data_15796_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15796
_Entry.PDB_ID 2K4D
_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 3 3 LEU HA H 357 4.257 4.214 0.043 1
1 11 . 1 1 1 A 3 3 LEU C C 357 174.994 177.443 -2.449 1
1 12 . 1 1 1 A 3 3 LEU CA C 357 53.329 56.739 -3.410 1
1 13 . 1 1 1 A 3 3 LEU CB C 357 39.382 42.277 -2.895 1
1 17 . 1 1 1 A 4 4 GLN H H 358 8.234 7.359 0.875 1
1 18 . 1 1 1 A 4 4 GLN HA H 358 4.211 4.484 -0.273 1
1 25 . 1 1 1 A 4 4 GLN C C 358 173.357 174.887 -1.530 1
1 26 . 1 1 1 A 4 4 GLN CA C 358 53.791 55.051 -1.260 1
1 27 . 1 1 1 A 4 4 GLN CB C 358 26.456 27.993 -1.537 1
1 29 . 1 1 1 A 4 4 GLN N N 358 119.506 117.371 2.135 1
1 31 . 1 1 1 A 5 5 ASP H H 359 8.090 8.684 -0.594 1
1 32 . 1 1 1 A 5 5 ASP HA H 359 4.458 4.871 -0.413 1
1 35 . 1 1 1 A 5 5 ASP C C 359 173.492 175.713 -2.221 1
1 36 . 1 1 1 A 5 5 ASP CA C 359 52.309 54.112 -1.803 1
1 37 . 1 1 1 A 5 5 ASP CB C 359 38.312 42.217 -3.905 1
1 38 . 1 1 1 A 5 5 ASP N N 359 120.683 125.956 -5.273 1
1 39 . 1 1 1 A 6 6 HIS H H 360 8.103 8.875 -0.772 1
1 40 . 1 1 1 A 6 6 HIS HA H 360 4.540 4.760 -0.220 1
1 45 . 1 1 1 A 6 6 HIS C C 360 172.801 173.681 -0.880 1
1 46 . 1 1 1 A 6 6 HIS CA C 360 53.874 54.490 -0.616 1
1 47 . 1 1 1 A 6 6 HIS CB C 360 27.878 28.945 -1.067 1
1 50 . 1 1 1 A 6 6 HIS N N 360 118.844 124.172 -5.328 1
1 51 . 1 1 1 A 7 7 ILE H H 361 7.862 8.732 -0.870 1
1 52 . 1 1 1 A 7 7 ILE HA H 361 4.010 5.023 -1.013 1
1 62 . 1 1 1 A 7 7 ILE C C 361 173.268 174.047 -0.779 1
1 63 . 1 1 1 A 7 7 ILE CA C 361 58.740 58.493 0.247 1
1 64 . 1 1 1 A 7 7 ILE CB C 361 35.788 42.777 -6.989 1
1 68 . 1 1 1 A 7 7 ILE N N 361 121.598 121.133 0.465 1
1 69 . 1 1 1 A 8 8 LYS H H 362 8.231 8.591 -0.360 1
1 70 . 1 1 1 A 8 8 LYS HA H 362 4.313 4.851 -0.538 1
1 79 . 1 1 1 A 8 8 LYS C C 362 173.899 175.128 -1.229 1
1 80 . 1 1 1 A 8 8 LYS CA C 362 53.677 55.034 -1.357 1
1 81 . 1 1 1 A 8 8 LYS CB C 362 30.355 36.409 -6.054 1
1 85 . 1 1 1 A 8 8 LYS N N 362 124.980 121.843 3.137 1
1 86 . 1 1 1 A 9 9 VAL H H 363 8.044 8.710 -0.666 1
1 87 . 1 1 1 A 9 9 VAL HA H 363 4.089 4.211 -0.122 1
1 95 . 1 1 1 A 9 9 VAL C C 363 173.760 176.019 -2.259 1
1 96 . 1 1 1 A 9 9 VAL CA C 363 59.814 61.707 -1.893 1
1 97 . 1 1 1 A 9 9 VAL CB C 363 30.058 30.769 -0.711 1
1 100 . 1 1 1 A 9 9 VAL N N 363 121.366 122.464 -1.098 1
1 101 . 1 1 1 A 10 10 THR H H 364 8.076 8.000 0.076 1
1 102 . 1 1 1 A 10 10 THR HA H 364 4.302 3.772 0.530 1
1 107 . 1 1 1 A 10 10 THR C C 364 172.135 176.679 -4.544 1
1 108 . 1 1 1 A 10 10 THR CA C 364 59.134 66.487 -7.353 1
1 109 . 1 1 1 A 10 10 THR CB C 364 67.415 68.550 -1.135 1
1 111 . 1 1 1 A 10 10 THR N N 364 116.817 119.884 -3.067 1
1 112 . 1 1 1 A 11 11 GLN H H 365 8.463 7.707 0.756 1
1 113 . 1 1 1 A 11 11 GLN HA H 365 4.046 4.329 -0.283 1
1 120 . 1 1 1 A 11 11 GLN C C 365 173.944 175.481 -1.537 1
1 121 . 1 1 1 A 11 11 GLN CA C 365 54.517 57.435 -2.918 1
1 122 . 1 1 1 A 11 11 GLN CB C 365 26.250 30.189 -3.939 1
1 124 . 1 1 1 A 11 11 GLN N N 365 122.059 119.084 2.975 1
1 126 . 1 1 1 A 12 12 GLU H H 366 8.449 7.602 0.847 1
1 127 . 1 1 1 A 12 12 GLU HA H 366 4.093 4.632 -0.539 1
1 132 . 1 1 1 A 12 12 GLU C C 366 174.746 175.804 -1.058 1
1 133 . 1 1 1 A 12 12 GLU CA C 366 55.235 56.378 -1.143 1
1 134 . 1 1 1 A 12 12 GLU CB C 366 27.180 33.682 -6.502 1
1 136 . 1 1 1 A 12 12 GLU N N 366 120.415 118.224 2.191 1
1 137 . 1 1 1 A 13 13 GLN H H 367 8.031 8.721 -0.690 1
1 138 . 1 1 1 A 13 13 GLN HA H 367 4.113 4.248 -0.135 1
1 145 . 1 1 1 A 13 13 GLN C C 367 173.693 176.489 -2.796 1
1 146 . 1 1 1 A 13 13 GLN CA C 367 54.132 56.901 -2.769 1
1 147 . 1 1 1 A 13 13 GLN CB C 367 26.420 29.977 -3.557 1
1 149 . 1 1 1 A 13 13 GLN N N 367 119.721 124.208 -4.487 1
1 151 . 1 1 1 A 14 14 TYR H H 368 8.111 8.041 0.070 1
1 152 . 1 1 1 A 14 14 TYR HA H 368 4.339 4.742 -0.403 1
1 159 . 1 1 1 A 14 14 TYR C C 368 173.916 176.569 -2.653 1
1 160 . 1 1 1 A 14 14 TYR CA C 368 56.572 57.780 -1.208 1
1 161 . 1 1 1 A 14 14 TYR CB C 368 35.879 38.174 -2.295 1
1 164 . 1 1 1 A 14 14 TYR N N 368 120.541 116.626 3.915 1
1 165 . 1 1 1 A 15 15 GLU H H 369 8.287 8.190 0.097 1
1 166 . 1 1 1 A 15 15 GLU HA H 369 4.009 4.471 -0.462 1
1 171 . 1 1 1 A 15 15 GLU C C 369 174.448 177.879 -3.431 1
1 172 . 1 1 1 A 15 15 GLU CA C 369 55.047 58.758 -3.711 1
1 173 . 1 1 1 A 15 15 GLU CB C 369 27.226 29.720 -2.494 1
1 175 . 1 1 1 A 15 15 GLU N N 369 120.398 122.578 -2.180 1
1 176 . 1 1 1 A 16 16 LEU H H 370 7.785 7.913 -0.128 1
1 177 . 1 1 1 A 16 16 LEU HA H 370 4.138 4.133 0.005 1
1 187 . 1 1 1 A 16 16 LEU C C 370 175.089 177.036 -1.947 1
1 188 . 1 1 1 A 16 16 LEU CA C 370 53.425 55.603 -2.178 1
1 189 . 1 1 1 A 16 16 LEU CB C 370 39.554 40.870 -1.316 1
1 193 . 1 1 1 A 16 16 LEU N N 370 121.323 116.882 4.441 1
1 194 . 1 1 1 A 17 17 TYR H H 371 8.038 7.428 0.610 1
1 195 . 1 1 1 A 17 17 TYR HA H 371 4.380 4.589 -0.209 1
1 202 . 1 1 1 A 17 17 TYR C C 371 173.931 175.579 -1.648 1
1 203 . 1 1 1 A 17 17 TYR CA C 371 56.143 57.456 -1.313 1
1 204 . 1 1 1 A 17 17 TYR CB C 371 35.501 39.030 -3.529 1
1 207 . 1 1 1 A 17 17 TYR N N 371 119.465 118.009 1.456 1
1 208 . 1 1 1 A 18 18 CYS H H 372 8.021 7.420 0.601 1
1 209 . 1 1 1 A 18 18 CYS HA H 372 4.236 4.490 -0.254 1
1 212 . 1 1 1 A 18 18 CYS C C 372 172.457 174.359 -1.902 1
1 213 . 1 1 1 A 18 18 CYS CA C 372 56.997 57.285 -0.288 1
1 214 . 1 1 1 A 18 18 CYS CB C 372 25.080 29.286 -4.206 1
1 215 . 1 1 1 A 18 18 CYS N N 372 119.913 120.547 -0.634 1
1 216 . 1 1 1 A 19 19 GLU H H 373 8.151 9.010 -0.859 1
1 217 . 1 1 1 A 19 19 GLU HA H 373 4.130 4.290 -0.160 1
1 222 . 1 1 1 A 19 19 GLU C C 373 174.151 176.570 -2.419 1
1 223 . 1 1 1 A 19 19 GLU CA C 373 54.535 58.432 -3.897 1
1 224 . 1 1 1 A 19 19 GLU CB C 373 27.244 30.365 -3.121 1
1 226 . 1 1 1 A 19 19 GLU N N 373 122.431 123.618 -1.187 1
1 227 . 1 1 1 A 20 20 MET H H 374 8.109 8.132 -0.023 1
1 228 . 1 1 1 A 20 20 MET HA H 374 4.352 4.107 0.245 1
1 236 . 1 1 1 A 20 20 MET C C 374 174.200 175.777 -1.577 1
1 237 . 1 1 1 A 20 20 MET CA C 374 53.238 56.425 -3.187 1
1 238 . 1 1 1 A 20 20 MET CB C 374 30.237 31.100 -0.863 1
1 241 . 1 1 1 A 20 20 MET N N 374 119.754 116.485 3.269 1
1 242 . 1 1 1 A 21 21 GLY H H 375 8.231 8.318 -0.087 1
1 243 . 1 1 1 A 21 21 GLY HA2 H 375 3.861 4.078 -0.217 1
1 244 . 1 1 1 A 21 21 GLY HA3 H 375 3.960 4.099 -0.139 1
1 245 . 1 1 1 A 21 21 GLY C C 375 171.928 173.238 -1.310 1
1 246 . 1 1 1 A 21 21 GLY CA C 375 42.930 44.441 -1.511 1
1 247 . 1 1 1 A 21 21 GLY N N 375 109.484 110.614 -1.130 1
1 248 . 1 1 1 A 22 22 SER HA H 376 4.492 5.308 -0.816 1
1 251 . 1 1 1 A 22 22 SER C C 376 172.206 173.582 -1.376 1
1 252 . 1 1 1 A 22 22 SER CA C 376 55.570 56.900 -1.330 1
1 253 . 1 1 1 A 22 22 SER CB C 376 61.525 64.660 -3.135 1
1 254 . 1 1 1 A 23 23 THR H H 377 8.470 9.104 -0.634 1
1 255 . 1 1 1 A 23 23 THR HA H 377 4.295 4.342 -0.047 1
1 260 . 1 1 1 A 23 23 THR C C 377 171.811 175.062 -3.251 1
1 261 . 1 1 1 A 23 23 THR CA C 377 58.937 62.723 -3.786 1
1 262 . 1 1 1 A 23 23 THR CB C 377 67.250 68.249 -0.999 1
1 264 . 1 1 1 A 23 23 THR N N 377 124.043 120.599 3.444 1
1 265 . 1 1 1 A 24 24 PHE H H 378 8.374 8.987 -0.613 1
1 266 . 1 1 1 A 24 24 PHE HA H 378 4.239 4.374 -0.135 1
1 273 . 1 1 1 A 24 24 PHE C C 378 173.411 176.011 -2.600 1
1 274 . 1 1 1 A 24 24 PHE CA C 378 56.697 59.950 -3.253 1
1 275 . 1 1 1 A 24 24 PHE CB C 378 36.538 39.997 -3.459 1
1 278 . 1 1 1 A 24 24 PHE N N 378 124.732 128.285 -3.553 1
1 279 . 1 1 1 A 25 25 GLN H H 379 8.457 7.655 0.802 1
1 280 . 1 1 1 A 25 25 GLN HA H 379 4.038 4.644 -0.606 1
1 287 . 1 1 1 A 25 25 GLN C C 379 172.431 175.612 -3.181 1
1 288 . 1 1 1 A 25 25 GLN CA C 379 54.078 55.171 -1.093 1
1 289 . 1 1 1 A 25 25 GLN CB C 379 26.414 30.387 -3.973 1
1 291 . 1 1 1 A 25 25 GLN N N 379 118.820 118.074 0.746 1
1 293 . 1 1 1 A 26 26 LEU H H 380 6.985 8.803 -1.818 1
1 294 . 1 1 1 A 26 26 LEU HA H 380 4.229 4.750 -0.521 1
1 304 . 1 1 1 A 26 26 LEU C C 380 173.895 174.691 -0.796 1
1 305 . 1 1 1 A 26 26 LEU CA C 380 52.123 56.165 -4.042 1
1 306 . 1 1 1 A 26 26 LEU CB C 380 40.543 41.118 -0.575 1
1 310 . 1 1 1 A 26 26 LEU N N 380 119.079 118.022 1.057 1
1 311 . 1 1 1 A 27 27 CYS H H 381 8.905 9.027 -0.122 1
1 312 . 1 1 1 A 27 27 CYS HA H 381 4.013 4.773 -0.760 1
1 315 . 1 1 1 A 27 27 CYS C C 381 174.439 176.170 -1.731 1
1 316 . 1 1 1 A 27 27 CYS CA C 381 57.847 58.146 -0.299 1
1 317 . 1 1 1 A 27 27 CYS CB C 381 28.648 29.313 -0.665 1
1 318 . 1 1 1 A 27 27 CYS N N 381 125.151 122.143 3.008 1
1 319 . 1 1 1 A 28 28 LYS H H 382 9.351 9.103 0.248 1
1 320 . 1 1 1 A 28 28 LYS HA H 382 4.157 4.071 0.086 1
1 329 . 1 1 1 A 28 28 LYS C C 382 174.678 178.629 -3.951 1
1 330 . 1 1 1 A 28 28 LYS CA C 382 54.324 58.709 -4.385 1
1 331 . 1 1 1 A 28 28 LYS CB C 382 30.086 32.064 -1.978 1
1 335 . 1 1 1 A 28 28 LYS N N 382 128.840 128.328 0.512 1
1 336 . 1 1 1 A 29 29 ILE H H 383 9.040 7.776 1.264 1
1 337 . 1 1 1 A 29 29 ILE HA H 383 3.804 3.773 0.031 1
1 347 . 1 1 1 A 29 29 ILE C C 383 174.239 177.248 -3.009 1
1 348 . 1 1 1 A 29 29 ILE CA C 383 62.114 63.997 -1.883 1
1 349 . 1 1 1 A 29 29 ILE CB C 383 33.870 37.703 -3.833 1
1 353 . 1 1 1 A 29 29 ILE N N 383 122.718 120.819 1.899 1
1 354 . 1 1 1 A 30 30 CYS H H 384 7.572 7.813 -0.241 1
1 355 . 1 1 1 A 30 30 CYS HA H 384 4.548 4.562 -0.014 1
1 358 . 1 1 1 A 30 30 CYS C C 384 172.978 175.738 -2.760 1
1 359 . 1 1 1 A 30 30 CYS CA C 384 54.957 59.245 -4.288 1
1 360 . 1 1 1 A 30 30 CYS CB C 384 29.778 29.874 -0.096 1
1 361 . 1 1 1 A 30 30 CYS N N 384 116.356 116.729 -0.373 1
1 362 . 1 1 1 A 31 31 ALA H H 385 8.205 8.449 -0.244 1
1 363 . 1 1 1 A 31 31 ALA HA H 385 4.107 4.275 -0.168 1
1 367 . 1 1 1 A 31 31 ALA C C 385 173.139 177.196 -4.057 1
1 368 . 1 1 1 A 31 31 ALA CA C 385 50.802 54.417 -3.615 1
1 369 . 1 1 1 A 31 31 ALA CB C 385 14.634 17.862 -3.228 1
1 370 . 1 1 1 A 31 31 ALA N N 385 125.526 120.747 4.779 1
1 371 . 1 1 1 A 32 32 GLU H H 386 8.416 8.096 0.320 1
1 372 . 1 1 1 A 32 32 GLU HA H 386 4.467 4.394 0.073 1
1 377 . 1 1 1 A 32 32 GLU C C 386 172.325 176.670 -4.345 1
1 378 . 1 1 1 A 32 32 GLU CA C 386 55.146 57.166 -2.020 1
1 379 . 1 1 1 A 32 32 GLU CB C 386 31.181 30.731 0.450 1
1 381 . 1 1 1 A 32 32 GLU N N 386 117.579 116.463 1.116 1
1 382 . 1 1 1 A 33 33 ASN H H 387 7.872 7.757 0.115 1
1 383 . 1 1 1 A 33 33 ASN HA H 387 4.900 5.087 -0.187 1
1 388 . 1 1 1 A 33 33 ASN C C 387 171.355 173.871 -2.516 1
1 389 . 1 1 1 A 33 33 ASN CA C 387 49.320 52.335 -3.015 1
1 390 . 1 1 1 A 33 33 ASN CB C 387 38.457 40.072 -1.615 1
1 391 . 1 1 1 A 33 33 ASN N N 387 120.399 116.954 3.445 1
1 393 . 1 1 1 A 34 34 ASP H H 388 8.565 8.638 -0.073 1
1 394 . 1 1 1 A 34 34 ASP HA H 388 4.679 4.970 -0.291 1
1 397 . 1 1 1 A 34 34 ASP C C 388 174.243 174.856 -0.613 1
1 398 . 1 1 1 A 34 34 ASP CA C 388 51.809 51.955 -0.146 1
1 399 . 1 1 1 A 34 34 ASP CB C 388 38.007 44.037 -6.030 1
1 400 . 1 1 1 A 34 34 ASP N N 388 120.661 121.536 -0.875 1
1 401 . 1 1 1 A 35 35 LYS H H 389 8.544 8.699 -0.155 1
1 402 . 1 1 1 A 35 35 LYS HA H 389 3.411 4.328 -0.917 1
1 409 . 1 1 1 A 35 35 LYS C C 389 172.938 176.455 -3.517 1
1 410 . 1 1 1 A 35 35 LYS CA C 389 54.973 55.891 -0.918 1
1 411 . 1 1 1 A 35 35 LYS CB C 389 30.617 31.539 -0.922 1
1 415 . 1 1 1 A 35 35 LYS N N 389 119.199 122.082 -2.883 1
1 416 . 1 1 1 A 36 36 ASP H H 390 8.327 9.054 -0.727 1
1 417 . 1 1 1 A 36 36 ASP HA H 390 4.724 4.706 0.018 1
1 420 . 1 1 1 A 36 36 ASP C C 390 172.860 175.505 -2.645 1
1 421 . 1 1 1 A 36 36 ASP CA C 390 51.609 55.500 -3.891 1
1 422 . 1 1 1 A 36 36 ASP CB C 390 39.018 42.873 -3.855 1
1 423 . 1 1 1 A 36 36 ASP N N 390 119.134 126.681 -7.547 1
1 424 . 1 1 1 A 37 37 VAL H H 391 8.544 8.121 0.423 1
1 425 . 1 1 1 A 37 37 VAL HA H 391 4.877 4.856 0.021 1
1 433 . 1 1 1 A 37 37 VAL C C 391 167.519 173.342 -5.823 1
1 434 . 1 1 1 A 37 37 VAL CA C 391 58.259 59.808 -1.549 1
1 435 . 1 1 1 A 37 37 VAL CB C 391 32.277 35.469 -3.192 1
1 438 . 1 1 1 A 37 37 VAL N N 391 121.970 117.065 4.905 1
1 439 . 1 1 1 A 38 38 LYS H H 392 8.621 9.575 -0.954 1
1 440 . 1 1 1 A 38 38 LYS HA H 392 4.991 5.212 -0.221 1
1 449 . 1 1 1 A 38 38 LYS C C 392 172.681 175.176 -2.495 1
1 450 . 1 1 1 A 38 38 LYS CA C 392 51.123 54.530 -3.407 1
1 451 . 1 1 1 A 38 38 LYS CB C 392 33.697 34.952 -1.255 1
1 455 . 1 1 1 A 38 38 LYS N N 392 126.381 127.885 -1.504 1
1 456 . 1 1 1 A 39 39 ILE H H 393 8.723 8.785 -0.062 1
1 457 . 1 1 1 A 39 39 ILE HA H 393 4.239 4.355 -0.116 1
1 467 . 1 1 1 A 39 39 ILE C C 393 172.642 175.720 -3.078 1
1 468 . 1 1 1 A 39 39 ILE CA C 393 57.768 61.045 -3.277 1
1 469 . 1 1 1 A 39 39 ILE CB C 393 35.691 37.657 -1.966 1
1 473 . 1 1 1 A 39 39 ILE N N 393 126.398 127.684 -1.286 1
1 474 . 1 1 1 A 40 40 GLU H H 394 8.506 9.364 -0.858 1
1 475 . 1 1 1 A 40 40 GLU HA H 394 4.753 4.752 0.001 1
1 480 . 1 1 1 A 40 40 GLU C C 394 173.596 176.099 -2.503 1
1 481 . 1 1 1 A 40 40 GLU CA C 394 49.793 53.106 -3.313 1
1 482 . 1 1 1 A 40 40 GLU CB C 394 28.210 31.030 -2.820 1
1 484 . 1 1 1 A 40 40 GLU N N 394 124.864 127.913 -3.049 1
1 485 . 1 1 1 A 41 41 PRO HA H 395 4.864 4.554 0.310 1
1 492 . 1 1 1 A 41 41 PRO C C 395 175.073 177.088 -2.015 1
1 493 . 1 1 1 A 41 41 PRO CA C 395 61.111 63.913 -2.802 1
1 494 . 1 1 1 A 41 41 PRO CB C 395 32.275 33.016 -0.741 1
1 497 . 1 1 1 A 42 42 CYS H H 396 7.828 7.826 0.002 1
1 498 . 1 1 1 A 42 42 CYS HA H 396 4.208 4.104 0.104 1
1 501 . 1 1 1 A 42 42 CYS C C 396 173.877 175.036 -1.159 1
1 502 . 1 1 1 A 42 42 CYS CA C 396 58.021 61.317 -3.296 1
1 503 . 1 1 1 A 42 42 CYS CB C 396 28.242 27.760 0.482 1
1 504 . 1 1 1 A 42 42 CYS N N 396 122.434 118.143 4.291 1
1 505 . 1 1 1 A 43 43 GLY H H 397 8.679 8.712 -0.033 1
1 506 . 1 1 1 A 43 43 GLY HA2 H 397 3.507 3.924 -0.417 1
1 507 . 1 1 1 A 43 43 GLY HA3 H 397 3.914 3.933 -0.019 1
1 508 . 1 1 1 A 43 43 GLY C C 397 171.981 174.975 -2.994 1
1 509 . 1 1 1 A 43 43 GLY CA C 397 43.347 45.737 -2.390 1
1 510 . 1 1 1 A 43 43 GLY N N 397 112.123 108.689 3.434 1
1 511 . 1 1 1 A 44 44 HIS H H 398 8.329 7.842 0.487 1
1 512 . 1 1 1 A 44 44 HIS HA H 398 4.339 4.450 -0.111 1
1 517 . 1 1 1 A 44 44 HIS C C 398 170.742 174.592 -3.850 1
1 518 . 1 1 1 A 44 44 HIS CA C 398 58.368 56.124 2.244 1
1 519 . 1 1 1 A 44 44 HIS CB C 398 28.434 30.912 -2.478 1
1 522 . 1 1 1 A 44 44 HIS N N 398 121.393 118.437 2.956 1
1 523 . 1 1 1 A 45 45 LEU H H 399 8.241 8.597 -0.356 1
1 524 . 1 1 1 A 45 45 LEU HA H 399 5.570 5.260 0.310 1
1 534 . 1 1 1 A 45 45 LEU C C 399 174.464 175.608 -1.144 1
1 535 . 1 1 1 A 45 45 LEU CA C 399 50.729 53.231 -2.502 1
1 536 . 1 1 1 A 45 45 LEU CB C 399 43.574 45.395 -1.821 1
1 540 . 1 1 1 A 45 45 LEU N N 399 118.469 122.047 -3.578 1
1 541 . 1 1 1 A 46 46 MET H H 400 8.707 8.640 0.067 1
1 542 . 1 1 1 A 46 46 MET HA H 400 4.842 5.051 -0.209 1
1 550 . 1 1 1 A 46 46 MET C C 400 170.736 174.287 -3.551 1
1 551 . 1 1 1 A 46 46 MET CA C 400 52.804 54.096 -1.292 1
1 552 . 1 1 1 A 46 46 MET CB C 400 31.945 35.476 -3.531 1
1 555 . 1 1 1 A 46 46 MET N N 400 114.897 120.293 -5.396 1
1 556 . 1 1 1 A 47 47 CYS H H 401 9.436 8.202 1.234 1
1 557 . 1 1 1 A 47 47 CYS HA H 401 5.629 5.050 0.579 1
1 560 . 1 1 1 A 47 47 CYS C C 401 173.909 176.107 -2.198 1
1 561 . 1 1 1 A 47 47 CYS CA C 401 54.325 56.916 -2.591 1
1 562 . 1 1 1 A 47 47 CYS CB C 401 30.725 29.910 0.815 1
1 563 . 1 1 1 A 47 47 CYS N N 401 119.575 119.148 0.427 1
1 564 . 1 1 1 A 48 48 THR H H 402 9.842 8.981 0.861 1
1 565 . 1 1 1 A 48 48 THR HA H 402 3.768 4.039 -0.271 1
1 570 . 1 1 1 A 48 48 THR C C 402 174.333 176.326 -1.993 1
1 571 . 1 1 1 A 48 48 THR CA C 402 64.516 66.079 -1.563 1
1 572 . 1 1 1 A 48 48 THR CB C 402 66.288 68.725 -2.437 1
1 574 . 1 1 1 A 48 48 THR N N 402 119.945 119.206 0.739 1
1 575 . 1 1 1 A 49 49 SER H H 403 8.355 8.060 0.295 1
1 576 . 1 1 1 A 49 49 SER HA H 403 4.222 4.063 0.159 1
1 579 . 1 1 1 A 49 49 SER C C 403 175.059 176.568 -1.509 1
1 580 . 1 1 1 A 49 49 SER CA C 403 59.828 62.083 -2.255 1
1 581 . 1 1 1 A 49 49 SER CB C 403 59.717 62.723 -3.006 1
1 582 . 1 1 1 A 49 49 SER N N 403 120.468 117.486 2.982 1
1 583 . 1 1 1 A 50 50 CYS H H 404 9.464 7.799 1.665 1
1 584 . 1 1 1 A 50 50 CYS HA H 404 3.922 4.362 -0.440 1
1 587 . 1 1 1 A 50 50 CYS C C 404 176.081 177.124 -1.043 1
1 588 . 1 1 1 A 50 50 CYS CA C 404 63.076 63.211 -0.135 1
1 589 . 1 1 1 A 50 50 CYS CB C 404 26.078 27.584 -1.506 1
1 590 . 1 1 1 A 50 50 CYS N N 404 126.744 119.607 7.137 1
1 591 . 1 1 1 A 51 51 LEU H H 405 7.948 8.171 -0.223 1
1 592 . 1 1 1 A 51 51 LEU HA H 405 4.064 4.148 -0.084 1
1 602 . 1 1 1 A 51 51 LEU C C 405 175.495 178.866 -3.371 1
1 603 . 1 1 1 A 51 51 LEU CA C 405 55.914 57.766 -1.852 1
1 604 . 1 1 1 A 51 51 LEU CB C 405 38.662 41.736 -3.074 1
1 607 . 1 1 1 A 51 51 LEU N N 405 121.951 122.704 -0.753 1
1 608 . 1 1 1 A 52 52 THR H H 406 8.786 8.503 0.283 1
1 609 . 1 1 1 A 52 52 THR HA H 406 4.024 3.901 0.123 1
1 614 . 1 1 1 A 52 52 THR C C 406 174.139 176.335 -2.196 1
1 615 . 1 1 1 A 52 52 THR CA C 406 64.017 66.337 -2.320 1
1 616 . 1 1 1 A 52 52 THR CB C 406 66.115 68.509 -2.394 1
1 618 . 1 1 1 A 52 52 THR N N 406 115.258 115.784 -0.526 1
1 619 . 1 1 1 A 53 53 SER H H 407 8.115 8.154 -0.039 1
1 620 . 1 1 1 A 53 53 SER HA H 407 4.204 4.257 -0.053 1
1 623 . 1 1 1 A 53 53 SER C C 407 174.456 176.365 -1.909 1
1 624 . 1 1 1 A 53 53 SER CA C 407 59.090 62.796 -3.706 1
1 625 . 1 1 1 A 53 53 SER CB C 407 60.146 63.442 -3.296 1
1 626 . 1 1 1 A 53 53 SER N N 407 116.852 116.692 0.160 1
1 627 . 1 1 1 A 54 54 TRP H H 408 8.123 7.738 0.385 1
1 628 . 1 1 1 A 54 54 TRP HA H 408 4.371 4.223 0.148 1
1 637 . 1 1 1 A 54 54 TRP C C 408 175.981 178.561 -2.580 1
1 638 . 1 1 1 A 54 54 TRP CA C 408 57.323 60.859 -3.536 1
1 639 . 1 1 1 A 54 54 TRP CB C 408 26.812 29.460 -2.648 1
1 645 . 1 1 1 A 54 54 TRP N N 408 123.556 123.681 -0.125 1
1 647 . 1 1 1 A 55 55 GLN H H 409 8.502 8.248 0.254 1
1 648 . 1 1 1 A 55 55 GLN HA H 409 3.999 3.925 0.074 1
1 655 . 1 1 1 A 55 55 GLN C C 409 177.300 177.850 -0.550 1
1 656 . 1 1 1 A 55 55 GLN CA C 409 56.484 58.660 -2.176 1
1 657 . 1 1 1 A 55 55 GLN CB C 409 26.190 28.020 -1.830 1
1 659 . 1 1 1 A 55 55 GLN N N 409 118.044 118.782 -0.738 1
1 661 . 1 1 1 A 56 56 GLU H H 410 8.467 8.431 0.036 1
1 662 . 1 1 1 A 56 56 GLU HA H 410 4.057 4.062 -0.005 1
1 667 . 1 1 1 A 56 56 GLU C C 410 174.787 176.658 -1.871 1
1 668 . 1 1 1 A 56 56 GLU CA C 410 55.909 58.696 -2.787 1
1 669 . 1 1 1 A 56 56 GLU CB C 410 26.895 29.220 -2.325 1
1 671 . 1 1 1 A 56 56 GLU N N 410 119.448 118.320 1.128 1
1 672 . 1 1 1 A 57 57 SER H H 411 7.438 7.516 -0.078 1
1 673 . 1 1 1 A 57 57 SER HA H 411 4.607 4.552 0.055 1
1 676 . 1 1 1 A 57 57 SER C C 411 170.849 173.815 -2.966 1
1 677 . 1 1 1 A 57 57 SER CA C 411 55.540 57.111 -1.571 1
1 678 . 1 1 1 A 57 57 SER CB C 411 60.928 63.221 -2.293 1
1 679 . 1 1 1 A 57 57 SER N N 411 113.752 115.208 -1.456 1
1 680 . 1 1 1 A 58 58 GLU H H 412 7.855 7.721 0.134 1
1 681 . 1 1 1 A 58 58 GLU HA H 412 3.772 4.018 -0.246 1
1 686 . 1 1 1 A 58 58 GLU C C 412 173.743 175.746 -2.003 1
1 687 . 1 1 1 A 58 58 GLU CA C 412 54.442 56.960 -2.518 1
1 688 . 1 1 1 A 58 58 GLU CB C 412 24.603 28.451 -3.848 1
1 690 . 1 1 1 A 58 58 GLU N N 412 115.908 118.119 -2.211 1
1 691 . 1 1 1 A 59 59 GLY H H 413 7.588 8.538 -0.950 1
1 692 . 1 1 1 A 59 59 GLY HA2 H 413 1.643 3.540 -1.897 1
1 693 . 1 1 1 A 59 59 GLY HA3 H 413 2.949 3.856 -0.907 1
1 694 . 1 1 1 A 59 59 GLY C C 413 170.850 174.969 -4.119 1
1 695 . 1 1 1 A 59 59 GLY CA C 413 41.724 47.186 -5.462 1
1 696 . 1 1 1 A 59 59 GLY N N 413 108.032 111.955 -3.923 1
1 697 . 1 1 1 A 60 60 GLN H H 414 7.973 8.161 -0.188 1
1 698 . 1 1 1 A 60 60 GLN HA H 414 4.366 4.318 0.048 1
1 705 . 1 1 1 A 60 60 GLN C C 414 173.108 175.872 -2.764 1
1 706 . 1 1 1 A 60 60 GLN CA C 414 52.422 55.152 -2.730 1
1 707 . 1 1 1 A 60 60 GLN CB C 414 27.049 27.561 -0.512 1
1 709 . 1 1 1 A 60 60 GLN N N 414 122.690 119.567 3.123 1
1 711 . 1 1 1 A 61 61 GLY H H 415 8.301 8.088 0.213 1
1 712 . 1 1 1 A 61 61 GLY HA2 H 415 3.700 4.194 -0.494 1
1 713 . 1 1 1 A 61 61 GLY HA3 H 415 3.920 4.224 -0.304 1
1 714 . 1 1 1 A 61 61 GLY C C 415 170.249 174.207 -3.958 1
1 715 . 1 1 1 A 61 61 GLY CA C 415 42.210 44.178 -1.968 1
1 716 . 1 1 1 A 61 61 GLY N N 415 110.794 110.026 0.768 1
1 717 . 1 1 1 A 62 62 CYS H H 416 8.549 8.452 0.097 1
1 718 . 1 1 1 A 62 62 CYS HA H 416 4.227 4.681 -0.454 1
1 721 . 1 1 1 A 62 62 CYS C C 416 172.914 175.368 -2.454 1
1 722 . 1 1 1 A 62 62 CYS CA C 416 54.008 58.612 -4.604 1
1 723 . 1 1 1 A 62 62 CYS CB C 416 29.716 27.373 2.343 1
1 724 . 1 1 1 A 62 62 CYS N N 416 123.683 120.488 3.195 1
1 725 . 1 1 1 A 63 63 PRO HA H 417 2.611 2.460 0.151 1
1 732 . 1 1 1 A 63 63 PRO C C 417 174.143 178.067 -3.924 1
1 733 . 1 1 1 A 63 63 PRO CA C 417 61.689 63.881 -2.192 1
1 734 . 1 1 1 A 63 63 PRO CB C 417 28.534 31.182 -2.648 1
1 737 . 1 1 1 A 64 64 PHE H H 418 8.968 7.774 1.194 1
1 738 . 1 1 1 A 64 64 PHE HA H 418 4.250 4.080 0.170 1
1 746 . 1 1 1 A 64 64 PHE C C 418 174.243 178.501 -4.258 1
1 747 . 1 1 1 A 64 64 PHE CA C 418 56.720 60.441 -3.721 1
1 748 . 1 1 1 A 64 64 PHE CB C 418 36.458 39.237 -2.779 1
1 752 . 1 1 1 A 64 64 PHE N N 418 117.008 115.926 1.082 1
1 753 . 1 1 1 A 65 65 CYS H H 419 7.968 8.009 -0.041 1
1 754 . 1 1 1 A 65 65 CYS HA H 419 4.906 4.445 0.461 1
1 757 . 1 1 1 A 65 65 CYS C C 419 173.198 174.924 -1.726 1
1 758 . 1 1 1 A 65 65 CYS CA C 419 55.870 59.983 -4.113 1
1 759 . 1 1 1 A 65 65 CYS CB C 419 30.559 28.958 1.601 1
1 760 . 1 1 1 A 65 65 CYS N N 419 117.505 117.132 0.373 1
1 761 . 1 1 1 A 66 66 ARG H H 420 8.761 7.913 0.848 1
1 762 . 1 1 1 A 66 66 ARG HA H 420 4.365 4.362 0.003 1
1 769 . 1 1 1 A 66 66 ARG C C 420 172.921 174.797 -1.876 1
1 770 . 1 1 1 A 66 66 ARG CA C 420 54.763 57.097 -2.334 1
1 771 . 1 1 1 A 66 66 ARG CB C 420 24.286 26.967 -2.681 1
1 774 . 1 1 1 A 66 66 ARG N N 420 118.763 116.152 2.611 1
1 775 . 1 1 1 A 67 67 CYS H H 421 8.223 7.889 0.334 1
1 776 . 1 1 1 A 67 67 CYS HA H 421 4.419 4.594 -0.175 1
1 779 . 1 1 1 A 67 67 CYS C C 421 171.160 174.767 -3.607 1
1 780 . 1 1 1 A 67 67 CYS CA C 421 57.119 57.961 -0.842 1
1 781 . 1 1 1 A 67 67 CYS CB C 421 25.911 29.970 -4.059 1
1 782 . 1 1 1 A 67 67 CYS N N 421 120.627 116.641 3.986 1
1 783 . 1 1 1 A 68 68 GLU H H 422 8.416 8.487 -0.071 1
1 784 . 1 1 1 A 68 68 GLU HA H 422 4.025 4.140 -0.115 1
1 789 . 1 1 1 A 68 68 GLU C C 422 173.764 176.403 -2.639 1
1 790 . 1 1 1 A 68 68 GLU CA C 422 54.752 57.369 -2.617 1
1 791 . 1 1 1 A 68 68 GLU CB C 422 27.302 29.813 -2.511 1
1 793 . 1 1 1 A 68 68 GLU N N 422 122.370 120.173 2.197 1
1 794 . 1 1 1 A 69 69 ILE H H 423 8.648 8.838 -0.190 1
1 795 . 1 1 1 A 69 69 ILE HA H 423 4.012 4.591 -0.579 1
1 805 . 1 1 1 A 69 69 ILE C C 423 174.257 175.432 -1.175 1
1 806 . 1 1 1 A 69 69 ILE CA C 423 59.740 60.828 -1.088 1
1 807 . 1 1 1 A 69 69 ILE CB C 423 35.846 39.303 -3.457 1
1 811 . 1 1 1 A 69 69 ILE N N 423 125.988 125.826 0.162 1
1 812 . 1 1 1 A 70 70 LYS H H 424 9.185 9.141 0.044 1
1 813 . 1 1 1 A 70 70 LYS HA H 424 4.434 4.527 -0.093 1
1 822 . 1 1 1 A 70 70 LYS C C 424 173.880 177.074 -3.194 1
1 823 . 1 1 1 A 70 70 LYS CA C 424 53.378 57.146 -3.768 1
1 824 . 1 1 1 A 70 70 LYS CB C 424 30.397 34.115 -3.718 1
1 828 . 1 1 1 A 70 70 LYS N N 424 128.977 126.930 2.047 1
1 829 . 1 1 1 A 71 71 GLY H H 425 7.810 7.829 -0.019 1
1 830 . 1 1 1 A 71 71 GLY HA2 H 425 4.094 4.162 -0.068 1
1 831 . 1 1 1 A 71 71 GLY HA3 H 425 4.159 4.165 -0.006 1
1 832 . 1 1 1 A 71 71 GLY C C 425 168.179 172.612 -4.433 1
1 833 . 1 1 1 A 71 71 GLY CA C 425 42.326 44.342 -2.016 1
1 834 . 1 1 1 A 71 71 GLY N N 425 107.696 104.067 3.629 1
1 835 . 1 1 1 A 72 72 THR H H 426 8.048 8.558 -0.510 1
1 836 . 1 1 1 A 72 72 THR HA H 426 5.258 5.682 -0.424 1
1 841 . 1 1 1 A 72 72 THR C C 426 170.979 173.273 -2.294 1
1 842 . 1 1 1 A 72 72 THR CA C 426 56.755 60.225 -3.470 1
1 843 . 1 1 1 A 72 72 THR CB C 426 69.226 72.052 -2.826 1
1 845 . 1 1 1 A 72 72 THR N N 426 109.122 111.101 -1.979 1
1 846 . 1 1 1 A 73 73 GLU H H 427 8.912 8.974 -0.062 1
1 847 . 1 1 1 A 73 73 GLU HA H 427 4.954 4.798 0.156 1
1 852 . 1 1 1 A 73 73 GLU C C 427 170.353 173.788 -3.435 1
1 853 . 1 1 1 A 73 73 GLU CA C 427 50.182 53.199 -3.017 1
1 854 . 1 1 1 A 73 73 GLU CB C 427 30.559 32.123 -1.564 1
1 856 . 1 1 1 A 73 73 GLU N N 427 121.703 122.208 -0.505 1
1 1 . 1 1 1 A 74 74 PRO HA H 428 4.372 4.977 -0.605 1
1 2 . 1 1 1 A 74 74 PRO C C 428 173.839 176.152 -2.313 1
1 3 . 1 1 1 A 74 74 PRO CA C 428 60.241 62.687 -2.446 1
1 4 . 1 1 1 A 74 74 PRO CB C 428 29.299 32.557 -3.258 1
1 857 . 1 1 1 A 74 74 PRO HA H 428 4.782 4.977 -0.195 1
1 864 . 1 1 1 A 74 74 PRO C C 428 174.027 176.152 -2.125 1
1 865 . 1 1 1 A 74 74 PRO CA C 428 59.771 62.687 -2.916 1
1 866 . 1 1 1 A 74 74 PRO CB C 428 29.633 32.557 -2.924 1
1 7 . 1 1 1 A 75 75 ILE H H 429 8.144 8.954 -0.810 1
1 8 . 1 1 1 A 75 75 ILE HA H 429 4.086 4.185 -0.099 1
1 15 . 1 1 1 A 75 75 ILE C C 429 173.426 176.285 -2.859 1
1 16 . 1 1 1 A 75 75 ILE CA C 429 58.339 62.254 -3.915 1
1 17 . 1 1 1 A 75 75 ILE CB C 429 35.988 38.230 -2.242 1
1 21 . 1 1 1 A 75 75 ILE N N 429 121.551 119.621 1.930 1
1 869 . 1 1 1 A 75 75 ILE H H 429 7.682 8.954 -1.272 1
1 870 . 1 1 1 A 75 75 ILE HA H 429 4.282 4.185 0.097 1
1 880 . 1 1 1 A 75 75 ILE C C 429 172.510 176.285 -3.775 1
1 881 . 1 1 1 A 75 75 ILE CA C 429 57.456 62.254 -4.798 1
1 882 . 1 1 1 A 75 75 ILE CB C 429 37.903 38.230 -0.327 1
1 886 . 1 1 1 A 75 75 ILE N N 429 119.651 119.621 0.030 1
1 1 . 1 1 1 A 76 76 VAL HA H 430 4.086 3.826 0.260 1
1 2 . 1 1 1 A 76 76 VAL CA C 430 59.372 62.481 -3.109 1
1 22 . 1 1 1 A 76 76 VAL H H 430 8.221 7.517 0.704 1
1 23 . 1 1 1 A 76 76 VAL HA H 430 4.083 3.826 0.257 1
1 24 . 1 1 1 A 76 76 VAL C C 430 173.067 175.038 -1.971 1
1 25 . 1 1 1 A 76 76 VAL CA C 430 59.445 62.481 -3.036 1
1 26 . 1 1 1 A 76 76 VAL CB C 430 30.407 30.344 0.063 1
1 27 . 1 1 1 A 76 76 VAL N N 430 125.930 118.757 7.173 1
1 887 . 1 1 1 A 76 76 VAL H H 430 8.122 7.517 0.605 1
1 888 . 1 1 1 A 76 76 VAL HA H 430 4.197 3.826 0.371 1
1 890 . 1 1 1 A 76 76 VAL C C 430 172.971 175.038 -2.067 1
1 891 . 1 1 1 A 76 76 VAL CA C 430 58.821 62.481 -3.660 1
1 892 . 1 1 1 A 76 76 VAL CB C 430 30.807 30.344 0.463 1
1 895 . 1 1 1 A 76 76 VAL N N 430 124.178 118.757 5.421 1
1 4 . 1 1 1 A 77 77 VAL H H 431 8.204 8.024 0.180 1
1 5 . 1 1 1 A 77 77 VAL HA H 431 4.049 4.519 -0.470 1
1 6 . 1 1 1 A 77 77 VAL C C 431 172.636 174.687 -2.051 1
1 7 . 1 1 1 A 77 77 VAL CA C 431 59.315 60.676 -1.361 1
1 8 . 1 1 1 A 77 77 VAL CB C 431 30.219 33.363 -3.144 1
1 9 . 1 1 1 A 77 77 VAL N N 431 125.320 119.591 5.729 1
1 28 . 1 1 1 A 77 77 VAL H H 431 8.412 8.024 0.388 1
1 29 . 1 1 1 A 77 77 VAL HA H 431 4.038 4.519 -0.481 1
1 37 . 1 1 1 A 77 77 VAL C C 431 172.617 174.687 -2.070 1
1 38 . 1 1 1 A 77 77 VAL CA C 431 59.137 60.676 -1.539 1
1 39 . 1 1 1 A 77 77 VAL CB C 431 30.292 33.363 -3.071 1
1 42 . 1 1 1 A 77 77 VAL N N 431 125.655 119.591 6.064 1
1 896 . 1 1 1 A 77 77 VAL H H 431 8.448 8.024 0.424 1
1 897 . 1 1 1 A 77 77 VAL HA H 431 4.087 4.519 -0.432 1
1 905 . 1 1 1 A 77 77 VAL C C 431 172.493 174.687 -2.194 1
1 906 . 1 1 1 A 77 77 VAL CA C 431 59.185 60.676 -1.491 1
1 907 . 1 1 1 A 77 77 VAL CB C 431 30.084 33.363 -3.279 1
1 910 . 1 1 1 A 77 77 VAL N N 431 125.770 119.591 6.179 1
1 43 . 1 1 1 A 78 78 ASP H H 432 8.419 8.538 -0.119 1
1 44 . 1 1 1 A 78 78 ASP HA H 432 4.829 4.894 -0.065 1
1 45 . 1 1 1 A 78 78 ASP C C 432 172.252 175.902 -3.650 1
1 46 . 1 1 1 A 78 78 ASP CA C 432 49.320 51.348 -2.028 1
1 47 . 1 1 1 A 78 78 ASP CB C 432 39.066 42.283 -3.217 1
1 48 . 1 1 1 A 78 78 ASP N N 432 126.226 123.800 2.426 1
1 911 . 1 1 1 A 78 78 ASP H H 432 8.493 8.538 -0.045 1
1 912 . 1 1 1 A 78 78 ASP HA H 432 4.852 4.894 -0.042 1
1 915 . 1 1 1 A 78 78 ASP C C 432 172.048 175.902 -3.854 1
1 916 . 1 1 1 A 78 78 ASP CA C 432 49.233 51.348 -2.115 1
1 917 . 1 1 1 A 78 78 ASP CB C 432 38.858 42.283 -3.425 1
1 918 . 1 1 1 A 78 78 ASP N N 432 126.705 123.800 2.905 1
1 10 . 1 1 1 A 79 79 PRO CA C 433 63.865 65.657 -1.792 1
1 49 . 1 1 1 A 79 79 PRO C C 433 173.867 177.533 -3.666 1
1 919 . 1 1 1 A 79 79 PRO HA H 433 4.237 4.386 -0.149 1
1 926 . 1 1 1 A 79 79 PRO C C 433 173.812 177.533 -3.721 1
1 927 . 1 1 1 A 79 79 PRO CA C 433 60.627 65.657 -5.030 1
1 928 . 1 1 1 A 79 79 PRO CB C 433 29.329 31.703 -2.374 1
1 11 . 1 1 1 A 80 80 PHE H H 434 8.182 8.325 -0.143 1
1 12 . 1 1 1 A 80 80 PHE HA H 434 4.499 4.386 0.113 1
1 13 . 1 1 1 A 80 80 PHE C C 434 171.680 173.922 -2.242 1
1 14 . 1 1 1 A 80 80 PHE CA C 434 54.657 60.154 -5.497 1
1 15 . 1 1 1 A 80 80 PHE CB C 434 36.272 38.618 -2.346 1
1 16 . 1 1 1 A 80 80 PHE N N 434 118.611 119.151 -0.540 1
1 50 . 1 1 1 A 80 80 PHE H H 434 8.191 8.325 -0.134 1
1 51 . 1 1 1 A 80 80 PHE HA H 434 4.528 4.386 0.142 1
1 54 . 1 1 1 A 80 80 PHE C C 434 172.457 173.922 -1.465 1
1 55 . 1 1 1 A 80 80 PHE CA C 434 54.828 60.154 -5.326 1
1 56 . 1 1 1 A 80 80 PHE CB C 434 36.457 38.618 -2.161 1
1 57 . 1 1 1 A 80 80 PHE N N 434 118.871 119.151 -0.280 1
1 931 . 1 1 1 A 80 80 PHE H H 434 8.191 8.325 -0.134 1
1 932 . 1 1 1 A 80 80 PHE HA H 434 4.463 4.386 0.077 1
1 939 . 1 1 1 A 80 80 PHE C C 434 172.283 173.922 -1.639 1
1 940 . 1 1 1 A 80 80 PHE CA C 434 54.971 60.154 -5.183 1
1 941 . 1 1 1 A 80 80 PHE CB C 434 36.490 38.618 -2.128 1
1 944 . 1 1 1 A 80 80 PHE N N 434 119.263 119.151 0.112 1
1 17 . 1 1 1 A 81 81 ASP H H 435 7.490 8.337 -0.847 1
1 18 . 1 1 1 A 81 81 ASP HA H 435 4.698 4.840 -0.142 1
1 19 . 1 1 1 A 81 81 ASP C C 435 171.662 175.136 -3.474 1
1 20 . 1 1 1 A 81 81 ASP CA C 435 49.570 51.749 -2.179 1
1 21 . 1 1 1 A 81 81 ASP CB C 435 40.104 41.031 -0.927 1
1 22 . 1 1 1 A 81 81 ASP N N 435 120.304 119.041 1.263 1
1 58 . 1 1 1 A 81 81 ASP H H 435 7.881 8.337 -0.456 1
1 59 . 1 1 1 A 81 81 ASP HA H 435 4.801 4.840 -0.039 1
1 60 . 1 1 1 A 81 81 ASP C C 435 171.144 175.136 -3.992 1
1 61 . 1 1 1 A 81 81 ASP CA C 435 49.406 51.749 -2.343 1
1 62 . 1 1 1 A 81 81 ASP CB C 435 38.618 41.031 -2.413 1
1 63 . 1 1 1 A 81 81 ASP N N 435 123.108 119.041 4.067 1
1 945 . 1 1 1 A 81 81 ASP H H 435 7.823 8.337 -0.514 1
1 946 . 1 1 1 A 81 81 ASP HA H 435 4.759 4.840 -0.081 1
1 949 . 1 1 1 A 81 81 ASP C C 435 171.057 175.136 -4.079 1
1 950 . 1 1 1 A 81 81 ASP CA C 435 49.174 51.749 -2.575 1
1 951 . 1 1 1 A 81 81 ASP CB C 435 38.725 41.031 -2.306 1
1 952 . 1 1 1 A 81 81 ASP N N 435 123.530 119.041 4.489 1
1 23 . 1 1 1 A 82 82 PRO HA H 436 4.758 4.619 0.139 1
1 24 . 1 1 1 A 82 82 PRO C C 436 172.944 176.288 -3.344 1
1 25 . 1 1 1 A 82 82 PRO CA C 436 60.134 63.997 -3.863 1
1 26 . 1 1 1 A 82 82 PRO CB C 436 31.425 32.734 -1.309 1
1 64 . 1 1 1 A 82 82 PRO HA H 436 4.364 4.619 -0.255 1
1 67 . 1 1 1 A 82 82 PRO C C 436 173.563 176.288 -2.725 1
1 68 . 1 1 1 A 82 82 PRO CA C 436 60.729 63.997 -3.268 1
1 69 . 1 1 1 A 82 82 PRO CB C 436 29.160 32.734 -3.574 1
1 953 . 1 1 1 A 82 82 PRO HA H 436 4.296 4.619 -0.323 1
1 960 . 1 1 1 A 82 82 PRO C C 436 173.494 176.288 -2.794 1
1 961 . 1 1 1 A 82 82 PRO CA C 436 60.625 63.997 -3.372 1
1 962 . 1 1 1 A 82 82 PRO CB C 436 29.237 32.734 -3.497 1
1 1 . 2 1 1 A 3 3 LEU HA H 357 4.257 4.680 -0.423 1
1 11 . 2 1 1 A 3 3 LEU C C 357 174.994 176.593 -1.599 1
1 12 . 2 1 1 A 3 3 LEU CA C 357 53.329 54.457 -1.128 1
1 13 . 2 1 1 A 3 3 LEU CB C 357 39.382 42.333 -2.951 1
1 17 . 2 1 1 A 4 4 GLN H H 358 8.234 7.908 0.326 1
1 18 . 2 1 1 A 4 4 GLN HA H 358 4.211 4.250 -0.039 1
1 25 . 2 1 1 A 4 4 GLN C C 358 173.357 176.153 -2.796 1
1 26 . 2 1 1 A 4 4 GLN CA C 358 53.791 58.200 -4.409 1
1 27 . 2 1 1 A 4 4 GLN CB C 358 26.456 27.685 -1.229 1
1 29 . 2 1 1 A 4 4 GLN N N 358 119.506 116.715 2.791 1
1 31 . 2 1 1 A 5 5 ASP H H 359 8.090 8.669 -0.579 1
1 32 . 2 1 1 A 5 5 ASP HA H 359 4.458 4.851 -0.393 1
1 35 . 2 1 1 A 5 5 ASP C C 359 173.492 176.952 -3.460 1
1 36 . 2 1 1 A 5 5 ASP CA C 359 52.309 55.368 -3.059 1
1 37 . 2 1 1 A 5 5 ASP CB C 359 38.312 42.106 -3.794 1
1 38 . 2 1 1 A 5 5 ASP N N 359 120.683 120.975 -0.292 1
1 39 . 2 1 1 A 6 6 HIS H H 360 8.103 8.026 0.077 1
1 40 . 2 1 1 A 6 6 HIS HA H 360 4.540 4.130 0.410 1
1 45 . 2 1 1 A 6 6 HIS C C 360 172.801 174.291 -1.490 1
1 46 . 2 1 1 A 6 6 HIS CA C 360 53.874 60.285 -6.411 1
1 47 . 2 1 1 A 6 6 HIS CB C 360 27.878 27.637 0.241 1
1 50 . 2 1 1 A 6 6 HIS N N 360 118.844 113.937 4.907 1
1 51 . 2 1 1 A 7 7 ILE H H 361 7.862 8.782 -0.920 1
1 52 . 2 1 1 A 7 7 ILE HA H 361 4.010 4.196 -0.186 1
1 62 . 2 1 1 A 7 7 ILE C C 361 173.268 175.029 -1.761 1
1 63 . 2 1 1 A 7 7 ILE CA C 361 58.740 60.680 -1.940 1
1 64 . 2 1 1 A 7 7 ILE CB C 361 35.788 37.853 -2.065 1
1 68 . 2 1 1 A 7 7 ILE N N 361 121.598 119.245 2.353 1
1 69 . 2 1 1 A 8 8 LYS H H 362 8.231 8.821 -0.590 1
1 70 . 2 1 1 A 8 8 LYS HA H 362 4.313 4.607 -0.294 1
1 79 . 2 1 1 A 8 8 LYS C C 362 173.899 175.749 -1.850 1
1 80 . 2 1 1 A 8 8 LYS CA C 362 53.677 55.725 -2.048 1
1 81 . 2 1 1 A 8 8 LYS CB C 362 30.355 32.710 -2.355 1
1 85 . 2 1 1 A 8 8 LYS N N 362 124.980 128.585 -3.605 1
1 86 . 2 1 1 A 9 9 VAL H H 363 8.044 8.126 -0.082 1
1 87 . 2 1 1 A 9 9 VAL HA H 363 4.089 4.470 -0.381 1
1 95 . 2 1 1 A 9 9 VAL C C 363 173.760 176.222 -2.462 1
1 96 . 2 1 1 A 9 9 VAL CA C 363 59.814 61.151 -1.337 1
1 97 . 2 1 1 A 9 9 VAL CB C 363 30.058 33.280 -3.222 1
1 100 . 2 1 1 A 9 9 VAL N N 363 121.366 123.868 -2.502 1
1 101 . 2 1 1 A 10 10 THR H H 364 8.076 8.032 0.044 1
1 102 . 2 1 1 A 10 10 THR HA H 364 4.302 4.508 -0.206 1
1 107 . 2 1 1 A 10 10 THR C C 364 172.135 174.756 -2.621 1
1 108 . 2 1 1 A 10 10 THR CA C 364 59.134 61.672 -2.538 1
1 109 . 2 1 1 A 10 10 THR CB C 364 67.415 69.269 -1.854 1
1 111 . 2 1 1 A 10 10 THR N N 364 116.817 114.916 1.901 1
1 112 . 2 1 1 A 11 11 GLN H H 365 8.463 8.215 0.248 1
1 113 . 2 1 1 A 11 11 GLN HA H 365 4.046 4.378 -0.332 1
1 120 . 2 1 1 A 11 11 GLN C C 365 173.944 175.740 -1.796 1
1 121 . 2 1 1 A 11 11 GLN CA C 365 54.517 56.317 -1.800 1
1 122 . 2 1 1 A 11 11 GLN CB C 365 26.250 29.961 -3.711 1
1 124 . 2 1 1 A 11 11 GLN N N 365 122.059 120.031 2.028 1
1 126 . 2 1 1 A 12 12 GLU H H 366 8.449 7.336 1.113 1
1 127 . 2 1 1 A 12 12 GLU HA H 366 4.093 4.747 -0.654 1
1 132 . 2 1 1 A 12 12 GLU C C 366 174.746 176.578 -1.832 1
1 133 . 2 1 1 A 12 12 GLU CA C 366 55.235 54.964 0.271 1
1 134 . 2 1 1 A 12 12 GLU CB C 366 27.180 31.692 -4.512 1
1 136 . 2 1 1 A 12 12 GLU N N 366 120.415 120.610 -0.195 1
1 137 . 2 1 1 A 13 13 GLN H H 367 8.031 8.928 -0.897 1
1 138 . 2 1 1 A 13 13 GLN HA H 367 4.113 4.203 -0.090 1
1 145 . 2 1 1 A 13 13 GLN C C 367 173.693 177.024 -3.331 1
1 146 . 2 1 1 A 13 13 GLN CA C 367 54.132 58.473 -4.341 1
1 147 . 2 1 1 A 13 13 GLN CB C 367 26.420 29.151 -2.731 1
1 149 . 2 1 1 A 13 13 GLN N N 367 119.721 122.371 -2.650 1
1 151 . 2 1 1 A 14 14 TYR H H 368 8.111 7.791 0.320 1
1 152 . 2 1 1 A 14 14 TYR HA H 368 4.339 4.704 -0.365 1
1 159 . 2 1 1 A 14 14 TYR C C 368 173.916 176.595 -2.679 1
1 160 . 2 1 1 A 14 14 TYR CA C 368 56.572 58.989 -2.417 1
1 161 . 2 1 1 A 14 14 TYR CB C 368 35.879 37.626 -1.747 1
1 164 . 2 1 1 A 14 14 TYR N N 368 120.541 118.974 1.567 1
1 165 . 2 1 1 A 15 15 GLU H H 369 8.287 8.323 -0.036 1
1 166 . 2 1 1 A 15 15 GLU HA H 369 4.009 4.358 -0.349 1
1 171 . 2 1 1 A 15 15 GLU C C 369 174.448 178.026 -3.578 1
1 172 . 2 1 1 A 15 15 GLU CA C 369 55.047 58.983 -3.936 1
1 173 . 2 1 1 A 15 15 GLU CB C 369 27.226 29.873 -2.647 1
1 175 . 2 1 1 A 15 15 GLU N N 369 120.398 122.633 -2.235 1
1 176 . 2 1 1 A 16 16 LEU H H 370 7.785 7.856 -0.071 1
1 177 . 2 1 1 A 16 16 LEU HA H 370 4.138 4.321 -0.183 1
1 187 . 2 1 1 A 16 16 LEU C C 370 175.089 177.722 -2.633 1
1 188 . 2 1 1 A 16 16 LEU CA C 370 53.425 54.779 -1.354 1
1 189 . 2 1 1 A 16 16 LEU CB C 370 39.554 41.596 -2.042 1
1 193 . 2 1 1 A 16 16 LEU N N 370 121.323 116.167 5.156 1
1 194 . 2 1 1 A 17 17 TYR H H 371 8.038 7.831 0.207 1
1 195 . 2 1 1 A 17 17 TYR HA H 371 4.380 4.415 -0.035 1
1 202 . 2 1 1 A 17 17 TYR C C 371 173.931 175.789 -1.858 1
1 203 . 2 1 1 A 17 17 TYR CA C 371 56.143 60.097 -3.954 1
1 204 . 2 1 1 A 17 17 TYR CB C 371 35.501 39.504 -4.003 1
1 207 . 2 1 1 A 17 17 TYR N N 371 119.465 119.726 -0.261 1
1 208 . 2 1 1 A 18 18 CYS H H 372 8.021 7.512 0.509 1
1 209 . 2 1 1 A 18 18 CYS HA H 372 4.236 4.101 0.135 1
1 212 . 2 1 1 A 18 18 CYS C C 372 172.457 174.887 -2.430 1
1 213 . 2 1 1 A 18 18 CYS CA C 372 56.997 59.778 -2.781 1
1 214 . 2 1 1 A 18 18 CYS CB C 372 25.080 26.562 -1.482 1
1 215 . 2 1 1 A 18 18 CYS N N 372 119.913 114.877 5.036 1
1 216 . 2 1 1 A 19 19 GLU H H 373 8.151 8.265 -0.114 1
1 217 . 2 1 1 A 19 19 GLU HA H 373 4.130 4.363 -0.233 1
1 222 . 2 1 1 A 19 19 GLU C C 373 174.151 176.247 -2.096 1
1 223 . 2 1 1 A 19 19 GLU CA C 373 54.535 58.992 -4.457 1
1 224 . 2 1 1 A 19 19 GLU CB C 373 27.244 29.992 -2.748 1
1 226 . 2 1 1 A 19 19 GLU N N 373 122.431 125.139 -2.708 1
1 227 . 2 1 1 A 20 20 MET H H 374 8.109 7.750 0.359 1
1 228 . 2 1 1 A 20 20 MET HA H 374 4.352 4.779 -0.427 1
1 236 . 2 1 1 A 20 20 MET C C 374 174.200 176.290 -2.090 1
1 237 . 2 1 1 A 20 20 MET CA C 374 53.238 53.899 -0.661 1
1 238 . 2 1 1 A 20 20 MET CB C 374 30.237 34.757 -4.520 1
1 241 . 2 1 1 A 20 20 MET N N 374 119.754 118.807 0.947 1
1 242 . 2 1 1 A 21 21 GLY H H 375 8.231 8.822 -0.591 1
1 243 . 2 1 1 A 21 21 GLY HA2 H 375 3.861 4.162 -0.301 1
1 244 . 2 1 1 A 21 21 GLY HA3 H 375 3.960 4.176 -0.216 1
1 245 . 2 1 1 A 21 21 GLY C C 375 171.928 174.172 -2.244 1
1 246 . 2 1 1 A 21 21 GLY CA C 375 42.930 45.538 -2.608 1
1 247 . 2 1 1 A 21 21 GLY N N 375 109.484 114.433 -4.949 1
1 248 . 2 1 1 A 22 22 SER HA H 376 4.492 4.362 0.130 1
1 251 . 2 1 1 A 22 22 SER C C 376 172.206 173.957 -1.751 1
1 252 . 2 1 1 A 22 22 SER CA C 376 55.570 59.658 -4.088 1
1 253 . 2 1 1 A 22 22 SER CB C 376 61.525 63.533 -2.008 1
1 254 . 2 1 1 A 23 23 THR H H 377 8.470 8.815 -0.345 1
1 255 . 2 1 1 A 23 23 THR HA H 377 4.295 4.476 -0.181 1
1 260 . 2 1 1 A 23 23 THR C C 377 171.811 175.124 -3.313 1
1 261 . 2 1 1 A 23 23 THR CA C 377 58.937 63.327 -4.390 1
1 262 . 2 1 1 A 23 23 THR CB C 377 67.250 69.456 -2.206 1
1 264 . 2 1 1 A 23 23 THR N N 377 124.043 121.974 2.069 1
1 265 . 2 1 1 A 24 24 PHE H H 378 8.374 9.214 -0.840 1
1 266 . 2 1 1 A 24 24 PHE HA H 378 4.239 4.142 0.097 1
1 273 . 2 1 1 A 24 24 PHE C C 378 173.411 177.504 -4.093 1
1 274 . 2 1 1 A 24 24 PHE CA C 378 56.697 61.176 -4.479 1
1 275 . 2 1 1 A 24 24 PHE CB C 378 36.538 39.432 -2.894 1
1 278 . 2 1 1 A 24 24 PHE N N 378 124.732 125.538 -0.806 1
1 279 . 2 1 1 A 25 25 GLN H H 379 8.457 7.777 0.680 1
1 280 . 2 1 1 A 25 25 GLN HA H 379 4.038 4.232 -0.194 1
1 287 . 2 1 1 A 25 25 GLN C C 379 172.431 177.029 -4.598 1
1 288 . 2 1 1 A 25 25 GLN CA C 379 54.078 57.927 -3.849 1
1 289 . 2 1 1 A 25 25 GLN CB C 379 26.414 28.902 -2.488 1
1 291 . 2 1 1 A 25 25 GLN N N 379 118.820 118.050 0.770 1
1 293 . 2 1 1 A 26 26 LEU H H 380 6.985 7.622 -0.637 1
1 294 . 2 1 1 A 26 26 LEU HA H 380 4.229 4.267 -0.038 1
1 304 . 2 1 1 A 26 26 LEU C C 380 173.895 176.593 -2.698 1
1 305 . 2 1 1 A 26 26 LEU CA C 380 52.123 54.678 -2.555 1
1 306 . 2 1 1 A 26 26 LEU CB C 380 40.543 42.695 -2.152 1
1 310 . 2 1 1 A 26 26 LEU N N 380 119.079 120.267 -1.188 1
1 311 . 2 1 1 A 27 27 CYS H H 381 8.905 9.200 -0.295 1
1 312 . 2 1 1 A 27 27 CYS HA H 381 4.013 4.544 -0.531 1
1 315 . 2 1 1 A 27 27 CYS C C 381 174.439 176.186 -1.747 1
1 316 . 2 1 1 A 27 27 CYS CA C 381 57.847 59.710 -1.863 1
1 317 . 2 1 1 A 27 27 CYS CB C 381 28.648 28.348 0.300 1
1 318 . 2 1 1 A 27 27 CYS N N 381 125.151 123.190 1.961 1
1 319 . 2 1 1 A 28 28 LYS H H 382 9.351 8.819 0.532 1
1 320 . 2 1 1 A 28 28 LYS HA H 382 4.157 4.019 0.138 1
1 329 . 2 1 1 A 28 28 LYS C C 382 174.678 178.362 -3.684 1
1 330 . 2 1 1 A 28 28 LYS CA C 382 54.324 58.819 -4.495 1
1 331 . 2 1 1 A 28 28 LYS CB C 382 30.086 32.675 -2.589 1
1 335 . 2 1 1 A 28 28 LYS N N 382 128.840 128.171 0.669 1
1 336 . 2 1 1 A 29 29 ILE H H 383 9.040 7.871 1.169 1
1 337 . 2 1 1 A 29 29 ILE HA H 383 3.804 3.598 0.206 1
1 347 . 2 1 1 A 29 29 ILE C C 383 174.239 177.412 -3.173 1
1 348 . 2 1 1 A 29 29 ILE CA C 383 62.114 65.114 -3.000 1
1 349 . 2 1 1 A 29 29 ILE CB C 383 33.870 38.376 -4.506 1
1 353 . 2 1 1 A 29 29 ILE N N 383 122.718 119.421 3.297 1
1 354 . 2 1 1 A 30 30 CYS H H 384 7.572 7.721 -0.149 1
1 355 . 2 1 1 A 30 30 CYS HA H 384 4.548 4.418 0.130 1
1 358 . 2 1 1 A 30 30 CYS C C 384 172.978 175.031 -2.053 1
1 359 . 2 1 1 A 30 30 CYS CA C 384 54.957 59.665 -4.708 1
1 360 . 2 1 1 A 30 30 CYS CB C 384 29.778 29.265 0.513 1
1 361 . 2 1 1 A 30 30 CYS N N 384 116.356 115.637 0.719 1
1 362 . 2 1 1 A 31 31 ALA H H 385 8.205 8.197 0.008 1
1 363 . 2 1 1 A 31 31 ALA HA H 385 4.107 4.296 -0.189 1
1 367 . 2 1 1 A 31 31 ALA C C 385 173.139 177.106 -3.967 1
1 368 . 2 1 1 A 31 31 ALA CA C 385 50.802 53.356 -2.554 1
1 369 . 2 1 1 A 31 31 ALA CB C 385 14.634 17.579 -2.945 1
1 370 . 2 1 1 A 31 31 ALA N N 385 125.526 121.460 4.066 1
1 371 . 2 1 1 A 32 32 GLU H H 386 8.416 7.949 0.467 1
1 372 . 2 1 1 A 32 32 GLU HA H 386 4.467 4.673 -0.206 1
1 377 . 2 1 1 A 32 32 GLU C C 386 172.325 176.158 -3.833 1
1 378 . 2 1 1 A 32 32 GLU CA C 386 55.146 57.809 -2.663 1
1 379 . 2 1 1 A 32 32 GLU CB C 386 31.181 32.579 -1.398 1
1 381 . 2 1 1 A 32 32 GLU N N 386 117.579 116.320 1.259 1
1 382 . 2 1 1 A 33 33 ASN H H 387 7.872 7.422 0.450 1
1 383 . 2 1 1 A 33 33 ASN HA H 387 4.900 4.831 0.069 1
1 388 . 2 1 1 A 33 33 ASN C C 387 171.355 174.977 -3.622 1
1 389 . 2 1 1 A 33 33 ASN CA C 387 49.320 52.474 -3.154 1
1 390 . 2 1 1 A 33 33 ASN CB C 387 38.457 40.128 -1.671 1
1 391 . 2 1 1 A 33 33 ASN N N 387 120.399 118.260 2.139 1
1 393 . 2 1 1 A 34 34 ASP H H 388 8.565 8.677 -0.112 1
1 394 . 2 1 1 A 34 34 ASP HA H 388 4.679 4.963 -0.284 1
1 397 . 2 1 1 A 34 34 ASP C C 388 174.243 175.882 -1.639 1
1 398 . 2 1 1 A 34 34 ASP CA C 388 51.809 53.791 -1.982 1
1 399 . 2 1 1 A 34 34 ASP CB C 388 38.007 42.536 -4.529 1
1 400 . 2 1 1 A 34 34 ASP N N 388 120.661 122.167 -1.506 1
1 401 . 2 1 1 A 35 35 LYS H H 389 8.544 8.905 -0.361 1
1 402 . 2 1 1 A 35 35 LYS HA H 389 3.411 4.340 -0.929 1
1 409 . 2 1 1 A 35 35 LYS C C 389 172.938 176.560 -3.622 1
1 410 . 2 1 1 A 35 35 LYS CA C 389 54.973 55.815 -0.842 1
1 411 . 2 1 1 A 35 35 LYS CB C 389 30.617 31.652 -1.035 1
1 415 . 2 1 1 A 35 35 LYS N N 389 119.199 121.119 -1.920 1
1 416 . 2 1 1 A 36 36 ASP H H 390 8.327 8.914 -0.587 1
1 417 . 2 1 1 A 36 36 ASP HA H 390 4.724 4.864 -0.140 1
1 420 . 2 1 1 A 36 36 ASP C C 390 172.860 175.262 -2.402 1
1 421 . 2 1 1 A 36 36 ASP CA C 390 51.609 53.556 -1.947 1
1 422 . 2 1 1 A 36 36 ASP CB C 390 39.018 41.105 -2.087 1
1 423 . 2 1 1 A 36 36 ASP N N 390 119.134 121.443 -2.309 1
1 424 . 2 1 1 A 37 37 VAL H H 391 8.544 7.774 0.770 1
1 425 . 2 1 1 A 37 37 VAL HA H 391 4.877 4.795 0.082 1
1 433 . 2 1 1 A 37 37 VAL C C 391 167.519 173.189 -5.670 1
1 434 . 2 1 1 A 37 37 VAL CA C 391 58.259 60.188 -1.929 1
1 435 . 2 1 1 A 37 37 VAL CB C 391 32.277 35.291 -3.014 1
1 438 . 2 1 1 A 37 37 VAL N N 391 121.970 119.564 2.406 1
1 439 . 2 1 1 A 38 38 LYS H H 392 8.621 9.637 -1.016 1
1 440 . 2 1 1 A 38 38 LYS HA H 392 4.991 5.215 -0.224 1
1 449 . 2 1 1 A 38 38 LYS C C 392 172.681 175.277 -2.596 1
1 450 . 2 1 1 A 38 38 LYS CA C 392 51.123 54.858 -3.735 1
1 451 . 2 1 1 A 38 38 LYS CB C 392 33.697 34.438 -0.741 1
1 455 . 2 1 1 A 38 38 LYS N N 392 126.381 129.200 -2.819 1
1 456 . 2 1 1 A 39 39 ILE H H 393 8.723 8.980 -0.257 1
1 457 . 2 1 1 A 39 39 ILE HA H 393 4.239 4.379 -0.140 1
1 467 . 2 1 1 A 39 39 ILE C C 393 172.642 175.609 -2.967 1
1 468 . 2 1 1 A 39 39 ILE CA C 393 57.768 61.064 -3.296 1
1 469 . 2 1 1 A 39 39 ILE CB C 393 35.691 37.406 -1.715 1
1 473 . 2 1 1 A 39 39 ILE N N 393 126.398 128.089 -1.691 1
1 474 . 2 1 1 A 40 40 GLU H H 394 8.506 9.547 -1.041 1
1 475 . 2 1 1 A 40 40 GLU HA H 394 4.753 4.780 -0.027 1
1 480 . 2 1 1 A 40 40 GLU C C 394 173.596 176.405 -2.809 1
1 481 . 2 1 1 A 40 40 GLU CA C 394 49.793 53.235 -3.442 1
1 482 . 2 1 1 A 40 40 GLU CB C 394 28.210 30.668 -2.458 1
1 484 . 2 1 1 A 40 40 GLU N N 394 124.864 128.198 -3.334 1
1 485 . 2 1 1 A 41 41 PRO HA H 395 4.864 4.489 0.375 1
1 492 . 2 1 1 A 41 41 PRO C C 395 175.073 177.082 -2.009 1
1 493 . 2 1 1 A 41 41 PRO CA C 395 61.111 63.891 -2.780 1
1 494 . 2 1 1 A 41 41 PRO CB C 395 32.275 32.832 -0.557 1
1 497 . 2 1 1 A 42 42 CYS H H 396 7.828 7.824 0.004 1
1 498 . 2 1 1 A 42 42 CYS HA H 396 4.208 4.072 0.136 1
1 501 . 2 1 1 A 42 42 CYS C C 396 173.877 175.067 -1.190 1
1 502 . 2 1 1 A 42 42 CYS CA C 396 58.021 61.472 -3.451 1
1 503 . 2 1 1 A 42 42 CYS CB C 396 28.242 27.247 0.995 1
1 504 . 2 1 1 A 42 42 CYS N N 396 122.434 117.872 4.562 1
1 505 . 2 1 1 A 43 43 GLY H H 397 8.679 8.834 -0.155 1
1 506 . 2 1 1 A 43 43 GLY HA2 H 397 3.507 3.938 -0.431 1
1 507 . 2 1 1 A 43 43 GLY HA3 H 397 3.914 3.940 -0.026 1
1 508 . 2 1 1 A 43 43 GLY C C 397 171.981 174.613 -2.632 1
1 509 . 2 1 1 A 43 43 GLY CA C 397 43.347 46.011 -2.664 1
1 510 . 2 1 1 A 43 43 GLY N N 397 112.123 108.236 3.887 1
1 511 . 2 1 1 A 44 44 HIS H H 398 8.329 7.329 1.000 1
1 512 . 2 1 1 A 44 44 HIS HA H 398 4.339 4.617 -0.278 1
1 517 . 2 1 1 A 44 44 HIS C C 398 170.742 174.259 -3.517 1
1 518 . 2 1 1 A 44 44 HIS CA C 398 58.368 55.771 2.597 1
1 519 . 2 1 1 A 44 44 HIS CB C 398 28.434 32.049 -3.615 1
1 522 . 2 1 1 A 44 44 HIS N N 398 121.393 117.298 4.095 1
1 523 . 2 1 1 A 45 45 LEU H H 399 8.241 8.871 -0.630 1
1 524 . 2 1 1 A 45 45 LEU HA H 399 5.570 5.159 0.411 1
1 534 . 2 1 1 A 45 45 LEU C C 399 174.464 175.349 -0.885 1
1 535 . 2 1 1 A 45 45 LEU CA C 399 50.729 53.443 -2.714 1
1 536 . 2 1 1 A 45 45 LEU CB C 399 43.574 43.539 0.035 1
1 540 . 2 1 1 A 45 45 LEU N N 399 118.469 122.147 -3.678 1
1 541 . 2 1 1 A 46 46 MET H H 400 8.707 8.882 -0.175 1
1 542 . 2 1 1 A 46 46 MET HA H 400 4.842 5.095 -0.253 1
1 550 . 2 1 1 A 46 46 MET C C 400 170.736 174.488 -3.752 1
1 551 . 2 1 1 A 46 46 MET CA C 400 52.804 53.931 -1.127 1
1 552 . 2 1 1 A 46 46 MET CB C 400 31.945 35.533 -3.588 1
1 555 . 2 1 1 A 46 46 MET N N 400 114.897 120.652 -5.755 1
1 556 . 2 1 1 A 47 47 CYS H H 401 9.436 8.177 1.259 1
1 557 . 2 1 1 A 47 47 CYS HA H 401 5.629 5.006 0.623 1
1 560 . 2 1 1 A 47 47 CYS C C 401 173.909 176.211 -2.302 1
1 561 . 2 1 1 A 47 47 CYS CA C 401 54.325 57.152 -2.827 1
1 562 . 2 1 1 A 47 47 CYS CB C 401 30.725 29.351 1.374 1
1 563 . 2 1 1 A 47 47 CYS N N 401 119.575 119.354 0.221 1
1 564 . 2 1 1 A 48 48 THR H H 402 9.842 9.338 0.504 1
1 565 . 2 1 1 A 48 48 THR HA H 402 3.768 3.959 -0.191 1
1 570 . 2 1 1 A 48 48 THR C C 402 174.333 176.226 -1.893 1
1 571 . 2 1 1 A 48 48 THR CA C 402 64.516 65.890 -1.374 1
1 572 . 2 1 1 A 48 48 THR CB C 402 66.288 68.558 -2.270 1
1 574 . 2 1 1 A 48 48 THR N N 402 119.945 119.083 0.862 1
1 575 . 2 1 1 A 49 49 SER H H 403 8.355 8.071 0.284 1
1 576 . 2 1 1 A 49 49 SER HA H 403 4.222 4.050 0.172 1
1 579 . 2 1 1 A 49 49 SER C C 403 175.059 176.703 -1.644 1
1 580 . 2 1 1 A 49 49 SER CA C 403 59.828 61.885 -2.057 1
1 581 . 2 1 1 A 49 49 SER CB C 403 59.717 62.603 -2.886 1
1 582 . 2 1 1 A 49 49 SER N N 403 120.468 116.402 4.066 1
1 583 . 2 1 1 A 50 50 CYS H H 404 9.464 8.194 1.270 1
1 584 . 2 1 1 A 50 50 CYS HA H 404 3.922 4.151 -0.229 1
1 587 . 2 1 1 A 50 50 CYS C C 404 176.081 177.052 -0.971 1
1 588 . 2 1 1 A 50 50 CYS CA C 404 63.076 64.025 -0.949 1
1 589 . 2 1 1 A 50 50 CYS CB C 404 26.078 27.815 -1.737 1
1 590 . 2 1 1 A 50 50 CYS N N 404 126.744 119.231 7.513 1
1 591 . 2 1 1 A 51 51 LEU H H 405 7.948 8.215 -0.267 1
1 592 . 2 1 1 A 51 51 LEU HA H 405 4.064 4.146 -0.082 1
1 602 . 2 1 1 A 51 51 LEU C C 405 175.495 178.686 -3.191 1
1 603 . 2 1 1 A 51 51 LEU CA C 405 55.914 58.223 -2.309 1
1 604 . 2 1 1 A 51 51 LEU CB C 405 38.662 41.934 -3.272 1
1 607 . 2 1 1 A 51 51 LEU N N 405 121.951 122.589 -0.638 1
1 608 . 2 1 1 A 52 52 THR H H 406 8.786 8.679 0.107 1
1 609 . 2 1 1 A 52 52 THR HA H 406 4.024 3.928 0.096 1
1 614 . 2 1 1 A 52 52 THR C C 406 174.139 176.460 -2.321 1
1 615 . 2 1 1 A 52 52 THR CA C 406 64.017 66.280 -2.263 1
1 616 . 2 1 1 A 52 52 THR CB C 406 66.115 68.540 -2.425 1
1 618 . 2 1 1 A 52 52 THR N N 406 115.258 114.665 0.593 1
1 619 . 2 1 1 A 53 53 SER H H 407 8.115 7.699 0.416 1
1 620 . 2 1 1 A 53 53 SER HA H 407 4.204 4.185 0.019 1
1 623 . 2 1 1 A 53 53 SER C C 407 174.456 176.900 -2.444 1
1 624 . 2 1 1 A 53 53 SER CA C 407 59.090 61.394 -2.304 1
1 625 . 2 1 1 A 53 53 SER CB C 407 60.146 63.050 -2.904 1
1 626 . 2 1 1 A 53 53 SER N N 407 116.852 115.548 1.304 1
1 627 . 2 1 1 A 54 54 TRP H H 408 8.123 8.010 0.113 1
1 628 . 2 1 1 A 54 54 TRP HA H 408 4.371 4.282 0.089 1
1 637 . 2 1 1 A 54 54 TRP C C 408 175.981 178.330 -2.349 1
1 638 . 2 1 1 A 54 54 TRP CA C 408 57.323 60.731 -3.408 1
1 639 . 2 1 1 A 54 54 TRP CB C 408 26.812 29.635 -2.823 1
1 645 . 2 1 1 A 54 54 TRP N N 408 123.556 123.308 0.248 1
1 647 . 2 1 1 A 55 55 GLN H H 409 8.502 8.802 -0.300 1
1 648 . 2 1 1 A 55 55 GLN HA H 409 3.999 3.631 0.368 1
1 655 . 2 1 1 A 55 55 GLN C C 409 177.300 178.652 -1.352 1
1 656 . 2 1 1 A 55 55 GLN CA C 409 56.484 59.244 -2.760 1
1 657 . 2 1 1 A 55 55 GLN CB C 409 26.190 28.666 -2.476 1
1 659 . 2 1 1 A 55 55 GLN N N 409 118.044 118.055 -0.011 1
1 661 . 2 1 1 A 56 56 GLU H H 410 8.467 8.577 -0.110 1
1 662 . 2 1 1 A 56 56 GLU HA H 410 4.057 4.047 0.010 1
1 667 . 2 1 1 A 56 56 GLU C C 410 174.787 176.980 -2.193 1
1 668 . 2 1 1 A 56 56 GLU CA C 410 55.909 58.484 -2.575 1
1 669 . 2 1 1 A 56 56 GLU CB C 410 26.895 29.221 -2.326 1
1 671 . 2 1 1 A 56 56 GLU N N 410 119.448 118.026 1.422 1
1 672 . 2 1 1 A 57 57 SER H H 411 7.438 7.464 -0.026 1
1 673 . 2 1 1 A 57 57 SER HA H 411 4.607 4.579 0.028 1
1 676 . 2 1 1 A 57 57 SER C C 411 170.849 173.882 -3.033 1
1 677 . 2 1 1 A 57 57 SER CA C 411 55.540 57.439 -1.899 1
1 678 . 2 1 1 A 57 57 SER CB C 411 60.928 62.965 -2.037 1
1 679 . 2 1 1 A 57 57 SER N N 411 113.752 113.704 0.048 1
1 680 . 2 1 1 A 58 58 GLU H H 412 7.855 7.679 0.176 1
1 681 . 2 1 1 A 58 58 GLU HA H 412 3.772 3.772 0.000 1
1 686 . 2 1 1 A 58 58 GLU C C 412 173.743 174.943 -1.200 1
1 687 . 2 1 1 A 58 58 GLU CA C 412 54.442 56.979 -2.537 1
1 688 . 2 1 1 A 58 58 GLU CB C 412 24.603 27.523 -2.920 1
1 690 . 2 1 1 A 58 58 GLU N N 412 115.908 117.921 -2.013 1
1 691 . 2 1 1 A 59 59 GLY H H 413 7.588 7.784 -0.196 1
1 692 . 2 1 1 A 59 59 GLY HA2 H 413 1.643 2.595 -0.952 1
1 693 . 2 1 1 A 59 59 GLY HA3 H 413 2.949 3.386 -0.437 1
1 694 . 2 1 1 A 59 59 GLY C C 413 170.850 171.985 -1.135 1
1 695 . 2 1 1 A 59 59 GLY CA C 413 41.724 44.115 -2.391 1
1 696 . 2 1 1 A 59 59 GLY N N 413 108.032 106.846 1.186 1
1 697 . 2 1 1 A 60 60 GLN H H 414 7.973 8.619 -0.646 1
1 698 . 2 1 1 A 60 60 GLN HA H 414 4.366 4.661 -0.295 1
1 705 . 2 1 1 A 60 60 GLN C C 414 173.108 175.679 -2.571 1
1 706 . 2 1 1 A 60 60 GLN CA C 414 52.422 55.356 -2.934 1
1 707 . 2 1 1 A 60 60 GLN CB C 414 27.049 29.558 -2.509 1
1 709 . 2 1 1 A 60 60 GLN N N 414 122.690 124.471 -1.781 1
1 711 . 2 1 1 A 61 61 GLY H H 415 8.301 8.453 -0.152 1
1 712 . 2 1 1 A 61 61 GLY HA2 H 415 3.700 4.234 -0.534 1
1 713 . 2 1 1 A 61 61 GLY HA3 H 415 3.920 4.264 -0.344 1
1 714 . 2 1 1 A 61 61 GLY C C 415 170.249 174.450 -4.201 1
1 715 . 2 1 1 A 61 61 GLY CA C 415 42.210 44.207 -1.997 1
1 716 . 2 1 1 A 61 61 GLY N N 415 110.794 113.828 -3.034 1
1 717 . 2 1 1 A 62 62 CYS H H 416 8.549 8.372 0.177 1
1 718 . 2 1 1 A 62 62 CYS HA H 416 4.227 4.675 -0.448 1
1 721 . 2 1 1 A 62 62 CYS C C 416 172.914 175.431 -2.517 1
1 722 . 2 1 1 A 62 62 CYS CA C 416 54.008 58.630 -4.622 1
1 723 . 2 1 1 A 62 62 CYS CB C 416 29.716 27.466 2.250 1
1 724 . 2 1 1 A 62 62 CYS N N 416 123.683 120.692 2.991 1
1 725 . 2 1 1 A 63 63 PRO HA H 417 2.611 2.810 -0.199 1
1 732 . 2 1 1 A 63 63 PRO C C 417 174.143 177.681 -3.538 1
1 733 . 2 1 1 A 63 63 PRO CA C 417 61.689 63.786 -2.097 1
1 734 . 2 1 1 A 63 63 PRO CB C 417 28.534 31.111 -2.577 1
1 737 . 2 1 1 A 64 64 PHE H H 418 8.968 7.865 1.103 1
1 738 . 2 1 1 A 64 64 PHE HA H 418 4.250 4.226 0.024 1
1 746 . 2 1 1 A 64 64 PHE C C 418 174.243 178.140 -3.897 1
1 747 . 2 1 1 A 64 64 PHE CA C 418 56.720 60.444 -3.724 1
1 748 . 2 1 1 A 64 64 PHE CB C 418 36.458 39.647 -3.189 1
1 752 . 2 1 1 A 64 64 PHE N N 418 117.008 115.392 1.616 1
1 753 . 2 1 1 A 65 65 CYS H H 419 7.968 8.014 -0.046 1
1 754 . 2 1 1 A 65 65 CYS HA H 419 4.906 4.489 0.417 1
1 757 . 2 1 1 A 65 65 CYS C C 419 173.198 175.045 -1.847 1
1 758 . 2 1 1 A 65 65 CYS CA C 419 55.870 59.972 -4.102 1
1 759 . 2 1 1 A 65 65 CYS CB C 419 30.559 28.970 1.589 1
1 760 . 2 1 1 A 65 65 CYS N N 419 117.505 117.763 -0.258 1
1 761 . 2 1 1 A 66 66 ARG H H 420 8.761 7.967 0.794 1
1 762 . 2 1 1 A 66 66 ARG HA H 420 4.365 4.356 0.009 1
1 769 . 2 1 1 A 66 66 ARG C C 420 172.921 174.908 -1.987 1
1 770 . 2 1 1 A 66 66 ARG CA C 420 54.763 57.186 -2.423 1
1 771 . 2 1 1 A 66 66 ARG CB C 420 24.286 27.000 -2.714 1
1 774 . 2 1 1 A 66 66 ARG N N 420 118.763 116.141 2.622 1
1 775 . 2 1 1 A 67 67 CYS H H 421 8.223 7.890 0.333 1
1 776 . 2 1 1 A 67 67 CYS HA H 421 4.419 4.566 -0.147 1
1 779 . 2 1 1 A 67 67 CYS C C 421 171.160 174.634 -3.474 1
1 780 . 2 1 1 A 67 67 CYS CA C 421 57.119 58.341 -1.222 1
1 781 . 2 1 1 A 67 67 CYS CB C 421 25.911 29.596 -3.685 1
1 782 . 2 1 1 A 67 67 CYS N N 421 120.627 116.854 3.773 1
1 783 . 2 1 1 A 68 68 GLU H H 422 8.416 8.545 -0.129 1
1 784 . 2 1 1 A 68 68 GLU HA H 422 4.025 4.151 -0.126 1
1 789 . 2 1 1 A 68 68 GLU C C 422 173.764 176.314 -2.550 1
1 790 . 2 1 1 A 68 68 GLU CA C 422 54.752 57.316 -2.564 1
1 791 . 2 1 1 A 68 68 GLU CB C 422 27.302 29.573 -2.271 1
1 793 . 2 1 1 A 68 68 GLU N N 422 122.370 120.235 2.135 1
1 794 . 2 1 1 A 69 69 ILE H H 423 8.648 9.080 -0.432 1
1 795 . 2 1 1 A 69 69 ILE HA H 423 4.012 4.378 -0.366 1
1 805 . 2 1 1 A 69 69 ILE C C 423 174.257 175.532 -1.275 1
1 806 . 2 1 1 A 69 69 ILE CA C 423 59.740 60.724 -0.984 1
1 807 . 2 1 1 A 69 69 ILE CB C 423 35.846 37.487 -1.641 1
1 811 . 2 1 1 A 69 69 ILE N N 423 125.988 127.172 -1.184 1
1 812 . 2 1 1 A 70 70 LYS H H 424 9.185 9.136 0.049 1
1 813 . 2 1 1 A 70 70 LYS HA H 424 4.434 4.824 -0.390 1
1 822 . 2 1 1 A 70 70 LYS C C 424 173.880 176.379 -2.499 1
1 823 . 2 1 1 A 70 70 LYS CA C 424 53.378 55.835 -2.457 1
1 824 . 2 1 1 A 70 70 LYS CB C 424 30.397 34.431 -4.034 1
1 828 . 2 1 1 A 70 70 LYS N N 424 128.977 126.527 2.450 1
1 829 . 2 1 1 A 71 71 GLY H H 425 7.810 7.448 0.362 1
1 830 . 2 1 1 A 71 71 GLY HA2 H 425 4.094 4.067 0.027 1
1 831 . 2 1 1 A 71 71 GLY HA3 H 425 4.159 4.069 0.090 1
1 832 . 2 1 1 A 71 71 GLY C C 425 168.179 172.276 -4.097 1
1 833 . 2 1 1 A 71 71 GLY CA C 425 42.326 45.345 -3.019 1
1 834 . 2 1 1 A 71 71 GLY N N 425 107.696 104.514 3.182 1
1 835 . 2 1 1 A 72 72 THR H H 426 8.048 8.576 -0.528 1
1 836 . 2 1 1 A 72 72 THR HA H 426 5.258 5.469 -0.211 1
1 841 . 2 1 1 A 72 72 THR C C 426 170.979 173.252 -2.273 1
1 842 . 2 1 1 A 72 72 THR CA C 426 56.755 60.137 -3.382 1
1 843 . 2 1 1 A 72 72 THR CB C 426 69.226 71.502 -2.276 1
1 845 . 2 1 1 A 72 72 THR N N 426 109.122 111.128 -2.006 1
1 846 . 2 1 1 A 73 73 GLU H H 427 8.912 9.121 -0.209 1
1 847 . 2 1 1 A 73 73 GLU HA H 427 4.954 4.771 0.183 1
1 852 . 2 1 1 A 73 73 GLU C C 427 170.353 174.153 -3.800 1
1 853 . 2 1 1 A 73 73 GLU CA C 427 50.182 52.858 -2.676 1
1 854 . 2 1 1 A 73 73 GLU CB C 427 30.559 31.692 -1.133 1
1 856 . 2 1 1 A 73 73 GLU N N 427 121.703 123.353 -1.650 1
1 1 . 2 1 1 A 74 74 PRO HA H 428 4.372 5.066 -0.694 1
1 2 . 2 1 1 A 74 74 PRO C C 428 173.839 176.231 -2.392 1
1 3 . 2 1 1 A 74 74 PRO CA C 428 60.241 62.775 -2.534 1
1 4 . 2 1 1 A 74 74 PRO CB C 428 29.299 32.344 -3.045 1
1 857 . 2 1 1 A 74 74 PRO HA H 428 4.782 5.066 -0.284 1
1 864 . 2 1 1 A 74 74 PRO C C 428 174.027 176.231 -2.204 1
1 865 . 2 1 1 A 74 74 PRO CA C 428 59.771 62.775 -3.004 1
1 866 . 2 1 1 A 74 74 PRO CB C 428 29.633 32.344 -2.711 1
1 7 . 2 1 1 A 75 75 ILE H H 429 8.144 8.828 -0.684 1
1 8 . 2 1 1 A 75 75 ILE HA H 429 4.086 4.826 -0.740 1
1 15 . 2 1 1 A 75 75 ILE C C 429 173.426 175.191 -1.765 1
1 16 . 2 1 1 A 75 75 ILE CA C 429 58.339 60.017 -1.678 1
1 17 . 2 1 1 A 75 75 ILE CB C 429 35.988 40.978 -4.990 1
1 21 . 2 1 1 A 75 75 ILE N N 429 121.551 121.441 0.110 1
1 869 . 2 1 1 A 75 75 ILE H H 429 7.682 8.828 -1.146 1
1 870 . 2 1 1 A 75 75 ILE HA H 429 4.282 4.826 -0.544 1
1 880 . 2 1 1 A 75 75 ILE C C 429 172.510 175.191 -2.681 1
1 881 . 2 1 1 A 75 75 ILE CA C 429 57.456 60.017 -2.561 1
1 882 . 2 1 1 A 75 75 ILE CB C 429 37.903 40.978 -3.075 1
1 886 . 2 1 1 A 75 75 ILE N N 429 119.651 121.441 -1.790 1
1 1 . 2 1 1 A 76 76 VAL HA H 430 4.086 4.529 -0.443 1
1 2 . 2 1 1 A 76 76 VAL CA C 430 59.372 61.059 -1.687 1
1 22 . 2 1 1 A 76 76 VAL H H 430 8.221 8.746 -0.525 1
1 23 . 2 1 1 A 76 76 VAL HA H 430 4.083 4.529 -0.446 1
1 24 . 2 1 1 A 76 76 VAL C C 430 173.067 176.098 -3.031 1
1 25 . 2 1 1 A 76 76 VAL CA C 430 59.445 61.059 -1.614 1
1 26 . 2 1 1 A 76 76 VAL CB C 430 30.407 32.437 -2.030 1
1 27 . 2 1 1 A 76 76 VAL N N 430 125.930 122.833 3.097 1
1 887 . 2 1 1 A 76 76 VAL H H 430 8.122 8.746 -0.624 1
1 888 . 2 1 1 A 76 76 VAL HA H 430 4.197 4.529 -0.332 1
1 890 . 2 1 1 A 76 76 VAL C C 430 172.971 176.098 -3.127 1
1 891 . 2 1 1 A 76 76 VAL CA C 430 58.821 61.059 -2.238 1
1 892 . 2 1 1 A 76 76 VAL CB C 430 30.807 32.437 -1.630 1
1 895 . 2 1 1 A 76 76 VAL N N 430 124.178 122.833 1.345 1
1 4 . 2 1 1 A 77 77 VAL H H 431 8.204 8.535 -0.331 1
1 5 . 2 1 1 A 77 77 VAL HA H 431 4.049 4.300 -0.251 1
1 6 . 2 1 1 A 77 77 VAL C C 431 172.636 174.706 -2.070 1
1 7 . 2 1 1 A 77 77 VAL CA C 431 59.315 61.505 -2.190 1
1 8 . 2 1 1 A 77 77 VAL CB C 431 30.219 31.592 -1.373 1
1 9 . 2 1 1 A 77 77 VAL N N 431 125.320 122.711 2.609 1
1 28 . 2 1 1 A 77 77 VAL H H 431 8.412 8.535 -0.123 1
1 29 . 2 1 1 A 77 77 VAL HA H 431 4.038 4.300 -0.262 1
1 37 . 2 1 1 A 77 77 VAL C C 431 172.617 174.706 -2.089 1
1 38 . 2 1 1 A 77 77 VAL CA C 431 59.137 61.505 -2.368 1
1 39 . 2 1 1 A 77 77 VAL CB C 431 30.292 31.592 -1.300 1
1 42 . 2 1 1 A 77 77 VAL N N 431 125.655 122.711 2.944 1
1 896 . 2 1 1 A 77 77 VAL H H 431 8.448 8.535 -0.087 1
1 897 . 2 1 1 A 77 77 VAL HA H 431 4.087 4.300 -0.213 1
1 905 . 2 1 1 A 77 77 VAL C C 431 172.493 174.706 -2.213 1
1 906 . 2 1 1 A 77 77 VAL CA C 431 59.185 61.505 -2.320 1
1 907 . 2 1 1 A 77 77 VAL CB C 431 30.084 31.592 -1.508 1
1 910 . 2 1 1 A 77 77 VAL N N 431 125.770 122.711 3.059 1
1 43 . 2 1 1 A 78 78 ASP H H 432 8.419 7.502 0.917 1
1 44 . 2 1 1 A 78 78 ASP HA H 432 4.829 4.878 -0.049 1
1 45 . 2 1 1 A 78 78 ASP C C 432 172.252 173.179 -0.927 1
1 46 . 2 1 1 A 78 78 ASP CA C 432 49.320 50.235 -0.915 1
1 47 . 2 1 1 A 78 78 ASP CB C 432 39.066 43.414 -4.348 1
1 48 . 2 1 1 A 78 78 ASP N N 432 126.226 121.652 4.574 1
1 911 . 2 1 1 A 78 78 ASP H H 432 8.493 7.502 0.991 1
1 912 . 2 1 1 A 78 78 ASP HA H 432 4.852 4.878 -0.026 1
1 915 . 2 1 1 A 78 78 ASP C C 432 172.048 173.179 -1.131 1
1 916 . 2 1 1 A 78 78 ASP CA C 432 49.233 50.235 -1.002 1
1 917 . 2 1 1 A 78 78 ASP CB C 432 38.858 43.414 -4.556 1
1 918 . 2 1 1 A 78 78 ASP N N 432 126.705 121.652 5.053 1
1 10 . 2 1 1 A 79 79 PRO CA C 433 63.865 62.081 1.784 1
1 49 . 2 1 1 A 79 79 PRO C C 433 173.867 176.599 -2.732 1
1 919 . 2 1 1 A 79 79 PRO HA H 433 4.237 4.621 -0.384 1
1 926 . 2 1 1 A 79 79 PRO C C 433 173.812 176.599 -2.787 1
1 927 . 2 1 1 A 79 79 PRO CA C 433 60.627 62.081 -1.454 1
1 928 . 2 1 1 A 79 79 PRO CB C 433 29.329 29.030 0.299 1
1 11 . 2 1 1 A 80 80 PHE H H 434 8.182 8.215 -0.033 1
1 12 . 2 1 1 A 80 80 PHE HA H 434 4.499 4.149 0.350 1
1 13 . 2 1 1 A 80 80 PHE C C 434 171.680 175.965 -4.285 1
1 14 . 2 1 1 A 80 80 PHE CA C 434 54.657 60.923 -6.266 1
1 15 . 2 1 1 A 80 80 PHE CB C 434 36.272 38.630 -2.358 1
1 16 . 2 1 1 A 80 80 PHE N N 434 118.611 123.163 -4.552 1
1 50 . 2 1 1 A 80 80 PHE H H 434 8.191 8.215 -0.024 1
1 51 . 2 1 1 A 80 80 PHE HA H 434 4.528 4.149 0.379 1
1 54 . 2 1 1 A 80 80 PHE C C 434 172.457 175.965 -3.508 1
1 55 . 2 1 1 A 80 80 PHE CA C 434 54.828 60.923 -6.095 1
1 56 . 2 1 1 A 80 80 PHE CB C 434 36.457 38.630 -2.173 1
1 57 . 2 1 1 A 80 80 PHE N N 434 118.871 123.163 -4.292 1
1 931 . 2 1 1 A 80 80 PHE H H 434 8.191 8.215 -0.024 1
1 932 . 2 1 1 A 80 80 PHE HA H 434 4.463 4.149 0.314 1
1 939 . 2 1 1 A 80 80 PHE C C 434 172.283 175.965 -3.682 1
1 940 . 2 1 1 A 80 80 PHE CA C 434 54.971 60.923 -5.952 1
1 941 . 2 1 1 A 80 80 PHE CB C 434 36.490 38.630 -2.140 1
1 944 . 2 1 1 A 80 80 PHE N N 434 119.263 123.163 -3.900 1
1 17 . 2 1 1 A 81 81 ASP H H 435 7.490 8.186 -0.696 1
1 18 . 2 1 1 A 81 81 ASP HA H 435 4.698 5.011 -0.313 1
1 19 . 2 1 1 A 81 81 ASP C C 435 171.662 174.459 -2.797 1
1 20 . 2 1 1 A 81 81 ASP CA C 435 49.570 51.027 -1.457 1
1 21 . 2 1 1 A 81 81 ASP CB C 435 40.104 41.850 -1.746 1
1 22 . 2 1 1 A 81 81 ASP N N 435 120.304 117.463 2.841 1
1 58 . 2 1 1 A 81 81 ASP H H 435 7.881 8.186 -0.305 1
1 59 . 2 1 1 A 81 81 ASP HA H 435 4.801 5.011 -0.210 1
1 60 . 2 1 1 A 81 81 ASP C C 435 171.144 174.459 -3.315 1
1 61 . 2 1 1 A 81 81 ASP CA C 435 49.406 51.027 -1.621 1
1 62 . 2 1 1 A 81 81 ASP CB C 435 38.618 41.850 -3.232 1
1 63 . 2 1 1 A 81 81 ASP N N 435 123.108 117.463 5.645 1
1 945 . 2 1 1 A 81 81 ASP H H 435 7.823 8.186 -0.363 1
1 946 . 2 1 1 A 81 81 ASP HA H 435 4.759 5.011 -0.252 1
1 949 . 2 1 1 A 81 81 ASP C C 435 171.057 174.459 -3.402 1
1 950 . 2 1 1 A 81 81 ASP CA C 435 49.174 51.027 -1.853 1
1 951 . 2 1 1 A 81 81 ASP CB C 435 38.725 41.850 -3.125 1
1 952 . 2 1 1 A 81 81 ASP N N 435 123.530 117.463 6.067 1
1 23 . 2 1 1 A 82 82 PRO HA H 436 4.758 4.593 0.165 1
1 24 . 2 1 1 A 82 82 PRO C C 436 172.944 176.155 -3.211 1
1 25 . 2 1 1 A 82 82 PRO CA C 436 60.134 64.017 -3.883 1
1 26 . 2 1 1 A 82 82 PRO CB C 436 31.425 32.142 -0.717 1
1 64 . 2 1 1 A 82 82 PRO HA H 436 4.364 4.593 -0.229 1
1 67 . 2 1 1 A 82 82 PRO C C 436 173.563 176.155 -2.592 1
1 68 . 2 1 1 A 82 82 PRO CA C 436 60.729 64.017 -3.288 1
1 69 . 2 1 1 A 82 82 PRO CB C 436 29.160 32.142 -2.982 1
1 953 . 2 1 1 A 82 82 PRO HA H 436 4.296 4.593 -0.297 1
1 960 . 2 1 1 A 82 82 PRO C C 436 173.494 176.155 -2.661 1
1 961 . 2 1 1 A 82 82 PRO CA C 436 60.625 64.017 -3.392 1
1 962 . 2 1 1 A 82 82 PRO CB C 436 29.237 32.142 -2.905 1
1 1 . 3 1 1 A 3 3 LEU HA H 357 4.257 4.156 0.101 1
1 11 . 3 1 1 A 3 3 LEU C C 357 174.994 176.101 -1.107 1
1 12 . 3 1 1 A 3 3 LEU CA C 357 53.329 57.518 -4.189 1
1 13 . 3 1 1 A 3 3 LEU CB C 357 39.382 42.484 -3.102 1
1 17 . 3 1 1 A 4 4 GLN H H 358 8.234 7.684 0.550 1
1 18 . 3 1 1 A 4 4 GLN HA H 358 4.211 4.664 -0.453 1
1 25 . 3 1 1 A 4 4 GLN C C 358 173.357 175.224 -1.867 1
1 26 . 3 1 1 A 4 4 GLN CA C 358 53.791 53.893 -0.102 1
1 27 . 3 1 1 A 4 4 GLN CB C 358 26.456 32.881 -6.425 1
1 29 . 3 1 1 A 4 4 GLN N N 358 119.506 114.956 4.550 1
1 31 . 3 1 1 A 5 5 ASP H H 359 8.090 8.803 -0.713 1
1 32 . 3 1 1 A 5 5 ASP HA H 359 4.458 4.515 -0.057 1
1 35 . 3 1 1 A 5 5 ASP C C 359 173.492 176.218 -2.726 1
1 36 . 3 1 1 A 5 5 ASP CA C 359 52.309 56.420 -4.111 1
1 37 . 3 1 1 A 5 5 ASP CB C 359 38.312 41.464 -3.152 1
1 38 . 3 1 1 A 5 5 ASP N N 359 120.683 121.272 -0.589 1
1 39 . 3 1 1 A 6 6 HIS H H 360 8.103 7.527 0.576 1
1 40 . 3 1 1 A 6 6 HIS HA H 360 4.540 4.663 -0.123 1
1 45 . 3 1 1 A 6 6 HIS C C 360 172.801 175.235 -2.434 1
1 46 . 3 1 1 A 6 6 HIS CA C 360 53.874 55.101 -1.227 1
1 47 . 3 1 1 A 6 6 HIS CB C 360 27.878 30.587 -2.709 1
1 50 . 3 1 1 A 6 6 HIS N N 360 118.844 113.735 5.109 1
1 51 . 3 1 1 A 7 7 ILE H H 361 7.862 8.763 -0.901 1
1 52 . 3 1 1 A 7 7 ILE HA H 361 4.010 4.201 -0.191 1
1 62 . 3 1 1 A 7 7 ILE C C 361 173.268 176.478 -3.210 1
1 63 . 3 1 1 A 7 7 ILE CA C 361 58.740 61.149 -2.409 1
1 64 . 3 1 1 A 7 7 ILE CB C 361 35.788 36.832 -1.044 1
1 68 . 3 1 1 A 7 7 ILE N N 361 121.598 124.862 -3.264 1
1 69 . 3 1 1 A 8 8 LYS H H 362 8.231 8.617 -0.386 1
1 70 . 3 1 1 A 8 8 LYS HA H 362 4.313 4.140 0.173 1
1 79 . 3 1 1 A 8 8 LYS C C 362 173.899 175.423 -1.524 1
1 80 . 3 1 1 A 8 8 LYS CA C 362 53.677 58.489 -4.812 1
1 81 . 3 1 1 A 8 8 LYS CB C 362 30.355 31.284 -0.929 1
1 85 . 3 1 1 A 8 8 LYS N N 362 124.980 121.982 2.998 1
1 86 . 3 1 1 A 9 9 VAL H H 363 8.044 8.614 -0.570 1
1 87 . 3 1 1 A 9 9 VAL HA H 363 4.089 4.272 -0.183 1
1 95 . 3 1 1 A 9 9 VAL C C 363 173.760 175.588 -1.828 1
1 96 . 3 1 1 A 9 9 VAL CA C 363 59.814 62.086 -2.272 1
1 97 . 3 1 1 A 9 9 VAL CB C 363 30.058 29.684 0.374 1
1 100 . 3 1 1 A 9 9 VAL N N 363 121.366 121.198 0.168 1
1 101 . 3 1 1 A 10 10 THR H H 364 8.076 8.319 -0.243 1
1 102 . 3 1 1 A 10 10 THR HA H 364 4.302 4.440 -0.138 1
1 107 . 3 1 1 A 10 10 THR C C 364 172.135 175.276 -3.141 1
1 108 . 3 1 1 A 10 10 THR CA C 364 59.134 64.333 -5.199 1
1 109 . 3 1 1 A 10 10 THR CB C 364 67.415 69.908 -2.493 1
1 111 . 3 1 1 A 10 10 THR N N 364 116.817 119.868 -3.051 1
1 112 . 3 1 1 A 11 11 GLN H H 365 8.463 7.821 0.642 1
1 113 . 3 1 1 A 11 11 GLN HA H 365 4.046 4.044 0.002 1
1 120 . 3 1 1 A 11 11 GLN C C 365 173.944 176.347 -2.403 1
1 121 . 3 1 1 A 11 11 GLN CA C 365 54.517 58.946 -4.429 1
1 122 . 3 1 1 A 11 11 GLN CB C 365 26.250 28.985 -2.735 1
1 124 . 3 1 1 A 11 11 GLN N N 365 122.059 120.278 1.781 1
1 126 . 3 1 1 A 12 12 GLU H H 366 8.449 7.545 0.904 1
1 127 . 3 1 1 A 12 12 GLU HA H 366 4.093 4.304 -0.211 1
1 132 . 3 1 1 A 12 12 GLU C C 366 174.746 176.198 -1.452 1
1 133 . 3 1 1 A 12 12 GLU CA C 366 55.235 56.415 -1.180 1
1 134 . 3 1 1 A 12 12 GLU CB C 366 27.180 30.063 -2.883 1
1 136 . 3 1 1 A 12 12 GLU N N 366 120.415 118.934 1.481 1
1 137 . 3 1 1 A 13 13 GLN H H 367 8.031 8.230 -0.199 1
1 138 . 3 1 1 A 13 13 GLN HA H 367 4.113 4.365 -0.252 1
1 145 . 3 1 1 A 13 13 GLN C C 367 173.693 176.099 -2.406 1
1 146 . 3 1 1 A 13 13 GLN CA C 367 54.132 55.326 -1.194 1
1 147 . 3 1 1 A 13 13 GLN CB C 367 26.420 29.482 -3.062 1
1 149 . 3 1 1 A 13 13 GLN N N 367 119.721 124.943 -5.222 1
1 151 . 3 1 1 A 14 14 TYR H H 368 8.111 7.600 0.511 1
1 152 . 3 1 1 A 14 14 TYR HA H 368 4.339 4.772 -0.433 1
1 159 . 3 1 1 A 14 14 TYR C C 368 173.916 176.348 -2.432 1
1 160 . 3 1 1 A 14 14 TYR CA C 368 56.572 57.693 -1.121 1
1 161 . 3 1 1 A 14 14 TYR CB C 368 35.879 38.346 -2.467 1
1 164 . 3 1 1 A 14 14 TYR N N 368 120.541 117.788 2.753 1
1 165 . 3 1 1 A 15 15 GLU H H 369 8.287 8.142 0.145 1
1 166 . 3 1 1 A 15 15 GLU HA H 369 4.009 4.405 -0.396 1
1 171 . 3 1 1 A 15 15 GLU C C 369 174.448 178.159 -3.711 1
1 172 . 3 1 1 A 15 15 GLU CA C 369 55.047 59.207 -4.160 1
1 173 . 3 1 1 A 15 15 GLU CB C 369 27.226 29.797 -2.571 1
1 175 . 3 1 1 A 15 15 GLU N N 369 120.398 122.716 -2.318 1
1 176 . 3 1 1 A 16 16 LEU H H 370 7.785 7.783 0.002 1
1 177 . 3 1 1 A 16 16 LEU HA H 370 4.138 4.141 -0.003 1
1 187 . 3 1 1 A 16 16 LEU C C 370 175.089 178.081 -2.992 1
1 188 . 3 1 1 A 16 16 LEU CA C 370 53.425 56.064 -2.639 1
1 189 . 3 1 1 A 16 16 LEU CB C 370 39.554 40.712 -1.158 1
1 193 . 3 1 1 A 16 16 LEU N N 370 121.323 117.971 3.352 1
1 194 . 3 1 1 A 17 17 TYR H H 371 8.038 8.177 -0.139 1
1 195 . 3 1 1 A 17 17 TYR HA H 371 4.380 4.576 -0.196 1
1 202 . 3 1 1 A 17 17 TYR C C 371 173.931 177.595 -3.664 1
1 203 . 3 1 1 A 17 17 TYR CA C 371 56.143 59.830 -3.687 1
1 204 . 3 1 1 A 17 17 TYR CB C 371 35.501 37.029 -1.528 1
1 207 . 3 1 1 A 17 17 TYR N N 371 119.465 120.399 -0.934 1
1 208 . 3 1 1 A 18 18 CYS H H 372 8.021 7.609 0.412 1
1 209 . 3 1 1 A 18 18 CYS HA H 372 4.236 4.021 0.215 1
1 212 . 3 1 1 A 18 18 CYS C C 372 172.457 176.094 -3.637 1
1 213 . 3 1 1 A 18 18 CYS CA C 372 56.997 61.351 -4.354 1
1 214 . 3 1 1 A 18 18 CYS CB C 372 25.080 27.035 -1.955 1
1 215 . 3 1 1 A 18 18 CYS N N 372 119.913 120.104 -0.191 1
1 216 . 3 1 1 A 19 19 GLU H H 373 8.151 7.658 0.493 1
1 217 . 3 1 1 A 19 19 GLU HA H 373 4.130 4.374 -0.244 1
1 222 . 3 1 1 A 19 19 GLU C C 373 174.151 177.189 -3.038 1
1 223 . 3 1 1 A 19 19 GLU CA C 373 54.535 57.483 -2.948 1
1 224 . 3 1 1 A 19 19 GLU CB C 373 27.244 30.847 -3.603 1
1 226 . 3 1 1 A 19 19 GLU N N 373 122.431 119.003 3.428 1
1 227 . 3 1 1 A 20 20 MET H H 374 8.109 8.347 -0.238 1
1 228 . 3 1 1 A 20 20 MET HA H 374 4.352 4.170 0.182 1
1 236 . 3 1 1 A 20 20 MET C C 374 174.200 176.310 -2.110 1
1 237 . 3 1 1 A 20 20 MET CA C 374 53.238 58.318 -5.080 1
1 238 . 3 1 1 A 20 20 MET CB C 374 30.237 30.517 -0.280 1
1 241 . 3 1 1 A 20 20 MET N N 374 119.754 116.421 3.333 1
1 242 . 3 1 1 A 21 21 GLY H H 375 8.231 8.737 -0.506 1
1 243 . 3 1 1 A 21 21 GLY HA2 H 375 3.861 4.084 -0.223 1
1 244 . 3 1 1 A 21 21 GLY HA3 H 375 3.960 4.091 -0.131 1
1 245 . 3 1 1 A 21 21 GLY C C 375 171.928 173.598 -1.670 1
1 246 . 3 1 1 A 21 21 GLY CA C 375 42.930 45.414 -2.484 1
1 247 . 3 1 1 A 21 21 GLY N N 375 109.484 106.955 2.529 1
1 248 . 3 1 1 A 22 22 SER HA H 376 4.492 5.011 -0.519 1
1 251 . 3 1 1 A 22 22 SER C C 376 172.206 172.371 -0.165 1
1 252 . 3 1 1 A 22 22 SER CA C 376 55.570 57.508 -1.938 1
1 253 . 3 1 1 A 22 22 SER CB C 376 61.525 66.802 -5.277 1
1 254 . 3 1 1 A 23 23 THR H H 377 8.470 8.644 -0.174 1
1 255 . 3 1 1 A 23 23 THR HA H 377 4.295 4.635 -0.340 1
1 260 . 3 1 1 A 23 23 THR C C 377 171.811 175.652 -3.841 1
1 261 . 3 1 1 A 23 23 THR CA C 377 58.937 60.947 -2.010 1
1 262 . 3 1 1 A 23 23 THR CB C 377 67.250 69.331 -2.081 1
1 264 . 3 1 1 A 23 23 THR N N 377 124.043 118.961 5.082 1
1 265 . 3 1 1 A 24 24 PHE H H 378 8.374 9.139 -0.765 1
1 266 . 3 1 1 A 24 24 PHE HA H 378 4.239 4.257 -0.018 1
1 273 . 3 1 1 A 24 24 PHE C C 378 173.411 177.384 -3.973 1
1 274 . 3 1 1 A 24 24 PHE CA C 378 56.697 59.994 -3.297 1
1 275 . 3 1 1 A 24 24 PHE CB C 378 36.538 40.049 -3.511 1
1 278 . 3 1 1 A 24 24 PHE N N 378 124.732 128.470 -3.738 1
1 279 . 3 1 1 A 25 25 GLN H H 379 8.457 7.497 0.960 1
1 280 . 3 1 1 A 25 25 GLN HA H 379 4.038 4.244 -0.206 1
1 287 . 3 1 1 A 25 25 GLN C C 379 172.431 176.886 -4.455 1
1 288 . 3 1 1 A 25 25 GLN CA C 379 54.078 58.054 -3.976 1
1 289 . 3 1 1 A 25 25 GLN CB C 379 26.414 28.853 -2.439 1
1 291 . 3 1 1 A 25 25 GLN N N 379 118.820 117.645 1.175 1
1 293 . 3 1 1 A 26 26 LEU H H 380 6.985 7.395 -0.410 1
1 294 . 3 1 1 A 26 26 LEU HA H 380 4.229 4.307 -0.078 1
1 304 . 3 1 1 A 26 26 LEU C C 380 173.895 177.230 -3.335 1
1 305 . 3 1 1 A 26 26 LEU CA C 380 52.123 55.360 -3.237 1
1 306 . 3 1 1 A 26 26 LEU CB C 380 40.543 42.120 -1.577 1
1 310 . 3 1 1 A 26 26 LEU N N 380 119.079 121.821 -2.742 1
1 311 . 3 1 1 A 27 27 CYS H H 381 8.905 9.154 -0.249 1
1 312 . 3 1 1 A 27 27 CYS HA H 381 4.013 4.508 -0.495 1
1 315 . 3 1 1 A 27 27 CYS C C 381 174.439 176.372 -1.933 1
1 316 . 3 1 1 A 27 27 CYS CA C 381 57.847 59.600 -1.753 1
1 317 . 3 1 1 A 27 27 CYS CB C 381 28.648 28.419 0.229 1
1 318 . 3 1 1 A 27 27 CYS N N 381 125.151 123.583 1.568 1
1 319 . 3 1 1 A 28 28 LYS H H 382 9.351 8.811 0.540 1
1 320 . 3 1 1 A 28 28 LYS HA H 382 4.157 4.002 0.155 1
1 329 . 3 1 1 A 28 28 LYS C C 382 174.678 178.134 -3.456 1
1 330 . 3 1 1 A 28 28 LYS CA C 382 54.324 58.529 -4.205 1
1 331 . 3 1 1 A 28 28 LYS CB C 382 30.086 32.649 -2.563 1
1 335 . 3 1 1 A 28 28 LYS N N 382 128.840 128.221 0.619 1
1 336 . 3 1 1 A 29 29 ILE H H 383 9.040 7.810 1.230 1
1 337 . 3 1 1 A 29 29 ILE HA H 383 3.804 3.836 -0.032 1
1 347 . 3 1 1 A 29 29 ILE C C 383 174.239 177.422 -3.183 1
1 348 . 3 1 1 A 29 29 ILE CA C 383 62.114 63.857 -1.743 1
1 349 . 3 1 1 A 29 29 ILE CB C 383 33.870 37.787 -3.917 1
1 353 . 3 1 1 A 29 29 ILE N N 383 122.718 118.364 4.354 1
1 354 . 3 1 1 A 30 30 CYS H H 384 7.572 7.439 0.133 1
1 355 . 3 1 1 A 30 30 CYS HA H 384 4.548 4.544 0.004 1
1 358 . 3 1 1 A 30 30 CYS C C 384 172.978 175.507 -2.529 1
1 359 . 3 1 1 A 30 30 CYS CA C 384 54.957 59.221 -4.264 1
1 360 . 3 1 1 A 30 30 CYS CB C 384 29.778 29.864 -0.086 1
1 361 . 3 1 1 A 30 30 CYS N N 384 116.356 116.365 -0.009 1
1 362 . 3 1 1 A 31 31 ALA H H 385 8.205 8.533 -0.328 1
1 363 . 3 1 1 A 31 31 ALA HA H 385 4.107 4.131 -0.024 1
1 367 . 3 1 1 A 31 31 ALA C C 385 173.139 177.159 -4.020 1
1 368 . 3 1 1 A 31 31 ALA CA C 385 50.802 53.976 -3.174 1
1 369 . 3 1 1 A 31 31 ALA CB C 385 14.634 18.184 -3.550 1
1 370 . 3 1 1 A 31 31 ALA N N 385 125.526 121.108 4.418 1
1 371 . 3 1 1 A 32 32 GLU H H 386 8.416 8.102 0.314 1
1 372 . 3 1 1 A 32 32 GLU HA H 386 4.467 4.406 0.061 1
1 377 . 3 1 1 A 32 32 GLU C C 386 172.325 176.273 -3.948 1
1 378 . 3 1 1 A 32 32 GLU CA C 386 55.146 57.217 -2.071 1
1 379 . 3 1 1 A 32 32 GLU CB C 386 31.181 30.990 0.191 1
1 381 . 3 1 1 A 32 32 GLU N N 386 117.579 116.154 1.425 1
1 382 . 3 1 1 A 33 33 ASN H H 387 7.872 7.910 -0.038 1
1 383 . 3 1 1 A 33 33 ASN HA H 387 4.900 5.022 -0.122 1
1 388 . 3 1 1 A 33 33 ASN C C 387 171.355 174.742 -3.387 1
1 389 . 3 1 1 A 33 33 ASN CA C 387 49.320 51.878 -2.558 1
1 390 . 3 1 1 A 33 33 ASN CB C 387 38.457 39.929 -1.472 1
1 391 . 3 1 1 A 33 33 ASN N N 387 120.399 116.816 3.583 1
1 393 . 3 1 1 A 34 34 ASP H H 388 8.565 8.605 -0.040 1
1 394 . 3 1 1 A 34 34 ASP HA H 388 4.679 4.721 -0.042 1
1 397 . 3 1 1 A 34 34 ASP C C 388 174.243 175.804 -1.561 1
1 398 . 3 1 1 A 34 34 ASP CA C 388 51.809 53.176 -1.367 1
1 399 . 3 1 1 A 34 34 ASP CB C 388 38.007 41.843 -3.836 1
1 400 . 3 1 1 A 34 34 ASP N N 388 120.661 120.906 -0.245 1
1 401 . 3 1 1 A 35 35 LYS H H 389 8.544 8.617 -0.073 1
1 402 . 3 1 1 A 35 35 LYS HA H 389 3.411 4.404 -0.993 1
1 409 . 3 1 1 A 35 35 LYS C C 389 172.938 176.549 -3.611 1
1 410 . 3 1 1 A 35 35 LYS CA C 389 54.973 56.002 -1.029 1
1 411 . 3 1 1 A 35 35 LYS CB C 389 30.617 32.380 -1.763 1
1 415 . 3 1 1 A 35 35 LYS N N 389 119.199 119.233 -0.034 1
1 416 . 3 1 1 A 36 36 ASP H H 390 8.327 8.637 -0.310 1
1 417 . 3 1 1 A 36 36 ASP HA H 390 4.724 4.994 -0.270 1
1 420 . 3 1 1 A 36 36 ASP C C 390 172.860 175.333 -2.473 1
1 421 . 3 1 1 A 36 36 ASP CA C 390 51.609 53.272 -1.663 1
1 422 . 3 1 1 A 36 36 ASP CB C 390 39.018 41.745 -2.727 1
1 423 . 3 1 1 A 36 36 ASP N N 390 119.134 120.481 -1.347 1
1 424 . 3 1 1 A 37 37 VAL H H 391 8.544 7.804 0.740 1
1 425 . 3 1 1 A 37 37 VAL HA H 391 4.877 5.067 -0.190 1
1 433 . 3 1 1 A 37 37 VAL C C 391 167.519 173.185 -5.666 1
1 434 . 3 1 1 A 37 37 VAL CA C 391 58.259 60.084 -1.825 1
1 435 . 3 1 1 A 37 37 VAL CB C 391 32.277 35.457 -3.180 1
1 438 . 3 1 1 A 37 37 VAL N N 391 121.970 118.882 3.088 1
1 439 . 3 1 1 A 38 38 LYS H H 392 8.621 9.707 -1.086 1
1 440 . 3 1 1 A 38 38 LYS HA H 392 4.991 5.451 -0.460 1
1 449 . 3 1 1 A 38 38 LYS C C 392 172.681 175.079 -2.398 1
1 450 . 3 1 1 A 38 38 LYS CA C 392 51.123 54.559 -3.436 1
1 451 . 3 1 1 A 38 38 LYS CB C 392 33.697 34.997 -1.300 1
1 455 . 3 1 1 A 38 38 LYS N N 392 126.381 128.343 -1.962 1
1 456 . 3 1 1 A 39 39 ILE H H 393 8.723 9.049 -0.326 1
1 457 . 3 1 1 A 39 39 ILE HA H 393 4.239 4.344 -0.105 1
1 467 . 3 1 1 A 39 39 ILE C C 393 172.642 175.608 -2.966 1
1 468 . 3 1 1 A 39 39 ILE CA C 393 57.768 61.057 -3.289 1
1 469 . 3 1 1 A 39 39 ILE CB C 393 35.691 37.741 -2.050 1
1 473 . 3 1 1 A 39 39 ILE N N 393 126.398 127.633 -1.235 1
1 474 . 3 1 1 A 40 40 GLU H H 394 8.506 9.343 -0.837 1
1 475 . 3 1 1 A 40 40 GLU HA H 394 4.753 4.653 0.100 1
1 480 . 3 1 1 A 40 40 GLU C C 394 173.596 176.312 -2.716 1
1 481 . 3 1 1 A 40 40 GLU CA C 394 49.793 53.447 -3.654 1
1 482 . 3 1 1 A 40 40 GLU CB C 394 28.210 30.071 -1.861 1
1 484 . 3 1 1 A 40 40 GLU N N 394 124.864 128.129 -3.265 1
1 485 . 3 1 1 A 41 41 PRO HA H 395 4.864 4.494 0.370 1
1 492 . 3 1 1 A 41 41 PRO C C 395 175.073 177.119 -2.046 1
1 493 . 3 1 1 A 41 41 PRO CA C 395 61.111 63.893 -2.782 1
1 494 . 3 1 1 A 41 41 PRO CB C 395 32.275 32.927 -0.652 1
1 497 . 3 1 1 A 42 42 CYS H H 396 7.828 7.755 0.073 1
1 498 . 3 1 1 A 42 42 CYS HA H 396 4.208 4.087 0.121 1
1 501 . 3 1 1 A 42 42 CYS C C 396 173.877 175.037 -1.160 1
1 502 . 3 1 1 A 42 42 CYS CA C 396 58.021 61.262 -3.241 1
1 503 . 3 1 1 A 42 42 CYS CB C 396 28.242 27.530 0.712 1
1 504 . 3 1 1 A 42 42 CYS N N 396 122.434 117.954 4.480 1
1 505 . 3 1 1 A 43 43 GLY H H 397 8.679 8.947 -0.268 1
1 506 . 3 1 1 A 43 43 GLY HA2 H 397 3.507 3.935 -0.428 1
1 507 . 3 1 1 A 43 43 GLY HA3 H 397 3.914 3.935 -0.021 1
1 508 . 3 1 1 A 43 43 GLY C C 397 171.981 174.667 -2.686 1
1 509 . 3 1 1 A 43 43 GLY CA C 397 43.347 46.089 -2.742 1
1 510 . 3 1 1 A 43 43 GLY N N 397 112.123 108.440 3.683 1
1 511 . 3 1 1 A 44 44 HIS H H 398 8.329 7.255 1.074 1
1 512 . 3 1 1 A 44 44 HIS HA H 398 4.339 4.526 -0.187 1
1 517 . 3 1 1 A 44 44 HIS C C 398 170.742 174.502 -3.760 1
1 518 . 3 1 1 A 44 44 HIS CA C 398 58.368 56.203 2.165 1
1 519 . 3 1 1 A 44 44 HIS CB C 398 28.434 31.142 -2.708 1
1 522 . 3 1 1 A 44 44 HIS N N 398 121.393 117.098 4.295 1
1 523 . 3 1 1 A 45 45 LEU H H 399 8.241 8.944 -0.703 1
1 524 . 3 1 1 A 45 45 LEU HA H 399 5.570 5.243 0.327 1
1 534 . 3 1 1 A 45 45 LEU C C 399 174.464 175.211 -0.747 1
1 535 . 3 1 1 A 45 45 LEU CA C 399 50.729 53.428 -2.699 1
1 536 . 3 1 1 A 45 45 LEU CB C 399 43.574 43.446 0.128 1
1 540 . 3 1 1 A 45 45 LEU N N 399 118.469 123.070 -4.601 1
1 541 . 3 1 1 A 46 46 MET H H 400 8.707 9.158 -0.451 1
1 542 . 3 1 1 A 46 46 MET HA H 400 4.842 5.094 -0.252 1
1 550 . 3 1 1 A 46 46 MET C C 400 170.736 174.399 -3.663 1
1 551 . 3 1 1 A 46 46 MET CA C 400 52.804 53.822 -1.018 1
1 552 . 3 1 1 A 46 46 MET CB C 400 31.945 35.370 -3.425 1
1 555 . 3 1 1 A 46 46 MET N N 400 114.897 120.780 -5.883 1
1 556 . 3 1 1 A 47 47 CYS H H 401 9.436 8.311 1.125 1
1 557 . 3 1 1 A 47 47 CYS HA H 401 5.629 5.131 0.498 1
1 560 . 3 1 1 A 47 47 CYS C C 401 173.909 176.087 -2.178 1
1 561 . 3 1 1 A 47 47 CYS CA C 401 54.325 56.916 -2.591 1
1 562 . 3 1 1 A 47 47 CYS CB C 401 30.725 29.606 1.119 1
1 563 . 3 1 1 A 47 47 CYS N N 401 119.575 119.078 0.497 1
1 564 . 3 1 1 A 48 48 THR H H 402 9.842 9.145 0.697 1
1 565 . 3 1 1 A 48 48 THR HA H 402 3.768 3.969 -0.201 1
1 570 . 3 1 1 A 48 48 THR C C 402 174.333 176.235 -1.902 1
1 571 . 3 1 1 A 48 48 THR CA C 402 64.516 66.049 -1.533 1
1 572 . 3 1 1 A 48 48 THR CB C 402 66.288 68.603 -2.315 1
1 574 . 3 1 1 A 48 48 THR N N 402 119.945 119.180 0.765 1
1 575 . 3 1 1 A 49 49 SER H H 403 8.355 8.061 0.294 1
1 576 . 3 1 1 A 49 49 SER HA H 403 4.222 4.104 0.118 1
1 579 . 3 1 1 A 49 49 SER C C 403 175.059 176.881 -1.822 1
1 580 . 3 1 1 A 49 49 SER CA C 403 59.828 61.950 -2.122 1
1 581 . 3 1 1 A 49 49 SER CB C 403 59.717 62.604 -2.887 1
1 582 . 3 1 1 A 49 49 SER N N 403 120.468 116.918 3.550 1
1 583 . 3 1 1 A 50 50 CYS H H 404 9.464 7.823 1.641 1
1 584 . 3 1 1 A 50 50 CYS HA H 404 3.922 4.182 -0.260 1
1 587 . 3 1 1 A 50 50 CYS C C 404 176.081 177.049 -0.968 1
1 588 . 3 1 1 A 50 50 CYS CA C 404 63.076 63.949 -0.873 1
1 589 . 3 1 1 A 50 50 CYS CB C 404 26.078 27.785 -1.707 1
1 590 . 3 1 1 A 50 50 CYS N N 404 126.744 119.468 7.276 1
1 591 . 3 1 1 A 51 51 LEU H H 405 7.948 8.079 -0.131 1
1 592 . 3 1 1 A 51 51 LEU HA H 405 4.064 4.178 -0.114 1
1 602 . 3 1 1 A 51 51 LEU C C 405 175.495 178.801 -3.306 1
1 603 . 3 1 1 A 51 51 LEU CA C 405 55.914 58.163 -2.249 1
1 604 . 3 1 1 A 51 51 LEU CB C 405 38.662 41.829 -3.167 1
1 607 . 3 1 1 A 51 51 LEU N N 405 121.951 122.611 -0.660 1
1 608 . 3 1 1 A 52 52 THR H H 406 8.786 8.617 0.169 1
1 609 . 3 1 1 A 52 52 THR HA H 406 4.024 4.011 0.013 1
1 614 . 3 1 1 A 52 52 THR C C 406 174.139 177.142 -3.003 1
1 615 . 3 1 1 A 52 52 THR CA C 406 64.017 66.550 -2.533 1
1 616 . 3 1 1 A 52 52 THR CB C 406 66.115 68.542 -2.427 1
1 618 . 3 1 1 A 52 52 THR N N 406 115.258 115.088 0.170 1
1 619 . 3 1 1 A 53 53 SER H H 407 8.115 7.880 0.235 1
1 620 . 3 1 1 A 53 53 SER HA H 407 4.204 4.285 -0.081 1
1 623 . 3 1 1 A 53 53 SER C C 407 174.456 176.880 -2.424 1
1 624 . 3 1 1 A 53 53 SER CA C 407 59.090 60.689 -1.599 1
1 625 . 3 1 1 A 53 53 SER CB C 407 60.146 63.310 -3.164 1
1 626 . 3 1 1 A 53 53 SER N N 407 116.852 114.881 1.971 1
1 627 . 3 1 1 A 54 54 TRP H H 408 8.123 7.675 0.448 1
1 628 . 3 1 1 A 54 54 TRP HA H 408 4.371 4.251 0.120 1
1 637 . 3 1 1 A 54 54 TRP C C 408 175.981 178.586 -2.605 1
1 638 . 3 1 1 A 54 54 TRP CA C 408 57.323 60.780 -3.457 1
1 639 . 3 1 1 A 54 54 TRP CB C 408 26.812 29.549 -2.737 1
1 645 . 3 1 1 A 54 54 TRP N N 408 123.556 123.283 0.273 1
1 647 . 3 1 1 A 55 55 GLN H H 409 8.502 8.540 -0.038 1
1 648 . 3 1 1 A 55 55 GLN HA H 409 3.999 3.743 0.256 1
1 655 . 3 1 1 A 55 55 GLN C C 409 177.300 178.646 -1.346 1
1 656 . 3 1 1 A 55 55 GLN CA C 409 56.484 59.043 -2.559 1
1 657 . 3 1 1 A 55 55 GLN CB C 409 26.190 28.183 -1.993 1
1 659 . 3 1 1 A 55 55 GLN N N 409 118.044 118.314 -0.270 1
1 661 . 3 1 1 A 56 56 GLU H H 410 8.467 8.676 -0.209 1
1 662 . 3 1 1 A 56 56 GLU HA H 410 4.057 4.098 -0.041 1
1 667 . 3 1 1 A 56 56 GLU C C 410 174.787 177.248 -2.461 1
1 668 . 3 1 1 A 56 56 GLU CA C 410 55.909 58.531 -2.622 1
1 669 . 3 1 1 A 56 56 GLU CB C 410 26.895 29.243 -2.348 1
1 671 . 3 1 1 A 56 56 GLU N N 410 119.448 119.924 -0.476 1
1 672 . 3 1 1 A 57 57 SER H H 411 7.438 7.457 -0.019 1
1 673 . 3 1 1 A 57 57 SER HA H 411 4.607 4.554 0.053 1
1 676 . 3 1 1 A 57 57 SER C C 411 170.849 173.874 -3.025 1
1 677 . 3 1 1 A 57 57 SER CA C 411 55.540 57.543 -2.003 1
1 678 . 3 1 1 A 57 57 SER CB C 411 60.928 62.983 -2.055 1
1 679 . 3 1 1 A 57 57 SER N N 411 113.752 112.927 0.825 1
1 680 . 3 1 1 A 58 58 GLU H H 412 7.855 7.834 0.021 1
1 681 . 3 1 1 A 58 58 GLU HA H 412 3.772 3.913 -0.141 1
1 686 . 3 1 1 A 58 58 GLU C C 412 173.743 175.242 -1.499 1
1 687 . 3 1 1 A 58 58 GLU CA C 412 54.442 56.725 -2.283 1
1 688 . 3 1 1 A 58 58 GLU CB C 412 24.603 28.062 -3.459 1
1 690 . 3 1 1 A 58 58 GLU N N 412 115.908 117.595 -1.687 1
1 691 . 3 1 1 A 59 59 GLY H H 413 7.588 8.130 -0.542 1
1 692 . 3 1 1 A 59 59 GLY HA2 H 413 1.643 2.994 -1.351 1
1 693 . 3 1 1 A 59 59 GLY HA3 H 413 2.949 3.123 -0.174 1
1 694 . 3 1 1 A 59 59 GLY C C 413 170.850 172.361 -1.511 1
1 695 . 3 1 1 A 59 59 GLY CA C 413 41.724 44.571 -2.847 1
1 696 . 3 1 1 A 59 59 GLY N N 413 108.032 109.836 -1.804 1
1 697 . 3 1 1 A 60 60 GLN H H 414 7.973 8.487 -0.514 1
1 698 . 3 1 1 A 60 60 GLN HA H 414 4.366 4.657 -0.291 1
1 705 . 3 1 1 A 60 60 GLN C C 414 173.108 175.663 -2.555 1
1 706 . 3 1 1 A 60 60 GLN CA C 414 52.422 55.181 -2.759 1
1 707 . 3 1 1 A 60 60 GLN CB C 414 27.049 29.254 -2.205 1
1 709 . 3 1 1 A 60 60 GLN N N 414 122.690 124.635 -1.945 1
1 711 . 3 1 1 A 61 61 GLY H H 415 8.301 8.011 0.290 1
1 712 . 3 1 1 A 61 61 GLY HA2 H 415 3.700 4.248 -0.548 1
1 713 . 3 1 1 A 61 61 GLY HA3 H 415 3.920 4.284 -0.364 1
1 714 . 3 1 1 A 61 61 GLY C C 415 170.249 174.415 -4.166 1
