data_10268_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 10268
_Entry.PDB_ID 2EE0
_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 4 . 1 1 1 A 2 2 SER H H 2 8.289 8.755 -0.466 1
1 5 . 1 1 1 A 2 2 SER HA H 2 4.530 4.550 -0.020 1
1 7 . 1 1 1 A 2 2 SER C C 2 174.868 174.029 0.839 1
1 8 . 1 1 1 A 2 2 SER CA C 2 58.284 60.012 -1.728 1
1 9 . 1 1 1 A 2 2 SER CB C 2 63.769 64.014 -0.245 1
1 10 . 1 1 1 A 2 2 SER N N 2 115.842 122.869 -7.027 1
1 11 . 1 1 1 A 3 3 SER H H 3 8.490 7.833 0.657 1
1 12 . 1 1 1 A 3 3 SER HA H 3 4.496 4.624 -0.128 1
1 14 . 1 1 1 A 3 3 SER C C 3 175.043 174.324 0.719 1
1 15 . 1 1 1 A 3 3 SER CA C 3 58.549 56.956 1.593 1
1 16 . 1 1 1 A 3 3 SER CB C 3 63.687 64.669 -0.982 1
1 17 . 1 1 1 A 3 3 SER N N 3 117.930 112.576 5.354 1
1 18 . 1 1 1 A 4 4 GLY H H 4 8.482 8.272 0.210 1
1 19 . 1 1 1 A 4 4 GLY C C 4 174.344 174.669 -0.325 1
1 20 . 1 1 1 A 4 4 GLY CA C 4 45.536 46.083 -0.547 1
1 21 . 1 1 1 A 4 4 GLY N N 4 110.985 109.723 1.262 1
1 22 . 1 1 1 A 6 6 SER HA H 6 4.508 4.621 -0.113 1
1 24 . 1 1 1 A 6 6 SER C C 6 175.026 174.941 0.085 1
1 25 . 1 1 1 A 6 6 SER CA C 6 58.584 59.436 -0.852 1
1 26 . 1 1 1 A 6 6 SER CB C 6 63.646 64.508 -0.862 1
1 27 . 1 1 1 A 7 7 GLY H H 7 8.419 7.606 0.813 1
1 28 . 1 1 1 A 7 7 GLY HA2 H 7 3.993 4.026 -0.033 1
1 29 . 1 1 1 A 7 7 GLY C C 7 173.995 171.834 2.161 1
1 30 . 1 1 1 A 7 7 GLY CA C 7 45.466 44.656 0.810 1
1 31 . 1 1 1 A 7 7 GLY N N 7 110.615 105.528 5.087 1
1 32 . 1 1 1 A 8 8 ASN H H 8 8.322 8.718 -0.396 1
1 33 . 1 1 1 A 8 8 ASN HA H 8 4.736 5.268 -0.532 1
1 38 . 1 1 1 A 8 8 ASN C C 8 174.907 173.277 1.630 1
1 39 . 1 1 1 A 8 8 ASN CA C 8 53.259 52.215 1.044 1
1 40 . 1 1 1 A 8 8 ASN CB C 8 39.127 41.896 -2.769 1
1 41 . 1 1 1 A 8 8 ASN N N 8 118.602 118.587 0.015 1
1 43 . 1 1 1 A 9 9 ASP H H 9 8.370 8.653 -0.283 1
1 44 . 1 1 1 A 9 9 ASP HA H 9 4.594 4.903 -0.309 1
1 47 . 1 1 1 A 9 9 ASP C C 9 175.765 175.699 0.066 1
1 48 . 1 1 1 A 9 9 ASP CA C 9 54.440 53.435 1.005 1
1 49 . 1 1 1 A 9 9 ASP CB C 9 40.898 41.853 -0.955 1
1 50 . 1 1 1 A 9 9 ASP N N 9 120.504 119.807 0.697 1
1 51 . 1 1 1 A 10 10 ASN H H 10 8.382 8.855 -0.473 1
1 52 . 1 1 1 A 10 10 ASN HA H 10 4.691 5.426 -0.735 1
1 57 . 1 1 1 A 10 10 ASN C C 10 174.383 173.669 0.714 1
1 58 . 1 1 1 A 10 10 ASN CA C 10 53.241 51.885 1.356 1
1 59 . 1 1 1 A 10 10 ASN CB C 10 38.674 42.496 -3.822 1
1 60 . 1 1 1 A 10 10 ASN N N 10 119.406 117.463 1.943 1
1 62 . 1 1 1 A 11 11 ARG H H 11 7.942 8.929 -0.987 1
1 63 . 1 1 1 A 11 11 ARG HA H 11 4.684 4.956 -0.272 1
1 70 . 1 1 1 A 11 11 ARG C C 11 173.640 174.185 -0.545 1
1 71 . 1 1 1 A 11 11 ARG CA C 11 54.246 53.315 0.931 1
1 72 . 1 1 1 A 11 11 ARG CB C 11 30.337 33.321 -2.984 1
1 75 . 1 1 1 A 11 11 ARG N N 11 121.145 119.366 1.779 1
1 76 . 1 1 1 A 12 12 PRO HA H 12 4.507 4.549 -0.042 1
1 83 . 1 1 1 A 12 12 PRO CA C 12 62.714 62.337 0.377 1
1 84 . 1 1 1 A 12 12 PRO CB C 12 31.942 32.943 -1.001 1
1 87 . 1 1 1 A 13 13 VAL H H 13 8.252 8.402 -0.150 1
1 88 . 1 1 1 A 13 13 VAL HA H 13 4.159 4.711 -0.552 1
1 96 . 1 1 1 A 13 13 VAL CA C 13 61.409 59.612 1.797 1
1 97 . 1 1 1 A 13 13 VAL CB C 13 34.858 35.639 -0.781 1
1 100 . 1 1 1 A 13 13 VAL N N 13 118.395 120.604 -2.209 1
1 101 . 1 1 1 A 14 14 PHE H H 14 8.725 8.792 -0.067 1
1 102 . 1 1 1 A 14 14 PHE HA H 14 4.781 4.688 0.093 1
1 110 . 1 1 1 A 14 14 PHE CA C 14 58.594 58.669 -0.075 1
1 111 . 1 1 1 A 14 14 PHE CB C 14 39.594 39.904 -0.310 1
1 117 . 1 1 1 A 14 14 PHE N N 14 122.950 127.330 -4.380 1
1 118 . 1 1 1 A 15 15 LYS H H 15 8.885 8.930 -0.045 1
1 119 . 1 1 1 A 15 15 LYS HA H 15 4.130 4.182 -0.052 1
1 128 . 1 1 1 A 15 15 LYS C C 15 177.027 175.949 1.078 1
1 129 . 1 1 1 A 15 15 LYS CA C 15 58.478 59.062 -0.584 1
1 130 . 1 1 1 A 15 15 LYS CB C 15 32.748 32.869 -0.121 1
1 134 . 1 1 1 A 15 15 LYS N N 15 123.863 122.389 1.474 1
1 135 . 1 1 1 A 16 16 GLU H H 16 8.091 8.002 0.089 1
1 136 . 1 1 1 A 16 16 GLU HA H 16 4.438 4.758 -0.320 1
1 141 . 1 1 1 A 16 16 GLU C C 16 175.947 177.412 -1.465 1
1 142 . 1 1 1 A 16 16 GLU CA C 16 56.045 55.240 0.805 1
1 143 . 1 1 1 A 16 16 GLU CB C 16 30.766 32.768 -2.002 1
1 145 . 1 1 1 A 16 16 GLU N N 16 117.026 116.597 0.429 1
1 146 . 1 1 1 A 17 17 GLY H H 17 8.421 8.788 -0.367 1
1 147 . 1 1 1 A 17 17 GLY HA2 H 17 3.993 3.851 0.142 1
1 148 . 1 1 1 A 17 17 GLY HA3 H 17 3.913 3.857 0.056 1
1 149 . 1 1 1 A 17 17 GLY C C 17 173.564 174.027 -0.463 1
1 150 . 1 1 1 A 17 17 GLY CA C 17 45.448 47.735 -2.287 1
1 151 . 1 1 1 A 17 17 GLY N N 17 109.577 111.352 -1.775 1
1 152 . 1 1 1 A 18 18 GLN H H 18 7.858 7.670 0.188 1
1 153 . 1 1 1 A 18 18 GLN HA H 18 5.065 5.359 -0.294 1
1 160 . 1 1 1 A 18 18 GLN C C 18 174.596 174.449 0.147 1
1 161 . 1 1 1 A 18 18 GLN CA C 18 55.110 53.910 1.200 1
1 162 . 1 1 1 A 18 18 GLN CB C 18 30.329 32.068 -1.739 1
1 164 . 1 1 1 A 18 18 GLN N N 18 120.202 113.498 6.704 1
1 166 . 1 1 1 A 19 19 VAL H H 19 8.216 8.715 -0.499 1
1 167 . 1 1 1 A 19 19 VAL HA H 19 4.450 4.656 -0.206 1
1 175 . 1 1 1 A 19 19 VAL C C 19 173.648 174.345 -0.697 1
1 176 . 1 1 1 A 19 19 VAL CA C 19 60.788 60.324 0.464 1
1 177 . 1 1 1 A 19 19 VAL CB C 19 35.336 35.699 -0.363 1
1 180 . 1 1 1 A 19 19 VAL N N 19 121.257 121.416 -0.159 1
1 181 . 1 1 1 A 20 20 GLU H H 20 8.610 8.735 -0.125 1
1 182 . 1 1 1 A 20 20 GLU HA H 20 5.211 5.180 0.031 1
1 187 . 1 1 1 A 20 20 GLU C C 20 174.783 176.052 -1.269 1
1 188 . 1 1 1 A 20 20 GLU CA C 20 54.793 55.286 -0.493 1
1 189 . 1 1 1 A 20 20 GLU CB C 20 32.058 31.911 0.147 1
1 191 . 1 1 1 A 20 20 GLU N N 20 127.095 125.767 1.328 1
1 192 . 1 1 1 A 21 21 VAL H H 21 8.727 8.808 -0.081 1
1 193 . 1 1 1 A 21 21 VAL HA H 21 4.633 5.139 -0.506 1
1 201 . 1 1 1 A 21 21 VAL C C 21 173.894 174.861 -0.967 1
1 202 . 1 1 1 A 21 21 VAL CA C 21 59.695 59.318 0.377 1
1 203 . 1 1 1 A 21 21 VAL CB C 21 35.865 35.619 0.246 1
1 206 . 1 1 1 A 21 21 VAL N N 21 120.489 118.182 2.307 1
1 207 . 1 1 1 A 22 22 HIS H H 22 8.680 8.882 -0.202 1
1 208 . 1 1 1 A 22 22 HIS HA H 22 5.552 5.697 -0.145 1
1 212 . 1 1 1 A 22 22 HIS C C 22 174.298 173.446 0.852 1
1 213 . 1 1 1 A 22 22 HIS CA C 22 55.331 53.778 1.553 1
1 214 . 1 1 1 A 22 22 HIS CB C 22 32.369 31.646 0.723 1
1 216 . 1 1 1 A 22 22 HIS N N 22 124.991 118.531 6.460 1
1 217 . 1 1 1 A 23 23 ILE H H 23 9.179 8.826 0.353 1
1 218 . 1 1 1 A 23 23 ILE HA H 23 5.046 4.693 0.353 1
1 228 . 1 1 1 A 23 23 ILE C C 23 171.552 173.262 -1.710 1
1 229 . 1 1 1 A 23 23 ILE CA C 23 55.551 57.145 -1.594 1
1 230 . 1 1 1 A 23 23 ILE CB C 23 42.053 41.987 0.066 1
1 234 . 1 1 1 A 23 23 ILE N N 23 123.121 125.435 -2.314 1
1 235 . 1 1 1 A 24 24 PRO HA H 24 4.816 4.962 -0.146 1
1 242 . 1 1 1 A 24 24 PRO C C 24 178.887 177.871 1.016 1
1 243 . 1 1 1 A 24 24 PRO CA C 24 62.216 62.798 -0.582 1
1 244 . 1 1 1 A 24 24 PRO CB C 24 32.895 32.382 0.513 1
1 247 . 1 1 1 A 25 25 GLU H H 25 8.399 8.335 0.064 1
1 248 . 1 1 1 A 25 25 GLU HA H 25 3.785 4.059 -0.274 1
1 253 . 1 1 1 A 25 25 GLU C C 25 175.244 178.082 -2.838 1
1 254 . 1 1 1 A 25 25 GLU CA C 25 58.425 59.464 -1.039 1
1 255 . 1 1 1 A 25 25 GLU CB C 25 30.011 29.061 0.950 1
1 257 . 1 1 1 A 25 25 GLU N N 25 117.706 123.025 -5.319 1
1 258 . 1 1 1 A 26 26 ASN H H 26 7.488 7.822 -0.334 1
1 259 . 1 1 1 A 26 26 ASN HA H 26 4.702 4.698 0.004 1
1 264 . 1 1 1 A 26 26 ASN C C 26 175.425 176.119 -0.694 1
1 265 . 1 1 1 A 26 26 ASN CA C 26 51.584 53.751 -2.167 1
1 266 . 1 1 1 A 26 26 ASN CB C 26 37.243 38.608 -1.365 1
1 267 . 1 1 1 A 26 26 ASN N N 26 112.383 118.223 -5.840 1
1 269 . 1 1 1 A 27 27 ALA H H 27 7.716 7.704 0.012 1
1 270 . 1 1 1 A 27 27 ALA HA H 27 4.409 4.261 0.148 1
1 274 . 1 1 1 A 27 27 ALA C C 27 175.850 175.839 0.011 1
1 275 . 1 1 1 A 27 27 ALA CA C 27 51.037 51.103 -0.066 1
1 276 . 1 1 1 A 27 27 ALA CB C 27 18.152 18.921 -0.769 1
1 277 . 1 1 1 A 27 27 ALA N N 27 125.139 122.711 2.428 1
1 278 . 1 1 1 A 28 28 PRO HA H 28 4.422 4.507 -0.085 1
1 285 . 1 1 1 A 28 28 PRO C C 28 178.442 176.865 1.577 1
1 286 . 1 1 1 A 28 28 PRO CA C 28 62.067 62.657 -0.590 1
1 287 . 1 1 1 A 28 28 PRO CB C 28 32.642 32.167 0.475 1
1 290 . 1 1 1 A 29 29 VAL H H 29 8.691 8.291 0.400 1
1 291 . 1 1 1 A 29 29 VAL HA H 29 3.239 3.600 -0.361 1
1 299 . 1 1 1 A 29 29 VAL C C 29 176.887 177.124 -0.237 1
1 300 . 1 1 1 A 29 29 VAL CA C 29 65.812 64.110 1.702 1
1 301 . 1 1 1 A 29 29 VAL CB C 29 31.174 31.374 -0.200 1
1 304 . 1 1 1 A 29 29 VAL N N 29 123.592 122.791 0.801 1
1 305 . 1 1 1 A 30 30 GLY H H 30 9.197 8.699 0.498 1
1 306 . 1 1 1 A 30 30 GLY HA2 H 30 4.486 3.961 0.525 1
1 307 . 1 1 1 A 30 30 GLY HA3 H 30 3.581 3.963 -0.382 1
1 308 . 1 1 1 A 30 30 GLY C C 30 174.347 174.760 -0.413 1
1 309 . 1 1 1 A 30 30 GLY CA C 30 44.320 44.844 -0.524 1
1 310 . 1 1 1 A 30 30 GLY N N 30 116.042 115.281 0.761 1
1 311 . 1 1 1 A 31 31 THR H H 31 7.838 7.152 0.686 1
1 312 . 1 1 1 A 31 31 THR HA H 31 3.959 4.221 -0.262 1
1 317 . 1 1 1 A 31 31 THR C C 31 174.274 174.044 0.230 1
1 318 . 1 1 1 A 31 31 THR CA C 31 65.160 62.938 2.222 1
1 319 . 1 1 1 A 31 31 THR CB C 31 69.972 69.603 0.369 1
1 321 . 1 1 1 A 31 31 THR N N 31 117.679 117.463 0.216 1
1 322 . 1 1 1 A 32 32 SER H H 32 9.022 8.621 0.401 1
1 323 . 1 1 1 A 32 32 SER HA H 32 4.273 5.015 -0.742 1
1 326 . 1 1 1 A 32 32 SER C C 32 172.692 174.391 -1.699 1
1 327 . 1 1 1 A 32 32 SER CA C 32 59.642 57.194 2.448 1
1 328 . 1 1 1 A 32 32 SER CB C 32 63.102 63.386 -0.284 1
1 329 . 1 1 1 A 32 32 SER N N 32 123.045 119.654 3.391 1
1 330 . 1 1 1 A 33 33 VAL H H 33 9.202 8.742 0.460 1
1 331 . 1 1 1 A 33 33 VAL HA H 33 3.844 3.904 -0.060 1
1 339 . 1 1 1 A 33 33 VAL C C 33 174.782 175.772 -0.990 1
1 340 . 1 1 1 A 33 33 VAL CA C 33 64.242 64.956 -0.714 1
1 341 . 1 1 1 A 33 33 VAL CB C 33 32.893 32.246 0.647 1
1 344 . 1 1 1 A 33 33 VAL N N 33 126.861 125.637 1.224 1
1 345 . 1 1 1 A 34 34 ILE H H 34 7.074 7.882 -0.808 1
1 346 . 1 1 1 A 34 34 ILE HA H 34 4.295 4.653 -0.358 1
1 356 . 1 1 1 A 34 34 ILE C C 34 170.577 173.177 -2.600 1
1 357 . 1 1 1 A 34 34 ILE CA C 34 59.500 59.271 0.229 1
1 358 . 1 1 1 A 34 34 ILE CB C 34 39.251 42.145 -2.894 1
1 362 . 1 1 1 A 34 34 ILE N N 34 111.445 118.840 -7.395 1
1 363 . 1 1 1 A 35 35 GLN H H 35 8.450 9.050 -0.600 1
1 364 . 1 1 1 A 35 35 GLN HA H 35 4.633 5.060 -0.427 1
1 371 . 1 1 1 A 35 35 GLN C C 35 174.354 174.230 0.124 1
1 372 . 1 1 1 A 35 35 GLN CA C 35 54.176 54.128 0.048 1
1 373 . 1 1 1 A 35 35 GLN CB C 35 29.456 31.943 -2.487 1
1 375 . 1 1 1 A 35 35 GLN N N 35 127.342 128.226 -0.884 1
1 377 . 1 1 1 A 36 36 LEU H H 36 7.761 9.045 -1.284 1
1 378 . 1 1 1 A 36 36 LEU HA H 36 4.492 5.008 -0.516 1
1 388 . 1 1 1 A 36 36 LEU C C 36 175.543 175.047 0.496 1
1 389 . 1 1 1 A 36 36 LEU CA C 36 53.982 53.559 0.423 1
1 390 . 1 1 1 A 36 36 LEU CB C 36 42.776 42.791 -0.015 1
1 394 . 1 1 1 A 36 36 LEU N N 36 128.895 128.137 0.758 1
1 395 . 1 1 1 A 37 37 HIS H H 37 8.529 9.136 -0.607 1
1 396 . 1 1 1 A 37 37 HIS HA H 37 4.851 5.244 -0.393 1
1 400 . 1 1 1 A 37 37 HIS C C 37 172.985 173.714 -0.729 1
1 401 . 1 1 1 A 37 37 HIS CA C 37 55.833 53.788 2.045 1
1 402 . 1 1 1 A 37 37 HIS CB C 37 32.204 31.706 0.498 1
1 404 . 1 1 1 A 37 37 HIS N N 37 115.903 125.251 -9.348 1
1 405 . 1 1 1 A 38 38 ALA H H 38 8.474 8.571 -0.097 1
1 406 . 1 1 1 A 38 38 ALA HA H 38 4.691 4.621 0.070 1
1 410 . 1 1 1 A 38 38 ALA C C 38 175.548 176.222 -0.674 1
1 411 . 1 1 1 A 38 38 ALA CA C 38 50.491 50.773 -0.282 1
1 412 . 1 1 1 A 38 38 ALA CB C 38 19.842 19.802 0.040 1
1 413 . 1 1 1 A 38 38 ALA N N 38 128.891 131.047 -2.156 1
1 414 . 1 1 1 A 39 39 THR H H 39 8.095 8.338 -0.243 1
1 415 . 1 1 1 A 39 39 THR HA H 39 4.336 4.915 -0.579 1
1 420 . 1 1 1 A 39 39 THR C C 39 173.553 174.402 -0.849 1
1 421 . 1 1 1 A 39 39 THR CA C 39 60.417 59.890 0.527 1
1 422 . 1 1 1 A 39 39 THR CB C 39 70.912 70.502 0.410 1
1 424 . 1 1 1 A 39 39 THR N N 39 110.982 114.473 -3.491 1
1 425 . 1 1 1 A 40 40 ASP H H 40 8.417 8.470 -0.053 1
1 426 . 1 1 1 A 40 40 ASP HA H 40 4.553 4.531 0.022 1
1 429 . 1 1 1 A 40 40 ASP C C 40 176.462 176.124 0.338 1
1 430 . 1 1 1 A 40 40 ASP CA C 40 54.158 54.241 -0.083 1
1 431 . 1 1 1 A 40 40 ASP CB C 40 41.517 41.957 -0.440 1
1 432 . 1 1 1 A 40 40 ASP N N 40 121.450 123.209 -1.759 1
1 433 . 1 1 1 A 41 41 ALA H H 41 8.435 8.169 0.266 1
1 434 . 1 1 1 A 41 41 ALA HA H 41 4.129 4.027 0.102 1
1 438 . 1 1 1 A 41 41 ALA C C 41 177.718 178.334 -0.616 1
1 439 . 1 1 1 A 41 41 ALA CA C 41 53.436 53.072 0.364 1
1 440 . 1 1 1 A 41 41 ALA CB C 41 19.183 19.833 -0.650 1
1 441 . 1 1 1 A 41 41 ALA N N 41 124.607 123.389 1.218 1
1 442 . 1 1 1 A 42 42 ASP H H 42 8.310 8.804 -0.494 1
1 443 . 1 1 1 A 42 42 ASP HA H 42 4.588 4.281 0.307 1
1 446 . 1 1 1 A 42 42 ASP C C 42 176.546 177.479 -0.933 1
1 447 . 1 1 1 A 42 42 ASP CA C 42 54.599 57.701 -3.102 1
1 448 . 1 1 1 A 42 42 ASP CB C 42 41.146 40.663 0.483 1
1 449 . 1 1 1 A 42 42 ASP N N 42 118.030 124.119 -6.089 1
1 450 . 1 1 1 A 43 43 ILE H H 43 8.000 7.953 0.047 1
1 451 . 1 1 1 A 43 43 ILE HA H 43 4.130 3.851 0.279 1
1 461 . 1 1 1 A 43 43 ILE C C 43 176.901 176.519 0.382 1
1 462 . 1 1 1 A 43 43 ILE CA C 43 61.740 62.761 -1.021 1
1 463 . 1 1 1 A 43 43 ILE CB C 43 38.491 37.728 0.763 1
1 467 . 1 1 1 A 43 43 ILE N N 43 119.301 118.152 1.149 1
1 468 . 1 1 1 A 44 44 GLY H H 44 8.448 8.827 -0.379 1
1 469 . 1 1 1 A 44 44 GLY HA2 H 44 3.939 4.112 -0.173 1
1 470 . 1 1 1 A 44 44 GLY HA3 H 44 3.939 4.114 -0.175 1
1 471 . 1 1 1 A 44 44 GLY C C 44 174.393 173.798 0.595 1
1 472 . 1 1 1 A 44 44 GLY CA C 44 45.501 44.744 0.757 1
1 473 . 1 1 1 A 44 44 GLY N N 44 111.333 117.940 -6.607 1
1 474 . 1 1 1 A 45 45 SER H H 45 8.061 8.767 -0.706 1
1 475 . 1 1 1 A 45 45 SER HA H 45 4.416 4.875 -0.459 1
1 478 . 1 1 1 A 45 45 SER C C 45 174.480 174.135 0.345 1
1 479 . 1 1 1 A 45 45 SER CA C 45 58.478 56.878 1.600 1
1 480 . 1 1 1 A 45 45 SER CB C 45 63.943 63.431 0.512 1
1 481 . 1 1 1 A 45 45 SER N N 45 115.551 118.580 -3.029 1
1 482 . 1 1 1 A 46 46 ASN H H 46 8.547 7.963 0.584 1
1 483 . 1 1 1 A 46 46 ASN HA H 46 4.725 4.840 -0.115 1
1 488 . 1 1 1 A 46 46 ASN C C 46 175.031 173.664 1.367 1
1 489 . 1 1 1 A 46 46 ASN CA C 46 53.277 52.725 0.552 1
1 490 . 1 1 1 A 46 46 ASN CB C 46 38.798 36.440 2.358 1
1 491 . 1 1 1 A 46 46 ASN N N 46 120.698 121.830 -1.132 1
1 493 . 1 1 1 A 47 47 ALA H H 47 8.239 7.412 0.827 1
1 494 . 1 1 1 A 47 47 ALA HA H 47 4.283 4.733 -0.450 1
1 498 . 1 1 1 A 47 47 ALA C C 47 177.240 174.867 2.373 1
1 499 . 1 1 1 A 47 47 ALA CA C 47 52.731 51.133 1.598 1
1 500 . 1 1 1 A 47 47 ALA CB C 47 19.594 24.026 -4.432 1
1 501 . 1 1 1 A 47 47 ALA N N 47 124.093 120.445 3.648 1
1 502 . 1 1 1 A 48 48 GLU H H 48 8.376 8.722 -0.346 1
1 503 . 1 1 1 A 48 48 GLU HA H 48 4.264 5.038 -0.774 1
1 508 . 1 1 1 A 48 48 GLU C C 48 175.702 174.530 1.172 1
1 509 . 1 1 1 A 48 48 GLU CA C 48 55.992 54.710 1.282 1
1 510 . 1 1 1 A 48 48 GLU CB C 48 30.210 31.446 -1.236 1
1 512 . 1 1 1 A 48 48 GLU N N 48 119.750 116.687 3.063 1
1 513 . 1 1 1 A 49 49 ILE H H 49 7.806 8.772 -0.966 1
1 514 . 1 1 1 A 49 49 ILE HA H 49 3.919 4.244 -0.325 1
1 524 . 1 1 1 A 49 49 ILE C C 49 175.894 175.214 0.680 1
1 525 . 1 1 1 A 49 49 ILE CA C 49 60.559 60.382 0.177 1
1 526 . 1 1 1 A 49 49 ILE CB C 49 37.860 37.456 0.404 1
1 530 . 1 1 1 A 49 49 ILE N N 49 122.772 126.532 -3.760 1
1 531 . 1 1 1 A 50 50 ARG H H 50 8.247 8.671 -0.424 1
1 532 . 1 1 1 A 50 50 ARG HA H 50 4.999 4.897 0.102 1
1 539 . 1 1 1 A 50 50 ARG C C 50 174.603 174.475 0.128 1
1 540 . 1 1 1 A 50 50 ARG CA C 50 53.189 54.647 -1.458 1
1 541 . 1 1 1 A 50 50 ARG CB C 50 33.152 32.809 0.343 1
1 544 . 1 1 1 A 50 50 ARG N N 50 126.912 127.432 -0.520 1
1 545 . 1 1 1 A 51 51 TYR H H 51 9.041 8.985 0.056 1
1 546 . 1 1 1 A 51 51 TYR HA H 51 5.395 5.537 -0.142 1
1 553 . 1 1 1 A 51 51 TYR C C 51 175.555 176.205 -0.650 1
1 554 . 1 1 1 A 51 51 TYR CA C 51 56.909 56.879 0.030 1
1 555 . 1 1 1 A 51 51 TYR CB C 51 40.116 39.350 0.766 1
1 560 . 1 1 1 A 51 51 TYR N N 51 121.627 121.799 -0.172 1
1 561 . 1 1 1 A 52 52 ILE H H 52 8.850 8.473 0.377 1
1 562 . 1 1 1 A 52 52 ILE HA H 52 4.576 4.963 -0.387 1
1 572 . 1 1 1 A 52 52 ILE C C 52 175.371 175.752 -0.381 1
1 573 . 1 1 1 A 52 52 ILE CA C 52 59.624 59.120 0.504 1
1 574 . 1 1 1 A 52 52 ILE CB C 52 42.895 40.367 2.528 1
1 578 . 1 1 1 A 52 52 ILE N N 52 117.697 119.278 -1.581 1
1 579 . 1 1 1 A 53 53 PHE H H 53 8.748 8.867 -0.119 1
1 580 . 1 1 1 A 53 53 PHE HA H 53 5.132 4.732 0.400 1
1 588 . 1 1 1 A 53 53 PHE C C 53 178.146 176.369 1.777 1
1 589 . 1 1 1 A 53 53 PHE CA C 53 57.667 57.604 0.063 1
1 590 . 1 1 1 A 53 53 PHE CB C 53 39.614 39.685 -0.071 1
1 596 . 1 1 1 A 53 53 PHE N N 53 121.433 121.161 0.272 1
1 597 . 1 1 1 A 54 54 GLY H H 54 8.538 8.399 0.139 1
1 598 . 1 1 1 A 54 54 GLY HA2 H 54 4.074 4.076 -0.002 1
1 599 . 1 1 1 A 54 54 GLY HA3 H 54 3.840 4.080 -0.240 1
1 600 . 1 1 1 A 54 54 GLY C C 54 174.530 172.910 1.620 1
1 601 . 1 1 1 A 54 54 GLY CA C 54 44.884 44.528 0.356 1
1 602 . 1 1 1 A 54 54 GLY N N 54 106.444 110.746 -4.302 1
1 603 . 1 1 1 A 55 55 ALA H H 55 8.594 8.215 0.379 1
1 604 . 1 1 1 A 55 55 ALA HA H 55 4.172 4.639 -0.467 1
1 608 . 1 1 1 A 55 55 ALA C C 55 178.718 177.404 1.314 1
1 609 . 1 1 1 A 55 55 ALA CA C 55 54.423 50.949 3.474 1
1 610 . 1 1 1 A 55 55 ALA CB C 55 19.059 20.462 -1.403 1
1 611 . 1 1 1 A 55 55 ALA N N 55 123.470 122.176 1.294 1
1 612 . 1 1 1 A 56 56 GLN H H 56 8.727 8.763 -0.036 1
1 613 . 1 1 1 A 56 56 GLN HA H 56 4.367 3.786 0.581 1
1 620 . 1 1 1 A 56 56 GLN C C 56 176.134 174.504 1.630 1
1 621 . 1 1 1 A 56 56 GLN CA C 56 55.660 56.762 -1.102 1
1 622 . 1 1 1 A 56 56 GLN CB C 56 28.152 26.871 1.281 1
1 624 . 1 1 1 A 56 56 GLN N N 56 114.221 115.719 -1.498 1
1 626 . 1 1 1 A 57 57 VAL H H 57 7.204 7.708 -0.504 1
1 627 . 1 1 1 A 57 57 VAL HA H 57 3.889 4.271 -0.382 1
1 635 . 1 1 1 A 57 57 VAL C C 57 175.371 175.308 0.063 1
1 636 . 1 1 1 A 57 57 VAL CA C 57 63.908 61.376 2.532 1
1 637 . 1 1 1 A 57 57 VAL CB C 57 31.557 32.815 -1.258 1
1 640 . 1 1 1 A 57 57 VAL N N 57 121.341 119.570 1.771 1
1 641 . 1 1 1 A 58 58 ALA H H 58 8.920 8.580 0.340 1
1 642 . 1 1 1 A 58 58 ALA HA H 58 4.547 4.413 0.134 1
1 646 . 1 1 1 A 58 58 ALA C C 58 177.064 177.786 -0.722 1
1 647 . 1 1 1 A 58 58 ALA CA C 58 51.173 50.764 0.409 1
1 648 . 1 1 1 A 58 58 ALA CB C 58 17.842 17.686 0.156 1
1 649 . 1 1 1 A 58 58 ALA N N 58 132.726 130.767 1.959 1
1 650 . 1 1 1 A 59 59 PRO HA H 59 4.101 4.211 -0.110 1
1 657 . 1 1 1 A 59 59 PRO C C 59 179.482 178.371 1.111 1
1 658 . 1 1 1 A 59 59 PRO CA C 59 66.060 65.209 0.851 1
1 659 . 1 1 1 A 59 59 PRO CB C 59 31.951 31.905 0.046 1
1 662 . 1 1 1 A 60 60 ALA H H 60 8.706 8.255 0.451 1
1 663 . 1 1 1 A 60 60 ALA HA H 60 4.057 4.007 0.050 1
1 667 . 1 1 1 A 60 60 ALA C C 60 179.627 180.139 -0.512 1
1 668 . 1 1 1 A 60 60 ALA CA C 60 55.305 55.438 -0.133 1
1 669 . 1 1 1 A 60 60 ALA CB C 60 18.737 18.653 0.084 1
1 670 . 1 1 1 A 60 60 ALA N N 60 117.882 118.729 -0.847 1
1 671 . 1 1 1 A 61 61 THR H H 61 7.312 8.137 -0.825 1
1 672 . 1 1 1 A 61 61 THR HA H 61 4.153 4.014 0.139 1
1 677 . 1 1 1 A 61 61 THR C C 61 175.824 176.812 -0.988 1
1 678 . 1 1 1 A 61 61 THR CA C 61 66.412 66.937 -0.525 1
1 679 . 1 1 1 A 61 61 THR CB C 61 68.787 68.431 0.356 1
1 681 . 1 1 1 A 61 61 THR N N 61 114.483 115.384 -0.901 1
1 682 . 1 1 1 A 62 62 LYS H H 62 7.556 7.665 -0.109 1
1 683 . 1 1 1 A 62 62 LYS HA H 62 3.943 4.015 -0.072 1
1 692 . 1 1 1 A 62 62 LYS C C 62 176.884 178.792 -1.908 1
1 693 . 1 1 1 A 62 62 LYS CA C 62 59.095 59.521 -0.426 1
1 694 . 1 1 1 A 62 62 LYS CB C 62 32.204 31.722 0.482 1
1 698 . 1 1 1 A 62 62 LYS N N 62 118.994 119.697 -0.703 1
1 699 . 1 1 1 A 63 63 ARG H H 63 7.474 7.602 -0.128 1
1 700 . 1 1 1 A 63 63 ARG HA H 63 4.034 4.085 -0.051 1
1 707 . 1 1 1 A 63 63 ARG C C 63 177.574 178.850 -1.276 1
1 708 . 1 1 1 A 63 63 ARG CA C 63 58.143 58.735 -0.592 1
1 709 . 1 1 1 A 63 63 ARG CB C 63 30.755 29.946 0.809 1
1 712 . 1 1 1 A 63 63 ARG N N 63 114.251 120.162 -5.911 1
1 713 . 1 1 1 A 64 64 LEU H H 64 6.991 8.124 -1.133 1
1 714 . 1 1 1 A 64 64 LEU HA H 64 3.904 3.918 -0.014 1
1 724 . 1 1 1 A 64 64 LEU C C 64 176.632 176.606 0.026 1
1 725 . 1 1 1 A 64 64 LEU CA C 64 56.503 57.558 -1.055 1
1 726 . 1 1 1 A 64 64 LEU CB C 64 42.929 41.993 0.936 1
1 730 . 1 1 1 A 64 64 LEU N N 64 116.109 119.524 -3.415 1
1 731 . 1 1 1 A 65 65 PHE H H 65 7.673 8.146 -0.473 1
1 732 . 1 1 1 A 65 65 PHE HA H 65 5.386 5.171 0.215 1
1 740 . 1 1 1 A 65 65 PHE C C 65 173.067 174.390 -1.323 1
1 741 . 1 1 1 A 65 65 PHE CA C 65 56.521 56.272 0.249 1
1 742 . 1 1 1 A 65 65 PHE CB C 65 41.270 41.880 -0.610 1
1 748 . 1 1 1 A 65 65 PHE N N 65 116.182 114.831 1.351 1
1 749 . 1 1 1 A 66 66 ALA H H 66 8.914 8.745 0.169 1
1 750 . 1 1 1 A 66 66 ALA HA H 66 4.748 4.891 -0.143 1
1 754 . 1 1 1 A 66 66 ALA C C 66 175.223 176.084 -0.861 1
1 755 . 1 1 1 A 66 66 ALA CA C 66 50.050 50.860 -0.810 1
1 756 . 1 1 1 A 66 66 ALA CB C 66 21.161 20.294 0.867 1
1 757 . 1 1 1 A 66 66 ALA N N 66 122.870 125.982 -3.112 1
1 758 . 1 1 1 A 67 67 LEU H H 67 8.498 9.175 -0.677 1
1 759 . 1 1 1 A 67 67 LEU HA H 67 4.713 4.953 -0.240 1
1 769 . 1 1 1 A 67 67 LEU C C 67 175.146 175.336 -0.190 1
1 770 . 1 1 1 A 67 67 LEU CA C 67 52.518 53.624 -1.106 1
1 771 . 1 1 1 A 67 67 LEU CB C 67 45.308 44.435 0.873 1
1 775 . 1 1 1 A 67 67 LEU N N 67 122.208 126.746 -4.538 1
1 776 . 1 1 1 A 68 68 ASN H H 68 8.357 8.691 -0.334 1
1 777 . 1 1 1 A 68 68 ASN HA H 68 4.679 4.822 -0.143 1
1 782 . 1 1 1 A 68 68 ASN C C 68 176.228 175.782 0.446 1
1 783 . 1 1 1 A 68 68 ASN CA C 68 53.524 53.615 -0.091 1
1 784 . 1 1 1 A 68 68 ASN CB C 68 39.580 38.726 0.854 1
1 785 . 1 1 1 A 68 68 ASN N N 68 126.940 125.206 1.734 1
1 787 . 1 1 1 A 69 69 ASN H H 69 8.861 8.899 -0.038 1
1 788 . 1 1 1 A 69 69 ASN HA H 69 5.137 5.172 -0.035 1
1 793 . 1 1 1 A 69 69 ASN C C 69 175.631 176.286 -0.655 1
1 794 . 1 1 1 A 69 69 ASN CA C 69 56.009 53.822 2.187 1
1 795 . 1 1 1 A 69 69 ASN CB C 69 40.314 38.636 1.678 1
1 796 . 1 1 1 A 69 69 ASN N N 69 124.980 123.652 1.328 1
1 798 . 1 1 1 A 70 70 THR H H 70 8.635 7.994 0.641 1
1 799 . 1 1 1 A 70 70 THR HA H 70 4.815 4.711 0.104 1
1 804 . 1 1 1 A 70 70 THR C C 70 176.223 175.716 0.507 1
1 805 . 1 1 1 A 70 70 THR CA C 70 63.944 62.072 1.872 1
1 806 . 1 1 1 A 70 70 THR CB C 70 69.727 70.667 -0.940 1
1 808 . 1 1 1 A 70 70 THR N N 70 110.394 109.898 0.496 1
1 809 . 1 1 1 A 71 71 THR H H 71 8.069 8.035 0.034 1
1 810 . 1 1 1 A 71 71 THR HA H 71 4.566 4.770 -0.204 1
1 815 . 1 1 1 A 71 71 THR C C 71 176.213 175.728 0.485 1
1 816 . 1 1 1 A 71 71 THR CA C 71 61.683 62.133 -0.450 1
1 817 . 1 1 1 A 71 71 THR CB C 71 70.832 71.241 -0.409 1
1 819 . 1 1 1 A 71 71 THR N N 71 110.507 110.872 -0.365 1
1 820 . 1 1 1 A 72 72 GLY H H 72 7.990 8.352 -0.362 1
1 821 . 1 1 1 A 72 72 GLY HA2 H 72 3.186 2.521 0.665 1
1 822 . 1 1 1 A 72 72 GLY HA3 H 72 2.516 3.592 -1.076 1
1 823 . 1 1 1 A 72 72 GLY C C 72 172.988 174.217 -1.229 1
1 824 . 1 1 1 A 72 72 GLY CA C 72 45.149 45.546 -0.397 1
1 825 . 1 1 1 A 72 72 GLY N N 72 110.788 112.245 -1.457 1
1 826 . 1 1 1 A 73 73 LEU H H 73 7.138 7.308 -0.170 1
1 827 . 1 1 1 A 73 73 LEU HA H 73 4.414 4.664 -0.250 1
1 837 . 1 1 1 A 73 73 LEU C C 73 176.836 174.960 1.876 1
1 838 . 1 1 1 A 73 73 LEU CA C 73 55.252 54.168 1.084 1
1 839 . 1 1 1 A 73 73 LEU CB C 73 43.574 43.594 -0.020 1
1 843 . 1 1 1 A 73 73 LEU N N 73 119.222 122.370 -3.148 1
1 844 . 1 1 1 A 74 74 ILE H H 74 8.925 8.862 0.063 1
1 845 . 1 1 1 A 74 74 ILE HA H 74 5.555 4.892 0.663 1
1 855 . 1 1 1 A 74 74 ILE C C 74 175.978 175.433 0.545 1
1 856 . 1 1 1 A 74 74 ILE CA C 74 60.100 60.194 -0.094 1
1 857 . 1 1 1 A 74 74 ILE CB C 74 38.550 38.702 -0.152 1
1 861 . 1 1 1 A 74 74 ILE N N 74 129.871 127.499 2.372 1
1 862 . 1 1 1 A 75 75 THR H H 75 9.161 8.635 0.526 1
1 863 . 1 1 1 A 75 75 THR HA H 75 5.375 5.567 -0.192 1
1 868 . 1 1 1 A 75 75 THR C C 75 174.798 173.736 1.062 1
1 869 . 1 1 1 A 75 75 THR CA C 75 58.796 59.674 -0.878 1
1 870 . 1 1 1 A 75 75 THR CB C 75 72.978 72.222 0.756 1
1 872 . 1 1 1 A 75 75 THR N N 75 117.522 118.157 -0.635 1
1 873 . 1 1 1 A 76 76 VAL H H 76 8.327 9.118 -0.791 1
1 874 . 1 1 1 A 76 76 VAL HA H 76 3.973 3.790 0.183 1
1 882 . 1 1 1 A 76 76 VAL C C 76 176.495 175.787 0.708 1
1 883 . 1 1 1 A 76 76 VAL CA C 76 64.085 63.761 0.324 1
1 884 . 1 1 1 A 76 76 VAL CB C 76 32.863 31.683 1.180 1
1 887 . 1 1 1 A 76 76 VAL N N 76 120.876 122.995 -2.119 1
1 888 . 1 1 1 A 77 77 GLN H H 77 9.525 8.864 0.661 1
1 889 . 1 1 1 A 77 77 GLN HA H 77 4.702 4.386 0.316 1
1 896 . 1 1 1 A 77 77 GLN C C 77 173.838 175.124 -1.286 1
1 897 . 1 1 1 A 77 77 GLN CA C 77 55.728 56.755 -1.027 1
1 898 . 1 1 1 A 77 77 GLN CB C 77 30.762 30.520 0.242 1
1 900 . 1 1 1 A 77 77 GLN N N 77 129.825 128.623 1.202 1
1 902 . 1 1 1 A 78 78 ARG H H 78 7.621 7.266 0.355 1
1 903 . 1 1 1 A 78 78 ARG HA H 78 4.347 4.753 -0.406 1
1 910 . 1 1 1 A 78 78 ARG C C 78 172.304 175.386 -3.082 1
1 911 . 1 1 1 A 78 78 ARG CA C 78 54.634 54.068 0.566 1
1 912 . 1 1 1 A 78 78 ARG CB C 78 34.685 35.008 -0.323 1
1 915 . 1 1 1 A 78 78 ARG N N 78 120.595 117.244 3.351 1
1 916 . 1 1 1 A 79 79 SER H H 79 7.958 8.370 -0.412 1
1 917 . 1 1 1 A 79 79 SER HA H 79 4.030 4.422 -0.392 1
1 920 . 1 1 1 A 79 79 SER C C 79 174.311 174.340 -0.029 1
1 921 . 1 1 1 A 79 79 SER CA C 79 59.889 59.235 0.654 1
1 922 . 1 1 1 A 79 79 SER CB C 79 63.548 64.017 -0.469 1
1 923 . 1 1 1 A 79 79 SER N N 79 112.565 117.466 -4.901 1
1 924 . 1 1 1 A 80 80 LEU H H 80 8.715 8.105 0.610 1
1 925 . 1 1 1 A 80 80 LEU HA H 80 4.114 4.995 -0.881 1
1 935 . 1 1 1 A 80 80 LEU C C 80 176.057 175.906 0.151 1
1 936 . 1 1 1 A 80 80 LEU CA C 80 55.091 53.221 1.870 1
1 937 . 1 1 1 A 80 80 LEU CB C 80 42.341 44.456 -2.115 1
1 941 . 1 1 1 A 80 80 LEU N N 80 123.070 124.440 -1.370 1
1 942 . 1 1 1 A 81 81 ASP H H 81 7.298 8.795 -1.497 1
1 943 . 1 1 1 A 81 81 ASP HA H 81 4.725 5.377 -0.652 1
1 946 . 1 1 1 A 81 81 ASP C C 81 175.939 176.140 -0.201 1
1 947 . 1 1 1 A 81 81 ASP CA C 81 53.664 52.821 0.843 1
1 948 . 1 1 1 A 81 81 ASP CB C 81 42.947 43.769 -0.822 1
1 949 . 1 1 1 A 81 81 ASP N N 81 115.229 119.704 -4.475 1
1 950 . 1 1 1 A 82 82 ARG H H 82 9.289 8.756 0.533 1
1 951 . 1 1 1 A 82 82 ARG HA H 82 4.416 4.167 0.249 1
1 959 . 1 1 1 A 82 82 ARG C C 82 176.406 178.110 -1.704 1
1 960 . 1 1 1 A 82 82 ARG CA C 82 56.397 59.095 -2.698 1
1 961 . 1 1 1 A 82 82 ARG CB C 82 30.638 30.227 0.411 1
1 964 . 1 1 1 A 82 82 ARG N N 82 123.174 126.545 -3.371 1
1 966 . 1 1 1 A 83 83 GLU H H 83 8.468 8.269 0.199 1
1 967 . 1 1 1 A 83 83 GLU HA H 83 3.982 4.012 -0.030 1
1 972 . 1 1 1 A 83 83 GLU C C 83 177.740 179.125 -1.385 1
1 973 . 1 1 1 A 83 83 GLU CA C 83 58.425 59.529 -1.104 1
1 974 . 1 1 1 A 83 83 GLU CB C 83 29.701 29.113 0.588 1
1 976 . 1 1 1 A 83 83 GLU N N 83 119.549 117.916 1.633 1
1 977 . 1 1 1 A 84 84 GLU H H 84 8.033 7.789 0.244 1
1 978 . 1 1 1 A 84 84 GLU HA H 84 4.206 4.212 -0.006 1
1 983 . 1 1 1 A 84 84 GLU C C 84 176.837 175.776 1.061 1
1 984 . 1 1 1 A 84 84 GLU CA C 84 58.056 58.660 -0.604 1
1 985 . 1 1 1 A 84 84 GLU CB C 84 30.432 30.579 -0.147 1
1 987 . 1 1 1 A 84 84 GLU N N 84 118.333 119.381 -1.048 1
1 988 . 1 1 1 A 85 85 THR H H 85 7.651 7.545 0.106 1
1 989 . 1 1 1 A 85 85 THR HA H 85 4.307 4.760 -0.453 1
1 994 . 1 1 1 A 85 85 THR C C 85 171.568 173.314 -1.746 1
1 995 . 1 1 1 A 85 85 THR CA C 85 61.387 59.224 2.163 1
1 996 . 1 1 1 A 85 85 THR CB C 85 69.963 70.590 -0.627 1
1 998 . 1 1 1 A 85 85 THR N N 85 112.444 112.997 -0.553 1
1 999 . 1 1 1 A 86 86 ALA H H 86 8.639 8.469 0.170 1
1 1000 . 1 1 1 A 86 86 ALA HA H 86 4.603 4.439 0.164 1
1 1004 . 1 1 1 A 86 86 ALA C C 86 175.560 176.597 -1.037 1
1 1005 . 1 1 1 A 86 86 ALA CA C 86 52.156 53.295 -1.139 1
1 1006 . 1 1 1 A 86 86 ALA CB C 86 20.378 20.752 -0.374 1
1 1007 . 1 1 1 A 86 86 ALA N N 86 127.705 127.216 0.489 1
1 1008 . 1 1 1 A 87 87 ILE H H 87 7.663 7.737 -0.074 1
1 1009 . 1 1 1 A 87 87 ILE HA H 87 4.828 4.589 0.239 1
1 1019 . 1 1 1 A 87 87 ILE C C 87 174.537 174.601 -0.064 1
1 1020 . 1 1 1 A 87 87 ILE CA C 87 60.329 60.151 0.178 1
1 1021 . 1 1 1 A 87 87 ILE CB C 87 41.090 39.918 1.172 1
1 1025 . 1 1 1 A 87 87 ILE N N 87 118.712 116.697 2.015 1
1 1026 . 1 1 1 A 88 88 HIS H H 88 9.098 8.820 0.278 1
1 1027 . 1 1 1 A 88 88 HIS HA H 88 4.576 5.180 -0.604 1
1 1032 . 1 1 1 A 88 88 HIS C C 88 174.354 174.224 0.130 1
1 1033 . 1 1 1 A 88 88 HIS CA C 88 54.740 54.216 0.524 1
1 1034 . 1 1 1 A 88 88 HIS CB C 88 33.955 32.214 1.741 1
1 1037 . 1 1 1 A 88 88 HIS N N 88 126.285 125.853 0.432 1
1 1038 . 1 1 1 A 89 89 LYS H H 89 8.957 8.985 -0.028 1
1 1039 . 1 1 1 A 89 89 LYS HA H 89 4.873 4.714 0.159 1
1 1048 . 1 1 1 A 89 89 LYS C C 89 175.906 175.563 0.343 1
1 1049 . 1 1 1 A 89 89 LYS CA C 89 55.269 55.401 -0.132 1
1 1050 . 1 1 1 A 89 89 LYS CB C 89 32.945 33.429 -0.484 1
1 1054 . 1 1 1 A 89 89 LYS N N 89 124.332 123.984 0.348 1
1 1055 . 1 1 1 A 90 90 VAL H H 90 9.174 8.894 0.280 1
1 1056 . 1 1 1 A 90 90 VAL HA H 90 4.227 4.941 -0.714 1
1 1064 . 1 1 1 A 90 90 VAL C C 90 174.168 174.512 -0.344 1
1 1065 . 1 1 1 A 90 90 VAL CA C 90 61.369 60.968 0.401 1
1 1066 . 1 1 1 A 90 90 VAL CB C 90 34.082 34.464 -0.382 1
1 1069 . 1 1 1 A 90 90 VAL N N 90 124.319 125.056 -0.737 1
1 1070 . 1 1 1 A 91 91 THR H H 91 6.697 8.909 -2.212 1
1 1071 . 1 1 1 A 91 91 THR HA H 91 5.163 5.322 -0.159 1
1 1076 . 1 1 1 A 91 91 THR C C 91 173.812 173.967 -0.155 1
1 1077 . 1 1 1 A 91 91 THR CA C 91 61.935 61.568 0.367 1
1 1078 . 1 1 1 A 91 91 THR CB C 91 70.412 70.773 -0.361 1
1 1080 . 1 1 1 A 91 91 THR N N 91 122.637 124.079 -1.442 1
1 1081 . 1 1 1 A 92 92 VAL H H 92 9.292 8.756 0.536 1
1 1082 . 1 1 1 A 92 92 VAL HA H 92 4.736 4.810 -0.074 1
1 1090 . 1 1 1 A 92 92 VAL C C 92 173.160 175.060 -1.900 1
1 1091 . 1 1 1 A 92 92 VAL CA C 92 60.982 60.690 0.292 1
1 1092 . 1 1 1 A 92 92 VAL CB C 92 35.130 34.305 0.825 1
1 1095 . 1 1 1 A 92 92 VAL N N 92 128.265 125.770 2.495 1
1 1096 . 1 1 1 A 93 93 LEU H H 93 9.495 8.501 0.994 1
1 1097 . 1 1 1 A 93 93 LEU HA H 93 5.628 5.688 -0.060 1
1 1107 . 1 1 1 A 93 93 LEU C C 93 176.274 175.134 1.140 1
1 1108 . 1 1 1 A 93 93 LEU CA C 93 52.773 53.623 -0.850 1
1 1109 . 1 1 1 A 93 93 LEU CB C 93 43.454 44.152 -0.698 1
1 1113 . 1 1 1 A 93 93 LEU N N 93 126.350 126.569 -0.219 1
1 1114 . 1 1 1 A 94 94 ALA H H 94 8.688 8.880 -0.192 1
1 1115 . 1 1 1 A 94 94 ALA HA H 94 4.986 5.136 -0.150 1
1 1119 . 1 1 1 A 94 94 ALA C C 94 175.787 176.254 -0.467 1
1 1120 . 1 1 1 A 94 94 ALA CA C 94 49.610 50.155 -0.545 1
1 1121 . 1 1 1 A 94 94 ALA CB C 94 21.463 20.345 1.118 1
1 1122 . 1 1 1 A 94 94 ALA N N 94 123.429 128.382 -4.953 1
1 1123 . 1 1 1 A 95 95 SER H H 95 8.401 8.173 0.228 1
1 1124 . 1 1 1 A 95 95 SER HA H 95 4.828 5.326 -0.498 1
1 1127 . 1 1 1 A 95 95 SER C C 95 174.327 174.039 0.288 1
1 1128 . 1 1 1 A 95 95 SER CA C 95 56.239 56.447 -0.208 1
1 1129 . 1 1 1 A 95 95 SER CB C 95 65.561 64.649 0.912 1
1 1130 . 1 1 1 A 95 95 SER N N 95 114.418 116.165 -1.747 1
1 1131 . 1 1 1 A 96 96 ASP H H 96 8.690 8.976 -0.286 1
1 1132 . 1 1 1 A 96 96 ASP HA H 96 4.908 4.594 0.314 1
1 1135 . 1 1 1 A 96 96 ASP C C 96 177.096 176.767 0.329 1
1 1136 . 1 1 1 A 96 96 ASP CA C 96 52.818 55.264 -2.446 1
1 1137 . 1 1 1 A 96 96 ASP CB C 96 41.253 42.252 -0.999 1
1 1138 . 1 1 1 A 96 96 ASP N N 96 125.624 124.838 0.786 1
1 1139 . 1 1 1 A 97 97 GLY H H 97 8.524 7.354 1.170 1
1 1140 . 1 1 1 A 97 97 GLY HA2 H 97 4.320 4.139 0.181 1
1 1141 . 1 1 1 A 97 97 GLY HA3 H 97 3.620 4.141 -0.521 1
1 1142 . 1 1 1 A 97 97 GLY C C 97 174.620 173.098 1.522 1
1 1143 . 1 1 1 A 97 97 GLY CA C 97 45.422 45.575 -0.153 1
1 1144 . 1 1 1 A 97 97 GLY N N 97 109.283 106.883 2.400 1
1 1145 . 1 1 1 A 98 98 SER H H 98 8.575 7.690 0.885 1
1 1146 . 1 1 1 A 98 98 SER HA H 98 4.607 4.891 -0.284 1
1 1149 . 1 1 1 A 98 98 SER C C 98 174.478 174.857 -0.379 1
1 1150 . 1 1 1 A 98 98 SER CA C 98 59.095 56.079 3.016 1
1 1151 . 1 1 1 A 98 98 SER CB C 98 64.800 66.985 -2.185 1
1 1152 . 1 1 1 A 98 98 SER N N 98 116.640 112.903 3.737 1
1 1153 . 1 1 1 A 99 99 SER H H 99 8.945 8.591 0.354 1
1 1154 . 1 1 1 A 99 99 SER HA H 99 4.530 4.133 0.397 1
1 1157 . 1 1 1 A 99 99 SER C C 99 174.491 174.755 -0.264 1
1 1158 . 1 1 1 A 99 99 SER CA C 99 58.460 62.336 -3.876 1
1 1159 . 1 1 1 A 99 99 SER CB C 99 64.146 63.226 0.920 1
1 1160 . 1 1 1 A 99 99 SER N N 99 117.676 116.866 0.810 1
1 1161 . 1 1 1 A 100 100 THR H H 100 8.411 7.812 0.599 1
1 1162 . 1 1 1 A 100 100 THR HA H 100 4.490 4.863 -0.373 1
1 1167 . 1 1 1 A 100 100 THR C C 100 172.766 172.462 0.304 1
1 1168 . 1 1 1 A 100 100 THR CA C 100 60.629 58.562 2.067 1
1 1169 . 1 1 1 A 100 100 THR CB C 100 69.778 70.771 -0.993 1
1 1171 . 1 1 1 A 100 100 THR N N 100 118.401 109.927 8.474 1
1 1172 . 1 1 1 A 101 101 PRO HA H 101 4.631 4.573 0.058 1
1 1179 . 1 1 1 A 101 101 PRO C C 101 177.227 175.991 1.236 1
1 1180 . 1 1 1 A 101 101 PRO CA C 101 63.097 62.301 0.796 1
1 1181 . 1 1 1 A 101 101 PRO CB C 101 32.917 32.731 0.186 1
1 1184 . 1 1 1 A 102 102 ALA H H 102 8.497 8.035 0.462 1
1 1185 . 1 1 1 A 102 102 ALA HA H 102 4.619 4.937 -0.318 1
1 1189 . 1 1 1 A 102 102 ALA C C 102 176.542 177.268 -0.726 1
1 1190 . 1 1 1 A 102 102 ALA CA C 102 51.390 51.838 -0.448 1
1 1191 . 1 1 1 A 102 102 ALA CB C 102 20.815 20.867 -0.052 1
1 1192 . 1 1 1 A 102 102 ALA N N 102 124.487 122.891 1.596 1
1 1193 . 1 1 1 A 103 103 ARG H H 103 8.663 8.812 -0.149 1
1 1194 . 1 1 1 A 103 103 ARG HA H 103 5.515 5.040 0.475 1
1 1201 . 1 1 1 A 103 103 ARG C C 103 174.539 175.210 -0.671 1
1 1202 . 1 1 1 A 103 103 ARG CA C 103 55.164 55.406 -0.242 1
1 1203 . 1 1 1 A 103 103 ARG CB C 103 34.393 32.300 2.093 1
1 1206 . 1 1 1 A 103 103 ARG N N 103 119.596 120.701 -1.105 1
1 1207 . 1 1 1 A 104 104 ALA H H 104 9.027 8.179 0.848 1
1 1208 . 1 1 1 A 104 104 ALA HA H 104 4.782 5.014 -0.232 1
1 1212 . 1 1 1 A 104 104 ALA C C 104 176.276 175.417 0.859 1
1 1213 . 1 1 1 A 104 104 ALA CA C 104 50.297 50.918 -0.621 1
1 1214 . 1 1 1 A 104 104 ALA CB C 104 20.810 22.049 -1.239 1
1 1215 . 1 1 1 A 104 104 ALA N N 104 126.962 122.413 4.549 1
1 1216 . 1 1 1 A 105 105 THR H H 105 8.384 8.342 0.042 1
1 1217 . 1 1 1 A 105 105 THR HA H 105 4.954 4.790 0.164 1
1 1222 . 1 1 1 A 105 105 THR C C 105 173.243 173.561 -0.318 1
1 1223 . 1 1 1 A 105 105 THR CA C 105 61.475 62.167 -0.692 1
1 1224 . 1 1 1 A 105 105 THR CB C 105 70.569 70.790 -0.221 1
1 1226 . 1 1 1 A 105 105 THR N N 105 115.327 118.903 -3.576 1
1 1227 . 1 1 1 A 106 106 VAL H H 106 8.970 8.132 0.838 1
1 1228 . 1 1 1 A 106 106 VAL HA H 106 4.702 4.649 0.053 1
1 1236 . 1 1 1 A 106 106 VAL C C 106 174.743 174.631 0.112 1
1 1237 . 1 1 1 A 106 106 VAL CA C 106 59.712 61.138 -1.426 1
1 1238 . 1 1 1 A 106 106 VAL CB C 106 34.327 34.602 -0.275 1
1 1241 . 1 1 1 A 106 106 VAL N N 106 126.226 123.734 2.492 1
1 1242 . 1 1 1 A 107 107 THR H H 107 8.833 8.601 0.232 1
1 1243 . 1 1 1 A 107 107 THR HA H 107 4.862 5.073 -0.211 1
1 1248 . 1 1 1 A 107 107 THR C C 107 172.970 173.734 -0.764 1
1 1249 . 1 1 1 A 107 107 THR CA C 107 62.322 61.940 0.382 1
1 1250 . 1 1 1 A 107 107 THR CB C 107 69.463 69.927 -0.464 1
1 1252 . 1 1 1 A 107 107 THR N N 107 125.403 123.106 2.297 1
1 1253 . 1 1 1 A 108 108 ILE H H 108 9.234 9.324 -0.090 1
1 1254 . 1 1 1 A 108 108 ILE HA H 108 4.178 4.671 -0.493 1
1 1264 . 1 1 1 A 108 108 ILE C C 108 174.087 174.730 -0.643 1
1 1265 . 1 1 1 A 108 108 ILE CA C 108 60.365 60.521 -0.156 1
1 1266 . 1 1 1 A 108 108 ILE CB C 108 39.745 39.635 0.110 1
1 1270 . 1 1 1 A 108 108 ILE N N 108 127.152 128.751 -1.599 1
1 1271 . 1 1 1 A 109 109 ASN H H 109 8.723 9.026 -0.303 1
1 1272 . 1 1 1 A 109 109 ASN HA H 109 5.147 5.188 -0.041 1
1 1277 . 1 1 1 A 109 109 ASN C C 109 173.592 174.718 -1.126 1
1 1278 . 1 1 1 A 109 109 ASN CA C 109 52.501 53.043 -0.542 1
1 1279 . 1 1 1 A 109 109 ASN CB C 109 40.791 39.538 1.253 1
1 1280 . 1 1 1 A 109 109 ASN N N 109 126.866 126.502 0.364 1
1 1282 . 1 1 1 A 110 110 VAL H H 110 9.046 8.493 0.553 1
1 1283 . 1 1 1 A 110 110 VAL HA H 110 5.081 4.675 0.406 1
1 1291 . 1 1 1 A 110 110 VAL C C 110 176.921 176.205 0.716 1
1 1292 . 1 1 1 A 110 110 VAL CA C 110 61.634 62.233 -0.599 1
1 1293 . 1 1 1 A 110 110 VAL CB C 110 31.809 32.007 -0.198 1
1 1296 . 1 1 1 A 110 110 VAL N N 110 126.070 124.979 1.091 1
1 1297 . 1 1 1 A 111 111 THR H H 111 9.197 8.427 0.770 1
1 1298 . 1 1 1 A 111 111 THR HA H 111 4.566 5.007 -0.441 1
1 1303 . 1 1 1 A 111 111 THR C C 111 174.087 174.373 -0.286 1
1 1304 . 1 1 1 A 111 111 THR CA C 111 61.145 59.962 1.183 1
1 1305 . 1 1 1 A 111 111 THR CB C 111 70.706 70.805 -0.099 1
1 1307 . 1 1 1 A 111 111 THR N N 111 121.425 118.767 2.658 1
1 1308 . 1 1 1 A 112 112 ASP H H 112 8.435 8.687 -0.252 1
1 1309 . 1 1 1 A 112 112 ASP HA H 112 4.656 4.702 -0.046 1
1 1312 . 1 1 1 A 112 112 ASP C C 112 176.745 175.879 0.866 1
1 1313 . 1 1 1 A 112 112 ASP CA C 112 54.158 55.086 -0.928 1
1 1314 . 1 1 1 A 112 112 ASP CB C 112 41.575 41.734 -0.159 1
1 1315 . 1 1 1 A 112 112 ASP N N 112 119.566 123.711 -4.145 1
1 1316 . 1 1 1 A 113 113 VAL H H 113 8.629 8.460 0.169 1
1 1317 . 1 1 1 A 113 113 VAL HA H 113 4.078 4.684 -0.606 1
1 1325 . 1 1 1 A 113 113 VAL C C 113 175.247 174.356 0.891 1
1 1326 . 1 1 1 A 113 113 VAL CA C 113 62.533 59.766 2.767 1
1 1327 . 1 1 1 A 113 113 VAL CB C 113 32.534 35.086 -2.552 1
1 1330 . 1 1 1 A 113 113 VAL N N 113 119.356 117.592 1.764 1
1 4 . 2 1 1 A 2 2 SER H H 2 8.289 8.620 -0.331 1
1 5 . 2 1 1 A 2 2 SER HA H 2 4.530 4.485 0.045 1
1 7 . 2 1 1 A 2 2 SER C C 2 174.868 175.088 -0.220 1
1 8 . 2 1 1 A 2 2 SER CA C 2 58.284 61.283 -2.999 1
1 9 . 2 1 1 A 2 2 SER CB C 2 63.769 63.860 -0.091 1
1 10 . 2 1 1 A 2 2 SER N N 2 115.842 115.927 -0.085 1
1 11 . 2 1 1 A 3 3 SER H H 3 8.490 8.159 0.331 1
1 12 . 2 1 1 A 3 3 SER HA H 3 4.496 4.157 0.339 1
1 14 . 2 1 1 A 3 3 SER C C 3 175.043 173.679 1.364 1
1 15 . 2 1 1 A 3 3 SER CA C 3 58.549 59.109 -0.560 1
1 16 . 2 1 1 A 3 3 SER CB C 3 63.687 60.990 2.697 1
1 17 . 2 1 1 A 3 3 SER N N 3 117.930 115.544 2.386 1
1 18 . 2 1 1 A 4 4 GLY H H 4 8.482 7.839 0.643 1
1 19 . 2 1 1 A 4 4 GLY C C 4 174.344 172.930 1.414 1
1 20 . 2 1 1 A 4 4 GLY CA C 4 45.536 44.711 0.825 1
1 21 . 2 1 1 A 4 4 GLY N N 4 110.985 109.769 1.216 1
1 22 . 2 1 1 A 6 6 SER HA H 6 4.508 4.620 -0.112 1
1 24 . 2 1 1 A 6 6 SER C C 6 175.026 175.056 -0.030 1
1 25 . 2 1 1 A 6 6 SER CA C 6 58.584 59.068 -0.484 1
1 26 . 2 1 1 A 6 6 SER CB C 6 63.646 61.871 1.775 1
1 27 . 2 1 1 A 7 7 GLY H H 7 8.419 8.186 0.233 1
1 28 . 2 1 1 A 7 7 GLY HA2 H 7 3.993 4.097 -0.104 1
1 29 . 2 1 1 A 7 7 GLY C C 7 173.995 172.219 1.776 1
1 30 . 2 1 1 A 7 7 GLY CA C 7 45.466 44.464 1.002 1
1 31 . 2 1 1 A 7 7 GLY N N 7 110.615 115.213 -4.598 1
1 32 . 2 1 1 A 8 8 ASN H H 8 8.322 8.513 -0.191 1
1 33 . 2 1 1 A 8 8 ASN HA H 8 4.736 5.460 -0.724 1
1 38 . 2 1 1 A 8 8 ASN C C 8 174.907 172.781 2.126 1
1 39 . 2 1 1 A 8 8 ASN CA C 8 53.259 52.222 1.037 1
1 40 . 2 1 1 A 8 8 ASN CB C 8 39.127 41.859 -2.732 1
1 41 . 2 1 1 A 8 8 ASN N N 8 118.602 116.286 2.316 1
1 43 . 2 1 1 A 9 9 ASP H H 9 8.370 8.850 -0.480 1
1 44 . 2 1 1 A 9 9 ASP HA H 9 4.594 5.505 -0.911 1
1 47 . 2 1 1 A 9 9 ASP C C 9 175.765 174.714 1.051 1
1 48 . 2 1 1 A 9 9 ASP CA C 9 54.440 53.082 1.358 1
1 49 . 2 1 1 A 9 9 ASP CB C 9 40.898 44.117 -3.219 1
1 50 . 2 1 1 A 9 9 ASP N N 9 120.504 121.132 -0.628 1
1 51 . 2 1 1 A 10 10 ASN H H 10 8.382 8.727 -0.345 1
1 52 . 2 1 1 A 10 10 ASN HA H 10 4.691 5.101 -0.410 1
1 57 . 2 1 1 A 10 10 ASN C C 10 174.383 173.494 0.889 1
1 58 . 2 1 1 A 10 10 ASN CA C 10 53.241 52.899 0.342 1
1 59 . 2 1 1 A 10 10 ASN CB C 10 38.674 42.974 -4.300 1
1 60 . 2 1 1 A 10 10 ASN N N 10 119.406 121.451 -2.045 1
1 62 . 2 1 1 A 11 11 ARG H H 11 7.942 8.549 -0.607 1
1 63 . 2 1 1 A 11 11 ARG HA H 11 4.684 4.718 -0.034 1
1 70 . 2 1 1 A 11 11 ARG C C 11 173.640 174.075 -0.435 1
1 71 . 2 1 1 A 11 11 ARG CA C 11 54.246 53.528 0.718 1
1 72 . 2 1 1 A 11 11 ARG CB C 11 30.337 29.781 0.556 1
1 75 . 2 1 1 A 11 11 ARG N N 11 121.145 125.968 -4.823 1
1 76 . 2 1 1 A 12 12 PRO HA H 12 4.507 4.618 -0.111 1
1 83 . 2 1 1 A 12 12 PRO CA C 12 62.714 62.359 0.355 1
1 84 . 2 1 1 A 12 12 PRO CB C 12 31.942 32.018 -0.076 1
1 87 . 2 1 1 A 13 13 VAL H H 13 8.252 8.145 0.107 1
1 88 . 2 1 1 A 13 13 VAL HA H 13 4.159 4.605 -0.446 1
1 96 . 2 1 1 A 13 13 VAL CA C 13 61.409 59.795 1.614 1
1 97 . 2 1 1 A 13 13 VAL CB C 13 34.858 34.240 0.618 1
1 100 . 2 1 1 A 13 13 VAL N N 13 118.395 116.584 1.811 1
1 101 . 2 1 1 A 14 14 PHE H H 14 8.725 8.837 -0.112 1
1 102 . 2 1 1 A 14 14 PHE HA H 14 4.781 4.775 0.006 1
1 110 . 2 1 1 A 14 14 PHE CA C 14 58.594 58.077 0.517 1
1 111 . 2 1 1 A 14 14 PHE CB C 14 39.594 39.890 -0.296 1
1 117 . 2 1 1 A 14 14 PHE N N 14 122.950 124.356 -1.406 1
1 118 . 2 1 1 A 15 15 LYS H H 15 8.885 8.826 0.059 1
1 119 . 2 1 1 A 15 15 LYS HA H 15 4.130 4.194 -0.064 1
1 128 . 2 1 1 A 15 15 LYS C C 15 177.027 176.488 0.539 1
1 129 . 2 1 1 A 15 15 LYS CA C 15 58.478 58.909 -0.431 1
1 130 . 2 1 1 A 15 15 LYS CB C 15 32.748 32.224 0.524 1
1 134 . 2 1 1 A 15 15 LYS N N 15 123.863 123.214 0.649 1
1 135 . 2 1 1 A 16 16 GLU H H 16 8.091 8.071 0.020 1
1 136 . 2 1 1 A 16 16 GLU HA H 16 4.438 4.731 -0.293 1
1 141 . 2 1 1 A 16 16 GLU C C 16 175.947 176.605 -0.658 1
1 142 . 2 1 1 A 16 16 GLU CA C 16 56.045 55.289 0.756 1
1 143 . 2 1 1 A 16 16 GLU CB C 16 30.766 33.437 -2.671 1
1 145 . 2 1 1 A 16 16 GLU N N 16 117.026 118.915 -1.889 1
1 146 . 2 1 1 A 17 17 GLY H H 17 8.421 8.745 -0.324 1
1 147 . 2 1 1 A 17 17 GLY HA2 H 17 3.993 3.883 0.110 1
1 148 . 2 1 1 A 17 17 GLY HA3 H 17 3.913 3.897 0.016 1
1 149 . 2 1 1 A 17 17 GLY C C 17 173.564 174.225 -0.661 1
1 150 . 2 1 1 A 17 17 GLY CA C 17 45.448 46.813 -1.365 1
1 151 . 2 1 1 A 17 17 GLY N N 17 109.577 111.094 -1.517 1
1 152 . 2 1 1 A 18 18 GLN H H 18 7.858 7.907 -0.049 1
1 153 . 2 1 1 A 18 18 GLN HA H 18 5.065 4.823 0.242 1
1 160 . 2 1 1 A 18 18 GLN C C 18 174.596 174.771 -0.175 1
1 161 . 2 1 1 A 18 18 GLN CA C 18 55.110 54.646 0.464 1
1 162 . 2 1 1 A 18 18 GLN CB C 18 30.329 30.928 -0.599 1
1 164 . 2 1 1 A 18 18 GLN N N 18 120.202 119.576 0.626 1
1 166 . 2 1 1 A 19 19 VAL H H 19 8.216 8.935 -0.719 1
1 167 . 2 1 1 A 19 19 VAL HA H 19 4.450 4.620 -0.170 1
1 175 . 2 1 1 A 19 19 VAL C C 19 173.648 174.009 -0.361 1
1 176 . 2 1 1 A 19 19 VAL CA C 19 60.788 60.994 -0.206 1
1 177 . 2 1 1 A 19 19 VAL CB C 19 35.336 35.094 0.242 1
1 180 . 2 1 1 A 19 19 VAL N N 19 121.257 126.010 -4.753 1
1 181 . 2 1 1 A 20 20 GLU H H 20 8.610 9.013 -0.403 1
1 182 . 2 1 1 A 20 20 GLU HA H 20 5.211 5.123 0.088 1
1 187 . 2 1 1 A 20 20 GLU C C 20 174.783 176.220 -1.437 1
1 188 . 2 1 1 A 20 20 GLU CA C 20 54.793 55.473 -0.680 1
1 189 . 2 1 1 A 20 20 GLU CB C 20 32.058 31.595 0.463 1
1 191 . 2 1 1 A 20 20 GLU N N 20 127.095 128.654 -1.559 1
1 192 . 2 1 1 A 21 21 VAL H H 21 8.727 9.135 -0.408 1
1 193 . 2 1 1 A 21 21 VAL HA H 21 4.633 5.065 -0.432 1
1 201 . 2 1 1 A 21 21 VAL C C 21 173.894 174.967 -1.073 1
1 202 . 2 1 1 A 21 21 VAL CA C 21 59.695 59.586 0.109 1
1 203 . 2 1 1 A 21 21 VAL CB C 21 35.865 34.577 1.288 1
1 206 . 2 1 1 A 21 21 VAL N N 21 120.489 121.525 -1.036 1
1 207 . 2 1 1 A 22 22 HIS H H 22 8.680 8.968 -0.288 1
1 208 . 2 1 1 A 22 22 HIS HA H 22 5.552 5.682 -0.130 1
1 212 . 2 1 1 A 22 22 HIS C C 22 174.298 173.645 0.653 1
1 213 . 2 1 1 A 22 22 HIS CA C 22 55.331 53.944 1.387 1
1 214 . 2 1 1 A 22 22 HIS CB C 22 32.369 31.880 0.489 1
1 216 . 2 1 1 A 22 22 HIS N N 22 124.991 120.001 4.990 1
1 217 . 2 1 1 A 23 23 ILE H H 23 9.179 9.018 0.161 1
1 218 . 2 1 1 A 23 23 ILE HA H 23 5.046 4.542 0.504 1
1 228 . 2 1 1 A 23 23 ILE C C 23 171.552 173.632 -2.080 1
1 229 . 2 1 1 A 23 23 ILE CA C 23 55.551 57.148 -1.597 1
1 230 . 2 1 1 A 23 23 ILE CB C 23 42.053 42.072 -0.019 1
1 234 . 2 1 1 A 23 23 ILE N N 23 123.121 123.417 -0.296 1
1 235 . 2 1 1 A 24 24 PRO HA H 24 4.816 4.648 0.168 1
1 242 . 2 1 1 A 24 24 PRO C C 24 178.887 177.240 1.647 1
1 243 . 2 1 1 A 24 24 PRO CA C 24 62.216 62.581 -0.365 1
1 244 . 2 1 1 A 24 24 PRO CB C 24 32.895 32.825 0.070 1
1 247 . 2 1 1 A 25 25 GLU H H 25 8.399 8.156 0.243 1
1 248 . 2 1 1 A 25 25 GLU HA H 25 3.785 4.065 -0.280 1
1 253 . 2 1 1 A 25 25 GLU C C 25 175.244 177.005 -1.761 1
1 254 . 2 1 1 A 25 25 GLU CA C 25 58.425 58.451 -0.026 1
1 255 . 2 1 1 A 25 25 GLU CB C 25 30.011 29.213 0.798 1
1 257 . 2 1 1 A 25 25 GLU N N 25 117.706 121.594 -3.888 1
1 258 . 2 1 1 A 26 26 ASN H H 26 7.488 7.805 -0.317 1
1 259 . 2 1 1 A 26 26 ASN HA H 26 4.702 4.812 -0.110 1
1 264 . 2 1 1 A 26 26 ASN C C 26 175.425 175.260 0.165 1
1 265 . 2 1 1 A 26 26 ASN CA C 26 51.584 52.093 -0.509 1
1 266 . 2 1 1 A 26 26 ASN CB C 26 37.243 38.592 -1.349 1
1 267 . 2 1 1 A 26 26 ASN N N 26 112.383 117.660 -5.277 1
1 269 . 2 1 1 A 27 27 ALA H H 27 7.716 7.334 0.382 1
1 270 . 2 1 1 A 27 27 ALA HA H 27 4.409 4.341 0.068 1
1 274 . 2 1 1 A 27 27 ALA C C 27 175.850 175.897 -0.047 1
1 275 . 2 1 1 A 27 27 ALA CA C 27 51.037 50.956 0.081 1
1 276 . 2 1 1 A 27 27 ALA CB C 27 18.152 18.414 -0.262 1
1 277 . 2 1 1 A 27 27 ALA N N 27 125.139 122.467 2.672 1
1 278 . 2 1 1 A 28 28 PRO HA H 28 4.422 4.495 -0.073 1
1 285 . 2 1 1 A 28 28 PRO C C 28 178.442 176.871 1.571 1
1 286 . 2 1 1 A 28 28 PRO CA C 28 62.067 62.664 -0.597 1
1 287 . 2 1 1 A 28 28 PRO CB C 28 32.642 32.026 0.616 1
1 290 . 2 1 1 A 29 29 VAL H H 29 8.691 8.272 0.419 1
1 291 . 2 1 1 A 29 29 VAL HA H 29 3.239 3.581 -0.342 1
1 299 . 2 1 1 A 29 29 VAL C C 29 176.887 177.242 -0.355 1
1 300 . 2 1 1 A 29 29 VAL CA C 29 65.812 64.086 1.726 1
1 301 . 2 1 1 A 29 29 VAL CB C 29 31.174 31.443 -0.269 1
1 304 . 2 1 1 A 29 29 VAL N N 29 123.592 122.743 0.849 1
1 305 . 2 1 1 A 30 30 GLY H H 30 9.197 8.877 0.320 1
1 306 . 2 1 1 A 30 30 GLY HA2 H 30 4.486 3.932 0.554 1
1 307 . 2 1 1 A 30 30 GLY HA3 H 30 3.581 3.933 -0.352 1
1 308 . 2 1 1 A 30 30 GLY C C 30 174.347 174.799 -0.452 1
1 309 . 2 1 1 A 30 30 GLY CA C 30 44.320 45.100 -0.780 1
1 310 . 2 1 1 A 30 30 GLY N N 30 116.042 115.186 0.856 1
1 311 . 2 1 1 A 31 31 THR H H 31 7.838 7.795 0.043 1
1 312 . 2 1 1 A 31 31 THR HA H 31 3.959 4.215 -0.256 1
1 317 . 2 1 1 A 31 31 THR C C 31 174.274 174.046 0.228 1
1 318 . 2 1 1 A 31 31 THR CA C 31 65.160 62.872 2.288 1
1 319 . 2 1 1 A 31 31 THR CB C 31 69.972 69.533 0.439 1
1 321 . 2 1 1 A 31 31 THR N N 31 117.679 117.605 0.074 1
1 322 . 2 1 1 A 32 32 SER H H 32 9.022 8.713 0.309 1
1 323 . 2 1 1 A 32 32 SER HA H 32 4.273 4.918 -0.645 1
1 326 . 2 1 1 A 32 32 SER C C 32 172.692 174.268 -1.576 1
1 327 . 2 1 1 A 32 32 SER CA C 32 59.642 57.171 2.471 1
1 328 . 2 1 1 A 32 32 SER CB C 32 63.102 63.410 -0.308 1
1 329 . 2 1 1 A 32 32 SER N N 32 123.045 119.550 3.495 1
1 330 . 2 1 1 A 33 33 VAL H H 33 9.202 8.488 0.714 1
1 331 . 2 1 1 A 33 33 VAL HA H 33 3.844 3.950 -0.106 1
1 339 . 2 1 1 A 33 33 VAL C C 33 174.782 175.781 -0.999 1
1 340 . 2 1 1 A 33 33 VAL CA C 33 64.242 64.823 -0.581 1
1 341 . 2 1 1 A 33 33 VAL CB C 33 32.893 32.216 0.677 1
1 344 . 2 1 1 A 33 33 VAL N N 33 126.861 125.505 1.356 1
1 345 . 2 1 1 A 34 34 ILE H H 34 7.074 7.920 -0.846 1
1 346 . 2 1 1 A 34 34 ILE HA H 34 4.295 4.698 -0.403 1
1 356 . 2 1 1 A 34 34 ILE C C 34 170.577 173.270 -2.693 1
1 357 . 2 1 1 A 34 34 ILE CA C 34 59.500 59.285 0.215 1
1 358 . 2 1 1 A 34 34 ILE CB C 34 39.251 42.177 -2.926 1
1 362 . 2 1 1 A 34 34 ILE N N 34 111.445 118.983 -7.538 1
1 363 . 2 1 1 A 35 35 GLN H H 35 8.450 9.035 -0.585 1
1 364 . 2 1 1 A 35 35 GLN HA H 35 4.633 4.967 -0.334 1
1 371 . 2 1 1 A 35 35 GLN C C 35 174.354 174.473 -0.119 1
1 372 . 2 1 1 A 35 35 GLN CA C 35 54.176 54.035 0.141 1
1 373 . 2 1 1 A 35 35 GLN CB C 35 29.456 32.311 -2.855 1
1 375 . 2 1 1 A 35 35 GLN N N 35 127.342 127.769 -0.427 1
1 377 . 2 1 1 A 36 36 LEU H H 36 7.761 9.211 -1.450 1
1 378 . 2 1 1 A 36 36 LEU HA H 36 4.492 4.899 -0.407 1
1 388 . 2 1 1 A 36 36 LEU C C 36 175.543 174.793 0.750 1
1 389 . 2 1 1 A 36 36 LEU CA C 36 53.982 53.462 0.520 1
1 390 . 2 1 1 A 36 36 LEU CB C 36 42.776 42.736 0.040 1
1 394 . 2 1 1 A 36 36 LEU N N 36 128.895 128.006 0.889 1
1 395 . 2 1 1 A 37 37 HIS H H 37 8.529 9.192 -0.663 1
1 396 . 2 1 1 A 37 37 HIS HA H 37 4.851 5.410 -0.559 1
1 400 . 2 1 1 A 37 37 HIS C C 37 172.985 173.753 -0.768 1
1 401 . 2 1 1 A 37 37 HIS CA C 37 55.833 54.043 1.790 1
1 402 . 2 1 1 A 37 37 HIS CB C 37 32.204 31.968 0.236 1
1 404 . 2 1 1 A 37 37 HIS N N 37 115.903 125.652 -9.749 1
1 405 . 2 1 1 A 38 38 ALA H H 38 8.474 9.088 -0.614 1
1 406 . 2 1 1 A 38 38 ALA HA H 38 4.691 5.344 -0.653 1
1 410 . 2 1 1 A 38 38 ALA C C 38 175.548 176.256 -0.708 1
1 411 . 2 1 1 A 38 38 ALA CA C 38 50.491 50.370 0.121 1
1 412 . 2 1 1 A 38 38 ALA CB C 38 19.842 21.757 -1.915 1
1 413 . 2 1 1 A 38 38 ALA N N 38 128.891 130.416 -1.525 1
1 414 . 2 1 1 A 39 39 THR H H 39 8.095 8.845 -0.750 1
1 415 . 2 1 1 A 39 39 THR HA H 39 4.336 5.135 -0.799 1
1 420 . 2 1 1 A 39 39 THR C C 39 173.553 172.499 1.054 1
1 421 . 2 1 1 A 39 39 THR CA C 39 60.417 60.103 0.314 1
1 422 . 2 1 1 A 39 39 THR CB C 39 70.912 71.959 -1.047 1
1 424 . 2 1 1 A 39 39 THR N N 39 110.982 112.009 -1.027 1
1 425 . 2 1 1 A 40 40 ASP H H 40 8.417 8.735 -0.318 1
1 426 . 2 1 1 A 40 40 ASP HA H 40 4.553 5.009 -0.456 1
1 429 . 2 1 1 A 40 40 ASP C C 40 176.462 174.523 1.939 1
1 430 . 2 1 1 A 40 40 ASP CA C 40 54.158 52.845 1.313 1
1 431 . 2 1 1 A 40 40 ASP CB C 40 41.517 45.050 -3.533 1
1 432 . 2 1 1 A 40 40 ASP N N 40 121.450 121.142 0.308 1
1 433 . 2 1 1 A 41 41 ALA H H 41 8.435 8.351 0.084 1
1 434 . 2 1 1 A 41 41 ALA HA H 41 4.129 4.137 -0.008 1
1 438 . 2 1 1 A 41 41 ALA C C 41 177.718 177.616 0.102 1
1 439 . 2 1 1 A 41 41 ALA CA C 41 53.436 52.820 0.616 1
1 440 . 2 1 1 A 41 41 ALA CB C 41 19.183 19.477 -0.294 1
1 441 . 2 1 1 A 41 41 ALA N N 41 124.607 125.477 -0.870 1
1 442 . 2 1 1 A 42 42 ASP H H 42 8.310 8.858 -0.548 1
1 443 . 2 1 1 A 42 42 ASP HA H 42 4.588 4.264 0.324 1
1 446 . 2 1 1 A 42 42 ASP C C 42 176.546 176.915 -0.369 1
1 447 . 2 1 1 A 42 42 ASP CA C 42 54.599 57.606 -3.007 1
1 448 . 2 1 1 A 42 42 ASP CB C 42 41.146 41.125 0.021 1
1 449 . 2 1 1 A 42 42 ASP N N 42 118.030 124.688 -6.658 1
1 450 . 2 1 1 A 43 43 ILE H H 43 8.000 7.833 0.167 1
1 451 . 2 1 1 A 43 43 ILE HA H 43 4.130 3.809 0.321 1
1 461 . 2 1 1 A 43 43 ILE C C 43 176.901 175.949 0.952 1
1 462 . 2 1 1 A 43 43 ILE CA C 43 61.740 62.868 -1.128 1
1 463 . 2 1 1 A 43 43 ILE CB C 43 38.491 37.788 0.703 1
1 467 . 2 1 1 A 43 43 ILE N N 43 119.301 119.134 0.167 1
1 468 . 2 1 1 A 44 44 GLY H H 44 8.448 8.526 -0.078 1
1 469 . 2 1 1 A 44 44 GLY HA2 H 44 3.939 4.184 -0.245 1
1 470 . 2 1 1 A 44 44 GLY HA3 H 44 3.939 4.185 -0.246 1
1 471 . 2 1 1 A 44 44 GLY C C 44 174.393 171.629 2.764 1
1 472 . 2 1 1 A 44 44 GLY CA C 44 45.501 45.527 -0.026 1
1 473 . 2 1 1 A 44 44 GLY N N 44 111.333 116.043 -4.710 1
1 474 . 2 1 1 A 45 45 SER H H 45 8.061 8.460 -0.399 1
1 475 . 2 1 1 A 45 45 SER HA H 45 4.416 5.204 -0.788 1
1 478 . 2 1 1 A 45 45 SER C C 45 174.480 173.237 1.243 1
1 479 . 2 1 1 A 45 45 SER CA C 45 58.478 56.481 1.997 1
1 480 . 2 1 1 A 45 45 SER CB C 45 63.943 65.684 -1.741 1
1 481 . 2 1 1 A 45 45 SER N N 45 115.551 119.291 -3.740 1
1 482 . 2 1 1 A 46 46 ASN H H 46 8.547 8.688 -0.141 1
1 483 . 2 1 1 A 46 46 ASN HA H 46 4.725 4.843 -0.118 1
1 488 . 2 1 1 A 46 46 ASN C C 46 175.031 174.933 0.098 1
1 489 . 2 1 1 A 46 46 ASN CA C 46 53.277 53.153 0.124 1
1 490 . 2 1 1 A 46 46 ASN CB C 46 38.798 38.711 0.087 1
1 491 . 2 1 1 A 46 46 ASN N N 46 120.698 121.605 -0.907 1
1 493 . 2 1 1 A 47 47 ALA H H 47 8.239 8.851 -0.612 1
1 494 . 2 1 1 A 47 47 ALA HA H 47 4.283 5.307 -1.024 1
1 498 . 2 1 1 A 47 47 ALA C C 47 177.240 175.853 1.387 1
1 499 . 2 1 1 A 47 47 ALA CA C 47 52.731 50.137 2.594 1
1 500 . 2 1 1 A 47 47 ALA CB C 47 19.594 21.298 -1.704 1
1 501 . 2 1 1 A 47 47 ALA N N 47 124.093 126.878 -2.785 1
1 502 . 2 1 1 A 48 48 GLU H H 48 8.376 8.736 -0.360 1
1 503 . 2 1 1 A 48 48 GLU HA H 48 4.264 4.560 -0.296 1
1 508 . 2 1 1 A 48 48 GLU C C 48 175.702 175.311 0.391 1
1 509 . 2 1 1 A 48 48 GLU CA C 48 55.992 55.301 0.691 1
1 510 . 2 1 1 A 48 48 GLU CB C 48 30.210 29.649 0.561 1
1 512 . 2 1 1 A 48 48 GLU N N 48 119.750 122.826 -3.076 1
1 513 . 2 1 1 A 49 49 ILE H H 49 7.806 8.133 -0.327 1
1 514 . 2 1 1 A 49 49 ILE HA H 49 3.919 3.891 0.028 1
1 524 . 2 1 1 A 49 49 ILE C C 49 175.894 175.140 0.754 1
1 525 . 2 1 1 A 49 49 ILE CA C 49 60.559 61.693 -1.134 1
1 526 . 2 1 1 A 49 49 ILE CB C 49 37.860 37.425 0.435 1
1 530 . 2 1 1 A 49 49 ILE N N 49 122.772 124.930 -2.158 1
1 531 . 2 1 1 A 50 50 ARG H H 50 8.247 7.990 0.257 1
1 532 . 2 1 1 A 50 50 ARG HA H 50 4.999 4.440 0.559 1
1 539 . 2 1 1 A 50 50 ARG C C 50 174.603 174.663 -0.060 1
1 540 . 2 1 1 A 50 50 ARG CA C 50 53.189 54.866 -1.677 1
1 541 . 2 1 1 A 50 50 ARG CB C 50 33.152 32.380 0.772 1
1 544 . 2 1 1 A 50 50 ARG N N 50 126.912 127.412 -0.500 1
1 545 . 2 1 1 A 51 51 TYR H H 51 9.041 8.896 0.145 1
1 546 . 2 1 1 A 51 51 TYR HA H 51 5.395 5.613 -0.218 1
1 553 . 2 1 1 A 51 51 TYR C C 51 175.555 175.786 -0.231 1
1 554 . 2 1 1 A 51 51 TYR CA C 51 56.909 57.037 -0.128 1
1 555 . 2 1 1 A 51 51 TYR CB C 51 40.116 40.016 0.100 1
1 560 . 2 1 1 A 51 51 TYR N N 51 121.627 121.973 -0.346 1
1 561 . 2 1 1 A 52 52 ILE H H 52 8.850 8.507 0.343 1
1 562 . 2 1 1 A 52 52 ILE HA H 52 4.576 4.987 -0.411 1
1 572 . 2 1 1 A 52 52 ILE C C 52 175.371 175.251 0.120 1
1 573 . 2 1 1 A 52 52 ILE CA C 52 59.624 59.232 0.392 1
1 574 . 2 1 1 A 52 52 ILE CB C 52 42.895 41.786 1.109 1
1 578 . 2 1 1 A 52 52 ILE N N 52 117.697 119.181 -1.484 1
1 579 . 2 1 1 A 53 53 PHE H H 53 8.748 8.891 -0.143 1
1 580 . 2 1 1 A 53 53 PHE HA H 53 5.132 4.538 0.594 1
1 588 . 2 1 1 A 53 53 PHE C C 53 178.146 176.430 1.716 1
1 589 . 2 1 1 A 53 53 PHE CA C 53 57.667 58.910 -1.243 1
1 590 . 2 1 1 A 53 53 PHE CB C 53 39.614 39.599 0.015 1
1 596 . 2 1 1 A 53 53 PHE N N 53 121.433 123.471 -2.038 1
1 597 . 2 1 1 A 54 54 GLY H H 54 8.538 8.830 -0.292 1
1 598 . 2 1 1 A 54 54 GLY HA2 H 54 4.074 4.102 -0.028 1
1 599 . 2 1 1 A 54 54 GLY HA3 H 54 3.840 4.104 -0.264 1
1 600 . 2 1 1 A 54 54 GLY C C 54 174.530 172.838 1.692 1
1 601 . 2 1 1 A 54 54 GLY CA C 54 44.884 44.527 0.357 1
1 602 . 2 1 1 A 54 54 GLY N N 54 106.444 110.574 -4.130 1
1 603 . 2 1 1 A 55 55 ALA H H 55 8.594 8.350 0.244 1
1 604 . 2 1 1 A 55 55 ALA HA H 55 4.172 4.498 -0.326 1
1 608 . 2 1 1 A 55 55 ALA C C 55 178.718 177.538 1.180 1
1 609 . 2 1 1 A 55 55 ALA CA C 55 54.423 51.098 3.325 1
1 610 . 2 1 1 A 55 55 ALA CB C 55 19.059 20.355 -1.296 1
1 611 . 2 1 1 A 55 55 ALA N N 55 123.470 121.821 1.649 1
1 612 . 2 1 1 A 56 56 GLN H H 56 8.727 8.765 -0.038 1
1 613 . 2 1 1 A 56 56 GLN HA H 56 4.367 3.779 0.588 1
1 620 . 2 1 1 A 56 56 GLN C C 56 176.134 174.782 1.352 1
1 621 . 2 1 1 A 56 56 GLN CA C 56 55.660 56.710 -1.050 1
1 622 . 2 1 1 A 56 56 GLN CB C 56 28.152 26.785 1.367 1
1 624 . 2 1 1 A 56 56 GLN N N 56 114.221 115.876 -1.655 1
1 626 . 2 1 1 A 57 57 VAL H H 57 7.204 7.830 -0.626 1
1 627 . 2 1 1 A 57 57 VAL HA H 57 3.889 4.112 -0.223 1
1 635 . 2 1 1 A 57 57 VAL C C 57 175.371 175.313 0.058 1
1 636 . 2 1 1 A 57 57 VAL CA C 57 63.908 61.741 2.167 1
1 637 . 2 1 1 A 57 57 VAL CB C 57 31.557 32.289 -0.732 1
1 640 . 2 1 1 A 57 57 VAL N N 57 121.341 120.059 1.282 1
1 641 . 2 1 1 A 58 58 ALA H H 58 8.920 8.485 0.435 1
1 642 . 2 1 1 A 58 58 ALA HA H 58 4.547 4.318 0.229 1
1 646 . 2 1 1 A 58 58 ALA C C 58 177.064 177.824 -0.760 1
1 647 . 2 1 1 A 58 58 ALA CA C 58 51.173 50.782 0.391 1
1 648 . 2 1 1 A 58 58 ALA CB C 58 17.842 18.183 -0.341 1
1 649 . 2 1 1 A 58 58 ALA N N 58 132.726 130.712 2.014 1
1 650 . 2 1 1 A 59 59 PRO HA H 59 4.101 4.249 -0.148 1
1 657 . 2 1 1 A 59 59 PRO C C 59 179.482 178.427 1.055 1
1 658 . 2 1 1 A 59 59 PRO CA C 59 66.060 65.508 0.552 1
1 659 . 2 1 1 A 59 59 PRO CB C 59 31.951 31.817 0.134 1
1 662 . 2 1 1 A 60 60 ALA H H 60 8.706 8.245 0.461 1
1 663 . 2 1 1 A 60 60 ALA HA H 60 4.057 4.005 0.052 1
1 667 . 2 1 1 A 60 60 ALA C C 60 179.627 180.388 -0.761 1
1 668 . 2 1 1 A 60 60 ALA CA C 60 55.305 55.241 0.064 1
1 669 . 2 1 1 A 60 60 ALA CB C 60 18.737 18.274 0.463 1
1 670 . 2 1 1 A 60 60 ALA N N 60 117.882 118.721 -0.839 1
1 671 . 2 1 1 A 61 61 THR H H 61 7.312 7.968 -0.656 1
1 672 . 2 1 1 A 61 61 THR HA H 61 4.153 4.027 0.126 1
1 677 . 2 1 1 A 61 61 THR C C 61 175.824 176.755 -0.931 1
1 678 . 2 1 1 A 61 61 THR CA C 61 66.412 66.952 -0.540 1
1 679 . 2 1 1 A 61 61 THR CB C 61 68.787 68.819 -0.032 1
1 681 . 2 1 1 A 61 61 THR N N 61 114.483 113.866 0.617 1
1 682 . 2 1 1 A 62 62 LYS H H 62 7.556 7.601 -0.045 1
1 683 . 2 1 1 A 62 62 LYS HA H 62 3.943 3.403 0.540 1
1 692 . 2 1 1 A 62 62 LYS C C 62 176.884 178.589 -1.705 1
1 693 . 2 1 1 A 62 62 LYS CA C 62 59.095 59.366 -0.271 1
1 694 . 2 1 1 A 62 62 LYS CB C 62 32.204 31.754 0.450 1
1 698 . 2 1 1 A 62 62 LYS N N 62 118.994 118.979 0.015 1
1 699 . 2 1 1 A 63 63 ARG H H 63 7.474 7.435 0.039 1
1 700 . 2 1 1 A 63 63 ARG HA H 63 4.034 4.078 -0.044 1
1 707 . 2 1 1 A 63 63 ARG C C 63 177.574 178.603 -1.029 1
1 708 . 2 1 1 A 63 63 ARG CA C 63 58.143 58.862 -0.719 1
1 709 . 2 1 1 A 63 63 ARG CB C 63 30.755 30.329 0.426 1
1 712 . 2 1 1 A 63 63 ARG N N 63 114.251 120.078 -5.827 1
1 713 . 2 1 1 A 64 64 LEU H H 64 6.991 7.928 -0.937 1
1 714 . 2 1 1 A 64 64 LEU HA H 64 3.904 3.900 0.004 1
1 724 . 2 1 1 A 64 64 LEU C C 64 176.632 176.520 0.112 1
1 725 . 2 1 1 A 64 64 LEU CA C 64 56.503 58.071 -1.568 1
1 726 . 2 1 1 A 64 64 LEU CB C 64 42.929 41.821 1.108 1
1 730 . 2 1 1 A 64 64 LEU N N 64 116.109 119.977 -3.868 1
1 731 . 2 1 1 A 65 65 PHE H H 65 7.673 8.341 -0.668 1
1 732 . 2 1 1 A 65 65 PHE HA H 65 5.386 5.207 0.179 1
1 740 . 2 1 1 A 65 65 PHE C C 65 173.067 174.641 -1.574 1
1 741 . 2 1 1 A 65 65 PHE CA C 65 56.521 56.293 0.228 1
1 742 . 2 1 1 A 65 65 PHE CB C 65 41.270 41.642 -0.372 1
1 748 . 2 1 1 A 65 65 PHE N N 65 116.182 114.691 1.491 1
1 749 . 2 1 1 A 66 66 ALA H H 66 8.914 9.058 -0.144 1
1 750 . 2 1 1 A 66 66 ALA HA H 66 4.748 5.236 -0.488 1
1 754 . 2 1 1 A 66 66 ALA C C 66 175.223 175.359 -0.136 1
1 755 . 2 1 1 A 66 66 ALA CA C 66 50.050 50.324 -0.274 1
1 756 . 2 1 1 A 66 66 ALA CB C 66 21.161 21.133 0.028 1
1 757 . 2 1 1 A 66 66 ALA N N 66 122.870 125.456 -2.586 1
1 758 . 2 1 1 A 67 67 LEU H H 67 8.498 9.260 -0.762 1
1 759 . 2 1 1 A 67 67 LEU HA H 67 4.713 4.939 -0.226 1
1 769 . 2 1 1 A 67 67 LEU C C 67 175.146 175.239 -0.093 1
1 770 . 2 1 1 A 67 67 LEU CA C 67 52.518 53.532 -1.014 1
1 771 . 2 1 1 A 67 67 LEU CB C 67 45.308 44.335 0.973 1
1 775 . 2 1 1 A 67 67 LEU N N 67 122.208 126.821 -4.613 1
1 776 . 2 1 1 A 68 68 ASN H H 68 8.357 8.606 -0.249 1
1 777 . 2 1 1 A 68 68 ASN HA H 68 4.679 4.727 -0.048 1
1 782 . 2 1 1 A 68 68 ASN C C 68 176.228 175.718 0.510 1
1 783 . 2 1 1 A 68 68 ASN CA C 68 53.524 53.763 -0.239 1
1 784 . 2 1 1 A 68 68 ASN CB C 68 39.580 39.236 0.344 1
1 785 . 2 1 1 A 68 68 ASN N N 68 126.940 125.744 1.196 1
1 787 . 2 1 1 A 69 69 ASN H H 69 8.861 9.047 -0.186 1
1 788 . 2 1 1 A 69 69 ASN HA H 69 5.137 5.068 0.069 1
1 793 . 2 1 1 A 69 69 ASN C C 69 175.631 176.410 -0.779 1
1 794 . 2 1 1 A 69 69 ASN CA C 69 56.009 54.125 1.884 1
1 795 . 2 1 1 A 69 69 ASN CB C 69 40.314 39.140 1.174 1
1 796 . 2 1 1 A 69 69 ASN N N 69 124.980 122.617 2.363 1
1 798 . 2 1 1 A 70 70 THR H H 70 8.635 7.863 0.772 1
1 799 . 2 1 1 A 70 70 THR HA H 70 4.815 4.576 0.239 1
1 804 . 2 1 1 A 70 70 THR C C 70 176.223 175.724 0.499 1
1 805 . 2 1 1 A 70 70 THR CA C 70 63.944 62.659 1.285 1
1 806 . 2 1 1 A 70 70 THR CB C 70 69.727 70.279 -0.552 1
1 808 . 2 1 1 A 70 70 THR N N 70 110.394 110.150 0.244 1
1 809 . 2 1 1 A 71 71 THR H H 71 8.069 7.974 0.095 1
1 810 . 2 1 1 A 71 71 THR HA H 71 4.566 4.598 -0.032 1
1 815 . 2 1 1 A 71 71 THR C C 71 176.213 175.590 0.623 1
1 816 . 2 1 1 A 71 71 THR CA C 71 61.683 61.997 -0.314 1
1 817 . 2 1 1 A 71 71 THR CB C 71 70.832 71.234 -0.402 1
1 819 . 2 1 1 A 71 71 THR N N 71 110.507 110.382 0.125 1
1 820 . 2 1 1 A 72 72 GLY H H 72 7.990 7.832 0.158 1
1 821 . 2 1 1 A 72 72 GLY HA2 H 72 3.186 2.360 0.826 1
1 822 . 2 1 1 A 72 72 GLY HA3 H 72 2.516 3.319 -0.803 1
1 823 . 2 1 1 A 72 72 GLY C C 72 172.988 174.217 -1.229 1
1 824 . 2 1 1 A 72 72 GLY CA C 72 45.149 45.599 -0.450 1
1 825 . 2 1 1 A 72 72 GLY N N 72 110.788 112.461 -1.673 1
1 826 . 2 1 1 A 73 73 LEU H H 73 7.138 7.607 -0.469 1
1 827 . 2 1 1 A 73 73 LEU HA H 73 4.414 4.596 -0.182 1
1 837 . 2 1 1 A 73 73 LEU C C 73 176.836 175.180 1.656 1
1 838 . 2 1 1 A 73 73 LEU CA C 73 55.252 53.487 1.765 1
1 839 . 2 1 1 A 73 73 LEU CB C 73 43.574 44.152 -0.578 1
1 843 . 2 1 1 A 73 73 LEU N N 73 119.222 121.929 -2.707 1
1 844 . 2 1 1 A 74 74 ILE H H 74 8.925 8.515 0.410 1
1 845 . 2 1 1 A 74 74 ILE HA H 74 5.555 4.998 0.557 1
1 855 . 2 1 1 A 74 74 ILE C C 74 175.978 175.122 0.856 1
1 856 . 2 1 1 A 74 74 ILE CA C 74 60.100 60.319 -0.219 1
1 857 . 2 1 1 A 74 74 ILE CB C 74 38.550 39.080 -0.530 1
1 861 . 2 1 1 A 74 74 ILE N N 74 129.871 127.640 2.231 1
1 862 . 2 1 1 A 75 75 THR H H 75 9.161 8.838 0.323 1
1 863 . 2 1 1 A 75 75 THR HA H 75 5.375 5.476 -0.101 1
1 868 . 2 1 1 A 75 75 THR C C 75 174.798 173.166 1.632 1
1 869 . 2 1 1 A 75 75 THR CA C 75 58.796 59.463 -0.667 1
1 870 . 2 1 1 A 75 75 THR CB C 75 72.978 72.059 0.919 1
1 872 . 2 1 1 A 75 75 THR N N 75 117.522 117.515 0.007 1
1 873 . 2 1 1 A 76 76 VAL H H 76 8.327 8.515 -0.188 1
1 874 . 2 1 1 A 76 76 VAL HA H 76 3.973 3.848 0.125 1
1 882 . 2 1 1 A 76 76 VAL C C 76 176.495 175.797 0.698 1
1 883 . 2 1 1 A 76 76 VAL CA C 76 64.085 62.580 1.505 1
1 884 . 2 1 1 A 76 76 VAL CB C 76 32.863 31.739 1.124 1
1 887 . 2 1 1 A 76 76 VAL N N 76 120.876 121.800 -0.924 1
1 888 . 2 1 1 A 77 77 GLN H H 77 9.525 8.923 0.602 1
1 889 . 2 1 1 A 77 77 GLN HA H 77 4.702 4.323 0.379 1
1 896 . 2 1 1 A 77 77 GLN C C 77 173.838 174.895 -1.057 1
1 897 . 2 1 1 A 77 77 GLN CA C 77 55.728 56.811 -1.083 1
1 898 . 2 1 1 A 77 77 GLN CB C 77 30.762 30.251 0.511 1
1 900 . 2 1 1 A 77 77 GLN N N 77 129.825 128.276 1.549 1
1 902 . 2 1 1 A 78 78 ARG H H 78 7.621 7.340 0.281 1
1 903 . 2 1 1 A 78 78 ARG HA H 78 4.347 4.721 -0.374 1
1 910 . 2 1 1 A 78 78 ARG C C 78 172.304 175.034 -2.730 1
1 911 . 2 1 1 A 78 78 ARG CA C 78 54.634 53.836 0.798 1
1 912 . 2 1 1 A 78 78 ARG CB C 78 34.685 34.986 -0.301 1
1 915 . 2 1 1 A 78 78 ARG N N 78 120.595 117.612 2.983 1
1 916 . 2 1 1 A 79 79 SER H H 79 7.958 8.477 -0.519 1
1 917 . 2 1 1 A 79 79 SER HA H 79 4.030 4.314 -0.284 1
1 920 . 2 1 1 A 79 79 SER C C 79 174.311 174.619 -0.308 1
1 921 . 2 1 1 A 79 79 SER CA C 79 59.889 58.962 0.927 1
1 922 . 2 1 1 A 79 79 SER CB C 79 63.548 63.853 -0.305 1
1 923 . 2 1 1 A 79 79 SER N N 79 112.565 117.974 -5.409 1
1 924 . 2 1 1 A 80 80 LEU H H 80 8.715 8.082 0.633 1
1 925 . 2 1 1 A 80 80 LEU HA H 80 4.114 5.126 -1.012 1
1 935 . 2 1 1 A 80 80 LEU C C 80 176.057 175.754 0.303 1
1 936 . 2 1 1 A 80 80 LEU CA C 80 55.091 53.469 1.622 1
1 937 . 2 1 1 A 80 80 LEU CB C 80 42.341 45.676 -3.335 1
1 941 . 2 1 1 A 80 80 LEU N N 80 123.070 124.051 -0.981 1
1 942 . 2 1 1 A 81 81 ASP H H 81 7.298 8.732 -1.434 1
1 943 . 2 1 1 A 81 81 ASP HA H 81 4.725 5.433 -0.708 1
1 946 . 2 1 1 A 81 81 ASP C C 81 175.939 175.882 0.057 1
1 947 . 2 1 1 A 81 81 ASP CA C 81 53.664 52.799 0.865 1
1 948 . 2 1 1 A 81 81 ASP CB C 81 42.947 43.887 -0.940 1
1 949 . 2 1 1 A 81 81 ASP N N 81 115.229 120.872 -5.643 1
1 950 . 2 1 1 A 82 82 ARG H H 82 9.289 8.736 0.553 1
1 951 . 2 1 1 A 82 82 ARG HA H 82 4.416 4.345 0.071 1
1 959 . 2 1 1 A 82 82 ARG C C 82 176.406 178.135 -1.729 1
1 960 . 2 1 1 A 82 82 ARG CA C 82 56.397 57.647 -1.250 1
1 961 . 2 1 1 A 82 82 ARG CB C 82 30.638 30.616 0.022 1
1 964 . 2 1 1 A 82 82 ARG N N 82 123.174 124.277 -1.103 1
1 966 . 2 1 1 A 83 83 GLU H H 83 8.468 8.541 -0.073 1
1 967 . 2 1 1 A 83 83 GLU HA H 83 3.982 4.124 -0.142 1
1 972 . 2 1 1 A 83 83 GLU C C 83 177.740 178.125 -0.385 1
1 973 . 2 1 1 A 83 83 GLU CA C 83 58.425 58.034 0.391 1
1 974 . 2 1 1 A 83 83 GLU CB C 83 29.701 28.071 1.630 1
1 976 . 2 1 1 A 83 83 GLU N N 83 119.549 116.742 2.807 1
1 977 . 2 1 1 A 84 84 GLU H H 84 8.033 8.247 -0.214 1
1 978 . 2 1 1 A 84 84 GLU HA H 84 4.206 4.362 -0.156 1
1 983 . 2 1 1 A 84 84 GLU C C 84 176.837 175.859 0.978 1
1 984 . 2 1 1 A 84 84 GLU CA C 84 58.056 58.039 0.017 1
1 985 . 2 1 1 A 84 84 GLU CB C 84 30.432 31.106 -0.674 1
1 987 . 2 1 1 A 84 84 GLU N N 84 118.333 120.441 -2.108 1
1 988 . 2 1 1 A 85 85 THR H H 85 7.651 7.890 -0.239 1
1 989 . 2 1 1 A 85 85 THR HA H 85 4.307 4.559 -0.252 1
1 994 . 2 1 1 A 85 85 THR C C 85 171.568 174.534 -2.966 1
1 995 . 2 1 1 A 85 85 THR CA C 85 61.387 60.397 0.990 1
1 996 . 2 1 1 A 85 85 THR CB C 85 69.963 70.334 -0.371 1
1 998 . 2 1 1 A 85 85 THR N N 85 112.444 112.769 -0.325 1
1 999 . 2 1 1 A 86 86 ALA H H 86 8.639 8.642 -0.003 1
1 1000 . 2 1 1 A 86 86 ALA HA H 86 4.603 4.289 0.314 1
1 1004 . 2 1 1 A 86 86 ALA C C 86 175.560 177.615 -2.055 1
1 1005 . 2 1 1 A 86 86 ALA CA C 86 52.156 54.350 -2.194 1
1 1006 . 2 1 1 A 86 86 ALA CB C 86 20.378 19.897 0.481 1
1 1007 . 2 1 1 A 86 86 ALA N N 86 127.705 130.087 -2.382 1
1 1008 . 2 1 1 A 87 87 ILE H H 87 7.663 7.843 -0.180 1
1 1009 . 2 1 1 A 87 87 ILE HA H 87 4.828 4.631 0.197 1
1 1019 . 2 1 1 A 87 87 ILE C C 87 174.537 174.713 -0.176 1
1 1020 . 2 1 1 A 87 87 ILE CA C 87 60.329 59.959 0.370 1
1 1021 . 2 1 1 A 87 87 ILE CB C 87 41.090 40.002 1.088 1
1 1025 . 2 1 1 A 87 87 ILE N N 87 118.712 117.136 1.576 1
1 1026 . 2 1 1 A 88 88 HIS H H 88 9.098 8.996 0.102 1
1 1027 . 2 1 1 A 88 88 HIS HA H 88 4.576 5.121 -0.545 1
1 1032 . 2 1 1 A 88 88 HIS C C 88 174.354 174.108 0.246 1
1 1033 . 2 1 1 A 88 88 HIS CA C 88 54.740 54.186 0.554 1
1 1034 . 2 1 1 A 88 88 HIS CB C 88 33.955 31.754 2.201 1
1 1037 . 2 1 1 A 88 88 HIS N N 88 126.285 125.963 0.322 1
1 1038 . 2 1 1 A 89 89 LYS H H 89 8.957 8.948 0.009 1
1 1039 . 2 1 1 A 89 89 LYS HA H 89 4.873 4.658 0.215 1
1 1048 . 2 1 1 A 89 89 LYS C C 89 175.906 175.704 0.202 1
1 1049 . 2 1 1 A 89 89 LYS CA C 89 55.269 55.479 -0.210 1
1 1050 . 2 1 1 A 89 89 LYS CB C 89 32.945 33.164 -0.219 1
1 1054 . 2 1 1 A 89 89 LYS N N 89 124.332 124.603 -0.271 1
1 1055 . 2 1 1 A 90 90 VAL H H 90 9.174 8.918 0.256 1
1 1056 . 2 1 1 A 90 90 VAL HA H 90 4.227 4.941 -0.714 1
1 1064 . 2 1 1 A 90 90 VAL C C 90 174.168 174.763 -0.595 1
1 1065 . 2 1 1 A 90 90 VAL CA C 90 61.369 60.846 0.523 1
1 1066 . 2 1 1 A 90 90 VAL CB C 90 34.082 34.926 -0.844 1
1 1069 . 2 1 1 A 90 90 VAL N N 90 124.319 124.339 -0.020 1
1 1070 . 2 1 1 A 91 91 THR H H 91 6.697 8.889 -2.192 1
1 1071 . 2 1 1 A 91 91 THR HA H 91 5.163 5.189 -0.026 1
1 1076 . 2 1 1 A 91 91 THR C C 91 173.812 173.974 -0.162 1
1 1077 . 2 1 1 A 91 91 THR CA C 91 61.935 61.834 0.101 1
1 1078 . 2 1 1 A 91 91 THR CB C 91 70.412 70.192 0.220 1
1 1080 . 2 1 1 A 91 91 THR N N 91 122.637 124.255 -1.618 1
1 1081 . 2 1 1 A 92 92 VAL H H 92 9.292 9.028 0.264 1
1 1082 . 2 1 1 A 92 92 VAL HA H 92 4.736 4.618 0.118 1
1 1090 . 2 1 1 A 92 92 VAL C C 92 173.160 174.980 -1.820 1
1 1091 . 2 1 1 A 92 92 VAL CA C 92 60.982 61.212 -0.230 1
1 1092 . 2 1 1 A 92 92 VAL CB C 92 35.130 33.137 1.993 1
1 1095 . 2 1 1 A 92 92 VAL N N 92 128.265 127.826 0.439 1
1 1096 . 2 1 1 A 93 93 LEU H H 93 9.495 8.988 0.507 1
1 1097 . 2 1 1 A 93 93 LEU HA H 93 5.628 5.658 -0.030 1
1 1107 . 2 1 1 A 93 93 LEU C C 93 176.274 175.791 0.483 1
1 1108 . 2 1 1 A 93 93 LEU CA C 93 52.773 53.550 -0.777 1
1 1109 . 2 1 1 A 93 93 LEU CB C 93 43.454 44.502 -1.048 1
1 1113 . 2 1 1 A 93 93 LEU N N 93 126.350 128.149 -1.799 1
1 1114 . 2 1 1 A 94 94 ALA H H 94 8.688 8.974 -0.286 1
1 1115 . 2 1 1 A 94 94 ALA HA H 94 4.986 5.016 -0.030 1
1 1119 . 2 1 1 A 94 94 ALA C C 94 175.787 175.543 0.244 1
1 1120 . 2 1 1 A 94 94 ALA CA C 94 49.610 50.367 -0.757 1
1 1121 . 2 1 1 A 94 94 ALA CB C 94 21.463 19.735 1.728 1
1 1122 . 2 1 1 A 94 94 ALA N N 94 123.429 127.310 -3.881 1
1 1123 . 2 1 1 A 95 95 SER H H 95 8.401 8.422 -0.021 1
1 1124 . 2 1 1 A 95 95 SER HA H 95 4.828 4.961 -0.133 1
1 1127 . 2 1 1 A 95 95 SER C C 95 174.327 174.530 -0.203 1
1 1128 . 2 1 1 A 95 95 SER CA C 95 56.239 56.294 -0.055 1
1 1129 . 2 1 1 A 95 95 SER CB C 95 65.561 64.522 1.039 1
1 1130 . 2 1 1 A 95 95 SER N N 95 114.418 119.984 -5.566 1
1 1131 . 2 1 1 A 96 96 ASP H H 96 8.690 8.773 -0.083 1
1 1132 . 2 1 1 A 96 96 ASP HA H 96 4.908 4.902 0.006 1
1 1135 . 2 1 1 A 96 96 ASP C C 96 177.096 176.373 0.723 1
1 1136 . 2 1 1 A 96 96 ASP CA C 96 52.818 52.775 0.043 1
1 1137 . 2 1 1 A 96 96 ASP CB C 96 41.253 41.025 0.228 1
1 1138 . 2 1 1 A 96 96 ASP N N 96 125.624 125.964 -0.340 1
1 1139 . 2 1 1 A 97 97 GLY H H 97 8.524 8.386 0.138 1
1 1140 . 2 1 1 A 97 97 GLY HA2 H 97 4.320 4.006 0.314 1
1 1141 . 2 1 1 A 97 97 GLY HA3 H 97 3.620 4.008 -0.388 1
1 1142 . 2 1 1 A 97 97 GLY C C 97 174.620 173.926 0.694 1
1 1143 . 2 1 1 A 97 97 GLY CA C 97 45.422 45.498 -0.076 1
1 1144 . 2 1 1 A 97 97 GLY N N 97 109.283 110.883 -1.600 1
1 1145 . 2 1 1 A 98 98 SER H H 98 8.575 7.793 0.782 1
1 1146 . 2 1 1 A 98 98 SER HA H 98 4.607 4.870 -0.263 1
1 1149 . 2 1 1 A 98 98 SER C C 98 174.478 174.193 0.285 1
1 1150 . 2 1 1 A 98 98 SER CA C 98 59.095 55.784 3.311 1
1 1151 . 2 1 1 A 98 98 SER CB C 98 64.800 65.746 -0.946 1
1 1152 . 2 1 1 A 98 98 SER N N 98 116.640 115.439 1.201 1
1 1153 . 2 1 1 A 99 99 SER H H 99 8.945 8.707 0.238 1
1 1154 . 2 1 1 A 99 99 SER HA H 99 4.530 4.191 0.339 1
1 1157 . 2 1 1 A 99 99 SER C C 99 174.491 174.565 -0.074 1
1 1158 . 2 1 1 A 99 99 SER CA C 99 58.460 61.932 -3.472 1
1 1159 . 2 1 1 A 99 99 SER CB C 99 64.146 63.142 1.004 1
1 1160 . 2 1 1 A 99 99 SER N N 99 117.676 118.131 -0.455 1
1 1161 . 2 1 1 A 100 100 THR H H 100 8.411 7.839 0.572 1
1 1162 . 2 1 1 A 100 100 THR HA H 100 4.490 4.852 -0.362 1
1 1167 . 2 1 1 A 100 100 THR C C 100 172.766 172.726 0.040 1
1 1168 . 2 1 1 A 100 100 THR CA C 100 60.629 58.591 2.038 1
1 1169 . 2 1 1 A 100 100 THR CB C 100 69.778 70.410 -0.632 1
1 1171 . 2 1 1 A 100 100 THR N N 100 118.401 110.148 8.253 1
1 1172 . 2 1 1 A 101 101 PRO HA H 101 4.631 4.638 -0.007 1
1 1179 . 2 1 1 A 101 101 PRO C C 101 177.227 176.336 0.891 1
1 1180 . 2 1 1 A 101 101 PRO CA C 101 63.097 62.226 0.871 1
1 1181 . 2 1 1 A 101 101 PRO CB C 101 32.917 32.465 0.452 1
1 1184 . 2 1 1 A 102 102 ALA H H 102 8.497 7.881 0.616 1
1 1185 . 2 1 1 A 102 102 ALA HA H 102 4.619 4.645 -0.026 1
1 1189 . 2 1 1 A 102 102 ALA C C 102 176.542 176.978 -0.436 1
1 1190 . 2 1 1 A 102 102 ALA CA C 102 51.390 51.949 -0.559 1
1 1191 . 2 1 1 A 102 102 ALA CB C 102 20.815 19.822 0.993 1
1 1192 . 2 1 1 A 102 102 ALA N N 102 124.487 122.895 1.592 1
1 1193 . 2 1 1 A 103 103 ARG H H 103 8.663 8.659 0.004 1
1 1194 . 2 1 1 A 103 103 ARG HA H 103 5.515 5.221 0.294 1
1 1201 . 2 1 1 A 103 103 ARG C C 103 174.539 175.577 -1.038 1
1 1202 . 2 1 1 A 103 103 ARG CA C 103 55.164 54.728 0.436 1
1 1203 . 2 1 1 A 103 103 ARG CB C 103 34.393 33.084 1.309 1
1 1206 . 2 1 1 A 103 103 ARG N N 103 119.596 121.280 -1.684 1
1 1207 . 2 1 1 A 104 104 ALA H H 104 9.027 8.652 0.375 1
1 1208 . 2 1 1 A 104 104 ALA HA H 104 4.782 4.965 -0.183 1
1 1212 . 2 1 1 A 104 104 ALA C C 104 176.276 175.641 0.635 1
1 1213 . 2 1 1 A 104 104 ALA CA C 104 50.297 51.511 -1.214 1
1 1214 . 2 1 1 A 104 104 ALA CB C 104 20.810 20.772 0.038 1
1 1215 . 2 1 1 A 104 104 ALA N N 104 126.962 123.878 3.084 1
1 1216 . 2 1 1 A 105 105 THR H H 105 8.384 8.825 -0.441 1
1 1217 . 2 1 1 A 105 105 THR HA H 105 4.954 4.983 -0.029 1
1 1222 . 2 1 1 A 105 105 THR C C 105 173.243 173.633 -0.390 1
1 1223 . 2 1 1 A 105 105 THR CA C 105 61.475 61.853 -0.378 1
1 1224 . 2 1 1 A 105 105 THR CB C 105 70.569 69.998 0.571 1
1 1226 . 2 1 1 A 105 105 THR N N 105 115.327 118.441 -3.114 1
1 1227 . 2 1 1 A 106 106 VAL H H 106 8.970 8.776 0.194 1
1 1228 . 2 1 1 A 106 106 VAL HA H 106 4.702 4.391 0.311 1
1 1236 . 2 1 1 A 106 106 VAL C C 106 174.743 175.313 -0.570 1
1 1237 . 2 1 1 A 106 106 VAL CA C 106 59.712 61.348 -1.636 1
1 1238 . 2 1 1 A 106 106 VAL CB C 106 34.327 32.156 2.171 1
1 1241 . 2 1 1 A 106 106 VAL N N 106 126.226 127.421 -1.195 1
1 1242 . 2 1 1 A 107 107 THR H H 107 8.833 8.811 0.022 1
1 1243 . 2 1 1 A 107 107 THR HA H 107 4.862 4.443 0.419 1
1 1248 . 2 1 1 A 107 107 THR C C 107 172.970 174.034 -1.064 1
1 1249 . 2 1 1 A 107 107 THR CA C 107 62.322 63.102 -0.780 1
1 1250 . 2 1 1 A 107 107 THR CB C 107 69.463 68.488 0.975 1
1 1252 . 2 1 1 A 107 107 THR N N 107 125.403 123.072 2.331 1
1 1253 . 2 1 1 A 108 108 ILE H H 108 9.234 8.879 0.355 1
1 1254 . 2 1 1 A 108 108 ILE HA H 108 4.178 4.688 -0.510 1
1 1264 . 2 1 1 A 108 108 ILE C C 108 174.087 174.860 -0.773 1
1 1265 . 2 1 1 A 108 108 ILE CA C 108 60.365 60.116 0.249 1
1 1266 . 2 1 1 A 108 108 ILE CB C 108 39.745 38.647 1.098 1
1 1270 . 2 1 1 A 108 108 ILE N N 108 127.152 128.501 -1.349 1
1 1271 . 2 1 1 A 109 109 ASN H H 109 8.723 9.274 -0.551 1
1 1272 . 2 1 1 A 109 109 ASN HA H 109 5.147 5.243 -0.096 1
1 1277 . 2 1 1 A 109 109 ASN C C 109 173.592 174.562 -0.970 1
1 1278 . 2 1 1 A 109 109 ASN CA C 109 52.501 52.870 -0.369 1
1 1279 . 2 1 1 A 109 109 ASN CB C 109 40.791 40.322 0.469 1
1 1280 . 2 1 1 A 109 109 ASN N N 109 126.866 126.146 0.720 1
1 1282 . 2 1 1 A 110 110 VAL H H 110 9.046 8.760 0.286 1
1 1283 . 2 1 1 A 110 110 VAL HA H 110 5.081 5.028 0.053 1
1 1291 . 2 1 1 A 110 110 VAL C C 110 176.921 176.160 0.761 1
1 1292 . 2 1 1 A 110 110 VAL CA C 110 61.634 61.517 0.117 1
1 1293 . 2 1 1 A 110 110 VAL CB C 110 31.809 33.185 -1.376 1
1 1296 . 2 1 1 A 110 110 VAL N N 110 126.070 123.520 2.550 1
1 1297 . 2 1 1 A 111 111 THR H H 111 9.197 8.457 0.740 1
1 1298 . 2 1 1 A 111 111 THR HA H 111 4.566 5.030 -0.464 1
1 1303 . 2 1 1 A 111 111 THR C C 111 174.087 174.076 0.011 1
1 1304 . 2 1 1 A 111 111 THR CA C 111 61.145 60.097 1.048 1
1 1305 . 2 1 1 A 111 111 THR CB C 111 70.706 71.305 -0.599 1
1 1307 . 2 1 1 A 111 111 THR N N 111 121.425 118.703 2.722 1
1 1308 . 2 1 1 A 112 112 ASP H H 112 8.435 8.720 -0.285 1
1 1309 . 2 1 1 A 112 112 ASP HA H 112 4.656 4.790 -0.134 1
1 1312 . 2 1 1 A 112 112 ASP C C 112 176.745 176.890 -0.145 1
1 1313 . 2 1 1 A 112 112 ASP CA C 112 54.158 54.203 -0.045 1
1 1314 . 2 1 1 A 112 112 ASP CB C 112 41.575 42.217 -0.642 1
1 1315 . 2 1 1 A 112 112 ASP N N 112 119.566 123.272 -3.706 1
1 1316 . 2 1 1 A 113 113 VAL H H 113 8.629 8.489 0.140 1
1 1317 . 2 1 1 A 113 113 VAL HA H 113 4.078 4.317 -0.239 1
1 1325 . 2 1 1 A 113 113 VAL C C 113 175.247 176.491 -1.244 1
1 1326 . 2 1 1 A 113 113 VAL CA C 113 62.533 61.973 0.560 1
1 1327 . 2 1 1 A 113 113 VAL CB C 113 32.534 33.405 -0.871 1
1 1330 . 2 1 1 A 113 113 VAL N N 113 119.356 121.204 -1.848 1
1 4 . 3 1 1 A 2 2 SER H H 2 8.289 9.361 -1.072 1
1 5 . 3 1 1 A 2 2 SER HA H 2 4.530 4.104 0.426 1
1 7 . 3 1 1 A 2 2 SER C C 2 174.868 174.272 0.596 1
1 8 . 3 1 1 A 2 2 SER CA C 2 58.284 59.213 -0.929 1
1 9 . 3 1 1 A 2 2 SER CB C 2 63.769 61.678 2.091 1
1 10 . 3 1 1 A 2 2 SER N N 2 115.842 121.133 -5.291 1
1 11 . 3 1 1 A 3 3 SER H H 3 8.490 8.669 -0.179 1
1 12 . 3 1 1 A 3 3 SER HA H 3 4.496 4.166 0.330 1
1 14 . 3 1 1 A 3 3 SER C C 3 175.043 174.828 0.215 1
1 15 . 3 1 1 A 3 3 SER CA C 3 58.549 59.052 -0.503 1
1 16 . 3 1 1 A 3 3 SER CB C 3 63.687 61.025 2.662 1
1 17 . 3 1 1 A 3 3 SER N N 3 117.930 114.209 3.721 1
1 18 . 3 1 1 A 4 4 GLY H H 4 8.482 8.378 0.104 1
1 19 . 3 1 1 A 4 4 GLY C C 4 174.344 173.396 0.948 1
1 20 . 3 1 1 A 4 4 GLY CA C 4 45.536 45.694 -0.158 1
1 21 . 3 1 1 A 4 4 GLY N N 4 110.985 109.574 1.411 1
1 22 . 3 1 1 A 6 6 SER HA H 6 4.508 4.826 -0.318 1
1 24 . 3 1 1 A 6 6 SER C C 6 175.026 173.223 1.803 1
1 25 . 3 1 1 A 6 6 SER CA C 6 58.584 56.953 1.631 1
1 26 . 3 1 1 A 6 6 SER CB C 6 63.646 65.273 -1.627 1
1 27 . 3 1 1 A 7 7 GLY H H 7 8.419 8.309 0.110 1
1 28 . 3 1 1 A 7 7 GLY HA2 H 7 3.993 4.093 -0.100 1
1 29 . 3 1 1 A 7 7 GLY C C 7 173.995 174.130 -0.135 1
1 30 . 3 1 1 A 7 7 GLY CA C 7 45.466 46.004 -0.538 1
1 31 . 3 1 1 A 7 7 GLY N N 7 110.615 110.789 -0.174 1
1 32 . 3 1 1 A 8 8 ASN H H 8 8.322 8.094 0.228 1
1 33 . 3 1 1 A 8 8 ASN HA H 8 4.736 5.384 -0.648 1
1 38 . 3 1 1 A 8 8 ASN C C 8 174.907 173.143 1.764 1
1 39 . 3 1 1 A 8 8 ASN CA C 8 53.259 51.526 1.733 1
1 40 . 3 1 1 A 8 8 ASN CB C 8 39.127 42.590 -3.463 1
1 41 . 3 1 1 A 8 8 ASN N N 8 118.602 113.310 5.292 1
1 43 . 3 1 1 A 9 9 ASP H H 9 8.370 8.654 -0.284 1
1 44 . 3 1 1 A 9 9 ASP HA H 9 4.594 5.078 -0.484 1
1 47 . 3 1 1 A 9 9 ASP C C 9 175.765 175.494 0.271 1
1 48 . 3 1 1 A 9 9 ASP CA C 9 54.440 53.831 0.609 1
1 49 . 3 1 1 A 9 9 ASP CB C 9 40.898 43.885 -2.987 1
1 50 . 3 1 1 A 9 9 ASP N N 9 120.504 118.202 2.302 1
1 51 . 3 1 1 A 10 10 ASN H H 10 8.382 8.712 -0.330 1
1 52 . 3 1 1 A 10 10 ASN HA H 10 4.691 4.566 0.125 1
1 57 . 3 1 1 A 10 10 ASN C C 10 174.383 175.634 -1.251 1
1 58 . 3 1 1 A 10 10 ASN CA C 10 53.241 53.422 -0.181 1
1 59 . 3 1 1 A 10 10 ASN CB C 10 38.674 37.940 0.734 1
1 60 . 3 1 1 A 10 10 ASN N N 10 119.406 122.647 -3.241 1
1 62 . 3 1 1 A 11 11 ARG H H 11 7.942 8.422 -0.480 1
1 63 . 3 1 1 A 11 11 ARG HA H 11 4.684 4.199 0.485 1
1 70 . 3 1 1 A 11 11 ARG C C 11 173.640 175.640 -2.000 1
1 71 . 3 1 1 A 11 11 ARG CA C 11 54.246 55.399 -1.153 1
1 72 . 3 1 1 A 11 11 ARG CB C 11 30.337 30.242 0.095 1
1 75 . 3 1 1 A 11 11 ARG N N 11 121.145 125.026 -3.881 1
1 76 . 3 1 1 A 12 12 PRO HA H 12 4.507 4.521 -0.014 1
1 83 . 3 1 1 A 12 12 PRO CA C 12 62.714 62.511 0.203 1
1 84 . 3 1 1 A 12 12 PRO CB C 12 31.942 31.558 0.384 1
1 87 . 3 1 1 A 13 13 VAL H H 13 8.252 8.601 -0.349 1
1 88 . 3 1 1 A 13 13 VAL HA H 13 4.159 4.277 -0.118 1
1 96 . 3 1 1 A 13 13 VAL CA C 13 61.409 61.209 0.200 1
1 97 . 3 1 1 A 13 13 VAL CB C 13 34.858 33.402 1.456 1
1 100 . 3 1 1 A 13 13 VAL N N 13 118.395 125.355 -6.960 1
1 101 . 3 1 1 A 14 14 PHE H H 14 8.725 8.608 0.117 1
1 102 . 3 1 1 A 14 14 PHE HA H 14 4.781 4.981 -0.200 1
1 110 . 3 1 1 A 14 14 PHE CA C 14 58.594 57.130 1.464 1
1 111 . 3 1 1 A 14 14 PHE CB C 14 39.594 39.827 -0.233 1
1 117 . 3 1 1 A 14 14 PHE N N 14 122.950 127.034 -4.084 1
1 118 . 3 1 1 A 15 15 LYS H H 15 8.885 8.813 0.072 1
1 119 . 3 1 1 A 15 15 LYS HA H 15 4.130 4.050 0.080 1
1 128 . 3 1 1 A 15 15 LYS C C 15 177.027 177.504 -0.477 1
1 129 . 3 1 1 A 15 15 LYS CA C 15 58.478 57.309 1.169 1
1 130 . 3 1 1 A 15 15 LYS CB C 15 32.748 32.433 0.315 1
1 134 . 3 1 1 A 15 15 LYS N N 15 123.863 124.809 -0.946 1
1 135 . 3 1 1 A 16 16 GLU H H 16 8.091 9.204 -1.113 1
1 136 . 3 1 1 A 16 16 GLU HA H 16 4.438 4.091 0.347 1
1 141 . 3 1 1 A 16 16 GLU C C 16 175.947 177.033 -1.086 1
1 142 . 3 1 1 A 16 16 GLU CA C 16 56.045 57.143 -1.098 1
1 143 . 3 1 1 A 16 16 GLU CB C 16 30.766 27.442 3.324 1
1 145 . 3 1 1 A 16 16 GLU N N 16 117.026 125.659 -8.633 1
1 146 . 3 1 1 A 17 17 GLY H H 17 8.421 7.931 0.490 1
1 147 . 3 1 1 A 17 17 GLY HA2 H 17 3.993 3.827 0.166 1
1 148 . 3 1 1 A 17 17 GLY HA3 H 17 3.913 3.866 0.047 1
1 149 . 3 1 1 A 17 17 GLY C C 17 173.564 175.054 -1.490 1
1 150 . 3 1 1 A 17 17 GLY CA C 17 45.448 47.660 -2.212 1
1 151 . 3 1 1 A 17 17 GLY N N 17 109.577 109.422 0.155 1
1 152 . 3 1 1 A 18 18 GLN H H 18 7.858 7.705 0.153 1
1 153 . 3 1 1 A 18 18 GLN HA H 18 5.065 4.544 0.521 1
1 160 . 3 1 1 A 18 18 GLN C C 18 174.596 175.671 -1.075 1
1 161 . 3 1 1 A 18 18 GLN CA C 18 55.110 55.957 -0.847 1
1 162 . 3 1 1 A 18 18 GLN CB C 18 30.329 29.764 0.565 1
1 164 . 3 1 1 A 18 18 GLN N N 18 120.202 118.490 1.712 1
1 166 . 3 1 1 A 19 19 VAL H H 19 8.216 8.607 -0.391 1
1 167 . 3 1 1 A 19 19 VAL HA H 19 4.450 4.719 -0.269 1
1 175 . 3 1 1 A 19 19 VAL C C 19 173.648 173.943 -0.295 1
1 176 . 3 1 1 A 19 19 VAL CA C 19 60.788 60.118 0.670 1
1 177 . 3 1 1 A 19 19 VAL CB C 19 35.336 36.111 -0.775 1
1 180 . 3 1 1 A 19 19 VAL N N 19 121.257 123.547 -2.290 1
1 181 . 3 1 1 A 20 20 GLU H H 20 8.610 8.791 -0.181 1
1 182 . 3 1 1 A 20 20 GLU HA H 20 5.211 5.211 0.000 1
1 187 . 3 1 1 A 20 20 GLU C C 20 174.783 175.156 -0.373 1
1 188 . 3 1 1 A 20 20 GLU CA C 20 54.793 54.864 -0.071 1
1 189 . 3 1 1 A 20 20 GLU CB C 20 32.058 32.406 -0.348 1
1 191 . 3 1 1 A 20 20 GLU N N 20 127.095 126.198 0.897 1
1 192 . 3 1 1 A 21 21 VAL H H 21 8.727 8.679 0.048 1
1 193 . 3 1 1 A 21 21 VAL HA H 21 4.633 5.025 -0.392 1
1 201 . 3 1 1 A 21 21 VAL C C 21 173.894 174.608 -0.714 1
1 202 . 3 1 1 A 21 21 VAL CA C 21 59.695 60.074 -0.379 1
1 203 . 3 1 1 A 21 21 VAL CB C 21 35.865 33.949 1.916 1
1 206 . 3 1 1 A 21 21 VAL N N 21 120.489 122.863 -2.374 1
1 207 . 3 1 1 A 22 22 HIS H H 22 8.680 9.036 -0.356 1
1 208 . 3 1 1 A 22 22 HIS HA H 22 5.552 5.245 0.307 1
1 212 . 3 1 1 A 22 22 HIS C C 22 174.298 173.513 0.785 1
1 213 . 3 1 1 A 22 22 HIS CA C 22 55.331 54.345 0.986 1
1 214 . 3 1 1 A 22 22 HIS CB C 22 32.369 31.493 0.876 1
1 216 . 3 1 1 A 22 22 HIS N N 22 124.991 119.795 5.196 1
1 217 . 3 1 1 A 23 23 ILE H H 23 9.179 8.928 0.251 1
1 218 . 3 1 1 A 23 23 ILE HA H 23 5.046 4.788 0.258 1
1 228 . 3 1 1 A 23 23 ILE C C 23 171.552 173.544 -1.992 1
1 229 . 3 1 1 A 23 23 ILE CA C 23 55.551 57.160 -1.609 1
1 230 . 3 1 1 A 23 23 ILE CB C 23 42.053 41.879 0.174 1
1 234 . 3 1 1 A 23 23 ILE N N 23 123.121 123.810 -0.689 1
1 235 . 3 1 1 A 24 24 PRO HA H 24 4.816 4.703 0.113 1
1 242 . 3 1 1 A 24 24 PRO C C 24 178.887 177.853 1.034 1
1 243 . 3 1 1 A 24 24 PRO CA C 24 62.216 62.799 -0.583 1
1 244 . 3 1 1 A 24 24 PRO CB C 24 32.895 32.684 0.211 1
1 247 . 3 1 1 A 25 25 GLU H H 25 8.399 8.274 0.125 1
1 248 . 3 1 1 A 25 25 GLU HA H 25 3.785 4.015 -0.230 1
1 253 . 3 1 1 A 25 25 GLU C C 25 175.244 177.344 -2.100 1
1 254 . 3 1 1 A 25 25 GLU CA C 25 58.425 59.099 -0.674 1
1 255 . 3 1 1 A 25 25 GLU CB C 25 30.011 29.025 0.986 1
1 257 . 3 1 1 A 25 25 GLU N N 25 117.706 122.340 -4.634 1
1 258 . 3 1 1 A 26 26 ASN H H 26 7.488 7.779 -0.291 1
1 259 . 3 1 1 A 26 26 ASN HA H 26 4.702 4.799 -0.097 1
1 264 . 3 1 1 A 26 26 ASN C C 26 175.425 175.420 0.005 1
1 265 . 3 1 1 A 26 26 ASN CA C 26 51.584 52.214 -0.630 1
1 266 . 3 1 1 A 26 26 ASN CB C 26 37.243 38.555 -1.312 1
1 267 . 3 1 1 A 26 26 ASN N N 26 112.383 117.432 -5.049 1
1 269 . 3 1 1 A 27 27 ALA H H 27 7.716 7.416 0.300 1
1 270 . 3 1 1 A 27 27 ALA HA H 27 4.409 4.331 0.078 1
1 274 . 3 1 1 A 27 27 ALA C C 27 175.850 175.825 0.025 1
1 275 . 3 1 1 A 27 27 ALA CA C 27 51.037 51.113 -0.076 1
1 276 . 3 1 1 A 27 27 ALA CB C 27 18.152 18.529 -0.377 1
1 277 . 3 1 1 A 27 27 ALA N N 27 125.139 122.492 2.647 1
1 278 . 3 1 1 A 28 28 PRO HA H 28 4.422 4.518 -0.096 1
1 285 . 3 1 1 A 28 28 PRO C C 28 178.442 177.066 1.376 1
1 286 . 3 1 1 A 28 28 PRO CA C 28 62.067 62.731 -0.664 1
1 287 . 3 1 1 A 28 28 PRO CB C 28 32.642 32.340 0.302 1
1 290 . 3 1 1 A 29 29 VAL H H 29 8.691 8.322 0.369 1
1 291 . 3 1 1 A 29 29 VAL HA H 29 3.239 3.619 -0.380 1
1 299 . 3 1 1 A 29 29 VAL C C 29 176.887 177.257 -0.370 1
1 300 . 3 1 1 A 29 29 VAL CA C 29 65.812 64.163 1.649 1
1 301 . 3 1 1 A 29 29 VAL CB C 29 31.174 31.550 -0.376 1
1 304 . 3 1 1 A 29 29 VAL N N 29 123.592 122.800 0.792 1
1 305 . 3 1 1 A 30 30 GLY H H 30 9.197 8.938 0.259 1
1 306 . 3 1 1 A 30 30 GLY HA2 H 30 4.486 3.947 0.539 1
1 307 . 3 1 1 A 30 30 GLY HA3 H 30 3.581 3.948 -0.367 1
1 308 . 3 1 1 A 30 30 GLY C C 30 174.347 174.765 -0.418 1
1 309 . 3 1 1 A 30 30 GLY CA C 30 44.320 44.557 -0.237 1
1 310 . 3 1 1 A 30 30 GLY N N 30 116.042 116.231 -0.189 1
1 311 . 3 1 1 A 31 31 THR H H 31 7.838 7.232 0.606 1
1 312 . 3 1 1 A 31 31 THR HA H 31 3.959 4.197 -0.238 1
1 317 . 3 1 1 A 31 31 THR C C 31 174.274 174.044 0.230 1
1 318 . 3 1 1 A 31 31 THR CA C 31 65.160 62.861 2.299 1
1 319 . 3 1 1 A 31 31 THR CB C 31 69.972 69.650 0.322 1
1 321 . 3 1 1 A 31 31 THR N N 31 117.679 117.555 0.124 1
1 322 . 3 1 1 A 32 32 SER H H 32 9.022 8.606 0.416 1
1 323 . 3 1 1 A 32 32 SER HA H 32 4.273 4.669 -0.396 1
1 326 . 3 1 1 A 32 32 SER C C 32 172.692 174.355 -1.663 1
1 327 . 3 1 1 A 32 32 SER CA C 32 59.642 57.934 1.708 1
1 328 . 3 1 1 A 32 32 SER CB C 32 63.102 63.047 0.055 1
1 329 . 3 1 1 A 32 32 SER N N 32 123.045 119.613 3.432 1
1 330 . 3 1 1 A 33 33 VAL H H 33 9.202 8.910 0.292 1
1 331 . 3 1 1 A 33 33 VAL HA H 33 3.844 3.983 -0.139 1
1 339 . 3 1 1 A 33 33 VAL C C 33 174.782 175.723 -0.941 1
1 340 . 3 1 1 A 33 33 VAL CA C 33 64.242 64.377 -0.135 1
1 341 . 3 1 1 A 33 33 VAL CB C 33 32.893 32.135 0.758 1
1 344 . 3 1 1 A 33 33 VAL N N 33 126.861 125.326 1.535 1
1 345 . 3 1 1 A 34 34 ILE H H 34 7.074 7.555 -0.481 1
1 346 . 3 1 1 A 34 34 ILE HA H 34 4.295 4.723 -0.428 1
1 356 . 3 1 1 A 34 34 ILE C C 34 170.577 173.257 -2.680 1
1 357 . 3 1 1 A 34 34 ILE CA C 34 59.500 59.251 0.249 1
1 358 . 3 1 1 A 34 34 ILE CB C 34 39.251 42.104 -2.853 1
1 362 . 3 1 1 A 34 34 ILE N N 34 111.445 119.243 -7.798 1
1 363 . 3 1 1 A 35 35 GLN H H 35 8.450 8.825 -0.375 1
1 364 . 3 1 1 A 35 35 GLN HA H 35 4.633 5.109 -0.476 1
1 371 . 3 1 1 A 35 35 GLN C C 35 174.354 174.232 0.122 1
1 372 . 3 1 1 A 35 35 GLN CA C 35 54.176 54.029 0.147 1
1 373 . 3 1 1 A 35 35 GLN CB C 35 29.456 32.154 -2.698 1
1 375 . 3 1 1 A 35 35 GLN N N 35 127.342 127.676 -0.334 1
1 377 . 3 1 1 A 36 36 LEU H H 36 7.761 8.798 -1.037 1
1 378 . 3 1 1 A 36 36 LEU HA H 36 4.492 5.034 -0.542 1
1 388 . 3 1 1 A 36 36 LEU C C 36 175.543 175.610 -0.067 1
1 389 . 3 1 1 A 36 36 LEU CA C 36 53.982 53.634 0.348 1
