34.508 32.853 1.655 1
1 445 . 13 1 1 A 41 41 ARG N N 41 122.231 121.049 1.182 1
1 447 . 13 1 1 A 42 42 LEU H H 42 9.546 9.077 0.469 1
1 448 . 13 1 1 A 42 42 LEU HA H 42 5.459 5.064 0.395 1
1 458 . 13 1 1 A 42 42 LEU C C 42 174.913 174.753 0.160 1
1 459 . 13 1 1 A 42 42 LEU CA C 42 52.997 53.691 -0.694 1
1 460 . 13 1 1 A 42 42 LEU CB C 42 46.413 45.582 0.831 1
1 464 . 13 1 1 A 42 42 LEU N N 42 132.335 127.020 5.315 1
1 465 . 13 1 1 A 43 43 GLN H H 43 9.502 9.347 0.155 1
1 466 . 13 1 1 A 43 43 GLN HA H 43 5.847 5.251 0.596 1
1 473 . 13 1 1 A 43 43 GLN C C 43 175.329 174.350 0.979 1
1 474 . 13 1 1 A 43 43 GLN CA C 43 54.005 54.378 -0.373 1
1 475 . 13 1 1 A 43 43 GLN CB C 43 33.429 31.441 1.988 1
1 477 . 13 1 1 A 43 43 GLN N N 43 123.932 125.829 -1.897 1
1 479 . 13 1 1 A 44 44 TYR H H 44 8.615 8.026 0.589 1
1 480 . 13 1 1 A 44 44 TYR HA H 44 5.783 5.642 0.141 1
1 487 . 13 1 1 A 44 44 TYR C C 44 174.058 173.522 0.536 1
1 488 . 13 1 1 A 44 44 TYR CA C 44 55.942 56.461 -0.519 1
1 489 . 13 1 1 A 44 44 TYR CB C 44 43.052 41.492 1.560 1
1 494 . 13 1 1 A 44 44 TYR N N 44 117.355 119.392 -2.037 1
1 495 . 13 1 1 A 45 45 CYS H H 45 8.377 8.293 0.084 1
1 496 . 13 1 1 A 45 45 CYS HA H 45 4.772 5.140 -0.368 1
1 499 . 13 1 1 A 45 45 CYS C C 45 173.205 173.798 -0.593 1
1 500 . 13 1 1 A 45 45 CYS CA C 45 55.960 56.760 -0.800 1
1 501 . 13 1 1 A 45 45 CYS CB C 45 30.665 31.112 -0.447 1
1 502 . 13 1 1 A 45 45 CYS N N 45 115.140 118.821 -3.681 1
1 503 . 13 1 1 A 46 46 ARG H H 46 9.165 8.501 0.664 1
1 504 . 13 1 1 A 46 46 ARG HA H 46 4.068 3.622 0.446 1
1 511 . 13 1 1 A 46 46 ARG C C 46 178.440 177.584 0.856 1
1 512 . 13 1 1 A 46 46 ARG CA C 46 56.401 56.013 0.388 1
1 513 . 13 1 1 A 46 46 ARG CB C 46 31.878 30.559 1.319 1
1 516 . 13 1 1 A 46 46 ARG N N 46 121.803 121.396 0.407 1
1 517 . 13 1 1 A 47 47 ALA H H 47 8.273 8.757 -0.484 1
1 518 . 13 1 1 A 47 47 ALA HA H 47 3.891 3.948 -0.057 1
1 522 . 13 1 1 A 47 47 ALA C C 47 177.599 177.713 -0.114 1
1 523 . 13 1 1 A 47 47 ALA CA C 47 54.796 54.310 0.486 1
1 524 . 13 1 1 A 47 47 ALA CB C 47 18.287 18.541 -0.254 1
1 525 . 13 1 1 A 47 47 ALA N N 47 123.895 124.425 -0.530 1
1 526 . 13 1 1 A 48 48 ASP H H 48 8.036 7.889 0.147 1
1 527 . 13 1 1 A 48 48 ASP HA H 48 4.453 4.724 -0.271 1
1 530 . 13 1 1 A 48 48 ASP C C 48 175.836 176.024 -0.188 1
1 531 . 13 1 1 A 48 48 ASP CA C 48 53.368 53.523 -0.155 1
1 532 . 13 1 1 A 48 48 ASP CB C 48 39.964 41.336 -1.372 1
1 533 . 13 1 1 A 48 48 ASP N N 48 112.576 116.994 -4.418 1
1 534 . 13 1 1 A 49 49 GLU H H 49 7.495 7.664 -0.169 1
1 535 . 13 1 1 A 49 49 GLU HA H 49 4.308 4.457 -0.149 1
1 540 . 13 1 1 A 49 49 GLU C C 49 175.756 175.808 -0.052 1
1 541 . 13 1 1 A 49 49 GLU CA C 49 56.224 55.303 0.921 1
1 542 . 13 1 1 A 49 49 GLU CB C 49 32.248 30.821 1.427 1
1 544 . 13 1 1 A 49 49 GLU N N 49 120.609 119.312 1.297 1
1 545 . 13 1 1 A 50 50 ALA H H 50 8.416 8.480 -0.064 1
1 546 . 13 1 1 A 50 50 ALA HA H 50 4.200 4.447 -0.247 1
1 550 . 13 1 1 A 50 50 ALA C C 50 177.433 176.773 0.660 1
1 551 . 13 1 1 A 50 50 ALA CA C 50 53.297 52.475 0.822 1
1 552 . 13 1 1 A 50 50 ALA CB C 50 19.474 20.513 -1.039 1
1 553 . 13 1 1 A 50 50 ALA N N 50 124.065 124.400 -0.335 1
1 554 . 13 1 1 A 51 51 ARG H H 51 7.648 7.683 -0.035 1
1 555 . 13 1 1 A 51 51 ARG HA H 51 4.747 4.513 0.234 1
1 562 . 13 1 1 A 51 51 ARG C C 51 173.400 173.940 -0.540 1
1 563 . 13 1 1 A 51 51 ARG CA C 51 52.592 52.400 0.192 1
1 564 . 13 1 1 A 51 51 ARG CB C 51 31.212 30.585 0.627 1
1 567 . 13 1 1 A 51 51 ARG N N 51 117.798 117.949 -0.151 1
1 568 . 13 1 1 A 52 52 PRO HA H 52 4.212 4.472 -0.260 1
1 575 . 13 1 1 A 52 52 PRO C C 52 176.380 176.541 -0.161 1
1 576 . 13 1 1 A 52 52 PRO CA C 52 62.360 62.542 -0.182 1
1 577 . 13 1 1 A 52 52 PRO CB C 52 32.331 32.218 0.113 1
1 580 . 13 1 1 A 53 53 ASN H H 53 8.127 7.814 0.313 1
1 581 . 13 1 1 A 53 53 ASN HA H 53 4.651 4.751 -0.100 1
1 586 . 13 1 1 A 53 53 ASN C C 53 174.354 174.532 -0.178 1
1 587 . 13 1 1 A 53 53 ASN CA C 53 53.136 52.626 0.510 1
1 588 . 13 1 1 A 53 53 ASN CB C 53 39.666 38.297 1.369 1
1 589 . 13 1 1 A 53 53 ASN N N 53 119.405 119.926 -0.521 1
1 591 . 13 1 1 A 54 54 THR H H 54 8.425 8.497 -0.072 1
1 592 . 13 1 1 A 54 54 THR HA H 54 5.306 4.525 0.781 1
1 597 . 13 1 1 A 54 54 THR C C 54 173.850 174.267 -0.417 1
1 598 . 13 1 1 A 54 54 THR CA C 54 61.881 62.982 -1.101 1
1 599 . 13 1 1 A 54 54 THR CB C 54 70.573 69.605 0.968 1
1 601 . 13 1 1 A 54 54 THR N N 54 118.968 121.515 -2.547 1
1 602 . 13 1 1 A 55 55 ILE H H 55 9.354 8.261 1.093 1
1 603 . 13 1 1 A 55 55 ILE HA H 55 4.051 4.499 -0.448 1
1 613 . 13 1 1 A 55 55 ILE C C 55 172.975 173.381 -0.406 1
1 614 . 13 1 1 A 55 55 ILE CA C 55 61.003 59.781 1.222 1
1 615 . 13 1 1 A 55 55 ILE CB C 55 41.619 42.106 -0.487 1
1 619 . 13 1 1 A 55 55 ILE N N 55 127.961 125.873 2.088 1
1 620 . 13 1 1 A 56 56 ASP H H 56 8.132 8.733 -0.601 1
1 621 . 13 1 1 A 56 56 ASP HA H 56 5.334 5.262 0.072 1
1 624 . 13 1 1 A 56 56 ASP C C 56 174.969 174.639 0.330 1
1 625 . 13 1 1 A 56 56 ASP CA C 56 53.702 52.807 0.895 1
1 626 . 13 1 1 A 56 56 ASP CB C 56 43.251 42.975 0.276 1
1 627 . 13 1 1 A 56 56 ASP N N 56 125.882 127.207 -1.325 1
1 628 . 13 1 1 A 57 57 PHE H H 57 8.955 8.720 0.235 1
1 629 . 13 1 1 A 57 57 PHE HA H 57 4.915 5.074 -0.159 1
1 637 . 13 1 1 A 57 57 PHE C C 57 177.361 175.632 1.729 1
1 638 . 13 1 1 A 57 57 PHE CA C 57 57.458 56.534 0.924 1
1 639 . 13 1 1 A 57 57 PHE CB C 57 43.737 43.218 0.519 1
1 645 . 13 1 1 A 57 57 PHE N N 57 118.872 123.078 -4.206 1
1 646 . 13 1 1 A 58 58 GLY H H 58 9.552 9.159 0.393 1
1 647 . 13 1 1 A 58 58 GLY HA2 H 58 4.662 4.091 0.571 1
1 648 . 13 1 1 A 58 58 GLY HA3 H 58 4.126 4.166 -0.040 1
1 649 . 13 1 1 A 58 58 GLY C C 58 174.760 174.974 -0.214 1
1 650 . 13 1 1 A 58 58 GLY CA C 58 44.680 44.975 -0.295 1
1 651 . 13 1 1 A 58 58 GLY N N 58 111.551 110.237 1.314 1
1 652 . 13 1 1 A 59 59 LYS H H 59 8.211 8.700 -0.489 1
1 653 . 13 1 1 A 59 59 LYS HA H 59 3.782 3.683 0.099 1
1 662 . 13 1 1 A 59 59 LYS C C 59 176.154 178.337 -2.183 1
1 663 . 13 1 1 A 59 59 LYS CA C 59 59.080 58.385 0.695 1
1 664 . 13 1 1 A 59 59 LYS CB C 59 32.516 31.925 0.591 1
1 668 . 13 1 1 A 59 59 LYS N N 59 115.953 120.043 -4.090 1
1 669 . 13 1 1 A 60 60 ASP H H 60 8.634 7.993 0.641 1
1 670 . 13 1 1 A 60 60 ASP HA H 60 4.882 4.468 0.414 1
1 673 . 13 1 1 A 60 60 ASP C C 60 176.039 175.946 0.093 1
1 674 . 13 1 1 A 60 60 ASP CA C 60 54.327 56.911 -2.584 1
1 675 . 13 1 1 A 60 60 ASP CB C 60 41.461 41.007 0.454 1
1 676 . 13 1 1 A 60 60 ASP N N 60 117.261 120.184 -2.923 1
1 677 . 13 1 1 A 61 61 ASP H H 61 7.500 8.118 -0.618 1
1 678 . 13 1 1 A 61 61 ASP HA H 61 4.591 4.726 -0.135 1
1 681 . 13 1 1 A 61 61 ASP C C 61 175.140 175.912 -0.772 1
1 682 . 13 1 1 A 61 61 ASP CA C 61 55.342 54.052 1.290 1
1 683 . 13 1 1 A 61 61 ASP CB C 61 42.475 40.228 2.247 1
1 684 . 13 1 1 A 61 61 ASP N N 61 122.319 119.309 3.010 1
1 685 . 13 1 1 A 62 62 GLN H H 62 8.239 7.919 0.320 1
1 686 . 13 1 1 A 62 62 GLN HA H 62 2.569 3.847 -1.278 1
1 693 . 13 1 1 A 62 62 GLN C C 62 172.652 173.692 -1.040 1
1 694 . 13 1 1 A 62 62 GLN CA C 62 54.038 55.672 -1.634 1
1 695 . 13 1 1 A 62 62 GLN CB C 62 31.481 29.434 2.047 1
1 697 . 13 1 1 A 62 62 GLN N N 62 117.458 123.496 -6.038 1
1 699 . 13 1 1 A 63 63 HIS H H 63 6.338 6.772 -0.434 1
1 700 . 13 1 1 A 63 63 HIS HA H 63 4.423 4.312 0.111 1
1 704 . 13 1 1 A 63 63 HIS C C 63 173.031 172.625 0.406 1
1 705 . 13 1 1 A 63 63 HIS CA C 63 54.743 54.056 0.687 1
1 706 . 13 1 1 A 63 63 HIS CB C 63 32.661 31.443 1.218 1
1 708 . 13 1 1 A 63 63 HIS N N 63 113.589 116.082 -2.493 1
1 709 . 13 1 1 A 64 64 PHE H H 64 8.549 8.997 -0.448 1
1 710 . 13 1 1 A 64 64 PHE HA H 64 4.578 5.098 -0.520 1
1 718 . 13 1 1 A 64 64 PHE C C 64 173.015 173.432 -0.417 1
1 719 . 13 1 1 A 64 64 PHE CA C 64 58.516 57.139 1.377 1
1 720 . 13 1 1 A 64 64 PHE CB C 64 43.525 43.107 0.418 1
1 726 . 13 1 1 A 64 64 PHE N N 64 118.214 119.788 -1.574 1
1 727 . 13 1 1 A 65 65 THR H H 65 7.150 8.009 -0.859 1
1 728 . 13 1 1 A 65 65 THR HA H 65 4.930 4.732 0.198 1
1 733 . 13 1 1 A 65 65 THR C C 65 172.457 173.176 -0.719 1
1 734 . 13 1 1 A 65 65 THR CA C 65 61.690 61.643 0.047 1
1 735 . 13 1 1 A 65 65 THR CB C 65 69.593 69.462 0.131 1
1 737 . 13 1 1 A 65 65 THR N N 65 123.198 119.578 3.620 1
1 738 . 13 1 1 A 66 66 VAL H H 66 8.888 8.523 0.365 1
1 739 . 13 1 1 A 66 66 VAL HA H 66 4.018 4.773 -0.755 1
1 747 . 13 1 1 A 66 66 VAL C C 66 174.868 175.329 -0.461 1
1 748 . 13 1 1 A 66 66 VAL CA C 66 61.178 60.528 0.650 1
1 749 . 13 1 1 A 66 66 VAL CB C 66 33.114 33.186 -0.072 1
1 752 . 13 1 1 A 66 66 VAL N N 66 126.840 128.451 -1.611 1
1 753 . 13 1 1 A 67 67 THR H H 67 8.174 8.509 -0.335 1
1 754 . 13 1 1 A 67 67 THR HA H 67 4.816 5.017 -0.201 1
1 759 . 13 1 1 A 67 67 THR C C 67 174.494 174.268 0.226 1
1 760 . 13 1 1 A 67 67 THR CA C 67 59.786 59.539 0.247 1
1 761 . 13 1 1 A 67 67 THR CB C 67 70.887 71.658 -0.771 1
1 763 . 13 1 1 A 67 67 THR N N 67 116.127 117.249 -1.122 1
1 764 . 13 1 1 A 68 68 GLY H H 68 8.570 8.692 -0.122 1
1 765 . 13 1 1 A 68 68 GLY HA2 H 68 3.970 3.999 -0.029 1
1 766 . 13 1 1 A 68 68 GLY HA3 H 68 3.819 4.017 -0.198 1
1 767 . 13 1 1 A 68 68 GLY C C 68 175.636 174.643 0.993 1
1 768 . 13 1 1 A 68 68 GLY CA C 68 46.397 45.130 1.267 1
1 769 . 13 1 1 A 68 68 GLY N N 68 107.146 113.019 -5.873 1
1 770 . 13 1 1 A 69 69 LEU H H 69 8.007 7.495 0.512 1
1 771 . 13 1 1 A 69 69 LEU HA H 69 4.154 4.229 -0.075 1
1 781 . 13 1 1 A 69 69 LEU C C 69 176.830 176.387 0.443 1
1 782 . 13 1 1 A 69 69 LEU CA C 69 54.602 54.898 -0.296 1
1 783 . 13 1 1 A 69 69 LEU CB C 69 41.149 41.844 -0.695 1
1 787 . 13 1 1 A 69 69 LEU N N 69 118.433 123.019 -4.586 1
1 788 . 13 1 1 A 70 70 HIS H H 70 8.866 8.774 0.092 1
1 789 . 13 1 1 A 70 70 HIS HA H 70 4.663 4.590 0.073 1
1 793 . 13 1 1 A 70 70 HIS C C 70 176.667 175.797 0.870 1
1 794 . 13 1 1 A 70 70 HIS CA C 70 55.464 57.359 -1.895 1
1 795 . 13 1 1 A 70 70 HIS CB C 70 32.125 30.191 1.934 1
1 797 . 13 1 1 A 70 70 HIS N N 70 122.457 122.631 -0.174 1
1 798 . 13 1 1 A 71 71 LYS H H 71 8.716 8.589 0.127 1
1 799 . 13 1 1 A 71 71 LYS HA H 71 4.320 4.156 0.164 1
1 808 . 13 1 1 A 71 71 LYS C C 71 178.110 176.783 1.327 1
1 809 . 13 1 1 A 71 71 LYS CA C 71 57.035 56.397 0.638 1
1 810 . 13 1 1 A 71 71 LYS CB C 71 33.580 32.913 0.667 1
1 814 . 13 1 1 A 71 71 LYS N N 71 123.173 123.645 -0.472 1
1 815 . 13 1 1 A 72 72 GLY H H 72 7.709 8.784 -1.075 1
1 816 . 13 1 1 A 72 72 GLY HA2 H 72 3.800 3.929 -0.129 1
1 817 . 13 1 1 A 72 72 GLY HA3 H 72 3.769 3.933 -0.164 1
1 818 . 13 1 1 A 72 72 GLY C C 72 174.231 173.892 0.339 1
1 819 . 13 1 1 A 72 72 GLY CA C 72 47.866 46.336 1.530 1
1 820 . 13 1 1 A 72 72 GLY N N 72 114.881 111.039 3.842 1
1 821 . 13 1 1 A 73 73 THR H H 73 8.162 7.688 0.474 1
1 822 . 13 1 1 A 73 73 THR HA H 73 4.584 4.700 -0.116 1
1 827 . 13 1 1 A 73 73 THR C C 73 172.208 173.480 -1.272 1
1 828 . 13 1 1 A 73 73 THR CA C 73 62.307 61.252 1.055 1
1 829 . 13 1 1 A 73 73 THR CB C 73 72.123 71.937 0.186 1
1 831 . 13 1 1 A 73 73 THR N N 73 114.225 114.566 -0.341 1
1 832 . 13 1 1 A 74 74 THR H H 74 8.743 8.749 -0.006 1
1 833 . 13 1 1 A 74 74 THR HA H 74 5.138 4.970 0.168 1
1 838 . 13 1 1 A 74 74 THR C C 74 173.376 173.424 -0.048 1
1 839 . 13 1 1 A 74 74 THR CA C 74 62.724 62.979 -0.255 1
1 840 . 13 1 1 A 74 74 THR CB C 74 69.202 69.761 -0.559 1
1 842 . 13 1 1 A 74 74 THR N N 74 123.376 121.105 2.271 1
1 843 . 13 1 1 A 75 75 TYR H H 75 9.549 9.192 0.357 1
1 844 . 13 1 1 A 75 75 TYR HA H 75 4.892 5.209 -0.317 1
1 851 . 13 1 1 A 75 75 TYR C C 75 173.991 175.272 -1.281 1
1 852 . 13 1 1 A 75 75 TYR CA C 75 57.740 55.969 1.771 1
1 853 . 13 1 1 A 75 75 TYR CB C 75 44.580 43.371 1.209 1
1 858 . 13 1 1 A 75 75 TYR N N 75 126.916 124.112 2.804 1
1 859 . 13 1 1 A 76 76 ILE H H 76 8.769 8.836 -0.067 1
1 860 . 13 1 1 A 76 76 ILE HA H 76 4.663 4.928 -0.265 1
1 870 . 13 1 1 A 76 76 ILE C C 76 174.683 175.283 -0.600 1
1 871 . 13 1 1 A 76 76 ILE CA C 76 60.455 60.741 -0.286 1
1 872 . 13 1 1 A 76 76 ILE CB C 76 40.284 39.983 0.301 1
1 876 . 13 1 1 A 76 76 ILE N N 76 119.407 120.768 -1.361 1
1 877 . 13 1 1 A 77 77 PHE H H 77 8.894 8.997 -0.103 1
1 878 . 13 1 1 A 77 77 PHE HA H 77 5.160 5.127 0.033 1
1 886 . 13 1 1 A 77 77 PHE C C 77 174.794 175.485 -0.691 1
1 887 . 13 1 1 A 77 77 PHE CA C 77 56.831 57.498 -0.667 1
1 888 . 13 1 1 A 77 77 PHE CB C 77 43.132 41.073 2.059 1
1 894 . 13 1 1 A 77 77 PHE N N 77 124.622 127.140 -2.518 1
1 895 . 13 1 1 A 78 78 ARG H H 78 9.407 9.132 0.275 1
1 896 . 13 1 1 A 78 78 ARG HA H 78 5.689 5.690 -0.001 1
1 904 . 13 1 1 A 78 78 ARG C C 78 174.376 174.724 -0.348 1
1 905 . 13 1 1 A 78 78 ARG CA C 78 54.530 54.638 -0.108 1
1 906 . 13 1 1 A 78 78 ARG CB C 78 34.473 34.229 0.244 1
1 909 . 13 1 1 A 78 78 ARG N N 78 120.055 120.989 -0.934 1
1 911 . 13 1 1 A 79 79 LEU H H 79 9.132 8.557 0.575 1
1 912 . 13 1 1 A 79 79 LEU HA H 79 5.398 5.077 0.321 1
1 922 . 13 1 1 A 79 79 LEU C C 79 174.006 174.320 -0.314 1
1 923 . 13 1 1 A 79 79 LEU CA C 79 53.401 53.343 0.058 1
1 924 . 13 1 1 A 79 79 LEU CB C 79 48.116 46.451 1.665 1
1 928 . 13 1 1 A 79 79 LEU N N 79 124.907 123.999 0.908 1
1 929 . 13 1 1 A 80 80 ALA H H 80 8.737 7.925 0.812 1
1 930 . 13 1 1 A 80 80 ALA HA H 80 4.871 4.925 -0.054 1
1 934 . 13 1 1 A 80 80 ALA C C 80 176.057 175.793 0.264 1
1 935 . 13 1 1 A 80 80 ALA CA C 80 50.353 51.355 -1.002 1
1 936 . 13 1 1 A 80 80 ALA CB C 80 23.972 23.163 0.809 1
1 937 . 13 1 1 A 80 80 ALA N N 80 128.220 125.340 2.880 1
1 938 . 13 1 1 A 81 81 ALA H H 81 9.890 8.599 1.291 1
1 939 . 13 1 1 A 81 81 ALA HA H 81 4.794 5.038 -0.244 1
1 943 . 13 1 1 A 81 81 ALA C C 81 174.655 176.060 -1.405 1
1 944 . 13 1 1 A 81 81 ALA CA C 81 50.300 51.048 -0.748 1
1 945 . 13 1 1 A 81 81 ALA CB C 81 21.369 20.677 0.692 1
1 946 . 13 1 1 A 81 81 ALA N N 81 123.682 123.532 0.150 1
1 947 . 13 1 1 A 82 82 LYS H H 82 7.965 8.649 -0.684 1
1 948 . 13 1 1 A 82 82 LYS HA H 82 4.974 5.200 -0.226 1
1 957 . 13 1 1 A 82 82 LYS C C 82 175.671 175.155 0.516 1
1 958 . 13 1 1 A 82 82 LYS CA C 82 54.664 54.773 -0.109 1
1 959 . 13 1 1 A 82 82 LYS CB C 82 36.677 35.613 1.064 1
1 963 . 13 1 1 A 82 82 LYS N N 82 118.164 122.338 -4.174 1
1 964 . 13 1 1 A 83 83 ASN H H 83 8.663 8.657 0.006 1
1 965 . 13 1 1 A 83 83 ASN HA H 83 5.113 5.069 0.044 1
1 970 . 13 1 1 A 83 83 ASN C C 83 176.582 175.955 0.627 1
1 971 . 13 1 1 A 83 83 ASN CA C 83 51.746 50.731 1.015 1
1 972 . 13 1 1 A 83 83 ASN CB C 83 40.357 40.109 0.248 1
1 973 . 13 1 1 A 83 83 ASN N N 83 124.784 124.296 0.488 1
1 975 . 13 1 1 A 84 84 ARG H H 84 8.873 8.844 0.029 1
1 976 . 13 1 1 A 84 84 ARG HA H 84 3.940 3.931 0.009 1
1 983 . 13 1 1 A 84 84 ARG C C 84 176.735 177.875 -1.140 1
1 984 . 13 1 1 A 84 84 ARG CA C 84 59.327 59.657 -0.330 1
1 985 . 13 1 1 A 84 84 ARG CB C 84 29.282 29.869 -0.587 1
1 988 . 13 1 1 A 84 84 ARG N N 84 117.891 119.976 -2.085 1
1 989 . 13 1 1 A 85 85 ALA H H 85 7.645 7.807 -0.162 1
1 990 . 13 1 1 A 85 85 ALA HA H 85 4.276 4.205 0.071 1
1 994 . 13 1 1 A 85 85 ALA C C 85 177.479 177.308 0.171 1
1 995 . 13 1 1 A 85 85 ALA CA C 85 52.818 52.984 -0.166 1
1 996 . 13 1 1 A 85 85 ALA CB C 85 18.806 19.455 -0.649 1
1 997 . 13 1 1 A 85 85 ALA N N 85 120.306 119.803 0.503 1
1 998 . 13 1 1 A 86 86 GLY H H 86 7.693 7.608 0.085 1
1 999 . 13 1 1 A 86 86 GLY HA2 H 86 4.456 4.066 0.390 1
1 1000 . 13 1 1 A 86 86 GLY HA3 H 86 3.649 4.070 -0.421 1
1 1001 . 13 1 1 A 86 86 GLY C C 86 172.068 172.558 -0.490 1
1 1002 . 13 1 1 A 86 86 GLY CA C 86 44.375 43.963 0.412 1
1 1003 . 13 1 1 A 86 86 GLY N N 86 106.594 103.714 2.880 1
1 1004 . 13 1 1 A 87 87 LEU H H 87 8.203 8.511 -0.308 1
1 1005 . 13 1 1 A 87 87 LEU HA H 87 4.629 4.644 -0.015 1
1 1015 . 13 1 1 A 87 87 LEU C C 87 179.155 176.535 2.620 1
1 1016 . 13 1 1 A 87 87 LEU CA C 87 54.814 55.404 -0.590 1
1 1017 . 13 1 1 A 87 87 LEU CB C 87 43.454 42.520 0.934 1
1 1021 . 13 1 1 A 87 87 LEU N N 87 120.879 122.426 -1.547 1
1 1022 . 13 1 1 A 88 88 GLY H H 88 8.492 8.198 0.294 1
1 1023 . 13 1 1 A 88 88 GLY HA2 H 88 4.339 4.148 0.191 1
1 1024 . 13 1 1 A 88 88 GLY HA3 H 88 4.122 4.153 -0.031 1
1 1025 . 13 1 1 A 88 88 GLY C C 88 173.030 173.460 -0.430 1
1 1026 . 13 1 1 A 88 88 GLY CA C 88 43.970 44.666 -0.696 1
1 1027 . 13 1 1 A 88 88 GLY N N 88 109.903 110.613 -0.710 1
1 1028 . 13 1 1 A 89 89 GLU H H 89 7.638 8.957 -1.319 1
1 1029 . 13 1 1 A 89 89 GLU HA H 89 4.103 4.356 -0.253 1
1 1034 . 13 1 1 A 89 89 GLU C C 89 177.511 175.750 1.761 1
1 1035 . 13 1 1 A 89 89 GLU CA C 89 56.659 56.787 -0.128 1
1 1036 . 13 1 1 A 89 89 GLU CB C 89 31.324 30.873 0.451 1
1 1038 . 13 1 1 A 89 89 GLU N N 89 117.551 122.392 -4.841 1
1 1039 . 13 1 1 A 90 90 GLU H H 90 8.734 9.108 -0.374 1
1 1040 . 13 1 1 A 90 90 GLU HA H 90 4.651 5.387 -0.736 1
1 1045 . 13 1 1 A 90 90 GLU C C 90 177.452 174.264 3.188 1
1 1046 . 13 1 1 A 90 90 GLU CA C 90 55.987 54.664 1.323 1
1 1047 . 13 1 1 A 90 90 GLU CB C 90 31.135 33.380 -2.245 1
1 1049 . 13 1 1 A 90 90 GLU N N 90 121.553 118.043 3.510 1
1 1050 . 13 1 1 A 91 91 PHE H H 91 9.411 9.005 0.406 1
1 1051 . 13 1 1 A 91 91 PHE HA H 91 4.665 5.102 -0.437 1
1 1059 . 13 1 1 A 91 91 PHE C C 91 173.944 174.366 -0.422 1
1 1060 . 13 1 1 A 91 91 PHE CA C 91 57.687 57.533 0.154 1
1 1061 . 13 1 1 A 91 91 PHE CB C 91 40.890 42.015 -1.125 1
1 1067 . 13 1 1 A 91 91 PHE N N 91 125.459 125.077 0.382 1
1 1068 . 13 1 1 A 92 92 GLU H H 92 8.043 8.294 -0.251 1
1 1069 . 13 1 1 A 92 92 GLU HA H 92 5.424 5.352 0.072 1
1 1074 . 13 1 1 A 92 92 GLU C C 92 174.295 174.463 -0.168 1
1 1075 . 13 1 1 A 92 92 GLU CA C 92 54.378 54.687 -0.309 1
1 1076 . 13 1 1 A 92 92 GLU CB C 92 33.662 33.493 0.169 1
1 1078 . 13 1 1 A 92 92 GLU N N 92 128.905 127.227 1.678 1
1 1079 . 13 1 1 A 93 93 LYS H H 93 9.142 8.529 0.613 1
1 1080 . 13 1 1 A 93 93 LYS HA H 93 4.541 5.098 -0.557 1
1 1089 . 13 1 1 A 93 93 LYS C C 93 173.366 173.908 -0.542 1
1 1090 . 13 1 1 A 93 93 LYS CA C 93 55.343 55.659 -0.316 1
1 1091 . 13 1 1 A 93 93 LYS CB C 93 37.317 36.302 1.015 1
1 1095 . 13 1 1 A 93 93 LYS N N 93 125.231 126.794 -1.563 1
1 1096 . 13 1 1 A 94 94 GLU H H 94 8.655 9.219 -0.564 1
1 1097 . 13 1 1 A 94 94 GLU HA H 94 5.558 5.493 0.065 1
1 1102 . 13 1 1 A 94 94 GLU C C 94 176.238 175.621 0.617 1
1 1103 . 13 1 1 A 94 94 GLU CA C 94 54.632 55.055 -0.423 1
1 1104 . 13 1 1 A 94 94 GLU CB C 94 32.166 32.937 -0.771 1
1 1106 . 13 1 1 A 94 94 GLU N N 94 127.232 127.791 -0.559 1
1 1107 . 13 1 1 A 95 95 ILE H H 95 9.302 8.830 0.472 1
1 1108 . 13 1 1 A 95 95 ILE HA H 95 4.794 5.207 -0.413 1
1 1118 . 13 1 1 A 95 95 ILE C C 95 173.138 174.397 -1.259 1
1 1119 . 13 1 1 A 95 95 ILE CA C 95 58.570 58.252 0.318 1
1 1120 . 13 1 1 A 95 95 ILE CB C 95 42.420 42.844 -0.424 1
1 1124 . 13 1 1 A 95 95 ILE N N 95 120.711 120.948 -0.237 1
1 1125 . 13 1 1 A 96 96 ARG H H 96 8.589 8.771 -0.182 1
1 1126 . 13 1 1 A 96 96 ARG HA H 96 5.373 4.775 0.598 1
1 1133 . 13 1 1 A 96 96 ARG C C 96 177.147 175.101 2.046 1
1 1134 . 13 1 1 A 96 96 ARG CA C 96 54.045 55.180 -1.135 1
1 1135 . 13 1 1 A 96 96 ARG CB C 96 32.001 33.979 -1.978 1
1 1138 . 13 1 1 A 96 96 ARG N N 96 124.445 121.906 2.539 1
1 1139 . 13 1 1 A 97 97 THR H H 97 9.243 8.536 0.707 1
1 1140 . 13 1 1 A 97 97 THR HA H 97 4.459 4.630 -0.171 1
1 1145 . 13 1 1 A 97 97 THR C C 97 172.745 173.997 -1.252 1
1 1146 . 13 1 1 A 97 97 THR CA C 97 59.637 60.782 -1.145 1
1 1147 . 13 1 1 A 97 97 THR CB C 97 67.687 68.777 -1.090 1
1 1149 . 13 1 1 A 97 97 THR N N 97 119.370 118.450 0.920 1
1 1150 . 13 1 1 A 98 98 PRO HA H 98 4.494 4.775 -0.281 1
1 1157 . 13 1 1 A 98 98 PRO CA C 98 63.117 62.668 0.449 1
1 1158 . 13 1 1 A 98 98 PRO CB C 98 32.500 31.926 0.574 1
1 1161 . 13 1 1 A 99 99 GLU H H 99 8.534 8.410 0.124 1
1 1162 . 13 1 1 A 99 99 GLU HA H 99 4.195 4.500 -0.305 1
1 1167 . 13 1 1 A 99 99 GLU C C 99 175.881 174.879 1.002 1
1 1168 . 13 1 1 A 99 99 GLU CA C 99 56.330 55.846 0.484 1
1 1169 . 13 1 1 A 99 99 GLU CB C 99 31.062 30.994 0.068 1
1 1171 . 13 1 1 A 99 99 GLU N N 99 119.688 118.707 0.981 1
1 1172 . 13 1 1 A 100 100 ASP H H 100 8.536 8.587 -0.051 1
1 1173 . 13 1 1 A 100 100 ASP HA H 100 4.607 5.107 -0.500 1
1 1176 . 13 1 1 A 100 100 ASP C C 100 176.012 174.714 1.298 1
1 1177 . 13 1 1 A 100 100 ASP CA C 100 54.109 53.432 0.677 1
1 1178 . 13 1 1 A 100 100 ASP CB C 100 41.562 42.725 -1.163 1
1 1179 . 13 1 1 A 100 100 ASP N N 100 119.803 122.481 -2.678 1
1 1180 . 13 1 1 A 101 101 LEU H H 101 8.403 8.582 -0.179 1
1 1181 . 13 1 1 A 101 101 LEU HA H 101 4.426 4.926 -0.500 1
1 1191 . 13 1 1 A 101 101 LEU C C 101 177.534 175.323 2.211 1
1 1192 . 13 1 1 A 101 101 LEU CA C 101 55.113 53.975 1.138 1
1 1193 . 13 1 1 A 101 101 LEU CB C 101 42.156 43.695 -1.539 1
1 1197 . 13 1 1 A 101 101 LEU N N 101 123.876 126.615 -2.739 1
1 1198 . 13 1 1 A 102 102 SER H H 102 8.413 8.695 -0.282 1
1 1199 . 13 1 1 A 102 102 SER HA H 102 4.434 4.972 -0.538 1
1 1202 . 13 1 1 A 102 102 SER C C 102 174.674 172.888 1.786 1
1 1203 . 13 1 1 A 102 102 SER CA C 102 58.798 57.978 0.820 1
1 1204 . 13 1 1 A 102 102 SER CB C 102 63.854 65.325 -1.471 1
1 1205 . 13 1 1 A 102 102 SER N N 102 116.667 119.594 -2.927 1
1 1206 . 13 1 1 A 103 103 GLY H H 103 8.213 8.975 -0.762 1
1 1207 . 13 1 1 A 103 103 GLY HA2 H 103 4.164 4.361 -0.197 1
1 1208 . 13 1 1 A 103 103 GLY HA3 H 103 4.057 4.361 -0.304 1
1 1209 . 13 1 1 A 103 103 GLY C C 103 171.822 174.095 -2.273 1
1 1210 . 13 1 1 A 103 103 GLY CA C 103 44.658 43.760 0.898 1
1 1211 . 13 1 1 A 103 103 GLY N N 103 110.592 114.671 -4.079 1
1 1212 . 13 1 1 A 104 104 PRO HA H 104 4.475 4.308 0.167 1
1 1219 . 13 1 1 A 104 104 PRO C C 104 177.445 178.329 -0.884 1
1 1220 . 13 1 1 A 104 104 PRO CA C 104 63.312 65.108 -1.796 1
1 1221 . 13 1 1 A 104 104 PRO CB C 104 32.190 32.118 0.072 1
1 1224 . 13 1 1 A 105 105 SER H H 105 8.538 8.247 0.291 1
1 1225 . 13 1 1 A 105 105 SER HA H 105 4.541 4.228 0.313 1
1 1228 . 13 1 1 A 105 105 SER C C 105 174.616 175.024 -0.408 1
1 1229 . 13 1 1 A 105 105 SER CA C 105 58.270 61.312 -3.042 1
1 1230 . 13 1 1 A 105 105 SER CB C 105 63.895 62.739 1.156 1
1 1231 . 13 1 1 A 105 105 SER N N 105 116.446 111.785 4.661 1
1 1232 . 13 1 1 A 106 106 SER H H 106 8.350 7.800 0.550 1
1 1233 . 13 1 1 A 106 106 SER HA H 106 4.541 4.551 -0.010 1
1 1236 . 13 1 1 A 106 106 SER C C 106 174.530 174.422 0.108 1
1 1237 . 13 1 1 A 106 106 SER CA C 106 58.357 57.395 0.962 1
1 1238 . 13 1 1 A 106 106 SER CB C 106 64.020 64.781 -0.761 1
1 1239 . 13 1 1 A 106 106 SER N N 106 117.448 113.442 4.006 1
1 1 . 14 1 1 A 2 2 SER C C 2 174.723 173.623 1.100 1
1 2 . 14 1 1 A 2 2 SER CA C 2 58.446 57.616 0.830 1
1 3 . 14 1 1 A 2 2 SER CB C 2 63.566 63.101 0.465 1
1 4 . 14 1 1 A 3 3 SER H H 3 8.350 8.924 -0.574 1
1 5 . 14 1 1 A 3 3 SER C C 3 173.961 174.342 -0.381 1
1 6 . 14 1 1 A 3 3 SER CA C 3 58.428 57.618 0.810 1
1 7 . 14 1 1 A 3 3 SER CB C 3 63.937 64.735 -0.798 1
1 8 . 14 1 1 A 3 3 SER N N 3 117.923 124.485 -6.562 1
1 9 . 14 1 1 A 4 4 GLY H H 4 8.050 8.403 -0.353 1
1 10 . 14 1 1 A 4 4 GLY C C 4 179.009 172.210 6.799 1
1 11 . 14 1 1 A 4 4 GLY CA C 4 46.174 45.867 0.307 1
1 12 . 14 1 1 A 4 4 GLY N N 4 116.890 110.685 6.205 1
1 13 . 14 1 1 A 7 7 GLY HA2 H 7 4.340 4.324 0.016 1
1 14 . 14 1 1 A 7 7 GLY HA3 H 7 3.629 4.327 -0.698 1
1 15 . 14 1 1 A 7 7 GLY CA C 7 44.381 44.228 0.153 1
1 16 . 14 1 1 A 8 8 PRO HA H 8 4.476 4.479 -0.003 1
1 23 . 14 1 1 A 8 8 PRO C C 8 176.235 177.164 -0.929 1
1 24 . 14 1 1 A 8 8 PRO CA C 8 62.995 62.628 0.367 1
1 25 . 14 1 1 A 8 8 PRO CB C 8 33.266 32.509 0.757 1
1 28 . 14 1 1 A 9 9 GLY H H 9 8.585 8.343 0.242 1
1 29 . 14 1 1 A 9 9 GLY HA2 H 9 4.326 4.121 0.205 1
1 30 . 14 1 1 A 9 9 GLY HA3 H 9 4.009 4.121 -0.112 1
1 31 . 14 1 1 A 9 9 GLY C C 9 172.998 173.113 -0.115 1
1 32 . 14 1 1 A 9 9 GLY CA C 9 44.393 44.309 0.084 1
1 33 . 14 1 1 A 9 9 GLY N N 9 106.004 107.688 -1.684 1
1 34 . 14 1 1 A 10 10 ARG H H 10 8.548 8.578 -0.030 1
1 35 . 14 1 1 A 10 10 ARG HA H 10 4.654 5.173 -0.519 1
1 41 . 14 1 1 A 10 10 ARG C C 10 175.780 174.518 1.262 1
1 42 . 14 1 1 A 10 10 ARG CA C 10 54.708 53.867 0.841 1
1 43 . 14 1 1 A 10 10 ARG CB C 10 31.448 32.749 -1.301 1
1 45 . 14 1 1 A 10 10 ARG N N 10 119.407 118.606 0.801 1
1 46 . 14 1 1 A 11 11 PRO HA H 11 4.611 4.552 0.059 1
1 53 . 14 1 1 A 11 11 PRO C C 11 173.510 175.389 -1.879 1
1 54 . 14 1 1 A 11 11 PRO CA C 11 62.360 62.605 -0.245 1
1 55 . 14 1 1 A 11 11 PRO CB C 11 33.402 32.392 1.010 1
1 58 . 14 1 1 A 12 12 THR H H 12 7.572 8.633 -1.061 1
1 59 . 14 1 1 A 12 12 THR HA H 12 3.796 4.184 -0.388 1
1 64 . 14 1 1 A 12 12 THR C C 12 172.337 173.288 -0.951 1
1 65 . 14 1 1 A 12 12 THR CA C 12 61.778 61.353 0.425 1
1 66 . 14 1 1 A 12 12 THR CB C 12 70.561 68.656 1.905 1
1 68 . 14 1 1 A 12 12 THR N N 12 109.653 116.852 -7.199 1
1 69 . 14 1 1 A 13 13 MET H H 13 5.605 8.547 -2.942 1
1 70 . 14 1 1 A 13 13 MET HA H 13 5.091 5.000 0.091 1
1 78 . 14 1 1 A 13 13 MET C C 13 172.639 175.046 -2.407 1
1 79 . 14 1 1 A 13 13 MET CA C 13 54.168 54.090 0.078 1
1 80 . 14 1 1 A 13 13 MET CB C 13 37.632 34.701 2.931 1
1 83 . 14 1 1 A 13 13 MET N N 13 121.634 126.966 -5.332 1
1 84 . 14 1 1 A 14 14 MET H H 14 9.254 9.228 0.026 1
1 85 . 14 1 1 A 14 14 MET HA H 14 4.662 5.315 -0.653 1
1 93 . 14 1 1 A 14 14 MET C C 14 174.388 174.939 -0.551 1
1 94 . 14 1 1 A 14 14 MET CA C 14 54.673 54.269 0.404 1
1 95 . 14 1 1 A 14 14 MET CB C 14 34.907 34.828 0.079 1
1 98 . 14 1 1 A 14 14 MET N N 14 125.746 124.427 1.319 1
1 99 . 14 1 1 A 15 15 ILE H H 15 8.555 9.095 -0.540 1
1 100 . 14 1 1 A 15 15 ILE HA H 15 4.882 4.940 -0.058 1
1 110 . 14 1 1 A 15 15 ILE C C 15 174.962 175.106 -0.144 1
1 111 . 14 1 1 A 15 15 ILE CA C 15 60.685 60.664 0.021 1
1 112 . 14 1 1 A 15 15 ILE CB C 15 40.878 39.095 1.783 1
1 116 . 14 1 1 A 15 15 ILE N N 15 121.623 126.113 -4.490 1
1 117 . 14 1 1 A 16 16 SER H H 16 8.703 8.720 -0.017 1
1 118 . 14 1 1 A 16 16 SER HA H 16 4.922 4.998 -0.076 1
1 121 . 14 1 1 A 16 16 SER C C 16 173.860 173.189 0.671 1
1 122 . 14 1 1 A 16 16 SER CA C 16 56.524 57.367 -0.843 1
1 123 . 14 1 1 A 16 16 SER CB C 16 65.004 65.817 -0.813 1
1 124 . 14 1 1 A 16 16 SER N N 16 122.261 124.745 -2.484 1
1 125 . 14 1 1 A 17 17 THR H H 17 8.759 8.624 0.135 1
1 126 . 14 1 1 A 17 17 THR HA H 17 4.885 4.728 0.157 1
1 131 . 14 1 1 A 17 17 THR C C 17 175.018 174.565 0.453 1
1 132 . 14 1 1 A 17 17 THR CA C 17 60.315 61.348 -1.033 1
1 133 . 14 1 1 A 17 17 THR CB C 17 69.799 69.940 -0.141 1
1 135 . 14 1 1 A 17 17 THR N N 17 115.660 116.992 -1.332 1
1 136 . 14 1 1 A 18 18 THR H H 18 8.038 8.395 -0.357 1
1 137 . 14 1 1 A 18 18 THR HA H 18 4.596 4.440 0.156 1
1 142 . 14 1 1 A 18 18 THR CA C 18 60.707 62.179 -1.472 1
1 143 . 14 1 1 A 18 18 THR CB C 18 71.082 69.639 1.443 1
1 145 . 14 1 1 A 18 18 THR N N 18 112.362 115.608 -3.246 1
1 146 . 14 1 1 A 19 19 ALA H H 19 8.545 7.555 0.990 1
1 147 . 14 1 1 A 19 19 ALA HA H 19 4.412 4.431 -0.019 1
1 151 . 14 1 1 A 19 19 ALA C C 19 177.034 177.335 -0.301 1
1 152 . 14 1 1 A 19 19 ALA CA C 19 52.264 51.651 0.613 1
1 153 . 14 1 1 A 19 19 ALA CB C 19 19.292 20.833 -1.541 1
1 154 . 14 1 1 A 19 19 ALA N N 19 119.589 123.465 -3.876 1
1 155 . 14 1 1 A 20 20 MET H H 20 8.145 8.509 -0.364 1
1 156 . 14 1 1 A 20 20 MET HA H 20 4.447 4.228 0.219 1
1 164 . 14 1 1 A 20 20 MET C C 20 175.676 176.566 -0.890 1
1 165 . 14 1 1 A 20 20 MET CA C 20 55.764 54.891 0.873 1
1 166 . 14 1 1 A 20 20 MET CB C 20 31.495 31.940 -0.445 1
1 169 . 14 1 1 A 20 20 MET N N 20 116.950 118.248 -1.298 1
1 170 . 14 1 1 A 21 21 ASN H H 21 8.275 8.990 -0.715 1
1 171 . 14 1 1 A 21 21 ASN HA H 21 4.452 4.332 0.120 1
1 176 . 14 1 1 A 21 21 ASN C C 21 174.100 173.787 0.313 1
1 177 . 14 1 1 A 21 21 ASN CA C 21 54.320 54.431 -0.111 1
1 178 . 14 1 1 A 21 21 ASN CB C 21 37.234 37.267 -0.033 1
1 179 . 14 1 1 A 21 21 ASN N N 21 113.198 118.825 -5.627 1
1 181 . 14 1 1 A 22 22 THR H H 22 7.071 6.972 0.099 1
1 182 . 14 1 1 A 22 22 THR HA H 22 5.218 5.385 -0.167 1
1 187 . 14 1 1 A 22 22 THR C C 22 173.301 173.054 0.247 1
1 188 . 14 1 1 A 22 22 THR CA C 22 59.399 60.509 -1.110 1
1 189 . 14 1 1 A 22 22 THR CB C 22 72.714 71.799 0.915 1
1 191 . 14 1 1 A 22 22 THR N N 22 107.603 107.714 -0.111 1
1 192 . 14 1 1 A 23 23 ALA H H 23 8.687 8.822 -0.135 1
1 193 . 14 1 1 A 23 23 ALA HA H 23 4.925 5.098 -0.173 1
1 197 . 14 1 1 A 23 23 ALA C C 23 174.100 175.535 -1.435 1
1 198 . 14 1 1 A 23 23 ALA CA C 23 50.812 50.120 0.692 1
1 199 . 14 1 1 A 23 23 ALA CB C 23 21.122 21.329 -0.207 1
1 200 . 14 1 1 A 23 23 ALA N N 23 121.937 126.018 -4.081 1
1 201 . 14 1 1 A 24 24 LEU H H 24 8.833 8.836 -0.003 1
1 202 . 14 1 1 A 24 24 LEU HA H 24 4.673 4.672 0.001 1
1 212 . 14 1 1 A 24 24 LEU C C 24 175.140 174.513 0.627 1
1 213 . 14 1 1 A 24 24 LEU CA C 24 54.320 54.611 -0.291 1
1 214 . 14 1 1 A 24 24 LEU CB C 24 42.518 43.356 -0.838 1
1 218 . 14 1 1 A 24 24 LEU N N 24 123.721 126.386 -2.665 1
1 219 . 14 1 1 A 25 25 LEU H H 25 9.176 9.031 0.145 1
1 220 . 14 1 1 A 25 25 LEU HA H 25 5.112 5.092 0.020 1
1 230 . 14 1 1 A 25 25 LEU C C 25 176.414 175.954 0.460 1
1 231 . 14 1 1 A 25 25 LEU CA C 25 54.108 53.289 0.819 1
1 232 . 14 1 1 A 25 25 LEU CB C 25 43.230 43.652 -0.422 1
1 236 . 14 1 1 A 25 25 LEU N N 25 128.589 128.675 -0.086 1
1 237 . 14 1 1 A 26 26 GLN H H 26 8.556 8.882 -0.326 1
1 238 . 14 1 1 A 26 26 GLN HA H 26 4.737 4.939 -0.202 1
1 245 . 14 1 1 A 26 26 GLN C C 26 174.372 174.334 0.038 1
1 246 . 14 1 1 A 26 26 GLN CA C 26 56.365 54.529 1.836 1
1 247 . 14 1 1 A 26 26 GLN CB C 26 33.320 32.009 1.311 1
1 249 . 14 1 1 A 26 26 GLN N N 26 119.630 122.671 -3.041 1
1 251 . 14 1 1 A 27 27 TRP H H 27 8.080 8.215 -0.135 1
1 252 . 14 1 1 A 27 27 TRP HA H 27 5.441 6.143 -0.702 1
1 261 . 14 1 1 A 27 27 TRP CA C 27 55.957 54.733 1.224 1
1 262 . 14 1 1 A 27 27 TRP CB C 27 32.517 32.537 -0.020 1
1 268 . 14 1 1 A 27 27 TRP N N 27 121.276 121.861 -0.585 1
1 270 . 14 1 1 A 28 28 HIS H H 28 8.262 8.777 -0.515 1
1 271 . 14 1 1 A 28 28 HIS HA H 28 4.997 5.545 -0.548 1
1 275 . 14 1 1 A 28 28 HIS CA C 28 53.028 53.278 -0.250 1
1 276 . 14 1 1 A 28 28 HIS CB C 28 32.832 32.758 0.074 1
1 278 . 14 1 1 A 28 28 HIS N N 28 116.245 116.331 -0.086 1
1 279 . 14 1 1 A 29 29 PRO HA H 29 4.984 4.471 0.513 1
1 286 . 14 1 1 A 29 29 PRO CA C 29 61.498 61.912 -0.414 1
1 287 . 14 1 1 A 29 29 PRO CB C 29 30.709 32.328 -1.619 1
1 290 . 14 1 1 A 30 30 PRO HA H 30 4.449 4.509 -0.060 1
1 297 . 14 1 1 A 30 30 PRO C C 30 175.733 176.570 -0.837 1
1 298 . 14 1 1 A 30 30 PRO CA C 30 62.245 62.522 -0.277 1
1 299 . 14 1 1 A 30 30 PRO CB C 30 32.083 32.553 -0.470 1
1 302 . 14 1 1 A 31 31 LYS H H 31 8.403 8.755 -0.352 1
1 303 . 14 1 1 A 31 31 LYS HA H 31 4.084 4.425 -0.341 1
1 312 . 14 1 1 A 31 31 LYS C C 31 177.166 178.344 -1.178 1
1 313 . 14 1 1 A 31 31 LYS CA C 31 57.866 57.766 0.100 1
1 314 . 14 1 1 A 31 31 LYS CB C 31 32.698 33.394 -0.696 1
1 318 . 14 1 1 A 31 31 LYS N N 31 121.693 122.652 -0.959 1
1 319 . 14 1 1 A 32 32 GLU H H 32 8.102 7.724 0.378 1
1 320 . 14 1 1 A 32 32 GLU HA H 32 4.365 4.444 -0.079 1
1 325 . 14 1 1 A 32 32 GLU C C 32 174.248 176.398 -2.150 1
1 326 . 14 1 1 A 32 32 GLU CA C 32 55.448 55.881 -0.433 1
1 327 . 14 1 1 A 32 32 GLU CB C 32 29.405 30.410 -1.005 1
1 329 . 14 1 1 A 32 32 GLU N N 32 118.742 117.116 1.626 1
1 330 . 14 1 1 A 33 33 LEU H H 33 8.420 7.450 0.970 1
1 331 . 14 1 1 A 33 33 LEU HA H 33 4.499 4.598 -0.099 1
1 341 . 14 1 1 A 33 33 LEU C C 33 173.036 175.061 -2.025 1
1 342 . 14 1 1 A 33 33 LEU CA C 33 52.863 52.620 0.243 1
1 343 . 14 1 1 A 33 33 LEU CB C 33 42.535 42.693 -0.158 1
1 347 . 14 1 1 A 33 33 LEU N N 33 125.181 123.804 1.377 1
1 348 . 14 1 1 A 34 34 PRO HA H 34 4.488 4.432 0.056 1
1 355 . 14 1 1 A 34 34 PRO C C 34 177.544 176.985 0.559 1
1 356 . 14 1 1 A 34 34 PRO CA C 34 62.889 63.401 -0.512 1
1 357 . 14 1 1 A 34 34 PRO CB C 34 31.472 31.035 0.437 1
1 360 . 14 1 1 A 35 35 GLY H H 35 8.397 8.498 -0.101 1
1 361 . 14 1 1 A 35 35 GLY HA2 H 35 4.059 4.103 -0.044 1
1 362 . 14 1 1 A 35 35 GLY HA3 H 35 3.716 4.104 -0.388 1
1 363 . 14 1 1 A 35 35 GLY C C 35 173.356 172.204 1.152 1
1 364 . 14 1 1 A 35 35 GLY CA C 35 45.892 44.863 1.029 1
1 365 . 14 1 1 A 35 35 GLY N N 35 110.524 112.233 -1.709 1
1 366 . 14 1 1 A 36 36 GLU H H 36 8.091 8.528 -0.437 1
1 367 . 14 1 1 A 36 36 GLU HA H 36 4.371 5.083 -0.712 1
1 372 . 14 1 1 A 36 36 GLU C C 36 174.864 174.378 0.486 1
1 373 . 14 1 1 A 36 36 GLU CA C 36 55.201 54.587 0.614 1
1 374 . 14 1 1 A 36 36 GLU CB C 36 31.878 32.970 -1.092 1
1 376 . 14 1 1 A 36 36 GLU N N 36 122.202 120.311 1.891 1
1 377 . 14 1 1 A 37 37 LEU H H 37 8.307 8.670 -0.363 1
1 378 . 14 1 1 A 37 37 LEU HA H 37 4.288 4.273 0.015 1
1 388 . 14 1 1 A 37 37 LEU C C 37 176.702 175.957 0.745 1
1 389 . 14 1 1 A 37 37 LEU CA C 37 55.342 55.903 -0.561 1
1 390 . 14 1 1 A 37 37 LEU CB C 37 42.715 42.247 0.468 1
1 394 . 14 1 1 A 37 37 LEU N N 37 123.204 124.350 -1.146 1
1 395 . 14 1 1 A 38 38 LEU H H 38 8.909 8.663 0.246 1
1 396 . 14 1 1 A 38 38 LEU HA H 38 4.640 4.731 -0.091 1
1 406 . 14 1 1 A 38 38 LEU C C 38 177.202 176.135 1.067 1
1 407 . 14 1 1 A 38 38 LEU CA C 38 54.390 54.537 -0.147 1
1 408 . 14 1 1 A 38 38 LEU CB C 38 43.770 43.279 0.491 1
1 412 . 14 1 1 A 38 38 LEU N N 38 123.021 127.262 -4.241 1
1 413 . 14 1 1 A 39 39 GLY H H 39 7.113 6.884 0.229 1
1 414 . 14 1 1 A 39 39 GLY HA2 H 39 4.816 3.572 1.244 1
1 415 . 14 1 1 A 39 39 GLY HA3 H 39 3.276 3.918 -0.642 1
1 416 . 14 1 1 A 39 39 GLY C C 39 169.863 170.401 -0.538 1
1 417 . 14 1 1 A 39 39 GLY CA C 39 44.622 45.254 -0.632 1
1 418 . 14 1 1 A 39 39 GLY N N 39 104.137 105.225 -1.088 1
1 419 . 14 1 1 A 40 40 TYR H H 40 8.318 8.858 -0.540 1
1 420 . 14 1 1 A 40 40 TYR HA H 40 5.414 5.128 0.286 1
1 425 . 14 1 1 A 40 40 TYR C C 40 174.448 172.123 2.325 1
1 426 . 14 1 1 A 40 40 TYR CA C 40 56.178 56.540 -0.362 1
1 427 . 14 1 1 A 40 40 TYR CB C 40 44.191 40.655 3.536 1
1 430 . 14 1 1 A 40 40 TYR N N 40 114.036 115.499 -1.463 1
1 431 . 14 1 1 A 41 41 ARG H H 41 9.347 8.844 0.503 1
1 432 . 14 1 1 A 41 41 ARG HA H 41 5.092 5.403 -0.311 1
1 440 . 14 1 1 A 41 41 ARG C C 41 174.097 174.109 -0.012 1
1 441 . 14 1 1 A 41 41 ARG CA C 41 56.100 54.271 1.829 1
1 442 . 14 1 1 A 41 41 ARG CB C 41 34.508 32.868 1.640 1
1 445 . 14 1 1 A 41 41 ARG N N 41 122.231 121.116 1.115 1
1 447 . 14 1 1 A 42 42 LEU H H 42 9.546 9.153 0.393 1
1 448 . 14 1 1 A 42 42 LEU HA H 42 5.459 5.311 0.148 1
1 458 . 14 1 1 A 42 42 LEU C C 42 174.913 174.682 0.231 1
1 459 . 14 1 1 A 42 42 LEU CA C 42 52.997 53.344 -0.347 1
1 460 . 14 1 1 A 42 42 LEU CB C 42 46.413 45.693 0.720 1
1 464 . 14 1 1 A 42 42 LEU N N 42 132.335 127.647 4.688 1
1 465 . 14 1 1 A 43 43 GLN H H 43 9.502 9.251 0.251 1
1 466 . 14 1 1 A 43 43 GLN HA H 43 5.847 5.242 0.605 1
1 473 . 14 1 1 A 43 43 GLN C C 43 175.329 174.008 1.321 1
1 474 . 14 1 1 A 43 43 GLN CA C 43 54.005 54.453 -0.448 1
1 475 . 14 1 1 A 43 43 GLN CB C 43 33.429 31.715 1.714 1
1 477 . 14 1 1 A 43 43 GLN N N 43 123.932 125.368 -1.436 1
1 479 . 14 1 1 A 44 44 TYR H H 44 8.615 8.531 0.084 1
1 480 . 14 1 1 A 44 44 TYR HA H 44 5.783 5.718 0.065 1
1 487 . 14 1 1 A 44 44 TYR C C 44 174.058 173.502 0.556 1
1 488 . 14 1 1 A 44 44 TYR CA C 44 55.942 55.862 0.080 1
1 489 . 14 1 1 A 44 44 TYR CB C 44 43.052 41.583 1.469 1
1 494 . 14 1 1 A 44 44 TYR N N 44 117.355 119.505 -2.150 1
1 495 . 14 1 1 A 45 45 CYS H H 45 8.377 8.320 0.057 1
1 496 . 14 1 1 A 45 45 CYS HA H 45 4.772 5.113 -0.341 1
1 499 . 14 1 1 A 45 45 CYS C C 45 173.205 173.754 -0.549 1
1 500 . 14 1 1 A 45 45 CYS CA C 45 55.960 57.005 -1.045 1
1 501 . 14 1 1 A 45 45 CYS CB C 45 30.665 31.193 -0.528 1
1 502 . 14 1 1 A 45 45 CYS N N 45 115.140 118.691 -3.551 1
1 503 . 14 1 1 A 46 46 ARG H H 46 9.165 8.225 0.940 1
1 504 . 14 1 1 A 46 46 ARG HA H 46 4.068 3.846 0.222 1
1 511 . 14 1 1 A 46 46 ARG C C 46 178.440 177.379 1.061 1
1 512 . 14 1 1 A 46 46 ARG CA C 46 56.401 56.032 0.369 1
1 513 . 14 1 1 A 46 46 ARG CB C 46 31.878 30.922 0.956 1
1 516 . 14 1 1 A 46 46 ARG N N 46 121.803 121.209 0.594 1
1 517 . 14 1 1 A 47 47 ALA H H 47 8.273 8.274 -0.001 1
1 518 . 14 1 1 A 47 47 ALA HA H 47 3.891 4.059 -0.168 1
1 522 . 14 1 1 A 47 47 ALA C C 47 177.599 177.496 0.103 1
1 523 . 14 1 1 A 47 47 ALA CA C 47 54.796 53.872 0.924 1
1 524 . 14 1 1 A 47 47 ALA CB C 47 18.287 18.624 -0.337 1
1 525 . 14 1 1 A 47 47 ALA N N 47 123.895 123.888 0.007 1
1 526 . 14 1 1 A 48 48 ASP H H 48 8.036 7.966 0.070 1
1 527 . 14 1 1 A 48 48 ASP HA H 48 4.453 4.767 -0.314 1
1 530 . 14 1 1 A 48 48 ASP C C 48 175.836 175.996 -0.160 1
1 531 . 14 1 1 A 48 48 ASP CA C 48 53.368 53.299 0.069 1
1 532 . 14 1 1 A 48 48 ASP CB C 48 39.964 41.492 -1.528 1
1 533 . 14 1 1 A 48 48 ASP N N 48 112.576 116.993 -4.417 1
1 534 . 14 1 1 A 49 49 GLU H H 49 7.495 7.443 0.052 1
1 535 . 14 1 1 A 49 49 GLU HA H 49 4.308 4.525 -0.217 1
1 540 . 14 1 1 A 49 49 GLU C C 49 175.756 175.821 -0.065 1
1 541 . 14 1 1 A 49 49 GLU CA C 49 56.224 54.983 1.241 1
1 542 . 14 1 1 A 49 49 GLU CB C 49 32.248 31.215 1.033 1
1 544 . 14 1 1 A 49 49 GLU N N 49 120.609 119.214 1.395 1
1 545 . 14 1 1 A 50 50 ALA H H 50 8.416 8.372 0.044 1
1 546 . 14 1 1 A 50 50 ALA HA H 50 4.200 4.478 -0.278 1
1 550 . 14 1 1 A 50 50 ALA C C 50 177.433 176.579 0.854 1
1 551 . 14 1 1 A 50 50 ALA CA C 50 53.297 52.140 1.157 1
1 552 . 14 1 1 A 50 50 ALA CB C 50 19.474 20.316 -0.842 1
1 553 . 14 1 1 A 50 50 ALA N N 50 124.065 124.055 0.010 1