1 715 . 3 1 1 A 61 61 GLY CA C 415 42.210 44.526 -2.316 1
1 716 . 3 1 1 A 61 61 GLY N N 415 110.794 114.054 -3.260 1
1 717 . 3 1 1 A 62 62 CYS H H 416 8.549 8.421 0.128 1
1 718 . 3 1 1 A 62 62 CYS HA H 416 4.227 4.666 -0.439 1
1 721 . 3 1 1 A 62 62 CYS C C 416 172.914 175.456 -2.542 1
1 722 . 3 1 1 A 62 62 CYS CA C 416 54.008 58.613 -4.605 1
1 723 . 3 1 1 A 62 62 CYS CB C 416 29.716 27.430 2.286 1
1 724 . 3 1 1 A 62 62 CYS N N 416 123.683 120.931 2.752 1
1 725 . 3 1 1 A 63 63 PRO HA H 417 2.611 3.047 -0.436 1
1 732 . 3 1 1 A 63 63 PRO C C 417 174.143 177.677 -3.534 1
1 733 . 3 1 1 A 63 63 PRO CA C 417 61.689 63.869 -2.180 1
1 734 . 3 1 1 A 63 63 PRO CB C 417 28.534 31.034 -2.500 1
1 737 . 3 1 1 A 64 64 PHE H H 418 8.968 7.837 1.131 1
1 738 . 3 1 1 A 64 64 PHE HA H 418 4.250 4.184 0.066 1
1 746 . 3 1 1 A 64 64 PHE C C 418 174.243 177.976 -3.733 1
1 747 . 3 1 1 A 64 64 PHE CA C 418 56.720 60.441 -3.721 1
1 748 . 3 1 1 A 64 64 PHE CB C 418 36.458 39.438 -2.980 1
1 752 . 3 1 1 A 64 64 PHE N N 418 117.008 115.504 1.504 1
1 753 . 3 1 1 A 65 65 CYS H H 419 7.968 8.001 -0.033 1
1 754 . 3 1 1 A 65 65 CYS HA H 419 4.906 4.494 0.412 1
1 757 . 3 1 1 A 65 65 CYS C C 419 173.198 174.800 -1.602 1
1 758 . 3 1 1 A 65 65 CYS CA C 419 55.870 60.009 -4.139 1
1 759 . 3 1 1 A 65 65 CYS CB C 419 30.559 28.938 1.621 1
1 760 . 3 1 1 A 65 65 CYS N N 419 117.505 117.543 -0.038 1
1 761 . 3 1 1 A 66 66 ARG H H 420 8.761 8.193 0.568 1
1 762 . 3 1 1 A 66 66 ARG HA H 420 4.365 4.174 0.191 1
1 769 . 3 1 1 A 66 66 ARG C C 420 172.921 175.204 -2.283 1
1 770 . 3 1 1 A 66 66 ARG CA C 420 54.763 56.973 -2.210 1
1 771 . 3 1 1 A 66 66 ARG CB C 420 24.286 28.151 -3.865 1
1 774 . 3 1 1 A 66 66 ARG N N 420 118.763 116.800 1.963 1
1 775 . 3 1 1 A 67 67 CYS H H 421 8.223 7.817 0.406 1
1 776 . 3 1 1 A 67 67 CYS HA H 421 4.419 4.984 -0.565 1
1 779 . 3 1 1 A 67 67 CYS C C 421 171.160 174.088 -2.928 1
1 780 . 3 1 1 A 67 67 CYS CA C 421 57.119 57.064 0.055 1
1 781 . 3 1 1 A 67 67 CYS CB C 421 25.911 30.228 -4.317 1
1 782 . 3 1 1 A 67 67 CYS N N 421 120.627 114.572 6.055 1
1 783 . 3 1 1 A 68 68 GLU H H 422 8.416 8.408 0.008 1
1 784 . 3 1 1 A 68 68 GLU HA H 422 4.025 4.440 -0.415 1
1 789 . 3 1 1 A 68 68 GLU C C 422 173.764 176.272 -2.508 1
1 790 . 3 1 1 A 68 68 GLU CA C 422 54.752 57.074 -2.322 1
1 791 . 3 1 1 A 68 68 GLU CB C 422 27.302 30.117 -2.815 1
1 793 . 3 1 1 A 68 68 GLU N N 422 122.370 120.327 2.043 1
1 794 . 3 1 1 A 69 69 ILE H H 423 8.648 8.720 -0.072 1
1 795 . 3 1 1 A 69 69 ILE HA H 423 4.012 4.745 -0.733 1
1 805 . 3 1 1 A 69 69 ILE C C 423 174.257 175.408 -1.151 1
1 806 . 3 1 1 A 69 69 ILE CA C 423 59.740 60.663 -0.923 1
1 807 . 3 1 1 A 69 69 ILE CB C 423 35.846 40.010 -4.164 1
1 811 . 3 1 1 A 69 69 ILE N N 423 125.988 124.811 1.177 1
1 812 . 3 1 1 A 70 70 LYS H H 424 9.185 9.562 -0.377 1
1 813 . 3 1 1 A 70 70 LYS HA H 424 4.434 4.491 -0.057 1
1 822 . 3 1 1 A 70 70 LYS C C 424 173.880 176.137 -2.257 1
1 823 . 3 1 1 A 70 70 LYS CA C 424 53.378 57.354 -3.976 1
1 824 . 3 1 1 A 70 70 LYS CB C 424 30.397 35.478 -5.081 1
1 828 . 3 1 1 A 70 70 LYS N N 424 128.977 129.268 -0.291 1
1 829 . 3 1 1 A 71 71 GLY H H 425 7.810 7.787 0.023 1
1 830 . 3 1 1 A 71 71 GLY HA2 H 425 4.094 4.155 -0.061 1
1 831 . 3 1 1 A 71 71 GLY HA3 H 425 4.159 4.157 0.002 1
1 832 . 3 1 1 A 71 71 GLY C C 425 168.179 172.686 -4.507 1
1 833 . 3 1 1 A 71 71 GLY CA C 425 42.326 44.664 -2.338 1
1 834 . 3 1 1 A 71 71 GLY N N 425 107.696 106.903 0.793 1
1 835 . 3 1 1 A 72 72 THR H H 426 8.048 8.558 -0.510 1
1 836 . 3 1 1 A 72 72 THR HA H 426 5.258 5.674 -0.416 1
1 841 . 3 1 1 A 72 72 THR C C 426 170.979 172.882 -1.903 1
1 842 . 3 1 1 A 72 72 THR CA C 426 56.755 60.323 -3.568 1
1 843 . 3 1 1 A 72 72 THR CB C 426 69.226 71.974 -2.748 1
1 845 . 3 1 1 A 72 72 THR N N 426 109.122 112.048 -2.926 1
1 846 . 3 1 1 A 73 73 GLU H H 427 8.912 9.290 -0.378 1
1 847 . 3 1 1 A 73 73 GLU HA H 427 4.954 4.857 0.097 1
1 852 . 3 1 1 A 73 73 GLU C C 427 170.353 176.343 -5.990 1
1 853 . 3 1 1 A 73 73 GLU CA C 427 50.182 53.088 -2.906 1
1 854 . 3 1 1 A 73 73 GLU CB C 427 30.559 31.008 -0.449 1
1 856 . 3 1 1 A 73 73 GLU N N 427 121.703 121.817 -0.114 1
1 1 . 3 1 1 A 74 74 PRO HA H 428 4.372 4.986 -0.614 1
1 2 . 3 1 1 A 74 74 PRO C C 428 173.839 177.086 -3.247 1
1 3 . 3 1 1 A 74 74 PRO CA C 428 60.241 63.483 -3.242 1
1 4 . 3 1 1 A 74 74 PRO CB C 428 29.299 32.557 -3.258 1
1 857 . 3 1 1 A 74 74 PRO HA H 428 4.782 4.986 -0.204 1
1 864 . 3 1 1 A 74 74 PRO C C 428 174.027 177.086 -3.059 1
1 865 . 3 1 1 A 74 74 PRO CA C 428 59.771 63.483 -3.712 1
1 866 . 3 1 1 A 74 74 PRO CB C 428 29.633 32.557 -2.924 1
1 7 . 3 1 1 A 75 75 ILE H H 429 8.144 7.940 0.204 1
1 8 . 3 1 1 A 75 75 ILE HA H 429 4.086 4.229 -0.143 1
1 15 . 3 1 1 A 75 75 ILE C C 429 173.426 174.271 -0.845 1
1 16 . 3 1 1 A 75 75 ILE CA C 429 58.339 62.794 -4.455 1
1 17 . 3 1 1 A 75 75 ILE CB C 429 35.988 36.999 -1.011 1
1 21 . 3 1 1 A 75 75 ILE N N 429 121.551 117.590 3.961 1
1 869 . 3 1 1 A 75 75 ILE H H 429 7.682 7.940 -0.258 1
1 870 . 3 1 1 A 75 75 ILE HA H 429 4.282 4.229 0.053 1
1 880 . 3 1 1 A 75 75 ILE C C 429 172.510 174.271 -1.761 1
1 881 . 3 1 1 A 75 75 ILE CA C 429 57.456 62.794 -5.338 1
1 882 . 3 1 1 A 75 75 ILE CB C 429 37.903 36.999 0.904 1
1 886 . 3 1 1 A 75 75 ILE N N 429 119.651 117.590 2.061 1
1 1 . 3 1 1 A 76 76 VAL HA H 430 4.086 4.562 -0.476 1
1 2 . 3 1 1 A 76 76 VAL CA C 430 59.372 61.707 -2.335 1
1 22 . 3 1 1 A 76 76 VAL H H 430 8.221 8.928 -0.707 1
1 23 . 3 1 1 A 76 76 VAL HA H 430 4.083 4.562 -0.479 1
1 24 . 3 1 1 A 76 76 VAL C C 430 173.067 174.545 -1.478 1
1 25 . 3 1 1 A 76 76 VAL CA C 430 59.445 61.707 -2.262 1
1 26 . 3 1 1 A 76 76 VAL CB C 430 30.407 32.461 -2.054 1
1 27 . 3 1 1 A 76 76 VAL N N 430 125.930 126.801 -0.871 1
1 887 . 3 1 1 A 76 76 VAL H H 430 8.122 8.928 -0.806 1
1 888 . 3 1 1 A 76 76 VAL HA H 430 4.197 4.562 -0.365 1
1 890 . 3 1 1 A 76 76 VAL C C 430 172.971 174.545 -1.574 1
1 891 . 3 1 1 A 76 76 VAL CA C 430 58.821 61.707 -2.886 1
1 892 . 3 1 1 A 76 76 VAL CB C 430 30.807 32.461 -1.654 1
1 895 . 3 1 1 A 76 76 VAL N N 430 124.178 126.801 -2.623 1
1 4 . 3 1 1 A 77 77 VAL H H 431 8.204 8.854 -0.650 1
1 5 . 3 1 1 A 77 77 VAL HA H 431 4.049 4.987 -0.938 1
1 6 . 3 1 1 A 77 77 VAL C C 431 172.636 174.305 -1.669 1
1 7 . 3 1 1 A 77 77 VAL CA C 431 59.315 60.090 -0.775 1
1 8 . 3 1 1 A 77 77 VAL CB C 431 30.219 34.503 -4.284 1
1 9 . 3 1 1 A 77 77 VAL N N 431 125.320 119.591 5.729 1
1 28 . 3 1 1 A 77 77 VAL H H 431 8.412 8.854 -0.442 1
1 29 . 3 1 1 A 77 77 VAL HA H 431 4.038 4.987 -0.949 1
1 37 . 3 1 1 A 77 77 VAL C C 431 172.617 174.305 -1.688 1
1 38 . 3 1 1 A 77 77 VAL CA C 431 59.137 60.090 -0.953 1
1 39 . 3 1 1 A 77 77 VAL CB C 431 30.292 34.503 -4.211 1
1 42 . 3 1 1 A 77 77 VAL N N 431 125.655 119.591 6.064 1
1 896 . 3 1 1 A 77 77 VAL H H 431 8.448 8.854 -0.406 1
1 897 . 3 1 1 A 77 77 VAL HA H 431 4.087 4.987 -0.900 1
1 905 . 3 1 1 A 77 77 VAL C C 431 172.493 174.305 -1.812 1
1 906 . 3 1 1 A 77 77 VAL CA C 431 59.185 60.090 -0.905 1
1 907 . 3 1 1 A 77 77 VAL CB C 431 30.084 34.503 -4.419 1
1 910 . 3 1 1 A 77 77 VAL N N 431 125.770 119.591 6.179 1
1 43 . 3 1 1 A 78 78 ASP H H 432 8.419 8.779 -0.360 1
1 44 . 3 1 1 A 78 78 ASP HA H 432 4.829 4.979 -0.150 1
1 45 . 3 1 1 A 78 78 ASP C C 432 172.252 176.023 -3.771 1
1 46 . 3 1 1 A 78 78 ASP CA C 432 49.320 51.921 -2.601 1
1 47 . 3 1 1 A 78 78 ASP CB C 432 39.066 43.476 -4.410 1
1 48 . 3 1 1 A 78 78 ASP N N 432 126.226 125.110 1.116 1
1 911 . 3 1 1 A 78 78 ASP H H 432 8.493 8.779 -0.286 1
1 912 . 3 1 1 A 78 78 ASP HA H 432 4.852 4.979 -0.127 1
1 915 . 3 1 1 A 78 78 ASP C C 432 172.048 176.023 -3.975 1
1 916 . 3 1 1 A 78 78 ASP CA C 432 49.233 51.921 -2.688 1
1 917 . 3 1 1 A 78 78 ASP CB C 432 38.858 43.476 -4.618 1
1 918 . 3 1 1 A 78 78 ASP N N 432 126.705 125.110 1.595 1
1 10 . 3 1 1 A 79 79 PRO CA C 433 63.865 65.242 -1.377 1
1 49 . 3 1 1 A 79 79 PRO C C 433 173.867 177.319 -3.452 1
1 919 . 3 1 1 A 79 79 PRO HA H 433 4.237 4.349 -0.112 1
1 926 . 3 1 1 A 79 79 PRO C C 433 173.812 177.319 -3.507 1
1 927 . 3 1 1 A 79 79 PRO CA C 433 60.627 65.242 -4.615 1
1 928 . 3 1 1 A 79 79 PRO CB C 433 29.329 31.929 -2.600 1
1 11 . 3 1 1 A 80 80 PHE H H 434 8.182 8.301 -0.119 1
1 12 . 3 1 1 A 80 80 PHE HA H 434 4.499 4.279 0.220 1
1 13 . 3 1 1 A 80 80 PHE C C 434 171.680 174.605 -2.925 1
1 14 . 3 1 1 A 80 80 PHE CA C 434 54.657 58.890 -4.233 1
1 15 . 3 1 1 A 80 80 PHE CB C 434 36.272 37.666 -1.394 1
1 16 . 3 1 1 A 80 80 PHE N N 434 118.611 118.151 0.460 1
1 50 . 3 1 1 A 80 80 PHE H H 434 8.191 8.301 -0.110 1
1 51 . 3 1 1 A 80 80 PHE HA H 434 4.528 4.279 0.249 1
1 54 . 3 1 1 A 80 80 PHE C C 434 172.457 174.605 -2.148 1
1 55 . 3 1 1 A 80 80 PHE CA C 434 54.828 58.890 -4.062 1
1 56 . 3 1 1 A 80 80 PHE CB C 434 36.457 37.666 -1.209 1
1 57 . 3 1 1 A 80 80 PHE N N 434 118.871 118.151 0.720 1
1 931 . 3 1 1 A 80 80 PHE H H 434 8.191 8.301 -0.110 1
1 932 . 3 1 1 A 80 80 PHE HA H 434 4.463 4.279 0.184 1
1 939 . 3 1 1 A 80 80 PHE C C 434 172.283 174.605 -2.322 1
1 940 . 3 1 1 A 80 80 PHE CA C 434 54.971 58.890 -3.919 1
1 941 . 3 1 1 A 80 80 PHE CB C 434 36.490 37.666 -1.176 1
1 944 . 3 1 1 A 80 80 PHE N N 434 119.263 118.151 1.112 1
1 17 . 3 1 1 A 81 81 ASP H H 435 7.490 8.479 -0.989 1
1 18 . 3 1 1 A 81 81 ASP HA H 435 4.698 4.324 0.374 1
1 19 . 3 1 1 A 81 81 ASP C C 435 171.662 177.015 -5.353 1
1 20 . 3 1 1 A 81 81 ASP CA C 435 49.570 54.734 -5.164 1
1 21 . 3 1 1 A 81 81 ASP CB C 435 40.104 39.076 1.028 1
1 22 . 3 1 1 A 81 81 ASP N N 435 120.304 119.519 0.785 1
1 58 . 3 1 1 A 81 81 ASP H H 435 7.881 8.479 -0.598 1
1 59 . 3 1 1 A 81 81 ASP HA H 435 4.801 4.324 0.477 1
1 60 . 3 1 1 A 81 81 ASP C C 435 171.144 177.015 -5.871 1
1 61 . 3 1 1 A 81 81 ASP CA C 435 49.406 54.734 -5.328 1
1 62 . 3 1 1 A 81 81 ASP CB C 435 38.618 39.076 -0.458 1
1 63 . 3 1 1 A 81 81 ASP N N 435 123.108 119.519 3.589 1
1 945 . 3 1 1 A 81 81 ASP H H 435 7.823 8.479 -0.656 1
1 946 . 3 1 1 A 81 81 ASP HA H 435 4.759 4.324 0.435 1
1 949 . 3 1 1 A 81 81 ASP C C 435 171.057 177.015 -5.958 1
1 950 . 3 1 1 A 81 81 ASP CA C 435 49.174 54.734 -5.560 1
1 951 . 3 1 1 A 81 81 ASP CB C 435 38.725 39.076 -0.351 1
1 952 . 3 1 1 A 81 81 ASP N N 435 123.530 119.519 4.011 1
1 23 . 3 1 1 A 82 82 PRO HA H 436 4.758 4.619 0.139 1
1 24 . 3 1 1 A 82 82 PRO C C 436 172.944 177.387 -4.443 1
1 25 . 3 1 1 A 82 82 PRO CA C 436 60.134 63.589 -3.455 1
1 26 . 3 1 1 A 82 82 PRO CB C 436 31.425 32.603 -1.178 1
1 64 . 3 1 1 A 82 82 PRO HA H 436 4.364 4.619 -0.255 1
1 67 . 3 1 1 A 82 82 PRO C C 436 173.563 177.387 -3.824 1
1 68 . 3 1 1 A 82 82 PRO CA C 436 60.729 63.589 -2.860 1
1 69 . 3 1 1 A 82 82 PRO CB C 436 29.160 32.603 -3.443 1
1 953 . 3 1 1 A 82 82 PRO HA H 436 4.296 4.619 -0.323 1
1 960 . 3 1 1 A 82 82 PRO C C 436 173.494 177.387 -3.893 1
1 961 . 3 1 1 A 82 82 PRO CA C 436 60.625 63.589 -2.964 1
1 962 . 3 1 1 A 82 82 PRO CB C 436 29.237 32.603 -3.366 1
1 1 . 4 1 1 A 3 3 LEU HA H 357 4.257 4.402 -0.145 1
1 11 . 4 1 1 A 3 3 LEU C C 357 174.994 177.168 -2.174 1
1 12 . 4 1 1 A 3 3 LEU CA C 357 53.329 54.422 -1.093 1
1 13 . 4 1 1 A 3 3 LEU CB C 357 39.382 43.358 -3.976 1
1 17 . 4 1 1 A 4 4 GLN H H 358 8.234 8.005 0.229 1
1 18 . 4 1 1 A 4 4 GLN HA H 358 4.211 4.160 0.051 1
1 25 . 4 1 1 A 4 4 GLN C C 358 173.357 176.513 -3.156 1
1 26 . 4 1 1 A 4 4 GLN CA C 358 53.791 57.999 -4.208 1
1 27 . 4 1 1 A 4 4 GLN CB C 358 26.456 27.445 -0.989 1
1 29 . 4 1 1 A 4 4 GLN N N 358 119.506 117.072 2.434 1
1 31 . 4 1 1 A 5 5 ASP H H 359 8.090 8.652 -0.562 1
1 32 . 4 1 1 A 5 5 ASP HA H 359 4.458 4.566 -0.108 1
1 35 . 4 1 1 A 5 5 ASP C C 359 173.492 175.037 -1.545 1
1 36 . 4 1 1 A 5 5 ASP CA C 359 52.309 55.911 -3.602 1
1 37 . 4 1 1 A 5 5 ASP CB C 359 38.312 40.916 -2.604 1
1 38 . 4 1 1 A 5 5 ASP N N 359 120.683 121.696 -1.013 1
1 39 . 4 1 1 A 6 6 HIS H H 360 8.103 7.698 0.405 1
1 40 . 4 1 1 A 6 6 HIS HA H 360 4.540 5.121 -0.581 1
1 45 . 4 1 1 A 6 6 HIS C C 360 172.801 174.928 -2.127 1
1 46 . 4 1 1 A 6 6 HIS CA C 360 53.874 54.795 -0.921 1
1 47 . 4 1 1 A 6 6 HIS CB C 360 27.878 33.516 -5.638 1
1 50 . 4 1 1 A 6 6 HIS N N 360 118.844 113.318 5.526 1
1 51 . 4 1 1 A 7 7 ILE H H 361 7.862 8.820 -0.958 1
1 52 . 4 1 1 A 7 7 ILE HA H 361 4.010 4.177 -0.167 1
1 62 . 4 1 1 A 7 7 ILE C C 361 173.268 176.139 -2.871 1
1 63 . 4 1 1 A 7 7 ILE CA C 361 58.740 62.403 -3.663 1
1 64 . 4 1 1 A 7 7 ILE CB C 361 35.788 38.652 -2.864 1
1 68 . 4 1 1 A 7 7 ILE N N 361 121.598 123.028 -1.430 1
1 69 . 4 1 1 A 8 8 LYS H H 362 8.231 7.781 0.450 1
1 70 . 4 1 1 A 8 8 LYS HA H 362 4.313 4.785 -0.472 1
1 79 . 4 1 1 A 8 8 LYS C C 362 173.899 174.613 -0.714 1
1 80 . 4 1 1 A 8 8 LYS CA C 362 53.677 54.520 -0.843 1
1 81 . 4 1 1 A 8 8 LYS CB C 362 30.355 35.772 -5.417 1
1 85 . 4 1 1 A 8 8 LYS N N 362 124.980 116.057 8.923 1
1 86 . 4 1 1 A 9 9 VAL H H 363 8.044 8.457 -0.413 1
1 87 . 4 1 1 A 9 9 VAL HA H 363 4.089 4.419 -0.330 1
1 95 . 4 1 1 A 9 9 VAL C C 363 173.760 175.418 -1.658 1
1 96 . 4 1 1 A 9 9 VAL CA C 363 59.814 62.264 -2.450 1
1 97 . 4 1 1 A 9 9 VAL CB C 363 30.058 32.407 -2.349 1
1 100 . 4 1 1 A 9 9 VAL N N 363 121.366 121.805 -0.439 1
1 101 . 4 1 1 A 10 10 THR H H 364 8.076 8.543 -0.467 1
1 102 . 4 1 1 A 10 10 THR HA H 364 4.302 4.830 -0.528 1
1 107 . 4 1 1 A 10 10 THR C C 364 172.135 176.134 -3.999 1
1 108 . 4 1 1 A 10 10 THR CA C 364 59.134 60.648 -1.514 1
1 109 . 4 1 1 A 10 10 THR CB C 364 67.415 71.471 -4.056 1
1 111 . 4 1 1 A 10 10 THR N N 364 116.817 118.644 -1.827 1
1 112 . 4 1 1 A 11 11 GLN H H 365 8.463 9.006 -0.543 1
1 113 . 4 1 1 A 11 11 GLN HA H 365 4.046 4.133 -0.087 1
1 120 . 4 1 1 A 11 11 GLN C C 365 173.944 178.469 -4.525 1
1 121 . 4 1 1 A 11 11 GLN CA C 365 54.517 59.578 -5.061 1
1 122 . 4 1 1 A 11 11 GLN CB C 365 26.250 28.240 -1.990 1
1 124 . 4 1 1 A 11 11 GLN N N 365 122.059 121.164 0.895 1
1 126 . 4 1 1 A 12 12 GLU H H 366 8.449 8.283 0.166 1
1 127 . 4 1 1 A 12 12 GLU HA H 366 4.093 4.151 -0.058 1
1 132 . 4 1 1 A 12 12 GLU C C 366 174.746 178.077 -3.331 1
1 133 . 4 1 1 A 12 12 GLU CA C 366 55.235 59.181 -3.946 1
1 134 . 4 1 1 A 12 12 GLU CB C 366 27.180 29.279 -2.099 1
1 136 . 4 1 1 A 12 12 GLU N N 366 120.415 119.381 1.034 1
1 137 . 4 1 1 A 13 13 GLN H H 367 8.031 7.871 0.160 1
1 138 . 4 1 1 A 13 13 GLN HA H 367 4.113 4.122 -0.009 1
1 145 . 4 1 1 A 13 13 GLN C C 367 173.693 176.245 -2.552 1
1 146 . 4 1 1 A 13 13 GLN CA C 367 54.132 57.188 -3.056 1
1 147 . 4 1 1 A 13 13 GLN CB C 367 26.420 28.740 -2.320 1
1 149 . 4 1 1 A 13 13 GLN N N 367 119.721 118.088 1.633 1
1 151 . 4 1 1 A 14 14 TYR H H 368 8.111 7.919 0.192 1
1 152 . 4 1 1 A 14 14 TYR HA H 368 4.339 4.542 -0.203 1
1 159 . 4 1 1 A 14 14 TYR C C 368 173.916 178.228 -4.312 1
1 160 . 4 1 1 A 14 14 TYR CA C 368 56.572 59.661 -3.089 1
1 161 . 4 1 1 A 14 14 TYR CB C 368 35.879 40.084 -4.205 1
1 164 . 4 1 1 A 14 14 TYR N N 368 120.541 117.337 3.204 1
1 165 . 4 1 1 A 15 15 GLU H H 369 8.287 8.450 -0.163 1
1 166 . 4 1 1 A 15 15 GLU HA H 369 4.009 4.313 -0.304 1
1 171 . 4 1 1 A 15 15 GLU C C 369 174.448 178.903 -4.455 1
1 172 . 4 1 1 A 15 15 GLU CA C 369 55.047 59.449 -4.402 1
1 173 . 4 1 1 A 15 15 GLU CB C 369 27.226 29.607 -2.381 1
1 175 . 4 1 1 A 15 15 GLU N N 369 120.398 121.452 -1.054 1
1 176 . 4 1 1 A 16 16 LEU H H 370 7.785 7.765 0.020 1
1 177 . 4 1 1 A 16 16 LEU HA H 370 4.138 4.034 0.104 1
1 187 . 4 1 1 A 16 16 LEU C C 370 175.089 178.045 -2.956 1
1 188 . 4 1 1 A 16 16 LEU CA C 370 53.425 57.488 -4.063 1
1 189 . 4 1 1 A 16 16 LEU CB C 370 39.554 41.223 -1.669 1
1 193 . 4 1 1 A 16 16 LEU N N 370 121.323 119.467 1.856 1
1 194 . 4 1 1 A 17 17 TYR H H 371 8.038 8.552 -0.514 1
1 195 . 4 1 1 A 17 17 TYR HA H 371 4.380 4.877 -0.497 1
1 202 . 4 1 1 A 17 17 TYR C C 371 173.931 177.312 -3.381 1
1 203 . 4 1 1 A 17 17 TYR CA C 371 56.143 60.084 -3.941 1
1 204 . 4 1 1 A 17 17 TYR CB C 371 35.501 37.128 -1.627 1
1 207 . 4 1 1 A 17 17 TYR N N 371 119.465 118.922 0.543 1
1 208 . 4 1 1 A 18 18 CYS H H 372 8.021 7.417 0.604 1
1 209 . 4 1 1 A 18 18 CYS HA H 372 4.236 4.014 0.222 1
1 212 . 4 1 1 A 18 18 CYS C C 372 172.457 175.651 -3.194 1
1 213 . 4 1 1 A 18 18 CYS CA C 372 56.997 61.025 -4.028 1
1 214 . 4 1 1 A 18 18 CYS CB C 372 25.080 26.633 -1.553 1
1 215 . 4 1 1 A 18 18 CYS N N 372 119.913 119.299 0.614 1
1 216 . 4 1 1 A 19 19 GLU H H 373 8.151 8.439 -0.288 1
1 217 . 4 1 1 A 19 19 GLU HA H 373 4.130 4.626 -0.496 1
1 222 . 4 1 1 A 19 19 GLU C C 373 174.151 175.858 -1.707 1
1 223 . 4 1 1 A 19 19 GLU CA C 373 54.535 57.908 -3.373 1
1 224 . 4 1 1 A 19 19 GLU CB C 373 27.244 32.528 -5.284 1
1 226 . 4 1 1 A 19 19 GLU N N 373 122.431 120.155 2.276 1
1 227 . 4 1 1 A 20 20 MET H H 374 8.109 8.587 -0.478 1
1 228 . 4 1 1 A 20 20 MET HA H 374 4.352 4.617 -0.265 1
1 236 . 4 1 1 A 20 20 MET C C 374 174.200 176.671 -2.471 1
1 237 . 4 1 1 A 20 20 MET CA C 374 53.238 54.575 -1.337 1
1 238 . 4 1 1 A 20 20 MET CB C 374 30.237 33.420 -3.183 1
1 241 . 4 1 1 A 20 20 MET N N 374 119.754 119.116 0.638 1
1 242 . 4 1 1 A 21 21 GLY H H 375 8.231 8.694 -0.463 1
1 243 . 4 1 1 A 21 21 GLY HA2 H 375 3.861 4.031 -0.170 1
1 244 . 4 1 1 A 21 21 GLY HA3 H 375 3.960 4.061 -0.101 1
1 245 . 4 1 1 A 21 21 GLY C C 375 171.928 174.441 -2.513 1
1 246 . 4 1 1 A 21 21 GLY CA C 375 42.930 45.402 -2.472 1
1 247 . 4 1 1 A 21 21 GLY N N 375 109.484 114.311 -4.827 1
1 248 . 4 1 1 A 22 22 SER HA H 376 4.492 4.783 -0.291 1
1 251 . 4 1 1 A 22 22 SER C C 376 172.206 174.100 -1.894 1
1 252 . 4 1 1 A 22 22 SER CA C 376 55.570 57.952 -2.382 1
1 253 . 4 1 1 A 22 22 SER CB C 376 61.525 63.804 -2.279 1
1 254 . 4 1 1 A 23 23 THR H H 377 8.470 8.920 -0.450 1
1 255 . 4 1 1 A 23 23 THR HA H 377 4.295 4.899 -0.604 1
1 260 . 4 1 1 A 23 23 THR C C 377 171.811 173.936 -2.125 1
1 261 . 4 1 1 A 23 23 THR CA C 377 58.937 61.642 -2.705 1
1 262 . 4 1 1 A 23 23 THR CB C 377 67.250 71.309 -4.059 1
1 264 . 4 1 1 A 23 23 THR N N 377 124.043 122.531 1.512 1
1 265 . 4 1 1 A 24 24 PHE H H 378 8.374 8.973 -0.599 1
1 266 . 4 1 1 A 24 24 PHE HA H 378 4.239 4.660 -0.421 1
1 273 . 4 1 1 A 24 24 PHE C C 378 173.411 177.180 -3.769 1
1 274 . 4 1 1 A 24 24 PHE CA C 378 56.697 59.004 -2.307 1
1 275 . 4 1 1 A 24 24 PHE CB C 378 36.538 40.848 -4.310 1
1 278 . 4 1 1 A 24 24 PHE N N 378 124.732 126.808 -2.076 1
1 279 . 4 1 1 A 25 25 GLN H H 379 8.457 8.067 0.390 1
1 280 . 4 1 1 A 25 25 GLN HA H 379 4.038 4.070 -0.032 1
1 287 . 4 1 1 A 25 25 GLN C C 379 172.431 176.294 -3.863 1
1 288 . 4 1 1 A 25 25 GLN CA C 379 54.078 58.141 -4.063 1
1 289 . 4 1 1 A 25 25 GLN CB C 379 26.414 28.569 -2.155 1
1 291 . 4 1 1 A 25 25 GLN N N 379 118.820 119.020 -0.200 1
1 293 . 4 1 1 A 26 26 LEU H H 380 6.985 7.212 -0.227 1
1 294 . 4 1 1 A 26 26 LEU HA H 380 4.229 4.149 0.080 1
1 304 . 4 1 1 A 26 26 LEU C C 380 173.895 176.955 -3.060 1
1 305 . 4 1 1 A 26 26 LEU CA C 380 52.123 55.014 -2.891 1
1 306 . 4 1 1 A 26 26 LEU CB C 380 40.543 42.450 -1.907 1
1 310 . 4 1 1 A 26 26 LEU N N 380 119.079 121.690 -2.611 1
1 311 . 4 1 1 A 27 27 CYS H H 381 8.905 8.970 -0.065 1
1 312 . 4 1 1 A 27 27 CYS HA H 381 4.013 4.524 -0.511 1
1 315 . 4 1 1 A 27 27 CYS C C 381 174.439 176.451 -2.012 1
1 316 . 4 1 1 A 27 27 CYS CA C 381 57.847 59.385 -1.538 1
1 317 . 4 1 1 A 27 27 CYS CB C 381 28.648 28.397 0.251 1
1 318 . 4 1 1 A 27 27 CYS N N 381 125.151 123.361 1.790 1
1 319 . 4 1 1 A 28 28 LYS H H 382 9.351 8.899 0.452 1
1 320 . 4 1 1 A 28 28 LYS HA H 382 4.157 4.165 -0.008 1
1 329 . 4 1 1 A 28 28 LYS C C 382 174.678 178.608 -3.930 1
1 330 . 4 1 1 A 28 28 LYS CA C 382 54.324 58.345 -4.021 1
1 331 . 4 1 1 A 28 28 LYS CB C 382 30.086 32.562 -2.476 1
1 335 . 4 1 1 A 28 28 LYS N N 382 128.840 128.740 0.100 1
1 336 . 4 1 1 A 29 29 ILE H H 383 9.040 7.960 1.080 1
1 337 . 4 1 1 A 29 29 ILE HA H 383 3.804 3.804 0.000 1
1 347 . 4 1 1 A 29 29 ILE C C 383 174.239 177.453 -3.214 1
1 348 . 4 1 1 A 29 29 ILE CA C 383 62.114 64.648 -2.534 1
1 349 . 4 1 1 A 29 29 ILE CB C 383 33.870 38.387 -4.517 1
1 353 . 4 1 1 A 29 29 ILE N N 383 122.718 118.717 4.001 1
1 354 . 4 1 1 A 30 30 CYS H H 384 7.572 7.697 -0.125 1
1 355 . 4 1 1 A 30 30 CYS HA H 384 4.548 4.392 0.156 1
1 358 . 4 1 1 A 30 30 CYS C C 384 172.978 175.093 -2.115 1
1 359 . 4 1 1 A 30 30 CYS CA C 384 54.957 59.668 -4.711 1
1 360 . 4 1 1 A 30 30 CYS CB C 384 29.778 29.315 0.463 1
1 361 . 4 1 1 A 30 30 CYS N N 384 116.356 115.843 0.513 1
1 362 . 4 1 1 A 31 31 ALA H H 385 8.205 8.239 -0.034 1
1 363 . 4 1 1 A 31 31 ALA HA H 385 4.107 4.237 -0.130 1
1 367 . 4 1 1 A 31 31 ALA C C 385 173.139 177.108 -3.969 1
1 368 . 4 1 1 A 31 31 ALA CA C 385 50.802 53.575 -2.773 1
1 369 . 4 1 1 A 31 31 ALA CB C 385 14.634 17.964 -3.330 1
1 370 . 4 1 1 A 31 31 ALA N N 385 125.526 120.894 4.632 1
1 371 . 4 1 1 A 32 32 GLU H H 386 8.416 8.102 0.314 1
1 372 . 4 1 1 A 32 32 GLU HA H 386 4.467 4.405 0.062 1
1 377 . 4 1 1 A 32 32 GLU C C 386 172.325 176.636 -4.311 1
1 378 . 4 1 1 A 32 32 GLU CA C 386 55.146 57.505 -2.359 1
1 379 . 4 1 1 A 32 32 GLU CB C 386 31.181 31.198 -0.017 1
1 381 . 4 1 1 A 32 32 GLU N N 386 117.579 115.866 1.713 1
1 382 . 4 1 1 A 33 33 ASN H H 387 7.872 7.908 -0.036 1
1 383 . 4 1 1 A 33 33 ASN HA H 387 4.900 4.947 -0.047 1
1 388 . 4 1 1 A 33 33 ASN C C 387 171.355 174.885 -3.530 1
1 389 . 4 1 1 A 33 33 ASN CA C 387 49.320 52.381 -3.061 1
1 390 . 4 1 1 A 33 33 ASN CB C 387 38.457 39.466 -1.009 1
1 391 . 4 1 1 A 33 33 ASN N N 387 120.399 116.530 3.869 1
1 393 . 4 1 1 A 34 34 ASP H H 388 8.565 8.614 -0.049 1
1 394 . 4 1 1 A 34 34 ASP HA H 388 4.679 4.831 -0.152 1
1 397 . 4 1 1 A 34 34 ASP C C 388 174.243 175.912 -1.669 1
1 398 . 4 1 1 A 34 34 ASP CA C 388 51.809 53.778 -1.969 1
1 399 . 4 1 1 A 34 34 ASP CB C 388 38.007 42.095 -4.088 1
1 400 . 4 1 1 A 34 34 ASP N N 388 120.661 120.300 0.361 1
1 401 . 4 1 1 A 35 35 LYS H H 389 8.544 8.777 -0.233 1
1 402 . 4 1 1 A 35 35 LYS HA H 389 3.411 4.388 -0.977 1
1 409 . 4 1 1 A 35 35 LYS C C 389 172.938 175.326 -2.388 1
1 410 . 4 1 1 A 35 35 LYS CA C 389 54.973 55.913 -0.940 1
1 411 . 4 1 1 A 35 35 LYS CB C 389 30.617 32.339 -1.722 1
1 415 . 4 1 1 A 35 35 LYS N N 389 119.199 120.356 -1.157 1
1 416 . 4 1 1 A 36 36 ASP H H 390 8.327 8.957 -0.630 1
1 417 . 4 1 1 A 36 36 ASP HA H 390 4.724 4.750 -0.026 1
1 420 . 4 1 1 A 36 36 ASP C C 390 172.860 175.461 -2.601 1
1 421 . 4 1 1 A 36 36 ASP CA C 390 51.609 54.784 -3.175 1
1 422 . 4 1 1 A 36 36 ASP CB C 390 39.018 42.780 -3.762 1
1 423 . 4 1 1 A 36 36 ASP N N 390 119.134 123.117 -3.983 1
1 424 . 4 1 1 A 37 37 VAL H H 391 8.544 8.263 0.281 1
1 425 . 4 1 1 A 37 37 VAL HA H 391 4.877 4.708 0.169 1
1 433 . 4 1 1 A 37 37 VAL C C 391 167.519 173.405 -5.886 1
1 434 . 4 1 1 A 37 37 VAL CA C 391 58.259 59.677 -1.418 1
1 435 . 4 1 1 A 37 37 VAL CB C 391 32.277 34.712 -2.435 1
1 438 . 4 1 1 A 37 37 VAL N N 391 121.970 117.925 4.045 1
1 439 . 4 1 1 A 38 38 LYS H H 392 8.621 9.506 -0.885 1
1 440 . 4 1 1 A 38 38 LYS HA H 392 4.991 5.215 -0.224 1
1 449 . 4 1 1 A 38 38 LYS C C 392 172.681 175.280 -2.599 1
1 450 . 4 1 1 A 38 38 LYS CA C 392 51.123 54.637 -3.514 1
1 451 . 4 1 1 A 38 38 LYS CB C 392 33.697 34.778 -1.081 1
1 455 . 4 1 1 A 38 38 LYS N N 392 126.381 128.980 -2.599 1
1 456 . 4 1 1 A 39 39 ILE H H 393 8.723 8.983 -0.260 1
1 457 . 4 1 1 A 39 39 ILE HA H 393 4.239 4.350 -0.111 1
1 467 . 4 1 1 A 39 39 ILE C C 393 172.642 175.752 -3.110 1
1 468 . 4 1 1 A 39 39 ILE CA C 393 57.768 61.076 -3.308 1
1 469 . 4 1 1 A 39 39 ILE CB C 393 35.691 37.660 -1.969 1
1 473 . 4 1 1 A 39 39 ILE N N 393 126.398 127.729 -1.331 1
1 474 . 4 1 1 A 40 40 GLU H H 394 8.506 9.286 -0.780 1
1 475 . 4 1 1 A 40 40 GLU HA H 394 4.753 4.716 0.037 1
1 480 . 4 1 1 A 40 40 GLU C C 394 173.596 176.142 -2.546 1
1 481 . 4 1 1 A 40 40 GLU CA C 394 49.793 53.447 -3.654 1
1 482 . 4 1 1 A 40 40 GLU CB C 394 28.210 30.471 -2.261 1
1 484 . 4 1 1 A 40 40 GLU N N 394 124.864 128.152 -3.288 1
1 485 . 4 1 1 A 41 41 PRO HA H 395 4.864 4.485 0.379 1
1 492 . 4 1 1 A 41 41 PRO C C 395 175.073 177.098 -2.025 1
1 493 . 4 1 1 A 41 41 PRO CA C 395 61.111 63.848 -2.737 1
1 494 . 4 1 1 A 41 41 PRO CB C 395 32.275 32.958 -0.683 1
1 497 . 4 1 1 A 42 42 CYS H H 396 7.828 7.831 -0.003 1
1 498 . 4 1 1 A 42 42 CYS HA H 396 4.208 4.062 0.146 1
1 501 . 4 1 1 A 42 42 CYS C C 396 173.877 175.010 -1.133 1
1 502 . 4 1 1 A 42 42 CYS CA C 396 58.021 61.500 -3.479 1
1 503 . 4 1 1 A 42 42 CYS CB C 396 28.242 27.763 0.479 1
1 504 . 4 1 1 A 42 42 CYS N N 396 122.434 117.855 4.579 1
1 505 . 4 1 1 A 43 43 GLY H H 397 8.679 8.762 -0.083 1
1 506 . 4 1 1 A 43 43 GLY HA2 H 397 3.507 3.901 -0.394 1
1 507 . 4 1 1 A 43 43 GLY HA3 H 397 3.914 3.910 0.004 1
1 508 . 4 1 1 A 43 43 GLY C C 397 171.981 174.606 -2.625 1
1 509 . 4 1 1 A 43 43 GLY CA C 397 43.347 45.054 -1.707 1
1 510 . 4 1 1 A 43 43 GLY N N 397 112.123 108.482 3.641 1
1 511 . 4 1 1 A 44 44 HIS H H 398 8.329 7.834 0.495 1
1 512 . 4 1 1 A 44 44 HIS HA H 398 4.339 4.478 -0.139 1
1 517 . 4 1 1 A 44 44 HIS C C 398 170.742 174.958 -4.216 1
1 518 . 4 1 1 A 44 44 HIS CA C 398 58.368 56.291 2.077 1
1 519 . 4 1 1 A 44 44 HIS CB C 398 28.434 30.856 -2.422 1
1 522 . 4 1 1 A 44 44 HIS N N 398 121.393 118.534 2.859 1
1 523 . 4 1 1 A 45 45 LEU H H 399 8.241 8.621 -0.380 1
1 524 . 4 1 1 A 45 45 LEU HA H 399 5.570 5.303 0.267 1
1 534 . 4 1 1 A 45 45 LEU C C 399 174.464 175.275 -0.811 1
1 535 . 4 1 1 A 45 45 LEU CA C 399 50.729 53.349 -2.620 1
1 536 . 4 1 1 A 45 45 LEU CB C 399 43.574 44.748 -1.174 1
1 540 . 4 1 1 A 45 45 LEU N N 399 118.469 121.993 -3.524 1
1 541 . 4 1 1 A 46 46 MET H H 400 8.707 9.012 -0.305 1
1 542 . 4 1 1 A 46 46 MET HA H 400 4.842 5.005 -0.163 1
1 550 . 4 1 1 A 46 46 MET C C 400 170.736 174.419 -3.683 1
1 551 . 4 1 1 A 46 46 MET CA C 400 52.804 54.023 -1.219 1
1 552 . 4 1 1 A 46 46 MET CB C 400 31.945 35.395 -3.450 1
1 555 . 4 1 1 A 46 46 MET N N 400 114.897 120.629 -5.732 1
1 556 . 4 1 1 A 47 47 CYS H H 401 9.436 8.447 0.989 1
1 557 . 4 1 1 A 47 47 CYS HA H 401 5.629 4.759 0.870 1
1 560 . 4 1 1 A 47 47 CYS C C 401 173.909 176.114 -2.205 1
1 561 . 4 1 1 A 47 47 CYS CA C 401 54.325 57.287 -2.962 1
1 562 . 4 1 1 A 47 47 CYS CB C 401 30.725 28.933 1.792 1
1 563 . 4 1 1 A 47 47 CYS N N 401 119.575 119.124 0.451 1
1 564 . 4 1 1 A 48 48 THR H H 402 9.842 8.815 1.027 1
1 565 . 4 1 1 A 48 48 THR HA H 402 3.768 3.973 -0.205 1
1 570 . 4 1 1 A 48 48 THR C C 402 174.333 176.287 -1.954 1
1 571 . 4 1 1 A 48 48 THR CA C 402 64.516 65.933 -1.417 1
1 572 . 4 1 1 A 48 48 THR CB C 402 66.288 68.645 -2.357 1
1 574 . 4 1 1 A 48 48 THR N N 402 119.945 119.204 0.741 1
1 575 . 4 1 1 A 49 49 SER H H 403 8.355 8.073 0.282 1
1 576 . 4 1 1 A 49 49 SER HA H 403 4.222 4.093 0.129 1
1 579 . 4 1 1 A 49 49 SER C C 403 175.059 176.583 -1.524 1
1 580 . 4 1 1 A 49 49 SER CA C 403 59.828 61.978 -2.150 1
1 581 . 4 1 1 A 49 49 SER CB C 403 59.717 62.784 -3.067 1
1 582 . 4 1 1 A 49 49 SER N N 403 120.468 116.885 3.583 1
1 583 . 4 1 1 A 50 50 CYS H H 404 9.464 7.930 1.534 1
1 584 . 4 1 1 A 50 50 CYS HA H 404 3.922 4.215 -0.293 1
1 587 . 4 1 1 A 50 50 CYS C C 404 176.081 177.109 -1.028 1
1 588 . 4 1 1 A 50 50 CYS CA C 404 63.076 64.152 -1.076 1
1 589 . 4 1 1 A 50 50 CYS CB C 404 26.078 27.884 -1.806 1
1 590 . 4 1 1 A 50 50 CYS N N 404 126.744 119.673 7.071 1
1 591 . 4 1 1 A 51 51 LEU H H 405 7.948 8.049 -0.101 1
1 592 . 4 1 1 A 51 51 LEU HA H 405 4.064 4.181 -0.117 1
1 602 . 4 1 1 A 51 51 LEU C C 405 175.495 178.919 -3.424 1
1 603 . 4 1 1 A 51 51 LEU CA C 405 55.914 58.068 -2.154 1
1 604 . 4 1 1 A 51 51 LEU CB C 405 38.662 41.846 -3.184 1
1 607 . 4 1 1 A 51 51 LEU N N 405 121.951 122.463 -0.512 1
1 608 . 4 1 1 A 52 52 THR H H 406 8.786 8.543 0.243 1
1 609 . 4 1 1 A 52 52 THR HA H 406 4.024 4.010 0.014 1
1 614 . 4 1 1 A 52 52 THR C C 406 174.139 176.502 -2.363 1
1 615 . 4 1 1 A 52 52 THR CA C 406 64.017 66.578 -2.561 1
1 616 . 4 1 1 A 52 52 THR CB C 406 66.115 68.163 -2.048 1
1 618 . 4 1 1 A 52 52 THR N N 406 115.258 114.956 0.302 1
1 619 . 4 1 1 A 53 53 SER H H 407 8.115 8.159 -0.044 1
1 620 . 4 1 1 A 53 53 SER HA H 407 4.204 4.239 -0.035 1
1 623 . 4 1 1 A 53 53 SER C C 407 174.456 176.958 -2.502 1
1 624 . 4 1 1 A 53 53 SER CA C 407 59.090 61.044 -1.954 1
1 625 . 4 1 1 A 53 53 SER CB C 407 60.146 62.948 -2.802 1
1 626 . 4 1 1 A 53 53 SER N N 407 116.852 115.303 1.549 1
1 627 . 4 1 1 A 54 54 TRP H H 408 8.123 7.788 0.335 1
1 628 . 4 1 1 A 54 54 TRP HA H 408 4.371 4.278 0.093 1
1 637 . 4 1 1 A 54 54 TRP C C 408 175.981 178.609 -2.628 1
1 638 . 4 1 1 A 54 54 TRP CA C 408 57.323 60.991 -3.668 1
1 639 . 4 1 1 A 54 54 TRP CB C 408 26.812 29.690 -2.878 1
1 645 . 4 1 1 A 54 54 TRP N N 408 123.556 123.154 0.402 1
1 647 . 4 1 1 A 55 55 GLN H H 409 8.502 8.599 -0.097 1
1 648 . 4 1 1 A 55 55 GLN HA H 409 3.999 3.635 0.364 1
1 655 . 4 1 1 A 55 55 GLN C C 409 177.300 178.926 -1.626 1
1 656 . 4 1 1 A 55 55 GLN CA C 409 56.484 59.271 -2.787 1
1 657 . 4 1 1 A 55 55 GLN CB C 409 26.190 28.444 -2.254 1
1 659 . 4 1 1 A 55 55 GLN N N 409 118.044 118.339 -0.295 1
1 661 . 4 1 1 A 56 56 GLU H H 410 8.467 8.486 -0.019 1
1 662 . 4 1 1 A 56 56 GLU HA H 410 4.057 4.082 -0.025 1
1 667 . 4 1 1 A 56 56 GLU C C 410 174.787 177.129 -2.342 1
1 668 . 4 1 1 A 56 56 GLU CA C 410 55.909 58.389 -2.480 1
1 669 . 4 1 1 A 56 56 GLU CB C 410 26.895 29.244 -2.349 1
1 671 . 4 1 1 A 56 56 GLU N N 410 119.448 119.174 0.274 1
1 672 . 4 1 1 A 57 57 SER H H 411 7.438 7.539 -0.101 1
1 673 . 4 1 1 A 57 57 SER HA H 411 4.607 4.580 0.027 1
1 676 . 4 1 1 A 57 57 SER C C 411 170.849 173.872 -3.023 1
1 677 . 4 1 1 A 57 57 SER CA C 411 55.540 57.465 -1.925 1
1 678 . 4 1 1 A 57 57 SER CB C 411 60.928 63.140 -2.212 1
1 679 . 4 1 1 A 57 57 SER N N 411 113.752 113.225 0.527 1
1 680 . 4 1 1 A 58 58 GLU H H 412 7.855 7.731 0.124 1
1 681 . 4 1 1 A 58 58 GLU HA H 412 3.772 3.878 -0.106 1
1 686 . 4 1 1 A 58 58 GLU C C 412 173.743 175.532 -1.789 1
1 687 . 4 1 1 A 58 58 GLU CA C 412 54.442 56.664 -2.222 1
1 688 . 4 1 1 A 58 58 GLU CB C 412 24.603 27.965 -3.362 1
1 690 . 4 1 1 A 58 58 GLU N N 412 115.908 117.797 -1.889 1
1 691 . 4 1 1 A 59 59 GLY H H 413 7.588 7.992 -0.404 1
1 692 . 4 1 1 A 59 59 GLY HA2 H 413 1.643 2.452 -0.809 1
1 693 . 4 1 1 A 59 59 GLY HA3 H 413 2.949 3.544 -0.595 1
1 694 . 4 1 1 A 59 59 GLY C C 413 170.850 173.149 -2.299 1
1 695 . 4 1 1 A 59 59 GLY CA C 413 41.724 46.174 -4.450 1
1 696 . 4 1 1 A 59 59 GLY N N 413 108.032 109.828 -1.796 1
1 697 . 4 1 1 A 60 60 GLN H H 414 7.973 8.093 -0.120 1
1 698 . 4 1 1 A 60 60 GLN HA H 414 4.366 4.636 -0.270 1
1 705 . 4 1 1 A 60 60 GLN C C 414 173.108 176.073 -2.965 1
1 706 . 4 1 1 A 60 60 GLN CA C 414 52.422 55.545 -3.123 1
1 707 . 4 1 1 A 60 60 GLN CB C 414 27.049 27.298 -0.249 1
1 709 . 4 1 1 A 60 60 GLN N N 414 122.690 124.567 -1.877 1
1 711 . 4 1 1 A 61 61 GLY H H 415 8.301 8.431 -0.130 1
1 712 . 4 1 1 A 61 61 GLY HA2 H 415 3.700 4.172 -0.472 1
1 713 . 4 1 1 A 61 61 GLY HA3 H 415 3.920 4.202 -0.282 1
1 714 . 4 1 1 A 61 61 GLY C C 415 170.249 174.304 -4.055 1
1 715 . 4 1 1 A 61 61 GLY CA C 415 42.210 44.616 -2.406 1
1 716 . 4 1 1 A 61 61 GLY N N 415 110.794 112.982 -2.188 1
1 717 . 4 1 1 A 62 62 CYS H H 416 8.549 8.703 -0.154 1
1 718 . 4 1 1 A 62 62 CYS HA H 416 4.227 4.731 -0.504 1
1 721 . 4 1 1 A 62 62 CYS C C 416 172.914 175.349 -2.435 1
1 722 . 4 1 1 A 62 62 CYS CA C 416 54.008 58.796 -4.788 1
1 723 . 4 1 1 A 62 62 CYS CB C 416 29.716 27.293 2.423 1
1 724 . 4 1 1 A 62 62 CYS N N 416 123.683 120.448 3.235 1
1 725 . 4 1 1 A 63 63 PRO HA H 417 2.611 3.203 -0.592 1
1 732 . 4 1 1 A 63 63 PRO C C 417 174.143 177.573 -3.430 1
1 733 . 4 1 1 A 63 63 PRO CA C 417 61.689 63.833 -2.144 1
1 734 . 4 1 1 A 63 63 PRO CB C 417 28.534 31.201 -2.667 1
1 737 . 4 1 1 A 64 64 PHE H H 418 8.968 7.937 1.031 1
1 738 . 4 1 1 A 64 64 PHE HA H 418 4.250 4.253 -0.003 1
1 746 . 4 1 1 A 64 64 PHE C C 418 174.243 178.392 -4.149 1
1 747 . 4 1 1 A 64 64 PHE CA C 418 56.720 60.154 -3.434 1
1 748 . 4 1 1 A 64 64 PHE CB C 418 36.458 39.680 -3.222 1
1 752 . 4 1 1 A 64 64 PHE N N 418 117.008 115.326 1.682 1
1 753 . 4 1 1 A 65 65 CYS H H 419 7.968 8.087 -0.119 1
1 754 . 4 1 1 A 65 65 CYS HA H 419 4.906 4.484 0.422 1
1 757 . 4 1 1 A 65 65 CYS C C 419 173.198 174.773 -1.575 1
1 758 . 4 1 1 A 65 65 CYS CA C 419 55.870 59.837 -3.967 1
1 759 . 4 1 1 A 65 65 CYS CB C 419 30.559 28.866 1.693 1
1 760 . 4 1 1 A 65 65 CYS N N 419 117.505 117.697 -0.192 1
1 761 . 4 1 1 A 66 66 ARG H H 420 8.761 7.951 0.810 1
1 762 . 4 1 1 A 66 66 ARG HA H 420 4.365 4.408 -0.043 1
1 769 . 4 1 1 A 66 66 ARG C C 420 172.921 174.563 -1.642 1
1 770 . 4 1 1 A 66 66 ARG CA C 420 54.763 57.238 -2.475 1
1 771 . 4 1 1 A 66 66 ARG CB C 420 24.286 26.825 -2.539 1
1 774 . 4 1 1 A 66 66 ARG N N 420 118.763 116.091 2.672 1
1 775 . 4 1 1 A 67 67 CYS H H 421 8.223 7.933 0.290 1
1 776 . 4 1 1 A 67 67 CYS HA H 421 4.419 4.626 -0.207 1
1 779 . 4 1 1 A 67 67 CYS C C 421 171.160 174.813 -3.653 1
1 780 . 4 1 1 A 67 67 CYS CA C 421 57.119 57.929 -0.810 1
1 781 . 4 1 1 A 67 67 CYS CB C 421 25.911 29.899 -3.988 1
1 782 . 4 1 1 A 67 67 CYS N N 421 120.627 116.712 3.915 1
1 783 . 4 1 1 A 68 68 GLU H H 422 8.416 8.620 -0.204 1
1 784 . 4 1 1 A 68 68 GLU HA H 422 4.025 4.150 -0.125 1
1 789 . 4 1 1 A 68 68 GLU C C 422 173.764 176.461 -2.697 1
1 790 . 4 1 1 A 68 68 GLU CA C 422 54.752 57.475 -2.723 1
1 791 . 4 1 1 A 68 68 GLU CB C 422 27.302 29.768 -2.466 1
1 793 . 4 1 1 A 68 68 GLU N N 422 122.370 120.620 1.750 1
1 794 . 4 1 1 A 69 69 ILE H H 423 8.648 8.960 -0.312 1
1 795 . 4 1 1 A 69 69 ILE HA H 423 4.012 4.485 -0.473 1
1 805 . 4 1 1 A 69 69 ILE C C 423 174.257 175.516 -1.259 1
1 806 . 4 1 1 A 69 69 ILE CA C 423 59.740 60.660 -0.920 1
1 807 . 4 1 1 A 69 69 ILE CB C 423 35.846 38.709 -2.863 1
1 811 . 4 1 1 A 69 69 ILE N N 423 125.988 126.149 -0.161 1
1 812 . 4 1 1 A 70 70 LYS H H 424 9.185 9.372 -0.187 1
1 813 . 4 1 1 A 70 70 LYS HA H 424 4.434 4.497 -0.063 1
1 822 . 4 1 1 A 70 70 LYS C C 424 173.880 175.753 -1.873 1
1 823 . 4 1 1 A 70 70 LYS CA C 424 53.378 57.279 -3.901 1
1 824 . 4 1 1 A 70 70 LYS CB C 424 30.397 35.733 -5.336 1
1 828 . 4 1 1 A 70 70 LYS N N 424 128.977 129.348 -0.371 1
1 829 . 4 1 1 A 71 71 GLY H H 425 7.810 7.973 -0.163 1
1 830 . 4 1 1 A 71 71 GLY HA2 H 425 4.094 4.052 0.042 1
1 831 . 4 1 1 A 71 71 GLY HA3 H 425 4.159 4.054 0.105 1
1 832 . 4 1 1 A 71 71 GLY C C 425 168.179 172.297 -4.118 1
1 833 . 4 1 1 A 71 71 GLY CA C 425 42.326 44.995 -2.669 1
1 834 . 4 1 1 A 71 71 GLY N N 425 107.696 106.729 0.967 1
1 835 . 4 1 1 A 72 72 THR H H 426 8.048 8.524 -0.476 1
1 836 . 4 1 1 A 72 72 THR HA H 426 5.258 5.425 -0.167 1
1 841 . 4 1 1 A 72 72 THR C C 426 170.979 172.190 -1.211 1
1 842 . 4 1 1 A 72 72 THR CA C 426 56.755 59.899 -3.144 1
1 843 . 4 1 1 A 72 72 THR CB C 426 69.226 71.400 -2.174 1
1 845 . 4 1 1 A 72 72 THR N N 426 109.122 110.940 -1.818 1
1 846 . 4 1 1 A 73 73 GLU H H 427 8.912 9.465 -0.553 1
1 847 . 4 1 1 A 73 73 GLU HA H 427 4.954 4.939 0.015 1
1 852 . 4 1 1 A 73 73 GLU C C 427 170.353 174.570 -4.217 1
1 853 . 4 1 1 A 73 73 GLU CA C 427 50.182 52.894 -2.712 1
1 854 . 4 1 1 A 73 73 GLU CB C 427 30.559 33.105 -2.546 1
1 856 . 4 1 1 A 73 73 GLU N N 427 121.703 123.165 -1.462 1
1 1 . 4 1 1 A 74 74 PRO HA H 428 4.372 4.845 -0.473 1
1 2 . 4 1 1 A 74 74 PRO C C 428 173.839 176.569 -2.730 1
1 3 . 4 1 1 A 74 74 PRO CA C 428 60.241 62.465 -2.224 1
1 4 . 4 1 1 A 74 74 PRO CB C 428 29.299 32.387 -3.088 1
1 857 . 4 1 1 A 74 74 PRO HA H 428 4.782 4.845 -0.063 1
1 864 . 4 1 1 A 74 74 PRO C C 428 174.027 176.569 -2.542 1
1 865 . 4 1 1 A 74 74 PRO CA C 428 59.771 62.465 -2.694 1
1 866 . 4 1 1 A 74 74 PRO CB C 428 29.633 32.387 -2.754 1
1 7 . 4 1 1 A 75 75 ILE H H 429 8.144 8.965 -0.821 1
1 8 . 4 1 1 A 75 75 ILE HA H 429 4.086 4.746 -0.660 1
1 15 . 4 1 1 A 75 75 ILE C C 429 173.426 175.340 -1.914 1
1 16 . 4 1 1 A 75 75 ILE CA C 429 58.339 60.342 -2.003 1
1 17 . 4 1 1 A 75 75 ILE CB C 429 35.988 40.311 -4.323 1
1 21 . 4 1 1 A 75 75 ILE N N 429 121.551 122.079 -0.528 1
1 869 . 4 1 1 A 75 75 ILE H H 429 7.682 8.965 -1.283 1
1 870 . 4 1 1 A 75 75 ILE HA H 429 4.282 4.746 -0.464 1
1 880 . 4 1 1 A 75 75 ILE C C 429 172.510 175.340 -2.830 1
1 881 . 4 1 1 A 75 75 ILE CA C 429 57.456 60.342 -2.886 1
1 882 . 4 1 1 A 75 75 ILE CB C 429 37.903 40.311 -2.408 1
1 886 . 4 1 1 A 75 75 ILE N N 429 119.651 122.079 -2.428 1
1 1 . 4 1 1 A 76 76 VAL HA H 430 4.086 4.530 -0.444 1
1 2 . 4 1 1 A 76 76 VAL CA C 430 59.372 60.952 -1.580 1
1 22 . 4 1 1 A 76 76 VAL H H 430 8.221 8.660 -0.439 1
1 23 . 4 1 1 A 76 76 VAL HA H 430 4.083 4.530 -0.447 1
1 24 . 4 1 1 A 76 76 VAL C C 430 173.067 173.996 -0.929 1
1 25 . 4 1 1 A 76 76 VAL CA C 430 59.445 60.952 -1.507 1
1 26 . 4 1 1 A 76 76 VAL CB C 430 30.407 32.100 -1.693 1
1 27 . 4 1 1 A 76 76 VAL N N 430 125.930 123.961 1.969 1
1 887 . 4 1 1 A 76 76 VAL H H 430 8.122 8.660 -0.538 1
1 888 . 4 1 1 A 76 76 VAL HA H 430 4.197 4.530 -0.333 1
1 890 . 4 1 1 A 76 76 VAL C C 430 172.971 173.996 -1.025 1
1 891 . 4 1 1 A 76 76 VAL CA C 430 58.821 60.952 -2.131 1
1 892 . 4 1 1 A 76 76 VAL CB C 430 30.807 32.100 -1.293 1
1 895 . 4 1 1 A 76 76 VAL N N 430 124.178 123.961 0.217 1
1 4 . 4 1 1 A 77 77 VAL H H 431 8.204 8.784 -0.580 1
1 5 . 4 1 1 A 77 77 VAL HA H 431 4.049 5.038 -0.989 1
1 6 . 4 1 1 A 77 77 VAL C C 431 172.636 174.074 -1.438 1
1 7 . 4 1 1 A 77 77 VAL CA C 431 59.315 59.360 -0.045 1
1 8 . 4 1 1 A 77 77 VAL CB C 431 30.219 34.667 -4.448 1
1 9 . 4 1 1 A 77 77 VAL N N 431 125.320 123.821 1.499 1
1 28 . 4 1 1 A 77 77 VAL H H 431 8.412 8.784 -0.372 1
1 29 . 4 1 1 A 77 77 VAL HA H 431 4.038 5.038 -1.000 1
1 37 . 4 1 1 A 77 77 VAL C C 431 172.617 174.074 -1.457 1
1 38 . 4 1 1 A 77 77 VAL CA C 431 59.137 59.360 -0.223 1
1 39 . 4 1 1 A 77 77 VAL CB C 431 30.292 34.667 -4.375 1
1 42 . 4 1 1 A 77 77 VAL N N 431 125.655 123.821 1.834 1
1 896 . 4 1 1 A 77 77 VAL H H 431 8.448 8.784 -0.336 1
1 897 . 4 1 1 A 77 77 VAL HA H 431 4.087 5.038 -0.951 1
1 905 . 4 1 1 A 77 77 VAL C C 431 172.493 174.074 -1.581 1
1 906 . 4 1 1 A 77 77 VAL CA C 431 59.185 59.360 -0.175 1
1 907 . 4 1 1 A 77 77 VAL CB C 431 30.084 34.667 -4.583 1
1 910 . 4 1 1 A 77 77 VAL N N 431 125.770 123.821 1.949 1
1 43 . 4 1 1 A 78 78 ASP H H 432 8.419 8.645 -0.226 1
1 44 . 4 1 1 A 78 78 ASP HA H 432 4.829 4.991 -0.162 1
1 45 . 4 1 1 A 78 78 ASP C C 432 172.252 172.682 -0.430 1
1 46 . 4 1 1 A 78 78 ASP CA C 432 49.320 51.563 -2.243 1
1 47 . 4 1 1 A 78 78 ASP CB C 432 39.066 43.587 -4.521 1
1 48 . 4 1 1 A 78 78 ASP N N 432 126.226 121.924 4.302 1
1 911 . 4 1 1 A 78 78 ASP H H 432 8.493 8.645 -0.152 1
1 912 . 4 1 1 A 78 78 ASP HA H 432 4.852 4.991 -0.139 1
1 915 . 4 1 1 A 78 78 ASP C C 432 172.048 172.682 -0.634 1
1 916 . 4 1 1 A 78 78 ASP CA C 432 49.233 51.563 -2.330 1
1 917 . 4 1 1 A 78 78 ASP CB C 432 38.858 43.587 -4.729 1
1 918 . 4 1 1 A 78 78 ASP N N 432 126.705 121.924 4.781 1
1 10 . 4 1 1 A 79 79 PRO CA C 433 63.865 62.350 1.515 1
1 49 . 4 1 1 A 79 79 PRO C C 433 173.867 177.616 -3.749 1
1 919 . 4 1 1 A 79 79 PRO HA H 433 4.237 4.481 -0.244 1
1 926 . 4 1 1 A 79 79 PRO C C 433 173.812 177.616 -3.804 1
1 927 . 4 1 1 A 79 79 PRO CA C 433 60.627 62.350 -1.723 1
1 928 . 4 1 1 A 79 79 PRO CB C 433 29.329 30.011 -0.682 1
1 11 . 4 1 1 A 80 80 PHE H H 434 8.182 7.965 0.217 1
1 12 . 4 1 1 A 80 80 PHE HA H 434 4.499 4.158 0.341 1
1 13 . 4 1 1 A 80 80 PHE C C 434 171.680 175.486 -3.806 1
1 14 . 4 1 1 A 80 80 PHE CA C 434 54.657 61.007 -6.350 1
1 15 . 4 1 1 A 80 80 PHE CB C 434 36.272 38.877 -2.605 1
1 16 . 4 1 1 A 80 80 PHE N N 434 118.611 122.825 -4.214 1
1 50 . 4 1 1 A 80 80 PHE H H 434 8.191 7.965 0.226 1
1 51 . 4 1 1 A 80 80 PHE HA H 434 4.528 4.158 0.370 1
1 54 . 4 1 1 A 80 80 PHE C C 434 172.457 175.486 -3.029 1
1 55 . 4 1 1 A 80 80 PHE CA C 434 54.828 61.007 -6.179 1
1 56 . 4 1 1 A 80 80 PHE CB C 434 36.457 38.877 -2.420 1
1 57 . 4 1 1 A 80 80 PHE N N 434 118.871 122.825 -3.954 1
1 931 . 4 1 1 A 80 80 PHE H H 434 8.191 7.965 0.226 1
1 932 . 4 1 1 A 80 80 PHE HA H 434 4.463 4.158 0.305 1
1 939 . 4 1 1 A 80 80 PHE C C 434 172.283 175.486 -3.203 1
1 940 . 4 1 1 A 80 80 PHE CA C 434 54.971 61.007 -6.036 1
1 941 . 4 1 1 A 80 80 PHE CB C 434 36.490 38.877 -2.387 1
1 944 . 4 1 1 A 80 80 PHE N N 434 119.263 122.825 -3.562 1
1 17 . 4 1 1 A 81 81 ASP H H 435 7.490 8.028 -0.538 1
1 18 . 4 1 1 A 81 81 ASP HA H 435 4.698 5.046 -0.348 1
1 19 . 4 1 1 A 81 81 ASP C C 435 171.662 175.074 -3.412 1
1 20 . 4 1 1 A 81 81 ASP CA C 435 49.570 51.831 -2.261 1
1 21 . 4 1 1 A 81 81 ASP CB C 435 40.104 41.580 -1.476 1
1 22 . 4 1 1 A 81 81 ASP N N 435 120.304 115.853 4.451 1
1 58 . 4 1 1 A 81 81 ASP H H 435 7.881 8.028 -0.147 1
1 59 . 4 1 1 A 81 81 ASP HA H 435 4.801 5.046 -0.245 1
1 60 . 4 1 1 A 81 81 ASP C C 435 171.144 175.074 -3.930 1
1 61 . 4 1 1 A 81 81 ASP CA C 435 49.406 51.831 -2.425 1
1 62 . 4 1 1 A 81 81 ASP CB C 435 38.618 41.580 -2.962 1
1 63 . 4 1 1 A 81 81 ASP N N 435 123.108 115.853 7.255 1
1 945 . 4 1 1 A 81 81 ASP H H 435 7.823 8.028 -0.205 1
1 946 . 4 1 1 A 81 81 ASP HA H 435 4.759 5.046 -0.287 1
1 949 . 4 1 1 A 81 81 ASP C C 435 171.057 175.074 -4.017 1
1 950 . 4 1 1 A 81 81 ASP CA C 435 49.174 51.831 -2.657 1
1 951 . 4 1 1 A 81 81 ASP CB C 435 38.725 41.580 -2.855 1
1 952 . 4 1 1 A 81 81 ASP N N 435 123.530 115.853 7.677 1
1 23 . 4 1 1 A 82 82 PRO HA H 436 4.758 4.454 0.304 1
1 24 . 4 1 1 A 82 82 PRO C C 436 172.944 176.291 -3.347 1
1 25 . 4 1 1 A 82 82 PRO CA C 436 60.134 64.139 -4.005 1
1 26 . 4 1 1 A 82 82 PRO CB C 436 31.425 32.117 -0.692 1
1 64 . 4 1 1 A 82 82 PRO HA H 436 4.364 4.454 -0.090 1
1 67 . 4 1 1 A 82 82 PRO C C 436 173.563 176.291 -2.728 1
1 68 . 4 1 1 A 82 82 PRO CA C 436 60.729 64.139 -3.410 1
1 69 . 4 1 1 A 82 82 PRO CB C 436 29.160 32.117 -2.957 1
1 953 . 4 1 1 A 82 82 PRO HA H 436 4.296 4.454 -0.158 1
1 960 . 4 1 1 A 82 82 PRO C C 436 173.494 176.291 -2.797 1
1 961 . 4 1 1 A 82 82 PRO CA C 436 60.625 64.139 -3.514 1
1 962 . 4 1 1 A 82 82 PRO CB C 436 29.237 32.117 -2.880 1
1 1 . 5 1 1 A 3 3 LEU HA H 357 4.257 4.280 -0.023 1
1 11 . 5 1 1 A 3 3 LEU C C 357 174.994 176.330 -1.336 1
1 12 . 5 1 1 A 3 3 LEU CA C 357 53.329 56.858 -3.529 1
1 13 . 5 1 1 A 3 3 LEU CB C 357 39.382 42.627 -3.245 1
1 17 . 5 1 1 A 4 4 GLN H H 358 8.234 7.789 0.445 1
1 18 . 5 1 1 A 4 4 GLN HA H 358 4.211 4.625 -0.414 1
1 25 . 5 1 1 A 4 4 GLN C C 358 173.357 174.344 -0.987 1
1 26 . 5 1 1 A 4 4 GLN CA C 358 53.791 54.259 -0.468 1
1 27 . 5 1 1 A 4 4 GLN CB C 358 26.456 31.924 -5.468 1
1 29 . 5 1 1 A 4 4 GLN N N 358 119.506 114.020 5.486 1
1 31 . 5 1 1 A 5 5 ASP H H 359 8.090 8.747 -0.657 1
1 32 . 5 1 1 A 5 5 ASP HA H 359 4.458 4.192 0.266 1
1 35 . 5 1 1 A 5 5 ASP C C 359 173.492 174.816 -1.324 1
1 36 . 5 1 1 A 5 5 ASP CA C 359 52.309 54.978 -2.669 1
1 37 . 5 1 1 A 5 5 ASP CB C 359 38.312 39.383 -1.071 1
1 38 . 5 1 1 A 5 5 ASP N N 359 120.683 118.089 2.594 1
1 39 . 5 1 1 A 6 6 HIS H H 360 8.103 8.513 -0.410 1
1 40 . 5 1 1 A 6 6 HIS HA H 360 4.540 4.833 -0.293 1
1 45 . 5 1 1 A 6 6 HIS C C 360 172.801 173.724 -0.923 1
1 46 . 5 1 1 A 6 6 HIS CA C 360 53.874 54.303 -0.429 1
1 47 . 5 1 1 A 6 6 HIS CB C 360 27.878 29.473 -1.595 1
1 50 . 5 1 1 A 6 6 HIS N N 360 118.844 117.999 0.845 1
1 51 . 5 1 1 A 7 7 ILE H H 361 7.862 8.050 -0.188 1
1 52 . 5 1 1 A 7 7 ILE HA H 361 4.010 4.921 -0.911 1
1 62 . 5 1 1 A 7 7 ILE C C 361 173.268 175.696 -2.428 1
1 63 . 5 1 1 A 7 7 ILE CA C 361 58.740 58.845 -0.105 1
1 64 . 5 1 1 A 7 7 ILE CB C 361 35.788 41.274 -5.486 1
1 68 . 5 1 1 A 7 7 ILE N N 361 121.598 121.148 0.450 1
1 69 . 5 1 1 A 8 8 LYS H H 362 8.231 7.993 0.238 1
1 70 . 5 1 1 A 8 8 LYS HA H 362 4.313 4.417 -0.104 1
1 79 . 5 1 1 A 8 8 LYS C C 362 173.899 176.011 -2.112 1
1 80 . 5 1 1 A 8 8 LYS CA C 362 53.677 54.827 -1.150 1
1 81 . 5 1 1 A 8 8 LYS CB C 362 30.355 33.037 -2.682 1
1 85 . 5 1 1 A 8 8 LYS N N 362 124.980 120.898 4.082 1
1 86 . 5 1 1 A 9 9 VAL H H 363 8.044 8.181 -0.137 1
1 87 . 5 1 1 A 9 9 VAL HA H 363 4.089 4.199 -0.110 1
1 95 . 5 1 1 A 9 9 VAL C C 363 173.760 176.099 -2.339 1
1 96 . 5 1 1 A 9 9 VAL CA C 363 59.814 62.226 -2.412 1
1 97 . 5 1 1 A 9 9 VAL CB C 363 30.058 32.608 -2.550 1
1 100 . 5 1 1 A 9 9 VAL N N 363 121.366 116.900 4.466 1
1 101 . 5 1 1 A 10 10 THR H H 364 8.076 8.548 -0.472 1
1 102 . 5 1 1 A 10 10 THR HA H 364 4.302 4.087 0.215 1
1 107 . 5 1 1 A 10 10 THR C C 364 172.135 176.118 -3.983 1
1 108 . 5 1 1 A 10 10 THR CA C 364 59.134 65.483 -6.349 1
1 109 . 5 1 1 A 10 10 THR CB C 364 67.415 69.182 -1.767 1
1 111 . 5 1 1 A 10 10 THR N N 364 116.817 118.738 -1.921 1
1 112 . 5 1 1 A 11 11 GLN H H 365 8.463 8.197 0.266 1
1 113 . 5 1 1 A 11 11 GLN HA H 365 4.046 4.065 -0.019 1
1 120 . 5 1 1 A 11 11 GLN C C 365 173.944 176.377 -2.433 1
1 121 . 5 1 1 A 11 11 GLN CA C 365 54.517 57.552 -3.035 1
1 122 . 5 1 1 A 11 11 GLN CB C 365 26.250 28.095 -1.845 1
1 124 . 5 1 1 A 11 11 GLN N N 365 122.059 118.881 3.178 1
1 126 . 5 1 1 A 12 12 GLU H H 366 8.449 7.926 0.523 1
1 127 . 5 1 1 A 12 12 GLU HA H 366 4.093 4.550 -0.457 1
1 132 . 5 1 1 A 12 12 GLU C C 366 174.746 176.974 -2.228 1
1 133 . 5 1 1 A 12 12 GLU CA C 366 55.235 56.339 -1.104 1
1 134 . 5 1 1 A 12 12 GLU CB C 366 27.180 30.166 -2.986 1
1 136 . 5 1 1 A 12 12 GLU N N 366 120.415 118.257 2.158 1
1 137 . 5 1 1 A 13 13 GLN H H 367 8.031 8.240 -0.209 1
1 138 . 5 1 1 A 13 13 GLN HA H 367 4.113 4.024 0.089 1
1 145 . 5 1 1 A 13 13 GLN C C 367 173.693 175.538 -1.845 1
1 146 . 5 1 1 A 13 13 GLN CA C 367 54.132 56.296 -2.164 1
1 147 . 5 1 1 A 13 13 GLN CB C 367 26.420 27.141 -0.721 1
1 149 . 5 1 1 A 13 13 GLN N N 367 119.721 118.919 0.802 1
1 151 . 5 1 1 A 14 14 TYR H H 368 8.111 8.085 0.026 1
1 152 . 5 1 1 A 14 14 TYR HA H 368 4.339 4.750 -0.411 1
1 159 . 5 1 1 A 14 14 TYR C C 368 173.916 176.679 -2.763 1
1 160 . 5 1 1 A 14 14 TYR CA C 368 56.572 58.158 -1.586 1
1 161 . 5 1 1 A 14 14 TYR CB C 368 35.879 38.185 -2.306 1
1 164 . 5 1 1 A 14 14 TYR N N 368 120.541 120.235 0.306 1
1 165 . 5 1 1 A 15 15 GLU H H 369 8.287 8.518 -0.231 1
1 166 . 5 1 1 A 15 15 GLU HA H 369 4.009 4.324 -0.315 1
1 171 . 5 1 1 A 15 15 GLU C C 369 174.448 177.074 -2.626 1
1 172 . 5 1 1 A 15 15 GLU CA C 369 55.047 59.058 -4.011 1
1 173 . 5 1 1 A 15 15 GLU CB C 369 27.226 28.839 -1.613 1
1 175 . 5 1 1 A 15 15 GLU N N 369 120.398 120.064 0.334 1
1 176 . 5 1 1 A 16 16 LEU H H 370 7.785 8.064 -0.279 1
1 177 . 5 1 1 A 16 16 LEU HA H 370 4.138 4.166 -0.028 1
1 187 . 5 1 1 A 16 16 LEU C C 370 175.089 177.499 -2.410 1
1 188 . 5 1 1 A 16 16 LEU CA C 370 53.425 54.915 -1.490 1
1 189 . 5 1 1 A 16 16 LEU CB C 370 39.554 41.208 -1.654 1
1 193 . 5 1 1 A 16 16 LEU N N 370 121.323 117.669 3.654 1
1 194 . 5 1 1 A 17 17 TYR H H 371 8.038 8.198 -0.160 1
1 195 . 5 1 1 A 17 17 TYR HA H 371 4.380 4.386 -0.006 1
1 202 . 5 1 1 A 17 17 TYR C C 371 173.931 175.715 -1.784 1
1 203 . 5 1 1 A 17 17 TYR CA C 371 56.143 59.311 -3.168 1
1 204 . 5 1 1 A 17 17 TYR CB C 371 35.501 37.513 -2.012 1
1 207 . 5 1 1 A 17 17 TYR N N 371 119.465 119.645 -0.180 1
1 208 . 5 1 1 A 18 18 CYS H H 372 8.021 6.977 1.044 1
1 209 . 5 1 1 A 18 18 CYS HA H 372 4.236 4.450 -0.214 1
1 212 . 5 1 1 A 18 18 CYS C C 372 172.457 173.349 -0.892 1
1 213 . 5 1 1 A 18 18 CYS CA C 372 56.997 56.987 0.010 1
1 214 . 5 1 1 A 18 18 CYS CB C 372 25.080 28.627 -3.547 1
1 215 . 5 1 1 A 18 18 CYS N N 372 119.913 119.774 0.139 1
1 216 . 5 1 1 A 19 19 GLU H H 373 8.151 8.903 -0.752 1
1 217 . 5 1 1 A 19 19 GLU HA H 373 4.130 4.718 -0.588 1
1 222 . 5 1 1 A 19 19 GLU C C 373 174.151 175.172 -1.021 1
1 223 . 5 1 1 A 19 19 GLU CA C 373 54.535 55.313 -0.778 1
1 224 . 5 1 1 A 19 19 GLU CB C 373 27.244 30.236 -2.992 1
1 226 . 5 1 1 A 19 19 GLU N N 373 122.431 126.403 -3.972 1
1 227 . 5 1 1 A 20 20 MET H H 374 8.109 8.158 -0.049 1
1 228 . 5 1 1 A 20 20 MET HA H 374 4.352 4.732 -0.380 1
1 236 . 5 1 1 A 20 20 MET C C 374 174.200 175.272 -1.072 1
1 237 . 5 1 1 A 20 20 MET CA C 374 53.238 55.390 -2.152 1
1 238 . 5 1 1 A 20 20 MET CB C 374 30.237 34.050 -3.813 1
1 241 . 5 1 1 A 20 20 MET N N 374 119.754 123.243 -3.489 1
1 242 . 5 1 1 A 21 21 GLY H H 375 8.231 9.014 -0.783 1
1 243 . 5 1 1 A 21 21 GLY HA2 H 375 3.861 3.887 -0.026 1
1 244 . 5 1 1 A 21 21 GLY HA3 H 375 3.960 3.895 0.065 1
1 245 . 5 1 1 A 21 21 GLY C C 375 171.928 173.548 -1.620 1
1 246 . 5 1 1 A 21 21 GLY CA C 375 42.930 47.227 -4.297 1
1 247 . 5 1 1 A 21 21 GLY N N 375 109.484 114.954 -5.470 1
1 248 . 5 1 1 A 22 22 SER HA H 376 4.492 5.163 -0.671 1
1 251 . 5 1 1 A 22 22 SER C C 376 172.206 173.398 -1.192 1
1 252 . 5 1 1 A 22 22 SER CA C 376 55.570 57.492 -1.922 1
1 253 . 5 1 1 A 22 22 SER CB C 376 61.525 65.369 -3.844 1
1 254 . 5 1 1 A 23 23 THR H H 377 8.470 9.281 -0.811 1
1 255 . 5 1 1 A 23 23 THR HA H 377 4.295 4.327 -0.032 1
1 260 . 5 1 1 A 23 23 THR C C 377 171.811 174.819 -3.008 1
1 261 . 5 1 1 A 23 23 THR CA C 377 58.937 62.802 -3.865 1
1 262 . 5 1 1 A 23 23 THR CB C 377 67.250 67.940 -0.690 1
1 264 . 5 1 1 A 23 23 THR N N 377 124.043 122.403 1.640 1
1 265 . 5 1 1 A 24 24 PHE H H 378 8.374 8.458 -0.084 1
1 266 . 5 1 1 A 24 24 PHE HA H 378 4.239 4.506 -0.267 1
1 273 . 5 1 1 A 24 24 PHE C C 378 173.411 177.266 -3.855 1
1 274 . 5 1 1 A 24 24 PHE CA C 378 56.697 58.254 -1.557 1
1 275 . 5 1 1 A 24 24 PHE CB C 378 36.538 38.402 -1.864 1
1 278 . 5 1 1 A 24 24 PHE N N 378 124.732 122.943 1.789 1
1 279 . 5 1 1 A 25 25 GLN H H 379 8.457 7.960 0.497 1
1 280 . 5 1 1 A 25 25 GLN HA H 379 4.038 3.594 0.444 1
1 287 . 5 1 1 A 25 25 GLN C C 379 172.431 176.328 -3.897 1
1 288 . 5 1 1 A 25 25 GLN CA C 379 54.078 57.997 -3.919 1
1 289 . 5 1 1 A 25 25 GLN CB C 379 26.414 28.455 -2.041 1
1 291 . 5 1 1 A 25 25 GLN N N 379 118.820 119.218 -0.398 1
1 293 . 5 1 1 A 26 26 LEU H H 380 6.985 7.379 -0.394 1
1 294 . 5 1 1 A 26 26 LEU HA H 380 4.229 4.234 -0.005 1
1 304 . 5 1 1 A 26 26 LEU C C 380 173.895 176.560 -2.665 1
1 305 . 5 1 1 A 26 26 LEU CA C 380 52.123 54.529 -2.406 1
1 306 . 5 1 1 A 26 26 LEU CB C 380 40.543 42.757 -2.214 1
1 310 . 5 1 1 A 26 26 LEU N N 380 119.079 121.725 -2.646 1
1 311 . 5 1 1 A 27 27 CYS H H 381 8.905 9.327 -0.422 1
1 312 . 5 1 1 A 27 27 CYS HA H 381 4.013 4.629 -0.616 1
1 315 . 5 1 1 A 27 27 CYS C C 381 174.439 176.320 -1.881 1
1 316 . 5 1 1 A 27 27 CYS CA C 381 57.847 59.422 -1.575 1
1 317 . 5 1 1 A 27 27 CYS CB C 381 28.648 28.643 0.005 1
1 318 . 5 1 1 A 27 27 CYS N N 381 125.151 123.433 1.718 1
1 319 . 5 1 1 A 28 28 LYS H H 382 9.351 8.999 0.352 1
1 320 . 5 1 1 A 28 28 LYS HA H 382 4.157 4.257 -0.100 1
1 329 . 5 1 1 A 28 28 LYS C C 382 174.678 178.532 -3.854 1
1 330 . 5 1 1 A 28 28 LYS CA C 382 54.324 58.366 -4.042 1
1 331 . 5 1 1 A 28 28 LYS CB C 382 30.086 32.287 -2.201 1
1 335 . 5 1 1 A 28 28 LYS N N 382 128.840 127.861 0.979 1
1 336 . 5 1 1 A 29 29 ILE H H 383 9.040 7.829 1.211 1
1 337 . 5 1 1 A 29 29 ILE HA H 383 3.804 3.865 -0.061 1
1 347 . 5 1 1 A 29 29 ILE C C 383 174.239 177.665 -3.426 1
1 348 . 5 1 1 A 29 29 ILE CA C 383 62.114 64.025 -1.911 1
1 349 . 5 1 1 A 29 29 ILE CB C 383 33.870 38.503 -4.633 1
1 353 . 5 1 1 A 29 29 ILE N N 383 122.718 118.762 3.956 1
1 354 . 5 1 1 A 30 30 CYS H H 384 7.572 7.496 0.076 1
1 355 . 5 1 1 A 30 30 CYS HA H 384 4.548 4.482 0.066 1
1 358 . 5 1 1 A 30 30 CYS C C 384 172.978 175.984 -3.006 1
1 359 . 5 1 1 A 30 30 CYS CA C 384 54.957 58.598 -3.641 1
1 360 . 5 1 1 A 30 30 CYS CB C 384 29.778 29.812 -0.034 1
1 361 . 5 1 1 A 30 30 CYS N N 384 116.356 115.894 0.462 1
1 362 . 5 1 1 A 31 31 ALA H H 385 8.205 8.578 -0.373 1
1 363 . 5 1 1 A 31 31 ALA HA H 385 4.107 4.004 0.103 1
1 367 . 5 1 1 A 31 31 ALA C C 385 173.139 177.136 -3.997 1
1 368 . 5 1 1 A 31 31 ALA CA C 385 50.802 55.045 -4.243 1
1 369 . 5 1 1 A 31 31 ALA CB C 385 14.634 16.851 -2.217 1
1 370 . 5 1 1 A 31 31 ALA N N 385 125.526 120.960 4.566 1
1 371 . 5 1 1 A 32 32 GLU H H 386 8.416 8.489 -0.073 1
1 372 . 5 1 1 A 32 32 GLU HA H 386 4.467 4.270 0.197 1
1 377 . 5 1 1 A 32 32 GLU C C 386 172.325 177.428 -5.103 1
1 378 . 5 1 1 A 32 32 GLU CA C 386 55.146 58.789 -3.643 1
1 379 . 5 1 1 A 32 32 GLU CB C 386 31.181 29.799 1.382 1
1 381 . 5 1 1 A 32 32 GLU N N 386 117.579 115.701 1.878 1
1 382 . 5 1 1 A 33 33 ASN H H 387 7.872 7.971 -0.099 1
1 383 . 5 1 1 A 33 33 ASN HA H 387 4.900 4.971 -0.071 1
1 388 . 5 1 1 A 33 33 ASN C C 387 171.355 174.806 -3.451 1
1 389 . 5 1 1 A 33 33 ASN CA C 387 49.320 52.153 -2.833 1
1 390 . 5 1 1 A 33 33 ASN CB C 387 38.457 39.734 -1.277 1
1 391 . 5 1 1 A 33 33 ASN N N 387 120.399 117.089 3.310 1
1 393 . 5 1 1 A 34 34 ASP H H 388 8.565 8.674 -0.109 1
1 394 . 5 1 1 A 34 34 ASP HA H 388 4.679 4.860 -0.181 1
1 397 . 5 1 1 A 34 34 ASP C C 388 174.243 176.311 -2.068 1
1 398 . 5 1 1 A 34 34 ASP CA C 388 51.809 53.386 -1.577 1
1 399 . 5 1 1 A 34 34 ASP CB C 388 38.007 42.569 -4.562 1
1 400 . 5 1 1 A 34 34 ASP N N 388 120.661 120.285 0.376 1
1 401 . 5 1 1 A 35 35 LYS H H 389 8.544 9.214 -0.670 1
1 402 . 5 1 1 A 35 35 LYS HA H 389 3.411 4.373 -0.962 1
1 409 . 5 1 1 A 35 35 LYS C C 389 172.938 176.531 -3.593 1
1 410 . 5 1 1 A 35 35 LYS CA C 389 54.973 55.749 -0.776 1
1 411 . 5 1 1 A 35 35 LYS CB C 389 30.617 31.782 -1.165 1
1 415 . 5 1 1 A 35 35 LYS N N 389 119.199 120.772 -1.573 1
1 416 . 5 1 1 A 36 36 ASP H H 390 8.327 8.841 -0.514 1
1 417 . 5 1 1 A 36 36 ASP HA H 390 4.724 4.653 0.071 1
1 420 . 5 1 1 A 36 36 ASP C C 390 172.860 175.608 -2.748 1
1 421 . 5 1 1 A 36 36 ASP CA C 390 51.609 55.485 -3.876 1
1 422 . 5 1 1 A 36 36 ASP CB C 390 39.018 42.681 -3.663 1
1 423 . 5 1 1 A 36 36 ASP N N 390 119.134 126.706 -7.572 1
1 424 . 5 1 1 A 37 37 VAL H H 391 8.544 8.107 0.437 1
1 425 . 5 1 1 A 37 37 VAL HA H 391 4.877 4.826 0.051 1
1 433 . 5 1 1 A 37 37 VAL C C 391 167.519 172.993 -5.474 1
1 434 . 5 1 1 A 37 37 VAL CA C 391 58.259 59.800 -1.541 1
1 435 . 5 1 1 A 37 37 VAL CB C 391 32.277 35.673 -3.396 1
1 438 . 5 1 1 A 37 37 VAL N N 391 121.970 116.981 4.989 1
1 439 . 5 1 1 A 38 38 LYS H H 392 8.621 9.745 -1.124 1
1 440 . 5 1 1 A 38 38 LYS HA H 392 4.991 5.395 -0.404 1
1 449 . 5 1 1 A 38 38 LYS C C 392 172.681 175.294 -2.613 1
1 450 . 5 1 1 A 38 38 LYS CA C 392 51.123 54.649 -3.526 1
1 451 . 5 1 1 A 38 38 LYS CB C 392 33.697 34.699 -1.002 1
1 455 . 5 1 1 A 38 38 LYS N N 392 126.381 127.708 -1.327 1
1 456 . 5 1 1 A 39 39 ILE H H 393 8.723 9.101 -0.378 1
1 457 . 5 1 1 A 39 39 ILE HA H 393 4.239 4.361 -0.122 1
1 467 . 5 1 1 A 39 39 ILE C C 393 172.642 175.716 -3.074 1
1 468 . 5 1 1 A 39 39 ILE CA C 393 57.768 61.072 -3.304 1
1 469 . 5 1 1 A 39 39 ILE CB C 393 35.691 37.507 -1.816 1
1 473 . 5 1 1 A 39 39 ILE N N 393 126.398 127.740 -1.342 1
1 474 . 5 1 1 A 40 40 GLU H H 394 8.506 9.215 -0.709 1
1 475 . 5 1 1 A 40 40 GLU HA H 394 4.753 4.738 0.015 1
1 480 . 5 1 1 A 40 40 GLU C C 394 173.596 176.152 -2.556 1
1 481 . 5 1 1 A 40 40 GLU CA C 394 49.793 53.096 -3.303 1
1 482 . 5 1 1 A 40 40 GLU CB C 394 28.210 30.899 -2.689 1
1 484 . 5 1 1 A 40 40 GLU N N 394 124.864 127.991 -3.127 1
1 485 . 5 1 1 A 41 41 PRO HA H 395 4.864 4.502 0.362 1
1 492 . 5 1 1 A 41 41 PRO C C 395 175.073 177.097 -2.024 1
1 493 . 5 1 1 A 41 41 PRO CA C 395 61.111 63.875 -2.764 1
1 494 . 5 1 1 A 41 41 PRO CB C 395 32.275 32.967 -0.692 1
1 497 . 5 1 1 A 42 42 CYS H H 396 7.828 7.805 0.023 1
1 498 . 5 1 1 A 42 42 CYS HA H 396 4.208 4.172 0.036 1
1 501 . 5 1 1 A 42 42 CYS C C 396 173.877 174.988 -1.111 1
1 502 . 5 1 1 A 42 42 CYS CA C 396 58.021 60.597 -2.576 1
1 503 . 5 1 1 A 42 42 CYS CB C 396 28.242 27.839 0.403 1
1 504 . 5 1 1 A 42 42 CYS N N 396 122.434 117.939 4.495 1
1 505 . 5 1 1 A 43 43 GLY H H 397 8.679 8.860 -0.181 1
1 506 . 5 1 1 A 43 43 GLY HA2 H 397 3.507 3.982 -0.475 1
1 507 . 5 1 1 A 43 43 GLY HA3 H 397 3.914 3.992 -0.078 1
1 508 . 5 1 1 A 43 43 GLY C C 397 171.981 174.752 -2.771 1
1 509 . 5 1 1 A 43 43 GLY CA C 397 43.347 46.409 -3.062 1
1 510 . 5 1 1 A 43 43 GLY N N 397 112.123 109.050 3.073 1
1 511 . 5 1 1 A 44 44 HIS H H 398 8.329 7.377 0.952 1
1 512 . 5 1 1 A 44 44 HIS HA H 398 4.339 4.669 -0.330 1
1 517 . 5 1 1 A 44 44 HIS C C 398 170.742 174.573 -3.831 1
1 518 . 5 1 1 A 44 44 HIS CA C 398 58.368 55.508 2.860 1
1 519 . 5 1 1 A 44 44 HIS CB C 398 28.434 31.810 -3.376 1
1 522 . 5 1 1 A 44 44 HIS N N 398 121.393 116.996 4.397 1
1 523 . 5 1 1 A 45 45 LEU H H 399 8.241 8.815 -0.574 1
1 524 . 5 1 1 A 45 45 LEU HA H 399 5.570 5.164 0.406 1
1 534 . 5 1 1 A 45 45 LEU C C 399 174.464 175.320 -0.856 1
1 535 . 5 1 1 A 45 45 LEU CA C 399 50.729 53.688 -2.959 1
1 536 . 5 1 1 A 45 45 LEU CB C 399 43.574 43.233 0.341 1
1 540 . 5 1 1 A 45 45 LEU N N 399 118.469 123.443 -4.974 1
1 541 . 5 1 1 A 46 46 MET H H 400 8.707 8.888 -0.181 1
1 542 . 5 1 1 A 46 46 MET HA H 400 4.842 5.038 -0.196 1
1 550 . 5 1 1 A 46 46 MET C C 400 170.736 174.211 -3.475 1
1 551 . 5 1 1 A 46 46 MET CA C 400 52.804 54.055 -1.251 1
1 552 . 5 1 1 A 46 46 MET CB C 400 31.945 35.314 -3.369 1
1 555 . 5 1 1 A 46 46 MET N N 400 114.897 120.646 -5.749 1
1 556 . 5 1 1 A 47 47 CYS H H 401 9.436 8.227 1.209 1
1 557 . 5 1 1 A 47 47 CYS HA H 401 5.629 5.062 0.567 1
1 560 . 5 1 1 A 47 47 CYS C C 401 173.909 176.104 -2.195 1
1 561 . 5 1 1 A 47 47 CYS CA C 401 54.325 56.766 -2.441 1
1 562 . 5 1 1 A 47 47 CYS CB C 401 30.725 30.193 0.532 1
1 563 . 5 1 1 A 47 47 CYS N N 401 119.575 118.932 0.643 1
1 564 . 5 1 1 A 48 48 THR H H 402 9.842 9.027 0.815 1
1 565 . 5 1 1 A 48 48 THR HA H 402 3.768 3.984 -0.216 1
1 570 . 5 1 1 A 48 48 THR C C 402 174.333 176.163 -1.830 1
1 571 . 5 1 1 A 48 48 THR CA C 402 64.516 65.997 -1.481 1
1 572 . 5 1 1 A 48 48 THR CB C 402 66.288 68.629 -2.341 1
1 574 . 5 1 1 A 48 48 THR N N 402 119.945 119.138 0.807 1
1 575 . 5 1 1 A 49 49 SER H H 403 8.355 8.254 0.101 1
1 576 . 5 1 1 A 49 49 SER HA H 403 4.222 4.048 0.174 1
1 579 . 5 1 1 A 49 49 SER C C 403 175.059 177.208 -2.149 1
1 580 . 5 1 1 A 49 49 SER CA C 403 59.828 61.706 -1.878 1
1 581 . 5 1 1 A 49 49 SER CB C 403 59.717 63.002 -3.285 1
1 582 . 5 1 1 A 49 49 SER N N 403 120.468 115.608 4.860 1
1 583 . 5 1 1 A 50 50 CYS H H 404 9.464 7.812 1.652 1
1 584 . 5 1 1 A 50 50 CYS HA H 404 3.922 4.155 -0.233 1
1 587 . 5 1 1 A 50 50 CYS C C 404 176.081 177.229 -1.148 1
1 588 . 5 1 1 A 50 50 CYS CA C 404 63.076 64.037 -0.961 1
1 589 . 5 1 1 A 50 50 CYS CB C 404 26.078 27.627 -1.549 1
1 590 . 5 1 1 A 50 50 CYS N N 404 126.744 119.202 7.542 1
1 591 . 5 1 1 A 51 51 LEU H H 405 7.948 8.321 -0.373 1
1 592 . 5 1 1 A 51 51 LEU HA H 405 4.064 4.246 -0.182 1
1 602 . 5 1 1 A 51 51 LEU C C 405 175.495 178.833 -3.338 1
1 603 . 5 1 1 A 51 51 LEU CA C 405 55.914 57.865 -1.951 1
1 604 . 5 1 1 A 51 51 LEU CB C 405 38.662 41.710 -3.048 1
1 607 . 5 1 1 A 51 51 LEU N N 405 121.951 122.645 -0.694 1
1 608 . 5 1 1 A 52 52 THR H H 406 8.786 8.438 0.348 1
1 609 . 5 1 1 A 52 52 THR HA H 406 4.024 4.003 0.021 1
1 614 . 5 1 1 A 52 52 THR C C 406 174.139 175.985 -1.846 1
1 615 . 5 1 1 A 52 52 THR CA C 406 64.017 65.965 -1.948 1
1 616 . 5 1 1 A 52 52 THR CB C 406 66.115 68.728 -2.613 1
1 618 . 5 1 1 A 52 52 THR N N 406 115.258 115.605 -0.347 1
1 619 . 5 1 1 A 53 53 SER H H 407 8.115 7.934 0.181 1
1 620 . 5 1 1 A 53 53 SER HA H 407 4.204 4.073 0.131 1
1 623 . 5 1 1 A 53 53 SER C C 407 174.456 175.990 -1.534 1
1 624 . 5 1 1 A 53 53 SER CA C 407 59.090 62.849 -3.759 1
1 625 . 5 1 1 A 53 53 SER CB C 407 60.146 63.581 -3.435 1
1 626 . 5 1 1 A 53 53 SER N N 407 116.852 116.797 0.055 1
1 627 . 5 1 1 A 54 54 TRP H H 408 8.123 8.470 -0.347 1
1 628 . 5 1 1 A 54 54 TRP HA H 408 4.371 4.269 0.102 1
1 637 . 5 1 1 A 54 54 TRP C C 408 175.981 178.938 -2.957 1
1 638 . 5 1 1 A 54 54 TRP CA C 408 57.323 60.892 -3.569 1
1 639 . 5 1 1 A 54 54 TRP CB C 408 26.812 29.720 -2.908 1
1 645 . 5 1 1 A 54 54 TRP N N 408 123.556 123.637 -0.081 1
1 647 . 5 1 1 A 55 55 GLN H H 409 8.502 7.953 0.549 1
1 648 . 5 1 1 A 55 55 GLN HA H 409 3.999 3.760 0.239 1
1 655 . 5 1 1 A 55 55 GLN C C 409 177.300 178.244 -0.944 1
1 656 . 5 1 1 A 55 55 GLN CA C 409 56.484 58.912 -2.428 1
1 657 . 5 1 1 A 55 55 GLN CB C 409 26.190 27.938 -1.748 1
1 659 . 5 1 1 A 55 55 GLN N N 409 118.044 118.062 -0.018 1
1 661 . 5 1 1 A 56 56 GLU H H 410 8.467 8.227 0.240 1
1 662 . 5 1 1 A 56 56 GLU HA H 410 4.057 4.110 -0.053 1
1 667 . 5 1 1 A 56 56 GLU C C 410 174.787 176.917 -2.130 1
1 668 . 5 1 1 A 56 56 GLU CA C 410 55.909 58.245 -2.336 1
1 669 . 5 1 1 A 56 56 GLU CB C 410 26.895 29.274 -2.379 1
1 671 . 5 1 1 A 56 56 GLU N N 410 119.448 119.556 -0.108 1
1 672 . 5 1 1 A 57 57 SER H H 411 7.438 7.622 -0.184 1
1 673 . 5 1 1 A 57 57 SER HA H 411 4.607 4.584 0.023 1
1 676 . 5 1 1 A 57 57 SER C C 411 170.849 173.883 -3.034 1
1 677 . 5 1 1 A 57 57 SER CA C 411 55.540 57.376 -1.836 1
1 678 . 5 1 1 A 57 57 SER CB C 411 60.928 63.106 -2.178 1
1 679 . 5 1 1 A 57 57 SER N N 411 113.752 113.385 0.367 1
1 680 . 5 1 1 A 58 58 GLU H H 412 7.855 7.815 0.040 1
1 681 . 5 1 1 A 58 58 GLU HA H 412 3.772 3.913 -0.141 1
1 686 . 5 1 1 A 58 58 GLU C C 412 173.743 175.528 -1.785 1
1 687 . 5 1 1 A 58 58 GLU CA C 412 54.442 56.758 -2.316 1
1 688 . 5 1 1 A 58 58 GLU CB C 412 24.603 28.075 -3.472 1
1 690 . 5 1 1 A 58 58 GLU N N 412 115.908 118.078 -2.170 1
1 691 . 5 1 1 A 59 59 GLY H H 413 7.588 8.137 -0.549 1
1 692 . 5 1 1 A 59 59 GLY HA2 H 413 1.643 2.715 -1.072 1
1 693 . 5 1 1 A 59 59 GLY HA3 H 413 2.949 3.552 -0.603 1
1 694 . 5 1 1 A 59 59 GLY C C 413 170.850 172.980 -2.130 1
1 695 . 5 1 1 A 59 59 GLY CA C 413 41.724 46.292 -4.568 1
1 696 . 5 1 1 A 59 59 GLY N N 413 108.032 111.025 -2.993 1
1 697 . 5 1 1 A 60 60 GLN H H 414 7.973 8.059 -0.086 1
1 698 . 5 1 1 A 60 60 GLN HA H 414 4.366 4.589 -0.223 1
1 705 . 5 1 1 A 60 60 GLN C C 414 173.108 175.725 -2.617 1
1 706 . 5 1 1 A 60 60 GLN CA C 414 52.422 55.161 -2.739 1
1 707 . 5 1 1 A 60 60 GLN CB C 414 27.049 28.898 -1.849 1
1 709 . 5 1 1 A 60 60 GLN N N 414 122.690 124.829 -2.139 1
1 711 . 5 1 1 A 61 61 GLY H H 415 8.301 8.122 0.179 1
1 712 . 5 1 1 A 61 61 GLY HA2 H 415 3.700 4.225 -0.525 1
1 713 . 5 1 1 A 61 61 GLY HA3 H 415 3.920 4.258 -0.338 1
1 714 . 5 1 1 A 61 61 GLY C C 415 170.249 174.313 -4.064 1
1 715 . 5 1 1 A 61 61 GLY CA C 415 42.210 44.608 -2.398 1
1 716 . 5 1 1 A 61 61 GLY N N 415 110.794 114.095 -3.301 1
1 717 . 5 1 1 A 62 62 CYS H H 416 8.549 8.623 -0.074 1
1 718 . 5 1 1 A 62 62 CYS HA H 416 4.227 4.675 -0.448 1
1 721 . 5 1 1 A 62 62 CYS C C 416 172.914 175.316 -2.402 1
1 722 . 5 1 1 A 62 62 CYS CA C 416 54.008 58.771 -4.763 1
1 723 . 5 1 1 A 62 62 CYS CB C 416 29.716 27.564 2.152 1
1 724 . 5 1 1 A 62 62 CYS N N 416 123.683 120.883 2.800 1
1 725 . 5 1 1 A 63 63 PRO HA H 417 2.611 3.224 -0.613 1
1 732 . 5 1 1 A 63 63 PRO C C 417 174.143 177.561 -3.418 1
1 733 . 5 1 1 A 63 63 PRO CA C 417 61.689 63.656 -1.967 1
1 734 . 5 1 1 A 63 63 PRO CB C 417 28.534 31.130 -2.596 1
1 737 . 5 1 1 A 64 64 PHE H H 418 8.968 7.921 1.047 1
1 738 . 5 1 1 A 64 64 PHE HA H 418 4.250 4.286 -0.036 1
1 746 . 5 1 1 A 64 64 PHE C C 418 174.243 178.386 -4.143 1
1 747 . 5 1 1 A 64 64 PHE CA C 418 56.720 60.346 -3.626 1
1 748 . 5 1 1 A 64 64 PHE CB C 418 36.458 39.606 -3.148 1
1 752 . 5 1 1 A 64 64 PHE N N 418 117.008 115.350 1.658 1
1 753 . 5 1 1 A 65 65 CYS H H 419 7.968 8.137 -0.169 1
1 754 . 5 1 1 A 65 65 CYS HA H 419 4.906 4.476 0.430 1
1 757 . 5 1 1 A 65 65 CYS C C 419 173.198 175.029 -1.831 1
1 758 . 5 1 1 A 65 65 CYS CA C 419 55.870 60.397 -4.527 1
1 759 . 5 1 1 A 65 65 CYS CB C 419 30.559 28.865 1.694 1
1 760 . 5 1 1 A 65 65 CYS N N 419 117.505 117.550 -0.045 1
1 761 . 5 1 1 A 66 66 ARG H H 420 8.761 7.911 0.850 1
1 762 . 5 1 1 A 66 66 ARG HA H 420 4.365 4.376 -0.011 1
1 769 . 5 1 1 A 66 66 ARG C C 420 172.921 174.664 -1.743 1
1 770 . 5 1 1 A 66 66 ARG CA C 420 54.763 57.328 -2.565 1
1 771 . 5 1 1 A 66 66 ARG CB C 420 24.286 27.033 -2.747 1
1 774 . 5 1 1 A 66 66 ARG N N 420 118.763 115.822 2.941 1
1 775 . 5 1 1 A 67 67 CYS H H 421 8.223 7.515 0.708 1
1 776 . 5 1 1 A 67 67 CYS HA H 421 4.419 4.560 -0.141 1
1 779 . 5 1 1 A 67 67 CYS C C 421 171.160 174.453 -3.293 1
1 780 . 5 1 1 A 67 67 CYS CA C 421 57.119 58.465 -1.346 1
1 781 . 5 1 1 A 67 67 CYS CB C 421 25.911 29.363 -3.452 1
1 782 . 5 1 1 A 67 67 CYS N N 421 120.627 117.198 3.429 1
1 783 . 5 1 1 A 68 68 GLU H H 422 8.416 8.566 -0.150 1
1 784 . 5 1 1 A 68 68 GLU HA H 422 4.025 4.164 -0.139 1
1 789 . 5 1 1 A 68 68 GLU C C 422 173.764 176.233 -2.469 1
1 790 . 5 1 1 A 68 68 GLU CA C 422 54.752 57.687 -2.935 1
1 791 . 5 1 1 A 68 68 GLU CB C 422 27.302 29.791 -2.489 1
1 793 . 5 1 1 A 68 68 GLU N N 422 122.370 122.229 0.141 1
1 794 . 5 1 1 A 69 69 ILE H H 423 8.648 8.847 -0.199 1
1 795 . 5 1 1 A 69 69 ILE HA H 423 4.012 4.501 -0.489 1
1 805 . 5 1 1 A 69 69 ILE C C 423 174.257 175.675 -1.418 1
1 806 . 5 1 1 A 69 69 ILE CA C 423 59.740 60.605 -0.865 1
1 807 . 5 1 1 A 69 69 ILE CB C 423 35.846 38.668 -2.822 1
1 811 . 5 1 1 A 69 69 ILE N N 423 125.988 125.335 0.653 1
1 812 . 5 1 1 A 70 70 LYS H H 424 9.185 9.527 -0.342 1
1 813 . 5 1 1 A 70 70 LYS HA H 424 4.434 4.390 0.044 1
1 822 . 5 1 1 A 70 70 LYS C C 424 173.880 176.545 -2.665 1
1 823 . 5 1 1 A 70 70 LYS CA C 424 53.378 57.200 -3.822 1
1 824 . 5 1 1 A 70 70 LYS CB C 424 30.397 33.978 -3.581 1
1 828 . 5 1 1 A 70 70 LYS N N 424 128.977 129.682 -0.705 1
1 829 . 5 1 1 A 71 71 GLY H H 425 7.810 7.615 0.195 1
1 830 . 5 1 1 A 71 71 GLY HA2 H 425 4.094 4.043 0.051 1
1 831 . 5 1 1 A 71 71 GLY HA3 H 425 4.159 4.045 0.114 1
1 832 . 5 1 1 A 71 71 GLY C C 425 168.179 172.182 -4.003 1
1 833 . 5 1 1 A 71 71 GLY CA C 425 42.326 45.223 -2.897 1
1 834 . 5 1 1 A 71 71 GLY N N 425 107.696 106.369 1.327 1
1 835 . 5 1 1 A 72 72 THR H H 426 8.048 8.682 -0.634 1
1 836 . 5 1 1 A 72 72 THR HA H 426 5.258 5.341 -0.083 1
1 841 . 5 1 1 A 72 72 THR C C 426 170.979 172.401 -1.422 1
1 842 . 5 1 1 A 72 72 THR CA C 426 56.755 59.733 -2.978 1
1 843 . 5 1 1 A 72 72 THR CB C 426 69.226 71.623 -2.397 1
1 845 . 5 1 1 A 72 72 THR N N 426 109.122 110.730 -1.608 1
1 846 . 5 1 1 A 73 73 GLU H H 427 8.912 9.543 -0.631 1
1 847 . 5 1 1 A 73 73 GLU HA H 427 4.954 4.898 0.056 1
1 852 . 5 1 1 A 73 73 GLU C C 427 170.353 174.658 -4.305 1
1 853 . 5 1 1 A 73 73 GLU CA C 427 50.182 52.942 -2.760 1
1 854 . 5 1 1 A 73 73 GLU CB C 427 30.559 33.062 -2.503 1
1 856 . 5 1 1 A 73 73 GLU N N 427 121.703 123.771 -2.068 1
1 1 . 5 1 1 A 74 74 PRO HA H 428 4.372 4.697 -0.325 1
1 2 . 5 1 1 A 74 74 PRO C C 428 173.839 176.679 -2.840 1
1 3 . 5 1 1 A 74 74 PRO CA C 428 60.241 62.675 -2.434 1
1 4 . 5 1 1 A 74 74 PRO CB C 428 29.299 32.418 -3.119 1
1 857 . 5 1 1 A 74 74 PRO HA H 428 4.782 4.697 0.085 1
1 864 . 5 1 1 A 74 74 PRO C C 428 174.027 176.679 -2.652 1
1 865 . 5 1 1 A 74 74 PRO CA C 428 59.771 62.675 -2.904 1
1 866 . 5 1 1 A 74 74 PRO CB C 428 29.633 32.418 -2.785 1
1 7 . 5 1 1 A 75 75 ILE H H 429 8.144 8.807 -0.663 1
1 8 . 5 1 1 A 75 75 ILE HA H 429 4.086 4.543 -0.457 1
1 15 . 5 1 1 A 75 75 ILE C C 429 173.426 175.499 -2.073 1
1 16 . 5 1 1 A 75 75 ILE CA C 429 58.339 61.023 -2.684 1
1 17 . 5 1 1 A 75 75 ILE CB C 429 35.988 38.801 -2.813 1
1 21 . 5 1 1 A 75 75 ILE N N 429 121.551 122.385 -0.834 1
1 869 . 5 1 1 A 75 75 ILE H H 429 7.682 8.807 -1.125 1
1 870 . 5 1 1 A 75 75 ILE HA H 429 4.282 4.543 -0.261 1
1 880 . 5 1 1 A 75 75 ILE C C 429 172.510 175.499 -2.989 1
1 881 . 5 1 1 A 75 75 ILE CA C 429 57.456 61.023 -3.567 1
1 882 . 5 1 1 A 75 75 ILE CB C 429 37.903 38.801 -0.898 1
1 886 . 5 1 1 A 75 75 ILE N N 429 119.651 122.385 -2.734 1
1 1 . 5 1 1 A 76 76 VAL HA H 430 4.086 4.750 -0.664 1
1 2 . 5 1 1 A 76 76 VAL CA C 430 59.372 61.413 -2.041 1
1 22 . 5 1 1 A 76 76 VAL H H 430 8.221 8.551 -0.330 1
1 23 . 5 1 1 A 76 76 VAL HA H 430 4.083 4.750 -0.667 1
1 24 . 5 1 1 A 76 76 VAL C C 430 173.067 175.104 -2.037 1
1 25 . 5 1 1 A 76 76 VAL CA C 430 59.445 61.413 -1.968 1
1 26 . 5 1 1 A 76 76 VAL CB C 430 30.407 33.508 -3.101 1
1 27 . 5 1 1 A 76 76 VAL N N 430 125.930 126.642 -0.712 1
1 887 . 5 1 1 A 76 76 VAL H H 430 8.122 8.551 -0.429 1
1 888 . 5 1 1 A 76 76 VAL HA H 430 4.197 4.750 -0.553 1
1 890 . 5 1 1 A 76 76 VAL C C 430 172.971 175.104 -2.133 1
1 891 . 5 1 1 A 76 76 VAL CA C 430 58.821 61.413 -2.592 1
1 892 . 5 1 1 A 76 76 VAL CB C 430 30.807 33.508 -2.701 1
1 895 . 5 1 1 A 76 76 VAL N N 430 124.178 126.642 -2.464 1
1 4 . 5 1 1 A 77 77 VAL H H 431 8.204 8.929 -0.725 1
1 5 . 5 1 1 A 77 77 VAL HA H 431 4.049 4.910 -0.861 1
1 6 . 5 1 1 A 77 77 VAL C C 431 172.636 173.789 -1.153 1
1 7 . 5 1 1 A 77 77 VAL CA C 431 59.315 58.847 0.468 1
1 8 . 5 1 1 A 77 77 VAL CB C 431 30.219 35.123 -4.904 1
1 9 . 5 1 1 A 77 77 VAL N N 431 125.320 120.369 4.951 1
1 28 . 5 1 1 A 77 77 VAL H H 431 8.412 8.929 -0.517 1
1 29 . 5 1 1 A 77 77 VAL HA H 431 4.038 4.910 -0.872 1
1 37 . 5 1 1 A 77 77 VAL C C 431 172.617 173.789 -1.172 1
1 38 . 5 1 1 A 77 77 VAL CA C 431 59.137 58.847 0.290 1
1 39 . 5 1 1 A 77 77 VAL CB C 431 30.292 35.123 -4.831 1
1 42 . 5 1 1 A 77 77 VAL N N 431 125.655 120.369 5.286 1
1 896 . 5 1 1 A 77 77 VAL H H 431 8.448 8.929 -0.481 1
1 897 . 5 1 1 A 77 77 VAL HA H 431 4.087 4.910 -0.823 1
1 905 . 5 1 1 A 77 77 VAL C C 431 172.493 173.789 -1.296 1
1 906 . 5 1 1 A 77 77 VAL CA C 431 59.185 58.847 0.338 1
1 907 . 5 1 1 A 77 77 VAL CB C 431 30.084 35.123 -5.039 1
1 910 . 5 1 1 A 77 77 VAL N N 431 125.770 120.369 5.401 1
1 43 . 5 1 1 A 78 78 ASP H H 432 8.419 8.672 -0.253 1
1 44 . 5 1 1 A 78 78 ASP HA H 432 4.829 4.877 -0.048 1
1 45 . 5 1 1 A 78 78 ASP C C 432 172.252 174.096 -1.844 1
1 46 . 5 1 1 A 78 78 ASP CA C 432 49.320 51.305 -1.985 1
1 47 . 5 1 1 A 78 78 ASP CB C 432 39.066 40.282 -1.216 1
1 48 . 5 1 1 A 78 78 ASP N N 432 126.226 122.845 3.381 1
1 911 . 5 1 1 A 78 78 ASP H H 432 8.493 8.672 -0.179 1
1 912 . 5 1 1 A 78 78 ASP HA H 432 4.852 4.877 -0.025 1
1 915 . 5 1 1 A 78 78 ASP C C 432 172.048 174.096 -2.048 1
1 916 . 5 1 1 A 78 78 ASP CA C 432 49.233 51.305 -2.072 1
1 917 . 5 1 1 A 78 78 ASP CB C 432 38.858 40.282 -1.424 1
1 918 . 5 1 1 A 78 78 ASP N N 432 126.705 122.845 3.860 1
1 10 . 5 1 1 A 79 79 PRO CA C 433 63.865 62.387 1.478 1
1 49 . 5 1 1 A 79 79 PRO C C 433 173.867 176.131 -2.264 1
1 919 . 5 1 1 A 79 79 PRO HA H 433 4.237 4.567 -0.330 1
1 926 . 5 1 1 A 79 79 PRO C C 433 173.812 176.131 -2.319 1
1 927 . 5 1 1 A 79 79 PRO CA C 433 60.627 62.387 -1.760 1
1 928 . 5 1 1 A 79 79 PRO CB C 433 29.329 30.601 -1.272 1
1 11 . 5 1 1 A 80 80 PHE H H 434 8.182 8.181 0.001 1
1 12 . 5 1 1 A 80 80 PHE HA H 434 4.499 4.558 -0.059 1
1 13 . 5 1 1 A 80 80 PHE C C 434 171.680 175.607 -3.927 1
1 14 . 5 1 1 A 80 80 PHE CA C 434 54.657 60.344 -5.687 1
1 15 . 5 1 1 A 80 80 PHE CB C 434 36.272 40.237 -3.965 1
1 16 . 5 1 1 A 80 80 PHE N N 434 118.611 122.150 -3.539 1
1 50 . 5 1 1 A 80 80 PHE H H 434 8.191 8.181 0.010 1
1 51 . 5 1 1 A 80 80 PHE HA H 434 4.528 4.558 -0.030 1
1 54 . 5 1 1 A 80 80 PHE C C 434 172.457 175.607 -3.150 1
1 55 . 5 1 1 A 80 80 PHE CA C 434 54.828 60.344 -5.516 1
1 56 . 5 1 1 A 80 80 PHE CB C 434 36.457 40.237 -3.780 1
1 57 . 5 1 1 A 80 80 PHE N N 434 118.871 122.150 -3.279 1
1 931 . 5 1 1 A 80 80 PHE H H 434 8.191 8.181 0.010 1
1 932 . 5 1 1 A 80 80 PHE HA H 434 4.463 4.558 -0.095 1
1 939 . 5 1 1 A 80 80 PHE C C 434 172.283 175.607 -3.324 1
1 940 . 5 1 1 A 80 80 PHE CA C 434 54.971 60.344 -5.373 1
1 941 . 5 1 1 A 80 80 PHE CB C 434 36.490 40.237 -3.747 1
1 944 . 5 1 1 A 80 80 PHE N N 434 119.263 122.150 -2.887 1
1 17 . 5 1 1 A 81 81 ASP H H 435 7.490 8.405 -0.915 1
1 18 . 5 1 1 A 81 81 ASP HA H 435 4.698 5.128 -0.430 1
1 19 . 5 1 1 A 81 81 ASP C C 435 171.662 173.652 -1.990 1
1 20 . 5 1 1 A 81 81 ASP CA C 435 49.570 51.540 -1.970 1
1 21 . 5 1 1 A 81 81 ASP CB C 435 40.104 41.515 -1.411 1
1 22 . 5 1 1 A 81 81 ASP N N 435 120.304 117.759 2.545 1
1 58 . 5 1 1 A 81 81 ASP H H 435 7.881 8.405 -0.524 1
1 59 . 5 1 1 A 81 81 ASP HA H 435 4.801 5.128 -0.327 1
1 60 . 5 1 1 A 81 81 ASP C C 435 171.144 173.652 -2.508 1
1 61 . 5 1 1 A 81 81 ASP CA C 435 49.406 51.540 -2.134 1
1 62 . 5 1 1 A 81 81 ASP CB C 435 38.618 41.515 -2.897 1
1 63 . 5 1 1 A 81 81 ASP N N 435 123.108 117.759 5.349 1
1 945 . 5 1 1 A 81 81 ASP H H 435 7.823 8.405 -0.582 1
1 946 . 5 1 1 A 81 81 ASP HA H 435 4.759 5.128 -0.369 1
1 949 . 5 1 1 A 81 81 ASP C C 435 171.057 173.652 -2.595 1
1 950 . 5 1 1 A 81 81 ASP CA C 435 49.174 51.540 -2.366 1
1 951 . 5 1 1 A 81 81 ASP CB C 435 38.725 41.515 -2.790 1
1 952 . 5 1 1 A 81 81 ASP N N 435 123.530 117.759 5.771 1
1 23 . 5 1 1 A 82 82 PRO HA H 436 4.758 4.771 -0.013 1
1 24 . 5 1 1 A 82 82 PRO C C 436 172.944 175.847 -2.903 1
1 25 . 5 1 1 A 82 82 PRO CA C 436 60.134 62.304 -2.170 1
1 26 . 5 1 1 A 82 82 PRO CB C 436 31.425 33.255 -1.830 1
1 64 . 5 1 1 A 82 82 PRO HA H 436 4.364 4.771 -0.407 1
1 67 . 5 1 1 A 82 82 PRO C C 436 173.563 175.847 -2.284 1
1 68 . 5 1 1 A 82 82 PRO CA C 436 60.729 62.304 -1.575 1
1 69 . 5 1 1 A 82 82 PRO CB C 436 29.160 33.255 -4.095 1
1 953 . 5 1 1 A 82 82 PRO HA H 436 4.296 4.771 -0.475 1
1 960 . 5 1 1 A 82 82 PRO C C 436 173.494 175.847 -2.353 1
1 961 . 5 1 1 A 82 82 PRO CA C 436 60.625 62.304 -1.679 1
1 962 . 5 1 1 A 82 82 PRO CB C 436 29.237 33.255 -4.018 1
1 1 . 6 1 1 A 3 3 LEU HA H 357 4.257 4.560 -0.303 1
1 11 . 6 1 1 A 3 3 LEU C C 357 174.994 176.484 -1.490 1
1 12 . 6 1 1 A 3 3 LEU CA C 357 53.329 54.269 -0.940 1
1 13 . 6 1 1 A 3 3 LEU CB C 357 39.382 42.025 -2.643 1
1 17 . 6 1 1 A 4 4 GLN H H 358 8.234 7.748 0.486 1
1 18 . 6 1 1 A 4 4 GLN HA H 358 4.211 4.279 -0.068 1
1 25 . 6 1 1 A 4 4 GLN C C 358 173.357 175.504 -2.147 1
1 26 . 6 1 1 A 4 4 GLN CA C 358 53.791 55.884 -2.093 1
1 27 . 6 1 1 A 4 4 GLN CB C 358 26.456 29.402 -2.946 1
1 29 . 6 1 1 A 4 4 GLN N N 358 119.506 121.472 -1.966 1
1 31 . 6 1 1 A 5 5 ASP H H 359 8.090 8.448 -0.358 1
1 32 . 6 1 1 A 5 5 ASP HA H 359 4.458 4.843 -0.385 1
1 35 . 6 1 1 A 5 5 ASP C C 359 173.492 175.910 -2.418 1
1 36 . 6 1 1 A 5 5 ASP CA C 359 52.309 54.242 -1.933 1
1 37 . 6 1 1 A 5 5 ASP CB C 359 38.312 41.697 -3.385 1
1 38 . 6 1 1 A 5 5 ASP N N 359 120.683 126.769 -6.086 1
1 39 . 6 1 1 A 6 6 HIS H H 360 8.103 8.650 -0.547 1
1 40 . 6 1 1 A 6 6 HIS HA H 360 4.540 4.424 0.116 1
1 45 . 6 1 1 A 6 6 HIS C C 360 172.801 175.045 -2.244 1
1 46 . 6 1 1 A 6 6 HIS CA C 360 53.874 57.831 -3.957 1
1 47 . 6 1 1 A 6 6 HIS CB C 360 27.878 29.703 -1.825 1
1 50 . 6 1 1 A 6 6 HIS N N 360 118.844 124.766 -5.922 1
1 51 . 6 1 1 A 7 7 ILE H H 361 7.862 8.137 -0.275 1
1 52 . 6 1 1 A 7 7 ILE HA H 361 4.010 3.913 0.097 1
1 62 . 6 1 1 A 7 7 ILE C C 361 173.268 174.927 -1.659 1
1 63 . 6 1 1 A 7 7 ILE CA C 361 58.740 62.031 -3.291 1
1 64 . 6 1 1 A 7 7 ILE CB C 361 35.788 36.928 -1.140 1
1 68 . 6 1 1 A 7 7 ILE N N 361 121.598 122.431 -0.833 1
1 69 . 6 1 1 A 8 8 LYS H H 362 8.231 8.759 -0.528 1
1 70 . 6 1 1 A 8 8 LYS HA H 362 4.313 4.533 -0.220 1
1 79 . 6 1 1 A 8 8 LYS C C 362 173.899 175.625 -1.726 1
1 80 . 6 1 1 A 8 8 LYS CA C 362 53.677 56.186 -2.509 1
1 81 . 6 1 1 A 8 8 LYS CB C 362 30.355 32.812 -2.457 1
1 85 . 6 1 1 A 8 8 LYS N N 362 124.980 127.348 -2.368 1
1 86 . 6 1 1 A 9 9 VAL H H 363 8.044 8.548 -0.504 1
1 87 . 6 1 1 A 9 9 VAL HA H 363 4.089 4.692 -0.603 1
1 95 . 6 1 1 A 9 9 VAL C C 363 173.760 174.158 -0.398 1
1 96 . 6 1 1 A 9 9 VAL CA C 363 59.814 59.422 0.392 1
1 97 . 6 1 1 A 9 9 VAL CB C 363 30.058 35.618 -5.560 1
1 100 . 6 1 1 A 9 9 VAL N N 363 121.366 123.209 -1.843 1
1 101 . 6 1 1 A 10 10 THR H H 364 8.076 8.263 -0.187 1
1 102 . 6 1 1 A 10 10 THR HA H 364 4.302 4.662 -0.360 1
1 107 . 6 1 1 A 10 10 THR C C 364 172.135 175.445 -3.310 1
1 108 . 6 1 1 A 10 10 THR CA C 364 59.134 60.560 -1.426 1
1 109 . 6 1 1 A 10 10 THR CB C 364 67.415 71.587 -4.172 1
1 111 . 6 1 1 A 10 10 THR N N 364 116.817 115.913 0.904 1
1 112 . 6 1 1 A 11 11 GLN H H 365 8.463 8.826 -0.363 1
1 113 . 6 1 1 A 11 11 GLN HA H 365 4.046 4.290 -0.244 1
1 120 . 6 1 1 A 11 11 GLN C C 365 173.944 176.127 -2.183 1
1 121 . 6 1 1 A 11 11 GLN CA C 365 54.517 57.564 -3.047 1
1 122 . 6 1 1 A 11 11 GLN CB C 365 26.250 29.782 -3.532 1
1 124 . 6 1 1 A 11 11 GLN N N 365 122.059 119.883 2.176 1
1 126 . 6 1 1 A 12 12 GLU H H 366 8.449 8.279 0.170 1
1 127 . 6 1 1 A 12 12 GLU HA H 366 4.093 4.824 -0.731 1
1 132 . 6 1 1 A 12 12 GLU C C 366 174.746 178.148 -3.402 1
1 133 . 6 1 1 A 12 12 GLU CA C 366 55.235 58.123 -2.888 1
1 134 . 6 1 1 A 12 12 GLU CB C 366 27.180 32.257 -5.077 1
1 136 . 6 1 1 A 12 12 GLU N N 366 120.415 119.896 0.519 1
1 137 . 6 1 1 A 13 13 GLN H H 367 8.031 8.845 -0.814 1
1 138 . 6 1 1 A 13 13 GLN HA H 367 4.113 4.073 0.040 1
1 145 . 6 1 1 A 13 13 GLN C C 367 173.693 178.287 -4.594 1
1 146 . 6 1 1 A 13 13 GLN CA C 367 54.132 58.977 -4.845 1
1 147 . 6 1 1 A 13 13 GLN CB C 367 26.420 28.506 -2.086 1
1 149 . 6 1 1 A 13 13 GLN N N 367 119.721 120.236 -0.515 1
1 151 . 6 1 1 A 14 14 TYR H H 368 8.111 8.124 -0.013 1
1 152 . 6 1 1 A 14 14 TYR HA H 368 4.339 4.408 -0.069 1
1 159 . 6 1 1 A 14 14 TYR C C 368 173.916 177.515 -3.599 1
1 160 . 6 1 1 A 14 14 TYR CA C 368 56.572 60.075 -3.503 1
1 161 . 6 1 1 A 14 14 TYR CB C 368 35.879 37.148 -1.269 1
1 164 . 6 1 1 A 14 14 TYR N N 368 120.541 118.775 1.766 1
1 165 . 6 1 1 A 15 15 GLU H H 369 8.287 7.992 0.295 1
1 166 . 6 1 1 A 15 15 GLU HA H 369 4.009 3.906 0.103 1
1 171 . 6 1 1 A 15 15 GLU C C 369 174.448 177.873 -3.425 1
1 172 . 6 1 1 A 15 15 GLU CA C 369 55.047 58.472 -3.425 1
1 173 . 6 1 1 A 15 15 GLU CB C 369 27.226 29.450 -2.224 1
1 175 . 6 1 1 A 15 15 GLU N N 369 120.398 121.241 -0.843 1
1 176 . 6 1 1 A 16 16 LEU H H 370 7.785 7.931 -0.146 1
1 177 . 6 1 1 A 16 16 LEU HA H 370 4.138 4.394 -0.256 1
1 187 . 6 1 1 A 16 16 LEU C C 370 175.089 177.619 -2.530 1
1 188 . 6 1 1 A 16 16 LEU CA C 370 53.425 54.737 -1.312 1
1 189 . 6 1 1 A 16 16 LEU CB C 370 39.554 41.720 -2.166 1
1 193 . 6 1 1 A 16 16 LEU N N 370 121.323 115.675 5.648 1
1 194 . 6 1 1 A 17 17 TYR H H 371 8.038 8.466 -0.428 1
1 195 . 6 1 1 A 17 17 TYR HA H 371 4.380 4.353 0.027 1
1 202 . 6 1 1 A 17 17 TYR C C 371 173.931 176.332 -2.401 1
1 203 . 6 1 1 A 17 17 TYR CA C 371 56.143 59.801 -3.658 1
1 204 . 6 1 1 A 17 17 TYR CB C 371 35.501 37.395 -1.894 1
1 207 . 6 1 1 A 17 17 TYR N N 371 119.465 119.725 -0.260 1
1 208 . 6 1 1 A 18 18 CYS H H 372 8.021 7.273 0.748 1
1 209 . 6 1 1 A 18 18 CYS HA H 372 4.236 3.844 0.392 1
1 212 . 6 1 1 A 18 18 CYS C C 372 172.457 174.096 -1.639 1
1 213 . 6 1 1 A 18 18 CYS CA C 372 56.997 58.785 -1.788 1
1 214 . 6 1 1 A 18 18 CYS CB C 372 25.080 27.893 -2.813 1
1 215 . 6 1 1 A 18 18 CYS N N 372 119.913 121.369 -1.456 1
1 216 . 6 1 1 A 19 19 GLU H H 373 8.151 8.430 -0.279 1
1 217 . 6 1 1 A 19 19 GLU HA H 373 4.130 4.520 -0.390 1
1 222 . 6 1 1 A 19 19 GLU C C 373 174.151 176.639 -2.488 1
1 223 . 6 1 1 A 19 19 GLU CA C 373 54.535 55.207 -0.672 1
1 224 . 6 1 1 A 19 19 GLU CB C 373 27.244 30.647 -3.403 1
1 226 . 6 1 1 A 19 19 GLU N N 373 122.431 126.605 -4.174 1
1 227 . 6 1 1 A 20 20 MET H H 374 8.109 8.988 -0.879 1
1 228 . 6 1 1 A 20 20 MET HA H 374 4.352 4.360 -0.008 1
1 236 . 6 1 1 A 20 20 MET C C 374 174.200 175.888 -1.688 1
1 237 . 6 1 1 A 20 20 MET CA C 374 53.238 55.871 -2.633 1
1 238 . 6 1 1 A 20 20 MET CB C 374 30.237 32.330 -2.093 1
1 241 . 6 1 1 A 20 20 MET N N 374 119.754 125.499 -5.745 1
1 242 . 6 1 1 A 21 21 GLY H H 375 8.231 8.787 -0.556 1
1 243 . 6 1 1 A 21 21 GLY HA2 H 375 3.861 4.038 -0.177 1
1 244 . 6 1 1 A 21 21 GLY HA3 H 375 3.960 4.039 -0.079 1
1 245 . 6 1 1 A 21 21 GLY C C 375 171.928 173.545 -1.617 1
1 246 . 6 1 1 A 21 21 GLY CA C 375 42.930 45.458 -2.528 1
1 247 . 6 1 1 A 21 21 GLY N N 375 109.484 107.018 2.466 1
1 248 . 6 1 1 A 22 22 SER HA H 376 4.492 4.821 -0.329 1
1 251 . 6 1 1 A 22 22 SER C C 376 172.206 173.560 -1.354 1
1 252 . 6 1 1 A 22 22 SER CA C 376 55.570 57.734 -2.164 1
1 253 . 6 1 1 A 22 22 SER CB C 376 61.525 65.236 -3.711 1
1 254 . 6 1 1 A 23 23 THR H H 377 8.470 9.119 -0.649 1
1 255 . 6 1 1 A 23 23 THR HA H 377 4.295 4.233 0.062 1
1 260 . 6 1 1 A 23 23 THR C C 377 171.811 175.214 -3.403 1
1 261 . 6 1 1 A 23 23 THR CA C 377 58.937 63.713 -4.776 1
1 262 . 6 1 1 A 23 23 THR CB C 377 67.250 68.383 -1.133 1
1 264 . 6 1 1 A 23 23 THR N N 377 124.043 122.651 1.392 1
1 265 . 6 1 1 A 24 24 PHE H H 378 8.374 9.051 -0.677 1
1 266 . 6 1 1 A 24 24 PHE HA H 378 4.239 4.113 0.126 1
1 273 . 6 1 1 A 24 24 PHE C C 378 173.411 178.028 -4.617 1
1 274 . 6 1 1 A 24 24 PHE CA C 378 56.697 61.284 -4.587 1
1 275 . 6 1 1 A 24 24 PHE CB C 378 36.538 39.580 -3.042 1
1 278 . 6 1 1 A 24 24 PHE N N 378 124.732 127.919 -3.187 1
1 279 . 6 1 1 A 25 25 GLN H H 379 8.457 8.050 0.407 1
1 280 . 6 1 1 A 25 25 GLN HA H 379 4.038 4.010 0.028 1
1 287 . 6 1 1 A 25 25 GLN C C 379 172.431 176.156 -3.725 1
1 288 . 6 1 1 A 25 25 GLN CA C 379 54.078 58.251 -4.173 1
1 289 . 6 1 1 A 25 25 GLN CB C 379 26.414 28.823 -2.409 1
1 291 . 6 1 1 A 25 25 GLN N N 379 118.820 118.199 0.621 1
1 293 . 6 1 1 A 26 26 LEU H H 380 6.985 7.613 -0.628 1
1 294 . 6 1 1 A 26 26 LEU HA H 380 4.229 4.558 -0.329 1
1 304 . 6 1 1 A 26 26 LEU C C 380 173.895 175.749 -1.854 1
1 305 . 6 1 1 A 26 26 LEU CA C 380 52.123 53.733 -1.610 1
1 306 . 6 1 1 A 26 26 LEU CB C 380 40.543 43.224 -2.681 1
1 310 . 6 1 1 A 26 26 LEU N N 380 119.079 120.852 -1.773 1
1 311 . 6 1 1 A 27 27 CYS H H 381 8.905 8.721 0.184 1
1 312 . 6 1 1 A 27 27 CYS HA H 381 4.013 4.621 -0.608 1
1 315 . 6 1 1 A 27 27 CYS C C 381 174.439 175.459 -1.020 1
1 316 . 6 1 1 A 27 27 CYS CA C 381 57.847 58.862 -1.015 1
1 317 . 6 1 1 A 27 27 CYS CB C 381 28.648 28.365 0.283 1
1 318 . 6 1 1 A 27 27 CYS N N 381 125.151 120.755 4.396 1
1 319 . 6 1 1 A 28 28 LYS H H 382 9.351 8.774 0.577 1
1 320 . 6 1 1 A 28 28 LYS HA H 382 4.157 3.950 0.207 1
1 329 . 6 1 1 A 28 28 LYS C C 382 174.678 178.247 -3.569 1
1 330 . 6 1 1 A 28 28 LYS CA C 382 54.324 59.177 -4.853 1
1 331 . 6 1 1 A 28 28 LYS CB C 382 30.086 32.504 -2.418 1
1 335 . 6 1 1 A 28 28 LYS N N 382 128.840 128.372 0.468 1
1 336 . 6 1 1 A 29 29 ILE H H 383 9.040 8.080 0.960 1
1 337 . 6 1 1 A 29 29 ILE HA H 383 3.804 3.465 0.339 1
1 347 . 6 1 1 A 29 29 ILE C C 383 174.239 177.549 -3.310 1
1 348 . 6 1 1 A 29 29 ILE CA C 383 62.114 65.296 -3.182 1
1 349 . 6 1 1 A 29 29 ILE CB C 383 33.870 38.667 -4.797 1
1 353 . 6 1 1 A 29 29 ILE N N 383 122.718 119.723 2.995 1
1 354 . 6 1 1 A 30 30 CYS H H 384 7.572 7.735 -0.163 1