1 390 . 3 1 1 A 36 36 LEU CB C 36 42.776 44.253 -1.477 1
1 394 . 3 1 1 A 36 36 LEU N N 36 128.895 127.988 0.907 1
1 395 . 3 1 1 A 37 37 HIS H H 37 8.529 8.988 -0.459 1
1 396 . 3 1 1 A 37 37 HIS HA H 37 4.851 5.488 -0.637 1
1 400 . 3 1 1 A 37 37 HIS C C 37 172.985 173.489 -0.504 1
1 401 . 3 1 1 A 37 37 HIS CA C 37 55.833 53.574 2.259 1
1 402 . 3 1 1 A 37 37 HIS CB C 37 32.204 32.069 0.135 1
1 404 . 3 1 1 A 37 37 HIS N N 37 115.903 124.054 -8.151 1
1 405 . 3 1 1 A 38 38 ALA H H 38 8.474 9.209 -0.735 1
1 406 . 3 1 1 A 38 38 ALA HA H 38 4.691 4.804 -0.113 1
1 410 . 3 1 1 A 38 38 ALA C C 38 175.548 175.924 -0.376 1
1 411 . 3 1 1 A 38 38 ALA CA C 38 50.491 50.489 0.002 1
1 412 . 3 1 1 A 38 38 ALA CB C 38 19.842 20.603 -0.761 1
1 413 . 3 1 1 A 38 38 ALA N N 38 128.891 130.959 -2.068 1
1 414 . 3 1 1 A 39 39 THR H H 39 8.095 8.416 -0.321 1
1 415 . 3 1 1 A 39 39 THR HA H 39 4.336 5.029 -0.693 1
1 420 . 3 1 1 A 39 39 THR C C 39 173.553 173.154 0.399 1
1 421 . 3 1 1 A 39 39 THR CA C 39 60.417 60.136 0.281 1
1 422 . 3 1 1 A 39 39 THR CB C 39 70.912 71.363 -0.451 1
1 424 . 3 1 1 A 39 39 THR N N 39 110.982 114.149 -3.167 1
1 425 . 3 1 1 A 40 40 ASP H H 40 8.417 8.621 -0.204 1
1 426 . 3 1 1 A 40 40 ASP HA H 40 4.553 4.936 -0.383 1
1 429 . 3 1 1 A 40 40 ASP C C 40 176.462 176.017 0.445 1
1 430 . 3 1 1 A 40 40 ASP CA C 40 54.158 54.441 -0.283 1
1 431 . 3 1 1 A 40 40 ASP CB C 40 41.517 42.161 -0.644 1
1 432 . 3 1 1 A 40 40 ASP N N 40 121.450 121.382 0.068 1
1 433 . 3 1 1 A 41 41 ALA H H 41 8.435 7.768 0.667 1
1 434 . 3 1 1 A 41 41 ALA HA H 41 4.129 4.568 -0.439 1
1 438 . 3 1 1 A 41 41 ALA C C 41 177.718 176.703 1.015 1
1 439 . 3 1 1 A 41 41 ALA CA C 41 53.436 50.553 2.883 1
1 440 . 3 1 1 A 41 41 ALA CB C 41 19.183 22.162 -2.979 1
1 441 . 3 1 1 A 41 41 ALA N N 41 124.607 119.672 4.935 1
1 442 . 3 1 1 A 42 42 ASP H H 42 8.310 8.974 -0.664 1
1 443 . 3 1 1 A 42 42 ASP HA H 42 4.588 4.666 -0.078 1
1 446 . 3 1 1 A 42 42 ASP C C 42 176.546 176.067 0.479 1
1 447 . 3 1 1 A 42 42 ASP CA C 42 54.599 55.619 -1.020 1
1 448 . 3 1 1 A 42 42 ASP CB C 42 41.146 42.264 -1.118 1
1 449 . 3 1 1 A 42 42 ASP N N 42 118.030 119.982 -1.952 1
1 450 . 3 1 1 A 43 43 ILE H H 43 8.000 7.854 0.146 1
1 451 . 3 1 1 A 43 43 ILE HA H 43 4.130 3.837 0.293 1
1 461 . 3 1 1 A 43 43 ILE C C 43 176.901 176.712 0.189 1
1 462 . 3 1 1 A 43 43 ILE CA C 43 61.740 62.762 -1.022 1
1 463 . 3 1 1 A 43 43 ILE CB C 43 38.491 37.768 0.723 1
1 467 . 3 1 1 A 43 43 ILE N N 43 119.301 118.817 0.484 1
1 468 . 3 1 1 A 44 44 GLY H H 44 8.448 8.602 -0.154 1
1 469 . 3 1 1 A 44 44 GLY HA2 H 44 3.939 3.957 -0.018 1
1 470 . 3 1 1 A 44 44 GLY HA3 H 44 3.939 3.959 -0.020 1
1 471 . 3 1 1 A 44 44 GLY C C 44 174.393 174.973 -0.580 1
1 472 . 3 1 1 A 44 44 GLY CA C 44 45.501 45.350 0.151 1
1 473 . 3 1 1 A 44 44 GLY N N 44 111.333 117.836 -6.503 1
1 474 . 3 1 1 A 45 45 SER H H 45 8.061 8.356 -0.295 1
1 475 . 3 1 1 A 45 45 SER HA H 45 4.416 4.278 0.138 1
1 478 . 3 1 1 A 45 45 SER C C 45 174.480 174.388 0.092 1
1 479 . 3 1 1 A 45 45 SER CA C 45 58.478 59.123 -0.645 1
1 480 . 3 1 1 A 45 45 SER CB C 45 63.943 61.330 2.613 1
1 481 . 3 1 1 A 45 45 SER N N 45 115.551 111.886 3.665 1
1 482 . 3 1 1 A 46 46 ASN H H 46 8.547 8.265 0.282 1
1 483 . 3 1 1 A 46 46 ASN HA H 46 4.725 4.883 -0.158 1
1 488 . 3 1 1 A 46 46 ASN C C 46 175.031 173.668 1.363 1
1 489 . 3 1 1 A 46 46 ASN CA C 46 53.277 52.933 0.344 1
1 490 . 3 1 1 A 46 46 ASN CB C 46 38.798 39.087 -0.289 1
1 491 . 3 1 1 A 46 46 ASN N N 46 120.698 116.901 3.797 1
1 493 . 3 1 1 A 47 47 ALA H H 47 8.239 7.566 0.673 1
1 494 . 3 1 1 A 47 47 ALA HA H 47 4.283 4.783 -0.500 1
1 498 . 3 1 1 A 47 47 ALA C C 47 177.240 175.651 1.589 1
1 499 . 3 1 1 A 47 47 ALA CA C 47 52.731 50.764 1.967 1
1 500 . 3 1 1 A 47 47 ALA CB C 47 19.594 20.291 -0.697 1
1 501 . 3 1 1 A 47 47 ALA N N 47 124.093 122.541 1.552 1
1 502 . 3 1 1 A 48 48 GLU H H 48 8.376 8.847 -0.471 1
1 503 . 3 1 1 A 48 48 GLU HA H 48 4.264 4.623 -0.359 1
1 508 . 3 1 1 A 48 48 GLU C C 48 175.702 175.167 0.535 1
1 509 . 3 1 1 A 48 48 GLU CA C 48 55.992 55.670 0.322 1
1 510 . 3 1 1 A 48 48 GLU CB C 48 30.210 29.439 0.771 1
1 512 . 3 1 1 A 48 48 GLU N N 48 119.750 122.817 -3.067 1
1 513 . 3 1 1 A 49 49 ILE H H 49 7.806 8.411 -0.605 1
1 514 . 3 1 1 A 49 49 ILE HA H 49 3.919 4.137 -0.218 1
1 524 . 3 1 1 A 49 49 ILE C C 49 175.894 175.093 0.801 1
1 525 . 3 1 1 A 49 49 ILE CA C 49 60.559 60.779 -0.220 1
1 526 . 3 1 1 A 49 49 ILE CB C 49 37.860 37.547 0.313 1
1 530 . 3 1 1 A 49 49 ILE N N 49 122.772 125.877 -3.105 1
1 531 . 3 1 1 A 50 50 ARG H H 50 8.247 8.558 -0.311 1
1 532 . 3 1 1 A 50 50 ARG HA H 50 4.999 4.701 0.298 1
1 539 . 3 1 1 A 50 50 ARG C C 50 174.603 174.948 -0.345 1
1 540 . 3 1 1 A 50 50 ARG CA C 50 53.189 54.740 -1.551 1
1 541 . 3 1 1 A 50 50 ARG CB C 50 33.152 31.624 1.528 1
1 544 . 3 1 1 A 50 50 ARG N N 50 126.912 127.756 -0.844 1
1 545 . 3 1 1 A 51 51 TYR H H 51 9.041 8.747 0.294 1
1 546 . 3 1 1 A 51 51 TYR HA H 51 5.395 5.038 0.357 1
1 553 . 3 1 1 A 51 51 TYR C C 51 175.555 175.769 -0.214 1
1 554 . 3 1 1 A 51 51 TYR CA C 51 56.909 58.342 -1.433 1
1 555 . 3 1 1 A 51 51 TYR CB C 51 40.116 39.849 0.267 1
1 560 . 3 1 1 A 51 51 TYR N N 51 121.627 123.239 -1.612 1
1 561 . 3 1 1 A 52 52 ILE H H 52 8.850 8.350 0.500 1
1 562 . 3 1 1 A 52 52 ILE HA H 52 4.576 4.628 -0.052 1
1 572 . 3 1 1 A 52 52 ILE C C 52 175.371 174.810 0.561 1
1 573 . 3 1 1 A 52 52 ILE CA C 52 59.624 59.381 0.243 1
1 574 . 3 1 1 A 52 52 ILE CB C 52 42.895 41.800 1.095 1
1 578 . 3 1 1 A 52 52 ILE N N 52 117.697 116.272 1.425 1
1 579 . 3 1 1 A 53 53 PHE H H 53 8.748 8.751 -0.003 1
1 580 . 3 1 1 A 53 53 PHE HA H 53 5.132 4.602 0.530 1
1 588 . 3 1 1 A 53 53 PHE C C 53 178.146 176.323 1.823 1
1 589 . 3 1 1 A 53 53 PHE CA C 53 57.667 57.946 -0.279 1
1 590 . 3 1 1 A 53 53 PHE CB C 53 39.614 39.304 0.310 1
1 596 . 3 1 1 A 53 53 PHE N N 53 121.433 122.226 -0.793 1
1 597 . 3 1 1 A 54 54 GLY H H 54 8.538 8.594 -0.056 1
1 598 . 3 1 1 A 54 54 GLY HA2 H 54 4.074 4.100 -0.026 1
1 599 . 3 1 1 A 54 54 GLY HA3 H 54 3.840 4.106 -0.266 1
1 600 . 3 1 1 A 54 54 GLY C C 54 174.530 172.938 1.592 1
1 601 . 3 1 1 A 54 54 GLY CA C 54 44.884 44.495 0.389 1
1 602 . 3 1 1 A 54 54 GLY N N 54 106.444 111.363 -4.919 1
1 603 . 3 1 1 A 55 55 ALA H H 55 8.594 8.200 0.394 1
1 604 . 3 1 1 A 55 55 ALA HA H 55 4.172 4.631 -0.459 1
1 608 . 3 1 1 A 55 55 ALA C C 55 178.718 177.384 1.334 1
1 609 . 3 1 1 A 55 55 ALA CA C 55 54.423 51.246 3.177 1
1 610 . 3 1 1 A 55 55 ALA CB C 55 19.059 20.782 -1.723 1
1 611 . 3 1 1 A 55 55 ALA N N 55 123.470 122.367 1.103 1
1 612 . 3 1 1 A 56 56 GLN H H 56 8.727 8.752 -0.025 1
1 613 . 3 1 1 A 56 56 GLN HA H 56 4.367 3.786 0.581 1
1 620 . 3 1 1 A 56 56 GLN C C 56 176.134 174.765 1.369 1
1 621 . 3 1 1 A 56 56 GLN CA C 56 55.660 56.719 -1.059 1
1 622 . 3 1 1 A 56 56 GLN CB C 56 28.152 27.006 1.146 1
1 624 . 3 1 1 A 56 56 GLN N N 56 114.221 115.279 -1.058 1
1 626 . 3 1 1 A 57 57 VAL H H 57 7.204 7.797 -0.593 1
1 627 . 3 1 1 A 57 57 VAL HA H 57 3.889 4.231 -0.342 1
1 635 . 3 1 1 A 57 57 VAL C C 57 175.371 175.163 0.208 1
1 636 . 3 1 1 A 57 57 VAL CA C 57 63.908 61.583 2.325 1
1 637 . 3 1 1 A 57 57 VAL CB C 57 31.557 33.001 -1.444 1
1 640 . 3 1 1 A 57 57 VAL N N 57 121.341 119.852 1.489 1
1 641 . 3 1 1 A 58 58 ALA H H 58 8.920 8.589 0.331 1
1 642 . 3 1 1 A 58 58 ALA HA H 58 4.547 4.528 0.019 1
1 646 . 3 1 1 A 58 58 ALA C C 58 177.064 177.703 -0.639 1
1 647 . 3 1 1 A 58 58 ALA CA C 58 51.173 50.686 0.487 1
1 648 . 3 1 1 A 58 58 ALA CB C 58 17.842 17.910 -0.068 1
1 649 . 3 1 1 A 58 58 ALA N N 58 132.726 130.280 2.446 1
1 650 . 3 1 1 A 59 59 PRO HA H 59 4.101 4.236 -0.135 1
1 657 . 3 1 1 A 59 59 PRO C C 59 179.482 178.432 1.050 1
1 658 . 3 1 1 A 59 59 PRO CA C 59 66.060 65.625 0.435 1
1 659 . 3 1 1 A 59 59 PRO CB C 59 31.951 31.778 0.173 1
1 662 . 3 1 1 A 60 60 ALA H H 60 8.706 8.224 0.482 1
1 663 . 3 1 1 A 60 60 ALA HA H 60 4.057 3.994 0.063 1
1 667 . 3 1 1 A 60 60 ALA C C 60 179.627 180.294 -0.667 1
1 668 . 3 1 1 A 60 60 ALA CA C 60 55.305 55.291 0.014 1
1 669 . 3 1 1 A 60 60 ALA CB C 60 18.737 18.355 0.382 1
1 670 . 3 1 1 A 60 60 ALA N N 60 117.882 118.681 -0.799 1
1 671 . 3 1 1 A 61 61 THR H H 61 7.312 7.783 -0.471 1
1 672 . 3 1 1 A 61 61 THR HA H 61 4.153 4.107 0.046 1
1 677 . 3 1 1 A 61 61 THR C C 61 175.824 177.083 -1.259 1
1 678 . 3 1 1 A 61 61 THR CA C 61 66.412 66.348 0.064 1
1 679 . 3 1 1 A 61 61 THR CB C 61 68.787 68.458 0.329 1
1 681 . 3 1 1 A 61 61 THR N N 61 114.483 114.102 0.381 1
1 682 . 3 1 1 A 62 62 LYS H H 62 7.556 7.652 -0.096 1
1 683 . 3 1 1 A 62 62 LYS HA H 62 3.943 4.029 -0.086 1
1 692 . 3 1 1 A 62 62 LYS C C 62 176.884 178.951 -2.067 1
1 693 . 3 1 1 A 62 62 LYS CA C 62 59.095 59.123 -0.028 1
1 694 . 3 1 1 A 62 62 LYS CB C 62 32.204 32.043 0.161 1
1 698 . 3 1 1 A 62 62 LYS N N 62 118.994 119.686 -0.692 1
1 699 . 3 1 1 A 63 63 ARG H H 63 7.474 7.574 -0.100 1
1 700 . 3 1 1 A 63 63 ARG HA H 63 4.034 4.079 -0.045 1
1 707 . 3 1 1 A 63 63 ARG C C 63 177.574 178.815 -1.241 1
1 708 . 3 1 1 A 63 63 ARG CA C 63 58.143 58.690 -0.547 1
1 709 . 3 1 1 A 63 63 ARG CB C 63 30.755 30.328 0.427 1
1 712 . 3 1 1 A 63 63 ARG N N 63 114.251 120.339 -6.088 1
1 713 . 3 1 1 A 64 64 LEU H H 64 6.991 8.073 -1.082 1
1 714 . 3 1 1 A 64 64 LEU HA H 64 3.904 3.874 0.030 1
1 724 . 3 1 1 A 64 64 LEU C C 64 176.632 176.327 0.305 1
1 725 . 3 1 1 A 64 64 LEU CA C 64 56.503 57.574 -1.071 1
1 726 . 3 1 1 A 64 64 LEU CB C 64 42.929 42.048 0.881 1
1 730 . 3 1 1 A 64 64 LEU N N 64 116.109 119.851 -3.742 1
1 731 . 3 1 1 A 65 65 PHE H H 65 7.673 7.638 0.035 1
1 732 . 3 1 1 A 65 65 PHE HA H 65 5.386 5.155 0.231 1
1 740 . 3 1 1 A 65 65 PHE C C 65 173.067 174.504 -1.437 1
1 741 . 3 1 1 A 65 65 PHE CA C 65 56.521 56.276 0.245 1
1 742 . 3 1 1 A 65 65 PHE CB C 65 41.270 41.852 -0.582 1
1 748 . 3 1 1 A 65 65 PHE N N 65 116.182 114.828 1.354 1
1 749 . 3 1 1 A 66 66 ALA H H 66 8.914 8.810 0.104 1
1 750 . 3 1 1 A 66 66 ALA HA H 66 4.748 5.051 -0.303 1
1 754 . 3 1 1 A 66 66 ALA C C 66 175.223 175.896 -0.673 1
1 755 . 3 1 1 A 66 66 ALA CA C 66 50.050 50.536 -0.486 1
1 756 . 3 1 1 A 66 66 ALA CB C 66 21.161 20.558 0.603 1
1 757 . 3 1 1 A 66 66 ALA N N 66 122.870 125.679 -2.809 1
1 758 . 3 1 1 A 67 67 LEU H H 67 8.498 9.228 -0.730 1
1 759 . 3 1 1 A 67 67 LEU HA H 67 4.713 4.986 -0.273 1
1 769 . 3 1 1 A 67 67 LEU C C 67 175.146 175.167 -0.021 1
1 770 . 3 1 1 A 67 67 LEU CA C 67 52.518 53.445 -0.927 1
1 771 . 3 1 1 A 67 67 LEU CB C 67 45.308 44.562 0.746 1
1 775 . 3 1 1 A 67 67 LEU N N 67 122.208 126.884 -4.676 1
1 776 . 3 1 1 A 68 68 ASN H H 68 8.357 8.408 -0.051 1
1 777 . 3 1 1 A 68 68 ASN HA H 68 4.679 4.748 -0.069 1
1 782 . 3 1 1 A 68 68 ASN C C 68 176.228 175.612 0.616 1
1 783 . 3 1 1 A 68 68 ASN CA C 68 53.524 53.670 -0.146 1
1 784 . 3 1 1 A 68 68 ASN CB C 68 39.580 38.800 0.780 1
1 785 . 3 1 1 A 68 68 ASN N N 68 126.940 125.473 1.467 1
1 787 . 3 1 1 A 69 69 ASN H H 69 8.861 8.780 0.081 1
1 788 . 3 1 1 A 69 69 ASN HA H 69 5.137 4.868 0.269 1
1 793 . 3 1 1 A 69 69 ASN C C 69 175.631 176.015 -0.384 1
1 794 . 3 1 1 A 69 69 ASN CA C 69 56.009 54.380 1.629 1
1 795 . 3 1 1 A 69 69 ASN CB C 69 40.314 38.620 1.694 1
1 796 . 3 1 1 A 69 69 ASN N N 69 124.980 123.655 1.325 1
1 798 . 3 1 1 A 70 70 THR H H 70 8.635 7.801 0.834 1
1 799 . 3 1 1 A 70 70 THR HA H 70 4.815 4.408 0.407 1
1 804 . 3 1 1 A 70 70 THR C C 70 176.223 176.184 0.039 1
1 805 . 3 1 1 A 70 70 THR CA C 70 63.944 63.907 0.037 1
1 806 . 3 1 1 A 70 70 THR CB C 70 69.727 70.220 -0.493 1
1 808 . 3 1 1 A 70 70 THR N N 70 110.394 112.154 -1.760 1
1 809 . 3 1 1 A 71 71 THR H H 71 8.069 7.929 0.140 1
1 810 . 3 1 1 A 71 71 THR HA H 71 4.566 4.771 -0.205 1
1 815 . 3 1 1 A 71 71 THR C C 71 176.213 175.901 0.312 1
1 816 . 3 1 1 A 71 71 THR CA C 71 61.683 62.126 -0.443 1
1 817 . 3 1 1 A 71 71 THR CB C 71 70.832 71.401 -0.569 1
1 819 . 3 1 1 A 71 71 THR N N 71 110.507 109.072 1.435 1
1 820 . 3 1 1 A 72 72 GLY H H 72 7.990 8.473 -0.483 1
1 821 . 3 1 1 A 72 72 GLY HA2 H 72 3.186 2.779 0.407 1
1 822 . 3 1 1 A 72 72 GLY HA3 H 72 2.516 3.477 -0.961 1
1 823 . 3 1 1 A 72 72 GLY C C 72 172.988 173.909 -0.921 1
1 824 . 3 1 1 A 72 72 GLY CA C 72 45.149 45.026 0.123 1
1 825 . 3 1 1 A 72 72 GLY N N 72 110.788 111.629 -0.841 1
1 826 . 3 1 1 A 73 73 LEU H H 73 7.138 7.479 -0.341 1
1 827 . 3 1 1 A 73 73 LEU HA H 73 4.414 4.579 -0.165 1
1 837 . 3 1 1 A 73 73 LEU C C 73 176.836 175.023 1.813 1
1 838 . 3 1 1 A 73 73 LEU CA C 73 55.252 54.076 1.176 1
1 839 . 3 1 1 A 73 73 LEU CB C 73 43.574 42.628 0.946 1
1 843 . 3 1 1 A 73 73 LEU N N 73 119.222 122.892 -3.670 1
1 844 . 3 1 1 A 74 74 ILE H H 74 8.925 8.681 0.244 1
1 845 . 3 1 1 A 74 74 ILE HA H 74 5.555 4.954 0.601 1
1 855 . 3 1 1 A 74 74 ILE C C 74 175.978 175.640 0.338 1
1 856 . 3 1 1 A 74 74 ILE CA C 74 60.100 60.982 -0.882 1
1 857 . 3 1 1 A 74 74 ILE CB C 74 38.550 37.878 0.672 1
1 861 . 3 1 1 A 74 74 ILE N N 74 129.871 129.519 0.352 1
1 862 . 3 1 1 A 75 75 THR H H 75 9.161 8.901 0.260 1
1 863 . 3 1 1 A 75 75 THR HA H 75 5.375 5.411 -0.036 1
1 868 . 3 1 1 A 75 75 THR C C 75 174.798 173.899 0.899 1
1 869 . 3 1 1 A 75 75 THR CA C 75 58.796 59.592 -0.796 1
1 870 . 3 1 1 A 75 75 THR CB C 75 72.978 71.968 1.010 1
1 872 . 3 1 1 A 75 75 THR N N 75 117.522 118.078 -0.556 1
1 873 . 3 1 1 A 76 76 VAL H H 76 8.327 8.754 -0.427 1
1 874 . 3 1 1 A 76 76 VAL HA H 76 3.973 3.890 0.083 1
1 882 . 3 1 1 A 76 76 VAL C C 76 176.495 175.901 0.594 1
1 883 . 3 1 1 A 76 76 VAL CA C 76 64.085 63.302 0.783 1
1 884 . 3 1 1 A 76 76 VAL CB C 76 32.863 31.014 1.849 1
1 887 . 3 1 1 A 76 76 VAL N N 76 120.876 123.397 -2.521 1
1 888 . 3 1 1 A 77 77 GLN H H 77 9.525 8.477 1.048 1
1 889 . 3 1 1 A 77 77 GLN HA H 77 4.702 4.250 0.452 1
1 896 . 3 1 1 A 77 77 GLN C C 77 173.838 175.405 -1.567 1
1 897 . 3 1 1 A 77 77 GLN CA C 77 55.728 57.139 -1.411 1
1 898 . 3 1 1 A 77 77 GLN CB C 77 30.762 30.234 0.528 1
1 900 . 3 1 1 A 77 77 GLN N N 77 129.825 129.306 0.519 1
1 902 . 3 1 1 A 78 78 ARG H H 78 7.621 7.158 0.463 1
1 903 . 3 1 1 A 78 78 ARG HA H 78 4.347 4.772 -0.425 1
1 910 . 3 1 1 A 78 78 ARG C C 78 172.304 175.546 -3.242 1
1 911 . 3 1 1 A 78 78 ARG CA C 78 54.634 54.090 0.544 1
1 912 . 3 1 1 A 78 78 ARG CB C 78 34.685 35.194 -0.509 1
1 915 . 3 1 1 A 78 78 ARG N N 78 120.595 117.205 3.390 1
1 916 . 3 1 1 A 79 79 SER H H 79 7.958 8.454 -0.496 1
1 917 . 3 1 1 A 79 79 SER HA H 79 4.030 4.407 -0.377 1
1 920 . 3 1 1 A 79 79 SER C C 79 174.311 174.541 -0.230 1
1 921 . 3 1 1 A 79 79 SER CA C 79 59.889 59.383 0.506 1
1 922 . 3 1 1 A 79 79 SER CB C 79 63.548 63.857 -0.309 1
1 923 . 3 1 1 A 79 79 SER N N 79 112.565 116.766 -4.201 1
1 924 . 3 1 1 A 80 80 LEU H H 80 8.715 8.058 0.657 1
1 925 . 3 1 1 A 80 80 LEU HA H 80 4.114 4.825 -0.711 1
1 935 . 3 1 1 A 80 80 LEU C C 80 176.057 175.709 0.348 1
1 936 . 3 1 1 A 80 80 LEU CA C 80 55.091 53.493 1.598 1
1 937 . 3 1 1 A 80 80 LEU CB C 80 42.341 43.639 -1.298 1
1 941 . 3 1 1 A 80 80 LEU N N 80 123.070 126.061 -2.991 1
1 942 . 3 1 1 A 81 81 ASP H H 81 7.298 8.665 -1.367 1
1 943 . 3 1 1 A 81 81 ASP HA H 81 4.725 5.439 -0.714 1
1 946 . 3 1 1 A 81 81 ASP C C 81 175.939 176.120 -0.181 1
1 947 . 3 1 1 A 81 81 ASP CA C 81 53.664 53.006 0.658 1
1 948 . 3 1 1 A 81 81 ASP CB C 81 42.947 44.041 -1.094 1
1 949 . 3 1 1 A 81 81 ASP N N 81 115.229 119.380 -4.151 1
1 950 . 3 1 1 A 82 82 ARG H H 82 9.289 8.454 0.835 1
1 951 . 3 1 1 A 82 82 ARG HA H 82 4.416 4.228 0.188 1
1 959 . 3 1 1 A 82 82 ARG C C 82 176.406 178.144 -1.738 1
1 960 . 3 1 1 A 82 82 ARG CA C 82 56.397 58.613 -2.216 1
1 961 . 3 1 1 A 82 82 ARG CB C 82 30.638 29.771 0.867 1
1 964 . 3 1 1 A 82 82 ARG N N 82 123.174 125.771 -2.597 1
1 966 . 3 1 1 A 83 83 GLU H H 83 8.468 8.351 0.117 1
1 967 . 3 1 1 A 83 83 GLU HA H 83 3.982 4.035 -0.053 1
1 972 . 3 1 1 A 83 83 GLU C C 83 177.740 178.771 -1.031 1
1 973 . 3 1 1 A 83 83 GLU CA C 83 58.425 59.265 -0.840 1
1 974 . 3 1 1 A 83 83 GLU CB C 83 29.701 29.289 0.412 1
1 976 . 3 1 1 A 83 83 GLU N N 83 119.549 119.225 0.324 1
1 977 . 3 1 1 A 84 84 GLU H H 84 8.033 7.736 0.297 1
1 978 . 3 1 1 A 84 84 GLU HA H 84 4.206 4.187 0.019 1
1 983 . 3 1 1 A 84 84 GLU C C 84 176.837 176.002 0.835 1
1 984 . 3 1 1 A 84 84 GLU CA C 84 58.056 58.503 -0.447 1
1 985 . 3 1 1 A 84 84 GLU CB C 84 30.432 30.875 -0.443 1
1 987 . 3 1 1 A 84 84 GLU N N 84 118.333 119.354 -1.021 1
1 988 . 3 1 1 A 85 85 THR H H 85 7.651 7.180 0.471 1
1 989 . 3 1 1 A 85 85 THR HA H 85 4.307 4.585 -0.278 1
1 994 . 3 1 1 A 85 85 THR C C 85 171.568 173.663 -2.095 1
1 995 . 3 1 1 A 85 85 THR CA C 85 61.387 59.858 1.529 1
1 996 . 3 1 1 A 85 85 THR CB C 85 69.963 71.093 -1.130 1
1 998 . 3 1 1 A 85 85 THR N N 85 112.444 112.254 0.190 1
1 999 . 3 1 1 A 86 86 ALA H H 86 8.639 8.614 0.025 1
1 1000 . 3 1 1 A 86 86 ALA HA H 86 4.603 4.384 0.219 1
1 1004 . 3 1 1 A 86 86 ALA C C 86 175.560 176.836 -1.276 1
1 1005 . 3 1 1 A 86 86 ALA CA C 86 52.156 53.277 -1.121 1
1 1006 . 3 1 1 A 86 86 ALA CB C 86 20.378 20.244 0.134 1
1 1007 . 3 1 1 A 86 86 ALA N N 86 127.705 127.266 0.439 1
1 1008 . 3 1 1 A 87 87 ILE H H 87 7.663 7.678 -0.015 1
1 1009 . 3 1 1 A 87 87 ILE HA H 87 4.828 4.434 0.394 1
1 1019 . 3 1 1 A 87 87 ILE C C 87 174.537 174.748 -0.211 1
1 1020 . 3 1 1 A 87 87 ILE CA C 87 60.329 60.237 0.092 1
1 1021 . 3 1 1 A 87 87 ILE CB C 87 41.090 38.603 2.487 1
1 1025 . 3 1 1 A 87 87 ILE N N 87 118.712 117.997 0.715 1
1 1026 . 3 1 1 A 88 88 HIS H H 88 9.098 8.731 0.367 1
1 1027 . 3 1 1 A 88 88 HIS HA H 88 4.576 5.162 -0.586 1
1 1032 . 3 1 1 A 88 88 HIS C C 88 174.354 174.255 0.099 1
1 1033 . 3 1 1 A 88 88 HIS CA C 88 54.740 54.473 0.267 1
1 1034 . 3 1 1 A 88 88 HIS CB C 88 33.955 31.730 2.225 1
1 1037 . 3 1 1 A 88 88 HIS N N 88 126.285 125.963 0.322 1
1 1038 . 3 1 1 A 89 89 LYS H H 89 8.957 8.966 -0.009 1
1 1039 . 3 1 1 A 89 89 LYS HA H 89 4.873 4.667 0.206 1
1 1048 . 3 1 1 A 89 89 LYS C C 89 175.906 175.586 0.320 1
1 1049 . 3 1 1 A 89 89 LYS CA C 89 55.269 55.259 0.010 1
1 1050 . 3 1 1 A 89 89 LYS CB C 89 32.945 33.545 -0.600 1
1 1054 . 3 1 1 A 89 89 LYS N N 89 124.332 124.175 0.157 1
1 1055 . 3 1 1 A 90 90 VAL H H 90 9.174 8.599 0.575 1
1 1056 . 3 1 1 A 90 90 VAL HA H 90 4.227 4.876 -0.649 1
1 1064 . 3 1 1 A 90 90 VAL C C 90 174.168 174.786 -0.618 1
1 1065 . 3 1 1 A 90 90 VAL CA C 90 61.369 61.355 0.014 1
1 1066 . 3 1 1 A 90 90 VAL CB C 90 34.082 33.858 0.224 1
1 1069 . 3 1 1 A 90 90 VAL N N 90 124.319 125.168 -0.849 1
1 1070 . 3 1 1 A 91 91 THR H H 91 6.697 8.908 -2.211 1
1 1071 . 3 1 1 A 91 91 THR HA H 91 5.163 4.978 0.185 1
1 1076 . 3 1 1 A 91 91 THR C C 91 173.812 174.024 -0.212 1
1 1077 . 3 1 1 A 91 91 THR CA C 91 61.935 61.813 0.122 1
1 1078 . 3 1 1 A 91 91 THR CB C 91 70.412 70.497 -0.085 1
1 1080 . 3 1 1 A 91 91 THR N N 91 122.637 123.549 -0.912 1
1 1081 . 3 1 1 A 92 92 VAL H H 92 9.292 8.887 0.405 1
1 1082 . 3 1 1 A 92 92 VAL HA H 92 4.736 4.900 -0.164 1
1 1090 . 3 1 1 A 92 92 VAL C C 92 173.160 174.213 -1.053 1
1 1091 . 3 1 1 A 92 92 VAL CA C 92 60.982 60.768 0.214 1
1 1092 . 3 1 1 A 92 92 VAL CB C 92 35.130 34.064 1.066 1
1 1095 . 3 1 1 A 92 92 VAL N N 92 128.265 126.806 1.459 1
1 1096 . 3 1 1 A 93 93 LEU H H 93 9.495 9.039 0.456 1
1 1097 . 3 1 1 A 93 93 LEU HA H 93 5.628 5.416 0.212 1
1 1107 . 3 1 1 A 93 93 LEU C C 93 176.274 175.274 1.000 1
1 1108 . 3 1 1 A 93 93 LEU CA C 93 52.773 53.176 -0.403 1
1 1109 . 3 1 1 A 93 93 LEU CB C 93 43.454 43.132 0.322 1
1 1113 . 3 1 1 A 93 93 LEU N N 93 126.350 127.525 -1.175 1
1 1114 . 3 1 1 A 94 94 ALA H H 94 8.688 9.082 -0.394 1
1 1115 . 3 1 1 A 94 94 ALA HA H 94 4.986 5.345 -0.359 1
1 1119 . 3 1 1 A 94 94 ALA C C 94 175.787 176.045 -0.258 1
1 1120 . 3 1 1 A 94 94 ALA CA C 94 49.610 50.350 -0.740 1
1 1121 . 3 1 1 A 94 94 ALA CB C 94 21.463 20.987 0.476 1
1 1122 . 3 1 1 A 94 94 ALA N N 94 123.429 128.913 -5.484 1
1 1123 . 3 1 1 A 95 95 SER H H 95 8.401 8.686 -0.285 1
1 1124 . 3 1 1 A 95 95 SER HA H 95 4.828 4.937 -0.109 1
1 1127 . 3 1 1 A 95 95 SER C C 95 174.327 173.896 0.431 1
1 1128 . 3 1 1 A 95 95 SER CA C 95 56.239 56.173 0.066 1
1 1129 . 3 1 1 A 95 95 SER CB C 95 65.561 65.208 0.353 1
1 1130 . 3 1 1 A 95 95 SER N N 95 114.418 117.461 -3.043 1
1 1131 . 3 1 1 A 96 96 ASP H H 96 8.690 8.976 -0.286 1
1 1132 . 3 1 1 A 96 96 ASP HA H 96 4.908 4.658 0.250 1
1 1135 . 3 1 1 A 96 96 ASP C C 96 177.096 176.105 0.991 1
1 1136 . 3 1 1 A 96 96 ASP CA C 96 52.818 55.151 -2.333 1
1 1137 . 3 1 1 A 96 96 ASP CB C 96 41.253 42.791 -1.538 1
1 1138 . 3 1 1 A 96 96 ASP N N 96 125.624 128.075 -2.451 1
1 1139 . 3 1 1 A 97 97 GLY H H 97 8.524 7.204 1.320 1
1 1140 . 3 1 1 A 97 97 GLY HA2 H 97 4.320 4.044 0.276 1
1 1141 . 3 1 1 A 97 97 GLY HA3 H 97 3.620 4.047 -0.427 1
1 1142 . 3 1 1 A 97 97 GLY C C 97 174.620 173.108 1.512 1
1 1143 . 3 1 1 A 97 97 GLY CA C 97 45.422 45.527 -0.105 1
1 1144 . 3 1 1 A 97 97 GLY N N 97 109.283 106.373 2.910 1
1 1145 . 3 1 1 A 98 98 SER H H 98 8.575 8.953 -0.378 1
1 1146 . 3 1 1 A 98 98 SER HA H 98 4.607 3.980 0.627 1
1 1149 . 3 1 1 A 98 98 SER C C 98 174.478 172.944 1.534 1
1 1150 . 3 1 1 A 98 98 SER CA C 98 59.095 58.925 0.170 1
1 1151 . 3 1 1 A 98 98 SER CB C 98 64.800 61.420 3.380 1
1 1152 . 3 1 1 A 98 98 SER N N 98 116.640 118.682 -2.042 1
1 1153 . 3 1 1 A 99 99 SER H H 99 8.945 7.786 1.159 1
1 1154 . 3 1 1 A 99 99 SER HA H 99 4.530 4.652 -0.122 1
1 1157 . 3 1 1 A 99 99 SER C C 99 174.491 172.902 1.589 1
1 1158 . 3 1 1 A 99 99 SER CA C 99 58.460 57.737 0.723 1
1 1159 . 3 1 1 A 99 99 SER CB C 99 64.146 65.508 -1.362 1
1 1160 . 3 1 1 A 99 99 SER N N 99 117.676 114.533 3.143 1
1 1161 . 3 1 1 A 100 100 THR H H 100 8.411 8.518 -0.107 1
1 1162 . 3 1 1 A 100 100 THR HA H 100 4.490 4.357 0.133 1
1 1167 . 3 1 1 A 100 100 THR C C 100 172.766 172.889 -0.123 1
1 1168 . 3 1 1 A 100 100 THR CA C 100 60.629 61.391 -0.762 1
1 1169 . 3 1 1 A 100 100 THR CB C 100 69.778 69.352 0.426 1
1 1171 . 3 1 1 A 100 100 THR N N 100 118.401 123.079 -4.678 1
1 1172 . 3 1 1 A 101 101 PRO HA H 101 4.631 4.942 -0.311 1
1 1179 . 3 1 1 A 101 101 PRO C C 101 177.227 175.334 1.893 1
1 1180 . 3 1 1 A 101 101 PRO CA C 101 63.097 62.343 0.754 1
1 1181 . 3 1 1 A 101 101 PRO CB C 101 32.917 32.136 0.781 1
1 1184 . 3 1 1 A 102 102 ALA H H 102 8.497 8.198 0.299 1
1 1185 . 3 1 1 A 102 102 ALA HA H 102 4.619 4.837 -0.218 1
1 1189 . 3 1 1 A 102 102 ALA C C 102 176.542 176.664 -0.122 1
1 1190 . 3 1 1 A 102 102 ALA CA C 102 51.390 50.941 0.449 1
1 1191 . 3 1 1 A 102 102 ALA CB C 102 20.815 20.554 0.261 1
1 1192 . 3 1 1 A 102 102 ALA N N 102 124.487 123.975 0.512 1
1 1193 . 3 1 1 A 103 103 ARG H H 103 8.663 8.517 0.146 1
1 1194 . 3 1 1 A 103 103 ARG HA H 103 5.515 4.810 0.705 1
1 1201 . 3 1 1 A 103 103 ARG C C 103 174.539 175.571 -1.032 1
1 1202 . 3 1 1 A 103 103 ARG CA C 103 55.164 55.712 -0.548 1
1 1203 . 3 1 1 A 103 103 ARG CB C 103 34.393 30.957 3.436 1
1 1206 . 3 1 1 A 103 103 ARG N N 103 119.596 122.784 -3.188 1
1 1207 . 3 1 1 A 104 104 ALA H H 104 9.027 8.343 0.684 1
1 1208 . 3 1 1 A 104 104 ALA HA H 104 4.782 5.149 -0.367 1
1 1212 . 3 1 1 A 104 104 ALA C C 104 176.276 175.496 0.780 1
1 1213 . 3 1 1 A 104 104 ALA CA C 104 50.297 50.874 -0.577 1
1 1214 . 3 1 1 A 104 104 ALA CB C 104 20.810 21.953 -1.143 1
1 1215 . 3 1 1 A 104 104 ALA N N 104 126.962 123.760 3.202 1
1 1216 . 3 1 1 A 105 105 THR H H 105 8.384 8.774 -0.390 1
1 1217 . 3 1 1 A 105 105 THR HA H 105 4.954 4.954 0.000 1
1 1222 . 3 1 1 A 105 105 THR C C 105 173.243 173.657 -0.414 1
1 1223 . 3 1 1 A 105 105 THR CA C 105 61.475 62.294 -0.819 1
1 1224 . 3 1 1 A 105 105 THR CB C 105 70.569 70.573 -0.004 1
1 1226 . 3 1 1 A 105 105 THR N N 105 115.327 119.460 -4.133 1
1 1227 . 3 1 1 A 106 106 VAL H H 106 8.970 8.761 0.209 1
1 1228 . 3 1 1 A 106 106 VAL HA H 106 4.702 4.756 -0.054 1
1 1236 . 3 1 1 A 106 106 VAL C C 106 174.743 174.724 0.019 1
1 1237 . 3 1 1 A 106 106 VAL CA C 106 59.712 60.973 -1.261 1
1 1238 . 3 1 1 A 106 106 VAL CB C 106 34.327 34.546 -0.219 1
1 1241 . 3 1 1 A 106 106 VAL N N 106 126.226 124.873 1.353 1
1 1242 . 3 1 1 A 107 107 THR H H 107 8.833 8.565 0.268 1
1 1243 . 3 1 1 A 107 107 THR HA H 107 4.862 4.601 0.261 1
1 1248 . 3 1 1 A 107 107 THR C C 107 172.970 174.131 -1.161 1
1 1249 . 3 1 1 A 107 107 THR CA C 107 62.322 62.307 0.015 1
1 1250 . 3 1 1 A 107 107 THR CB C 107 69.463 69.709 -0.246 1
1 1252 . 3 1 1 A 107 107 THR N N 107 125.403 121.854 3.549 1
1 1253 . 3 1 1 A 108 108 ILE H H 108 9.234 8.946 0.288 1
1 1254 . 3 1 1 A 108 108 ILE HA H 108 4.178 4.553 -0.375 1
1 1264 . 3 1 1 A 108 108 ILE C C 108 174.087 174.782 -0.695 1
1 1265 . 3 1 1 A 108 108 ILE CA C 108 60.365 60.444 -0.079 1
1 1266 . 3 1 1 A 108 108 ILE CB C 108 39.745 39.608 0.137 1
1 1270 . 3 1 1 A 108 108 ILE N N 108 127.152 128.236 -1.084 1
1 1271 . 3 1 1 A 109 109 ASN H H 109 8.723 8.653 0.070 1
1 1272 . 3 1 1 A 109 109 ASN HA H 109 5.147 5.091 0.056 1
1 1277 . 3 1 1 A 109 109 ASN C C 109 173.592 174.730 -1.138 1
1 1278 . 3 1 1 A 109 109 ASN CA C 109 52.501 52.961 -0.460 1
1 1279 . 3 1 1 A 109 109 ASN CB C 109 40.791 39.164 1.627 1
1 1280 . 3 1 1 A 109 109 ASN N N 109 126.866 125.818 1.048 1
1 1282 . 3 1 1 A 110 110 VAL H H 110 9.046 8.649 0.397 1
1 1283 . 3 1 1 A 110 110 VAL HA H 110 5.081 4.814 0.267 1
1 1291 . 3 1 1 A 110 110 VAL C C 110 176.921 175.987 0.934 1
1 1292 . 3 1 1 A 110 110 VAL CA C 110 61.634 61.832 -0.198 1
1 1293 . 3 1 1 A 110 110 VAL CB C 110 31.809 32.413 -0.604 1
1 1296 . 3 1 1 A 110 110 VAL N N 110 126.070 125.239 0.831 1
1 1297 . 3 1 1 A 111 111 THR H H 111 9.197 8.525 0.672 1
1 1298 . 3 1 1 A 111 111 THR HA H 111 4.566 5.256 -0.690 1
1 1303 . 3 1 1 A 111 111 THR C C 111 174.087 174.201 -0.114 1
1 1304 . 3 1 1 A 111 111 THR CA C 111 61.145 59.457 1.688 1
1 1305 . 3 1 1 A 111 111 THR CB C 111 70.706 71.162 -0.456 1
1 1307 . 3 1 1 A 111 111 THR N N 111 121.425 118.156 3.269 1
1 1308 . 3 1 1 A 112 112 ASP H H 112 8.435 8.804 -0.369 1
1 1309 . 3 1 1 A 112 112 ASP HA H 112 4.656 4.782 -0.126 1
1 1312 . 3 1 1 A 112 112 ASP C C 112 176.745 176.891 -0.146 1
1 1313 . 3 1 1 A 112 112 ASP CA C 112 54.158 54.646 -0.488 1
1 1314 . 3 1 1 A 112 112 ASP CB C 112 41.575 41.766 -0.191 1
1 1315 . 3 1 1 A 112 112 ASP N N 112 119.566 121.851 -2.285 1
1 1316 . 3 1 1 A 113 113 VAL H H 113 8.629 8.685 -0.056 1
1 1317 . 3 1 1 A 113 113 VAL HA H 113 4.078 4.410 -0.332 1
1 1325 . 3 1 1 A 113 113 VAL C C 113 175.247 176.390 -1.143 1
1 1326 . 3 1 1 A 113 113 VAL CA C 113 62.533 61.654 0.879 1
1 1327 . 3 1 1 A 113 113 VAL CB C 113 32.534 33.609 -1.075 1
1 1330 . 3 1 1 A 113 113 VAL N N 113 119.356 117.286 2.070 1
1 4 . 4 1 1 A 2 2 SER H H 2 8.289 8.470 -0.181 1
1 5 . 4 1 1 A 2 2 SER HA H 2 4.530 5.265 -0.735 1
1 7 . 4 1 1 A 2 2 SER C C 2 174.868 175.059 -0.191 1
1 8 . 4 1 1 A 2 2 SER CA C 2 58.284 56.331 1.953 1
1 9 . 4 1 1 A 2 2 SER CB C 2 63.769 66.360 -2.591 1
1 10 . 4 1 1 A 2 2 SER N N 2 115.842 115.114 0.728 1
1 11 . 4 1 1 A 3 3 SER H H 3 8.490 9.112 -0.622 1
1 12 . 4 1 1 A 3 3 SER HA H 3 4.496 4.161 0.335 1
1 14 . 4 1 1 A 3 3 SER C C 3 175.043 174.522 0.521 1
1 15 . 4 1 1 A 3 3 SER CA C 3 58.549 60.864 -2.315 1
1 16 . 4 1 1 A 3 3 SER CB C 3 63.687 63.581 0.106 1
1 17 . 4 1 1 A 3 3 SER N N 3 117.930 118.780 -0.850 1
1 18 . 4 1 1 A 4 4 GLY H H 4 8.482 7.732 0.750 1
1 19 . 4 1 1 A 4 4 GLY C C 4 174.344 174.205 0.139 1
1 20 . 4 1 1 A 4 4 GLY CA C 4 45.536 44.889 0.647 1
1 21 . 4 1 1 A 4 4 GLY N N 4 110.985 108.393 2.592 1
1 22 . 4 1 1 A 6 6 SER HA H 6 4.508 5.253 -0.745 1
1 24 . 4 1 1 A 6 6 SER C C 6 175.026 173.729 1.297 1
1 25 . 4 1 1 A 6 6 SER CA C 6 58.584 56.466 2.118 1
1 26 . 4 1 1 A 6 6 SER CB C 6 63.646 66.334 -2.688 1
1 27 . 4 1 1 A 7 7 GLY H H 7 8.419 8.574 -0.155 1
1 28 . 4 1 1 A 7 7 GLY HA2 H 7 3.993 4.460 -0.467 1
1 29 . 4 1 1 A 7 7 GLY C C 7 173.995 173.776 0.219 1
1 30 . 4 1 1 A 7 7 GLY CA C 7 45.466 44.602 0.864 1
1 31 . 4 1 1 A 7 7 GLY N N 7 110.615 107.583 3.032 1
1 32 . 4 1 1 A 8 8 ASN H H 8 8.322 9.187 -0.865 1
1 33 . 4 1 1 A 8 8 ASN HA H 8 4.736 4.861 -0.125 1
1 38 . 4 1 1 A 8 8 ASN C C 8 174.907 174.227 0.680 1
1 39 . 4 1 1 A 8 8 ASN CA C 8 53.259 53.864 -0.605 1
1 40 . 4 1 1 A 8 8 ASN CB C 8 39.127 41.046 -1.919 1
1 41 . 4 1 1 A 8 8 ASN N N 8 118.602 118.716 -0.114 1
1 43 . 4 1 1 A 9 9 ASP H H 9 8.370 7.729 0.641 1
1 44 . 4 1 1 A 9 9 ASP HA H 9 4.594 4.857 -0.263 1
1 47 . 4 1 1 A 9 9 ASP C C 9 175.765 174.306 1.459 1
1 48 . 4 1 1 A 9 9 ASP CA C 9 54.440 53.522 0.918 1
1 49 . 4 1 1 A 9 9 ASP CB C 9 40.898 43.873 -2.975 1
1 50 . 4 1 1 A 9 9 ASP N N 9 120.504 117.358 3.146 1
1 51 . 4 1 1 A 10 10 ASN H H 10 8.382 8.697 -0.315 1
1 52 . 4 1 1 A 10 10 ASN HA H 10 4.691 4.965 -0.274 1
1 57 . 4 1 1 A 10 10 ASN C C 10 174.383 175.009 -0.626 1
1 58 . 4 1 1 A 10 10 ASN CA C 10 53.241 53.618 -0.377 1
1 59 . 4 1 1 A 10 10 ASN CB C 10 38.674 40.962 -2.288 1
1 60 . 4 1 1 A 10 10 ASN N N 10 119.406 118.968 0.438 1
1 62 . 4 1 1 A 11 11 ARG H H 11 7.942 7.376 0.566 1
1 63 . 4 1 1 A 11 11 ARG HA H 11 4.684 4.549 0.135 1
1 70 . 4 1 1 A 11 11 ARG C C 11 173.640 175.135 -1.495 1
1 71 . 4 1 1 A 11 11 ARG CA C 11 54.246 54.289 -0.043 1
1 72 . 4 1 1 A 11 11 ARG CB C 11 30.337 30.600 -0.263 1
1 75 . 4 1 1 A 11 11 ARG N N 11 121.145 117.698 3.447 1
1 76 . 4 1 1 A 12 12 PRO HA H 12 4.507 4.665 -0.158 1
1 83 . 4 1 1 A 12 12 PRO CA C 12 62.714 62.486 0.228 1
1 84 . 4 1 1 A 12 12 PRO CB C 12 31.942 32.697 -0.755 1
1 87 . 4 1 1 A 13 13 VAL H H 13 8.252 8.419 -0.167 1
1 88 . 4 1 1 A 13 13 VAL HA H 13 4.159 4.711 -0.552 1
1 96 . 4 1 1 A 13 13 VAL CA C 13 61.409 59.573 1.836 1
1 97 . 4 1 1 A 13 13 VAL CB C 13 34.858 35.630 -0.772 1
1 100 . 4 1 1 A 13 13 VAL N N 13 118.395 121.399 -3.004 1
1 101 . 4 1 1 A 14 14 PHE H H 14 8.725 8.728 -0.003 1
1 102 . 4 1 1 A 14 14 PHE HA H 14 4.781 4.798 -0.017 1
1 110 . 4 1 1 A 14 14 PHE CA C 14 58.594 58.075 0.519 1
1 111 . 4 1 1 A 14 14 PHE CB C 14 39.594 39.786 -0.192 1
1 117 . 4 1 1 A 14 14 PHE N N 14 122.950 126.149 -3.199 1
1 118 . 4 1 1 A 15 15 LYS H H 15 8.885 8.932 -0.047 1
1 119 . 4 1 1 A 15 15 LYS HA H 15 4.130 4.047 0.083 1
1 128 . 4 1 1 A 15 15 LYS C C 15 177.027 176.043 0.984 1
1 129 . 4 1 1 A 15 15 LYS CA C 15 58.478 59.486 -1.008 1
1 130 . 4 1 1 A 15 15 LYS CB C 15 32.748 32.604 0.144 1
1 134 . 4 1 1 A 15 15 LYS N N 15 123.863 124.844 -0.981 1
1 135 . 4 1 1 A 16 16 GLU H H 16 8.091 7.771 0.320 1
1 136 . 4 1 1 A 16 16 GLU HA H 16 4.438 4.644 -0.206 1
1 141 . 4 1 1 A 16 16 GLU C C 16 175.947 175.961 -0.014 1
1 142 . 4 1 1 A 16 16 GLU CA C 16 56.045 55.281 0.764 1
1 143 . 4 1 1 A 16 16 GLU CB C 16 30.766 31.306 -0.540 1
1 145 . 4 1 1 A 16 16 GLU N N 16 117.026 112.836 4.190 1
1 146 . 4 1 1 A 17 17 GLY H H 17 8.421 8.305 0.116 1
1 147 . 4 1 1 A 17 17 GLY HA2 H 17 3.993 4.077 -0.084 1
1 148 . 4 1 1 A 17 17 GLY HA3 H 17 3.913 4.078 -0.165 1
1 149 . 4 1 1 A 17 17 GLY C C 17 173.564 174.043 -0.479 1
1 150 . 4 1 1 A 17 17 GLY CA C 17 45.448 46.276 -0.828 1
1 151 . 4 1 1 A 17 17 GLY N N 17 109.577 108.362 1.215 1
1 152 . 4 1 1 A 18 18 GLN H H 18 7.858 7.975 -0.117 1
1 153 . 4 1 1 A 18 18 GLN HA H 18 5.065 5.096 -0.031 1
1 160 . 4 1 1 A 18 18 GLN C C 18 174.596 174.281 0.315 1
1 161 . 4 1 1 A 18 18 GLN CA C 18 55.110 54.468 0.642 1
1 162 . 4 1 1 A 18 18 GLN CB C 18 30.329 32.258 -1.929 1
1 164 . 4 1 1 A 18 18 GLN N N 18 120.202 120.032 0.170 1
1 166 . 4 1 1 A 19 19 VAL H H 19 8.216 8.753 -0.537 1
1 167 . 4 1 1 A 19 19 VAL HA H 19 4.450 4.591 -0.141 1
1 175 . 4 1 1 A 19 19 VAL C C 19 173.648 174.533 -0.885 1
1 176 . 4 1 1 A 19 19 VAL CA C 19 60.788 61.401 -0.613 1
1 177 . 4 1 1 A 19 19 VAL CB C 19 35.336 35.142 0.194 1
1 180 . 4 1 1 A 19 19 VAL N N 19 121.257 125.156 -3.899 1
1 181 . 4 1 1 A 20 20 GLU H H 20 8.610 9.045 -0.435 1
1 182 . 4 1 1 A 20 20 GLU HA H 20 5.211 4.900 0.311 1
1 187 . 4 1 1 A 20 20 GLU C C 20 174.783 176.530 -1.747 1
1 188 . 4 1 1 A 20 20 GLU CA C 20 54.793 56.152 -1.359 1
1 189 . 4 1 1 A 20 20 GLU CB C 20 32.058 30.483 1.575 1
1 191 . 4 1 1 A 20 20 GLU N N 20 127.095 128.375 -1.280 1
1 192 . 4 1 1 A 21 21 VAL H H 21 8.727 8.820 -0.093 1
1 193 . 4 1 1 A 21 21 VAL HA H 21 4.633 5.097 -0.464 1
1 201 . 4 1 1 A 21 21 VAL C C 21 173.894 175.032 -1.138 1
1 202 . 4 1 1 A 21 21 VAL CA C 21 59.695 59.947 -0.252 1
1 203 . 4 1 1 A 21 21 VAL CB C 21 35.865 34.538 1.327 1
1 206 . 4 1 1 A 21 21 VAL N N 21 120.489 121.366 -0.877 1
1 207 . 4 1 1 A 22 22 HIS H H 22 8.680 8.892 -0.212 1
1 208 . 4 1 1 A 22 22 HIS HA H 22 5.552 5.651 -0.099 1
1 212 . 4 1 1 A 22 22 HIS C C 22 174.298 173.579 0.719 1
1 213 . 4 1 1 A 22 22 HIS CA C 22 55.331 53.759 1.572 1
1 214 . 4 1 1 A 22 22 HIS CB C 22 32.369 31.996 0.373 1
1 216 . 4 1 1 A 22 22 HIS N N 22 124.991 118.387 6.604 1
1 217 . 4 1 1 A 23 23 ILE H H 23 9.179 8.983 0.196 1
1 218 . 4 1 1 A 23 23 ILE HA H 23 5.046 4.564 0.482 1
1 228 . 4 1 1 A 23 23 ILE C C 23 171.552 173.392 -1.840 1
1 229 . 4 1 1 A 23 23 ILE CA C 23 55.551 57.096 -1.545 1
1 230 . 4 1 1 A 23 23 ILE CB C 23 42.053 41.863 0.190 1
1 234 . 4 1 1 A 23 23 ILE N N 23 123.121 124.510 -1.389 1
1 235 . 4 1 1 A 24 24 PRO HA H 24 4.816 4.755 0.061 1
1 242 . 4 1 1 A 24 24 PRO C C 24 178.887 177.891 0.996 1
1 243 . 4 1 1 A 24 24 PRO CA C 24 62.216 62.814 -0.598 1
1 244 . 4 1 1 A 24 24 PRO CB C 24 32.895 32.445 0.450 1
1 247 . 4 1 1 A 25 25 GLU H H 25 8.399 8.473 -0.074 1
1 248 . 4 1 1 A 25 25 GLU HA H 25 3.785 4.049 -0.264 1
1 253 . 4 1 1 A 25 25 GLU C C 25 175.244 177.087 -1.843 1
1 254 . 4 1 1 A 25 25 GLU CA C 25 58.425 59.237 -0.812 1
1 255 . 4 1 1 A 25 25 GLU CB C 25 30.011 28.997 1.014 1
1 257 . 4 1 1 A 25 25 GLU N N 25 117.706 122.677 -4.971 1
1 258 . 4 1 1 A 26 26 ASN H H 26 7.488 7.780 -0.292 1
1 259 . 4 1 1 A 26 26 ASN HA H 26 4.702 4.789 -0.087 1
1 264 . 4 1 1 A 26 26 ASN C C 26 175.425 175.260 0.165 1
1 265 . 4 1 1 A 26 26 ASN CA C 26 51.584 52.163 -0.579 1
1 266 . 4 1 1 A 26 26 ASN CB C 26 37.243 38.579 -1.336 1
1 267 . 4 1 1 A 26 26 ASN N N 26 112.383 117.102 -4.719 1
1 269 . 4 1 1 A 27 27 ALA H H 27 7.716 7.393 0.323 1
1 270 . 4 1 1 A 27 27 ALA HA H 27 4.409 4.347 0.062 1
1 274 . 4 1 1 A 27 27 ALA C C 27 175.850 175.774 0.076 1
1 275 . 4 1 1 A 27 27 ALA CA C 27 51.037 50.948 0.089 1
1 276 . 4 1 1 A 27 27 ALA CB C 27 18.152 18.304 -0.152 1
1 277 . 4 1 1 A 27 27 ALA N N 27 125.139 122.255 2.884 1
1 278 . 4 1 1 A 28 28 PRO HA H 28 4.422 4.529 -0.107 1
1 285 . 4 1 1 A 28 28 PRO C C 28 178.442 176.904 1.538 1
1 286 . 4 1 1 A 28 28 PRO CA C 28 62.067 62.701 -0.634 1
1 287 . 4 1 1 A 28 28 PRO CB C 28 32.642 32.252 0.390 1
1 290 . 4 1 1 A 29 29 VAL H H 29 8.691 8.322 0.369 1
1 291 . 4 1 1 A 29 29 VAL HA H 29 3.239 3.554 -0.315 1
1 299 . 4 1 1 A 29 29 VAL C C 29 176.887 177.010 -0.123 1
1 300 . 4 1 1 A 29 29 VAL CA C 29 65.812 64.373 1.439 1
1 301 . 4 1 1 A 29 29 VAL CB C 29 31.174 31.183 -0.009 1
1 304 . 4 1 1 A 29 29 VAL N N 29 123.592 122.679 0.913 1
1 305 . 4 1 1 A 30 30 GLY H H 30 9.197 8.878 0.319 1
1 306 . 4 1 1 A 30 30 GLY HA2 H 30 4.486 3.977 0.509 1
1 307 . 4 1 1 A 30 30 GLY HA3 H 30 3.581 3.981 -0.400 1
1 308 . 4 1 1 A 30 30 GLY C C 30 174.347 174.530 -0.183 1
1 309 . 4 1 1 A 30 30 GLY CA C 30 44.320 44.859 -0.539 1
1 310 . 4 1 1 A 30 30 GLY N N 30 116.042 115.271 0.771 1
1 311 . 4 1 1 A 31 31 THR H H 31 7.838 7.236 0.602 1
1 312 . 4 1 1 A 31 31 THR HA H 31 3.959 4.176 -0.217 1
1 317 . 4 1 1 A 31 31 THR C C 31 174.274 173.933 0.341 1
1 318 . 4 1 1 A 31 31 THR CA C 31 65.160 63.154 2.006 1
1 319 . 4 1 1 A 31 31 THR CB C 31 69.972 69.174 0.798 1
1 321 . 4 1 1 A 31 31 THR N N 31 117.679 117.679 0.000 1
1 322 . 4 1 1 A 32 32 SER H H 32 9.022 8.833 0.189 1
1 323 . 4 1 1 A 32 32 SER HA H 32 4.273 4.418 -0.145 1
1 326 . 4 1 1 A 32 32 SER C C 32 172.692 173.865 -1.173 1
1 327 . 4 1 1 A 32 32 SER CA C 32 59.642 59.277 0.365 1
1 328 . 4 1 1 A 32 32 SER CB C 32 63.102 62.970 0.132 1
1 329 . 4 1 1 A 32 32 SER N N 32 123.045 121.138 1.907 1
1 330 . 4 1 1 A 33 33 VAL H H 33 9.202 8.986 0.216 1
1 331 . 4 1 1 A 33 33 VAL HA H 33 3.844 4.015 -0.171 1
1 339 . 4 1 1 A 33 33 VAL C C 33 174.782 175.764 -0.982 1
1 340 . 4 1 1 A 33 33 VAL CA C 33 64.242 63.993 0.249 1
1 341 . 4 1 1 A 33 33 VAL CB C 33 32.893 32.039 0.854 1
1 344 . 4 1 1 A 33 33 VAL N N 33 126.861 126.964 -0.103 1
1 345 . 4 1 1 A 34 34 ILE H H 34 7.074 7.440 -0.366 1
1 346 . 4 1 1 A 34 34 ILE HA H 34 4.295 4.654 -0.359 1
1 356 . 4 1 1 A 34 34 ILE C C 34 170.577 172.882 -2.305 1
1 357 . 4 1 1 A 34 34 ILE CA C 34 59.500 59.199 0.301 1
1 358 . 4 1 1 A 34 34 ILE CB C 34 39.251 42.190 -2.939 1
1 362 . 4 1 1 A 34 34 ILE N N 34 111.445 119.119 -7.674 1
1 363 . 4 1 1 A 35 35 GLN H H 35 8.450 9.076 -0.626 1
1 364 . 4 1 1 A 35 35 GLN HA H 35 4.633 4.954 -0.321 1
1 371 . 4 1 1 A 35 35 GLN C C 35 174.354 174.242 0.112 1
1 372 . 4 1 1 A 35 35 GLN CA C 35 54.176 54.084 0.092 1
1 373 . 4 1 1 A 35 35 GLN CB C 35 29.456 32.186 -2.730 1
1 375 . 4 1 1 A 35 35 GLN N N 35 127.342 129.024 -1.682 1
1 377 . 4 1 1 A 36 36 LEU H H 36 7.761 9.035 -1.274 1
1 378 . 4 1 1 A 36 36 LEU HA H 36 4.492 5.171 -0.679 1
1 388 . 4 1 1 A 36 36 LEU C C 36 175.543 175.018 0.525 1
1 389 . 4 1 1 A 36 36 LEU CA C 36 53.982 53.442 0.540 1
1 390 . 4 1 1 A 36 36 LEU CB C 36 42.776 43.516 -0.740 1
1 394 . 4 1 1 A 36 36 LEU N N 36 128.895 127.880 1.015 1
1 395 . 4 1 1 A 37 37 HIS H H 37 8.529 8.874 -0.345 1
1 396 . 4 1 1 A 37 37 HIS HA H 37 4.851 5.361 -0.510 1
1 400 . 4 1 1 A 37 37 HIS C C 37 172.985 173.572 -0.587 1
1 401 . 4 1 1 A 37 37 HIS CA C 37 55.833 53.373 2.460 1
1 402 . 4 1 1 A 37 37 HIS CB C 37 32.204 32.335 -0.131 1
1 404 . 4 1 1 A 37 37 HIS N N 37 115.903 124.646 -8.743 1
1 405 . 4 1 1 A 38 38 ALA H H 38 8.474 8.565 -0.091 1
1 406 . 4 1 1 A 38 38 ALA HA H 38 4.691 4.813 -0.122 1
1 410 . 4 1 1 A 38 38 ALA C C 38 175.548 176.231 -0.683 1
1 411 . 4 1 1 A 38 38 ALA CA C 38 50.491 50.801 -0.310 1
1 412 . 4 1 1 A 38 38 ALA CB C 38 19.842 20.010 -0.168 1
1 413 . 4 1 1 A 38 38 ALA N N 38 128.891 130.836 -1.945 1
1 414 . 4 1 1 A 39 39 THR H H 39 8.095 8.601 -0.506 1
1 415 . 4 1 1 A 39 39 THR HA H 39 4.336 5.170 -0.834 1
1 420 . 4 1 1 A 39 39 THR C C 39 173.553 174.656 -1.103 1
1 421 . 4 1 1 A 39 39 THR CA C 39 60.417 59.681 0.736 1
1 422 . 4 1 1 A 39 39 THR CB C 39 70.912 71.513 -0.601 1
1 424 . 4 1 1 A 39 39 THR N N 39 110.982 114.299 -3.317 1
1 425 . 4 1 1 A 40 40 ASP H H 40 8.417 8.440 -0.023 1
1 426 . 4 1 1 A 40 40 ASP HA H 40 4.553 4.926 -0.373 1
1 429 . 4 1 1 A 40 40 ASP C C 40 176.462 175.992 0.470 1
1 430 . 4 1 1 A 40 40 ASP CA C 40 54.158 51.575 2.583 1
1 431 . 4 1 1 A 40 40 ASP CB C 40 41.517 42.051 -0.534 1
1 432 . 4 1 1 A 40 40 ASP N N 40 121.450 120.861 0.589 1
1 433 . 4 1 1 A 41 41 ALA H H 41 8.435 8.243 0.192 1
1 434 . 4 1 1 A 41 41 ALA HA H 41 4.129 4.230 -0.101 1
1 438 . 4 1 1 A 41 41 ALA C C 41 177.718 178.378 -0.660 1
1 439 . 4 1 1 A 41 41 ALA CA C 41 53.436 52.567 0.869 1
1 440 . 4 1 1 A 41 41 ALA CB C 41 19.183 19.099 0.084 1
1 441 . 4 1 1 A 41 41 ALA N N 41 124.607 123.028 1.579 1
1 442 . 4 1 1 A 42 42 ASP H H 42 8.310 8.731 -0.421 1
1 443 . 4 1 1 A 42 42 ASP HA H 42 4.588 4.344 0.244 1
1 446 . 4 1 1 A 42 42 ASP C C 42 176.546 176.470 0.076 1
1 447 . 4 1 1 A 42 42 ASP CA C 42 54.599 56.977 -2.378 1
1 448 . 4 1 1 A 42 42 ASP CB C 42 41.146 40.199 0.947 1
1 449 . 4 1 1 A 42 42 ASP N N 42 118.030 124.411 -6.381 1
1 450 . 4 1 1 A 43 43 ILE H H 43 8.000 7.838 0.162 1
1 451 . 4 1 1 A 43 43 ILE HA H 43 4.130 3.856 0.274 1
1 461 . 4 1 1 A 43 43 ILE C C 43 176.901 176.912 -0.011 1
1 462 . 4 1 1 A 43 43 ILE CA C 43 61.740 62.434 -0.694 1
1 463 . 4 1 1 A 43 43 ILE CB C 43 38.491 37.768 0.723 1
1 467 . 4 1 1 A 43 43 ILE N N 43 119.301 119.743 -0.442 1
1 468 . 4 1 1 A 44 44 GLY H H 44 8.448 8.667 -0.219 1
1 469 . 4 1 1 A 44 44 GLY HA2 H 44 3.939 3.944 -0.005 1
1 470 . 4 1 1 A 44 44 GLY HA3 H 44 3.939 3.945 -0.006 1
1 471 . 4 1 1 A 44 44 GLY C C 44 174.393 174.576 -0.183 1
1 472 . 4 1 1 A 44 44 GLY CA C 44 45.501 46.806 -1.305 1
1 473 . 4 1 1 A 44 44 GLY N N 44 111.333 117.530 -6.197 1
1 474 . 4 1 1 A 45 45 SER H H 45 8.061 8.125 -0.064 1
1 475 . 4 1 1 A 45 45 SER HA H 45 4.416 4.605 -0.189 1
1 478 . 4 1 1 A 45 45 SER C C 45 174.480 174.723 -0.243 1
1 479 . 4 1 1 A 45 45 SER CA C 45 58.478 57.062 1.416 1
1 480 . 4 1 1 A 45 45 SER CB C 45 63.943 61.767 2.176 1
1 481 . 4 1 1 A 45 45 SER N N 45 115.551 116.614 -1.063 1
1 482 . 4 1 1 A 46 46 ASN H H 46 8.547 8.188 0.359 1
1 483 . 4 1 1 A 46 46 ASN HA H 46 4.725 4.989 -0.264 1
1 488 . 4 1 1 A 46 46 ASN C C 46 175.031 173.956 1.075 1
1 489 . 4 1 1 A 46 46 ASN CA C 46 53.277 52.833 0.444 1
1 490 . 4 1 1 A 46 46 ASN CB C 46 38.798 39.037 -0.239 1
1 491 . 4 1 1 A 46 46 ASN N N 46 120.698 126.073 -5.375 1
1 493 . 4 1 1 A 47 47 ALA H H 47 8.239 7.514 0.725 1
1 494 . 4 1 1 A 47 47 ALA HA H 47 4.283 4.709 -0.426 1
1 498 . 4 1 1 A 47 47 ALA C C 47 177.240 175.215 2.025 1
1 499 . 4 1 1 A 47 47 ALA CA C 47 52.731 50.414 2.317 1
1 500 . 4 1 1 A 47 47 ALA CB C 47 19.594 22.225 -2.631 1
1 501 . 4 1 1 A 47 47 ALA N N 47 124.093 122.069 2.024 1
1 502 . 4 1 1 A 48 48 GLU H H 48 8.376 8.257 0.119 1
1 503 . 4 1 1 A 48 48 GLU HA H 48 4.264 4.827 -0.563 1
1 508 . 4 1 1 A 48 48 GLU C C 48 175.702 175.414 0.288 1
1 509 . 4 1 1 A 48 48 GLU CA C 48 55.992 55.192 0.800 1
1 510 . 4 1 1 A 48 48 GLU CB C 48 30.210 30.606 -0.396 1
1 512 . 4 1 1 A 48 48 GLU N N 48 119.750 117.440 2.310 1
1 513 . 4 1 1 A 49 49 ILE H H 49 7.806 8.420 -0.614 1
1 514 . 4 1 1 A 49 49 ILE HA H 49 3.919 4.315 -0.396 1
1 524 . 4 1 1 A 49 49 ILE C C 49 175.894 175.142 0.752 1
1 525 . 4 1 1 A 49 49 ILE CA C 49 60.559 61.704 -1.145 1
1 526 . 4 1 1 A 49 49 ILE CB C 49 37.860 37.378 0.482 1
1 530 . 4 1 1 A 49 49 ILE N N 49 122.772 124.863 -2.091 1
1 531 . 4 1 1 A 50 50 ARG H H 50 8.247 8.376 -0.129 1
1 532 . 4 1 1 A 50 50 ARG HA H 50 4.999 5.040 -0.041 1
1 539 . 4 1 1 A 50 50 ARG C C 50 174.603 173.876 0.727 1
1 540 . 4 1 1 A 50 50 ARG CA C 50 53.189 54.135 -0.946 1
1 541 . 4 1 1 A 50 50 ARG CB C 50 33.152 34.082 -0.930 1
1 544 . 4 1 1 A 50 50 ARG N N 50 126.912 128.197 -1.285 1
1 545 . 4 1 1 A 51 51 TYR H H 51 9.041 8.883 0.158 1
1 546 . 4 1 1 A 51 51 TYR HA H 51 5.395 5.665 -0.270 1
1 553 . 4 1 1 A 51 51 TYR C C 51 175.555 175.682 -0.127 1
1 554 . 4 1 1 A 51 51 TYR CA C 51 56.909 56.692 0.217 1
1 555 . 4 1 1 A 51 51 TYR CB C 51 40.116 40.433 -0.317 1
1 560 . 4 1 1 A 51 51 TYR N N 51 121.627 124.735 -3.108 1
1 561 . 4 1 1 A 52 52 ILE H H 52 8.850 8.863 -0.013 1
1 562 . 4 1 1 A 52 52 ILE HA H 52 4.576 4.918 -0.342 1
1 572 . 4 1 1 A 52 52 ILE C C 52 175.371 175.475 -0.104 1
1 573 . 4 1 1 A 52 52 ILE CA C 52 59.624 59.382 0.242 1
1 574 . 4 1 1 A 52 52 ILE CB C 52 42.895 41.334 1.561 1
1 578 . 4 1 1 A 52 52 ILE N N 52 117.697 119.161 -1.464 1
1 579 . 4 1 1 A 53 53 PHE H H 53 8.748 8.822 -0.074 1
1 580 . 4 1 1 A 53 53 PHE HA H 53 5.132 4.582 0.550 1
1 588 . 4 1 1 A 53 53 PHE C C 53 178.146 176.487 1.659 1
1 589 . 4 1 1 A 53 53 PHE CA C 53 57.667 58.493 -0.826 1
1 590 . 4 1 1 A 53 53 PHE CB C 53 39.614 39.620 -0.006 1
1 596 . 4 1 1 A 53 53 PHE N N 53 121.433 122.598 -1.165 1
1 597 . 4 1 1 A 54 54 GLY H H 54 8.538 8.719 -0.181 1
1 598 . 4 1 1 A 54 54 GLY HA2 H 54 4.074 4.097 -0.023 1
1 599 . 4 1 1 A 54 54 GLY HA3 H 54 3.840 4.099 -0.259 1
1 600 . 4 1 1 A 54 54 GLY C C 54 174.530 173.049 1.481 1
1 601 . 4 1 1 A 54 54 GLY CA C 54 44.884 44.725 0.159 1
1 602 . 4 1 1 A 54 54 GLY N N 54 106.444 110.759 -4.315 1
1 603 . 4 1 1 A 55 55 ALA H H 55 8.594 8.428 0.166 1
1 604 . 4 1 1 A 55 55 ALA HA H 55 4.172 4.518 -0.346 1
1 608 . 4 1 1 A 55 55 ALA C C 55 178.718 177.475 1.243 1
1 609 . 4 1 1 A 55 55 ALA CA C 55 54.423 51.272 3.151 1
1 610 . 4 1 1 A 55 55 ALA CB C 55 19.059 20.277 -1.218 1
1 611 . 4 1 1 A 55 55 ALA N N 55 123.470 121.425 2.045 1
1 612 . 4 1 1 A 56 56 GLN H H 56 8.727 8.743 -0.016 1
1 613 . 4 1 1 A 56 56 GLN HA H 56 4.367 3.741 0.626 1
1 620 . 4 1 1 A 56 56 GLN C C 56 176.134 174.906 1.228 1
1 621 . 4 1 1 A 56 56 GLN CA C 56 55.660 56.690 -1.030 1
1 622 . 4 1 1 A 56 56 GLN CB C 56 28.152 26.930 1.222 1
1 624 . 4 1 1 A 56 56 GLN N N 56 114.221 115.604 -1.383 1
1 626 . 4 1 1 A 57 57 VAL H H 57 7.204 7.854 -0.650 1
1 627 . 4 1 1 A 57 57 VAL HA H 57 3.889 4.068 -0.179 1
1 635 . 4 1 1 A 57 57 VAL C C 57 175.371 175.377 -0.006 1
1 636 . 4 1 1 A 57 57 VAL CA C 57 63.908 61.797 2.111 1
1 637 . 4 1 1 A 57 57 VAL CB C 57 31.557 32.294 -0.737 1
1 640 . 4 1 1 A 57 57 VAL N N 57 121.341 119.951 1.390 1
1 641 . 4 1 1 A 58 58 ALA H H 58 8.920 8.467 0.453 1
1 642 . 4 1 1 A 58 58 ALA HA H 58 4.547 4.273 0.274 1
1 646 . 4 1 1 A 58 58 ALA C C 58 177.064 177.742 -0.678 1
1 647 . 4 1 1 A 58 58 ALA CA C 58 51.173 50.857 0.316 1
1 648 . 4 1 1 A 58 58 ALA CB C 58 17.842 18.239 -0.397 1
1 649 . 4 1 1 A 58 58 ALA N N 58 132.726 131.080 1.646 1
1 650 . 4 1 1 A 59 59 PRO HA H 59 4.101 4.272 -0.171 1
1 657 . 4 1 1 A 59 59 PRO C C 59 179.482 178.686 0.796 1
1 658 . 4 1 1 A 59 59 PRO CA C 59 66.060 65.730 0.330 1
1 659 . 4 1 1 A 59 59 PRO CB C 59 31.951 31.724 0.227 1
1 662 . 4 1 1 A 60 60 ALA H H 60 8.706 8.226 0.480 1
1 663 . 4 1 1 A 60 60 ALA HA H 60 4.057 3.997 0.060 1
1 667 . 4 1 1 A 60 60 ALA C C 60 179.627 180.243 -0.616 1
1 668 . 4 1 1 A 60 60 ALA CA C 60 55.305 55.437 -0.132 1
1 669 . 4 1 1 A 60 60 ALA CB C 60 18.737 18.698 0.039 1
1 670 . 4 1 1 A 60 60 ALA N N 60 117.882 118.782 -0.900 1
1 671 . 4 1 1 A 61 61 THR H H 61 7.312 8.132 -0.820 1
1 672 . 4 1 1 A 61 61 THR HA H 61 4.153 4.213 -0.060 1
1 677 . 4 1 1 A 61 61 THR C C 61 175.824 175.426 0.398 1
1 678 . 4 1 1 A 61 61 THR CA C 61 66.412 65.147 1.265 1
1 679 . 4 1 1 A 61 61 THR CB C 61 68.787 68.565 0.222 1
1 681 . 4 1 1 A 61 61 THR N N 61 114.483 113.217 1.266 1
1 682 . 4 1 1 A 62 62 LYS H H 62 7.556 8.104 -0.548 1
1 683 . 4 1 1 A 62 62 LYS HA H 62 3.943 4.225 -0.282 1
1 692 . 4 1 1 A 62 62 LYS C C 62 176.884 178.453 -1.569 1
1 693 . 4 1 1 A 62 62 LYS CA C 62 59.095 56.500 2.595 1
1 694 . 4 1 1 A 62 62 LYS CB C 62 32.204 32.599 -0.395 1
1 698 . 4 1 1 A 62 62 LYS N N 62 118.994 118.880 0.114 1
1 699 . 4 1 1 A 63 63 ARG H H 63 7.474 8.396 -0.922 1
1 700 . 4 1 1 A 63 63 ARG HA H 63 4.034 4.082 -0.048 1
1 707 . 4 1 1 A 63 63 ARG C C 63 177.574 178.223 -0.649 1
1 708 . 4 1 1 A 63 63 ARG CA C 63 58.143 58.681 -0.538 1
1 709 . 4 1 1 A 63 63 ARG CB C 63 30.755 29.918 0.837 1
1 712 . 4 1 1 A 63 63 ARG N N 63 114.251 118.464 -4.213 1
1 713 . 4 1 1 A 64 64 LEU H H 64 6.991 7.598 -0.607 1
1 714 . 4 1 1 A 64 64 LEU HA H 64 3.904 4.042 -0.138 1
1 724 . 4 1 1 A 64 64 LEU C C 64 176.632 176.302 0.330 1
1 725 . 4 1 1 A 64 64 LEU CA C 64 56.503 56.059 0.444 1
1 726 . 4 1 1 A 64 64 LEU CB C 64 42.929 43.239 -0.310 1
1 730 . 4 1 1 A 64 64 LEU N N 64 116.109 118.004 -1.895 1
1 731 . 4 1 1 A 65 65 PHE H H 65 7.673 7.895 -0.222 1
1 732 . 4 1 1 A 65 65 PHE HA H 65 5.386 5.227 0.159 1
1 740 . 4 1 1 A 65 65 PHE C C 65 173.067 174.255 -1.188 1
1 741 . 4 1 1 A 65 65 PHE CA C 65 56.521 56.241 0.280 1
1 742 . 4 1 1 A 65 65 PHE CB C 65 41.270 42.114 -0.844 1
1 748 . 4 1 1 A 65 65 PHE N N 65 116.182 115.466 0.716 1
1 749 . 4 1 1 A 66 66 ALA H H 66 8.914 9.267 -0.353 1
1 750 . 4 1 1 A 66 66 ALA HA H 66 4.748 5.281 -0.533 1
1 754 . 4 1 1 A 66 66 ALA C C 66 175.223 175.478 -0.255 1
1 755 . 4 1 1 A 66 66 ALA CA C 66 50.050 50.429 -0.379 1
1 756 . 4 1 1 A 66 66 ALA CB C 66 21.161 21.462 -0.301 1
1 757 . 4 1 1 A 66 66 ALA N N 66 122.870 125.566 -2.696 1
1 758 . 4 1 1 A 67 67 LEU H H 67 8.498 9.144 -0.646 1
1 759 . 4 1 1 A 67 67 LEU HA H 67 4.713 4.975 -0.262 1
1 769 . 4 1 1 A 67 67 LEU C C 67 175.146 174.495 0.651 1
1 770 . 4 1 1 A 67 67 LEU CA C 67 52.518 53.773 -1.255 1
1 771 . 4 1 1 A 67 67 LEU CB C 67 45.308 44.325 0.983 1
1 775 . 4 1 1 A 67 67 LEU N N 67 122.208 126.471 -4.263 1
1 776 . 4 1 1 A 68 68 ASN H H 68 8.357 8.567 -0.210 1
1 777 . 4 1 1 A 68 68 ASN HA H 68 4.679 5.158 -0.479 1
1 782 . 4 1 1 A 68 68 ASN C C 68 176.228 174.953 1.275 1
1 783 . 4 1 1 A 68 68 ASN CA C 68 53.524 51.744 1.780 1
1 784 . 4 1 1 A 68 68 ASN CB C 68 39.580 40.572 -0.992 1
1 785 . 4 1 1 A 68 68 ASN N N 68 126.940 123.772 3.168 1
1 787 . 4 1 1 A 69 69 ASN H H 69 8.861 9.052 -0.191 1
1 788 . 4 1 1 A 69 69 ASN HA H 69 5.137 5.099 0.038 1
1 793 . 4 1 1 A 69 69 ASN C C 69 175.631 176.404 -0.773 1
1 794 . 4 1 1 A 69 69 ASN CA C 69 56.009 53.796 2.213 1
1 795 . 4 1 1 A 69 69 ASN CB C 69 40.314 39.044 1.270 1
1 796 . 4 1 1 A 69 69 ASN N N 69 124.980 121.751 3.229 1
1 798 . 4 1 1 A 70 70 THR H H 70 8.635 7.864 0.771 1
1 799 . 4 1 1 A 70 70 THR HA H 70 4.815 4.479 0.336 1
1 804 . 4 1 1 A 70 70 THR C C 70 176.223 175.824 0.399 1
1 805 . 4 1 1 A 70 70 THR CA C 70 63.944 63.008 0.936 1
1 806 . 4 1 1 A 70 70 THR CB C 70 69.727 69.867 -0.140 1
1 808 . 4 1 1 A 70 70 THR N N 70 110.394 110.449 -0.055 1
1 809 . 4 1 1 A 71 71 THR H H 71 8.069 7.905 0.164 1
1 810 . 4 1 1 A 71 71 THR HA H 71 4.566 4.564 0.002 1
1 815 . 4 1 1 A 71 71 THR C C 71 176.213 175.909 0.304 1
1 816 . 4 1 1 A 71 71 THR CA C 71 61.683 62.131 -0.448 1
1 817 . 4 1 1 A 71 71 THR CB C 71 70.832 71.605 -0.773 1
1 819 . 4 1 1 A 71 71 THR N N 71 110.507 110.486 0.021 1
1 820 . 4 1 1 A 72 72 GLY H H 72 7.990 8.087 -0.097 1
1 821 . 4 1 1 A 72 72 GLY HA2 H 72 3.186 3.235 -0.049 1
1 822 . 4 1 1 A 72 72 GLY HA3 H 72 2.516 3.571 -1.055 1
1 823 . 4 1 1 A 72 72 GLY C C 72 172.988 174.187 -1.199 1
1 824 . 4 1 1 A 72 72 GLY CA C 72 45.149 46.102 -0.953 1
1 825 . 4 1 1 A 72 72 GLY N N 72 110.788 112.287 -1.499 1
1 826 . 4 1 1 A 73 73 LEU H H 73 7.138 7.621 -0.483 1
1 827 . 4 1 1 A 73 73 LEU HA H 73 4.414 4.692 -0.278 1
1 837 . 4 1 1 A 73 73 LEU C C 73 176.836 174.462 2.374 1
1 838 . 4 1 1 A 73 73 LEU CA C 73 55.252 53.431 1.821 1
1 839 . 4 1 1 A 73 73 LEU CB C 73 43.574 44.928 -1.354 1
1 843 . 4 1 1 A 73 73 LEU N N 73 119.222 121.030 -1.808 1
1 844 . 4 1 1 A 74 74 ILE H H 74 8.925 9.036 -0.111 1
1 845 . 4 1 1 A 74 74 ILE HA H 74 5.555 4.848 0.707 1
1 855 . 4 1 1 A 74 74 ILE C C 74 175.978 175.468 0.510 1
1 856 . 4 1 1 A 74 74 ILE CA C 74 60.100 60.194 -0.094 1
1 857 . 4 1 1 A 74 74 ILE CB C 74 38.550 38.762 -0.212 1
1 861 . 4 1 1 A 74 74 ILE N N 74 129.871 126.862 3.009 1
1 862 . 4 1 1 A 75 75 THR H H 75 9.161 8.883 0.278 1
1 863 . 4 1 1 A 75 75 THR HA H 75 5.375 5.420 -0.045 1
1 868 . 4 1 1 A 75 75 THR C C 75 174.798 173.638 1.160 1
1 869 . 4 1 1 A 75 75 THR CA C 75 58.796 59.815 -1.019 1
1 870 . 4 1 1 A 75 75 THR CB C 75 72.978 71.486 1.492 1
1 872 . 4 1 1 A 75 75 THR N N 75 117.522 118.135 -0.613 1
1 873 . 4 1 1 A 76 76 VAL H H 76 8.327 8.546 -0.219 1
1 874 . 4 1 1 A 76 76 VAL HA H 76 3.973 3.999 -0.026 1
1 882 . 4 1 1 A 76 76 VAL C C 76 176.495 175.786 0.709 1
1 883 . 4 1 1 A 76 76 VAL CA C 76 64.085 62.831 1.254 1
1 884 . 4 1 1 A 76 76 VAL CB C 76 32.863 32.095 0.768 1
1 887 . 4 1 1 A 76 76 VAL N N 76 120.876 121.767 -0.891 1
1 888 . 4 1 1 A 77 77 GLN H H 77 9.525 9.193 0.332 1
1 889 . 4 1 1 A 77 77 GLN HA H 77 4.702 4.430 0.272 1
1 896 . 4 1 1 A 77 77 GLN C C 77 173.838 174.642 -0.804 1
1 897 . 4 1 1 A 77 77 GLN CA C 77 55.728 56.842 -1.114 1
1 898 . 4 1 1 A 77 77 GLN CB C 77 30.762 30.847 -0.085 1
1 900 . 4 1 1 A 77 77 GLN N N 77 129.825 127.168 2.657 1
1 902 . 4 1 1 A 78 78 ARG H H 78 7.621 7.131 0.490 1
1 903 . 4 1 1 A 78 78 ARG HA H 78 4.347 4.676 -0.329 1
1 910 . 4 1 1 A 78 78 ARG C C 78 172.304 175.190 -2.886 1
1 911 . 4 1 1 A 78 78 ARG CA C 78 54.634 54.170 0.464 1
1 912 . 4 1 1 A 78 78 ARG CB C 78 34.685 34.480 0.205 1
1 915 . 4 1 1 A 78 78 ARG N N 78 120.595 117.534 3.061 1
1 916 . 4 1 1 A 79 79 SER H H 79 7.958 8.358 -0.400 1
1 917 . 4 1 1 A 79 79 SER HA H 79 4.030 4.285 -0.255 1
1 920 . 4 1 1 A 79 79 SER C C 79 174.311 174.358 -0.047 1
1 921 . 4 1 1 A 79 79 SER CA C 79 59.889 59.703 0.186 1
1 922 . 4 1 1 A 79 79 SER CB C 79 63.548 63.813 -0.265 1
1 923 . 4 1 1 A 79 79 SER N N 79 112.565 118.269 -5.704 1
1 924 . 4 1 1 A 80 80 LEU H H 80 8.715 8.185 0.530 1
1 925 . 4 1 1 A 80 80 LEU HA H 80 4.114 4.889 -0.775 1
1 935 . 4 1 1 A 80 80 LEU C C 80 176.057 175.938 0.119 1
1 936 . 4 1 1 A 80 80 LEU CA C 80 55.091 53.196 1.895 1
1 937 . 4 1 1 A 80 80 LEU CB C 80 42.341 44.749 -2.408 1
1 941 . 4 1 1 A 80 80 LEU N N 80 123.070 123.908 -0.838 1
1 942 . 4 1 1 A 81 81 ASP H H 81 7.298 8.744 -1.446 1
1 943 . 4 1 1 A 81 81 ASP HA H 81 4.725 5.314 -0.589 1
1 946 . 4 1 1 A 81 81 ASP C C 81 175.939 175.863 0.076 1
1 947 . 4 1 1 A 81 81 ASP CA C 81 53.664 52.915 0.749 1
1 948 . 4 1 1 A 81 81 ASP CB C 81 42.947 43.016 -0.069 1
1 949 . 4 1 1 A 81 81 ASP N N 81 115.229 120.996 -5.767 1
1 950 . 4 1 1 A 82 82 ARG H H 82 9.289 8.775 0.514 1
1 951 . 4 1 1 A 82 82 ARG HA H 82 4.416 4.447 -0.031 1
1 959 . 4 1 1 A 82 82 ARG C C 82 176.406 178.142 -1.736 1
1 960 . 4 1 1 A 82 82 ARG CA C 82 56.397 59.128 -2.731 1
1 961 . 4 1 1 A 82 82 ARG CB C 82 30.638 29.941 0.697 1
1 964 . 4 1 1 A 82 82 ARG N N 82 123.174 127.138 -3.964 1
1 966 . 4 1 1 A 83 83 GLU H H 83 8.468 8.627 -0.159 1
1 967 . 4 1 1 A 83 83 GLU HA H 83 3.982 4.093 -0.111 1
1 972 . 4 1 1 A 83 83 GLU C C 83 177.740 178.075 -0.335 1
1 973 . 4 1 1 A 83 83 GLU CA C 83 58.425 58.625 -0.200 1
1 974 . 4 1 1 A 83 83 GLU CB C 83 29.701 28.416 1.285 1
1 976 . 4 1 1 A 83 83 GLU N N 83 119.549 116.856 2.693 1
1 977 . 4 1 1 A 84 84 GLU H H 84 8.033 8.111 -0.078 1
1 978 . 4 1 1 A 84 84 GLU HA H 84 4.206 4.363 -0.157 1
1 983 . 4 1 1 A 84 84 GLU C C 84 176.837 175.445 1.392 1
1 984 . 4 1 1 A 84 84 GLU CA C 84 58.056 58.015 0.041 1
1 985 . 4 1 1 A 84 84 GLU CB C 84 30.432 31.130 -0.698 1
1 987 . 4 1 1 A 84 84 GLU N N 84 118.333 119.026 -0.693 1
1 988 . 4 1 1 A 85 85 THR H H 85 7.651 7.579 0.072 1
1 989 . 4 1 1 A 85 85 THR HA H 85 4.307 4.720 -0.413 1
1 994 . 4 1 1 A 85 85 THR C C 85 171.568 173.292 -1.724 1
1 995 . 4 1 1 A 85 85 THR CA C 85 61.387 59.493 1.894 1
1 996 . 4 1 1 A 85 85 THR CB C 85 69.963 70.577 -0.614 1
1 998 . 4 1 1 A 85 85 THR N N 85 112.444 112.433 0.011 1
1 999 . 4 1 1 A 86 86 ALA H H 86 8.639 8.447 0.192 1
1 1000 . 4 1 1 A 86 86 ALA HA H 86 4.603 4.610 -0.007 1
1 1004 . 4 1 1 A 86 86 ALA C C 86 175.560 176.767 -1.207 1
1 1005 . 4 1 1 A 86 86 ALA CA C 86 52.156 52.680 -0.524 1
1 1006 . 4 1 1 A 86 86 ALA CB C 86 20.378 20.818 -0.440 1
1 1007 . 4 1 1 A 86 86 ALA N N 86 127.705 127.446 0.259 1
1 1008 . 4 1 1 A 87 87 ILE H H 87 7.663 7.612 0.051 1
1 1009 . 4 1 1 A 87 87 ILE HA H 87 4.828 4.678 0.150 1
1 1019 . 4 1 1 A 87 87 ILE C C 87 174.537 174.725 -0.188 1
1 1020 . 4 1 1 A 87 87 ILE CA C 87 60.329 60.330 -0.001 1
1 1021 . 4 1 1 A 87 87 ILE CB C 87 41.090 38.903 2.187 1
1 1025 . 4 1 1 A 87 87 ILE N N 87 118.712 117.684 1.028 1
1 1026 . 4 1 1 A 88 88 HIS H H 88 9.098 8.998 0.100 1
1 1027 . 4 1 1 A 88 88 HIS HA H 88 4.576 5.094 -0.518 1
1 1032 . 4 1 1 A 88 88 HIS C C 88 174.354 174.016 0.338 1
1 1033 . 4 1 1 A 88 88 HIS CA C 88 54.740 53.979 0.761 1
1 1034 . 4 1 1 A 88 88 HIS CB C 88 33.955 31.989 1.966 1
1 1037 . 4 1 1 A 88 88 HIS N N 88 126.285 125.547 0.738 1
1 1038 . 4 1 1 A 89 89 LYS H H 89 8.957 8.939 0.018 1
1 1039 . 4 1 1 A 89 89 LYS HA H 89 4.873 4.670 0.203 1
1 1048 . 4 1 1 A 89 89 LYS C C 89 175.906 175.556 0.350 1
1 1049 . 4 1 1 A 89 89 LYS CA C 89 55.269 55.341 -0.072 1
1 1050 . 4 1 1 A 89 89 LYS CB C 89 32.945 33.343 -0.398 1
1 1054 . 4 1 1 A 89 89 LYS N N 89 124.332 124.259 0.073 1
1 1055 . 4 1 1 A 90 90 VAL H H 90 9.174 8.645 0.529 1
1 1056 . 4 1 1 A 90 90 VAL HA H 90 4.227 5.040 -0.813 1
1 1064 . 4 1 1 A 90 90 VAL C C 90 174.168 174.589 -0.421 1
1 1065 . 4 1 1 A 90 90 VAL CA C 90 61.369 61.044 0.325 1
1 1066 . 4 1 1 A 90 90 VAL CB C 90 34.082 34.350 -0.268 1
1 1069 . 4 1 1 A 90 90 VAL N N 90 124.319 125.273 -0.954 1
1 1070 . 4 1 1 A 91 91 THR H H 91 6.697 8.854 -2.157 1
1 1071 . 4 1 1 A 91 91 THR HA H 91 5.163 5.090 0.073 1
1 1076 . 4 1 1 A 91 91 THR C C 91 173.812 174.033 -0.221 1
1 1077 . 4 1 1 A 91 91 THR CA C 91 61.935 61.872 0.063 1
1 1078 . 4 1 1 A 91 91 THR CB C 91 70.412 70.980 -0.568 1
1 1080 . 4 1 1 A 91 91 THR N N 91 122.637 124.191 -1.554 1
1 1081 . 4 1 1 A 92 92 VAL H H 92 9.292 8.806 0.486 1
1 1082 . 4 1 1 A 92 92 VAL HA H 92 4.736 4.697 0.039 1
1 1090 . 4 1 1 A 92 92 VAL C C 92 173.160 175.108 -1.948 1
1 1091 . 4 1 1 A 92 92 VAL CA C 92 60.982 60.924 0.058 1
1 1092 . 4 1 1 A 92 92 VAL CB C 92 35.130 34.289 0.841 1
1 1095 . 4 1 1 A 92 92 VAL N N 92 128.265 126.645 1.620 1
1 1096 . 4 1 1 A 93 93 LEU H H 93 9.495 8.714 0.781 1
1 1097 . 4 1 1 A 93 93 LEU HA H 93 5.628 5.689 -0.061 1
1 1107 . 4 1 1 A 93 93 LEU C C 93 176.274 175.308 0.966 1
1 1108 . 4 1 1 A 93 93 LEU CA C 93 52.773 53.542 -0.769 1
1 1109 . 4 1 1 A 93 93 LEU CB C 93 43.454 44.572 -1.118 1
1 1113 . 4 1 1 A 93 93 LEU N N 93 126.350 126.821 -0.471 1
1 1114 . 4 1 1 A 94 94 ALA H H 94 8.688 8.668 0.020 1
1 1115 . 4 1 1 A 94 94 ALA HA H 94 4.986 5.542 -0.556 1
1 1119 . 4 1 1 A 94 94 ALA C C 94 175.787 176.143 -0.356 1
1 1120 . 4 1 1 A 94 94 ALA CA C 94 49.610 50.142 -0.532 1
1 1121 . 4 1 1 A 94 94 ALA CB C 94 21.463 20.863 0.600 1
1 1122 . 4 1 1 A 94 94 ALA N N 94 123.429 128.125 -4.696 1
1 1123 . 4 1 1 A 95 95 SER H H 95 8.401 8.472 -0.071 1
1 1124 . 4 1 1 A 95 95 SER HA H 95 4.828 5.016 -0.188 1
1 1127 . 4 1 1 A 95 95 SER C C 95 174.327 173.654 0.673 1
1 1128 . 4 1 1 A 95 95 SER CA C 95 56.239 55.623 0.616 1
1 1129 . 4 1 1 A 95 95 SER CB C 95 65.561 66.076 -0.515 1
1 1130 . 4 1 1 A 95 95 SER N N 95 114.418 116.119 -1.701 1
1 1131 . 4 1 1 A 96 96 ASP H H 96 8.690 9.013 -0.323 1
1 1132 . 4 1 1 A 96 96 ASP HA H 96 4.908 4.792 0.116 1
1 1135 . 4 1 1 A 96 96 ASP C C 96 177.096 176.240 0.856 1
1 1136 . 4 1 1 A 96 96 ASP CA C 96 52.818 55.026 -2.208 1
1 1137 . 4 1 1 A 96 96 ASP CB C 96 41.253 42.131 -0.878 1
1 1138 . 4 1 1 A 96 96 ASP N N 96 125.624 121.766 3.858 1
1 1139 . 4 1 1 A 97 97 GLY H H 97 8.524 7.491 1.033 1
1 1140 . 4 1 1 A 97 97 GLY HA2 H 97 4.320 3.931 0.389 1
1 1141 . 4 1 1 A 97 97 GLY HA3 H 97 3.620 3.932 -0.312 1
1 1142 . 4 1 1 A 97 97 GLY C C 97 174.620 174.355 0.265 1
1 1143 . 4 1 1 A 97 97 GLY CA C 97 45.422 45.560 -0.138 1
1 1144 . 4 1 1 A 97 97 GLY N N 97 109.283 104.740 4.543 1
1 1145 . 4 1 1 A 98 98 SER H H 98 8.575 8.349 0.226 1
1 1146 . 4 1 1 A 98 98 SER HA H 98 4.607 4.519 0.088 1
1 1149 . 4 1 1 A 98 98 SER C C 98 174.478 172.396 2.082 1
1 1150 . 4 1 1 A 98 98 SER CA C 98 59.095 56.904 2.191 1
1 1151 . 4 1 1 A 98 98 SER CB C 98 64.800 63.512 1.288 1
1 1152 . 4 1 1 A 98 98 SER N N 98 116.640 115.599 1.041 1
1 1153 . 4 1 1 A 99 99 SER H H 99 8.945 7.783 1.162 1
1 1154 . 4 1 1 A 99 99 SER HA H 99 4.530 4.834 -0.304 1
1 1157 . 4 1 1 A 99 99 SER C C 99 174.491 173.414 1.077 1
1 1158 . 4 1 1 A 99 99 SER CA C 99 58.460 57.905 0.555 1
1 1159 . 4 1 1 A 99 99 SER CB C 99 64.146 67.116 -2.970 1
1 1160 . 4 1 1 A 99 99 SER N N 99 117.676 115.388 2.288 1
1 1161 . 4 1 1 A 100 100 THR H H 100 8.411 8.509 -0.098 1
1 1162 . 4 1 1 A 100 100 THR HA H 100 4.490 4.467 0.023 1
1 1167 . 4 1 1 A 100 100 THR C C 100 172.766 173.845 -1.079 1
1 1168 . 4 1 1 A 100 100 THR CA C 100 60.629 60.549 0.080 1
1 1169 . 4 1 1 A 100 100 THR CB C 100 69.778 68.769 1.009 1
1 1171 . 4 1 1 A 100 100 THR N N 100 118.401 116.121 2.280 1
1 1172 . 4 1 1 A 101 101 PRO HA H 101 4.631 4.793 -0.162 1
1 1179 . 4 1 1 A 101 101 PRO C C 101 177.227 176.139 1.088 1
1 1180 . 4 1 1 A 101 101 PRO CA C 101 63.097 62.089 1.008 1
1 1181 . 4 1 1 A 101 101 PRO CB C 101 32.917 32.263 0.654 1
1 1184 . 4 1 1 A 102 102 ALA H H 102 8.497 7.945 0.552 1
1 1185 . 4 1 1 A 102 102 ALA HA H 102 4.619 4.592 0.027 1
1 1189 . 4 1 1 A 102 102 ALA C C 102 176.542 176.931 -0.389 1
1 1190 . 4 1 1 A 102 102 ALA CA C 102 51.390 52.103 -0.713 1
1 1191 . 4 1 1 A 102 102 ALA CB C 102 20.815 19.812 1.003 1
1 1192 . 4 1 1 A 102 102 ALA N N 102 124.487 123.629 0.858 1
1 1193 . 4 1 1 A 103 103 ARG H H 103 8.663 8.536 0.127 1
1 1194 . 4 1 1 A 103 103 ARG HA H 103 5.515 5.075 0.440 1
1 1201 . 4 1 1 A 103 103 ARG C C 103 174.539 175.339 -0.800 1
1 1202 . 4 1 1 A 103 103 ARG CA C 103 55.164 55.040 0.124 1
1 1203 . 4 1 1 A 103 103 ARG CB C 103 34.393 32.949 1.444 1
1 1206 . 4 1 1 A 103 103 ARG N N 103 119.596 121.707 -2.111 1
1 1207 . 4 1 1 A 104 104 ALA H H 104 9.027 8.380 0.647 1
1 1208 . 4 1 1 A 104 104 ALA HA H 104 4.782 5.055 -0.273 1
1 1212 . 4 1 1 A 104 104 ALA C C 104 176.276 175.399 0.877 1
1 1213 . 4 1 1 A 104 104 ALA CA C 104 50.297 51.084 -0.787 1
1 1214 . 4 1 1 A 104 104 ALA CB C 104 20.810 21.222 -0.412 1
1 1215 . 4 1 1 A 104 104 ALA N N 104 126.962 124.501 2.461 1
1 1216 . 4 1 1 A 105 105 THR H H 105 8.384 8.764 -0.380 1
1 1217 . 4 1 1 A 105 105 THR HA H 105 4.954 4.940 0.014 1
1 1222 . 4 1 1 A 105 105 THR C C 105 173.243 173.998 -0.755 1
1 1223 . 4 1 1 A 105 105 THR CA C 105 61.475 62.188 -0.713 1
1 1224 . 4 1 1 A 105 105 THR CB C 105 70.569 70.452 0.117 1
1 1226 . 4 1 1 A 105 105 THR N N 105 115.327 118.483 -3.156 1
1 1227 . 4 1 1 A 106 106 VAL H H 106 8.970 8.743 0.227 1
1 1228 . 4 1 1 A 106 106 VAL HA H 106 4.702 4.739 -0.037 1
1 1236 . 4 1 1 A 106 106 VAL C C 106 174.743 174.627 0.116 1
1 1237 . 4 1 1 A 106 106 VAL CA C 106 59.712 60.929 -1.217 1
1 1238 . 4 1 1 A 106 106 VAL CB C 106 34.327 34.510 -0.183 1
1 1241 . 4 1 1 A 106 106 VAL N N 106 126.226 126.705 -0.479 1
1 1242 . 4 1 1 A 107 107 THR H H 107 8.833 8.666 0.167 1
1 1243 . 4 1 1 A 107 107 THR HA H 107 4.862 4.632 0.230 1
1 1248 . 4 1 1 A 107 107 THR C C 107 172.970 173.997 -1.027 1
1 1249 . 4 1 1 A 107 107 THR CA C 107 62.322 62.194 0.128 1
1 1250 . 4 1 1 A 107 107 THR CB C 107 69.463 69.445 0.018 1
1 1252 . 4 1 1 A 107 107 THR N N 107 125.403 121.600 3.803 1
1 1253 . 4 1 1 A 108 108 ILE H H 108 9.234 8.763 0.471 1
1 1254 . 4 1 1 A 108 108 ILE HA H 108 4.178 4.809 -0.631 1
1 1264 . 4 1 1 A 108 108 ILE C C 108 174.087 174.498 -0.411 1
1 1265 . 4 1 1 A 108 108 ILE CA C 108 60.365 60.042 0.323 1
1 1266 . 4 1 1 A 108 108 ILE CB C 108 39.745 40.141 -0.396 1
1 1270 . 4 1 1 A 108 108 ILE N N 108 127.152 128.393 -1.241 1
1 1271 . 4 1 1 A 109 109 ASN H H 109 8.723 9.072 -0.349 1
1 1272 . 4 1 1 A 109 109 ASN HA H 109 5.147 5.427 -0.280 1
1 1277 . 4 1 1 A 109 109 ASN C C 109 173.592 174.243 -0.651 1
1 1278 . 4 1 1 A 109 109 ASN CA C 109 52.501 52.196 0.305 1
1 1279 . 4 1 1 A 109 109 ASN CB C 109 40.791 40.784 0.007 1
1 1280 . 4 1 1 A 109 109 ASN N N 109 126.866 126.630 0.236 1
1 1282 . 4 1 1 A 110 110 VAL H H 110 9.046 8.819 0.227 1
1 1283 . 4 1 1 A 110 110 VAL HA H 110 5.081 4.869 0.212 1
1 1291 . 4 1 1 A 110 110 VAL C C 110 176.921 176.247 0.674 1
1 1292 . 4 1 1 A 110 110 VAL CA C 110 61.634 61.613 0.021 1
1 1293 . 4 1 1 A 110 110 VAL CB C 110 31.809 32.608 -0.799 1
1 1296 . 4 1 1 A 110 110 VAL N N 110 126.070 124.776 1.294 1
1 1297 . 4 1 1 A 111 111 THR H H 111 9.197 8.382 0.815 1
1 1298 . 4 1 1 A 111 111 THR HA H 111 4.566 4.903 -0.337 1
1 1303 . 4 1 1 A 111 111 THR C C 111 174.087 174.291 -0.204 1
1 1304 . 4 1 1 A 111 111 THR CA C 111 61.145 60.163 0.982 1
1 1305 . 4 1 1 A 111 111 THR CB C 111 70.706 71.400 -0.694 1
1 1307 . 4 1 1 A 111 111 THR N N 111 121.425 119.030 2.395 1
1 1308 . 4 1 1 A 112 112 ASP H H 112 8.435 8.550 -0.115 1
1 1309 . 4 1 1 A 112 112 ASP HA H 112 4.656 4.680 -0.024 1
1 1312 . 4 1 1 A 112 112 ASP C C 112 176.745 175.542 1.203 1
1 1313 . 4 1 1 A 112 112 ASP CA C 112 54.158 53.379 0.779 1
1 1314 . 4 1 1 A 112 112 ASP CB C 112 41.575 41.817 -0.242 1
1 1315 . 4 1 1 A 112 112 ASP N N 112 119.566 122.196 -2.630 1
1 1316 . 4 1 1 A 113 113 VAL H H 113 8.629 8.500 0.129 1
1 1317 . 4 1 1 A 113 113 VAL HA H 113 4.078 4.724 -0.646 1
1 1325 . 4 1 1 A 113 113 VAL C C 113 175.247 174.050 1.197 1
1 1326 . 4 1 1 A 113 113 VAL CA C 113 62.533 59.587 2.946 1
1 1327 . 4 1 1 A 113 113 VAL CB C 113 32.534 35.288 -2.754 1
1 1330 . 4 1 1 A 113 113 VAL N N 113 119.356 118.115 1.241 1
1 4 . 5 1 1 A 2 2 SER H H 2 8.289 8.498 -0.209 1
1 5 . 5 1 1 A 2 2 SER HA H 2 4.530 5.322 -0.792 1
1 7 . 5 1 1 A 2 2 SER C C 2 174.868 172.594 2.274 1
1 8 . 5 1 1 A 2 2 SER CA C 2 58.284 57.559 0.725 1
1 9 . 5 1 1 A 2 2 SER CB C 2 63.769 66.589 -2.820 1
1 10 . 5 1 1 A 2 2 SER N N 2 115.842 116.054 -0.212 1
1 11 . 5 1 1 A 3 3 SER H H 3 8.490 8.649 -0.159 1
1 12 . 5 1 1 A 3 3 SER HA H 3 4.496 5.258 -0.762 1
1 14 . 5 1 1 A 3 3 SER C C 3 175.043 172.809 2.234 1
1 15 . 5 1 1 A 3 3 SER CA C 3 58.549 57.480 1.069 1
1 16 . 5 1 1 A 3 3 SER CB C 3 63.687 67.158 -3.471 1
1 17 . 5 1 1 A 3 3 SER N N 3 117.930 117.998 -0.068 1
1 18 . 5 1 1 A 4 4 GLY H H 4 8.482 8.474 0.008 1
1 19 . 5 1 1 A 4 4 GLY C C 4 174.344 171.947 2.397 1
1 20 . 5 1 1 A 4 4 GLY CA C 4 45.536 44.909 0.627 1
1 21 . 5 1 1 A 4 4 GLY N N 4 110.985 109.815 1.170 1
1 22 . 5 1 1 A 6 6 SER HA H 6 4.508 4.337 0.171 1
1 24 . 5 1 1 A 6 6 SER C C 6 175.026 174.994 0.032 1
1 25 . 5 1 1 A 6 6 SER CA C 6 58.584 59.603 -1.019 1
1 26 . 5 1 1 A 6 6 SER CB C 6 63.646 64.138 -0.492 1
1 27 . 5 1 1 A 7 7 GLY H H 7 8.419 8.619 -0.200 1
1 28 . 5 1 1 A 7 7 GLY HA2 H 7 3.993 3.960 0.033 1
1 29 . 5 1 1 A 7 7 GLY C C 7 173.995 172.843 1.152 1
1 30 . 5 1 1 A 7 7 GLY CA C 7 45.466 46.411 -0.945 1
1 31 . 5 1 1 A 7 7 GLY N N 7 110.615 110.962 -0.347 1
1 32 . 5 1 1 A 8 8 ASN H H 8 8.322 8.528 -0.206 1
1 33 . 5 1 1 A 8 8 ASN HA H 8 4.736 5.280 -0.544 1
1 38 . 5 1 1 A 8 8 ASN C C 8 174.907 173.715 1.192 1
1 39 . 5 1 1 A 8 8 ASN CA C 8 53.259 52.367 0.892 1
1 40 . 5 1 1 A 8 8 ASN CB C 8 39.127 40.605 -1.478 1
1 41 . 5 1 1 A 8 8 ASN N N 8 118.602 124.629 -6.027 1
1 43 . 5 1 1 A 9 9 ASP H H 9 8.370 8.735 -0.365 1
1 44 . 5 1 1 A 9 9 ASP HA H 9 4.594 5.332 -0.738 1
1 47 . 5 1 1 A 9 9 ASP C C 9 175.765 174.838 0.927 1
1 48 . 5 1 1 A 9 9 ASP CA C 9 54.440 53.029 1.411 1
1 49 . 5 1 1 A 9 9 ASP CB C 9 40.898 42.466 -1.568 1
1 50 . 5 1 1 A 9 9 ASP N N 9 120.504 124.810 -4.306 1
1 51 . 5 1 1 A 10 10 ASN H H 10 8.382 8.713 -0.331 1
1 52 . 5 1 1 A 10 10 ASN HA H 10 4.691 5.125 -0.434 1
1 57 . 5 1 1 A 10 10 ASN C C 10 174.383 173.201 1.182 1
1 58 . 5 1 1 A 10 10 ASN CA C 10 53.241 53.188 0.053 1
1 59 . 5 1 1 A 10 10 ASN CB C 10 38.674 43.422 -4.748 1
1 60 . 5 1 1 A 10 10 ASN N N 10 119.406 121.105 -1.699 1
1 62 . 5 1 1 A 11 11 ARG H H 11 7.942 8.640 -0.698 1
1 63 . 5 1 1 A 11 11 ARG HA H 11 4.684 4.811 -0.127 1
1 70 . 5 1 1 A 11 11 ARG C C 11 173.640 174.187 -0.547 1
1 71 . 5 1 1 A 11 11 ARG CA C 11 54.246 52.640 1.606 1
1 72 . 5 1 1 A 11 11 ARG CB C 11 30.337 30.842 -0.505 1
1 75 . 5 1 1 A 11 11 ARG N N 11 121.145 125.047 -3.902 1
1 76 . 5 1 1 A 12 12 PRO HA H 12 4.507 4.668 -0.161 1
1 83 . 5 1 1 A 12 12 PRO CA C 12 62.714 62.534 0.180 1
1 84 . 5 1 1 A 12 12 PRO CB C 12 31.942 30.690 1.252 1
1 87 . 5 1 1 A 13 13 VAL H H 13 8.252 8.057 0.195 1
1 88 . 5 1 1 A 13 13 VAL HA H 13 4.159 4.332 -0.173 1
1 96 . 5 1 1 A 13 13 VAL CA C 13 61.409 60.983 0.426 1
1 97 . 5 1 1 A 13 13 VAL CB C 13 34.858 32.490 2.368 1
1 100 . 5 1 1 A 13 13 VAL N N 13 118.395 117.841 0.554 1
1 101 . 5 1 1 A 14 14 PHE H H 14 8.725 8.856 -0.131 1
1 102 . 5 1 1 A 14 14 PHE HA H 14 4.781 4.445 0.336 1
1 110 . 5 1 1 A 14 14 PHE CA C 14 58.594 59.293 -0.699 1
1 111 . 5 1 1 A 14 14 PHE CB C 14 39.594 38.947 0.647 1
1 117 . 5 1 1 A 14 14 PHE N N 14 122.950 125.946 -2.996 1
1 118 . 5 1 1 A 15 15 LYS H H 15 8.885 8.829 0.056 1
1 119 . 5 1 1 A 15 15 LYS HA H 15 4.130 3.941 0.189 1
1 128 . 5 1 1 A 15 15 LYS C C 15 177.027 176.091 0.936 1
1 129 . 5 1 1 A 15 15 LYS CA C 15 58.478 59.837 -1.359 1
1 130 . 5 1 1 A 15 15 LYS CB C 15 32.748 32.277 0.471 1
1 134 . 5 1 1 A 15 15 LYS N N 15 123.863 126.194 -2.331 1
1 135 . 5 1 1 A 16 16 GLU H H 16 8.091 8.162 -0.071 1
1 136 . 5 1 1 A 16 16 GLU HA H 16 4.438 4.646 -0.208 1
1 141 . 5 1 1 A 16 16 GLU C C 16 175.947 176.566 -0.619 1
1 142 . 5 1 1 A 16 16 GLU CA C 16 56.045 54.969 1.076 1
1 143 . 5 1 1 A 16 16 GLU CB C 16 30.766 31.181 -0.415 1
1 145 . 5 1 1 A 16 16 GLU N N 16 117.026 117.732 -0.706 1
1 146 . 5 1 1 A 17 17 GLY H H 17 8.421 8.724 -0.303 1
1 147 . 5 1 1 A 17 17 GLY HA2 H 17 3.993 3.885 0.108 1
1 148 . 5 1 1 A 17 17 GLY HA3 H 17 3.913 3.917 -0.004 1
1 149 . 5 1 1 A 17 17 GLY C C 17 173.564 174.238 -0.674 1
1 150 . 5 1 1 A 17 17 GLY CA C 17 45.448 46.712 -1.264 1
1 151 . 5 1 1 A 17 17 GLY N N 17 109.577 112.423 -2.846 1
1 152 . 5 1 1 A 18 18 GLN H H 18 7.858 8.036 -0.178 1
1 153 . 5 1 1 A 18 18 GLN HA H 18 5.065 4.732 0.333 1
1 160 . 5 1 1 A 18 18 GLN C C 18 174.596 174.973 -0.377 1
1 161 . 5 1 1 A 18 18 GLN CA C 18 55.110 55.483 -0.373 1
1 162 . 5 1 1 A 18 18 GLN CB C 18 30.329 29.601 0.728 1
1 164 . 5 1 1 A 18 18 GLN N N 18 120.202 122.122 -1.920 1
1 166 . 5 1 1 A 19 19 VAL H H 19 8.216 8.591 -0.375 1
1 167 . 5 1 1 A 19 19 VAL HA H 19 4.450 4.695 -0.245 1
1 175 . 5 1 1 A 19 19 VAL C C 19 173.648 173.522 0.126 1
1 176 . 5 1 1 A 19 19 VAL CA C 19 60.788 60.453 0.335 1
1 177 . 5 1 1 A 19 19 VAL CB C 19 35.336 35.600 -0.264 1
1 180 . 5 1 1 A 19 19 VAL N N 19 121.257 126.950 -5.693 1
1 181 . 5 1 1 A 20 20 GLU H H 20 8.610 8.916 -0.306 1
1 182 . 5 1 1 A 20 20 GLU HA H 20 5.211 4.996 0.215 1
1 187 . 5 1 1 A 20 20 GLU C C 20 174.783 175.491 -0.708 1
1 188 . 5 1 1 A 20 20 GLU CA C 20 54.793 55.019 -0.226 1
1 189 . 5 1 1 A 20 20 GLU CB C 20 32.058 32.149 -0.091 1
1 191 . 5 1 1 A 20 20 GLU N N 20 127.095 127.482 -0.387 1
1 192 . 5 1 1 A 21 21 VAL H H 21 8.727 8.529 0.198 1
1 193 . 5 1 1 A 21 21 VAL HA H 21 4.633 4.910 -0.277 1
1 201 . 5 1 1 A 21 21 VAL C C 21 173.894 174.134 -0.240 1
1 202 . 5 1 1 A 21 21 VAL CA C 21 59.695 59.168 0.527 1
1 203 . 5 1 1 A 21 21 VAL CB C 21 35.865 35.543 0.322 1
1 206 . 5 1 1 A 21 21 VAL N N 21 120.489 120.563 -0.074 1
1 207 . 5 1 1 A 22 22 HIS H H 22 8.680 8.802 -0.122 1
1 208 . 5 1 1 A 22 22 HIS HA H 22 5.552 5.164 0.388 1
1 212 . 5 1 1 A 22 22 HIS C C 22 174.298 173.564 0.734 1
1 213 . 5 1 1 A 22 22 HIS CA C 22 55.331 54.384 0.947 1
1 214 . 5 1 1 A 22 22 HIS CB C 22 32.369 31.670 0.699 1
1 216 . 5 1 1 A 22 22 HIS N N 22 124.991 120.387 4.604 1
1 217 . 5 1 1 A 23 23 ILE H H 23 9.179 9.142 0.037 1
1 218 . 5 1 1 A 23 23 ILE HA H 23 5.046 4.776 0.270 1
1 228 . 5 1 1 A 23 23 ILE C C 23 171.552 173.934 -2.382 1
1 229 . 5 1 1 A 23 23 ILE CA C 23 55.551 57.281 -1.730 1
1 230 . 5 1 1 A 23 23 ILE CB C 23 42.053 41.615 0.438 1
1 234 . 5 1 1 A 23 23 ILE N N 23 123.121 123.984 -0.863 1
1 235 . 5 1 1 A 24 24 PRO HA H 24 4.816 4.827 -0.011 1
1 242 . 5 1 1 A 24 24 PRO C C 24 178.887 177.920 0.967 1
1 243 . 5 1 1 A 24 24 PRO CA C 24 62.216 62.782 -0.566 1
1 244 . 5 1 1 A 24 24 PRO CB C 24 32.895 32.669 0.226 1
1 247 . 5 1 1 A 25 25 GLU H H 25 8.399 8.743 -0.344 1
1 248 . 5 1 1 A 25 25 GLU HA H 25 3.785 4.020 -0.235 1
1 253 . 5 1 1 A 25 25 GLU C C 25 175.244 177.221 -1.977 1
1 254 . 5 1 1 A 25 25 GLU CA C 25 58.425 59.156 -0.731 1
1 255 . 5 1 1 A 25 25 GLU CB C 25 30.011 29.038 0.973 1
1 257 . 5 1 1 A 25 25 GLU N N 25 117.706 122.366 -4.660 1
1 258 . 5 1 1 A 26 26 ASN H H 26 7.488 7.709 -0.221 1
1 259 . 5 1 1 A 26 26 ASN HA H 26 4.702 4.825 -0.123 1
1 264 . 5 1 1 A 26 26 ASN C C 26 175.425 175.099 0.326 1
1 265 . 5 1 1 A 26 26 ASN CA C 26 51.584 53.377 -1.793 1
1 266 . 5 1 1 A 26 26 ASN CB C 26 37.243 38.545 -1.302 1
1 267 . 5 1 1 A 26 26 ASN N N 26 112.383 116.281 -3.898 1
1 269 . 5 1 1 A 27 27 ALA H H 27 7.716 7.302 0.414 1
1 270 . 5 1 1 A 27 27 ALA HA H 27 4.409 4.371 0.038 1
1 274 . 5 1 1 A 27 27 ALA C C 27 175.850 175.793 0.057 1
1 275 . 5 1 1 A 27 27 ALA CA C 27 51.037 50.960 0.077 1
1 276 . 5 1 1 A 27 27 ALA CB C 27 18.152 18.382 -0.230 1
1 277 . 5 1 1 A 27 27 ALA N N 27 125.139 123.421 1.718 1
1 278 . 5 1 1 A 28 28 PRO HA H 28 4.422 4.547 -0.125 1
1 285 . 5 1 1 A 28 28 PRO C C 28 178.442 176.792 1.650 1
1 286 . 5 1 1 A 28 28 PRO CA C 28 62.067 62.897 -0.830 1
1 287 . 5 1 1 A 28 28 PRO CB C 28 32.642 32.218 0.424 1
1 290 . 5 1 1 A 29 29 VAL H H 29 8.691 8.442 0.249 1
1 291 . 5 1 1 A 29 29 VAL HA H 29 3.239 3.695 -0.456 1
1 299 . 5 1 1 A 29 29 VAL C C 29 176.887 176.689 0.198 1
1 300 . 5 1 1 A 29 29 VAL CA C 29 65.812 63.457 2.355 1
1 301 . 5 1 1 A 29 29 VAL CB C 29 31.174 31.403 -0.229 1
1 304 . 5 1 1 A 29 29 VAL N N 29 123.592 122.348 1.244 1
1 305 . 5 1 1 A 30 30 GLY H H 30 9.197 9.109 0.088 1
1 306 . 5 1 1 A 30 30 GLY HA2 H 30 4.486 3.952 0.534 1
1 307 . 5 1 1 A 30 30 GLY HA3 H 30 3.581 3.953 -0.372 1
1 308 . 5 1 1 A 30 30 GLY C C 30 174.347 174.663 -0.316 1
1 309 . 5 1 1 A 30 30 GLY CA C 30 44.320 45.145 -0.825 1
1 310 . 5 1 1 A 30 30 GLY N N 30 116.042 116.572 -0.530 1
1 311 . 5 1 1 A 31 31 THR H H 31 7.838 7.783 0.055 1
1 312 . 5 1 1 A 31 31 THR HA H 31 3.959 4.206 -0.247 1
1 317 . 5 1 1 A 31 31 THR C C 31 174.274 173.842 0.432 1
1 318 . 5 1 1 A 31 31 THR CA C 31 65.160 63.093 2.067 1
1 319 . 5 1 1 A 31 31 THR CB C 31 69.972 69.152 0.820 1
1 321 . 5 1 1 A 31 31 THR N N 31 117.679 118.190 -0.511 1
1 322 . 5 1 1 A 32 32 SER H H 32 9.022 8.628 0.394 1
1 323 . 5 1 1 A 32 32 SER HA H 32 4.273 4.619 -0.346 1
1 326 . 5 1 1 A 32 32 SER C C 32 172.692 174.475 -1.783 1
1 327 . 5 1 1 A 32 32 SER CA C 32 59.642 58.387 1.255 1
1 328 . 5 1 1 A 32 32 SER CB C 32 63.102 63.101 0.001 1
1 329 . 5 1 1 A 32 32 SER N N 32 123.045 121.266 1.779 1
1 330 . 5 1 1 A 33 33 VAL H H 33 9.202 8.569 0.633 1
1 331 . 5 1 1 A 33 33 VAL HA H 33 3.844 4.061 -0.217 1
1 339 . 5 1 1 A 33 33 VAL C C 33 174.782 175.784 -1.002 1
1 340 . 5 1 1 A 33 33 VAL CA C 33 64.242 63.999 0.243 1
1 341 . 5 1 1 A 33 33 VAL CB C 33 32.893 32.218 0.675 1
1 344 . 5 1 1 A 33 33 VAL N N 33 126.861 124.886 1.975 1
1 345 . 5 1 1 A 34 34 ILE H H 34 7.074 7.954 -0.880 1
1 346 . 5 1 1 A 34 34 ILE HA H 34 4.295 4.705 -0.410 1
1 356 . 5 1 1 A 34 34 ILE C C 34 170.577 173.242 -2.665 1
1 357 . 5 1 1 A 34 34 ILE CA C 34 59.500 59.242 0.258 1
1 358 . 5 1 1 A 34 34 ILE CB C 34 39.251 42.150 -2.899 1
1 362 . 5 1 1 A 34 34 ILE N N 34 111.445 118.889 -7.444 1
1 363 . 5 1 1 A 35 35 GLN H H 35 8.450 8.934 -0.484 1
1 364 . 5 1 1 A 35 35 GLN HA H 35 4.633 5.015 -0.382 1
1 371 . 5 1 1 A 35 35 GLN C C 35 174.354 174.221 0.133 1
1 372 . 5 1 1 A 35 35 GLN CA C 35 54.176 54.077 0.099 1
1 373 . 5 1 1 A 35 35 GLN CB C 35 29.456 32.112 -2.656 1
1 375 . 5 1 1 A 35 35 GLN N N 35 127.342 127.989 -0.647 1
1 377 . 5 1 1 A 36 36 LEU H H 36 7.761 8.368 -0.607 1
1 378 . 5 1 1 A 36 36 LEU HA H 36 4.492 5.193 -0.701 1
1 388 . 5 1 1 A 36 36 LEU C C 36 175.543 175.149 0.394 1
1 389 . 5 1 1 A 36 36 LEU CA C 36 53.982 53.590 0.392 1
1 390 . 5 1 1 A 36 36 LEU CB C 36 42.776 43.393 -0.617 1
1 394 . 5 1 1 A 36 36 LEU N N 36 128.895 126.793 2.102 1
1 395 . 5 1 1 A 37 37 HIS H H 37 8.529 8.952 -0.423 1
1 396 . 5 1 1 A 37 37 HIS HA H 37 4.851 5.350 -0.499 1
1 400 . 5 1 1 A 37 37 HIS C C 37 172.985 173.358 -0.373 1
1 401 . 5 1 1 A 37 37 HIS CA C 37 55.833 53.157 2.676 1
1 402 . 5 1 1 A 37 37 HIS CB C 37 32.204 32.313 -0.109 1
1 404 . 5 1 1 A 37 37 HIS N N 37 115.903 124.544 -8.641 1
1 405 . 5 1 1 A 38 38 ALA H H 38 8.474 8.701 -0.227 1
1 406 . 5 1 1 A 38 38 ALA HA H 38 4.691 4.816 -0.125 1
1 410 . 5 1 1 A 38 38 ALA C C 38 175.548 176.006 -0.458 1
1 411 . 5 1 1 A 38 38 ALA CA C 38 50.491 50.661 -0.170 1
1 412 . 5 1 1 A 38 38 ALA CB C 38 19.842 20.156 -0.314 1
1 413 . 5 1 1 A 38 38 ALA N N 38 128.891 130.825 -1.934 1
1 414 . 5 1 1 A 39 39 THR H H 39 8.095 8.876 -0.781 1
1 415 . 5 1 1 A 39 39 THR HA H 39 4.336 5.228 -0.892 1
1 420 . 5 1 1 A 39 39 THR C C 39 173.553 173.747 -0.194 1
1 421 . 5 1 1 A 39 39 THR CA C 39 60.417 60.352 0.065 1
1 422 . 5 1 1 A 39 39 THR CB C 39 70.912 70.965 -0.053 1
1 424 . 5 1 1 A 39 39 THR N N 39 110.982 114.768 -3.786 1
1 425 . 5 1 1 A 40 40 ASP H H 40 8.417 8.873 -0.456 1
1 426 . 5 1 1 A 40 40 ASP HA H 40 4.553 4.615 -0.062 1
1 429 . 5 1 1 A 40 40 ASP C C 40 176.462 175.774 0.688 1
1 430 . 5 1 1 A 40 40 ASP CA C 40 54.158 53.100 1.058 1
1 431 . 5 1 1 A 40 40 ASP CB C 40 41.517 41.612 -0.095 1
1 432 . 5 1 1 A 40 40 ASP N N 40 121.450 125.087 -3.637 1
1 433 . 5 1 1 A 41 41 ALA H H 41 8.435 8.345 0.090 1
1 434 . 5 1 1 A 41 41 ALA HA H 41 4.129 4.233 -0.104 1
1 438 . 5 1 1 A 41 41 ALA C C 41 177.718 178.218 -0.500 1
1 439 . 5 1 1 A 41 41 ALA CA C 41 53.436 52.742 0.694 1
1 440 . 5 1 1 A 41 41 ALA CB C 41 19.183 19.430 -0.247 1
1 441 . 5 1 1 A 41 41 ALA N N 41 124.607 123.446 1.161 1
1 442 . 5 1 1 A 42 42 ASP H H 42 8.310 8.997 -0.687 1
1 443 . 5 1 1 A 42 42 ASP HA H 42 4.588 4.282 0.306 1
1 446 . 5 1 1 A 42 42 ASP C C 42 176.546 177.160 -0.614 1
1 447 . 5 1 1 A 42 42 ASP CA C 42 54.599 57.940 -3.341 1
1 448 . 5 1 1 A 42 42 ASP CB C 42 41.146 41.062 0.084 1
1 449 . 5 1 1 A 42 42 ASP N N 42 118.030 125.581 -7.551 1
1 450 . 5 1 1 A 43 43 ILE H H 43 8.000 7.852 0.148 1
1 451 . 5 1 1 A 43 43 ILE HA H 43 4.130 3.925 0.205 1
1 461 . 5 1 1 A 43 43 ILE C C 43 176.901 175.701 1.200 1
1 462 . 5 1 1 A 43 43 ILE CA C 43 61.740 62.683 -0.943 1
1 463 . 5 1 1 A 43 43 ILE CB C 43 38.491 37.858 0.633 1
1 467 . 5 1 1 A 43 43 ILE N N 43 119.301 118.815 0.486 1
1 468 . 5 1 1 A 44 44 GLY H H 44 8.448 8.409 0.039 1
1 469 . 5 1 1 A 44 44 GLY HA2 H 44 3.939 4.189 -0.250 1
1 470 . 5 1 1 A 44 44 GLY HA3 H 44 3.939 4.191 -0.252 1
1 471 . 5 1 1 A 44 44 GLY C C 44 174.393 172.184 2.209 1
1 472 . 5 1 1 A 44 44 GLY CA C 44 45.501 45.671 -0.170 1
1 473 . 5 1 1 A 44 44 GLY N N 44 111.333 115.760 -4.427 1
1 474 . 5 1 1 A 45 45 SER H H 45 8.061 8.401 -0.340 1
1 475 . 5 1 1 A 45 45 SER HA H 45 4.416 5.060 -0.644 1
1 478 . 5 1 1 A 45 45 SER C C 45 174.480 173.065 1.415 1
1 479 . 5 1 1 A 45 45 SER CA C 45 58.478 57.479 0.999 1
1 480 . 5 1 1 A 45 45 SER CB C 45 63.943 66.437 -2.494 1
1 481 . 5 1 1 A 45 45 SER N N 45 115.551 117.685 -2.134 1
1 482 . 5 1 1 A 46 46 ASN H H 46 8.547 8.898 -0.351 1
1 483 . 5 1 1 A 46 46 ASN HA H 46 4.725 4.684 0.041 1
1 488 . 5 1 1 A 46 46 ASN C C 46 175.031 174.866 0.165 1
1 489 . 5 1 1 A 46 46 ASN CA C 46 53.277 53.982 -0.705 1
1 490 . 5 1 1 A 46 46 ASN CB C 46 38.798 39.113 -0.315 1
1 491 . 5 1 1 A 46 46 ASN N N 46 120.698 126.331 -5.633 1
1 493 . 5 1 1 A 47 47 ALA H H 47 8.239 8.590 -0.351 1
1 494 . 5 1 1 A 47 47 ALA HA H 47 4.283 5.183 -0.900 1
1 498 . 5 1 1 A 47 47 ALA C C 47 177.240 175.660 1.580 1
1 499 . 5 1 1 A 47 47 ALA CA C 47 52.731 50.055 2.676 1
1 500 . 5 1 1 A 47 47 ALA CB C 47 19.594 23.334 -3.740 1
1 501 . 5 1 1 A 47 47 ALA N N 47 124.093 128.123 -4.030 1
1 502 . 5 1 1 A 48 48 GLU H H 48 8.376 8.667 -0.291 1
1 503 . 5 1 1 A 48 48 GLU HA H 48 4.264 4.685 -0.421 1
1 508 . 5 1 1 A 48 48 GLU C C 48 175.702 175.295 0.407 1
1 509 . 5 1 1 A 48 48 GLU CA C 48 55.992 55.192 0.800 1
1 510 . 5 1 1 A 48 48 GLU CB C 48 30.210 29.892 0.318 1
1 512 . 5 1 1 A 48 48 GLU N N 48 119.750 120.660 -0.910 1
1 513 . 5 1 1 A 49 49 ILE H H 49 7.806 8.413 -0.607 1
1 514 . 5 1 1 A 49 49 ILE HA H 49 3.919 4.566 -0.647 1
1 524 . 5 1 1 A 49 49 ILE C C 49 175.894 174.821 1.073 1
1 525 . 5 1 1 A 49 49 ILE CA C 49 60.559 60.825 -0.266 1
1 526 . 5 1 1 A 49 49 ILE CB C 49 37.860 37.520 0.340 1
1 530 . 5 1 1 A 49 49 ILE N N 49 122.772 125.775 -3.003 1
1 531 . 5 1 1 A 50 50 ARG H H 50 8.247 8.006 0.241 1
1 532 . 5 1 1 A 50 50 ARG HA H 50 4.999 4.782 0.217 1
1 539 . 5 1 1 A 50 50 ARG C C 50 174.603 174.092 0.511 1
1 540 . 5 1 1 A 50 50 ARG CA C 50 53.189 54.139 -0.950 1
1 541 . 5 1 1 A 50 50 ARG CB C 50 33.152 33.220 -0.068 1
1 544 . 5 1 1 A 50 50 ARG N N 50 126.912 127.448 -0.536 1
1 545 . 5 1 1 A 51 51 TYR H H 51 9.041 8.880 0.161 1
1 546 . 5 1 1 A 51 51 TYR HA H 51 5.395 5.396 -0.001 1
1 553 . 5 1 1 A 51 51 TYR C C 51 175.555 175.746 -0.191 1
1 554 . 5 1 1 A 51 51 TYR CA C 51 56.909 57.006 -0.097 1
1 555 . 5 1 1 A 51 51 TYR CB C 51 40.116 40.211 -0.095 1
1 560 . 5 1 1 A 51 51 TYR N N 51 121.627 126.203 -4.576 1
1 561 . 5 1 1 A 52 52 ILE H H 52 8.850 8.688 0.162 1
1 562 . 5 1 1 A 52 52 ILE HA H 52 4.576 4.901 -0.325 1
1 572 . 5 1 1 A 52 52 ILE C C 52 175.371 175.036 0.335 1
1 573 . 5 1 1 A 52 52 ILE CA C 52 59.624 59.296 0.328 1
1 574 . 5 1 1 A 52 52 ILE CB C 52 42.895 41.960 0.935 1
1 578 . 5 1 1 A 52 52 ILE N N 52 117.697 118.308 -0.611 1
1 579 . 5 1 1 A 53 53 PHE H H 53 8.748 8.725 0.023 1
1 580 . 5 1 1 A 53 53 PHE HA H 53 5.132 4.502 0.630 1
1 588 . 5 1 1 A 53 53 PHE C C 53 178.146 176.545 1.601 1
1 589 . 5 1 1 A 53 53 PHE CA C 53 57.667 59.149 -1.482 1
1 590 . 5 1 1 A 53 53 PHE CB C 53 39.614 39.581 0.033 1
1 596 . 5 1 1 A 53 53 PHE N N 53 121.433 122.901 -1.468 1
1 597 . 5 1 1 A 54 54 GLY H H 54 8.538 9.047 -0.509 1
1 598 . 5 1 1 A 54 54 GLY HA2 H 54 4.074 4.105 -0.031 1
1 599 . 5 1 1 A 54 54 GLY HA3 H 54 3.840 4.108 -0.268 1
1 600 . 5 1 1 A 54 54 GLY C C 54 174.530 172.939 1.591 1
1 601 . 5 1 1 A 54 54 GLY CA C 54 44.884 44.625 0.259 1
1 602 . 5 1 1 A 54 54 GLY N N 54 106.444 111.070 -4.626 1
1 603 . 5 1 1 A 55 55 ALA H H 55 8.594 8.354 0.240 1
1 604 . 5 1 1 A 55 55 ALA HA H 55 4.172 4.506 -0.334 1
1 608 . 5 1 1 A 55 55 ALA C C 55 178.718 177.467 1.251 1
1 609 . 5 1 1 A 55 55 ALA CA C 55 54.423 51.206 3.217 1
1 610 . 5 1 1 A 55 55 ALA CB C 55 19.059 20.336 -1.277 1
1 611 . 5 1 1 A 55 55 ALA N N 55 123.470 121.703 1.767 1
1 612 . 5 1 1 A 56 56 GLN H H 56 8.727 8.760 -0.033 1
1 613 . 5 1 1 A 56 56 GLN HA H 56 4.367 3.724 0.643 1
1 620 . 5 1 1 A 56 56 GLN C C 56 176.134 174.903 1.231 1
1 621 . 5 1 1 A 56 56 GLN CA C 56 55.660 56.624 -0.964 1
1 622 . 5 1 1 A 56 56 GLN CB C 56 28.152 26.971 1.181 1
1 624 . 5 1 1 A 56 56 GLN N N 56 114.221 115.622 -1.401 1
1 626 . 5 1 1 A 57 57 VAL H H 57 7.204 7.870 -0.666 1
1 627 . 5 1 1 A 57 57 VAL HA H 57 3.889 4.089 -0.200 1
1 635 . 5 1 1 A 57 57 VAL C C 57 175.371 175.265 0.106 1
1 636 . 5 1 1 A 57 57 VAL CA C 57 63.908 61.815 2.093 1
1 637 . 5 1 1 A 57 57 VAL CB C 57 31.557 32.223 -0.666 1
1 640 . 5 1 1 A 57 57 VAL N N 57 121.341 119.772 1.569 1
1 641 . 5 1 1 A 58 58 ALA H H 58 8.920 8.510 0.410 1
1 642 . 5 1 1 A 58 58 ALA HA H 58 4.547 4.383 0.164 1
1 646 . 5 1 1 A 58 58 ALA C C 58 177.064 177.772 -0.708 1
1 647 . 5 1 1 A 58 58 ALA CA C 58 51.173 50.634 0.539 1
1 648 . 5 1 1 A 58 58 ALA CB C 58 17.842 17.755 0.087 1
1 649 . 5 1 1 A 58 58 ALA N N 58 132.726 130.817 1.909 1
1 650 . 5 1 1 A 59 59 PRO HA H 59 4.101 4.244 -0.143 1
1 657 . 5 1 1 A 59 59 PRO C C 59 179.482 178.378 1.104 1
1 658 . 5 1 1 A 59 59 PRO CA C 59 66.060 65.502 0.558 1
1 659 . 5 1 1 A 59 59 PRO CB C 59 31.951 31.865 0.086 1
1 662 . 5 1 1 A 60 60 ALA H H 60 8.706 8.252 0.454 1
1 663 . 5 1 1 A 60 60 ALA HA H 60 4.057 4.006 0.051 1
1 667 . 5 1 1 A 60 60 ALA C C 60 179.627 180.142 -0.515 1
1 668 . 5 1 1 A 60 60 ALA CA C 60 55.305 55.341 -0.036 1
1 669 . 5 1 1 A 60 60 ALA CB C 60 18.737 18.430 0.307 1
1 670 . 5 1 1 A 60 60 ALA N N 60 117.882 118.615 -0.733 1
1 671 . 5 1 1 A 61 61 THR H H 61 7.312 7.999 -0.687 1
1 672 . 5 1 1 A 61 61 THR HA H 61 4.153 3.994 0.159 1
1 677 . 5 1 1 A 61 61 THR C C 61 175.824 176.536 -0.712 1
1 678 . 5 1 1 A 61 61 THR CA C 61 66.412 66.999 -0.587 1
1 679 . 5 1 1 A 61 61 THR CB C 61 68.787 68.782 0.005 1
1 681 . 5 1 1 A 61 61 THR N N 61 114.483 114.593 -0.110 1
1 682 . 5 1 1 A 62 62 LYS H H 62 7.556 7.617 -0.061 1
1 683 . 5 1 1 A 62 62 LYS HA H 62 3.943 4.084 -0.141 1
1 692 . 5 1 1 A 62 62 LYS C C 62 176.884 178.987 -2.103 1
1 693 . 5 1 1 A 62 62 LYS CA C 62 59.095 59.760 -0.665 1
1 694 . 5 1 1 A 62 62 LYS CB C 62 32.204 31.771 0.433 1
1 698 . 5 1 1 A 62 62 LYS N N 62 118.994 118.846 0.148 1
1 699 . 5 1 1 A 63 63 ARG H H 63 7.474 8.024 -0.550 1
1 700 . 5 1 1 A 63 63 ARG HA H 63 4.034 4.013 0.021 1
1 707 . 5 1 1 A 63 63 ARG C C 63 177.574 178.852 -1.278 1
1 708 . 5 1 1 A 63 63 ARG CA C 63 58.143 58.962 -0.819 1
1 709 . 5 1 1 A 63 63 ARG CB C 63 30.755 29.788 0.967 1
1 712 . 5 1 1 A 63 63 ARG N N 63 114.251 120.336 -6.085 1
1 713 . 5 1 1 A 64 64 LEU H H 64 6.991 7.314 -0.323 1
1 714 . 5 1 1 A 64 64 LEU HA H 64 3.904 3.885 0.019 1
1 724 . 5 1 1 A 64 64 LEU C C 64 176.632 176.266 0.366 1
1 725 . 5 1 1 A 64 64 LEU CA C 64 56.503 57.584 -1.081 1
1 726 . 5 1 1 A 64 64 LEU CB C 64 42.929 42.091 0.838 1
1 730 . 5 1 1 A 64 64 LEU N N 64 116.109 119.392 -3.283 1
1 731 . 5 1 1 A 65 65 PHE H H 65 7.673 8.346 -0.673 1
1 732 . 5 1 1 A 65 65 PHE HA H 65 5.386 5.094 0.292 1
1 740 . 5 1 1 A 65 65 PHE C C 65 173.067 175.352 -2.285 1
1 741 . 5 1 1 A 65 65 PHE CA C 65 56.521 57.212 -0.691 1
1 742 . 5 1 1 A 65 65 PHE CB C 65 41.270 41.210 0.060 1
1 748 . 5 1 1 A 65 65 PHE N N 65 116.182 115.467 0.715 1
1 749 . 5 1 1 A 66 66 ALA H H 66 8.914 9.333 -0.419 1
1 750 . 5 1 1 A 66 66 ALA HA H 66 4.748 5.568 -0.820 1
1 754 . 5 1 1 A 66 66 ALA C C 66 175.223 175.626 -0.403 1
1 755 . 5 1 1 A 66 66 ALA CA C 66 50.050 50.162 -0.112 1
1 756 . 5 1 1 A 66 66 ALA CB C 66 21.161 22.657 -1.496 1
1 757 . 5 1 1 A 66 66 ALA N N 66 122.870 126.002 -3.132 1
1 758 . 5 1 1 A 67 67 LEU H H 67 8.498 8.870 -0.372 1
1 759 . 5 1 1 A 67 67 LEU HA H 67 4.713 4.775 -0.062 1
1 769 . 5 1 1 A 67 67 LEU C C 67 175.146 174.473 0.673 1
1 770 . 5 1 1 A 67 67 LEU CA C 67 52.518 54.006 -1.488 1
1 771 . 5 1 1 A 67 67 LEU CB C 67 45.308 45.430 -0.122 1
1 775 . 5 1 1 A 67 67 LEU N N 67 122.208 122.084 0.124 1
1 776 . 5 1 1 A 68 68 ASN H H 68 8.357 8.414 -0.057 1
1 777 . 5 1 1 A 68 68 ASN HA H 68 4.679 5.055 -0.376 1