1 554 . 14 1 1 A 51 51 ARG H H 51 7.648 7.638 0.010 1
1 555 . 14 1 1 A 51 51 ARG HA H 51 4.747 4.597 0.150 1
1 562 . 14 1 1 A 51 51 ARG C C 51 173.400 173.612 -0.212 1
1 563 . 14 1 1 A 51 51 ARG CA C 51 52.592 52.664 -0.072 1
1 564 . 14 1 1 A 51 51 ARG CB C 51 31.212 30.752 0.460 1
1 567 . 14 1 1 A 51 51 ARG N N 51 117.798 118.915 -1.117 1
1 568 . 14 1 1 A 52 52 PRO HA H 52 4.212 4.445 -0.233 1
1 575 . 14 1 1 A 52 52 PRO C C 52 176.380 176.678 -0.298 1
1 576 . 14 1 1 A 52 52 PRO CA C 52 62.360 62.480 -0.120 1
1 577 . 14 1 1 A 52 52 PRO CB C 52 32.331 32.267 0.064 1
1 580 . 14 1 1 A 53 53 ASN H H 53 8.127 7.704 0.423 1
1 581 . 14 1 1 A 53 53 ASN HA H 53 4.651 4.741 -0.090 1
1 586 . 14 1 1 A 53 53 ASN C C 53 174.354 174.616 -0.262 1
1 587 . 14 1 1 A 53 53 ASN CA C 53 53.136 52.616 0.520 1
1 588 . 14 1 1 A 53 53 ASN CB C 53 39.666 38.214 1.452 1
1 589 . 14 1 1 A 53 53 ASN N N 53 119.405 119.813 -0.408 1
1 591 . 14 1 1 A 54 54 THR H H 54 8.425 8.522 -0.097 1
1 592 . 14 1 1 A 54 54 THR HA H 54 5.306 4.392 0.914 1
1 597 . 14 1 1 A 54 54 THR C C 54 173.850 174.088 -0.238 1
1 598 . 14 1 1 A 54 54 THR CA C 54 61.881 63.460 -1.579 1
1 599 . 14 1 1 A 54 54 THR CB C 54 70.573 69.180 1.393 1
1 601 . 14 1 1 A 54 54 THR N N 54 118.968 121.651 -2.683 1
1 602 . 14 1 1 A 55 55 ILE H H 55 9.354 8.871 0.483 1
1 603 . 14 1 1 A 55 55 ILE HA H 55 4.051 4.571 -0.520 1
1 613 . 14 1 1 A 55 55 ILE C C 55 172.975 173.469 -0.494 1
1 614 . 14 1 1 A 55 55 ILE CA C 55 61.003 59.541 1.462 1
1 615 . 14 1 1 A 55 55 ILE CB C 55 41.619 41.756 -0.137 1
1 619 . 14 1 1 A 55 55 ILE N N 55 127.961 126.589 1.372 1
1 620 . 14 1 1 A 56 56 ASP H H 56 8.132 8.677 -0.545 1
1 621 . 14 1 1 A 56 56 ASP HA H 56 5.334 5.293 0.041 1
1 624 . 14 1 1 A 56 56 ASP C C 56 174.969 174.572 0.397 1
1 625 . 14 1 1 A 56 56 ASP CA C 56 53.702 52.800 0.902 1
1 626 . 14 1 1 A 56 56 ASP CB C 56 43.251 42.995 0.256 1
1 627 . 14 1 1 A 56 56 ASP N N 56 125.882 126.877 -0.995 1
1 628 . 14 1 1 A 57 57 PHE H H 57 8.955 8.769 0.186 1
1 629 . 14 1 1 A 57 57 PHE HA H 57 4.915 5.046 -0.131 1
1 637 . 14 1 1 A 57 57 PHE C C 57 177.361 175.475 1.886 1
1 638 . 14 1 1 A 57 57 PHE CA C 57 57.458 56.495 0.963 1
1 639 . 14 1 1 A 57 57 PHE CB C 57 43.737 43.493 0.244 1
1 645 . 14 1 1 A 57 57 PHE N N 57 118.872 123.069 -4.197 1
1 646 . 14 1 1 A 58 58 GLY H H 58 9.552 9.184 0.368 1
1 647 . 14 1 1 A 58 58 GLY HA2 H 58 4.662 4.117 0.545 1
1 648 . 14 1 1 A 58 58 GLY HA3 H 58 4.126 4.194 -0.068 1
1 649 . 14 1 1 A 58 58 GLY C C 58 174.760 175.022 -0.262 1
1 650 . 14 1 1 A 58 58 GLY CA C 58 44.680 45.036 -0.356 1
1 651 . 14 1 1 A 58 58 GLY N N 58 111.551 109.643 1.908 1
1 652 . 14 1 1 A 59 59 LYS H H 59 8.211 8.652 -0.441 1
1 653 . 14 1 1 A 59 59 LYS HA H 59 3.782 3.627 0.155 1
1 662 . 14 1 1 A 59 59 LYS C C 59 176.154 178.197 -2.043 1
1 663 . 14 1 1 A 59 59 LYS CA C 59 59.080 59.036 0.044 1
1 664 . 14 1 1 A 59 59 LYS CB C 59 32.516 31.754 0.762 1
1 668 . 14 1 1 A 59 59 LYS N N 59 115.953 120.542 -4.589 1
1 669 . 14 1 1 A 60 60 ASP H H 60 8.634 8.223 0.411 1
1 670 . 14 1 1 A 60 60 ASP HA H 60 4.882 4.410 0.472 1
1 673 . 14 1 1 A 60 60 ASP C C 60 176.039 176.490 -0.451 1
1 674 . 14 1 1 A 60 60 ASP CA C 60 54.327 57.590 -3.263 1
1 675 . 14 1 1 A 60 60 ASP CB C 60 41.461 41.463 -0.002 1
1 676 . 14 1 1 A 60 60 ASP N N 60 117.261 120.357 -3.096 1
1 677 . 14 1 1 A 61 61 ASP H H 61 7.500 8.497 -0.997 1
1 678 . 14 1 1 A 61 61 ASP HA H 61 4.591 4.694 -0.103 1
1 681 . 14 1 1 A 61 61 ASP C C 61 175.140 175.912 -0.772 1
1 682 . 14 1 1 A 61 61 ASP CA C 61 55.342 53.855 1.487 1
1 683 . 14 1 1 A 61 61 ASP CB C 61 42.475 39.977 2.498 1
1 684 . 14 1 1 A 61 61 ASP N N 61 122.319 118.466 3.853 1
1 685 . 14 1 1 A 62 62 GLN H H 62 8.239 8.061 0.178 1
1 686 . 14 1 1 A 62 62 GLN HA H 62 2.569 3.755 -1.186 1
1 693 . 14 1 1 A 62 62 GLN C C 62 172.652 173.576 -0.924 1
1 694 . 14 1 1 A 62 62 GLN CA C 62 54.038 55.587 -1.549 1
1 695 . 14 1 1 A 62 62 GLN CB C 62 31.481 29.329 2.152 1
1 697 . 14 1 1 A 62 62 GLN N N 62 117.458 123.380 -5.922 1
1 699 . 14 1 1 A 63 63 HIS H H 63 6.338 6.776 -0.438 1
1 700 . 14 1 1 A 63 63 HIS HA H 63 4.423 4.055 0.368 1
1 704 . 14 1 1 A 63 63 HIS C C 63 173.031 172.636 0.395 1
1 705 . 14 1 1 A 63 63 HIS CA C 63 54.743 54.044 0.699 1
1 706 . 14 1 1 A 63 63 HIS CB C 63 32.661 31.403 1.258 1
1 708 . 14 1 1 A 63 63 HIS N N 63 113.589 116.159 -2.570 1
1 709 . 14 1 1 A 64 64 PHE H H 64 8.549 8.827 -0.278 1
1 710 . 14 1 1 A 64 64 PHE HA H 64 4.578 5.115 -0.537 1
1 718 . 14 1 1 A 64 64 PHE C C 64 173.015 173.329 -0.314 1
1 719 . 14 1 1 A 64 64 PHE CA C 64 58.516 57.315 1.201 1
1 720 . 14 1 1 A 64 64 PHE CB C 64 43.525 43.121 0.404 1
1 726 . 14 1 1 A 64 64 PHE N N 64 118.214 119.772 -1.558 1
1 727 . 14 1 1 A 65 65 THR H H 65 7.150 7.879 -0.729 1
1 728 . 14 1 1 A 65 65 THR HA H 65 4.930 4.711 0.219 1
1 733 . 14 1 1 A 65 65 THR C C 65 172.457 173.133 -0.676 1
1 734 . 14 1 1 A 65 65 THR CA C 65 61.690 61.452 0.238 1
1 735 . 14 1 1 A 65 65 THR CB C 65 69.593 69.320 0.273 1
1 737 . 14 1 1 A 65 65 THR N N 65 123.198 119.245 3.953 1
1 738 . 14 1 1 A 66 66 VAL H H 66 8.888 8.672 0.216 1
1 739 . 14 1 1 A 66 66 VAL HA H 66 4.018 4.751 -0.733 1
1 747 . 14 1 1 A 66 66 VAL C C 66 174.868 175.453 -0.585 1
1 748 . 14 1 1 A 66 66 VAL CA C 66 61.178 60.852 0.326 1
1 749 . 14 1 1 A 66 66 VAL CB C 66 33.114 33.027 0.087 1
1 752 . 14 1 1 A 66 66 VAL N N 66 126.840 128.442 -1.602 1
1 753 . 14 1 1 A 67 67 THR H H 67 8.174 8.599 -0.425 1
1 754 . 14 1 1 A 67 67 THR HA H 67 4.816 5.095 -0.279 1
1 759 . 14 1 1 A 67 67 THR C C 67 174.494 174.178 0.316 1
1 760 . 14 1 1 A 67 67 THR CA C 67 59.786 59.531 0.255 1
1 761 . 14 1 1 A 67 67 THR CB C 67 70.887 71.611 -0.724 1
1 763 . 14 1 1 A 67 67 THR N N 67 116.127 117.169 -1.042 1
1 764 . 14 1 1 A 68 68 GLY H H 68 8.570 9.090 -0.520 1
1 765 . 14 1 1 A 68 68 GLY HA2 H 68 3.970 4.027 -0.057 1
1 766 . 14 1 1 A 68 68 GLY HA3 H 68 3.819 4.039 -0.220 1
1 767 . 14 1 1 A 68 68 GLY C C 68 175.636 174.788 0.848 1
1 768 . 14 1 1 A 68 68 GLY CA C 68 46.397 44.847 1.550 1
1 769 . 14 1 1 A 68 68 GLY N N 68 107.146 112.988 -5.842 1
1 770 . 14 1 1 A 69 69 LEU H H 69 8.007 7.485 0.522 1
1 771 . 14 1 1 A 69 69 LEU HA H 69 4.154 4.203 -0.049 1
1 781 . 14 1 1 A 69 69 LEU C C 69 176.830 176.798 0.032 1
1 782 . 14 1 1 A 69 69 LEU CA C 69 54.602 55.551 -0.949 1
1 783 . 14 1 1 A 69 69 LEU CB C 69 41.149 41.870 -0.721 1
1 787 . 14 1 1 A 69 69 LEU N N 69 118.433 123.025 -4.592 1
1 788 . 14 1 1 A 70 70 HIS H H 70 8.866 8.751 0.115 1
1 789 . 14 1 1 A 70 70 HIS HA H 70 4.663 4.626 0.037 1
1 793 . 14 1 1 A 70 70 HIS C C 70 176.667 175.595 1.072 1
1 794 . 14 1 1 A 70 70 HIS CA C 70 55.464 57.214 -1.750 1
1 795 . 14 1 1 A 70 70 HIS CB C 70 32.125 29.683 2.442 1
1 797 . 14 1 1 A 70 70 HIS N N 70 122.457 122.867 -0.410 1
1 798 . 14 1 1 A 71 71 LYS H H 71 8.716 8.595 0.121 1
1 799 . 14 1 1 A 71 71 LYS HA H 71 4.320 4.430 -0.110 1
1 808 . 14 1 1 A 71 71 LYS C C 71 178.110 176.811 1.299 1
1 809 . 14 1 1 A 71 71 LYS CA C 71 57.035 56.514 0.521 1
1 810 . 14 1 1 A 71 71 LYS CB C 71 33.580 32.729 0.851 1
1 814 . 14 1 1 A 71 71 LYS N N 71 123.173 123.721 -0.548 1
1 815 . 14 1 1 A 72 72 GLY H H 72 7.709 8.751 -1.042 1
1 816 . 14 1 1 A 72 72 GLY HA2 H 72 3.800 3.920 -0.120 1
1 817 . 14 1 1 A 72 72 GLY HA3 H 72 3.769 3.926 -0.157 1
1 818 . 14 1 1 A 72 72 GLY C C 72 174.231 173.933 0.298 1
1 819 . 14 1 1 A 72 72 GLY CA C 72 47.866 46.406 1.460 1
1 820 . 14 1 1 A 72 72 GLY N N 72 114.881 111.033 3.848 1
1 821 . 14 1 1 A 73 73 THR H H 73 8.162 7.607 0.555 1
1 822 . 14 1 1 A 73 73 THR HA H 73 4.584 4.790 -0.206 1
1 827 . 14 1 1 A 73 73 THR C C 73 172.208 173.420 -1.212 1
1 828 . 14 1 1 A 73 73 THR CA C 73 62.307 61.391 0.916 1
1 829 . 14 1 1 A 73 73 THR CB C 73 72.123 71.763 0.360 1
1 831 . 14 1 1 A 73 73 THR N N 73 114.225 114.362 -0.137 1
1 832 . 14 1 1 A 74 74 THR H H 74 8.743 8.913 -0.170 1
1 833 . 14 1 1 A 74 74 THR HA H 74 5.138 5.060 0.078 1
1 838 . 14 1 1 A 74 74 THR C C 74 173.376 173.294 0.082 1
1 839 . 14 1 1 A 74 74 THR CA C 74 62.724 62.860 -0.136 1
1 840 . 14 1 1 A 74 74 THR CB C 74 69.202 69.532 -0.330 1
1 842 . 14 1 1 A 74 74 THR N N 74 123.376 121.591 1.785 1
1 843 . 14 1 1 A 75 75 TYR H H 75 9.549 9.463 0.086 1
1 844 . 14 1 1 A 75 75 TYR HA H 75 4.892 5.247 -0.355 1
1 851 . 14 1 1 A 75 75 TYR C C 75 173.991 175.429 -1.438 1
1 852 . 14 1 1 A 75 75 TYR CA C 75 57.740 56.144 1.596 1
1 853 . 14 1 1 A 75 75 TYR CB C 75 44.580 42.891 1.689 1
1 858 . 14 1 1 A 75 75 TYR N N 75 126.916 126.057 0.859 1
1 859 . 14 1 1 A 76 76 ILE H H 76 8.769 8.844 -0.075 1
1 860 . 14 1 1 A 76 76 ILE HA H 76 4.663 4.940 -0.277 1
1 870 . 14 1 1 A 76 76 ILE C C 76 174.683 175.277 -0.594 1
1 871 . 14 1 1 A 76 76 ILE CA C 76 60.455 60.715 -0.260 1
1 872 . 14 1 1 A 76 76 ILE CB C 76 40.284 39.972 0.312 1
1 876 . 14 1 1 A 76 76 ILE N N 76 119.407 120.717 -1.310 1
1 877 . 14 1 1 A 77 77 PHE H H 77 8.894 9.010 -0.116 1
1 878 . 14 1 1 A 77 77 PHE HA H 77 5.160 5.089 0.071 1
1 886 . 14 1 1 A 77 77 PHE C C 77 174.794 175.379 -0.585 1
1 887 . 14 1 1 A 77 77 PHE CA C 77 56.831 57.594 -0.763 1
1 888 . 14 1 1 A 77 77 PHE CB C 77 43.132 41.241 1.891 1
1 894 . 14 1 1 A 77 77 PHE N N 77 124.622 127.159 -2.537 1
1 895 . 14 1 1 A 78 78 ARG H H 78 9.407 9.122 0.285 1
1 896 . 14 1 1 A 78 78 ARG HA H 78 5.689 5.652 0.037 1
1 904 . 14 1 1 A 78 78 ARG C C 78 174.376 174.547 -0.171 1
1 905 . 14 1 1 A 78 78 ARG CA C 78 54.530 54.624 -0.094 1
1 906 . 14 1 1 A 78 78 ARG CB C 78 34.473 33.830 0.643 1
1 909 . 14 1 1 A 78 78 ARG N N 78 120.055 121.224 -1.169 1
1 911 . 14 1 1 A 79 79 LEU H H 79 9.132 8.645 0.487 1
1 912 . 14 1 1 A 79 79 LEU HA H 79 5.398 5.125 0.273 1
1 922 . 14 1 1 A 79 79 LEU C C 79 174.006 174.391 -0.385 1
1 923 . 14 1 1 A 79 79 LEU CA C 79 53.401 53.337 0.064 1
1 924 . 14 1 1 A 79 79 LEU CB C 79 48.116 46.700 1.416 1
1 928 . 14 1 1 A 79 79 LEU N N 79 124.907 124.832 0.075 1
1 929 . 14 1 1 A 80 80 ALA H H 80 8.737 8.072 0.665 1
1 930 . 14 1 1 A 80 80 ALA HA H 80 4.871 4.991 -0.120 1
1 934 . 14 1 1 A 80 80 ALA C C 80 176.057 175.662 0.395 1
1 935 . 14 1 1 A 80 80 ALA CA C 80 50.353 51.171 -0.818 1
1 936 . 14 1 1 A 80 80 ALA CB C 80 23.972 23.358 0.614 1
1 937 . 14 1 1 A 80 80 ALA N N 80 128.220 125.874 2.346 1
1 938 . 14 1 1 A 81 81 ALA H H 81 9.890 8.595 1.295 1
1 939 . 14 1 1 A 81 81 ALA HA H 81 4.794 5.008 -0.214 1
1 943 . 14 1 1 A 81 81 ALA C C 81 174.655 176.433 -1.778 1
1 944 . 14 1 1 A 81 81 ALA CA C 81 50.300 51.067 -0.767 1
1 945 . 14 1 1 A 81 81 ALA CB C 81 21.369 20.486 0.883 1
1 946 . 14 1 1 A 81 81 ALA N N 81 123.682 123.266 0.416 1
1 947 . 14 1 1 A 82 82 LYS H H 82 7.965 8.760 -0.795 1
1 948 . 14 1 1 A 82 82 LYS HA H 82 4.974 5.050 -0.076 1
1 957 . 14 1 1 A 82 82 LYS C C 82 175.671 175.343 0.328 1
1 958 . 14 1 1 A 82 82 LYS CA C 82 54.664 54.637 0.027 1
1 959 . 14 1 1 A 82 82 LYS CB C 82 36.677 34.441 2.236 1
1 963 . 14 1 1 A 82 82 LYS N N 82 118.164 122.915 -4.751 1
1 964 . 14 1 1 A 83 83 ASN H H 83 8.663 8.985 -0.322 1
1 965 . 14 1 1 A 83 83 ASN HA H 83 5.113 5.045 0.068 1
1 970 . 14 1 1 A 83 83 ASN C C 83 176.582 175.894 0.688 1
1 971 . 14 1 1 A 83 83 ASN CA C 83 51.746 50.632 1.114 1
1 972 . 14 1 1 A 83 83 ASN CB C 83 40.357 40.122 0.235 1
1 973 . 14 1 1 A 83 83 ASN N N 83 124.784 124.230 0.554 1
1 975 . 14 1 1 A 84 84 ARG H H 84 8.873 8.843 0.030 1
1 976 . 14 1 1 A 84 84 ARG HA H 84 3.940 3.943 -0.003 1
1 983 . 14 1 1 A 84 84 ARG C C 84 176.735 177.528 -0.793 1
1 984 . 14 1 1 A 84 84 ARG CA C 84 59.327 59.049 0.278 1
1 985 . 14 1 1 A 84 84 ARG CB C 84 29.282 29.753 -0.471 1
1 988 . 14 1 1 A 84 84 ARG N N 84 117.891 119.569 -1.678 1
1 989 . 14 1 1 A 85 85 ALA H H 85 7.645 7.791 -0.146 1
1 990 . 14 1 1 A 85 85 ALA HA H 85 4.276 4.324 -0.048 1
1 994 . 14 1 1 A 85 85 ALA C C 85 177.479 177.087 0.392 1
1 995 . 14 1 1 A 85 85 ALA CA C 85 52.818 52.304 0.514 1
1 996 . 14 1 1 A 85 85 ALA CB C 85 18.806 19.482 -0.676 1
1 997 . 14 1 1 A 85 85 ALA N N 85 120.306 119.102 1.204 1
1 998 . 14 1 1 A 86 86 GLY H H 86 7.693 7.552 0.141 1
1 999 . 14 1 1 A 86 86 GLY HA2 H 86 4.456 4.076 0.380 1
1 1000 . 14 1 1 A 86 86 GLY HA3 H 86 3.649 4.079 -0.430 1
1 1001 . 14 1 1 A 86 86 GLY C C 86 172.068 172.647 -0.579 1
1 1002 . 14 1 1 A 86 86 GLY CA C 86 44.375 43.846 0.529 1
1 1003 . 14 1 1 A 86 86 GLY N N 86 106.594 104.764 1.830 1
1 1004 . 14 1 1 A 87 87 LEU H H 87 8.203 8.324 -0.121 1
1 1005 . 14 1 1 A 87 87 LEU HA H 87 4.629 4.832 -0.203 1
1 1015 . 14 1 1 A 87 87 LEU C C 87 179.155 176.498 2.657 1
1 1016 . 14 1 1 A 87 87 LEU CA C 87 54.814 54.583 0.231 1
1 1017 . 14 1 1 A 87 87 LEU CB C 87 43.454 42.299 1.155 1
1 1021 . 14 1 1 A 87 87 LEU N N 87 120.879 122.417 -1.538 1
1 1022 . 14 1 1 A 88 88 GLY H H 88 8.492 8.011 0.481 1
1 1023 . 14 1 1 A 88 88 GLY HA2 H 88 4.339 4.148 0.191 1
1 1024 . 14 1 1 A 88 88 GLY HA3 H 88 4.122 4.152 -0.030 1
1 1025 . 14 1 1 A 88 88 GLY C C 88 173.030 173.305 -0.275 1
1 1026 . 14 1 1 A 88 88 GLY CA C 88 43.970 44.554 -0.584 1
1 1027 . 14 1 1 A 88 88 GLY N N 88 109.903 110.540 -0.637 1
1 1028 . 14 1 1 A 89 89 GLU H H 89 7.638 8.800 -1.162 1
1 1029 . 14 1 1 A 89 89 GLU HA H 89 4.103 4.372 -0.269 1
1 1034 . 14 1 1 A 89 89 GLU C C 89 177.511 176.227 1.284 1
1 1035 . 14 1 1 A 89 89 GLU CA C 89 56.659 56.710 -0.051 1
1 1036 . 14 1 1 A 89 89 GLU CB C 89 31.324 30.657 0.667 1
1 1038 . 14 1 1 A 89 89 GLU N N 89 117.551 122.740 -5.189 1
1 1039 . 14 1 1 A 90 90 GLU H H 90 8.734 8.706 0.028 1
1 1040 . 14 1 1 A 90 90 GLU HA H 90 4.651 5.354 -0.703 1
1 1045 . 14 1 1 A 90 90 GLU C C 90 177.452 174.676 2.776 1
1 1046 . 14 1 1 A 90 90 GLU CA C 90 55.987 54.972 1.015 1
1 1047 . 14 1 1 A 90 90 GLU CB C 90 31.135 33.123 -1.988 1
1 1049 . 14 1 1 A 90 90 GLU N N 90 121.553 120.204 1.349 1
1 1050 . 14 1 1 A 91 91 PHE H H 91 9.411 9.228 0.183 1
1 1051 . 14 1 1 A 91 91 PHE HA H 91 4.665 5.062 -0.397 1
1 1059 . 14 1 1 A 91 91 PHE C C 91 173.944 174.235 -0.291 1
1 1060 . 14 1 1 A 91 91 PHE CA C 91 57.687 57.720 -0.033 1
1 1061 . 14 1 1 A 91 91 PHE CB C 91 40.890 41.868 -0.978 1
1 1067 . 14 1 1 A 91 91 PHE N N 91 125.459 124.633 0.826 1
1 1068 . 14 1 1 A 92 92 GLU H H 92 8.043 8.165 -0.122 1
1 1069 . 14 1 1 A 92 92 GLU HA H 92 5.424 4.946 0.478 1
1 1074 . 14 1 1 A 92 92 GLU C C 92 174.295 174.096 0.199 1
1 1075 . 14 1 1 A 92 92 GLU CA C 92 54.378 54.320 0.058 1
1 1076 . 14 1 1 A 92 92 GLU CB C 92 33.662 33.187 0.475 1
1 1078 . 14 1 1 A 92 92 GLU N N 92 128.905 126.781 2.124 1
1 1079 . 14 1 1 A 93 93 LYS H H 93 9.142 8.297 0.845 1
1 1080 . 14 1 1 A 93 93 LYS HA H 93 4.541 4.872 -0.331 1
1 1089 . 14 1 1 A 93 93 LYS C C 93 173.366 173.888 -0.522 1
1 1090 . 14 1 1 A 93 93 LYS CA C 93 55.343 55.508 -0.165 1
1 1091 . 14 1 1 A 93 93 LYS CB C 93 37.317 36.080 1.237 1
1 1095 . 14 1 1 A 93 93 LYS N N 93 125.231 125.923 -0.692 1
1 1096 . 14 1 1 A 94 94 GLU H H 94 8.655 9.147 -0.492 1
1 1097 . 14 1 1 A 94 94 GLU HA H 94 5.558 5.315 0.243 1
1 1102 . 14 1 1 A 94 94 GLU C C 94 176.238 175.578 0.660 1
1 1103 . 14 1 1 A 94 94 GLU CA C 94 54.632 55.034 -0.402 1
1 1104 . 14 1 1 A 94 94 GLU CB C 94 32.166 32.786 -0.620 1
1 1106 . 14 1 1 A 94 94 GLU N N 94 127.232 128.068 -0.836 1
1 1107 . 14 1 1 A 95 95 ILE H H 95 9.302 8.872 0.430 1
1 1108 . 14 1 1 A 95 95 ILE HA H 95 4.794 5.260 -0.466 1
1 1118 . 14 1 1 A 95 95 ILE C C 95 173.138 174.283 -1.145 1
1 1119 . 14 1 1 A 95 95 ILE CA C 95 58.570 58.410 0.160 1
1 1120 . 14 1 1 A 95 95 ILE CB C 95 42.420 42.776 -0.356 1
1 1124 . 14 1 1 A 95 95 ILE N N 95 120.711 121.376 -0.665 1
1 1125 . 14 1 1 A 96 96 ARG H H 96 8.589 8.788 -0.199 1
1 1126 . 14 1 1 A 96 96 ARG HA H 96 5.373 4.936 0.437 1
1 1133 . 14 1 1 A 96 96 ARG C C 96 177.147 175.000 2.147 1
1 1134 . 14 1 1 A 96 96 ARG CA C 96 54.045 55.233 -1.188 1
1 1135 . 14 1 1 A 96 96 ARG CB C 96 32.001 33.931 -1.930 1
1 1138 . 14 1 1 A 96 96 ARG N N 96 124.445 121.934 2.511 1
1 1139 . 14 1 1 A 97 97 THR H H 97 9.243 8.614 0.629 1
1 1140 . 14 1 1 A 97 97 THR HA H 97 4.459 4.510 -0.051 1
1 1145 . 14 1 1 A 97 97 THR C C 97 172.745 173.919 -1.174 1
1 1146 . 14 1 1 A 97 97 THR CA C 97 59.637 60.768 -1.131 1
1 1147 . 14 1 1 A 97 97 THR CB C 97 67.687 68.781 -1.094 1
1 1149 . 14 1 1 A 97 97 THR N N 97 119.370 118.804 0.566 1
1 1150 . 14 1 1 A 98 98 PRO HA H 98 4.494 4.550 -0.056 1
1 1157 . 14 1 1 A 98 98 PRO CA C 98 63.117 62.722 0.395 1
1 1158 . 14 1 1 A 98 98 PRO CB C 98 32.500 32.423 0.077 1
1 1161 . 14 1 1 A 99 99 GLU H H 99 8.534 8.464 0.070 1
1 1162 . 14 1 1 A 99 99 GLU HA H 99 4.195 4.706 -0.511 1
1 1167 . 14 1 1 A 99 99 GLU C C 99 175.881 175.408 0.473 1
1 1168 . 14 1 1 A 99 99 GLU CA C 99 56.330 56.515 -0.185 1
1 1169 . 14 1 1 A 99 99 GLU CB C 99 31.062 30.658 0.404 1
1 1171 . 14 1 1 A 99 99 GLU N N 99 119.688 121.589 -1.901 1
1 1172 . 14 1 1 A 100 100 ASP H H 100 8.536 8.676 -0.140 1
1 1173 . 14 1 1 A 100 100 ASP HA H 100 4.607 5.133 -0.526 1
1 1176 . 14 1 1 A 100 100 ASP C C 100 176.012 174.533 1.479 1
1 1177 . 14 1 1 A 100 100 ASP CA C 100 54.109 53.011 1.098 1
1 1178 . 14 1 1 A 100 100 ASP CB C 100 41.562 45.209 -3.647 1
1 1179 . 14 1 1 A 100 100 ASP N N 100 119.803 122.375 -2.572 1
1 1180 . 14 1 1 A 101 101 LEU H H 101 8.403 8.517 -0.114 1
1 1181 . 14 1 1 A 101 101 LEU HA H 101 4.426 5.039 -0.613 1
1 1191 . 14 1 1 A 101 101 LEU C C 101 177.534 175.915 1.619 1
1 1192 . 14 1 1 A 101 101 LEU CA C 101 55.113 53.065 2.048 1
1 1193 . 14 1 1 A 101 101 LEU CB C 101 42.156 43.529 -1.373 1
1 1197 . 14 1 1 A 101 101 LEU N N 101 123.876 119.965 3.911 1
1 1198 . 14 1 1 A 102 102 SER H H 102 8.413 8.697 -0.284 1
1 1199 . 14 1 1 A 102 102 SER HA H 102 4.434 5.334 -0.900 1
1 1202 . 14 1 1 A 102 102 SER C C 102 174.674 173.333 1.341 1
1 1203 . 14 1 1 A 102 102 SER CA C 102 58.798 57.607 1.191 1
1 1204 . 14 1 1 A 102 102 SER CB C 102 63.854 66.623 -2.769 1
1 1205 . 14 1 1 A 102 102 SER N N 102 116.667 115.760 0.907 1
1 1206 . 14 1 1 A 103 103 GLY H H 103 8.213 8.296 -0.083 1
1 1207 . 14 1 1 A 103 103 GLY HA2 H 103 4.164 4.174 -0.010 1
1 1208 . 14 1 1 A 103 103 GLY HA3 H 103 4.057 4.175 -0.118 1
1 1209 . 14 1 1 A 103 103 GLY C C 103 171.822 170.527 1.295 1
1 1210 . 14 1 1 A 103 103 GLY CA C 103 44.658 45.381 -0.723 1
1 1211 . 14 1 1 A 103 103 GLY N N 103 110.592 110.300 0.292 1
1 1212 . 14 1 1 A 104 104 PRO HA H 104 4.475 4.761 -0.286 1
1 1219 . 14 1 1 A 104 104 PRO C C 104 177.445 176.011 1.434 1
1 1220 . 14 1 1 A 104 104 PRO CA C 104 63.312 62.661 0.651 1
1 1221 . 14 1 1 A 104 104 PRO CB C 104 32.190 32.904 -0.714 1
1 1224 . 14 1 1 A 105 105 SER H H 105 8.538 8.362 0.176 1
1 1225 . 14 1 1 A 105 105 SER HA H 105 4.541 4.924 -0.383 1
1 1228 . 14 1 1 A 105 105 SER C C 105 174.616 173.173 1.443 1
1 1229 . 14 1 1 A 105 105 SER CA C 105 58.270 56.550 1.720 1
1 1230 . 14 1 1 A 105 105 SER CB C 105 63.895 65.840 -1.945 1
1 1231 . 14 1 1 A 105 105 SER N N 105 116.446 114.405 2.041 1
1 1232 . 14 1 1 A 106 106 SER H H 106 8.350 8.677 -0.327 1
1 1233 . 14 1 1 A 106 106 SER HA H 106 4.541 4.103 0.438 1
1 1236 . 14 1 1 A 106 106 SER C C 106 174.530 173.628 0.902 1
1 1237 . 14 1 1 A 106 106 SER CA C 106 58.357 59.645 -1.288 1
1 1238 . 14 1 1 A 106 106 SER CB C 106 64.020 61.202 2.818 1
1 1239 . 14 1 1 A 106 106 SER N N 106 117.448 116.230 1.218 1
1 1 . 15 1 1 A 2 2 SER C C 2 174.723 173.208 1.515 1
1 2 . 15 1 1 A 2 2 SER CA C 2 58.446 57.136 1.310 1
1 3 . 15 1 1 A 2 2 SER CB C 2 63.566 66.560 -2.994 1
1 4 . 15 1 1 A 3 3 SER H H 3 8.350 8.748 -0.398 1
1 5 . 15 1 1 A 3 3 SER C C 3 173.961 174.241 -0.280 1
1 6 . 15 1 1 A 3 3 SER CA C 3 58.428 56.627 1.801 1
1 7 . 15 1 1 A 3 3 SER CB C 3 63.937 65.740 -1.803 1
1 8 . 15 1 1 A 3 3 SER N N 3 117.923 116.444 1.479 1
1 9 . 15 1 1 A 4 4 GLY H H 4 8.050 8.440 -0.390 1
1 10 . 15 1 1 A 4 4 GLY C C 4 179.009 171.739 7.270 1
1 11 . 15 1 1 A 4 4 GLY CA C 4 46.174 45.492 0.682 1
1 12 . 15 1 1 A 4 4 GLY N N 4 116.890 107.520 9.370 1
1 13 . 15 1 1 A 7 7 GLY HA2 H 7 4.340 4.232 0.108 1
1 14 . 15 1 1 A 7 7 GLY HA3 H 7 3.629 4.233 -0.604 1
1 15 . 15 1 1 A 7 7 GLY CA C 7 44.381 45.119 -0.738 1
1 16 . 15 1 1 A 8 8 PRO HA H 8 4.476 4.511 -0.035 1
1 23 . 15 1 1 A 8 8 PRO C C 8 176.235 177.183 -0.948 1
1 24 . 15 1 1 A 8 8 PRO CA C 8 62.995 62.553 0.442 1
1 25 . 15 1 1 A 8 8 PRO CB C 8 33.266 32.796 0.470 1
1 28 . 15 1 1 A 9 9 GLY H H 9 8.585 8.464 0.121 1
1 29 . 15 1 1 A 9 9 GLY HA2 H 9 4.326 4.107 0.219 1
1 30 . 15 1 1 A 9 9 GLY HA3 H 9 4.009 4.110 -0.101 1
1 31 . 15 1 1 A 9 9 GLY C C 9 172.998 173.232 -0.234 1
1 32 . 15 1 1 A 9 9 GLY CA C 9 44.393 44.132 0.261 1
1 33 . 15 1 1 A 9 9 GLY N N 9 106.004 107.816 -1.812 1
1 34 . 15 1 1 A 10 10 ARG H H 10 8.548 8.334 0.214 1
1 35 . 15 1 1 A 10 10 ARG HA H 10 4.654 4.613 0.041 1
1 41 . 15 1 1 A 10 10 ARG C C 10 175.780 175.435 0.345 1
1 42 . 15 1 1 A 10 10 ARG CA C 10 54.708 54.815 -0.107 1
1 43 . 15 1 1 A 10 10 ARG CB C 10 31.448 30.659 0.789 1
1 45 . 15 1 1 A 10 10 ARG N N 10 119.407 117.648 1.759 1
1 46 . 15 1 1 A 11 11 PRO HA H 11 4.611 4.544 0.067 1
1 53 . 15 1 1 A 11 11 PRO C C 11 173.510 175.476 -1.966 1
1 54 . 15 1 1 A 11 11 PRO CA C 11 62.360 62.631 -0.271 1
1 55 . 15 1 1 A 11 11 PRO CB C 11 33.402 32.203 1.199 1
1 58 . 15 1 1 A 12 12 THR H H 12 7.572 8.418 -0.846 1
1 59 . 15 1 1 A 12 12 THR HA H 12 3.796 4.114 -0.318 1
1 64 . 15 1 1 A 12 12 THR C C 12 172.337 173.367 -1.030 1
1 65 . 15 1 1 A 12 12 THR CA C 12 61.778 61.495 0.283 1
1 66 . 15 1 1 A 12 12 THR CB C 12 70.561 68.620 1.941 1
1 68 . 15 1 1 A 12 12 THR N N 12 109.653 117.194 -7.541 1
1 69 . 15 1 1 A 13 13 MET H H 13 5.605 8.462 -2.857 1
1 70 . 15 1 1 A 13 13 MET HA H 13 5.091 5.021 0.070 1
1 78 . 15 1 1 A 13 13 MET C C 13 172.639 175.271 -2.632 1
1 79 . 15 1 1 A 13 13 MET CA C 13 54.168 53.698 0.470 1
1 80 . 15 1 1 A 13 13 MET CB C 13 37.632 34.684 2.948 1
1 83 . 15 1 1 A 13 13 MET N N 13 121.634 126.802 -5.168 1
1 84 . 15 1 1 A 14 14 MET H H 14 9.254 9.293 -0.039 1
1 85 . 15 1 1 A 14 14 MET HA H 14 4.662 5.163 -0.501 1
1 93 . 15 1 1 A 14 14 MET C C 14 174.388 174.520 -0.132 1
1 94 . 15 1 1 A 14 14 MET CA C 14 54.673 54.348 0.325 1
1 95 . 15 1 1 A 14 14 MET CB C 14 34.907 35.565 -0.658 1
1 98 . 15 1 1 A 14 14 MET N N 14 125.746 123.659 2.087 1
1 99 . 15 1 1 A 15 15 ILE H H 15 8.555 8.973 -0.418 1
1 100 . 15 1 1 A 15 15 ILE HA H 15 4.882 5.184 -0.302 1
1 110 . 15 1 1 A 15 15 ILE C C 15 174.962 174.412 0.550 1
1 111 . 15 1 1 A 15 15 ILE CA C 15 60.685 60.120 0.565 1
1 112 . 15 1 1 A 15 15 ILE CB C 15 40.878 39.390 1.488 1
1 116 . 15 1 1 A 15 15 ILE N N 15 121.623 125.719 -4.096 1
1 117 . 15 1 1 A 16 16 SER H H 16 8.703 8.766 -0.063 1
1 118 . 15 1 1 A 16 16 SER HA H 16 4.922 5.231 -0.309 1
1 121 . 15 1 1 A 16 16 SER C C 16 173.860 172.868 0.992 1
1 122 . 15 1 1 A 16 16 SER CA C 16 56.524 56.739 -0.215 1
1 123 . 15 1 1 A 16 16 SER CB C 16 65.004 65.059 -0.055 1
1 124 . 15 1 1 A 16 16 SER N N 16 122.261 122.301 -0.040 1
1 125 . 15 1 1 A 17 17 THR H H 17 8.759 8.663 0.096 1
1 126 . 15 1 1 A 17 17 THR HA H 17 4.885 4.803 0.082 1
1 131 . 15 1 1 A 17 17 THR C C 17 175.018 174.829 0.189 1
1 132 . 15 1 1 A 17 17 THR CA C 17 60.315 60.827 -0.512 1
1 133 . 15 1 1 A 17 17 THR CB C 17 69.799 69.688 0.111 1
1 135 . 15 1 1 A 17 17 THR N N 17 115.660 116.306 -0.646 1
1 136 . 15 1 1 A 18 18 THR H H 18 8.038 8.786 -0.748 1
1 137 . 15 1 1 A 18 18 THR HA H 18 4.596 4.445 0.151 1
1 142 . 15 1 1 A 18 18 THR CA C 18 60.707 62.414 -1.707 1
1 143 . 15 1 1 A 18 18 THR CB C 18 71.082 69.651 1.431 1
1 145 . 15 1 1 A 18 18 THR N N 18 112.362 116.041 -3.679 1
1 146 . 15 1 1 A 19 19 ALA H H 19 8.545 7.296 1.249 1
1 147 . 15 1 1 A 19 19 ALA HA H 19 4.412 4.494 -0.082 1
1 151 . 15 1 1 A 19 19 ALA C C 19 177.034 177.112 -0.078 1
1 152 . 15 1 1 A 19 19 ALA CA C 19 52.264 51.318 0.946 1
1 153 . 15 1 1 A 19 19 ALA CB C 19 19.292 21.532 -2.240 1
1 154 . 15 1 1 A 19 19 ALA N N 19 119.589 123.392 -3.803 1
1 155 . 15 1 1 A 20 20 MET H H 20 8.145 8.513 -0.368 1
1 156 . 15 1 1 A 20 20 MET HA H 20 4.447 4.488 -0.041 1
1 164 . 15 1 1 A 20 20 MET C C 20 175.676 176.515 -0.839 1
1 165 . 15 1 1 A 20 20 MET CA C 20 55.764 54.478 1.286 1
1 166 . 15 1 1 A 20 20 MET CB C 20 31.495 32.321 -0.826 1
1 169 . 15 1 1 A 20 20 MET N N 20 116.950 118.704 -1.754 1
1 170 . 15 1 1 A 21 21 ASN H H 21 8.275 8.962 -0.687 1
1 171 . 15 1 1 A 21 21 ASN HA H 21 4.452 4.384 0.068 1
1 176 . 15 1 1 A 21 21 ASN C C 21 174.100 173.810 0.290 1
1 177 . 15 1 1 A 21 21 ASN CA C 21 54.320 54.626 -0.306 1
1 178 . 15 1 1 A 21 21 ASN CB C 21 37.234 37.143 0.091 1
1 179 . 15 1 1 A 21 21 ASN N N 21 113.198 118.528 -5.330 1
1 181 . 15 1 1 A 22 22 THR H H 22 7.071 7.476 -0.405 1
1 182 . 15 1 1 A 22 22 THR HA H 22 5.218 5.439 -0.221 1
1 187 . 15 1 1 A 22 22 THR C C 22 173.301 172.916 0.385 1
1 188 . 15 1 1 A 22 22 THR CA C 22 59.399 60.182 -0.783 1
1 189 . 15 1 1 A 22 22 THR CB C 22 72.714 72.154 0.560 1
1 191 . 15 1 1 A 22 22 THR N N 22 107.603 107.822 -0.219 1
1 192 . 15 1 1 A 23 23 ALA H H 23 8.687 8.818 -0.131 1
1 193 . 15 1 1 A 23 23 ALA HA H 23 4.925 5.123 -0.198 1
1 197 . 15 1 1 A 23 23 ALA C C 23 174.100 175.510 -1.410 1
1 198 . 15 1 1 A 23 23 ALA CA C 23 50.812 50.099 0.713 1
1 199 . 15 1 1 A 23 23 ALA CB C 23 21.122 21.398 -0.276 1
1 200 . 15 1 1 A 23 23 ALA N N 23 121.937 125.520 -3.583 1
1 201 . 15 1 1 A 24 24 LEU H H 24 8.833 8.979 -0.146 1
1 202 . 15 1 1 A 24 24 LEU HA H 24 4.673 4.560 0.113 1
1 212 . 15 1 1 A 24 24 LEU C C 24 175.140 174.569 0.571 1
1 213 . 15 1 1 A 24 24 LEU CA C 24 54.320 54.740 -0.420 1
1 214 . 15 1 1 A 24 24 LEU CB C 24 42.518 42.944 -0.426 1
1 218 . 15 1 1 A 24 24 LEU N N 24 123.721 126.581 -2.860 1
1 219 . 15 1 1 A 25 25 LEU H H 25 9.176 9.094 0.082 1
1 220 . 15 1 1 A 25 25 LEU HA H 25 5.112 5.051 0.061 1
1 230 . 15 1 1 A 25 25 LEU C C 25 176.414 175.883 0.531 1
1 231 . 15 1 1 A 25 25 LEU CA C 25 54.108 53.337 0.771 1
1 232 . 15 1 1 A 25 25 LEU CB C 25 43.230 43.156 0.074 1
1 236 . 15 1 1 A 25 25 LEU N N 25 128.589 128.963 -0.374 1
1 237 . 15 1 1 A 26 26 GLN H H 26 8.556 8.941 -0.385 1
1 238 . 15 1 1 A 26 26 GLN HA H 26 4.737 4.845 -0.108 1
1 245 . 15 1 1 A 26 26 GLN C C 26 174.372 174.304 0.068 1
1 246 . 15 1 1 A 26 26 GLN CA C 26 56.365 54.448 1.917 1
1 247 . 15 1 1 A 26 26 GLN CB C 26 33.320 31.916 1.404 1
1 249 . 15 1 1 A 26 26 GLN N N 26 119.630 123.161 -3.531 1
1 251 . 15 1 1 A 27 27 TRP H H 27 8.080 7.862 0.218 1
1 252 . 15 1 1 A 27 27 TRP HA H 27 5.441 5.803 -0.362 1
1 261 . 15 1 1 A 27 27 TRP CA C 27 55.957 54.459 1.498 1
1 262 . 15 1 1 A 27 27 TRP CB C 27 32.517 32.229 0.288 1
1 268 . 15 1 1 A 27 27 TRP N N 27 121.276 121.676 -0.400 1
1 270 . 15 1 1 A 28 28 HIS H H 28 8.262 8.536 -0.274 1
1 271 . 15 1 1 A 28 28 HIS HA H 28 4.997 5.024 -0.027 1
1 275 . 15 1 1 A 28 28 HIS CA C 28 53.028 53.947 -0.919 1
1 276 . 15 1 1 A 28 28 HIS CB C 28 32.832 32.885 -0.053 1
1 278 . 15 1 1 A 28 28 HIS N N 28 116.245 116.848 -0.603 1
1 279 . 15 1 1 A 29 29 PRO HA H 29 4.984 4.667 0.317 1
1 286 . 15 1 1 A 29 29 PRO CA C 29 61.498 62.084 -0.586 1
1 287 . 15 1 1 A 29 29 PRO CB C 29 30.709 32.290 -1.581 1
1 290 . 15 1 1 A 30 30 PRO HA H 30 4.449 4.668 -0.219 1
1 297 . 15 1 1 A 30 30 PRO C C 30 175.733 176.873 -1.140 1
1 298 . 15 1 1 A 30 30 PRO CA C 30 62.245 62.535 -0.290 1
1 299 . 15 1 1 A 30 30 PRO CB C 30 32.083 33.446 -1.363 1
1 302 . 15 1 1 A 31 31 LYS H H 31 8.403 8.900 -0.497 1
1 303 . 15 1 1 A 31 31 LYS HA H 31 4.084 4.465 -0.381 1
1 312 . 15 1 1 A 31 31 LYS C C 31 177.166 177.173 -0.007 1
1 313 . 15 1 1 A 31 31 LYS CA C 31 57.866 56.773 1.093 1
1 314 . 15 1 1 A 31 31 LYS CB C 31 32.698 33.608 -0.910 1
1 318 . 15 1 1 A 31 31 LYS N N 31 121.693 119.564 2.129 1
1 319 . 15 1 1 A 32 32 GLU H H 32 8.102 7.899 0.203 1
1 320 . 15 1 1 A 32 32 GLU HA H 32 4.365 4.462 -0.097 1
1 325 . 15 1 1 A 32 32 GLU C C 32 174.248 176.371 -2.123 1
1 326 . 15 1 1 A 32 32 GLU CA C 32 55.448 55.780 -0.332 1
1 327 . 15 1 1 A 32 32 GLU CB C 32 29.405 30.114 -0.709 1
1 329 . 15 1 1 A 32 32 GLU N N 32 118.742 116.807 1.935 1
1 330 . 15 1 1 A 33 33 LEU H H 33 8.420 7.525 0.895 1
1 331 . 15 1 1 A 33 33 LEU HA H 33 4.499 4.587 -0.088 1
1 341 . 15 1 1 A 33 33 LEU C C 33 173.036 175.065 -2.029 1
1 342 . 15 1 1 A 33 33 LEU CA C 33 52.863 52.633 0.230 1
1 343 . 15 1 1 A 33 33 LEU CB C 33 42.535 42.814 -0.279 1
1 347 . 15 1 1 A 33 33 LEU N N 33 125.181 123.833 1.348 1
1 348 . 15 1 1 A 34 34 PRO HA H 34 4.488 4.434 0.054 1
1 355 . 15 1 1 A 34 34 PRO C C 34 177.544 177.024 0.520 1
1 356 . 15 1 1 A 34 34 PRO CA C 34 62.889 63.296 -0.407 1
1 357 . 15 1 1 A 34 34 PRO CB C 34 31.472 30.882 0.590 1
1 360 . 15 1 1 A 35 35 GLY H H 35 8.397 8.085 0.312 1
1 361 . 15 1 1 A 35 35 GLY HA2 H 35 4.059 4.116 -0.057 1
1 362 . 15 1 1 A 35 35 GLY HA3 H 35 3.716 4.117 -0.401 1
1 363 . 15 1 1 A 35 35 GLY C C 35 173.356 172.199 1.157 1
1 364 . 15 1 1 A 35 35 GLY CA C 35 45.892 45.096 0.796 1
1 365 . 15 1 1 A 35 35 GLY N N 35 110.524 112.290 -1.766 1
1 366 . 15 1 1 A 36 36 GLU H H 36 8.091 8.533 -0.442 1
1 367 . 15 1 1 A 36 36 GLU HA H 36 4.371 5.045 -0.674 1
1 372 . 15 1 1 A 36 36 GLU C C 36 174.864 174.309 0.555 1
1 373 . 15 1 1 A 36 36 GLU CA C 36 55.201 54.685 0.516 1
1 374 . 15 1 1 A 36 36 GLU CB C 36 31.878 32.884 -1.006 1
1 376 . 15 1 1 A 36 36 GLU N N 36 122.202 120.265 1.937 1
1 377 . 15 1 1 A 37 37 LEU H H 37 8.307 8.718 -0.411 1
1 378 . 15 1 1 A 37 37 LEU HA H 37 4.288 4.300 -0.012 1
1 388 . 15 1 1 A 37 37 LEU C C 37 176.702 176.026 0.676 1
1 389 . 15 1 1 A 37 37 LEU CA C 37 55.342 56.286 -0.944 1
1 390 . 15 1 1 A 37 37 LEU CB C 37 42.715 42.290 0.425 1
1 394 . 15 1 1 A 37 37 LEU N N 37 123.204 124.289 -1.085 1
1 395 . 15 1 1 A 38 38 LEU H H 38 8.909 8.585 0.324 1
1 396 . 15 1 1 A 38 38 LEU HA H 38 4.640 4.595 0.045 1
1 406 . 15 1 1 A 38 38 LEU C C 38 177.202 176.904 0.298 1
1 407 . 15 1 1 A 38 38 LEU CA C 38 54.390 55.165 -0.775 1
1 408 . 15 1 1 A 38 38 LEU CB C 38 43.770 43.864 -0.094 1
1 412 . 15 1 1 A 38 38 LEU N N 38 123.021 126.697 -3.676 1
1 413 . 15 1 1 A 39 39 GLY H H 39 7.113 7.024 0.089 1
1 414 . 15 1 1 A 39 39 GLY HA2 H 39 4.816 3.562 1.254 1
1 415 . 15 1 1 A 39 39 GLY HA3 H 39 3.276 3.900 -0.624 1
1 416 . 15 1 1 A 39 39 GLY C C 39 169.863 170.507 -0.644 1
1 417 . 15 1 1 A 39 39 GLY CA C 39 44.622 45.466 -0.844 1
1 418 . 15 1 1 A 39 39 GLY N N 39 104.137 103.607 0.530 1
1 419 . 15 1 1 A 40 40 TYR H H 40 8.318 8.881 -0.563 1
1 420 . 15 1 1 A 40 40 TYR HA H 40 5.414 5.142 0.272 1
1 425 . 15 1 1 A 40 40 TYR C C 40 174.448 172.115 2.333 1
1 426 . 15 1 1 A 40 40 TYR CA C 40 56.178 56.435 -0.257 1
1 427 . 15 1 1 A 40 40 TYR CB C 40 44.191 40.629 3.562 1
1 430 . 15 1 1 A 40 40 TYR N N 40 114.036 115.350 -1.314 1
1 431 . 15 1 1 A 41 41 ARG H H 41 9.347 8.386 0.961 1
1 432 . 15 1 1 A 41 41 ARG HA H 41 5.092 5.346 -0.254 1
1 440 . 15 1 1 A 41 41 ARG C C 41 174.097 173.999 0.098 1
1 441 . 15 1 1 A 41 41 ARG CA C 41 56.100 54.212 1.888 1
1 442 . 15 1 1 A 41 41 ARG CB C 41 34.508 33.272 1.236 1
1 445 . 15 1 1 A 41 41 ARG N N 41 122.231 121.118 1.113 1
1 447 . 15 1 1 A 42 42 LEU H H 42 9.546 9.192 0.354 1
1 448 . 15 1 1 A 42 42 LEU HA H 42 5.459 5.265 0.194 1
1 458 . 15 1 1 A 42 42 LEU C C 42 174.913 174.708 0.205 1
1 459 . 15 1 1 A 42 42 LEU CA C 42 52.997 53.376 -0.379 1
1 460 . 15 1 1 A 42 42 LEU CB C 42 46.413 45.598 0.815 1
1 464 . 15 1 1 A 42 42 LEU N N 42 132.335 127.607 4.728 1
1 465 . 15 1 1 A 43 43 GLN H H 43 9.502 9.249 0.253 1
1 466 . 15 1 1 A 43 43 GLN HA H 43 5.847 5.360 0.487 1
1 473 . 15 1 1 A 43 43 GLN C C 43 175.329 173.998 1.331 1
1 474 . 15 1 1 A 43 43 GLN CA C 43 54.005 54.482 -0.477 1
1 475 . 15 1 1 A 43 43 GLN CB C 43 33.429 31.766 1.663 1
1 477 . 15 1 1 A 43 43 GLN N N 43 123.932 125.358 -1.426 1
1 479 . 15 1 1 A 44 44 TYR H H 44 8.615 8.504 0.111 1
1 480 . 15 1 1 A 44 44 TYR HA H 44 5.783 5.666 0.117 1
1 487 . 15 1 1 A 44 44 TYR C C 44 174.058 173.486 0.572 1
1 488 . 15 1 1 A 44 44 TYR CA C 44 55.942 56.077 -0.135 1
1 489 . 15 1 1 A 44 44 TYR CB C 44 43.052 41.417 1.635 1
1 494 . 15 1 1 A 44 44 TYR N N 44 117.355 119.441 -2.086 1
1 495 . 15 1 1 A 45 45 CYS H H 45 8.377 8.287 0.090 1
1 496 . 15 1 1 A 45 45 CYS HA H 45 4.772 5.149 -0.377 1
1 499 . 15 1 1 A 45 45 CYS C C 45 173.205 173.859 -0.654 1
1 500 . 15 1 1 A 45 45 CYS CA C 45 55.960 56.878 -0.918 1
1 501 . 15 1 1 A 45 45 CYS CB C 45 30.665 31.227 -0.562 1
1 502 . 15 1 1 A 45 45 CYS N N 45 115.140 118.549 -3.409 1
1 503 . 15 1 1 A 46 46 ARG H H 46 9.165 8.541 0.624 1
1 504 . 15 1 1 A 46 46 ARG HA H 46 4.068 3.919 0.149 1
1 511 . 15 1 1 A 46 46 ARG C C 46 178.440 177.332 1.108 1
1 512 . 15 1 1 A 46 46 ARG CA C 46 56.401 55.967 0.434 1
1 513 . 15 1 1 A 46 46 ARG CB C 46 31.878 31.052 0.826 1
1 516 . 15 1 1 A 46 46 ARG N N 46 121.803 121.227 0.576 1
1 517 . 15 1 1 A 47 47 ALA H H 47 8.273 8.070 0.203 1
1 518 . 15 1 1 A 47 47 ALA HA H 47 3.891 4.151 -0.260 1
1 522 . 15 1 1 A 47 47 ALA C C 47 177.599 177.209 0.390 1
1 523 . 15 1 1 A 47 47 ALA CA C 47 54.796 53.350 1.446 1
1 524 . 15 1 1 A 47 47 ALA CB C 47 18.287 18.619 -0.332 1
1 525 . 15 1 1 A 47 47 ALA N N 47 123.895 123.764 0.131 1
1 526 . 15 1 1 A 48 48 ASP H H 48 8.036 8.092 -0.056 1
1 527 . 15 1 1 A 48 48 ASP HA H 48 4.453 4.817 -0.364 1
1 530 . 15 1 1 A 48 48 ASP C C 48 175.836 175.847 -0.011 1
1 531 . 15 1 1 A 48 48 ASP CA C 48 53.368 52.913 0.455 1
1 532 . 15 1 1 A 48 48 ASP CB C 48 39.964 41.381 -1.417 1
1 533 . 15 1 1 A 48 48 ASP N N 48 112.576 117.685 -5.109 1
1 534 . 15 1 1 A 49 49 GLU H H 49 7.495 7.386 0.109 1
1 535 . 15 1 1 A 49 49 GLU HA H 49 4.308 4.497 -0.189 1
1 540 . 15 1 1 A 49 49 GLU C C 49 175.756 175.692 0.064 1
1 541 . 15 1 1 A 49 49 GLU CA C 49 56.224 55.220 1.004 1
1 542 . 15 1 1 A 49 49 GLU CB C 49 32.248 30.740 1.508 1
1 544 . 15 1 1 A 49 49 GLU N N 49 120.609 119.662 0.947 1
1 545 . 15 1 1 A 50 50 ALA H H 50 8.416 8.578 -0.162 1
1 546 . 15 1 1 A 50 50 ALA HA H 50 4.200 4.496 -0.296 1
1 550 . 15 1 1 A 50 50 ALA C C 50 177.433 177.417 0.016 1
1 551 . 15 1 1 A 50 50 ALA CA C 50 53.297 52.315 0.982 1
1 552 . 15 1 1 A 50 50 ALA CB C 50 19.474 20.642 -1.168 1
1 553 . 15 1 1 A 50 50 ALA N N 50 124.065 123.592 0.473 1
1 554 . 15 1 1 A 51 51 ARG H H 51 7.648 7.611 0.037 1
1 555 . 15 1 1 A 51 51 ARG HA H 51 4.747 4.740 0.007 1
1 562 . 15 1 1 A 51 51 ARG C C 51 173.400 173.404 -0.004 1
1 563 . 15 1 1 A 51 51 ARG CA C 51 52.592 52.267 0.325 1
1 564 . 15 1 1 A 51 51 ARG CB C 51 31.212 32.405 -1.193 1
1 567 . 15 1 1 A 51 51 ARG N N 51 117.798 117.664 0.134 1
1 568 . 15 1 1 A 52 52 PRO HA H 52 4.212 4.445 -0.233 1
1 575 . 15 1 1 A 52 52 PRO C C 52 176.380 176.367 0.013 1
1 576 . 15 1 1 A 52 52 PRO CA C 52 62.360 62.687 -0.327 1
1 577 . 15 1 1 A 52 52 PRO CB C 52 32.331 31.904 0.427 1
1 580 . 15 1 1 A 53 53 ASN H H 53 8.127 7.799 0.328 1
1 581 . 15 1 1 A 53 53 ASN HA H 53 4.651 4.761 -0.110 1
1 586 . 15 1 1 A 53 53 ASN C C 53 174.354 174.441 -0.087 1
1 587 . 15 1 1 A 53 53 ASN CA C 53 53.136 52.502 0.634 1
1 588 . 15 1 1 A 53 53 ASN CB C 53 39.666 38.154 1.512 1
1 589 . 15 1 1 A 53 53 ASN N N 53 119.405 119.785 -0.380 1
1 591 . 15 1 1 A 54 54 THR H H 54 8.425 8.526 -0.101 1
1 592 . 15 1 1 A 54 54 THR HA H 54 5.306 4.411 0.895 1
1 597 . 15 1 1 A 54 54 THR C C 54 173.850 174.145 -0.295 1
1 598 . 15 1 1 A 54 54 THR CA C 54 61.881 63.487 -1.606 1
1 599 . 15 1 1 A 54 54 THR CB C 54 70.573 69.137 1.436 1
1 601 . 15 1 1 A 54 54 THR N N 54 118.968 121.683 -2.715 1
1 602 . 15 1 1 A 55 55 ILE H H 55 9.354 8.852 0.502 1
1 603 . 15 1 1 A 55 55 ILE HA H 55 4.051 4.640 -0.589 1
1 613 . 15 1 1 A 55 55 ILE C C 55 172.975 173.499 -0.524 1
1 614 . 15 1 1 A 55 55 ILE CA C 55 61.003 59.585 1.418 1
1 615 . 15 1 1 A 55 55 ILE CB C 55 41.619 42.022 -0.403 1
1 619 . 15 1 1 A 55 55 ILE N N 55 127.961 126.550 1.411 1
1 620 . 15 1 1 A 56 56 ASP H H 56 8.132 8.642 -0.510 1
1 621 . 15 1 1 A 56 56 ASP HA H 56 5.334 5.298 0.036 1
1 624 . 15 1 1 A 56 56 ASP C C 56 174.969 174.722 0.247 1
1 625 . 15 1 1 A 56 56 ASP CA C 56 53.702 52.744 0.958 1
1 626 . 15 1 1 A 56 56 ASP CB C 56 43.251 43.021 0.230 1
1 627 . 15 1 1 A 56 56 ASP N N 56 125.882 127.055 -1.173 1
1 628 . 15 1 1 A 57 57 PHE H H 57 8.955 8.758 0.197 1
1 629 . 15 1 1 A 57 57 PHE HA H 57 4.915 4.991 -0.076 1
1 637 . 15 1 1 A 57 57 PHE C C 57 177.361 175.423 1.938 1
1 638 . 15 1 1 A 57 57 PHE CA C 57 57.458 56.600 0.858 1
1 639 . 15 1 1 A 57 57 PHE CB C 57 43.737 43.630 0.107 1
1 645 . 15 1 1 A 57 57 PHE N N 57 118.872 122.719 -3.847 1
1 646 . 15 1 1 A 58 58 GLY H H 58 9.552 9.184 0.368 1
1 647 . 15 1 1 A 58 58 GLY HA2 H 58 4.662 4.122 0.540 1
1 648 . 15 1 1 A 58 58 GLY HA3 H 58 4.126 4.199 -0.073 1
1 649 . 15 1 1 A 58 58 GLY C C 58 174.760 174.947 -0.187 1
1 650 . 15 1 1 A 58 58 GLY CA C 58 44.680 44.970 -0.290 1
1 651 . 15 1 1 A 58 58 GLY N N 58 111.551 109.760 1.791 1
1 652 . 15 1 1 A 59 59 LYS H H 59 8.211 8.223 -0.012 1
1 653 . 15 1 1 A 59 59 LYS HA H 59 3.782 3.706 0.076 1
1 662 . 15 1 1 A 59 59 LYS C C 59 176.154 178.251 -2.097 1
1 663 . 15 1 1 A 59 59 LYS CA C 59 59.080 58.685 0.395 1
1 664 . 15 1 1 A 59 59 LYS CB C 59 32.516 31.799 0.717 1
1 668 . 15 1 1 A 59 59 LYS N N 59 115.953 120.435 -4.482 1
1 669 . 15 1 1 A 60 60 ASP H H 60 8.634 8.130 0.504 1
1 670 . 15 1 1 A 60 60 ASP HA H 60 4.882 4.408 0.474 1
1 673 . 15 1 1 A 60 60 ASP C C 60 176.039 176.078 -0.039 1
1 674 . 15 1 1 A 60 60 ASP CA C 60 54.327 57.262 -2.935 1