1 355 . 6 1 1 A 30 30 CYS HA H 384 4.548 4.415 0.133 1
1 358 . 6 1 1 A 30 30 CYS C C 384 172.978 175.022 -2.044 1
1 359 . 6 1 1 A 30 30 CYS CA C 384 54.957 59.700 -4.743 1
1 360 . 6 1 1 A 30 30 CYS CB C 384 29.778 29.327 0.451 1
1 361 . 6 1 1 A 30 30 CYS N N 384 116.356 115.543 0.813 1
1 362 . 6 1 1 A 31 31 ALA H H 385 8.205 8.403 -0.198 1
1 363 . 6 1 1 A 31 31 ALA HA H 385 4.107 4.096 0.011 1
1 367 . 6 1 1 A 31 31 ALA C C 385 173.139 177.098 -3.959 1
1 368 . 6 1 1 A 31 31 ALA CA C 385 50.802 53.334 -2.532 1
1 369 . 6 1 1 A 31 31 ALA CB C 385 14.634 17.581 -2.947 1
1 370 . 6 1 1 A 31 31 ALA N N 385 125.526 121.091 4.435 1
1 371 . 6 1 1 A 32 32 GLU H H 386 8.416 7.888 0.528 1
1 372 . 6 1 1 A 32 32 GLU HA H 386 4.467 4.653 -0.186 1
1 377 . 6 1 1 A 32 32 GLU C C 386 172.325 175.965 -3.640 1
1 378 . 6 1 1 A 32 32 GLU CA C 386 55.146 57.906 -2.760 1
1 379 . 6 1 1 A 32 32 GLU CB C 386 31.181 32.514 -1.333 1
1 381 . 6 1 1 A 32 32 GLU N N 386 117.579 116.356 1.223 1
1 382 . 6 1 1 A 33 33 ASN H H 387 7.872 8.041 -0.169 1
1 383 . 6 1 1 A 33 33 ASN HA H 387 4.900 4.914 -0.014 1
1 388 . 6 1 1 A 33 33 ASN C C 387 171.355 175.044 -3.689 1
1 389 . 6 1 1 A 33 33 ASN CA C 387 49.320 52.092 -2.772 1
1 390 . 6 1 1 A 33 33 ASN CB C 387 38.457 39.860 -1.403 1
1 391 . 6 1 1 A 33 33 ASN N N 387 120.399 117.776 2.623 1
1 393 . 6 1 1 A 34 34 ASP H H 388 8.565 8.546 0.019 1
1 394 . 6 1 1 A 34 34 ASP HA H 388 4.679 4.707 -0.028 1
1 397 . 6 1 1 A 34 34 ASP C C 388 174.243 175.972 -1.729 1
1 398 . 6 1 1 A 34 34 ASP CA C 388 51.809 54.427 -2.618 1
1 399 . 6 1 1 A 34 34 ASP CB C 388 38.007 41.879 -3.872 1
1 400 . 6 1 1 A 34 34 ASP N N 388 120.661 120.723 -0.062 1
1 401 . 6 1 1 A 35 35 LYS H H 389 8.544 8.912 -0.368 1
1 402 . 6 1 1 A 35 35 LYS HA H 389 3.411 4.348 -0.937 1
1 409 . 6 1 1 A 35 35 LYS C C 389 172.938 176.574 -3.636 1
1 410 . 6 1 1 A 35 35 LYS CA C 389 54.973 56.242 -1.269 1
1 411 . 6 1 1 A 35 35 LYS CB C 389 30.617 32.090 -1.473 1
1 415 . 6 1 1 A 35 35 LYS N N 389 119.199 121.906 -2.707 1
1 416 . 6 1 1 A 36 36 ASP H H 390 8.327 8.981 -0.654 1
1 417 . 6 1 1 A 36 36 ASP HA H 390 4.724 4.810 -0.086 1
1 420 . 6 1 1 A 36 36 ASP C C 390 172.860 175.259 -2.399 1
1 421 . 6 1 1 A 36 36 ASP CA C 390 51.609 53.672 -2.063 1
1 422 . 6 1 1 A 36 36 ASP CB C 390 39.018 41.486 -2.468 1
1 423 . 6 1 1 A 36 36 ASP N N 390 119.134 124.850 -5.716 1
1 424 . 6 1 1 A 37 37 VAL H H 391 8.544 7.700 0.844 1
1 425 . 6 1 1 A 37 37 VAL HA H 391 4.877 4.764 0.113 1
1 433 . 6 1 1 A 37 37 VAL C C 391 167.519 173.492 -5.973 1
1 434 . 6 1 1 A 37 37 VAL CA C 391 58.259 59.995 -1.736 1
1 435 . 6 1 1 A 37 37 VAL CB C 391 32.277 35.325 -3.048 1
1 438 . 6 1 1 A 37 37 VAL N N 391 121.970 119.387 2.583 1
1 439 . 6 1 1 A 38 38 LYS H H 392 8.621 9.588 -0.967 1
1 440 . 6 1 1 A 38 38 LYS HA H 392 4.991 5.075 -0.084 1
1 449 . 6 1 1 A 38 38 LYS C C 392 172.681 175.188 -2.507 1
1 450 . 6 1 1 A 38 38 LYS CA C 392 51.123 54.621 -3.498 1
1 451 . 6 1 1 A 38 38 LYS CB C 392 33.697 34.783 -1.086 1
1 455 . 6 1 1 A 38 38 LYS N N 392 126.381 128.565 -2.184 1
1 456 . 6 1 1 A 39 39 ILE H H 393 8.723 9.014 -0.291 1
1 457 . 6 1 1 A 39 39 ILE HA H 393 4.239 4.397 -0.158 1
1 467 . 6 1 1 A 39 39 ILE C C 393 172.642 175.701 -3.059 1
1 468 . 6 1 1 A 39 39 ILE CA C 393 57.768 60.969 -3.201 1
1 469 . 6 1 1 A 39 39 ILE CB C 393 35.691 37.528 -1.837 1
1 473 . 6 1 1 A 39 39 ILE N N 393 126.398 127.706 -1.308 1
1 474 . 6 1 1 A 40 40 GLU H H 394 8.506 9.425 -0.919 1
1 475 . 6 1 1 A 40 40 GLU HA H 394 4.753 4.712 0.041 1
1 480 . 6 1 1 A 40 40 GLU C C 394 173.596 176.190 -2.594 1
1 481 . 6 1 1 A 40 40 GLU CA C 394 49.793 53.347 -3.554 1
1 482 . 6 1 1 A 40 40 GLU CB C 394 28.210 30.702 -2.492 1
1 484 . 6 1 1 A 40 40 GLU N N 394 124.864 128.197 -3.333 1
1 485 . 6 1 1 A 41 41 PRO HA H 395 4.864 4.482 0.382 1
1 492 . 6 1 1 A 41 41 PRO C C 395 175.073 177.081 -2.008 1
1 493 . 6 1 1 A 41 41 PRO CA C 395 61.111 63.876 -2.765 1
1 494 . 6 1 1 A 41 41 PRO CB C 395 32.275 32.984 -0.709 1
1 497 . 6 1 1 A 42 42 CYS H H 396 7.828 7.829 -0.001 1
1 498 . 6 1 1 A 42 42 CYS HA H 396 4.208 4.039 0.169 1
1 501 . 6 1 1 A 42 42 CYS C C 396 173.877 175.051 -1.174 1
1 502 . 6 1 1 A 42 42 CYS CA C 396 58.021 61.427 -3.406 1
1 503 . 6 1 1 A 42 42 CYS CB C 396 28.242 27.273 0.969 1
1 504 . 6 1 1 A 42 42 CYS N N 396 122.434 117.839 4.595 1
1 505 . 6 1 1 A 43 43 GLY H H 397 8.679 8.853 -0.174 1
1 506 . 6 1 1 A 43 43 GLY HA2 H 397 3.507 3.951 -0.444 1
1 507 . 6 1 1 A 43 43 GLY HA3 H 397 3.914 3.956 -0.042 1
1 508 . 6 1 1 A 43 43 GLY C C 397 171.981 175.104 -3.123 1
1 509 . 6 1 1 A 43 43 GLY CA C 397 43.347 45.764 -2.417 1
1 510 . 6 1 1 A 43 43 GLY N N 397 112.123 108.477 3.646 1
1 511 . 6 1 1 A 44 44 HIS H H 398 8.329 7.843 0.486 1
1 512 . 6 1 1 A 44 44 HIS HA H 398 4.339 4.466 -0.127 1
1 517 . 6 1 1 A 44 44 HIS C C 398 170.742 174.483 -3.741 1
1 518 . 6 1 1 A 44 44 HIS CA C 398 58.368 56.324 2.044 1
1 519 . 6 1 1 A 44 44 HIS CB C 398 28.434 30.905 -2.471 1
1 522 . 6 1 1 A 44 44 HIS N N 398 121.393 118.450 2.943 1
1 523 . 6 1 1 A 45 45 LEU H H 399 8.241 8.767 -0.526 1
1 524 . 6 1 1 A 45 45 LEU HA H 399 5.570 5.379 0.191 1
1 534 . 6 1 1 A 45 45 LEU C C 399 174.464 175.732 -1.268 1
1 535 . 6 1 1 A 45 45 LEU CA C 399 50.729 53.264 -2.535 1
1 536 . 6 1 1 A 45 45 LEU CB C 399 43.574 45.383 -1.809 1
1 540 . 6 1 1 A 45 45 LEU N N 399 118.469 122.324 -3.855 1
1 541 . 6 1 1 A 46 46 MET H H 400 8.707 8.565 0.142 1
1 542 . 6 1 1 A 46 46 MET HA H 400 4.842 4.955 -0.113 1
1 550 . 6 1 1 A 46 46 MET C C 400 170.736 173.761 -3.025 1
1 551 . 6 1 1 A 46 46 MET CA C 400 52.804 54.387 -1.583 1
1 552 . 6 1 1 A 46 46 MET CB C 400 31.945 34.496 -2.551 1
1 555 . 6 1 1 A 46 46 MET N N 400 114.897 119.918 -5.021 1
1 556 . 6 1 1 A 47 47 CYS H H 401 9.436 8.386 1.050 1
1 557 . 6 1 1 A 47 47 CYS HA H 401 5.629 5.280 0.349 1
1 560 . 6 1 1 A 47 47 CYS C C 401 173.909 176.075 -2.166 1
1 561 . 6 1 1 A 47 47 CYS CA C 401 54.325 56.700 -2.375 1
1 562 . 6 1 1 A 47 47 CYS CB C 401 30.725 30.259 0.466 1
1 563 . 6 1 1 A 47 47 CYS N N 401 119.575 118.888 0.687 1
1 564 . 6 1 1 A 48 48 THR H H 402 9.842 9.498 0.344 1
1 565 . 6 1 1 A 48 48 THR HA H 402 3.768 3.996 -0.228 1
1 570 . 6 1 1 A 48 48 THR C C 402 174.333 176.276 -1.943 1
1 571 . 6 1 1 A 48 48 THR CA C 402 64.516 65.954 -1.438 1
1 572 . 6 1 1 A 48 48 THR CB C 402 66.288 68.628 -2.340 1
1 574 . 6 1 1 A 48 48 THR N N 402 119.945 119.191 0.754 1
1 575 . 6 1 1 A 49 49 SER H H 403 8.355 8.059 0.296 1
1 576 . 6 1 1 A 49 49 SER HA H 403 4.222 4.062 0.160 1
1 579 . 6 1 1 A 49 49 SER C C 403 175.059 176.973 -1.914 1
1 580 . 6 1 1 A 49 49 SER CA C 403 59.828 61.862 -2.034 1
1 581 . 6 1 1 A 49 49 SER CB C 403 59.717 62.844 -3.127 1
1 582 . 6 1 1 A 49 49 SER N N 403 120.468 117.308 3.160 1
1 583 . 6 1 1 A 50 50 CYS H H 404 9.464 8.258 1.206 1
1 584 . 6 1 1 A 50 50 CYS HA H 404 3.922 4.116 -0.194 1
1 587 . 6 1 1 A 50 50 CYS C C 404 176.081 177.075 -0.994 1
1 588 . 6 1 1 A 50 50 CYS CA C 404 63.076 64.407 -1.331 1
1 589 . 6 1 1 A 50 50 CYS CB C 404 26.078 27.276 -1.198 1
1 590 . 6 1 1 A 50 50 CYS N N 404 126.744 119.614 7.130 1
1 591 . 6 1 1 A 51 51 LEU H H 405 7.948 7.918 0.030 1
1 592 . 6 1 1 A 51 51 LEU HA H 405 4.064 4.157 -0.093 1
1 602 . 6 1 1 A 51 51 LEU C C 405 175.495 178.946 -3.451 1
1 603 . 6 1 1 A 51 51 LEU CA C 405 55.914 58.023 -2.109 1
1 604 . 6 1 1 A 51 51 LEU CB C 405 38.662 41.984 -3.322 1
1 607 . 6 1 1 A 51 51 LEU N N 405 121.951 122.652 -0.701 1
1 608 . 6 1 1 A 52 52 THR H H 406 8.786 8.560 0.226 1
1 609 . 6 1 1 A 52 52 THR HA H 406 4.024 3.938 0.086 1
1 614 . 6 1 1 A 52 52 THR C C 406 174.139 176.140 -2.001 1
1 615 . 6 1 1 A 52 52 THR CA C 406 64.017 66.645 -2.628 1
1 616 . 6 1 1 A 52 52 THR CB C 406 66.115 68.725 -2.610 1
1 618 . 6 1 1 A 52 52 THR N N 406 115.258 115.154 0.104 1
1 619 . 6 1 1 A 53 53 SER H H 407 8.115 8.122 -0.007 1
1 620 . 6 1 1 A 53 53 SER HA H 407 4.204 4.066 0.138 1
1 623 . 6 1 1 A 53 53 SER C C 407 174.456 176.947 -2.491 1
1 624 . 6 1 1 A 53 53 SER CA C 407 59.090 61.370 -2.280 1
1 625 . 6 1 1 A 53 53 SER CB C 407 60.146 63.291 -3.145 1
1 626 . 6 1 1 A 53 53 SER N N 407 116.852 114.945 1.907 1
1 627 . 6 1 1 A 54 54 TRP H H 408 8.123 8.079 0.044 1
1 628 . 6 1 1 A 54 54 TRP HA H 408 4.371 4.313 0.058 1
1 637 . 6 1 1 A 54 54 TRP C C 408 175.981 178.727 -2.746 1
1 638 . 6 1 1 A 54 54 TRP CA C 408 57.323 61.215 -3.892 1
1 639 . 6 1 1 A 54 54 TRP CB C 408 26.812 29.631 -2.819 1
1 645 . 6 1 1 A 54 54 TRP N N 408 123.556 123.903 -0.347 1
1 647 . 6 1 1 A 55 55 GLN H H 409 8.502 8.689 -0.187 1
1 648 . 6 1 1 A 55 55 GLN HA H 409 3.999 3.728 0.271 1
1 655 . 6 1 1 A 55 55 GLN C C 409 177.300 177.893 -0.593 1
1 656 . 6 1 1 A 55 55 GLN CA C 409 56.484 58.879 -2.395 1
1 657 . 6 1 1 A 55 55 GLN CB C 409 26.190 27.949 -1.759 1
1 659 . 6 1 1 A 55 55 GLN N N 409 118.044 118.138 -0.094 1
1 661 . 6 1 1 A 56 56 GLU H H 410 8.467 8.118 0.349 1
1 662 . 6 1 1 A 56 56 GLU HA H 410 4.057 4.133 -0.076 1
1 667 . 6 1 1 A 56 56 GLU C C 410 174.787 177.848 -3.061 1
1 668 . 6 1 1 A 56 56 GLU CA C 410 55.909 58.400 -2.491 1
1 669 . 6 1 1 A 56 56 GLU CB C 410 26.895 29.718 -2.823 1
1 671 . 6 1 1 A 56 56 GLU N N 410 119.448 119.207 0.241 1
1 672 . 6 1 1 A 57 57 SER H H 411 7.438 7.379 0.059 1
1 673 . 6 1 1 A 57 57 SER HA H 411 4.607 4.490 0.117 1
1 676 . 6 1 1 A 57 57 SER C C 411 170.849 173.005 -2.156 1
1 677 . 6 1 1 A 57 57 SER CA C 411 55.540 57.947 -2.407 1
1 678 . 6 1 1 A 57 57 SER CB C 411 60.928 63.189 -2.261 1
1 679 . 6 1 1 A 57 57 SER N N 411 113.752 111.971 1.781 1
1 680 . 6 1 1 A 58 58 GLU H H 412 7.855 7.682 0.173 1
1 681 . 6 1 1 A 58 58 GLU HA H 412 3.772 3.790 -0.018 1
1 686 . 6 1 1 A 58 58 GLU C C 412 173.743 174.893 -1.150 1
1 687 . 6 1 1 A 58 58 GLU CA C 412 54.442 56.957 -2.515 1
1 688 . 6 1 1 A 58 58 GLU CB C 412 24.603 27.621 -3.018 1
1 690 . 6 1 1 A 58 58 GLU N N 412 115.908 117.714 -1.806 1
1 691 . 6 1 1 A 59 59 GLY H H 413 7.588 7.719 -0.131 1
1 692 . 6 1 1 A 59 59 GLY HA2 H 413 1.643 2.302 -0.659 1
1 693 . 6 1 1 A 59 59 GLY HA3 H 413 2.949 3.483 -0.534 1
1 694 . 6 1 1 A 59 59 GLY C C 413 170.850 171.694 -0.844 1
1 695 . 6 1 1 A 59 59 GLY CA C 413 41.724 44.054 -2.330 1
1 696 . 6 1 1 A 59 59 GLY N N 413 108.032 106.872 1.160 1
1 697 . 6 1 1 A 60 60 GLN H H 414 7.973 8.643 -0.670 1
1 698 . 6 1 1 A 60 60 GLN HA H 414 4.366 4.775 -0.409 1
1 705 . 6 1 1 A 60 60 GLN C C 414 173.108 175.154 -2.046 1
1 706 . 6 1 1 A 60 60 GLN CA C 414 52.422 55.082 -2.660 1
1 707 . 6 1 1 A 60 60 GLN CB C 414 27.049 30.175 -3.126 1
1 709 . 6 1 1 A 60 60 GLN N N 414 122.690 124.873 -2.183 1
1 711 . 6 1 1 A 61 61 GLY H H 415 8.301 8.326 -0.025 1
1 712 . 6 1 1 A 61 61 GLY HA2 H 415 3.700 4.291 -0.591 1
1 713 . 6 1 1 A 61 61 GLY HA3 H 415 3.920 4.333 -0.413 1
1 714 . 6 1 1 A 61 61 GLY C C 415 170.249 174.066 -3.817 1
1 715 . 6 1 1 A 61 61 GLY CA C 415 42.210 44.281 -2.071 1
1 716 . 6 1 1 A 61 61 GLY N N 415 110.794 113.243 -2.449 1
1 717 . 6 1 1 A 62 62 CYS H H 416 8.549 8.194 0.355 1
1 718 . 6 1 1 A 62 62 CYS HA H 416 4.227 4.631 -0.404 1
1 721 . 6 1 1 A 62 62 CYS C C 416 172.914 175.415 -2.501 1
1 722 . 6 1 1 A 62 62 CYS CA C 416 54.008 58.577 -4.569 1
1 723 . 6 1 1 A 62 62 CYS CB C 416 29.716 27.457 2.259 1
1 724 . 6 1 1 A 62 62 CYS N N 416 123.683 121.091 2.592 1
1 725 . 6 1 1 A 63 63 PRO HA H 417 2.611 2.778 -0.167 1
1 732 . 6 1 1 A 63 63 PRO C C 417 174.143 178.403 -4.260 1
1 733 . 6 1 1 A 63 63 PRO CA C 417 61.689 64.143 -2.454 1
1 734 . 6 1 1 A 63 63 PRO CB C 417 28.534 31.185 -2.651 1
1 737 . 6 1 1 A 64 64 PHE H H 418 8.968 7.695 1.273 1
1 738 . 6 1 1 A 64 64 PHE HA H 418 4.250 4.081 0.169 1
1 746 . 6 1 1 A 64 64 PHE C C 418 174.243 178.468 -4.225 1
1 747 . 6 1 1 A 64 64 PHE CA C 418 56.720 60.695 -3.975 1
1 748 . 6 1 1 A 64 64 PHE CB C 418 36.458 38.877 -2.419 1
1 752 . 6 1 1 A 64 64 PHE N N 418 117.008 116.209 0.799 1
1 753 . 6 1 1 A 65 65 CYS H H 419 7.968 8.010 -0.042 1
1 754 . 6 1 1 A 65 65 CYS HA H 419 4.906 4.491 0.415 1
1 757 . 6 1 1 A 65 65 CYS C C 419 173.198 174.795 -1.597 1
1 758 . 6 1 1 A 65 65 CYS CA C 419 55.870 60.522 -4.652 1
1 759 . 6 1 1 A 65 65 CYS CB C 419 30.559 28.977 1.582 1
1 760 . 6 1 1 A 65 65 CYS N N 419 117.505 117.402 0.103 1
1 761 . 6 1 1 A 66 66 ARG H H 420 8.761 8.228 0.533 1
1 762 . 6 1 1 A 66 66 ARG HA H 420 4.365 4.194 0.171 1
1 769 . 6 1 1 A 66 66 ARG C C 420 172.921 174.757 -1.836 1
1 770 . 6 1 1 A 66 66 ARG CA C 420 54.763 56.996 -2.233 1
1 771 . 6 1 1 A 66 66 ARG CB C 420 24.286 27.424 -3.138 1
1 774 . 6 1 1 A 66 66 ARG N N 420 118.763 116.258 2.505 1
1 775 . 6 1 1 A 67 67 CYS H H 421 8.223 7.887 0.336 1
1 776 . 6 1 1 A 67 67 CYS HA H 421 4.419 4.901 -0.482 1
1 779 . 6 1 1 A 67 67 CYS C C 421 171.160 174.255 -3.095 1
1 780 . 6 1 1 A 67 67 CYS CA C 421 57.119 56.975 0.144 1
1 781 . 6 1 1 A 67 67 CYS CB C 421 25.911 30.882 -4.971 1
1 782 . 6 1 1 A 67 67 CYS N N 421 120.627 115.058 5.569 1
1 783 . 6 1 1 A 68 68 GLU H H 422 8.416 8.581 -0.165 1
1 784 . 6 1 1 A 68 68 GLU HA H 422 4.025 4.158 -0.133 1
1 789 . 6 1 1 A 68 68 GLU C C 422 173.764 176.337 -2.573 1
1 790 . 6 1 1 A 68 68 GLU CA C 422 54.752 57.850 -3.098 1
1 791 . 6 1 1 A 68 68 GLU CB C 422 27.302 29.821 -2.519 1
1 793 . 6 1 1 A 68 68 GLU N N 422 122.370 120.484 1.886 1
1 794 . 6 1 1 A 69 69 ILE H H 423 8.648 8.818 -0.170 1
1 795 . 6 1 1 A 69 69 ILE HA H 423 4.012 4.494 -0.482 1
1 805 . 6 1 1 A 69 69 ILE C C 423 174.257 175.618 -1.361 1
1 806 . 6 1 1 A 69 69 ILE CA C 423 59.740 60.620 -0.880 1
1 807 . 6 1 1 A 69 69 ILE CB C 423 35.846 39.237 -3.391 1
1 811 . 6 1 1 A 69 69 ILE N N 423 125.988 124.824 1.164 1
1 812 . 6 1 1 A 70 70 LYS H H 424 9.185 9.156 0.029 1
1 813 . 6 1 1 A 70 70 LYS HA H 424 4.434 4.386 0.048 1
1 822 . 6 1 1 A 70 70 LYS C C 424 173.880 176.497 -2.617 1
1 823 . 6 1 1 A 70 70 LYS CA C 424 53.378 57.431 -4.053 1
1 824 . 6 1 1 A 70 70 LYS CB C 424 30.397 33.826 -3.429 1
1 828 . 6 1 1 A 70 70 LYS N N 424 128.977 129.625 -0.648 1
1 829 . 6 1 1 A 71 71 GLY H H 425 7.810 7.663 0.147 1
1 830 . 6 1 1 A 71 71 GLY HA2 H 425 4.094 4.056 0.038 1
1 831 . 6 1 1 A 71 71 GLY HA3 H 425 4.159 4.059 0.100 1
1 832 . 6 1 1 A 71 71 GLY C C 425 168.179 172.510 -4.331 1
1 833 . 6 1 1 A 71 71 GLY CA C 425 42.326 45.038 -2.712 1
1 834 . 6 1 1 A 71 71 GLY N N 425 107.696 106.057 1.639 1
1 835 . 6 1 1 A 72 72 THR H H 426 8.048 8.725 -0.677 1
1 836 . 6 1 1 A 72 72 THR HA H 426 5.258 5.446 -0.188 1
1 841 . 6 1 1 A 72 72 THR C C 426 170.979 172.768 -1.789 1
1 842 . 6 1 1 A 72 72 THR CA C 426 56.755 60.321 -3.566 1
1 843 . 6 1 1 A 72 72 THR CB C 426 69.226 71.009 -1.783 1
1 845 . 6 1 1 A 72 72 THR N N 426 109.122 111.013 -1.891 1
1 846 . 6 1 1 A 73 73 GLU H H 427 8.912 9.396 -0.484 1
1 847 . 6 1 1 A 73 73 GLU HA H 427 4.954 4.907 0.047 1
1 852 . 6 1 1 A 73 73 GLU C C 427 170.353 174.862 -4.509 1
1 853 . 6 1 1 A 73 73 GLU CA C 427 50.182 52.965 -2.783 1
1 854 . 6 1 1 A 73 73 GLU CB C 427 30.559 33.216 -2.657 1
1 856 . 6 1 1 A 73 73 GLU N N 427 121.703 125.344 -3.641 1
1 1 . 6 1 1 A 74 74 PRO HA H 428 4.372 4.952 -0.580 1
1 2 . 6 1 1 A 74 74 PRO C C 428 173.839 175.410 -1.571 1
1 3 . 6 1 1 A 74 74 PRO CA C 428 60.241 62.457 -2.216 1
1 4 . 6 1 1 A 74 74 PRO CB C 428 29.299 32.395 -3.096 1
1 857 . 6 1 1 A 74 74 PRO HA H 428 4.782 4.952 -0.170 1
1 864 . 6 1 1 A 74 74 PRO C C 428 174.027 175.410 -1.383 1
1 865 . 6 1 1 A 74 74 PRO CA C 428 59.771 62.457 -2.686 1
1 866 . 6 1 1 A 74 74 PRO CB C 428 29.633 32.395 -2.762 1
1 7 . 6 1 1 A 75 75 ILE H H 429 8.144 8.095 0.049 1
1 8 . 6 1 1 A 75 75 ILE HA H 429 4.086 4.796 -0.710 1
1 15 . 6 1 1 A 75 75 ILE C C 429 173.426 175.103 -1.677 1
1 16 . 6 1 1 A 75 75 ILE CA C 429 58.339 60.173 -1.834 1
1 17 . 6 1 1 A 75 75 ILE CB C 429 35.988 39.622 -3.634 1
1 21 . 6 1 1 A 75 75 ILE N N 429 121.551 120.959 0.592 1
1 869 . 6 1 1 A 75 75 ILE H H 429 7.682 8.095 -0.413 1
1 870 . 6 1 1 A 75 75 ILE HA H 429 4.282 4.796 -0.514 1
1 880 . 6 1 1 A 75 75 ILE C C 429 172.510 175.103 -2.593 1
1 881 . 6 1 1 A 75 75 ILE CA C 429 57.456 60.173 -2.717 1
1 882 . 6 1 1 A 75 75 ILE CB C 429 37.903 39.622 -1.719 1
1 886 . 6 1 1 A 75 75 ILE N N 429 119.651 120.959 -1.308 1
1 1 . 6 1 1 A 76 76 VAL HA H 430 4.086 4.663 -0.577 1
1 2 . 6 1 1 A 76 76 VAL CA C 430 59.372 61.197 -1.825 1
1 22 . 6 1 1 A 76 76 VAL H H 430 8.221 8.786 -0.565 1
1 23 . 6 1 1 A 76 76 VAL HA H 430 4.083 4.663 -0.580 1
1 24 . 6 1 1 A 76 76 VAL C C 430 173.067 176.034 -2.967 1
1 25 . 6 1 1 A 76 76 VAL CA C 430 59.445 61.197 -1.752 1
1 26 . 6 1 1 A 76 76 VAL CB C 430 30.407 32.089 -1.682 1
1 27 . 6 1 1 A 76 76 VAL N N 430 125.930 125.743 0.187 1
1 887 . 6 1 1 A 76 76 VAL H H 430 8.122 8.786 -0.664 1
1 888 . 6 1 1 A 76 76 VAL HA H 430 4.197 4.663 -0.466 1
1 890 . 6 1 1 A 76 76 VAL C C 430 172.971 176.034 -3.063 1
1 891 . 6 1 1 A 76 76 VAL CA C 430 58.821 61.197 -2.376 1
1 892 . 6 1 1 A 76 76 VAL CB C 430 30.807 32.089 -1.282 1
1 895 . 6 1 1 A 76 76 VAL N N 430 124.178 125.743 -1.565 1
1 4 . 6 1 1 A 77 77 VAL H H 431 8.204 8.816 -0.612 1
1 5 . 6 1 1 A 77 77 VAL HA H 431 4.049 4.592 -0.543 1
1 6 . 6 1 1 A 77 77 VAL C C 431 172.636 174.810 -2.174 1
1 7 . 6 1 1 A 77 77 VAL CA C 431 59.315 60.764 -1.449 1
1 8 . 6 1 1 A 77 77 VAL CB C 431 30.219 33.347 -3.128 1
1 9 . 6 1 1 A 77 77 VAL N N 431 125.320 123.549 1.771 1
1 28 . 6 1 1 A 77 77 VAL H H 431 8.412 8.816 -0.404 1
1 29 . 6 1 1 A 77 77 VAL HA H 431 4.038 4.592 -0.554 1
1 37 . 6 1 1 A 77 77 VAL C C 431 172.617 174.810 -2.193 1
1 38 . 6 1 1 A 77 77 VAL CA C 431 59.137 60.764 -1.627 1
1 39 . 6 1 1 A 77 77 VAL CB C 431 30.292 33.347 -3.055 1
1 42 . 6 1 1 A 77 77 VAL N N 431 125.655 123.549 2.106 1
1 896 . 6 1 1 A 77 77 VAL H H 431 8.448 8.816 -0.368 1
1 897 . 6 1 1 A 77 77 VAL HA H 431 4.087 4.592 -0.505 1
1 905 . 6 1 1 A 77 77 VAL C C 431 172.493 174.810 -2.317 1
1 906 . 6 1 1 A 77 77 VAL CA C 431 59.185 60.764 -1.579 1
1 907 . 6 1 1 A 77 77 VAL CB C 431 30.084 33.347 -3.263 1
1 910 . 6 1 1 A 77 77 VAL N N 431 125.770 123.549 2.221 1
1 43 . 6 1 1 A 78 78 ASP H H 432 8.419 7.777 0.642 1
1 44 . 6 1 1 A 78 78 ASP HA H 432 4.829 5.024 -0.195 1
1 45 . 6 1 1 A 78 78 ASP C C 432 172.252 173.057 -0.805 1
1 46 . 6 1 1 A 78 78 ASP CA C 432 49.320 50.588 -1.268 1
1 47 . 6 1 1 A 78 78 ASP CB C 432 39.066 44.208 -5.142 1
1 48 . 6 1 1 A 78 78 ASP N N 432 126.226 121.193 5.033 1
1 911 . 6 1 1 A 78 78 ASP H H 432 8.493 7.777 0.716 1
1 912 . 6 1 1 A 78 78 ASP HA H 432 4.852 5.024 -0.172 1
1 915 . 6 1 1 A 78 78 ASP C C 432 172.048 173.057 -1.009 1
1 916 . 6 1 1 A 78 78 ASP CA C 432 49.233 50.588 -1.355 1
1 917 . 6 1 1 A 78 78 ASP CB C 432 38.858 44.208 -5.350 1
1 918 . 6 1 1 A 78 78 ASP N N 432 126.705 121.193 5.512 1
1 10 . 6 1 1 A 79 79 PRO CA C 433 63.865 62.301 1.564 1
1 49 . 6 1 1 A 79 79 PRO C C 433 173.867 176.394 -2.527 1
1 919 . 6 1 1 A 79 79 PRO HA H 433 4.237 4.660 -0.423 1
1 926 . 6 1 1 A 79 79 PRO C C 433 173.812 176.394 -2.582 1
1 927 . 6 1 1 A 79 79 PRO CA C 433 60.627 62.301 -1.674 1
1 928 . 6 1 1 A 79 79 PRO CB C 433 29.329 29.755 -0.426 1
1 11 . 6 1 1 A 80 80 PHE H H 434 8.182 8.666 -0.484 1
1 12 . 6 1 1 A 80 80 PHE HA H 434 4.499 4.445 0.054 1
1 13 . 6 1 1 A 80 80 PHE C C 434 171.680 176.194 -4.514 1
1 14 . 6 1 1 A 80 80 PHE CA C 434 54.657 60.340 -5.683 1
1 15 . 6 1 1 A 80 80 PHE CB C 434 36.272 39.844 -3.572 1
1 16 . 6 1 1 A 80 80 PHE N N 434 118.611 122.297 -3.686 1
1 50 . 6 1 1 A 80 80 PHE H H 434 8.191 8.666 -0.475 1
1 51 . 6 1 1 A 80 80 PHE HA H 434 4.528 4.445 0.083 1
1 54 . 6 1 1 A 80 80 PHE C C 434 172.457 176.194 -3.737 1
1 55 . 6 1 1 A 80 80 PHE CA C 434 54.828 60.340 -5.512 1
1 56 . 6 1 1 A 80 80 PHE CB C 434 36.457 39.844 -3.387 1
1 57 . 6 1 1 A 80 80 PHE N N 434 118.871 122.297 -3.426 1
1 931 . 6 1 1 A 80 80 PHE H H 434 8.191 8.666 -0.475 1
1 932 . 6 1 1 A 80 80 PHE HA H 434 4.463 4.445 0.018 1
1 939 . 6 1 1 A 80 80 PHE C C 434 172.283 176.194 -3.911 1
1 940 . 6 1 1 A 80 80 PHE CA C 434 54.971 60.340 -5.369 1
1 941 . 6 1 1 A 80 80 PHE CB C 434 36.490 39.844 -3.354 1
1 944 . 6 1 1 A 80 80 PHE N N 434 119.263 122.297 -3.034 1
1 17 . 6 1 1 A 81 81 ASP H H 435 7.490 8.132 -0.642 1
1 18 . 6 1 1 A 81 81 ASP HA H 435 4.698 5.029 -0.331 1
1 19 . 6 1 1 A 81 81 ASP C C 435 171.662 174.498 -2.836 1
1 20 . 6 1 1 A 81 81 ASP CA C 435 49.570 51.315 -1.745 1
1 21 . 6 1 1 A 81 81 ASP CB C 435 40.104 41.455 -1.351 1
1 22 . 6 1 1 A 81 81 ASP N N 435 120.304 117.531 2.773 1
1 58 . 6 1 1 A 81 81 ASP H H 435 7.881 8.132 -0.251 1
1 59 . 6 1 1 A 81 81 ASP HA H 435 4.801 5.029 -0.228 1
1 60 . 6 1 1 A 81 81 ASP C C 435 171.144 174.498 -3.354 1
1 61 . 6 1 1 A 81 81 ASP CA C 435 49.406 51.315 -1.909 1
1 62 . 6 1 1 A 81 81 ASP CB C 435 38.618 41.455 -2.837 1
1 63 . 6 1 1 A 81 81 ASP N N 435 123.108 117.531 5.577 1
1 945 . 6 1 1 A 81 81 ASP H H 435 7.823 8.132 -0.309 1
1 946 . 6 1 1 A 81 81 ASP HA H 435 4.759 5.029 -0.270 1
1 949 . 6 1 1 A 81 81 ASP C C 435 171.057 174.498 -3.441 1
1 950 . 6 1 1 A 81 81 ASP CA C 435 49.174 51.315 -2.141 1
1 951 . 6 1 1 A 81 81 ASP CB C 435 38.725 41.455 -2.730 1
1 952 . 6 1 1 A 81 81 ASP N N 435 123.530 117.531 5.999 1
1 23 . 6 1 1 A 82 82 PRO HA H 436 4.758 4.650 0.108 1
1 24 . 6 1 1 A 82 82 PRO C C 436 172.944 175.863 -2.919 1
1 25 . 6 1 1 A 82 82 PRO CA C 436 60.134 63.958 -3.824 1
1 26 . 6 1 1 A 82 82 PRO CB C 436 31.425 32.844 -1.419 1
1 64 . 6 1 1 A 82 82 PRO HA H 436 4.364 4.650 -0.286 1
1 67 . 6 1 1 A 82 82 PRO C C 436 173.563 175.863 -2.300 1
1 68 . 6 1 1 A 82 82 PRO CA C 436 60.729 63.958 -3.229 1
1 69 . 6 1 1 A 82 82 PRO CB C 436 29.160 32.844 -3.684 1
1 953 . 6 1 1 A 82 82 PRO HA H 436 4.296 4.650 -0.354 1
1 960 . 6 1 1 A 82 82 PRO C C 436 173.494 175.863 -2.369 1
1 961 . 6 1 1 A 82 82 PRO CA C 436 60.625 63.958 -3.333 1
1 962 . 6 1 1 A 82 82 PRO CB C 436 29.237 32.844 -3.607 1
1 1 . 7 1 1 A 3 3 LEU HA H 357 4.257 4.347 -0.090 1
1 11 . 7 1 1 A 3 3 LEU C C 357 174.994 178.131 -3.137 1
1 12 . 7 1 1 A 3 3 LEU CA C 357 53.329 56.180 -2.851 1
1 13 . 7 1 1 A 3 3 LEU CB C 357 39.382 43.049 -3.667 1
1 17 . 7 1 1 A 4 4 GLN H H 358 8.234 7.627 0.607 1
1 18 . 7 1 1 A 4 4 GLN HA H 358 4.211 4.031 0.180 1
1 25 . 7 1 1 A 4 4 GLN C C 358 173.357 175.162 -1.805 1
1 26 . 7 1 1 A 4 4 GLN CA C 358 53.791 57.560 -3.769 1
1 27 . 7 1 1 A 4 4 GLN CB C 358 26.456 29.712 -3.256 1
1 29 . 7 1 1 A 4 4 GLN N N 358 119.506 117.555 1.951 1
1 31 . 7 1 1 A 5 5 ASP H H 359 8.090 7.781 0.309 1
1 32 . 7 1 1 A 5 5 ASP HA H 359 4.458 4.934 -0.476 1
1 35 . 7 1 1 A 5 5 ASP C C 359 173.492 175.282 -1.790 1
1 36 . 7 1 1 A 5 5 ASP CA C 359 52.309 52.621 -0.312 1
1 37 . 7 1 1 A 5 5 ASP CB C 359 38.312 43.834 -5.522 1
1 38 . 7 1 1 A 5 5 ASP N N 359 120.683 114.691 5.992 1
1 39 . 7 1 1 A 6 6 HIS H H 360 8.103 8.377 -0.274 1
1 40 . 7 1 1 A 6 6 HIS HA H 360 4.540 5.014 -0.474 1
1 45 . 7 1 1 A 6 6 HIS C C 360 172.801 174.845 -2.044 1
1 46 . 7 1 1 A 6 6 HIS CA C 360 53.874 54.960 -1.086 1
1 47 . 7 1 1 A 6 6 HIS CB C 360 27.878 31.823 -3.945 1
1 50 . 7 1 1 A 6 6 HIS N N 360 118.844 116.037 2.807 1
1 51 . 7 1 1 A 7 7 ILE H H 361 7.862 7.919 -0.057 1
1 52 . 7 1 1 A 7 7 ILE HA H 361 4.010 4.403 -0.393 1
1 62 . 7 1 1 A 7 7 ILE C C 361 173.268 175.013 -1.745 1
1 63 . 7 1 1 A 7 7 ILE CA C 361 58.740 62.494 -3.754 1
1 64 . 7 1 1 A 7 7 ILE CB C 361 35.788 40.769 -4.981 1
1 68 . 7 1 1 A 7 7 ILE N N 361 121.598 119.307 2.291 1
1 69 . 7 1 1 A 8 8 LYS H H 362 8.231 7.722 0.509 1
1 70 . 7 1 1 A 8 8 LYS HA H 362 4.313 4.851 -0.538 1
1 79 . 7 1 1 A 8 8 LYS C C 362 173.899 174.283 -0.384 1
1 80 . 7 1 1 A 8 8 LYS CA C 362 53.677 54.859 -1.182 1
1 81 . 7 1 1 A 8 8 LYS CB C 362 30.355 36.164 -5.809 1
1 85 . 7 1 1 A 8 8 LYS N N 362 124.980 117.353 7.627 1
1 86 . 7 1 1 A 9 9 VAL H H 363 8.044 8.474 -0.430 1
1 87 . 7 1 1 A 9 9 VAL HA H 363 4.089 4.485 -0.396 1
1 95 . 7 1 1 A 9 9 VAL C C 363 173.760 173.368 0.392 1
1 96 . 7 1 1 A 9 9 VAL CA C 363 59.814 60.378 -0.564 1
1 97 . 7 1 1 A 9 9 VAL CB C 363 30.058 34.715 -4.657 1
1 100 . 7 1 1 A 9 9 VAL N N 363 121.366 119.347 2.019 1
1 101 . 7 1 1 A 10 10 THR H H 364 8.076 8.654 -0.578 1
1 102 . 7 1 1 A 10 10 THR HA H 364 4.302 5.083 -0.781 1
1 107 . 7 1 1 A 10 10 THR C C 364 172.135 175.222 -3.087 1
1 108 . 7 1 1 A 10 10 THR CA C 364 59.134 60.523 -1.389 1
1 109 . 7 1 1 A 10 10 THR CB C 364 67.415 70.475 -3.060 1
1 111 . 7 1 1 A 10 10 THR N N 364 116.817 118.111 -1.294 1
1 112 . 7 1 1 A 11 11 GLN H H 365 8.463 8.801 -0.338 1
1 113 . 7 1 1 A 11 11 GLN HA H 365 4.046 3.931 0.115 1
1 120 . 7 1 1 A 11 11 GLN C C 365 173.944 177.621 -3.677 1
1 121 . 7 1 1 A 11 11 GLN CA C 365 54.517 59.379 -4.862 1
1 122 . 7 1 1 A 11 11 GLN CB C 365 26.250 28.671 -2.421 1
1 124 . 7 1 1 A 11 11 GLN N N 365 122.059 123.973 -1.914 1
1 126 . 7 1 1 A 12 12 GLU H H 366 8.449 8.524 -0.075 1
1 127 . 7 1 1 A 12 12 GLU HA H 366 4.093 4.144 -0.051 1
1 132 . 7 1 1 A 12 12 GLU C C 366 174.746 179.067 -4.321 1
1 133 . 7 1 1 A 12 12 GLU CA C 366 55.235 58.942 -3.707 1
1 134 . 7 1 1 A 12 12 GLU CB C 366 27.180 29.395 -2.215 1
1 136 . 7 1 1 A 12 12 GLU N N 366 120.415 118.058 2.357 1
1 137 . 7 1 1 A 13 13 GLN H H 367 8.031 7.825 0.206 1
1 138 . 7 1 1 A 13 13 GLN HA H 367 4.113 4.101 0.012 1
1 145 . 7 1 1 A 13 13 GLN C C 367 173.693 177.234 -3.541 1
1 146 . 7 1 1 A 13 13 GLN CA C 367 54.132 58.149 -4.017 1
1 147 . 7 1 1 A 13 13 GLN CB C 367 26.420 29.518 -3.098 1
1 149 . 7 1 1 A 13 13 GLN N N 367 119.721 117.031 2.690 1
1 151 . 7 1 1 A 14 14 TYR H H 368 8.111 7.953 0.158 1
1 152 . 7 1 1 A 14 14 TYR HA H 368 4.339 4.673 -0.334 1
1 159 . 7 1 1 A 14 14 TYR C C 368 173.916 176.650 -2.734 1
1 160 . 7 1 1 A 14 14 TYR CA C 368 56.572 58.674 -2.102 1
1 161 . 7 1 1 A 14 14 TYR CB C 368 35.879 37.764 -1.885 1
1 164 . 7 1 1 A 14 14 TYR N N 368 120.541 118.025 2.516 1
1 165 . 7 1 1 A 15 15 GLU H H 369 8.287 8.249 0.038 1
1 166 . 7 1 1 A 15 15 GLU HA H 369 4.009 4.316 -0.307 1
1 171 . 7 1 1 A 15 15 GLU C C 369 174.448 178.212 -3.764 1
1 172 . 7 1 1 A 15 15 GLU CA C 369 55.047 59.034 -3.987 1
1 173 . 7 1 1 A 15 15 GLU CB C 369 27.226 29.666 -2.440 1
1 175 . 7 1 1 A 15 15 GLU N N 369 120.398 122.451 -2.053 1
1 176 . 7 1 1 A 16 16 LEU H H 370 7.785 7.478 0.307 1
1 177 . 7 1 1 A 16 16 LEU HA H 370 4.138 4.331 -0.193 1
1 187 . 7 1 1 A 16 16 LEU C C 370 175.089 177.633 -2.544 1
1 188 . 7 1 1 A 16 16 LEU CA C 370 53.425 54.417 -0.992 1
1 189 . 7 1 1 A 16 16 LEU CB C 370 39.554 41.507 -1.953 1
1 193 . 7 1 1 A 16 16 LEU N N 370 121.323 117.076 4.247 1
1 194 . 7 1 1 A 17 17 TYR H H 371 8.038 7.833 0.205 1
1 195 . 7 1 1 A 17 17 TYR HA H 371 4.380 4.387 -0.007 1
1 202 . 7 1 1 A 17 17 TYR C C 371 173.931 175.763 -1.832 1
1 203 . 7 1 1 A 17 17 TYR CA C 371 56.143 61.146 -5.003 1
1 204 . 7 1 1 A 17 17 TYR CB C 371 35.501 37.885 -2.384 1
1 207 . 7 1 1 A 17 17 TYR N N 371 119.465 119.871 -0.406 1
1 208 . 7 1 1 A 18 18 CYS H H 372 8.021 7.369 0.652 1
1 209 . 7 1 1 A 18 18 CYS HA H 372 4.236 4.022 0.214 1
1 212 . 7 1 1 A 18 18 CYS C C 372 172.457 174.650 -2.193 1
1 213 . 7 1 1 A 18 18 CYS CA C 372 56.997 59.810 -2.813 1
1 214 . 7 1 1 A 18 18 CYS CB C 372 25.080 26.660 -1.580 1
1 215 . 7 1 1 A 18 18 CYS N N 372 119.913 114.873 5.040 1
1 216 . 7 1 1 A 19 19 GLU H H 373 8.151 8.495 -0.344 1
1 217 . 7 1 1 A 19 19 GLU HA H 373 4.130 4.608 -0.478 1
1 222 . 7 1 1 A 19 19 GLU C C 373 174.151 176.523 -2.372 1
1 223 . 7 1 1 A 19 19 GLU CA C 373 54.535 55.759 -1.224 1
1 224 . 7 1 1 A 19 19 GLU CB C 373 27.244 29.920 -2.676 1
1 226 . 7 1 1 A 19 19 GLU N N 373 122.431 122.066 0.365 1
1 227 . 7 1 1 A 20 20 MET H H 374 8.109 7.664 0.445 1
1 228 . 7 1 1 A 20 20 MET HA H 374 4.352 4.435 -0.083 1
1 236 . 7 1 1 A 20 20 MET C C 374 174.200 176.226 -2.026 1
1 237 . 7 1 1 A 20 20 MET CA C 374 53.238 56.108 -2.870 1
1 238 . 7 1 1 A 20 20 MET CB C 374 30.237 33.807 -3.570 1
1 241 . 7 1 1 A 20 20 MET N N 374 119.754 120.393 -0.639 1
1 242 . 7 1 1 A 21 21 GLY H H 375 8.231 8.632 -0.401 1
1 243 . 7 1 1 A 21 21 GLY HA2 H 375 3.861 4.138 -0.277 1
1 244 . 7 1 1 A 21 21 GLY HA3 H 375 3.960 4.148 -0.188 1
1 245 . 7 1 1 A 21 21 GLY C C 375 171.928 173.629 -1.701 1
1 246 . 7 1 1 A 21 21 GLY CA C 375 42.930 44.288 -1.358 1
1 247 . 7 1 1 A 21 21 GLY N N 375 109.484 109.296 0.188 1
1 248 . 7 1 1 A 22 22 SER HA H 376 4.492 4.768 -0.276 1
1 251 . 7 1 1 A 22 22 SER C C 376 172.206 173.757 -1.551 1
1 252 . 7 1 1 A 22 22 SER CA C 376 55.570 57.685 -2.115 1
1 253 . 7 1 1 A 22 22 SER CB C 376 61.525 62.512 -0.987 1
1 254 . 7 1 1 A 23 23 THR H H 377 8.470 8.456 0.014 1
1 255 . 7 1 1 A 23 23 THR HA H 377 4.295 4.351 -0.056 1
1 260 . 7 1 1 A 23 23 THR C C 377 171.811 174.831 -3.020 1
1 261 . 7 1 1 A 23 23 THR CA C 377 58.937 62.655 -3.718 1
1 262 . 7 1 1 A 23 23 THR CB C 377 67.250 67.489 -0.239 1
1 264 . 7 1 1 A 23 23 THR N N 377 124.043 121.411 2.632 1
1 265 . 7 1 1 A 24 24 PHE H H 378 8.374 8.868 -0.494 1
1 266 . 7 1 1 A 24 24 PHE HA H 378 4.239 4.607 -0.368 1
1 273 . 7 1 1 A 24 24 PHE C C 378 173.411 177.384 -3.973 1
1 274 . 7 1 1 A 24 24 PHE CA C 378 56.697 59.613 -2.916 1
1 275 . 7 1 1 A 24 24 PHE CB C 378 36.538 40.343 -3.805 1
1 278 . 7 1 1 A 24 24 PHE N N 378 124.732 128.120 -3.388 1
1 279 . 7 1 1 A 25 25 GLN H H 379 8.457 8.222 0.235 1
1 280 . 7 1 1 A 25 25 GLN HA H 379 4.038 4.086 -0.048 1
1 287 . 7 1 1 A 25 25 GLN C C 379 172.431 176.320 -3.889 1
1 288 . 7 1 1 A 25 25 GLN CA C 379 54.078 57.986 -3.908 1
1 289 . 7 1 1 A 25 25 GLN CB C 379 26.414 28.681 -2.267 1
1 291 . 7 1 1 A 25 25 GLN N N 379 118.820 118.390 0.430 1
1 293 . 7 1 1 A 26 26 LEU H H 380 6.985 7.363 -0.378 1
1 294 . 7 1 1 A 26 26 LEU HA H 380 4.229 4.280 -0.051 1
1 304 . 7 1 1 A 26 26 LEU C C 380 173.895 176.069 -2.174 1
1 305 . 7 1 1 A 26 26 LEU CA C 380 52.123 54.404 -2.281 1
1 306 . 7 1 1 A 26 26 LEU CB C 380 40.543 42.507 -1.964 1
1 310 . 7 1 1 A 26 26 LEU N N 380 119.079 121.649 -2.570 1
1 311 . 7 1 1 A 27 27 CYS H H 381 8.905 9.273 -0.368 1
1 312 . 7 1 1 A 27 27 CYS HA H 381 4.013 4.317 -0.304 1
1 315 . 7 1 1 A 27 27 CYS C C 381 174.439 176.233 -1.794 1
1 316 . 7 1 1 A 27 27 CYS CA C 381 57.847 59.958 -2.111 1
1 317 . 7 1 1 A 27 27 CYS CB C 381 28.648 28.808 -0.160 1
1 318 . 7 1 1 A 27 27 CYS N N 381 125.151 122.066 3.085 1
1 319 . 7 1 1 A 28 28 LYS H H 382 9.351 8.787 0.564 1
1 320 . 7 1 1 A 28 28 LYS HA H 382 4.157 3.975 0.182 1
1 329 . 7 1 1 A 28 28 LYS C C 382 174.678 178.327 -3.649 1
1 330 . 7 1 1 A 28 28 LYS CA C 382 54.324 58.806 -4.482 1
1 331 . 7 1 1 A 28 28 LYS CB C 382 30.086 32.649 -2.563 1
1 335 . 7 1 1 A 28 28 LYS N N 382 128.840 128.125 0.715 1
1 336 . 7 1 1 A 29 29 ILE H H 383 9.040 7.884 1.156 1
1 337 . 7 1 1 A 29 29 ILE HA H 383 3.804 3.569 0.235 1
1 347 . 7 1 1 A 29 29 ILE C C 383 174.239 177.329 -3.090 1
1 348 . 7 1 1 A 29 29 ILE CA C 383 62.114 64.913 -2.799 1
1 349 . 7 1 1 A 29 29 ILE CB C 383 33.870 38.401 -4.531 1
1 353 . 7 1 1 A 29 29 ILE N N 383 122.718 119.366 3.352 1
1 354 . 7 1 1 A 30 30 CYS H H 384 7.572 7.743 -0.171 1
1 355 . 7 1 1 A 30 30 CYS HA H 384 4.548 4.469 0.079 1
1 358 . 7 1 1 A 30 30 CYS C C 384 172.978 175.156 -2.178 1
1 359 . 7 1 1 A 30 30 CYS CA C 384 54.957 59.776 -4.819 1
1 360 . 7 1 1 A 30 30 CYS CB C 384 29.778 29.739 0.039 1
1 361 . 7 1 1 A 30 30 CYS N N 384 116.356 114.884 1.472 1
1 362 . 7 1 1 A 31 31 ALA H H 385 8.205 8.225 -0.020 1
1 363 . 7 1 1 A 31 31 ALA HA H 385 4.107 4.257 -0.150 1
1 367 . 7 1 1 A 31 31 ALA C C 385 173.139 177.134 -3.995 1
1 368 . 7 1 1 A 31 31 ALA CA C 385 50.802 53.437 -2.635 1
1 369 . 7 1 1 A 31 31 ALA CB C 385 14.634 17.836 -3.202 1
1 370 . 7 1 1 A 31 31 ALA N N 385 125.526 120.873 4.653 1
1 371 . 7 1 1 A 32 32 GLU H H 386 8.416 8.171 0.245 1
1 372 . 7 1 1 A 32 32 GLU HA H 386 4.467 4.403 0.064 1
1 377 . 7 1 1 A 32 32 GLU C C 386 172.325 176.230 -3.905 1
1 378 . 7 1 1 A 32 32 GLU CA C 386 55.146 57.565 -2.419 1
1 379 . 7 1 1 A 32 32 GLU CB C 386 31.181 31.239 -0.058 1
1 381 . 7 1 1 A 32 32 GLU N N 386 117.579 115.396 2.183 1
1 382 . 7 1 1 A 33 33 ASN H H 387 7.872 7.368 0.504 1
1 383 . 7 1 1 A 33 33 ASN HA H 387 4.900 5.146 -0.246 1
1 388 . 7 1 1 A 33 33 ASN C C 387 171.355 174.457 -3.102 1
1 389 . 7 1 1 A 33 33 ASN CA C 387 49.320 51.958 -2.638 1
1 390 . 7 1 1 A 33 33 ASN CB C 387 38.457 41.141 -2.684 1
1 391 . 7 1 1 A 33 33 ASN N N 387 120.399 116.250 4.149 1
1 393 . 7 1 1 A 34 34 ASP H H 388 8.565 8.546 0.019 1
1 394 . 7 1 1 A 34 34 ASP HA H 388 4.679 4.846 -0.167 1
1 397 . 7 1 1 A 34 34 ASP C C 388 174.243 176.218 -1.975 1
1 398 . 7 1 1 A 34 34 ASP CA C 388 51.809 53.774 -1.965 1
1 399 . 7 1 1 A 34 34 ASP CB C 388 38.007 42.147 -4.140 1
1 400 . 7 1 1 A 34 34 ASP N N 388 120.661 119.470 1.191 1
1 401 . 7 1 1 A 35 35 LYS H H 389 8.544 9.191 -0.647 1
1 402 . 7 1 1 A 35 35 LYS HA H 389 3.411 4.358 -0.947 1
1 409 . 7 1 1 A 35 35 LYS C C 389 172.938 176.837 -3.899 1
1 410 . 7 1 1 A 35 35 LYS CA C 389 54.973 55.254 -0.281 1
1 411 . 7 1 1 A 35 35 LYS CB C 389 30.617 30.916 -0.299 1
1 415 . 7 1 1 A 35 35 LYS N N 389 119.199 120.712 -1.513 1
1 416 . 7 1 1 A 36 36 ASP H H 390 8.327 8.374 -0.047 1
1 417 . 7 1 1 A 36 36 ASP HA H 390 4.724 4.758 -0.034 1
1 420 . 7 1 1 A 36 36 ASP C C 390 172.860 175.444 -2.584 1
1 421 . 7 1 1 A 36 36 ASP CA C 390 51.609 54.122 -2.513 1
1 422 . 7 1 1 A 36 36 ASP CB C 390 39.018 41.676 -2.658 1
1 423 . 7 1 1 A 36 36 ASP N N 390 119.134 122.593 -3.459 1
1 424 . 7 1 1 A 37 37 VAL H H 391 8.544 7.874 0.670 1
1 425 . 7 1 1 A 37 37 VAL HA H 391 4.877 4.695 0.182 1
1 433 . 7 1 1 A 37 37 VAL C C 391 167.519 173.329 -5.810 1
1 434 . 7 1 1 A 37 37 VAL CA C 391 58.259 59.923 -1.664 1
1 435 . 7 1 1 A 37 37 VAL CB C 391 32.277 35.002 -2.725 1
1 438 . 7 1 1 A 37 37 VAL N N 391 121.970 118.986 2.984 1
1 439 . 7 1 1 A 38 38 LYS H H 392 8.621 9.516 -0.895 1
1 440 . 7 1 1 A 38 38 LYS HA H 392 4.991 5.457 -0.466 1
1 449 . 7 1 1 A 38 38 LYS C C 392 172.681 175.267 -2.586 1
1 450 . 7 1 1 A 38 38 LYS CA C 392 51.123 54.698 -3.575 1
1 451 . 7 1 1 A 38 38 LYS CB C 392 33.697 34.714 -1.017 1
1 455 . 7 1 1 A 38 38 LYS N N 392 126.381 129.099 -2.718 1
1 456 . 7 1 1 A 39 39 ILE H H 393 8.723 9.060 -0.337 1
1 457 . 7 1 1 A 39 39 ILE HA H 393 4.239 4.360 -0.121 1
1 467 . 7 1 1 A 39 39 ILE C C 393 172.642 175.698 -3.056 1
1 468 . 7 1 1 A 39 39 ILE CA C 393 57.768 61.008 -3.240 1
1 469 . 7 1 1 A 39 39 ILE CB C 393 35.691 37.613 -1.922 1
1 473 . 7 1 1 A 39 39 ILE N N 393 126.398 127.705 -1.307 1
1 474 . 7 1 1 A 40 40 GLU H H 394 8.506 9.422 -0.916 1
1 475 . 7 1 1 A 40 40 GLU HA H 394 4.753 4.658 0.095 1
1 480 . 7 1 1 A 40 40 GLU C C 394 173.596 176.332 -2.736 1
1 481 . 7 1 1 A 40 40 GLU CA C 394 49.793 53.491 -3.698 1
1 482 . 7 1 1 A 40 40 GLU CB C 394 28.210 30.073 -1.863 1
1 484 . 7 1 1 A 40 40 GLU N N 394 124.864 127.977 -3.113 1
1 485 . 7 1 1 A 41 41 PRO HA H 395 4.864 4.494 0.370 1
1 492 . 7 1 1 A 41 41 PRO C C 395 175.073 176.880 -1.807 1
1 493 . 7 1 1 A 41 41 PRO CA C 395 61.111 63.879 -2.768 1
1 494 . 7 1 1 A 41 41 PRO CB C 395 32.275 32.958 -0.683 1
1 497 . 7 1 1 A 42 42 CYS H H 396 7.828 7.716 0.112 1
1 498 . 7 1 1 A 42 42 CYS HA H 396 4.208 4.063 0.145 1
1 501 . 7 1 1 A 42 42 CYS C C 396 173.877 175.463 -1.586 1
1 502 . 7 1 1 A 42 42 CYS CA C 396 58.021 60.951 -2.930 1
1 503 . 7 1 1 A 42 42 CYS CB C 396 28.242 27.410 0.832 1
1 504 . 7 1 1 A 42 42 CYS N N 396 122.434 118.315 4.119 1
1 505 . 7 1 1 A 43 43 GLY H H 397 8.679 8.639 0.040 1
1 506 . 7 1 1 A 43 43 GLY HA2 H 397 3.507 3.921 -0.414 1
1 507 . 7 1 1 A 43 43 GLY HA3 H 397 3.914 3.924 -0.010 1
1 508 . 7 1 1 A 43 43 GLY C C 397 171.981 175.083 -3.102 1
1 509 . 7 1 1 A 43 43 GLY CA C 397 43.347 46.255 -2.908 1
1 510 . 7 1 1 A 43 43 GLY N N 397 112.123 108.227 3.896 1
1 511 . 7 1 1 A 44 44 HIS H H 398 8.329 7.443 0.886 1
1 512 . 7 1 1 A 44 44 HIS HA H 398 4.339 4.416 -0.077 1
1 517 . 7 1 1 A 44 44 HIS C C 398 170.742 174.809 -4.067 1
1 518 . 7 1 1 A 44 44 HIS CA C 398 58.368 56.436 1.932 1
1 519 . 7 1 1 A 44 44 HIS CB C 398 28.434 30.614 -2.180 1
1 522 . 7 1 1 A 44 44 HIS N N 398 121.393 117.522 3.871 1
1 523 . 7 1 1 A 45 45 LEU H H 399 8.241 8.756 -0.515 1
1 524 . 7 1 1 A 45 45 LEU HA H 399 5.570 5.249 0.321 1
1 534 . 7 1 1 A 45 45 LEU C C 399 174.464 175.726 -1.262 1
1 535 . 7 1 1 A 45 45 LEU CA C 399 50.729 53.486 -2.757 1
1 536 . 7 1 1 A 45 45 LEU CB C 399 43.574 44.795 -1.221 1
1 540 . 7 1 1 A 45 45 LEU N N 399 118.469 122.908 -4.439 1
1 541 . 7 1 1 A 46 46 MET H H 400 8.707 8.680 0.027 1
1 542 . 7 1 1 A 46 46 MET HA H 400 4.842 4.968 -0.126 1
1 550 . 7 1 1 A 46 46 MET C C 400 170.736 174.070 -3.334 1
1 551 . 7 1 1 A 46 46 MET CA C 400 52.804 54.356 -1.552 1
1 552 . 7 1 1 A 46 46 MET CB C 400 31.945 34.996 -3.051 1
1 555 . 7 1 1 A 46 46 MET N N 400 114.897 120.128 -5.231 1
1 556 . 7 1 1 A 47 47 CYS H H 401 9.436 8.270 1.166 1
1 557 . 7 1 1 A 47 47 CYS HA H 401 5.629 5.309 0.320 1
1 560 . 7 1 1 A 47 47 CYS C C 401 173.909 176.133 -2.224 1
1 561 . 7 1 1 A 47 47 CYS CA C 401 54.325 56.920 -2.595 1
1 562 . 7 1 1 A 47 47 CYS CB C 401 30.725 29.687 1.038 1
1 563 . 7 1 1 A 47 47 CYS N N 401 119.575 119.182 0.393 1
1 564 . 7 1 1 A 48 48 THR H H 402 9.842 9.385 0.457 1
1 565 . 7 1 1 A 48 48 THR HA H 402 3.768 4.003 -0.235 1
1 570 . 7 1 1 A 48 48 THR C C 402 174.333 176.266 -1.933 1
1 571 . 7 1 1 A 48 48 THR CA C 402 64.516 66.021 -1.505 1
1 572 . 7 1 1 A 48 48 THR CB C 402 66.288 68.713 -2.425 1
1 574 . 7 1 1 A 48 48 THR N N 402 119.945 119.145 0.800 1
1 575 . 7 1 1 A 49 49 SER H H 403 8.355 8.045 0.310 1
1 576 . 7 1 1 A 49 49 SER HA H 403 4.222 4.068 0.154 1
1 579 . 7 1 1 A 49 49 SER C C 403 175.059 177.067 -2.008 1
1 580 . 7 1 1 A 49 49 SER CA C 403 59.828 61.961 -2.133 1
1 581 . 7 1 1 A 49 49 SER CB C 403 59.717 62.728 -3.011 1
1 582 . 7 1 1 A 49 49 SER N N 403 120.468 117.406 3.062 1
1 583 . 7 1 1 A 50 50 CYS H H 404 9.464 7.812 1.652 1
1 584 . 7 1 1 A 50 50 CYS HA H 404 3.922 4.127 -0.205 1
1 587 . 7 1 1 A 50 50 CYS C C 404 176.081 177.103 -1.022 1
1 588 . 7 1 1 A 50 50 CYS CA C 404 63.076 64.182 -1.106 1
1 589 . 7 1 1 A 50 50 CYS CB C 404 26.078 27.730 -1.652 1
1 590 . 7 1 1 A 50 50 CYS N N 404 126.744 119.717 7.027 1
1 591 . 7 1 1 A 51 51 LEU H H 405 7.948 8.115 -0.167 1
1 592 . 7 1 1 A 51 51 LEU HA H 405 4.064 4.171 -0.107 1
1 602 . 7 1 1 A 51 51 LEU C C 405 175.495 178.801 -3.306 1
1 603 . 7 1 1 A 51 51 LEU CA C 405 55.914 58.048 -2.134 1
1 604 . 7 1 1 A 51 51 LEU CB C 405 38.662 41.800 -3.138 1
1 607 . 7 1 1 A 51 51 LEU N N 405 121.951 122.544 -0.593 1
1 608 . 7 1 1 A 52 52 THR H H 406 8.786 8.612 0.174 1
1 609 . 7 1 1 A 52 52 THR HA H 406 4.024 3.946 0.078 1
1 614 . 7 1 1 A 52 52 THR C C 406 174.139 176.241 -2.102 1
1 615 . 7 1 1 A 52 52 THR CA C 406 64.017 66.382 -2.365 1
1 616 . 7 1 1 A 52 52 THR CB C 406 66.115 68.803 -2.688 1
1 618 . 7 1 1 A 52 52 THR N N 406 115.258 115.114 0.144 1
1 619 . 7 1 1 A 53 53 SER H H 407 8.115 8.130 -0.015 1
1 620 . 7 1 1 A 53 53 SER HA H 407 4.204 4.117 0.087 1
1 623 . 7 1 1 A 53 53 SER C C 407 174.456 176.930 -2.474 1
1 624 . 7 1 1 A 53 53 SER CA C 407 59.090 61.217 -2.127 1
1 625 . 7 1 1 A 53 53 SER CB C 407 60.146 63.105 -2.959 1
1 626 . 7 1 1 A 53 53 SER N N 407 116.852 115.079 1.773 1
1 627 . 7 1 1 A 54 54 TRP H H 408 8.123 8.458 -0.335 1
1 628 . 7 1 1 A 54 54 TRP HA H 408 4.371 4.229 0.142 1
1 637 . 7 1 1 A 54 54 TRP C C 408 175.981 178.609 -2.628 1
1 638 . 7 1 1 A 54 54 TRP CA C 408 57.323 61.227 -3.904 1
1 639 . 7 1 1 A 54 54 TRP CB C 408 26.812 29.594 -2.782 1
1 645 . 7 1 1 A 54 54 TRP N N 408 123.556 123.762 -0.206 1
1 647 . 7 1 1 A 55 55 GLN H H 409 8.502 8.363 0.139 1
1 648 . 7 1 1 A 55 55 GLN HA H 409 3.999 3.749 0.250 1
1 655 . 7 1 1 A 55 55 GLN C C 409 177.300 178.135 -0.835 1
1 656 . 7 1 1 A 55 55 GLN CA C 409 56.484 58.894 -2.410 1
1 657 . 7 1 1 A 55 55 GLN CB C 409 26.190 28.047 -1.857 1
1 659 . 7 1 1 A 55 55 GLN N N 409 118.044 118.609 -0.565 1
1 661 . 7 1 1 A 56 56 GLU H H 410 8.467 8.114 0.353 1
1 662 . 7 1 1 A 56 56 GLU HA H 410 4.057 4.101 -0.044 1
1 667 . 7 1 1 A 56 56 GLU C C 410 174.787 178.056 -3.269 1
1 668 . 7 1 1 A 56 56 GLU CA C 410 55.909 58.745 -2.836 1
1 669 . 7 1 1 A 56 56 GLU CB C 410 26.895 29.483 -2.588 1
1 671 . 7 1 1 A 56 56 GLU N N 410 119.448 119.596 -0.148 1
1 672 . 7 1 1 A 57 57 SER H H 411 7.438 7.529 -0.091 1
1 673 . 7 1 1 A 57 57 SER HA H 411 4.607 4.507 0.100 1
1 676 . 7 1 1 A 57 57 SER C C 411 170.849 173.512 -2.663 1
1 677 . 7 1 1 A 57 57 SER CA C 411 55.540 58.075 -2.535 1
1 678 . 7 1 1 A 57 57 SER CB C 411 60.928 63.363 -2.435 1
1 679 . 7 1 1 A 57 57 SER N N 411 113.752 111.519 2.233 1
1 680 . 7 1 1 A 58 58 GLU H H 412 7.855 7.806 0.049 1
1 681 . 7 1 1 A 58 58 GLU HA H 412 3.772 3.838 -0.066 1
1 686 . 7 1 1 A 58 58 GLU C C 412 173.743 175.045 -1.302 1
1 687 . 7 1 1 A 58 58 GLU CA C 412 54.442 57.026 -2.584 1
1 688 . 7 1 1 A 58 58 GLU CB C 412 24.603 28.019 -3.416 1
1 690 . 7 1 1 A 58 58 GLU N N 412 115.908 120.322 -4.414 1
1 691 . 7 1 1 A 59 59 GLY H H 413 7.588 8.054 -0.466 1
1 692 . 7 1 1 A 59 59 GLY HA2 H 413 1.643 2.752 -1.109 1
1 693 . 7 1 1 A 59 59 GLY HA3 H 413 2.949 3.598 -0.649 1
1 694 . 7 1 1 A 59 59 GLY C C 413 170.850 171.814 -0.964 1
1 695 . 7 1 1 A 59 59 GLY CA C 413 41.724 43.969 -2.245 1
1 696 . 7 1 1 A 59 59 GLY N N 413 108.032 112.158 -4.126 1
1 697 . 7 1 1 A 60 60 GLN H H 414 7.973 8.592 -0.619 1
1 698 . 7 1 1 A 60 60 GLN HA H 414 4.366 4.674 -0.308 1
1 705 . 7 1 1 A 60 60 GLN C C 414 173.108 175.357 -2.249 1
1 706 . 7 1 1 A 60 60 GLN CA C 414 52.422 55.203 -2.781 1
1 707 . 7 1 1 A 60 60 GLN CB C 414 27.049 29.424 -2.375 1
1 709 . 7 1 1 A 60 60 GLN N N 414 122.690 123.898 -1.208 1
1 711 . 7 1 1 A 61 61 GLY H H 415 8.301 7.972 0.329 1
1 712 . 7 1 1 A 61 61 GLY HA2 H 415 3.700 4.243 -0.543 1
1 713 . 7 1 1 A 61 61 GLY HA3 H 415 3.920 4.276 -0.356 1
1 714 . 7 1 1 A 61 61 GLY C C 415 170.249 174.024 -3.775 1
1 715 . 7 1 1 A 61 61 GLY CA C 415 42.210 44.059 -1.849 1
1 716 . 7 1 1 A 61 61 GLY N N 415 110.794 112.837 -2.043 1
1 717 . 7 1 1 A 62 62 CYS H H 416 8.549 8.236 0.313 1
1 718 . 7 1 1 A 62 62 CYS HA H 416 4.227 4.680 -0.453 1
1 721 . 7 1 1 A 62 62 CYS C C 416 172.914 175.197 -2.283 1
1 722 . 7 1 1 A 62 62 CYS CA C 416 54.008 58.607 -4.599 1
1 723 . 7 1 1 A 62 62 CYS CB C 416 29.716 27.282 2.434 1
1 724 . 7 1 1 A 62 62 CYS N N 416 123.683 120.851 2.832 1
1 725 . 7 1 1 A 63 63 PRO HA H 417 2.611 2.734 -0.123 1
1 732 . 7 1 1 A 63 63 PRO C C 417 174.143 178.404 -4.261 1
1 733 . 7 1 1 A 63 63 PRO CA C 417 61.689 64.524 -2.835 1
1 734 . 7 1 1 A 63 63 PRO CB C 417 28.534 31.093 -2.559 1
1 737 . 7 1 1 A 64 64 PHE H H 418 8.968 7.643 1.325 1
1 738 . 7 1 1 A 64 64 PHE HA H 418 4.250 4.048 0.202 1
1 746 . 7 1 1 A 64 64 PHE C C 418 174.243 178.493 -4.250 1
1 747 . 7 1 1 A 64 64 PHE CA C 418 56.720 60.677 -3.957 1
1 748 . 7 1 1 A 64 64 PHE CB C 418 36.458 38.697 -2.239 1
1 752 . 7 1 1 A 64 64 PHE N N 418 117.008 116.330 0.678 1
1 753 . 7 1 1 A 65 65 CYS H H 419 7.968 7.933 0.035 1
1 754 . 7 1 1 A 65 65 CYS HA H 419 4.906 4.451 0.455 1
1 757 . 7 1 1 A 65 65 CYS C C 419 173.198 174.986 -1.788 1
1 758 . 7 1 1 A 65 65 CYS CA C 419 55.870 60.292 -4.422 1
1 759 . 7 1 1 A 65 65 CYS CB C 419 30.559 28.860 1.699 1
1 760 . 7 1 1 A 65 65 CYS N N 419 117.505 117.413 0.092 1
1 761 . 7 1 1 A 66 66 ARG H H 420 8.761 8.143 0.618 1
1 762 . 7 1 1 A 66 66 ARG HA H 420 4.365 4.350 0.015 1
1 769 . 7 1 1 A 66 66 ARG C C 420 172.921 174.890 -1.969 1
1 770 . 7 1 1 A 66 66 ARG CA C 420 54.763 57.165 -2.402 1
1 771 . 7 1 1 A 66 66 ARG CB C 420 24.286 27.041 -2.755 1
1 774 . 7 1 1 A 66 66 ARG N N 420 118.763 115.918 2.845 1
1 775 . 7 1 1 A 67 67 CYS H H 421 8.223 7.925 0.298 1
1 776 . 7 1 1 A 67 67 CYS HA H 421 4.419 4.618 -0.199 1
1 779 . 7 1 1 A 67 67 CYS C C 421 171.160 174.748 -3.588 1
1 780 . 7 1 1 A 67 67 CYS CA C 421 57.119 57.399 -0.280 1
1 781 . 7 1 1 A 67 67 CYS CB C 421 25.911 29.011 -3.100 1
1 782 . 7 1 1 A 67 67 CYS N N 421 120.627 117.039 3.588 1
1 783 . 7 1 1 A 68 68 GLU H H 422 8.416 8.551 -0.135 1
1 784 . 7 1 1 A 68 68 GLU HA H 422 4.025 4.235 -0.210 1
1 789 . 7 1 1 A 68 68 GLU C C 422 173.764 176.299 -2.535 1
1 790 . 7 1 1 A 68 68 GLU CA C 422 54.752 57.979 -3.227 1
1 791 . 7 1 1 A 68 68 GLU CB C 422 27.302 30.043 -2.741 1
1 793 . 7 1 1 A 68 68 GLU N N 422 122.370 119.630 2.740 1
1 794 . 7 1 1 A 69 69 ILE H H 423 8.648 8.787 -0.139 1
1 795 . 7 1 1 A 69 69 ILE HA H 423 4.012 4.575 -0.563 1
1 805 . 7 1 1 A 69 69 ILE C C 423 174.257 175.272 -1.015 1
1 806 . 7 1 1 A 69 69 ILE CA C 423 59.740 60.763 -1.023 1
1 807 . 7 1 1 A 69 69 ILE CB C 423 35.846 39.913 -4.067 1
1 811 . 7 1 1 A 69 69 ILE N N 423 125.988 123.864 2.124 1
1 812 . 7 1 1 A 70 70 LYS H H 424 9.185 9.478 -0.293 1
1 813 . 7 1 1 A 70 70 LYS HA H 424 4.434 4.659 -0.225 1
1 822 . 7 1 1 A 70 70 LYS C C 424 173.880 177.067 -3.187 1
1 823 . 7 1 1 A 70 70 LYS CA C 424 53.378 56.519 -3.141 1
1 824 . 7 1 1 A 70 70 LYS CB C 424 30.397 34.608 -4.211 1
1 828 . 7 1 1 A 70 70 LYS N N 424 128.977 127.458 1.519 1
1 829 . 7 1 1 A 71 71 GLY H H 425 7.810 7.260 0.550 1
1 830 . 7 1 1 A 71 71 GLY HA2 H 425 4.094 4.028 0.066 1
1 831 . 7 1 1 A 71 71 GLY HA3 H 425 4.159 4.033 0.126 1
1 832 . 7 1 1 A 71 71 GLY C C 425 168.179 172.333 -4.154 1
1 833 . 7 1 1 A 71 71 GLY CA C 425 42.326 45.328 -3.002 1
1 834 . 7 1 1 A 71 71 GLY N N 425 107.696 103.785 3.911 1
1 835 . 7 1 1 A 72 72 THR H H 426 8.048 8.486 -0.438 1
1 836 . 7 1 1 A 72 72 THR HA H 426 5.258 5.428 -0.170 1
1 841 . 7 1 1 A 72 72 THR C C 426 170.979 173.287 -2.308 1
1 842 . 7 1 1 A 72 72 THR CA C 426 56.755 60.348 -3.593 1
1 843 . 7 1 1 A 72 72 THR CB C 426 69.226 71.345 -2.119 1
1 845 . 7 1 1 A 72 72 THR N N 426 109.122 110.757 -1.635 1
1 846 . 7 1 1 A 73 73 GLU H H 427 8.912 9.053 -0.141 1
1 847 . 7 1 1 A 73 73 GLU HA H 427 4.954 4.753 0.201 1
1 852 . 7 1 1 A 73 73 GLU C C 427 170.353 174.068 -3.715 1
1 853 . 7 1 1 A 73 73 GLU CA C 427 50.182 52.744 -2.562 1
1 854 . 7 1 1 A 73 73 GLU CB C 427 30.559 31.684 -1.125 1
1 856 . 7 1 1 A 73 73 GLU N N 427 121.703 124.287 -2.584 1
1 1 . 7 1 1 A 74 74 PRO HA H 428 4.372 5.121 -0.749 1
1 2 . 7 1 1 A 74 74 PRO C C 428 173.839 176.733 -2.894 1
1 3 . 7 1 1 A 74 74 PRO CA C 428 60.241 63.131 -2.890 1
1 4 . 7 1 1 A 74 74 PRO CB C 428 29.299 32.144 -2.845 1
1 857 . 7 1 1 A 74 74 PRO HA H 428 4.782 5.121 -0.339 1
1 864 . 7 1 1 A 74 74 PRO C C 428 174.027 176.733 -2.706 1
1 865 . 7 1 1 A 74 74 PRO CA C 428 59.771 63.131 -3.360 1
1 866 . 7 1 1 A 74 74 PRO CB C 428 29.633 32.144 -2.511 1
1 7 . 7 1 1 A 75 75 ILE H H 429 8.144 8.649 -0.505 1
1 8 . 7 1 1 A 75 75 ILE HA H 429 4.086 4.557 -0.471 1
1 15 . 7 1 1 A 75 75 ILE C C 429 173.426 177.105 -3.679 1
1 16 . 7 1 1 A 75 75 ILE CA C 429 58.339 60.586 -2.247 1
1 17 . 7 1 1 A 75 75 ILE CB C 429 35.988 39.622 -3.634 1
1 21 . 7 1 1 A 75 75 ILE N N 429 121.551 122.252 -0.701 1
1 869 . 7 1 1 A 75 75 ILE H H 429 7.682 8.649 -0.967 1
1 870 . 7 1 1 A 75 75 ILE HA H 429 4.282 4.557 -0.275 1
1 880 . 7 1 1 A 75 75 ILE C C 429 172.510 177.105 -4.595 1
1 881 . 7 1 1 A 75 75 ILE CA C 429 57.456 60.586 -3.130 1
1 882 . 7 1 1 A 75 75 ILE CB C 429 37.903 39.622 -1.719 1
1 886 . 7 1 1 A 75 75 ILE N N 429 119.651 122.252 -2.601 1
1 1 . 7 1 1 A 76 76 VAL HA H 430 4.086 4.520 -0.434 1
1 2 . 7 1 1 A 76 76 VAL CA C 430 59.372 60.949 -1.577 1
1 22 . 7 1 1 A 76 76 VAL H H 430 8.221 8.491 -0.270 1
1 23 . 7 1 1 A 76 76 VAL HA H 430 4.083 4.520 -0.437 1
1 24 . 7 1 1 A 76 76 VAL C C 430 173.067 176.506 -3.439 1
1 25 . 7 1 1 A 76 76 VAL CA C 430 59.445 60.949 -1.504 1
1 26 . 7 1 1 A 76 76 VAL CB C 430 30.407 31.633 -1.226 1
1 27 . 7 1 1 A 76 76 VAL N N 430 125.930 121.226 4.704 1
1 887 . 7 1 1 A 76 76 VAL H H 430 8.122 8.491 -0.369 1
1 888 . 7 1 1 A 76 76 VAL HA H 430 4.197 4.520 -0.323 1
1 890 . 7 1 1 A 76 76 VAL C C 430 172.971 176.506 -3.535 1
1 891 . 7 1 1 A 76 76 VAL CA C 430 58.821 60.949 -2.128 1
1 892 . 7 1 1 A 76 76 VAL CB C 430 30.807 31.633 -0.826 1
1 895 . 7 1 1 A 76 76 VAL N N 430 124.178 121.226 2.952 1
1 4 . 7 1 1 A 77 77 VAL H H 431 8.204 7.706 0.498 1
1 5 . 7 1 1 A 77 77 VAL HA H 431 4.049 4.390 -0.341 1
1 6 . 7 1 1 A 77 77 VAL C C 431 172.636 175.897 -3.261 1
1 7 . 7 1 1 A 77 77 VAL CA C 431 59.315 61.344 -2.029 1
1 8 . 7 1 1 A 77 77 VAL CB C 431 30.219 31.984 -1.765 1
1 9 . 7 1 1 A 77 77 VAL N N 431 125.320 120.386 4.934 1
1 28 . 7 1 1 A 77 77 VAL H H 431 8.412 7.706 0.706 1
1 29 . 7 1 1 A 77 77 VAL HA H 431 4.038 4.390 -0.352 1
1 37 . 7 1 1 A 77 77 VAL C C 431 172.617 175.897 -3.280 1
1 38 . 7 1 1 A 77 77 VAL CA C 431 59.137 61.344 -2.207 1
1 39 . 7 1 1 A 77 77 VAL CB C 431 30.292 31.984 -1.692 1
1 42 . 7 1 1 A 77 77 VAL N N 431 125.655 120.386 5.269 1
1 896 . 7 1 1 A 77 77 VAL H H 431 8.448 7.706 0.742 1
1 897 . 7 1 1 A 77 77 VAL HA H 431 4.087 4.390 -0.303 1
1 905 . 7 1 1 A 77 77 VAL C C 431 172.493 175.897 -3.404 1
1 906 . 7 1 1 A 77 77 VAL CA C 431 59.185 61.344 -2.159 1
1 907 . 7 1 1 A 77 77 VAL CB C 431 30.084 31.984 -1.900 1
1 910 . 7 1 1 A 77 77 VAL N N 431 125.770 120.386 5.384 1
1 43 . 7 1 1 A 78 78 ASP H H 432 8.419 7.657 0.762 1
1 44 . 7 1 1 A 78 78 ASP HA H 432 4.829 4.902 -0.073 1
1 45 . 7 1 1 A 78 78 ASP C C 432 172.252 174.870 -2.618 1
1 46 . 7 1 1 A 78 78 ASP CA C 432 49.320 52.318 -2.998 1
1 47 . 7 1 1 A 78 78 ASP CB C 432 39.066 40.685 -1.619 1
1 48 . 7 1 1 A 78 78 ASP N N 432 126.226 121.523 4.703 1
1 911 . 7 1 1 A 78 78 ASP H H 432 8.493 7.657 0.836 1
1 912 . 7 1 1 A 78 78 ASP HA H 432 4.852 4.902 -0.050 1
1 915 . 7 1 1 A 78 78 ASP C C 432 172.048 174.870 -2.822 1
1 916 . 7 1 1 A 78 78 ASP CA C 432 49.233 52.318 -3.085 1
1 917 . 7 1 1 A 78 78 ASP CB C 432 38.858 40.685 -1.827 1
1 918 . 7 1 1 A 78 78 ASP N N 432 126.705 121.523 5.182 1
1 10 . 7 1 1 A 79 79 PRO CA C 433 63.865 62.364 1.501 1
1 49 . 7 1 1 A 79 79 PRO C C 433 173.867 177.180 -3.313 1
1 919 . 7 1 1 A 79 79 PRO HA H 433 4.237 4.740 -0.503 1
1 926 . 7 1 1 A 79 79 PRO C C 433 173.812 177.180 -3.368 1
1 927 . 7 1 1 A 79 79 PRO CA C 433 60.627 62.364 -1.737 1
1 928 . 7 1 1 A 79 79 PRO CB C 433 29.329 29.750 -0.421 1
1 11 . 7 1 1 A 80 80 PHE H H 434 8.182 8.665 -0.483 1
1 12 . 7 1 1 A 80 80 PHE HA H 434 4.499 4.462 0.037 1
1 13 . 7 1 1 A 80 80 PHE C C 434 171.680 175.194 -3.514 1
1 14 . 7 1 1 A 80 80 PHE CA C 434 54.657 61.035 -6.378 1
1 15 . 7 1 1 A 80 80 PHE CB C 434 36.272 40.415 -4.143 1
1 16 . 7 1 1 A 80 80 PHE N N 434 118.611 125.458 -6.847 1
1 50 . 7 1 1 A 80 80 PHE H H 434 8.191 8.665 -0.474 1
1 51 . 7 1 1 A 80 80 PHE HA H 434 4.528 4.462 0.066 1
1 54 . 7 1 1 A 80 80 PHE C C 434 172.457 175.194 -2.737 1
1 55 . 7 1 1 A 80 80 PHE CA C 434 54.828 61.035 -6.207 1
1 56 . 7 1 1 A 80 80 PHE CB C 434 36.457 40.415 -3.958 1
1 57 . 7 1 1 A 80 80 PHE N N 434 118.871 125.458 -6.587 1
1 931 . 7 1 1 A 80 80 PHE H H 434 8.191 8.665 -0.474 1
1 932 . 7 1 1 A 80 80 PHE HA H 434 4.463 4.462 0.001 1
1 939 . 7 1 1 A 80 80 PHE C C 434 172.283 175.194 -2.911 1
1 940 . 7 1 1 A 80 80 PHE CA C 434 54.971 61.035 -6.064 1
1 941 . 7 1 1 A 80 80 PHE CB C 434 36.490 40.415 -3.925 1
1 944 . 7 1 1 A 80 80 PHE N N 434 119.263 125.458 -6.195 1
1 17 . 7 1 1 A 81 81 ASP H H 435 7.490 7.945 -0.455 1
1 18 . 7 1 1 A 81 81 ASP HA H 435 4.698 4.960 -0.262 1
1 19 . 7 1 1 A 81 81 ASP C C 435 171.662 174.171 -2.509 1
1 20 . 7 1 1 A 81 81 ASP CA C 435 49.570 51.621 -2.051 1
1 21 . 7 1 1 A 81 81 ASP CB C 435 40.104 41.536 -1.432 1
1 22 . 7 1 1 A 81 81 ASP N N 435 120.304 117.721 2.583 1
1 58 . 7 1 1 A 81 81 ASP H H 435 7.881 7.945 -0.064 1
1 59 . 7 1 1 A 81 81 ASP HA H 435 4.801 4.960 -0.159 1
1 60 . 7 1 1 A 81 81 ASP C C 435 171.144 174.171 -3.027 1
1 61 . 7 1 1 A 81 81 ASP CA C 435 49.406 51.621 -2.215 1
1 62 . 7 1 1 A 81 81 ASP CB C 435 38.618 41.536 -2.918 1
1 63 . 7 1 1 A 81 81 ASP N N 435 123.108 117.721 5.387 1
1 945 . 7 1 1 A 81 81 ASP H H 435 7.823 7.945 -0.122 1
1 946 . 7 1 1 A 81 81 ASP HA H 435 4.759 4.960 -0.201 1
1 949 . 7 1 1 A 81 81 ASP C C 435 171.057 174.171 -3.114 1
1 950 . 7 1 1 A 81 81 ASP CA C 435 49.174 51.621 -2.447 1
1 951 . 7 1 1 A 81 81 ASP CB C 435 38.725 41.536 -2.811 1
1 952 . 7 1 1 A 81 81 ASP N N 435 123.530 117.721 5.809 1
1 23 . 7 1 1 A 82 82 PRO HA H 436 4.758 4.808 -0.050 1
1 24 . 7 1 1 A 82 82 PRO C C 436 172.944 175.668 -2.724 1
1 25 . 7 1 1 A 82 82 PRO CA C 436 60.134 62.216 -2.082 1
1 26 . 7 1 1 A 82 82 PRO CB C 436 31.425 33.291 -1.866 1
1 64 . 7 1 1 A 82 82 PRO HA H 436 4.364 4.808 -0.444 1
1 67 . 7 1 1 A 82 82 PRO C C 436 173.563 175.668 -2.105 1
1 68 . 7 1 1 A 82 82 PRO CA C 436 60.729 62.216 -1.487 1
1 69 . 7 1 1 A 82 82 PRO CB C 436 29.160 33.291 -4.131 1
1 953 . 7 1 1 A 82 82 PRO HA H 436 4.296 4.808 -0.512 1
1 960 . 7 1 1 A 82 82 PRO C C 436 173.494 175.668 -2.174 1
1 961 . 7 1 1 A 82 82 PRO CA C 436 60.625 62.216 -1.591 1
1 962 . 7 1 1 A 82 82 PRO CB C 436 29.237 33.291 -4.054 1
1 1 . 8 1 1 A 3 3 LEU HA H 357 4.257 4.046 0.211 1
1 11 . 8 1 1 A 3 3 LEU C C 357 174.994 177.941 -2.947 1
1 12 . 8 1 1 A 3 3 LEU CA C 357 53.329 57.820 -4.491 1
1 13 . 8 1 1 A 3 3 LEU CB C 357 39.382 41.789 -2.407 1
1 17 . 8 1 1 A 4 4 GLN H H 358 8.234 7.862 0.372 1
1 18 . 8 1 1 A 4 4 GLN HA H 358 4.211 4.483 -0.272 1
1 25 . 8 1 1 A 4 4 GLN C C 358 173.357 175.537 -2.180 1
1 26 . 8 1 1 A 4 4 GLN CA C 358 53.791 55.391 -1.600 1
1 27 . 8 1 1 A 4 4 GLN CB C 358 26.456 28.802 -2.346 1
1 29 . 8 1 1 A 4 4 GLN N N 358 119.506 116.338 3.168 1
1 31 . 8 1 1 A 5 5 ASP H H 359 8.090 8.196 -0.106 1
1 32 . 8 1 1 A 5 5 ASP HA H 359 4.458 4.556 -0.098 1
1 35 . 8 1 1 A 5 5 ASP C C 359 173.492 175.466 -1.974 1
1 36 . 8 1 1 A 5 5 ASP CA C 359 52.309 54.906 -2.597 1
1 37 . 8 1 1 A 5 5 ASP CB C 359 38.312 40.531 -2.219 1
1 38 . 8 1 1 A 5 5 ASP N N 359 120.683 119.572 1.111 1
1 39 . 8 1 1 A 6 6 HIS H H 360 8.103 8.543 -0.440 1
1 40 . 8 1 1 A 6 6 HIS HA H 360 4.540 4.337 0.203 1
1 45 . 8 1 1 A 6 6 HIS C C 360 172.801 174.857 -2.056 1
1 46 . 8 1 1 A 6 6 HIS CA C 360 53.874 58.230 -4.356 1
1 47 . 8 1 1 A 6 6 HIS CB C 360 27.878 28.373 -0.495 1
1 50 . 8 1 1 A 6 6 HIS N N 360 118.844 117.815 1.029 1
1 51 . 8 1 1 A 7 7 ILE H H 361 7.862 8.582 -0.720 1
1 52 . 8 1 1 A 7 7 ILE HA H 361 4.010 4.343 -0.333 1
1 62 . 8 1 1 A 7 7 ILE C C 361 173.268 175.206 -1.938 1
1 63 . 8 1 1 A 7 7 ILE CA C 361 58.740 60.396 -1.656 1
1 64 . 8 1 1 A 7 7 ILE CB C 361 35.788 38.410 -2.622 1
1 68 . 8 1 1 A 7 7 ILE N N 361 121.598 121.047 0.551 1
1 69 . 8 1 1 A 8 8 LYS H H 362 8.231 7.693 0.538 1
1 70 . 8 1 1 A 8 8 LYS HA H 362 4.313 4.441 -0.128 1
1 79 . 8 1 1 A 8 8 LYS C C 362 173.899 175.433 -1.534 1
1 80 . 8 1 1 A 8 8 LYS CA C 362 53.677 56.797 -3.120 1
1 81 . 8 1 1 A 8 8 LYS CB C 362 30.355 33.105 -2.750 1
1 85 . 8 1 1 A 8 8 LYS N N 362 124.980 124.786 0.194 1
1 86 . 8 1 1 A 9 9 VAL H H 363 8.044 8.399 -0.355 1
1 87 . 8 1 1 A 9 9 VAL HA H 363 4.089 4.874 -0.785 1
1 95 . 8 1 1 A 9 9 VAL C C 363 173.760 175.986 -2.226 1
1 96 . 8 1 1 A 9 9 VAL CA C 363 59.814 60.347 -0.533 1
1 97 . 8 1 1 A 9 9 VAL CB C 363 30.058 35.401 -5.343 1
1 100 . 8 1 1 A 9 9 VAL N N 363 121.366 125.343 -3.977 1
1 101 . 8 1 1 A 10 10 THR H H 364 8.076 9.247 -1.171 1
1 102 . 8 1 1 A 10 10 THR HA H 364 4.302 3.823 0.479 1
1 107 . 8 1 1 A 10 10 THR C C 364 172.135 176.237 -4.102 1
1 108 . 8 1 1 A 10 10 THR CA C 364 59.134 66.480 -7.346 1
1 109 . 8 1 1 A 10 10 THR CB C 364 67.415 69.038 -1.623 1
1 111 . 8 1 1 A 10 10 THR N N 364 116.817 123.493 -6.676 1
1 112 . 8 1 1 A 11 11 GLN H H 365 8.463 7.900 0.563 1
1 113 . 8 1 1 A 11 11 GLN HA H 365 4.046 4.239 -0.193 1
1 120 . 8 1 1 A 11 11 GLN C C 365 173.944 175.561 -1.617 1
1 121 . 8 1 1 A 11 11 GLN CA C 365 54.517 55.587 -1.070 1
1 122 . 8 1 1 A 11 11 GLN CB C 365 26.250 28.349 -2.099 1
1 124 . 8 1 1 A 11 11 GLN N N 365 122.059 117.019 5.040 1
1 126 . 8 1 1 A 12 12 GLU H H 366 8.449 7.919 0.530 1
1 127 . 8 1 1 A 12 12 GLU HA H 366 4.093 4.040 0.053 1
1 132 . 8 1 1 A 12 12 GLU C C 366 174.746 176.655 -1.909 1
1 133 . 8 1 1 A 12 12 GLU CA C 366 55.235 57.446 -2.211 1
1 134 . 8 1 1 A 12 12 GLU CB C 366 27.180 27.457 -0.277 1
1 136 . 8 1 1 A 12 12 GLU N N 366 120.415 115.542 4.873 1
1 137 . 8 1 1 A 13 13 GLN H H 367 8.031 8.207 -0.176 1
1 138 . 8 1 1 A 13 13 GLN HA H 367 4.113 4.213 -0.100 1
1 145 . 8 1 1 A 13 13 GLN C C 367 173.693 176.169 -2.476 1
1 146 . 8 1 1 A 13 13 GLN CA C 367 54.132 56.958 -2.826 1
1 147 . 8 1 1 A 13 13 GLN CB C 367 26.420 27.916 -1.496 1
1 149 . 8 1 1 A 13 13 GLN N N 367 119.721 117.092 2.629 1
1 151 . 8 1 1 A 14 14 TYR H H 368 8.111 7.687 0.424 1
1 152 . 8 1 1 A 14 14 TYR HA H 368 4.339 4.619 -0.280 1
1 159 . 8 1 1 A 14 14 TYR C C 368 173.916 176.867 -2.951 1
1 160 . 8 1 1 A 14 14 TYR CA C 368 56.572 59.283 -2.711 1
1 161 . 8 1 1 A 14 14 TYR CB C 368 35.879 37.472 -1.593 1
1 164 . 8 1 1 A 14 14 TYR N N 368 120.541 118.389 2.152 1
1 165 . 8 1 1 A 15 15 GLU H H 369 8.287 8.392 -0.105 1
1 166 . 8 1 1 A 15 15 GLU HA H 369 4.009 4.385 -0.376 1
1 171 . 8 1 1 A 15 15 GLU C C 369 174.448 178.584 -4.136 1
1 172 . 8 1 1 A 15 15 GLU CA C 369 55.047 59.337 -4.290 1
1 173 . 8 1 1 A 15 15 GLU CB C 369 27.226 29.954 -2.728 1
1 175 . 8 1 1 A 15 15 GLU N N 369 120.398 123.081 -2.683 1
1 176 . 8 1 1 A 16 16 LEU H H 370 7.785 7.776 0.009 1
1 177 . 8 1 1 A 16 16 LEU HA H 370 4.138 4.153 -0.015 1
1 187 . 8 1 1 A 16 16 LEU C C 370 175.089 177.430 -2.341 1
1 188 . 8 1 1 A 16 16 LEU CA C 370 53.425 56.687 -3.262 1
1 189 . 8 1 1 A 16 16 LEU CB C 370 39.554 41.376 -1.822 1
1 193 . 8 1 1 A 16 16 LEU N N 370 121.323 117.985 3.338 1
1 194 . 8 1 1 A 17 17 TYR H H 371 8.038 7.617 0.421 1
1 195 . 8 1 1 A 17 17 TYR HA H 371 4.380 4.488 -0.108 1
1 202 . 8 1 1 A 17 17 TYR C C 371 173.931 176.155 -2.224 1
1 203 . 8 1 1 A 17 17 TYR CA C 371 56.143 58.517 -2.374 1
1 204 . 8 1 1 A 17 17 TYR CB C 371 35.501 38.202 -2.701 1
1 207 . 8 1 1 A 17 17 TYR N N 371 119.465 117.564 1.901 1
1 208 . 8 1 1 A 18 18 CYS H H 372 8.021 7.152 0.869 1
1 209 . 8 1 1 A 18 18 CYS HA H 372 4.236 4.027 0.209 1
1 212 . 8 1 1 A 18 18 CYS C C 372 172.457 174.082 -1.625 1
1 213 . 8 1 1 A 18 18 CYS CA C 372 56.997 58.743 -1.746 1
1 214 . 8 1 1 A 18 18 CYS CB C 372 25.080 27.648 -2.568 1
1 215 . 8 1 1 A 18 18 CYS N N 372 119.913 120.336 -0.423 1
1 216 . 8 1 1 A 19 19 GLU H H 373 8.151 9.003 -0.852 1
1 217 . 8 1 1 A 19 19 GLU HA H 373 4.130 4.182 -0.052 1
1 222 . 8 1 1 A 19 19 GLU C C 373 174.151 176.036 -1.885 1
1 223 . 8 1 1 A 19 19 GLU CA C 373 54.535 59.098 -4.563 1
1 224 . 8 1 1 A 19 19 GLU CB C 373 27.244 29.761 -2.517 1
1 226 . 8 1 1 A 19 19 GLU N N 373 122.431 125.480 -3.049 1
1 227 . 8 1 1 A 20 20 MET H H 374 8.109 8.028 0.081 1
1 228 . 8 1 1 A 20 20 MET HA H 374 4.352 4.357 -0.005 1
1 236 . 8 1 1 A 20 20 MET C C 374 174.200 176.258 -2.058 1
1 237 . 8 1 1 A 20 20 MET CA C 374 53.238 57.638 -4.400 1
1 238 . 8 1 1 A 20 20 MET CB C 374 30.237 31.426 -1.189 1
1 241 . 8 1 1 A 20 20 MET N N 374 119.754 117.864 1.890 1
1 242 . 8 1 1 A 21 21 GLY H H 375 8.231 8.691 -0.460 1
1 243 . 8 1 1 A 21 21 GLY HA2 H 375 3.861 4.006 -0.145 1
1 244 . 8 1 1 A 21 21 GLY HA3 H 375 3.960 4.011 -0.051 1
1 245 . 8 1 1 A 21 21 GLY C C 375 171.928 174.311 -2.383 1
1 246 . 8 1 1 A 21 21 GLY CA C 375 42.930 45.015 -2.085 1
1 247 . 8 1 1 A 21 21 GLY N N 375 109.484 111.905 -2.421 1
1 248 . 8 1 1 A 22 22 SER HA H 376 4.492 4.356 0.136 1
1 251 . 8 1 1 A 22 22 SER C C 376 172.206 174.053 -1.847 1
1 252 . 8 1 1 A 22 22 SER CA C 376 55.570 59.460 -3.890 1
1 253 . 8 1 1 A 22 22 SER CB C 376 61.525 63.489 -1.964 1
1 254 . 8 1 1 A 23 23 THR H H 377 8.470 8.662 -0.192 1
1 255 . 8 1 1 A 23 23 THR HA H 377 4.295 4.511 -0.216 1
1 260 . 8 1 1 A 23 23 THR C C 377 171.811 174.577 -2.766 1
1 261 . 8 1 1 A 23 23 THR CA C 377 58.937 61.658 -2.721 1
1 262 . 8 1 1 A 23 23 THR CB C 377 67.250 67.960 -0.710 1
1 264 . 8 1 1 A 23 23 THR N N 377 124.043 118.553 5.490 1
1 265 . 8 1 1 A 24 24 PHE H H 378 8.374 8.911 -0.537 1
1 266 . 8 1 1 A 24 24 PHE HA H 378 4.239 4.381 -0.142 1
1 273 . 8 1 1 A 24 24 PHE C C 378 173.411 177.713 -4.302 1
1 274 . 8 1 1 A 24 24 PHE CA C 378 56.697 60.238 -3.541 1
1 275 . 8 1 1 A 24 24 PHE CB C 378 36.538 40.045 -3.507 1
1 278 . 8 1 1 A 24 24 PHE N N 378 124.732 126.057 -1.325 1
1 279 . 8 1 1 A 25 25 GLN H H 379 8.457 8.185 0.272 1
1 280 . 8 1 1 A 25 25 GLN HA H 379 4.038 3.966 0.072 1
1 287 . 8 1 1 A 25 25 GLN C C 379 172.431 175.717 -3.286 1
1 288 . 8 1 1 A 25 25 GLN CA C 379 54.078 58.033 -3.955 1
1 289 . 8 1 1 A 25 25 GLN CB C 379 26.414 29.446 -3.032 1
1 291 . 8 1 1 A 25 25 GLN N N 379 118.820 118.737 0.083 1
1 293 . 8 1 1 A 26 26 LEU H H 380 6.985 7.494 -0.509 1
1 294 . 8 1 1 A 26 26 LEU HA H 380 4.229 4.295 -0.066 1
1 304 . 8 1 1 A 26 26 LEU C C 380 173.895 176.504 -2.609 1
1 305 . 8 1 1 A 26 26 LEU CA C 380 52.123 54.415 -2.292 1
1 306 . 8 1 1 A 26 26 LEU CB C 380 40.543 42.869 -2.326 1
1 310 . 8 1 1 A 26 26 LEU N N 380 119.079 120.207 -1.128 1
1 311 . 8 1 1 A 27 27 CYS H H 381 8.905 9.212 -0.307 1
1 312 . 8 1 1 A 27 27 CYS HA H 381 4.013 4.549 -0.536 1
1 315 . 8 1 1 A 27 27 CYS C C 381 174.439 176.388 -1.949 1
1 316 . 8 1 1 A 27 27 CYS CA C 381 57.847 59.539 -1.692 1
1 317 . 8 1 1 A 27 27 CYS CB C 381 28.648 28.330 0.318 1
1 318 . 8 1 1 A 27 27 CYS N N 381 125.151 122.444 2.707 1
1 319 . 8 1 1 A 28 28 LYS H H 382 9.351 8.907 0.444 1
1 320 . 8 1 1 A 28 28 LYS HA H 382 4.157 4.074 0.083 1
1 329 . 8 1 1 A 28 28 LYS C C 382 174.678 178.368 -3.690 1
1 330 . 8 1 1 A 28 28 LYS CA C 382 54.324 58.680 -4.356 1
1 331 . 8 1 1 A 28 28 LYS CB C 382 30.086 32.626 -2.540 1
1 335 . 8 1 1 A 28 28 LYS N N 382 128.840 128.251 0.589 1
1 336 . 8 1 1 A 29 29 ILE H H 383 9.040 7.937 1.103 1
1 337 . 8 1 1 A 29 29 ILE HA H 383 3.804 3.744 0.060 1
1 347 . 8 1 1 A 29 29 ILE C C 383 174.239 177.076 -2.837 1
1 348 . 8 1 1 A 29 29 ILE CA C 383 62.114 64.393 -2.279 1
1 349 . 8 1 1 A 29 29 ILE CB C 383 33.870 37.763 -3.893 1
1 353 . 8 1 1 A 29 29 ILE N N 383 122.718 118.932 3.786 1
1 354 . 8 1 1 A 30 30 CYS H H 384 7.572 7.834 -0.262 1
1 355 . 8 1 1 A 30 30 CYS HA H 384 4.548 4.581 -0.033 1
1 358 . 8 1 1 A 30 30 CYS C C 384 172.978 175.247 -2.269 1
1 359 . 8 1 1 A 30 30 CYS CA C 384 54.957 59.429 -4.472 1
1 360 . 8 1 1 A 30 30 CYS CB C 384 29.778 29.832 -0.054 1
1 361 . 8 1 1 A 30 30 CYS N N 384 116.356 116.637 -0.281 1
1 362 . 8 1 1 A 31 31 ALA H H 385 8.205 8.435 -0.230 1
1 363 . 8 1 1 A 31 31 ALA HA H 385 4.107 4.199 -0.092 1
1 367 . 8 1 1 A 31 31 ALA C C 385 173.139 177.078 -3.939 1
1 368 . 8 1 1 A 31 31 ALA CA C 385 50.802 53.432 -2.630 1
1 369 . 8 1 1 A 31 31 ALA CB C 385 14.634 17.852 -3.218 1
1 370 . 8 1 1 A 31 31 ALA N N 385 125.526 121.167 4.359 1
1 371 . 8 1 1 A 32 32 GLU H H 386 8.416 7.925 0.491 1
1 372 . 8 1 1 A 32 32 GLU HA H 386 4.467 4.624 -0.157 1
1 377 . 8 1 1 A 32 32 GLU C C 386 172.325 176.165 -3.840 1
1 378 . 8 1 1 A 32 32 GLU CA C 386 55.146 57.879 -2.733 1
1 379 . 8 1 1 A 32 32 GLU CB C 386 31.181 32.142 -0.961 1
1 381 . 8 1 1 A 32 32 GLU N N 386 117.579 116.504 1.075 1
1 382 . 8 1 1 A 33 33 ASN H H 387 7.872 7.819 0.053 1
1 383 . 8 1 1 A 33 33 ASN HA H 387 4.900 4.955 -0.055 1
1 388 . 8 1 1 A 33 33 ASN C C 387 171.355 174.478 -3.123 1
1 389 . 8 1 1 A 33 33 ASN CA C 387 49.320 52.391 -3.071 1
1 390 . 8 1 1 A 33 33 ASN CB C 387 38.457 39.729 -1.272 1
1 391 . 8 1 1 A 33 33 ASN N N 387 120.399 117.737 2.662 1
1 393 . 8 1 1 A 34 34 ASP H H 388 8.565 8.544 0.021 1
1 394 . 8 1 1 A 34 34 ASP HA H 388 4.679 4.944 -0.265 1
1 397 . 8 1 1 A 34 34 ASP C C 388 174.243 176.028 -1.785 1
1 398 . 8 1 1 A 34 34 ASP CA C 388 51.809 52.812 -1.003 1
1 399 . 8 1 1 A 34 34 ASP CB C 388 38.007 41.974 -3.967 1
1 400 . 8 1 1 A 34 34 ASP N N 388 120.661 120.315 0.346 1
1 401 . 8 1 1 A 35 35 LYS H H 389 8.544 8.944 -0.400 1
1 402 . 8 1 1 A 35 35 LYS HA H 389 3.411 4.253 -0.842 1
1 409 . 8 1 1 A 35 35 LYS C C 389 172.938 177.050 -4.112 1
1 410 . 8 1 1 A 35 35 LYS CA C 389 54.973 56.194 -1.221 1
1 411 . 8 1 1 A 35 35 LYS CB C 389 30.617 31.699 -1.082 1
1 415 . 8 1 1 A 35 35 LYS N N 389 119.199 121.964 -2.765 1
1 416 . 8 1 1 A 36 36 ASP H H 390 8.327 8.657 -0.330 1
1 417 . 8 1 1 A 36 36 ASP HA H 390 4.724 4.833 -0.109 1
1 420 . 8 1 1 A 36 36 ASP C C 390 172.860 175.382 -2.522 1
1 421 . 8 1 1 A 36 36 ASP CA C 390 51.609 53.856 -2.247 1
1 422 . 8 1 1 A 36 36 ASP CB C 390 39.018 41.742 -2.724 1
1 423 . 8 1 1 A 36 36 ASP N N 390 119.134 121.276 -2.142 1
1 424 . 8 1 1 A 37 37 VAL H H 391 8.544 7.802 0.742 1
1 425 . 8 1 1 A 37 37 VAL HA H 391 4.877 4.807 0.070 1
1 433 . 8 1 1 A 37 37 VAL C C 391 167.519 173.467 -5.948 1
1 434 . 8 1 1 A 37 37 VAL CA C 391 58.259 59.825 -1.566 1
1 435 . 8 1 1 A 37 37 VAL CB C 391 32.277 35.187 -2.910 1
1 438 . 8 1 1 A 37 37 VAL N N 391 121.970 119.076 2.894 1
1 439 . 8 1 1 A 38 38 LYS H H 392 8.621 9.530 -0.909 1
1 440 . 8 1 1 A 38 38 LYS HA H 392 4.991 5.349 -0.358 1
1 449 . 8 1 1 A 38 38 LYS C C 392 172.681 175.193 -2.512 1
1 450 . 8 1 1 A 38 38 LYS CA C 392 51.123 54.431 -3.308 1
1 451 . 8 1 1 A 38 38 LYS CB C 392 33.697 35.242 -1.545 1
1 455 . 8 1 1 A 38 38 LYS N N 392 126.381 127.798 -1.417 1
1 456 . 8 1 1 A 39 39 ILE H H 393 8.723 8.634 0.089 1
1 457 . 8 1 1 A 39 39 ILE HA H 393 4.239 4.355 -0.116 1
1 467 . 8 1 1 A 39 39 ILE C C 393 172.642 175.677 -3.035 1
1 468 . 8 1 1 A 39 39 ILE CA C 393 57.768 61.058 -3.290 1
1 469 . 8 1 1 A 39 39 ILE CB C 393 35.691 37.473 -1.782 1
1 473 . 8 1 1 A 39 39 ILE N N 393 126.398 127.687 -1.289 1
1 474 . 8 1 1 A 40 40 GLU H H 394 8.506 9.451 -0.945 1
1 475 . 8 1 1 A 40 40 GLU HA H 394 4.753 4.706 0.047 1
1 480 . 8 1 1 A 40 40 GLU C C 394 173.596 176.211 -2.615 1
1 481 . 8 1 1 A 40 40 GLU CA C 394 49.793 53.330 -3.537 1
1 482 . 8 1 1 A 40 40 GLU CB C 394 28.210 30.416 -2.206 1
1 484 . 8 1 1 A 40 40 GLU N N 394 124.864 127.978 -3.114 1
1 485 . 8 1 1 A 41 41 PRO HA H 395 4.864 4.480 0.384 1
1 492 . 8 1 1 A 41 41 PRO C C 395 175.073 177.085 -2.012 1
1 493 . 8 1 1 A 41 41 PRO CA C 395 61.111 63.866 -2.755 1
1 494 . 8 1 1 A 41 41 PRO CB C 395 32.275 32.871 -0.596 1
1 497 . 8 1 1 A 42 42 CYS H H 396 7.828 7.792 0.036 1
1 498 . 8 1 1 A 42 42 CYS HA H 396 4.208 4.047 0.161 1
1 501 . 8 1 1 A 42 42 CYS C C 396 173.877 175.090 -1.213 1
1 502 . 8 1 1 A 42 42 CYS CA C 396 58.021 61.487 -3.466 1
1 503 . 8 1 1 A 42 42 CYS CB C 396 28.242 27.181 1.061 1
1 504 . 8 1 1 A 42 42 CYS N N 396 122.434 117.855 4.579 1
1 505 . 8 1 1 A 43 43 GLY H H 397 8.679 8.933 -0.254 1
1 506 . 8 1 1 A 43 43 GLY HA2 H 397 3.507 3.892 -0.385 1
1 507 . 8 1 1 A 43 43 GLY HA3 H 397 3.914 3.894 0.020 1
1 508 . 8 1 1 A 43 43 GLY C C 397 171.981 175.071 -3.090 1
1 509 . 8 1 1 A 43 43 GLY CA C 397 43.347 45.987 -2.640 1
1 510 . 8 1 1 A 43 43 GLY N N 397 112.123 108.685 3.438 1
1 511 . 8 1 1 A 44 44 HIS H H 398 8.329 7.713 0.616 1
1 512 . 8 1 1 A 44 44 HIS HA H 398 4.339 4.480 -0.141 1
1 517 . 8 1 1 A 44 44 HIS C C 398 170.742 174.807 -4.065 1
1 518 . 8 1 1 A 44 44 HIS CA C 398 58.368 56.263 2.105 1
1 519 . 8 1 1 A 44 44 HIS CB C 398 28.434 30.995 -2.561 1
1 522 . 8 1 1 A 44 44 HIS N N 398 121.393 117.943 3.450 1
1 523 . 8 1 1 A 45 45 LEU H H 399 8.241 8.707 -0.466 1
1 524 . 8 1 1 A 45 45 LEU HA H 399 5.570 5.236 0.334 1
1 534 . 8 1 1 A 45 45 LEU C C 399 174.464 175.478 -1.014 1
1 535 . 8 1 1 A 45 45 LEU CA C 399 50.729 53.567 -2.838 1
1 536 . 8 1 1 A 45 45 LEU CB C 399 43.574 44.273 -0.699 1
1 540 . 8 1 1 A 45 45 LEU N N 399 118.469 121.589 -3.120 1
1 541 . 8 1 1 A 46 46 MET H H 400 8.707 8.658 0.049 1
1 542 . 8 1 1 A 46 46 MET HA H 400 4.842 4.990 -0.148 1
1 550 . 8 1 1 A 46 46 MET C C 400 170.736 174.193 -3.457 1
1 551 . 8 1 1 A 46 46 MET CA C 400 52.804 54.164 -1.360 1
1 552 . 8 1 1 A 46 46 MET CB C 400 31.945 35.253 -3.308 1
1 555 . 8 1 1 A 46 46 MET N N 400 114.897 120.283 -5.386 1
1 556 . 8 1 1 A 47 47 CYS H H 401 9.436 8.285 1.151 1
1 557 . 8 1 1 A 47 47 CYS HA H 401 5.629 5.140 0.489 1
1 560 . 8 1 1 A 47 47 CYS C C 401 173.909 176.059 -2.150 1
1 561 . 8 1 1 A 47 47 CYS CA C 401 54.325 56.876 -2.551 1
1 562 . 8 1 1 A 47 47 CYS CB C 401 30.725 29.478 1.247 1
1 563 . 8 1 1 A 47 47 CYS N N 401 119.575 119.056 0.519 1
1 564 . 8 1 1 A 48 48 THR H H 402 9.842 9.500 0.342 1
1 565 . 8 1 1 A 48 48 THR HA H 402 3.768 3.989 -0.221 1
1 570 . 8 1 1 A 48 48 THR C C 402 174.333 176.263 -1.930 1
1 571 . 8 1 1 A 48 48 THR CA C 402 64.516 65.853 -1.337 1
1 572 . 8 1 1 A 48 48 THR CB C 402 66.288 68.595 -2.307 1
1 574 . 8 1 1 A 48 48 THR N N 402 119.945 119.222 0.723 1
1 575 . 8 1 1 A 49 49 SER H H 403 8.355 8.060 0.295 1
1 576 . 8 1 1 A 49 49 SER HA H 403 4.222 4.095 0.127 1
1 579 . 8 1 1 A 49 49 SER C C 403 175.059 176.970 -1.911 1
1 580 . 8 1 1 A 49 49 SER CA C 403 59.828 62.077 -2.249 1
1 581 . 8 1 1 A 49 49 SER CB C 403 59.717 62.617 -2.900 1
1 582 . 8 1 1 A 49 49 SER N N 403 120.468 117.264 3.204 1
1 583 . 8 1 1 A 50 50 CYS H H 404 9.464 8.270 1.194 1
1 584 . 8 1 1 A 50 50 CYS HA H 404 3.922 4.244 -0.322 1
1 587 . 8 1 1 A 50 50 CYS C C 404 176.081 177.005 -0.924 1
1 588 . 8 1 1 A 50 50 CYS CA C 404 63.076 63.905 -0.829 1
1 589 . 8 1 1 A 50 50 CYS CB C 404 26.078 27.296 -1.218 1
1 590 . 8 1 1 A 50 50 CYS N N 404 126.744 119.530 7.214 1
1 591 . 8 1 1 A 51 51 LEU H H 405 7.948 7.996 -0.048 1
1 592 . 8 1 1 A 51 51 LEU HA H 405 4.064 4.145 -0.081 1
1 602 . 8 1 1 A 51 51 LEU C C 405 175.495 178.930 -3.435 1
1 603 . 8 1 1 A 51 51 LEU CA C 405 55.914 57.939 -2.025 1
1 604 . 8 1 1 A 51 51 LEU CB C 405 38.662 41.954 -3.292 1
1 607 . 8 1 1 A 51 51 LEU N N 405 121.951 123.141 -1.190 1
1 608 . 8 1 1 A 52 52 THR H H 406 8.786 8.676 0.110 1
1 609 . 8 1 1 A 52 52 THR HA H 406 4.024 3.930 0.094 1
1 614 . 8 1 1 A 52 52 THR C C 406 174.139 176.228 -2.089 1
1 615 . 8 1 1 A 52 52 THR CA C 406 64.017 66.802 -2.785 1
1 616 . 8 1 1 A 52 52 THR CB C 406 66.115 68.552 -2.437 1
1 618 . 8 1 1 A 52 52 THR N N 406 115.258 115.086 0.172 1
1 619 . 8 1 1 A 53 53 SER H H 407 8.115 7.862 0.253 1
1 620 . 8 1 1 A 53 53 SER HA H 407 4.204 4.067 0.137 1
1 623 . 8 1 1 A 53 53 SER C C 407 174.456 176.949 -2.493 1
1 624 . 8 1 1 A 53 53 SER CA C 407 59.090 61.406 -2.316 1
1 625 . 8 1 1 A 53 53 SER CB C 407 60.146 63.207 -3.061 1
1 626 . 8 1 1 A 53 53 SER N N 407 116.852 115.050 1.802 1
1 627 . 8 1 1 A 54 54 TRP H H 408 8.123 7.932 0.191 1
1 628 . 8 1 1 A 54 54 TRP HA H 408 4.371 4.266 0.105 1
1 637 . 8 1 1 A 54 54 TRP C C 408 175.981 178.857 -2.876 1
1 638 . 8 1 1 A 54 54 TRP CA C 408 57.323 60.895 -3.572 1
1 639 . 8 1 1 A 54 54 TRP CB C 408 26.812 29.692 -2.880 1
1 645 . 8 1 1 A 54 54 TRP N N 408 123.556 123.770 -0.214 1
1 647 . 8 1 1 A 55 55 GLN H H 409 8.502 8.627 -0.125 1
1 648 . 8 1 1 A 55 55 GLN HA H 409 3.999 3.815 0.184 1
1 655 . 8 1 1 A 55 55 GLN C C 409 177.300 178.459 -1.159 1
1 656 . 8 1 1 A 55 55 GLN CA C 409 56.484 59.043 -2.559 1
1 657 . 8 1 1 A 55 55 GLN CB C 409 26.190 28.321 -2.131 1
1 659 . 8 1 1 A 55 55 GLN N N 409 118.044 118.009 0.035 1
1 661 . 8 1 1 A 56 56 GLU H H 410 8.467 8.195 0.272 1
1 662 . 8 1 1 A 56 56 GLU HA H 410 4.057 4.101 -0.044 1
1 667 . 8 1 1 A 56 56 GLU C C 410 174.787 177.969 -3.182 1
1 668 . 8 1 1 A 56 56 GLU CA C 410 55.909 58.733 -2.824 1
1 669 . 8 1 1 A 56 56 GLU CB C 410 26.895 29.337 -2.442 1
1 671 . 8 1 1 A 56 56 GLU N N 410 119.448 119.938 -0.490 1
1 672 . 8 1 1 A 57 57 SER H H 411 7.438 7.464 -0.026 1
1 673 . 8 1 1 A 57 57 SER HA H 411 4.607 4.457 0.150 1
1 676 . 8 1 1 A 57 57 SER C C 411 170.849 172.996 -2.147 1
1 677 . 8 1 1 A 57 57 SER CA C 411 55.540 58.031 -2.491 1
1 678 . 8 1 1 A 57 57 SER CB C 411 60.928 63.295 -2.367 1
1 679 . 8 1 1 A 57 57 SER N N 411 113.752 111.896 1.856 1
1 680 . 8 1 1 A 58 58 GLU H H 412 7.855 7.774 0.081 1
1 681 . 8 1 1 A 58 58 GLU HA H 412 3.772 4.040 -0.268 1
1 686 . 8 1 1 A 58 58 GLU C C 412 173.743 175.696 -1.953 1
1 687 . 8 1 1 A 58 58 GLU CA C 412 54.442 56.983 -2.541 1
1 688 . 8 1 1 A 58 58 GLU CB C 412 24.603 28.497 -3.894 1
1 690 . 8 1 1 A 58 58 GLU N N 412 115.908 117.299 -1.391 1
1 691 . 8 1 1 A 59 59 GLY H H 413 7.588 8.324 -0.736 1
1 692 . 8 1 1 A 59 59 GLY HA2 H 413 1.643 3.587 -1.944 1
1 693 . 8 1 1 A 59 59 GLY HA3 H 413 2.949 3.597 -0.648 1
1 694 . 8 1 1 A 59 59 GLY C C 413 170.850 174.137 -3.287 1
1 695 . 8 1 1 A 59 59 GLY CA C 413 41.724 44.181 -2.457 1
1 696 . 8 1 1 A 59 59 GLY N N 413 108.032 112.740 -4.708 1
1 697 . 8 1 1 A 60 60 GLN H H 414 7.973 8.724 -0.751 1
1 698 . 8 1 1 A 60 60 GLN HA H 414 4.366 4.493 -0.127 1
1 705 . 8 1 1 A 60 60 GLN C C 414 173.108 174.958 -1.850 1
1 706 . 8 1 1 A 60 60 GLN CA C 414 52.422 55.393 -2.971 1
1 707 . 8 1 1 A 60 60 GLN CB C 414 27.049 29.425 -2.376 1
1 709 . 8 1 1 A 60 60 GLN N N 414 122.690 122.286 0.404 1
1 711 . 8 1 1 A 61 61 GLY H H 415 8.301 7.626 0.675 1
1 712 . 8 1 1 A 61 61 GLY HA2 H 415 3.700 4.160 -0.460 1
1 713 . 8 1 1 A 61 61 GLY HA3 H 415 3.920 4.187 -0.267 1
1 714 . 8 1 1 A 61 61 GLY C C 415 170.249 172.203 -1.954 1
1 715 . 8 1 1 A 61 61 GLY CA C 415 42.210 45.640 -3.430 1
1 716 . 8 1 1 A 61 61 GLY N N 415 110.794 107.098 3.696 1
1 717 . 8 1 1 A 62 62 CYS H H 416 8.549 8.365 0.184 1
1 718 . 8 1 1 A 62 62 CYS HA H 416 4.227 4.666 -0.439 1
1 721 . 8 1 1 A 62 62 CYS C C 416 172.914 175.108 -2.194 1
1 722 . 8 1 1 A 62 62 CYS CA C 416 54.008 58.701 -4.693 1
1 723 . 8 1 1 A 62 62 CYS CB C 416 29.716 27.320 2.396 1
1 724 . 8 1 1 A 62 62 CYS N N 416 123.683 120.527 3.156 1
1 725 . 8 1 1 A 63 63 PRO HA H 417 2.611 2.657 -0.046 1
1 732 . 8 1 1 A 63 63 PRO C C 417 174.143 178.371 -4.228 1
1 733 . 8 1 1 A 63 63 PRO CA C 417 61.689 64.511 -2.822 1
1 734 . 8 1 1 A 63 63 PRO CB C 417 28.534 30.970 -2.436 1
1 737 . 8 1 1 A 64 64 PHE H H 418 8.968 7.611 1.357 1
1 738 . 8 1 1 A 64 64 PHE HA H 418 4.250 4.095 0.155 1
1 746 . 8 1 1 A 64 64 PHE C C 418 174.243 178.671 -4.428 1
1 747 . 8 1 1 A 64 64 PHE CA C 418 56.720 60.582 -3.862 1
1 748 . 8 1 1 A 64 64 PHE CB C 418 36.458 38.995 -2.537 1
1 752 . 8 1 1 A 64 64 PHE N N 418 117.008 116.383 0.625 1
1 753 . 8 1 1 A 65 65 CYS H H 419 7.968 8.006 -0.038 1
1 754 . 8 1 1 A 65 65 CYS HA H 419 4.906 4.451 0.455 1
1 757 . 8 1 1 A 65 65 CYS C C 419 173.198 174.817 -1.619 1
1 758 . 8 1 1 A 65 65 CYS CA C 419 55.870 60.301 -4.431 1
1 759 . 8 1 1 A 65 65 CYS CB C 419 30.559 28.803 1.756 1
1 760 . 8 1 1 A 65 65 CYS N N 419 117.505 117.487 0.018 1
1 761 . 8 1 1 A 66 66 ARG H H 420 8.761 7.765 0.996 1
1 762 . 8 1 1 A 66 66 ARG HA H 420 4.365 4.494 -0.129 1
1 769 . 8 1 1 A 66 66 ARG C C 420 172.921 174.915 -1.994 1
1 770 . 8 1 1 A 66 66 ARG CA C 420 54.763 57.168 -2.405 1
1 771 . 8 1 1 A 66 66 ARG CB C 420 24.286 26.845 -2.559 1
1 774 . 8 1 1 A 66 66 ARG N N 420 118.763 116.246 2.517 1
1 775 . 8 1 1 A 67 67 CYS H H 421 8.223 7.899 0.324 1
1 776 . 8 1 1 A 67 67 CYS HA H 421 4.419 4.593 -0.174 1
1 779 . 8 1 1 A 67 67 CYS C C 421 171.160 174.527 -3.367 1
1 780 . 8 1 1 A 67 67 CYS CA C 421 57.119 57.884 -0.765 1
1 781 . 8 1 1 A 67 67 CYS CB C 421 25.911 29.534 -3.623 1
1 782 . 8 1 1 A 67 67 CYS N N 421 120.627 116.666 3.961 1
1 783 . 8 1 1 A 68 68 GLU H H 422 8.416 8.594 -0.178 1
1 784 . 8 1 1 A 68 68 GLU HA H 422 4.025 4.255 -0.230 1
1 789 . 8 1 1 A 68 68 GLU C C 422 173.764 176.440 -2.676 1
1 790 . 8 1 1 A 68 68 GLU CA C 422 54.752 57.444 -2.692 1
1 791 . 8 1 1 A 68 68 GLU CB C 422 27.302 29.737 -2.435 1
1 793 . 8 1 1 A 68 68 GLU N N 422 122.370 119.811 2.559 1
1 794 . 8 1 1 A 69 69 ILE H H 423 8.648 8.804 -0.156 1
1 795 . 8 1 1 A 69 69 ILE HA H 423 4.012 4.575 -0.563 1
1 805 . 8 1 1 A 69 69 ILE C C 423 174.257 175.420 -1.163 1
1 806 . 8 1 1 A 69 69 ILE CA C 423 59.740 60.453 -0.713 1
1 807 . 8 1 1 A 69 69 ILE CB C 423 35.846 39.877 -4.031 1
1 811 . 8 1 1 A 69 69 ILE N N 423 125.988 125.139 0.849 1
1 812 . 8 1 1 A 70 70 LYS H H 424 9.185 9.620 -0.435 1
1 813 . 8 1 1 A 70 70 LYS HA H 424 4.434 4.489 -0.055 1
1 822 . 8 1 1 A 70 70 LYS C C 424 173.880 176.115 -2.235 1
1 823 . 8 1 1 A 70 70 LYS CA C 424 53.378 57.259 -3.881 1
1 824 . 8 1 1 A 70 70 LYS CB C 424 30.397 35.314 -4.917 1
1 828 . 8 1 1 A 70 70 LYS N N 424 128.977 129.648 -0.671 1
1 829 . 8 1 1 A 71 71 GLY H H 425 7.810 7.475 0.335 1
1 830 . 8 1 1 A 71 71 GLY HA2 H 425 4.094 4.012 0.082 1
1 831 . 8 1 1 A 71 71 GLY HA3 H 425 4.159 4.016 0.143 1
1 832 . 8 1 1 A 71 71 GLY C C 425 168.179 172.058 -3.879 1
1 833 . 8 1 1 A 71 71 GLY CA C 425 42.326 45.320 -2.994 1
1 834 . 8 1 1 A 71 71 GLY N N 425 107.696 106.534 1.162 1
1 835 . 8 1 1 A 72 72 THR H H 426 8.048 8.465 -0.417 1
1 836 . 8 1 1 A 72 72 THR HA H 426 5.258 5.398 -0.140 1
1 841 . 8 1 1 A 72 72 THR C C 426 170.979 173.710 -2.731 1
1 842 . 8 1 1 A 72 72 THR CA C 426 56.755 59.762 -3.007 1
1 843 . 8 1 1 A 72 72 THR CB C 426 69.226 71.481 -2.255 1
1 845 . 8 1 1 A 72 72 THR N N 426 109.122 110.904 -1.782 1
1 846 . 8 1 1 A 73 73 GLU H H 427 8.912 9.197 -0.285 1
1 847 . 8 1 1 A 73 73 GLU HA H 427 4.954 4.960 -0.006 1
1 852 . 8 1 1 A 73 73 GLU C C 427 170.353 173.735 -3.382 1
1 853 . 8 1 1 A 73 73 GLU CA C 427 50.182 53.206 -3.024 1
1 854 . 8 1 1 A 73 73 GLU CB C 427 30.559 32.611 -2.052 1
1 856 . 8 1 1 A 73 73 GLU N N 427 121.703 120.554 1.149 1
1 1 . 8 1 1 A 74 74 PRO HA H 428 4.372 5.054 -0.682 1
1 2 . 8 1 1 A 74 74 PRO C C 428 173.839 176.086 -2.247 1
1 3 . 8 1 1 A 74 74 PRO CA C 428 60.241 62.524 -2.283 1
1 4 . 8 1 1 A 74 74 PRO CB C 428 29.299 32.508 -3.209 1
1 857 . 8 1 1 A 74 74 PRO HA H 428 4.782 5.054 -0.272 1
1 864 . 8 1 1 A 74 74 PRO C C 428 174.027 176.086 -2.059 1
1 865 . 8 1 1 A 74 74 PRO CA C 428 59.771 62.524 -2.753 1
1 866 . 8 1 1 A 74 74 PRO CB C 428 29.633 32.508 -2.875 1
1 7 . 8 1 1 A 75 75 ILE H H 429 8.144 9.130 -0.986 1
1 8 . 8 1 1 A 75 75 ILE HA H 429 4.086 4.145 -0.059 1
1 15 . 8 1 1 A 75 75 ILE C C 429 173.426 175.967 -2.541 1
1 16 . 8 1 1 A 75 75 ILE CA C 429 58.339 62.481 -4.142 1
1 17 . 8 1 1 A 75 75 ILE CB C 429 35.988 38.543 -2.555 1
1 21 . 8 1 1 A 75 75 ILE N N 429 121.551 119.694 1.857 1
1 869 . 8 1 1 A 75 75 ILE H H 429 7.682 9.130 -1.448 1
1 870 . 8 1 1 A 75 75 ILE HA H 429 4.282 4.145 0.137 1
1 880 . 8 1 1 A 75 75 ILE C C 429 172.510 175.967 -3.457 1
1 881 . 8 1 1 A 75 75 ILE CA C 429 57.456 62.481 -5.025 1
1 882 . 8 1 1 A 75 75 ILE CB C 429 37.903 38.543 -0.640 1
1 886 . 8 1 1 A 75 75 ILE N N 429 119.651 119.694 -0.043 1
1 1 . 8 1 1 A 76 76 VAL HA H 430 4.086 3.729 0.357 1
1 2 . 8 1 1 A 76 76 VAL CA C 430 59.372 62.461 -3.089 1
1 22 . 8 1 1 A 76 76 VAL H H 430 8.221 7.897 0.324 1
1 23 . 8 1 1 A 76 76 VAL HA H 430 4.083 3.729 0.354 1
1 24 . 8 1 1 A 76 76 VAL C C 430 173.067 174.715 -1.648 1
1 25 . 8 1 1 A 76 76 VAL CA C 430 59.445 62.461 -3.016 1
1 26 . 8 1 1 A 76 76 VAL CB C 430 30.407 30.204 0.203 1
1 27 . 8 1 1 A 76 76 VAL N N 430 125.930 118.736 7.194 1
1 887 . 8 1 1 A 76 76 VAL H H 430 8.122 7.897 0.225 1
1 888 . 8 1 1 A 76 76 VAL HA H 430 4.197 3.729 0.468 1
1 890 . 8 1 1 A 76 76 VAL C C 430 172.971 174.715 -1.744 1
1 891 . 8 1 1 A 76 76 VAL CA C 430 58.821 62.461 -3.640 1
1 892 . 8 1 1 A 76 76 VAL CB C 430 30.807 30.204 0.603 1
1 895 . 8 1 1 A 76 76 VAL N N 430 124.178 118.736 5.442 1
1 4 . 8 1 1 A 77 77 VAL H H 431 8.204 8.050 0.154 1
1 5 . 8 1 1 A 77 77 VAL HA H 431 4.049 4.631 -0.582 1
1 6 . 8 1 1 A 77 77 VAL C C 431 172.636 174.724 -2.088 1
1 7 . 8 1 1 A 77 77 VAL CA C 431 59.315 60.926 -1.611 1
1 8 . 8 1 1 A 77 77 VAL CB C 431 30.219 32.522 -2.303 1
1 9 . 8 1 1 A 77 77 VAL N N 431 125.320 120.021 5.299 1
1 28 . 8 1 1 A 77 77 VAL H H 431 8.412 8.050 0.362 1
1 29 . 8 1 1 A 77 77 VAL HA H 431 4.038 4.631 -0.593 1
1 37 . 8 1 1 A 77 77 VAL C C 431 172.617 174.724 -2.107 1
1 38 . 8 1 1 A 77 77 VAL CA C 431 59.137 60.926 -1.789 1
1 39 . 8 1 1 A 77 77 VAL CB C 431 30.292 32.522 -2.230 1
1 42 . 8 1 1 A 77 77 VAL N N 431 125.655 120.021 5.634 1
1 896 . 8 1 1 A 77 77 VAL H H 431 8.448 8.050 0.398 1
1 897 . 8 1 1 A 77 77 VAL HA H 431 4.087 4.631 -0.544 1
1 905 . 8 1 1 A 77 77 VAL C C 431 172.493 174.724 -2.231 1
1 906 . 8 1 1 A 77 77 VAL CA C 431 59.185 60.926 -1.741 1
1 907 . 8 1 1 A 77 77 VAL CB C 431 30.084 32.522 -2.438 1
1 910 . 8 1 1 A 77 77 VAL N N 431 125.770 120.021 5.749 1
1 43 . 8 1 1 A 78 78 ASP H H 432 8.419 8.911 -0.492 1
1 44 . 8 1 1 A 78 78 ASP HA H 432 4.829 5.391 -0.562 1
1 45 . 8 1 1 A 78 78 ASP C C 432 172.252 174.555 -2.303 1
1 46 . 8 1 1 A 78 78 ASP CA C 432 49.320 51.529 -2.209 1
1 47 . 8 1 1 A 78 78 ASP CB C 432 39.066 41.984 -2.918 1
1 48 . 8 1 1 A 78 78 ASP N N 432 126.226 126.227 -0.001 1
1 911 . 8 1 1 A 78 78 ASP H H 432 8.493 8.911 -0.418 1
1 912 . 8 1 1 A 78 78 ASP HA H 432 4.852 5.391 -0.539 1
1 915 . 8 1 1 A 78 78 ASP C C 432 172.048 174.555 -2.507 1
1 916 . 8 1 1 A 78 78 ASP CA C 432 49.233 51.529 -2.296 1
1 917 . 8 1 1 A 78 78 ASP CB C 432 38.858 41.984 -3.126 1
1 918 . 8 1 1 A 78 78 ASP N N 432 126.705 126.227 0.478 1
1 10 . 8 1 1 A 79 79 PRO CA C 433 63.865 62.351 1.514 1
1 49 . 8 1 1 A 79 79 PRO C C 433 173.867 177.023 -3.156 1
1 919 . 8 1 1 A 79 79 PRO HA H 433 4.237 4.815 -0.578 1
1 926 . 8 1 1 A 79 79 PRO C C 433 173.812 177.023 -3.211 1
1 927 . 8 1 1 A 79 79 PRO CA C 433 60.627 62.351 -1.724 1
1 928 . 8 1 1 A 79 79 PRO CB C 433 29.329 29.329 0.000 1
1 11 . 8 1 1 A 80 80 PHE H H 434 8.182 8.719 -0.537 1
1 12 . 8 1 1 A 80 80 PHE HA H 434 4.499 4.399 0.100 1
1 13 . 8 1 1 A 80 80 PHE C C 434 171.680 175.160 -3.480 1
1 14 . 8 1 1 A 80 80 PHE CA C 434 54.657 60.743 -6.086 1
1 15 . 8 1 1 A 80 80 PHE CB C 434 36.272 40.182 -3.910 1
1 16 . 8 1 1 A 80 80 PHE N N 434 118.611 125.045 -6.434 1
1 50 . 8 1 1 A 80 80 PHE H H 434 8.191 8.719 -0.528 1
1 51 . 8 1 1 A 80 80 PHE HA H 434 4.528 4.399 0.129 1
1 54 . 8 1 1 A 80 80 PHE C C 434 172.457 175.160 -2.703 1
1 55 . 8 1 1 A 80 80 PHE CA C 434 54.828 60.743 -5.915 1
1 56 . 8 1 1 A 80 80 PHE CB C 434 36.457 40.182 -3.725 1
1 57 . 8 1 1 A 80 80 PHE N N 434 118.871 125.045 -6.174 1
1 931 . 8 1 1 A 80 80 PHE H H 434 8.191 8.719 -0.528 1
1 932 . 8 1 1 A 80 80 PHE HA H 434 4.463 4.399 0.064 1
1 939 . 8 1 1 A 80 80 PHE C C 434 172.283 175.160 -2.877 1
1 940 . 8 1 1 A 80 80 PHE CA C 434 54.971 60.743 -5.772 1
1 941 . 8 1 1 A 80 80 PHE CB C 434 36.490 40.182 -3.692 1
1 944 . 8 1 1 A 80 80 PHE N N 434 119.263 125.045 -5.782 1