1 782 . 5 1 1 A 68 68 ASN C C 68 176.228 175.504 0.724 1
1 783 . 5 1 1 A 68 68 ASN CA C 68 53.524 52.636 0.888 1
1 784 . 5 1 1 A 68 68 ASN CB C 68 39.580 40.032 -0.452 1
1 785 . 5 1 1 A 68 68 ASN N N 68 126.940 124.638 2.302 1
1 787 . 5 1 1 A 69 69 ASN H H 69 8.861 9.193 -0.332 1
1 788 . 5 1 1 A 69 69 ASN HA H 69 5.137 5.107 0.030 1
1 793 . 5 1 1 A 69 69 ASN C C 69 175.631 176.528 -0.897 1
1 794 . 5 1 1 A 69 69 ASN CA C 69 56.009 54.872 1.137 1
1 795 . 5 1 1 A 69 69 ASN CB C 69 40.314 38.670 1.644 1
1 796 . 5 1 1 A 69 69 ASN N N 69 124.980 122.794 2.186 1
1 798 . 5 1 1 A 70 70 THR H H 70 8.635 7.725 0.910 1
1 799 . 5 1 1 A 70 70 THR HA H 70 4.815 4.199 0.616 1
1 804 . 5 1 1 A 70 70 THR C C 70 176.223 176.047 0.176 1
1 805 . 5 1 1 A 70 70 THR CA C 70 63.944 64.712 -0.768 1
1 806 . 5 1 1 A 70 70 THR CB C 70 69.727 69.461 0.266 1
1 808 . 5 1 1 A 70 70 THR N N 70 110.394 114.061 -3.667 1
1 809 . 5 1 1 A 71 71 THR H H 71 8.069 7.882 0.187 1
1 810 . 5 1 1 A 71 71 THR HA H 71 4.566 4.573 -0.007 1
1 815 . 5 1 1 A 71 71 THR C C 71 176.213 176.079 0.134 1
1 816 . 5 1 1 A 71 71 THR CA C 71 61.683 62.165 -0.482 1
1 817 . 5 1 1 A 71 71 THR CB C 71 70.832 71.601 -0.769 1
1 819 . 5 1 1 A 71 71 THR N N 71 110.507 108.725 1.782 1
1 820 . 5 1 1 A 72 72 GLY H H 72 7.990 8.357 -0.367 1
1 821 . 5 1 1 A 72 72 GLY HA2 H 72 3.186 3.577 -0.391 1
1 822 . 5 1 1 A 72 72 GLY HA3 H 72 2.516 3.899 -1.383 1
1 823 . 5 1 1 A 72 72 GLY C C 72 172.988 174.487 -1.499 1
1 824 . 5 1 1 A 72 72 GLY CA C 72 45.149 46.204 -1.055 1
1 825 . 5 1 1 A 72 72 GLY N N 72 110.788 112.585 -1.797 1
1 826 . 5 1 1 A 73 73 LEU H H 73 7.138 7.209 -0.071 1
1 827 . 5 1 1 A 73 73 LEU HA H 73 4.414 4.670 -0.256 1
1 837 . 5 1 1 A 73 73 LEU C C 73 176.836 175.158 1.678 1
1 838 . 5 1 1 A 73 73 LEU CA C 73 55.252 53.396 1.856 1
1 839 . 5 1 1 A 73 73 LEU CB C 73 43.574 44.576 -1.002 1
1 843 . 5 1 1 A 73 73 LEU N N 73 119.222 121.778 -2.556 1
1 844 . 5 1 1 A 74 74 ILE H H 74 8.925 8.745 0.180 1
1 845 . 5 1 1 A 74 74 ILE HA H 74 5.555 5.191 0.364 1
1 855 . 5 1 1 A 74 74 ILE C C 74 175.978 175.162 0.816 1
1 856 . 5 1 1 A 74 74 ILE CA C 74 60.100 60.284 -0.184 1
1 857 . 5 1 1 A 74 74 ILE CB C 74 38.550 39.201 -0.651 1
1 861 . 5 1 1 A 74 74 ILE N N 74 129.871 127.181 2.690 1
1 862 . 5 1 1 A 75 75 THR H H 75 9.161 8.563 0.598 1
1 863 . 5 1 1 A 75 75 THR HA H 75 5.375 5.222 0.153 1
1 868 . 5 1 1 A 75 75 THR C C 75 174.798 173.400 1.398 1
1 869 . 5 1 1 A 75 75 THR CA C 75 58.796 59.406 -0.610 1
1 870 . 5 1 1 A 75 75 THR CB C 75 72.978 72.072 0.906 1
1 872 . 5 1 1 A 75 75 THR N N 75 117.522 117.804 -0.282 1
1 873 . 5 1 1 A 76 76 VAL H H 76 8.327 8.864 -0.537 1
1 874 . 5 1 1 A 76 76 VAL HA H 76 3.973 3.696 0.277 1
1 882 . 5 1 1 A 76 76 VAL C C 76 176.495 176.154 0.341 1
1 883 . 5 1 1 A 76 76 VAL CA C 76 64.085 63.089 0.996 1
1 884 . 5 1 1 A 76 76 VAL CB C 76 32.863 30.648 2.215 1
1 887 . 5 1 1 A 76 76 VAL N N 76 120.876 123.082 -2.206 1
1 888 . 5 1 1 A 77 77 GLN H H 77 9.525 8.985 0.540 1
1 889 . 5 1 1 A 77 77 GLN HA H 77 4.702 4.123 0.579 1
1 896 . 5 1 1 A 77 77 GLN C C 77 173.838 175.389 -1.551 1
1 897 . 5 1 1 A 77 77 GLN CA C 77 55.728 57.843 -2.115 1
1 898 . 5 1 1 A 77 77 GLN CB C 77 30.762 29.562 1.200 1
1 900 . 5 1 1 A 77 77 GLN N N 77 129.825 129.000 0.825 1
1 902 . 5 1 1 A 78 78 ARG H H 78 7.621 8.022 -0.401 1
1 903 . 5 1 1 A 78 78 ARG HA H 78 4.347 4.675 -0.328 1
1 910 . 5 1 1 A 78 78 ARG C C 78 172.304 175.075 -2.771 1
1 911 . 5 1 1 A 78 78 ARG CA C 78 54.634 53.715 0.919 1
1 912 . 5 1 1 A 78 78 ARG CB C 78 34.685 35.109 -0.424 1
1 915 . 5 1 1 A 78 78 ARG N N 78 120.595 117.667 2.928 1
1 916 . 5 1 1 A 79 79 SER H H 79 7.958 8.468 -0.510 1
1 917 . 5 1 1 A 79 79 SER HA H 79 4.030 4.313 -0.283 1
1 920 . 5 1 1 A 79 79 SER C C 79 174.311 174.408 -0.097 1
1 921 . 5 1 1 A 79 79 SER CA C 79 59.889 58.890 0.999 1
1 922 . 5 1 1 A 79 79 SER CB C 79 63.548 63.674 -0.126 1
1 923 . 5 1 1 A 79 79 SER N N 79 112.565 117.838 -5.273 1
1 924 . 5 1 1 A 80 80 LEU H H 80 8.715 8.296 0.419 1
1 925 . 5 1 1 A 80 80 LEU HA H 80 4.114 5.023 -0.909 1
1 935 . 5 1 1 A 80 80 LEU C C 80 176.057 174.832 1.225 1
1 936 . 5 1 1 A 80 80 LEU CA C 80 55.091 53.584 1.507 1
1 937 . 5 1 1 A 80 80 LEU CB C 80 42.341 44.826 -2.485 1
1 941 . 5 1 1 A 80 80 LEU N N 80 123.070 124.613 -1.543 1
1 942 . 5 1 1 A 81 81 ASP H H 81 7.298 8.716 -1.418 1
1 943 . 5 1 1 A 81 81 ASP HA H 81 4.725 5.207 -0.482 1
1 946 . 5 1 1 A 81 81 ASP C C 81 175.939 175.616 0.323 1
1 947 . 5 1 1 A 81 81 ASP CA C 81 53.664 52.623 1.041 1
1 948 . 5 1 1 A 81 81 ASP CB C 81 42.947 43.480 -0.533 1
1 949 . 5 1 1 A 81 81 ASP N N 81 115.229 122.802 -7.573 1
1 950 . 5 1 1 A 82 82 ARG H H 82 9.289 8.923 0.366 1
1 951 . 5 1 1 A 82 82 ARG HA H 82 4.416 4.628 -0.212 1
1 959 . 5 1 1 A 82 82 ARG C C 82 176.406 178.368 -1.962 1
1 960 . 5 1 1 A 82 82 ARG CA C 82 56.397 58.683 -2.286 1
1 961 . 5 1 1 A 82 82 ARG CB C 82 30.638 30.802 -0.164 1
1 964 . 5 1 1 A 82 82 ARG N N 82 123.174 126.023 -2.849 1
1 966 . 5 1 1 A 83 83 GLU H H 83 8.468 8.339 0.129 1
1 967 . 5 1 1 A 83 83 GLU HA H 83 3.982 4.136 -0.154 1
1 972 . 5 1 1 A 83 83 GLU C C 83 177.740 178.477 -0.737 1
1 973 . 5 1 1 A 83 83 GLU CA C 83 58.425 59.232 -0.807 1
1 974 . 5 1 1 A 83 83 GLU CB C 83 29.701 28.769 0.932 1
1 976 . 5 1 1 A 83 83 GLU N N 83 119.549 117.803 1.746 1
1 977 . 5 1 1 A 84 84 GLU H H 84 8.033 7.973 0.060 1
1 978 . 5 1 1 A 84 84 GLU HA H 84 4.206 4.302 -0.096 1
1 983 . 5 1 1 A 84 84 GLU C C 84 176.837 175.799 1.038 1
1 984 . 5 1 1 A 84 84 GLU CA C 84 58.056 58.027 0.029 1
1 985 . 5 1 1 A 84 84 GLU CB C 84 30.432 31.158 -0.726 1
1 987 . 5 1 1 A 84 84 GLU N N 84 118.333 119.501 -1.168 1
1 988 . 5 1 1 A 85 85 THR H H 85 7.651 7.337 0.314 1
1 989 . 5 1 1 A 85 85 THR HA H 85 4.307 4.573 -0.266 1
1 994 . 5 1 1 A 85 85 THR C C 85 171.568 173.576 -2.008 1
1 995 . 5 1 1 A 85 85 THR CA C 85 61.387 59.865 1.522 1
1 996 . 5 1 1 A 85 85 THR CB C 85 69.963 70.913 -0.950 1
1 998 . 5 1 1 A 85 85 THR N N 85 112.444 112.235 0.209 1
1 999 . 5 1 1 A 86 86 ALA H H 86 8.639 8.540 0.099 1
1 1000 . 5 1 1 A 86 86 ALA HA H 86 4.603 4.451 0.152 1
1 1004 . 5 1 1 A 86 86 ALA C C 86 175.560 177.100 -1.540 1
1 1005 . 5 1 1 A 86 86 ALA CA C 86 52.156 53.203 -1.047 1
1 1006 . 5 1 1 A 86 86 ALA CB C 86 20.378 20.320 0.058 1
1 1007 . 5 1 1 A 86 86 ALA N N 86 127.705 127.028 0.677 1
1 1008 . 5 1 1 A 87 87 ILE H H 87 7.663 7.624 0.039 1
1 1009 . 5 1 1 A 87 87 ILE HA H 87 4.828 4.637 0.191 1
1 1019 . 5 1 1 A 87 87 ILE C C 87 174.537 174.244 0.293 1
1 1020 . 5 1 1 A 87 87 ILE CA C 87 60.329 59.913 0.416 1
1 1021 . 5 1 1 A 87 87 ILE CB C 87 41.090 40.542 0.548 1
1 1025 . 5 1 1 A 87 87 ILE N N 87 118.712 117.237 1.475 1
1 1026 . 5 1 1 A 88 88 HIS H H 88 9.098 8.706 0.392 1
1 1027 . 5 1 1 A 88 88 HIS HA H 88 4.576 5.314 -0.738 1
1 1032 . 5 1 1 A 88 88 HIS C C 88 174.354 174.499 -0.145 1
1 1033 . 5 1 1 A 88 88 HIS CA C 88 54.740 54.529 0.211 1
1 1034 . 5 1 1 A 88 88 HIS CB C 88 33.955 32.686 1.269 1
1 1037 . 5 1 1 A 88 88 HIS N N 88 126.285 125.623 0.662 1
1 1038 . 5 1 1 A 89 89 LYS H H 89 8.957 8.980 -0.023 1
1 1039 . 5 1 1 A 89 89 LYS HA H 89 4.873 4.779 0.094 1
1 1048 . 5 1 1 A 89 89 LYS C C 89 175.906 175.505 0.401 1
1 1049 . 5 1 1 A 89 89 LYS CA C 89 55.269 55.190 0.079 1
1 1050 . 5 1 1 A 89 89 LYS CB C 89 32.945 34.186 -1.241 1
1 1054 . 5 1 1 A 89 89 LYS N N 89 124.332 122.098 2.234 1
1 1055 . 5 1 1 A 90 90 VAL H H 90 9.174 8.620 0.554 1
1 1056 . 5 1 1 A 90 90 VAL HA H 90 4.227 4.919 -0.692 1
1 1064 . 5 1 1 A 90 90 VAL C C 90 174.168 174.757 -0.589 1
1 1065 . 5 1 1 A 90 90 VAL CA C 90 61.369 61.093 0.276 1
1 1066 . 5 1 1 A 90 90 VAL CB C 90 34.082 34.364 -0.282 1
1 1069 . 5 1 1 A 90 90 VAL N N 90 124.319 125.855 -1.536 1
1 1070 . 5 1 1 A 91 91 THR H H 91 6.697 9.061 -2.364 1
1 1071 . 5 1 1 A 91 91 THR HA H 91 5.163 5.039 0.124 1
1 1076 . 5 1 1 A 91 91 THR C C 91 173.812 173.751 0.061 1
1 1077 . 5 1 1 A 91 91 THR CA C 91 61.935 61.616 0.319 1
1 1078 . 5 1 1 A 91 91 THR CB C 91 70.412 70.267 0.145 1
1 1080 . 5 1 1 A 91 91 THR N N 91 122.637 124.264 -1.627 1
1 1081 . 5 1 1 A 92 92 VAL H H 92 9.292 8.694 0.598 1
1 1082 . 5 1 1 A 92 92 VAL HA H 92 4.736 4.974 -0.238 1
1 1090 . 5 1 1 A 92 92 VAL C C 92 173.160 175.030 -1.870 1
1 1091 . 5 1 1 A 92 92 VAL CA C 92 60.982 60.591 0.391 1
1 1092 . 5 1 1 A 92 92 VAL CB C 92 35.130 34.407 0.723 1
1 1095 . 5 1 1 A 92 92 VAL N N 92 128.265 127.460 0.805 1
1 1096 . 5 1 1 A 93 93 LEU H H 93 9.495 8.838 0.657 1
1 1097 . 5 1 1 A 93 93 LEU HA H 93 5.628 5.679 -0.051 1
1 1107 . 5 1 1 A 93 93 LEU C C 93 176.274 176.452 -0.178 1
1 1108 . 5 1 1 A 93 93 LEU CA C 93 52.773 53.383 -0.610 1
1 1109 . 5 1 1 A 93 93 LEU CB C 93 43.454 45.051 -1.597 1
1 1113 . 5 1 1 A 93 93 LEU N N 93 126.350 126.977 -0.627 1
1 1114 . 5 1 1 A 94 94 ALA H H 94 8.688 8.628 0.060 1
1 1115 . 5 1 1 A 94 94 ALA HA H 94 4.986 5.027 -0.041 1
1 1119 . 5 1 1 A 94 94 ALA C C 94 175.787 175.983 -0.196 1
1 1120 . 5 1 1 A 94 94 ALA CA C 94 49.610 50.847 -1.237 1
1 1121 . 5 1 1 A 94 94 ALA CB C 94 21.463 21.324 0.139 1
1 1122 . 5 1 1 A 94 94 ALA N N 94 123.429 124.032 -0.603 1
1 1123 . 5 1 1 A 95 95 SER H H 95 8.401 8.626 -0.225 1
1 1124 . 5 1 1 A 95 95 SER HA H 95 4.828 5.292 -0.464 1
1 1127 . 5 1 1 A 95 95 SER C C 95 174.327 174.044 0.283 1
1 1128 . 5 1 1 A 95 95 SER CA C 95 56.239 56.106 0.133 1
1 1129 . 5 1 1 A 95 95 SER CB C 95 65.561 65.162 0.399 1
1 1130 . 5 1 1 A 95 95 SER N N 95 114.418 116.736 -2.318 1
1 1131 . 5 1 1 A 96 96 ASP H H 96 8.690 9.092 -0.402 1
1 1132 . 5 1 1 A 96 96 ASP HA H 96 4.908 4.652 0.256 1
1 1135 . 5 1 1 A 96 96 ASP C C 96 177.096 175.844 1.252 1
1 1136 . 5 1 1 A 96 96 ASP CA C 96 52.818 55.263 -2.445 1
1 1137 . 5 1 1 A 96 96 ASP CB C 96 41.253 42.995 -1.742 1
1 1138 . 5 1 1 A 96 96 ASP N N 96 125.624 123.796 1.828 1
1 1139 . 5 1 1 A 97 97 GLY H H 97 8.524 7.306 1.218 1
1 1140 . 5 1 1 A 97 97 GLY HA2 H 97 4.320 4.040 0.280 1
1 1141 . 5 1 1 A 97 97 GLY HA3 H 97 3.620 4.041 -0.421 1
1 1142 . 5 1 1 A 97 97 GLY C C 97 174.620 173.062 1.558 1
1 1143 . 5 1 1 A 97 97 GLY CA C 97 45.422 45.472 -0.050 1
1 1144 . 5 1 1 A 97 97 GLY N N 97 109.283 106.353 2.930 1
1 1145 . 5 1 1 A 98 98 SER H H 98 8.575 8.897 -0.322 1
1 1146 . 5 1 1 A 98 98 SER HA H 98 4.607 3.984 0.623 1
1 1149 . 5 1 1 A 98 98 SER C C 98 174.478 172.804 1.674 1
1 1150 . 5 1 1 A 98 98 SER CA C 98 59.095 59.089 0.006 1
1 1151 . 5 1 1 A 98 98 SER CB C 98 64.800 61.516 3.284 1
1 1152 . 5 1 1 A 98 98 SER N N 98 116.640 116.798 -0.158 1
1 1153 . 5 1 1 A 99 99 SER H H 99 8.945 7.701 1.244 1
1 1154 . 5 1 1 A 99 99 SER HA H 99 4.530 4.612 -0.082 1
1 1157 . 5 1 1 A 99 99 SER C C 99 174.491 172.596 1.895 1
1 1158 . 5 1 1 A 99 99 SER CA C 99 58.460 57.373 1.087 1
1 1159 . 5 1 1 A 99 99 SER CB C 99 64.146 64.976 -0.830 1
1 1160 . 5 1 1 A 99 99 SER N N 99 117.676 114.178 3.498 1
1 1161 . 5 1 1 A 100 100 THR H H 100 8.411 8.436 -0.025 1
1 1162 . 5 1 1 A 100 100 THR HA H 100 4.490 4.607 -0.117 1
1 1167 . 5 1 1 A 100 100 THR C C 100 172.766 173.693 -0.927 1
1 1168 . 5 1 1 A 100 100 THR CA C 100 60.629 60.316 0.313 1
1 1169 . 5 1 1 A 100 100 THR CB C 100 69.778 68.785 0.993 1
1 1171 . 5 1 1 A 100 100 THR N N 100 118.401 117.296 1.105 1
1 1172 . 5 1 1 A 101 101 PRO HA H 101 4.631 4.845 -0.214 1
1 1179 . 5 1 1 A 101 101 PRO C C 101 177.227 175.462 1.765 1
1 1180 . 5 1 1 A 101 101 PRO CA C 101 63.097 62.129 0.968 1
1 1181 . 5 1 1 A 101 101 PRO CB C 101 32.917 32.252 0.665 1
1 1184 . 5 1 1 A 102 102 ALA H H 102 8.497 8.012 0.485 1
1 1185 . 5 1 1 A 102 102 ALA HA H 102 4.619 4.734 -0.115 1
1 1189 . 5 1 1 A 102 102 ALA C C 102 176.542 177.333 -0.791 1
1 1190 . 5 1 1 A 102 102 ALA CA C 102 51.390 51.541 -0.151 1
1 1191 . 5 1 1 A 102 102 ALA CB C 102 20.815 20.938 -0.123 1
1 1192 . 5 1 1 A 102 102 ALA N N 102 124.487 123.484 1.003 1
1 1193 . 5 1 1 A 103 103 ARG H H 103 8.663 9.244 -0.581 1
1 1194 . 5 1 1 A 103 103 ARG HA H 103 5.515 5.226 0.289 1
1 1201 . 5 1 1 A 103 103 ARG C C 103 174.539 174.896 -0.357 1
1 1202 . 5 1 1 A 103 103 ARG CA C 103 55.164 54.599 0.565 1
1 1203 . 5 1 1 A 103 103 ARG CB C 103 34.393 33.544 0.849 1
1 1206 . 5 1 1 A 103 103 ARG N N 103 119.596 117.536 2.060 1
1 1207 . 5 1 1 A 104 104 ALA H H 104 9.027 8.495 0.532 1
1 1208 . 5 1 1 A 104 104 ALA HA H 104 4.782 4.969 -0.187 1
1 1212 . 5 1 1 A 104 104 ALA C C 104 176.276 175.336 0.940 1
1 1213 . 5 1 1 A 104 104 ALA CA C 104 50.297 50.225 0.072 1
1 1214 . 5 1 1 A 104 104 ALA CB C 104 20.810 20.819 -0.009 1
1 1215 . 5 1 1 A 104 104 ALA N N 104 126.962 123.659 3.303 1
1 1216 . 5 1 1 A 105 105 THR H H 105 8.384 8.722 -0.338 1
1 1217 . 5 1 1 A 105 105 THR HA H 105 4.954 4.645 0.309 1
1 1222 . 5 1 1 A 105 105 THR C C 105 173.243 174.094 -0.851 1
1 1223 . 5 1 1 A 105 105 THR CA C 105 61.475 62.264 -0.789 1
1 1224 . 5 1 1 A 105 105 THR CB C 105 70.569 69.279 1.290 1
1 1226 . 5 1 1 A 105 105 THR N N 105 115.327 118.544 -3.217 1
1 1227 . 5 1 1 A 106 106 VAL H H 106 8.970 8.730 0.240 1
1 1228 . 5 1 1 A 106 106 VAL HA H 106 4.702 4.705 -0.003 1
1 1236 . 5 1 1 A 106 106 VAL C C 106 174.743 174.818 -0.075 1
1 1237 . 5 1 1 A 106 106 VAL CA C 106 59.712 60.298 -0.586 1
1 1238 . 5 1 1 A 106 106 VAL CB C 106 34.327 33.789 0.538 1
1 1241 . 5 1 1 A 106 106 VAL N N 106 126.226 128.022 -1.796 1
1 1242 . 5 1 1 A 107 107 THR H H 107 8.833 8.610 0.223 1
1 1243 . 5 1 1 A 107 107 THR HA H 107 4.862 4.848 0.014 1
1 1248 . 5 1 1 A 107 107 THR C C 107 172.970 173.731 -0.761 1
1 1249 . 5 1 1 A 107 107 THR CA C 107 62.322 62.101 0.221 1
1 1250 . 5 1 1 A 107 107 THR CB C 107 69.463 69.571 -0.108 1
1 1252 . 5 1 1 A 107 107 THR N N 107 125.403 123.729 1.674 1
1 1253 . 5 1 1 A 108 108 ILE H H 108 9.234 8.930 0.304 1
1 1254 . 5 1 1 A 108 108 ILE HA H 108 4.178 4.526 -0.348 1
1 1264 . 5 1 1 A 108 108 ILE C C 108 174.087 174.993 -0.906 1
1 1265 . 5 1 1 A 108 108 ILE CA C 108 60.365 60.424 -0.059 1
1 1266 . 5 1 1 A 108 108 ILE CB C 108 39.745 37.865 1.880 1
1 1270 . 5 1 1 A 108 108 ILE N N 108 127.152 128.672 -1.520 1
1 1271 . 5 1 1 A 109 109 ASN H H 109 8.723 8.525 0.198 1
1 1272 . 5 1 1 A 109 109 ASN HA H 109 5.147 5.195 -0.048 1
1 1277 . 5 1 1 A 109 109 ASN C C 109 173.592 174.824 -1.232 1
1 1278 . 5 1 1 A 109 109 ASN CA C 109 52.501 53.206 -0.705 1
1 1279 . 5 1 1 A 109 109 ASN CB C 109 40.791 39.557 1.234 1
1 1280 . 5 1 1 A 109 109 ASN N N 109 126.866 126.136 0.730 1
1 1282 . 5 1 1 A 110 110 VAL H H 110 9.046 8.649 0.397 1
1 1283 . 5 1 1 A 110 110 VAL HA H 110 5.081 4.858 0.223 1
1 1291 . 5 1 1 A 110 110 VAL C C 110 176.921 176.233 0.688 1
1 1292 . 5 1 1 A 110 110 VAL CA C 110 61.634 62.110 -0.476 1
1 1293 . 5 1 1 A 110 110 VAL CB C 110 31.809 32.080 -0.271 1
1 1296 . 5 1 1 A 110 110 VAL N N 110 126.070 125.565 0.505 1
1 1297 . 5 1 1 A 111 111 THR H H 111 9.197 8.888 0.309 1
1 1298 . 5 1 1 A 111 111 THR HA H 111 4.566 4.913 -0.347 1
1 1303 . 5 1 1 A 111 111 THR C C 111 174.087 174.652 -0.565 1
1 1304 . 5 1 1 A 111 111 THR CA C 111 61.145 60.420 0.725 1
1 1305 . 5 1 1 A 111 111 THR CB C 111 70.706 71.389 -0.683 1
1 1307 . 5 1 1 A 111 111 THR N N 111 121.425 118.890 2.535 1
1 1308 . 5 1 1 A 112 112 ASP H H 112 8.435 8.601 -0.166 1
1 1309 . 5 1 1 A 112 112 ASP HA H 112 4.656 5.157 -0.501 1
1 1312 . 5 1 1 A 112 112 ASP C C 112 176.745 175.195 1.550 1
1 1313 . 5 1 1 A 112 112 ASP CA C 112 54.158 53.885 0.273 1
1 1314 . 5 1 1 A 112 112 ASP CB C 112 41.575 41.956 -0.381 1
1 1315 . 5 1 1 A 112 112 ASP N N 112 119.566 121.121 -1.555 1
1 1316 . 5 1 1 A 113 113 VAL H H 113 8.629 8.457 0.172 1
1 1317 . 5 1 1 A 113 113 VAL HA H 113 4.078 4.744 -0.666 1
1 1325 . 5 1 1 A 113 113 VAL C C 113 175.247 174.951 0.296 1
1 1326 . 5 1 1 A 113 113 VAL CA C 113 62.533 59.463 3.070 1
1 1327 . 5 1 1 A 113 113 VAL CB C 113 32.534 35.310 -2.776 1
1 1330 . 5 1 1 A 113 113 VAL N N 113 119.356 115.641 3.715 1
1 4 . 6 1 1 A 2 2 SER H H 2 8.289 8.859 -0.570 1
1 5 . 6 1 1 A 2 2 SER HA H 2 4.530 5.019 -0.489 1
1 7 . 6 1 1 A 2 2 SER C C 2 174.868 173.949 0.919 1
1 8 . 6 1 1 A 2 2 SER CA C 2 58.284 55.814 2.470 1
1 9 . 6 1 1 A 2 2 SER CB C 2 63.769 65.838 -2.069 1
1 10 . 6 1 1 A 2 2 SER N N 2 115.842 117.901 -2.059 1
1 11 . 6 1 1 A 3 3 SER H H 3 8.490 9.176 -0.686 1
1 12 . 6 1 1 A 3 3 SER HA H 3 4.496 4.042 0.454 1
1 14 . 6 1 1 A 3 3 SER C C 3 175.043 173.308 1.735 1
1 15 . 6 1 1 A 3 3 SER CA C 3 58.549 59.211 -0.662 1
1 16 . 6 1 1 A 3 3 SER CB C 3 63.687 62.105 1.582 1
1 17 . 6 1 1 A 3 3 SER N N 3 117.930 122.286 -4.356 1
1 18 . 6 1 1 A 4 4 GLY H H 4 8.482 7.787 0.695 1
1 19 . 6 1 1 A 4 4 GLY C C 4 174.344 173.376 0.968 1
1 20 . 6 1 1 A 4 4 GLY CA C 4 45.536 45.689 -0.153 1
1 21 . 6 1 1 A 4 4 GLY N N 4 110.985 107.504 3.481 1
1 22 . 6 1 1 A 6 6 SER HA H 6 4.508 4.462 0.046 1
1 24 . 6 1 1 A 6 6 SER C C 6 175.026 174.619 0.407 1
1 25 . 6 1 1 A 6 6 SER CA C 6 58.584 58.442 0.142 1
1 26 . 6 1 1 A 6 6 SER CB C 6 63.646 64.272 -0.626 1
1 27 . 6 1 1 A 7 7 GLY H H 7 8.419 8.652 -0.233 1
1 28 . 6 1 1 A 7 7 GLY HA2 H 7 3.993 4.100 -0.107 1
1 29 . 6 1 1 A 7 7 GLY C C 7 173.995 172.832 1.163 1
1 30 . 6 1 1 A 7 7 GLY CA C 7 45.466 44.664 0.802 1
1 31 . 6 1 1 A 7 7 GLY N N 7 110.615 110.507 0.108 1
1 32 . 6 1 1 A 8 8 ASN H H 8 8.322 8.624 -0.302 1
1 33 . 6 1 1 A 8 8 ASN HA H 8 4.736 5.133 -0.397 1
1 38 . 6 1 1 A 8 8 ASN C C 8 174.907 174.099 0.808 1
1 39 . 6 1 1 A 8 8 ASN CA C 8 53.259 51.283 1.976 1
1 40 . 6 1 1 A 8 8 ASN CB C 8 39.127 42.410 -3.283 1
1 41 . 6 1 1 A 8 8 ASN N N 8 118.602 119.011 -0.409 1
1 43 . 6 1 1 A 9 9 ASP H H 9 8.370 8.730 -0.360 1
1 44 . 6 1 1 A 9 9 ASP HA H 9 4.594 4.068 0.526 1
1 47 . 6 1 1 A 9 9 ASP C C 9 175.765 175.845 -0.080 1
1 48 . 6 1 1 A 9 9 ASP CA C 9 54.440 55.081 -0.641 1
1 49 . 6 1 1 A 9 9 ASP CB C 9 40.898 39.239 1.659 1
1 50 . 6 1 1 A 9 9 ASP N N 9 120.504 117.160 3.344 1
1 51 . 6 1 1 A 10 10 ASN H H 10 8.382 8.157 0.225 1
1 52 . 6 1 1 A 10 10 ASN HA H 10 4.691 4.894 -0.203 1
1 57 . 6 1 1 A 10 10 ASN C C 10 174.383 174.770 -0.387 1
1 58 . 6 1 1 A 10 10 ASN CA C 10 53.241 52.381 0.860 1
1 59 . 6 1 1 A 10 10 ASN CB C 10 38.674 36.864 1.810 1
1 60 . 6 1 1 A 10 10 ASN N N 10 119.406 116.912 2.494 1
1 62 . 6 1 1 A 11 11 ARG H H 11 7.942 7.432 0.510 1
1 63 . 6 1 1 A 11 11 ARG HA H 11 4.684 4.497 0.187 1
1 70 . 6 1 1 A 11 11 ARG C C 11 173.640 175.604 -1.964 1
1 71 . 6 1 1 A 11 11 ARG CA C 11 54.246 55.096 -0.850 1
1 72 . 6 1 1 A 11 11 ARG CB C 11 30.337 30.450 -0.113 1
1 75 . 6 1 1 A 11 11 ARG N N 11 121.145 119.261 1.884 1
1 76 . 6 1 1 A 12 12 PRO HA H 12 4.507 4.554 -0.047 1
1 83 . 6 1 1 A 12 12 PRO CA C 12 62.714 62.302 0.412 1
1 84 . 6 1 1 A 12 12 PRO CB C 12 31.942 32.751 -0.809 1
1 87 . 6 1 1 A 13 13 VAL H H 13 8.252 8.318 -0.066 1
1 88 . 6 1 1 A 13 13 VAL HA H 13 4.159 4.593 -0.434 1
1 96 . 6 1 1 A 13 13 VAL CA C 13 61.409 59.491 1.918 1
1 97 . 6 1 1 A 13 13 VAL CB C 13 34.858 35.562 -0.704 1
1 100 . 6 1 1 A 13 13 VAL N N 13 118.395 120.438 -2.043 1
1 101 . 6 1 1 A 14 14 PHE H H 14 8.725 8.885 -0.160 1
1 102 . 6 1 1 A 14 14 PHE HA H 14 4.781 4.847 -0.066 1
1 110 . 6 1 1 A 14 14 PHE CA C 14 58.594 56.671 1.923 1
1 111 . 6 1 1 A 14 14 PHE CB C 14 39.594 37.364 2.230 1
1 117 . 6 1 1 A 14 14 PHE N N 14 122.950 127.712 -4.762 1
1 118 . 6 1 1 A 15 15 LYS H H 15 8.885 8.632 0.253 1
1 119 . 6 1 1 A 15 15 LYS HA H 15 4.130 3.932 0.198 1
1 128 . 6 1 1 A 15 15 LYS C C 15 177.027 177.392 -0.365 1
1 129 . 6 1 1 A 15 15 LYS CA C 15 58.478 58.374 0.104 1
1 130 . 6 1 1 A 15 15 LYS CB C 15 32.748 32.286 0.462 1
1 134 . 6 1 1 A 15 15 LYS N N 15 123.863 125.981 -2.118 1
1 135 . 6 1 1 A 16 16 GLU H H 16 8.091 9.207 -1.116 1
1 136 . 6 1 1 A 16 16 GLU HA H 16 4.438 4.028 0.410 1
1 141 . 6 1 1 A 16 16 GLU C C 16 175.947 177.239 -1.292 1
1 142 . 6 1 1 A 16 16 GLU CA C 16 56.045 57.602 -1.557 1
1 143 . 6 1 1 A 16 16 GLU CB C 16 30.766 27.308 3.458 1
1 145 . 6 1 1 A 16 16 GLU N N 16 117.026 122.041 -5.015 1
1 146 . 6 1 1 A 17 17 GLY H H 17 8.421 7.878 0.543 1
1 147 . 6 1 1 A 17 17 GLY HA2 H 17 3.993 3.807 0.186 1
1 148 . 6 1 1 A 17 17 GLY HA3 H 17 3.913 3.813 0.100 1
1 149 . 6 1 1 A 17 17 GLY C C 17 173.564 175.441 -1.877 1
1 150 . 6 1 1 A 17 17 GLY CA C 17 45.448 47.306 -1.858 1
1 151 . 6 1 1 A 17 17 GLY N N 17 109.577 106.908 2.669 1
1 152 . 6 1 1 A 18 18 GLN H H 18 7.858 8.046 -0.188 1
1 153 . 6 1 1 A 18 18 GLN HA H 18 5.065 4.704 0.361 1
1 160 . 6 1 1 A 18 18 GLN C C 18 174.596 175.904 -1.308 1
1 161 . 6 1 1 A 18 18 GLN CA C 18 55.110 56.124 -1.014 1
1 162 . 6 1 1 A 18 18 GLN CB C 18 30.329 29.238 1.091 1
1 164 . 6 1 1 A 18 18 GLN N N 18 120.202 120.750 -0.548 1
1 166 . 6 1 1 A 19 19 VAL H H 19 8.216 8.542 -0.326 1
1 167 . 6 1 1 A 19 19 VAL HA H 19 4.450 4.694 -0.244 1
1 175 . 6 1 1 A 19 19 VAL C C 19 173.648 173.442 0.206 1
1 176 . 6 1 1 A 19 19 VAL CA C 19 60.788 59.884 0.904 1
1 177 . 6 1 1 A 19 19 VAL CB C 19 35.336 35.661 -0.325 1
1 180 . 6 1 1 A 19 19 VAL N N 19 121.257 123.830 -2.573 1
1 181 . 6 1 1 A 20 20 GLU H H 20 8.610 8.930 -0.320 1
1 182 . 6 1 1 A 20 20 GLU HA H 20 5.211 5.286 -0.075 1
1 187 . 6 1 1 A 20 20 GLU C C 20 174.783 175.111 -0.328 1
1 188 . 6 1 1 A 20 20 GLU CA C 20 54.793 54.827 -0.034 1
1 189 . 6 1 1 A 20 20 GLU CB C 20 32.058 33.477 -1.419 1
1 191 . 6 1 1 A 20 20 GLU N N 20 127.095 126.397 0.698 1
1 192 . 6 1 1 A 21 21 VAL H H 21 8.727 8.344 0.383 1
1 193 . 6 1 1 A 21 21 VAL HA H 21 4.633 4.979 -0.346 1
1 201 . 6 1 1 A 21 21 VAL C C 21 173.894 174.636 -0.742 1
1 202 . 6 1 1 A 21 21 VAL CA C 21 59.695 58.891 0.804 1
1 203 . 6 1 1 A 21 21 VAL CB C 21 35.865 35.803 0.062 1
1 206 . 6 1 1 A 21 21 VAL N N 21 120.489 119.108 1.381 1
1 207 . 6 1 1 A 22 22 HIS H H 22 8.680 8.886 -0.206 1
1 208 . 6 1 1 A 22 22 HIS HA H 22 5.552 5.147 0.405 1
1 212 . 6 1 1 A 22 22 HIS C C 22 174.298 173.502 0.796 1
1 213 . 6 1 1 A 22 22 HIS CA C 22 55.331 54.396 0.935 1
1 214 . 6 1 1 A 22 22 HIS CB C 22 32.369 31.719 0.650 1
1 216 . 6 1 1 A 22 22 HIS N N 22 124.991 119.169 5.822 1
1 217 . 6 1 1 A 23 23 ILE H H 23 9.179 9.031 0.148 1
1 218 . 6 1 1 A 23 23 ILE HA H 23 5.046 4.809 0.237 1
1 228 . 6 1 1 A 23 23 ILE C C 23 171.552 174.170 -2.618 1
1 229 . 6 1 1 A 23 23 ILE CA C 23 55.551 57.282 -1.731 1
1 230 . 6 1 1 A 23 23 ILE CB C 23 42.053 41.591 0.462 1
1 234 . 6 1 1 A 23 23 ILE N N 23 123.121 124.139 -1.018 1
1 235 . 6 1 1 A 24 24 PRO HA H 24 4.816 4.664 0.152 1
1 242 . 6 1 1 A 24 24 PRO C C 24 178.887 177.922 0.965 1
1 243 . 6 1 1 A 24 24 PRO CA C 24 62.216 62.685 -0.469 1
1 244 . 6 1 1 A 24 24 PRO CB C 24 32.895 32.724 0.171 1
1 247 . 6 1 1 A 25 25 GLU H H 25 8.399 8.228 0.171 1
1 248 . 6 1 1 A 25 25 GLU HA H 25 3.785 4.070 -0.285 1
1 253 . 6 1 1 A 25 25 GLU C C 25 175.244 177.474 -2.230 1
1 254 . 6 1 1 A 25 25 GLU CA C 25 58.425 59.426 -1.001 1
1 255 . 6 1 1 A 25 25 GLU CB C 25 30.011 28.991 1.020 1
1 257 . 6 1 1 A 25 25 GLU N N 25 117.706 122.603 -4.897 1
1 258 . 6 1 1 A 26 26 ASN H H 26 7.488 7.687 -0.199 1
1 259 . 6 1 1 A 26 26 ASN HA H 26 4.702 4.806 -0.104 1
1 264 . 6 1 1 A 26 26 ASN C C 26 175.425 175.325 0.100 1
1 265 . 6 1 1 A 26 26 ASN CA C 26 51.584 53.413 -1.829 1
1 266 . 6 1 1 A 26 26 ASN CB C 26 37.243 38.637 -1.394 1
1 267 . 6 1 1 A 26 26 ASN N N 26 112.383 116.275 -3.892 1
1 269 . 6 1 1 A 27 27 ALA H H 27 7.716 7.432 0.284 1
1 270 . 6 1 1 A 27 27 ALA HA H 27 4.409 4.300 0.109 1
1 274 . 6 1 1 A 27 27 ALA C C 27 175.850 175.830 0.020 1
1 275 . 6 1 1 A 27 27 ALA CA C 27 51.037 51.186 -0.149 1
1 276 . 6 1 1 A 27 27 ALA CB C 27 18.152 18.612 -0.460 1
1 277 . 6 1 1 A 27 27 ALA N N 27 125.139 123.587 1.552 1
1 278 . 6 1 1 A 28 28 PRO HA H 28 4.422 4.546 -0.124 1
1 285 . 6 1 1 A 28 28 PRO C C 28 178.442 177.178 1.264 1
1 286 . 6 1 1 A 28 28 PRO CA C 28 62.067 62.856 -0.789 1
1 287 . 6 1 1 A 28 28 PRO CB C 28 32.642 32.329 0.313 1
1 290 . 6 1 1 A 29 29 VAL H H 29 8.691 8.345 0.346 1
1 291 . 6 1 1 A 29 29 VAL HA H 29 3.239 3.574 -0.335 1
1 299 . 6 1 1 A 29 29 VAL C C 29 176.887 177.210 -0.323 1
1 300 . 6 1 1 A 29 29 VAL CA C 29 65.812 64.233 1.579 1
1 301 . 6 1 1 A 29 29 VAL CB C 29 31.174 31.435 -0.261 1
1 304 . 6 1 1 A 29 29 VAL N N 29 123.592 122.631 0.961 1
1 305 . 6 1 1 A 30 30 GLY H H 30 9.197 8.713 0.484 1
1 306 . 6 1 1 A 30 30 GLY HA2 H 30 4.486 3.952 0.534 1
1 307 . 6 1 1 A 30 30 GLY HA3 H 30 3.581 3.953 -0.372 1
1 308 . 6 1 1 A 30 30 GLY C C 30 174.347 174.550 -0.203 1
1 309 . 6 1 1 A 30 30 GLY CA C 30 44.320 45.078 -0.758 1
1 310 . 6 1 1 A 30 30 GLY N N 30 116.042 115.286 0.756 1
1 311 . 6 1 1 A 31 31 THR H H 31 7.838 7.808 0.030 1
1 312 . 6 1 1 A 31 31 THR HA H 31 3.959 4.185 -0.226 1
1 317 . 6 1 1 A 31 31 THR C C 31 174.274 173.614 0.660 1
1 318 . 6 1 1 A 31 31 THR CA C 31 65.160 63.381 1.779 1
1 319 . 6 1 1 A 31 31 THR CB C 31 69.972 69.001 0.971 1
1 321 . 6 1 1 A 31 31 THR N N 31 117.679 118.251 -0.572 1
1 322 . 6 1 1 A 32 32 SER H H 32 9.022 8.754 0.268 1
1 323 . 6 1 1 A 32 32 SER HA H 32 4.273 4.613 -0.340 1
1 326 . 6 1 1 A 32 32 SER C C 32 172.692 174.492 -1.800 1
1 327 . 6 1 1 A 32 32 SER CA C 32 59.642 57.858 1.784 1
1 328 . 6 1 1 A 32 32 SER CB C 32 63.102 63.647 -0.545 1
1 329 . 6 1 1 A 32 32 SER N N 32 123.045 121.799 1.246 1
1 330 . 6 1 1 A 33 33 VAL H H 33 9.202 8.856 0.346 1
1 331 . 6 1 1 A 33 33 VAL HA H 33 3.844 4.034 -0.190 1
1 339 . 6 1 1 A 33 33 VAL C C 33 174.782 175.877 -1.095 1
1 340 . 6 1 1 A 33 33 VAL CA C 33 64.242 64.139 0.103 1
1 341 . 6 1 1 A 33 33 VAL CB C 33 32.893 32.677 0.216 1
1 344 . 6 1 1 A 33 33 VAL N N 33 126.861 128.869 -2.008 1
1 345 . 6 1 1 A 34 34 ILE H H 34 7.074 7.891 -0.817 1
1 346 . 6 1 1 A 34 34 ILE HA H 34 4.295 4.700 -0.405 1
1 356 . 6 1 1 A 34 34 ILE C C 34 170.577 173.359 -2.782 1
1 357 . 6 1 1 A 34 34 ILE CA C 34 59.500 59.281 0.219 1
1 358 . 6 1 1 A 34 34 ILE CB C 34 39.251 42.086 -2.835 1
1 362 . 6 1 1 A 34 34 ILE N N 34 111.445 119.311 -7.866 1
1 363 . 6 1 1 A 35 35 GLN H H 35 8.450 8.799 -0.349 1
1 364 . 6 1 1 A 35 35 GLN HA H 35 4.633 5.106 -0.473 1
1 371 . 6 1 1 A 35 35 GLN C C 35 174.354 174.067 0.287 1
1 372 . 6 1 1 A 35 35 GLN CA C 35 54.176 54.085 0.091 1
1 373 . 6 1 1 A 35 35 GLN CB C 35 29.456 32.257 -2.801 1
1 375 . 6 1 1 A 35 35 GLN N N 35 127.342 126.715 0.627 1
1 377 . 6 1 1 A 36 36 LEU H H 36 7.761 8.435 -0.674 1
1 378 . 6 1 1 A 36 36 LEU HA H 36 4.492 5.141 -0.649 1
1 388 . 6 1 1 A 36 36 LEU C C 36 175.543 175.446 0.097 1
1 389 . 6 1 1 A 36 36 LEU CA C 36 53.982 53.707 0.275 1
1 390 . 6 1 1 A 36 36 LEU CB C 36 42.776 44.248 -1.472 1
1 394 . 6 1 1 A 36 36 LEU N N 36 128.895 128.123 0.772 1
1 395 . 6 1 1 A 37 37 HIS H H 37 8.529 9.013 -0.484 1
1 396 . 6 1 1 A 37 37 HIS HA H 37 4.851 5.307 -0.456 1
1 400 . 6 1 1 A 37 37 HIS C C 37 172.985 173.370 -0.385 1
1 401 . 6 1 1 A 37 37 HIS CA C 37 55.833 53.784 2.049 1
1 402 . 6 1 1 A 37 37 HIS CB C 37 32.204 32.748 -0.544 1
1 404 . 6 1 1 A 37 37 HIS N N 37 115.903 124.471 -8.568 1
1 405 . 6 1 1 A 38 38 ALA H H 38 8.474 9.024 -0.550 1
1 406 . 6 1 1 A 38 38 ALA HA H 38 4.691 5.021 -0.330 1
1 410 . 6 1 1 A 38 38 ALA C C 38 175.548 175.767 -0.219 1
1 411 . 6 1 1 A 38 38 ALA CA C 38 50.491 50.638 -0.147 1
1 412 . 6 1 1 A 38 38 ALA CB C 38 19.842 20.394 -0.552 1
1 413 . 6 1 1 A 38 38 ALA N N 38 128.891 130.834 -1.943 1
1 414 . 6 1 1 A 39 39 THR H H 39 8.095 8.954 -0.859 1
1 415 . 6 1 1 A 39 39 THR HA H 39 4.336 5.039 -0.703 1
1 420 . 6 1 1 A 39 39 THR C C 39 173.553 172.411 1.142 1
1 421 . 6 1 1 A 39 39 THR CA C 39 60.417 59.976 0.441 1
1 422 . 6 1 1 A 39 39 THR CB C 39 70.912 71.624 -0.712 1
1 424 . 6 1 1 A 39 39 THR N N 39 110.982 113.846 -2.864 1
1 425 . 6 1 1 A 40 40 ASP H H 40 8.417 8.839 -0.422 1
1 426 . 6 1 1 A 40 40 ASP HA H 40 4.553 4.692 -0.139 1
1 429 . 6 1 1 A 40 40 ASP C C 40 176.462 176.594 -0.132 1
1 430 . 6 1 1 A 40 40 ASP CA C 40 54.158 53.591 0.567 1
1 431 . 6 1 1 A 40 40 ASP CB C 40 41.517 39.820 1.697 1
1 432 . 6 1 1 A 40 40 ASP N N 40 121.450 123.125 -1.675 1
1 433 . 6 1 1 A 41 41 ALA H H 41 8.435 8.120 0.315 1
1 434 . 6 1 1 A 41 41 ALA HA H 41 4.129 3.973 0.156 1
1 438 . 6 1 1 A 41 41 ALA C C 41 177.718 178.542 -0.824 1
1 439 . 6 1 1 A 41 41 ALA CA C 41 53.436 55.204 -1.768 1
1 440 . 6 1 1 A 41 41 ALA CB C 41 19.183 18.509 0.674 1
1 441 . 6 1 1 A 41 41 ALA N N 41 124.607 127.554 -2.947 1
1 442 . 6 1 1 A 42 42 ASP H H 42 8.310 7.960 0.350 1
1 443 . 6 1 1 A 42 42 ASP HA H 42 4.588 4.637 -0.049 1
1 446 . 6 1 1 A 42 42 ASP C C 42 176.546 175.504 1.042 1
1 447 . 6 1 1 A 42 42 ASP CA C 42 54.599 52.784 1.815 1
1 448 . 6 1 1 A 42 42 ASP CB C 42 41.146 38.658 2.488 1
1 449 . 6 1 1 A 42 42 ASP N N 42 118.030 116.324 1.706 1
1 450 . 6 1 1 A 43 43 ILE H H 43 8.000 7.899 0.101 1
1 451 . 6 1 1 A 43 43 ILE HA H 43 4.130 4.073 0.057 1
1 461 . 6 1 1 A 43 43 ILE C C 43 176.901 176.031 0.870 1
1 462 . 6 1 1 A 43 43 ILE CA C 43 61.740 61.447 0.293 1
1 463 . 6 1 1 A 43 43 ILE CB C 43 38.491 38.077 0.414 1
1 467 . 6 1 1 A 43 43 ILE N N 43 119.301 119.029 0.272 1
1 468 . 6 1 1 A 44 44 GLY H H 44 8.448 8.158 0.290 1
1 469 . 6 1 1 A 44 44 GLY HA2 H 44 3.939 3.998 -0.059 1
1 470 . 6 1 1 A 44 44 GLY HA3 H 44 3.939 3.999 -0.060 1
1 471 . 6 1 1 A 44 44 GLY C C 44 174.393 174.583 -0.190 1
1 472 . 6 1 1 A 44 44 GLY CA C 44 45.501 45.477 0.024 1
1 473 . 6 1 1 A 44 44 GLY N N 44 111.333 112.433 -1.100 1
1 474 . 6 1 1 A 45 45 SER H H 45 8.061 8.165 -0.104 1
1 475 . 6 1 1 A 45 45 SER HA H 45 4.416 4.654 -0.238 1
1 478 . 6 1 1 A 45 45 SER C C 45 174.480 173.870 0.610 1
1 479 . 6 1 1 A 45 45 SER CA C 45 58.478 57.878 0.600 1
1 480 . 6 1 1 A 45 45 SER CB C 45 63.943 64.868 -0.925 1
1 481 . 6 1 1 A 45 45 SER N N 45 115.551 116.624 -1.073 1
1 482 . 6 1 1 A 46 46 ASN H H 46 8.547 8.588 -0.041 1
1 483 . 6 1 1 A 46 46 ASN HA H 46 4.725 4.802 -0.077 1
1 488 . 6 1 1 A 46 46 ASN C C 46 175.031 174.095 0.936 1
1 489 . 6 1 1 A 46 46 ASN CA C 46 53.277 53.238 0.039 1
1 490 . 6 1 1 A 46 46 ASN CB C 46 38.798 37.370 1.428 1
1 491 . 6 1 1 A 46 46 ASN N N 46 120.698 121.549 -0.851 1
1 493 . 6 1 1 A 47 47 ALA H H 47 8.239 8.281 -0.042 1
1 494 . 6 1 1 A 47 47 ALA HA H 47 4.283 5.265 -0.982 1
1 498 . 6 1 1 A 47 47 ALA C C 47 177.240 175.520 1.720 1
1 499 . 6 1 1 A 47 47 ALA CA C 47 52.731 50.170 2.561 1
1 500 . 6 1 1 A 47 47 ALA CB C 47 19.594 22.335 -2.741 1
1 501 . 6 1 1 A 47 47 ALA N N 47 124.093 126.910 -2.817 1
1 502 . 6 1 1 A 48 48 GLU H H 48 8.376 8.690 -0.314 1
1 503 . 6 1 1 A 48 48 GLU HA H 48 4.264 4.984 -0.720 1
1 508 . 6 1 1 A 48 48 GLU C C 48 175.702 175.485 0.217 1
1 509 . 6 1 1 A 48 48 GLU CA C 48 55.992 54.929 1.063 1
1 510 . 6 1 1 A 48 48 GLU CB C 48 30.210 31.720 -1.510 1
1 512 . 6 1 1 A 48 48 GLU N N 48 119.750 122.180 -2.430 1
1 513 . 6 1 1 A 49 49 ILE H H 49 7.806 8.919 -1.113 1
1 514 . 6 1 1 A 49 49 ILE HA H 49 3.919 4.645 -0.726 1
1 524 . 6 1 1 A 49 49 ILE C C 49 175.894 175.085 0.809 1
1 525 . 6 1 1 A 49 49 ILE CA C 49 60.559 60.027 0.532 1
1 526 . 6 1 1 A 49 49 ILE CB C 49 37.860 38.449 -0.589 1
1 530 . 6 1 1 A 49 49 ILE N N 49 122.772 125.922 -3.150 1
1 531 . 6 1 1 A 50 50 ARG H H 50 8.247 8.332 -0.085 1
1 532 . 6 1 1 A 50 50 ARG HA H 50 4.999 4.624 0.375 1
1 539 . 6 1 1 A 50 50 ARG C C 50 174.603 174.463 0.140 1
1 540 . 6 1 1 A 50 50 ARG CA C 50 53.189 54.316 -1.127 1
1 541 . 6 1 1 A 50 50 ARG CB C 50 33.152 33.388 -0.236 1
1 544 . 6 1 1 A 50 50 ARG N N 50 126.912 127.414 -0.502 1
1 545 . 6 1 1 A 51 51 TYR H H 51 9.041 8.954 0.087 1
1 546 . 6 1 1 A 51 51 TYR HA H 51 5.395 5.281 0.114 1
1 553 . 6 1 1 A 51 51 TYR C C 51 175.555 175.771 -0.216 1
1 554 . 6 1 1 A 51 51 TYR CA C 51 56.909 56.546 0.363 1
1 555 . 6 1 1 A 51 51 TYR CB C 51 40.116 39.356 0.760 1
1 560 . 6 1 1 A 51 51 TYR N N 51 121.627 120.483 1.144 1
1 561 . 6 1 1 A 52 52 ILE H H 52 8.850 8.576 0.274 1
1 562 . 6 1 1 A 52 52 ILE HA H 52 4.576 4.926 -0.350 1
1 572 . 6 1 1 A 52 52 ILE C C 52 175.371 175.538 -0.167 1
1 573 . 6 1 1 A 52 52 ILE CA C 52 59.624 59.206 0.418 1
1 574 . 6 1 1 A 52 52 ILE CB C 52 42.895 40.666 2.229 1
1 578 . 6 1 1 A 52 52 ILE N N 52 117.697 118.805 -1.108 1
1 579 . 6 1 1 A 53 53 PHE H H 53 8.748 8.666 0.082 1
1 580 . 6 1 1 A 53 53 PHE HA H 53 5.132 4.544 0.588 1
1 588 . 6 1 1 A 53 53 PHE C C 53 178.146 176.284 1.862 1
1 589 . 6 1 1 A 53 53 PHE CA C 53 57.667 58.782 -1.115 1
1 590 . 6 1 1 A 53 53 PHE CB C 53 39.614 39.626 -0.012 1
1 596 . 6 1 1 A 53 53 PHE N N 53 121.433 122.719 -1.286 1
1 597 . 6 1 1 A 54 54 GLY H H 54 8.538 8.965 -0.427 1
1 598 . 6 1 1 A 54 54 GLY HA2 H 54 4.074 4.133 -0.059 1
1 599 . 6 1 1 A 54 54 GLY HA3 H 54 3.840 4.143 -0.303 1
1 600 . 6 1 1 A 54 54 GLY C C 54 174.530 172.916 1.614 1
1 601 . 6 1 1 A 54 54 GLY CA C 54 44.884 44.427 0.457 1
1 602 . 6 1 1 A 54 54 GLY N N 54 106.444 110.368 -3.924 1
1 603 . 6 1 1 A 55 55 ALA H H 55 8.594 8.363 0.231 1
1 604 . 6 1 1 A 55 55 ALA HA H 55 4.172 4.460 -0.288 1
1 608 . 6 1 1 A 55 55 ALA C C 55 178.718 177.534 1.184 1
1 609 . 6 1 1 A 55 55 ALA CA C 55 54.423 51.179 3.244 1
1 610 . 6 1 1 A 55 55 ALA CB C 55 19.059 20.266 -1.207 1
1 611 . 6 1 1 A 55 55 ALA N N 55 123.470 121.879 1.591 1
1 612 . 6 1 1 A 56 56 GLN H H 56 8.727 8.726 0.001 1
1 613 . 6 1 1 A 56 56 GLN HA H 56 4.367 3.778 0.589 1
1 620 . 6 1 1 A 56 56 GLN C C 56 176.134 174.439 1.695 1
1 621 . 6 1 1 A 56 56 GLN CA C 56 55.660 56.838 -1.178 1
1 622 . 6 1 1 A 56 56 GLN CB C 56 28.152 26.721 1.431 1
1 624 . 6 1 1 A 56 56 GLN N N 56 114.221 115.956 -1.735 1
1 626 . 6 1 1 A 57 57 VAL H H 57 7.204 7.650 -0.446 1
1 627 . 6 1 1 A 57 57 VAL HA H 57 3.889 4.332 -0.443 1
1 635 . 6 1 1 A 57 57 VAL C C 57 175.371 175.373 -0.002 1
1 636 . 6 1 1 A 57 57 VAL CA C 57 63.908 60.971 2.937 1
1 637 . 6 1 1 A 57 57 VAL CB C 57 31.557 33.158 -1.601 1
1 640 . 6 1 1 A 57 57 VAL N N 57 121.341 119.174 2.167 1
1 641 . 6 1 1 A 58 58 ALA H H 58 8.920 8.496 0.424 1
1 642 . 6 1 1 A 58 58 ALA HA H 58 4.547 4.337 0.210 1
1 646 . 6 1 1 A 58 58 ALA C C 58 177.064 177.715 -0.651 1
1 647 . 6 1 1 A 58 58 ALA CA C 58 51.173 50.831 0.342 1
1 648 . 6 1 1 A 58 58 ALA CB C 58 17.842 17.692 0.150 1
1 649 . 6 1 1 A 58 58 ALA N N 58 132.726 130.821 1.905 1
1 650 . 6 1 1 A 59 59 PRO HA H 59 4.101 4.239 -0.138 1
1 657 . 6 1 1 A 59 59 PRO C C 59 179.482 178.529 0.953 1
1 658 . 6 1 1 A 59 59 PRO CA C 59 66.060 65.074 0.986 1
1 659 . 6 1 1 A 59 59 PRO CB C 59 31.951 31.956 -0.005 1
1 662 . 6 1 1 A 60 60 ALA H H 60 8.706 8.127 0.579 1
1 663 . 6 1 1 A 60 60 ALA HA H 60 4.057 4.043 0.014 1
1 667 . 6 1 1 A 60 60 ALA C C 60 179.627 180.164 -0.537 1
1 668 . 6 1 1 A 60 60 ALA CA C 60 55.305 55.254 0.051 1
1 669 . 6 1 1 A 60 60 ALA CB C 60 18.737 18.307 0.430 1
1 670 . 6 1 1 A 60 60 ALA N N 60 117.882 119.188 -1.306 1
1 671 . 6 1 1 A 61 61 THR H H 61 7.312 8.114 -0.802 1
1 672 . 6 1 1 A 61 61 THR HA H 61 4.153 4.000 0.153 1
1 677 . 6 1 1 A 61 61 THR C C 61 175.824 176.725 -0.901 1
1 678 . 6 1 1 A 61 61 THR CA C 61 66.412 66.709 -0.297 1
1 679 . 6 1 1 A 61 61 THR CB C 61 68.787 68.473 0.314 1
1 681 . 6 1 1 A 61 61 THR N N 61 114.483 114.580 -0.097 1
1 682 . 6 1 1 A 62 62 LYS H H 62 7.556 7.850 -0.294 1
1 683 . 6 1 1 A 62 62 LYS HA H 62 3.943 4.011 -0.068 1
1 692 . 6 1 1 A 62 62 LYS C C 62 176.884 179.020 -2.136 1
1 693 . 6 1 1 A 62 62 LYS CA C 62 59.095 59.412 -0.317 1
1 694 . 6 1 1 A 62 62 LYS CB C 62 32.204 31.623 0.581 1
1 698 . 6 1 1 A 62 62 LYS N N 62 118.994 119.747 -0.753 1
1 699 . 6 1 1 A 63 63 ARG H H 63 7.474 7.640 -0.166 1
1 700 . 6 1 1 A 63 63 ARG HA H 63 4.034 4.105 -0.071 1
1 707 . 6 1 1 A 63 63 ARG C C 63 177.574 178.532 -0.958 1
1 708 . 6 1 1 A 63 63 ARG CA C 63 58.143 59.050 -0.907 1
1 709 . 6 1 1 A 63 63 ARG CB C 63 30.755 30.135 0.620 1
1 712 . 6 1 1 A 63 63 ARG N N 63 114.251 120.305 -6.054 1
1 713 . 6 1 1 A 64 64 LEU H H 64 6.991 7.855 -0.864 1
1 714 . 6 1 1 A 64 64 LEU HA H 64 3.904 3.860 0.044 1
1 724 . 6 1 1 A 64 64 LEU C C 64 176.632 176.568 0.064 1
1 725 . 6 1 1 A 64 64 LEU CA C 64 56.503 58.021 -1.518 1
1 726 . 6 1 1 A 64 64 LEU CB C 64 42.929 41.784 1.145 1
1 730 . 6 1 1 A 64 64 LEU N N 64 116.109 120.346 -4.237 1
1 731 . 6 1 1 A 65 65 PHE H H 65 7.673 8.072 -0.399 1
1 732 . 6 1 1 A 65 65 PHE HA H 65 5.386 5.141 0.245 1
1 740 . 6 1 1 A 65 65 PHE C C 65 173.067 175.477 -2.410 1
1 741 . 6 1 1 A 65 65 PHE CA C 65 56.521 56.802 -0.281 1
1 742 . 6 1 1 A 65 65 PHE CB C 65 41.270 40.845 0.425 1
1 748 . 6 1 1 A 65 65 PHE N N 65 116.182 115.300 0.882 1
1 749 . 6 1 1 A 66 66 ALA H H 66 8.914 9.094 -0.180 1
1 750 . 6 1 1 A 66 66 ALA HA H 66 4.748 5.124 -0.376 1
1 754 . 6 1 1 A 66 66 ALA C C 66 175.223 176.067 -0.844 1
1 755 . 6 1 1 A 66 66 ALA CA C 66 50.050 50.858 -0.808 1
1 756 . 6 1 1 A 66 66 ALA CB C 66 21.161 21.077 0.084 1
1 757 . 6 1 1 A 66 66 ALA N N 66 122.870 126.052 -3.182 1
1 758 . 6 1 1 A 67 67 LEU H H 67 8.498 8.817 -0.319 1
1 759 . 6 1 1 A 67 67 LEU HA H 67 4.713 5.121 -0.408 1
1 769 . 6 1 1 A 67 67 LEU C C 67 175.146 174.352 0.794 1
1 770 . 6 1 1 A 67 67 LEU CA C 67 52.518 53.551 -1.033 1
1 771 . 6 1 1 A 67 67 LEU CB C 67 45.308 46.192 -0.884 1
1 775 . 6 1 1 A 67 67 LEU N N 67 122.208 122.326 -0.118 1
1 776 . 6 1 1 A 68 68 ASN H H 68 8.357 8.886 -0.529 1
1 777 . 6 1 1 A 68 68 ASN HA H 68 4.679 5.201 -0.522 1
1 782 . 6 1 1 A 68 68 ASN C C 68 176.228 175.644 0.584 1
1 783 . 6 1 1 A 68 68 ASN CA C 68 53.524 52.684 0.840 1
1 784 . 6 1 1 A 68 68 ASN CB C 68 39.580 39.997 -0.417 1
1 785 . 6 1 1 A 68 68 ASN N N 68 126.940 124.391 2.549 1
1 787 . 6 1 1 A 69 69 ASN H H 69 8.861 9.255 -0.394 1
1 788 . 6 1 1 A 69 69 ASN HA H 69 5.137 4.981 0.156 1
1 793 . 6 1 1 A 69 69 ASN C C 69 175.631 176.624 -0.993 1
1 794 . 6 1 1 A 69 69 ASN CA C 69 56.009 54.528 1.481 1
1 795 . 6 1 1 A 69 69 ASN CB C 69 40.314 38.778 1.536 1
1 796 . 6 1 1 A 69 69 ASN N N 69 124.980 123.358 1.622 1
1 798 . 6 1 1 A 70 70 THR H H 70 8.635 7.931 0.704 1
1 799 . 6 1 1 A 70 70 THR HA H 70 4.815 4.547 0.268 1
1 804 . 6 1 1 A 70 70 THR C C 70 176.223 175.676 0.547 1
1 805 . 6 1 1 A 70 70 THR CA C 70 63.944 62.874 1.070 1
1 806 . 6 1 1 A 70 70 THR CB C 70 69.727 70.001 -0.274 1
1 808 . 6 1 1 A 70 70 THR N N 70 110.394 110.170 0.224 1
1 809 . 6 1 1 A 71 71 THR H H 71 8.069 7.834 0.235 1
1 810 . 6 1 1 A 71 71 THR HA H 71 4.566 4.627 -0.061 1
1 815 . 6 1 1 A 71 71 THR C C 71 176.213 175.032 1.181 1
1 816 . 6 1 1 A 71 71 THR CA C 71 61.683 61.381 0.302 1
1 817 . 6 1 1 A 71 71 THR CB C 71 70.832 70.599 0.233 1
1 819 . 6 1 1 A 71 71 THR N N 71 110.507 110.193 0.314 1
1 820 . 6 1 1 A 72 72 GLY H H 72 7.990 7.966 0.024 1
1 821 . 6 1 1 A 72 72 GLY HA2 H 72 3.186 2.294 0.892 1
1 822 . 6 1 1 A 72 72 GLY HA3 H 72 2.516 3.517 -1.001 1
1 823 . 6 1 1 A 72 72 GLY C C 72 172.988 174.014 -1.026 1
1 824 . 6 1 1 A 72 72 GLY CA C 72 45.149 46.073 -0.924 1
1 825 . 6 1 1 A 72 72 GLY N N 72 110.788 110.506 0.282 1
1 826 . 6 1 1 A 73 73 LEU H H 73 7.138 7.623 -0.485 1
1 827 . 6 1 1 A 73 73 LEU HA H 73 4.414 4.632 -0.218 1
1 837 . 6 1 1 A 73 73 LEU C C 73 176.836 174.966 1.870 1
1 838 . 6 1 1 A 73 73 LEU CA C 73 55.252 53.591 1.661 1
1 839 . 6 1 1 A 73 73 LEU CB C 73 43.574 44.919 -1.345 1
1 843 . 6 1 1 A 73 73 LEU N N 73 119.222 121.425 -2.203 1
1 844 . 6 1 1 A 74 74 ILE H H 74 8.925 8.767 0.158 1
1 845 . 6 1 1 A 74 74 ILE HA H 74 5.555 5.060 0.495 1
1 855 . 6 1 1 A 74 74 ILE C C 74 175.978 175.419 0.559 1
1 856 . 6 1 1 A 74 74 ILE CA C 74 60.100 60.056 0.044 1
1 857 . 6 1 1 A 74 74 ILE CB C 74 38.550 39.307 -0.757 1
1 861 . 6 1 1 A 74 74 ILE N N 74 129.871 126.210 3.661 1
1 862 . 6 1 1 A 75 75 THR H H 75 9.161 8.911 0.250 1
1 863 . 6 1 1 A 75 75 THR HA H 75 5.375 5.259 0.116 1
1 868 . 6 1 1 A 75 75 THR C C 75 174.798 173.840 0.958 1
1 869 . 6 1 1 A 75 75 THR CA C 75 58.796 59.489 -0.693 1
1 870 . 6 1 1 A 75 75 THR CB C 75 72.978 71.840 1.138 1
1 872 . 6 1 1 A 75 75 THR N N 75 117.522 118.143 -0.621 1
1 873 . 6 1 1 A 76 76 VAL H H 76 8.327 8.577 -0.250 1
1 874 . 6 1 1 A 76 76 VAL HA H 76 3.973 3.816 0.157 1
1 882 . 6 1 1 A 76 76 VAL C C 76 176.495 175.831 0.664 1
1 883 . 6 1 1 A 76 76 VAL CA C 76 64.085 63.498 0.587 1
1 884 . 6 1 1 A 76 76 VAL CB C 76 32.863 31.041 1.822 1
1 887 . 6 1 1 A 76 76 VAL N N 76 120.876 122.552 -1.676 1
1 888 . 6 1 1 A 77 77 GLN H H 77 9.525 8.990 0.535 1
1 889 . 6 1 1 A 77 77 GLN HA H 77 4.702 4.232 0.470 1
1 896 . 6 1 1 A 77 77 GLN C C 77 173.838 175.245 -1.407 1
1 897 . 6 1 1 A 77 77 GLN CA C 77 55.728 57.169 -1.441 1
1 898 . 6 1 1 A 77 77 GLN CB C 77 30.762 29.932 0.830 1
1 900 . 6 1 1 A 77 77 GLN N N 77 129.825 129.226 0.599 1
1 902 . 6 1 1 A 78 78 ARG H H 78 7.621 7.267 0.354 1
1 903 . 6 1 1 A 78 78 ARG HA H 78 4.347 4.767 -0.420 1
1 910 . 6 1 1 A 78 78 ARG C C 78 172.304 174.953 -2.649 1
1 911 . 6 1 1 A 78 78 ARG CA C 78 54.634 54.001 0.633 1
1 912 . 6 1 1 A 78 78 ARG CB C 78 34.685 35.044 -0.359 1
1 915 . 6 1 1 A 78 78 ARG N N 78 120.595 117.221 3.374 1
1 916 . 6 1 1 A 79 79 SER H H 79 7.958 8.457 -0.499 1
1 917 . 6 1 1 A 79 79 SER HA H 79 4.030 4.325 -0.295 1
1 920 . 6 1 1 A 79 79 SER C C 79 174.311 174.281 0.030 1
1 921 . 6 1 1 A 79 79 SER CA C 79 59.889 59.002 0.887 1
1 922 . 6 1 1 A 79 79 SER CB C 79 63.548 63.838 -0.290 1
1 923 . 6 1 1 A 79 79 SER N N 79 112.565 117.581 -5.016 1
1 924 . 6 1 1 A 80 80 LEU H H 80 8.715 8.061 0.654 1
1 925 . 6 1 1 A 80 80 LEU HA H 80 4.114 5.109 -0.995 1
1 935 . 6 1 1 A 80 80 LEU C C 80 176.057 175.823 0.234 1
1 936 . 6 1 1 A 80 80 LEU CA C 80 55.091 53.620 1.471 1
1 937 . 6 1 1 A 80 80 LEU CB C 80 42.341 46.403 -4.062 1
1 941 . 6 1 1 A 80 80 LEU N N 80 123.070 124.107 -1.037 1
1 942 . 6 1 1 A 81 81 ASP H H 81 7.298 8.790 -1.492 1
1 943 . 6 1 1 A 81 81 ASP HA H 81 4.725 5.449 -0.724 1
1 946 . 6 1 1 A 81 81 ASP C C 81 175.939 176.096 -0.157 1
1 947 . 6 1 1 A 81 81 ASP CA C 81 53.664 52.774 0.890 1
1 948 . 6 1 1 A 81 81 ASP CB C 81 42.947 44.126 -1.179 1
1 949 . 6 1 1 A 81 81 ASP N N 81 115.229 120.722 -5.493 1
1 950 . 6 1 1 A 82 82 ARG H H 82 9.289 8.814 0.475 1
1 951 . 6 1 1 A 82 82 ARG HA H 82 4.416 4.150 0.266 1
1 959 . 6 1 1 A 82 82 ARG C C 82 176.406 178.148 -1.742 1
1 960 . 6 1 1 A 82 82 ARG CA C 82 56.397 58.851 -2.454 1
1 961 . 6 1 1 A 82 82 ARG CB C 82 30.638 29.781 0.857 1
1 964 . 6 1 1 A 82 82 ARG N N 82 123.174 125.599 -2.425 1
1 966 . 6 1 1 A 83 83 GLU H H 83 8.468 8.340 0.128 1
1 967 . 6 1 1 A 83 83 GLU HA H 83 3.982 4.076 -0.094 1
1 972 . 6 1 1 A 83 83 GLU C C 83 177.740 178.547 -0.807 1
1 973 . 6 1 1 A 83 83 GLU CA C 83 58.425 59.321 -0.896 1
1 974 . 6 1 1 A 83 83 GLU CB C 83 29.701 29.367 0.334 1
1 976 . 6 1 1 A 83 83 GLU N N 83 119.549 118.697 0.852 1
1 977 . 6 1 1 A 84 84 GLU H H 84 8.033 7.940 0.093 1
1 978 . 6 1 1 A 84 84 GLU HA H 84 4.206 4.267 -0.061 1
1 983 . 6 1 1 A 84 84 GLU C C 84 176.837 175.960 0.877 1
1 984 . 6 1 1 A 84 84 GLU CA C 84 58.056 58.167 -0.111 1
1 985 . 6 1 1 A 84 84 GLU CB C 84 30.432 30.946 -0.514 1
1 987 . 6 1 1 A 84 84 GLU N N 84 118.333 119.234 -0.901 1
1 988 . 6 1 1 A 85 85 THR H H 85 7.651 7.319 0.332 1
1 989 . 6 1 1 A 85 85 THR HA H 85 4.307 4.569 -0.262 1
1 994 . 6 1 1 A 85 85 THR C C 85 171.568 174.353 -2.785 1
1 995 . 6 1 1 A 85 85 THR CA C 85 61.387 60.247 1.140 1
1 996 . 6 1 1 A 85 85 THR CB C 85 69.963 71.148 -1.185 1
1 998 . 6 1 1 A 85 85 THR N N 85 112.444 112.293 0.151 1
1 999 . 6 1 1 A 86 86 ALA H H 86 8.639 8.531 0.108 1
1 1000 . 6 1 1 A 86 86 ALA HA H 86 4.603 4.260 0.343 1
1 1004 . 6 1 1 A 86 86 ALA C C 86 175.560 177.538 -1.978 1
1 1005 . 6 1 1 A 86 86 ALA CA C 86 52.156 54.231 -2.075 1
1 1006 . 6 1 1 A 86 86 ALA CB C 86 20.378 19.974 0.404 1
1 1007 . 6 1 1 A 86 86 ALA N N 86 127.705 129.041 -1.336 1
1 1008 . 6 1 1 A 87 87 ILE H H 87 7.663 7.852 -0.189 1
1 1009 . 6 1 1 A 87 87 ILE HA H 87 4.828 4.696 0.132 1
1 1019 . 6 1 1 A 87 87 ILE C C 87 174.537 174.444 0.093 1
1 1020 . 6 1 1 A 87 87 ILE CA C 87 60.329 60.476 -0.147 1
1 1021 . 6 1 1 A 87 87 ILE CB C 87 41.090 39.034 2.056 1
1 1025 . 6 1 1 A 87 87 ILE N N 87 118.712 117.253 1.459 1
1 1026 . 6 1 1 A 88 88 HIS H H 88 9.098 9.031 0.067 1
1 1027 . 6 1 1 A 88 88 HIS HA H 88 4.576 5.290 -0.714 1
1 1032 . 6 1 1 A 88 88 HIS C C 88 174.354 174.575 -0.221 1
1 1033 . 6 1 1 A 88 88 HIS CA C 88 54.740 54.130 0.610 1
1 1034 . 6 1 1 A 88 88 HIS CB C 88 33.955 32.131 1.824 1
1 1037 . 6 1 1 A 88 88 HIS N N 88 126.285 126.190 0.095 1
1 1038 . 6 1 1 A 89 89 LYS H H 89 8.957 8.990 -0.033 1
1 1039 . 6 1 1 A 89 89 LYS HA H 89 4.873 4.883 -0.010 1
1 1048 . 6 1 1 A 89 89 LYS C C 89 175.906 175.563 0.343 1
1 1049 . 6 1 1 A 89 89 LYS CA C 89 55.269 55.105 0.164 1
1 1050 . 6 1 1 A 89 89 LYS CB C 89 32.945 34.297 -1.352 1
1 1054 . 6 1 1 A 89 89 LYS N N 89 124.332 122.252 2.080 1
1 1055 . 6 1 1 A 90 90 VAL H H 90 9.174 8.563 0.611 1
1 1056 . 6 1 1 A 90 90 VAL HA H 90 4.227 4.884 -0.657 1
1 1064 . 6 1 1 A 90 90 VAL C C 90 174.168 174.847 -0.679 1
1 1065 . 6 1 1 A 90 90 VAL CA C 90 61.369 61.060 0.309 1
1 1066 . 6 1 1 A 90 90 VAL CB C 90 34.082 34.505 -0.423 1
1 1069 . 6 1 1 A 90 90 VAL N N 90 124.319 125.690 -1.371 1
1 1070 . 6 1 1 A 91 91 THR H H 91 6.697 8.961 -2.264 1
1 1071 . 6 1 1 A 91 91 THR HA H 91 5.163 5.317 -0.154 1
1 1076 . 6 1 1 A 91 91 THR C C 91 173.812 173.727 0.085 1
1 1077 . 6 1 1 A 91 91 THR CA C 91 61.935 61.582 0.353 1
1 1078 . 6 1 1 A 91 91 THR CB C 91 70.412 70.341 0.071 1
1 1080 . 6 1 1 A 91 91 THR N N 91 122.637 123.884 -1.247 1
1 1081 . 6 1 1 A 92 92 VAL H H 92 9.292 8.960 0.332 1
1 1082 . 6 1 1 A 92 92 VAL HA H 92 4.736 4.964 -0.228 1
1 1090 . 6 1 1 A 92 92 VAL C C 92 173.160 174.886 -1.726 1
1 1091 . 6 1 1 A 92 92 VAL CA C 92 60.982 60.704 0.278 1
1 1092 . 6 1 1 A 92 92 VAL CB C 92 35.130 34.811 0.319 1
1 1095 . 6 1 1 A 92 92 VAL N N 92 128.265 126.943 1.322 1
1 1096 . 6 1 1 A 93 93 LEU H H 93 9.495 8.641 0.854 1
1 1097 . 6 1 1 A 93 93 LEU HA H 93 5.628 5.796 -0.168 1
1 1107 . 6 1 1 A 93 93 LEU C C 93 176.274 175.626 0.648 1
1 1108 . 6 1 1 A 93 93 LEU CA C 93 52.773 53.452 -0.679 1
1 1109 . 6 1 1 A 93 93 LEU CB C 93 43.454 45.799 -2.345 1
1 1113 . 6 1 1 A 93 93 LEU N N 93 126.350 126.452 -0.102 1
1 1114 . 6 1 1 A 94 94 ALA H H 94 8.688 8.828 -0.140 1
1 1115 . 6 1 1 A 94 94 ALA HA H 94 4.986 5.248 -0.262 1
1 1119 . 6 1 1 A 94 94 ALA C C 94 175.787 176.368 -0.581 1
1 1120 . 6 1 1 A 94 94 ALA CA C 94 49.610 50.282 -0.672 1
1 1121 . 6 1 1 A 94 94 ALA CB C 94 21.463 20.205 1.258 1
1 1122 . 6 1 1 A 94 94 ALA N N 94 123.429 127.003 -3.574 1
1 1123 . 6 1 1 A 95 95 SER H H 95 8.401 8.039 0.362 1
1 1124 . 6 1 1 A 95 95 SER HA H 95 4.828 5.258 -0.430 1
1 1127 . 6 1 1 A 95 95 SER C C 95 174.327 173.864 0.463 1
1 1128 . 6 1 1 A 95 95 SER CA C 95 56.239 56.470 -0.231 1
1 1129 . 6 1 1 A 95 95 SER CB C 95 65.561 64.461 1.100 1
1 1130 . 6 1 1 A 95 95 SER N N 95 114.418 117.244 -2.826 1
1 1131 . 6 1 1 A 96 96 ASP H H 96 8.690 9.144 -0.454 1
1 1132 . 6 1 1 A 96 96 ASP HA H 96 4.908 4.812 0.096 1
1 1135 . 6 1 1 A 96 96 ASP C C 96 177.096 175.749 1.347 1
1 1136 . 6 1 1 A 96 96 ASP CA C 96 52.818 55.321 -2.503 1
1 1137 . 6 1 1 A 96 96 ASP CB C 96 41.253 43.192 -1.939 1
1 1138 . 6 1 1 A 96 96 ASP N N 96 125.624 124.315 1.309 1
1 1139 . 6 1 1 A 97 97 GLY H H 97 8.524 7.601 0.923 1
1 1140 . 6 1 1 A 97 97 GLY HA2 H 97 4.320 4.037 0.283 1
1 1141 . 6 1 1 A 97 97 GLY HA3 H 97 3.620 4.038 -0.418 1
1 1142 . 6 1 1 A 97 97 GLY C C 97 174.620 174.270 0.350 1
1 1143 . 6 1 1 A 97 97 GLY CA C 97 45.422 45.970 -0.548 1
1 1144 . 6 1 1 A 97 97 GLY N N 97 109.283 105.829 3.454 1
1 1145 . 6 1 1 A 98 98 SER H H 98 8.575 8.500 0.075 1
1 1146 . 6 1 1 A 98 98 SER HA H 98 4.607 4.175 0.432 1
1 1149 . 6 1 1 A 98 98 SER C C 98 174.478 175.345 -0.867 1
1 1150 . 6 1 1 A 98 98 SER CA C 98 59.095 61.199 -2.104 1
1 1151 . 6 1 1 A 98 98 SER CB C 98 64.800 63.023 1.777 1
1 1152 . 6 1 1 A 98 98 SER N N 98 116.640 122.093 -5.453 1
1 1153 . 6 1 1 A 99 99 SER H H 99 8.945 7.680 1.265 1
1 1154 . 6 1 1 A 99 99 SER HA H 99 4.530 4.354 0.176 1
1 1157 . 6 1 1 A 99 99 SER C C 99 174.491 174.079 0.412 1
1 1158 . 6 1 1 A 99 99 SER CA C 99 58.460 58.319 0.141 1
1 1159 . 6 1 1 A 99 99 SER CB C 99 64.146 63.416 0.730 1
1 1160 . 6 1 1 A 99 99 SER N N 99 117.676 116.439 1.237 1
1 1161 . 6 1 1 A 100 100 THR H H 100 8.411 8.382 0.029 1
1 1162 . 6 1 1 A 100 100 THR HA H 100 4.490 4.335 0.155 1
1 1167 . 6 1 1 A 100 100 THR C C 100 172.766 174.122 -1.356 1
1 1168 . 6 1 1 A 100 100 THR CA C 100 60.629 60.758 -0.129 1
1 1169 . 6 1 1 A 100 100 THR CB C 100 69.778 68.694 1.084 1
1 1171 . 6 1 1 A 100 100 THR N N 100 118.401 119.599 -1.198 1
1 1172 . 6 1 1 A 101 101 PRO HA H 101 4.631 4.730 -0.099 1
1 1179 . 6 1 1 A 101 101 PRO C C 101 177.227 176.978 0.249 1
1 1180 . 6 1 1 A 101 101 PRO CA C 101 63.097 62.514 0.583 1
1 1181 . 6 1 1 A 101 101 PRO CB C 101 32.917 32.423 0.494 1
1 1184 . 6 1 1 A 102 102 ALA H H 102 8.497 7.865 0.632 1
1 1185 . 6 1 1 A 102 102 ALA HA H 102 4.619 4.324 0.295 1
1 1189 . 6 1 1 A 102 102 ALA C C 102 176.542 177.939 -1.397 1
1 1190 . 6 1 1 A 102 102 ALA CA C 102 51.390 53.015 -1.625 1
1 1191 . 6 1 1 A 102 102 ALA CB C 102 20.815 19.232 1.583 1
1 1192 . 6 1 1 A 102 102 ALA N N 102 124.487 124.261 0.226 1
1 1193 . 6 1 1 A 103 103 ARG H H 103 8.663 9.045 -0.382 1
1 1194 . 6 1 1 A 103 103 ARG HA H 103 5.515 5.375 0.140 1
1 1201 . 6 1 1 A 103 103 ARG C C 103 174.539 174.797 -0.258 1
1 1202 . 6 1 1 A 103 103 ARG CA C 103 55.164 54.282 0.882 1
1 1203 . 6 1 1 A 103 103 ARG CB C 103 34.393 34.015 0.378 1
1 1206 . 6 1 1 A 103 103 ARG N N 103 119.596 117.674 1.922 1
1 1207 . 6 1 1 A 104 104 ALA H H 104 9.027 8.505 0.522 1
1 1208 . 6 1 1 A 104 104 ALA HA H 104 4.782 5.158 -0.376 1
1 1212 . 6 1 1 A 104 104 ALA C C 104 176.276 175.413 0.863 1
1 1213 . 6 1 1 A 104 104 ALA CA C 104 50.297 50.709 -0.412 1
1 1214 . 6 1 1 A 104 104 ALA CB C 104 20.810 23.458 -2.648 1
1 1215 . 6 1 1 A 104 104 ALA N N 104 126.962 122.035 4.927 1
1 1216 . 6 1 1 A 105 105 THR H H 105 8.384 8.579 -0.195 1
1 1217 . 6 1 1 A 105 105 THR HA H 105 4.954 5.091 -0.137 1
1 1222 . 6 1 1 A 105 105 THR C C 105 173.243 173.652 -0.409 1
1 1223 . 6 1 1 A 105 105 THR CA C 105 61.475 61.641 -0.166 1
1 1224 . 6 1 1 A 105 105 THR CB C 105 70.569 71.611 -1.042 1
1 1226 . 6 1 1 A 105 105 THR N N 105 115.327 115.336 -0.009 1
1 1227 . 6 1 1 A 106 106 VAL H H 106 8.970 8.809 0.161 1
1 1228 . 6 1 1 A 106 106 VAL HA H 106 4.702 4.840 -0.138 1
1 1236 . 6 1 1 A 106 106 VAL C C 106 174.743 174.672 0.071 1
1 1237 . 6 1 1 A 106 106 VAL CA C 106 59.712 60.417 -0.705 1
1 1238 . 6 1 1 A 106 106 VAL CB C 106 34.327 35.274 -0.947 1
1 1241 . 6 1 1 A 106 106 VAL N N 106 126.226 126.774 -0.548 1
1 1242 . 6 1 1 A 107 107 THR H H 107 8.833 8.777 0.056 1
1 1243 . 6 1 1 A 107 107 THR HA H 107 4.862 4.893 -0.031 1
1 1248 . 6 1 1 A 107 107 THR C C 107 172.970 174.145 -1.175 1
1 1249 . 6 1 1 A 107 107 THR CA C 107 62.322 62.052 0.270 1
1 1250 . 6 1 1 A 107 107 THR CB C 107 69.463 69.690 -0.227 1
1 1252 . 6 1 1 A 107 107 THR N N 107 125.403 123.700 1.703 1
1 1253 . 6 1 1 A 108 108 ILE H H 108 9.234 9.157 0.077 1
1 1254 . 6 1 1 A 108 108 ILE HA H 108 4.178 4.709 -0.531 1
1 1264 . 6 1 1 A 108 108 ILE C C 108 174.087 174.787 -0.700 1
1 1265 . 6 1 1 A 108 108 ILE CA C 108 60.365 59.774 0.591 1
1 1266 . 6 1 1 A 108 108 ILE CB C 108 39.745 40.614 -0.869 1
1 1270 . 6 1 1 A 108 108 ILE N N 108 127.152 128.744 -1.592 1
1 1271 . 6 1 1 A 109 109 ASN H H 109 8.723 8.791 -0.068 1
1 1272 . 6 1 1 A 109 109 ASN HA H 109 5.147 5.400 -0.253 1
1 1277 . 6 1 1 A 109 109 ASN C C 109 173.592 174.290 -0.698 1
1 1278 . 6 1 1 A 109 109 ASN CA C 109 52.501 51.579 0.922 1
1 1279 . 6 1 1 A 109 109 ASN CB C 109 40.791 41.798 -1.007 1
1 1280 . 6 1 1 A 109 109 ASN N N 109 126.866 125.313 1.553 1
1 1282 . 6 1 1 A 110 110 VAL H H 110 9.046 8.491 0.555 1
1 1283 . 6 1 1 A 110 110 VAL HA H 110 5.081 5.030 0.051 1
1 1291 . 6 1 1 A 110 110 VAL C C 110 176.921 174.625 2.296 1
1 1292 . 6 1 1 A 110 110 VAL CA C 110 61.634 61.369 0.265 1
1 1293 . 6 1 1 A 110 110 VAL CB C 110 31.809 33.333 -1.524 1
1 1296 . 6 1 1 A 110 110 VAL N N 110 126.070 122.520 3.550 1
1 1297 . 6 1 1 A 111 111 THR H H 111 9.197 9.210 -0.013 1
1 1298 . 6 1 1 A 111 111 THR HA H 111 4.566 4.918 -0.352 1
1 1303 . 6 1 1 A 111 111 THR C C 111 174.087 172.439 1.648 1
1 1304 . 6 1 1 A 111 111 THR CA C 111 61.145 59.826 1.319 1
1 1305 . 6 1 1 A 111 111 THR CB C 111 70.706 71.086 -0.380 1
1 1307 . 6 1 1 A 111 111 THR N N 111 121.425 122.723 -1.298 1
1 1308 . 6 1 1 A 112 112 ASP H H 112 8.435 8.522 -0.087 1
1 1309 . 6 1 1 A 112 112 ASP HA H 112 4.656 4.690 -0.034 1
1 1312 . 6 1 1 A 112 112 ASP C C 112 176.745 175.793 0.952 1
1 1313 . 6 1 1 A 112 112 ASP CA C 112 54.158 53.960 0.198 1
1 1314 . 6 1 1 A 112 112 ASP CB C 112 41.575 42.294 -0.719 1
1 1315 . 6 1 1 A 112 112 ASP N N 112 119.566 124.686 -5.120 1
1 1316 . 6 1 1 A 113 113 VAL H H 113 8.629 8.508 0.121 1
1 1317 . 6 1 1 A 113 113 VAL HA H 113 4.078 4.175 -0.097 1
1 1325 . 6 1 1 A 113 113 VAL C C 113 175.247 176.763 -1.516 1
1 1326 . 6 1 1 A 113 113 VAL CA C 113 62.533 63.868 -1.335 1
1 1327 . 6 1 1 A 113 113 VAL CB C 113 32.534 33.544 -1.010 1
1 1330 . 6 1 1 A 113 113 VAL N N 113 119.356 121.672 -2.316 1
1 4 . 7 1 1 A 2 2 SER H H 2 8.289 8.863 -0.574 1
1 5 . 7 1 1 A 2 2 SER HA H 2 4.530 4.071 0.459 1
1 7 . 7 1 1 A 2 2 SER C C 2 174.868 173.300 1.568 1
1 8 . 7 1 1 A 2 2 SER CA C 2 58.284 59.015 -0.731 1
1 9 . 7 1 1 A 2 2 SER CB C 2 63.769 61.497 2.272 1
1 10 . 7 1 1 A 2 2 SER N N 2 115.842 118.848 -3.006 1
1 11 . 7 1 1 A 3 3 SER H H 3 8.490 7.930 0.560 1
1 12 . 7 1 1 A 3 3 SER HA H 3 4.496 4.730 -0.234 1
1 14 . 7 1 1 A 3 3 SER C C 3 175.043 174.350 0.693 1
1 15 . 7 1 1 A 3 3 SER CA C 3 58.549 57.640 0.909 1
1 16 . 7 1 1 A 3 3 SER CB C 3 63.687 62.486 1.201 1
1 17 . 7 1 1 A 3 3 SER N N 3 117.930 115.827 2.103 1
1 18 . 7 1 1 A 4 4 GLY H H 4 8.482 8.638 -0.156 1
1 19 . 7 1 1 A 4 4 GLY C C 4 174.344 172.672 1.672 1
1 20 . 7 1 1 A 4 4 GLY CA C 4 45.536 44.482 1.054 1
1 21 . 7 1 1 A 4 4 GLY N N 4 110.985 112.905 -1.920 1
1 22 . 7 1 1 A 6 6 SER HA H 6 4.508 4.234 0.274 1
1 24 . 7 1 1 A 6 6 SER C C 6 175.026 174.824 0.202 1
1 25 . 7 1 1 A 6 6 SER CA C 6 58.584 59.483 -0.899 1
1 26 . 7 1 1 A 6 6 SER CB C 6 63.646 62.957 0.689 1
1 27 . 7 1 1 A 7 7 GLY H H 7 8.419 8.833 -0.414 1
1 28 . 7 1 1 A 7 7 GLY HA2 H 7 3.993 4.135 -0.142 1
1 29 . 7 1 1 A 7 7 GLY C C 7 173.995 174.540 -0.545 1
1 30 . 7 1 1 A 7 7 GLY CA C 7 45.466 44.681 0.785 1
1 31 . 7 1 1 A 7 7 GLY N N 7 110.615 111.317 -0.702 1
1 32 . 7 1 1 A 8 8 ASN H H 8 8.322 8.706 -0.384 1
1 33 . 7 1 1 A 8 8 ASN HA H 8 4.736 4.680 0.056 1
1 38 . 7 1 1 A 8 8 ASN C C 8 174.907 175.505 -0.598 1
1 39 . 7 1 1 A 8 8 ASN CA C 8 53.259 55.090 -1.831 1
1 40 . 7 1 1 A 8 8 ASN CB C 8 39.127 39.142 -0.015 1
1 41 . 7 1 1 A 8 8 ASN N N 8 118.602 120.983 -2.381 1
1 43 . 7 1 1 A 9 9 ASP H H 9 8.370 7.953 0.417 1
1 44 . 7 1 1 A 9 9 ASP HA H 9 4.594 4.537 0.057 1
1 47 . 7 1 1 A 9 9 ASP C C 9 175.765 175.754 0.011 1
1 48 . 7 1 1 A 9 9 ASP CA C 9 54.440 54.464 -0.024 1
1 49 . 7 1 1 A 9 9 ASP CB C 9 40.898 41.156 -0.258 1
1 50 . 7 1 1 A 9 9 ASP N N 9 120.504 120.287 0.217 1
1 51 . 7 1 1 A 10 10 ASN H H 10 8.382 8.855 -0.473 1
1 52 . 7 1 1 A 10 10 ASN HA H 10 4.691 5.045 -0.354 1
1 57 . 7 1 1 A 10 10 ASN C C 10 174.383 175.098 -0.715 1
1 58 . 7 1 1 A 10 10 ASN CA C 10 53.241 52.240 1.001 1
1 59 . 7 1 1 A 10 10 ASN CB C 10 38.674 38.083 0.591 1
1 60 . 7 1 1 A 10 10 ASN N N 10 119.406 123.136 -3.730 1
1 62 . 7 1 1 A 11 11 ARG H H 11 7.942 8.185 -0.243 1
1 63 . 7 1 1 A 11 11 ARG HA H 11 4.684 4.803 -0.119 1
1 70 . 7 1 1 A 11 11 ARG C C 11 173.640 174.200 -0.560 1
1 71 . 7 1 1 A 11 11 ARG CA C 11 54.246 53.612 0.634 1
1 72 . 7 1 1 A 11 11 ARG CB C 11 30.337 31.701 -1.364 1
1 75 . 7 1 1 A 11 11 ARG N N 11 121.145 122.652 -1.507 1
1 76 . 7 1 1 A 12 12 PRO HA H 12 4.507 4.593 -0.086 1
1 83 . 7 1 1 A 12 12 PRO CA C 12 62.714 62.639 0.075 1
1 84 . 7 1 1 A 12 12 PRO CB C 12 31.942 31.664 0.278 1
1 87 . 7 1 1 A 13 13 VAL H H 13 8.252 8.227 0.025 1
1 88 . 7 1 1 A 13 13 VAL HA H 13 4.159 4.279 -0.120 1
1 96 . 7 1 1 A 13 13 VAL CA C 13 61.409 61.885 -0.476 1
1 97 . 7 1 1 A 13 13 VAL CB C 13 34.858 32.816 2.042 1
1 100 . 7 1 1 A 13 13 VAL N N 13 118.395 122.501 -4.106 1
1 101 . 7 1 1 A 14 14 PHE H H 14 8.725 8.645 0.080 1
1 102 . 7 1 1 A 14 14 PHE HA H 14 4.781 4.951 -0.170 1
1 110 . 7 1 1 A 14 14 PHE CA C 14 58.594 56.908 1.686 1
1 111 . 7 1 1 A 14 14 PHE CB C 14 39.594 38.808 0.786 1
1 117 . 7 1 1 A 14 14 PHE N N 14 122.950 128.850 -5.900 1
1 118 . 7 1 1 A 15 15 LYS H H 15 8.885 8.819 0.066 1
1 119 . 7 1 1 A 15 15 LYS HA H 15 4.130 4.142 -0.012 1
1 128 . 7 1 1 A 15 15 LYS C C 15 177.027 177.251 -0.224 1
1 129 . 7 1 1 A 15 15 LYS CA C 15 58.478 57.032 1.446 1
1 130 . 7 1 1 A 15 15 LYS CB C 15 32.748 32.611 0.137 1
1 134 . 7 1 1 A 15 15 LYS N N 15 123.863 125.676 -1.813 1
1 135 . 7 1 1 A 16 16 GLU H H 16 8.091 9.179 -1.088 1
1 136 . 7 1 1 A 16 16 GLU HA H 16 4.438 4.069 0.369 1
1 141 . 7 1 1 A 16 16 GLU C C 16 175.947 177.311 -1.364 1
1 142 . 7 1 1 A 16 16 GLU CA C 16 56.045 57.515 -1.470 1
1 143 . 7 1 1 A 16 16 GLU CB C 16 30.766 27.216 3.550 1
1 145 . 7 1 1 A 16 16 GLU N N 16 117.026 123.369 -6.343 1
1 146 . 7 1 1 A 17 17 GLY H H 17 8.421 7.859 0.562 1
1 147 . 7 1 1 A 17 17 GLY HA2 H 17 3.993 3.836 0.157 1
1 148 . 7 1 1 A 17 17 GLY HA3 H 17 3.913 3.873 0.040 1
1 149 . 7 1 1 A 17 17 GLY C C 17 173.564 174.911 -1.347 1
1 150 . 7 1 1 A 17 17 GLY CA C 17 45.448 47.413 -1.965 1
1 151 . 7 1 1 A 17 17 GLY N N 17 109.577 107.170 2.407 1
1 152 . 7 1 1 A 18 18 GLN H H 18 7.858 7.668 0.190 1
1 153 . 7 1 1 A 18 18 GLN HA H 18 5.065 5.056 0.009 1
1 160 . 7 1 1 A 18 18 GLN C C 18 174.596 175.183 -0.587 1
1 161 . 7 1 1 A 18 18 GLN CA C 18 55.110 55.220 -0.110 1
1 162 . 7 1 1 A 18 18 GLN CB C 18 30.329 29.989 0.340 1
1 164 . 7 1 1 A 18 18 GLN N N 18 120.202 119.559 0.643 1
1 166 . 7 1 1 A 19 19 VAL H H 19 8.216 8.684 -0.468 1
1 167 . 7 1 1 A 19 19 VAL HA H 19 4.450 4.625 -0.175 1
1 175 . 7 1 1 A 19 19 VAL C C 19 173.648 173.922 -0.274 1
1 176 . 7 1 1 A 19 19 VAL CA C 19 60.788 60.794 -0.006 1
1 177 . 7 1 1 A 19 19 VAL CB C 19 35.336 35.848 -0.512 1
1 180 . 7 1 1 A 19 19 VAL N N 19 121.257 126.440 -5.183 1
1 181 . 7 1 1 A 20 20 GLU H H 20 8.610 8.987 -0.377 1
1 182 . 7 1 1 A 20 20 GLU HA H 20 5.211 5.257 -0.046 1
1 187 . 7 1 1 A 20 20 GLU C C 20 174.783 175.966 -1.183 1
1 188 . 7 1 1 A 20 20 GLU CA C 20 54.793 55.161 -0.368 1
1 189 . 7 1 1 A 20 20 GLU CB C 20 32.058 31.726 0.332 1
1 191 . 7 1 1 A 20 20 GLU N N 20 127.095 127.508 -0.413 1
1 192 . 7 1 1 A 21 21 VAL H H 21 8.727 9.162 -0.435 1
1 193 . 7 1 1 A 21 21 VAL HA H 21 4.633 5.105 -0.472 1
1 201 . 7 1 1 A 21 21 VAL C C 21 173.894 174.916 -1.022 1
1 202 . 7 1 1 A 21 21 VAL CA C 21 59.695 59.455 0.240 1
1 203 . 7 1 1 A 21 21 VAL CB C 21 35.865 34.922 0.943 1
1 206 . 7 1 1 A 21 21 VAL N N 21 120.489 121.203 -0.714 1
1 207 . 7 1 1 A 22 22 HIS H H 22 8.680 9.007 -0.327 1
1 208 . 7 1 1 A 22 22 HIS HA H 22 5.552 5.852 -0.300 1
1 212 . 7 1 1 A 22 22 HIS C C 22 174.298 173.695 0.603 1
1 213 . 7 1 1 A 22 22 HIS CA C 22 55.331 53.781 1.550 1
1 214 . 7 1 1 A 22 22 HIS CB C 22 32.369 32.399 -0.030 1
1 216 . 7 1 1 A 22 22 HIS N N 22 124.991 119.339 5.652 1
1 217 . 7 1 1 A 23 23 ILE H H 23 9.179 8.404 0.775 1
1 218 . 7 1 1 A 23 23 ILE HA H 23 5.046 4.409 0.637 1
1 228 . 7 1 1 A 23 23 ILE C C 23 171.552 173.548 -1.996 1
1 229 . 7 1 1 A 23 23 ILE CA C 23 55.551 57.154 -1.603 1
1 230 . 7 1 1 A 23 23 ILE CB C 23 42.053 42.047 0.006 1
1 234 . 7 1 1 A 23 23 ILE N N 23 123.121 121.374 1.747 1
1 235 . 7 1 1 A 24 24 PRO HA H 24 4.816 4.817 -0.001 1
1 242 . 7 1 1 A 24 24 PRO C C 24 178.887 177.690 1.197 1
1 243 . 7 1 1 A 24 24 PRO CA C 24 62.216 62.638 -0.422 1
1 244 . 7 1 1 A 24 24 PRO CB C 24 32.895 32.819 0.076 1
1 247 . 7 1 1 A 25 25 GLU H H 25 8.399 8.280 0.119 1
1 248 . 7 1 1 A 25 25 GLU HA H 25 3.785 4.004 -0.219 1
1 253 . 7 1 1 A 25 25 GLU C C 25 175.244 177.245 -2.001 1
1 254 . 7 1 1 A 25 25 GLU CA C 25 58.425 59.031 -0.606 1
1 255 . 7 1 1 A 25 25 GLU CB C 25 30.011 29.018 0.993 1
1 257 . 7 1 1 A 25 25 GLU N N 25 117.706 122.137 -4.431 1
1 258 . 7 1 1 A 26 26 ASN H H 26 7.488 7.733 -0.245 1
1 259 . 7 1 1 A 26 26 ASN HA H 26 4.702 4.796 -0.094 1
1 264 . 7 1 1 A 26 26 ASN C C 26 175.425 175.268 0.157 1
1 265 . 7 1 1 A 26 26 ASN CA C 26 51.584 53.362 -1.778 1
1 266 . 7 1 1 A 26 26 ASN CB C 26 37.243 39.078 -1.835 1
1 267 . 7 1 1 A 26 26 ASN N N 26 112.383 116.447 -4.064 1
1 269 . 7 1 1 A 27 27 ALA H H 27 7.716 7.276 0.440 1
1 270 . 7 1 1 A 27 27 ALA HA H 27 4.409 4.265 0.144 1
1 274 . 7 1 1 A 27 27 ALA C C 27 175.850 175.925 -0.075 1
1 275 . 7 1 1 A 27 27 ALA CA C 27 51.037 51.086 -0.049 1
1 276 . 7 1 1 A 27 27 ALA CB C 27 18.152 18.668 -0.516 1
1 277 . 7 1 1 A 27 27 ALA N N 27 125.139 123.786 1.353 1
1 278 . 7 1 1 A 28 28 PRO HA H 28 4.422 4.528 -0.106 1
1 285 . 7 1 1 A 28 28 PRO C C 28 178.442 176.943 1.499 1
1 286 . 7 1 1 A 28 28 PRO CA C 28 62.067 62.855 -0.788 1
1 287 . 7 1 1 A 28 28 PRO CB C 28 32.642 32.109 0.533 1
1 290 . 7 1 1 A 29 29 VAL H H 29 8.691 8.355 0.336 1
1 291 . 7 1 1 A 29 29 VAL HA H 29 3.239 3.700 -0.461 1
1 299 . 7 1 1 A 29 29 VAL C C 29 176.887 177.061 -0.174 1
1 300 . 7 1 1 A 29 29 VAL CA C 29 65.812 64.471 1.341 1
1 301 . 7 1 1 A 29 29 VAL CB C 29 31.174 31.257 -0.083 1
1 304 . 7 1 1 A 29 29 VAL N N 29 123.592 122.653 0.939 1
1 305 . 7 1 1 A 30 30 GLY H H 30 9.197 8.931 0.266 1
1 306 . 7 1 1 A 30 30 GLY HA2 H 30 4.486 3.953 0.533 1
1 307 . 7 1 1 A 30 30 GLY HA3 H 30 3.581 3.953 -0.372 1
1 308 . 7 1 1 A 30 30 GLY C C 30 174.347 174.776 -0.429 1
1 309 . 7 1 1 A 30 30 GLY CA C 30 44.320 45.018 -0.698 1
1 310 . 7 1 1 A 30 30 GLY N N 30 116.042 115.032 1.010 1
1 311 . 7 1 1 A 31 31 THR H H 31 7.838 7.386 0.452 1
1 312 . 7 1 1 A 31 31 THR HA H 31 3.959 4.145 -0.186 1
1 317 . 7 1 1 A 31 31 THR C C 31 174.274 174.029 0.245 1
1 318 . 7 1 1 A 31 31 THR CA C 31 65.160 62.944 2.216 1
1 319 . 7 1 1 A 31 31 THR CB C 31 69.972 69.615 0.357 1
1 321 . 7 1 1 A 31 31 THR N N 31 117.679 117.683 -0.004 1
1 322 . 7 1 1 A 32 32 SER H H 32 9.022 8.667 0.355 1
1 323 . 7 1 1 A 32 32 SER HA H 32 4.273 4.719 -0.446 1
1 326 . 7 1 1 A 32 32 SER C C 32 172.692 174.229 -1.537 1
1 327 . 7 1 1 A 32 32 SER CA C 32 59.642 57.546 2.096 1
1 328 . 7 1 1 A 32 32 SER CB C 32 63.102 62.995 0.107 1
1 329 . 7 1 1 A 32 32 SER N N 32 123.045 119.600 3.445 1
1 330 . 7 1 1 A 33 33 VAL H H 33 9.202 8.927 0.275 1
1 331 . 7 1 1 A 33 33 VAL HA H 33 3.844 4.018 -0.174 1
1 339 . 7 1 1 A 33 33 VAL C C 33 174.782 175.784 -1.002 1
1 340 . 7 1 1 A 33 33 VAL CA C 33 64.242 63.997 0.245 1
1 341 . 7 1 1 A 33 33 VAL CB C 33 32.893 31.985 0.908 1
1 344 . 7 1 1 A 33 33 VAL N N 33 126.861 124.820 2.041 1
1 345 . 7 1 1 A 34 34 ILE H H 34 7.074 7.973 -0.899 1
1 346 . 7 1 1 A 34 34 ILE HA H 34 4.295 4.693 -0.398 1
1 356 . 7 1 1 A 34 34 ILE C C 34 170.577 172.922 -2.345 1
1 357 . 7 1 1 A 34 34 ILE CA C 34 59.500 59.242 0.258 1
1 358 . 7 1 1 A 34 34 ILE CB C 34 39.251 42.203 -2.952 1
1 362 . 7 1 1 A 34 34 ILE N N 34 111.445 119.141 -7.696 1
1 363 . 7 1 1 A 35 35 GLN H H 35 8.450 8.961 -0.511 1
1 364 . 7 1 1 A 35 35 GLN HA H 35 4.633 4.833 -0.200 1
1 371 . 7 1 1 A 35 35 GLN C C 35 174.354 174.234 0.120 1
1 372 . 7 1 1 A 35 35 GLN CA C 35 54.176 54.448 -0.272 1
1 373 . 7 1 1 A 35 35 GLN CB C 35 29.456 30.429 -0.973 1
1 375 . 7 1 1 A 35 35 GLN N N 35 127.342 129.125 -1.783 1
1 377 . 7 1 1 A 36 36 LEU H H 36 7.761 8.418 -0.657 1
1 378 . 7 1 1 A 36 36 LEU HA H 36 4.492 4.632 -0.140 1
1 388 . 7 1 1 A 36 36 LEU C C 36 175.543 175.805 -0.262 1
1 389 . 7 1 1 A 36 36 LEU CA C 36 53.982 54.599 -0.617 1
1 390 . 7 1 1 A 36 36 LEU CB C 36 42.776 42.337 0.439 1
1 394 . 7 1 1 A 36 36 LEU N N 36 128.895 128.182 0.713 1
1 395 . 7 1 1 A 37 37 HIS H H 37 8.529 8.933 -0.404 1
1 396 . 7 1 1 A 37 37 HIS HA H 37 4.851 5.386 -0.535 1
1 400 . 7 1 1 A 37 37 HIS C C 37 172.985 173.602 -0.617 1
1 401 . 7 1 1 A 37 37 HIS CA C 37 55.833 53.681 2.152 1
1 402 . 7 1 1 A 37 37 HIS CB C 37 32.204 31.713 0.491 1
1 404 . 7 1 1 A 37 37 HIS N N 37 115.903 124.712 -8.809 1
1 405 . 7 1 1 A 38 38 ALA H H 38 8.474 9.280 -0.806 1
1 406 . 7 1 1 A 38 38 ALA HA H 38 4.691 4.889 -0.198 1
1 410 . 7 1 1 A 38 38 ALA C C 38 175.548 175.825 -0.277 1
1 411 . 7 1 1 A 38 38 ALA CA C 38 50.491 51.097 -0.606 1
1 412 . 7 1 1 A 38 38 ALA CB C 38 19.842 20.059 -0.217 1
1 413 . 7 1 1 A 38 38 ALA N N 38 128.891 131.093 -2.202 1
1 414 . 7 1 1 A 39 39 THR H H 39 8.095 8.874 -0.779 1
1 415 . 7 1 1 A 39 39 THR HA H 39 4.336 5.400 -1.064 1
1 420 . 7 1 1 A 39 39 THR C C 39 173.553 172.595 0.958 1
1 421 . 7 1 1 A 39 39 THR CA C 39 60.417 60.270 0.147 1
1 422 . 7 1 1 A 39 39 THR CB C 39 70.912 71.467 -0.555 1
1 424 . 7 1 1 A 39 39 THR N N 39 110.982 114.101 -3.119 1
1 425 . 7 1 1 A 40 40 ASP H H 40 8.417 9.047 -0.630 1
1 426 . 7 1 1 A 40 40 ASP HA H 40 4.553 5.032 -0.479 1
1 429 . 7 1 1 A 40 40 ASP C C 40 176.462 175.053 1.409 1
1 430 . 7 1 1 A 40 40 ASP CA C 40 54.158 51.699 2.459 1
1 431 . 7 1 1 A 40 40 ASP CB C 40 41.517 44.180 -2.663 1
1 432 . 7 1 1 A 40 40 ASP N N 40 121.450 125.005 -3.555 1
1 433 . 7 1 1 A 41 41 ALA H H 41 8.435 8.460 -0.025 1
1 434 . 7 1 1 A 41 41 ALA HA H 41 4.129 4.203 -0.074 1
1 438 . 7 1 1 A 41 41 ALA C C 41 177.718 177.503 0.215 1
1 439 . 7 1 1 A 41 41 ALA CA C 41 53.436 52.990 0.446 1
1 440 . 7 1 1 A 41 41 ALA CB C 41 19.183 19.132 0.051 1
1 441 . 7 1 1 A 41 41 ALA N N 41 124.607 124.400 0.207 1
1 442 . 7 1 1 A 42 42 ASP H H 42 8.310 8.935 -0.625 1
1 443 . 7 1 1 A 42 42 ASP HA H 42 4.588 4.858 -0.270 1
1 446 . 7 1 1 A 42 42 ASP C C 42 176.546 175.131 1.415 1
1 447 . 7 1 1 A 42 42 ASP CA C 42 54.599 53.115 1.484 1
1 448 . 7 1 1 A 42 42 ASP CB C 42 41.146 40.399 0.747 1
1 449 . 7 1 1 A 42 42 ASP N N 42 118.030 126.228 -8.198 1
1 450 . 7 1 1 A 43 43 ILE H H 43 8.000 7.818 0.182 1
1 451 . 7 1 1 A 43 43 ILE HA H 43 4.130 4.594 -0.464 1
1 461 . 7 1 1 A 43 43 ILE C C 43 176.901 175.855 1.046 1
1 462 . 7 1 1 A 43 43 ILE CA C 43 61.740 60.296 1.444 1
1 463 . 7 1 1 A 43 43 ILE CB C 43 38.491 39.083 -0.592 1
1 467 . 7 1 1 A 43 43 ILE N N 43 119.301 119.086 0.215 1
1 468 . 7 1 1 A 44 44 GLY H H 44 8.448 8.504 -0.056 1
1 469 . 7 1 1 A 44 44 GLY HA2 H 44 3.939 3.967 -0.028 1
1 470 . 7 1 1 A 44 44 GLY HA3 H 44 3.939 3.968 -0.029 1
1 471 . 7 1 1 A 44 44 GLY C C 44 174.393 173.557 0.836 1
1 472 . 7 1 1 A 44 44 GLY CA C 44 45.501 45.769 -0.268 1
1 473 . 7 1 1 A 44 44 GLY N N 44 111.333 115.631 -4.298 1
1 474 . 7 1 1 A 45 45 SER H H 45 8.061 7.975 0.086 1
1 475 . 7 1 1 A 45 45 SER HA H 45 4.416 4.854 -0.438 1
1 478 . 7 1 1 A 45 45 SER C C 45 174.480 172.902 1.578 1
1 479 . 7 1 1 A 45 45 SER CA C 45 58.478 56.458 2.020 1
1 480 . 7 1 1 A 45 45 SER CB C 45 63.943 65.215 -1.272 1
1 481 . 7 1 1 A 45 45 SER N N 45 115.551 119.512 -3.961 1
1 482 . 7 1 1 A 46 46 ASN H H 46 8.547 8.714 -0.167 1
1 483 . 7 1 1 A 46 46 ASN HA H 46 4.725 4.891 -0.166 1
1 488 . 7 1 1 A 46 46 ASN C C 46 175.031 174.357 0.674 1
1 489 . 7 1 1 A 46 46 ASN CA C 46 53.277 52.429 0.848 1
1 490 . 7 1 1 A 46 46 ASN CB C 46 38.798 37.135 1.663 1
1 491 . 7 1 1 A 46 46 ASN N N 46 120.698 123.504 -2.806 1
1 493 . 7 1 1 A 47 47 ALA H H 47 8.239 7.949 0.290 1
1 494 . 7 1 1 A 47 47 ALA HA H 47 4.283 4.227 0.056 1
1 498 . 7 1 1 A 47 47 ALA C C 47 177.240 177.100 0.140 1
1 499 . 7 1 1 A 47 47 ALA CA C 47 52.731 53.073 -0.342 1
1 500 . 7 1 1 A 47 47 ALA CB C 47 19.594 19.250 0.344 1
1 501 . 7 1 1 A 47 47 ALA N N 47 124.093 126.407 -2.314 1
1 502 . 7 1 1 A 48 48 GLU H H 48 8.376 8.645 -0.269 1
1 503 . 7 1 1 A 48 48 GLU HA H 48 4.264 4.547 -0.283 1
1 508 . 7 1 1 A 48 48 GLU C C 48 175.702 175.295 0.407 1
1 509 . 7 1 1 A 48 48 GLU CA C 48 55.992 55.110 0.882 1
1 510 . 7 1 1 A 48 48 GLU CB C 48 30.210 29.514 0.696 1
1 512 . 7 1 1 A 48 48 GLU N N 48 119.750 123.508 -3.758 1
1 513 . 7 1 1 A 49 49 ILE H H 49 7.806 8.123 -0.317 1
1 514 . 7 1 1 A 49 49 ILE HA H 49 3.919 3.961 -0.042 1
1 524 . 7 1 1 A 49 49 ILE C C 49 175.894 175.215 0.679 1
1 525 . 7 1 1 A 49 49 ILE CA C 49 60.559 61.748 -1.189 1
1 526 . 7 1 1 A 49 49 ILE CB C 49 37.860 37.598 0.262 1
1 530 . 7 1 1 A 49 49 ILE N N 49 122.772 125.044 -2.272 1
1 531 . 7 1 1 A 50 50 ARG H H 50 8.247 8.501 -0.254 1
1 532 . 7 1 1 A 50 50 ARG HA H 50 4.999 4.626 0.373 1
1 539 . 7 1 1 A 50 50 ARG C C 50 174.603 174.590 0.013 1
1 540 . 7 1 1 A 50 50 ARG CA C 50 53.189 54.631 -1.442 1
1 541 . 7 1 1 A 50 50 ARG CB C 50 33.152 32.200 0.952 1
1 544 . 7 1 1 A 50 50 ARG N N 50 126.912 127.955 -1.043 1
1 545 . 7 1 1 A 51 51 TYR H H 51 9.041 8.993 0.048 1
1 546 . 7 1 1 A 51 51 TYR HA H 51 5.395 5.235 0.160 1
1 553 . 7 1 1 A 51 51 TYR C C 51 175.555 176.064 -0.509 1
1 554 . 7 1 1 A 51 51 TYR CA C 51 56.909 57.639 -0.730 1
1 555 . 7 1 1 A 51 51 TYR CB C 51 40.116 39.966 0.150 1
1 560 . 7 1 1 A 51 51 TYR N N 51 121.627 122.211 -0.584 1
1 561 . 7 1 1 A 52 52 ILE H H 52 8.850 8.530 0.320 1
1 562 . 7 1 1 A 52 52 ILE HA H 52 4.576 4.915 -0.339 1
1 572 . 7 1 1 A 52 52 ILE C C 52 175.371 175.164 0.207 1
1 573 . 7 1 1 A 52 52 ILE CA C 52 59.624 59.177 0.447 1
1 574 . 7 1 1 A 52 52 ILE CB C 52 42.895 41.788 1.107 1
1 578 . 7 1 1 A 52 52 ILE N N 52 117.697 119.235 -1.538 1
1 579 . 7 1 1 A 53 53 PHE H H 53 8.748 8.682 0.066 1
1 580 . 7 1 1 A 53 53 PHE HA H 53 5.132 4.516 0.616 1
1 588 . 7 1 1 A 53 53 PHE C C 53 178.146 176.383 1.763 1
1 589 . 7 1 1 A 53 53 PHE CA C 53 57.667 58.880 -1.213 1
1 590 . 7 1 1 A 53 53 PHE CB C 53 39.614 39.780 -0.166 1
1 596 . 7 1 1 A 53 53 PHE N N 53 121.433 123.176 -1.743 1
1 597 . 7 1 1 A 54 54 GLY H H 54 8.538 8.272 0.266 1
1 598 . 7 1 1 A 54 54 GLY HA2 H 54 4.074 4.124 -0.050 1
1 599 . 7 1 1 A 54 54 GLY HA3 H 54 3.840 4.127 -0.287 1
1 600 . 7 1 1 A 54 54 GLY C C 54 174.530 172.940 1.590 1
1 601 . 7 1 1 A 54 54 GLY CA C 54 44.884 44.516 0.368 1
1 602 . 7 1 1 A 54 54 GLY N N 54 106.444 110.439 -3.995 1
1 603 . 7 1 1 A 55 55 ALA H H 55 8.594 8.141 0.453 1
1 604 . 7 1 1 A 55 55 ALA HA H 55 4.172 4.786 -0.614 1
1 608 . 7 1 1 A 55 55 ALA C C 55 178.718 177.125 1.593 1
1 609 . 7 1 1 A 55 55 ALA CA C 55 54.423 50.741 3.682 1
1 610 . 7 1 1 A 55 55 ALA CB C 55 19.059 21.210 -2.151 1
1 611 . 7 1 1 A 55 55 ALA N N 55 123.470 122.894 0.576 1
1 612 . 7 1 1 A 56 56 GLN H H 56 8.727 8.676 0.051 1
1 613 . 7 1 1 A 56 56 GLN HA H 56 4.367 3.732 0.635 1
1 620 . 7 1 1 A 56 56 GLN C C 56 176.134 174.855 1.279 1
1 621 . 7 1 1 A 56 56 GLN CA C 56 55.660 56.676 -1.016 1
1 622 . 7 1 1 A 56 56 GLN CB C 56 28.152 27.177 0.975 1
1 624 . 7 1 1 A 56 56 GLN N N 56 114.221 115.431 -1.210 1
1 626 . 7 1 1 A 57 57 VAL H H 57 7.204 7.810 -0.606 1
1 627 . 7 1 1 A 57 57 VAL HA H 57 3.889 4.197 -0.308 1
1 635 . 7 1 1 A 57 57 VAL C C 57 175.371 175.196 0.175 1
1 636 . 7 1 1 A 57 57 VAL CA C 57 63.908 61.411 2.497 1
1 637 . 7 1 1 A 57 57 VAL CB C 57 31.557 32.889 -1.332 1
1 640 . 7 1 1 A 57 57 VAL N N 57 121.341 119.448 1.893 1
1 641 . 7 1 1 A 58 58 ALA H H 58 8.920 8.517 0.403 1
1 642 . 7 1 1 A 58 58 ALA HA H 58 4.547 4.441 0.106 1
1 646 . 7 1 1 A 58 58 ALA C C 58 177.064 177.798 -0.734 1
1 647 . 7 1 1 A 58 58 ALA CA C 58 51.173 50.496 0.677 1
1 648 . 7 1 1 A 58 58 ALA CB C 58 17.842 17.851 -0.009 1
1 649 . 7 1 1 A 58 58 ALA N N 58 132.726 128.779 3.947 1
1 650 . 7 1 1 A 59 59 PRO HA H 59 4.101 4.226 -0.125 1
1 657 . 7 1 1 A 59 59 PRO C C 59 179.482 178.542 0.940 1
1 658 . 7 1 1 A 59 59 PRO CA C 59 66.060 65.411 0.649 1
1 659 . 7 1 1 A 59 59 PRO CB C 59 31.951 31.867 0.084 1
1 662 . 7 1 1 A 60 60 ALA H H 60 8.706 8.238 0.468 1
1 663 . 7 1 1 A 60 60 ALA HA H 60 4.057 4.014 0.043 1
1 667 . 7 1 1 A 60 60 ALA C C 60 179.627 180.145 -0.518 1
1 668 . 7 1 1 A 60 60 ALA CA C 60 55.305 55.474 -0.169 1
1 669 . 7 1 1 A 60 60 ALA CB C 60 18.737 18.680 0.057 1
1 670 . 7 1 1 A 60 60 ALA N N 60 117.882 118.736 -0.854 1
1 671 . 7 1 1 A 61 61 THR H H 61 7.312 8.246 -0.934 1
1 672 . 7 1 1 A 61 61 THR HA H 61 4.153 3.963 0.190 1
1 677 . 7 1 1 A 61 61 THR C C 61 175.824 176.889 -1.065 1
1 678 . 7 1 1 A 61 61 THR CA C 61 66.412 66.845 -0.433 1
1 679 . 7 1 1 A 61 61 THR CB C 61 68.787 68.713 0.074 1
1 681 . 7 1 1 A 61 61 THR N N 61 114.483 113.786 0.697 1
1 682 . 7 1 1 A 62 62 LYS H H 62 7.556 7.677 -0.121 1
1 683 . 7 1 1 A 62 62 LYS HA H 62 3.943 3.933 0.010 1
1 692 . 7 1 1 A 62 62 LYS C C 62 176.884 178.540 -1.656 1
1 693 . 7 1 1 A 62 62 LYS CA C 62 59.095 59.536 -0.441 1
1 694 . 7 1 1 A 62 62 LYS CB C 62 32.204 31.814 0.390 1
1 698 . 7 1 1 A 62 62 LYS N N 62 118.994 119.137 -0.143 1
1 699 . 7 1 1 A 63 63 ARG H H 63 7.474 7.675 -0.201 1
1 700 . 7 1 1 A 63 63 ARG HA H 63 4.034 4.081 -0.047 1
1 707 . 7 1 1 A 63 63 ARG C C 63 177.574 178.674 -1.100 1
1 708 . 7 1 1 A 63 63 ARG CA C 63 58.143 58.633 -0.490 1
1 709 . 7 1 1 A 63 63 ARG CB C 63 30.755 30.109 0.646 1
1 712 . 7 1 1 A 63 63 ARG N N 63 114.251 120.198 -5.947 1
1 713 . 7 1 1 A 64 64 LEU H H 64 6.991 7.977 -0.986 1
1 714 . 7 1 1 A 64 64 LEU HA H 64 3.904 3.903 0.001 1
1 724 . 7 1 1 A 64 64 LEU C C 64 176.632 176.792 -0.160 1
1 725 . 7 1 1 A 64 64 LEU CA C 64 56.503 57.897 -1.394 1
1 726 . 7 1 1 A 64 64 LEU CB C 64 42.929 41.805 1.124 1
1 730 . 7 1 1 A 64 64 LEU N N 64 116.109 120.086 -3.977 1
1 731 . 7 1 1 A 65 65 PHE H H 65 7.673 8.628 -0.955 1
1 732 . 7 1 1 A 65 65 PHE HA H 65 5.386 5.065 0.321 1
1 740 . 7 1 1 A 65 65 PHE C C 65 173.067 174.986 -1.919 1
1 741 . 7 1 1 A 65 65 PHE CA C 65 56.521 57.471 -0.950 1
1 742 . 7 1 1 A 65 65 PHE CB C 65 41.270 40.738 0.532 1
1 748 . 7 1 1 A 65 65 PHE N N 65 116.182 115.507 0.675 1
1 749 . 7 1 1 A 66 66 ALA H H 66 8.914 8.537 0.377 1
1 750 . 7 1 1 A 66 66 ALA HA H 66 4.748 5.060 -0.312 1
1 754 . 7 1 1 A 66 66 ALA C C 66 175.223 176.089 -0.866 1
1 755 . 7 1 1 A 66 66 ALA CA C 66 50.050 50.441 -0.391 1
1 756 . 7 1 1 A 66 66 ALA CB C 66 21.161 20.751 0.410 1
1 757 . 7 1 1 A 66 66 ALA N N 66 122.870 125.995 -3.125 1
1 758 . 7 1 1 A 67 67 LEU H H 67 8.498 9.091 -0.593 1
1 759 . 7 1 1 A 67 67 LEU HA H 67 4.713 4.662 0.051 1
1 769 . 7 1 1 A 67 67 LEU C C 67 175.146 175.065 0.081 1
1 770 . 7 1 1 A 67 67 LEU CA C 67 52.518 53.891 -1.373 1
1 771 . 7 1 1 A 67 67 LEU CB C 67 45.308 42.412 2.896 1
1 775 . 7 1 1 A 67 67 LEU N N 67 122.208 126.803 -4.595 1
1 776 . 7 1 1 A 68 68 ASN H H 68 8.357 7.936 0.421 1
1 777 . 7 1 1 A 68 68 ASN HA H 68 4.679 4.595 0.084 1
1 782 . 7 1 1 A 68 68 ASN C C 68 176.228 175.739 0.489 1
1 783 . 7 1 1 A 68 68 ASN CA C 68 53.524 54.054 -0.530 1
1 784 . 7 1 1 A 68 68 ASN CB C 68 39.580 38.774 0.806 1
1 785 . 7 1 1 A 68 68 ASN N N 68 126.940 124.684 2.256 1
1 787 . 7 1 1 A 69 69 ASN H H 69 8.861 8.831 0.030 1
1 788 . 7 1 1 A 69 69 ASN HA H 69 5.137 5.039 0.098 1
1 793 . 7 1 1 A 69 69 ASN C C 69 175.631 176.230 -0.599 1
1 794 . 7 1 1 A 69 69 ASN CA C 69 56.009 53.340 2.669 1
1 795 . 7 1 1 A 69 69 ASN CB C 69 40.314 38.853 1.461 1
1 796 . 7 1 1 A 69 69 ASN N N 69 124.980 123.138 1.842 1
1 798 . 7 1 1 A 70 70 THR H H 70 8.635 7.942 0.693 1
1 799 . 7 1 1 A 70 70 THR HA H 70 4.815 4.687 0.128 1
1 804 . 7 1 1 A 70 70 THR C C 70 176.223 175.515 0.708 1
1 805 . 7 1 1 A 70 70 THR CA C 70 63.944 62.169 1.775 1
1 806 . 7 1 1 A 70 70 THR CB C 70 69.727 70.463 -0.736 1
1 808 . 7 1 1 A 70 70 THR N N 70 110.394 111.149 -0.755 1
1 809 . 7 1 1 A 71 71 THR H H 71 8.069 7.929 0.140 1
1 810 . 7 1 1 A 71 71 THR HA H 71 4.566 4.614 -0.048 1
1 815 . 7 1 1 A 71 71 THR C C 71 176.213 175.905 0.308 1
1 816 . 7 1 1 A 71 71 THR CA C 71 61.683 62.058 -0.375 1
1 817 . 7 1 1 A 71 71 THR CB C 71 70.832 71.363 -0.531 1
1 819 . 7 1 1 A 71 71 THR N N 71 110.507 110.805 -0.298 1
1 820 . 7 1 1 A 72 72 GLY H H 72 7.990 7.848 0.142 1
1 821 . 7 1 1 A 72 72 GLY HA2 H 72 3.186 2.993 0.193 1
1 822 . 7 1 1 A 72 72 GLY HA3 H 72 2.516 3.534 -1.018 1
1 823 . 7 1 1 A 72 72 GLY C C 72 172.988 174.208 -1.220 1
1 824 . 7 1 1 A 72 72 GLY CA C 72 45.149 45.925 -0.776 1
1 825 . 7 1 1 A 72 72 GLY N N 72 110.788 112.348 -1.560 1
1 826 . 7 1 1 A 73 73 LEU H H 73 7.138 7.653 -0.515 1
1 827 . 7 1 1 A 73 73 LEU HA H 73 4.414 4.629 -0.215 1
1 837 . 7 1 1 A 73 73 LEU C C 73 176.836 175.248 1.588 1
1 838 . 7 1 1 A 73 73 LEU CA C 73 55.252 53.351 1.901 1
1 839 . 7 1 1 A 73 73 LEU CB C 73 43.574 44.342 -0.768 1
1 843 . 7 1 1 A 73 73 LEU N N 73 119.222 121.442 -2.220 1
1 844 . 7 1 1 A 74 74 ILE H H 74 8.925 8.810 0.115 1
1 845 . 7 1 1 A 74 74 ILE HA H 74 5.555 4.517 1.038 1
1 855 . 7 1 1 A 74 74 ILE C C 74 175.978 175.411 0.567 1
1 856 . 7 1 1 A 74 74 ILE CA C 74 60.100 61.091 -0.991 1
1 857 . 7 1 1 A 74 74 ILE CB C 74 38.550 37.990 0.560 1
1 861 . 7 1 1 A 74 74 ILE N N 74 129.871 127.141 2.730 1
1 862 . 7 1 1 A 75 75 THR H H 75 9.161 8.491 0.670 1
1 863 . 7 1 1 A 75 75 THR HA H 75 5.375 5.598 -0.223 1
1 868 . 7 1 1 A 75 75 THR C C 75 174.798 173.152 1.646 1
1 869 . 7 1 1 A 75 75 THR CA C 75 58.796 59.477 -0.681 1
1 870 . 7 1 1 A 75 75 THR CB C 75 72.978 72.471 0.507 1
1 872 . 7 1 1 A 75 75 THR N N 75 117.522 117.761 -0.239 1
1 873 . 7 1 1 A 76 76 VAL H H 76 8.327 8.842 -0.515 1
1 874 . 7 1 1 A 76 76 VAL HA H 76 3.973 4.087 -0.114 1
1 882 . 7 1 1 A 76 76 VAL C C 76 176.495 176.015 0.480 1
1 883 . 7 1 1 A 76 76 VAL CA C 76 64.085 61.718 2.367 1
1 884 . 7 1 1 A 76 76 VAL CB C 76 32.863 31.805 1.058 1
1 887 . 7 1 1 A 76 76 VAL N N 76 120.876 121.314 -0.438 1
1 888 . 7 1 1 A 77 77 GLN H H 77 9.525 9.231 0.294 1
1 889 . 7 1 1 A 77 77 GLN HA H 77 4.702 4.241 0.461 1
1 896 . 7 1 1 A 77 77 GLN C C 77 173.838 175.439 -1.601 1
1 897 . 7 1 1 A 77 77 GLN CA C 77 55.728 57.205 -1.477 1
1 898 . 7 1 1 A 77 77 GLN CB C 77 30.762 30.093 0.669 1
1 900 . 7 1 1 A 77 77 GLN N N 77 129.825 128.834 0.991 1
1 902 . 7 1 1 A 78 78 ARG H H 78 7.621 7.216 0.405 1
1 903 . 7 1 1 A 78 78 ARG HA H 78 4.347 4.632 -0.285 1
1 910 . 7 1 1 A 78 78 ARG C C 78 172.304 175.114 -2.810 1
1 911 . 7 1 1 A 78 78 ARG CA C 78 54.634 53.959 0.675 1
1 912 . 7 1 1 A 78 78 ARG CB C 78 34.685 34.781 -0.096 1
1 915 . 7 1 1 A 78 78 ARG N N 78 120.595 117.374 3.221 1
1 916 . 7 1 1 A 79 79 SER H H 79 7.958 8.431 -0.473 1
1 917 . 7 1 1 A 79 79 SER HA H 79 4.030 4.343 -0.313 1
1 920 . 7 1 1 A 79 79 SER C C 79 174.311 174.384 -0.073 1
1 921 . 7 1 1 A 79 79 SER CA C 79 59.889 59.570 0.319 1
1 922 . 7 1 1 A 79 79 SER CB C 79 63.548 64.067 -0.519 1
1 923 . 7 1 1 A 79 79 SER N N 79 112.565 117.837 -5.272 1
1 924 . 7 1 1 A 80 80 LEU H H 80 8.715 8.482 0.233 1
1 925 . 7 1 1 A 80 80 LEU HA H 80 4.114 5.089 -0.975 1
1 935 . 7 1 1 A 80 80 LEU C C 80 176.057 175.791 0.266 1
1 936 . 7 1 1 A 80 80 LEU CA C 80 55.091 53.442 1.649 1
1 937 . 7 1 1 A 80 80 LEU CB C 80 42.341 45.863 -3.522 1
1 941 . 7 1 1 A 80 80 LEU N N 80 123.070 123.548 -0.478 1
1 942 . 7 1 1 A 81 81 ASP H H 81 7.298 8.700 -1.402 1
1 943 . 7 1 1 A 81 81 ASP HA H 81 4.725 5.372 -0.647 1
1 946 . 7 1 1 A 81 81 ASP C C 81 175.939 176.131 -0.192 1
1 947 . 7 1 1 A 81 81 ASP CA C 81 53.664 52.786 0.878 1
1 948 . 7 1 1 A 81 81 ASP CB C 81 42.947 43.819 -0.872 1
1 949 . 7 1 1 A 81 81 ASP N N 81 115.229 120.432 -5.203 1
1 950 . 7 1 1 A 82 82 ARG H H 82 9.289 8.811 0.478 1
1 951 . 7 1 1 A 82 82 ARG HA H 82 4.416 4.259 0.157 1
1 959 . 7 1 1 A 82 82 ARG C C 82 176.406 177.976 -1.570 1
1 960 . 7 1 1 A 82 82 ARG CA C 82 56.397 58.982 -2.585 1
1 961 . 7 1 1 A 82 82 ARG CB C 82 30.638 30.105 0.533 1
1 964 . 7 1 1 A 82 82 ARG N N 82 123.174 125.911 -2.737 1
1 966 . 7 1 1 A 83 83 GLU H H 83 8.468 8.312 0.156 1
1 967 . 7 1 1 A 83 83 GLU HA H 83 3.982 4.112 -0.130 1
1 972 . 7 1 1 A 83 83 GLU C C 83 177.740 178.583 -0.843 1
1 973 . 7 1 1 A 83 83 GLU CA C 83 58.425 59.551 -1.126 1
1 974 . 7 1 1 A 83 83 GLU CB C 83 29.701 29.401 0.300 1
1 976 . 7 1 1 A 83 83 GLU N N 83 119.549 117.285 2.264 1
1 977 . 7 1 1 A 84 84 GLU H H 84 8.033 7.819 0.214 1
1 978 . 7 1 1 A 84 84 GLU HA H 84 4.206 4.214 -0.008 1
1 983 . 7 1 1 A 84 84 GLU C C 84 176.837 175.818 1.019 1
1 984 . 7 1 1 A 84 84 GLU CA C 84 58.056 58.642 -0.586 1
1 985 . 7 1 1 A 84 84 GLU CB C 84 30.432 30.856 -0.424 1
1 987 . 7 1 1 A 84 84 GLU N N 84 118.333 119.425 -1.092 1
1 988 . 7 1 1 A 85 85 THR H H 85 7.651 7.468 0.183 1
1 989 . 7 1 1 A 85 85 THR HA H 85 4.307 4.693 -0.386 1
1 994 . 7 1 1 A 85 85 THR C C 85 171.568 173.380 -1.812 1
1 995 . 7 1 1 A 85 85 THR CA C 85 61.387 59.345 2.042 1
1 996 . 7 1 1 A 85 85 THR CB C 85 69.963 70.603 -0.640 1
1 998 . 7 1 1 A 85 85 THR N N 85 112.444 112.865 -0.421 1
1 999 . 7 1 1 A 86 86 ALA H H 86 8.639 8.564 0.075 1
1 1000 . 7 1 1 A 86 86 ALA HA H 86 4.603 4.424 0.179 1
1 1004 . 7 1 1 A 86 86 ALA C C 86 175.560 177.074 -1.514 1
1 1005 . 7 1 1 A 86 86 ALA CA C 86 52.156 53.431 -1.275 1
1 1006 . 7 1 1 A 86 86 ALA CB C 86 20.378 20.447 -0.069 1
1 1007 . 7 1 1 A 86 86 ALA N N 86 127.705 127.452 0.253 1
1 1008 . 7 1 1 A 87 87 ILE H H 87 7.663 7.566 0.097 1
1 1009 . 7 1 1 A 87 87 ILE HA H 87 4.828 4.815 0.013 1
1 1019 . 7 1 1 A 87 87 ILE C C 87 174.537 174.475 0.062 1
1 1020 . 7 1 1 A 87 87 ILE CA C 87 60.329 59.568 0.761 1
1 1021 . 7 1 1 A 87 87 ILE CB C 87 41.090 41.292 -0.202 1
1 1025 . 7 1 1 A 87 87 ILE N N 87 118.712 117.212 1.500 1
1 1026 . 7 1 1 A 88 88 HIS H H 88 9.098 9.087 0.011 1
1 1027 . 7 1 1 A 88 88 HIS HA H 88 4.576 5.113 -0.537 1
1 1032 . 7 1 1 A 88 88 HIS C C 88 174.354 173.979 0.375 1
1 1033 . 7 1 1 A 88 88 HIS CA C 88 54.740 54.234 0.506 1
1 1034 . 7 1 1 A 88 88 HIS CB C 88 33.955 31.783 2.172 1
1 1037 . 7 1 1 A 88 88 HIS N N 88 126.285 124.420 1.865 1
1 1038 . 7 1 1 A 89 89 LYS H H 89 8.957 8.972 -0.015 1
1 1039 . 7 1 1 A 89 89 LYS HA H 89 4.873 4.656 0.217 1
1 1048 . 7 1 1 A 89 89 LYS C C 89 175.906 175.580 0.326 1
1 1049 . 7 1 1 A 89 89 LYS CA C 89 55.269 55.497 -0.228 1
1 1050 . 7 1 1 A 89 89 LYS CB C 89 32.945 33.272 -0.327 1
1 1054 . 7 1 1 A 89 89 LYS N N 89 124.332 124.552 -0.220 1
1 1055 . 7 1 1 A 90 90 VAL H H 90 9.174 9.063 0.111 1
1 1056 . 7 1 1 A 90 90 VAL HA H 90 4.227 4.711 -0.484 1
1 1064 . 7 1 1 A 90 90 VAL C C 90 174.168 174.696 -0.528 1
1 1065 . 7 1 1 A 90 90 VAL CA C 90 61.369 61.221 0.148 1
1 1066 . 7 1 1 A 90 90 VAL CB C 90 34.082 32.992 1.090 1
1 1069 . 7 1 1 A 90 90 VAL N N 90 124.319 125.433 -1.114 1
1 1070 . 7 1 1 A 91 91 THR H H 91 6.697 8.810 -2.113 1
1 1071 . 7 1 1 A 91 91 THR HA H 91 5.163 4.693 0.470 1
1 1076 . 7 1 1 A 91 91 THR C C 91 173.812 174.254 -0.442 1
1 1077 . 7 1 1 A 91 91 THR CA C 91 61.935 62.528 -0.593 1
1 1078 . 7 1 1 A 91 91 THR CB C 91 70.412 70.027 0.385 1
1 1080 . 7 1 1 A 91 91 THR N N 91 122.637 122.470 0.167 1
1 1081 . 7 1 1 A 92 92 VAL H H 92 9.292 8.527 0.765 1
1 1082 . 7 1 1 A 92 92 VAL HA H 92 4.736 4.828 -0.092 1
1 1090 . 7 1 1 A 92 92 VAL C C 92 173.160 174.385 -1.225 1
1 1091 . 7 1 1 A 92 92 VAL CA C 92 60.982 60.668 0.314 1
1 1092 . 7 1 1 A 92 92 VAL CB C 92 35.130 34.344 0.786 1
1 1095 . 7 1 1 A 92 92 VAL N N 92 128.265 126.220 2.045 1
1 1096 . 7 1 1 A 93 93 LEU H H 93 9.495 8.907 0.588 1
1 1097 . 7 1 1 A 93 93 LEU HA H 93 5.628 5.848 -0.220 1
1 1107 . 7 1 1 A 93 93 LEU C C 93 176.274 175.527 0.747 1
1 1108 . 7 1 1 A 93 93 LEU CA C 93 52.773 53.525 -0.752 1
1 1109 . 7 1 1 A 93 93 LEU CB C 93 43.454 44.651 -1.197 1
1 1113 . 7 1 1 A 93 93 LEU N N 93 126.350 126.808 -0.458 1
1 1114 . 7 1 1 A 94 94 ALA H H 94 8.688 8.783 -0.095 1
1 1115 . 7 1 1 A 94 94 ALA HA H 94 4.986 5.023 -0.037 1
1 1119 . 7 1 1 A 94 94 ALA C C 94 175.787 175.495 0.292 1
1 1120 . 7 1 1 A 94 94 ALA CA C 94 49.610 50.389 -0.779 1
1 1121 . 7 1 1 A 94 94 ALA CB C 94 21.463 20.080 1.383 1
1 1122 . 7 1 1 A 94 94 ALA N N 94 123.429 127.510 -4.081 1
1 1123 . 7 1 1 A 95 95 SER H H 95 8.401 8.730 -0.329 1
1 1124 . 7 1 1 A 95 95 SER HA H 95 4.828 5.108 -0.280 1
1 1127 . 7 1 1 A 95 95 SER C C 95 174.327 173.638 0.689 1
1 1128 . 7 1 1 A 95 95 SER CA C 95 56.239 56.332 -0.093 1
1 1129 . 7 1 1 A 95 95 SER CB C 95 65.561 64.467 1.094 1
1 1130 . 7 1 1 A 95 95 SER N N 95 114.418 119.728 -5.310 1
1 1131 . 7 1 1 A 96 96 ASP H H 96 8.690 8.788 -0.098 1
1 1132 . 7 1 1 A 96 96 ASP HA H 96 4.908 4.814 0.094 1
1 1135 . 7 1 1 A 96 96 ASP C C 96 177.096 176.878 0.218 1
1 1136 . 7 1 1 A 96 96 ASP CA C 96 52.818 54.644 -1.826 1
1 1137 . 7 1 1 A 96 96 ASP CB C 96 41.253 42.047 -0.794 1
1 1138 . 7 1 1 A 96 96 ASP N N 96 125.624 124.741 0.883 1
1 1139 . 7 1 1 A 97 97 GLY H H 97 8.524 7.361 1.163 1
1 1140 . 7 1 1 A 97 97 GLY HA2 H 97 4.320 4.117 0.203 1
1 1141 . 7 1 1 A 97 97 GLY HA3 H 97 3.620 4.119 -0.499 1
1 1142 . 7 1 1 A 97 97 GLY C C 97 174.620 173.607 1.013 1
1 1143 . 7 1 1 A 97 97 GLY CA C 97 45.422 45.647 -0.225 1
1 1144 . 7 1 1 A 97 97 GLY N N 97 109.283 106.129 3.154 1
1 1145 . 7 1 1 A 98 98 SER H H 98 8.575 7.756 0.819 1
1 1146 . 7 1 1 A 98 98 SER HA H 98 4.607 4.824 -0.217 1
1 1149 . 7 1 1 A 98 98 SER C C 98 174.478 175.073 -0.595 1
1 1150 . 7 1 1 A 98 98 SER CA C 98 59.095 57.027 2.068 1
1 1151 . 7 1 1 A 98 98 SER CB C 98 64.800 66.174 -1.374 1
1 1152 . 7 1 1 A 98 98 SER N N 98 116.640 114.447 2.193 1
1 1153 . 7 1 1 A 99 99 SER H H 99 8.945 8.655 0.290 1
1 1154 . 7 1 1 A 99 99 SER HA H 99 4.530 4.275 0.255 1