1 675 . 15 1 1 A 60 60 ASP CB C 60 41.461 41.278 0.183 1
1 676 . 15 1 1 A 60 60 ASP N N 60 117.261 120.262 -3.001 1
1 677 . 15 1 1 A 61 61 ASP H H 61 7.500 8.399 -0.899 1
1 678 . 15 1 1 A 61 61 ASP HA H 61 4.591 4.684 -0.093 1
1 681 . 15 1 1 A 61 61 ASP C C 61 175.140 175.908 -0.768 1
1 682 . 15 1 1 A 61 61 ASP CA C 61 55.342 53.986 1.356 1
1 683 . 15 1 1 A 61 61 ASP CB C 61 42.475 39.966 2.509 1
1 684 . 15 1 1 A 61 61 ASP N N 61 122.319 118.675 3.644 1
1 685 . 15 1 1 A 62 62 GLN H H 62 8.239 8.045 0.194 1
1 686 . 15 1 1 A 62 62 GLN HA H 62 2.569 3.748 -1.179 1
1 693 . 15 1 1 A 62 62 GLN C C 62 172.652 173.486 -0.834 1
1 694 . 15 1 1 A 62 62 GLN CA C 62 54.038 55.523 -1.485 1
1 695 . 15 1 1 A 62 62 GLN CB C 62 31.481 29.271 2.210 1
1 697 . 15 1 1 A 62 62 GLN N N 62 117.458 123.421 -5.963 1
1 699 . 15 1 1 A 63 63 HIS H H 63 6.338 6.756 -0.418 1
1 700 . 15 1 1 A 63 63 HIS HA H 63 4.423 4.241 0.182 1
1 704 . 15 1 1 A 63 63 HIS C C 63 173.031 172.474 0.557 1
1 705 . 15 1 1 A 63 63 HIS CA C 63 54.743 54.015 0.728 1
1 706 . 15 1 1 A 63 63 HIS CB C 63 32.661 30.966 1.695 1
1 708 . 15 1 1 A 63 63 HIS N N 63 113.589 115.540 -1.951 1
1 709 . 15 1 1 A 64 64 PHE H H 64 8.549 8.879 -0.330 1
1 710 . 15 1 1 A 64 64 PHE HA H 64 4.578 5.201 -0.623 1
1 718 . 15 1 1 A 64 64 PHE C C 64 173.015 173.507 -0.492 1
1 719 . 15 1 1 A 64 64 PHE CA C 64 58.516 56.816 1.700 1
1 720 . 15 1 1 A 64 64 PHE CB C 64 43.525 43.405 0.120 1
1 726 . 15 1 1 A 64 64 PHE N N 64 118.214 120.113 -1.899 1
1 727 . 15 1 1 A 65 65 THR H H 65 7.150 7.940 -0.790 1
1 728 . 15 1 1 A 65 65 THR HA H 65 4.930 4.636 0.294 1
1 733 . 15 1 1 A 65 65 THR C C 65 172.457 173.323 -0.866 1
1 734 . 15 1 1 A 65 65 THR CA C 65 61.690 61.680 0.010 1
1 735 . 15 1 1 A 65 65 THR CB C 65 69.593 69.236 0.357 1
1 737 . 15 1 1 A 65 65 THR N N 65 123.198 119.342 3.856 1
1 738 . 15 1 1 A 66 66 VAL H H 66 8.888 8.622 0.266 1
1 739 . 15 1 1 A 66 66 VAL HA H 66 4.018 4.812 -0.794 1
1 747 . 15 1 1 A 66 66 VAL C C 66 174.868 175.516 -0.648 1
1 748 . 15 1 1 A 66 66 VAL CA C 66 61.178 60.767 0.411 1
1 749 . 15 1 1 A 66 66 VAL CB C 66 33.114 33.180 -0.066 1
1 752 . 15 1 1 A 66 66 VAL N N 66 126.840 128.221 -1.381 1
1 753 . 15 1 1 A 67 67 THR H H 67 8.174 8.564 -0.390 1
1 754 . 15 1 1 A 67 67 THR HA H 67 4.816 4.954 -0.138 1
1 759 . 15 1 1 A 67 67 THR C C 67 174.494 174.282 0.212 1
1 760 . 15 1 1 A 67 67 THR CA C 67 59.786 59.528 0.258 1
1 761 . 15 1 1 A 67 67 THR CB C 67 70.887 71.615 -0.728 1
1 763 . 15 1 1 A 67 67 THR N N 67 116.127 117.088 -0.961 1
1 764 . 15 1 1 A 68 68 GLY H H 68 8.570 8.748 -0.178 1
1 765 . 15 1 1 A 68 68 GLY HA2 H 68 3.970 4.023 -0.053 1
1 766 . 15 1 1 A 68 68 GLY HA3 H 68 3.819 4.027 -0.208 1
1 767 . 15 1 1 A 68 68 GLY C C 68 175.636 174.692 0.944 1
1 768 . 15 1 1 A 68 68 GLY CA C 68 46.397 44.927 1.470 1
1 769 . 15 1 1 A 68 68 GLY N N 68 107.146 112.991 -5.845 1
1 770 . 15 1 1 A 69 69 LEU H H 69 8.007 7.679 0.328 1
1 771 . 15 1 1 A 69 69 LEU HA H 69 4.154 4.242 -0.088 1
1 781 . 15 1 1 A 69 69 LEU C C 69 176.830 176.461 0.369 1
1 782 . 15 1 1 A 69 69 LEU CA C 69 54.602 55.211 -0.609 1
1 783 . 15 1 1 A 69 69 LEU CB C 69 41.149 42.143 -0.994 1
1 787 . 15 1 1 A 69 69 LEU N N 69 118.433 123.037 -4.604 1
1 788 . 15 1 1 A 70 70 HIS H H 70 8.866 8.822 0.044 1
1 789 . 15 1 1 A 70 70 HIS HA H 70 4.663 4.649 0.014 1
1 793 . 15 1 1 A 70 70 HIS C C 70 176.667 175.417 1.250 1
1 794 . 15 1 1 A 70 70 HIS CA C 70 55.464 57.195 -1.731 1
1 795 . 15 1 1 A 70 70 HIS CB C 70 32.125 30.047 2.078 1
1 797 . 15 1 1 A 70 70 HIS N N 70 122.457 123.077 -0.620 1
1 798 . 15 1 1 A 71 71 LYS H H 71 8.716 8.790 -0.074 1
1 799 . 15 1 1 A 71 71 LYS HA H 71 4.320 4.261 0.059 1
1 808 . 15 1 1 A 71 71 LYS C C 71 178.110 177.661 0.449 1
1 809 . 15 1 1 A 71 71 LYS CA C 71 57.035 58.332 -1.297 1
1 810 . 15 1 1 A 71 71 LYS CB C 71 33.580 32.675 0.905 1
1 814 . 15 1 1 A 71 71 LYS N N 71 123.173 123.398 -0.225 1
1 815 . 15 1 1 A 72 72 GLY H H 72 7.709 8.818 -1.109 1
1 816 . 15 1 1 A 72 72 GLY HA2 H 72 3.800 3.902 -0.102 1
1 817 . 15 1 1 A 72 72 GLY HA3 H 72 3.769 3.910 -0.141 1
1 818 . 15 1 1 A 72 72 GLY C C 72 174.231 173.871 0.360 1
1 819 . 15 1 1 A 72 72 GLY CA C 72 47.866 46.455 1.411 1
1 820 . 15 1 1 A 72 72 GLY N N 72 114.881 111.974 2.907 1
1 821 . 15 1 1 A 73 73 THR H H 73 8.162 7.547 0.615 1
1 822 . 15 1 1 A 73 73 THR HA H 73 4.584 4.709 -0.125 1
1 827 . 15 1 1 A 73 73 THR C C 73 172.208 173.458 -1.250 1
1 828 . 15 1 1 A 73 73 THR CA C 73 62.307 61.325 0.982 1
1 829 . 15 1 1 A 73 73 THR CB C 73 72.123 71.573 0.550 1
1 831 . 15 1 1 A 73 73 THR N N 73 114.225 114.389 -0.164 1
1 832 . 15 1 1 A 74 74 THR H H 74 8.743 8.728 0.015 1
1 833 . 15 1 1 A 74 74 THR HA H 74 5.138 4.878 0.260 1
1 838 . 15 1 1 A 74 74 THR C C 74 173.376 173.487 -0.111 1
1 839 . 15 1 1 A 74 74 THR CA C 74 62.724 62.847 -0.123 1
1 840 . 15 1 1 A 74 74 THR CB C 74 69.202 69.983 -0.781 1
1 842 . 15 1 1 A 74 74 THR N N 74 123.376 121.261 2.115 1
1 843 . 15 1 1 A 75 75 TYR H H 75 9.549 9.079 0.470 1
1 844 . 15 1 1 A 75 75 TYR HA H 75 4.892 5.191 -0.299 1
1 851 . 15 1 1 A 75 75 TYR C C 75 173.991 175.266 -1.275 1
1 852 . 15 1 1 A 75 75 TYR CA C 75 57.740 56.116 1.624 1
1 853 . 15 1 1 A 75 75 TYR CB C 75 44.580 43.435 1.145 1
1 858 . 15 1 1 A 75 75 TYR N N 75 126.916 124.238 2.678 1
1 859 . 15 1 1 A 76 76 ILE H H 76 8.769 9.085 -0.316 1
1 860 . 15 1 1 A 76 76 ILE HA H 76 4.663 5.040 -0.377 1
1 870 . 15 1 1 A 76 76 ILE C C 76 174.683 175.351 -0.668 1
1 871 . 15 1 1 A 76 76 ILE CA C 76 60.455 60.501 -0.046 1
1 872 . 15 1 1 A 76 76 ILE CB C 76 40.284 39.806 0.478 1
1 876 . 15 1 1 A 76 76 ILE N N 76 119.407 121.158 -1.751 1
1 877 . 15 1 1 A 77 77 PHE H H 77 8.894 9.119 -0.225 1
1 878 . 15 1 1 A 77 77 PHE HA H 77 5.160 5.135 0.025 1
1 886 . 15 1 1 A 77 77 PHE C C 77 174.794 175.317 -0.523 1
1 887 . 15 1 1 A 77 77 PHE CA C 77 56.831 57.346 -0.515 1
1 888 . 15 1 1 A 77 77 PHE CB C 77 43.132 41.392 1.740 1
1 894 . 15 1 1 A 77 77 PHE N N 77 124.622 126.782 -2.160 1
1 895 . 15 1 1 A 78 78 ARG H H 78 9.407 9.304 0.103 1
1 896 . 15 1 1 A 78 78 ARG HA H 78 5.689 5.679 0.010 1
1 904 . 15 1 1 A 78 78 ARG C C 78 174.376 174.457 -0.081 1
1 905 . 15 1 1 A 78 78 ARG CA C 78 54.530 54.621 -0.091 1
1 906 . 15 1 1 A 78 78 ARG CB C 78 34.473 33.854 0.619 1
1 909 . 15 1 1 A 78 78 ARG N N 78 120.055 120.743 -0.688 1
1 911 . 15 1 1 A 79 79 LEU H H 79 9.132 9.153 -0.021 1
1 912 . 15 1 1 A 79 79 LEU HA H 79 5.398 5.200 0.198 1
1 922 . 15 1 1 A 79 79 LEU C C 79 174.006 174.571 -0.565 1
1 923 . 15 1 1 A 79 79 LEU CA C 79 53.401 53.247 0.154 1
1 924 . 15 1 1 A 79 79 LEU CB C 79 48.116 46.520 1.596 1
1 928 . 15 1 1 A 79 79 LEU N N 79 124.907 124.674 0.233 1
1 929 . 15 1 1 A 80 80 ALA H H 80 8.737 7.928 0.809 1
1 930 . 15 1 1 A 80 80 ALA HA H 80 4.871 4.941 -0.070 1
1 934 . 15 1 1 A 80 80 ALA C C 80 176.057 175.846 0.211 1
1 935 . 15 1 1 A 80 80 ALA CA C 80 50.353 51.423 -1.070 1
1 936 . 15 1 1 A 80 80 ALA CB C 80 23.972 23.091 0.881 1
1 937 . 15 1 1 A 80 80 ALA N N 80 128.220 125.428 2.792 1
1 938 . 15 1 1 A 81 81 ALA H H 81 9.890 8.627 1.263 1
1 939 . 15 1 1 A 81 81 ALA HA H 81 4.794 5.029 -0.235 1
1 943 . 15 1 1 A 81 81 ALA C C 81 174.655 176.246 -1.591 1
1 944 . 15 1 1 A 81 81 ALA CA C 81 50.300 51.080 -0.780 1
1 945 . 15 1 1 A 81 81 ALA CB C 81 21.369 20.612 0.757 1
1 946 . 15 1 1 A 81 81 ALA N N 81 123.682 123.866 -0.184 1
1 947 . 15 1 1 A 82 82 LYS H H 82 7.965 8.946 -0.981 1
1 948 . 15 1 1 A 82 82 LYS HA H 82 4.974 5.264 -0.290 1
1 957 . 15 1 1 A 82 82 LYS C C 82 175.671 175.474 0.197 1
1 958 . 15 1 1 A 82 82 LYS CA C 82 54.664 54.617 0.047 1
1 959 . 15 1 1 A 82 82 LYS CB C 82 36.677 35.080 1.597 1
1 963 . 15 1 1 A 82 82 LYS N N 82 118.164 122.230 -4.066 1
1 964 . 15 1 1 A 83 83 ASN H H 83 8.663 8.735 -0.072 1
1 965 . 15 1 1 A 83 83 ASN HA H 83 5.113 5.059 0.054 1
1 970 . 15 1 1 A 83 83 ASN C C 83 176.582 176.726 -0.144 1
1 971 . 15 1 1 A 83 83 ASN CA C 83 51.746 50.657 1.089 1
1 972 . 15 1 1 A 83 83 ASN CB C 83 40.357 40.164 0.193 1
1 973 . 15 1 1 A 83 83 ASN N N 83 124.784 124.123 0.661 1
1 975 . 15 1 1 A 84 84 ARG H H 84 8.873 8.773 0.100 1
1 976 . 15 1 1 A 84 84 ARG HA H 84 3.940 4.001 -0.061 1
1 983 . 15 1 1 A 84 84 ARG C C 84 176.735 177.830 -1.095 1
1 984 . 15 1 1 A 84 84 ARG CA C 84 59.327 59.275 0.052 1
1 985 . 15 1 1 A 84 84 ARG CB C 84 29.282 29.861 -0.579 1
1 988 . 15 1 1 A 84 84 ARG N N 84 117.891 119.120 -1.229 1
1 989 . 15 1 1 A 85 85 ALA H H 85 7.645 7.856 -0.211 1
1 990 . 15 1 1 A 85 85 ALA HA H 85 4.276 4.312 -0.036 1
1 994 . 15 1 1 A 85 85 ALA C C 85 177.479 177.036 0.443 1
1 995 . 15 1 1 A 85 85 ALA CA C 85 52.818 52.615 0.203 1
1 996 . 15 1 1 A 85 85 ALA CB C 85 18.806 19.742 -0.936 1
1 997 . 15 1 1 A 85 85 ALA N N 85 120.306 120.277 0.029 1
1 998 . 15 1 1 A 86 86 GLY H H 86 7.693 7.513 0.180 1
1 999 . 15 1 1 A 86 86 GLY HA2 H 86 4.456 4.077 0.379 1
1 1000 . 15 1 1 A 86 86 GLY HA3 H 86 3.649 4.080 -0.431 1
1 1001 . 15 1 1 A 86 86 GLY C C 86 172.068 172.684 -0.616 1
1 1002 . 15 1 1 A 86 86 GLY CA C 86 44.375 43.941 0.434 1
1 1003 . 15 1 1 A 86 86 GLY N N 86 106.594 103.835 2.759 1
1 1004 . 15 1 1 A 87 87 LEU H H 87 8.203 8.528 -0.325 1
1 1005 . 15 1 1 A 87 87 LEU HA H 87 4.629 4.727 -0.098 1
1 1015 . 15 1 1 A 87 87 LEU C C 87 179.155 176.421 2.734 1
1 1016 . 15 1 1 A 87 87 LEU CA C 87 54.814 55.377 -0.563 1
1 1017 . 15 1 1 A 87 87 LEU CB C 87 43.454 42.544 0.910 1
1 1021 . 15 1 1 A 87 87 LEU N N 87 120.879 122.593 -1.714 1
1 1022 . 15 1 1 A 88 88 GLY H H 88 8.492 8.083 0.409 1
1 1023 . 15 1 1 A 88 88 GLY HA2 H 88 4.339 4.151 0.188 1
1 1024 . 15 1 1 A 88 88 GLY HA3 H 88 4.122 4.158 -0.036 1
1 1025 . 15 1 1 A 88 88 GLY C C 88 173.030 173.290 -0.260 1
1 1026 . 15 1 1 A 88 88 GLY CA C 88 43.970 44.559 -0.589 1
1 1027 . 15 1 1 A 88 88 GLY N N 88 109.903 110.422 -0.519 1
1 1028 . 15 1 1 A 89 89 GLU H H 89 7.638 8.804 -1.166 1
1 1029 . 15 1 1 A 89 89 GLU HA H 89 4.103 4.264 -0.161 1
1 1034 . 15 1 1 A 89 89 GLU C C 89 177.511 175.619 1.892 1
1 1035 . 15 1 1 A 89 89 GLU CA C 89 56.659 57.024 -0.365 1
1 1036 . 15 1 1 A 89 89 GLU CB C 89 31.324 30.646 0.678 1
1 1038 . 15 1 1 A 89 89 GLU N N 89 117.551 122.791 -5.240 1
1 1039 . 15 1 1 A 90 90 GLU H H 90 8.734 8.725 0.009 1
1 1040 . 15 1 1 A 90 90 GLU HA H 90 4.651 5.309 -0.658 1
1 1045 . 15 1 1 A 90 90 GLU C C 90 177.452 174.974 2.478 1
1 1046 . 15 1 1 A 90 90 GLU CA C 90 55.987 55.010 0.977 1
1 1047 . 15 1 1 A 90 90 GLU CB C 90 31.135 32.987 -1.852 1
1 1049 . 15 1 1 A 90 90 GLU N N 90 121.553 120.052 1.501 1
1 1050 . 15 1 1 A 91 91 PHE H H 91 9.411 9.230 0.181 1
1 1051 . 15 1 1 A 91 91 PHE HA H 91 4.665 4.958 -0.293 1
1 1059 . 15 1 1 A 91 91 PHE C C 91 173.944 174.749 -0.805 1
1 1060 . 15 1 1 A 91 91 PHE CA C 91 57.687 58.394 -0.707 1
1 1061 . 15 1 1 A 91 91 PHE CB C 91 40.890 40.606 0.284 1
1 1067 . 15 1 1 A 91 91 PHE N N 91 125.459 125.552 -0.093 1
1 1068 . 15 1 1 A 92 92 GLU H H 92 8.043 7.939 0.104 1
1 1069 . 15 1 1 A 92 92 GLU HA H 92 5.424 5.286 0.138 1
1 1074 . 15 1 1 A 92 92 GLU C C 92 174.295 174.176 0.119 1
1 1075 . 15 1 1 A 92 92 GLU CA C 92 54.378 54.572 -0.194 1
1 1076 . 15 1 1 A 92 92 GLU CB C 92 33.662 33.561 0.101 1
1 1078 . 15 1 1 A 92 92 GLU N N 92 128.905 126.640 2.265 1
1 1079 . 15 1 1 A 93 93 LYS H H 93 9.142 8.654 0.488 1
1 1080 . 15 1 1 A 93 93 LYS HA H 93 4.541 5.016 -0.475 1
1 1089 . 15 1 1 A 93 93 LYS C C 93 173.366 173.931 -0.565 1
1 1090 . 15 1 1 A 93 93 LYS CA C 93 55.343 55.559 -0.216 1
1 1091 . 15 1 1 A 93 93 LYS CB C 93 37.317 35.899 1.418 1
1 1095 . 15 1 1 A 93 93 LYS N N 93 125.231 126.733 -1.502 1
1 1096 . 15 1 1 A 94 94 GLU H H 94 8.655 9.123 -0.468 1
1 1097 . 15 1 1 A 94 94 GLU HA H 94 5.558 5.341 0.217 1
1 1102 . 15 1 1 A 94 94 GLU C C 94 176.238 175.434 0.804 1
1 1103 . 15 1 1 A 94 94 GLU CA C 94 54.632 55.038 -0.406 1
1 1104 . 15 1 1 A 94 94 GLU CB C 94 32.166 32.545 -0.379 1
1 1106 . 15 1 1 A 94 94 GLU N N 94 127.232 128.147 -0.915 1
1 1107 . 15 1 1 A 95 95 ILE H H 95 9.302 8.978 0.324 1
1 1108 . 15 1 1 A 95 95 ILE HA H 95 4.794 5.243 -0.449 1
1 1118 . 15 1 1 A 95 95 ILE C C 95 173.138 174.546 -1.408 1
1 1119 . 15 1 1 A 95 95 ILE CA C 95 58.570 58.591 -0.021 1
1 1120 . 15 1 1 A 95 95 ILE CB C 95 42.420 42.570 -0.150 1
1 1124 . 15 1 1 A 95 95 ILE N N 95 120.711 121.593 -0.882 1
1 1125 . 15 1 1 A 96 96 ARG H H 96 8.589 8.659 -0.070 1
1 1126 . 15 1 1 A 96 96 ARG HA H 96 5.373 4.864 0.509 1
1 1133 . 15 1 1 A 96 96 ARG C C 96 177.147 174.881 2.266 1
1 1134 . 15 1 1 A 96 96 ARG CA C 96 54.045 55.440 -1.395 1
1 1135 . 15 1 1 A 96 96 ARG CB C 96 32.001 33.475 -1.474 1
1 1138 . 15 1 1 A 96 96 ARG N N 96 124.445 121.756 2.689 1
1 1139 . 15 1 1 A 97 97 THR H H 97 9.243 8.497 0.746 1
1 1140 . 15 1 1 A 97 97 THR HA H 97 4.459 4.560 -0.101 1
1 1145 . 15 1 1 A 97 97 THR C C 97 172.745 173.891 -1.146 1
1 1146 . 15 1 1 A 97 97 THR CA C 97 59.637 60.753 -1.116 1
1 1147 . 15 1 1 A 97 97 THR CB C 97 67.687 68.832 -1.145 1
1 1149 . 15 1 1 A 97 97 THR N N 97 119.370 118.191 1.179 1
1 1150 . 15 1 1 A 98 98 PRO HA H 98 4.494 4.759 -0.265 1
1 1157 . 15 1 1 A 98 98 PRO CA C 98 63.117 62.682 0.435 1
1 1158 . 15 1 1 A 98 98 PRO CB C 98 32.500 31.730 0.770 1
1 1161 . 15 1 1 A 99 99 GLU H H 99 8.534 8.389 0.145 1
1 1162 . 15 1 1 A 99 99 GLU HA H 99 4.195 4.254 -0.059 1
1 1167 . 15 1 1 A 99 99 GLU C C 99 175.881 175.719 0.162 1
1 1168 . 15 1 1 A 99 99 GLU CA C 99 56.330 56.532 -0.202 1
1 1169 . 15 1 1 A 99 99 GLU CB C 99 31.062 29.824 1.238 1
1 1171 . 15 1 1 A 99 99 GLU N N 99 119.688 119.226 0.462 1
1 1172 . 15 1 1 A 100 100 ASP H H 100 8.536 8.785 -0.249 1
1 1173 . 15 1 1 A 100 100 ASP HA H 100 4.607 4.614 -0.007 1
1 1176 . 15 1 1 A 100 100 ASP C C 100 176.012 175.222 0.790 1
1 1177 . 15 1 1 A 100 100 ASP CA C 100 54.109 54.347 -0.238 1
1 1178 . 15 1 1 A 100 100 ASP CB C 100 41.562 41.308 0.254 1
1 1179 . 15 1 1 A 100 100 ASP N N 100 119.803 124.257 -4.454 1
1 1180 . 15 1 1 A 101 101 LEU H H 101 8.403 8.291 0.112 1
1 1181 . 15 1 1 A 101 101 LEU HA H 101 4.426 4.628 -0.202 1
1 1191 . 15 1 1 A 101 101 LEU C C 101 177.534 176.452 1.082 1
1 1192 . 15 1 1 A 101 101 LEU CA C 101 55.113 54.236 0.877 1
1 1193 . 15 1 1 A 101 101 LEU CB C 101 42.156 44.856 -2.700 1
1 1197 . 15 1 1 A 101 101 LEU N N 101 123.876 124.244 -0.368 1
1 1198 . 15 1 1 A 102 102 SER H H 102 8.413 8.822 -0.409 1
1 1199 . 15 1 1 A 102 102 SER HA H 102 4.434 4.181 0.253 1
1 1202 . 15 1 1 A 102 102 SER C C 102 174.674 174.569 0.105 1
1 1203 . 15 1 1 A 102 102 SER CA C 102 58.798 60.849 -2.051 1
1 1204 . 15 1 1 A 102 102 SER CB C 102 63.854 63.314 0.540 1
1 1205 . 15 1 1 A 102 102 SER N N 102 116.667 120.679 -4.012 1
1 1206 . 15 1 1 A 103 103 GLY H H 103 8.213 7.784 0.429 1
1 1207 . 15 1 1 A 103 103 GLY HA2 H 103 4.164 4.082 0.082 1
1 1208 . 15 1 1 A 103 103 GLY HA3 H 103 4.057 4.083 -0.026 1
1 1209 . 15 1 1 A 103 103 GLY C C 103 171.822 173.470 -1.648 1
1 1210 . 15 1 1 A 103 103 GLY CA C 103 44.658 44.886 -0.228 1
1 1211 . 15 1 1 A 103 103 GLY N N 103 110.592 108.965 1.627 1
1 1212 . 15 1 1 A 104 104 PRO HA H 104 4.475 4.468 0.007 1
1 1219 . 15 1 1 A 104 104 PRO C C 104 177.445 176.273 1.172 1
1 1220 . 15 1 1 A 104 104 PRO CA C 104 63.312 64.026 -0.714 1
1 1221 . 15 1 1 A 104 104 PRO CB C 104 32.190 31.738 0.452 1
1 1224 . 15 1 1 A 105 105 SER H H 105 8.538 7.633 0.905 1
1 1225 . 15 1 1 A 105 105 SER HA H 105 4.541 4.801 -0.260 1
1 1228 . 15 1 1 A 105 105 SER C C 105 174.616 172.234 2.382 1
1 1229 . 15 1 1 A 105 105 SER CA C 105 58.270 57.583 0.687 1
1 1230 . 15 1 1 A 105 105 SER CB C 105 63.895 67.098 -3.203 1
1 1231 . 15 1 1 A 105 105 SER N N 105 116.446 114.897 1.549 1
1 1232 . 15 1 1 A 106 106 SER H H 106 8.350 8.570 -0.220 1
1 1233 . 15 1 1 A 106 106 SER HA H 106 4.541 5.080 -0.539 1
1 1236 . 15 1 1 A 106 106 SER C C 106 174.530 174.586 -0.056 1
1 1237 . 15 1 1 A 106 106 SER CA C 106 58.357 57.550 0.807 1
1 1238 . 15 1 1 A 106 106 SER CB C 106 64.020 65.044 -1.024 1
1 1239 . 15 1 1 A 106 106 SER N N 106 117.448 118.438 -0.990 1
1 1 . 16 1 1 A 2 2 SER C C 2 174.723 173.766 0.957 1
1 2 . 16 1 1 A 2 2 SER CA C 2 58.446 57.595 0.851 1
1 3 . 16 1 1 A 2 2 SER CB C 2 63.566 62.228 1.338 1
1 4 . 16 1 1 A 3 3 SER H H 3 8.350 8.729 -0.379 1
1 5 . 16 1 1 A 3 3 SER C C 3 173.961 174.453 -0.492 1
1 6 . 16 1 1 A 3 3 SER CA C 3 58.428 58.024 0.404 1
1 7 . 16 1 1 A 3 3 SER CB C 3 63.937 63.349 0.588 1
1 8 . 16 1 1 A 3 3 SER N N 3 117.923 120.651 -2.728 1
1 9 . 16 1 1 A 4 4 GLY H H 4 8.050 8.458 -0.408 1
1 10 . 16 1 1 A 4 4 GLY C C 4 179.009 174.224 4.785 1
1 11 . 16 1 1 A 4 4 GLY CA C 4 46.174 47.290 -1.116 1
1 12 . 16 1 1 A 4 4 GLY N N 4 116.890 109.960 6.930 1
1 13 . 16 1 1 A 7 7 GLY HA2 H 7 4.340 4.146 0.194 1
1 14 . 16 1 1 A 7 7 GLY HA3 H 7 3.629 4.147 -0.518 1
1 15 . 16 1 1 A 7 7 GLY CA C 7 44.381 44.283 0.098 1
1 16 . 16 1 1 A 8 8 PRO HA H 8 4.476 4.566 -0.090 1
1 23 . 16 1 1 A 8 8 PRO C C 8 176.235 177.296 -1.061 1
1 24 . 16 1 1 A 8 8 PRO CA C 8 62.995 62.605 0.390 1
1 25 . 16 1 1 A 8 8 PRO CB C 8 33.266 32.790 0.476 1
1 28 . 16 1 1 A 9 9 GLY H H 9 8.585 8.395 0.190 1
1 29 . 16 1 1 A 9 9 GLY HA2 H 9 4.326 4.117 0.209 1
1 30 . 16 1 1 A 9 9 GLY HA3 H 9 4.009 4.121 -0.112 1
1 31 . 16 1 1 A 9 9 GLY C C 9 172.998 173.077 -0.079 1
1 32 . 16 1 1 A 9 9 GLY CA C 9 44.393 44.129 0.264 1
1 33 . 16 1 1 A 9 9 GLY N N 9 106.004 107.920 -1.916 1
1 34 . 16 1 1 A 10 10 ARG H H 10 8.548 8.284 0.264 1
1 35 . 16 1 1 A 10 10 ARG HA H 10 4.654 4.849 -0.195 1
1 41 . 16 1 1 A 10 10 ARG C C 10 175.780 175.052 0.728 1
1 42 . 16 1 1 A 10 10 ARG CA C 10 54.708 54.696 0.012 1
1 43 . 16 1 1 A 10 10 ARG CB C 10 31.448 31.139 0.309 1
1 45 . 16 1 1 A 10 10 ARG N N 10 119.407 117.371 2.036 1
1 46 . 16 1 1 A 11 11 PRO HA H 11 4.611 4.588 0.023 1
1 53 . 16 1 1 A 11 11 PRO C C 11 173.510 175.412 -1.902 1
1 54 . 16 1 1 A 11 11 PRO CA C 11 62.360 62.637 -0.277 1
1 55 . 16 1 1 A 11 11 PRO CB C 11 33.402 32.274 1.128 1
1 58 . 16 1 1 A 12 12 THR H H 12 7.572 7.985 -0.413 1
1 59 . 16 1 1 A 12 12 THR HA H 12 3.796 4.258 -0.462 1
1 64 . 16 1 1 A 12 12 THR C C 12 172.337 173.329 -0.992 1
1 65 . 16 1 1 A 12 12 THR CA C 12 61.778 61.366 0.412 1
1 66 . 16 1 1 A 12 12 THR CB C 12 70.561 68.659 1.902 1
1 68 . 16 1 1 A 12 12 THR N N 12 109.653 116.811 -7.158 1
1 69 . 16 1 1 A 13 13 MET H H 13 5.605 8.580 -2.975 1
1 70 . 16 1 1 A 13 13 MET HA H 13 5.091 4.997 0.094 1
1 78 . 16 1 1 A 13 13 MET C C 13 172.639 175.081 -2.442 1
1 79 . 16 1 1 A 13 13 MET CA C 13 54.168 53.695 0.473 1
1 80 . 16 1 1 A 13 13 MET CB C 13 37.632 34.678 2.954 1
1 83 . 16 1 1 A 13 13 MET N N 13 121.634 127.021 -5.387 1
1 84 . 16 1 1 A 14 14 MET H H 14 9.254 9.251 0.003 1
1 85 . 16 1 1 A 14 14 MET HA H 14 4.662 5.165 -0.503 1
1 93 . 16 1 1 A 14 14 MET C C 14 174.388 174.649 -0.261 1
1 94 . 16 1 1 A 14 14 MET CA C 14 54.673 54.444 0.229 1
1 95 . 16 1 1 A 14 14 MET CB C 14 34.907 35.078 -0.171 1
1 98 . 16 1 1 A 14 14 MET N N 14 125.746 123.860 1.886 1
1 99 . 16 1 1 A 15 15 ILE H H 15 8.555 9.299 -0.744 1
1 100 . 16 1 1 A 15 15 ILE HA H 15 4.882 4.968 -0.086 1
1 110 . 16 1 1 A 15 15 ILE C C 15 174.962 175.079 -0.117 1
1 111 . 16 1 1 A 15 15 ILE CA C 15 60.685 60.436 0.249 1
1 112 . 16 1 1 A 15 15 ILE CB C 15 40.878 38.730 2.148 1
1 116 . 16 1 1 A 15 15 ILE N N 15 121.623 125.760 -4.137 1
1 117 . 16 1 1 A 16 16 SER H H 16 8.703 8.782 -0.079 1
1 118 . 16 1 1 A 16 16 SER HA H 16 4.922 5.056 -0.134 1
1 121 . 16 1 1 A 16 16 SER C C 16 173.860 173.148 0.712 1
1 122 . 16 1 1 A 16 16 SER CA C 16 56.524 57.241 -0.717 1
1 123 . 16 1 1 A 16 16 SER CB C 16 65.004 65.650 -0.646 1
1 124 . 16 1 1 A 16 16 SER N N 16 122.261 124.982 -2.721 1
1 125 . 16 1 1 A 17 17 THR H H 17 8.759 8.677 0.082 1
1 126 . 16 1 1 A 17 17 THR HA H 17 4.885 4.630 0.255 1
1 131 . 16 1 1 A 17 17 THR C C 17 175.018 174.650 0.368 1
1 132 . 16 1 1 A 17 17 THR CA C 17 60.315 61.070 -0.755 1
1 133 . 16 1 1 A 17 17 THR CB C 17 69.799 69.837 -0.038 1
1 135 . 16 1 1 A 17 17 THR N N 17 115.660 117.102 -1.442 1
1 136 . 16 1 1 A 18 18 THR H H 18 8.038 8.895 -0.857 1
1 137 . 16 1 1 A 18 18 THR HA H 18 4.596 4.356 0.240 1
1 142 . 16 1 1 A 18 18 THR CA C 18 60.707 62.295 -1.588 1
1 143 . 16 1 1 A 18 18 THR CB C 18 71.082 69.276 1.806 1
1 145 . 16 1 1 A 18 18 THR N N 18 112.362 116.008 -3.646 1
1 146 . 16 1 1 A 19 19 ALA H H 19 8.545 7.445 1.100 1
1 147 . 16 1 1 A 19 19 ALA HA H 19 4.412 4.425 -0.013 1
1 151 . 16 1 1 A 19 19 ALA C C 19 177.034 177.232 -0.198 1
1 152 . 16 1 1 A 19 19 ALA CA C 19 52.264 51.640 0.624 1
1 153 . 16 1 1 A 19 19 ALA CB C 19 19.292 20.909 -1.617 1
1 154 . 16 1 1 A 19 19 ALA N N 19 119.589 123.440 -3.851 1
1 155 . 16 1 1 A 20 20 MET H H 20 8.145 8.497 -0.352 1
1 156 . 16 1 1 A 20 20 MET HA H 20 4.447 4.250 0.197 1
1 164 . 16 1 1 A 20 20 MET C C 20 175.676 176.581 -0.905 1
1 165 . 16 1 1 A 20 20 MET CA C 20 55.764 54.941 0.823 1
1 166 . 16 1 1 A 20 20 MET CB C 20 31.495 32.002 -0.507 1
1 169 . 16 1 1 A 20 20 MET N N 20 116.950 118.747 -1.797 1
1 170 . 16 1 1 A 21 21 ASN H H 21 8.275 8.987 -0.712 1
1 171 . 16 1 1 A 21 21 ASN HA H 21 4.452 4.338 0.114 1
1 176 . 16 1 1 A 21 21 ASN C C 21 174.100 173.751 0.349 1
1 177 . 16 1 1 A 21 21 ASN CA C 21 54.320 54.611 -0.291 1
1 178 . 16 1 1 A 21 21 ASN CB C 21 37.234 37.169 0.065 1
1 179 . 16 1 1 A 21 21 ASN N N 21 113.198 118.511 -5.313 1
1 181 . 16 1 1 A 22 22 THR H H 22 7.071 6.981 0.090 1
1 182 . 16 1 1 A 22 22 THR HA H 22 5.218 5.322 -0.104 1
1 187 . 16 1 1 A 22 22 THR C C 22 173.301 172.812 0.489 1
1 188 . 16 1 1 A 22 22 THR CA C 22 59.399 60.367 -0.968 1
1 189 . 16 1 1 A 22 22 THR CB C 22 72.714 71.638 1.076 1
1 191 . 16 1 1 A 22 22 THR N N 22 107.603 107.673 -0.070 1
1 192 . 16 1 1 A 23 23 ALA H H 23 8.687 8.773 -0.086 1
1 193 . 16 1 1 A 23 23 ALA HA H 23 4.925 5.024 -0.099 1
1 197 . 16 1 1 A 23 23 ALA C C 23 174.100 175.743 -1.643 1
1 198 . 16 1 1 A 23 23 ALA CA C 23 50.812 50.049 0.763 1
1 199 . 16 1 1 A 23 23 ALA CB C 23 21.122 21.159 -0.037 1
1 200 . 16 1 1 A 23 23 ALA N N 23 121.937 126.916 -4.979 1
1 201 . 16 1 1 A 24 24 LEU H H 24 8.833 8.820 0.013 1
1 202 . 16 1 1 A 24 24 LEU HA H 24 4.673 4.559 0.114 1
1 212 . 16 1 1 A 24 24 LEU C C 24 175.140 174.588 0.552 1
1 213 . 16 1 1 A 24 24 LEU CA C 24 54.320 54.810 -0.490 1
1 214 . 16 1 1 A 24 24 LEU CB C 24 42.518 43.098 -0.580 1
1 218 . 16 1 1 A 24 24 LEU N N 24 123.721 126.277 -2.556 1
1 219 . 16 1 1 A 25 25 LEU H H 25 9.176 9.109 0.067 1
1 220 . 16 1 1 A 25 25 LEU HA H 25 5.112 5.060 0.052 1
1 230 . 16 1 1 A 25 25 LEU C C 25 176.414 175.884 0.530 1
1 231 . 16 1 1 A 25 25 LEU CA C 25 54.108 53.111 0.997 1
1 232 . 16 1 1 A 25 25 LEU CB C 25 43.230 43.098 0.132 1
1 236 . 16 1 1 A 25 25 LEU N N 25 128.589 128.727 -0.138 1
1 237 . 16 1 1 A 26 26 GLN H H 26 8.556 8.549 0.007 1
1 238 . 16 1 1 A 26 26 GLN HA H 26 4.737 4.926 -0.189 1
1 245 . 16 1 1 A 26 26 GLN C C 26 174.372 174.231 0.141 1
1 246 . 16 1 1 A 26 26 GLN CA C 26 56.365 54.471 1.894 1
1 247 . 16 1 1 A 26 26 GLN CB C 26 33.320 31.968 1.352 1
1 249 . 16 1 1 A 26 26 GLN N N 26 119.630 122.861 -3.231 1
1 251 . 16 1 1 A 27 27 TRP H H 27 8.080 8.317 -0.237 1
1 252 . 16 1 1 A 27 27 TRP HA H 27 5.441 5.865 -0.424 1
1 261 . 16 1 1 A 27 27 TRP CA C 27 55.957 54.573 1.384 1
1 262 . 16 1 1 A 27 27 TRP CB C 27 32.517 32.320 0.197 1
1 268 . 16 1 1 A 27 27 TRP N N 27 121.276 121.236 0.040 1
1 270 . 16 1 1 A 28 28 HIS H H 28 8.262 8.675 -0.413 1
1 271 . 16 1 1 A 28 28 HIS HA H 28 4.997 4.990 0.007 1
1 275 . 16 1 1 A 28 28 HIS CA C 28 53.028 53.947 -0.919 1
1 276 . 16 1 1 A 28 28 HIS CB C 28 32.832 32.836 -0.004 1
1 278 . 16 1 1 A 28 28 HIS N N 28 116.245 117.402 -1.157 1
1 279 . 16 1 1 A 29 29 PRO HA H 29 4.984 4.716 0.268 1
1 286 . 16 1 1 A 29 29 PRO CA C 29 61.498 62.062 -0.564 1
1 287 . 16 1 1 A 29 29 PRO CB C 29 30.709 32.126 -1.417 1
1 290 . 16 1 1 A 30 30 PRO HA H 30 4.449 4.666 -0.217 1
1 297 . 16 1 1 A 30 30 PRO C C 30 175.733 176.406 -0.673 1
1 298 . 16 1 1 A 30 30 PRO CA C 30 62.245 62.504 -0.259 1
1 299 . 16 1 1 A 30 30 PRO CB C 30 32.083 33.471 -1.388 1
1 302 . 16 1 1 A 31 31 LYS H H 31 8.403 8.731 -0.328 1
1 303 . 16 1 1 A 31 31 LYS HA H 31 4.084 4.466 -0.382 1
1 312 . 16 1 1 A 31 31 LYS C C 31 177.166 178.209 -1.043 1
1 313 . 16 1 1 A 31 31 LYS CA C 31 57.866 57.196 0.670 1
1 314 . 16 1 1 A 31 31 LYS CB C 31 32.698 34.327 -1.629 1
1 318 . 16 1 1 A 31 31 LYS N N 31 121.693 120.459 1.234 1
1 319 . 16 1 1 A 32 32 GLU H H 32 8.102 7.854 0.248 1
1 320 . 16 1 1 A 32 32 GLU HA H 32 4.365 4.476 -0.111 1
1 325 . 16 1 1 A 32 32 GLU C C 32 174.248 175.865 -1.617 1
1 326 . 16 1 1 A 32 32 GLU CA C 32 55.448 56.053 -0.605 1
1 327 . 16 1 1 A 32 32 GLU CB C 32 29.405 30.193 -0.788 1
1 329 . 16 1 1 A 32 32 GLU N N 32 118.742 116.945 1.797 1
1 330 . 16 1 1 A 33 33 LEU H H 33 8.420 7.525 0.895 1
1 331 . 16 1 1 A 33 33 LEU HA H 33 4.499 4.772 -0.273 1
1 341 . 16 1 1 A 33 33 LEU C C 33 173.036 174.964 -1.928 1
1 342 . 16 1 1 A 33 33 LEU CA C 33 52.863 51.765 1.098 1
1 343 . 16 1 1 A 33 33 LEU CB C 33 42.535 43.459 -0.924 1
1 347 . 16 1 1 A 33 33 LEU N N 33 125.181 123.374 1.807 1
1 348 . 16 1 1 A 34 34 PRO HA H 34 4.488 4.446 0.042 1
1 355 . 16 1 1 A 34 34 PRO C C 34 177.544 177.028 0.516 1
1 356 . 16 1 1 A 34 34 PRO CA C 34 62.889 63.402 -0.513 1
1 357 . 16 1 1 A 34 34 PRO CB C 34 31.472 31.139 0.333 1
1 360 . 16 1 1 A 35 35 GLY H H 35 8.397 8.506 -0.109 1
1 361 . 16 1 1 A 35 35 GLY HA2 H 35 4.059 4.111 -0.052 1
1 362 . 16 1 1 A 35 35 GLY HA3 H 35 3.716 4.111 -0.395 1
1 363 . 16 1 1 A 35 35 GLY C C 35 173.356 172.135 1.221 1
1 364 . 16 1 1 A 35 35 GLY CA C 35 45.892 44.877 1.015 1
1 365 . 16 1 1 A 35 35 GLY N N 35 110.524 112.135 -1.611 1
1 366 . 16 1 1 A 36 36 GLU H H 36 8.091 8.461 -0.370 1
1 367 . 16 1 1 A 36 36 GLU HA H 36 4.371 5.063 -0.692 1
1 372 . 16 1 1 A 36 36 GLU C C 36 174.864 174.546 0.318 1
1 373 . 16 1 1 A 36 36 GLU CA C 36 55.201 54.866 0.335 1
1 374 . 16 1 1 A 36 36 GLU CB C 36 31.878 33.203 -1.325 1
1 376 . 16 1 1 A 36 36 GLU N N 36 122.202 120.465 1.737 1
1 377 . 16 1 1 A 37 37 LEU H H 37 8.307 8.708 -0.401 1
1 378 . 16 1 1 A 37 37 LEU HA H 37 4.288 4.285 0.003 1
1 388 . 16 1 1 A 37 37 LEU C C 37 176.702 175.974 0.728 1
1 389 . 16 1 1 A 37 37 LEU CA C 37 55.342 56.656 -1.314 1
1 390 . 16 1 1 A 37 37 LEU CB C 37 42.715 42.203 0.512 1
1 394 . 16 1 1 A 37 37 LEU N N 37 123.204 125.848 -2.644 1
1 395 . 16 1 1 A 38 38 LEU H H 38 8.909 8.675 0.234 1
1 396 . 16 1 1 A 38 38 LEU HA H 38 4.640 4.742 -0.102 1
1 406 . 16 1 1 A 38 38 LEU C C 38 177.202 176.292 0.910 1
1 407 . 16 1 1 A 38 38 LEU CA C 38 54.390 54.685 -0.295 1
1 408 . 16 1 1 A 38 38 LEU CB C 38 43.770 43.632 0.138 1
1 412 . 16 1 1 A 38 38 LEU N N 38 123.021 126.810 -3.789 1
1 413 . 16 1 1 A 39 39 GLY H H 39 7.113 6.952 0.161 1
1 414 . 16 1 1 A 39 39 GLY HA2 H 39 4.816 3.594 1.222 1
1 415 . 16 1 1 A 39 39 GLY HA3 H 39 3.276 3.936 -0.660 1
1 416 . 16 1 1 A 39 39 GLY C C 39 169.863 170.319 -0.456 1
1 417 . 16 1 1 A 39 39 GLY CA C 39 44.622 45.348 -0.726 1
1 418 . 16 1 1 A 39 39 GLY N N 39 104.137 104.915 -0.778 1
1 419 . 16 1 1 A 40 40 TYR H H 40 8.318 8.874 -0.556 1
1 420 . 16 1 1 A 40 40 TYR HA H 40 5.414 5.188 0.226 1
1 425 . 16 1 1 A 40 40 TYR C C 40 174.448 172.141 2.307 1
1 426 . 16 1 1 A 40 40 TYR CA C 40 56.178 56.480 -0.302 1
1 427 . 16 1 1 A 40 40 TYR CB C 40 44.191 40.671 3.520 1
1 430 . 16 1 1 A 40 40 TYR N N 40 114.036 115.480 -1.444 1
1 431 . 16 1 1 A 41 41 ARG H H 41 9.347 8.822 0.525 1
1 432 . 16 1 1 A 41 41 ARG HA H 41 5.092 5.381 -0.289 1
1 440 . 16 1 1 A 41 41 ARG C C 41 174.097 174.027 0.070 1
1 441 . 16 1 1 A 41 41 ARG CA C 41 56.100 54.214 1.886 1
1 442 . 16 1 1 A 41 41 ARG CB C 41 34.508 33.128 1.380 1
1 445 . 16 1 1 A 41 41 ARG N N 41 122.231 121.133 1.098 1
1 447 . 16 1 1 A 42 42 LEU H H 42 9.546 9.097 0.449 1
1 448 . 16 1 1 A 42 42 LEU HA H 42 5.459 5.279 0.180 1
1 458 . 16 1 1 A 42 42 LEU C C 42 174.913 174.680 0.233 1
1 459 . 16 1 1 A 42 42 LEU CA C 42 52.997 53.397 -0.400 1
1 460 . 16 1 1 A 42 42 LEU CB C 42 46.413 45.584 0.829 1
1 464 . 16 1 1 A 42 42 LEU N N 42 132.335 127.625 4.710 1
1 465 . 16 1 1 A 43 43 GLN H H 43 9.502 9.237 0.265 1
1 466 . 16 1 1 A 43 43 GLN HA H 43 5.847 5.428 0.419 1
1 473 . 16 1 1 A 43 43 GLN C C 43 175.329 174.002 1.327 1
1 474 . 16 1 1 A 43 43 GLN CA C 43 54.005 54.483 -0.478 1
1 475 . 16 1 1 A 43 43 GLN CB C 43 33.429 31.737 1.692 1
1 477 . 16 1 1 A 43 43 GLN N N 43 123.932 125.270 -1.338 1
1 479 . 16 1 1 A 44 44 TYR H H 44 8.615 8.472 0.143 1
1 480 . 16 1 1 A 44 44 TYR HA H 44 5.783 5.655 0.128 1
1 487 . 16 1 1 A 44 44 TYR C C 44 174.058 173.516 0.542 1
1 488 . 16 1 1 A 44 44 TYR CA C 44 55.942 56.154 -0.212 1
1 489 . 16 1 1 A 44 44 TYR CB C 44 43.052 41.641 1.411 1
1 494 . 16 1 1 A 44 44 TYR N N 44 117.355 119.616 -2.261 1
1 495 . 16 1 1 A 45 45 CYS H H 45 8.377 8.191 0.186 1
1 496 . 16 1 1 A 45 45 CYS HA H 45 4.772 5.016 -0.244 1
1 499 . 16 1 1 A 45 45 CYS C C 45 173.205 173.641 -0.436 1
1 500 . 16 1 1 A 45 45 CYS CA C 45 55.960 56.835 -0.875 1
1 501 . 16 1 1 A 45 45 CYS CB C 45 30.665 31.287 -0.622 1
1 502 . 16 1 1 A 45 45 CYS N N 45 115.140 118.385 -3.245 1
1 503 . 16 1 1 A 46 46 ARG H H 46 9.165 8.474 0.691 1
1 504 . 16 1 1 A 46 46 ARG HA H 46 4.068 3.512 0.556 1
1 511 . 16 1 1 A 46 46 ARG C C 46 178.440 177.613 0.827 1
1 512 . 16 1 1 A 46 46 ARG CA C 46 56.401 56.011 0.390 1
1 513 . 16 1 1 A 46 46 ARG CB C 46 31.878 30.448 1.430 1
1 516 . 16 1 1 A 46 46 ARG N N 46 121.803 121.283 0.520 1
1 517 . 16 1 1 A 47 47 ALA H H 47 8.273 8.778 -0.505 1
1 518 . 16 1 1 A 47 47 ALA HA H 47 3.891 3.988 -0.097 1
1 522 . 16 1 1 A 47 47 ALA C C 47 177.599 177.936 -0.337 1
1 523 . 16 1 1 A 47 47 ALA CA C 47 54.796 54.269 0.527 1
1 524 . 16 1 1 A 47 47 ALA CB C 47 18.287 18.522 -0.235 1
1 525 . 16 1 1 A 47 47 ALA N N 47 123.895 124.736 -0.841 1
1 526 . 16 1 1 A 48 48 ASP H H 48 8.036 7.807 0.229 1
1 527 . 16 1 1 A 48 48 ASP HA H 48 4.453 4.643 -0.190 1
1 530 . 16 1 1 A 48 48 ASP C C 48 175.836 176.119 -0.283 1
1 531 . 16 1 1 A 48 48 ASP CA C 48 53.368 54.625 -1.257 1
1 532 . 16 1 1 A 48 48 ASP CB C 48 39.964 41.602 -1.638 1
1 533 . 16 1 1 A 48 48 ASP N N 48 112.576 116.929 -4.353 1
1 534 . 16 1 1 A 49 49 GLU H H 49 7.495 7.812 -0.317 1
1 535 . 16 1 1 A 49 49 GLU HA H 49 4.308 4.422 -0.114 1
1 540 . 16 1 1 A 49 49 GLU C C 49 175.756 175.859 -0.103 1
1 541 . 16 1 1 A 49 49 GLU CA C 49 56.224 55.492 0.732 1
1 542 . 16 1 1 A 49 49 GLU CB C 49 32.248 30.514 1.734 1
1 544 . 16 1 1 A 49 49 GLU N N 49 120.609 119.249 1.360 1
1 545 . 16 1 1 A 50 50 ALA H H 50 8.416 8.484 -0.068 1
1 546 . 16 1 1 A 50 50 ALA HA H 50 4.200 4.458 -0.258 1
1 550 . 16 1 1 A 50 50 ALA C C 50 177.433 176.654 0.779 1
1 551 . 16 1 1 A 50 50 ALA CA C 50 53.297 52.371 0.926 1
1 552 . 16 1 1 A 50 50 ALA CB C 50 19.474 20.629 -1.155 1
1 553 . 16 1 1 A 50 50 ALA N N 50 124.065 123.181 0.884 1
1 554 . 16 1 1 A 51 51 ARG H H 51 7.648 7.690 -0.042 1
1 555 . 16 1 1 A 51 51 ARG HA H 51 4.747 4.531 0.216 1
1 562 . 16 1 1 A 51 51 ARG C C 51 173.400 173.888 -0.488 1
1 563 . 16 1 1 A 51 51 ARG CA C 51 52.592 52.169 0.423 1
1 564 . 16 1 1 A 51 51 ARG CB C 51 31.212 30.862 0.350 1
1 567 . 16 1 1 A 51 51 ARG N N 51 117.798 118.291 -0.493 1
1 568 . 16 1 1 A 52 52 PRO HA H 52 4.212 4.445 -0.233 1
1 575 . 16 1 1 A 52 52 PRO C C 52 176.380 176.007 0.373 1
1 576 . 16 1 1 A 52 52 PRO CA C 52 62.360 62.616 -0.256 1
1 577 . 16 1 1 A 52 52 PRO CB C 52 32.331 32.039 0.292 1
1 580 . 16 1 1 A 53 53 ASN H H 53 8.127 7.902 0.225 1
1 581 . 16 1 1 A 53 53 ASN HA H 53 4.651 4.775 -0.124 1
1 586 . 16 1 1 A 53 53 ASN C C 53 174.354 174.260 0.094 1
1 587 . 16 1 1 A 53 53 ASN CA C 53 53.136 52.325 0.811 1
1 588 . 16 1 1 A 53 53 ASN CB C 53 39.666 38.417 1.249 1
1 589 . 16 1 1 A 53 53 ASN N N 53 119.405 119.617 -0.212 1
1 591 . 16 1 1 A 54 54 THR H H 54 8.425 8.561 -0.136 1
1 592 . 16 1 1 A 54 54 THR HA H 54 5.306 4.431 0.875 1
1 597 . 16 1 1 A 54 54 THR C C 54 173.850 174.218 -0.368 1
1 598 . 16 1 1 A 54 54 THR CA C 54 61.881 63.478 -1.597 1
1 599 . 16 1 1 A 54 54 THR CB C 54 70.573 69.100 1.473 1
1 601 . 16 1 1 A 54 54 THR N N 54 118.968 120.794 -1.826 1
1 602 . 16 1 1 A 55 55 ILE H H 55 9.354 8.705 0.649 1
1 603 . 16 1 1 A 55 55 ILE HA H 55 4.051 4.554 -0.503 1
1 613 . 16 1 1 A 55 55 ILE C C 55 172.975 173.493 -0.518 1
1 614 . 16 1 1 A 55 55 ILE CA C 55 61.003 59.753 1.250 1
1 615 . 16 1 1 A 55 55 ILE CB C 55 41.619 42.253 -0.634 1
1 619 . 16 1 1 A 55 55 ILE N N 55 127.961 126.528 1.433 1
1 620 . 16 1 1 A 56 56 ASP H H 56 8.132 8.748 -0.616 1
1 621 . 16 1 1 A 56 56 ASP HA H 56 5.334 5.285 0.049 1
1 624 . 16 1 1 A 56 56 ASP C C 56 174.969 174.736 0.233 1
1 625 . 16 1 1 A 56 56 ASP CA C 56 53.702 52.803 0.899 1
1 626 . 16 1 1 A 56 56 ASP CB C 56 43.251 42.953 0.298 1
1 627 . 16 1 1 A 56 56 ASP N N 56 125.882 127.199 -1.317 1
1 628 . 16 1 1 A 57 57 PHE H H 57 8.955 8.735 0.220 1
1 629 . 16 1 1 A 57 57 PHE HA H 57 4.915 5.043 -0.128 1
1 637 . 16 1 1 A 57 57 PHE C C 57 177.361 175.615 1.746 1
1 638 . 16 1 1 A 57 57 PHE CA C 57 57.458 56.664 0.794 1
1 639 . 16 1 1 A 57 57 PHE CB C 57 43.737 43.347 0.390 1
1 645 . 16 1 1 A 57 57 PHE N N 57 118.872 123.068 -4.196 1
1 646 . 16 1 1 A 58 58 GLY H H 58 9.552 8.737 0.815 1
1 647 . 16 1 1 A 58 58 GLY HA2 H 58 4.662 4.134 0.528 1
1 648 . 16 1 1 A 58 58 GLY HA3 H 58 4.126 4.197 -0.071 1
1 649 . 16 1 1 A 58 58 GLY C C 58 174.760 174.964 -0.204 1
1 650 . 16 1 1 A 58 58 GLY CA C 58 44.680 45.095 -0.415 1
1 651 . 16 1 1 A 58 58 GLY N N 58 111.551 110.025 1.526 1
1 652 . 16 1 1 A 59 59 LYS H H 59 8.211 8.697 -0.486 1
1 653 . 16 1 1 A 59 59 LYS HA H 59 3.782 3.698 0.084 1
1 662 . 16 1 1 A 59 59 LYS C C 59 176.154 178.031 -1.877 1
1 663 . 16 1 1 A 59 59 LYS CA C 59 59.080 58.562 0.518 1
1 664 . 16 1 1 A 59 59 LYS CB C 59 32.516 31.890 0.626 1
1 668 . 16 1 1 A 59 59 LYS N N 59 115.953 120.483 -4.530 1
1 669 . 16 1 1 A 60 60 ASP H H 60 8.634 7.989 0.645 1
1 670 . 16 1 1 A 60 60 ASP HA H 60 4.882 4.557 0.325 1
1 673 . 16 1 1 A 60 60 ASP C C 60 176.039 177.085 -1.046 1
1 674 . 16 1 1 A 60 60 ASP CA C 60 54.327 56.469 -2.142 1
1 675 . 16 1 1 A 60 60 ASP CB C 60 41.461 41.050 0.411 1
1 676 . 16 1 1 A 60 60 ASP N N 60 117.261 118.459 -1.198 1
1 677 . 16 1 1 A 61 61 ASP H H 61 7.500 8.286 -0.786 1
1 678 . 16 1 1 A 61 61 ASP HA H 61 4.591 4.654 -0.063 1
1 681 . 16 1 1 A 61 61 ASP C C 61 175.140 175.814 -0.674 1
1 682 . 16 1 1 A 61 61 ASP CA C 61 55.342 53.931 1.411 1
1 683 . 16 1 1 A 61 61 ASP CB C 61 42.475 40.148 2.327 1
1 684 . 16 1 1 A 61 61 ASP N N 61 122.319 119.050 3.269 1
1 685 . 16 1 1 A 62 62 GLN H H 62 8.239 8.012 0.227 1
1 686 . 16 1 1 A 62 62 GLN HA H 62 2.569 3.609 -1.040 1
1 693 . 16 1 1 A 62 62 GLN C C 62 172.652 173.630 -0.978 1
1 694 . 16 1 1 A 62 62 GLN CA C 62 54.038 55.480 -1.442 1
1 695 . 16 1 1 A 62 62 GLN CB C 62 31.481 29.248 2.233 1
1 697 . 16 1 1 A 62 62 GLN N N 62 117.458 123.200 -5.742 1
1 699 . 16 1 1 A 63 63 HIS H H 63 6.338 6.739 -0.401 1
1 700 . 16 1 1 A 63 63 HIS HA H 63 4.423 4.422 0.001 1
1 704 . 16 1 1 A 63 63 HIS C C 63 173.031 172.660 0.371 1
1 705 . 16 1 1 A 63 63 HIS CA C 63 54.743 54.045 0.698 1
1 706 . 16 1 1 A 63 63 HIS CB C 63 32.661 31.112 1.549 1
1 708 . 16 1 1 A 63 63 HIS N N 63 113.589 116.038 -2.449 1
1 709 . 16 1 1 A 64 64 PHE H H 64 8.549 9.102 -0.553 1
1 710 . 16 1 1 A 64 64 PHE HA H 64 4.578 5.161 -0.583 1
1 718 . 16 1 1 A 64 64 PHE C C 64 173.015 173.745 -0.730 1
1 719 . 16 1 1 A 64 64 PHE CA C 64 58.516 56.796 1.720 1
1 720 . 16 1 1 A 64 64 PHE CB C 64 43.525 42.954 0.571 1
1 726 . 16 1 1 A 64 64 PHE N N 64 118.214 120.240 -2.026 1
1 727 . 16 1 1 A 65 65 THR H H 65 7.150 8.189 -1.039 1
1 728 . 16 1 1 A 65 65 THR HA H 65 4.930 4.649 0.281 1
1 733 . 16 1 1 A 65 65 THR C C 65 172.457 173.819 -1.362 1
1 734 . 16 1 1 A 65 65 THR CA C 65 61.690 61.840 -0.150 1
1 735 . 16 1 1 A 65 65 THR CB C 65 69.593 69.307 0.286 1
1 737 . 16 1 1 A 65 65 THR N N 65 123.198 120.849 2.349 1
1 738 . 16 1 1 A 66 66 VAL H H 66 8.888 8.613 0.275 1
1 739 . 16 1 1 A 66 66 VAL HA H 66 4.018 4.773 -0.755 1
1 747 . 16 1 1 A 66 66 VAL C C 66 174.868 175.457 -0.589 1
1 748 . 16 1 1 A 66 66 VAL CA C 66 61.178 60.753 0.425 1
1 749 . 16 1 1 A 66 66 VAL CB C 66 33.114 33.186 -0.072 1
1 752 . 16 1 1 A 66 66 VAL N N 66 126.840 128.330 -1.490 1
1 753 . 16 1 1 A 67 67 THR H H 67 8.174 8.514 -0.340 1
1 754 . 16 1 1 A 67 67 THR HA H 67 4.816 4.989 -0.173 1
1 759 . 16 1 1 A 67 67 THR C C 67 174.494 174.214 0.280 1
1 760 . 16 1 1 A 67 67 THR CA C 67 59.786 59.520 0.266 1
1 761 . 16 1 1 A 67 67 THR CB C 67 70.887 71.658 -0.771 1
1 763 . 16 1 1 A 67 67 THR N N 67 116.127 117.250 -1.123 1
1 764 . 16 1 1 A 68 68 GLY H H 68 8.570 8.603 -0.033 1
1 765 . 16 1 1 A 68 68 GLY HA2 H 68 3.970 3.982 -0.012 1
1 766 . 16 1 1 A 68 68 GLY HA3 H 68 3.819 3.992 -0.173 1
1 767 . 16 1 1 A 68 68 GLY C C 68 175.636 174.517 1.119 1
1 768 . 16 1 1 A 68 68 GLY CA C 68 46.397 45.084 1.313 1
1 769 . 16 1 1 A 68 68 GLY N N 68 107.146 112.998 -5.852 1
1 770 . 16 1 1 A 69 69 LEU H H 69 8.007 7.330 0.677 1
1 771 . 16 1 1 A 69 69 LEU HA H 69 4.154 4.110 0.044 1
1 781 . 16 1 1 A 69 69 LEU C C 69 176.830 176.309 0.521 1
1 782 . 16 1 1 A 69 69 LEU CA C 69 54.602 54.897 -0.295 1
1 783 . 16 1 1 A 69 69 LEU CB C 69 41.149 42.003 -0.854 1
1 787 . 16 1 1 A 69 69 LEU N N 69 118.433 122.479 -4.046 1