1 17 . 8 1 1 A 81 81 ASP H H 435 7.490 8.056 -0.566 1
1 18 . 8 1 1 A 81 81 ASP HA H 435 4.698 4.958 -0.260 1
1 19 . 8 1 1 A 81 81 ASP C C 435 171.662 175.180 -3.518 1
1 20 . 8 1 1 A 81 81 ASP CA C 435 49.570 51.488 -1.918 1
1 21 . 8 1 1 A 81 81 ASP CB C 435 40.104 41.638 -1.534 1
1 22 . 8 1 1 A 81 81 ASP N N 435 120.304 117.777 2.527 1
1 58 . 8 1 1 A 81 81 ASP H H 435 7.881 8.056 -0.175 1
1 59 . 8 1 1 A 81 81 ASP HA H 435 4.801 4.958 -0.157 1
1 60 . 8 1 1 A 81 81 ASP C C 435 171.144 175.180 -4.036 1
1 61 . 8 1 1 A 81 81 ASP CA C 435 49.406 51.488 -2.082 1
1 62 . 8 1 1 A 81 81 ASP CB C 435 38.618 41.638 -3.020 1
1 63 . 8 1 1 A 81 81 ASP N N 435 123.108 117.777 5.331 1
1 945 . 8 1 1 A 81 81 ASP H H 435 7.823 8.056 -0.233 1
1 946 . 8 1 1 A 81 81 ASP HA H 435 4.759 4.958 -0.199 1
1 949 . 8 1 1 A 81 81 ASP C C 435 171.057 175.180 -4.123 1
1 950 . 8 1 1 A 81 81 ASP CA C 435 49.174 51.488 -2.314 1
1 951 . 8 1 1 A 81 81 ASP CB C 435 38.725 41.638 -2.913 1
1 952 . 8 1 1 A 81 81 ASP N N 435 123.530 117.777 5.753 1
1 23 . 8 1 1 A 82 82 PRO HA H 436 4.758 4.606 0.152 1
1 24 . 8 1 1 A 82 82 PRO C C 436 172.944 175.542 -2.598 1
1 25 . 8 1 1 A 82 82 PRO CA C 436 60.134 63.664 -3.530 1
1 26 . 8 1 1 A 82 82 PRO CB C 436 31.425 31.838 -0.413 1
1 64 . 8 1 1 A 82 82 PRO HA H 436 4.364 4.606 -0.242 1
1 67 . 8 1 1 A 82 82 PRO C C 436 173.563 175.542 -1.979 1
1 68 . 8 1 1 A 82 82 PRO CA C 436 60.729 63.664 -2.935 1
1 69 . 8 1 1 A 82 82 PRO CB C 436 29.160 31.838 -2.678 1
1 953 . 8 1 1 A 82 82 PRO HA H 436 4.296 4.606 -0.310 1
1 960 . 8 1 1 A 82 82 PRO C C 436 173.494 175.542 -2.048 1
1 961 . 8 1 1 A 82 82 PRO CA C 436 60.625 63.664 -3.039 1
1 962 . 8 1 1 A 82 82 PRO CB C 436 29.237 31.838 -2.601 1
1 1 . 9 1 1 A 3 3 LEU HA H 357 4.257 4.039 0.218 1
1 11 . 9 1 1 A 3 3 LEU C C 357 174.994 178.575 -3.581 1
1 12 . 9 1 1 A 3 3 LEU CA C 357 53.329 56.884 -3.555 1
1 13 . 9 1 1 A 3 3 LEU CB C 357 39.382 42.169 -2.787 1
1 17 . 9 1 1 A 4 4 GLN H H 358 8.234 7.883 0.351 1
1 18 . 9 1 1 A 4 4 GLN HA H 358 4.211 4.350 -0.139 1
1 25 . 9 1 1 A 4 4 GLN C C 358 173.357 175.869 -2.512 1
1 26 . 9 1 1 A 4 4 GLN CA C 358 53.791 57.502 -3.711 1
1 27 . 9 1 1 A 4 4 GLN CB C 358 26.456 29.868 -3.412 1
1 29 . 9 1 1 A 4 4 GLN N N 358 119.506 117.698 1.808 1
1 31 . 9 1 1 A 5 5 ASP H H 359 8.090 8.522 -0.432 1
1 32 . 9 1 1 A 5 5 ASP HA H 359 4.458 5.170 -0.712 1
1 35 . 9 1 1 A 5 5 ASP C C 359 173.492 174.826 -1.334 1
1 36 . 9 1 1 A 5 5 ASP CA C 359 52.309 53.416 -1.107 1
1 37 . 9 1 1 A 5 5 ASP CB C 359 38.312 42.834 -4.522 1
1 38 . 9 1 1 A 5 5 ASP N N 359 120.683 118.684 1.999 1
1 39 . 9 1 1 A 6 6 HIS H H 360 8.103 8.797 -0.694 1
1 40 . 9 1 1 A 6 6 HIS HA H 360 4.540 5.188 -0.648 1
1 45 . 9 1 1 A 6 6 HIS C C 360 172.801 172.257 0.544 1
1 46 . 9 1 1 A 6 6 HIS CA C 360 53.874 54.436 -0.562 1
1 47 . 9 1 1 A 6 6 HIS CB C 360 27.878 32.224 -4.346 1
1 50 . 9 1 1 A 6 6 HIS N N 360 118.844 120.515 -1.671 1
1 51 . 9 1 1 A 7 7 ILE H H 361 7.862 9.040 -1.178 1
1 52 . 9 1 1 A 7 7 ILE HA H 361 4.010 4.000 0.010 1
1 62 . 9 1 1 A 7 7 ILE C C 361 173.268 176.635 -3.367 1
1 63 . 9 1 1 A 7 7 ILE CA C 361 58.740 61.507 -2.767 1
1 64 . 9 1 1 A 7 7 ILE CB C 361 35.788 36.828 -1.040 1
1 68 . 9 1 1 A 7 7 ILE N N 361 121.598 122.494 -0.896 1
1 69 . 9 1 1 A 8 8 LYS H H 362 8.231 8.028 0.203 1
1 70 . 9 1 1 A 8 8 LYS HA H 362 4.313 4.322 -0.009 1
1 79 . 9 1 1 A 8 8 LYS C C 362 173.899 176.439 -2.540 1
1 80 . 9 1 1 A 8 8 LYS CA C 362 53.677 57.821 -4.144 1
1 81 . 9 1 1 A 8 8 LYS CB C 362 30.355 33.272 -2.917 1
1 85 . 9 1 1 A 8 8 LYS N N 362 124.980 123.736 1.244 1
1 86 . 9 1 1 A 9 9 VAL H H 363 8.044 7.930 0.114 1
1 87 . 9 1 1 A 9 9 VAL HA H 363 4.089 4.132 -0.043 1
1 95 . 9 1 1 A 9 9 VAL C C 363 173.760 175.501 -1.741 1
1 96 . 9 1 1 A 9 9 VAL CA C 363 59.814 61.813 -1.999 1
1 97 . 9 1 1 A 9 9 VAL CB C 363 30.058 30.638 -0.580 1
1 100 . 9 1 1 A 9 9 VAL N N 363 121.366 120.105 1.261 1
1 101 . 9 1 1 A 10 10 THR H H 364 8.076 8.250 -0.174 1
1 102 . 9 1 1 A 10 10 THR HA H 364 4.302 3.867 0.435 1
1 107 . 9 1 1 A 10 10 THR C C 364 172.135 175.997 -3.862 1
1 108 . 9 1 1 A 10 10 THR CA C 364 59.134 65.068 -5.934 1
1 109 . 9 1 1 A 10 10 THR CB C 364 67.415 68.945 -1.530 1
1 111 . 9 1 1 A 10 10 THR N N 364 116.817 122.115 -5.298 1
1 112 . 9 1 1 A 11 11 GLN H H 365 8.463 7.853 0.610 1
1 113 . 9 1 1 A 11 11 GLN HA H 365 4.046 4.406 -0.360 1
1 120 . 9 1 1 A 11 11 GLN C C 365 173.944 175.951 -2.007 1
1 121 . 9 1 1 A 11 11 GLN CA C 365 54.517 57.265 -2.748 1
1 122 . 9 1 1 A 11 11 GLN CB C 365 26.250 30.414 -4.164 1
1 124 . 9 1 1 A 11 11 GLN N N 365 122.059 120.232 1.827 1
1 126 . 9 1 1 A 12 12 GLU H H 366 8.449 7.849 0.600 1
1 127 . 9 1 1 A 12 12 GLU HA H 366 4.093 4.735 -0.642 1
1 132 . 9 1 1 A 12 12 GLU C C 366 174.746 176.176 -1.430 1
1 133 . 9 1 1 A 12 12 GLU CA C 366 55.235 55.693 -0.458 1
1 134 . 9 1 1 A 12 12 GLU CB C 366 27.180 32.414 -5.234 1
1 136 . 9 1 1 A 12 12 GLU N N 366 120.415 119.086 1.329 1
1 137 . 9 1 1 A 13 13 GLN H H 367 8.031 8.890 -0.859 1
1 138 . 9 1 1 A 13 13 GLN HA H 367 4.113 4.152 -0.039 1
1 145 . 9 1 1 A 13 13 GLN C C 367 173.693 176.744 -3.051 1
1 146 . 9 1 1 A 13 13 GLN CA C 367 54.132 57.896 -3.764 1
1 147 . 9 1 1 A 13 13 GLN CB C 367 26.420 28.672 -2.252 1
1 149 . 9 1 1 A 13 13 GLN N N 367 119.721 126.193 -6.472 1
1 151 . 9 1 1 A 14 14 TYR H H 368 8.111 7.998 0.113 1
1 152 . 9 1 1 A 14 14 TYR HA H 368 4.339 4.672 -0.333 1
1 159 . 9 1 1 A 14 14 TYR C C 368 173.916 176.599 -2.683 1
1 160 . 9 1 1 A 14 14 TYR CA C 368 56.572 58.257 -1.685 1
1 161 . 9 1 1 A 14 14 TYR CB C 368 35.879 37.970 -2.091 1
1 164 . 9 1 1 A 14 14 TYR N N 368 120.541 116.174 4.367 1
1 165 . 9 1 1 A 15 15 GLU H H 369 8.287 8.254 0.033 1
1 166 . 9 1 1 A 15 15 GLU HA H 369 4.009 4.369 -0.360 1
1 171 . 9 1 1 A 15 15 GLU C C 369 174.448 178.213 -3.765 1
1 172 . 9 1 1 A 15 15 GLU CA C 369 55.047 58.844 -3.797 1
1 173 . 9 1 1 A 15 15 GLU CB C 369 27.226 29.713 -2.487 1
1 175 . 9 1 1 A 15 15 GLU N N 369 120.398 122.507 -2.109 1
1 176 . 9 1 1 A 16 16 LEU H H 370 7.785 7.942 -0.157 1
1 177 . 9 1 1 A 16 16 LEU HA H 370 4.138 4.285 -0.147 1
1 187 . 9 1 1 A 16 16 LEU C C 370 175.089 177.748 -2.659 1
1 188 . 9 1 1 A 16 16 LEU CA C 370 53.425 55.045 -1.620 1
1 189 . 9 1 1 A 16 16 LEU CB C 370 39.554 41.544 -1.990 1
1 193 . 9 1 1 A 16 16 LEU N N 370 121.323 117.789 3.534 1
1 194 . 9 1 1 A 17 17 TYR H H 371 8.038 8.294 -0.256 1
1 195 . 9 1 1 A 17 17 TYR HA H 371 4.380 4.421 -0.041 1
1 202 . 9 1 1 A 17 17 TYR C C 371 173.931 175.580 -1.649 1
1 203 . 9 1 1 A 17 17 TYR CA C 371 56.143 60.548 -4.405 1
1 204 . 9 1 1 A 17 17 TYR CB C 371 35.501 37.615 -2.114 1
1 207 . 9 1 1 A 17 17 TYR N N 371 119.465 119.501 -0.036 1
1 208 . 9 1 1 A 18 18 CYS H H 372 8.021 7.118 0.903 1
1 209 . 9 1 1 A 18 18 CYS HA H 372 4.236 4.628 -0.392 1
1 212 . 9 1 1 A 18 18 CYS C C 372 172.457 173.187 -0.730 1
1 213 . 9 1 1 A 18 18 CYS CA C 372 56.997 56.731 0.266 1
1 214 . 9 1 1 A 18 18 CYS CB C 372 25.080 29.992 -4.912 1
1 215 . 9 1 1 A 18 18 CYS N N 372 119.913 119.140 0.773 1
1 216 . 9 1 1 A 19 19 GLU H H 373 8.151 8.745 -0.594 1
1 217 . 9 1 1 A 19 19 GLU HA H 373 4.130 4.537 -0.407 1
1 222 . 9 1 1 A 19 19 GLU C C 373 174.151 177.613 -3.462 1
1 223 . 9 1 1 A 19 19 GLU CA C 373 54.535 55.045 -0.510 1
1 224 . 9 1 1 A 19 19 GLU CB C 373 27.244 31.079 -3.835 1
1 226 . 9 1 1 A 19 19 GLU N N 373 122.431 124.448 -2.017 1
1 227 . 9 1 1 A 20 20 MET H H 374 8.109 8.959 -0.850 1
1 228 . 9 1 1 A 20 20 MET HA H 374 4.352 4.553 -0.201 1
1 236 . 9 1 1 A 20 20 MET C C 374 174.200 175.703 -1.503 1
1 237 . 9 1 1 A 20 20 MET CA C 374 53.238 55.310 -2.072 1
1 238 . 9 1 1 A 20 20 MET CB C 374 30.237 34.020 -3.783 1
1 241 . 9 1 1 A 20 20 MET N N 374 119.754 122.096 -2.342 1
1 242 . 9 1 1 A 21 21 GLY H H 375 8.231 7.442 0.789 1
1 243 . 9 1 1 A 21 21 GLY HA2 H 375 3.861 4.079 -0.218 1
1 244 . 9 1 1 A 21 21 GLY HA3 H 375 3.960 4.084 -0.124 1
1 245 . 9 1 1 A 21 21 GLY C C 375 171.928 171.961 -0.033 1
1 246 . 9 1 1 A 21 21 GLY CA C 375 42.930 45.931 -3.001 1
1 247 . 9 1 1 A 21 21 GLY N N 375 109.484 107.985 1.499 1
1 248 . 9 1 1 A 22 22 SER HA H 376 4.492 4.854 -0.362 1
1 251 . 9 1 1 A 22 22 SER C C 376 172.206 174.353 -2.147 1
1 252 . 9 1 1 A 22 22 SER CA C 376 55.570 58.781 -3.211 1
1 253 . 9 1 1 A 22 22 SER CB C 376 61.525 63.224 -1.699 1
1 254 . 9 1 1 A 23 23 THR H H 377 8.470 8.736 -0.266 1
1 255 . 9 1 1 A 23 23 THR HA H 377 4.295 4.255 0.040 1
1 260 . 9 1 1 A 23 23 THR C C 377 171.811 175.642 -3.831 1
1 261 . 9 1 1 A 23 23 THR CA C 377 58.937 63.888 -4.951 1
1 262 . 9 1 1 A 23 23 THR CB C 377 67.250 69.414 -2.164 1
1 264 . 9 1 1 A 23 23 THR N N 377 124.043 122.397 1.646 1
1 265 . 9 1 1 A 24 24 PHE H H 378 8.374 9.204 -0.830 1
1 266 . 9 1 1 A 24 24 PHE HA H 378 4.239 4.111 0.128 1
1 273 . 9 1 1 A 24 24 PHE C C 378 173.411 177.106 -3.695 1
1 274 . 9 1 1 A 24 24 PHE CA C 378 56.697 62.472 -5.775 1
1 275 . 9 1 1 A 24 24 PHE CB C 378 36.538 39.665 -3.127 1
1 278 . 9 1 1 A 24 24 PHE N N 378 124.732 125.153 -0.421 1
1 279 . 9 1 1 A 25 25 GLN H H 379 8.457 8.001 0.456 1
1 280 . 9 1 1 A 25 25 GLN HA H 379 4.038 4.105 -0.067 1
1 287 . 9 1 1 A 25 25 GLN C C 379 172.431 177.230 -4.799 1
1 288 . 9 1 1 A 25 25 GLN CA C 379 54.078 58.799 -4.721 1
1 289 . 9 1 1 A 25 25 GLN CB C 379 26.414 28.655 -2.241 1
1 291 . 9 1 1 A 25 25 GLN N N 379 118.820 118.354 0.466 1
1 293 . 9 1 1 A 26 26 LEU H H 380 6.985 7.409 -0.424 1
1 294 . 9 1 1 A 26 26 LEU HA H 380 4.229 4.142 0.087 1
1 304 . 9 1 1 A 26 26 LEU C C 380 173.895 176.931 -3.036 1
1 305 . 9 1 1 A 26 26 LEU CA C 380 52.123 55.161 -3.038 1
1 306 . 9 1 1 A 26 26 LEU CB C 380 40.543 42.545 -2.002 1
1 310 . 9 1 1 A 26 26 LEU N N 380 119.079 120.209 -1.130 1
1 311 . 9 1 1 A 27 27 CYS H H 381 8.905 9.165 -0.260 1
1 312 . 9 1 1 A 27 27 CYS HA H 381 4.013 4.455 -0.442 1
1 315 . 9 1 1 A 27 27 CYS C C 381 174.439 176.270 -1.831 1
1 316 . 9 1 1 A 27 27 CYS CA C 381 57.847 59.801 -1.954 1
1 317 . 9 1 1 A 27 27 CYS CB C 381 28.648 28.651 -0.003 1
1 318 . 9 1 1 A 27 27 CYS N N 381 125.151 123.802 1.349 1
1 319 . 9 1 1 A 28 28 LYS H H 382 9.351 9.035 0.316 1
1 320 . 9 1 1 A 28 28 LYS HA H 382 4.157 4.259 -0.102 1
1 329 . 9 1 1 A 28 28 LYS C C 382 174.678 178.392 -3.714 1
1 330 . 9 1 1 A 28 28 LYS CA C 382 54.324 58.284 -3.960 1
1 331 . 9 1 1 A 28 28 LYS CB C 382 30.086 32.306 -2.220 1
1 335 . 9 1 1 A 28 28 LYS N N 382 128.840 128.006 0.834 1
1 336 . 9 1 1 A 29 29 ILE H H 383 9.040 7.824 1.216 1
1 337 . 9 1 1 A 29 29 ILE HA H 383 3.804 3.635 0.169 1
1 347 . 9 1 1 A 29 29 ILE C C 383 174.239 177.329 -3.090 1
1 348 . 9 1 1 A 29 29 ILE CA C 383 62.114 64.797 -2.683 1
1 349 . 9 1 1 A 29 29 ILE CB C 383 33.870 38.284 -4.414 1
1 353 . 9 1 1 A 29 29 ILE N N 383 122.718 118.510 4.208 1
1 354 . 9 1 1 A 30 30 CYS H H 384 7.572 7.666 -0.094 1
1 355 . 9 1 1 A 30 30 CYS HA H 384 4.548 4.412 0.136 1
1 358 . 9 1 1 A 30 30 CYS C C 384 172.978 175.099 -2.121 1
1 359 . 9 1 1 A 30 30 CYS CA C 384 54.957 59.650 -4.693 1
1 360 . 9 1 1 A 30 30 CYS CB C 384 29.778 29.338 0.440 1
1 361 . 9 1 1 A 30 30 CYS N N 384 116.356 115.593 0.763 1
1 362 . 9 1 1 A 31 31 ALA H H 385 8.205 8.341 -0.136 1
1 363 . 9 1 1 A 31 31 ALA HA H 385 4.107 4.108 -0.001 1
1 367 . 9 1 1 A 31 31 ALA C C 385 173.139 177.215 -4.076 1
1 368 . 9 1 1 A 31 31 ALA CA C 385 50.802 53.499 -2.697 1
1 369 . 9 1 1 A 31 31 ALA CB C 385 14.634 17.853 -3.219 1
1 370 . 9 1 1 A 31 31 ALA N N 385 125.526 121.168 4.358 1
1 371 . 9 1 1 A 32 32 GLU H H 386 8.416 8.186 0.230 1
1 372 . 9 1 1 A 32 32 GLU HA H 386 4.467 4.435 0.032 1
1 377 . 9 1 1 A 32 32 GLU C C 386 172.325 176.189 -3.864 1
1 378 . 9 1 1 A 32 32 GLU CA C 386 55.146 57.174 -2.028 1
1 379 . 9 1 1 A 32 32 GLU CB C 386 31.181 31.880 -0.699 1
1 381 . 9 1 1 A 32 32 GLU N N 386 117.579 115.371 2.208 1
1 382 . 9 1 1 A 33 33 ASN H H 387 7.872 7.790 0.082 1
1 383 . 9 1 1 A 33 33 ASN HA H 387 4.900 4.975 -0.075 1
1 388 . 9 1 1 A 33 33 ASN C C 387 171.355 175.007 -3.652 1
1 389 . 9 1 1 A 33 33 ASN CA C 387 49.320 51.868 -2.548 1
1 390 . 9 1 1 A 33 33 ASN CB C 387 38.457 39.969 -1.512 1
1 391 . 9 1 1 A 33 33 ASN N N 387 120.399 116.229 4.170 1
1 393 . 9 1 1 A 34 34 ASP H H 388 8.565 8.563 0.002 1
1 394 . 9 1 1 A 34 34 ASP HA H 388 4.679 4.784 -0.105 1
1 397 . 9 1 1 A 34 34 ASP C C 388 174.243 175.490 -1.247 1
1 398 . 9 1 1 A 34 34 ASP CA C 388 51.809 53.744 -1.935 1
1 399 . 9 1 1 A 34 34 ASP CB C 388 38.007 42.100 -4.093 1
1 400 . 9 1 1 A 34 34 ASP N N 388 120.661 120.470 0.191 1
1 401 . 9 1 1 A 35 35 LYS H H 389 8.544 8.905 -0.361 1
1 402 . 9 1 1 A 35 35 LYS HA H 389 3.411 4.235 -0.824 1
1 409 . 9 1 1 A 35 35 LYS C C 389 172.938 176.661 -3.723 1
1 410 . 9 1 1 A 35 35 LYS CA C 389 54.973 56.207 -1.234 1
1 411 . 9 1 1 A 35 35 LYS CB C 389 30.617 31.610 -0.993 1
1 415 . 9 1 1 A 35 35 LYS N N 389 119.199 120.572 -1.373 1
1 416 . 9 1 1 A 36 36 ASP H H 390 8.327 8.660 -0.333 1
1 417 . 9 1 1 A 36 36 ASP HA H 390 4.724 4.899 -0.175 1
1 420 . 9 1 1 A 36 36 ASP C C 390 172.860 175.343 -2.483 1
1 421 . 9 1 1 A 36 36 ASP CA C 390 51.609 53.632 -2.023 1
1 422 . 9 1 1 A 36 36 ASP CB C 390 39.018 41.353 -2.335 1
1 423 . 9 1 1 A 36 36 ASP N N 390 119.134 120.865 -1.731 1
1 424 . 9 1 1 A 37 37 VAL H H 391 8.544 7.614 0.930 1
1 425 . 9 1 1 A 37 37 VAL HA H 391 4.877 4.808 0.069 1
1 433 . 9 1 1 A 37 37 VAL C C 391 167.519 173.102 -5.583 1
1 434 . 9 1 1 A 37 37 VAL CA C 391 58.259 59.939 -1.680 1
1 435 . 9 1 1 A 37 37 VAL CB C 391 32.277 35.387 -3.110 1
1 438 . 9 1 1 A 37 37 VAL N N 391 121.970 119.268 2.702 1
1 439 . 9 1 1 A 38 38 LYS H H 392 8.621 9.646 -1.025 1
1 440 . 9 1 1 A 38 38 LYS HA H 392 4.991 5.359 -0.368 1
1 449 . 9 1 1 A 38 38 LYS C C 392 172.681 175.205 -2.524 1
1 450 . 9 1 1 A 38 38 LYS CA C 392 51.123 54.707 -3.584 1
1 451 . 9 1 1 A 38 38 LYS CB C 392 33.697 34.653 -0.956 1
1 455 . 9 1 1 A 38 38 LYS N N 392 126.381 128.908 -2.527 1
1 456 . 9 1 1 A 39 39 ILE H H 393 8.723 9.119 -0.396 1
1 457 . 9 1 1 A 39 39 ILE HA H 393 4.239 4.408 -0.169 1
1 467 . 9 1 1 A 39 39 ILE C C 393 172.642 175.590 -2.948 1
1 468 . 9 1 1 A 39 39 ILE CA C 393 57.768 61.095 -3.327 1
1 469 . 9 1 1 A 39 39 ILE CB C 393 35.691 37.425 -1.734 1
1 473 . 9 1 1 A 39 39 ILE N N 393 126.398 127.754 -1.356 1
1 474 . 9 1 1 A 40 40 GLU H H 394 8.506 9.446 -0.940 1
1 475 . 9 1 1 A 40 40 GLU HA H 394 4.753 4.771 -0.018 1
1 480 . 9 1 1 A 40 40 GLU C C 394 173.596 176.323 -2.727 1
1 481 . 9 1 1 A 40 40 GLU CA C 394 49.793 53.199 -3.406 1
1 482 . 9 1 1 A 40 40 GLU CB C 394 28.210 30.671 -2.461 1
1 484 . 9 1 1 A 40 40 GLU N N 394 124.864 128.262 -3.398 1
1 485 . 9 1 1 A 41 41 PRO HA H 395 4.864 4.490 0.374 1
1 492 . 9 1 1 A 41 41 PRO C C 395 175.073 176.990 -1.917 1
1 493 . 9 1 1 A 41 41 PRO CA C 395 61.111 63.873 -2.762 1
1 494 . 9 1 1 A 41 41 PRO CB C 395 32.275 32.897 -0.622 1
1 497 . 9 1 1 A 42 42 CYS H H 396 7.828 7.825 0.003 1
1 498 . 9 1 1 A 42 42 CYS HA H 396 4.208 4.053 0.155 1
1 501 . 9 1 1 A 42 42 CYS C C 396 173.877 175.076 -1.199 1
1 502 . 9 1 1 A 42 42 CYS CA C 396 58.021 61.323 -3.302 1
1 503 . 9 1 1 A 42 42 CYS CB C 396 28.242 27.489 0.753 1
1 504 . 9 1 1 A 42 42 CYS N N 396 122.434 117.865 4.569 1
1 505 . 9 1 1 A 43 43 GLY H H 397 8.679 8.833 -0.154 1
1 506 . 9 1 1 A 43 43 GLY HA2 H 397 3.507 3.946 -0.439 1
1 507 . 9 1 1 A 43 43 GLY HA3 H 397 3.914 3.952 -0.038 1
1 508 . 9 1 1 A 43 43 GLY C C 397 171.981 174.619 -2.638 1
1 509 . 9 1 1 A 43 43 GLY CA C 397 43.347 46.204 -2.857 1
1 510 . 9 1 1 A 43 43 GLY N N 397 112.123 108.487 3.636 1
1 511 . 9 1 1 A 44 44 HIS H H 398 8.329 7.465 0.864 1
1 512 . 9 1 1 A 44 44 HIS HA H 398 4.339 4.556 -0.217 1
1 517 . 9 1 1 A 44 44 HIS C C 398 170.742 174.493 -3.751 1
1 518 . 9 1 1 A 44 44 HIS CA C 398 58.368 56.144 2.224 1
1 519 . 9 1 1 A 44 44 HIS CB C 398 28.434 31.376 -2.942 1
1 522 . 9 1 1 A 44 44 HIS N N 398 121.393 116.989 4.404 1
1 523 . 9 1 1 A 45 45 LEU H H 399 8.241 8.868 -0.627 1
1 524 . 9 1 1 A 45 45 LEU HA H 399 5.570 5.085 0.485 1
1 534 . 9 1 1 A 45 45 LEU C C 399 174.464 175.240 -0.776 1
1 535 . 9 1 1 A 45 45 LEU CA C 399 50.729 53.390 -2.661 1
1 536 . 9 1 1 A 45 45 LEU CB C 399 43.574 43.393 0.181 1
1 540 . 9 1 1 A 45 45 LEU N N 399 118.469 122.716 -4.247 1
1 541 . 9 1 1 A 46 46 MET H H 400 8.707 8.806 -0.099 1
1 542 . 9 1 1 A 46 46 MET HA H 400 4.842 5.025 -0.183 1
1 550 . 9 1 1 A 46 46 MET C C 400 170.736 174.366 -3.630 1
1 551 . 9 1 1 A 46 46 MET CA C 400 52.804 53.984 -1.180 1
1 552 . 9 1 1 A 46 46 MET CB C 400 31.945 35.294 -3.349 1
1 555 . 9 1 1 A 46 46 MET N N 400 114.897 120.632 -5.735 1
1 556 . 9 1 1 A 47 47 CYS H H 401 9.436 8.270 1.166 1
1 557 . 9 1 1 A 47 47 CYS HA H 401 5.629 5.196 0.433 1
1 560 . 9 1 1 A 47 47 CYS C C 401 173.909 176.141 -2.232 1
1 561 . 9 1 1 A 47 47 CYS CA C 401 54.325 56.950 -2.625 1
1 562 . 9 1 1 A 47 47 CYS CB C 401 30.725 29.376 1.349 1
1 563 . 9 1 1 A 47 47 CYS N N 401 119.575 119.114 0.461 1
1 564 . 9 1 1 A 48 48 THR H H 402 9.842 9.371 0.471 1
1 565 . 9 1 1 A 48 48 THR HA H 402 3.768 3.972 -0.204 1
1 570 . 9 1 1 A 48 48 THR C C 402 174.333 176.195 -1.862 1
1 571 . 9 1 1 A 48 48 THR CA C 402 64.516 65.884 -1.368 1
1 572 . 9 1 1 A 48 48 THR CB C 402 66.288 68.642 -2.354 1
1 574 . 9 1 1 A 48 48 THR N N 402 119.945 119.080 0.865 1
1 575 . 9 1 1 A 49 49 SER H H 403 8.355 8.058 0.297 1
1 576 . 9 1 1 A 49 49 SER HA H 403 4.222 4.084 0.138 1
1 579 . 9 1 1 A 49 49 SER C C 403 175.059 177.004 -1.945 1
1 580 . 9 1 1 A 49 49 SER CA C 403 59.828 61.955 -2.127 1
1 581 . 9 1 1 A 49 49 SER CB C 403 59.717 62.749 -3.032 1
1 582 . 9 1 1 A 49 49 SER N N 403 120.468 117.137 3.331 1
1 583 . 9 1 1 A 50 50 CYS H H 404 9.464 7.847 1.617 1
1 584 . 9 1 1 A 50 50 CYS HA H 404 3.922 4.137 -0.215 1
1 587 . 9 1 1 A 50 50 CYS C C 404 176.081 176.955 -0.874 1
1 588 . 9 1 1 A 50 50 CYS CA C 404 63.076 64.225 -1.149 1
1 589 . 9 1 1 A 50 50 CYS CB C 404 26.078 27.259 -1.181 1
1 590 . 9 1 1 A 50 50 CYS N N 404 126.744 119.757 6.987 1
1 591 . 9 1 1 A 51 51 LEU H H 405 7.948 8.103 -0.155 1
1 592 . 9 1 1 A 51 51 LEU HA H 405 4.064 4.150 -0.086 1
1 602 . 9 1 1 A 51 51 LEU C C 405 175.495 178.705 -3.210 1
1 603 . 9 1 1 A 51 51 LEU CA C 405 55.914 58.207 -2.293 1
1 604 . 9 1 1 A 51 51 LEU CB C 405 38.662 41.982 -3.320 1
1 607 . 9 1 1 A 51 51 LEU N N 405 121.951 123.110 -1.159 1
1 608 . 9 1 1 A 52 52 THR H H 406 8.786 8.605 0.181 1
1 609 . 9 1 1 A 52 52 THR HA H 406 4.024 3.878 0.146 1
1 614 . 9 1 1 A 52 52 THR C C 406 174.139 176.264 -2.125 1
1 615 . 9 1 1 A 52 52 THR CA C 406 64.017 66.216 -2.199 1
1 616 . 9 1 1 A 52 52 THR CB C 406 66.115 68.523 -2.408 1
1 618 . 9 1 1 A 52 52 THR N N 406 115.258 114.664 0.594 1
1 619 . 9 1 1 A 53 53 SER H H 407 8.115 8.076 0.039 1
1 620 . 9 1 1 A 53 53 SER HA H 407 4.204 4.156 0.048 1
1 623 . 9 1 1 A 53 53 SER C C 407 174.456 176.985 -2.529 1
1 624 . 9 1 1 A 53 53 SER CA C 407 59.090 61.325 -2.235 1
1 625 . 9 1 1 A 53 53 SER CB C 407 60.146 63.182 -3.036 1
1 626 . 9 1 1 A 53 53 SER N N 407 116.852 115.285 1.567 1
1 627 . 9 1 1 A 54 54 TRP H H 408 8.123 7.742 0.381 1
1 628 . 9 1 1 A 54 54 TRP HA H 408 4.371 4.271 0.100 1
1 637 . 9 1 1 A 54 54 TRP C C 408 175.981 178.393 -2.412 1
1 638 . 9 1 1 A 54 54 TRP CA C 408 57.323 60.855 -3.532 1
1 639 . 9 1 1 A 54 54 TRP CB C 408 26.812 29.566 -2.754 1
1 645 . 9 1 1 A 54 54 TRP N N 408 123.556 122.545 1.011 1
1 647 . 9 1 1 A 55 55 GLN H H 409 8.502 8.918 -0.416 1
1 648 . 9 1 1 A 55 55 GLN HA H 409 3.999 3.736 0.263 1
1 655 . 9 1 1 A 55 55 GLN C C 409 177.300 178.449 -1.149 1
1 656 . 9 1 1 A 55 55 GLN CA C 409 56.484 59.271 -2.787 1
1 657 . 9 1 1 A 55 55 GLN CB C 409 26.190 28.718 -2.528 1
1 659 . 9 1 1 A 55 55 GLN N N 409 118.044 118.534 -0.490 1
1 661 . 9 1 1 A 56 56 GLU H H 410 8.467 8.544 -0.077 1
1 662 . 9 1 1 A 56 56 GLU HA H 410 4.057 4.122 -0.065 1
1 667 . 9 1 1 A 56 56 GLU C C 410 174.787 176.615 -1.828 1
1 668 . 9 1 1 A 56 56 GLU CA C 410 55.909 58.181 -2.272 1
1 669 . 9 1 1 A 56 56 GLU CB C 410 26.895 29.292 -2.397 1
1 671 . 9 1 1 A 56 56 GLU N N 410 119.448 117.764 1.684 1
1 672 . 9 1 1 A 57 57 SER H H 411 7.438 7.583 -0.145 1
1 673 . 9 1 1 A 57 57 SER HA H 411 4.607 4.601 0.006 1
1 676 . 9 1 1 A 57 57 SER C C 411 170.849 173.894 -3.045 1
1 677 . 9 1 1 A 57 57 SER CA C 411 55.540 57.152 -1.612 1
1 678 . 9 1 1 A 57 57 SER CB C 411 60.928 63.310 -2.382 1
1 679 . 9 1 1 A 57 57 SER N N 411 113.752 115.626 -1.874 1
1 680 . 9 1 1 A 58 58 GLU H H 412 7.855 7.698 0.157 1
1 681 . 9 1 1 A 58 58 GLU HA H 412 3.772 3.898 -0.126 1
1 686 . 9 1 1 A 58 58 GLU C C 412 173.743 175.680 -1.937 1
1 687 . 9 1 1 A 58 58 GLU CA C 412 54.442 56.801 -2.359 1
1 688 . 9 1 1 A 58 58 GLU CB C 412 24.603 28.175 -3.572 1
1 690 . 9 1 1 A 58 58 GLU N N 412 115.908 118.182 -2.274 1
1 691 . 9 1 1 A 59 59 GLY H H 413 7.588 8.273 -0.685 1
1 692 . 9 1 1 A 59 59 GLY HA2 H 413 1.643 2.854 -1.211 1
1 693 . 9 1 1 A 59 59 GLY HA3 H 413 2.949 3.749 -0.800 1
1 694 . 9 1 1 A 59 59 GLY C C 413 170.850 172.925 -2.075 1
1 695 . 9 1 1 A 59 59 GLY CA C 413 41.724 46.235 -4.511 1
1 696 . 9 1 1 A 59 59 GLY N N 413 108.032 111.292 -3.260 1
1 697 . 9 1 1 A 60 60 GLN H H 414 7.973 8.055 -0.082 1
1 698 . 9 1 1 A 60 60 GLN HA H 414 4.366 4.702 -0.336 1
1 705 . 9 1 1 A 60 60 GLN C C 414 173.108 176.208 -3.100 1
1 706 . 9 1 1 A 60 60 GLN CA C 414 52.422 55.778 -3.356 1
1 707 . 9 1 1 A 60 60 GLN CB C 414 27.049 27.377 -0.328 1
1 709 . 9 1 1 A 60 60 GLN N N 414 122.690 124.907 -2.217 1
1 711 . 9 1 1 A 61 61 GLY H H 415 8.301 8.209 0.092 1
1 712 . 9 1 1 A 61 61 GLY HA2 H 415 3.700 4.201 -0.501 1
1 713 . 9 1 1 A 61 61 GLY HA3 H 415 3.920 4.236 -0.316 1
1 714 . 9 1 1 A 61 61 GLY C C 415 170.249 174.339 -4.090 1
1 715 . 9 1 1 A 61 61 GLY CA C 415 42.210 44.677 -2.467 1
1 716 . 9 1 1 A 61 61 GLY N N 415 110.794 114.085 -3.291 1
1 717 . 9 1 1 A 62 62 CYS H H 416 8.549 8.826 -0.277 1
1 718 . 9 1 1 A 62 62 CYS HA H 416 4.227 4.666 -0.439 1
1 721 . 9 1 1 A 62 62 CYS C C 416 172.914 175.425 -2.511 1
1 722 . 9 1 1 A 62 62 CYS CA C 416 54.008 58.599 -4.591 1
1 723 . 9 1 1 A 62 62 CYS CB C 416 29.716 27.282 2.434 1
1 724 . 9 1 1 A 62 62 CYS N N 416 123.683 120.674 3.009 1
1 725 . 9 1 1 A 63 63 PRO HA H 417 2.611 2.990 -0.379 1
1 732 . 9 1 1 A 63 63 PRO C C 417 174.143 177.982 -3.839 1
1 733 . 9 1 1 A 63 63 PRO CA C 417 61.689 63.809 -2.120 1
1 734 . 9 1 1 A 63 63 PRO CB C 417 28.534 31.175 -2.641 1
1 737 . 9 1 1 A 64 64 PHE H H 418 8.968 7.769 1.199 1
1 738 . 9 1 1 A 64 64 PHE HA H 418 4.250 4.110 0.140 1
1 746 . 9 1 1 A 64 64 PHE C C 418 174.243 177.640 -3.397 1
1 747 . 9 1 1 A 64 64 PHE CA C 418 56.720 60.102 -3.382 1
1 748 . 9 1 1 A 64 64 PHE CB C 418 36.458 39.240 -2.782 1
1 752 . 9 1 1 A 64 64 PHE N N 418 117.008 115.723 1.285 1
1 753 . 9 1 1 A 65 65 CYS H H 419 7.968 7.902 0.066 1
1 754 . 9 1 1 A 65 65 CYS HA H 419 4.906 4.559 0.347 1
1 757 . 9 1 1 A 65 65 CYS C C 419 173.198 174.356 -1.158 1
1 758 . 9 1 1 A 65 65 CYS CA C 419 55.870 59.191 -3.321 1
1 759 . 9 1 1 A 65 65 CYS CB C 419 30.559 28.133 2.426 1
1 760 . 9 1 1 A 65 65 CYS N N 419 117.505 117.696 -0.191 1
1 761 . 9 1 1 A 66 66 ARG H H 420 8.761 8.056 0.705 1
1 762 . 9 1 1 A 66 66 ARG HA H 420 4.365 4.309 0.056 1
1 769 . 9 1 1 A 66 66 ARG C C 420 172.921 174.813 -1.892 1
1 770 . 9 1 1 A 66 66 ARG CA C 420 54.763 57.212 -2.449 1
1 771 . 9 1 1 A 66 66 ARG CB C 420 24.286 27.012 -2.726 1
1 774 . 9 1 1 A 66 66 ARG N N 420 118.763 117.106 1.657 1
1 775 . 9 1 1 A 67 67 CYS H H 421 8.223 7.876 0.347 1
1 776 . 9 1 1 A 67 67 CYS HA H 421 4.419 4.592 -0.173 1
1 779 . 9 1 1 A 67 67 CYS C C 421 171.160 174.797 -3.637 1
1 780 . 9 1 1 A 67 67 CYS CA C 421 57.119 58.021 -0.902 1
1 781 . 9 1 1 A 67 67 CYS CB C 421 25.911 29.883 -3.972 1
1 782 . 9 1 1 A 67 67 CYS N N 421 120.627 116.618 4.009 1
1 783 . 9 1 1 A 68 68 GLU H H 422 8.416 8.576 -0.160 1
1 784 . 9 1 1 A 68 68 GLU HA H 422 4.025 4.215 -0.190 1
1 789 . 9 1 1 A 68 68 GLU C C 422 173.764 176.441 -2.677 1
1 790 . 9 1 1 A 68 68 GLU CA C 422 54.752 57.971 -3.219 1
1 791 . 9 1 1 A 68 68 GLU CB C 422 27.302 30.131 -2.829 1
1 793 . 9 1 1 A 68 68 GLU N N 422 122.370 120.572 1.798 1
1 794 . 9 1 1 A 69 69 ILE H H 423 8.648 8.752 -0.104 1
1 795 . 9 1 1 A 69 69 ILE HA H 423 4.012 4.543 -0.531 1
1 805 . 9 1 1 A 69 69 ILE C C 423 174.257 175.303 -1.046 1
1 806 . 9 1 1 A 69 69 ILE CA C 423 59.740 60.600 -0.860 1
1 807 . 9 1 1 A 69 69 ILE CB C 423 35.846 39.889 -4.043 1
1 811 . 9 1 1 A 69 69 ILE N N 423 125.988 123.699 2.289 1
1 812 . 9 1 1 A 70 70 LYS H H 424 9.185 9.125 0.060 1
1 813 . 9 1 1 A 70 70 LYS HA H 424 4.434 4.463 -0.029 1
1 822 . 9 1 1 A 70 70 LYS C C 424 173.880 176.309 -2.429 1
1 823 . 9 1 1 A 70 70 LYS CA C 424 53.378 57.117 -3.739 1
1 824 . 9 1 1 A 70 70 LYS CB C 424 30.397 34.880 -4.483 1
1 828 . 9 1 1 A 70 70 LYS N N 424 128.977 129.253 -0.276 1
1 829 . 9 1 1 A 71 71 GLY H H 425 7.810 8.149 -0.339 1
1 830 . 9 1 1 A 71 71 GLY HA2 H 425 4.094 4.140 -0.046 1
1 831 . 9 1 1 A 71 71 GLY HA3 H 425 4.159 4.143 0.016 1
1 832 . 9 1 1 A 71 71 GLY C C 425 168.179 172.610 -4.431 1
1 833 . 9 1 1 A 71 71 GLY CA C 425 42.326 44.460 -2.134 1
1 834 . 9 1 1 A 71 71 GLY N N 425 107.696 107.224 0.472 1
1 835 . 9 1 1 A 72 72 THR H H 426 8.048 8.526 -0.478 1
1 836 . 9 1 1 A 72 72 THR HA H 426 5.258 5.517 -0.259 1
1 841 . 9 1 1 A 72 72 THR C C 426 170.979 173.225 -2.246 1
1 842 . 9 1 1 A 72 72 THR CA C 426 56.755 60.251 -3.496 1
1 843 . 9 1 1 A 72 72 THR CB C 426 69.226 71.462 -2.236 1
1 845 . 9 1 1 A 72 72 THR N N 426 109.122 111.073 -1.951 1
1 846 . 9 1 1 A 73 73 GLU H H 427 8.912 9.053 -0.141 1
1 847 . 9 1 1 A 73 73 GLU HA H 427 4.954 4.767 0.187 1
1 852 . 9 1 1 A 73 73 GLU C C 427 170.353 173.968 -3.615 1
1 853 . 9 1 1 A 73 73 GLU CA C 427 50.182 52.986 -2.804 1
1 854 . 9 1 1 A 73 73 GLU CB C 427 30.559 31.710 -1.151 1
1 856 . 9 1 1 A 73 73 GLU N N 427 121.703 122.896 -1.193 1
1 1 . 9 1 1 A 74 74 PRO HA H 428 4.372 4.887 -0.515 1
1 2 . 9 1 1 A 74 74 PRO C C 428 173.839 176.087 -2.248 1
1 3 . 9 1 1 A 74 74 PRO CA C 428 60.241 62.715 -2.474 1
1 4 . 9 1 1 A 74 74 PRO CB C 428 29.299 32.431 -3.132 1
1 857 . 9 1 1 A 74 74 PRO HA H 428 4.782 4.887 -0.105 1
1 864 . 9 1 1 A 74 74 PRO C C 428 174.027 176.087 -2.060 1
1 865 . 9 1 1 A 74 74 PRO CA C 428 59.771 62.715 -2.944 1
1 866 . 9 1 1 A 74 74 PRO CB C 428 29.633 32.431 -2.798 1
1 7 . 9 1 1 A 75 75 ILE H H 429 8.144 8.608 -0.464 1
1 8 . 9 1 1 A 75 75 ILE HA H 429 4.086 4.810 -0.724 1
1 15 . 9 1 1 A 75 75 ILE C C 429 173.426 175.029 -1.603 1
1 16 . 9 1 1 A 75 75 ILE CA C 429 58.339 59.596 -1.257 1
1 17 . 9 1 1 A 75 75 ILE CB C 429 35.988 41.011 -5.023 1
1 21 . 9 1 1 A 75 75 ILE N N 429 121.551 120.867 0.684 1
1 869 . 9 1 1 A 75 75 ILE H H 429 7.682 8.608 -0.926 1
1 870 . 9 1 1 A 75 75 ILE HA H 429 4.282 4.810 -0.528 1
1 880 . 9 1 1 A 75 75 ILE C C 429 172.510 175.029 -2.519 1
1 881 . 9 1 1 A 75 75 ILE CA C 429 57.456 59.596 -2.140 1
1 882 . 9 1 1 A 75 75 ILE CB C 429 37.903 41.011 -3.108 1
1 886 . 9 1 1 A 75 75 ILE N N 429 119.651 120.867 -1.216 1
1 1 . 9 1 1 A 76 76 VAL HA H 430 4.086 4.640 -0.554 1
1 2 . 9 1 1 A 76 76 VAL CA C 430 59.372 60.613 -1.241 1
1 22 . 9 1 1 A 76 76 VAL H H 430 8.221 8.788 -0.567 1
1 23 . 9 1 1 A 76 76 VAL HA H 430 4.083 4.640 -0.557 1
1 24 . 9 1 1 A 76 76 VAL C C 430 173.067 175.706 -2.639 1
1 25 . 9 1 1 A 76 76 VAL CA C 430 59.445 60.613 -1.168 1
1 26 . 9 1 1 A 76 76 VAL CB C 430 30.407 33.432 -3.025 1
1 27 . 9 1 1 A 76 76 VAL N N 430 125.930 122.732 3.198 1
1 887 . 9 1 1 A 76 76 VAL H H 430 8.122 8.788 -0.666 1
1 888 . 9 1 1 A 76 76 VAL HA H 430 4.197 4.640 -0.443 1
1 890 . 9 1 1 A 76 76 VAL C C 430 172.971 175.706 -2.735 1
1 891 . 9 1 1 A 76 76 VAL CA C 430 58.821 60.613 -1.792 1
1 892 . 9 1 1 A 76 76 VAL CB C 430 30.807 33.432 -2.625 1
1 895 . 9 1 1 A 76 76 VAL N N 430 124.178 122.732 1.446 1
1 4 . 9 1 1 A 77 77 VAL H H 431 8.204 8.586 -0.382 1
1 5 . 9 1 1 A 77 77 VAL HA H 431 4.049 4.578 -0.529 1
1 6 . 9 1 1 A 77 77 VAL C C 431 172.636 175.423 -2.787 1
1 7 . 9 1 1 A 77 77 VAL CA C 431 59.315 60.444 -1.129 1
1 8 . 9 1 1 A 77 77 VAL CB C 431 30.219 32.046 -1.827 1
1 9 . 9 1 1 A 77 77 VAL N N 431 125.320 122.899 2.421 1
1 28 . 9 1 1 A 77 77 VAL H H 431 8.412 8.586 -0.174 1
1 29 . 9 1 1 A 77 77 VAL HA H 431 4.038 4.578 -0.540 1
1 37 . 9 1 1 A 77 77 VAL C C 431 172.617 175.423 -2.806 1
1 38 . 9 1 1 A 77 77 VAL CA C 431 59.137 60.444 -1.307 1
1 39 . 9 1 1 A 77 77 VAL CB C 431 30.292 32.046 -1.754 1
1 42 . 9 1 1 A 77 77 VAL N N 431 125.655 122.899 2.756 1
1 896 . 9 1 1 A 77 77 VAL H H 431 8.448 8.586 -0.138 1
1 897 . 9 1 1 A 77 77 VAL HA H 431 4.087 4.578 -0.491 1
1 905 . 9 1 1 A 77 77 VAL C C 431 172.493 175.423 -2.930 1
1 906 . 9 1 1 A 77 77 VAL CA C 431 59.185 60.444 -1.259 1
1 907 . 9 1 1 A 77 77 VAL CB C 431 30.084 32.046 -1.962 1
1 910 . 9 1 1 A 77 77 VAL N N 431 125.770 122.899 2.871 1
1 43 . 9 1 1 A 78 78 ASP H H 432 8.419 7.533 0.886 1
1 44 . 9 1 1 A 78 78 ASP HA H 432 4.829 4.822 0.007 1
1 45 . 9 1 1 A 78 78 ASP C C 432 172.252 175.723 -3.471 1
1 46 . 9 1 1 A 78 78 ASP CA C 432 49.320 51.969 -2.649 1
1 47 . 9 1 1 A 78 78 ASP CB C 432 39.066 41.039 -1.973 1
1 48 . 9 1 1 A 78 78 ASP N N 432 126.226 124.930 1.296 1
1 911 . 9 1 1 A 78 78 ASP H H 432 8.493 7.533 0.960 1
1 912 . 9 1 1 A 78 78 ASP HA H 432 4.852 4.822 0.030 1
1 915 . 9 1 1 A 78 78 ASP C C 432 172.048 175.723 -3.675 1
1 916 . 9 1 1 A 78 78 ASP CA C 432 49.233 51.969 -2.736 1
1 917 . 9 1 1 A 78 78 ASP CB C 432 38.858 41.039 -2.181 1
1 918 . 9 1 1 A 78 78 ASP N N 432 126.705 124.930 1.775 1
1 10 . 9 1 1 A 79 79 PRO CA C 433 63.865 63.581 0.284 1
1 49 . 9 1 1 A 79 79 PRO C C 433 173.867 177.345 -3.478 1
1 919 . 9 1 1 A 79 79 PRO HA H 433 4.237 4.522 -0.285 1
1 926 . 9 1 1 A 79 79 PRO C C 433 173.812 177.345 -3.533 1
1 927 . 9 1 1 A 79 79 PRO CA C 433 60.627 63.581 -2.954 1
1 928 . 9 1 1 A 79 79 PRO CB C 433 29.329 31.316 -1.987 1
1 11 . 9 1 1 A 80 80 PHE H H 434 8.182 8.191 -0.009 1
1 12 . 9 1 1 A 80 80 PHE HA H 434 4.499 4.212 0.287 1
1 13 . 9 1 1 A 80 80 PHE C C 434 171.680 175.475 -3.795 1
1 14 . 9 1 1 A 80 80 PHE CA C 434 54.657 61.482 -6.825 1
1 15 . 9 1 1 A 80 80 PHE CB C 434 36.272 39.755 -3.483 1
1 16 . 9 1 1 A 80 80 PHE N N 434 118.611 120.075 -1.464 1
1 50 . 9 1 1 A 80 80 PHE H H 434 8.191 8.191 0.000 1
1 51 . 9 1 1 A 80 80 PHE HA H 434 4.528 4.212 0.316 1
1 54 . 9 1 1 A 80 80 PHE C C 434 172.457 175.475 -3.018 1
1 55 . 9 1 1 A 80 80 PHE CA C 434 54.828 61.482 -6.654 1
1 56 . 9 1 1 A 80 80 PHE CB C 434 36.457 39.755 -3.298 1
1 57 . 9 1 1 A 80 80 PHE N N 434 118.871 120.075 -1.204 1
1 931 . 9 1 1 A 80 80 PHE H H 434 8.191 8.191 0.000 1
1 932 . 9 1 1 A 80 80 PHE HA H 434 4.463 4.212 0.251 1
1 939 . 9 1 1 A 80 80 PHE C C 434 172.283 175.475 -3.192 1
1 940 . 9 1 1 A 80 80 PHE CA C 434 54.971 61.482 -6.511 1
1 941 . 9 1 1 A 80 80 PHE CB C 434 36.490 39.755 -3.265 1
1 944 . 9 1 1 A 80 80 PHE N N 434 119.263 120.075 -0.812 1
1 17 . 9 1 1 A 81 81 ASP H H 435 7.490 8.176 -0.686 1
1 18 . 9 1 1 A 81 81 ASP HA H 435 4.698 4.923 -0.225 1
1 19 . 9 1 1 A 81 81 ASP C C 435 171.662 175.330 -3.668 1
1 20 . 9 1 1 A 81 81 ASP CA C 435 49.570 51.152 -1.582 1
1 21 . 9 1 1 A 81 81 ASP CB C 435 40.104 41.425 -1.321 1
1 22 . 9 1 1 A 81 81 ASP N N 435 120.304 117.945 2.359 1
1 58 . 9 1 1 A 81 81 ASP H H 435 7.881 8.176 -0.295 1
1 59 . 9 1 1 A 81 81 ASP HA H 435 4.801 4.923 -0.122 1
1 60 . 9 1 1 A 81 81 ASP C C 435 171.144 175.330 -4.186 1
1 61 . 9 1 1 A 81 81 ASP CA C 435 49.406 51.152 -1.746 1
1 62 . 9 1 1 A 81 81 ASP CB C 435 38.618 41.425 -2.807 1
1 63 . 9 1 1 A 81 81 ASP N N 435 123.108 117.945 5.163 1
1 945 . 9 1 1 A 81 81 ASP H H 435 7.823 8.176 -0.353 1
1 946 . 9 1 1 A 81 81 ASP HA H 435 4.759 4.923 -0.164 1
1 949 . 9 1 1 A 81 81 ASP C C 435 171.057 175.330 -4.273 1
1 950 . 9 1 1 A 81 81 ASP CA C 435 49.174 51.152 -1.978 1
1 951 . 9 1 1 A 81 81 ASP CB C 435 38.725 41.425 -2.700 1
1 952 . 9 1 1 A 81 81 ASP N N 435 123.530 117.945 5.585 1
1 23 . 9 1 1 A 82 82 PRO HA H 436 4.758 4.654 0.104 1
1 24 . 9 1 1 A 82 82 PRO C C 436 172.944 175.351 -2.407 1
1 25 . 9 1 1 A 82 82 PRO CA C 436 60.134 64.003 -3.869 1
1 26 . 9 1 1 A 82 82 PRO CB C 436 31.425 32.938 -1.513 1
1 64 . 9 1 1 A 82 82 PRO HA H 436 4.364 4.654 -0.290 1
1 67 . 9 1 1 A 82 82 PRO C C 436 173.563 175.351 -1.788 1
1 68 . 9 1 1 A 82 82 PRO CA C 436 60.729 64.003 -3.274 1
1 69 . 9 1 1 A 82 82 PRO CB C 436 29.160 32.938 -3.778 1
1 953 . 9 1 1 A 82 82 PRO HA H 436 4.296 4.654 -0.358 1
1 960 . 9 1 1 A 82 82 PRO C C 436 173.494 175.351 -1.857 1
1 961 . 9 1 1 A 82 82 PRO CA C 436 60.625 64.003 -3.378 1
1 962 . 9 1 1 A 82 82 PRO CB C 436 29.237 32.938 -3.701 1
1 1 . 10 1 1 A 3 3 LEU HA H 357 4.257 4.398 -0.141 1
1 11 . 10 1 1 A 3 3 LEU C C 357 174.994 176.236 -1.242 1
1 12 . 10 1 1 A 3 3 LEU CA C 357 53.329 56.294 -2.965 1
1 13 . 10 1 1 A 3 3 LEU CB C 357 39.382 43.641 -4.259 1
1 17 . 10 1 1 A 4 4 GLN H H 358 8.234 7.520 0.714 1
1 18 . 10 1 1 A 4 4 GLN HA H 358 4.211 4.378 -0.167 1
1 25 . 10 1 1 A 4 4 GLN C C 358 173.357 173.058 0.299 1
1 26 . 10 1 1 A 4 4 GLN CA C 358 53.791 55.878 -2.087 1
1 27 . 10 1 1 A 4 4 GLN CB C 358 26.456 29.433 -2.977 1
1 29 . 10 1 1 A 4 4 GLN N N 358 119.506 117.838 1.668 1
1 31 . 10 1 1 A 5 5 ASP H H 359 8.090 8.787 -0.697 1
1 32 . 10 1 1 A 5 5 ASP HA H 359 4.458 5.359 -0.901 1
1 35 . 10 1 1 A 5 5 ASP C C 359 173.492 174.435 -0.943 1
1 36 . 10 1 1 A 5 5 ASP CA C 359 52.309 52.154 0.155 1
1 37 . 10 1 1 A 5 5 ASP CB C 359 38.312 43.585 -5.273 1
1 38 . 10 1 1 A 5 5 ASP N N 359 120.683 123.782 -3.099 1
1 39 . 10 1 1 A 6 6 HIS H H 360 8.103 8.692 -0.589 1
1 40 . 10 1 1 A 6 6 HIS HA H 360 4.540 5.170 -0.630 1
1 45 . 10 1 1 A 6 6 HIS C C 360 172.801 174.964 -2.163 1
1 46 . 10 1 1 A 6 6 HIS CA C 360 53.874 55.237 -1.363 1
1 47 . 10 1 1 A 6 6 HIS CB C 360 27.878 32.346 -4.468 1
1 50 . 10 1 1 A 6 6 HIS N N 360 118.844 120.429 -1.585 1
1 51 . 10 1 1 A 7 7 ILE H H 361 7.862 8.900 -1.038 1
1 52 . 10 1 1 A 7 7 ILE HA H 361 4.010 4.869 -0.859 1
1 62 . 10 1 1 A 7 7 ILE C C 361 173.268 175.339 -2.071 1
1 63 . 10 1 1 A 7 7 ILE CA C 361 58.740 58.722 0.018 1
1 64 . 10 1 1 A 7 7 ILE CB C 361 35.788 41.443 -5.655 1
1 68 . 10 1 1 A 7 7 ILE N N 361 121.598 117.521 4.077 1
1 69 . 10 1 1 A 8 8 LYS H H 362 8.231 9.061 -0.830 1
1 70 . 10 1 1 A 8 8 LYS HA H 362 4.313 4.484 -0.171 1
1 79 . 10 1 1 A 8 8 LYS C C 362 173.899 175.265 -1.366 1
1 80 . 10 1 1 A 8 8 LYS CA C 362 53.677 57.666 -3.989 1
1 81 . 10 1 1 A 8 8 LYS CB C 362 30.355 35.142 -4.787 1
1 85 . 10 1 1 A 8 8 LYS N N 362 124.980 122.823 2.157 1
1 86 . 10 1 1 A 9 9 VAL H H 363 8.044 7.939 0.105 1
1 87 . 10 1 1 A 9 9 VAL HA H 363 4.089 4.420 -0.331 1
1 95 . 10 1 1 A 9 9 VAL C C 363 173.760 175.613 -1.853 1
1 96 . 10 1 1 A 9 9 VAL CA C 363 59.814 59.928 -0.114 1
1 97 . 10 1 1 A 9 9 VAL CB C 363 30.058 34.336 -4.278 1
1 100 . 10 1 1 A 9 9 VAL N N 363 121.366 118.154 3.212 1
1 101 . 10 1 1 A 10 10 THR H H 364 8.076 8.991 -0.915 1
1 102 . 10 1 1 A 10 10 THR HA H 364 4.302 3.902 0.400 1
1 107 . 10 1 1 A 10 10 THR C C 364 172.135 176.321 -4.186 1
1 108 . 10 1 1 A 10 10 THR CA C 364 59.134 66.297 -7.163 1
1 109 . 10 1 1 A 10 10 THR CB C 364 67.415 68.753 -1.338 1
1 111 . 10 1 1 A 10 10 THR N N 364 116.817 123.552 -6.735 1
1 112 . 10 1 1 A 11 11 GLN H H 365 8.463 7.783 0.680 1
1 113 . 10 1 1 A 11 11 GLN HA H 365 4.046 4.329 -0.283 1
1 120 . 10 1 1 A 11 11 GLN C C 365 173.944 175.784 -1.840 1
1 121 . 10 1 1 A 11 11 GLN CA C 365 54.517 57.338 -2.821 1
1 122 . 10 1 1 A 11 11 GLN CB C 365 26.250 29.406 -3.156 1
1 124 . 10 1 1 A 11 11 GLN N N 365 122.059 119.062 2.997 1
1 126 . 10 1 1 A 12 12 GLU H H 366 8.449 8.111 0.338 1
1 127 . 10 1 1 A 12 12 GLU HA H 366 4.093 4.085 0.008 1
1 132 . 10 1 1 A 12 12 GLU C C 366 174.746 176.463 -1.717 1
1 133 . 10 1 1 A 12 12 GLU CA C 366 55.235 57.273 -2.038 1
1 134 . 10 1 1 A 12 12 GLU CB C 366 27.180 28.462 -1.282 1
1 136 . 10 1 1 A 12 12 GLU N N 366 120.415 119.009 1.406 1
1 137 . 10 1 1 A 13 13 GLN H H 367 8.031 8.546 -0.515 1
1 138 . 10 1 1 A 13 13 GLN HA H 367 4.113 4.282 -0.169 1
1 145 . 10 1 1 A 13 13 GLN C C 367 173.693 175.979 -2.286 1
1 146 . 10 1 1 A 13 13 GLN CA C 367 54.132 57.119 -2.987 1
1 147 . 10 1 1 A 13 13 GLN CB C 367 26.420 28.889 -2.469 1
1 149 . 10 1 1 A 13 13 GLN N N 367 119.721 126.511 -6.790 1
1 151 . 10 1 1 A 14 14 TYR H H 368 8.111 7.949 0.162 1
1 152 . 10 1 1 A 14 14 TYR HA H 368 4.339 4.698 -0.359 1
1 159 . 10 1 1 A 14 14 TYR C C 368 173.916 176.494 -2.578 1
1 160 . 10 1 1 A 14 14 TYR CA C 368 56.572 58.240 -1.668 1
1 161 . 10 1 1 A 14 14 TYR CB C 368 35.879 38.009 -2.130 1
1 164 . 10 1 1 A 14 14 TYR N N 368 120.541 118.493 2.048 1
1 165 . 10 1 1 A 15 15 GLU H H 369 8.287 8.247 0.040 1
1 166 . 10 1 1 A 15 15 GLU HA H 369 4.009 4.582 -0.573 1
1 171 . 10 1 1 A 15 15 GLU C C 369 174.448 178.361 -3.913 1
1 172 . 10 1 1 A 15 15 GLU CA C 369 55.047 59.177 -4.130 1
1 173 . 10 1 1 A 15 15 GLU CB C 369 27.226 30.060 -2.834 1
1 175 . 10 1 1 A 15 15 GLU N N 369 120.398 122.798 -2.400 1
1 176 . 10 1 1 A 16 16 LEU H H 370 7.785 7.881 -0.096 1
1 177 . 10 1 1 A 16 16 LEU HA H 370 4.138 4.284 -0.146 1
1 187 . 10 1 1 A 16 16 LEU C C 370 175.089 177.750 -2.661 1
1 188 . 10 1 1 A 16 16 LEU CA C 370 53.425 56.253 -2.828 1
1 189 . 10 1 1 A 16 16 LEU CB C 370 39.554 41.267 -1.713 1
1 193 . 10 1 1 A 16 16 LEU N N 370 121.323 119.477 1.846 1
1 194 . 10 1 1 A 17 17 TYR H H 371 8.038 8.323 -0.285 1
1 195 . 10 1 1 A 17 17 TYR HA H 371 4.380 4.472 -0.092 1
1 202 . 10 1 1 A 17 17 TYR C C 371 173.931 176.905 -2.974 1
1 203 . 10 1 1 A 17 17 TYR CA C 371 56.143 58.230 -2.087 1
1 204 . 10 1 1 A 17 17 TYR CB C 371 35.501 38.400 -2.899 1
1 207 . 10 1 1 A 17 17 TYR N N 371 119.465 119.882 -0.417 1
1 208 . 10 1 1 A 18 18 CYS H H 372 8.021 7.720 0.301 1
1 209 . 10 1 1 A 18 18 CYS HA H 372 4.236 4.145 0.091 1
1 212 . 10 1 1 A 18 18 CYS C C 372 172.457 176.100 -3.643 1
1 213 . 10 1 1 A 18 18 CYS CA C 372 56.997 62.698 -5.701 1
1 214 . 10 1 1 A 18 18 CYS CB C 372 25.080 28.264 -3.184 1
1 215 . 10 1 1 A 18 18 CYS N N 372 119.913 120.496 -0.583 1
1 216 . 10 1 1 A 19 19 GLU H H 373 8.151 7.980 0.171 1
1 217 . 10 1 1 A 19 19 GLU HA H 373 4.130 4.581 -0.451 1
1 222 . 10 1 1 A 19 19 GLU C C 373 174.151 176.418 -2.267 1
1 223 . 10 1 1 A 19 19 GLU CA C 373 54.535 55.593 -1.058 1
1 224 . 10 1 1 A 19 19 GLU CB C 373 27.244 31.077 -3.833 1
1 226 . 10 1 1 A 19 19 GLU N N 373 122.431 116.690 5.741 1
1 227 . 10 1 1 A 20 20 MET H H 374 8.109 7.767 0.342 1
1 228 . 10 1 1 A 20 20 MET HA H 374 4.352 4.284 0.068 1
1 236 . 10 1 1 A 20 20 MET C C 374 174.200 176.045 -1.845 1
1 237 . 10 1 1 A 20 20 MET CA C 374 53.238 57.632 -4.394 1
1 238 . 10 1 1 A 20 20 MET CB C 374 30.237 31.285 -1.048 1
1 241 . 10 1 1 A 20 20 MET N N 374 119.754 117.377 2.377 1
1 242 . 10 1 1 A 21 21 GLY H H 375 8.231 8.648 -0.417 1
1 243 . 10 1 1 A 21 21 GLY HA2 H 375 3.861 3.981 -0.120 1
1 244 . 10 1 1 A 21 21 GLY HA3 H 375 3.960 3.981 -0.021 1
1 245 . 10 1 1 A 21 21 GLY C C 375 171.928 173.478 -1.550 1
1 246 . 10 1 1 A 21 21 GLY CA C 375 42.930 46.237 -3.307 1
1 247 . 10 1 1 A 21 21 GLY N N 375 109.484 110.778 -1.294 1
1 248 . 10 1 1 A 22 22 SER HA H 376 4.492 4.669 -0.177 1
1 251 . 10 1 1 A 22 22 SER C C 376 172.206 173.788 -1.582 1
1 252 . 10 1 1 A 22 22 SER CA C 376 55.570 58.541 -2.971 1
1 253 . 10 1 1 A 22 22 SER CB C 376 61.525 63.061 -1.536 1
1 254 . 10 1 1 A 23 23 THR H H 377 8.470 8.965 -0.495 1
1 255 . 10 1 1 A 23 23 THR HA H 377 4.295 4.326 -0.031 1
1 260 . 10 1 1 A 23 23 THR C C 377 171.811 174.616 -2.805 1
1 261 . 10 1 1 A 23 23 THR CA C 377 58.937 63.465 -4.528 1
1 262 . 10 1 1 A 23 23 THR CB C 377 67.250 67.847 -0.597 1
1 264 . 10 1 1 A 23 23 THR N N 377 124.043 123.283 0.760 1
1 265 . 10 1 1 A 24 24 PHE H H 378 8.374 8.504 -0.130 1
1 266 . 10 1 1 A 24 24 PHE HA H 378 4.239 4.802 -0.563 1
1 273 . 10 1 1 A 24 24 PHE C C 378 173.411 177.371 -3.960 1
1 274 . 10 1 1 A 24 24 PHE CA C 378 56.697 59.497 -2.800 1
1 275 . 10 1 1 A 24 24 PHE CB C 378 36.538 41.515 -4.977 1
1 278 . 10 1 1 A 24 24 PHE N N 378 124.732 127.673 -2.941 1
1 279 . 10 1 1 A 25 25 GLN H H 379 8.457 8.146 0.311 1
1 280 . 10 1 1 A 25 25 GLN HA H 379 4.038 3.865 0.173 1
1 287 . 10 1 1 A 25 25 GLN C C 379 172.431 176.270 -3.839 1
1 288 . 10 1 1 A 25 25 GLN CA C 379 54.078 58.170 -4.092 1
1 289 . 10 1 1 A 25 25 GLN CB C 379 26.414 28.645 -2.231 1
1 291 . 10 1 1 A 25 25 GLN N N 379 118.820 118.536 0.284 1
1 293 . 10 1 1 A 26 26 LEU H H 380 6.985 7.431 -0.446 1
1 294 . 10 1 1 A 26 26 LEU HA H 380 4.229 4.240 -0.011 1
1 304 . 10 1 1 A 26 26 LEU C C 380 173.895 176.683 -2.788 1
1 305 . 10 1 1 A 26 26 LEU CA C 380 52.123 54.701 -2.578 1
1 306 . 10 1 1 A 26 26 LEU CB C 380 40.543 42.170 -1.627 1
1 310 . 10 1 1 A 26 26 LEU N N 380 119.079 120.885 -1.806 1
1 311 . 10 1 1 A 27 27 CYS H H 381 8.905 8.940 -0.035 1
1 312 . 10 1 1 A 27 27 CYS HA H 381 4.013 4.578 -0.565 1
1 315 . 10 1 1 A 27 27 CYS C C 381 174.439 176.516 -2.077 1
1 316 . 10 1 1 A 27 27 CYS CA C 381 57.847 58.488 -0.641 1
1 317 . 10 1 1 A 27 27 CYS CB C 381 28.648 28.487 0.161 1
1 318 . 10 1 1 A 27 27 CYS N N 381 125.151 120.951 4.200 1
1 319 . 10 1 1 A 28 28 LYS H H 382 9.351 9.151 0.200 1
1 320 . 10 1 1 A 28 28 LYS HA H 382 4.157 4.277 -0.120 1
1 329 . 10 1 1 A 28 28 LYS C C 382 174.678 178.313 -3.635 1
1 330 . 10 1 1 A 28 28 LYS CA C 382 54.324 58.395 -4.071 1
1 331 . 10 1 1 A 28 28 LYS CB C 382 30.086 32.304 -2.218 1
1 335 . 10 1 1 A 28 28 LYS N N 382 128.840 128.116 0.724 1
1 336 . 10 1 1 A 29 29 ILE H H 383 9.040 7.914 1.126 1
1 337 . 10 1 1 A 29 29 ILE HA H 383 3.804 3.850 -0.046 1
1 347 . 10 1 1 A 29 29 ILE C C 383 174.239 177.436 -3.197 1
1 348 . 10 1 1 A 29 29 ILE CA C 383 62.114 63.962 -1.848 1
1 349 . 10 1 1 A 29 29 ILE CB C 383 33.870 38.403 -4.533 1
1 353 . 10 1 1 A 29 29 ILE N N 383 122.718 118.011 4.707 1
1 354 . 10 1 1 A 30 30 CYS H H 384 7.572 7.400 0.172 1
1 355 . 10 1 1 A 30 30 CYS HA H 384 4.548 4.487 0.061 1
1 358 . 10 1 1 A 30 30 CYS C C 384 172.978 175.237 -2.259 1
1 359 . 10 1 1 A 30 30 CYS CA C 384 54.957 59.792 -4.835 1
1 360 . 10 1 1 A 30 30 CYS CB C 384 29.778 29.761 0.017 1
1 361 . 10 1 1 A 30 30 CYS N N 384 116.356 116.199 0.157 1
1 362 . 10 1 1 A 31 31 ALA H H 385 8.205 8.544 -0.339 1
1 363 . 10 1 1 A 31 31 ALA HA H 385 4.107 4.100 0.007 1
1 367 . 10 1 1 A 31 31 ALA C C 385 173.139 177.103 -3.964 1
1 368 . 10 1 1 A 31 31 ALA CA C 385 50.802 53.231 -2.429 1
1 369 . 10 1 1 A 31 31 ALA CB C 385 14.634 17.668 -3.034 1
1 370 . 10 1 1 A 31 31 ALA N N 385 125.526 121.159 4.367 1
1 371 . 10 1 1 A 32 32 GLU H H 386 8.416 8.192 0.224 1
1 372 . 10 1 1 A 32 32 GLU HA H 386 4.467 4.456 0.011 1
1 377 . 10 1 1 A 32 32 GLU C C 386 172.325 175.951 -3.626 1
1 378 . 10 1 1 A 32 32 GLU CA C 386 55.146 57.285 -2.139 1
1 379 . 10 1 1 A 32 32 GLU CB C 386 31.181 32.550 -1.369 1
1 381 . 10 1 1 A 32 32 GLU N N 386 117.579 114.420 3.159 1
1 382 . 10 1 1 A 33 33 ASN H H 387 7.872 7.956 -0.084 1
1 383 . 10 1 1 A 33 33 ASN HA H 387 4.900 4.913 -0.013 1
1 388 . 10 1 1 A 33 33 ASN C C 387 171.355 175.050 -3.695 1
1 389 . 10 1 1 A 33 33 ASN CA C 387 49.320 52.435 -3.115 1
1 390 . 10 1 1 A 33 33 ASN CB C 387 38.457 39.385 -0.928 1
1 391 . 10 1 1 A 33 33 ASN N N 387 120.399 117.159 3.240 1
1 393 . 10 1 1 A 34 34 ASP H H 388 8.565 8.615 -0.050 1
1 394 . 10 1 1 A 34 34 ASP HA H 388 4.679 4.784 -0.105 1
1 397 . 10 1 1 A 34 34 ASP C C 388 174.243 175.564 -1.321 1
1 398 . 10 1 1 A 34 34 ASP CA C 388 51.809 53.774 -1.965 1
1 399 . 10 1 1 A 34 34 ASP CB C 388 38.007 42.086 -4.079 1
1 400 . 10 1 1 A 34 34 ASP N N 388 120.661 120.475 0.186 1
1 401 . 10 1 1 A 35 35 LYS H H 389 8.544 8.575 -0.031 1
1 402 . 10 1 1 A 35 35 LYS HA H 389 3.411 4.389 -0.978 1
1 409 . 10 1 1 A 35 35 LYS C C 389 172.938 176.539 -3.601 1
1 410 . 10 1 1 A 35 35 LYS CA C 389 54.973 55.602 -0.629 1
1 411 . 10 1 1 A 35 35 LYS CB C 389 30.617 31.561 -0.944 1
1 415 . 10 1 1 A 35 35 LYS N N 389 119.199 120.374 -1.175 1
1 416 . 10 1 1 A 36 36 ASP H H 390 8.327 8.462 -0.135 1
1 417 . 10 1 1 A 36 36 ASP HA H 390 4.724 4.839 -0.115 1
1 420 . 10 1 1 A 36 36 ASP C C 390 172.860 175.338 -2.478 1
1 421 . 10 1 1 A 36 36 ASP CA C 390 51.609 53.564 -1.955 1
1 422 . 10 1 1 A 36 36 ASP CB C 390 39.018 41.051 -2.033 1
1 423 . 10 1 1 A 36 36 ASP N N 390 119.134 120.880 -1.746 1
1 424 . 10 1 1 A 37 37 VAL H H 391 8.544 7.891 0.653 1
1 425 . 10 1 1 A 37 37 VAL HA H 391 4.877 4.814 0.063 1
1 433 . 10 1 1 A 37 37 VAL C C 391 167.519 173.098 -5.579 1
1 434 . 10 1 1 A 37 37 VAL CA C 391 58.259 59.938 -1.679 1
1 435 . 10 1 1 A 37 37 VAL CB C 391 32.277 35.385 -3.108 1
1 438 . 10 1 1 A 37 37 VAL N N 391 121.970 119.476 2.494 1
1 439 . 10 1 1 A 38 38 LYS H H 392 8.621 9.582 -0.961 1
1 440 . 10 1 1 A 38 38 LYS HA H 392 4.991 5.088 -0.097 1
1 449 . 10 1 1 A 38 38 LYS C C 392 172.681 175.263 -2.582 1
1 450 . 10 1 1 A 38 38 LYS CA C 392 51.123 54.672 -3.549 1
1 451 . 10 1 1 A 38 38 LYS CB C 392 33.697 34.690 -0.993 1
1 455 . 10 1 1 A 38 38 LYS N N 392 126.381 128.983 -2.602 1
1 456 . 10 1 1 A 39 39 ILE H H 393 8.723 8.959 -0.236 1
1 457 . 10 1 1 A 39 39 ILE HA H 393 4.239 4.357 -0.118 1
1 467 . 10 1 1 A 39 39 ILE C C 393 172.642 175.696 -3.054 1
1 468 . 10 1 1 A 39 39 ILE CA C 393 57.768 61.053 -3.285 1
1 469 . 10 1 1 A 39 39 ILE CB C 393 35.691 37.501 -1.810 1
1 473 . 10 1 1 A 39 39 ILE N N 393 126.398 127.382 -0.984 1
1 474 . 10 1 1 A 40 40 GLU H H 394 8.506 9.345 -0.839 1
1 475 . 10 1 1 A 40 40 GLU HA H 394 4.753 4.719 0.034 1
1 480 . 10 1 1 A 40 40 GLU C C 394 173.596 176.133 -2.537 1
1 481 . 10 1 1 A 40 40 GLU CA C 394 49.793 53.076 -3.283 1
1 482 . 10 1 1 A 40 40 GLU CB C 394 28.210 30.961 -2.751 1
1 484 . 10 1 1 A 40 40 GLU N N 394 124.864 127.962 -3.098 1
1 485 . 10 1 1 A 41 41 PRO HA H 395 4.864 4.490 0.374 1
1 492 . 10 1 1 A 41 41 PRO C C 395 175.073 177.042 -1.969 1
1 493 . 10 1 1 A 41 41 PRO CA C 395 61.111 63.898 -2.787 1
1 494 . 10 1 1 A 41 41 PRO CB C 395 32.275 32.941 -0.666 1
1 497 . 10 1 1 A 42 42 CYS H H 396 7.828 7.814 0.014 1
1 498 . 10 1 1 A 42 42 CYS HA H 396 4.208 4.007 0.201 1
1 501 . 10 1 1 A 42 42 CYS C C 396 173.877 175.003 -1.126 1
1 502 . 10 1 1 A 42 42 CYS CA C 396 58.021 61.387 -3.366 1
1 503 . 10 1 1 A 42 42 CYS CB C 396 28.242 27.417 0.825 1
1 504 . 10 1 1 A 42 42 CYS N N 396 122.434 117.906 4.528 1
1 505 . 10 1 1 A 43 43 GLY H H 397 8.679 8.772 -0.093 1
1 506 . 10 1 1 A 43 43 GLY HA2 H 397 3.507 3.900 -0.393 1
1 507 . 10 1 1 A 43 43 GLY HA3 H 397 3.914 3.908 0.006 1
1 508 . 10 1 1 A 43 43 GLY C C 397 171.981 175.082 -3.101 1
1 509 . 10 1 1 A 43 43 GLY CA C 397 43.347 45.756 -2.409 1
1 510 . 10 1 1 A 43 43 GLY N N 397 112.123 108.240 3.883 1
1 511 . 10 1 1 A 44 44 HIS H H 398 8.329 7.801 0.528 1
1 512 . 10 1 1 A 44 44 HIS HA H 398 4.339 4.484 -0.145 1
1 517 . 10 1 1 A 44 44 HIS C C 398 170.742 174.950 -4.208 1
1 518 . 10 1 1 A 44 44 HIS CA C 398 58.368 56.488 1.880 1
1 519 . 10 1 1 A 44 44 HIS CB C 398 28.434 30.596 -2.162 1
1 522 . 10 1 1 A 44 44 HIS N N 398 121.393 117.957 3.436 1
1 523 . 10 1 1 A 45 45 LEU H H 399 8.241 8.855 -0.614 1
1 524 . 10 1 1 A 45 45 LEU HA H 399 5.570 5.248 0.322 1
1 534 . 10 1 1 A 45 45 LEU C C 399 174.464 175.468 -1.004 1
1 535 . 10 1 1 A 45 45 LEU CA C 399 50.729 53.515 -2.786 1
1 536 . 10 1 1 A 45 45 LEU CB C 399 43.574 44.031 -0.457 1
1 540 . 10 1 1 A 45 45 LEU N N 399 118.469 123.138 -4.669 1
1 541 . 10 1 1 A 46 46 MET H H 400 8.707 8.761 -0.054 1
1 542 . 10 1 1 A 46 46 MET HA H 400 4.842 5.023 -0.181 1
1 550 . 10 1 1 A 46 46 MET C C 400 170.736 174.210 -3.474 1
1 551 . 10 1 1 A 46 46 MET CA C 400 52.804 54.181 -1.377 1
1 552 . 10 1 1 A 46 46 MET CB C 400 31.945 35.274 -3.329 1
1 555 . 10 1 1 A 46 46 MET N N 400 114.897 120.054 -5.157 1
1 556 . 10 1 1 A 47 47 CYS H H 401 9.436 8.343 1.093 1
1 557 . 10 1 1 A 47 47 CYS HA H 401 5.629 5.218 0.411 1
1 560 . 10 1 1 A 47 47 CYS C C 401 173.909 176.002 -2.093 1
1 561 . 10 1 1 A 47 47 CYS CA C 401 54.325 56.925 -2.600 1
1 562 . 10 1 1 A 47 47 CYS CB C 401 30.725 29.593 1.132 1
1 563 . 10 1 1 A 47 47 CYS N N 401 119.575 119.057 0.518 1
1 564 . 10 1 1 A 48 48 THR H H 402 9.842 9.155 0.687 1
1 565 . 10 1 1 A 48 48 THR HA H 402 3.768 3.956 -0.188 1
1 570 . 10 1 1 A 48 48 THR C C 402 174.333 176.208 -1.875 1
1 571 . 10 1 1 A 48 48 THR CA C 402 64.516 65.885 -1.369 1
1 572 . 10 1 1 A 48 48 THR CB C 402 66.288 68.549 -2.261 1
1 574 . 10 1 1 A 48 48 THR N N 402 119.945 119.199 0.746 1
1 575 . 10 1 1 A 49 49 SER H H 403 8.355 8.071 0.284 1
1 576 . 10 1 1 A 49 49 SER HA H 403 4.222 4.077 0.145 1
1 579 . 10 1 1 A 49 49 SER C C 403 175.059 176.920 -1.861 1
1 580 . 10 1 1 A 49 49 SER CA C 403 59.828 61.867 -2.039 1
1 581 . 10 1 1 A 49 49 SER CB C 403 59.717 62.532 -2.815 1
1 582 . 10 1 1 A 49 49 SER N N 403 120.468 116.483 3.985 1
1 583 . 10 1 1 A 50 50 CYS H H 404 9.464 7.848 1.616 1
1 584 . 10 1 1 A 50 50 CYS HA H 404 3.922 4.223 -0.301 1
1 587 . 10 1 1 A 50 50 CYS C C 404 176.081 177.035 -0.954 1
1 588 . 10 1 1 A 50 50 CYS CA C 404 63.076 63.964 -0.888 1
1 589 . 10 1 1 A 50 50 CYS CB C 404 26.078 27.594 -1.516 1
1 590 . 10 1 1 A 50 50 CYS N N 404 126.744 119.353 7.391 1
1 591 . 10 1 1 A 51 51 LEU H H 405 7.948 8.111 -0.163 1
1 592 . 10 1 1 A 51 51 LEU HA H 405 4.064 4.176 -0.112 1
1 602 . 10 1 1 A 51 51 LEU C C 405 175.495 178.665 -3.170 1
1 603 . 10 1 1 A 51 51 LEU CA C 405 55.914 58.265 -2.351 1
1 604 . 10 1 1 A 51 51 LEU CB C 405 38.662 41.862 -3.200 1
1 607 . 10 1 1 A 51 51 LEU N N 405 121.951 123.075 -1.124 1
1 608 . 10 1 1 A 52 52 THR H H 406 8.786 8.559 0.227 1
1 609 . 10 1 1 A 52 52 THR HA H 406 4.024 3.948 0.076 1
1 614 . 10 1 1 A 52 52 THR C C 406 174.139 176.541 -2.402 1
1 615 . 10 1 1 A 52 52 THR CA C 406 64.017 66.484 -2.467 1
1 616 . 10 1 1 A 52 52 THR CB C 406 66.115 68.361 -2.246 1
1 618 . 10 1 1 A 52 52 THR N N 406 115.258 114.625 0.633 1
1 619 . 10 1 1 A 53 53 SER H H 407 8.115 7.841 0.274 1
1 620 . 10 1 1 A 53 53 SER HA H 407 4.204 4.165 0.039 1
1 623 . 10 1 1 A 53 53 SER C C 407 174.456 176.992 -2.536 1
1 624 . 10 1 1 A 53 53 SER CA C 407 59.090 61.162 -2.072 1
1 625 . 10 1 1 A 53 53 SER CB C 407 60.146 63.072 -2.926 1
1 626 . 10 1 1 A 53 53 SER N N 407 116.852 114.957 1.895 1
1 627 . 10 1 1 A 54 54 TRP H H 408 8.123 7.788 0.335 1
1 628 . 10 1 1 A 54 54 TRP HA H 408 4.371 4.238 0.133 1
1 637 . 10 1 1 A 54 54 TRP C C 408 175.981 178.588 -2.607 1
1 638 . 10 1 1 A 54 54 TRP CA C 408 57.323 60.751 -3.428 1
1 639 . 10 1 1 A 54 54 TRP CB C 408 26.812 29.461 -2.649 1
1 645 . 10 1 1 A 54 54 TRP N N 408 123.556 122.749 0.807 1
1 647 . 10 1 1 A 55 55 GLN H H 409 8.502 8.726 -0.224 1
1 648 . 10 1 1 A 55 55 GLN HA H 409 3.999 3.681 0.318 1
1 655 . 10 1 1 A 55 55 GLN C C 409 177.300 178.305 -1.005 1
1 656 . 10 1 1 A 55 55 GLN CA C 409 56.484 59.264 -2.780 1
1 657 . 10 1 1 A 55 55 GLN CB C 409 26.190 28.563 -2.373 1
1 659 . 10 1 1 A 55 55 GLN N N 409 118.044 118.526 -0.482 1
1 661 . 10 1 1 A 56 56 GLU H H 410 8.467 8.382 0.085 1
1 662 . 10 1 1 A 56 56 GLU HA H 410 4.057 4.049 0.008 1
1 667 . 10 1 1 A 56 56 GLU C C 410 174.787 176.768 -1.981 1
1 668 . 10 1 1 A 56 56 GLU CA C 410 55.909 58.357 -2.448 1
1 669 . 10 1 1 A 56 56 GLU CB C 410 26.895 29.310 -2.415 1
1 671 . 10 1 1 A 56 56 GLU N N 410 119.448 117.915 1.533 1
1 672 . 10 1 1 A 57 57 SER H H 411 7.438 7.613 -0.175 1
1 673 . 10 1 1 A 57 57 SER HA H 411 4.607 4.565 0.042 1
1 676 . 10 1 1 A 57 57 SER C C 411 170.849 173.737 -2.888 1
1 677 . 10 1 1 A 57 57 SER CA C 411 55.540 57.518 -1.978 1
1 678 . 10 1 1 A 57 57 SER CB C 411 60.928 63.255 -2.327 1
1 679 . 10 1 1 A 57 57 SER N N 411 113.752 114.397 -0.645 1
1 680 . 10 1 1 A 58 58 GLU H H 412 7.855 7.675 0.180 1
1 681 . 10 1 1 A 58 58 GLU HA H 412 3.772 3.807 -0.035 1
1 686 . 10 1 1 A 58 58 GLU C C 412 173.743 175.354 -1.611 1
1 687 . 10 1 1 A 58 58 GLU CA C 412 54.442 56.998 -2.556 1
1 688 . 10 1 1 A 58 58 GLU CB C 412 24.603 27.854 -3.251 1
1 690 . 10 1 1 A 58 58 GLU N N 412 115.908 120.287 -4.379 1
1 691 . 10 1 1 A 59 59 GLY H H 413 7.588 8.096 -0.508 1
1 692 . 10 1 1 A 59 59 GLY HA2 H 413 1.643 3.297 -1.654 1
1 693 . 10 1 1 A 59 59 GLY HA3 H 413 2.949 3.817 -0.868 1
1 694 . 10 1 1 A 59 59 GLY C C 413 170.850 174.850 -4.000 1
1 695 . 10 1 1 A 59 59 GLY CA C 413 41.724 46.405 -4.681 1
1 696 . 10 1 1 A 59 59 GLY N N 413 108.032 114.488 -6.456 1
1 697 . 10 1 1 A 60 60 GLN H H 414 7.973 7.896 0.077 1
1 698 . 10 1 1 A 60 60 GLN HA H 414 4.366 4.296 0.070 1
1 705 . 10 1 1 A 60 60 GLN C C 414 173.108 175.481 -2.373 1
1 706 . 10 1 1 A 60 60 GLN CA C 414 52.422 55.301 -2.879 1
1 707 . 10 1 1 A 60 60 GLN CB C 414 27.049 28.020 -0.971 1
1 709 . 10 1 1 A 60 60 GLN N N 414 122.690 121.466 1.224 1
1 711 . 10 1 1 A 61 61 GLY H H 415 8.301 7.497 0.804 1
1 712 . 10 1 1 A 61 61 GLY HA2 H 415 3.700 4.185 -0.485 1
1 713 . 10 1 1 A 61 61 GLY HA3 H 415 3.920 4.213 -0.293 1
1 714 . 10 1 1 A 61 61 GLY C C 415 170.249 172.280 -2.031 1
1 715 . 10 1 1 A 61 61 GLY CA C 415 42.210 45.472 -3.262 1
1 716 . 10 1 1 A 61 61 GLY N N 415 110.794 107.873 2.921 1
1 717 . 10 1 1 A 62 62 CYS H H 416 8.549 8.504 0.045 1
1 718 . 10 1 1 A 62 62 CYS HA H 416 4.227 4.692 -0.465 1
1 721 . 10 1 1 A 62 62 CYS C C 416 172.914 175.019 -2.105 1
1 722 . 10 1 1 A 62 62 CYS CA C 416 54.008 58.699 -4.691 1
1 723 . 10 1 1 A 62 62 CYS CB C 416 29.716 27.166 2.550 1
1 724 . 10 1 1 A 62 62 CYS N N 416 123.683 120.288 3.395 1
1 725 . 10 1 1 A 63 63 PRO HA H 417 2.611 2.705 -0.094 1
1 732 . 10 1 1 A 63 63 PRO C C 417 174.143 177.398 -3.255 1
1 733 . 10 1 1 A 63 63 PRO CA C 417 61.689 63.652 -1.963 1
1 734 . 10 1 1 A 63 63 PRO CB C 417 28.534 31.021 -2.487 1
1 737 . 10 1 1 A 64 64 PHE H H 418 8.968 7.842 1.126 1
1 738 . 10 1 1 A 64 64 PHE HA H 418 4.250 4.202 0.048 1
1 746 . 10 1 1 A 64 64 PHE C C 418 174.243 178.337 -4.094 1
1 747 . 10 1 1 A 64 64 PHE CA C 418 56.720 60.125 -3.405 1
1 748 . 10 1 1 A 64 64 PHE CB C 418 36.458 39.522 -3.064 1
1 752 . 10 1 1 A 64 64 PHE N N 418 117.008 115.335 1.673 1
1 753 . 10 1 1 A 65 65 CYS H H 419 7.968 8.060 -0.092 1
1 754 . 10 1 1 A 65 65 CYS HA H 419 4.906 4.439 0.467 1
1 757 . 10 1 1 A 65 65 CYS C C 419 173.198 174.859 -1.661 1
1 758 . 10 1 1 A 65 65 CYS CA C 419 55.870 60.082 -4.212 1
1 759 . 10 1 1 A 65 65 CYS CB C 419 30.559 28.805 1.754 1
1 760 . 10 1 1 A 65 65 CYS N N 419 117.505 117.683 -0.178 1
1 761 . 10 1 1 A 66 66 ARG H H 420 8.761 7.882 0.879 1
1 762 . 10 1 1 A 66 66 ARG HA H 420 4.365 4.428 -0.063 1
1 769 . 10 1 1 A 66 66 ARG C C 420 172.921 174.710 -1.789 1
1 770 . 10 1 1 A 66 66 ARG CA C 420 54.763 57.205 -2.442 1
1 771 . 10 1 1 A 66 66 ARG CB C 420 24.286 26.975 -2.689 1
1 774 . 10 1 1 A 66 66 ARG N N 420 118.763 116.032 2.731 1
1 775 . 10 1 1 A 67 67 CYS H H 421 8.223 7.916 0.307 1
1 776 . 10 1 1 A 67 67 CYS HA H 421 4.419 4.615 -0.196 1
1 779 . 10 1 1 A 67 67 CYS C C 421 171.160 174.788 -3.628 1
1 780 . 10 1 1 A 67 67 CYS CA C 421 57.119 57.987 -0.868 1
1 781 . 10 1 1 A 67 67 CYS CB C 421 25.911 29.820 -3.909 1
1 782 . 10 1 1 A 67 67 CYS N N 421 120.627 116.857 3.770 1
1 783 . 10 1 1 A 68 68 GLU H H 422 8.416 8.534 -0.118 1
1 784 . 10 1 1 A 68 68 GLU HA H 422 4.025 4.159 -0.134 1
1 789 . 10 1 1 A 68 68 GLU C C 422 173.764 176.302 -2.538 1
1 790 . 10 1 1 A 68 68 GLU CA C 422 54.752 57.611 -2.859 1
1 791 . 10 1 1 A 68 68 GLU CB C 422 27.302 29.751 -2.449 1
1 793 . 10 1 1 A 68 68 GLU N N 422 122.370 119.870 2.500 1
1 794 . 10 1 1 A 69 69 ILE H H 423 8.648 8.913 -0.265 1
1 795 . 10 1 1 A 69 69 ILE HA H 423 4.012 4.456 -0.444 1
1 805 . 10 1 1 A 69 69 ILE C C 423 174.257 175.657 -1.400 1
1 806 . 10 1 1 A 69 69 ILE CA C 423 59.740 60.648 -0.908 1
1 807 . 10 1 1 A 69 69 ILE CB C 423 35.846 38.076 -2.230 1
1 811 . 10 1 1 A 69 69 ILE N N 423 125.988 125.689 0.299 1
1 812 . 10 1 1 A 70 70 LYS H H 424 9.185 9.156 0.029 1
1 813 . 10 1 1 A 70 70 LYS HA H 424 4.434 4.556 -0.122 1
1 822 . 10 1 1 A 70 70 LYS C C 424 173.880 177.217 -3.337 1
1 823 . 10 1 1 A 70 70 LYS CA C 424 53.378 56.699 -3.321 1
1 824 . 10 1 1 A 70 70 LYS CB C 424 30.397 34.019 -3.622 1
1 828 . 10 1 1 A 70 70 LYS N N 424 128.977 127.433 1.544 1
1 829 . 10 1 1 A 71 71 GLY H H 425 7.810 7.501 0.309 1
1 830 . 10 1 1 A 71 71 GLY HA2 H 425 4.094 4.020 0.074 1
1 831 . 10 1 1 A 71 71 GLY HA3 H 425 4.159 4.023 0.136 1
1 832 . 10 1 1 A 71 71 GLY C C 425 168.179 171.969 -3.790 1
1 833 . 10 1 1 A 71 71 GLY CA C 425 42.326 45.340 -3.014 1
1 834 . 10 1 1 A 71 71 GLY N N 425 107.696 103.646 4.050 1
1 835 . 10 1 1 A 72 72 THR H H 426 8.048 8.516 -0.468 1
1 836 . 10 1 1 A 72 72 THR HA H 426 5.258 5.619 -0.361 1
1 841 . 10 1 1 A 72 72 THR C C 426 170.979 173.267 -2.288 1
1 842 . 10 1 1 A 72 72 THR CA C 426 56.755 60.261 -3.506 1
1 843 . 10 1 1 A 72 72 THR CB C 426 69.226 72.621 -3.395 1
1 845 . 10 1 1 A 72 72 THR N N 426 109.122 111.293 -2.171 1
1 846 . 10 1 1 A 73 73 GLU H H 427 8.912 8.936 -0.024 1
1 847 . 10 1 1 A 73 73 GLU HA H 427 4.954 4.865 0.089 1
1 852 . 10 1 1 A 73 73 GLU C C 427 170.353 173.804 -3.451 1
1 853 . 10 1 1 A 73 73 GLU CA C 427 50.182 53.060 -2.878 1
1 854 . 10 1 1 A 73 73 GLU CB C 427 30.559 32.578 -2.019 1
1 856 . 10 1 1 A 73 73 GLU N N 427 121.703 120.762 0.941 1
1 1 . 10 1 1 A 74 74 PRO HA H 428 4.372 5.008 -0.636 1
1 2 . 10 1 1 A 74 74 PRO C C 428 173.839 175.847 -2.008 1
1 3 . 10 1 1 A 74 74 PRO CA C 428 60.241 62.449 -2.208 1
1 4 . 10 1 1 A 74 74 PRO CB C 428 29.299 32.441 -3.142 1
1 857 . 10 1 1 A 74 74 PRO HA H 428 4.782 5.008 -0.226 1
1 864 . 10 1 1 A 74 74 PRO C C 428 174.027 175.847 -1.820 1
1 865 . 10 1 1 A 74 74 PRO CA C 428 59.771 62.449 -2.678 1
1 866 . 10 1 1 A 74 74 PRO CB C 428 29.633 32.441 -2.808 1
1 7 . 10 1 1 A 75 75 ILE H H 429 8.144 8.849 -0.705 1
1 8 . 10 1 1 A 75 75 ILE HA H 429 4.086 4.878 -0.792 1
1 15 . 10 1 1 A 75 75 ILE C C 429 173.426 175.532 -2.106 1
1 16 . 10 1 1 A 75 75 ILE CA C 429 58.339 59.528 -1.189 1
1 17 . 10 1 1 A 75 75 ILE CB C 429 35.988 41.526 -5.538 1
1 21 . 10 1 1 A 75 75 ILE N N 429 121.551 121.061 0.490 1
1 869 . 10 1 1 A 75 75 ILE H H 429 7.682 8.849 -1.167 1
1 870 . 10 1 1 A 75 75 ILE HA H 429 4.282 4.878 -0.596 1
1 880 . 10 1 1 A 75 75 ILE C C 429 172.510 175.532 -3.022 1
1 881 . 10 1 1 A 75 75 ILE CA C 429 57.456 59.528 -2.072 1
1 882 . 10 1 1 A 75 75 ILE CB C 429 37.903 41.526 -3.623 1
1 886 . 10 1 1 A 75 75 ILE N N 429 119.651 121.061 -1.410 1
1 1 . 10 1 1 A 76 76 VAL HA H 430 4.086 4.909 -0.823 1
1 2 . 10 1 1 A 76 76 VAL CA C 430 59.372 59.633 -0.261 1
1 22 . 10 1 1 A 76 76 VAL H H 430 8.221 8.879 -0.658 1
1 23 . 10 1 1 A 76 76 VAL HA H 430 4.083 4.909 -0.826 1
1 24 . 10 1 1 A 76 76 VAL C C 430 173.067 174.772 -1.705 1
1 25 . 10 1 1 A 76 76 VAL CA C 430 59.445 59.633 -0.188 1
1 26 . 10 1 1 A 76 76 VAL CB C 430 30.407 35.223 -4.816 1
1 27 . 10 1 1 A 76 76 VAL N N 430 125.930 121.243 4.687 1
1 887 . 10 1 1 A 76 76 VAL H H 430 8.122 8.879 -0.757 1
1 888 . 10 1 1 A 76 76 VAL HA H 430 4.197 4.909 -0.712 1
1 890 . 10 1 1 A 76 76 VAL C C 430 172.971 174.772 -1.801 1
1 891 . 10 1 1 A 76 76 VAL CA C 430 58.821 59.633 -0.812 1
1 892 . 10 1 1 A 76 76 VAL CB C 430 30.807 35.223 -4.416 1
1 895 . 10 1 1 A 76 76 VAL N N 430 124.178 121.243 2.935 1
1 4 . 10 1 1 A 77 77 VAL H H 431 8.204 9.062 -0.858 1
1 5 . 10 1 1 A 77 77 VAL HA H 431 4.049 4.738 -0.689 1
1 6 . 10 1 1 A 77 77 VAL C C 431 172.636 174.021 -1.385 1
1 7 . 10 1 1 A 77 77 VAL CA C 431 59.315 60.778 -1.463 1
1 8 . 10 1 1 A 77 77 VAL CB C 431 30.219 34.076 -3.857 1
1 9 . 10 1 1 A 77 77 VAL N N 431 125.320 125.113 0.207 1
1 28 . 10 1 1 A 77 77 VAL H H 431 8.412 9.062 -0.650 1
1 29 . 10 1 1 A 77 77 VAL HA H 431 4.038 4.738 -0.700 1
1 37 . 10 1 1 A 77 77 VAL C C 431 172.617 174.021 -1.404 1
1 38 . 10 1 1 A 77 77 VAL CA C 431 59.137 60.778 -1.641 1
1 39 . 10 1 1 A 77 77 VAL CB C 431 30.292 34.076 -3.784 1
1 42 . 10 1 1 A 77 77 VAL N N 431 125.655 125.113 0.542 1
1 896 . 10 1 1 A 77 77 VAL H H 431 8.448 9.062 -0.614 1
1 897 . 10 1 1 A 77 77 VAL HA H 431 4.087 4.738 -0.651 1
1 905 . 10 1 1 A 77 77 VAL C C 431 172.493 174.021 -1.528 1
1 906 . 10 1 1 A 77 77 VAL CA C 431 59.185 60.778 -1.593 1
1 907 . 10 1 1 A 77 77 VAL CB C 431 30.084 34.076 -3.992 1
1 910 . 10 1 1 A 77 77 VAL N N 431 125.770 125.113 0.657 1
1 43 . 10 1 1 A 78 78 ASP H H 432 8.419 8.872 -0.453 1
1 44 . 10 1 1 A 78 78 ASP HA H 432 4.829 5.259 -0.430 1
1 45 . 10 1 1 A 78 78 ASP C C 432 172.252 175.143 -2.891 1
1 46 . 10 1 1 A 78 78 ASP CA C 432 49.320 50.512 -1.192 1
1 47 . 10 1 1 A 78 78 ASP CB C 432 39.066 41.919 -2.853 1
1 48 . 10 1 1 A 78 78 ASP N N 432 126.226 126.665 -0.439 1
1 911 . 10 1 1 A 78 78 ASP H H 432 8.493 8.872 -0.379 1
1 912 . 10 1 1 A 78 78 ASP HA H 432 4.852 5.259 -0.407 1
1 915 . 10 1 1 A 78 78 ASP C C 432 172.048 175.143 -3.095 1
1 916 . 10 1 1 A 78 78 ASP CA C 432 49.233 50.512 -1.279 1
1 917 . 10 1 1 A 78 78 ASP CB C 432 38.858 41.919 -3.061 1
1 918 . 10 1 1 A 78 78 ASP N N 432 126.705 126.665 0.040 1
1 10 . 10 1 1 A 79 79 PRO CA C 433 63.865 62.294 1.571 1
1 49 . 10 1 1 A 79 79 PRO C C 433 173.867 177.079 -3.212 1
1 919 . 10 1 1 A 79 79 PRO HA H 433 4.237 4.750 -0.513 1
1 926 . 10 1 1 A 79 79 PRO C C 433 173.812 177.079 -3.267 1
1 927 . 10 1 1 A 79 79 PRO CA C 433 60.627 62.294 -1.667 1
1 928 . 10 1 1 A 79 79 PRO CB C 433 29.329 29.038 0.291 1
1 11 . 10 1 1 A 80 80 PHE H H 434 8.182 8.841 -0.659 1
1 12 . 10 1 1 A 80 80 PHE HA H 434 4.499 4.136 0.363 1
1 13 . 10 1 1 A 80 80 PHE C C 434 171.680 174.980 -3.300 1
1 14 . 10 1 1 A 80 80 PHE CA C 434 54.657 61.591 -6.934 1
1 15 . 10 1 1 A 80 80 PHE CB C 434 36.272 39.587 -3.315 1
1 16 . 10 1 1 A 80 80 PHE N N 434 118.611 124.592 -5.981 1
1 50 . 10 1 1 A 80 80 PHE H H 434 8.191 8.841 -0.650 1
1 51 . 10 1 1 A 80 80 PHE HA H 434 4.528 4.136 0.392 1
1 54 . 10 1 1 A 80 80 PHE C C 434 172.457 174.980 -2.523 1
1 55 . 10 1 1 A 80 80 PHE CA C 434 54.828 61.591 -6.763 1
1 56 . 10 1 1 A 80 80 PHE CB C 434 36.457 39.587 -3.130 1
1 57 . 10 1 1 A 80 80 PHE N N 434 118.871 124.592 -5.721 1
1 931 . 10 1 1 A 80 80 PHE H H 434 8.191 8.841 -0.650 1
1 932 . 10 1 1 A 80 80 PHE HA H 434 4.463 4.136 0.327 1
1 939 . 10 1 1 A 80 80 PHE C C 434 172.283 174.980 -2.697 1
1 940 . 10 1 1 A 80 80 PHE CA C 434 54.971 61.591 -6.620 1
1 941 . 10 1 1 A 80 80 PHE CB C 434 36.490 39.587 -3.097 1
1 944 . 10 1 1 A 80 80 PHE N N 434 119.263 124.592 -5.329 1
1 17 . 10 1 1 A 81 81 ASP H H 435 7.490 8.328 -0.838 1
1 18 . 10 1 1 A 81 81 ASP HA H 435 4.698 5.001 -0.303 1
1 19 . 10 1 1 A 81 81 ASP C C 435 171.662 175.187 -3.525 1
1 20 . 10 1 1 A 81 81 ASP CA C 435 49.570 51.880 -2.310 1
1 21 . 10 1 1 A 81 81 ASP CB C 435 40.104 41.369 -1.265 1
1 22 . 10 1 1 A 81 81 ASP N N 435 120.304 114.622 5.682 1
1 58 . 10 1 1 A 81 81 ASP H H 435 7.881 8.328 -0.447 1
1 59 . 10 1 1 A 81 81 ASP HA H 435 4.801 5.001 -0.200 1
1 60 . 10 1 1 A 81 81 ASP C C 435 171.144 175.187 -4.043 1
1 61 . 10 1 1 A 81 81 ASP CA C 435 49.406 51.880 -2.474 1
1 62 . 10 1 1 A 81 81 ASP CB C 435 38.618 41.369 -2.751 1
1 63 . 10 1 1 A 81 81 ASP N N 435 123.108 114.622 8.486 1
1 945 . 10 1 1 A 81 81 ASP H H 435 7.823 8.328 -0.505 1
1 946 . 10 1 1 A 81 81 ASP HA H 435 4.759 5.001 -0.242 1
1 949 . 10 1 1 A 81 81 ASP C C 435 171.057 175.187 -4.130 1
1 950 . 10 1 1 A 81 81 ASP CA C 435 49.174 51.880 -2.706 1
1 951 . 10 1 1 A 81 81 ASP CB C 435 38.725 41.369 -2.644 1
1 952 . 10 1 1 A 81 81 ASP N N 435 123.530 114.622 8.908 1
1 23 . 10 1 1 A 82 82 PRO HA H 436 4.758 4.412 0.346 1
1 24 . 10 1 1 A 82 82 PRO C C 436 172.944 177.302 -4.358 1
1 25 . 10 1 1 A 82 82 PRO CA C 436 60.134 65.355 -5.221 1
1 26 . 10 1 1 A 82 82 PRO CB C 436 31.425 31.883 -0.458 1
1 64 . 10 1 1 A 82 82 PRO HA H 436 4.364 4.412 -0.048 1
1 67 . 10 1 1 A 82 82 PRO C C 436 173.563 177.302 -3.739 1
1 68 . 10 1 1 A 82 82 PRO CA C 436 60.729 65.355 -4.626 1
1 69 . 10 1 1 A 82 82 PRO CB C 436 29.160 31.883 -2.723 1
1 953 . 10 1 1 A 82 82 PRO HA H 436 4.296 4.412 -0.116 1
1 960 . 10 1 1 A 82 82 PRO C C 436 173.494 177.302 -3.808 1
1 961 . 10 1 1 A 82 82 PRO CA C 436 60.625 65.355 -4.730 1
1 962 . 10 1 1 A 82 82 PRO CB C 436 29.237 31.883 -2.646 1
1 1 . 11 1 1 A 3 3 LEU HA H 357 4.257 4.253 0.004 1
1 11 . 11 1 1 A 3 3 LEU C C 357 174.994 178.623 -3.629 1
1 12 . 11 1 1 A 3 3 LEU CA C 357 53.329 56.619 -3.290 1
1 13 . 11 1 1 A 3 3 LEU CB C 357 39.382 42.779 -3.397 1
1 17 . 11 1 1 A 4 4 GLN H H 358 8.234 7.588 0.646 1
1 18 . 11 1 1 A 4 4 GLN HA H 358 4.211 4.307 -0.096 1
1 25 . 11 1 1 A 4 4 GLN C C 358 173.357 174.594 -1.237 1
1 26 . 11 1 1 A 4 4 GLN CA C 358 53.791 56.041 -2.250 1
1 27 . 11 1 1 A 4 4 GLN CB C 358 26.456 28.996 -2.540 1
1 29 . 11 1 1 A 4 4 GLN N N 358 119.506 116.140 3.366 1
1 31 . 11 1 1 A 5 5 ASP H H 359 8.090 7.440 0.650 1
1 32 . 11 1 1 A 5 5 ASP HA H 359 4.458 5.038 -0.580 1
1 35 . 11 1 1 A 5 5 ASP C C 359 173.492 174.213 -0.721 1
1 36 . 11 1 1 A 5 5 ASP CA C 359 52.309 52.880 -0.571 1
1 37 . 11 1 1 A 5 5 ASP CB C 359 38.312 44.157 -5.845 1
1 38 . 11 1 1 A 5 5 ASP N N 359 120.683 118.688 1.995 1
1 39 . 11 1 1 A 6 6 HIS H H 360 8.103 9.160 -1.057 1
1 40 . 11 1 1 A 6 6 HIS HA H 360 4.540 4.719 -0.179 1
1 45 . 11 1 1 A 6 6 HIS C C 360 172.801 175.205 -2.404 1
1 46 . 11 1 1 A 6 6 HIS CA C 360 53.874 57.552 -3.678 1
1 47 . 11 1 1 A 6 6 HIS CB C 360 27.878 31.127 -3.249 1
1 50 . 11 1 1 A 6 6 HIS N N 360 118.844 120.406 -1.562 1
1 51 . 11 1 1 A 7 7 ILE H H 361 7.862 8.085 -0.223 1
1 52 . 11 1 1 A 7 7 ILE HA H 361 4.010 4.411 -0.401 1
1 62 . 11 1 1 A 7 7 ILE C C 361 173.268 175.151 -1.883 1
1 63 . 11 1 1 A 7 7 ILE CA C 361 58.740 59.446 -0.706 1
1 64 . 11 1 1 A 7 7 ILE CB C 361 35.788 38.048 -2.260 1
1 68 . 11 1 1 A 7 7 ILE N N 361 121.598 113.569 8.029 1
1 69 . 11 1 1 A 8 8 LYS H H 362 8.231 8.404 -0.173 1
1 70 . 11 1 1 A 8 8 LYS HA H 362 4.313 4.957 -0.644 1
1 79 . 11 1 1 A 8 8 LYS C C 362 173.899 175.623 -1.724 1
1 80 . 11 1 1 A 8 8 LYS CA C 362 53.677 54.285 -0.608 1
1 81 . 11 1 1 A 8 8 LYS CB C 362 30.355 36.769 -6.414 1
1 85 . 11 1 1 A 8 8 LYS N N 362 124.980 125.895 -0.915 1
1 86 . 11 1 1 A 9 9 VAL H H 363 8.044 8.709 -0.665 1
1 87 . 11 1 1 A 9 9 VAL HA H 363 4.089 4.412 -0.323 1
1 95 . 11 1 1 A 9 9 VAL C C 363 173.760 175.598 -1.838 1
1 96 . 11 1 1 A 9 9 VAL CA C 363 59.814 61.672 -1.858 1
1 97 . 11 1 1 A 9 9 VAL CB C 363 30.058 32.881 -2.823 1
1 100 . 11 1 1 A 9 9 VAL N N 363 121.366 120.224 1.142 1
1 101 . 11 1 1 A 10 10 THR H H 364 8.076 9.429 -1.353 1
1 102 . 11 1 1 A 10 10 THR HA H 364 4.302 4.498 -0.196 1
1 107 . 11 1 1 A 10 10 THR C C 364 172.135 175.475 -3.340 1
1 108 . 11 1 1 A 10 10 THR CA C 364 59.134 64.007 -4.873 1
1 109 . 11 1 1 A 10 10 THR CB C 364 67.415 70.308 -2.893 1
1 111 . 11 1 1 A 10 10 THR N N 364 116.817 118.082 -1.265 1
1 112 . 11 1 1 A 11 11 GLN H H 365 8.463 8.251 0.212 1
1 113 . 11 1 1 A 11 11 GLN HA H 365 4.046 4.503 -0.457 1
1 120 . 11 1 1 A 11 11 GLN C C 365 173.944 177.333 -3.389 1
1 121 . 11 1 1 A 11 11 GLN CA C 365 54.517 56.634 -2.117 1
1 122 . 11 1 1 A 11 11 GLN CB C 365 26.250 29.451 -3.201 1
1 124 . 11 1 1 A 11 11 GLN N N 365 122.059 117.365 4.694 1
1 126 . 11 1 1 A 12 12 GLU H H 366 8.449 8.164 0.285 1
1 127 . 11 1 1 A 12 12 GLU HA H 366 4.093 4.391 -0.298 1
1 132 . 11 1 1 A 12 12 GLU C C 366 174.746 177.308 -2.562 1
1 133 . 11 1 1 A 12 12 GLU CA C 366 55.235 56.198 -0.963 1
1 134 . 11 1 1 A 12 12 GLU CB C 366 27.180 29.309 -2.129 1
1 136 . 11 1 1 A 12 12 GLU N N 366 120.415 116.211 4.204 1
1 137 . 11 1 1 A 13 13 GLN H H 367 8.031 8.248 -0.217 1
1 138 . 11 1 1 A 13 13 GLN HA H 367 4.113 4.201 -0.088 1
1 145 . 11 1 1 A 13 13 GLN C C 367 173.693 175.746 -2.053 1
1 146 . 11 1 1 A 13 13 GLN CA C 367 54.132 55.631 -1.499 1
1 147 . 11 1 1 A 13 13 GLN CB C 367 26.420 27.917 -1.497 1
1 149 . 11 1 1 A 13 13 GLN N N 367 119.721 118.379 1.342 1
1 151 . 11 1 1 A 14 14 TYR H H 368 8.111 7.906 0.205 1
1 152 . 11 1 1 A 14 14 TYR HA H 368 4.339 4.818 -0.479 1
1 159 . 11 1 1 A 14 14 TYR C C 368 173.916 176.607 -2.691 1
1 160 . 11 1 1 A 14 14 TYR CA C 368 56.572 57.699 -1.127 1
1 161 . 11 1 1 A 14 14 TYR CB C 368 35.879 38.418 -2.539 1
1 164 . 11 1 1 A 14 14 TYR N N 368 120.541 119.746 0.795 1
1 165 . 11 1 1 A 15 15 GLU H H 369 8.287 8.511 -0.224 1
1 166 . 11 1 1 A 15 15 GLU HA H 369 4.009 4.306 -0.297 1
1 171 . 11 1 1 A 15 15 GLU C C 369 174.448 177.292 -2.844 1
1 172 . 11 1 1 A 15 15 GLU CA C 369 55.047 58.870 -3.823 1
1 173 . 11 1 1 A 15 15 GLU CB C 369 27.226 28.681 -1.455 1
1 175 . 11 1 1 A 15 15 GLU N N 369 120.398 120.088 0.310 1
1 176 . 11 1 1 A 16 16 LEU H H 370 7.785 7.874 -0.089 1
1 177 . 11 1 1 A 16 16 LEU HA H 370 4.138 4.316 -0.178 1
1 187 . 11 1 1 A 16 16 LEU C C 370 175.089 177.887 -2.798 1
1 188 . 11 1 1 A 16 16 LEU CA C 370 53.425 55.767 -2.342 1
1 189 . 11 1 1 A 16 16 LEU CB C 370 39.554 41.269 -1.715 1
1 193 . 11 1 1 A 16 16 LEU N N 370 121.323 120.171 1.152 1
1 194 . 11 1 1 A 17 17 TYR H H 371 8.038 7.940 0.098 1
1 195 . 11 1 1 A 17 17 TYR HA H 371 4.380 4.543 -0.163 1
1 202 . 11 1 1 A 17 17 TYR C C 371 173.931 175.319 -1.388 1
1 203 . 11 1 1 A 17 17 TYR CA C 371 56.143 57.690 -1.547 1
1 204 . 11 1 1 A 17 17 TYR CB C 371 35.501 39.202 -3.701 1
1 207 . 11 1 1 A 17 17 TYR N N 371 119.465 119.188 0.277 1
1 208 . 11 1 1 A 18 18 CYS H H 372 8.021 7.050 0.971 1
1 209 . 11 1 1 A 18 18 CYS HA H 372 4.236 4.840 -0.604 1
1 212 . 11 1 1 A 18 18 CYS C C 372 172.457 173.328 -0.871 1
1 213 . 11 1 1 A 18 18 CYS CA C 372 56.997 56.818 0.179 1
1 214 . 11 1 1 A 18 18 CYS CB C 372 25.080 29.215 -4.135 1
1 215 . 11 1 1 A 18 18 CYS N N 372 119.913 117.724 2.189 1
1 216 . 11 1 1 A 19 19 GLU H H 373 8.151 8.811 -0.660 1
1 217 . 11 1 1 A 19 19 GLU HA H 373 4.130 4.443 -0.313 1
1 222 . 11 1 1 A 19 19 GLU C C 373 174.151 174.950 -0.799 1
1 223 . 11 1 1 A 19 19 GLU CA C 373 54.535 56.373 -1.838 1
1 224 . 11 1 1 A 19 19 GLU CB C 373 27.244 32.554 -5.310 1
1 226 . 11 1 1 A 19 19 GLU N N 373 122.431 123.636 -1.205 1
1 227 . 11 1 1 A 20 20 MET H H 374 8.109 8.634 -0.525 1
1 228 . 11 1 1 A 20 20 MET HA H 374 4.352 4.040 0.312 1
1 236 . 11 1 1 A 20 20 MET C C 374 174.200 175.729 -1.529 1
1 237 . 11 1 1 A 20 20 MET CA C 374 53.238 56.833 -3.595 1
1 238 . 11 1 1 A 20 20 MET CB C 374 30.237 30.945 -0.708 1
1 241 . 11 1 1 A 20 20 MET N N 374 119.754 122.602 -2.848 1
1 242 . 11 1 1 A 21 21 GLY H H 375 8.231 8.036 0.195 1
1 243 . 11 1 1 A 21 21 GLY HA2 H 375 3.861 3.913 -0.052 1
1 244 . 11 1 1 A 21 21 GLY HA3 H 375 3.960 3.916 0.044 1
1 245 . 11 1 1 A 21 21 GLY C C 375 171.928 172.759 -0.831 1
1 246 . 11 1 1 A 21 21 GLY CA C 375 42.930 45.461 -2.531 1
1 247 . 11 1 1 A 21 21 GLY N N 375 109.484 107.308 2.176 1
1 248 . 11 1 1 A 22 22 SER HA H 376 4.492 5.306 -0.814 1
1 251 . 11 1 1 A 22 22 SER C C 376 172.206 172.972 -0.766 1
1 252 . 11 1 1 A 22 22 SER CA C 376 55.570 56.119 -0.549 1
1 253 . 11 1 1 A 22 22 SER CB C 376 61.525 65.837 -4.312 1
1 254 . 11 1 1 A 23 23 THR H H 377 8.470 8.768 -0.298 1
1 255 . 11 1 1 A 23 23 THR HA H 377 4.295 4.689 -0.394 1
1 260 . 11 1 1 A 23 23 THR C C 377 171.811 174.756 -2.945 1
1 261 . 11 1 1 A 23 23 THR CA C 377 58.937 61.246 -2.309 1
1 262 . 11 1 1 A 23 23 THR CB C 377 67.250 68.754 -1.504 1
1 264 . 11 1 1 A 23 23 THR N N 377 124.043 115.017 9.026 1
1 265 . 11 1 1 A 24 24 PHE H H 378 8.374 9.170 -0.796 1
1 266 . 11 1 1 A 24 24 PHE HA H 378 4.239 4.383 -0.144 1
1 273 . 11 1 1 A 24 24 PHE C C 378 173.411 177.295 -3.884 1
1 274 . 11 1 1 A 24 24 PHE CA C 378 56.697 59.827 -3.130 1
1 275 . 11 1 1 A 24 24 PHE CB C 378 36.538 39.892 -3.354 1
1 278 . 11 1 1 A 24 24 PHE N N 378 124.732 126.333 -1.601 1
1 279 . 11 1 1 A 25 25 GLN H H 379 8.457 8.152 0.305 1
1 280 . 11 1 1 A 25 25 GLN HA H 379 4.038 4.250 -0.212 1
1 287 . 11 1 1 A 25 25 GLN C C 379 172.431 175.849 -3.418 1
1 288 . 11 1 1 A 25 25 GLN CA C 379 54.078 57.211 -3.133 1
1 289 . 11 1 1 A 25 25 GLN CB C 379 26.414 29.883 -3.469 1
1 291 . 11 1 1 A 25 25 GLN N N 379 118.820 118.615 0.205 1
1 293 . 11 1 1 A 26 26 LEU H H 380 6.985 7.544 -0.559 1
1 294 . 11 1 1 A 26 26 LEU HA H 380 4.229 4.287 -0.058 1
1 304 . 11 1 1 A 26 26 LEU C C 380 173.895 176.432 -2.537 1
1 305 . 11 1 1 A 26 26 LEU CA C 380 52.123 54.482 -2.359 1
1 306 . 11 1 1 A 26 26 LEU CB C 380 40.543 42.752 -2.209 1
1 310 . 11 1 1 A 26 26 LEU N N 380 119.079 119.942 -0.863 1
1 311 . 11 1 1 A 27 27 CYS H H 381 8.905 9.146 -0.241 1
1 312 . 11 1 1 A 27 27 CYS HA H 381 4.013 4.595 -0.582 1
1 315 . 11 1 1 A 27 27 CYS C C 381 174.439 175.401 -0.962 1
1 316 . 11 1 1 A 27 27 CYS CA C 381 57.847 58.739 -0.892 1
1 317 . 11 1 1 A 27 27 CYS CB C 381 28.648 27.824 0.824 1
1 318 . 11 1 1 A 27 27 CYS N N 381 125.151 122.213 2.938 1
1 319 . 11 1 1 A 28 28 LYS H H 382 9.351 8.798 0.553 1
1 320 . 11 1 1 A 28 28 LYS HA H 382 4.157 3.891 0.266 1
1 329 . 11 1 1 A 28 28 LYS C C 382 174.678 178.151 -3.473 1
1 330 . 11 1 1 A 28 28 LYS CA C 382 54.324 59.173 -4.849 1
1 331 . 11 1 1 A 28 28 LYS CB C 382 30.086 32.300 -2.214 1
1 335 . 11 1 1 A 28 28 LYS N N 382 128.840 128.445 0.395 1
1 336 . 11 1 1 A 29 29 ILE H H 383 9.040 7.984 1.056 1
1 337 . 11 1 1 A 29 29 ILE HA H 383 3.804 3.457 0.347 1
1 347 . 11 1 1 A 29 29 ILE C C 383 174.239 177.323 -3.084 1
1 348 . 11 1 1 A 29 29 ILE CA C 383 62.114 65.046 -2.932 1
1 349 . 11 1 1 A 29 29 ILE CB C 383 33.870 38.087 -4.217 1
1 353 . 11 1 1 A 29 29 ILE N N 383 122.718 119.229 3.489 1
1 354 . 11 1 1 A 30 30 CYS H H 384 7.572 7.490 0.082 1
1 355 . 11 1 1 A 30 30 CYS HA H 384 4.548 4.435 0.113 1
1 358 . 11 1 1 A 30 30 CYS C C 384 172.978 175.095 -2.117 1
1 359 . 11 1 1 A 30 30 CYS CA C 384 54.957 59.592 -4.635 1
1 360 . 11 1 1 A 30 30 CYS CB C 384 29.778 29.570 0.208 1
1 361 . 11 1 1 A 30 30 CYS N N 384 116.356 115.612 0.744 1
1 362 . 11 1 1 A 31 31 ALA H H 385 8.205 8.730 -0.525 1
1 363 . 11 1 1 A 31 31 ALA HA H 385 4.107 4.107 0.000 1
1 367 . 11 1 1 A 31 31 ALA C C 385 173.139 177.086 -3.947 1
1 368 . 11 1 1 A 31 31 ALA CA C 385 50.802 53.456 -2.654 1
1 369 . 11 1 1 A 31 31 ALA CB C 385 14.634 17.988 -3.354 1
1 370 . 11 1 1 A 31 31 ALA N N 385 125.526 121.432 4.094 1
1 371 . 11 1 1 A 32 32 GLU H H 386 8.416 7.874 0.542 1
1 372 . 11 1 1 A 32 32 GLU HA H 386 4.467 4.649 -0.182 1
1 377 . 11 1 1 A 32 32 GLU C C 386 172.325 176.227 -3.902 1
1 378 . 11 1 1 A 32 32 GLU CA C 386 55.146 57.490 -2.344 1
1 379 . 11 1 1 A 32 32 GLU CB C 386 31.181 32.616 -1.435 1
1 381 . 11 1 1 A 32 32 GLU N N 386 117.579 116.252 1.327 1
1 382 . 11 1 1 A 33 33 ASN H H 387 7.872 7.929 -0.057 1
1 383 . 11 1 1 A 33 33 ASN HA H 387 4.900 4.934 -0.034 1
1 388 . 11 1 1 A 33 33 ASN C C 387 171.355 174.414 -3.059 1
1 389 . 11 1 1 A 33 33 ASN CA C 387 49.320 52.223 -2.903 1
1 390 . 11 1 1 A 33 33 ASN CB C 387 38.457 39.773 -1.316 1
1 391 . 11 1 1 A 33 33 ASN N N 387 120.399 117.624 2.775 1
1 393 . 11 1 1 A 34 34 ASP H H 388 8.565 8.571 -0.006 1
1 394 . 11 1 1 A 34 34 ASP HA H 388 4.679 4.985 -0.306 1
1 397 . 11 1 1 A 34 34 ASP C C 388 174.243 175.943 -1.700 1
1 398 . 11 1 1 A 34 34 ASP CA C 388 51.809 52.444 -0.635 1
1 399 . 11 1 1 A 34 34 ASP CB C 388 38.007 42.047 -4.040 1
1 400 . 11 1 1 A 34 34 ASP N N 388 120.661 120.325 0.336 1
1 401 . 11 1 1 A 35 35 LYS H H 389 8.544 9.021 -0.477 1
1 402 . 11 1 1 A 35 35 LYS HA H 389 3.411 4.282 -0.871 1
1 409 . 11 1 1 A 35 35 LYS C C 389 172.938 176.905 -3.967 1
1 410 . 11 1 1 A 35 35 LYS CA C 389 54.973 56.074 -1.101 1
1 411 . 11 1 1 A 35 35 LYS CB C 389 30.617 31.808 -1.191 1
1 415 . 11 1 1 A 35 35 LYS N N 389 119.199 121.220 -2.021 1
1 416 . 11 1 1 A 36 36 ASP H H 390 8.327 8.673 -0.346 1
1 417 . 11 1 1 A 36 36 ASP HA H 390 4.724 4.887 -0.163 1
1 420 . 11 1 1 A 36 36 ASP C C 390 172.860 175.298 -2.438 1
1 421 . 11 1 1 A 36 36 ASP CA C 390 51.609 53.644 -2.035 1
1 422 . 11 1 1 A 36 36 ASP CB C 390 39.018 41.568 -2.550 1
1 423 . 11 1 1 A 36 36 ASP N N 390 119.134 120.783 -1.649 1
1 424 . 11 1 1 A 37 37 VAL H H 391 8.544 7.864 0.680 1
1 425 . 11 1 1 A 37 37 VAL HA H 391 4.877 4.747 0.130 1
1 433 . 11 1 1 A 37 37 VAL C C 391 167.519 173.276 -5.757 1
1 434 . 11 1 1 A 37 37 VAL CA C 391 58.259 60.140 -1.881 1
1 435 . 11 1 1 A 37 37 VAL CB C 391 32.277 35.280 -3.003 1
1 438 . 11 1 1 A 37 37 VAL N N 391 121.970 119.539 2.431 1
1 439 . 11 1 1 A 38 38 LYS H H 392 8.621 9.621 -1.000 1
1 440 . 11 1 1 A 38 38 LYS HA H 392 4.991 5.055 -0.064 1
1 449 . 11 1 1 A 38 38 LYS C C 392 172.681 175.357 -2.676 1
1 450 . 11 1 1 A 38 38 LYS CA C 392 51.123 54.808 -3.685 1
1 451 . 11 1 1 A 38 38 LYS CB C 392 33.697 34.763 -1.066 1
1 455 . 11 1 1 A 38 38 LYS N N 392 126.381 129.584 -3.203 1
1 456 . 11 1 1 A 39 39 ILE H H 393 8.723 8.823 -0.100 1
1 457 . 11 1 1 A 39 39 ILE HA H 393 4.239 4.342 -0.103 1
1 467 . 11 1 1 A 39 39 ILE C C 393 172.642 175.710 -3.068 1
1 468 . 11 1 1 A 39 39 ILE CA C 393 57.768 60.994 -3.226 1
1 469 . 11 1 1 A 39 39 ILE CB C 393 35.691 37.619 -1.928 1
1 473 . 11 1 1 A 39 39 ILE N N 393 126.398 127.737 -1.339 1
1 474 . 11 1 1 A 40 40 GLU H H 394 8.506 9.380 -0.874 1
1 475 . 11 1 1 A 40 40 GLU HA H 394 4.753 4.677 0.076 1
1 480 . 11 1 1 A 40 40 GLU C C 394 173.596 176.353 -2.757 1
1 481 . 11 1 1 A 40 40 GLU CA C 394 49.793 53.428 -3.635 1
1 482 . 11 1 1 A 40 40 GLU CB C 394 28.210 30.107 -1.897 1
1 484 . 11 1 1 A 40 40 GLU N N 394 124.864 127.992 -3.128 1
1 485 . 11 1 1 A 41 41 PRO HA H 395 4.864 4.531 0.333 1
1 492 . 11 1 1 A 41 41 PRO C C 395 175.073 177.252 -2.179 1
1 493 . 11 1 1 A 41 41 PRO CA C 395 61.111 63.876 -2.765 1
1 494 . 11 1 1 A 41 41 PRO CB C 395 32.275 33.016 -0.741 1
1 497 . 11 1 1 A 42 42 CYS H H 396 7.828 7.782 0.046 1
1 498 . 11 1 1 A 42 42 CYS HA H 396 4.208 4.068 0.140 1
1 501 . 11 1 1 A 42 42 CYS C C 396 173.877 174.988 -1.111 1
1 502 . 11 1 1 A 42 42 CYS CA C 396 58.021 61.381 -3.360 1
1 503 . 11 1 1 A 42 42 CYS CB C 396 28.242 27.790 0.452 1
1 504 . 11 1 1 A 42 42 CYS N N 396 122.434 117.982 4.452 1
1 505 . 11 1 1 A 43 43 GLY H H 397 8.679 8.501 0.178 1
1 506 . 11 1 1 A 43 43 GLY HA2 H 397 3.507 3.882 -0.375 1
1 507 . 11 1 1 A 43 43 GLY HA3 H 397 3.914 3.891 0.023 1
1 508 . 11 1 1 A 43 43 GLY C C 397 171.981 174.535 -2.554 1
1 509 . 11 1 1 A 43 43 GLY CA C 397 43.347 44.986 -1.639 1
1 510 . 11 1 1 A 43 43 GLY N N 397 112.123 108.489 3.634 1
1 511 . 11 1 1 A 44 44 HIS H H 398 8.329 7.767 0.562 1
1 512 . 11 1 1 A 44 44 HIS HA H 398 4.339 4.489 -0.150 1
1 517 . 11 1 1 A 44 44 HIS C C 398 170.742 174.883 -4.141 1
1 518 . 11 1 1 A 44 44 HIS CA C 398 58.368 56.628 1.740 1
1 519 . 11 1 1 A 44 44 HIS CB C 398 28.434 30.660 -2.226 1
1 522 . 11 1 1 A 44 44 HIS N N 398 121.393 118.602 2.791 1
1 523 . 11 1 1 A 45 45 LEU H H 399 8.241 8.553 -0.312 1
1 524 . 11 1 1 A 45 45 LEU HA H 399 5.570 5.216 0.354 1
1 534 . 11 1 1 A 45 45 LEU C C 399 174.464 175.474 -1.010 1
1 535 . 11 1 1 A 45 45 LEU CA C 399 50.729 53.249 -2.520 1
1 536 . 11 1 1 A 45 45 LEU CB C 399 43.574 45.010 -1.436 1
1 540 . 11 1 1 A 45 45 LEU N N 399 118.469 122.321 -3.852 1
1 541 . 11 1 1 A 46 46 MET H H 400 8.707 8.957 -0.250 1
1 542 . 11 1 1 A 46 46 MET HA H 400 4.842 4.973 -0.131 1
1 550 . 11 1 1 A 46 46 MET C C 400 170.736 174.288 -3.552 1
1 551 . 11 1 1 A 46 46 MET CA C 400 52.804 54.063 -1.259 1
1 552 . 11 1 1 A 46 46 MET CB C 400 31.945 35.119 -3.174 1
1 555 . 11 1 1 A 46 46 MET N N 400 114.897 120.660 -5.763 1
1 556 . 11 1 1 A 47 47 CYS H H 401 9.436 8.310 1.126 1
1 557 . 11 1 1 A 47 47 CYS HA H 401 5.629 5.354 0.275 1
1 560 . 11 1 1 A 47 47 CYS C C 401 173.909 175.954 -2.045 1
1 561 . 11 1 1 A 47 47 CYS CA C 401 54.325 56.864 -2.539 1
1 562 . 11 1 1 A 47 47 CYS CB C 401 30.725 29.713 1.012 1
1 563 . 11 1 1 A 47 47 CYS N N 401 119.575 119.084 0.491 1
1 564 . 11 1 1 A 48 48 THR H H 402 9.842 9.467 0.375 1
1 565 . 11 1 1 A 48 48 THR HA H 402 3.768 3.955 -0.187 1
1 570 . 11 1 1 A 48 48 THR C C 402 174.333 176.218 -1.885 1
1 571 . 11 1 1 A 48 48 THR CA C 402 64.516 65.884 -1.368 1
1 572 . 11 1 1 A 48 48 THR CB C 402 66.288 68.551 -2.263 1
1 574 . 11 1 1 A 48 48 THR N N 402 119.945 119.255 0.690 1
1 575 . 11 1 1 A 49 49 SER H H 403 8.355 8.086 0.269 1
1 576 . 11 1 1 A 49 49 SER HA H 403 4.222 4.068 0.154 1
1 579 . 11 1 1 A 49 49 SER C C 403 175.059 176.719 -1.660 1
1 580 . 11 1 1 A 49 49 SER CA C 403 59.828 61.873 -2.045 1
1 581 . 11 1 1 A 49 49 SER CB C 403 59.717 62.608 -2.891 1
1 582 . 11 1 1 A 49 49 SER N N 403 120.468 116.500 3.968 1
1 583 . 11 1 1 A 50 50 CYS H H 404 9.464 7.871 1.593 1
1 584 . 11 1 1 A 50 50 CYS HA H 404 3.922 4.116 -0.194 1
1 587 . 11 1 1 A 50 50 CYS C C 404 176.081 177.114 -1.033 1
1 588 . 11 1 1 A 50 50 CYS CA C 404 63.076 64.214 -1.138 1
1 589 . 11 1 1 A 50 50 CYS CB C 404 26.078 27.821 -1.743 1
1 590 . 11 1 1 A 50 50 CYS N N 404 126.744 119.251 7.493 1
1 591 . 11 1 1 A 51 51 LEU H H 405 7.948 8.202 -0.254 1
1 592 . 11 1 1 A 51 51 LEU HA H 405 4.064 4.168 -0.104 1
1 602 . 11 1 1 A 51 51 LEU C C 405 175.495 178.793 -3.298 1
1 603 . 11 1 1 A 51 51 LEU CA C 405 55.914 57.908 -1.994 1
1 604 . 11 1 1 A 51 51 LEU CB C 405 38.662 41.935 -3.273 1
1 607 . 11 1 1 A 51 51 LEU N N 405 121.951 122.530 -0.579 1
1 608 . 11 1 1 A 52 52 THR H H 406 8.786 8.510 0.276 1
1 609 . 11 1 1 A 52 52 THR HA H 406 4.024 3.884 0.140 1
1 614 . 11 1 1 A 52 52 THR C C 406 174.139 176.322 -2.183 1
1 615 . 11 1 1 A 52 52 THR CA C 406 64.017 66.386 -2.369 1
1 616 . 11 1 1 A 52 52 THR CB C 406 66.115 68.555 -2.440 1
1 618 . 11 1 1 A 52 52 THR N N 406 115.258 115.855 -0.597 1
1 619 . 11 1 1 A 53 53 SER H H 407 8.115 7.759 0.356 1
1 620 . 11 1 1 A 53 53 SER HA H 407 4.204 4.110 0.094 1
1 623 . 11 1 1 A 53 53 SER C C 407 174.456 176.005 -1.549 1
1 624 . 11 1 1 A 53 53 SER CA C 407 59.090 62.678 -3.588 1
1 625 . 11 1 1 A 53 53 SER CB C 407 60.146 63.166 -3.020 1
1 626 . 11 1 1 A 53 53 SER N N 407 116.852 116.768 0.084 1
1 627 . 11 1 1 A 54 54 TRP H H 408 8.123 8.174 -0.051 1
1 628 . 11 1 1 A 54 54 TRP HA H 408 4.371 4.267 0.104 1
1 637 . 11 1 1 A 54 54 TRP C C 408 175.981 178.865 -2.884 1
1 638 . 11 1 1 A 54 54 TRP CA C 408 57.323 61.066 -3.743 1