1 1157 . 7 1 1 A 99 99 SER C C 99 174.491 174.733 -0.242 1
1 1158 . 7 1 1 A 99 99 SER CA C 99 58.460 61.469 -3.009 1
1 1159 . 7 1 1 A 99 99 SER CB C 99 64.146 63.023 1.123 1
1 1160 . 7 1 1 A 99 99 SER N N 99 117.676 116.850 0.826 1
1 1161 . 7 1 1 A 100 100 THR H H 100 8.411 7.778 0.633 1
1 1162 . 7 1 1 A 100 100 THR HA H 100 4.490 4.857 -0.367 1
1 1167 . 7 1 1 A 100 100 THR C C 100 172.766 172.400 0.366 1
1 1168 . 7 1 1 A 100 100 THR CA C 100 60.629 58.502 2.127 1
1 1169 . 7 1 1 A 100 100 THR CB C 100 69.778 70.909 -1.131 1
1 1171 . 7 1 1 A 100 100 THR N N 100 118.401 111.575 6.826 1
1 1172 . 7 1 1 A 101 101 PRO HA H 101 4.631 4.582 0.049 1
1 1179 . 7 1 1 A 101 101 PRO C C 101 177.227 176.531 0.696 1
1 1180 . 7 1 1 A 101 101 PRO CA C 101 63.097 62.260 0.837 1
1 1181 . 7 1 1 A 101 101 PRO CB C 101 32.917 32.544 0.373 1
1 1184 . 7 1 1 A 102 102 ALA H H 102 8.497 7.872 0.625 1
1 1185 . 7 1 1 A 102 102 ALA HA H 102 4.619 4.656 -0.037 1
1 1189 . 7 1 1 A 102 102 ALA C C 102 176.542 177.935 -1.393 1
1 1190 . 7 1 1 A 102 102 ALA CA C 102 51.390 52.376 -0.986 1
1 1191 . 7 1 1 A 102 102 ALA CB C 102 20.815 19.846 0.969 1
1 1192 . 7 1 1 A 102 102 ALA N N 102 124.487 123.231 1.256 1
1 1193 . 7 1 1 A 103 103 ARG H H 103 8.663 9.150 -0.487 1
1 1194 . 7 1 1 A 103 103 ARG HA H 103 5.515 5.156 0.359 1
1 1201 . 7 1 1 A 103 103 ARG C C 103 174.539 175.053 -0.514 1
1 1202 . 7 1 1 A 103 103 ARG CA C 103 55.164 54.634 0.530 1
1 1203 . 7 1 1 A 103 103 ARG CB C 103 34.393 33.540 0.853 1
1 1206 . 7 1 1 A 103 103 ARG N N 103 119.596 118.904 0.692 1
1 1207 . 7 1 1 A 104 104 ALA H H 104 9.027 8.240 0.787 1
1 1208 . 7 1 1 A 104 104 ALA HA H 104 4.782 5.089 -0.307 1
1 1212 . 7 1 1 A 104 104 ALA C C 104 176.276 175.510 0.766 1
1 1213 . 7 1 1 A 104 104 ALA CA C 104 50.297 51.202 -0.905 1
1 1214 . 7 1 1 A 104 104 ALA CB C 104 20.810 21.990 -1.180 1
1 1215 . 7 1 1 A 104 104 ALA N N 104 126.962 122.508 4.454 1
1 1216 . 7 1 1 A 105 105 THR H H 105 8.384 8.831 -0.447 1
1 1217 . 7 1 1 A 105 105 THR HA H 105 4.954 4.909 0.045 1
1 1222 . 7 1 1 A 105 105 THR C C 105 173.243 173.821 -0.578 1
1 1223 . 7 1 1 A 105 105 THR CA C 105 61.475 62.148 -0.673 1
1 1224 . 7 1 1 A 105 105 THR CB C 105 70.569 70.544 0.025 1
1 1226 . 7 1 1 A 105 105 THR N N 105 115.327 119.012 -3.685 1
1 1227 . 7 1 1 A 106 106 VAL H H 106 8.970 8.717 0.253 1
1 1228 . 7 1 1 A 106 106 VAL HA H 106 4.702 4.692 0.010 1
1 1236 . 7 1 1 A 106 106 VAL C C 106 174.743 175.229 -0.486 1
1 1237 . 7 1 1 A 106 106 VAL CA C 106 59.712 60.909 -1.197 1
1 1238 . 7 1 1 A 106 106 VAL CB C 106 34.327 33.547 0.780 1
1 1241 . 7 1 1 A 106 106 VAL N N 106 126.226 127.260 -1.034 1
1 1242 . 7 1 1 A 107 107 THR H H 107 8.833 8.471 0.362 1
1 1243 . 7 1 1 A 107 107 THR HA H 107 4.862 4.418 0.444 1
1 1248 . 7 1 1 A 107 107 THR C C 107 172.970 174.132 -1.162 1
1 1249 . 7 1 1 A 107 107 THR CA C 107 62.322 63.481 -1.159 1
1 1250 . 7 1 1 A 107 107 THR CB C 107 69.463 68.927 0.536 1
1 1252 . 7 1 1 A 107 107 THR N N 107 125.403 121.890 3.513 1
1 1253 . 7 1 1 A 108 108 ILE H H 108 9.234 8.654 0.580 1
1 1254 . 7 1 1 A 108 108 ILE HA H 108 4.178 4.650 -0.472 1
1 1264 . 7 1 1 A 108 108 ILE C C 108 174.087 175.036 -0.949 1
1 1265 . 7 1 1 A 108 108 ILE CA C 108 60.365 60.527 -0.162 1
1 1266 . 7 1 1 A 108 108 ILE CB C 108 39.745 39.548 0.197 1
1 1270 . 7 1 1 A 108 108 ILE N N 108 127.152 128.436 -1.284 1
1 1271 . 7 1 1 A 109 109 ASN H H 109 8.723 9.262 -0.539 1
1 1272 . 7 1 1 A 109 109 ASN HA H 109 5.147 5.333 -0.186 1
1 1277 . 7 1 1 A 109 109 ASN C C 109 173.592 174.816 -1.224 1
1 1278 . 7 1 1 A 109 109 ASN CA C 109 52.501 53.015 -0.514 1
1 1279 . 7 1 1 A 109 109 ASN CB C 109 40.791 40.447 0.344 1
1 1280 . 7 1 1 A 109 109 ASN N N 109 126.866 126.206 0.660 1
1 1282 . 7 1 1 A 110 110 VAL H H 110 9.046 8.249 0.797 1
1 1283 . 7 1 1 A 110 110 VAL HA H 110 5.081 4.964 0.117 1
1 1291 . 7 1 1 A 110 110 VAL C C 110 176.921 176.116 0.805 1
1 1292 . 7 1 1 A 110 110 VAL CA C 110 61.634 61.408 0.226 1
1 1293 . 7 1 1 A 110 110 VAL CB C 110 31.809 33.140 -1.331 1
1 1296 . 7 1 1 A 110 110 VAL N N 110 126.070 121.703 4.367 1
1 1297 . 7 1 1 A 111 111 THR H H 111 9.197 8.729 0.468 1
1 1298 . 7 1 1 A 111 111 THR HA H 111 4.566 5.158 -0.592 1
1 1303 . 7 1 1 A 111 111 THR C C 111 174.087 173.863 0.224 1
1 1304 . 7 1 1 A 111 111 THR CA C 111 61.145 60.026 1.119 1
1 1305 . 7 1 1 A 111 111 THR CB C 111 70.706 71.465 -0.759 1
1 1307 . 7 1 1 A 111 111 THR N N 111 121.425 118.549 2.876 1
1 1308 . 7 1 1 A 112 112 ASP H H 112 8.435 8.786 -0.351 1
1 1309 . 7 1 1 A 112 112 ASP HA H 112 4.656 5.033 -0.377 1
1 1312 . 7 1 1 A 112 112 ASP C C 112 176.745 177.086 -0.341 1
1 1313 . 7 1 1 A 112 112 ASP CA C 112 54.158 53.140 1.018 1
1 1314 . 7 1 1 A 112 112 ASP CB C 112 41.575 42.725 -1.150 1
1 1315 . 7 1 1 A 112 112 ASP N N 112 119.566 120.809 -1.243 1
1 1316 . 7 1 1 A 113 113 VAL H H 113 8.629 8.604 0.025 1
1 1317 . 7 1 1 A 113 113 VAL HA H 113 4.078 4.206 -0.128 1
1 1325 . 7 1 1 A 113 113 VAL C C 113 175.247 176.247 -1.000 1
1 1326 . 7 1 1 A 113 113 VAL CA C 113 62.533 63.457 -0.924 1
1 1327 . 7 1 1 A 113 113 VAL CB C 113 32.534 32.477 0.057 1
1 1330 . 7 1 1 A 113 113 VAL N N 113 119.356 119.680 -0.324 1
1 4 . 8 1 1 A 2 2 SER H H 2 8.289 8.447 -0.158 1
1 5 . 8 1 1 A 2 2 SER HA H 2 4.530 5.209 -0.679 1
1 7 . 8 1 1 A 2 2 SER C C 2 174.868 172.954 1.914 1
1 8 . 8 1 1 A 2 2 SER CA C 2 58.284 56.095 2.189 1
1 9 . 8 1 1 A 2 2 SER CB C 2 63.769 66.381 -2.612 1
1 10 . 8 1 1 A 2 2 SER N N 2 115.842 115.908 -0.066 1
1 11 . 8 1 1 A 3 3 SER H H 3 8.490 8.886 -0.396 1
1 12 . 8 1 1 A 3 3 SER HA H 3 4.496 4.680 -0.184 1
1 14 . 8 1 1 A 3 3 SER C C 3 175.043 174.384 0.659 1
1 15 . 8 1 1 A 3 3 SER CA C 3 58.549 58.055 0.494 1
1 16 . 8 1 1 A 3 3 SER CB C 3 63.687 63.457 0.230 1
1 17 . 8 1 1 A 3 3 SER N N 3 117.930 116.570 1.360 1
1 18 . 8 1 1 A 4 4 GLY H H 4 8.482 8.519 -0.037 1
1 19 . 8 1 1 A 4 4 GLY C C 4 174.344 174.337 0.007 1
1 20 . 8 1 1 A 4 4 GLY CA C 4 45.536 45.808 -0.272 1
1 21 . 8 1 1 A 4 4 GLY N N 4 110.985 109.504 1.481 1
1 22 . 8 1 1 A 6 6 SER HA H 6 4.508 4.422 0.086 1
1 24 . 8 1 1 A 6 6 SER C C 6 175.026 175.254 -0.228 1
1 25 . 8 1 1 A 6 6 SER CA C 6 58.584 61.480 -2.896 1
1 26 . 8 1 1 A 6 6 SER CB C 6 63.646 63.874 -0.228 1
1 27 . 8 1 1 A 7 7 GLY H H 7 8.419 7.680 0.739 1
1 28 . 8 1 1 A 7 7 GLY HA2 H 7 3.993 4.165 -0.172 1
1 29 . 8 1 1 A 7 7 GLY C C 7 173.995 171.723 2.272 1
1 30 . 8 1 1 A 7 7 GLY CA C 7 45.466 44.890 0.576 1
1 31 . 8 1 1 A 7 7 GLY N N 7 110.615 105.099 5.516 1
1 32 . 8 1 1 A 8 8 ASN H H 8 8.322 8.916 -0.594 1
1 33 . 8 1 1 A 8 8 ASN HA H 8 4.736 5.235 -0.499 1
1 38 . 8 1 1 A 8 8 ASN C C 8 174.907 174.516 0.391 1
1 39 . 8 1 1 A 8 8 ASN CA C 8 53.259 52.565 0.694 1
1 40 . 8 1 1 A 8 8 ASN CB C 8 39.127 40.788 -1.661 1
1 41 . 8 1 1 A 8 8 ASN N N 8 118.602 122.982 -4.380 1
1 43 . 8 1 1 A 9 9 ASP H H 9 8.370 8.728 -0.358 1
1 44 . 8 1 1 A 9 9 ASP HA H 9 4.594 5.018 -0.424 1
1 47 . 8 1 1 A 9 9 ASP C C 9 175.765 177.027 -1.262 1
1 48 . 8 1 1 A 9 9 ASP CA C 9 54.440 53.329 1.111 1
1 49 . 8 1 1 A 9 9 ASP CB C 9 40.898 42.577 -1.679 1
1 50 . 8 1 1 A 9 9 ASP N N 9 120.504 121.763 -1.259 1
1 51 . 8 1 1 A 10 10 ASN H H 10 8.382 8.684 -0.302 1
1 52 . 8 1 1 A 10 10 ASN HA H 10 4.691 4.787 -0.096 1
1 57 . 8 1 1 A 10 10 ASN C C 10 174.383 174.479 -0.096 1
1 58 . 8 1 1 A 10 10 ASN CA C 10 53.241 52.807 0.434 1
1 59 . 8 1 1 A 10 10 ASN CB C 10 38.674 37.635 1.039 1
1 60 . 8 1 1 A 10 10 ASN N N 10 119.406 118.051 1.355 1
1 62 . 8 1 1 A 11 11 ARG H H 11 7.942 7.857 0.085 1
1 63 . 8 1 1 A 11 11 ARG HA H 11 4.684 4.810 -0.126 1
1 70 . 8 1 1 A 11 11 ARG C C 11 173.640 173.471 0.169 1
1 71 . 8 1 1 A 11 11 ARG CA C 11 54.246 54.132 0.114 1
1 72 . 8 1 1 A 11 11 ARG CB C 11 30.337 33.449 -3.112 1
1 75 . 8 1 1 A 11 11 ARG N N 11 121.145 116.813 4.332 1
1 76 . 8 1 1 A 12 12 PRO HA H 12 4.507 4.551 -0.044 1
1 83 . 8 1 1 A 12 12 PRO CA C 12 62.714 62.496 0.218 1
1 84 . 8 1 1 A 12 12 PRO CB C 12 31.942 33.127 -1.185 1
1 87 . 8 1 1 A 13 13 VAL H H 13 8.252 8.311 -0.059 1
1 88 . 8 1 1 A 13 13 VAL HA H 13 4.159 4.347 -0.188 1
1 96 . 8 1 1 A 13 13 VAL CA C 13 61.409 60.621 0.788 1
1 97 . 8 1 1 A 13 13 VAL CB C 13 34.858 35.567 -0.709 1
1 100 . 8 1 1 A 13 13 VAL N N 13 118.395 119.220 -0.825 1
1 101 . 8 1 1 A 14 14 PHE H H 14 8.725 8.630 0.095 1
1 102 . 8 1 1 A 14 14 PHE HA H 14 4.781 4.630 0.151 1
1 110 . 8 1 1 A 14 14 PHE CA C 14 58.594 58.614 -0.020 1
1 111 . 8 1 1 A 14 14 PHE CB C 14 39.594 39.404 0.190 1
1 117 . 8 1 1 A 14 14 PHE N N 14 122.950 126.325 -3.375 1
1 118 . 8 1 1 A 15 15 LYS H H 15 8.885 9.041 -0.156 1
1 119 . 8 1 1 A 15 15 LYS HA H 15 4.130 4.020 0.110 1
1 128 . 8 1 1 A 15 15 LYS C C 15 177.027 176.022 1.005 1
1 129 . 8 1 1 A 15 15 LYS CA C 15 58.478 59.463 -0.985 1
1 130 . 8 1 1 A 15 15 LYS CB C 15 32.748 32.627 0.121 1
1 134 . 8 1 1 A 15 15 LYS N N 15 123.863 123.874 -0.011 1
1 135 . 8 1 1 A 16 16 GLU H H 16 8.091 8.059 0.032 1
1 136 . 8 1 1 A 16 16 GLU HA H 16 4.438 4.670 -0.232 1
1 141 . 8 1 1 A 16 16 GLU C C 16 175.947 177.282 -1.335 1
1 142 . 8 1 1 A 16 16 GLU CA C 16 56.045 55.153 0.892 1
1 143 . 8 1 1 A 16 16 GLU CB C 16 30.766 32.386 -1.620 1
1 145 . 8 1 1 A 16 16 GLU N N 16 117.026 116.299 0.727 1
1 146 . 8 1 1 A 17 17 GLY H H 17 8.421 8.802 -0.381 1
1 147 . 8 1 1 A 17 17 GLY HA2 H 17 3.993 3.885 0.108 1
1 148 . 8 1 1 A 17 17 GLY HA3 H 17 3.913 3.906 0.007 1
1 149 . 8 1 1 A 17 17 GLY C C 17 173.564 174.424 -0.860 1
1 150 . 8 1 1 A 17 17 GLY CA C 17 45.448 47.699 -2.251 1
1 151 . 8 1 1 A 17 17 GLY N N 17 109.577 111.573 -1.996 1
1 152 . 8 1 1 A 18 18 GLN H H 18 7.858 7.955 -0.097 1
1 153 . 8 1 1 A 18 18 GLN HA H 18 5.065 4.977 0.088 1
1 160 . 8 1 1 A 18 18 GLN C C 18 174.596 174.803 -0.207 1
1 161 . 8 1 1 A 18 18 GLN CA C 18 55.110 54.527 0.583 1
1 162 . 8 1 1 A 18 18 GLN CB C 18 30.329 31.272 -0.943 1
1 164 . 8 1 1 A 18 18 GLN N N 18 120.202 119.267 0.935 1
1 166 . 8 1 1 A 19 19 VAL H H 19 8.216 8.708 -0.492 1
1 167 . 8 1 1 A 19 19 VAL HA H 19 4.450 4.715 -0.265 1
1 175 . 8 1 1 A 19 19 VAL C C 19 173.648 173.612 0.036 1
1 176 . 8 1 1 A 19 19 VAL CA C 19 60.788 60.349 0.439 1
1 177 . 8 1 1 A 19 19 VAL CB C 19 35.336 35.789 -0.453 1
1 180 . 8 1 1 A 19 19 VAL N N 19 121.257 126.089 -4.832 1
1 181 . 8 1 1 A 20 20 GLU H H 20 8.610 8.996 -0.386 1
1 182 . 8 1 1 A 20 20 GLU HA H 20 5.211 5.361 -0.150 1
1 187 . 8 1 1 A 20 20 GLU C C 20 174.783 175.329 -0.546 1
1 188 . 8 1 1 A 20 20 GLU CA C 20 54.793 54.840 -0.047 1
1 189 . 8 1 1 A 20 20 GLU CB C 20 32.058 32.716 -0.658 1
1 191 . 8 1 1 A 20 20 GLU N N 20 127.095 127.582 -0.487 1
1 192 . 8 1 1 A 21 21 VAL H H 21 8.727 8.957 -0.230 1
1 193 . 8 1 1 A 21 21 VAL HA H 21 4.633 5.031 -0.398 1
1 201 . 8 1 1 A 21 21 VAL C C 21 173.894 174.921 -1.027 1
1 202 . 8 1 1 A 21 21 VAL CA C 21 59.695 59.495 0.200 1
1 203 . 8 1 1 A 21 21 VAL CB C 21 35.865 35.100 0.765 1
1 206 . 8 1 1 A 21 21 VAL N N 21 120.489 120.866 -0.377 1
1 207 . 8 1 1 A 22 22 HIS H H 22 8.680 9.001 -0.321 1
1 208 . 8 1 1 A 22 22 HIS HA H 22 5.552 5.689 -0.137 1
1 212 . 8 1 1 A 22 22 HIS C C 22 174.298 173.638 0.660 1
1 213 . 8 1 1 A 22 22 HIS CA C 22 55.331 53.923 1.408 1
1 214 . 8 1 1 A 22 22 HIS CB C 22 32.369 31.914 0.455 1
1 216 . 8 1 1 A 22 22 HIS N N 22 124.991 120.460 4.531 1
1 217 . 8 1 1 A 23 23 ILE H H 23 9.179 8.830 0.349 1
1 218 . 8 1 1 A 23 23 ILE HA H 23 5.046 4.503 0.543 1
1 228 . 8 1 1 A 23 23 ILE C C 23 171.552 173.595 -2.043 1
1 229 . 8 1 1 A 23 23 ILE CA C 23 55.551 57.126 -1.575 1
1 230 . 8 1 1 A 23 23 ILE CB C 23 42.053 42.117 -0.064 1
1 234 . 8 1 1 A 23 23 ILE N N 23 123.121 123.449 -0.328 1
1 235 . 8 1 1 A 24 24 PRO HA H 24 4.816 4.935 -0.119 1
1 242 . 8 1 1 A 24 24 PRO C C 24 178.887 177.648 1.239 1
1 243 . 8 1 1 A 24 24 PRO CA C 24 62.216 62.570 -0.354 1
1 244 . 8 1 1 A 24 24 PRO CB C 24 32.895 32.614 0.281 1
1 247 . 8 1 1 A 25 25 GLU H H 25 8.399 8.240 0.159 1
1 248 . 8 1 1 A 25 25 GLU HA H 25 3.785 3.995 -0.210 1
1 253 . 8 1 1 A 25 25 GLU C C 25 175.244 178.223 -2.979 1
1 254 . 8 1 1 A 25 25 GLU CA C 25 58.425 59.225 -0.800 1
1 255 . 8 1 1 A 25 25 GLU CB C 25 30.011 28.947 1.064 1
1 257 . 8 1 1 A 25 25 GLU N N 25 117.706 122.056 -4.350 1
1 258 . 8 1 1 A 26 26 ASN H H 26 7.488 7.752 -0.264 1
1 259 . 8 1 1 A 26 26 ASN HA H 26 4.702 4.686 0.016 1
1 264 . 8 1 1 A 26 26 ASN C C 26 175.425 175.909 -0.484 1
1 265 . 8 1 1 A 26 26 ASN CA C 26 51.584 53.541 -1.957 1
1 266 . 8 1 1 A 26 26 ASN CB C 26 37.243 38.558 -1.315 1
1 267 . 8 1 1 A 26 26 ASN N N 26 112.383 117.746 -5.363 1
1 269 . 8 1 1 A 27 27 ALA H H 27 7.716 7.499 0.217 1
1 270 . 8 1 1 A 27 27 ALA HA H 27 4.409 4.256 0.153 1
1 274 . 8 1 1 A 27 27 ALA C C 27 175.850 175.932 -0.082 1
1 275 . 8 1 1 A 27 27 ALA CA C 27 51.037 51.084 -0.047 1
1 276 . 8 1 1 A 27 27 ALA CB C 27 18.152 18.760 -0.608 1
1 277 . 8 1 1 A 27 27 ALA N N 27 125.139 122.570 2.569 1
1 278 . 8 1 1 A 28 28 PRO HA H 28 4.422 4.531 -0.109 1
1 285 . 8 1 1 A 28 28 PRO C C 28 178.442 176.940 1.502 1
1 286 . 8 1 1 A 28 28 PRO CA C 28 62.067 62.838 -0.771 1
1 287 . 8 1 1 A 28 28 PRO CB C 28 32.642 32.315 0.327 1
1 290 . 8 1 1 A 29 29 VAL H H 29 8.691 8.329 0.362 1
1 291 . 8 1 1 A 29 29 VAL HA H 29 3.239 3.527 -0.288 1
1 299 . 8 1 1 A 29 29 VAL C C 29 176.887 177.081 -0.194 1
1 300 . 8 1 1 A 29 29 VAL CA C 29 65.812 64.354 1.458 1
1 301 . 8 1 1 A 29 29 VAL CB C 29 31.174 31.337 -0.163 1
1 304 . 8 1 1 A 29 29 VAL N N 29 123.592 122.576 1.016 1
1 305 . 8 1 1 A 30 30 GLY H H 30 9.197 8.995 0.202 1
1 306 . 8 1 1 A 30 30 GLY HA2 H 30 4.486 3.983 0.503 1
1 307 . 8 1 1 A 30 30 GLY HA3 H 30 3.581 3.984 -0.403 1
1 308 . 8 1 1 A 30 30 GLY C C 30 174.347 174.712 -0.365 1
1 309 . 8 1 1 A 30 30 GLY CA C 30 44.320 45.016 -0.696 1
1 310 . 8 1 1 A 30 30 GLY N N 30 116.042 115.247 0.795 1
1 311 . 8 1 1 A 31 31 THR H H 31 7.838 7.373 0.465 1
1 312 . 8 1 1 A 31 31 THR HA H 31 3.959 4.181 -0.222 1
1 317 . 8 1 1 A 31 31 THR C C 31 174.274 174.354 -0.080 1
1 318 . 8 1 1 A 31 31 THR CA C 31 65.160 62.916 2.244 1
1 319 . 8 1 1 A 31 31 THR CB C 31 69.972 69.113 0.859 1
1 321 . 8 1 1 A 31 31 THR N N 31 117.679 117.469 0.210 1
1 322 . 8 1 1 A 32 32 SER H H 32 9.022 8.645 0.377 1
1 323 . 8 1 1 A 32 32 SER HA H 32 4.273 4.876 -0.603 1
1 326 . 8 1 1 A 32 32 SER C C 32 172.692 174.328 -1.636 1
1 327 . 8 1 1 A 32 32 SER CA C 32 59.642 57.276 2.366 1
1 328 . 8 1 1 A 32 32 SER CB C 32 63.102 63.133 -0.031 1
1 329 . 8 1 1 A 32 32 SER N N 32 123.045 119.581 3.464 1
1 330 . 8 1 1 A 33 33 VAL H H 33 9.202 9.050 0.152 1
1 331 . 8 1 1 A 33 33 VAL HA H 33 3.844 3.970 -0.126 1
1 339 . 8 1 1 A 33 33 VAL C C 33 174.782 175.696 -0.914 1
1 340 . 8 1 1 A 33 33 VAL CA C 33 64.242 64.914 -0.672 1
1 341 . 8 1 1 A 33 33 VAL CB C 33 32.893 32.216 0.677 1
1 344 . 8 1 1 A 33 33 VAL N N 33 126.861 125.498 1.363 1
1 345 . 8 1 1 A 34 34 ILE H H 34 7.074 7.949 -0.875 1
1 346 . 8 1 1 A 34 34 ILE HA H 34 4.295 4.683 -0.388 1
1 356 . 8 1 1 A 34 34 ILE C C 34 170.577 172.996 -2.419 1
1 357 . 8 1 1 A 34 34 ILE CA C 34 59.500 59.179 0.321 1
1 358 . 8 1 1 A 34 34 ILE CB C 34 39.251 42.070 -2.819 1
1 362 . 8 1 1 A 34 34 ILE N N 34 111.445 119.174 -7.729 1
1 363 . 8 1 1 A 35 35 GLN H H 35 8.450 9.049 -0.599 1
1 364 . 8 1 1 A 35 35 GLN HA H 35 4.633 4.890 -0.257 1
1 371 . 8 1 1 A 35 35 GLN C C 35 174.354 174.003 0.351 1
1 372 . 8 1 1 A 35 35 GLN CA C 35 54.176 54.029 0.147 1
1 373 . 8 1 1 A 35 35 GLN CB C 35 29.456 31.859 -2.403 1
1 375 . 8 1 1 A 35 35 GLN N N 35 127.342 128.917 -1.575 1
1 377 . 8 1 1 A 36 36 LEU H H 36 7.761 8.476 -0.715 1
1 378 . 8 1 1 A 36 36 LEU HA H 36 4.492 5.118 -0.626 1
1 388 . 8 1 1 A 36 36 LEU C C 36 175.543 175.332 0.211 1
1 389 . 8 1 1 A 36 36 LEU CA C 36 53.982 53.397 0.585 1
1 390 . 8 1 1 A 36 36 LEU CB C 36 42.776 42.899 -0.123 1
1 394 . 8 1 1 A 36 36 LEU N N 36 128.895 127.807 1.088 1
1 395 . 8 1 1 A 37 37 HIS H H 37 8.529 9.171 -0.642 1
1 396 . 8 1 1 A 37 37 HIS HA H 37 4.851 5.193 -0.342 1
1 400 . 8 1 1 A 37 37 HIS C C 37 172.985 173.854 -0.869 1
1 401 . 8 1 1 A 37 37 HIS CA C 37 55.833 54.403 1.430 1
1 402 . 8 1 1 A 37 37 HIS CB C 37 32.204 30.794 1.410 1
1 404 . 8 1 1 A 37 37 HIS N N 37 115.903 123.344 -7.441 1
1 405 . 8 1 1 A 38 38 ALA H H 38 8.474 8.889 -0.415 1
1 406 . 8 1 1 A 38 38 ALA HA H 38 4.691 5.089 -0.398 1
1 410 . 8 1 1 A 38 38 ALA C C 38 175.548 176.154 -0.606 1
1 411 . 8 1 1 A 38 38 ALA CA C 38 50.491 50.575 -0.084 1
1 412 . 8 1 1 A 38 38 ALA CB C 38 19.842 20.493 -0.651 1
1 413 . 8 1 1 A 38 38 ALA N N 38 128.891 127.916 0.975 1
1 414 . 8 1 1 A 39 39 THR H H 39 8.095 8.467 -0.372 1
1 415 . 8 1 1 A 39 39 THR HA H 39 4.336 5.081 -0.745 1
1 420 . 8 1 1 A 39 39 THR C C 39 173.553 174.374 -0.821 1
1 421 . 8 1 1 A 39 39 THR CA C 39 60.417 60.615 -0.198 1
1 422 . 8 1 1 A 39 39 THR CB C 39 70.912 71.110 -0.198 1
1 424 . 8 1 1 A 39 39 THR N N 39 110.982 114.325 -3.343 1
1 425 . 8 1 1 A 40 40 ASP H H 40 8.417 8.893 -0.476 1
1 426 . 8 1 1 A 40 40 ASP HA H 40 4.553 4.547 0.006 1
1 429 . 8 1 1 A 40 40 ASP C C 40 176.462 175.766 0.696 1
1 430 . 8 1 1 A 40 40 ASP CA C 40 54.158 56.201 -2.043 1
1 431 . 8 1 1 A 40 40 ASP CB C 40 41.517 41.627 -0.110 1
1 432 . 8 1 1 A 40 40 ASP N N 40 121.450 123.785 -2.335 1
1 433 . 8 1 1 A 41 41 ALA H H 41 8.435 7.814 0.621 1
1 434 . 8 1 1 A 41 41 ALA HA H 41 4.129 4.764 -0.635 1
1 438 . 8 1 1 A 41 41 ALA C C 41 177.718 176.647 1.071 1
1 439 . 8 1 1 A 41 41 ALA CA C 41 53.436 50.833 2.603 1
1 440 . 8 1 1 A 41 41 ALA CB C 41 19.183 21.549 -2.366 1
1 441 . 8 1 1 A 41 41 ALA N N 41 124.607 119.392 5.215 1
1 442 . 8 1 1 A 42 42 ASP H H 42 8.310 8.763 -0.453 1
1 443 . 8 1 1 A 42 42 ASP HA H 42 4.588 4.849 -0.261 1
1 446 . 8 1 1 A 42 42 ASP C C 42 176.546 176.530 0.016 1
1 447 . 8 1 1 A 42 42 ASP CA C 42 54.599 53.509 1.090 1
1 448 . 8 1 1 A 42 42 ASP CB C 42 41.146 41.032 0.114 1
1 449 . 8 1 1 A 42 42 ASP N N 42 118.030 120.349 -2.319 1
1 450 . 8 1 1 A 43 43 ILE H H 43 8.000 7.589 0.411 1
1 451 . 8 1 1 A 43 43 ILE HA H 43 4.130 4.295 -0.165 1
1 461 . 8 1 1 A 43 43 ILE C C 43 176.901 176.569 0.332 1
1 462 . 8 1 1 A 43 43 ILE CA C 43 61.740 60.508 1.232 1
1 463 . 8 1 1 A 43 43 ILE CB C 43 38.491 38.327 0.164 1
1 467 . 8 1 1 A 43 43 ILE N N 43 119.301 116.299 3.002 1
1 468 . 8 1 1 A 44 44 GLY H H 44 8.448 8.616 -0.168 1
1 469 . 8 1 1 A 44 44 GLY HA2 H 44 3.939 3.864 0.075 1
1 470 . 8 1 1 A 44 44 GLY HA3 H 44 3.939 3.864 0.075 1
1 471 . 8 1 1 A 44 44 GLY C C 44 174.393 173.832 0.561 1
1 472 . 8 1 1 A 44 44 GLY CA C 44 45.501 47.375 -1.874 1
1 473 . 8 1 1 A 44 44 GLY N N 44 111.333 114.679 -3.346 1
1 474 . 8 1 1 A 45 45 SER H H 45 8.061 7.866 0.195 1
1 475 . 8 1 1 A 45 45 SER HA H 45 4.416 5.103 -0.687 1
1 478 . 8 1 1 A 45 45 SER C C 45 174.480 173.068 1.412 1
1 479 . 8 1 1 A 45 45 SER CA C 45 58.478 56.214 2.264 1
1 480 . 8 1 1 A 45 45 SER CB C 45 63.943 66.703 -2.760 1
1 481 . 8 1 1 A 45 45 SER N N 45 115.551 115.621 -0.070 1
1 482 . 8 1 1 A 46 46 ASN H H 46 8.547 9.049 -0.502 1
1 483 . 8 1 1 A 46 46 ASN HA H 46 4.725 5.256 -0.531 1
1 488 . 8 1 1 A 46 46 ASN C C 46 175.031 173.792 1.239 1
1 489 . 8 1 1 A 46 46 ASN CA C 46 53.277 52.217 1.060 1
1 490 . 8 1 1 A 46 46 ASN CB C 46 38.798 42.367 -3.569 1
1 491 . 8 1 1 A 46 46 ASN N N 46 120.698 116.293 4.405 1
1 493 . 8 1 1 A 47 47 ALA H H 47 8.239 8.378 -0.139 1
1 494 . 8 1 1 A 47 47 ALA HA H 47 4.283 4.673 -0.390 1
1 498 . 8 1 1 A 47 47 ALA C C 47 177.240 176.641 0.599 1
1 499 . 8 1 1 A 47 47 ALA CA C 47 52.731 51.126 1.605 1
1 500 . 8 1 1 A 47 47 ALA CB C 47 19.594 20.812 -1.218 1
1 501 . 8 1 1 A 47 47 ALA N N 47 124.093 122.847 1.246 1
1 502 . 8 1 1 A 48 48 GLU H H 48 8.376 8.597 -0.221 1
1 503 . 8 1 1 A 48 48 GLU HA H 48 4.264 4.671 -0.407 1
1 508 . 8 1 1 A 48 48 GLU C C 48 175.702 175.126 0.576 1
1 509 . 8 1 1 A 48 48 GLU CA C 48 55.992 55.468 0.524 1
1 510 . 8 1 1 A 48 48 GLU CB C 48 30.210 30.061 0.149 1
1 512 . 8 1 1 A 48 48 GLU N N 48 119.750 118.517 1.233 1
1 513 . 8 1 1 A 49 49 ILE H H 49 7.806 8.536 -0.730 1
1 514 . 8 1 1 A 49 49 ILE HA H 49 3.919 4.308 -0.389 1
1 524 . 8 1 1 A 49 49 ILE C C 49 175.894 175.453 0.441 1
1 525 . 8 1 1 A 49 49 ILE CA C 49 60.559 60.690 -0.131 1
1 526 . 8 1 1 A 49 49 ILE CB C 49 37.860 37.669 0.191 1
1 530 . 8 1 1 A 49 49 ILE N N 49 122.772 126.148 -3.376 1
1 531 . 8 1 1 A 50 50 ARG H H 50 8.247 8.475 -0.228 1
1 532 . 8 1 1 A 50 50 ARG HA H 50 4.999 4.709 0.290 1
1 539 . 8 1 1 A 50 50 ARG C C 50 174.603 175.180 -0.577 1
1 540 . 8 1 1 A 50 50 ARG CA C 50 53.189 55.224 -2.035 1
1 541 . 8 1 1 A 50 50 ARG CB C 50 33.152 32.037 1.115 1
1 544 . 8 1 1 A 50 50 ARG N N 50 126.912 127.346 -0.434 1
1 545 . 8 1 1 A 51 51 TYR H H 51 9.041 9.176 -0.135 1
1 546 . 8 1 1 A 51 51 TYR HA H 51 5.395 5.412 -0.017 1
1 553 . 8 1 1 A 51 51 TYR C C 51 175.555 176.076 -0.521 1
1 554 . 8 1 1 A 51 51 TYR CA C 51 56.909 57.103 -0.194 1
1 555 . 8 1 1 A 51 51 TYR CB C 51 40.116 39.404 0.712 1
1 560 . 8 1 1 A 51 51 TYR N N 51 121.627 122.091 -0.464 1
1 561 . 8 1 1 A 52 52 ILE H H 52 8.850 8.950 -0.100 1
1 562 . 8 1 1 A 52 52 ILE HA H 52 4.576 4.918 -0.342 1
1 572 . 8 1 1 A 52 52 ILE C C 52 175.371 175.705 -0.334 1
1 573 . 8 1 1 A 52 52 ILE CA C 52 59.624 59.091 0.533 1
1 574 . 8 1 1 A 52 52 ILE CB C 52 42.895 40.492 2.403 1
1 578 . 8 1 1 A 52 52 ILE N N 52 117.697 119.257 -1.560 1
1 579 . 8 1 1 A 53 53 PHE H H 53 8.748 8.763 -0.015 1
1 580 . 8 1 1 A 53 53 PHE HA H 53 5.132 4.602 0.530 1
1 588 . 8 1 1 A 53 53 PHE C C 53 178.146 176.436 1.710 1
1 589 . 8 1 1 A 53 53 PHE CA C 53 57.667 57.777 -0.110 1
1 590 . 8 1 1 A 53 53 PHE CB C 53 39.614 39.466 0.148 1
1 596 . 8 1 1 A 53 53 PHE N N 53 121.433 122.045 -0.612 1
1 597 . 8 1 1 A 54 54 GLY H H 54 8.538 8.557 -0.019 1
1 598 . 8 1 1 A 54 54 GLY HA2 H 54 4.074 4.110 -0.036 1
1 599 . 8 1 1 A 54 54 GLY HA3 H 54 3.840 4.110 -0.270 1
1 600 . 8 1 1 A 54 54 GLY C C 54 174.530 172.886 1.644 1
1 601 . 8 1 1 A 54 54 GLY CA C 54 44.884 44.484 0.400 1
1 602 . 8 1 1 A 54 54 GLY N N 54 106.444 110.376 -3.932 1
1 603 . 8 1 1 A 55 55 ALA H H 55 8.594 8.113 0.481 1
1 604 . 8 1 1 A 55 55 ALA HA H 55 4.172 4.813 -0.641 1
1 608 . 8 1 1 A 55 55 ALA C C 55 178.718 177.132 1.586 1
1 609 . 8 1 1 A 55 55 ALA CA C 55 54.423 50.733 3.690 1
1 610 . 8 1 1 A 55 55 ALA CB C 55 19.059 21.222 -2.163 1
1 611 . 8 1 1 A 55 55 ALA N N 55 123.470 122.455 1.015 1
1 612 . 8 1 1 A 56 56 GLN H H 56 8.727 8.680 0.047 1
1 613 . 8 1 1 A 56 56 GLN HA H 56 4.367 3.723 0.644 1
1 620 . 8 1 1 A 56 56 GLN C C 56 176.134 174.729 1.405 1
1 621 . 8 1 1 A 56 56 GLN CA C 56 55.660 56.685 -1.025 1
1 622 . 8 1 1 A 56 56 GLN CB C 56 28.152 26.961 1.191 1
1 624 . 8 1 1 A 56 56 GLN N N 56 114.221 115.365 -1.144 1
1 626 . 8 1 1 A 57 57 VAL H H 57 7.204 7.803 -0.599 1
1 627 . 8 1 1 A 57 57 VAL HA H 57 3.889 4.153 -0.264 1
1 635 . 8 1 1 A 57 57 VAL C C 57 175.371 175.322 0.049 1
1 636 . 8 1 1 A 57 57 VAL CA C 57 63.908 61.545 2.363 1
1 637 . 8 1 1 A 57 57 VAL CB C 57 31.557 32.546 -0.989 1
1 640 . 8 1 1 A 57 57 VAL N N 57 121.341 119.579 1.762 1
1 641 . 8 1 1 A 58 58 ALA H H 58 8.920 8.533 0.387 1
1 642 . 8 1 1 A 58 58 ALA HA H 58 4.547 4.399 0.148 1
1 646 . 8 1 1 A 58 58 ALA C C 58 177.064 177.780 -0.716 1
1 647 . 8 1 1 A 58 58 ALA CA C 58 51.173 50.730 0.443 1
1 648 . 8 1 1 A 58 58 ALA CB C 58 17.842 17.724 0.118 1
1 649 . 8 1 1 A 58 58 ALA N N 58 132.726 130.804 1.922 1
1 650 . 8 1 1 A 59 59 PRO HA H 59 4.101 4.211 -0.110 1
1 657 . 8 1 1 A 59 59 PRO C C 59 179.482 178.524 0.958 1
1 658 . 8 1 1 A 59 59 PRO CA C 59 66.060 65.442 0.618 1
1 659 . 8 1 1 A 59 59 PRO CB C 59 31.951 31.841 0.110 1
1 662 . 8 1 1 A 60 60 ALA H H 60 8.706 8.251 0.455 1
1 663 . 8 1 1 A 60 60 ALA HA H 60 4.057 4.007 0.050 1
1 667 . 8 1 1 A 60 60 ALA C C 60 179.627 180.068 -0.441 1
1 668 . 8 1 1 A 60 60 ALA CA C 60 55.305 55.483 -0.178 1
1 669 . 8 1 1 A 60 60 ALA CB C 60 18.737 18.803 -0.066 1
1 670 . 8 1 1 A 60 60 ALA N N 60 117.882 118.660 -0.778 1
1 671 . 8 1 1 A 61 61 THR H H 61 7.312 8.060 -0.748 1
1 672 . 8 1 1 A 61 61 THR HA H 61 4.153 4.057 0.096 1
1 677 . 8 1 1 A 61 61 THR C C 61 175.824 176.382 -0.558 1
1 678 . 8 1 1 A 61 61 THR CA C 61 66.412 66.473 -0.061 1
1 679 . 8 1 1 A 61 61 THR CB C 61 68.787 68.200 0.587 1
1 681 . 8 1 1 A 61 61 THR N N 61 114.483 114.396 0.087 1
1 682 . 8 1 1 A 62 62 LYS H H 62 7.556 7.768 -0.212 1
1 683 . 8 1 1 A 62 62 LYS HA H 62 3.943 4.271 -0.328 1
1 692 . 8 1 1 A 62 62 LYS C C 62 176.884 178.885 -2.001 1
1 693 . 8 1 1 A 62 62 LYS CA C 62 59.095 58.712 0.383 1
1 694 . 8 1 1 A 62 62 LYS CB C 62 32.204 32.210 -0.006 1
1 698 . 8 1 1 A 62 62 LYS N N 62 118.994 119.188 -0.194 1
1 699 . 8 1 1 A 63 63 ARG H H 63 7.474 7.711 -0.237 1
1 700 . 8 1 1 A 63 63 ARG HA H 63 4.034 4.042 -0.008 1
1 707 . 8 1 1 A 63 63 ARG C C 63 177.574 178.698 -1.124 1
1 708 . 8 1 1 A 63 63 ARG CA C 63 58.143 59.078 -0.935 1
1 709 . 8 1 1 A 63 63 ARG CB C 63 30.755 29.799 0.956 1
1 712 . 8 1 1 A 63 63 ARG N N 63 114.251 120.546 -6.295 1
1 713 . 8 1 1 A 64 64 LEU H H 64 6.991 7.463 -0.472 1
1 714 . 8 1 1 A 64 64 LEU HA H 64 3.904 3.852 0.052 1
1 724 . 8 1 1 A 64 64 LEU C C 64 176.632 176.603 0.029 1
1 725 . 8 1 1 A 64 64 LEU CA C 64 56.503 57.728 -1.225 1
1 726 . 8 1 1 A 64 64 LEU CB C 64 42.929 41.571 1.358 1
1 730 . 8 1 1 A 64 64 LEU N N 64 116.109 118.992 -2.883 1
1 731 . 8 1 1 A 65 65 PHE H H 65 7.673 7.781 -0.108 1
1 732 . 8 1 1 A 65 65 PHE HA H 65 5.386 5.051 0.335 1
1 740 . 8 1 1 A 65 65 PHE C C 65 173.067 175.255 -2.188 1
1 741 . 8 1 1 A 65 65 PHE CA C 65 56.521 56.886 -0.365 1
1 742 . 8 1 1 A 65 65 PHE CB C 65 41.270 41.078 0.192 1
1 748 . 8 1 1 A 65 65 PHE N N 65 116.182 115.367 0.815 1
1 749 . 8 1 1 A 66 66 ALA H H 66 8.914 9.423 -0.509 1
1 750 . 8 1 1 A 66 66 ALA HA H 66 4.748 5.374 -0.626 1
1 754 . 8 1 1 A 66 66 ALA C C 66 175.223 175.140 0.083 1
1 755 . 8 1 1 A 66 66 ALA CA C 66 50.050 50.315 -0.265 1
1 756 . 8 1 1 A 66 66 ALA CB C 66 21.161 21.592 -0.431 1
1 757 . 8 1 1 A 66 66 ALA N N 66 122.870 124.935 -2.065 1
1 758 . 8 1 1 A 67 67 LEU H H 67 8.498 9.042 -0.544 1
1 759 . 8 1 1 A 67 67 LEU HA H 67 4.713 4.865 -0.152 1
1 769 . 8 1 1 A 67 67 LEU C C 67 175.146 175.252 -0.106 1
1 770 . 8 1 1 A 67 67 LEU CA C 67 52.518 53.689 -1.171 1
1 771 . 8 1 1 A 67 67 LEU CB C 67 45.308 43.851 1.457 1
1 775 . 8 1 1 A 67 67 LEU N N 67 122.208 125.531 -3.323 1
1 776 . 8 1 1 A 68 68 ASN H H 68 8.357 9.248 -0.891 1
1 777 . 8 1 1 A 68 68 ASN HA H 68 4.679 4.747 -0.068 1
1 782 . 8 1 1 A 68 68 ASN C C 68 176.228 175.428 0.800 1
1 783 . 8 1 1 A 68 68 ASN CA C 68 53.524 53.601 -0.077 1
1 784 . 8 1 1 A 68 68 ASN CB C 68 39.580 38.389 1.191 1
1 785 . 8 1 1 A 68 68 ASN N N 68 126.940 125.380 1.560 1
1 787 . 8 1 1 A 69 69 ASN H H 69 8.861 8.956 -0.095 1
1 788 . 8 1 1 A 69 69 ASN HA H 69 5.137 5.032 0.105 1
1 793 . 8 1 1 A 69 69 ASN C C 69 175.631 176.320 -0.689 1
1 794 . 8 1 1 A 69 69 ASN CA C 69 56.009 54.334 1.675 1
1 795 . 8 1 1 A 69 69 ASN CB C 69 40.314 38.374 1.940 1
1 796 . 8 1 1 A 69 69 ASN N N 69 124.980 123.690 1.290 1
1 798 . 8 1 1 A 70 70 THR H H 70 8.635 7.957 0.678 1
1 799 . 8 1 1 A 70 70 THR HA H 70 4.815 4.586 0.229 1
1 804 . 8 1 1 A 70 70 THR C C 70 176.223 175.508 0.715 1
1 805 . 8 1 1 A 70 70 THR CA C 70 63.944 62.516 1.428 1
1 806 . 8 1 1 A 70 70 THR CB C 70 69.727 70.226 -0.499 1
1 808 . 8 1 1 A 70 70 THR N N 70 110.394 109.616 0.778 1
1 809 . 8 1 1 A 71 71 THR H H 71 8.069 7.790 0.279 1
1 810 . 8 1 1 A 71 71 THR HA H 71 4.566 4.588 -0.022 1
1 815 . 8 1 1 A 71 71 THR C C 71 176.213 174.550 1.663 1
1 816 . 8 1 1 A 71 71 THR CA C 71 61.683 61.019 0.664 1
1 817 . 8 1 1 A 71 71 THR CB C 71 70.832 69.429 1.403 1
1 819 . 8 1 1 A 71 71 THR N N 71 110.507 110.719 -0.212 1
1 820 . 8 1 1 A 72 72 GLY H H 72 7.990 7.834 0.156 1
1 821 . 8 1 1 A 72 72 GLY HA2 H 72 3.186 2.229 0.957 1
1 822 . 8 1 1 A 72 72 GLY HA3 H 72 2.516 3.542 -1.026 1
1 823 . 8 1 1 A 72 72 GLY C C 72 172.988 173.762 -0.774 1
1 824 . 8 1 1 A 72 72 GLY CA C 72 45.149 46.287 -1.138 1
1 825 . 8 1 1 A 72 72 GLY N N 72 110.788 109.942 0.846 1
1 826 . 8 1 1 A 73 73 LEU H H 73 7.138 7.548 -0.410 1
1 827 . 8 1 1 A 73 73 LEU HA H 73 4.414 4.614 -0.200 1
1 837 . 8 1 1 A 73 73 LEU C C 73 176.836 174.852 1.984 1
1 838 . 8 1 1 A 73 73 LEU CA C 73 55.252 53.318 1.934 1
1 839 . 8 1 1 A 73 73 LEU CB C 73 43.574 45.058 -1.484 1
1 843 . 8 1 1 A 73 73 LEU N N 73 119.222 121.108 -1.886 1
1 844 . 8 1 1 A 74 74 ILE H H 74 8.925 8.948 -0.023 1
1 845 . 8 1 1 A 74 74 ILE HA H 74 5.555 5.062 0.493 1
1 855 . 8 1 1 A 74 74 ILE C C 74 175.978 175.555 0.423 1
1 856 . 8 1 1 A 74 74 ILE CA C 74 60.100 60.349 -0.249 1
1 857 . 8 1 1 A 74 74 ILE CB C 74 38.550 38.562 -0.012 1
1 861 . 8 1 1 A 74 74 ILE N N 74 129.871 127.662 2.209 1
1 862 . 8 1 1 A 75 75 THR H H 75 9.161 9.300 -0.139 1
1 863 . 8 1 1 A 75 75 THR HA H 75 5.375 5.576 -0.201 1
1 868 . 8 1 1 A 75 75 THR C C 75 174.798 173.660 1.138 1
1 869 . 8 1 1 A 75 75 THR CA C 75 58.796 59.380 -0.584 1
1 870 . 8 1 1 A 75 75 THR CB C 75 72.978 71.455 1.523 1
1 872 . 8 1 1 A 75 75 THR N N 75 117.522 118.324 -0.802 1
1 873 . 8 1 1 A 76 76 VAL H H 76 8.327 8.859 -0.532 1
1 874 . 8 1 1 A 76 76 VAL HA H 76 3.973 3.852 0.121 1
1 882 . 8 1 1 A 76 76 VAL C C 76 176.495 176.082 0.413 1
1 883 . 8 1 1 A 76 76 VAL CA C 76 64.085 63.150 0.935 1
1 884 . 8 1 1 A 76 76 VAL CB C 76 32.863 30.927 1.936 1
1 887 . 8 1 1 A 76 76 VAL N N 76 120.876 122.718 -1.842 1
1 888 . 8 1 1 A 77 77 GLN H H 77 9.525 9.167 0.358 1
1 889 . 8 1 1 A 77 77 GLN HA H 77 4.702 4.145 0.557 1
1 896 . 8 1 1 A 77 77 GLN C C 77 173.838 175.185 -1.347 1
1 897 . 8 1 1 A 77 77 GLN CA C 77 55.728 57.822 -2.094 1
1 898 . 8 1 1 A 77 77 GLN CB C 77 30.762 29.512 1.250 1
1 900 . 8 1 1 A 77 77 GLN N N 77 129.825 129.239 0.586 1
1 902 . 8 1 1 A 78 78 ARG H H 78 7.621 7.481 0.140 1
1 903 . 8 1 1 A 78 78 ARG HA H 78 4.347 4.713 -0.366 1
1 910 . 8 1 1 A 78 78 ARG C C 78 172.304 175.646 -3.342 1
1 911 . 8 1 1 A 78 78 ARG CA C 78 54.634 53.901 0.733 1
1 912 . 8 1 1 A 78 78 ARG CB C 78 34.685 35.035 -0.350 1
1 915 . 8 1 1 A 78 78 ARG N N 78 120.595 117.559 3.036 1
1 916 . 8 1 1 A 79 79 SER H H 79 7.958 8.677 -0.719 1
1 917 . 8 1 1 A 79 79 SER HA H 79 4.030 4.313 -0.283 1
1 920 . 8 1 1 A 79 79 SER C C 79 174.311 174.233 0.078 1
1 921 . 8 1 1 A 79 79 SER CA C 79 59.889 58.537 1.352 1
1 922 . 8 1 1 A 79 79 SER CB C 79 63.548 63.975 -0.427 1
1 923 . 8 1 1 A 79 79 SER N N 79 112.565 116.561 -3.996 1
1 924 . 8 1 1 A 80 80 LEU H H 80 8.715 8.037 0.678 1
1 925 . 8 1 1 A 80 80 LEU HA H 80 4.114 4.934 -0.820 1
1 935 . 8 1 1 A 80 80 LEU C C 80 176.057 175.442 0.615 1
1 936 . 8 1 1 A 80 80 LEU CA C 80 55.091 53.373 1.718 1
1 937 . 8 1 1 A 80 80 LEU CB C 80 42.341 45.081 -2.740 1
1 941 . 8 1 1 A 80 80 LEU N N 80 123.070 122.829 0.241 1
1 942 . 8 1 1 A 81 81 ASP H H 81 7.298 8.848 -1.550 1
1 943 . 8 1 1 A 81 81 ASP HA H 81 4.725 5.122 -0.397 1
1 946 . 8 1 1 A 81 81 ASP C C 81 175.939 175.439 0.500 1
1 947 . 8 1 1 A 81 81 ASP CA C 81 53.664 52.941 0.723 1
1 948 . 8 1 1 A 81 81 ASP CB C 81 42.947 44.052 -1.105 1
1 949 . 8 1 1 A 81 81 ASP N N 81 115.229 121.685 -6.456 1
1 950 . 8 1 1 A 82 82 ARG H H 82 9.289 8.853 0.436 1
1 951 . 8 1 1 A 82 82 ARG HA H 82 4.416 4.961 -0.545 1
1 959 . 8 1 1 A 82 82 ARG C C 82 176.406 178.075 -1.669 1
1 960 . 8 1 1 A 82 82 ARG CA C 82 56.397 56.827 -0.430 1
1 961 . 8 1 1 A 82 82 ARG CB C 82 30.638 31.893 -1.255 1
1 964 . 8 1 1 A 82 82 ARG N N 82 123.174 122.408 0.766 1
1 966 . 8 1 1 A 83 83 GLU H H 83 8.468 8.247 0.221 1
1 967 . 8 1 1 A 83 83 GLU HA H 83 3.982 4.127 -0.145 1
1 972 . 8 1 1 A 83 83 GLU C C 83 177.740 178.453 -0.713 1
1 973 . 8 1 1 A 83 83 GLU CA C 83 58.425 59.271 -0.846 1
1 974 . 8 1 1 A 83 83 GLU CB C 83 29.701 28.822 0.879 1
1 976 . 8 1 1 A 83 83 GLU N N 83 119.549 118.377 1.172 1
1 977 . 8 1 1 A 84 84 GLU H H 84 8.033 7.974 0.059 1
1 978 . 8 1 1 A 84 84 GLU HA H 84 4.206 4.305 -0.099 1
1 983 . 8 1 1 A 84 84 GLU C C 84 176.837 175.654 1.183 1
1 984 . 8 1 1 A 84 84 GLU CA C 84 58.056 58.045 0.011 1
1 985 . 8 1 1 A 84 84 GLU CB C 84 30.432 31.094 -0.662 1
1 987 . 8 1 1 A 84 84 GLU N N 84 118.333 119.260 -0.927 1
1 988 . 8 1 1 A 85 85 THR H H 85 7.651 7.788 -0.137 1
1 989 . 8 1 1 A 85 85 THR HA H 85 4.307 4.607 -0.300 1
1 994 . 8 1 1 A 85 85 THR C C 85 171.568 173.313 -1.745 1
1 995 . 8 1 1 A 85 85 THR CA C 85 61.387 59.675 1.712 1
1 996 . 8 1 1 A 85 85 THR CB C 85 69.963 70.948 -0.985 1
1 998 . 8 1 1 A 85 85 THR N N 85 112.444 112.284 0.160 1
1 999 . 8 1 1 A 86 86 ALA H H 86 8.639 8.456 0.183 1
1 1000 . 8 1 1 A 86 86 ALA HA H 86 4.603 4.438 0.165 1
1 1004 . 8 1 1 A 86 86 ALA C C 86 175.560 177.083 -1.523 1
1 1005 . 8 1 1 A 86 86 ALA CA C 86 52.156 53.539 -1.383 1
1 1006 . 8 1 1 A 86 86 ALA CB C 86 20.378 20.502 -0.124 1
1 1007 . 8 1 1 A 86 86 ALA N N 86 127.705 127.301 0.404 1
1 1008 . 8 1 1 A 87 87 ILE H H 87 7.663 7.669 -0.006 1
1 1009 . 8 1 1 A 87 87 ILE HA H 87 4.828 4.534 0.294 1
1 1019 . 8 1 1 A 87 87 ILE C C 87 174.537 174.632 -0.095 1
1 1020 . 8 1 1 A 87 87 ILE CA C 87 60.329 60.809 -0.480 1
1 1021 . 8 1 1 A 87 87 ILE CB C 87 41.090 39.344 1.746 1
1 1025 . 8 1 1 A 87 87 ILE N N 87 118.712 116.942 1.770 1
1 1026 . 8 1 1 A 88 88 HIS H H 88 9.098 9.063 0.035 1
1 1027 . 8 1 1 A 88 88 HIS HA H 88 4.576 5.108 -0.532 1
1 1032 . 8 1 1 A 88 88 HIS C C 88 174.354 174.261 0.093 1
1 1033 . 8 1 1 A 88 88 HIS CA C 88 54.740 54.237 0.503 1
1 1034 . 8 1 1 A 88 88 HIS CB C 88 33.955 32.072 1.883 1
1 1037 . 8 1 1 A 88 88 HIS N N 88 126.285 125.919 0.366 1
1 1038 . 8 1 1 A 89 89 LYS H H 89 8.957 8.906 0.051 1
1 1039 . 8 1 1 A 89 89 LYS HA H 89 4.873 5.041 -0.168 1
1 1048 . 8 1 1 A 89 89 LYS C C 89 175.906 175.298 0.608 1
1 1049 . 8 1 1 A 89 89 LYS CA C 89 55.269 55.422 -0.153 1
1 1050 . 8 1 1 A 89 89 LYS CB C 89 32.945 33.484 -0.539 1
1 1054 . 8 1 1 A 89 89 LYS N N 89 124.332 124.034 0.298 1
1 1055 . 8 1 1 A 90 90 VAL H H 90 9.174 8.683 0.491 1
1 1056 . 8 1 1 A 90 90 VAL HA H 90 4.227 4.797 -0.570 1
1 1064 . 8 1 1 A 90 90 VAL C C 90 174.168 174.744 -0.576 1
1 1065 . 8 1 1 A 90 90 VAL CA C 90 61.369 61.174 0.195 1
1 1066 . 8 1 1 A 90 90 VAL CB C 90 34.082 33.755 0.327 1
1 1069 . 8 1 1 A 90 90 VAL N N 90 124.319 125.637 -1.318 1
1 1070 . 8 1 1 A 91 91 THR H H 91 6.697 8.998 -2.301 1
1 1071 . 8 1 1 A 91 91 THR HA H 91 5.163 5.123 0.040 1
1 1076 . 8 1 1 A 91 91 THR C C 91 173.812 173.926 -0.114 1
1 1077 . 8 1 1 A 91 91 THR CA C 91 61.935 62.113 -0.178 1
1 1078 . 8 1 1 A 91 91 THR CB C 91 70.412 69.513 0.899 1
1 1080 . 8 1 1 A 91 91 THR N N 91 122.637 124.147 -1.510 1
1 1081 . 8 1 1 A 92 92 VAL H H 92 9.292 8.622 0.670 1
1 1082 . 8 1 1 A 92 92 VAL HA H 92 4.736 4.526 0.210 1
1 1090 . 8 1 1 A 92 92 VAL C C 92 173.160 175.259 -2.099 1
1 1091 . 8 1 1 A 92 92 VAL CA C 92 60.982 61.419 -0.437 1
1 1092 . 8 1 1 A 92 92 VAL CB C 92 35.130 33.451 1.679 1
1 1095 . 8 1 1 A 92 92 VAL N N 92 128.265 128.597 -0.332 1
1 1096 . 8 1 1 A 93 93 LEU H H 93 9.495 8.606 0.889 1
1 1097 . 8 1 1 A 93 93 LEU HA H 93 5.628 5.817 -0.189 1
1 1107 . 8 1 1 A 93 93 LEU C C 93 176.274 176.203 0.071 1
1 1108 . 8 1 1 A 93 93 LEU CA C 93 52.773 53.551 -0.778 1
1 1109 . 8 1 1 A 93 93 LEU CB C 93 43.454 45.440 -1.986 1
1 1113 . 8 1 1 A 93 93 LEU N N 93 126.350 126.700 -0.350 1
1 1114 . 8 1 1 A 94 94 ALA H H 94 8.688 8.597 0.091 1
1 1115 . 8 1 1 A 94 94 ALA HA H 94 4.986 4.956 0.030 1
1 1119 . 8 1 1 A 94 94 ALA C C 94 175.787 175.307 0.480 1
1 1120 . 8 1 1 A 94 94 ALA CA C 94 49.610 50.906 -1.296 1
1 1121 . 8 1 1 A 94 94 ALA CB C 94 21.463 22.026 -0.563 1
1 1122 . 8 1 1 A 94 94 ALA N N 94 123.429 123.164 0.265 1
1 1123 . 8 1 1 A 95 95 SER H H 95 8.401 8.543 -0.142 1
1 1124 . 8 1 1 A 95 95 SER HA H 95 4.828 5.180 -0.352 1
1 1127 . 8 1 1 A 95 95 SER C C 95 174.327 172.225 2.102 1
1 1128 . 8 1 1 A 95 95 SER CA C 95 56.239 56.656 -0.417 1
1 1129 . 8 1 1 A 95 95 SER CB C 95 65.561 65.700 -0.139 1
1 1130 . 8 1 1 A 95 95 SER N N 95 114.418 117.596 -3.178 1
1 1131 . 8 1 1 A 96 96 ASP H H 96 8.690 8.517 0.173 1
1 1132 . 8 1 1 A 96 96 ASP HA H 96 4.908 4.837 0.071 1
1 1135 . 8 1 1 A 96 96 ASP C C 96 177.096 175.663 1.433 1
1 1136 . 8 1 1 A 96 96 ASP CA C 96 52.818 52.888 -0.070 1
1 1137 . 8 1 1 A 96 96 ASP CB C 96 41.253 41.421 -0.168 1
1 1138 . 8 1 1 A 96 96 ASP N N 96 125.624 124.412 1.212 1
1 1139 . 8 1 1 A 97 97 GLY H H 97 8.524 7.350 1.174 1
1 1140 . 8 1 1 A 97 97 GLY HA2 H 97 4.320 4.075 0.245 1
1 1141 . 8 1 1 A 97 97 GLY HA3 H 97 3.620 4.075 -0.455 1
1 1142 . 8 1 1 A 97 97 GLY C C 97 174.620 174.523 0.097 1
1 1143 . 8 1 1 A 97 97 GLY CA C 97 45.422 45.239 0.183 1
1 1144 . 8 1 1 A 97 97 GLY N N 97 109.283 109.007 0.276 1
1 1145 . 8 1 1 A 98 98 SER H H 98 8.575 8.495 0.080 1
1 1146 . 8 1 1 A 98 98 SER HA H 98 4.607 4.554 0.053 1
1 1149 . 8 1 1 A 98 98 SER C C 98 174.478 174.471 0.007 1
1 1150 . 8 1 1 A 98 98 SER CA C 98 59.095 60.158 -1.063 1
1 1151 . 8 1 1 A 98 98 SER CB C 98 64.800 64.899 -0.099 1
1 1152 . 8 1 1 A 98 98 SER N N 98 116.640 122.101 -5.461 1
1 1153 . 8 1 1 A 99 99 SER H H 99 8.945 7.542 1.403 1
1 1154 . 8 1 1 A 99 99 SER HA H 99 4.530 4.406 0.124 1
1 1157 . 8 1 1 A 99 99 SER C C 99 174.491 174.354 0.137 1
1 1158 . 8 1 1 A 99 99 SER CA C 99 58.460 58.888 -0.428 1
1 1159 . 8 1 1 A 99 99 SER CB C 99 64.146 63.633 0.513 1
1 1160 . 8 1 1 A 99 99 SER N N 99 117.676 114.195 3.481 1
1 1161 . 8 1 1 A 100 100 THR H H 100 8.411 8.329 0.082 1
1 1162 . 8 1 1 A 100 100 THR HA H 100 4.490 4.335 0.155 1
1 1167 . 8 1 1 A 100 100 THR C C 100 172.766 174.109 -1.343 1
1 1168 . 8 1 1 A 100 100 THR CA C 100 60.629 60.700 -0.071 1
1 1169 . 8 1 1 A 100 100 THR CB C 100 69.778 68.685 1.093 1
1 1171 . 8 1 1 A 100 100 THR N N 100 118.401 117.408 0.993 1
1 1172 . 8 1 1 A 101 101 PRO HA H 101 4.631 4.899 -0.268 1
1 1179 . 8 1 1 A 101 101 PRO C C 101 177.227 176.893 0.334 1
1 1180 . 8 1 1 A 101 101 PRO CA C 101 63.097 62.434 0.663 1
1 1181 . 8 1 1 A 101 101 PRO CB C 101 32.917 31.941 0.976 1
1 1184 . 8 1 1 A 102 102 ALA H H 102 8.497 8.092 0.405 1
1 1185 . 8 1 1 A 102 102 ALA HA H 102 4.619 4.246 0.373 1
1 1189 . 8 1 1 A 102 102 ALA C C 102 176.542 177.977 -1.435 1
1 1190 . 8 1 1 A 102 102 ALA CA C 102 51.390 53.246 -1.856 1
1 1191 . 8 1 1 A 102 102 ALA CB C 102 20.815 19.119 1.696 1
1 1192 . 8 1 1 A 102 102 ALA N N 102 124.487 125.351 -0.864 1
1 1193 . 8 1 1 A 103 103 ARG H H 103 8.663 8.924 -0.261 1
1 1194 . 8 1 1 A 103 103 ARG HA H 103 5.515 5.308 0.207 1
1 1201 . 8 1 1 A 103 103 ARG C C 103 174.539 175.441 -0.902 1
1 1202 . 8 1 1 A 103 103 ARG CA C 103 55.164 54.789 0.375 1
1 1203 . 8 1 1 A 103 103 ARG CB C 103 34.393 33.801 0.592 1
1 1206 . 8 1 1 A 103 103 ARG N N 103 119.596 119.330 0.266 1
1 1207 . 8 1 1 A 104 104 ALA H H 104 9.027 8.016 1.011 1
1 1208 . 8 1 1 A 104 104 ALA HA H 104 4.782 4.979 -0.197 1
1 1212 . 8 1 1 A 104 104 ALA C C 104 176.276 175.477 0.799 1
1 1213 . 8 1 1 A 104 104 ALA CA C 104 50.297 51.475 -1.178 1
1 1214 . 8 1 1 A 104 104 ALA CB C 104 20.810 21.724 -0.914 1
1 1215 . 8 1 1 A 104 104 ALA N N 104 126.962 121.709 5.253 1
1 1216 . 8 1 1 A 105 105 THR H H 105 8.384 8.606 -0.222 1
1 1217 . 8 1 1 A 105 105 THR HA H 105 4.954 4.673 0.281 1
1 1222 . 8 1 1 A 105 105 THR C C 105 173.243 174.156 -0.913 1
1 1223 . 8 1 1 A 105 105 THR CA C 105 61.475 62.523 -1.048 1
1 1224 . 8 1 1 A 105 105 THR CB C 105 70.569 69.853 0.716 1
1 1226 . 8 1 1 A 105 105 THR N N 105 115.327 119.033 -3.706 1
1 1227 . 8 1 1 A 106 106 VAL H H 106 8.970 8.548 0.422 1
1 1228 . 8 1 1 A 106 106 VAL HA H 106 4.702 4.830 -0.128 1
1 1236 . 8 1 1 A 106 106 VAL C C 106 174.743 174.847 -0.104 1
1 1237 . 8 1 1 A 106 106 VAL CA C 106 59.712 60.311 -0.599 1
1 1238 . 8 1 1 A 106 106 VAL CB C 106 34.327 34.752 -0.425 1
1 1241 . 8 1 1 A 106 106 VAL N N 106 126.226 126.270 -0.044 1
1 1242 . 8 1 1 A 107 107 THR H H 107 8.833 8.813 0.020 1
1 1243 . 8 1 1 A 107 107 THR HA H 107 4.862 4.969 -0.107 1
1 1248 . 8 1 1 A 107 107 THR C C 107 172.970 174.200 -1.230 1
1 1249 . 8 1 1 A 107 107 THR CA C 107 62.322 62.145 0.177 1
1 1250 . 8 1 1 A 107 107 THR CB C 107 69.463 69.535 -0.072 1
1 1252 . 8 1 1 A 107 107 THR N N 107 125.403 123.775 1.628 1
1 1253 . 8 1 1 A 108 108 ILE H H 108 9.234 9.316 -0.082 1
1 1254 . 8 1 1 A 108 108 ILE HA H 108 4.178 4.737 -0.559 1
1 1264 . 8 1 1 A 108 108 ILE C C 108 174.087 175.078 -0.991 1
1 1265 . 8 1 1 A 108 108 ILE CA C 108 60.365 59.720 0.645 1
1 1266 . 8 1 1 A 108 108 ILE CB C 108 39.745 39.259 0.486 1
1 1270 . 8 1 1 A 108 108 ILE N N 108 127.152 128.725 -1.573 1
1 1271 . 8 1 1 A 109 109 ASN H H 109 8.723 9.216 -0.493 1
1 1272 . 8 1 1 A 109 109 ASN HA H 109 5.147 5.448 -0.301 1
1 1277 . 8 1 1 A 109 109 ASN C C 109 173.592 174.282 -0.690 1
1 1278 . 8 1 1 A 109 109 ASN CA C 109 52.501 51.697 0.804 1
1 1279 . 8 1 1 A 109 109 ASN CB C 109 40.791 42.019 -1.228 1
1 1280 . 8 1 1 A 109 109 ASN N N 109 126.866 125.538 1.328 1
1 1282 . 8 1 1 A 110 110 VAL H H 110 9.046 9.069 -0.023 1
1 1283 . 8 1 1 A 110 110 VAL HA H 110 5.081 4.986 0.095 1
1 1291 . 8 1 1 A 110 110 VAL C C 110 176.921 176.310 0.611 1
1 1292 . 8 1 1 A 110 110 VAL CA C 110 61.634 61.553 0.081 1
1 1293 . 8 1 1 A 110 110 VAL CB C 110 31.809 32.651 -0.842 1
1 1296 . 8 1 1 A 110 110 VAL N N 110 126.070 124.148 1.922 1
1 1297 . 8 1 1 A 111 111 THR H H 111 9.197 8.447 0.750 1
1 1298 . 8 1 1 A 111 111 THR HA H 111 4.566 4.946 -0.380 1
1 1303 . 8 1 1 A 111 111 THR C C 111 174.087 174.012 0.075 1
1 1304 . 8 1 1 A 111 111 THR CA C 111 61.145 59.864 1.281 1
1 1305 . 8 1 1 A 111 111 THR CB C 111 70.706 71.090 -0.384 1
1 1307 . 8 1 1 A 111 111 THR N N 111 121.425 118.980 2.445 1
1 1308 . 8 1 1 A 112 112 ASP H H 112 8.435 8.657 -0.222 1
1 1309 . 8 1 1 A 112 112 ASP HA H 112 4.656 4.690 -0.034 1
1 1312 . 8 1 1 A 112 112 ASP C C 112 176.745 175.506 1.239 1
1 1313 . 8 1 1 A 112 112 ASP CA C 112 54.158 53.562 0.596 1
1 1314 . 8 1 1 A 112 112 ASP CB C 112 41.575 41.782 -0.207 1
1 1315 . 8 1 1 A 112 112 ASP N N 112 119.566 122.459 -2.893 1
1 1316 . 8 1 1 A 113 113 VAL H H 113 8.629 8.399 0.230 1
1 1317 . 8 1 1 A 113 113 VAL HA H 113 4.078 4.693 -0.615 1
1 1325 . 8 1 1 A 113 113 VAL C C 113 175.247 175.003 0.244 1
1 1326 . 8 1 1 A 113 113 VAL CA C 113 62.533 59.831 2.702 1
1 1327 . 8 1 1 A 113 113 VAL CB C 113 32.534 34.945 -2.411 1
1 1330 . 8 1 1 A 113 113 VAL N N 113 119.356 118.207 1.149 1
1 4 . 9 1 1 A 2 2 SER H H 2 8.289 8.902 -0.613 1
1 5 . 9 1 1 A 2 2 SER HA H 2 4.530 4.566 -0.036 1
1 7 . 9 1 1 A 2 2 SER C C 2 174.868 174.841 0.027 1
1 8 . 9 1 1 A 2 2 SER CA C 2 58.284 61.327 -3.043 1
1 9 . 9 1 1 A 2 2 SER CB C 2 63.769 63.823 -0.054 1
1 10 . 9 1 1 A 2 2 SER N N 2 115.842 118.649 -2.807 1
1 11 . 9 1 1 A 3 3 SER H H 3 8.490 7.805 0.685 1
1 12 . 9 1 1 A 3 3 SER HA H 3 4.496 4.360 0.136 1
1 14 . 9 1 1 A 3 3 SER C C 3 175.043 174.426 0.617 1
1 15 . 9 1 1 A 3 3 SER CA C 3 58.549 59.738 -1.189 1
1 16 . 9 1 1 A 3 3 SER CB C 3 63.687 63.875 -0.188 1
1 17 . 9 1 1 A 3 3 SER N N 3 117.930 116.542 1.388 1
1 18 . 9 1 1 A 4 4 GLY H H 4 8.482 8.205 0.277 1
1 19 . 9 1 1 A 4 4 GLY C C 4 174.344 175.257 -0.913 1
1 20 . 9 1 1 A 4 4 GLY CA C 4 45.536 45.984 -0.448 1
1 21 . 9 1 1 A 4 4 GLY N N 4 110.985 110.986 -0.001 1
1 22 . 9 1 1 A 6 6 SER HA H 6 4.508 5.186 -0.678 1
1 24 . 9 1 1 A 6 6 SER C C 6 175.026 173.965 1.061 1
1 25 . 9 1 1 A 6 6 SER CA C 6 58.584 56.771 1.813 1
1 26 . 9 1 1 A 6 6 SER CB C 6 63.646 65.650 -2.004 1
1 27 . 9 1 1 A 7 7 GLY H H 7 8.419 8.643 -0.224 1
1 28 . 9 1 1 A 7 7 GLY HA2 H 7 3.993 4.283 -0.290 1
1 29 . 9 1 1 A 7 7 GLY C C 7 173.995 175.091 -1.096 1
1 30 . 9 1 1 A 7 7 GLY CA C 7 45.466 45.753 -0.287 1
1 31 . 9 1 1 A 7 7 GLY N N 7 110.615 110.606 0.009 1
1 32 . 9 1 1 A 8 8 ASN H H 8 8.322 8.062 0.260 1
1 33 . 9 1 1 A 8 8 ASN HA H 8 4.736 4.232 0.504 1
1 38 . 9 1 1 A 8 8 ASN C C 8 174.907 174.779 0.128 1
1 39 . 9 1 1 A 8 8 ASN CA C 8 53.259 56.674 -3.415 1
1 40 . 9 1 1 A 8 8 ASN CB C 8 39.127 38.290 0.837 1
1 41 . 9 1 1 A 8 8 ASN N N 8 118.602 120.070 -1.468 1
1 43 . 9 1 1 A 9 9 ASP H H 9 8.370 7.994 0.376 1
1 44 . 9 1 1 A 9 9 ASP HA H 9 4.594 4.176 0.418 1
1 47 . 9 1 1 A 9 9 ASP C C 9 175.765 174.602 1.163 1
1 48 . 9 1 1 A 9 9 ASP CA C 9 54.440 55.533 -1.093 1
1 49 . 9 1 1 A 9 9 ASP CB C 9 40.898 39.177 1.721 1
1 50 . 9 1 1 A 9 9 ASP N N 9 120.504 117.122 3.382 1
1 51 . 9 1 1 A 10 10 ASN H H 10 8.382 7.720 0.662 1
1 52 . 9 1 1 A 10 10 ASN HA H 10 4.691 5.019 -0.328 1
1 57 . 9 1 1 A 10 10 ASN C C 10 174.383 173.113 1.270 1
1 58 . 9 1 1 A 10 10 ASN CA C 10 53.241 52.146 1.095 1
1 59 . 9 1 1 A 10 10 ASN CB C 10 38.674 40.354 -1.680 1
1 60 . 9 1 1 A 10 10 ASN N N 10 119.406 115.323 4.083 1
1 62 . 9 1 1 A 11 11 ARG H H 11 7.942 8.935 -0.993 1
1 63 . 9 1 1 A 11 11 ARG HA H 11 4.684 4.647 0.037 1
1 70 . 9 1 1 A 11 11 ARG C C 11 173.640 174.500 -0.860 1
1 71 . 9 1 1 A 11 11 ARG CA C 11 54.246 53.639 0.607 1
1 72 . 9 1 1 A 11 11 ARG CB C 11 30.337 31.774 -1.437 1
1 75 . 9 1 1 A 11 11 ARG N N 11 121.145 126.077 -4.932 1
1 76 . 9 1 1 A 12 12 PRO HA H 12 4.507 4.967 -0.460 1
1 83 . 9 1 1 A 12 12 PRO CA C 12 62.714 62.459 0.255 1
1 84 . 9 1 1 A 12 12 PRO CB C 12 31.942 30.342 1.600 1
1 87 . 9 1 1 A 13 13 VAL H H 13 8.252 7.756 0.496 1
1 88 . 9 1 1 A 13 13 VAL HA H 13 4.159 4.517 -0.358 1
1 96 . 9 1 1 A 13 13 VAL CA C 13 61.409 60.191 1.218 1
1 97 . 9 1 1 A 13 13 VAL CB C 13 34.858 33.453 1.405 1
1 100 . 9 1 1 A 13 13 VAL N N 13 118.395 117.648 0.747 1
1 101 . 9 1 1 A 14 14 PHE H H 14 8.725 8.698 0.027 1
1 102 . 9 1 1 A 14 14 PHE HA H 14 4.781 4.632 0.149 1
1 110 . 9 1 1 A 14 14 PHE CA C 14 58.594 58.371 0.223 1
1 111 . 9 1 1 A 14 14 PHE CB C 14 39.594 39.964 -0.370 1
1 117 . 9 1 1 A 14 14 PHE N N 14 122.950 125.405 -2.455 1
1 118 . 9 1 1 A 15 15 LYS H H 15 8.885 9.049 -0.164 1
1 119 . 9 1 1 A 15 15 LYS HA H 15 4.130 4.212 -0.082 1
1 128 . 9 1 1 A 15 15 LYS C C 15 177.027 176.096 0.931 1
1 129 . 9 1 1 A 15 15 LYS CA C 15 58.478 59.258 -0.780 1
1 130 . 9 1 1 A 15 15 LYS CB C 15 32.748 32.318 0.430 1
1 134 . 9 1 1 A 15 15 LYS N N 15 123.863 121.382 2.481 1
1 135 . 9 1 1 A 16 16 GLU H H 16 8.091 8.069 0.022 1
1 136 . 9 1 1 A 16 16 GLU HA H 16 4.438 4.720 -0.282 1
1 141 . 9 1 1 A 16 16 GLU C C 16 175.947 177.347 -1.400 1
1 142 . 9 1 1 A 16 16 GLU CA C 16 56.045 54.944 1.101 1
1 143 . 9 1 1 A 16 16 GLU CB C 16 30.766 32.342 -1.576 1
1 145 . 9 1 1 A 16 16 GLU N N 16 117.026 118.466 -1.440 1
1 146 . 9 1 1 A 17 17 GLY H H 17 8.421 8.743 -0.322 1
1 147 . 9 1 1 A 17 17 GLY HA2 H 17 3.993 3.889 0.104 1
1 148 . 9 1 1 A 17 17 GLY HA3 H 17 3.913 3.919 -0.006 1
1 149 . 9 1 1 A 17 17 GLY C C 17 173.564 174.021 -0.457 1
1 150 . 9 1 1 A 17 17 GLY CA C 17 45.448 47.706 -2.258 1
1 151 . 9 1 1 A 17 17 GLY N N 17 109.577 111.395 -1.818 1
1 152 . 9 1 1 A 18 18 GLN H H 18 7.858 7.691 0.167 1
1 153 . 9 1 1 A 18 18 GLN HA H 18 5.065 5.210 -0.145 1
1 160 . 9 1 1 A 18 18 GLN C C 18 174.596 173.906 0.690 1
1 161 . 9 1 1 A 18 18 GLN CA C 18 55.110 53.585 1.525 1
1 162 . 9 1 1 A 18 18 GLN CB C 18 30.329 32.530 -2.201 1
1 164 . 9 1 1 A 18 18 GLN N N 18 120.202 113.040 7.162 1
1 166 . 9 1 1 A 19 19 VAL H H 19 8.216 8.645 -0.429 1
1 167 . 9 1 1 A 19 19 VAL HA H 19 4.450 4.696 -0.246 1
1 175 . 9 1 1 A 19 19 VAL C C 19 173.648 173.566 0.082 1
1 176 . 9 1 1 A 19 19 VAL CA C 19 60.788 60.855 -0.067 1
1 177 . 9 1 1 A 19 19 VAL CB C 19 35.336 35.637 -0.301 1
1 180 . 9 1 1 A 19 19 VAL N N 19 121.257 119.679 1.578 1
1 181 . 9 1 1 A 20 20 GLU H H 20 8.610 8.976 -0.366 1
1 182 . 9 1 1 A 20 20 GLU HA H 20 5.211 5.330 -0.119 1
1 187 . 9 1 1 A 20 20 GLU C C 20 174.783 175.808 -1.025 1
1 188 . 9 1 1 A 20 20 GLU CA C 20 54.793 55.247 -0.454 1
1 189 . 9 1 1 A 20 20 GLU CB C 20 32.058 31.806 0.252 1
1 191 . 9 1 1 A 20 20 GLU N N 20 127.095 127.880 -0.785 1
1 192 . 9 1 1 A 21 21 VAL H H 21 8.727 8.916 -0.189 1
1 193 . 9 1 1 A 21 21 VAL HA H 21 4.633 5.177 -0.544 1
1 201 . 9 1 1 A 21 21 VAL C C 21 173.894 174.320 -0.426 1
1 202 . 9 1 1 A 21 21 VAL CA C 21 59.695 58.904 0.791 1
1 203 . 9 1 1 A 21 21 VAL CB C 21 35.865 35.876 -0.011 1
1 206 . 9 1 1 A 21 21 VAL N N 21 120.489 119.542 0.947 1
1 207 . 9 1 1 A 22 22 HIS H H 22 8.680 8.793 -0.113 1
1 208 . 9 1 1 A 22 22 HIS HA H 22 5.552 5.821 -0.269 1
1 212 . 9 1 1 A 22 22 HIS C C 22 174.298 173.282 1.016 1
1 213 . 9 1 1 A 22 22 HIS CA C 22 55.331 53.715 1.616 1
1 214 . 9 1 1 A 22 22 HIS CB C 22 32.369 32.325 0.044 1
1 216 . 9 1 1 A 22 22 HIS N N 22 124.991 118.090 6.901 1
1 217 . 9 1 1 A 23 23 ILE H H 23 9.179 9.127 0.052 1
1 218 . 9 1 1 A 23 23 ILE HA H 23 5.046 4.709 0.337 1
1 228 . 9 1 1 A 23 23 ILE C C 23 171.552 173.371 -1.819 1
1 229 . 9 1 1 A 23 23 ILE CA C 23 55.551 57.131 -1.580 1
1 230 . 9 1 1 A 23 23 ILE CB C 23 42.053 41.902 0.151 1
1 234 . 9 1 1 A 23 23 ILE N N 23 123.121 125.146 -2.025 1
1 235 . 9 1 1 A 24 24 PRO HA H 24 4.816 4.729 0.087 1
1 242 . 9 1 1 A 24 24 PRO C C 24 178.887 177.838 1.049 1
1 243 . 9 1 1 A 24 24 PRO CA C 24 62.216 62.834 -0.618 1
1 244 . 9 1 1 A 24 24 PRO CB C 24 32.895 32.161 0.734 1
1 247 . 9 1 1 A 25 25 GLU H H 25 8.399 8.263 0.136 1
1 248 . 9 1 1 A 25 25 GLU HA H 25 3.785 4.088 -0.303 1
1 253 . 9 1 1 A 25 25 GLU C C 25 175.244 177.632 -2.388 1
1 254 . 9 1 1 A 25 25 GLU CA C 25 58.425 59.511 -1.086 1
1 255 . 9 1 1 A 25 25 GLU CB C 25 30.011 29.050 0.961 1
1 257 . 9 1 1 A 25 25 GLU N N 25 117.706 123.128 -5.422 1
1 258 . 9 1 1 A 26 26 ASN H H 26 7.488 7.734 -0.246 1
1 259 . 9 1 1 A 26 26 ASN HA H 26 4.702 4.918 -0.216 1
1 264 . 9 1 1 A 26 26 ASN C C 26 175.425 174.926 0.499 1
1 265 . 9 1 1 A 26 26 ASN CA C 26 51.584 52.899 -1.315 1
1 266 . 9 1 1 A 26 26 ASN CB C 26 37.243 38.232 -0.989 1
1 267 . 9 1 1 A 26 26 ASN N N 26 112.383 116.223 -3.840 1
1 269 . 9 1 1 A 27 27 ALA H H 27 7.716 7.575 0.141 1
1 270 . 9 1 1 A 27 27 ALA HA H 27 4.409 4.405 0.004 1
1 274 . 9 1 1 A 27 27 ALA C C 27 175.850 175.845 0.005 1
1 275 . 9 1 1 A 27 27 ALA CA C 27 51.037 50.941 0.096 1
1 276 . 9 1 1 A 27 27 ALA CB C 27 18.152 18.341 -0.189 1
1 277 . 9 1 1 A 27 27 ALA N N 27 125.139 123.291 1.848 1
1 278 . 9 1 1 A 28 28 PRO HA H 28 4.422 4.558 -0.136 1
1 285 . 9 1 1 A 28 28 PRO C C 28 178.442 176.986 1.456 1
1 286 . 9 1 1 A 28 28 PRO CA C 28 62.067 62.875 -0.808 1
1 287 . 9 1 1 A 28 28 PRO CB C 28 32.642 32.108 0.534 1
1 290 . 9 1 1 A 29 29 VAL H H 29 8.691 8.360 0.331 1
1 291 . 9 1 1 A 29 29 VAL HA H 29 3.239 3.569 -0.330 1
1 299 . 9 1 1 A 29 29 VAL C C 29 176.887 177.086 -0.199 1
1 300 . 9 1 1 A 29 29 VAL CA C 29 65.812 64.408 1.404 1
1 301 . 9 1 1 A 29 29 VAL CB C 29 31.174 31.288 -0.114 1
1 304 . 9 1 1 A 29 29 VAL N N 29 123.592 122.710 0.882 1
1 305 . 9 1 1 A 30 30 GLY H H 30 9.197 8.779 0.418 1
1 306 . 9 1 1 A 30 30 GLY HA2 H 30 4.486 3.978 0.508 1
1 307 . 9 1 1 A 30 30 GLY HA3 H 30 3.581 3.982 -0.401 1
1 308 . 9 1 1 A 30 30 GLY C C 30 174.347 174.609 -0.262 1
1 309 . 9 1 1 A 30 30 GLY CA C 30 44.320 44.989 -0.669 1
1 310 . 9 1 1 A 30 30 GLY N N 30 116.042 115.042 1.000 1
1 311 . 9 1 1 A 31 31 THR H H 31 7.838 7.785 0.053 1
1 312 . 9 1 1 A 31 31 THR HA H 31 3.959 4.178 -0.219 1
1 317 . 9 1 1 A 31 31 THR C C 31 174.274 173.964 0.310 1
1 318 . 9 1 1 A 31 31 THR CA C 31 65.160 63.383 1.777 1
1 319 . 9 1 1 A 31 31 THR CB C 31 69.972 68.724 1.248 1
1 321 . 9 1 1 A 31 31 THR N N 31 117.679 117.922 -0.243 1
1 322 . 9 1 1 A 32 32 SER H H 32 9.022 8.695 0.327 1
1 323 . 9 1 1 A 32 32 SER HA H 32 4.273 4.513 -0.240 1
1 326 . 9 1 1 A 32 32 SER C C 32 172.692 174.428 -1.736 1
1 327 . 9 1 1 A 32 32 SER CA C 32 59.642 58.690 0.952 1
1 328 . 9 1 1 A 32 32 SER CB C 32 63.102 62.888 0.214 1
1 329 . 9 1 1 A 32 32 SER N N 32 123.045 122.819 0.226 1
1 330 . 9 1 1 A 33 33 VAL H H 33 9.202 8.816 0.386 1
1 331 . 9 1 1 A 33 33 VAL HA H 33 3.844 3.968 -0.124 1
1 339 . 9 1 1 A 33 33 VAL C C 33 174.782 175.907 -1.125 1
1 340 . 9 1 1 A 33 33 VAL CA C 33 64.242 64.410 -0.168 1
1 341 . 9 1 1 A 33 33 VAL CB C 33 32.893 32.482 0.411 1
1 344 . 9 1 1 A 33 33 VAL N N 33 126.861 125.339 1.522 1
1 345 . 9 1 1 A 34 34 ILE H H 34 7.074 7.402 -0.328 1
1 346 . 9 1 1 A 34 34 ILE HA H 34 4.295 4.663 -0.368 1
1 356 . 9 1 1 A 34 34 ILE C C 34 170.577 173.099 -2.522 1
1 357 . 9 1 1 A 34 34 ILE CA C 34 59.500 59.209 0.291 1
1 358 . 9 1 1 A 34 34 ILE CB C 34 39.251 42.047 -2.796 1
1 362 . 9 1 1 A 34 34 ILE N N 34 111.445 118.717 -7.272 1
1 363 . 9 1 1 A 35 35 GLN H H 35 8.450 8.943 -0.493 1
1 364 . 9 1 1 A 35 35 GLN HA H 35 4.633 5.125 -0.492 1
1 371 . 9 1 1 A 35 35 GLN C C 35 174.354 174.079 0.275 1
1 372 . 9 1 1 A 35 35 GLN CA C 35 54.176 54.066 0.110 1
1 373 . 9 1 1 A 35 35 GLN CB C 35 29.456 32.029 -2.573 1
1 375 . 9 1 1 A 35 35 GLN N N 35 127.342 127.276 0.066 1
1 377 . 9 1 1 A 36 36 LEU H H 36 7.761 8.804 -1.043 1
1 378 . 9 1 1 A 36 36 LEU HA H 36 4.492 5.100 -0.608 1
1 388 . 9 1 1 A 36 36 LEU C C 36 175.543 175.415 0.128 1
1 389 . 9 1 1 A 36 36 LEU CA C 36 53.982 53.554 0.428 1
1 390 . 9 1 1 A 36 36 LEU CB C 36 42.776 43.285 -0.509 1
1 394 . 9 1 1 A 36 36 LEU N N 36 128.895 127.969 0.926 1
1 395 . 9 1 1 A 37 37 HIS H H 37 8.529 8.963 -0.434 1
1 396 . 9 1 1 A 37 37 HIS HA H 37 4.851 5.379 -0.528 1
1 400 . 9 1 1 A 37 37 HIS C C 37 172.985 173.613 -0.628 1
1 401 . 9 1 1 A 37 37 HIS CA C 37 55.833 53.660 2.173 1
1 402 . 9 1 1 A 37 37 HIS CB C 37 32.204 31.845 0.359 1
1 404 . 9 1 1 A 37 37 HIS N N 37 115.903 124.748 -8.845 1
1 405 . 9 1 1 A 38 38 ALA H H 38 8.474 8.951 -0.477 1
1 406 . 9 1 1 A 38 38 ALA HA H 38 4.691 4.769 -0.078 1
1 410 . 9 1 1 A 38 38 ALA C C 38 175.548 175.649 -0.101 1
1 411 . 9 1 1 A 38 38 ALA CA C 38 50.491 50.715 -0.224 1
1 412 . 9 1 1 A 38 38 ALA CB C 38 19.842 20.274 -0.432 1
1 413 . 9 1 1 A 38 38 ALA N N 38 128.891 130.655 -1.764 1
1 414 . 9 1 1 A 39 39 THR H H 39 8.095 8.605 -0.510 1
1 415 . 9 1 1 A 39 39 THR HA H 39 4.336 5.167 -0.831 1
1 420 . 9 1 1 A 39 39 THR C C 39 173.553 173.155 0.398 1
1 421 . 9 1 1 A 39 39 THR CA C 39 60.417 59.632 0.785 1
1 422 . 9 1 1 A 39 39 THR CB C 39 70.912 71.772 -0.860 1
1 424 . 9 1 1 A 39 39 THR N N 39 110.982 113.866 -2.884 1
1 425 . 9 1 1 A 40 40 ASP H H 40 8.417 8.708 -0.291 1
1 426 . 9 1 1 A 40 40 ASP HA H 40 4.553 5.161 -0.608 1
1 429 . 9 1 1 A 40 40 ASP C C 40 176.462 175.430 1.032 1
1 430 . 9 1 1 A 40 40 ASP CA C 40 54.158 52.753 1.405 1
1 431 . 9 1 1 A 40 40 ASP CB C 40 41.517 44.643 -3.126 1
1 432 . 9 1 1 A 40 40 ASP N N 40 121.450 121.698 -0.248 1
1 433 . 9 1 1 A 41 41 ALA H H 41 8.435 8.622 -0.187 1
1 434 . 9 1 1 A 41 41 ALA HA H 41 4.129 4.188 -0.059 1
1 438 . 9 1 1 A 41 41 ALA C C 41 177.718 178.310 -0.592 1
1 439 . 9 1 1 A 41 41 ALA CA C 41 53.436 53.001 0.435 1
1 440 . 9 1 1 A 41 41 ALA CB C 41 19.183 19.509 -0.326 1
1 441 . 9 1 1 A 41 41 ALA N N 41 124.607 125.136 -0.529 1
1 442 . 9 1 1 A 42 42 ASP H H 42 8.310 9.163 -0.853 1
1 443 . 9 1 1 A 42 42 ASP HA H 42 4.588 4.810 -0.222 1
1 446 . 9 1 1 A 42 42 ASP C C 42 176.546 175.383 1.163 1
1 447 . 9 1 1 A 42 42 ASP CA C 42 54.599 53.342 1.257 1
1 448 . 9 1 1 A 42 42 ASP CB C 42 41.146 40.372 0.774 1
1 449 . 9 1 1 A 42 42 ASP N N 42 118.030 124.922 -6.892 1
1 450 . 9 1 1 A 43 43 ILE H H 43 8.000 7.791 0.209 1
1 451 . 9 1 1 A 43 43 ILE HA H 43 4.130 4.867 -0.737 1
1 461 . 9 1 1 A 43 43 ILE C C 43 176.901 175.721 1.180 1
1 462 . 9 1 1 A 43 43 ILE CA C 43 61.740 59.571 2.169 1
1 463 . 9 1 1 A 43 43 ILE CB C 43 38.491 40.099 -1.608 1
1 467 . 9 1 1 A 43 43 ILE N N 43 119.301 117.575 1.726 1
1 468 . 9 1 1 A 44 44 GLY H H 44 8.448 8.410 0.038 1
1 469 . 9 1 1 A 44 44 GLY HA2 H 44 3.939 3.988 -0.049 1
1 470 . 9 1 1 A 44 44 GLY HA3 H 44 3.939 3.990 -0.051 1
1 471 . 9 1 1 A 44 44 GLY C C 44 174.393 172.966 1.427 1
1 472 . 9 1 1 A 44 44 GLY CA C 44 45.501 45.645 -0.144 1
1 473 . 9 1 1 A 44 44 GLY N N 44 111.333 113.086 -1.753 1
1 474 . 9 1 1 A 45 45 SER H H 45 8.061 8.120 -0.059 1
1 475 . 9 1 1 A 45 45 SER HA H 45 4.416 4.891 -0.475 1
1 478 . 9 1 1 A 45 45 SER C C 45 174.480 172.788 1.692 1
1 479 . 9 1 1 A 45 45 SER CA C 45 58.478 56.777 1.701 1
1 480 . 9 1 1 A 45 45 SER CB C 45 63.943 65.526 -1.583 1
1 481 . 9 1 1 A 45 45 SER N N 45 115.551 117.748 -2.197 1
1 482 . 9 1 1 A 46 46 ASN H H 46 8.547 8.953 -0.406 1
1 483 . 9 1 1 A 46 46 ASN HA H 46 4.725 4.692 0.033 1
1 488 . 9 1 1 A 46 46 ASN C C 46 175.031 174.301 0.730 1
1 489 . 9 1 1 A 46 46 ASN CA C 46 53.277 53.735 -0.458 1
1 490 . 9 1 1 A 46 46 ASN CB C 46 38.798 39.144 -0.346 1
1 491 . 9 1 1 A 46 46 ASN N N 46 120.698 126.935 -6.237 1
1 493 . 9 1 1 A 47 47 ALA H H 47 8.239 8.705 -0.466 1
1 494 . 9 1 1 A 47 47 ALA HA H 47 4.283 5.177 -0.894 1
1 498 . 9 1 1 A 47 47 ALA C C 47 177.240 175.648 1.592 1
1 499 . 9 1 1 A 47 47 ALA CA C 47 52.731 50.255 2.476 1
1 500 . 9 1 1 A 47 47 ALA CB C 47 19.594 22.425 -2.831 1
1 501 . 9 1 1 A 47 47 ALA N N 47 124.093 128.934 -4.841 1
1 502 . 9 1 1 A 48 48 GLU H H 48 8.376 8.614 -0.238 1
1 503 . 9 1 1 A 48 48 GLU HA H 48 4.264 4.626 -0.362 1
1 508 . 9 1 1 A 48 48 GLU C C 48 175.702 175.426 0.276 1
1 509 . 9 1 1 A 48 48 GLU CA C 48 55.992 55.200 0.792 1
1 510 . 9 1 1 A 48 48 GLU CB C 48 30.210 29.975 0.235 1
1 512 . 9 1 1 A 48 48 GLU N N 48 119.750 121.979 -2.229 1
1 513 . 9 1 1 A 49 49 ILE H H 49 7.806 8.354 -0.548 1
1 514 . 9 1 1 A 49 49 ILE HA H 49 3.919 4.377 -0.458 1
1 524 . 9 1 1 A 49 49 ILE C C 49 175.894 174.865 1.029 1
1 525 . 9 1 1 A 49 49 ILE CA C 49 60.559 61.910 -1.351 1
1 526 . 9 1 1 A 49 49 ILE CB C 49 37.860 37.622 0.238 1
1 530 . 9 1 1 A 49 49 ILE N N 49 122.772 125.245 -2.473 1
1 531 . 9 1 1 A 50 50 ARG H H 50 8.247 8.563 -0.316 1
1 532 . 9 1 1 A 50 50 ARG HA H 50 4.999 4.814 0.185 1
1 539 . 9 1 1 A 50 50 ARG C C 50 174.603 173.995 0.608 1
1 540 . 9 1 1 A 50 50 ARG CA C 50 53.189 54.234 -1.045 1
1 541 . 9 1 1 A 50 50 ARG CB C 50 33.152 32.416 0.736 1
1 544 . 9 1 1 A 50 50 ARG N N 50 126.912 127.836 -0.924 1
1 545 . 9 1 1 A 51 51 TYR H H 51 9.041 9.162 -0.121 1
1 546 . 9 1 1 A 51 51 TYR HA H 51 5.395 5.421 -0.026 1
1 553 . 9 1 1 A 51 51 TYR C C 51 175.555 175.923 -0.368 1
1 554 . 9 1 1 A 51 51 TYR CA C 51 56.909 57.461 -0.552 1
1 555 . 9 1 1 A 51 51 TYR CB C 51 40.116 39.899 0.217 1
1 560 . 9 1 1 A 51 51 TYR N N 51 121.627 126.865 -5.238 1
1 561 . 9 1 1 A 52 52 ILE H H 52 8.850 8.365 0.485 1
1 562 . 9 1 1 A 52 52 ILE HA H 52 4.576 4.808 -0.232 1
1 572 . 9 1 1 A 52 52 ILE C C 52 175.371 174.900 0.471 1
1 573 . 9 1 1 A 52 52 ILE CA C 52 59.624 59.172 0.452 1
1 574 . 9 1 1 A 52 52 ILE CB C 52 42.895 42.026 0.869 1
1 578 . 9 1 1 A 52 52 ILE N N 52 117.697 119.142 -1.445 1
1 579 . 9 1 1 A 53 53 PHE H H 53 8.748 8.628 0.120 1
1 580 . 9 1 1 A 53 53 PHE HA H 53 5.132 4.713 0.419 1
1 588 . 9 1 1 A 53 53 PHE C C 53 178.146 176.451 1.695 1
1 589 . 9 1 1 A 53 53 PHE CA C 53 57.667 58.290 -0.623 1
1 590 . 9 1 1 A 53 53 PHE CB C 53 39.614 39.743 -0.129 1
1 596 . 9 1 1 A 53 53 PHE N N 53 121.433 122.826 -1.393 1
1 597 . 9 1 1 A 54 54 GLY H H 54 8.538 9.049 -0.511 1
1 598 . 9 1 1 A 54 54 GLY HA2 H 54 4.074 4.130 -0.056 1
1 599 . 9 1 1 A 54 54 GLY HA3 H 54 3.840 4.131 -0.291 1
1 600 . 9 1 1 A 54 54 GLY C C 54 174.530 172.903 1.627 1
1 601 . 9 1 1 A 54 54 GLY CA C 54 44.884 44.502 0.382 1
1 602 . 9 1 1 A 54 54 GLY N N 54 106.444 110.223 -3.779 1
1 603 . 9 1 1 A 55 55 ALA H H 55 8.594 8.164 0.430 1
1 604 . 9 1 1 A 55 55 ALA HA H 55 4.172 4.682 -0.510 1
1 608 . 9 1 1 A 55 55 ALA C C 55 178.718 177.290 1.428 1
1 609 . 9 1 1 A 55 55 ALA CA C 55 54.423 50.705 3.718 1
1 610 . 9 1 1 A 55 55 ALA CB C 55 19.059 20.951 -1.892 1
1 611 . 9 1 1 A 55 55 ALA N N 55 123.470 122.295 1.175 1
1 612 . 9 1 1 A 56 56 GLN H H 56 8.727 8.731 -0.004 1
1 613 . 9 1 1 A 56 56 GLN HA H 56 4.367 3.784 0.583 1
1 620 . 9 1 1 A 56 56 GLN C C 56 176.134 174.734 1.400 1
1 621 . 9 1 1 A 56 56 GLN CA C 56 55.660 56.664 -1.004 1
1 622 . 9 1 1 A 56 56 GLN CB C 56 28.152 26.871 1.281 1
1 624 . 9 1 1 A 56 56 GLN N N 56 114.221 115.474 -1.253 1
1 626 . 9 1 1 A 57 57 VAL H H 57 7.204 7.813 -0.609 1
1 627 . 9 1 1 A 57 57 VAL HA H 57 3.889 4.190 -0.301 1
1 635 . 9 1 1 A 57 57 VAL C C 57 175.371 175.215 0.156 1
1 636 . 9 1 1 A 57 57 VAL CA C 57 63.908 61.627 2.281 1
1 637 . 9 1 1 A 57 57 VAL CB C 57 31.557 32.900 -1.343 1
1 640 . 9 1 1 A 57 57 VAL N N 57 121.341 119.495 1.846 1
1 641 . 9 1 1 A 58 58 ALA H H 58 8.920 8.485 0.435 1
1 642 . 9 1 1 A 58 58 ALA HA H 58 4.547 4.535 0.012 1
1 646 . 9 1 1 A 58 58 ALA C C 58 177.064 177.554 -0.490 1
1 647 . 9 1 1 A 58 58 ALA CA C 58 51.173 50.646 0.527 1
1 648 . 9 1 1 A 58 58 ALA CB C 58 17.842 17.811 0.031 1
1 649 . 9 1 1 A 58 58 ALA N N 58 132.726 130.150 2.576 1
1 650 . 9 1 1 A 59 59 PRO HA H 59 4.101 4.278 -0.177 1
1 657 . 9 1 1 A 59 59 PRO C C 59 179.482 178.708 0.774 1
1 658 . 9 1 1 A 59 59 PRO CA C 59 66.060 65.821 0.239 1
1 659 . 9 1 1 A 59 59 PRO CB C 59 31.951 31.703 0.248 1
1 662 . 9 1 1 A 60 60 ALA H H 60 8.706 8.221 0.485 1
1 663 . 9 1 1 A 60 60 ALA HA H 60 4.057 3.992 0.065 1
1 667 . 9 1 1 A 60 60 ALA C C 60 179.627 180.250 -0.623 1
1 668 . 9 1 1 A 60 60 ALA CA C 60 55.305 55.387 -0.082 1
1 669 . 9 1 1 A 60 60 ALA CB C 60 18.737 18.665 0.072 1
1 670 . 9 1 1 A 60 60 ALA N N 60 117.882 118.392 -0.510 1
1 671 . 9 1 1 A 61 61 THR H H 61 7.312 8.237 -0.925 1
1 672 . 9 1 1 A 61 61 THR HA H 61 4.153 3.870 0.283 1
1 677 . 9 1 1 A 61 61 THR C C 61 175.824 176.299 -0.475 1
1 678 . 9 1 1 A 61 61 THR CA C 61 66.412 67.223 -0.811 1
1 679 . 9 1 1 A 61 61 THR CB C 61 68.787 68.717 0.070 1
1 681 . 9 1 1 A 61 61 THR N N 61 114.483 114.481 0.002 1
1 682 . 9 1 1 A 62 62 LYS H H 62 7.556 7.834 -0.278 1
1 683 . 9 1 1 A 62 62 LYS HA H 62 3.943 3.867 0.076 1
1 692 . 9 1 1 A 62 62 LYS C C 62 176.884 178.611 -1.727 1
1 693 . 9 1 1 A 62 62 LYS CA C 62 59.095 59.757 -0.662 1
1 694 . 9 1 1 A 62 62 LYS CB C 62 32.204 32.228 -0.024 1
1 698 . 9 1 1 A 62 62 LYS N N 62 118.994 119.718 -0.724 1
1 699 . 9 1 1 A 63 63 ARG H H 63 7.474 7.792 -0.318 1
1 700 . 9 1 1 A 63 63 ARG HA H 63 4.034 4.017 0.017 1
1 707 . 9 1 1 A 63 63 ARG C C 63 177.574 178.877 -1.303 1
1 708 . 9 1 1 A 63 63 ARG CA C 63 58.143 58.832 -0.689 1
1 709 . 9 1 1 A 63 63 ARG CB C 63 30.755 29.951 0.804 1
1 712 . 9 1 1 A 63 63 ARG N N 63 114.251 119.480 -5.229 1
1 713 . 9 1 1 A 64 64 LEU H H 64 6.991 7.392 -0.401 1
1 714 . 9 1 1 A 64 64 LEU HA H 64 3.904 3.697 0.207 1
1 724 . 9 1 1 A 64 64 LEU C C 64 176.632 176.044 0.588 1
1 725 . 9 1 1 A 64 64 LEU CA C 64 56.503 57.670 -1.167 1
1 726 . 9 1 1 A 64 64 LEU CB C 64 42.929 41.768 1.161 1
1 730 . 9 1 1 A 64 64 LEU N N 64 116.109 119.574 -3.465 1
1 731 . 9 1 1 A 65 65 PHE H H 65 7.673 8.275 -0.602 1
1 732 . 9 1 1 A 65 65 PHE HA H 65 5.386 5.099 0.287 1
1 740 . 9 1 1 A 65 65 PHE C C 65 173.067 174.708 -1.641 1
1 741 . 9 1 1 A 65 65 PHE CA C 65 56.521 57.045 -0.524 1
1 742 . 9 1 1 A 65 65 PHE CB C 65 41.270 40.521 0.749 1
1 748 . 9 1 1 A 65 65 PHE N N 65 116.182 115.114 1.068 1
1 749 . 9 1 1 A 66 66 ALA H H 66 8.914 9.044 -0.130 1
1 750 . 9 1 1 A 66 66 ALA HA H 66 4.748 5.361 -0.613 1
1 754 . 9 1 1 A 66 66 ALA C C 66 175.223 175.501 -0.278 1
1 755 . 9 1 1 A 66 66 ALA CA C 66 50.050 50.424 -0.374 1
1 756 . 9 1 1 A 66 66 ALA CB C 66 21.161 21.285 -0.124 1
1 757 . 9 1 1 A 66 66 ALA N N 66 122.870 126.662 -3.792 1
1 758 . 9 1 1 A 67 67 LEU H H 67 8.498 9.031 -0.533 1
1 759 . 9 1 1 A 67 67 LEU HA H 67 4.713 5.262 -0.549 1
1 769 . 9 1 1 A 67 67 LEU C C 67 175.146 174.926 0.220 1
1 770 . 9 1 1 A 67 67 LEU CA C 67 52.518 53.251 -0.733 1
1 771 . 9 1 1 A 67 67 LEU CB C 67 45.308 44.793 0.515 1
1 775 . 9 1 1 A 67 67 LEU N N 67 122.208 123.963 -1.755 1
1 776 . 9 1 1 A 68 68 ASN H H 68 8.357 8.943 -0.586 1
1 777 . 9 1 1 A 68 68 ASN HA H 68 4.679 5.142 -0.463 1
1 782 . 9 1 1 A 68 68 ASN C C 68 176.228 175.076 1.152 1
1 783 . 9 1 1 A 68 68 ASN CA C 68 53.524 51.918 1.606 1
1 784 . 9 1 1 A 68 68 ASN CB C 68 39.580 40.470 -0.890 1
1 785 . 9 1 1 A 68 68 ASN N N 68 126.940 124.231 2.709 1
1 787 . 9 1 1 A 69 69 ASN H H 69 8.861 9.056 -0.195 1
1 788 . 9 1 1 A 69 69 ASN HA H 69 5.137 5.004 0.133 1
1 793 . 9 1 1 A 69 69 ASN C C 69 175.631 176.569 -0.938 1
1 794 . 9 1 1 A 69 69 ASN CA C 69 56.009 54.187 1.822 1
1 795 . 9 1 1 A 69 69 ASN CB C 69 40.314 39.242 1.072 1
1 796 . 9 1 1 A 69 69 ASN N N 69 124.980 121.600 3.380 1
1 798 . 9 1 1 A 70 70 THR H H 70 8.635 7.855 0.780 1
1 799 . 9 1 1 A 70 70 THR HA H 70 4.815 4.502 0.313 1
1 804 . 9 1 1 A 70 70 THR C C 70 176.223 175.660 0.563 1
1 805 . 9 1 1 A 70 70 THR CA C 70 63.944 62.948 0.996 1
1 806 . 9 1 1 A 70 70 THR CB C 70 69.727 69.911 -0.184 1
1 808 . 9 1 1 A 70 70 THR N N 70 110.394 110.959 -0.565 1
1 809 . 9 1 1 A 71 71 THR H H 71 8.069 7.766 0.303 1
1 810 . 9 1 1 A 71 71 THR HA H 71 4.566 4.558 0.008 1
1 815 . 9 1 1 A 71 71 THR C C 71 176.213 175.315 0.898 1
1 816 . 9 1 1 A 71 71 THR CA C 71 61.683 61.915 -0.232 1
1 817 . 9 1 1 A 71 71 THR CB C 71 70.832 71.123 -0.291 1
1 819 . 9 1 1 A 71 71 THR N N 71 110.507 110.078 0.429 1
1 820 . 9 1 1 A 72 72 GLY H H 72 7.990 7.842 0.148 1
1 821 . 9 1 1 A 72 72 GLY HA2 H 72 3.186 3.348 -0.162 1
1 822 . 9 1 1 A 72 72 GLY HA3 H 72 2.516 3.674 -1.158 1
1 823 . 9 1 1 A 72 72 GLY C C 72 172.988 174.100 -1.112 1
1 824 . 9 1 1 A 72 72 GLY CA C 72 45.149 46.463 -1.314 1
1 825 . 9 1 1 A 72 72 GLY N N 72 110.788 112.656 -1.868 1
1 826 . 9 1 1 A 73 73 LEU H H 73 7.138 7.568 -0.430 1
1 827 . 9 1 1 A 73 73 LEU HA H 73 4.414 4.748 -0.334 1
1 837 . 9 1 1 A 73 73 LEU C C 73 176.836 174.869 1.967 1
1 838 . 9 1 1 A 73 73 LEU CA C 73 55.252 53.372 1.880 1
1 839 . 9 1 1 A 73 73 LEU CB C 73 43.574 45.179 -1.605 1
1 843 . 9 1 1 A 73 73 LEU N N 73 119.222 120.896 -1.674 1
1 844 . 9 1 1 A 74 74 ILE H H 74 8.925 9.012 -0.087 1
1 845 . 9 1 1 A 74 74 ILE HA H 74 5.555 5.204 0.351 1
1 855 . 9 1 1 A 74 74 ILE C C 74 175.978 175.570 0.408 1
1 856 . 9 1 1 A 74 74 ILE CA C 74 60.100 60.419 -0.319 1
1 857 . 9 1 1 A 74 74 ILE CB C 74 38.550 38.653 -0.103 1
1 861 . 9 1 1 A 74 74 ILE N N 74 129.871 127.762 2.109 1
1 862 . 9 1 1 A 75 75 THR H H 75 9.161 8.706 0.455 1
1 863 . 9 1 1 A 75 75 THR HA H 75 5.375 5.254 0.121 1
1 868 . 9 1 1 A 75 75 THR C C 75 174.798 173.593 1.205 1
1 869 . 9 1 1 A 75 75 THR CA C 75 58.796 59.411 -0.615 1
1 870 . 9 1 1 A 75 75 THR CB C 75 72.978 71.885 1.093 1
1 872 . 9 1 1 A 75 75 THR N N 75 117.522 118.045 -0.523 1
1 873 . 9 1 1 A 76 76 VAL H H 76 8.327 9.004 -0.677 1
1 874 . 9 1 1 A 76 76 VAL HA H 76 3.973 3.866 0.107 1
1 882 . 9 1 1 A 76 76 VAL C C 76 176.495 176.079 0.416 1
1 883 . 9 1 1 A 76 76 VAL CA C 76 64.085 63.266 0.819 1
1 884 . 9 1 1 A 76 76 VAL CB C 76 32.863 30.830 2.033 1
1 887 . 9 1 1 A 76 76 VAL N N 76 120.876 122.933 -2.057 1
1 888 . 9 1 1 A 77 77 GLN H H 77 9.525 9.298 0.227 1
1 889 . 9 1 1 A 77 77 GLN HA H 77 4.702 4.228 0.474 1
1 896 . 9 1 1 A 77 77 GLN C C 77 173.838 175.243 -1.405 1
1 897 . 9 1 1 A 77 77 GLN CA C 77 55.728 57.352 -1.624 1
1 898 . 9 1 1 A 77 77 GLN CB C 77 30.762 29.765 0.997 1
1 900 . 9 1 1 A 77 77 GLN N N 77 129.825 129.295 0.530 1
1 902 . 9 1 1 A 78 78 ARG H H 78 7.621 7.451 0.170 1
1 903 . 9 1 1 A 78 78 ARG HA H 78 4.347 4.686 -0.339 1
1 910 . 9 1 1 A 78 78 ARG C C 78 172.304 174.905 -2.601 1
1 911 . 9 1 1 A 78 78 ARG CA C 78 54.634 53.807 0.827 1
1 912 . 9 1 1 A 78 78 ARG CB C 78 34.685 35.087 -0.402 1
1 915 . 9 1 1 A 78 78 ARG N N 78 120.595 117.614 2.981 1
1 916 . 9 1 1 A 79 79 SER H H 79 7.958 8.474 -0.516 1
1 917 . 9 1 1 A 79 79 SER HA H 79 4.030 4.296 -0.266 1
1 920 . 9 1 1 A 79 79 SER C C 79 174.311 174.443 -0.132 1
1 921 . 9 1 1 A 79 79 SER CA C 79 59.889 58.895 0.994 1
1 922 . 9 1 1 A 79 79 SER CB C 79 63.548 63.610 -0.062 1
1 923 . 9 1 1 A 79 79 SER N N 79 112.565 117.877 -5.312 1
1 924 . 9 1 1 A 80 80 LEU H H 80 8.715 7.918 0.797 1
1 925 . 9 1 1 A 80 80 LEU HA H 80 4.114 4.907 -0.793 1
1 935 . 9 1 1 A 80 80 LEU C C 80 176.057 175.932 0.125 1
1 936 . 9 1 1 A 80 80 LEU CA C 80 55.091 53.578 1.513 1
1 937 . 9 1 1 A 80 80 LEU CB C 80 42.341 44.859 -2.518 1
1 941 . 9 1 1 A 80 80 LEU N N 80 123.070 124.559 -1.489 1
1 942 . 9 1 1 A 81 81 ASP H H 81 7.298 8.831 -1.533 1
1 943 . 9 1 1 A 81 81 ASP HA H 81 4.725 5.208 -0.483 1
1 946 . 9 1 1 A 81 81 ASP C C 81 175.939 176.079 -0.140 1
1 947 . 9 1 1 A 81 81 ASP CA C 81 53.664 53.090 0.574 1
1 948 . 9 1 1 A 81 81 ASP CB C 81 42.947 42.830 0.117 1
1 949 . 9 1 1 A 81 81 ASP N N 81 115.229 123.235 -8.006 1
1 950 . 9 1 1 A 82 82 ARG H H 82 9.289 8.774 0.515 1
1 951 . 9 1 1 A 82 82 ARG HA H 82 4.416 4.174 0.242 1
1 959 . 9 1 1 A 82 82 ARG C C 82 176.406 178.329 -1.923 1
1 960 . 9 1 1 A 82 82 ARG CA C 82 56.397 59.132 -2.735 1
1 961 . 9 1 1 A 82 82 ARG CB C 82 30.638 30.240 0.398 1
1 964 . 9 1 1 A 82 82 ARG N N 82 123.174 126.728 -3.554 1
1 966 . 9 1 1 A 83 83 GLU H H 83 8.468 8.202 0.266 1
1 967 . 9 1 1 A 83 83 GLU HA H 83 3.982 4.008 -0.026 1
1 972 . 9 1 1 A 83 83 GLU C C 83 177.740 179.212 -1.472 1
1 973 . 9 1 1 A 83 83 GLU CA C 83 58.425 59.532 -1.107 1
1 974 . 9 1 1 A 83 83 GLU CB C 83 29.701 29.192 0.509 1
1 976 . 9 1 1 A 83 83 GLU N N 83 119.549 117.702 1.847 1
1 977 . 9 1 1 A 84 84 GLU H H 84 8.033 7.779 0.254 1
1 978 . 9 1 1 A 84 84 GLU HA H 84 4.206 4.197 0.009 1
1 983 . 9 1 1 A 84 84 GLU C C 84 176.837 175.969 0.868 1
1 984 . 9 1 1 A 84 84 GLU CA C 84 58.056 58.618 -0.562 1
1 985 . 9 1 1 A 84 84 GLU CB C 84 30.432 30.924 -0.492 1
1 987 . 9 1 1 A 84 84 GLU N N 84 118.333 119.409 -1.076 1
1 988 . 9 1 1 A 85 85 THR H H 85 7.651 7.445 0.206 1
1 989 . 9 1 1 A 85 85 THR HA H 85 4.307 4.613 -0.306 1
1 994 . 9 1 1 A 85 85 THR C C 85 171.568 173.736 -2.168 1
1 995 . 9 1 1 A 85 85 THR CA C 85 61.387 59.805 1.582 1
1 996 . 9 1 1 A 85 85 THR CB C 85 69.963 70.827 -0.864 1
1 998 . 9 1 1 A 85 85 THR N N 85 112.444 112.477 -0.033 1
1 999 . 9 1 1 A 86 86 ALA H H 86 8.639 8.590 0.049 1
1 1000 . 9 1 1 A 86 86 ALA HA H 86 4.603 4.377 0.226 1
1 1004 . 9 1 1 A 86 86 ALA C C 86 175.560 176.681 -1.121 1
1 1005 . 9 1 1 A 86 86 ALA CA C 86 52.156 54.307 -2.151 1
1 1006 . 9 1 1 A 86 86 ALA CB C 86 20.378 19.942 0.436 1
1 1007 . 9 1 1 A 86 86 ALA N N 86 127.705 127.687 0.018 1
1 1008 . 9 1 1 A 87 87 ILE H H 87 7.663 7.832 -0.169 1
1 1009 . 9 1 1 A 87 87 ILE HA H 87 4.828 4.584 0.244 1
1 1019 . 9 1 1 A 87 87 ILE C C 87 174.537 174.792 -0.255 1
1 1020 . 9 1 1 A 87 87 ILE CA C 87 60.329 60.462 -0.133 1
1 1021 . 9 1 1 A 87 87 ILE CB C 87 41.090 39.122 1.968 1
1 1025 . 9 1 1 A 87 87 ILE N N 87 118.712 117.090 1.622 1
1 1026 . 9 1 1 A 88 88 HIS H H 88 9.098 8.801 0.297 1
1 1027 . 9 1 1 A 88 88 HIS HA H 88 4.576 5.163 -0.587 1
1 1032 . 9 1 1 A 88 88 HIS C C 88 174.354 174.214 0.140 1
1 1033 . 9 1 1 A 88 88 HIS CA C 88 54.740 54.633 0.107 1
1 1034 . 9 1 1 A 88 88 HIS CB C 88 33.955 31.726 2.229 1
1 1037 . 9 1 1 A 88 88 HIS N N 88 126.285 126.141 0.144 1
1 1038 . 9 1 1 A 89 89 LYS H H 89 8.957 8.990 -0.033 1
1 1039 . 9 1 1 A 89 89 LYS HA H 89 4.873 4.647 0.226 1
1 1048 . 9 1 1 A 89 89 LYS C C 89 175.906 175.501 0.405 1
1 1049 . 9 1 1 A 89 89 LYS CA C 89 55.269 55.537 -0.268 1
1 1050 . 9 1 1 A 89 89 LYS CB C 89 32.945 32.947 -0.002 1
1 1054 . 9 1 1 A 89 89 LYS N N 89 124.332 124.576 -0.244 1
1 1055 . 9 1 1 A 90 90 VAL H H 90 9.174 8.621 0.553 1
1 1056 . 9 1 1 A 90 90 VAL HA H 90 4.227 5.066 -0.839 1
1 1064 . 9 1 1 A 90 90 VAL C C 90 174.168 174.668 -0.500 1
1 1065 . 9 1 1 A 90 90 VAL CA C 90 61.369 61.022 0.347 1
1 1066 . 9 1 1 A 90 90 VAL CB C 90 34.082 34.474 -0.392 1
1 1069 . 9 1 1 A 90 90 VAL N N 90 124.319 125.171 -0.852 1
1 1070 . 9 1 1 A 91 91 THR H H 91 6.697 8.942 -2.245 1
1 1071 . 9 1 1 A 91 91 THR HA H 91 5.163 4.902 0.261 1
1 1076 . 9 1 1 A 91 91 THR C C 91 173.812 174.202 -0.390 1
1 1077 . 9 1 1 A 91 91 THR CA C 91 61.935 61.856 0.079 1
1 1078 . 9 1 1 A 91 91 THR CB C 91 70.412 70.915 -0.503 1
1 1080 . 9 1 1 A 91 91 THR N N 91 122.637 124.504 -1.867 1
1 1081 . 9 1 1 A 92 92 VAL H H 92 9.292 8.550 0.742 1
1 1082 . 9 1 1 A 92 92 VAL HA H 92 4.736 4.650 0.086 1
1 1090 . 9 1 1 A 92 92 VAL C C 92 173.160 174.904 -1.744 1
1 1091 . 9 1 1 A 92 92 VAL CA C 92 60.982 61.155 -0.173 1
1 1092 . 9 1 1 A 92 92 VAL CB C 92 35.130 33.839 1.291 1
1 1095 . 9 1 1 A 92 92 VAL N N 92 128.265 127.183 1.082 1
1 1096 . 9 1 1 A 93 93 LEU H H 93 9.495 9.338 0.157 1
1 1097 . 9 1 1 A 93 93 LEU HA H 93 5.628 5.744 -0.116 1
1 1107 . 9 1 1 A 93 93 LEU C C 93 176.274 175.294 0.980 1
1 1108 . 9 1 1 A 93 93 LEU CA C 93 52.773 53.669 -0.896 1
1 1109 . 9 1 1 A 93 93 LEU CB C 93 43.454 44.659 -1.205 1
1 1113 . 9 1 1 A 93 93 LEU N N 93 126.350 126.814 -0.464 1
1 1114 . 9 1 1 A 94 94 ALA H H 94 8.688 9.046 -0.358 1
1 1115 . 9 1 1 A 94 94 ALA HA H 94 4.986 4.938 0.048 1
1 1119 . 9 1 1 A 94 94 ALA C C 94 175.787 175.545 0.242 1
1 1120 . 9 1 1 A 94 94 ALA CA C 94 49.610 50.320 -0.710 1
1 1121 . 9 1 1 A 94 94 ALA CB C 94 21.463 20.880 0.583 1
1 1122 . 9 1 1 A 94 94 ALA N N 94 123.429 127.113 -3.684 1
1 1123 . 9 1 1 A 95 95 SER H H 95 8.401 8.571 -0.170 1
1 1124 . 9 1 1 A 95 95 SER HA H 95 4.828 5.046 -0.218 1
1 1127 . 9 1 1 A 95 95 SER C C 95 174.327 173.959 0.368 1
1 1128 . 9 1 1 A 95 95 SER CA C 95 56.239 56.225 0.014 1
1 1129 . 9 1 1 A 95 95 SER CB C 95 65.561 64.808 0.753 1
1 1130 . 9 1 1 A 95 95 SER N N 95 114.418 118.862 -4.444 1
1 1131 . 9 1 1 A 96 96 ASP H H 96 8.690 8.693 -0.003 1
1 1132 . 9 1 1 A 96 96 ASP HA H 96 4.908 4.743 0.165 1
1 1135 . 9 1 1 A 96 96 ASP C C 96 177.096 176.281 0.815 1
1 1136 . 9 1 1 A 96 96 ASP CA C 96 52.818 54.686 -1.868 1
1 1137 . 9 1 1 A 96 96 ASP CB C 96 41.253 41.609 -0.356 1
1 1138 . 9 1 1 A 96 96 ASP N N 96 125.624 123.745 1.879 1
1 1139 . 9 1 1 A 97 97 GLY H H 97 8.524 7.409 1.115 1
1 1140 . 9 1 1 A 97 97 GLY HA2 H 97 4.320 4.053 0.267 1
1 1141 . 9 1 1 A 97 97 GLY HA3 H 97 3.620 4.055 -0.435 1
1 1142 . 9 1 1 A 97 97 GLY C C 97 174.620 172.909 1.711 1
1 1143 . 9 1 1 A 97 97 GLY CA C 97 45.422 46.127 -0.705 1
1 1144 . 9 1 1 A 97 97 GLY N N 97 109.283 106.981 2.302 1
1 1145 . 9 1 1 A 98 98 SER H H 98 8.575 8.315 0.260 1
1 1146 . 9 1 1 A 98 98 SER HA H 98 4.607 4.528 0.079 1
1 1149 . 9 1 1 A 98 98 SER C C 98 174.478 172.338 2.140 1
1 1150 . 9 1 1 A 98 98 SER CA C 98 59.095 58.062 1.033 1
1 1151 . 9 1 1 A 98 98 SER CB C 98 64.800 62.001 2.799 1
1 1152 . 9 1 1 A 98 98 SER N N 98 116.640 121.229 -4.589 1
1 1153 . 9 1 1 A 99 99 SER H H 99 8.945 7.709 1.236 1
1 1154 . 9 1 1 A 99 99 SER HA H 99 4.530 4.998 -0.468 1
1 1157 . 9 1 1 A 99 99 SER C C 99 174.491 173.917 0.574 1
1 1158 . 9 1 1 A 99 99 SER CA C 99 58.460 57.541 0.919 1
1 1159 . 9 1 1 A 99 99 SER CB C 99 64.146 65.843 -1.697 1
1 1160 . 9 1 1 A 99 99 SER N N 99 117.676 116.917 0.759 1
1 1161 . 9 1 1 A 100 100 THR H H 100 8.411 8.515 -0.104 1
1 1162 . 9 1 1 A 100 100 THR HA H 100 4.490 4.327 0.163 1
1 1167 . 9 1 1 A 100 100 THR C C 100 172.766 172.905 -0.139 1
1 1168 . 9 1 1 A 100 100 THR CA C 100 60.629 61.384 -0.755 1
1 1169 . 9 1 1 A 100 100 THR CB C 100 69.778 69.204 0.574 1
1 1171 . 9 1 1 A 100 100 THR N N 100 118.401 120.970 -2.569 1
1 1172 . 9 1 1 A 101 101 PRO HA H 101 4.631 4.746 -0.115 1
1 1179 . 9 1 1 A 101 101 PRO C C 101 177.227 176.124 1.103 1
1 1180 . 9 1 1 A 101 101 PRO CA C 101 63.097 62.380 0.717 1
1 1181 . 9 1 1 A 101 101 PRO CB C 101 32.917 32.446 0.471 1
1 1184 . 9 1 1 A 102 102 ALA H H 102 8.497 8.126 0.371 1
1 1185 . 9 1 1 A 102 102 ALA HA H 102 4.619 4.704 -0.085 1
1 1189 . 9 1 1 A 102 102 ALA C C 102 176.542 177.551 -1.009 1
1 1190 . 9 1 1 A 102 102 ALA CA C 102 51.390 51.862 -0.472 1
1 1191 . 9 1 1 A 102 102 ALA CB C 102 20.815 20.321 0.494 1
1 1192 . 9 1 1 A 102 102 ALA N N 102 124.487 123.544 0.943 1
1 1193 . 9 1 1 A 103 103 ARG H H 103 8.663 9.218 -0.555 1
1 1194 . 9 1 1 A 103 103 ARG HA H 103 5.515 5.714 -0.199 1
1 1201 . 9 1 1 A 103 103 ARG C C 103 174.539 174.740 -0.201 1
1 1202 . 9 1 1 A 103 103 ARG CA C 103 55.164 54.377 0.787 1
1 1203 . 9 1 1 A 103 103 ARG CB C 103 34.393 33.969 0.424 1
1 1206 . 9 1 1 A 103 103 ARG N N 103 119.596 117.568 2.028 1
1 1207 . 9 1 1 A 104 104 ALA H H 104 9.027 8.144 0.883 1
1 1208 . 9 1 1 A 104 104 ALA HA H 104 4.782 5.130 -0.348 1
1 1212 . 9 1 1 A 104 104 ALA C C 104 176.276 175.428 0.848 1
1 1213 . 9 1 1 A 104 104 ALA CA C 104 50.297 50.979 -0.682 1
1 1214 . 9 1 1 A 104 104 ALA CB C 104 20.810 21.574 -0.764 1
1 1215 . 9 1 1 A 104 104 ALA N N 104 126.962 122.055 4.907 1
1 1216 . 9 1 1 A 105 105 THR H H 105 8.384 8.685 -0.301 1
1 1217 . 9 1 1 A 105 105 THR HA H 105 4.954 4.542 0.412 1
1 1222 . 9 1 1 A 105 105 THR C C 105 173.243 174.190 -0.947 1
1 1223 . 9 1 1 A 105 105 THR CA C 105 61.475 62.688 -1.213 1
1 1224 . 9 1 1 A 105 105 THR CB C 105 70.569 69.352 1.217 1
1 1226 . 9 1 1 A 105 105 THR N N 105 115.327 119.001 -3.674 1
1 1227 . 9 1 1 A 106 106 VAL H H 106 8.970 8.633 0.337 1
1 1228 . 9 1 1 A 106 106 VAL HA H 106 4.702 4.826 -0.124 1
1 1236 . 9 1 1 A 106 106 VAL C C 106 174.743 174.765 -0.022 1
1 1237 . 9 1 1 A 106 106 VAL CA C 106 59.712 60.296 -0.584 1
1 1238 . 9 1 1 A 106 106 VAL CB C 106 34.327 33.986 0.341 1
1 1241 . 9 1 1 A 106 106 VAL N N 106 126.226 127.618 -1.392 1
1 1242 . 9 1 1 A 107 107 THR H H 107 8.833 8.695 0.138 1
1 1243 . 9 1 1 A 107 107 THR HA H 107 4.862 4.895 -0.033 1
1 1248 . 9 1 1 A 107 107 THR C C 107 172.970 173.852 -0.882 1
1 1249 . 9 1 1 A 107 107 THR CA C 107 62.322 62.173 0.149 1
1 1250 . 9 1 1 A 107 107 THR CB C 107 69.463 69.484 -0.021 1
1 1252 . 9 1 1 A 107 107 THR N N 107 125.403 123.312 2.091 1
1 1253 . 9 1 1 A 108 108 ILE H H 108 9.234 8.852 0.382 1
1 1254 . 9 1 1 A 108 108 ILE HA H 108 4.178 4.595 -0.417 1
1 1264 . 9 1 1 A 108 108 ILE C C 108 174.087 174.942 -0.855 1
1 1265 . 9 1 1 A 108 108 ILE CA C 108 60.365 60.573 -0.208 1
1 1266 . 9 1 1 A 108 108 ILE CB C 108 39.745 39.285 0.460 1
1 1270 . 9 1 1 A 108 108 ILE N N 108 127.152 128.705 -1.553 1
1 1271 . 9 1 1 A 109 109 ASN H H 109 8.723 9.106 -0.383 1
1 1272 . 9 1 1 A 109 109 ASN HA H 109 5.147 5.351 -0.204 1
1 1277 . 9 1 1 A 109 109 ASN C C 109 173.592 174.600 -1.008 1
1 1278 . 9 1 1 A 109 109 ASN CA C 109 52.501 52.836 -0.335 1
1 1279 . 9 1 1 A 109 109 ASN CB C 109 40.791 40.859 -0.068 1
1 1280 . 9 1 1 A 109 109 ASN N N 109 126.866 125.846 1.020 1
1 1282 . 9 1 1 A 110 110 VAL H H 110 9.046 8.554 0.492 1
1 1283 . 9 1 1 A 110 110 VAL HA H 110 5.081 5.159 -0.078 1
1 1291 . 9 1 1 A 110 110 VAL C C 110 176.921 176.355 0.566 1
1 1292 . 9 1 1 A 110 110 VAL CA C 110 61.634 61.337 0.297 1
1 1293 . 9 1 1 A 110 110 VAL CB C 110 31.809 33.355 -1.546 1
1 1296 . 9 1 1 A 110 110 VAL N N 110 126.070 121.818 4.252 1
1 1297 . 9 1 1 A 111 111 THR H H 111 9.197 8.405 0.792 1
1 1298 . 9 1 1 A 111 111 THR HA H 111 4.566 4.898 -0.332 1
1 1303 . 9 1 1 A 111 111 THR C C 111 174.087 174.221 -0.134 1
1 1304 . 9 1 1 A 111 111 THR CA C 111 61.145 60.578 0.567 1
1 1305 . 9 1 1 A 111 111 THR CB C 111 70.706 71.257 -0.551 1
1 1307 . 9 1 1 A 111 111 THR N N 111 121.425 118.864 2.561 1
1 1308 . 9 1 1 A 112 112 ASP H H 112 8.435 8.539 -0.104 1
1 1309 . 9 1 1 A 112 112 ASP HA H 112 4.656 4.860 -0.204 1
1 1312 . 9 1 1 A 112 112 ASP C C 112 176.745 175.696 1.049 1
1 1313 . 9 1 1 A 112 112 ASP CA C 112 54.158 54.166 -0.008 1
1 1314 . 9 1 1 A 112 112 ASP CB C 112 41.575 41.922 -0.347 1
1 1315 . 9 1 1 A 112 112 ASP N N 112 119.566 122.210 -2.644 1
1 1316 . 9 1 1 A 113 113 VAL H H 113 8.629 8.776 -0.147 1
1 1317 . 9 1 1 A 113 113 VAL HA H 113 4.078 4.961 -0.883 1
1 1325 . 9 1 1 A 113 113 VAL C C 113 175.247 174.119 1.128 1
1 1326 . 9 1 1 A 113 113 VAL CA C 113 62.533 60.468 2.065 1
1 1327 . 9 1 1 A 113 113 VAL CB C 113 32.534 34.102 -1.568 1
1 1330 . 9 1 1 A 113 113 VAL N N 113 119.356 118.687 0.669 1
1 4 . 10 1 1 A 2 2 SER H H 2 8.289 7.847 0.442 1
1 5 . 10 1 1 A 2 2 SER HA H 2 4.530 4.864 -0.334 1
1 7 . 10 1 1 A 2 2 SER C C 2 174.868 173.430 1.438 1
1 8 . 10 1 1 A 2 2 SER CA C 2 58.284 57.857 0.427 1
1 9 . 10 1 1 A 2 2 SER CB C 2 63.769 63.435 0.334 1
1 10 . 10 1 1 A 2 2 SER N N 2 115.842 116.057 -0.215 1
1 11 . 10 1 1 A 3 3 SER H H 3 8.490 8.660 -0.170 1
1 12 . 10 1 1 A 3 3 SER HA H 3 4.496 5.053 -0.557 1
1 14 . 10 1 1 A 3 3 SER C C 3 175.043 173.590 1.453 1
1 15 . 10 1 1 A 3 3 SER CA C 3 58.549 57.603 0.946 1
1 16 . 10 1 1 A 3 3 SER CB C 3 63.687 67.254 -3.567 1
1 17 . 10 1 1 A 3 3 SER N N 3 117.930 119.783 -1.853 1
1 18 . 10 1 1 A 4 4 GLY H H 4 8.482 8.327 0.155 1
1 19 . 10 1 1 A 4 4 GLY C C 4 174.344 175.188 -0.844 1
1 20 . 10 1 1 A 4 4 GLY CA C 4 45.536 45.958 -0.422 1
1 21 . 10 1 1 A 4 4 GLY N N 4 110.985 109.905 1.080 1
1 22 . 10 1 1 A 6 6 SER HA H 6 4.508 4.199 0.309 1
1 24 . 10 1 1 A 6 6 SER C C 6 175.026 175.378 -0.352 1
1 25 . 10 1 1 A 6 6 SER CA C 6 58.584 59.926 -1.342 1
1 26 . 10 1 1 A 6 6 SER CB C 6 63.646 63.720 -0.074 1
1 27 . 10 1 1 A 7 7 GLY H H 7 8.419 8.843 -0.424 1
1 28 . 10 1 1 A 7 7 GLY HA2 H 7 3.993 4.000 -0.007 1
1 29 . 10 1 1 A 7 7 GLY C C 7 173.995 174.258 -0.263 1
1 30 . 10 1 1 A 7 7 GLY CA C 7 45.466 45.594 -0.128 1
1 31 . 10 1 1 A 7 7 GLY N N 7 110.615 112.089 -1.474 1
1 32 . 10 1 1 A 8 8 ASN H H 8 8.322 8.012 0.310 1
1 33 . 10 1 1 A 8 8 ASN HA H 8 4.736 4.853 -0.117 1
1 38 . 10 1 1 A 8 8 ASN C C 8 174.907 174.386 0.521 1
1 39 . 10 1 1 A 8 8 ASN CA C 8 53.259 52.879 0.380 1
1 40 . 10 1 1 A 8 8 ASN CB C 8 39.127 39.493 -0.366 1
1 41 . 10 1 1 A 8 8 ASN N N 8 118.602 118.522 0.080 1
1 43 . 10 1 1 A 9 9 ASP H H 9 8.370 8.890 -0.520 1
1 44 . 10 1 1 A 9 9 ASP HA H 9 4.594 4.795 -0.201 1
1 47 . 10 1 1 A 9 9 ASP C C 9 175.765 175.690 0.075 1
1 48 . 10 1 1 A 9 9 ASP CA C 9 54.440 52.968 1.472 1
1 49 . 10 1 1 A 9 9 ASP CB C 9 40.898 40.683 0.215 1
1 50 . 10 1 1 A 9 9 ASP N N 9 120.504 123.580 -3.076 1
1 51 . 10 1 1 A 10 10 ASN H H 10 8.382 8.402 -0.020 1
1 52 . 10 1 1 A 10 10 ASN HA H 10 4.691 4.440 0.251 1
1 57 . 10 1 1 A 10 10 ASN C C 10 174.383 173.642 0.741 1
1 58 . 10 1 1 A 10 10 ASN CA C 10 53.241 54.455 -1.214 1
1 59 . 10 1 1 A 10 10 ASN CB C 10 38.674 36.650 2.024 1
1 60 . 10 1 1 A 10 10 ASN N N 10 119.406 113.495 5.911 1
1 62 . 10 1 1 A 11 11 ARG H H 11 7.942 7.066 0.876 1
1 63 . 10 1 1 A 11 11 ARG HA H 11 4.684 4.902 -0.218 1
1 70 . 10 1 1 A 11 11 ARG C C 11 173.640 174.100 -0.460 1
1 71 . 10 1 1 A 11 11 ARG CA C 11 54.246 54.059 0.187 1
1 72 . 10 1 1 A 11 11 ARG CB C 11 30.337 33.056 -2.719 1
1 75 . 10 1 1 A 11 11 ARG N N 11 121.145 114.176 6.969 1
1 76 . 10 1 1 A 12 12 PRO HA H 12 4.507 4.534 -0.027 1
1 83 . 10 1 1 A 12 12 PRO CA C 12 62.714 62.326 0.388 1
1 84 . 10 1 1 A 12 12 PRO CB C 12 31.942 33.177 -1.235 1
1 87 . 10 1 1 A 13 13 VAL H H 13 8.252 8.395 -0.143 1
1 88 . 10 1 1 A 13 13 VAL HA H 13 4.159 4.466 -0.307 1
1 96 . 10 1 1 A 13 13 VAL CA C 13 61.409 60.287 1.122 1
1 97 . 10 1 1 A 13 13 VAL CB C 13 34.858 34.392 0.466 1
1 100 . 10 1 1 A 13 13 VAL N N 13 118.395 120.326 -1.931 1
1 101 . 10 1 1 A 14 14 PHE H H 14 8.725 8.621 0.104 1
1 102 . 10 1 1 A 14 14 PHE HA H 14 4.781 4.578 0.203 1
1 110 . 10 1 1 A 14 14 PHE CA C 14 58.594 58.315 0.279 1
1 111 . 10 1 1 A 14 14 PHE CB C 14 39.594 39.469 0.125 1
1 117 . 10 1 1 A 14 14 PHE N N 14 122.950 127.253 -4.303 1
1 118 . 10 1 1 A 15 15 LYS H H 15 8.885 8.964 -0.079 1
1 119 . 10 1 1 A 15 15 LYS HA H 15 4.130 3.961 0.169 1
1 128 . 10 1 1 A 15 15 LYS C C 15 177.027 175.884 1.143 1
1 129 . 10 1 1 A 15 15 LYS CA C 15 58.478 59.899 -1.421 1
1 130 . 10 1 1 A 15 15 LYS CB C 15 32.748 32.567 0.181 1
1 134 . 10 1 1 A 15 15 LYS N N 15 123.863 125.673 -1.810 1
1 135 . 10 1 1 A 16 16 GLU H H 16 8.091 8.071 0.020 1
1 136 . 10 1 1 A 16 16 GLU HA H 16 4.438 4.763 -0.325 1
1 141 . 10 1 1 A 16 16 GLU C C 16 175.947 176.976 -1.029 1
1 142 . 10 1 1 A 16 16 GLU CA C 16 56.045 54.779 1.266 1
1 143 . 10 1 1 A 16 16 GLU CB C 16 30.766 32.486 -1.720 1
1 145 . 10 1 1 A 16 16 GLU N N 16 117.026 117.010 0.016 1
1 146 . 10 1 1 A 17 17 GLY H H 17 8.421 8.767 -0.346 1
1 147 . 10 1 1 A 17 17 GLY HA2 H 17 3.993 3.859 0.134 1
1 148 . 10 1 1 A 17 17 GLY HA3 H 17 3.913 3.860 0.053 1
1 149 . 10 1 1 A 17 17 GLY C C 17 173.564 174.045 -0.481 1
1 150 . 10 1 1 A 17 17 GLY CA C 17 45.448 47.744 -2.296 1
1 151 . 10 1 1 A 17 17 GLY N N 17 109.577 111.522 -1.945 1
1 152 . 10 1 1 A 18 18 GLN H H 18 7.858 7.977 -0.119 1
1 153 . 10 1 1 A 18 18 GLN HA H 18 5.065 5.075 -0.010 1
1 160 . 10 1 1 A 18 18 GLN C C 18 174.596 174.683 -0.087 1
1 161 . 10 1 1 A 18 18 GLN CA C 18 55.110 54.472 0.638 1
1 162 . 10 1 1 A 18 18 GLN CB C 18 30.329 31.366 -1.037 1
1 164 . 10 1 1 A 18 18 GLN N N 18 120.202 119.491 0.711 1
1 166 . 10 1 1 A 19 19 VAL H H 19 8.216 8.881 -0.665 1
1 167 . 10 1 1 A 19 19 VAL HA H 19 4.450 4.571 -0.121 1
1 175 . 10 1 1 A 19 19 VAL C C 19 173.648 174.177 -0.529 1
1 176 . 10 1 1 A 19 19 VAL CA C 19 60.788 61.104 -0.316 1
1 177 . 10 1 1 A 19 19 VAL CB C 19 35.336 35.194 0.142 1
1 180 . 10 1 1 A 19 19 VAL N N 19 121.257 125.734 -4.477 1
1 181 . 10 1 1 A 20 20 GLU H H 20 8.610 9.097 -0.487 1
1 182 . 10 1 1 A 20 20 GLU HA H 20 5.211 5.018 0.193 1
1 187 . 10 1 1 A 20 20 GLU C C 20 174.783 176.364 -1.581 1
1 188 . 10 1 1 A 20 20 GLU CA C 20 54.793 55.657 -0.864 1
1 189 . 10 1 1 A 20 20 GLU CB C 20 32.058 31.225 0.833 1