1 788 . 16 1 1 A 70 70 HIS H H 70 8.866 8.334 0.532 1
1 789 . 16 1 1 A 70 70 HIS HA H 70 4.663 4.753 -0.090 1
1 793 . 16 1 1 A 70 70 HIS C C 70 176.667 175.393 1.274 1
1 794 . 16 1 1 A 70 70 HIS CA C 70 55.464 56.718 -1.254 1
1 795 . 16 1 1 A 70 70 HIS CB C 70 32.125 30.111 2.014 1
1 797 . 16 1 1 A 70 70 HIS N N 70 122.457 121.897 0.560 1
1 798 . 16 1 1 A 71 71 LYS H H 71 8.716 8.873 -0.157 1
1 799 . 16 1 1 A 71 71 LYS HA H 71 4.320 4.263 0.057 1
1 808 . 16 1 1 A 71 71 LYS C C 71 178.110 177.670 0.440 1
1 809 . 16 1 1 A 71 71 LYS CA C 71 57.035 58.143 -1.108 1
1 810 . 16 1 1 A 71 71 LYS CB C 71 33.580 32.863 0.717 1
1 814 . 16 1 1 A 71 71 LYS N N 71 123.173 123.048 0.125 1
1 815 . 16 1 1 A 72 72 GLY H H 72 7.709 8.756 -1.047 1
1 816 . 16 1 1 A 72 72 GLY HA2 H 72 3.800 3.916 -0.116 1
1 817 . 16 1 1 A 72 72 GLY HA3 H 72 3.769 3.924 -0.155 1
1 818 . 16 1 1 A 72 72 GLY C C 72 174.231 173.997 0.234 1
1 819 . 16 1 1 A 72 72 GLY CA C 72 47.866 46.512 1.354 1
1 820 . 16 1 1 A 72 72 GLY N N 72 114.881 111.940 2.941 1
1 821 . 16 1 1 A 73 73 THR H H 73 8.162 7.573 0.589 1
1 822 . 16 1 1 A 73 73 THR HA H 73 4.584 4.737 -0.153 1
1 827 . 16 1 1 A 73 73 THR C C 73 172.208 173.503 -1.295 1
1 828 . 16 1 1 A 73 73 THR CA C 73 62.307 61.328 0.979 1
1 829 . 16 1 1 A 73 73 THR CB C 73 72.123 71.815 0.308 1
1 831 . 16 1 1 A 73 73 THR N N 73 114.225 114.452 -0.227 1
1 832 . 16 1 1 A 74 74 THR H H 74 8.743 8.764 -0.021 1
1 833 . 16 1 1 A 74 74 THR HA H 74 5.138 4.912 0.226 1
1 838 . 16 1 1 A 74 74 THR C C 74 173.376 173.339 0.037 1
1 839 . 16 1 1 A 74 74 THR CA C 74 62.724 63.038 -0.314 1
1 840 . 16 1 1 A 74 74 THR CB C 74 69.202 69.820 -0.618 1
1 842 . 16 1 1 A 74 74 THR N N 74 123.376 121.216 2.160 1
1 843 . 16 1 1 A 75 75 TYR H H 75 9.549 9.275 0.274 1
1 844 . 16 1 1 A 75 75 TYR HA H 75 4.892 5.181 -0.289 1
1 851 . 16 1 1 A 75 75 TYR C C 75 173.991 175.230 -1.239 1
1 852 . 16 1 1 A 75 75 TYR CA C 75 57.740 56.019 1.721 1
1 853 . 16 1 1 A 75 75 TYR CB C 75 44.580 43.273 1.307 1
1 858 . 16 1 1 A 75 75 TYR N N 75 126.916 124.209 2.707 1
1 859 . 16 1 1 A 76 76 ILE H H 76 8.769 8.676 0.093 1
1 860 . 16 1 1 A 76 76 ILE HA H 76 4.663 4.864 -0.201 1
1 870 . 16 1 1 A 76 76 ILE C C 76 174.683 175.101 -0.418 1
1 871 . 16 1 1 A 76 76 ILE CA C 76 60.455 60.587 -0.132 1
1 872 . 16 1 1 A 76 76 ILE CB C 76 40.284 40.537 -0.253 1
1 876 . 16 1 1 A 76 76 ILE N N 76 119.407 120.438 -1.031 1
1 877 . 16 1 1 A 77 77 PHE H H 77 8.894 8.992 -0.098 1
1 878 . 16 1 1 A 77 77 PHE HA H 77 5.160 5.149 0.011 1
1 886 . 16 1 1 A 77 77 PHE C C 77 174.794 175.426 -0.632 1
1 887 . 16 1 1 A 77 77 PHE CA C 77 56.831 57.054 -0.223 1
1 888 . 16 1 1 A 77 77 PHE CB C 77 43.132 41.100 2.032 1
1 894 . 16 1 1 A 77 77 PHE N N 77 124.622 126.298 -1.676 1
1 895 . 16 1 1 A 78 78 ARG H H 78 9.407 9.189 0.218 1
1 896 . 16 1 1 A 78 78 ARG HA H 78 5.689 5.743 -0.054 1
1 904 . 16 1 1 A 78 78 ARG C C 78 174.376 174.635 -0.259 1
1 905 . 16 1 1 A 78 78 ARG CA C 78 54.530 54.788 -0.258 1
1 906 . 16 1 1 A 78 78 ARG CB C 78 34.473 33.806 0.667 1
1 909 . 16 1 1 A 78 78 ARG N N 78 120.055 121.687 -1.632 1
1 911 . 16 1 1 A 79 79 LEU H H 79 9.132 8.727 0.405 1
1 912 . 16 1 1 A 79 79 LEU HA H 79 5.398 5.033 0.365 1
1 922 . 16 1 1 A 79 79 LEU C C 79 174.006 174.242 -0.236 1
1 923 . 16 1 1 A 79 79 LEU CA C 79 53.401 53.344 0.057 1
1 924 . 16 1 1 A 79 79 LEU CB C 79 48.116 46.551 1.565 1
1 928 . 16 1 1 A 79 79 LEU N N 79 124.907 124.444 0.463 1
1 929 . 16 1 1 A 80 80 ALA H H 80 8.737 7.852 0.885 1
1 930 . 16 1 1 A 80 80 ALA HA H 80 4.871 4.963 -0.092 1
1 934 . 16 1 1 A 80 80 ALA C C 80 176.057 175.766 0.291 1
1 935 . 16 1 1 A 80 80 ALA CA C 80 50.353 51.290 -0.937 1
1 936 . 16 1 1 A 80 80 ALA CB C 80 23.972 23.208 0.764 1
1 937 . 16 1 1 A 80 80 ALA N N 80 128.220 125.296 2.924 1
1 938 . 16 1 1 A 81 81 ALA H H 81 9.890 8.606 1.284 1
1 939 . 16 1 1 A 81 81 ALA HA H 81 4.794 5.032 -0.238 1
1 943 . 16 1 1 A 81 81 ALA C C 81 174.655 176.188 -1.533 1
1 944 . 16 1 1 A 81 81 ALA CA C 81 50.300 51.050 -0.750 1
1 945 . 16 1 1 A 81 81 ALA CB C 81 21.369 20.716 0.653 1
1 946 . 16 1 1 A 81 81 ALA N N 81 123.682 123.494 0.188 1
1 947 . 16 1 1 A 82 82 LYS H H 82 7.965 8.835 -0.870 1
1 948 . 16 1 1 A 82 82 LYS HA H 82 4.974 5.123 -0.149 1
1 957 . 16 1 1 A 82 82 LYS C C 82 175.671 175.188 0.483 1
1 958 . 16 1 1 A 82 82 LYS CA C 82 54.664 54.698 -0.034 1
1 959 . 16 1 1 A 82 82 LYS CB C 82 36.677 35.361 1.316 1
1 963 . 16 1 1 A 82 82 LYS N N 82 118.164 122.258 -4.094 1
1 964 . 16 1 1 A 83 83 ASN H H 83 8.663 8.716 -0.053 1
1 965 . 16 1 1 A 83 83 ASN HA H 83 5.113 5.058 0.055 1
1 970 . 16 1 1 A 83 83 ASN C C 83 176.582 176.473 0.109 1
1 971 . 16 1 1 A 83 83 ASN CA C 83 51.746 50.669 1.077 1
1 972 . 16 1 1 A 83 83 ASN CB C 83 40.357 40.186 0.171 1
1 973 . 16 1 1 A 83 83 ASN N N 83 124.784 124.295 0.489 1
1 975 . 16 1 1 A 84 84 ARG H H 84 8.873 8.825 0.048 1
1 976 . 16 1 1 A 84 84 ARG HA H 84 3.940 3.918 0.022 1
1 983 . 16 1 1 A 84 84 ARG C C 84 176.735 178.077 -1.342 1
1 984 . 16 1 1 A 84 84 ARG CA C 84 59.327 59.933 -0.606 1
1 985 . 16 1 1 A 84 84 ARG CB C 84 29.282 29.971 -0.689 1
1 988 . 16 1 1 A 84 84 ARG N N 84 117.891 119.217 -1.326 1
1 989 . 16 1 1 A 85 85 ALA H H 85 7.645 7.819 -0.174 1
1 990 . 16 1 1 A 85 85 ALA HA H 85 4.276 4.203 0.073 1
1 994 . 16 1 1 A 85 85 ALA C C 85 177.479 177.300 0.179 1
1 995 . 16 1 1 A 85 85 ALA CA C 85 52.818 53.015 -0.197 1
1 996 . 16 1 1 A 85 85 ALA CB C 85 18.806 19.515 -0.709 1
1 997 . 16 1 1 A 85 85 ALA N N 85 120.306 120.413 -0.107 1
1 998 . 16 1 1 A 86 86 GLY H H 86 7.693 7.574 0.119 1
1 999 . 16 1 1 A 86 86 GLY HA2 H 86 4.456 4.087 0.369 1
1 1000 . 16 1 1 A 86 86 GLY HA3 H 86 3.649 4.089 -0.440 1
1 1001 . 16 1 1 A 86 86 GLY C C 86 172.068 172.482 -0.414 1
1 1002 . 16 1 1 A 86 86 GLY CA C 86 44.375 44.050 0.325 1
1 1003 . 16 1 1 A 86 86 GLY N N 86 106.594 103.773 2.821 1
1 1004 . 16 1 1 A 87 87 LEU H H 87 8.203 8.463 -0.260 1
1 1005 . 16 1 1 A 87 87 LEU HA H 87 4.629 4.604 0.025 1
1 1015 . 16 1 1 A 87 87 LEU C C 87 179.155 176.475 2.680 1
1 1016 . 16 1 1 A 87 87 LEU CA C 87 54.814 55.305 -0.491 1
1 1017 . 16 1 1 A 87 87 LEU CB C 87 43.454 42.538 0.916 1
1 1021 . 16 1 1 A 87 87 LEU N N 87 120.879 122.435 -1.556 1
1 1022 . 16 1 1 A 88 88 GLY H H 88 8.492 8.280 0.212 1
1 1023 . 16 1 1 A 88 88 GLY HA2 H 88 4.339 4.184 0.155 1
1 1024 . 16 1 1 A 88 88 GLY HA3 H 88 4.122 4.191 -0.069 1
1 1025 . 16 1 1 A 88 88 GLY C C 88 173.030 173.299 -0.269 1
1 1026 . 16 1 1 A 88 88 GLY CA C 88 43.970 44.750 -0.780 1
1 1027 . 16 1 1 A 88 88 GLY N N 88 109.903 109.647 0.256 1
1 1028 . 16 1 1 A 89 89 GLU H H 89 7.638 9.011 -1.373 1
1 1029 . 16 1 1 A 89 89 GLU HA H 89 4.103 4.285 -0.182 1
1 1034 . 16 1 1 A 89 89 GLU C C 89 177.511 176.315 1.196 1
1 1035 . 16 1 1 A 89 89 GLU CA C 89 56.659 57.337 -0.678 1
1 1036 . 16 1 1 A 89 89 GLU CB C 89 31.324 30.694 0.630 1
1 1038 . 16 1 1 A 89 89 GLU N N 89 117.551 121.475 -3.924 1
1 1039 . 16 1 1 A 90 90 GLU H H 90 8.734 8.920 -0.186 1
1 1040 . 16 1 1 A 90 90 GLU HA H 90 4.651 5.380 -0.729 1
1 1045 . 16 1 1 A 90 90 GLU C C 90 177.452 174.418 3.034 1
1 1046 . 16 1 1 A 90 90 GLU CA C 90 55.987 54.501 1.486 1
1 1047 . 16 1 1 A 90 90 GLU CB C 90 31.135 33.776 -2.641 1
1 1049 . 16 1 1 A 90 90 GLU N N 90 121.553 118.306 3.247 1
1 1050 . 16 1 1 A 91 91 PHE H H 91 9.411 8.863 0.548 1
1 1051 . 16 1 1 A 91 91 PHE HA H 91 4.665 5.331 -0.666 1
1 1059 . 16 1 1 A 91 91 PHE C C 91 173.944 173.301 0.643 1
1 1060 . 16 1 1 A 91 91 PHE CA C 91 57.687 56.312 1.375 1
1 1061 . 16 1 1 A 91 91 PHE CB C 91 40.890 42.697 -1.807 1
1 1067 . 16 1 1 A 91 91 PHE N N 91 125.459 122.782 2.677 1
1 1068 . 16 1 1 A 92 92 GLU H H 92 8.043 8.511 -0.468 1
1 1069 . 16 1 1 A 92 92 GLU HA H 92 5.424 5.261 0.163 1
1 1074 . 16 1 1 A 92 92 GLU C C 92 174.295 174.547 -0.252 1
1 1075 . 16 1 1 A 92 92 GLU CA C 92 54.378 54.558 -0.180 1
1 1076 . 16 1 1 A 92 92 GLU CB C 92 33.662 33.463 0.199 1
1 1078 . 16 1 1 A 92 92 GLU N N 92 128.905 127.844 1.061 1
1 1079 . 16 1 1 A 93 93 LYS H H 93 9.142 8.344 0.798 1
1 1080 . 16 1 1 A 93 93 LYS HA H 93 4.541 4.964 -0.423 1
1 1089 . 16 1 1 A 93 93 LYS C C 93 173.366 173.872 -0.506 1
1 1090 . 16 1 1 A 93 93 LYS CA C 93 55.343 55.667 -0.324 1
1 1091 . 16 1 1 A 93 93 LYS CB C 93 37.317 36.344 0.973 1
1 1095 . 16 1 1 A 93 93 LYS N N 93 125.231 126.379 -1.148 1
1 1096 . 16 1 1 A 94 94 GLU H H 94 8.655 9.197 -0.542 1
1 1097 . 16 1 1 A 94 94 GLU HA H 94 5.558 5.390 0.168 1
1 1102 . 16 1 1 A 94 94 GLU C C 94 176.238 175.587 0.651 1
1 1103 . 16 1 1 A 94 94 GLU CA C 94 54.632 55.244 -0.612 1
1 1104 . 16 1 1 A 94 94 GLU CB C 94 32.166 32.899 -0.733 1
1 1106 . 16 1 1 A 94 94 GLU N N 94 127.232 127.834 -0.602 1
1 1107 . 16 1 1 A 95 95 ILE H H 95 9.302 8.938 0.364 1
1 1108 . 16 1 1 A 95 95 ILE HA H 95 4.794 5.200 -0.406 1
1 1118 . 16 1 1 A 95 95 ILE C C 95 173.138 174.190 -1.052 1
1 1119 . 16 1 1 A 95 95 ILE CA C 95 58.570 58.286 0.284 1
1 1120 . 16 1 1 A 95 95 ILE CB C 95 42.420 42.831 -0.411 1
1 1124 . 16 1 1 A 95 95 ILE N N 95 120.711 120.878 -0.167 1
1 1125 . 16 1 1 A 96 96 ARG H H 96 8.589 8.791 -0.202 1
1 1126 . 16 1 1 A 96 96 ARG HA H 96 5.373 4.805 0.568 1
1 1133 . 16 1 1 A 96 96 ARG C C 96 177.147 175.037 2.110 1
1 1134 . 16 1 1 A 96 96 ARG CA C 96 54.045 55.055 -1.010 1
1 1135 . 16 1 1 A 96 96 ARG CB C 96 32.001 33.961 -1.960 1
1 1138 . 16 1 1 A 96 96 ARG N N 96 124.445 121.850 2.595 1
1 1139 . 16 1 1 A 97 97 THR H H 97 9.243 8.465 0.778 1
1 1140 . 16 1 1 A 97 97 THR HA H 97 4.459 4.564 -0.105 1
1 1145 . 16 1 1 A 97 97 THR C C 97 172.745 173.914 -1.169 1
1 1146 . 16 1 1 A 97 97 THR CA C 97 59.637 60.619 -0.982 1
1 1147 . 16 1 1 A 97 97 THR CB C 97 67.687 68.904 -1.217 1
1 1149 . 16 1 1 A 97 97 THR N N 97 119.370 118.385 0.985 1
1 1150 . 16 1 1 A 98 98 PRO HA H 98 4.494 4.723 -0.229 1
1 1157 . 16 1 1 A 98 98 PRO CA C 98 63.117 62.681 0.436 1
1 1158 . 16 1 1 A 98 98 PRO CB C 98 32.500 31.733 0.767 1
1 1161 . 16 1 1 A 99 99 GLU H H 99 8.534 8.406 0.128 1
1 1162 . 16 1 1 A 99 99 GLU HA H 99 4.195 4.253 -0.058 1
1 1167 . 16 1 1 A 99 99 GLU C C 99 175.881 175.895 -0.014 1
1 1168 . 16 1 1 A 99 99 GLU CA C 99 56.330 56.494 -0.164 1
1 1169 . 16 1 1 A 99 99 GLU CB C 99 31.062 29.849 1.213 1
1 1171 . 16 1 1 A 99 99 GLU N N 99 119.688 118.911 0.777 1
1 1172 . 16 1 1 A 100 100 ASP H H 100 8.536 8.504 0.032 1
1 1173 . 16 1 1 A 100 100 ASP HA H 100 4.607 4.538 0.069 1
1 1176 . 16 1 1 A 100 100 ASP C C 100 176.012 175.809 0.203 1
1 1177 . 16 1 1 A 100 100 ASP CA C 100 54.109 54.243 -0.134 1
1 1178 . 16 1 1 A 100 100 ASP CB C 100 41.562 41.272 0.290 1
1 1179 . 16 1 1 A 100 100 ASP N N 100 119.803 122.888 -3.085 1
1 1180 . 16 1 1 A 101 101 LEU H H 101 8.403 8.722 -0.319 1
1 1181 . 16 1 1 A 101 101 LEU HA H 101 4.426 5.161 -0.735 1
1 1191 . 16 1 1 A 101 101 LEU C C 101 177.534 175.231 2.303 1
1 1192 . 16 1 1 A 101 101 LEU CA C 101 55.113 53.643 1.470 1
1 1193 . 16 1 1 A 101 101 LEU CB C 101 42.156 45.993 -3.837 1
1 1197 . 16 1 1 A 101 101 LEU N N 101 123.876 116.462 7.414 1
1 1198 . 16 1 1 A 102 102 SER H H 102 8.413 8.687 -0.274 1
1 1199 . 16 1 1 A 102 102 SER HA H 102 4.434 5.487 -1.053 1
1 1202 . 16 1 1 A 102 102 SER C C 102 174.674 173.960 0.714 1
1 1203 . 16 1 1 A 102 102 SER CA C 102 58.798 57.146 1.652 1
1 1204 . 16 1 1 A 102 102 SER CB C 102 63.854 66.789 -2.935 1
1 1205 . 16 1 1 A 102 102 SER N N 102 116.667 117.739 -1.072 1
1 1206 . 16 1 1 A 103 103 GLY H H 103 8.213 8.305 -0.092 1
1 1207 . 16 1 1 A 103 103 GLY HA2 H 103 4.164 4.232 -0.068 1
1 1208 . 16 1 1 A 103 103 GLY HA3 H 103 4.057 4.232 -0.175 1
1 1209 . 16 1 1 A 103 103 GLY C C 103 171.822 172.057 -0.235 1
1 1210 . 16 1 1 A 103 103 GLY CA C 103 44.658 45.558 -0.900 1
1 1211 . 16 1 1 A 103 103 GLY N N 103 110.592 109.012 1.580 1
1 1212 . 16 1 1 A 104 104 PRO HA H 104 4.475 4.497 -0.022 1
1 1219 . 16 1 1 A 104 104 PRO C C 104 177.445 176.192 1.253 1
1 1220 . 16 1 1 A 104 104 PRO CA C 104 63.312 62.726 0.586 1
1 1221 . 16 1 1 A 104 104 PRO CB C 104 32.190 32.569 -0.379 1
1 1224 . 16 1 1 A 105 105 SER H H 105 8.538 8.377 0.161 1
1 1225 . 16 1 1 A 105 105 SER HA H 105 4.541 5.059 -0.518 1
1 1228 . 16 1 1 A 105 105 SER C C 105 174.616 172.671 1.945 1
1 1229 . 16 1 1 A 105 105 SER CA C 105 58.270 56.758 1.512 1
1 1230 . 16 1 1 A 105 105 SER CB C 105 63.895 63.945 -0.050 1
1 1231 . 16 1 1 A 105 105 SER N N 105 116.446 115.826 0.620 1
1 1232 . 16 1 1 A 106 106 SER H H 106 8.350 8.874 -0.524 1
1 1233 . 16 1 1 A 106 106 SER HA H 106 4.541 4.566 -0.025 1
1 1236 . 16 1 1 A 106 106 SER C C 106 174.530 175.142 -0.612 1
1 1237 . 16 1 1 A 106 106 SER CA C 106 58.357 58.109 0.248 1
1 1238 . 16 1 1 A 106 106 SER CB C 106 64.020 62.245 1.775 1
1 1239 . 16 1 1 A 106 106 SER N N 106 117.448 123.446 -5.998 1
1 1 . 17 1 1 A 2 2 SER C C 2 174.723 175.412 -0.689 1
1 2 . 17 1 1 A 2 2 SER CA C 2 58.446 56.914 1.532 1
1 3 . 17 1 1 A 2 2 SER CB C 2 63.566 64.607 -1.041 1
1 4 . 17 1 1 A 3 3 SER H H 3 8.350 8.436 -0.086 1
1 5 . 17 1 1 A 3 3 SER C C 3 173.961 175.562 -1.601 1
1 6 . 17 1 1 A 3 3 SER CA C 3 58.428 59.694 -1.266 1
1 7 . 17 1 1 A 3 3 SER CB C 3 63.937 64.202 -0.265 1
1 8 . 17 1 1 A 3 3 SER N N 3 117.923 119.370 -1.447 1
1 9 . 17 1 1 A 4 4 GLY H H 4 8.050 8.033 0.017 1
1 10 . 17 1 1 A 4 4 GLY C C 4 179.009 174.645 4.364 1
1 11 . 17 1 1 A 4 4 GLY CA C 4 46.174 46.380 -0.206 1
1 12 . 17 1 1 A 4 4 GLY N N 4 116.890 111.279 5.611 1
1 13 . 17 1 1 A 7 7 GLY HA2 H 7 4.340 4.251 0.089 1
1 14 . 17 1 1 A 7 7 GLY HA3 H 7 3.629 4.252 -0.623 1
1 15 . 17 1 1 A 7 7 GLY CA C 7 44.381 43.975 0.406 1
1 16 . 17 1 1 A 8 8 PRO HA H 8 4.476 4.507 -0.031 1
1 23 . 17 1 1 A 8 8 PRO C C 8 176.235 177.340 -1.105 1
1 24 . 17 1 1 A 8 8 PRO CA C 8 62.995 62.703 0.292 1
1 25 . 17 1 1 A 8 8 PRO CB C 8 33.266 32.190 1.076 1
1 28 . 17 1 1 A 9 9 GLY H H 9 8.585 8.461 0.124 1
1 29 . 17 1 1 A 9 9 GLY HA2 H 9 4.326 4.053 0.273 1
1 30 . 17 1 1 A 9 9 GLY HA3 H 9 4.009 4.058 -0.049 1
1 31 . 17 1 1 A 9 9 GLY C C 9 172.998 172.984 0.014 1
1 32 . 17 1 1 A 9 9 GLY CA C 9 44.393 44.325 0.068 1
1 33 . 17 1 1 A 9 9 GLY N N 9 106.004 107.710 -1.706 1
1 34 . 17 1 1 A 10 10 ARG H H 10 8.548 8.281 0.267 1
1 35 . 17 1 1 A 10 10 ARG HA H 10 4.654 4.904 -0.250 1
1 41 . 17 1 1 A 10 10 ARG C C 10 175.780 174.910 0.870 1
1 42 . 17 1 1 A 10 10 ARG CA C 10 54.708 54.526 0.182 1
1 43 . 17 1 1 A 10 10 ARG CB C 10 31.448 31.324 0.124 1
1 45 . 17 1 1 A 10 10 ARG N N 10 119.407 117.851 1.556 1
1 46 . 17 1 1 A 11 11 PRO HA H 11 4.611 4.588 0.023 1
1 53 . 17 1 1 A 11 11 PRO C C 11 173.510 175.572 -2.062 1
1 54 . 17 1 1 A 11 11 PRO CA C 11 62.360 62.670 -0.310 1
1 55 . 17 1 1 A 11 11 PRO CB C 11 33.402 32.239 1.163 1
1 58 . 17 1 1 A 12 12 THR H H 12 7.572 8.469 -0.897 1
1 59 . 17 1 1 A 12 12 THR HA H 12 3.796 4.341 -0.545 1
1 64 . 17 1 1 A 12 12 THR C C 12 172.337 173.295 -0.958 1
1 65 . 17 1 1 A 12 12 THR CA C 12 61.778 61.618 0.160 1
1 66 . 17 1 1 A 12 12 THR CB C 12 70.561 68.524 2.037 1
1 68 . 17 1 1 A 12 12 THR N N 12 109.653 117.229 -7.576 1
1 69 . 17 1 1 A 13 13 MET H H 13 5.605 8.629 -3.024 1
1 70 . 17 1 1 A 13 13 MET HA H 13 5.091 4.957 0.134 1
1 78 . 17 1 1 A 13 13 MET C C 13 172.639 174.907 -2.268 1
1 79 . 17 1 1 A 13 13 MET CA C 13 54.168 53.664 0.504 1
1 80 . 17 1 1 A 13 13 MET CB C 13 37.632 34.507 3.125 1
1 83 . 17 1 1 A 13 13 MET N N 13 121.634 126.996 -5.362 1
1 84 . 17 1 1 A 14 14 MET H H 14 9.254 9.150 0.104 1
1 85 . 17 1 1 A 14 14 MET HA H 14 4.662 5.053 -0.391 1
1 93 . 17 1 1 A 14 14 MET C C 14 174.388 174.851 -0.463 1
1 94 . 17 1 1 A 14 14 MET CA C 14 54.673 54.475 0.198 1
1 95 . 17 1 1 A 14 14 MET CB C 14 34.907 35.250 -0.343 1
1 98 . 17 1 1 A 14 14 MET N N 14 125.746 123.796 1.950 1
1 99 . 17 1 1 A 15 15 ILE H H 15 8.555 9.014 -0.459 1
1 100 . 17 1 1 A 15 15 ILE HA H 15 4.882 4.911 -0.029 1
1 110 . 17 1 1 A 15 15 ILE C C 15 174.962 175.205 -0.243 1
1 111 . 17 1 1 A 15 15 ILE CA C 15 60.685 60.755 -0.070 1
1 112 . 17 1 1 A 15 15 ILE CB C 15 40.878 38.650 2.228 1
1 116 . 17 1 1 A 15 15 ILE N N 15 121.623 126.044 -4.421 1
1 117 . 17 1 1 A 16 16 SER H H 16 8.703 8.954 -0.251 1
1 118 . 17 1 1 A 16 16 SER HA H 16 4.922 5.162 -0.240 1
1 121 . 17 1 1 A 16 16 SER C C 16 173.860 172.799 1.061 1
1 122 . 17 1 1 A 16 16 SER CA C 16 56.524 57.269 -0.745 1
1 123 . 17 1 1 A 16 16 SER CB C 16 65.004 66.309 -1.305 1
1 124 . 17 1 1 A 16 16 SER N N 16 122.261 124.110 -1.849 1
1 125 . 17 1 1 A 17 17 THR H H 17 8.759 8.644 0.115 1
1 126 . 17 1 1 A 17 17 THR HA H 17 4.885 5.119 -0.234 1
1 131 . 17 1 1 A 17 17 THR C C 17 175.018 174.047 0.971 1
1 132 . 17 1 1 A 17 17 THR CA C 17 60.315 60.272 0.043 1
1 133 . 17 1 1 A 17 17 THR CB C 17 69.799 70.409 -0.610 1
1 135 . 17 1 1 A 17 17 THR N N 17 115.660 113.823 1.837 1
1 136 . 17 1 1 A 18 18 THR H H 18 8.038 8.759 -0.721 1
1 137 . 17 1 1 A 18 18 THR HA H 18 4.596 4.443 0.153 1
1 142 . 17 1 1 A 18 18 THR CA C 18 60.707 63.385 -2.678 1
1 143 . 17 1 1 A 18 18 THR CB C 18 71.082 71.514 -0.432 1
1 145 . 17 1 1 A 18 18 THR N N 18 112.362 118.340 -5.978 1
1 146 . 17 1 1 A 19 19 ALA H H 19 8.545 7.259 1.286 1
1 147 . 17 1 1 A 19 19 ALA HA H 19 4.412 4.518 -0.106 1
1 151 . 17 1 1 A 19 19 ALA C C 19 177.034 177.095 -0.061 1
1 152 . 17 1 1 A 19 19 ALA CA C 19 52.264 51.112 1.152 1
1 153 . 17 1 1 A 19 19 ALA CB C 19 19.292 21.579 -2.287 1
1 154 . 17 1 1 A 19 19 ALA N N 19 119.589 122.621 -3.032 1
1 155 . 17 1 1 A 20 20 MET H H 20 8.145 8.593 -0.448 1
1 156 . 17 1 1 A 20 20 MET HA H 20 4.447 4.458 -0.011 1
1 164 . 17 1 1 A 20 20 MET C C 20 175.676 176.000 -0.324 1
1 165 . 17 1 1 A 20 20 MET CA C 20 55.764 55.899 -0.135 1
1 166 . 17 1 1 A 20 20 MET CB C 20 31.495 32.550 -1.055 1
1 169 . 17 1 1 A 20 20 MET N N 20 116.950 117.053 -0.103 1
1 170 . 17 1 1 A 21 21 ASN H H 21 8.275 8.913 -0.638 1
1 171 . 17 1 1 A 21 21 ASN HA H 21 4.452 4.349 0.103 1
1 176 . 17 1 1 A 21 21 ASN C C 21 174.100 173.787 0.313 1
1 177 . 17 1 1 A 21 21 ASN CA C 21 54.320 54.509 -0.189 1
1 178 . 17 1 1 A 21 21 ASN CB C 21 37.234 37.392 -0.158 1
1 179 . 17 1 1 A 21 21 ASN N N 21 113.198 116.901 -3.703 1
1 181 . 17 1 1 A 22 22 THR H H 22 7.071 7.446 -0.375 1
1 182 . 17 1 1 A 22 22 THR HA H 22 5.218 5.359 -0.141 1
1 187 . 17 1 1 A 22 22 THR C C 22 173.301 172.744 0.557 1
1 188 . 17 1 1 A 22 22 THR CA C 22 59.399 60.504 -1.105 1
1 189 . 17 1 1 A 22 22 THR CB C 22 72.714 71.654 1.060 1
1 191 . 17 1 1 A 22 22 THR N N 22 107.603 107.850 -0.247 1
1 192 . 17 1 1 A 23 23 ALA H H 23 8.687 8.612 0.075 1
1 193 . 17 1 1 A 23 23 ALA HA H 23 4.925 4.972 -0.047 1
1 197 . 17 1 1 A 23 23 ALA C C 23 174.100 176.202 -2.102 1
1 198 . 17 1 1 A 23 23 ALA CA C 23 50.812 50.054 0.758 1
1 199 . 17 1 1 A 23 23 ALA CB C 23 21.122 21.038 0.084 1
1 200 . 17 1 1 A 23 23 ALA N N 23 121.937 126.873 -4.936 1
1 201 . 17 1 1 A 24 24 LEU H H 24 8.833 9.127 -0.294 1
1 202 . 17 1 1 A 24 24 LEU HA H 24 4.673 4.445 0.228 1
1 212 . 17 1 1 A 24 24 LEU C C 24 175.140 175.047 0.093 1
1 213 . 17 1 1 A 24 24 LEU CA C 24 54.320 55.263 -0.943 1
1 214 . 17 1 1 A 24 24 LEU CB C 24 42.518 42.985 -0.467 1
1 218 . 17 1 1 A 24 24 LEU N N 24 123.721 126.468 -2.747 1
1 219 . 17 1 1 A 25 25 LEU H H 25 9.176 8.705 0.471 1
1 220 . 17 1 1 A 25 25 LEU HA H 25 5.112 5.054 0.058 1
1 230 . 17 1 1 A 25 25 LEU C C 25 176.414 175.628 0.786 1
1 231 . 17 1 1 A 25 25 LEU CA C 25 54.108 53.231 0.877 1
1 232 . 17 1 1 A 25 25 LEU CB C 25 43.230 43.684 -0.454 1
1 236 . 17 1 1 A 25 25 LEU N N 25 128.589 127.689 0.900 1
1 237 . 17 1 1 A 26 26 GLN H H 26 8.556 8.554 0.002 1
1 238 . 17 1 1 A 26 26 GLN HA H 26 4.737 4.810 -0.073 1
1 245 . 17 1 1 A 26 26 GLN C C 26 174.372 174.368 0.004 1
1 246 . 17 1 1 A 26 26 GLN CA C 26 56.365 54.347 2.018 1
1 247 . 17 1 1 A 26 26 GLN CB C 26 33.320 31.398 1.922 1
1 249 . 17 1 1 A 26 26 GLN N N 26 119.630 122.752 -3.122 1
1 251 . 17 1 1 A 27 27 TRP H H 27 8.080 8.293 -0.213 1
1 252 . 17 1 1 A 27 27 TRP HA H 27 5.441 5.864 -0.423 1
1 261 . 17 1 1 A 27 27 TRP CA C 27 55.957 54.542 1.415 1
1 262 . 17 1 1 A 27 27 TRP CB C 27 32.517 32.341 0.176 1
1 268 . 17 1 1 A 27 27 TRP N N 27 121.276 121.481 -0.205 1
1 270 . 17 1 1 A 28 28 HIS H H 28 8.262 8.651 -0.389 1
1 271 . 17 1 1 A 28 28 HIS HA H 28 4.997 5.011 -0.014 1
1 275 . 17 1 1 A 28 28 HIS CA C 28 53.028 53.987 -0.959 1
1 276 . 17 1 1 A 28 28 HIS CB C 28 32.832 32.861 -0.029 1
1 278 . 17 1 1 A 28 28 HIS N N 28 116.245 117.759 -1.514 1
1 279 . 17 1 1 A 29 29 PRO HA H 29 4.984 4.667 0.317 1
1 286 . 17 1 1 A 29 29 PRO CA C 29 61.498 62.138 -0.640 1
1 287 . 17 1 1 A 29 29 PRO CB C 29 30.709 32.445 -1.736 1
1 290 . 17 1 1 A 30 30 PRO HA H 30 4.449 4.673 -0.224 1
1 297 . 17 1 1 A 30 30 PRO C C 30 175.733 176.498 -0.765 1
1 298 . 17 1 1 A 30 30 PRO CA C 30 62.245 62.590 -0.345 1
1 299 . 17 1 1 A 30 30 PRO CB C 30 32.083 33.308 -1.225 1
1 302 . 17 1 1 A 31 31 LYS H H 31 8.403 8.747 -0.344 1
1 303 . 17 1 1 A 31 31 LYS HA H 31 4.084 4.374 -0.290 1
1 312 . 17 1 1 A 31 31 LYS C C 31 177.166 178.431 -1.265 1
1 313 . 17 1 1 A 31 31 LYS CA C 31 57.866 57.796 0.070 1
1 314 . 17 1 1 A 31 31 LYS CB C 31 32.698 33.750 -1.052 1
1 318 . 17 1 1 A 31 31 LYS N N 31 121.693 121.335 0.358 1
1 319 . 17 1 1 A 32 32 GLU H H 32 8.102 7.806 0.296 1
1 320 . 17 1 1 A 32 32 GLU HA H 32 4.365 4.481 -0.116 1
1 325 . 17 1 1 A 32 32 GLU C C 32 174.248 175.714 -1.466 1
1 326 . 17 1 1 A 32 32 GLU CA C 32 55.448 56.025 -0.577 1
1 327 . 17 1 1 A 32 32 GLU CB C 32 29.405 30.092 -0.687 1
1 329 . 17 1 1 A 32 32 GLU N N 32 118.742 116.730 2.012 1
1 330 . 17 1 1 A 33 33 LEU H H 33 8.420 7.490 0.930 1
1 331 . 17 1 1 A 33 33 LEU HA H 33 4.499 4.738 -0.239 1
1 341 . 17 1 1 A 33 33 LEU C C 33 173.036 175.006 -1.970 1
1 342 . 17 1 1 A 33 33 LEU CA C 33 52.863 51.840 1.023 1
1 343 . 17 1 1 A 33 33 LEU CB C 33 42.535 43.584 -1.049 1
1 347 . 17 1 1 A 33 33 LEU N N 33 125.181 123.429 1.752 1
1 348 . 17 1 1 A 34 34 PRO HA H 34 4.488 4.488 0.000 1
1 355 . 17 1 1 A 34 34 PRO C C 34 177.544 176.594 0.950 1
1 356 . 17 1 1 A 34 34 PRO CA C 34 62.889 63.171 -0.282 1
1 357 . 17 1 1 A 34 34 PRO CB C 34 31.472 30.873 0.599 1
1 360 . 17 1 1 A 35 35 GLY H H 35 8.397 7.984 0.413 1
1 361 . 17 1 1 A 35 35 GLY HA2 H 35 4.059 4.126 -0.067 1
1 362 . 17 1 1 A 35 35 GLY HA3 H 35 3.716 4.127 -0.411 1
1 363 . 17 1 1 A 35 35 GLY C C 35 173.356 171.627 1.729 1
1 364 . 17 1 1 A 35 35 GLY CA C 35 45.892 44.416 1.476 1
1 365 . 17 1 1 A 35 35 GLY N N 35 110.524 112.191 -1.667 1
1 366 . 17 1 1 A 36 36 GLU H H 36 8.091 8.665 -0.574 1
1 367 . 17 1 1 A 36 36 GLU HA H 36 4.371 5.171 -0.800 1
1 372 . 17 1 1 A 36 36 GLU C C 36 174.864 175.280 -0.416 1
1 373 . 17 1 1 A 36 36 GLU CA C 36 55.201 54.650 0.551 1
1 374 . 17 1 1 A 36 36 GLU CB C 36 31.878 33.522 -1.644 1
1 376 . 17 1 1 A 36 36 GLU N N 36 122.202 122.378 -0.176 1
1 377 . 17 1 1 A 37 37 LEU H H 37 8.307 8.652 -0.345 1
1 378 . 17 1 1 A 37 37 LEU HA H 37 4.288 4.267 0.021 1
1 388 . 17 1 1 A 37 37 LEU C C 37 176.702 176.031 0.671 1
1 389 . 17 1 1 A 37 37 LEU CA C 37 55.342 56.432 -1.090 1
1 390 . 17 1 1 A 37 37 LEU CB C 37 42.715 42.113 0.602 1
1 394 . 17 1 1 A 37 37 LEU N N 37 123.204 127.063 -3.859 1
1 395 . 17 1 1 A 38 38 LEU H H 38 8.909 8.777 0.132 1
1 396 . 17 1 1 A 38 38 LEU HA H 38 4.640 4.643 -0.003 1
1 406 . 17 1 1 A 38 38 LEU C C 38 177.202 176.743 0.459 1
1 407 . 17 1 1 A 38 38 LEU CA C 38 54.390 55.140 -0.750 1
1 408 . 17 1 1 A 38 38 LEU CB C 38 43.770 43.596 0.174 1
1 412 . 17 1 1 A 38 38 LEU N N 38 123.021 127.295 -4.274 1
1 413 . 17 1 1 A 39 39 GLY H H 39 7.113 6.969 0.144 1
1 414 . 17 1 1 A 39 39 GLY HA2 H 39 4.816 3.560 1.256 1
1 415 . 17 1 1 A 39 39 GLY HA3 H 39 3.276 3.910 -0.634 1
1 416 . 17 1 1 A 39 39 GLY C C 39 169.863 170.367 -0.504 1
1 417 . 17 1 1 A 39 39 GLY CA C 39 44.622 45.510 -0.888 1
1 418 . 17 1 1 A 39 39 GLY N N 39 104.137 103.940 0.197 1
1 419 . 17 1 1 A 40 40 TYR H H 40 8.318 8.884 -0.566 1
1 420 . 17 1 1 A 40 40 TYR HA H 40 5.414 5.135 0.279 1
1 425 . 17 1 1 A 40 40 TYR C C 40 174.448 172.162 2.286 1
1 426 . 17 1 1 A 40 40 TYR CA C 40 56.178 56.553 -0.375 1
1 427 . 17 1 1 A 40 40 TYR CB C 40 44.191 40.660 3.531 1
1 430 . 17 1 1 A 40 40 TYR N N 40 114.036 115.373 -1.337 1
1 431 . 17 1 1 A 41 41 ARG H H 41 9.347 8.848 0.499 1
1 432 . 17 1 1 A 41 41 ARG HA H 41 5.092 5.355 -0.263 1
1 440 . 17 1 1 A 41 41 ARG C C 41 174.097 174.373 -0.276 1
1 441 . 17 1 1 A 41 41 ARG CA C 41 56.100 54.477 1.623 1
1 442 . 17 1 1 A 41 41 ARG CB C 41 34.508 32.681 1.827 1
1 445 . 17 1 1 A 41 41 ARG N N 41 122.231 121.244 0.987 1
1 447 . 17 1 1 A 42 42 LEU H H 42 9.546 9.273 0.273 1
1 448 . 17 1 1 A 42 42 LEU HA H 42 5.459 5.201 0.258 1
1 458 . 17 1 1 A 42 42 LEU C C 42 174.913 174.734 0.179 1
1 459 . 17 1 1 A 42 42 LEU CA C 42 52.997 53.484 -0.487 1
1 460 . 17 1 1 A 42 42 LEU CB C 42 46.413 45.383 1.030 1
1 464 . 17 1 1 A 42 42 LEU N N 42 132.335 128.473 3.862 1
1 465 . 17 1 1 A 43 43 GLN H H 43 9.502 9.281 0.221 1
1 466 . 17 1 1 A 43 43 GLN HA H 43 5.847 5.383 0.464 1
1 473 . 17 1 1 A 43 43 GLN C C 43 175.329 174.092 1.237 1
1 474 . 17 1 1 A 43 43 GLN CA C 43 54.005 54.447 -0.442 1
1 475 . 17 1 1 A 43 43 GLN CB C 43 33.429 31.329 2.100 1
1 477 . 17 1 1 A 43 43 GLN N N 43 123.932 125.400 -1.468 1
1 479 . 17 1 1 A 44 44 TYR H H 44 8.615 8.072 0.543 1
1 480 . 17 1 1 A 44 44 TYR HA H 44 5.783 5.675 0.108 1
1 487 . 17 1 1 A 44 44 TYR C C 44 174.058 173.451 0.607 1
1 488 . 17 1 1 A 44 44 TYR CA C 44 55.942 56.453 -0.511 1
1 489 . 17 1 1 A 44 44 TYR CB C 44 43.052 41.148 1.904 1
1 494 . 17 1 1 A 44 44 TYR N N 44 117.355 119.854 -2.499 1
1 495 . 17 1 1 A 45 45 CYS H H 45 8.377 8.254 0.123 1
1 496 . 17 1 1 A 45 45 CYS HA H 45 4.772 5.058 -0.286 1
1 499 . 17 1 1 A 45 45 CYS C C 45 173.205 173.805 -0.600 1
1 500 . 17 1 1 A 45 45 CYS CA C 45 55.960 57.804 -1.844 1
1 501 . 17 1 1 A 45 45 CYS CB C 45 30.665 31.597 -0.932 1
1 502 . 17 1 1 A 45 45 CYS N N 45 115.140 118.842 -3.702 1
1 503 . 17 1 1 A 46 46 ARG H H 46 9.165 8.407 0.758 1
1 504 . 17 1 1 A 46 46 ARG HA H 46 4.068 3.522 0.546 1
1 511 . 17 1 1 A 46 46 ARG C C 46 178.440 177.421 1.019 1
1 512 . 17 1 1 A 46 46 ARG CA C 46 56.401 56.649 -0.248 1
1 513 . 17 1 1 A 46 46 ARG CB C 46 31.878 30.748 1.130 1
1 516 . 17 1 1 A 46 46 ARG N N 46 121.803 122.440 -0.637 1
1 517 . 17 1 1 A 47 47 ALA H H 47 8.273 8.379 -0.106 1
1 518 . 17 1 1 A 47 47 ALA HA H 47 3.891 4.177 -0.286 1
1 522 . 17 1 1 A 47 47 ALA C C 47 177.599 177.582 0.017 1
1 523 . 17 1 1 A 47 47 ALA CA C 47 54.796 53.346 1.450 1
1 524 . 17 1 1 A 47 47 ALA CB C 47 18.287 18.603 -0.316 1
1 525 . 17 1 1 A 47 47 ALA N N 47 123.895 124.149 -0.254 1
1 526 . 17 1 1 A 48 48 ASP H H 48 8.036 8.175 -0.139 1
1 527 . 17 1 1 A 48 48 ASP HA H 48 4.453 4.675 -0.222 1
1 530 . 17 1 1 A 48 48 ASP C C 48 175.836 176.065 -0.229 1
1 531 . 17 1 1 A 48 48 ASP CA C 48 53.368 53.647 -0.279 1
1 532 . 17 1 1 A 48 48 ASP CB C 48 39.964 41.029 -1.065 1
1 533 . 17 1 1 A 48 48 ASP N N 48 112.576 116.019 -3.443 1
1 534 . 17 1 1 A 49 49 GLU H H 49 7.495 7.207 0.288 1
1 535 . 17 1 1 A 49 49 GLU HA H 49 4.308 4.352 -0.044 1
1 540 . 17 1 1 A 49 49 GLU C C 49 175.756 176.052 -0.296 1
1 541 . 17 1 1 A 49 49 GLU CA C 49 56.224 55.706 0.518 1
1 542 . 17 1 1 A 49 49 GLU CB C 49 32.248 30.452 1.796 1
1 544 . 17 1 1 A 49 49 GLU N N 49 120.609 120.342 0.267 1
1 545 . 17 1 1 A 50 50 ALA H H 50 8.416 8.586 -0.170 1
1 546 . 17 1 1 A 50 50 ALA HA H 50 4.200 4.247 -0.047 1
1 550 . 17 1 1 A 50 50 ALA C C 50 177.433 177.296 0.137 1
1 551 . 17 1 1 A 50 50 ALA CA C 50 53.297 53.619 -0.322 1
1 552 . 17 1 1 A 50 50 ALA CB C 50 19.474 19.930 -0.456 1
1 553 . 17 1 1 A 50 50 ALA N N 50 124.065 125.113 -1.048 1
1 554 . 17 1 1 A 51 51 ARG H H 51 7.648 7.604 0.044 1
1 555 . 17 1 1 A 51 51 ARG HA H 51 4.747 4.771 -0.024 1
1 562 . 17 1 1 A 51 51 ARG C C 51 173.400 174.610 -1.210 1
1 563 . 17 1 1 A 51 51 ARG CA C 51 52.592 54.040 -1.448 1
1 564 . 17 1 1 A 51 51 ARG CB C 51 31.212 32.052 -0.840 1
1 567 . 17 1 1 A 51 51 ARG N N 51 117.798 116.421 1.377 1
1 568 . 17 1 1 A 52 52 PRO HA H 52 4.212 4.441 -0.229 1
1 575 . 17 1 1 A 52 52 PRO C C 52 176.380 176.200 0.180 1
1 576 . 17 1 1 A 52 52 PRO CA C 52 62.360 62.540 -0.180 1
1 577 . 17 1 1 A 52 52 PRO CB C 52 32.331 32.111 0.220 1
1 580 . 17 1 1 A 53 53 ASN H H 53 8.127 8.302 -0.175 1
1 581 . 17 1 1 A 53 53 ASN HA H 53 4.651 4.741 -0.090 1
1 586 . 17 1 1 A 53 53 ASN C C 53 174.354 174.603 -0.249 1
1 587 . 17 1 1 A 53 53 ASN CA C 53 53.136 52.635 0.501 1
1 588 . 17 1 1 A 53 53 ASN CB C 53 39.666 38.131 1.535 1
1 589 . 17 1 1 A 53 53 ASN N N 53 119.405 119.795 -0.390 1
1 591 . 17 1 1 A 54 54 THR H H 54 8.425 8.518 -0.093 1
1 592 . 17 1 1 A 54 54 THR HA H 54 5.306 4.492 0.814 1
1 597 . 17 1 1 A 54 54 THR C C 54 173.850 174.242 -0.392 1
1 598 . 17 1 1 A 54 54 THR CA C 54 61.881 63.233 -1.352 1
1 599 . 17 1 1 A 54 54 THR CB C 54 70.573 69.538 1.035 1
1 601 . 17 1 1 A 54 54 THR N N 54 118.968 120.940 -1.972 1
1 602 . 17 1 1 A 55 55 ILE H H 55 9.354 8.451 0.903 1
1 603 . 17 1 1 A 55 55 ILE HA H 55 4.051 4.556 -0.505 1
1 613 . 17 1 1 A 55 55 ILE C C 55 172.975 173.229 -0.254 1
1 614 . 17 1 1 A 55 55 ILE CA C 55 61.003 59.880 1.123 1
1 615 . 17 1 1 A 55 55 ILE CB C 55 41.619 41.895 -0.276 1
1 619 . 17 1 1 A 55 55 ILE N N 55 127.961 125.490 2.471 1
1 620 . 17 1 1 A 56 56 ASP H H 56 8.132 8.676 -0.544 1
1 621 . 17 1 1 A 56 56 ASP HA H 56 5.334 5.361 -0.027 1
1 624 . 17 1 1 A 56 56 ASP C C 56 174.969 174.675 0.294 1
1 625 . 17 1 1 A 56 56 ASP CA C 56 53.702 52.703 0.999 1
1 626 . 17 1 1 A 56 56 ASP CB C 56 43.251 43.134 0.117 1
1 627 . 17 1 1 A 56 56 ASP N N 56 125.882 127.039 -1.157 1
1 628 . 17 1 1 A 57 57 PHE H H 57 8.955 8.785 0.170 1
1 629 . 17 1 1 A 57 57 PHE HA H 57 4.915 5.080 -0.165 1
1 637 . 17 1 1 A 57 57 PHE C C 57 177.361 175.501 1.860 1
1 638 . 17 1 1 A 57 57 PHE CA C 57 57.458 56.763 0.695 1
1 639 . 17 1 1 A 57 57 PHE CB C 57 43.737 43.868 -0.131 1
1 645 . 17 1 1 A 57 57 PHE N N 57 118.872 122.729 -3.857 1
1 646 . 17 1 1 A 58 58 GLY H H 58 9.552 9.266 0.286 1
1 647 . 17 1 1 A 58 58 GLY HA2 H 58 4.662 4.181 0.481 1
1 648 . 17 1 1 A 58 58 GLY HA3 H 58 4.126 4.256 -0.130 1
1 649 . 17 1 1 A 58 58 GLY C C 58 174.760 174.993 -0.233 1
1 650 . 17 1 1 A 58 58 GLY CA C 58 44.680 44.919 -0.239 1
1 651 . 17 1 1 A 58 58 GLY N N 58 111.551 109.666 1.885 1
1 652 . 17 1 1 A 59 59 LYS H H 59 8.211 8.643 -0.432 1
1 653 . 17 1 1 A 59 59 LYS HA H 59 3.782 3.646 0.136 1
1 662 . 17 1 1 A 59 59 LYS C C 59 176.154 178.325 -2.171 1
1 663 . 17 1 1 A 59 59 LYS CA C 59 59.080 58.811 0.269 1
1 664 . 17 1 1 A 59 59 LYS CB C 59 32.516 31.750 0.766 1
1 668 . 17 1 1 A 59 59 LYS N N 59 115.953 120.570 -4.617 1
1 669 . 17 1 1 A 60 60 ASP H H 60 8.634 8.072 0.562 1
1 670 . 17 1 1 A 60 60 ASP HA H 60 4.882 4.434 0.448 1
1 673 . 17 1 1 A 60 60 ASP C C 60 176.039 176.434 -0.395 1
1 674 . 17 1 1 A 60 60 ASP CA C 60 54.327 57.331 -3.004 1
1 675 . 17 1 1 A 60 60 ASP CB C 60 41.461 41.413 0.048 1
1 676 . 17 1 1 A 60 60 ASP N N 60 117.261 120.093 -2.832 1
1 677 . 17 1 1 A 61 61 ASP H H 61 7.500 8.353 -0.853 1
1 678 . 17 1 1 A 61 61 ASP HA H 61 4.591 4.703 -0.112 1
1 681 . 17 1 1 A 61 61 ASP C C 61 175.140 175.718 -0.578 1
1 682 . 17 1 1 A 61 61 ASP CA C 61 55.342 53.941 1.401 1
1 683 . 17 1 1 A 61 61 ASP CB C 61 42.475 40.107 2.368 1
1 684 . 17 1 1 A 61 61 ASP N N 61 122.319 118.519 3.800 1
1 685 . 17 1 1 A 62 62 GLN H H 62 8.239 7.939 0.300 1
1 686 . 17 1 1 A 62 62 GLN HA H 62 2.569 3.713 -1.144 1
1 693 . 17 1 1 A 62 62 GLN C C 62 172.652 173.968 -1.316 1
1 694 . 17 1 1 A 62 62 GLN CA C 62 54.038 55.686 -1.648 1
1 695 . 17 1 1 A 62 62 GLN CB C 62 31.481 29.250 2.231 1
1 697 . 17 1 1 A 62 62 GLN N N 62 117.458 123.283 -5.825 1
1 699 . 17 1 1 A 63 63 HIS H H 63 6.338 6.843 -0.505 1
1 700 . 17 1 1 A 63 63 HIS HA H 63 4.423 4.421 0.002 1
1 704 . 17 1 1 A 63 63 HIS C C 63 173.031 172.520 0.511 1
1 705 . 17 1 1 A 63 63 HIS CA C 63 54.743 53.581 1.162 1
1 706 . 17 1 1 A 63 63 HIS CB C 63 32.661 31.962 0.699 1
1 708 . 17 1 1 A 63 63 HIS N N 63 113.589 115.789 -2.200 1
1 709 . 17 1 1 A 64 64 PHE H H 64 8.549 8.988 -0.439 1
1 710 . 17 1 1 A 64 64 PHE HA H 64 4.578 5.109 -0.531 1
1 718 . 17 1 1 A 64 64 PHE C C 64 173.015 173.663 -0.648 1
1 719 . 17 1 1 A 64 64 PHE CA C 64 58.516 57.233 1.283 1
1 720 . 17 1 1 A 64 64 PHE CB C 64 43.525 43.063 0.462 1
1 726 . 17 1 1 A 64 64 PHE N N 64 118.214 119.832 -1.618 1
1 727 . 17 1 1 A 65 65 THR H H 65 7.150 8.092 -0.942 1
1 728 . 17 1 1 A 65 65 THR HA H 65 4.930 4.670 0.260 1
1 733 . 17 1 1 A 65 65 THR C C 65 172.457 173.609 -1.152 1
1 734 . 17 1 1 A 65 65 THR CA C 65 61.690 61.678 0.012 1
1 735 . 17 1 1 A 65 65 THR CB C 65 69.593 69.499 0.094 1
1 737 . 17 1 1 A 65 65 THR N N 65 123.198 120.346 2.852 1
1 738 . 17 1 1 A 66 66 VAL H H 66 8.888 8.491 0.397 1
1 739 . 17 1 1 A 66 66 VAL HA H 66 4.018 4.812 -0.794 1
1 747 . 17 1 1 A 66 66 VAL C C 66 174.868 175.369 -0.501 1
1 748 . 17 1 1 A 66 66 VAL CA C 66 61.178 60.617 0.561 1
1 749 . 17 1 1 A 66 66 VAL CB C 66 33.114 33.199 -0.085 1
1 752 . 17 1 1 A 66 66 VAL N N 66 126.840 128.375 -1.535 1
1 753 . 17 1 1 A 67 67 THR H H 67 8.174 8.508 -0.334 1
1 754 . 17 1 1 A 67 67 THR HA H 67 4.816 4.990 -0.174 1
1 759 . 17 1 1 A 67 67 THR C C 67 174.494 174.290 0.204 1
1 760 . 17 1 1 A 67 67 THR CA C 67 59.786 59.595 0.191 1
1 761 . 17 1 1 A 67 67 THR CB C 67 70.887 71.750 -0.863 1
1 763 . 17 1 1 A 67 67 THR N N 67 116.127 117.166 -1.039 1
1 764 . 17 1 1 A 68 68 GLY H H 68 8.570 8.430 0.140 1
1 765 . 17 1 1 A 68 68 GLY HA2 H 68 3.970 4.003 -0.033 1
1 766 . 17 1 1 A 68 68 GLY HA3 H 68 3.819 4.010 -0.191 1
1 767 . 17 1 1 A 68 68 GLY C C 68 175.636 174.945 0.691 1
1 768 . 17 1 1 A 68 68 GLY CA C 68 46.397 45.333 1.064 1
1 769 . 17 1 1 A 68 68 GLY N N 68 107.146 113.122 -5.976 1
1 770 . 17 1 1 A 69 69 LEU H H 69 8.007 7.747 0.260 1
1 771 . 17 1 1 A 69 69 LEU HA H 69 4.154 4.388 -0.234 1
1 781 . 17 1 1 A 69 69 LEU C C 69 176.830 176.245 0.585 1
1 782 . 17 1 1 A 69 69 LEU CA C 69 54.602 54.806 -0.204 1
1 783 . 17 1 1 A 69 69 LEU CB C 69 41.149 42.499 -1.350 1
1 787 . 17 1 1 A 69 69 LEU N N 69 118.433 122.779 -4.346 1
1 788 . 17 1 1 A 70 70 HIS H H 70 8.866 9.022 -0.156 1
1 789 . 17 1 1 A 70 70 HIS HA H 70 4.663 4.918 -0.255 1
1 793 . 17 1 1 A 70 70 HIS C C 70 176.667 175.402 1.265 1
1 794 . 17 1 1 A 70 70 HIS CA C 70 55.464 55.556 -0.092 1
1 795 . 17 1 1 A 70 70 HIS CB C 70 32.125 30.648 1.477 1
1 797 . 17 1 1 A 70 70 HIS N N 70 122.457 121.095 1.362 1
1 798 . 17 1 1 A 71 71 LYS H H 71 8.716 8.670 0.046 1
1 799 . 17 1 1 A 71 71 LYS HA H 71 4.320 4.434 -0.114 1
1 808 . 17 1 1 A 71 71 LYS C C 71 178.110 176.889 1.221 1
1 809 . 17 1 1 A 71 71 LYS CA C 71 57.035 56.530 0.505 1
1 810 . 17 1 1 A 71 71 LYS CB C 71 33.580 32.667 0.913 1
1 814 . 17 1 1 A 71 71 LYS N N 71 123.173 123.807 -0.634 1
1 815 . 17 1 1 A 72 72 GLY H H 72 7.709 8.739 -1.030 1
1 816 . 17 1 1 A 72 72 GLY HA2 H 72 3.800 3.943 -0.143 1
1 817 . 17 1 1 A 72 72 GLY HA3 H 72 3.769 3.948 -0.179 1
1 818 . 17 1 1 A 72 72 GLY C C 72 174.231 173.983 0.248 1
1 819 . 17 1 1 A 72 72 GLY CA C 72 47.866 46.369 1.497 1
1 820 . 17 1 1 A 72 72 GLY N N 72 114.881 111.687 3.194 1
1 821 . 17 1 1 A 73 73 THR H H 73 8.162 7.497 0.665 1
1 822 . 17 1 1 A 73 73 THR HA H 73 4.584 4.863 -0.279 1
1 827 . 17 1 1 A 73 73 THR C C 73 172.208 173.438 -1.230 1
1 828 . 17 1 1 A 73 73 THR CA C 73 62.307 61.315 0.992 1
1 829 . 17 1 1 A 73 73 THR CB C 73 72.123 72.060 0.063 1
1 831 . 17 1 1 A 73 73 THR N N 73 114.225 114.321 -0.096 1
1 832 . 17 1 1 A 74 74 THR H H 74 8.743 8.867 -0.124 1
1 833 . 17 1 1 A 74 74 THR HA H 74 5.138 5.039 0.099 1
1 838 . 17 1 1 A 74 74 THR C C 74 173.376 173.423 -0.047 1
1 839 . 17 1 1 A 74 74 THR CA C 74 62.724 62.672 0.052 1
1 840 . 17 1 1 A 74 74 THR CB C 74 69.202 70.428 -1.226 1
1 842 . 17 1 1 A 74 74 THR N N 74 123.376 120.590 2.786 1
1 843 . 17 1 1 A 75 75 TYR H H 75 9.549 9.066 0.483 1
1 844 . 17 1 1 A 75 75 TYR HA H 75 4.892 5.197 -0.305 1
1 851 . 17 1 1 A 75 75 TYR C C 75 173.991 175.171 -1.180 1
1 852 . 17 1 1 A 75 75 TYR CA C 75 57.740 56.079 1.661 1
1 853 . 17 1 1 A 75 75 TYR CB C 75 44.580 43.415 1.165 1
1 858 . 17 1 1 A 75 75 TYR N N 75 126.916 124.131 2.785 1
1 859 . 17 1 1 A 76 76 ILE H H 76 8.769 9.012 -0.243 1
1 860 . 17 1 1 A 76 76 ILE HA H 76 4.663 5.016 -0.353 1
1 870 . 17 1 1 A 76 76 ILE C C 76 174.683 175.243 -0.560 1
1 871 . 17 1 1 A 76 76 ILE CA C 76 60.455 60.528 -0.073 1
1 872 . 17 1 1 A 76 76 ILE CB C 76 40.284 39.608 0.676 1
1 876 . 17 1 1 A 76 76 ILE N N 76 119.407 121.247 -1.840 1
1 877 . 17 1 1 A 77 77 PHE H H 77 8.894 9.255 -0.361 1
1 878 . 17 1 1 A 77 77 PHE HA H 77 5.160 5.178 -0.018 1
1 886 . 17 1 1 A 77 77 PHE C C 77 174.794 175.291 -0.497 1
1 887 . 17 1 1 A 77 77 PHE CA C 77 56.831 57.425 -0.594 1
1 888 . 17 1 1 A 77 77 PHE CB C 77 43.132 41.486 1.646 1
1 894 . 17 1 1 A 77 77 PHE N N 77 124.622 126.753 -2.131 1
1 895 . 17 1 1 A 78 78 ARG H H 78 9.407 9.096 0.311 1
1 896 . 17 1 1 A 78 78 ARG HA H 78 5.689 5.577 0.112 1
1 904 . 17 1 1 A 78 78 ARG C C 78 174.376 174.428 -0.052 1
1 905 . 17 1 1 A 78 78 ARG CA C 78 54.530 54.636 -0.106 1
1 906 . 17 1 1 A 78 78 ARG CB C 78 34.473 33.751 0.722 1
1 909 . 17 1 1 A 78 78 ARG N N 78 120.055 121.283 -1.228 1
1 911 . 17 1 1 A 79 79 LEU H H 79 9.132 9.101 0.031 1