1 639 . 11 1 1 A 54 54 TRP CB C 408 26.812 29.673 -2.861 1
1 645 . 11 1 1 A 54 54 TRP N N 408 123.556 123.956 -0.400 1
1 647 . 11 1 1 A 55 55 GLN H H 409 8.502 8.552 -0.050 1
1 648 . 11 1 1 A 55 55 GLN HA H 409 3.999 3.764 0.235 1
1 655 . 11 1 1 A 55 55 GLN C C 409 177.300 178.614 -1.314 1
1 656 . 11 1 1 A 55 55 GLN CA C 409 56.484 59.183 -2.699 1
1 657 . 11 1 1 A 55 55 GLN CB C 409 26.190 28.366 -2.176 1
1 659 . 11 1 1 A 55 55 GLN N N 409 118.044 118.235 -0.191 1
1 661 . 11 1 1 A 56 56 GLU H H 410 8.467 8.547 -0.080 1
1 662 . 11 1 1 A 56 56 GLU HA H 410 4.057 4.085 -0.028 1
1 667 . 11 1 1 A 56 56 GLU C C 410 174.787 177.183 -2.396 1
1 668 . 11 1 1 A 56 56 GLU CA C 410 55.909 58.439 -2.530 1
1 669 . 11 1 1 A 56 56 GLU CB C 410 26.895 29.497 -2.602 1
1 671 . 11 1 1 A 56 56 GLU N N 410 119.448 120.082 -0.634 1
1 672 . 11 1 1 A 57 57 SER H H 411 7.438 7.512 -0.074 1
1 673 . 11 1 1 A 57 57 SER HA H 411 4.607 4.351 0.256 1
1 676 . 11 1 1 A 57 57 SER C C 411 170.849 174.010 -3.161 1
1 677 . 11 1 1 A 57 57 SER CA C 411 55.540 58.925 -3.385 1
1 678 . 11 1 1 A 57 57 SER CB C 411 60.928 63.970 -3.042 1
1 679 . 11 1 1 A 57 57 SER N N 411 113.752 113.566 0.186 1
1 680 . 11 1 1 A 58 58 GLU H H 412 7.855 7.284 0.571 1
1 681 . 11 1 1 A 58 58 GLU HA H 412 3.772 4.273 -0.501 1
1 686 . 11 1 1 A 58 58 GLU C C 412 173.743 176.521 -2.778 1
1 687 . 11 1 1 A 58 58 GLU CA C 412 54.442 57.571 -3.129 1
1 688 . 11 1 1 A 58 58 GLU CB C 412 24.603 31.059 -6.456 1
1 690 . 11 1 1 A 58 58 GLU N N 412 115.908 118.388 -2.480 1
1 691 . 11 1 1 A 59 59 GLY H H 413 7.588 7.167 0.421 1
1 692 . 11 1 1 A 59 59 GLY HA2 H 413 1.643 3.334 -1.691 1
1 693 . 11 1 1 A 59 59 GLY HA3 H 413 2.949 3.741 -0.792 1
1 694 . 11 1 1 A 59 59 GLY C C 413 170.850 174.572 -3.722 1
1 695 . 11 1 1 A 59 59 GLY CA C 413 41.724 46.242 -4.518 1
1 696 . 11 1 1 A 59 59 GLY N N 413 108.032 107.580 0.452 1
1 697 . 11 1 1 A 60 60 GLN H H 414 7.973 7.554 0.419 1
1 698 . 11 1 1 A 60 60 GLN HA H 414 4.366 4.646 -0.280 1
1 705 . 11 1 1 A 60 60 GLN C C 414 173.108 175.579 -2.471 1
1 706 . 11 1 1 A 60 60 GLN CA C 414 52.422 54.611 -2.189 1
1 707 . 11 1 1 A 60 60 GLN CB C 414 27.049 29.063 -2.014 1
1 709 . 11 1 1 A 60 60 GLN N N 414 122.690 120.486 2.204 1
1 711 . 11 1 1 A 61 61 GLY H H 415 8.301 7.913 0.388 1
1 712 . 11 1 1 A 61 61 GLY HA2 H 415 3.700 4.250 -0.550 1
1 713 . 11 1 1 A 61 61 GLY HA3 H 415 3.920 4.287 -0.367 1
1 714 . 11 1 1 A 61 61 GLY C C 415 170.249 174.215 -3.966 1
1 715 . 11 1 1 A 61 61 GLY CA C 415 42.210 44.330 -2.120 1
1 716 . 11 1 1 A 61 61 GLY N N 415 110.794 113.381 -2.587 1
1 717 . 11 1 1 A 62 62 CYS H H 416 8.549 8.472 0.077 1
1 718 . 11 1 1 A 62 62 CYS HA H 416 4.227 4.667 -0.440 1
1 721 . 11 1 1 A 62 62 CYS C C 416 172.914 175.289 -2.375 1
1 722 . 11 1 1 A 62 62 CYS CA C 416 54.008 58.614 -4.606 1
1 723 . 11 1 1 A 62 62 CYS CB C 416 29.716 27.514 2.202 1
1 724 . 11 1 1 A 62 62 CYS N N 416 123.683 121.057 2.626 1
1 725 . 11 1 1 A 63 63 PRO HA H 417 2.611 2.524 0.087 1
1 732 . 11 1 1 A 63 63 PRO C C 417 174.143 177.878 -3.735 1
1 733 . 11 1 1 A 63 63 PRO CA C 417 61.689 63.677 -1.988 1
1 734 . 11 1 1 A 63 63 PRO CB C 417 28.534 30.934 -2.400 1
1 737 . 11 1 1 A 64 64 PHE H H 418 8.968 7.797 1.171 1
1 738 . 11 1 1 A 64 64 PHE HA H 418 4.250 4.105 0.145 1
1 746 . 11 1 1 A 64 64 PHE C C 418 174.243 178.635 -4.392 1
1 747 . 11 1 1 A 64 64 PHE CA C 418 56.720 60.184 -3.464 1
1 748 . 11 1 1 A 64 64 PHE CB C 418 36.458 39.379 -2.921 1
1 752 . 11 1 1 A 64 64 PHE N N 418 117.008 115.677 1.331 1
1 753 . 11 1 1 A 65 65 CYS H H 419 7.968 8.071 -0.103 1
1 754 . 11 1 1 A 65 65 CYS HA H 419 4.906 4.446 0.460 1
1 757 . 11 1 1 A 65 65 CYS C C 419 173.198 174.920 -1.722 1
1 758 . 11 1 1 A 65 65 CYS CA C 419 55.870 60.478 -4.608 1
1 759 . 11 1 1 A 65 65 CYS CB C 419 30.559 28.728 1.831 1
1 760 . 11 1 1 A 65 65 CYS N N 419 117.505 117.160 0.345 1
1 761 . 11 1 1 A 66 66 ARG H H 420 8.761 7.927 0.834 1
1 762 . 11 1 1 A 66 66 ARG HA H 420 4.365 4.394 -0.029 1
1 769 . 11 1 1 A 66 66 ARG C C 420 172.921 174.666 -1.745 1
1 770 . 11 1 1 A 66 66 ARG CA C 420 54.763 57.156 -2.393 1
1 771 . 11 1 1 A 66 66 ARG CB C 420 24.286 26.963 -2.677 1
1 774 . 11 1 1 A 66 66 ARG N N 420 118.763 116.101 2.662 1
1 775 . 11 1 1 A 67 67 CYS H H 421 8.223 7.906 0.317 1
1 776 . 11 1 1 A 67 67 CYS HA H 421 4.419 4.578 -0.159 1
1 779 . 11 1 1 A 67 67 CYS C C 421 171.160 174.872 -3.712 1
1 780 . 11 1 1 A 67 67 CYS CA C 421 57.119 58.172 -1.053 1
1 781 . 11 1 1 A 67 67 CYS CB C 421 25.911 29.746 -3.835 1
1 782 . 11 1 1 A 67 67 CYS N N 421 120.627 116.741 3.886 1
1 783 . 11 1 1 A 68 68 GLU H H 422 8.416 8.503 -0.087 1
1 784 . 11 1 1 A 68 68 GLU HA H 422 4.025 4.145 -0.120 1
1 789 . 11 1 1 A 68 68 GLU C C 422 173.764 176.317 -2.553 1
1 790 . 11 1 1 A 68 68 GLU CA C 422 54.752 57.664 -2.912 1
1 791 . 11 1 1 A 68 68 GLU CB C 422 27.302 29.715 -2.413 1
1 793 . 11 1 1 A 68 68 GLU N N 422 122.370 121.131 1.239 1
1 794 . 11 1 1 A 69 69 ILE H H 423 8.648 8.884 -0.236 1
1 795 . 11 1 1 A 69 69 ILE HA H 423 4.012 4.558 -0.546 1
1 805 . 11 1 1 A 69 69 ILE C C 423 174.257 175.413 -1.156 1
1 806 . 11 1 1 A 69 69 ILE CA C 423 59.740 60.728 -0.988 1
1 807 . 11 1 1 A 69 69 ILE CB C 423 35.846 39.608 -3.762 1
1 811 . 11 1 1 A 69 69 ILE N N 423 125.988 125.729 0.259 1
1 812 . 11 1 1 A 70 70 LYS H H 424 9.185 9.638 -0.453 1
1 813 . 11 1 1 A 70 70 LYS HA H 424 4.434 4.485 -0.051 1
1 822 . 11 1 1 A 70 70 LYS C C 424 173.880 176.018 -2.138 1
1 823 . 11 1 1 A 70 70 LYS CA C 424 53.378 56.989 -3.611 1
1 824 . 11 1 1 A 70 70 LYS CB C 424 30.397 35.311 -4.914 1
1 828 . 11 1 1 A 70 70 LYS N N 424 128.977 129.856 -0.879 1
1 829 . 11 1 1 A 71 71 GLY H H 425 7.810 7.696 0.114 1
1 830 . 11 1 1 A 71 71 GLY HA2 H 425 4.094 4.013 0.081 1
1 831 . 11 1 1 A 71 71 GLY HA3 H 425 4.159 4.017 0.142 1
1 832 . 11 1 1 A 71 71 GLY C C 425 168.179 172.278 -4.099 1
1 833 . 11 1 1 A 71 71 GLY CA C 425 42.326 45.189 -2.863 1
1 834 . 11 1 1 A 71 71 GLY N N 425 107.696 106.682 1.014 1
1 835 . 11 1 1 A 72 72 THR H H 426 8.048 8.521 -0.473 1
1 836 . 11 1 1 A 72 72 THR HA H 426 5.258 5.506 -0.248 1
1 841 . 11 1 1 A 72 72 THR C C 426 170.979 172.133 -1.154 1
1 842 . 11 1 1 A 72 72 THR CA C 426 56.755 60.185 -3.430 1
1 843 . 11 1 1 A 72 72 THR CB C 426 69.226 71.597 -2.371 1
1 845 . 11 1 1 A 72 72 THR N N 426 109.122 110.967 -1.845 1
1 846 . 11 1 1 A 73 73 GLU H H 427 8.912 9.346 -0.434 1
1 847 . 11 1 1 A 73 73 GLU HA H 427 4.954 4.895 0.059 1
1 852 . 11 1 1 A 73 73 GLU C C 427 170.353 174.607 -4.254 1
1 853 . 11 1 1 A 73 73 GLU CA C 427 50.182 52.904 -2.722 1
1 854 . 11 1 1 A 73 73 GLU CB C 427 30.559 32.963 -2.404 1
1 856 . 11 1 1 A 73 73 GLU N N 427 121.703 124.740 -3.037 1
1 1 . 11 1 1 A 74 74 PRO HA H 428 4.372 4.966 -0.594 1
1 2 . 11 1 1 A 74 74 PRO C C 428 173.839 176.533 -2.694 1
1 3 . 11 1 1 A 74 74 PRO CA C 428 60.241 62.727 -2.486 1
1 4 . 11 1 1 A 74 74 PRO CB C 428 29.299 31.873 -2.574 1
1 857 . 11 1 1 A 74 74 PRO HA H 428 4.782 4.966 -0.184 1
1 864 . 11 1 1 A 74 74 PRO C C 428 174.027 176.533 -2.506 1
1 865 . 11 1 1 A 74 74 PRO CA C 428 59.771 62.727 -2.956 1
1 866 . 11 1 1 A 74 74 PRO CB C 428 29.633 31.873 -2.240 1
1 7 . 11 1 1 A 75 75 ILE H H 429 8.144 9.123 -0.979 1
1 8 . 11 1 1 A 75 75 ILE HA H 429 4.086 4.630 -0.544 1
1 15 . 11 1 1 A 75 75 ILE C C 429 173.426 174.965 -1.539 1
1 16 . 11 1 1 A 75 75 ILE CA C 429 58.339 60.465 -2.126 1
1 17 . 11 1 1 A 75 75 ILE CB C 429 35.988 39.857 -3.869 1
1 21 . 11 1 1 A 75 75 ILE N N 429 121.551 122.528 -0.977 1
1 869 . 11 1 1 A 75 75 ILE H H 429 7.682 9.123 -1.441 1
1 870 . 11 1 1 A 75 75 ILE HA H 429 4.282 4.630 -0.348 1
1 880 . 11 1 1 A 75 75 ILE C C 429 172.510 174.965 -2.455 1
1 881 . 11 1 1 A 75 75 ILE CA C 429 57.456 60.465 -3.009 1
1 882 . 11 1 1 A 75 75 ILE CB C 429 37.903 39.857 -1.954 1
1 886 . 11 1 1 A 75 75 ILE N N 429 119.651 122.528 -2.877 1
1 1 . 11 1 1 A 76 76 VAL HA H 430 4.086 4.711 -0.625 1
1 2 . 11 1 1 A 76 76 VAL CA C 430 59.372 60.577 -1.205 1
1 22 . 11 1 1 A 76 76 VAL H H 430 8.221 8.766 -0.545 1
1 23 . 11 1 1 A 76 76 VAL HA H 430 4.083 4.711 -0.628 1
1 24 . 11 1 1 A 76 76 VAL C C 430 173.067 175.732 -2.665 1
1 25 . 11 1 1 A 76 76 VAL CA C 430 59.445 60.577 -1.132 1
1 26 . 11 1 1 A 76 76 VAL CB C 430 30.407 31.730 -1.323 1
1 27 . 11 1 1 A 76 76 VAL N N 430 125.930 121.689 4.241 1
1 887 . 11 1 1 A 76 76 VAL H H 430 8.122 8.766 -0.644 1
1 888 . 11 1 1 A 76 76 VAL HA H 430 4.197 4.711 -0.514 1
1 890 . 11 1 1 A 76 76 VAL C C 430 172.971 175.732 -2.761 1
1 891 . 11 1 1 A 76 76 VAL CA C 430 58.821 60.577 -1.756 1
1 892 . 11 1 1 A 76 76 VAL CB C 430 30.807 31.730 -0.923 1
1 895 . 11 1 1 A 76 76 VAL N N 430 124.178 121.689 2.489 1
1 4 . 11 1 1 A 77 77 VAL H H 431 8.204 8.341 -0.137 1
1 5 . 11 1 1 A 77 77 VAL HA H 431 4.049 4.526 -0.477 1
1 6 . 11 1 1 A 77 77 VAL C C 431 172.636 176.031 -3.395 1
1 7 . 11 1 1 A 77 77 VAL CA C 431 59.315 60.326 -1.011 1
1 8 . 11 1 1 A 77 77 VAL CB C 431 30.219 31.717 -1.498 1
1 9 . 11 1 1 A 77 77 VAL N N 431 125.320 121.807 3.513 1
1 28 . 11 1 1 A 77 77 VAL H H 431 8.412 8.341 0.071 1
1 29 . 11 1 1 A 77 77 VAL HA H 431 4.038 4.526 -0.488 1
1 37 . 11 1 1 A 77 77 VAL C C 431 172.617 176.031 -3.414 1
1 38 . 11 1 1 A 77 77 VAL CA C 431 59.137 60.326 -1.189 1
1 39 . 11 1 1 A 77 77 VAL CB C 431 30.292 31.717 -1.425 1
1 42 . 11 1 1 A 77 77 VAL N N 431 125.655 121.807 3.848 1
1 896 . 11 1 1 A 77 77 VAL H H 431 8.448 8.341 0.107 1
1 897 . 11 1 1 A 77 77 VAL HA H 431 4.087 4.526 -0.439 1
1 905 . 11 1 1 A 77 77 VAL C C 431 172.493 176.031 -3.538 1
1 906 . 11 1 1 A 77 77 VAL CA C 431 59.185 60.326 -1.141 1
1 907 . 11 1 1 A 77 77 VAL CB C 431 30.084 31.717 -1.633 1
1 910 . 11 1 1 A 77 77 VAL N N 431 125.770 121.807 3.963 1
1 43 . 11 1 1 A 78 78 ASP H H 432 8.419 7.569 0.850 1
1 44 . 11 1 1 A 78 78 ASP HA H 432 4.829 4.863 -0.034 1
1 45 . 11 1 1 A 78 78 ASP C C 432 172.252 175.805 -3.553 1
1 46 . 11 1 1 A 78 78 ASP CA C 432 49.320 52.367 -3.047 1
1 47 . 11 1 1 A 78 78 ASP CB C 432 39.066 40.948 -1.882 1
1 48 . 11 1 1 A 78 78 ASP N N 432 126.226 121.561 4.665 1
1 911 . 11 1 1 A 78 78 ASP H H 432 8.493 7.569 0.924 1
1 912 . 11 1 1 A 78 78 ASP HA H 432 4.852 4.863 -0.011 1
1 915 . 11 1 1 A 78 78 ASP C C 432 172.048 175.805 -3.757 1
1 916 . 11 1 1 A 78 78 ASP CA C 432 49.233 52.367 -3.134 1
1 917 . 11 1 1 A 78 78 ASP CB C 432 38.858 40.948 -2.090 1
1 918 . 11 1 1 A 78 78 ASP N N 432 126.705 121.561 5.144 1
1 10 . 11 1 1 A 79 79 PRO CA C 433 63.865 65.254 -1.389 1
1 49 . 11 1 1 A 79 79 PRO C C 433 173.867 177.609 -3.742 1
1 919 . 11 1 1 A 79 79 PRO HA H 433 4.237 4.374 -0.137 1
1 926 . 11 1 1 A 79 79 PRO C C 433 173.812 177.609 -3.797 1
1 927 . 11 1 1 A 79 79 PRO CA C 433 60.627 65.254 -4.627 1
1 928 . 11 1 1 A 79 79 PRO CB C 433 29.329 31.853 -2.524 1
1 11 . 11 1 1 A 80 80 PHE H H 434 8.182 8.306 -0.124 1
1 12 . 11 1 1 A 80 80 PHE HA H 434 4.499 4.430 0.069 1
1 13 . 11 1 1 A 80 80 PHE C C 434 171.680 173.949 -2.269 1
1 14 . 11 1 1 A 80 80 PHE CA C 434 54.657 59.895 -5.238 1
1 15 . 11 1 1 A 80 80 PHE CB C 434 36.272 38.713 -2.441 1
1 16 . 11 1 1 A 80 80 PHE N N 434 118.611 119.551 -0.940 1
1 50 . 11 1 1 A 80 80 PHE H H 434 8.191 8.306 -0.115 1
1 51 . 11 1 1 A 80 80 PHE HA H 434 4.528 4.430 0.098 1
1 54 . 11 1 1 A 80 80 PHE C C 434 172.457 173.949 -1.492 1
1 55 . 11 1 1 A 80 80 PHE CA C 434 54.828 59.895 -5.067 1
1 56 . 11 1 1 A 80 80 PHE CB C 434 36.457 38.713 -2.256 1
1 57 . 11 1 1 A 80 80 PHE N N 434 118.871 119.551 -0.680 1
1 931 . 11 1 1 A 80 80 PHE H H 434 8.191 8.306 -0.115 1
1 932 . 11 1 1 A 80 80 PHE HA H 434 4.463 4.430 0.033 1
1 939 . 11 1 1 A 80 80 PHE C C 434 172.283 173.949 -1.666 1
1 940 . 11 1 1 A 80 80 PHE CA C 434 54.971 59.895 -4.924 1
1 941 . 11 1 1 A 80 80 PHE CB C 434 36.490 38.713 -2.223 1
1 944 . 11 1 1 A 80 80 PHE N N 434 119.263 119.551 -0.288 1
1 17 . 11 1 1 A 81 81 ASP H H 435 7.490 8.576 -1.086 1
1 18 . 11 1 1 A 81 81 ASP HA H 435 4.698 4.856 -0.158 1
1 19 . 11 1 1 A 81 81 ASP C C 435 171.662 175.274 -3.612 1
1 20 . 11 1 1 A 81 81 ASP CA C 435 49.570 51.795 -2.225 1
1 21 . 11 1 1 A 81 81 ASP CB C 435 40.104 41.136 -1.032 1
1 22 . 11 1 1 A 81 81 ASP N N 435 120.304 118.404 1.900 1
1 58 . 11 1 1 A 81 81 ASP H H 435 7.881 8.576 -0.695 1
1 59 . 11 1 1 A 81 81 ASP HA H 435 4.801 4.856 -0.055 1
1 60 . 11 1 1 A 81 81 ASP C C 435 171.144 175.274 -4.130 1
1 61 . 11 1 1 A 81 81 ASP CA C 435 49.406 51.795 -2.389 1
1 62 . 11 1 1 A 81 81 ASP CB C 435 38.618 41.136 -2.518 1
1 63 . 11 1 1 A 81 81 ASP N N 435 123.108 118.404 4.704 1
1 945 . 11 1 1 A 81 81 ASP H H 435 7.823 8.576 -0.753 1
1 946 . 11 1 1 A 81 81 ASP HA H 435 4.759 4.856 -0.097 1
1 949 . 11 1 1 A 81 81 ASP C C 435 171.057 175.274 -4.217 1
1 950 . 11 1 1 A 81 81 ASP CA C 435 49.174 51.795 -2.621 1
1 951 . 11 1 1 A 81 81 ASP CB C 435 38.725 41.136 -2.411 1
1 952 . 11 1 1 A 81 81 ASP N N 435 123.530 118.404 5.126 1
1 23 . 11 1 1 A 82 82 PRO HA H 436 4.758 4.680 0.078 1
1 24 . 11 1 1 A 82 82 PRO C C 436 172.944 176.190 -3.246 1
1 25 . 11 1 1 A 82 82 PRO CA C 436 60.134 64.042 -3.908 1
1 26 . 11 1 1 A 82 82 PRO CB C 436 31.425 32.873 -1.448 1
1 64 . 11 1 1 A 82 82 PRO HA H 436 4.364 4.680 -0.316 1
1 67 . 11 1 1 A 82 82 PRO C C 436 173.563 176.190 -2.627 1
1 68 . 11 1 1 A 82 82 PRO CA C 436 60.729 64.042 -3.313 1
1 69 . 11 1 1 A 82 82 PRO CB C 436 29.160 32.873 -3.713 1
1 953 . 11 1 1 A 82 82 PRO HA H 436 4.296 4.680 -0.384 1
1 960 . 11 1 1 A 82 82 PRO C C 436 173.494 176.190 -2.696 1
1 961 . 11 1 1 A 82 82 PRO CA C 436 60.625 64.042 -3.417 1
1 962 . 11 1 1 A 82 82 PRO CB C 436 29.237 32.873 -3.636 1
1 1 . 12 1 1 A 3 3 LEU HA H 357 4.257 4.091 0.166 1
1 11 . 12 1 1 A 3 3 LEU C C 357 174.994 176.971 -1.977 1
1 12 . 12 1 1 A 3 3 LEU CA C 357 53.329 57.729 -4.400 1
1 13 . 12 1 1 A 3 3 LEU CB C 357 39.382 41.979 -2.597 1
1 17 . 12 1 1 A 4 4 GLN H H 358 8.234 7.774 0.460 1
1 18 . 12 1 1 A 4 4 GLN HA H 358 4.211 4.433 -0.222 1
1 25 . 12 1 1 A 4 4 GLN C C 358 173.357 174.944 -1.587 1
1 26 . 12 1 1 A 4 4 GLN CA C 358 53.791 55.595 -1.804 1
1 27 . 12 1 1 A 4 4 GLN CB C 358 26.456 29.589 -3.133 1
1 29 . 12 1 1 A 4 4 GLN N N 358 119.506 118.233 1.273 1
1 31 . 12 1 1 A 5 5 ASP H H 359 8.090 8.245 -0.155 1
1 32 . 12 1 1 A 5 5 ASP HA H 359 4.458 5.068 -0.610 1
1 35 . 12 1 1 A 5 5 ASP C C 359 173.492 175.444 -1.952 1
1 36 . 12 1 1 A 5 5 ASP CA C 359 52.309 52.188 0.121 1
1 37 . 12 1 1 A 5 5 ASP CB C 359 38.312 42.231 -3.919 1
1 38 . 12 1 1 A 5 5 ASP N N 359 120.683 120.366 0.317 1
1 39 . 12 1 1 A 6 6 HIS H H 360 8.103 8.771 -0.668 1
1 40 . 12 1 1 A 6 6 HIS HA H 360 4.540 4.669 -0.129 1
1 45 . 12 1 1 A 6 6 HIS C C 360 172.801 175.128 -2.327 1
1 46 . 12 1 1 A 6 6 HIS CA C 360 53.874 57.438 -3.564 1
1 47 . 12 1 1 A 6 6 HIS CB C 360 27.878 30.982 -3.104 1
1 50 . 12 1 1 A 6 6 HIS N N 360 118.844 116.715 2.129 1
1 51 . 12 1 1 A 7 7 ILE H H 361 7.862 8.197 -0.335 1
1 52 . 12 1 1 A 7 7 ILE HA H 361 4.010 3.731 0.279 1
1 62 . 12 1 1 A 7 7 ILE C C 361 173.268 175.470 -2.202 1
1 63 . 12 1 1 A 7 7 ILE CA C 361 58.740 62.193 -3.453 1
1 64 . 12 1 1 A 7 7 ILE CB C 361 35.788 36.642 -0.854 1
1 68 . 12 1 1 A 7 7 ILE N N 361 121.598 116.906 4.692 1
1 69 . 12 1 1 A 8 8 LYS H H 362 8.231 8.398 -0.167 1
1 70 . 12 1 1 A 8 8 LYS HA H 362 4.313 4.133 0.180 1
1 79 . 12 1 1 A 8 8 LYS C C 362 173.899 175.385 -1.486 1
1 80 . 12 1 1 A 8 8 LYS CA C 362 53.677 58.487 -4.810 1
1 81 . 12 1 1 A 8 8 LYS CB C 362 30.355 31.299 -0.944 1
1 85 . 12 1 1 A 8 8 LYS N N 362 124.980 117.039 7.941 1
1 86 . 12 1 1 A 9 9 VAL H H 363 8.044 8.284 -0.240 1
1 87 . 12 1 1 A 9 9 VAL HA H 363 4.089 4.535 -0.446 1
1 95 . 12 1 1 A 9 9 VAL C C 363 173.760 176.260 -2.500 1
1 96 . 12 1 1 A 9 9 VAL CA C 363 59.814 61.475 -1.661 1
1 97 . 12 1 1 A 9 9 VAL CB C 363 30.058 32.419 -2.361 1
1 100 . 12 1 1 A 9 9 VAL N N 363 121.366 120.931 0.435 1
1 101 . 12 1 1 A 10 10 THR H H 364 8.076 8.626 -0.550 1
1 102 . 12 1 1 A 10 10 THR HA H 364 4.302 3.811 0.491 1
1 107 . 12 1 1 A 10 10 THR C C 364 172.135 176.252 -4.117 1
1 108 . 12 1 1 A 10 10 THR CA C 364 59.134 67.002 -7.868 1
1 109 . 12 1 1 A 10 10 THR CB C 364 67.415 68.833 -1.418 1
1 111 . 12 1 1 A 10 10 THR N N 364 116.817 122.885 -6.068 1
1 112 . 12 1 1 A 11 11 GLN H H 365 8.463 7.709 0.754 1
1 113 . 12 1 1 A 11 11 GLN HA H 365 4.046 4.130 -0.084 1
1 120 . 12 1 1 A 11 11 GLN C C 365 173.944 175.666 -1.722 1
1 121 . 12 1 1 A 11 11 GLN CA C 365 54.517 58.535 -4.018 1
1 122 . 12 1 1 A 11 11 GLN CB C 365 26.250 29.011 -2.761 1
1 124 . 12 1 1 A 11 11 GLN N N 365 122.059 119.117 2.942 1
1 126 . 12 1 1 A 12 12 GLU H H 366 8.449 7.954 0.495 1
1 127 . 12 1 1 A 12 12 GLU HA H 366 4.093 4.100 -0.007 1
1 132 . 12 1 1 A 12 12 GLU C C 366 174.746 176.803 -2.057 1
1 133 . 12 1 1 A 12 12 GLU CA C 366 55.235 57.531 -2.296 1
1 134 . 12 1 1 A 12 12 GLU CB C 366 27.180 27.330 -0.150 1
1 136 . 12 1 1 A 12 12 GLU N N 366 120.415 115.720 4.695 1
1 137 . 12 1 1 A 13 13 GLN H H 367 8.031 8.003 0.028 1
1 138 . 12 1 1 A 13 13 GLN HA H 367 4.113 4.064 0.049 1
1 145 . 12 1 1 A 13 13 GLN C C 367 173.693 175.617 -1.924 1
1 146 . 12 1 1 A 13 13 GLN CA C 367 54.132 56.493 -2.361 1
1 147 . 12 1 1 A 13 13 GLN CB C 367 26.420 27.161 -0.741 1
1 149 . 12 1 1 A 13 13 GLN N N 367 119.721 116.622 3.099 1
1 151 . 12 1 1 A 14 14 TYR H H 368 8.111 8.581 -0.470 1
1 152 . 12 1 1 A 14 14 TYR HA H 368 4.339 4.704 -0.365 1
1 159 . 12 1 1 A 14 14 TYR C C 368 173.916 176.485 -2.569 1
1 160 . 12 1 1 A 14 14 TYR CA C 368 56.572 57.967 -1.395 1
1 161 . 12 1 1 A 14 14 TYR CB C 368 35.879 38.113 -2.234 1
1 164 . 12 1 1 A 14 14 TYR N N 368 120.541 120.177 0.364 1
1 165 . 12 1 1 A 15 15 GLU H H 369 8.287 8.229 0.058 1
1 166 . 12 1 1 A 15 15 GLU HA H 369 4.009 4.350 -0.341 1
1 171 . 12 1 1 A 15 15 GLU C C 369 174.448 178.481 -4.033 1
1 172 . 12 1 1 A 15 15 GLU CA C 369 55.047 59.306 -4.259 1
1 173 . 12 1 1 A 15 15 GLU CB C 369 27.226 29.794 -2.568 1
1 175 . 12 1 1 A 15 15 GLU N N 369 120.398 122.818 -2.420 1
1 176 . 12 1 1 A 16 16 LEU H H 370 7.785 7.820 -0.035 1
1 177 . 12 1 1 A 16 16 LEU HA H 370 4.138 4.192 -0.054 1
1 187 . 12 1 1 A 16 16 LEU C C 370 175.089 177.903 -2.814 1
1 188 . 12 1 1 A 16 16 LEU CA C 370 53.425 56.410 -2.985 1
1 189 . 12 1 1 A 16 16 LEU CB C 370 39.554 41.272 -1.718 1
1 193 . 12 1 1 A 16 16 LEU N N 370 121.323 118.904 2.419 1
1 194 . 12 1 1 A 17 17 TYR H H 371 8.038 8.386 -0.348 1
1 195 . 12 1 1 A 17 17 TYR HA H 371 4.380 4.435 -0.055 1
1 202 . 12 1 1 A 17 17 TYR C C 371 173.931 177.231 -3.300 1
1 203 . 12 1 1 A 17 17 TYR CA C 371 56.143 59.399 -3.256 1
1 204 . 12 1 1 A 17 17 TYR CB C 371 35.501 37.032 -1.531 1
1 207 . 12 1 1 A 17 17 TYR N N 371 119.465 120.429 -0.964 1
1 208 . 12 1 1 A 18 18 CYS H H 372 8.021 7.387 0.634 1
1 209 . 12 1 1 A 18 18 CYS HA H 372 4.236 4.065 0.171 1
1 212 . 12 1 1 A 18 18 CYS C C 372 172.457 174.463 -2.006 1
1 213 . 12 1 1 A 18 18 CYS CA C 372 56.997 60.372 -3.375 1
1 214 . 12 1 1 A 18 18 CYS CB C 372 25.080 28.263 -3.183 1
1 215 . 12 1 1 A 18 18 CYS N N 372 119.913 118.598 1.315 1
1 216 . 12 1 1 A 19 19 GLU H H 373 8.151 8.043 0.108 1
1 217 . 12 1 1 A 19 19 GLU HA H 373 4.130 4.697 -0.567 1
1 222 . 12 1 1 A 19 19 GLU C C 373 174.151 175.984 -1.833 1
1 223 . 12 1 1 A 19 19 GLU CA C 373 54.535 54.780 -0.245 1
1 224 . 12 1 1 A 19 19 GLU CB C 373 27.244 31.843 -4.599 1
1 226 . 12 1 1 A 19 19 GLU N N 373 122.431 119.676 2.755 1
1 227 . 12 1 1 A 20 20 MET H H 374 8.109 9.081 -0.972 1
1 228 . 12 1 1 A 20 20 MET HA H 374 4.352 4.598 -0.246 1
1 236 . 12 1 1 A 20 20 MET C C 374 174.200 175.578 -1.378 1
1 237 . 12 1 1 A 20 20 MET CA C 374 53.238 57.090 -3.852 1
1 238 . 12 1 1 A 20 20 MET CB C 374 30.237 35.036 -4.799 1
1 241 . 12 1 1 A 20 20 MET N N 374 119.754 122.085 -2.331 1
1 242 . 12 1 1 A 21 21 GLY H H 375 8.231 7.376 0.855 1
1 243 . 12 1 1 A 21 21 GLY HA2 H 375 3.861 4.108 -0.247 1
1 244 . 12 1 1 A 21 21 GLY HA3 H 375 3.960 4.109 -0.149 1
1 245 . 12 1 1 A 21 21 GLY C C 375 171.928 173.407 -1.479 1
1 246 . 12 1 1 A 21 21 GLY CA C 375 42.930 45.692 -2.762 1
1 247 . 12 1 1 A 21 21 GLY N N 375 109.484 106.550 2.934 1
1 248 . 12 1 1 A 22 22 SER HA H 376 4.492 4.814 -0.322 1
1 251 . 12 1 1 A 22 22 SER C C 376 172.206 173.464 -1.258 1
1 252 . 12 1 1 A 22 22 SER CA C 376 55.570 57.289 -1.719 1
1 253 . 12 1 1 A 22 22 SER CB C 376 61.525 63.331 -1.806 1
1 254 . 12 1 1 A 23 23 THR H H 377 8.470 8.696 -0.226 1
1 255 . 12 1 1 A 23 23 THR HA H 377 4.295 4.269 0.026 1
1 260 . 12 1 1 A 23 23 THR C C 377 171.811 174.397 -2.586 1
1 261 . 12 1 1 A 23 23 THR CA C 377 58.937 63.803 -4.866 1
1 262 . 12 1 1 A 23 23 THR CB C 377 67.250 68.475 -1.225 1
1 264 . 12 1 1 A 23 23 THR N N 377 124.043 123.432 0.611 1
1 265 . 12 1 1 A 24 24 PHE H H 378 8.374 8.980 -0.606 1
1 266 . 12 1 1 A 24 24 PHE HA H 378 4.239 4.691 -0.452 1
1 273 . 12 1 1 A 24 24 PHE C C 378 173.411 175.062 -1.651 1
1 274 . 12 1 1 A 24 24 PHE CA C 378 56.697 56.136 0.561 1
1 275 . 12 1 1 A 24 24 PHE CB C 378 36.538 37.369 -0.831 1
1 278 . 12 1 1 A 24 24 PHE N N 378 124.732 128.026 -3.294 1
1 279 . 12 1 1 A 25 25 GLN H H 379 8.457 8.559 -0.102 1
1 280 . 12 1 1 A 25 25 GLN HA H 379 4.038 4.506 -0.468 1
1 287 . 12 1 1 A 25 25 GLN C C 379 172.431 174.740 -2.309 1
1 288 . 12 1 1 A 25 25 GLN CA C 379 54.078 55.150 -1.072 1
1 289 . 12 1 1 A 25 25 GLN CB C 379 26.414 30.287 -3.873 1
1 291 . 12 1 1 A 25 25 GLN N N 379 118.820 124.254 -5.434 1
1 293 . 12 1 1 A 26 26 LEU H H 380 6.985 7.157 -0.172 1
1 294 . 12 1 1 A 26 26 LEU HA H 380 4.229 4.969 -0.740 1
1 304 . 12 1 1 A 26 26 LEU C C 380 173.895 176.007 -2.112 1
1 305 . 12 1 1 A 26 26 LEU CA C 380 52.123 53.055 -0.932 1
1 306 . 12 1 1 A 26 26 LEU CB C 380 40.543 44.847 -4.304 1
1 310 . 12 1 1 A 26 26 LEU N N 380 119.079 120.830 -1.751 1
1 311 . 12 1 1 A 27 27 CYS H H 381 8.905 9.340 -0.435 1
1 312 . 12 1 1 A 27 27 CYS HA H 381 4.013 4.558 -0.545 1
1 315 . 12 1 1 A 27 27 CYS C C 381 174.439 175.682 -1.243 1
1 316 . 12 1 1 A 27 27 CYS CA C 381 57.847 59.208 -1.361 1
1 317 . 12 1 1 A 27 27 CYS CB C 381 28.648 28.405 0.243 1
1 318 . 12 1 1 A 27 27 CYS N N 381 125.151 123.384 1.767 1
1 319 . 12 1 1 A 28 28 LYS H H 382 9.351 8.815 0.536 1
1 320 . 12 1 1 A 28 28 LYS HA H 382 4.157 3.989 0.168 1
1 329 . 12 1 1 A 28 28 LYS C C 382 174.678 177.989 -3.311 1
1 330 . 12 1 1 A 28 28 LYS CA C 382 54.324 58.880 -4.556 1
1 331 . 12 1 1 A 28 28 LYS CB C 382 30.086 32.504 -2.418 1
1 335 . 12 1 1 A 28 28 LYS N N 382 128.840 128.363 0.477 1
1 336 . 12 1 1 A 29 29 ILE H H 383 9.040 7.876 1.164 1
1 337 . 12 1 1 A 29 29 ILE HA H 383 3.804 3.808 -0.004 1
1 347 . 12 1 1 A 29 29 ILE C C 383 174.239 177.416 -3.177 1
1 348 . 12 1 1 A 29 29 ILE CA C 383 62.114 64.259 -2.145 1
1 349 . 12 1 1 A 29 29 ILE CB C 383 33.870 38.062 -4.192 1
1 353 . 12 1 1 A 29 29 ILE N N 383 122.718 119.082 3.636 1
1 354 . 12 1 1 A 30 30 CYS H H 384 7.572 7.555 0.017 1
1 355 . 12 1 1 A 30 30 CYS HA H 384 4.548 4.439 0.109 1
1 358 . 12 1 1 A 30 30 CYS C C 384 172.978 174.901 -1.923 1
1 359 . 12 1 1 A 30 30 CYS CA C 384 54.957 59.418 -4.461 1
1 360 . 12 1 1 A 30 30 CYS CB C 384 29.778 29.626 0.152 1
1 361 . 12 1 1 A 30 30 CYS N N 384 116.356 116.353 0.003 1
1 362 . 12 1 1 A 31 31 ALA H H 385 8.205 8.726 -0.521 1
1 363 . 12 1 1 A 31 31 ALA HA H 385 4.107 4.062 0.045 1
1 367 . 12 1 1 A 31 31 ALA C C 385 173.139 176.858 -3.719 1
1 368 . 12 1 1 A 31 31 ALA CA C 385 50.802 53.169 -2.367 1
1 369 . 12 1 1 A 31 31 ALA CB C 385 14.634 17.601 -2.967 1
1 370 . 12 1 1 A 31 31 ALA N N 385 125.526 121.454 4.072 1
1 371 . 12 1 1 A 32 32 GLU H H 386 8.416 7.921 0.495 1
1 372 . 12 1 1 A 32 32 GLU HA H 386 4.467 4.660 -0.193 1
1 377 . 12 1 1 A 32 32 GLU C C 386 172.325 175.959 -3.634 1
1 378 . 12 1 1 A 32 32 GLU CA C 386 55.146 57.819 -2.673 1
1 379 . 12 1 1 A 32 32 GLU CB C 386 31.181 32.740 -1.559 1
1 381 . 12 1 1 A 32 32 GLU N N 386 117.579 115.939 1.640 1
1 382 . 12 1 1 A 33 33 ASN H H 387 7.872 7.969 -0.097 1
1 383 . 12 1 1 A 33 33 ASN HA H 387 4.900 4.829 0.071 1
1 388 . 12 1 1 A 33 33 ASN C C 387 171.355 174.677 -3.322 1
1 389 . 12 1 1 A 33 33 ASN CA C 387 49.320 53.148 -3.828 1
1 390 . 12 1 1 A 33 33 ASN CB C 387 38.457 39.572 -1.115 1
1 391 . 12 1 1 A 33 33 ASN N N 387 120.399 118.055 2.344 1
1 393 . 12 1 1 A 34 34 ASP H H 388 8.565 8.357 0.208 1
1 394 . 12 1 1 A 34 34 ASP HA H 388 4.679 5.369 -0.690 1
1 397 . 12 1 1 A 34 34 ASP C C 388 174.243 175.805 -1.562 1
1 398 . 12 1 1 A 34 34 ASP CA C 388 51.809 53.968 -2.159 1
1 399 . 12 1 1 A 34 34 ASP CB C 388 38.007 42.300 -4.293 1
1 400 . 12 1 1 A 34 34 ASP N N 388 120.661 121.973 -1.312 1
1 401 . 12 1 1 A 35 35 LYS H H 389 8.544 8.249 0.295 1
1 402 . 12 1 1 A 35 35 LYS HA H 389 3.411 4.218 -0.807 1
1 409 . 12 1 1 A 35 35 LYS C C 389 172.938 176.561 -3.623 1
1 410 . 12 1 1 A 35 35 LYS CA C 389 54.973 56.370 -1.397 1
1 411 . 12 1 1 A 35 35 LYS CB C 389 30.617 31.858 -1.241 1
1 415 . 12 1 1 A 35 35 LYS N N 389 119.199 122.132 -2.933 1
1 416 . 12 1 1 A 36 36 ASP H H 390 8.327 8.615 -0.288 1
1 417 . 12 1 1 A 36 36 ASP HA H 390 4.724 4.868 -0.144 1
1 420 . 12 1 1 A 36 36 ASP C C 390 172.860 175.403 -2.543 1
1 421 . 12 1 1 A 36 36 ASP CA C 390 51.609 53.717 -2.108 1
1 422 . 12 1 1 A 36 36 ASP CB C 390 39.018 41.508 -2.490 1
1 423 . 12 1 1 A 36 36 ASP N N 390 119.134 120.441 -1.307 1
1 424 . 12 1 1 A 37 37 VAL H H 391 8.544 7.693 0.851 1
1 425 . 12 1 1 A 37 37 VAL HA H 391 4.877 4.726 0.151 1
1 433 . 12 1 1 A 37 37 VAL C C 391 167.519 173.259 -5.740 1
1 434 . 12 1 1 A 37 37 VAL CA C 391 58.259 60.064 -1.805 1
1 435 . 12 1 1 A 37 37 VAL CB C 391 32.277 35.457 -3.180 1
1 438 . 12 1 1 A 37 37 VAL N N 391 121.970 119.099 2.871 1
1 439 . 12 1 1 A 38 38 LYS H H 392 8.621 9.471 -0.850 1
1 440 . 12 1 1 A 38 38 LYS HA H 392 4.991 5.113 -0.122 1
1 449 . 12 1 1 A 38 38 LYS C C 392 172.681 175.286 -2.605 1
1 450 . 12 1 1 A 38 38 LYS CA C 392 51.123 54.718 -3.595 1
1 451 . 12 1 1 A 38 38 LYS CB C 392 33.697 34.623 -0.926 1
1 455 . 12 1 1 A 38 38 LYS N N 392 126.381 128.992 -2.611 1
1 456 . 12 1 1 A 39 39 ILE H H 393 8.723 8.831 -0.108 1
1 457 . 12 1 1 A 39 39 ILE HA H 393 4.239 4.380 -0.141 1
1 467 . 12 1 1 A 39 39 ILE C C 393 172.642 175.774 -3.132 1
1 468 . 12 1 1 A 39 39 ILE CA C 393 57.768 61.005 -3.237 1
1 469 . 12 1 1 A 39 39 ILE CB C 393 35.691 37.484 -1.793 1
1 473 . 12 1 1 A 39 39 ILE N N 393 126.398 127.600 -1.202 1
1 474 . 12 1 1 A 40 40 GLU H H 394 8.506 8.774 -0.268 1
1 475 . 12 1 1 A 40 40 GLU HA H 394 4.753 4.855 -0.102 1
1 480 . 12 1 1 A 40 40 GLU C C 394 173.596 176.380 -2.784 1
1 481 . 12 1 1 A 40 40 GLU CA C 394 49.793 53.845 -4.052 1
1 482 . 12 1 1 A 40 40 GLU CB C 394 28.210 31.173 -2.963 1
1 484 . 12 1 1 A 40 40 GLU N N 394 124.864 127.941 -3.077 1
1 485 . 12 1 1 A 41 41 PRO HA H 395 4.864 4.500 0.364 1
1 492 . 12 1 1 A 41 41 PRO C C 395 175.073 177.249 -2.176 1
1 493 . 12 1 1 A 41 41 PRO CA C 395 61.111 63.909 -2.798 1
1 494 . 12 1 1 A 41 41 PRO CB C 395 32.275 32.941 -0.666 1
1 497 . 12 1 1 A 42 42 CYS H H 396 7.828 7.842 -0.014 1
1 498 . 12 1 1 A 42 42 CYS HA H 396 4.208 4.045 0.163 1
1 501 . 12 1 1 A 42 42 CYS C C 396 173.877 175.037 -1.160 1
1 502 . 12 1 1 A 42 42 CYS CA C 396 58.021 61.443 -3.422 1
1 503 . 12 1 1 A 42 42 CYS CB C 396 28.242 27.383 0.859 1
1 504 . 12 1 1 A 42 42 CYS N N 396 122.434 117.963 4.471 1
1 505 . 12 1 1 A 43 43 GLY H H 397 8.679 8.704 -0.025 1
1 506 . 12 1 1 A 43 43 GLY HA2 H 397 3.507 3.948 -0.441 1
1 507 . 12 1 1 A 43 43 GLY HA3 H 397 3.914 3.960 -0.046 1
1 508 . 12 1 1 A 43 43 GLY C C 397 171.981 174.537 -2.556 1
1 509 . 12 1 1 A 43 43 GLY CA C 397 43.347 45.743 -2.396 1
1 510 . 12 1 1 A 43 43 GLY N N 397 112.123 108.313 3.810 1
1 511 . 12 1 1 A 44 44 HIS H H 398 8.329 7.702 0.627 1
1 512 . 12 1 1 A 44 44 HIS HA H 398 4.339 4.629 -0.290 1
1 517 . 12 1 1 A 44 44 HIS C C 398 170.742 174.684 -3.942 1
1 518 . 12 1 1 A 44 44 HIS CA C 398 58.368 56.121 2.247 1
1 519 . 12 1 1 A 44 44 HIS CB C 398 28.434 31.363 -2.929 1
1 522 . 12 1 1 A 44 44 HIS N N 398 121.393 117.604 3.789 1
1 523 . 12 1 1 A 45 45 LEU H H 399 8.241 8.979 -0.738 1
1 524 . 12 1 1 A 45 45 LEU HA H 399 5.570 5.272 0.298 1
1 534 . 12 1 1 A 45 45 LEU C C 399 174.464 175.484 -1.020 1
1 535 . 12 1 1 A 45 45 LEU CA C 399 50.729 53.693 -2.964 1
1 536 . 12 1 1 A 45 45 LEU CB C 399 43.574 43.854 -0.280 1
1 540 . 12 1 1 A 45 45 LEU N N 399 118.469 123.217 -4.748 1
1 541 . 12 1 1 A 46 46 MET H H 400 8.707 8.821 -0.114 1
1 542 . 12 1 1 A 46 46 MET HA H 400 4.842 5.003 -0.161 1
1 550 . 12 1 1 A 46 46 MET C C 400 170.736 174.197 -3.461 1
1 551 . 12 1 1 A 46 46 MET CA C 400 52.804 54.090 -1.286 1
1 552 . 12 1 1 A 46 46 MET CB C 400 31.945 35.434 -3.489 1
1 555 . 12 1 1 A 46 46 MET N N 400 114.897 120.501 -5.604 1
1 556 . 12 1 1 A 47 47 CYS H H 401 9.436 8.388 1.048 1
1 557 . 12 1 1 A 47 47 CYS HA H 401 5.629 5.369 0.260 1
1 560 . 12 1 1 A 47 47 CYS C C 401 173.909 176.107 -2.198 1
1 561 . 12 1 1 A 47 47 CYS CA C 401 54.325 56.800 -2.475 1
1 562 . 12 1 1 A 47 47 CYS CB C 401 30.725 29.818 0.907 1
1 563 . 12 1 1 A 47 47 CYS N N 401 119.575 119.012 0.563 1
1 564 . 12 1 1 A 48 48 THR H H 402 9.842 9.387 0.455 1
1 565 . 12 1 1 A 48 48 THR HA H 402 3.768 4.001 -0.233 1
1 570 . 12 1 1 A 48 48 THR C C 402 174.333 176.220 -1.887 1
1 571 . 12 1 1 A 48 48 THR CA C 402 64.516 65.951 -1.435 1
1 572 . 12 1 1 A 48 48 THR CB C 402 66.288 68.680 -2.392 1
1 574 . 12 1 1 A 48 48 THR N N 402 119.945 119.239 0.706 1
1 575 . 12 1 1 A 49 49 SER H H 403 8.355 8.223 0.132 1
1 576 . 12 1 1 A 49 49 SER HA H 403 4.222 4.025 0.197 1
1 579 . 12 1 1 A 49 49 SER C C 403 175.059 177.136 -2.077 1
1 580 . 12 1 1 A 49 49 SER CA C 403 59.828 61.699 -1.871 1
1 581 . 12 1 1 A 49 49 SER CB C 403 59.717 63.003 -3.286 1
1 582 . 12 1 1 A 49 49 SER N N 403 120.468 115.652 4.816 1
1 583 . 12 1 1 A 50 50 CYS H H 404 9.464 8.272 1.192 1
1 584 . 12 1 1 A 50 50 CYS HA H 404 3.922 4.110 -0.188 1
1 587 . 12 1 1 A 50 50 CYS C C 404 176.081 177.048 -0.967 1
1 588 . 12 1 1 A 50 50 CYS CA C 404 63.076 64.272 -1.196 1
1 589 . 12 1 1 A 50 50 CYS CB C 404 26.078 27.246 -1.168 1
1 590 . 12 1 1 A 50 50 CYS N N 404 126.744 119.264 7.480 1
1 591 . 12 1 1 A 51 51 LEU H H 405 7.948 8.042 -0.094 1
1 592 . 12 1 1 A 51 51 LEU HA H 405 4.064 4.162 -0.098 1
1 602 . 12 1 1 A 51 51 LEU C C 405 175.495 178.859 -3.364 1
1 603 . 12 1 1 A 51 51 LEU CA C 405 55.914 57.851 -1.937 1
1 604 . 12 1 1 A 51 51 LEU CB C 405 38.662 41.852 -3.190 1
1 607 . 12 1 1 A 51 51 LEU N N 405 121.951 122.812 -0.861 1
1 608 . 12 1 1 A 52 52 THR H H 406 8.786 8.441 0.345 1
1 609 . 12 1 1 A 52 52 THR HA H 406 4.024 3.845 0.179 1
1 614 . 12 1 1 A 52 52 THR C C 406 174.139 176.261 -2.122 1
1 615 . 12 1 1 A 52 52 THR CA C 406 64.017 66.299 -2.282 1
1 616 . 12 1 1 A 52 52 THR CB C 406 66.115 68.618 -2.503 1
1 618 . 12 1 1 A 52 52 THR N N 406 115.258 115.836 -0.578 1
1 619 . 12 1 1 A 53 53 SER H H 407 8.115 7.904 0.211 1
1 620 . 12 1 1 A 53 53 SER HA H 407 4.204 4.109 0.095 1
1 623 . 12 1 1 A 53 53 SER C C 407 174.456 176.300 -1.844 1
1 624 . 12 1 1 A 53 53 SER CA C 407 59.090 62.732 -3.642 1
1 625 . 12 1 1 A 53 53 SER CB C 407 60.146 63.276 -3.130 1
1 626 . 12 1 1 A 53 53 SER N N 407 116.852 116.694 0.158 1
1 627 . 12 1 1 A 54 54 TRP H H 408 8.123 7.962 0.161 1
1 628 . 12 1 1 A 54 54 TRP HA H 408 4.371 4.290 0.081 1
1 637 . 12 1 1 A 54 54 TRP C C 408 175.981 178.579 -2.598 1
1 638 . 12 1 1 A 54 54 TRP CA C 408 57.323 60.971 -3.648 1
1 639 . 12 1 1 A 54 54 TRP CB C 408 26.812 29.510 -2.698 1
1 645 . 12 1 1 A 54 54 TRP N N 408 123.556 123.728 -0.172 1
1 647 . 12 1 1 A 55 55 GLN H H 409 8.502 8.223 0.279 1
1 648 . 12 1 1 A 55 55 GLN HA H 409 3.999 3.644 0.355 1
1 655 . 12 1 1 A 55 55 GLN C C 409 177.300 178.952 -1.652 1
1 656 . 12 1 1 A 55 55 GLN CA C 409 56.484 59.206 -2.722 1
1 657 . 12 1 1 A 55 55 GLN CB C 409 26.190 28.336 -2.146 1
1 659 . 12 1 1 A 55 55 GLN N N 409 118.044 118.271 -0.227 1
1 661 . 12 1 1 A 56 56 GLU H H 410 8.467 8.493 -0.026 1
1 662 . 12 1 1 A 56 56 GLU HA H 410 4.057 4.067 -0.010 1
1 667 . 12 1 1 A 56 56 GLU C C 410 174.787 177.252 -2.465 1
1 668 . 12 1 1 A 56 56 GLU CA C 410 55.909 58.586 -2.677 1
1 669 . 12 1 1 A 56 56 GLU CB C 410 26.895 29.196 -2.301 1
1 671 . 12 1 1 A 56 56 GLU N N 410 119.448 120.441 -0.993 1
1 672 . 12 1 1 A 57 57 SER H H 411 7.438 8.000 -0.562 1
1 673 . 12 1 1 A 57 57 SER HA H 411 4.607 4.484 0.123 1
1 676 . 12 1 1 A 57 57 SER C C 411 170.849 173.893 -3.044 1
1 677 . 12 1 1 A 57 57 SER CA C 411 55.540 58.740 -3.200 1
1 678 . 12 1 1 A 57 57 SER CB C 411 60.928 64.651 -3.723 1
1 679 . 12 1 1 A 57 57 SER N N 411 113.752 114.057 -0.305 1
1 680 . 12 1 1 A 58 58 GLU H H 412 7.855 7.468 0.387 1
1 681 . 12 1 1 A 58 58 GLU HA H 412 3.772 4.273 -0.501 1
1 686 . 12 1 1 A 58 58 GLU C C 412 173.743 176.517 -2.774 1
1 687 . 12 1 1 A 58 58 GLU CA C 412 54.442 57.418 -2.976 1
1 688 . 12 1 1 A 58 58 GLU CB C 412 24.603 30.637 -6.034 1
1 690 . 12 1 1 A 58 58 GLU N N 412 115.908 118.568 -2.660 1
1 691 . 12 1 1 A 59 59 GLY H H 413 7.588 6.836 0.752 1
1 692 . 12 1 1 A 59 59 GLY HA2 H 413 1.643 3.296 -1.653 1
1 693 . 12 1 1 A 59 59 GLY HA3 H 413 2.949 3.655 -0.706 1
1 694 . 12 1 1 A 59 59 GLY C C 413 170.850 174.432 -3.582 1
1 695 . 12 1 1 A 59 59 GLY CA C 413 41.724 45.786 -4.062 1
1 696 . 12 1 1 A 59 59 GLY N N 413 108.032 107.219 0.813 1
1 697 . 12 1 1 A 60 60 GLN H H 414 7.973 7.482 0.491 1
1 698 . 12 1 1 A 60 60 GLN HA H 414 4.366 4.529 -0.163 1
1 705 . 12 1 1 A 60 60 GLN C C 414 173.108 175.656 -2.548 1
1 706 . 12 1 1 A 60 60 GLN CA C 414 52.422 54.749 -2.327 1
1 707 . 12 1 1 A 60 60 GLN CB C 414 27.049 28.677 -1.628 1
1 709 . 12 1 1 A 60 60 GLN N N 414 122.690 120.723 1.967 1
1 711 . 12 1 1 A 61 61 GLY H H 415 8.301 8.016 0.285 1
1 712 . 12 1 1 A 61 61 GLY HA2 H 415 3.700 4.261 -0.561 1
1 713 . 12 1 1 A 61 61 GLY HA3 H 415 3.920 4.301 -0.381 1
1 714 . 12 1 1 A 61 61 GLY C C 415 170.249 174.162 -3.913 1
1 715 . 12 1 1 A 61 61 GLY CA C 415 42.210 44.395 -2.185 1
1 716 . 12 1 1 A 61 61 GLY N N 415 110.794 113.383 -2.589 1
1 717 . 12 1 1 A 62 62 CYS H H 416 8.549 8.414 0.135 1
1 718 . 12 1 1 A 62 62 CYS HA H 416 4.227 4.715 -0.488 1
1 721 . 12 1 1 A 62 62 CYS C C 416 172.914 175.359 -2.445 1
1 722 . 12 1 1 A 62 62 CYS CA C 416 54.008 58.760 -4.752 1
1 723 . 12 1 1 A 62 62 CYS CB C 416 29.716 27.403 2.313 1
1 724 . 12 1 1 A 62 62 CYS N N 416 123.683 121.040 2.643 1
1 725 . 12 1 1 A 63 63 PRO HA H 417 2.611 2.814 -0.203 1
1 732 . 12 1 1 A 63 63 PRO C C 417 174.143 178.114 -3.971 1
1 733 . 12 1 1 A 63 63 PRO CA C 417 61.689 64.237 -2.548 1
1 734 . 12 1 1 A 63 63 PRO CB C 417 28.534 31.333 -2.799 1
1 737 . 12 1 1 A 64 64 PHE H H 418 8.968 7.740 1.228 1
1 738 . 12 1 1 A 64 64 PHE HA H 418 4.250 4.104 0.146 1
1 746 . 12 1 1 A 64 64 PHE C C 418 174.243 178.180 -3.937 1
1 747 . 12 1 1 A 64 64 PHE CA C 418 56.720 60.518 -3.798 1
1 748 . 12 1 1 A 64 64 PHE CB C 418 36.458 39.222 -2.764 1
1 752 . 12 1 1 A 64 64 PHE N N 418 117.008 115.980 1.028 1
1 753 . 12 1 1 A 65 65 CYS H H 419 7.968 7.963 0.005 1
1 754 . 12 1 1 A 65 65 CYS HA H 419 4.906 4.497 0.409 1
1 757 . 12 1 1 A 65 65 CYS C C 419 173.198 174.907 -1.709 1
1 758 . 12 1 1 A 65 65 CYS CA C 419 55.870 59.593 -3.723 1
1 759 . 12 1 1 A 65 65 CYS CB C 419 30.559 28.999 1.560 1
1 760 . 12 1 1 A 65 65 CYS N N 419 117.505 117.590 -0.085 1
1 761 . 12 1 1 A 66 66 ARG H H 420 8.761 7.967 0.794 1
1 762 . 12 1 1 A 66 66 ARG HA H 420 4.365 4.358 0.007 1
1 769 . 12 1 1 A 66 66 ARG C C 420 172.921 174.766 -1.845 1
1 770 . 12 1 1 A 66 66 ARG CA C 420 54.763 57.234 -2.471 1
1 771 . 12 1 1 A 66 66 ARG CB C 420 24.286 26.939 -2.653 1
1 774 . 12 1 1 A 66 66 ARG N N 420 118.763 116.070 2.693 1
1 775 . 12 1 1 A 67 67 CYS H H 421 8.223 7.903 0.320 1
1 776 . 12 1 1 A 67 67 CYS HA H 421 4.419 4.580 -0.161 1
1 779 . 12 1 1 A 67 67 CYS C C 421 171.160 174.767 -3.607 1
1 780 . 12 1 1 A 67 67 CYS CA C 421 57.119 58.093 -0.974 1
1 781 . 12 1 1 A 67 67 CYS CB C 421 25.911 29.712 -3.801 1
1 782 . 12 1 1 A 67 67 CYS N N 421 120.627 117.004 3.623 1
1 783 . 12 1 1 A 68 68 GLU H H 422 8.416 8.516 -0.100 1
1 784 . 12 1 1 A 68 68 GLU HA H 422 4.025 4.147 -0.122 1
1 789 . 12 1 1 A 68 68 GLU C C 422 173.764 176.420 -2.656 1
1 790 . 12 1 1 A 68 68 GLU CA C 422 54.752 57.605 -2.853 1
1 791 . 12 1 1 A 68 68 GLU CB C 422 27.302 29.783 -2.481 1
1 793 . 12 1 1 A 68 68 GLU N N 422 122.370 120.372 1.998 1
1 794 . 12 1 1 A 69 69 ILE H H 423 8.648 8.894 -0.246 1
1 795 . 12 1 1 A 69 69 ILE HA H 423 4.012 4.462 -0.450 1
1 805 . 12 1 1 A 69 69 ILE C C 423 174.257 175.426 -1.169 1
1 806 . 12 1 1 A 69 69 ILE CA C 423 59.740 60.715 -0.975 1
1 807 . 12 1 1 A 69 69 ILE CB C 423 35.846 38.520 -2.674 1
1 811 . 12 1 1 A 69 69 ILE N N 423 125.988 125.739 0.249 1
1 812 . 12 1 1 A 70 70 LYS H H 424 9.185 9.481 -0.296 1
1 813 . 12 1 1 A 70 70 LYS HA H 424 4.434 4.458 -0.024 1
1 822 . 12 1 1 A 70 70 LYS C C 424 173.880 176.348 -2.468 1
1 823 . 12 1 1 A 70 70 LYS CA C 424 53.378 57.148 -3.770 1
1 824 . 12 1 1 A 70 70 LYS CB C 424 30.397 34.910 -4.513 1
1 828 . 12 1 1 A 70 70 LYS N N 424 128.977 129.412 -0.435 1
1 829 . 12 1 1 A 71 71 GLY H H 425 7.810 7.495 0.315 1
1 830 . 12 1 1 A 71 71 GLY HA2 H 425 4.094 4.050 0.044 1
1 831 . 12 1 1 A 71 71 GLY HA3 H 425 4.159 4.053 0.106 1
1 832 . 12 1 1 A 71 71 GLY C C 425 168.179 172.036 -3.857 1
1 833 . 12 1 1 A 71 71 GLY CA C 425 42.326 45.429 -3.103 1
1 834 . 12 1 1 A 71 71 GLY N N 425 107.696 106.241 1.455 1
1 835 . 12 1 1 A 72 72 THR H H 426 8.048 8.561 -0.513 1
1 836 . 12 1 1 A 72 72 THR HA H 426 5.258 5.682 -0.424 1
1 841 . 12 1 1 A 72 72 THR C C 426 170.979 173.026 -2.047 1
1 842 . 12 1 1 A 72 72 THR CA C 426 56.755 60.162 -3.407 1
1 843 . 12 1 1 A 72 72 THR CB C 426 69.226 71.956 -2.730 1
1 845 . 12 1 1 A 72 72 THR N N 426 109.122 112.557 -3.435 1
1 846 . 12 1 1 A 73 73 GLU H H 427 8.912 9.486 -0.574 1
1 847 . 12 1 1 A 73 73 GLU HA H 427 4.954 4.809 0.145 1
1 852 . 12 1 1 A 73 73 GLU C C 427 170.353 174.086 -3.733 1
1 853 . 12 1 1 A 73 73 GLU CA C 427 50.182 52.805 -2.623 1
1 854 . 12 1 1 A 73 73 GLU CB C 427 30.559 31.412 -0.853 1
1 856 . 12 1 1 A 73 73 GLU N N 427 121.703 123.233 -1.530 1
1 1 . 12 1 1 A 74 74 PRO HA H 428 4.372 4.671 -0.299 1
1 2 . 12 1 1 A 74 74 PRO C C 428 173.839 175.838 -1.999 1
1 3 . 12 1 1 A 74 74 PRO CA C 428 60.241 62.671 -2.430 1
1 4 . 12 1 1 A 74 74 PRO CB C 428 29.299 32.340 -3.041 1
1 857 . 12 1 1 A 74 74 PRO HA H 428 4.782 4.671 0.111 1
1 864 . 12 1 1 A 74 74 PRO C C 428 174.027 175.838 -1.811 1
1 865 . 12 1 1 A 74 74 PRO CA C 428 59.771 62.671 -2.900 1
1 866 . 12 1 1 A 74 74 PRO CB C 428 29.633 32.340 -2.707 1
1 7 . 12 1 1 A 75 75 ILE H H 429 8.144 8.079 0.065 1
1 8 . 12 1 1 A 75 75 ILE HA H 429 4.086 4.784 -0.698 1
1 15 . 12 1 1 A 75 75 ILE C C 429 173.426 175.651 -2.225 1
1 16 . 12 1 1 A 75 75 ILE CA C 429 58.339 60.658 -2.319 1
1 17 . 12 1 1 A 75 75 ILE CB C 429 35.988 39.520 -3.532 1
1 21 . 12 1 1 A 75 75 ILE N N 429 121.551 121.892 -0.341 1
1 869 . 12 1 1 A 75 75 ILE H H 429 7.682 8.079 -0.397 1
1 870 . 12 1 1 A 75 75 ILE HA H 429 4.282 4.784 -0.502 1
1 880 . 12 1 1 A 75 75 ILE C C 429 172.510 175.651 -3.141 1
1 881 . 12 1 1 A 75 75 ILE CA C 429 57.456 60.658 -3.202 1
1 882 . 12 1 1 A 75 75 ILE CB C 429 37.903 39.520 -1.617 1
1 886 . 12 1 1 A 75 75 ILE N N 429 119.651 121.892 -2.241 1
1 1 . 12 1 1 A 76 76 VAL HA H 430 4.086 4.959 -0.873 1
1 2 . 12 1 1 A 76 76 VAL CA C 430 59.372 59.853 -0.481 1
1 22 . 12 1 1 A 76 76 VAL H H 430 8.221 9.078 -0.857 1
1 23 . 12 1 1 A 76 76 VAL HA H 430 4.083 4.959 -0.876 1
1 24 . 12 1 1 A 76 76 VAL C C 430 173.067 174.645 -1.578 1
1 25 . 12 1 1 A 76 76 VAL CA C 430 59.445 59.853 -0.408 1
1 26 . 12 1 1 A 76 76 VAL CB C 430 30.407 35.208 -4.801 1
1 27 . 12 1 1 A 76 76 VAL N N 430 125.930 121.423 4.507 1
1 887 . 12 1 1 A 76 76 VAL H H 430 8.122 9.078 -0.956 1
1 888 . 12 1 1 A 76 76 VAL HA H 430 4.197 4.959 -0.762 1
1 890 . 12 1 1 A 76 76 VAL C C 430 172.971 174.645 -1.674 1
1 891 . 12 1 1 A 76 76 VAL CA C 430 58.821 59.853 -1.032 1
1 892 . 12 1 1 A 76 76 VAL CB C 430 30.807 35.208 -4.401 1
1 895 . 12 1 1 A 76 76 VAL N N 430 124.178 121.423 2.755 1
1 4 . 12 1 1 A 77 77 VAL H H 431 8.204 8.848 -0.644 1
1 5 . 12 1 1 A 77 77 VAL HA H 431 4.049 4.942 -0.893 1
1 6 . 12 1 1 A 77 77 VAL C C 431 172.636 174.525 -1.889 1
1 7 . 12 1 1 A 77 77 VAL CA C 431 59.315 59.016 0.299 1
1 8 . 12 1 1 A 77 77 VAL CB C 431 30.219 36.326 -6.107 1
1 9 . 12 1 1 A 77 77 VAL N N 431 125.320 121.858 3.462 1
1 28 . 12 1 1 A 77 77 VAL H H 431 8.412 8.848 -0.436 1
1 29 . 12 1 1 A 77 77 VAL HA H 431 4.038 4.942 -0.904 1
1 37 . 12 1 1 A 77 77 VAL C C 431 172.617 174.525 -1.908 1
1 38 . 12 1 1 A 77 77 VAL CA C 431 59.137 59.016 0.121 1
1 39 . 12 1 1 A 77 77 VAL CB C 431 30.292 36.326 -6.034 1
1 42 . 12 1 1 A 77 77 VAL N N 431 125.655 121.858 3.797 1
1 896 . 12 1 1 A 77 77 VAL H H 431 8.448 8.848 -0.400 1
1 897 . 12 1 1 A 77 77 VAL HA H 431 4.087 4.942 -0.855 1
1 905 . 12 1 1 A 77 77 VAL C C 431 172.493 174.525 -2.032 1
1 906 . 12 1 1 A 77 77 VAL CA C 431 59.185 59.016 0.169 1
1 907 . 12 1 1 A 77 77 VAL CB C 431 30.084 36.326 -6.242 1
1 910 . 12 1 1 A 77 77 VAL N N 431 125.770 121.858 3.912 1
1 43 . 12 1 1 A 78 78 ASP H H 432 8.419 8.809 -0.390 1
1 44 . 12 1 1 A 78 78 ASP HA H 432 4.829 4.728 0.101 1
1 45 . 12 1 1 A 78 78 ASP C C 432 172.252 174.966 -2.714 1
1 46 . 12 1 1 A 78 78 ASP CA C 432 49.320 52.441 -3.121 1
1 47 . 12 1 1 A 78 78 ASP CB C 432 39.066 41.053 -1.987 1
1 48 . 12 1 1 A 78 78 ASP N N 432 126.226 122.093 4.133 1
1 911 . 12 1 1 A 78 78 ASP H H 432 8.493 8.809 -0.316 1
1 912 . 12 1 1 A 78 78 ASP HA H 432 4.852 4.728 0.124 1
1 915 . 12 1 1 A 78 78 ASP C C 432 172.048 174.966 -2.918 1
1 916 . 12 1 1 A 78 78 ASP CA C 432 49.233 52.441 -3.208 1
1 917 . 12 1 1 A 78 78 ASP CB C 432 38.858 41.053 -2.195 1
1 918 . 12 1 1 A 78 78 ASP N N 432 126.705 122.093 4.612 1
1 10 . 12 1 1 A 79 79 PRO CA C 433 63.865 62.472 1.393 1
1 49 . 12 1 1 A 79 79 PRO C C 433 173.867 177.360 -3.493 1
1 919 . 12 1 1 A 79 79 PRO HA H 433 4.237 4.839 -0.602 1
1 926 . 12 1 1 A 79 79 PRO C C 433 173.812 177.360 -3.548 1
1 927 . 12 1 1 A 79 79 PRO CA C 433 60.627 62.472 -1.845 1
1 928 . 12 1 1 A 79 79 PRO CB C 433 29.329 31.611 -2.282 1
1 11 . 12 1 1 A 80 80 PHE H H 434 8.182 8.881 -0.699 1
1 12 . 12 1 1 A 80 80 PHE HA H 434 4.499 4.360 0.139 1
1 13 . 12 1 1 A 80 80 PHE C C 434 171.680 175.023 -3.343 1
1 14 . 12 1 1 A 80 80 PHE CA C 434 54.657 61.233 -6.576 1
1 15 . 12 1 1 A 80 80 PHE CB C 434 36.272 40.294 -4.022 1
1 16 . 12 1 1 A 80 80 PHE N N 434 118.611 124.849 -6.238 1
1 50 . 12 1 1 A 80 80 PHE H H 434 8.191 8.881 -0.690 1
1 51 . 12 1 1 A 80 80 PHE HA H 434 4.528 4.360 0.168 1
1 54 . 12 1 1 A 80 80 PHE C C 434 172.457 175.023 -2.566 1
1 55 . 12 1 1 A 80 80 PHE CA C 434 54.828 61.233 -6.405 1
1 56 . 12 1 1 A 80 80 PHE CB C 434 36.457 40.294 -3.837 1
1 57 . 12 1 1 A 80 80 PHE N N 434 118.871 124.849 -5.978 1
1 931 . 12 1 1 A 80 80 PHE H H 434 8.191 8.881 -0.690 1
1 932 . 12 1 1 A 80 80 PHE HA H 434 4.463 4.360 0.103 1
1 939 . 12 1 1 A 80 80 PHE C C 434 172.283 175.023 -2.740 1
1 940 . 12 1 1 A 80 80 PHE CA C 434 54.971 61.233 -6.262 1
1 941 . 12 1 1 A 80 80 PHE CB C 434 36.490 40.294 -3.804 1
1 944 . 12 1 1 A 80 80 PHE N N 434 119.263 124.849 -5.586 1
1 17 . 12 1 1 A 81 81 ASP H H 435 7.490 8.200 -0.710 1
1 18 . 12 1 1 A 81 81 ASP HA H 435 4.698 4.921 -0.223 1
1 19 . 12 1 1 A 81 81 ASP C C 435 171.662 175.074 -3.412 1
1 20 . 12 1 1 A 81 81 ASP CA C 435 49.570 51.726 -2.156 1
1 21 . 12 1 1 A 81 81 ASP CB C 435 40.104 40.962 -0.858 1
1 22 . 12 1 1 A 81 81 ASP N N 435 120.304 115.184 5.120 1
1 58 . 12 1 1 A 81 81 ASP H H 435 7.881 8.200 -0.319 1
1 59 . 12 1 1 A 81 81 ASP HA H 435 4.801 4.921 -0.120 1
1 60 . 12 1 1 A 81 81 ASP C C 435 171.144 175.074 -3.930 1
1 61 . 12 1 1 A 81 81 ASP CA C 435 49.406 51.726 -2.320 1
1 62 . 12 1 1 A 81 81 ASP CB C 435 38.618 40.962 -2.344 1
1 63 . 12 1 1 A 81 81 ASP N N 435 123.108 115.184 7.924 1
1 945 . 12 1 1 A 81 81 ASP H H 435 7.823 8.200 -0.377 1
1 946 . 12 1 1 A 81 81 ASP HA H 435 4.759 4.921 -0.162 1
1 949 . 12 1 1 A 81 81 ASP C C 435 171.057 175.074 -4.017 1
1 950 . 12 1 1 A 81 81 ASP CA C 435 49.174 51.726 -2.552 1
1 951 . 12 1 1 A 81 81 ASP CB C 435 38.725 40.962 -2.237 1
1 952 . 12 1 1 A 81 81 ASP N N 435 123.530 115.184 8.346 1
1 23 . 12 1 1 A 82 82 PRO HA H 436 4.758 4.632 0.126 1
1 24 . 12 1 1 A 82 82 PRO C C 436 172.944 175.852 -2.908 1
1 25 . 12 1 1 A 82 82 PRO CA C 436 60.134 63.953 -3.819 1
1 26 . 12 1 1 A 82 82 PRO CB C 436 31.425 33.018 -1.593 1
1 64 . 12 1 1 A 82 82 PRO HA H 436 4.364 4.632 -0.268 1
1 67 . 12 1 1 A 82 82 PRO C C 436 173.563 175.852 -2.289 1
1 68 . 12 1 1 A 82 82 PRO CA C 436 60.729 63.953 -3.224 1
1 69 . 12 1 1 A 82 82 PRO CB C 436 29.160 33.018 -3.858 1
1 953 . 12 1 1 A 82 82 PRO HA H 436 4.296 4.632 -0.336 1
1 960 . 12 1 1 A 82 82 PRO C C 436 173.494 175.852 -2.358 1
1 961 . 12 1 1 A 82 82 PRO CA C 436 60.625 63.953 -3.328 1
1 962 . 12 1 1 A 82 82 PRO CB C 436 29.237 33.018 -3.781 1
1 1 . 13 1 1 A 3 3 LEU HA H 357 4.257 4.208 0.049 1
1 11 . 13 1 1 A 3 3 LEU C C 357 174.994 176.720 -1.726 1
1 12 . 13 1 1 A 3 3 LEU CA C 357 53.329 56.828 -3.499 1
1 13 . 13 1 1 A 3 3 LEU CB C 357 39.382 43.002 -3.620 1
1 17 . 13 1 1 A 4 4 GLN H H 358 8.234 8.015 0.219 1
1 18 . 13 1 1 A 4 4 GLN HA H 358 4.211 4.099 0.112 1
1 25 . 13 1 1 A 4 4 GLN C C 358 173.357 174.738 -1.381 1
1 26 . 13 1 1 A 4 4 GLN CA C 358 53.791 57.605 -3.814 1
1 27 . 13 1 1 A 4 4 GLN CB C 358 26.456 28.803 -2.347 1
1 29 . 13 1 1 A 4 4 GLN N N 358 119.506 118.894 0.612 1
1 31 . 13 1 1 A 5 5 ASP H H 359 8.090 8.410 -0.320 1
1 32 . 13 1 1 A 5 5 ASP HA H 359 4.458 4.532 -0.074 1
1 35 . 13 1 1 A 5 5 ASP C C 359 173.492 175.296 -1.804 1
1 36 . 13 1 1 A 5 5 ASP CA C 359 52.309 56.520 -4.211 1
1 37 . 13 1 1 A 5 5 ASP CB C 359 38.312 40.474 -2.162 1
1 38 . 13 1 1 A 5 5 ASP N N 359 120.683 120.167 0.516 1
1 39 . 13 1 1 A 6 6 HIS H H 360 8.103 8.350 -0.247 1
1 40 . 13 1 1 A 6 6 HIS HA H 360 4.540 4.617 -0.077 1
1 45 . 13 1 1 A 6 6 HIS C C 360 172.801 174.577 -1.776 1
1 46 . 13 1 1 A 6 6 HIS CA C 360 53.874 54.967 -1.093 1
1 47 . 13 1 1 A 6 6 HIS CB C 360 27.878 29.021 -1.143 1
1 50 . 13 1 1 A 6 6 HIS N N 360 118.844 114.617 4.227 1
1 51 . 13 1 1 A 7 7 ILE H H 361 7.862 7.957 -0.095 1
1 52 . 13 1 1 A 7 7 ILE HA H 361 4.010 4.021 -0.011 1
1 62 . 13 1 1 A 7 7 ILE C C 361 173.268 175.694 -2.426 1
1 63 . 13 1 1 A 7 7 ILE CA C 361 58.740 61.200 -2.460 1
1 64 . 13 1 1 A 7 7 ILE CB C 361 35.788 38.609 -2.821 1
1 68 . 13 1 1 A 7 7 ILE N N 361 121.598 121.207 0.391 1
1 69 . 13 1 1 A 8 8 LYS H H 362 8.231 8.510 -0.279 1
1 70 . 13 1 1 A 8 8 LYS HA H 362 4.313 4.537 -0.224 1
1 79 . 13 1 1 A 8 8 LYS C C 362 173.899 175.812 -1.913 1
1 80 . 13 1 1 A 8 8 LYS CA C 362 53.677 56.526 -2.849 1
1 81 . 13 1 1 A 8 8 LYS CB C 362 30.355 32.902 -2.547 1
1 85 . 13 1 1 A 8 8 LYS N N 362 124.980 125.840 -0.860 1
1 86 . 13 1 1 A 9 9 VAL H H 363 8.044 8.629 -0.585 1
1 87 . 13 1 1 A 9 9 VAL HA H 363 4.089 4.301 -0.212 1
1 95 . 13 1 1 A 9 9 VAL C C 363 173.760 175.196 -1.436 1
1 96 . 13 1 1 A 9 9 VAL CA C 363 59.814 61.206 -1.392 1
1 97 . 13 1 1 A 9 9 VAL CB C 363 30.058 30.242 -0.184 1
1 100 . 13 1 1 A 9 9 VAL N N 363 121.366 126.491 -5.125 1
1 101 . 13 1 1 A 10 10 THR H H 364 8.076 7.755 0.321 1
1 102 . 13 1 1 A 10 10 THR HA H 364 4.302 3.969 0.333 1
1 107 . 13 1 1 A 10 10 THR C C 364 172.135 176.141 -4.006 1
1 108 . 13 1 1 A 10 10 THR CA C 364 59.134 66.290 -7.156 1
1 109 . 13 1 1 A 10 10 THR CB C 364 67.415 68.585 -1.170 1
1 111 . 13 1 1 A 10 10 THR N N 364 116.817 121.078 -4.261 1
1 112 . 13 1 1 A 11 11 GLN H H 365 8.463 7.799 0.664 1
1 113 . 13 1 1 A 11 11 GLN HA H 365 4.046 4.203 -0.157 1
1 120 . 13 1 1 A 11 11 GLN C C 365 173.944 175.686 -1.742 1
1 121 . 13 1 1 A 11 11 GLN CA C 365 54.517 57.790 -3.273 1
1 122 . 13 1 1 A 11 11 GLN CB C 365 26.250 28.591 -2.341 1
1 124 . 13 1 1 A 11 11 GLN N N 365 122.059 117.892 4.167 1
1 126 . 13 1 1 A 12 12 GLU H H 366 8.449 7.799 0.650 1
1 127 . 13 1 1 A 12 12 GLU HA H 366 4.093 3.968 0.125 1
1 132 . 13 1 1 A 12 12 GLU C C 366 174.746 176.187 -1.441 1
1 133 . 13 1 1 A 12 12 GLU CA C 366 55.235 57.119 -1.884 1
1 134 . 13 1 1 A 12 12 GLU CB C 366 27.180 28.025 -0.845 1
1 136 . 13 1 1 A 12 12 GLU N N 366 120.415 115.533 4.882 1
1 137 . 13 1 1 A 13 13 GLN H H 367 8.031 7.790 0.241 1
1 138 . 13 1 1 A 13 13 GLN HA H 367 4.113 4.201 -0.088 1
1 145 . 13 1 1 A 13 13 GLN C C 367 173.693 176.985 -3.292 1
1 146 . 13 1 1 A 13 13 GLN CA C 367 54.132 57.970 -3.838 1
1 147 . 13 1 1 A 13 13 GLN CB C 367 26.420 28.945 -2.525 1
1 149 . 13 1 1 A 13 13 GLN N N 367 119.721 122.756 -3.035 1
1 151 . 13 1 1 A 14 14 TYR H H 368 8.111 7.394 0.717 1
1 152 . 13 1 1 A 14 14 TYR HA H 368 4.339 4.659 -0.320 1
1 159 . 13 1 1 A 14 14 TYR C C 368 173.916 176.684 -2.768 1
1 160 . 13 1 1 A 14 14 TYR CA C 368 56.572 58.921 -2.349 1
1 161 . 13 1 1 A 14 14 TYR CB C 368 35.879 37.615 -1.736 1
1 164 . 13 1 1 A 14 14 TYR N N 368 120.541 117.650 2.891 1
1 165 . 13 1 1 A 15 15 GLU H H 369 8.287 8.258 0.029 1
1 166 . 13 1 1 A 15 15 GLU HA H 369 4.009 4.381 -0.372 1
1 171 . 13 1 1 A 15 15 GLU C C 369 174.448 178.142 -3.694 1
1 172 . 13 1 1 A 15 15 GLU CA C 369 55.047 59.231 -4.184 1
1 173 . 13 1 1 A 15 15 GLU CB C 369 27.226 29.815 -2.589 1
1 175 . 13 1 1 A 15 15 GLU N N 369 120.398 122.754 -2.356 1
1 176 . 13 1 1 A 16 16 LEU H H 370 7.785 8.100 -0.315 1
1 177 . 13 1 1 A 16 16 LEU HA H 370 4.138 4.222 -0.084 1
1 187 . 13 1 1 A 16 16 LEU C C 370 175.089 177.301 -2.212 1
1 188 . 13 1 1 A 16 16 LEU CA C 370 53.425 55.536 -2.111 1
1 189 . 13 1 1 A 16 16 LEU CB C 370 39.554 40.924 -1.370 1
1 193 . 13 1 1 A 16 16 LEU N N 370 121.323 116.815 4.508 1
1 194 . 13 1 1 A 17 17 TYR H H 371 8.038 8.206 -0.168 1
1 195 . 13 1 1 A 17 17 TYR HA H 371 4.380 4.537 -0.157 1
1 202 . 13 1 1 A 17 17 TYR C C 371 173.931 176.270 -2.339 1
1 203 . 13 1 1 A 17 17 TYR CA C 371 56.143 57.754 -1.611 1
1 204 . 13 1 1 A 17 17 TYR CB C 371 35.501 38.578 -3.077 1
1 207 . 13 1 1 A 17 17 TYR N N 371 119.465 118.875 0.590 1
1 208 . 13 1 1 A 18 18 CYS H H 372 8.021 7.480 0.541 1
1 209 . 13 1 1 A 18 18 CYS HA H 372 4.236 4.059 0.177 1
1 212 . 13 1 1 A 18 18 CYS C C 372 172.457 174.786 -2.329 1
1 213 . 13 1 1 A 18 18 CYS CA C 372 56.997 59.493 -2.496 1
1 214 . 13 1 1 A 18 18 CYS CB C 372 25.080 28.007 -2.927 1
1 215 . 13 1 1 A 18 18 CYS N N 372 119.913 120.781 -0.868 1
1 216 . 13 1 1 A 19 19 GLU H H 373 8.151 9.074 -0.923 1
1 217 . 13 1 1 A 19 19 GLU HA H 373 4.130 4.435 -0.305 1
1 222 . 13 1 1 A 19 19 GLU C C 373 174.151 176.069 -1.918 1
1 223 . 13 1 1 A 19 19 GLU CA C 373 54.535 57.892 -3.357 1
1 224 . 13 1 1 A 19 19 GLU CB C 373 27.244 31.566 -4.322 1
1 226 . 13 1 1 A 19 19 GLU N N 373 122.431 128.415 -5.984 1
1 227 . 13 1 1 A 20 20 MET H H 374 8.109 8.036 0.073 1
1 228 . 13 1 1 A 20 20 MET HA H 374 4.352 4.540 -0.188 1
1 236 . 13 1 1 A 20 20 MET C C 374 174.200 175.424 -1.224 1
1 237 . 13 1 1 A 20 20 MET CA C 374 53.238 57.469 -4.231 1
1 238 . 13 1 1 A 20 20 MET CB C 374 30.237 31.455 -1.218 1
1 241 . 13 1 1 A 20 20 MET N N 374 119.754 117.653 2.101 1
1 242 . 13 1 1 A 21 21 GLY H H 375 8.231 8.650 -0.419 1
1 243 . 13 1 1 A 21 21 GLY HA2 H 375 3.861 4.199 -0.338 1
1 244 . 13 1 1 A 21 21 GLY HA3 H 375 3.960 4.202 -0.242 1
1 245 . 13 1 1 A 21 21 GLY C C 375 171.928 172.458 -0.530 1
1 246 . 13 1 1 A 21 21 GLY CA C 375 42.930 44.788 -1.858 1
1 247 . 13 1 1 A 21 21 GLY N N 375 109.484 108.792 0.692 1
1 248 . 13 1 1 A 22 22 SER HA H 376 4.492 4.631 -0.139 1
1 251 . 13 1 1 A 22 22 SER C C 376 172.206 174.645 -2.439 1
1 252 . 13 1 1 A 22 22 SER CA C 376 55.570 58.398 -2.828 1
1 253 . 13 1 1 A 22 22 SER CB C 376 61.525 63.744 -2.219 1
1 254 . 13 1 1 A 23 23 THR H H 377 8.470 8.662 -0.192 1
1 255 . 13 1 1 A 23 23 THR HA H 377 4.295 4.592 -0.297 1
1 260 . 13 1 1 A 23 23 THR C C 377 171.811 174.296 -2.485 1
1 261 . 13 1 1 A 23 23 THR CA C 377 58.937 61.333 -2.396 1
1 262 . 13 1 1 A 23 23 THR CB C 377 67.250 68.050 -0.800 1
1 264 . 13 1 1 A 23 23 THR N N 377 124.043 118.879 5.164 1
1 265 . 13 1 1 A 24 24 PHE H H 378 8.374 8.904 -0.530 1
1 266 . 13 1 1 A 24 24 PHE HA H 378 4.239 4.407 -0.168 1
1 273 . 13 1 1 A 24 24 PHE C C 378 173.411 177.798 -4.387 1
1 274 . 13 1 1 A 24 24 PHE CA C 378 56.697 60.111 -3.414 1
1 275 . 13 1 1 A 24 24 PHE CB C 378 36.538 40.106 -3.568 1
1 278 . 13 1 1 A 24 24 PHE N N 378 124.732 125.881 -1.149 1
1 279 . 13 1 1 A 25 25 GLN H H 379 8.457 8.261 0.196 1
1 280 . 13 1 1 A 25 25 GLN HA H 379 4.038 4.092 -0.054 1
1 287 . 13 1 1 A 25 25 GLN C C 379 172.431 175.937 -3.506 1
1 288 . 13 1 1 A 25 25 GLN CA C 379 54.078 57.633 -3.555 1
1 289 . 13 1 1 A 25 25 GLN CB C 379 26.414 29.428 -3.014 1
1 291 . 13 1 1 A 25 25 GLN N N 379 118.820 118.409 0.411 1
1 293 . 13 1 1 A 26 26 LEU H H 380 6.985 7.656 -0.671 1
1 294 . 13 1 1 A 26 26 LEU HA H 380 4.229 4.257 -0.028 1
1 304 . 13 1 1 A 26 26 LEU C C 380 173.895 176.682 -2.787 1
1 305 . 13 1 1 A 26 26 LEU CA C 380 52.123 54.671 -2.548 1
1 306 . 13 1 1 A 26 26 LEU CB C 380 40.543 42.630 -2.087 1
1 310 . 13 1 1 A 26 26 LEU N N 380 119.079 120.210 -1.131 1
1 311 . 13 1 1 A 27 27 CYS H H 381 8.905 9.243 -0.338 1
1 312 . 13 1 1 A 27 27 CYS HA H 381 4.013 4.554 -0.541 1
1 315 . 13 1 1 A 27 27 CYS C C 381 174.439 176.549 -2.110 1
1 316 . 13 1 1 A 27 27 CYS CA C 381 57.847 59.279 -1.432 1
1 317 . 13 1 1 A 27 27 CYS CB C 381 28.648 28.439 0.209 1
1 318 . 13 1 1 A 27 27 CYS N N 381 125.151 122.512 2.639 1
1 319 . 13 1 1 A 28 28 LYS H H 382 9.351 8.985 0.366 1
1 320 . 13 1 1 A 28 28 LYS HA H 382 4.157 4.181 -0.024 1
1 329 . 13 1 1 A 28 28 LYS C C 382 174.678 178.570 -3.892 1
1 330 . 13 1 1 A 28 28 LYS CA C 382 54.324 58.401 -4.077 1
1 331 . 13 1 1 A 28 28 LYS CB C 382 30.086 32.632 -2.546 1
1 335 . 13 1 1 A 28 28 LYS N N 382 128.840 128.324 0.516 1
1 336 . 13 1 1 A 29 29 ILE H H 383 9.040 7.385 1.655 1
1 337 . 13 1 1 A 29 29 ILE HA H 383 3.804 3.712 0.092 1
1 347 . 13 1 1 A 29 29 ILE C C 383 174.239 177.400 -3.161 1
1 348 . 13 1 1 A 29 29 ILE CA C 383 62.114 64.816 -2.702 1
1 349 . 13 1 1 A 29 29 ILE CB C 383 33.870 38.347 -4.477 1
1 353 . 13 1 1 A 29 29 ILE N N 383 122.718 118.774 3.944 1
1 354 . 13 1 1 A 30 30 CYS H H 384 7.572 7.689 -0.117 1
1 355 . 13 1 1 A 30 30 CYS HA H 384 4.548 4.416 0.132 1
1 358 . 13 1 1 A 30 30 CYS C C 384 172.978 175.094 -2.116 1
1 359 . 13 1 1 A 30 30 CYS CA C 384 54.957 59.702 -4.745 1
1 360 . 13 1 1 A 30 30 CYS CB C 384 29.778 29.343 0.435 1
1 361 . 13 1 1 A 30 30 CYS N N 384 116.356 115.855 0.501 1
1 362 . 13 1 1 A 31 31 ALA H H 385 8.205 8.231 -0.026 1
1 363 . 13 1 1 A 31 31 ALA HA H 385 4.107 4.277 -0.170 1
1 367 . 13 1 1 A 31 31 ALA C C 385 173.139 177.222 -4.083 1
1 368 . 13 1 1 A 31 31 ALA CA C 385 50.802 53.593 -2.791 1
1 369 . 13 1 1 A 31 31 ALA CB C 385 14.634 17.853 -3.219 1
1 370 . 13 1 1 A 31 31 ALA N N 385 125.526 120.886 4.640 1
1 371 . 13 1 1 A 32 32 GLU H H 386 8.416 8.139 0.277 1
1 372 . 13 1 1 A 32 32 GLU HA H 386 4.467 4.430 0.037 1
1 377 . 13 1 1 A 32 32 GLU C C 386 172.325 176.344 -4.019 1
1 378 . 13 1 1 A 32 32 GLU CA C 386 55.146 57.163 -2.017 1
1 379 . 13 1 1 A 32 32 GLU CB C 386 31.181 31.906 -0.725 1
1 381 . 13 1 1 A 32 32 GLU N N 386 117.579 115.674 1.905 1
1 382 . 13 1 1 A 33 33 ASN H H 387 7.872 7.809 0.063 1
1 383 . 13 1 1 A 33 33 ASN HA H 387 4.900 4.963 -0.063 1
1 388 . 13 1 1 A 33 33 ASN C C 387 171.355 174.607 -3.252 1
1 389 . 13 1 1 A 33 33 ASN CA C 387 49.320 52.036 -2.716 1
1 390 . 13 1 1 A 33 33 ASN CB C 387 38.457 39.821 -1.364 1
1 391 . 13 1 1 A 33 33 ASN N N 387 120.399 116.384 4.015 1
1 393 . 13 1 1 A 34 34 ASP H H 388 8.565 8.583 -0.018 1
1 394 . 13 1 1 A 34 34 ASP HA H 388 4.679 5.051 -0.372 1
1 397 . 13 1 1 A 34 34 ASP C C 388 174.243 175.674 -1.431 1
1 398 . 13 1 1 A 34 34 ASP CA C 388 51.809 53.390 -1.581 1
1 399 . 13 1 1 A 34 34 ASP CB C 388 38.007 41.665 -3.658 1
1 400 . 13 1 1 A 34 34 ASP N N 388 120.661 120.961 -0.300 1
1 401 . 13 1 1 A 35 35 LYS H H 389 8.544 8.526 0.018 1
1 402 . 13 1 1 A 35 35 LYS HA H 389 3.411 4.468 -1.057 1
1 409 . 13 1 1 A 35 35 LYS C C 389 172.938 176.552 -3.614 1
1 410 . 13 1 1 A 35 35 LYS CA C 389 54.973 55.890 -0.917 1
1 411 . 13 1 1 A 35 35 LYS CB C 389 30.617 32.522 -1.905 1
1 415 . 13 1 1 A 35 35 LYS N N 389 119.199 119.073 0.126 1
1 416 . 13 1 1 A 36 36 ASP H H 390 8.327 8.920 -0.593 1
1 417 . 13 1 1 A 36 36 ASP HA H 390 4.724 4.929 -0.205 1
1 420 . 13 1 1 A 36 36 ASP C C 390 172.860 175.267 -2.407 1
1 421 . 13 1 1 A 36 36 ASP CA C 390 51.609 53.423 -1.814 1
1 422 . 13 1 1 A 36 36 ASP CB C 390 39.018 41.689 -2.671 1
1 423 . 13 1 1 A 36 36 ASP N N 390 119.134 120.175 -1.041 1
1 424 . 13 1 1 A 37 37 VAL H H 391 8.544 7.879 0.665 1
1 425 . 13 1 1 A 37 37 VAL HA H 391 4.877 4.800 0.077 1
1 433 . 13 1 1 A 37 37 VAL C C 391 167.519 173.316 -5.797 1
1 434 . 13 1 1 A 37 37 VAL CA C 391 58.259 59.873 -1.614 1
1 435 . 13 1 1 A 37 37 VAL CB C 391 32.277 35.251 -2.974 1
1 438 . 13 1 1 A 37 37 VAL N N 391 121.970 119.532 2.438 1
1 439 . 13 1 1 A 38 38 LYS H H 392 8.621 9.575 -0.954 1
1 440 . 13 1 1 A 38 38 LYS HA H 392 4.991 5.333 -0.342 1
1 449 . 13 1 1 A 38 38 LYS C C 392 172.681 175.201 -2.520 1
1 450 . 13 1 1 A 38 38 LYS CA C 392 51.123 54.673 -3.550 1
1 451 . 13 1 1 A 38 38 LYS CB C 392 33.697 34.368 -0.671 1
1 455 . 13 1 1 A 38 38 LYS N N 392 126.381 129.110 -2.729 1
1 456 . 13 1 1 A 39 39 ILE H H 393 8.723 8.997 -0.274 1
1 457 . 13 1 1 A 39 39 ILE HA H 393 4.239 4.344 -0.105 1
1 467 . 13 1 1 A 39 39 ILE C C 393 172.642 175.774 -3.132 1
1 468 . 13 1 1 A 39 39 ILE CA C 393 57.768 61.054 -3.286 1
1 469 . 13 1 1 A 39 39 ILE CB C 393 35.691 37.587 -1.896 1
1 473 . 13 1 1 A 39 39 ILE N N 393 126.398 128.395 -1.997 1
1 474 . 13 1 1 A 40 40 GLU H H 394 8.506 9.232 -0.726 1
1 475 . 13 1 1 A 40 40 GLU HA H 394 4.753 4.688 0.065 1
1 480 . 13 1 1 A 40 40 GLU C C 394 173.596 176.083 -2.487 1
1 481 . 13 1 1 A 40 40 GLU CA C 394 49.793 53.410 -3.617 1
1 482 . 13 1 1 A 40 40 GLU CB C 394 28.210 30.358 -2.148 1
1 484 . 13 1 1 A 40 40 GLU N N 394 124.864 127.816 -2.952 1
1 485 . 13 1 1 A 41 41 PRO HA H 395 4.864 4.514 0.350 1
1 492 . 13 1 1 A 41 41 PRO C C 395 175.073 176.857 -1.784 1
1 493 . 13 1 1 A 41 41 PRO CA C 395 61.111 63.898 -2.787 1
1 494 . 13 1 1 A 41 41 PRO CB C 395 32.275 32.945 -0.670 1
1 497 . 13 1 1 A 42 42 CYS H H 396 7.828 7.724 0.104 1
1 498 . 13 1 1 A 42 42 CYS HA H 396 4.208 4.042 0.166 1
1 501 . 13 1 1 A 42 42 CYS C C 396 173.877 175.449 -1.572 1
1 502 . 13 1 1 A 42 42 CYS CA C 396 58.021 60.966 -2.945 1
1 503 . 13 1 1 A 42 42 CYS CB C 396 28.242 27.447 0.795 1
1 504 . 13 1 1 A 42 42 CYS N N 396 122.434 118.663 3.771 1
1 505 . 13 1 1 A 43 43 GLY H H 397 8.679 8.667 0.012 1
1 506 . 13 1 1 A 43 43 GLY HA2 H 397 3.507 3.931 -0.424 1
1 507 . 13 1 1 A 43 43 GLY HA3 H 397 3.914 3.935 -0.021 1
1 508 . 13 1 1 A 43 43 GLY C C 397 171.981 174.888 -2.907 1
1 509 . 13 1 1 A 43 43 GLY CA C 397 43.347 46.287 -2.940 1
1 510 . 13 1 1 A 43 43 GLY N N 397 112.123 108.087 4.036 1
1 511 . 13 1 1 A 44 44 HIS H H 398 8.329 7.269 1.060 1
1 512 . 13 1 1 A 44 44 HIS HA H 398 4.339 4.420 -0.081 1
1 517 . 13 1 1 A 44 44 HIS C C 398 170.742 174.803 -4.061 1
1 518 . 13 1 1 A 44 44 HIS CA C 398 58.368 56.287 2.081 1
1 519 . 13 1 1 A 44 44 HIS CB C 398 28.434 30.899 -2.465 1
1 522 . 13 1 1 A 44 44 HIS N N 398 121.393 117.162 4.231 1
1 523 . 13 1 1 A 45 45 LEU H H 399 8.241 8.904 -0.663 1
1 524 . 13 1 1 A 45 45 LEU HA H 399 5.570 5.244 0.326 1
1 534 . 13 1 1 A 45 45 LEU C C 399 174.464 175.357 -0.893 1
1 535 . 13 1 1 A 45 45 LEU CA C 399 50.729 53.802 -3.073 1
1 536 . 13 1 1 A 45 45 LEU CB C 399 43.574 43.576 -0.002 1
1 540 . 13 1 1 A 45 45 LEU N N 399 118.469 123.722 -5.253 1
1 541 . 13 1 1 A 46 46 MET H H 400 8.707 8.872 -0.165 1
1 542 . 13 1 1 A 46 46 MET HA H 400 4.842 5.072 -0.230 1
1 550 . 13 1 1 A 46 46 MET C C 400 170.736 174.593 -3.857 1
1 551 . 13 1 1 A 46 46 MET CA C 400 52.804 54.010 -1.206 1
1 552 . 13 1 1 A 46 46 MET CB C 400 31.945 35.525 -3.580 1
1 555 . 13 1 1 A 46 46 MET N N 400 114.897 120.612 -5.715 1
1 556 . 13 1 1 A 47 47 CYS H H 401 9.436 8.370 1.066 1
1 557 . 13 1 1 A 47 47 CYS HA H 401 5.629 4.989 0.640 1
1 560 . 13 1 1 A 47 47 CYS C C 401 173.909 176.365 -2.456 1
1 561 . 13 1 1 A 47 47 CYS CA C 401 54.325 57.276 -2.951 1
1 562 . 13 1 1 A 47 47 CYS CB C 401 30.725 29.376 1.349 1
1 563 . 13 1 1 A 47 47 CYS N N 401 119.575 119.391 0.184 1
1 564 . 13 1 1 A 48 48 THR H H 402 9.842 9.405 0.437 1
1 565 . 13 1 1 A 48 48 THR HA H 402 3.768 4.007 -0.239 1
1 570 . 13 1 1 A 48 48 THR C C 402 174.333 176.270 -1.937 1
1 571 . 13 1 1 A 48 48 THR CA C 402 64.516 65.962 -1.446 1
1 572 . 13 1 1 A 48 48 THR CB C 402 66.288 68.708 -2.420 1
1 574 . 13 1 1 A 48 48 THR N N 402 119.945 118.927 1.018 1
1 575 . 13 1 1 A 49 49 SER H H 403 8.355 8.049 0.306 1
1 576 . 13 1 1 A 49 49 SER HA H 403 4.222 4.062 0.160 1
1 579 . 13 1 1 A 49 49 SER C C 403 175.059 177.010 -1.951 1
1 580 . 13 1 1 A 49 49 SER CA C 403 59.828 61.961 -2.133 1
1 581 . 13 1 1 A 49 49 SER CB C 403 59.717 62.760 -3.043 1
1 582 . 13 1 1 A 49 49 SER N N 403 120.468 117.345 3.123 1
1 583 . 13 1 1 A 50 50 CYS H H 404 9.464 7.835 1.629 1
1 584 . 13 1 1 A 50 50 CYS HA H 404 3.922 4.145 -0.223 1
1 587 . 13 1 1 A 50 50 CYS C C 404 176.081 177.082 -1.001 1
1 588 . 13 1 1 A 50 50 CYS CA C 404 63.076 64.220 -1.144 1
1 589 . 13 1 1 A 50 50 CYS CB C 404 26.078 27.315 -1.237 1
1 590 . 13 1 1 A 50 50 CYS N N 404 126.744 119.740 7.004 1
1 591 . 13 1 1 A 51 51 LEU H H 405 7.948 8.299 -0.351 1
1 592 . 13 1 1 A 51 51 LEU HA H 405 4.064 4.216 -0.152 1
1 602 . 13 1 1 A 51 51 LEU C C 405 175.495 178.713 -3.218 1
1 603 . 13 1 1 A 51 51 LEU CA C 405 55.914 58.209 -2.295 1
1 604 . 13 1 1 A 51 51 LEU CB C 405 38.662 41.912 -3.250 1
1 607 . 13 1 1 A 51 51 LEU N N 405 121.951 123.183 -1.232 1
1 608 . 13 1 1 A 52 52 THR H H 406 8.786 8.512 0.274 1
1 609 . 13 1 1 A 52 52 THR HA H 406 4.024 3.981 0.043 1
1 614 . 13 1 1 A 52 52 THR C C 406 174.139 176.599 -2.460 1
1 615 . 13 1 1 A 52 52 THR CA C 406 64.017 66.453 -2.436 1
1 616 . 13 1 1 A 52 52 THR CB C 406 66.115 68.346 -2.231 1
1 618 . 13 1 1 A 52 52 THR N N 406 115.258 114.767 0.491 1
1 619 . 13 1 1 A 53 53 SER H H 407 8.115 8.011 0.104 1
1 620 . 13 1 1 A 53 53 SER HA H 407 4.204 4.241 -0.037 1
1 623 . 13 1 1 A 53 53 SER C C 407 174.456 176.866 -2.410 1
1 624 . 13 1 1 A 53 53 SER CA C 407 59.090 60.850 -1.760 1
1 625 . 13 1 1 A 53 53 SER CB C 407 60.146 63.255 -3.109 1
1 626 . 13 1 1 A 53 53 SER N N 407 116.852 115.150 1.702 1
1 627 . 13 1 1 A 54 54 TRP H H 408 8.123 7.814 0.309 1
1 628 . 13 1 1 A 54 54 TRP HA H 408 4.371 4.248 0.123 1
1 637 . 13 1 1 A 54 54 TRP C C 408 175.981 178.432 -2.451 1
1 638 . 13 1 1 A 54 54 TRP CA C 408 57.323 60.769 -3.446 1
1 639 . 13 1 1 A 54 54 TRP CB C 408 26.812 29.666 -2.854 1
1 645 . 13 1 1 A 54 54 TRP N N 408 123.556 123.106 0.450 1
1 647 . 13 1 1 A 55 55 GLN H H 409 8.502 8.977 -0.475 1
1 648 . 13 1 1 A 55 55 GLN HA H 409 3.999 3.705 0.294 1
1 655 . 13 1 1 A 55 55 GLN C C 409 177.300 178.270 -0.970 1
1 656 . 13 1 1 A 55 55 GLN CA C 409 56.484 59.154 -2.670 1
1 657 . 13 1 1 A 55 55 GLN CB C 409 26.190 28.457 -2.267 1
1 659 . 13 1 1 A 55 55 GLN N N 409 118.044 118.306 -0.262 1
1 661 . 13 1 1 A 56 56 GLU H H 410 8.467 8.401 0.066 1
1 662 . 13 1 1 A 56 56 GLU HA H 410 4.057 3.957 0.100 1
1 667 . 13 1 1 A 56 56 GLU C C 410 174.787 176.599 -1.812 1
1 668 . 13 1 1 A 56 56 GLU CA C 410 55.909 58.782 -2.873 1
1 669 . 13 1 1 A 56 56 GLU CB C 410 26.895 29.222 -2.327 1
1 671 . 13 1 1 A 56 56 GLU N N 410 119.448 117.764 1.684 1
1 672 . 13 1 1 A 57 57 SER H H 411 7.438 7.791 -0.353 1
1 673 . 13 1 1 A 57 57 SER HA H 411 4.607 4.575 0.032 1
1 676 . 13 1 1 A 57 57 SER C C 411 170.849 173.783 -2.934 1
1 677 . 13 1 1 A 57 57 SER CA C 411 55.540 57.164 -1.624 1
1 678 . 13 1 1 A 57 57 SER CB C 411 60.928 63.323 -2.395 1
1 679 . 13 1 1 A 57 57 SER N N 411 113.752 114.679 -0.927 1
1 680 . 13 1 1 A 58 58 GLU H H 412 7.855 7.716 0.139 1
1 681 . 13 1 1 A 58 58 GLU HA H 412 3.772 3.830 -0.058 1
1 686 . 13 1 1 A 58 58 GLU C C 412 173.743 175.521 -1.778 1
1 687 . 13 1 1 A 58 58 GLU CA C 412 54.442 57.031 -2.589 1
1 688 . 13 1 1 A 58 58 GLU CB C 412 24.603 27.879 -3.276 1
1 690 . 13 1 1 A 58 58 GLU N N 412 115.908 120.330 -4.422 1
1 691 . 13 1 1 A 59 59 GLY H H 413 7.588 8.091 -0.503 1
1 692 . 13 1 1 A 59 59 GLY HA2 H 413 1.643 2.941 -1.298 1
1 693 . 13 1 1 A 59 59 GLY HA3 H 413 2.949 3.655 -0.706 1
1 694 . 13 1 1 A 59 59 GLY C C 413 170.850 174.261 -3.411 1
1 695 . 13 1 1 A 59 59 GLY CA C 413 41.724 46.614 -4.890 1
1 696 . 13 1 1 A 59 59 GLY N N 413 108.032 114.268 -6.236 1
1 697 . 13 1 1 A 60 60 GLN H H 414 7.973 8.047 -0.074 1
1 698 . 13 1 1 A 60 60 GLN HA H 414 4.366 4.545 -0.179 1
1 705 . 13 1 1 A 60 60 GLN C C 414 173.108 175.923 -2.815 1
1 706 . 13 1 1 A 60 60 GLN CA C 414 52.422 55.691 -3.269 1
1 707 . 13 1 1 A 60 60 GLN CB C 414 27.049 28.472 -1.423 1
1 709 . 13 1 1 A 60 60 GLN N N 414 122.690 120.151 2.539 1
1 711 . 13 1 1 A 61 61 GLY H H 415 8.301 8.067 0.234 1
1 712 . 13 1 1 A 61 61 GLY HA2 H 415 3.700 4.210 -0.510 1
1 713 . 13 1 1 A 61 61 GLY HA3 H 415 3.920 4.241 -0.321 1
1 714 . 13 1 1 A 61 61 GLY C C 415 170.249 174.269 -4.020 1
1 715 . 13 1 1 A 61 61 GLY CA C 415 42.210 44.686 -2.476 1
1 716 . 13 1 1 A 61 61 GLY N N 415 110.794 111.565 -0.771 1
1 717 . 13 1 1 A 62 62 CYS H H 416 8.549 8.410 0.139 1
1 718 . 13 1 1 A 62 62 CYS HA H 416 4.227 4.701 -0.474 1
1 721 . 13 1 1 A 62 62 CYS C C 416 172.914 175.403 -2.489 1
1 722 . 13 1 1 A 62 62 CYS CA C 416 54.008 58.779 -4.771 1
1 723 . 13 1 1 A 62 62 CYS CB C 416 29.716 27.571 2.145 1
1 724 . 13 1 1 A 62 62 CYS N N 416 123.683 120.778 2.905 1
1 725 . 13 1 1 A 63 63 PRO HA H 417 2.611 2.983 -0.372 1
1 732 . 13 1 1 A 63 63 PRO C C 417 174.143 177.915 -3.772 1
1 733 . 13 1 1 A 63 63 PRO CA C 417 61.689 63.792 -2.103 1
1 734 . 13 1 1 A 63 63 PRO CB C 417 28.534 31.077 -2.543 1
1 737 . 13 1 1 A 64 64 PHE H H 418 8.968 7.818 1.150 1
1 738 . 13 1 1 A 64 64 PHE HA H 418 4.250 4.117 0.133 1
1 746 . 13 1 1 A 64 64 PHE C C 418 174.243 177.961 -3.718 1
1 747 . 13 1 1 A 64 64 PHE CA C 418 56.720 60.331 -3.611 1
1 748 . 13 1 1 A 64 64 PHE CB C 418 36.458 39.189 -2.731 1
1 752 . 13 1 1 A 64 64 PHE N N 418 117.008 115.687 1.321 1
1 753 . 13 1 1 A 65 65 CYS H H 419 7.968 7.890 0.078 1
1 754 . 13 1 1 A 65 65 CYS HA H 419 4.906 4.499 0.407 1
1 757 . 13 1 1 A 65 65 CYS C C 419 173.198 174.858 -1.660 1
1 758 . 13 1 1 A 65 65 CYS CA C 419 55.870 59.863 -3.993 1
1 759 . 13 1 1 A 65 65 CYS CB C 419 30.559 28.973 1.586 1
1 760 . 13 1 1 A 65 65 CYS N N 419 117.505 117.633 -0.128 1
1 761 . 13 1 1 A 66 66 ARG H H 420 8.761 8.135 0.626 1
1 762 . 13 1 1 A 66 66 ARG HA H 420 4.365 4.361 0.004 1
1 769 . 13 1 1 A 66 66 ARG C C 420 172.921 174.254 -1.333 1
1 770 . 13 1 1 A 66 66 ARG CA C 420 54.763 57.074 -2.311 1
1 771 . 13 1 1 A 66 66 ARG CB C 420 24.286 27.004 -2.718 1
1 774 . 13 1 1 A 66 66 ARG N N 420 118.763 116.239 2.524 1
1 775 . 13 1 1 A 67 67 CYS H H 421 8.223 7.973 0.250 1
1 776 . 13 1 1 A 67 67 CYS HA H 421 4.419 4.849 -0.430 1
1 779 . 13 1 1 A 67 67 CYS C C 421 171.160 174.343 -3.183 1
1 780 . 13 1 1 A 67 67 CYS CA C 421 57.119 57.258 -0.139 1
1 781 . 13 1 1 A 67 67 CYS CB C 421 25.911 30.121 -4.210 1
1 782 . 13 1 1 A 67 67 CYS N N 421 120.627 116.276 4.351 1
1 783 . 13 1 1 A 68 68 GLU H H 422 8.416 8.788 -0.372 1
1 784 . 13 1 1 A 68 68 GLU HA H 422 4.025 4.015 0.010 1
1 789 . 13 1 1 A 68 68 GLU C C 422 173.764 176.055 -2.291 1
1 790 . 13 1 1 A 68 68 GLU CA C 422 54.752 57.379 -2.627 1
1 791 . 13 1 1 A 68 68 GLU CB C 422 27.302 29.526 -2.224 1
1 793 . 13 1 1 A 68 68 GLU N N 422 122.370 120.136 2.234 1
1 794 . 13 1 1 A 69 69 ILE H H 423 8.648 8.965 -0.317 1
1 795 . 13 1 1 A 69 69 ILE HA H 423 4.012 4.425 -0.413 1
1 805 . 13 1 1 A 69 69 ILE C C 423 174.257 175.569 -1.312 1
1 806 . 13 1 1 A 69 69 ILE CA C 423 59.740 60.547 -0.807 1
1 807 . 13 1 1 A 69 69 ILE CB C 423 35.846 38.056 -2.210 1
1 811 . 13 1 1 A 69 69 ILE N N 423 125.988 126.103 -0.115 1
1 812 . 13 1 1 A 70 70 LYS H H 424 9.185 9.620 -0.435 1
1 813 . 13 1 1 A 70 70 LYS HA H 424 4.434 4.413 0.021 1
1 822 . 13 1 1 A 70 70 LYS C C 424 173.880 176.376 -2.496 1
1 823 . 13 1 1 A 70 70 LYS CA C 424 53.378 56.869 -3.491 1
1 824 . 13 1 1 A 70 70 LYS CB C 424 30.397 34.145 -3.748 1
1 828 . 13 1 1 A 70 70 LYS N N 424 128.977 130.049 -1.072 1
1 829 . 13 1 1 A 71 71 GLY H H 425 7.810 7.168 0.642 1
1 830 . 13 1 1 A 71 71 GLY HA2 H 425 4.094 4.037 0.057 1
1 831 . 13 1 1 A 71 71 GLY HA3 H 425 4.159 4.040 0.119 1
1 832 . 13 1 1 A 71 71 GLY C C 425 168.179 171.528 -3.349 1
1 833 . 13 1 1 A 71 71 GLY CA C 425 42.326 45.551 -3.225 1
1 834 . 13 1 1 A 71 71 GLY N N 425 107.696 106.728 0.968 1
1 835 . 13 1 1 A 72 72 THR H H 426 8.048 8.484 -0.436 1
1 836 . 13 1 1 A 72 72 THR HA H 426 5.258 5.427 -0.169 1
1 841 . 13 1 1 A 72 72 THR C C 426 170.979 173.604 -2.625 1
1 842 . 13 1 1 A 72 72 THR CA C 426 56.755 59.763 -3.008 1
1 843 . 13 1 1 A 72 72 THR CB C 426 69.226 72.259 -3.033 1
1 845 . 13 1 1 A 72 72 THR N N 426 109.122 111.054 -1.932 1
1 846 . 13 1 1 A 73 73 GLU H H 427 8.912 9.085 -0.173 1
1 847 . 13 1 1 A 73 73 GLU HA H 427 4.954 4.800 0.154 1
1 852 . 13 1 1 A 73 73 GLU C C 427 170.353 174.100 -3.747 1
1 853 . 13 1 1 A 73 73 GLU CA C 427 50.182 52.912 -2.730 1
1 854 . 13 1 1 A 73 73 GLU CB C 427 30.559 31.911 -1.352 1
1 856 . 13 1 1 A 73 73 GLU N N 427 121.703 121.389 0.314 1
1 1 . 13 1 1 A 74 74 PRO HA H 428 4.372 4.891 -0.519 1
1 2 . 13 1 1 A 74 74 PRO C C 428 173.839 176.754 -2.915 1
1 3 . 13 1 1 A 74 74 PRO CA C 428 60.241 62.824 -2.583 1
1 4 . 13 1 1 A 74 74 PRO CB C 428 29.299 32.147 -2.848 1
1 857 . 13 1 1 A 74 74 PRO HA H 428 4.782 4.891 -0.109 1
1 864 . 13 1 1 A 74 74 PRO C C 428 174.027 176.754 -2.727 1
1 865 . 13 1 1 A 74 74 PRO CA C 428 59.771 62.824 -3.053 1
1 866 . 13 1 1 A 74 74 PRO CB C 428 29.633 32.147 -2.514 1
1 7 . 13 1 1 A 75 75 ILE H H 429 8.144 8.960 -0.816 1
1 8 . 13 1 1 A 75 75 ILE HA H 429 4.086 4.499 -0.413 1
1 15 . 13 1 1 A 75 75 ILE C C 429 173.426 175.476 -2.050 1
1 16 . 13 1 1 A 75 75 ILE CA C 429 58.339 61.003 -2.664 1
1 17 . 13 1 1 A 75 75 ILE CB C 429 35.988 38.765 -2.777 1
1 21 . 13 1 1 A 75 75 ILE N N 429 121.551 122.573 -1.022 1
1 869 . 13 1 1 A 75 75 ILE H H 429 7.682 8.960 -1.278 1
1 870 . 13 1 1 A 75 75 ILE HA H 429 4.282 4.499 -0.217 1
1 880 . 13 1 1 A 75 75 ILE C C 429 172.510 175.476 -2.966 1
1 881 . 13 1 1 A 75 75 ILE CA C 429 57.456 61.003 -3.547 1
1 882 . 13 1 1 A 75 75 ILE CB C 429 37.903 38.765 -0.862 1
1 886 . 13 1 1 A 75 75 ILE N N 429 119.651 122.573 -2.922 1
1 1 . 13 1 1 A 76 76 VAL HA H 430 4.086 4.537 -0.451 1
1 2 . 13 1 1 A 76 76 VAL CA C 430 59.372 61.782 -2.410 1
1 22 . 13 1 1 A 76 76 VAL H H 430 8.221 8.631 -0.410 1
1 23 . 13 1 1 A 76 76 VAL HA H 430 4.083 4.537 -0.454 1
1 24 . 13 1 1 A 76 76 VAL C C 430 173.067 174.722 -1.655 1
1 25 . 13 1 1 A 76 76 VAL CA C 430 59.445 61.782 -2.337 1
1 26 . 13 1 1 A 76 76 VAL CB C 430 30.407 33.310 -2.903 1
1 27 . 13 1 1 A 76 76 VAL N N 430 125.930 126.243 -0.313 1
1 887 . 13 1 1 A 76 76 VAL H H 430 8.122 8.631 -0.509 1
1 888 . 13 1 1 A 76 76 VAL HA H 430 4.197 4.537 -0.340 1
1 890 . 13 1 1 A 76 76 VAL C C 430 172.971 174.722 -1.751 1
1 891 . 13 1 1 A 76 76 VAL CA C 430 58.821 61.782 -2.961 1
1 892 . 13 1 1 A 76 76 VAL CB C 430 30.807 33.310 -2.503 1
1 895 . 13 1 1 A 76 76 VAL N N 430 124.178 126.243 -2.065 1
1 4 . 13 1 1 A 77 77 VAL H H 431 8.204 8.715 -0.511 1
1 5 . 13 1 1 A 77 77 VAL HA H 431 4.049 5.027 -0.978 1
1 6 . 13 1 1 A 77 77 VAL C C 431 172.636 175.093 -2.457 1
1 7 . 13 1 1 A 77 77 VAL CA C 431 59.315 60.133 -0.818 1
1 8 . 13 1 1 A 77 77 VAL CB C 431 30.219 34.065 -3.846 1
1 9 . 13 1 1 A 77 77 VAL N N 431 125.320 121.717 3.603 1
1 28 . 13 1 1 A 77 77 VAL H H 431 8.412 8.715 -0.303 1
1 29 . 13 1 1 A 77 77 VAL HA H 431 4.038 5.027 -0.989 1
1 37 . 13 1 1 A 77 77 VAL C C 431 172.617 175.093 -2.476 1
1 38 . 13 1 1 A 77 77 VAL CA C 431 59.137 60.133 -0.996 1
1 39 . 13 1 1 A 77 77 VAL CB C 431 30.292 34.065 -3.773 1
1 42 . 13 1 1 A 77 77 VAL N N 431 125.655 121.717 3.938 1
1 896 . 13 1 1 A 77 77 VAL H H 431 8.448 8.715 -0.267 1
1 897 . 13 1 1 A 77 77 VAL HA H 431 4.087 5.027 -0.940 1
1 905 . 13 1 1 A 77 77 VAL C C 431 172.493 175.093 -2.600 1
1 906 . 13 1 1 A 77 77 VAL CA C 431 59.185 60.133 -0.948 1
1 907 . 13 1 1 A 77 77 VAL CB C 431 30.084 34.065 -3.981 1
1 910 . 13 1 1 A 77 77 VAL N N 431 125.770 121.717 4.053 1
1 43 . 13 1 1 A 78 78 ASP H H 432 8.419 8.819 -0.400 1
1 44 . 13 1 1 A 78 78 ASP HA H 432 4.829 4.634 0.195 1
1 45 . 13 1 1 A 78 78 ASP C C 432 172.252 175.168 -2.916 1
1 46 . 13 1 1 A 78 78 ASP CA C 432 49.320 52.623 -3.303 1
1 47 . 13 1 1 A 78 78 ASP CB C 432 39.066 39.481 -0.415 1
1 48 . 13 1 1 A 78 78 ASP N N 432 126.226 125.634 0.592 1
1 911 . 13 1 1 A 78 78 ASP H H 432 8.493 8.819 -0.326 1
1 912 . 13 1 1 A 78 78 ASP HA H 432 4.852 4.634 0.218 1
1 915 . 13 1 1 A 78 78 ASP C C 432 172.048 175.168 -3.120 1
1 916 . 13 1 1 A 78 78 ASP CA C 432 49.233 52.623 -3.390 1
1 917 . 13 1 1 A 78 78 ASP CB C 432 38.858 39.481 -0.623 1
1 918 . 13 1 1 A 78 78 ASP N N 432 126.705 125.634 1.071 1
1 10 . 13 1 1 A 79 79 PRO CA C 433 63.865 62.519 1.346 1
1 49 . 13 1 1 A 79 79 PRO C C 433 173.867 176.241 -2.374 1
1 919 . 13 1 1 A 79 79 PRO HA H 433 4.237 4.584 -0.347 1
1 926 . 13 1 1 A 79 79 PRO C C 433 173.812 176.241 -2.429 1
1 927 . 13 1 1 A 79 79 PRO CA C 433 60.627 62.519 -1.892 1
1 928 . 13 1 1 A 79 79 PRO CB C 433 29.329 29.135 0.194 1
1 11 . 13 1 1 A 80 80 PHE H H 434 8.182 8.736 -0.554 1
1 12 . 13 1 1 A 80 80 PHE HA H 434 4.499 4.278 0.221 1
1 13 . 13 1 1 A 80 80 PHE C C 434 171.680 176.277 -4.597 1
1 14 . 13 1 1 A 80 80 PHE CA C 434 54.657 60.761 -6.104 1
1 15 . 13 1 1 A 80 80 PHE CB C 434 36.272 38.880 -2.608 1
1 16 . 13 1 1 A 80 80 PHE N N 434 118.611 123.577 -4.966 1
1 50 . 13 1 1 A 80 80 PHE H H 434 8.191 8.736 -0.545 1
1 51 . 13 1 1 A 80 80 PHE HA H 434 4.528 4.278 0.250 1
1 54 . 13 1 1 A 80 80 PHE C C 434 172.457 176.277 -3.820 1
1 55 . 13 1 1 A 80 80 PHE CA C 434 54.828 60.761 -5.933 1
1 56 . 13 1 1 A 80 80 PHE CB C 434 36.457 38.880 -2.423 1
1 57 . 13 1 1 A 80 80 PHE N N 434 118.871 123.577 -4.706 1
1 931 . 13 1 1 A 80 80 PHE H H 434 8.191 8.736 -0.545 1
1 932 . 13 1 1 A 80 80 PHE HA H 434 4.463 4.278 0.185 1
1 939 . 13 1 1 A 80 80 PHE C C 434 172.283 176.277 -3.994 1
1 940 . 13 1 1 A 80 80 PHE CA C 434 54.971 60.761 -5.790 1
1 941 . 13 1 1 A 80 80 PHE CB C 434 36.490 38.880 -2.390 1
1 944 . 13 1 1 A 80 80 PHE N N 434 119.263 123.577 -4.314 1
1 17 . 13 1 1 A 81 81 ASP H H 435 7.490 8.190 -0.700 1
1 18 . 13 1 1 A 81 81 ASP HA H 435 4.698 5.011 -0.313 1
1 19 . 13 1 1 A 81 81 ASP C C 435 171.662 174.253 -2.591 1
1 20 . 13 1 1 A 81 81 ASP CA C 435 49.570 50.777 -1.207 1
1 21 . 13 1 1 A 81 81 ASP CB C 435 40.104 42.006 -1.902 1
1 22 . 13 1 1 A 81 81 ASP N N 435 120.304 118.300 2.004 1
1 58 . 13 1 1 A 81 81 ASP H H 435 7.881 8.190 -0.309 1
1 59 . 13 1 1 A 81 81 ASP HA H 435 4.801 5.011 -0.210 1
1 60 . 13 1 1 A 81 81 ASP C C 435 171.144 174.253 -3.109 1
1 61 . 13 1 1 A 81 81 ASP CA C 435 49.406 50.777 -1.371 1
1 62 . 13 1 1 A 81 81 ASP CB C 435 38.618 42.006 -3.388 1
1 63 . 13 1 1 A 81 81 ASP N N 435 123.108 118.300 4.808 1
1 945 . 13 1 1 A 81 81 ASP H H 435 7.823 8.190 -0.367 1
1 946 . 13 1 1 A 81 81 ASP HA H 435 4.759 5.011 -0.252 1
1 949 . 13 1 1 A 81 81 ASP C C 435 171.057 174.253 -3.196 1
1 950 . 13 1 1 A 81 81 ASP CA C 435 49.174 50.777 -1.603 1
1 951 . 13 1 1 A 81 81 ASP CB C 435 38.725 42.006 -3.281 1
1 952 . 13 1 1 A 81 81 ASP N N 435 123.530 118.300 5.230 1
1 23 . 13 1 1 A 82 82 PRO HA H 436 4.758 4.889 -0.131 1
1 24 . 13 1 1 A 82 82 PRO C C 436 172.944 176.232 -3.288 1
1 25 . 13 1 1 A 82 82 PRO CA C 436 60.134 62.465 -2.331 1
1 26 . 13 1 1 A 82 82 PRO CB C 436 31.425 32.549 -1.124 1
1 64 . 13 1 1 A 82 82 PRO HA H 436 4.364 4.889 -0.525 1
1 67 . 13 1 1 A 82 82 PRO C C 436 173.563 176.232 -2.669 1
1 68 . 13 1 1 A 82 82 PRO CA C 436 60.729 62.465 -1.736 1
1 69 . 13 1 1 A 82 82 PRO CB C 436 29.160 32.549 -3.389 1
1 953 . 13 1 1 A 82 82 PRO HA H 436 4.296 4.889 -0.593 1
1 960 . 13 1 1 A 82 82 PRO C C 436 173.494 176.232 -2.738 1
1 961 . 13 1 1 A 82 82 PRO CA C 436 60.625 62.465 -1.840 1
1 962 . 13 1 1 A 82 82 PRO CB C 436 29.237 32.549 -3.312 1
1 1 . 14 1 1 A 3 3 LEU HA H 357 4.257 4.159 0.098 1
1 11 . 14 1 1 A 3 3 LEU C C 357 174.994 176.208 -1.214 1
1 12 . 14 1 1 A 3 3 LEU CA C 357 53.329 57.544 -4.215 1
1 13 . 14 1 1 A 3 3 LEU CB C 357 39.382 42.584 -3.202 1
1 17 . 14 1 1 A 4 4 GLN H H 358 8.234 7.097 1.137 1
1 18 . 14 1 1 A 4 4 GLN HA H 358 4.211 4.609 -0.398 1
1 25 . 14 1 1 A 4 4 GLN C C 358 173.357 172.452 0.905 1
1 26 . 14 1 1 A 4 4 GLN CA C 358 53.791 54.500 -0.709 1
1 27 . 14 1 1 A 4 4 GLN CB C 358 26.456 29.215 -2.759 1
1 29 . 14 1 1 A 4 4 GLN N N 358 119.506 113.797 5.709 1
1 31 . 14 1 1 A 5 5 ASP H H 359 8.090 8.496 -0.406 1
1 32 . 14 1 1 A 5 5 ASP HA H 359 4.458 4.837 -0.379 1
1 35 . 14 1 1 A 5 5 ASP C C 359 173.492 174.859 -1.367 1
1 36 . 14 1 1 A 5 5 ASP CA C 359 52.309 53.124 -0.815 1
1 37 . 14 1 1 A 5 5 ASP CB C 359 38.312 40.739 -2.427 1
1 38 . 14 1 1 A 5 5 ASP N N 359 120.683 120.720 -0.037 1
1 39 . 14 1 1 A 6 6 HIS H H 360 8.103 8.345 -0.242 1
1 40 . 14 1 1 A 6 6 HIS HA H 360 4.540 4.698 -0.158 1
1 45 . 14 1 1 A 6 6 HIS C C 360 172.801 175.071 -2.270 1
1 46 . 14 1 1 A 6 6 HIS CA C 360 53.874 56.498 -2.624 1
1 47 . 14 1 1 A 6 6 HIS CB C 360 27.878 30.453 -2.575 1
1 50 . 14 1 1 A 6 6 HIS N N 360 118.844 124.369 -5.525 1
1 51 . 14 1 1 A 7 7 ILE H H 361 7.862 8.339 -0.477 1
1 52 . 14 1 1 A 7 7 ILE HA H 361 4.010 4.078 -0.068 1
1 62 . 14 1 1 A 7 7 ILE C C 361 173.268 175.203 -1.935 1
1 63 . 14 1 1 A 7 7 ILE CA C 361 58.740 62.169 -3.429 1
1 64 . 14 1 1 A 7 7 ILE CB C 361 35.788 37.172 -1.384 1
1 68 . 14 1 1 A 7 7 ILE N N 361 121.598 123.951 -2.353 1
1 69 . 14 1 1 A 8 8 LYS H H 362 8.231 8.816 -0.585 1
1 70 . 14 1 1 A 8 8 LYS HA H 362 4.313 4.973 -0.660 1
1 79 . 14 1 1 A 8 8 LYS C C 362 173.899 175.277 -1.378 1
1 80 . 14 1 1 A 8 8 LYS CA C 362 53.677 54.290 -0.613 1
1 81 . 14 1 1 A 8 8 LYS CB C 362 30.355 36.136 -5.781 1
1 85 . 14 1 1 A 8 8 LYS N N 362 124.980 129.334 -4.354 1
1 86 . 14 1 1 A 9 9 VAL H H 363 8.044 8.642 -0.598 1
1 87 . 14 1 1 A 9 9 VAL HA H 363 4.089 4.415 -0.326 1
1 95 . 14 1 1 A 9 9 VAL C C 363 173.760 175.160 -1.400 1
1 96 . 14 1 1 A 9 9 VAL CA C 363 59.814 63.042 -3.228 1
1 97 . 14 1 1 A 9 9 VAL CB C 363 30.058 31.390 -1.332 1
1 100 . 14 1 1 A 9 9 VAL N N 363 121.366 125.591 -4.225 1
1 101 . 14 1 1 A 10 10 THR H H 364 8.076 8.194 -0.118 1
1 102 . 14 1 1 A 10 10 THR HA H 364 4.302 4.563 -0.261 1
1 107 . 14 1 1 A 10 10 THR C C 364 172.135 176.080 -3.945 1
1 108 . 14 1 1 A 10 10 THR CA C 364 59.134 63.797 -4.663 1
1 109 . 14 1 1 A 10 10 THR CB C 364 67.415 70.684 -3.269 1
1 111 . 14 1 1 A 10 10 THR N N 364 116.817 123.580 -6.763 1
1 112 . 14 1 1 A 11 11 GLN H H 365 8.463 8.121 0.342 1
1 113 . 14 1 1 A 11 11 GLN HA H 365 4.046 4.286 -0.240 1
1 120 . 14 1 1 A 11 11 GLN C C 365 173.944 175.636 -1.692 1
1 121 . 14 1 1 A 11 11 GLN CA C 365 54.517 57.230 -2.713 1
1 122 . 14 1 1 A 11 11 GLN CB C 365 26.250 29.211 -2.961 1
1 124 . 14 1 1 A 11 11 GLN N N 365 122.059 117.702 4.357 1
1 126 . 14 1 1 A 12 12 GLU H H 366 8.449 7.651 0.798 1
1 127 . 14 1 1 A 12 12 GLU HA H 366 4.093 4.664 -0.571 1
1 132 . 14 1 1 A 12 12 GLU C C 366 174.746 175.784 -1.038 1
1 133 . 14 1 1 A 12 12 GLU CA C 366 55.235 55.989 -0.754 1
1 134 . 14 1 1 A 12 12 GLU CB C 366 27.180 33.294 -6.114 1
1 136 . 14 1 1 A 12 12 GLU N N 366 120.415 118.406 2.009 1
1 137 . 14 1 1 A 13 13 GLN H H 367 8.031 8.703 -0.672 1
1 138 . 14 1 1 A 13 13 GLN HA H 367 4.113 4.183 -0.070 1
1 145 . 14 1 1 A 13 13 GLN C C 367 173.693 176.848 -3.155 1
1 146 . 14 1 1 A 13 13 GLN CA C 367 54.132 57.348 -3.216 1
1 147 . 14 1 1 A 13 13 GLN CB C 367 26.420 29.384 -2.964 1
1 149 . 14 1 1 A 13 13 GLN N N 367 119.721 124.212 -4.491 1
1 151 . 14 1 1 A 14 14 TYR H H 368 8.111 8.258 -0.147 1
1 152 . 14 1 1 A 14 14 TYR HA H 368 4.339 4.592 -0.253 1
1 159 . 14 1 1 A 14 14 TYR C C 368 173.916 177.221 -3.305 1
1 160 . 14 1 1 A 14 14 TYR CA C 368 56.572 59.636 -3.064 1
1 161 . 14 1 1 A 14 14 TYR CB C 368 35.879 37.419 -1.540 1
1 164 . 14 1 1 A 14 14 TYR N N 368 120.541 118.037 2.504 1
1 165 . 14 1 1 A 15 15 GLU H H 369 8.287 8.393 -0.106 1
1 166 . 14 1 1 A 15 15 GLU HA H 369 4.009 4.323 -0.314 1
1 171 . 14 1 1 A 15 15 GLU C C 369 174.448 178.238 -3.790 1
1 172 . 14 1 1 A 15 15 GLU CA C 369 55.047 59.146 -4.099 1
1 173 . 14 1 1 A 15 15 GLU CB C 369 27.226 29.530 -2.304 1
1 175 . 14 1 1 A 15 15 GLU N N 369 120.398 122.820 -2.422 1
1 176 . 14 1 1 A 16 16 LEU H H 370 7.785 7.593 0.192 1
1 177 . 14 1 1 A 16 16 LEU HA H 370 4.138 4.318 -0.180 1
1 187 . 14 1 1 A 16 16 LEU C C 370 175.089 177.810 -2.721 1
1 188 . 14 1 1 A 16 16 LEU CA C 370 53.425 55.264 -1.839 1
1 189 . 14 1 1 A 16 16 LEU CB C 370 39.554 41.643 -2.089 1
1 193 . 14 1 1 A 16 16 LEU N N 370 121.323 117.261 4.062 1
1 194 . 14 1 1 A 17 17 TYR H H 371 8.038 7.863 0.175 1
1 195 . 14 1 1 A 17 17 TYR HA H 371 4.380 4.321 0.059 1
1 202 . 14 1 1 A 17 17 TYR C C 371 173.931 176.342 -2.411 1
1 203 . 14 1 1 A 17 17 TYR CA C 371 56.143 60.948 -4.805 1
1 204 . 14 1 1 A 17 17 TYR CB C 371 35.501 37.709 -2.208 1
1 207 . 14 1 1 A 17 17 TYR N N 371 119.465 120.368 -0.903 1
1 208 . 14 1 1 A 18 18 CYS H H 372 8.021 7.116 0.905 1
1 209 . 14 1 1 A 18 18 CYS HA H 372 4.236 3.737 0.499 1
1 212 . 14 1 1 A 18 18 CYS C C 372 172.457 174.909 -2.452 1
1 213 . 14 1 1 A 18 18 CYS CA C 372 56.997 61.352 -4.355 1
1 214 . 14 1 1 A 18 18 CYS CB C 372 25.080 26.198 -1.118 1