1 191 . 10 1 1 A 20 20 GLU N N 20 127.095 128.519 -1.424 1
1 192 . 10 1 1 A 21 21 VAL H H 21 8.727 8.973 -0.246 1
1 193 . 10 1 1 A 21 21 VAL HA H 21 4.633 5.076 -0.443 1
1 201 . 10 1 1 A 21 21 VAL C C 21 173.894 174.958 -1.064 1
1 202 . 10 1 1 A 21 21 VAL CA C 21 59.695 59.468 0.227 1
1 203 . 10 1 1 A 21 21 VAL CB C 21 35.865 34.792 1.073 1
1 206 . 10 1 1 A 21 21 VAL N N 21 120.489 121.005 -0.516 1
1 207 . 10 1 1 A 22 22 HIS H H 22 8.680 8.797 -0.117 1
1 208 . 10 1 1 A 22 22 HIS HA H 22 5.552 5.708 -0.156 1
1 212 . 10 1 1 A 22 22 HIS C C 22 174.298 173.685 0.613 1
1 213 . 10 1 1 A 22 22 HIS CA C 22 55.331 53.855 1.476 1
1 214 . 10 1 1 A 22 22 HIS CB C 22 32.369 31.920 0.449 1
1 216 . 10 1 1 A 22 22 HIS N N 22 124.991 118.774 6.217 1
1 217 . 10 1 1 A 23 23 ILE H H 23 9.179 8.713 0.466 1
1 218 . 10 1 1 A 23 23 ILE HA H 23 5.046 4.584 0.462 1
1 228 . 10 1 1 A 23 23 ILE C C 23 171.552 173.345 -1.793 1
1 229 . 10 1 1 A 23 23 ILE CA C 23 55.551 57.157 -1.606 1
1 230 . 10 1 1 A 23 23 ILE CB C 23 42.053 42.149 -0.096 1
1 234 . 10 1 1 A 23 23 ILE N N 23 123.121 123.412 -0.291 1
1 235 . 10 1 1 A 24 24 PRO HA H 24 4.816 4.827 -0.011 1
1 242 . 10 1 1 A 24 24 PRO C C 24 178.887 177.831 1.056 1
1 243 . 10 1 1 A 24 24 PRO CA C 24 62.216 62.651 -0.435 1
1 244 . 10 1 1 A 24 24 PRO CB C 24 32.895 32.828 0.067 1
1 247 . 10 1 1 A 25 25 GLU H H 25 8.399 8.700 -0.301 1
1 248 . 10 1 1 A 25 25 GLU HA H 25 3.785 4.014 -0.229 1
1 253 . 10 1 1 A 25 25 GLU C C 25 175.244 177.071 -1.827 1
1 254 . 10 1 1 A 25 25 GLU CA C 25 58.425 59.063 -0.638 1
1 255 . 10 1 1 A 25 25 GLU CB C 25 30.011 29.009 1.002 1
1 257 . 10 1 1 A 25 25 GLU N N 25 117.706 122.168 -4.462 1
1 258 . 10 1 1 A 26 26 ASN H H 26 7.488 7.815 -0.327 1
1 259 . 10 1 1 A 26 26 ASN HA H 26 4.702 4.842 -0.140 1
1 264 . 10 1 1 A 26 26 ASN C C 26 175.425 175.223 0.202 1
1 265 . 10 1 1 A 26 26 ASN CA C 26 51.584 52.104 -0.520 1
1 266 . 10 1 1 A 26 26 ASN CB C 26 37.243 38.708 -1.465 1
1 267 . 10 1 1 A 26 26 ASN N N 26 112.383 117.066 -4.683 1
1 269 . 10 1 1 A 27 27 ALA H H 27 7.716 7.067 0.649 1
1 270 . 10 1 1 A 27 27 ALA HA H 27 4.409 4.361 0.048 1
1 274 . 10 1 1 A 27 27 ALA C C 27 175.850 175.776 0.074 1
1 275 . 10 1 1 A 27 27 ALA CA C 27 51.037 50.938 0.099 1
1 276 . 10 1 1 A 27 27 ALA CB C 27 18.152 18.293 -0.141 1
1 277 . 10 1 1 A 27 27 ALA N N 27 125.139 122.309 2.830 1
1 278 . 10 1 1 A 28 28 PRO HA H 28 4.422 4.515 -0.093 1
1 285 . 10 1 1 A 28 28 PRO C C 28 178.442 176.986 1.456 1
1 286 . 10 1 1 A 28 28 PRO CA C 28 62.067 62.685 -0.618 1
1 287 . 10 1 1 A 28 28 PRO CB C 28 32.642 32.233 0.409 1
1 290 . 10 1 1 A 29 29 VAL H H 29 8.691 8.338 0.353 1
1 291 . 10 1 1 A 29 29 VAL HA H 29 3.239 3.637 -0.398 1
1 299 . 10 1 1 A 29 29 VAL C C 29 176.887 177.075 -0.188 1
1 300 . 10 1 1 A 29 29 VAL CA C 29 65.812 64.286 1.526 1
1 301 . 10 1 1 A 29 29 VAL CB C 29 31.174 31.388 -0.214 1
1 304 . 10 1 1 A 29 29 VAL N N 29 123.592 122.743 0.849 1
1 305 . 10 1 1 A 30 30 GLY H H 30 9.197 8.874 0.323 1
1 306 . 10 1 1 A 30 30 GLY HA2 H 30 4.486 3.956 0.530 1
1 307 . 10 1 1 A 30 30 GLY HA3 H 30 3.581 3.956 -0.375 1
1 308 . 10 1 1 A 30 30 GLY C C 30 174.347 174.729 -0.382 1
1 309 . 10 1 1 A 30 30 GLY CA C 30 44.320 44.757 -0.437 1
1 310 . 10 1 1 A 30 30 GLY N N 30 116.042 115.292 0.750 1
1 311 . 10 1 1 A 31 31 THR H H 31 7.838 7.252 0.586 1
1 312 . 10 1 1 A 31 31 THR HA H 31 3.959 4.153 -0.194 1
1 317 . 10 1 1 A 31 31 THR C C 31 174.274 174.084 0.190 1
1 318 . 10 1 1 A 31 31 THR CA C 31 65.160 63.299 1.861 1
1 319 . 10 1 1 A 31 31 THR CB C 31 69.972 68.927 1.045 1
1 321 . 10 1 1 A 31 31 THR N N 31 117.679 117.374 0.305 1
1 322 . 10 1 1 A 32 32 SER H H 32 9.022 8.587 0.435 1
1 323 . 10 1 1 A 32 32 SER HA H 32 4.273 4.621 -0.348 1
1 326 . 10 1 1 A 32 32 SER C C 32 172.692 174.443 -1.751 1
1 327 . 10 1 1 A 32 32 SER CA C 32 59.642 58.291 1.351 1
1 328 . 10 1 1 A 32 32 SER CB C 32 63.102 63.027 0.075 1
1 329 . 10 1 1 A 32 32 SER N N 32 123.045 121.918 1.127 1
1 330 . 10 1 1 A 33 33 VAL H H 33 9.202 8.754 0.448 1
1 331 . 10 1 1 A 33 33 VAL HA H 33 3.844 4.030 -0.186 1
1 339 . 10 1 1 A 33 33 VAL C C 33 174.782 175.788 -1.006 1
1 340 . 10 1 1 A 33 33 VAL CA C 33 64.242 63.973 0.269 1
1 341 . 10 1 1 A 33 33 VAL CB C 33 32.893 32.292 0.601 1
1 344 . 10 1 1 A 33 33 VAL N N 33 126.861 124.893 1.968 1
1 345 . 10 1 1 A 34 34 ILE H H 34 7.074 7.943 -0.869 1
1 346 . 10 1 1 A 34 34 ILE HA H 34 4.295 4.613 -0.318 1
1 356 . 10 1 1 A 34 34 ILE C C 34 170.577 173.357 -2.780 1
1 357 . 10 1 1 A 34 34 ILE CA C 34 59.500 59.311 0.189 1
1 358 . 10 1 1 A 34 34 ILE CB C 34 39.251 42.108 -2.857 1
1 362 . 10 1 1 A 34 34 ILE N N 34 111.445 119.139 -7.694 1
1 363 . 10 1 1 A 35 35 GLN H H 35 8.450 8.935 -0.485 1
1 364 . 10 1 1 A 35 35 GLN HA H 35 4.633 5.138 -0.505 1
1 371 . 10 1 1 A 35 35 GLN C C 35 174.354 174.312 0.042 1
1 372 . 10 1 1 A 35 35 GLN CA C 35 54.176 53.972 0.204 1
1 373 . 10 1 1 A 35 35 GLN CB C 35 29.456 32.224 -2.768 1
1 375 . 10 1 1 A 35 35 GLN N N 35 127.342 127.972 -0.630 1
1 377 . 10 1 1 A 36 36 LEU H H 36 7.761 8.404 -0.643 1
1 378 . 10 1 1 A 36 36 LEU HA H 36 4.492 5.131 -0.639 1
1 388 . 10 1 1 A 36 36 LEU C C 36 175.543 176.019 -0.476 1
1 389 . 10 1 1 A 36 36 LEU CA C 36 53.982 53.665 0.317 1
1 390 . 10 1 1 A 36 36 LEU CB C 36 42.776 44.421 -1.645 1
1 394 . 10 1 1 A 36 36 LEU N N 36 128.895 128.237 0.658 1
1 395 . 10 1 1 A 37 37 HIS H H 37 8.529 9.143 -0.614 1
1 396 . 10 1 1 A 37 37 HIS HA H 37 4.851 5.246 -0.395 1
1 400 . 10 1 1 A 37 37 HIS C C 37 172.985 173.221 -0.236 1
1 401 . 10 1 1 A 37 37 HIS CA C 37 55.833 53.982 1.851 1
1 402 . 10 1 1 A 37 37 HIS CB C 37 32.204 32.599 -0.395 1
1 404 . 10 1 1 A 37 37 HIS N N 37 115.903 124.255 -8.352 1
1 405 . 10 1 1 A 38 38 ALA H H 38 8.474 9.077 -0.603 1
1 406 . 10 1 1 A 38 38 ALA HA H 38 4.691 5.143 -0.452 1
1 410 . 10 1 1 A 38 38 ALA C C 38 175.548 176.065 -0.517 1
1 411 . 10 1 1 A 38 38 ALA CA C 38 50.491 50.398 0.093 1
1 412 . 10 1 1 A 38 38 ALA CB C 38 19.842 21.908 -2.066 1
1 413 . 10 1 1 A 38 38 ALA N N 38 128.891 130.173 -1.282 1
1 414 . 10 1 1 A 39 39 THR H H 39 8.095 8.588 -0.493 1
1 415 . 10 1 1 A 39 39 THR HA H 39 4.336 4.950 -0.614 1
1 420 . 10 1 1 A 39 39 THR C C 39 173.553 174.614 -1.061 1
1 421 . 10 1 1 A 39 39 THR CA C 39 60.417 60.327 0.090 1
1 422 . 10 1 1 A 39 39 THR CB C 39 70.912 70.985 -0.073 1
1 424 . 10 1 1 A 39 39 THR N N 39 110.982 111.237 -0.255 1
1 425 . 10 1 1 A 40 40 ASP H H 40 8.417 8.851 -0.434 1
1 426 . 10 1 1 A 40 40 ASP HA H 40 4.553 4.263 0.290 1
1 429 . 10 1 1 A 40 40 ASP C C 40 176.462 175.861 0.601 1
1 430 . 10 1 1 A 40 40 ASP CA C 40 54.158 57.630 -3.472 1
1 431 . 10 1 1 A 40 40 ASP CB C 40 41.517 41.183 0.334 1
1 432 . 10 1 1 A 40 40 ASP N N 40 121.450 124.661 -3.211 1
1 433 . 10 1 1 A 41 41 ALA H H 41 8.435 7.710 0.725 1
1 434 . 10 1 1 A 41 41 ALA HA H 41 4.129 4.524 -0.395 1
1 438 . 10 1 1 A 41 41 ALA C C 41 177.718 177.105 0.613 1
1 439 . 10 1 1 A 41 41 ALA CA C 41 53.436 50.668 2.768 1
1 440 . 10 1 1 A 41 41 ALA CB C 41 19.183 20.567 -1.384 1
1 441 . 10 1 1 A 41 41 ALA N N 41 124.607 119.084 5.523 1
1 442 . 10 1 1 A 42 42 ASP H H 42 8.310 8.874 -0.564 1
1 443 . 10 1 1 A 42 42 ASP HA H 42 4.588 4.326 0.262 1
1 446 . 10 1 1 A 42 42 ASP C C 42 176.546 177.001 -0.455 1
1 447 . 10 1 1 A 42 42 ASP CA C 42 54.599 57.392 -2.793 1
1 448 . 10 1 1 A 42 42 ASP CB C 42 41.146 40.946 0.200 1
1 449 . 10 1 1 A 42 42 ASP N N 42 118.030 124.334 -6.304 1
1 450 . 10 1 1 A 43 43 ILE H H 43 8.000 7.806 0.194 1
1 451 . 10 1 1 A 43 43 ILE HA H 43 4.130 4.087 0.043 1
1 461 . 10 1 1 A 43 43 ILE C C 43 176.901 175.807 1.094 1
1 462 . 10 1 1 A 43 43 ILE CA C 43 61.740 60.896 0.844 1
1 463 . 10 1 1 A 43 43 ILE CB C 43 38.491 38.767 -0.276 1
1 467 . 10 1 1 A 43 43 ILE N N 43 119.301 119.028 0.273 1
1 468 . 10 1 1 A 44 44 GLY H H 44 8.448 8.910 -0.462 1
1 469 . 10 1 1 A 44 44 GLY HA2 H 44 3.939 3.919 0.020 1
1 470 . 10 1 1 A 44 44 GLY HA3 H 44 3.939 3.920 0.019 1
1 471 . 10 1 1 A 44 44 GLY C C 44 174.393 174.062 0.331 1
1 472 . 10 1 1 A 44 44 GLY CA C 44 45.501 46.706 -1.205 1
1 473 . 10 1 1 A 44 44 GLY N N 44 111.333 117.628 -6.295 1
1 474 . 10 1 1 A 45 45 SER H H 45 8.061 8.327 -0.266 1
1 475 . 10 1 1 A 45 45 SER HA H 45 4.416 4.733 -0.317 1
1 478 . 10 1 1 A 45 45 SER C C 45 174.480 173.330 1.150 1
1 479 . 10 1 1 A 45 45 SER CA C 45 58.478 56.977 1.501 1
1 480 . 10 1 1 A 45 45 SER CB C 45 63.943 63.334 0.609 1
1 481 . 10 1 1 A 45 45 SER N N 45 115.551 119.207 -3.656 1
1 482 . 10 1 1 A 46 46 ASN H H 46 8.547 9.039 -0.492 1
1 483 . 10 1 1 A 46 46 ASN HA H 46 4.725 4.880 -0.155 1
1 488 . 10 1 1 A 46 46 ASN C C 46 175.031 173.743 1.288 1
1 489 . 10 1 1 A 46 46 ASN CA C 46 53.277 52.595 0.682 1
1 490 . 10 1 1 A 46 46 ASN CB C 46 38.798 36.573 2.225 1
1 491 . 10 1 1 A 46 46 ASN N N 46 120.698 125.627 -4.929 1
1 493 . 10 1 1 A 47 47 ALA H H 47 8.239 7.485 0.754 1
1 494 . 10 1 1 A 47 47 ALA HA H 47 4.283 4.688 -0.405 1
1 498 . 10 1 1 A 47 47 ALA C C 47 177.240 175.911 1.329 1
1 499 . 10 1 1 A 47 47 ALA CA C 47 52.731 51.815 0.916 1
1 500 . 10 1 1 A 47 47 ALA CB C 47 19.594 21.419 -1.825 1
1 501 . 10 1 1 A 47 47 ALA N N 47 124.093 123.631 0.462 1
1 502 . 10 1 1 A 48 48 GLU H H 48 8.376 8.616 -0.240 1
1 503 . 10 1 1 A 48 48 GLU HA H 48 4.264 4.468 -0.204 1
1 508 . 10 1 1 A 48 48 GLU C C 48 175.702 175.334 0.368 1
1 509 . 10 1 1 A 48 48 GLU CA C 48 55.992 55.626 0.366 1
1 510 . 10 1 1 A 48 48 GLU CB C 48 30.210 28.553 1.657 1
1 512 . 10 1 1 A 48 48 GLU N N 48 119.750 123.159 -3.409 1
1 513 . 10 1 1 A 49 49 ILE H H 49 7.806 7.960 -0.154 1
1 514 . 10 1 1 A 49 49 ILE HA H 49 3.919 4.027 -0.108 1
1 524 . 10 1 1 A 49 49 ILE C C 49 175.894 175.300 0.594 1
1 525 . 10 1 1 A 49 49 ILE CA C 49 60.559 61.554 -0.995 1
1 526 . 10 1 1 A 49 49 ILE CB C 49 37.860 37.286 0.574 1
1 530 . 10 1 1 A 49 49 ILE N N 49 122.772 125.391 -2.619 1
1 531 . 10 1 1 A 50 50 ARG H H 50 8.247 8.446 -0.199 1
1 532 . 10 1 1 A 50 50 ARG HA H 50 4.999 4.700 0.299 1
1 539 . 10 1 1 A 50 50 ARG C C 50 174.603 174.616 -0.013 1
1 540 . 10 1 1 A 50 50 ARG CA C 50 53.189 54.807 -1.618 1
1 541 . 10 1 1 A 50 50 ARG CB C 50 33.152 32.023 1.129 1
1 544 . 10 1 1 A 50 50 ARG N N 50 126.912 127.481 -0.569 1
1 545 . 10 1 1 A 51 51 TYR H H 51 9.041 9.022 0.019 1
1 546 . 10 1 1 A 51 51 TYR HA H 51 5.395 5.260 0.135 1
1 553 . 10 1 1 A 51 51 TYR C C 51 175.555 175.655 -0.100 1
1 554 . 10 1 1 A 51 51 TYR CA C 51 56.909 56.678 0.231 1
1 555 . 10 1 1 A 51 51 TYR CB C 51 40.116 41.064 -0.948 1
1 560 . 10 1 1 A 51 51 TYR N N 51 121.627 122.511 -0.884 1
1 561 . 10 1 1 A 52 52 ILE H H 52 8.850 8.421 0.429 1
1 562 . 10 1 1 A 52 52 ILE HA H 52 4.576 4.829 -0.253 1
1 572 . 10 1 1 A 52 52 ILE C C 52 175.371 174.876 0.495 1
1 573 . 10 1 1 A 52 52 ILE CA C 52 59.624 58.802 0.822 1
1 574 . 10 1 1 A 52 52 ILE CB C 52 42.895 42.051 0.844 1
1 578 . 10 1 1 A 52 52 ILE N N 52 117.697 117.560 0.137 1
1 579 . 10 1 1 A 53 53 PHE H H 53 8.748 8.740 0.008 1
1 580 . 10 1 1 A 53 53 PHE HA H 53 5.132 4.751 0.381 1
1 588 . 10 1 1 A 53 53 PHE C C 53 178.146 176.398 1.748 1
1 589 . 10 1 1 A 53 53 PHE CA C 53 57.667 57.420 0.247 1
1 590 . 10 1 1 A 53 53 PHE CB C 53 39.614 39.704 -0.090 1
1 596 . 10 1 1 A 53 53 PHE N N 53 121.433 121.722 -0.289 1
1 597 . 10 1 1 A 54 54 GLY H H 54 8.538 8.729 -0.191 1
1 598 . 10 1 1 A 54 54 GLY HA2 H 54 4.074 4.128 -0.054 1
1 599 . 10 1 1 A 54 54 GLY HA3 H 54 3.840 4.131 -0.291 1
1 600 . 10 1 1 A 54 54 GLY C C 54 174.530 172.992 1.538 1
1 601 . 10 1 1 A 54 54 GLY CA C 54 44.884 44.544 0.340 1
1 602 . 10 1 1 A 54 54 GLY N N 54 106.444 110.981 -4.537 1
1 603 . 10 1 1 A 55 55 ALA H H 55 8.594 8.333 0.261 1
1 604 . 10 1 1 A 55 55 ALA HA H 55 4.172 4.385 -0.213 1
1 608 . 10 1 1 A 55 55 ALA C C 55 178.718 177.534 1.184 1
1 609 . 10 1 1 A 55 55 ALA CA C 55 54.423 51.459 2.964 1
1 610 . 10 1 1 A 55 55 ALA CB C 55 19.059 20.198 -1.139 1
1 611 . 10 1 1 A 55 55 ALA N N 55 123.470 121.711 1.759 1
1 612 . 10 1 1 A 56 56 GLN H H 56 8.727 8.737 -0.010 1
1 613 . 10 1 1 A 56 56 GLN HA H 56 4.367 3.755 0.612 1
1 620 . 10 1 1 A 56 56 GLN C C 56 176.134 174.596 1.538 1
1 621 . 10 1 1 A 56 56 GLN CA C 56 55.660 56.729 -1.069 1
1 622 . 10 1 1 A 56 56 GLN CB C 56 28.152 26.861 1.291 1
1 624 . 10 1 1 A 56 56 GLN N N 56 114.221 115.689 -1.468 1
1 626 . 10 1 1 A 57 57 VAL H H 57 7.204 7.686 -0.482 1
1 627 . 10 1 1 A 57 57 VAL HA H 57 3.889 4.323 -0.434 1
1 635 . 10 1 1 A 57 57 VAL C C 57 175.371 175.465 -0.094 1
1 636 . 10 1 1 A 57 57 VAL CA C 57 63.908 61.145 2.763 1
1 637 . 10 1 1 A 57 57 VAL CB C 57 31.557 33.004 -1.447 1
1 640 . 10 1 1 A 57 57 VAL N N 57 121.341 119.336 2.005 1
1 641 . 10 1 1 A 58 58 ALA H H 58 8.920 8.452 0.468 1
1 642 . 10 1 1 A 58 58 ALA HA H 58 4.547 4.312 0.235 1
1 646 . 10 1 1 A 58 58 ALA C C 58 177.064 177.739 -0.675 1
1 647 . 10 1 1 A 58 58 ALA CA C 58 51.173 50.777 0.396 1
1 648 . 10 1 1 A 58 58 ALA CB C 58 17.842 18.129 -0.287 1
1 649 . 10 1 1 A 58 58 ALA N N 58 132.726 130.889 1.837 1
1 650 . 10 1 1 A 59 59 PRO HA H 59 4.101 4.320 -0.219 1
1 657 . 10 1 1 A 59 59 PRO C C 59 179.482 178.266 1.216 1
1 658 . 10 1 1 A 59 59 PRO CA C 59 66.060 64.909 1.151 1
1 659 . 10 1 1 A 59 59 PRO CB C 59 31.951 31.987 -0.036 1
1 662 . 10 1 1 A 60 60 ALA H H 60 8.706 8.111 0.595 1
1 663 . 10 1 1 A 60 60 ALA HA H 60 4.057 4.065 -0.008 1
1 667 . 10 1 1 A 60 60 ALA C C 60 179.627 180.338 -0.711 1
1 668 . 10 1 1 A 60 60 ALA CA C 60 55.305 55.049 0.256 1
1 669 . 10 1 1 A 60 60 ALA CB C 60 18.737 18.385 0.352 1
1 670 . 10 1 1 A 60 60 ALA N N 60 117.882 119.414 -1.532 1
1 671 . 10 1 1 A 61 61 THR H H 61 7.312 7.810 -0.498 1
1 672 . 10 1 1 A 61 61 THR HA H 61 4.153 4.077 0.076 1
1 677 . 10 1 1 A 61 61 THR C C 61 175.824 176.918 -1.094 1
1 678 . 10 1 1 A 61 61 THR CA C 61 66.412 66.399 0.013 1
1 679 . 10 1 1 A 61 61 THR CB C 61 68.787 68.109 0.678 1
1 681 . 10 1 1 A 61 61 THR N N 61 114.483 114.413 0.070 1
1 682 . 10 1 1 A 62 62 LYS H H 62 7.556 7.436 0.120 1
1 683 . 10 1 1 A 62 62 LYS HA H 62 3.943 3.824 0.119 1
1 692 . 10 1 1 A 62 62 LYS C C 62 176.884 179.097 -2.213 1
1 693 . 10 1 1 A 62 62 LYS CA C 62 59.095 59.103 -0.008 1
1 694 . 10 1 1 A 62 62 LYS CB C 62 32.204 31.512 0.692 1
1 698 . 10 1 1 A 62 62 LYS N N 62 118.994 119.861 -0.867 1
1 699 . 10 1 1 A 63 63 ARG H H 63 7.474 7.741 -0.267 1
1 700 . 10 1 1 A 63 63 ARG HA H 63 4.034 4.132 -0.098 1
1 707 . 10 1 1 A 63 63 ARG C C 63 177.574 178.588 -1.014 1
1 708 . 10 1 1 A 63 63 ARG CA C 63 58.143 58.525 -0.382 1
1 709 . 10 1 1 A 63 63 ARG CB C 63 30.755 29.815 0.940 1
1 712 . 10 1 1 A 63 63 ARG N N 63 114.251 121.083 -6.832 1
1 713 . 10 1 1 A 64 64 LEU H H 64 6.991 7.462 -0.471 1
1 714 . 10 1 1 A 64 64 LEU HA H 64 3.904 4.054 -0.150 1
1 724 . 10 1 1 A 64 64 LEU C C 64 176.632 176.433 0.199 1
1 725 . 10 1 1 A 64 64 LEU CA C 64 56.503 56.220 0.283 1
1 726 . 10 1 1 A 64 64 LEU CB C 64 42.929 43.290 -0.361 1
1 730 . 10 1 1 A 64 64 LEU N N 64 116.109 118.379 -2.270 1
1 731 . 10 1 1 A 65 65 PHE H H 65 7.673 8.290 -0.617 1
1 732 . 10 1 1 A 65 65 PHE HA H 65 5.386 5.154 0.232 1
1 740 . 10 1 1 A 65 65 PHE C C 65 173.067 174.250 -1.183 1
1 741 . 10 1 1 A 65 65 PHE CA C 65 56.521 56.636 -0.115 1
1 742 . 10 1 1 A 65 65 PHE CB C 65 41.270 41.271 -0.001 1
1 748 . 10 1 1 A 65 65 PHE N N 65 116.182 115.402 0.780 1
1 749 . 10 1 1 A 66 66 ALA H H 66 8.914 8.771 0.143 1
1 750 . 10 1 1 A 66 66 ALA HA H 66 4.748 5.285 -0.537 1
1 754 . 10 1 1 A 66 66 ALA C C 66 175.223 175.802 -0.579 1
1 755 . 10 1 1 A 66 66 ALA CA C 66 50.050 50.410 -0.360 1
1 756 . 10 1 1 A 66 66 ALA CB C 66 21.161 20.578 0.583 1
1 757 . 10 1 1 A 66 66 ALA N N 66 122.870 126.079 -3.209 1
1 758 . 10 1 1 A 67 67 LEU H H 67 8.498 9.035 -0.537 1
1 759 . 10 1 1 A 67 67 LEU HA H 67 4.713 5.233 -0.520 1
1 769 . 10 1 1 A 67 67 LEU C C 67 175.146 174.443 0.703 1
1 770 . 10 1 1 A 67 67 LEU CA C 67 52.518 53.437 -0.919 1
1 771 . 10 1 1 A 67 67 LEU CB C 67 45.308 44.833 0.475 1
1 775 . 10 1 1 A 67 67 LEU N N 67 122.208 124.927 -2.719 1
1 776 . 10 1 1 A 68 68 ASN H H 68 8.357 8.558 -0.201 1
1 777 . 10 1 1 A 68 68 ASN HA H 68 4.679 5.080 -0.401 1
1 782 . 10 1 1 A 68 68 ASN C C 68 176.228 175.453 0.775 1
1 783 . 10 1 1 A 68 68 ASN CA C 68 53.524 52.572 0.952 1
1 784 . 10 1 1 A 68 68 ASN CB C 68 39.580 39.469 0.111 1
1 785 . 10 1 1 A 68 68 ASN N N 68 126.940 124.153 2.787 1
1 787 . 10 1 1 A 69 69 ASN H H 69 8.861 9.162 -0.301 1
1 788 . 10 1 1 A 69 69 ASN HA H 69 5.137 4.872 0.265 1
1 793 . 10 1 1 A 69 69 ASN C C 69 175.631 176.415 -0.784 1
1 794 . 10 1 1 A 69 69 ASN CA C 69 56.009 54.598 1.411 1
1 795 . 10 1 1 A 69 69 ASN CB C 69 40.314 38.522 1.792 1
1 796 . 10 1 1 A 69 69 ASN N N 69 124.980 123.550 1.430 1
1 798 . 10 1 1 A 70 70 THR H H 70 8.635 7.854 0.781 1
1 799 . 10 1 1 A 70 70 THR HA H 70 4.815 4.606 0.209 1
1 804 . 10 1 1 A 70 70 THR C C 70 176.223 175.557 0.666 1
1 805 . 10 1 1 A 70 70 THR CA C 70 63.944 62.516 1.428 1
1 806 . 10 1 1 A 70 70 THR CB C 70 69.727 70.243 -0.516 1
1 808 . 10 1 1 A 70 70 THR N N 70 110.394 109.346 1.048 1
1 809 . 10 1 1 A 71 71 THR H H 71 8.069 7.791 0.278 1
1 810 . 10 1 1 A 71 71 THR HA H 71 4.566 4.598 -0.032 1
1 815 . 10 1 1 A 71 71 THR C C 71 176.213 175.264 0.949 1
1 816 . 10 1 1 A 71 71 THR CA C 71 61.683 61.861 -0.178 1
1 817 . 10 1 1 A 71 71 THR CB C 71 70.832 71.098 -0.266 1
1 819 . 10 1 1 A 71 71 THR N N 71 110.507 110.083 0.424 1
1 820 . 10 1 1 A 72 72 GLY H H 72 7.990 8.117 -0.127 1
1 821 . 10 1 1 A 72 72 GLY HA2 H 72 3.186 3.080 0.106 1
1 822 . 10 1 1 A 72 72 GLY HA3 H 72 2.516 3.523 -1.007 1
1 823 . 10 1 1 A 72 72 GLY C C 72 172.988 174.023 -1.035 1
1 824 . 10 1 1 A 72 72 GLY CA C 72 45.149 46.314 -1.165 1
1 825 . 10 1 1 A 72 72 GLY N N 72 110.788 112.362 -1.574 1
1 826 . 10 1 1 A 73 73 LEU H H 73 7.138 7.544 -0.406 1
1 827 . 10 1 1 A 73 73 LEU HA H 73 4.414 4.738 -0.324 1
1 837 . 10 1 1 A 73 73 LEU C C 73 176.836 174.658 2.178 1
1 838 . 10 1 1 A 73 73 LEU CA C 73 55.252 53.395 1.857 1
1 839 . 10 1 1 A 73 73 LEU CB C 73 43.574 45.248 -1.674 1
1 843 . 10 1 1 A 73 73 LEU N N 73 119.222 120.876 -1.654 1
1 844 . 10 1 1 A 74 74 ILE H H 74 8.925 8.930 -0.005 1
1 845 . 10 1 1 A 74 74 ILE HA H 74 5.555 5.298 0.257 1
1 855 . 10 1 1 A 74 74 ILE C C 74 175.978 175.486 0.492 1
1 856 . 10 1 1 A 74 74 ILE CA C 74 60.100 60.280 -0.180 1
1 857 . 10 1 1 A 74 74 ILE CB C 74 38.550 39.236 -0.686 1
1 861 . 10 1 1 A 74 74 ILE N N 74 129.871 127.297 2.574 1
1 862 . 10 1 1 A 75 75 THR H H 75 9.161 8.648 0.513 1
1 863 . 10 1 1 A 75 75 THR HA H 75 5.375 5.306 0.069 1
1 868 . 10 1 1 A 75 75 THR C C 75 174.798 173.539 1.259 1
1 869 . 10 1 1 A 75 75 THR CA C 75 58.796 59.408 -0.612 1
1 870 . 10 1 1 A 75 75 THR CB C 75 72.978 71.963 1.015 1
1 872 . 10 1 1 A 75 75 THR N N 75 117.522 117.888 -0.366 1
1 873 . 10 1 1 A 76 76 VAL H H 76 8.327 8.749 -0.422 1
1 874 . 10 1 1 A 76 76 VAL HA H 76 3.973 3.774 0.199 1
1 882 . 10 1 1 A 76 76 VAL C C 76 176.495 176.116 0.379 1
1 883 . 10 1 1 A 76 76 VAL CA C 76 64.085 63.244 0.841 1
1 884 . 10 1 1 A 76 76 VAL CB C 76 32.863 30.789 2.074 1
1 887 . 10 1 1 A 76 76 VAL N N 76 120.876 122.679 -1.803 1
1 888 . 10 1 1 A 77 77 GLN H H 77 9.525 8.593 0.932 1
1 889 . 10 1 1 A 77 77 GLN HA H 77 4.702 4.213 0.489 1
1 896 . 10 1 1 A 77 77 GLN C C 77 173.838 175.467 -1.629 1
1 897 . 10 1 1 A 77 77 GLN CA C 77 55.728 57.263 -1.535 1
1 898 . 10 1 1 A 77 77 GLN CB C 77 30.762 29.974 0.788 1
1 900 . 10 1 1 A 77 77 GLN N N 77 129.825 129.052 0.773 1
1 902 . 10 1 1 A 78 78 ARG H H 78 7.621 7.034 0.587 1
1 903 . 10 1 1 A 78 78 ARG HA H 78 4.347 4.752 -0.405 1
1 910 . 10 1 1 A 78 78 ARG C C 78 172.304 174.587 -2.283 1
1 911 . 10 1 1 A 78 78 ARG CA C 78 54.634 54.011 0.623 1
1 912 . 10 1 1 A 78 78 ARG CB C 78 34.685 35.209 -0.524 1
1 915 . 10 1 1 A 78 78 ARG N N 78 120.595 117.237 3.358 1
1 916 . 10 1 1 A 79 79 SER H H 79 7.958 8.515 -0.557 1
1 917 . 10 1 1 A 79 79 SER HA H 79 4.030 4.384 -0.354 1
1 920 . 10 1 1 A 79 79 SER C C 79 174.311 174.361 -0.050 1
1 921 . 10 1 1 A 79 79 SER CA C 79 59.889 59.087 0.802 1
1 922 . 10 1 1 A 79 79 SER CB C 79 63.548 63.783 -0.235 1
1 923 . 10 1 1 A 79 79 SER N N 79 112.565 118.015 -5.450 1
1 924 . 10 1 1 A 80 80 LEU H H 80 8.715 8.213 0.502 1
1 925 . 10 1 1 A 80 80 LEU HA H 80 4.114 5.128 -1.014 1
1 935 . 10 1 1 A 80 80 LEU C C 80 176.057 175.379 0.678 1
1 936 . 10 1 1 A 80 80 LEU CA C 80 55.091 53.325 1.766 1
1 937 . 10 1 1 A 80 80 LEU CB C 80 42.341 45.287 -2.946 1
1 941 . 10 1 1 A 80 80 LEU N N 80 123.070 124.265 -1.195 1
1 942 . 10 1 1 A 81 81 ASP H H 81 7.298 8.796 -1.498 1
1 943 . 10 1 1 A 81 81 ASP HA H 81 4.725 5.156 -0.431 1
1 946 . 10 1 1 A 81 81 ASP C C 81 175.939 175.198 0.741 1
1 947 . 10 1 1 A 81 81 ASP CA C 81 53.664 53.234 0.430 1
1 948 . 10 1 1 A 81 81 ASP CB C 81 42.947 44.802 -1.855 1
1 949 . 10 1 1 A 81 81 ASP N N 81 115.229 122.176 -6.947 1
1 950 . 10 1 1 A 82 82 ARG H H 82 9.289 8.875 0.414 1
1 951 . 10 1 1 A 82 82 ARG HA H 82 4.416 4.426 -0.010 1
1 959 . 10 1 1 A 82 82 ARG C C 82 176.406 178.124 -1.718 1
1 960 . 10 1 1 A 82 82 ARG CA C 82 56.397 57.121 -0.724 1
1 961 . 10 1 1 A 82 82 ARG CB C 82 30.638 30.969 -0.331 1
1 964 . 10 1 1 A 82 82 ARG N N 82 123.174 123.425 -0.251 1
1 966 . 10 1 1 A 83 83 GLU H H 83 8.468 8.224 0.244 1
1 967 . 10 1 1 A 83 83 GLU HA H 83 3.982 3.996 -0.014 1
1 972 . 10 1 1 A 83 83 GLU C C 83 177.740 178.444 -0.704 1
1 973 . 10 1 1 A 83 83 GLU CA C 83 58.425 59.437 -1.012 1
1 974 . 10 1 1 A 83 83 GLU CB C 83 29.701 29.332 0.369 1
1 976 . 10 1 1 A 83 83 GLU N N 83 119.549 119.651 -0.102 1
1 977 . 10 1 1 A 84 84 GLU H H 84 8.033 7.983 0.050 1
1 978 . 10 1 1 A 84 84 GLU HA H 84 4.206 4.312 -0.106 1
1 983 . 10 1 1 A 84 84 GLU C C 84 176.837 175.754 1.083 1
1 984 . 10 1 1 A 84 84 GLU CA C 84 58.056 58.099 -0.043 1
1 985 . 10 1 1 A 84 84 GLU CB C 84 30.432 31.101 -0.669 1
1 987 . 10 1 1 A 84 84 GLU N N 84 118.333 119.422 -1.089 1
1 988 . 10 1 1 A 85 85 THR H H 85 7.651 7.859 -0.208 1
1 989 . 10 1 1 A 85 85 THR HA H 85 4.307 4.590 -0.283 1
1 994 . 10 1 1 A 85 85 THR C C 85 171.568 174.322 -2.754 1
1 995 . 10 1 1 A 85 85 THR CA C 85 61.387 60.089 1.298 1
1 996 . 10 1 1 A 85 85 THR CB C 85 69.963 71.092 -1.129 1
1 998 . 10 1 1 A 85 85 THR N N 85 112.444 112.350 0.094 1
1 999 . 10 1 1 A 86 86 ALA H H 86 8.639 8.532 0.107 1
1 1000 . 10 1 1 A 86 86 ALA HA H 86 4.603 4.303 0.300 1
1 1004 . 10 1 1 A 86 86 ALA C C 86 175.560 177.391 -1.831 1
1 1005 . 10 1 1 A 86 86 ALA CA C 86 52.156 54.451 -2.295 1
1 1006 . 10 1 1 A 86 86 ALA CB C 86 20.378 19.940 0.438 1
1 1007 . 10 1 1 A 86 86 ALA N N 86 127.705 128.415 -0.710 1
1 1008 . 10 1 1 A 87 87 ILE H H 87 7.663 7.881 -0.218 1
1 1009 . 10 1 1 A 87 87 ILE HA H 87 4.828 4.571 0.257 1
1 1019 . 10 1 1 A 87 87 ILE C C 87 174.537 174.639 -0.102 1
1 1020 . 10 1 1 A 87 87 ILE CA C 87 60.329 60.151 0.178 1
1 1021 . 10 1 1 A 87 87 ILE CB C 87 41.090 39.628 1.462 1
1 1025 . 10 1 1 A 87 87 ILE N N 87 118.712 117.050 1.662 1
1 1026 . 10 1 1 A 88 88 HIS H H 88 9.098 8.745 0.353 1
1 1027 . 10 1 1 A 88 88 HIS HA H 88 4.576 5.165 -0.589 1
1 1032 . 10 1 1 A 88 88 HIS C C 88 174.354 174.163 0.191 1
1 1033 . 10 1 1 A 88 88 HIS CA C 88 54.740 54.305 0.435 1
1 1034 . 10 1 1 A 88 88 HIS CB C 88 33.955 32.311 1.644 1
1 1037 . 10 1 1 A 88 88 HIS N N 88 126.285 126.005 0.280 1
1 1038 . 10 1 1 A 89 89 LYS H H 89 8.957 8.889 0.068 1
1 1039 . 10 1 1 A 89 89 LYS HA H 89 4.873 4.619 0.254 1
1 1048 . 10 1 1 A 89 89 LYS C C 89 175.906 175.326 0.580 1
1 1049 . 10 1 1 A 89 89 LYS CA C 89 55.269 55.429 -0.160 1
1 1050 . 10 1 1 A 89 89 LYS CB C 89 32.945 32.824 0.121 1
1 1054 . 10 1 1 A 89 89 LYS N N 89 124.332 124.241 0.091 1
1 1055 . 10 1 1 A 90 90 VAL H H 90 9.174 8.566 0.608 1
1 1056 . 10 1 1 A 90 90 VAL HA H 90 4.227 4.890 -0.663 1
1 1064 . 10 1 1 A 90 90 VAL C C 90 174.168 174.625 -0.457 1
1 1065 . 10 1 1 A 90 90 VAL CA C 90 61.369 61.138 0.231 1
1 1066 . 10 1 1 A 90 90 VAL CB C 90 34.082 34.003 0.079 1
1 1069 . 10 1 1 A 90 90 VAL N N 90 124.319 125.548 -1.229 1
1 1070 . 10 1 1 A 91 91 THR H H 91 6.697 9.060 -2.363 1
1 1071 . 10 1 1 A 91 91 THR HA H 91 5.163 5.308 -0.145 1
1 1076 . 10 1 1 A 91 91 THR C C 91 173.812 174.132 -0.320 1
1 1077 . 10 1 1 A 91 91 THR CA C 91 61.935 61.755 0.180 1
1 1078 . 10 1 1 A 91 91 THR CB C 91 70.412 70.445 -0.033 1
1 1080 . 10 1 1 A 91 91 THR N N 91 122.637 124.210 -1.573 1
1 1081 . 10 1 1 A 92 92 VAL H H 92 9.292 8.744 0.548 1
1 1082 . 10 1 1 A 92 92 VAL HA H 92 4.736 4.650 0.086 1
1 1090 . 10 1 1 A 92 92 VAL C C 92 173.160 174.992 -1.832 1
1 1091 . 10 1 1 A 92 92 VAL CA C 92 60.982 61.084 -0.102 1
1 1092 . 10 1 1 A 92 92 VAL CB C 92 35.130 33.982 1.148 1
1 1095 . 10 1 1 A 92 92 VAL N N 92 128.265 127.201 1.064 1
1 1096 . 10 1 1 A 93 93 LEU H H 93 9.495 8.595 0.900 1
1 1097 . 10 1 1 A 93 93 LEU HA H 93 5.628 5.447 0.181 1
1 1107 . 10 1 1 A 93 93 LEU C C 93 176.274 175.046 1.228 1
1 1108 . 10 1 1 A 93 93 LEU CA C 93 52.773 53.487 -0.714 1
1 1109 . 10 1 1 A 93 93 LEU CB C 93 43.454 44.524 -1.070 1
1 1113 . 10 1 1 A 93 93 LEU N N 93 126.350 126.678 -0.328 1
1 1114 . 10 1 1 A 94 94 ALA H H 94 8.688 8.714 -0.026 1
1 1115 . 10 1 1 A 94 94 ALA HA H 94 4.986 5.081 -0.095 1
1 1119 . 10 1 1 A 94 94 ALA C C 94 175.787 175.616 0.171 1
1 1120 . 10 1 1 A 94 94 ALA CA C 94 49.610 50.445 -0.835 1
1 1121 . 10 1 1 A 94 94 ALA CB C 94 21.463 21.081 0.382 1
1 1122 . 10 1 1 A 94 94 ALA N N 94 123.429 127.178 -3.749 1
1 1123 . 10 1 1 A 95 95 SER H H 95 8.401 8.629 -0.228 1
1 1124 . 10 1 1 A 95 95 SER HA H 95 4.828 5.127 -0.299 1
1 1127 . 10 1 1 A 95 95 SER C C 95 174.327 173.466 0.861 1
1 1128 . 10 1 1 A 95 95 SER CA C 95 56.239 56.162 0.077 1
1 1129 . 10 1 1 A 95 95 SER CB C 95 65.561 64.749 0.812 1
1 1130 . 10 1 1 A 95 95 SER N N 95 114.418 118.971 -4.553 1
1 1131 . 10 1 1 A 96 96 ASP H H 96 8.690 8.751 -0.061 1
1 1132 . 10 1 1 A 96 96 ASP HA H 96 4.908 4.778 0.130 1
1 1135 . 10 1 1 A 96 96 ASP C C 96 177.096 176.750 0.346 1
1 1136 . 10 1 1 A 96 96 ASP CA C 96 52.818 54.756 -1.938 1
1 1137 . 10 1 1 A 96 96 ASP CB C 96 41.253 42.118 -0.865 1
1 1138 . 10 1 1 A 96 96 ASP N N 96 125.624 124.221 1.403 1
1 1139 . 10 1 1 A 97 97 GLY H H 97 8.524 7.381 1.143 1
1 1140 . 10 1 1 A 97 97 GLY HA2 H 97 4.320 4.119 0.201 1
1 1141 . 10 1 1 A 97 97 GLY HA3 H 97 3.620 4.120 -0.500 1
1 1142 . 10 1 1 A 97 97 GLY C C 97 174.620 172.967 1.653 1
1 1143 . 10 1 1 A 97 97 GLY CA C 97 45.422 45.696 -0.274 1
1 1144 . 10 1 1 A 97 97 GLY N N 97 109.283 106.216 3.067 1
1 1145 . 10 1 1 A 98 98 SER H H 98 8.575 7.869 0.706 1
1 1146 . 10 1 1 A 98 98 SER HA H 98 4.607 4.947 -0.340 1
1 1149 . 10 1 1 A 98 98 SER C C 98 174.478 174.323 0.155 1
1 1150 . 10 1 1 A 98 98 SER CA C 98 59.095 55.978 3.117 1
1 1151 . 10 1 1 A 98 98 SER CB C 98 64.800 66.023 -1.223 1
1 1152 . 10 1 1 A 98 98 SER N N 98 116.640 114.892 1.748 1
1 1153 . 10 1 1 A 99 99 SER H H 99 8.945 8.876 0.069 1
1 1154 . 10 1 1 A 99 99 SER HA H 99 4.530 4.283 0.247 1
1 1157 . 10 1 1 A 99 99 SER C C 99 174.491 173.125 1.366 1
1 1158 . 10 1 1 A 99 99 SER CA C 99 58.460 61.565 -3.105 1
1 1159 . 10 1 1 A 99 99 SER CB C 99 64.146 63.419 0.727 1
1 1160 . 10 1 1 A 99 99 SER N N 99 117.676 119.843 -2.167 1
1 1161 . 10 1 1 A 100 100 THR H H 100 8.411 8.105 0.306 1
1 1162 . 10 1 1 A 100 100 THR HA H 100 4.490 4.701 -0.211 1
1 1167 . 10 1 1 A 100 100 THR C C 100 172.766 172.434 0.332 1
1 1168 . 10 1 1 A 100 100 THR CA C 100 60.629 59.245 1.384 1
1 1169 . 10 1 1 A 100 100 THR CB C 100 69.778 70.497 -0.719 1
1 1171 . 10 1 1 A 100 100 THR N N 100 118.401 112.938 5.463 1
1 1172 . 10 1 1 A 101 101 PRO HA H 101 4.631 4.550 0.081 1
1 1179 . 10 1 1 A 101 101 PRO C C 101 177.227 175.627 1.600 1
1 1180 . 10 1 1 A 101 101 PRO CA C 101 63.097 62.341 0.756 1
1 1181 . 10 1 1 A 101 101 PRO CB C 101 32.917 32.906 0.011 1
1 1184 . 10 1 1 A 102 102 ALA H H 102 8.497 8.064 0.433 1
1 1185 . 10 1 1 A 102 102 ALA HA H 102 4.619 4.871 -0.252 1
1 1189 . 10 1 1 A 102 102 ALA C C 102 176.542 176.892 -0.350 1
1 1190 . 10 1 1 A 102 102 ALA CA C 102 51.390 50.840 0.550 1
1 1191 . 10 1 1 A 102 102 ALA CB C 102 20.815 20.652 0.163 1
1 1192 . 10 1 1 A 102 102 ALA N N 102 124.487 122.762 1.725 1
1 1193 . 10 1 1 A 103 103 ARG H H 103 8.663 8.948 -0.285 1
1 1194 . 10 1 1 A 103 103 ARG HA H 103 5.515 4.973 0.542 1
1 1201 . 10 1 1 A 103 103 ARG C C 103 174.539 175.448 -0.909 1
1 1202 . 10 1 1 A 103 103 ARG CA C 103 55.164 55.462 -0.298 1
1 1203 . 10 1 1 A 103 103 ARG CB C 103 34.393 32.266 2.127 1
1 1206 . 10 1 1 A 103 103 ARG N N 103 119.596 123.192 -3.596 1
1 1207 . 10 1 1 A 104 104 ALA H H 104 9.027 8.644 0.383 1
1 1208 . 10 1 1 A 104 104 ALA HA H 104 4.782 5.048 -0.266 1
1 1212 . 10 1 1 A 104 104 ALA C C 104 176.276 175.609 0.667 1
1 1213 . 10 1 1 A 104 104 ALA CA C 104 50.297 51.367 -1.070 1
1 1214 . 10 1 1 A 104 104 ALA CB C 104 20.810 21.019 -0.209 1
1 1215 . 10 1 1 A 104 104 ALA N N 104 126.962 122.736 4.226 1
1 1216 . 10 1 1 A 105 105 THR H H 105 8.384 8.754 -0.370 1
1 1217 . 10 1 1 A 105 105 THR HA H 105 4.954 4.948 0.006 1
1 1222 . 10 1 1 A 105 105 THR C C 105 173.243 173.872 -0.629 1
1 1223 . 10 1 1 A 105 105 THR CA C 105 61.475 62.052 -0.577 1
1 1224 . 10 1 1 A 105 105 THR CB C 105 70.569 70.452 0.117 1
1 1226 . 10 1 1 A 105 105 THR N N 105 115.327 118.525 -3.198 1
1 1227 . 10 1 1 A 106 106 VAL H H 106 8.970 8.744 0.226 1
1 1228 . 10 1 1 A 106 106 VAL HA H 106 4.702 4.808 -0.106 1
1 1236 . 10 1 1 A 106 106 VAL C C 106 174.743 174.640 0.103 1
1 1237 . 10 1 1 A 106 106 VAL CA C 106 59.712 60.559 -0.847 1
1 1238 . 10 1 1 A 106 106 VAL CB C 106 34.327 34.462 -0.135 1
1 1241 . 10 1 1 A 106 106 VAL N N 106 126.226 127.161 -0.935 1
1 1242 . 10 1 1 A 107 107 THR H H 107 8.833 8.470 0.363 1
1 1243 . 10 1 1 A 107 107 THR HA H 107 4.862 4.859 0.003 1
1 1248 . 10 1 1 A 107 107 THR C C 107 172.970 173.770 -0.800 1
1 1249 . 10 1 1 A 107 107 THR CA C 107 62.322 62.117 0.205 1
1 1250 . 10 1 1 A 107 107 THR CB C 107 69.463 69.243 0.220 1
1 1252 . 10 1 1 A 107 107 THR N N 107 125.403 123.635 1.768 1
1 1253 . 10 1 1 A 108 108 ILE H H 108 9.234 8.912 0.322 1
1 1254 . 10 1 1 A 108 108 ILE HA H 108 4.178 4.636 -0.458 1
1 1264 . 10 1 1 A 108 108 ILE C C 108 174.087 175.219 -1.132 1
1 1265 . 10 1 1 A 108 108 ILE CA C 108 60.365 60.464 -0.099 1
1 1266 . 10 1 1 A 108 108 ILE CB C 108 39.745 37.651 2.094 1
1 1270 . 10 1 1 A 108 108 ILE N N 108 127.152 128.587 -1.435 1
1 1271 . 10 1 1 A 109 109 ASN H H 109 8.723 8.590 0.133 1
1 1272 . 10 1 1 A 109 109 ASN HA H 109 5.147 5.177 -0.030 1
1 1277 . 10 1 1 A 109 109 ASN C C 109 173.592 174.676 -1.084 1
1 1278 . 10 1 1 A 109 109 ASN CA C 109 52.501 53.097 -0.596 1
1 1279 . 10 1 1 A 109 109 ASN CB C 109 40.791 39.530 1.261 1
1 1280 . 10 1 1 A 109 109 ASN N N 109 126.866 126.215 0.651 1
1 1282 . 10 1 1 A 110 110 VAL H H 110 9.046 8.492 0.554 1
1 1283 . 10 1 1 A 110 110 VAL HA H 110 5.081 4.807 0.274 1
1 1291 . 10 1 1 A 110 110 VAL C C 110 176.921 176.448 0.473 1
1 1292 . 10 1 1 A 110 110 VAL CA C 110 61.634 61.898 -0.264 1
1 1293 . 10 1 1 A 110 110 VAL CB C 110 31.809 32.200 -0.391 1
1 1296 . 10 1 1 A 110 110 VAL N N 110 126.070 125.269 0.801 1
1 1297 . 10 1 1 A 111 111 THR H H 111 9.197 8.789 0.408 1
1 1298 . 10 1 1 A 111 111 THR HA H 111 4.566 4.899 -0.333 1
1 1303 . 10 1 1 A 111 111 THR C C 111 174.087 174.605 -0.518 1
1 1304 . 10 1 1 A 111 111 THR CA C 111 61.145 60.066 1.079 1
1 1305 . 10 1 1 A 111 111 THR CB C 111 70.706 70.998 -0.292 1
1 1307 . 10 1 1 A 111 111 THR N N 111 121.425 119.184 2.241 1
1 1308 . 10 1 1 A 112 112 ASP H H 112 8.435 8.567 -0.132 1
1 1309 . 10 1 1 A 112 112 ASP HA H 112 4.656 4.782 -0.126 1
1 1312 . 10 1 1 A 112 112 ASP C C 112 176.745 175.900 0.845 1
1 1313 . 10 1 1 A 112 112 ASP CA C 112 54.158 54.809 -0.651 1
1 1314 . 10 1 1 A 112 112 ASP CB C 112 41.575 41.796 -0.221 1
1 1315 . 10 1 1 A 112 112 ASP N N 112 119.566 122.170 -2.604 1
1 1316 . 10 1 1 A 113 113 VAL H H 113 8.629 8.536 0.093 1
1 1317 . 10 1 1 A 113 113 VAL HA H 113 4.078 4.909 -0.831 1
1 1325 . 10 1 1 A 113 113 VAL C C 113 175.247 174.728 0.519 1
1 1326 . 10 1 1 A 113 113 VAL CA C 113 62.533 59.984 2.549 1
1 1327 . 10 1 1 A 113 113 VAL CB C 113 32.534 34.776 -2.242 1
1 1330 . 10 1 1 A 113 113 VAL N N 113 119.356 116.493 2.863 1
1 4 . 11 1 1 A 2 2 SER H H 2 8.289 7.957 0.332 1
1 5 . 11 1 1 A 2 2 SER HA H 2 4.530 4.973 -0.443 1
1 7 . 11 1 1 A 2 2 SER C C 2 174.868 173.235 1.633 1
1 8 . 11 1 1 A 2 2 SER CA C 2 58.284 56.039 2.245 1
1 9 . 11 1 1 A 2 2 SER CB C 2 63.769 66.743 -2.974 1
1 10 . 11 1 1 A 2 2 SER N N 2 115.842 111.901 3.941 1
1 11 . 11 1 1 A 3 3 SER H H 3 8.490 8.512 -0.022 1
1 12 . 11 1 1 A 3 3 SER HA H 3 4.496 4.808 -0.312 1
1 14 . 11 1 1 A 3 3 SER C C 3 175.043 174.458 0.585 1
1 15 . 11 1 1 A 3 3 SER CA C 3 58.549 57.418 1.131 1
1 16 . 11 1 1 A 3 3 SER CB C 3 63.687 63.614 0.073 1
1 17 . 11 1 1 A 3 3 SER N N 3 117.930 117.647 0.283 1
1 18 . 11 1 1 A 4 4 GLY H H 4 8.482 8.666 -0.184 1
1 19 . 11 1 1 A 4 4 GLY C C 4 174.344 174.557 -0.213 1
1 20 . 11 1 1 A 4 4 GLY CA C 4 45.536 43.769 1.767 1
1 21 . 11 1 1 A 4 4 GLY N N 4 110.985 115.045 -4.060 1
1 22 . 11 1 1 A 6 6 SER HA H 6 4.508 4.816 -0.308 1
1 24 . 11 1 1 A 6 6 SER C C 6 175.026 173.857 1.169 1
1 25 . 11 1 1 A 6 6 SER CA C 6 58.584 56.680 1.904 1
1 26 . 11 1 1 A 6 6 SER CB C 6 63.646 64.296 -0.650 1
1 27 . 11 1 1 A 7 7 GLY H H 7 8.419 8.346 0.073 1
1 28 . 11 1 1 A 7 7 GLY HA2 H 7 3.993 4.041 -0.048 1
1 29 . 11 1 1 A 7 7 GLY C C 7 173.995 173.846 0.149 1
1 30 . 11 1 1 A 7 7 GLY CA C 7 45.466 45.255 0.211 1
1 31 . 11 1 1 A 7 7 GLY N N 7 110.615 115.272 -4.657 1
1 32 . 11 1 1 A 8 8 ASN H H 8 8.322 8.184 0.138 1
1 33 . 11 1 1 A 8 8 ASN HA H 8 4.736 5.353 -0.617 1
1 38 . 11 1 1 A 8 8 ASN C C 8 174.907 174.930 -0.023 1
1 39 . 11 1 1 A 8 8 ASN CA C 8 53.259 51.410 1.849 1
1 40 . 11 1 1 A 8 8 ASN CB C 8 39.127 41.996 -2.869 1
1 41 . 11 1 1 A 8 8 ASN N N 8 118.602 118.685 -0.083 1
1 43 . 11 1 1 A 9 9 ASP H H 9 8.370 8.679 -0.309 1
1 44 . 11 1 1 A 9 9 ASP HA H 9 4.594 4.389 0.205 1
1 47 . 11 1 1 A 9 9 ASP C C 9 175.765 176.496 -0.731 1
1 48 . 11 1 1 A 9 9 ASP CA C 9 54.440 57.213 -2.773 1
1 49 . 11 1 1 A 9 9 ASP CB C 9 40.898 40.323 0.575 1
1 50 . 11 1 1 A 9 9 ASP N N 9 120.504 120.570 -0.066 1
1 51 . 11 1 1 A 10 10 ASN H H 10 8.382 8.179 0.203 1
1 52 . 11 1 1 A 10 10 ASN HA H 10 4.691 4.316 0.375 1
1 57 . 11 1 1 A 10 10 ASN C C 10 174.383 173.969 0.414 1
1 58 . 11 1 1 A 10 10 ASN CA C 10 53.241 54.093 -0.852 1
1 59 . 11 1 1 A 10 10 ASN CB C 10 38.674 37.421 1.253 1
1 60 . 11 1 1 A 10 10 ASN N N 10 119.406 117.438 1.968 1
1 62 . 11 1 1 A 11 11 ARG H H 11 7.942 7.605 0.337 1
1 63 . 11 1 1 A 11 11 ARG HA H 11 4.684 4.711 -0.027 1
1 70 . 11 1 1 A 11 11 ARG C C 11 173.640 173.608 0.032 1
1 71 . 11 1 1 A 11 11 ARG CA C 11 54.246 52.852 1.394 1
1 72 . 11 1 1 A 11 11 ARG CB C 11 30.337 32.719 -2.382 1
1 75 . 11 1 1 A 11 11 ARG N N 11 121.145 117.852 3.293 1
1 76 . 11 1 1 A 12 12 PRO HA H 12 4.507 4.706 -0.199 1
1 83 . 11 1 1 A 12 12 PRO CA C 12 62.714 62.505 0.209 1
1 84 . 11 1 1 A 12 12 PRO CB C 12 31.942 31.497 0.445 1
1 87 . 11 1 1 A 13 13 VAL H H 13 8.252 8.330 -0.078 1
1 88 . 11 1 1 A 13 13 VAL HA H 13 4.159 4.200 -0.041 1
1 96 . 11 1 1 A 13 13 VAL CA C 13 61.409 61.792 -0.383 1
1 97 . 11 1 1 A 13 13 VAL CB C 13 34.858 32.423 2.435 1
1 100 . 11 1 1 A 13 13 VAL N N 13 118.395 124.182 -5.787 1
1 101 . 11 1 1 A 14 14 PHE H H 14 8.725 8.919 -0.194 1
1 102 . 11 1 1 A 14 14 PHE HA H 14 4.781 4.723 0.058 1
1 110 . 11 1 1 A 14 14 PHE CA C 14 58.594 58.165 0.429 1
1 111 . 11 1 1 A 14 14 PHE CB C 14 39.594 40.200 -0.606 1
1 117 . 11 1 1 A 14 14 PHE N N 14 122.950 126.584 -3.634 1
1 118 . 11 1 1 A 15 15 LYS H H 15 8.885 9.007 -0.122 1
1 119 . 11 1 1 A 15 15 LYS HA H 15 4.130 4.190 -0.060 1
1 128 . 11 1 1 A 15 15 LYS C C 15 177.027 176.187 0.840 1
1 129 . 11 1 1 A 15 15 LYS CA C 15 58.478 59.011 -0.533 1
1 130 . 11 1 1 A 15 15 LYS CB C 15 32.748 33.109 -0.361 1
1 134 . 11 1 1 A 15 15 LYS N N 15 123.863 122.871 0.992 1
1 135 . 11 1 1 A 16 16 GLU H H 16 8.091 8.068 0.023 1
1 136 . 11 1 1 A 16 16 GLU HA H 16 4.438 4.646 -0.208 1
1 141 . 11 1 1 A 16 16 GLU C C 16 175.947 177.106 -1.159 1
1 142 . 11 1 1 A 16 16 GLU CA C 16 56.045 54.986 1.059 1
1 143 . 11 1 1 A 16 16 GLU CB C 16 30.766 31.623 -0.857 1
1 145 . 11 1 1 A 16 16 GLU N N 16 117.026 117.173 -0.147 1
1 146 . 11 1 1 A 17 17 GLY H H 17 8.421 8.724 -0.303 1
1 147 . 11 1 1 A 17 17 GLY HA2 H 17 3.993 3.860 0.133 1
1 148 . 11 1 1 A 17 17 GLY HA3 H 17 3.913 3.877 0.036 1
1 149 . 11 1 1 A 17 17 GLY C C 17 173.564 174.110 -0.546 1
1 150 . 11 1 1 A 17 17 GLY CA C 17 45.448 47.813 -2.365 1
1 151 . 11 1 1 A 17 17 GLY N N 17 109.577 111.980 -2.403 1
1 152 . 11 1 1 A 18 18 GLN H H 18 7.858 7.848 0.010 1
1 153 . 11 1 1 A 18 18 GLN HA H 18 5.065 5.105 -0.040 1
1 160 . 11 1 1 A 18 18 GLN C C 18 174.596 174.264 0.332 1
1 161 . 11 1 1 A 18 18 GLN CA C 18 55.110 54.432 0.678 1
1 162 . 11 1 1 A 18 18 GLN CB C 18 30.329 31.878 -1.549 1
1 164 . 11 1 1 A 18 18 GLN N N 18 120.202 119.273 0.929 1
1 166 . 11 1 1 A 19 19 VAL H H 19 8.216 8.658 -0.442 1
1 167 . 11 1 1 A 19 19 VAL HA H 19 4.450 4.599 -0.149 1
1 175 . 11 1 1 A 19 19 VAL C C 19 173.648 173.741 -0.093 1
1 176 . 11 1 1 A 19 19 VAL CA C 19 60.788 60.797 -0.009 1
1 177 . 11 1 1 A 19 19 VAL CB C 19 35.336 35.252 0.084 1
1 180 . 11 1 1 A 19 19 VAL N N 19 121.257 126.020 -4.763 1
1 181 . 11 1 1 A 20 20 GLU H H 20 8.610 9.033 -0.423 1
1 182 . 11 1 1 A 20 20 GLU HA H 20 5.211 4.957 0.254 1
1 187 . 11 1 1 A 20 20 GLU C C 20 174.783 175.973 -1.190 1
1 188 . 11 1 1 A 20 20 GLU CA C 20 54.793 55.347 -0.554 1
1 189 . 11 1 1 A 20 20 GLU CB C 20 32.058 31.513 0.545 1
1 191 . 11 1 1 A 20 20 GLU N N 20 127.095 128.376 -1.281 1
1 192 . 11 1 1 A 21 21 VAL H H 21 8.727 8.603 0.124 1
1 193 . 11 1 1 A 21 21 VAL HA H 21 4.633 4.858 -0.225 1
1 201 . 11 1 1 A 21 21 VAL C C 21 173.894 174.142 -0.248 1
1 202 . 11 1 1 A 21 21 VAL CA C 21 59.695 59.026 0.669 1
1 203 . 11 1 1 A 21 21 VAL CB C 21 35.865 35.378 0.487 1
1 206 . 11 1 1 A 21 21 VAL N N 21 120.489 120.170 0.319 1
1 207 . 11 1 1 A 22 22 HIS H H 22 8.680 8.815 -0.135 1
1 208 . 11 1 1 A 22 22 HIS HA H 22 5.552 5.170 0.382 1
1 212 . 11 1 1 A 22 22 HIS C C 22 174.298 173.647 0.651 1
1 213 . 11 1 1 A 22 22 HIS CA C 22 55.331 54.324 1.007 1
1 214 . 11 1 1 A 22 22 HIS CB C 22 32.369 30.942 1.427 1
1 216 . 11 1 1 A 22 22 HIS N N 22 124.991 121.130 3.861 1
1 217 . 11 1 1 A 23 23 ILE H H 23 9.179 9.054 0.125 1
1 218 . 11 1 1 A 23 23 ILE HA H 23 5.046 4.830 0.216 1
1 228 . 11 1 1 A 23 23 ILE C C 23 171.552 174.508 -2.956 1
1 229 . 11 1 1 A 23 23 ILE CA C 23 55.551 57.216 -1.665 1
1 230 . 11 1 1 A 23 23 ILE CB C 23 42.053 41.335 0.718 1
1 234 . 11 1 1 A 23 23 ILE N N 23 123.121 124.358 -1.237 1
1 235 . 11 1 1 A 24 24 PRO HA H 24 4.816 4.990 -0.174 1
1 242 . 11 1 1 A 24 24 PRO C C 24 178.887 176.896 1.991 1
1 243 . 11 1 1 A 24 24 PRO CA C 24 62.216 62.735 -0.519 1
1 244 . 11 1 1 A 24 24 PRO CB C 24 32.895 33.065 -0.170 1
1 247 . 11 1 1 A 25 25 GLU H H 25 8.399 8.112 0.287 1
1 248 . 11 1 1 A 25 25 GLU HA H 25 3.785 4.142 -0.357 1
1 253 . 11 1 1 A 25 25 GLU C C 25 175.244 176.754 -1.510 1
1 254 . 11 1 1 A 25 25 GLU CA C 25 58.425 57.977 0.448 1
1 255 . 11 1 1 A 25 25 GLU CB C 25 30.011 29.474 0.537 1
1 257 . 11 1 1 A 25 25 GLU N N 25 117.706 120.897 -3.191 1
1 258 . 11 1 1 A 26 26 ASN H H 26 7.488 7.802 -0.314 1
1 259 . 11 1 1 A 26 26 ASN HA H 26 4.702 4.865 -0.163 1
1 264 . 11 1 1 A 26 26 ASN C C 26 175.425 175.076 0.349 1
1 265 . 11 1 1 A 26 26 ASN CA C 26 51.584 51.963 -0.379 1
1 266 . 11 1 1 A 26 26 ASN CB C 26 37.243 38.698 -1.455 1
1 267 . 11 1 1 A 26 26 ASN N N 26 112.383 117.553 -5.170 1
1 269 . 11 1 1 A 27 27 ALA H H 27 7.716 7.345 0.371 1
1 270 . 11 1 1 A 27 27 ALA HA H 27 4.409 4.361 0.048 1
1 274 . 11 1 1 A 27 27 ALA C C 27 175.850 175.874 -0.024 1
1 275 . 11 1 1 A 27 27 ALA CA C 27 51.037 50.947 0.090 1
1 276 . 11 1 1 A 27 27 ALA CB C 27 18.152 18.441 -0.289 1
1 277 . 11 1 1 A 27 27 ALA N N 27 125.139 122.461 2.678 1
1 278 . 11 1 1 A 28 28 PRO HA H 28 4.422 4.499 -0.077 1
1 285 . 11 1 1 A 28 28 PRO C C 28 178.442 176.451 1.991 1
1 286 . 11 1 1 A 28 28 PRO CA C 28 62.067 62.742 -0.675 1
1 287 . 11 1 1 A 28 28 PRO CB C 28 32.642 32.000 0.642 1
1 290 . 11 1 1 A 29 29 VAL H H 29 8.691 8.279 0.412 1
1 291 . 11 1 1 A 29 29 VAL HA H 29 3.239 3.632 -0.393 1
1 299 . 11 1 1 A 29 29 VAL C C 29 176.887 176.983 -0.096 1
1 300 . 11 1 1 A 29 29 VAL CA C 29 65.812 63.893 1.919 1
1 301 . 11 1 1 A 29 29 VAL CB C 29 31.174 31.158 0.016 1
1 304 . 11 1 1 A 29 29 VAL N N 29 123.592 122.524 1.068 1
1 305 . 11 1 1 A 30 30 GLY H H 30 9.197 8.541 0.656 1
1 306 . 11 1 1 A 30 30 GLY HA2 H 30 4.486 3.991 0.495 1
1 307 . 11 1 1 A 30 30 GLY HA3 H 30 3.581 3.991 -0.410 1
1 308 . 11 1 1 A 30 30 GLY C C 30 174.347 175.054 -0.707 1
1 309 . 11 1 1 A 30 30 GLY CA C 30 44.320 44.966 -0.646 1
1 310 . 11 1 1 A 30 30 GLY N N 30 116.042 115.195 0.847 1
1 311 . 11 1 1 A 31 31 THR H H 31 7.838 7.268 0.570 1
1 312 . 11 1 1 A 31 31 THR HA H 31 3.959 4.250 -0.291 1
1 317 . 11 1 1 A 31 31 THR C C 31 174.274 174.477 -0.203 1
1 318 . 11 1 1 A 31 31 THR CA C 31 65.160 62.648 2.512 1
1 319 . 11 1 1 A 31 31 THR CB C 31 69.972 69.599 0.373 1
1 321 . 11 1 1 A 31 31 THR N N 31 117.679 117.460 0.219 1
1 322 . 11 1 1 A 32 32 SER H H 32 9.022 8.657 0.365 1
1 323 . 11 1 1 A 32 32 SER HA H 32 4.273 5.033 -0.760 1
1 326 . 11 1 1 A 32 32 SER C C 32 172.692 174.279 -1.587 1
1 327 . 11 1 1 A 32 32 SER CA C 32 59.642 56.565 3.077 1
1 328 . 11 1 1 A 32 32 SER CB C 32 63.102 64.293 -1.191 1
1 329 . 11 1 1 A 32 32 SER N N 32 123.045 118.309 4.736 1
1 330 . 11 1 1 A 33 33 VAL H H 33 9.202 8.725 0.477 1
1 331 . 11 1 1 A 33 33 VAL HA H 33 3.844 4.034 -0.190 1
1 339 . 11 1 1 A 33 33 VAL C C 33 174.782 175.755 -0.973 1
1 340 . 11 1 1 A 33 33 VAL CA C 33 64.242 63.935 0.307 1
1 341 . 11 1 1 A 33 33 VAL CB C 33 32.893 32.171 0.722 1
1 344 . 11 1 1 A 33 33 VAL N N 33 126.861 124.700 2.161 1
1 345 . 11 1 1 A 34 34 ILE H H 34 7.074 7.495 -0.421 1
1 346 . 11 1 1 A 34 34 ILE HA H 34 4.295 4.707 -0.412 1
1 356 . 11 1 1 A 34 34 ILE C C 34 170.577 172.934 -2.357 1
1 357 . 11 1 1 A 34 34 ILE CA C 34 59.500 59.240 0.260 1
1 358 . 11 1 1 A 34 34 ILE CB C 34 39.251 42.099 -2.848 1
1 362 . 11 1 1 A 34 34 ILE N N 34 111.445 119.208 -7.763 1
1 363 . 11 1 1 A 35 35 GLN H H 35 8.450 8.902 -0.452 1
1 364 . 11 1 1 A 35 35 GLN HA H 35 4.633 4.832 -0.199 1
1 371 . 11 1 1 A 35 35 GLN C C 35 174.354 174.073 0.281 1
1 372 . 11 1 1 A 35 35 GLN CA C 35 54.176 54.660 -0.484 1
1 373 . 11 1 1 A 35 35 GLN CB C 35 29.456 30.110 -0.654 1
1 375 . 11 1 1 A 35 35 GLN N N 35 127.342 129.196 -1.854 1
1 377 . 11 1 1 A 36 36 LEU H H 36 7.761 8.222 -0.461 1
1 378 . 11 1 1 A 36 36 LEU HA H 36 4.492 4.888 -0.396 1
1 388 . 11 1 1 A 36 36 LEU C C 36 175.543 175.777 -0.234 1
1 389 . 11 1 1 A 36 36 LEU CA C 36 53.982 54.085 -0.103 1
1 390 . 11 1 1 A 36 36 LEU CB C 36 42.776 43.206 -0.430 1
1 394 . 11 1 1 A 36 36 LEU N N 36 128.895 127.688 1.207 1
1 395 . 11 1 1 A 37 37 HIS H H 37 8.529 9.064 -0.535 1
1 396 . 11 1 1 A 37 37 HIS HA H 37 4.851 5.438 -0.587 1
1 400 . 11 1 1 A 37 37 HIS C C 37 172.985 173.134 -0.149 1
1 401 . 11 1 1 A 37 37 HIS CA C 37 55.833 54.349 1.484 1
1 402 . 11 1 1 A 37 37 HIS CB C 37 32.204 33.273 -1.069 1
1 404 . 11 1 1 A 37 37 HIS N N 37 115.903 124.501 -8.598 1
1 405 . 11 1 1 A 38 38 ALA H H 38 8.474 8.782 -0.308 1
1 406 . 11 1 1 A 38 38 ALA HA H 38 4.691 5.177 -0.486 1
1 410 . 11 1 1 A 38 38 ALA C C 38 175.548 176.118 -0.570 1
1 411 . 11 1 1 A 38 38 ALA CA C 38 50.491 50.584 -0.093 1
1 412 . 11 1 1 A 38 38 ALA CB C 38 19.842 22.259 -2.417 1
1 413 . 11 1 1 A 38 38 ALA N N 38 128.891 130.315 -1.424 1
1 414 . 11 1 1 A 39 39 THR H H 39 8.095 8.791 -0.696 1
1 415 . 11 1 1 A 39 39 THR HA H 39 4.336 5.094 -0.758 1
1 420 . 11 1 1 A 39 39 THR C C 39 173.553 172.561 0.992 1
1 421 . 11 1 1 A 39 39 THR CA C 39 60.417 60.156 0.261 1
1 422 . 11 1 1 A 39 39 THR CB C 39 70.912 72.130 -1.218 1
1 424 . 11 1 1 A 39 39 THR N N 39 110.982 111.521 -0.539 1
1 425 . 11 1 1 A 40 40 ASP H H 40 8.417 8.741 -0.324 1
1 426 . 11 1 1 A 40 40 ASP HA H 40 4.553 5.038 -0.485 1
1 429 . 11 1 1 A 40 40 ASP C C 40 176.462 174.232 2.230 1
1 430 . 11 1 1 A 40 40 ASP CA C 40 54.158 53.304 0.854 1
1 431 . 11 1 1 A 40 40 ASP CB C 40 41.517 44.893 -3.376 1
1 432 . 11 1 1 A 40 40 ASP N N 40 121.450 121.074 0.376 1
1 433 . 11 1 1 A 41 41 ALA H H 41 8.435 8.544 -0.109 1
1 434 . 11 1 1 A 41 41 ALA HA H 41 4.129 4.274 -0.145 1
1 438 . 11 1 1 A 41 41 ALA C C 41 177.718 175.907 1.811 1
1 439 . 11 1 1 A 41 41 ALA CA C 41 53.436 51.964 1.472 1
1 440 . 11 1 1 A 41 41 ALA CB C 41 19.183 17.507 1.676 1
1 441 . 11 1 1 A 41 41 ALA N N 41 124.607 124.967 -0.360 1
1 442 . 11 1 1 A 42 42 ASP H H 42 8.310 8.888 -0.578 1
1 443 . 11 1 1 A 42 42 ASP HA H 42 4.588 4.980 -0.392 1
1 446 . 11 1 1 A 42 42 ASP C C 42 176.546 174.529 2.017 1
1 447 . 11 1 1 A 42 42 ASP CA C 42 54.599 53.080 1.519 1
1 448 . 11 1 1 A 42 42 ASP CB C 42 41.146 40.678 0.468 1
1 449 . 11 1 1 A 42 42 ASP N N 42 118.030 121.926 -3.896 1
1 450 . 11 1 1 A 43 43 ILE H H 43 8.000 8.501 -0.501 1
1 451 . 11 1 1 A 43 43 ILE HA H 43 4.130 4.621 -0.491 1
1 461 . 11 1 1 A 43 43 ILE C C 43 176.901 176.052 0.849 1
1 462 . 11 1 1 A 43 43 ILE CA C 43 61.740 60.261 1.479 1
1 463 . 11 1 1 A 43 43 ILE CB C 43 38.491 38.637 -0.146 1
1 467 . 11 1 1 A 43 43 ILE N N 43 119.301 120.283 -0.982 1
1 468 . 11 1 1 A 44 44 GLY H H 44 8.448 8.399 0.049 1
1 469 . 11 1 1 A 44 44 GLY HA2 H 44 3.939 4.003 -0.064 1
1 470 . 11 1 1 A 44 44 GLY HA3 H 44 3.939 4.004 -0.065 1
1 471 . 11 1 1 A 44 44 GLY C C 44 174.393 174.041 0.352 1
1 472 . 11 1 1 A 44 44 GLY CA C 44 45.501 45.419 0.082 1
1 473 . 11 1 1 A 44 44 GLY N N 44 111.333 115.801 -4.468 1
1 474 . 11 1 1 A 45 45 SER H H 45 8.061 7.950 0.111 1
1 475 . 11 1 1 A 45 45 SER HA H 45 4.416 4.823 -0.407 1
1 478 . 11 1 1 A 45 45 SER C C 45 174.480 173.572 0.908 1
1 479 . 11 1 1 A 45 45 SER CA C 45 58.478 57.749 0.729 1
1 480 . 11 1 1 A 45 45 SER CB C 45 63.943 65.410 -1.467 1
1 481 . 11 1 1 A 45 45 SER N N 45 115.551 116.203 -0.652 1
1 482 . 11 1 1 A 46 46 ASN H H 46 8.547 8.844 -0.297 1
1 483 . 11 1 1 A 46 46 ASN HA H 46 4.725 4.745 -0.020 1
1 488 . 11 1 1 A 46 46 ASN C C 46 175.031 175.029 0.002 1
1 489 . 11 1 1 A 46 46 ASN CA C 46 53.277 53.768 -0.491 1
1 490 . 11 1 1 A 46 46 ASN CB C 46 38.798 38.509 0.289 1
1 491 . 11 1 1 A 46 46 ASN N N 46 120.698 124.872 -4.174 1
1 493 . 11 1 1 A 47 47 ALA H H 47 8.239 8.565 -0.326 1
1 494 . 11 1 1 A 47 47 ALA HA H 47 4.283 4.673 -0.390 1
1 498 . 11 1 1 A 47 47 ALA C C 47 177.240 176.691 0.549 1
1 499 . 11 1 1 A 47 47 ALA CA C 47 52.731 50.810 1.921 1
1 500 . 11 1 1 A 47 47 ALA CB C 47 19.594 19.328 0.266 1
1 501 . 11 1 1 A 47 47 ALA N N 47 124.093 125.766 -1.673 1
1 502 . 11 1 1 A 48 48 GLU H H 48 8.376 8.729 -0.353 1
1 503 . 11 1 1 A 48 48 GLU HA H 48 4.264 4.315 -0.051 1
1 508 . 11 1 1 A 48 48 GLU C C 48 175.702 175.348 0.354 1
1 509 . 11 1 1 A 48 48 GLU CA C 48 55.992 56.103 -0.111 1
1 510 . 11 1 1 A 48 48 GLU CB C 48 30.210 29.247 0.963 1
1 512 . 11 1 1 A 48 48 GLU N N 48 119.750 125.318 -5.568 1
1 513 . 11 1 1 A 49 49 ILE H H 49 7.806 8.051 -0.245 1
1 514 . 11 1 1 A 49 49 ILE HA H 49 3.919 3.941 -0.022 1
1 524 . 11 1 1 A 49 49 ILE C C 49 175.894 175.262 0.632 1
1 525 . 11 1 1 A 49 49 ILE CA C 49 60.559 61.706 -1.147 1
1 526 . 11 1 1 A 49 49 ILE CB C 49 37.860 37.224 0.636 1
1 530 . 11 1 1 A 49 49 ILE N N 49 122.772 127.226 -4.454 1
1 531 . 11 1 1 A 50 50 ARG H H 50 8.247 8.033 0.214 1
1 532 . 11 1 1 A 50 50 ARG HA H 50 4.999 4.603 0.396 1
1 539 . 11 1 1 A 50 50 ARG C C 50 174.603 174.674 -0.071 1
1 540 . 11 1 1 A 50 50 ARG CA C 50 53.189 55.078 -1.889 1
1 541 . 11 1 1 A 50 50 ARG CB C 50 33.152 32.567 0.585 1
1 544 . 11 1 1 A 50 50 ARG N N 50 126.912 127.236 -0.324 1
1 545 . 11 1 1 A 51 51 TYR H H 51 9.041 9.094 -0.053 1
1 546 . 11 1 1 A 51 51 TYR HA H 51 5.395 5.514 -0.119 1
1 553 . 11 1 1 A 51 51 TYR C C 51 175.555 175.711 -0.156 1
1 554 . 11 1 1 A 51 51 TYR CA C 51 56.909 57.010 -0.101 1
1 555 . 11 1 1 A 51 51 TYR CB C 51 40.116 40.151 -0.035 1
1 560 . 11 1 1 A 51 51 TYR N N 51 121.627 121.382 0.245 1
1 561 . 11 1 1 A 52 52 ILE H H 52 8.850 8.417 0.433 1
1 562 . 11 1 1 A 52 52 ILE HA H 52 4.576 4.902 -0.326 1
1 572 . 11 1 1 A 52 52 ILE C C 52 175.371 175.282 0.089 1
1 573 . 11 1 1 A 52 52 ILE CA C 52 59.624 59.471 0.153 1
1 574 . 11 1 1 A 52 52 ILE CB C 52 42.895 41.515 1.380 1
1 578 . 11 1 1 A 52 52 ILE N N 52 117.697 119.018 -1.321 1
1 579 . 11 1 1 A 53 53 PHE H H 53 8.748 8.790 -0.042 1
1 580 . 11 1 1 A 53 53 PHE HA H 53 5.132 4.525 0.607 1
1 588 . 11 1 1 A 53 53 PHE C C 53 178.146 176.339 1.807 1
1 589 . 11 1 1 A 53 53 PHE CA C 53 57.667 58.859 -1.192 1
1 590 . 11 1 1 A 53 53 PHE CB C 53 39.614 39.490 0.124 1
1 596 . 11 1 1 A 53 53 PHE N N 53 121.433 123.262 -1.829 1
1 597 . 11 1 1 A 54 54 GLY H H 54 8.538 8.532 0.006 1
1 598 . 11 1 1 A 54 54 GLY HA2 H 54 4.074 4.098 -0.024 1
1 599 . 11 1 1 A 54 54 GLY HA3 H 54 3.840 4.100 -0.260 1
1 600 . 11 1 1 A 54 54 GLY C C 54 174.530 172.900 1.630 1
1 601 . 11 1 1 A 54 54 GLY CA C 54 44.884 44.562 0.322 1
1 602 . 11 1 1 A 54 54 GLY N N 54 106.444 111.121 -4.677 1
1 603 . 11 1 1 A 55 55 ALA H H 55 8.594 8.410 0.184 1
1 604 . 11 1 1 A 55 55 ALA HA H 55 4.172 4.663 -0.491 1
1 608 . 11 1 1 A 55 55 ALA C C 55 178.718 177.378 1.340 1
1 609 . 11 1 1 A 55 55 ALA CA C 55 54.423 51.012 3.411 1
1 610 . 11 1 1 A 55 55 ALA CB C 55 19.059 20.810 -1.751 1
1 611 . 11 1 1 A 55 55 ALA N N 55 123.470 122.061 1.409 1
1 612 . 11 1 1 A 56 56 GLN H H 56 8.727 8.764 -0.037 1
1 613 . 11 1 1 A 56 56 GLN HA H 56 4.367 3.787 0.580 1
1 620 . 11 1 1 A 56 56 GLN C C 56 176.134 174.497 1.637 1
1 621 . 11 1 1 A 56 56 GLN CA C 56 55.660 56.722 -1.062 1
1 622 . 11 1 1 A 56 56 GLN CB C 56 28.152 26.880 1.272 1
1 624 . 11 1 1 A 56 56 GLN N N 56 114.221 115.531 -1.310 1
1 626 . 11 1 1 A 57 57 VAL H H 57 7.204 7.681 -0.477 1
1 627 . 11 1 1 A 57 57 VAL HA H 57 3.889 4.206 -0.317 1
1 635 . 11 1 1 A 57 57 VAL C C 57 175.371 175.527 -0.156 1
1 636 . 11 1 1 A 57 57 VAL CA C 57 63.908 61.329 2.579 1
1 637 . 11 1 1 A 57 57 VAL CB C 57 31.557 32.623 -1.066 1
1 640 . 11 1 1 A 57 57 VAL N N 57 121.341 119.576 1.765 1
1 641 . 11 1 1 A 58 58 ALA H H 58 8.920 8.485 0.435 1
1 642 . 11 1 1 A 58 58 ALA HA H 58 4.547 4.320 0.227 1
1 646 . 11 1 1 A 58 58 ALA C C 58 177.064 177.756 -0.692 1
1 647 . 11 1 1 A 58 58 ALA CA C 58 51.173 50.814 0.359 1
1 648 . 11 1 1 A 58 58 ALA CB C 58 17.842 17.986 -0.144 1
1 649 . 11 1 1 A 58 58 ALA N N 58 132.726 130.662 2.064 1
1 650 . 11 1 1 A 59 59 PRO HA H 59 4.101 4.288 -0.187 1
1 657 . 11 1 1 A 59 59 PRO C C 59 179.482 178.522 0.960 1
1 658 . 11 1 1 A 59 59 PRO CA C 59 66.060 65.088 0.972 1
1 659 . 11 1 1 A 59 59 PRO CB C 59 31.951 31.993 -0.042 1
1 662 . 11 1 1 A 60 60 ALA H H 60 8.706 8.154 0.552 1
1 663 . 11 1 1 A 60 60 ALA HA H 60 4.057 4.037 0.020 1
1 667 . 11 1 1 A 60 60 ALA C C 60 179.627 180.019 -0.392 1
1 668 . 11 1 1 A 60 60 ALA CA C 60 55.305 55.324 -0.019 1
1 669 . 11 1 1 A 60 60 ALA CB C 60 18.737 18.422 0.315 1
1 670 . 11 1 1 A 60 60 ALA N N 60 117.882 119.066 -1.184 1
1 671 . 11 1 1 A 61 61 THR H H 61 7.312 8.169 -0.857 1
1 672 . 11 1 1 A 61 61 THR HA H 61 4.153 4.047 0.106 1
1 677 . 11 1 1 A 61 61 THR C C 61 175.824 176.616 -0.792 1
1 678 . 11 1 1 A 61 61 THR CA C 61 66.412 67.069 -0.657 1
1 679 . 11 1 1 A 61 61 THR CB C 61 68.787 68.785 0.002 1
1 681 . 11 1 1 A 61 61 THR N N 61 114.483 115.094 -0.611 1
1 682 . 11 1 1 A 62 62 LYS H H 62 7.556 7.408 0.148 1
1 683 . 11 1 1 A 62 62 LYS HA H 62 3.943 3.701 0.242 1
1 692 . 11 1 1 A 62 62 LYS C C 62 176.884 179.302 -2.418 1
1 693 . 11 1 1 A 62 62 LYS CA C 62 59.095 59.004 0.091 1
1 694 . 11 1 1 A 62 62 LYS CB C 62 32.204 31.537 0.667 1
1 698 . 11 1 1 A 62 62 LYS N N 62 118.994 119.404 -0.410 1
1 699 . 11 1 1 A 63 63 ARG H H 63 7.474 7.710 -0.236 1
1 700 . 11 1 1 A 63 63 ARG HA H 63 4.034 4.038 -0.004 1
1 707 . 11 1 1 A 63 63 ARG C C 63 177.574 178.659 -1.085 1
1 708 . 11 1 1 A 63 63 ARG CA C 63 58.143 59.070 -0.927 1
1 709 . 11 1 1 A 63 63 ARG CB C 63 30.755 30.405 0.350 1
1 712 . 11 1 1 A 63 63 ARG N N 63 114.251 120.279 -6.028 1
1 713 . 11 1 1 A 64 64 LEU H H 64 6.991 7.789 -0.798 1
1 714 . 11 1 1 A 64 64 LEU HA H 64 3.904 3.869 0.035 1
1 724 . 11 1 1 A 64 64 LEU C C 64 176.632 176.429 0.203 1
1 725 . 11 1 1 A 64 64 LEU CA C 64 56.503 57.822 -1.319 1
1 726 . 11 1 1 A 64 64 LEU CB C 64 42.929 41.669 1.260 1
1 730 . 11 1 1 A 64 64 LEU N N 64 116.109 119.474 -3.365 1
1 731 . 11 1 1 A 65 65 PHE H H 65 7.673 8.105 -0.432 1
1 732 . 11 1 1 A 65 65 PHE HA H 65 5.386 5.173 0.213 1
1 740 . 11 1 1 A 65 65 PHE C C 65 173.067 175.045 -1.978 1
1 741 . 11 1 1 A 65 65 PHE CA C 65 56.521 56.853 -0.332 1
1 742 . 11 1 1 A 65 65 PHE CB C 65 41.270 41.371 -0.101 1
1 748 . 11 1 1 A 65 65 PHE N N 65 116.182 115.334 0.848 1
1 749 . 11 1 1 A 66 66 ALA H H 66 8.914 8.941 -0.027 1
1 750 . 11 1 1 A 66 66 ALA HA H 66 4.748 5.470 -0.722 1
1 754 . 11 1 1 A 66 66 ALA C C 66 175.223 175.691 -0.468 1
1 755 . 11 1 1 A 66 66 ALA CA C 66 50.050 50.235 -0.185 1
1 756 . 11 1 1 A 66 66 ALA CB C 66 21.161 20.859 0.302 1
1 757 . 11 1 1 A 66 66 ALA N N 66 122.870 125.801 -2.931 1
1 758 . 11 1 1 A 67 67 LEU H H 67 8.498 9.150 -0.652 1
1 759 . 11 1 1 A 67 67 LEU HA H 67 4.713 4.761 -0.048 1
1 769 . 11 1 1 A 67 67 LEU C C 67 175.146 174.986 0.160 1
1 770 . 11 1 1 A 67 67 LEU CA C 67 52.518 53.803 -1.285 1
1 771 . 11 1 1 A 67 67 LEU CB C 67 45.308 43.083 2.225 1
1 775 . 11 1 1 A 67 67 LEU N N 67 122.208 124.774 -2.566 1
1 776 . 11 1 1 A 68 68 ASN H H 68 8.357 8.926 -0.569 1
1 777 . 11 1 1 A 68 68 ASN HA H 68 4.679 4.898 -0.219 1
1 782 . 11 1 1 A 68 68 ASN C C 68 176.228 175.490 0.738 1
1 783 . 11 1 1 A 68 68 ASN CA C 68 53.524 53.429 0.095 1
1 784 . 11 1 1 A 68 68 ASN CB C 68 39.580 38.905 0.675 1
1 785 . 11 1 1 A 68 68 ASN N N 68 126.940 125.093 1.847 1
1 787 . 11 1 1 A 69 69 ASN H H 69 8.861 8.887 -0.026 1
1 788 . 11 1 1 A 69 69 ASN HA H 69 5.137 4.977 0.160 1
1 793 . 11 1 1 A 69 69 ASN C C 69 175.631 176.342 -0.711 1
1 794 . 11 1 1 A 69 69 ASN CA C 69 56.009 53.718 2.291 1
1 795 . 11 1 1 A 69 69 ASN CB C 69 40.314 38.521 1.793 1
1 796 . 11 1 1 A 69 69 ASN N N 69 124.980 124.543 0.437 1
1 798 . 11 1 1 A 70 70 THR H H 70 8.635 7.919 0.716 1
1 799 . 11 1 1 A 70 70 THR HA H 70 4.815 4.622 0.193 1
1 804 . 11 1 1 A 70 70 THR C C 70 176.223 175.558 0.665 1
1 805 . 11 1 1 A 70 70 THR CA C 70 63.944 62.551 1.393 1
1 806 . 11 1 1 A 70 70 THR CB C 70 69.727 70.140 -0.413 1
1 808 . 11 1 1 A 70 70 THR N N 70 110.394 110.594 -0.200 1
1 809 . 11 1 1 A 71 71 THR H H 71 8.069 7.919 0.150 1
1 810 . 11 1 1 A 71 71 THR HA H 71 4.566 4.573 -0.007 1
1 815 . 11 1 1 A 71 71 THR C C 71 176.213 175.716 0.497 1
1 816 . 11 1 1 A 71 71 THR CA C 71 61.683 61.985 -0.302 1
1 817 . 11 1 1 A 71 71 THR CB C 71 70.832 71.307 -0.475 1
1 819 . 11 1 1 A 71 71 THR N N 71 110.507 110.582 -0.075 1
1 820 . 11 1 1 A 72 72 GLY H H 72 7.990 8.333 -0.343 1
1 821 . 11 1 1 A 72 72 GLY HA2 H 72 3.186 2.499 0.687 1
1 822 . 11 1 1 A 72 72 GLY HA3 H 72 2.516 3.395 -0.879 1
1 823 . 11 1 1 A 72 72 GLY C C 72 172.988 173.790 -0.802 1
1 824 . 11 1 1 A 72 72 GLY CA C 72 45.149 45.291 -0.142 1
1 825 . 11 1 1 A 72 72 GLY N N 72 110.788 111.967 -1.179 1
1 826 . 11 1 1 A 73 73 LEU H H 73 7.138 7.153 -0.015 1
1 827 . 11 1 1 A 73 73 LEU HA H 73 4.414 4.620 -0.206 1
1 837 . 11 1 1 A 73 73 LEU C C 73 176.836 174.570 2.266 1
1 838 . 11 1 1 A 73 73 LEU CA C 73 55.252 53.410 1.842 1
1 839 . 11 1 1 A 73 73 LEU CB C 73 43.574 45.242 -1.668 1
1 843 . 11 1 1 A 73 73 LEU N N 73 119.222 121.796 -2.574 1
1 844 . 11 1 1 A 74 74 ILE H H 74 8.925 8.690 0.235 1
1 845 . 11 1 1 A 74 74 ILE HA H 74 5.555 5.141 0.414 1
1 855 . 11 1 1 A 74 74 ILE C C 74 175.978 175.559 0.419 1
1 856 . 11 1 1 A 74 74 ILE CA C 74 60.100 59.892 0.208 1
1 857 . 11 1 1 A 74 74 ILE CB C 74 38.550 39.371 -0.821 1
1 861 . 11 1 1 A 74 74 ILE N N 74 129.871 125.779 4.092 1
1 862 . 11 1 1 A 75 75 THR H H 75 9.161 8.795 0.366 1
1 863 . 11 1 1 A 75 75 THR HA H 75 5.375 5.296 0.079 1
1 868 . 11 1 1 A 75 75 THR C C 75 174.798 173.831 0.967 1
1 869 . 11 1 1 A 75 75 THR CA C 75 58.796 59.760 -0.964 1
1 870 . 11 1 1 A 75 75 THR CB C 75 72.978 71.499 1.479 1
1 872 . 11 1 1 A 75 75 THR N N 75 117.522 117.953 -0.431 1
1 873 . 11 1 1 A 76 76 VAL H H 76 8.327 8.627 -0.300 1
1 874 . 11 1 1 A 76 76 VAL HA H 76 3.973 3.821 0.152 1
1 882 . 11 1 1 A 76 76 VAL C C 76 176.495 176.038 0.457 1
1 883 . 11 1 1 A 76 76 VAL CA C 76 64.085 63.351 0.734 1
1 884 . 11 1 1 A 76 76 VAL CB C 76 32.863 31.156 1.707 1
1 887 . 11 1 1 A 76 76 VAL N N 76 120.876 121.875 -0.999 1
1 888 . 11 1 1 A 77 77 GLN H H 77 9.525 9.274 0.251 1
1 889 . 11 1 1 A 77 77 GLN HA H 77 4.702 4.219 0.483 1
1 896 . 11 1 1 A 77 77 GLN C C 77 173.838 175.416 -1.578 1
1 897 . 11 1 1 A 77 77 GLN CA C 77 55.728 57.332 -1.604 1
1 898 . 11 1 1 A 77 77 GLN CB C 77 30.762 29.905 0.857 1
1 900 . 11 1 1 A 77 77 GLN N N 77 129.825 129.101 0.724 1
1 902 . 11 1 1 A 78 78 ARG H H 78 7.621 7.132 0.489 1
1 903 . 11 1 1 A 78 78 ARG HA H 78 4.347 4.788 -0.441 1
1 910 . 11 1 1 A 78 78 ARG C C 78 172.304 174.926 -2.622 1
1 911 . 11 1 1 A 78 78 ARG CA C 78 54.634 54.141 0.493 1
1 912 . 11 1 1 A 78 78 ARG CB C 78 34.685 34.993 -0.308 1
1 915 . 11 1 1 A 78 78 ARG N N 78 120.595 116.985 3.610 1
1 916 . 11 1 1 A 79 79 SER H H 79 7.958 8.569 -0.611 1
1 917 . 11 1 1 A 79 79 SER HA H 79 4.030 4.369 -0.339 1
1 920 . 11 1 1 A 79 79 SER C C 79 174.311 174.698 -0.387 1
1 921 . 11 1 1 A 79 79 SER CA C 79 59.889 58.930 0.959 1
1 922 . 11 1 1 A 79 79 SER CB C 79 63.548 63.460 0.088 1
1 923 . 11 1 1 A 79 79 SER N N 79 112.565 117.371 -4.806 1
1 924 . 11 1 1 A 80 80 LEU H H 80 8.715 8.464 0.251 1
1 925 . 11 1 1 A 80 80 LEU HA H 80 4.114 4.739 -0.625 1
1 935 . 11 1 1 A 80 80 LEU C C 80 176.057 175.827 0.230 1
1 936 . 11 1 1 A 80 80 LEU CA C 80 55.091 53.903 1.188 1
1 937 . 11 1 1 A 80 80 LEU CB C 80 42.341 43.132 -0.791 1
1 941 . 11 1 1 A 80 80 LEU N N 80 123.070 126.186 -3.116 1
1 942 . 11 1 1 A 81 81 ASP H H 81 7.298 8.688 -1.390 1
1 943 . 11 1 1 A 81 81 ASP HA H 81 4.725 5.289 -0.564 1
1 946 . 11 1 1 A 81 81 ASP C C 81 175.939 176.234 -0.295 1
1 947 . 11 1 1 A 81 81 ASP CA C 81 53.664 52.877 0.787 1
1 948 . 11 1 1 A 81 81 ASP CB C 81 42.947 42.875 0.072 1
1 949 . 11 1 1 A 81 81 ASP N N 81 115.229 121.581 -6.352 1
1 950 . 11 1 1 A 82 82 ARG H H 82 9.289 8.764 0.525 1
1 951 . 11 1 1 A 82 82 ARG HA H 82 4.416 4.042 0.374 1
1 959 . 11 1 1 A 82 82 ARG C C 82 176.406 177.828 -1.422 1
1 960 . 11 1 1 A 82 82 ARG CA C 82 56.397 59.660 -3.263 1
1 961 . 11 1 1 A 82 82 ARG CB C 82 30.638 30.063 0.575 1
1 964 . 11 1 1 A 82 82 ARG N N 82 123.174 126.434 -3.260 1
1 966 . 11 1 1 A 83 83 GLU H H 83 8.468 8.353 0.115 1
1 967 . 11 1 1 A 83 83 GLU HA H 83 3.982 4.107 -0.125 1
1 972 . 11 1 1 A 83 83 GLU C C 83 177.740 178.708 -0.968 1
1 973 . 11 1 1 A 83 83 GLU CA C 83 58.425 59.292 -0.867 1
1 974 . 11 1 1 A 83 83 GLU CB C 83 29.701 29.155 0.546 1
1 976 . 11 1 1 A 83 83 GLU N N 83 119.549 117.419 2.130 1
1 977 . 11 1 1 A 84 84 GLU H H 84 8.033 7.772 0.261 1
1 978 . 11 1 1 A 84 84 GLU HA H 84 4.206 4.346 -0.140 1
1 983 . 11 1 1 A 84 84 GLU C C 84 176.837 176.175 0.662 1
1 984 . 11 1 1 A 84 84 GLU CA C 84 58.056 58.205 -0.149 1
1 985 . 11 1 1 A 84 84 GLU CB C 84 30.432 30.485 -0.053 1
1 987 . 11 1 1 A 84 84 GLU N N 84 118.333 117.552 0.781 1
1 988 . 11 1 1 A 85 85 THR H H 85 7.651 7.594 0.057 1
1 989 . 11 1 1 A 85 85 THR HA H 85 4.307 4.624 -0.317 1
1 994 . 11 1 1 A 85 85 THR C C 85 171.568 173.511 -1.943 1
1 995 . 11 1 1 A 85 85 THR CA C 85 61.387 59.549 1.838 1
1 996 . 11 1 1 A 85 85 THR CB C 85 69.963 70.790 -0.827 1
1 998 . 11 1 1 A 85 85 THR N N 85 112.444 111.665 0.779 1
1 999 . 11 1 1 A 86 86 ALA H H 86 8.639 8.466 0.173 1
1 1000 . 11 1 1 A 86 86 ALA HA H 86 4.603 4.471 0.132 1
1 1004 . 11 1 1 A 86 86 ALA C C 86 175.560 177.143 -1.583 1
1 1005 . 11 1 1 A 86 86 ALA CA C 86 52.156 53.239 -1.083 1
1 1006 . 11 1 1 A 86 86 ALA CB C 86 20.378 20.335 0.043 1
1 1007 . 11 1 1 A 86 86 ALA N N 86 127.705 127.084 0.621 1
1 1008 . 11 1 1 A 87 87 ILE H H 87 7.663 7.628 0.035 1
1 1009 . 11 1 1 A 87 87 ILE HA H 87 4.828 4.686 0.142 1
1 1019 . 11 1 1 A 87 87 ILE C C 87 174.537 174.248 0.289 1
1 1020 . 11 1 1 A 87 87 ILE CA C 87 60.329 59.930 0.399 1
1 1021 . 11 1 1 A 87 87 ILE CB C 87 41.090 41.181 -0.091 1
1 1025 . 11 1 1 A 87 87 ILE N N 87 118.712 117.235 1.477 1
1 1026 . 11 1 1 A 88 88 HIS H H 88 9.098 8.839 0.259 1
1 1027 . 11 1 1 A 88 88 HIS HA H 88 4.576 5.396 -0.820 1
1 1032 . 11 1 1 A 88 88 HIS C C 88 174.354 174.657 -0.303 1
1 1033 . 11 1 1 A 88 88 HIS CA C 88 54.740 54.488 0.252 1
1 1034 . 11 1 1 A 88 88 HIS CB C 88 33.955 32.863 1.092 1
1 1037 . 11 1 1 A 88 88 HIS N N 88 126.285 125.743 0.542 1
1 1038 . 11 1 1 A 89 89 LYS H H 89 8.957 8.865 0.092 1
1 1039 . 11 1 1 A 89 89 LYS HA H 89 4.873 4.802 0.071 1
1 1048 . 11 1 1 A 89 89 LYS C C 89 175.906 175.427 0.479 1
1 1049 . 11 1 1 A 89 89 LYS CA C 89 55.269 55.214 0.055 1
1 1050 . 11 1 1 A 89 89 LYS CB C 89 32.945 34.377 -1.432 1
1 1054 . 11 1 1 A 89 89 LYS N N 89 124.332 121.511 2.821 1
1 1055 . 11 1 1 A 90 90 VAL H H 90 9.174 9.080 0.094 1
1 1056 . 11 1 1 A 90 90 VAL HA H 90 4.227 4.972 -0.745 1
1 1064 . 11 1 1 A 90 90 VAL C C 90 174.168 174.644 -0.476 1
1 1065 . 11 1 1 A 90 90 VAL CA C 90 61.369 61.153 0.216 1
1 1066 . 11 1 1 A 90 90 VAL CB C 90 34.082 34.839 -0.757 1
1 1069 . 11 1 1 A 90 90 VAL N N 90 124.319 125.397 -1.078 1
1 1070 . 11 1 1 A 91 91 THR H H 91 6.697 9.105 -2.408 1
1 1071 . 11 1 1 A 91 91 THR HA H 91 5.163 5.195 -0.032 1
1 1076 . 11 1 1 A 91 91 THR C C 91 173.812 173.360 0.452 1
1 1077 . 11 1 1 A 91 91 THR CA C 91 61.935 61.808 0.127 1
1 1078 . 11 1 1 A 91 91 THR CB C 91 70.412 70.575 -0.163 1
1 1080 . 11 1 1 A 91 91 THR N N 91 122.637 124.225 -1.588 1
1 1081 . 11 1 1 A 92 92 VAL H H 92 9.292 8.735 0.557 1
1 1082 . 11 1 1 A 92 92 VAL HA H 92 4.736 4.629 0.107 1
1 1090 . 11 1 1 A 92 92 VAL C C 92 173.160 175.297 -2.137 1
1 1091 . 11 1 1 A 92 92 VAL CA C 92 60.982 61.422 -0.440 1
1 1092 . 11 1 1 A 92 92 VAL CB C 92 35.130 32.273 2.857 1
1 1095 . 11 1 1 A 92 92 VAL N N 92 128.265 128.055 0.210 1
1 1096 . 11 1 1 A 93 93 LEU H H 93 9.495 8.826 0.669 1
1 1097 . 11 1 1 A 93 93 LEU HA H 93 5.628 5.142 0.486 1
1 1107 . 11 1 1 A 93 93 LEU C C 93 176.274 176.586 -0.312 1
1 1108 . 11 1 1 A 93 93 LEU CA C 93 52.773 54.237 -1.464 1
1 1109 . 11 1 1 A 93 93 LEU CB C 93 43.454 42.714 0.740 1
1 1113 . 11 1 1 A 93 93 LEU N N 93 126.350 128.996 -2.646 1
1 1114 . 11 1 1 A 94 94 ALA H H 94 8.688 8.350 0.338 1
1 1115 . 11 1 1 A 94 94 ALA HA H 94 4.986 4.986 0.000 1
1 1119 . 11 1 1 A 94 94 ALA C C 94 175.787 175.875 -0.088 1
1 1120 . 11 1 1 A 94 94 ALA CA C 94 49.610 50.390 -0.780 1
1 1121 . 11 1 1 A 94 94 ALA CB C 94 21.463 20.320 1.143 1
1 1122 . 11 1 1 A 94 94 ALA N N 94 123.429 124.992 -1.563 1
1 1123 . 11 1 1 A 95 95 SER H H 95 8.401 8.207 0.194 1
1 1124 . 11 1 1 A 95 95 SER HA H 95 4.828 5.078 -0.250 1
1 1127 . 11 1 1 A 95 95 SER C C 95 174.327 172.453 1.874 1
1 1128 . 11 1 1 A 95 95 SER CA C 95 56.239 56.622 -0.383 1
1 1129 . 11 1 1 A 95 95 SER CB C 95 65.561 65.063 0.498 1
1 1130 . 11 1 1 A 95 95 SER N N 95 114.418 117.773 -3.355 1
1 1131 . 11 1 1 A 96 96 ASP H H 96 8.690 8.492 0.198 1
1 1132 . 11 1 1 A 96 96 ASP HA H 96 4.908 4.859 0.049 1
1 1135 . 11 1 1 A 96 96 ASP C C 96 177.096 175.963 1.133 1
1 1136 . 11 1 1 A 96 96 ASP CA C 96 52.818 52.834 -0.016 1
1 1137 . 11 1 1 A 96 96 ASP CB C 96 41.253 41.854 -0.601 1
1 1138 . 11 1 1 A 96 96 ASP N N 96 125.624 125.009 0.615 1
1 1139 . 11 1 1 A 97 97 GLY H H 97 8.524 8.279 0.245 1
1 1140 . 11 1 1 A 97 97 GLY HA2 H 97 4.320 4.027 0.293 1
1 1141 . 11 1 1 A 97 97 GLY HA3 H 97 3.620 4.028 -0.408 1
1 1142 . 11 1 1 A 97 97 GLY C C 97 174.620 173.635 0.985 1
1 1143 . 11 1 1 A 97 97 GLY CA C 97 45.422 45.389 0.033 1
1 1144 . 11 1 1 A 97 97 GLY N N 97 109.283 110.805 -1.522 1
1 1145 . 11 1 1 A 98 98 SER H H 98 8.575 7.711 0.864 1
1 1146 . 11 1 1 A 98 98 SER HA H 98 4.607 4.967 -0.360 1
1 1149 . 11 1 1 A 98 98 SER C C 98 174.478 172.836 1.642 1
1 1150 . 11 1 1 A 98 98 SER CA C 98 59.095 57.174 1.921 1
1 1151 . 11 1 1 A 98 98 SER CB C 98 64.800 66.995 -2.195 1
1 1152 . 11 1 1 A 98 98 SER N N 98 116.640 114.930 1.710 1
1 1153 . 11 1 1 A 99 99 SER H H 99 8.945 8.624 0.321 1
1 1154 . 11 1 1 A 99 99 SER HA H 99 4.530 4.564 -0.034 1
1 1157 . 11 1 1 A 99 99 SER C C 99 174.491 174.326 0.165 1
1 1158 . 11 1 1 A 99 99 SER CA C 99 58.460 58.443 0.017 1
1 1159 . 11 1 1 A 99 99 SER CB C 99 64.146 63.709 0.437 1
1 1160 . 11 1 1 A 99 99 SER N N 99 117.676 118.574 -0.898 1
1 1161 . 11 1 1 A 100 100 THR H H 100 8.411 8.329 0.082 1
1 1162 . 11 1 1 A 100 100 THR HA H 100 4.490 4.277 0.213 1
1 1167 . 11 1 1 A 100 100 THR C C 100 172.766 172.895 -0.129 1
1 1168 . 11 1 1 A 100 100 THR CA C 100 60.629 61.316 -0.687 1
1 1169 . 11 1 1 A 100 100 THR CB C 100 69.778 69.248 0.530 1
1 1171 . 11 1 1 A 100 100 THR N N 100 118.401 118.401 0.000 1
1 1172 . 11 1 1 A 101 101 PRO HA H 101 4.631 4.580 0.051 1
1 1179 . 11 1 1 A 101 101 PRO C C 101 177.227 176.314 0.913 1
1 1180 . 11 1 1 A 101 101 PRO CA C 101 63.097 62.343 0.754 1
1 1181 . 11 1 1 A 101 101 PRO CB C 101 32.917 32.233 0.684 1
1 1184 . 11 1 1 A 102 102 ALA H H 102 8.497 7.889 0.608 1
1 1185 . 11 1 1 A 102 102 ALA HA H 102 4.619 4.248 0.371 1
1 1189 . 11 1 1 A 102 102 ALA C C 102 176.542 177.468 -0.926 1
1 1190 . 11 1 1 A 102 102 ALA CA C 102 51.390 53.090 -1.700 1
1 1191 . 11 1 1 A 102 102 ALA CB C 102 20.815 19.288 1.527 1
1 1192 . 11 1 1 A 102 102 ALA N N 102 124.487 123.637 0.850 1
1 1193 . 11 1 1 A 103 103 ARG H H 103 8.663 8.653 0.010 1
1 1194 . 11 1 1 A 103 103 ARG HA H 103 5.515 4.963 0.552 1
1 1201 . 11 1 1 A 103 103 ARG C C 103 174.539 175.334 -0.795 1
1 1202 . 11 1 1 A 103 103 ARG CA C 103 55.164 55.446 -0.282 1
1 1203 . 11 1 1 A 103 103 ARG CB C 103 34.393 31.803 2.590 1
1 1206 . 11 1 1 A 103 103 ARG N N 103 119.596 123.474 -3.878 1
1 1207 . 11 1 1 A 104 104 ALA H H 104 9.027 8.856 0.171 1
1 1208 . 11 1 1 A 104 104 ALA HA H 104 4.782 4.972 -0.190 1
1 1212 . 11 1 1 A 104 104 ALA C C 104 176.276 175.255 1.021 1
1 1213 . 11 1 1 A 104 104 ALA CA C 104 50.297 50.791 -0.494 1
1 1214 . 11 1 1 A 104 104 ALA CB C 104 20.810 20.898 -0.088 1
1 1215 . 11 1 1 A 104 104 ALA N N 104 126.962 126.149 0.813 1
1 1216 . 11 1 1 A 105 105 THR H H 105 8.384 8.752 -0.368 1
1 1217 . 11 1 1 A 105 105 THR HA H 105 4.954 4.761 0.193 1
1 1222 . 11 1 1 A 105 105 THR C C 105 173.243 173.988 -0.745 1
1 1223 . 11 1 1 A 105 105 THR CA C 105 61.475 62.267 -0.792 1
1 1224 . 11 1 1 A 105 105 THR CB C 105 70.569 70.427 0.142 1
1 1226 . 11 1 1 A 105 105 THR N N 105 115.327 118.374 -3.047 1
1 1227 . 11 1 1 A 106 106 VAL H H 106 8.970 8.589 0.381 1
1 1228 . 11 1 1 A 106 106 VAL HA H 106 4.702 4.627 0.075 1
1 1236 . 11 1 1 A 106 106 VAL C C 106 174.743 175.251 -0.508 1
1 1237 . 11 1 1 A 106 106 VAL CA C 106 59.712 61.327 -1.615 1
1 1238 . 11 1 1 A 106 106 VAL CB C 106 34.327 33.516 0.811 1
1 1241 . 11 1 1 A 106 106 VAL N N 106 126.226 126.717 -0.491 1
1 1242 . 11 1 1 A 107 107 THR H H 107 8.833 8.601 0.232 1
1 1243 . 11 1 1 A 107 107 THR HA H 107 4.862 4.394 0.468 1
1 1248 . 11 1 1 A 107 107 THR C C 107 172.970 174.349 -1.379 1
1 1249 . 11 1 1 A 107 107 THR CA C 107 62.322 63.137 -0.815 1
1 1250 . 11 1 1 A 107 107 THR CB C 107 69.463 69.055 0.408 1
1 1252 . 11 1 1 A 107 107 THR N N 107 125.403 122.541 2.862 1
1 1253 . 11 1 1 A 108 108 ILE H H 108 9.234 8.430 0.804 1
1 1254 . 11 1 1 A 108 108 ILE HA H 108 4.178 4.584 -0.406 1
1 1264 . 11 1 1 A 108 108 ILE C C 108 174.087 174.932 -0.845 1
1 1265 . 11 1 1 A 108 108 ILE CA C 108 60.365 60.444 -0.079 1
1 1266 . 11 1 1 A 108 108 ILE CB C 108 39.745 39.264 0.481 1
1 1270 . 11 1 1 A 108 108 ILE N N 108 127.152 128.487 -1.335 1
1 1271 . 11 1 1 A 109 109 ASN H H 109 8.723 8.606 0.117 1
1 1272 . 11 1 1 A 109 109 ASN HA H 109 5.147 5.208 -0.061 1
1 1277 . 11 1 1 A 109 109 ASN C C 109 173.592 174.974 -1.382 1
1 1278 . 11 1 1 A 109 109 ASN CA C 109 52.501 53.169 -0.668 1
1 1279 . 11 1 1 A 109 109 ASN CB C 109 40.791 39.511 1.280 1
1 1280 . 11 1 1 A 109 109 ASN N N 109 126.866 126.049 0.817 1
1 1282 . 11 1 1 A 110 110 VAL H H 110 9.046 8.909 0.137 1
1 1283 . 11 1 1 A 110 110 VAL HA H 110 5.081 4.797 0.284 1
1 1291 . 11 1 1 A 110 110 VAL C C 110 176.921 176.209 0.712 1
1 1292 . 11 1 1 A 110 110 VAL CA C 110 61.634 62.020 -0.386 1
1 1293 . 11 1 1 A 110 110 VAL CB C 110 31.809 32.018 -0.209 1
1 1296 . 11 1 1 A 110 110 VAL N N 110 126.070 124.434 1.636 1
1 1297 . 11 1 1 A 111 111 THR H H 111 9.197 8.810 0.387 1
1 1298 . 11 1 1 A 111 111 THR HA H 111 4.566 5.055 -0.489 1
1 1303 . 11 1 1 A 111 111 THR C C 111 174.087 174.218 -0.131 1
1 1304 . 11 1 1 A 111 111 THR CA C 111 61.145 59.563 1.582 1
1 1305 . 11 1 1 A 111 111 THR CB C 111 70.706 70.951 -0.245 1
1 1307 . 11 1 1 A 111 111 THR N N 111 121.425 118.964 2.461 1
1 1308 . 11 1 1 A 112 112 ASP H H 112 8.435 8.663 -0.228 1
1 1309 . 11 1 1 A 112 112 ASP HA H 112 4.656 4.622 0.034 1
1 1312 . 11 1 1 A 112 112 ASP C C 112 176.745 176.956 -0.211 1
1 1313 . 11 1 1 A 112 112 ASP CA C 112 54.158 54.986 -0.828 1
1 1314 . 11 1 1 A 112 112 ASP CB C 112 41.575 41.741 -0.166 1
1 1315 . 11 1 1 A 112 112 ASP N N 112 119.566 122.873 -3.307 1
1 1316 . 11 1 1 A 113 113 VAL H H 113 8.629 8.808 -0.179 1
1 1317 . 11 1 1 A 113 113 VAL HA H 113 4.078 4.423 -0.345 1
1 1325 . 11 1 1 A 113 113 VAL C C 113 175.247 175.141 0.106 1
1 1326 . 11 1 1 A 113 113 VAL CA C 113 62.533 61.834 0.699 1
1 1327 . 11 1 1 A 113 113 VAL CB C 113 32.534 33.494 -0.960 1
1 1330 . 11 1 1 A 113 113 VAL N N 113 119.356 117.290 2.066 1
1 4 . 12 1 1 A 2 2 SER H H 2 8.289 8.404 -0.115 1
1 5 . 12 1 1 A 2 2 SER HA H 2 4.530 4.860 -0.330 1
1 7 . 12 1 1 A 2 2 SER C C 2 174.868 174.236 0.632 1
1 8 . 12 1 1 A 2 2 SER CA C 2 58.284 58.095 0.189 1
1 9 . 12 1 1 A 2 2 SER CB C 2 63.769 64.392 -0.623 1
1 10 . 12 1 1 A 2 2 SER N N 2 115.842 119.245 -3.403 1
1 11 . 12 1 1 A 3 3 SER H H 3 8.490 8.725 -0.235 1
1 12 . 12 1 1 A 3 3 SER HA H 3 4.496 4.599 -0.103 1
1 14 . 12 1 1 A 3 3 SER C C 3 175.043 173.929 1.114 1
1 15 . 12 1 1 A 3 3 SER CA C 3 58.549 57.728 0.821 1
1 16 . 12 1 1 A 3 3 SER CB C 3 63.687 62.377 1.310 1
1 17 . 12 1 1 A 3 3 SER N N 3 117.930 118.963 -1.033 1
1 18 . 12 1 1 A 4 4 GLY H H 4 8.482 7.979 0.503 1
1 19 . 12 1 1 A 4 4 GLY C C 4 174.344 172.701 1.643 1
1 20 . 12 1 1 A 4 4 GLY CA C 4 45.536 44.603 0.933 1
1 21 . 12 1 1 A 4 4 GLY N N 4 110.985 110.249 0.736 1
1 22 . 12 1 1 A 6 6 SER HA H 6 4.508 5.237 -0.729 1
1 24 . 12 1 1 A 6 6 SER C C 6 175.026 173.960 1.066 1
1 25 . 12 1 1 A 6 6 SER CA C 6 58.584 56.860 1.724 1
1 26 . 12 1 1 A 6 6 SER CB C 6 63.646 66.727 -3.081 1
1 27 . 12 1 1 A 7 7 GLY H H 7 8.419 8.553 -0.134 1
1 28 . 12 1 1 A 7 7 GLY HA2 H 7 3.993 4.097 -0.104 1
1 29 . 12 1 1 A 7 7 GLY C C 7 173.995 173.818 0.177 1
1 30 . 12 1 1 A 7 7 GLY CA C 7 45.466 46.169 -0.703 1
1 31 . 12 1 1 A 7 7 GLY N N 7 110.615 110.564 0.051 1
1 32 . 12 1 1 A 8 8 ASN H H 8 8.322 7.979 0.343 1
1 33 . 12 1 1 A 8 8 ASN HA H 8 4.736 5.271 -0.535 1
1 38 . 12 1 1 A 8 8 ASN C C 8 174.907 173.742 1.165 1
1 39 . 12 1 1 A 8 8 ASN CA C 8 53.259 52.528 0.731 1
1 40 . 12 1 1 A 8 8 ASN CB C 8 39.127 41.355 -2.228 1
1 41 . 12 1 1 A 8 8 ASN N N 8 118.602 118.776 -0.174 1
1 43 . 12 1 1 A 9 9 ASP H H 9 8.370 8.722 -0.352 1
1 44 . 12 1 1 A 9 9 ASP HA H 9 4.594 4.637 -0.043 1
1 47 . 12 1 1 A 9 9 ASP C C 9 175.765 176.497 -0.732 1
1 48 . 12 1 1 A 9 9 ASP CA C 9 54.440 54.653 -0.213 1
1 49 . 12 1 1 A 9 9 ASP CB C 9 40.898 41.782 -0.884 1
1 50 . 12 1 1 A 9 9 ASP N N 9 120.504 127.535 -7.031 1
1 51 . 12 1 1 A 10 10 ASN H H 10 8.382 8.856 -0.474 1
1 52 . 12 1 1 A 10 10 ASN HA H 10 4.691 5.001 -0.310 1
1 57 . 12 1 1 A 10 10 ASN C C 10 174.383 174.661 -0.278 1
1 58 . 12 1 1 A 10 10 ASN CA C 10 53.241 52.949 0.292 1
1 59 . 12 1 1 A 10 10 ASN CB C 10 38.674 38.880 -0.206 1
1 60 . 12 1 1 A 10 10 ASN N N 10 119.406 118.419 0.987 1
1 62 . 12 1 1 A 11 11 ARG H H 11 7.942 7.627 0.315 1
1 63 . 12 1 1 A 11 11 ARG HA H 11 4.684 4.552 0.132 1
1 70 . 12 1 1 A 11 11 ARG C C 11 173.640 174.838 -1.198 1
1 71 . 12 1 1 A 11 11 ARG CA C 11 54.246 53.904 0.342 1
1 72 . 12 1 1 A 11 11 ARG CB C 11 30.337 31.166 -0.829 1
1 75 . 12 1 1 A 11 11 ARG N N 11 121.145 122.302 -1.157 1
1 76 . 12 1 1 A 12 12 PRO HA H 12 4.507 4.654 -0.147 1
1 83 . 12 1 1 A 12 12 PRO CA C 12 62.714 62.549 0.165 1
1 84 . 12 1 1 A 12 12 PRO CB C 12 31.942 31.758 0.184 1
1 87 . 12 1 1 A 13 13 VAL H H 13 8.252 8.331 -0.079 1
1 88 . 12 1 1 A 13 13 VAL HA H 13 4.159 4.480 -0.321 1
1 96 . 12 1 1 A 13 13 VAL CA C 13 61.409 60.257 1.152 1
1 97 . 12 1 1 A 13 13 VAL CB C 13 34.858 34.087 0.771 1
1 100 . 12 1 1 A 13 13 VAL N N 13 118.395 122.313 -3.918 1
1 101 . 12 1 1 A 14 14 PHE H H 14 8.725 8.964 -0.239 1
1 102 . 12 1 1 A 14 14 PHE HA H 14 4.781 4.539 0.242 1
1 110 . 12 1 1 A 14 14 PHE CA C 14 58.594 58.775 -0.181 1
1 111 . 12 1 1 A 14 14 PHE CB C 14 39.594 38.964 0.630 1
1 117 . 12 1 1 A 14 14 PHE N N 14 122.950 127.897 -4.947 1
1 118 . 12 1 1 A 15 15 LYS H H 15 8.885 8.497 0.388 1
1 119 . 12 1 1 A 15 15 LYS HA H 15 4.130 3.939 0.191 1
1 128 . 12 1 1 A 15 15 LYS C C 15 177.027 175.922 1.105 1
1 129 . 12 1 1 A 15 15 LYS CA C 15 58.478 60.062 -1.584 1
1 130 . 12 1 1 A 15 15 LYS CB C 15 32.748 32.548 0.200 1
1 134 . 12 1 1 A 15 15 LYS N N 15 123.863 125.932 -2.069 1
1 135 . 12 1 1 A 16 16 GLU H H 16 8.091 8.170 -0.079 1
1 136 . 12 1 1 A 16 16 GLU HA H 16 4.438 4.753 -0.315 1
1 141 . 12 1 1 A 16 16 GLU C C 16 175.947 176.809 -0.862 1
1 142 . 12 1 1 A 16 16 GLU CA C 16 56.045 54.964 1.081 1
1 143 . 12 1 1 A 16 16 GLU CB C 16 30.766 32.166 -1.400 1
1 145 . 12 1 1 A 16 16 GLU N N 16 117.026 117.200 -0.174 1
1 146 . 12 1 1 A 17 17 GLY H H 17 8.421 8.678 -0.257 1
1 147 . 12 1 1 A 17 17 GLY HA2 H 17 3.993 3.859 0.134 1
1 148 . 12 1 1 A 17 17 GLY HA3 H 17 3.913 3.872 0.041 1
1 149 . 12 1 1 A 17 17 GLY C C 17 173.564 174.048 -0.484 1
1 150 . 12 1 1 A 17 17 GLY CA C 17 45.448 46.950 -1.502 1
1 151 . 12 1 1 A 17 17 GLY N N 17 109.577 111.602 -2.025 1
1 152 . 12 1 1 A 18 18 GLN H H 18 7.858 7.724 0.134 1
1 153 . 12 1 1 A 18 18 GLN HA H 18 5.065 4.989 0.076 1
1 160 . 12 1 1 A 18 18 GLN C C 18 174.596 174.987 -0.391 1
1 161 . 12 1 1 A 18 18 GLN CA C 18 55.110 55.082 0.028 1
1 162 . 12 1 1 A 18 18 GLN CB C 18 30.329 29.645 0.684 1
1 164 . 12 1 1 A 18 18 GLN N N 18 120.202 117.726 2.476 1
1 166 . 12 1 1 A 19 19 VAL H H 19 8.216 8.860 -0.644 1
1 167 . 12 1 1 A 19 19 VAL HA H 19 4.450 4.804 -0.354 1
1 175 . 12 1 1 A 19 19 VAL C C 19 173.648 173.716 -0.068 1
1 176 . 12 1 1 A 19 19 VAL CA C 19 60.788 60.478 0.310 1
1 177 . 12 1 1 A 19 19 VAL CB C 19 35.336 35.525 -0.189 1
1 180 . 12 1 1 A 19 19 VAL N N 19 121.257 123.912 -2.655 1
1 181 . 12 1 1 A 20 20 GLU H H 20 8.610 8.945 -0.335 1
1 182 . 12 1 1 A 20 20 GLU HA H 20 5.211 5.350 -0.139 1
1 187 . 12 1 1 A 20 20 GLU C C 20 174.783 175.519 -0.736 1
1 188 . 12 1 1 A 20 20 GLU CA C 20 54.793 55.028 -0.235 1
1 189 . 12 1 1 A 20 20 GLU CB C 20 32.058 32.479 -0.421 1
1 191 . 12 1 1 A 20 20 GLU N N 20 127.095 127.958 -0.863 1
1 192 . 12 1 1 A 21 21 VAL H H 21 8.727 8.845 -0.118 1
1 193 . 12 1 1 A 21 21 VAL HA H 21 4.633 5.004 -0.371 1
1 201 . 12 1 1 A 21 21 VAL C C 21 173.894 174.776 -0.882 1
1 202 . 12 1 1 A 21 21 VAL CA C 21 59.695 59.201 0.494 1
1 203 . 12 1 1 A 21 21 VAL CB C 21 35.865 35.455 0.410 1
1 206 . 12 1 1 A 21 21 VAL N N 21 120.489 120.773 -0.284 1
1 207 . 12 1 1 A 22 22 HIS H H 22 8.680 8.849 -0.169 1
1 208 . 12 1 1 A 22 22 HIS HA H 22 5.552 5.605 -0.053 1
1 212 . 12 1 1 A 22 22 HIS C C 22 174.298 173.594 0.704 1
1 213 . 12 1 1 A 22 22 HIS CA C 22 55.331 53.956 1.375 1
1 214 . 12 1 1 A 22 22 HIS CB C 22 32.369 31.778 0.591 1
1 216 . 12 1 1 A 22 22 HIS N N 22 124.991 120.796 4.195 1
1 217 . 12 1 1 A 23 23 ILE H H 23 9.179 8.933 0.246 1
1 218 . 12 1 1 A 23 23 ILE HA H 23 5.046 4.558 0.488 1
1 228 . 12 1 1 A 23 23 ILE C C 23 171.552 173.321 -1.769 1
1 229 . 12 1 1 A 23 23 ILE CA C 23 55.551 57.130 -1.579 1
1 230 . 12 1 1 A 23 23 ILE CB C 23 42.053 42.059 -0.006 1
1 234 . 12 1 1 A 23 23 ILE N N 23 123.121 123.850 -0.729 1
1 235 . 12 1 1 A 24 24 PRO HA H 24 4.816 4.890 -0.074 1
1 242 . 12 1 1 A 24 24 PRO C C 24 178.887 177.937 0.950 1
1 243 . 12 1 1 A 24 24 PRO CA C 24 62.216 62.788 -0.572 1
1 244 . 12 1 1 A 24 24 PRO CB C 24 32.895 32.633 0.262 1
1 247 . 12 1 1 A 25 25 GLU H H 25 8.399 8.843 -0.444 1
1 248 . 12 1 1 A 25 25 GLU HA H 25 3.785 4.052 -0.267 1
1 253 . 12 1 1 A 25 25 GLU C C 25 175.244 177.099 -1.855 1
1 254 . 12 1 1 A 25 25 GLU CA C 25 58.425 59.185 -0.760 1
1 255 . 12 1 1 A 25 25 GLU CB C 25 30.011 29.015 0.996 1
1 257 . 12 1 1 A 25 25 GLU N N 25 117.706 122.412 -4.706 1
1 258 . 12 1 1 A 26 26 ASN H H 26 7.488 7.783 -0.295 1
1 259 . 12 1 1 A 26 26 ASN HA H 26 4.702 4.827 -0.125 1
1 264 . 12 1 1 A 26 26 ASN C C 26 175.425 175.221 0.204 1
1 265 . 12 1 1 A 26 26 ASN CA C 26 51.584 52.155 -0.571 1
1 266 . 12 1 1 A 26 26 ASN CB C 26 37.243 38.718 -1.475 1
1 267 . 12 1 1 A 26 26 ASN N N 26 112.383 116.874 -4.491 1
1 269 . 12 1 1 A 27 27 ALA H H 27 7.716 7.177 0.539 1
1 270 . 12 1 1 A 27 27 ALA HA H 27 4.409 4.408 0.001 1
1 274 . 12 1 1 A 27 27 ALA C C 27 175.850 175.836 0.014 1
1 275 . 12 1 1 A 27 27 ALA CA C 27 51.037 50.912 0.125 1
1 276 . 12 1 1 A 27 27 ALA CB C 27 18.152 18.280 -0.128 1
1 277 . 12 1 1 A 27 27 ALA N N 27 125.139 122.267 2.872 1
1 278 . 12 1 1 A 28 28 PRO HA H 28 4.422 4.500 -0.078 1
1 285 . 12 1 1 A 28 28 PRO C C 28 178.442 176.881 1.561 1
1 286 . 12 1 1 A 28 28 PRO CA C 28 62.067 62.702 -0.635 1
1 287 . 12 1 1 A 28 28 PRO CB C 28 32.642 32.348 0.294 1
1 290 . 12 1 1 A 29 29 VAL H H 29 8.691 8.287 0.404 1
1 291 . 12 1 1 A 29 29 VAL HA H 29 3.239 3.610 -0.371 1
1 299 . 12 1 1 A 29 29 VAL C C 29 176.887 177.131 -0.244 1
1 300 . 12 1 1 A 29 29 VAL CA C 29 65.812 64.254 1.558 1
1 301 . 12 1 1 A 29 29 VAL CB C 29 31.174 31.349 -0.175 1
1 304 . 12 1 1 A 29 29 VAL N N 29 123.592 122.813 0.779 1
1 305 . 12 1 1 A 30 30 GLY H H 30 9.197 8.713 0.484 1
1 306 . 12 1 1 A 30 30 GLY HA2 H 30 4.486 3.957 0.529 1
1 307 . 12 1 1 A 30 30 GLY HA3 H 30 3.581 3.959 -0.378 1
1 308 . 12 1 1 A 30 30 GLY C C 30 174.347 174.600 -0.253 1
1 309 . 12 1 1 A 30 30 GLY CA C 30 44.320 44.976 -0.656 1
1 310 . 12 1 1 A 30 30 GLY N N 30 116.042 115.133 0.909 1
1 311 . 12 1 1 A 31 31 THR H H 31 7.838 7.769 0.069 1
1 312 . 12 1 1 A 31 31 THR HA H 31 3.959 4.173 -0.214 1
1 317 . 12 1 1 A 31 31 THR C C 31 174.274 173.963 0.311 1
1 318 . 12 1 1 A 31 31 THR CA C 31 65.160 63.372 1.788 1
1 319 . 12 1 1 A 31 31 THR CB C 31 69.972 68.913 1.059 1
1 321 . 12 1 1 A 31 31 THR N N 31 117.679 118.050 -0.371 1
1 322 . 12 1 1 A 32 32 SER H H 32 9.022 8.659 0.363 1
1 323 . 12 1 1 A 32 32 SER HA H 32 4.273 4.648 -0.375 1
1 326 . 12 1 1 A 32 32 SER C C 32 172.692 174.463 -1.771 1
1 327 . 12 1 1 A 32 32 SER CA C 32 59.642 58.196 1.446 1
1 328 . 12 1 1 A 32 32 SER CB C 32 63.102 62.907 0.195 1
1 329 . 12 1 1 A 32 32 SER N N 32 123.045 122.011 1.034 1
1 330 . 12 1 1 A 33 33 VAL H H 33 9.202 8.751 0.451 1
1 331 . 12 1 1 A 33 33 VAL HA H 33 3.844 3.948 -0.104 1
1 339 . 12 1 1 A 33 33 VAL C C 33 174.782 175.950 -1.168 1
1 340 . 12 1 1 A 33 33 VAL CA C 33 64.242 64.392 -0.150 1
1 341 . 12 1 1 A 33 33 VAL CB C 33 32.893 32.486 0.407 1
1 344 . 12 1 1 A 33 33 VAL N N 33 126.861 125.612 1.249 1
1 345 . 12 1 1 A 34 34 ILE H H 34 7.074 7.766 -0.692 1
1 346 . 12 1 1 A 34 34 ILE HA H 34 4.295 4.618 -0.323 1
1 356 . 12 1 1 A 34 34 ILE C C 34 170.577 172.962 -2.385 1
1 357 . 12 1 1 A 34 34 ILE CA C 34 59.500 59.427 0.073 1
1 358 . 12 1 1 A 34 34 ILE CB C 34 39.251 41.914 -2.663 1
1 362 . 12 1 1 A 34 34 ILE N N 34 111.445 119.186 -7.741 1
1 363 . 12 1 1 A 35 35 GLN H H 35 8.450 9.046 -0.596 1
1 364 . 12 1 1 A 35 35 GLN HA H 35 4.633 4.923 -0.290 1
1 371 . 12 1 1 A 35 35 GLN C C 35 174.354 174.192 0.162 1
1 372 . 12 1 1 A 35 35 GLN CA C 35 54.176 54.434 -0.258 1
1 373 . 12 1 1 A 35 35 GLN CB C 35 29.456 30.607 -1.151 1
1 375 . 12 1 1 A 35 35 GLN N N 35 127.342 128.925 -1.583 1
1 377 . 12 1 1 A 36 36 LEU H H 36 7.761 8.544 -0.783 1
1 378 . 12 1 1 A 36 36 LEU HA H 36 4.492 4.935 -0.443 1
1 388 . 12 1 1 A 36 36 LEU C C 36 175.543 175.467 0.076 1
1 389 . 12 1 1 A 36 36 LEU CA C 36 53.982 53.769 0.213 1
1 390 . 12 1 1 A 36 36 LEU CB C 36 42.776 42.627 0.149 1
1 394 . 12 1 1 A 36 36 LEU N N 36 128.895 128.757 0.138 1
1 395 . 12 1 1 A 37 37 HIS H H 37 8.529 8.953 -0.424 1
1 396 . 12 1 1 A 37 37 HIS HA H 37 4.851 5.370 -0.519 1
1 400 . 12 1 1 A 37 37 HIS C C 37 172.985 173.455 -0.470 1
1 401 . 12 1 1 A 37 37 HIS CA C 37 55.833 53.157 2.676 1
1 402 . 12 1 1 A 37 37 HIS CB C 37 32.204 32.349 -0.145 1
1 404 . 12 1 1 A 37 37 HIS N N 37 115.903 124.669 -8.766 1
1 405 . 12 1 1 A 38 38 ALA H H 38 8.474 8.696 -0.222 1
1 406 . 12 1 1 A 38 38 ALA HA H 38 4.691 4.845 -0.154 1
1 410 . 12 1 1 A 38 38 ALA C C 38 175.548 176.673 -1.125 1
1 411 . 12 1 1 A 38 38 ALA CA C 38 50.491 50.593 -0.102 1
1 412 . 12 1 1 A 38 38 ALA CB C 38 19.842 19.936 -0.094 1
1 413 . 12 1 1 A 38 38 ALA N N 38 128.891 131.094 -2.203 1
1 414 . 12 1 1 A 39 39 THR H H 39 8.095 8.513 -0.418 1
1 415 . 12 1 1 A 39 39 THR HA H 39 4.336 5.031 -0.695 1
1 420 . 12 1 1 A 39 39 THR C C 39 173.553 173.726 -0.173 1
1 421 . 12 1 1 A 39 39 THR CA C 39 60.417 59.460 0.957 1
1 422 . 12 1 1 A 39 39 THR CB C 39 70.912 71.359 -0.447 1
1 424 . 12 1 1 A 39 39 THR N N 39 110.982 114.418 -3.436 1
1 425 . 12 1 1 A 40 40 ASP H H 40 8.417 9.095 -0.678 1
1 426 . 12 1 1 A 40 40 ASP HA H 40 4.553 4.909 -0.356 1
1 429 . 12 1 1 A 40 40 ASP C C 40 176.462 176.203 0.259 1
1 430 . 12 1 1 A 40 40 ASP CA C 40 54.158 55.177 -1.019 1
1 431 . 12 1 1 A 40 40 ASP CB C 40 41.517 42.889 -1.372 1
1 432 . 12 1 1 A 40 40 ASP N N 40 121.450 120.119 1.331 1
1 433 . 12 1 1 A 41 41 ALA H H 41 8.435 7.654 0.781 1
1 434 . 12 1 1 A 41 41 ALA HA H 41 4.129 4.483 -0.354 1
1 438 . 12 1 1 A 41 41 ALA C C 41 177.718 176.252 1.466 1
1 439 . 12 1 1 A 41 41 ALA CA C 41 53.436 51.149 2.287 1
1 440 . 12 1 1 A 41 41 ALA CB C 41 19.183 22.280 -3.097 1
1 441 . 12 1 1 A 41 41 ALA N N 41 124.607 117.058 7.549 1
1 442 . 12 1 1 A 42 42 ASP H H 42 8.310 8.886 -0.576 1
1 443 . 12 1 1 A 42 42 ASP HA H 42 4.588 4.726 -0.138 1
1 446 . 12 1 1 A 42 42 ASP C C 42 176.546 175.838 0.708 1
1 447 . 12 1 1 A 42 42 ASP CA C 42 54.599 53.889 0.710 1
1 448 . 12 1 1 A 42 42 ASP CB C 42 41.146 39.603 1.543 1
1 449 . 12 1 1 A 42 42 ASP N N 42 118.030 118.559 -0.529 1
1 450 . 12 1 1 A 43 43 ILE H H 43 8.000 8.255 -0.255 1
1 451 . 12 1 1 A 43 43 ILE HA H 43 4.130 4.514 -0.384 1
1 461 . 12 1 1 A 43 43 ILE C C 43 176.901 175.384 1.517 1
1 462 . 12 1 1 A 43 43 ILE CA C 43 61.740 60.302 1.438 1
1 463 . 12 1 1 A 43 43 ILE CB C 43 38.491 38.133 0.358 1
1 467 . 12 1 1 A 43 43 ILE N N 43 119.301 118.592 0.709 1
1 468 . 12 1 1 A 44 44 GLY H H 44 8.448 8.739 -0.291 1
1 469 . 12 1 1 A 44 44 GLY HA2 H 44 3.939 3.852 0.087 1
1 470 . 12 1 1 A 44 44 GLY HA3 H 44 3.939 3.856 0.083 1
1 471 . 12 1 1 A 44 44 GLY C C 44 174.393 174.609 -0.216 1
1 472 . 12 1 1 A 44 44 GLY CA C 44 45.501 47.172 -1.671 1
1 473 . 12 1 1 A 44 44 GLY N N 44 111.333 114.165 -2.832 1
1 474 . 12 1 1 A 45 45 SER H H 45 8.061 8.923 -0.862 1
1 475 . 12 1 1 A 45 45 SER HA H 45 4.416 4.140 0.276 1
1 478 . 12 1 1 A 45 45 SER C C 45 174.480 173.945 0.535 1
1 479 . 12 1 1 A 45 45 SER CA C 45 58.478 58.975 -0.497 1
1 480 . 12 1 1 A 45 45 SER CB C 45 63.943 61.627 2.316 1
1 481 . 12 1 1 A 45 45 SER N N 45 115.551 118.548 -2.997 1
1 482 . 12 1 1 A 46 46 ASN H H 46 8.547 7.563 0.984 1
1 483 . 12 1 1 A 46 46 ASN HA H 46 4.725 4.926 -0.201 1
1 488 . 12 1 1 A 46 46 ASN C C 46 175.031 175.256 -0.225 1
1 489 . 12 1 1 A 46 46 ASN CA C 46 53.277 54.788 -1.511 1
1 490 . 12 1 1 A 46 46 ASN CB C 46 38.798 40.250 -1.452 1
1 491 . 12 1 1 A 46 46 ASN N N 46 120.698 117.997 2.701 1
1 493 . 12 1 1 A 47 47 ALA H H 47 8.239 7.732 0.507 1
1 494 . 12 1 1 A 47 47 ALA HA H 47 4.283 4.535 -0.252 1
1 498 . 12 1 1 A 47 47 ALA C C 47 177.240 176.302 0.938 1
1 499 . 12 1 1 A 47 47 ALA CA C 47 52.731 50.501 2.230 1
1 500 . 12 1 1 A 47 47 ALA CB C 47 19.594 18.940 0.654 1
1 501 . 12 1 1 A 47 47 ALA N N 47 124.093 120.297 3.796 1
1 502 . 12 1 1 A 48 48 GLU H H 48 8.376 8.721 -0.345 1
1 503 . 12 1 1 A 48 48 GLU HA H 48 4.264 4.234 0.030 1
1 508 . 12 1 1 A 48 48 GLU C C 48 175.702 175.498 0.204 1