1 912 . 17 1 1 A 79 79 LEU HA H 79 5.398 5.183 0.215 1
1 922 . 17 1 1 A 79 79 LEU C C 79 174.006 174.347 -0.341 1
1 923 . 17 1 1 A 79 79 LEU CA C 79 53.401 53.226 0.175 1
1 924 . 17 1 1 A 79 79 LEU CB C 79 48.116 46.521 1.595 1
1 928 . 17 1 1 A 79 79 LEU N N 79 124.907 125.665 -0.758 1
1 929 . 17 1 1 A 80 80 ALA H H 80 8.737 8.093 0.644 1
1 930 . 17 1 1 A 80 80 ALA HA H 80 4.871 5.076 -0.205 1
1 934 . 17 1 1 A 80 80 ALA C C 80 176.057 175.724 0.333 1
1 935 . 17 1 1 A 80 80 ALA CA C 80 50.353 51.181 -0.828 1
1 936 . 17 1 1 A 80 80 ALA CB C 80 23.972 23.227 0.745 1
1 937 . 17 1 1 A 80 80 ALA N N 80 128.220 125.826 2.394 1
1 938 . 17 1 1 A 81 81 ALA H H 81 9.890 8.629 1.261 1
1 939 . 17 1 1 A 81 81 ALA HA H 81 4.794 4.994 -0.200 1
1 943 . 17 1 1 A 81 81 ALA C C 81 174.655 176.388 -1.733 1
1 944 . 17 1 1 A 81 81 ALA CA C 81 50.300 51.251 -0.951 1
1 945 . 17 1 1 A 81 81 ALA CB C 81 21.369 20.641 0.728 1
1 946 . 17 1 1 A 81 81 ALA N N 81 123.682 123.521 0.161 1
1 947 . 17 1 1 A 82 82 LYS H H 82 7.965 8.625 -0.660 1
1 948 . 17 1 1 A 82 82 LYS HA H 82 4.974 5.350 -0.376 1
1 957 . 17 1 1 A 82 82 LYS C C 82 175.671 175.152 0.519 1
1 958 . 17 1 1 A 82 82 LYS CA C 82 54.664 54.719 -0.055 1
1 959 . 17 1 1 A 82 82 LYS CB C 82 36.677 35.620 1.057 1
1 963 . 17 1 1 A 82 82 LYS N N 82 118.164 122.351 -4.187 1
1 964 . 17 1 1 A 83 83 ASN H H 83 8.663 8.770 -0.107 1
1 965 . 17 1 1 A 83 83 ASN HA H 83 5.113 5.070 0.043 1
1 970 . 17 1 1 A 83 83 ASN C C 83 176.582 175.971 0.611 1
1 971 . 17 1 1 A 83 83 ASN CA C 83 51.746 50.731 1.015 1
1 972 . 17 1 1 A 83 83 ASN CB C 83 40.357 40.176 0.181 1
1 973 . 17 1 1 A 83 83 ASN N N 83 124.784 124.280 0.504 1
1 975 . 17 1 1 A 84 84 ARG H H 84 8.873 8.862 0.011 1
1 976 . 17 1 1 A 84 84 ARG HA H 84 3.940 3.938 0.002 1
1 983 . 17 1 1 A 84 84 ARG C C 84 176.735 177.742 -1.007 1
1 984 . 17 1 1 A 84 84 ARG CA C 84 59.327 59.385 -0.058 1
1 985 . 17 1 1 A 84 84 ARG CB C 84 29.282 29.874 -0.592 1
1 988 . 17 1 1 A 84 84 ARG N N 84 117.891 120.199 -2.308 1
1 989 . 17 1 1 A 85 85 ALA H H 85 7.645 7.794 -0.149 1
1 990 . 17 1 1 A 85 85 ALA HA H 85 4.276 4.199 0.077 1
1 994 . 17 1 1 A 85 85 ALA C C 85 177.479 177.328 0.151 1
1 995 . 17 1 1 A 85 85 ALA CA C 85 52.818 52.995 -0.177 1
1 996 . 17 1 1 A 85 85 ALA CB C 85 18.806 19.500 -0.694 1
1 997 . 17 1 1 A 85 85 ALA N N 85 120.306 119.794 0.512 1
1 998 . 17 1 1 A 86 86 GLY H H 86 7.693 7.478 0.215 1
1 999 . 17 1 1 A 86 86 GLY HA2 H 86 4.456 4.107 0.349 1
1 1000 . 17 1 1 A 86 86 GLY HA3 H 86 3.649 4.110 -0.461 1
1 1001 . 17 1 1 A 86 86 GLY C C 86 172.068 172.467 -0.399 1
1 1002 . 17 1 1 A 86 86 GLY CA C 86 44.375 44.066 0.309 1
1 1003 . 17 1 1 A 86 86 GLY N N 86 106.594 103.883 2.711 1
1 1004 . 17 1 1 A 87 87 LEU H H 87 8.203 8.525 -0.322 1
1 1005 . 17 1 1 A 87 87 LEU HA H 87 4.629 4.677 -0.048 1
1 1015 . 17 1 1 A 87 87 LEU C C 87 179.155 176.539 2.616 1
1 1016 . 17 1 1 A 87 87 LEU CA C 87 54.814 55.535 -0.721 1
1 1017 . 17 1 1 A 87 87 LEU CB C 87 43.454 42.518 0.936 1
1 1021 . 17 1 1 A 87 87 LEU N N 87 120.879 122.444 -1.565 1
1 1022 . 17 1 1 A 88 88 GLY H H 88 8.492 8.365 0.127 1
1 1023 . 17 1 1 A 88 88 GLY HA2 H 88 4.339 4.154 0.185 1
1 1024 . 17 1 1 A 88 88 GLY HA3 H 88 4.122 4.161 -0.039 1
1 1025 . 17 1 1 A 88 88 GLY C C 88 173.030 173.377 -0.347 1
1 1026 . 17 1 1 A 88 88 GLY CA C 88 43.970 44.656 -0.686 1
1 1027 . 17 1 1 A 88 88 GLY N N 88 109.903 110.642 -0.739 1
1 1028 . 17 1 1 A 89 89 GLU H H 89 7.638 9.007 -1.369 1
1 1029 . 17 1 1 A 89 89 GLU HA H 89 4.103 4.354 -0.251 1
1 1034 . 17 1 1 A 89 89 GLU C C 89 177.511 175.802 1.709 1
1 1035 . 17 1 1 A 89 89 GLU CA C 89 56.659 56.699 -0.040 1
1 1036 . 17 1 1 A 89 89 GLU CB C 89 31.324 30.566 0.758 1
1 1038 . 17 1 1 A 89 89 GLU N N 89 117.551 122.409 -4.858 1
1 1039 . 17 1 1 A 90 90 GLU H H 90 8.734 9.077 -0.343 1
1 1040 . 17 1 1 A 90 90 GLU HA H 90 4.651 5.428 -0.777 1
1 1045 . 17 1 1 A 90 90 GLU C C 90 177.452 174.722 2.730 1
1 1046 . 17 1 1 A 90 90 GLU CA C 90 55.987 54.707 1.280 1
1 1047 . 17 1 1 A 90 90 GLU CB C 90 31.135 33.422 -2.287 1
1 1049 . 17 1 1 A 90 90 GLU N N 90 121.553 118.105 3.448 1
1 1050 . 17 1 1 A 91 91 PHE H H 91 9.411 9.178 0.233 1
1 1051 . 17 1 1 A 91 91 PHE HA H 91 4.665 5.009 -0.344 1
1 1059 . 17 1 1 A 91 91 PHE C C 91 173.944 174.633 -0.689 1
1 1060 . 17 1 1 A 91 91 PHE CA C 91 57.687 58.258 -0.571 1
1 1061 . 17 1 1 A 91 91 PHE CB C 91 40.890 41.083 -0.193 1
1 1067 . 17 1 1 A 91 91 PHE N N 91 125.459 125.159 0.300 1
1 1068 . 17 1 1 A 92 92 GLU H H 92 8.043 8.011 0.032 1
1 1069 . 17 1 1 A 92 92 GLU HA H 92 5.424 5.359 0.065 1
1 1074 . 17 1 1 A 92 92 GLU C C 92 174.295 174.404 -0.109 1
1 1075 . 17 1 1 A 92 92 GLU CA C 92 54.378 54.695 -0.317 1
1 1076 . 17 1 1 A 92 92 GLU CB C 92 33.662 33.602 0.060 1
1 1078 . 17 1 1 A 92 92 GLU N N 92 128.905 126.592 2.313 1
1 1079 . 17 1 1 A 93 93 LYS H H 93 9.142 8.674 0.468 1
1 1080 . 17 1 1 A 93 93 LYS HA H 93 4.541 5.073 -0.532 1
1 1089 . 17 1 1 A 93 93 LYS C C 93 173.366 173.976 -0.610 1
1 1090 . 17 1 1 A 93 93 LYS CA C 93 55.343 55.678 -0.335 1
1 1091 . 17 1 1 A 93 93 LYS CB C 93 37.317 36.017 1.300 1
1 1095 . 17 1 1 A 93 93 LYS N N 93 125.231 126.687 -1.456 1
1 1096 . 17 1 1 A 94 94 GLU H H 94 8.655 9.197 -0.542 1
1 1097 . 17 1 1 A 94 94 GLU HA H 94 5.558 5.449 0.109 1
1 1102 . 17 1 1 A 94 94 GLU C C 94 176.238 175.413 0.825 1
1 1103 . 17 1 1 A 94 94 GLU CA C 94 54.632 54.978 -0.346 1
1 1104 . 17 1 1 A 94 94 GLU CB C 94 32.166 32.683 -0.517 1
1 1106 . 17 1 1 A 94 94 GLU N N 94 127.232 128.149 -0.917 1
1 1107 . 17 1 1 A 95 95 ILE H H 95 9.302 9.014 0.288 1
1 1108 . 17 1 1 A 95 95 ILE HA H 95 4.794 5.279 -0.485 1
1 1118 . 17 1 1 A 95 95 ILE C C 95 173.138 174.627 -1.489 1
1 1119 . 17 1 1 A 95 95 ILE CA C 95 58.570 58.733 -0.163 1
1 1120 . 17 1 1 A 95 95 ILE CB C 95 42.420 42.190 0.230 1
1 1124 . 17 1 1 A 95 95 ILE N N 95 120.711 121.483 -0.772 1
1 1125 . 17 1 1 A 96 96 ARG H H 96 8.589 8.726 -0.137 1
1 1126 . 17 1 1 A 96 96 ARG HA H 96 5.373 4.917 0.456 1
1 1133 . 17 1 1 A 96 96 ARG C C 96 177.147 174.927 2.220 1
1 1134 . 17 1 1 A 96 96 ARG CA C 96 54.045 55.356 -1.311 1
1 1135 . 17 1 1 A 96 96 ARG CB C 96 32.001 33.539 -1.538 1
1 1138 . 17 1 1 A 96 96 ARG N N 96 124.445 121.566 2.879 1
1 1139 . 17 1 1 A 97 97 THR H H 97 9.243 8.579 0.664 1
1 1140 . 17 1 1 A 97 97 THR HA H 97 4.459 4.679 -0.220 1
1 1145 . 17 1 1 A 97 97 THR C C 97 172.745 173.940 -1.195 1
1 1146 . 17 1 1 A 97 97 THR CA C 97 59.637 60.634 -0.997 1
1 1147 . 17 1 1 A 97 97 THR CB C 97 67.687 68.828 -1.141 1
1 1149 . 17 1 1 A 97 97 THR N N 97 119.370 118.525 0.845 1
1 1150 . 17 1 1 A 98 98 PRO HA H 98 4.494 4.752 -0.258 1
1 1157 . 17 1 1 A 98 98 PRO CA C 98 63.117 62.715 0.402 1
1 1158 . 17 1 1 A 98 98 PRO CB C 98 32.500 31.866 0.634 1
1 1161 . 17 1 1 A 99 99 GLU H H 99 8.534 8.404 0.130 1
1 1162 . 17 1 1 A 99 99 GLU HA H 99 4.195 4.329 -0.134 1
1 1167 . 17 1 1 A 99 99 GLU C C 99 175.881 175.617 0.264 1
1 1168 . 17 1 1 A 99 99 GLU CA C 99 56.330 55.555 0.775 1
1 1169 . 17 1 1 A 99 99 GLU CB C 99 31.062 30.518 0.544 1
1 1171 . 17 1 1 A 99 99 GLU N N 99 119.688 118.887 0.801 1
1 1172 . 17 1 1 A 100 100 ASP H H 100 8.536 8.581 -0.045 1
1 1173 . 17 1 1 A 100 100 ASP HA H 100 4.607 5.052 -0.445 1
1 1176 . 17 1 1 A 100 100 ASP C C 100 176.012 174.400 1.612 1
1 1177 . 17 1 1 A 100 100 ASP CA C 100 54.109 52.862 1.247 1
1 1178 . 17 1 1 A 100 100 ASP CB C 100 41.562 45.477 -3.915 1
1 1179 . 17 1 1 A 100 100 ASP N N 100 119.803 119.321 0.482 1
1 1180 . 17 1 1 A 101 101 LEU H H 101 8.403 8.361 0.042 1
1 1181 . 17 1 1 A 101 101 LEU HA H 101 4.426 4.374 0.052 1
1 1191 . 17 1 1 A 101 101 LEU C C 101 177.534 176.236 1.298 1
1 1192 . 17 1 1 A 101 101 LEU CA C 101 55.113 56.065 -0.952 1
1 1193 . 17 1 1 A 101 101 LEU CB C 101 42.156 42.732 -0.576 1
1 1197 . 17 1 1 A 101 101 LEU N N 101 123.876 125.120 -1.244 1
1 1198 . 17 1 1 A 102 102 SER H H 102 8.413 8.645 -0.232 1
1 1199 . 17 1 1 A 102 102 SER HA H 102 4.434 4.259 0.175 1
1 1202 . 17 1 1 A 102 102 SER C C 102 174.674 174.506 0.168 1
1 1203 . 17 1 1 A 102 102 SER CA C 102 58.798 59.722 -0.924 1
1 1204 . 17 1 1 A 102 102 SER CB C 102 63.854 62.743 1.111 1
1 1205 . 17 1 1 A 102 102 SER N N 102 116.667 121.148 -4.481 1
1 1206 . 17 1 1 A 103 103 GLY H H 103 8.213 8.582 -0.369 1
1 1207 . 17 1 1 A 103 103 GLY HA2 H 103 4.164 4.149 0.015 1
1 1208 . 17 1 1 A 103 103 GLY HA3 H 103 4.057 4.150 -0.093 1
1 1209 . 17 1 1 A 103 103 GLY C C 103 171.822 172.509 -0.687 1
1 1210 . 17 1 1 A 103 103 GLY CA C 103 44.658 44.461 0.197 1
1 1211 . 17 1 1 A 103 103 GLY N N 103 110.592 109.154 1.438 1
1 1212 . 17 1 1 A 104 104 PRO HA H 104 4.475 4.756 -0.281 1
1 1219 . 17 1 1 A 104 104 PRO C C 104 177.445 175.102 2.343 1
1 1220 . 17 1 1 A 104 104 PRO CA C 104 63.312 62.804 0.508 1
1 1221 . 17 1 1 A 104 104 PRO CB C 104 32.190 31.729 0.461 1
1 1224 . 17 1 1 A 105 105 SER H H 105 8.538 8.740 -0.202 1
1 1225 . 17 1 1 A 105 105 SER HA H 105 4.541 5.173 -0.632 1
1 1228 . 17 1 1 A 105 105 SER C C 105 174.616 172.720 1.896 1
1 1229 . 17 1 1 A 105 105 SER CA C 105 58.270 56.878 1.392 1
1 1230 . 17 1 1 A 105 105 SER CB C 105 63.895 66.027 -2.132 1
1 1231 . 17 1 1 A 105 105 SER N N 105 116.446 118.327 -1.881 1
1 1232 . 17 1 1 A 106 106 SER H H 106 8.350 8.510 -0.160 1
1 1233 . 17 1 1 A 106 106 SER HA H 106 4.541 5.128 -0.587 1
1 1236 . 17 1 1 A 106 106 SER C C 106 174.530 174.585 -0.055 1
1 1237 . 17 1 1 A 106 106 SER CA C 106 58.357 56.493 1.864 1
1 1238 . 17 1 1 A 106 106 SER CB C 106 64.020 66.053 -2.033 1
1 1239 . 17 1 1 A 106 106 SER N N 106 117.448 117.238 0.210 1
1 1 . 18 1 1 A 2 2 SER C C 2 174.723 173.493 1.230 1
1 2 . 18 1 1 A 2 2 SER CA C 2 58.446 57.634 0.812 1
1 3 . 18 1 1 A 2 2 SER CB C 2 63.566 64.741 -1.175 1
1 4 . 18 1 1 A 3 3 SER H H 3 8.350 8.695 -0.345 1
1 5 . 18 1 1 A 3 3 SER C C 3 173.961 174.238 -0.277 1
1 6 . 18 1 1 A 3 3 SER CA C 3 58.428 56.178 2.250 1
1 7 . 18 1 1 A 3 3 SER CB C 3 63.937 65.736 -1.799 1
1 8 . 18 1 1 A 3 3 SER N N 3 117.923 118.517 -0.594 1
1 9 . 18 1 1 A 4 4 GLY H H 4 8.050 8.792 -0.742 1
1 10 . 18 1 1 A 4 4 GLY C C 4 179.009 173.528 5.481 1
1 11 . 18 1 1 A 4 4 GLY CA C 4 46.174 46.851 -0.677 1
1 12 . 18 1 1 A 4 4 GLY N N 4 116.890 112.275 4.615 1
1 13 . 18 1 1 A 7 7 GLY HA2 H 7 4.340 4.317 0.023 1
1 14 . 18 1 1 A 7 7 GLY HA3 H 7 3.629 4.318 -0.689 1
1 15 . 18 1 1 A 7 7 GLY CA C 7 44.381 44.727 -0.346 1
1 16 . 18 1 1 A 8 8 PRO HA H 8 4.476 4.493 -0.017 1
1 23 . 18 1 1 A 8 8 PRO C C 8 176.235 177.164 -0.929 1
1 24 . 18 1 1 A 8 8 PRO CA C 8 62.995 62.574 0.421 1
1 25 . 18 1 1 A 8 8 PRO CB C 8 33.266 32.219 1.047 1
1 28 . 18 1 1 A 9 9 GLY H H 9 8.585 8.422 0.163 1
1 29 . 18 1 1 A 9 9 GLY HA2 H 9 4.326 4.111 0.215 1
1 30 . 18 1 1 A 9 9 GLY HA3 H 9 4.009 4.117 -0.108 1
1 31 . 18 1 1 A 9 9 GLY C C 9 172.998 172.945 0.053 1
1 32 . 18 1 1 A 9 9 GLY CA C 9 44.393 44.348 0.045 1
1 33 . 18 1 1 A 9 9 GLY N N 9 106.004 107.565 -1.561 1
1 34 . 18 1 1 A 10 10 ARG H H 10 8.548 8.478 0.070 1
1 35 . 18 1 1 A 10 10 ARG HA H 10 4.654 5.102 -0.448 1
1 41 . 18 1 1 A 10 10 ARG C C 10 175.780 174.677 1.103 1
1 42 . 18 1 1 A 10 10 ARG CA C 10 54.708 54.342 0.366 1
1 43 . 18 1 1 A 10 10 ARG CB C 10 31.448 31.741 -0.293 1
1 45 . 18 1 1 A 10 10 ARG N N 10 119.407 118.803 0.604 1
1 46 . 18 1 1 A 11 11 PRO HA H 11 4.611 4.577 0.034 1
1 53 . 18 1 1 A 11 11 PRO C C 11 173.510 175.659 -2.149 1
1 54 . 18 1 1 A 11 11 PRO CA C 11 62.360 62.664 -0.304 1
1 55 . 18 1 1 A 11 11 PRO CB C 11 33.402 32.199 1.203 1
1 58 . 18 1 1 A 12 12 THR H H 12 7.572 8.483 -0.911 1
1 59 . 18 1 1 A 12 12 THR HA H 12 3.796 4.332 -0.536 1
1 64 . 18 1 1 A 12 12 THR C C 12 172.337 173.265 -0.928 1
1 65 . 18 1 1 A 12 12 THR CA C 12 61.778 61.723 0.055 1
1 66 . 18 1 1 A 12 12 THR CB C 12 70.561 69.205 1.356 1
1 68 . 18 1 1 A 12 12 THR N N 12 109.653 117.826 -8.173 1
1 69 . 18 1 1 A 13 13 MET H H 13 5.605 8.647 -3.042 1
1 70 . 18 1 1 A 13 13 MET HA H 13 5.091 5.107 -0.016 1
1 78 . 18 1 1 A 13 13 MET C C 13 172.639 174.943 -2.304 1
1 79 . 18 1 1 A 13 13 MET CA C 13 54.168 53.600 0.568 1
1 80 . 18 1 1 A 13 13 MET CB C 13 37.632 35.233 2.399 1
1 83 . 18 1 1 A 13 13 MET N N 13 121.634 126.903 -5.269 1
1 84 . 18 1 1 A 14 14 MET H H 14 9.254 9.241 0.013 1
1 85 . 18 1 1 A 14 14 MET HA H 14 4.662 5.152 -0.490 1
1 93 . 18 1 1 A 14 14 MET C C 14 174.388 174.620 -0.232 1
1 94 . 18 1 1 A 14 14 MET CA C 14 54.673 54.394 0.279 1
1 95 . 18 1 1 A 14 14 MET CB C 14 34.907 35.111 -0.204 1
1 98 . 18 1 1 A 14 14 MET N N 14 125.746 123.553 2.193 1
1 99 . 18 1 1 A 15 15 ILE H H 15 8.555 9.251 -0.696 1
1 100 . 18 1 1 A 15 15 ILE HA H 15 4.882 5.277 -0.395 1
1 110 . 18 1 1 A 15 15 ILE C C 15 174.962 174.654 0.308 1
1 111 . 18 1 1 A 15 15 ILE CA C 15 60.685 60.442 0.243 1
1 112 . 18 1 1 A 15 15 ILE CB C 15 40.878 39.276 1.602 1
1 116 . 18 1 1 A 15 15 ILE N N 15 121.623 126.249 -4.626 1
1 117 . 18 1 1 A 16 16 SER H H 16 8.703 8.832 -0.129 1
1 118 . 18 1 1 A 16 16 SER HA H 16 4.922 5.184 -0.262 1
1 121 . 18 1 1 A 16 16 SER C C 16 173.860 173.204 0.656 1
1 122 . 18 1 1 A 16 16 SER CA C 16 56.524 56.824 -0.300 1
1 123 . 18 1 1 A 16 16 SER CB C 16 65.004 65.015 -0.011 1
1 124 . 18 1 1 A 16 16 SER N N 16 122.261 122.694 -0.433 1
1 125 . 18 1 1 A 17 17 THR H H 17 8.759 8.662 0.097 1
1 126 . 18 1 1 A 17 17 THR HA H 17 4.885 4.752 0.133 1
1 131 . 18 1 1 A 17 17 THR C C 17 175.018 174.793 0.225 1
1 132 . 18 1 1 A 17 17 THR CA C 17 60.315 60.899 -0.584 1
1 133 . 18 1 1 A 17 17 THR CB C 17 69.799 69.417 0.382 1
1 135 . 18 1 1 A 17 17 THR N N 17 115.660 116.540 -0.880 1
1 136 . 18 1 1 A 18 18 THR H H 18 8.038 8.849 -0.811 1
1 137 . 18 1 1 A 18 18 THR HA H 18 4.596 4.394 0.202 1
1 142 . 18 1 1 A 18 18 THR CA C 18 60.707 62.317 -1.610 1
1 143 . 18 1 1 A 18 18 THR CB C 18 71.082 69.334 1.748 1
1 145 . 18 1 1 A 18 18 THR N N 18 112.362 116.064 -3.702 1
1 146 . 18 1 1 A 19 19 ALA H H 19 8.545 7.405 1.140 1
1 147 . 18 1 1 A 19 19 ALA HA H 19 4.412 4.426 -0.014 1
1 151 . 18 1 1 A 19 19 ALA C C 19 177.034 177.515 -0.481 1
1 152 . 18 1 1 A 19 19 ALA CA C 19 52.264 51.634 0.630 1
1 153 . 18 1 1 A 19 19 ALA CB C 19 19.292 20.935 -1.643 1
1 154 . 18 1 1 A 19 19 ALA N N 19 119.589 123.605 -4.016 1
1 155 . 18 1 1 A 20 20 MET H H 20 8.145 8.581 -0.436 1
1 156 . 18 1 1 A 20 20 MET HA H 20 4.447 4.190 0.257 1
1 164 . 18 1 1 A 20 20 MET C C 20 175.676 176.762 -1.086 1
1 165 . 18 1 1 A 20 20 MET CA C 20 55.764 55.265 0.499 1
1 166 . 18 1 1 A 20 20 MET CB C 20 31.495 31.947 -0.452 1
1 169 . 18 1 1 A 20 20 MET N N 20 116.950 119.990 -3.040 1
1 170 . 18 1 1 A 21 21 ASN H H 21 8.275 8.956 -0.681 1
1 171 . 18 1 1 A 21 21 ASN HA H 21 4.452 4.401 0.051 1
1 176 . 18 1 1 A 21 21 ASN C C 21 174.100 173.796 0.304 1
1 177 . 18 1 1 A 21 21 ASN CA C 21 54.320 54.565 -0.245 1
1 178 . 18 1 1 A 21 21 ASN CB C 21 37.234 37.127 0.107 1
1 179 . 18 1 1 A 21 21 ASN N N 21 113.198 118.476 -5.278 1
1 181 . 18 1 1 A 22 22 THR H H 22 7.071 7.088 -0.017 1
1 182 . 18 1 1 A 22 22 THR HA H 22 5.218 5.445 -0.227 1
1 187 . 18 1 1 A 22 22 THR C C 22 173.301 173.030 0.271 1
1 188 . 18 1 1 A 22 22 THR CA C 22 59.399 60.492 -1.093 1
1 189 . 18 1 1 A 22 22 THR CB C 22 72.714 71.977 0.737 1
1 191 . 18 1 1 A 22 22 THR N N 22 107.603 108.112 -0.509 1
1 192 . 18 1 1 A 23 23 ALA H H 23 8.687 8.716 -0.029 1
1 193 . 18 1 1 A 23 23 ALA HA H 23 4.925 5.093 -0.168 1
1 197 . 18 1 1 A 23 23 ALA C C 23 174.100 175.546 -1.446 1
1 198 . 18 1 1 A 23 23 ALA CA C 23 50.812 50.131 0.681 1
1 199 . 18 1 1 A 23 23 ALA CB C 23 21.122 21.276 -0.154 1
1 200 . 18 1 1 A 23 23 ALA N N 23 121.937 125.482 -3.545 1
1 201 . 18 1 1 A 24 24 LEU H H 24 8.833 8.959 -0.126 1
1 202 . 18 1 1 A 24 24 LEU HA H 24 4.673 4.509 0.164 1
1 212 . 18 1 1 A 24 24 LEU C C 24 175.140 174.595 0.545 1
1 213 . 18 1 1 A 24 24 LEU CA C 24 54.320 54.826 -0.506 1
1 214 . 18 1 1 A 24 24 LEU CB C 24 42.518 43.206 -0.688 1
1 218 . 18 1 1 A 24 24 LEU N N 24 123.721 126.300 -2.579 1
1 219 . 18 1 1 A 25 25 LEU H H 25 9.176 9.003 0.173 1
1 220 . 18 1 1 A 25 25 LEU HA H 25 5.112 5.002 0.110 1
1 230 . 18 1 1 A 25 25 LEU C C 25 176.414 175.875 0.539 1
1 231 . 18 1 1 A 25 25 LEU CA C 25 54.108 53.001 1.107 1
1 232 . 18 1 1 A 25 25 LEU CB C 25 43.230 43.029 0.201 1
1 236 . 18 1 1 A 25 25 LEU N N 25 128.589 128.605 -0.016 1
1 237 . 18 1 1 A 26 26 GLN H H 26 8.556 8.735 -0.179 1
1 238 . 18 1 1 A 26 26 GLN HA H 26 4.737 4.835 -0.098 1
1 245 . 18 1 1 A 26 26 GLN C C 26 174.372 174.308 0.064 1
1 246 . 18 1 1 A 26 26 GLN CA C 26 56.365 54.386 1.979 1
1 247 . 18 1 1 A 26 26 GLN CB C 26 33.320 31.775 1.545 1
1 249 . 18 1 1 A 26 26 GLN N N 26 119.630 122.998 -3.368 1
1 251 . 18 1 1 A 27 27 TRP H H 27 8.080 8.262 -0.182 1
1 252 . 18 1 1 A 27 27 TRP HA H 27 5.441 5.802 -0.361 1
1 261 . 18 1 1 A 27 27 TRP CA C 27 55.957 54.455 1.502 1
1 262 . 18 1 1 A 27 27 TRP CB C 27 32.517 32.217 0.300 1
1 268 . 18 1 1 A 27 27 TRP N N 27 121.276 121.735 -0.459 1
1 270 . 18 1 1 A 28 28 HIS H H 28 8.262 8.665 -0.403 1
1 271 . 18 1 1 A 28 28 HIS HA H 28 4.997 5.037 -0.040 1
1 275 . 18 1 1 A 28 28 HIS CA C 28 53.028 53.945 -0.917 1
1 276 . 18 1 1 A 28 28 HIS CB C 28 32.832 32.908 -0.076 1
1 278 . 18 1 1 A 28 28 HIS N N 28 116.245 116.858 -0.613 1
1 279 . 18 1 1 A 29 29 PRO HA H 29 4.984 4.682 0.302 1
1 286 . 18 1 1 A 29 29 PRO CA C 29 61.498 62.078 -0.580 1
1 287 . 18 1 1 A 29 29 PRO CB C 29 30.709 32.284 -1.575 1
1 290 . 18 1 1 A 30 30 PRO HA H 30 4.449 4.680 -0.231 1
1 297 . 18 1 1 A 30 30 PRO C C 30 175.733 176.407 -0.674 1
1 298 . 18 1 1 A 30 30 PRO CA C 30 62.245 62.543 -0.298 1
1 299 . 18 1 1 A 30 30 PRO CB C 30 32.083 33.460 -1.377 1
1 302 . 18 1 1 A 31 31 LYS H H 31 8.403 8.747 -0.344 1
1 303 . 18 1 1 A 31 31 LYS HA H 31 4.084 4.442 -0.358 1
1 312 . 18 1 1 A 31 31 LYS C C 31 177.166 178.325 -1.159 1
1 313 . 18 1 1 A 31 31 LYS CA C 31 57.866 57.187 0.679 1
1 314 . 18 1 1 A 31 31 LYS CB C 31 32.698 34.431 -1.733 1
1 318 . 18 1 1 A 31 31 LYS N N 31 121.693 120.806 0.887 1
1 319 . 18 1 1 A 32 32 GLU H H 32 8.102 7.825 0.277 1
1 320 . 18 1 1 A 32 32 GLU HA H 32 4.365 4.443 -0.078 1
1 325 . 18 1 1 A 32 32 GLU C C 32 174.248 176.283 -2.035 1
1 326 . 18 1 1 A 32 32 GLU CA C 32 55.448 56.152 -0.704 1
1 327 . 18 1 1 A 32 32 GLU CB C 32 29.405 30.117 -0.712 1
1 329 . 18 1 1 A 32 32 GLU N N 32 118.742 116.863 1.879 1
1 330 . 18 1 1 A 33 33 LEU H H 33 8.420 7.507 0.913 1
1 331 . 18 1 1 A 33 33 LEU HA H 33 4.499 4.672 -0.173 1
1 341 . 18 1 1 A 33 33 LEU C C 33 173.036 174.984 -1.948 1
1 342 . 18 1 1 A 33 33 LEU CA C 33 52.863 52.022 0.841 1
1 343 . 18 1 1 A 33 33 LEU CB C 33 42.535 43.184 -0.649 1
1 347 . 18 1 1 A 33 33 LEU N N 33 125.181 123.908 1.273 1
1 348 . 18 1 1 A 34 34 PRO HA H 34 4.488 4.478 0.010 1
1 355 . 18 1 1 A 34 34 PRO C C 34 177.544 176.873 0.671 1
1 356 . 18 1 1 A 34 34 PRO CA C 34 62.889 63.181 -0.292 1
1 357 . 18 1 1 A 34 34 PRO CB C 34 31.472 30.874 0.598 1
1 360 . 18 1 1 A 35 35 GLY H H 35 8.397 7.974 0.423 1
1 361 . 18 1 1 A 35 35 GLY HA2 H 35 4.059 4.124 -0.065 1
1 362 . 18 1 1 A 35 35 GLY HA3 H 35 3.716 4.125 -0.409 1
1 363 . 18 1 1 A 35 35 GLY C C 35 173.356 172.112 1.244 1
1 364 . 18 1 1 A 35 35 GLY CA C 35 45.892 45.026 0.866 1
1 365 . 18 1 1 A 35 35 GLY N N 35 110.524 112.031 -1.507 1
1 366 . 18 1 1 A 36 36 GLU H H 36 8.091 8.535 -0.444 1
1 367 . 18 1 1 A 36 36 GLU HA H 36 4.371 5.015 -0.644 1
1 372 . 18 1 1 A 36 36 GLU C C 36 174.864 174.421 0.443 1
1 373 . 18 1 1 A 36 36 GLU CA C 36 55.201 54.704 0.497 1
1 374 . 18 1 1 A 36 36 GLU CB C 36 31.878 32.782 -0.904 1
1 376 . 18 1 1 A 36 36 GLU N N 36 122.202 120.079 2.123 1
1 377 . 18 1 1 A 37 37 LEU H H 37 8.307 8.710 -0.403 1
1 378 . 18 1 1 A 37 37 LEU HA H 37 4.288 4.281 0.007 1
1 388 . 18 1 1 A 37 37 LEU C C 37 176.702 176.001 0.701 1
1 389 . 18 1 1 A 37 37 LEU CA C 37 55.342 55.995 -0.653 1
1 390 . 18 1 1 A 37 37 LEU CB C 37 42.715 42.321 0.394 1
1 394 . 18 1 1 A 37 37 LEU N N 37 123.204 124.683 -1.479 1
1 395 . 18 1 1 A 38 38 LEU H H 38 8.909 8.720 0.189 1
1 396 . 18 1 1 A 38 38 LEU HA H 38 4.640 4.730 -0.090 1
1 406 . 18 1 1 A 38 38 LEU C C 38 177.202 176.265 0.937 1
1 407 . 18 1 1 A 38 38 LEU CA C 38 54.390 54.615 -0.225 1
1 408 . 18 1 1 A 38 38 LEU CB C 38 43.770 43.634 0.136 1
1 412 . 18 1 1 A 38 38 LEU N N 38 123.021 127.214 -4.193 1
1 413 . 18 1 1 A 39 39 GLY H H 39 7.113 6.880 0.233 1
1 414 . 18 1 1 A 39 39 GLY HA2 H 39 4.816 3.587 1.229 1
1 415 . 18 1 1 A 39 39 GLY HA3 H 39 3.276 3.925 -0.649 1
1 416 . 18 1 1 A 39 39 GLY C C 39 169.863 170.440 -0.577 1
1 417 . 18 1 1 A 39 39 GLY CA C 39 44.622 45.264 -0.642 1
1 418 . 18 1 1 A 39 39 GLY N N 39 104.137 104.970 -0.833 1
1 419 . 18 1 1 A 40 40 TYR H H 40 8.318 8.781 -0.463 1
1 420 . 18 1 1 A 40 40 TYR HA H 40 5.414 5.192 0.222 1
1 425 . 18 1 1 A 40 40 TYR C C 40 174.448 172.204 2.244 1
1 426 . 18 1 1 A 40 40 TYR CA C 40 56.178 56.260 -0.082 1
1 427 . 18 1 1 A 40 40 TYR CB C 40 44.191 40.769 3.422 1
1 430 . 18 1 1 A 40 40 TYR N N 40 114.036 115.225 -1.189 1
1 431 . 18 1 1 A 41 41 ARG H H 41 9.347 8.895 0.452 1
1 432 . 18 1 1 A 41 41 ARG HA H 41 5.092 5.449 -0.357 1
1 440 . 18 1 1 A 41 41 ARG C C 41 174.097 174.131 -0.034 1
1 441 . 18 1 1 A 41 41 ARG CA C 41 56.100 54.341 1.759 1
1 442 . 18 1 1 A 41 41 ARG CB C 41 34.508 32.776 1.732 1
1 445 . 18 1 1 A 41 41 ARG N N 41 122.231 121.228 1.003 1
1 447 . 18 1 1 A 42 42 LEU H H 42 9.546 9.053 0.493 1
1 448 . 18 1 1 A 42 42 LEU HA H 42 5.459 5.202 0.257 1
1 458 . 18 1 1 A 42 42 LEU C C 42 174.913 174.862 0.051 1
1 459 . 18 1 1 A 42 42 LEU CA C 42 52.997 53.526 -0.529 1
1 460 . 18 1 1 A 42 42 LEU CB C 42 46.413 45.891 0.522 1
1 464 . 18 1 1 A 42 42 LEU N N 42 132.335 127.163 5.172 1
1 465 . 18 1 1 A 43 43 GLN H H 43 9.502 9.263 0.239 1
1 466 . 18 1 1 A 43 43 GLN HA H 43 5.847 5.589 0.258 1
1 473 . 18 1 1 A 43 43 GLN C C 43 175.329 174.245 1.084 1
1 474 . 18 1 1 A 43 43 GLN CA C 43 54.005 54.707 -0.702 1
1 475 . 18 1 1 A 43 43 GLN CB C 43 33.429 31.139 2.290 1
1 477 . 18 1 1 A 43 43 GLN N N 43 123.932 125.538 -1.606 1
1 479 . 18 1 1 A 44 44 TYR H H 44 8.615 8.383 0.232 1
1 480 . 18 1 1 A 44 44 TYR HA H 44 5.783 5.679 0.104 1
1 487 . 18 1 1 A 44 44 TYR C C 44 174.058 173.465 0.593 1
1 488 . 18 1 1 A 44 44 TYR CA C 44 55.942 56.647 -0.705 1
1 489 . 18 1 1 A 44 44 TYR CB C 44 43.052 41.255 1.797 1
1 494 . 18 1 1 A 44 44 TYR N N 44 117.355 120.312 -2.957 1
1 495 . 18 1 1 A 45 45 CYS H H 45 8.377 8.137 0.240 1
1 496 . 18 1 1 A 45 45 CYS HA H 45 4.772 4.823 -0.051 1
1 499 . 18 1 1 A 45 45 CYS C C 45 173.205 173.677 -0.472 1
1 500 . 18 1 1 A 45 45 CYS CA C 45 55.960 57.670 -1.710 1
1 501 . 18 1 1 A 45 45 CYS CB C 45 30.665 31.508 -0.843 1
1 502 . 18 1 1 A 45 45 CYS N N 45 115.140 118.304 -3.164 1
1 503 . 18 1 1 A 46 46 ARG H H 46 9.165 8.450 0.715 1
1 504 . 18 1 1 A 46 46 ARG HA H 46 4.068 3.287 0.781 1
1 511 . 18 1 1 A 46 46 ARG C C 46 178.440 177.414 1.026 1
1 512 . 18 1 1 A 46 46 ARG CA C 46 56.401 56.862 -0.461 1
1 513 . 18 1 1 A 46 46 ARG CB C 46 31.878 30.615 1.263 1
1 516 . 18 1 1 A 46 46 ARG N N 46 121.803 122.629 -0.826 1
1 517 . 18 1 1 A 47 47 ALA H H 47 8.273 8.668 -0.395 1
1 518 . 18 1 1 A 47 47 ALA HA H 47 3.891 4.015 -0.124 1
1 522 . 18 1 1 A 47 47 ALA C C 47 177.599 177.933 -0.334 1
1 523 . 18 1 1 A 47 47 ALA CA C 47 54.796 54.005 0.791 1
1 524 . 18 1 1 A 47 47 ALA CB C 47 18.287 18.671 -0.384 1
1 525 . 18 1 1 A 47 47 ALA N N 47 123.895 124.472 -0.577 1
1 526 . 18 1 1 A 48 48 ASP H H 48 8.036 7.799 0.237 1
1 527 . 18 1 1 A 48 48 ASP HA H 48 4.453 4.627 -0.174 1
1 530 . 18 1 1 A 48 48 ASP C C 48 175.836 176.226 -0.390 1
1 531 . 18 1 1 A 48 48 ASP CA C 48 53.368 55.039 -1.671 1
1 532 . 18 1 1 A 48 48 ASP CB C 48 39.964 41.650 -1.686 1
1 533 . 18 1 1 A 48 48 ASP N N 48 112.576 117.303 -4.727 1
1 534 . 18 1 1 A 49 49 GLU H H 49 7.495 7.465 0.030 1
1 535 . 18 1 1 A 49 49 GLU HA H 49 4.308 4.421 -0.113 1
1 540 . 18 1 1 A 49 49 GLU C C 49 175.756 175.758 -0.002 1
1 541 . 18 1 1 A 49 49 GLU CA C 49 56.224 55.328 0.896 1
1 542 . 18 1 1 A 49 49 GLU CB C 49 32.248 30.635 1.613 1
1 544 . 18 1 1 A 49 49 GLU N N 49 120.609 119.020 1.589 1
1 545 . 18 1 1 A 50 50 ALA H H 50 8.416 8.598 -0.182 1
1 546 . 18 1 1 A 50 50 ALA HA H 50 4.200 4.428 -0.228 1
1 550 . 18 1 1 A 50 50 ALA C C 50 177.433 176.815 0.618 1
1 551 . 18 1 1 A 50 50 ALA CA C 50 53.297 52.385 0.912 1
1 552 . 18 1 1 A 50 50 ALA CB C 50 19.474 20.179 -0.705 1
1 553 . 18 1 1 A 50 50 ALA N N 50 124.065 123.657 0.408 1
1 554 . 18 1 1 A 51 51 ARG H H 51 7.648 7.638 0.010 1
1 555 . 18 1 1 A 51 51 ARG HA H 51 4.747 4.568 0.179 1
1 562 . 18 1 1 A 51 51 ARG C C 51 173.400 173.746 -0.346 1
1 563 . 18 1 1 A 51 51 ARG CA C 51 52.592 52.186 0.406 1
1 564 . 18 1 1 A 51 51 ARG CB C 51 31.212 31.113 0.099 1
1 567 . 18 1 1 A 51 51 ARG N N 51 117.798 118.644 -0.846 1
1 568 . 18 1 1 A 52 52 PRO HA H 52 4.212 4.418 -0.206 1
1 575 . 18 1 1 A 52 52 PRO C C 52 176.380 176.594 -0.214 1
1 576 . 18 1 1 A 52 52 PRO CA C 52 62.360 62.727 -0.367 1
1 577 . 18 1 1 A 52 52 PRO CB C 52 32.331 31.878 0.453 1
1 580 . 18 1 1 A 53 53 ASN H H 53 8.127 8.208 -0.081 1
1 581 . 18 1 1 A 53 53 ASN HA H 53 4.651 4.721 -0.070 1
1 586 . 18 1 1 A 53 53 ASN C C 53 174.354 174.817 -0.463 1
1 587 . 18 1 1 A 53 53 ASN CA C 53 53.136 52.598 0.538 1
1 588 . 18 1 1 A 53 53 ASN CB C 53 39.666 37.697 1.969 1
1 589 . 18 1 1 A 53 53 ASN N N 53 119.405 119.974 -0.569 1
1 591 . 18 1 1 A 54 54 THR H H 54 8.425 8.158 0.267 1
1 592 . 18 1 1 A 54 54 THR HA H 54 5.306 4.867 0.439 1
1 597 . 18 1 1 A 54 54 THR C C 54 173.850 174.188 -0.338 1
1 598 . 18 1 1 A 54 54 THR CA C 54 61.881 63.401 -1.520 1
1 599 . 18 1 1 A 54 54 THR CB C 54 70.573 69.715 0.858 1
1 601 . 18 1 1 A 54 54 THR N N 54 118.968 121.594 -2.626 1
1 602 . 18 1 1 A 55 55 ILE H H 55 9.354 8.752 0.602 1
1 603 . 18 1 1 A 55 55 ILE HA H 55 4.051 4.622 -0.571 1
1 613 . 18 1 1 A 55 55 ILE C C 55 172.975 173.277 -0.302 1
1 614 . 18 1 1 A 55 55 ILE CA C 55 61.003 59.707 1.296 1
1 615 . 18 1 1 A 55 55 ILE CB C 55 41.619 41.887 -0.268 1
1 619 . 18 1 1 A 55 55 ILE N N 55 127.961 125.013 2.948 1
1 620 . 18 1 1 A 56 56 ASP H H 56 8.132 8.601 -0.469 1
1 621 . 18 1 1 A 56 56 ASP HA H 56 5.334 5.300 0.034 1
1 624 . 18 1 1 A 56 56 ASP C C 56 174.969 174.549 0.420 1
1 625 . 18 1 1 A 56 56 ASP CA C 56 53.702 52.598 1.104 1
1 626 . 18 1 1 A 56 56 ASP CB C 56 43.251 43.494 -0.243 1
1 627 . 18 1 1 A 56 56 ASP N N 56 125.882 124.858 1.024 1
1 628 . 18 1 1 A 57 57 PHE H H 57 8.955 8.663 0.292 1
1 629 . 18 1 1 A 57 57 PHE HA H 57 4.915 4.980 -0.065 1
1 637 . 18 1 1 A 57 57 PHE C C 57 177.361 175.457 1.904 1
1 638 . 18 1 1 A 57 57 PHE CA C 57 57.458 56.551 0.907 1
1 639 . 18 1 1 A 57 57 PHE CB C 57 43.737 43.663 0.074 1
1 645 . 18 1 1 A 57 57 PHE N N 57 118.872 123.214 -4.342 1
1 646 . 18 1 1 A 58 58 GLY H H 58 9.552 9.247 0.305 1
1 647 . 18 1 1 A 58 58 GLY HA2 H 58 4.662 4.147 0.515 1
1 648 . 18 1 1 A 58 58 GLY HA3 H 58 4.126 4.215 -0.089 1
1 649 . 18 1 1 A 58 58 GLY C C 58 174.760 174.970 -0.210 1
1 650 . 18 1 1 A 58 58 GLY CA C 58 44.680 45.002 -0.322 1
1 651 . 18 1 1 A 58 58 GLY N N 58 111.551 109.754 1.797 1
1 652 . 18 1 1 A 59 59 LYS H H 59 8.211 8.658 -0.447 1
1 653 . 18 1 1 A 59 59 LYS HA H 59 3.782 3.649 0.133 1
1 662 . 18 1 1 A 59 59 LYS C C 59 176.154 178.015 -1.861 1
1 663 . 18 1 1 A 59 59 LYS CA C 59 59.080 58.682 0.398 1
1 664 . 18 1 1 A 59 59 LYS CB C 59 32.516 31.783 0.733 1
1 668 . 18 1 1 A 59 59 LYS N N 59 115.953 120.525 -4.572 1
1 669 . 18 1 1 A 60 60 ASP H H 60 8.634 8.044 0.590 1
1 670 . 18 1 1 A 60 60 ASP HA H 60 4.882 4.539 0.343 1
1 673 . 18 1 1 A 60 60 ASP C C 60 176.039 177.094 -1.055 1
1 674 . 18 1 1 A 60 60 ASP CA C 60 54.327 56.620 -2.293 1
1 675 . 18 1 1 A 60 60 ASP CB C 60 41.461 40.808 0.653 1
1 676 . 18 1 1 A 60 60 ASP N N 60 117.261 118.584 -1.323 1
1 677 . 18 1 1 A 61 61 ASP H H 61 7.500 8.398 -0.898 1
1 678 . 18 1 1 A 61 61 ASP HA H 61 4.591 4.691 -0.100 1
1 681 . 18 1 1 A 61 61 ASP C C 61 175.140 175.883 -0.743 1
1 682 . 18 1 1 A 61 61 ASP CA C 61 55.342 53.787 1.555 1
1 683 . 18 1 1 A 61 61 ASP CB C 61 42.475 39.883 2.592 1
1 684 . 18 1 1 A 61 61 ASP N N 61 122.319 119.051 3.268 1
1 685 . 18 1 1 A 62 62 GLN H H 62 8.239 7.867 0.372 1
1 686 . 18 1 1 A 62 62 GLN HA H 62 2.569 3.757 -1.188 1
1 693 . 18 1 1 A 62 62 GLN C C 62 172.652 173.502 -0.850 1
1 694 . 18 1 1 A 62 62 GLN CA C 62 54.038 55.479 -1.441 1
1 695 . 18 1 1 A 62 62 GLN CB C 62 31.481 29.238 2.243 1
1 697 . 18 1 1 A 62 62 GLN N N 62 117.458 123.178 -5.720 1
1 699 . 18 1 1 A 63 63 HIS H H 63 6.338 6.716 -0.378 1
1 700 . 18 1 1 A 63 63 HIS HA H 63 4.423 4.296 0.127 1
1 704 . 18 1 1 A 63 63 HIS C C 63 173.031 172.434 0.597 1
1 705 . 18 1 1 A 63 63 HIS CA C 63 54.743 53.900 0.843 1
1 706 . 18 1 1 A 63 63 HIS CB C 63 32.661 31.136 1.525 1
1 708 . 18 1 1 A 63 63 HIS N N 63 113.589 115.625 -2.036 1
1 709 . 18 1 1 A 64 64 PHE H H 64 8.549 8.866 -0.317 1
1 710 . 18 1 1 A 64 64 PHE HA H 64 4.578 5.148 -0.570 1
1 718 . 18 1 1 A 64 64 PHE C C 64 173.015 173.438 -0.423 1
1 719 . 18 1 1 A 64 64 PHE CA C 64 58.516 56.737 1.779 1
1 720 . 18 1 1 A 64 64 PHE CB C 64 43.525 43.202 0.323 1
1 726 . 18 1 1 A 64 64 PHE N N 64 118.214 119.854 -1.640 1
1 727 . 18 1 1 A 65 65 THR H H 65 7.150 7.997 -0.847 1
1 728 . 18 1 1 A 65 65 THR HA H 65 4.930 4.727 0.203 1
1 733 . 18 1 1 A 65 65 THR C C 65 172.457 173.186 -0.729 1
1 734 . 18 1 1 A 65 65 THR CA C 65 61.690 61.639 0.051 1
1 735 . 18 1 1 A 65 65 THR CB C 65 69.593 69.382 0.211 1
1 737 . 18 1 1 A 65 65 THR N N 65 123.198 119.481 3.717 1
1 738 . 18 1 1 A 66 66 VAL H H 66 8.888 8.457 0.431 1
1 739 . 18 1 1 A 66 66 VAL HA H 66 4.018 4.813 -0.795 1
1 747 . 18 1 1 A 66 66 VAL C C 66 174.868 175.431 -0.563 1
1 748 . 18 1 1 A 66 66 VAL CA C 66 61.178 60.606 0.572 1
1 749 . 18 1 1 A 66 66 VAL CB C 66 33.114 33.339 -0.225 1
1 752 . 18 1 1 A 66 66 VAL N N 66 126.840 128.595 -1.755 1
1 753 . 18 1 1 A 67 67 THR H H 67 8.174 8.561 -0.387 1
1 754 . 18 1 1 A 67 67 THR HA H 67 4.816 4.981 -0.165 1
1 759 . 18 1 1 A 67 67 THR C C 67 174.494 174.342 0.152 1
1 760 . 18 1 1 A 67 67 THR CA C 67 59.786 59.554 0.232 1
1 761 . 18 1 1 A 67 67 THR CB C 67 70.887 71.624 -0.737 1
1 763 . 18 1 1 A 67 67 THR N N 67 116.127 117.087 -0.960 1
1 764 . 18 1 1 A 68 68 GLY H H 68 8.570 8.674 -0.104 1
1 765 . 18 1 1 A 68 68 GLY HA2 H 68 3.970 4.030 -0.060 1
1 766 . 18 1 1 A 68 68 GLY HA3 H 68 3.819 4.039 -0.220 1
1 767 . 18 1 1 A 68 68 GLY C C 68 175.636 174.680 0.956 1
1 768 . 18 1 1 A 68 68 GLY CA C 68 46.397 45.167 1.230 1
1 769 . 18 1 1 A 68 68 GLY N N 68 107.146 113.127 -5.981 1
1 770 . 18 1 1 A 69 69 LEU H H 69 8.007 7.852 0.155 1
1 771 . 18 1 1 A 69 69 LEU HA H 69 4.154 4.258 -0.104 1
1 781 . 18 1 1 A 69 69 LEU C C 69 176.830 176.386 0.444 1
1 782 . 18 1 1 A 69 69 LEU CA C 69 54.602 54.970 -0.368 1
1 783 . 18 1 1 A 69 69 LEU CB C 69 41.149 41.998 -0.849 1
1 787 . 18 1 1 A 69 69 LEU N N 69 118.433 122.971 -4.538 1
1 788 . 18 1 1 A 70 70 HIS H H 70 8.866 8.738 0.128 1
1 789 . 18 1 1 A 70 70 HIS HA H 70 4.663 4.613 0.050 1
1 793 . 18 1 1 A 70 70 HIS C C 70 176.667 175.726 0.941 1
1 794 . 18 1 1 A 70 70 HIS CA C 70 55.464 57.373 -1.909 1
1 795 . 18 1 1 A 70 70 HIS CB C 70 32.125 29.899 2.226 1
1 797 . 18 1 1 A 70 70 HIS N N 70 122.457 122.595 -0.138 1
1 798 . 18 1 1 A 71 71 LYS H H 71 8.716 8.643 0.073 1
1 799 . 18 1 1 A 71 71 LYS HA H 71 4.320 4.181 0.139 1
1 808 . 18 1 1 A 71 71 LYS C C 71 178.110 176.755 1.355 1
1 809 . 18 1 1 A 71 71 LYS CA C 71 57.035 56.328 0.707 1
1 810 . 18 1 1 A 71 71 LYS CB C 71 33.580 33.032 0.548 1
1 814 . 18 1 1 A 71 71 LYS N N 71 123.173 123.701 -0.528 1
1 815 . 18 1 1 A 72 72 GLY H H 72 7.709 8.803 -1.094 1
1 816 . 18 1 1 A 72 72 GLY HA2 H 72 3.800 3.925 -0.125 1
1 817 . 18 1 1 A 72 72 GLY HA3 H 72 3.769 3.932 -0.163 1
1 818 . 18 1 1 A 72 72 GLY C C 72 174.231 173.908 0.323 1
1 819 . 18 1 1 A 72 72 GLY CA C 72 47.866 46.324 1.542 1
1 820 . 18 1 1 A 72 72 GLY N N 72 114.881 110.325 4.556 1
1 821 . 18 1 1 A 73 73 THR H H 73 8.162 7.702 0.460 1
1 822 . 18 1 1 A 73 73 THR HA H 73 4.584 4.647 -0.063 1
1 827 . 18 1 1 A 73 73 THR C C 73 172.208 173.401 -1.193 1
1 828 . 18 1 1 A 73 73 THR CA C 73 62.307 61.250 1.057 1
1 829 . 18 1 1 A 73 73 THR CB C 73 72.123 71.670 0.453 1
1 831 . 18 1 1 A 73 73 THR N N 73 114.225 114.573 -0.348 1
1 832 . 18 1 1 A 74 74 THR H H 74 8.743 8.736 0.007 1
1 833 . 18 1 1 A 74 74 THR HA H 74 5.138 4.841 0.297 1
1 838 . 18 1 1 A 74 74 THR C C 74 173.376 173.540 -0.164 1
1 839 . 18 1 1 A 74 74 THR CA C 74 62.724 62.965 -0.241 1
1 840 . 18 1 1 A 74 74 THR CB C 74 69.202 69.707 -0.505 1
1 842 . 18 1 1 A 74 74 THR N N 74 123.376 120.727 2.649 1
1 843 . 18 1 1 A 75 75 TYR H H 75 9.549 9.057 0.492 1
1 844 . 18 1 1 A 75 75 TYR HA H 75 4.892 5.202 -0.310 1
1 851 . 18 1 1 A 75 75 TYR C C 75 173.991 175.230 -1.239 1
1 852 . 18 1 1 A 75 75 TYR CA C 75 57.740 56.156 1.584 1
1 853 . 18 1 1 A 75 75 TYR CB C 75 44.580 43.172 1.408 1
1 858 . 18 1 1 A 75 75 TYR N N 75 126.916 124.185 2.731 1
1 859 . 18 1 1 A 76 76 ILE H H 76 8.769 8.632 0.137 1
1 860 . 18 1 1 A 76 76 ILE HA H 76 4.663 4.928 -0.265 1
1 870 . 18 1 1 A 76 76 ILE C C 76 174.683 175.116 -0.433 1
1 871 . 18 1 1 A 76 76 ILE CA C 76 60.455 60.764 -0.309 1
1 872 . 18 1 1 A 76 76 ILE CB C 76 40.284 40.096 0.188 1
1 876 . 18 1 1 A 76 76 ILE N N 76 119.407 120.704 -1.297 1
1 877 . 18 1 1 A 77 77 PHE H H 77 8.894 9.141 -0.247 1
1 878 . 18 1 1 A 77 77 PHE HA H 77 5.160 5.202 -0.042 1
1 886 . 18 1 1 A 77 77 PHE C C 77 174.794 175.292 -0.498 1
1 887 . 18 1 1 A 77 77 PHE CA C 77 56.831 57.420 -0.589 1
1 888 . 18 1 1 A 77 77 PHE CB C 77 43.132 41.270 1.862 1
1 894 . 18 1 1 A 77 77 PHE N N 77 124.622 126.848 -2.226 1
1 895 . 18 1 1 A 78 78 ARG H H 78 9.407 8.932 0.475 1
1 896 . 18 1 1 A 78 78 ARG HA H 78 5.689 5.708 -0.019 1
1 904 . 18 1 1 A 78 78 ARG C C 78 174.376 174.569 -0.193 1
1 905 . 18 1 1 A 78 78 ARG CA C 78 54.530 54.630 -0.100 1
1 906 . 18 1 1 A 78 78 ARG CB C 78 34.473 33.958 0.515 1
1 909 . 18 1 1 A 78 78 ARG N N 78 120.055 121.290 -1.235 1
1 911 . 18 1 1 A 79 79 LEU H H 79 9.132 8.678 0.454 1
1 912 . 18 1 1 A 79 79 LEU HA H 79 5.398 5.132 0.266 1
1 922 . 18 1 1 A 79 79 LEU C C 79 174.006 174.344 -0.338 1
1 923 . 18 1 1 A 79 79 LEU CA C 79 53.401 53.230 0.171 1
1 924 . 18 1 1 A 79 79 LEU CB C 79 48.116 46.515 1.601 1
1 928 . 18 1 1 A 79 79 LEU N N 79 124.907 124.222 0.685 1
1 929 . 18 1 1 A 80 80 ALA H H 80 8.737 8.021 0.716 1
1 930 . 18 1 1 A 80 80 ALA HA H 80 4.871 5.009 -0.138 1
1 934 . 18 1 1 A 80 80 ALA C C 80 176.057 175.792 0.265 1
1 935 . 18 1 1 A 80 80 ALA CA C 80 50.353 51.302 -0.949 1
1 936 . 18 1 1 A 80 80 ALA CB C 80 23.972 23.431 0.541 1
1 937 . 18 1 1 A 80 80 ALA N N 80 128.220 125.310 2.910 1
1 938 . 18 1 1 A 81 81 ALA H H 81 9.890 8.628 1.262 1
1 939 . 18 1 1 A 81 81 ALA HA H 81 4.794 5.178 -0.384 1
1 943 . 18 1 1 A 81 81 ALA C C 81 174.655 175.888 -1.233 1
1 944 . 18 1 1 A 81 81 ALA CA C 81 50.300 50.716 -0.416 1
1 945 . 18 1 1 A 81 81 ALA CB C 81 21.369 21.059 0.310 1
1 946 . 18 1 1 A 81 81 ALA N N 81 123.682 123.312 0.370 1
1 947 . 18 1 1 A 82 82 LYS H H 82 7.965 8.746 -0.781 1
1 948 . 18 1 1 A 82 82 LYS HA H 82 4.974 5.172 -0.198 1
1 957 . 18 1 1 A 82 82 LYS C C 82 175.671 175.156 0.515 1
1 958 . 18 1 1 A 82 82 LYS CA C 82 54.664 54.742 -0.078 1
1 959 . 18 1 1 A 82 82 LYS CB C 82 36.677 35.606 1.071 1
1 963 . 18 1 1 A 82 82 LYS N N 82 118.164 122.454 -4.290 1
1 964 . 18 1 1 A 83 83 ASN H H 83 8.663 8.873 -0.210 1
1 965 . 18 1 1 A 83 83 ASN HA H 83 5.113 5.083 0.030 1
1 970 . 18 1 1 A 83 83 ASN C C 83 176.582 176.047 0.535 1
1 971 . 18 1 1 A 83 83 ASN CA C 83 51.746 50.687 1.059 1
1 972 . 18 1 1 A 83 83 ASN CB C 83 40.357 40.131 0.226 1
1 973 . 18 1 1 A 83 83 ASN N N 83 124.784 124.279 0.505 1
1 975 . 18 1 1 A 84 84 ARG H H 84 8.873 8.795 0.078 1
1 976 . 18 1 1 A 84 84 ARG HA H 84 3.940 3.926 0.014 1
1 983 . 18 1 1 A 84 84 ARG C C 84 176.735 177.500 -0.765 1
1 984 . 18 1 1 A 84 84 ARG CA C 84 59.327 59.212 0.115 1
1 985 . 18 1 1 A 84 84 ARG CB C 84 29.282 29.822 -0.540 1
1 988 . 18 1 1 A 84 84 ARG N N 84 117.891 119.699 -1.808 1
1 989 . 18 1 1 A 85 85 ALA H H 85 7.645 7.816 -0.171 1
1 990 . 18 1 1 A 85 85 ALA HA H 85 4.276 4.282 -0.006 1
1 994 . 18 1 1 A 85 85 ALA C C 85 177.479 177.196 0.283 1
1 995 . 18 1 1 A 85 85 ALA CA C 85 52.818 52.604 0.214 1
1 996 . 18 1 1 A 85 85 ALA CB C 85 18.806 19.485 -0.679 1
1 997 . 18 1 1 A 85 85 ALA N N 85 120.306 119.698 0.608 1
1 998 . 18 1 1 A 86 86 GLY H H 86 7.693 7.600 0.093 1
1 999 . 18 1 1 A 86 86 GLY HA2 H 86 4.456 4.045 0.411 1
1 1000 . 18 1 1 A 86 86 GLY HA3 H 86 3.649 4.047 -0.398 1
1 1001 . 18 1 1 A 86 86 GLY C C 86 172.068 172.616 -0.548 1
1 1002 . 18 1 1 A 86 86 GLY CA C 86 44.375 43.888 0.487 1
1 1003 . 18 1 1 A 86 86 GLY N N 86 106.594 104.340 2.254 1
1 1004 . 18 1 1 A 87 87 LEU H H 87 8.203 8.499 -0.296 1
1 1005 . 18 1 1 A 87 87 LEU HA H 87 4.629 4.630 -0.001 1
1 1015 . 18 1 1 A 87 87 LEU C C 87 179.155 176.559 2.596 1
1 1016 . 18 1 1 A 87 87 LEU CA C 87 54.814 55.399 -0.585 1
1 1017 . 18 1 1 A 87 87 LEU CB C 87 43.454 42.434 1.020 1
1 1021 . 18 1 1 A 87 87 LEU N N 87 120.879 121.927 -1.048 1
1 1022 . 18 1 1 A 88 88 GLY H H 88 8.492 8.442 0.050 1
1 1023 . 18 1 1 A 88 88 GLY HA2 H 88 4.339 4.144 0.195 1