1 215 . 14 1 1 A 18 18 CYS N N 372 119.913 114.135 5.778 1
1 216 . 14 1 1 A 19 19 GLU H H 373 8.151 7.802 0.349 1
1 217 . 14 1 1 A 19 19 GLU HA H 373 4.130 4.530 -0.400 1
1 222 . 14 1 1 A 19 19 GLU C C 373 174.151 177.848 -3.697 1
1 223 . 14 1 1 A 19 19 GLU CA C 373 54.535 55.766 -1.231 1
1 224 . 14 1 1 A 19 19 GLU CB C 373 27.244 31.766 -4.522 1
1 226 . 14 1 1 A 19 19 GLU N N 373 122.431 117.818 4.613 1
1 227 . 14 1 1 A 20 20 MET H H 374 8.109 8.018 0.091 1
1 228 . 14 1 1 A 20 20 MET HA H 374 4.352 4.166 0.186 1
1 236 . 14 1 1 A 20 20 MET C C 374 174.200 175.087 -0.887 1
1 237 . 14 1 1 A 20 20 MET CA C 374 53.238 58.347 -5.109 1
1 238 . 14 1 1 A 20 20 MET CB C 374 30.237 30.632 -0.395 1
1 241 . 14 1 1 A 20 20 MET N N 374 119.754 115.497 4.257 1
1 242 . 14 1 1 A 21 21 GLY H H 375 8.231 8.152 0.079 1
1 243 . 14 1 1 A 21 21 GLY HA2 H 375 3.861 4.103 -0.242 1
1 244 . 14 1 1 A 21 21 GLY HA3 H 375 3.960 4.105 -0.145 1
1 245 . 14 1 1 A 21 21 GLY C C 375 171.928 172.365 -0.437 1
1 246 . 14 1 1 A 21 21 GLY CA C 375 42.930 44.167 -1.237 1
1 247 . 14 1 1 A 21 21 GLY N N 375 109.484 105.099 4.385 1
1 248 . 14 1 1 A 22 22 SER HA H 376 4.492 4.625 -0.133 1
1 251 . 14 1 1 A 22 22 SER C C 376 172.206 174.024 -1.818 1
1 252 . 14 1 1 A 22 22 SER CA C 376 55.570 59.449 -3.879 1
1 253 . 14 1 1 A 22 22 SER CB C 376 61.525 62.877 -1.352 1
1 254 . 14 1 1 A 23 23 THR H H 377 8.470 8.495 -0.025 1
1 255 . 14 1 1 A 23 23 THR HA H 377 4.295 4.608 -0.313 1
1 260 . 14 1 1 A 23 23 THR C C 377 171.811 173.888 -2.077 1
1 261 . 14 1 1 A 23 23 THR CA C 377 58.937 62.474 -3.537 1
1 262 . 14 1 1 A 23 23 THR CB C 377 67.250 69.766 -2.516 1
1 264 . 14 1 1 A 23 23 THR N N 377 124.043 122.597 1.446 1
1 265 . 14 1 1 A 24 24 PHE H H 378 8.374 8.631 -0.257 1
1 266 . 14 1 1 A 24 24 PHE HA H 378 4.239 4.445 -0.206 1
1 273 . 14 1 1 A 24 24 PHE C C 378 173.411 176.162 -2.751 1
1 274 . 14 1 1 A 24 24 PHE CA C 378 56.697 59.658 -2.961 1
1 275 . 14 1 1 A 24 24 PHE CB C 378 36.538 39.377 -2.839 1
1 278 . 14 1 1 A 24 24 PHE N N 378 124.732 126.592 -1.860 1
1 279 . 14 1 1 A 25 25 GLN H H 379 8.457 8.011 0.446 1
1 280 . 14 1 1 A 25 25 GLN HA H 379 4.038 3.651 0.387 1
1 287 . 14 1 1 A 25 25 GLN C C 379 172.431 175.201 -2.770 1
1 288 . 14 1 1 A 25 25 GLN CA C 379 54.078 58.325 -4.247 1
1 289 . 14 1 1 A 25 25 GLN CB C 379 26.414 27.078 -0.664 1
1 291 . 14 1 1 A 25 25 GLN N N 379 118.820 119.536 -0.716 1
1 293 . 14 1 1 A 26 26 LEU H H 380 6.985 8.019 -1.034 1
1 294 . 14 1 1 A 26 26 LEU HA H 380 4.229 4.349 -0.120 1
1 304 . 14 1 1 A 26 26 LEU C C 380 173.895 176.806 -2.911 1
1 305 . 14 1 1 A 26 26 LEU CA C 380 52.123 55.408 -3.285 1
1 306 . 14 1 1 A 26 26 LEU CB C 380 40.543 42.142 -1.599 1
1 310 . 14 1 1 A 26 26 LEU N N 380 119.079 120.543 -1.464 1
1 311 . 14 1 1 A 27 27 CYS H H 381 8.905 9.211 -0.306 1
1 312 . 14 1 1 A 27 27 CYS HA H 381 4.013 4.569 -0.556 1
1 315 . 14 1 1 A 27 27 CYS C C 381 174.439 176.108 -1.669 1
1 316 . 14 1 1 A 27 27 CYS CA C 381 57.847 58.833 -0.986 1
1 317 . 14 1 1 A 27 27 CYS CB C 381 28.648 28.257 0.391 1
1 318 . 14 1 1 A 27 27 CYS N N 381 125.151 123.957 1.194 1
1 319 . 14 1 1 A 28 28 LYS H H 382 9.351 8.903 0.448 1
1 320 . 14 1 1 A 28 28 LYS HA H 382 4.157 4.156 0.001 1
1 329 . 14 1 1 A 28 28 LYS C C 382 174.678 178.626 -3.948 1
1 330 . 14 1 1 A 28 28 LYS CA C 382 54.324 58.530 -4.206 1
1 331 . 14 1 1 A 28 28 LYS CB C 382 30.086 32.369 -2.283 1
1 335 . 14 1 1 A 28 28 LYS N N 382 128.840 127.679 1.161 1
1 336 . 14 1 1 A 29 29 ILE H H 383 9.040 7.823 1.217 1
1 337 . 14 1 1 A 29 29 ILE HA H 383 3.804 3.865 -0.061 1
1 347 . 14 1 1 A 29 29 ILE C C 383 174.239 177.350 -3.111 1
1 348 . 14 1 1 A 29 29 ILE CA C 383 62.114 63.987 -1.873 1
1 349 . 14 1 1 A 29 29 ILE CB C 383 33.870 37.736 -3.866 1
1 353 . 14 1 1 A 29 29 ILE N N 383 122.718 119.276 3.442 1
1 354 . 14 1 1 A 30 30 CYS H H 384 7.572 7.609 -0.037 1
1 355 . 14 1 1 A 30 30 CYS HA H 384 4.548 4.573 -0.025 1
1 358 . 14 1 1 A 30 30 CYS C C 384 172.978 175.197 -2.219 1
1 359 . 14 1 1 A 30 30 CYS CA C 384 54.957 59.268 -4.311 1
1 360 . 14 1 1 A 30 30 CYS CB C 384 29.778 29.873 -0.095 1
1 361 . 14 1 1 A 30 30 CYS N N 384 116.356 116.637 -0.281 1
1 362 . 14 1 1 A 31 31 ALA H H 385 8.205 8.744 -0.539 1
1 363 . 14 1 1 A 31 31 ALA HA H 385 4.107 4.124 -0.017 1
1 367 . 14 1 1 A 31 31 ALA C C 385 173.139 177.256 -4.117 1
1 368 . 14 1 1 A 31 31 ALA CA C 385 50.802 53.564 -2.762 1
1 369 . 14 1 1 A 31 31 ALA CB C 385 14.634 17.957 -3.323 1
1 370 . 14 1 1 A 31 31 ALA N N 385 125.526 121.277 4.249 1
1 371 . 14 1 1 A 32 32 GLU H H 386 8.416 8.181 0.235 1
1 372 . 14 1 1 A 32 32 GLU HA H 386 4.467 4.403 0.064 1
1 377 . 14 1 1 A 32 32 GLU C C 386 172.325 176.059 -3.734 1
1 378 . 14 1 1 A 32 32 GLU CA C 386 55.146 56.833 -1.687 1
1 379 . 14 1 1 A 32 32 GLU CB C 386 31.181 32.383 -1.202 1
1 381 . 14 1 1 A 32 32 GLU N N 386 117.579 114.959 2.620 1
1 382 . 14 1 1 A 33 33 ASN H H 387 7.872 7.844 0.028 1
1 383 . 14 1 1 A 33 33 ASN HA H 387 4.900 4.908 -0.008 1
1 388 . 14 1 1 A 33 33 ASN C C 387 171.355 174.750 -3.395 1
1 389 . 14 1 1 A 33 33 ASN CA C 387 49.320 52.157 -2.837 1
1 390 . 14 1 1 A 33 33 ASN CB C 387 38.457 39.816 -1.359 1
1 391 . 14 1 1 A 33 33 ASN N N 387 120.399 116.839 3.560 1
1 393 . 14 1 1 A 34 34 ASP H H 388 8.565 8.603 -0.038 1
1 394 . 14 1 1 A 34 34 ASP HA H 388 4.679 4.851 -0.172 1
1 397 . 14 1 1 A 34 34 ASP C C 388 174.243 176.604 -2.361 1
1 398 . 14 1 1 A 34 34 ASP CA C 388 51.809 53.324 -1.515 1
1 399 . 14 1 1 A 34 34 ASP CB C 388 38.007 42.252 -4.245 1
1 400 . 14 1 1 A 34 34 ASP N N 388 120.661 120.568 0.093 1
1 401 . 14 1 1 A 35 35 LYS H H 389 8.544 9.261 -0.717 1
1 402 . 14 1 1 A 35 35 LYS HA H 389 3.411 4.219 -0.808 1
1 409 . 14 1 1 A 35 35 LYS C C 389 172.938 176.206 -3.268 1
1 410 . 14 1 1 A 35 35 LYS CA C 389 54.973 56.861 -1.888 1
1 411 . 14 1 1 A 35 35 LYS CB C 389 30.617 31.972 -1.355 1
1 415 . 14 1 1 A 35 35 LYS N N 389 119.199 121.410 -2.211 1
1 416 . 14 1 1 A 36 36 ASP H H 390 8.327 9.201 -0.874 1
1 417 . 14 1 1 A 36 36 ASP HA H 390 4.724 4.765 -0.041 1
1 420 . 14 1 1 A 36 36 ASP C C 390 172.860 175.420 -2.560 1
1 421 . 14 1 1 A 36 36 ASP CA C 390 51.609 54.693 -3.084 1
1 422 . 14 1 1 A 36 36 ASP CB C 390 39.018 42.732 -3.714 1
1 423 . 14 1 1 A 36 36 ASP N N 390 119.134 126.549 -7.415 1
1 424 . 14 1 1 A 37 37 VAL H H 391 8.544 8.255 0.289 1
1 425 . 14 1 1 A 37 37 VAL HA H 391 4.877 4.793 0.084 1
1 433 . 14 1 1 A 37 37 VAL C C 391 167.519 173.371 -5.852 1
1 434 . 14 1 1 A 37 37 VAL CA C 391 58.259 59.973 -1.714 1
1 435 . 14 1 1 A 37 37 VAL CB C 391 32.277 35.382 -3.105 1
1 438 . 14 1 1 A 37 37 VAL N N 391 121.970 117.678 4.292 1
1 439 . 14 1 1 A 38 38 LYS H H 392 8.621 9.487 -0.866 1
1 440 . 14 1 1 A 38 38 LYS HA H 392 4.991 5.243 -0.252 1
1 449 . 14 1 1 A 38 38 LYS C C 392 172.681 175.195 -2.514 1
1 450 . 14 1 1 A 38 38 LYS CA C 392 51.123 54.682 -3.559 1
1 451 . 14 1 1 A 38 38 LYS CB C 392 33.697 34.676 -0.979 1
1 455 . 14 1 1 A 38 38 LYS N N 392 126.381 128.643 -2.262 1
1 456 . 14 1 1 A 39 39 ILE H H 393 8.723 9.003 -0.280 1
1 457 . 14 1 1 A 39 39 ILE HA H 393 4.239 4.361 -0.122 1
1 467 . 14 1 1 A 39 39 ILE C C 393 172.642 175.748 -3.106 1
1 468 . 14 1 1 A 39 39 ILE CA C 393 57.768 61.085 -3.317 1
1 469 . 14 1 1 A 39 39 ILE CB C 393 35.691 37.569 -1.878 1
1 473 . 14 1 1 A 39 39 ILE N N 393 126.398 127.768 -1.370 1
1 474 . 14 1 1 A 40 40 GLU H H 394 8.506 9.430 -0.924 1
1 475 . 14 1 1 A 40 40 GLU HA H 394 4.753 4.721 0.032 1
1 480 . 14 1 1 A 40 40 GLU C C 394 173.596 176.200 -2.604 1
1 481 . 14 1 1 A 40 40 GLU CA C 394 49.793 53.341 -3.548 1
1 482 . 14 1 1 A 40 40 GLU CB C 394 28.210 30.702 -2.492 1
1 484 . 14 1 1 A 40 40 GLU N N 394 124.864 128.027 -3.163 1
1 485 . 14 1 1 A 41 41 PRO HA H 395 4.864 4.505 0.359 1
1 492 . 14 1 1 A 41 41 PRO C C 395 175.073 177.061 -1.988 1
1 493 . 14 1 1 A 41 41 PRO CA C 395 61.111 63.880 -2.769 1
1 494 . 14 1 1 A 41 41 PRO CB C 395 32.275 33.001 -0.726 1
1 497 . 14 1 1 A 42 42 CYS H H 396 7.828 7.835 -0.007 1
1 498 . 14 1 1 A 42 42 CYS HA H 396 4.208 4.057 0.151 1
1 501 . 14 1 1 A 42 42 CYS C C 396 173.877 175.055 -1.178 1
1 502 . 14 1 1 A 42 42 CYS CA C 396 58.021 61.437 -3.416 1
1 503 . 14 1 1 A 42 42 CYS CB C 396 28.242 27.436 0.806 1
1 504 . 14 1 1 A 42 42 CYS N N 396 122.434 117.854 4.580 1
1 505 . 14 1 1 A 43 43 GLY H H 397 8.679 8.714 -0.035 1
1 506 . 14 1 1 A 43 43 GLY HA2 H 397 3.507 3.959 -0.452 1
1 507 . 14 1 1 A 43 43 GLY HA3 H 397 3.914 3.960 -0.046 1
1 508 . 14 1 1 A 43 43 GLY C C 397 171.981 175.137 -3.156 1
1 509 . 14 1 1 A 43 43 GLY CA C 397 43.347 45.649 -2.302 1
1 510 . 14 1 1 A 43 43 GLY N N 397 112.123 108.306 3.817 1
1 511 . 14 1 1 A 44 44 HIS H H 398 8.329 7.870 0.459 1
1 512 . 14 1 1 A 44 44 HIS HA H 398 4.339 4.429 -0.090 1
1 517 . 14 1 1 A 44 44 HIS C C 398 170.742 174.783 -4.041 1
1 518 . 14 1 1 A 44 44 HIS CA C 398 58.368 56.734 1.634 1
1 519 . 14 1 1 A 44 44 HIS CB C 398 28.434 30.792 -2.358 1
1 522 . 14 1 1 A 44 44 HIS N N 398 121.393 118.397 2.996 1
1 523 . 14 1 1 A 45 45 LEU H H 399 8.241 8.693 -0.452 1
1 524 . 14 1 1 A 45 45 LEU HA H 399 5.570 5.225 0.345 1
1 534 . 14 1 1 A 45 45 LEU C C 399 174.464 175.361 -0.897 1
1 535 . 14 1 1 A 45 45 LEU CA C 399 50.729 53.404 -2.675 1
1 536 . 14 1 1 A 45 45 LEU CB C 399 43.574 44.786 -1.212 1
1 540 . 14 1 1 A 45 45 LEU N N 399 118.469 122.839 -4.370 1
1 541 . 14 1 1 A 46 46 MET H H 400 8.707 8.881 -0.174 1
1 542 . 14 1 1 A 46 46 MET HA H 400 4.842 5.015 -0.173 1
1 550 . 14 1 1 A 46 46 MET C C 400 170.736 174.556 -3.820 1
1 551 . 14 1 1 A 46 46 MET CA C 400 52.804 54.037 -1.233 1
1 552 . 14 1 1 A 46 46 MET CB C 400 31.945 35.369 -3.424 1
1 555 . 14 1 1 A 46 46 MET N N 400 114.897 120.312 -5.415 1
1 556 . 14 1 1 A 47 47 CYS H H 401 9.436 8.425 1.011 1
1 557 . 14 1 1 A 47 47 CYS HA H 401 5.629 4.795 0.834 1
1 560 . 14 1 1 A 47 47 CYS C C 401 173.909 176.316 -2.407 1
1 561 . 14 1 1 A 47 47 CYS CA C 401 54.325 57.080 -2.755 1
1 562 . 14 1 1 A 47 47 CYS CB C 401 30.725 29.329 1.396 1
1 563 . 14 1 1 A 47 47 CYS N N 401 119.575 119.165 0.410 1
1 564 . 14 1 1 A 48 48 THR H H 402 9.842 8.892 0.950 1
1 565 . 14 1 1 A 48 48 THR HA H 402 3.768 4.004 -0.236 1
1 570 . 14 1 1 A 48 48 THR C C 402 174.333 176.336 -2.003 1
1 571 . 14 1 1 A 48 48 THR CA C 402 64.516 65.876 -1.360 1
1 572 . 14 1 1 A 48 48 THR CB C 402 66.288 68.650 -2.362 1
1 574 . 14 1 1 A 48 48 THR N N 402 119.945 119.052 0.893 1
1 575 . 14 1 1 A 49 49 SER H H 403 8.355 8.033 0.322 1
1 576 . 14 1 1 A 49 49 SER HA H 403 4.222 4.088 0.134 1
1 579 . 14 1 1 A 49 49 SER C C 403 175.059 176.356 -1.297 1
1 580 . 14 1 1 A 49 49 SER CA C 403 59.828 61.997 -2.169 1
1 581 . 14 1 1 A 49 49 SER CB C 403 59.717 62.888 -3.171 1
1 582 . 14 1 1 A 49 49 SER N N 403 120.468 117.351 3.117 1
1 583 . 14 1 1 A 50 50 CYS H H 404 9.464 7.894 1.570 1
1 584 . 14 1 1 A 50 50 CYS HA H 404 3.922 4.381 -0.459 1
1 587 . 14 1 1 A 50 50 CYS C C 404 176.081 177.067 -0.986 1
1 588 . 14 1 1 A 50 50 CYS CA C 404 63.076 63.707 -0.631 1
1 589 . 14 1 1 A 50 50 CYS CB C 404 26.078 27.835 -1.757 1
1 590 . 14 1 1 A 50 50 CYS N N 404 126.744 119.760 6.984 1
1 591 . 14 1 1 A 51 51 LEU H H 405 7.948 8.061 -0.113 1
1 592 . 14 1 1 A 51 51 LEU HA H 405 4.064 4.180 -0.116 1
1 602 . 14 1 1 A 51 51 LEU C C 405 175.495 178.857 -3.362 1
1 603 . 14 1 1 A 51 51 LEU CA C 405 55.914 57.906 -1.992 1
1 604 . 14 1 1 A 51 51 LEU CB C 405 38.662 41.831 -3.169 1
1 607 . 14 1 1 A 51 51 LEU N N 405 121.951 122.483 -0.532 1
1 608 . 14 1 1 A 52 52 THR H H 406 8.786 8.532 0.254 1
1 609 . 14 1 1 A 52 52 THR HA H 406 4.024 3.931 0.093 1
1 614 . 14 1 1 A 52 52 THR C C 406 174.139 176.225 -2.086 1
1 615 . 14 1 1 A 52 52 THR CA C 406 64.017 66.037 -2.020 1
1 616 . 14 1 1 A 52 52 THR CB C 406 66.115 68.575 -2.460 1
1 618 . 14 1 1 A 52 52 THR N N 406 115.258 115.833 -0.575 1
1 619 . 14 1 1 A 53 53 SER H H 407 8.115 8.151 -0.036 1
1 620 . 14 1 1 A 53 53 SER HA H 407 4.204 4.404 -0.200 1
1 623 . 14 1 1 A 53 53 SER C C 407 174.456 176.094 -1.638 1
1 624 . 14 1 1 A 53 53 SER CA C 407 59.090 62.842 -3.752 1
1 625 . 14 1 1 A 53 53 SER CB C 407 60.146 63.578 -3.432 1
1 626 . 14 1 1 A 53 53 SER N N 407 116.852 116.761 0.091 1
1 627 . 14 1 1 A 54 54 TRP H H 408 8.123 7.726 0.397 1
1 628 . 14 1 1 A 54 54 TRP HA H 408 4.371 4.297 0.074 1
1 637 . 14 1 1 A 54 54 TRP C C 408 175.981 178.694 -2.713 1
1 638 . 14 1 1 A 54 54 TRP CA C 408 57.323 60.700 -3.377 1
1 639 . 14 1 1 A 54 54 TRP CB C 408 26.812 29.518 -2.706 1
1 645 . 14 1 1 A 54 54 TRP N N 408 123.556 123.482 0.074 1
1 647 . 14 1 1 A 55 55 GLN H H 409 8.502 8.491 0.011 1
1 648 . 14 1 1 A 55 55 GLN HA H 409 3.999 3.670 0.329 1
1 655 . 14 1 1 A 55 55 GLN C C 409 177.300 178.275 -0.975 1
1 656 . 14 1 1 A 55 55 GLN CA C 409 56.484 59.163 -2.679 1
1 657 . 14 1 1 A 55 55 GLN CB C 409 26.190 28.300 -2.110 1
1 659 . 14 1 1 A 55 55 GLN N N 409 118.044 117.956 0.088 1
1 661 . 14 1 1 A 56 56 GLU H H 410 8.467 8.975 -0.508 1
1 662 . 14 1 1 A 56 56 GLU HA H 410 4.057 4.139 -0.082 1
1 667 . 14 1 1 A 56 56 GLU C C 410 174.787 176.940 -2.153 1
1 668 . 14 1 1 A 56 56 GLU CA C 410 55.909 58.374 -2.465 1
1 669 . 14 1 1 A 56 56 GLU CB C 410 26.895 28.230 -1.335 1
1 671 . 14 1 1 A 56 56 GLU N N 410 119.448 118.713 0.735 1
1 672 . 14 1 1 A 57 57 SER H H 411 7.438 7.324 0.114 1
1 673 . 14 1 1 A 57 57 SER HA H 411 4.607 4.553 0.054 1
1 676 . 14 1 1 A 57 57 SER C C 411 170.849 173.873 -3.024 1
1 677 . 14 1 1 A 57 57 SER CA C 411 55.540 57.642 -2.102 1
1 678 . 14 1 1 A 57 57 SER CB C 411 60.928 63.085 -2.157 1
1 679 . 14 1 1 A 57 57 SER N N 411 113.752 114.753 -1.001 1
1 680 . 14 1 1 A 58 58 GLU H H 412 7.855 7.601 0.254 1
1 681 . 14 1 1 A 58 58 GLU HA H 412 3.772 3.954 -0.182 1
1 686 . 14 1 1 A 58 58 GLU C C 412 173.743 175.225 -1.482 1
1 687 . 14 1 1 A 58 58 GLU CA C 412 54.442 56.955 -2.513 1
1 688 . 14 1 1 A 58 58 GLU CB C 412 24.603 28.351 -3.748 1
1 690 . 14 1 1 A 58 58 GLU N N 412 115.908 117.472 -1.564 1
1 691 . 14 1 1 A 59 59 GLY H H 413 7.588 8.240 -0.652 1
1 692 . 14 1 1 A 59 59 GLY HA2 H 413 1.643 2.570 -0.927 1
1 693 . 14 1 1 A 59 59 GLY HA3 H 413 2.949 3.326 -0.377 1
1 694 . 14 1 1 A 59 59 GLY C C 413 170.850 171.917 -1.067 1
1 695 . 14 1 1 A 59 59 GLY CA C 413 41.724 44.081 -2.357 1
1 696 . 14 1 1 A 59 59 GLY N N 413 108.032 110.442 -2.410 1
1 697 . 14 1 1 A 60 60 GLN H H 414 7.973 8.665 -0.692 1
1 698 . 14 1 1 A 60 60 GLN HA H 414 4.366 4.756 -0.390 1
1 705 . 14 1 1 A 60 60 GLN C C 414 173.108 175.277 -2.169 1
1 706 . 14 1 1 A 60 60 GLN CA C 414 52.422 55.238 -2.816 1
1 707 . 14 1 1 A 60 60 GLN CB C 414 27.049 30.222 -3.173 1
1 709 . 14 1 1 A 60 60 GLN N N 414 122.690 124.999 -2.309 1
1 711 . 14 1 1 A 61 61 GLY H H 415 8.301 8.308 -0.007 1
1 712 . 14 1 1 A 61 61 GLY HA2 H 415 3.700 4.285 -0.585 1
1 713 . 14 1 1 A 61 61 GLY HA3 H 415 3.920 4.324 -0.404 1
1 714 . 14 1 1 A 61 61 GLY C C 415 170.249 174.213 -3.964 1
1 715 . 14 1 1 A 61 61 GLY CA C 415 42.210 44.514 -2.304 1
1 716 . 14 1 1 A 61 61 GLY N N 415 110.794 113.795 -3.001 1
1 717 . 14 1 1 A 62 62 CYS H H 416 8.549 8.429 0.120 1
1 718 . 14 1 1 A 62 62 CYS HA H 416 4.227 4.647 -0.420 1
1 721 . 14 1 1 A 62 62 CYS C C 416 172.914 175.476 -2.562 1
1 722 . 14 1 1 A 62 62 CYS CA C 416 54.008 58.687 -4.679 1
1 723 . 14 1 1 A 62 62 CYS CB C 416 29.716 27.563 2.153 1
1 724 . 14 1 1 A 62 62 CYS N N 416 123.683 121.321 2.362 1
1 725 . 14 1 1 A 63 63 PRO HA H 417 2.611 3.150 -0.539 1
1 732 . 14 1 1 A 63 63 PRO C C 417 174.143 178.468 -4.325 1
1 733 . 14 1 1 A 63 63 PRO CA C 417 61.689 64.277 -2.588 1
1 734 . 14 1 1 A 63 63 PRO CB C 417 28.534 31.265 -2.731 1
1 737 . 14 1 1 A 64 64 PHE H H 418 8.968 7.807 1.161 1
1 738 . 14 1 1 A 64 64 PHE HA H 418 4.250 4.095 0.155 1
1 746 . 14 1 1 A 64 64 PHE C C 418 174.243 176.863 -2.620 1
1 747 . 14 1 1 A 64 64 PHE CA C 418 56.720 60.435 -3.715 1
1 748 . 14 1 1 A 64 64 PHE CB C 418 36.458 38.913 -2.455 1
1 752 . 14 1 1 A 64 64 PHE N N 418 117.008 116.121 0.887 1
1 753 . 14 1 1 A 65 65 CYS H H 419 7.968 8.100 -0.132 1
1 754 . 14 1 1 A 65 65 CYS HA H 419 4.906 4.642 0.264 1
1 757 . 14 1 1 A 65 65 CYS C C 419 173.198 173.800 -0.602 1
1 758 . 14 1 1 A 65 65 CYS CA C 419 55.870 58.402 -2.532 1
1 759 . 14 1 1 A 65 65 CYS CB C 419 30.559 28.352 2.207 1
1 760 . 14 1 1 A 65 65 CYS N N 419 117.505 115.956 1.549 1
1 761 . 14 1 1 A 66 66 ARG H H 420 8.761 8.256 0.505 1
1 762 . 14 1 1 A 66 66 ARG HA H 420 4.365 4.183 0.182 1
1 769 . 14 1 1 A 66 66 ARG C C 420 172.921 174.866 -1.945 1
1 770 . 14 1 1 A 66 66 ARG CA C 420 54.763 56.977 -2.214 1
1 771 . 14 1 1 A 66 66 ARG CB C 420 24.286 28.157 -3.871 1
1 774 . 14 1 1 A 66 66 ARG N N 420 118.763 117.923 0.840 1
1 775 . 14 1 1 A 67 67 CYS H H 421 8.223 7.788 0.435 1
1 776 . 14 1 1 A 67 67 CYS HA H 421 4.419 5.038 -0.619 1
1 779 . 14 1 1 A 67 67 CYS C C 421 171.160 173.788 -2.628 1
1 780 . 14 1 1 A 67 67 CYS CA C 421 57.119 57.044 0.075 1
1 781 . 14 1 1 A 67 67 CYS CB C 421 25.911 31.013 -5.102 1
1 782 . 14 1 1 A 67 67 CYS N N 421 120.627 115.045 5.582 1
1 783 . 14 1 1 A 68 68 GLU H H 422 8.416 8.543 -0.127 1
1 784 . 14 1 1 A 68 68 GLU HA H 422 4.025 4.149 -0.124 1
1 789 . 14 1 1 A 68 68 GLU C C 422 173.764 176.215 -2.451 1
1 790 . 14 1 1 A 68 68 GLU CA C 422 54.752 57.559 -2.807 1
1 791 . 14 1 1 A 68 68 GLU CB C 422 27.302 29.749 -2.447 1
1 793 . 14 1 1 A 68 68 GLU N N 422 122.370 121.407 0.963 1
1 794 . 14 1 1 A 69 69 ILE H H 423 8.648 8.886 -0.238 1
1 795 . 14 1 1 A 69 69 ILE HA H 423 4.012 4.529 -0.517 1
1 805 . 14 1 1 A 69 69 ILE C C 423 174.257 175.606 -1.349 1
1 806 . 14 1 1 A 69 69 ILE CA C 423 59.740 60.648 -0.908 1
1 807 . 14 1 1 A 69 69 ILE CB C 423 35.846 38.810 -2.964 1
1 811 . 14 1 1 A 69 69 ILE N N 423 125.988 125.374 0.614 1
1 812 . 14 1 1 A 70 70 LYS H H 424 9.185 9.546 -0.361 1
1 813 . 14 1 1 A 70 70 LYS HA H 424 4.434 4.395 0.039 1
1 822 . 14 1 1 A 70 70 LYS C C 424 173.880 176.506 -2.626 1
1 823 . 14 1 1 A 70 70 LYS CA C 424 53.378 57.248 -3.870 1
1 824 . 14 1 1 A 70 70 LYS CB C 424 30.397 33.868 -3.471 1
1 828 . 14 1 1 A 70 70 LYS N N 424 128.977 129.837 -0.860 1
1 829 . 14 1 1 A 71 71 GLY H H 425 7.810 7.459 0.351 1
1 830 . 14 1 1 A 71 71 GLY HA2 H 425 4.094 4.065 0.029 1
1 831 . 14 1 1 A 71 71 GLY HA3 H 425 4.159 4.067 0.092 1
1 832 . 14 1 1 A 71 71 GLY C C 425 168.179 172.368 -4.189 1
1 833 . 14 1 1 A 71 71 GLY CA C 425 42.326 44.978 -2.652 1
1 834 . 14 1 1 A 71 71 GLY N N 425 107.696 106.183 1.513 1
1 835 . 14 1 1 A 72 72 THR H H 426 8.048 8.685 -0.637 1
1 836 . 14 1 1 A 72 72 THR HA H 426 5.258 5.522 -0.264 1
1 841 . 14 1 1 A 72 72 THR C C 426 170.979 172.336 -1.357 1
1 842 . 14 1 1 A 72 72 THR CA C 426 56.755 59.847 -3.092 1
1 843 . 14 1 1 A 72 72 THR CB C 426 69.226 71.464 -2.238 1
1 845 . 14 1 1 A 72 72 THR N N 426 109.122 110.992 -1.870 1
1 846 . 14 1 1 A 73 73 GLU H H 427 8.912 9.362 -0.450 1
1 847 . 14 1 1 A 73 73 GLU HA H 427 4.954 4.910 0.044 1
1 852 . 14 1 1 A 73 73 GLU C C 427 170.353 174.617 -4.264 1
1 853 . 14 1 1 A 73 73 GLU CA C 427 50.182 53.004 -2.822 1
1 854 . 14 1 1 A 73 73 GLU CB C 427 30.559 33.236 -2.677 1
1 856 . 14 1 1 A 73 73 GLU N N 427 121.703 124.259 -2.556 1
1 1 . 14 1 1 A 74 74 PRO HA H 428 4.372 4.851 -0.479 1
1 2 . 14 1 1 A 74 74 PRO C C 428 173.839 176.014 -2.175 1
1 3 . 14 1 1 A 74 74 PRO CA C 428 60.241 62.499 -2.258 1
1 4 . 14 1 1 A 74 74 PRO CB C 428 29.299 32.334 -3.035 1
1 857 . 14 1 1 A 74 74 PRO HA H 428 4.782 4.851 -0.069 1
1 864 . 14 1 1 A 74 74 PRO C C 428 174.027 176.014 -1.987 1
1 865 . 14 1 1 A 74 74 PRO CA C 428 59.771 62.499 -2.728 1
1 866 . 14 1 1 A 74 74 PRO CB C 428 29.633 32.334 -2.701 1
1 7 . 14 1 1 A 75 75 ILE H H 429 8.144 8.770 -0.626 1
1 8 . 14 1 1 A 75 75 ILE HA H 429 4.086 4.780 -0.694 1
1 15 . 14 1 1 A 75 75 ILE C C 429 173.426 175.124 -1.698 1
1 16 . 14 1 1 A 75 75 ILE CA C 429 58.339 60.113 -1.774 1
1 17 . 14 1 1 A 75 75 ILE CB C 429 35.988 40.310 -4.322 1
1 21 . 14 1 1 A 75 75 ILE N N 429 121.551 121.485 0.066 1
1 869 . 14 1 1 A 75 75 ILE H H 429 7.682 8.770 -1.088 1
1 870 . 14 1 1 A 75 75 ILE HA H 429 4.282 4.780 -0.498 1
1 880 . 14 1 1 A 75 75 ILE C C 429 172.510 175.124 -2.614 1
1 881 . 14 1 1 A 75 75 ILE CA C 429 57.456 60.113 -2.657 1
1 882 . 14 1 1 A 75 75 ILE CB C 429 37.903 40.310 -2.407 1
1 886 . 14 1 1 A 75 75 ILE N N 429 119.651 121.485 -1.834 1
1 1 . 14 1 1 A 76 76 VAL HA H 430 4.086 4.362 -0.276 1
1 2 . 14 1 1 A 76 76 VAL CA C 430 59.372 60.956 -1.584 1
1 22 . 14 1 1 A 76 76 VAL H H 430 8.221 8.667 -0.446 1
1 23 . 14 1 1 A 76 76 VAL HA H 430 4.083 4.362 -0.279 1
1 24 . 14 1 1 A 76 76 VAL C C 430 173.067 176.011 -2.944 1
1 25 . 14 1 1 A 76 76 VAL CA C 430 59.445 60.956 -1.511 1
1 26 . 14 1 1 A 76 76 VAL CB C 430 30.407 32.096 -1.689 1
1 27 . 14 1 1 A 76 76 VAL N N 430 125.930 123.231 2.699 1
1 887 . 14 1 1 A 76 76 VAL H H 430 8.122 8.667 -0.545 1
1 888 . 14 1 1 A 76 76 VAL HA H 430 4.197 4.362 -0.165 1
1 890 . 14 1 1 A 76 76 VAL C C 430 172.971 176.011 -3.040 1
1 891 . 14 1 1 A 76 76 VAL CA C 430 58.821 60.956 -2.135 1
1 892 . 14 1 1 A 76 76 VAL CB C 430 30.807 32.096 -1.289 1
1 895 . 14 1 1 A 76 76 VAL N N 430 124.178 123.231 0.947 1
1 4 . 14 1 1 A 77 77 VAL H H 431 8.204 8.420 -0.216 1
1 5 . 14 1 1 A 77 77 VAL HA H 431 4.049 4.261 -0.212 1
1 6 . 14 1 1 A 77 77 VAL C C 431 172.636 175.214 -2.578 1
1 7 . 14 1 1 A 77 77 VAL CA C 431 59.315 62.687 -3.372 1
1 8 . 14 1 1 A 77 77 VAL CB C 431 30.219 32.047 -1.828 1
1 9 . 14 1 1 A 77 77 VAL N N 431 125.320 123.909 1.411 1
1 28 . 14 1 1 A 77 77 VAL H H 431 8.412 8.420 -0.008 1
1 29 . 14 1 1 A 77 77 VAL HA H 431 4.038 4.261 -0.223 1
1 37 . 14 1 1 A 77 77 VAL C C 431 172.617 175.214 -2.597 1
1 38 . 14 1 1 A 77 77 VAL CA C 431 59.137 62.687 -3.550 1
1 39 . 14 1 1 A 77 77 VAL CB C 431 30.292 32.047 -1.755 1
1 42 . 14 1 1 A 77 77 VAL N N 431 125.655 123.909 1.746 1
1 896 . 14 1 1 A 77 77 VAL H H 431 8.448 8.420 0.028 1
1 897 . 14 1 1 A 77 77 VAL HA H 431 4.087 4.261 -0.174 1
1 905 . 14 1 1 A 77 77 VAL C C 431 172.493 175.214 -2.721 1
1 906 . 14 1 1 A 77 77 VAL CA C 431 59.185 62.687 -3.502 1
1 907 . 14 1 1 A 77 77 VAL CB C 431 30.084 32.047 -1.963 1
1 910 . 14 1 1 A 77 77 VAL N N 431 125.770 123.909 1.861 1
1 43 . 14 1 1 A 78 78 ASP H H 432 8.419 7.805 0.614 1
1 44 . 14 1 1 A 78 78 ASP HA H 432 4.829 5.104 -0.275 1
1 45 . 14 1 1 A 78 78 ASP C C 432 172.252 175.596 -3.344 1
1 46 . 14 1 1 A 78 78 ASP CA C 432 49.320 50.538 -1.218 1
1 47 . 14 1 1 A 78 78 ASP CB C 432 39.066 43.964 -4.898 1
1 48 . 14 1 1 A 78 78 ASP N N 432 126.226 122.736 3.490 1
1 911 . 14 1 1 A 78 78 ASP H H 432 8.493 7.805 0.688 1
1 912 . 14 1 1 A 78 78 ASP HA H 432 4.852 5.104 -0.252 1
1 915 . 14 1 1 A 78 78 ASP C C 432 172.048 175.596 -3.548 1
1 916 . 14 1 1 A 78 78 ASP CA C 432 49.233 50.538 -1.305 1
1 917 . 14 1 1 A 78 78 ASP CB C 432 38.858 43.964 -5.106 1
1 918 . 14 1 1 A 78 78 ASP N N 432 126.705 122.736 3.969 1
1 10 . 14 1 1 A 79 79 PRO CA C 433 63.865 65.253 -1.388 1
1 49 . 14 1 1 A 79 79 PRO C C 433 173.867 177.350 -3.483 1
1 919 . 14 1 1 A 79 79 PRO HA H 433 4.237 4.375 -0.138 1
1 926 . 14 1 1 A 79 79 PRO C C 433 173.812 177.350 -3.538 1
1 927 . 14 1 1 A 79 79 PRO CA C 433 60.627 65.253 -4.626 1
1 928 . 14 1 1 A 79 79 PRO CB C 433 29.329 31.898 -2.569 1
1 11 . 14 1 1 A 80 80 PHE H H 434 8.182 8.523 -0.341 1
1 12 . 14 1 1 A 80 80 PHE HA H 434 4.499 4.433 0.066 1
1 13 . 14 1 1 A 80 80 PHE C C 434 171.680 174.068 -2.388 1
1 14 . 14 1 1 A 80 80 PHE CA C 434 54.657 60.181 -5.524 1
1 15 . 14 1 1 A 80 80 PHE CB C 434 36.272 38.732 -2.460 1
1 16 . 14 1 1 A 80 80 PHE N N 434 118.611 119.370 -0.759 1
1 50 . 14 1 1 A 80 80 PHE H H 434 8.191 8.523 -0.332 1
1 51 . 14 1 1 A 80 80 PHE HA H 434 4.528 4.433 0.095 1
1 54 . 14 1 1 A 80 80 PHE C C 434 172.457 174.068 -1.611 1
1 55 . 14 1 1 A 80 80 PHE CA C 434 54.828 60.181 -5.353 1
1 56 . 14 1 1 A 80 80 PHE CB C 434 36.457 38.732 -2.275 1
1 57 . 14 1 1 A 80 80 PHE N N 434 118.871 119.370 -0.499 1
1 931 . 14 1 1 A 80 80 PHE H H 434 8.191 8.523 -0.332 1
1 932 . 14 1 1 A 80 80 PHE HA H 434 4.463 4.433 0.030 1
1 939 . 14 1 1 A 80 80 PHE C C 434 172.283 174.068 -1.785 1
1 940 . 14 1 1 A 80 80 PHE CA C 434 54.971 60.181 -5.210 1
1 941 . 14 1 1 A 80 80 PHE CB C 434 36.490 38.732 -2.242 1
1 944 . 14 1 1 A 80 80 PHE N N 434 119.263 119.370 -0.107 1
1 17 . 14 1 1 A 81 81 ASP H H 435 7.490 8.516 -1.026 1
1 18 . 14 1 1 A 81 81 ASP HA H 435 4.698 4.889 -0.191 1
1 19 . 14 1 1 A 81 81 ASP C C 435 171.662 174.475 -2.813 1
1 20 . 14 1 1 A 81 81 ASP CA C 435 49.570 51.393 -1.823 1
1 21 . 14 1 1 A 81 81 ASP CB C 435 40.104 41.339 -1.235 1
1 22 . 14 1 1 A 81 81 ASP N N 435 120.304 119.430 0.874 1
1 58 . 14 1 1 A 81 81 ASP H H 435 7.881 8.516 -0.635 1
1 59 . 14 1 1 A 81 81 ASP HA H 435 4.801 4.889 -0.088 1
1 60 . 14 1 1 A 81 81 ASP C C 435 171.144 174.475 -3.331 1
1 61 . 14 1 1 A 81 81 ASP CA C 435 49.406 51.393 -1.987 1
1 62 . 14 1 1 A 81 81 ASP CB C 435 38.618 41.339 -2.721 1
1 63 . 14 1 1 A 81 81 ASP N N 435 123.108 119.430 3.678 1
1 945 . 14 1 1 A 81 81 ASP H H 435 7.823 8.516 -0.693 1
1 946 . 14 1 1 A 81 81 ASP HA H 435 4.759 4.889 -0.130 1
1 949 . 14 1 1 A 81 81 ASP C C 435 171.057 174.475 -3.418 1
1 950 . 14 1 1 A 81 81 ASP CA C 435 49.174 51.393 -2.219 1
1 951 . 14 1 1 A 81 81 ASP CB C 435 38.725 41.339 -2.614 1
1 952 . 14 1 1 A 81 81 ASP N N 435 123.530 119.430 4.100 1
1 23 . 14 1 1 A 82 82 PRO HA H 436 4.758 4.751 0.007 1
1 24 . 14 1 1 A 82 82 PRO C C 436 172.944 175.449 -2.505 1
1 25 . 14 1 1 A 82 82 PRO CA C 436 60.134 62.268 -2.134 1
1 26 . 14 1 1 A 82 82 PRO CB C 436 31.425 33.242 -1.817 1
1 64 . 14 1 1 A 82 82 PRO HA H 436 4.364 4.751 -0.387 1
1 67 . 14 1 1 A 82 82 PRO C C 436 173.563 175.449 -1.886 1
1 68 . 14 1 1 A 82 82 PRO CA C 436 60.729 62.268 -1.539 1
1 69 . 14 1 1 A 82 82 PRO CB C 436 29.160 33.242 -4.082 1
1 953 . 14 1 1 A 82 82 PRO HA H 436 4.296 4.751 -0.455 1
1 960 . 14 1 1 A 82 82 PRO C C 436 173.494 175.449 -1.955 1
1 961 . 14 1 1 A 82 82 PRO CA C 436 60.625 62.268 -1.643 1
1 962 . 14 1 1 A 82 82 PRO CB C 436 29.237 33.242 -4.005 1
1 1 . 15 1 1 A 3 3 LEU HA H 357 4.257 4.238 0.019 1
1 11 . 15 1 1 A 3 3 LEU C C 357 174.994 176.402 -1.408 1
1 12 . 15 1 1 A 3 3 LEU CA C 357 53.329 57.650 -4.321 1
1 13 . 15 1 1 A 3 3 LEU CB C 357 39.382 42.284 -2.902 1
1 17 . 15 1 1 A 4 4 GLN H H 358 8.234 8.062 0.172 1
1 18 . 15 1 1 A 4 4 GLN HA H 358 4.211 4.595 -0.384 1
1 25 . 15 1 1 A 4 4 GLN C C 358 173.357 174.321 -0.964 1
1 26 . 15 1 1 A 4 4 GLN CA C 358 53.791 54.409 -0.618 1
1 27 . 15 1 1 A 4 4 GLN CB C 358 26.456 30.224 -3.768 1
1 29 . 15 1 1 A 4 4 GLN N N 358 119.506 117.014 2.492 1
1 31 . 15 1 1 A 5 5 ASP H H 359 8.090 8.900 -0.810 1
1 32 . 15 1 1 A 5 5 ASP HA H 359 4.458 4.684 -0.226 1
1 35 . 15 1 1 A 5 5 ASP C C 359 173.492 175.631 -2.139 1
1 36 . 15 1 1 A 5 5 ASP CA C 359 52.309 54.369 -2.060 1
1 37 . 15 1 1 A 5 5 ASP CB C 359 38.312 41.566 -3.254 1
1 38 . 15 1 1 A 5 5 ASP N N 359 120.683 126.843 -6.160 1
1 39 . 15 1 1 A 6 6 HIS H H 360 8.103 8.465 -0.362 1
1 40 . 15 1 1 A 6 6 HIS HA H 360 4.540 4.708 -0.168 1
1 45 . 15 1 1 A 6 6 HIS C C 360 172.801 174.927 -2.126 1
1 46 . 15 1 1 A 6 6 HIS CA C 360 53.874 55.401 -1.527 1
1 47 . 15 1 1 A 6 6 HIS CB C 360 27.878 29.008 -1.130 1
1 50 . 15 1 1 A 6 6 HIS N N 360 118.844 122.062 -3.218 1
1 51 . 15 1 1 A 7 7 ILE H H 361 7.862 8.447 -0.585 1
1 52 . 15 1 1 A 7 7 ILE HA H 361 4.010 4.083 -0.073 1
1 62 . 15 1 1 A 7 7 ILE C C 361 173.268 176.596 -3.328 1
1 63 . 15 1 1 A 7 7 ILE CA C 361 58.740 62.843 -4.103 1
1 64 . 15 1 1 A 7 7 ILE CB C 361 35.788 38.621 -2.833 1
1 68 . 15 1 1 A 7 7 ILE N N 361 121.598 124.283 -2.685 1
1 69 . 15 1 1 A 8 8 LYS H H 362 8.231 7.709 0.522 1
1 70 . 15 1 1 A 8 8 LYS HA H 362 4.313 4.653 -0.340 1
1 79 . 15 1 1 A 8 8 LYS C C 362 173.899 175.228 -1.329 1
1 80 . 15 1 1 A 8 8 LYS CA C 362 53.677 55.067 -1.390 1
1 81 . 15 1 1 A 8 8 LYS CB C 362 30.355 33.273 -2.918 1
1 85 . 15 1 1 A 8 8 LYS N N 362 124.980 121.436 3.544 1
1 86 . 15 1 1 A 9 9 VAL H H 363 8.044 8.776 -0.732 1
1 87 . 15 1 1 A 9 9 VAL HA H 363 4.089 4.861 -0.772 1
1 95 . 15 1 1 A 9 9 VAL C C 363 173.760 174.249 -0.489 1
1 96 . 15 1 1 A 9 9 VAL CA C 363 59.814 60.014 -0.200 1
1 97 . 15 1 1 A 9 9 VAL CB C 363 30.058 35.573 -5.515 1
1 100 . 15 1 1 A 9 9 VAL N N 363 121.366 125.976 -4.610 1
1 101 . 15 1 1 A 10 10 THR H H 364 8.076 8.403 -0.327 1
1 102 . 15 1 1 A 10 10 THR HA H 364 4.302 4.944 -0.642 1
1 107 . 15 1 1 A 10 10 THR C C 364 172.135 176.206 -4.071 1
1 108 . 15 1 1 A 10 10 THR CA C 364 59.134 59.195 -0.061 1
1 109 . 15 1 1 A 10 10 THR CB C 364 67.415 72.099 -4.684 1
1 111 . 15 1 1 A 10 10 THR N N 364 116.817 117.722 -0.905 1
1 112 . 15 1 1 A 11 11 GLN H H 365 8.463 9.028 -0.565 1
1 113 . 15 1 1 A 11 11 GLN HA H 365 4.046 4.102 -0.056 1
1 120 . 15 1 1 A 11 11 GLN C C 365 173.944 178.299 -4.355 1
1 121 . 15 1 1 A 11 11 GLN CA C 365 54.517 58.514 -3.997 1
1 122 . 15 1 1 A 11 11 GLN CB C 365 26.250 28.120 -1.870 1
1 124 . 15 1 1 A 11 11 GLN N N 365 122.059 119.843 2.216 1
1 126 . 15 1 1 A 12 12 GLU H H 366 8.449 8.636 -0.187 1
1 127 . 15 1 1 A 12 12 GLU HA H 366 4.093 4.089 0.004 1
1 132 . 15 1 1 A 12 12 GLU C C 366 174.746 178.810 -4.064 1
1 133 . 15 1 1 A 12 12 GLU CA C 366 55.235 58.951 -3.716 1
1 134 . 15 1 1 A 12 12 GLU CB C 366 27.180 28.447 -1.267 1
1 136 . 15 1 1 A 12 12 GLU N N 366 120.415 118.955 1.460 1
1 137 . 15 1 1 A 13 13 GLN H H 367 8.031 7.766 0.265 1
1 138 . 15 1 1 A 13 13 GLN HA H 367 4.113 3.966 0.147 1
1 145 . 15 1 1 A 13 13 GLN C C 367 173.693 177.094 -3.401 1
1 146 . 15 1 1 A 13 13 GLN CA C 367 54.132 58.218 -4.086 1
1 147 . 15 1 1 A 13 13 GLN CB C 367 26.420 28.551 -2.131 1
1 149 . 15 1 1 A 13 13 GLN N N 367 119.721 120.455 -0.734 1
1 151 . 15 1 1 A 14 14 TYR H H 368 8.111 7.414 0.697 1
1 152 . 15 1 1 A 14 14 TYR HA H 368 4.339 4.600 -0.261 1
1 159 . 15 1 1 A 14 14 TYR C C 368 173.916 177.062 -3.146 1
1 160 . 15 1 1 A 14 14 TYR CA C 368 56.572 58.223 -1.651 1
1 161 . 15 1 1 A 14 14 TYR CB C 368 35.879 39.307 -3.428 1
1 164 . 15 1 1 A 14 14 TYR N N 368 120.541 115.907 4.634 1
1 165 . 15 1 1 A 15 15 GLU H H 369 8.287 8.209 0.078 1
1 166 . 15 1 1 A 15 15 GLU HA H 369 4.009 4.458 -0.449 1
1 171 . 15 1 1 A 15 15 GLU C C 369 174.448 178.592 -4.144 1
1 172 . 15 1 1 A 15 15 GLU CA C 369 55.047 59.369 -4.322 1
1 173 . 15 1 1 A 15 15 GLU CB C 369 27.226 29.956 -2.730 1
1 175 . 15 1 1 A 15 15 GLU N N 369 120.398 122.543 -2.145 1
1 176 . 15 1 1 A 16 16 LEU H H 370 7.785 8.087 -0.302 1
1 177 . 15 1 1 A 16 16 LEU HA H 370 4.138 4.113 0.025 1
1 187 . 15 1 1 A 16 16 LEU C C 370 175.089 179.085 -3.996 1
1 188 . 15 1 1 A 16 16 LEU CA C 370 53.425 57.686 -4.261 1
1 189 . 15 1 1 A 16 16 LEU CB C 370 39.554 41.114 -1.560 1
1 193 . 15 1 1 A 16 16 LEU N N 370 121.323 120.366 0.957 1
1 194 . 15 1 1 A 17 17 TYR H H 371 8.038 8.352 -0.314 1
1 195 . 15 1 1 A 17 17 TYR HA H 371 4.380 4.414 -0.034 1
1 202 . 15 1 1 A 17 17 TYR C C 371 173.931 177.609 -3.678 1
1 203 . 15 1 1 A 17 17 TYR CA C 371 56.143 59.741 -3.598 1
1 204 . 15 1 1 A 17 17 TYR CB C 371 35.501 36.961 -1.460 1
1 207 . 15 1 1 A 17 17 TYR N N 371 119.465 117.419 2.046 1
1 208 . 15 1 1 A 18 18 CYS H H 372 8.021 7.076 0.945 1
1 209 . 15 1 1 A 18 18 CYS HA H 372 4.236 3.846 0.390 1
1 212 . 15 1 1 A 18 18 CYS C C 372 172.457 174.680 -2.223 1
1 213 . 15 1 1 A 18 18 CYS CA C 372 56.997 61.750 -4.753 1
1 214 . 15 1 1 A 18 18 CYS CB C 372 25.080 26.996 -1.916 1
1 215 . 15 1 1 A 18 18 CYS N N 372 119.913 119.283 0.630 1
1 216 . 15 1 1 A 19 19 GLU H H 373 8.151 7.660 0.491 1
1 217 . 15 1 1 A 19 19 GLU HA H 373 4.130 4.527 -0.397 1
1 222 . 15 1 1 A 19 19 GLU C C 373 174.151 175.740 -1.589 1
1 223 . 15 1 1 A 19 19 GLU CA C 373 54.535 56.116 -1.581 1
1 224 . 15 1 1 A 19 19 GLU CB C 373 27.244 30.683 -3.439 1
1 226 . 15 1 1 A 19 19 GLU N N 373 122.431 119.975 2.456 1
1 227 . 15 1 1 A 20 20 MET H H 374 8.109 8.818 -0.709 1
1 228 . 15 1 1 A 20 20 MET HA H 374 4.352 5.027 -0.675 1
1 236 . 15 1 1 A 20 20 MET C C 374 174.200 174.955 -0.755 1
1 237 . 15 1 1 A 20 20 MET CA C 374 53.238 54.462 -1.224 1
1 238 . 15 1 1 A 20 20 MET CB C 374 30.237 33.754 -3.517 1
1 241 . 15 1 1 A 20 20 MET N N 374 119.754 122.113 -2.359 1
1 242 . 15 1 1 A 21 21 GLY H H 375 8.231 8.374 -0.143 1
1 243 . 15 1 1 A 21 21 GLY HA2 H 375 3.861 4.300 -0.439 1
1 244 . 15 1 1 A 21 21 GLY HA3 H 375 3.960 4.304 -0.344 1
1 245 . 15 1 1 A 21 21 GLY C C 375 171.928 171.980 -0.052 1
1 246 . 15 1 1 A 21 21 GLY CA C 375 42.930 45.387 -2.457 1
1 247 . 15 1 1 A 21 21 GLY N N 375 109.484 113.511 -4.027 1
1 248 . 15 1 1 A 22 22 SER HA H 376 4.492 4.791 -0.299 1
1 251 . 15 1 1 A 22 22 SER C C 376 172.206 173.203 -0.997 1
1 252 . 15 1 1 A 22 22 SER CA C 376 55.570 57.036 -1.466 1
1 253 . 15 1 1 A 22 22 SER CB C 376 61.525 64.014 -2.489 1
1 254 . 15 1 1 A 23 23 THR H H 377 8.470 9.046 -0.576 1
1 255 . 15 1 1 A 23 23 THR HA H 377 4.295 4.323 -0.028 1
1 260 . 15 1 1 A 23 23 THR C C 377 171.811 174.624 -2.813 1
1 261 . 15 1 1 A 23 23 THR CA C 377 58.937 63.442 -4.505 1
1 262 . 15 1 1 A 23 23 THR CB C 377 67.250 68.627 -1.377 1
1 264 . 15 1 1 A 23 23 THR N N 377 124.043 124.112 -0.069 1
1 265 . 15 1 1 A 24 24 PHE H H 378 8.374 8.707 -0.333 1
1 266 . 15 1 1 A 24 24 PHE HA H 378 4.239 4.730 -0.491 1
1 273 . 15 1 1 A 24 24 PHE C C 378 173.411 175.883 -2.472 1
1 274 . 15 1 1 A 24 24 PHE CA C 378 56.697 58.881 -2.184 1
1 275 . 15 1 1 A 24 24 PHE CB C 378 36.538 42.296 -5.758 1
1 278 . 15 1 1 A 24 24 PHE N N 378 124.732 127.343 -2.611 1
1 279 . 15 1 1 A 25 25 GLN H H 379 8.457 7.979 0.478 1
1 280 . 15 1 1 A 25 25 GLN HA H 379 4.038 4.393 -0.355 1
1 287 . 15 1 1 A 25 25 GLN C C 379 172.431 174.499 -2.068 1
1 288 . 15 1 1 A 25 25 GLN CA C 379 54.078 54.731 -0.653 1
1 289 . 15 1 1 A 25 25 GLN CB C 379 26.414 28.115 -1.701 1
1 291 . 15 1 1 A 25 25 GLN N N 379 118.820 117.245 1.575 1
1 293 . 15 1 1 A 26 26 LEU H H 380 6.985 7.357 -0.372 1
1 294 . 15 1 1 A 26 26 LEU HA H 380 4.229 4.775 -0.546 1
1 304 . 15 1 1 A 26 26 LEU C C 380 173.895 175.611 -1.716 1
1 305 . 15 1 1 A 26 26 LEU CA C 380 52.123 53.093 -0.970 1
1 306 . 15 1 1 A 26 26 LEU CB C 380 40.543 46.003 -5.460 1
1 310 . 15 1 1 A 26 26 LEU N N 380 119.079 120.712 -1.633 1
1 311 . 15 1 1 A 27 27 CYS H H 381 8.905 9.263 -0.358 1
1 312 . 15 1 1 A 27 27 CYS HA H 381 4.013 4.531 -0.518 1
1 315 . 15 1 1 A 27 27 CYS C C 381 174.439 176.145 -1.706 1
1 316 . 15 1 1 A 27 27 CYS CA C 381 57.847 59.203 -1.356 1
1 317 . 15 1 1 A 27 27 CYS CB C 381 28.648 28.287 0.361 1
1 318 . 15 1 1 A 27 27 CYS N N 381 125.151 123.190 1.961 1
1 319 . 15 1 1 A 28 28 LYS H H 382 9.351 8.799 0.552 1
1 320 . 15 1 1 A 28 28 LYS HA H 382 4.157 3.995 0.162 1
1 329 . 15 1 1 A 28 28 LYS C C 382 174.678 178.163 -3.485 1
1 330 . 15 1 1 A 28 28 LYS CA C 382 54.324 58.582 -4.258 1
1 331 . 15 1 1 A 28 28 LYS CB C 382 30.086 32.590 -2.504 1
1 335 . 15 1 1 A 28 28 LYS N N 382 128.840 128.470 0.370 1
1 336 . 15 1 1 A 29 29 ILE H H 383 9.040 7.842 1.198 1
1 337 . 15 1 1 A 29 29 ILE HA H 383 3.804 3.555 0.249 1
1 347 . 15 1 1 A 29 29 ILE C C 383 174.239 177.344 -3.105 1
1 348 . 15 1 1 A 29 29 ILE CA C 383 62.114 65.032 -2.918 1
1 349 . 15 1 1 A 29 29 ILE CB C 383 33.870 38.341 -4.471 1
1 353 . 15 1 1 A 29 29 ILE N N 383 122.718 118.868 3.850 1
1 354 . 15 1 1 A 30 30 CYS H H 384 7.572 7.367 0.205 1
1 355 . 15 1 1 A 30 30 CYS HA H 384 4.548 4.435 0.113 1
1 358 . 15 1 1 A 30 30 CYS C C 384 172.978 175.107 -2.129 1
1 359 . 15 1 1 A 30 30 CYS CA C 384 54.957 59.625 -4.668 1
1 360 . 15 1 1 A 30 30 CYS CB C 384 29.778 29.569 0.209 1
1 361 . 15 1 1 A 30 30 CYS N N 384 116.356 115.609 0.747 1
1 362 . 15 1 1 A 31 31 ALA H H 385 8.205 8.632 -0.427 1
1 363 . 15 1 1 A 31 31 ALA HA H 385 4.107 4.102 0.005 1
1 367 . 15 1 1 A 31 31 ALA C C 385 173.139 177.089 -3.950 1
1 368 . 15 1 1 A 31 31 ALA CA C 385 50.802 53.451 -2.649 1
1 369 . 15 1 1 A 31 31 ALA CB C 385 14.634 17.909 -3.275 1
1 370 . 15 1 1 A 31 31 ALA N N 385 125.526 120.874 4.652 1
1 371 . 15 1 1 A 32 32 GLU H H 386 8.416 7.929 0.487 1
1 372 . 15 1 1 A 32 32 GLU HA H 386 4.467 4.629 -0.162 1
1 377 . 15 1 1 A 32 32 GLU C C 386 172.325 175.832 -3.507 1
1 378 . 15 1 1 A 32 32 GLU CA C 386 55.146 57.640 -2.494 1
1 379 . 15 1 1 A 32 32 GLU CB C 386 31.181 32.270 -1.089 1
1 381 . 15 1 1 A 32 32 GLU N N 386 117.579 116.670 0.909 1
1 382 . 15 1 1 A 33 33 ASN H H 387 7.872 7.951 -0.079 1
1 383 . 15 1 1 A 33 33 ASN HA H 387 4.900 4.990 -0.090 1
1 388 . 15 1 1 A 33 33 ASN C C 387 171.355 174.361 -3.006 1
1 389 . 15 1 1 A 33 33 ASN CA C 387 49.320 51.827 -2.507 1
1 390 . 15 1 1 A 33 33 ASN CB C 387 38.457 39.880 -1.423 1
1 391 . 15 1 1 A 33 33 ASN N N 387 120.399 117.417 2.982 1
1 393 . 15 1 1 A 34 34 ASP H H 388 8.565 8.578 -0.013 1
1 394 . 15 1 1 A 34 34 ASP HA H 388 4.679 4.879 -0.200 1
1 397 . 15 1 1 A 34 34 ASP C C 388 174.243 175.840 -1.597 1
1 398 . 15 1 1 A 34 34 ASP CA C 388 51.809 53.856 -2.047 1
1 399 . 15 1 1 A 34 34 ASP CB C 388 38.007 41.775 -3.768 1
1 400 . 15 1 1 A 34 34 ASP N N 388 120.661 121.514 -0.853 1
1 401 . 15 1 1 A 35 35 LYS H H 389 8.544 8.292 0.252 1
1 402 . 15 1 1 A 35 35 LYS HA H 389 3.411 4.257 -0.846 1
1 409 . 15 1 1 A 35 35 LYS C C 389 172.938 175.960 -3.022 1
1 410 . 15 1 1 A 35 35 LYS CA C 389 54.973 56.499 -1.526 1
1 411 . 15 1 1 A 35 35 LYS CB C 389 30.617 32.370 -1.753 1
1 415 . 15 1 1 A 35 35 LYS N N 389 119.199 122.008 -2.809 1
1 416 . 15 1 1 A 36 36 ASP H H 390 8.327 9.016 -0.689 1
1 417 . 15 1 1 A 36 36 ASP HA H 390 4.724 4.729 -0.005 1
1 420 . 15 1 1 A 36 36 ASP C C 390 172.860 175.324 -2.464 1
1 421 . 15 1 1 A 36 36 ASP CA C 390 51.609 54.967 -3.358 1
1 422 . 15 1 1 A 36 36 ASP CB C 390 39.018 42.738 -3.720 1
1 423 . 15 1 1 A 36 36 ASP N N 390 119.134 122.942 -3.808 1
1 424 . 15 1 1 A 37 37 VAL H H 391 8.544 7.993 0.551 1
1 425 . 15 1 1 A 37 37 VAL HA H 391 4.877 4.669 0.208 1
1 433 . 15 1 1 A 37 37 VAL C C 391 167.519 173.633 -6.114 1
1 434 . 15 1 1 A 37 37 VAL CA C 391 58.259 59.731 -1.472 1
1 435 . 15 1 1 A 37 37 VAL CB C 391 32.277 34.886 -2.609 1
1 438 . 15 1 1 A 37 37 VAL N N 391 121.970 117.869 4.101 1
1 439 . 15 1 1 A 38 38 LYS H H 392 8.621 9.465 -0.844 1
1 440 . 15 1 1 A 38 38 LYS HA H 392 4.991 5.255 -0.264 1
1 449 . 15 1 1 A 38 38 LYS C C 392 172.681 175.089 -2.408 1
1 450 . 15 1 1 A 38 38 LYS CA C 392 51.123 54.564 -3.441 1
1 451 . 15 1 1 A 38 38 LYS CB C 392 33.697 35.051 -1.354 1
1 455 . 15 1 1 A 38 38 LYS N N 392 126.381 127.876 -1.495 1
1 456 . 15 1 1 A 39 39 ILE H H 393 8.723 9.125 -0.402 1
1 457 . 15 1 1 A 39 39 ILE HA H 393 4.239 4.447 -0.208 1
1 467 . 15 1 1 A 39 39 ILE C C 393 172.642 175.688 -3.046 1
1 468 . 15 1 1 A 39 39 ILE CA C 393 57.768 60.561 -2.793 1
1 469 . 15 1 1 A 39 39 ILE CB C 393 35.691 37.789 -2.098 1
1 473 . 15 1 1 A 39 39 ILE N N 393 126.398 128.277 -1.879 1
1 474 . 15 1 1 A 40 40 GLU H H 394 8.506 9.336 -0.830 1
1 475 . 15 1 1 A 40 40 GLU HA H 394 4.753 4.705 0.048 1
1 480 . 15 1 1 A 40 40 GLU C C 394 173.596 176.100 -2.504 1
1 481 . 15 1 1 A 40 40 GLU CA C 394 49.793 53.443 -3.650 1
1 482 . 15 1 1 A 40 40 GLU CB C 394 28.210 30.294 -2.084 1
1 484 . 15 1 1 A 40 40 GLU N N 394 124.864 128.284 -3.420 1
1 485 . 15 1 1 A 41 41 PRO HA H 395 4.864 4.546 0.318 1
1 492 . 15 1 1 A 41 41 PRO C C 395 175.073 177.215 -2.142 1
1 493 . 15 1 1 A 41 41 PRO CA C 395 61.111 63.918 -2.807 1
1 494 . 15 1 1 A 41 41 PRO CB C 395 32.275 33.002 -0.727 1
1 497 . 15 1 1 A 42 42 CYS H H 396 7.828 7.767 0.061 1
1 498 . 15 1 1 A 42 42 CYS HA H 396 4.208 4.227 -0.019 1
1 501 . 15 1 1 A 42 42 CYS C C 396 173.877 174.997 -1.120 1
1 502 . 15 1 1 A 42 42 CYS CA C 396 58.021 60.236 -2.215 1
1 503 . 15 1 1 A 42 42 CYS CB C 396 28.242 27.965 0.277 1
1 504 . 15 1 1 A 42 42 CYS N N 396 122.434 118.121 4.313 1
1 505 . 15 1 1 A 43 43 GLY H H 397 8.679 8.596 0.083 1
1 506 . 15 1 1 A 43 43 GLY HA2 H 397 3.507 3.929 -0.422 1
1 507 . 15 1 1 A 43 43 GLY HA3 H 397 3.914 3.936 -0.022 1
1 508 . 15 1 1 A 43 43 GLY C C 397 171.981 175.159 -3.178 1
1 509 . 15 1 1 A 43 43 GLY CA C 397 43.347 45.963 -2.616 1
1 510 . 15 1 1 A 43 43 GLY N N 397 112.123 108.963 3.160 1
1 511 . 15 1 1 A 44 44 HIS H H 398 8.329 7.438 0.891 1
1 512 . 15 1 1 A 44 44 HIS HA H 398 4.339 4.444 -0.105 1
1 517 . 15 1 1 A 44 44 HIS C C 398 170.742 174.562 -3.820 1
1 518 . 15 1 1 A 44 44 HIS CA C 398 58.368 56.125 2.243 1
1 519 . 15 1 1 A 44 44 HIS CB C 398 28.434 30.994 -2.560 1
1 522 . 15 1 1 A 44 44 HIS N N 398 121.393 117.635 3.758 1
1 523 . 15 1 1 A 45 45 LEU H H 399 8.241 8.572 -0.331 1
1 524 . 15 1 1 A 45 45 LEU HA H 399 5.570 5.230 0.340 1
1 534 . 15 1 1 A 45 45 LEU C C 399 174.464 175.331 -0.867 1
1 535 . 15 1 1 A 45 45 LEU CA C 399 50.729 53.239 -2.510 1
1 536 . 15 1 1 A 45 45 LEU CB C 399 43.574 44.759 -1.185 1
1 540 . 15 1 1 A 45 45 LEU N N 399 118.469 122.100 -3.631 1
1 541 . 15 1 1 A 46 46 MET H H 400 8.707 8.839 -0.132 1
1 542 . 15 1 1 A 46 46 MET HA H 400 4.842 4.997 -0.155 1
1 550 . 15 1 1 A 46 46 MET C C 400 170.736 174.395 -3.659 1
1 551 . 15 1 1 A 46 46 MET CA C 400 52.804 53.950 -1.146 1
1 552 . 15 1 1 A 46 46 MET CB C 400 31.945 35.480 -3.535 1
1 555 . 15 1 1 A 46 46 MET N N 400 114.897 120.598 -5.701 1
1 556 . 15 1 1 A 47 47 CYS H H 401 9.436 8.400 1.036 1
1 557 . 15 1 1 A 47 47 CYS HA H 401 5.629 4.809 0.820 1
1 560 . 15 1 1 A 47 47 CYS C C 401 173.909 176.190 -2.281 1
1 561 . 15 1 1 A 47 47 CYS CA C 401 54.325 57.172 -2.847 1
1 562 . 15 1 1 A 47 47 CYS CB C 401 30.725 29.092 1.633 1
1 563 . 15 1 1 A 47 47 CYS N N 401 119.575 119.332 0.243 1
1 564 . 15 1 1 A 48 48 THR H H 402 9.842 8.835 1.007 1
1 565 . 15 1 1 A 48 48 THR HA H 402 3.768 3.974 -0.206 1
1 570 . 15 1 1 A 48 48 THR C C 402 174.333 176.293 -1.960 1
1 571 . 15 1 1 A 48 48 THR CA C 402 64.516 65.838 -1.322 1
1 572 . 15 1 1 A 48 48 THR CB C 402 66.288 68.647 -2.359 1
1 574 . 15 1 1 A 48 48 THR N N 402 119.945 119.280 0.665 1
1 575 . 15 1 1 A 49 49 SER H H 403 8.355 8.040 0.315 1
1 576 . 15 1 1 A 49 49 SER HA H 403 4.222 4.131 0.091 1
1 579 . 15 1 1 A 49 49 SER C C 403 175.059 176.426 -1.367 1
1 580 . 15 1 1 A 49 49 SER CA C 403 59.828 61.965 -2.137 1
1 581 . 15 1 1 A 49 49 SER CB C 403 59.717 63.002 -3.285 1
1 582 . 15 1 1 A 49 49 SER N N 403 120.468 117.106 3.362 1
1 583 . 15 1 1 A 50 50 CYS H H 404 9.464 7.944 1.520 1
1 584 . 15 1 1 A 50 50 CYS HA H 404 3.922 4.300 -0.378 1
1 587 . 15 1 1 A 50 50 CYS C C 404 176.081 177.059 -0.978 1
1 588 . 15 1 1 A 50 50 CYS CA C 404 63.076 63.891 -0.815 1
1 589 . 15 1 1 A 50 50 CYS CB C 404 26.078 27.772 -1.694 1
1 590 . 15 1 1 A 50 50 CYS N N 404 126.744 119.994 6.750 1
1 591 . 15 1 1 A 51 51 LEU H H 405 7.948 8.131 -0.183 1
1 592 . 15 1 1 A 51 51 LEU HA H 405 4.064 4.181 -0.117 1
1 602 . 15 1 1 A 51 51 LEU C C 405 175.495 178.909 -3.414 1
1 603 . 15 1 1 A 51 51 LEU CA C 405 55.914 57.967 -2.053 1
1 604 . 15 1 1 A 51 51 LEU CB C 405 38.662 41.736 -3.074 1
1 607 . 15 1 1 A 51 51 LEU N N 405 121.951 122.467 -0.516 1
1 608 . 15 1 1 A 52 52 THR H H 406 8.786 8.733 0.053 1
1 609 . 15 1 1 A 52 52 THR HA H 406 4.024 3.950 0.074 1
1 614 . 15 1 1 A 52 52 THR C C 406 174.139 176.556 -2.417 1
1 615 . 15 1 1 A 52 52 THR CA C 406 64.017 66.636 -2.619 1
1 616 . 15 1 1 A 52 52 THR CB C 406 66.115 68.579 -2.464 1
1 618 . 15 1 1 A 52 52 THR N N 406 115.258 115.079 0.179 1
1 619 . 15 1 1 A 53 53 SER H H 407 8.115 8.256 -0.141 1
1 620 . 15 1 1 A 53 53 SER HA H 407 4.204 4.185 0.019 1
1 623 . 15 1 1 A 53 53 SER C C 407 174.456 176.993 -2.537 1
1 624 . 15 1 1 A 53 53 SER CA C 407 59.090 61.104 -2.014 1
1 625 . 15 1 1 A 53 53 SER CB C 407 60.146 63.123 -2.977 1
1 626 . 15 1 1 A 53 53 SER N N 407 116.852 114.979 1.873 1
1 627 . 15 1 1 A 54 54 TRP H H 408 8.123 7.694 0.429 1
1 628 . 15 1 1 A 54 54 TRP HA H 408 4.371 4.288 0.083 1
1 637 . 15 1 1 A 54 54 TRP C C 408 175.981 178.770 -2.789 1
1 638 . 15 1 1 A 54 54 TRP CA C 408 57.323 60.929 -3.606 1
1 639 . 15 1 1 A 54 54 TRP CB C 408 26.812 29.534 -2.722 1
1 645 . 15 1 1 A 54 54 TRP N N 408 123.556 122.825 0.731 1
1 647 . 15 1 1 A 55 55 GLN H H 409 8.502 8.555 -0.053 1
1 648 . 15 1 1 A 55 55 GLN HA H 409 3.999 3.844 0.155 1
1 655 . 15 1 1 A 55 55 GLN C C 409 177.300 178.293 -0.993 1
1 656 . 15 1 1 A 55 55 GLN CA C 409 56.484 58.974 -2.490 1
1 657 . 15 1 1 A 55 55 GLN CB C 409 26.190 28.091 -1.901 1
1 659 . 15 1 1 A 55 55 GLN N N 409 118.044 118.285 -0.241 1
1 661 . 15 1 1 A 56 56 GLU H H 410 8.467 8.524 -0.057 1
1 662 . 15 1 1 A 56 56 GLU HA H 410 4.057 4.134 -0.077 1
1 667 . 15 1 1 A 56 56 GLU C C 410 174.787 177.181 -2.394 1
1 668 . 15 1 1 A 56 56 GLU CA C 410 55.909 58.495 -2.586 1
1 669 . 15 1 1 A 56 56 GLU CB C 410 26.895 29.539 -2.644 1
1 671 . 15 1 1 A 56 56 GLU N N 410 119.448 119.519 -0.071 1
1 672 . 15 1 1 A 57 57 SER H H 411 7.438 7.466 -0.028 1
1 673 . 15 1 1 A 57 57 SER HA H 411 4.607 4.547 0.060 1
1 676 . 15 1 1 A 57 57 SER C C 411 170.849 173.894 -3.045 1
1 677 . 15 1 1 A 57 57 SER CA C 411 55.540 57.451 -1.911 1
1 678 . 15 1 1 A 57 57 SER CB C 411 60.928 62.994 -2.066 1
1 679 . 15 1 1 A 57 57 SER N N 411 113.752 113.254 0.498 1
1 680 . 15 1 1 A 58 58 GLU H H 412 7.855 7.805 0.050 1
1 681 . 15 1 1 A 58 58 GLU HA H 412 3.772 4.038 -0.266 1
1 686 . 15 1 1 A 58 58 GLU C C 412 173.743 175.699 -1.956 1
1 687 . 15 1 1 A 58 58 GLU CA C 412 54.442 56.934 -2.492 1
1 688 . 15 1 1 A 58 58 GLU CB C 412 24.603 28.337 -3.734 1
1 690 . 15 1 1 A 58 58 GLU N N 412 115.908 117.910 -2.002 1
1 691 . 15 1 1 A 59 59 GLY H H 413 7.588 8.316 -0.728 1
1 692 . 15 1 1 A 59 59 GLY HA2 H 413 1.643 3.168 -1.525 1
1 693 . 15 1 1 A 59 59 GLY HA3 H 413 2.949 3.846 -0.897 1
1 694 . 15 1 1 A 59 59 GLY C C 413 170.850 174.063 -3.213 1
1 695 . 15 1 1 A 59 59 GLY CA C 413 41.724 46.319 -4.595 1
1 696 . 15 1 1 A 59 59 GLY N N 413 108.032 112.011 -3.979 1
1 697 . 15 1 1 A 60 60 GLN H H 414 7.973 8.064 -0.091 1
1 698 . 15 1 1 A 60 60 GLN HA H 414 4.366 4.466 -0.100 1
1 705 . 15 1 1 A 60 60 GLN C C 414 173.108 176.244 -3.136 1
1 706 . 15 1 1 A 60 60 GLN CA C 414 52.422 55.642 -3.220 1
1 707 . 15 1 1 A 60 60 GLN CB C 414 27.049 27.936 -0.887 1
1 709 . 15 1 1 A 60 60 GLN N N 414 122.690 121.233 1.457 1
1 711 . 15 1 1 A 61 61 GLY H H 415 8.301 8.466 -0.165 1
1 712 . 15 1 1 A 61 61 GLY HA2 H 415 3.700 4.148 -0.448 1
1 713 . 15 1 1 A 61 61 GLY HA3 H 415 3.920 4.173 -0.253 1
1 714 . 15 1 1 A 61 61 GLY C C 415 170.249 174.207 -3.958 1
1 715 . 15 1 1 A 61 61 GLY CA C 415 42.210 44.800 -2.590 1
1 716 . 15 1 1 A 61 61 GLY N N 415 110.794 111.790 -0.996 1
1 717 . 15 1 1 A 62 62 CYS H H 416 8.549 8.779 -0.230 1
1 718 . 15 1 1 A 62 62 CYS HA H 416 4.227 4.690 -0.463 1
1 721 . 15 1 1 A 62 62 CYS C C 416 172.914 175.111 -2.197 1
1 722 . 15 1 1 A 62 62 CYS CA C 416 54.008 58.694 -4.686 1
1 723 . 15 1 1 A 62 62 CYS CB C 416 29.716 27.216 2.500 1
1 724 . 15 1 1 A 62 62 CYS N N 416 123.683 120.315 3.368 1
1 725 . 15 1 1 A 63 63 PRO HA H 417 2.611 3.056 -0.445 1
1 732 . 15 1 1 A 63 63 PRO C C 417 174.143 178.156 -4.013 1
1 733 . 15 1 1 A 63 63 PRO CA C 417 61.689 63.842 -2.153 1
1 734 . 15 1 1 A 63 63 PRO CB C 417 28.534 31.003 -2.469 1
1 737 . 15 1 1 A 64 64 PHE H H 418 8.968 7.851 1.117 1
1 738 . 15 1 1 A 64 64 PHE HA H 418 4.250 4.136 0.114 1
1 746 . 15 1 1 A 64 64 PHE C C 418 174.243 178.585 -4.342 1
1 747 . 15 1 1 A 64 64 PHE CA C 418 56.720 60.511 -3.791 1
1 748 . 15 1 1 A 64 64 PHE CB C 418 36.458 39.237 -2.779 1
1 752 . 15 1 1 A 64 64 PHE N N 418 117.008 115.848 1.160 1
1 753 . 15 1 1 A 65 65 CYS H H 419 7.968 8.078 -0.110 1
1 754 . 15 1 1 A 65 65 CYS HA H 419 4.906 4.468 0.438 1
1 757 . 15 1 1 A 65 65 CYS C C 419 173.198 174.935 -1.737 1
1 758 . 15 1 1 A 65 65 CYS CA C 419 55.870 60.101 -4.231 1
1 759 . 15 1 1 A 65 65 CYS CB C 419 30.559 28.908 1.651 1
1 760 . 15 1 1 A 65 65 CYS N N 419 117.505 117.338 0.167 1
1 761 . 15 1 1 A 66 66 ARG H H 420 8.761 8.060 0.701 1
1 762 . 15 1 1 A 66 66 ARG HA H 420 4.365 4.353 0.012 1
1 769 . 15 1 1 A 66 66 ARG C C 420 172.921 174.385 -1.464 1
1 770 . 15 1 1 A 66 66 ARG CA C 420 54.763 57.248 -2.485 1
1 771 . 15 1 1 A 66 66 ARG CB C 420 24.286 27.033 -2.747 1
1 774 . 15 1 1 A 66 66 ARG N N 420 118.763 115.940 2.823 1
1 775 . 15 1 1 A 67 67 CYS H H 421 8.223 7.533 0.690 1
1 776 . 15 1 1 A 67 67 CYS HA H 421 4.419 4.667 -0.248 1
1 779 . 15 1 1 A 67 67 CYS C C 421 171.160 174.069 -2.909 1
1 780 . 15 1 1 A 67 67 CYS CA C 421 57.119 57.976 -0.857 1
1 781 . 15 1 1 A 67 67 CYS CB C 421 25.911 29.611 -3.700 1
1 782 . 15 1 1 A 67 67 CYS N N 421 120.627 117.487 3.140 1
1 783 . 15 1 1 A 68 68 GLU H H 422 8.416 8.570 -0.154 1
1 784 . 15 1 1 A 68 68 GLU HA H 422 4.025 4.175 -0.150 1
1 789 . 15 1 1 A 68 68 GLU C C 422 173.764 176.280 -2.516 1
1 790 . 15 1 1 A 68 68 GLU CA C 422 54.752 57.840 -3.088 1
1 791 . 15 1 1 A 68 68 GLU CB C 422 27.302 29.820 -2.518 1
1 793 . 15 1 1 A 68 68 GLU N N 422 122.370 122.227 0.143 1
1 794 . 15 1 1 A 69 69 ILE H H 423 8.648 8.755 -0.107 1
1 795 . 15 1 1 A 69 69 ILE HA H 423 4.012 4.561 -0.549 1
1 805 . 15 1 1 A 69 69 ILE C C 423 174.257 175.645 -1.388 1
1 806 . 15 1 1 A 69 69 ILE CA C 423 59.740 60.679 -0.939 1
1 807 . 15 1 1 A 69 69 ILE CB C 423 35.846 39.132 -3.286 1
1 811 . 15 1 1 A 69 69 ILE N N 423 125.988 124.534 1.454 1
1 812 . 15 1 1 A 70 70 LYS H H 424 9.185 9.200 -0.015 1
1 813 . 15 1 1 A 70 70 LYS HA H 424 4.434 4.249 0.185 1
1 822 . 15 1 1 A 70 70 LYS C C 424 173.880 177.231 -3.351 1
1 823 . 15 1 1 A 70 70 LYS CA C 424 53.378 57.781 -4.403 1
1 824 . 15 1 1 A 70 70 LYS CB C 424 30.397 32.964 -2.567 1
1 828 . 15 1 1 A 70 70 LYS N N 424 128.977 127.506 1.471 1
1 829 . 15 1 1 A 71 71 GLY H H 425 7.810 7.295 0.515 1
1 830 . 15 1 1 A 71 71 GLY HA2 H 425 4.094 4.056 0.038 1
1 831 . 15 1 1 A 71 71 GLY HA3 H 425 4.159 4.059 0.100 1
1 832 . 15 1 1 A 71 71 GLY C C 425 168.179 172.115 -3.936 1
1 833 . 15 1 1 A 71 71 GLY CA C 425 42.326 45.206 -2.880 1
1 834 . 15 1 1 A 71 71 GLY N N 425 107.696 103.266 4.430 1
1 835 . 15 1 1 A 72 72 THR H H 426 8.048 8.647 -0.599 1
1 836 . 15 1 1 A 72 72 THR HA H 426 5.258 5.594 -0.336 1
1 841 . 15 1 1 A 72 72 THR C C 426 170.979 173.497 -2.518 1
1 842 . 15 1 1 A 72 72 THR CA C 426 56.755 59.625 -2.870 1
1 843 . 15 1 1 A 72 72 THR CB C 426 69.226 71.865 -2.639 1
1 845 . 15 1 1 A 72 72 THR N N 426 109.122 110.961 -1.839 1
1 846 . 15 1 1 A 73 73 GLU H H 427 8.912 8.891 0.021 1
1 847 . 15 1 1 A 73 73 GLU HA H 427 4.954 4.850 0.104 1
1 852 . 15 1 1 A 73 73 GLU C C 427 170.353 173.770 -3.417 1
1 853 . 15 1 1 A 73 73 GLU CA C 427 50.182 53.108 -2.926 1
1 854 . 15 1 1 A 73 73 GLU CB C 427 30.559 32.463 -1.904 1
1 856 . 15 1 1 A 73 73 GLU N N 427 121.703 120.500 1.203 1
1 1 . 15 1 1 A 74 74 PRO HA H 428 4.372 4.785 -0.413 1
1 2 . 15 1 1 A 74 74 PRO C C 428 173.839 176.743 -2.904 1
1 3 . 15 1 1 A 74 74 PRO CA C 428 60.241 62.801 -2.560 1
1 4 . 15 1 1 A 74 74 PRO CB C 428 29.299 32.371 -3.072 1
1 857 . 15 1 1 A 74 74 PRO HA H 428 4.782 4.785 -0.003 1
1 864 . 15 1 1 A 74 74 PRO C C 428 174.027 176.743 -2.716 1
1 865 . 15 1 1 A 74 74 PRO CA C 428 59.771 62.801 -3.030 1
1 866 . 15 1 1 A 74 74 PRO CB C 428 29.633 32.371 -2.738 1
1 7 . 15 1 1 A 75 75 ILE H H 429 8.144 9.074 -0.930 1
1 8 . 15 1 1 A 75 75 ILE HA H 429 4.086 4.032 0.054 1
1 15 . 15 1 1 A 75 75 ILE C C 429 173.426 176.358 -2.932 1
1 16 . 15 1 1 A 75 75 ILE CA C 429 58.339 63.488 -5.149 1
1 17 . 15 1 1 A 75 75 ILE CB C 429 35.988 38.078 -2.090 1
1 21 . 15 1 1 A 75 75 ILE N N 429 121.551 119.827 1.724 1
1 869 . 15 1 1 A 75 75 ILE H H 429 7.682 9.074 -1.392 1
1 870 . 15 1 1 A 75 75 ILE HA H 429 4.282 4.032 0.250 1
1 880 . 15 1 1 A 75 75 ILE C C 429 172.510 176.358 -3.848 1
1 881 . 15 1 1 A 75 75 ILE CA C 429 57.456 63.488 -6.032 1
1 882 . 15 1 1 A 75 75 ILE CB C 429 37.903 38.078 -0.175 1
1 886 . 15 1 1 A 75 75 ILE N N 429 119.651 119.827 -0.176 1
1 1 . 15 1 1 A 76 76 VAL HA H 430 4.086 3.862 0.224 1
1 2 . 15 1 1 A 76 76 VAL CA C 430 59.372 62.402 -3.030 1
1 22 . 15 1 1 A 76 76 VAL H H 430 8.221 7.885 0.336 1
1 23 . 15 1 1 A 76 76 VAL HA H 430 4.083 3.862 0.221 1
1 24 . 15 1 1 A 76 76 VAL C C 430 173.067 174.965 -1.898 1
1 25 . 15 1 1 A 76 76 VAL CA C 430 59.445 62.402 -2.957 1
1 26 . 15 1 1 A 76 76 VAL CB C 430 30.407 30.383 0.024 1
1 27 . 15 1 1 A 76 76 VAL N N 430 125.930 118.615 7.315 1
1 887 . 15 1 1 A 76 76 VAL H H 430 8.122 7.885 0.237 1
1 888 . 15 1 1 A 76 76 VAL HA H 430 4.197 3.862 0.335 1
1 890 . 15 1 1 A 76 76 VAL C C 430 172.971 174.965 -1.994 1
1 891 . 15 1 1 A 76 76 VAL CA C 430 58.821 62.402 -3.581 1
1 892 . 15 1 1 A 76 76 VAL CB C 430 30.807 30.383 0.424 1
1 895 . 15 1 1 A 76 76 VAL N N 430 124.178 118.615 5.563 1
1 4 . 15 1 1 A 77 77 VAL H H 431 8.204 8.276 -0.072 1
1 5 . 15 1 1 A 77 77 VAL HA H 431 4.049 4.563 -0.514 1
1 6 . 15 1 1 A 77 77 VAL C C 431 172.636 174.818 -2.182 1
1 7 . 15 1 1 A 77 77 VAL CA C 431 59.315 61.382 -2.067 1
1 8 . 15 1 1 A 77 77 VAL CB C 431 30.219 31.528 -1.309 1
1 9 . 15 1 1 A 77 77 VAL N N 431 125.320 122.524 2.796 1
1 28 . 15 1 1 A 77 77 VAL H H 431 8.412 8.276 0.136 1
1 29 . 15 1 1 A 77 77 VAL HA H 431 4.038 4.563 -0.525 1
1 37 . 15 1 1 A 77 77 VAL C C 431 172.617 174.818 -2.201 1
1 38 . 15 1 1 A 77 77 VAL CA C 431 59.137 61.382 -2.245 1
1 39 . 15 1 1 A 77 77 VAL CB C 431 30.292 31.528 -1.236 1
1 42 . 15 1 1 A 77 77 VAL N N 431 125.655 122.524 3.131 1
1 896 . 15 1 1 A 77 77 VAL H H 431 8.448 8.276 0.172 1
1 897 . 15 1 1 A 77 77 VAL HA H 431 4.087 4.563 -0.476 1
1 905 . 15 1 1 A 77 77 VAL C C 431 172.493 174.818 -2.325 1
1 906 . 15 1 1 A 77 77 VAL CA C 431 59.185 61.382 -2.197 1
1 907 . 15 1 1 A 77 77 VAL CB C 431 30.084 31.528 -1.444 1
1 910 . 15 1 1 A 77 77 VAL N N 431 125.770 122.524 3.246 1
1 43 . 15 1 1 A 78 78 ASP H H 432 8.419 8.236 0.183 1
1 44 . 15 1 1 A 78 78 ASP HA H 432 4.829 4.942 -0.113 1
1 45 . 15 1 1 A 78 78 ASP C C 432 172.252 175.771 -3.519 1
1 46 . 15 1 1 A 78 78 ASP CA C 432 49.320 52.431 -3.111 1
1 47 . 15 1 1 A 78 78 ASP CB C 432 39.066 40.737 -1.671 1
1 48 . 15 1 1 A 78 78 ASP N N 432 126.226 125.273 0.953 1
1 911 . 15 1 1 A 78 78 ASP H H 432 8.493 8.236 0.257 1
1 912 . 15 1 1 A 78 78 ASP HA H 432 4.852 4.942 -0.090 1
1 915 . 15 1 1 A 78 78 ASP C C 432 172.048 175.771 -3.723 1
1 916 . 15 1 1 A 78 78 ASP CA C 432 49.233 52.431 -3.198 1
1 917 . 15 1 1 A 78 78 ASP CB C 432 38.858 40.737 -1.879 1
1 918 . 15 1 1 A 78 78 ASP N N 432 126.705 125.273 1.432 1
1 10 . 15 1 1 A 79 79 PRO CA C 433 63.865 62.188 1.677 1
1 49 . 15 1 1 A 79 79 PRO C C 433 173.867 176.697 -2.830 1
1 919 . 15 1 1 A 79 79 PRO HA H 433 4.237 4.558 -0.321 1
1 926 . 15 1 1 A 79 79 PRO C C 433 173.812 176.697 -2.885 1
1 927 . 15 1 1 A 79 79 PRO CA C 433 60.627 62.188 -1.561 1
1 928 . 15 1 1 A 79 79 PRO CB C 433 29.329 29.274 0.055 1
1 11 . 15 1 1 A 80 80 PHE H H 434 8.182 7.712 0.470 1
1 12 . 15 1 1 A 80 80 PHE HA H 434 4.499 4.372 0.127 1
1 13 . 15 1 1 A 80 80 PHE C C 434 171.680 175.303 -3.623 1
1 14 . 15 1 1 A 80 80 PHE CA C 434 54.657 59.273 -4.616 1
1 15 . 15 1 1 A 80 80 PHE CB C 434 36.272 38.795 -2.523 1
1 16 . 15 1 1 A 80 80 PHE N N 434 118.611 122.157 -3.546 1
1 50 . 15 1 1 A 80 80 PHE H H 434 8.191 7.712 0.479 1
1 51 . 15 1 1 A 80 80 PHE HA H 434 4.528 4.372 0.156 1
1 54 . 15 1 1 A 80 80 PHE C C 434 172.457 175.303 -2.846 1
1 55 . 15 1 1 A 80 80 PHE CA C 434 54.828 59.273 -4.445 1
1 56 . 15 1 1 A 80 80 PHE CB C 434 36.457 38.795 -2.338 1
1 57 . 15 1 1 A 80 80 PHE N N 434 118.871 122.157 -3.286 1
1 931 . 15 1 1 A 80 80 PHE H H 434 8.191 7.712 0.479 1
1 932 . 15 1 1 A 80 80 PHE HA H 434 4.463 4.372 0.091 1
1 939 . 15 1 1 A 80 80 PHE C C 434 172.283 175.303 -3.020 1
1 940 . 15 1 1 A 80 80 PHE CA C 434 54.971 59.273 -4.302 1
1 941 . 15 1 1 A 80 80 PHE CB C 434 36.490 38.795 -2.305 1
1 944 . 15 1 1 A 80 80 PHE N N 434 119.263 122.157 -2.894 1
1 17 . 15 1 1 A 81 81 ASP H H 435 7.490 7.213 0.277 1
1 18 . 15 1 1 A 81 81 ASP HA H 435 4.698 4.855 -0.157 1
1 19 . 15 1 1 A 81 81 ASP C C 435 171.662 173.390 -1.728 1
1 20 . 15 1 1 A 81 81 ASP CA C 435 49.570 51.547 -1.977 1
1 21 . 15 1 1 A 81 81 ASP CB C 435 40.104 41.102 -0.998 1
1 22 . 15 1 1 A 81 81 ASP N N 435 120.304 119.323 0.981 1
1 58 . 15 1 1 A 81 81 ASP H H 435 7.881 7.213 0.668 1
1 59 . 15 1 1 A 81 81 ASP HA H 435 4.801 4.855 -0.054 1
1 60 . 15 1 1 A 81 81 ASP C C 435 171.144 173.390 -2.246 1
1 61 . 15 1 1 A 81 81 ASP CA C 435 49.406 51.547 -2.141 1
1 62 . 15 1 1 A 81 81 ASP CB C 435 38.618 41.102 -2.484 1
1 63 . 15 1 1 A 81 81 ASP N N 435 123.108 119.323 3.785 1
1 945 . 15 1 1 A 81 81 ASP H H 435 7.823 7.213 0.610 1
1 946 . 15 1 1 A 81 81 ASP HA H 435 4.759 4.855 -0.096 1
1 949 . 15 1 1 A 81 81 ASP C C 435 171.057 173.390 -2.333 1
1 950 . 15 1 1 A 81 81 ASP CA C 435 49.174 51.547 -2.373 1
1 951 . 15 1 1 A 81 81 ASP CB C 435 38.725 41.102 -2.377 1
1 952 . 15 1 1 A 81 81 ASP N N 435 123.530 119.323 4.207 1
1 23 . 15 1 1 A 82 82 PRO HA H 436 4.758 4.617 0.141 1
1 24 . 15 1 1 A 82 82 PRO C C 436 172.944 175.673 -2.729 1
1 25 . 15 1 1 A 82 82 PRO CA C 436 60.134 62.370 -2.236 1
1 26 . 15 1 1 A 82 82 PRO CB C 436 31.425 32.503 -1.078 1
1 64 . 15 1 1 A 82 82 PRO HA H 436 4.364 4.617 -0.253 1
1 67 . 15 1 1 A 82 82 PRO C C 436 173.563 175.673 -2.110 1
1 68 . 15 1 1 A 82 82 PRO CA C 436 60.729 62.370 -1.641 1
1 69 . 15 1 1 A 82 82 PRO CB C 436 29.160 32.503 -3.343 1
1 953 . 15 1 1 A 82 82 PRO HA H 436 4.296 4.617 -0.321 1
1 960 . 15 1 1 A 82 82 PRO C C 436 173.494 175.673 -2.179 1
1 961 . 15 1 1 A 82 82 PRO CA C 436 60.625 62.370 -1.745 1
1 962 . 15 1 1 A 82 82 PRO CB C 436 29.237 32.503 -3.266 1
1 1 . 16 1 1 A 3 3 LEU HA H 357 4.257 4.150 0.107 1
1 11 . 16 1 1 A 3 3 LEU C C 357 174.994 176.819 -1.825 1
1 12 . 16 1 1 A 3 3 LEU CA C 357 53.329 57.354 -4.025 1
1 13 . 16 1 1 A 3 3 LEU CB C 357 39.382 42.247 -2.865 1
1 17 . 16 1 1 A 4 4 GLN H H 358 8.234 7.712 0.522 1
1 18 . 16 1 1 A 4 4 GLN HA H 358 4.211 4.423 -0.212 1
1 25 . 16 1 1 A 4 4 GLN C C 358 173.357 176.126 -2.769 1
1 26 . 16 1 1 A 4 4 GLN CA C 358 53.791 55.613 -1.822 1
1 27 . 16 1 1 A 4 4 GLN CB C 358 26.456 29.560 -3.104 1
1 29 . 16 1 1 A 4 4 GLN N N 358 119.506 118.167 1.339 1
1 31 . 16 1 1 A 5 5 ASP H H 359 8.090 9.031 -0.941 1
1 32 . 16 1 1 A 5 5 ASP HA H 359 4.458 4.459 -0.001 1
1 35 . 16 1 1 A 5 5 ASP C C 359 173.492 175.186 -1.694 1
1 36 . 16 1 1 A 5 5 ASP CA C 359 52.309 55.492 -3.183 1
1 37 . 16 1 1 A 5 5 ASP CB C 359 38.312 40.518 -2.206 1
1 38 . 16 1 1 A 5 5 ASP N N 359 120.683 122.781 -2.098 1
1 39 . 16 1 1 A 6 6 HIS H H 360 8.103 7.891 0.212 1
1 40 . 16 1 1 A 6 6 HIS HA H 360 4.540 4.740 -0.200 1
1 45 . 16 1 1 A 6 6 HIS C C 360 172.801 173.811 -1.010 1
1 46 . 16 1 1 A 6 6 HIS CA C 360 53.874 54.515 -0.641 1
1 47 . 16 1 1 A 6 6 HIS CB C 360 27.878 29.859 -1.981 1
1 50 . 16 1 1 A 6 6 HIS N N 360 118.844 119.048 -0.204 1
1 51 . 16 1 1 A 7 7 ILE H H 361 7.862 8.630 -0.768 1
1 52 . 16 1 1 A 7 7 ILE HA H 361 4.010 3.836 0.174 1
1 62 . 16 1 1 A 7 7 ILE C C 361 173.268 175.581 -2.313 1
1 63 . 16 1 1 A 7 7 ILE CA C 361 58.740 63.386 -4.646 1
1 64 . 16 1 1 A 7 7 ILE CB C 361 35.788 38.443 -2.655 1
1 68 . 16 1 1 A 7 7 ILE N N 361 121.598 128.500 -6.902 1
1 69 . 16 1 1 A 8 8 LYS H H 362 8.231 7.158 1.073 1
1 70 . 16 1 1 A 8 8 LYS HA H 362 4.313 4.041 0.272 1
1 79 . 16 1 1 A 8 8 LYS C C 362 173.899 173.908 -0.009 1
1 80 . 16 1 1 A 8 8 LYS CA C 362 53.677 55.662 -1.985 1
1 81 . 16 1 1 A 8 8 LYS CB C 362 30.355 35.979 -5.624 1
1 85 . 16 1 1 A 8 8 LYS N N 362 124.980 116.758 8.222 1
1 86 . 16 1 1 A 9 9 VAL H H 363 8.044 8.625 -0.581 1
1 87 . 16 1 1 A 9 9 VAL HA H 363 4.089 4.766 -0.677 1
1 95 . 16 1 1 A 9 9 VAL C C 363 173.760 175.650 -1.890 1
1 96 . 16 1 1 A 9 9 VAL CA C 363 59.814 60.137 -0.323 1
1 97 . 16 1 1 A 9 9 VAL CB C 363 30.058 34.397 -4.339 1
1 100 . 16 1 1 A 9 9 VAL N N 363 121.366 120.417 0.949 1
1 101 . 16 1 1 A 10 10 THR H H 364 8.076 8.849 -0.773 1
1 102 . 16 1 1 A 10 10 THR HA H 364 4.302 4.178 0.124 1
1 107 . 16 1 1 A 10 10 THR C C 364 172.135 175.801 -3.666 1
1 108 . 16 1 1 A 10 10 THR CA C 364 59.134 64.879 -5.745 1
1 109 . 16 1 1 A 10 10 THR CB C 364 67.415 69.490 -2.075 1
1 111 . 16 1 1 A 10 10 THR N N 364 116.817 118.623 -1.806 1
1 112 . 16 1 1 A 11 11 GLN H H 365 8.463 8.356 0.107 1
1 113 . 16 1 1 A 11 11 GLN HA H 365 4.046 4.417 -0.371 1
1 120 . 16 1 1 A 11 11 GLN C C 365 173.944 175.544 -1.600 1
1 121 . 16 1 1 A 11 11 GLN CA C 365 54.517 57.244 -2.727 1
1 122 . 16 1 1 A 11 11 GLN CB C 365 26.250 30.266 -4.016 1
1 124 . 16 1 1 A 11 11 GLN N N 365 122.059 117.923 4.136 1
1 126 . 16 1 1 A 12 12 GLU H H 366 8.449 7.984 0.465 1
1 127 . 16 1 1 A 12 12 GLU HA H 366 4.093 4.757 -0.664 1
1 132 . 16 1 1 A 12 12 GLU C C 366 174.746 175.748 -1.002 1
1 133 . 16 1 1 A 12 12 GLU CA C 366 55.235 54.780 0.455 1
1 134 . 16 1 1 A 12 12 GLU CB C 366 27.180 32.832 -5.652 1
1 136 . 16 1 1 A 12 12 GLU N N 366 120.415 117.439 2.976 1
1 137 . 16 1 1 A 13 13 GLN H H 367 8.031 8.934 -0.903 1
1 138 . 16 1 1 A 13 13 GLN HA H 367 4.113 3.900 0.213 1
1 145 . 16 1 1 A 13 13 GLN C C 367 173.693 176.875 -3.182 1
1 146 . 16 1 1 A 13 13 GLN CA C 367 54.132 59.029 -4.897 1
1 147 . 16 1 1 A 13 13 GLN CB C 367 26.420 28.006 -1.586 1
1 149 . 16 1 1 A 13 13 GLN N N 367 119.721 123.379 -3.658 1
1 151 . 16 1 1 A 14 14 TYR H H 368 8.111 7.755 0.356 1
1 152 . 16 1 1 A 14 14 TYR HA H 368 4.339 4.711 -0.372 1
1 159 . 16 1 1 A 14 14 TYR C C 368 173.916 176.682 -2.766 1
1 160 . 16 1 1 A 14 14 TYR CA C 368 56.572 58.932 -2.360 1
1 161 . 16 1 1 A 14 14 TYR CB C 368 35.879 37.648 -1.769 1
1 164 . 16 1 1 A 14 14 TYR N N 368 120.541 118.433 2.108 1
1 165 . 16 1 1 A 15 15 GLU H H 369 8.287 8.004 0.283 1
1 166 . 16 1 1 A 15 15 GLU HA H 369 4.009 4.310 -0.301 1
1 171 . 16 1 1 A 15 15 GLU C C 369 174.448 178.253 -3.805 1
1 172 . 16 1 1 A 15 15 GLU CA C 369 55.047 59.159 -4.112 1
1 173 . 16 1 1 A 15 15 GLU CB C 369 27.226 29.796 -2.570 1
1 175 . 16 1 1 A 15 15 GLU N N 369 120.398 122.626 -2.228 1
1 176 . 16 1 1 A 16 16 LEU H H 370 7.785 7.513 0.272 1
1 177 . 16 1 1 A 16 16 LEU HA H 370 4.138 4.324 -0.186 1
1 187 . 16 1 1 A 16 16 LEU C C 370 175.089 177.817 -2.728 1
1 188 . 16 1 1 A 16 16 LEU CA C 370 53.425 55.026 -1.601 1
1 189 . 16 1 1 A 16 16 LEU CB C 370 39.554 41.539 -1.985 1
1 193 . 16 1 1 A 16 16 LEU N N 370 121.323 117.372 3.951 1
1 194 . 16 1 1 A 17 17 TYR H H 371 8.038 7.885 0.153 1
1 195 . 16 1 1 A 17 17 TYR HA H 371 4.380 4.420 -0.040 1
1 202 . 16 1 1 A 17 17 TYR C C 371 173.931 175.849 -1.918 1
1 203 . 16 1 1 A 17 17 TYR CA C 371 56.143 61.244 -5.101 1
1 204 . 16 1 1 A 17 17 TYR CB C 371 35.501 37.571 -2.070 1
1 207 . 16 1 1 A 17 17 TYR N N 371 119.465 120.411 -0.946 1
1 208 . 16 1 1 A 18 18 CYS H H 372 8.021 7.335 0.686 1
1 209 . 16 1 1 A 18 18 CYS HA H 372 4.236 3.849 0.387 1
1 212 . 16 1 1 A 18 18 CYS C C 372 172.457 174.638 -2.181 1
1 213 . 16 1 1 A 18 18 CYS CA C 372 56.997 59.646 -2.649 1
1 214 . 16 1 1 A 18 18 CYS CB C 372 25.080 26.064 -0.984 1
1 215 . 16 1 1 A 18 18 CYS N N 372 119.913 114.647 5.266 1
1 216 . 16 1 1 A 19 19 GLU H H 373 8.151 7.926 0.225 1
1 217 . 16 1 1 A 19 19 GLU HA H 373 4.130 4.196 -0.066 1
1 222 . 16 1 1 A 19 19 GLU C C 373 174.151 176.702 -2.551 1
1 223 . 16 1 1 A 19 19 GLU CA C 373 54.535 59.131 -4.596 1
1 224 . 16 1 1 A 19 19 GLU CB C 373 27.244 30.504 -3.260 1
1 226 . 16 1 1 A 19 19 GLU N N 373 122.431 123.221 -0.790 1
1 227 . 16 1 1 A 20 20 MET H H 374 8.109 7.736 0.373 1
1 228 . 16 1 1 A 20 20 MET HA H 374 4.352 4.803 -0.451 1
1 236 . 16 1 1 A 20 20 MET C C 374 174.200 176.164 -1.964 1
1 237 . 16 1 1 A 20 20 MET CA C 374 53.238 53.839 -0.601 1
1 238 . 16 1 1 A 20 20 MET CB C 374 30.237 35.014 -4.777 1
1 241 . 16 1 1 A 20 20 MET N N 374 119.754 118.738 1.016 1
1 242 . 16 1 1 A 21 21 GLY H H 375 8.231 8.699 -0.468 1
1 243 . 16 1 1 A 21 21 GLY HA2 H 375 3.861 4.081 -0.220 1
1 244 . 16 1 1 A 21 21 GLY HA3 H 375 3.960 4.097 -0.137 1
1 245 . 16 1 1 A 21 21 GLY C C 375 171.928 172.573 -0.645 1
1 246 . 16 1 1 A 21 21 GLY CA C 375 42.930 44.228 -1.298 1
1 247 . 16 1 1 A 21 21 GLY N N 375 109.484 113.732 -4.248 1
1 248 . 16 1 1 A 22 22 SER HA H 376 4.492 4.870 -0.378 1
1 251 . 16 1 1 A 22 22 SER C C 376 172.206 173.036 -0.830 1
1 252 . 16 1 1 A 22 22 SER CA C 376 55.570 57.087 -1.517 1
1 253 . 16 1 1 A 22 22 SER CB C 376 61.525 64.511 -2.986 1
1 254 . 16 1 1 A 23 23 THR H H 377 8.470 9.102 -0.632 1
1 255 . 16 1 1 A 23 23 THR HA H 377 4.295 4.266 0.029 1
1 260 . 16 1 1 A 23 23 THR C C 377 171.811 174.699 -2.888 1
1 261 . 16 1 1 A 23 23 THR CA C 377 58.937 63.718 -4.781 1
1 262 . 16 1 1 A 23 23 THR CB C 377 67.250 68.662 -1.412 1
1 264 . 16 1 1 A 23 23 THR N N 377 124.043 124.013 0.030 1
1 265 . 16 1 1 A 24 24 PHE H H 378 8.374 9.043 -0.669 1
1 266 . 16 1 1 A 24 24 PHE HA H 378 4.239 4.132 0.107 1
1 273 . 16 1 1 A 24 24 PHE C C 378 173.411 178.049 -4.638 1
1 274 . 16 1 1 A 24 24 PHE CA C 378 56.697 61.231 -4.534 1
1 275 . 16 1 1 A 24 24 PHE CB C 378 36.538 39.170 -2.632 1
1 278 . 16 1 1 A 24 24 PHE N N 378 124.732 127.002 -2.270 1
1 279 . 16 1 1 A 25 25 GLN H H 379 8.457 8.010 0.447 1
1 280 . 16 1 1 A 25 25 GLN HA H 379 4.038 4.158 -0.120 1
1 287 . 16 1 1 A 25 25 GLN C C 379 172.431 176.209 -3.778 1
1 288 . 16 1 1 A 25 25 GLN CA C 379 54.078 57.228 -3.150 1
1 289 . 16 1 1 A 25 25 GLN CB C 379 26.414 29.218 -2.804 1
1 291 . 16 1 1 A 25 25 GLN N N 379 118.820 118.015 0.805 1
1 293 . 16 1 1 A 26 26 LEU H H 380 6.985 7.204 -0.219 1
1 294 . 16 1 1 A 26 26 LEU HA H 380 4.229 4.202 0.027 1
1 304 . 16 1 1 A 26 26 LEU C C 380 173.895 176.819 -2.924 1
1 305 . 16 1 1 A 26 26 LEU CA C 380 52.123 55.038 -2.915 1
1 306 . 16 1 1 A 26 26 LEU CB C 380 40.543 42.482 -1.939 1
1 310 . 16 1 1 A 26 26 LEU N N 380 119.079 122.484 -3.405 1
1 311 . 16 1 1 A 27 27 CYS H H 381 8.905 8.912 -0.007 1
1 312 . 16 1 1 A 27 27 CYS HA H 381 4.013 4.587 -0.574 1
1 315 . 16 1 1 A 27 27 CYS C C 381 174.439 176.209 -1.770 1
1 316 . 16 1 1 A 27 27 CYS CA C 381 57.847 58.951 -1.104 1
1 317 . 16 1 1 A 27 27 CYS CB C 381 28.648 27.850 0.798 1
1 318 . 16 1 1 A 27 27 CYS N N 381 125.151 123.521 1.630 1
1 319 . 16 1 1 A 28 28 LYS H H 382 9.351 9.004 0.347 1
1 320 . 16 1 1 A 28 28 LYS HA H 382 4.157 4.290 -0.133 1
1 329 . 16 1 1 A 28 28 LYS C C 382 174.678 177.880 -3.202 1
1 330 . 16 1 1 A 28 28 LYS CA C 382 54.324 58.362 -4.038 1
1 331 . 16 1 1 A 28 28 LYS CB C 382 30.086 32.328 -2.242 1
1 335 . 16 1 1 A 28 28 LYS N N 382 128.840 127.687 1.153 1
1 336 . 16 1 1 A 29 29 ILE H H 383 9.040 7.853 1.187 1
1 337 . 16 1 1 A 29 29 ILE HA H 383 3.804 3.684 0.120 1
1 347 . 16 1 1 A 29 29 ILE C C 383 174.239 177.407 -3.168 1
1 348 . 16 1 1 A 29 29 ILE CA C 383 62.114 64.111 -1.997 1
1 349 . 16 1 1 A 29 29 ILE CB C 383 33.870 38.381 -4.511 1
1 353 . 16 1 1 A 29 29 ILE N N 383 122.718 118.817 3.901 1
1 354 . 16 1 1 A 30 30 CYS H H 384 7.572 7.319 0.253 1
1 355 . 16 1 1 A 30 30 CYS HA H 384 4.548 4.450 0.098 1
1 358 . 16 1 1 A 30 30 CYS C C 384 172.978 175.168 -2.190 1
1 359 . 16 1 1 A 30 30 CYS CA C 384 54.957 59.797 -4.840 1
1 360 . 16 1 1 A 30 30 CYS CB C 384 29.778 29.657 0.121 1
1 361 . 16 1 1 A 30 30 CYS N N 384 116.356 115.765 0.591 1
1 362 . 16 1 1 A 31 31 ALA H H 385 8.205 8.600 -0.395 1
1 363 . 16 1 1 A 31 31 ALA HA H 385 4.107 4.116 -0.009 1
1 367 . 16 1 1 A 31 31 ALA C C 385 173.139 177.212 -4.073 1
1 368 . 16 1 1 A 31 31 ALA CA C 385 50.802 53.429 -2.627 1
1 369 . 16 1 1 A 31 31 ALA CB C 385 14.634 17.854 -3.220 1
1 370 . 16 1 1 A 31 31 ALA N N 385 125.526 120.853 4.673 1
1 371 . 16 1 1 A 32 32 GLU H H 386 8.416 8.153 0.263 1
1 372 . 16 1 1 A 32 32 GLU HA H 386 4.467 4.447 0.020 1
1 377 . 16 1 1 A 32 32 GLU C C 386 172.325 176.093 -3.768 1
1 378 . 16 1 1 A 32 32 GLU CA C 386 55.146 57.154 -2.008 1
1 379 . 16 1 1 A 32 32 GLU CB C 386 31.181 32.224 -1.043 1
1 381 . 16 1 1 A 32 32 GLU N N 386 117.579 115.253 2.326 1
1 382 . 16 1 1 A 33 33 ASN H H 387 7.872 7.772 0.100 1
1 383 . 16 1 1 A 33 33 ASN HA H 387 4.900 4.917 -0.017 1
1 388 . 16 1 1 A 33 33 ASN C C 387 171.355 174.801 -3.446 1
1 389 . 16 1 1 A 33 33 ASN CA C 387 49.320 52.133 -2.813 1
1 390 . 16 1 1 A 33 33 ASN CB C 387 38.457 39.746 -1.289 1
1 391 . 16 1 1 A 33 33 ASN N N 387 120.399 116.457 3.942 1
1 393 . 16 1 1 A 34 34 ASP H H 388 8.565 8.672 -0.107 1
1 394 . 16 1 1 A 34 34 ASP HA H 388 4.679 4.824 -0.145 1
1 397 . 16 1 1 A 34 34 ASP C C 388 174.243 176.726 -2.483 1
1 398 . 16 1 1 A 34 34 ASP CA C 388 51.809 53.439 -1.630 1
1 399 . 16 1 1 A 34 34 ASP CB C 388 38.007 42.090 -4.083 1
1 400 . 16 1 1 A 34 34 ASP N N 388 120.661 120.639 0.022 1
1 401 . 16 1 1 A 35 35 LYS H H 389 8.544 9.175 -0.631 1
1 402 . 16 1 1 A 35 35 LYS HA H 389 3.411 4.283 -0.872 1
1 409 . 16 1 1 A 35 35 LYS C C 389 172.938 176.293 -3.355 1
1 410 . 16 1 1 A 35 35 LYS CA C 389 54.973 56.830 -1.857 1
1 411 . 16 1 1 A 35 35 LYS CB C 389 30.617 32.170 -1.553 1
1 415 . 16 1 1 A 35 35 LYS N N 389 119.199 121.355 -2.156 1
1 416 . 16 1 1 A 36 36 ASP H H 390 8.327 9.216 -0.889 1
1 417 . 16 1 1 A 36 36 ASP HA H 390 4.724 4.784 -0.060 1
1 420 . 16 1 1 A 36 36 ASP C C 390 172.860 175.431 -2.571 1
1 421 . 16 1 1 A 36 36 ASP CA C 390 51.609 54.772 -3.163 1
1 422 . 16 1 1 A 36 36 ASP CB C 390 39.018 43.252 -4.234 1
1 423 . 16 1 1 A 36 36 ASP N N 390 119.134 126.458 -7.324 1
1 424 . 16 1 1 A 37 37 VAL H H 391 8.544 8.088 0.456 1
1 425 . 16 1 1 A 37 37 VAL HA H 391 4.877 4.681 0.196 1
1 433 . 16 1 1 A 37 37 VAL C C 391 167.519 173.160 -5.641 1
1 434 . 16 1 1 A 37 37 VAL CA C 391 58.259 59.993 -1.734 1
1 435 . 16 1 1 A 37 37 VAL CB C 391 32.277 35.453 -3.176 1
1 438 . 16 1 1 A 37 37 VAL N N 391 121.970 117.648 4.322 1
1 439 . 16 1 1 A 38 38 LYS H H 392 8.621 9.506 -0.885 1
1 440 . 16 1 1 A 38 38 LYS HA H 392 4.991 5.154 -0.163 1
1 449 . 16 1 1 A 38 38 LYS C C 392 172.681 175.260 -2.579 1
1 450 . 16 1 1 A 38 38 LYS CA C 392 51.123 54.769 -3.646 1
1 451 . 16 1 1 A 38 38 LYS CB C 392 33.697 34.488 -0.791 1
1 455 . 16 1 1 A 38 38 LYS N N 392 126.381 128.694 -2.313 1
1 456 . 16 1 1 A 39 39 ILE H H 393 8.723 8.995 -0.272 1
1 457 . 16 1 1 A 39 39 ILE HA H 393 4.239 4.356 -0.117 1
1 467 . 16 1 1 A 39 39 ILE C C 393 172.642 175.723 -3.081 1
1 468 . 16 1 1 A 39 39 ILE CA C 393 57.768 61.052 -3.284 1
1 469 . 16 1 1 A 39 39 ILE CB C 393 35.691 37.568 -1.877 1
1 473 . 16 1 1 A 39 39 ILE N N 393 126.398 128.117 -1.719 1
1 474 . 16 1 1 A 40 40 GLU H H 394 8.506 9.351 -0.845 1
1 475 . 16 1 1 A 40 40 GLU HA H 394 4.753 4.731 0.022 1
1 480 . 16 1 1 A 40 40 GLU C C 394 173.596 176.287 -2.691 1
1 481 . 16 1 1 A 40 40 GLU CA C 394 49.793 53.259 -3.466 1
1 482 . 16 1 1 A 40 40 GLU CB C 394 28.210 30.614 -2.404 1
1 484 . 16 1 1 A 40 40 GLU N N 394 124.864 128.036 -3.172 1
1 485 . 16 1 1 A 41 41 PRO HA H 395 4.864 4.479 0.385 1
1 492 . 16 1 1 A 41 41 PRO C C 395 175.073 177.122 -2.049 1
1 493 . 16 1 1 A 41 41 PRO CA C 395 61.111 63.869 -2.758 1
1 494 . 16 1 1 A 41 41 PRO CB C 395 32.275 32.907 -0.632 1
1 497 . 16 1 1 A 42 42 CYS H H 396 7.828 7.829 -0.001 1
1 498 . 16 1 1 A 42 42 CYS HA H 396 4.208 4.047 0.161 1
1 501 . 16 1 1 A 42 42 CYS C C 396 173.877 175.018 -1.141 1
1 502 . 16 1 1 A 42 42 CYS CA C 396 58.021 61.444 -3.423 1
1 503 . 16 1 1 A 42 42 CYS CB C 396 28.242 27.332 0.910 1
1 504 . 16 1 1 A 42 42 CYS N N 396 122.434 117.936 4.498 1
1 505 . 16 1 1 A 43 43 GLY H H 397 8.679 8.830 -0.151 1
1 506 . 16 1 1 A 43 43 GLY HA2 H 397 3.507 3.909 -0.402 1
1 507 . 16 1 1 A 43 43 GLY HA3 H 397 3.914 3.913 0.001 1
1 508 . 16 1 1 A 43 43 GLY C C 397 171.981 174.889 -2.908 1
1 509 . 16 1 1 A 43 43 GLY CA C 397 43.347 45.540 -2.193 1
1 510 . 16 1 1 A 43 43 GLY N N 397 112.123 108.602 3.521 1
1 511 . 16 1 1 A 44 44 HIS H H 398 8.329 7.813 0.516 1
1 512 . 16 1 1 A 44 44 HIS HA H 398 4.339 4.451 -0.112 1
1 517 . 16 1 1 A 44 44 HIS C C 398 170.742 174.950 -4.208 1
1 518 . 16 1 1 A 44 44 HIS CA C 398 58.368 56.251 2.117 1
1 519 . 16 1 1 A 44 44 HIS CB C 398 28.434 30.763 -2.329 1
1 522 . 16 1 1 A 44 44 HIS N N 398 121.393 118.465 2.928 1
1 523 . 16 1 1 A 45 45 LEU H H 399 8.241 8.635 -0.394 1
1 524 . 16 1 1 A 45 45 LEU HA H 399 5.570 5.287 0.283 1
1 534 . 16 1 1 A 45 45 LEU C C 399 174.464 175.309 -0.845 1
1 535 . 16 1 1 A 45 45 LEU CA C 399 50.729 53.327 -2.598 1
1 536 . 16 1 1 A 45 45 LEU CB C 399 43.574 45.084 -1.510 1
1 540 . 16 1 1 A 45 45 LEU N N 399 118.469 122.057 -3.588 1
1 541 . 16 1 1 A 46 46 MET H H 400 8.707 8.881 -0.174 1
1 542 . 16 1 1 A 46 46 MET HA H 400 4.842 5.055 -0.213 1
1 550 . 16 1 1 A 46 46 MET C C 400 170.736 174.200 -3.464 1
1 551 . 16 1 1 A 46 46 MET CA C 400 52.804 54.048 -1.244 1
1 552 . 16 1 1 A 46 46 MET CB C 400 31.945 35.417 -3.472 1
1 555 . 16 1 1 A 46 46 MET N N 400 114.897 120.643 -5.746 1
1 556 . 16 1 1 A 47 47 CYS H H 401 9.436 8.375 1.061 1
1 557 . 16 1 1 A 47 47 CYS HA H 401 5.629 4.847 0.782 1
1 560 . 16 1 1 A 47 47 CYS C C 401 173.909 176.030 -2.121 1
1 561 . 16 1 1 A 47 47 CYS CA C 401 54.325 57.263 -2.938 1
1 562 . 16 1 1 A 47 47 CYS CB C 401 30.725 28.945 1.780 1
1 563 . 16 1 1 A 47 47 CYS N N 401 119.575 119.088 0.487 1
1 564 . 16 1 1 A 48 48 THR H H 402 9.842 8.791 1.051 1
1 565 . 16 1 1 A 48 48 THR HA H 402 3.768 3.979 -0.211 1
1 570 . 16 1 1 A 48 48 THR C C 402 174.333 176.204 -1.871 1
1 571 . 16 1 1 A 48 48 THR CA C 402 64.516 65.930 -1.414 1
1 572 . 16 1 1 A 48 48 THR CB C 402 66.288 68.648 -2.360 1
1 574 . 16 1 1 A 48 48 THR N N 402 119.945 119.137 0.808 1
1 575 . 16 1 1 A 49 49 SER H H 403 8.355 8.040 0.315 1
1 576 . 16 1 1 A 49 49 SER HA H 403 4.222 4.079 0.143 1
1 579 . 16 1 1 A 49 49 SER C C 403 175.059 176.844 -1.785 1
1 580 . 16 1 1 A 49 49 SER CA C 403 59.828 61.839 -2.011 1
1 581 . 16 1 1 A 49 49 SER CB C 403 59.717 62.565 -2.848 1
1 582 . 16 1 1 A 49 49 SER N N 403 120.468 116.934 3.534 1
1 583 . 16 1 1 A 50 50 CYS H H 404 9.464 7.894 1.570 1
1 584 . 16 1 1 A 50 50 CYS HA H 404 3.922 4.152 -0.230 1
1 587 . 16 1 1 A 50 50 CYS C C 404 176.081 177.011 -0.930 1
1 588 . 16 1 1 A 50 50 CYS CA C 404 63.076 64.119 -1.043 1
1 589 . 16 1 1 A 50 50 CYS CB C 404 26.078 27.270 -1.192 1
1 590 . 16 1 1 A 50 50 CYS N N 404 126.744 119.371 7.373 1
1 591 . 16 1 1 A 51 51 LEU H H 405 7.948 8.028 -0.080 1
1 592 . 16 1 1 A 51 51 LEU HA H 405 4.064 4.155 -0.091 1
1 602 . 16 1 1 A 51 51 LEU C C 405 175.495 178.869 -3.374 1
1 603 . 16 1 1 A 51 51 LEU CA C 405 55.914 58.173 -2.259 1
1 604 . 16 1 1 A 51 51 LEU CB C 405 38.662 41.842 -3.180 1
1 607 . 16 1 1 A 51 51 LEU N N 405 121.951 123.314 -1.363 1
1 608 . 16 1 1 A 52 52 THR H H 406 8.786 8.703 0.083 1
1 609 . 16 1 1 A 52 52 THR HA H 406 4.024 3.977 0.047 1
1 614 . 16 1 1 A 52 52 THR C C 406 174.139 176.427 -2.288 1
1 615 . 16 1 1 A 52 52 THR CA C 406 64.017 66.709 -2.692 1
1 616 . 16 1 1 A 52 52 THR CB C 406 66.115 68.171 -2.056 1
1 618 . 16 1 1 A 52 52 THR N N 406 115.258 115.008 0.250 1
1 619 . 16 1 1 A 53 53 SER H H 407 8.115 8.093 0.022 1
1 620 . 16 1 1 A 53 53 SER HA H 407 4.204 4.124 0.080 1
1 623 . 16 1 1 A 53 53 SER C C 407 174.456 177.041 -2.585 1
1 624 . 16 1 1 A 53 53 SER CA C 407 59.090 61.404 -2.314 1
1 625 . 16 1 1 A 53 53 SER CB C 407 60.146 63.141 -2.995 1
1 626 . 16 1 1 A 53 53 SER N N 407 116.852 114.966 1.886 1
1 627 . 16 1 1 A 54 54 TRP H H 408 8.123 8.158 -0.035 1
1 628 . 16 1 1 A 54 54 TRP HA H 408 4.371 4.287 0.084 1
1 637 . 16 1 1 A 54 54 TRP C C 408 175.981 178.711 -2.730 1
1 638 . 16 1 1 A 54 54 TRP CA C 408 57.323 60.687 -3.364 1
1 639 . 16 1 1 A 54 54 TRP CB C 408 26.812 29.478 -2.666 1
1 645 . 16 1 1 A 54 54 TRP N N 408 123.556 123.157 0.399 1
1 647 . 16 1 1 A 55 55 GLN H H 409 8.502 8.912 -0.410 1
1 648 . 16 1 1 A 55 55 GLN HA H 409 3.999 3.678 0.321 1
1 655 . 16 1 1 A 55 55 GLN C C 409 177.300 178.574 -1.274 1
1 656 . 16 1 1 A 55 55 GLN CA C 409 56.484 59.254 -2.770 1
1 657 . 16 1 1 A 55 55 GLN CB C 409 26.190 28.616 -2.426 1
1 659 . 16 1 1 A 55 55 GLN N N 409 118.044 117.854 0.190 1
1 661 . 16 1 1 A 56 56 GLU H H 410 8.467 8.450 0.017 1
1 662 . 16 1 1 A 56 56 GLU HA H 410 4.057 4.106 -0.049 1
1 667 . 16 1 1 A 56 56 GLU C C 410 174.787 176.995 -2.208 1
1 668 . 16 1 1 A 56 56 GLU CA C 410 55.909 58.296 -2.387 1
1 669 . 16 1 1 A 56 56 GLU CB C 410 26.895 29.376 -2.481 1
1 671 . 16 1 1 A 56 56 GLU N N 410 119.448 118.263 1.185 1
1 672 . 16 1 1 A 57 57 SER H H 411 7.438 7.525 -0.087 1
1 673 . 16 1 1 A 57 57 SER HA H 411 4.607 4.533 0.074 1
1 676 . 16 1 1 A 57 57 SER C C 411 170.849 173.898 -3.049 1
1 677 . 16 1 1 A 57 57 SER CA C 411 55.540 57.542 -2.002 1
1 678 . 16 1 1 A 57 57 SER CB C 411 60.928 63.070 -2.142 1
1 679 . 16 1 1 A 57 57 SER N N 411 113.752 113.555 0.197 1
1 680 . 16 1 1 A 58 58 GLU H H 412 7.855 7.770 0.085 1
1 681 . 16 1 1 A 58 58 GLU HA H 412 3.772 3.994 -0.222 1
1 686 . 16 1 1 A 58 58 GLU C C 412 173.743 175.301 -1.558 1
1 687 . 16 1 1 A 58 58 GLU CA C 412 54.442 56.878 -2.436 1
1 688 . 16 1 1 A 58 58 GLU CB C 412 24.603 28.359 -3.756 1
1 690 . 16 1 1 A 58 58 GLU N N 412 115.908 118.083 -2.175 1
1 691 . 16 1 1 A 59 59 GLY H H 413 7.588 8.211 -0.623 1
1 692 . 16 1 1 A 59 59 GLY HA2 H 413 1.643 3.609 -1.966 1
1 693 . 16 1 1 A 59 59 GLY HA3 H 413 2.949 3.704 -0.755 1
1 694 . 16 1 1 A 59 59 GLY C C 413 170.850 173.864 -3.014 1
1 695 . 16 1 1 A 59 59 GLY CA C 413 41.724 44.549 -2.825 1
1 696 . 16 1 1 A 59 59 GLY N N 413 108.032 110.880 -2.848 1
1 697 . 16 1 1 A 60 60 GLN H H 414 7.973 8.920 -0.947 1
1 698 . 16 1 1 A 60 60 GLN HA H 414 4.366 4.452 -0.086 1
1 705 . 16 1 1 A 60 60 GLN C C 414 173.108 175.502 -2.394 1
1 706 . 16 1 1 A 60 60 GLN CA C 414 52.422 55.721 -3.299 1
1 707 . 16 1 1 A 60 60 GLN CB C 414 27.049 30.018 -2.969 1
1 709 . 16 1 1 A 60 60 GLN N N 414 122.690 125.714 -3.024 1
1 711 . 16 1 1 A 61 61 GLY H H 415 8.301 7.739 0.562 1
1 712 . 16 1 1 A 61 61 GLY HA2 H 415 3.700 4.119 -0.419 1
1 713 . 16 1 1 A 61 61 GLY HA3 H 415 3.920 4.145 -0.225 1
1 714 . 16 1 1 A 61 61 GLY C C 415 170.249 172.023 -1.774 1
1 715 . 16 1 1 A 61 61 GLY CA C 415 42.210 45.837 -3.627 1
1 716 . 16 1 1 A 61 61 GLY N N 415 110.794 107.897 2.897 1
1 717 . 16 1 1 A 62 62 CYS H H 416 8.549 8.851 -0.302 1
1 718 . 16 1 1 A 62 62 CYS HA H 416 4.227 4.650 -0.423 1
1 721 . 16 1 1 A 62 62 CYS C C 416 172.914 175.146 -2.232 1
1 722 . 16 1 1 A 62 62 CYS CA C 416 54.008 58.686 -4.678 1
1 723 . 16 1 1 A 62 62 CYS CB C 416 29.716 27.319 2.397 1
1 724 . 16 1 1 A 62 62 CYS N N 416 123.683 120.584 3.099 1
1 725 . 16 1 1 A 63 63 PRO HA H 417 2.611 2.487 0.124 1
1 732 . 16 1 1 A 63 63 PRO C C 417 174.143 178.082 -3.939 1
1 733 . 16 1 1 A 63 63 PRO CA C 417 61.689 63.992 -2.303 1
1 734 . 16 1 1 A 63 63 PRO CB C 417 28.534 31.114 -2.580 1
1 737 . 16 1 1 A 64 64 PHE H H 418 8.968 7.743 1.225 1
1 738 . 16 1 1 A 64 64 PHE HA H 418 4.250 4.072 0.178 1
1 746 . 16 1 1 A 64 64 PHE C C 418 174.243 178.074 -3.831 1
1 747 . 16 1 1 A 64 64 PHE CA C 418 56.720 60.454 -3.734 1
1 748 . 16 1 1 A 64 64 PHE CB C 418 36.458 39.147 -2.689 1
1 752 . 16 1 1 A 64 64 PHE N N 418 117.008 115.915 1.093 1
1 753 . 16 1 1 A 65 65 CYS H H 419 7.968 7.925 0.043 1
1 754 . 16 1 1 A 65 65 CYS HA H 419 4.906 4.490 0.416 1
1 757 . 16 1 1 A 65 65 CYS C C 419 173.198 174.725 -1.527 1
1 758 . 16 1 1 A 65 65 CYS CA C 419 55.870 59.598 -3.728 1
1 759 . 16 1 1 A 65 65 CYS CB C 419 30.559 28.896 1.663 1
1 760 . 16 1 1 A 65 65 CYS N N 419 117.505 117.570 -0.065 1
1 761 . 16 1 1 A 66 66 ARG H H 420 8.761 8.153 0.608 1
1 762 . 16 1 1 A 66 66 ARG HA H 420 4.365 4.319 0.046 1
1 769 . 16 1 1 A 66 66 ARG C C 420 172.921 174.485 -1.564 1
1 770 . 16 1 1 A 66 66 ARG CA C 420 54.763 57.235 -2.472 1
1 771 . 16 1 1 A 66 66 ARG CB C 420 24.286 26.933 -2.647 1
1 774 . 16 1 1 A 66 66 ARG N N 420 118.763 116.092 2.671 1
1 775 . 16 1 1 A 67 67 CYS H H 421 8.223 7.919 0.304 1
1 776 . 16 1 1 A 67 67 CYS HA H 421 4.419 4.648 -0.229 1
1 779 . 16 1 1 A 67 67 CYS C C 421 171.160 174.834 -3.674 1
1 780 . 16 1 1 A 67 67 CYS CA C 421 57.119 57.894 -0.775 1
1 781 . 16 1 1 A 67 67 CYS CB C 421 25.911 29.678 -3.767 1
1 782 . 16 1 1 A 67 67 CYS N N 421 120.627 116.515 4.112 1
1 783 . 16 1 1 A 68 68 GLU H H 422 8.416 8.544 -0.128 1
1 784 . 16 1 1 A 68 68 GLU HA H 422 4.025 4.129 -0.104 1
1 789 . 16 1 1 A 68 68 GLU C C 422 173.764 176.396 -2.632 1
1 790 . 16 1 1 A 68 68 GLU CA C 422 54.752 57.701 -2.949 1
1 791 . 16 1 1 A 68 68 GLU CB C 422 27.302 29.770 -2.468 1
1 793 . 16 1 1 A 68 68 GLU N N 422 122.370 121.247 1.123 1
1 794 . 16 1 1 A 69 69 ILE H H 423 8.648 8.870 -0.222 1
1 795 . 16 1 1 A 69 69 ILE HA H 423 4.012 4.658 -0.646 1
1 805 . 16 1 1 A 69 69 ILE C C 423 174.257 175.482 -1.225 1
1 806 . 16 1 1 A 69 69 ILE CA C 423 59.740 60.532 -0.792 1
1 807 . 16 1 1 A 69 69 ILE CB C 423 35.846 39.788 -3.942 1
1 811 . 16 1 1 A 69 69 ILE N N 423 125.988 125.352 0.636 1
1 812 . 16 1 1 A 70 70 LYS H H 424 9.185 9.225 -0.040 1
1 813 . 16 1 1 A 70 70 LYS HA H 424 4.434 4.626 -0.192 1
1 822 . 16 1 1 A 70 70 LYS C C 424 173.880 176.733 -2.853 1
1 823 . 16 1 1 A 70 70 LYS CA C 424 53.378 56.689 -3.311 1
1 824 . 16 1 1 A 70 70 LYS CB C 424 30.397 35.337 -4.940 1
1 828 . 16 1 1 A 70 70 LYS N N 424 128.977 126.098 2.879 1
1 829 . 16 1 1 A 71 71 GLY H H 425 7.810 7.908 -0.098 1
1 830 . 16 1 1 A 71 71 GLY HA2 H 425 4.094 4.104 -0.010 1
1 831 . 16 1 1 A 71 71 GLY HA3 H 425 4.159 4.107 0.052 1
1 832 . 16 1 1 A 71 71 GLY C C 425 168.179 172.491 -4.312 1
1 833 . 16 1 1 A 71 71 GLY CA C 425 42.326 44.549 -2.223 1
1 834 . 16 1 1 A 71 71 GLY N N 425 107.696 103.949 3.747 1
1 835 . 16 1 1 A 72 72 THR H H 426 8.048 8.625 -0.577 1
1 836 . 16 1 1 A 72 72 THR HA H 426 5.258 5.347 -0.089 1
1 841 . 16 1 1 A 72 72 THR C C 426 170.979 172.136 -1.157 1
1 842 . 16 1 1 A 72 72 THR CA C 426 56.755 59.738 -2.983 1
1 843 . 16 1 1 A 72 72 THR CB C 426 69.226 71.614 -2.388 1
1 845 . 16 1 1 A 72 72 THR N N 426 109.122 110.982 -1.860 1
1 846 . 16 1 1 A 73 73 GLU H H 427 8.912 9.533 -0.621 1
1 847 . 16 1 1 A 73 73 GLU HA H 427 4.954 4.963 -0.009 1
1 852 . 16 1 1 A 73 73 GLU C C 427 170.353 174.465 -4.112 1