1 509 . 12 1 1 A 48 48 GLU CA C 48 55.992 56.236 -0.244 1
1 510 . 12 1 1 A 48 48 GLU CB C 48 30.210 29.307 0.903 1
1 512 . 12 1 1 A 48 48 GLU N N 48 119.750 125.286 -5.536 1
1 513 . 12 1 1 A 49 49 ILE H H 49 7.806 7.969 -0.163 1
1 514 . 12 1 1 A 49 49 ILE HA H 49 3.919 4.181 -0.262 1
1 524 . 12 1 1 A 49 49 ILE C C 49 175.894 175.439 0.455 1
1 525 . 12 1 1 A 49 49 ILE CA C 49 60.559 61.882 -1.323 1
1 526 . 12 1 1 A 49 49 ILE CB C 49 37.860 37.292 0.568 1
1 530 . 12 1 1 A 49 49 ILE N N 49 122.772 127.085 -4.313 1
1 531 . 12 1 1 A 50 50 ARG H H 50 8.247 8.017 0.230 1
1 532 . 12 1 1 A 50 50 ARG HA H 50 4.999 4.681 0.318 1
1 539 . 12 1 1 A 50 50 ARG C C 50 174.603 175.051 -0.448 1
1 540 . 12 1 1 A 50 50 ARG CA C 50 53.189 55.512 -2.323 1
1 541 . 12 1 1 A 50 50 ARG CB C 50 33.152 31.881 1.271 1
1 544 . 12 1 1 A 50 50 ARG N N 50 126.912 127.602 -0.690 1
1 545 . 12 1 1 A 51 51 TYR H H 51 9.041 8.922 0.119 1
1 546 . 12 1 1 A 51 51 TYR HA H 51 5.395 5.561 -0.166 1
1 553 . 12 1 1 A 51 51 TYR C C 51 175.555 175.120 0.435 1
1 554 . 12 1 1 A 51 51 TYR CA C 51 56.909 56.499 0.410 1
1 555 . 12 1 1 A 51 51 TYR CB C 51 40.116 41.118 -1.002 1
1 560 . 12 1 1 A 51 51 TYR N N 51 121.627 120.059 1.568 1
1 561 . 12 1 1 A 52 52 ILE H H 52 8.850 8.573 0.277 1
1 562 . 12 1 1 A 52 52 ILE HA H 52 4.576 4.856 -0.280 1
1 572 . 12 1 1 A 52 52 ILE C C 52 175.371 174.850 0.521 1
1 573 . 12 1 1 A 52 52 ILE CA C 52 59.624 59.124 0.500 1
1 574 . 12 1 1 A 52 52 ILE CB C 52 42.895 41.843 1.052 1
1 578 . 12 1 1 A 52 52 ILE N N 52 117.697 118.440 -0.743 1
1 579 . 12 1 1 A 53 53 PHE H H 53 8.748 8.783 -0.035 1
1 580 . 12 1 1 A 53 53 PHE HA H 53 5.132 4.967 0.165 1
1 588 . 12 1 1 A 53 53 PHE C C 53 178.146 176.376 1.770 1
1 589 . 12 1 1 A 53 53 PHE CA C 53 57.667 57.465 0.202 1
1 590 . 12 1 1 A 53 53 PHE CB C 53 39.614 39.758 -0.144 1
1 596 . 12 1 1 A 53 53 PHE N N 53 121.433 121.807 -0.374 1
1 597 . 12 1 1 A 54 54 GLY H H 54 8.538 9.013 -0.475 1
1 598 . 12 1 1 A 54 54 GLY HA2 H 54 4.074 4.128 -0.054 1
1 599 . 12 1 1 A 54 54 GLY HA3 H 54 3.840 4.134 -0.294 1
1 600 . 12 1 1 A 54 54 GLY C C 54 174.530 172.966 1.564 1
1 601 . 12 1 1 A 54 54 GLY CA C 54 44.884 44.444 0.440 1
1 602 . 12 1 1 A 54 54 GLY N N 54 106.444 110.414 -3.970 1
1 603 . 12 1 1 A 55 55 ALA H H 55 8.594 8.358 0.236 1
1 604 . 12 1 1 A 55 55 ALA HA H 55 4.172 4.447 -0.275 1
1 608 . 12 1 1 A 55 55 ALA C C 55 178.718 177.442 1.276 1
1 609 . 12 1 1 A 55 55 ALA CA C 55 54.423 51.331 3.092 1
1 610 . 12 1 1 A 55 55 ALA CB C 55 19.059 20.349 -1.290 1
1 611 . 12 1 1 A 55 55 ALA N N 55 123.470 121.743 1.727 1
1 612 . 12 1 1 A 56 56 GLN H H 56 8.727 8.776 -0.049 1
1 613 . 12 1 1 A 56 56 GLN HA H 56 4.367 3.791 0.576 1
1 620 . 12 1 1 A 56 56 GLN C C 56 176.134 174.513 1.621 1
1 621 . 12 1 1 A 56 56 GLN CA C 56 55.660 56.721 -1.061 1
1 622 . 12 1 1 A 56 56 GLN CB C 56 28.152 27.005 1.147 1
1 624 . 12 1 1 A 56 56 GLN N N 56 114.221 115.311 -1.090 1
1 626 . 12 1 1 A 57 57 VAL H H 57 7.204 7.665 -0.461 1
1 627 . 12 1 1 A 57 57 VAL HA H 57 3.889 4.323 -0.434 1
1 635 . 12 1 1 A 57 57 VAL C C 57 175.371 175.204 0.167 1
1 636 . 12 1 1 A 57 57 VAL CA C 57 63.908 60.817 3.091 1
1 637 . 12 1 1 A 57 57 VAL CB C 57 31.557 33.442 -1.885 1
1 640 . 12 1 1 A 57 57 VAL N N 57 121.341 119.304 2.037 1
1 641 . 12 1 1 A 58 58 ALA H H 58 8.920 8.569 0.351 1
1 642 . 12 1 1 A 58 58 ALA HA H 58 4.547 4.433 0.114 1
1 646 . 12 1 1 A 58 58 ALA C C 58 177.064 177.809 -0.745 1
1 647 . 12 1 1 A 58 58 ALA CA C 58 51.173 50.528 0.645 1
1 648 . 12 1 1 A 58 58 ALA CB C 58 17.842 17.865 -0.023 1
1 649 . 12 1 1 A 58 58 ALA N N 58 132.726 129.624 3.102 1
1 650 . 12 1 1 A 59 59 PRO HA H 59 4.101 4.245 -0.144 1
1 657 . 12 1 1 A 59 59 PRO C C 59 179.482 178.533 0.949 1
1 658 . 12 1 1 A 59 59 PRO CA C 59 66.060 65.495 0.565 1
1 659 . 12 1 1 A 59 59 PRO CB C 59 31.951 31.870 0.081 1
1 662 . 12 1 1 A 60 60 ALA H H 60 8.706 8.236 0.470 1
1 663 . 12 1 1 A 60 60 ALA HA H 60 4.057 3.993 0.064 1
1 667 . 12 1 1 A 60 60 ALA C C 60 179.627 180.104 -0.477 1
1 668 . 12 1 1 A 60 60 ALA CA C 60 55.305 55.465 -0.160 1
1 669 . 12 1 1 A 60 60 ALA CB C 60 18.737 18.738 -0.001 1
1 670 . 12 1 1 A 60 60 ALA N N 60 117.882 118.670 -0.788 1
1 671 . 12 1 1 A 61 61 THR H H 61 7.312 8.199 -0.887 1
1 672 . 12 1 1 A 61 61 THR HA H 61 4.153 3.912 0.241 1
1 677 . 12 1 1 A 61 61 THR C C 61 175.824 176.615 -0.791 1
1 678 . 12 1 1 A 61 61 THR CA C 61 66.412 66.933 -0.521 1
1 679 . 12 1 1 A 61 61 THR CB C 61 68.787 68.657 0.130 1
1 681 . 12 1 1 A 61 61 THR N N 61 114.483 114.669 -0.186 1
1 682 . 12 1 1 A 62 62 LYS H H 62 7.556 7.317 0.239 1
1 683 . 12 1 1 A 62 62 LYS HA H 62 3.943 3.838 0.105 1
1 692 . 12 1 1 A 62 62 LYS C C 62 176.884 179.337 -2.453 1
1 693 . 12 1 1 A 62 62 LYS CA C 62 59.095 59.012 0.083 1
1 694 . 12 1 1 A 62 62 LYS CB C 62 32.204 31.742 0.462 1
1 698 . 12 1 1 A 62 62 LYS N N 62 118.994 119.060 -0.066 1
1 699 . 12 1 1 A 63 63 ARG H H 63 7.474 7.903 -0.429 1
1 700 . 12 1 1 A 63 63 ARG HA H 63 4.034 4.053 -0.019 1
1 707 . 12 1 1 A 63 63 ARG C C 63 177.574 178.302 -0.728 1
1 708 . 12 1 1 A 63 63 ARG CA C 63 58.143 59.085 -0.942 1
1 709 . 12 1 1 A 63 63 ARG CB C 63 30.755 30.572 0.183 1
1 712 . 12 1 1 A 63 63 ARG N N 63 114.251 119.902 -5.651 1
1 713 . 12 1 1 A 64 64 LEU H H 64 6.991 7.807 -0.816 1
1 714 . 12 1 1 A 64 64 LEU HA H 64 3.904 3.922 -0.018 1
1 724 . 12 1 1 A 64 64 LEU C C 64 176.632 176.350 0.282 1
1 725 . 12 1 1 A 64 64 LEU CA C 64 56.503 56.668 -0.165 1
1 726 . 12 1 1 A 64 64 LEU CB C 64 42.929 42.664 0.265 1
1 730 . 12 1 1 A 64 64 LEU N N 64 116.109 118.889 -2.780 1
1 731 . 12 1 1 A 65 65 PHE H H 65 7.673 8.028 -0.355 1
1 732 . 12 1 1 A 65 65 PHE HA H 65 5.386 5.094 0.292 1
1 740 . 12 1 1 A 65 65 PHE C C 65 173.067 175.028 -1.961 1
1 741 . 12 1 1 A 65 65 PHE CA C 65 56.521 56.726 -0.205 1
1 742 . 12 1 1 A 65 65 PHE CB C 65 41.270 40.825 0.445 1
1 748 . 12 1 1 A 65 65 PHE N N 65 116.182 115.582 0.600 1
1 749 . 12 1 1 A 66 66 ALA H H 66 8.914 8.799 0.115 1
1 750 . 12 1 1 A 66 66 ALA HA H 66 4.748 5.132 -0.384 1
1 754 . 12 1 1 A 66 66 ALA C C 66 175.223 176.021 -0.798 1
1 755 . 12 1 1 A 66 66 ALA CA C 66 50.050 50.924 -0.874 1
1 756 . 12 1 1 A 66 66 ALA CB C 66 21.161 20.781 0.380 1
1 757 . 12 1 1 A 66 66 ALA N N 66 122.870 126.407 -3.537 1
1 758 . 12 1 1 A 67 67 LEU H H 67 8.498 9.047 -0.549 1
1 759 . 12 1 1 A 67 67 LEU HA H 67 4.713 5.248 -0.535 1
1 769 . 12 1 1 A 67 67 LEU C C 67 175.146 174.917 0.229 1
1 770 . 12 1 1 A 67 67 LEU CA C 67 52.518 53.267 -0.749 1
1 771 . 12 1 1 A 67 67 LEU CB C 67 45.308 44.668 0.640 1
1 775 . 12 1 1 A 67 67 LEU N N 67 122.208 124.443 -2.235 1
1 776 . 12 1 1 A 68 68 ASN H H 68 8.357 8.918 -0.561 1
1 777 . 12 1 1 A 68 68 ASN HA H 68 4.679 5.128 -0.449 1
1 782 . 12 1 1 A 68 68 ASN C C 68 176.228 175.053 1.175 1
1 783 . 12 1 1 A 68 68 ASN CA C 68 53.524 52.338 1.186 1
1 784 . 12 1 1 A 68 68 ASN CB C 68 39.580 40.471 -0.891 1
1 785 . 12 1 1 A 68 68 ASN N N 68 126.940 124.328 2.612 1
1 787 . 12 1 1 A 69 69 ASN H H 69 8.861 9.033 -0.172 1
1 788 . 12 1 1 A 69 69 ASN HA H 69 5.137 5.068 0.069 1
1 793 . 12 1 1 A 69 69 ASN C C 69 175.631 176.419 -0.788 1
1 794 . 12 1 1 A 69 69 ASN CA C 69 56.009 53.743 2.266 1
1 795 . 12 1 1 A 69 69 ASN CB C 69 40.314 39.105 1.209 1
1 796 . 12 1 1 A 69 69 ASN N N 69 124.980 122.190 2.790 1
1 798 . 12 1 1 A 70 70 THR H H 70 8.635 7.827 0.808 1
1 799 . 12 1 1 A 70 70 THR HA H 70 4.815 4.606 0.209 1
1 804 . 12 1 1 A 70 70 THR C C 70 176.223 175.547 0.676 1
1 805 . 12 1 1 A 70 70 THR CA C 70 63.944 62.642 1.302 1
1 806 . 12 1 1 A 70 70 THR CB C 70 69.727 70.302 -0.575 1
1 808 . 12 1 1 A 70 70 THR N N 70 110.394 109.350 1.044 1
1 809 . 12 1 1 A 71 71 THR H H 71 8.069 7.844 0.225 1
1 810 . 12 1 1 A 71 71 THR HA H 71 4.566 4.489 0.077 1
1 815 . 12 1 1 A 71 71 THR C C 71 176.213 175.551 0.662 1
1 816 . 12 1 1 A 71 71 THR CA C 71 61.683 61.883 -0.200 1
1 817 . 12 1 1 A 71 71 THR CB C 71 70.832 70.982 -0.150 1
1 819 . 12 1 1 A 71 71 THR N N 71 110.507 110.289 0.218 1
1 820 . 12 1 1 A 72 72 GLY H H 72 7.990 7.984 0.006 1
1 821 . 12 1 1 A 72 72 GLY HA2 H 72 3.186 3.283 -0.097 1
1 822 . 12 1 1 A 72 72 GLY HA3 H 72 2.516 3.638 -1.122 1
1 823 . 12 1 1 A 72 72 GLY C C 72 172.988 174.224 -1.236 1
1 824 . 12 1 1 A 72 72 GLY CA C 72 45.149 45.951 -0.802 1
1 825 . 12 1 1 A 72 72 GLY N N 72 110.788 112.395 -1.607 1
1 826 . 12 1 1 A 73 73 LEU H H 73 7.138 7.660 -0.522 1
1 827 . 12 1 1 A 73 73 LEU HA H 73 4.414 4.691 -0.277 1
1 837 . 12 1 1 A 73 73 LEU C C 73 176.836 175.246 1.590 1
1 838 . 12 1 1 A 73 73 LEU CA C 73 55.252 53.817 1.435 1
1 839 . 12 1 1 A 73 73 LEU CB C 73 43.574 43.092 0.482 1
1 843 . 12 1 1 A 73 73 LEU N N 73 119.222 122.355 -3.133 1
1 844 . 12 1 1 A 74 74 ILE H H 74 8.925 8.548 0.377 1
1 845 . 12 1 1 A 74 74 ILE HA H 74 5.555 4.783 0.772 1
1 855 . 12 1 1 A 74 74 ILE C C 74 175.978 175.524 0.454 1
1 856 . 12 1 1 A 74 74 ILE CA C 74 60.100 60.997 -0.897 1
1 857 . 12 1 1 A 74 74 ILE CB C 74 38.550 38.235 0.315 1
1 861 . 12 1 1 A 74 74 ILE N N 74 129.871 128.729 1.142 1
1 862 . 12 1 1 A 75 75 THR H H 75 9.161 8.573 0.588 1
1 863 . 12 1 1 A 75 75 THR HA H 75 5.375 5.451 -0.076 1
1 868 . 12 1 1 A 75 75 THR C C 75 174.798 173.452 1.346 1
1 869 . 12 1 1 A 75 75 THR CA C 75 58.796 59.487 -0.691 1
1 870 . 12 1 1 A 75 75 THR CB C 75 72.978 71.648 1.330 1
1 872 . 12 1 1 A 75 75 THR N N 75 117.522 117.755 -0.233 1
1 873 . 12 1 1 A 76 76 VAL H H 76 8.327 8.529 -0.202 1
1 874 . 12 1 1 A 76 76 VAL HA H 76 3.973 3.884 0.089 1
1 882 . 12 1 1 A 76 76 VAL C C 76 176.495 175.843 0.652 1
1 883 . 12 1 1 A 76 76 VAL CA C 76 64.085 63.374 0.711 1
1 884 . 12 1 1 A 76 76 VAL CB C 76 32.863 31.625 1.238 1
1 887 . 12 1 1 A 76 76 VAL N N 76 120.876 122.161 -1.285 1
1 888 . 12 1 1 A 77 77 GLN H H 77 9.525 9.197 0.328 1
1 889 . 12 1 1 A 77 77 GLN HA H 77 4.702 4.331 0.371 1
1 896 . 12 1 1 A 77 77 GLN C C 77 173.838 175.068 -1.230 1
1 897 . 12 1 1 A 77 77 GLN CA C 77 55.728 56.850 -1.122 1
1 898 . 12 1 1 A 77 77 GLN CB C 77 30.762 30.431 0.331 1
1 900 . 12 1 1 A 77 77 GLN N N 77 129.825 128.532 1.293 1
1 902 . 12 1 1 A 78 78 ARG H H 78 7.621 7.092 0.529 1
1 903 . 12 1 1 A 78 78 ARG HA H 78 4.347 4.738 -0.391 1
1 910 . 12 1 1 A 78 78 ARG C C 78 172.304 175.631 -3.327 1
1 911 . 12 1 1 A 78 78 ARG CA C 78 54.634 53.956 0.678 1
1 912 . 12 1 1 A 78 78 ARG CB C 78 34.685 35.275 -0.590 1
1 915 . 12 1 1 A 78 78 ARG N N 78 120.595 117.252 3.343 1
1 916 . 12 1 1 A 79 79 SER H H 79 7.958 8.605 -0.647 1
1 917 . 12 1 1 A 79 79 SER HA H 79 4.030 4.337 -0.307 1
1 920 . 12 1 1 A 79 79 SER C C 79 174.311 174.332 -0.021 1
1 921 . 12 1 1 A 79 79 SER CA C 79 59.889 58.610 1.279 1
1 922 . 12 1 1 A 79 79 SER CB C 79 63.548 63.843 -0.295 1
1 923 . 12 1 1 A 79 79 SER N N 79 112.565 116.528 -3.963 1
1 924 . 12 1 1 A 80 80 LEU H H 80 8.715 8.203 0.512 1
1 925 . 12 1 1 A 80 80 LEU HA H 80 4.114 5.094 -0.980 1
1 935 . 12 1 1 A 80 80 LEU C C 80 176.057 175.781 0.276 1
1 936 . 12 1 1 A 80 80 LEU CA C 80 55.091 53.373 1.718 1
1 937 . 12 1 1 A 80 80 LEU CB C 80 42.341 45.116 -2.775 1
1 941 . 12 1 1 A 80 80 LEU N N 80 123.070 123.115 -0.045 1
1 942 . 12 1 1 A 81 81 ASP H H 81 7.298 8.820 -1.522 1
1 943 . 12 1 1 A 81 81 ASP HA H 81 4.725 5.314 -0.589 1
1 946 . 12 1 1 A 81 81 ASP C C 81 175.939 176.125 -0.186 1
1 947 . 12 1 1 A 81 81 ASP CA C 81 53.664 52.875 0.789 1
1 948 . 12 1 1 A 81 81 ASP CB C 81 42.947 43.576 -0.629 1
1 949 . 12 1 1 A 81 81 ASP N N 81 115.229 121.685 -6.456 1
1 950 . 12 1 1 A 82 82 ARG H H 82 9.289 8.893 0.396 1
1 951 . 12 1 1 A 82 82 ARG HA H 82 4.416 4.579 -0.163 1
1 959 . 12 1 1 A 82 82 ARG C C 82 176.406 178.011 -1.605 1
1 960 . 12 1 1 A 82 82 ARG CA C 82 56.397 58.091 -1.694 1
1 961 . 12 1 1 A 82 82 ARG CB C 82 30.638 30.562 0.076 1
1 964 . 12 1 1 A 82 82 ARG N N 82 123.174 124.947 -1.773 1
1 966 . 12 1 1 A 83 83 GLU H H 83 8.468 8.289 0.179 1
1 967 . 12 1 1 A 83 83 GLU HA H 83 3.982 4.125 -0.143 1
1 972 . 12 1 1 A 83 83 GLU C C 83 177.740 178.532 -0.792 1
1 973 . 12 1 1 A 83 83 GLU CA C 83 58.425 59.279 -0.854 1
1 974 . 12 1 1 A 83 83 GLU CB C 83 29.701 28.875 0.826 1
1 976 . 12 1 1 A 83 83 GLU N N 83 119.549 117.465 2.084 1
1 977 . 12 1 1 A 84 84 GLU H H 84 8.033 7.853 0.180 1
1 978 . 12 1 1 A 84 84 GLU HA H 84 4.206 4.290 -0.084 1
1 983 . 12 1 1 A 84 84 GLU C C 84 176.837 175.718 1.119 1
1 984 . 12 1 1 A 84 84 GLU CA C 84 58.056 58.096 -0.040 1
1 985 . 12 1 1 A 84 84 GLU CB C 84 30.432 30.894 -0.462 1
1 987 . 12 1 1 A 84 84 GLU N N 84 118.333 120.141 -1.808 1
1 988 . 12 1 1 A 85 85 THR H H 85 7.651 7.718 -0.067 1
1 989 . 12 1 1 A 85 85 THR HA H 85 4.307 4.581 -0.274 1
1 994 . 12 1 1 A 85 85 THR C C 85 171.568 173.709 -2.141 1
1 995 . 12 1 1 A 85 85 THR CA C 85 61.387 59.909 1.478 1
1 996 . 12 1 1 A 85 85 THR CB C 85 69.963 70.999 -1.036 1
1 998 . 12 1 1 A 85 85 THR N N 85 112.444 112.150 0.294 1
1 999 . 12 1 1 A 86 86 ALA H H 86 8.639 8.463 0.176 1
1 1000 . 12 1 1 A 86 86 ALA HA H 86 4.603 4.412 0.191 1
1 1004 . 12 1 1 A 86 86 ALA C C 86 175.560 176.690 -1.130 1
1 1005 . 12 1 1 A 86 86 ALA CA C 86 52.156 52.537 -0.381 1
1 1006 . 12 1 1 A 86 86 ALA CB C 86 20.378 20.165 0.213 1
1 1007 . 12 1 1 A 86 86 ALA N N 86 127.705 127.015 0.690 1
1 1008 . 12 1 1 A 87 87 ILE H H 87 7.663 7.038 0.625 1
1 1009 . 12 1 1 A 87 87 ILE HA H 87 4.828 4.877 -0.049 1
1 1019 . 12 1 1 A 87 87 ILE C C 87 174.537 173.972 0.565 1
1 1020 . 12 1 1 A 87 87 ILE CA C 87 60.329 59.820 0.509 1
1 1021 . 12 1 1 A 87 87 ILE CB C 87 41.090 42.017 -0.927 1
1 1025 . 12 1 1 A 87 87 ILE N N 87 118.712 118.293 0.419 1
1 1026 . 12 1 1 A 88 88 HIS H H 88 9.098 8.769 0.329 1
1 1027 . 12 1 1 A 88 88 HIS HA H 88 4.576 5.224 -0.648 1
1 1032 . 12 1 1 A 88 88 HIS C C 88 174.354 174.590 -0.236 1
1 1033 . 12 1 1 A 88 88 HIS CA C 88 54.740 54.214 0.526 1
1 1034 . 12 1 1 A 88 88 HIS CB C 88 33.955 33.165 0.790 1
1 1037 . 12 1 1 A 88 88 HIS N N 88 126.285 124.553 1.732 1
1 1038 . 12 1 1 A 89 89 LYS H H 89 8.957 8.957 0.000 1
1 1039 . 12 1 1 A 89 89 LYS HA H 89 4.873 4.910 -0.037 1
1 1048 . 12 1 1 A 89 89 LYS C C 89 175.906 175.555 0.351 1
1 1049 . 12 1 1 A 89 89 LYS CA C 89 55.269 55.054 0.215 1
1 1050 . 12 1 1 A 89 89 LYS CB C 89 32.945 34.544 -1.599 1
1 1054 . 12 1 1 A 89 89 LYS N N 89 124.332 122.238 2.094 1
1 1055 . 12 1 1 A 90 90 VAL H H 90 9.174 8.904 0.270 1
1 1056 . 12 1 1 A 90 90 VAL HA H 90 4.227 4.879 -0.652 1
1 1064 . 12 1 1 A 90 90 VAL C C 90 174.168 174.832 -0.664 1
1 1065 . 12 1 1 A 90 90 VAL CA C 90 61.369 60.866 0.503 1
1 1066 . 12 1 1 A 90 90 VAL CB C 90 34.082 35.909 -1.827 1
1 1069 . 12 1 1 A 90 90 VAL N N 90 124.319 123.492 0.827 1
1 1070 . 12 1 1 A 91 91 THR H H 91 6.697 8.900 -2.203 1
1 1071 . 12 1 1 A 91 91 THR HA H 91 5.163 5.237 -0.074 1
1 1076 . 12 1 1 A 91 91 THR C C 91 173.812 173.622 0.190 1
1 1077 . 12 1 1 A 91 91 THR CA C 91 61.935 61.570 0.365 1
1 1078 . 12 1 1 A 91 91 THR CB C 91 70.412 70.949 -0.537 1
1 1080 . 12 1 1 A 91 91 THR N N 91 122.637 123.675 -1.038 1
1 1081 . 12 1 1 A 92 92 VAL H H 92 9.292 8.394 0.898 1
1 1082 . 12 1 1 A 92 92 VAL HA H 92 4.736 5.141 -0.405 1
1 1090 . 12 1 1 A 92 92 VAL C C 92 173.160 174.841 -1.681 1
1 1091 . 12 1 1 A 92 92 VAL CA C 92 60.982 60.820 0.162 1
1 1092 . 12 1 1 A 92 92 VAL CB C 92 35.130 34.701 0.429 1
1 1095 . 12 1 1 A 92 92 VAL N N 92 128.265 126.247 2.018 1
1 1096 . 12 1 1 A 93 93 LEU H H 93 9.495 9.353 0.142 1
1 1097 . 12 1 1 A 93 93 LEU HA H 93 5.628 5.627 0.001 1
1 1107 . 12 1 1 A 93 93 LEU C C 93 176.274 175.169 1.105 1
1 1108 . 12 1 1 A 93 93 LEU CA C 93 52.773 53.666 -0.893 1
1 1109 . 12 1 1 A 93 93 LEU CB C 93 43.454 43.556 -0.102 1
1 1113 . 12 1 1 A 93 93 LEU N N 93 126.350 126.814 -0.464 1
1 1114 . 12 1 1 A 94 94 ALA H H 94 8.688 9.278 -0.590 1
1 1115 . 12 1 1 A 94 94 ALA HA H 94 4.986 5.104 -0.118 1
1 1119 . 12 1 1 A 94 94 ALA C C 94 175.787 175.891 -0.104 1
1 1120 . 12 1 1 A 94 94 ALA CA C 94 49.610 50.250 -0.640 1
1 1121 . 12 1 1 A 94 94 ALA CB C 94 21.463 21.451 0.012 1
1 1122 . 12 1 1 A 94 94 ALA N N 94 123.429 129.354 -5.925 1
1 1123 . 12 1 1 A 95 95 SER H H 95 8.401 8.023 0.378 1
1 1124 . 12 1 1 A 95 95 SER HA H 95 4.828 5.066 -0.238 1
1 1127 . 12 1 1 A 95 95 SER C C 95 174.327 172.324 2.003 1
1 1128 . 12 1 1 A 95 95 SER CA C 95 56.239 56.803 -0.564 1
1 1129 . 12 1 1 A 95 95 SER CB C 95 65.561 65.594 -0.033 1
1 1130 . 12 1 1 A 95 95 SER N N 95 114.418 116.139 -1.721 1
1 1131 . 12 1 1 A 96 96 ASP H H 96 8.690 8.786 -0.096 1
1 1132 . 12 1 1 A 96 96 ASP HA H 96 4.908 4.887 0.021 1
1 1135 . 12 1 1 A 96 96 ASP C C 96 177.096 176.683 0.413 1
1 1136 . 12 1 1 A 96 96 ASP CA C 96 52.818 53.831 -1.013 1
1 1137 . 12 1 1 A 96 96 ASP CB C 96 41.253 42.877 -1.624 1
1 1138 . 12 1 1 A 96 96 ASP N N 96 125.624 124.924 0.700 1
1 1139 . 12 1 1 A 97 97 GLY H H 97 8.524 7.360 1.164 1
1 1140 . 12 1 1 A 97 97 GLY HA2 H 97 4.320 4.063 0.257 1
1 1141 . 12 1 1 A 97 97 GLY HA3 H 97 3.620 4.065 -0.445 1
1 1142 . 12 1 1 A 97 97 GLY C C 97 174.620 173.846 0.774 1
1 1143 . 12 1 1 A 97 97 GLY CA C 97 45.422 45.602 -0.180 1
1 1144 . 12 1 1 A 97 97 GLY N N 97 109.283 106.208 3.075 1
1 1145 . 12 1 1 A 98 98 SER H H 98 8.575 7.879 0.696 1
1 1146 . 12 1 1 A 98 98 SER HA H 98 4.607 4.815 -0.208 1
1 1149 . 12 1 1 A 98 98 SER C C 98 174.478 174.375 0.103 1
1 1150 . 12 1 1 A 98 98 SER CA C 98 59.095 56.907 2.188 1
1 1151 . 12 1 1 A 98 98 SER CB C 98 64.800 66.253 -1.453 1
1 1152 . 12 1 1 A 98 98 SER N N 98 116.640 115.441 1.199 1
1 1153 . 12 1 1 A 99 99 SER H H 99 8.945 8.735 0.210 1
1 1154 . 12 1 1 A 99 99 SER HA H 99 4.530 4.412 0.118 1
1 1157 . 12 1 1 A 99 99 SER C C 99 174.491 174.627 -0.136 1
1 1158 . 12 1 1 A 99 99 SER CA C 99 58.460 61.360 -2.900 1
1 1159 . 12 1 1 A 99 99 SER CB C 99 64.146 63.286 0.860 1
1 1160 . 12 1 1 A 99 99 SER N N 99 117.676 117.881 -0.205 1
1 1161 . 12 1 1 A 100 100 THR H H 100 8.411 7.784 0.627 1
1 1162 . 12 1 1 A 100 100 THR HA H 100 4.490 4.669 -0.179 1
1 1167 . 12 1 1 A 100 100 THR C C 100 172.766 173.186 -0.420 1
1 1168 . 12 1 1 A 100 100 THR CA C 100 60.629 58.745 1.884 1
1 1169 . 12 1 1 A 100 100 THR CB C 100 69.778 69.950 -0.172 1
1 1171 . 12 1 1 A 100 100 THR N N 100 118.401 111.655 6.746 1
1 1172 . 12 1 1 A 101 101 PRO HA H 101 4.631 4.928 -0.297 1
1 1179 . 12 1 1 A 101 101 PRO C C 101 177.227 176.292 0.935 1
1 1180 . 12 1 1 A 101 101 PRO CA C 101 63.097 62.172 0.925 1
1 1181 . 12 1 1 A 101 101 PRO CB C 101 32.917 32.372 0.545 1
1 1184 . 12 1 1 A 102 102 ALA H H 102 8.497 8.042 0.455 1
1 1185 . 12 1 1 A 102 102 ALA HA H 102 4.619 4.656 -0.037 1
1 1189 . 12 1 1 A 102 102 ALA C C 102 176.542 177.080 -0.538 1
1 1190 . 12 1 1 A 102 102 ALA CA C 102 51.390 52.130 -0.740 1
1 1191 . 12 1 1 A 102 102 ALA CB C 102 20.815 20.125 0.690 1
1 1192 . 12 1 1 A 102 102 ALA N N 102 124.487 122.946 1.541 1
1 1193 . 12 1 1 A 103 103 ARG H H 103 8.663 8.696 -0.033 1
1 1194 . 12 1 1 A 103 103 ARG HA H 103 5.515 5.174 0.341 1
1 1201 . 12 1 1 A 103 103 ARG C C 103 174.539 175.109 -0.570 1
1 1202 . 12 1 1 A 103 103 ARG CA C 103 55.164 54.491 0.673 1
1 1203 . 12 1 1 A 103 103 ARG CB C 103 34.393 33.007 1.386 1
1 1206 . 12 1 1 A 103 103 ARG N N 103 119.596 119.825 -0.229 1
1 1207 . 12 1 1 A 104 104 ALA H H 104 9.027 8.454 0.573 1
1 1208 . 12 1 1 A 104 104 ALA HA H 104 4.782 5.051 -0.269 1
1 1212 . 12 1 1 A 104 104 ALA C C 104 176.276 175.716 0.560 1
1 1213 . 12 1 1 A 104 104 ALA CA C 104 50.297 51.300 -1.003 1
1 1214 . 12 1 1 A 104 104 ALA CB C 104 20.810 21.157 -0.347 1
1 1215 . 12 1 1 A 104 104 ALA N N 104 126.962 123.847 3.115 1
1 1216 . 12 1 1 A 105 105 THR H H 105 8.384 8.650 -0.266 1
1 1217 . 12 1 1 A 105 105 THR HA H 105 4.954 4.596 0.358 1
1 1222 . 12 1 1 A 105 105 THR C C 105 173.243 174.296 -1.053 1
1 1223 . 12 1 1 A 105 105 THR CA C 105 61.475 62.595 -1.120 1
1 1224 . 12 1 1 A 105 105 THR CB C 105 70.569 69.910 0.659 1
1 1226 . 12 1 1 A 105 105 THR N N 105 115.327 118.258 -2.931 1
1 1227 . 12 1 1 A 106 106 VAL H H 106 8.970 8.525 0.445 1
1 1228 . 12 1 1 A 106 106 VAL HA H 106 4.702 4.644 0.058 1
1 1236 . 12 1 1 A 106 106 VAL C C 106 174.743 175.072 -0.329 1
1 1237 . 12 1 1 A 106 106 VAL CA C 106 59.712 61.286 -1.574 1
1 1238 . 12 1 1 A 106 106 VAL CB C 106 34.327 33.664 0.663 1
1 1241 . 12 1 1 A 106 106 VAL N N 106 126.226 126.658 -0.432 1
1 1242 . 12 1 1 A 107 107 THR H H 107 8.833 8.433 0.400 1
1 1243 . 12 1 1 A 107 107 THR HA H 107 4.862 4.615 0.247 1
1 1248 . 12 1 1 A 107 107 THR C C 107 172.970 173.973 -1.003 1
1 1249 . 12 1 1 A 107 107 THR CA C 107 62.322 62.385 -0.063 1
1 1250 . 12 1 1 A 107 107 THR CB C 107 69.463 69.224 0.239 1
1 1252 . 12 1 1 A 107 107 THR N N 107 125.403 122.474 2.929 1
1 1253 . 12 1 1 A 108 108 ILE H H 108 9.234 8.979 0.255 1
1 1254 . 12 1 1 A 108 108 ILE HA H 108 4.178 4.633 -0.455 1
1 1264 . 12 1 1 A 108 108 ILE C C 108 174.087 174.974 -0.887 1
1 1265 . 12 1 1 A 108 108 ILE CA C 108 60.365 60.438 -0.073 1
1 1266 . 12 1 1 A 108 108 ILE CB C 108 39.745 38.845 0.900 1
1 1270 . 12 1 1 A 108 108 ILE N N 108 127.152 128.518 -1.366 1
1 1271 . 12 1 1 A 109 109 ASN H H 109 8.723 9.041 -0.318 1
1 1272 . 12 1 1 A 109 109 ASN HA H 109 5.147 5.121 0.026 1
1 1277 . 12 1 1 A 109 109 ASN C C 109 173.592 174.680 -1.088 1
1 1278 . 12 1 1 A 109 109 ASN CA C 109 52.501 53.379 -0.878 1
1 1279 . 12 1 1 A 109 109 ASN CB C 109 40.791 39.544 1.247 1
1 1280 . 12 1 1 A 109 109 ASN N N 109 126.866 126.547 0.319 1
1 1282 . 12 1 1 A 110 110 VAL H H 110 9.046 9.248 -0.202 1
1 1283 . 12 1 1 A 110 110 VAL HA H 110 5.081 5.020 0.061 1
1 1291 . 12 1 1 A 110 110 VAL C C 110 176.921 175.818 1.103 1
1 1292 . 12 1 1 A 110 110 VAL CA C 110 61.634 61.300 0.334 1
1 1293 . 12 1 1 A 110 110 VAL CB C 110 31.809 33.334 -1.525 1
1 1296 . 12 1 1 A 110 110 VAL N N 110 126.070 123.272 2.798 1
1 1297 . 12 1 1 A 111 111 THR H H 111 9.197 8.788 0.409 1
1 1298 . 12 1 1 A 111 111 THR HA H 111 4.566 5.042 -0.476 1
1 1303 . 12 1 1 A 111 111 THR C C 111 174.087 174.472 -0.385 1
1 1304 . 12 1 1 A 111 111 THR CA C 111 61.145 59.649 1.496 1
1 1305 . 12 1 1 A 111 111 THR CB C 111 70.706 71.188 -0.482 1
1 1307 . 12 1 1 A 111 111 THR N N 111 121.425 117.856 3.569 1
1 1308 . 12 1 1 A 112 112 ASP H H 112 8.435 8.368 0.067 1
1 1309 . 12 1 1 A 112 112 ASP HA H 112 4.656 4.986 -0.330 1
1 1312 . 12 1 1 A 112 112 ASP C C 112 176.745 175.405 1.340 1
1 1313 . 12 1 1 A 112 112 ASP CA C 112 54.158 52.758 1.400 1
1 1314 . 12 1 1 A 112 112 ASP CB C 112 41.575 41.890 -0.315 1
1 1315 . 12 1 1 A 112 112 ASP N N 112 119.566 120.181 -0.615 1
1 1316 . 12 1 1 A 113 113 VAL H H 113 8.629 8.521 0.108 1
1 1317 . 12 1 1 A 113 113 VAL HA H 113 4.078 4.779 -0.701 1
1 1325 . 12 1 1 A 113 113 VAL C C 113 175.247 174.157 1.090 1
1 1326 . 12 1 1 A 113 113 VAL CA C 113 62.533 59.890 2.643 1
1 1327 . 12 1 1 A 113 113 VAL CB C 113 32.534 34.856 -2.322 1
1 1330 . 12 1 1 A 113 113 VAL N N 113 119.356 111.243 8.113 1
1 4 . 13 1 1 A 2 2 SER H H 2 8.289 8.419 -0.130 1
1 5 . 13 1 1 A 2 2 SER HA H 2 4.530 4.579 -0.049 1
1 7 . 13 1 1 A 2 2 SER C C 2 174.868 175.040 -0.172 1
1 8 . 13 1 1 A 2 2 SER CA C 2 58.284 58.458 -0.174 1
1 9 . 13 1 1 A 2 2 SER CB C 2 63.769 64.586 -0.817 1
1 10 . 13 1 1 A 2 2 SER N N 2 115.842 114.121 1.721 1
1 11 . 13 1 1 A 3 3 SER H H 3 8.490 7.863 0.627 1
1 12 . 13 1 1 A 3 3 SER HA H 3 4.496 4.215 0.281 1
1 14 . 13 1 1 A 3 3 SER C C 3 175.043 174.910 0.133 1
1 15 . 13 1 1 A 3 3 SER CA C 3 58.549 60.292 -1.743 1
1 16 . 13 1 1 A 3 3 SER CB C 3 63.687 63.579 0.108 1
1 17 . 13 1 1 A 3 3 SER N N 3 117.930 118.339 -0.409 1
1 18 . 13 1 1 A 4 4 GLY H H 4 8.482 8.606 -0.124 1
1 19 . 13 1 1 A 4 4 GLY C C 4 174.344 173.401 0.943 1
1 20 . 13 1 1 A 4 4 GLY CA C 4 45.536 45.786 -0.250 1
1 21 . 13 1 1 A 4 4 GLY N N 4 110.985 114.414 -3.429 1
1 22 . 13 1 1 A 6 6 SER HA H 6 4.508 4.798 -0.290 1
1 24 . 13 1 1 A 6 6 SER C C 6 175.026 174.535 0.491 1
1 25 . 13 1 1 A 6 6 SER CA C 6 58.584 57.844 0.740 1
1 26 . 13 1 1 A 6 6 SER CB C 6 63.646 64.326 -0.680 1
1 27 . 13 1 1 A 7 7 GLY H H 7 8.419 8.618 -0.199 1
1 28 . 13 1 1 A 7 7 GLY HA2 H 7 3.993 3.891 0.102 1
1 29 . 13 1 1 A 7 7 GLY C C 7 173.995 175.037 -1.042 1
1 30 . 13 1 1 A 7 7 GLY CA C 7 45.466 47.118 -1.652 1
1 31 . 13 1 1 A 7 7 GLY N N 7 110.615 111.439 -0.824 1
1 32 . 13 1 1 A 8 8 ASN H H 8 8.322 8.144 0.178 1
1 33 . 13 1 1 A 8 8 ASN HA H 8 4.736 5.006 -0.270 1
1 38 . 13 1 1 A 8 8 ASN C C 8 174.907 175.313 -0.406 1
1 39 . 13 1 1 A 8 8 ASN CA C 8 53.259 51.770 1.489 1
1 40 . 13 1 1 A 8 8 ASN CB C 8 39.127 38.436 0.691 1
1 41 . 13 1 1 A 8 8 ASN N N 8 118.602 118.468 0.134 1
1 43 . 13 1 1 A 9 9 ASP H H 9 8.370 7.845 0.525 1
1 44 . 13 1 1 A 9 9 ASP HA H 9 4.594 4.530 0.064 1
1 47 . 13 1 1 A 9 9 ASP C C 9 175.765 176.232 -0.467 1
1 48 . 13 1 1 A 9 9 ASP CA C 9 54.440 55.404 -0.964 1
1 49 . 13 1 1 A 9 9 ASP CB C 9 40.898 41.229 -0.331 1
1 50 . 13 1 1 A 9 9 ASP N N 9 120.504 121.352 -0.848 1
1 51 . 13 1 1 A 10 10 ASN H H 10 8.382 8.766 -0.384 1
1 52 . 13 1 1 A 10 10 ASN HA H 10 4.691 5.171 -0.480 1
1 57 . 13 1 1 A 10 10 ASN C C 10 174.383 173.293 1.090 1
1 58 . 13 1 1 A 10 10 ASN CA C 10 53.241 53.026 0.215 1
1 59 . 13 1 1 A 10 10 ASN CB C 10 38.674 42.963 -4.289 1
1 60 . 13 1 1 A 10 10 ASN N N 10 119.406 120.897 -1.491 1
1 62 . 13 1 1 A 11 11 ARG H H 11 7.942 8.497 -0.555 1
1 63 . 13 1 1 A 11 11 ARG HA H 11 4.684 4.745 -0.061 1
1 70 . 13 1 1 A 11 11 ARG C C 11 173.640 174.720 -1.080 1
1 71 . 13 1 1 A 11 11 ARG CA C 11 54.246 54.242 0.004 1
1 72 . 13 1 1 A 11 11 ARG CB C 11 30.337 30.864 -0.527 1
1 75 . 13 1 1 A 11 11 ARG N N 11 121.145 124.288 -3.143 1
1 76 . 13 1 1 A 12 12 PRO HA H 12 4.507 4.638 -0.131 1
1 83 . 13 1 1 A 12 12 PRO CA C 12 62.714 62.498 0.216 1
1 84 . 13 1 1 A 12 12 PRO CB C 12 31.942 32.447 -0.505 1
1 87 . 13 1 1 A 13 13 VAL H H 13 8.252 8.215 0.037 1
1 88 . 13 1 1 A 13 13 VAL HA H 13 4.159 4.829 -0.670 1
1 96 . 13 1 1 A 13 13 VAL CA C 13 61.409 59.384 2.025 1
1 97 . 13 1 1 A 13 13 VAL CB C 13 34.858 34.706 0.152 1
1 100 . 13 1 1 A 13 13 VAL N N 13 118.395 116.267 2.128 1
1 101 . 13 1 1 A 14 14 PHE H H 14 8.725 8.881 -0.156 1
1 102 . 13 1 1 A 14 14 PHE HA H 14 4.781 4.900 -0.119 1
1 110 . 13 1 1 A 14 14 PHE CA C 14 58.594 57.541 1.053 1
1 111 . 13 1 1 A 14 14 PHE CB C 14 39.594 40.930 -1.336 1
1 117 . 13 1 1 A 14 14 PHE N N 14 122.950 122.770 0.180 1
1 118 . 13 1 1 A 15 15 LYS H H 15 8.885 8.800 0.085 1
1 119 . 13 1 1 A 15 15 LYS HA H 15 4.130 4.175 -0.045 1
1 128 . 13 1 1 A 15 15 LYS C C 15 177.027 176.425 0.602 1
1 129 . 13 1 1 A 15 15 LYS CA C 15 58.478 59.121 -0.643 1
1 130 . 13 1 1 A 15 15 LYS CB C 15 32.748 32.245 0.503 1
1 134 . 13 1 1 A 15 15 LYS N N 15 123.863 122.801 1.062 1
1 135 . 13 1 1 A 16 16 GLU H H 16 8.091 8.020 0.071 1
1 136 . 13 1 1 A 16 16 GLU HA H 16 4.438 4.755 -0.317 1
1 141 . 13 1 1 A 16 16 GLU C C 16 175.947 176.495 -0.548 1
1 142 . 13 1 1 A 16 16 GLU CA C 16 56.045 54.975 1.070 1
1 143 . 13 1 1 A 16 16 GLU CB C 16 30.766 33.184 -2.418 1
1 145 . 13 1 1 A 16 16 GLU N N 16 117.026 118.423 -1.397 1
1 146 . 13 1 1 A 17 17 GLY H H 17 8.421 8.664 -0.243 1
1 147 . 13 1 1 A 17 17 GLY HA2 H 17 3.993 3.946 0.047 1
1 148 . 13 1 1 A 17 17 GLY HA3 H 17 3.913 3.993 -0.080 1
1 149 . 13 1 1 A 17 17 GLY C C 17 173.564 174.626 -1.062 1
1 150 . 13 1 1 A 17 17 GLY CA C 17 45.448 45.667 -0.219 1
1 151 . 13 1 1 A 17 17 GLY N N 17 109.577 110.989 -1.412 1
1 152 . 13 1 1 A 18 18 GLN H H 18 7.858 8.121 -0.263 1
1 153 . 13 1 1 A 18 18 GLN HA H 18 5.065 4.604 0.461 1
1 160 . 13 1 1 A 18 18 GLN C C 18 174.596 175.389 -0.793 1
1 161 . 13 1 1 A 18 18 GLN CA C 18 55.110 55.941 -0.831 1
1 162 . 13 1 1 A 18 18 GLN CB C 18 30.329 29.256 1.073 1
1 164 . 13 1 1 A 18 18 GLN N N 18 120.202 120.468 -0.266 1
1 166 . 13 1 1 A 19 19 VAL H H 19 8.216 8.629 -0.413 1
1 167 . 13 1 1 A 19 19 VAL HA H 19 4.450 4.560 -0.110 1
1 175 . 13 1 1 A 19 19 VAL C C 19 173.648 174.771 -1.123 1
1 176 . 13 1 1 A 19 19 VAL CA C 19 60.788 60.793 -0.005 1
1 177 . 13 1 1 A 19 19 VAL CB C 19 35.336 35.381 -0.045 1
1 180 . 13 1 1 A 19 19 VAL N N 19 121.257 124.288 -3.031 1
1 181 . 13 1 1 A 20 20 GLU H H 20 8.610 8.657 -0.047 1
1 182 . 13 1 1 A 20 20 GLU HA H 20 5.211 5.210 0.001 1
1 187 . 13 1 1 A 20 20 GLU C C 20 174.783 176.336 -1.553 1
1 188 . 13 1 1 A 20 20 GLU CA C 20 54.793 56.031 -1.238 1
1 189 . 13 1 1 A 20 20 GLU CB C 20 32.058 31.325 0.733 1
1 191 . 13 1 1 A 20 20 GLU N N 20 127.095 127.423 -0.328 1
1 192 . 13 1 1 A 21 21 VAL H H 21 8.727 8.639 0.088 1
1 193 . 13 1 1 A 21 21 VAL HA H 21 4.633 5.086 -0.453 1
1 201 . 13 1 1 A 21 21 VAL C C 21 173.894 174.569 -0.675 1
1 202 . 13 1 1 A 21 21 VAL CA C 21 59.695 59.136 0.559 1
1 203 . 13 1 1 A 21 21 VAL CB C 21 35.865 35.605 0.260 1
1 206 . 13 1 1 A 21 21 VAL N N 21 120.489 118.557 1.932 1
1 207 . 13 1 1 A 22 22 HIS H H 22 8.680 8.999 -0.319 1
1 208 . 13 1 1 A 22 22 HIS HA H 22 5.552 5.849 -0.297 1
1 212 . 13 1 1 A 22 22 HIS C C 22 174.298 173.636 0.662 1
1 213 . 13 1 1 A 22 22 HIS CA C 22 55.331 53.764 1.567 1
1 214 . 13 1 1 A 22 22 HIS CB C 22 32.369 32.238 0.131 1
1 216 . 13 1 1 A 22 22 HIS N N 22 124.991 118.646 6.345 1
1 217 . 13 1 1 A 23 23 ILE H H 23 9.179 8.841 0.338 1
1 218 . 13 1 1 A 23 23 ILE HA H 23 5.046 4.496 0.550 1
1 228 . 13 1 1 A 23 23 ILE C C 23 171.552 173.181 -1.629 1
1 229 . 13 1 1 A 23 23 ILE CA C 23 55.551 57.103 -1.552 1
1 230 . 13 1 1 A 23 23 ILE CB C 23 42.053 42.164 -0.111 1
1 234 . 13 1 1 A 23 23 ILE N N 23 123.121 123.531 -0.410 1
1 235 . 13 1 1 A 24 24 PRO HA H 24 4.816 4.843 -0.027 1
1 242 . 13 1 1 A 24 24 PRO C C 24 178.887 177.884 1.003 1
1 243 . 13 1 1 A 24 24 PRO CA C 24 62.216 62.755 -0.539 1
1 244 . 13 1 1 A 24 24 PRO CB C 24 32.895 32.515 0.380 1
1 247 . 13 1 1 A 25 25 GLU H H 25 8.399 8.377 0.022 1
1 248 . 13 1 1 A 25 25 GLU HA H 25 3.785 3.984 -0.199 1
1 253 . 13 1 1 A 25 25 GLU C C 25 175.244 177.108 -1.864 1
1 254 . 13 1 1 A 25 25 GLU CA C 25 58.425 59.111 -0.686 1
1 255 . 13 1 1 A 25 25 GLU CB C 25 30.011 29.012 0.999 1
1 257 . 13 1 1 A 25 25 GLU N N 25 117.706 122.484 -4.778 1
1 258 . 13 1 1 A 26 26 ASN H H 26 7.488 7.676 -0.188 1
1 259 . 13 1 1 A 26 26 ASN HA H 26 4.702 4.842 -0.140 1
1 264 . 13 1 1 A 26 26 ASN C C 26 175.425 175.087 0.338 1
1 265 . 13 1 1 A 26 26 ASN CA C 26 51.584 53.308 -1.724 1
1 266 . 13 1 1 A 26 26 ASN CB C 26 37.243 38.898 -1.655 1
1 267 . 13 1 1 A 26 26 ASN N N 26 112.383 116.460 -4.077 1
1 269 . 13 1 1 A 27 27 ALA H H 27 7.716 7.398 0.318 1
1 270 . 13 1 1 A 27 27 ALA HA H 27 4.409 4.314 0.095 1
1 274 . 13 1 1 A 27 27 ALA C C 27 175.850 175.855 -0.005 1
1 275 . 13 1 1 A 27 27 ALA CA C 27 51.037 50.941 0.096 1
1 276 . 13 1 1 A 27 27 ALA CB C 27 18.152 18.412 -0.260 1
1 277 . 13 1 1 A 27 27 ALA N N 27 125.139 123.388 1.751 1
1 278 . 13 1 1 A 28 28 PRO HA H 28 4.422 4.492 -0.070 1
1 285 . 13 1 1 A 28 28 PRO C C 28 178.442 176.765 1.677 1
1 286 . 13 1 1 A 28 28 PRO CA C 28 62.067 62.735 -0.668 1
1 287 . 13 1 1 A 28 28 PRO CB C 28 32.642 32.448 0.194 1
1 290 . 13 1 1 A 29 29 VAL H H 29 8.691 8.268 0.423 1
1 291 . 13 1 1 A 29 29 VAL HA H 29 3.239 3.557 -0.318 1
1 299 . 13 1 1 A 29 29 VAL C C 29 176.887 176.970 -0.083 1
1 300 . 13 1 1 A 29 29 VAL CA C 29 65.812 64.250 1.562 1
1 301 . 13 1 1 A 29 29 VAL CB C 29 31.174 31.153 0.021 1
1 304 . 13 1 1 A 29 29 VAL N N 29 123.592 122.723 0.869 1
1 305 . 13 1 1 A 30 30 GLY H H 30 9.197 8.533 0.664 1
1 306 . 13 1 1 A 30 30 GLY HA2 H 30 4.486 3.969 0.517 1
1 307 . 13 1 1 A 30 30 GLY HA3 H 30 3.581 3.969 -0.388 1
1 308 . 13 1 1 A 30 30 GLY C C 30 174.347 174.464 -0.117 1
1 309 . 13 1 1 A 30 30 GLY CA C 30 44.320 44.911 -0.591 1
1 310 . 13 1 1 A 30 30 GLY N N 30 116.042 115.115 0.927 1
1 311 . 13 1 1 A 31 31 THR H H 31 7.838 7.767 0.071 1
1 312 . 13 1 1 A 31 31 THR HA H 31 3.959 4.197 -0.238 1
1 317 . 13 1 1 A 31 31 THR C C 31 174.274 173.885 0.389 1
1 318 . 13 1 1 A 31 31 THR CA C 31 65.160 63.014 2.146 1
1 319 . 13 1 1 A 31 31 THR CB C 31 69.972 69.178 0.794 1
1 321 . 13 1 1 A 31 31 THR N N 31 117.679 117.760 -0.081 1
1 322 . 13 1 1 A 32 32 SER H H 32 9.022 8.721 0.301 1
1 323 . 13 1 1 A 32 32 SER HA H 32 4.273 4.645 -0.372 1
1 326 . 13 1 1 A 32 32 SER C C 32 172.692 174.402 -1.710 1
1 327 . 13 1 1 A 32 32 SER CA C 32 59.642 57.839 1.803 1
1 328 . 13 1 1 A 32 32 SER CB C 32 63.102 63.060 0.042 1
1 329 . 13 1 1 A 32 32 SER N N 32 123.045 120.421 2.624 1
1 330 . 13 1 1 A 33 33 VAL H H 33 9.202 8.859 0.343 1
1 331 . 13 1 1 A 33 33 VAL HA H 33 3.844 4.058 -0.214 1
1 339 . 13 1 1 A 33 33 VAL C C 33 174.782 175.752 -0.970 1
1 340 . 13 1 1 A 33 33 VAL CA C 33 64.242 64.091 0.151 1
1 341 . 13 1 1 A 33 33 VAL CB C 33 32.893 32.410 0.483 1
1 344 . 13 1 1 A 33 33 VAL N N 33 126.861 124.918 1.943 1
1 345 . 13 1 1 A 34 34 ILE H H 34 7.074 7.919 -0.845 1
1 346 . 13 1 1 A 34 34 ILE HA H 34 4.295 4.702 -0.407 1
1 356 . 13 1 1 A 34 34 ILE C C 34 170.577 173.301 -2.724 1
1 357 . 13 1 1 A 34 34 ILE CA C 34 59.500 59.269 0.231 1
1 358 . 13 1 1 A 34 34 ILE CB C 34 39.251 42.196 -2.945 1
1 362 . 13 1 1 A 34 34 ILE N N 34 111.445 118.749 -7.304 1
1 363 . 13 1 1 A 35 35 GLN H H 35 8.450 8.873 -0.423 1
1 364 . 13 1 1 A 35 35 GLN HA H 35 4.633 5.135 -0.502 1
1 371 . 13 1 1 A 35 35 GLN C C 35 174.354 174.168 0.186 1
1 372 . 13 1 1 A 35 35 GLN CA C 35 54.176 54.102 0.074 1
1 373 . 13 1 1 A 35 35 GLN CB C 35 29.456 32.261 -2.805 1
1 375 . 13 1 1 A 35 35 GLN N N 35 127.342 126.694 0.648 1
1 377 . 13 1 1 A 36 36 LEU H H 36 7.761 8.473 -0.712 1
1 378 . 13 1 1 A 36 36 LEU HA H 36 4.492 5.274 -0.782 1
1 388 . 13 1 1 A 36 36 LEU C C 36 175.543 175.058 0.485 1
1 389 . 13 1 1 A 36 36 LEU CA C 36 53.982 53.808 0.174 1
1 390 . 13 1 1 A 36 36 LEU CB C 36 42.776 44.093 -1.317 1
1 394 . 13 1 1 A 36 36 LEU N N 36 128.895 128.186 0.709 1
1 395 . 13 1 1 A 37 37 HIS H H 37 8.529 8.963 -0.434 1
1 396 . 13 1 1 A 37 37 HIS HA H 37 4.851 5.340 -0.489 1
1 400 . 13 1 1 A 37 37 HIS C C 37 172.985 173.421 -0.436 1
1 401 . 13 1 1 A 37 37 HIS CA C 37 55.833 53.594 2.239 1
1 402 . 13 1 1 A 37 37 HIS CB C 37 32.204 32.854 -0.650 1
1 404 . 13 1 1 A 37 37 HIS N N 37 115.903 124.504 -8.601 1
1 405 . 13 1 1 A 38 38 ALA H H 38 8.474 9.032 -0.558 1
1 406 . 13 1 1 A 38 38 ALA HA H 38 4.691 5.101 -0.410 1
1 410 . 13 1 1 A 38 38 ALA C C 38 175.548 176.498 -0.950 1
1 411 . 13 1 1 A 38 38 ALA CA C 38 50.491 50.706 -0.215 1
1 412 . 13 1 1 A 38 38 ALA CB C 38 19.842 19.889 -0.047 1
1 413 . 13 1 1 A 38 38 ALA N N 38 128.891 130.970 -2.079 1
1 414 . 13 1 1 A 39 39 THR H H 39 8.095 8.624 -0.529 1
1 415 . 13 1 1 A 39 39 THR HA H 39 4.336 4.944 -0.608 1
1 420 . 13 1 1 A 39 39 THR C C 39 173.553 174.091 -0.538 1
1 421 . 13 1 1 A 39 39 THR CA C 39 60.417 60.692 -0.275 1
1 422 . 13 1 1 A 39 39 THR CB C 39 70.912 69.880 1.032 1
1 424 . 13 1 1 A 39 39 THR N N 39 110.982 113.907 -2.925 1
1 425 . 13 1 1 A 40 40 ASP H H 40 8.417 9.138 -0.721 1
1 426 . 13 1 1 A 40 40 ASP HA H 40 4.553 4.668 -0.115 1
1 429 . 13 1 1 A 40 40 ASP C C 40 176.462 175.452 1.010 1
1 430 . 13 1 1 A 40 40 ASP CA C 40 54.158 56.163 -2.005 1
1 431 . 13 1 1 A 40 40 ASP CB C 40 41.517 41.400 0.117 1
1 432 . 13 1 1 A 40 40 ASP N N 40 121.450 124.536 -3.086 1
1 433 . 13 1 1 A 41 41 ALA H H 41 8.435 7.790 0.645 1
1 434 . 13 1 1 A 41 41 ALA HA H 41 4.129 4.511 -0.382 1
1 438 . 13 1 1 A 41 41 ALA C C 41 177.718 176.576 1.142 1
1 439 . 13 1 1 A 41 41 ALA CA C 41 53.436 51.614 1.822 1
1 440 . 13 1 1 A 41 41 ALA CB C 41 19.183 20.683 -1.500 1
1 441 . 13 1 1 A 41 41 ALA N N 41 124.607 118.590 6.017 1
1 442 . 13 1 1 A 42 42 ASP H H 42 8.310 8.531 -0.221 1
1 443 . 13 1 1 A 42 42 ASP HA H 42 4.588 4.733 -0.145 1
1 446 . 13 1 1 A 42 42 ASP C C 42 176.546 176.506 0.040 1
1 447 . 13 1 1 A 42 42 ASP CA C 42 54.599 56.680 -2.081 1
1 448 . 13 1 1 A 42 42 ASP CB C 42 41.146 42.254 -1.108 1
1 449 . 13 1 1 A 42 42 ASP N N 42 118.030 122.339 -4.309 1
1 450 . 13 1 1 A 43 43 ILE H H 43 8.000 7.934 0.066 1
1 451 . 13 1 1 A 43 43 ILE HA H 43 4.130 4.065 0.065 1
1 461 . 13 1 1 A 43 43 ILE C C 43 176.901 175.948 0.953 1
1 462 . 13 1 1 A 43 43 ILE CA C 43 61.740 61.829 -0.089 1
1 463 . 13 1 1 A 43 43 ILE CB C 43 38.491 37.700 0.791 1
1 467 . 13 1 1 A 43 43 ILE N N 43 119.301 118.207 1.094 1
1 468 . 13 1 1 A 44 44 GLY H H 44 8.448 7.975 0.473 1
1 469 . 13 1 1 A 44 44 GLY HA2 H 44 3.939 4.161 -0.222 1
1 470 . 13 1 1 A 44 44 GLY HA3 H 44 3.939 4.162 -0.223 1
1 471 . 13 1 1 A 44 44 GLY C C 44 174.393 172.933 1.460 1
1 472 . 13 1 1 A 44 44 GLY CA C 44 45.501 45.329 0.172 1
1 473 . 13 1 1 A 44 44 GLY N N 44 111.333 115.887 -4.554 1
1 474 . 13 1 1 A 45 45 SER H H 45 8.061 8.279 -0.218 1
1 475 . 13 1 1 A 45 45 SER HA H 45 4.416 5.049 -0.633 1
1 478 . 13 1 1 A 45 45 SER C C 45 174.480 173.359 1.121 1
1 479 . 13 1 1 A 45 45 SER CA C 45 58.478 57.419 1.059 1
1 480 . 13 1 1 A 45 45 SER CB C 45 63.943 66.268 -2.325 1
1 481 . 13 1 1 A 45 45 SER N N 45 115.551 118.130 -2.579 1
1 482 . 13 1 1 A 46 46 ASN H H 46 8.547 8.669 -0.122 1
1 483 . 13 1 1 A 46 46 ASN HA H 46 4.725 5.218 -0.493 1
1 488 . 13 1 1 A 46 46 ASN C C 46 175.031 174.612 0.419 1
1 489 . 13 1 1 A 46 46 ASN CA C 46 53.277 52.653 0.624 1
1 490 . 13 1 1 A 46 46 ASN CB C 46 38.798 41.875 -3.077 1
1 491 . 13 1 1 A 46 46 ASN N N 46 120.698 120.614 0.084 1
1 493 . 13 1 1 A 47 47 ALA H H 47 8.239 8.947 -0.708 1
1 494 . 13 1 1 A 47 47 ALA HA H 47 4.283 4.707 -0.424 1
1 498 . 13 1 1 A 47 47 ALA C C 47 177.240 175.887 1.353 1
1 499 . 13 1 1 A 47 47 ALA CA C 47 52.731 51.209 1.522 1
1 500 . 13 1 1 A 47 47 ALA CB C 47 19.594 20.657 -1.063 1
1 501 . 13 1 1 A 47 47 ALA N N 47 124.093 128.893 -4.800 1
1 502 . 13 1 1 A 48 48 GLU H H 48 8.376 8.577 -0.201 1
1 503 . 13 1 1 A 48 48 GLU HA H 48 4.264 4.734 -0.470 1
1 508 . 13 1 1 A 48 48 GLU C C 48 175.702 174.996 0.706 1
1 509 . 13 1 1 A 48 48 GLU CA C 48 55.992 55.405 0.587 1
1 510 . 13 1 1 A 48 48 GLU CB C 48 30.210 29.881 0.329 1
1 512 . 13 1 1 A 48 48 GLU N N 48 119.750 117.788 1.962 1
1 513 . 13 1 1 A 49 49 ILE H H 49 7.806 8.251 -0.445 1
1 514 . 13 1 1 A 49 49 ILE HA H 49 3.919 4.082 -0.163 1
1 524 . 13 1 1 A 49 49 ILE C C 49 175.894 175.132 0.762 1
1 525 . 13 1 1 A 49 49 ILE CA C 49 60.559 61.291 -0.732 1
1 526 . 13 1 1 A 49 49 ILE CB C 49 37.860 37.265 0.595 1
1 530 . 13 1 1 A 49 49 ILE N N 49 122.772 126.541 -3.769 1
1 531 . 13 1 1 A 50 50 ARG H H 50 8.247 8.381 -0.134 1
1 532 . 13 1 1 A 50 50 ARG HA H 50 4.999 4.550 0.449 1
1 539 . 13 1 1 A 50 50 ARG C C 50 174.603 174.692 -0.089 1
1 540 . 13 1 1 A 50 50 ARG CA C 50 53.189 54.900 -1.711 1
1 541 . 13 1 1 A 50 50 ARG CB C 50 33.152 32.472 0.680 1
1 544 . 13 1 1 A 50 50 ARG N N 50 126.912 127.442 -0.530 1
1 545 . 13 1 1 A 51 51 TYR H H 51 9.041 9.049 -0.008 1
1 546 . 13 1 1 A 51 51 TYR HA H 51 5.395 5.480 -0.085 1
1 553 . 13 1 1 A 51 51 TYR C C 51 175.555 176.007 -0.452 1
1 554 . 13 1 1 A 51 51 TYR CA C 51 56.909 56.560 0.349 1
1 555 . 13 1 1 A 51 51 TYR CB C 51 40.116 39.408 0.708 1
1 560 . 13 1 1 A 51 51 TYR N N 51 121.627 121.637 -0.010 1
1 561 . 13 1 1 A 52 52 ILE H H 52 8.850 8.750 0.100 1
1 562 . 13 1 1 A 52 52 ILE HA H 52 4.576 4.847 -0.271 1
1 572 . 13 1 1 A 52 52 ILE C C 52 175.371 175.926 -0.555 1
1 573 . 13 1 1 A 52 52 ILE CA C 52 59.624 59.049 0.575 1
1 574 . 13 1 1 A 52 52 ILE CB C 52 42.895 40.345 2.550 1
1 578 . 13 1 1 A 52 52 ILE N N 52 117.697 119.798 -2.101 1
1 579 . 13 1 1 A 53 53 PHE H H 53 8.748 8.784 -0.036 1
1 580 . 13 1 1 A 53 53 PHE HA H 53 5.132 4.762 0.370 1
1 588 . 13 1 1 A 53 53 PHE C C 53 178.146 176.461 1.685 1
1 589 . 13 1 1 A 53 53 PHE CA C 53 57.667 57.338 0.329 1
1 590 . 13 1 1 A 53 53 PHE CB C 53 39.614 39.685 -0.071 1
1 596 . 13 1 1 A 53 53 PHE N N 53 121.433 120.882 0.551 1
1 597 . 13 1 1 A 54 54 GLY H H 54 8.538 8.357 0.181 1
1 598 . 13 1 1 A 54 54 GLY HA2 H 54 4.074 4.111 -0.037 1
1 599 . 13 1 1 A 54 54 GLY HA3 H 54 3.840 4.115 -0.275 1
1 600 . 13 1 1 A 54 54 GLY C C 54 174.530 172.887 1.643 1
1 601 . 13 1 1 A 54 54 GLY CA C 54 44.884 44.416 0.468 1
1 602 . 13 1 1 A 54 54 GLY N N 54 106.444 110.284 -3.840 1
1 603 . 13 1 1 A 55 55 ALA H H 55 8.594 8.371 0.223 1
1 604 . 13 1 1 A 55 55 ALA HA H 55 4.172 4.778 -0.606 1
1 608 . 13 1 1 A 55 55 ALA C C 55 178.718 177.247 1.471 1
1 609 . 13 1 1 A 55 55 ALA CA C 55 54.423 50.808 3.615 1
1 610 . 13 1 1 A 55 55 ALA CB C 55 19.059 20.937 -1.878 1
1 611 . 13 1 1 A 55 55 ALA N N 55 123.470 121.873 1.597 1
1 612 . 13 1 1 A 56 56 GLN H H 56 8.727 8.767 -0.040 1
1 613 . 13 1 1 A 56 56 GLN HA H 56 4.367 3.801 0.566 1
1 620 . 13 1 1 A 56 56 GLN C C 56 176.134 174.834 1.300 1
1 621 . 13 1 1 A 56 56 GLN CA C 56 55.660 56.829 -1.169 1
1 622 . 13 1 1 A 56 56 GLN CB C 56 28.152 26.659 1.493 1
1 624 . 13 1 1 A 56 56 GLN N N 56 114.221 115.718 -1.497 1
1 626 . 13 1 1 A 57 57 VAL H H 57 7.204 7.854 -0.650 1
1 627 . 13 1 1 A 57 57 VAL HA H 57 3.889 4.110 -0.221 1
1 635 . 13 1 1 A 57 57 VAL C C 57 175.371 175.321 0.050 1
1 636 . 13 1 1 A 57 57 VAL CA C 57 63.908 61.826 2.082 1
1 637 . 13 1 1 A 57 57 VAL CB C 57 31.557 32.447 -0.890 1
1 640 . 13 1 1 A 57 57 VAL N N 57 121.341 120.053 1.288 1
1 641 . 13 1 1 A 58 58 ALA H H 58 8.920 8.611 0.309 1
1 642 . 13 1 1 A 58 58 ALA HA H 58 4.547 4.427 0.120 1
1 646 . 13 1 1 A 58 58 ALA C C 58 177.064 177.669 -0.605 1
1 647 . 13 1 1 A 58 58 ALA CA C 58 51.173 50.785 0.388 1
1 648 . 13 1 1 A 58 58 ALA CB C 58 17.842 17.841 0.001 1
1 649 . 13 1 1 A 58 58 ALA N N 58 132.726 130.799 1.927 1
1 650 . 13 1 1 A 59 59 PRO HA H 59 4.101 4.238 -0.137 1
1 657 . 13 1 1 A 59 59 PRO C C 59 179.482 178.482 1.000 1
1 658 . 13 1 1 A 59 59 PRO CA C 59 66.060 65.808 0.252 1
1 659 . 13 1 1 A 59 59 PRO CB C 59 31.951 31.606 0.345 1
1 662 . 13 1 1 A 60 60 ALA H H 60 8.706 8.242 0.464 1
1 663 . 13 1 1 A 60 60 ALA HA H 60 4.057 3.990 0.067 1
1 667 . 13 1 1 A 60 60 ALA C C 60 179.627 180.103 -0.476 1
1 668 . 13 1 1 A 60 60 ALA CA C 60 55.305 55.268 0.037 1
1 669 . 13 1 1 A 60 60 ALA CB C 60 18.737 18.280 0.457 1
1 670 . 13 1 1 A 60 60 ALA N N 60 117.882 118.357 -0.475 1
1 671 . 13 1 1 A 61 61 THR H H 61 7.312 7.741 -0.429 1
1 672 . 13 1 1 A 61 61 THR HA H 61 4.153 4.012 0.141 1
1 677 . 13 1 1 A 61 61 THR C C 61 175.824 176.759 -0.935 1
1 678 . 13 1 1 A 61 61 THR CA C 61 66.412 66.308 0.104 1
1 679 . 13 1 1 A 61 61 THR CB C 61 68.787 68.244 0.543 1
1 681 . 13 1 1 A 61 61 THR N N 61 114.483 114.151 0.332 1
1 682 . 13 1 1 A 62 62 LYS H H 62 7.556 7.829 -0.273 1
1 683 . 13 1 1 A 62 62 LYS HA H 62 3.943 3.959 -0.016 1
1 692 . 13 1 1 A 62 62 LYS C C 62 176.884 179.241 -2.357 1
1 693 . 13 1 1 A 62 62 LYS CA C 62 59.095 59.080 0.015 1
1 694 . 13 1 1 A 62 62 LYS CB C 62 32.204 31.744 0.460 1
1 698 . 13 1 1 A 62 62 LYS N N 62 118.994 119.532 -0.538 1
1 699 . 13 1 1 A 63 63 ARG H H 63 7.474 8.063 -0.589 1
1 700 . 13 1 1 A 63 63 ARG HA H 63 4.034 4.067 -0.033 1
1 707 . 13 1 1 A 63 63 ARG C C 63 177.574 178.497 -0.923 1
1 708 . 13 1 1 A 63 63 ARG CA C 63 58.143 59.089 -0.946 1
1 709 . 13 1 1 A 63 63 ARG CB C 63 30.755 30.238 0.517 1
1 712 . 13 1 1 A 63 63 ARG N N 63 114.251 120.319 -6.068 1
1 713 . 13 1 1 A 64 64 LEU H H 64 6.991 8.066 -1.075 1
1 714 . 13 1 1 A 64 64 LEU HA H 64 3.904 3.843 0.061 1
1 724 . 13 1 1 A 64 64 LEU C C 64 176.632 177.395 -0.763 1
1 725 . 13 1 1 A 64 64 LEU CA C 64 56.503 58.224 -1.721 1
1 726 . 13 1 1 A 64 64 LEU CB C 64 42.929 41.651 1.278 1
1 730 . 13 1 1 A 64 64 LEU N N 64 116.109 120.019 -3.910 1
1 731 . 13 1 1 A 65 65 PHE H H 65 7.673 7.858 -0.185 1
1 732 . 13 1 1 A 65 65 PHE HA H 65 5.386 4.847 0.539 1
1 740 . 13 1 1 A 65 65 PHE C C 65 173.067 175.449 -2.382 1
1 741 . 13 1 1 A 65 65 PHE CA C 65 56.521 57.502 -0.981 1
1 742 . 13 1 1 A 65 65 PHE CB C 65 41.270 40.799 0.471 1
1 748 . 13 1 1 A 65 65 PHE N N 65 116.182 115.108 1.074 1
1 749 . 13 1 1 A 66 66 ALA H H 66 8.914 9.117 -0.203 1
1 750 . 13 1 1 A 66 66 ALA HA H 66 4.748 5.209 -0.461 1
1 754 . 13 1 1 A 66 66 ALA C C 66 175.223 175.198 0.025 1
1 755 . 13 1 1 A 66 66 ALA CA C 66 50.050 51.171 -1.121 1
1 756 . 13 1 1 A 66 66 ALA CB C 66 21.161 21.327 -0.166 1
1 757 . 13 1 1 A 66 66 ALA N N 66 122.870 122.779 0.091 1
1 758 . 13 1 1 A 67 67 LEU H H 67 8.498 9.010 -0.512 1
1 759 . 13 1 1 A 67 67 LEU HA H 67 4.713 4.983 -0.270 1
1 769 . 13 1 1 A 67 67 LEU C C 67 175.146 174.651 0.495 1
1 770 . 13 1 1 A 67 67 LEU CA C 67 52.518 53.805 -1.287 1
1 771 . 13 1 1 A 67 67 LEU CB C 67 45.308 44.488 0.820 1
1 775 . 13 1 1 A 67 67 LEU N N 67 122.208 126.637 -4.429 1
1 776 . 13 1 1 A 68 68 ASN H H 68 8.357 8.991 -0.634 1
1 777 . 13 1 1 A 68 68 ASN HA H 68 4.679 5.160 -0.481 1
1 782 . 13 1 1 A 68 68 ASN C C 68 176.228 175.108 1.120 1
1 783 . 13 1 1 A 68 68 ASN CA C 68 53.524 52.233 1.291 1
1 784 . 13 1 1 A 68 68 ASN CB C 68 39.580 40.532 -0.952 1
1 785 . 13 1 1 A 68 68 ASN N N 68 126.940 124.210 2.730 1
1 787 . 13 1 1 A 69 69 ASN H H 69 8.861 9.143 -0.282 1
1 788 . 13 1 1 A 69 69 ASN HA H 69 5.137 5.058 0.079 1
1 793 . 13 1 1 A 69 69 ASN C C 69 175.631 176.407 -0.776 1
1 794 . 13 1 1 A 69 69 ASN CA C 69 56.009 53.800 2.209 1
1 795 . 13 1 1 A 69 69 ASN CB C 69 40.314 38.991 1.323 1
1 796 . 13 1 1 A 69 69 ASN N N 69 124.980 123.675 1.305 1
1 798 . 13 1 1 A 70 70 THR H H 70 8.635 7.864 0.771 1
1 799 . 13 1 1 A 70 70 THR HA H 70 4.815 4.611 0.204 1
1 804 . 13 1 1 A 70 70 THR C C 70 176.223 175.606 0.617 1
1 805 . 13 1 1 A 70 70 THR CA C 70 63.944 62.436 1.508 1
1 806 . 13 1 1 A 70 70 THR CB C 70 69.727 70.332 -0.605 1
1 808 . 13 1 1 A 70 70 THR N N 70 110.394 109.589 0.805 1
1 809 . 13 1 1 A 71 71 THR H H 71 8.069 7.889 0.180 1
1 810 . 13 1 1 A 71 71 THR HA H 71 4.566 4.605 -0.039 1
1 815 . 13 1 1 A 71 71 THR C C 71 176.213 175.337 0.876 1
1 816 . 13 1 1 A 71 71 THR CA C 71 61.683 61.885 -0.202 1
1 817 . 13 1 1 A 71 71 THR CB C 71 70.832 71.099 -0.267 1
1 819 . 13 1 1 A 71 71 THR N N 71 110.507 110.503 0.004 1
1 820 . 13 1 1 A 72 72 GLY H H 72 7.990 7.946 0.044 1
1 821 . 13 1 1 A 72 72 GLY HA2 H 72 3.186 3.086 0.100 1
1 822 . 13 1 1 A 72 72 GLY HA3 H 72 2.516 3.607 -1.091 1
1 823 . 13 1 1 A 72 72 GLY C C 72 172.988 174.211 -1.223 1
1 824 . 13 1 1 A 72 72 GLY CA C 72 45.149 46.472 -1.323 1
1 825 . 13 1 1 A 72 72 GLY N N 72 110.788 112.489 -1.701 1
1 826 . 13 1 1 A 73 73 LEU H H 73 7.138 7.627 -0.489 1
1 827 . 13 1 1 A 73 73 LEU HA H 73 4.414 4.693 -0.279 1
1 837 . 13 1 1 A 73 73 LEU C C 73 176.836 174.985 1.851 1
1 838 . 13 1 1 A 73 73 LEU CA C 73 55.252 53.585 1.667 1
1 839 . 13 1 1 A 73 73 LEU CB C 73 43.574 45.242 -1.668 1
1 843 . 13 1 1 A 73 73 LEU N N 73 119.222 120.820 -1.598 1
1 844 . 13 1 1 A 74 74 ILE H H 74 8.925 8.554 0.371 1
1 845 . 13 1 1 A 74 74 ILE HA H 74 5.555 4.656 0.899 1
1 855 . 13 1 1 A 74 74 ILE C C 74 175.978 175.721 0.257 1
1 856 . 13 1 1 A 74 74 ILE CA C 74 60.100 61.262 -1.162 1
1 857 . 13 1 1 A 74 74 ILE CB C 74 38.550 37.902 0.648 1
1 861 . 13 1 1 A 74 74 ILE N N 74 129.871 128.595 1.276 1
1 862 . 13 1 1 A 75 75 THR H H 75 9.161 8.839 0.322 1
1 863 . 13 1 1 A 75 75 THR HA H 75 5.375 5.563 -0.188 1
1 868 . 13 1 1 A 75 75 THR C C 75 174.798 173.712 1.086 1
1 869 . 13 1 1 A 75 75 THR CA C 75 58.796 59.385 -0.589 1
1 870 . 13 1 1 A 75 75 THR CB C 75 72.978 71.904 1.074 1
1 872 . 13 1 1 A 75 75 THR N N 75 117.522 117.944 -0.422 1
1 873 . 13 1 1 A 76 76 VAL H H 76 8.327 8.506 -0.179 1
1 874 . 13 1 1 A 76 76 VAL HA H 76 3.973 3.609 0.364 1
1 882 . 13 1 1 A 76 76 VAL C C 76 176.495 175.825 0.670 1
1 883 . 13 1 1 A 76 76 VAL CA C 76 64.085 63.737 0.348 1
1 884 . 13 1 1 A 76 76 VAL CB C 76 32.863 32.161 0.702 1
1 887 . 13 1 1 A 76 76 VAL N N 76 120.876 122.104 -1.228 1
1 888 . 13 1 1 A 77 77 GLN H H 77 9.525 8.955 0.570 1
1 889 . 13 1 1 A 77 77 GLN HA H 77 4.702 4.456 0.246 1
1 896 . 13 1 1 A 77 77 GLN C C 77 173.838 174.813 -0.975 1
1 897 . 13 1 1 A 77 77 GLN CA C 77 55.728 56.650 -0.922 1
1 898 . 13 1 1 A 77 77 GLN CB C 77 30.762 31.050 -0.288 1
1 900 . 13 1 1 A 77 77 GLN N N 77 129.825 127.458 2.367 1
1 902 . 13 1 1 A 78 78 ARG H H 78 7.621 7.468 0.153 1
1 903 . 13 1 1 A 78 78 ARG HA H 78 4.347 4.750 -0.403 1
1 910 . 13 1 1 A 78 78 ARG C C 78 172.304 174.657 -2.353 1
1 911 . 13 1 1 A 78 78 ARG CA C 78 54.634 54.152 0.482 1
1 912 . 13 1 1 A 78 78 ARG CB C 78 34.685 34.654 0.031 1
1 915 . 13 1 1 A 78 78 ARG N N 78 120.595 117.617 2.978 1
1 916 . 13 1 1 A 79 79 SER H H 79 7.958 8.459 -0.501 1
1 917 . 13 1 1 A 79 79 SER HA H 79 4.030 4.317 -0.287 1
1 920 . 13 1 1 A 79 79 SER C C 79 174.311 174.551 -0.240 1
1 921 . 13 1 1 A 79 79 SER CA C 79 59.889 58.935 0.954 1
1 922 . 13 1 1 A 79 79 SER CB C 79 63.548 63.273 0.275 1
1 923 . 13 1 1 A 79 79 SER N N 79 112.565 118.206 -5.641 1
1 924 . 13 1 1 A 80 80 LEU H H 80 8.715 7.991 0.724 1
1 925 . 13 1 1 A 80 80 LEU HA H 80 4.114 4.842 -0.728 1
1 935 . 13 1 1 A 80 80 LEU C C 80 176.057 175.866 0.191 1
1 936 . 13 1 1 A 80 80 LEU CA C 80 55.091 53.634 1.457 1
1 937 . 13 1 1 A 80 80 LEU CB C 80 42.341 43.837 -1.496 1
1 941 . 13 1 1 A 80 80 LEU N N 80 123.070 125.588 -2.518 1
1 942 . 13 1 1 A 81 81 ASP H H 81 7.298 8.804 -1.506 1
1 943 . 13 1 1 A 81 81 ASP HA H 81 4.725 5.383 -0.658 1
1 946 . 13 1 1 A 81 81 ASP C C 81 175.939 176.119 -0.180 1
1 947 . 13 1 1 A 81 81 ASP CA C 81 53.664 52.890 0.774 1
1 948 . 13 1 1 A 81 81 ASP CB C 81 42.947 43.026 -0.079 1
1 949 . 13 1 1 A 81 81 ASP N N 81 115.229 121.051 -5.822 1
1 950 . 13 1 1 A 82 82 ARG H H 82 9.289 8.751 0.538 1
1 951 . 13 1 1 A 82 82 ARG HA H 82 4.416 4.202 0.214 1
1 959 . 13 1 1 A 82 82 ARG C C 82 176.406 178.013 -1.607 1
1 960 . 13 1 1 A 82 82 ARG CA C 82 56.397 59.139 -2.742 1
1 961 . 13 1 1 A 82 82 ARG CB C 82 30.638 29.934 0.704 1
1 964 . 13 1 1 A 82 82 ARG N N 82 123.174 126.682 -3.508 1
1 966 . 13 1 1 A 83 83 GLU H H 83 8.468 8.204 0.264 1
1 967 . 13 1 1 A 83 83 GLU HA H 83 3.982 4.004 -0.022 1
1 972 . 13 1 1 A 83 83 GLU C C 83 177.740 178.655 -0.915 1
1 973 . 13 1 1 A 83 83 GLU CA C 83 58.425 59.611 -1.186 1
1 974 . 13 1 1 A 83 83 GLU CB C 83 29.701 29.287 0.414 1
1 976 . 13 1 1 A 83 83 GLU N N 83 119.549 118.097 1.452 1
1 977 . 13 1 1 A 84 84 GLU H H 84 8.033 7.717 0.316 1
1 978 . 13 1 1 A 84 84 GLU HA H 84 4.206 4.179 0.027 1
1 983 . 13 1 1 A 84 84 GLU C C 84 176.837 176.143 0.694 1
1 984 . 13 1 1 A 84 84 GLU CA C 84 58.056 58.422 -0.366 1
1 985 . 13 1 1 A 84 84 GLU CB C 84 30.432 31.017 -0.585 1
1 987 . 13 1 1 A 84 84 GLU N N 84 118.333 119.157 -0.824 1
1 988 . 13 1 1 A 85 85 THR H H 85 7.651 7.316 0.335 1
1 989 . 13 1 1 A 85 85 THR HA H 85 4.307 4.545 -0.238 1
1 994 . 13 1 1 A 85 85 THR C C 85 171.568 173.955 -2.387 1
1 995 . 13 1 1 A 85 85 THR CA C 85 61.387 60.223 1.164 1
1 996 . 13 1 1 A 85 85 THR CB C 85 69.963 71.158 -1.195 1
1 998 . 13 1 1 A 85 85 THR N N 85 112.444 112.184 0.260 1
1 999 . 13 1 1 A 86 86 ALA H H 86 8.639 8.474 0.165 1
1 1000 . 13 1 1 A 86 86 ALA HA H 86 4.603 4.328 0.275 1
1 1004 . 13 1 1 A 86 86 ALA C C 86 175.560 177.188 -1.628 1
1 1005 . 13 1 1 A 86 86 ALA CA C 86 52.156 52.983 -0.827 1
1 1006 . 13 1 1 A 86 86 ALA CB C 86 20.378 20.164 0.214 1
1 1007 . 13 1 1 A 86 86 ALA N N 86 127.705 127.500 0.205 1
1 1008 . 13 1 1 A 87 87 ILE H H 87 7.663 7.704 -0.041 1
1 1009 . 13 1 1 A 87 87 ILE HA H 87 4.828 4.662 0.166 1
1 1019 . 13 1 1 A 87 87 ILE C C 87 174.537 174.482 0.055 1
1 1020 . 13 1 1 A 87 87 ILE CA C 87 60.329 60.370 -0.041 1
1 1021 . 13 1 1 A 87 87 ILE CB C 87 41.090 40.421 0.669 1
1 1025 . 13 1 1 A 87 87 ILE N N 87 118.712 117.690 1.022 1
1 1026 . 13 1 1 A 88 88 HIS H H 88 9.098 8.788 0.310 1
1 1027 . 13 1 1 A 88 88 HIS HA H 88 4.576 5.031 -0.455 1
1 1032 . 13 1 1 A 88 88 HIS C C 88 174.354 174.263 0.091 1
1 1033 . 13 1 1 A 88 88 HIS CA C 88 54.740 54.757 -0.017 1
1 1034 . 13 1 1 A 88 88 HIS CB C 88 33.955 31.114 2.841 1
1 1037 . 13 1 1 A 88 88 HIS N N 88 126.285 126.078 0.207 1
1 1038 . 13 1 1 A 89 89 LYS H H 89 8.957 9.027 -0.070 1
1 1039 . 13 1 1 A 89 89 LYS HA H 89 4.873 4.614 0.259 1
1 1048 . 13 1 1 A 89 89 LYS C C 89 175.906 175.272 0.634 1
1 1049 . 13 1 1 A 89 89 LYS CA C 89 55.269 55.435 -0.166 1
1 1050 . 13 1 1 A 89 89 LYS CB C 89 32.945 32.797 0.148 1
1 1054 . 13 1 1 A 89 89 LYS N N 89 124.332 124.843 -0.511 1
1 1055 . 13 1 1 A 90 90 VAL H H 90 9.174 8.633 0.541 1
1 1056 . 13 1 1 A 90 90 VAL HA H 90 4.227 4.867 -0.640 1
1 1064 . 13 1 1 A 90 90 VAL C C 90 174.168 174.703 -0.535 1
1 1065 . 13 1 1 A 90 90 VAL CA C 90 61.369 61.225 0.144 1
1 1066 . 13 1 1 A 90 90 VAL CB C 90 34.082 34.153 -0.071 1
1 1069 . 13 1 1 A 90 90 VAL N N 90 124.319 125.521 -1.202 1
1 1070 . 13 1 1 A 91 91 THR H H 91 6.697 9.028 -2.331 1
1 1071 . 13 1 1 A 91 91 THR HA H 91 5.163 5.131 0.032 1
1 1076 . 13 1 1 A 91 91 THR C C 91 173.812 173.844 -0.032 1
1 1077 . 13 1 1 A 91 91 THR CA C 91 61.935 61.743 0.192 1
1 1078 . 13 1 1 A 91 91 THR CB C 91 70.412 70.190 0.222 1
1 1080 . 13 1 1 A 91 91 THR N N 91 122.637 124.503 -1.866 1
1 1081 . 13 1 1 A 92 92 VAL H H 92 9.292 8.702 0.590 1
1 1082 . 13 1 1 A 92 92 VAL HA H 92 4.736 4.519 0.217 1
1 1090 . 13 1 1 A 92 92 VAL C C 92 173.160 174.957 -1.797 1
1 1091 . 13 1 1 A 92 92 VAL CA C 92 60.982 61.115 -0.133 1
1 1092 . 13 1 1 A 92 92 VAL CB C 92 35.130 33.806 1.324 1
1 1095 . 13 1 1 A 92 92 VAL N N 92 128.265 127.888 0.377 1
1 1096 . 13 1 1 A 93 93 LEU H H 93 9.495 8.647 0.848 1
1 1097 . 13 1 1 A 93 93 LEU HA H 93 5.628 5.707 -0.079 1
1 1107 . 13 1 1 A 93 93 LEU C C 93 176.274 176.139 0.135 1
1 1108 . 13 1 1 A 93 93 LEU CA C 93 52.773 53.722 -0.949 1
1 1109 . 13 1 1 A 93 93 LEU CB C 93 43.454 44.976 -1.522 1
1 1113 . 13 1 1 A 93 93 LEU N N 93 126.350 126.660 -0.310 1
1 1114 . 13 1 1 A 94 94 ALA H H 94 8.688 9.088 -0.400 1
1 1115 . 13 1 1 A 94 94 ALA HA H 94 4.986 5.031 -0.045 1
1 1119 . 13 1 1 A 94 94 ALA C C 94 175.787 175.391 0.396 1
1 1120 . 13 1 1 A 94 94 ALA CA C 94 49.610 50.460 -0.850 1
1 1121 . 13 1 1 A 94 94 ALA CB C 94 21.463 20.261 1.202 1
1 1122 . 13 1 1 A 94 94 ALA N N 94 123.429 126.466 -3.037 1
1 1123 . 13 1 1 A 95 95 SER H H 95 8.401 8.368 0.033 1
1 1124 . 13 1 1 A 95 95 SER HA H 95 4.828 4.910 -0.082 1
1 1127 . 13 1 1 A 95 95 SER C C 95 174.327 174.397 -0.070 1
1 1128 . 13 1 1 A 95 95 SER CA C 95 56.239 56.517 -0.278 1
1 1129 . 13 1 1 A 95 95 SER CB C 95 65.561 64.378 1.183 1
1 1130 . 13 1 1 A 95 95 SER N N 95 114.418 118.808 -4.390 1
1 1131 . 13 1 1 A 96 96 ASP H H 96 8.690 8.672 0.018 1
1 1132 . 13 1 1 A 96 96 ASP HA H 96 4.908 4.875 0.033 1
1 1135 . 13 1 1 A 96 96 ASP C C 96 177.096 176.375 0.721 1
1 1136 . 13 1 1 A 96 96 ASP CA C 96 52.818 52.867 -0.049 1
1 1137 . 13 1 1 A 96 96 ASP CB C 96 41.253 40.399 0.854 1
1 1138 . 13 1 1 A 96 96 ASP N N 96 125.624 124.656 0.968 1
1 1139 . 13 1 1 A 97 97 GLY H H 97 8.524 8.574 -0.050 1
1 1140 . 13 1 1 A 97 97 GLY HA2 H 97 4.320 3.932 0.388 1
1 1141 . 13 1 1 A 97 97 GLY HA3 H 97 3.620 3.933 -0.313 1
1 1142 . 13 1 1 A 97 97 GLY C C 97 174.620 173.784 0.836 1
1 1143 . 13 1 1 A 97 97 GLY CA C 97 45.422 46.072 -0.650 1
1 1144 . 13 1 1 A 97 97 GLY N N 97 109.283 109.969 -0.686 1
1 1145 . 13 1 1 A 98 98 SER H H 98 8.575 7.800 0.775 1
1 1146 . 13 1 1 A 98 98 SER HA H 98 4.607 4.963 -0.356 1
1 1149 . 13 1 1 A 98 98 SER C C 98 174.478 174.585 -0.107 1
1 1150 . 13 1 1 A 98 98 SER CA C 98 59.095 55.822 3.273 1
1 1151 . 13 1 1 A 98 98 SER CB C 98 64.800 67.169 -2.369 1
1 1152 . 13 1 1 A 98 98 SER N N 98 116.640 112.416 4.224 1
1 1153 . 13 1 1 A 99 99 SER H H 99 8.945 8.584 0.361 1
1 1154 . 13 1 1 A 99 99 SER HA H 99 4.530 4.161 0.369 1
1 1157 . 13 1 1 A 99 99 SER C C 99 174.491 175.014 -0.523 1
1 1158 . 13 1 1 A 99 99 SER CA C 99 58.460 62.449 -3.989 1
1 1159 . 13 1 1 A 99 99 SER CB C 99 64.146 63.253 0.893 1
1 1160 . 13 1 1 A 99 99 SER N N 99 117.676 118.316 -0.640 1
1 1161 . 13 1 1 A 100 100 THR H H 100 8.411 7.967 0.444 1
1 1162 . 13 1 1 A 100 100 THR HA H 100 4.490 4.848 -0.358 1
1 1167 . 13 1 1 A 100 100 THR C C 100 172.766 172.173 0.593 1
1 1168 . 13 1 1 A 100 100 THR CA C 100 60.629 59.147 1.482 1
1 1169 . 13 1 1 A 100 100 THR CB C 100 69.778 71.614 -1.836 1
1 1171 . 13 1 1 A 100 100 THR N N 100 118.401 113.172 5.229 1
1 1172 . 13 1 1 A 101 101 PRO HA H 101 4.631 4.919 -0.288 1
1 1179 . 13 1 1 A 101 101 PRO C C 101 177.227 176.337 0.890 1
1 1180 . 13 1 1 A 101 101 PRO CA C 101 63.097 62.232 0.865 1
1 1181 . 13 1 1 A 101 101 PRO CB C 101 32.917 32.651 0.266 1
1 1184 . 13 1 1 A 102 102 ALA H H 102 8.497 8.150 0.347 1
1 1185 . 13 1 1 A 102 102 ALA HA H 102 4.619 4.612 0.007 1
1 1189 . 13 1 1 A 102 102 ALA C C 102 176.542 177.132 -0.590 1
1 1190 . 13 1 1 A 102 102 ALA CA C 102 51.390 51.870 -0.480 1
1 1191 . 13 1 1 A 102 102 ALA CB C 102 20.815 20.352 0.463 1
1 1192 . 13 1 1 A 102 102 ALA N N 102 124.487 122.780 1.707 1
1 1193 . 13 1 1 A 103 103 ARG H H 103 8.663 8.613 0.050 1
1 1194 . 13 1 1 A 103 103 ARG HA H 103 5.515 5.248 0.267 1
1 1201 . 13 1 1 A 103 103 ARG C C 103 174.539 174.519 0.020 1
1 1202 . 13 1 1 A 103 103 ARG CA C 103 55.164 54.179 0.985 1
1 1203 . 13 1 1 A 103 103 ARG CB C 103 34.393 33.056 1.337 1
1 1206 . 13 1 1 A 103 103 ARG N N 103 119.596 118.280 1.316 1
1 1207 . 13 1 1 A 104 104 ALA H H 104 9.027 8.278 0.749 1
1 1208 . 13 1 1 A 104 104 ALA HA H 104 4.782 4.957 -0.175 1
1 1212 . 13 1 1 A 104 104 ALA C C 104 176.276 175.305 0.971 1
1 1213 . 13 1 1 A 104 104 ALA CA C 104 50.297 50.643 -0.346 1
1 1214 . 13 1 1 A 104 104 ALA CB C 104 20.810 21.074 -0.264 1
1 1215 . 13 1 1 A 104 104 ALA N N 104 126.962 125.642 1.320 1
1 1216 . 13 1 1 A 105 105 THR H H 105 8.384 8.610 -0.226 1
1 1217 . 13 1 1 A 105 105 THR HA H 105 4.954 4.635 0.319 1
1 1222 . 13 1 1 A 105 105 THR C C 105 173.243 174.187 -0.944 1
1 1223 . 13 1 1 A 105 105 THR CA C 105 61.475 62.273 -0.798 1
1 1224 . 13 1 1 A 105 105 THR CB C 105 70.569 70.104 0.465 1
1 1226 . 13 1 1 A 105 105 THR N N 105 115.327 118.493 -3.166 1
1 1227 . 13 1 1 A 106 106 VAL H H 106 8.970 8.582 0.388 1
1 1228 . 13 1 1 A 106 106 VAL HA H 106 4.702 4.608 0.094 1
1 1236 . 13 1 1 A 106 106 VAL C C 106 174.743 175.247 -0.504 1
1 1237 . 13 1 1 A 106 106 VAL CA C 106 59.712 61.421 -1.709 1
1 1238 . 13 1 1 A 106 106 VAL CB C 106 34.327 33.314 1.013 1
1 1241 . 13 1 1 A 106 106 VAL N N 106 126.226 126.973 -0.747 1
1 1242 . 13 1 1 A 107 107 THR H H 107 8.833 8.605 0.228 1
1 1243 . 13 1 1 A 107 107 THR HA H 107 4.862 4.527 0.335 1
1 1248 . 13 1 1 A 107 107 THR C C 107 172.970 174.112 -1.142 1
1 1249 . 13 1 1 A 107 107 THR CA C 107 62.322 62.758 -0.436 1
1 1250 . 13 1 1 A 107 107 THR CB C 107 69.463 69.099 0.364 1
1 1252 . 13 1 1 A 107 107 THR N N 107 125.403 122.654 2.749 1
1 1253 . 13 1 1 A 108 108 ILE H H 108 9.234 8.743 0.491 1
1 1254 . 13 1 1 A 108 108 ILE HA H 108 4.178 4.739 -0.561 1
1 1264 . 13 1 1 A 108 108 ILE C C 108 174.087 174.586 -0.499 1
1 1265 . 13 1 1 A 108 108 ILE CA C 108 60.365 60.336 0.029 1
1 1266 . 13 1 1 A 108 108 ILE CB C 108 39.745 39.722 0.023 1
1 1270 . 13 1 1 A 108 108 ILE N N 108 127.152 128.118 -0.966 1
1 1271 . 13 1 1 A 109 109 ASN H H 109 8.723 9.167 -0.444 1
1 1272 . 13 1 1 A 109 109 ASN HA H 109 5.147 5.166 -0.019 1
1 1277 . 13 1 1 A 109 109 ASN C C 109 173.592 174.530 -0.938 1
1 1278 . 13 1 1 A 109 109 ASN CA C 109 52.501 52.797 -0.296 1
1 1279 . 13 1 1 A 109 109 ASN CB C 109 40.791 39.624 1.167 1
1 1280 . 13 1 1 A 109 109 ASN N N 109 126.866 126.777 0.089 1
1 1282 . 13 1 1 A 110 110 VAL H H 110 9.046 8.451 0.595 1
1 1283 . 13 1 1 A 110 110 VAL HA H 110 5.081 4.627 0.454 1
1 1291 . 13 1 1 A 110 110 VAL C C 110 176.921 176.018 0.903 1
1 1292 . 13 1 1 A 110 110 VAL CA C 110 61.634 62.618 -0.984 1
1 1293 . 13 1 1 A 110 110 VAL CB C 110 31.809 31.680 0.129 1
1 1296 . 13 1 1 A 110 110 VAL N N 110 126.070 125.352 0.718 1
1 1297 . 13 1 1 A 111 111 THR H H 111 9.197 8.707 0.490 1
1 1298 . 13 1 1 A 111 111 THR HA H 111 4.566 5.142 -0.576 1
1 1303 . 13 1 1 A 111 111 THR C C 111 174.087 174.476 -0.389 1
1 1304 . 13 1 1 A 111 111 THR CA C 111 61.145 59.693 1.452 1
1 1305 . 13 1 1 A 111 111 THR CB C 111 70.706 71.459 -0.753 1
1 1307 . 13 1 1 A 111 111 THR N N 111 121.425 118.660 2.765 1
1 1308 . 13 1 1 A 112 112 ASP H H 112 8.435 8.562 -0.127 1
1 1309 . 13 1 1 A 112 112 ASP HA H 112 4.656 4.833 -0.177 1
1 1312 . 13 1 1 A 112 112 ASP C C 112 176.745 175.844 0.901 1
1 1313 . 13 1 1 A 112 112 ASP CA C 112 54.158 54.388 -0.230 1
1 1314 . 13 1 1 A 112 112 ASP CB C 112 41.575 41.966 -0.391 1
1 1315 . 13 1 1 A 112 112 ASP N N 112 119.566 121.553 -1.987 1
1 1316 . 13 1 1 A 113 113 VAL H H 113 8.629 8.522 0.107 1
1 1317 . 13 1 1 A 113 113 VAL HA H 113 4.078 4.779 -0.701 1
1 1325 . 13 1 1 A 113 113 VAL C C 113 175.247 174.271 0.976 1
1 1326 . 13 1 1 A 113 113 VAL CA C 113 62.533 60.020 2.513 1
1 1327 . 13 1 1 A 113 113 VAL CB C 113 32.534 34.473 -1.939 1
1 1330 . 13 1 1 A 113 113 VAL N N 113 119.356 116.879 2.477 1
1 4 . 14 1 1 A 2 2 SER H H 2 8.289 8.558 -0.269 1
1 5 . 14 1 1 A 2 2 SER HA H 2 4.530 5.252 -0.722 1
1 7 . 14 1 1 A 2 2 SER C C 2 174.868 172.257 2.611 1
1 8 . 14 1 1 A 2 2 SER CA C 2 58.284 57.712 0.572 1
1 9 . 14 1 1 A 2 2 SER CB C 2 63.769 66.617 -2.848 1
1 10 . 14 1 1 A 2 2 SER N N 2 115.842 116.636 -0.794 1
1 11 . 14 1 1 A 3 3 SER H H 3 8.490 8.463 0.027 1
1 12 . 14 1 1 A 3 3 SER HA H 3 4.496 5.087 -0.591 1
1 14 . 14 1 1 A 3 3 SER C C 3 175.043 174.280 0.763 1
1 15 . 14 1 1 A 3 3 SER CA C 3 58.549 57.689 0.860 1
1 16 . 14 1 1 A 3 3 SER CB C 3 63.687 63.282 0.405 1
1 17 . 14 1 1 A 3 3 SER N N 3 117.930 118.675 -0.745 1
1 18 . 14 1 1 A 4 4 GLY H H 4 8.482 8.468 0.014 1
1 19 . 14 1 1 A 4 4 GLY C C 4 174.344 172.123 2.221 1
1 20 . 14 1 1 A 4 4 GLY CA C 4 45.536 45.293 0.243 1
1 21 . 14 1 1 A 4 4 GLY N N 4 110.985 113.175 -2.190 1
1 22 . 14 1 1 A 6 6 SER HA H 6 4.508 5.229 -0.721 1
1 24 . 14 1 1 A 6 6 SER C C 6 175.026 172.398 2.628 1
1 25 . 14 1 1 A 6 6 SER CA C 6 58.584 56.645 1.939 1
1 26 . 14 1 1 A 6 6 SER CB C 6 63.646 65.857 -2.211 1
1 27 . 14 1 1 A 7 7 GLY H H 7 8.419 8.565 -0.146 1
1 28 . 14 1 1 A 7 7 GLY HA2 H 7 3.993 4.293 -0.300 1
1 29 . 14 1 1 A 7 7 GLY C C 7 173.995 175.409 -1.414 1
1 30 . 14 1 1 A 7 7 GLY CA C 7 45.466 45.758 -0.292 1
1 31 . 14 1 1 A 7 7 GLY N N 7 110.615 111.888 -1.273 1
1 32 . 14 1 1 A 8 8 ASN H H 8 8.322 8.327 -0.005 1
1 33 . 14 1 1 A 8 8 ASN HA H 8 4.736 4.421 0.315 1
1 38 . 14 1 1 A 8 8 ASN C C 8 174.907 176.047 -1.140 1
1 39 . 14 1 1 A 8 8 ASN CA C 8 53.259 55.824 -2.565 1
1 40 . 14 1 1 A 8 8 ASN CB C 8 39.127 38.715 0.412 1
1 41 . 14 1 1 A 8 8 ASN N N 8 118.602 117.121 1.481 1
1 43 . 14 1 1 A 9 9 ASP H H 9 8.370 7.987 0.383 1
1 44 . 14 1 1 A 9 9 ASP HA H 9 4.594 4.819 -0.225 1
1 47 . 14 1 1 A 9 9 ASP C C 9 175.765 176.034 -0.269 1
1 48 . 14 1 1 A 9 9 ASP CA C 9 54.440 54.064 0.376 1
1 49 . 14 1 1 A 9 9 ASP CB C 9 40.898 41.207 -0.309 1
1 50 . 14 1 1 A 9 9 ASP N N 9 120.504 118.898 1.606 1
1 51 . 14 1 1 A 10 10 ASN H H 10 8.382 8.767 -0.385 1
1 52 . 14 1 1 A 10 10 ASN HA H 10 4.691 4.852 -0.161 1
1 57 . 14 1 1 A 10 10 ASN C C 10 174.383 175.239 -0.856 1
1 58 . 14 1 1 A 10 10 ASN CA C 10 53.241 54.774 -1.533 1
1 59 . 14 1 1 A 10 10 ASN CB C 10 38.674 40.161 -1.487 1
1 60 . 14 1 1 A 10 10 ASN N N 10 119.406 123.074 -3.668 1
1 62 . 14 1 1 A 11 11 ARG H H 11 7.942 7.520 0.422 1
1 63 . 14 1 1 A 11 11 ARG HA H 11 4.684 4.703 -0.019 1
1 70 . 14 1 1 A 11 11 ARG C C 11 173.640 174.584 -0.944 1
1 71 . 14 1 1 A 11 11 ARG CA C 11 54.246 53.787 0.459 1
1 72 . 14 1 1 A 11 11 ARG CB C 11 30.337 31.363 -1.026 1
1 75 . 14 1 1 A 11 11 ARG N N 11 121.145 117.964 3.181 1
1 76 . 14 1 1 A 12 12 PRO HA H 12 4.507 5.017 -0.510 1
1 83 . 14 1 1 A 12 12 PRO CA C 12 62.714 62.476 0.238 1
1 84 . 14 1 1 A 12 12 PRO CB C 12 31.942 32.642 -0.700 1
1 87 . 14 1 1 A 13 13 VAL H H 13 8.252 8.458 -0.206 1
1 88 . 14 1 1 A 13 13 VAL HA H 13 4.159 4.611 -0.452 1
1 96 . 14 1 1 A 13 13 VAL CA C 13 61.409 59.562 1.847 1
1 97 . 14 1 1 A 13 13 VAL CB C 13 34.858 35.497 -0.639 1
1 100 . 14 1 1 A 13 13 VAL N N 13 118.395 121.446 -3.051 1
1 101 . 14 1 1 A 14 14 PHE H H 14 8.725 8.708 0.017 1
1 102 . 14 1 1 A 14 14 PHE HA H 14 4.781 4.690 0.091 1
1 110 . 14 1 1 A 14 14 PHE CA C 14 58.594 58.692 -0.098 1
1 111 . 14 1 1 A 14 14 PHE CB C 14 39.594 39.502 0.092 1
1 117 . 14 1 1 A 14 14 PHE N N 14 122.950 126.616 -3.666 1
1 118 . 14 1 1 A 15 15 LYS H H 15 8.885 8.879 0.006 1
1 119 . 14 1 1 A 15 15 LYS HA H 15 4.130 4.181 -0.051 1
1 128 . 14 1 1 A 15 15 LYS C C 15 177.027 176.222 0.805 1
1 129 . 14 1 1 A 15 15 LYS CA C 15 58.478 58.660 -0.182 1
1 130 . 14 1 1 A 15 15 LYS CB C 15 32.748 32.925 -0.177 1
1 134 . 14 1 1 A 15 15 LYS N N 15 123.863 125.227 -1.364 1
1 135 . 14 1 1 A 16 16 GLU H H 16 8.091 7.673 0.418 1
1 136 . 14 1 1 A 16 16 GLU HA H 16 4.438 4.861 -0.423 1
1 141 . 14 1 1 A 16 16 GLU C C 16 175.947 175.682 0.265 1
1 142 . 14 1 1 A 16 16 GLU CA C 16 56.045 54.877 1.168 1
1 143 . 14 1 1 A 16 16 GLU CB C 16 30.766 32.494 -1.728 1
1 145 . 14 1 1 A 16 16 GLU N N 16 117.026 113.873 3.153 1
1 146 . 14 1 1 A 17 17 GLY H H 17 8.421 8.568 -0.147 1
1 147 . 14 1 1 A 17 17 GLY HA2 H 17 3.993 3.944 0.049 1
1 148 . 14 1 1 A 17 17 GLY HA3 H 17 3.913 3.997 -0.084 1
1 149 . 14 1 1 A 17 17 GLY C C 17 173.564 174.416 -0.852 1
1 150 . 14 1 1 A 17 17 GLY CA C 17 45.448 46.563 -1.115 1
1 151 . 14 1 1 A 17 17 GLY N N 17 109.577 110.579 -1.002 1
1 152 . 14 1 1 A 18 18 GLN H H 18 7.858 7.764 0.094 1
1 153 . 14 1 1 A 18 18 GLN HA H 18 5.065 4.730 0.335 1
1 160 . 14 1 1 A 18 18 GLN C C 18 174.596 174.693 -0.097 1
1 161 . 14 1 1 A 18 18 GLN CA C 18 55.110 55.298 -0.188 1
1 162 . 14 1 1 A 18 18 GLN CB C 18 30.329 28.897 1.432 1
1 164 . 14 1 1 A 18 18 GLN N N 18 120.202 118.133 2.069 1
1 166 . 14 1 1 A 19 19 VAL H H 19 8.216 8.577 -0.361 1
1 167 . 14 1 1 A 19 19 VAL HA H 19 4.450 4.731 -0.281 1
1 175 . 14 1 1 A 19 19 VAL C C 19 173.648 174.448 -0.800 1
1 176 . 14 1 1 A 19 19 VAL CA C 19 60.788 59.891 0.897 1
1 177 . 14 1 1 A 19 19 VAL CB C 19 35.336 35.694 -0.358 1
1 180 . 14 1 1 A 19 19 VAL N N 19 121.257 124.155 -2.898 1
1 181 . 14 1 1 A 20 20 GLU H H 20 8.610 8.603 0.007 1
1 182 . 14 1 1 A 20 20 GLU HA H 20 5.211 5.234 -0.023 1
1 187 . 14 1 1 A 20 20 GLU C C 20 174.783 175.536 -0.753 1
1 188 . 14 1 1 A 20 20 GLU CA C 20 54.793 54.631 0.162 1
1 189 . 14 1 1 A 20 20 GLU CB C 20 32.058 32.802 -0.744 1
1 191 . 14 1 1 A 20 20 GLU N N 20 127.095 124.057 3.038 1
1 192 . 14 1 1 A 21 21 VAL H H 21 8.727 8.544 0.183 1
1 193 . 14 1 1 A 21 21 VAL HA H 21 4.633 4.673 -0.040 1
1 201 . 14 1 1 A 21 21 VAL C C 21 173.894 173.777 0.117 1
1 202 . 14 1 1 A 21 21 VAL CA C 21 59.695 59.101 0.594 1
1 203 . 14 1 1 A 21 21 VAL CB C 21 35.865 35.541 0.324 1
1 206 . 14 1 1 A 21 21 VAL N N 21 120.489 118.029 2.460 1
1 207 . 14 1 1 A 22 22 HIS H H 22 8.680 8.581 0.099 1
1 208 . 14 1 1 A 22 22 HIS HA H 22 5.552 5.275 0.277 1
1 212 . 14 1 1 A 22 22 HIS C C 22 174.298 173.680 0.618 1
1 213 . 14 1 1 A 22 22 HIS CA C 22 55.331 54.305 1.026 1
1 214 . 14 1 1 A 22 22 HIS CB C 22 32.369 31.960 0.409 1
1 216 . 14 1 1 A 22 22 HIS N N 22 124.991 121.354 3.637 1
1 217 . 14 1 1 A 23 23 ILE H H 23 9.179 8.731 0.448 1
1 218 . 14 1 1 A 23 23 ILE HA H 23 5.046 4.698 0.348 1
1 228 . 14 1 1 A 23 23 ILE C C 23 171.552 173.420 -1.868 1
1 229 . 14 1 1 A 23 23 ILE CA C 23 55.551 57.334 -1.783 1
1 230 . 14 1 1 A 23 23 ILE CB C 23 42.053 42.197 -0.144 1
1 234 . 14 1 1 A 23 23 ILE N N 23 123.121 123.204 -0.083 1
1 235 . 14 1 1 A 24 24 PRO HA H 24 4.816 4.876 -0.060 1
1 242 . 14 1 1 A 24 24 PRO C C 24 178.887 177.699 1.188 1
1 243 . 14 1 1 A 24 24 PRO CA C 24 62.216 62.678 -0.462 1
1 244 . 14 1 1 A 24 24 PRO CB C 24 32.895 32.848 0.047 1
1 247 . 14 1 1 A 25 25 GLU H H 25 8.399 8.331 0.068 1
1 248 . 14 1 1 A 25 25 GLU HA H 25 3.785 4.001 -0.216 1
1 253 . 14 1 1 A 25 25 GLU C C 25 175.244 177.666 -2.422 1
1 254 . 14 1 1 A 25 25 GLU CA C 25 58.425 58.655 -0.230 1
1 255 . 14 1 1 A 25 25 GLU CB C 25 30.011 29.189 0.822 1
1 257 . 14 1 1 A 25 25 GLU N N 25 117.706 122.030 -4.324 1
1 258 . 14 1 1 A 26 26 ASN H H 26 7.488 7.785 -0.297 1
1 259 . 14 1 1 A 26 26 ASN HA H 26 4.702 4.767 -0.065 1
1 264 . 14 1 1 A 26 26 ASN C C 26 175.425 175.549 -0.124 1
1 265 . 14 1 1 A 26 26 ASN CA C 26 51.584 52.386 -0.802 1
1 266 . 14 1 1 A 26 26 ASN CB C 26 37.243 38.508 -1.265 1
1 267 . 14 1 1 A 26 26 ASN N N 26 112.383 117.957 -5.574 1
1 269 . 14 1 1 A 27 27 ALA H H 27 7.716 7.401 0.315 1
1 270 . 14 1 1 A 27 27 ALA HA H 27 4.409 4.276 0.133 1
1 274 . 14 1 1 A 27 27 ALA C C 27 175.850 175.947 -0.097 1
1 275 . 14 1 1 A 27 27 ALA CA C 27 51.037 51.101 -0.064 1
1 276 . 14 1 1 A 27 27 ALA CB C 27 18.152 18.851 -0.699 1
1 277 . 14 1 1 A 27 27 ALA N N 27 125.139 122.537 2.602 1
1 278 . 14 1 1 A 28 28 PRO HA H 28 4.422 4.552 -0.130 1
1 285 . 14 1 1 A 28 28 PRO C C 28 178.442 177.079 1.363 1
1 286 . 14 1 1 A 28 28 PRO CA C 28 62.067 62.837 -0.770 1
1 287 . 14 1 1 A 28 28 PRO CB C 28 32.642 32.306 0.336 1
1 290 . 14 1 1 A 29 29 VAL H H 29 8.691 8.336 0.355 1
1 291 . 14 1 1 A 29 29 VAL HA H 29 3.239 3.553 -0.314 1
1 299 . 14 1 1 A 29 29 VAL C C 29 176.887 177.186 -0.299 1
1 300 . 14 1 1 A 29 29 VAL CA C 29 65.812 64.214 1.598 1
1 301 . 14 1 1 A 29 29 VAL CB C 29 31.174 31.417 -0.243 1
1 304 . 14 1 1 A 29 29 VAL N N 29 123.592 122.613 0.979 1
1 305 . 14 1 1 A 30 30 GLY H H 30 9.197 9.062 0.135 1
1 306 . 14 1 1 A 30 30 GLY HA2 H 30 4.486 3.948 0.538 1
1 307 . 14 1 1 A 30 30 GLY HA3 H 30 3.581 3.948 -0.367 1
1 308 . 14 1 1 A 30 30 GLY C C 30 174.347 174.825 -0.478 1
1 309 . 14 1 1 A 30 30 GLY CA C 30 44.320 44.949 -0.629 1
1 310 . 14 1 1 A 30 30 GLY N N 30 116.042 115.335 0.707 1
1 311 . 14 1 1 A 31 31 THR H H 31 7.838 7.714 0.124 1
1 312 . 14 1 1 A 31 31 THR HA H 31 3.959 4.197 -0.238 1
1 317 . 14 1 1 A 31 31 THR C C 31 174.274 173.923 0.351 1
1 318 . 14 1 1 A 31 31 THR CA C 31 65.160 62.803 2.357 1
1 319 . 14 1 1 A 31 31 THR CB C 31 69.972 69.643 0.329 1
1 321 . 14 1 1 A 31 31 THR N N 31 117.679 117.446 0.233 1
1 322 . 14 1 1 A 32 32 SER H H 32 9.022 8.598 0.424 1
1 323 . 14 1 1 A 32 32 SER HA H 32 4.273 4.670 -0.397 1
1 326 . 14 1 1 A 32 32 SER C C 32 172.692 174.292 -1.600 1
1 327 . 14 1 1 A 32 32 SER CA C 32 59.642 56.917 2.725 1
1 328 . 14 1 1 A 32 32 SER CB C 32 63.102 63.059 0.043 1
1 329 . 14 1 1 A 32 32 SER N N 32 123.045 120.760 2.285 1
1 330 . 14 1 1 A 33 33 VAL H H 33 9.202 8.901 0.301 1
1 331 . 14 1 1 A 33 33 VAL HA H 33 3.844 3.986 -0.142 1
1 339 . 14 1 1 A 33 33 VAL C C 33 174.782 175.739 -0.957 1
1 340 . 14 1 1 A 33 33 VAL CA C 33 64.242 64.943 -0.701 1
1 341 . 14 1 1 A 33 33 VAL CB C 33 32.893 32.247 0.646 1
1 344 . 14 1 1 A 33 33 VAL N N 33 126.861 128.724 -1.863 1
1 345 . 14 1 1 A 34 34 ILE H H 34 7.074 7.992 -0.918 1
1 346 . 14 1 1 A 34 34 ILE HA H 34 4.295 4.734 -0.439 1
1 356 . 14 1 1 A 34 34 ILE C C 34 170.577 173.320 -2.743 1
1 357 . 14 1 1 A 34 34 ILE CA C 34 59.500 59.209 0.291 1
1 358 . 14 1 1 A 34 34 ILE CB C 34 39.251 42.167 -2.916 1
1 362 . 14 1 1 A 34 34 ILE N N 34 111.445 119.327 -7.882 1
1 363 . 14 1 1 A 35 35 GLN H H 35 8.450 8.830 -0.380 1
1 364 . 14 1 1 A 35 35 GLN HA H 35 4.633 5.045 -0.412 1
1 371 . 14 1 1 A 35 35 GLN C C 35 174.354 174.113 0.241 1
1 372 . 14 1 1 A 35 35 GLN CA C 35 54.176 54.123 0.053 1
1 373 . 14 1 1 A 35 35 GLN CB C 35 29.456 31.669 -2.213 1
1 375 . 14 1 1 A 35 35 GLN N N 35 127.342 127.605 -0.263 1
1 377 . 14 1 1 A 36 36 LEU H H 36 7.761 9.013 -1.252 1
1 378 . 14 1 1 A 36 36 LEU HA H 36 4.492 5.084 -0.592 1
1 388 . 14 1 1 A 36 36 LEU C C 36 175.543 175.066 0.477 1
1 389 . 14 1 1 A 36 36 LEU CA C 36 53.982 53.379 0.603 1
1 390 . 14 1 1 A 36 36 LEU CB C 36 42.776 42.850 -0.074 1
1 394 . 14 1 1 A 36 36 LEU N N 36 128.895 128.260 0.635 1
1 395 . 14 1 1 A 37 37 HIS H H 37 8.529 9.002 -0.473 1
1 396 . 14 1 1 A 37 37 HIS HA H 37 4.851 5.447 -0.596 1
1 400 . 14 1 1 A 37 37 HIS C C 37 172.985 173.493 -0.508 1
1 401 . 14 1 1 A 37 37 HIS CA C 37 55.833 53.477 2.356 1
1 402 . 14 1 1 A 37 37 HIS CB C 37 32.204 31.846 0.358 1
1 404 . 14 1 1 A 37 37 HIS N N 37 115.903 125.203 -9.300 1
1 405 . 14 1 1 A 38 38 ALA H H 38 8.474 9.045 -0.571 1
1 406 . 14 1 1 A 38 38 ALA HA H 38 4.691 5.354 -0.663 1
1 410 . 14 1 1 A 38 38 ALA C C 38 175.548 176.942 -1.394 1
1 411 . 14 1 1 A 38 38 ALA CA C 38 50.491 49.820 0.671 1
1 412 . 14 1 1 A 38 38 ALA CB C 38 19.842 22.760 -2.918 1
1 413 . 14 1 1 A 38 38 ALA N N 38 128.891 130.165 -1.274 1
1 414 . 14 1 1 A 39 39 THR H H 39 8.095 8.700 -0.605 1
1 415 . 14 1 1 A 39 39 THR HA H 39 4.336 5.208 -0.872 1
1 420 . 14 1 1 A 39 39 THR C C 39 173.553 172.677 0.876 1
1 421 . 14 1 1 A 39 39 THR CA C 39 60.417 59.774 0.643 1
1 422 . 14 1 1 A 39 39 THR CB C 39 70.912 72.151 -1.239 1
1 424 . 14 1 1 A 39 39 THR N N 39 110.982 110.821 0.161 1
1 425 . 14 1 1 A 40 40 ASP H H 40 8.417 8.641 -0.224 1
1 426 . 14 1 1 A 40 40 ASP HA H 40 4.553 4.967 -0.414 1
1 429 . 14 1 1 A 40 40 ASP C C 40 176.462 174.408 2.054 1
1 430 . 14 1 1 A 40 40 ASP CA C 40 54.158 52.641 1.517 1
1 431 . 14 1 1 A 40 40 ASP CB C 40 41.517 44.333 -2.816 1
1 432 . 14 1 1 A 40 40 ASP N N 40 121.450 120.329 1.121 1
1 433 . 14 1 1 A 41 41 ALA H H 41 8.435 8.364 0.071 1
1 434 . 14 1 1 A 41 41 ALA HA H 41 4.129 4.130 -0.001 1
1 438 . 14 1 1 A 41 41 ALA C C 41 177.718 177.989 -0.271 1
1 439 . 14 1 1 A 41 41 ALA CA C 41 53.436 52.688 0.748 1
1 440 . 14 1 1 A 41 41 ALA CB C 41 19.183 19.566 -0.383 1
1 441 . 14 1 1 A 41 41 ALA N N 41 124.607 125.015 -0.408 1
1 442 . 14 1 1 A 42 42 ASP H H 42 8.310 8.523 -0.213 1
1 443 . 14 1 1 A 42 42 ASP HA H 42 4.588 4.327 0.261 1
1 446 . 14 1 1 A 42 42 ASP C C 42 176.546 176.865 -0.319 1
1 447 . 14 1 1 A 42 42 ASP CA C 42 54.599 57.221 -2.622 1
1 448 . 14 1 1 A 42 42 ASP CB C 42 41.146 40.398 0.748 1
1 449 . 14 1 1 A 42 42 ASP N N 42 118.030 124.936 -6.906 1
1 450 . 14 1 1 A 43 43 ILE H H 43 8.000 7.534 0.466 1
1 451 . 14 1 1 A 43 43 ILE HA H 43 4.130 4.180 -0.050 1
1 461 . 14 1 1 A 43 43 ILE C C 43 176.901 176.051 0.850 1
1 462 . 14 1 1 A 43 43 ILE CA C 43 61.740 61.209 0.531 1
1 463 . 14 1 1 A 43 43 ILE CB C 43 38.491 38.264 0.227 1
1 467 . 14 1 1 A 43 43 ILE N N 43 119.301 115.562 3.739 1
1 468 . 14 1 1 A 44 44 GLY H H 44 8.448 8.756 -0.308 1
1 469 . 14 1 1 A 44 44 GLY HA2 H 44 3.939 3.952 -0.013 1
1 470 . 14 1 1 A 44 44 GLY HA3 H 44 3.939 3.955 -0.016 1
1 471 . 14 1 1 A 44 44 GLY C C 44 174.393 173.068 1.325 1
1 472 . 14 1 1 A 44 44 GLY CA C 44 45.501 46.805 -1.304 1
1 473 . 14 1 1 A 44 44 GLY N N 44 111.333 112.109 -0.776 1
1 474 . 14 1 1 A 45 45 SER H H 45 8.061 8.668 -0.607 1
1 475 . 14 1 1 A 45 45 SER HA H 45 4.416 4.805 -0.389 1
1 478 . 14 1 1 A 45 45 SER C C 45 174.480 173.880 0.600 1
1 479 . 14 1 1 A 45 45 SER CA C 45 58.478 56.770 1.708 1
1 480 . 14 1 1 A 45 45 SER CB C 45 63.943 63.754 0.189 1
1 481 . 14 1 1 A 45 45 SER N N 45 115.551 119.416 -3.865 1
1 482 . 14 1 1 A 46 46 ASN H H 46 8.547 8.220 0.327 1
1 483 . 14 1 1 A 46 46 ASN HA H 46 4.725 4.394 0.331 1
1 488 . 14 1 1 A 46 46 ASN C C 46 175.031 174.247 0.784 1
1 489 . 14 1 1 A 46 46 ASN CA C 46 53.277 53.932 -0.655 1
1 490 . 14 1 1 A 46 46 ASN CB C 46 38.798 36.235 2.563 1
1 491 . 14 1 1 A 46 46 ASN N N 46 120.698 123.711 -3.013 1
1 493 . 14 1 1 A 47 47 ALA H H 47 8.239 7.801 0.438 1
1 494 . 14 1 1 A 47 47 ALA HA H 47 4.283 4.679 -0.396 1
1 498 . 14 1 1 A 47 47 ALA C C 47 177.240 176.926 0.314 1
1 499 . 14 1 1 A 47 47 ALA CA C 47 52.731 50.690 2.041 1
1 500 . 14 1 1 A 47 47 ALA CB C 47 19.594 20.610 -1.016 1
1 501 . 14 1 1 A 47 47 ALA N N 47 124.093 122.343 1.750 1
1 502 . 14 1 1 A 48 48 GLU H H 48 8.376 8.948 -0.572 1
1 503 . 14 1 1 A 48 48 GLU HA H 48 4.264 4.909 -0.645 1
1 508 . 14 1 1 A 48 48 GLU C C 48 175.702 175.236 0.466 1
1 509 . 14 1 1 A 48 48 GLU CA C 48 55.992 54.902 1.090 1
1 510 . 14 1 1 A 48 48 GLU CB C 48 30.210 31.609 -1.399 1
1 512 . 14 1 1 A 48 48 GLU N N 48 119.750 122.673 -2.923 1
1 513 . 14 1 1 A 49 49 ILE H H 49 7.806 8.761 -0.955 1
1 514 . 14 1 1 A 49 49 ILE HA H 49 3.919 4.467 -0.548 1
1 524 . 14 1 1 A 49 49 ILE C C 49 175.894 175.398 0.496 1
1 525 . 14 1 1 A 49 49 ILE CA C 49 60.559 60.667 -0.108 1
1 526 . 14 1 1 A 49 49 ILE CB C 49 37.860 37.398 0.462 1
1 530 . 14 1 1 A 49 49 ILE N N 49 122.772 126.381 -3.609 1
1 531 . 14 1 1 A 50 50 ARG H H 50 8.247 8.399 -0.152 1
1 532 . 14 1 1 A 50 50 ARG HA H 50 4.999 4.850 0.149 1
1 539 . 14 1 1 A 50 50 ARG C C 50 174.603 174.371 0.232 1
1 540 . 14 1 1 A 50 50 ARG CA C 50 53.189 53.757 -0.568 1
1 541 . 14 1 1 A 50 50 ARG CB C 50 33.152 33.450 -0.298 1
1 544 . 14 1 1 A 50 50 ARG N N 50 126.912 127.594 -0.682 1
1 545 . 14 1 1 A 51 51 TYR H H 51 9.041 8.656 0.385 1
1 546 . 14 1 1 A 51 51 TYR HA H 51 5.395 5.545 -0.150 1
1 553 . 14 1 1 A 51 51 TYR C C 51 175.555 175.252 0.303 1
1 554 . 14 1 1 A 51 51 TYR CA C 51 56.909 55.986 0.923 1
1 555 . 14 1 1 A 51 51 TYR CB C 51 40.116 41.214 -1.098 1
1 560 . 14 1 1 A 51 51 TYR N N 51 121.627 118.853 2.774 1
1 561 . 14 1 1 A 52 52 ILE H H 52 8.850 8.324 0.526 1
1 562 . 14 1 1 A 52 52 ILE HA H 52 4.576 4.835 -0.259 1
1 572 . 14 1 1 A 52 52 ILE C C 52 175.371 174.907 0.464 1
1 573 . 14 1 1 A 52 52 ILE CA C 52 59.624 59.709 -0.085 1
1 574 . 14 1 1 A 52 52 ILE CB C 52 42.895 42.018 0.877 1
1 578 . 14 1 1 A 52 52 ILE N N 52 117.697 118.143 -0.446 1
1 579 . 14 1 1 A 53 53 PHE H H 53 8.748 8.938 -0.190 1
1 580 . 14 1 1 A 53 53 PHE HA H 53 5.132 4.624 0.508 1
1 588 . 14 1 1 A 53 53 PHE C C 53 178.146 176.493 1.653 1
1 589 . 14 1 1 A 53 53 PHE CA C 53 57.667 58.855 -1.188 1
1 590 . 14 1 1 A 53 53 PHE CB C 53 39.614 39.714 -0.100 1
1 596 . 14 1 1 A 53 53 PHE N N 53 121.433 123.858 -2.425 1
1 597 . 14 1 1 A 54 54 GLY H H 54 8.538 8.394 0.144 1
1 598 . 14 1 1 A 54 54 GLY HA2 H 54 4.074 4.130 -0.056 1
1 599 . 14 1 1 A 54 54 GLY HA3 H 54 3.840 4.133 -0.293 1
1 600 . 14 1 1 A 54 54 GLY C C 54 174.530 172.965 1.565 1
1 601 . 14 1 1 A 54 54 GLY CA C 54 44.884 44.501 0.383 1
1 602 . 14 1 1 A 54 54 GLY N N 54 106.444 110.394 -3.950 1
1 603 . 14 1 1 A 55 55 ALA H H 55 8.594 8.138 0.456 1
1 604 . 14 1 1 A 55 55 ALA HA H 55 4.172 4.620 -0.448 1
1 608 . 14 1 1 A 55 55 ALA C C 55 178.718 177.290 1.428 1
1 609 . 14 1 1 A 55 55 ALA CA C 55 54.423 51.240 3.183 1
1 610 . 14 1 1 A 55 55 ALA CB C 55 19.059 20.822 -1.763 1
1 611 . 14 1 1 A 55 55 ALA N N 55 123.470 122.903 0.567 1
1 612 . 14 1 1 A 56 56 GLN H H 56 8.727 8.763 -0.036 1
1 613 . 14 1 1 A 56 56 GLN HA H 56 4.367 3.756 0.611 1
1 620 . 14 1 1 A 56 56 GLN C C 56 176.134 174.501 1.633 1
1 621 . 14 1 1 A 56 56 GLN CA C 56 55.660 56.736 -1.076 1
1 622 . 14 1 1 A 56 56 GLN CB C 56 28.152 26.848 1.304 1
1 624 . 14 1 1 A 56 56 GLN N N 56 114.221 115.376 -1.155 1
1 626 . 14 1 1 A 57 57 VAL H H 57 7.204 7.719 -0.515 1
1 627 . 14 1 1 A 57 57 VAL HA H 57 3.889 4.304 -0.415 1
1 635 . 14 1 1 A 57 57 VAL C C 57 175.371 175.586 -0.215 1
1 636 . 14 1 1 A 57 57 VAL CA C 57 63.908 61.283 2.625 1
1 637 . 14 1 1 A 57 57 VAL CB C 57 31.557 33.057 -1.500 1
1 640 . 14 1 1 A 57 57 VAL N N 57 121.341 119.346 1.995 1
1 641 . 14 1 1 A 58 58 ALA H H 58 8.920 8.532 0.388 1
1 642 . 14 1 1 A 58 58 ALA HA H 58 4.547 4.367 0.180 1
1 646 . 14 1 1 A 58 58 ALA C C 58 177.064 177.815 -0.751 1
1 647 . 14 1 1 A 58 58 ALA CA C 58 51.173 50.706 0.467 1
1 648 . 14 1 1 A 58 58 ALA CB C 58 17.842 17.800 0.042 1
1 649 . 14 1 1 A 58 58 ALA N N 58 132.726 130.760 1.966 1
1 650 . 14 1 1 A 59 59 PRO HA H 59 4.101 4.251 -0.150 1
1 657 . 14 1 1 A 59 59 PRO C C 59 179.482 178.854 0.628 1
1 658 . 14 1 1 A 59 59 PRO CA C 59 66.060 65.802 0.258 1
1 659 . 14 1 1 A 59 59 PRO CB C 59 31.951 31.694 0.257 1
1 662 . 14 1 1 A 60 60 ALA H H 60 8.706 8.240 0.466 1
1 663 . 14 1 1 A 60 60 ALA HA H 60 4.057 4.002 0.055 1
1 667 . 14 1 1 A 60 60 ALA C C 60 179.627 180.119 -0.492 1
1 668 . 14 1 1 A 60 60 ALA CA C 60 55.305 55.451 -0.146 1
1 669 . 14 1 1 A 60 60 ALA CB C 60 18.737 18.674 0.063 1
1 670 . 14 1 1 A 60 60 ALA N N 60 117.882 118.688 -0.806 1
1 671 . 14 1 1 A 61 61 THR H H 61 7.312 8.164 -0.852 1
1 672 . 14 1 1 A 61 61 THR HA H 61 4.153 3.815 0.338 1
1 677 . 14 1 1 A 61 61 THR C C 61 175.824 176.684 -0.860 1
1 678 . 14 1 1 A 61 61 THR CA C 61 66.412 67.175 -0.763 1
1 679 . 14 1 1 A 61 61 THR CB C 61 68.787 69.232 -0.445 1
1 681 . 14 1 1 A 61 61 THR N N 61 114.483 114.837 -0.354 1
1 682 . 14 1 1 A 62 62 LYS H H 62 7.556 7.853 -0.297 1
1 683 . 14 1 1 A 62 62 LYS HA H 62 3.943 3.997 -0.054 1
1 692 . 14 1 1 A 62 62 LYS C C 62 176.884 178.738 -1.854 1
1 693 . 14 1 1 A 62 62 LYS CA C 62 59.095 58.979 0.116 1
1 694 . 14 1 1 A 62 62 LYS CB C 62 32.204 31.852 0.352 1
1 698 . 14 1 1 A 62 62 LYS N N 62 118.994 119.247 -0.253 1
1 699 . 14 1 1 A 63 63 ARG H H 63 7.474 7.836 -0.362 1
1 700 . 14 1 1 A 63 63 ARG HA H 63 4.034 4.025 0.009 1
1 707 . 14 1 1 A 63 63 ARG C C 63 177.574 178.827 -1.253 1
1 708 . 14 1 1 A 63 63 ARG CA C 63 58.143 58.950 -0.807 1
1 709 . 14 1 1 A 63 63 ARG CB C 63 30.755 29.946 0.809 1
1 712 . 14 1 1 A 63 63 ARG N N 63 114.251 120.705 -6.454 1
1 713 . 14 1 1 A 64 64 LEU H H 64 6.991 7.847 -0.856 1
1 714 . 14 1 1 A 64 64 LEU HA H 64 3.904 3.946 -0.042 1
1 724 . 14 1 1 A 64 64 LEU C C 64 176.632 177.100 -0.468 1
1 725 . 14 1 1 A 64 64 LEU CA C 64 56.503 58.083 -1.580 1
1 726 . 14 1 1 A 64 64 LEU CB C 64 42.929 41.747 1.182 1
1 730 . 14 1 1 A 64 64 LEU N N 64 116.109 119.513 -3.404 1
1 731 . 14 1 1 A 65 65 PHE H H 65 7.673 8.048 -0.375 1
1 732 . 14 1 1 A 65 65 PHE HA H 65 5.386 4.921 0.465 1
1 740 . 14 1 1 A 65 65 PHE C C 65 173.067 175.607 -2.540 1
1 741 . 14 1 1 A 65 65 PHE CA C 65 56.521 57.547 -1.026 1
1 742 . 14 1 1 A 65 65 PHE CB C 65 41.270 41.337 -0.067 1
1 748 . 14 1 1 A 65 65 PHE N N 65 116.182 115.047 1.135 1
1 749 . 14 1 1 A 66 66 ALA H H 66 8.914 9.279 -0.365 1
1 750 . 14 1 1 A 66 66 ALA HA H 66 4.748 5.177 -0.429 1
1 754 . 14 1 1 A 66 66 ALA C C 66 175.223 175.349 -0.126 1
1 755 . 14 1 1 A 66 66 ALA CA C 66 50.050 50.633 -0.583 1
1 756 . 14 1 1 A 66 66 ALA CB C 66 21.161 20.596 0.565 1
1 757 . 14 1 1 A 66 66 ALA N N 66 122.870 124.204 -1.334 1
1 758 . 14 1 1 A 67 67 LEU H H 67 8.498 9.152 -0.654 1
1 759 . 14 1 1 A 67 67 LEU HA H 67 4.713 4.811 -0.098 1
1 769 . 14 1 1 A 67 67 LEU C C 67 175.146 175.574 -0.428 1
1 770 . 14 1 1 A 67 67 LEU CA C 67 52.518 54.036 -1.518 1
1 771 . 14 1 1 A 67 67 LEU CB C 67 45.308 43.461 1.847 1
1 775 . 14 1 1 A 67 67 LEU N N 67 122.208 127.081 -4.873 1
1 776 . 14 1 1 A 68 68 ASN H H 68 8.357 8.531 -0.174 1
1 777 . 14 1 1 A 68 68 ASN HA H 68 4.679 4.813 -0.134 1
1 782 . 14 1 1 A 68 68 ASN C C 68 176.228 175.795 0.433 1
1 783 . 14 1 1 A 68 68 ASN CA C 68 53.524 53.657 -0.133 1
1 784 . 14 1 1 A 68 68 ASN CB C 68 39.580 38.797 0.783 1
1 785 . 14 1 1 A 68 68 ASN N N 68 126.940 125.406 1.534 1
1 787 . 14 1 1 A 69 69 ASN H H 69 8.861 8.988 -0.127 1
1 788 . 14 1 1 A 69 69 ASN HA H 69 5.137 5.153 -0.016 1
1 793 . 14 1 1 A 69 69 ASN C C 69 175.631 175.934 -0.303 1
1 794 . 14 1 1 A 69 69 ASN CA C 69 56.009 53.988 2.021 1
1 795 . 14 1 1 A 69 69 ASN CB C 69 40.314 38.478 1.836 1
1 796 . 14 1 1 A 69 69 ASN N N 69 124.980 123.579 1.401 1
1 798 . 14 1 1 A 70 70 THR H H 70 8.635 7.904 0.731 1
1 799 . 14 1 1 A 70 70 THR HA H 70 4.815 4.633 0.182 1
1 804 . 14 1 1 A 70 70 THR C C 70 176.223 175.932 0.291 1
1 805 . 14 1 1 A 70 70 THR CA C 70 63.944 63.267 0.677 1
1 806 . 14 1 1 A 70 70 THR CB C 70 69.727 70.474 -0.747 1
1 808 . 14 1 1 A 70 70 THR N N 70 110.394 112.216 -1.822 1
1 809 . 14 1 1 A 71 71 THR H H 71 8.069 7.937 0.132 1
1 810 . 14 1 1 A 71 71 THR HA H 71 4.566 4.684 -0.118 1
1 815 . 14 1 1 A 71 71 THR C C 71 176.213 175.503 0.710 1
1 816 . 14 1 1 A 71 71 THR CA C 71 61.683 61.999 -0.316 1
1 817 . 14 1 1 A 71 71 THR CB C 71 70.832 71.296 -0.464 1
1 819 . 14 1 1 A 71 71 THR N N 71 110.507 108.947 1.560 1
1 820 . 14 1 1 A 72 72 GLY H H 72 7.990 8.259 -0.269 1
1 821 . 14 1 1 A 72 72 GLY HA2 H 72 3.186 2.572 0.614 1
1 822 . 14 1 1 A 72 72 GLY HA3 H 72 2.516 3.430 -0.914 1
1 823 . 14 1 1 A 72 72 GLY C C 72 172.988 173.953 -0.965 1
1 824 . 14 1 1 A 72 72 GLY CA C 72 45.149 45.059 0.090 1
1 825 . 14 1 1 A 72 72 GLY N N 72 110.788 111.473 -0.685 1
1 826 . 14 1 1 A 73 73 LEU H H 73 7.138 7.317 -0.179 1
1 827 . 14 1 1 A 73 73 LEU HA H 73 4.414 4.632 -0.218 1
1 837 . 14 1 1 A 73 73 LEU C C 73 176.836 175.125 1.711 1
1 838 . 14 1 1 A 73 73 LEU CA C 73 55.252 54.045 1.207 1
1 839 . 14 1 1 A 73 73 LEU CB C 73 43.574 42.882 0.692 1
1 843 . 14 1 1 A 73 73 LEU N N 73 119.222 122.760 -3.538 1
1 844 . 14 1 1 A 74 74 ILE H H 74 8.925 8.410 0.515 1
1 845 . 14 1 1 A 74 74 ILE HA H 74 5.555 4.799 0.756 1
1 855 . 14 1 1 A 74 74 ILE C C 74 175.978 175.452 0.526 1
1 856 . 14 1 1 A 74 74 ILE CA C 74 60.100 60.810 -0.710 1
1 857 . 14 1 1 A 74 74 ILE CB C 74 38.550 38.371 0.179 1
1 861 . 14 1 1 A 74 74 ILE N N 74 129.871 129.327 0.544 1
1 862 . 14 1 1 A 75 75 THR H H 75 9.161 8.714 0.447 1
1 863 . 14 1 1 A 75 75 THR HA H 75 5.375 5.446 -0.071 1
1 868 . 14 1 1 A 75 75 THR C C 75 174.798 173.561 1.237 1
1 869 . 14 1 1 A 75 75 THR CA C 75 58.796 60.037 -1.241 1
1 870 . 14 1 1 A 75 75 THR CB C 75 72.978 72.144 0.834 1