1 1024 . 18 1 1 A 88 88 GLY HA3 H 88 4.122 4.150 -0.028 1
1 1025 . 18 1 1 A 88 88 GLY C C 88 173.030 173.504 -0.474 1
1 1026 . 18 1 1 A 88 88 GLY CA C 88 43.970 44.573 -0.603 1
1 1027 . 18 1 1 A 88 88 GLY N N 88 109.903 110.798 -0.895 1
1 1028 . 18 1 1 A 89 89 GLU H H 89 7.638 8.961 -1.323 1
1 1029 . 18 1 1 A 89 89 GLU HA H 89 4.103 4.304 -0.201 1
1 1034 . 18 1 1 A 89 89 GLU C C 89 177.511 175.812 1.699 1
1 1035 . 18 1 1 A 89 89 GLU CA C 89 56.659 56.759 -0.100 1
1 1036 . 18 1 1 A 89 89 GLU CB C 89 31.324 30.740 0.584 1
1 1038 . 18 1 1 A 89 89 GLU N N 89 117.551 121.848 -4.297 1
1 1039 . 18 1 1 A 90 90 GLU H H 90 8.734 9.074 -0.340 1
1 1040 . 18 1 1 A 90 90 GLU HA H 90 4.651 5.406 -0.755 1
1 1045 . 18 1 1 A 90 90 GLU C C 90 177.452 174.343 3.109 1
1 1046 . 18 1 1 A 90 90 GLU CA C 90 55.987 54.587 1.400 1
1 1047 . 18 1 1 A 90 90 GLU CB C 90 31.135 33.405 -2.270 1
1 1049 . 18 1 1 A 90 90 GLU N N 90 121.553 117.914 3.639 1
1 1050 . 18 1 1 A 91 91 PHE H H 91 9.411 9.206 0.205 1
1 1051 . 18 1 1 A 91 91 PHE HA H 91 4.665 5.094 -0.429 1
1 1059 . 18 1 1 A 91 91 PHE C C 91 173.944 174.386 -0.442 1
1 1060 . 18 1 1 A 91 91 PHE CA C 91 57.687 57.530 0.157 1
1 1061 . 18 1 1 A 91 91 PHE CB C 91 40.890 41.907 -1.017 1
1 1067 . 18 1 1 A 91 91 PHE N N 91 125.459 125.034 0.425 1
1 1068 . 18 1 1 A 92 92 GLU H H 92 8.043 8.031 0.012 1
1 1069 . 18 1 1 A 92 92 GLU HA H 92 5.424 5.390 0.034 1
1 1074 . 18 1 1 A 92 92 GLU C C 92 174.295 174.217 0.078 1
1 1075 . 18 1 1 A 92 92 GLU CA C 92 54.378 54.776 -0.398 1
1 1076 . 18 1 1 A 92 92 GLU CB C 92 33.662 33.448 0.214 1
1 1078 . 18 1 1 A 92 92 GLU N N 92 128.905 127.013 1.892 1
1 1079 . 18 1 1 A 93 93 LYS H H 93 9.142 9.149 -0.007 1
1 1080 . 18 1 1 A 93 93 LYS HA H 93 4.541 5.330 -0.789 1
1 1089 . 18 1 1 A 93 93 LYS C C 93 173.366 173.960 -0.594 1
1 1090 . 18 1 1 A 93 93 LYS CA C 93 55.343 55.175 0.168 1
1 1091 . 18 1 1 A 93 93 LYS CB C 93 37.317 36.134 1.183 1
1 1095 . 18 1 1 A 93 93 LYS N N 93 125.231 127.230 -1.999 1
1 1096 . 18 1 1 A 94 94 GLU H H 94 8.655 9.193 -0.538 1
1 1097 . 18 1 1 A 94 94 GLU HA H 94 5.558 5.323 0.235 1
1 1102 . 18 1 1 A 94 94 GLU C C 94 176.238 175.612 0.626 1
1 1103 . 18 1 1 A 94 94 GLU CA C 94 54.632 55.090 -0.458 1
1 1104 . 18 1 1 A 94 94 GLU CB C 94 32.166 32.850 -0.684 1
1 1106 . 18 1 1 A 94 94 GLU N N 94 127.232 128.177 -0.945 1
1 1107 . 18 1 1 A 95 95 ILE H H 95 9.302 8.833 0.469 1
1 1108 . 18 1 1 A 95 95 ILE HA H 95 4.794 5.253 -0.459 1
1 1118 . 18 1 1 A 95 95 ILE C C 95 173.138 174.536 -1.398 1
1 1119 . 18 1 1 A 95 95 ILE CA C 95 58.570 58.481 0.089 1
1 1120 . 18 1 1 A 95 95 ILE CB C 95 42.420 42.818 -0.398 1
1 1124 . 18 1 1 A 95 95 ILE N N 95 120.711 121.186 -0.475 1
1 1125 . 18 1 1 A 96 96 ARG H H 96 8.589 8.747 -0.158 1
1 1126 . 18 1 1 A 96 96 ARG HA H 96 5.373 4.763 0.610 1
1 1133 . 18 1 1 A 96 96 ARG C C 96 177.147 175.050 2.097 1
1 1134 . 18 1 1 A 96 96 ARG CA C 96 54.045 55.353 -1.308 1
1 1135 . 18 1 1 A 96 96 ARG CB C 96 32.001 33.705 -1.704 1
1 1138 . 18 1 1 A 96 96 ARG N N 96 124.445 121.606 2.839 1
1 1139 . 18 1 1 A 97 97 THR H H 97 9.243 8.468 0.775 1
1 1140 . 18 1 1 A 97 97 THR HA H 97 4.459 4.708 -0.249 1
1 1145 . 18 1 1 A 97 97 THR C C 97 172.745 173.929 -1.184 1
1 1146 . 18 1 1 A 97 97 THR CA C 97 59.637 60.673 -1.036 1
1 1147 . 18 1 1 A 97 97 THR CB C 97 67.687 68.913 -1.226 1
1 1149 . 18 1 1 A 97 97 THR N N 97 119.370 118.517 0.853 1
1 1150 . 18 1 1 A 98 98 PRO HA H 98 4.494 4.735 -0.241 1
1 1157 . 18 1 1 A 98 98 PRO CA C 98 63.117 62.707 0.410 1
1 1158 . 18 1 1 A 98 98 PRO CB C 98 32.500 32.024 0.476 1
1 1161 . 18 1 1 A 99 99 GLU H H 99 8.534 8.409 0.125 1
1 1162 . 18 1 1 A 99 99 GLU HA H 99 4.195 4.382 -0.187 1
1 1167 . 18 1 1 A 99 99 GLU C C 99 175.881 175.277 0.604 1
1 1168 . 18 1 1 A 99 99 GLU CA C 99 56.330 55.846 0.484 1
1 1169 . 18 1 1 A 99 99 GLU CB C 99 31.062 30.535 0.527 1
1 1171 . 18 1 1 A 99 99 GLU N N 99 119.688 118.933 0.755 1
1 1172 . 18 1 1 A 100 100 ASP H H 100 8.536 8.742 -0.206 1
1 1173 . 18 1 1 A 100 100 ASP HA H 100 4.607 5.239 -0.632 1
1 1176 . 18 1 1 A 100 100 ASP C C 100 176.012 174.365 1.647 1
1 1177 . 18 1 1 A 100 100 ASP CA C 100 54.109 53.083 1.026 1
1 1178 . 18 1 1 A 100 100 ASP CB C 100 41.562 44.771 -3.209 1
1 1179 . 18 1 1 A 100 100 ASP N N 100 119.803 120.515 -0.712 1
1 1180 . 18 1 1 A 101 101 LEU H H 101 8.403 8.792 -0.389 1
1 1181 . 18 1 1 A 101 101 LEU HA H 101 4.426 4.529 -0.103 1
1 1191 . 18 1 1 A 101 101 LEU C C 101 177.534 175.845 1.689 1
1 1192 . 18 1 1 A 101 101 LEU CA C 101 55.113 54.120 0.993 1
1 1193 . 18 1 1 A 101 101 LEU CB C 101 42.156 45.097 -2.941 1
1 1197 . 18 1 1 A 101 101 LEU N N 101 123.876 124.341 -0.465 1
1 1198 . 18 1 1 A 102 102 SER H H 102 8.413 8.776 -0.363 1
1 1199 . 18 1 1 A 102 102 SER HA H 102 4.434 4.186 0.248 1
1 1202 . 18 1 1 A 102 102 SER C C 102 174.674 174.061 0.613 1
1 1203 . 18 1 1 A 102 102 SER CA C 102 58.798 59.045 -0.247 1
1 1204 . 18 1 1 A 102 102 SER CB C 102 63.854 61.137 2.717 1
1 1205 . 18 1 1 A 102 102 SER N N 102 116.667 120.693 -4.026 1
1 1206 . 18 1 1 A 103 103 GLY H H 103 8.213 8.210 0.003 1
1 1207 . 18 1 1 A 103 103 GLY HA2 H 103 4.164 4.043 0.121 1
1 1208 . 18 1 1 A 103 103 GLY HA3 H 103 4.057 4.043 0.014 1
1 1209 . 18 1 1 A 103 103 GLY C C 103 171.822 173.164 -1.342 1
1 1210 . 18 1 1 A 103 103 GLY CA C 103 44.658 44.158 0.500 1
1 1211 . 18 1 1 A 103 103 GLY N N 103 110.592 109.860 0.732 1
1 1212 . 18 1 1 A 104 104 PRO HA H 104 4.475 4.618 -0.143 1
1 1219 . 18 1 1 A 104 104 PRO C C 104 177.445 175.135 2.310 1
1 1220 . 18 1 1 A 104 104 PRO CA C 104 63.312 62.566 0.746 1
1 1221 . 18 1 1 A 104 104 PRO CB C 104 32.190 33.056 -0.866 1
1 1224 . 18 1 1 A 105 105 SER H H 105 8.538 8.646 -0.108 1
1 1225 . 18 1 1 A 105 105 SER HA H 105 4.541 4.991 -0.450 1
1 1228 . 18 1 1 A 105 105 SER C C 105 174.616 172.173 2.443 1
1 1229 . 18 1 1 A 105 105 SER CA C 105 58.270 57.040 1.230 1
1 1230 . 18 1 1 A 105 105 SER CB C 105 63.895 65.186 -1.291 1
1 1231 . 18 1 1 A 105 105 SER N N 105 116.446 115.965 0.481 1
1 1232 . 18 1 1 A 106 106 SER H H 106 8.350 8.798 -0.448 1
1 1233 . 18 1 1 A 106 106 SER HA H 106 4.541 5.070 -0.529 1
1 1236 . 18 1 1 A 106 106 SER C C 106 174.530 172.976 1.554 1
1 1237 . 18 1 1 A 106 106 SER CA C 106 58.357 57.399 0.958 1
1 1238 . 18 1 1 A 106 106 SER CB C 106 64.020 65.766 -1.746 1
1 1239 . 18 1 1 A 106 106 SER N N 106 117.448 119.032 -1.584 1
1 1 . 19 1 1 A 2 2 SER C C 2 174.723 175.307 -0.584 1
1 2 . 19 1 1 A 2 2 SER CA C 2 58.446 62.558 -4.112 1
1 3 . 19 1 1 A 2 2 SER CB C 2 63.566 62.946 0.620 1
1 4 . 19 1 1 A 3 3 SER H H 3 8.350 7.819 0.531 1
1 5 . 19 1 1 A 3 3 SER C C 3 173.961 175.154 -1.193 1
1 6 . 19 1 1 A 3 3 SER CA C 3 58.428 59.416 -0.988 1
1 7 . 19 1 1 A 3 3 SER CB C 3 63.937 64.247 -0.310 1
1 8 . 19 1 1 A 3 3 SER N N 3 117.923 116.228 1.695 1
1 9 . 19 1 1 A 4 4 GLY H H 4 8.050 8.515 -0.465 1
1 10 . 19 1 1 A 4 4 GLY C C 4 179.009 172.916 6.093 1
1 11 . 19 1 1 A 4 4 GLY CA C 4 46.174 44.703 1.471 1
1 12 . 19 1 1 A 4 4 GLY N N 4 116.890 110.648 6.242 1
1 13 . 19 1 1 A 7 7 GLY HA2 H 7 4.340 4.348 -0.008 1
1 14 . 19 1 1 A 7 7 GLY HA3 H 7 3.629 4.349 -0.720 1
1 15 . 19 1 1 A 7 7 GLY CA C 7 44.381 44.489 -0.108 1
1 16 . 19 1 1 A 8 8 PRO HA H 8 4.476 4.517 -0.041 1
1 23 . 19 1 1 A 8 8 PRO C C 8 176.235 177.323 -1.088 1
1 24 . 19 1 1 A 8 8 PRO CA C 8 62.995 62.657 0.338 1
1 25 . 19 1 1 A 8 8 PRO CB C 8 33.266 32.255 1.011 1
1 28 . 19 1 1 A 9 9 GLY H H 9 8.585 8.450 0.135 1
1 29 . 19 1 1 A 9 9 GLY HA2 H 9 4.326 4.083 0.243 1
1 30 . 19 1 1 A 9 9 GLY HA3 H 9 4.009 4.087 -0.078 1
1 31 . 19 1 1 A 9 9 GLY C C 9 172.998 172.982 0.016 1
1 32 . 19 1 1 A 9 9 GLY CA C 9 44.393 44.359 0.034 1
1 33 . 19 1 1 A 9 9 GLY N N 9 106.004 107.706 -1.702 1
1 34 . 19 1 1 A 10 10 ARG H H 10 8.548 8.310 0.238 1
1 35 . 19 1 1 A 10 10 ARG HA H 10 4.654 4.946 -0.292 1
1 41 . 19 1 1 A 10 10 ARG C C 10 175.780 174.771 1.009 1
1 42 . 19 1 1 A 10 10 ARG CA C 10 54.708 54.454 0.254 1
1 43 . 19 1 1 A 10 10 ARG CB C 10 31.448 31.554 -0.106 1
1 45 . 19 1 1 A 10 10 ARG N N 10 119.407 118.570 0.837 1
1 46 . 19 1 1 A 11 11 PRO HA H 11 4.611 4.583 0.028 1
1 53 . 19 1 1 A 11 11 PRO C C 11 173.510 175.550 -2.040 1
1 54 . 19 1 1 A 11 11 PRO CA C 11 62.360 62.637 -0.277 1
1 55 . 19 1 1 A 11 11 PRO CB C 11 33.402 32.239 1.163 1
1 58 . 19 1 1 A 12 12 THR H H 12 7.572 7.961 -0.389 1
1 59 . 19 1 1 A 12 12 THR HA H 12 3.796 4.355 -0.559 1
1 64 . 19 1 1 A 12 12 THR C C 12 172.337 173.385 -1.048 1
1 65 . 19 1 1 A 12 12 THR CA C 12 61.778 61.626 0.152 1
1 66 . 19 1 1 A 12 12 THR CB C 12 70.561 68.722 1.839 1
1 68 . 19 1 1 A 12 12 THR N N 12 109.653 117.257 -7.604 1
1 69 . 19 1 1 A 13 13 MET H H 13 5.605 8.646 -3.041 1
1 70 . 19 1 1 A 13 13 MET HA H 13 5.091 4.986 0.105 1
1 78 . 19 1 1 A 13 13 MET C C 13 172.639 174.968 -2.329 1
1 79 . 19 1 1 A 13 13 MET CA C 13 54.168 53.693 0.475 1
1 80 . 19 1 1 A 13 13 MET CB C 13 37.632 34.545 3.087 1
1 83 . 19 1 1 A 13 13 MET N N 13 121.634 126.955 -5.321 1
1 84 . 19 1 1 A 14 14 MET H H 14 9.254 9.200 0.054 1
1 85 . 19 1 1 A 14 14 MET HA H 14 4.662 5.165 -0.503 1
1 93 . 19 1 1 A 14 14 MET C C 14 174.388 174.785 -0.397 1
1 94 . 19 1 1 A 14 14 MET CA C 14 54.673 54.300 0.373 1
1 95 . 19 1 1 A 14 14 MET CB C 14 34.907 35.173 -0.266 1
1 98 . 19 1 1 A 14 14 MET N N 14 125.746 123.846 1.900 1
1 99 . 19 1 1 A 15 15 ILE H H 15 8.555 9.095 -0.540 1
1 100 . 19 1 1 A 15 15 ILE HA H 15 4.882 4.891 -0.009 1
1 110 . 19 1 1 A 15 15 ILE C C 15 174.962 175.107 -0.145 1
1 111 . 19 1 1 A 15 15 ILE CA C 15 60.685 60.709 -0.024 1
1 112 . 19 1 1 A 15 15 ILE CB C 15 40.878 38.940 1.938 1
1 116 . 19 1 1 A 15 15 ILE N N 15 121.623 126.065 -4.442 1
1 117 . 19 1 1 A 16 16 SER H H 16 8.703 8.961 -0.258 1
1 118 . 19 1 1 A 16 16 SER HA H 16 4.922 5.073 -0.151 1
1 121 . 19 1 1 A 16 16 SER C C 16 173.860 172.918 0.942 1
1 122 . 19 1 1 A 16 16 SER CA C 16 56.524 57.316 -0.792 1
1 123 . 19 1 1 A 16 16 SER CB C 16 65.004 66.104 -1.100 1
1 124 . 19 1 1 A 16 16 SER N N 16 122.261 124.045 -1.784 1
1 125 . 19 1 1 A 17 17 THR H H 17 8.759 8.632 0.127 1
1 126 . 19 1 1 A 17 17 THR HA H 17 4.885 5.089 -0.204 1
1 131 . 19 1 1 A 17 17 THR C C 17 175.018 174.011 1.007 1
1 132 . 19 1 1 A 17 17 THR CA C 17 60.315 60.348 -0.033 1
1 133 . 19 1 1 A 17 17 THR CB C 17 69.799 70.334 -0.535 1
1 135 . 19 1 1 A 17 17 THR N N 17 115.660 114.493 1.167 1
1 136 . 19 1 1 A 18 18 THR H H 18 8.038 8.756 -0.718 1
1 137 . 19 1 1 A 18 18 THR HA H 18 4.596 4.444 0.152 1
1 142 . 19 1 1 A 18 18 THR CA C 18 60.707 63.720 -3.013 1
1 143 . 19 1 1 A 18 18 THR CB C 18 71.082 71.321 -0.239 1
1 145 . 19 1 1 A 18 18 THR N N 18 112.362 118.424 -6.062 1
1 146 . 19 1 1 A 19 19 ALA H H 19 8.545 7.720 0.825 1
1 147 . 19 1 1 A 19 19 ALA HA H 19 4.412 4.371 0.041 1
1 151 . 19 1 1 A 19 19 ALA C C 19 177.034 177.028 0.006 1
1 152 . 19 1 1 A 19 19 ALA CA C 19 52.264 51.656 0.608 1
1 153 . 19 1 1 A 19 19 ALA CB C 19 19.292 20.850 -1.558 1
1 154 . 19 1 1 A 19 19 ALA N N 19 119.589 123.015 -3.426 1
1 155 . 19 1 1 A 20 20 MET H H 20 8.145 8.490 -0.345 1
1 156 . 19 1 1 A 20 20 MET HA H 20 4.447 4.424 0.023 1
1 164 . 19 1 1 A 20 20 MET C C 20 175.676 176.474 -0.798 1
1 165 . 19 1 1 A 20 20 MET CA C 20 55.764 55.510 0.254 1
1 166 . 19 1 1 A 20 20 MET CB C 20 31.495 33.497 -2.002 1
1 169 . 19 1 1 A 20 20 MET N N 20 116.950 119.306 -2.356 1
1 170 . 19 1 1 A 21 21 ASN H H 21 8.275 8.879 -0.604 1
1 171 . 19 1 1 A 21 21 ASN HA H 21 4.452 4.279 0.173 1
1 176 . 19 1 1 A 21 21 ASN C C 21 174.100 173.753 0.347 1
1 177 . 19 1 1 A 21 21 ASN CA C 21 54.320 54.346 -0.026 1
1 178 . 19 1 1 A 21 21 ASN CB C 21 37.234 37.214 0.020 1
1 179 . 19 1 1 A 21 21 ASN N N 21 113.198 119.480 -6.282 1
1 181 . 19 1 1 A 22 22 THR H H 22 7.071 7.414 -0.343 1
1 182 . 19 1 1 A 22 22 THR HA H 22 5.218 5.365 -0.147 1
1 187 . 19 1 1 A 22 22 THR C C 22 173.301 172.592 0.709 1
1 188 . 19 1 1 A 22 22 THR CA C 22 59.399 60.416 -1.017 1
1 189 . 19 1 1 A 22 22 THR CB C 22 72.714 71.538 1.176 1
1 191 . 19 1 1 A 22 22 THR N N 22 107.603 107.766 -0.163 1
1 192 . 19 1 1 A 23 23 ALA H H 23 8.687 8.624 0.063 1
1 193 . 19 1 1 A 23 23 ALA HA H 23 4.925 4.855 0.070 1
1 197 . 19 1 1 A 23 23 ALA C C 23 174.100 175.911 -1.811 1
1 198 . 19 1 1 A 23 23 ALA CA C 23 50.812 50.171 0.641 1
1 199 . 19 1 1 A 23 23 ALA CB C 23 21.122 20.703 0.419 1
1 200 . 19 1 1 A 23 23 ALA N N 23 121.937 128.368 -6.431 1
1 201 . 19 1 1 A 24 24 LEU H H 24 8.833 9.169 -0.336 1
1 202 . 19 1 1 A 24 24 LEU HA H 24 4.673 4.529 0.144 1
1 212 . 19 1 1 A 24 24 LEU C C 24 175.140 174.622 0.518 1
1 213 . 19 1 1 A 24 24 LEU CA C 24 54.320 54.800 -0.480 1
1 214 . 19 1 1 A 24 24 LEU CB C 24 42.518 42.789 -0.271 1
1 218 . 19 1 1 A 24 24 LEU N N 24 123.721 126.966 -3.245 1
1 219 . 19 1 1 A 25 25 LEU H H 25 9.176 8.982 0.194 1
1 220 . 19 1 1 A 25 25 LEU HA H 25 5.112 4.955 0.157 1
1 230 . 19 1 1 A 25 25 LEU C C 25 176.414 175.761 0.653 1
1 231 . 19 1 1 A 25 25 LEU CA C 25 54.108 53.448 0.660 1
1 232 . 19 1 1 A 25 25 LEU CB C 25 43.230 43.934 -0.704 1
1 236 . 19 1 1 A 25 25 LEU N N 25 128.589 129.084 -0.495 1
1 237 . 19 1 1 A 26 26 GLN H H 26 8.556 8.532 0.024 1
1 238 . 19 1 1 A 26 26 GLN HA H 26 4.737 4.887 -0.150 1
1 245 . 19 1 1 A 26 26 GLN C C 26 174.372 174.352 0.020 1
1 246 . 19 1 1 A 26 26 GLN CA C 26 56.365 54.501 1.864 1
1 247 . 19 1 1 A 26 26 GLN CB C 26 33.320 31.831 1.489 1
1 249 . 19 1 1 A 26 26 GLN N N 26 119.630 123.069 -3.439 1
1 251 . 19 1 1 A 27 27 TRP H H 27 8.080 8.296 -0.216 1
1 252 . 19 1 1 A 27 27 TRP HA H 27 5.441 5.829 -0.388 1
1 261 . 19 1 1 A 27 27 TRP CA C 27 55.957 54.495 1.462 1
1 262 . 19 1 1 A 27 27 TRP CB C 27 32.517 32.263 0.254 1
1 268 . 19 1 1 A 27 27 TRP N N 27 121.276 121.591 -0.315 1
1 270 . 19 1 1 A 28 28 HIS H H 28 8.262 8.586 -0.324 1
1 271 . 19 1 1 A 28 28 HIS HA H 28 4.997 4.994 0.003 1
1 275 . 19 1 1 A 28 28 HIS CA C 28 53.028 53.918 -0.890 1
1 276 . 19 1 1 A 28 28 HIS CB C 28 32.832 32.898 -0.066 1
1 278 . 19 1 1 A 28 28 HIS N N 28 116.245 116.836 -0.591 1
1 279 . 19 1 1 A 29 29 PRO HA H 29 4.984 4.709 0.275 1
1 286 . 19 1 1 A 29 29 PRO CA C 29 61.498 62.086 -0.588 1
1 287 . 19 1 1 A 29 29 PRO CB C 29 30.709 32.224 -1.515 1
1 290 . 19 1 1 A 30 30 PRO HA H 30 4.449 4.669 -0.220 1
1 297 . 19 1 1 A 30 30 PRO C C 30 175.733 176.404 -0.671 1
1 298 . 19 1 1 A 30 30 PRO CA C 30 62.245 62.524 -0.279 1
1 299 . 19 1 1 A 30 30 PRO CB C 30 32.083 33.447 -1.364 1
1 302 . 19 1 1 A 31 31 LYS H H 31 8.403 8.692 -0.289 1
1 303 . 19 1 1 A 31 31 LYS HA H 31 4.084 4.469 -0.385 1
1 312 . 19 1 1 A 31 31 LYS C C 31 177.166 178.106 -0.940 1
1 313 . 19 1 1 A 31 31 LYS CA C 31 57.866 57.104 0.762 1
1 314 . 19 1 1 A 31 31 LYS CB C 31 32.698 34.438 -1.740 1
1 318 . 19 1 1 A 31 31 LYS N N 31 121.693 120.434 1.259 1
1 319 . 19 1 1 A 32 32 GLU H H 32 8.102 7.796 0.306 1
1 320 . 19 1 1 A 32 32 GLU HA H 32 4.365 4.536 -0.171 1
1 325 . 19 1 1 A 32 32 GLU C C 32 174.248 175.418 -1.170 1
1 326 . 19 1 1 A 32 32 GLU CA C 32 55.448 56.074 -0.626 1
1 327 . 19 1 1 A 32 32 GLU CB C 32 29.405 29.846 -0.441 1
1 329 . 19 1 1 A 32 32 GLU N N 32 118.742 116.702 2.040 1
1 330 . 19 1 1 A 33 33 LEU H H 33 8.420 7.555 0.865 1
1 331 . 19 1 1 A 33 33 LEU HA H 33 4.499 4.816 -0.317 1
1 341 . 19 1 1 A 33 33 LEU C C 33 173.036 174.701 -1.665 1
1 342 . 19 1 1 A 33 33 LEU CA C 33 52.863 51.318 1.545 1
1 343 . 19 1 1 A 33 33 LEU CB C 33 42.535 43.691 -1.156 1
1 347 . 19 1 1 A 33 33 LEU N N 33 125.181 122.910 2.271 1
1 348 . 19 1 1 A 34 34 PRO HA H 34 4.488 4.448 0.040 1
1 355 . 19 1 1 A 34 34 PRO C C 34 177.544 176.993 0.551 1
1 356 . 19 1 1 A 34 34 PRO CA C 34 62.889 63.277 -0.388 1
1 357 . 19 1 1 A 34 34 PRO CB C 34 31.472 30.905 0.567 1
1 360 . 19 1 1 A 35 35 GLY H H 35 8.397 8.460 -0.063 1
1 361 . 19 1 1 A 35 35 GLY HA2 H 35 4.059 4.118 -0.059 1
1 362 . 19 1 1 A 35 35 GLY HA3 H 35 3.716 4.118 -0.402 1
1 363 . 19 1 1 A 35 35 GLY C C 35 173.356 172.181 1.175 1
1 364 . 19 1 1 A 35 35 GLY CA C 35 45.892 44.884 1.008 1
1 365 . 19 1 1 A 35 35 GLY N N 35 110.524 112.258 -1.734 1
1 366 . 19 1 1 A 36 36 GLU H H 36 8.091 8.539 -0.448 1
1 367 . 19 1 1 A 36 36 GLU HA H 36 4.371 5.104 -0.733 1
1 372 . 19 1 1 A 36 36 GLU C C 36 174.864 174.702 0.162 1
1 373 . 19 1 1 A 36 36 GLU CA C 36 55.201 54.759 0.442 1
1 374 . 19 1 1 A 36 36 GLU CB C 36 31.878 33.231 -1.353 1
1 376 . 19 1 1 A 36 36 GLU N N 36 122.202 120.315 1.887 1
1 377 . 19 1 1 A 37 37 LEU H H 37 8.307 8.714 -0.407 1
1 378 . 19 1 1 A 37 37 LEU HA H 37 4.288 4.279 0.009 1
1 388 . 19 1 1 A 37 37 LEU C C 37 176.702 176.032 0.670 1
1 389 . 19 1 1 A 37 37 LEU CA C 37 55.342 56.669 -1.327 1
1 390 . 19 1 1 A 37 37 LEU CB C 37 42.715 42.138 0.577 1
1 394 . 19 1 1 A 37 37 LEU N N 37 123.204 125.680 -2.476 1
1 395 . 19 1 1 A 38 38 LEU H H 38 8.909 8.658 0.251 1
1 396 . 19 1 1 A 38 38 LEU HA H 38 4.640 4.708 -0.068 1
1 406 . 19 1 1 A 38 38 LEU C C 38 177.202 176.734 0.468 1
1 407 . 19 1 1 A 38 38 LEU CA C 38 54.390 54.934 -0.544 1
1 408 . 19 1 1 A 38 38 LEU CB C 38 43.770 43.497 0.273 1
1 412 . 19 1 1 A 38 38 LEU N N 38 123.021 126.902 -3.881 1
1 413 . 19 1 1 A 39 39 GLY H H 39 7.113 6.973 0.140 1
1 414 . 19 1 1 A 39 39 GLY HA2 H 39 4.816 3.567 1.249 1
1 415 . 19 1 1 A 39 39 GLY HA3 H 39 3.276 3.916 -0.640 1
1 416 . 19 1 1 A 39 39 GLY C C 39 169.863 170.350 -0.487 1
1 417 . 19 1 1 A 39 39 GLY CA C 39 44.622 45.401 -0.779 1
1 418 . 19 1 1 A 39 39 GLY N N 39 104.137 104.250 -0.113 1
1 419 . 19 1 1 A 40 40 TYR H H 40 8.318 8.991 -0.673 1
1 420 . 19 1 1 A 40 40 TYR HA H 40 5.414 5.141 0.273 1
1 425 . 19 1 1 A 40 40 TYR C C 40 174.448 172.183 2.265 1
1 426 . 19 1 1 A 40 40 TYR CA C 40 56.178 56.550 -0.372 1
1 427 . 19 1 1 A 40 40 TYR CB C 40 44.191 40.675 3.516 1
1 430 . 19 1 1 A 40 40 TYR N N 40 114.036 115.414 -1.378 1
1 431 . 19 1 1 A 41 41 ARG H H 41 9.347 8.809 0.538 1
1 432 . 19 1 1 A 41 41 ARG HA H 41 5.092 5.402 -0.310 1
1 440 . 19 1 1 A 41 41 ARG C C 41 174.097 174.137 -0.040 1
1 441 . 19 1 1 A 41 41 ARG CA C 41 56.100 54.289 1.811 1
1 442 . 19 1 1 A 41 41 ARG CB C 41 34.508 32.819 1.689 1
1 445 . 19 1 1 A 41 41 ARG N N 41 122.231 121.141 1.090 1
1 447 . 19 1 1 A 42 42 LEU H H 42 9.546 9.200 0.346 1
1 448 . 19 1 1 A 42 42 LEU HA H 42 5.459 5.262 0.197 1
1 458 . 19 1 1 A 42 42 LEU C C 42 174.913 174.600 0.313 1
1 459 . 19 1 1 A 42 42 LEU CA C 42 52.997 53.376 -0.379 1
1 460 . 19 1 1 A 42 42 LEU CB C 42 46.413 45.638 0.775 1
1 464 . 19 1 1 A 42 42 LEU N N 42 132.335 127.675 4.660 1
1 465 . 19 1 1 A 43 43 GLN H H 43 9.502 9.229 0.273 1
1 466 . 19 1 1 A 43 43 GLN HA H 43 5.847 5.288 0.559 1
1 473 . 19 1 1 A 43 43 GLN C C 43 175.329 173.799 1.530 1
1 474 . 19 1 1 A 43 43 GLN CA C 43 54.005 54.505 -0.500 1
1 475 . 19 1 1 A 43 43 GLN CB C 43 33.429 31.463 1.966 1
1 477 . 19 1 1 A 43 43 GLN N N 43 123.932 125.258 -1.326 1
1 479 . 19 1 1 A 44 44 TYR H H 44 8.615 8.491 0.124 1
1 480 . 19 1 1 A 44 44 TYR HA H 44 5.783 5.864 -0.081 1
1 487 . 19 1 1 A 44 44 TYR C C 44 174.058 173.582 0.476 1
1 488 . 19 1 1 A 44 44 TYR CA C 44 55.942 55.550 0.392 1
1 489 . 19 1 1 A 44 44 TYR CB C 44 43.052 41.752 1.300 1
1 494 . 19 1 1 A 44 44 TYR N N 44 117.355 119.907 -2.552 1
1 495 . 19 1 1 A 45 45 CYS H H 45 8.377 8.426 -0.049 1
1 496 . 19 1 1 A 45 45 CYS HA H 45 4.772 5.106 -0.334 1
1 499 . 19 1 1 A 45 45 CYS C C 45 173.205 173.673 -0.468 1
1 500 . 19 1 1 A 45 45 CYS CA C 45 55.960 57.016 -1.056 1
1 501 . 19 1 1 A 45 45 CYS CB C 45 30.665 31.192 -0.527 1
1 502 . 19 1 1 A 45 45 CYS N N 45 115.140 118.937 -3.797 1
1 503 . 19 1 1 A 46 46 ARG H H 46 9.165 8.532 0.633 1
1 504 . 19 1 1 A 46 46 ARG HA H 46 4.068 3.779 0.289 1
1 511 . 19 1 1 A 46 46 ARG C C 46 178.440 177.564 0.876 1
1 512 . 19 1 1 A 46 46 ARG CA C 46 56.401 55.816 0.585 1
1 513 . 19 1 1 A 46 46 ARG CB C 46 31.878 30.679 1.199 1
1 516 . 19 1 1 A 46 46 ARG N N 46 121.803 121.194 0.609 1
1 517 . 19 1 1 A 47 47 ALA H H 47 8.273 8.446 -0.173 1
1 518 . 19 1 1 A 47 47 ALA HA H 47 3.891 4.075 -0.184 1
1 522 . 19 1 1 A 47 47 ALA C C 47 177.599 177.259 0.340 1
1 523 . 19 1 1 A 47 47 ALA CA C 47 54.796 53.584 1.212 1
1 524 . 19 1 1 A 47 47 ALA CB C 47 18.287 18.547 -0.260 1
1 525 . 19 1 1 A 47 47 ALA N N 47 123.895 123.906 -0.011 1
1 526 . 19 1 1 A 48 48 ASP H H 48 8.036 8.054 -0.018 1
1 527 . 19 1 1 A 48 48 ASP HA H 48 4.453 4.793 -0.340 1
1 530 . 19 1 1 A 48 48 ASP C C 48 175.836 175.797 0.039 1
1 531 . 19 1 1 A 48 48 ASP CA C 48 53.368 52.828 0.540 1
1 532 . 19 1 1 A 48 48 ASP CB C 48 39.964 41.259 -1.295 1
1 533 . 19 1 1 A 48 48 ASP N N 48 112.576 117.584 -5.008 1
1 534 . 19 1 1 A 49 49 GLU H H 49 7.495 7.405 0.090 1
1 535 . 19 1 1 A 49 49 GLU HA H 49 4.308 4.418 -0.110 1
1 540 . 19 1 1 A 49 49 GLU C C 49 175.756 175.698 0.058 1
1 541 . 19 1 1 A 49 49 GLU CA C 49 56.224 55.225 0.999 1
1 542 . 19 1 1 A 49 49 GLU CB C 49 32.248 30.370 1.878 1
1 544 . 19 1 1 A 49 49 GLU N N 49 120.609 119.606 1.003 1
1 545 . 19 1 1 A 50 50 ALA H H 50 8.416 8.756 -0.340 1
1 546 . 19 1 1 A 50 50 ALA HA H 50 4.200 4.434 -0.234 1
1 550 . 19 1 1 A 50 50 ALA C C 50 177.433 177.438 -0.005 1
1 551 . 19 1 1 A 50 50 ALA CA C 50 53.297 53.091 0.206 1
1 552 . 19 1 1 A 50 50 ALA CB C 50 19.474 20.973 -1.499 1
1 553 . 19 1 1 A 50 50 ALA N N 50 124.065 123.334 0.731 1
1 554 . 19 1 1 A 51 51 ARG H H 51 7.648 7.594 0.054 1
1 555 . 19 1 1 A 51 51 ARG HA H 51 4.747 4.895 -0.148 1
1 562 . 19 1 1 A 51 51 ARG C C 51 173.400 173.829 -0.429 1
1 563 . 19 1 1 A 51 51 ARG CA C 51 52.592 52.850 -0.258 1
1 564 . 19 1 1 A 51 51 ARG CB C 51 31.212 33.451 -2.239 1
1 567 . 19 1 1 A 51 51 ARG N N 51 117.798 117.065 0.733 1
1 568 . 19 1 1 A 52 52 PRO HA H 52 4.212 4.439 -0.227 1
1 575 . 19 1 1 A 52 52 PRO C C 52 176.380 176.642 -0.262 1
1 576 . 19 1 1 A 52 52 PRO CA C 52 62.360 62.549 -0.189 1
1 577 . 19 1 1 A 52 52 PRO CB C 52 32.331 32.108 0.223 1
1 580 . 19 1 1 A 53 53 ASN H H 53 8.127 8.212 -0.085 1
1 581 . 19 1 1 A 53 53 ASN HA H 53 4.651 4.725 -0.074 1
1 586 . 19 1 1 A 53 53 ASN C C 53 174.354 174.581 -0.227 1
1 587 . 19 1 1 A 53 53 ASN CA C 53 53.136 52.681 0.455 1
1 588 . 19 1 1 A 53 53 ASN CB C 53 39.666 37.891 1.775 1
1 589 . 19 1 1 A 53 53 ASN N N 53 119.405 119.793 -0.388 1
1 591 . 19 1 1 A 54 54 THR H H 54 8.425 8.557 -0.132 1
1 592 . 19 1 1 A 54 54 THR HA H 54 5.306 4.529 0.777 1
1 597 . 19 1 1 A 54 54 THR C C 54 173.850 174.032 -0.182 1
1 598 . 19 1 1 A 54 54 THR CA C 54 61.881 63.003 -1.122 1
1 599 . 19 1 1 A 54 54 THR CB C 54 70.573 69.772 0.801 1
1 601 . 19 1 1 A 54 54 THR N N 54 118.968 121.749 -2.781 1
1 602 . 19 1 1 A 55 55 ILE H H 55 9.354 8.453 0.901 1
1 603 . 19 1 1 A 55 55 ILE HA H 55 4.051 4.483 -0.432 1
1 613 . 19 1 1 A 55 55 ILE C C 55 172.975 173.452 -0.477 1
1 614 . 19 1 1 A 55 55 ILE CA C 55 61.003 59.852 1.151 1
1 615 . 19 1 1 A 55 55 ILE CB C 55 41.619 42.022 -0.403 1
1 619 . 19 1 1 A 55 55 ILE N N 55 127.961 125.153 2.808 1
1 620 . 19 1 1 A 56 56 ASP H H 56 8.132 8.750 -0.618 1
1 621 . 19 1 1 A 56 56 ASP HA H 56 5.334 5.213 0.121 1
1 624 . 19 1 1 A 56 56 ASP C C 56 174.969 174.759 0.210 1
1 625 . 19 1 1 A 56 56 ASP CA C 56 53.702 52.772 0.930 1
1 626 . 19 1 1 A 56 56 ASP CB C 56 43.251 42.923 0.328 1
1 627 . 19 1 1 A 56 56 ASP N N 56 125.882 127.224 -1.342 1
1 628 . 19 1 1 A 57 57 PHE H H 57 8.955 8.804 0.151 1
1 629 . 19 1 1 A 57 57 PHE HA H 57 4.915 5.029 -0.114 1
1 637 . 19 1 1 A 57 57 PHE C C 57 177.361 175.539 1.822 1
1 638 . 19 1 1 A 57 57 PHE CA C 57 57.458 56.483 0.975 1
1 639 . 19 1 1 A 57 57 PHE CB C 57 43.737 43.642 0.095 1
1 645 . 19 1 1 A 57 57 PHE N N 57 118.872 123.060 -4.188 1
1 646 . 19 1 1 A 58 58 GLY H H 58 9.552 8.722 0.830 1
1 647 . 19 1 1 A 58 58 GLY HA2 H 58 4.662 4.087 0.575 1
1 648 . 19 1 1 A 58 58 GLY HA3 H 58 4.126 4.170 -0.044 1
1 649 . 19 1 1 A 58 58 GLY C C 58 174.760 174.864 -0.104 1
1 650 . 19 1 1 A 58 58 GLY CA C 58 44.680 44.874 -0.194 1
1 651 . 19 1 1 A 58 58 GLY N N 58 111.551 109.634 1.917 1
1 652 . 19 1 1 A 59 59 LYS H H 59 8.211 8.662 -0.451 1
1 653 . 19 1 1 A 59 59 LYS HA H 59 3.782 3.671 0.111 1
1 662 . 19 1 1 A 59 59 LYS C C 59 176.154 178.305 -2.151 1
1 663 . 19 1 1 A 59 59 LYS CA C 59 59.080 58.745 0.335 1
1 664 . 19 1 1 A 59 59 LYS CB C 59 32.516 31.810 0.706 1
1 668 . 19 1 1 A 59 59 LYS N N 59 115.953 119.881 -3.928 1
1 669 . 19 1 1 A 60 60 ASP H H 60 8.634 8.110 0.524 1
1 670 . 19 1 1 A 60 60 ASP HA H 60 4.882 4.389 0.493 1
1 673 . 19 1 1 A 60 60 ASP C C 60 176.039 176.201 -0.162 1
1 674 . 19 1 1 A 60 60 ASP CA C 60 54.327 57.418 -3.091 1
1 675 . 19 1 1 A 60 60 ASP CB C 60 41.461 41.336 0.125 1
1 676 . 19 1 1 A 60 60 ASP N N 60 117.261 120.276 -3.015 1
1 677 . 19 1 1 A 61 61 ASP H H 61 7.500 8.069 -0.569 1
1 678 . 19 1 1 A 61 61 ASP HA H 61 4.591 4.727 -0.136 1
1 681 . 19 1 1 A 61 61 ASP C C 61 175.140 175.863 -0.723 1
1 682 . 19 1 1 A 61 61 ASP CA C 61 55.342 53.930 1.412 1
1 683 . 19 1 1 A 61 61 ASP CB C 61 42.475 40.049 2.426 1
1 684 . 19 1 1 A 61 61 ASP N N 61 122.319 118.789 3.530 1
1 685 . 19 1 1 A 62 62 GLN H H 62 8.239 7.986 0.253 1
1 686 . 19 1 1 A 62 62 GLN HA H 62 2.569 3.651 -1.082 1
1 693 . 19 1 1 A 62 62 GLN C C 62 172.652 173.834 -1.182 1
1 694 . 19 1 1 A 62 62 GLN CA C 62 54.038 55.470 -1.432 1
1 695 . 19 1 1 A 62 62 GLN CB C 62 31.481 29.318 2.163 1
1 697 . 19 1 1 A 62 62 GLN N N 62 117.458 123.232 -5.774 1
1 699 . 19 1 1 A 63 63 HIS H H 63 6.338 6.810 -0.472 1
1 700 . 19 1 1 A 63 63 HIS HA H 63 4.423 4.433 -0.010 1
1 704 . 19 1 1 A 63 63 HIS C C 63 173.031 172.590 0.441 1
1 705 . 19 1 1 A 63 63 HIS CA C 63 54.743 53.953 0.790 1
1 706 . 19 1 1 A 63 63 HIS CB C 63 32.661 32.009 0.652 1
1 708 . 19 1 1 A 63 63 HIS N N 63 113.589 115.803 -2.214 1
1 709 . 19 1 1 A 64 64 PHE H H 64 8.549 8.840 -0.291 1
1 710 . 19 1 1 A 64 64 PHE HA H 64 4.578 5.243 -0.665 1
1 718 . 19 1 1 A 64 64 PHE C C 64 173.015 173.883 -0.868 1
1 719 . 19 1 1 A 64 64 PHE CA C 64 58.516 56.536 1.980 1
1 720 . 19 1 1 A 64 64 PHE CB C 64 43.525 42.825 0.700 1
1 726 . 19 1 1 A 64 64 PHE N N 64 118.214 120.503 -2.289 1
1 727 . 19 1 1 A 65 65 THR H H 65 7.150 8.473 -1.323 1
1 728 . 19 1 1 A 65 65 THR HA H 65 4.930 4.524 0.406 1
1 733 . 19 1 1 A 65 65 THR C C 65 172.457 173.783 -1.326 1
1 734 . 19 1 1 A 65 65 THR CA C 65 61.690 62.181 -0.491 1
1 735 . 19 1 1 A 65 65 THR CB C 65 69.593 68.872 0.721 1
1 737 . 19 1 1 A 65 65 THR N N 65 123.198 122.108 1.090 1
1 738 . 19 1 1 A 66 66 VAL H H 66 8.888 8.467 0.421 1
1 739 . 19 1 1 A 66 66 VAL HA H 66 4.018 4.685 -0.667 1
1 747 . 19 1 1 A 66 66 VAL C C 66 174.868 175.467 -0.599 1
1 748 . 19 1 1 A 66 66 VAL CA C 66 61.178 60.697 0.481 1
1 749 . 19 1 1 A 66 66 VAL CB C 66 33.114 33.065 0.049 1
1 752 . 19 1 1 A 66 66 VAL N N 66 126.840 128.146 -1.306 1
1 753 . 19 1 1 A 67 67 THR H H 67 8.174 8.474 -0.300 1
1 754 . 19 1 1 A 67 67 THR HA H 67 4.816 5.018 -0.202 1
1 759 . 19 1 1 A 67 67 THR C C 67 174.494 174.274 0.220 1
1 760 . 19 1 1 A 67 67 THR CA C 67 59.786 59.569 0.217 1
1 761 . 19 1 1 A 67 67 THR CB C 67 70.887 71.714 -0.827 1
1 763 . 19 1 1 A 67 67 THR N N 67 116.127 117.168 -1.041 1
1 764 . 19 1 1 A 68 68 GLY H H 68 8.570 8.547 0.023 1
1 765 . 19 1 1 A 68 68 GLY HA2 H 68 3.970 3.984 -0.014 1
1 766 . 19 1 1 A 68 68 GLY HA3 H 68 3.819 3.993 -0.174 1
1 767 . 19 1 1 A 68 68 GLY C C 68 175.636 175.149 0.487 1
1 768 . 19 1 1 A 68 68 GLY CA C 68 46.397 45.619 0.778 1
1 769 . 19 1 1 A 68 68 GLY N N 68 107.146 113.243 -6.097 1
1 770 . 19 1 1 A 69 69 LEU H H 69 8.007 8.048 -0.041 1
1 771 . 19 1 1 A 69 69 LEU HA H 69 4.154 4.350 -0.196 1
1 781 . 19 1 1 A 69 69 LEU C C 69 176.830 176.362 0.468 1
1 782 . 19 1 1 A 69 69 LEU CA C 69 54.602 54.256 0.346 1
1 783 . 19 1 1 A 69 69 LEU CB C 69 41.149 41.936 -0.787 1
1 787 . 19 1 1 A 69 69 LEU N N 69 118.433 122.499 -4.066 1
1 788 . 19 1 1 A 70 70 HIS H H 70 8.866 8.955 -0.089 1
1 789 . 19 1 1 A 70 70 HIS HA H 70 4.663 4.733 -0.070 1
1 793 . 19 1 1 A 70 70 HIS C C 70 176.667 175.413 1.254 1
1 794 . 19 1 1 A 70 70 HIS CA C 70 55.464 56.845 -1.381 1
1 795 . 19 1 1 A 70 70 HIS CB C 70 32.125 30.329 1.796 1
1 797 . 19 1 1 A 70 70 HIS N N 70 122.457 122.452 0.005 1
1 798 . 19 1 1 A 71 71 LYS H H 71 8.716 8.773 -0.057 1
1 799 . 19 1 1 A 71 71 LYS HA H 71 4.320 4.346 -0.026 1
1 808 . 19 1 1 A 71 71 LYS C C 71 178.110 177.683 0.427 1
1 809 . 19 1 1 A 71 71 LYS CA C 71 57.035 57.849 -0.814 1
1 810 . 19 1 1 A 71 71 LYS CB C 71 33.580 33.070 0.510 1
1 814 . 19 1 1 A 71 71 LYS N N 71 123.173 123.390 -0.217 1
1 815 . 19 1 1 A 72 72 GLY H H 72 7.709 8.794 -1.085 1
1 816 . 19 1 1 A 72 72 GLY HA2 H 72 3.800 3.915 -0.115 1
1 817 . 19 1 1 A 72 72 GLY HA3 H 72 3.769 3.920 -0.151 1
1 818 . 19 1 1 A 72 72 GLY C C 72 174.231 173.913 0.318 1
1 819 . 19 1 1 A 72 72 GLY CA C 72 47.866 46.456 1.410 1
1 820 . 19 1 1 A 72 72 GLY N N 72 114.881 111.789 3.092 1
1 821 . 19 1 1 A 73 73 THR H H 73 8.162 7.540 0.622 1
1 822 . 19 1 1 A 73 73 THR HA H 73 4.584 4.783 -0.199 1
1 827 . 19 1 1 A 73 73 THR C C 73 172.208 173.363 -1.155 1
1 828 . 19 1 1 A 73 73 THR CA C 73 62.307 61.314 0.993 1
1 829 . 19 1 1 A 73 73 THR CB C 73 72.123 71.807 0.316 1
1 831 . 19 1 1 A 73 73 THR N N 73 114.225 114.353 -0.128 1
1 832 . 19 1 1 A 74 74 THR H H 74 8.743 8.810 -0.067 1
1 833 . 19 1 1 A 74 74 THR HA H 74 5.138 5.139 -0.001 1
1 838 . 19 1 1 A 74 74 THR C C 74 173.376 173.353 0.023 1
1 839 . 19 1 1 A 74 74 THR CA C 74 62.724 62.566 0.158 1
1 840 . 19 1 1 A 74 74 THR CB C 74 69.202 70.447 -1.245 1
1 842 . 19 1 1 A 74 74 THR N N 74 123.376 121.031 2.345 1
1 843 . 19 1 1 A 75 75 TYR H H 75 9.549 9.216 0.333 1
1 844 . 19 1 1 A 75 75 TYR HA H 75 4.892 5.250 -0.358 1
1 851 . 19 1 1 A 75 75 TYR C C 75 173.991 175.242 -1.251 1
1 852 . 19 1 1 A 75 75 TYR CA C 75 57.740 56.056 1.684 1
1 853 . 19 1 1 A 75 75 TYR CB C 75 44.580 43.335 1.245 1
1 858 . 19 1 1 A 75 75 TYR N N 75 126.916 124.136 2.780 1
1 859 . 19 1 1 A 76 76 ILE H H 76 8.769 9.185 -0.416 1
1 860 . 19 1 1 A 76 76 ILE HA H 76 4.663 4.974 -0.311 1
1 870 . 19 1 1 A 76 76 ILE C C 76 174.683 175.229 -0.546 1
1 871 . 19 1 1 A 76 76 ILE CA C 76 60.455 60.577 -0.122 1
1 872 . 19 1 1 A 76 76 ILE CB C 76 40.284 39.951 0.333 1
1 876 . 19 1 1 A 76 76 ILE N N 76 119.407 120.823 -1.416 1
1 877 . 19 1 1 A 77 77 PHE H H 77 8.894 9.028 -0.134 1
1 878 . 19 1 1 A 77 77 PHE HA H 77 5.160 5.171 -0.011 1
1 886 . 19 1 1 A 77 77 PHE C C 77 174.794 175.394 -0.600 1
1 887 . 19 1 1 A 77 77 PHE CA C 77 56.831 57.413 -0.582 1
1 888 . 19 1 1 A 77 77 PHE CB C 77 43.132 41.507 1.625 1
1 894 . 19 1 1 A 77 77 PHE N N 77 124.622 126.775 -2.153 1
1 895 . 19 1 1 A 78 78 ARG H H 78 9.407 9.147 0.260 1
1 896 . 19 1 1 A 78 78 ARG HA H 78 5.689 5.753 -0.064 1
1 904 . 19 1 1 A 78 78 ARG C C 78 174.376 174.737 -0.361 1
1 905 . 19 1 1 A 78 78 ARG CA C 78 54.530 54.639 -0.109 1
1 906 . 19 1 1 A 78 78 ARG CB C 78 34.473 34.002 0.471 1
1 909 . 19 1 1 A 78 78 ARG N N 78 120.055 121.120 -1.065 1
1 911 . 19 1 1 A 79 79 LEU H H 79 9.132 8.527 0.605 1
1 912 . 19 1 1 A 79 79 LEU HA H 79 5.398 5.016 0.382 1
1 922 . 19 1 1 A 79 79 LEU C C 79 174.006 174.245 -0.239 1
1 923 . 19 1 1 A 79 79 LEU CA C 79 53.401 53.355 0.046 1
1 924 . 19 1 1 A 79 79 LEU CB C 79 48.116 46.475 1.641 1
1 928 . 19 1 1 A 79 79 LEU N N 79 124.907 123.967 0.940 1
1 929 . 19 1 1 A 80 80 ALA H H 80 8.737 8.012 0.725 1
1 930 . 19 1 1 A 80 80 ALA HA H 80 4.871 5.003 -0.132 1
1 934 . 19 1 1 A 80 80 ALA C C 80 176.057 175.795 0.262 1
1 935 . 19 1 1 A 80 80 ALA CA C 80 50.353 51.221 -0.868 1
1 936 . 19 1 1 A 80 80 ALA CB C 80 23.972 23.566 0.406 1
1 937 . 19 1 1 A 80 80 ALA N N 80 128.220 125.541 2.679 1
1 938 . 19 1 1 A 81 81 ALA H H 81 9.890 8.614 1.276 1
1 939 . 19 1 1 A 81 81 ALA HA H 81 4.794 5.003 -0.209 1
1 943 . 19 1 1 A 81 81 ALA C C 81 174.655 176.344 -1.689 1
1 944 . 19 1 1 A 81 81 ALA CA C 81 50.300 51.149 -0.849 1
1 945 . 19 1 1 A 81 81 ALA CB C 81 21.369 20.656 0.713 1
1 946 . 19 1 1 A 81 81 ALA N N 81 123.682 123.311 0.371 1
1 947 . 19 1 1 A 82 82 LYS H H 82 7.965 8.572 -0.607 1
1 948 . 19 1 1 A 82 82 LYS HA H 82 4.974 5.333 -0.359 1
1 957 . 19 1 1 A 82 82 LYS C C 82 175.671 175.092 0.579 1
1 958 . 19 1 1 A 82 82 LYS CA C 82 54.664 54.825 -0.161 1
1 959 . 19 1 1 A 82 82 LYS CB C 82 36.677 35.652 1.025 1
1 963 . 19 1 1 A 82 82 LYS N N 82 118.164 122.353 -4.189 1
1 964 . 19 1 1 A 83 83 ASN H H 83 8.663 8.705 -0.042 1
1 965 . 19 1 1 A 83 83 ASN HA H 83 5.113 5.089 0.024 1
1 970 . 19 1 1 A 83 83 ASN C C 83 176.582 176.346 0.236 1
1 971 . 19 1 1 A 83 83 ASN CA C 83 51.746 50.742 1.004 1
1 972 . 19 1 1 A 83 83 ASN CB C 83 40.357 40.128 0.229 1
1 973 . 19 1 1 A 83 83 ASN N N 83 124.784 124.303 0.481 1
1 975 . 19 1 1 A 84 84 ARG H H 84 8.873 8.758 0.115 1
1 976 . 19 1 1 A 84 84 ARG HA H 84 3.940 3.918 0.022 1
1 983 . 19 1 1 A 84 84 ARG C C 84 176.735 178.369 -1.634 1
1 984 . 19 1 1 A 84 84 ARG CA C 84 59.327 59.960 -0.633 1
1 985 . 19 1 1 A 84 84 ARG CB C 84 29.282 29.935 -0.653 1
1 988 . 19 1 1 A 84 84 ARG N N 84 117.891 119.171 -1.280 1
1 989 . 19 1 1 A 85 85 ALA H H 85 7.645 7.889 -0.244 1
1 990 . 19 1 1 A 85 85 ALA HA H 85 4.276 4.165 0.111 1
1 994 . 19 1 1 A 85 85 ALA C C 85 177.479 177.425 0.054 1
1 995 . 19 1 1 A 85 85 ALA CA C 85 52.818 53.158 -0.340 1
1 996 . 19 1 1 A 85 85 ALA CB C 85 18.806 19.669 -0.863 1
1 997 . 19 1 1 A 85 85 ALA N N 85 120.306 120.775 -0.469 1
1 998 . 19 1 1 A 86 86 GLY H H 86 7.693 7.729 -0.036 1
1 999 . 19 1 1 A 86 86 GLY HA2 H 86 4.456 4.100 0.356 1
1 1000 . 19 1 1 A 86 86 GLY HA3 H 86 3.649 4.103 -0.454 1
1 1001 . 19 1 1 A 86 86 GLY C C 86 172.068 172.372 -0.304 1
1 1002 . 19 1 1 A 86 86 GLY CA C 86 44.375 44.231 0.144 1
1 1003 . 19 1 1 A 86 86 GLY N N 86 106.594 103.893 2.701 1
1 1004 . 19 1 1 A 87 87 LEU H H 87 8.203 8.464 -0.261 1
1 1005 . 19 1 1 A 87 87 LEU HA H 87 4.629 4.616 0.013 1
1 1015 . 19 1 1 A 87 87 LEU C C 87 179.155 176.548 2.607 1
1 1016 . 19 1 1 A 87 87 LEU CA C 87 54.814 55.458 -0.644 1
1 1017 . 19 1 1 A 87 87 LEU CB C 87 43.454 42.558 0.896 1
1 1021 . 19 1 1 A 87 87 LEU N N 87 120.879 122.456 -1.577 1
1 1022 . 19 1 1 A 88 88 GLY H H 88 8.492 8.410 0.082 1
1 1023 . 19 1 1 A 88 88 GLY HA2 H 88 4.339 4.175 0.164 1
1 1024 . 19 1 1 A 88 88 GLY HA3 H 88 4.122 4.183 -0.061 1
1 1025 . 19 1 1 A 88 88 GLY C C 88 173.030 173.440 -0.410 1
1 1026 . 19 1 1 A 88 88 GLY CA C 88 43.970 44.645 -0.675 1
1 1027 . 19 1 1 A 88 88 GLY N N 88 109.903 110.371 -0.468 1
1 1028 . 19 1 1 A 89 89 GLU H H 89 7.638 8.970 -1.332 1
1 1029 . 19 1 1 A 89 89 GLU HA H 89 4.103 4.252 -0.149 1
1 1034 . 19 1 1 A 89 89 GLU C C 89 177.511 175.793 1.718 1
1 1035 . 19 1 1 A 89 89 GLU CA C 89 56.659 57.189 -0.530 1
1 1036 . 19 1 1 A 89 89 GLU CB C 89 31.324 30.659 0.665 1
1 1038 . 19 1 1 A 89 89 GLU N N 89 117.551 121.983 -4.432 1
1 1039 . 19 1 1 A 90 90 GLU H H 90 8.734 9.046 -0.312 1
1 1040 . 19 1 1 A 90 90 GLU HA H 90 4.651 5.375 -0.724 1
1 1045 . 19 1 1 A 90 90 GLU C C 90 177.452 174.679 2.773 1
1 1046 . 19 1 1 A 90 90 GLU CA C 90 55.987 54.681 1.306 1
1 1047 . 19 1 1 A 90 90 GLU CB C 90 31.135 33.246 -2.111 1
1 1049 . 19 1 1 A 90 90 GLU N N 90 121.553 118.293 3.260 1
1 1050 . 19 1 1 A 91 91 PHE H H 91 9.411 9.372 0.039 1
1 1051 . 19 1 1 A 91 91 PHE HA H 91 4.665 4.954 -0.289 1
1 1059 . 19 1 1 A 91 91 PHE C C 91 173.944 174.752 -0.808 1
1 1060 . 19 1 1 A 91 91 PHE CA C 91 57.687 58.376 -0.689 1
1 1061 . 19 1 1 A 91 91 PHE CB C 91 40.890 40.615 0.275 1
1 1067 . 19 1 1 A 91 91 PHE N N 91 125.459 125.154 0.305 1
1 1068 . 19 1 1 A 92 92 GLU H H 92 8.043 8.023 0.020 1
1 1069 . 19 1 1 A 92 92 GLU HA H 92 5.424 5.404 0.020 1
1 1074 . 19 1 1 A 92 92 GLU C C 92 174.295 174.480 -0.185 1
1 1075 . 19 1 1 A 92 92 GLU CA C 92 54.378 54.873 -0.495 1
1 1076 . 19 1 1 A 92 92 GLU CB C 92 33.662 33.378 0.284 1
1 1078 . 19 1 1 A 92 92 GLU N N 92 128.905 126.701 2.204 1
1 1079 . 19 1 1 A 93 93 LYS H H 93 9.142 8.758 0.384 1
1 1080 . 19 1 1 A 93 93 LYS HA H 93 4.541 5.103 -0.562 1
1 1089 . 19 1 1 A 93 93 LYS C C 93 173.366 173.891 -0.525 1
1 1090 . 19 1 1 A 93 93 LYS CA C 93 55.343 55.371 -0.028 1
1 1091 . 19 1 1 A 93 93 LYS CB C 93 37.317 36.282 1.035 1
1 1095 . 19 1 1 A 93 93 LYS N N 93 125.231 127.347 -2.116 1
1 1096 . 19 1 1 A 94 94 GLU H H 94 8.655 9.227 -0.572 1
1 1097 . 19 1 1 A 94 94 GLU HA H 94 5.558 5.461 0.097 1
1 1102 . 19 1 1 A 94 94 GLU C C 94 176.238 175.418 0.820 1
1 1103 . 19 1 1 A 94 94 GLU CA C 94 54.632 55.056 -0.424 1
1 1104 . 19 1 1 A 94 94 GLU CB C 94 32.166 33.191 -1.025 1
1 1106 . 19 1 1 A 94 94 GLU N N 94 127.232 125.653 1.579 1
1 1107 . 19 1 1 A 95 95 ILE H H 95 9.302 8.905 0.397 1
1 1108 . 19 1 1 A 95 95 ILE HA H 95 4.794 5.192 -0.398 1
1 1118 . 19 1 1 A 95 95 ILE C C 95 173.138 174.223 -1.085 1
1 1119 . 19 1 1 A 95 95 ILE CA C 95 58.570 58.296 0.274 1
1 1120 . 19 1 1 A 95 95 ILE CB C 95 42.420 42.915 -0.495 1
1 1124 . 19 1 1 A 95 95 ILE N N 95 120.711 121.237 -0.526 1
1 1125 . 19 1 1 A 96 96 ARG H H 96 8.589 8.797 -0.208 1
1 1126 . 19 1 1 A 96 96 ARG HA H 96 5.373 4.905 0.468 1
1 1133 . 19 1 1 A 96 96 ARG C C 96 177.147 175.040 2.107 1
1 1134 . 19 1 1 A 96 96 ARG CA C 96 54.045 55.232 -1.187 1
1 1135 . 19 1 1 A 96 96 ARG CB C 96 32.001 33.875 -1.874 1
1 1138 . 19 1 1 A 96 96 ARG N N 96 124.445 121.980 2.465 1
1 1139 . 19 1 1 A 97 97 THR H H 97 9.243 8.635 0.608 1
1 1140 . 19 1 1 A 97 97 THR HA H 97 4.459 4.520 -0.061 1
1 1145 . 19 1 1 A 97 97 THR C C 97 172.745 173.910 -1.165 1