1 853 . 16 1 1 A 73 73 GLU CA C 427 50.182 52.963 -2.781 1
1 854 . 16 1 1 A 73 73 GLU CB C 427 30.559 32.737 -2.178 1
1 856 . 16 1 1 A 73 73 GLU N N 427 121.703 122.645 -0.942 1
1 1 . 16 1 1 A 74 74 PRO HA H 428 4.372 4.684 -0.312 1
1 2 . 16 1 1 A 74 74 PRO C C 428 173.839 176.489 -2.650 1
1 3 . 16 1 1 A 74 74 PRO CA C 428 60.241 62.898 -2.657 1
1 4 . 16 1 1 A 74 74 PRO CB C 428 29.299 31.881 -2.582 1
1 857 . 16 1 1 A 74 74 PRO HA H 428 4.782 4.684 0.098 1
1 864 . 16 1 1 A 74 74 PRO C C 428 174.027 176.489 -2.462 1
1 865 . 16 1 1 A 74 74 PRO CA C 428 59.771 62.898 -3.127 1
1 866 . 16 1 1 A 74 74 PRO CB C 428 29.633 31.881 -2.248 1
1 7 . 16 1 1 A 75 75 ILE H H 429 8.144 8.881 -0.737 1
1 8 . 16 1 1 A 75 75 ILE HA H 429 4.086 4.333 -0.247 1
1 15 . 16 1 1 A 75 75 ILE C C 429 173.426 175.000 -1.574 1
1 16 . 16 1 1 A 75 75 ILE CA C 429 58.339 60.989 -2.650 1
1 17 . 16 1 1 A 75 75 ILE CB C 429 35.988 37.739 -1.751 1
1 21 . 16 1 1 A 75 75 ILE N N 429 121.551 123.329 -1.778 1
1 869 . 16 1 1 A 75 75 ILE H H 429 7.682 8.881 -1.199 1
1 870 . 16 1 1 A 75 75 ILE HA H 429 4.282 4.333 -0.051 1
1 880 . 16 1 1 A 75 75 ILE C C 429 172.510 175.000 -2.490 1
1 881 . 16 1 1 A 75 75 ILE CA C 429 57.456 60.989 -3.533 1
1 882 . 16 1 1 A 75 75 ILE CB C 429 37.903 37.739 0.164 1
1 886 . 16 1 1 A 75 75 ILE N N 429 119.651 123.329 -3.678 1
1 1 . 16 1 1 A 76 76 VAL HA H 430 4.086 4.484 -0.398 1
1 2 . 16 1 1 A 76 76 VAL CA C 430 59.372 61.048 -1.676 1
1 22 . 16 1 1 A 76 76 VAL H H 430 8.221 8.909 -0.688 1
1 23 . 16 1 1 A 76 76 VAL HA H 430 4.083 4.484 -0.401 1
1 24 . 16 1 1 A 76 76 VAL C C 430 173.067 174.550 -1.483 1
1 25 . 16 1 1 A 76 76 VAL CA C 430 59.445 61.048 -1.603 1
1 26 . 16 1 1 A 76 76 VAL CB C 430 30.407 32.088 -1.681 1
1 27 . 16 1 1 A 76 76 VAL N N 430 125.930 127.339 -1.409 1
1 887 . 16 1 1 A 76 76 VAL H H 430 8.122 8.909 -0.787 1
1 888 . 16 1 1 A 76 76 VAL HA H 430 4.197 4.484 -0.287 1
1 890 . 16 1 1 A 76 76 VAL C C 430 172.971 174.550 -1.579 1
1 891 . 16 1 1 A 76 76 VAL CA C 430 58.821 61.048 -2.227 1
1 892 . 16 1 1 A 76 76 VAL CB C 430 30.807 32.088 -1.281 1
1 895 . 16 1 1 A 76 76 VAL N N 430 124.178 127.339 -3.161 1
1 4 . 16 1 1 A 77 77 VAL H H 431 8.204 8.212 -0.008 1
1 5 . 16 1 1 A 77 77 VAL HA H 431 4.049 4.512 -0.463 1
1 6 . 16 1 1 A 77 77 VAL C C 431 172.636 174.175 -1.539 1
1 7 . 16 1 1 A 77 77 VAL CA C 431 59.315 61.532 -2.217 1
1 8 . 16 1 1 A 77 77 VAL CB C 431 30.219 31.337 -1.118 1
1 9 . 16 1 1 A 77 77 VAL N N 431 125.320 123.196 2.124 1
1 28 . 16 1 1 A 77 77 VAL H H 431 8.412 8.212 0.200 1
1 29 . 16 1 1 A 77 77 VAL HA H 431 4.038 4.512 -0.474 1
1 37 . 16 1 1 A 77 77 VAL C C 431 172.617 174.175 -1.558 1
1 38 . 16 1 1 A 77 77 VAL CA C 431 59.137 61.532 -2.395 1
1 39 . 16 1 1 A 77 77 VAL CB C 431 30.292 31.337 -1.045 1
1 42 . 16 1 1 A 77 77 VAL N N 431 125.655 123.196 2.459 1
1 896 . 16 1 1 A 77 77 VAL H H 431 8.448 8.212 0.236 1
1 897 . 16 1 1 A 77 77 VAL HA H 431 4.087 4.512 -0.425 1
1 905 . 16 1 1 A 77 77 VAL C C 431 172.493 174.175 -1.682 1
1 906 . 16 1 1 A 77 77 VAL CA C 431 59.185 61.532 -2.347 1
1 907 . 16 1 1 A 77 77 VAL CB C 431 30.084 31.337 -1.253 1
1 910 . 16 1 1 A 77 77 VAL N N 431 125.770 123.196 2.574 1
1 43 . 16 1 1 A 78 78 ASP H H 432 8.419 8.243 0.176 1
1 44 . 16 1 1 A 78 78 ASP HA H 432 4.829 4.744 0.085 1
1 45 . 16 1 1 A 78 78 ASP C C 432 172.252 176.091 -3.839 1
1 46 . 16 1 1 A 78 78 ASP CA C 432 49.320 51.772 -2.452 1
1 47 . 16 1 1 A 78 78 ASP CB C 432 39.066 41.774 -2.708 1
1 48 . 16 1 1 A 78 78 ASP N N 432 126.226 128.385 -2.159 1
1 911 . 16 1 1 A 78 78 ASP H H 432 8.493 8.243 0.250 1
1 912 . 16 1 1 A 78 78 ASP HA H 432 4.852 4.744 0.108 1
1 915 . 16 1 1 A 78 78 ASP C C 432 172.048 176.091 -4.043 1
1 916 . 16 1 1 A 78 78 ASP CA C 432 49.233 51.772 -2.539 1
1 917 . 16 1 1 A 78 78 ASP CB C 432 38.858 41.774 -2.916 1
1 918 . 16 1 1 A 78 78 ASP N N 432 126.705 128.385 -1.680 1
1 10 . 16 1 1 A 79 79 PRO CA C 433 63.865 63.448 0.417 1
1 49 . 16 1 1 A 79 79 PRO C C 433 173.867 177.222 -3.355 1
1 919 . 16 1 1 A 79 79 PRO HA H 433 4.237 4.609 -0.372 1
1 926 . 16 1 1 A 79 79 PRO C C 433 173.812 177.222 -3.410 1
1 927 . 16 1 1 A 79 79 PRO CA C 433 60.627 63.448 -2.821 1
1 928 . 16 1 1 A 79 79 PRO CB C 433 29.329 31.288 -1.959 1
1 11 . 16 1 1 A 80 80 PHE H H 434 8.182 8.086 0.096 1
1 12 . 16 1 1 A 80 80 PHE HA H 434 4.499 4.196 0.303 1
1 13 . 16 1 1 A 80 80 PHE C C 434 171.680 174.779 -3.099 1
1 14 . 16 1 1 A 80 80 PHE CA C 434 54.657 61.447 -6.790 1
1 15 . 16 1 1 A 80 80 PHE CB C 434 36.272 39.599 -3.327 1
1 16 . 16 1 1 A 80 80 PHE N N 434 118.611 119.969 -1.358 1
1 50 . 16 1 1 A 80 80 PHE H H 434 8.191 8.086 0.105 1
1 51 . 16 1 1 A 80 80 PHE HA H 434 4.528 4.196 0.332 1
1 54 . 16 1 1 A 80 80 PHE C C 434 172.457 174.779 -2.322 1
1 55 . 16 1 1 A 80 80 PHE CA C 434 54.828 61.447 -6.619 1
1 56 . 16 1 1 A 80 80 PHE CB C 434 36.457 39.599 -3.142 1
1 57 . 16 1 1 A 80 80 PHE N N 434 118.871 119.969 -1.098 1
1 931 . 16 1 1 A 80 80 PHE H H 434 8.191 8.086 0.105 1
1 932 . 16 1 1 A 80 80 PHE HA H 434 4.463 4.196 0.267 1
1 939 . 16 1 1 A 80 80 PHE C C 434 172.283 174.779 -2.496 1
1 940 . 16 1 1 A 80 80 PHE CA C 434 54.971 61.447 -6.476 1
1 941 . 16 1 1 A 80 80 PHE CB C 434 36.490 39.599 -3.109 1
1 944 . 16 1 1 A 80 80 PHE N N 434 119.263 119.969 -0.706 1
1 17 . 16 1 1 A 81 81 ASP H H 435 7.490 7.930 -0.440 1
1 18 . 16 1 1 A 81 81 ASP HA H 435 4.698 5.053 -0.355 1
1 19 . 16 1 1 A 81 81 ASP C C 435 171.662 175.179 -3.517 1
1 20 . 16 1 1 A 81 81 ASP CA C 435 49.570 51.587 -2.017 1
1 21 . 16 1 1 A 81 81 ASP CB C 435 40.104 43.996 -3.892 1
1 22 . 16 1 1 A 81 81 ASP N N 435 120.304 114.406 5.898 1
1 58 . 16 1 1 A 81 81 ASP H H 435 7.881 7.930 -0.049 1
1 59 . 16 1 1 A 81 81 ASP HA H 435 4.801 5.053 -0.252 1
1 60 . 16 1 1 A 81 81 ASP C C 435 171.144 175.179 -4.035 1
1 61 . 16 1 1 A 81 81 ASP CA C 435 49.406 51.587 -2.181 1
1 62 . 16 1 1 A 81 81 ASP CB C 435 38.618 43.996 -5.378 1
1 63 . 16 1 1 A 81 81 ASP N N 435 123.108 114.406 8.702 1
1 945 . 16 1 1 A 81 81 ASP H H 435 7.823 7.930 -0.107 1
1 946 . 16 1 1 A 81 81 ASP HA H 435 4.759 5.053 -0.294 1
1 949 . 16 1 1 A 81 81 ASP C C 435 171.057 175.179 -4.122 1
1 950 . 16 1 1 A 81 81 ASP CA C 435 49.174 51.587 -2.413 1
1 951 . 16 1 1 A 81 81 ASP CB C 435 38.725 43.996 -5.271 1
1 952 . 16 1 1 A 81 81 ASP N N 435 123.530 114.406 9.124 1
1 23 . 16 1 1 A 82 82 PRO HA H 436 4.758 4.587 0.171 1
1 24 . 16 1 1 A 82 82 PRO C C 436 172.944 175.702 -2.758 1
1 25 . 16 1 1 A 82 82 PRO CA C 436 60.134 63.722 -3.588 1
1 26 . 16 1 1 A 82 82 PRO CB C 436 31.425 32.323 -0.898 1
1 64 . 16 1 1 A 82 82 PRO HA H 436 4.364 4.587 -0.223 1
1 67 . 16 1 1 A 82 82 PRO C C 436 173.563 175.702 -2.139 1
1 68 . 16 1 1 A 82 82 PRO CA C 436 60.729 63.722 -2.993 1
1 69 . 16 1 1 A 82 82 PRO CB C 436 29.160 32.323 -3.163 1
1 953 . 16 1 1 A 82 82 PRO HA H 436 4.296 4.587 -0.291 1
1 960 . 16 1 1 A 82 82 PRO C C 436 173.494 175.702 -2.208 1
1 961 . 16 1 1 A 82 82 PRO CA C 436 60.625 63.722 -3.097 1
1 962 . 16 1 1 A 82 82 PRO CB C 436 29.237 32.323 -3.086 1
1 1 . 17 1 1 A 3 3 LEU HA H 357 4.257 4.264 -0.007 1
1 11 . 17 1 1 A 3 3 LEU C C 357 174.994 176.392 -1.398 1
1 12 . 17 1 1 A 3 3 LEU CA C 357 53.329 56.708 -3.379 1
1 13 . 17 1 1 A 3 3 LEU CB C 357 39.382 42.683 -3.301 1
1 17 . 17 1 1 A 4 4 GLN H H 358 8.234 7.554 0.680 1
1 18 . 17 1 1 A 4 4 GLN HA H 358 4.211 4.733 -0.522 1
1 25 . 17 1 1 A 4 4 GLN C C 358 173.357 174.185 -0.828 1
1 26 . 17 1 1 A 4 4 GLN CA C 358 53.791 54.179 -0.388 1
1 27 . 17 1 1 A 4 4 GLN CB C 358 26.456 31.895 -5.439 1
1 29 . 17 1 1 A 4 4 GLN N N 358 119.506 113.735 5.771 1
1 31 . 17 1 1 A 5 5 ASP H H 359 8.090 8.662 -0.572 1
1 32 . 17 1 1 A 5 5 ASP HA H 359 4.458 4.802 -0.344 1
1 35 . 17 1 1 A 5 5 ASP C C 359 173.492 176.417 -2.925 1
1 36 . 17 1 1 A 5 5 ASP CA C 359 52.309 54.787 -2.478 1
1 37 . 17 1 1 A 5 5 ASP CB C 359 38.312 41.705 -3.393 1
1 38 . 17 1 1 A 5 5 ASP N N 359 120.683 119.444 1.239 1
1 39 . 17 1 1 A 6 6 HIS H H 360 8.103 8.030 0.073 1
1 40 . 17 1 1 A 6 6 HIS HA H 360 4.540 4.534 0.006 1
1 45 . 17 1 1 A 6 6 HIS C C 360 172.801 175.452 -2.651 1
1 46 . 17 1 1 A 6 6 HIS CA C 360 53.874 56.968 -3.094 1
1 47 . 17 1 1 A 6 6 HIS CB C 360 27.878 30.131 -2.253 1
1 50 . 17 1 1 A 6 6 HIS N N 360 118.844 115.966 2.878 1
1 51 . 17 1 1 A 7 7 ILE H H 361 7.862 7.286 0.576 1
1 52 . 17 1 1 A 7 7 ILE HA H 361 4.010 4.080 -0.070 1
1 62 . 17 1 1 A 7 7 ILE C C 361 173.268 176.015 -2.747 1
1 63 . 17 1 1 A 7 7 ILE CA C 361 58.740 60.459 -1.719 1
1 64 . 17 1 1 A 7 7 ILE CB C 361 35.788 37.941 -2.153 1
1 68 . 17 1 1 A 7 7 ILE N N 361 121.598 121.739 -0.141 1
1 69 . 17 1 1 A 8 8 LYS H H 362 8.231 8.737 -0.506 1
1 70 . 17 1 1 A 8 8 LYS HA H 362 4.313 4.388 -0.075 1
1 79 . 17 1 1 A 8 8 LYS C C 362 173.899 174.204 -0.305 1
1 80 . 17 1 1 A 8 8 LYS CA C 362 53.677 56.637 -2.960 1
1 81 . 17 1 1 A 8 8 LYS CB C 362 30.355 32.235 -1.880 1
1 85 . 17 1 1 A 8 8 LYS N N 362 124.980 126.415 -1.435 1
1 86 . 17 1 1 A 9 9 VAL H H 363 8.044 8.245 -0.201 1
1 87 . 17 1 1 A 9 9 VAL HA H 363 4.089 4.729 -0.640 1
1 95 . 17 1 1 A 9 9 VAL C C 363 173.760 175.678 -1.918 1
1 96 . 17 1 1 A 9 9 VAL CA C 363 59.814 59.906 -0.092 1
1 97 . 17 1 1 A 9 9 VAL CB C 363 30.058 34.611 -4.553 1
1 100 . 17 1 1 A 9 9 VAL N N 363 121.366 122.295 -0.929 1
1 101 . 17 1 1 A 10 10 THR H H 364 8.076 8.811 -0.735 1
1 102 . 17 1 1 A 10 10 THR HA H 364 4.302 4.311 -0.009 1
1 107 . 17 1 1 A 10 10 THR C C 364 172.135 174.688 -2.553 1
1 108 . 17 1 1 A 10 10 THR CA C 364 59.134 64.410 -5.276 1
1 109 . 17 1 1 A 10 10 THR CB C 364 67.415 68.435 -1.020 1
1 111 . 17 1 1 A 10 10 THR N N 364 116.817 124.329 -7.512 1
1 112 . 17 1 1 A 11 11 GLN H H 365 8.463 8.741 -0.278 1
1 113 . 17 1 1 A 11 11 GLN HA H 365 4.046 4.411 -0.365 1
1 120 . 17 1 1 A 11 11 GLN C C 365 173.944 175.883 -1.939 1
1 121 . 17 1 1 A 11 11 GLN CA C 365 54.517 57.312 -2.795 1
1 122 . 17 1 1 A 11 11 GLN CB C 365 26.250 30.372 -4.122 1
1 124 . 17 1 1 A 11 11 GLN N N 365 122.059 125.646 -3.587 1
1 126 . 17 1 1 A 12 12 GLU H H 366 8.449 8.044 0.405 1
1 127 . 17 1 1 A 12 12 GLU HA H 366 4.093 4.813 -0.720 1
1 132 . 17 1 1 A 12 12 GLU C C 366 174.746 176.694 -1.948 1
1 133 . 17 1 1 A 12 12 GLU CA C 366 55.235 54.895 0.340 1
1 134 . 17 1 1 A 12 12 GLU CB C 366 27.180 33.748 -6.568 1
1 136 . 17 1 1 A 12 12 GLU N N 366 120.415 117.115 3.300 1
1 137 . 17 1 1 A 13 13 GLN H H 367 8.031 9.090 -1.059 1
1 138 . 17 1 1 A 13 13 GLN HA H 367 4.113 4.195 -0.082 1
1 145 . 17 1 1 A 13 13 GLN C C 367 173.693 177.112 -3.419 1
1 146 . 17 1 1 A 13 13 GLN CA C 367 54.132 57.240 -3.108 1
1 147 . 17 1 1 A 13 13 GLN CB C 367 26.420 27.561 -1.141 1
1 149 . 17 1 1 A 13 13 GLN N N 367 119.721 120.882 -1.161 1
1 151 . 17 1 1 A 14 14 TYR H H 368 8.111 8.461 -0.350 1
1 152 . 17 1 1 A 14 14 TYR HA H 368 4.339 4.357 -0.018 1
1 159 . 17 1 1 A 14 14 TYR C C 368 173.916 177.467 -3.551 1
1 160 . 17 1 1 A 14 14 TYR CA C 368 56.572 60.613 -4.041 1
1 161 . 17 1 1 A 14 14 TYR CB C 368 35.879 37.398 -1.519 1
1 164 . 17 1 1 A 14 14 TYR N N 368 120.541 120.334 0.207 1
1 165 . 17 1 1 A 15 15 GLU H H 369 8.287 7.874 0.413 1
1 166 . 17 1 1 A 15 15 GLU HA H 369 4.009 3.827 0.182 1
1 171 . 17 1 1 A 15 15 GLU C C 369 174.448 177.753 -3.305 1
1 172 . 17 1 1 A 15 15 GLU CA C 369 55.047 58.238 -3.191 1
1 173 . 17 1 1 A 15 15 GLU CB C 369 27.226 28.916 -1.690 1
1 175 . 17 1 1 A 15 15 GLU N N 369 120.398 121.047 -0.649 1
1 176 . 17 1 1 A 16 16 LEU H H 370 7.785 7.372 0.413 1
1 177 . 17 1 1 A 16 16 LEU HA H 370 4.138 4.355 -0.217 1
1 187 . 17 1 1 A 16 16 LEU C C 370 175.089 177.407 -2.318 1
1 188 . 17 1 1 A 16 16 LEU CA C 370 53.425 54.290 -0.865 1
1 189 . 17 1 1 A 16 16 LEU CB C 370 39.554 41.297 -1.743 1
1 193 . 17 1 1 A 16 16 LEU N N 370 121.323 117.960 3.363 1
1 194 . 17 1 1 A 17 17 TYR H H 371 8.038 8.173 -0.135 1
1 195 . 17 1 1 A 17 17 TYR HA H 371 4.380 4.502 -0.122 1
1 202 . 17 1 1 A 17 17 TYR C C 371 173.931 176.191 -2.260 1
1 203 . 17 1 1 A 17 17 TYR CA C 371 56.143 57.785 -1.642 1
1 204 . 17 1 1 A 17 17 TYR CB C 371 35.501 38.312 -2.811 1
1 207 . 17 1 1 A 17 17 TYR N N 371 119.465 119.524 -0.059 1
1 208 . 17 1 1 A 18 18 CYS H H 372 8.021 7.342 0.679 1
1 209 . 17 1 1 A 18 18 CYS HA H 372 4.236 3.888 0.348 1
1 212 . 17 1 1 A 18 18 CYS C C 372 172.457 175.293 -2.836 1
1 213 . 17 1 1 A 18 18 CYS CA C 372 56.997 59.907 -2.910 1
1 214 . 17 1 1 A 18 18 CYS CB C 372 25.080 27.387 -2.307 1
1 215 . 17 1 1 A 18 18 CYS N N 372 119.913 121.040 -1.127 1
1 216 . 17 1 1 A 19 19 GLU H H 373 8.151 8.734 -0.583 1
1 217 . 17 1 1 A 19 19 GLU HA H 373 4.130 4.119 0.011 1
1 222 . 17 1 1 A 19 19 GLU C C 373 174.151 175.560 -1.409 1
1 223 . 17 1 1 A 19 19 GLU CA C 373 54.535 57.119 -2.584 1
1 224 . 17 1 1 A 19 19 GLU CB C 373 27.244 28.894 -1.650 1
1 226 . 17 1 1 A 19 19 GLU N N 373 122.431 121.240 1.191 1
1 227 . 17 1 1 A 20 20 MET H H 374 8.109 8.869 -0.760 1
1 228 . 17 1 1 A 20 20 MET HA H 374 4.352 4.989 -0.637 1
1 236 . 17 1 1 A 20 20 MET C C 374 174.200 176.999 -2.799 1
1 237 . 17 1 1 A 20 20 MET CA C 374 53.238 54.438 -1.200 1
1 238 . 17 1 1 A 20 20 MET CB C 374 30.237 34.539 -4.302 1
1 241 . 17 1 1 A 20 20 MET N N 374 119.754 123.144 -3.390 1
1 242 . 17 1 1 A 21 21 GLY H H 375 8.231 8.682 -0.451 1
1 243 . 17 1 1 A 21 21 GLY HA2 H 375 3.861 3.778 0.083 1
1 244 . 17 1 1 A 21 21 GLY HA3 H 375 3.960 3.779 0.181 1
1 245 . 17 1 1 A 21 21 GLY C C 375 171.928 173.344 -1.416 1
1 246 . 17 1 1 A 21 21 GLY CA C 375 42.930 46.726 -3.796 1
1 247 . 17 1 1 A 21 21 GLY N N 375 109.484 110.280 -0.796 1
1 248 . 17 1 1 A 22 22 SER HA H 376 4.492 5.435 -0.943 1
1 251 . 17 1 1 A 22 22 SER C C 376 172.206 172.651 -0.445 1
1 252 . 17 1 1 A 22 22 SER CA C 376 55.570 57.484 -1.914 1
1 253 . 17 1 1 A 22 22 SER CB C 376 61.525 66.661 -5.136 1
1 254 . 17 1 1 A 23 23 THR H H 377 8.470 8.639 -0.169 1
1 255 . 17 1 1 A 23 23 THR HA H 377 4.295 5.144 -0.849 1
1 260 . 17 1 1 A 23 23 THR C C 377 171.811 174.186 -2.375 1
1 261 . 17 1 1 A 23 23 THR CA C 377 58.937 60.531 -1.594 1
1 262 . 17 1 1 A 23 23 THR CB C 377 67.250 71.400 -4.150 1
1 264 . 17 1 1 A 23 23 THR N N 377 124.043 115.726 8.317 1
1 265 . 17 1 1 A 24 24 PHE H H 378 8.374 9.002 -0.628 1
1 266 . 17 1 1 A 24 24 PHE HA H 378 4.239 4.399 -0.160 1
1 273 . 17 1 1 A 24 24 PHE C C 378 173.411 177.828 -4.417 1
1 274 . 17 1 1 A 24 24 PHE CA C 378 56.697 60.346 -3.649 1
1 275 . 17 1 1 A 24 24 PHE CB C 378 36.538 39.952 -3.414 1
1 278 . 17 1 1 A 24 24 PHE N N 378 124.732 127.582 -2.850 1
1 279 . 17 1 1 A 25 25 GLN H H 379 8.457 8.084 0.373 1
1 280 . 17 1 1 A 25 25 GLN HA H 379 4.038 3.921 0.117 1
1 287 . 17 1 1 A 25 25 GLN C C 379 172.431 176.252 -3.821 1
1 288 . 17 1 1 A 25 25 GLN CA C 379 54.078 58.203 -4.125 1
1 289 . 17 1 1 A 25 25 GLN CB C 379 26.414 28.821 -2.407 1
1 291 . 17 1 1 A 25 25 GLN N N 379 118.820 118.246 0.574 1
1 293 . 17 1 1 A 26 26 LEU H H 380 6.985 6.981 0.004 1
1 294 . 17 1 1 A 26 26 LEU HA H 380 4.229 4.278 -0.049 1
1 304 . 17 1 1 A 26 26 LEU C C 380 173.895 176.550 -2.655 1
1 305 . 17 1 1 A 26 26 LEU CA C 380 52.123 54.667 -2.544 1
1 306 . 17 1 1 A 26 26 LEU CB C 380 40.543 42.756 -2.213 1
1 310 . 17 1 1 A 26 26 LEU N N 380 119.079 121.669 -2.590 1
1 311 . 17 1 1 A 27 27 CYS H H 381 8.905 9.211 -0.306 1
1 312 . 17 1 1 A 27 27 CYS HA H 381 4.013 4.518 -0.505 1
1 315 . 17 1 1 A 27 27 CYS C C 381 174.439 175.930 -1.491 1
1 316 . 17 1 1 A 27 27 CYS CA C 381 57.847 59.498 -1.651 1
1 317 . 17 1 1 A 27 27 CYS CB C 381 28.648 28.528 0.120 1
1 318 . 17 1 1 A 27 27 CYS N N 381 125.151 123.072 2.079 1
1 319 . 17 1 1 A 28 28 LYS H H 382 9.351 8.805 0.546 1
1 320 . 17 1 1 A 28 28 LYS HA H 382 4.157 3.926 0.231 1
1 329 . 17 1 1 A 28 28 LYS C C 382 174.678 178.175 -3.497 1
1 330 . 17 1 1 A 28 28 LYS CA C 382 54.324 59.151 -4.827 1
1 331 . 17 1 1 A 28 28 LYS CB C 382 30.086 32.379 -2.293 1
1 335 . 17 1 1 A 28 28 LYS N N 382 128.840 128.290 0.550 1
1 336 . 17 1 1 A 29 29 ILE H H 383 9.040 8.025 1.015 1
1 337 . 17 1 1 A 29 29 ILE HA H 383 3.804 3.369 0.435 1
1 347 . 17 1 1 A 29 29 ILE C C 383 174.239 177.539 -3.300 1
1 348 . 17 1 1 A 29 29 ILE CA C 383 62.114 65.313 -3.199 1
1 349 . 17 1 1 A 29 29 ILE CB C 383 33.870 38.264 -4.394 1
1 353 . 17 1 1 A 29 29 ILE N N 383 122.718 119.498 3.220 1
1 354 . 17 1 1 A 30 30 CYS H H 384 7.572 7.702 -0.130 1
1 355 . 17 1 1 A 30 30 CYS HA H 384 4.548 4.407 0.141 1
1 358 . 17 1 1 A 30 30 CYS C C 384 172.978 175.267 -2.289 1
1 359 . 17 1 1 A 30 30 CYS CA C 384 54.957 59.713 -4.756 1
1 360 . 17 1 1 A 30 30 CYS CB C 384 29.778 29.333 0.445 1
1 361 . 17 1 1 A 30 30 CYS N N 384 116.356 115.791 0.565 1
1 362 . 17 1 1 A 31 31 ALA H H 385 8.205 8.417 -0.212 1
1 363 . 17 1 1 A 31 31 ALA HA H 385 4.107 4.142 -0.035 1
1 367 . 17 1 1 A 31 31 ALA C C 385 173.139 177.077 -3.938 1
1 368 . 17 1 1 A 31 31 ALA CA C 385 50.802 53.885 -3.083 1
1 369 . 17 1 1 A 31 31 ALA CB C 385 14.634 18.168 -3.534 1
1 370 . 17 1 1 A 31 31 ALA N N 385 125.526 120.782 4.744 1
1 371 . 17 1 1 A 32 32 GLU H H 386 8.416 8.080 0.336 1
1 372 . 17 1 1 A 32 32 GLU HA H 386 4.467 4.411 0.056 1
1 377 . 17 1 1 A 32 32 GLU C C 386 172.325 176.764 -4.439 1
1 378 . 17 1 1 A 32 32 GLU CA C 386 55.146 57.752 -2.606 1
1 379 . 17 1 1 A 32 32 GLU CB C 386 31.181 31.050 0.131 1
1 381 . 17 1 1 A 32 32 GLU N N 386 117.579 116.039 1.540 1
1 382 . 17 1 1 A 33 33 ASN H H 387 7.872 7.924 -0.052 1
1 383 . 17 1 1 A 33 33 ASN HA H 387 4.900 4.947 -0.047 1
1 388 . 17 1 1 A 33 33 ASN C C 387 171.355 174.841 -3.486 1
1 389 . 17 1 1 A 33 33 ASN CA C 387 49.320 52.424 -3.104 1
1 390 . 17 1 1 A 33 33 ASN CB C 387 38.457 39.477 -1.020 1
1 391 . 17 1 1 A 33 33 ASN N N 387 120.399 116.884 3.515 1
1 393 . 17 1 1 A 34 34 ASP H H 388 8.565 8.591 -0.026 1
1 394 . 17 1 1 A 34 34 ASP HA H 388 4.679 4.829 -0.150 1
1 397 . 17 1 1 A 34 34 ASP C C 388 174.243 175.766 -1.523 1
1 398 . 17 1 1 A 34 34 ASP CA C 388 51.809 53.213 -1.404 1
1 399 . 17 1 1 A 34 34 ASP CB C 388 38.007 41.997 -3.990 1
1 400 . 17 1 1 A 34 34 ASP N N 388 120.661 120.853 -0.192 1
1 401 . 17 1 1 A 35 35 LYS H H 389 8.544 8.724 -0.180 1
1 402 . 17 1 1 A 35 35 LYS HA H 389 3.411 4.374 -0.963 1
1 409 . 17 1 1 A 35 35 LYS C C 389 172.938 176.586 -3.648 1
1 410 . 17 1 1 A 35 35 LYS CA C 389 54.973 56.111 -1.138 1
1 411 . 17 1 1 A 35 35 LYS CB C 389 30.617 32.387 -1.770 1
1 415 . 17 1 1 A 35 35 LYS N N 389 119.199 118.773 0.426 1
1 416 . 17 1 1 A 36 36 ASP H H 390 8.327 8.822 -0.495 1
1 417 . 17 1 1 A 36 36 ASP HA H 390 4.724 4.986 -0.262 1
1 420 . 17 1 1 A 36 36 ASP C C 390 172.860 175.469 -2.609 1
1 421 . 17 1 1 A 36 36 ASP CA C 390 51.609 53.515 -1.906 1
1 422 . 17 1 1 A 36 36 ASP CB C 390 39.018 42.108 -3.090 1
1 423 . 17 1 1 A 36 36 ASP N N 390 119.134 119.918 -0.784 1
1 424 . 17 1 1 A 37 37 VAL H H 391 8.544 7.740 0.804 1
1 425 . 17 1 1 A 37 37 VAL HA H 391 4.877 4.773 0.104 1
1 433 . 17 1 1 A 37 37 VAL C C 391 167.519 173.236 -5.717 1
1 434 . 17 1 1 A 37 37 VAL CA C 391 58.259 60.087 -1.828 1
1 435 . 17 1 1 A 37 37 VAL CB C 391 32.277 35.345 -3.068 1
1 438 . 17 1 1 A 37 37 VAL N N 391 121.970 119.616 2.354 1
1 439 . 17 1 1 A 38 38 LYS H H 392 8.621 9.689 -1.068 1
1 440 . 17 1 1 A 38 38 LYS HA H 392 4.991 5.116 -0.125 1
1 449 . 17 1 1 A 38 38 LYS C C 392 172.681 175.257 -2.576 1
1 450 . 17 1 1 A 38 38 LYS CA C 392 51.123 54.675 -3.552 1
1 451 . 17 1 1 A 38 38 LYS CB C 392 33.697 34.635 -0.938 1
1 455 . 17 1 1 A 38 38 LYS N N 392 126.381 129.046 -2.665 1
1 456 . 17 1 1 A 39 39 ILE H H 393 8.723 9.030 -0.307 1
1 457 . 17 1 1 A 39 39 ILE HA H 393 4.239 4.348 -0.109 1
1 467 . 17 1 1 A 39 39 ILE C C 393 172.642 175.747 -3.105 1
1 468 . 17 1 1 A 39 39 ILE CA C 393 57.768 61.047 -3.279 1
1 469 . 17 1 1 A 39 39 ILE CB C 393 35.691 37.593 -1.902 1
1 473 . 17 1 1 A 39 39 ILE N N 393 126.398 127.384 -0.986 1
1 474 . 17 1 1 A 40 40 GLU H H 394 8.506 9.336 -0.830 1
1 475 . 17 1 1 A 40 40 GLU HA H 394 4.753 4.737 0.016 1
1 480 . 17 1 1 A 40 40 GLU C C 394 173.596 176.210 -2.614 1
1 481 . 17 1 1 A 40 40 GLU CA C 394 49.793 53.278 -3.485 1
1 482 . 17 1 1 A 40 40 GLU CB C 394 28.210 30.333 -2.123 1
1 484 . 17 1 1 A 40 40 GLU N N 394 124.864 128.116 -3.252 1
1 485 . 17 1 1 A 41 41 PRO HA H 395 4.864 4.500 0.364 1
1 492 . 17 1 1 A 41 41 PRO C C 395 175.073 177.105 -2.032 1
1 493 . 17 1 1 A 41 41 PRO CA C 395 61.111 63.883 -2.772 1
1 494 . 17 1 1 A 41 41 PRO CB C 395 32.275 32.999 -0.724 1
1 497 . 17 1 1 A 42 42 CYS H H 396 7.828 7.806 0.022 1
1 498 . 17 1 1 A 42 42 CYS HA H 396 4.208 4.084 0.124 1
1 501 . 17 1 1 A 42 42 CYS C C 396 173.877 174.987 -1.110 1
1 502 . 17 1 1 A 42 42 CYS CA C 396 58.021 61.310 -3.289 1
1 503 . 17 1 1 A 42 42 CYS CB C 396 28.242 27.651 0.591 1
1 504 . 17 1 1 A 42 42 CYS N N 396 122.434 117.968 4.466 1
1 505 . 17 1 1 A 43 43 GLY H H 397 8.679 8.870 -0.191 1
1 506 . 17 1 1 A 43 43 GLY HA2 H 397 3.507 3.875 -0.368 1
1 507 . 17 1 1 A 43 43 GLY HA3 H 397 3.914 3.886 0.028 1
1 508 . 17 1 1 A 43 43 GLY C C 397 171.981 174.583 -2.602 1
1 509 . 17 1 1 A 43 43 GLY CA C 397 43.347 46.101 -2.754 1
1 510 . 17 1 1 A 43 43 GLY N N 397 112.123 108.655 3.468 1
1 511 . 17 1 1 A 44 44 HIS H H 398 8.329 7.163 1.166 1
1 512 . 17 1 1 A 44 44 HIS HA H 398 4.339 4.498 -0.159 1
1 517 . 17 1 1 A 44 44 HIS C C 398 170.742 174.580 -3.838 1
1 518 . 17 1 1 A 44 44 HIS CA C 398 58.368 56.009 2.359 1
1 519 . 17 1 1 A 44 44 HIS CB C 398 28.434 31.334 -2.900 1
1 522 . 17 1 1 A 44 44 HIS N N 398 121.393 117.313 4.080 1
1 523 . 17 1 1 A 45 45 LEU H H 399 8.241 8.860 -0.619 1
1 524 . 17 1 1 A 45 45 LEU HA H 399 5.570 5.269 0.301 1
1 534 . 17 1 1 A 45 45 LEU C C 399 174.464 175.603 -1.139 1
1 535 . 17 1 1 A 45 45 LEU CA C 399 50.729 53.427 -2.698 1
1 536 . 17 1 1 A 45 45 LEU CB C 399 43.574 44.360 -0.786 1
1 540 . 17 1 1 A 45 45 LEU N N 399 118.469 123.129 -4.660 1
1 541 . 17 1 1 A 46 46 MET H H 400 8.707 8.782 -0.075 1
1 542 . 17 1 1 A 46 46 MET HA H 400 4.842 5.073 -0.231 1
1 550 . 17 1 1 A 46 46 MET C C 400 170.736 174.456 -3.720 1
1 551 . 17 1 1 A 46 46 MET CA C 400 52.804 54.098 -1.294 1
1 552 . 17 1 1 A 46 46 MET CB C 400 31.945 35.389 -3.444 1
1 555 . 17 1 1 A 46 46 MET N N 400 114.897 120.084 -5.187 1
1 556 . 17 1 1 A 47 47 CYS H H 401 9.436 8.419 1.017 1
1 557 . 17 1 1 A 47 47 CYS HA H 401 5.629 4.850 0.779 1
1 560 . 17 1 1 A 47 47 CYS C C 401 173.909 176.137 -2.228 1
1 561 . 17 1 1 A 47 47 CYS CA C 401 54.325 57.179 -2.854 1
1 562 . 17 1 1 A 47 47 CYS CB C 401 30.725 29.227 1.498 1
1 563 . 17 1 1 A 47 47 CYS N N 401 119.575 119.115 0.460 1
1 564 . 17 1 1 A 48 48 THR H H 402 9.842 9.467 0.375 1
1 565 . 17 1 1 A 48 48 THR HA H 402 3.768 3.972 -0.204 1
1 570 . 17 1 1 A 48 48 THR C C 402 174.333 176.208 -1.875 1
1 571 . 17 1 1 A 48 48 THR CA C 402 64.516 65.928 -1.412 1
1 572 . 17 1 1 A 48 48 THR CB C 402 66.288 68.656 -2.368 1
1 574 . 17 1 1 A 48 48 THR N N 402 119.945 119.134 0.811 1
1 575 . 17 1 1 A 49 49 SER H H 403 8.355 8.029 0.326 1
1 576 . 17 1 1 A 49 49 SER HA H 403 4.222 4.094 0.128 1
1 579 . 17 1 1 A 49 49 SER C C 403 175.059 177.056 -1.997 1
1 580 . 17 1 1 A 49 49 SER CA C 403 59.828 61.956 -2.128 1
1 581 . 17 1 1 A 49 49 SER CB C 403 59.717 62.830 -3.113 1
1 582 . 17 1 1 A 49 49 SER N N 403 120.468 117.259 3.209 1
1 583 . 17 1 1 A 50 50 CYS H H 404 9.464 8.285 1.179 1
1 584 . 17 1 1 A 50 50 CYS HA H 404 3.922 4.118 -0.196 1
1 587 . 17 1 1 A 50 50 CYS C C 404 176.081 177.350 -1.269 1
1 588 . 17 1 1 A 50 50 CYS CA C 404 63.076 64.435 -1.359 1
1 589 . 17 1 1 A 50 50 CYS CB C 404 26.078 27.273 -1.195 1
1 590 . 17 1 1 A 50 50 CYS N N 404 126.744 119.704 7.040 1
1 591 . 17 1 1 A 51 51 LEU H H 405 7.948 8.106 -0.158 1
1 592 . 17 1 1 A 51 51 LEU HA H 405 4.064 4.190 -0.126 1
1 602 . 17 1 1 A 51 51 LEU C C 405 175.495 178.782 -3.287 1
1 603 . 17 1 1 A 51 51 LEU CA C 405 55.914 58.151 -2.237 1
1 604 . 17 1 1 A 51 51 LEU CB C 405 38.662 41.910 -3.248 1
1 607 . 17 1 1 A 51 51 LEU N N 405 121.951 122.490 -0.539 1
1 608 . 17 1 1 A 52 52 THR H H 406 8.786 8.670 0.116 1
1 609 . 17 1 1 A 52 52 THR HA H 406 4.024 3.928 0.096 1
1 614 . 17 1 1 A 52 52 THR C C 406 174.139 176.405 -2.266 1
1 615 . 17 1 1 A 52 52 THR CA C 406 64.017 66.366 -2.349 1
1 616 . 17 1 1 A 52 52 THR CB C 406 66.115 68.395 -2.280 1
1 618 . 17 1 1 A 52 52 THR N N 406 115.258 114.777 0.481 1
1 619 . 17 1 1 A 53 53 SER H H 407 8.115 8.136 -0.021 1
1 620 . 17 1 1 A 53 53 SER HA H 407 4.204 4.234 -0.030 1
1 623 . 17 1 1 A 53 53 SER C C 407 174.456 176.983 -2.527 1
1 624 . 17 1 1 A 53 53 SER CA C 407 59.090 61.008 -1.918 1
1 625 . 17 1 1 A 53 53 SER CB C 407 60.146 63.082 -2.936 1
1 626 . 17 1 1 A 53 53 SER N N 407 116.852 115.233 1.619 1
1 627 . 17 1 1 A 54 54 TRP H H 408 8.123 7.916 0.207 1
1 628 . 17 1 1 A 54 54 TRP HA H 408 4.371 4.277 0.094 1
1 637 . 17 1 1 A 54 54 TRP C C 408 175.981 178.612 -2.631 1
1 638 . 17 1 1 A 54 54 TRP CA C 408 57.323 60.770 -3.447 1
1 639 . 17 1 1 A 54 54 TRP CB C 408 26.812 29.576 -2.764 1
1 645 . 17 1 1 A 54 54 TRP N N 408 123.556 123.247 0.309 1
1 647 . 17 1 1 A 55 55 GLN H H 409 8.502 8.726 -0.224 1
1 648 . 17 1 1 A 55 55 GLN HA H 409 3.999 3.648 0.351 1
1 655 . 17 1 1 A 55 55 GLN C C 409 177.300 178.448 -1.148 1
1 656 . 17 1 1 A 55 55 GLN CA C 409 56.484 59.227 -2.743 1
1 657 . 17 1 1 A 55 55 GLN CB C 409 26.190 28.643 -2.453 1
1 659 . 17 1 1 A 55 55 GLN N N 409 118.044 118.203 -0.159 1
1 661 . 17 1 1 A 56 56 GLU H H 410 8.467 8.492 -0.025 1
1 662 . 17 1 1 A 56 56 GLU HA H 410 4.057 3.919 0.138 1
1 667 . 17 1 1 A 56 56 GLU C C 410 174.787 176.773 -1.986 1
1 668 . 17 1 1 A 56 56 GLU CA C 410 55.909 58.860 -2.951 1
1 669 . 17 1 1 A 56 56 GLU CB C 410 26.895 29.203 -2.308 1
1 671 . 17 1 1 A 56 56 GLU N N 410 119.448 117.704 1.744 1
1 672 . 17 1 1 A 57 57 SER H H 411 7.438 7.630 -0.192 1
1 673 . 17 1 1 A 57 57 SER HA H 411 4.607 4.589 0.018 1
1 676 . 17 1 1 A 57 57 SER C C 411 170.849 173.918 -3.069 1
1 677 . 17 1 1 A 57 57 SER CA C 411 55.540 57.428 -1.888 1
1 678 . 17 1 1 A 57 57 SER CB C 411 60.928 63.239 -2.311 1
1 679 . 17 1 1 A 57 57 SER N N 411 113.752 114.525 -0.773 1
1 680 . 17 1 1 A 58 58 GLU H H 412 7.855 7.650 0.205 1
1 681 . 17 1 1 A 58 58 GLU HA H 412 3.772 3.912 -0.140 1
1 686 . 17 1 1 A 58 58 GLU C C 412 173.743 175.805 -2.062 1
1 687 . 17 1 1 A 58 58 GLU CA C 412 54.442 56.791 -2.349 1
1 688 . 17 1 1 A 58 58 GLU CB C 412 24.603 28.237 -3.634 1
1 690 . 17 1 1 A 58 58 GLU N N 412 115.908 118.127 -2.219 1
1 691 . 17 1 1 A 59 59 GLY H H 413 7.588 8.318 -0.730 1
1 692 . 17 1 1 A 59 59 GLY HA2 H 413 1.643 2.792 -1.149 1
1 693 . 17 1 1 A 59 59 GLY HA3 H 413 2.949 3.710 -0.761 1
1 694 . 17 1 1 A 59 59 GLY C C 413 170.850 172.543 -1.693 1
1 695 . 17 1 1 A 59 59 GLY CA C 413 41.724 44.911 -3.187 1
1 696 . 17 1 1 A 59 59 GLY N N 413 108.032 110.884 -2.852 1
1 697 . 17 1 1 A 60 60 GLN H H 414 7.973 8.645 -0.672 1
1 698 . 17 1 1 A 60 60 GLN HA H 414 4.366 4.707 -0.341 1
1 705 . 17 1 1 A 60 60 GLN C C 414 173.108 176.190 -3.082 1
1 706 . 17 1 1 A 60 60 GLN CA C 414 52.422 54.928 -2.506 1
1 707 . 17 1 1 A 60 60 GLN CB C 414 27.049 29.461 -2.412 1
1 709 . 17 1 1 A 60 60 GLN N N 414 122.690 124.371 -1.681 1
1 711 . 17 1 1 A 61 61 GLY H H 415 8.301 8.753 -0.452 1
1 712 . 17 1 1 A 61 61 GLY HA2 H 415 3.700 4.166 -0.466 1
1 713 . 17 1 1 A 61 61 GLY HA3 H 415 3.920 4.190 -0.270 1
1 714 . 17 1 1 A 61 61 GLY C C 415 170.249 174.363 -4.114 1
1 715 . 17 1 1 A 61 61 GLY CA C 415 42.210 44.741 -2.531 1
1 716 . 17 1 1 A 61 61 GLY N N 415 110.794 114.442 -3.648 1
1 717 . 17 1 1 A 62 62 CYS H H 416 8.549 8.625 -0.076 1
1 718 . 17 1 1 A 62 62 CYS HA H 416 4.227 4.654 -0.427 1
1 721 . 17 1 1 A 62 62 CYS C C 416 172.914 175.381 -2.467 1
1 722 . 17 1 1 A 62 62 CYS CA C 416 54.008 58.588 -4.580 1
1 723 . 17 1 1 A 62 62 CYS CB C 416 29.716 27.337 2.379 1
1 724 . 17 1 1 A 62 62 CYS N N 416 123.683 120.320 3.363 1
1 725 . 17 1 1 A 63 63 PRO HA H 417 2.611 2.934 -0.323 1
1 732 . 17 1 1 A 63 63 PRO C C 417 174.143 178.079 -3.936 1
1 733 . 17 1 1 A 63 63 PRO CA C 417 61.689 63.750 -2.061 1
1 734 . 17 1 1 A 63 63 PRO CB C 417 28.534 31.291 -2.757 1
1 737 . 17 1 1 A 64 64 PHE H H 418 8.968 7.792 1.176 1
1 738 . 17 1 1 A 64 64 PHE HA H 418 4.250 4.077 0.173 1
1 746 . 17 1 1 A 64 64 PHE C C 418 174.243 177.453 -3.210 1
1 747 . 17 1 1 A 64 64 PHE CA C 418 56.720 60.583 -3.863 1
1 748 . 17 1 1 A 64 64 PHE CB C 418 36.458 38.818 -2.360 1
1 752 . 17 1 1 A 64 64 PHE N N 418 117.008 115.861 1.147 1
1 753 . 17 1 1 A 65 65 CYS H H 419 7.968 7.915 0.053 1
1 754 . 17 1 1 A 65 65 CYS HA H 419 4.906 4.486 0.420 1
1 757 . 17 1 1 A 65 65 CYS C C 419 173.198 174.789 -1.591 1
1 758 . 17 1 1 A 65 65 CYS CA C 419 55.870 59.387 -3.517 1
1 759 . 17 1 1 A 65 65 CYS CB C 419 30.559 29.110 1.449 1
1 760 . 17 1 1 A 65 65 CYS N N 419 117.505 115.178 2.327 1
1 761 . 17 1 1 A 66 66 ARG H H 420 8.761 8.021 0.740 1
1 762 . 17 1 1 A 66 66 ARG HA H 420 4.365 4.258 0.107 1
1 769 . 17 1 1 A 66 66 ARG C C 420 172.921 175.072 -2.151 1
1 770 . 17 1 1 A 66 66 ARG CA C 420 54.763 57.043 -2.280 1
1 771 . 17 1 1 A 66 66 ARG CB C 420 24.286 27.827 -3.541 1
1 774 . 17 1 1 A 66 66 ARG N N 420 118.763 116.524 2.239 1
1 775 . 17 1 1 A 67 67 CYS H H 421 8.223 7.639 0.584 1
1 776 . 17 1 1 A 67 67 CYS HA H 421 4.419 5.039 -0.620 1
1 779 . 17 1 1 A 67 67 CYS C C 421 171.160 173.629 -2.469 1
1 780 . 17 1 1 A 67 67 CYS CA C 421 57.119 57.325 -0.206 1
1 781 . 17 1 1 A 67 67 CYS CB C 421 25.911 30.860 -4.949 1
1 782 . 17 1 1 A 67 67 CYS N N 421 120.627 114.249 6.378 1
1 783 . 17 1 1 A 68 68 GLU H H 422 8.416 8.500 -0.084 1
1 784 . 17 1 1 A 68 68 GLU HA H 422 4.025 4.134 -0.109 1
1 789 . 17 1 1 A 68 68 GLU C C 422 173.764 176.275 -2.511 1
1 790 . 17 1 1 A 68 68 GLU CA C 422 54.752 57.553 -2.801 1
1 791 . 17 1 1 A 68 68 GLU CB C 422 27.302 29.782 -2.480 1
1 793 . 17 1 1 A 68 68 GLU N N 422 122.370 120.588 1.782 1
1 794 . 17 1 1 A 69 69 ILE H H 423 8.648 8.895 -0.247 1
1 795 . 17 1 1 A 69 69 ILE HA H 423 4.012 4.546 -0.534 1
1 805 . 17 1 1 A 69 69 ILE C C 423 174.257 175.515 -1.258 1
1 806 . 17 1 1 A 69 69 ILE CA C 423 59.740 60.632 -0.892 1
1 807 . 17 1 1 A 69 69 ILE CB C 423 35.846 39.322 -3.476 1
1 811 . 17 1 1 A 69 69 ILE N N 423 125.988 125.585 0.403 1
1 812 . 17 1 1 A 70 70 LYS H H 424 9.185 9.437 -0.252 1
1 813 . 17 1 1 A 70 70 LYS HA H 424 4.434 4.441 -0.007 1
1 822 . 17 1 1 A 70 70 LYS C C 424 173.880 176.496 -2.616 1
1 823 . 17 1 1 A 70 70 LYS CA C 424 53.378 57.147 -3.769 1
1 824 . 17 1 1 A 70 70 LYS CB C 424 30.397 34.563 -4.166 1
1 828 . 17 1 1 A 70 70 LYS N N 424 128.977 129.437 -0.460 1
1 829 . 17 1 1 A 71 71 GLY H H 425 7.810 7.786 0.024 1
1 830 . 17 1 1 A 71 71 GLY HA2 H 425 4.094 4.060 0.034 1
1 831 . 17 1 1 A 71 71 GLY HA3 H 425 4.159 4.064 0.095 1
1 832 . 17 1 1 A 71 71 GLY C C 425 168.179 172.401 -4.222 1
1 833 . 17 1 1 A 71 71 GLY CA C 425 42.326 45.107 -2.781 1
1 834 . 17 1 1 A 71 71 GLY N N 425 107.696 106.500 1.196 1
1 835 . 17 1 1 A 72 72 THR H H 426 8.048 8.620 -0.572 1
1 836 . 17 1 1 A 72 72 THR HA H 426 5.258 5.447 -0.189 1
1 841 . 17 1 1 A 72 72 THR C C 426 170.979 172.535 -1.556 1
1 842 . 17 1 1 A 72 72 THR CA C 426 56.755 60.277 -3.522 1
1 843 . 17 1 1 A 72 72 THR CB C 426 69.226 71.431 -2.205 1
1 845 . 17 1 1 A 72 72 THR N N 426 109.122 110.807 -1.685 1
1 846 . 17 1 1 A 73 73 GLU H H 427 8.912 9.392 -0.480 1
1 847 . 17 1 1 A 73 73 GLU HA H 427 4.954 4.928 0.026 1
1 852 . 17 1 1 A 73 73 GLU C C 427 170.353 174.846 -4.493 1
1 853 . 17 1 1 A 73 73 GLU CA C 427 50.182 53.004 -2.822 1
1 854 . 17 1 1 A 73 73 GLU CB C 427 30.559 33.219 -2.660 1
1 856 . 17 1 1 A 73 73 GLU N N 427 121.703 125.139 -3.436 1
1 1 . 17 1 1 A 74 74 PRO HA H 428 4.372 4.980 -0.608 1
1 2 . 17 1 1 A 74 74 PRO C C 428 173.839 175.519 -1.680 1
1 3 . 17 1 1 A 74 74 PRO CA C 428 60.241 62.646 -2.405 1
1 4 . 17 1 1 A 74 74 PRO CB C 428 29.299 32.661 -3.362 1
1 857 . 17 1 1 A 74 74 PRO HA H 428 4.782 4.980 -0.198 1
1 864 . 17 1 1 A 74 74 PRO C C 428 174.027 175.519 -1.492 1
1 865 . 17 1 1 A 74 74 PRO CA C 428 59.771 62.646 -2.875 1
1 866 . 17 1 1 A 74 74 PRO CB C 428 29.633 32.661 -3.028 1
1 7 . 17 1 1 A 75 75 ILE H H 429 8.144 8.577 -0.433 1
1 8 . 17 1 1 A 75 75 ILE HA H 429 4.086 4.906 -0.820 1
1 15 . 17 1 1 A 75 75 ILE C C 429 173.426 174.853 -1.427 1
1 16 . 17 1 1 A 75 75 ILE CA C 429 58.339 59.894 -1.555 1
1 17 . 17 1 1 A 75 75 ILE CB C 429 35.988 40.627 -4.639 1
1 21 . 17 1 1 A 75 75 ILE N N 429 121.551 121.721 -0.170 1
1 869 . 17 1 1 A 75 75 ILE H H 429 7.682 8.577 -0.895 1
1 870 . 17 1 1 A 75 75 ILE HA H 429 4.282 4.906 -0.624 1
1 880 . 17 1 1 A 75 75 ILE C C 429 172.510 174.853 -2.343 1
1 881 . 17 1 1 A 75 75 ILE CA C 429 57.456 59.894 -2.438 1
1 882 . 17 1 1 A 75 75 ILE CB C 429 37.903 40.627 -2.724 1
1 886 . 17 1 1 A 75 75 ILE N N 429 119.651 121.721 -2.070 1
1 1 . 17 1 1 A 76 76 VAL HA H 430 4.086 4.888 -0.802 1
1 2 . 17 1 1 A 76 76 VAL CA C 430 59.372 60.503 -1.131 1
1 22 . 17 1 1 A 76 76 VAL H H 430 8.221 8.763 -0.542 1
1 23 . 17 1 1 A 76 76 VAL HA H 430 4.083 4.888 -0.805 1
1 24 . 17 1 1 A 76 76 VAL C C 430 173.067 175.779 -2.712 1
1 25 . 17 1 1 A 76 76 VAL CA C 430 59.445 60.503 -1.058 1
1 26 . 17 1 1 A 76 76 VAL CB C 430 30.407 31.914 -1.507 1
1 27 . 17 1 1 A 76 76 VAL N N 430 125.930 122.192 3.738 1
1 887 . 17 1 1 A 76 76 VAL H H 430 8.122 8.763 -0.641 1
1 888 . 17 1 1 A 76 76 VAL HA H 430 4.197 4.888 -0.691 1
1 890 . 17 1 1 A 76 76 VAL C C 430 172.971 175.779 -2.808 1
1 891 . 17 1 1 A 76 76 VAL CA C 430 58.821 60.503 -1.682 1
1 892 . 17 1 1 A 76 76 VAL CB C 430 30.807 31.914 -1.107 1
1 895 . 17 1 1 A 76 76 VAL N N 430 124.178 122.192 1.986 1
1 4 . 17 1 1 A 77 77 VAL H H 431 8.204 8.259 -0.055 1
1 5 . 17 1 1 A 77 77 VAL HA H 431 4.049 4.487 -0.438 1
1 6 . 17 1 1 A 77 77 VAL C C 431 172.636 174.284 -1.648 1
1 7 . 17 1 1 A 77 77 VAL CA C 431 59.315 60.816 -1.501 1
1 8 . 17 1 1 A 77 77 VAL CB C 431 30.219 32.063 -1.844 1
1 9 . 17 1 1 A 77 77 VAL N N 431 125.320 121.062 4.258 1
1 28 . 17 1 1 A 77 77 VAL H H 431 8.412 8.259 0.153 1
1 29 . 17 1 1 A 77 77 VAL HA H 431 4.038 4.487 -0.449 1
1 37 . 17 1 1 A 77 77 VAL C C 431 172.617 174.284 -1.667 1
1 38 . 17 1 1 A 77 77 VAL CA C 431 59.137 60.816 -1.679 1
1 39 . 17 1 1 A 77 77 VAL CB C 431 30.292 32.063 -1.771 1
1 42 . 17 1 1 A 77 77 VAL N N 431 125.655 121.062 4.593 1
1 896 . 17 1 1 A 77 77 VAL H H 431 8.448 8.259 0.189 1
1 897 . 17 1 1 A 77 77 VAL HA H 431 4.087 4.487 -0.400 1
1 905 . 17 1 1 A 77 77 VAL C C 431 172.493 174.284 -1.791 1
1 906 . 17 1 1 A 77 77 VAL CA C 431 59.185 60.816 -1.631 1
1 907 . 17 1 1 A 77 77 VAL CB C 431 30.084 32.063 -1.979 1
1 910 . 17 1 1 A 77 77 VAL N N 431 125.770 121.062 4.708 1
1 43 . 17 1 1 A 78 78 ASP H H 432 8.419 7.733 0.686 1
1 44 . 17 1 1 A 78 78 ASP HA H 432 4.829 4.885 -0.056 1
1 45 . 17 1 1 A 78 78 ASP C C 432 172.252 173.959 -1.707 1
1 46 . 17 1 1 A 78 78 ASP CA C 432 49.320 50.337 -1.017 1
1 47 . 17 1 1 A 78 78 ASP CB C 432 39.066 42.665 -3.599 1
1 48 . 17 1 1 A 78 78 ASP N N 432 126.226 123.946 2.280 1
1 911 . 17 1 1 A 78 78 ASP H H 432 8.493 7.733 0.760 1
1 912 . 17 1 1 A 78 78 ASP HA H 432 4.852 4.885 -0.033 1
1 915 . 17 1 1 A 78 78 ASP C C 432 172.048 173.959 -1.911 1
1 916 . 17 1 1 A 78 78 ASP CA C 432 49.233 50.337 -1.104 1
1 917 . 17 1 1 A 78 78 ASP CB C 432 38.858 42.665 -3.807 1
1 918 . 17 1 1 A 78 78 ASP N N 432 126.705 123.946 2.759 1
1 10 . 17 1 1 A 79 79 PRO CA C 433 63.865 62.089 1.776 1
1 49 . 17 1 1 A 79 79 PRO C C 433 173.867 176.575 -2.708 1
1 919 . 17 1 1 A 79 79 PRO HA H 433 4.237 4.573 -0.336 1
1 926 . 17 1 1 A 79 79 PRO C C 433 173.812 176.575 -2.763 1
1 927 . 17 1 1 A 79 79 PRO CA C 433 60.627 62.089 -1.462 1
1 928 . 17 1 1 A 79 79 PRO CB C 433 29.329 29.203 0.126 1
1 11 . 17 1 1 A 80 80 PHE H H 434 8.182 8.458 -0.276 1
1 12 . 17 1 1 A 80 80 PHE HA H 434 4.499 4.318 0.181 1
1 13 . 17 1 1 A 80 80 PHE C C 434 171.680 175.924 -4.244 1
1 14 . 17 1 1 A 80 80 PHE CA C 434 54.657 60.563 -5.906 1
1 15 . 17 1 1 A 80 80 PHE CB C 434 36.272 39.637 -3.365 1
1 16 . 17 1 1 A 80 80 PHE N N 434 118.611 122.740 -4.129 1
1 50 . 17 1 1 A 80 80 PHE H H 434 8.191 8.458 -0.267 1
1 51 . 17 1 1 A 80 80 PHE HA H 434 4.528 4.318 0.210 1
1 54 . 17 1 1 A 80 80 PHE C C 434 172.457 175.924 -3.467 1
1 55 . 17 1 1 A 80 80 PHE CA C 434 54.828 60.563 -5.735 1
1 56 . 17 1 1 A 80 80 PHE CB C 434 36.457 39.637 -3.180 1
1 57 . 17 1 1 A 80 80 PHE N N 434 118.871 122.740 -3.869 1
1 931 . 17 1 1 A 80 80 PHE H H 434 8.191 8.458 -0.267 1
1 932 . 17 1 1 A 80 80 PHE HA H 434 4.463 4.318 0.145 1
1 939 . 17 1 1 A 80 80 PHE C C 434 172.283 175.924 -3.641 1
1 940 . 17 1 1 A 80 80 PHE CA C 434 54.971 60.563 -5.592 1
1 941 . 17 1 1 A 80 80 PHE CB C 434 36.490 39.637 -3.147 1
1 944 . 17 1 1 A 80 80 PHE N N 434 119.263 122.740 -3.477 1
1 17 . 17 1 1 A 81 81 ASP H H 435 7.490 8.124 -0.634 1
1 18 . 17 1 1 A 81 81 ASP HA H 435 4.698 5.024 -0.326 1
1 19 . 17 1 1 A 81 81 ASP C C 435 171.662 175.085 -3.423 1
1 20 . 17 1 1 A 81 81 ASP CA C 435 49.570 51.056 -1.486 1
1 21 . 17 1 1 A 81 81 ASP CB C 435 40.104 41.888 -1.784 1
1 22 . 17 1 1 A 81 81 ASP N N 435 120.304 117.735 2.569 1
1 58 . 17 1 1 A 81 81 ASP H H 435 7.881 8.124 -0.243 1
1 59 . 17 1 1 A 81 81 ASP HA H 435 4.801 5.024 -0.223 1
1 60 . 17 1 1 A 81 81 ASP C C 435 171.144 175.085 -3.941 1
1 61 . 17 1 1 A 81 81 ASP CA C 435 49.406 51.056 -1.650 1
1 62 . 17 1 1 A 81 81 ASP CB C 435 38.618 41.888 -3.270 1
1 63 . 17 1 1 A 81 81 ASP N N 435 123.108 117.735 5.373 1
1 945 . 17 1 1 A 81 81 ASP H H 435 7.823 8.124 -0.301 1
1 946 . 17 1 1 A 81 81 ASP HA H 435 4.759 5.024 -0.265 1
1 949 . 17 1 1 A 81 81 ASP C C 435 171.057 175.085 -4.028 1
1 950 . 17 1 1 A 81 81 ASP CA C 435 49.174 51.056 -1.882 1
1 951 . 17 1 1 A 81 81 ASP CB C 435 38.725 41.888 -3.163 1
1 952 . 17 1 1 A 81 81 ASP N N 435 123.530 117.735 5.795 1
1 23 . 17 1 1 A 82 82 PRO HA H 436 4.758 4.594 0.164 1
1 24 . 17 1 1 A 82 82 PRO C C 436 172.944 174.870 -1.926 1
1 25 . 17 1 1 A 82 82 PRO CA C 436 60.134 63.119 -2.985 1
1 26 . 17 1 1 A 82 82 PRO CB C 436 31.425 30.477 0.948 1
1 64 . 17 1 1 A 82 82 PRO HA H 436 4.364 4.594 -0.230 1
1 67 . 17 1 1 A 82 82 PRO C C 436 173.563 174.870 -1.307 1
1 68 . 17 1 1 A 82 82 PRO CA C 436 60.729 63.119 -2.390 1
1 69 . 17 1 1 A 82 82 PRO CB C 436 29.160 30.477 -1.317 1
1 953 . 17 1 1 A 82 82 PRO HA H 436 4.296 4.594 -0.298 1
1 960 . 17 1 1 A 82 82 PRO C C 436 173.494 174.870 -1.376 1
1 961 . 17 1 1 A 82 82 PRO CA C 436 60.625 63.119 -2.494 1
1 962 . 17 1 1 A 82 82 PRO CB C 436 29.237 30.477 -1.240 1
1 1 . 18 1 1 A 3 3 LEU HA H 357 4.257 4.089 0.168 1
1 11 . 18 1 1 A 3 3 LEU C C 357 174.994 175.995 -1.001 1
1 12 . 18 1 1 A 3 3 LEU CA C 357 53.329 58.096 -4.767 1
1 13 . 18 1 1 A 3 3 LEU CB C 357 39.382 42.347 -2.965 1
1 17 . 18 1 1 A 4 4 GLN H H 358 8.234 7.848 0.386 1
1 18 . 18 1 1 A 4 4 GLN HA H 358 4.211 4.781 -0.570 1
1 25 . 18 1 1 A 4 4 GLN C C 358 173.357 175.420 -2.063 1
1 26 . 18 1 1 A 4 4 GLN CA C 358 53.791 54.191 -0.400 1
1 27 . 18 1 1 A 4 4 GLN CB C 358 26.456 33.117 -6.661 1
1 29 . 18 1 1 A 4 4 GLN N N 358 119.506 114.630 4.876 1
1 31 . 18 1 1 A 5 5 ASP H H 359 8.090 9.039 -0.949 1
1 32 . 18 1 1 A 5 5 ASP HA H 359 4.458 4.527 -0.069 1
1 35 . 18 1 1 A 5 5 ASP C C 359 173.492 175.572 -2.080 1
1 36 . 18 1 1 A 5 5 ASP CA C 359 52.309 55.617 -3.308 1
1 37 . 18 1 1 A 5 5 ASP CB C 359 38.312 41.450 -3.138 1
1 38 . 18 1 1 A 5 5 ASP N N 359 120.683 120.259 0.424 1
1 39 . 18 1 1 A 6 6 HIS H H 360 8.103 7.895 0.208 1
1 40 . 18 1 1 A 6 6 HIS HA H 360 4.540 4.832 -0.292 1
1 45 . 18 1 1 A 6 6 HIS C C 360 172.801 173.596 -0.795 1
1 46 . 18 1 1 A 6 6 HIS CA C 360 53.874 54.188 -0.314 1
1 47 . 18 1 1 A 6 6 HIS CB C 360 27.878 30.047 -2.169 1
1 50 . 18 1 1 A 6 6 HIS N N 360 118.844 120.236 -1.392 1
1 51 . 18 1 1 A 7 7 ILE H H 361 7.862 8.449 -0.587 1
1 52 . 18 1 1 A 7 7 ILE HA H 361 4.010 4.910 -0.900 1
1 62 . 18 1 1 A 7 7 ILE C C 361 173.268 173.883 -0.615 1
1 63 . 18 1 1 A 7 7 ILE CA C 361 58.740 59.956 -1.216 1
1 64 . 18 1 1 A 7 7 ILE CB C 361 35.788 40.486 -4.698 1
1 68 . 18 1 1 A 7 7 ILE N N 361 121.598 128.424 -6.826 1
1 69 . 18 1 1 A 8 8 LYS H H 362 8.231 9.201 -0.970 1
1 70 . 18 1 1 A 8 8 LYS HA H 362 4.313 5.018 -0.705 1
1 79 . 18 1 1 A 8 8 LYS C C 362 173.899 176.112 -2.213 1
1 80 . 18 1 1 A 8 8 LYS CA C 362 53.677 54.622 -0.945 1
1 81 . 18 1 1 A 8 8 LYS CB C 362 30.355 35.264 -4.909 1
1 85 . 18 1 1 A 8 8 LYS N N 362 124.980 131.183 -6.203 1
1 86 . 18 1 1 A 9 9 VAL H H 363 8.044 8.698 -0.654 1
1 87 . 18 1 1 A 9 9 VAL HA H 363 4.089 4.216 -0.127 1
1 95 . 18 1 1 A 9 9 VAL C C 363 173.760 175.401 -1.641 1
1 96 . 18 1 1 A 9 9 VAL CA C 363 59.814 61.923 -2.109 1
1 97 . 18 1 1 A 9 9 VAL CB C 363 30.058 32.830 -2.772 1
1 100 . 18 1 1 A 9 9 VAL N N 363 121.366 123.101 -1.735 1
1 101 . 18 1 1 A 10 10 THR H H 364 8.076 9.397 -1.321 1
1 102 . 18 1 1 A 10 10 THR HA H 364 4.302 4.509 -0.207 1
1 107 . 18 1 1 A 10 10 THR C C 364 172.135 176.279 -4.144 1
1 108 . 18 1 1 A 10 10 THR CA C 364 59.134 64.134 -5.000 1
1 109 . 18 1 1 A 10 10 THR CB C 364 67.415 70.069 -2.654 1
1 111 . 18 1 1 A 10 10 THR N N 364 116.817 117.546 -0.729 1
1 112 . 18 1 1 A 11 11 GLN H H 365 8.463 8.526 -0.063 1
1 113 . 18 1 1 A 11 11 GLN HA H 365 4.046 4.442 -0.396 1
1 120 . 18 1 1 A 11 11 GLN C C 365 173.944 175.299 -1.355 1
1 121 . 18 1 1 A 11 11 GLN CA C 365 54.517 56.935 -2.418 1
1 122 . 18 1 1 A 11 11 GLN CB C 365 26.250 29.984 -3.734 1
1 124 . 18 1 1 A 11 11 GLN N N 365 122.059 117.216 4.843 1
1 126 . 18 1 1 A 12 12 GLU H H 366 8.449 7.857 0.592 1
1 127 . 18 1 1 A 12 12 GLU HA H 366 4.093 4.709 -0.616 1
1 132 . 18 1 1 A 12 12 GLU C C 366 174.746 176.435 -1.689 1
1 133 . 18 1 1 A 12 12 GLU CA C 366 55.235 54.853 0.382 1
1 134 . 18 1 1 A 12 12 GLU CB C 366 27.180 33.511 -6.331 1
1 136 . 18 1 1 A 12 12 GLU N N 366 120.415 118.178 2.237 1
1 137 . 18 1 1 A 13 13 GLN H H 367 8.031 8.788 -0.757 1
1 138 . 18 1 1 A 13 13 GLN HA H 367 4.113 4.023 0.090 1
1 145 . 18 1 1 A 13 13 GLN C C 367 173.693 175.725 -2.032 1
1 146 . 18 1 1 A 13 13 GLN CA C 367 54.132 57.444 -3.312 1
1 147 . 18 1 1 A 13 13 GLN CB C 367 26.420 27.560 -1.140 1
1 149 . 18 1 1 A 13 13 GLN N N 367 119.721 120.007 -0.286 1
1 151 . 18 1 1 A 14 14 TYR H H 368 8.111 7.689 0.422 1
1 152 . 18 1 1 A 14 14 TYR HA H 368 4.339 4.749 -0.410 1
1 159 . 18 1 1 A 14 14 TYR C C 368 173.916 176.633 -2.717 1
1 160 . 18 1 1 A 14 14 TYR CA C 368 56.572 57.763 -1.191 1
1 161 . 18 1 1 A 14 14 TYR CB C 368 35.879 38.157 -2.278 1
1 164 . 18 1 1 A 14 14 TYR N N 368 120.541 118.867 1.674 1
1 165 . 18 1 1 A 15 15 GLU H H 369 8.287 8.129 0.158 1
1 166 . 18 1 1 A 15 15 GLU HA H 369 4.009 4.493 -0.484 1
1 171 . 18 1 1 A 15 15 GLU C C 369 174.448 177.918 -3.470 1
1 172 . 18 1 1 A 15 15 GLU CA C 369 55.047 58.354 -3.307 1
1 173 . 18 1 1 A 15 15 GLU CB C 369 27.226 29.759 -2.533 1
1 175 . 18 1 1 A 15 15 GLU N N 369 120.398 121.016 -0.618 1
1 176 . 18 1 1 A 16 16 LEU H H 370 7.785 7.961 -0.176 1
1 177 . 18 1 1 A 16 16 LEU HA H 370 4.138 4.466 -0.328 1
1 187 . 18 1 1 A 16 16 LEU C C 370 175.089 177.572 -2.483 1
1 188 . 18 1 1 A 16 16 LEU CA C 370 53.425 54.412 -0.987 1
1 189 . 18 1 1 A 16 16 LEU CB C 370 39.554 41.807 -2.253 1
1 193 . 18 1 1 A 16 16 LEU N N 370 121.323 114.280 7.043 1
1 194 . 18 1 1 A 17 17 TYR H H 371 8.038 7.944 0.094 1
1 195 . 18 1 1 A 17 17 TYR HA H 371 4.380 4.332 0.048 1
1 202 . 18 1 1 A 17 17 TYR C C 371 173.931 176.094 -2.163 1
1 203 . 18 1 1 A 17 17 TYR CA C 371 56.143 60.925 -4.782 1
1 204 . 18 1 1 A 17 17 TYR CB C 371 35.501 37.622 -2.121 1
1 207 . 18 1 1 A 17 17 TYR N N 371 119.465 120.561 -1.096 1
1 208 . 18 1 1 A 18 18 CYS H H 372 8.021 7.258 0.763 1
1 209 . 18 1 1 A 18 18 CYS HA H 372 4.236 4.695 -0.459 1
1 212 . 18 1 1 A 18 18 CYS C C 372 172.457 173.662 -1.205 1
1 213 . 18 1 1 A 18 18 CYS CA C 372 56.997 60.357 -3.360 1
1 214 . 18 1 1 A 18 18 CYS CB C 372 25.080 30.209 -5.129 1
1 215 . 18 1 1 A 18 18 CYS N N 372 119.913 117.924 1.989 1
1 216 . 18 1 1 A 19 19 GLU H H 373 8.151 7.201 0.950 1
1 217 . 18 1 1 A 19 19 GLU HA H 373 4.130 4.528 -0.398 1
1 222 . 18 1 1 A 19 19 GLU C C 373 174.151 173.918 0.233 1
1 223 . 18 1 1 A 19 19 GLU CA C 373 54.535 54.912 -0.377 1
1 224 . 18 1 1 A 19 19 GLU CB C 373 27.244 32.524 -5.280 1
1 226 . 18 1 1 A 19 19 GLU N N 373 122.431 115.729 6.702 1
1 227 . 18 1 1 A 20 20 MET H H 374 8.109 8.707 -0.598 1
1 228 . 18 1 1 A 20 20 MET HA H 374 4.352 4.287 0.065 1
1 236 . 18 1 1 A 20 20 MET C C 374 174.200 176.851 -2.651 1
1 237 . 18 1 1 A 20 20 MET CA C 374 53.238 56.199 -2.961 1
1 238 . 18 1 1 A 20 20 MET CB C 374 30.237 33.906 -3.669 1
1 241 . 18 1 1 A 20 20 MET N N 374 119.754 120.949 -1.195 1
1 242 . 18 1 1 A 21 21 GLY H H 375 8.231 8.819 -0.588 1
1 243 . 18 1 1 A 21 21 GLY HA2 H 375 3.861 4.018 -0.157 1
1 244 . 18 1 1 A 21 21 GLY HA3 H 375 3.960 4.075 -0.115 1
1 245 . 18 1 1 A 21 21 GLY C C 375 171.928 174.626 -2.698 1
1 246 . 18 1 1 A 21 21 GLY CA C 375 42.930 47.139 -4.209 1
1 247 . 18 1 1 A 21 21 GLY N N 375 109.484 113.660 -4.176 1
1 248 . 18 1 1 A 22 22 SER HA H 376 4.492 4.479 0.013 1
1 251 . 18 1 1 A 22 22 SER C C 376 172.206 174.075 -1.869 1
1 252 . 18 1 1 A 22 22 SER CA C 376 55.570 58.201 -2.631 1
1 253 . 18 1 1 A 22 22 SER CB C 376 61.525 63.300 -1.775 1
1 254 . 18 1 1 A 23 23 THR H H 377 8.470 8.417 0.053 1
1 255 . 18 1 1 A 23 23 THR HA H 377 4.295 4.930 -0.635 1
1 260 . 18 1 1 A 23 23 THR C C 377 171.811 173.702 -1.891 1
1 261 . 18 1 1 A 23 23 THR CA C 377 58.937 61.563 -2.626 1
1 262 . 18 1 1 A 23 23 THR CB C 377 67.250 71.001 -3.751 1
1 264 . 18 1 1 A 23 23 THR N N 377 124.043 122.572 1.471 1
1 265 . 18 1 1 A 24 24 PHE H H 378 8.374 8.756 -0.382 1
1 266 . 18 1 1 A 24 24 PHE HA H 378 4.239 4.410 -0.171 1
1 273 . 18 1 1 A 24 24 PHE C C 378 173.411 176.211 -2.800 1
1 274 . 18 1 1 A 24 24 PHE CA C 378 56.697 59.075 -2.378 1
1 275 . 18 1 1 A 24 24 PHE CB C 378 36.538 39.285 -2.747 1
1 278 . 18 1 1 A 24 24 PHE N N 378 124.732 126.222 -1.490 1
1 279 . 18 1 1 A 25 25 GLN H H 379 8.457 8.170 0.287 1
1 280 . 18 1 1 A 25 25 GLN HA H 379 4.038 4.144 -0.106 1
1 287 . 18 1 1 A 25 25 GLN C C 379 172.431 175.638 -3.207 1
1 288 . 18 1 1 A 25 25 GLN CA C 379 54.078 57.996 -3.918 1
1 289 . 18 1 1 A 25 25 GLN CB C 379 26.414 26.772 -0.358 1
1 291 . 18 1 1 A 25 25 GLN N N 379 118.820 120.742 -1.922 1
1 293 . 18 1 1 A 26 26 LEU H H 380 6.985 8.172 -1.187 1
1 294 . 18 1 1 A 26 26 LEU HA H 380 4.229 4.301 -0.072 1
1 304 . 18 1 1 A 26 26 LEU C C 380 173.895 176.368 -2.473 1
1 305 . 18 1 1 A 26 26 LEU CA C 380 52.123 54.650 -2.527 1
1 306 . 18 1 1 A 26 26 LEU CB C 380 40.543 42.559 -2.016 1
1 310 . 18 1 1 A 26 26 LEU N N 380 119.079 120.750 -1.671 1
1 311 . 18 1 1 A 27 27 CYS H H 381 8.905 9.187 -0.282 1
1 312 . 18 1 1 A 27 27 CYS HA H 381 4.013 4.586 -0.573 1
1 315 . 18 1 1 A 27 27 CYS C C 381 174.439 175.965 -1.526 1
1 316 . 18 1 1 A 27 27 CYS CA C 381 57.847 59.575 -1.728 1
1 317 . 18 1 1 A 27 27 CYS CB C 381 28.648 28.549 0.099 1
1 318 . 18 1 1 A 27 27 CYS N N 381 125.151 123.938 1.213 1
1 319 . 18 1 1 A 28 28 LYS H H 382 9.351 8.854 0.497 1
1 320 . 18 1 1 A 28 28 LYS HA H 382 4.157 3.977 0.180 1
1 329 . 18 1 1 A 28 28 LYS C C 382 174.678 178.317 -3.639 1
1 330 . 18 1 1 A 28 28 LYS CA C 382 54.324 59.034 -4.710 1
1 331 . 18 1 1 A 28 28 LYS CB C 382 30.086 32.551 -2.465 1
1 335 . 18 1 1 A 28 28 LYS N N 382 128.840 128.171 0.669 1
1 336 . 18 1 1 A 29 29 ILE H H 383 9.040 8.136 0.904 1
1 337 . 18 1 1 A 29 29 ILE HA H 383 3.804 3.555 0.249 1
1 347 . 18 1 1 A 29 29 ILE C C 383 174.239 177.484 -3.245 1
1 348 . 18 1 1 A 29 29 ILE CA C 383 62.114 65.310 -3.196 1
1 349 . 18 1 1 A 29 29 ILE CB C 383 33.870 38.389 -4.519 1
1 353 . 18 1 1 A 29 29 ILE N N 383 122.718 119.611 3.107 1
1 354 . 18 1 1 A 30 30 CYS H H 384 7.572 7.745 -0.173 1
1 355 . 18 1 1 A 30 30 CYS HA H 384 4.548 4.425 0.123 1
1 358 . 18 1 1 A 30 30 CYS C C 384 172.978 175.191 -2.213 1
1 359 . 18 1 1 A 30 30 CYS CA C 384 54.957 59.705 -4.748 1
1 360 . 18 1 1 A 30 30 CYS CB C 384 29.778 29.349 0.429 1
1 361 . 18 1 1 A 30 30 CYS N N 384 116.356 115.806 0.550 1
1 362 . 18 1 1 A 31 31 ALA H H 385 8.205 8.251 -0.046 1
1 363 . 18 1 1 A 31 31 ALA HA H 385 4.107 4.366 -0.259 1
1 367 . 18 1 1 A 31 31 ALA C C 385 173.139 177.125 -3.986 1
1 368 . 18 1 1 A 31 31 ALA CA C 385 50.802 54.186 -3.384 1
1 369 . 18 1 1 A 31 31 ALA CB C 385 14.634 18.096 -3.462 1
1 370 . 18 1 1 A 31 31 ALA N N 385 125.526 120.786 4.740 1
1 371 . 18 1 1 A 32 32 GLU H H 386 8.416 8.120 0.296 1
1 372 . 18 1 1 A 32 32 GLU HA H 386 4.467 4.432 0.035 1
1 377 . 18 1 1 A 32 32 GLU C C 386 172.325 176.680 -4.355 1
1 378 . 18 1 1 A 32 32 GLU CA C 386 55.146 57.580 -2.434 1
1 379 . 18 1 1 A 32 32 GLU CB C 386 31.181 30.879 0.302 1
1 381 . 18 1 1 A 32 32 GLU N N 386 117.579 116.595 0.984 1
1 382 . 18 1 1 A 33 33 ASN H H 387 7.872 7.940 -0.068 1
1 383 . 18 1 1 A 33 33 ASN HA H 387 4.900 4.964 -0.064 1
1 388 . 18 1 1 A 33 33 ASN C C 387 171.355 174.850 -3.495 1
1 389 . 18 1 1 A 33 33 ASN CA C 387 49.320 52.104 -2.784 1
1 390 . 18 1 1 A 33 33 ASN CB C 387 38.457 39.827 -1.370 1
1 391 . 18 1 1 A 33 33 ASN N N 387 120.399 116.435 3.964 1
1 393 . 18 1 1 A 34 34 ASP H H 388 8.565 8.564 0.001 1
1 394 . 18 1 1 A 34 34 ASP HA H 388 4.679 5.042 -0.363 1
1 397 . 18 1 1 A 34 34 ASP C C 388 174.243 176.392 -2.149 1
1 398 . 18 1 1 A 34 34 ASP CA C 388 51.809 53.624 -1.815 1
1 399 . 18 1 1 A 34 34 ASP CB C 388 38.007 42.190 -4.183 1
1 400 . 18 1 1 A 34 34 ASP N N 388 120.661 120.432 0.229 1
1 401 . 18 1 1 A 35 35 LYS H H 389 8.544 9.282 -0.738 1
1 402 . 18 1 1 A 35 35 LYS HA H 389 3.411 4.273 -0.862 1
1 409 . 18 1 1 A 35 35 LYS C C 389 172.938 176.482 -3.544 1
1 410 . 18 1 1 A 35 35 LYS CA C 389 54.973 56.020 -1.047 1
1 411 . 18 1 1 A 35 35 LYS CB C 389 30.617 31.624 -1.007 1
1 415 . 18 1 1 A 35 35 LYS N N 389 119.199 121.378 -2.179 1
1 416 . 18 1 1 A 36 36 ASP H H 390 8.327 8.943 -0.616 1
1 417 . 18 1 1 A 36 36 ASP HA H 390 4.724 4.687 0.037 1
1 420 . 18 1 1 A 36 36 ASP C C 390 172.860 175.570 -2.710 1
1 421 . 18 1 1 A 36 36 ASP CA C 390 51.609 55.249 -3.640 1
1 422 . 18 1 1 A 36 36 ASP CB C 390 39.018 42.720 -3.702 1
1 423 . 18 1 1 A 36 36 ASP N N 390 119.134 126.790 -7.656 1
1 424 . 18 1 1 A 37 37 VAL H H 391 8.544 8.053 0.491 1
1 425 . 18 1 1 A 37 37 VAL HA H 391 4.877 4.816 0.061 1
1 433 . 18 1 1 A 37 37 VAL C C 391 167.519 173.087 -5.568 1
1 434 . 18 1 1 A 37 37 VAL CA C 391 58.259 60.057 -1.798 1
1 435 . 18 1 1 A 37 37 VAL CB C 391 32.277 35.513 -3.236 1
1 438 . 18 1 1 A 37 37 VAL N N 391 121.970 117.365 4.605 1
1 439 . 18 1 1 A 38 38 LYS H H 392 8.621 9.562 -0.941 1
1 440 . 18 1 1 A 38 38 LYS HA H 392 4.991 5.199 -0.208 1
1 449 . 18 1 1 A 38 38 LYS C C 392 172.681 175.307 -2.626 1
1 450 . 18 1 1 A 38 38 LYS CA C 392 51.123 54.636 -3.513 1
1 451 . 18 1 1 A 38 38 LYS CB C 392 33.697 34.889 -1.192 1
1 455 . 18 1 1 A 38 38 LYS N N 392 126.381 128.879 -2.498 1
1 456 . 18 1 1 A 39 39 ILE H H 393 8.723 8.917 -0.194 1
1 457 . 18 1 1 A 39 39 ILE HA H 393 4.239 4.367 -0.128 1
1 467 . 18 1 1 A 39 39 ILE C C 393 172.642 175.679 -3.037 1
1 468 . 18 1 1 A 39 39 ILE CA C 393 57.768 61.059 -3.291 1
1 469 . 18 1 1 A 39 39 ILE CB C 393 35.691 37.352 -1.661 1
1 473 . 18 1 1 A 39 39 ILE N N 393 126.398 127.654 -1.256 1
1 474 . 18 1 1 A 40 40 GLU H H 394 8.506 9.261 -0.755 1
1 475 . 18 1 1 A 40 40 GLU HA H 394 4.753 4.775 -0.022 1
1 480 . 18 1 1 A 40 40 GLU C C 394 173.596 176.087 -2.491 1
1 481 . 18 1 1 A 40 40 GLU CA C 394 49.793 53.171 -3.378 1
1 482 . 18 1 1 A 40 40 GLU CB C 394 28.210 30.708 -2.498 1
1 484 . 18 1 1 A 40 40 GLU N N 394 124.864 127.871 -3.007 1
1 485 . 18 1 1 A 41 41 PRO HA H 395 4.864 4.506 0.358 1
1 492 . 18 1 1 A 41 41 PRO C C 395 175.073 177.117 -2.044 1
1 493 . 18 1 1 A 41 41 PRO CA C 395 61.111 63.919 -2.808 1
1 494 . 18 1 1 A 41 41 PRO CB C 395 32.275 32.950 -0.675 1
1 497 . 18 1 1 A 42 42 CYS H H 396 7.828 7.805 0.023 1
1 498 . 18 1 1 A 42 42 CYS HA H 396 4.208 4.153 0.055 1
1 501 . 18 1 1 A 42 42 CYS C C 396 173.877 174.967 -1.090 1
1 502 . 18 1 1 A 42 42 CYS CA C 396 58.021 61.167 -3.146 1
1 503 . 18 1 1 A 42 42 CYS CB C 396 28.242 27.708 0.534 1
1 504 . 18 1 1 A 42 42 CYS N N 396 122.434 118.117 4.317 1
1 505 . 18 1 1 A 43 43 GLY H H 397 8.679 8.775 -0.096 1
1 506 . 18 1 1 A 43 43 GLY HA2 H 397 3.507 3.904 -0.397 1
1 507 . 18 1 1 A 43 43 GLY HA3 H 397 3.914 3.910 0.004 1
1 508 . 18 1 1 A 43 43 GLY C C 397 171.981 174.777 -2.796 1
1 509 . 18 1 1 A 43 43 GLY CA C 397 43.347 45.876 -2.529 1
1 510 . 18 1 1 A 43 43 GLY N N 397 112.123 108.526 3.597 1
1 511 . 18 1 1 A 44 44 HIS H H 398 8.329 7.211 1.118 1
1 512 . 18 1 1 A 44 44 HIS HA H 398 4.339 4.528 -0.189 1
1 517 . 18 1 1 A 44 44 HIS C C 398 170.742 174.700 -3.958 1
1 518 . 18 1 1 A 44 44 HIS CA C 398 58.368 56.045 2.323 1
1 519 . 18 1 1 A 44 44 HIS CB C 398 28.434 31.549 -3.115 1
1 522 . 18 1 1 A 44 44 HIS N N 398 121.393 117.621 3.772 1
1 523 . 18 1 1 A 45 45 LEU H H 399 8.241 8.780 -0.539 1
1 524 . 18 1 1 A 45 45 LEU HA H 399 5.570 5.223 0.347 1
1 534 . 18 1 1 A 45 45 LEU C C 399 174.464 175.529 -1.065 1
1 535 . 18 1 1 A 45 45 LEU CA C 399 50.729 53.612 -2.883 1
1 536 . 18 1 1 A 45 45 LEU CB C 399 43.574 44.150 -0.576 1
1 540 . 18 1 1 A 45 45 LEU N N 399 118.469 122.198 -3.729 1
1 541 . 18 1 1 A 46 46 MET H H 400 8.707 8.733 -0.026 1
1 542 . 18 1 1 A 46 46 MET HA H 400 4.842 5.025 -0.183 1
1 550 . 18 1 1 A 46 46 MET C C 400 170.736 174.267 -3.531 1
1 551 . 18 1 1 A 46 46 MET CA C 400 52.804 54.211 -1.407 1
1 552 . 18 1 1 A 46 46 MET CB C 400 31.945 35.283 -3.338 1
1 555 . 18 1 1 A 46 46 MET N N 400 114.897 120.148 -5.251 1
1 556 . 18 1 1 A 47 47 CYS H H 401 9.436 8.234 1.202 1
1 557 . 18 1 1 A 47 47 CYS HA H 401 5.629 4.975 0.654 1
1 560 . 18 1 1 A 47 47 CYS C C 401 173.909 176.028 -2.119 1
1 561 . 18 1 1 A 47 47 CYS CA C 401 54.325 56.879 -2.554 1
1 562 . 18 1 1 A 47 47 CYS CB C 401 30.725 29.819 0.906 1
1 563 . 18 1 1 A 47 47 CYS N N 401 119.575 119.051 0.524 1
1 564 . 18 1 1 A 48 48 THR H H 402 9.842 8.882 0.960 1
1 565 . 18 1 1 A 48 48 THR HA H 402 3.768 3.976 -0.208 1
1 570 . 18 1 1 A 48 48 THR C C 402 174.333 176.214 -1.881 1
1 571 . 18 1 1 A 48 48 THR CA C 402 64.516 65.832 -1.316 1
1 572 . 18 1 1 A 48 48 THR CB C 402 66.288 68.649 -2.361 1
1 574 . 18 1 1 A 48 48 THR N N 402 119.945 119.211 0.734 1
1 575 . 18 1 1 A 49 49 SER H H 403 8.355 8.021 0.334 1
1 576 . 18 1 1 A 49 49 SER HA H 403 4.222 4.094 0.128 1
1 579 . 18 1 1 A 49 49 SER C C 403 175.059 176.900 -1.841 1
1 580 . 18 1 1 A 49 49 SER CA C 403 59.828 61.904 -2.076 1
1 581 . 18 1 1 A 49 49 SER CB C 403 59.717 62.725 -3.008 1
1 582 . 18 1 1 A 49 49 SER N N 403 120.468 117.200 3.268 1
1 583 . 18 1 1 A 50 50 CYS H H 404 9.464 8.328 1.136 1
1 584 . 18 1 1 A 50 50 CYS HA H 404 3.922 4.131 -0.209 1
1 587 . 18 1 1 A 50 50 CYS C C 404 176.081 177.072 -0.991 1
1 588 . 18 1 1 A 50 50 CYS CA C 404 63.076 64.177 -1.101 1
1 589 . 18 1 1 A 50 50 CYS CB C 404 26.078 27.285 -1.207 1
1 590 . 18 1 1 A 50 50 CYS N N 404 126.744 119.788 6.956 1
1 591 . 18 1 1 A 51 51 LEU H H 405 7.948 8.296 -0.348 1
1 592 . 18 1 1 A 51 51 LEU HA H 405 4.064 4.170 -0.106 1
1 602 . 18 1 1 A 51 51 LEU C C 405 175.495 178.769 -3.274 1
1 603 . 18 1 1 A 51 51 LEU CA C 405 55.914 58.008 -2.094 1
1 604 . 18 1 1 A 51 51 LEU CB C 405 38.662 41.856 -3.194 1
1 607 . 18 1 1 A 51 51 LEU N N 405 121.951 123.154 -1.203 1
1 608 . 18 1 1 A 52 52 THR H H 406 8.786 8.301 0.485 1
1 609 . 18 1 1 A 52 52 THR HA H 406 4.024 3.966 0.058 1
1 614 . 18 1 1 A 52 52 THR C C 406 174.139 175.796 -1.657 1
1 615 . 18 1 1 A 52 52 THR CA C 406 64.017 66.020 -2.003 1
1 616 . 18 1 1 A 52 52 THR CB C 406 66.115 68.570 -2.455 1
1 618 . 18 1 1 A 52 52 THR N N 406 115.258 115.102 0.156 1
1 619 . 18 1 1 A 53 53 SER H H 407 8.115 8.061 0.054 1
1 620 . 18 1 1 A 53 53 SER HA H 407 4.204 4.093 0.111 1
1 623 . 18 1 1 A 53 53 SER C C 407 174.456 176.158 -1.702 1
1 624 . 18 1 1 A 53 53 SER CA C 407 59.090 62.730 -3.640 1
1 625 . 18 1 1 A 53 53 SER CB C 407 60.146 63.255 -3.109 1
1 626 . 18 1 1 A 53 53 SER N N 407 116.852 116.683 0.169 1
1 627 . 18 1 1 A 54 54 TRP H H 408 8.123 8.230 -0.107 1
1 628 . 18 1 1 A 54 54 TRP HA H 408 4.371 4.253 0.118 1
1 637 . 18 1 1 A 54 54 TRP C C 408 175.981 178.636 -2.655 1
1 638 . 18 1 1 A 54 54 TRP CA C 408 57.323 61.045 -3.722 1
1 639 . 18 1 1 A 54 54 TRP CB C 408 26.812 29.702 -2.890 1
1 645 . 18 1 1 A 54 54 TRP N N 408 123.556 123.805 -0.249 1
1 647 . 18 1 1 A 55 55 GLN H H 409 8.502 8.333 0.169 1
1 648 . 18 1 1 A 55 55 GLN HA H 409 3.999 3.740 0.259 1
1 655 . 18 1 1 A 55 55 GLN C C 409 177.300 178.047 -0.747 1
1 656 . 18 1 1 A 55 55 GLN CA C 409 56.484 59.139 -2.655 1
1 657 . 18 1 1 A 55 55 GLN CB C 409 26.190 28.284 -2.094 1
1 659 . 18 1 1 A 55 55 GLN N N 409 118.044 118.368 -0.324 1
1 661 . 18 1 1 A 56 56 GLU H H 410 8.467 8.275 0.192 1
1 662 . 18 1 1 A 56 56 GLU HA H 410 4.057 4.100 -0.043 1
1 667 . 18 1 1 A 56 56 GLU C C 410 174.787 177.799 -3.012 1
1 668 . 18 1 1 A 56 56 GLU CA C 410 55.909 58.396 -2.487 1
1 669 . 18 1 1 A 56 56 GLU CB C 410 26.895 29.765 -2.870 1
1 671 . 18 1 1 A 56 56 GLU N N 410 119.448 118.449 0.999 1
1 672 . 18 1 1 A 57 57 SER H H 411 7.438 7.429 0.009 1
1 673 . 18 1 1 A 57 57 SER HA H 411 4.607 4.464 0.143 1
1 676 . 18 1 1 A 57 57 SER C C 411 170.849 172.892 -2.043 1
1 677 . 18 1 1 A 57 57 SER CA C 411 55.540 57.957 -2.417 1
1 678 . 18 1 1 A 57 57 SER CB C 411 60.928 63.197 -2.269 1
1 679 . 18 1 1 A 57 57 SER N N 411 113.752 112.283 1.469 1
1 680 . 18 1 1 A 58 58 GLU H H 412 7.855 7.691 0.164 1
1 681 . 18 1 1 A 58 58 GLU HA H 412 3.772 3.965 -0.193 1
1 686 . 18 1 1 A 58 58 GLU C C 412 173.743 175.413 -1.670 1
1 687 . 18 1 1 A 58 58 GLU CA C 412 54.442 56.866 -2.424 1
1 688 . 18 1 1 A 58 58 GLU CB C 412 24.603 28.336 -3.733 1
1 690 . 18 1 1 A 58 58 GLU N N 412 115.908 116.925 -1.017 1
1 691 . 18 1 1 A 59 59 GLY H H 413 7.588 8.234 -0.646 1
1 692 . 18 1 1 A 59 59 GLY HA2 H 413 1.643 3.632 -1.989 1
1 693 . 18 1 1 A 59 59 GLY HA3 H 413 2.949 3.884 -0.935 1
1 694 . 18 1 1 A 59 59 GLY C C 413 170.850 174.730 -3.880 1
1 695 . 18 1 1 A 59 59 GLY CA C 413 41.724 44.490 -2.766 1
1 696 . 18 1 1 A 59 59 GLY N N 413 108.032 110.950 -2.918 1
1 697 . 18 1 1 A 60 60 GLN H H 414 7.973 8.677 -0.704 1
1 698 . 18 1 1 A 60 60 GLN HA H 414 4.366 4.660 -0.294 1
1 705 . 18 1 1 A 60 60 GLN C C 414 173.108 175.786 -2.678 1
1 706 . 18 1 1 A 60 60 GLN CA C 414 52.422 55.433 -3.011 1
1 707 . 18 1 1 A 60 60 GLN CB C 414 27.049 29.512 -2.463 1
1 709 . 18 1 1 A 60 60 GLN N N 414 122.690 121.214 1.476 1
1 711 . 18 1 1 A 61 61 GLY H H 415 8.301 7.780 0.521 1
1 712 . 18 1 1 A 61 61 GLY HA2 H 415 3.700 4.072 -0.372 1
1 713 . 18 1 1 A 61 61 GLY HA3 H 415 3.920 4.097 -0.177 1
1 714 . 18 1 1 A 61 61 GLY C C 415 170.249 172.161 -1.912 1
1 715 . 18 1 1 A 61 61 GLY CA C 415 42.210 45.480 -3.270 1
1 716 . 18 1 1 A 61 61 GLY N N 415 110.794 107.892 2.902 1
1 717 . 18 1 1 A 62 62 CYS H H 416 8.549 8.476 0.073 1
1 718 . 18 1 1 A 62 62 CYS HA H 416 4.227 4.626 -0.399 1
1 721 . 18 1 1 A 62 62 CYS C C 416 172.914 175.310 -2.396 1
1 722 . 18 1 1 A 62 62 CYS CA C 416 54.008 58.681 -4.673 1
1 723 . 18 1 1 A 62 62 CYS CB C 416 29.716 27.442 2.274 1
1 724 . 18 1 1 A 62 62 CYS N N 416 123.683 120.393 3.290 1
1 725 . 18 1 1 A 63 63 PRO HA H 417 2.611 2.614 -0.003 1
1 732 . 18 1 1 A 63 63 PRO C C 417 174.143 178.356 -4.213 1
1 733 . 18 1 1 A 63 63 PRO CA C 417 61.689 64.260 -2.571 1
1 734 . 18 1 1 A 63 63 PRO CB C 417 28.534 31.241 -2.707 1
1 737 . 18 1 1 A 64 64 PHE H H 418 8.968 7.608 1.360 1
1 738 . 18 1 1 A 64 64 PHE HA H 418 4.250 4.076 0.174 1
1 746 . 18 1 1 A 64 64 PHE C C 418 174.243 178.342 -4.099 1
1 747 . 18 1 1 A 64 64 PHE CA C 418 56.720 60.578 -3.858 1
1 748 . 18 1 1 A 64 64 PHE CB C 418 36.458 38.836 -2.378 1
1 752 . 18 1 1 A 64 64 PHE N N 418 117.008 116.154 0.854 1
1 753 . 18 1 1 A 65 65 CYS H H 419 7.968 7.925 0.043 1
1 754 . 18 1 1 A 65 65 CYS HA H 419 4.906 4.475 0.431 1
1 757 . 18 1 1 A 65 65 CYS C C 419 173.198 174.797 -1.599 1
1 758 . 18 1 1 A 65 65 CYS CA C 419 55.870 60.043 -4.173 1
1 759 . 18 1 1 A 65 65 CYS CB C 419 30.559 28.940 1.619 1
1 760 . 18 1 1 A 65 65 CYS N N 419 117.505 117.239 0.266 1
1 761 . 18 1 1 A 66 66 ARG H H 420 8.761 8.186 0.575 1
1 762 . 18 1 1 A 66 66 ARG HA H 420 4.365 4.285 0.080 1
1 769 . 18 1 1 A 66 66 ARG C C 420 172.921 174.942 -2.021 1
1 770 . 18 1 1 A 66 66 ARG CA C 420 54.763 56.947 -2.184 1
1 771 . 18 1 1 A 66 66 ARG CB C 420 24.286 28.327 -4.041 1
1 774 . 18 1 1 A 66 66 ARG N N 420 118.763 116.913 1.850 1
1 775 . 18 1 1 A 67 67 CYS H H 421 8.223 7.740 0.483 1
1 776 . 18 1 1 A 67 67 CYS HA H 421 4.419 5.080 -0.661 1
1 779 . 18 1 1 A 67 67 CYS C C 421 171.160 173.686 -2.526 1
1 780 . 18 1 1 A 67 67 CYS CA C 421 57.119 57.406 -0.287 1
1 781 . 18 1 1 A 67 67 CYS CB C 421 25.911 30.999 -5.088 1
1 782 . 18 1 1 A 67 67 CYS N N 421 120.627 114.822 5.805 1
1 783 . 18 1 1 A 68 68 GLU H H 422 8.416 8.518 -0.102 1
1 784 . 18 1 1 A 68 68 GLU HA H 422 4.025 4.135 -0.110 1
1 789 . 18 1 1 A 68 68 GLU C C 422 173.764 176.315 -2.551 1
1 790 . 18 1 1 A 68 68 GLU CA C 422 54.752 57.603 -2.851 1
1 791 . 18 1 1 A 68 68 GLU CB C 422 27.302 29.718 -2.416 1
1 793 . 18 1 1 A 68 68 GLU N N 422 122.370 121.198 1.172 1
1 794 . 18 1 1 A 69 69 ILE H H 423 8.648 8.950 -0.302 1
1 795 . 18 1 1 A 69 69 ILE HA H 423 4.012 4.378 -0.366 1
1 805 . 18 1 1 A 69 69 ILE C C 423 174.257 175.636 -1.379 1
1 806 . 18 1 1 A 69 69 ILE CA C 423 59.740 60.718 -0.978 1
1 807 . 18 1 1 A 69 69 ILE CB C 423 35.846 37.686 -1.840 1
1 811 . 18 1 1 A 69 69 ILE N N 423 125.988 126.272 -0.284 1
1 812 . 18 1 1 A 70 70 LYS H H 424 9.185 9.070 0.115 1
1 813 . 18 1 1 A 70 70 LYS HA H 424 4.434 4.639 -0.205 1
1 822 . 18 1 1 A 70 70 LYS C C 424 173.880 177.011 -3.131 1
1 823 . 18 1 1 A 70 70 LYS CA C 424 53.378 56.550 -3.172 1
1 824 . 18 1 1 A 70 70 LYS CB C 424 30.397 34.695 -4.298 1
1 828 . 18 1 1 A 70 70 LYS N N 424 128.977 127.323 1.654 1
1 829 . 18 1 1 A 71 71 GLY H H 425 7.810 7.819 -0.009 1
1 830 . 18 1 1 A 71 71 GLY HA2 H 425 4.094 4.011 0.083 1
1 831 . 18 1 1 A 71 71 GLY HA3 H 425 4.159 4.013 0.146 1
1 832 . 18 1 1 A 71 71 GLY C C 425 168.179 172.094 -3.915 1
1 833 . 18 1 1 A 71 71 GLY CA C 425 42.326 45.180 -2.854 1
1 834 . 18 1 1 A 71 71 GLY N N 425 107.696 103.858 3.838 1
1 835 . 18 1 1 A 72 72 THR H H 426 8.048 8.484 -0.436 1
1 836 . 18 1 1 A 72 72 THR HA H 426 5.258 5.464 -0.206 1
1 841 . 18 1 1 A 72 72 THR C C 426 170.979 172.120 -1.141 1
1 842 . 18 1 1 A 72 72 THR CA C 426 56.755 59.910 -3.155 1
1 843 . 18 1 1 A 72 72 THR CB C 426 69.226 72.306 -3.080 1
1 845 . 18 1 1 A 72 72 THR N N 426 109.122 111.041 -1.919 1
1 846 . 18 1 1 A 73 73 GLU H H 427 8.912 9.285 -0.373 1
1 847 . 18 1 1 A 73 73 GLU HA H 427 4.954 4.876 0.078 1
1 852 . 18 1 1 A 73 73 GLU C C 427 170.353 174.334 -3.981 1
1 853 . 18 1 1 A 73 73 GLU CA C 427 50.182 52.919 -2.737 1
1 854 . 18 1 1 A 73 73 GLU CB C 427 30.559 33.398 -2.839 1
1 856 . 18 1 1 A 73 73 GLU N N 427 121.703 121.838 -0.135 1
1 1 . 18 1 1 A 74 74 PRO HA H 428 4.372 4.736 -0.364 1
1 2 . 18 1 1 A 74 74 PRO C C 428 173.839 176.236 -2.397 1
1 3 . 18 1 1 A 74 74 PRO CA C 428 60.241 62.819 -2.578 1
1 4 . 18 1 1 A 74 74 PRO CB C 428 29.299 32.185 -2.886 1
1 857 . 18 1 1 A 74 74 PRO HA H 428 4.782 4.736 0.046 1
1 864 . 18 1 1 A 74 74 PRO C C 428 174.027 176.236 -2.209 1
1 865 . 18 1 1 A 74 74 PRO CA C 428 59.771 62.819 -3.048 1
1 866 . 18 1 1 A 74 74 PRO CB C 428 29.633 32.185 -2.552 1
1 7 . 18 1 1 A 75 75 ILE H H 429 8.144 9.079 -0.935 1
1 8 . 18 1 1 A 75 75 ILE HA H 429 4.086 4.571 -0.485 1
1 15 . 18 1 1 A 75 75 ILE C C 429 173.426 175.317 -1.891 1
1 16 . 18 1 1 A 75 75 ILE CA C 429 58.339 60.773 -2.434 1
1 17 . 18 1 1 A 75 75 ILE CB C 429 35.988 39.213 -3.225 1
1 21 . 18 1 1 A 75 75 ILE N N 429 121.551 122.940 -1.389 1
1 869 . 18 1 1 A 75 75 ILE H H 429 7.682 9.079 -1.397 1
1 870 . 18 1 1 A 75 75 ILE HA H 429 4.282 4.571 -0.289 1
1 880 . 18 1 1 A 75 75 ILE C C 429 172.510 175.317 -2.807 1
1 881 . 18 1 1 A 75 75 ILE CA C 429 57.456 60.773 -3.317 1
1 882 . 18 1 1 A 75 75 ILE CB C 429 37.903 39.213 -1.310 1
1 886 . 18 1 1 A 75 75 ILE N N 429 119.651 122.940 -3.289 1
1 1 . 18 1 1 A 76 76 VAL HA H 430 4.086 4.566 -0.480 1
1 2 . 18 1 1 A 76 76 VAL CA C 430 59.372 61.687 -2.315 1
1 22 . 18 1 1 A 76 76 VAL H H 430 8.221 8.839 -0.618 1
1 23 . 18 1 1 A 76 76 VAL HA H 430 4.083 4.566 -0.483 1
1 24 . 18 1 1 A 76 76 VAL C C 430 173.067 174.863 -1.796 1
1 25 . 18 1 1 A 76 76 VAL CA C 430 59.445 61.687 -2.242 1
1 26 . 18 1 1 A 76 76 VAL CB C 430 30.407 33.392 -2.985 1
1 27 . 18 1 1 A 76 76 VAL N N 430 125.930 127.304 -1.374 1
1 887 . 18 1 1 A 76 76 VAL H H 430 8.122 8.839 -0.717 1
1 888 . 18 1 1 A 76 76 VAL HA H 430 4.197 4.566 -0.369 1
1 890 . 18 1 1 A 76 76 VAL C C 430 172.971 174.863 -1.892 1
1 891 . 18 1 1 A 76 76 VAL CA C 430 58.821 61.687 -2.866 1
1 892 . 18 1 1 A 76 76 VAL CB C 430 30.807 33.392 -2.585 1
1 895 . 18 1 1 A 76 76 VAL N N 430 124.178 127.304 -3.126 1
1 4 . 18 1 1 A 77 77 VAL H H 431 8.204 8.738 -0.534 1
1 5 . 18 1 1 A 77 77 VAL HA H 431 4.049 5.000 -0.951 1
1 6 . 18 1 1 A 77 77 VAL C C 431 172.636 175.079 -2.443 1
1 7 . 18 1 1 A 77 77 VAL CA C 431 59.315 59.779 -0.464 1
1 8 . 18 1 1 A 77 77 VAL CB C 431 30.219 33.959 -3.740 1
1 9 . 18 1 1 A 77 77 VAL N N 431 125.320 121.747 3.573 1
1 28 . 18 1 1 A 77 77 VAL H H 431 8.412 8.738 -0.326 1
1 29 . 18 1 1 A 77 77 VAL HA H 431 4.038 5.000 -0.962 1
1 37 . 18 1 1 A 77 77 VAL C C 431 172.617 175.079 -2.462 1
1 38 . 18 1 1 A 77 77 VAL CA C 431 59.137 59.779 -0.642 1
1 39 . 18 1 1 A 77 77 VAL CB C 431 30.292 33.959 -3.667 1
1 42 . 18 1 1 A 77 77 VAL N N 431 125.655 121.747 3.908 1
1 896 . 18 1 1 A 77 77 VAL H H 431 8.448 8.738 -0.290 1
1 897 . 18 1 1 A 77 77 VAL HA H 431 4.087 5.000 -0.913 1
1 905 . 18 1 1 A 77 77 VAL C C 431 172.493 175.079 -2.586 1
1 906 . 18 1 1 A 77 77 VAL CA C 431 59.185 59.779 -0.594 1
1 907 . 18 1 1 A 77 77 VAL CB C 431 30.084 33.959 -3.875 1
1 910 . 18 1 1 A 77 77 VAL N N 431 125.770 121.747 4.023 1
1 43 . 18 1 1 A 78 78 ASP H H 432 8.419 8.952 -0.533 1
1 44 . 18 1 1 A 78 78 ASP HA H 432 4.829 4.917 -0.088 1
1 45 . 18 1 1 A 78 78 ASP C C 432 172.252 176.454 -4.202 1
1 46 . 18 1 1 A 78 78 ASP CA C 432 49.320 52.834 -3.514 1
1 47 . 18 1 1 A 78 78 ASP CB C 432 39.066 40.316 -1.250 1
1 48 . 18 1 1 A 78 78 ASP N N 432 126.226 124.070 2.156 1
1 911 . 18 1 1 A 78 78 ASP H H 432 8.493 8.952 -0.459 1
1 912 . 18 1 1 A 78 78 ASP HA H 432 4.852 4.917 -0.065 1
1 915 . 18 1 1 A 78 78 ASP C C 432 172.048 176.454 -4.406 1
1 916 . 18 1 1 A 78 78 ASP CA C 432 49.233 52.834 -3.601 1
1 917 . 18 1 1 A 78 78 ASP CB C 432 38.858 40.316 -1.458 1
1 918 . 18 1 1 A 78 78 ASP N N 432 126.705 124.070 2.635 1
1 10 . 18 1 1 A 79 79 PRO CA C 433 63.865 66.159 -2.294 1
1 49 . 18 1 1 A 79 79 PRO C C 433 173.867 177.942 -4.075 1
1 919 . 18 1 1 A 79 79 PRO HA H 433 4.237 4.414 -0.177 1
1 926 . 18 1 1 A 79 79 PRO C C 433 173.812 177.942 -4.130 1
1 927 . 18 1 1 A 79 79 PRO CA C 433 60.627 66.159 -5.532 1
1 928 . 18 1 1 A 79 79 PRO CB C 433 29.329 31.633 -2.304 1
1 11 . 18 1 1 A 80 80 PHE H H 434 8.182 8.401 -0.219 1
1 12 . 18 1 1 A 80 80 PHE HA H 434 4.499 4.449 0.050 1
1 13 . 18 1 1 A 80 80 PHE C C 434 171.680 174.073 -2.393 1
1 14 . 18 1 1 A 80 80 PHE CA C 434 54.657 60.008 -5.351 1
1 15 . 18 1 1 A 80 80 PHE CB C 434 36.272 38.814 -2.542 1
1 16 . 18 1 1 A 80 80 PHE N N 434 118.611 117.746 0.865 1
1 50 . 18 1 1 A 80 80 PHE H H 434 8.191 8.401 -0.210 1
1 51 . 18 1 1 A 80 80 PHE HA H 434 4.528 4.449 0.079 1
1 54 . 18 1 1 A 80 80 PHE C C 434 172.457 174.073 -1.616 1
1 55 . 18 1 1 A 80 80 PHE CA C 434 54.828 60.008 -5.180 1
1 56 . 18 1 1 A 80 80 PHE CB C 434 36.457 38.814 -2.357 1
1 57 . 18 1 1 A 80 80 PHE N N 434 118.871 117.746 1.125 1
1 931 . 18 1 1 A 80 80 PHE H H 434 8.191 8.401 -0.210 1
1 932 . 18 1 1 A 80 80 PHE HA H 434 4.463 4.449 0.014 1
1 939 . 18 1 1 A 80 80 PHE C C 434 172.283 174.073 -1.790 1
1 940 . 18 1 1 A 80 80 PHE CA C 434 54.971 60.008 -5.037 1
1 941 . 18 1 1 A 80 80 PHE CB C 434 36.490 38.814 -2.324 1
1 944 . 18 1 1 A 80 80 PHE N N 434 119.263 117.746 1.517 1
1 17 . 18 1 1 A 81 81 ASP H H 435 7.490 8.876 -1.386 1
1 18 . 18 1 1 A 81 81 ASP HA H 435 4.698 4.922 -0.224 1
1 19 . 18 1 1 A 81 81 ASP C C 435 171.662 174.340 -2.678 1
1 20 . 18 1 1 A 81 81 ASP CA C 435 49.570 51.665 -2.095 1
1 21 . 18 1 1 A 81 81 ASP CB C 435 40.104 41.007 -0.903 1
1 22 . 18 1 1 A 81 81 ASP N N 435 120.304 118.352 1.952 1
1 58 . 18 1 1 A 81 81 ASP H H 435 7.881 8.876 -0.995 1
1 59 . 18 1 1 A 81 81 ASP HA H 435 4.801 4.922 -0.121 1
1 60 . 18 1 1 A 81 81 ASP C C 435 171.144 174.340 -3.196 1
1 61 . 18 1 1 A 81 81 ASP CA C 435 49.406 51.665 -2.259 1
1 62 . 18 1 1 A 81 81 ASP CB C 435 38.618 41.007 -2.389 1
1 63 . 18 1 1 A 81 81 ASP N N 435 123.108 118.352 4.756 1
1 945 . 18 1 1 A 81 81 ASP H H 435 7.823 8.876 -1.053 1
1 946 . 18 1 1 A 81 81 ASP HA H 435 4.759 4.922 -0.163 1
1 949 . 18 1 1 A 81 81 ASP C C 435 171.057 174.340 -3.283 1
1 950 . 18 1 1 A 81 81 ASP CA C 435 49.174 51.665 -2.491 1
1 951 . 18 1 1 A 81 81 ASP CB C 435 38.725 41.007 -2.282 1
1 952 . 18 1 1 A 81 81 ASP N N 435 123.530 118.352 5.178 1
1 23 . 18 1 1 A 82 82 PRO HA H 436 4.758 4.867 -0.109 1
1 24 . 18 1 1 A 82 82 PRO C C 436 172.944 175.579 -2.635 1
1 25 . 18 1 1 A 82 82 PRO CA C 436 60.134 62.267 -2.133 1
1 26 . 18 1 1 A 82 82 PRO CB C 436 31.425 33.108 -1.683 1
1 64 . 18 1 1 A 82 82 PRO HA H 436 4.364 4.867 -0.503 1
1 67 . 18 1 1 A 82 82 PRO C C 436 173.563 175.579 -2.016 1
1 68 . 18 1 1 A 82 82 PRO CA C 436 60.729 62.267 -1.538 1
1 69 . 18 1 1 A 82 82 PRO CB C 436 29.160 33.108 -3.948 1
1 953 . 18 1 1 A 82 82 PRO HA H 436 4.296 4.867 -0.571 1
1 960 . 18 1 1 A 82 82 PRO C C 436 173.494 175.579 -2.085 1
1 961 . 18 1 1 A 82 82 PRO CA C 436 60.625 62.267 -1.642 1
1 962 . 18 1 1 A 82 82 PRO CB C 436 29.237 33.108 -3.871 1
1 1 . 19 1 1 A 3 3 LEU HA H 357 4.257 4.249 0.008 1
1 11 . 19 1 1 A 3 3 LEU C C 357 174.994 176.871 -1.877 1
1 12 . 19 1 1 A 3 3 LEU CA C 357 53.329 56.296 -2.967 1
1 13 . 19 1 1 A 3 3 LEU CB C 357 39.382 43.326 -3.944 1
1 17 . 19 1 1 A 4 4 GLN H H 358 8.234 7.793 0.441 1
1 18 . 19 1 1 A 4 4 GLN HA H 358 4.211 4.634 -0.423 1
1 25 . 19 1 1 A 4 4 GLN C C 358 173.357 174.459 -1.102 1
1 26 . 19 1 1 A 4 4 GLN CA C 358 53.791 57.262 -3.471 1
1 27 . 19 1 1 A 4 4 GLN CB C 358 26.456 31.384 -4.928 1
1 29 . 19 1 1 A 4 4 GLN N N 358 119.506 113.793 5.713 1
1 31 . 19 1 1 A 5 5 ASP H H 359 8.090 8.173 -0.083 1
1 32 . 19 1 1 A 5 5 ASP HA H 359 4.458 4.858 -0.400 1
1 35 . 19 1 1 A 5 5 ASP C C 359 173.492 175.861 -2.369 1
1 36 . 19 1 1 A 5 5 ASP CA C 359 52.309 53.372 -1.063 1
1 37 . 19 1 1 A 5 5 ASP CB C 359 38.312 42.554 -4.242 1
1 38 . 19 1 1 A 5 5 ASP N N 359 120.683 120.058 0.625 1
1 39 . 19 1 1 A 6 6 HIS H H 360 8.103 8.586 -0.483 1
1 40 . 19 1 1 A 6 6 HIS HA H 360 4.540 4.147 0.393 1
1 45 . 19 1 1 A 6 6 HIS C C 360 172.801 174.281 -1.480 1
1 46 . 19 1 1 A 6 6 HIS CA C 360 53.874 56.243 -2.369 1
1 47 . 19 1 1 A 6 6 HIS CB C 360 27.878 27.807 0.071 1
1 50 . 19 1 1 A 6 6 HIS N N 360 118.844 114.776 4.068 1
1 51 . 19 1 1 A 7 7 ILE H H 361 7.862 8.045 -0.183 1
1 52 . 19 1 1 A 7 7 ILE HA H 361 4.010 4.735 -0.725 1
1 62 . 19 1 1 A 7 7 ILE C C 361 173.268 175.244 -1.976 1
1 63 . 19 1 1 A 7 7 ILE CA C 361 58.740 59.944 -1.204 1
1 64 . 19 1 1 A 7 7 ILE CB C 361 35.788 39.592 -3.804 1
1 68 . 19 1 1 A 7 7 ILE N N 361 121.598 117.813 3.785 1
1 69 . 19 1 1 A 8 8 LYS H H 362 8.231 8.654 -0.423 1
1 70 . 19 1 1 A 8 8 LYS HA H 362 4.313 4.483 -0.170 1
1 79 . 19 1 1 A 8 8 LYS C C 362 173.899 177.966 -4.067 1
1 80 . 19 1 1 A 8 8 LYS CA C 362 53.677 54.869 -1.192 1
1 81 . 19 1 1 A 8 8 LYS CB C 362 30.355 34.635 -4.280 1
1 85 . 19 1 1 A 8 8 LYS N N 362 124.980 125.259 -0.279 1
1 86 . 19 1 1 A 9 9 VAL H H 363 8.044 8.557 -0.513 1
1 87 . 19 1 1 A 9 9 VAL HA H 363 4.089 3.906 0.183 1
1 95 . 19 1 1 A 9 9 VAL C C 363 173.760 175.924 -2.164 1
1 96 . 19 1 1 A 9 9 VAL CA C 363 59.814 65.016 -5.202 1
1 97 . 19 1 1 A 9 9 VAL CB C 363 30.058 31.975 -1.917 1
1 100 . 19 1 1 A 9 9 VAL N N 363 121.366 120.857 0.509 1
1 101 . 19 1 1 A 10 10 THR H H 364 8.076 7.927 0.149 1
1 102 . 19 1 1 A 10 10 THR HA H 364 4.302 4.737 -0.435 1
1 107 . 19 1 1 A 10 10 THR C C 364 172.135 174.303 -2.168 1
1 108 . 19 1 1 A 10 10 THR CA C 364 59.134 59.195 -0.061 1
1 109 . 19 1 1 A 10 10 THR CB C 364 67.415 72.611 -5.196 1
1 111 . 19 1 1 A 10 10 THR N N 364 116.817 112.021 4.796 1
1 112 . 19 1 1 A 11 11 GLN H H 365 8.463 8.642 -0.179 1
1 113 . 19 1 1 A 11 11 GLN HA H 365 4.046 4.510 -0.464 1
1 120 . 19 1 1 A 11 11 GLN C C 365 173.944 176.817 -2.873 1
1 121 . 19 1 1 A 11 11 GLN CA C 365 54.517 56.693 -2.176 1
1 122 . 19 1 1 A 11 11 GLN CB C 365 26.250 30.809 -4.559 1
1 124 . 19 1 1 A 11 11 GLN N N 365 122.059 119.263 2.796 1
1 126 . 19 1 1 A 12 12 GLU H H 366 8.449 8.036 0.413 1
1 127 . 19 1 1 A 12 12 GLU HA H 366 4.093 4.475 -0.382 1
1 132 . 19 1 1 A 12 12 GLU C C 366 174.746 177.982 -3.236 1
1 133 . 19 1 1 A 12 12 GLU CA C 366 55.235 56.025 -0.790 1
1 134 . 19 1 1 A 12 12 GLU CB C 366 27.180 31.411 -4.231 1
1 136 . 19 1 1 A 12 12 GLU N N 366 120.415 115.267 5.148 1
1 137 . 19 1 1 A 13 13 GLN H H 367 8.031 7.845 0.186 1
1 138 . 19 1 1 A 13 13 GLN HA H 367 4.113 4.053 0.060 1
1 145 . 19 1 1 A 13 13 GLN C C 367 173.693 177.343 -3.650 1
1 146 . 19 1 1 A 13 13 GLN CA C 367 54.132 57.966 -3.834 1
1 147 . 19 1 1 A 13 13 GLN CB C 367 26.420 29.030 -2.610 1
1 149 . 19 1 1 A 13 13 GLN N N 367 119.721 120.565 -0.844 1
1 151 . 19 1 1 A 14 14 TYR H H 368 8.111 8.168 -0.057 1
1 152 . 19 1 1 A 14 14 TYR HA H 368 4.339 4.381 -0.042 1
1 159 . 19 1 1 A 14 14 TYR C C 368 173.916 176.921 -3.005 1
1 160 . 19 1 1 A 14 14 TYR CA C 368 56.572 59.803 -3.231 1
1 161 . 19 1 1 A 14 14 TYR CB C 368 35.879 37.731 -1.852 1
1 164 . 19 1 1 A 14 14 TYR N N 368 120.541 117.247 3.294 1
1 165 . 19 1 1 A 15 15 GLU H H 369 8.287 8.491 -0.204 1
1 166 . 19 1 1 A 15 15 GLU HA H 369 4.009 3.275 0.734 1
1 171 . 19 1 1 A 15 15 GLU C C 369 174.448 177.740 -3.292 1
1 172 . 19 1 1 A 15 15 GLU CA C 369 55.047 58.990 -3.943 1
1 173 . 19 1 1 A 15 15 GLU CB C 369 27.226 29.142 -1.916 1
1 175 . 19 1 1 A 15 15 GLU N N 369 120.398 120.642 -0.244 1
1 176 . 19 1 1 A 16 16 LEU H H 370 7.785 7.644 0.141 1
1 177 . 19 1 1 A 16 16 LEU HA H 370 4.138 4.214 -0.076 1
1 187 . 19 1 1 A 16 16 LEU C C 370 175.089 177.634 -2.545 1
1 188 . 19 1 1 A 16 16 LEU CA C 370 53.425 55.511 -2.086 1
1 189 . 19 1 1 A 16 16 LEU CB C 370 39.554 40.985 -1.431 1
1 193 . 19 1 1 A 16 16 LEU N N 370 121.323 115.466 5.857 1
1 194 . 19 1 1 A 17 17 TYR H H 371 8.038 7.371 0.667 1
1 195 . 19 1 1 A 17 17 TYR HA H 371 4.380 4.389 -0.009 1
1 202 . 19 1 1 A 17 17 TYR C C 371 173.931 176.769 -2.838 1
1 203 . 19 1 1 A 17 17 TYR CA C 371 56.143 59.888 -3.745 1
1 204 . 19 1 1 A 17 17 TYR CB C 371 35.501 37.501 -2.000 1
1 207 . 19 1 1 A 17 17 TYR N N 371 119.465 120.130 -0.665 1
1 208 . 19 1 1 A 18 18 CYS H H 372 8.021 8.303 -0.282 1
1 209 . 19 1 1 A 18 18 CYS HA H 372 4.236 4.720 -0.484 1
1 212 . 19 1 1 A 18 18 CYS C C 372 172.457 174.330 -1.873 1
1 213 . 19 1 1 A 18 18 CYS CA C 372 56.997 60.017 -3.020 1
1 214 . 19 1 1 A 18 18 CYS CB C 372 25.080 29.778 -4.698 1
1 215 . 19 1 1 A 18 18 CYS N N 372 119.913 119.092 0.821 1
1 216 . 19 1 1 A 19 19 GLU H H 373 8.151 8.188 -0.037 1
1 217 . 19 1 1 A 19 19 GLU HA H 373 4.130 4.865 -0.735 1
1 222 . 19 1 1 A 19 19 GLU C C 373 174.151 175.331 -1.180 1
1 223 . 19 1 1 A 19 19 GLU CA C 373 54.535 55.070 -0.535 1
1 224 . 19 1 1 A 19 19 GLU CB C 373 27.244 33.049 -5.805 1
1 226 . 19 1 1 A 19 19 GLU N N 373 122.431 118.986 3.445 1
1 227 . 19 1 1 A 20 20 MET H H 374 8.109 8.970 -0.861 1
1 228 . 19 1 1 A 20 20 MET HA H 374 4.352 4.901 -0.549 1
1 236 . 19 1 1 A 20 20 MET C C 374 174.200 176.682 -2.482 1
1 237 . 19 1 1 A 20 20 MET CA C 374 53.238 55.440 -2.202 1
1 238 . 19 1 1 A 20 20 MET CB C 374 30.237 34.798 -4.561 1
1 241 . 19 1 1 A 20 20 MET N N 374 119.754 123.837 -4.083 1
1 242 . 19 1 1 A 21 21 GLY H H 375 8.231 8.112 0.119 1
1 243 . 19 1 1 A 21 21 GLY HA2 H 375 3.861 3.789 0.072 1
1 244 . 19 1 1 A 21 21 GLY HA3 H 375 3.960 3.946 0.014 1
1 245 . 19 1 1 A 21 21 GLY C C 375 171.928 172.288 -0.360 1
1 246 . 19 1 1 A 21 21 GLY CA C 375 42.930 44.459 -1.529 1
1 247 . 19 1 1 A 21 21 GLY N N 375 109.484 106.533 2.951 1
1 248 . 19 1 1 A 22 22 SER HA H 376 4.492 4.994 -0.502 1
1 251 . 19 1 1 A 22 22 SER C C 376 172.206 173.688 -1.482 1
1 252 . 19 1 1 A 22 22 SER CA C 376 55.570 56.697 -1.127 1
1 253 . 19 1 1 A 22 22 SER CB C 376 61.525 64.901 -3.376 1
1 254 . 19 1 1 A 23 23 THR H H 377 8.470 8.690 -0.220 1
1 255 . 19 1 1 A 23 23 THR HA H 377 4.295 4.374 -0.079 1
1 260 . 19 1 1 A 23 23 THR C C 377 171.811 175.181 -3.370 1
1 261 . 19 1 1 A 23 23 THR CA C 377 58.937 62.365 -3.428 1
1 262 . 19 1 1 A 23 23 THR CB C 377 67.250 69.449 -2.199 1
1 264 . 19 1 1 A 23 23 THR N N 377 124.043 118.449 5.594 1
1 265 . 19 1 1 A 24 24 PHE H H 378 8.374 8.780 -0.406 1
1 266 . 19 1 1 A 24 24 PHE HA H 378 4.239 4.389 -0.150 1
1 273 . 19 1 1 A 24 24 PHE C C 378 173.411 175.211 -1.800 1
1 274 . 19 1 1 A 24 24 PHE CA C 378 56.697 59.870 -3.173 1
1 275 . 19 1 1 A 24 24 PHE CB C 378 36.538 39.925 -3.387 1
1 278 . 19 1 1 A 24 24 PHE N N 378 124.732 124.755 -0.023 1
1 279 . 19 1 1 A 25 25 GLN H H 379 8.457 7.431 1.026 1
1 280 . 19 1 1 A 25 25 GLN HA H 379 4.038 4.372 -0.334 1
1 287 . 19 1 1 A 25 25 GLN C C 379 172.431 175.443 -3.012 1
1 288 . 19 1 1 A 25 25 GLN CA C 379 54.078 54.712 -0.634 1
1 289 . 19 1 1 A 25 25 GLN CB C 379 26.414 29.642 -3.228 1
1 291 . 19 1 1 A 25 25 GLN N N 379 118.820 115.133 3.687 1
1 293 . 19 1 1 A 26 26 LEU H H 380 6.985 8.902 -1.917 1
1 294 . 19 1 1 A 26 26 LEU HA H 380 4.229 4.304 -0.075 1
1 304 . 19 1 1 A 26 26 LEU C C 380 173.895 175.592 -1.697 1
1 305 . 19 1 1 A 26 26 LEU CA C 380 52.123 55.608 -3.485 1
1 306 . 19 1 1 A 26 26 LEU CB C 380 40.543 40.988 -0.445 1
1 310 . 19 1 1 A 26 26 LEU N N 380 119.079 117.909 1.170 1
1 311 . 19 1 1 A 27 27 CYS H H 381 8.905 8.786 0.119 1
1 312 . 19 1 1 A 27 27 CYS HA H 381 4.013 4.453 -0.440 1
1 315 . 19 1 1 A 27 27 CYS C C 381 174.439 175.858 -1.419 1
1 316 . 19 1 1 A 27 27 CYS CA C 381 57.847 59.550 -1.703 1
1 317 . 19 1 1 A 27 27 CYS CB C 381 28.648 28.652 -0.004 1
1 318 . 19 1 1 A 27 27 CYS N N 381 125.151 123.997 1.154 1
1 319 . 19 1 1 A 28 28 LYS H H 382 9.351 8.816 0.535 1
1 320 . 19 1 1 A 28 28 LYS HA H 382 4.157 3.898 0.259 1
1 329 . 19 1 1 A 28 28 LYS C C 382 174.678 178.159 -3.481 1
1 330 . 19 1 1 A 28 28 LYS CA C 382 54.324 59.137 -4.813 1
1 331 . 19 1 1 A 28 28 LYS CB C 382 30.086 32.370 -2.284 1
1 335 . 19 1 1 A 28 28 LYS N N 382 128.840 128.310 0.530 1
1 336 . 19 1 1 A 29 29 ILE H H 383 9.040 7.906 1.134 1
1 337 . 19 1 1 A 29 29 ILE HA H 383 3.804 3.647 0.157 1
1 347 . 19 1 1 A 29 29 ILE C C 383 174.239 177.384 -3.145 1
1 348 . 19 1 1 A 29 29 ILE CA C 383 62.114 64.375 -2.261 1
1 349 . 19 1 1 A 29 29 ILE CB C 383 33.870 37.784 -3.914 1
1 353 . 19 1 1 A 29 29 ILE N N 383 122.718 119.007 3.711 1
1 354 . 19 1 1 A 30 30 CYS H H 384 7.572 7.597 -0.025 1
1 355 . 19 1 1 A 30 30 CYS HA H 384 4.548 4.446 0.102 1
1 358 . 19 1 1 A 30 30 CYS C C 384 172.978 176.087 -3.109 1
1 359 . 19 1 1 A 30 30 CYS CA C 384 54.957 59.497 -4.540 1
1 360 . 19 1 1 A 30 30 CYS CB C 384 29.778 29.633 0.145 1
1 361 . 19 1 1 A 30 30 CYS N N 384 116.356 115.860 0.496 1
1 362 . 19 1 1 A 31 31 ALA H H 385 8.205 8.833 -0.628 1
1 363 . 19 1 1 A 31 31 ALA HA H 385 4.107 4.015 0.092 1
1 367 . 19 1 1 A 31 31 ALA C C 385 173.139 177.289 -4.150 1
1 368 . 19 1 1 A 31 31 ALA CA C 385 50.802 54.657 -3.855 1
1 369 . 19 1 1 A 31 31 ALA CB C 385 14.634 16.982 -2.348 1
1 370 . 19 1 1 A 31 31 ALA N N 385 125.526 120.765 4.761 1
1 371 . 19 1 1 A 32 32 GLU H H 386 8.416 8.287 0.129 1
1 372 . 19 1 1 A 32 32 GLU HA H 386 4.467 4.365 0.102 1
1 377 . 19 1 1 A 32 32 GLU C C 386 172.325 176.452 -4.127 1
1 378 . 19 1 1 A 32 32 GLU CA C 386 55.146 57.249 -2.103 1
1 379 . 19 1 1 A 32 32 GLU CB C 386 31.181 30.255 0.926 1
1 381 . 19 1 1 A 32 32 GLU N N 386 117.579 115.670 1.909 1
1 382 . 19 1 1 A 33 33 ASN H H 387 7.872 7.782 0.090 1
1 383 . 19 1 1 A 33 33 ASN HA H 387 4.900 5.066 -0.166 1
1 388 . 19 1 1 A 33 33 ASN C C 387 171.355 174.430 -3.075 1
1 389 . 19 1 1 A 33 33 ASN CA C 387 49.320 51.888 -2.568 1
1 390 . 19 1 1 A 33 33 ASN CB C 387 38.457 40.216 -1.759 1
1 391 . 19 1 1 A 33 33 ASN N N 387 120.399 116.791 3.608 1
1 393 . 19 1 1 A 34 34 ASP H H 388 8.565 8.715 -0.150 1
1 394 . 19 1 1 A 34 34 ASP HA H 388 4.679 5.045 -0.366 1
1 397 . 19 1 1 A 34 34 ASP C C 388 174.243 176.346 -2.103 1
1 398 . 19 1 1 A 34 34 ASP CA C 388 51.809 53.187 -1.378 1
1 399 . 19 1 1 A 34 34 ASP CB C 388 38.007 42.694 -4.687 1
1 400 . 19 1 1 A 34 34 ASP N N 388 120.661 120.738 -0.077 1
1 401 . 19 1 1 A 35 35 LYS H H 389 8.544 8.762 -0.218 1
1 402 . 19 1 1 A 35 35 LYS HA H 389 3.411 4.379 -0.968 1
1 409 . 19 1 1 A 35 35 LYS C C 389 172.938 177.014 -4.076 1
1 410 . 19 1 1 A 35 35 LYS CA C 389 54.973 55.796 -0.823 1
1 411 . 19 1 1 A 35 35 LYS CB C 389 30.617 31.791 -1.174 1
1 415 . 19 1 1 A 35 35 LYS N N 389 119.199 120.630 -1.431 1
1 416 . 19 1 1 A 36 36 ASP H H 390 8.327 8.640 -0.313 1
1 417 . 19 1 1 A 36 36 ASP HA H 390 4.724 4.871 -0.147 1
1 420 . 19 1 1 A 36 36 ASP C C 390 172.860 175.413 -2.553 1
1 421 . 19 1 1 A 36 36 ASP CA C 390 51.609 53.896 -2.287 1
1 422 . 19 1 1 A 36 36 ASP CB C 390 39.018 41.826 -2.808 1
1 423 . 19 1 1 A 36 36 ASP N N 390 119.134 122.514 -3.380 1
1 424 . 19 1 1 A 37 37 VAL H H 391 8.544 8.026 0.518 1
1 425 . 19 1 1 A 37 37 VAL HA H 391 4.877 4.902 -0.025 1
1 433 . 19 1 1 A 37 37 VAL C C 391 167.519 173.385 -5.866 1
1 434 . 19 1 1 A 37 37 VAL CA C 391 58.259 59.875 -1.616 1