1 872 . 14 1 1 A 75 75 THR N N 75 117.522 117.952 -0.430 1
1 873 . 14 1 1 A 76 76 VAL H H 76 8.327 8.451 -0.124 1
1 874 . 14 1 1 A 76 76 VAL HA H 76 3.973 3.670 0.303 1
1 882 . 14 1 1 A 76 76 VAL C C 76 176.495 175.778 0.717 1
1 883 . 14 1 1 A 76 76 VAL CA C 76 64.085 63.421 0.664 1
1 884 . 14 1 1 A 76 76 VAL CB C 76 32.863 31.185 1.678 1
1 887 . 14 1 1 A 76 76 VAL N N 76 120.876 123.986 -3.110 1
1 888 . 14 1 1 A 77 77 GLN H H 77 9.525 9.277 0.248 1
1 889 . 14 1 1 A 77 77 GLN HA H 77 4.702 4.252 0.450 1
1 896 . 14 1 1 A 77 77 GLN C C 77 173.838 175.398 -1.560 1
1 897 . 14 1 1 A 77 77 GLN CA C 77 55.728 57.107 -1.379 1
1 898 . 14 1 1 A 77 77 GLN CB C 77 30.762 30.331 0.431 1
1 900 . 14 1 1 A 77 77 GLN N N 77 129.825 129.205 0.620 1
1 902 . 14 1 1 A 78 78 ARG H H 78 7.621 7.769 -0.148 1
1 903 . 14 1 1 A 78 78 ARG HA H 78 4.347 4.666 -0.319 1
1 910 . 14 1 1 A 78 78 ARG C C 78 172.304 175.589 -3.285 1
1 911 . 14 1 1 A 78 78 ARG CA C 78 54.634 53.812 0.822 1
1 912 . 14 1 1 A 78 78 ARG CB C 78 34.685 34.691 -0.006 1
1 915 . 14 1 1 A 78 78 ARG N N 78 120.595 117.421 3.174 1
1 916 . 14 1 1 A 79 79 SER H H 79 7.958 8.634 -0.676 1
1 917 . 14 1 1 A 79 79 SER HA H 79 4.030 4.291 -0.261 1
1 920 . 14 1 1 A 79 79 SER C C 79 174.311 174.353 -0.042 1
1 921 . 14 1 1 A 79 79 SER CA C 79 59.889 58.849 1.040 1
1 922 . 14 1 1 A 79 79 SER CB C 79 63.548 63.324 0.224 1
1 923 . 14 1 1 A 79 79 SER N N 79 112.565 117.008 -4.443 1
1 924 . 14 1 1 A 80 80 LEU H H 80 8.715 8.009 0.706 1
1 925 . 14 1 1 A 80 80 LEU HA H 80 4.114 4.662 -0.548 1
1 935 . 14 1 1 A 80 80 LEU C C 80 176.057 175.890 0.167 1
1 936 . 14 1 1 A 80 80 LEU CA C 80 55.091 54.245 0.846 1
1 937 . 14 1 1 A 80 80 LEU CB C 80 42.341 43.142 -0.801 1
1 941 . 14 1 1 A 80 80 LEU N N 80 123.070 125.072 -2.002 1
1 942 . 14 1 1 A 81 81 ASP H H 81 7.298 8.688 -1.390 1
1 943 . 14 1 1 A 81 81 ASP HA H 81 4.725 5.415 -0.690 1
1 946 . 14 1 1 A 81 81 ASP C C 81 175.939 176.118 -0.179 1
1 947 . 14 1 1 A 81 81 ASP CA C 81 53.664 52.905 0.759 1
1 948 . 14 1 1 A 81 81 ASP CB C 81 42.947 43.355 -0.408 1
1 949 . 14 1 1 A 81 81 ASP N N 81 115.229 119.958 -4.729 1
1 950 . 14 1 1 A 82 82 ARG H H 82 9.289 8.779 0.510 1
1 951 . 14 1 1 A 82 82 ARG HA H 82 4.416 4.101 0.315 1
1 959 . 14 1 1 A 82 82 ARG C C 82 176.406 177.956 -1.550 1
1 960 . 14 1 1 A 82 82 ARG CA C 82 56.397 59.148 -2.751 1
1 961 . 14 1 1 A 82 82 ARG CB C 82 30.638 30.047 0.591 1
1 964 . 14 1 1 A 82 82 ARG N N 82 123.174 126.493 -3.319 1
1 966 . 14 1 1 A 83 83 GLU H H 83 8.468 8.336 0.132 1
1 967 . 14 1 1 A 83 83 GLU HA H 83 3.982 4.123 -0.141 1
1 972 . 14 1 1 A 83 83 GLU C C 83 177.740 178.530 -0.790 1
1 973 . 14 1 1 A 83 83 GLU CA C 83 58.425 59.269 -0.844 1
1 974 . 14 1 1 A 83 83 GLU CB C 83 29.701 28.948 0.753 1
1 976 . 14 1 1 A 83 83 GLU N N 83 119.549 116.926 2.623 1
1 977 . 14 1 1 A 84 84 GLU H H 84 8.033 7.789 0.244 1
1 978 . 14 1 1 A 84 84 GLU HA H 84 4.206 4.362 -0.156 1
1 983 . 14 1 1 A 84 84 GLU C C 84 176.837 176.286 0.551 1
1 984 . 14 1 1 A 84 84 GLU CA C 84 58.056 58.177 -0.121 1
1 985 . 14 1 1 A 84 84 GLU CB C 84 30.432 30.732 -0.300 1
1 987 . 14 1 1 A 84 84 GLU N N 84 118.333 117.544 0.789 1
1 988 . 14 1 1 A 85 85 THR H H 85 7.651 7.209 0.442 1
1 989 . 14 1 1 A 85 85 THR HA H 85 4.307 4.627 -0.320 1
1 994 . 14 1 1 A 85 85 THR C C 85 171.568 173.682 -2.114 1
1 995 . 14 1 1 A 85 85 THR CA C 85 61.387 59.645 1.742 1
1 996 . 14 1 1 A 85 85 THR CB C 85 69.963 70.859 -0.896 1
1 998 . 14 1 1 A 85 85 THR N N 85 112.444 111.298 1.146 1
1 999 . 14 1 1 A 86 86 ALA H H 86 8.639 8.652 -0.013 1
1 1000 . 14 1 1 A 86 86 ALA HA H 86 4.603 4.259 0.344 1
1 1004 . 14 1 1 A 86 86 ALA C C 86 175.560 177.343 -1.783 1
1 1005 . 14 1 1 A 86 86 ALA CA C 86 52.156 53.853 -1.697 1
1 1006 . 14 1 1 A 86 86 ALA CB C 86 20.378 20.051 0.327 1
1 1007 . 14 1 1 A 86 86 ALA N N 86 127.705 127.229 0.476 1
1 1008 . 14 1 1 A 87 87 ILE H H 87 7.663 7.670 -0.007 1
1 1009 . 14 1 1 A 87 87 ILE HA H 87 4.828 4.689 0.139 1
1 1019 . 14 1 1 A 87 87 ILE C C 87 174.537 174.148 0.389 1
1 1020 . 14 1 1 A 87 87 ILE CA C 87 60.329 59.591 0.738 1
1 1021 . 14 1 1 A 87 87 ILE CB C 87 41.090 41.634 -0.544 1
1 1025 . 14 1 1 A 87 87 ILE N N 87 118.712 117.102 1.610 1
1 1026 . 14 1 1 A 88 88 HIS H H 88 9.098 8.571 0.527 1
1 1027 . 14 1 1 A 88 88 HIS HA H 88 4.576 5.124 -0.548 1
1 1032 . 14 1 1 A 88 88 HIS C C 88 174.354 174.128 0.226 1
1 1033 . 14 1 1 A 88 88 HIS CA C 88 54.740 54.244 0.496 1
1 1034 . 14 1 1 A 88 88 HIS CB C 88 33.955 32.441 1.514 1
1 1037 . 14 1 1 A 88 88 HIS N N 88 126.285 124.263 2.022 1
1 1038 . 14 1 1 A 89 89 LYS H H 89 8.957 8.881 0.076 1
1 1039 . 14 1 1 A 89 89 LYS HA H 89 4.873 4.653 0.220 1
1 1048 . 14 1 1 A 89 89 LYS C C 89 175.906 175.678 0.228 1
1 1049 . 14 1 1 A 89 89 LYS CA C 89 55.269 55.501 -0.232 1
1 1050 . 14 1 1 A 89 89 LYS CB C 89 32.945 33.337 -0.392 1
1 1054 . 14 1 1 A 89 89 LYS N N 89 124.332 123.833 0.499 1
1 1055 . 14 1 1 A 90 90 VAL H H 90 9.174 8.526 0.648 1
1 1056 . 14 1 1 A 90 90 VAL HA H 90 4.227 5.127 -0.900 1
1 1064 . 14 1 1 A 90 90 VAL C C 90 174.168 174.534 -0.366 1
1 1065 . 14 1 1 A 90 90 VAL CA C 90 61.369 60.989 0.380 1
1 1066 . 14 1 1 A 90 90 VAL CB C 90 34.082 34.415 -0.333 1
1 1069 . 14 1 1 A 90 90 VAL N N 90 124.319 125.128 -0.809 1
1 1070 . 14 1 1 A 91 91 THR H H 91 6.697 8.887 -2.190 1
1 1071 . 14 1 1 A 91 91 THR HA H 91 5.163 5.005 0.158 1
1 1076 . 14 1 1 A 91 91 THR C C 91 173.812 173.966 -0.154 1
1 1077 . 14 1 1 A 91 91 THR CA C 91 61.935 61.846 0.089 1
1 1078 . 14 1 1 A 91 91 THR CB C 91 70.412 70.899 -0.487 1
1 1080 . 14 1 1 A 91 91 THR N N 91 122.637 124.496 -1.859 1
1 1081 . 14 1 1 A 92 92 VAL H H 92 9.292 8.764 0.528 1
1 1082 . 14 1 1 A 92 92 VAL HA H 92 4.736 4.625 0.111 1
1 1090 . 14 1 1 A 92 92 VAL C C 92 173.160 174.881 -1.721 1
1 1091 . 14 1 1 A 92 92 VAL CA C 92 60.982 60.861 0.121 1
1 1092 . 14 1 1 A 92 92 VAL CB C 92 35.130 33.906 1.224 1
1 1095 . 14 1 1 A 92 92 VAL N N 92 128.265 126.858 1.407 1
1 1096 . 14 1 1 A 93 93 LEU H H 93 9.495 8.916 0.579 1
1 1097 . 14 1 1 A 93 93 LEU HA H 93 5.628 5.587 0.041 1
1 1107 . 14 1 1 A 93 93 LEU C C 93 176.274 175.306 0.968 1
1 1108 . 14 1 1 A 93 93 LEU CA C 93 52.773 53.587 -0.814 1
1 1109 . 14 1 1 A 93 93 LEU CB C 93 43.454 43.861 -0.407 1
1 1113 . 14 1 1 A 93 93 LEU N N 93 126.350 127.292 -0.942 1
1 1114 . 14 1 1 A 94 94 ALA H H 94 8.688 9.173 -0.485 1
1 1115 . 14 1 1 A 94 94 ALA HA H 94 4.986 5.250 -0.264 1
1 1119 . 14 1 1 A 94 94 ALA C C 94 175.787 176.439 -0.652 1
1 1120 . 14 1 1 A 94 94 ALA CA C 94 49.610 50.252 -0.642 1
1 1121 . 14 1 1 A 94 94 ALA CB C 94 21.463 20.871 0.592 1
1 1122 . 14 1 1 A 94 94 ALA N N 94 123.429 129.286 -5.857 1
1 1123 . 14 1 1 A 95 95 SER H H 95 8.401 8.258 0.143 1
1 1124 . 14 1 1 A 95 95 SER HA H 95 4.828 5.144 -0.316 1
1 1127 . 14 1 1 A 95 95 SER C C 95 174.327 174.042 0.285 1
1 1128 . 14 1 1 A 95 95 SER CA C 95 56.239 56.688 -0.449 1
1 1129 . 14 1 1 A 95 95 SER CB C 95 65.561 65.404 0.157 1
1 1130 . 14 1 1 A 95 95 SER N N 95 114.418 116.694 -2.276 1
1 1131 . 14 1 1 A 96 96 ASP H H 96 8.690 8.672 0.018 1
1 1132 . 14 1 1 A 96 96 ASP HA H 96 4.908 4.587 0.321 1
1 1135 . 14 1 1 A 96 96 ASP C C 96 177.096 176.736 0.360 1
1 1136 . 14 1 1 A 96 96 ASP CA C 96 52.818 55.632 -2.814 1
1 1137 . 14 1 1 A 96 96 ASP CB C 96 41.253 41.039 0.214 1
1 1138 . 14 1 1 A 96 96 ASP N N 96 125.624 122.701 2.923 1
1 1139 . 14 1 1 A 97 97 GLY H H 97 8.524 7.542 0.982 1
1 1140 . 14 1 1 A 97 97 GLY HA2 H 97 4.320 4.038 0.282 1
1 1141 . 14 1 1 A 97 97 GLY HA3 H 97 3.620 4.039 -0.419 1
1 1142 . 14 1 1 A 97 97 GLY C C 97 174.620 172.018 2.602 1
1 1143 . 14 1 1 A 97 97 GLY CA C 97 45.422 46.072 -0.650 1
1 1144 . 14 1 1 A 97 97 GLY N N 97 109.283 106.971 2.312 1
1 1145 . 14 1 1 A 98 98 SER H H 98 8.575 8.586 -0.011 1
1 1146 . 14 1 1 A 98 98 SER HA H 98 4.607 5.003 -0.396 1
1 1149 . 14 1 1 A 98 98 SER C C 98 174.478 173.308 1.170 1
1 1150 . 14 1 1 A 98 98 SER CA C 98 59.095 57.956 1.139 1
1 1151 . 14 1 1 A 98 98 SER CB C 98 64.800 62.591 2.209 1
1 1152 . 14 1 1 A 98 98 SER N N 98 116.640 119.520 -2.880 1
1 1153 . 14 1 1 A 99 99 SER H H 99 8.945 8.357 0.588 1
1 1154 . 14 1 1 A 99 99 SER HA H 99 4.530 4.917 -0.387 1
1 1157 . 14 1 1 A 99 99 SER C C 99 174.491 173.076 1.415 1
1 1158 . 14 1 1 A 99 99 SER CA C 99 58.460 57.192 1.268 1
1 1159 . 14 1 1 A 99 99 SER CB C 99 64.146 65.450 -1.304 1
1 1160 . 14 1 1 A 99 99 SER N N 99 117.676 120.555 -2.879 1
1 1161 . 14 1 1 A 100 100 THR H H 100 8.411 8.570 -0.159 1
1 1162 . 14 1 1 A 100 100 THR HA H 100 4.490 4.471 0.019 1
1 1167 . 14 1 1 A 100 100 THR C C 100 172.766 173.079 -0.313 1
1 1168 . 14 1 1 A 100 100 THR CA C 100 60.629 61.271 -0.642 1
1 1169 . 14 1 1 A 100 100 THR CB C 100 69.778 69.534 0.244 1
1 1171 . 14 1 1 A 100 100 THR N N 100 118.401 117.551 0.850 1
1 1172 . 14 1 1 A 101 101 PRO HA H 101 4.631 4.766 -0.135 1
1 1179 . 14 1 1 A 101 101 PRO C C 101 177.227 176.340 0.887 1
1 1180 . 14 1 1 A 101 101 PRO CA C 101 63.097 62.278 0.819 1
1 1181 . 14 1 1 A 101 101 PRO CB C 101 32.917 32.172 0.745 1
1 1184 . 14 1 1 A 102 102 ALA H H 102 8.497 8.196 0.301 1
1 1185 . 14 1 1 A 102 102 ALA HA H 102 4.619 4.544 0.075 1
1 1189 . 14 1 1 A 102 102 ALA C C 102 176.542 177.122 -0.580 1
1 1190 . 14 1 1 A 102 102 ALA CA C 102 51.390 52.269 -0.879 1
1 1191 . 14 1 1 A 102 102 ALA CB C 102 20.815 19.984 0.831 1
1 1192 . 14 1 1 A 102 102 ALA N N 102 124.487 123.656 0.831 1
1 1193 . 14 1 1 A 103 103 ARG H H 103 8.663 8.662 0.001 1
1 1194 . 14 1 1 A 103 103 ARG HA H 103 5.515 5.323 0.192 1
1 1201 . 14 1 1 A 103 103 ARG C C 103 174.539 175.308 -0.769 1
1 1202 . 14 1 1 A 103 103 ARG CA C 103 55.164 54.399 0.765 1
1 1203 . 14 1 1 A 103 103 ARG CB C 103 34.393 33.661 0.732 1
1 1206 . 14 1 1 A 103 103 ARG N N 103 119.596 119.908 -0.312 1
1 1207 . 14 1 1 A 104 104 ALA H H 104 9.027 8.568 0.459 1
1 1208 . 14 1 1 A 104 104 ALA HA H 104 4.782 4.972 -0.190 1
1 1212 . 14 1 1 A 104 104 ALA C C 104 176.276 175.730 0.546 1
1 1213 . 14 1 1 A 104 104 ALA CA C 104 50.297 51.576 -1.279 1
1 1214 . 14 1 1 A 104 104 ALA CB C 104 20.810 21.542 -0.732 1
1 1215 . 14 1 1 A 104 104 ALA N N 104 126.962 123.511 3.451 1
1 1216 . 14 1 1 A 105 105 THR H H 105 8.384 8.813 -0.429 1
1 1217 . 14 1 1 A 105 105 THR HA H 105 4.954 5.273 -0.319 1
1 1222 . 14 1 1 A 105 105 THR C C 105 173.243 174.010 -0.767 1
1 1223 . 14 1 1 A 105 105 THR CA C 105 61.475 61.780 -0.305 1
1 1224 . 14 1 1 A 105 105 THR CB C 105 70.569 69.714 0.855 1
1 1226 . 14 1 1 A 105 105 THR N N 105 115.327 118.654 -3.327 1
1 1227 . 14 1 1 A 106 106 VAL H H 106 8.970 8.954 0.016 1
1 1228 . 14 1 1 A 106 106 VAL HA H 106 4.702 4.544 0.158 1
1 1236 . 14 1 1 A 106 106 VAL C C 106 174.743 175.167 -0.424 1
1 1237 . 14 1 1 A 106 106 VAL CA C 106 59.712 60.642 -0.930 1
1 1238 . 14 1 1 A 106 106 VAL CB C 106 34.327 33.104 1.223 1
1 1241 . 14 1 1 A 106 106 VAL N N 106 126.226 128.103 -1.877 1
1 1242 . 14 1 1 A 107 107 THR H H 107 8.833 8.858 -0.025 1
1 1243 . 14 1 1 A 107 107 THR HA H 107 4.862 4.740 0.122 1
1 1248 . 14 1 1 A 107 107 THR C C 107 172.970 174.027 -1.057 1
1 1249 . 14 1 1 A 107 107 THR CA C 107 62.322 62.138 0.184 1
1 1250 . 14 1 1 A 107 107 THR CB C 107 69.463 69.218 0.245 1
1 1252 . 14 1 1 A 107 107 THR N N 107 125.403 122.528 2.875 1
1 1253 . 14 1 1 A 108 108 ILE H H 108 9.234 8.863 0.371 1
1 1254 . 14 1 1 A 108 108 ILE HA H 108 4.178 4.569 -0.391 1
1 1264 . 14 1 1 A 108 108 ILE C C 108 174.087 174.745 -0.658 1
1 1265 . 14 1 1 A 108 108 ILE CA C 108 60.365 60.542 -0.177 1
1 1266 . 14 1 1 A 108 108 ILE CB C 108 39.745 39.103 0.642 1
1 1270 . 14 1 1 A 108 108 ILE N N 108 127.152 128.484 -1.332 1
1 1271 . 14 1 1 A 109 109 ASN H H 109 8.723 9.014 -0.291 1
1 1272 . 14 1 1 A 109 109 ASN HA H 109 5.147 5.187 -0.040 1
1 1277 . 14 1 1 A 109 109 ASN C C 109 173.592 174.792 -1.200 1
1 1278 . 14 1 1 A 109 109 ASN CA C 109 52.501 53.096 -0.595 1
1 1279 . 14 1 1 A 109 109 ASN CB C 109 40.791 39.509 1.282 1
1 1280 . 14 1 1 A 109 109 ASN N N 109 126.866 126.632 0.234 1
1 1282 . 14 1 1 A 110 110 VAL H H 110 9.046 8.711 0.335 1
1 1283 . 14 1 1 A 110 110 VAL HA H 110 5.081 4.561 0.520 1
1 1291 . 14 1 1 A 110 110 VAL C C 110 176.921 176.262 0.659 1
1 1292 . 14 1 1 A 110 110 VAL CA C 110 61.634 61.846 -0.212 1
1 1293 . 14 1 1 A 110 110 VAL CB C 110 31.809 32.133 -0.324 1
1 1296 . 14 1 1 A 110 110 VAL N N 110 126.070 125.271 0.799 1
1 1297 . 14 1 1 A 111 111 THR H H 111 9.197 8.682 0.515 1
1 1298 . 14 1 1 A 111 111 THR HA H 111 4.566 5.110 -0.544 1
1 1303 . 14 1 1 A 111 111 THR C C 111 174.087 173.748 0.339 1
1 1304 . 14 1 1 A 111 111 THR CA C 111 61.145 59.624 1.521 1
1 1305 . 14 1 1 A 111 111 THR CB C 111 70.706 71.070 -0.364 1
1 1307 . 14 1 1 A 111 111 THR N N 111 121.425 118.998 2.427 1
1 1308 . 14 1 1 A 112 112 ASP H H 112 8.435 8.719 -0.284 1
1 1309 . 14 1 1 A 112 112 ASP HA H 112 4.656 4.663 -0.007 1
1 1312 . 14 1 1 A 112 112 ASP C C 112 176.745 176.767 -0.022 1
1 1313 . 14 1 1 A 112 112 ASP CA C 112 54.158 54.212 -0.054 1
1 1314 . 14 1 1 A 112 112 ASP CB C 112 41.575 42.540 -0.965 1
1 1315 . 14 1 1 A 112 112 ASP N N 112 119.566 124.335 -4.769 1
1 1316 . 14 1 1 A 113 113 VAL H H 113 8.629 8.550 0.079 1
1 1317 . 14 1 1 A 113 113 VAL HA H 113 4.078 4.237 -0.159 1
1 1325 . 14 1 1 A 113 113 VAL C C 113 175.247 176.718 -1.471 1
1 1326 . 14 1 1 A 113 113 VAL CA C 113 62.533 62.201 0.332 1
1 1327 . 14 1 1 A 113 113 VAL CB C 113 32.534 33.272 -0.738 1
1 1330 . 14 1 1 A 113 113 VAL N N 113 119.356 120.984 -1.628 1
1 4 . 15 1 1 A 2 2 SER H H 2 8.289 8.612 -0.323 1
1 5 . 15 1 1 A 2 2 SER HA H 2 4.530 4.590 -0.060 1
1 7 . 15 1 1 A 2 2 SER C C 2 174.868 174.403 0.465 1
1 8 . 15 1 1 A 2 2 SER CA C 2 58.284 59.898 -1.614 1
1 9 . 15 1 1 A 2 2 SER CB C 2 63.769 64.597 -0.828 1
1 10 . 15 1 1 A 2 2 SER N N 2 115.842 118.494 -2.652 1
1 11 . 15 1 1 A 3 3 SER H H 3 8.490 7.817 0.673 1
1 12 . 15 1 1 A 3 3 SER HA H 3 4.496 4.258 0.238 1
1 14 . 15 1 1 A 3 3 SER C C 3 175.043 174.386 0.657 1
1 15 . 15 1 1 A 3 3 SER CA C 3 58.549 60.313 -1.764 1
1 16 . 15 1 1 A 3 3 SER CB C 3 63.687 63.502 0.185 1
1 17 . 15 1 1 A 3 3 SER N N 3 117.930 116.712 1.218 1
1 18 . 15 1 1 A 4 4 GLY H H 4 8.482 8.690 -0.208 1
1 19 . 15 1 1 A 4 4 GLY C C 4 174.344 172.322 2.022 1
1 20 . 15 1 1 A 4 4 GLY CA C 4 45.536 44.937 0.599 1
1 21 . 15 1 1 A 4 4 GLY N N 4 110.985 114.457 -3.472 1
1 22 . 15 1 1 A 6 6 SER HA H 6 4.508 4.915 -0.407 1
1 24 . 15 1 1 A 6 6 SER C C 6 175.026 173.727 1.299 1
1 25 . 15 1 1 A 6 6 SER CA C 6 58.584 57.249 1.335 1
1 26 . 15 1 1 A 6 6 SER CB C 6 63.646 66.606 -2.960 1
1 27 . 15 1 1 A 7 7 GLY H H 7 8.419 8.738 -0.319 1
1 28 . 15 1 1 A 7 7 GLY HA2 H 7 3.993 4.092 -0.099 1
1 29 . 15 1 1 A 7 7 GLY C C 7 173.995 173.249 0.746 1
1 30 . 15 1 1 A 7 7 GLY CA C 7 45.466 44.331 1.135 1
1 31 . 15 1 1 A 7 7 GLY N N 7 110.615 109.044 1.571 1
1 32 . 15 1 1 A 8 8 ASN H H 8 8.322 8.393 -0.071 1
1 33 . 15 1 1 A 8 8 ASN HA H 8 4.736 5.672 -0.936 1
1 38 . 15 1 1 A 8 8 ASN C C 8 174.907 173.326 1.581 1
1 39 . 15 1 1 A 8 8 ASN CA C 8 53.259 52.104 1.155 1
1 40 . 15 1 1 A 8 8 ASN CB C 8 39.127 41.986 -2.859 1
1 41 . 15 1 1 A 8 8 ASN N N 8 118.602 118.705 -0.103 1
1 43 . 15 1 1 A 9 9 ASP H H 9 8.370 8.583 -0.213 1
1 44 . 15 1 1 A 9 9 ASP HA H 9 4.594 5.049 -0.455 1
1 47 . 15 1 1 A 9 9 ASP C C 9 175.765 174.740 1.025 1
1 48 . 15 1 1 A 9 9 ASP CA C 9 54.440 53.667 0.773 1
1 49 . 15 1 1 A 9 9 ASP CB C 9 40.898 43.934 -3.036 1
1 50 . 15 1 1 A 9 9 ASP N N 9 120.504 117.905 2.599 1
1 51 . 15 1 1 A 10 10 ASN H H 10 8.382 8.662 -0.280 1
1 52 . 15 1 1 A 10 10 ASN HA H 10 4.691 5.001 -0.310 1
1 57 . 15 1 1 A 10 10 ASN C C 10 174.383 175.036 -0.653 1
1 58 . 15 1 1 A 10 10 ASN CA C 10 53.241 54.192 -0.951 1
1 59 . 15 1 1 A 10 10 ASN CB C 10 38.674 40.894 -2.220 1
1 60 . 15 1 1 A 10 10 ASN N N 10 119.406 116.870 2.536 1
1 62 . 15 1 1 A 11 11 ARG H H 11 7.942 7.628 0.314 1
1 63 . 15 1 1 A 11 11 ARG HA H 11 4.684 4.816 -0.132 1
1 70 . 15 1 1 A 11 11 ARG C C 11 173.640 173.916 -0.276 1
1 71 . 15 1 1 A 11 11 ARG CA C 11 54.246 53.769 0.477 1
1 72 . 15 1 1 A 11 11 ARG CB C 11 30.337 32.642 -2.305 1
1 75 . 15 1 1 A 11 11 ARG N N 11 121.145 115.903 5.242 1
1 76 . 15 1 1 A 12 12 PRO HA H 12 4.507 4.662 -0.155 1
1 83 . 15 1 1 A 12 12 PRO CA C 12 62.714 62.479 0.235 1
1 84 . 15 1 1 A 12 12 PRO CB C 12 31.942 32.387 -0.445 1
1 87 . 15 1 1 A 13 13 VAL H H 13 8.252 8.311 -0.059 1
1 88 . 15 1 1 A 13 13 VAL HA H 13 4.159 4.673 -0.514 1
1 96 . 15 1 1 A 13 13 VAL CA C 13 61.409 60.308 1.101 1
1 97 . 15 1 1 A 13 13 VAL CB C 13 34.858 35.511 -0.653 1
1 100 . 15 1 1 A 13 13 VAL N N 13 118.395 120.659 -2.264 1
1 101 . 15 1 1 A 14 14 PHE H H 14 8.725 8.870 -0.145 1
1 102 . 15 1 1 A 14 14 PHE HA H 14 4.781 4.814 -0.033 1
1 110 . 15 1 1 A 14 14 PHE CA C 14 58.594 57.844 0.750 1
1 111 . 15 1 1 A 14 14 PHE CB C 14 39.594 40.796 -1.202 1
1 117 . 15 1 1 A 14 14 PHE N N 14 122.950 126.032 -3.082 1
1 118 . 15 1 1 A 15 15 LYS H H 15 8.885 8.987 -0.102 1
1 119 . 15 1 1 A 15 15 LYS HA H 15 4.130 4.188 -0.058 1
1 128 . 15 1 1 A 15 15 LYS C C 15 177.027 175.950 1.077 1
1 129 . 15 1 1 A 15 15 LYS CA C 15 58.478 58.355 0.123 1
1 130 . 15 1 1 A 15 15 LYS CB C 15 32.748 33.145 -0.397 1
1 134 . 15 1 1 A 15 15 LYS N N 15 123.863 122.084 1.779 1
1 135 . 15 1 1 A 16 16 GLU H H 16 8.091 8.009 0.082 1
1 136 . 15 1 1 A 16 16 GLU HA H 16 4.438 4.687 -0.249 1
1 141 . 15 1 1 A 16 16 GLU C C 16 175.947 177.327 -1.380 1
1 142 . 15 1 1 A 16 16 GLU CA C 16 56.045 55.270 0.775 1
1 143 . 15 1 1 A 16 16 GLU CB C 16 30.766 32.856 -2.090 1
1 145 . 15 1 1 A 16 16 GLU N N 16 117.026 116.339 0.687 1
1 146 . 15 1 1 A 17 17 GLY H H 17 8.421 8.805 -0.384 1
1 147 . 15 1 1 A 17 17 GLY HA2 H 17 3.993 3.889 0.104 1
1 148 . 15 1 1 A 17 17 GLY HA3 H 17 3.913 3.910 0.003 1
1 149 . 15 1 1 A 17 17 GLY C C 17 173.564 173.648 -0.084 1
1 150 . 15 1 1 A 17 17 GLY CA C 17 45.448 47.909 -2.461 1
1 151 . 15 1 1 A 17 17 GLY N N 17 109.577 111.214 -1.637 1
1 152 . 15 1 1 A 18 18 GLN H H 18 7.858 7.681 0.177 1
1 153 . 15 1 1 A 18 18 GLN HA H 18 5.065 4.953 0.112 1
1 160 . 15 1 1 A 18 18 GLN C C 18 174.596 173.798 0.798 1
1 161 . 15 1 1 A 18 18 GLN CA C 18 55.110 53.990 1.120 1
1 162 . 15 1 1 A 18 18 GLN CB C 18 30.329 31.417 -1.088 1
1 164 . 15 1 1 A 18 18 GLN N N 18 120.202 113.241 6.961 1
1 166 . 15 1 1 A 19 19 VAL H H 19 8.216 8.325 -0.109 1
1 167 . 15 1 1 A 19 19 VAL HA H 19 4.450 4.821 -0.371 1
1 175 . 15 1 1 A 19 19 VAL C C 19 173.648 173.961 -0.313 1
1 176 . 15 1 1 A 19 19 VAL CA C 19 60.788 60.605 0.183 1
1 177 . 15 1 1 A 19 19 VAL CB C 19 35.336 34.866 0.470 1
1 180 . 15 1 1 A 19 19 VAL N N 19 121.257 122.525 -1.268 1
1 181 . 15 1 1 A 20 20 GLU H H 20 8.610 8.850 -0.240 1
1 182 . 15 1 1 A 20 20 GLU HA H 20 5.211 4.836 0.375 1
1 187 . 15 1 1 A 20 20 GLU C C 20 174.783 175.607 -0.824 1
1 188 . 15 1 1 A 20 20 GLU CA C 20 54.793 54.738 0.055 1
1 189 . 15 1 1 A 20 20 GLU CB C 20 32.058 31.037 1.021 1
1 191 . 15 1 1 A 20 20 GLU N N 20 127.095 127.363 -0.268 1
1 192 . 15 1 1 A 21 21 VAL H H 21 8.727 8.589 0.138 1
1 193 . 15 1 1 A 21 21 VAL HA H 21 4.633 4.854 -0.221 1
1 201 . 15 1 1 A 21 21 VAL C C 21 173.894 174.477 -0.583 1
1 202 . 15 1 1 A 21 21 VAL CA C 21 59.695 60.106 -0.411 1
1 203 . 15 1 1 A 21 21 VAL CB C 21 35.865 33.886 1.979 1
1 206 . 15 1 1 A 21 21 VAL N N 21 120.489 122.394 -1.905 1
1 207 . 15 1 1 A 22 22 HIS H H 22 8.680 9.060 -0.380 1
1 208 . 15 1 1 A 22 22 HIS HA H 22 5.552 5.097 0.455 1
1 212 . 15 1 1 A 22 22 HIS C C 22 174.298 173.463 0.835 1
1 213 . 15 1 1 A 22 22 HIS CA C 22 55.331 54.303 1.028 1
1 214 . 15 1 1 A 22 22 HIS CB C 22 32.369 31.570 0.799 1
1 216 . 15 1 1 A 22 22 HIS N N 22 124.991 120.284 4.707 1
1 217 . 15 1 1 A 23 23 ILE H H 23 9.179 8.824 0.355 1
1 218 . 15 1 1 A 23 23 ILE HA H 23 5.046 4.740 0.306 1
1 228 . 15 1 1 A 23 23 ILE C C 23 171.552 174.091 -2.539 1
1 229 . 15 1 1 A 23 23 ILE CA C 23 55.551 57.194 -1.643 1
1 230 . 15 1 1 A 23 23 ILE CB C 23 42.053 41.567 0.486 1
1 234 . 15 1 1 A 23 23 ILE N N 23 123.121 124.551 -1.430 1
1 235 . 15 1 1 A 24 24 PRO HA H 24 4.816 4.783 0.033 1
1 242 . 15 1 1 A 24 24 PRO C C 24 178.887 177.744 1.143 1
1 243 . 15 1 1 A 24 24 PRO CA C 24 62.216 62.652 -0.436 1
1 244 . 15 1 1 A 24 24 PRO CB C 24 32.895 32.747 0.148 1
1 247 . 15 1 1 A 25 25 GLU H H 25 8.399 8.330 0.069 1
1 248 . 15 1 1 A 25 25 GLU HA H 25 3.785 4.021 -0.236 1
1 253 . 15 1 1 A 25 25 GLU C C 25 175.244 177.183 -1.939 1
1 254 . 15 1 1 A 25 25 GLU CA C 25 58.425 59.085 -0.660 1
1 255 . 15 1 1 A 25 25 GLU CB C 25 30.011 29.042 0.969 1
1 257 . 15 1 1 A 25 25 GLU N N 25 117.706 122.113 -4.407 1
1 258 . 15 1 1 A 26 26 ASN H H 26 7.488 7.784 -0.296 1
1 259 . 15 1 1 A 26 26 ASN HA H 26 4.702 4.788 -0.086 1
1 264 . 15 1 1 A 26 26 ASN C C 26 175.425 175.294 0.131 1
1 265 . 15 1 1 A 26 26 ASN CA C 26 51.584 52.257 -0.673 1
1 266 . 15 1 1 A 26 26 ASN CB C 26 37.243 38.592 -1.349 1
1 267 . 15 1 1 A 26 26 ASN N N 26 112.383 117.541 -5.158 1
1 269 . 15 1 1 A 27 27 ALA H H 27 7.716 7.038 0.678 1
1 270 . 15 1 1 A 27 27 ALA HA H 27 4.409 4.412 -0.003 1
1 274 . 15 1 1 A 27 27 ALA C C 27 175.850 175.850 0.000 1
1 275 . 15 1 1 A 27 27 ALA CA C 27 51.037 50.933 0.104 1
1 276 . 15 1 1 A 27 27 ALA CB C 27 18.152 18.295 -0.143 1
1 277 . 15 1 1 A 27 27 ALA N N 27 125.139 122.263 2.876 1
1 278 . 15 1 1 A 28 28 PRO HA H 28 4.422 4.522 -0.100 1
1 285 . 15 1 1 A 28 28 PRO C C 28 178.442 177.083 1.359 1
1 286 . 15 1 1 A 28 28 PRO CA C 28 62.067 62.718 -0.651 1
1 287 . 15 1 1 A 28 28 PRO CB C 28 32.642 32.355 0.287 1
1 290 . 15 1 1 A 29 29 VAL H H 29 8.691 8.320 0.371 1
1 291 . 15 1 1 A 29 29 VAL HA H 29 3.239 3.620 -0.381 1
1 299 . 15 1 1 A 29 29 VAL C C 29 176.887 177.240 -0.353 1
1 300 . 15 1 1 A 29 29 VAL CA C 29 65.812 64.172 1.640 1
1 301 . 15 1 1 A 29 29 VAL CB C 29 31.174 31.545 -0.371 1
1 304 . 15 1 1 A 29 29 VAL N N 29 123.592 122.877 0.715 1
1 305 . 15 1 1 A 30 30 GLY H H 30 9.197 8.733 0.464 1
1 306 . 15 1 1 A 30 30 GLY HA2 H 30 4.486 3.995 0.491 1
1 307 . 15 1 1 A 30 30 GLY HA3 H 30 3.581 3.998 -0.417 1
1 308 . 15 1 1 A 30 30 GLY C C 30 174.347 174.592 -0.245 1
1 309 . 15 1 1 A 30 30 GLY CA C 30 44.320 44.893 -0.573 1
1 310 . 15 1 1 A 30 30 GLY N N 30 116.042 115.637 0.405 1
1 311 . 15 1 1 A 31 31 THR H H 31 7.838 7.323 0.515 1
1 312 . 15 1 1 A 31 31 THR HA H 31 3.959 4.211 -0.252 1
1 317 . 15 1 1 A 31 31 THR C C 31 174.274 174.191 0.083 1
1 318 . 15 1 1 A 31 31 THR CA C 31 65.160 63.245 1.915 1
1 319 . 15 1 1 A 31 31 THR CB C 31 69.972 69.260 0.712 1
1 321 . 15 1 1 A 31 31 THR N N 31 117.679 117.521 0.158 1
1 322 . 15 1 1 A 32 32 SER H H 32 9.022 9.027 -0.005 1
1 323 . 15 1 1 A 32 32 SER HA H 32 4.273 4.383 -0.110 1
1 326 . 15 1 1 A 32 32 SER C C 32 172.692 173.940 -1.248 1
1 327 . 15 1 1 A 32 32 SER CA C 32 59.642 58.734 0.908 1
1 328 . 15 1 1 A 32 32 SER CB C 32 63.102 62.945 0.157 1
1 329 . 15 1 1 A 32 32 SER N N 32 123.045 122.167 0.878 1
1 330 . 15 1 1 A 33 33 VAL H H 33 9.202 8.894 0.308 1
1 331 . 15 1 1 A 33 33 VAL HA H 33 3.844 3.905 -0.061 1
1 339 . 15 1 1 A 33 33 VAL C C 33 174.782 175.823 -1.041 1
1 340 . 15 1 1 A 33 33 VAL CA C 33 64.242 65.053 -0.811 1
1 341 . 15 1 1 A 33 33 VAL CB C 33 32.893 32.197 0.696 1
1 344 . 15 1 1 A 33 33 VAL N N 33 126.861 127.708 -0.847 1
1 345 . 15 1 1 A 34 34 ILE H H 34 7.074 7.441 -0.367 1
1 346 . 15 1 1 A 34 34 ILE HA H 34 4.295 4.662 -0.367 1
1 356 . 15 1 1 A 34 34 ILE C C 34 170.577 173.295 -2.718 1
1 357 . 15 1 1 A 34 34 ILE CA C 34 59.500 59.232 0.268 1
1 358 . 15 1 1 A 34 34 ILE CB C 34 39.251 42.081 -2.830 1
1 362 . 15 1 1 A 34 34 ILE N N 34 111.445 119.197 -7.752 1
1 363 . 15 1 1 A 35 35 GLN H H 35 8.450 8.953 -0.503 1
1 364 . 15 1 1 A 35 35 GLN HA H 35 4.633 4.905 -0.272 1
1 371 . 15 1 1 A 35 35 GLN C C 35 174.354 175.104 -0.750 1
1 372 . 15 1 1 A 35 35 GLN CA C 35 54.176 54.213 -0.037 1
1 373 . 15 1 1 A 35 35 GLN CB C 35 29.456 31.700 -2.244 1
1 375 . 15 1 1 A 35 35 GLN N N 35 127.342 128.771 -1.429 1
1 377 . 15 1 1 A 36 36 LEU H H 36 7.761 8.269 -0.508 1
1 378 . 15 1 1 A 36 36 LEU HA H 36 4.492 4.397 0.095 1
1 388 . 15 1 1 A 36 36 LEU C C 36 175.543 176.259 -0.716 1
1 389 . 15 1 1 A 36 36 LEU CA C 36 53.982 55.073 -1.091 1
1 390 . 15 1 1 A 36 36 LEU CB C 36 42.776 42.415 0.361 1
1 394 . 15 1 1 A 36 36 LEU N N 36 128.895 127.727 1.168 1
1 395 . 15 1 1 A 37 37 HIS H H 37 8.529 8.944 -0.415 1
1 396 . 15 1 1 A 37 37 HIS HA H 37 4.851 5.451 -0.600 1
1 400 . 15 1 1 A 37 37 HIS C C 37 172.985 173.642 -0.657 1
1 401 . 15 1 1 A 37 37 HIS CA C 37 55.833 53.472 2.361 1
1 402 . 15 1 1 A 37 37 HIS CB C 37 32.204 31.935 0.269 1
1 404 . 15 1 1 A 37 37 HIS N N 37 115.903 124.640 -8.737 1
1 405 . 15 1 1 A 38 38 ALA H H 38 8.474 8.872 -0.398 1
1 406 . 15 1 1 A 38 38 ALA HA H 38 4.691 4.886 -0.195 1
1 410 . 15 1 1 A 38 38 ALA C C 38 175.548 176.029 -0.481 1
1 411 . 15 1 1 A 38 38 ALA CA C 38 50.491 50.830 -0.339 1
1 412 . 15 1 1 A 38 38 ALA CB C 38 19.842 20.658 -0.816 1
1 413 . 15 1 1 A 38 38 ALA N N 38 128.891 130.455 -1.564 1
1 414 . 15 1 1 A 39 39 THR H H 39 8.095 8.748 -0.653 1
1 415 . 15 1 1 A 39 39 THR HA H 39 4.336 5.249 -0.913 1
1 420 . 15 1 1 A 39 39 THR C C 39 173.553 173.285 0.268 1
1 421 . 15 1 1 A 39 39 THR CA C 39 60.417 59.950 0.467 1
1 422 . 15 1 1 A 39 39 THR CB C 39 70.912 72.033 -1.121 1
1 424 . 15 1 1 A 39 39 THR N N 39 110.982 115.306 -4.324 1
1 425 . 15 1 1 A 40 40 ASP H H 40 8.417 8.840 -0.423 1
1 426 . 15 1 1 A 40 40 ASP HA H 40 4.553 5.352 -0.799 1
1 429 . 15 1 1 A 40 40 ASP C C 40 176.462 175.247 1.215 1
1 430 . 15 1 1 A 40 40 ASP CA C 40 54.158 52.964 1.194 1
1 431 . 15 1 1 A 40 40 ASP CB C 40 41.517 41.669 -0.152 1
1 432 . 15 1 1 A 40 40 ASP N N 40 121.450 118.875 2.575 1
1 433 . 15 1 1 A 41 41 ALA H H 41 8.435 8.712 -0.277 1
1 434 . 15 1 1 A 41 41 ALA HA H 41 4.129 4.170 -0.041 1
1 438 . 15 1 1 A 41 41 ALA C C 41 177.718 179.195 -1.477 1
1 439 . 15 1 1 A 41 41 ALA CA C 41 53.436 55.067 -1.631 1
1 440 . 15 1 1 A 41 41 ALA CB C 41 19.183 18.870 0.313 1
1 441 . 15 1 1 A 41 41 ALA N N 41 124.607 126.538 -1.931 1
1 442 . 15 1 1 A 42 42 ASP H H 42 8.310 8.238 0.072 1
1 443 . 15 1 1 A 42 42 ASP HA H 42 4.588 4.588 0.000 1
1 446 . 15 1 1 A 42 42 ASP C C 42 176.546 176.217 0.329 1
1 447 . 15 1 1 A 42 42 ASP CA C 42 54.599 56.512 -1.913 1
1 448 . 15 1 1 A 42 42 ASP CB C 42 41.146 41.050 0.096 1
1 449 . 15 1 1 A 42 42 ASP N N 42 118.030 115.817 2.213 1
1 450 . 15 1 1 A 43 43 ILE H H 43 8.000 7.690 0.310 1
1 451 . 15 1 1 A 43 43 ILE HA H 43 4.130 3.759 0.371 1
1 461 . 15 1 1 A 43 43 ILE C C 43 176.901 177.092 -0.191 1
1 462 . 15 1 1 A 43 43 ILE CA C 43 61.740 62.994 -1.254 1
1 463 . 15 1 1 A 43 43 ILE CB C 43 38.491 37.550 0.941 1
1 467 . 15 1 1 A 43 43 ILE N N 43 119.301 120.645 -1.344 1
1 468 . 15 1 1 A 44 44 GLY H H 44 8.448 8.979 -0.531 1
1 469 . 15 1 1 A 44 44 GLY HA2 H 44 3.939 3.928 0.011 1
1 470 . 15 1 1 A 44 44 GLY HA3 H 44 3.939 3.935 0.004 1
1 471 . 15 1 1 A 44 44 GLY C C 44 174.393 175.107 -0.714 1
1 472 . 15 1 1 A 44 44 GLY CA C 44 45.501 46.642 -1.141 1
1 473 . 15 1 1 A 44 44 GLY N N 44 111.333 117.608 -6.275 1
1 474 . 15 1 1 A 45 45 SER H H 45 8.061 8.193 -0.132 1
1 475 . 15 1 1 A 45 45 SER HA H 45 4.416 4.021 0.395 1
1 478 . 15 1 1 A 45 45 SER C C 45 174.480 174.595 -0.115 1
1 479 . 15 1 1 A 45 45 SER CA C 45 58.478 62.484 -4.006 1
1 480 . 15 1 1 A 45 45 SER CB C 45 63.943 63.292 0.651 1
1 481 . 15 1 1 A 45 45 SER N N 45 115.551 117.699 -2.148 1
1 482 . 15 1 1 A 46 46 ASN H H 46 8.547 8.051 0.496 1
1 483 . 15 1 1 A 46 46 ASN HA H 46 4.725 5.155 -0.430 1
1 488 . 15 1 1 A 46 46 ASN C C 46 175.031 174.072 0.959 1
1 489 . 15 1 1 A 46 46 ASN CA C 46 53.277 51.809 1.468 1
1 490 . 15 1 1 A 46 46 ASN CB C 46 38.798 40.053 -1.255 1
1 491 . 15 1 1 A 46 46 ASN N N 46 120.698 118.108 2.590 1
1 493 . 15 1 1 A 47 47 ALA H H 47 8.239 8.793 -0.554 1
1 494 . 15 1 1 A 47 47 ALA HA H 47 4.283 5.011 -0.728 1
1 498 . 15 1 1 A 47 47 ALA C C 47 177.240 176.056 1.184 1
1 499 . 15 1 1 A 47 47 ALA CA C 47 52.731 51.414 1.317 1
1 500 . 15 1 1 A 47 47 ALA CB C 47 19.594 22.878 -3.284 1
1 501 . 15 1 1 A 47 47 ALA N N 47 124.093 126.865 -2.772 1
1 502 . 15 1 1 A 48 48 GLU H H 48 8.376 8.620 -0.244 1
1 503 . 15 1 1 A 48 48 GLU HA H 48 4.264 4.574 -0.310 1
1 508 . 15 1 1 A 48 48 GLU C C 48 175.702 175.467 0.235 1
1 509 . 15 1 1 A 48 48 GLU CA C 48 55.992 55.011 0.981 1
1 510 . 15 1 1 A 48 48 GLU CB C 48 30.210 29.259 0.951 1
1 512 . 15 1 1 A 48 48 GLU N N 48 119.750 122.028 -2.278 1
1 513 . 15 1 1 A 49 49 ILE H H 49 7.806 8.028 -0.222 1
1 514 . 15 1 1 A 49 49 ILE HA H 49 3.919 3.938 -0.019 1
1 524 . 15 1 1 A 49 49 ILE C C 49 175.894 175.170 0.724 1
1 525 . 15 1 1 A 49 49 ILE CA C 49 60.559 61.943 -1.384 1
1 526 . 15 1 1 A 49 49 ILE CB C 49 37.860 37.353 0.507 1
1 530 . 15 1 1 A 49 49 ILE N N 49 122.772 124.530 -1.758 1
1 531 . 15 1 1 A 50 50 ARG H H 50 8.247 8.477 -0.230 1
1 532 . 15 1 1 A 50 50 ARG HA H 50 4.999 4.694 0.305 1
1 539 . 15 1 1 A 50 50 ARG C C 50 174.603 174.707 -0.104 1
1 540 . 15 1 1 A 50 50 ARG CA C 50 53.189 54.850 -1.661 1
1 541 . 15 1 1 A 50 50 ARG CB C 50 33.152 32.828 0.324 1
1 544 . 15 1 1 A 50 50 ARG N N 50 126.912 127.252 -0.340 1
1 545 . 15 1 1 A 51 51 TYR H H 51 9.041 8.981 0.060 1
1 546 . 15 1 1 A 51 51 TYR HA H 51 5.395 5.681 -0.286 1
1 553 . 15 1 1 A 51 51 TYR C C 51 175.555 175.493 0.062 1
1 554 . 15 1 1 A 51 51 TYR CA C 51 56.909 56.212 0.697 1
1 555 . 15 1 1 A 51 51 TYR CB C 51 40.116 41.630 -1.514 1
1 560 . 15 1 1 A 51 51 TYR N N 51 121.627 121.706 -0.079 1
1 561 . 15 1 1 A 52 52 ILE H H 52 8.850 8.362 0.488 1
1 562 . 15 1 1 A 52 52 ILE HA H 52 4.576 4.837 -0.261 1
1 572 . 15 1 1 A 52 52 ILE C C 52 175.371 174.958 0.413 1
1 573 . 15 1 1 A 52 52 ILE CA C 52 59.624 58.867 0.757 1
1 574 . 15 1 1 A 52 52 ILE CB C 52 42.895 42.117 0.778 1
1 578 . 15 1 1 A 52 52 ILE N N 52 117.697 117.321 0.376 1
1 579 . 15 1 1 A 53 53 PHE H H 53 8.748 8.692 0.056 1
1 580 . 15 1 1 A 53 53 PHE HA H 53 5.132 4.622 0.510 1
1 588 . 15 1 1 A 53 53 PHE C C 53 178.146 176.459 1.687 1
1 589 . 15 1 1 A 53 53 PHE CA C 53 57.667 57.791 -0.124 1
1 590 . 15 1 1 A 53 53 PHE CB C 53 39.614 39.484 0.130 1
1 596 . 15 1 1 A 53 53 PHE N N 53 121.433 122.112 -0.679 1
1 597 . 15 1 1 A 54 54 GLY H H 54 8.538 8.431 0.107 1
1 598 . 15 1 1 A 54 54 GLY HA2 H 54 4.074 4.112 -0.038 1
1 599 . 15 1 1 A 54 54 GLY HA3 H 54 3.840 4.112 -0.272 1
1 600 . 15 1 1 A 54 54 GLY C C 54 174.530 172.891 1.639 1
1 601 . 15 1 1 A 54 54 GLY CA C 54 44.884 44.493 0.391 1
1 602 . 15 1 1 A 54 54 GLY N N 54 106.444 110.277 -3.833 1
1 603 . 15 1 1 A 55 55 ALA H H 55 8.594 8.187 0.407 1
1 604 . 15 1 1 A 55 55 ALA HA H 55 4.172 4.786 -0.614 1
1 608 . 15 1 1 A 55 55 ALA C C 55 178.718 177.095 1.623 1
1 609 . 15 1 1 A 55 55 ALA CA C 55 54.423 50.737 3.686 1
1 610 . 15 1 1 A 55 55 ALA CB C 55 19.059 21.051 -1.992 1
1 611 . 15 1 1 A 55 55 ALA N N 55 123.470 122.268 1.202 1
1 612 . 15 1 1 A 56 56 GLN H H 56 8.727 8.707 0.020 1
1 613 . 15 1 1 A 56 56 GLN HA H 56 4.367 3.758 0.609 1
1 620 . 15 1 1 A 56 56 GLN C C 56 176.134 174.710 1.424 1
1 621 . 15 1 1 A 56 56 GLN CA C 56 55.660 56.694 -1.034 1
1 622 . 15 1 1 A 56 56 GLN CB C 56 28.152 26.826 1.326 1
1 624 . 15 1 1 A 56 56 GLN N N 56 114.221 115.445 -1.224 1
1 626 . 15 1 1 A 57 57 VAL H H 57 7.204 7.885 -0.681 1
1 627 . 15 1 1 A 57 57 VAL HA H 57 3.889 4.139 -0.250 1
1 635 . 15 1 1 A 57 57 VAL C C 57 175.371 175.266 0.105 1
1 636 . 15 1 1 A 57 57 VAL CA C 57 63.908 61.822 2.086 1
1 637 . 15 1 1 A 57 57 VAL CB C 57 31.557 32.601 -1.044 1
1 640 . 15 1 1 A 57 57 VAL N N 57 121.341 119.888 1.453 1
1 641 . 15 1 1 A 58 58 ALA H H 58 8.920 8.584 0.336 1
1 642 . 15 1 1 A 58 58 ALA HA H 58 4.547 4.428 0.119 1
1 646 . 15 1 1 A 58 58 ALA C C 58 177.064 177.804 -0.740 1
1 647 . 15 1 1 A 58 58 ALA CA C 58 51.173 50.689 0.484 1
1 648 . 15 1 1 A 58 58 ALA CB C 58 17.842 17.732 0.110 1
1 649 . 15 1 1 A 58 58 ALA N N 58 132.726 130.196 2.530 1
1 650 . 15 1 1 A 59 59 PRO HA H 59 4.101 4.234 -0.133 1
1 657 . 15 1 1 A 59 59 PRO C C 59 179.482 178.532 0.950 1
1 658 . 15 1 1 A 59 59 PRO CA C 59 66.060 65.224 0.836 1
1 659 . 15 1 1 A 59 59 PRO CB C 59 31.951 31.911 0.040 1
1 662 . 15 1 1 A 60 60 ALA H H 60 8.706 8.242 0.464 1
1 663 . 15 1 1 A 60 60 ALA HA H 60 4.057 4.013 0.044 1
1 667 . 15 1 1 A 60 60 ALA C C 60 179.627 180.288 -0.661 1
1 668 . 15 1 1 A 60 60 ALA CA C 60 55.305 55.448 -0.143 1
1 669 . 15 1 1 A 60 60 ALA CB C 60 18.737 18.751 -0.014 1
1 670 . 15 1 1 A 60 60 ALA N N 60 117.882 118.745 -0.863 1
1 671 . 15 1 1 A 61 61 THR H H 61 7.312 8.173 -0.861 1
1 672 . 15 1 1 A 61 61 THR HA H 61 4.153 4.040 0.113 1
1 677 . 15 1 1 A 61 61 THR C C 61 175.824 176.718 -0.894 1
1 678 . 15 1 1 A 61 61 THR CA C 61 66.412 67.056 -0.644 1
1 679 . 15 1 1 A 61 61 THR CB C 61 68.787 68.816 -0.029 1
1 681 . 15 1 1 A 61 61 THR N N 61 114.483 115.035 -0.552 1
1 682 . 15 1 1 A 62 62 LYS H H 62 7.556 7.384 0.172 1
1 683 . 15 1 1 A 62 62 LYS HA H 62 3.943 4.139 -0.196 1
1 692 . 15 1 1 A 62 62 LYS C C 62 176.884 177.780 -0.896 1
1 693 . 15 1 1 A 62 62 LYS CA C 62 59.095 58.606 0.489 1
1 694 . 15 1 1 A 62 62 LYS CB C 62 32.204 32.047 0.157 1
1 698 . 15 1 1 A 62 62 LYS N N 62 118.994 119.404 -0.410 1
1 699 . 15 1 1 A 63 63 ARG H H 63 7.474 7.723 -0.249 1
1 700 . 15 1 1 A 63 63 ARG HA H 63 4.034 4.203 -0.169 1
1 707 . 15 1 1 A 63 63 ARG C C 63 177.574 178.222 -0.648 1
1 708 . 15 1 1 A 63 63 ARG CA C 63 58.143 58.441 -0.298 1
1 709 . 15 1 1 A 63 63 ARG CB C 63 30.755 30.390 0.365 1
1 712 . 15 1 1 A 63 63 ARG N N 63 114.251 118.797 -4.546 1
1 713 . 15 1 1 A 64 64 LEU H H 64 6.991 7.362 -0.371 1
1 714 . 15 1 1 A 64 64 LEU HA H 64 3.904 4.091 -0.187 1
1 724 . 15 1 1 A 64 64 LEU C C 64 176.632 176.273 0.359 1
1 725 . 15 1 1 A 64 64 LEU CA C 64 56.503 56.109 0.394 1
1 726 . 15 1 1 A 64 64 LEU CB C 64 42.929 43.536 -0.607 1
1 730 . 15 1 1 A 64 64 LEU N N 64 116.109 117.696 -1.587 1
1 731 . 15 1 1 A 65 65 PHE H H 65 7.673 8.033 -0.360 1
1 732 . 15 1 1 A 65 65 PHE HA H 65 5.386 5.266 0.120 1
1 740 . 15 1 1 A 65 65 PHE C C 65 173.067 174.290 -1.223 1
1 741 . 15 1 1 A 65 65 PHE CA C 65 56.521 56.623 -0.102 1
1 742 . 15 1 1 A 65 65 PHE CB C 65 41.270 41.553 -0.283 1
1 748 . 15 1 1 A 65 65 PHE N N 65 116.182 115.453 0.729 1
1 749 . 15 1 1 A 66 66 ALA H H 66 8.914 8.858 0.056 1
1 750 . 15 1 1 A 66 66 ALA HA H 66 4.748 5.089 -0.341 1
1 754 . 15 1 1 A 66 66 ALA C C 66 175.223 175.656 -0.433 1
1 755 . 15 1 1 A 66 66 ALA CA C 66 50.050 50.607 -0.557 1
1 756 . 15 1 1 A 66 66 ALA CB C 66 21.161 20.485 0.676 1
1 757 . 15 1 1 A 66 66 ALA N N 66 122.870 126.142 -3.272 1
1 758 . 15 1 1 A 67 67 LEU H H 67 8.498 9.067 -0.569 1
1 759 . 15 1 1 A 67 67 LEU HA H 67 4.713 5.395 -0.682 1
1 769 . 15 1 1 A 67 67 LEU C C 67 175.146 174.767 0.379 1
1 770 . 15 1 1 A 67 67 LEU CA C 67 52.518 53.579 -1.061 1
1 771 . 15 1 1 A 67 67 LEU CB C 67 45.308 44.711 0.597 1
1 775 . 15 1 1 A 67 67 LEU N N 67 122.208 126.602 -4.394 1
1 776 . 15 1 1 A 68 68 ASN H H 68 8.357 8.832 -0.475 1
1 777 . 15 1 1 A 68 68 ASN HA H 68 4.679 5.104 -0.425 1
1 782 . 15 1 1 A 68 68 ASN C C 68 176.228 174.882 1.346 1
1 783 . 15 1 1 A 68 68 ASN CA C 68 53.524 52.093 1.431 1
1 784 . 15 1 1 A 68 68 ASN CB C 68 39.580 40.836 -1.256 1
1 785 . 15 1 1 A 68 68 ASN N N 68 126.940 123.575 3.365 1
1 787 . 15 1 1 A 69 69 ASN H H 69 8.861 9.112 -0.251 1
1 788 . 15 1 1 A 69 69 ASN HA H 69 5.137 5.262 -0.125 1
1 793 . 15 1 1 A 69 69 ASN C C 69 175.631 176.478 -0.847 1
1 794 . 15 1 1 A 69 69 ASN CA C 69 56.009 53.621 2.388 1
1 795 . 15 1 1 A 69 69 ASN CB C 69 40.314 38.941 1.373 1
1 796 . 15 1 1 A 69 69 ASN N N 69 124.980 120.636 4.344 1
1 798 . 15 1 1 A 70 70 THR H H 70 8.635 7.843 0.792 1
1 799 . 15 1 1 A 70 70 THR HA H 70 4.815 4.586 0.229 1
1 804 . 15 1 1 A 70 70 THR C C 70 176.223 175.853 0.370 1
1 805 . 15 1 1 A 70 70 THR CA C 70 63.944 62.733 1.211 1
1 806 . 15 1 1 A 70 70 THR CB C 70 69.727 70.285 -0.558 1
1 808 . 15 1 1 A 70 70 THR N N 70 110.394 109.764 0.630 1
1 809 . 15 1 1 A 71 71 THR H H 71 8.069 7.934 0.135 1
1 810 . 15 1 1 A 71 71 THR HA H 71 4.566 4.572 -0.006 1
1 815 . 15 1 1 A 71 71 THR C C 71 176.213 175.767 0.446 1
1 816 . 15 1 1 A 71 71 THR CA C 71 61.683 62.037 -0.354 1
1 817 . 15 1 1 A 71 71 THR CB C 71 70.832 71.450 -0.618 1
1 819 . 15 1 1 A 71 71 THR N N 71 110.507 110.345 0.162 1
1 820 . 15 1 1 A 72 72 GLY H H 72 7.990 8.080 -0.090 1
1 821 . 15 1 1 A 72 72 GLY HA2 H 72 3.186 2.562 0.624 1
1 822 . 15 1 1 A 72 72 GLY HA3 H 72 2.516 3.505 -0.989 1
1 823 . 15 1 1 A 72 72 GLY C C 72 172.988 174.140 -1.152 1
1 824 . 15 1 1 A 72 72 GLY CA C 72 45.149 45.862 -0.713 1
1 825 . 15 1 1 A 72 72 GLY N N 72 110.788 112.261 -1.473 1
1 826 . 15 1 1 A 73 73 LEU H H 73 7.138 7.163 -0.025 1
1 827 . 15 1 1 A 73 73 LEU HA H 73 4.414 4.615 -0.201 1
1 837 . 15 1 1 A 73 73 LEU C C 73 176.836 174.448 2.388 1
1 838 . 15 1 1 A 73 73 LEU CA C 73 55.252 53.480 1.772 1
1 839 . 15 1 1 A 73 73 LEU CB C 73 43.574 44.982 -1.408 1
1 843 . 15 1 1 A 73 73 LEU N N 73 119.222 121.515 -2.293 1
1 844 . 15 1 1 A 74 74 ILE H H 74 8.925 9.002 -0.077 1
1 845 . 15 1 1 A 74 74 ILE HA H 74 5.555 4.728 0.827 1
1 855 . 15 1 1 A 74 74 ILE C C 74 175.978 175.921 0.057 1
1 856 . 15 1 1 A 74 74 ILE CA C 74 60.100 60.190 -0.090 1
1 857 . 15 1 1 A 74 74 ILE CB C 74 38.550 39.379 -0.829 1
1 861 . 15 1 1 A 74 74 ILE N N 74 129.871 126.037 3.834 1
1 862 . 15 1 1 A 75 75 THR H H 75 9.161 9.093 0.068 1
1 863 . 15 1 1 A 75 75 THR HA H 75 5.375 5.480 -0.105 1
1 868 . 15 1 1 A 75 75 THR C C 75 174.798 174.170 0.628 1
1 869 . 15 1 1 A 75 75 THR CA C 75 58.796 60.018 -1.222 1
1 870 . 15 1 1 A 75 75 THR CB C 75 72.978 70.905 2.073 1
1 872 . 15 1 1 A 75 75 THR N N 75 117.522 119.110 -1.588 1
1 873 . 15 1 1 A 76 76 VAL H H 76 8.327 8.628 -0.301 1
1 874 . 15 1 1 A 76 76 VAL HA H 76 3.973 4.131 -0.158 1
1 882 . 15 1 1 A 76 76 VAL C C 76 176.495 176.277 0.218 1
1 883 . 15 1 1 A 76 76 VAL CA C 76 64.085 62.171 1.914 1
1 884 . 15 1 1 A 76 76 VAL CB C 76 32.863 31.203 1.660 1
1 887 . 15 1 1 A 76 76 VAL N N 76 120.876 121.554 -0.678 1
1 888 . 15 1 1 A 77 77 GLN H H 77 9.525 9.190 0.335 1
1 889 . 15 1 1 A 77 77 GLN HA H 77 4.702 4.114 0.588 1
1 896 . 15 1 1 A 77 77 GLN C C 77 173.838 175.560 -1.722 1
1 897 . 15 1 1 A 77 77 GLN CA C 77 55.728 58.028 -2.300 1
1 898 . 15 1 1 A 77 77 GLN CB C 77 30.762 29.458 1.304 1
1 900 . 15 1 1 A 77 77 GLN N N 77 129.825 128.995 0.830 1
1 902 . 15 1 1 A 78 78 ARG H H 78 7.621 7.411 0.210 1
1 903 . 15 1 1 A 78 78 ARG HA H 78 4.347 4.619 -0.272 1
1 910 . 15 1 1 A 78 78 ARG C C 78 172.304 174.005 -1.701 1
1 911 . 15 1 1 A 78 78 ARG CA C 78 54.634 54.551 0.083 1
1 912 . 15 1 1 A 78 78 ARG CB C 78 34.685 32.775 1.910 1
1 915 . 15 1 1 A 78 78 ARG N N 78 120.595 115.452 5.143 1
1 916 . 15 1 1 A 79 79 SER H H 79 7.958 8.559 -0.601 1
1 917 . 15 1 1 A 79 79 SER HA H 79 4.030 4.312 -0.282 1
1 920 . 15 1 1 A 79 79 SER C C 79 174.311 174.128 0.183 1
1 921 . 15 1 1 A 79 79 SER CA C 79 59.889 59.032 0.857 1
1 922 . 15 1 1 A 79 79 SER CB C 79 63.548 63.421 0.127 1
1 923 . 15 1 1 A 79 79 SER N N 79 112.565 116.343 -3.778 1
1 924 . 15 1 1 A 80 80 LEU H H 80 8.715 8.198 0.517 1
1 925 . 15 1 1 A 80 80 LEU HA H 80 4.114 4.812 -0.698 1
1 935 . 15 1 1 A 80 80 LEU C C 80 176.057 175.518 0.539 1
1 936 . 15 1 1 A 80 80 LEU CA C 80 55.091 53.762 1.329 1
1 937 . 15 1 1 A 80 80 LEU CB C 80 42.341 43.407 -1.066 1
1 941 . 15 1 1 A 80 80 LEU N N 80 123.070 125.270 -2.200 1
1 942 . 15 1 1 A 81 81 ASP H H 81 7.298 9.101 -1.803 1
1 943 . 15 1 1 A 81 81 ASP HA H 81 4.725 4.943 -0.218 1
1 946 . 15 1 1 A 81 81 ASP C C 81 175.939 176.274 -0.335 1
1 947 . 15 1 1 A 81 81 ASP CA C 81 53.664 53.712 -0.048 1
1 948 . 15 1 1 A 81 81 ASP CB C 81 42.947 42.024 0.923 1
1 949 . 15 1 1 A 81 81 ASP N N 81 115.229 124.715 -9.486 1
1 950 . 15 1 1 A 82 82 ARG H H 82 9.289 8.943 0.346 1
1 951 . 15 1 1 A 82 82 ARG HA H 82 4.416 4.125 0.291 1
1 959 . 15 1 1 A 82 82 ARG C C 82 176.406 178.295 -1.889 1
1 960 . 15 1 1 A 82 82 ARG CA C 82 56.397 58.615 -2.218 1
1 961 . 15 1 1 A 82 82 ARG CB C 82 30.638 29.927 0.711 1
1 964 . 15 1 1 A 82 82 ARG N N 82 123.174 125.230 -2.056 1
1 966 . 15 1 1 A 83 83 GLU H H 83 8.468 7.960 0.508 1
1 967 . 15 1 1 A 83 83 GLU HA H 83 3.982 4.162 -0.180 1
1 972 . 15 1 1 A 83 83 GLU C C 83 177.740 177.350 0.390 1
1 973 . 15 1 1 A 83 83 GLU CA C 83 58.425 58.513 -0.088 1
1 974 . 15 1 1 A 83 83 GLU CB C 83 29.701 29.378 0.323 1
1 976 . 15 1 1 A 83 83 GLU N N 83 119.549 117.760 1.789 1
1 977 . 15 1 1 A 84 84 GLU H H 84 8.033 8.397 -0.364 1
1 978 . 15 1 1 A 84 84 GLU HA H 84 4.206 4.581 -0.375 1
1 983 . 15 1 1 A 84 84 GLU C C 84 176.837 175.992 0.845 1
1 984 . 15 1 1 A 84 84 GLU CA C 84 58.056 57.911 0.145 1
1 985 . 15 1 1 A 84 84 GLU CB C 84 30.432 32.380 -1.948 1
1 987 . 15 1 1 A 84 84 GLU N N 84 118.333 120.014 -1.681 1
1 988 . 15 1 1 A 85 85 THR H H 85 7.651 7.691 -0.040 1
1 989 . 15 1 1 A 85 85 THR HA H 85 4.307 4.555 -0.248 1
1 994 . 15 1 1 A 85 85 THR C C 85 171.568 174.289 -2.721 1
1 995 . 15 1 1 A 85 85 THR CA C 85 61.387 60.645 0.742 1
1 996 . 15 1 1 A 85 85 THR CB C 85 69.963 69.510 0.453 1
1 998 . 15 1 1 A 85 85 THR N N 85 112.444 112.588 -0.144 1
1 999 . 15 1 1 A 86 86 ALA H H 86 8.639 8.756 -0.117 1
1 1000 . 15 1 1 A 86 86 ALA HA H 86 4.603 4.235 0.368 1
1 1004 . 15 1 1 A 86 86 ALA C C 86 175.560 177.426 -1.866 1
1 1005 . 15 1 1 A 86 86 ALA CA C 86 52.156 54.379 -2.223 1
1 1006 . 15 1 1 A 86 86 ALA CB C 86 20.378 19.229 1.149 1
1 1007 . 15 1 1 A 86 86 ALA N N 86 127.705 130.926 -3.221 1
1 1008 . 15 1 1 A 87 87 ILE H H 87 7.663 7.806 -0.143 1
1 1009 . 15 1 1 A 87 87 ILE HA H 87 4.828 4.918 -0.090 1
1 1019 . 15 1 1 A 87 87 ILE C C 87 174.537 174.140 0.397 1
1 1020 . 15 1 1 A 87 87 ILE CA C 87 60.329 59.660 0.669 1
1 1021 . 15 1 1 A 87 87 ILE CB C 87 41.090 42.116 -1.026 1
1 1025 . 15 1 1 A 87 87 ILE N N 87 118.712 117.155 1.557 1
1 1026 . 15 1 1 A 88 88 HIS H H 88 9.098 8.800 0.298 1
1 1027 . 15 1 1 A 88 88 HIS HA H 88 4.576 5.457 -0.881 1
1 1032 . 15 1 1 A 88 88 HIS C C 88 174.354 174.566 -0.212 1
1 1033 . 15 1 1 A 88 88 HIS CA C 88 54.740 54.515 0.225 1
1 1034 . 15 1 1 A 88 88 HIS CB C 88 33.955 33.263 0.692 1
1 1037 . 15 1 1 A 88 88 HIS N N 88 126.285 124.732 1.553 1
1 1038 . 15 1 1 A 89 89 LYS H H 89 8.957 9.122 -0.165 1
1 1039 . 15 1 1 A 89 89 LYS HA H 89 4.873 4.784 0.089 1
1 1048 . 15 1 1 A 89 89 LYS C C 89 175.906 175.396 0.510 1
1 1049 . 15 1 1 A 89 89 LYS CA C 89 55.269 55.186 0.083 1
1 1050 . 15 1 1 A 89 89 LYS CB C 89 32.945 34.159 -1.214 1
1 1054 . 15 1 1 A 89 89 LYS N N 89 124.332 122.050 2.282 1
1 1055 . 15 1 1 A 90 90 VAL H H 90 9.174 8.779 0.395 1
1 1056 . 15 1 1 A 90 90 VAL HA H 90 4.227 4.857 -0.630 1
1 1064 . 15 1 1 A 90 90 VAL C C 90 174.168 174.638 -0.470 1
1 1065 . 15 1 1 A 90 90 VAL CA C 90 61.369 61.049 0.320 1
1 1066 . 15 1 1 A 90 90 VAL CB C 90 34.082 33.844 0.238 1
1 1069 . 15 1 1 A 90 90 VAL N N 90 124.319 125.295 -0.976 1
1 1070 . 15 1 1 A 91 91 THR H H 91 6.697 8.980 -2.283 1
1 1071 . 15 1 1 A 91 91 THR HA H 91 5.163 5.232 -0.069 1
1 1076 . 15 1 1 A 91 91 THR C C 91 173.812 174.347 -0.535 1
1 1077 . 15 1 1 A 91 91 THR CA C 91 61.935 62.260 -0.325 1
1 1078 . 15 1 1 A 91 91 THR CB C 91 70.412 69.525 0.887 1
1 1080 . 15 1 1 A 91 91 THR N N 91 122.637 123.217 -0.580 1
1 1081 . 15 1 1 A 92 92 VAL H H 92 9.292 9.176 0.116 1
1 1082 . 15 1 1 A 92 92 VAL HA H 92 4.736 4.570 0.166 1
1 1090 . 15 1 1 A 92 92 VAL C C 92 173.160 175.131 -1.971 1
1 1091 . 15 1 1 A 92 92 VAL CA C 92 60.982 61.411 -0.429 1
1 1092 . 15 1 1 A 92 92 VAL CB C 92 35.130 33.021 2.109 1
1 1095 . 15 1 1 A 92 92 VAL N N 92 128.265 128.398 -0.133 1
1 1096 . 15 1 1 A 93 93 LEU H H 93 9.495 8.773 0.722 1
1 1097 . 15 1 1 A 93 93 LEU HA H 93 5.628 5.573 0.055 1
1 1107 . 15 1 1 A 93 93 LEU C C 93 176.274 175.395 0.879 1
1 1108 . 15 1 1 A 93 93 LEU CA C 93 52.773 53.519 -0.746 1
1 1109 . 15 1 1 A 93 93 LEU CB C 93 43.454 44.620 -1.166 1
1 1113 . 15 1 1 A 93 93 LEU N N 93 126.350 127.101 -0.751 1
1 1114 . 15 1 1 A 94 94 ALA H H 94 8.688 9.104 -0.416 1
1 1115 . 15 1 1 A 94 94 ALA HA H 94 4.986 4.937 0.049 1
1 1119 . 15 1 1 A 94 94 ALA C C 94 175.787 175.366 0.421 1
1 1120 . 15 1 1 A 94 94 ALA CA C 94 49.610 50.242 -0.632 1
1 1121 . 15 1 1 A 94 94 ALA CB C 94 21.463 20.305 1.158 1
1 1122 . 15 1 1 A 94 94 ALA N N 94 123.429 127.681 -4.252 1
1 1123 . 15 1 1 A 95 95 SER H H 95 8.401 8.200 0.201 1
1 1124 . 15 1 1 A 95 95 SER HA H 95 4.828 4.744 0.084 1
1 1127 . 15 1 1 A 95 95 SER C C 95 174.327 173.940 0.387 1
1 1128 . 15 1 1 A 95 95 SER CA C 95 56.239 56.307 -0.068 1
1 1129 . 15 1 1 A 95 95 SER CB C 95 65.561 64.448 1.113 1
1 1130 . 15 1 1 A 95 95 SER N N 95 114.418 119.282 -4.864 1
1 1131 . 15 1 1 A 96 96 ASP H H 96 8.690 9.029 -0.339 1
1 1132 . 15 1 1 A 96 96 ASP HA H 96 4.908 4.572 0.336 1
1 1135 . 15 1 1 A 96 96 ASP C C 96 177.096 176.111 0.985 1
1 1136 . 15 1 1 A 96 96 ASP CA C 96 52.818 55.661 -2.843 1
1 1137 . 15 1 1 A 96 96 ASP CB C 96 41.253 41.821 -0.568 1
1 1138 . 15 1 1 A 96 96 ASP N N 96 125.624 128.442 -2.818 1
1 1139 . 15 1 1 A 97 97 GLY H H 97 8.524 7.229 1.295 1
1 1140 . 15 1 1 A 97 97 GLY HA2 H 97 4.320 4.021 0.299 1
1 1141 . 15 1 1 A 97 97 GLY HA3 H 97 3.620 4.022 -0.402 1
1 1142 . 15 1 1 A 97 97 GLY C C 97 174.620 173.744 0.876 1
1 1143 . 15 1 1 A 97 97 GLY CA C 97 45.422 45.608 -0.186 1
1 1144 . 15 1 1 A 97 97 GLY N N 97 109.283 105.925 3.358 1
1 1145 . 15 1 1 A 98 98 SER H H 98 8.575 9.220 -0.645 1
1 1146 . 15 1 1 A 98 98 SER HA H 98 4.607 4.139 0.468 1
1 1149 . 15 1 1 A 98 98 SER C C 98 174.478 173.091 1.387 1
1 1150 . 15 1 1 A 98 98 SER CA C 98 59.095 59.302 -0.207 1
1 1151 . 15 1 1 A 98 98 SER CB C 98 64.800 62.189 2.611 1
1 1152 . 15 1 1 A 98 98 SER N N 98 116.640 119.100 -2.460 1
1 1153 . 15 1 1 A 99 99 SER H H 99 8.945 7.710 1.235 1
1 1154 . 15 1 1 A 99 99 SER HA H 99 4.530 4.636 -0.106 1
1 1157 . 15 1 1 A 99 99 SER C C 99 174.491 172.472 2.019 1
1 1158 . 15 1 1 A 99 99 SER CA C 99 58.460 57.397 1.063 1
1 1159 . 15 1 1 A 99 99 SER CB C 99 64.146 65.056 -0.910 1
1 1160 . 15 1 1 A 99 99 SER N N 99 117.676 114.400 3.276 1
1 1161 . 15 1 1 A 100 100 THR H H 100 8.411 8.515 -0.104 1
1 1162 . 15 1 1 A 100 100 THR HA H 100 4.490 4.552 -0.062 1
1 1167 . 15 1 1 A 100 100 THR C C 100 172.766 173.714 -0.948 1
1 1168 . 15 1 1 A 100 100 THR CA C 100 60.629 60.385 0.244 1
1 1169 . 15 1 1 A 100 100 THR CB C 100 69.778 68.836 0.942 1
1 1171 . 15 1 1 A 100 100 THR N N 100 118.401 118.355 0.046 1
1 1172 . 15 1 1 A 101 101 PRO HA H 101 4.631 4.702 -0.071 1
1 1179 . 15 1 1 A 101 101 PRO C C 101 177.227 176.206 1.021 1
1 1180 . 15 1 1 A 101 101 PRO CA C 101 63.097 62.406 0.691 1
1 1181 . 15 1 1 A 101 101 PRO CB C 101 32.917 32.193 0.724 1
1 1184 . 15 1 1 A 102 102 ALA H H 102 8.497 7.965 0.532 1
1 1185 . 15 1 1 A 102 102 ALA HA H 102 4.619 4.630 -0.011 1
1 1189 . 15 1 1 A 102 102 ALA C C 102 176.542 176.902 -0.360 1
1 1190 . 15 1 1 A 102 102 ALA CA C 102 51.390 51.419 -0.029 1
1 1191 . 15 1 1 A 102 102 ALA CB C 102 20.815 20.677 0.138 1
1 1192 . 15 1 1 A 102 102 ALA N N 102 124.487 122.939 1.548 1
1 1193 . 15 1 1 A 103 103 ARG H H 103 8.663 8.618 0.045 1
1 1194 . 15 1 1 A 103 103 ARG HA H 103 5.515 5.107 0.408 1
1 1201 . 15 1 1 A 103 103 ARG C C 103 174.539 174.812 -0.273 1
1 1202 . 15 1 1 A 103 103 ARG CA C 103 55.164 54.244 0.920 1
1 1203 . 15 1 1 A 103 103 ARG CB C 103 34.393 32.304 2.089 1
1 1206 . 15 1 1 A 103 103 ARG N N 103 119.596 117.782 1.814 1
1 1207 . 15 1 1 A 104 104 ALA H H 104 9.027 8.955 0.072 1
1 1208 . 15 1 1 A 104 104 ALA HA H 104 4.782 5.216 -0.434 1
1 1212 . 15 1 1 A 104 104 ALA C C 104 176.276 175.448 0.828 1
1 1213 . 15 1 1 A 104 104 ALA CA C 104 50.297 50.165 0.132 1
1 1214 . 15 1 1 A 104 104 ALA CB C 104 20.810 21.119 -0.309 1
1 1215 . 15 1 1 A 104 104 ALA N N 104 126.962 126.847 0.115 1
1 1216 . 15 1 1 A 105 105 THR H H 105 8.384 8.638 -0.254 1
1 1217 . 15 1 1 A 105 105 THR HA H 105 4.954 4.922 0.032 1
1 1222 . 15 1 1 A 105 105 THR C C 105 173.243 174.048 -0.805 1
1 1223 . 15 1 1 A 105 105 THR CA C 105 61.475 61.713 -0.238 1
1 1224 . 15 1 1 A 105 105 THR CB C 105 70.569 69.697 0.872 1
1 1226 . 15 1 1 A 105 105 THR N N 105 115.327 119.144 -3.817 1
1 1227 . 15 1 1 A 106 106 VAL H H 106 8.970 8.844 0.126 1
1 1228 . 15 1 1 A 106 106 VAL HA H 106 4.702 4.595 0.107 1
1 1236 . 15 1 1 A 106 106 VAL C C 106 174.743 174.982 -0.239 1
1 1237 . 15 1 1 A 106 106 VAL CA C 106 59.712 60.660 -0.948 1
1 1238 . 15 1 1 A 106 106 VAL CB C 106 34.327 33.256 1.071 1
1 1241 . 15 1 1 A 106 106 VAL N N 106 126.226 128.133 -1.907 1
1 1242 . 15 1 1 A 107 107 THR H H 107 8.833 8.767 0.066 1
1 1243 . 15 1 1 A 107 107 THR HA H 107 4.862 4.885 -0.023 1
1 1248 . 15 1 1 A 107 107 THR C C 107 172.970 173.747 -0.777 1
1 1249 . 15 1 1 A 107 107 THR CA C 107 62.322 62.006 0.316 1
1 1250 . 15 1 1 A 107 107 THR CB C 107 69.463 69.251 0.212 1
1 1252 . 15 1 1 A 107 107 THR N N 107 125.403 123.104 2.299 1
1 1253 . 15 1 1 A 108 108 ILE H H 108 9.234 9.044 0.190 1
1 1254 . 15 1 1 A 108 108 ILE HA H 108 4.178 4.647 -0.469 1
1 1264 . 15 1 1 A 108 108 ILE C C 108 174.087 174.918 -0.831 1
1 1265 . 15 1 1 A 108 108 ILE CA C 108 60.365 60.316 0.049 1
1 1266 . 15 1 1 A 108 108 ILE CB C 108 39.745 37.835 1.910 1
1 1270 . 15 1 1 A 108 108 ILE N N 108 127.152 128.483 -1.331 1
1 1271 . 15 1 1 A 109 109 ASN H H 109 8.723 8.552 0.171 1
1 1272 . 15 1 1 A 109 109 ASN HA H 109 5.147 5.230 -0.083 1
1 1277 . 15 1 1 A 109 109 ASN C C 109 173.592 174.684 -1.092 1
1 1278 . 15 1 1 A 109 109 ASN CA C 109 52.501 52.920 -0.419 1
1 1279 . 15 1 1 A 109 109 ASN CB C 109 40.791 40.067 0.724 1
1 1280 . 15 1 1 A 109 109 ASN N N 109 126.866 125.939 0.927 1
1 1282 . 15 1 1 A 110 110 VAL H H 110 9.046 8.781 0.265 1
1 1283 . 15 1 1 A 110 110 VAL HA H 110 5.081 4.674 0.407 1
1 1291 . 15 1 1 A 110 110 VAL C C 110 176.921 176.293 0.628 1
1 1292 . 15 1 1 A 110 110 VAL CA C 110 61.634 62.148 -0.514 1
1 1293 . 15 1 1 A 110 110 VAL CB C 110 31.809 31.968 -0.159 1
1 1296 . 15 1 1 A 110 110 VAL N N 110 126.070 124.322 1.748 1
1 1297 . 15 1 1 A 111 111 THR H H 111 9.197 8.349 0.848 1
1 1298 . 15 1 1 A 111 111 THR HA H 111 4.566 4.845 -0.279 1
1 1303 . 15 1 1 A 111 111 THR C C 111 174.087 174.495 -0.408 1
1 1304 . 15 1 1 A 111 111 THR CA C 111 61.145 60.312 0.833 1
1 1305 . 15 1 1 A 111 111 THR CB C 111 70.706 70.837 -0.131 1
1 1307 . 15 1 1 A 111 111 THR N N 111 121.425 118.525 2.900 1
1 1308 . 15 1 1 A 112 112 ASP H H 112 8.435 8.497 -0.062 1
1 1309 . 15 1 1 A 112 112 ASP HA H 112 4.656 4.750 -0.094 1
1 1312 . 15 1 1 A 112 112 ASP C C 112 176.745 176.984 -0.239 1
1 1313 . 15 1 1 A 112 112 ASP CA C 112 54.158 53.625 0.533 1
1 1314 . 15 1 1 A 112 112 ASP CB C 112 41.575 41.852 -0.277 1
1 1315 . 15 1 1 A 112 112 ASP N N 112 119.566 121.327 -1.761 1
1 1316 . 15 1 1 A 113 113 VAL H H 113 8.629 8.699 -0.070 1
1 1317 . 15 1 1 A 113 113 VAL HA H 113 4.078 4.399 -0.321 1
1 1325 . 15 1 1 A 113 113 VAL C C 113 175.247 175.171 0.076 1
1 1326 . 15 1 1 A 113 113 VAL CA C 113 62.533 62.224 0.309 1
1 1327 . 15 1 1 A 113 113 VAL CB C 113 32.534 33.725 -1.191 1
1 1330 . 15 1 1 A 113 113 VAL N N 113 119.356 116.479 2.877 1
1 4 . 16 1 1 A 2 2 SER H H 2 8.289 8.881 -0.592 1
1 5 . 16 1 1 A 2 2 SER HA H 2 4.530 4.728 -0.198 1
1 7 . 16 1 1 A 2 2 SER C C 2 174.868 173.225 1.643 1
1 8 . 16 1 1 A 2 2 SER CA C 2 58.284 57.163 1.121 1
1 9 . 16 1 1 A 2 2 SER CB C 2 63.769 62.518 1.251 1
1 10 . 16 1 1 A 2 2 SER N N 2 115.842 121.346 -5.504 1
1 11 . 16 1 1 A 3 3 SER H H 3 8.490 8.158 0.332 1
1 12 . 16 1 1 A 3 3 SER HA H 3 4.496 5.235 -0.739 1
1 14 . 16 1 1 A 3 3 SER C C 3 175.043 173.773 1.270 1
1 15 . 16 1 1 A 3 3 SER CA C 3 58.549 56.223 2.326 1
1 16 . 16 1 1 A 3 3 SER CB C 3 63.687 65.642 -1.955 1
1 17 . 16 1 1 A 3 3 SER N N 3 117.930 119.369 -1.439 1
1 18 . 16 1 1 A 4 4 GLY H H 4 8.482 8.554 -0.072 1
1 19 . 16 1 1 A 4 4 GLY C C 4 174.344 174.739 -0.395 1
1 20 . 16 1 1 A 4 4 GLY CA C 4 45.536 45.584 -0.048 1
1 21 . 16 1 1 A 4 4 GLY N N 4 110.985 109.248 1.737 1
1 22 . 16 1 1 A 6 6 SER HA H 6 4.508 4.984 -0.476 1
1 24 . 16 1 1 A 6 6 SER C C 6 175.026 172.977 2.049 1
1 25 . 16 1 1 A 6 6 SER CA C 6 58.584 57.636 0.948 1
1 26 . 16 1 1 A 6 6 SER CB C 6 63.646 66.139 -2.493 1
1 27 . 16 1 1 A 7 7 GLY H H 7 8.419 8.794 -0.375 1
1 28 . 16 1 1 A 7 7 GLY HA2 H 7 3.993 4.117 -0.124 1
1 29 . 16 1 1 A 7 7 GLY C C 7 173.995 175.235 -1.240 1
1 30 . 16 1 1 A 7 7 GLY CA C 7 45.466 44.111 1.355 1
1 31 . 16 1 1 A 7 7 GLY N N 7 110.615 110.352 0.263 1
1 32 . 16 1 1 A 8 8 ASN H H 8 8.322 8.907 -0.585 1
1 33 . 16 1 1 A 8 8 ASN HA H 8 4.736 4.762 -0.026 1
1 38 . 16 1 1 A 8 8 ASN C C 8 174.907 174.964 -0.057 1
1 39 . 16 1 1 A 8 8 ASN CA C 8 53.259 55.019 -1.760 1
1 40 . 16 1 1 A 8 8 ASN CB C 8 39.127 39.340 -0.213 1
1 41 . 16 1 1 A 8 8 ASN N N 8 118.602 117.252 1.350 1
1 43 . 16 1 1 A 9 9 ASP H H 9 8.370 7.889 0.481 1
1 44 . 16 1 1 A 9 9 ASP HA H 9 4.594 5.023 -0.429 1
1 47 . 16 1 1 A 9 9 ASP C C 9 175.765 174.699 1.066 1
1 48 . 16 1 1 A 9 9 ASP CA C 9 54.440 52.730 1.710 1
1 49 . 16 1 1 A 9 9 ASP CB C 9 40.898 42.158 -1.260 1
1 50 . 16 1 1 A 9 9 ASP N N 9 120.504 115.682 4.822 1
1 51 . 16 1 1 A 10 10 ASN H H 10 8.382 8.804 -0.422 1
1 52 . 16 1 1 A 10 10 ASN HA H 10 4.691 5.112 -0.421 1
1 57 . 16 1 1 A 10 10 ASN C C 10 174.383 174.200 0.183 1
1 58 . 16 1 1 A 10 10 ASN CA C 10 53.241 52.196 1.045 1
1 59 . 16 1 1 A 10 10 ASN CB C 10 38.674 38.066 0.608 1
1 60 . 16 1 1 A 10 10 ASN N N 10 119.406 123.370 -3.964 1
1 62 . 16 1 1 A 11 11 ARG H H 11 7.942 8.454 -0.512 1
1 63 . 16 1 1 A 11 11 ARG HA H 11 4.684 4.746 -0.062 1
1 70 . 16 1 1 A 11 11 ARG C C 11 173.640 173.715 -0.075 1
1 71 . 16 1 1 A 11 11 ARG CA C 11 54.246 52.636 1.610 1
1 72 . 16 1 1 A 11 11 ARG CB C 11 30.337 32.569 -2.232 1
1 75 . 16 1 1 A 11 11 ARG N N 11 121.145 123.797 -2.652 1
1 76 . 16 1 1 A 12 12 PRO HA H 12 4.507 4.572 -0.065 1
1 83 . 16 1 1 A 12 12 PRO CA C 12 62.714 62.148 0.566 1
1 84 . 16 1 1 A 12 12 PRO CB C 12 31.942 29.268 2.674 1
1 87 . 16 1 1 A 13 13 VAL H H 13 8.252 7.798 0.454 1
1 88 . 16 1 1 A 13 13 VAL HA H 13 4.159 4.158 0.001 1
1 96 . 16 1 1 A 13 13 VAL CA C 13 61.409 61.364 0.045 1
1 97 . 16 1 1 A 13 13 VAL CB C 13 34.858 32.658 2.200 1
1 100 . 16 1 1 A 13 13 VAL N N 13 118.395 118.242 0.153 1
1 101 . 16 1 1 A 14 14 PHE H H 14 8.725 8.889 -0.164 1
1 102 . 16 1 1 A 14 14 PHE HA H 14 4.781 4.838 -0.057 1
1 110 . 16 1 1 A 14 14 PHE CA C 14 58.594 57.460 1.134 1
1 111 . 16 1 1 A 14 14 PHE CB C 14 39.594 40.774 -1.180 1
1 117 . 16 1 1 A 14 14 PHE N N 14 122.950 123.828 -0.878 1
1 118 . 16 1 1 A 15 15 LYS H H 15 8.885 8.974 -0.089 1
1 119 . 16 1 1 A 15 15 LYS HA H 15 4.130 3.962 0.168 1
1 128 . 16 1 1 A 15 15 LYS C C 15 177.027 175.796 1.231 1
1 129 . 16 1 1 A 15 15 LYS CA C 15 58.478 60.217 -1.739 1
1 130 . 16 1 1 A 15 15 LYS CB C 15 32.748 32.601 0.147 1
1 134 . 16 1 1 A 15 15 LYS N N 15 123.863 123.250 0.613 1
1 135 . 16 1 1 A 16 16 GLU H H 16 8.091 8.055 0.036 1
1 136 . 16 1 1 A 16 16 GLU HA H 16 4.438 4.816 -0.378 1
1 141 . 16 1 1 A 16 16 GLU C C 16 175.947 177.194 -1.247 1
1 142 . 16 1 1 A 16 16 GLU CA C 16 56.045 54.527 1.518 1
1 143 . 16 1 1 A 16 16 GLU CB C 16 30.766 33.599 -2.833 1
1 145 . 16 1 1 A 16 16 GLU N N 16 117.026 115.756 1.270 1
1 146 . 16 1 1 A 17 17 GLY H H 17 8.421 8.668 -0.247 1
1 147 . 16 1 1 A 17 17 GLY HA2 H 17 3.993 3.897 0.096 1
1 148 . 16 1 1 A 17 17 GLY HA3 H 17 3.913 3.903 0.010 1
1 149 . 16 1 1 A 17 17 GLY C C 17 173.564 174.005 -0.441 1
1 150 . 16 1 1 A 17 17 GLY CA C 17 45.448 47.032 -1.584 1
1 151 . 16 1 1 A 17 17 GLY N N 17 109.577 109.967 -0.390 1
1 152 . 16 1 1 A 18 18 GLN H H 18 7.858 7.803 0.055 1
1 153 . 16 1 1 A 18 18 GLN HA H 18 5.065 4.940 0.125 1
1 160 . 16 1 1 A 18 18 GLN C C 18 174.596 174.662 -0.066 1
1 161 . 16 1 1 A 18 18 GLN CA C 18 55.110 54.368 0.742 1
1 162 . 16 1 1 A 18 18 GLN CB C 18 30.329 31.483 -1.154 1
1 164 . 16 1 1 A 18 18 GLN N N 18 120.202 117.316 2.886 1
1 166 . 16 1 1 A 19 19 VAL H H 19 8.216 8.932 -0.716 1
1 167 . 16 1 1 A 19 19 VAL HA H 19 4.450 4.636 -0.186 1
1 175 . 16 1 1 A 19 19 VAL C C 19 173.648 174.219 -0.571 1
1 176 . 16 1 1 A 19 19 VAL CA C 19 60.788 61.194 -0.406 1
1 177 . 16 1 1 A 19 19 VAL CB C 19 35.336 34.711 0.625 1
1 180 . 16 1 1 A 19 19 VAL N N 19 121.257 124.251 -2.994 1
1 181 . 16 1 1 A 20 20 GLU H H 20 8.610 9.112 -0.502 1
1 182 . 16 1 1 A 20 20 GLU HA H 20 5.211 4.900 0.311 1
1 187 . 16 1 1 A 20 20 GLU C C 20 174.783 176.397 -1.614 1
1 188 . 16 1 1 A 20 20 GLU CA C 20 54.793 56.008 -1.215 1
1 189 . 16 1 1 A 20 20 GLU CB C 20 32.058 31.561 0.497 1
1 191 . 16 1 1 A 20 20 GLU N N 20 127.095 128.442 -1.347 1
1 192 . 16 1 1 A 21 21 VAL H H 21 8.727 8.829 -0.102 1
1 193 . 16 1 1 A 21 21 VAL HA H 21 4.633 5.071 -0.438 1
1 201 . 16 1 1 A 21 21 VAL C C 21 173.894 174.775 -0.881 1
1 202 . 16 1 1 A 21 21 VAL CA C 21 59.695 59.311 0.384 1
1 203 . 16 1 1 A 21 21 VAL CB C 21 35.865 35.660 0.205 1
1 206 . 16 1 1 A 21 21 VAL N N 21 120.489 120.573 -0.084 1
1 207 . 16 1 1 A 22 22 HIS H H 22 8.680 8.842 -0.162 1
1 208 . 16 1 1 A 22 22 HIS HA H 22 5.552 5.702 -0.150 1
1 212 . 16 1 1 A 22 22 HIS C C 22 174.298 173.526 0.772 1
1 213 . 16 1 1 A 22 22 HIS CA C 22 55.331 53.759 1.572 1
1 214 . 16 1 1 A 22 22 HIS CB C 22 32.369 31.948 0.421 1
1 216 . 16 1 1 A 22 22 HIS N N 22 124.991 118.991 6.000 1
1 217 . 16 1 1 A 23 23 ILE H H 23 9.179 8.803 0.376 1
1 218 . 16 1 1 A 23 23 ILE HA H 23 5.046 4.580 0.466 1
1 228 . 16 1 1 A 23 23 ILE C C 23 171.552 173.570 -2.018 1
1 229 . 16 1 1 A 23 23 ILE CA C 23 55.551 57.139 -1.588 1
1 230 . 16 1 1 A 23 23 ILE CB C 23 42.053 42.048 0.005 1
1 234 . 16 1 1 A 23 23 ILE N N 23 123.121 124.010 -0.889 1
1 235 . 16 1 1 A 24 24 PRO HA H 24 4.816 4.777 0.039 1
1 242 . 16 1 1 A 24 24 PRO C C 24 178.887 177.837 1.050 1
1 243 . 16 1 1 A 24 24 PRO CA C 24 62.216 62.665 -0.449 1
1 244 . 16 1 1 A 24 24 PRO CB C 24 32.895 32.860 0.035 1
1 247 . 16 1 1 A 25 25 GLU H H 25 8.399 8.589 -0.190 1
1 248 . 16 1 1 A 25 25 GLU HA H 25 3.785 4.072 -0.287 1
1 253 . 16 1 1 A 25 25 GLU C C 25 175.244 177.509 -2.265 1
1 254 . 16 1 1 A 25 25 GLU CA C 25 58.425 59.293 -0.868 1
1 255 . 16 1 1 A 25 25 GLU CB C 25 30.011 29.063 0.948 1
1 257 . 16 1 1 A 25 25 GLU N N 25 117.706 122.305 -4.599 1
1 258 . 16 1 1 A 26 26 ASN H H 26 7.488 7.778 -0.290 1
1 259 . 16 1 1 A 26 26 ASN HA H 26 4.702 4.770 -0.068 1
1 264 . 16 1 1 A 26 26 ASN C C 26 175.425 175.454 -0.029 1
1 265 . 16 1 1 A 26 26 ASN CA C 26 51.584 52.189 -0.605 1
1 266 . 16 1 1 A 26 26 ASN CB C 26 37.243 38.514 -1.271 1
1 267 . 16 1 1 A 26 26 ASN N N 26 112.383 117.417 -5.034 1
1 269 . 16 1 1 A 27 27 ALA H H 27 7.716 7.120 0.596 1
1 270 . 16 1 1 A 27 27 ALA HA H 27 4.409 4.323 0.086 1
1 274 . 16 1 1 A 27 27 ALA C C 27 175.850 175.812 0.038 1
1 275 . 16 1 1 A 27 27 ALA CA C 27 51.037 51.062 -0.025 1
1 276 . 16 1 1 A 27 27 ALA CB C 27 18.152 18.457 -0.305 1
1 277 . 16 1 1 A 27 27 ALA N N 27 125.139 122.510 2.629 1
1 278 . 16 1 1 A 28 28 PRO HA H 28 4.422 4.515 -0.093 1
1 285 . 16 1 1 A 28 28 PRO C C 28 178.442 176.852 1.590 1
1 286 . 16 1 1 A 28 28 PRO CA C 28 62.067 62.714 -0.647 1
1 287 . 16 1 1 A 28 28 PRO CB C 28 32.642 32.341 0.301 1
1 290 . 16 1 1 A 29 29 VAL H H 29 8.691 8.291 0.400 1
1 291 . 16 1 1 A 29 29 VAL HA H 29 3.239 3.691 -0.452 1
1 299 . 16 1 1 A 29 29 VAL C C 29 176.887 177.026 -0.139 1
1 300 . 16 1 1 A 29 29 VAL CA C 29 65.812 64.282 1.530 1
1 301 . 16 1 1 A 29 29 VAL CB C 29 31.174 31.238 -0.064 1
1 304 . 16 1 1 A 29 29 VAL N N 29 123.592 122.789 0.803 1
1 305 . 16 1 1 A 30 30 GLY H H 30 9.197 8.671 0.526 1
1 306 . 16 1 1 A 30 30 GLY HA2 H 30 4.486 3.973 0.513 1
1 307 . 16 1 1 A 30 30 GLY HA3 H 30 3.581 3.975 -0.394 1
1 308 . 16 1 1 A 30 30 GLY C C 30 174.347 174.567 -0.220 1
1 309 . 16 1 1 A 30 30 GLY CA C 30 44.320 44.994 -0.674 1
1 310 . 16 1 1 A 30 30 GLY N N 30 116.042 114.994 1.048 1
1 311 . 16 1 1 A 31 31 THR H H 31 7.838 7.808 0.030 1
1 312 . 16 1 1 A 31 31 THR HA H 31 3.959 4.203 -0.244 1
1 317 . 16 1 1 A 31 31 THR C C 31 174.274 173.554 0.720 1
1 318 . 16 1 1 A 31 31 THR CA C 31 65.160 63.378 1.782 1
1 319 . 16 1 1 A 31 31 THR CB C 31 69.972 68.710 1.262 1
1 321 . 16 1 1 A 31 31 THR N N 31 117.679 117.910 -0.231 1
1 322 . 16 1 1 A 32 32 SER H H 32 9.022 8.929 0.093 1
1 323 . 16 1 1 A 32 32 SER HA H 32 4.273 4.402 -0.129 1
1 326 . 16 1 1 A 32 32 SER C C 32 172.692 173.898 -1.206 1
1 327 . 16 1 1 A 32 32 SER CA C 32 59.642 59.782 -0.140 1
1 328 . 16 1 1 A 32 32 SER CB C 32 63.102 62.822 0.280 1
1 329 . 16 1 1 A 32 32 SER N N 32 123.045 123.468 -0.423 1
1 330 . 16 1 1 A 33 33 VAL H H 33 9.202 8.905 0.297 1
1 331 . 16 1 1 A 33 33 VAL HA H 33 3.844 3.968 -0.124 1
1 339 . 16 1 1 A 33 33 VAL C C 33 174.782 175.776 -0.994 1
1 340 . 16 1 1 A 33 33 VAL CA C 33 64.242 64.356 -0.114 1
1 341 . 16 1 1 A 33 33 VAL CB C 33 32.893 32.473 0.420 1
1 344 . 16 1 1 A 33 33 VAL N N 33 126.861 127.707 -0.846 1
1 345 . 16 1 1 A 34 34 ILE H H 34 7.074 7.386 -0.312 1
1 346 . 16 1 1 A 34 34 ILE HA H 34 4.295 4.679 -0.384 1
1 356 . 16 1 1 A 34 34 ILE C C 34 170.577 173.110 -2.533 1
1 357 . 16 1 1 A 34 34 ILE CA C 34 59.500 59.398 0.102 1
1 358 . 16 1 1 A 34 34 ILE CB C 34 39.251 42.113 -2.862 1
1 362 . 16 1 1 A 34 34 ILE N N 34 111.445 119.717 -8.272 1
1 363 . 16 1 1 A 35 35 GLN H H 35 8.450 8.940 -0.490 1
1 364 . 16 1 1 A 35 35 GLN HA H 35 4.633 4.756 -0.123 1
1 371 . 16 1 1 A 35 35 GLN C C 35 174.354 174.482 -0.128 1
1 372 . 16 1 1 A 35 35 GLN CA C 35 54.176 54.494 -0.318 1
1 373 . 16 1 1 A 35 35 GLN CB C 35 29.456 31.055 -1.599 1
1 375 . 16 1 1 A 35 35 GLN N N 35 127.342 128.333 -0.991 1
1 377 . 16 1 1 A 36 36 LEU H H 36 7.761 8.380 -0.619 1
1 378 . 16 1 1 A 36 36 LEU HA H 36 4.492 4.593 -0.101 1
1 388 . 16 1 1 A 36 36 LEU C C 36 175.543 175.583 -0.040 1
1 389 . 16 1 1 A 36 36 LEU CA C 36 53.982 55.358 -1.376 1
1 390 . 16 1 1 A 36 36 LEU CB C 36 42.776 41.300 1.476 1
1 394 . 16 1 1 A 36 36 LEU N N 36 128.895 127.407 1.488 1
1 395 . 16 1 1 A 37 37 HIS H H 37 8.529 9.018 -0.489 1
1 396 . 16 1 1 A 37 37 HIS HA H 37 4.851 5.374 -0.523 1
1 400 . 16 1 1 A 37 37 HIS C C 37 172.985 173.388 -0.403 1
1 401 . 16 1 1 A 37 37 HIS CA C 37 55.833 53.609 2.224 1
1 402 . 16 1 1 A 37 37 HIS CB C 37 32.204 31.726 0.478 1
1 404 . 16 1 1 A 37 37 HIS N N 37 115.903 125.092 -9.189 1
1 405 . 16 1 1 A 38 38 ALA H H 38 8.474 8.751 -0.277 1
1 406 . 16 1 1 A 38 38 ALA HA H 38 4.691 4.829 -0.138 1
1 410 . 16 1 1 A 38 38 ALA C C 38 175.548 176.138 -0.590 1
1 411 . 16 1 1 A 38 38 ALA CA C 38 50.491 50.723 -0.232 1
1 412 . 16 1 1 A 38 38 ALA CB C 38 19.842 19.561 0.281 1
1 413 . 16 1 1 A 38 38 ALA N N 38 128.891 131.095 -2.204 1
1 414 . 16 1 1 A 39 39 THR H H 39 8.095 8.373 -0.278 1
1 415 . 16 1 1 A 39 39 THR HA H 39 4.336 5.145 -0.809 1
1 420 . 16 1 1 A 39 39 THR C C 39 173.553 174.184 -0.631 1
1 421 . 16 1 1 A 39 39 THR CA C 39 60.417 59.814 0.603 1
1 422 . 16 1 1 A 39 39 THR CB C 39 70.912 71.884 -0.972 1
1 424 . 16 1 1 A 39 39 THR N N 39 110.982 113.410 -2.428 1
1 425 . 16 1 1 A 40 40 ASP H H 40 8.417 8.925 -0.508 1
1 426 . 16 1 1 A 40 40 ASP HA H 40 4.553 4.607 -0.054 1
1 429 . 16 1 1 A 40 40 ASP C C 40 176.462 176.708 -0.246 1
1 430 . 16 1 1 A 40 40 ASP CA C 40 54.158 56.018 -1.860 1
1 431 . 16 1 1 A 40 40 ASP CB C 40 41.517 41.456 0.061 1
1 432 . 16 1 1 A 40 40 ASP N N 40 121.450 122.527 -1.077 1
1 433 . 16 1 1 A 41 41 ALA H H 41 8.435 7.668 0.767 1
1 434 . 16 1 1 A 41 41 ALA HA H 41 4.129 4.591 -0.462 1
1 438 . 16 1 1 A 41 41 ALA C C 41 177.718 176.869 0.849 1
1 439 . 16 1 1 A 41 41 ALA CA C 41 53.436 50.705 2.731 1
1 440 . 16 1 1 A 41 41 ALA CB C 41 19.183 19.362 -0.179 1
1 441 . 16 1 1 A 41 41 ALA N N 41 124.607 119.280 5.327 1
1 442 . 16 1 1 A 42 42 ASP H H 42 8.310 8.126 0.184 1
1 443 . 16 1 1 A 42 42 ASP HA H 42 4.588 4.247 0.341 1
1 446 . 16 1 1 A 42 42 ASP C C 42 176.546 175.732 0.814 1
1 447 . 16 1 1 A 42 42 ASP CA C 42 54.599 54.943 -0.344 1
1 448 . 16 1 1 A 42 42 ASP CB C 42 41.146 39.567 1.579 1
1 449 . 16 1 1 A 42 42 ASP N N 42 118.030 115.523 2.507 1
1 450 . 16 1 1 A 43 43 ILE H H 43 8.000 7.644 0.356 1
1 451 . 16 1 1 A 43 43 ILE HA H 43 4.130 4.506 -0.376 1
1 461 . 16 1 1 A 43 43 ILE C C 43 176.901 175.898 1.003 1
1 462 . 16 1 1 A 43 43 ILE CA C 43 61.740 60.207 1.533 1
1 463 . 16 1 1 A 43 43 ILE CB C 43 38.491 38.655 -0.164 1
1 467 . 16 1 1 A 43 43 ILE N N 43 119.301 114.590 4.711 1
1 468 . 16 1 1 A 44 44 GLY H H 44 8.448 8.870 -0.422 1
1 469 . 16 1 1 A 44 44 GLY HA2 H 44 3.939 3.865 0.074 1
1 470 . 16 1 1 A 44 44 GLY HA3 H 44 3.939 3.871 0.068 1
1 471 . 16 1 1 A 44 44 GLY C C 44 174.393 176.089 -1.696 1
1 472 . 16 1 1 A 44 44 GLY CA C 44 45.501 47.337 -1.836 1
1 473 . 16 1 1 A 44 44 GLY N N 44 111.333 112.436 -1.103 1
1 474 . 16 1 1 A 45 45 SER H H 45 8.061 8.252 -0.191 1
1 475 . 16 1 1 A 45 45 SER HA H 45 4.416 4.264 0.152 1
1 478 . 16 1 1 A 45 45 SER C C 45 174.480 174.554 -0.074 1
1 479 . 16 1 1 A 45 45 SER CA C 45 58.478 61.762 -3.284 1
1 480 . 16 1 1 A 45 45 SER CB C 45 63.943 62.917 1.026 1
1 481 . 16 1 1 A 45 45 SER N N 45 115.551 117.841 -2.290 1
1 482 . 16 1 1 A 46 46 ASN H H 46 8.547 7.914 0.633 1
1 483 . 16 1 1 A 46 46 ASN HA H 46 4.725 5.096 -0.371 1
1 488 . 16 1 1 A 46 46 ASN C C 46 175.031 174.292 0.739 1
1 489 . 16 1 1 A 46 46 ASN CA C 46 53.277 51.068 2.209 1
1 490 . 16 1 1 A 46 46 ASN CB C 46 38.798 40.784 -1.986 1
1 491 . 16 1 1 A 46 46 ASN N N 46 120.698 116.283 4.415 1
1 493 . 16 1 1 A 47 47 ALA H H 47 8.239 8.532 -0.293 1
1 494 . 16 1 1 A 47 47 ALA HA H 47 4.283 3.939 0.344 1
1 498 . 16 1 1 A 47 47 ALA C C 47 177.240 176.538 0.702 1
1 499 . 16 1 1 A 47 47 ALA CA C 47 52.731 53.302 -0.571 1
1 500 . 16 1 1 A 47 47 ALA CB C 47 19.594 18.191 1.403 1
1 501 . 16 1 1 A 47 47 ALA N N 47 124.093 119.306 4.787 1
1 502 . 16 1 1 A 48 48 GLU H H 48 8.376 7.980 0.396 1
1 503 . 16 1 1 A 48 48 GLU HA H 48 4.264 4.457 -0.193 1
1 508 . 16 1 1 A 48 48 GLU C C 48 175.702 175.547 0.155 1
1 509 . 16 1 1 A 48 48 GLU CA C 48 55.992 55.587 0.405 1
1 510 . 16 1 1 A 48 48 GLU CB C 48 30.210 28.139 2.071 1
1 512 . 16 1 1 A 48 48 GLU N N 48 119.750 117.138 2.612 1
1 513 . 16 1 1 A 49 49 ILE H H 49 7.806 8.060 -0.254 1
1 514 . 16 1 1 A 49 49 ILE HA H 49 3.919 3.887 0.032 1
1 524 . 16 1 1 A 49 49 ILE C C 49 175.894 175.424 0.470 1
1 525 . 16 1 1 A 49 49 ILE CA C 49 60.559 62.106 -1.547 1
1 526 . 16 1 1 A 49 49 ILE CB C 49 37.860 37.981 -0.121 1
1 530 . 16 1 1 A 49 49 ILE N N 49 122.772 125.215 -2.443 1
1 531 . 16 1 1 A 50 50 ARG H H 50 8.247 8.467 -0.220 1
1 532 . 16 1 1 A 50 50 ARG HA H 50 4.999 5.049 -0.050 1
1 539 . 16 1 1 A 50 50 ARG C C 50 174.603 174.434 0.169 1
1 540 . 16 1 1 A 50 50 ARG CA C 50 53.189 54.551 -1.362 1
1 541 . 16 1 1 A 50 50 ARG CB C 50 33.152 31.792 1.360 1
1 544 . 16 1 1 A 50 50 ARG N N 50 126.912 127.556 -0.644 1
1 545 . 16 1 1 A 51 51 TYR H H 51 9.041 9.095 -0.054 1
1 546 . 16 1 1 A 51 51 TYR HA H 51 5.395 5.659 -0.264 1
1 553 . 16 1 1 A 51 51 TYR C C 51 175.555 175.433 0.122 1
1 554 . 16 1 1 A 51 51 TYR CA C 51 56.909 56.072 0.837 1
1 555 . 16 1 1 A 51 51 TYR CB C 51 40.116 40.755 -0.639 1
1 560 . 16 1 1 A 51 51 TYR N N 51 121.627 124.236 -2.609 1
1 561 . 16 1 1 A 52 52 ILE H H 52 8.850 8.567 0.283 1
1 562 . 16 1 1 A 52 52 ILE HA H 52 4.576 5.043 -0.467 1
1 572 . 16 1 1 A 52 52 ILE C C 52 175.371 174.904 0.467 1
1 573 . 16 1 1 A 52 52 ILE CA C 52 59.624 59.289 0.335 1
1 574 . 16 1 1 A 52 52 ILE CB C 52 42.895 41.758 1.137 1
1 578 . 16 1 1 A 52 52 ILE N N 52 117.697 118.753 -1.056 1
1 579 . 16 1 1 A 53 53 PHE H H 53 8.748 8.916 -0.168 1
1 580 . 16 1 1 A 53 53 PHE HA H 53 5.132 4.715 0.417 1
1 588 . 16 1 1 A 53 53 PHE C C 53 178.146 176.388 1.758 1
1 589 . 16 1 1 A 53 53 PHE CA C 53 57.667 57.649 0.018 1
1 590 . 16 1 1 A 53 53 PHE CB C 53 39.614 39.700 -0.086 1
1 596 . 16 1 1 A 53 53 PHE N N 53 121.433 122.105 -0.672 1
1 597 . 16 1 1 A 54 54 GLY H H 54 8.538 8.388 0.150 1
1 598 . 16 1 1 A 54 54 GLY HA2 H 54 4.074 4.102 -0.028 1
1 599 . 16 1 1 A 54 54 GLY HA3 H 54 3.840 4.102 -0.262 1
1 600 . 16 1 1 A 54 54 GLY C C 54 174.530 172.886 1.644 1
1 601 . 16 1 1 A 54 54 GLY CA C 54 44.884 44.494 0.390 1
1 602 . 16 1 1 A 54 54 GLY N N 54 106.444 110.433 -3.989 1
1 603 . 16 1 1 A 55 55 ALA H H 55 8.594 8.511 0.083 1
1 604 . 16 1 1 A 55 55 ALA HA H 55 4.172 4.676 -0.504 1
1 608 . 16 1 1 A 55 55 ALA C C 55 178.718 177.381 1.337 1
1 609 . 16 1 1 A 55 55 ALA CA C 55 54.423 51.246 3.177 1
1 610 . 16 1 1 A 55 55 ALA CB C 55 19.059 20.804 -1.745 1
1 611 . 16 1 1 A 55 55 ALA N N 55 123.470 121.707 1.763 1
1 612 . 16 1 1 A 56 56 GLN H H 56 8.727 8.759 -0.032 1
1 613 . 16 1 1 A 56 56 GLN HA H 56 4.367 3.833 0.534 1
1 620 . 16 1 1 A 56 56 GLN C C 56 176.134 174.799 1.335 1
1 621 . 16 1 1 A 56 56 GLN CA C 56 55.660 56.859 -1.199 1
1 622 . 16 1 1 A 56 56 GLN CB C 56 28.152 26.964 1.188 1
1 624 . 16 1 1 A 56 56 GLN N N 56 114.221 115.379 -1.158 1
1 626 . 16 1 1 A 57 57 VAL H H 57 7.204 7.763 -0.559 1
1 627 . 16 1 1 A 57 57 VAL HA H 57 3.889 4.166 -0.277 1
1 635 . 16 1 1 A 57 57 VAL C C 57 175.371 175.311 0.060 1
1 636 . 16 1 1 A 57 57 VAL CA C 57 63.908 61.417 2.491 1
1 637 . 16 1 1 A 57 57 VAL CB C 57 31.557 32.502 -0.945 1
1 640 . 16 1 1 A 57 57 VAL N N 57 121.341 119.863 1.478 1
1 641 . 16 1 1 A 58 58 ALA H H 58 8.920 8.528 0.392 1
1 642 . 16 1 1 A 58 58 ALA HA H 58 4.547 4.364 0.183 1
1 646 . 16 1 1 A 58 58 ALA C C 58 177.064 177.746 -0.682 1
1 647 . 16 1 1 A 58 58 ALA CA C 58 51.173 50.917 0.256 1
1 648 . 16 1 1 A 58 58 ALA CB C 58 17.842 18.142 -0.300 1
1 649 . 16 1 1 A 58 58 ALA N N 58 132.726 130.902 1.824 1
1 650 . 16 1 1 A 59 59 PRO HA H 59 4.101 4.268 -0.167 1
1 657 . 16 1 1 A 59 59 PRO C C 59 179.482 178.585 0.897 1
1 658 . 16 1 1 A 59 59 PRO CA C 59 66.060 65.573 0.487 1
1 659 . 16 1 1 A 59 59 PRO CB C 59 31.951 31.841 0.110 1
1 662 . 16 1 1 A 60 60 ALA H H 60 8.706 8.207 0.499 1
1 663 . 16 1 1 A 60 60 ALA HA H 60 4.057 4.034 0.023 1
1 667 . 16 1 1 A 60 60 ALA C C 60 179.627 180.144 -0.517 1
1 668 . 16 1 1 A 60 60 ALA CA C 60 55.305 55.406 -0.101 1
1 669 . 16 1 1 A 60 60 ALA CB C 60 18.737 18.645 0.092 1
1 670 . 16 1 1 A 60 60 ALA N N 60 117.882 118.755 -0.873 1
1 671 . 16 1 1 A 61 61 THR H H 61 7.312 8.288 -0.976 1
1 672 . 16 1 1 A 61 61 THR HA H 61 4.153 4.228 -0.075 1
1 677 . 16 1 1 A 61 61 THR C C 61 175.824 176.068 -0.244 1
1 678 . 16 1 1 A 61 61 THR CA C 61 66.412 65.740 0.672 1
1 679 . 16 1 1 A 61 61 THR CB C 61 68.787 69.096 -0.309 1
1 681 . 16 1 1 A 61 61 THR N N 61 114.483 112.771 1.712 1
1 682 . 16 1 1 A 62 62 LYS H H 62 7.556 7.887 -0.331 1
1 683 . 16 1 1 A 62 62 LYS HA H 62 3.943 4.078 -0.135 1
1 692 . 16 1 1 A 62 62 LYS C C 62 176.884 179.097 -2.213 1
1 693 . 16 1 1 A 62 62 LYS CA C 62 59.095 57.727 1.368 1
1 694 . 16 1 1 A 62 62 LYS CB C 62 32.204 32.662 -0.458 1
1 698 . 16 1 1 A 62 62 LYS N N 62 118.994 119.663 -0.669 1
1 699 . 16 1 1 A 63 63 ARG H H 63 7.474 8.229 -0.755 1
1 700 . 16 1 1 A 63 63 ARG HA H 63 4.034 4.054 -0.020 1
1 707 . 16 1 1 A 63 63 ARG C C 63 177.574 178.502 -0.928 1
1 708 . 16 1 1 A 63 63 ARG CA C 63 58.143 58.582 -0.439 1
1 709 . 16 1 1 A 63 63 ARG CB C 63 30.755 29.798 0.957 1
1 712 . 16 1 1 A 63 63 ARG N N 63 114.251 118.214 -3.963 1
1 713 . 16 1 1 A 64 64 LEU H H 64 6.991 7.767 -0.776 1
1 714 . 16 1 1 A 64 64 LEU HA H 64 3.904 4.025 -0.121 1
1 724 . 16 1 1 A 64 64 LEU C C 64 176.632 176.176 0.456 1
1 725 . 16 1 1 A 64 64 LEU CA C 64 56.503 56.713 -0.210 1
1 726 . 16 1 1 A 64 64 LEU CB C 64 42.929 42.966 -0.037 1
1 730 . 16 1 1 A 64 64 LEU N N 64 116.109 118.168 -2.059 1
1 731 . 16 1 1 A 65 65 PHE H H 65 7.673 7.709 -0.036 1
1 732 . 16 1 1 A 65 65 PHE HA H 65 5.386 5.022 0.364 1
1 740 . 16 1 1 A 65 65 PHE C C 65 173.067 175.297 -2.230 1
1 741 . 16 1 1 A 65 65 PHE CA C 65 56.521 57.049 -0.528 1
1 742 . 16 1 1 A 65 65 PHE CB C 65 41.270 40.828 0.442 1
1 748 . 16 1 1 A 65 65 PHE N N 65 116.182 115.561 0.621 1
1 749 . 16 1 1 A 66 66 ALA H H 66 8.914 8.905 0.009 1
1 750 . 16 1 1 A 66 66 ALA HA H 66 4.748 5.493 -0.745 1
1 754 . 16 1 1 A 66 66 ALA C C 66 175.223 175.392 -0.169 1
1 755 . 16 1 1 A 66 66 ALA CA C 66 50.050 50.282 -0.232 1
1 756 . 16 1 1 A 66 66 ALA CB C 66 21.161 21.085 0.076 1
1 757 . 16 1 1 A 66 66 ALA N N 66 122.870 125.848 -2.978 1
1 758 . 16 1 1 A 67 67 LEU H H 67 8.498 9.222 -0.724 1
1 759 . 16 1 1 A 67 67 LEU HA H 67 4.713 5.528 -0.815 1
1 769 . 16 1 1 A 67 67 LEU C C 67 175.146 174.671 0.475 1
1 770 . 16 1 1 A 67 67 LEU CA C 67 52.518 53.365 -0.847 1
1 771 . 16 1 1 A 67 67 LEU CB C 67 45.308 44.847 0.461 1
1 775 . 16 1 1 A 67 67 LEU N N 67 122.208 125.166 -2.958 1
1 776 . 16 1 1 A 68 68 ASN H H 68 8.357 8.627 -0.270 1
1 777 . 16 1 1 A 68 68 ASN HA H 68 4.679 5.086 -0.407 1
1 782 . 16 1 1 A 68 68 ASN C C 68 176.228 175.555 0.673 1
1 783 . 16 1 1 A 68 68 ASN CA C 68 53.524 52.752 0.772 1
1 784 . 16 1 1 A 68 68 ASN CB C 68 39.580 39.838 -0.258 1
1 785 . 16 1 1 A 68 68 ASN N N 68 126.940 124.205 2.735 1
1 787 . 16 1 1 A 69 69 ASN H H 69 8.861 9.161 -0.300 1
1 788 . 16 1 1 A 69 69 ASN HA H 69 5.137 5.045 0.092 1
1 793 . 16 1 1 A 69 69 ASN C C 69 175.631 176.504 -0.873 1
1 794 . 16 1 1 A 69 69 ASN CA C 69 56.009 54.450 1.559 1
1 795 . 16 1 1 A 69 69 ASN CB C 69 40.314 38.730 1.584 1
1 796 . 16 1 1 A 69 69 ASN N N 69 124.980 122.879 2.101 1
1 798 . 16 1 1 A 70 70 THR H H 70 8.635 7.860 0.775 1
1 799 . 16 1 1 A 70 70 THR HA H 70 4.815 4.613 0.202 1
1 804 . 16 1 1 A 70 70 THR C C 70 176.223 175.671 0.552 1
1 805 . 16 1 1 A 70 70 THR CA C 70 63.944 62.807 1.137 1
1 806 . 16 1 1 A 70 70 THR CB C 70 69.727 70.105 -0.378 1
1 808 . 16 1 1 A 70 70 THR N N 70 110.394 109.886 0.508 1
1 809 . 16 1 1 A 71 71 THR H H 71 8.069 7.880 0.189 1
1 810 . 16 1 1 A 71 71 THR HA H 71 4.566 4.522 0.044 1
1 815 . 16 1 1 A 71 71 THR C C 71 176.213 175.261 0.952 1
1 816 . 16 1 1 A 71 71 THR CA C 71 61.683 61.965 -0.282 1
1 817 . 16 1 1 A 71 71 THR CB C 71 70.832 71.180 -0.348 1
1 819 . 16 1 1 A 71 71 THR N N 71 110.507 110.352 0.155 1
1 820 . 16 1 1 A 72 72 GLY H H 72 7.990 7.839 0.151 1
1 821 . 16 1 1 A 72 72 GLY HA2 H 72 3.186 2.949 0.237 1
1 822 . 16 1 1 A 72 72 GLY HA3 H 72 2.516 3.548 -1.032 1
1 823 . 16 1 1 A 72 72 GLY C C 72 172.988 173.781 -0.793 1
1 824 . 16 1 1 A 72 72 GLY CA C 72 45.149 46.510 -1.361 1
1 825 . 16 1 1 A 72 72 GLY N N 72 110.788 112.444 -1.656 1
1 826 . 16 1 1 A 73 73 LEU H H 73 7.138 7.560 -0.422 1
1 827 . 16 1 1 A 73 73 LEU HA H 73 4.414 4.770 -0.356 1
1 837 . 16 1 1 A 73 73 LEU C C 73 176.836 174.534 2.302 1
1 838 . 16 1 1 A 73 73 LEU CA C 73 55.252 53.432 1.820 1
1 839 . 16 1 1 A 73 73 LEU CB C 73 43.574 46.127 -2.553 1
1 843 . 16 1 1 A 73 73 LEU N N 73 119.222 120.044 -0.822 1
1 844 . 16 1 1 A 74 74 ILE H H 74 8.925 8.922 0.003 1
1 845 . 16 1 1 A 74 74 ILE HA H 74 5.555 5.235 0.320 1
1 855 . 16 1 1 A 74 74 ILE C C 74 175.978 175.529 0.449 1
1 856 . 16 1 1 A 74 74 ILE CA C 74 60.100 59.862 0.238 1
1 857 . 16 1 1 A 74 74 ILE CB C 74 38.550 39.328 -0.778 1
1 861 . 16 1 1 A 74 74 ILE N N 74 129.871 125.713 4.158 1
1 862 . 16 1 1 A 75 75 THR H H 75 9.161 8.846 0.315 1
1 863 . 16 1 1 A 75 75 THR HA H 75 5.375 5.271 0.104 1
1 868 . 16 1 1 A 75 75 THR C C 75 174.798 173.541 1.257 1
1 869 . 16 1 1 A 75 75 THR CA C 75 58.796 59.611 -0.815 1
1 870 . 16 1 1 A 75 75 THR CB C 75 72.978 71.748 1.230 1
1 872 . 16 1 1 A 75 75 THR N N 75 117.522 117.864 -0.342 1
1 873 . 16 1 1 A 76 76 VAL H H 76 8.327 8.973 -0.646 1
1 874 . 16 1 1 A 76 76 VAL HA H 76 3.973 3.856 0.117 1
1 882 . 16 1 1 A 76 76 VAL C C 76 176.495 176.112 0.383 1
1 883 . 16 1 1 A 76 76 VAL CA C 76 64.085 63.121 0.964 1
1 884 . 16 1 1 A 76 76 VAL CB C 76 32.863 31.000 1.863 1
1 887 . 16 1 1 A 76 76 VAL N N 76 120.876 122.212 -1.336 1
1 888 . 16 1 1 A 77 77 GLN H H 77 9.525 9.057 0.468 1
1 889 . 16 1 1 A 77 77 GLN HA H 77 4.702 4.212 0.490 1
1 896 . 16 1 1 A 77 77 GLN C C 77 173.838 175.392 -1.554 1
1 897 . 16 1 1 A 77 77 GLN CA C 77 55.728 57.316 -1.588 1
1 898 . 16 1 1 A 77 77 GLN CB C 77 30.762 29.875 0.887 1
1 900 . 16 1 1 A 77 77 GLN N N 77 129.825 129.296 0.529 1
1 902 . 16 1 1 A 78 78 ARG H H 78 7.621 7.115 0.506 1
1 903 . 16 1 1 A 78 78 ARG HA H 78 4.347 4.763 -0.416 1
1 910 . 16 1 1 A 78 78 ARG C C 78 172.304 174.765 -2.461 1
1 911 . 16 1 1 A 78 78 ARG CA C 78 54.634 53.998 0.636 1
1 912 . 16 1 1 A 78 78 ARG CB C 78 34.685 35.023 -0.338 1
1 915 . 16 1 1 A 78 78 ARG N N 78 120.595 116.965 3.630 1
1 916 . 16 1 1 A 79 79 SER H H 79 7.958 8.471 -0.513 1
1 917 . 16 1 1 A 79 79 SER HA H 79 4.030 4.361 -0.331 1
1 920 . 16 1 1 A 79 79 SER C C 79 174.311 174.559 -0.248 1
1 921 . 16 1 1 A 79 79 SER CA C 79 59.889 58.943 0.946 1
1 922 . 16 1 1 A 79 79 SER CB C 79 63.548 63.788 -0.240 1
1 923 . 16 1 1 A 79 79 SER N N 79 112.565 117.540 -4.975 1
1 924 . 16 1 1 A 80 80 LEU H H 80 8.715 8.131 0.584 1
1 925 . 16 1 1 A 80 80 LEU HA H 80 4.114 5.131 -1.017 1
1 935 . 16 1 1 A 80 80 LEU C C 80 176.057 175.841 0.216 1
1 936 . 16 1 1 A 80 80 LEU CA C 80 55.091 53.481 1.610 1
1 937 . 16 1 1 A 80 80 LEU CB C 80 42.341 45.676 -3.335 1
1 941 . 16 1 1 A 80 80 LEU N N 80 123.070 124.214 -1.144 1
1 942 . 16 1 1 A 81 81 ASP H H 81 7.298 8.675 -1.377 1
1 943 . 16 1 1 A 81 81 ASP HA H 81 4.725 5.324 -0.599 1
1 946 . 16 1 1 A 81 81 ASP C C 81 175.939 175.894 0.045 1
1 947 . 16 1 1 A 81 81 ASP CA C 81 53.664 52.839 0.825 1
1 948 . 16 1 1 A 81 81 ASP CB C 81 42.947 44.421 -1.474 1
1 949 . 16 1 1 A 81 81 ASP N N 81 115.229 120.926 -5.697 1
1 950 . 16 1 1 A 82 82 ARG H H 82 9.289 9.019 0.270 1
1 951 . 16 1 1 A 82 82 ARG HA H 82 4.416 4.367 0.049 1
1 959 . 16 1 1 A 82 82 ARG C C 82 176.406 178.103 -1.697 1
1 960 . 16 1 1 A 82 82 ARG CA C 82 56.397 58.829 -2.432 1
1 961 . 16 1 1 A 82 82 ARG CB C 82 30.638 30.449 0.189 1
1 964 . 16 1 1 A 82 82 ARG N N 82 123.174 123.676 -0.502 1
1 966 . 16 1 1 A 83 83 GLU H H 83 8.468 8.497 -0.029 1
1 967 . 16 1 1 A 83 83 GLU HA H 83 3.982 4.143 -0.161 1
1 972 . 16 1 1 A 83 83 GLU C C 83 177.740 178.233 -0.493 1
1 973 . 16 1 1 A 83 83 GLU CA C 83 58.425 59.102 -0.677 1
1 974 . 16 1 1 A 83 83 GLU CB C 83 29.701 28.645 1.056 1
1 976 . 16 1 1 A 83 83 GLU N N 83 119.549 118.088 1.461 1
1 977 . 16 1 1 A 84 84 GLU H H 84 8.033 7.989 0.044 1
1 978 . 16 1 1 A 84 84 GLU HA H 84 4.206 4.330 -0.124 1
1 983 . 16 1 1 A 84 84 GLU C C 84 176.837 175.704 1.133 1
1 984 . 16 1 1 A 84 84 GLU CA C 84 58.056 58.031 0.025 1
1 985 . 16 1 1 A 84 84 GLU CB C 84 30.432 31.185 -0.753 1
1 987 . 16 1 1 A 84 84 GLU N N 84 118.333 119.525 -1.192 1
1 988 . 16 1 1 A 85 85 THR H H 85 7.651 7.373 0.278 1
1 989 . 16 1 1 A 85 85 THR HA H 85 4.307 4.621 -0.314 1
1 994 . 16 1 1 A 85 85 THR C C 85 171.568 173.871 -2.303 1
1 995 . 16 1 1 A 85 85 THR CA C 85 61.387 59.939 1.448 1
1 996 . 16 1 1 A 85 85 THR CB C 85 69.963 70.920 -0.957 1
1 998 . 16 1 1 A 85 85 THR N N 85 112.444 112.280 0.164 1
1 999 . 16 1 1 A 86 86 ALA H H 86 8.639 8.473 0.166 1
1 1000 . 16 1 1 A 86 86 ALA HA H 86 4.603 4.387 0.216 1
1 1004 . 16 1 1 A 86 86 ALA C C 86 175.560 177.178 -1.618 1
1 1005 . 16 1 1 A 86 86 ALA CA C 86 52.156 53.674 -1.518 1
1 1006 . 16 1 1 A 86 86 ALA CB C 86 20.378 20.214 0.164 1
1 1007 . 16 1 1 A 86 86 ALA N N 86 127.705 127.412 0.293 1
1 1008 . 16 1 1 A 87 87 ILE H H 87 7.663 7.759 -0.096 1
1 1009 . 16 1 1 A 87 87 ILE HA H 87 4.828 4.603 0.225 1
1 1019 . 16 1 1 A 87 87 ILE C C 87 174.537 174.523 0.014 1
1 1020 . 16 1 1 A 87 87 ILE CA C 87 60.329 59.910 0.419 1
1 1021 . 16 1 1 A 87 87 ILE CB C 87 41.090 40.276 0.814 1
1 1025 . 16 1 1 A 87 87 ILE N N 87 118.712 116.985 1.727 1
1 1026 . 16 1 1 A 88 88 HIS H H 88 9.098 9.011 0.087 1
1 1027 . 16 1 1 A 88 88 HIS HA H 88 4.576 5.313 -0.737 1
1 1032 . 16 1 1 A 88 88 HIS C C 88 174.354 174.391 -0.037 1
1 1033 . 16 1 1 A 88 88 HIS CA C 88 54.740 54.085 0.655 1
1 1034 . 16 1 1 A 88 88 HIS CB C 88 33.955 32.305 1.650 1
1 1037 . 16 1 1 A 88 88 HIS N N 88 126.285 125.845 0.440 1
1 1038 . 16 1 1 A 89 89 LYS H H 89 8.957 8.972 -0.015 1
1 1039 . 16 1 1 A 89 89 LYS HA H 89 4.873 4.731 0.142 1
1 1048 . 16 1 1 A 89 89 LYS C C 89 175.906 175.566 0.340 1
1 1049 . 16 1 1 A 89 89 LYS CA C 89 55.269 55.251 0.018 1
1 1050 . 16 1 1 A 89 89 LYS CB C 89 32.945 33.631 -0.686 1
1 1054 . 16 1 1 A 89 89 LYS N N 89 124.332 123.633 0.699 1
1 1055 . 16 1 1 A 90 90 VAL H H 90 9.174 9.076 0.098 1
1 1056 . 16 1 1 A 90 90 VAL HA H 90 4.227 5.016 -0.789 1
1 1064 . 16 1 1 A 90 90 VAL C C 90 174.168 174.740 -0.572 1
1 1065 . 16 1 1 A 90 90 VAL CA C 90 61.369 61.077 0.292 1
1 1066 . 16 1 1 A 90 90 VAL CB C 90 34.082 34.225 -0.143 1
1 1069 . 16 1 1 A 90 90 VAL N N 90 124.319 125.320 -1.001 1
1 1070 . 16 1 1 A 91 91 THR H H 91 6.697 9.117 -2.420 1
1 1071 . 16 1 1 A 91 91 THR HA H 91 5.163 5.020 0.143 1
1 1076 . 16 1 1 A 91 91 THR C C 91 173.812 173.756 0.056 1
1 1077 . 16 1 1 A 91 91 THR CA C 91 61.935 61.848 0.087 1
1 1078 . 16 1 1 A 91 91 THR CB C 91 70.412 70.012 0.400 1
1 1080 . 16 1 1 A 91 91 THR N N 91 122.637 124.591 -1.954 1
1 1081 . 16 1 1 A 92 92 VAL H H 92 9.292 8.770 0.522 1
1 1082 . 16 1 1 A 92 92 VAL HA H 92 4.736 4.591 0.145 1
1 1090 . 16 1 1 A 92 92 VAL C C 92 173.160 174.981 -1.821 1
1 1091 . 16 1 1 A 92 92 VAL CA C 92 60.982 61.341 -0.359 1
1 1092 . 16 1 1 A 92 92 VAL CB C 92 35.130 33.015 2.115 1
1 1095 . 16 1 1 A 92 92 VAL N N 92 128.265 128.478 -0.213 1
1 1096 . 16 1 1 A 93 93 LEU H H 93 9.495 8.960 0.535 1
1 1097 . 16 1 1 A 93 93 LEU HA H 93 5.628 5.762 -0.134 1
1 1107 . 16 1 1 A 93 93 LEU C C 93 176.274 175.833 0.441 1
1 1108 . 16 1 1 A 93 93 LEU CA C 93 52.773 53.745 -0.972 1
1 1109 . 16 1 1 A 93 93 LEU CB C 93 43.454 44.798 -1.344 1
1 1113 . 16 1 1 A 93 93 LEU N N 93 126.350 126.776 -0.426 1
1 1114 . 16 1 1 A 94 94 ALA H H 94 8.688 8.835 -0.147 1
1 1115 . 16 1 1 A 94 94 ALA HA H 94 4.986 5.077 -0.091 1
1 1119 . 16 1 1 A 94 94 ALA C C 94 175.787 175.498 0.289 1
1 1120 . 16 1 1 A 94 94 ALA CA C 94 49.610 50.571 -0.961 1
1 1121 . 16 1 1 A 94 94 ALA CB C 94 21.463 21.709 -0.246 1
1 1122 . 16 1 1 A 94 94 ALA N N 94 123.429 125.540 -2.111 1
1 1123 . 16 1 1 A 95 95 SER H H 95 8.401 8.631 -0.230 1
1 1124 . 16 1 1 A 95 95 SER HA H 95 4.828 5.107 -0.279 1
1 1127 . 16 1 1 A 95 95 SER C C 95 174.327 172.648 1.679 1
1 1128 . 16 1 1 A 95 95 SER CA C 95 56.239 56.545 -0.306 1
1 1129 . 16 1 1 A 95 95 SER CB C 95 65.561 65.345 0.216 1
1 1130 . 16 1 1 A 95 95 SER N N 95 114.418 117.589 -3.171 1
1 1131 . 16 1 1 A 96 96 ASP H H 96 8.690 8.722 -0.032 1
1 1132 . 16 1 1 A 96 96 ASP HA H 96 4.908 4.930 -0.022 1
1 1135 . 16 1 1 A 96 96 ASP C C 96 177.096 176.774 0.322 1
1 1136 . 16 1 1 A 96 96 ASP CA C 96 52.818 54.115 -1.297 1
1 1137 . 16 1 1 A 96 96 ASP CB C 96 41.253 42.880 -1.627 1
1 1138 . 16 1 1 A 96 96 ASP N N 96 125.624 124.723 0.901 1
1 1139 . 16 1 1 A 97 97 GLY H H 97 8.524 7.352 1.172 1
1 1140 . 16 1 1 A 97 97 GLY HA2 H 97 4.320 4.065 0.255 1
1 1141 . 16 1 1 A 97 97 GLY HA3 H 97 3.620 4.066 -0.446 1
1 1142 . 16 1 1 A 97 97 GLY C C 97 174.620 174.022 0.598 1
1 1143 . 16 1 1 A 97 97 GLY CA C 97 45.422 45.658 -0.236 1
1 1144 . 16 1 1 A 97 97 GLY N N 97 109.283 106.140 3.143 1
1 1145 . 16 1 1 A 98 98 SER H H 98 8.575 7.774 0.801 1
1 1146 . 16 1 1 A 98 98 SER HA H 98 4.607 4.932 -0.325 1
1 1149 . 16 1 1 A 98 98 SER C C 98 174.478 175.468 -0.990 1
1 1150 . 16 1 1 A 98 98 SER CA C 98 59.095 56.280 2.815 1
1 1151 . 16 1 1 A 98 98 SER CB C 98 64.800 66.429 -1.629 1
1 1152 . 16 1 1 A 98 98 SER N N 98 116.640 113.812 2.828 1
1 1153 . 16 1 1 A 99 99 SER H H 99 8.945 8.768 0.177 1
1 1154 . 16 1 1 A 99 99 SER HA H 99 4.530 4.295 0.235 1
1 1157 . 16 1 1 A 99 99 SER C C 99 174.491 174.147 0.344 1
1 1158 . 16 1 1 A 99 99 SER CA C 99 58.460 60.749 -2.289 1
1 1159 . 16 1 1 A 99 99 SER CB C 99 64.146 63.438 0.708 1
1 1160 . 16 1 1 A 99 99 SER N N 99 117.676 115.699 1.977 1
1 1161 . 16 1 1 A 100 100 THR H H 100 8.411 7.938 0.473 1
1 1162 . 16 1 1 A 100 100 THR HA H 100 4.490 4.686 -0.196 1
1 1167 . 16 1 1 A 100 100 THR C C 100 172.766 172.646 0.120 1
1 1168 . 16 1 1 A 100 100 THR CA C 100 60.629 58.999 1.630 1
1 1169 . 16 1 1 A 100 100 THR CB C 100 69.778 70.677 -0.899 1
1 1171 . 16 1 1 A 100 100 THR N N 100 118.401 115.439 2.962 1
1 1172 . 16 1 1 A 101 101 PRO HA H 101 4.631 4.536 0.095 1
1 1179 . 16 1 1 A 101 101 PRO C C 101 177.227 175.957 1.270 1
1 1180 . 16 1 1 A 101 101 PRO CA C 101 63.097 62.239 0.858 1
1 1181 . 16 1 1 A 101 101 PRO CB C 101 32.917 32.505 0.412 1
1 1184 . 16 1 1 A 102 102 ALA H H 102 8.497 8.087 0.410 1
1 1185 . 16 1 1 A 102 102 ALA HA H 102 4.619 4.949 -0.330 1
1 1189 . 16 1 1 A 102 102 ALA C C 102 176.542 177.503 -0.961 1
1 1190 . 16 1 1 A 102 102 ALA CA C 102 51.390 51.510 -0.120 1