1 1146 . 19 1 1 A 97 97 THR CA C 97 59.637 60.725 -1.088 1
1 1147 . 19 1 1 A 97 97 THR CB C 97 67.687 68.932 -1.245 1
1 1149 . 19 1 1 A 97 97 THR N N 97 119.370 118.479 0.891 1
1 1150 . 19 1 1 A 98 98 PRO HA H 98 4.494 4.716 -0.222 1
1 1157 . 19 1 1 A 98 98 PRO CA C 98 63.117 62.738 0.379 1
1 1158 . 19 1 1 A 98 98 PRO CB C 98 32.500 31.721 0.779 1
1 1161 . 19 1 1 A 99 99 GLU H H 99 8.534 8.492 0.042 1
1 1162 . 19 1 1 A 99 99 GLU HA H 99 4.195 4.367 -0.172 1
1 1167 . 19 1 1 A 99 99 GLU C C 99 175.881 177.584 -1.703 1
1 1168 . 19 1 1 A 99 99 GLU CA C 99 56.330 56.858 -0.528 1
1 1169 . 19 1 1 A 99 99 GLU CB C 99 31.062 30.729 0.333 1
1 1171 . 19 1 1 A 99 99 GLU N N 99 119.688 122.580 -2.892 1
1 1172 . 19 1 1 A 100 100 ASP H H 100 8.536 8.742 -0.206 1
1 1173 . 19 1 1 A 100 100 ASP HA H 100 4.607 4.505 0.102 1
1 1176 . 19 1 1 A 100 100 ASP C C 100 176.012 176.556 -0.544 1
1 1177 . 19 1 1 A 100 100 ASP CA C 100 54.109 57.022 -2.913 1
1 1178 . 19 1 1 A 100 100 ASP CB C 100 41.562 40.415 1.147 1
1 1179 . 19 1 1 A 100 100 ASP N N 100 119.803 121.544 -1.741 1
1 1180 . 19 1 1 A 101 101 LEU H H 101 8.403 7.671 0.732 1
1 1181 . 19 1 1 A 101 101 LEU HA H 101 4.426 4.560 -0.134 1
1 1191 . 19 1 1 A 101 101 LEU C C 101 177.534 176.482 1.052 1
1 1192 . 19 1 1 A 101 101 LEU CA C 101 55.113 53.191 1.922 1
1 1193 . 19 1 1 A 101 101 LEU CB C 101 42.156 43.410 -1.254 1
1 1197 . 19 1 1 A 101 101 LEU N N 101 123.876 117.812 6.064 1
1 1198 . 19 1 1 A 102 102 SER H H 102 8.413 8.443 -0.030 1
1 1199 . 19 1 1 A 102 102 SER HA H 102 4.434 4.562 -0.128 1
1 1202 . 19 1 1 A 102 102 SER C C 102 174.674 175.076 -0.402 1
1 1203 . 19 1 1 A 102 102 SER CA C 102 58.798 58.655 0.143 1
1 1204 . 19 1 1 A 102 102 SER CB C 102 63.854 64.491 -0.637 1
1 1205 . 19 1 1 A 102 102 SER N N 102 116.667 112.530 4.137 1
1 1206 . 19 1 1 A 103 103 GLY H H 103 8.213 7.854 0.359 1
1 1207 . 19 1 1 A 103 103 GLY HA2 H 103 4.164 3.950 0.214 1
1 1208 . 19 1 1 A 103 103 GLY HA3 H 103 4.057 3.950 0.107 1
1 1209 . 19 1 1 A 103 103 GLY C C 103 171.822 173.178 -1.356 1
1 1210 . 19 1 1 A 103 103 GLY CA C 103 44.658 45.547 -0.889 1
1 1211 . 19 1 1 A 103 103 GLY N N 103 110.592 109.670 0.922 1
1 1212 . 19 1 1 A 104 104 PRO HA H 104 4.475 4.715 -0.240 1
1 1219 . 19 1 1 A 104 104 PRO C C 104 177.445 177.816 -0.371 1
1 1220 . 19 1 1 A 104 104 PRO CA C 104 63.312 62.834 0.478 1
1 1221 . 19 1 1 A 104 104 PRO CB C 104 32.190 32.047 0.143 1
1 1224 . 19 1 1 A 105 105 SER H H 105 8.538 8.815 -0.277 1
1 1225 . 19 1 1 A 105 105 SER HA H 105 4.541 4.263 0.278 1
1 1228 . 19 1 1 A 105 105 SER C C 105 174.616 174.742 -0.126 1
1 1229 . 19 1 1 A 105 105 SER CA C 105 58.270 61.308 -3.038 1
1 1230 . 19 1 1 A 105 105 SER CB C 105 63.895 63.343 0.552 1
1 1231 . 19 1 1 A 105 105 SER N N 105 116.446 118.574 -2.128 1
1 1232 . 19 1 1 A 106 106 SER H H 106 8.350 7.733 0.617 1
1 1233 . 19 1 1 A 106 106 SER HA H 106 4.541 4.767 -0.226 1
1 1236 . 19 1 1 A 106 106 SER C C 106 174.530 173.979 0.551 1
1 1237 . 19 1 1 A 106 106 SER CA C 106 58.357 57.952 0.405 1
1 1238 . 19 1 1 A 106 106 SER CB C 106 64.020 65.479 -1.459 1
1 1239 . 19 1 1 A 106 106 SER N N 106 117.448 112.625 4.823 1
1 1 . 20 1 1 A 2 2 SER C C 2 174.723 174.413 0.310 1
1 2 . 20 1 1 A 2 2 SER CA C 2 58.446 59.832 -1.386 1
1 3 . 20 1 1 A 2 2 SER CB C 2 63.566 63.055 0.511 1
1 4 . 20 1 1 A 3 3 SER H H 3 8.350 8.855 -0.505 1
1 5 . 20 1 1 A 3 3 SER C C 3 173.961 175.129 -1.168 1
1 6 . 20 1 1 A 3 3 SER CA C 3 58.428 61.355 -2.927 1
1 7 . 20 1 1 A 3 3 SER CB C 3 63.937 63.175 0.762 1
1 8 . 20 1 1 A 3 3 SER N N 3 117.923 122.438 -4.515 1
1 9 . 20 1 1 A 4 4 GLY H H 4 8.050 8.322 -0.272 1
1 10 . 20 1 1 A 4 4 GLY C C 4 179.009 174.904 4.105 1
1 11 . 20 1 1 A 4 4 GLY CA C 4 46.174 45.778 0.396 1
1 12 . 20 1 1 A 4 4 GLY N N 4 116.890 108.177 8.713 1
1 13 . 20 1 1 A 7 7 GLY HA2 H 7 4.340 4.283 0.057 1
1 14 . 20 1 1 A 7 7 GLY HA3 H 7 3.629 4.284 -0.655 1
1 15 . 20 1 1 A 7 7 GLY CA C 7 44.381 44.148 0.233 1
1 16 . 20 1 1 A 8 8 PRO HA H 8 4.476 4.518 -0.042 1
1 23 . 20 1 1 A 8 8 PRO C C 8 176.235 177.181 -0.946 1
1 24 . 20 1 1 A 8 8 PRO CA C 8 62.995 62.662 0.333 1
1 25 . 20 1 1 A 8 8 PRO CB C 8 33.266 32.196 1.070 1
1 28 . 20 1 1 A 9 9 GLY H H 9 8.585 8.553 0.032 1
1 29 . 20 1 1 A 9 9 GLY HA2 H 9 4.326 4.084 0.242 1
1 30 . 20 1 1 A 9 9 GLY HA3 H 9 4.009 4.090 -0.081 1
1 31 . 20 1 1 A 9 9 GLY C C 9 172.998 173.150 -0.152 1
1 32 . 20 1 1 A 9 9 GLY CA C 9 44.393 44.307 0.086 1
1 33 . 20 1 1 A 9 9 GLY N N 9 106.004 107.714 -1.710 1
1 34 . 20 1 1 A 10 10 ARG H H 10 8.548 8.239 0.309 1
1 35 . 20 1 1 A 10 10 ARG HA H 10 4.654 4.751 -0.097 1
1 41 . 20 1 1 A 10 10 ARG C C 10 175.780 175.243 0.537 1
1 42 . 20 1 1 A 10 10 ARG CA C 10 54.708 54.777 -0.069 1
1 43 . 20 1 1 A 10 10 ARG CB C 10 31.448 30.840 0.608 1
1 45 . 20 1 1 A 10 10 ARG N N 10 119.407 117.552 1.855 1
1 46 . 20 1 1 A 11 11 PRO HA H 11 4.611 4.568 0.043 1
1 53 . 20 1 1 A 11 11 PRO C C 11 173.510 175.628 -2.118 1
1 54 . 20 1 1 A 11 11 PRO CA C 11 62.360 62.683 -0.323 1
1 55 . 20 1 1 A 11 11 PRO CB C 11 33.402 32.199 1.203 1
1 58 . 20 1 1 A 12 12 THR H H 12 7.572 7.951 -0.379 1
1 59 . 20 1 1 A 12 12 THR HA H 12 3.796 4.238 -0.442 1
1 64 . 20 1 1 A 12 12 THR C C 12 172.337 173.245 -0.908 1
1 65 . 20 1 1 A 12 12 THR CA C 12 61.778 61.616 0.162 1
1 66 . 20 1 1 A 12 12 THR CB C 12 70.561 68.585 1.976 1
1 68 . 20 1 1 A 12 12 THR N N 12 109.653 117.289 -7.636 1
1 69 . 20 1 1 A 13 13 MET H H 13 5.605 8.239 -2.634 1
1 70 . 20 1 1 A 13 13 MET HA H 13 5.091 4.897 0.194 1
1 78 . 20 1 1 A 13 13 MET C C 13 172.639 174.787 -2.148 1
1 79 . 20 1 1 A 13 13 MET CA C 13 54.168 53.602 0.566 1
1 80 . 20 1 1 A 13 13 MET CB C 13 37.632 34.506 3.126 1
1 83 . 20 1 1 A 13 13 MET N N 13 121.634 126.776 -5.142 1
1 84 . 20 1 1 A 14 14 MET H H 14 9.254 9.207 0.047 1
1 85 . 20 1 1 A 14 14 MET HA H 14 4.662 5.211 -0.549 1
1 93 . 20 1 1 A 14 14 MET C C 14 174.388 174.739 -0.351 1
1 94 . 20 1 1 A 14 14 MET CA C 14 54.673 54.277 0.396 1
1 95 . 20 1 1 A 14 14 MET CB C 14 34.907 35.001 -0.094 1
1 98 . 20 1 1 A 14 14 MET N N 14 125.746 124.376 1.370 1
1 99 . 20 1 1 A 15 15 ILE H H 15 8.555 9.099 -0.544 1
1 100 . 20 1 1 A 15 15 ILE HA H 15 4.882 4.964 -0.082 1
1 110 . 20 1 1 A 15 15 ILE C C 15 174.962 175.046 -0.084 1
1 111 . 20 1 1 A 15 15 ILE CA C 15 60.685 60.675 0.010 1
1 112 . 20 1 1 A 15 15 ILE CB C 15 40.878 39.113 1.765 1
1 116 . 20 1 1 A 15 15 ILE N N 15 121.623 126.091 -4.468 1
1 117 . 20 1 1 A 16 16 SER H H 16 8.703 8.869 -0.166 1
1 118 . 20 1 1 A 16 16 SER HA H 16 4.922 5.086 -0.164 1
1 121 . 20 1 1 A 16 16 SER C C 16 173.860 172.848 1.012 1
1 122 . 20 1 1 A 16 16 SER CA C 16 56.524 57.309 -0.785 1
1 123 . 20 1 1 A 16 16 SER CB C 16 65.004 66.064 -1.060 1
1 124 . 20 1 1 A 16 16 SER N N 16 122.261 124.434 -2.173 1
1 125 . 20 1 1 A 17 17 THR H H 17 8.759 8.661 0.098 1
1 126 . 20 1 1 A 17 17 THR HA H 17 4.885 5.210 -0.325 1
1 131 . 20 1 1 A 17 17 THR C C 17 175.018 174.098 0.920 1
1 132 . 20 1 1 A 17 17 THR CA C 17 60.315 60.477 -0.162 1
1 133 . 20 1 1 A 17 17 THR CB C 17 69.799 70.493 -0.694 1
1 135 . 20 1 1 A 17 17 THR N N 17 115.660 114.378 1.282 1
1 136 . 20 1 1 A 18 18 THR H H 18 8.038 8.712 -0.674 1
1 137 . 20 1 1 A 18 18 THR HA H 18 4.596 4.433 0.163 1
1 142 . 20 1 1 A 18 18 THR CA C 18 60.707 64.010 -3.303 1
1 143 . 20 1 1 A 18 18 THR CB C 18 71.082 71.181 -0.099 1
1 145 . 20 1 1 A 18 18 THR N N 18 112.362 118.331 -5.969 1
1 146 . 20 1 1 A 19 19 ALA H H 19 8.545 7.729 0.816 1
1 147 . 20 1 1 A 19 19 ALA HA H 19 4.412 4.417 -0.005 1
1 151 . 20 1 1 A 19 19 ALA C C 19 177.034 177.053 -0.019 1
1 152 . 20 1 1 A 19 19 ALA CA C 19 52.264 51.617 0.647 1
1 153 . 20 1 1 A 19 19 ALA CB C 19 19.292 21.090 -1.798 1
1 154 . 20 1 1 A 19 19 ALA N N 19 119.589 122.707 -3.118 1
1 155 . 20 1 1 A 20 20 MET H H 20 8.145 8.498 -0.353 1
1 156 . 20 1 1 A 20 20 MET HA H 20 4.447 4.492 -0.045 1
1 164 . 20 1 1 A 20 20 MET C C 20 175.676 176.381 -0.705 1
1 165 . 20 1 1 A 20 20 MET CA C 20 55.764 54.476 1.288 1
1 166 . 20 1 1 A 20 20 MET CB C 20 31.495 32.200 -0.705 1
1 169 . 20 1 1 A 20 20 MET N N 20 116.950 118.789 -1.839 1
1 170 . 20 1 1 A 21 21 ASN H H 21 8.275 8.870 -0.595 1
1 171 . 20 1 1 A 21 21 ASN HA H 21 4.452 4.287 0.165 1
1 176 . 20 1 1 A 21 21 ASN C C 21 174.100 173.933 0.167 1
1 177 . 20 1 1 A 21 21 ASN CA C 21 54.320 54.351 -0.031 1
1 178 . 20 1 1 A 21 21 ASN CB C 21 37.234 37.278 -0.044 1
1 179 . 20 1 1 A 21 21 ASN N N 21 113.198 119.101 -5.903 1
1 181 . 20 1 1 A 22 22 THR H H 22 7.071 7.420 -0.349 1
1 182 . 20 1 1 A 22 22 THR HA H 22 5.218 5.356 -0.138 1
1 187 . 20 1 1 A 22 22 THR C C 22 173.301 172.639 0.662 1
1 188 . 20 1 1 A 22 22 THR CA C 22 59.399 60.556 -1.157 1
1 189 . 20 1 1 A 22 22 THR CB C 22 72.714 71.631 1.083 1
1 191 . 20 1 1 A 22 22 THR N N 22 107.603 107.805 -0.202 1
1 192 . 20 1 1 A 23 23 ALA H H 23 8.687 8.825 -0.138 1
1 193 . 20 1 1 A 23 23 ALA HA H 23 4.925 4.899 0.026 1
1 197 . 20 1 1 A 23 23 ALA C C 23 174.100 175.813 -1.713 1
1 198 . 20 1 1 A 23 23 ALA CA C 23 50.812 50.115 0.697 1
1 199 . 20 1 1 A 23 23 ALA CB C 23 21.122 20.875 0.247 1
1 200 . 20 1 1 A 23 23 ALA N N 23 121.937 127.701 -5.764 1
1 201 . 20 1 1 A 24 24 LEU H H 24 8.833 9.075 -0.242 1
1 202 . 20 1 1 A 24 24 LEU HA H 24 4.673 4.607 0.066 1
1 212 . 20 1 1 A 24 24 LEU C C 24 175.140 174.482 0.658 1
1 213 . 20 1 1 A 24 24 LEU CA C 24 54.320 54.827 -0.507 1
1 214 . 20 1 1 A 24 24 LEU CB C 24 42.518 42.654 -0.136 1
1 218 . 20 1 1 A 24 24 LEU N N 24 123.721 127.010 -3.289 1
1 219 . 20 1 1 A 25 25 LEU H H 25 9.176 9.256 -0.080 1
1 220 . 20 1 1 A 25 25 LEU HA H 25 5.112 4.967 0.145 1
1 230 . 20 1 1 A 25 25 LEU C C 25 176.414 175.823 0.591 1
1 231 . 20 1 1 A 25 25 LEU CA C 25 54.108 53.558 0.550 1
1 232 . 20 1 1 A 25 25 LEU CB C 25 43.230 43.275 -0.045 1
1 236 . 20 1 1 A 25 25 LEU N N 25 128.589 129.417 -0.828 1
1 237 . 20 1 1 A 26 26 GLN H H 26 8.556 8.512 0.044 1
1 238 . 20 1 1 A 26 26 GLN HA H 26 4.737 4.939 -0.202 1
1 245 . 20 1 1 A 26 26 GLN C C 26 174.372 174.382 -0.010 1
1 246 . 20 1 1 A 26 26 GLN CA C 26 56.365 54.514 1.851 1
1 247 . 20 1 1 A 26 26 GLN CB C 26 33.320 31.975 1.345 1
1 249 . 20 1 1 A 26 26 GLN N N 26 119.630 123.227 -3.597 1
1 251 . 20 1 1 A 27 27 TRP H H 27 8.080 8.309 -0.229 1
1 252 . 20 1 1 A 27 27 TRP HA H 27 5.441 5.834 -0.393 1
1 261 . 20 1 1 A 27 27 TRP CA C 27 55.957 54.563 1.394 1
1 262 . 20 1 1 A 27 27 TRP CB C 27 32.517 32.231 0.286 1
1 268 . 20 1 1 A 27 27 TRP N N 27 121.276 121.705 -0.429 1
1 270 . 20 1 1 A 28 28 HIS H H 28 8.262 8.641 -0.379 1
1 271 . 20 1 1 A 28 28 HIS HA H 28 4.997 5.011 -0.014 1
1 275 . 20 1 1 A 28 28 HIS CA C 28 53.028 53.915 -0.887 1
1 276 . 20 1 1 A 28 28 HIS CB C 28 32.832 32.806 0.026 1
1 278 . 20 1 1 A 28 28 HIS N N 28 116.245 116.817 -0.572 1
1 279 . 20 1 1 A 29 29 PRO HA H 29 4.984 4.668 0.316 1
1 286 . 20 1 1 A 29 29 PRO CA C 29 61.498 62.088 -0.590 1
1 287 . 20 1 1 A 29 29 PRO CB C 29 30.709 32.280 -1.571 1
1 290 . 20 1 1 A 30 30 PRO HA H 30 4.449 4.679 -0.230 1
1 297 . 20 1 1 A 30 30 PRO C C 30 175.733 176.758 -1.025 1
1 298 . 20 1 1 A 30 30 PRO CA C 30 62.245 62.527 -0.282 1
1 299 . 20 1 1 A 30 30 PRO CB C 30 32.083 33.441 -1.358 1
1 302 . 20 1 1 A 31 31 LYS H H 31 8.403 8.899 -0.496 1
1 303 . 20 1 1 A 31 31 LYS HA H 31 4.084 4.501 -0.417 1
1 312 . 20 1 1 A 31 31 LYS C C 31 177.166 177.333 -0.167 1
1 313 . 20 1 1 A 31 31 LYS CA C 31 57.866 56.951 0.915 1
1 314 . 20 1 1 A 31 31 LYS CB C 31 32.698 33.793 -1.095 1
1 318 . 20 1 1 A 31 31 LYS N N 31 121.693 119.639 2.054 1
1 319 . 20 1 1 A 32 32 GLU H H 32 8.102 7.765 0.337 1
1 320 . 20 1 1 A 32 32 GLU HA H 32 4.365 4.532 -0.167 1
1 325 . 20 1 1 A 32 32 GLU C C 32 174.248 175.427 -1.179 1
1 326 . 20 1 1 A 32 32 GLU CA C 32 55.448 56.060 -0.612 1
1 327 . 20 1 1 A 32 32 GLU CB C 32 29.405 29.994 -0.589 1
1 329 . 20 1 1 A 32 32 GLU N N 32 118.742 117.193 1.549 1
1 330 . 20 1 1 A 33 33 LEU H H 33 8.420 7.519 0.901 1
1 331 . 20 1 1 A 33 33 LEU HA H 33 4.499 4.802 -0.303 1
1 341 . 20 1 1 A 33 33 LEU C C 33 173.036 174.750 -1.714 1
1 342 . 20 1 1 A 33 33 LEU CA C 33 52.863 51.485 1.378 1
1 343 . 20 1 1 A 33 33 LEU CB C 33 42.535 43.751 -1.216 1
1 347 . 20 1 1 A 33 33 LEU N N 33 125.181 122.923 2.258 1
1 348 . 20 1 1 A 34 34 PRO HA H 34 4.488 4.492 -0.004 1
1 355 . 20 1 1 A 34 34 PRO C C 34 177.544 176.645 0.899 1
1 356 . 20 1 1 A 34 34 PRO CA C 34 62.889 63.126 -0.237 1
1 357 . 20 1 1 A 34 34 PRO CB C 34 31.472 30.863 0.609 1
1 360 . 20 1 1 A 35 35 GLY H H 35 8.397 8.009 0.388 1
1 361 . 20 1 1 A 35 35 GLY HA2 H 35 4.059 4.120 -0.061 1
1 362 . 20 1 1 A 35 35 GLY HA3 H 35 3.716 4.120 -0.404 1
1 363 . 20 1 1 A 35 35 GLY C C 35 173.356 171.861 1.495 1
1 364 . 20 1 1 A 35 35 GLY CA C 35 45.892 44.389 1.503 1
1 365 . 20 1 1 A 35 35 GLY N N 35 110.524 112.180 -1.656 1
1 366 . 20 1 1 A 36 36 GLU H H 36 8.091 8.532 -0.441 1
1 367 . 20 1 1 A 36 36 GLU HA H 36 4.371 5.086 -0.715 1
1 372 . 20 1 1 A 36 36 GLU C C 36 174.864 175.537 -0.673 1
1 373 . 20 1 1 A 36 36 GLU CA C 36 55.201 54.633 0.568 1
1 374 . 20 1 1 A 36 36 GLU CB C 36 31.878 33.099 -1.221 1
1 376 . 20 1 1 A 36 36 GLU N N 36 122.202 122.087 0.115 1
1 377 . 20 1 1 A 37 37 LEU H H 37 8.307 8.600 -0.293 1
1 378 . 20 1 1 A 37 37 LEU HA H 37 4.288 4.298 -0.010 1
1 388 . 20 1 1 A 37 37 LEU C C 37 176.702 176.133 0.569 1
1 389 . 20 1 1 A 37 37 LEU CA C 37 55.342 56.208 -0.866 1
1 390 . 20 1 1 A 37 37 LEU CB C 37 42.715 42.365 0.350 1
1 394 . 20 1 1 A 37 37 LEU N N 37 123.204 127.185 -3.981 1
1 395 . 20 1 1 A 38 38 LEU H H 38 8.909 8.700 0.209 1
1 396 . 20 1 1 A 38 38 LEU HA H 38 4.640 4.633 0.007 1
1 406 . 20 1 1 A 38 38 LEU C C 38 177.202 176.759 0.443 1
1 407 . 20 1 1 A 38 38 LEU CA C 38 54.390 55.228 -0.838 1
1 408 . 20 1 1 A 38 38 LEU CB C 38 43.770 43.651 0.119 1
1 412 . 20 1 1 A 38 38 LEU N N 38 123.021 126.966 -3.945 1
1 413 . 20 1 1 A 39 39 GLY H H 39 7.113 6.987 0.126 1
1 414 . 20 1 1 A 39 39 GLY HA2 H 39 4.816 3.548 1.268 1
1 415 . 20 1 1 A 39 39 GLY HA3 H 39 3.276 3.901 -0.625 1
1 416 . 20 1 1 A 39 39 GLY C C 39 169.863 170.400 -0.537 1
1 417 . 20 1 1 A 39 39 GLY CA C 39 44.622 45.531 -0.909 1
1 418 . 20 1 1 A 39 39 GLY N N 39 104.137 103.655 0.482 1
1 419 . 20 1 1 A 40 40 TYR H H 40 8.318 8.964 -0.646 1
1 420 . 20 1 1 A 40 40 TYR HA H 40 5.414 5.168 0.246 1
1 425 . 20 1 1 A 40 40 TYR C C 40 174.448 172.181 2.267 1
1 426 . 20 1 1 A 40 40 TYR CA C 40 56.178 56.469 -0.291 1
1 427 . 20 1 1 A 40 40 TYR CB C 40 44.191 40.705 3.486 1
1 430 . 20 1 1 A 40 40 TYR N N 40 114.036 115.476 -1.440 1
1 431 . 20 1 1 A 41 41 ARG H H 41 9.347 8.811 0.536 1
1 432 . 20 1 1 A 41 41 ARG HA H 41 5.092 5.422 -0.330 1
1 440 . 20 1 1 A 41 41 ARG C C 41 174.097 174.452 -0.355 1
1 441 . 20 1 1 A 41 41 ARG CA C 41 56.100 54.226 1.874 1
1 442 . 20 1 1 A 41 41 ARG CB C 41 34.508 32.690 1.818 1
1 445 . 20 1 1 A 41 41 ARG N N 41 122.231 121.217 1.014 1
1 447 . 20 1 1 A 42 42 LEU H H 42 9.546 9.232 0.314 1
1 448 . 20 1 1 A 42 42 LEU HA H 42 5.459 5.238 0.221 1
1 458 . 20 1 1 A 42 42 LEU C C 42 174.913 174.758 0.155 1
1 459 . 20 1 1 A 42 42 LEU CA C 42 52.997 53.392 -0.395 1
1 460 . 20 1 1 A 42 42 LEU CB C 42 46.413 45.435 0.978 1
1 464 . 20 1 1 A 42 42 LEU N N 42 132.335 127.785 4.550 1
1 465 . 20 1 1 A 43 43 GLN H H 43 9.502 9.266 0.236 1
1 466 . 20 1 1 A 43 43 GLN HA H 43 5.847 5.382 0.465 1
1 473 . 20 1 1 A 43 43 GLN C C 43 175.329 173.935 1.394 1
1 474 . 20 1 1 A 43 43 GLN CA C 43 54.005 54.511 -0.506 1
1 475 . 20 1 1 A 43 43 GLN CB C 43 33.429 31.399 2.030 1
1 477 . 20 1 1 A 43 43 GLN N N 43 123.932 125.400 -1.468 1
1 479 . 20 1 1 A 44 44 TYR H H 44 8.615 8.447 0.168 1
1 480 . 20 1 1 A 44 44 TYR HA H 44 5.783 5.797 -0.014 1
1 487 . 20 1 1 A 44 44 TYR C C 44 174.058 173.503 0.555 1
1 488 . 20 1 1 A 44 44 TYR CA C 44 55.942 55.888 0.054 1
1 489 . 20 1 1 A 44 44 TYR CB C 44 43.052 41.660 1.392 1
1 494 . 20 1 1 A 44 44 TYR N N 44 117.355 119.892 -2.537 1
1 495 . 20 1 1 A 45 45 CYS H H 45 8.377 8.273 0.104 1
1 496 . 20 1 1 A 45 45 CYS HA H 45 4.772 5.130 -0.358 1
1 499 . 20 1 1 A 45 45 CYS C C 45 173.205 173.774 -0.569 1
1 500 . 20 1 1 A 45 45 CYS CA C 45 55.960 57.002 -1.042 1
1 501 . 20 1 1 A 45 45 CYS CB C 45 30.665 31.285 -0.620 1
1 502 . 20 1 1 A 45 45 CYS N N 45 115.140 118.577 -3.437 1
1 503 . 20 1 1 A 46 46 ARG H H 46 9.165 8.438 0.727 1
1 504 . 20 1 1 A 46 46 ARG HA H 46 4.068 3.873 0.195 1
1 511 . 20 1 1 A 46 46 ARG C C 46 178.440 177.428 1.012 1
1 512 . 20 1 1 A 46 46 ARG CA C 46 56.401 56.116 0.285 1
1 513 . 20 1 1 A 46 46 ARG CB C 46 31.878 31.113 0.765 1
1 516 . 20 1 1 A 46 46 ARG N N 46 121.803 121.023 0.780 1
1 517 . 20 1 1 A 47 47 ALA H H 47 8.273 7.968 0.305 1
1 518 . 20 1 1 A 47 47 ALA HA H 47 3.891 4.170 -0.279 1
1 522 . 20 1 1 A 47 47 ALA C C 47 177.599 177.315 0.284 1
1 523 . 20 1 1 A 47 47 ALA CA C 47 54.796 52.981 1.815 1
1 524 . 20 1 1 A 47 47 ALA CB C 47 18.287 18.650 -0.363 1
1 525 . 20 1 1 A 47 47 ALA N N 47 123.895 123.593 0.302 1
1 526 . 20 1 1 A 48 48 ASP H H 48 8.036 8.281 -0.245 1
1 527 . 20 1 1 A 48 48 ASP HA H 48 4.453 4.682 -0.229 1
1 530 . 20 1 1 A 48 48 ASP C C 48 175.836 175.335 0.501 1
1 531 . 20 1 1 A 48 48 ASP CA C 48 53.368 53.323 0.045 1
1 532 . 20 1 1 A 48 48 ASP CB C 48 39.964 41.864 -1.900 1
1 533 . 20 1 1 A 48 48 ASP N N 48 112.576 115.825 -3.249 1
1 534 . 20 1 1 A 49 49 GLU H H 49 7.495 7.252 0.243 1
1 535 . 20 1 1 A 49 49 GLU HA H 49 4.308 4.437 -0.129 1
1 540 . 20 1 1 A 49 49 GLU C C 49 175.756 175.668 0.088 1
1 541 . 20 1 1 A 49 49 GLU CA C 49 56.224 55.167 1.057 1
1 542 . 20 1 1 A 49 49 GLU CB C 49 32.248 30.605 1.643 1
1 544 . 20 1 1 A 49 49 GLU N N 49 120.609 119.407 1.202 1
1 545 . 20 1 1 A 50 50 ALA H H 50 8.416 8.599 -0.183 1
1 546 . 20 1 1 A 50 50 ALA HA H 50 4.200 4.497 -0.297 1
1 550 . 20 1 1 A 50 50 ALA C C 50 177.433 177.013 0.420 1
1 551 . 20 1 1 A 50 50 ALA CA C 50 53.297 52.534 0.763 1
1 552 . 20 1 1 A 50 50 ALA CB C 50 19.474 20.809 -1.335 1
1 553 . 20 1 1 A 50 50 ALA N N 50 124.065 123.189 0.876 1
1 554 . 20 1 1 A 51 51 ARG H H 51 7.648 7.732 -0.084 1
1 555 . 20 1 1 A 51 51 ARG HA H 51 4.747 4.822 -0.075 1
1 562 . 20 1 1 A 51 51 ARG C C 51 173.400 174.208 -0.808 1
1 563 . 20 1 1 A 51 51 ARG CA C 51 52.592 53.913 -1.321 1
1 564 . 20 1 1 A 51 51 ARG CB C 51 31.212 32.418 -1.206 1
1 567 . 20 1 1 A 51 51 ARG N N 51 117.798 116.212 1.586 1
1 568 . 20 1 1 A 52 52 PRO HA H 52 4.212 4.411 -0.199 1
1 575 . 20 1 1 A 52 52 PRO C C 52 176.380 176.182 0.198 1
1 576 . 20 1 1 A 52 52 PRO CA C 52 62.360 62.564 -0.204 1
1 577 . 20 1 1 A 52 52 PRO CB C 52 32.331 32.219 0.112 1
1 580 . 20 1 1 A 53 53 ASN H H 53 8.127 7.862 0.265 1
1 581 . 20 1 1 A 53 53 ASN HA H 53 4.651 4.813 -0.162 1
1 586 . 20 1 1 A 53 53 ASN C C 53 174.354 174.497 -0.143 1
1 587 . 20 1 1 A 53 53 ASN CA C 53 53.136 52.407 0.729 1
1 588 . 20 1 1 A 53 53 ASN CB C 53 39.666 38.384 1.282 1
1 589 . 20 1 1 A 53 53 ASN N N 53 119.405 119.876 -0.471 1
1 591 . 20 1 1 A 54 54 THR H H 54 8.425 8.544 -0.119 1
1 592 . 20 1 1 A 54 54 THR HA H 54 5.306 4.527 0.779 1
1 597 . 20 1 1 A 54 54 THR C C 54 173.850 174.136 -0.286 1
1 598 . 20 1 1 A 54 54 THR CA C 54 61.881 63.301 -1.420 1
1 599 . 20 1 1 A 54 54 THR CB C 54 70.573 69.694 0.879 1
1 601 . 20 1 1 A 54 54 THR N N 54 118.968 120.703 -1.735 1
1 602 . 20 1 1 A 55 55 ILE H H 55 9.354 8.385 0.969 1
1 603 . 20 1 1 A 55 55 ILE HA H 55 4.051 4.530 -0.479 1
1 613 . 20 1 1 A 55 55 ILE C C 55 172.975 173.505 -0.530 1
1 614 . 20 1 1 A 55 55 ILE CA C 55 61.003 59.932 1.071 1
1 615 . 20 1 1 A 55 55 ILE CB C 55 41.619 42.109 -0.490 1
1 619 . 20 1 1 A 55 55 ILE N N 55 127.961 124.983 2.978 1
1 620 . 20 1 1 A 56 56 ASP H H 56 8.132 8.767 -0.635 1
1 621 . 20 1 1 A 56 56 ASP HA H 56 5.334 5.300 0.034 1
1 624 . 20 1 1 A 56 56 ASP C C 56 174.969 174.775 0.194 1
1 625 . 20 1 1 A 56 56 ASP CA C 56 53.702 52.847 0.855 1
1 626 . 20 1 1 A 56 56 ASP CB C 56 43.251 42.959 0.292 1
1 627 . 20 1 1 A 56 56 ASP N N 56 125.882 127.363 -1.481 1
1 628 . 20 1 1 A 57 57 PHE H H 57 8.955 8.770 0.185 1
1 629 . 20 1 1 A 57 57 PHE HA H 57 4.915 5.011 -0.096 1
1 637 . 20 1 1 A 57 57 PHE C C 57 177.361 175.533 1.828 1
1 638 . 20 1 1 A 57 57 PHE CA C 57 57.458 56.645 0.813 1
1 639 . 20 1 1 A 57 57 PHE CB C 57 43.737 43.271 0.466 1
1 645 . 20 1 1 A 57 57 PHE N N 57 118.872 122.926 -4.054 1
1 646 . 20 1 1 A 58 58 GLY H H 58 9.552 8.666 0.886 1
1 647 . 20 1 1 A 58 58 GLY HA2 H 58 4.662 4.094 0.568 1
1 648 . 20 1 1 A 58 58 GLY HA3 H 58 4.126 4.166 -0.040 1
1 649 . 20 1 1 A 58 58 GLY C C 58 174.760 174.951 -0.191 1
1 650 . 20 1 1 A 58 58 GLY CA C 58 44.680 45.116 -0.436 1
1 651 . 20 1 1 A 58 58 GLY N N 58 111.551 110.257 1.294 1
1 652 . 20 1 1 A 59 59 LYS H H 59 8.211 8.184 0.027 1
1 653 . 20 1 1 A 59 59 LYS HA H 59 3.782 3.643 0.139 1
1 662 . 20 1 1 A 59 59 LYS C C 59 176.154 178.289 -2.135 1
1 663 . 20 1 1 A 59 59 LYS CA C 59 59.080 58.694 0.386 1
1 664 . 20 1 1 A 59 59 LYS CB C 59 32.516 31.800 0.716 1
1 668 . 20 1 1 A 59 59 LYS N N 59 115.953 120.430 -4.477 1
1 669 . 20 1 1 A 60 60 ASP H H 60 8.634 8.092 0.542 1
1 670 . 20 1 1 A 60 60 ASP HA H 60 4.882 4.370 0.512 1
1 673 . 20 1 1 A 60 60 ASP C C 60 176.039 176.266 -0.227 1
1 674 . 20 1 1 A 60 60 ASP CA C 60 54.327 57.340 -3.013 1
1 675 . 20 1 1 A 60 60 ASP CB C 60 41.461 41.319 0.142 1
1 676 . 20 1 1 A 60 60 ASP N N 60 117.261 120.275 -3.014 1
1 677 . 20 1 1 A 61 61 ASP H H 61 7.500 8.072 -0.572 1
1 678 . 20 1 1 A 61 61 ASP HA H 61 4.591 4.685 -0.094 1
1 681 . 20 1 1 A 61 61 ASP C C 61 175.140 175.746 -0.606 1
1 682 . 20 1 1 A 61 61 ASP CA C 61 55.342 53.671 1.671 1
1 683 . 20 1 1 A 61 61 ASP CB C 61 42.475 39.751 2.724 1
1 684 . 20 1 1 A 61 61 ASP N N 61 122.319 118.721 3.598 1
1 685 . 20 1 1 A 62 62 GLN H H 62 8.239 8.016 0.223 1
1 686 . 20 1 1 A 62 62 GLN HA H 62 2.569 3.545 -0.976 1
1 693 . 20 1 1 A 62 62 GLN C C 62 172.652 174.094 -1.442 1
1 694 . 20 1 1 A 62 62 GLN CA C 62 54.038 55.811 -1.773 1
1 695 . 20 1 1 A 62 62 GLN CB C 62 31.481 29.058 2.423 1
1 697 . 20 1 1 A 62 62 GLN N N 62 117.458 123.169 -5.711 1
1 699 . 20 1 1 A 63 63 HIS H H 63 6.338 6.850 -0.512 1
1 700 . 20 1 1 A 63 63 HIS HA H 63 4.423 4.602 -0.179 1
1 704 . 20 1 1 A 63 63 HIS C C 63 173.031 172.649 0.382 1
1 705 . 20 1 1 A 63 63 HIS CA C 63 54.743 54.033 0.710 1
1 706 . 20 1 1 A 63 63 HIS CB C 63 32.661 31.702 0.959 1
1 708 . 20 1 1 A 63 63 HIS N N 63 113.589 115.871 -2.282 1
1 709 . 20 1 1 A 64 64 PHE H H 64 8.549 9.296 -0.747 1
1 710 . 20 1 1 A 64 64 PHE HA H 64 4.578 5.247 -0.669 1
1 718 . 20 1 1 A 64 64 PHE C C 64 173.015 173.763 -0.748 1
1 719 . 20 1 1 A 64 64 PHE CA C 64 58.516 56.668 1.848 1
1 720 . 20 1 1 A 64 64 PHE CB C 64 43.525 43.017 0.508 1
1 726 . 20 1 1 A 64 64 PHE N N 64 118.214 120.455 -2.241 1
1 727 . 20 1 1 A 65 65 THR H H 65 7.150 8.271 -1.121 1
1 728 . 20 1 1 A 65 65 THR HA H 65 4.930 4.637 0.293 1
1 733 . 20 1 1 A 65 65 THR C C 65 172.457 173.673 -1.216 1
1 734 . 20 1 1 A 65 65 THR CA C 65 61.690 61.847 -0.157 1
1 735 . 20 1 1 A 65 65 THR CB C 65 69.593 69.067 0.526 1
1 737 . 20 1 1 A 65 65 THR N N 65 123.198 120.973 2.225 1
1 738 . 20 1 1 A 66 66 VAL H H 66 8.888 8.625 0.263 1
1 739 . 20 1 1 A 66 66 VAL HA H 66 4.018 4.700 -0.682 1
1 747 . 20 1 1 A 66 66 VAL C C 66 174.868 175.468 -0.600 1
1 748 . 20 1 1 A 66 66 VAL CA C 66 61.178 60.812 0.366 1
1 749 . 20 1 1 A 66 66 VAL CB C 66 33.114 33.035 0.079 1
1 752 . 20 1 1 A 66 66 VAL N N 66 126.840 128.103 -1.263 1
1 753 . 20 1 1 A 67 67 THR H H 67 8.174 8.528 -0.354 1
1 754 . 20 1 1 A 67 67 THR HA H 67 4.816 5.111 -0.295 1
1 759 . 20 1 1 A 67 67 THR C C 67 174.494 174.269 0.225 1
1 760 . 20 1 1 A 67 67 THR CA C 67 59.786 59.586 0.200 1
1 761 . 20 1 1 A 67 67 THR CB C 67 70.887 71.714 -0.827 1
1 763 . 20 1 1 A 67 67 THR N N 67 116.127 116.902 -0.775 1
1 764 . 20 1 1 A 68 68 GLY H H 68 8.570 8.961 -0.391 1
1 765 . 20 1 1 A 68 68 GLY HA2 H 68 3.970 3.999 -0.029 1
1 766 . 20 1 1 A 68 68 GLY HA3 H 68 3.819 4.001 -0.182 1
1 767 . 20 1 1 A 68 68 GLY C C 68 175.636 175.143 0.493 1
1 768 . 20 1 1 A 68 68 GLY CA C 68 46.397 45.564 0.833 1
1 769 . 20 1 1 A 68 68 GLY N N 68 107.146 113.205 -6.059 1
1 770 . 20 1 1 A 69 69 LEU H H 69 8.007 7.732 0.275 1
1 771 . 20 1 1 A 69 69 LEU HA H 69 4.154 4.299 -0.145 1
1 781 . 20 1 1 A 69 69 LEU C C 69 176.830 176.254 0.576 1
1 782 . 20 1 1 A 69 69 LEU CA C 69 54.602 54.425 0.177 1
1 783 . 20 1 1 A 69 69 LEU CB C 69 41.149 42.002 -0.853 1
1 787 . 20 1 1 A 69 69 LEU N N 69 118.433 122.360 -3.927 1
1 788 . 20 1 1 A 70 70 HIS H H 70 8.866 8.970 -0.104 1
1 789 . 20 1 1 A 70 70 HIS HA H 70 4.663 4.761 -0.098 1
1 793 . 20 1 1 A 70 70 HIS C C 70 176.667 175.235 1.432 1
1 794 . 20 1 1 A 70 70 HIS CA C 70 55.464 56.378 -0.914 1
1 795 . 20 1 1 A 70 70 HIS CB C 70 32.125 29.673 2.452 1
1 797 . 20 1 1 A 70 70 HIS N N 70 122.457 122.722 -0.265 1
1 798 . 20 1 1 A 71 71 LYS H H 71 8.716 8.746 -0.030 1
1 799 . 20 1 1 A 71 71 LYS HA H 71 4.320 4.256 0.064 1
1 808 . 20 1 1 A 71 71 LYS C C 71 178.110 177.689 0.421 1
1 809 . 20 1 1 A 71 71 LYS CA C 71 57.035 58.068 -1.033 1
1 810 . 20 1 1 A 71 71 LYS CB C 71 33.580 32.868 0.712 1
1 814 . 20 1 1 A 71 71 LYS N N 71 123.173 123.766 -0.593 1
1 815 . 20 1 1 A 72 72 GLY H H 72 7.709 8.789 -1.080 1
1 816 . 20 1 1 A 72 72 GLY HA2 H 72 3.800 3.907 -0.107 1
1 817 . 20 1 1 A 72 72 GLY HA3 H 72 3.769 3.914 -0.145 1
1 818 . 20 1 1 A 72 72 GLY C C 72 174.231 173.863 0.368 1
1 819 . 20 1 1 A 72 72 GLY CA C 72 47.866 46.420 1.446 1
1 820 . 20 1 1 A 72 72 GLY N N 72 114.881 111.806 3.075 1
1 821 . 20 1 1 A 73 73 THR H H 73 8.162 7.550 0.612 1
1 822 . 20 1 1 A 73 73 THR HA H 73 4.584 4.807 -0.223 1
1 827 . 20 1 1 A 73 73 THR C C 73 172.208 173.417 -1.209 1
1 828 . 20 1 1 A 73 73 THR CA C 73 62.307 61.254 1.053 1
1 829 . 20 1 1 A 73 73 THR CB C 73 72.123 72.079 0.044 1
1 831 . 20 1 1 A 73 73 THR N N 73 114.225 114.238 -0.013 1
1 832 . 20 1 1 A 74 74 THR H H 74 8.743 8.859 -0.116 1
1 833 . 20 1 1 A 74 74 THR HA H 74 5.138 5.048 0.090 1
1 838 . 20 1 1 A 74 74 THR C C 74 173.376 173.405 -0.029 1
1 839 . 20 1 1 A 74 74 THR CA C 74 62.724 62.850 -0.126 1
1 840 . 20 1 1 A 74 74 THR CB C 74 69.202 69.756 -0.554 1
1 842 . 20 1 1 A 74 74 THR N N 74 123.376 121.608 1.768 1
1 843 . 20 1 1 A 75 75 TYR H H 75 9.549 9.366 0.183 1
1 844 . 20 1 1 A 75 75 TYR HA H 75 4.892 5.240 -0.348 1
1 851 . 20 1 1 A 75 75 TYR C C 75 173.991 175.357 -1.366 1
1 852 . 20 1 1 A 75 75 TYR CA C 75 57.740 56.139 1.601 1
1 853 . 20 1 1 A 75 75 TYR CB C 75 44.580 42.833 1.747 1
1 858 . 20 1 1 A 75 75 TYR N N 75 126.916 125.842 1.074 1
1 859 . 20 1 1 A 76 76 ILE H H 76 8.769 8.800 -0.031 1
1 860 . 20 1 1 A 76 76 ILE HA H 76 4.663 4.842 -0.179 1
1 870 . 20 1 1 A 76 76 ILE C C 76 174.683 175.210 -0.527 1
1 871 . 20 1 1 A 76 76 ILE CA C 76 60.455 60.643 -0.188 1
1 872 . 20 1 1 A 76 76 ILE CB C 76 40.284 39.898 0.386 1
1 876 . 20 1 1 A 76 76 ILE N N 76 119.407 120.689 -1.282 1
1 877 . 20 1 1 A 77 77 PHE H H 77 8.894 8.909 -0.015 1
1 878 . 20 1 1 A 77 77 PHE HA H 77 5.160 5.103 0.057 1
1 886 . 20 1 1 A 77 77 PHE C C 77 174.794 175.468 -0.674 1
1 887 . 20 1 1 A 77 77 PHE CA C 77 56.831 57.453 -0.622 1
1 888 . 20 1 1 A 77 77 PHE CB C 77 43.132 40.998 2.134 1
1 894 . 20 1 1 A 77 77 PHE N N 77 124.622 127.106 -2.484 1
1 895 . 20 1 1 A 78 78 ARG H H 78 9.407 9.333 0.074 1
1 896 . 20 1 1 A 78 78 ARG HA H 78 5.689 5.646 0.043 1
1 904 . 20 1 1 A 78 78 ARG C C 78 174.376 174.422 -0.046 1
1 905 . 20 1 1 A 78 78 ARG CA C 78 54.530 54.854 -0.324 1
1 906 . 20 1 1 A 78 78 ARG CB C 78 34.473 33.242 1.231 1
1 909 . 20 1 1 A 78 78 ARG N N 78 120.055 121.391 -1.336 1
1 911 . 20 1 1 A 79 79 LEU H H 79 9.132 8.850 0.282 1
1 912 . 20 1 1 A 79 79 LEU HA H 79 5.398 5.265 0.133 1
1 922 . 20 1 1 A 79 79 LEU C C 79 174.006 174.411 -0.405 1
1 923 . 20 1 1 A 79 79 LEU CA C 79 53.401 53.196 0.205 1
1 924 . 20 1 1 A 79 79 LEU CB C 79 48.116 46.366 1.750 1
1 928 . 20 1 1 A 79 79 LEU N N 79 124.907 127.249 -2.342 1
1 929 . 20 1 1 A 80 80 ALA H H 80 8.737 7.929 0.808 1
1 930 . 20 1 1 A 80 80 ALA HA H 80 4.871 4.964 -0.093 1
1 934 . 20 1 1 A 80 80 ALA C C 80 176.057 175.716 0.341 1
1 935 . 20 1 1 A 80 80 ALA CA C 80 50.353 51.286 -0.933 1
1 936 . 20 1 1 A 80 80 ALA CB C 80 23.972 23.215 0.757 1
1 937 . 20 1 1 A 80 80 ALA N N 80 128.220 125.393 2.827 1
1 938 . 20 1 1 A 81 81 ALA H H 81 9.890 8.622 1.268 1
1 939 . 20 1 1 A 81 81 ALA HA H 81 4.794 5.060 -0.266 1
1 943 . 20 1 1 A 81 81 ALA C C 81 174.655 176.308 -1.653 1
1 944 . 20 1 1 A 81 81 ALA CA C 81 50.300 51.132 -0.832 1
1 945 . 20 1 1 A 81 81 ALA CB C 81 21.369 20.737 0.632 1
1 946 . 20 1 1 A 81 81 ALA N N 81 123.682 123.515 0.167 1
1 947 . 20 1 1 A 82 82 LYS H H 82 7.965 8.692 -0.727 1
1 948 . 20 1 1 A 82 82 LYS HA H 82 4.974 5.176 -0.202 1
1 957 . 20 1 1 A 82 82 LYS C C 82 175.671 175.177 0.494 1
1 958 . 20 1 1 A 82 82 LYS CA C 82 54.664 54.784 -0.120 1
1 959 . 20 1 1 A 82 82 LYS CB C 82 36.677 35.566 1.111 1
1 963 . 20 1 1 A 82 82 LYS N N 82 118.164 122.234 -4.070 1
1 964 . 20 1 1 A 83 83 ASN H H 83 8.663 8.538 0.125 1
1 965 . 20 1 1 A 83 83 ASN HA H 83 5.113 5.108 0.005 1
1 970 . 20 1 1 A 83 83 ASN C C 83 176.582 176.436 0.146 1
1 971 . 20 1 1 A 83 83 ASN CA C 83 51.746 50.702 1.044 1
1 972 . 20 1 1 A 83 83 ASN CB C 83 40.357 40.119 0.238 1
1 973 . 20 1 1 A 83 83 ASN N N 83 124.784 124.307 0.477 1
1 975 . 20 1 1 A 84 84 ARG H H 84 8.873 8.739 0.134 1
1 976 . 20 1 1 A 84 84 ARG HA H 84 3.940 3.917 0.023 1
1 983 . 20 1 1 A 84 84 ARG C C 84 176.735 178.359 -1.624 1
1 984 . 20 1 1 A 84 84 ARG CA C 84 59.327 59.692 -0.365 1
1 985 . 20 1 1 A 84 84 ARG CB C 84 29.282 29.986 -0.704 1
1 988 . 20 1 1 A 84 84 ARG N N 84 117.891 119.063 -1.172 1
1 989 . 20 1 1 A 85 85 ALA H H 85 7.645 7.831 -0.186 1
1 990 . 20 1 1 A 85 85 ALA HA H 85 4.276 4.179 0.097 1
1 994 . 20 1 1 A 85 85 ALA C C 85 177.479 177.395 0.084 1
1 995 . 20 1 1 A 85 85 ALA CA C 85 52.818 53.067 -0.249 1
1 996 . 20 1 1 A 85 85 ALA CB C 85 18.806 19.610 -0.804 1
1 997 . 20 1 1 A 85 85 ALA N N 85 120.306 120.607 -0.301 1
1 998 . 20 1 1 A 86 86 GLY H H 86 7.693 7.568 0.125 1
1 999 . 20 1 1 A 86 86 GLY HA2 H 86 4.456 4.115 0.341 1
1 1000 . 20 1 1 A 86 86 GLY HA3 H 86 3.649 4.117 -0.468 1
1 1001 . 20 1 1 A 86 86 GLY C C 86 172.068 172.392 -0.324 1
1 1002 . 20 1 1 A 86 86 GLY CA C 86 44.375 44.140 0.235 1
1 1003 . 20 1 1 A 86 86 GLY N N 86 106.594 103.868 2.726 1
1 1004 . 20 1 1 A 87 87 LEU H H 87 8.203 8.473 -0.270 1
1 1005 . 20 1 1 A 87 87 LEU HA H 87 4.629 4.717 -0.088 1
1 1015 . 20 1 1 A 87 87 LEU C C 87 179.155 176.547 2.608 1
1 1016 . 20 1 1 A 87 87 LEU CA C 87 54.814 55.538 -0.724 1
1 1017 . 20 1 1 A 87 87 LEU CB C 87 43.454 42.516 0.938 1
1 1021 . 20 1 1 A 87 87 LEU N N 87 120.879 122.317 -1.438 1
1 1022 . 20 1 1 A 88 88 GLY H H 88 8.492 8.344 0.148 1
1 1023 . 20 1 1 A 88 88 GLY HA2 H 88 4.339 4.204 0.135 1
1 1024 . 20 1 1 A 88 88 GLY HA3 H 88 4.122 4.212 -0.090 1
1 1025 . 20 1 1 A 88 88 GLY C C 88 173.030 173.370 -0.340 1
1 1026 . 20 1 1 A 88 88 GLY CA C 88 43.970 44.600 -0.630 1
1 1027 . 20 1 1 A 88 88 GLY N N 88 109.903 110.115 -0.212 1
1 1028 . 20 1 1 A 89 89 GLU H H 89 7.638 9.052 -1.414 1
1 1029 . 20 1 1 A 89 89 GLU HA H 89 4.103 4.305 -0.202 1
1 1034 . 20 1 1 A 89 89 GLU C C 89 177.511 175.509 2.002 1
1 1035 . 20 1 1 A 89 89 GLU CA C 89 56.659 56.899 -0.240 1
1 1036 . 20 1 1 A 89 89 GLU CB C 89 31.324 30.829 0.495 1
1 1038 . 20 1 1 A 89 89 GLU N N 89 117.551 121.527 -3.976 1
1 1039 . 20 1 1 A 90 90 GLU H H 90 8.734 8.957 -0.223 1
1 1040 . 20 1 1 A 90 90 GLU HA H 90 4.651 5.353 -0.702 1
1 1045 . 20 1 1 A 90 90 GLU C C 90 177.452 174.867 2.585 1
1 1046 . 20 1 1 A 90 90 GLU CA C 90 55.987 54.780 1.207 1
1 1047 . 20 1 1 A 90 90 GLU CB C 90 31.135 33.641 -2.506 1
1 1049 . 20 1 1 A 90 90 GLU N N 90 121.553 119.416 2.137 1
1 1050 . 20 1 1 A 91 91 PHE H H 91 9.411 9.256 0.155 1
1 1051 . 20 1 1 A 91 91 PHE HA H 91 4.665 4.922 -0.257 1
1 1059 . 20 1 1 A 91 91 PHE C C 91 173.944 174.586 -0.642 1
1 1060 . 20 1 1 A 91 91 PHE CA C 91 57.687 58.395 -0.708 1
1 1061 . 20 1 1 A 91 91 PHE CB C 91 40.890 40.731 0.159 1
1 1067 . 20 1 1 A 91 91 PHE N N 91 125.459 125.650 -0.191 1
1 1068 . 20 1 1 A 92 92 GLU H H 92 8.043 8.227 -0.184 1
1 1069 . 20 1 1 A 92 92 GLU HA H 92 5.424 5.245 0.179 1
1 1074 . 20 1 1 A 92 92 GLU C C 92 174.295 174.528 -0.233 1
1 1075 . 20 1 1 A 92 92 GLU CA C 92 54.378 54.673 -0.295 1
1 1076 . 20 1 1 A 92 92 GLU CB C 92 33.662 32.990 0.672 1
1 1078 . 20 1 1 A 92 92 GLU N N 92 128.905 127.307 1.598 1
1 1079 . 20 1 1 A 93 93 LYS H H 93 9.142 8.707 0.435 1
1 1080 . 20 1 1 A 93 93 LYS HA H 93 4.541 5.236 -0.695 1
1 1089 . 20 1 1 A 93 93 LYS C C 93 173.366 173.980 -0.614 1
1 1090 . 20 1 1 A 93 93 LYS CA C 93 55.343 55.065 0.278 1
1 1091 . 20 1 1 A 93 93 LYS CB C 93 37.317 36.081 1.236 1
1 1095 . 20 1 1 A 93 93 LYS N N 93 125.231 127.331 -2.100 1
1 1096 . 20 1 1 A 94 94 GLU H H 94 8.655 9.209 -0.554 1
1 1097 . 20 1 1 A 94 94 GLU HA H 94 5.558 5.335 0.223 1
1 1102 . 20 1 1 A 94 94 GLU C C 94 176.238 175.544 0.694 1
1 1103 . 20 1 1 A 94 94 GLU CA C 94 54.632 55.086 -0.454 1
1 1104 . 20 1 1 A 94 94 GLU CB C 94 32.166 32.938 -0.772 1
1 1106 . 20 1 1 A 94 94 GLU N N 94 127.232 127.305 -0.073 1
1 1107 . 20 1 1 A 95 95 ILE H H 95 9.302 8.907 0.395 1
1 1108 . 20 1 1 A 95 95 ILE HA H 95 4.794 5.324 -0.530 1
1 1118 . 20 1 1 A 95 95 ILE C C 95 173.138 174.195 -1.057 1
1 1119 . 20 1 1 A 95 95 ILE CA C 95 58.570 58.501 0.069 1
1 1120 . 20 1 1 A 95 95 ILE CB C 95 42.420 42.558 -0.138 1
1 1124 . 20 1 1 A 95 95 ILE N N 95 120.711 121.422 -0.711 1
1 1125 . 20 1 1 A 96 96 ARG H H 96 8.589 8.778 -0.189 1
1 1126 . 20 1 1 A 96 96 ARG HA H 96 5.373 4.813 0.560 1
1 1133 . 20 1 1 A 96 96 ARG C C 96 177.147 174.937 2.210 1
1 1134 . 20 1 1 A 96 96 ARG CA C 96 54.045 55.013 -0.968 1
1 1135 . 20 1 1 A 96 96 ARG CB C 96 32.001 34.056 -2.055 1
1 1138 . 20 1 1 A 96 96 ARG N N 96 124.445 121.766 2.679 1
1 1139 . 20 1 1 A 97 97 THR H H 97 9.243 8.548 0.695 1
1 1140 . 20 1 1 A 97 97 THR HA H 97 4.459 4.577 -0.118 1
1 1145 . 20 1 1 A 97 97 THR C C 97 172.745 173.808 -1.063 1
1 1146 . 20 1 1 A 97 97 THR CA C 97 59.637 60.552 -0.915 1
1 1147 . 20 1 1 A 97 97 THR CB C 97 67.687 69.190 -1.503 1
1 1149 . 20 1 1 A 97 97 THR N N 97 119.370 118.819 0.551 1
1 1150 . 20 1 1 A 98 98 PRO HA H 98 4.494 4.711 -0.217 1
1 1157 . 20 1 1 A 98 98 PRO CA C 98 63.117 62.738 0.379 1
1 1158 . 20 1 1 A 98 98 PRO CB C 98 32.500 31.706 0.794 1
1 1161 . 20 1 1 A 99 99 GLU H H 99 8.534 8.321 0.213 1
1 1162 . 20 1 1 A 99 99 GLU HA H 99 4.195 4.434 -0.239 1
1 1167 . 20 1 1 A 99 99 GLU C C 99 175.881 175.967 -0.086 1
1 1168 . 20 1 1 A 99 99 GLU CA C 99 56.330 56.724 -0.394 1
1 1169 . 20 1 1 A 99 99 GLU CB C 99 31.062 30.756 0.306 1
1 1171 . 20 1 1 A 99 99 GLU N N 99 119.688 122.429 -2.741 1
1 1172 . 20 1 1 A 100 100 ASP H H 100 8.536 8.615 -0.079 1
1 1173 . 20 1 1 A 100 100 ASP HA H 100 4.607 4.790 -0.183 1
1 1176 . 20 1 1 A 100 100 ASP C C 100 176.012 175.772 0.240 1
1 1177 . 20 1 1 A 100 100 ASP CA C 100 54.109 55.124 -1.015 1
1 1178 . 20 1 1 A 100 100 ASP CB C 100 41.562 43.470 -1.908 1
1 1179 . 20 1 1 A 100 100 ASP N N 100 119.803 120.656 -0.853 1
1 1180 . 20 1 1 A 101 101 LEU H H 101 8.403 7.338 1.065 1
1 1181 . 20 1 1 A 101 101 LEU HA H 101 4.426 4.298 0.128 1
1 1191 . 20 1 1 A 101 101 LEU C C 101 177.534 176.063 1.471 1
1 1192 . 20 1 1 A 101 101 LEU CA C 101 55.113 55.120 -0.007 1
1 1193 . 20 1 1 A 101 101 LEU CB C 101 42.156 42.563 -0.407 1
1 1197 . 20 1 1 A 101 101 LEU N N 101 123.876 117.919 5.957 1
1 1198 . 20 1 1 A 102 102 SER H H 102 8.413 8.673 -0.260 1
1 1199 . 20 1 1 A 102 102 SER HA H 102 4.434 4.805 -0.371 1
1 1202 . 20 1 1 A 102 102 SER C C 102 174.674 173.270 1.404 1
1 1203 . 20 1 1 A 102 102 SER CA C 102 58.798 57.791 1.007 1
1 1204 . 20 1 1 A 102 102 SER CB C 102 63.854 66.180 -2.326 1
1 1205 . 20 1 1 A 102 102 SER N N 102 116.667 117.802 -1.135 1
1 1206 . 20 1 1 A 103 103 GLY H H 103 8.213 8.430 -0.217 1
1 1207 . 20 1 1 A 103 103 GLY HA2 H 103 4.164 4.121 0.043 1
1 1208 . 20 1 1 A 103 103 GLY HA3 H 103 4.057 4.121 -0.064 1
1 1209 . 20 1 1 A 103 103 GLY C C 103 171.822 173.552 -1.730 1
1 1210 . 20 1 1 A 103 103 GLY CA C 103 44.658 44.907 -0.249 1
1 1211 . 20 1 1 A 103 103 GLY N N 103 110.592 113.466 -2.874 1
1 1212 . 20 1 1 A 104 104 PRO HA H 104 4.475 4.314 0.161 1
1 1219 . 20 1 1 A 104 104 PRO C C 104 177.445 177.139 0.306 1
1 1220 . 20 1 1 A 104 104 PRO CA C 104 63.312 62.984 0.328 1
1 1221 . 20 1 1 A 104 104 PRO CB C 104 32.190 32.403 -0.213 1
1 1224 . 20 1 1 A 105 105 SER H H 105 8.538 8.939 -0.401 1
1 1225 . 20 1 1 A 105 105 SER HA H 105 4.541 4.076 0.465 1
1 1228 . 20 1 1 A 105 105 SER C C 105 174.616 173.008 1.608 1
1 1229 . 20 1 1 A 105 105 SER CA C 105 58.270 59.352 -1.082 1
1 1230 . 20 1 1 A 105 105 SER CB C 105 63.895 61.934 1.961 1
1 1231 . 20 1 1 A 105 105 SER N N 105 116.446 117.664 -1.218 1
1 1232 . 20 1 1 A 106 106 SER H H 106 8.350 7.456 0.894 1
1 1233 . 20 1 1 A 106 106 SER HA H 106 4.541 5.214 -0.673 1
1 1236 . 20 1 1 A 106 106 SER C C 106 174.530 173.237 1.293 1
1 1237 . 20 1 1 A 106 106 SER CA C 106 58.357 57.331 1.026 1
1 1238 . 20 1 1 A 106 106 SER CB C 106 64.020 67.757 -3.737 1
1 1239 . 20 1 1 A 106 106 SER N N 106 117.448 115.113 2.335 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 1.079 1