1 435 . 19 1 1 A 37 37 VAL CB C 391 32.277 34.876 -2.599 1
1 438 . 19 1 1 A 37 37 VAL N N 391 121.970 119.188 2.782 1
1 439 . 19 1 1 A 38 38 LYS H H 392 8.621 9.629 -1.008 1
1 440 . 19 1 1 A 38 38 LYS HA H 392 4.991 5.117 -0.126 1
1 449 . 19 1 1 A 38 38 LYS C C 392 172.681 175.287 -2.606 1
1 450 . 19 1 1 A 38 38 LYS CA C 392 51.123 54.656 -3.533 1
1 451 . 19 1 1 A 38 38 LYS CB C 392 33.697 34.772 -1.075 1
1 455 . 19 1 1 A 38 38 LYS N N 392 126.381 129.183 -2.802 1
1 456 . 19 1 1 A 39 39 ILE H H 393 8.723 8.784 -0.061 1
1 457 . 19 1 1 A 39 39 ILE HA H 393 4.239 4.430 -0.191 1
1 467 . 19 1 1 A 39 39 ILE C C 393 172.642 175.719 -3.077 1
1 468 . 19 1 1 A 39 39 ILE CA C 393 57.768 60.651 -2.883 1
1 469 . 19 1 1 A 39 39 ILE CB C 393 35.691 37.664 -1.973 1
1 473 . 19 1 1 A 39 39 ILE N N 393 126.398 127.941 -1.543 1
1 474 . 19 1 1 A 40 40 GLU H H 394 8.506 8.641 -0.135 1
1 475 . 19 1 1 A 40 40 GLU HA H 394 4.753 4.897 -0.144 1
1 480 . 19 1 1 A 40 40 GLU C C 394 173.596 176.076 -2.480 1
1 481 . 19 1 1 A 40 40 GLU CA C 394 49.793 53.628 -3.835 1
1 482 . 19 1 1 A 40 40 GLU CB C 394 28.210 31.841 -3.631 1
1 484 . 19 1 1 A 40 40 GLU N N 394 124.864 126.660 -1.796 1
1 485 . 19 1 1 A 41 41 PRO HA H 395 4.864 4.510 0.354 1
1 492 . 19 1 1 A 41 41 PRO C C 395 175.073 177.084 -2.011 1
1 493 . 19 1 1 A 41 41 PRO CA C 395 61.111 63.920 -2.809 1
1 494 . 19 1 1 A 41 41 PRO CB C 395 32.275 32.949 -0.674 1
1 497 . 19 1 1 A 42 42 CYS H H 396 7.828 7.822 0.006 1
1 498 . 19 1 1 A 42 42 CYS HA H 396 4.208 4.090 0.118 1
1 501 . 19 1 1 A 42 42 CYS C C 396 173.877 175.010 -1.133 1
1 502 . 19 1 1 A 42 42 CYS CA C 396 58.021 61.302 -3.281 1
1 503 . 19 1 1 A 42 42 CYS CB C 396 28.242 27.738 0.504 1
1 504 . 19 1 1 A 42 42 CYS N N 396 122.434 118.132 4.302 1
1 505 . 19 1 1 A 43 43 GLY H H 397 8.679 8.642 0.037 1
1 506 . 19 1 1 A 43 43 GLY HA2 H 397 3.507 3.943 -0.436 1
1 507 . 19 1 1 A 43 43 GLY HA3 H 397 3.914 3.950 -0.036 1
1 508 . 19 1 1 A 43 43 GLY C C 397 171.981 174.959 -2.978 1
1 509 . 19 1 1 A 43 43 GLY CA C 397 43.347 45.706 -2.359 1
1 510 . 19 1 1 A 43 43 GLY N N 397 112.123 108.655 3.468 1
1 511 . 19 1 1 A 44 44 HIS H H 398 8.329 7.801 0.528 1
1 512 . 19 1 1 A 44 44 HIS HA H 398 4.339 4.520 -0.181 1
1 517 . 19 1 1 A 44 44 HIS C C 398 170.742 174.974 -4.232 1
1 518 . 19 1 1 A 44 44 HIS CA C 398 58.368 56.250 2.118 1
1 519 . 19 1 1 A 44 44 HIS CB C 398 28.434 31.061 -2.627 1
1 522 . 19 1 1 A 44 44 HIS N N 398 121.393 118.010 3.383 1
1 523 . 19 1 1 A 45 45 LEU H H 399 8.241 8.920 -0.679 1
1 524 . 19 1 1 A 45 45 LEU HA H 399 5.570 5.299 0.271 1
1 534 . 19 1 1 A 45 45 LEU C C 399 174.464 175.411 -0.947 1
1 535 . 19 1 1 A 45 45 LEU CA C 399 50.729 53.648 -2.919 1
1 536 . 19 1 1 A 45 45 LEU CB C 399 43.574 43.984 -0.410 1
1 540 . 19 1 1 A 45 45 LEU N N 399 118.469 122.647 -4.178 1
1 541 . 19 1 1 A 46 46 MET H H 400 8.707 8.912 -0.205 1
1 542 . 19 1 1 A 46 46 MET HA H 400 4.842 5.005 -0.163 1
1 550 . 19 1 1 A 46 46 MET C C 400 170.736 174.224 -3.488 1
1 551 . 19 1 1 A 46 46 MET CA C 400 52.804 54.090 -1.286 1
1 552 . 19 1 1 A 46 46 MET CB C 400 31.945 35.415 -3.470 1
1 555 . 19 1 1 A 46 46 MET N N 400 114.897 120.485 -5.588 1
1 556 . 19 1 1 A 47 47 CYS H H 401 9.436 8.223 1.213 1
1 557 . 19 1 1 A 47 47 CYS HA H 401 5.629 5.298 0.331 1
1 560 . 19 1 1 A 47 47 CYS C C 401 173.909 176.098 -2.189 1
1 561 . 19 1 1 A 47 47 CYS CA C 401 54.325 56.861 -2.536 1
1 562 . 19 1 1 A 47 47 CYS CB C 401 30.725 30.115 0.610 1
1 563 . 19 1 1 A 47 47 CYS N N 401 119.575 119.070 0.505 1
1 564 . 19 1 1 A 48 48 THR H H 402 9.842 9.204 0.638 1
1 565 . 19 1 1 A 48 48 THR HA H 402 3.768 4.009 -0.241 1
1 570 . 19 1 1 A 48 48 THR C C 402 174.333 176.180 -1.847 1
1 571 . 19 1 1 A 48 48 THR CA C 402 64.516 65.835 -1.319 1
1 572 . 19 1 1 A 48 48 THR CB C 402 66.288 68.683 -2.395 1
1 574 . 19 1 1 A 48 48 THR N N 402 119.945 119.218 0.727 1
1 575 . 19 1 1 A 49 49 SER H H 403 8.355 8.263 0.092 1
1 576 . 19 1 1 A 49 49 SER HA H 403 4.222 4.034 0.188 1
1 579 . 19 1 1 A 49 49 SER C C 403 175.059 177.155 -2.096 1
1 580 . 19 1 1 A 49 49 SER CA C 403 59.828 61.713 -1.885 1
1 581 . 19 1 1 A 49 49 SER CB C 403 59.717 62.995 -3.278 1
1 582 . 19 1 1 A 49 49 SER N N 403 120.468 115.672 4.796 1
1 583 . 19 1 1 A 50 50 CYS H H 404 9.464 7.901 1.563 1
1 584 . 19 1 1 A 50 50 CYS HA H 404 3.922 4.163 -0.241 1
1 587 . 19 1 1 A 50 50 CYS C C 404 176.081 177.069 -0.988 1
1 588 . 19 1 1 A 50 50 CYS CA C 404 63.076 64.162 -1.086 1
1 589 . 19 1 1 A 50 50 CYS CB C 404 26.078 27.503 -1.425 1
1 590 . 19 1 1 A 50 50 CYS N N 404 126.744 119.162 7.582 1
1 591 . 19 1 1 A 51 51 LEU H H 405 7.948 8.156 -0.208 1
1 592 . 19 1 1 A 51 51 LEU HA H 405 4.064 4.221 -0.157 1
1 602 . 19 1 1 A 51 51 LEU C C 405 175.495 178.995 -3.500 1
1 603 . 19 1 1 A 51 51 LEU CA C 405 55.914 57.876 -1.962 1
1 604 . 19 1 1 A 51 51 LEU CB C 405 38.662 41.686 -3.024 1
1 607 . 19 1 1 A 51 51 LEU N N 405 121.951 122.727 -0.776 1
1 608 . 19 1 1 A 52 52 THR H H 406 8.786 8.348 0.438 1
1 609 . 19 1 1 A 52 52 THR HA H 406 4.024 3.858 0.166 1
1 614 . 19 1 1 A 52 52 THR C C 406 174.139 176.025 -1.886 1
1 615 . 19 1 1 A 52 52 THR CA C 406 64.017 66.219 -2.202 1
1 616 . 19 1 1 A 52 52 THR CB C 406 66.115 68.656 -2.541 1
1 618 . 19 1 1 A 52 52 THR N N 406 115.258 115.573 -0.315 1
1 619 . 19 1 1 A 53 53 SER H H 407 8.115 7.732 0.383 1
1 620 . 19 1 1 A 53 53 SER HA H 407 4.204 4.104 0.100 1
1 623 . 19 1 1 A 53 53 SER C C 407 174.456 176.323 -1.867 1
1 624 . 19 1 1 A 53 53 SER CA C 407 59.090 62.794 -3.704 1
1 625 . 19 1 1 A 53 53 SER CB C 407 60.146 63.374 -3.228 1
1 626 . 19 1 1 A 53 53 SER N N 407 116.852 116.709 0.143 1
1 627 . 19 1 1 A 54 54 TRP H H 408 8.123 7.935 0.188 1
1 628 . 19 1 1 A 54 54 TRP HA H 408 4.371 4.265 0.106 1
1 637 . 19 1 1 A 54 54 TRP C C 408 175.981 178.604 -2.623 1
1 638 . 19 1 1 A 54 54 TRP CA C 408 57.323 60.751 -3.428 1
1 639 . 19 1 1 A 54 54 TRP CB C 408 26.812 29.518 -2.706 1
1 645 . 19 1 1 A 54 54 TRP N N 408 123.556 123.770 -0.214 1
1 647 . 19 1 1 A 55 55 GLN H H 409 8.502 8.727 -0.225 1
1 648 . 19 1 1 A 55 55 GLN HA H 409 3.999 3.682 0.317 1
1 655 . 19 1 1 A 55 55 GLN C C 409 177.300 178.558 -1.258 1
1 656 . 19 1 1 A 55 55 GLN CA C 409 56.484 59.254 -2.770 1
1 657 . 19 1 1 A 55 55 GLN CB C 409 26.190 28.816 -2.626 1
1 659 . 19 1 1 A 55 55 GLN N N 409 118.044 118.514 -0.470 1
1 661 . 19 1 1 A 56 56 GLU H H 410 8.467 8.613 -0.146 1
1 662 . 19 1 1 A 56 56 GLU HA H 410 4.057 4.107 -0.050 1
1 667 . 19 1 1 A 56 56 GLU C C 410 174.787 176.881 -2.094 1
1 668 . 19 1 1 A 56 56 GLU CA C 410 55.909 58.213 -2.304 1
1 669 . 19 1 1 A 56 56 GLU CB C 410 26.895 29.271 -2.376 1
1 671 . 19 1 1 A 56 56 GLU N N 410 119.448 117.829 1.619 1
1 672 . 19 1 1 A 57 57 SER H H 411 7.438 7.504 -0.066 1
1 673 . 19 1 1 A 57 57 SER HA H 411 4.607 4.582 0.025 1
1 676 . 19 1 1 A 57 57 SER C C 411 170.849 173.970 -3.121 1
1 677 . 19 1 1 A 57 57 SER CA C 411 55.540 57.417 -1.877 1
1 678 . 19 1 1 A 57 57 SER CB C 411 60.928 63.330 -2.402 1
1 679 . 19 1 1 A 57 57 SER N N 411 113.752 115.420 -1.668 1
1 680 . 19 1 1 A 58 58 GLU H H 412 7.855 7.957 -0.102 1
1 681 . 19 1 1 A 58 58 GLU HA H 412 3.772 4.013 -0.241 1
1 686 . 19 1 1 A 58 58 GLU C C 412 173.743 175.159 -1.416 1
1 687 . 19 1 1 A 58 58 GLU CA C 412 54.442 56.930 -2.488 1
1 688 . 19 1 1 A 58 58 GLU CB C 412 24.603 28.311 -3.708 1
1 690 . 19 1 1 A 58 58 GLU N N 412 115.908 118.392 -2.484 1
1 691 . 19 1 1 A 59 59 GLY H H 413 7.588 8.174 -0.586 1
1 692 . 19 1 1 A 59 59 GLY HA2 H 413 1.643 3.133 -1.490 1
1 693 . 19 1 1 A 59 59 GLY HA3 H 413 2.949 3.424 -0.475 1
1 694 . 19 1 1 A 59 59 GLY C C 413 170.850 172.080 -1.230 1
1 695 . 19 1 1 A 59 59 GLY CA C 413 41.724 44.232 -2.508 1
1 696 . 19 1 1 A 59 59 GLY N N 413 108.032 111.585 -3.553 1
1 697 . 19 1 1 A 60 60 GLN H H 414 7.973 8.609 -0.636 1
1 698 . 19 1 1 A 60 60 GLN HA H 414 4.366 4.707 -0.341 1
1 705 . 19 1 1 A 60 60 GLN C C 414 173.108 175.643 -2.535 1
1 706 . 19 1 1 A 60 60 GLN CA C 414 52.422 55.228 -2.806 1
1 707 . 19 1 1 A 60 60 GLN CB C 414 27.049 29.605 -2.556 1
1 709 . 19 1 1 A 60 60 GLN N N 414 122.690 124.635 -1.945 1
1 711 . 19 1 1 A 61 61 GLY H H 415 8.301 8.454 -0.153 1
1 712 . 19 1 1 A 61 61 GLY HA2 H 415 3.700 4.243 -0.543 1
1 713 . 19 1 1 A 61 61 GLY HA3 H 415 3.920 4.275 -0.355 1
1 714 . 19 1 1 A 61 61 GLY C C 415 170.249 174.392 -4.143 1
1 715 . 19 1 1 A 61 61 GLY CA C 415 42.210 44.409 -2.199 1
1 716 . 19 1 1 A 61 61 GLY N N 415 110.794 113.813 -3.019 1
1 717 . 19 1 1 A 62 62 CYS H H 416 8.549 8.347 0.202 1
1 718 . 19 1 1 A 62 62 CYS HA H 416 4.227 4.663 -0.436 1
1 721 . 19 1 1 A 62 62 CYS C C 416 172.914 175.197 -2.283 1
1 722 . 19 1 1 A 62 62 CYS CA C 416 54.008 58.731 -4.723 1
1 723 . 19 1 1 A 62 62 CYS CB C 416 29.716 27.428 2.288 1
1 724 . 19 1 1 A 62 62 CYS N N 416 123.683 120.884 2.799 1
1 725 . 19 1 1 A 63 63 PRO HA H 417 2.611 2.505 0.106 1
1 732 . 19 1 1 A 63 63 PRO C C 417 174.143 177.644 -3.501 1
1 733 . 19 1 1 A 63 63 PRO CA C 417 61.689 63.701 -2.012 1
1 734 . 19 1 1 A 63 63 PRO CB C 417 28.534 30.992 -2.458 1
1 737 . 19 1 1 A 64 64 PHE H H 418 8.968 7.766 1.202 1
1 738 . 19 1 1 A 64 64 PHE HA H 418 4.250 4.167 0.083 1
1 746 . 19 1 1 A 64 64 PHE C C 418 174.243 177.647 -3.404 1
1 747 . 19 1 1 A 64 64 PHE CA C 418 56.720 60.437 -3.717 1
1 748 . 19 1 1 A 64 64 PHE CB C 418 36.458 39.333 -2.875 1
1 752 . 19 1 1 A 64 64 PHE N N 418 117.008 115.517 1.491 1
1 753 . 19 1 1 A 65 65 CYS H H 419 7.968 7.932 0.036 1
1 754 . 19 1 1 A 65 65 CYS HA H 419 4.906 4.502 0.404 1
1 757 . 19 1 1 A 65 65 CYS C C 419 173.198 175.028 -1.830 1
1 758 . 19 1 1 A 65 65 CYS CA C 419 55.870 59.801 -3.931 1
1 759 . 19 1 1 A 65 65 CYS CB C 419 30.559 28.983 1.576 1
1 760 . 19 1 1 A 65 65 CYS N N 419 117.505 117.228 0.277 1
1 761 . 19 1 1 A 66 66 ARG H H 420 8.761 7.926 0.835 1
1 762 . 19 1 1 A 66 66 ARG HA H 420 4.365 4.244 0.121 1
1 769 . 19 1 1 A 66 66 ARG C C 420 172.921 174.476 -1.555 1
1 770 . 19 1 1 A 66 66 ARG CA C 420 54.763 57.171 -2.408 1
1 771 . 19 1 1 A 66 66 ARG CB C 420 24.286 26.868 -2.582 1
1 774 . 19 1 1 A 66 66 ARG N N 420 118.763 116.148 2.615 1
1 775 . 19 1 1 A 67 67 CYS H H 421 8.223 7.914 0.309 1
1 776 . 19 1 1 A 67 67 CYS HA H 421 4.419 4.619 -0.200 1
1 779 . 19 1 1 A 67 67 CYS C C 421 171.160 174.752 -3.592 1
1 780 . 19 1 1 A 67 67 CYS CA C 421 57.119 57.930 -0.811 1
1 781 . 19 1 1 A 67 67 CYS CB C 421 25.911 29.763 -3.852 1
1 782 . 19 1 1 A 67 67 CYS N N 421 120.627 116.867 3.760 1
1 783 . 19 1 1 A 68 68 GLU H H 422 8.416 8.639 -0.223 1
1 784 . 19 1 1 A 68 68 GLU HA H 422 4.025 4.157 -0.132 1
1 789 . 19 1 1 A 68 68 GLU C C 422 173.764 176.322 -2.558 1
1 790 . 19 1 1 A 68 68 GLU CA C 422 54.752 57.453 -2.701 1
1 791 . 19 1 1 A 68 68 GLU CB C 422 27.302 29.715 -2.413 1
1 793 . 19 1 1 A 68 68 GLU N N 422 122.370 121.061 1.309 1
1 794 . 19 1 1 A 69 69 ILE H H 423 8.648 8.969 -0.321 1
1 795 . 19 1 1 A 69 69 ILE HA H 423 4.012 4.451 -0.439 1
1 805 . 19 1 1 A 69 69 ILE C C 423 174.257 175.504 -1.247 1
1 806 . 19 1 1 A 69 69 ILE CA C 423 59.740 60.818 -1.078 1
1 807 . 19 1 1 A 69 69 ILE CB C 423 35.846 38.469 -2.623 1
1 811 . 19 1 1 A 69 69 ILE N N 423 125.988 125.648 0.340 1
1 812 . 19 1 1 A 70 70 LYS H H 424 9.185 9.228 -0.043 1
1 813 . 19 1 1 A 70 70 LYS HA H 424 4.434 4.438 -0.004 1
1 822 . 19 1 1 A 70 70 LYS C C 424 173.880 177.171 -3.291 1
1 823 . 19 1 1 A 70 70 LYS CA C 424 53.378 57.243 -3.865 1
1 824 . 19 1 1 A 70 70 LYS CB C 424 30.397 33.953 -3.556 1
1 828 . 19 1 1 A 70 70 LYS N N 424 128.977 127.692 1.285 1
1 829 . 19 1 1 A 71 71 GLY H H 425 7.810 7.740 0.070 1
1 830 . 19 1 1 A 71 71 GLY HA2 H 425 4.094 4.167 -0.073 1
1 831 . 19 1 1 A 71 71 GLY HA3 H 425 4.159 4.169 -0.010 1
1 832 . 19 1 1 A 71 71 GLY C C 425 168.179 172.631 -4.452 1
1 833 . 19 1 1 A 71 71 GLY CA C 425 42.326 44.138 -1.812 1
1 834 . 19 1 1 A 71 71 GLY N N 425 107.696 104.238 3.458 1
1 835 . 19 1 1 A 72 72 THR H H 426 8.048 8.584 -0.536 1
1 836 . 19 1 1 A 72 72 THR HA H 426 5.258 5.507 -0.249 1
1 841 . 19 1 1 A 72 72 THR C C 426 170.979 173.320 -2.341 1
1 842 . 19 1 1 A 72 72 THR CA C 426 56.755 59.806 -3.051 1
1 843 . 19 1 1 A 72 72 THR CB C 426 69.226 71.550 -2.324 1
1 845 . 19 1 1 A 72 72 THR N N 426 109.122 110.677 -1.555 1
1 846 . 19 1 1 A 73 73 GLU H H 427 8.912 9.353 -0.441 1
1 847 . 19 1 1 A 73 73 GLU HA H 427 4.954 4.774 0.180 1
1 852 . 19 1 1 A 73 73 GLU C C 427 170.353 174.006 -3.653 1
1 853 . 19 1 1 A 73 73 GLU CA C 427 50.182 52.877 -2.695 1
1 854 . 19 1 1 A 73 73 GLU CB C 427 30.559 31.405 -0.846 1
1 856 . 19 1 1 A 73 73 GLU N N 427 121.703 122.875 -1.172 1
1 1 . 19 1 1 A 74 74 PRO HA H 428 4.372 4.960 -0.588 1
1 2 . 19 1 1 A 74 74 PRO C C 428 173.839 176.538 -2.699 1
1 3 . 19 1 1 A 74 74 PRO CA C 428 60.241 62.275 -2.034 1
1 4 . 19 1 1 A 74 74 PRO CB C 428 29.299 32.503 -3.204 1
1 857 . 19 1 1 A 74 74 PRO HA H 428 4.782 4.960 -0.178 1
1 864 . 19 1 1 A 74 74 PRO C C 428 174.027 176.538 -2.511 1
1 865 . 19 1 1 A 74 74 PRO CA C 428 59.771 62.275 -2.504 1
1 866 . 19 1 1 A 74 74 PRO CB C 428 29.633 32.503 -2.870 1
1 7 . 19 1 1 A 75 75 ILE H H 429 8.144 8.853 -0.709 1
1 8 . 19 1 1 A 75 75 ILE HA H 429 4.086 4.753 -0.667 1
1 15 . 19 1 1 A 75 75 ILE C C 429 173.426 175.389 -1.963 1
1 16 . 19 1 1 A 75 75 ILE CA C 429 58.339 60.466 -2.127 1
1 17 . 19 1 1 A 75 75 ILE CB C 429 35.988 40.394 -4.406 1
1 21 . 19 1 1 A 75 75 ILE N N 429 121.551 122.092 -0.541 1
1 869 . 19 1 1 A 75 75 ILE H H 429 7.682 8.853 -1.171 1
1 870 . 19 1 1 A 75 75 ILE HA H 429 4.282 4.753 -0.471 1
1 880 . 19 1 1 A 75 75 ILE C C 429 172.510 175.389 -2.879 1
1 881 . 19 1 1 A 75 75 ILE CA C 429 57.456 60.466 -3.010 1
1 882 . 19 1 1 A 75 75 ILE CB C 429 37.903 40.394 -2.491 1
1 886 . 19 1 1 A 75 75 ILE N N 429 119.651 122.092 -2.441 1
1 1 . 19 1 1 A 76 76 VAL HA H 430 4.086 4.801 -0.715 1
1 2 . 19 1 1 A 76 76 VAL CA C 430 59.372 60.572 -1.200 1
1 22 . 19 1 1 A 76 76 VAL H H 430 8.221 8.595 -0.374 1
1 23 . 19 1 1 A 76 76 VAL HA H 430 4.083 4.801 -0.718 1
1 24 . 19 1 1 A 76 76 VAL C C 430 173.067 174.097 -1.030 1
1 25 . 19 1 1 A 76 76 VAL CA C 430 59.445 60.572 -1.127 1
1 26 . 19 1 1 A 76 76 VAL CB C 430 30.407 34.940 -4.533 1
1 27 . 19 1 1 A 76 76 VAL N N 430 125.930 123.816 2.114 1
1 887 . 19 1 1 A 76 76 VAL H H 430 8.122 8.595 -0.473 1
1 888 . 19 1 1 A 76 76 VAL HA H 430 4.197 4.801 -0.604 1
1 890 . 19 1 1 A 76 76 VAL C C 430 172.971 174.097 -1.126 1
1 891 . 19 1 1 A 76 76 VAL CA C 430 58.821 60.572 -1.751 1
1 892 . 19 1 1 A 76 76 VAL CB C 430 30.807 34.940 -4.133 1
1 895 . 19 1 1 A 76 76 VAL N N 430 124.178 123.816 0.362 1
1 4 . 19 1 1 A 77 77 VAL H H 431 8.204 8.954 -0.750 1
1 5 . 19 1 1 A 77 77 VAL HA H 431 4.049 5.006 -0.957 1
1 6 . 19 1 1 A 77 77 VAL C C 431 172.636 174.160 -1.524 1
1 7 . 19 1 1 A 77 77 VAL CA C 431 59.315 59.144 0.171 1
1 8 . 19 1 1 A 77 77 VAL CB C 431 30.219 36.578 -6.359 1
1 9 . 19 1 1 A 77 77 VAL N N 431 125.320 123.419 1.901 1
1 28 . 19 1 1 A 77 77 VAL H H 431 8.412 8.954 -0.542 1
1 29 . 19 1 1 A 77 77 VAL HA H 431 4.038 5.006 -0.968 1
1 37 . 19 1 1 A 77 77 VAL C C 431 172.617 174.160 -1.543 1
1 38 . 19 1 1 A 77 77 VAL CA C 431 59.137 59.144 -0.007 1
1 39 . 19 1 1 A 77 77 VAL CB C 431 30.292 36.578 -6.286 1
1 42 . 19 1 1 A 77 77 VAL N N 431 125.655 123.419 2.236 1
1 896 . 19 1 1 A 77 77 VAL H H 431 8.448 8.954 -0.506 1
1 897 . 19 1 1 A 77 77 VAL HA H 431 4.087 5.006 -0.919 1
1 905 . 19 1 1 A 77 77 VAL C C 431 172.493 174.160 -1.667 1
1 906 . 19 1 1 A 77 77 VAL CA C 431 59.185 59.144 0.041 1
1 907 . 19 1 1 A 77 77 VAL CB C 431 30.084 36.578 -6.494 1
1 910 . 19 1 1 A 77 77 VAL N N 431 125.770 123.419 2.351 1
1 43 . 19 1 1 A 78 78 ASP H H 432 8.419 8.653 -0.234 1
1 44 . 19 1 1 A 78 78 ASP HA H 432 4.829 5.166 -0.337 1
1 45 . 19 1 1 A 78 78 ASP C C 432 172.252 174.894 -2.642 1
1 46 . 19 1 1 A 78 78 ASP CA C 432 49.320 51.275 -1.955 1
1 47 . 19 1 1 A 78 78 ASP CB C 432 39.066 41.327 -2.261 1
1 48 . 19 1 1 A 78 78 ASP N N 432 126.226 121.589 4.637 1
1 911 . 19 1 1 A 78 78 ASP H H 432 8.493 8.653 -0.160 1
1 912 . 19 1 1 A 78 78 ASP HA H 432 4.852 5.166 -0.314 1
1 915 . 19 1 1 A 78 78 ASP C C 432 172.048 174.894 -2.846 1
1 916 . 19 1 1 A 78 78 ASP CA C 432 49.233 51.275 -2.042 1
1 917 . 19 1 1 A 78 78 ASP CB C 432 38.858 41.327 -2.469 1
1 918 . 19 1 1 A 78 78 ASP N N 432 126.705 121.589 5.116 1
1 10 . 19 1 1 A 79 79 PRO CA C 433 63.865 62.342 1.523 1
1 49 . 19 1 1 A 79 79 PRO C C 433 173.867 177.160 -3.293 1
1 919 . 19 1 1 A 79 79 PRO HA H 433 4.237 4.971 -0.734 1
1 926 . 19 1 1 A 79 79 PRO C C 433 173.812 177.160 -3.348 1
1 927 . 19 1 1 A 79 79 PRO CA C 433 60.627 62.342 -1.715 1
1 928 . 19 1 1 A 79 79 PRO CB C 433 29.329 30.143 -0.814 1
1 11 . 19 1 1 A 80 80 PHE H H 434 8.182 9.120 -0.938 1
1 12 . 19 1 1 A 80 80 PHE HA H 434 4.499 4.245 0.254 1
1 13 . 19 1 1 A 80 80 PHE C C 434 171.680 175.110 -3.430 1
1 14 . 19 1 1 A 80 80 PHE CA C 434 54.657 61.175 -6.518 1
1 15 . 19 1 1 A 80 80 PHE CB C 434 36.272 40.104 -3.832 1
1 16 . 19 1 1 A 80 80 PHE N N 434 118.611 125.386 -6.775 1
1 50 . 19 1 1 A 80 80 PHE H H 434 8.191 9.120 -0.929 1
1 51 . 19 1 1 A 80 80 PHE HA H 434 4.528 4.245 0.283 1
1 54 . 19 1 1 A 80 80 PHE C C 434 172.457 175.110 -2.653 1
1 55 . 19 1 1 A 80 80 PHE CA C 434 54.828 61.175 -6.347 1
1 56 . 19 1 1 A 80 80 PHE CB C 434 36.457 40.104 -3.647 1
1 57 . 19 1 1 A 80 80 PHE N N 434 118.871 125.386 -6.515 1
1 931 . 19 1 1 A 80 80 PHE H H 434 8.191 9.120 -0.929 1
1 932 . 19 1 1 A 80 80 PHE HA H 434 4.463 4.245 0.218 1
1 939 . 19 1 1 A 80 80 PHE C C 434 172.283 175.110 -2.827 1
1 940 . 19 1 1 A 80 80 PHE CA C 434 54.971 61.175 -6.204 1
1 941 . 19 1 1 A 80 80 PHE CB C 434 36.490 40.104 -3.614 1
1 944 . 19 1 1 A 80 80 PHE N N 434 119.263 125.386 -6.123 1
1 17 . 19 1 1 A 81 81 ASP H H 435 7.490 8.025 -0.535 1
1 18 . 19 1 1 A 81 81 ASP HA H 435 4.698 4.884 -0.186 1
1 19 . 19 1 1 A 81 81 ASP C C 435 171.662 175.250 -3.588 1
1 20 . 19 1 1 A 81 81 ASP CA C 435 49.570 51.730 -2.160 1
1 21 . 19 1 1 A 81 81 ASP CB C 435 40.104 41.261 -1.157 1
1 22 . 19 1 1 A 81 81 ASP N N 435 120.304 117.615 2.689 1
1 58 . 19 1 1 A 81 81 ASP H H 435 7.881 8.025 -0.144 1
1 59 . 19 1 1 A 81 81 ASP HA H 435 4.801 4.884 -0.083 1
1 60 . 19 1 1 A 81 81 ASP C C 435 171.144 175.250 -4.106 1
1 61 . 19 1 1 A 81 81 ASP CA C 435 49.406 51.730 -2.324 1
1 62 . 19 1 1 A 81 81 ASP CB C 435 38.618 41.261 -2.643 1
1 63 . 19 1 1 A 81 81 ASP N N 435 123.108 117.615 5.493 1
1 945 . 19 1 1 A 81 81 ASP H H 435 7.823 8.025 -0.202 1
1 946 . 19 1 1 A 81 81 ASP HA H 435 4.759 4.884 -0.125 1
1 949 . 19 1 1 A 81 81 ASP C C 435 171.057 175.250 -4.193 1
1 950 . 19 1 1 A 81 81 ASP CA C 435 49.174 51.730 -2.556 1
1 951 . 19 1 1 A 81 81 ASP CB C 435 38.725 41.261 -2.536 1
1 952 . 19 1 1 A 81 81 ASP N N 435 123.530 117.615 5.915 1
1 23 . 19 1 1 A 82 82 PRO HA H 436 4.758 4.618 0.140 1
1 24 . 19 1 1 A 82 82 PRO C C 436 172.944 175.267 -2.323 1
1 25 . 19 1 1 A 82 82 PRO CA C 436 60.134 63.832 -3.698 1
1 26 . 19 1 1 A 82 82 PRO CB C 436 31.425 32.293 -0.868 1
1 64 . 19 1 1 A 82 82 PRO HA H 436 4.364 4.618 -0.254 1
1 67 . 19 1 1 A 82 82 PRO C C 436 173.563 175.267 -1.704 1
1 68 . 19 1 1 A 82 82 PRO CA C 436 60.729 63.832 -3.103 1
1 69 . 19 1 1 A 82 82 PRO CB C 436 29.160 32.293 -3.133 1
1 953 . 19 1 1 A 82 82 PRO HA H 436 4.296 4.618 -0.322 1
1 960 . 19 1 1 A 82 82 PRO C C 436 173.494 175.267 -1.773 1
1 961 . 19 1 1 A 82 82 PRO CA C 436 60.625 63.832 -3.207 1
1 962 . 19 1 1 A 82 82 PRO CB C 436 29.237 32.293 -3.056 1
1 1 . 20 1 1 A 3 3 LEU HA H 357 4.257 4.031 0.226 1
1 11 . 20 1 1 A 3 3 LEU C C 357 174.994 177.579 -2.585 1
1 12 . 20 1 1 A 3 3 LEU CA C 357 53.329 57.685 -4.356 1
1 13 . 20 1 1 A 3 3 LEU CB C 357 39.382 42.106 -2.724 1
1 17 . 20 1 1 A 4 4 GLN H H 358 8.234 7.805 0.429 1
1 18 . 20 1 1 A 4 4 GLN HA H 358 4.211 4.466 -0.255 1
1 25 . 20 1 1 A 4 4 GLN C C 358 173.357 175.128 -1.771 1
1 26 . 20 1 1 A 4 4 GLN CA C 358 53.791 55.823 -2.032 1
1 27 . 20 1 1 A 4 4 GLN CB C 358 26.456 29.037 -2.581 1
1 29 . 20 1 1 A 4 4 GLN N N 358 119.506 118.003 1.503 1
1 31 . 20 1 1 A 5 5 ASP H H 359 8.090 9.009 -0.919 1
1 32 . 20 1 1 A 5 5 ASP HA H 359 4.458 4.789 -0.331 1
1 35 . 20 1 1 A 5 5 ASP C C 359 173.492 175.734 -2.242 1
1 36 . 20 1 1 A 5 5 ASP CA C 359 52.309 55.700 -3.391 1
1 37 . 20 1 1 A 5 5 ASP CB C 359 38.312 43.913 -5.601 1
1 38 . 20 1 1 A 5 5 ASP N N 359 120.683 128.916 -8.233 1
1 39 . 20 1 1 A 6 6 HIS H H 360 8.103 7.786 0.317 1
1 40 . 20 1 1 A 6 6 HIS HA H 360 4.540 4.475 0.065 1
1 45 . 20 1 1 A 6 6 HIS C C 360 172.801 175.481 -2.680 1
1 46 . 20 1 1 A 6 6 HIS CA C 360 53.874 56.210 -2.336 1
1 47 . 20 1 1 A 6 6 HIS CB C 360 27.878 30.293 -2.415 1
1 50 . 20 1 1 A 6 6 HIS N N 360 118.844 116.693 2.151 1
1 51 . 20 1 1 A 7 7 ILE H H 361 7.862 8.892 -1.030 1
1 52 . 20 1 1 A 7 7 ILE HA H 361 4.010 4.049 -0.039 1
1 62 . 20 1 1 A 7 7 ILE C C 361 173.268 175.622 -2.354 1
1 63 . 20 1 1 A 7 7 ILE CA C 361 58.740 62.663 -3.923 1
1 64 . 20 1 1 A 7 7 ILE CB C 361 35.788 37.423 -1.635 1
1 68 . 20 1 1 A 7 7 ILE N N 361 121.598 122.102 -0.504 1
1 69 . 20 1 1 A 8 8 LYS H H 362 8.231 8.731 -0.500 1
1 70 . 20 1 1 A 8 8 LYS HA H 362 4.313 4.467 -0.154 1
1 79 . 20 1 1 A 8 8 LYS C C 362 173.899 176.166 -2.267 1
1 80 . 20 1 1 A 8 8 LYS CA C 362 53.677 57.383 -3.706 1
1 81 . 20 1 1 A 8 8 LYS CB C 362 30.355 34.567 -4.212 1
1 85 . 20 1 1 A 8 8 LYS N N 362 124.980 127.318 -2.338 1
1 86 . 20 1 1 A 9 9 VAL H H 363 8.044 7.699 0.345 1
1 87 . 20 1 1 A 9 9 VAL HA H 363 4.089 4.479 -0.390 1
1 95 . 20 1 1 A 9 9 VAL C C 363 173.760 175.480 -1.720 1
1 96 . 20 1 1 A 9 9 VAL CA C 363 59.814 60.727 -0.913 1
1 97 . 20 1 1 A 9 9 VAL CB C 363 30.058 33.602 -3.544 1
1 100 . 20 1 1 A 9 9 VAL N N 363 121.366 115.318 6.048 1
1 101 . 20 1 1 A 10 10 THR H H 364 8.076 9.420 -1.344 1
1 102 . 20 1 1 A 10 10 THR HA H 364 4.302 4.626 -0.324 1
1 107 . 20 1 1 A 10 10 THR C C 364 172.135 174.896 -2.761 1
1 108 . 20 1 1 A 10 10 THR CA C 364 59.134 63.388 -4.254 1
1 109 . 20 1 1 A 10 10 THR CB C 364 67.415 70.947 -3.532 1
1 111 . 20 1 1 A 10 10 THR N N 364 116.817 116.859 -0.042 1
1 112 . 20 1 1 A 11 11 GLN H H 365 8.463 8.661 -0.198 1
1 113 . 20 1 1 A 11 11 GLN HA H 365 4.046 4.297 -0.251 1
1 120 . 20 1 1 A 11 11 GLN C C 365 173.944 175.089 -1.145 1
1 121 . 20 1 1 A 11 11 GLN CA C 365 54.517 57.164 -2.647 1
1 122 . 20 1 1 A 11 11 GLN CB C 365 26.250 29.955 -3.705 1
1 124 . 20 1 1 A 11 11 GLN N N 365 122.059 119.690 2.369 1
1 126 . 20 1 1 A 12 12 GLU H H 366 8.449 8.055 0.394 1
1 127 . 20 1 1 A 12 12 GLU HA H 366 4.093 4.766 -0.673 1
1 132 . 20 1 1 A 12 12 GLU C C 366 174.746 176.124 -1.378 1
1 133 . 20 1 1 A 12 12 GLU CA C 366 55.235 55.171 0.064 1
1 134 . 20 1 1 A 12 12 GLU CB C 366 27.180 32.875 -5.695 1
1 136 . 20 1 1 A 12 12 GLU N N 366 120.415 117.931 2.484 1
1 137 . 20 1 1 A 13 13 GLN H H 367 8.031 8.599 -0.568 1
1 138 . 20 1 1 A 13 13 GLN HA H 367 4.113 3.943 0.170 1
1 145 . 20 1 1 A 13 13 GLN C C 367 173.693 176.016 -2.323 1
1 146 . 20 1 1 A 13 13 GLN CA C 367 54.132 58.337 -4.205 1
1 147 . 20 1 1 A 13 13 GLN CB C 367 26.420 27.873 -1.453 1
1 149 . 20 1 1 A 13 13 GLN N N 367 119.721 123.839 -4.118 1
1 151 . 20 1 1 A 14 14 TYR H H 368 8.111 7.634 0.477 1
1 152 . 20 1 1 A 14 14 TYR HA H 368 4.339 4.686 -0.347 1
1 159 . 20 1 1 A 14 14 TYR C C 368 173.916 176.496 -2.580 1
1 160 . 20 1 1 A 14 14 TYR CA C 368 56.572 57.483 -0.911 1
1 161 . 20 1 1 A 14 14 TYR CB C 368 35.879 38.114 -2.235 1
1 164 . 20 1 1 A 14 14 TYR N N 368 120.541 117.240 3.301 1
1 165 . 20 1 1 A 15 15 GLU H H 369 8.287 8.403 -0.116 1
1 166 . 20 1 1 A 15 15 GLU HA H 369 4.009 4.414 -0.405 1
1 171 . 20 1 1 A 15 15 GLU C C 369 174.448 177.498 -3.050 1
1 172 . 20 1 1 A 15 15 GLU CA C 369 55.047 58.586 -3.539 1
1 173 . 20 1 1 A 15 15 GLU CB C 369 27.226 28.166 -0.940 1
1 175 . 20 1 1 A 15 15 GLU N N 369 120.398 118.990 1.408 1
1 176 . 20 1 1 A 16 16 LEU H H 370 7.785 7.897 -0.112 1
1 177 . 20 1 1 A 16 16 LEU HA H 370 4.138 4.179 -0.041 1
1 187 . 20 1 1 A 16 16 LEU C C 370 175.089 177.219 -2.130 1
1 188 . 20 1 1 A 16 16 LEU CA C 370 53.425 56.255 -2.830 1
1 189 . 20 1 1 A 16 16 LEU CB C 370 39.554 40.694 -1.140 1
1 193 . 20 1 1 A 16 16 LEU N N 370 121.323 118.060 3.263 1
1 194 . 20 1 1 A 17 17 TYR H H 371 8.038 8.176 -0.138 1
1 195 . 20 1 1 A 17 17 TYR HA H 371 4.380 4.530 -0.150 1
1 202 . 20 1 1 A 17 17 TYR C C 371 173.931 176.058 -2.127 1
1 203 . 20 1 1 A 17 17 TYR CA C 371 56.143 57.667 -1.524 1
1 204 . 20 1 1 A 17 17 TYR CB C 371 35.501 38.433 -2.932 1
1 207 . 20 1 1 A 17 17 TYR N N 371 119.465 118.487 0.978 1
1 208 . 20 1 1 A 18 18 CYS H H 372 8.021 7.322 0.699 1
1 209 . 20 1 1 A 18 18 CYS HA H 372 4.236 4.134 0.102 1
1 212 . 20 1 1 A 18 18 CYS C C 372 172.457 174.795 -2.338 1
1 213 . 20 1 1 A 18 18 CYS CA C 372 56.997 57.773 -0.776 1
1 214 . 20 1 1 A 18 18 CYS CB C 372 25.080 26.890 -1.810 1
1 215 . 20 1 1 A 18 18 CYS N N 372 119.913 120.224 -0.311 1
1 216 . 20 1 1 A 19 19 GLU H H 373 8.151 8.162 -0.011 1
1 217 . 20 1 1 A 19 19 GLU HA H 373 4.130 4.399 -0.269 1
1 222 . 20 1 1 A 19 19 GLU C C 373 174.151 177.889 -3.738 1
1 223 . 20 1 1 A 19 19 GLU CA C 373 54.535 56.602 -2.067 1
1 224 . 20 1 1 A 19 19 GLU CB C 373 27.244 30.301 -3.057 1
1 226 . 20 1 1 A 19 19 GLU N N 373 122.431 126.709 -4.278 1
1 227 . 20 1 1 A 20 20 MET H H 374 8.109 7.914 0.195 1
1 228 . 20 1 1 A 20 20 MET HA H 374 4.352 4.298 0.054 1
1 236 . 20 1 1 A 20 20 MET C C 374 174.200 177.140 -2.940 1
1 237 . 20 1 1 A 20 20 MET CA C 374 53.238 55.901 -2.663 1
1 238 . 20 1 1 A 20 20 MET CB C 374 30.237 33.767 -3.530 1
1 241 . 20 1 1 A 20 20 MET N N 374 119.754 116.635 3.119 1
1 242 . 20 1 1 A 21 21 GLY H H 375 8.231 8.206 0.025 1
1 243 . 20 1 1 A 21 21 GLY HA2 H 375 3.861 3.927 -0.066 1
1 244 . 20 1 1 A 21 21 GLY HA3 H 375 3.960 3.934 0.026 1
1 245 . 20 1 1 A 21 21 GLY C C 375 171.928 174.498 -2.570 1
1 246 . 20 1 1 A 21 21 GLY CA C 375 42.930 46.577 -3.647 1
1 247 . 20 1 1 A 21 21 GLY N N 375 109.484 109.994 -0.510 1
1 248 . 20 1 1 A 22 22 SER HA H 376 4.492 4.831 -0.339 1
1 251 . 20 1 1 A 22 22 SER C C 376 172.206 173.422 -1.216 1
1 252 . 20 1 1 A 22 22 SER CA C 376 55.570 57.620 -2.050 1
1 253 . 20 1 1 A 22 22 SER CB C 376 61.525 65.410 -3.885 1
1 254 . 20 1 1 A 23 23 THR H H 377 8.470 8.843 -0.373 1
1 255 . 20 1 1 A 23 23 THR HA H 377 4.295 4.298 -0.003 1
1 260 . 20 1 1 A 23 23 THR C C 377 171.811 175.081 -3.270 1
1 261 . 20 1 1 A 23 23 THR CA C 377 58.937 62.852 -3.915 1
1 262 . 20 1 1 A 23 23 THR CB C 377 67.250 68.033 -0.783 1
1 264 . 20 1 1 A 23 23 THR N N 377 124.043 120.349 3.694 1
1 265 . 20 1 1 A 24 24 PHE H H 378 8.374 8.951 -0.577 1
1 266 . 20 1 1 A 24 24 PHE HA H 378 4.239 4.099 0.140 1
1 273 . 20 1 1 A 24 24 PHE C C 378 173.411 177.459 -4.048 1
1 274 . 20 1 1 A 24 24 PHE CA C 378 56.697 60.128 -3.431 1
1 275 . 20 1 1 A 24 24 PHE CB C 378 36.538 39.965 -3.427 1
1 278 . 20 1 1 A 24 24 PHE N N 378 124.732 127.951 -3.219 1
1 279 . 20 1 1 A 25 25 GLN H H 379 8.457 8.244 0.213 1
1 280 . 20 1 1 A 25 25 GLN HA H 379 4.038 4.023 0.015 1
1 287 . 20 1 1 A 25 25 GLN C C 379 172.431 176.288 -3.857 1
1 288 . 20 1 1 A 25 25 GLN CA C 379 54.078 57.812 -3.734 1
1 289 . 20 1 1 A 25 25 GLN CB C 379 26.414 28.732 -2.318 1
1 291 . 20 1 1 A 25 25 GLN N N 379 118.820 117.825 0.995 1
1 293 . 20 1 1 A 26 26 LEU H H 380 6.985 7.230 -0.245 1
1 294 . 20 1 1 A 26 26 LEU HA H 380 4.229 4.247 -0.018 1
1 304 . 20 1 1 A 26 26 LEU C C 380 173.895 176.404 -2.509 1
1 305 . 20 1 1 A 26 26 LEU CA C 380 52.123 54.511 -2.388 1
1 306 . 20 1 1 A 26 26 LEU CB C 380 40.543 42.684 -2.141 1
1 310 . 20 1 1 A 26 26 LEU N N 380 119.079 121.741 -2.662 1
1 311 . 20 1 1 A 27 27 CYS H H 381 8.905 9.253 -0.348 1
1 312 . 20 1 1 A 27 27 CYS HA H 381 4.013 4.495 -0.482 1
1 315 . 20 1 1 A 27 27 CYS C C 381 174.439 175.840 -1.401 1
1 316 . 20 1 1 A 27 27 CYS CA C 381 57.847 59.297 -1.450 1
1 317 . 20 1 1 A 27 27 CYS CB C 381 28.648 28.534 0.114 1
1 318 . 20 1 1 A 27 27 CYS N N 381 125.151 122.579 2.572 1
1 319 . 20 1 1 A 28 28 LYS H H 382 9.351 8.829 0.522 1
1 320 . 20 1 1 A 28 28 LYS HA H 382 4.157 3.956 0.201 1
1 329 . 20 1 1 A 28 28 LYS C C 382 174.678 178.327 -3.649 1
1 330 . 20 1 1 A 28 28 LYS CA C 382 54.324 59.025 -4.701 1
1 331 . 20 1 1 A 28 28 LYS CB C 382 30.086 32.552 -2.466 1
1 335 . 20 1 1 A 28 28 LYS N N 382 128.840 128.096 0.744 1
1 336 . 20 1 1 A 29 29 ILE H H 383 9.040 8.083 0.957 1
1 337 . 20 1 1 A 29 29 ILE HA H 383 3.804 3.515 0.289 1
1 347 . 20 1 1 A 29 29 ILE C C 383 174.239 177.535 -3.296 1
1 348 . 20 1 1 A 29 29 ILE CA C 383 62.114 65.011 -2.897 1
1 349 . 20 1 1 A 29 29 ILE CB C 383 33.870 37.944 -4.074 1
1 353 . 20 1 1 A 29 29 ILE N N 383 122.718 119.747 2.971 1
1 354 . 20 1 1 A 30 30 CYS H H 384 7.572 7.720 -0.148 1
1 355 . 20 1 1 A 30 30 CYS HA H 384 4.548 4.416 0.132 1
1 358 . 20 1 1 A 30 30 CYS C C 384 172.978 175.305 -2.327 1
1 359 . 20 1 1 A 30 30 CYS CA C 384 54.957 59.725 -4.768 1
1 360 . 20 1 1 A 30 30 CYS CB C 384 29.778 29.348 0.430 1
1 361 . 20 1 1 A 30 30 CYS N N 384 116.356 115.911 0.445 1
1 362 . 20 1 1 A 31 31 ALA H H 385 8.205 8.351 -0.146 1
1 363 . 20 1 1 A 31 31 ALA HA H 385 4.107 4.377 -0.270 1
1 367 . 20 1 1 A 31 31 ALA C C 385 173.139 177.263 -4.124 1
1 368 . 20 1 1 A 31 31 ALA CA C 385 50.802 54.189 -3.387 1
1 369 . 20 1 1 A 31 31 ALA CB C 385 14.634 18.138 -3.504 1
1 370 . 20 1 1 A 31 31 ALA N N 385 125.526 120.723 4.803 1
1 371 . 20 1 1 A 32 32 GLU H H 386 8.416 8.145 0.271 1
1 372 . 20 1 1 A 32 32 GLU HA H 386 4.467 4.411 0.056 1
1 377 . 20 1 1 A 32 32 GLU C C 386 172.325 176.389 -4.064 1
1 378 . 20 1 1 A 32 32 GLU CA C 386 55.146 57.142 -1.996 1
1 379 . 20 1 1 A 32 32 GLU CB C 386 31.181 30.953 0.228 1
1 381 . 20 1 1 A 32 32 GLU N N 386 117.579 116.294 1.285 1
1 382 . 20 1 1 A 33 33 ASN H H 387 7.872 7.783 0.089 1
1 383 . 20 1 1 A 33 33 ASN HA H 387 4.900 4.996 -0.096 1
1 388 . 20 1 1 A 33 33 ASN C C 387 171.355 174.747 -3.392 1
1 389 . 20 1 1 A 33 33 ASN CA C 387 49.320 51.900 -2.580 1
1 390 . 20 1 1 A 33 33 ASN CB C 387 38.457 39.892 -1.435 1
1 391 . 20 1 1 A 33 33 ASN N N 387 120.399 117.120 3.279 1
1 393 . 20 1 1 A 34 34 ASP H H 388 8.565 8.632 -0.067 1
1 394 . 20 1 1 A 34 34 ASP HA H 388 4.679 4.846 -0.167 1
1 397 . 20 1 1 A 34 34 ASP C C 388 174.243 176.366 -2.123 1
1 398 . 20 1 1 A 34 34 ASP CA C 388 51.809 53.846 -2.037 1
1 399 . 20 1 1 A 34 34 ASP CB C 388 38.007 42.164 -4.157 1
1 400 . 20 1 1 A 34 34 ASP N N 388 120.661 120.466 0.195 1
1 401 . 20 1 1 A 35 35 LYS H H 389 8.544 9.174 -0.630 1
1 402 . 20 1 1 A 35 35 LYS HA H 389 3.411 4.334 -0.923 1
1 409 . 20 1 1 A 35 35 LYS C C 389 172.938 176.924 -3.986 1
1 410 . 20 1 1 A 35 35 LYS CA C 389 54.973 55.840 -0.867 1
1 411 . 20 1 1 A 35 35 LYS CB C 389 30.617 32.257 -1.640 1
1 415 . 20 1 1 A 35 35 LYS N N 389 119.199 121.332 -2.133 1
1 416 . 20 1 1 A 36 36 ASP H H 390 8.327 8.635 -0.308 1
1 417 . 20 1 1 A 36 36 ASP HA H 390 4.724 4.853 -0.129 1
1 420 . 20 1 1 A 36 36 ASP C C 390 172.860 175.315 -2.455 1
1 421 . 20 1 1 A 36 36 ASP CA C 390 51.609 53.860 -2.251 1
1 422 . 20 1 1 A 36 36 ASP CB C 390 39.018 41.634 -2.616 1
1 423 . 20 1 1 A 36 36 ASP N N 390 119.134 121.160 -2.026 1
1 424 . 20 1 1 A 37 37 VAL H H 391 8.544 7.876 0.668 1
1 425 . 20 1 1 A 37 37 VAL HA H 391 4.877 4.752 0.125 1
1 433 . 20 1 1 A 37 37 VAL C C 391 167.519 173.506 -5.987 1
1 434 . 20 1 1 A 37 37 VAL CA C 391 58.259 59.972 -1.713 1
1 435 . 20 1 1 A 37 37 VAL CB C 391 32.277 34.929 -2.652 1
1 438 . 20 1 1 A 37 37 VAL N N 391 121.970 119.291 2.679 1
1 439 . 20 1 1 A 38 38 LYS H H 392 8.621 9.525 -0.904 1
1 440 . 20 1 1 A 38 38 LYS HA H 392 4.991 5.265 -0.274 1
1 449 . 20 1 1 A 38 38 LYS C C 392 172.681 175.192 -2.511 1
1 450 . 20 1 1 A 38 38 LYS CA C 392 51.123 54.665 -3.542 1
1 451 . 20 1 1 A 38 38 LYS CB C 392 33.697 34.847 -1.150 1
1 455 . 20 1 1 A 38 38 LYS N N 392 126.381 129.115 -2.734 1
1 456 . 20 1 1 A 39 39 ILE H H 393 8.723 8.956 -0.233 1
1 457 . 20 1 1 A 39 39 ILE HA H 393 4.239 4.352 -0.113 1
1 467 . 20 1 1 A 39 39 ILE C C 393 172.642 175.733 -3.091 1
1 468 . 20 1 1 A 39 39 ILE CA C 393 57.768 61.065 -3.297 1
1 469 . 20 1 1 A 39 39 ILE CB C 393 35.691 37.485 -1.794 1
1 473 . 20 1 1 A 39 39 ILE N N 393 126.398 127.361 -0.963 1
1 474 . 20 1 1 A 40 40 GLU H H 394 8.506 9.428 -0.922 1
1 475 . 20 1 1 A 40 40 GLU HA H 394 4.753 4.712 0.041 1
1 480 . 20 1 1 A 40 40 GLU C C 394 173.596 176.160 -2.564 1
1 481 . 20 1 1 A 40 40 GLU CA C 394 49.793 53.337 -3.544 1
1 482 . 20 1 1 A 40 40 GLU CB C 394 28.210 30.614 -2.404 1
1 484 . 20 1 1 A 40 40 GLU N N 394 124.864 128.023 -3.159 1
1 485 . 20 1 1 A 41 41 PRO HA H 395 4.864 4.477 0.387 1
1 492 . 20 1 1 A 41 41 PRO C C 395 175.073 177.128 -2.055 1
1 493 . 20 1 1 A 41 41 PRO CA C 395 61.111 63.792 -2.681 1
1 494 . 20 1 1 A 41 41 PRO CB C 395 32.275 32.958 -0.683 1
1 497 . 20 1 1 A 42 42 CYS H H 396 7.828 7.884 -0.056 1
1 498 . 20 1 1 A 42 42 CYS HA H 396 4.208 3.991 0.217 1
1 501 . 20 1 1 A 42 42 CYS C C 396 173.877 175.007 -1.130 1
1 502 . 20 1 1 A 42 42 CYS CA C 396 58.021 61.515 -3.494 1
1 503 . 20 1 1 A 42 42 CYS CB C 396 28.242 27.582 0.660 1
1 504 . 20 1 1 A 42 42 CYS N N 396 122.434 117.932 4.502 1
1 505 . 20 1 1 A 43 43 GLY H H 397 8.679 8.870 -0.191 1
1 506 . 20 1 1 A 43 43 GLY HA2 H 397 3.507 3.938 -0.431 1
1 507 . 20 1 1 A 43 43 GLY HA3 H 397 3.914 3.941 -0.027 1
1 508 . 20 1 1 A 43 43 GLY C C 397 171.981 174.858 -2.877 1
1 509 . 20 1 1 A 43 43 GLY CA C 397 43.347 45.622 -2.275 1
1 510 . 20 1 1 A 43 43 GLY N N 397 112.123 108.346 3.777 1
1 511 . 20 1 1 A 44 44 HIS H H 398 8.329 7.805 0.524 1
1 512 . 20 1 1 A 44 44 HIS HA H 398 4.339 4.489 -0.150 1
1 517 . 20 1 1 A 44 44 HIS C C 398 170.742 174.920 -4.178 1
1 518 . 20 1 1 A 44 44 HIS CA C 398 58.368 56.274 2.094 1
1 519 . 20 1 1 A 44 44 HIS CB C 398 28.434 31.101 -2.667 1
1 522 . 20 1 1 A 44 44 HIS N N 398 121.393 117.809 3.584 1
1 523 . 20 1 1 A 45 45 LEU H H 399 8.241 8.821 -0.580 1
1 524 . 20 1 1 A 45 45 LEU HA H 399 5.570 5.248 0.322 1
1 534 . 20 1 1 A 45 45 LEU C C 399 174.464 175.450 -0.986 1
1 535 . 20 1 1 A 45 45 LEU CA C 399 50.729 53.559 -2.830 1
1 536 . 20 1 1 A 45 45 LEU CB C 399 43.574 43.969 -0.395 1
1 540 . 20 1 1 A 45 45 LEU N N 399 118.469 122.389 -3.920 1
1 541 . 20 1 1 A 46 46 MET H H 400 8.707 8.782 -0.075 1
1 542 . 20 1 1 A 46 46 MET HA H 400 4.842 5.029 -0.187 1
1 550 . 20 1 1 A 46 46 MET C C 400 170.736 174.156 -3.420 1
1 551 . 20 1 1 A 46 46 MET CA C 400 52.804 54.050 -1.246 1
1 552 . 20 1 1 A 46 46 MET CB C 400 31.945 35.283 -3.338 1
1 555 . 20 1 1 A 46 46 MET N N 400 114.897 120.293 -5.396 1
1 556 . 20 1 1 A 47 47 CYS H H 401 9.436 8.215 1.221 1
1 557 . 20 1 1 A 47 47 CYS HA H 401 5.629 5.290 0.339 1
1 560 . 20 1 1 A 47 47 CYS C C 401 173.909 176.068 -2.159 1
1 561 . 20 1 1 A 47 47 CYS CA C 401 54.325 56.847 -2.522 1
1 562 . 20 1 1 A 47 47 CYS CB C 401 30.725 29.745 0.980 1
1 563 . 20 1 1 A 47 47 CYS N N 401 119.575 119.109 0.466 1
1 564 . 20 1 1 A 48 48 THR H H 402 9.842 9.613 0.229 1
1 565 . 20 1 1 A 48 48 THR HA H 402 3.768 4.008 -0.240 1
1 570 . 20 1 1 A 48 48 THR C C 402 174.333 176.359 -2.026 1
1 571 . 20 1 1 A 48 48 THR CA C 402 64.516 65.834 -1.318 1
1 572 . 20 1 1 A 48 48 THR CB C 402 66.288 68.678 -2.390 1
1 574 . 20 1 1 A 48 48 THR N N 402 119.945 119.220 0.725 1
1 575 . 20 1 1 A 49 49 SER H H 403 8.355 8.053 0.302 1
1 576 . 20 1 1 A 49 49 SER HA H 403 4.222 4.075 0.147 1
1 579 . 20 1 1 A 49 49 SER C C 403 175.059 176.730 -1.671 1
1 580 . 20 1 1 A 49 49 SER CA C 403 59.828 61.878 -2.050 1
1 581 . 20 1 1 A 49 49 SER CB C 403 59.717 62.608 -2.891 1
1 582 . 20 1 1 A 49 49 SER N N 403 120.468 117.324 3.144 1
1 583 . 20 1 1 A 50 50 CYS H H 404 9.464 7.868 1.596 1
1 584 . 20 1 1 A 50 50 CYS HA H 404 3.922 4.151 -0.229 1
1 587 . 20 1 1 A 50 50 CYS C C 404 176.081 177.086 -1.005 1
1 588 . 20 1 1 A 50 50 CYS CA C 404 63.076 64.029 -0.953 1
1 589 . 20 1 1 A 50 50 CYS CB C 404 26.078 27.811 -1.733 1
1 590 . 20 1 1 A 50 50 CYS N N 404 126.744 119.358 7.386 1
1 591 . 20 1 1 A 51 51 LEU H H 405 7.948 8.194 -0.246 1
1 592 . 20 1 1 A 51 51 LEU HA H 405 4.064 4.208 -0.144 1
1 602 . 20 1 1 A 51 51 LEU C C 405 175.495 178.721 -3.226 1
1 603 . 20 1 1 A 51 51 LEU CA C 405 55.914 58.202 -2.288 1
1 604 . 20 1 1 A 51 51 LEU CB C 405 38.662 41.982 -3.320 1
1 607 . 20 1 1 A 51 51 LEU N N 405 121.951 122.691 -0.740 1
1 608 . 20 1 1 A 52 52 THR H H 406 8.786 8.752 0.034 1
1 609 . 20 1 1 A 52 52 THR HA H 406 4.024 3.967 0.057 1
1 614 . 20 1 1 A 52 52 THR C C 406 174.139 176.394 -2.255 1
1 615 . 20 1 1 A 52 52 THR CA C 406 64.017 66.492 -2.475 1
1 616 . 20 1 1 A 52 52 THR CB C 406 66.115 68.327 -2.212 1
1 618 . 20 1 1 A 52 52 THR N N 406 115.258 114.547 0.711 1
1 619 . 20 1 1 A 53 53 SER H H 407 8.115 7.949 0.166 1
1 620 . 20 1 1 A 53 53 SER HA H 407 4.204 4.119 0.085 1
1 623 . 20 1 1 A 53 53 SER C C 407 174.456 176.926 -2.470 1
1 624 . 20 1 1 A 53 53 SER CA C 407 59.090 61.552 -2.462 1
1 625 . 20 1 1 A 53 53 SER CB C 407 60.146 63.149 -3.003 1
1 626 . 20 1 1 A 53 53 SER N N 407 116.852 114.971 1.881 1
1 627 . 20 1 1 A 54 54 TRP H H 408 8.123 8.236 -0.113 1
1 628 . 20 1 1 A 54 54 TRP HA H 408 4.371 4.235 0.136 1
1 637 . 20 1 1 A 54 54 TRP C C 408 175.981 178.816 -2.835 1
1 638 . 20 1 1 A 54 54 TRP CA C 408 57.323 61.005 -3.682 1
1 639 . 20 1 1 A 54 54 TRP CB C 408 26.812 29.613 -2.801 1
1 645 . 20 1 1 A 54 54 TRP N N 408 123.556 123.899 -0.343 1
1 647 . 20 1 1 A 55 55 GLN H H 409 8.502 8.664 -0.162 1
1 648 . 20 1 1 A 55 55 GLN HA H 409 3.999 3.756 0.243 1
1 655 . 20 1 1 A 55 55 GLN C C 409 177.300 178.117 -0.817 1
1 656 . 20 1 1 A 55 55 GLN CA C 409 56.484 58.878 -2.394 1
1 657 . 20 1 1 A 55 55 GLN CB C 409 26.190 28.292 -2.102 1
1 659 . 20 1 1 A 55 55 GLN N N 409 118.044 118.043 0.001 1
1 661 . 20 1 1 A 56 56 GLU H H 410 8.467 8.225 0.242 1
1 662 . 20 1 1 A 56 56 GLU HA H 410 4.057 4.108 -0.051 1
1 667 . 20 1 1 A 56 56 GLU C C 410 174.787 177.991 -3.204 1
1 668 . 20 1 1 A 56 56 GLU CA C 410 55.909 58.622 -2.713 1
1 669 . 20 1 1 A 56 56 GLU CB C 410 26.895 29.483 -2.588 1
1 671 . 20 1 1 A 56 56 GLU N N 410 119.448 119.768 -0.320 1
1 672 . 20 1 1 A 57 57 SER H H 411 7.438 7.423 0.015 1
1 673 . 20 1 1 A 57 57 SER HA H 411 4.607 4.468 0.139 1
1 676 . 20 1 1 A 57 57 SER C C 411 170.849 173.081 -2.232 1
1 677 . 20 1 1 A 57 57 SER CA C 411 55.540 58.048 -2.508 1
1 678 . 20 1 1 A 57 57 SER CB C 411 60.928 63.313 -2.385 1
1 679 . 20 1 1 A 57 57 SER N N 411 113.752 111.850 1.902 1
1 680 . 20 1 1 A 58 58 GLU H H 412 7.855 7.833 0.022 1
1 681 . 20 1 1 A 58 58 GLU HA H 412 3.772 4.031 -0.259 1
1 686 . 20 1 1 A 58 58 GLU C C 412 173.743 175.275 -1.532 1
1 687 . 20 1 1 A 58 58 GLU CA C 412 54.442 56.819 -2.377 1
1 688 . 20 1 1 A 58 58 GLU CB C 412 24.603 28.238 -3.635 1
1 690 . 20 1 1 A 58 58 GLU N N 412 115.908 117.847 -1.939 1
1 691 . 20 1 1 A 59 59 GLY H H 413 7.588 8.145 -0.557 1
1 692 . 20 1 1 A 59 59 GLY HA2 H 413 1.643 2.673 -1.030 1
1 693 . 20 1 1 A 59 59 GLY HA3 H 413 2.949 3.551 -0.602 1
1 694 . 20 1 1 A 59 59 GLY C C 413 170.850 171.735 -0.885 1
1 695 . 20 1 1 A 59 59 GLY CA C 413 41.724 43.989 -2.265 1
1 696 . 20 1 1 A 59 59 GLY N N 413 108.032 110.664 -2.632 1
1 697 . 20 1 1 A 60 60 GLN H H 414 7.973 8.614 -0.641 1
1 698 . 20 1 1 A 60 60 GLN HA H 414 4.366 4.710 -0.344 1
1 705 . 20 1 1 A 60 60 GLN C C 414 173.108 175.617 -2.509 1
1 706 . 20 1 1 A 60 60 GLN CA C 414 52.422 55.347 -2.925 1
1 707 . 20 1 1 A 60 60 GLN CB C 414 27.049 29.806 -2.757 1
1 709 . 20 1 1 A 60 60 GLN N N 414 122.690 123.649 -0.959 1
1 711 . 20 1 1 A 61 61 GLY H H 415 8.301 8.417 -0.116 1
1 712 . 20 1 1 A 61 61 GLY HA2 H 415 3.700 4.246 -0.546 1
1 713 . 20 1 1 A 61 61 GLY HA3 H 415 3.920 4.280 -0.360 1
1 714 . 20 1 1 A 61 61 GLY C C 415 170.249 174.434 -4.185 1
1 715 . 20 1 1 A 61 61 GLY CA C 415 42.210 44.166 -1.956 1
1 716 . 20 1 1 A 61 61 GLY N N 415 110.794 113.627 -2.833 1
1 717 . 20 1 1 A 62 62 CYS H H 416 8.549 8.238 0.311 1
1 718 . 20 1 1 A 62 62 CYS HA H 416 4.227 4.630 -0.403 1
1 721 . 20 1 1 A 62 62 CYS C C 416 172.914 175.223 -2.309 1
1 722 . 20 1 1 A 62 62 CYS CA C 416 54.008 58.581 -4.573 1
1 723 . 20 1 1 A 62 62 CYS CB C 416 29.716 27.244 2.472 1
1 724 . 20 1 1 A 62 62 CYS N N 416 123.683 120.593 3.090 1
1 725 . 20 1 1 A 63 63 PRO HA H 417 2.611 2.662 -0.051 1
1 732 . 20 1 1 A 63 63 PRO C C 417 174.143 176.765 -2.622 1
1 733 . 20 1 1 A 63 63 PRO CA C 417 61.689 63.338 -1.649 1
1 734 . 20 1 1 A 63 63 PRO CB C 417 28.534 31.013 -2.479 1
1 737 . 20 1 1 A 64 64 PHE H H 418 8.968 8.092 0.876 1
1 738 . 20 1 1 A 64 64 PHE HA H 418 4.250 4.336 -0.086 1
1 746 . 20 1 1 A 64 64 PHE C C 418 174.243 177.062 -2.819 1
1 747 . 20 1 1 A 64 64 PHE CA C 418 56.720 59.573 -2.853 1
1 748 . 20 1 1 A 64 64 PHE CB C 418 36.458 40.200 -3.742 1
1 752 . 20 1 1 A 64 64 PHE N N 418 117.008 115.219 1.789 1
1 753 . 20 1 1 A 65 65 CYS H H 419 7.968 8.019 -0.051 1
1 754 . 20 1 1 A 65 65 CYS HA H 419 4.906 4.524 0.382 1
1 757 . 20 1 1 A 65 65 CYS C C 419 173.198 175.140 -1.942 1
1 758 . 20 1 1 A 65 65 CYS CA C 419 55.870 59.044 -3.174 1
1 759 . 20 1 1 A 65 65 CYS CB C 419 30.559 29.289 1.270 1
1 760 . 20 1 1 A 65 65 CYS N N 419 117.505 115.356 2.149 1
1 761 . 20 1 1 A 66 66 ARG H H 420 8.761 8.265 0.496 1
1 762 . 20 1 1 A 66 66 ARG HA H 420 4.365 4.219 0.146 1
1 769 . 20 1 1 A 66 66 ARG C C 420 172.921 174.940 -2.019 1
1 770 . 20 1 1 A 66 66 ARG CA C 420 54.763 57.264 -2.501 1
1 771 . 20 1 1 A 66 66 ARG CB C 420 24.286 27.170 -2.884 1
1 774 . 20 1 1 A 66 66 ARG N N 420 118.763 115.865 2.898 1
1 775 . 20 1 1 A 67 67 CYS H H 421 8.223 7.877 0.346 1
1 776 . 20 1 1 A 67 67 CYS HA H 421 4.419 4.571 -0.152 1
1 779 . 20 1 1 A 67 67 CYS C C 421 171.160 174.638 -3.478 1
1 780 . 20 1 1 A 67 67 CYS CA C 421 57.119 58.562 -1.443 1
1 781 . 20 1 1 A 67 67 CYS CB C 421 25.911 29.362 -3.451 1
1 782 . 20 1 1 A 67 67 CYS N N 421 120.627 117.027 3.600 1
1 783 . 20 1 1 A 68 68 GLU H H 422 8.416 8.581 -0.165 1
1 784 . 20 1 1 A 68 68 GLU HA H 422 4.025 4.156 -0.131 1
1 789 . 20 1 1 A 68 68 GLU C C 422 173.764 176.302 -2.538 1
1 790 . 20 1 1 A 68 68 GLU CA C 422 54.752 57.373 -2.621 1
1 791 . 20 1 1 A 68 68 GLU CB C 422 27.302 29.547 -2.245 1
1 793 . 20 1 1 A 68 68 GLU N N 422 122.370 120.761 1.609 1
1 794 . 20 1 1 A 69 69 ILE H H 423 8.648 8.999 -0.351 1
1 795 . 20 1 1 A 69 69 ILE HA H 423 4.012 4.328 -0.316 1
1 805 . 20 1 1 A 69 69 ILE C C 423 174.257 175.765 -1.508 1
1 806 . 20 1 1 A 69 69 ILE CA C 423 59.740 61.087 -1.347 1
1 807 . 20 1 1 A 69 69 ILE CB C 423 35.846 37.400 -1.554 1
1 811 . 20 1 1 A 69 69 ILE N N 423 125.988 126.019 -0.031 1
1 812 . 20 1 1 A 70 70 LYS H H 424 9.185 9.221 -0.036 1
1 813 . 20 1 1 A 70 70 LYS HA H 424 4.434 4.622 -0.188 1
1 822 . 20 1 1 A 70 70 LYS C C 424 173.880 177.088 -3.208 1
1 823 . 20 1 1 A 70 70 LYS CA C 424 53.378 56.656 -3.278 1
1 824 . 20 1 1 A 70 70 LYS CB C 424 30.397 34.179 -3.782 1
1 828 . 20 1 1 A 70 70 LYS N N 424 128.977 127.737 1.240 1
1 829 . 20 1 1 A 71 71 GLY H H 425 7.810 7.675 0.135 1
1 830 . 20 1 1 A 71 71 GLY HA2 H 425 4.094 4.025 0.069 1
1 831 . 20 1 1 A 71 71 GLY HA3 H 425 4.159 4.028 0.131 1
1 832 . 20 1 1 A 71 71 GLY C C 425 168.179 172.323 -4.144 1
1 833 . 20 1 1 A 71 71 GLY CA C 425 42.326 45.212 -2.886 1
1 834 . 20 1 1 A 71 71 GLY N N 425 107.696 103.787 3.909 1
1 835 . 20 1 1 A 72 72 THR H H 426 8.048 8.710 -0.662 1
1 836 . 20 1 1 A 72 72 THR HA H 426 5.258 5.419 -0.161 1
1 841 . 20 1 1 A 72 72 THR C C 426 170.979 172.624 -1.645 1
1 842 . 20 1 1 A 72 72 THR CA C 426 56.755 59.980 -3.225 1
1 843 . 20 1 1 A 72 72 THR CB C 426 69.226 71.210 -1.984 1
1 845 . 20 1 1 A 72 72 THR N N 426 109.122 110.713 -1.591 1
1 846 . 20 1 1 A 73 73 GLU H H 427 8.912 9.449 -0.537 1
1 847 . 20 1 1 A 73 73 GLU HA H 427 4.954 4.889 0.065 1
1 852 . 20 1 1 A 73 73 GLU C C 427 170.353 174.713 -4.360 1
1 853 . 20 1 1 A 73 73 GLU CA C 427 50.182 52.920 -2.738 1
1 854 . 20 1 1 A 73 73 GLU CB C 427 30.559 32.988 -2.429 1
1 856 . 20 1 1 A 73 73 GLU N N 427 121.703 124.375 -2.672 1
1 1 . 20 1 1 A 74 74 PRO HA H 428 4.372 4.877 -0.505 1
1 2 . 20 1 1 A 74 74 PRO C C 428 173.839 176.060 -2.221 1
1 3 . 20 1 1 A 74 74 PRO CA C 428 60.241 62.638 -2.397 1
1 4 . 20 1 1 A 74 74 PRO CB C 428 29.299 32.394 -3.095 1
1 857 . 20 1 1 A 74 74 PRO HA H 428 4.782 4.877 -0.095 1
1 864 . 20 1 1 A 74 74 PRO C C 428 174.027 176.060 -2.033 1
1 865 . 20 1 1 A 74 74 PRO CA C 428 59.771 62.638 -2.867 1
1 866 . 20 1 1 A 74 74 PRO CB C 428 29.633 32.394 -2.761 1
1 7 . 20 1 1 A 75 75 ILE H H 429 8.144 8.769 -0.625 1
1 8 . 20 1 1 A 75 75 ILE HA H 429 4.086 4.672 -0.586 1
1 15 . 20 1 1 A 75 75 ILE C C 429 173.426 174.700 -1.274 1
1 16 . 20 1 1 A 75 75 ILE CA C 429 58.339 60.680 -2.341 1
1 17 . 20 1 1 A 75 75 ILE CB C 429 35.988 39.499 -3.511 1
1 21 . 20 1 1 A 75 75 ILE N N 429 121.551 121.965 -0.414 1
1 869 . 20 1 1 A 75 75 ILE H H 429 7.682 8.769 -1.087 1
1 870 . 20 1 1 A 75 75 ILE HA H 429 4.282 4.672 -0.390 1
1 880 . 20 1 1 A 75 75 ILE C C 429 172.510 174.700 -2.190 1
1 881 . 20 1 1 A 75 75 ILE CA C 429 57.456 60.680 -3.224 1
1 882 . 20 1 1 A 75 75 ILE CB C 429 37.903 39.499 -1.596 1
1 886 . 20 1 1 A 75 75 ILE N N 429 119.651 121.965 -2.314 1
1 1 . 20 1 1 A 76 76 VAL HA H 430 4.086 4.607 -0.521 1
1 2 . 20 1 1 A 76 76 VAL CA C 430 59.372 60.587 -1.215 1
1 22 . 20 1 1 A 76 76 VAL H H 430 8.221 9.004 -0.783 1
1 23 . 20 1 1 A 76 76 VAL HA H 430 4.083 4.607 -0.524 1
1 24 . 20 1 1 A 76 76 VAL C C 430 173.067 176.023 -2.956 1
1 25 . 20 1 1 A 76 76 VAL CA C 430 59.445 60.587 -1.142 1
1 26 . 20 1 1 A 76 76 VAL CB C 430 30.407 33.398 -2.991 1
1 27 . 20 1 1 A 76 76 VAL N N 430 125.930 127.299 -1.369 1
1 887 . 20 1 1 A 76 76 VAL H H 430 8.122 9.004 -0.882 1
1 888 . 20 1 1 A 76 76 VAL HA H 430 4.197 4.607 -0.410 1
1 890 . 20 1 1 A 76 76 VAL C C 430 172.971 176.023 -3.052 1
1 891 . 20 1 1 A 76 76 VAL CA C 430 58.821 60.587 -1.766 1
1 892 . 20 1 1 A 76 76 VAL CB C 430 30.807 33.398 -2.591 1
1 895 . 20 1 1 A 76 76 VAL N N 430 124.178 127.299 -3.121 1
1 4 . 20 1 1 A 77 77 VAL H H 431 8.204 8.656 -0.452 1
1 5 . 20 1 1 A 77 77 VAL HA H 431 4.049 4.524 -0.475 1
1 6 . 20 1 1 A 77 77 VAL C C 431 172.636 174.555 -1.919 1
1 7 . 20 1 1 A 77 77 VAL CA C 431 59.315 60.223 -0.908 1
1 8 . 20 1 1 A 77 77 VAL CB C 431 30.219 31.677 -1.458 1
1 9 . 20 1 1 A 77 77 VAL N N 431 125.320 122.963 2.357 1
1 28 . 20 1 1 A 77 77 VAL H H 431 8.412 8.656 -0.244 1
1 29 . 20 1 1 A 77 77 VAL HA H 431 4.038 4.524 -0.486 1
1 37 . 20 1 1 A 77 77 VAL C C 431 172.617 174.555 -1.938 1
1 38 . 20 1 1 A 77 77 VAL CA C 431 59.137 60.223 -1.086 1
1 39 . 20 1 1 A 77 77 VAL CB C 431 30.292 31.677 -1.385 1
1 42 . 20 1 1 A 77 77 VAL N N 431 125.655 122.963 2.692 1
1 896 . 20 1 1 A 77 77 VAL H H 431 8.448 8.656 -0.208 1
1 897 . 20 1 1 A 77 77 VAL HA H 431 4.087 4.524 -0.437 1
1 905 . 20 1 1 A 77 77 VAL C C 431 172.493 174.555 -2.062 1
1 906 . 20 1 1 A 77 77 VAL CA C 431 59.185 60.223 -1.038 1
1 907 . 20 1 1 A 77 77 VAL CB C 431 30.084 31.677 -1.593 1
1 910 . 20 1 1 A 77 77 VAL N N 431 125.770 122.963 2.807 1
1 43 . 20 1 1 A 78 78 ASP H H 432 8.419 7.593 0.826 1
1 44 . 20 1 1 A 78 78 ASP HA H 432 4.829 4.644 0.185 1
1 45 . 20 1 1 A 78 78 ASP C C 432 172.252 174.148 -1.896 1
1 46 . 20 1 1 A 78 78 ASP CA C 432 49.320 50.416 -1.096 1
1 47 . 20 1 1 A 78 78 ASP CB C 432 39.066 40.944 -1.878 1
1 48 . 20 1 1 A 78 78 ASP N N 432 126.226 123.634 2.592 1
1 911 . 20 1 1 A 78 78 ASP H H 432 8.493 7.593 0.900 1
1 912 . 20 1 1 A 78 78 ASP HA H 432 4.852 4.644 0.208 1
1 915 . 20 1 1 A 78 78 ASP C C 432 172.048 174.148 -2.100 1
1 916 . 20 1 1 A 78 78 ASP CA C 432 49.233 50.416 -1.183 1
1 917 . 20 1 1 A 78 78 ASP CB C 432 38.858 40.944 -2.086 1
1 918 . 20 1 1 A 78 78 ASP N N 432 126.705 123.634 3.071 1
1 10 . 20 1 1 A 79 79 PRO CA C 433 63.865 62.301 1.564 1
1 49 . 20 1 1 A 79 79 PRO C C 433 173.867 175.785 -1.918 1
1 919 . 20 1 1 A 79 79 PRO HA H 433 4.237 4.659 -0.422 1
1 926 . 20 1 1 A 79 79 PRO C C 433 173.812 175.785 -1.973 1
1 927 . 20 1 1 A 79 79 PRO CA C 433 60.627 62.301 -1.674 1
1 928 . 20 1 1 A 79 79 PRO CB C 433 29.329 30.169 -0.840 1
1 11 . 20 1 1 A 80 80 PHE H H 434 8.182 8.032 0.150 1
1 12 . 20 1 1 A 80 80 PHE HA H 434 4.499 4.781 -0.282 1
1 13 . 20 1 1 A 80 80 PHE C C 434 171.680 176.078 -4.398 1
1 14 . 20 1 1 A 80 80 PHE CA C 434 54.657 56.748 -2.091 1
1 15 . 20 1 1 A 80 80 PHE CB C 434 36.272 37.736 -1.464 1
1 16 . 20 1 1 A 80 80 PHE N N 434 118.611 124.259 -5.648 1
1 50 . 20 1 1 A 80 80 PHE H H 434 8.191 8.032 0.159 1
1 51 . 20 1 1 A 80 80 PHE HA H 434 4.528 4.781 -0.253 1
1 54 . 20 1 1 A 80 80 PHE C C 434 172.457 176.078 -3.621 1
1 55 . 20 1 1 A 80 80 PHE CA C 434 54.828 56.748 -1.920 1
1 56 . 20 1 1 A 80 80 PHE CB C 434 36.457 37.736 -1.279 1
1 57 . 20 1 1 A 80 80 PHE N N 434 118.871 124.259 -5.388 1
1 931 . 20 1 1 A 80 80 PHE H H 434 8.191 8.032 0.159 1
1 932 . 20 1 1 A 80 80 PHE HA H 434 4.463 4.781 -0.318 1
1 939 . 20 1 1 A 80 80 PHE C C 434 172.283 176.078 -3.795 1
1 940 . 20 1 1 A 80 80 PHE CA C 434 54.971 56.748 -1.777 1
1 941 . 20 1 1 A 80 80 PHE CB C 434 36.490 37.736 -1.246 1
1 944 . 20 1 1 A 80 80 PHE N N 434 119.263 124.259 -4.996 1
1 17 . 20 1 1 A 81 81 ASP H H 435 7.490 8.376 -0.886 1
1 18 . 20 1 1 A 81 81 ASP HA H 435 4.698 4.278 0.420 1
1 19 . 20 1 1 A 81 81 ASP C C 435 171.662 174.854 -3.192 1
1 20 . 20 1 1 A 81 81 ASP CA C 435 49.570 54.955 -5.385 1
1 21 . 20 1 1 A 81 81 ASP CB C 435 40.104 39.507 0.597 1
1 22 . 20 1 1 A 81 81 ASP N N 435 120.304 122.502 -2.198 1
1 58 . 20 1 1 A 81 81 ASP H H 435 7.881 8.376 -0.495 1
1 59 . 20 1 1 A 81 81 ASP HA H 435 4.801 4.278 0.523 1
1 60 . 20 1 1 A 81 81 ASP C C 435 171.144 174.854 -3.710 1
1 61 . 20 1 1 A 81 81 ASP CA C 435 49.406 54.955 -5.549 1
1 62 . 20 1 1 A 81 81 ASP CB C 435 38.618 39.507 -0.889 1
1 63 . 20 1 1 A 81 81 ASP N N 435 123.108 122.502 0.606 1
1 945 . 20 1 1 A 81 81 ASP H H 435 7.823 8.376 -0.553 1
1 946 . 20 1 1 A 81 81 ASP HA H 435 4.759 4.278 0.481 1
1 949 . 20 1 1 A 81 81 ASP C C 435 171.057 174.854 -3.797 1
1 950 . 20 1 1 A 81 81 ASP CA C 435 49.174 54.955 -5.781 1
1 951 . 20 1 1 A 81 81 ASP CB C 435 38.725 39.507 -0.782 1
1 952 . 20 1 1 A 81 81 ASP N N 435 123.530 122.502 1.028 1
1 23 . 20 1 1 A 82 82 PRO HA H 436 4.758 4.680 0.078 1
1 24 . 20 1 1 A 82 82 PRO C C 436 172.944 176.137 -3.193 1
1 25 . 20 1 1 A 82 82 PRO CA C 436 60.134 62.936 -2.802 1
1 26 . 20 1 1 A 82 82 PRO CB C 436 31.425 32.750 -1.325 1
1 64 . 20 1 1 A 82 82 PRO HA H 436 4.364 4.680 -0.316 1
1 67 . 20 1 1 A 82 82 PRO C C 436 173.563 176.137 -2.574 1
1 68 . 20 1 1 A 82 82 PRO CA C 436 60.729 62.936 -2.207 1
1 69 . 20 1 1 A 82 82 PRO CB C 436 29.160 32.750 -3.590 1
1 953 . 20 1 1 A 82 82 PRO HA H 436 4.296 4.680 -0.384 1
1 960 . 20 1 1 A 82 82 PRO C C 436 173.494 176.137 -2.643 1
1 961 . 20 1 1 A 82 82 PRO CA C 436 60.625 62.936 -2.311 1
1 962 . 20 1 1 A 82 82 PRO CB C 436 29.237 32.750 -3.513 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 93 2.793 1
2 1 1 1 "RMS(OBS, PRED)" CA 94 2.995 1
3 1 1 1 "RMS(OBS, PRED)" CB 87 2.879 1
4 1 1 1 "RMS(OBS, PRED)" H 82 0.604 1
5 1 1 1 "RMS(OBS, PRED)" HA 98 0.387 1
6 1 1 1 "RMS(OBS, PRED)" N 82 3.205 1
7 1 2 1 "RMS(OBS, PRED)" C 93 2.794 1
8 1 2 1 "RMS(OBS, PRED)" CA 94 2.997 1
9 1 2 1 "RMS(OBS, PRED)" CB 87 2.659 1
10 1 2 1 "RMS(OBS, PRED)" H 82 0.560 1
11 1 2 1 "RMS(OBS, PRED)" HA 98 0.326 1
12 1 2 1 "RMS(OBS, PRED)" N 82 2.986 1
13 1 3 1 "RMS(OBS, PRED)" C 93 3.046 1
14 1 3 1 "RMS(OBS, PRED)" CA 94 3.111 1
15 1 3 1 "RMS(OBS, PRED)" CB 87 2.746 1
16 1 3 1 "RMS(OBS, PRED)" H 82 0.556 1
17 1 3 1 "RMS(OBS, PRED)" HA 98 0.364 1
18 1 3 1 "RMS(OBS, PRED)" N 82 3.005 1
19 1 4 1 "RMS(OBS, PRED)" C 93 2.909 1
20 1 4 1 "RMS(OBS, PRED)" CA 94 3.004 1
21 1 4 1 "RMS(OBS, PRED)" CB 87 2.935 1
22 1 4 1 "RMS(OBS, PRED)" H 82 0.494 1
23 1 4 1 "RMS(OBS, PRED)" HA 98 0.365 1
24 1 4 1 "RMS(OBS, PRED)" N 82 3.044 1
25 1 5 1 "RMS(OBS, PRED)" C 93 2.679 1
26 1 5 1 "RMS(OBS, PRED)" CA 94 2.837 1
27 1 5 1 "RMS(OBS, PRED)" CB 87 2.824 1
28 1 5 1 "RMS(OBS, PRED)" H 82 0.556 1
29 1 5 1 "RMS(OBS, PRED)" HA 98 0.374 1
30 1 5 1 "RMS(OBS, PRED)" N 82 3.168 1
31 1 6 1 "RMS(OBS, PRED)" C 93 2.801 1
32 1 6 1 "RMS(OBS, PRED)" CA 94 2.891 1
33 1 6 1 "RMS(OBS, PRED)" CB 87 2.840 1
34 1 6 1 "RMS(OBS, PRED)" H 82 0.511 1
35 1 6 1 "RMS(OBS, PRED)" HA 98 0.326 1
36 1 6 1 "RMS(OBS, PRED)" N 82 3.028 1
37 1 7 1 "RMS(OBS, PRED)" C 93 2.923 1
38 1 7 1 "RMS(OBS, PRED)" CA 94 2.935 1
39 1 7 1 "RMS(OBS, PRED)" CB 87 2.792 1
40 1 7 1 "RMS(OBS, PRED)" H 82 0.522 1
41 1 7 1 "RMS(OBS, PRED)" HA 98 0.332 1
42 1 7 1 "RMS(OBS, PRED)" N 82 3.448 1
43 1 8 1 "RMS(OBS, PRED)" C 93 2.792 1
44 1 8 1 "RMS(OBS, PRED)" CA 94 3.128 1
45 1 8 1 "RMS(OBS, PRED)" CB 87 2.539 1
46 1 8 1 "RMS(OBS, PRED)" H 82 0.551 1
47 1 8 1 "RMS(OBS, PRED)" HA 98 0.361 1
48 1 8 1 "RMS(OBS, PRED)" N 82 3.313 1
49 1 9 1 "RMS(OBS, PRED)" C 93 2.889 1
50 1 9 1 "RMS(OBS, PRED)" CA 94 3.043 1
51 1 9 1 "RMS(OBS, PRED)" CB 87 2.803 1
52 1 9 1 "RMS(OBS, PRED)" H 82 0.564 1
53 1 9 1 "RMS(OBS, PRED)" HA 98 0.347 1
54 1 9 1 "RMS(OBS, PRED)" N 82 2.714 1
55 1 10 1 "RMS(OBS, PRED)" C 93 2.811 1
56 1 10 1 "RMS(OBS, PRED)" CA 94 3.087 1
57 1 10 1 "RMS(OBS, PRED)" CB 87 2.936 1
58 1 10 1 "RMS(OBS, PRED)" H 82 0.562 1
59 1 10 1 "RMS(OBS, PRED)" HA 98 0.413 1
60 1 10 1 "RMS(OBS, PRED)" N 82 3.427 1
61 1 11 1 "RMS(OBS, PRED)" C 93 2.846 1
62 1 11 1 "RMS(OBS, PRED)" CA 94 2.822 1
63 1 11 1 "RMS(OBS, PRED)" CB 87 2.834 1
64 1 11 1 "RMS(OBS, PRED)" H 82 0.590 1
65 1 11 1 "RMS(OBS, PRED)" HA 98 0.372 1
66 1 11 1 "RMS(OBS, PRED)" N 82 2.985 1
67 1 12 1 "RMS(OBS, PRED)" C 93 2.732 1
68 1 12 1 "RMS(OBS, PRED)" CA 94 3.097 1
69 1 12 1 "RMS(OBS, PRED)" CB 87 2.986 1
70 1 12 1 "RMS(OBS, PRED)" H 82 0.526 1
71 1 12 1 "RMS(OBS, PRED)" HA 98 0.410 1
72 1 12 1 "RMS(OBS, PRED)" N 82 3.439 1
73 1 13 1 "RMS(OBS, PRED)" C 93 2.808 1
74 1 13 1 "RMS(OBS, PRED)" CA 94 2.997 1
75 1 13 1 "RMS(OBS, PRED)" CB 87 2.526 1
76 1 13 1 "RMS(OBS, PRED)" H 82 0.549 1
77 1 13 1 "RMS(OBS, PRED)" HA 98 0.360 1
78 1 13 1 "RMS(OBS, PRED)" N 82 3.104 1
79 1 14 1 "RMS(OBS, PRED)" C 93 2.704 1
80 1 14 1 "RMS(OBS, PRED)" CA 94 2.933 1
81 1 14 1 "RMS(OBS, PRED)" CB 87 2.799 1
82 1 14 1 "RMS(OBS, PRED)" H 82 0.563 1
83 1 14 1 "RMS(OBS, PRED)" HA 98 0.322 1
84 1 14 1 "RMS(OBS, PRED)" N 82 3.111 1
85 1 15 1 "RMS(OBS, PRED)" C 93 2.823 1
86 1 15 1 "RMS(OBS, PRED)" CA 94 2.965 1
87 1 15 1 "RMS(OBS, PRED)" CB 87 2.633 1
88 1 15 1 "RMS(OBS, PRED)" H 82 0.547 1
89 1 15 1 "RMS(OBS, PRED)" HA 98 0.358 1
90 1 15 1 "RMS(OBS, PRED)" N 82 2.938 1
91 1 16 1 "RMS(OBS, PRED)" C 93 2.769 1
92 1 16 1 "RMS(OBS, PRED)" CA 94 3.088 1
93 1 16 1 "RMS(OBS, PRED)" CB 87 2.837 1
94 1 16 1 "RMS(OBS, PRED)" H 82 0.560 1
95 1 16 1 "RMS(OBS, PRED)" HA 98 0.358 1
96 1 16 1 "RMS(OBS, PRED)" N 82 3.369 1
97 1 17 1 "RMS(OBS, PRED)" C 93 2.755 1
98 1 17 1 "RMS(OBS, PRED)" CA 94 2.802 1
99 1 17 1 "RMS(OBS, PRED)" CB 87 2.866 1
100 1 17 1 "RMS(OBS, PRED)" H 82 0.531 1
101 1 17 1 "RMS(OBS, PRED)" HA 98 0.389 1
102 1 17 1 "RMS(OBS, PRED)" N 82 3.149 1
103 1 18 1 "RMS(OBS, PRED)" C 93 2.710 1
104 1 18 1 "RMS(OBS, PRED)" CA 94 2.948 1
105 1 18 1 "RMS(OBS, PRED)" CB 87 2.994 1
106 1 18 1 "RMS(OBS, PRED)" H 82 0.630 1
107 1 18 1 "RMS(OBS, PRED)" HA 98 0.418 1
108 1 18 1 "RMS(OBS, PRED)" N 82 3.161 1
109 1 19 1 "RMS(OBS, PRED)" C 93 2.762 1
110 1 19 1 "RMS(OBS, PRED)" CA 94 2.831 1
111 1 19 1 "RMS(OBS, PRED)" CB 87 3.159 1
112 1 19 1 "RMS(OBS, PRED)" H 82 0.573 1
113 1 19 1 "RMS(OBS, PRED)" HA 98 0.408 1
114 1 19 1 "RMS(OBS, PRED)" N 82 3.283 1
115 1 20 1 "RMS(OBS, PRED)" C 93 2.796 1
116 1 20 1 "RMS(OBS, PRED)" CA 94 2.800 1
117 1 20 1 "RMS(OBS, PRED)" CB 87 2.617 1
118 1 20 1 "RMS(OBS, PRED)" H 82 0.549 1
119 1 20 1 "RMS(OBS, PRED)" HA 98 0.323 1
120 1 20 1 "RMS(OBS, PRED)" N 82 2.972 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 3 3 LEU HA H 357 4.257 4.243 0.014 2
1 11 . 1 1 A 3 3 LEU C C 357 174.994 176.979 -1.985 2
1 12 . 1 1 A 3 3 LEU CA C 357 53.329 56.697 -3.369 2
1 13 . 1 1 A 3 3 LEU CB C 357 39.382 42.554 -3.172 2
1 17 . 1 1 A 4 4 GLN H H 358 8.234 7.732 0.502 2
1 18 . 1 1 A 4 4 GLN HA H 358 4.211 4.439 -0.228 2
1 25 . 1 1 A 4 4 GLN C C 358 173.357 174.931 -1.574 2
1 26 . 1 1 A 4 4 GLN CA C 358 53.791 55.842 -2.051 2
1 27 . 1 1 A 4 4 GLN CB C 358 26.456 29.848 -3.392 2
1 29 . 1 1 A 4 4 GLN N N 358 119.506 116.672 2.834 2
1 31 . 1 1 A 5 5 ASP H H 359 8.090 8.535 -0.445 2
1 32 . 1 1 A 5 5 ASP HA H 359 4.458 4.773 -0.315 2
1 35 . 1 1 A 5 5 ASP C C 359 173.492 175.443 -1.951 2
1 36 . 1 1 A 5 5 ASP CA C 359 52.309 54.409 -2.100 2
1 37 . 1 1 A 5 5 ASP CB C 359 38.312 41.894 -3.582 2
1 38 . 1 1 A 5 5 ASP N N 359 120.683 121.486 -0.803 2
1 39 . 1 1 A 6 6 HIS H H 360 8.103 8.349 -0.246 2
1 40 . 1 1 A 6 6 HIS HA H 360 4.540 4.689 -0.149 2
1 45 . 1 1 A 6 6 HIS C C 360 172.801 174.568 -1.767 2
1 46 . 1 1 A 6 6 HIS CA C 360 53.874 55.982 -2.108 2
1 47 . 1 1 A 6 6 HIS CB C 360 27.878 30.168 -2.290 2
1 50 . 1 1 A 6 6 HIS N N 360 118.844 118.381 0.463 2
1 51 . 1 1 A 7 7 ILE H H 361 7.862 8.403 -0.541 2
1 52 . 1 1 A 7 7 ILE HA H 361 4.010 4.299 -0.289 2
1 62 . 1 1 A 7 7 ILE C C 361 173.268 175.448 -2.180 2
1 63 . 1 1 A 7 7 ILE CA C 361 58.740 61.049 -2.309 2
1 64 . 1 1 A 7 7 ILE CB C 361 35.788 38.737 -2.949 2
1 68 . 1 1 A 7 7 ILE N N 361 121.598 121.535 0.062 2
1 69 . 1 1 A 8 8 LYS H H 362 8.231 8.369 -0.138 2
1 70 . 1 1 A 8 8 LYS HA H 362 4.313 4.554 -0.241 2
1 79 . 1 1 A 8 8 LYS C C 362 173.899 175.482 -1.584 2
1 80 . 1 1 A 8 8 LYS CA C 362 53.677 55.988 -2.311 2
1 81 . 1 1 A 8 8 LYS CB C 362 30.355 34.138 -3.783 2
1 85 . 1 1 A 8 8 LYS N N 362 124.980 123.594 1.386 2
1 86 . 1 1 A 9 9 VAL H H 363 8.044 8.412 -0.368 2
1 87 . 1 1 A 9 9 VAL HA H 363 4.089 4.440 -0.351 2
1 95 . 1 1 A 9 9 VAL C C 363 173.760 175.428 -1.668 2
1 96 . 1 1 A 9 9 VAL CA C 363 59.814 61.322 -1.508 2
1 97 . 1 1 A 9 9 VAL CB C 363 30.058 32.969 -2.911 2
1 100 . 1 1 A 9 9 VAL N N 363 121.366 121.680 -0.314 2
1 101 . 1 1 A 10 10 THR H H 364 8.076 8.583 -0.507 2
1 102 . 1 1 A 10 10 THR HA H 364 4.302 4.356 -0.054 2
1 107 . 1 1 A 10 10 THR C C 364 172.135 175.715 -3.580 2
1 108 . 1 1 A 10 10 THR CA C 364 59.134 63.692 -4.558 2
1 109 . 1 1 A 10 10 THR CB C 364 67.415 69.962 -2.547 2
1 111 . 1 1 A 10 10 THR N N 364 116.817 119.398 -2.581 2
1 112 . 1 1 A 11 11 GLN H H 365 8.463 8.297 0.166 2
1 113 . 1 1 A 11 11 GLN HA H 365 4.046 4.272 -0.226 2
1 120 . 1 1 A 11 11 GLN C C 365 173.944 176.236 -2.292 2
1 121 . 1 1 A 11 11 GLN CA C 365 54.517 57.551 -3.034 2
1 122 . 1 1 A 11 11 GLN CB C 365 26.250 29.393 -3.143 2
1 124 . 1 1 A 11 11 GLN N N 365 122.059 119.563 2.496 2
1 126 . 1 1 A 12 12 GLU H H 366 8.449 7.978 0.471 2
1 127 . 1 1 A 12 12 GLU HA H 366 4.093 4.447 -0.354 2
1 132 . 1 1 A 12 12 GLU C C 366 174.746 176.901 -2.155 2
1 133 . 1 1 A 12 12 GLU CA C 366 55.235 56.613 -1.378 2
1 134 . 1 1 A 12 12 GLU CB C 366 27.180 30.782 -3.602 2
1 136 . 1 1 A 12 12 GLU N N 366 120.415 117.888 2.527 2
1 137 . 1 1 A 13 13 GLN H H 367 8.031 8.403 -0.372 2
1 138 . 1 1 A 13 13 GLN HA H 367 4.113 4.126 -0.013 2
1 145 . 1 1 A 13 13 GLN C C 367 173.693 176.558 -2.865 2
1 146 . 1 1 A 13 13 GLN CA C 367 54.132 57.448 -3.316 2
1 147 . 1 1 A 13 13 GLN CB C 367 26.420 28.499 -2.079 2
1 149 . 1 1 A 13 13 GLN N N 367 119.721 121.334 -1.613 2
1 151 . 1 1 A 14 14 TYR H H 368 8.111 7.920 0.191 2
1 152 . 1 1 A 14 14 TYR HA H 368 4.339 4.642 -0.303 2
1 159 . 1 1 A 14 14 TYR C C 368 173.916 176.840 -2.924 2
1 160 . 1 1 A 14 14 TYR CA C 368 56.572 58.693 -2.120 2
1 161 . 1 1 A 14 14 TYR CB C 368 35.879 38.035 -2.156 2
1 164 . 1 1 A 14 14 TYR N N 368 120.541 118.223 2.318 2
1 165 . 1 1 A 15 15 GLU H H 369 8.287 8.263 0.024 2
1 166 . 1 1 A 15 15 GLU HA H 369 4.009 4.278 -0.269 2
1 171 . 1 1 A 15 15 GLU C C 369 174.448 178.060 -3.612 2
1 172 . 1 1 A 15 15 GLU CA C 369 55.047 58.978 -3.931 2
1 173 . 1 1 A 15 15 GLU CB C 369 27.226 29.512 -2.286 2
1 175 . 1 1 A 15 15 GLU N N 369 120.398 121.843 -1.445 2
1 176 . 1 1 A 16 16 LEU H H 370 7.785 7.812 -0.027 2
1 177 . 1 1 A 16 16 LEU HA H 370 4.138 4.247 -0.109 2
1 187 . 1 1 A 16 16 LEU C C 370 175.089 177.710 -2.621 2
1 188 . 1 1 A 16 16 LEU CA C 370 53.425 55.607 -2.182 2
1 189 . 1 1 A 16 16 LEU CB C 370 39.554 41.278 -1.724 2
1 193 . 1 1 A 16 16 LEU N N 370 121.323 117.641 3.682 2
1 194 . 1 1 A 17 17 TYR H H 371 8.038 8.051 -0.013 2
1 195 . 1 1 A 17 17 TYR HA H 371 4.380 4.469 -0.089 2
1 202 . 1 1 A 17 17 TYR C C 371 173.931 176.323 -2.392 2
1 203 . 1 1 A 17 17 TYR CA C 371 56.143 59.403 -3.260 2
1 204 . 1 1 A 17 17 TYR CB C 371 35.501 37.931 -2.430 2
1 207 . 1 1 A 17 17 TYR N N 371 119.465 119.432 0.033 2
1 208 . 1 1 A 18 18 CYS H H 372 8.021 7.362 0.659 2
1 209 . 1 1 A 18 18 CYS HA H 372 4.236 4.179 0.057 2
1 212 . 1 1 A 18 18 CYS C C 372 172.457 174.567 -2.110 2
1 213 . 1 1 A 18 18 CYS CA C 372 56.997 59.534 -2.537 2
1 214 . 1 1 A 18 18 CYS CB C 372 25.080 27.880 -2.800 2
1 215 . 1 1 A 18 18 CYS N N 372 119.913 118.713 1.200 2
1 216 . 1 1 A 19 19 GLU H H 373 8.151 8.326 -0.175 2
1 217 . 1 1 A 19 19 GLU HA H 373 4.130 4.477 -0.347 2
1 222 . 1 1 A 19 19 GLU C C 373 174.151 176.213 -2.062 2
1 223 . 1 1 A 19 19 GLU CA C 373 54.535 56.630 -2.095 2
1 224 . 1 1 A 19 19 GLU CB C 373 27.244 31.007 -3.763 2
1 226 . 1 1 A 19 19 GLU N N 373 122.431 122.251 0.180 2
1 227 . 1 1 A 20 20 MET H H 374 8.109 8.358 -0.249 2
1 228 . 1 1 A 20 20 MET HA H 374 4.352 4.502 -0.150 2
1 236 . 1 1 A 20 20 MET C C 374 174.200 176.052 -1.852 2
1 237 . 1 1 A 20 20 MET CA C 374 53.238 56.059 -2.821 2
1 238 . 1 1 A 20 20 MET CB C 374 30.237 33.028 -2.791 2
1 241 . 1 1 A 20 20 MET N N 374 119.754 120.028 -0.274 2
1 242 . 1 1 A 21 21 GLY H H 375 8.231 8.445 -0.214 2
1 243 . 1 1 A 21 21 GLY HA2 H 375 3.861 4.035 -0.174 2
1 244 . 1 1 A 21 21 GLY HA3 H 375 3.960 4.053 -0.093 2
1 245 . 1 1 A 21 21 GLY C C 375 171.928 173.311 -1.383 2
1 246 . 1 1 A 21 21 GLY CA C 375 42.930 45.479 -2.549 2
1 247 . 1 1 A 21 21 GLY N N 375 109.484 110.185 -0.701 2
1 248 . 1 1 A 22 22 SER HA H 376 4.492 4.844 -0.352 2
1 251 . 1 1 A 22 22 SER C C 376 172.206 173.605 -1.399 2
1 252 . 1 1 A 22 22 SER CA C 376 55.570 57.855 -2.285 2
1 253 . 1 1 A 22 22 SER CB C 376 61.525 64.314 -2.789 2
1 254 . 1 1 A 23 23 THR H H 377 8.470 8.803 -0.333 2
1 255 . 1 1 A 23 23 THR HA H 377 4.295 4.492 -0.197 2
1 260 . 1 1 A 23 23 THR C C 377 171.811 174.714 -2.903 2
1 261 . 1 1 A 23 23 THR CA C 377 58.937 62.507 -3.570 2
1 262 . 1 1 A 23 23 THR CB C 377 67.250 68.980 -1.730 2
1 264 . 1 1 A 23 23 THR N N 377 124.043 120.995 3.048 2
1 265 . 1 1 A 24 24 PHE H H 378 8.374 8.912 -0.538 2
1 266 . 1 1 A 24 24 PHE HA H 378 4.239 4.402 -0.163 2
1 273 . 1 1 A 24 24 PHE C C 378 173.411 176.995 -3.584 2
1 274 . 1 1 A 24 24 PHE CA C 378 56.697 59.837 -3.140 2
1 275 . 1 1 A 24 24 PHE CB C 378 36.538 39.861 -3.323 2
1 278 . 1 1 A 24 24 PHE N N 378 124.732 126.733 -2.001 2
1 279 . 1 1 A 25 25 GLN H H 379 8.457 8.023 0.434 2
1 280 . 1 1 A 25 25 GLN HA H 379 4.038 4.116 -0.078 2
1 287 . 1 1 A 25 25 GLN C C 379 172.431 175.995 -3.564 2
1 288 . 1 1 A 25 25 GLN CA C 379 54.078 57.377 -3.298 2
1 289 . 1 1 A 25 25 GLN CB C 379 26.414 28.870 -2.456 2
1 291 . 1 1 A 25 25 GLN N N 379 118.820 118.612 0.208 2
1 293 . 1 1 A 26 26 LEU H H 380 6.985 7.597 -0.612 2
1 294 . 1 1 A 26 26 LEU HA H 380 4.229 4.360 -0.131 2
1 304 . 1 1 A 26 26 LEU C C 380 173.895 176.362 -2.467 2
1 305 . 1 1 A 26 26 LEU CA C 380 52.123 54.667 -2.544 2
1 306 . 1 1 A 26 26 LEU CB C 380 40.543 42.715 -2.172 2
1 310 . 1 1 A 26 26 LEU N N 380 119.079 120.706 -1.627 2
1 311 . 1 1 A 27 27 CYS H H 381 8.905 9.127 -0.222 2
1 312 . 1 1 A 27 27 CYS HA H 381 4.013 4.547 -0.534 2
1 315 . 1 1 A 27 27 CYS C C 381 174.439 176.103 -1.664 2
1 316 . 1 1 A 27 27 CYS CA C 381 57.847 59.252 -1.405 2
1 317 . 1 1 A 27 27 CYS CB C 381 28.648 28.454 0.194 2
1 318 . 1 1 A 27 27 CYS N N 381 125.151 122.905 2.246 2
1 319 . 1 1 A 28 28 LYS H H 382 9.351 8.895 0.456 2
1 320 . 1 1 A 28 28 LYS HA H 382 4.157 4.065 0.092 2
1 329 . 1 1 A 28 28 LYS C C 382 174.678 178.313 -3.635 2
1 330 . 1 1 A 28 28 LYS CA C 382 54.324 58.719 -4.395 2
1 331 . 1 1 A 28 28 LYS CB C 382 30.086 32.460 -2.374 2
1 335 . 1 1 A 28 28 LYS N N 382 128.840 128.201 0.639 2
1 336 . 1 1 A 29 29 ILE H H 383 9.040 7.890 1.150 2
1 337 . 1 1 A 29 29 ILE HA H 383 3.804 3.665 0.139 2
1 347 . 1 1 A 29 29 ILE C C 383 174.239 177.405 -3.166 2
1 348 . 1 1 A 29 29 ILE CA C 383 62.114 64.613 -2.499 2
1 349 . 1 1 A 29 29 ILE CB C 383 33.870 38.180 -4.310 2
1 353 . 1 1 A 29 29 ILE N N 383 122.718 119.127 3.591 2
1 354 . 1 1 A 30 30 CYS H H 384 7.572 7.617 -0.045 2
1 355 . 1 1 A 30 30 CYS HA H 384 4.548 4.460 0.088 2
1 358 . 1 1 A 30 30 CYS C C 384 172.978 175.276 -2.298 2
1 359 . 1 1 A 30 30 CYS CA C 384 54.957 59.539 -4.582 2
1 360 . 1 1 A 30 30 CYS CB C 384 29.778 29.571 0.207 2
1 361 . 1 1 A 30 30 CYS N N 384 116.356 115.926 0.430 2
1 362 . 1 1 A 31 31 ALA H H 385 8.205 8.473 -0.268 2
1 363 . 1 1 A 31 31 ALA HA H 385 4.107 4.170 -0.063 2
1 367 . 1 1 A 31 31 ALA C C 385 173.139 177.141 -4.001 2
1 368 . 1 1 A 31 31 ALA CA C 385 50.802 53.744 -2.942 2
1 369 . 1 1 A 31 31 ALA CB C 385 14.634 17.789 -3.155 2
1 370 . 1 1 A 31 31 ALA N N 385 125.526 121.023 4.503 2
1 371 . 1 1 A 32 32 GLU H H 386 8.416 8.096 0.320 2
1 372 . 1 1 A 32 32 GLU HA H 386 4.467 4.478 -0.011 2
1 377 . 1 1 A 32 32 GLU C C 386 172.325 176.323 -3.998 2
1 378 . 1 1 A 32 32 GLU CA C 386 55.146 57.506 -2.360 2
1 379 . 1 1 A 32 32 GLU CB C 386 31.181 31.645 -0.464 2
1 381 . 1 1 A 32 32 GLU N N 386 117.579 115.895 1.684 2
1 382 . 1 1 A 33 33 ASN H H 387 7.872 7.832 0.040 2
1 383 . 1 1 A 33 33 ASN HA H 387 4.900 4.964 -0.064 2
1 388 . 1 1 A 33 33 ASN C C 387 171.355 174.690 -3.335 2
1 389 . 1 1 A 33 33 ASN CA C 387 49.320 52.190 -2.870 2
1 390 . 1 1 A 33 33 ASN CB C 387 38.457 39.872 -1.415 2
1 391 . 1 1 A 33 33 ASN N N 387 120.399 117.040 3.359 2
1 393 . 1 1 A 34 34 ASP H H 388 8.565 8.594 -0.029 2
1 394 . 1 1 A 34 34 ASP HA H 388 4.679 4.907 -0.228 2
1 397 . 1 1 A 34 34 ASP C C 388 174.243 175.975 -1.732 2
1 398 . 1 1 A 34 34 ASP CA C 388 51.809 53.445 -1.636 2
1 399 . 1 1 A 34 34 ASP CB C 388 38.007 42.222 -4.215 2
1 400 . 1 1 A 34 34 ASP N N 388 120.661 120.756 -0.095 2
1 401 . 1 1 A 35 35 LYS H H 389 8.544 8.860 -0.316 2
1 402 . 1 1 A 35 35 LYS HA H 389 3.411 4.325 -0.914 2
1 409 . 1 1 A 35 35 LYS C C 389 172.938 176.528 -3.590 2
1 410 . 1 1 A 35 35 LYS CA C 389 54.973 56.058 -1.085 2
1 411 . 1 1 A 35 35 LYS CB C 389 30.617 31.916 -1.299 2
1 415 . 1 1 A 35 35 LYS N N 389 119.199 120.920 -1.721 2
1 416 . 1 1 A 36 36 ASP H H 390 8.327 8.811 -0.484 2
1 417 . 1 1 A 36 36 ASP HA H 390 4.724 4.823 -0.099 2
1 420 . 1 1 A 36 36 ASP C C 390 172.860 175.392 -2.532 2
1 421 . 1 1 A 36 36 ASP CA C 390 51.609 54.159 -2.550 2
1 422 . 1 1 A 36 36 ASP CB C 390 39.018 42.013 -2.995 2
1 423 . 1 1 A 36 36 ASP N N 390 119.134 122.831 -3.697 2
1 424 . 1 1 A 37 37 VAL H H 391 8.544 7.921 0.623 2
1 425 . 1 1 A 37 37 VAL HA H 391 4.877 4.790 0.087 2
1 433 . 1 1 A 37 37 VAL C C 391 167.519 173.292 -5.773 2
1 434 . 1 1 A 37 37 VAL CA C 391 58.259 59.947 -1.688 2
1 435 . 1 1 A 37 37 VAL CB C 391 32.277 35.263 -2.986 2
1 438 . 1 1 A 37 37 VAL N N 391 121.970 118.672 3.298 2
1 439 . 1 1 A 38 38 LYS H H 392 8.621 9.578 -0.957 2
1 440 . 1 1 A 38 38 LYS HA H 392 4.991 5.233 -0.242 2
1 449 . 1 1 A 38 38 LYS C C 392 172.681 175.233 -2.552 2
1 450 . 1 1 A 38 38 LYS CA C 392 51.123 54.660 -3.537 2
1 451 . 1 1 A 38 38 LYS CB C 392 33.697 34.753 -1.056 2
1 455 . 1 1 A 38 38 LYS N N 392 126.381 128.730 -2.349 2
1 456 . 1 1 A 39 39 ILE H H 393 8.723 8.957 -0.234 2
1 457 . 1 1 A 39 39 ILE HA H 393 4.239 4.370 -0.131 2
1 467 . 1 1 A 39 39 ILE C C 393 172.642 175.703 -3.061 2
1 468 . 1 1 A 39 39 ILE CA C 393 57.768 61.004 -3.236 2
1 469 . 1 1 A 39 39 ILE CB C 393 35.691 37.561 -1.870 2
1 473 . 1 1 A 39 39 ILE N N 393 126.398 127.767 -1.369 2
1 474 . 1 1 A 40 40 GLU H H 394 8.506 9.301 -0.795 2
1 475 . 1 1 A 40 40 GLU HA H 394 4.753 4.735 0.018 2
1 480 . 1 1 A 40 40 GLU C C 394 173.596 176.212 -2.616 2
1 481 . 1 1 A 40 40 GLU CA C 394 49.793 53.346 -3.553 2
1 482 . 1 1 A 40 40 GLU CB C 394 28.210 30.635 -2.425 2
1 484 . 1 1 A 40 40 GLU N N 394 124.864 127.976 -3.112 2
1 485 . 1 1 A 41 41 PRO HA H 395 4.864 4.501 0.363 2
1 492 . 1 1 A 41 41 PRO C C 395 175.073 177.088 -2.015 2
1 493 . 1 1 A 41 41 PRO CA C 395 61.111 63.884 -2.773 2
1 494 . 1 1 A 41 41 PRO CB C 395 32.275 32.951 -0.676 2
1 497 . 1 1 A 42 42 CYS H H 396 7.828 7.806 0.022 2
1 498 . 1 1 A 42 42 CYS HA H 396 4.208 4.075 0.133 2
1 501 . 1 1 A 42 42 CYS C C 396 173.877 175.067 -1.190 2
1 502 . 1 1 A 42 42 CYS CA C 396 58.021 61.246 -3.225 2
1 503 . 1 1 A 42 42 CYS CB C 396 28.242 27.547 0.695 2
1 504 . 1 1 A 42 42 CYS N N 396 122.434 118.011 4.423 2
1 505 . 1 1 A 43 43 GLY H H 397 8.679 8.766 -0.087 2
1 506 . 1 1 A 43 43 GLY HA2 H 397 3.507 3.925 -0.418 2
1 507 . 1 1 A 43 43 GLY HA3 H 397 3.914 3.931 -0.017 2
1 508 . 1 1 A 43 43 GLY C C 397 171.981 174.845 -2.864 2
1 509 . 1 1 A 43 43 GLY CA C 397 43.347 45.837 -2.490 2
1 510 . 1 1 A 43 43 GLY N N 397 112.123 108.498 3.625 2
1 511 . 1 1 A 44 44 HIS H H 398 8.329 7.587 0.742 2
1 512 . 1 1 A 44 44 HIS HA H 398 4.339 4.502 -0.163 2
1 517 . 1 1 A 44 44 HIS C C 398 170.742 174.713 -3.971 2
1 518 . 1 1 A 44 44 HIS CA C 398 58.368 56.214 2.154 2
1 519 . 1 1 A 44 44 HIS CB C 398 28.434 31.089 -2.655 2
1 522 . 1 1 A 44 44 HIS N N 398 121.393 117.792 3.601 2
1 523 . 1 1 A 45 45 LEU H H 399 8.241 8.776 -0.535 2
1 524 . 1 1 A 45 45 LEU HA H 399 5.570 5.242 0.328 2
1 534 . 1 1 A 45 45 LEU C C 399 174.464 175.436 -0.972 2
1 535 . 1 1 A 45 45 LEU CA C 399 50.729 53.466 -2.737 2
1 536 . 1 1 A 45 45 LEU CB C 399 43.574 44.288 -0.714 2
1 540 . 1 1 A 45 45 LEU N N 399 118.469 122.600 -4.131 2
1 541 . 1 1 A 46 46 MET H H 400 8.707 8.825 -0.119 2
1 542 . 1 1 A 46 46 MET HA H 400 4.842 5.025 -0.183 2
1 550 . 1 1 A 46 46 MET C C 400 170.736 174.287 -3.551 2
1 551 . 1 1 A 46 46 MET CA C 400 52.804 54.082 -1.278 2
1 552 . 1 1 A 46 46 MET CB C 400 31.945 35.306 -3.361 2
1 555 . 1 1 A 46 46 MET N N 400 114.897 120.418 -5.521 2
1 556 . 1 1 A 47 47 CYS H H 401 9.436 8.314 1.122 2
1 557 . 1 1 A 47 47 CYS HA H 401 5.629 5.086 0.543 2
1 560 . 1 1 A 47 47 CYS C C 401 173.909 176.116 -2.207 2
1 561 . 1 1 A 47 47 CYS CA C 401 54.325 56.981 -2.656 2
1 562 . 1 1 A 47 47 CYS CB C 401 30.725 29.578 1.147 2
1 563 . 1 1 A 47 47 CYS N N 401 119.575 119.118 0.457 2
1 564 . 1 1 A 48 48 THR H H 402 9.842 9.208 0.634 2
1 565 . 1 1 A 48 48 THR HA H 402 3.768 3.986 -0.218 2
1 570 . 1 1 A 48 48 THR C C 402 174.333 176.247 -1.914 2
1 571 . 1 1 A 48 48 THR CA C 402 64.516 65.921 -1.405 2
1 572 . 1 1 A 48 48 THR CB C 402 66.288 68.642 -2.354 2
1 574 . 1 1 A 48 48 THR N N 402 119.945 119.166 0.779 2
1 575 . 1 1 A 49 49 SER H H 403 8.355 8.082 0.273 2
1 576 . 1 1 A 49 49 SER HA H 403 4.222 4.075 0.147 2
1 579 . 1 1 A 49 49 SER C C 403 175.059 176.860 -1.801 2
1 580 . 1 1 A 49 49 SER CA C 403 59.828 61.905 -2.077 2
1 581 . 1 1 A 49 49 SER CB C 403 59.717 62.758 -3.041 2
1 582 . 1 1 A 49 49 SER N N 403 120.468 116.862 3.606 2
1 583 . 1 1 A 50 50 CYS H H 404 9.464 7.984 1.480 2
1 584 . 1 1 A 50 50 CYS HA H 404 3.922 4.184 -0.262 2
1 587 . 1 1 A 50 50 CYS C C 404 176.081 177.085 -1.004 2
1 588 . 1 1 A 50 50 CYS CA C 404 63.076 64.064 -0.988 2
1 589 . 1 1 A 50 50 CYS CB C 404 26.078 27.549 -1.471 2
1 590 . 1 1 A 50 50 CYS N N 404 126.744 119.527 7.217 2
1 591 . 1 1 A 51 51 LEU H H 405 7.948 8.130 -0.182 2
1 592 . 1 1 A 51 51 LEU HA H 405 4.064 4.177 -0.113 2
1 602 . 1 1 A 51 51 LEU C C 405 175.495 178.821 -3.326 2
1 603 . 1 1 A 51 51 LEU CA C 405 55.914 58.041 -2.127 2
1 604 . 1 1 A 51 51 LEU CB C 405 38.662 41.859 -3.197 2
1 607 . 1 1 A 51 51 LEU N N 405 121.951 122.769 -0.818 2
1 608 . 1 1 A 52 52 THR H H 406 8.786 8.565 0.221 2
1 609 . 1 1 A 52 52 THR HA H 406 4.024 3.939 0.085 2
1 614 . 1 1 A 52 52 THR C C 406 174.139 176.342 -2.203 2
1 615 . 1 1 A 52 52 THR CA C 406 64.017 66.393 -2.376 2
1 616 . 1 1 A 52 52 THR CB C 406 66.115 68.512 -2.397 2
1 618 . 1 1 A 52 52 THR N N 406 115.258 115.156 0.102 2
1 619 . 1 1 A 53 53 SER H H 407 8.115 7.995 0.120 2
1 620 . 1 1 A 53 53 SER HA H 407 4.204 4.167 0.037 2
1 623 . 1 1 A 53 53 SER C C 407 174.456 176.679 -2.223 2
1 624 . 1 1 A 53 53 SER CA C 407 59.090 61.747 -2.657 2
1 625 . 1 1 A 53 53 SER CB C 407 60.146 63.229 -3.083 2
1 626 . 1 1 A 53 53 SER N N 407 116.852 115.673 1.179 2
1 627 . 1 1 A 54 54 TRP H H 408 8.123 7.976 0.147 2
1 628 . 1 1 A 54 54 TRP HA H 408 4.371 4.266 0.105 2
1 637 . 1 1 A 54 54 TRP C C 408 175.981 178.646 -2.665 2
1 638 . 1 1 A 54 54 TRP CA C 408 57.323 60.894 -3.571 2
1 639 . 1 1 A 54 54 TRP CB C 408 26.812 29.589 -2.777 2
1 645 . 1 1 A 54 54 TRP N N 408 123.556 123.438 0.118 2
1 647 . 1 1 A 55 55 GLN H H 409 8.502 8.581 -0.079 2
1 648 . 1 1 A 55 55 GLN HA H 409 3.999 3.727 0.272 2
1 655 . 1 1 A 55 55 GLN C C 409 177.300 178.385 -1.085 2
1 656 . 1 1 A 55 55 GLN CA C 409 56.484 59.096 -2.612 2
1 657 . 1 1 A 55 55 GLN CB C 409 26.190 28.352 -2.163 2
1 659 . 1 1 A 55 55 GLN N N 409 118.044 118.270 -0.226 2
1 661 . 1 1 A 56 56 GLU H H 410 8.467 8.437 0.030 2
1 662 . 1 1 A 56 56 GLU HA H 410 4.057 4.081 -0.024 2
1 667 . 1 1 A 56 56 GLU C C 410 174.787 177.189 -2.402 2
1 668 . 1 1 A 56 56 GLU CA C 410 55.909 58.491 -2.582 2
1 669 . 1 1 A 56 56 GLU CB C 410 26.895 29.306 -2.411 2
1 671 . 1 1 A 56 56 GLU N N 410 119.448 118.898 0.550 2
1 672 . 1 1 A 57 57 SER H H 411 7.438 7.538 -0.100 2
1 673 . 1 1 A 57 57 SER HA H 411 4.607 4.531 0.076 2
1 676 . 1 1 A 57 57 SER C C 411 170.849 173.684 -2.835 2
1 677 . 1 1 A 57 57 SER CA C 411 55.540 57.699 -2.159 2
1 678 . 1 1 A 57 57 SER CB C 411 60.928 63.300 -2.372 2
1 679 . 1 1 A 57 57 SER N N 411 113.752 113.590 0.162 2
1 680 . 1 1 A 58 58 GLU H H 412 7.855 7.710 0.145 2
1 681 . 1 1 A 58 58 GLU HA H 412 3.772 3.958 -0.186 2
1 686 . 1 1 A 58 58 GLU C C 412 173.743 175.505 -1.762 2
1 687 . 1 1 A 58 58 GLU CA C 412 54.442 56.952 -2.510 2
1 688 . 1 1 A 58 58 GLU CB C 412 24.603 28.399 -3.796 2
1 690 . 1 1 A 58 58 GLU N N 412 115.908 118.268 -2.360 2
1 691 . 1 1 A 59 59 GLY H H 413 7.588 8.039 -0.451 2
1 692 . 1 1 A 59 59 GLY HA2 H 413 1.643 3.012 -1.369 2
1 693 . 1 1 A 59 59 GLY HA3 H 413 2.949 3.610 -0.661 2
1 694 . 1 1 A 59 59 GLY C C 413 170.850 173.253 -2.403 2
1 695 . 1 1 A 59 59 GLY CA C 413 41.724 45.220 -3.496 2
1 696 . 1 1 A 59 59 GLY N N 413 108.032 110.676 -2.644 2
1 697 . 1 1 A 60 60 GLN H H 414 7.973 8.330 -0.357 2
1 698 . 1 1 A 60 60 GLN HA H 414 4.366 4.599 -0.233 2
1 705 . 1 1 A 60 60 GLN C C 414 173.108 175.679 -2.571 2
1 706 . 1 1 A 60 60 GLN CA C 414 52.422 55.287 -2.865 2
1 707 . 1 1 A 60 60 GLN CB C 414 27.049 28.988 -1.939 2
1 709 . 1 1 A 60 60 GLN N N 414 122.690 123.134 -0.444 2
1 711 . 1 1 A 61 61 GLY H H 415 8.301 8.132 0.169 2
1 712 . 1 1 A 61 61 GLY HA2 H 415 3.700 4.208 -0.508 2
1 713 . 1 1 A 61 61 GLY HA3 H 415 3.920 4.239 -0.320 2
1 714 . 1 1 A 61 61 GLY C C 415 170.249 173.852 -3.603 2
1 715 . 1 1 A 61 61 GLY CA C 415 42.210 44.681 -2.471 2
1 716 . 1 1 A 61 61 GLY N N 415 110.794 112.085 -1.291 2
1 717 . 1 1 A 62 62 CYS H H 416 8.549 8.487 0.062 2
1 718 . 1 1 A 62 62 CYS HA H 416 4.227 4.670 -0.443 2
1 721 . 1 1 A 62 62 CYS C C 416 172.914 175.299 -2.385 2
1 722 . 1 1 A 62 62 CYS CA C 416 54.008 58.670 -4.662 2
1 723 . 1 1 A 62 62 CYS CB C 416 29.716 27.384 2.332 2
1 724 . 1 1 A 62 62 CYS N N 416 123.683 120.708 2.975 2
1 725 . 1 1 A 63 63 PRO HA H 417 2.611 2.817 -0.206 2
1 732 . 1 1 A 63 63 PRO C C 417 174.143 177.929 -3.786 2
1 733 . 1 1 A 63 63 PRO CA C 417 61.689 63.926 -2.237 2
1 734 . 1 1 A 63 63 PRO CB C 417 28.534 31.118 -2.584 2
1 737 . 1 1 A 64 64 PHE H H 418 8.968 7.795 1.173 2
1 738 . 1 1 A 64 64 PHE HA H 418 4.250 4.143 0.107 2
1 746 . 1 1 A 64 64 PHE C C 418 174.243 178.090 -3.847 2
1 747 . 1 1 A 64 64 PHE CA C 418 56.720 60.381 -3.661 2
1 748 . 1 1 A 64 64 PHE CB C 418 36.458 39.261 -2.803 2
1 752 . 1 1 A 64 64 PHE N N 418 117.008 115.773 1.235 2
1 753 . 1 1 A 65 65 CYS H H 419 7.968 7.999 -0.031 2
1 754 . 1 1 A 65 65 CYS HA H 419 4.906 4.490 0.416 2
1 757 . 1 1 A 65 65 CYS C C 419 173.198 174.814 -1.616 2
1 758 . 1 1 A 65 65 CYS CA C 419 55.870 59.845 -3.975 2
1 759 . 1 1 A 65 65 CYS CB C 419 30.559 28.868 1.691 2
1 760 . 1 1 A 65 65 CYS N N 419 117.505 117.181 0.324 2
1 761 . 1 1 A 66 66 ARG H H 420 8.761 8.045 0.716 2
1 762 . 1 1 A 66 66 ARG HA H 420 4.365 4.321 0.044 2
1 769 . 1 1 A 66 66 ARG C C 420 172.921 174.754 -1.833 2
1 770 . 1 1 A 66 66 ARG CA C 420 54.763 57.146 -2.383 2
1 771 . 1 1 A 66 66 ARG CB C 420 24.286 27.225 -2.939 2
1 774 . 1 1 A 66 66 ARG N N 420 118.763 116.319 2.444 2
1 775 . 1 1 A 67 67 CYS H H 421 8.223 7.837 0.386 2
1 776 . 1 1 A 67 67 CYS HA H 421 4.419 4.716 -0.297 2
1 779 . 1 1 A 67 67 CYS C C 421 171.160 174.462 -3.302 2
1 780 . 1 1 A 67 67 CYS CA C 421 57.119 57.784 -0.665 2
1 781 . 1 1 A 67 67 CYS CB C 421 25.911 29.953 -4.042 2
1 782 . 1 1 A 67 67 CYS N N 421 120.627 116.312 4.315 2
1 783 . 1 1 A 68 68 GLU H H 422 8.416 8.558 -0.142 2
1 784 . 1 1 A 68 68 GLU HA H 422 4.025 4.170 -0.145 2
1 789 . 1 1 A 68 68 GLU C C 422 173.764 176.320 -2.556 2
1 790 . 1 1 A 68 68 GLU CA C 422 54.752 57.575 -2.823 2
1 791 . 1 1 A 68 68 GLU CB C 422 27.302 29.784 -2.482 2
1 793 . 1 1 A 68 68 GLU N N 422 122.370 120.704 1.666 2
1 794 . 1 1 A 69 69 ILE H H 423 8.648 8.879 -0.231 2
1 795 . 1 1 A 69 69 ILE HA H 423 4.012 4.512 -0.500 2
1 805 . 1 1 A 69 69 ILE C C 423 174.257 175.520 -1.263 2
1 806 . 1 1 A 69 69 ILE CA C 423 59.740 60.683 -0.943 2
1 807 . 1 1 A 69 69 ILE CB C 423 35.846 38.898 -3.052 2
1 811 . 1 1 A 69 69 ILE N N 423 125.988 125.443 0.545 2
1 812 . 1 1 A 70 70 LYS H H 424 9.185 9.347 -0.162 2
1 813 . 1 1 A 70 70 LYS HA H 424 4.434 4.502 -0.068 2
1 822 . 1 1 A 70 70 LYS C C 424 173.880 176.604 -2.724 2
1 823 . 1 1 A 70 70 LYS CA C 424 53.378 57.008 -3.630 2
1 824 . 1 1 A 70 70 LYS CB C 424 30.397 34.515 -4.118 2
1 828 . 1 1 A 70 70 LYS N N 424 128.977 128.506 0.471 2
1 829 . 1 1 A 71 71 GLY H H 425 7.810 7.637 0.173 2
1 830 . 1 1 A 71 71 GLY HA2 H 425 4.094 4.066 0.028 2
1 831 . 1 1 A 71 71 GLY HA3 H 425 4.159 4.069 0.090 2
1 832 . 1 1 A 71 71 GLY C C 425 168.179 172.290 -4.111 2
1 833 . 1 1 A 71 71 GLY CA C 425 42.326 45.030 -2.704 2
1 834 . 1 1 A 71 71 GLY N N 425 107.696 105.363 2.333 2
1 835 . 1 1 A 72 72 THR H H 426 8.048 8.577 -0.529 2
1 836 . 1 1 A 72 72 THR HA H 426 5.258 5.496 -0.238 2
1 841 . 1 1 A 72 72 THR C C 426 170.979 172.879 -1.900 2
1 842 . 1 1 A 72 72 THR CA C 426 56.755 60.028 -3.273 2
1 843 . 1 1 A 72 72 THR CB C 426 69.226 71.686 -2.460 2
1 845 . 1 1 A 72 72 THR N N 426 109.122 111.087 -1.965 2
1 846 . 1 1 A 73 73 GLU H H 427 8.912 9.261 -0.348 2
1 847 . 1 1 A 73 73 GLU HA H 427 4.954 4.860 0.094 2
1 852 . 1 1 A 73 73 GLU C C 427 170.353 174.375 -4.022 2
1 853 . 1 1 A 73 73 GLU CA C 427 50.182 52.968 -2.786 2
1 854 . 1 1 A 73 73 GLU CB C 427 30.559 32.426 -1.867 2
1 856 . 1 1 A 73 73 GLU N N 427 121.703 122.957 -1.255 2
1 1 . 1 1 A 74 74 PRO HA H 428 4.372 4.900 -0.528 2
1 2 . 1 1 A 74 74 PRO C C 428 173.839 176.280 -2.441 2
1 3 . 1 1 A 74 74 PRO CA C 428 60.241 62.708 -2.467 2
1 4 . 1 1 A 74 74 PRO CB C 428 29.299 32.344 -3.045 2
1 7 . 1 1 A 75 75 ILE H H 429 8.144 8.749 -0.605 2
1 8 . 1 1 A 75 75 ILE HA H 429 4.086 4.584 -0.498 2
1 15 . 1 1 A 75 75 ILE C C 429 173.426 175.408 -1.982 2
1 16 . 1 1 A 75 75 ILE CA C 429 58.339 60.866 -2.527 2
1 17 . 1 1 A 75 75 ILE CB C 429 35.988 39.482 -3.494 2
1 21 . 1 1 A 75 75 ILE N N 429 121.551 121.415 0.136 2
1 1 . 1 1 A 76 76 VAL HA H 430 4.086 4.522 -0.436 2
1 2 . 1 1 A 76 76 VAL CA C 430 59.372 61.122 -1.750 2
1 22 . 1 1 A 76 76 VAL H H 430 8.221 8.619 -0.398 2
1 24 . 1 1 A 76 76 VAL C C 430 173.067 175.195 -2.128 2
1 26 . 1 1 A 76 76 VAL CB C 430 30.407 32.594 -2.188 2
1 27 . 1 1 A 76 76 VAL N N 430 125.930 123.391 2.539 2
1 4 . 1 1 A 77 77 VAL H H 431 8.204 8.538 -0.334 2
1 5 . 1 1 A 77 77 VAL HA H 431 4.049 4.677 -0.628 2
1 6 . 1 1 A 77 77 VAL C C 431 172.636 174.719 -2.083 2
1 7 . 1 1 A 77 77 VAL CA C 431 59.315 60.489 -1.174 2
1 8 . 1 1 A 77 77 VAL CB C 431 30.219 33.226 -3.007 2
1 9 . 1 1 A 77 77 VAL N N 431 125.320 122.113 3.207 2
1 43 . 1 1 A 78 78 ASP H H 432 8.419 8.265 0.154 2
1 44 . 1 1 A 78 78 ASP HA H 432 4.829 4.932 -0.103 2
1 45 . 1 1 A 78 78 ASP C C 432 172.252 174.904 -2.652 2
1 46 . 1 1 A 78 78 ASP CA C 432 49.320 51.516 -2.196 2
1 47 . 1 1 A 78 78 ASP CB C 432 39.066 41.804 -2.738 2
1 48 . 1 1 A 78 78 ASP N N 432 126.226 123.740 2.487 2
1 10 . 1 1 A 79 79 PRO CA C 433 63.865 63.232 0.633 2
1 49 . 1 1 A 79 79 PRO C C 433 173.867 177.008 -3.141 2
1 919 . 1 1 A 79 79 PRO HA H 433 4.237 4.592 -0.355 2
1 928 . 1 1 A 79 79 PRO CB C 433 29.329 30.433 -1.104 2
1 11 . 1 1 A 80 80 PHE H H 434 8.182 8.416 -0.234 2
1 12 . 1 1 A 80 80 PHE HA H 434 4.499 4.352 0.147 2
1 13 . 1 1 A 80 80 PHE C C 434 171.680 175.159 -3.479 2
1 14 . 1 1 A 80 80 PHE CA C 434 54.657 60.390 -5.733 2
1 15 . 1 1 A 80 80 PHE CB C 434 36.272 39.256 -2.984 2
1 16 . 1 1 A 80 80 PHE N N 434 118.611 122.126 -3.515 2
1 17 . 1 1 A 81 81 ASP H H 435 7.490 8.205 -0.715 2
1 18 . 1 1 A 81 81 ASP HA H 435 4.698 4.896 -0.198 2
1 19 . 1 1 A 81 81 ASP C C 435 171.662 174.844 -3.182 2
1 20 . 1 1 A 81 81 ASP CA C 435 49.570 51.828 -2.258 2
1 21 . 1 1 A 81 81 ASP CB C 435 40.104 41.334 -1.230 2
1 22 . 1 1 A 81 81 ASP N N 435 120.304 117.824 2.480 2
1 23 . 1 1 A 82 82 PRO HA H 436 4.758 4.655 0.103 2
1 24 . 1 1 A 82 82 PRO C C 436 172.944 175.932 -2.988 2
1 25 . 1 1 A 82 82 PRO CA C 436 60.134 63.411 -3.277 2
1 26 . 1 1 A 82 82 PRO CB C 436 31.425 32.539 -1.114 2
stop_
save_