2 1 1 1 "RMS(OBS, PRED)" CA 103 0.860 1
3 1 1 1 "RMS(OBS, PRED)" CB 92 1.243 1
4 1 1 1 "RMS(OBS, PRED)" H 93 0.562 1
5 1 1 1 "RMS(OBS, PRED)" HA 110 0.325 1
6 1 1 1 "RMS(OBS, PRED)" N 93 2.840 1
7 1 2 1 "RMS(OBS, PRED)" C 97 1.232 1
8 1 2 1 "RMS(OBS, PRED)" CA 103 0.918 1
9 1 2 1 "RMS(OBS, PRED)" CB 92 1.258 1
10 1 2 1 "RMS(OBS, PRED)" H 93 0.558 1
11 1 2 1 "RMS(OBS, PRED)" HA 110 0.327 1
12 1 2 1 "RMS(OBS, PRED)" N 93 2.949 1
13 1 3 1 "RMS(OBS, PRED)" C 97 1.135 1
14 1 3 1 "RMS(OBS, PRED)" CA 103 0.928 1
15 1 3 1 "RMS(OBS, PRED)" CB 92 1.249 1
16 1 3 1 "RMS(OBS, PRED)" H 93 0.579 1
17 1 3 1 "RMS(OBS, PRED)" HA 110 0.325 1
18 1 3 1 "RMS(OBS, PRED)" N 93 2.820 1
19 1 4 1 "RMS(OBS, PRED)" C 97 1.149 1
20 1 4 1 "RMS(OBS, PRED)" CA 103 1.045 1
21 1 4 1 "RMS(OBS, PRED)" CB 92 1.159 1
22 1 4 1 "RMS(OBS, PRED)" H 93 0.574 1
23 1 4 1 "RMS(OBS, PRED)" HA 110 0.316 1
24 1 4 1 "RMS(OBS, PRED)" N 93 2.791 1
25 1 5 1 "RMS(OBS, PRED)" C 97 1.233 1
26 1 5 1 "RMS(OBS, PRED)" CA 103 1.026 1
27 1 5 1 "RMS(OBS, PRED)" CB 92 1.212 1
28 1 5 1 "RMS(OBS, PRED)" H 93 0.560 1
29 1 5 1 "RMS(OBS, PRED)" HA 110 0.335 1
30 1 5 1 "RMS(OBS, PRED)" N 93 2.995 1
31 1 6 1 "RMS(OBS, PRED)" C 97 1.274 1
32 1 6 1 "RMS(OBS, PRED)" CA 103 0.907 1
33 1 6 1 "RMS(OBS, PRED)" CB 92 1.204 1
34 1 6 1 "RMS(OBS, PRED)" H 93 0.555 1
35 1 6 1 "RMS(OBS, PRED)" HA 110 0.338 1
36 1 6 1 "RMS(OBS, PRED)" N 93 2.846 1
37 1 7 1 "RMS(OBS, PRED)" C 97 1.206 1
38 1 7 1 "RMS(OBS, PRED)" CA 103 0.982 1
39 1 7 1 "RMS(OBS, PRED)" CB 92 1.204 1
40 1 7 1 "RMS(OBS, PRED)" H 93 0.563 1
41 1 7 1 "RMS(OBS, PRED)" HA 110 0.329 1
42 1 7 1 "RMS(OBS, PRED)" N 93 2.845 1
43 1 8 1 "RMS(OBS, PRED)" C 97 1.196 1
44 1 8 1 "RMS(OBS, PRED)" CA 103 1.044 1
45 1 8 1 "RMS(OBS, PRED)" CB 92 1.248 1
46 1 8 1 "RMS(OBS, PRED)" H 93 0.568 1
47 1 8 1 "RMS(OBS, PRED)" HA 110 0.336 1
48 1 8 1 "RMS(OBS, PRED)" N 93 2.953 1
49 1 9 1 "RMS(OBS, PRED)" C 97 1.139 1
50 1 9 1 "RMS(OBS, PRED)" CA 103 0.983 1
51 1 9 1 "RMS(OBS, PRED)" CB 92 1.258 1
52 1 9 1 "RMS(OBS, PRED)" H 93 0.585 1
53 1 9 1 "RMS(OBS, PRED)" HA 110 0.331 1
54 1 9 1 "RMS(OBS, PRED)" N 93 2.866 1
55 1 10 1 "RMS(OBS, PRED)" C 97 1.174 1
56 1 10 1 "RMS(OBS, PRED)" CA 103 1.024 1
57 1 10 1 "RMS(OBS, PRED)" CB 92 1.222 1
58 1 10 1 "RMS(OBS, PRED)" H 93 0.554 1
59 1 10 1 "RMS(OBS, PRED)" HA 110 0.337 1
60 1 10 1 "RMS(OBS, PRED)" N 93 2.771 1
61 1 11 1 "RMS(OBS, PRED)" C 97 1.166 1
62 1 11 1 "RMS(OBS, PRED)" CA 103 0.918 1
63 1 11 1 "RMS(OBS, PRED)" CB 92 1.225 1
64 1 11 1 "RMS(OBS, PRED)" H 93 0.553 1
65 1 11 1 "RMS(OBS, PRED)" HA 110 0.334 1
66 1 11 1 "RMS(OBS, PRED)" N 93 2.764 1
67 1 12 1 "RMS(OBS, PRED)" C 97 1.288 1
68 1 12 1 "RMS(OBS, PRED)" CA 103 0.934 1
69 1 12 1 "RMS(OBS, PRED)" CB 92 1.332 1
70 1 12 1 "RMS(OBS, PRED)" H 93 0.550 1
71 1 12 1 "RMS(OBS, PRED)" HA 110 0.349 1
72 1 12 1 "RMS(OBS, PRED)" N 93 2.792 1
73 1 13 1 "RMS(OBS, PRED)" C 97 1.159 1
74 1 13 1 "RMS(OBS, PRED)" CA 103 0.935 1
75 1 13 1 "RMS(OBS, PRED)" CB 92 1.180 1
76 1 13 1 "RMS(OBS, PRED)" H 93 0.593 1
77 1 13 1 "RMS(OBS, PRED)" HA 110 0.349 1
78 1 13 1 "RMS(OBS, PRED)" N 93 2.765 1
79 1 14 1 "RMS(OBS, PRED)" C 97 1.257 1
80 1 14 1 "RMS(OBS, PRED)" CA 103 0.907 1
81 1 14 1 "RMS(OBS, PRED)" CB 92 1.290 1
82 1 14 1 "RMS(OBS, PRED)" H 93 0.553 1
83 1 14 1 "RMS(OBS, PRED)" HA 110 0.360 1
84 1 14 1 "RMS(OBS, PRED)" N 93 2.807 1
85 1 15 1 "RMS(OBS, PRED)" C 97 1.281 1
86 1 15 1 "RMS(OBS, PRED)" CA 103 0.930 1
87 1 15 1 "RMS(OBS, PRED)" CB 92 1.272 1
88 1 15 1 "RMS(OBS, PRED)" H 93 0.560 1
89 1 15 1 "RMS(OBS, PRED)" HA 110 0.319 1
90 1 15 1 "RMS(OBS, PRED)" N 93 2.838 1
91 1 16 1 "RMS(OBS, PRED)" C 97 1.139 1
92 1 16 1 "RMS(OBS, PRED)" CA 103 0.890 1
93 1 16 1 "RMS(OBS, PRED)" CB 92 1.304 1
94 1 16 1 "RMS(OBS, PRED)" H 93 0.582 1
95 1 16 1 "RMS(OBS, PRED)" HA 110 0.335 1
96 1 16 1 "RMS(OBS, PRED)" N 93 2.864 1
97 1 17 1 "RMS(OBS, PRED)" C 97 1.176 1
98 1 17 1 "RMS(OBS, PRED)" CA 103 0.946 1
99 1 17 1 "RMS(OBS, PRED)" CB 92 1.291 1
100 1 17 1 "RMS(OBS, PRED)" H 93 0.567 1
101 1 17 1 "RMS(OBS, PRED)" HA 110 0.332 1
102 1 17 1 "RMS(OBS, PRED)" N 93 2.753 1
103 1 18 1 "RMS(OBS, PRED)" C 97 1.224 1
104 1 18 1 "RMS(OBS, PRED)" CA 103 0.913 1
105 1 18 1 "RMS(OBS, PRED)" CB 92 1.296 1
106 1 18 1 "RMS(OBS, PRED)" H 93 0.569 1
107 1 18 1 "RMS(OBS, PRED)" HA 110 0.336 1
108 1 18 1 "RMS(OBS, PRED)" N 93 2.745 1
109 1 19 1 "RMS(OBS, PRED)" C 97 1.185 1
110 1 19 1 "RMS(OBS, PRED)" CA 103 1.089 1
111 1 19 1 "RMS(OBS, PRED)" CB 92 1.204 1
112 1 19 1 "RMS(OBS, PRED)" H 93 0.567 1
113 1 19 1 "RMS(OBS, PRED)" HA 110 0.318 1
114 1 19 1 "RMS(OBS, PRED)" N 93 2.985 1
115 1 20 1 "RMS(OBS, PRED)" C 97 1.118 1
116 1 20 1 "RMS(OBS, PRED)" CA 103 0.992 1
117 1 20 1 "RMS(OBS, PRED)" CB 92 1.318 1
118 1 20 1 "RMS(OBS, PRED)" H 93 0.559 1
119 1 20 1 "RMS(OBS, PRED)" HA 110 0.324 1
120 1 20 1 "RMS(OBS, PRED)" N 93 2.951 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 2 2 SER C C 2 174.723 174.175 0.548 2
1 2 . 1 1 A 2 2 SER CA C 2 58.446 58.839 -0.393 2
1 3 . 1 1 A 2 2 SER CB C 2 63.566 63.794 -0.228 2
1 4 . 1 1 A 3 3 SER H H 3 8.350 8.458 -0.108 2
1 5 . 1 1 A 3 3 SER C C 3 173.961 174.412 -0.451 2
1 6 . 1 1 A 3 3 SER CA C 3 58.428 58.262 0.166 2
1 7 . 1 1 A 3 3 SER CB C 3 63.937 64.262 -0.325 2
1 8 . 1 1 A 3 3 SER N N 3 117.923 118.193 -0.270 2
1 9 . 1 1 A 4 4 GLY H H 4 8.050 8.351 -0.301 2
1 10 . 1 1 A 4 4 GLY C C 4 179.009 173.513 5.496 2
1 11 . 1 1 A 4 4 GLY CA C 4 46.174 45.683 0.491 2
1 12 . 1 1 A 4 4 GLY N N 4 116.890 111.026 5.864 2
1 13 . 1 1 A 7 7 GLY HA2 H 7 4.340 4.212 0.128 2
1 14 . 1 1 A 7 7 GLY HA3 H 7 3.629 4.213 -0.584 2
1 15 . 1 1 A 7 7 GLY CA C 7 44.381 44.637 -0.256 2
1 16 . 1 1 A 8 8 PRO HA H 8 4.476 4.526 -0.050 2
1 23 . 1 1 A 8 8 PRO C C 8 176.235 177.245 -1.010 2
1 24 . 1 1 A 8 8 PRO CA C 8 62.995 62.620 0.375 2
1 25 . 1 1 A 8 8 PRO CB C 8 33.266 32.495 0.771 2
1 28 . 1 1 A 9 9 GLY H H 9 8.585 8.429 0.156 2
1 29 . 1 1 A 9 9 GLY HA2 H 9 4.326 4.107 0.219 2
1 30 . 1 1 A 9 9 GLY HA3 H 9 4.009 4.113 -0.104 2
1 31 . 1 1 A 9 9 GLY C C 9 172.998 173.172 -0.174 2
1 32 . 1 1 A 9 9 GLY CA C 9 44.393 44.267 0.127 2
1 33 . 1 1 A 9 9 GLY N N 9 106.004 107.720 -1.716 2
1 34 . 1 1 A 10 10 ARG H H 10 8.548 8.384 0.164 2
1 35 . 1 1 A 10 10 ARG HA H 10 4.654 4.844 -0.190 2
1 41 . 1 1 A 10 10 ARG C C 10 175.780 174.847 0.933 2
1 42 . 1 1 A 10 10 ARG CA C 10 54.708 54.328 0.380 2
1 43 . 1 1 A 10 10 ARG CB C 10 31.448 31.266 0.182 2
1 45 . 1 1 A 10 10 ARG N N 10 119.407 118.838 0.569 2
1 46 . 1 1 A 11 11 PRO HA H 11 4.611 4.572 0.039 2
1 53 . 1 1 A 11 11 PRO C C 11 173.510 175.577 -2.067 2
1 54 . 1 1 A 11 11 PRO CA C 11 62.360 62.654 -0.294 2
1 55 . 1 1 A 11 11 PRO CB C 11 33.402 32.226 1.176 2
1 58 . 1 1 A 12 12 THR H H 12 7.572 8.274 -0.702 2
1 59 . 1 1 A 12 12 THR HA H 12 3.796 4.262 -0.466 2
1 64 . 1 1 A 12 12 THR C C 12 172.337 173.314 -0.977 2
1 65 . 1 1 A 12 12 THR CA C 12 61.778 61.596 0.182 2
1 66 . 1 1 A 12 12 THR CB C 12 70.561 68.638 1.923 2
1 68 . 1 1 A 12 12 THR N N 12 109.653 117.315 -7.662 2
1 69 . 1 1 A 13 13 MET H H 13 5.605 8.490 -2.885 2
1 70 . 1 1 A 13 13 MET HA H 13 5.091 4.969 0.122 2
1 78 . 1 1 A 13 13 MET C C 13 172.639 174.979 -2.340 2
1 79 . 1 1 A 13 13 MET CA C 13 54.168 53.739 0.429 2
1 80 . 1 1 A 13 13 MET CB C 13 37.632 34.604 3.028 2
1 83 . 1 1 A 13 13 MET N N 13 121.634 126.904 -5.270 2
1 84 . 1 1 A 14 14 MET H H 14 9.254 9.170 0.084 2
1 85 . 1 1 A 14 14 MET HA H 14 4.662 5.164 -0.502 2
1 93 . 1 1 A 14 14 MET C C 14 174.388 174.766 -0.378 2
1 94 . 1 1 A 14 14 MET CA C 14 54.673 54.368 0.305 2
1 95 . 1 1 A 14 14 MET CB C 14 34.907 35.061 -0.154 2
1 98 . 1 1 A 14 14 MET N N 14 125.746 123.943 1.803 2
1 99 . 1 1 A 15 15 ILE H H 15 8.555 9.155 -0.600 2
1 100 . 1 1 A 15 15 ILE HA H 15 4.882 5.013 -0.131 2
1 110 . 1 1 A 15 15 ILE C C 15 174.962 174.990 -0.028 2
1 111 . 1 1 A 15 15 ILE CA C 15 60.685 60.587 0.099 2
1 112 . 1 1 A 15 15 ILE CB C 15 40.878 38.906 1.972 2
1 116 . 1 1 A 15 15 ILE N N 15 121.623 126.028 -4.405 2
1 117 . 1 1 A 16 16 SER H H 16 8.703 8.881 -0.178 2
1 118 . 1 1 A 16 16 SER HA H 16 4.922 5.071 -0.149 2
1 121 . 1 1 A 16 16 SER C C 16 173.860 173.068 0.792 2
1 122 . 1 1 A 16 16 SER CA C 16 56.524 57.197 -0.673 2
1 123 . 1 1 A 16 16 SER CB C 16 65.004 65.672 -0.668 2
1 124 . 1 1 A 16 16 SER N N 16 122.261 124.207 -1.947 2
1 125 . 1 1 A 17 17 THR H H 17 8.759 8.647 0.112 2
1 126 . 1 1 A 17 17 THR HA H 17 4.885 4.874 0.011 2
1 131 . 1 1 A 17 17 THR C C 17 175.018 174.475 0.543 2
1 132 . 1 1 A 17 17 THR CA C 17 60.315 60.850 -0.535 2
1 133 . 1 1 A 17 17 THR CB C 17 69.799 70.032 -0.233 2
1 135 . 1 1 A 17 17 THR N N 17 115.660 116.170 -0.510 2
1 136 . 1 1 A 18 18 THR H H 18 8.038 8.683 -0.645 2
1 137 . 1 1 A 18 18 THR HA H 18 4.596 4.426 0.170 2
1 142 . 1 1 A 18 18 THR CA C 18 60.707 62.635 -1.928 2
1 143 . 1 1 A 18 18 THR CB C 18 71.082 70.049 1.033 2
1 145 . 1 1 A 18 18 THR N N 18 112.362 116.252 -3.890 2
1 146 . 1 1 A 19 19 ALA H H 19 8.545 7.515 1.030 2
1 147 . 1 1 A 19 19 ALA HA H 19 4.412 4.410 0.002 2
1 151 . 1 1 A 19 19 ALA C C 19 177.034 177.144 -0.110 2
1 152 . 1 1 A 19 19 ALA CA C 19 52.264 51.649 0.615 2
1 153 . 1 1 A 19 19 ALA CB C 19 19.292 20.750 -1.458 2
1 154 . 1 1 A 19 19 ALA N N 19 119.589 123.272 -3.683 2
1 155 . 1 1 A 20 20 MET H H 20 8.145 8.517 -0.372 2
1 156 . 1 1 A 20 20 MET HA H 20 4.447 4.343 0.104 2
1 164 . 1 1 A 20 20 MET C C 20 175.676 176.487 -0.811 2
1 165 . 1 1 A 20 20 MET CA C 20 55.764 55.113 0.651 2
1 166 . 1 1 A 20 20 MET CB C 20 31.495 32.281 -0.786 2
1 169 . 1 1 A 20 20 MET N N 20 116.950 118.736 -1.786 2
1 170 . 1 1 A 21 21 ASN H H 21 8.275 8.940 -0.665 2
1 171 . 1 1 A 21 21 ASN HA H 21 4.452 4.342 0.110 2
1 176 . 1 1 A 21 21 ASN C C 21 174.100 173.796 0.304 2
1 177 . 1 1 A 21 21 ASN CA C 21 54.320 54.505 -0.185 2
1 178 . 1 1 A 21 21 ASN CB C 21 37.234 37.238 -0.004 2
1 179 . 1 1 A 21 21 ASN N N 21 113.198 118.510 -5.312 2
1 181 . 1 1 A 22 22 THR H H 22 7.071 7.248 -0.177 2
1 182 . 1 1 A 22 22 THR HA H 22 5.218 5.372 -0.154 2
1 187 . 1 1 A 22 22 THR C C 22 173.301 172.935 0.366 2
1 188 . 1 1 A 22 22 THR CA C 22 59.399 60.390 -0.991 2
1 189 . 1 1 A 22 22 THR CB C 22 72.714 71.805 0.909 2
1 191 . 1 1 A 22 22 THR N N 22 107.603 107.867 -0.264 2
1 192 . 1 1 A 23 23 ALA H H 23 8.687 8.805 -0.118 2
1 193 . 1 1 A 23 23 ALA HA H 23 4.925 5.063 -0.138 2
1 197 . 1 1 A 23 23 ALA C C 23 174.100 175.658 -1.558 2
1 198 . 1 1 A 23 23 ALA CA C 23 50.812 50.087 0.725 2
1 199 . 1 1 A 23 23 ALA CB C 23 21.122 21.215 -0.093 2
1 200 . 1 1 A 23 23 ALA N N 23 121.937 126.271 -4.334 2
1 201 . 1 1 A 24 24 LEU H H 24 8.833 8.972 -0.139 2
1 202 . 1 1 A 24 24 LEU HA H 24 4.673 4.544 0.129 2
1 212 . 1 1 A 24 24 LEU C C 24 175.140 174.633 0.507 2
1 213 . 1 1 A 24 24 LEU CA C 24 54.320 54.839 -0.519 2
1 214 . 1 1 A 24 24 LEU CB C 24 42.518 43.125 -0.607 2
1 218 . 1 1 A 24 24 LEU N N 24 123.721 126.451 -2.730 2
1 219 . 1 1 A 25 25 LEU H H 25 9.176 8.961 0.215 2
1 220 . 1 1 A 25 25 LEU HA H 25 5.112 5.027 0.085 2
1 230 . 1 1 A 25 25 LEU C C 25 176.414 175.876 0.538 2
1 231 . 1 1 A 25 25 LEU CA C 25 54.108 53.183 0.925 2
1 232 . 1 1 A 25 25 LEU CB C 25 43.230 43.343 -0.113 2
1 236 . 1 1 A 25 25 LEU N N 25 128.589 128.572 0.017 2
1 237 . 1 1 A 26 26 GLN H H 26 8.556 8.606 -0.050 2
1 238 . 1 1 A 26 26 GLN HA H 26 4.737 4.897 -0.160 2
1 245 . 1 1 A 26 26 GLN C C 26 174.372 174.276 0.096 2
1 246 . 1 1 A 26 26 GLN CA C 26 56.365 54.447 1.918 2
1 247 . 1 1 A 26 26 GLN CB C 26 33.320 31.820 1.500 2
1 249 . 1 1 A 26 26 GLN N N 26 119.630 122.924 -3.294 2
1 251 . 1 1 A 27 27 TRP H H 27 8.080 8.185 -0.105 2
1 252 . 1 1 A 27 27 TRP HA H 27 5.441 5.871 -0.430 2
1 261 . 1 1 A 27 27 TRP CA C 27 55.957 54.522 1.435 2
1 262 . 1 1 A 27 27 TRP CB C 27 32.517 32.315 0.202 2
1 268 . 1 1 A 27 27 TRP N N 27 121.276 121.690 -0.414 2
1 270 . 1 1 A 28 28 HIS H H 28 8.262 8.639 -0.377 2
1 271 . 1 1 A 28 28 HIS HA H 28 4.997 5.101 -0.104 2
1 275 . 1 1 A 28 28 HIS CA C 28 53.028 53.852 -0.824 2
1 276 . 1 1 A 28 28 HIS CB C 28 32.832 32.797 0.035 2
1 278 . 1 1 A 28 28 HIS N N 28 116.245 116.960 -0.715 2
1 279 . 1 1 A 29 29 PRO HA H 29 4.984 4.662 0.322 2
1 286 . 1 1 A 29 29 PRO CA C 29 61.498 62.098 -0.600 2
1 287 . 1 1 A 29 29 PRO CB C 29 30.709 32.318 -1.609 2
1 290 . 1 1 A 30 30 PRO HA H 30 4.449 4.670 -0.221 2
1 297 . 1 1 A 30 30 PRO C C 30 175.733 176.609 -0.876 2
1 298 . 1 1 A 30 30 PRO CA C 30 62.245 62.573 -0.328 2
1 299 . 1 1 A 30 30 PRO CB C 30 32.083 33.231 -1.148 2
1 302 . 1 1 A 31 31 LYS H H 31 8.403 8.754 -0.351 2
1 303 . 1 1 A 31 31 LYS HA H 31 4.084 4.453 -0.369 2
1 312 . 1 1 A 31 31 LYS C C 31 177.166 177.954 -0.788 2
1 313 . 1 1 A 31 31 LYS CA C 31 57.866 57.350 0.516 2
1 314 . 1 1 A 31 31 LYS CB C 31 32.698 33.735 -1.037 2
1 318 . 1 1 A 31 31 LYS N N 31 121.693 120.823 0.870 2
1 319 . 1 1 A 32 32 GLU H H 32 8.102 7.805 0.297 2
1 320 . 1 1 A 32 32 GLU HA H 32 4.365 4.476 -0.111 2
1 325 . 1 1 A 32 32 GLU C C 32 174.248 176.043 -1.795 2
1 326 . 1 1 A 32 32 GLU CA C 32 55.448 55.964 -0.516 2
1 327 . 1 1 A 32 32 GLU CB C 32 29.405 30.086 -0.681 2
1 329 . 1 1 A 32 32 GLU N N 32 118.742 116.972 1.770 2
1 330 . 1 1 A 33 33 LEU H H 33 8.420 7.515 0.905 2
1 331 . 1 1 A 33 33 LEU HA H 33 4.499 4.689 -0.191 2
1 341 . 1 1 A 33 33 LEU C C 33 173.036 174.966 -1.930 2
1 342 . 1 1 A 33 33 LEU CA C 33 52.863 52.108 0.755 2
1 343 . 1 1 A 33 33 LEU CB C 33 42.535 43.215 -0.680 2
1 347 . 1 1 A 33 33 LEU N N 33 125.181 123.606 1.575 2
1 348 . 1 1 A 34 34 PRO HA H 34 4.488 4.470 0.018 2
1 355 . 1 1 A 34 34 PRO C C 34 177.544 176.833 0.711 2
1 356 . 1 1 A 34 34 PRO CA C 34 62.889 63.233 -0.344 2
1 357 . 1 1 A 34 34 PRO CB C 34 31.472 30.921 0.551 2
1 360 . 1 1 A 35 35 GLY H H 35 8.397 8.187 0.210 2
1 361 . 1 1 A 35 35 GLY HA2 H 35 4.059 4.120 -0.061 2
1 362 . 1 1 A 35 35 GLY HA3 H 35 3.716 4.120 -0.404 2
1 363 . 1 1 A 35 35 GLY C C 35 173.356 171.986 1.370 2
1 364 . 1 1 A 35 35 GLY CA C 35 45.892 44.830 1.062 2
1 365 . 1 1 A 35 35 GLY N N 35 110.524 112.161 -1.637 2
1 366 . 1 1 A 36 36 GLU H H 36 8.091 8.576 -0.485 2
1 367 . 1 1 A 36 36 GLU HA H 36 4.371 5.098 -0.727 2
1 372 . 1 1 A 36 36 GLU C C 36 174.864 174.683 0.181 2
1 373 . 1 1 A 36 36 GLU CA C 36 55.201 54.690 0.511 2
1 374 . 1 1 A 36 36 GLU CB C 36 31.878 33.249 -1.371 2
1 376 . 1 1 A 36 36 GLU N N 36 122.202 121.223 0.979 2
1 377 . 1 1 A 37 37 LEU H H 37 8.307 8.684 -0.377 2
1 378 . 1 1 A 37 37 LEU HA H 37 4.288 4.300 -0.012 2
1 388 . 1 1 A 37 37 LEU C C 37 176.702 176.000 0.702 2
1 389 . 1 1 A 37 37 LEU CA C 37 55.342 56.219 -0.877 2
1 390 . 1 1 A 37 37 LEU CB C 37 42.715 42.311 0.404 2
1 394 . 1 1 A 37 37 LEU N N 37 123.204 125.580 -2.376 2
1 395 . 1 1 A 38 38 LEU H H 38 8.909 8.712 0.197 2
1 396 . 1 1 A 38 38 LEU HA H 38 4.640 4.688 -0.048 2
1 406 . 1 1 A 38 38 LEU C C 38 177.202 176.574 0.628 2
1 407 . 1 1 A 38 38 LEU CA C 38 54.390 54.904 -0.514 2
1 408 . 1 1 A 38 38 LEU CB C 38 43.770 43.535 0.235 2
1 412 . 1 1 A 38 38 LEU N N 38 123.021 127.134 -4.113 2
1 413 . 1 1 A 39 39 GLY H H 39 7.113 6.943 0.170 2
1 414 . 1 1 A 39 39 GLY HA2 H 39 4.816 3.572 1.244 2
1 415 . 1 1 A 39 39 GLY HA3 H 39 3.276 3.915 -0.639 2
1 416 . 1 1 A 39 39 GLY C C 39 169.863 170.372 -0.509 2
1 417 . 1 1 A 39 39 GLY CA C 39 44.622 45.407 -0.785 2
1 418 . 1 1 A 39 39 GLY N N 39 104.137 104.349 -0.212 2
1 419 . 1 1 A 40 40 TYR H H 40 8.318 8.901 -0.583 2
1 420 . 1 1 A 40 40 TYR HA H 40 5.414 5.134 0.280 2
1 425 . 1 1 A 40 40 TYR C C 40 174.448 172.159 2.289 2
1 426 . 1 1 A 40 40 TYR CA C 40 56.178 56.509 -0.331 2
1 427 . 1 1 A 40 40 TYR CB C 40 44.191 40.656 3.535 2
1 430 . 1 1 A 40 40 TYR N N 40 114.036 115.431 -1.395 2
1 431 . 1 1 A 41 41 ARG H H 41 9.347 8.730 0.617 2
1 432 . 1 1 A 41 41 ARG HA H 41 5.092 5.420 -0.328 2
1 440 . 1 1 A 41 41 ARG C C 41 174.097 174.129 -0.032 2
1 441 . 1 1 A 41 41 ARG CA C 41 56.100 54.282 1.818 2
1 442 . 1 1 A 41 41 ARG CB C 41 34.508 32.963 1.545 2
1 445 . 1 1 A 41 41 ARG N N 41 122.231 121.148 1.083 2
1 447 . 1 1 A 42 42 LEU H H 42 9.546 9.120 0.426 2
1 448 . 1 1 A 42 42 LEU HA H 42 5.459 5.239 0.220 2
1 458 . 1 1 A 42 42 LEU C C 42 174.913 174.719 0.194 2
1 459 . 1 1 A 42 42 LEU CA C 42 52.997 53.426 -0.429 2
1 460 . 1 1 A 42 42 LEU CB C 42 46.413 45.727 0.686 2
1 464 . 1 1 A 42 42 LEU N N 42 132.335 127.406 4.929 2
1 465 . 1 1 A 43 43 GLN H H 43 9.502 9.270 0.232 2
1 466 . 1 1 A 43 43 GLN HA H 43 5.847 5.319 0.528 2
1 473 . 1 1 A 43 43 GLN C C 43 175.329 174.050 1.279 2
1 474 . 1 1 A 43 43 GLN CA C 43 54.005 54.466 -0.461 2
1 475 . 1 1 A 43 43 GLN CB C 43 33.429 31.654 1.775 2
1 477 . 1 1 A 43 43 GLN N N 43 123.932 125.415 -1.483 2
1 479 . 1 1 A 44 44 TYR H H 44 8.615 8.425 0.190 2
1 480 . 1 1 A 44 44 TYR HA H 44 5.783 5.704 0.079 2
1 487 . 1 1 A 44 44 TYR C C 44 174.058 173.499 0.559 2
1 488 . 1 1 A 44 44 TYR CA C 44 55.942 56.073 -0.131 2
1 489 . 1 1 A 44 44 TYR CB C 44 43.052 41.535 1.517 2
1 494 . 1 1 A 44 44 TYR N N 44 117.355 119.683 -2.328 2
1 495 . 1 1 A 45 45 CYS H H 45 8.377 8.282 0.095 2
1 496 . 1 1 A 45 45 CYS HA H 45 4.772 5.085 -0.313 2
1 499 . 1 1 A 45 45 CYS C C 45 173.205 173.778 -0.573 2
1 500 . 1 1 A 45 45 CYS CA C 45 55.960 57.079 -1.119 2
1 501 . 1 1 A 45 45 CYS CB C 45 30.665 31.308 -0.643 2
1 502 . 1 1 A 45 45 CYS N N 45 115.140 118.582 -3.442 2
1 503 . 1 1 A 46 46 ARG H H 46 9.165 8.455 0.710 2
1 504 . 1 1 A 46 46 ARG HA H 46 4.068 3.757 0.311 2
1 511 . 1 1 A 46 46 ARG C C 46 178.440 177.461 0.979 2
1 512 . 1 1 A 46 46 ARG CA C 46 56.401 55.899 0.502 2
1 513 . 1 1 A 46 46 ARG CB C 46 31.878 30.815 1.063 2
1 516 . 1 1 A 46 46 ARG N N 46 121.803 121.515 0.288 2
1 517 . 1 1 A 47 47 ALA H H 47 8.273 8.290 -0.017 2
1 518 . 1 1 A 47 47 ALA HA H 47 3.891 4.104 -0.213 2
1 522 . 1 1 A 47 47 ALA C C 47 177.599 177.393 0.206 2
1 523 . 1 1 A 47 47 ALA CA C 47 54.796 53.556 1.240 2
1 524 . 1 1 A 47 47 ALA CB C 47 18.287 18.580 -0.293 2
1 525 . 1 1 A 47 47 ALA N N 47 123.895 123.919 -0.024 2
1 526 . 1 1 A 48 48 ASP H H 48 8.036 8.019 0.017 2
1 527 . 1 1 A 48 48 ASP HA H 48 4.453 4.767 -0.314 2
1 530 . 1 1 A 48 48 ASP C C 48 175.836 175.780 0.056 2
1 531 . 1 1 A 48 48 ASP CA C 48 53.368 53.436 -0.068 2
1 532 . 1 1 A 48 48 ASP CB C 48 39.964 41.635 -1.671 2
1 533 . 1 1 A 48 48 ASP N N 48 112.576 117.266 -4.690 2
1 534 . 1 1 A 49 49 GLU H H 49 7.495 7.451 0.044 2
1 535 . 1 1 A 49 49 GLU HA H 49 4.308 4.505 -0.197 2
1 540 . 1 1 A 49 49 GLU C C 49 175.756 175.770 -0.014 2
1 541 . 1 1 A 49 49 GLU CA C 49 56.224 55.208 1.016 2
1 542 . 1 1 A 49 49 GLU CB C 49 32.248 30.981 1.267 2
1 544 . 1 1 A 49 49 GLU N N 49 120.609 119.320 1.289 2
1 545 . 1 1 A 50 50 ALA H H 50 8.416 8.526 -0.110 2
1 546 . 1 1 A 50 50 ALA HA H 50 4.200 4.457 -0.257 2
1 550 . 1 1 A 50 50 ALA C C 50 177.433 176.965 0.468 2
1 551 . 1 1 A 50 50 ALA CA C 50 53.297 52.395 0.902 2
1 552 . 1 1 A 50 50 ALA CB C 50 19.474 20.465 -0.991 2
1 553 . 1 1 A 50 50 ALA N N 50 124.065 123.894 0.171 2
1 554 . 1 1 A 51 51 ARG H H 51 7.648 7.659 -0.011 2
1 555 . 1 1 A 51 51 ARG HA H 51 4.747 4.671 0.076 2
1 562 . 1 1 A 51 51 ARG C C 51 173.400 173.779 -0.379 2
1 563 . 1 1 A 51 51 ARG CA C 51 52.592 52.796 -0.204 2
1 564 . 1 1 A 51 51 ARG CB C 51 31.212 31.591 -0.379 2
1 567 . 1 1 A 51 51 ARG N N 51 117.798 117.929 -0.131 2
1 568 . 1 1 A 52 52 PRO HA H 52 4.212 4.449 -0.237 2
1 575 . 1 1 A 52 52 PRO C C 52 176.380 176.305 0.075 2
1 576 . 1 1 A 52 52 PRO CA C 52 62.360 62.594 -0.235 2
1 577 . 1 1 A 52 52 PRO CB C 52 32.331 32.141 0.190 2
1 580 . 1 1 A 53 53 ASN H H 53 8.127 8.007 0.120 2
1 581 . 1 1 A 53 53 ASN HA H 53 4.651 4.766 -0.115 2
1 586 . 1 1 A 53 53 ASN C C 53 174.354 174.487 -0.133 2
1 587 . 1 1 A 53 53 ASN CA C 53 53.136 52.528 0.609 2
1 588 . 1 1 A 53 53 ASN CB C 53 39.666 38.193 1.473 2
1 589 . 1 1 A 53 53 ASN N N 53 119.405 119.820 -0.416 2
1 591 . 1 1 A 54 54 THR H H 54 8.425 8.522 -0.097 2
1 592 . 1 1 A 54 54 THR HA H 54 5.306 4.494 0.812 2
1 597 . 1 1 A 54 54 THR C C 54 173.850 174.202 -0.353 2
1 598 . 1 1 A 54 54 THR CA C 54 61.881 63.297 -1.416 2
1 599 . 1 1 A 54 54 THR CB C 54 70.573 69.441 1.132 2
1 601 . 1 1 A 54 54 THR N N 54 118.968 121.248 -2.280 2
1 602 . 1 1 A 55 55 ILE H H 55 9.354 8.579 0.775 2
1 603 . 1 1 A 55 55 ILE HA H 55 4.051 4.548 -0.497 2
1 613 . 1 1 A 55 55 ILE C C 55 172.975 173.426 -0.451 2
1 614 . 1 1 A 55 55 ILE CA C 55 61.003 59.763 1.240 2
1 615 . 1 1 A 55 55 ILE CB C 55 41.619 42.045 -0.426 2
1 619 . 1 1 A 55 55 ILE N N 55 127.961 125.839 2.122 2
1 620 . 1 1 A 56 56 ASP H H 56 8.132 8.697 -0.565 2
1 621 . 1 1 A 56 56 ASP HA H 56 5.334 5.260 0.074 2
1 624 . 1 1 A 56 56 ASP C C 56 174.969 174.662 0.306 2
1 625 . 1 1 A 56 56 ASP CA C 56 53.702 52.727 0.975 2
1 626 . 1 1 A 56 56 ASP CB C 56 43.251 42.952 0.300 2
1 627 . 1 1 A 56 56 ASP N N 56 125.882 126.935 -1.053 2
1 628 . 1 1 A 57 57 PHE H H 57 8.955 8.782 0.173 2
1 629 . 1 1 A 57 57 PHE HA H 57 4.915 5.035 -0.120 2
1 637 . 1 1 A 57 57 PHE C C 57 177.361 175.549 1.812 2
1 638 . 1 1 A 57 57 PHE CA C 57 57.458 56.532 0.926 2
1 639 . 1 1 A 57 57 PHE CB C 57 43.737 43.495 0.242 2
1 645 . 1 1 A 57 57 PHE N N 57 118.872 123.125 -4.253 2
1 646 . 1 1 A 58 58 GLY H H 58 9.552 9.072 0.480 2
1 647 . 1 1 A 58 58 GLY HA2 H 58 4.662 4.124 0.538 2
1 648 . 1 1 A 58 58 GLY HA3 H 58 4.126 4.195 -0.069 2
1 649 . 1 1 A 58 58 GLY C C 58 174.760 174.961 -0.201 2
1 650 . 1 1 A 58 58 GLY CA C 58 44.680 45.040 -0.360 2
1 651 . 1 1 A 58 58 GLY N N 58 111.551 109.878 1.673 2
1 652 . 1 1 A 59 59 LYS H H 59 8.211 8.578 -0.367 2
1 653 . 1 1 A 59 59 LYS HA H 59 3.782 3.666 0.116 2
1 662 . 1 1 A 59 59 LYS C C 59 176.154 178.166 -2.012 2
1 663 . 1 1 A 59 59 LYS CA C 59 59.080 58.696 0.384 2
1 664 . 1 1 A 59 59 LYS CB C 59 32.516 31.800 0.716 2
1 668 . 1 1 A 59 59 LYS N N 59 115.953 120.433 -4.480 2
1 669 . 1 1 A 60 60 ASP H H 60 8.634 8.110 0.524 2
1 670 . 1 1 A 60 60 ASP HA H 60 4.882 4.465 0.417 2
1 673 . 1 1 A 60 60 ASP C C 60 176.039 176.570 -0.531 2
1 674 . 1 1 A 60 60 ASP CA C 60 54.327 56.996 -2.669 2
1 675 . 1 1 A 60 60 ASP CB C 60 41.461 41.025 0.436 2
1 676 . 1 1 A 60 60 ASP N N 60 117.261 119.488 -2.227 2
1 677 . 1 1 A 61 61 ASP H H 61 7.500 8.314 -0.814 2
1 678 . 1 1 A 61 61 ASP HA H 61 4.591 4.690 -0.099 2
1 681 . 1 1 A 61 61 ASP C C 61 175.140 175.846 -0.706 2
1 682 . 1 1 A 61 61 ASP CA C 61 55.342 53.908 1.433 2
1 683 . 1 1 A 61 61 ASP CB C 61 42.475 40.020 2.455 2
1 684 . 1 1 A 61 61 ASP N N 61 122.319 118.862 3.457 2
1 685 . 1 1 A 62 62 GLN H H 62 8.239 7.965 0.274 2
1 686 . 1 1 A 62 62 GLN HA H 62 2.569 3.678 -1.109 2
1 693 . 1 1 A 62 62 GLN C C 62 172.652 173.685 -1.033 2
1 694 . 1 1 A 62 62 GLN CA C 62 54.038 55.540 -1.502 2
1 695 . 1 1 A 62 62 GLN CB C 62 31.481 29.271 2.210 2
1 697 . 1 1 A 62 62 GLN N N 62 117.458 123.305 -5.847 2
1 699 . 1 1 A 63 63 HIS H H 63 6.338 6.777 -0.439 2
1 700 . 1 1 A 63 63 HIS HA H 63 4.423 4.375 0.048 2
1 704 . 1 1 A 63 63 HIS C C 63 173.031 172.607 0.424 2
1 705 . 1 1 A 63 63 HIS CA C 63 54.743 53.981 0.762 2
1 706 . 1 1 A 63 63 HIS CB C 63 32.661 31.399 1.262 2
1 708 . 1 1 A 63 63 HIS N N 63 113.589 115.905 -2.316 2
1 709 . 1 1 A 64 64 PHE H H 64 8.549 8.969 -0.420 2
1 710 . 1 1 A 64 64 PHE HA H 64 4.578 5.148 -0.570 2
1 718 . 1 1 A 64 64 PHE C C 64 173.015 173.582 -0.567 2
1 719 . 1 1 A 64 64 PHE CA C 64 58.516 57.060 1.456 2
1 720 . 1 1 A 64 64 PHE CB C 64 43.525 43.048 0.477 2
1 726 . 1 1 A 64 64 PHE N N 64 118.214 120.029 -1.815 2
1 727 . 1 1 A 65 65 THR H H 65 7.150 8.102 -0.952 2
1 728 . 1 1 A 65 65 THR HA H 65 4.930 4.667 0.263 2
1 733 . 1 1 A 65 65 THR C C 65 172.457 173.480 -1.023 2
1 734 . 1 1 A 65 65 THR CA C 65 61.690 61.745 -0.054 2
1 735 . 1 1 A 65 65 THR CB C 65 69.593 69.320 0.273 2
1 737 . 1 1 A 65 65 THR N N 65 123.198 120.294 2.904 2
1 738 . 1 1 A 66 66 VAL H H 66 8.888 8.580 0.308 2
1 739 . 1 1 A 66 66 VAL HA H 66 4.018 4.760 -0.742 2
1 747 . 1 1 A 66 66 VAL C C 66 174.868 175.389 -0.521 2
1 748 . 1 1 A 66 66 VAL CA C 66 61.178 60.635 0.543 2
1 749 . 1 1 A 66 66 VAL CB C 66 33.114 33.179 -0.065 2
1 752 . 1 1 A 66 66 VAL N N 66 126.840 128.290 -1.450 2
1 753 . 1 1 A 67 67 THR H H 67 8.174 8.524 -0.350 2
1 754 . 1 1 A 67 67 THR HA H 67 4.816 5.023 -0.207 2
1 759 . 1 1 A 67 67 THR C C 67 174.494 174.260 0.234 2
1 760 . 1 1 A 67 67 THR CA C 67 59.786 59.540 0.246 2
1 761 . 1 1 A 67 67 THR CB C 67 70.887 71.659 -0.772 2
1 763 . 1 1 A 67 67 THR N N 67 116.127 117.100 -0.973 2
1 764 . 1 1 A 68 68 GLY H H 68 8.570 8.714 -0.144 2
1 765 . 1 1 A 68 68 GLY HA2 H 68 3.970 4.009 -0.039 2
1 766 . 1 1 A 68 68 GLY HA3 H 68 3.819 4.018 -0.199 2
1 767 . 1 1 A 68 68 GLY C C 68 175.636 174.713 0.923 2
1 768 . 1 1 A 68 68 GLY CA C 68 46.397 45.147 1.250 2
1 769 . 1 1 A 68 68 GLY N N 68 107.146 113.084 -5.938 2
1 770 . 1 1 A 69 69 LEU H H 69 8.007 7.563 0.444 2
1 771 . 1 1 A 69 69 LEU HA H 69 4.154 4.254 -0.100 2
1 781 . 1 1 A 69 69 LEU C C 69 176.830 176.425 0.405 2
1 782 . 1 1 A 69 69 LEU CA C 69 54.602 54.957 -0.355 2
1 783 . 1 1 A 69 69 LEU CB C 69 41.149 42.044 -0.895 2
1 787 . 1 1 A 69 69 LEU N N 69 118.433 122.831 -4.398 2
1 788 . 1 1 A 70 70 HIS H H 70 8.866 8.691 0.175 2
1 789 . 1 1 A 70 70 HIS HA H 70 4.663 4.678 -0.015 2
1 793 . 1 1 A 70 70 HIS C C 70 176.667 175.558 1.109 2
1 794 . 1 1 A 70 70 HIS CA C 70 55.464 56.952 -1.488 2
1 795 . 1 1 A 70 70 HIS CB C 70 32.125 30.039 2.086 2
1 797 . 1 1 A 70 70 HIS N N 70 122.457 122.545 -0.088 2
1 798 . 1 1 A 71 71 LYS H H 71 8.716 8.685 0.031 2
1 799 . 1 1 A 71 71 LYS HA H 71 4.320 4.286 0.034 2
1 808 . 1 1 A 71 71 LYS C C 71 178.110 177.132 0.978 2
1 809 . 1 1 A 71 71 LYS CA C 71 57.035 57.051 -0.016 2
1 810 . 1 1 A 71 71 LYS CB C 71 33.580 32.896 0.684 2
1 814 . 1 1 A 71 71 LYS N N 71 123.173 123.595 -0.422 2
1 815 . 1 1 A 72 72 GLY H H 72 7.709 8.832 -1.123 2
1 816 . 1 1 A 72 72 GLY HA2 H 72 3.800 3.914 -0.114 2
1 817 . 1 1 A 72 72 GLY HA3 H 72 3.769 3.921 -0.152 2
1 818 . 1 1 A 72 72 GLY C C 72 174.231 173.896 0.335 2
1 819 . 1 1 A 72 72 GLY CA C 72 47.866 46.409 1.457 2
1 820 . 1 1 A 72 72 GLY N N 72 114.881 111.165 3.716 2
1 821 . 1 1 A 73 73 THR H H 73 8.162 7.610 0.552 2
1 822 . 1 1 A 73 73 THR HA H 73 4.584 4.740 -0.156 2
1 827 . 1 1 A 73 73 THR C C 73 172.208 173.415 -1.207 2
1 828 . 1 1 A 73 73 THR CA C 73 62.307 61.275 1.032 2
1 829 . 1 1 A 73 73 THR CB C 73 72.123 71.855 0.268 2
1 831 . 1 1 A 73 73 THR N N 73 114.225 114.401 -0.176 2
1 832 . 1 1 A 74 74 THR H H 74 8.743 8.776 -0.033 2
1 833 . 1 1 A 74 74 THR HA H 74 5.138 4.958 0.180 2
1 838 . 1 1 A 74 74 THR C C 74 173.376 173.371 0.005 2
1 839 . 1 1 A 74 74 THR CA C 74 62.724 62.822 -0.098 2
1 840 . 1 1 A 74 74 THR CB C 74 69.202 69.945 -0.743 2
1 842 . 1 1 A 74 74 THR N N 74 123.376 121.070 2.306 2
1 843 . 1 1 A 75 75 TYR H H 75 9.549 9.178 0.371 2
1 844 . 1 1 A 75 75 TYR HA H 75 4.892 5.219 -0.327 2
1 851 . 1 1 A 75 75 TYR C C 75 173.991 175.314 -1.323 2
1 852 . 1 1 A 75 75 TYR CA C 75 57.740 56.059 1.681 2
1 853 . 1 1 A 75 75 TYR CB C 75 44.580 43.219 1.361 2
1 858 . 1 1 A 75 75 TYR N N 75 126.916 124.540 2.376 2
1 859 . 1 1 A 76 76 ILE H H 76 8.769 8.906 -0.137 2
1 860 . 1 1 A 76 76 ILE HA H 76 4.663 4.931 -0.268 2
1 870 . 1 1 A 76 76 ILE C C 76 174.683 175.235 -0.552 2
1 871 . 1 1 A 76 76 ILE CA C 76 60.455 60.678 -0.223 2
1 872 . 1 1 A 76 76 ILE CB C 76 40.284 40.046 0.238 2
1 876 . 1 1 A 76 76 ILE N N 76 119.407 120.813 -1.406 2
1 877 . 1 1 A 77 77 PHE H H 77 8.894 9.061 -0.167 2
1 878 . 1 1 A 77 77 PHE HA H 77 5.160 5.131 0.029 2
1 886 . 1 1 A 77 77 PHE C C 77 174.794 175.402 -0.608 2
1 887 . 1 1 A 77 77 PHE CA C 77 56.831 57.441 -0.610 2
1 888 . 1 1 A 77 77 PHE CB C 77 43.132 41.213 1.919 2
1 894 . 1 1 A 77 77 PHE N N 77 124.622 126.973 -2.351 2
1 895 . 1 1 A 78 78 ARG H H 78 9.407 9.170 0.237 2
1 896 . 1 1 A 78 78 ARG HA H 78 5.689 5.665 0.024 2
1 904 . 1 1 A 78 78 ARG C C 78 174.376 174.502 -0.126 2
1 905 . 1 1 A 78 78 ARG CA C 78 54.530 54.667 -0.137 2
1 906 . 1 1 A 78 78 ARG CB C 78 34.473 33.779 0.694 2
1 909 . 1 1 A 78 78 ARG N N 78 120.055 121.120 -1.065 2
1 911 . 1 1 A 79 79 LEU H H 79 9.132 8.870 0.262 2
1 912 . 1 1 A 79 79 LEU HA H 79 5.398 5.142 0.256 2
1 922 . 1 1 A 79 79 LEU C C 79 174.006 174.362 -0.356 2
1 923 . 1 1 A 79 79 LEU CA C 79 53.401 53.263 0.138 2
1 924 . 1 1 A 79 79 LEU CB C 79 48.116 46.536 1.580 2
1 928 . 1 1 A 79 79 LEU N N 79 124.907 125.275 -0.368 2
1 929 . 1 1 A 80 80 ALA H H 80 8.737 8.049 0.688 2
1 930 . 1 1 A 80 80 ALA HA H 80 4.871 5.020 -0.149 2
1 934 . 1 1 A 80 80 ALA C C 80 176.057 175.728 0.329 2
1 935 . 1 1 A 80 80 ALA CA C 80 50.353 51.164 -0.811 2
1 936 . 1 1 A 80 80 ALA CB C 80 23.972 23.294 0.678 2
1 937 . 1 1 A 80 80 ALA N N 80 128.220 125.747 2.473 2
1 938 . 1 1 A 81 81 ALA H H 81 9.890 8.620 1.270 2
1 939 . 1 1 A 81 81 ALA HA H 81 4.794 5.048 -0.254 2
1 943 . 1 1 A 81 81 ALA C C 81 174.655 176.210 -1.555 2
1 944 . 1 1 A 81 81 ALA CA C 81 50.300 51.100 -0.800 2
1 945 . 1 1 A 81 81 ALA CB C 81 21.369 20.701 0.668 2
1 946 . 1 1 A 81 81 ALA N N 81 123.682 123.440 0.242 2
1 947 . 1 1 A 82 82 LYS H H 82 7.965 8.728 -0.763 2
1 948 . 1 1 A 82 82 LYS HA H 82 4.974 5.240 -0.266 2
1 957 . 1 1 A 82 82 LYS C C 82 175.671 175.191 0.480 2
1 958 . 1 1 A 82 82 LYS CA C 82 54.664 54.738 -0.074 2
1 959 . 1 1 A 82 82 LYS CB C 82 36.677 35.419 1.258 2
1 963 . 1 1 A 82 82 LYS N N 82 118.164 122.366 -4.202 2
1 964 . 1 1 A 83 83 ASN H H 83 8.663 8.760 -0.097 2
1 965 . 1 1 A 83 83 ASN HA H 83 5.113 5.081 0.032 2
1 970 . 1 1 A 83 83 ASN C C 83 176.582 176.282 0.300 2
1 971 . 1 1 A 83 83 ASN CA C 83 51.746 50.701 1.045 2
1 972 . 1 1 A 83 83 ASN CB C 83 40.357 40.155 0.202 2
1 973 . 1 1 A 83 83 ASN N N 83 124.784 124.197 0.587 2
1 975 . 1 1 A 84 84 ARG H H 84 8.873 8.813 0.060 2
1 976 . 1 1 A 84 84 ARG HA H 84 3.940 3.944 -0.004 2
1 983 . 1 1 A 84 84 ARG C C 84 176.735 177.845 -1.110 2
1 984 . 1 1 A 84 84 ARG CA C 84 59.327 59.493 -0.166 2
1 985 . 1 1 A 84 84 ARG CB C 84 29.282 29.905 -0.623 2
1 988 . 1 1 A 84 84 ARG N N 84 117.891 119.496 -1.605 2
1 989 . 1 1 A 85 85 ALA H H 85 7.645 7.806 -0.161 2
1 990 . 1 1 A 85 85 ALA HA H 85 4.276 4.237 0.039 2
1 994 . 1 1 A 85 85 ALA C C 85 177.479 177.240 0.239 2
1 995 . 1 1 A 85 85 ALA CA C 85 52.818 52.825 -0.007 2
1 996 . 1 1 A 85 85 ALA CB C 85 18.806 19.575 -0.769 2
1 997 . 1 1 A 85 85 ALA N N 85 120.306 120.028 0.278 2
1 998 . 1 1 A 86 86 GLY H H 86 7.693 7.611 0.082 2
1 999 . 1 1 A 86 86 GLY HA2 H 86 4.456 4.084 0.372 2
1 1000 . 1 1 A 86 86 GLY HA3 H 86 3.649 4.087 -0.438 2
1 1001 . 1 1 A 86 86 GLY C C 86 172.068 172.534 -0.465 2
1 1002 . 1 1 A 86 86 GLY CA C 86 44.375 44.004 0.371 2
1 1003 . 1 1 A 86 86 GLY N N 86 106.594 104.003 2.591 2
1 1004 . 1 1 A 87 87 LEU H H 87 8.203 8.465 -0.262 2
1 1005 . 1 1 A 87 87 LEU HA H 87 4.629 4.685 -0.056 2
1 1015 . 1 1 A 87 87 LEU C C 87 179.155 176.520 2.635 2
1 1016 . 1 1 A 87 87 LEU CA C 87 54.814 55.304 -0.490 2
1 1017 . 1 1 A 87 87 LEU CB C 87 43.454 42.489 0.965 2
1 1021 . 1 1 A 87 87 LEU N N 87 120.879 122.298 -1.419 2
1 1022 . 1 1 A 88 88 GLY H H 88 8.492 8.274 0.218 2
1 1023 . 1 1 A 88 88 GLY HA2 H 88 4.339 4.169 0.170 2
1 1024 . 1 1 A 88 88 GLY HA3 H 88 4.122 4.176 -0.054 2
1 1025 . 1 1 A 88 88 GLY C C 88 173.030 173.377 -0.347 2
1 1026 . 1 1 A 88 88 GLY CA C 88 43.970 44.627 -0.657 2
1 1027 . 1 1 A 88 88 GLY N N 88 109.903 110.267 -0.364 2
1 1028 . 1 1 A 89 89 GLU H H 89 7.638 8.927 -1.289 2
1 1029 . 1 1 A 89 89 GLU HA H 89 4.103 4.297 -0.194 2
1 1034 . 1 1 A 89 89 GLU C C 89 177.511 175.791 1.720 2
1 1035 . 1 1 A 89 89 GLU CA C 89 56.659 56.971 -0.312 2
1 1036 . 1 1 A 89 89 GLU CB C 89 31.324 30.739 0.585 2
1 1038 . 1 1 A 89 89 GLU N N 89 117.551 122.040 -4.489 2
1 1039 . 1 1 A 90 90 GLU H H 90 8.734 8.947 -0.213 2
1 1040 . 1 1 A 90 90 GLU HA H 90 4.651 5.359 -0.708 2
1 1045 . 1 1 A 90 90 GLU C C 90 177.452 174.593 2.859 2
1 1046 . 1 1 A 90 90 GLU CA C 90 55.987 54.718 1.269 2
1 1047 . 1 1 A 90 90 GLU CB C 90 31.135 33.333 -2.198 2
1 1049 . 1 1 A 90 90 GLU N N 90 121.553 118.621 2.931 2
1 1050 . 1 1 A 91 91 PHE H H 91 9.411 9.175 0.236 2
1 1051 . 1 1 A 91 91 PHE HA H 91 4.665 5.015 -0.350 2
1 1059 . 1 1 A 91 91 PHE C C 91 173.944 174.423 -0.479 2
1 1060 . 1 1 A 91 91 PHE CA C 91 57.687 57.906 -0.219 2
1 1061 . 1 1 A 91 91 PHE CB C 91 40.890 41.298 -0.408 2
1 1067 . 1 1 A 91 91 PHE N N 91 125.459 124.967 0.492 2
1 1068 . 1 1 A 92 92 GLU H H 92 8.043 8.153 -0.110 2
1 1069 . 1 1 A 92 92 GLU HA H 92 5.424 5.273 0.151 2
1 1074 . 1 1 A 92 92 GLU C C 92 174.295 174.442 -0.147 2
1 1075 . 1 1 A 92 92 GLU CA C 92 54.378 54.705 -0.327 2
1 1076 . 1 1 A 92 92 GLU CB C 92 33.662 33.298 0.364 2
1 1078 . 1 1 A 92 92 GLU N N 92 128.905 127.032 1.873 2
1 1079 . 1 1 A 93 93 LYS H H 93 9.142 8.671 0.471 2
1 1080 . 1 1 A 93 93 LYS HA H 93 4.541 5.117 -0.577 2
1 1089 . 1 1 A 93 93 LYS C C 93 173.366 173.938 -0.572 2
1 1090 . 1 1 A 93 93 LYS CA C 93 55.343 55.447 -0.104 2
1 1091 . 1 1 A 93 93 LYS CB C 93 37.317 36.157 1.160 2
1 1095 . 1 1 A 93 93 LYS N N 93 125.231 126.927 -1.696 2
1 1096 . 1 1 A 94 94 GLU H H 94 8.655 9.184 -0.529 2
1 1097 . 1 1 A 94 94 GLU HA H 94 5.558 5.389 0.169 2
1 1102 . 1 1 A 94 94 GLU C C 94 176.238 175.586 0.652 2
1 1103 . 1 1 A 94 94 GLU CA C 94 54.632 55.120 -0.488 2
1 1104 . 1 1 A 94 94 GLU CB C 94 32.166 32.843 -0.677 2
1 1106 . 1 1 A 94 94 GLU N N 94 127.232 127.819 -0.587 2
1 1107 . 1 1 A 95 95 ILE H H 95 9.302 8.899 0.403 2
1 1108 . 1 1 A 95 95 ILE HA H 95 4.794 5.236 -0.442 2
1 1118 . 1 1 A 95 95 ILE C C 95 173.138 174.414 -1.276 2
1 1119 . 1 1 A 95 95 ILE CA C 95 58.570 58.439 0.131 2
1 1120 . 1 1 A 95 95 ILE CB C 95 42.420 42.713 -0.293 2
1 1124 . 1 1 A 95 95 ILE N N 95 120.711 121.112 -0.401 2
1 1125 . 1 1 A 96 96 ARG H H 96 8.589 8.746 -0.157 2
1 1126 . 1 1 A 96 96 ARG HA H 96 5.373 4.820 0.553 2
1 1133 . 1 1 A 96 96 ARG C C 96 177.147 174.985 2.162 2
1 1134 . 1 1 A 96 96 ARG CA C 96 54.045 55.266 -1.221 2
1 1135 . 1 1 A 96 96 ARG CB C 96 32.001 33.770 -1.769 2
1 1138 . 1 1 A 96 96 ARG N N 96 124.445 121.774 2.671 2
1 1139 . 1 1 A 97 97 THR H H 97 9.243 8.559 0.684 2
1 1140 . 1 1 A 97 97 THR HA H 97 4.459 4.619 -0.160 2
1 1145 . 1 1 A 97 97 THR C C 97 172.745 173.885 -1.140 2
1 1146 . 1 1 A 97 97 THR CA C 97 59.637 60.672 -1.035 2
1 1147 . 1 1 A 97 97 THR CB C 97 67.687 68.894 -1.207 2
1 1149 . 1 1 A 97 97 THR N N 97 119.370 118.463 0.907 2
1 1150 . 1 1 A 98 98 PRO HA H 98 4.494 4.687 -0.193 2
1 1157 . 1 1 A 98 98 PRO CA C 98 63.117 62.701 0.416 2
1 1158 . 1 1 A 98 98 PRO CB C 98 32.500 31.970 0.530 2
1 1161 . 1 1 A 99 99 GLU H H 99 8.534 8.448 0.086 2
1 1162 . 1 1 A 99 99 GLU HA H 99 4.195 4.443 -0.248 2
1 1167 . 1 1 A 99 99 GLU C C 99 175.881 175.967 -0.086 2
1 1168 . 1 1 A 99 99 GLU CA C 99 56.330 56.382 -0.052 2
1 1169 . 1 1 A 99 99 GLU CB C 99 31.062 30.556 0.506 2
1 1171 . 1 1 A 99 99 GLU N N 99 119.688 120.474 -0.786 2
1 1172 . 1 1 A 100 100 ASP H H 100 8.536 8.665 -0.129 2
1 1173 . 1 1 A 100 100 ASP HA H 100 4.607 4.806 -0.199 2
1 1176 . 1 1 A 100 100 ASP C C 100 176.012 175.523 0.489 2
1 1177 . 1 1 A 100 100 ASP CA C 100 54.109 54.424 -0.315 2
1 1178 . 1 1 A 100 100 ASP CB C 100 41.562 42.799 -1.237 2
1 1179 . 1 1 A 100 100 ASP N N 100 119.803 121.238 -1.435 2
1 1180 . 1 1 A 101 101 LEU H H 101 8.403 8.351 0.052 2
1 1181 . 1 1 A 101 101 LEU HA H 101 4.426 4.549 -0.123 2
1 1191 . 1 1 A 101 101 LEU C C 101 177.534 176.074 1.460 2
1 1192 . 1 1 A 101 101 LEU CA C 101 55.113 54.816 0.297 2
1 1193 . 1 1 A 101 101 LEU CB C 101 42.156 43.442 -1.286 2
1 1197 . 1 1 A 101 101 LEU N N 101 123.876 121.956 1.920 2
1 1198 . 1 1 A 102 102 SER H H 102 8.413 8.515 -0.102 2
1 1199 . 1 1 A 102 102 SER HA H 102 4.434 4.757 -0.323 2
1 1202 . 1 1 A 102 102 SER C C 102 174.674 173.998 0.676 2
1 1203 . 1 1 A 102 102 SER CA C 102 58.798 58.188 0.610 2
1 1204 . 1 1 A 102 102 SER CB C 102 63.854 64.495 -0.641 2
1 1205 . 1 1 A 102 102 SER N N 102 116.667 117.669 -1.002 2
1 1206 . 1 1 A 103 103 GLY H H 103 8.213 8.297 -0.084 2
1 1207 . 1 1 A 103 103 GLY HA2 H 103 4.164 4.137 0.027 2
1 1208 . 1 1 A 103 103 GLY HA3 H 103 4.057 4.138 -0.081 2
1 1209 . 1 1 A 103 103 GLY C C 103 171.822 173.154 -1.332 2
1 1210 . 1 1 A 103 103 GLY CA C 103 44.658 44.839 -0.181 2
1 1211 . 1 1 A 103 103 GLY N N 103 110.592 110.456 0.136 2
1 1212 . 1 1 A 104 104 PRO HA H 104 4.475 4.565 -0.090 2
1 1219 . 1 1 A 104 104 PRO C C 104 177.445 176.585 0.860 2
1 1220 . 1 1 A 104 104 PRO CA C 104 63.312 63.287 0.025 2
1 1221 . 1 1 A 104 104 PRO CB C 104 32.190 31.693 0.497 2
1 1224 . 1 1 A 105 105 SER H H 105 8.538 8.273 0.265 2
1 1225 . 1 1 A 105 105 SER HA H 105 4.541 4.612 -0.071 2
1 1228 . 1 1 A 105 105 SER C C 105 174.616 173.673 0.943 2
1 1229 . 1 1 A 105 105 SER CA C 105 58.270 58.621 -0.351 2
1 1230 . 1 1 A 105 105 SER CB C 105 63.895 64.142 -0.247 2
1 1231 . 1 1 A 105 105 SER N N 105 116.446 116.557 -0.111 2
1 1232 . 1 1 A 106 106 SER H H 106 8.350 8.361 -0.011 2
1 1233 . 1 1 A 106 106 SER HA H 106 4.541 4.850 -0.309 2
1 1236 . 1 1 A 106 106 SER C C 106 174.530 174.108 0.422 2
1 1237 . 1 1 A 106 106 SER CA C 106 58.357 57.572 0.785 2
1 1238 . 1 1 A 106 106 SER CB C 106 64.020 64.889 -0.869 2
1 1239 . 1 1 A 106 106 SER N N 106 117.448 117.778 -0.330 2
stop_
save_