1 1191 . 16 1 1 A 102 102 ALA CB C 102 20.815 20.724 0.091 1
1 1192 . 16 1 1 A 102 102 ALA N N 102 124.487 122.969 1.518 1
1 1193 . 16 1 1 A 103 103 ARG H H 103 8.663 9.181 -0.518 1
1 1194 . 16 1 1 A 103 103 ARG HA H 103 5.515 5.207 0.308 1
1 1201 . 16 1 1 A 103 103 ARG C C 103 174.539 174.920 -0.381 1
1 1202 . 16 1 1 A 103 103 ARG CA C 103 55.164 54.543 0.621 1
1 1203 . 16 1 1 A 103 103 ARG CB C 103 34.393 33.387 1.006 1
1 1206 . 16 1 1 A 103 103 ARG N N 103 119.596 120.409 -0.813 1
1 1207 . 16 1 1 A 104 104 ALA H H 104 9.027 8.293 0.734 1
1 1208 . 16 1 1 A 104 104 ALA HA H 104 4.782 4.944 -0.162 1
1 1212 . 16 1 1 A 104 104 ALA C C 104 176.276 175.300 0.976 1
1 1213 . 16 1 1 A 104 104 ALA CA C 104 50.297 50.560 -0.263 1
1 1214 . 16 1 1 A 104 104 ALA CB C 104 20.810 20.893 -0.083 1
1 1215 . 16 1 1 A 104 104 ALA N N 104 126.962 123.252 3.710 1
1 1216 . 16 1 1 A 105 105 THR H H 105 8.384 8.695 -0.311 1
1 1217 . 16 1 1 A 105 105 THR HA H 105 4.954 4.592 0.362 1
1 1222 . 16 1 1 A 105 105 THR C C 105 173.243 174.042 -0.799 1
1 1223 . 16 1 1 A 105 105 THR CA C 105 61.475 62.380 -0.905 1
1 1224 . 16 1 1 A 105 105 THR CB C 105 70.569 69.572 0.997 1
1 1226 . 16 1 1 A 105 105 THR N N 105 115.327 118.230 -2.903 1
1 1227 . 16 1 1 A 106 106 VAL H H 106 8.970 8.735 0.235 1
1 1228 . 16 1 1 A 106 106 VAL HA H 106 4.702 4.502 0.200 1
1 1236 . 16 1 1 A 106 106 VAL C C 106 174.743 175.272 -0.529 1
1 1237 . 16 1 1 A 106 106 VAL CA C 106 59.712 61.426 -1.714 1
1 1238 . 16 1 1 A 106 106 VAL CB C 106 34.327 32.893 1.434 1
1 1241 . 16 1 1 A 106 106 VAL N N 106 126.226 128.005 -1.779 1
1 1242 . 16 1 1 A 107 107 THR H H 107 8.833 8.695 0.138 1
1 1243 . 16 1 1 A 107 107 THR HA H 107 4.862 4.428 0.434 1
1 1248 . 16 1 1 A 107 107 THR C C 107 172.970 174.453 -1.483 1
1 1249 . 16 1 1 A 107 107 THR CA C 107 62.322 62.987 -0.665 1
1 1250 . 16 1 1 A 107 107 THR CB C 107 69.463 69.086 0.377 1
1 1252 . 16 1 1 A 107 107 THR N N 107 125.403 122.728 2.675 1
1 1253 . 16 1 1 A 108 108 ILE H H 108 9.234 8.371 0.863 1
1 1254 . 16 1 1 A 108 108 ILE HA H 108 4.178 4.679 -0.501 1
1 1264 . 16 1 1 A 108 108 ILE C C 108 174.087 174.753 -0.666 1
1 1265 . 16 1 1 A 108 108 ILE CA C 108 60.365 60.372 -0.007 1
1 1266 . 16 1 1 A 108 108 ILE CB C 108 39.745 39.768 -0.023 1
1 1270 . 16 1 1 A 108 108 ILE N N 108 127.152 127.659 -0.507 1
1 1271 . 16 1 1 A 109 109 ASN H H 109 8.723 8.770 -0.047 1
1 1272 . 16 1 1 A 109 109 ASN HA H 109 5.147 5.194 -0.047 1
1 1277 . 16 1 1 A 109 109 ASN C C 109 173.592 174.721 -1.129 1
1 1278 . 16 1 1 A 109 109 ASN CA C 109 52.501 53.025 -0.524 1
1 1279 . 16 1 1 A 109 109 ASN CB C 109 40.791 39.697 1.094 1
1 1280 . 16 1 1 A 109 109 ASN N N 109 126.866 125.975 0.891 1
1 1282 . 16 1 1 A 110 110 VAL H H 110 9.046 8.679 0.367 1
1 1283 . 16 1 1 A 110 110 VAL HA H 110 5.081 4.696 0.385 1
1 1291 . 16 1 1 A 110 110 VAL C C 110 176.921 175.993 0.928 1
1 1292 . 16 1 1 A 110 110 VAL CA C 110 61.634 62.212 -0.578 1
1 1293 . 16 1 1 A 110 110 VAL CB C 110 31.809 31.821 -0.012 1
1 1296 . 16 1 1 A 110 110 VAL N N 110 126.070 125.056 1.014 1
1 1297 . 16 1 1 A 111 111 THR H H 111 9.197 8.493 0.704 1
1 1298 . 16 1 1 A 111 111 THR HA H 111 4.566 5.118 -0.552 1
1 1303 . 16 1 1 A 111 111 THR C C 111 174.087 174.416 -0.329 1
1 1304 . 16 1 1 A 111 111 THR CA C 111 61.145 59.433 1.712 1
1 1305 . 16 1 1 A 111 111 THR CB C 111 70.706 71.465 -0.759 1
1 1307 . 16 1 1 A 111 111 THR N N 111 121.425 118.124 3.301 1
1 1308 . 16 1 1 A 112 112 ASP H H 112 8.435 8.552 -0.117 1
1 1309 . 16 1 1 A 112 112 ASP HA H 112 4.656 5.062 -0.406 1
1 1312 . 16 1 1 A 112 112 ASP C C 112 176.745 175.467 1.278 1
1 1313 . 16 1 1 A 112 112 ASP CA C 112 54.158 54.405 -0.247 1
1 1314 . 16 1 1 A 112 112 ASP CB C 112 41.575 41.712 -0.137 1
1 1315 . 16 1 1 A 112 112 ASP N N 112 119.566 121.772 -2.206 1
1 1316 . 16 1 1 A 113 113 VAL H H 113 8.629 8.468 0.161 1
1 1317 . 16 1 1 A 113 113 VAL HA H 113 4.078 4.768 -0.690 1
1 1325 . 16 1 1 A 113 113 VAL C C 113 175.247 175.402 -0.155 1
1 1326 . 16 1 1 A 113 113 VAL CA C 113 62.533 60.019 2.514 1
1 1327 . 16 1 1 A 113 113 VAL CB C 113 32.534 34.637 -2.103 1
1 1330 . 16 1 1 A 113 113 VAL N N 113 119.356 116.645 2.711 1
1 4 . 17 1 1 A 2 2 SER H H 2 8.289 9.025 -0.736 1
1 5 . 17 1 1 A 2 2 SER HA H 2 4.530 4.124 0.406 1
1 7 . 17 1 1 A 2 2 SER C C 2 174.868 173.180 1.688 1
1 8 . 17 1 1 A 2 2 SER CA C 2 58.284 59.129 -0.845 1
1 9 . 17 1 1 A 2 2 SER CB C 2 63.769 62.039 1.730 1
1 10 . 17 1 1 A 2 2 SER N N 2 115.842 116.546 -0.704 1
1 11 . 17 1 1 A 3 3 SER H H 3 8.490 7.976 0.514 1
1 12 . 17 1 1 A 3 3 SER HA H 3 4.496 4.794 -0.298 1
1 14 . 17 1 1 A 3 3 SER C C 3 175.043 174.884 0.159 1
1 15 . 17 1 1 A 3 3 SER CA C 3 58.549 57.647 0.902 1
1 16 . 17 1 1 A 3 3 SER CB C 3 63.687 65.033 -1.346 1
1 17 . 17 1 1 A 3 3 SER N N 3 117.930 116.175 1.755 1
1 18 . 17 1 1 A 4 4 GLY H H 4 8.482 8.927 -0.445 1
1 19 . 17 1 1 A 4 4 GLY C C 4 174.344 174.592 -0.248 1
1 20 . 17 1 1 A 4 4 GLY CA C 4 45.536 47.024 -1.488 1
1 21 . 17 1 1 A 4 4 GLY N N 4 110.985 113.883 -2.898 1
1 22 . 17 1 1 A 6 6 SER HA H 6 4.508 4.221 0.287 1
1 24 . 17 1 1 A 6 6 SER C C 6 175.026 174.962 0.064 1
1 25 . 17 1 1 A 6 6 SER CA C 6 58.584 59.909 -1.325 1
1 26 . 17 1 1 A 6 6 SER CB C 6 63.646 62.638 1.008 1
1 27 . 17 1 1 A 7 7 GLY H H 7 8.419 8.667 -0.248 1
1 28 . 17 1 1 A 7 7 GLY HA2 H 7 3.993 3.840 0.153 1
1 29 . 17 1 1 A 7 7 GLY C C 7 173.995 174.882 -0.887 1
1 30 . 17 1 1 A 7 7 GLY CA C 7 45.466 47.127 -1.661 1
1 31 . 17 1 1 A 7 7 GLY N N 7 110.615 117.186 -6.571 1
1 32 . 17 1 1 A 8 8 ASN H H 8 8.322 8.776 -0.454 1
1 33 . 17 1 1 A 8 8 ASN HA H 8 4.736 4.389 0.347 1
1 38 . 17 1 1 A 8 8 ASN C C 8 174.907 175.092 -0.185 1
1 39 . 17 1 1 A 8 8 ASN CA C 8 53.259 53.858 -0.599 1
1 40 . 17 1 1 A 8 8 ASN CB C 8 39.127 37.128 1.999 1
1 41 . 17 1 1 A 8 8 ASN N N 8 118.602 123.960 -5.358 1
1 43 . 17 1 1 A 9 9 ASP H H 9 8.370 7.975 0.395 1
1 44 . 17 1 1 A 9 9 ASP HA H 9 4.594 4.802 -0.208 1
1 47 . 17 1 1 A 9 9 ASP C C 9 175.765 175.220 0.545 1
1 48 . 17 1 1 A 9 9 ASP CA C 9 54.440 52.897 1.543 1
1 49 . 17 1 1 A 9 9 ASP CB C 9 40.898 41.291 -0.393 1
1 50 . 17 1 1 A 9 9 ASP N N 9 120.504 119.154 1.350 1
1 51 . 17 1 1 A 10 10 ASN H H 10 8.382 8.057 0.325 1
1 52 . 17 1 1 A 10 10 ASN HA H 10 4.691 4.995 -0.304 1
1 57 . 17 1 1 A 10 10 ASN C C 10 174.383 174.602 -0.219 1
1 58 . 17 1 1 A 10 10 ASN CA C 10 53.241 52.336 0.905 1
1 59 . 17 1 1 A 10 10 ASN CB C 10 38.674 37.719 0.955 1
1 60 . 17 1 1 A 10 10 ASN N N 10 119.406 117.404 2.002 1
1 62 . 17 1 1 A 11 11 ARG H H 11 7.942 8.287 -0.345 1
1 63 . 17 1 1 A 11 11 ARG HA H 11 4.684 4.560 0.124 1
1 70 . 17 1 1 A 11 11 ARG C C 11 173.640 175.296 -1.656 1
1 71 . 17 1 1 A 11 11 ARG CA C 11 54.246 54.794 -0.548 1
1 72 . 17 1 1 A 11 11 ARG CB C 11 30.337 30.393 -0.056 1
1 75 . 17 1 1 A 11 11 ARG N N 11 121.145 121.258 -0.113 1
1 76 . 17 1 1 A 12 12 PRO HA H 12 4.507 4.683 -0.176 1
1 83 . 17 1 1 A 12 12 PRO CA C 12 62.714 62.517 0.197 1
1 84 . 17 1 1 A 12 12 PRO CB C 12 31.942 32.650 -0.708 1
1 87 . 17 1 1 A 13 13 VAL H H 13 8.252 8.278 -0.026 1
1 88 . 17 1 1 A 13 13 VAL HA H 13 4.159 4.400 -0.241 1
1 96 . 17 1 1 A 13 13 VAL CA C 13 61.409 60.834 0.575 1
1 97 . 17 1 1 A 13 13 VAL CB C 13 34.858 34.658 0.200 1
1 100 . 17 1 1 A 13 13 VAL N N 13 118.395 121.318 -2.923 1
1 101 . 17 1 1 A 14 14 PHE H H 14 8.725 8.659 0.066 1
1 102 . 17 1 1 A 14 14 PHE HA H 14 4.781 4.610 0.171 1
1 110 . 17 1 1 A 14 14 PHE CA C 14 58.594 58.533 0.061 1
1 111 . 17 1 1 A 14 14 PHE CB C 14 39.594 39.988 -0.394 1
1 117 . 17 1 1 A 14 14 PHE N N 14 122.950 126.866 -3.916 1
1 118 . 17 1 1 A 15 15 LYS H H 15 8.885 8.944 -0.059 1
1 119 . 17 1 1 A 15 15 LYS HA H 15 4.130 4.019 0.111 1
1 128 . 17 1 1 A 15 15 LYS C C 15 177.027 175.811 1.216 1
1 129 . 17 1 1 A 15 15 LYS CA C 15 58.478 59.789 -1.311 1
1 130 . 17 1 1 A 15 15 LYS CB C 15 32.748 32.469 0.279 1
1 134 . 17 1 1 A 15 15 LYS N N 15 123.863 122.896 0.967 1
1 135 . 17 1 1 A 16 16 GLU H H 16 8.091 7.970 0.121 1
1 136 . 17 1 1 A 16 16 GLU HA H 16 4.438 4.732 -0.294 1
1 141 . 17 1 1 A 16 16 GLU C C 16 175.947 177.281 -1.334 1
1 142 . 17 1 1 A 16 16 GLU CA C 16 56.045 54.997 1.048 1
1 143 . 17 1 1 A 16 16 GLU CB C 16 30.766 33.488 -2.722 1
1 145 . 17 1 1 A 16 16 GLU N N 16 117.026 115.959 1.067 1
1 146 . 17 1 1 A 17 17 GLY H H 17 8.421 8.724 -0.303 1
1 147 . 17 1 1 A 17 17 GLY HA2 H 17 3.993 3.902 0.091 1
1 148 . 17 1 1 A 17 17 GLY HA3 H 17 3.913 3.924 -0.011 1
1 149 . 17 1 1 A 17 17 GLY C C 17 173.564 174.484 -0.920 1
1 150 . 17 1 1 A 17 17 GLY CA C 17 45.448 46.895 -1.447 1
1 151 . 17 1 1 A 17 17 GLY N N 17 109.577 110.197 -0.620 1
1 152 . 17 1 1 A 18 18 GLN H H 18 7.858 8.042 -0.184 1
1 153 . 17 1 1 A 18 18 GLN HA H 18 5.065 4.472 0.593 1
1 160 . 17 1 1 A 18 18 GLN C C 18 174.596 175.392 -0.796 1
1 161 . 17 1 1 A 18 18 GLN CA C 18 55.110 55.798 -0.688 1
1 162 . 17 1 1 A 18 18 GLN CB C 18 30.329 29.541 0.788 1
1 164 . 17 1 1 A 18 18 GLN N N 18 120.202 120.421 -0.219 1
1 166 . 17 1 1 A 19 19 VAL H H 19 8.216 8.687 -0.471 1
1 167 . 17 1 1 A 19 19 VAL HA H 19 4.450 4.537 -0.087 1
1 175 . 17 1 1 A 19 19 VAL C C 19 173.648 173.489 0.159 1
1 176 . 17 1 1 A 19 19 VAL CA C 19 60.788 60.694 0.094 1
1 177 . 17 1 1 A 19 19 VAL CB C 19 35.336 35.250 0.086 1
1 180 . 17 1 1 A 19 19 VAL N N 19 121.257 124.113 -2.856 1
1 181 . 17 1 1 A 20 20 GLU H H 20 8.610 8.991 -0.381 1
1 182 . 17 1 1 A 20 20 GLU HA H 20 5.211 5.210 0.001 1
1 187 . 17 1 1 A 20 20 GLU C C 20 174.783 175.802 -1.019 1
1 188 . 17 1 1 A 20 20 GLU CA C 20 54.793 55.239 -0.446 1
1 189 . 17 1 1 A 20 20 GLU CB C 20 32.058 31.420 0.638 1
1 191 . 17 1 1 A 20 20 GLU N N 20 127.095 128.399 -1.304 1
1 192 . 17 1 1 A 21 21 VAL H H 21 8.727 8.830 -0.103 1
1 193 . 17 1 1 A 21 21 VAL HA H 21 4.633 4.820 -0.187 1
1 201 . 17 1 1 A 21 21 VAL C C 21 173.894 174.352 -0.458 1
1 202 . 17 1 1 A 21 21 VAL CA C 21 59.695 58.956 0.739 1
1 203 . 17 1 1 A 21 21 VAL CB C 21 35.865 35.575 0.290 1
1 206 . 17 1 1 A 21 21 VAL N N 21 120.489 119.739 0.750 1
1 207 . 17 1 1 A 22 22 HIS H H 22 8.680 8.480 0.200 1
1 208 . 17 1 1 A 22 22 HIS HA H 22 5.552 5.505 0.047 1
1 212 . 17 1 1 A 22 22 HIS C C 22 174.298 173.945 0.353 1
1 213 . 17 1 1 A 22 22 HIS CA C 22 55.331 54.033 1.298 1
1 214 . 17 1 1 A 22 22 HIS CB C 22 32.369 32.878 -0.509 1
1 216 . 17 1 1 A 22 22 HIS N N 22 124.991 119.229 5.762 1
1 217 . 17 1 1 A 23 23 ILE H H 23 9.179 8.363 0.816 1
1 218 . 17 1 1 A 23 23 ILE HA H 23 5.046 4.669 0.377 1
1 228 . 17 1 1 A 23 23 ILE C C 23 171.552 173.681 -2.129 1
1 229 . 17 1 1 A 23 23 ILE CA C 23 55.551 57.455 -1.904 1
1 230 . 17 1 1 A 23 23 ILE CB C 23 42.053 41.939 0.114 1
1 234 . 17 1 1 A 23 23 ILE N N 23 123.121 122.440 0.681 1
1 235 . 17 1 1 A 24 24 PRO HA H 24 4.816 4.954 -0.138 1
1 242 . 17 1 1 A 24 24 PRO C C 24 178.887 177.706 1.181 1
1 243 . 17 1 1 A 24 24 PRO CA C 24 62.216 62.642 -0.426 1
1 244 . 17 1 1 A 24 24 PRO CB C 24 32.895 32.693 0.202 1
1 247 . 17 1 1 A 25 25 GLU H H 25 8.399 8.189 0.210 1
1 248 . 17 1 1 A 25 25 GLU HA H 25 3.785 4.033 -0.248 1
1 253 . 17 1 1 A 25 25 GLU C C 25 175.244 177.144 -1.900 1
1 254 . 17 1 1 A 25 25 GLU CA C 25 58.425 59.028 -0.603 1
1 255 . 17 1 1 A 25 25 GLU CB C 25 30.011 29.058 0.953 1
1 257 . 17 1 1 A 25 25 GLU N N 25 117.706 121.717 -4.011 1
1 258 . 17 1 1 A 26 26 ASN H H 26 7.488 7.668 -0.180 1
1 259 . 17 1 1 A 26 26 ASN HA H 26 4.702 4.916 -0.214 1
1 264 . 17 1 1 A 26 26 ASN C C 26 175.425 174.321 1.104 1
1 265 . 17 1 1 A 26 26 ASN CA C 26 51.584 52.866 -1.282 1
1 266 . 17 1 1 A 26 26 ASN CB C 26 37.243 38.702 -1.459 1
1 267 . 17 1 1 A 26 26 ASN N N 26 112.383 116.116 -3.733 1
1 269 . 17 1 1 A 27 27 ALA H H 27 7.716 7.552 0.164 1
1 270 . 17 1 1 A 27 27 ALA HA H 27 4.409 4.470 -0.061 1
1 274 . 17 1 1 A 27 27 ALA C C 27 175.850 175.820 0.030 1
1 275 . 17 1 1 A 27 27 ALA CA C 27 51.037 50.815 0.222 1
1 276 . 17 1 1 A 27 27 ALA CB C 27 18.152 18.027 0.125 1
1 277 . 17 1 1 A 27 27 ALA N N 27 125.139 123.060 2.079 1
1 278 . 17 1 1 A 28 28 PRO HA H 28 4.422 4.536 -0.114 1
1 285 . 17 1 1 A 28 28 PRO C C 28 178.442 176.907 1.535 1
1 286 . 17 1 1 A 28 28 PRO CA C 28 62.067 62.689 -0.622 1
1 287 . 17 1 1 A 28 28 PRO CB C 28 32.642 32.193 0.449 1
1 290 . 17 1 1 A 29 29 VAL H H 29 8.691 8.335 0.356 1
1 291 . 17 1 1 A 29 29 VAL HA H 29 3.239 3.724 -0.485 1
1 299 . 17 1 1 A 29 29 VAL C C 29 176.887 177.022 -0.135 1
1 300 . 17 1 1 A 29 29 VAL CA C 29 65.812 64.395 1.417 1
1 301 . 17 1 1 A 29 29 VAL CB C 29 31.174 31.177 -0.003 1
1 304 . 17 1 1 A 29 29 VAL N N 29 123.592 122.654 0.938 1
1 305 . 17 1 1 A 30 30 GLY H H 30 9.197 8.637 0.560 1
1 306 . 17 1 1 A 30 30 GLY HA2 H 30 4.486 4.053 0.433 1
1 307 . 17 1 1 A 30 30 GLY HA3 H 30 3.581 4.054 -0.473 1
1 308 . 17 1 1 A 30 30 GLY C C 30 174.347 174.594 -0.247 1
1 309 . 17 1 1 A 30 30 GLY CA C 30 44.320 44.877 -0.557 1
1 310 . 17 1 1 A 30 30 GLY N N 30 116.042 115.231 0.811 1
1 311 . 17 1 1 A 31 31 THR H H 31 7.838 7.311 0.527 1
1 312 . 17 1 1 A 31 31 THR HA H 31 3.959 4.197 -0.238 1
1 317 . 17 1 1 A 31 31 THR C C 31 174.274 173.989 0.285 1
1 318 . 17 1 1 A 31 31 THR CA C 31 65.160 62.997 2.163 1
1 319 . 17 1 1 A 31 31 THR CB C 31 69.972 69.360 0.612 1
1 321 . 17 1 1 A 31 31 THR N N 31 117.679 117.231 0.448 1
1 322 . 17 1 1 A 32 32 SER H H 32 9.022 8.613 0.409 1
1 323 . 17 1 1 A 32 32 SER HA H 32 4.273 4.622 -0.349 1
1 326 . 17 1 1 A 32 32 SER C C 32 172.692 174.477 -1.785 1
1 327 . 17 1 1 A 32 32 SER CA C 32 59.642 58.009 1.633 1
1 328 . 17 1 1 A 32 32 SER CB C 32 63.102 62.907 0.195 1
1 329 . 17 1 1 A 32 32 SER N N 32 123.045 120.248 2.797 1
1 330 . 17 1 1 A 33 33 VAL H H 33 9.202 9.070 0.132 1
1 331 . 17 1 1 A 33 33 VAL HA H 33 3.844 3.974 -0.130 1
1 339 . 17 1 1 A 33 33 VAL C C 33 174.782 175.823 -1.041 1
1 340 . 17 1 1 A 33 33 VAL CA C 33 64.242 64.417 -0.175 1
1 341 . 17 1 1 A 33 33 VAL CB C 33 32.893 32.407 0.486 1
1 344 . 17 1 1 A 33 33 VAL N N 33 126.861 125.405 1.456 1
1 345 . 17 1 1 A 34 34 ILE H H 34 7.074 7.426 -0.352 1
1 346 . 17 1 1 A 34 34 ILE HA H 34 4.295 4.593 -0.298 1
1 356 . 17 1 1 A 34 34 ILE C C 34 170.577 172.999 -2.422 1
1 357 . 17 1 1 A 34 34 ILE CA C 34 59.500 59.176 0.324 1
1 358 . 17 1 1 A 34 34 ILE CB C 34 39.251 41.949 -2.698 1
1 362 . 17 1 1 A 34 34 ILE N N 34 111.445 118.756 -7.311 1
1 363 . 17 1 1 A 35 35 GLN H H 35 8.450 8.874 -0.424 1
1 364 . 17 1 1 A 35 35 GLN HA H 35 4.633 4.947 -0.314 1
1 371 . 17 1 1 A 35 35 GLN C C 35 174.354 173.988 0.366 1
1 372 . 17 1 1 A 35 35 GLN CA C 35 54.176 53.989 0.187 1
1 373 . 17 1 1 A 35 35 GLN CB C 35 29.456 31.586 -2.130 1
1 375 . 17 1 1 A 35 35 GLN N N 35 127.342 127.515 -0.173 1
1 377 . 17 1 1 A 36 36 LEU H H 36 7.761 8.430 -0.669 1
1 378 . 17 1 1 A 36 36 LEU HA H 36 4.492 4.848 -0.356 1
1 388 . 17 1 1 A 36 36 LEU C C 36 175.543 175.131 0.412 1
1 389 . 17 1 1 A 36 36 LEU CA C 36 53.982 53.359 0.623 1
1 390 . 17 1 1 A 36 36 LEU CB C 36 42.776 42.311 0.465 1
1 394 . 17 1 1 A 36 36 LEU N N 36 128.895 128.132 0.763 1
1 395 . 17 1 1 A 37 37 HIS H H 37 8.529 9.111 -0.582 1
1 396 . 17 1 1 A 37 37 HIS HA H 37 4.851 5.081 -0.230 1
1 400 . 17 1 1 A 37 37 HIS C C 37 172.985 174.330 -1.345 1
1 401 . 17 1 1 A 37 37 HIS CA C 37 55.833 55.230 0.603 1
1 402 . 17 1 1 A 37 37 HIS CB C 37 32.204 29.997 2.207 1
1 404 . 17 1 1 A 37 37 HIS N N 37 115.903 123.699 -7.796 1
1 405 . 17 1 1 A 38 38 ALA H H 38 8.474 9.195 -0.721 1
1 406 . 17 1 1 A 38 38 ALA HA H 38 4.691 4.763 -0.072 1
1 410 . 17 1 1 A 38 38 ALA C C 38 175.548 176.022 -0.474 1
1 411 . 17 1 1 A 38 38 ALA CA C 38 50.491 50.865 -0.374 1
1 412 . 17 1 1 A 38 38 ALA CB C 38 19.842 19.827 0.015 1
1 413 . 17 1 1 A 38 38 ALA N N 38 128.891 127.701 1.190 1
1 414 . 17 1 1 A 39 39 THR H H 39 8.095 8.792 -0.697 1
1 415 . 17 1 1 A 39 39 THR HA H 39 4.336 5.313 -0.977 1
1 420 . 17 1 1 A 39 39 THR C C 39 173.553 172.555 0.998 1
1 421 . 17 1 1 A 39 39 THR CA C 39 60.417 60.374 0.043 1
1 422 . 17 1 1 A 39 39 THR CB C 39 70.912 70.773 0.139 1
1 424 . 17 1 1 A 39 39 THR N N 39 110.982 114.164 -3.182 1
1 425 . 17 1 1 A 40 40 ASP H H 40 8.417 8.880 -0.463 1
1 426 . 17 1 1 A 40 40 ASP HA H 40 4.553 4.958 -0.405 1
1 429 . 17 1 1 A 40 40 ASP C C 40 176.462 175.362 1.100 1
1 430 . 17 1 1 A 40 40 ASP CA C 40 54.158 51.944 2.214 1
1 431 . 17 1 1 A 40 40 ASP CB C 40 41.517 41.530 -0.013 1
1 432 . 17 1 1 A 40 40 ASP N N 40 121.450 127.434 -5.984 1
1 433 . 17 1 1 A 41 41 ALA H H 41 8.435 8.396 0.039 1
1 434 . 17 1 1 A 41 41 ALA HA H 41 4.129 3.946 0.183 1
1 438 . 17 1 1 A 41 41 ALA C C 41 177.718 176.534 1.184 1
1 439 . 17 1 1 A 41 41 ALA CA C 41 53.436 53.028 0.408 1
1 440 . 17 1 1 A 41 41 ALA CB C 41 19.183 17.186 1.997 1
1 441 . 17 1 1 A 41 41 ALA N N 41 124.607 127.708 -3.101 1
1 442 . 17 1 1 A 42 42 ASP H H 42 8.310 7.938 0.372 1
1 443 . 17 1 1 A 42 42 ASP HA H 42 4.588 4.685 -0.097 1
1 446 . 17 1 1 A 42 42 ASP C C 42 176.546 175.175 1.371 1
1 447 . 17 1 1 A 42 42 ASP CA C 42 54.599 53.061 1.538 1
1 448 . 17 1 1 A 42 42 ASP CB C 42 41.146 39.044 2.102 1
1 449 . 17 1 1 A 42 42 ASP N N 42 118.030 117.661 0.369 1
1 450 . 17 1 1 A 43 43 ILE H H 43 8.000 7.777 0.223 1
1 451 . 17 1 1 A 43 43 ILE HA H 43 4.130 4.337 -0.207 1
1 461 . 17 1 1 A 43 43 ILE C C 43 176.901 176.775 0.126 1
1 462 . 17 1 1 A 43 43 ILE CA C 43 61.740 60.541 1.199 1
1 463 . 17 1 1 A 43 43 ILE CB C 43 38.491 37.750 0.741 1
1 467 . 17 1 1 A 43 43 ILE N N 43 119.301 118.316 0.985 1
1 468 . 17 1 1 A 44 44 GLY H H 44 8.448 8.932 -0.484 1
1 469 . 17 1 1 A 44 44 GLY HA2 H 44 3.939 3.955 -0.016 1
1 470 . 17 1 1 A 44 44 GLY HA3 H 44 3.939 3.956 -0.017 1
1 471 . 17 1 1 A 44 44 GLY C C 44 174.393 174.309 0.084 1
1 472 . 17 1 1 A 44 44 GLY CA C 44 45.501 45.911 -0.410 1
1 473 . 17 1 1 A 44 44 GLY N N 44 111.333 116.356 -5.023 1
1 474 . 17 1 1 A 45 45 SER H H 45 8.061 8.028 0.033 1
1 475 . 17 1 1 A 45 45 SER HA H 45 4.416 4.468 -0.052 1
1 478 . 17 1 1 A 45 45 SER C C 45 174.480 175.045 -0.565 1
1 479 . 17 1 1 A 45 45 SER CA C 45 58.478 59.023 -0.545 1
1 480 . 17 1 1 A 45 45 SER CB C 45 63.943 63.795 0.148 1
1 481 . 17 1 1 A 45 45 SER N N 45 115.551 116.904 -1.353 1
1 482 . 17 1 1 A 46 46 ASN H H 46 8.547 9.055 -0.508 1
1 483 . 17 1 1 A 46 46 ASN HA H 46 4.725 4.384 0.341 1
1 488 . 17 1 1 A 46 46 ASN C C 46 175.031 175.385 -0.354 1
1 489 . 17 1 1 A 46 46 ASN CA C 46 53.277 56.070 -2.793 1
1 490 . 17 1 1 A 46 46 ASN CB C 46 38.798 38.322 0.476 1
1 491 . 17 1 1 A 46 46 ASN N N 46 120.698 123.284 -2.586 1
1 493 . 17 1 1 A 47 47 ALA H H 47 8.239 7.858 0.381 1
1 494 . 17 1 1 A 47 47 ALA HA H 47 4.283 3.927 0.356 1
1 498 . 17 1 1 A 47 47 ALA C C 47 177.240 176.384 0.856 1
1 499 . 17 1 1 A 47 47 ALA CA C 47 52.731 53.258 -0.527 1
1 500 . 17 1 1 A 47 47 ALA CB C 47 19.594 17.592 2.002 1
1 501 . 17 1 1 A 47 47 ALA N N 47 124.093 119.552 4.541 1
1 502 . 17 1 1 A 48 48 GLU H H 48 8.376 7.917 0.459 1
1 503 . 17 1 1 A 48 48 GLU HA H 48 4.264 4.304 -0.040 1
1 508 . 17 1 1 A 48 48 GLU C C 48 175.702 175.812 -0.110 1
1 509 . 17 1 1 A 48 48 GLU CA C 48 55.992 55.617 0.375 1
1 510 . 17 1 1 A 48 48 GLU CB C 48 30.210 28.672 1.538 1
1 512 . 17 1 1 A 48 48 GLU N N 48 119.750 116.824 2.926 1
1 513 . 17 1 1 A 49 49 ILE H H 49 7.806 7.933 -0.127 1
1 514 . 17 1 1 A 49 49 ILE HA H 49 3.919 3.775 0.144 1
1 524 . 17 1 1 A 49 49 ILE C C 49 175.894 175.457 0.437 1
1 525 . 17 1 1 A 49 49 ILE CA C 49 60.559 61.851 -1.292 1
1 526 . 17 1 1 A 49 49 ILE CB C 49 37.860 37.658 0.202 1
1 530 . 17 1 1 A 49 49 ILE N N 49 122.772 124.473 -1.701 1
1 531 . 17 1 1 A 50 50 ARG H H 50 8.247 8.323 -0.076 1
1 532 . 17 1 1 A 50 50 ARG HA H 50 4.999 4.957 0.042 1
1 539 . 17 1 1 A 50 50 ARG C C 50 174.603 174.932 -0.329 1
1 540 . 17 1 1 A 50 50 ARG CA C 50 53.189 55.305 -2.116 1
1 541 . 17 1 1 A 50 50 ARG CB C 50 33.152 31.009 2.143 1
1 544 . 17 1 1 A 50 50 ARG N N 50 126.912 127.929 -1.017 1
1 545 . 17 1 1 A 51 51 TYR H H 51 9.041 8.926 0.115 1
1 546 . 17 1 1 A 51 51 TYR HA H 51 5.395 5.098 0.297 1
1 553 . 17 1 1 A 51 51 TYR C C 51 175.555 176.021 -0.466 1
1 554 . 17 1 1 A 51 51 TYR CA C 51 56.909 57.282 -0.373 1
1 555 . 17 1 1 A 51 51 TYR CB C 51 40.116 39.147 0.969 1
1 560 . 17 1 1 A 51 51 TYR N N 51 121.627 123.460 -1.833 1
1 561 . 17 1 1 A 52 52 ILE H H 52 8.850 8.504 0.346 1
1 562 . 17 1 1 A 52 52 ILE HA H 52 4.576 4.824 -0.248 1
1 572 . 17 1 1 A 52 52 ILE C C 52 175.371 175.898 -0.527 1
1 573 . 17 1 1 A 52 52 ILE CA C 52 59.624 59.480 0.144 1
1 574 . 17 1 1 A 52 52 ILE CB C 52 42.895 40.513 2.382 1
1 578 . 17 1 1 A 52 52 ILE N N 52 117.697 119.793 -2.096 1
1 579 . 17 1 1 A 53 53 PHE H H 53 8.748 8.734 0.014 1
1 580 . 17 1 1 A 53 53 PHE HA H 53 5.132 4.584 0.548 1
1 588 . 17 1 1 A 53 53 PHE C C 53 178.146 176.379 1.767 1
1 589 . 17 1 1 A 53 53 PHE CA C 53 57.667 58.275 -0.608 1
1 590 . 17 1 1 A 53 53 PHE CB C 53 39.614 39.670 -0.056 1
1 596 . 17 1 1 A 53 53 PHE N N 53 121.433 123.294 -1.861 1
1 597 . 17 1 1 A 54 54 GLY H H 54 8.538 8.839 -0.301 1
1 598 . 17 1 1 A 54 54 GLY HA2 H 54 4.074 4.089 -0.015 1
1 599 . 17 1 1 A 54 54 GLY HA3 H 54 3.840 4.089 -0.249 1
1 600 . 17 1 1 A 54 54 GLY C C 54 174.530 172.927 1.603 1
1 601 . 17 1 1 A 54 54 GLY CA C 54 44.884 44.583 0.301 1
1 602 . 17 1 1 A 54 54 GLY N N 54 106.444 110.380 -3.936 1
1 603 . 17 1 1 A 55 55 ALA H H 55 8.594 8.308 0.286 1
1 604 . 17 1 1 A 55 55 ALA HA H 55 4.172 4.683 -0.511 1
1 608 . 17 1 1 A 55 55 ALA C C 55 178.718 177.204 1.514 1
1 609 . 17 1 1 A 55 55 ALA CA C 55 54.423 50.862 3.561 1
1 610 . 17 1 1 A 55 55 ALA CB C 55 19.059 21.056 -1.997 1
1 611 . 17 1 1 A 55 55 ALA N N 55 123.470 121.939 1.531 1
1 612 . 17 1 1 A 56 56 GLN H H 56 8.727 8.702 0.025 1
1 613 . 17 1 1 A 56 56 GLN HA H 56 4.367 3.745 0.622 1
1 620 . 17 1 1 A 56 56 GLN C C 56 176.134 174.589 1.545 1
1 621 . 17 1 1 A 56 56 GLN CA C 56 55.660 56.723 -1.063 1
1 622 . 17 1 1 A 56 56 GLN CB C 56 28.152 27.009 1.143 1
1 624 . 17 1 1 A 56 56 GLN N N 56 114.221 115.380 -1.159 1
1 626 . 17 1 1 A 57 57 VAL H H 57 7.204 7.667 -0.463 1
1 627 . 17 1 1 A 57 57 VAL HA H 57 3.889 4.377 -0.488 1
1 635 . 17 1 1 A 57 57 VAL C C 57 175.371 175.248 0.123 1
1 636 . 17 1 1 A 57 57 VAL CA C 57 63.908 60.607 3.301 1
1 637 . 17 1 1 A 57 57 VAL CB C 57 31.557 34.031 -2.474 1
1 640 . 17 1 1 A 57 57 VAL N N 57 121.341 119.279 2.062 1
1 641 . 17 1 1 A 58 58 ALA H H 58 8.920 8.583 0.337 1
1 642 . 17 1 1 A 58 58 ALA HA H 58 4.547 4.374 0.173 1
1 646 . 17 1 1 A 58 58 ALA C C 58 177.064 177.761 -0.697 1
1 647 . 17 1 1 A 58 58 ALA CA C 58 51.173 50.816 0.357 1
1 648 . 17 1 1 A 58 58 ALA CB C 58 17.842 17.712 0.130 1
1 649 . 17 1 1 A 58 58 ALA N N 58 132.726 129.884 2.842 1
1 650 . 17 1 1 A 59 59 PRO HA H 59 4.101 4.245 -0.144 1
1 657 . 17 1 1 A 59 59 PRO C C 59 179.482 178.432 1.050 1
1 658 . 17 1 1 A 59 59 PRO CA C 59 66.060 65.542 0.518 1
1 659 . 17 1 1 A 59 59 PRO CB C 59 31.951 31.849 0.102 1
1 662 . 17 1 1 A 60 60 ALA H H 60 8.706 8.243 0.463 1
1 663 . 17 1 1 A 60 60 ALA HA H 60 4.057 3.985 0.072 1
1 667 . 17 1 1 A 60 60 ALA C C 60 179.627 180.421 -0.794 1
1 668 . 17 1 1 A 60 60 ALA CA C 60 55.305 55.459 -0.154 1
1 669 . 17 1 1 A 60 60 ALA CB C 60 18.737 18.700 0.037 1
1 670 . 17 1 1 A 60 60 ALA N N 60 117.882 118.642 -0.760 1
1 671 . 17 1 1 A 61 61 THR H H 61 7.312 8.094 -0.782 1
1 672 . 17 1 1 A 61 61 THR HA H 61 4.153 4.010 0.143 1
1 677 . 17 1 1 A 61 61 THR C C 61 175.824 176.706 -0.882 1
1 678 . 17 1 1 A 61 61 THR CA C 61 66.412 67.084 -0.672 1
1 679 . 17 1 1 A 61 61 THR CB C 61 68.787 68.683 0.104 1
1 681 . 17 1 1 A 61 61 THR N N 61 114.483 115.169 -0.686 1
1 682 . 17 1 1 A 62 62 LYS H H 62 7.556 7.554 0.002 1
1 683 . 17 1 1 A 62 62 LYS HA H 62 3.943 3.673 0.270 1
1 692 . 17 1 1 A 62 62 LYS C C 62 176.884 178.927 -2.043 1
1 693 . 17 1 1 A 62 62 LYS CA C 62 59.095 59.396 -0.301 1
1 694 . 17 1 1 A 62 62 LYS CB C 62 32.204 31.716 0.488 1
1 698 . 17 1 1 A 62 62 LYS N N 62 118.994 119.520 -0.526 1
1 699 . 17 1 1 A 63 63 ARG H H 63 7.474 7.808 -0.334 1
1 700 . 17 1 1 A 63 63 ARG HA H 63 4.034 4.033 0.001 1
1 707 . 17 1 1 A 63 63 ARG C C 63 177.574 178.712 -1.138 1
1 708 . 17 1 1 A 63 63 ARG CA C 63 58.143 59.227 -1.084 1
1 709 . 17 1 1 A 63 63 ARG CB C 63 30.755 29.803 0.952 1
1 712 . 17 1 1 A 63 63 ARG N N 63 114.251 119.778 -5.527 1
1 713 . 17 1 1 A 64 64 LEU H H 64 6.991 8.038 -1.047 1
1 714 . 17 1 1 A 64 64 LEU HA H 64 3.904 3.834 0.070 1
1 724 . 17 1 1 A 64 64 LEU C C 64 176.632 176.743 -0.111 1
1 725 . 17 1 1 A 64 64 LEU CA C 64 56.503 57.868 -1.365 1
1 726 . 17 1 1 A 64 64 LEU CB C 64 42.929 41.594 1.335 1
1 730 . 17 1 1 A 64 64 LEU N N 64 116.109 119.696 -3.587 1
1 731 . 17 1 1 A 65 65 PHE H H 65 7.673 8.144 -0.471 1
1 732 . 17 1 1 A 65 65 PHE HA H 65 5.386 5.032 0.354 1
1 740 . 17 1 1 A 65 65 PHE C C 65 173.067 174.590 -1.523 1
1 741 . 17 1 1 A 65 65 PHE CA C 65 56.521 57.118 -0.597 1
1 742 . 17 1 1 A 65 65 PHE CB C 65 41.270 40.657 0.613 1
1 748 . 17 1 1 A 65 65 PHE N N 65 116.182 115.358 0.824 1
1 749 . 17 1 1 A 66 66 ALA H H 66 8.914 8.962 -0.048 1
1 750 . 17 1 1 A 66 66 ALA HA H 66 4.748 5.259 -0.511 1
1 754 . 17 1 1 A 66 66 ALA C C 66 175.223 175.482 -0.259 1
1 755 . 17 1 1 A 66 66 ALA CA C 66 50.050 50.397 -0.347 1
1 756 . 17 1 1 A 66 66 ALA CB C 66 21.161 20.390 0.771 1
1 757 . 17 1 1 A 66 66 ALA N N 66 122.870 126.708 -3.838 1
1 758 . 17 1 1 A 67 67 LEU H H 67 8.498 9.150 -0.652 1
1 759 . 17 1 1 A 67 67 LEU HA H 67 4.713 5.106 -0.393 1
1 769 . 17 1 1 A 67 67 LEU C C 67 175.146 175.045 0.101 1
1 770 . 17 1 1 A 67 67 LEU CA C 67 52.518 53.270 -0.752 1
1 771 . 17 1 1 A 67 67 LEU CB C 67 45.308 44.807 0.501 1
1 775 . 17 1 1 A 67 67 LEU N N 67 122.208 125.334 -3.126 1
1 776 . 17 1 1 A 68 68 ASN H H 68 8.357 8.495 -0.138 1
1 777 . 17 1 1 A 68 68 ASN HA H 68 4.679 4.999 -0.320 1
1 782 . 17 1 1 A 68 68 ASN C C 68 176.228 175.184 1.044 1
1 783 . 17 1 1 A 68 68 ASN CA C 68 53.524 52.721 0.803 1
1 784 . 17 1 1 A 68 68 ASN CB C 68 39.580 39.813 -0.233 1
1 785 . 17 1 1 A 68 68 ASN N N 68 126.940 125.228 1.712 1
1 787 . 17 1 1 A 69 69 ASN H H 69 8.861 9.204 -0.343 1
1 788 . 17 1 1 A 69 69 ASN HA H 69 5.137 5.073 0.064 1
1 793 . 17 1 1 A 69 69 ASN C C 69 175.631 176.585 -0.954 1
1 794 . 17 1 1 A 69 69 ASN CA C 69 56.009 54.080 1.929 1
1 795 . 17 1 1 A 69 69 ASN CB C 69 40.314 39.260 1.054 1
1 796 . 17 1 1 A 69 69 ASN N N 69 124.980 121.403 3.577 1
1 798 . 17 1 1 A 70 70 THR H H 70 8.635 7.870 0.765 1
1 799 . 17 1 1 A 70 70 THR HA H 70 4.815 4.479 0.336 1
1 804 . 17 1 1 A 70 70 THR C C 70 176.223 175.786 0.437 1
1 805 . 17 1 1 A 70 70 THR CA C 70 63.944 63.043 0.901 1
1 806 . 17 1 1 A 70 70 THR CB C 70 69.727 69.884 -0.157 1
1 808 . 17 1 1 A 70 70 THR N N 70 110.394 110.641 -0.247 1
1 809 . 17 1 1 A 71 71 THR H H 71 8.069 7.947 0.122 1
1 810 . 17 1 1 A 71 71 THR HA H 71 4.566 4.613 -0.047 1
1 815 . 17 1 1 A 71 71 THR C C 71 176.213 175.874 0.339 1
1 816 . 17 1 1 A 71 71 THR CA C 71 61.683 62.092 -0.409 1
1 817 . 17 1 1 A 71 71 THR CB C 71 70.832 71.401 -0.569 1
1 819 . 17 1 1 A 71 71 THR N N 71 110.507 110.237 0.270 1
1 820 . 17 1 1 A 72 72 GLY H H 72 7.990 8.099 -0.109 1
1 821 . 17 1 1 A 72 72 GLY HA2 H 72 3.186 3.132 0.054 1
1 822 . 17 1 1 A 72 72 GLY HA3 H 72 2.516 3.607 -1.091 1
1 823 . 17 1 1 A 72 72 GLY C C 72 172.988 174.186 -1.198 1
1 824 . 17 1 1 A 72 72 GLY CA C 72 45.149 46.318 -1.169 1
1 825 . 17 1 1 A 72 72 GLY N N 72 110.788 112.701 -1.913 1
1 826 . 17 1 1 A 73 73 LEU H H 73 7.138 7.597 -0.459 1
1 827 . 17 1 1 A 73 73 LEU HA H 73 4.414 4.831 -0.417 1
1 837 . 17 1 1 A 73 73 LEU C C 73 176.836 174.686 2.150 1
1 838 . 17 1 1 A 73 73 LEU CA C 73 55.252 53.315 1.937 1
1 839 . 17 1 1 A 73 73 LEU CB C 73 43.574 45.152 -1.578 1
1 843 . 17 1 1 A 73 73 LEU N N 73 119.222 120.912 -1.690 1
1 844 . 17 1 1 A 74 74 ILE H H 74 8.925 8.924 0.001 1
1 845 . 17 1 1 A 74 74 ILE HA H 74 5.555 5.006 0.549 1
1 855 . 17 1 1 A 74 74 ILE C C 74 175.978 175.503 0.475 1
1 856 . 17 1 1 A 74 74 ILE CA C 74 60.100 60.333 -0.233 1
1 857 . 17 1 1 A 74 74 ILE CB C 74 38.550 38.739 -0.189 1
1 861 . 17 1 1 A 74 74 ILE N N 74 129.871 127.608 2.263 1
1 862 . 17 1 1 A 75 75 THR H H 75 9.161 8.725 0.436 1
1 863 . 17 1 1 A 75 75 THR HA H 75 5.375 5.531 -0.156 1
1 868 . 17 1 1 A 75 75 THR C C 75 174.798 173.450 1.348 1
1 869 . 17 1 1 A 75 75 THR CA C 75 58.796 59.452 -0.656 1
1 870 . 17 1 1 A 75 75 THR CB C 75 72.978 71.739 1.239 1
1 872 . 17 1 1 A 75 75 THR N N 75 117.522 118.145 -0.623 1
1 873 . 17 1 1 A 76 76 VAL H H 76 8.327 8.664 -0.337 1
1 874 . 17 1 1 A 76 76 VAL HA H 76 3.973 3.879 0.094 1
1 882 . 17 1 1 A 76 76 VAL C C 76 176.495 176.088 0.407 1
1 883 . 17 1 1 A 76 76 VAL CA C 76 64.085 63.331 0.754 1
1 884 . 17 1 1 A 76 76 VAL CB C 76 32.863 31.094 1.769 1
1 887 . 17 1 1 A 76 76 VAL N N 76 120.876 122.249 -1.373 1
1 888 . 17 1 1 A 77 77 GLN H H 77 9.525 9.225 0.300 1
1 889 . 17 1 1 A 77 77 GLN HA H 77 4.702 4.224 0.478 1
1 896 . 17 1 1 A 77 77 GLN C C 77 173.838 175.456 -1.618 1
1 897 . 17 1 1 A 77 77 GLN CA C 77 55.728 57.313 -1.585 1
1 898 . 17 1 1 A 77 77 GLN CB C 77 30.762 30.098 0.664 1
1 900 . 17 1 1 A 77 77 GLN N N 77 129.825 128.938 0.887 1
1 902 . 17 1 1 A 78 78 ARG H H 78 7.621 7.129 0.492 1
1 903 . 17 1 1 A 78 78 ARG HA H 78 4.347 4.710 -0.363 1
1 910 . 17 1 1 A 78 78 ARG C C 78 172.304 174.864 -2.560 1
1 911 . 17 1 1 A 78 78 ARG CA C 78 54.634 53.987 0.647 1
1 912 . 17 1 1 A 78 78 ARG CB C 78 34.685 35.215 -0.530 1
1 915 . 17 1 1 A 78 78 ARG N N 78 120.595 117.259 3.336 1
1 916 . 17 1 1 A 79 79 SER H H 79 7.958 8.481 -0.523 1
1 917 . 17 1 1 A 79 79 SER HA H 79 4.030 4.297 -0.267 1
1 920 . 17 1 1 A 79 79 SER C C 79 174.311 174.662 -0.351 1
1 921 . 17 1 1 A 79 79 SER CA C 79 59.889 59.031 0.858 1
1 922 . 17 1 1 A 79 79 SER CB C 79 63.548 63.480 0.068 1
1 923 . 17 1 1 A 79 79 SER N N 79 112.565 118.248 -5.683 1
1 924 . 17 1 1 A 80 80 LEU H H 80 8.715 7.940 0.775 1
1 925 . 17 1 1 A 80 80 LEU HA H 80 4.114 4.849 -0.735 1
1 935 . 17 1 1 A 80 80 LEU C C 80 176.057 175.917 0.140 1
1 936 . 17 1 1 A 80 80 LEU CA C 80 55.091 53.378 1.713 1
1 937 . 17 1 1 A 80 80 LEU CB C 80 42.341 43.900 -1.559 1
1 941 . 17 1 1 A 80 80 LEU N N 80 123.070 125.555 -2.485 1
1 942 . 17 1 1 A 81 81 ASP H H 81 7.298 8.705 -1.407 1
1 943 . 17 1 1 A 81 81 ASP HA H 81 4.725 5.332 -0.607 1
1 946 . 17 1 1 A 81 81 ASP C C 81 175.939 175.992 -0.053 1
1 947 . 17 1 1 A 81 81 ASP CA C 81 53.664 52.822 0.842 1
1 948 . 17 1 1 A 81 81 ASP CB C 81 42.947 43.778 -0.831 1
1 949 . 17 1 1 A 81 81 ASP N N 81 115.229 121.376 -6.147 1
1 950 . 17 1 1 A 82 82 ARG H H 82 9.289 9.053 0.236 1
1 951 . 17 1 1 A 82 82 ARG HA H 82 4.416 4.315 0.101 1
1 959 . 17 1 1 A 82 82 ARG C C 82 176.406 178.299 -1.893 1
1 960 . 17 1 1 A 82 82 ARG CA C 82 56.397 59.231 -2.834 1
1 961 . 17 1 1 A 82 82 ARG CB C 82 30.638 30.560 0.078 1
1 964 . 17 1 1 A 82 82 ARG N N 82 123.174 123.939 -0.765 1
1 966 . 17 1 1 A 83 83 GLU H H 83 8.468 8.245 0.223 1
1 967 . 17 1 1 A 83 83 GLU HA H 83 3.982 4.003 -0.021 1
1 972 . 17 1 1 A 83 83 GLU C C 83 177.740 178.697 -0.957 1
1 973 . 17 1 1 A 83 83 GLU CA C 83 58.425 59.547 -1.122 1
1 974 . 17 1 1 A 83 83 GLU CB C 83 29.701 29.239 0.462 1
1 976 . 17 1 1 A 83 83 GLU N N 83 119.549 119.671 -0.122 1
1 977 . 17 1 1 A 84 84 GLU H H 84 8.033 7.730 0.303 1
1 978 . 17 1 1 A 84 84 GLU HA H 84 4.206 4.205 0.001 1
1 983 . 17 1 1 A 84 84 GLU C C 84 176.837 175.898 0.939 1
1 984 . 17 1 1 A 84 84 GLU CA C 84 58.056 58.518 -0.462 1
1 985 . 17 1 1 A 84 84 GLU CB C 84 30.432 30.896 -0.464 1
1 987 . 17 1 1 A 84 84 GLU N N 84 118.333 119.310 -0.977 1
1 988 . 17 1 1 A 85 85 THR H H 85 7.651 7.313 0.338 1
1 989 . 17 1 1 A 85 85 THR HA H 85 4.307 4.570 -0.263 1
1 994 . 17 1 1 A 85 85 THR C C 85 171.568 173.508 -1.940 1
1 995 . 17 1 1 A 85 85 THR CA C 85 61.387 59.742 1.645 1
1 996 . 17 1 1 A 85 85 THR CB C 85 69.963 70.930 -0.967 1
1 998 . 17 1 1 A 85 85 THR N N 85 112.444 112.106 0.338 1
1 999 . 17 1 1 A 86 86 ALA H H 86 8.639 8.590 0.049 1
1 1000 . 17 1 1 A 86 86 ALA HA H 86 4.603 4.409 0.194 1
1 1004 . 17 1 1 A 86 86 ALA C C 86 175.560 177.076 -1.516 1
1 1005 . 17 1 1 A 86 86 ALA CA C 86 52.156 53.688 -1.532 1
1 1006 . 17 1 1 A 86 86 ALA CB C 86 20.378 20.519 -0.141 1
1 1007 . 17 1 1 A 86 86 ALA N N 86 127.705 127.263 0.442 1
1 1008 . 17 1 1 A 87 87 ILE H H 87 7.663 7.676 -0.013 1
1 1009 . 17 1 1 A 87 87 ILE HA H 87 4.828 4.744 0.084 1
1 1019 . 17 1 1 A 87 87 ILE C C 87 174.537 174.560 -0.023 1
1 1020 . 17 1 1 A 87 87 ILE CA C 87 60.329 60.422 -0.093 1
1 1021 . 17 1 1 A 87 87 ILE CB C 87 41.090 39.435 1.655 1
1 1025 . 17 1 1 A 87 87 ILE N N 87 118.712 116.886 1.826 1
1 1026 . 17 1 1 A 88 88 HIS H H 88 9.098 8.889 0.209 1
1 1027 . 17 1 1 A 88 88 HIS HA H 88 4.576 5.045 -0.469 1
1 1032 . 17 1 1 A 88 88 HIS C C 88 174.354 174.019 0.335 1
1 1033 . 17 1 1 A 88 88 HIS CA C 88 54.740 54.158 0.582 1
1 1034 . 17 1 1 A 88 88 HIS CB C 88 33.955 31.682 2.273 1
1 1037 . 17 1 1 A 88 88 HIS N N 88 126.285 125.761 0.524 1
1 1038 . 17 1 1 A 89 89 LYS H H 89 8.957 8.934 0.023 1
1 1039 . 17 1 1 A 89 89 LYS HA H 89 4.873 4.706 0.167 1
1 1048 . 17 1 1 A 89 89 LYS C C 89 175.906 175.343 0.563 1
1 1049 . 17 1 1 A 89 89 LYS CA C 89 55.269 55.478 -0.209 1
1 1050 . 17 1 1 A 89 89 LYS CB C 89 32.945 33.027 -0.082 1
1 1054 . 17 1 1 A 89 89 LYS N N 89 124.332 124.608 -0.276 1
1 1055 . 17 1 1 A 90 90 VAL H H 90 9.174 8.712 0.462 1
1 1056 . 17 1 1 A 90 90 VAL HA H 90 4.227 4.873 -0.646 1
1 1064 . 17 1 1 A 90 90 VAL C C 90 174.168 174.972 -0.804 1
1 1065 . 17 1 1 A 90 90 VAL CA C 90 61.369 61.301 0.068 1
1 1066 . 17 1 1 A 90 90 VAL CB C 90 34.082 33.908 0.174 1
1 1069 . 17 1 1 A 90 90 VAL N N 90 124.319 125.107 -0.788 1
1 1070 . 17 1 1 A 91 91 THR H H 91 6.697 8.943 -2.246 1
1 1071 . 17 1 1 A 91 91 THR HA H 91 5.163 5.058 0.105 1
1 1076 . 17 1 1 A 91 91 THR C C 91 173.812 174.162 -0.350 1
1 1077 . 17 1 1 A 91 91 THR CA C 91 61.935 61.964 -0.029 1
1 1078 . 17 1 1 A 91 91 THR CB C 91 70.412 70.026 0.386 1
1 1080 . 17 1 1 A 91 91 THR N N 91 122.637 123.718 -1.081 1
1 1081 . 17 1 1 A 92 92 VAL H H 92 9.292 8.588 0.704 1
1 1082 . 17 1 1 A 92 92 VAL HA H 92 4.736 4.573 0.163 1
1 1090 . 17 1 1 A 92 92 VAL C C 92 173.160 175.013 -1.853 1
1 1091 . 17 1 1 A 92 92 VAL CA C 92 60.982 61.014 -0.032 1
1 1092 . 17 1 1 A 92 92 VAL CB C 92 35.130 33.832 1.298 1
1 1095 . 17 1 1 A 92 92 VAL N N 92 128.265 127.010 1.255 1
1 1096 . 17 1 1 A 93 93 LEU H H 93 9.495 8.968 0.527 1
1 1097 . 17 1 1 A 93 93 LEU HA H 93 5.628 5.246 0.382 1
1 1107 . 17 1 1 A 93 93 LEU C C 93 176.274 175.304 0.970 1
1 1108 . 17 1 1 A 93 93 LEU CA C 93 52.773 53.679 -0.906 1
1 1109 . 17 1 1 A 93 93 LEU CB C 93 43.454 43.558 -0.104 1
1 1113 . 17 1 1 A 93 93 LEU N N 93 126.350 127.323 -0.973 1
1 1114 . 17 1 1 A 94 94 ALA H H 94 8.688 9.279 -0.591 1
1 1115 . 17 1 1 A 94 94 ALA HA H 94 4.986 5.256 -0.270 1
1 1119 . 17 1 1 A 94 94 ALA C C 94 175.787 176.074 -0.287 1
1 1120 . 17 1 1 A 94 94 ALA CA C 94 49.610 50.192 -0.582 1
1 1121 . 17 1 1 A 94 94 ALA CB C 94 21.463 20.908 0.555 1
1 1122 . 17 1 1 A 94 94 ALA N N 94 123.429 129.259 -5.830 1
1 1123 . 17 1 1 A 95 95 SER H H 95 8.401 8.770 -0.369 1
1 1124 . 17 1 1 A 95 95 SER HA H 95 4.828 5.116 -0.288 1
1 1127 . 17 1 1 A 95 95 SER C C 95 174.327 172.193 2.134 1
1 1128 . 17 1 1 A 95 95 SER CA C 95 56.239 56.673 -0.434 1
1 1129 . 17 1 1 A 95 95 SER CB C 95 65.561 64.925 0.636 1
1 1130 . 17 1 1 A 95 95 SER N N 95 114.418 117.384 -2.966 1
1 1131 . 17 1 1 A 96 96 ASP H H 96 8.690 8.421 0.269 1
1 1132 . 17 1 1 A 96 96 ASP HA H 96 4.908 4.826 0.082 1
1 1135 . 17 1 1 A 96 96 ASP C C 96 177.096 176.045 1.051 1
1 1136 . 17 1 1 A 96 96 ASP CA C 96 52.818 52.977 -0.159 1
1 1137 . 17 1 1 A 96 96 ASP CB C 96 41.253 40.609 0.644 1
1 1138 . 17 1 1 A 96 96 ASP N N 96 125.624 124.752 0.872 1
1 1139 . 17 1 1 A 97 97 GLY H H 97 8.524 8.252 0.272 1
1 1140 . 17 1 1 A 97 97 GLY HA2 H 97 4.320 3.937 0.383 1
1 1141 . 17 1 1 A 97 97 GLY HA3 H 97 3.620 3.939 -0.319 1
1 1142 . 17 1 1 A 97 97 GLY C C 97 174.620 173.664 0.956 1
1 1143 . 17 1 1 A 97 97 GLY CA C 97 45.422 46.535 -1.113 1
1 1144 . 17 1 1 A 97 97 GLY N N 97 109.283 109.066 0.217 1
1 1145 . 17 1 1 A 98 98 SER H H 98 8.575 7.570 1.005 1
1 1146 . 17 1 1 A 98 98 SER HA H 98 4.607 4.925 -0.318 1
1 1149 . 17 1 1 A 98 98 SER C C 98 174.478 172.652 1.826 1
1 1150 . 17 1 1 A 98 98 SER CA C 98 59.095 57.336 1.759 1
1 1151 . 17 1 1 A 98 98 SER CB C 98 64.800 67.052 -2.252 1
1 1152 . 17 1 1 A 98 98 SER N N 98 116.640 114.899 1.741 1
1 1153 . 17 1 1 A 99 99 SER H H 99 8.945 8.676 0.269 1
1 1154 . 17 1 1 A 99 99 SER HA H 99 4.530 4.523 0.007 1
1 1157 . 17 1 1 A 99 99 SER C C 99 174.491 174.296 0.195 1
1 1158 . 17 1 1 A 99 99 SER CA C 99 58.460 58.373 0.087 1
1 1159 . 17 1 1 A 99 99 SER CB C 99 64.146 64.112 0.034 1
1 1160 . 17 1 1 A 99 99 SER N N 99 117.676 118.174 -0.498 1
1 1161 . 17 1 1 A 100 100 THR H H 100 8.411 8.325 0.086 1
1 1162 . 17 1 1 A 100 100 THR HA H 100 4.490 4.193 0.297 1
1 1167 . 17 1 1 A 100 100 THR C C 100 172.766 172.879 -0.113 1
1 1168 . 17 1 1 A 100 100 THR CA C 100 60.629 61.415 -0.786 1
1 1169 . 17 1 1 A 100 100 THR CB C 100 69.778 69.404 0.374 1
1 1171 . 17 1 1 A 100 100 THR N N 100 118.401 118.392 0.009 1
1 1172 . 17 1 1 A 101 101 PRO HA H 101 4.631 4.525 0.106 1
1 1179 . 17 1 1 A 101 101 PRO C C 101 177.227 176.311 0.916 1
1 1180 . 17 1 1 A 101 101 PRO CA C 101 63.097 62.362 0.735 1
1 1181 . 17 1 1 A 101 101 PRO CB C 101 32.917 32.370 0.547 1
1 1184 . 17 1 1 A 102 102 ALA H H 102 8.497 7.884 0.613 1
1 1185 . 17 1 1 A 102 102 ALA HA H 102 4.619 4.383 0.236 1
1 1189 . 17 1 1 A 102 102 ALA C C 102 176.542 177.215 -0.673 1
1 1190 . 17 1 1 A 102 102 ALA CA C 102 51.390 52.256 -0.866 1
1 1191 . 17 1 1 A 102 102 ALA CB C 102 20.815 19.617 1.198 1
1 1192 . 17 1 1 A 102 102 ALA N N 102 124.487 122.979 1.508 1
1 1193 . 17 1 1 A 103 103 ARG H H 103 8.663 8.553 0.110 1
1 1194 . 17 1 1 A 103 103 ARG HA H 103 5.515 5.407 0.108 1
1 1201 . 17 1 1 A 103 103 ARG C C 103 174.539 174.638 -0.099 1
1 1202 . 17 1 1 A 103 103 ARG CA C 103 55.164 54.498 0.666 1
1 1203 . 17 1 1 A 103 103 ARG CB C 103 34.393 34.160 0.233 1
1 1206 . 17 1 1 A 103 103 ARG N N 103 119.596 117.585 2.011 1
1 1207 . 17 1 1 A 104 104 ALA H H 104 9.027 8.476 0.551 1
1 1208 . 17 1 1 A 104 104 ALA HA H 104 4.782 5.066 -0.284 1
1 1212 . 17 1 1 A 104 104 ALA C C 104 176.276 175.537 0.739 1
1 1213 . 17 1 1 A 104 104 ALA CA C 104 50.297 51.462 -1.165 1
1 1214 . 17 1 1 A 104 104 ALA CB C 104 20.810 21.527 -0.717 1
1 1215 . 17 1 1 A 104 104 ALA N N 104 126.962 123.328 3.634 1
1 1216 . 17 1 1 A 105 105 THR H H 105 8.384 8.720 -0.336 1
1 1217 . 17 1 1 A 105 105 THR HA H 105 4.954 4.775 0.179 1
1 1222 . 17 1 1 A 105 105 THR C C 105 173.243 174.037 -0.794 1
1 1223 . 17 1 1 A 105 105 THR CA C 105 61.475 62.208 -0.733 1
1 1224 . 17 1 1 A 105 105 THR CB C 105 70.569 69.443 1.126 1
1 1226 . 17 1 1 A 105 105 THR N N 105 115.327 118.978 -3.651 1
1 1227 . 17 1 1 A 106 106 VAL H H 106 8.970 8.866 0.104 1
1 1228 . 17 1 1 A 106 106 VAL HA H 106 4.702 4.576 0.126 1
1 1236 . 17 1 1 A 106 106 VAL C C 106 174.743 175.056 -0.313 1
1 1237 . 17 1 1 A 106 106 VAL CA C 106 59.712 60.945 -1.233 1
1 1238 . 17 1 1 A 106 106 VAL CB C 106 34.327 32.927 1.400 1
1 1241 . 17 1 1 A 106 106 VAL N N 106 126.226 128.133 -1.907 1
1 1242 . 17 1 1 A 107 107 THR H H 107 8.833 8.555 0.278 1
1 1243 . 17 1 1 A 107 107 THR HA H 107 4.862 4.742 0.120 1
1 1248 . 17 1 1 A 107 107 THR C C 107 172.970 173.967 -0.997 1
1 1249 . 17 1 1 A 107 107 THR CA C 107 62.322 62.047 0.275 1
1 1250 . 17 1 1 A 107 107 THR CB C 107 69.463 69.298 0.165 1
1 1252 . 17 1 1 A 107 107 THR N N 107 125.403 122.616 2.787 1
1 1253 . 17 1 1 A 108 108 ILE H H 108 9.234 8.976 0.258 1
1 1254 . 17 1 1 A 108 108 ILE HA H 108 4.178 4.583 -0.405 1
1 1264 . 17 1 1 A 108 108 ILE C C 108 174.087 174.544 -0.457 1
1 1265 . 17 1 1 A 108 108 ILE CA C 108 60.365 60.380 -0.015 1
1 1266 . 17 1 1 A 108 108 ILE CB C 108 39.745 38.725 1.020 1
1 1270 . 17 1 1 A 108 108 ILE N N 108 127.152 129.113 -1.961 1
1 1271 . 17 1 1 A 109 109 ASN H H 109 8.723 8.885 -0.162 1
1 1272 . 17 1 1 A 109 109 ASN HA H 109 5.147 5.122 0.025 1
1 1277 . 17 1 1 A 109 109 ASN C C 109 173.592 174.511 -0.919 1
1 1278 . 17 1 1 A 109 109 ASN CA C 109 52.501 52.778 -0.277 1
1 1279 . 17 1 1 A 109 109 ASN CB C 109 40.791 39.644 1.147 1
1 1280 . 17 1 1 A 109 109 ASN N N 109 126.866 126.278 0.588 1
1 1282 . 17 1 1 A 110 110 VAL H H 110 9.046 8.225 0.821 1
1 1283 . 17 1 1 A 110 110 VAL HA H 110 5.081 4.891 0.190 1
1 1291 . 17 1 1 A 110 110 VAL C C 110 176.921 175.744 1.177 1
1 1292 . 17 1 1 A 110 110 VAL CA C 110 61.634 62.408 -0.774 1
1 1293 . 17 1 1 A 110 110 VAL CB C 110 31.809 31.748 0.061 1
1 1296 . 17 1 1 A 110 110 VAL N N 110 126.070 125.257 0.813 1
1 1297 . 17 1 1 A 111 111 THR H H 111 9.197 8.495 0.702 1
1 1298 . 17 1 1 A 111 111 THR HA H 111 4.566 5.055 -0.489 1
1 1303 . 17 1 1 A 111 111 THR C C 111 174.087 173.821 0.266 1
1 1304 . 17 1 1 A 111 111 THR CA C 111 61.145 59.401 1.744 1
1 1305 . 17 1 1 A 111 111 THR CB C 111 70.706 71.846 -1.140 1
1 1307 . 17 1 1 A 111 111 THR N N 111 121.425 117.067 4.358 1
1 1308 . 17 1 1 A 112 112 ASP H H 112 8.435 8.532 -0.097 1
1 1309 . 17 1 1 A 112 112 ASP HA H 112 4.656 4.583 0.073 1
1 1312 . 17 1 1 A 112 112 ASP C C 112 176.745 176.627 0.118 1
1 1313 . 17 1 1 A 112 112 ASP CA C 112 54.158 54.905 -0.747 1
1 1314 . 17 1 1 A 112 112 ASP CB C 112 41.575 41.687 -0.112 1
1 1315 . 17 1 1 A 112 112 ASP N N 112 119.566 121.044 -1.478 1
1 1316 . 17 1 1 A 113 113 VAL H H 113 8.629 8.517 0.112 1
1 1317 . 17 1 1 A 113 113 VAL HA H 113 4.078 4.146 -0.068 1
1 1325 . 17 1 1 A 113 113 VAL C C 113 175.247 177.482 -2.235 1
1 1326 . 17 1 1 A 113 113 VAL CA C 113 62.533 63.696 -1.163 1
1 1327 . 17 1 1 A 113 113 VAL CB C 113 32.534 32.832 -0.298 1
1 1330 . 17 1 1 A 113 113 VAL N N 113 119.356 123.192 -3.836 1
1 4 . 18 1 1 A 2 2 SER H H 2 8.289 8.436 -0.147 1
1 5 . 18 1 1 A 2 2 SER HA H 2 4.530 5.013 -0.483 1
1 7 . 18 1 1 A 2 2 SER C C 2 174.868 173.527 1.341 1
1 8 . 18 1 1 A 2 2 SER CA C 2 58.284 57.597 0.687 1
1 9 . 18 1 1 A 2 2 SER CB C 2 63.769 67.080 -3.311 1
1 10 . 18 1 1 A 2 2 SER N N 2 115.842 115.831 0.011 1
1 11 . 18 1 1 A 3 3 SER H H 3 8.490 8.503 -0.013 1
1 12 . 18 1 1 A 3 3 SER HA H 3 4.496 4.635 -0.139 1
1 14 . 18 1 1 A 3 3 SER C C 3 175.043 175.418 -0.375 1
1 15 . 18 1 1 A 3 3 SER CA C 3 58.549 58.400 0.149 1
1 16 . 18 1 1 A 3 3 SER CB C 3 63.687 64.115 -0.428 1
1 17 . 18 1 1 A 3 3 SER N N 3 117.930 115.190 2.740 1
1 18 . 18 1 1 A 4 4 GLY H H 4 8.482 7.694 0.788 1
1 19 . 18 1 1 A 4 4 GLY C C 4 174.344 174.496 -0.152 1
1 20 . 18 1 1 A 4 4 GLY CA C 4 45.536 45.699 -0.163 1
1 21 . 18 1 1 A 4 4 GLY N N 4 110.985 110.098 0.887 1
1 22 . 18 1 1 A 6 6 SER HA H 6 4.508 4.556 -0.048 1
1 24 . 18 1 1 A 6 6 SER C C 6 175.026 174.918 0.108 1
1 25 . 18 1 1 A 6 6 SER CA C 6 58.584 58.018 0.566 1
1 26 . 18 1 1 A 6 6 SER CB C 6 63.646 64.730 -1.084 1
1 27 . 18 1 1 A 7 7 GLY H H 7 8.419 8.432 -0.013 1
1 28 . 18 1 1 A 7 7 GLY HA2 H 7 3.993 4.027 -0.034 1
1 29 . 18 1 1 A 7 7 GLY C C 7 173.995 173.560 0.435 1
1 30 . 18 1 1 A 7 7 GLY CA C 7 45.466 44.475 0.991 1
1 31 . 18 1 1 A 7 7 GLY N N 7 110.615 111.040 -0.425 1
1 32 . 18 1 1 A 8 8 ASN H H 8 8.322 8.193 0.129 1
1 33 . 18 1 1 A 8 8 ASN HA H 8 4.736 5.056 -0.320 1
1 38 . 18 1 1 A 8 8 ASN C C 8 174.907 175.068 -0.161 1
1 39 . 18 1 1 A 8 8 ASN CA C 8 53.259 52.025 1.234 1
1 40 . 18 1 1 A 8 8 ASN CB C 8 39.127 41.180 -2.053 1
1 41 . 18 1 1 A 8 8 ASN N N 8 118.602 120.377 -1.775 1
1 43 . 18 1 1 A 9 9 ASP H H 9 8.370 8.546 -0.176 1
1 44 . 18 1 1 A 9 9 ASP HA H 9 4.594 4.533 0.061 1
1 47 . 18 1 1 A 9 9 ASP C C 9 175.765 175.974 -0.209 1
1 48 . 18 1 1 A 9 9 ASP CA C 9 54.440 55.024 -0.584 1
1 49 . 18 1 1 A 9 9 ASP CB C 9 40.898 41.172 -0.274 1
1 50 . 18 1 1 A 9 9 ASP N N 9 120.504 120.059 0.445 1
1 51 . 18 1 1 A 10 10 ASN H H 10 8.382 8.588 -0.206 1
1 52 . 18 1 1 A 10 10 ASN HA H 10 4.691 5.251 -0.560 1
1 57 . 18 1 1 A 10 10 ASN C C 10 174.383 173.821 0.562 1
1 58 . 18 1 1 A 10 10 ASN CA C 10 53.241 52.821 0.420 1
1 59 . 18 1 1 A 10 10 ASN CB C 10 38.674 41.462 -2.788 1
1 60 . 18 1 1 A 10 10 ASN N N 10 119.406 120.210 -0.804 1
1 62 . 18 1 1 A 11 11 ARG H H 11 7.942 8.900 -0.958 1
1 63 . 18 1 1 A 11 11 ARG HA H 11 4.684 4.949 -0.265 1
1 70 . 18 1 1 A 11 11 ARG C C 11 173.640 174.047 -0.407 1
1 71 . 18 1 1 A 11 11 ARG CA C 11 54.246 53.611 0.635 1
1 72 . 18 1 1 A 11 11 ARG CB C 11 30.337 32.952 -2.615 1
1 75 . 18 1 1 A 11 11 ARG N N 11 121.145 124.684 -3.539 1
1 76 . 18 1 1 A 12 12 PRO HA H 12 4.507 4.681 -0.174 1
1 83 . 18 1 1 A 12 12 PRO CA C 12 62.714 62.529 0.185 1
1 84 . 18 1 1 A 12 12 PRO CB C 12 31.942 32.617 -0.675 1
1 87 . 18 1 1 A 13 13 VAL H H 13 8.252 8.428 -0.176 1
1 88 . 18 1 1 A 13 13 VAL HA H 13 4.159 4.736 -0.577 1
1 96 . 18 1 1 A 13 13 VAL CA C 13 61.409 59.566 1.843 1
1 97 . 18 1 1 A 13 13 VAL CB C 13 34.858 35.071 -0.213 1
1 100 . 18 1 1 A 13 13 VAL N N 13 118.395 121.492 -3.097 1
1 101 . 18 1 1 A 14 14 PHE H H 14 8.725 8.858 -0.133 1
1 102 . 18 1 1 A 14 14 PHE HA H 14 4.781 4.719 0.062 1
1 110 . 18 1 1 A 14 14 PHE CA C 14 58.594 58.427 0.167 1
1 111 . 18 1 1 A 14 14 PHE CB C 14 39.594 40.020 -0.426 1
1 117 . 18 1 1 A 14 14 PHE N N 14 122.950 127.004 -4.054 1
1 118 . 18 1 1 A 15 15 LYS H H 15 8.885 8.966 -0.081 1
1 119 . 18 1 1 A 15 15 LYS HA H 15 4.130 4.042 0.088 1
1 128 . 18 1 1 A 15 15 LYS C C 15 177.027 175.986 1.041 1
1 129 . 18 1 1 A 15 15 LYS CA C 15 58.478 59.760 -1.282 1
1 130 . 18 1 1 A 15 15 LYS CB C 15 32.748 32.585 0.163 1
1 134 . 18 1 1 A 15 15 LYS N N 15 123.863 123.131 0.732 1
1 135 . 18 1 1 A 16 16 GLU H H 16 8.091 7.720 0.371 1
1 136 . 18 1 1 A 16 16 GLU HA H 16 4.438 4.708 -0.270 1
1 141 . 18 1 1 A 16 16 GLU C C 16 175.947 176.994 -1.047 1
1 142 . 18 1 1 A 16 16 GLU CA C 16 56.045 55.077 0.968 1
1 143 . 18 1 1 A 16 16 GLU CB C 16 30.766 32.225 -1.459 1
1 145 . 18 1 1 A 16 16 GLU N N 16 117.026 113.126 3.900 1
1 146 . 18 1 1 A 17 17 GLY H H 17 8.421 8.741 -0.320 1
1 147 . 18 1 1 A 17 17 GLY HA2 H 17 3.993 3.852 0.141 1
1 148 . 18 1 1 A 17 17 GLY HA3 H 17 3.913 3.868 0.045 1
1 149 . 18 1 1 A 17 17 GLY C C 17 173.564 174.033 -0.469 1
1 150 . 18 1 1 A 17 17 GLY CA C 17 45.448 47.323 -1.875 1
1 151 . 18 1 1 A 17 17 GLY N N 17 109.577 108.587 0.990 1
1 152 . 18 1 1 A 18 18 GLN H H 18 7.858 7.930 -0.072 1
1 153 . 18 1 1 A 18 18 GLN HA H 18 5.065 4.772 0.293 1
1 160 . 18 1 1 A 18 18 GLN C C 18 174.596 174.593 0.003 1
1 161 . 18 1 1 A 18 18 GLN CA C 18 55.110 54.607 0.503 1
1 162 . 18 1 1 A 18 18 GLN CB C 18 30.329 31.134 -0.805 1
1 164 . 18 1 1 A 18 18 GLN N N 18 120.202 119.775 0.427 1
1 166 . 18 1 1 A 19 19 VAL H H 19 8.216 8.124 0.092 1
1 167 . 18 1 1 A 19 19 VAL HA H 19 4.450 4.781 -0.331 1
1 175 . 18 1 1 A 19 19 VAL C C 19 173.648 174.082 -0.434 1
1 176 . 18 1 1 A 19 19 VAL CA C 19 60.788 60.595 0.193 1
1 177 . 18 1 1 A 19 19 VAL CB C 19 35.336 35.179 0.157 1
1 180 . 18 1 1 A 19 19 VAL N N 19 121.257 125.682 -4.425 1
1 181 . 18 1 1 A 20 20 GLU H H 20 8.610 9.117 -0.507 1
1 182 . 18 1 1 A 20 20 GLU HA H 20 5.211 5.290 -0.079 1
1 187 . 18 1 1 A 20 20 GLU C C 20 174.783 175.044 -0.261 1
1 188 . 18 1 1 A 20 20 GLU CA C 20 54.793 54.710 0.083 1
1 189 . 18 1 1 A 20 20 GLU CB C 20 32.058 33.442 -1.384 1
1 191 . 18 1 1 A 20 20 GLU N N 20 127.095 127.988 -0.893 1
1 192 . 18 1 1 A 21 21 VAL H H 21 8.727 8.540 0.187 1
1 193 . 18 1 1 A 21 21 VAL HA H 21 4.633 4.988 -0.355 1
1 201 . 18 1 1 A 21 21 VAL C C 21 173.894 174.685 -0.791 1
1 202 . 18 1 1 A 21 21 VAL CA C 21 59.695 59.295 0.400 1
1 203 . 18 1 1 A 21 21 VAL CB C 21 35.865 35.659 0.206 1
1 206 . 18 1 1 A 21 21 VAL N N 21 120.489 120.100 0.389 1
1 207 . 18 1 1 A 22 22 HIS H H 22 8.680 8.697 -0.017 1
1 208 . 18 1 1 A 22 22 HIS HA H 22 5.552 5.747 -0.195 1
1 212 . 18 1 1 A 22 22 HIS C C 22 174.298 173.715 0.583 1
1 213 . 18 1 1 A 22 22 HIS CA C 22 55.331 53.805 1.526 1
1 214 . 18 1 1 A 22 22 HIS CB C 22 32.369 32.244 0.125 1
1 216 . 18 1 1 A 22 22 HIS N N 22 124.991 119.615 5.376 1
1 217 . 18 1 1 A 23 23 ILE H H 23 9.179 8.503 0.676 1
1 218 . 18 1 1 A 23 23 ILE HA H 23 5.046 4.698 0.348 1
1 228 . 18 1 1 A 23 23 ILE C C 23 171.552 173.755 -2.203 1
1 229 . 18 1 1 A 23 23 ILE CA C 23 55.551 57.281 -1.730 1
1 230 . 18 1 1 A 23 23 ILE CB C 23 42.053 42.076 -0.023 1
1 234 . 18 1 1 A 23 23 ILE N N 23 123.121 122.573 0.548 1
1 235 . 18 1 1 A 24 24 PRO HA H 24 4.816 4.848 -0.032 1
1 242 . 18 1 1 A 24 24 PRO C C 24 178.887 177.729 1.158 1
1 243 . 18 1 1 A 24 24 PRO CA C 24 62.216 62.641 -0.425 1
1 244 . 18 1 1 A 24 24 PRO CB C 24 32.895 32.712 0.183 1
1 247 . 18 1 1 A 25 25 GLU H H 25 8.399 8.425 -0.026 1
1 248 . 18 1 1 A 25 25 GLU HA H 25 3.785 4.042 -0.257 1
1 253 . 18 1 1 A 25 25 GLU C C 25 175.244 177.329 -2.085 1
1 254 . 18 1 1 A 25 25 GLU CA C 25 58.425 59.170 -0.745 1
1 255 . 18 1 1 A 25 25 GLU CB C 25 30.011 29.034 0.977 1
1 257 . 18 1 1 A 25 25 GLU N N 25 117.706 122.188 -4.482 1
1 258 . 18 1 1 A 26 26 ASN H H 26 7.488 7.721 -0.233 1
1 259 . 18 1 1 A 26 26 ASN HA H 26 4.702 4.854 -0.152 1
1 264 . 18 1 1 A 26 26 ASN C C 26 175.425 174.744 0.681 1
1 265 . 18 1 1 A 26 26 ASN CA C 26 51.584 52.969 -1.385 1
1 266 . 18 1 1 A 26 26 ASN CB C 26 37.243 38.653 -1.410 1
1 267 . 18 1 1 A 26 26 ASN N N 26 112.383 115.958 -3.575 1
1 269 . 18 1 1 A 27 27 ALA H H 27 7.716 7.409 0.307 1
1 270 . 18 1 1 A 27 27 ALA HA H 27 4.409 4.440 -0.031 1
1 274 . 18 1 1 A 27 27 ALA C C 27 175.850 175.867 -0.017 1
1 275 . 18 1 1 A 27 27 ALA CA C 27 51.037 50.880 0.157 1
1 276 . 18 1 1 A 27 27 ALA CB C 27 18.152 18.242 -0.090 1
1 277 . 18 1 1 A 27 27 ALA N N 27 125.139 123.283 1.856 1
1 278 . 18 1 1 A 28 28 PRO HA H 28 4.422 4.519 -0.097 1
1 285 . 18 1 1 A 28 28 PRO C C 28 178.442 176.942 1.500 1
1 286 . 18 1 1 A 28 28 PRO CA C 28 62.067 62.651 -0.584 1
1 287 . 18 1 1 A 28 28 PRO CB C 28 32.642 32.032 0.610 1
1 290 . 18 1 1 A 29 29 VAL H H 29 8.691 8.315 0.376 1
1 291 . 18 1 1 A 29 29 VAL HA H 29 3.239 3.607 -0.368 1
1 299 . 18 1 1 A 29 29 VAL C C 29 176.887 177.268 -0.381 1
1 300 . 18 1 1 A 29 29 VAL CA C 29 65.812 64.138 1.674 1
1 301 . 18 1 1 A 29 29 VAL CB C 29 31.174 31.547 -0.373 1
1 304 . 18 1 1 A 29 29 VAL N N 29 123.592 122.797 0.795 1
1 305 . 18 1 1 A 30 30 GLY H H 30 9.197 8.947 0.250 1
1 306 . 18 1 1 A 30 30 GLY HA2 H 30 4.486 3.951 0.535 1
1 307 . 18 1 1 A 30 30 GLY HA3 H 30 3.581 3.952 -0.371 1
1 308 . 18 1 1 A 30 30 GLY C C 30 174.347 174.817 -0.470 1
1 309 . 18 1 1 A 30 30 GLY CA C 30 44.320 45.187 -0.867 1
1 310 . 18 1 1 A 30 30 GLY N N 30 116.042 115.166 0.876 1
1 311 . 18 1 1 A 31 31 THR H H 31 7.838 7.906 -0.068 1
1 312 . 18 1 1 A 31 31 THR HA H 31 3.959 4.157 -0.198 1
1 317 . 18 1 1 A 31 31 THR C C 31 174.274 174.017 0.257 1
1 318 . 18 1 1 A 31 31 THR CA C 31 65.160 63.295 1.865 1
1 319 . 18 1 1 A 31 31 THR CB C 31 69.972 68.936 1.036 1
1 321 . 18 1 1 A 31 31 THR N N 31 117.679 118.530 -0.851 1
1 322 . 18 1 1 A 32 32 SER H H 32 9.022 8.602 0.420 1
1 323 . 18 1 1 A 32 32 SER HA H 32 4.273 4.651 -0.378 1
1 326 . 18 1 1 A 32 32 SER C C 32 172.692 174.353 -1.661 1
1 327 . 18 1 1 A 32 32 SER CA C 32 59.642 58.249 1.393 1
1 328 . 18 1 1 A 32 32 SER CB C 32 63.102 62.818 0.284 1
1 329 . 18 1 1 A 32 32 SER N N 32 123.045 121.681 1.364 1
1 330 . 18 1 1 A 33 33 VAL H H 33 9.202 8.847 0.355 1
1 331 . 18 1 1 A 33 33 VAL HA H 33 3.844 3.926 -0.082 1
1 339 . 18 1 1 A 33 33 VAL C C 33 174.782 175.800 -1.018 1
1 340 . 18 1 1 A 33 33 VAL CA C 33 64.242 64.340 -0.098 1
1 341 . 18 1 1 A 33 33 VAL CB C 33 32.893 32.011 0.882 1
1 344 . 18 1 1 A 33 33 VAL N N 33 126.861 124.937 1.924 1
1 345 . 18 1 1 A 34 34 ILE H H 34 7.074 7.910 -0.836 1
1 346 . 18 1 1 A 34 34 ILE HA H 34 4.295 4.652 -0.357 1
1 356 . 18 1 1 A 34 34 ILE C C 34 170.577 172.960 -2.383 1
1 357 . 18 1 1 A 34 34 ILE CA C 34 59.500 59.214 0.286 1
1 358 . 18 1 1 A 34 34 ILE CB C 34 39.251 42.117 -2.866 1
1 362 . 18 1 1 A 34 34 ILE N N 34 111.445 118.767 -7.322 1
1 363 . 18 1 1 A 35 35 GLN H H 35 8.450 8.928 -0.478 1
1 364 . 18 1 1 A 35 35 GLN HA H 35 4.633 4.797 -0.164 1
1 371 . 18 1 1 A 35 35 GLN C C 35 174.354 175.125 -0.771 1
1 372 . 18 1 1 A 35 35 GLN CA C 35 54.176 54.389 -0.213 1
1 373 . 18 1 1 A 35 35 GLN CB C 35 29.456 31.284 -1.828 1
1 375 . 18 1 1 A 35 35 GLN N N 35 127.342 128.295 -0.953 1
1 377 . 18 1 1 A 36 36 LEU H H 36 7.761 8.373 -0.612 1
1 378 . 18 1 1 A 36 36 LEU HA H 36 4.492 4.326 0.166 1
1 388 . 18 1 1 A 36 36 LEU C C 36 175.543 176.296 -0.753 1
1 389 . 18 1 1 A 36 36 LEU CA C 36 53.982 55.222 -1.240 1
1 390 . 18 1 1 A 36 36 LEU CB C 36 42.776 42.244 0.532 1
1 394 . 18 1 1 A 36 36 LEU N N 36 128.895 127.223 1.672 1
1 395 . 18 1 1 A 37 37 HIS H H 37 8.529 9.091 -0.562 1
1 396 . 18 1 1 A 37 37 HIS HA H 37 4.851 5.257 -0.406 1
1 400 . 18 1 1 A 37 37 HIS C C 37 172.985 173.137 -0.152 1
1 401 . 18 1 1 A 37 37 HIS CA C 37 55.833 54.500 1.333 1
1 402 . 18 1 1 A 37 37 HIS CB C 37 32.204 33.328 -1.124 1
1 404 . 18 1 1 A 37 37 HIS N N 37 115.903 124.309 -8.406 1
1 405 . 18 1 1 A 38 38 ALA H H 38 8.474 8.642 -0.168 1
1 406 . 18 1 1 A 38 38 ALA HA H 38 4.691 5.321 -0.630 1
1 410 . 18 1 1 A 38 38 ALA C C 38 175.548 176.249 -0.701 1
1 411 . 18 1 1 A 38 38 ALA CA C 38 50.491 50.322 0.169 1
1 412 . 18 1 1 A 38 38 ALA CB C 38 19.842 21.557 -1.715 1
1 413 . 18 1 1 A 38 38 ALA N N 38 128.891 130.402 -1.511 1
1 414 . 18 1 1 A 39 39 THR H H 39 8.095 9.029 -0.934 1
1 415 . 18 1 1 A 39 39 THR HA H 39 4.336 5.320 -0.984 1
1 420 . 18 1 1 A 39 39 THR C C 39 173.553 172.641 0.912 1
1 421 . 18 1 1 A 39 39 THR CA C 39 60.417 60.499 -0.082 1
1 422 . 18 1 1 A 39 39 THR CB C 39 70.912 70.926 -0.014 1
1 424 . 18 1 1 A 39 39 THR N N 39 110.982 113.650 -2.668 1
1 425 . 18 1 1 A 40 40 ASP H H 40 8.417 8.950 -0.533 1
1 426 . 18 1 1 A 40 40 ASP HA H 40 4.553 5.085 -0.532 1
1 429 . 18 1 1 A 40 40 ASP C C 40 176.462 175.256 1.206 1
1 430 . 18 1 1 A 40 40 ASP CA C 40 54.158 53.287 0.871 1
1 431 . 18 1 1 A 40 40 ASP CB C 40 41.517 43.517 -2.000 1
1 432 . 18 1 1 A 40 40 ASP N N 40 121.450 127.318 -5.868 1
1 433 . 18 1 1 A 41 41 ALA H H 41 8.435 8.535 -0.100 1
1 434 . 18 1 1 A 41 41 ALA HA H 41 4.129 3.826 0.303 1
1 438 . 18 1 1 A 41 41 ALA C C 41 177.718 176.569 1.149 1
1 439 . 18 1 1 A 41 41 ALA CA C 41 53.436 52.934 0.502 1
1 440 . 18 1 1 A 41 41 ALA CB C 41 19.183 17.164 2.019 1
1 441 . 18 1 1 A 41 41 ALA N N 41 124.607 127.913 -3.306 1
1 442 . 18 1 1 A 42 42 ASP H H 42 8.310 7.885 0.425 1
1 443 . 18 1 1 A 42 42 ASP HA H 42 4.588 4.727 -0.139 1
1 446 . 18 1 1 A 42 42 ASP C C 42 176.546 175.213 1.333 1
1 447 . 18 1 1 A 42 42 ASP CA C 42 54.599 53.048 1.551 1
1 448 . 18 1 1 A 42 42 ASP CB C 42 41.146 38.870 2.276 1
1 449 . 18 1 1 A 42 42 ASP N N 42 118.030 117.245 0.785 1
1 450 . 18 1 1 A 43 43 ILE H H 43 8.000 8.061 -0.061 1
1 451 . 18 1 1 A 43 43 ILE HA H 43 4.130 4.499 -0.369 1
1 461 . 18 1 1 A 43 43 ILE C C 43 176.901 175.584 1.317 1
1 462 . 18 1 1 A 43 43 ILE CA C 43 61.740 60.240 1.500 1
1 463 . 18 1 1 A 43 43 ILE CB C 43 38.491 38.355 0.136 1
1 467 . 18 1 1 A 43 43 ILE N N 43 119.301 118.135 1.166 1
1 468 . 18 1 1 A 44 44 GLY H H 44 8.448 8.321 0.127 1
1 469 . 18 1 1 A 44 44 GLY HA2 H 44 3.939 4.064 -0.125 1
1 470 . 18 1 1 A 44 44 GLY HA3 H 44 3.939 4.065 -0.126 1
1 471 . 18 1 1 A 44 44 GLY C C 44 174.393 173.162 1.231 1
1 472 . 18 1 1 A 44 44 GLY CA C 44 45.501 45.434 0.067 1
1 473 . 18 1 1 A 44 44 GLY N N 44 111.333 114.903 -3.570 1
1 474 . 18 1 1 A 45 45 SER H H 45 8.061 8.262 -0.201 1
1 475 . 18 1 1 A 45 45 SER HA H 45 4.416 4.856 -0.440 1
1 478 . 18 1 1 A 45 45 SER C C 45 174.480 173.509 0.971 1
1 479 . 18 1 1 A 45 45 SER CA C 45 58.478 56.834 1.644 1
1 480 . 18 1 1 A 45 45 SER CB C 45 63.943 64.523 -0.580 1
1 481 . 18 1 1 A 45 45 SER N N 45 115.551 120.328 -4.777 1
1 482 . 18 1 1 A 46 46 ASN H H 46 8.547 8.519 0.028 1
1 483 . 18 1 1 A 46 46 ASN HA H 46 4.725 4.944 -0.219 1
1 488 . 18 1 1 A 46 46 ASN C C 46 175.031 174.765 0.266 1
1 489 . 18 1 1 A 46 46 ASN CA C 46 53.277 52.496 0.781 1
1 490 . 18 1 1 A 46 46 ASN CB C 46 38.798 38.927 -0.129 1
1 491 . 18 1 1 A 46 46 ASN N N 46 120.698 123.649 -2.951 1
1 493 . 18 1 1 A 47 47 ALA H H 47 8.239 8.396 -0.157 1
1 494 . 18 1 1 A 47 47 ALA HA H 47 4.283 4.287 -0.004 1
1 498 . 18 1 1 A 47 47 ALA C C 47 177.240 177.062 0.178 1
1 499 . 18 1 1 A 47 47 ALA CA C 47 52.731 52.391 0.340 1
1 500 . 18 1 1 A 47 47 ALA CB C 47 19.594 19.084 0.510 1
1 501 . 18 1 1 A 47 47 ALA N N 47 124.093 128.910 -4.817 1
1 502 . 18 1 1 A 48 48 GLU H H 48 8.376 8.552 -0.176 1
1 503 . 18 1 1 A 48 48 GLU HA H 48 4.264 4.478 -0.214 1
1 508 . 18 1 1 A 48 48 GLU C C 48 175.702 175.218 0.484 1
1 509 . 18 1 1 A 48 48 GLU CA C 48 55.992 55.477 0.515 1
1 510 . 18 1 1 A 48 48 GLU CB C 48 30.210 29.350 0.860 1
1 512 . 18 1 1 A 48 48 GLU N N 48 119.750 121.602 -1.852 1
1 513 . 18 1 1 A 49 49 ILE H H 49 7.806 8.285 -0.479 1
1 514 . 18 1 1 A 49 49 ILE HA H 49 3.919 4.260 -0.341 1
1 524 . 18 1 1 A 49 49 ILE C C 49 175.894 175.179 0.715 1
1 525 . 18 1 1 A 49 49 ILE CA C 49 60.559 61.048 -0.489 1
1 526 . 18 1 1 A 49 49 ILE CB C 49 37.860 37.850 0.010 1
1 530 . 18 1 1 A 49 49 ILE N N 49 122.772 125.587 -2.815 1
1 531 . 18 1 1 A 50 50 ARG H H 50 8.247 8.614 -0.367 1
1 532 . 18 1 1 A 50 50 ARG HA H 50 4.999 4.504 0.495 1
1 539 . 18 1 1 A 50 50 ARG C C 50 174.603 174.394 0.209 1
1 540 . 18 1 1 A 50 50 ARG CA C 50 53.189 55.501 -2.312 1
1 541 . 18 1 1 A 50 50 ARG CB C 50 33.152 31.259 1.893 1
1 544 . 18 1 1 A 50 50 ARG N N 50 126.912 128.745 -1.833 1
1 545 . 18 1 1 A 51 51 TYR H H 51 9.041 8.833 0.208 1
1 546 . 18 1 1 A 51 51 TYR HA H 51 5.395 5.315 0.080 1
1 553 . 18 1 1 A 51 51 TYR C C 51 175.555 175.193 0.362 1
1 554 . 18 1 1 A 51 51 TYR CA C 51 56.909 56.760 0.149 1
1 555 . 18 1 1 A 51 51 TYR CB C 51 40.116 40.548 -0.432 1
1 560 . 18 1 1 A 51 51 TYR N N 51 121.627 122.568 -0.941 1
1 561 . 18 1 1 A 52 52 ILE H H 52 8.850 8.435 0.415 1
1 562 . 18 1 1 A 52 52 ILE HA H 52 4.576 4.977 -0.401 1
1 572 . 18 1 1 A 52 52 ILE C C 52 175.371 175.500 -0.129 1
1 573 . 18 1 1 A 52 52 ILE CA C 52 59.624 59.211 0.413 1
1 574 . 18 1 1 A 52 52 ILE CB C 52 42.895 40.698 2.197 1
1 578 . 18 1 1 A 52 52 ILE N N 52 117.697 119.049 -1.352 1
1 579 . 18 1 1 A 53 53 PHE H H 53 8.748 8.846 -0.098 1
1 580 . 18 1 1 A 53 53 PHE HA H 53 5.132 4.581 0.551 1
1 588 . 18 1 1 A 53 53 PHE C C 53 178.146 176.387 1.759 1
1 589 . 18 1 1 A 53 53 PHE CA C 53 57.667 58.070 -0.403 1
1 590 . 18 1 1 A 53 53 PHE CB C 53 39.614 39.330 0.284 1
1 596 . 18 1 1 A 53 53 PHE N N 53 121.433 122.606 -1.173 1
1 597 . 18 1 1 A 54 54 GLY H H 54 8.538 9.071 -0.533 1
1 598 . 18 1 1 A 54 54 GLY HA2 H 54 4.074 4.112 -0.038 1
1 599 . 18 1 1 A 54 54 GLY HA3 H 54 3.840 4.112 -0.272 1
1 600 . 18 1 1 A 54 54 GLY C C 54 174.530 172.924 1.606 1
1 601 . 18 1 1 A 54 54 GLY CA C 54 44.884 44.519 0.365 1
1 602 . 18 1 1 A 54 54 GLY N N 54 106.444 110.598 -4.154 1
1 603 . 18 1 1 A 55 55 ALA H H 55 8.594 8.169 0.425 1
1 604 . 18 1 1 A 55 55 ALA HA H 55 4.172 4.775 -0.603 1
1 608 . 18 1 1 A 55 55 ALA C C 55 178.718 177.085 1.633 1
1 609 . 18 1 1 A 55 55 ALA CA C 55 54.423 50.698 3.725 1
1 610 . 18 1 1 A 55 55 ALA CB C 55 19.059 21.369 -2.310 1
1 611 . 18 1 1 A 55 55 ALA N N 55 123.470 122.797 0.673 1
1 612 . 18 1 1 A 56 56 GLN H H 56 8.727 8.722 0.005 1
1 613 . 18 1 1 A 56 56 GLN HA H 56 4.367 3.752 0.615 1
1 620 . 18 1 1 A 56 56 GLN C C 56 176.134 174.507 1.627 1
1 621 . 18 1 1 A 56 56 GLN CA C 56 55.660 56.734 -1.074 1
1 622 . 18 1 1 A 56 56 GLN CB C 56 28.152 26.843 1.309 1
1 624 . 18 1 1 A 56 56 GLN N N 56 114.221 115.382 -1.161 1
1 626 . 18 1 1 A 57 57 VAL H H 57 7.204 7.722 -0.518 1
1 627 . 18 1 1 A 57 57 VAL HA H 57 3.889 4.293 -0.404 1
1 635 . 18 1 1 A 57 57 VAL C C 57 175.371 175.376 -0.005 1
1 636 . 18 1 1 A 57 57 VAL CA C 57 63.908 61.387 2.521 1
1 637 . 18 1 1 A 57 57 VAL CB C 57 31.557 32.962 -1.405 1
1 640 . 18 1 1 A 57 57 VAL N N 57 121.341 119.348 1.993 1
1 641 . 18 1 1 A 58 58 ALA H H 58 8.920 8.578 0.342 1
1 642 . 18 1 1 A 58 58 ALA HA H 58 4.547 4.410 0.137 1
1 646 . 18 1 1 A 58 58 ALA C C 58 177.064 177.752 -0.688 1
1 647 . 18 1 1 A 58 58 ALA CA C 58 51.173 50.798 0.375 1
1 648 . 18 1 1 A 58 58 ALA CB C 58 17.842 17.806 0.036 1
1 649 . 18 1 1 A 58 58 ALA N N 58 132.726 130.472 2.254 1
1 650 . 18 1 1 A 59 59 PRO HA H 59 4.101 4.234 -0.133 1
1 657 . 18 1 1 A 59 59 PRO C C 59 179.482 178.674 0.808 1
1 658 . 18 1 1 A 59 59 PRO CA C 59 66.060 65.224 0.836 1
1 659 . 18 1 1 A 59 59 PRO CB C 59 31.951 31.913 0.038 1
1 662 . 18 1 1 A 60 60 ALA H H 60 8.706 8.172 0.534 1
1 663 . 18 1 1 A 60 60 ALA HA H 60 4.057 4.048 0.009 1
1 667 . 18 1 1 A 60 60 ALA C C 60 179.627 179.912 -0.285 1
1 668 . 18 1 1 A 60 60 ALA CA C 60 55.305 55.383 -0.078 1
1 669 . 18 1 1 A 60 60 ALA CB C 60 18.737 18.686 0.051 1
1 670 . 18 1 1 A 60 60 ALA N N 60 117.882 118.830 -0.948 1
1 671 . 18 1 1 A 61 61 THR H H 61 7.312 8.236 -0.924 1
1 672 . 18 1 1 A 61 61 THR HA H 61 4.153 3.869 0.284 1
1 677 . 18 1 1 A 61 61 THR C C 61 175.824 176.479 -0.655 1
1 678 . 18 1 1 A 61 61 THR CA C 61 66.412 67.280 -0.868 1
1 679 . 18 1 1 A 61 61 THR CB C 61 68.787 69.057 -0.270 1
1 681 . 18 1 1 A 61 61 THR N N 61 114.483 113.489 0.994 1
1 682 . 18 1 1 A 62 62 LYS H H 62 7.556 7.899 -0.343 1
1 683 . 18 1 1 A 62 62 LYS HA H 62 3.943 3.991 -0.048 1
1 692 . 18 1 1 A 62 62 LYS C C 62 176.884 178.967 -2.083 1
1 693 . 18 1 1 A 62 62 LYS CA C 62 59.095 59.074 0.021 1
1 694 . 18 1 1 A 62 62 LYS CB C 62 32.204 31.777 0.427 1
1 698 . 18 1 1 A 62 62 LYS N N 62 118.994 119.494 -0.500 1
1 699 . 18 1 1 A 63 63 ARG H H 63 7.474 8.305 -0.831 1
1 700 . 18 1 1 A 63 63 ARG HA H 63 4.034 4.096 -0.062 1
1 707 . 18 1 1 A 63 63 ARG C C 63 177.574 178.711 -1.137 1
1 708 . 18 1 1 A 63 63 ARG CA C 63 58.143 59.019 -0.876 1
1 709 . 18 1 1 A 63 63 ARG CB C 63 30.755 30.668 0.087 1
1 712 . 18 1 1 A 63 63 ARG N N 63 114.251 119.331 -5.080 1
1 713 . 18 1 1 A 64 64 LEU H H 64 6.991 8.156 -1.165 1
1 714 . 18 1 1 A 64 64 LEU HA H 64 3.904 3.826 0.078 1
1 724 . 18 1 1 A 64 64 LEU C C 64 176.632 176.602 0.030 1
1 725 . 18 1 1 A 64 64 LEU CA C 64 56.503 57.784 -1.281 1
1 726 . 18 1 1 A 64 64 LEU CB C 64 42.929 41.748 1.181 1
1 730 . 18 1 1 A 64 64 LEU N N 64 116.109 119.320 -3.211 1
1 731 . 18 1 1 A 65 65 PHE H H 65 7.673 8.034 -0.361 1
1 732 . 18 1 1 A 65 65 PHE HA H 65 5.386 5.135 0.251 1
1 740 . 18 1 1 A 65 65 PHE C C 65 173.067 174.740 -1.673 1
1 741 . 18 1 1 A 65 65 PHE CA C 65 56.521 56.983 -0.462 1
1 742 . 18 1 1 A 65 65 PHE CB C 65 41.270 41.019 0.251 1
1 748 . 18 1 1 A 65 65 PHE N N 65 116.182 115.172 1.010 1
1 749 . 18 1 1 A 66 66 ALA H H 66 8.914 8.902 0.012 1
1 750 . 18 1 1 A 66 66 ALA HA H 66 4.748 5.259 -0.511 1
1 754 . 18 1 1 A 66 66 ALA C C 66 175.223 175.680 -0.457 1
1 755 . 18 1 1 A 66 66 ALA CA C 66 50.050 50.462 -0.412 1
1 756 . 18 1 1 A 66 66 ALA CB C 66 21.161 20.945 0.216 1
1 757 . 18 1 1 A 66 66 ALA N N 66 122.870 125.987 -3.117 1
1 758 . 18 1 1 A 67 67 LEU H H 67 8.498 9.004 -0.506 1
1 759 . 18 1 1 A 67 67 LEU HA H 67 4.713 5.382 -0.669 1
1 769 . 18 1 1 A 67 67 LEU C C 67 175.146 174.437 0.709 1
1 770 . 18 1 1 A 67 67 LEU CA C 67 52.518 53.272 -0.754 1
1 771 . 18 1 1 A 67 67 LEU CB C 67 45.308 45.058 0.250 1
1 775 . 18 1 1 A 67 67 LEU N N 67 122.208 124.230 -2.022 1
1 776 . 18 1 1 A 68 68 ASN H H 68 8.357 8.744 -0.387 1
1 777 . 18 1 1 A 68 68 ASN HA H 68 4.679 5.197 -0.518 1
1 782 . 18 1 1 A 68 68 ASN C C 68 176.228 175.476 0.752 1
1 783 . 18 1 1 A 68 68 ASN CA C 68 53.524 52.564 0.960 1
1 784 . 18 1 1 A 68 68 ASN CB C 68 39.580 39.833 -0.253 1
1 785 . 18 1 1 A 68 68 ASN N N 68 126.940 124.265 2.675 1
1 787 . 18 1 1 A 69 69 ASN H H 69 8.861 9.229 -0.368 1
1 788 . 18 1 1 A 69 69 ASN HA H 69 5.137 4.883 0.254 1
1 793 . 18 1 1 A 69 69 ASN C C 69 175.631 176.429 -0.798 1
1 794 . 18 1 1 A 69 69 ASN CA C 69 56.009 54.394 1.615 1
1 795 . 18 1 1 A 69 69 ASN CB C 69 40.314 38.669 1.645 1
1 796 . 18 1 1 A 69 69 ASN N N 69 124.980 122.796 2.184 1
1 798 . 18 1 1 A 70 70 THR H H 70 8.635 7.840 0.795 1
1 799 . 18 1 1 A 70 70 THR HA H 70 4.815 4.587 0.228 1
1 804 . 18 1 1 A 70 70 THR C C 70 176.223 175.614 0.609 1
1 805 . 18 1 1 A 70 70 THR CA C 70 63.944 62.672 1.272 1
1 806 . 18 1 1 A 70 70 THR CB C 70 69.727 70.272 -0.545 1
1 808 . 18 1 1 A 70 70 THR N N 70 110.394 109.450 0.944 1
1 809 . 18 1 1 A 71 71 THR H H 71 8.069 7.867 0.202 1
1 810 . 18 1 1 A 71 71 THR HA H 71 4.566 4.600 -0.034 1
1 815 . 18 1 1 A 71 71 THR C C 71 176.213 175.407 0.806 1
1 816 . 18 1 1 A 71 71 THR CA C 71 61.683 61.988 -0.305 1
1 817 . 18 1 1 A 71 71 THR CB C 71 70.832 71.117 -0.285 1
1 819 . 18 1 1 A 71 71 THR N N 71 110.507 110.178 0.329 1
1 820 . 18 1 1 A 72 72 GLY H H 72 7.990 8.121 -0.131 1
1 821 . 18 1 1 A 72 72 GLY HA2 H 72 3.186 3.199 -0.013 1
1 822 . 18 1 1 A 72 72 GLY HA3 H 72 2.516 3.688 -1.172 1
1 823 . 18 1 1 A 72 72 GLY C C 72 172.988 174.105 -1.117 1
1 824 . 18 1 1 A 72 72 GLY CA C 72 45.149 46.416 -1.267 1
1 825 . 18 1 1 A 72 72 GLY N N 72 110.788 112.477 -1.689 1
1 826 . 18 1 1 A 73 73 LEU H H 73 7.138 7.642 -0.504 1
1 827 . 18 1 1 A 73 73 LEU HA H 73 4.414 4.695 -0.281 1
1 837 . 18 1 1 A 73 73 LEU C C 73 176.836 174.692 2.144 1
1 838 . 18 1 1 A 73 73 LEU CA C 73 55.252 53.510 1.742 1
1 839 . 18 1 1 A 73 73 LEU CB C 73 43.574 45.561 -1.987 1
1 843 . 18 1 1 A 73 73 LEU N N 73 119.222 120.941 -1.719 1
1 844 . 18 1 1 A 74 74 ILE H H 74 8.925 8.519 0.406 1
1 845 . 18 1 1 A 74 74 ILE HA H 74 5.555 5.364 0.191 1
1 855 . 18 1 1 A 74 74 ILE C C 74 175.978 175.852 0.126 1
1 856 . 18 1 1 A 74 74 ILE CA C 74 60.100 59.980 0.120 1
1 857 . 18 1 1 A 74 74 ILE CB C 74 38.550 40.238 -1.688 1
1 861 . 18 1 1 A 74 74 ILE N N 74 129.871 125.689 4.182 1
1 862 . 18 1 1 A 75 75 THR H H 75 9.161 8.773 0.388 1
1 863 . 18 1 1 A 75 75 THR HA H 75 5.375 5.513 -0.138 1
1 868 . 18 1 1 A 75 75 THR C C 75 174.798 173.693 1.105 1
1 869 . 18 1 1 A 75 75 THR CA C 75 58.796 59.579 -0.783 1
1 870 . 18 1 1 A 75 75 THR CB C 75 72.978 71.779 1.199 1
1 872 . 18 1 1 A 75 75 THR N N 75 117.522 118.431 -0.909 1
1 873 . 18 1 1 A 76 76 VAL H H 76 8.327 8.557 -0.230 1
1 874 . 18 1 1 A 76 76 VAL HA H 76 3.973 3.755 0.218 1
1 882 . 18 1 1 A 76 76 VAL C C 76 176.495 175.758 0.737 1
1 883 . 18 1 1 A 76 76 VAL CA C 76 64.085 63.543 0.542 1
1 884 . 18 1 1 A 76 76 VAL CB C 76 32.863 31.938 0.925 1
1 887 . 18 1 1 A 76 76 VAL N N 76 120.876 122.304 -1.428 1
1 888 . 18 1 1 A 77 77 GLN H H 77 9.525 9.283 0.242 1
1 889 . 18 1 1 A 77 77 GLN HA H 77 4.702 4.426 0.276 1
1 896 . 18 1 1 A 77 77 GLN C C 77 173.838 174.960 -1.122 1
1 897 . 18 1 1 A 77 77 GLN CA C 77 55.728 56.762 -1.034 1
1 898 . 18 1 1 A 77 77 GLN CB C 77 30.762 30.841 -0.079 1
1 900 . 18 1 1 A 77 77 GLN N N 77 129.825 128.016 1.809 1
1 902 . 18 1 1 A 78 78 ARG H H 78 7.621 7.068 0.553 1
1 903 . 18 1 1 A 78 78 ARG HA H 78 4.347 4.688 -0.341 1
1 910 . 18 1 1 A 78 78 ARG C C 78 172.304 175.566 -3.262 1
1 911 . 18 1 1 A 78 78 ARG CA C 78 54.634 54.258 0.376 1
1 912 . 18 1 1 A 78 78 ARG CB C 78 34.685 34.401 0.284 1
1 915 . 18 1 1 A 78 78 ARG N N 78 120.595 117.525 3.070 1
1 916 . 18 1 1 A 79 79 SER H H 79 7.958 8.647 -0.689 1
1 917 . 18 1 1 A 79 79 SER HA H 79 4.030 4.314 -0.284 1
1 920 . 18 1 1 A 79 79 SER C C 79 174.311 174.440 -0.129 1
1 921 . 18 1 1 A 79 79 SER CA C 79 59.889 58.778 1.111 1
1 922 . 18 1 1 A 79 79 SER CB C 79 63.548 63.785 -0.237 1
1 923 . 18 1 1 A 79 79 SER N N 79 112.565 116.915 -4.350 1
1 924 . 18 1 1 A 80 80 LEU H H 80 8.715 8.390 0.325 1
1 925 . 18 1 1 A 80 80 LEU HA H 80 4.114 4.943 -0.829 1
1 935 . 18 1 1 A 80 80 LEU C C 80 176.057 176.008 0.049 1
1 936 . 18 1 1 A 80 80 LEU CA C 80 55.091 53.336 1.755 1
1 937 . 18 1 1 A 80 80 LEU CB C 80 42.341 45.266 -2.925 1
1 941 . 18 1 1 A 80 80 LEU N N 80 123.070 123.419 -0.349 1
1 942 . 18 1 1 A 81 81 ASP H H 81 7.298 8.731 -1.433 1
1 943 . 18 1 1 A 81 81 ASP HA H 81 4.725 5.298 -0.573 1
1 946 . 18 1 1 A 81 81 ASP C C 81 175.939 176.220 -0.281 1
1 947 . 18 1 1 A 81 81 ASP CA C 81 53.664 52.931 0.733 1
1 948 . 18 1 1 A 81 81 ASP CB C 81 42.947 43.263 -0.316 1
1 949 . 18 1 1 A 81 81 ASP N N 81 115.229 121.565 -6.336 1
1 950 . 18 1 1 A 82 82 ARG H H 82 9.289 8.755 0.534 1
1 951 . 18 1 1 A 82 82 ARG HA H 82 4.416 4.327 0.089 1
1 959 . 18 1 1 A 82 82 ARG C C 82 176.406 178.038 -1.632 1
1 960 . 18 1 1 A 82 82 ARG CA C 82 56.397 59.183 -2.786 1
1 961 . 18 1 1 A 82 82 ARG CB C 82 30.638 30.103 0.535 1
1 964 . 18 1 1 A 82 82 ARG N N 82 123.174 126.923 -3.749 1
1 966 . 18 1 1 A 83 83 GLU H H 83 8.468 8.261 0.207 1
1 967 . 18 1 1 A 83 83 GLU HA H 83 3.982 4.021 -0.039 1
1 972 . 18 1 1 A 83 83 GLU C C 83 177.740 179.203 -1.463 1
1 973 . 18 1 1 A 83 83 GLU CA C 83 58.425 59.562 -1.137 1
1 974 . 18 1 1 A 83 83 GLU CB C 83 29.701 29.118 0.583 1
1 976 . 18 1 1 A 83 83 GLU N N 83 119.549 118.168 1.381 1
1 977 . 18 1 1 A 84 84 GLU H H 84 8.033 7.875 0.158 1
1 978 . 18 1 1 A 84 84 GLU HA H 84 4.206 4.282 -0.076 1
1 983 . 18 1 1 A 84 84 GLU C C 84 176.837 176.286 0.551 1
1 984 . 18 1 1 A 84 84 GLU CA C 84 58.056 58.718 -0.662 1
1 985 . 18 1 1 A 84 84 GLU CB C 84 30.432 30.195 0.237 1
1 987 . 18 1 1 A 84 84 GLU N N 84 118.333 119.643 -1.310 1
1 988 . 18 1 1 A 85 85 THR H H 85 7.651 7.390 0.261 1
1 989 . 18 1 1 A 85 85 THR HA H 85 4.307 4.659 -0.352 1
1 994 . 18 1 1 A 85 85 THR C C 85 171.568 173.320 -1.752 1
1 995 . 18 1 1 A 85 85 THR CA C 85 61.387 59.375 2.012 1
1 996 . 18 1 1 A 85 85 THR CB C 85 69.963 70.679 -0.716 1
1 998 . 18 1 1 A 85 85 THR N N 85 112.444 111.278 1.166 1
1 999 . 18 1 1 A 86 86 ALA H H 86 8.639 8.527 0.112 1
1 1000 . 18 1 1 A 86 86 ALA HA H 86 4.603 4.483 0.120 1
1 1004 . 18 1 1 A 86 86 ALA C C 86 175.560 177.245 -1.685 1
1 1005 . 18 1 1 A 86 86 ALA CA C 86 52.156 52.858 -0.702 1
1 1006 . 18 1 1 A 86 86 ALA CB C 86 20.378 20.711 -0.333 1
1 1007 . 18 1 1 A 86 86 ALA N N 86 127.705 127.151 0.554 1
1 1008 . 18 1 1 A 87 87 ILE H H 87 7.663 7.632 0.031 1
1 1009 . 18 1 1 A 87 87 ILE HA H 87 4.828 5.082 -0.254 1
1 1019 . 18 1 1 A 87 87 ILE C C 87 174.537 174.259 0.278 1
1 1020 . 18 1 1 A 87 87 ILE CA C 87 60.329 59.787 0.542 1
1 1021 . 18 1 1 A 87 87 ILE CB C 87 41.090 42.034 -0.944 1
1 1025 . 18 1 1 A 87 87 ILE N N 87 118.712 116.976 1.736 1
1 1026 . 18 1 1 A 88 88 HIS H H 88 9.098 8.871 0.227 1
1 1027 . 18 1 1 A 88 88 HIS HA H 88 4.576 5.188 -0.612 1
1 1032 . 18 1 1 A 88 88 HIS C C 88 174.354 174.171 0.183 1
1 1033 . 18 1 1 A 88 88 HIS CA C 88 54.740 54.357 0.383 1
1 1034 . 18 1 1 A 88 88 HIS CB C 88 33.955 31.935 2.020 1
1 1037 . 18 1 1 A 88 88 HIS N N 88 126.285 125.277 1.008 1
1 1038 . 18 1 1 A 89 89 LYS H H 89 8.957 8.952 0.005 1
1 1039 . 18 1 1 A 89 89 LYS HA H 89 4.873 4.978 -0.105 1
1 1048 . 18 1 1 A 89 89 LYS C C 89 175.906 175.351 0.555 1
1 1049 . 18 1 1 A 89 89 LYS CA C 89 55.269 55.470 -0.201 1
1 1050 . 18 1 1 A 89 89 LYS CB C 89 32.945 33.065 -0.120 1
1 1054 . 18 1 1 A 89 89 LYS N N 89 124.332 124.487 -0.155 1
1 1055 . 18 1 1 A 90 90 VAL H H 90 9.174 8.779 0.395 1
1 1056 . 18 1 1 A 90 90 VAL HA H 90 4.227 4.918 -0.691 1
1 1064 . 18 1 1 A 90 90 VAL C C 90 174.168 174.968 -0.800 1
1 1065 . 18 1 1 A 90 90 VAL CA C 90 61.369 61.127 0.242 1
1 1066 . 18 1 1 A 90 90 VAL CB C 90 34.082 34.595 -0.513 1
1 1069 . 18 1 1 A 90 90 VAL N N 90 124.319 125.335 -1.016 1
1 1070 . 18 1 1 A 91 91 THR H H 91 6.697 8.973 -2.276 1
1 1071 . 18 1 1 A 91 91 THR HA H 91 5.163 5.253 -0.090 1
1 1076 . 18 1 1 A 91 91 THR C C 91 173.812 173.697 0.115 1
1 1077 . 18 1 1 A 91 91 THR CA C 91 61.935 61.785 0.150 1
1 1078 . 18 1 1 A 91 91 THR CB C 91 70.412 70.464 -0.052 1
1 1080 . 18 1 1 A 91 91 THR N N 91 122.637 122.957 -0.320 1
1 1081 . 18 1 1 A 92 92 VAL H H 92 9.292 8.570 0.722 1
1 1082 . 18 1 1 A 92 92 VAL HA H 92 4.736 4.581 0.155 1
1 1090 . 18 1 1 A 92 92 VAL C C 92 173.160 174.633 -1.473 1
1 1091 . 18 1 1 A 92 92 VAL CA C 92 60.982 60.993 -0.011 1
1 1092 . 18 1 1 A 92 92 VAL CB C 92 35.130 33.934 1.196 1
1 1095 . 18 1 1 A 92 92 VAL N N 92 128.265 128.015 0.250 1
1 1096 . 18 1 1 A 93 93 LEU H H 93 9.495 8.834 0.661 1
1 1097 . 18 1 1 A 93 93 LEU HA H 93 5.628 5.728 -0.100 1
1 1107 . 18 1 1 A 93 93 LEU C C 93 176.274 176.020 0.254 1
1 1108 . 18 1 1 A 93 93 LEU CA C 93 52.773 53.682 -0.909 1
1 1109 . 18 1 1 A 93 93 LEU CB C 93 43.454 44.178 -0.724 1
1 1113 . 18 1 1 A 93 93 LEU N N 93 126.350 127.019 -0.669 1
1 1114 . 18 1 1 A 94 94 ALA H H 94 8.688 9.287 -0.599 1
1 1115 . 18 1 1 A 94 94 ALA HA H 94 4.986 5.353 -0.367 1
1 1119 . 18 1 1 A 94 94 ALA C C 94 175.787 175.592 0.195 1
1 1120 . 18 1 1 A 94 94 ALA CA C 94 49.610 50.121 -0.511 1
1 1121 . 18 1 1 A 94 94 ALA CB C 94 21.463 21.970 -0.507 1
1 1122 . 18 1 1 A 94 94 ALA N N 94 123.429 126.336 -2.907 1
1 1123 . 18 1 1 A 95 95 SER H H 95 8.401 8.592 -0.191 1
1 1124 . 18 1 1 A 95 95 SER HA H 95 4.828 5.094 -0.266 1
1 1127 . 18 1 1 A 95 95 SER C C 95 174.327 172.340 1.987 1
1 1128 . 18 1 1 A 95 95 SER CA C 95 56.239 56.517 -0.278 1
1 1129 . 18 1 1 A 95 95 SER CB C 95 65.561 65.569 -0.008 1
1 1130 . 18 1 1 A 95 95 SER N N 95 114.418 116.012 -1.594 1
1 1131 . 18 1 1 A 96 96 ASP H H 96 8.690 8.560 0.130 1
1 1132 . 18 1 1 A 96 96 ASP HA H 96 4.908 4.894 0.014 1
1 1135 . 18 1 1 A 96 96 ASP C C 96 177.096 176.340 0.756 1
1 1136 . 18 1 1 A 96 96 ASP CA C 96 52.818 53.718 -0.900 1
1 1137 . 18 1 1 A 96 96 ASP CB C 96 41.253 42.904 -1.651 1
1 1138 . 18 1 1 A 96 96 ASP N N 96 125.624 124.629 0.995 1
1 1139 . 18 1 1 A 97 97 GLY H H 97 8.524 7.459 1.065 1
1 1140 . 18 1 1 A 97 97 GLY HA2 H 97 4.320 4.028 0.292 1
1 1141 . 18 1 1 A 97 97 GLY HA3 H 97 3.620 4.029 -0.409 1
1 1142 . 18 1 1 A 97 97 GLY C C 97 174.620 174.320 0.300 1
1 1143 . 18 1 1 A 97 97 GLY CA C 97 45.422 45.143 0.279 1
1 1144 . 18 1 1 A 97 97 GLY N N 97 109.283 107.304 1.979 1
1 1145 . 18 1 1 A 98 98 SER H H 98 8.575 7.732 0.843 1
1 1146 . 18 1 1 A 98 98 SER HA H 98 4.607 4.837 -0.230 1
1 1149 . 18 1 1 A 98 98 SER C C 98 174.478 174.219 0.259 1
1 1150 . 18 1 1 A 98 98 SER CA C 98 59.095 55.682 3.413 1
1 1151 . 18 1 1 A 98 98 SER CB C 98 64.800 65.518 -0.718 1
1 1152 . 18 1 1 A 98 98 SER N N 98 116.640 115.652 0.988 1
1 1153 . 18 1 1 A 99 99 SER H H 99 8.945 8.699 0.246 1
1 1154 . 18 1 1 A 99 99 SER HA H 99 4.530 4.363 0.167 1
1 1157 . 18 1 1 A 99 99 SER C C 99 174.491 174.110 0.381 1
1 1158 . 18 1 1 A 99 99 SER CA C 99 58.460 61.755 -3.295 1
1 1159 . 18 1 1 A 99 99 SER CB C 99 64.146 63.294 0.852 1
1 1160 . 18 1 1 A 99 99 SER N N 99 117.676 118.080 -0.404 1
1 1161 . 18 1 1 A 100 100 THR H H 100 8.411 8.178 0.233 1
1 1162 . 18 1 1 A 100 100 THR HA H 100 4.490 4.518 -0.028 1
1 1167 . 18 1 1 A 100 100 THR C C 100 172.766 172.853 -0.087 1
1 1168 . 18 1 1 A 100 100 THR CA C 100 60.629 59.567 1.062 1
1 1169 . 18 1 1 A 100 100 THR CB C 100 69.778 69.527 0.251 1
1 1171 . 18 1 1 A 100 100 THR N N 100 118.401 113.259 5.142 1
1 1172 . 18 1 1 A 101 101 PRO HA H 101 4.631 4.554 0.077 1
1 1179 . 18 1 1 A 101 101 PRO C C 101 177.227 175.631 1.596 1
1 1180 . 18 1 1 A 101 101 PRO CA C 101 63.097 62.269 0.828 1
1 1181 . 18 1 1 A 101 101 PRO CB C 101 32.917 32.489 0.428 1
1 1184 . 18 1 1 A 102 102 ALA H H 102 8.497 8.389 0.108 1
1 1185 . 18 1 1 A 102 102 ALA HA H 102 4.619 4.909 -0.290 1
1 1189 . 18 1 1 A 102 102 ALA C C 102 176.542 177.388 -0.846 1
1 1190 . 18 1 1 A 102 102 ALA CA C 102 51.390 51.100 0.290 1
1 1191 . 18 1 1 A 102 102 ALA CB C 102 20.815 20.590 0.225 1
1 1192 . 18 1 1 A 102 102 ALA N N 102 124.487 123.020 1.467 1
1 1193 . 18 1 1 A 103 103 ARG H H 103 8.663 9.023 -0.360 1
1 1194 . 18 1 1 A 103 103 ARG HA H 103 5.515 5.367 0.148 1
1 1201 . 18 1 1 A 103 103 ARG C C 103 174.539 175.600 -1.061 1
1 1202 . 18 1 1 A 103 103 ARG CA C 103 55.164 54.878 0.286 1
1 1203 . 18 1 1 A 103 103 ARG CB C 103 34.393 33.147 1.246 1
1 1206 . 18 1 1 A 103 103 ARG N N 103 119.596 121.104 -1.508 1
1 1207 . 18 1 1 A 104 104 ALA H H 104 9.027 8.118 0.909 1
1 1208 . 18 1 1 A 104 104 ALA HA H 104 4.782 5.053 -0.271 1
1 1212 . 18 1 1 A 104 104 ALA C C 104 176.276 175.499 0.777 1
1 1213 . 18 1 1 A 104 104 ALA CA C 104 50.297 51.324 -1.027 1
1 1214 . 18 1 1 A 104 104 ALA CB C 104 20.810 21.586 -0.776 1
1 1215 . 18 1 1 A 104 104 ALA N N 104 126.962 121.834 5.128 1
1 1216 . 18 1 1 A 105 105 THR H H 105 8.384 8.745 -0.361 1
1 1217 . 18 1 1 A 105 105 THR HA H 105 4.954 4.565 0.389 1
1 1222 . 18 1 1 A 105 105 THR C C 105 173.243 173.996 -0.753 1
1 1223 . 18 1 1 A 105 105 THR CA C 105 61.475 62.698 -1.223 1
1 1224 . 18 1 1 A 105 105 THR CB C 105 70.569 69.156 1.413 1
1 1226 . 18 1 1 A 105 105 THR N N 105 115.327 118.821 -3.494 1
1 1227 . 18 1 1 A 106 106 VAL H H 106 8.970 9.242 -0.272 1
1 1228 . 18 1 1 A 106 106 VAL HA H 106 4.702 4.476 0.226 1
1 1236 . 18 1 1 A 106 106 VAL C C 106 174.743 174.983 -0.240 1
1 1237 . 18 1 1 A 106 106 VAL CA C 106 59.712 61.141 -1.429 1
1 1238 . 18 1 1 A 106 106 VAL CB C 106 34.327 33.834 0.493 1
1 1241 . 18 1 1 A 106 106 VAL N N 106 126.226 128.678 -2.452 1
1 1242 . 18 1 1 A 107 107 THR H H 107 8.833 9.010 -0.177 1
1 1243 . 18 1 1 A 107 107 THR HA H 107 4.862 5.007 -0.145 1
1 1248 . 18 1 1 A 107 107 THR C C 107 172.970 173.708 -0.738 1
1 1249 . 18 1 1 A 107 107 THR CA C 107 62.322 61.721 0.601 1
1 1250 . 18 1 1 A 107 107 THR CB C 107 69.463 70.237 -0.774 1
1 1252 . 18 1 1 A 107 107 THR N N 107 125.403 122.785 2.618 1
1 1253 . 18 1 1 A 108 108 ILE H H 108 9.234 9.068 0.166 1
1 1254 . 18 1 1 A 108 108 ILE HA H 108 4.178 4.641 -0.463 1
1 1264 . 18 1 1 A 108 108 ILE C C 108 174.087 174.628 -0.541 1
1 1265 . 18 1 1 A 108 108 ILE CA C 108 60.365 60.442 -0.077 1
1 1266 . 18 1 1 A 108 108 ILE CB C 108 39.745 39.933 -0.188 1
1 1270 . 18 1 1 A 108 108 ILE N N 108 127.152 128.007 -0.855 1
1 1271 . 18 1 1 A 109 109 ASN H H 109 8.723 8.958 -0.235 1
1 1272 . 18 1 1 A 109 109 ASN HA H 109 5.147 5.239 -0.092 1
1 1277 . 18 1 1 A 109 109 ASN C C 109 173.592 174.532 -0.940 1
1 1278 . 18 1 1 A 109 109 ASN CA C 109 52.501 52.859 -0.358 1
1 1279 . 18 1 1 A 109 109 ASN CB C 109 40.791 40.192 0.599 1
1 1280 . 18 1 1 A 109 109 ASN N N 109 126.866 126.807 0.059 1
1 1282 . 18 1 1 A 110 110 VAL H H 110 9.046 8.767 0.279 1
1 1283 . 18 1 1 A 110 110 VAL HA H 110 5.081 4.665 0.416 1
1 1291 . 18 1 1 A 110 110 VAL C C 110 176.921 176.240 0.681 1
1 1292 . 18 1 1 A 110 110 VAL CA C 110 61.634 61.757 -0.123 1
1 1293 . 18 1 1 A 110 110 VAL CB C 110 31.809 31.835 -0.026 1
1 1296 . 18 1 1 A 110 110 VAL N N 110 126.070 124.221 1.849 1
1 1297 . 18 1 1 A 111 111 THR H H 111 9.197 8.541 0.656 1
1 1298 . 18 1 1 A 111 111 THR HA H 111 4.566 4.700 -0.134 1
1 1303 . 18 1 1 A 111 111 THR C C 111 174.087 174.405 -0.318 1
1 1304 . 18 1 1 A 111 111 THR CA C 111 61.145 60.660 0.485 1
1 1305 . 18 1 1 A 111 111 THR CB C 111 70.706 70.838 -0.132 1
1 1307 . 18 1 1 A 111 111 THR N N 111 121.425 119.219 2.206 1
1 1308 . 18 1 1 A 112 112 ASP H H 112 8.435 8.590 -0.155 1
1 1309 . 18 1 1 A 112 112 ASP HA H 112 4.656 4.842 -0.186 1
1 1312 . 18 1 1 A 112 112 ASP C C 112 176.745 175.698 1.047 1
1 1313 . 18 1 1 A 112 112 ASP CA C 112 54.158 54.419 -0.261 1
1 1314 . 18 1 1 A 112 112 ASP CB C 112 41.575 41.875 -0.300 1
1 1315 . 18 1 1 A 112 112 ASP N N 112 119.566 121.461 -1.895 1
1 1316 . 18 1 1 A 113 113 VAL H H 113 8.629 8.528 0.101 1
1 1317 . 18 1 1 A 113 113 VAL HA H 113 4.078 4.769 -0.691 1
1 1325 . 18 1 1 A 113 113 VAL C C 113 175.247 175.097 0.150 1
1 1326 . 18 1 1 A 113 113 VAL CA C 113 62.533 59.799 2.734 1
1 1327 . 18 1 1 A 113 113 VAL CB C 113 32.534 35.087 -2.553 1
1 1330 . 18 1 1 A 113 113 VAL N N 113 119.356 116.451 2.905 1
1 4 . 19 1 1 A 2 2 SER H H 2 8.289 8.593 -0.304 1
1 5 . 19 1 1 A 2 2 SER HA H 2 4.530 5.095 -0.565 1
1 7 . 19 1 1 A 2 2 SER C C 2 174.868 172.156 2.712 1
1 8 . 19 1 1 A 2 2 SER CA C 2 58.284 57.579 0.705 1
1 9 . 19 1 1 A 2 2 SER CB C 2 63.769 65.161 -1.392 1
1 10 . 19 1 1 A 2 2 SER N N 2 115.842 114.716 1.126 1
1 11 . 19 1 1 A 3 3 SER H H 3 8.490 8.799 -0.309 1
1 12 . 19 1 1 A 3 3 SER HA H 3 4.496 5.014 -0.518 1
1 14 . 19 1 1 A 3 3 SER C C 3 175.043 172.768 2.275 1
1 15 . 19 1 1 A 3 3 SER CA C 3 58.549 57.586 0.963 1
1 16 . 19 1 1 A 3 3 SER CB C 3 63.687 66.004 -2.317 1
1 17 . 19 1 1 A 3 3 SER N N 3 117.930 119.678 -1.748 1
1 18 . 19 1 1 A 4 4 GLY H H 4 8.482 8.616 -0.134 1
1 19 . 19 1 1 A 4 4 GLY C C 4 174.344 172.443 1.901 1
1 20 . 19 1 1 A 4 4 GLY CA C 4 45.536 44.926 0.610 1
1 21 . 19 1 1 A 4 4 GLY N N 4 110.985 113.264 -2.279 1
1 22 . 19 1 1 A 6 6 SER HA H 6 4.508 5.402 -0.894 1
1 24 . 19 1 1 A 6 6 SER C C 6 175.026 173.397 1.629 1
1 25 . 19 1 1 A 6 6 SER CA C 6 58.584 56.020 2.564 1
1 26 . 19 1 1 A 6 6 SER CB C 6 63.646 66.397 -2.751 1
1 27 . 19 1 1 A 7 7 GLY H H 7 8.419 8.486 -0.067 1
1 28 . 19 1 1 A 7 7 GLY HA2 H 7 3.993 4.370 -0.377 1
1 29 . 19 1 1 A 7 7 GLY C C 7 173.995 171.996 1.999 1
1 30 . 19 1 1 A 7 7 GLY CA C 7 45.466 45.497 -0.031 1
1 31 . 19 1 1 A 7 7 GLY N N 7 110.615 110.359 0.256 1
1 32 . 19 1 1 A 8 8 ASN H H 8 8.322 8.603 -0.281 1
1 33 . 19 1 1 A 8 8 ASN HA H 8 4.736 5.242 -0.506 1
1 38 . 19 1 1 A 8 8 ASN C C 8 174.907 174.578 0.329 1
1 39 . 19 1 1 A 8 8 ASN CA C 8 53.259 51.462 1.797 1
1 40 . 19 1 1 A 8 8 ASN CB C 8 39.127 43.032 -3.905 1
1 41 . 19 1 1 A 8 8 ASN N N 8 118.602 120.429 -1.827 1
1 43 . 19 1 1 A 9 9 ASP H H 9 8.370 8.529 -0.159 1
1 44 . 19 1 1 A 9 9 ASP HA H 9 4.594 4.511 0.083 1
1 47 . 19 1 1 A 9 9 ASP C C 9 175.765 176.506 -0.741 1
1 48 . 19 1 1 A 9 9 ASP CA C 9 54.440 55.194 -0.754 1
1 49 . 19 1 1 A 9 9 ASP CB C 9 40.898 40.643 0.255 1
1 50 . 19 1 1 A 9 9 ASP N N 9 120.504 120.762 -0.258 1
1 51 . 19 1 1 A 10 10 ASN H H 10 8.382 8.857 -0.475 1
1 52 . 19 1 1 A 10 10 ASN HA H 10 4.691 5.130 -0.439 1
1 57 . 19 1 1 A 10 10 ASN C C 10 174.383 174.342 0.041 1
1 58 . 19 1 1 A 10 10 ASN CA C 10 53.241 52.278 0.963 1
1 59 . 19 1 1 A 10 10 ASN CB C 10 38.674 42.472 -3.798 1
1 60 . 19 1 1 A 10 10 ASN N N 10 119.406 122.276 -2.870 1
1 62 . 19 1 1 A 11 11 ARG H H 11 7.942 8.459 -0.517 1
1 63 . 19 1 1 A 11 11 ARG HA H 11 4.684 4.695 -0.011 1
1 70 . 19 1 1 A 11 11 ARG C C 11 173.640 174.038 -0.398 1
1 71 . 19 1 1 A 11 11 ARG CA C 11 54.246 53.904 0.342 1
1 72 . 19 1 1 A 11 11 ARG CB C 11 30.337 29.516 0.821 1
1 75 . 19 1 1 A 11 11 ARG N N 11 121.145 122.077 -0.932 1
1 76 . 19 1 1 A 12 12 PRO HA H 12 4.507 4.618 -0.111 1
1 83 . 19 1 1 A 12 12 PRO CA C 12 62.714 62.506 0.208 1
1 84 . 19 1 1 A 12 12 PRO CB C 12 31.942 30.445 1.497 1
1 87 . 19 1 1 A 13 13 VAL H H 13 8.252 7.814 0.438 1
1 88 . 19 1 1 A 13 13 VAL HA H 13 4.159 4.695 -0.536 1
1 96 . 19 1 1 A 13 13 VAL CA C 13 61.409 59.488 1.921 1
1 97 . 19 1 1 A 13 13 VAL CB C 13 34.858 34.340 0.518 1
1 100 . 19 1 1 A 13 13 VAL N N 13 118.395 117.307 1.088 1
1 101 . 19 1 1 A 14 14 PHE H H 14 8.725 8.828 -0.103 1
1 102 . 19 1 1 A 14 14 PHE HA H 14 4.781 4.875 -0.094 1
1 110 . 19 1 1 A 14 14 PHE CA C 14 58.594 57.119 1.475 1
1 111 . 19 1 1 A 14 14 PHE CB C 14 39.594 41.041 -1.447 1
1 117 . 19 1 1 A 14 14 PHE N N 14 122.950 120.773 2.177 1
1 118 . 19 1 1 A 15 15 LYS H H 15 8.885 9.131 -0.246 1
1 119 . 19 1 1 A 15 15 LYS HA H 15 4.130 4.062 0.068 1
1 128 . 19 1 1 A 15 15 LYS C C 15 177.027 177.427 -0.400 1
1 129 . 19 1 1 A 15 15 LYS CA C 15 58.478 59.627 -1.149 1
1 130 . 19 1 1 A 15 15 LYS CB C 15 32.748 32.381 0.367 1
1 134 . 19 1 1 A 15 15 LYS N N 15 123.863 123.346 0.517 1
1 135 . 19 1 1 A 16 16 GLU H H 16 8.091 7.870 0.221 1
1 136 . 19 1 1 A 16 16 GLU HA H 16 4.438 4.590 -0.152 1
1 141 . 19 1 1 A 16 16 GLU C C 16 175.947 178.124 -2.177 1
1 142 . 19 1 1 A 16 16 GLU CA C 16 56.045 55.396 0.649 1
1 143 . 19 1 1 A 16 16 GLU CB C 16 30.766 31.829 -1.063 1
1 145 . 19 1 1 A 16 16 GLU N N 16 117.026 115.486 1.540 1
1 146 . 19 1 1 A 17 17 GLY H H 17 8.421 8.394 0.027 1
1 147 . 19 1 1 A 17 17 GLY HA2 H 17 3.993 3.854 0.139 1
1 148 . 19 1 1 A 17 17 GLY HA3 H 17 3.913 3.979 -0.066 1
1 149 . 19 1 1 A 17 17 GLY C C 17 173.564 173.736 -0.172 1
1 150 . 19 1 1 A 17 17 GLY CA C 17 45.448 45.833 -0.385 1
1 151 . 19 1 1 A 17 17 GLY N N 17 109.577 109.868 -0.291 1
1 152 . 19 1 1 A 18 18 GLN H H 18 7.858 8.146 -0.288 1
1 153 . 19 1 1 A 18 18 GLN HA H 18 5.065 4.702 0.363 1
1 160 . 19 1 1 A 18 18 GLN C C 18 174.596 175.294 -0.698 1
1 161 . 19 1 1 A 18 18 GLN CA C 18 55.110 54.957 0.153 1
1 162 . 19 1 1 A 18 18 GLN CB C 18 30.329 30.544 -0.215 1
1 164 . 19 1 1 A 18 18 GLN N N 18 120.202 120.321 -0.119 1
1 166 . 19 1 1 A 19 19 VAL H H 19 8.216 8.152 0.064 1
1 167 . 19 1 1 A 19 19 VAL HA H 19 4.450 4.673 -0.223 1
1 175 . 19 1 1 A 19 19 VAL C C 19 173.648 173.813 -0.165 1
1 176 . 19 1 1 A 19 19 VAL CA C 19 60.788 60.795 -0.007 1
1 177 . 19 1 1 A 19 19 VAL CB C 19 35.336 35.799 -0.463 1
1 180 . 19 1 1 A 19 19 VAL N N 19 121.257 122.783 -1.526 1
1 181 . 19 1 1 A 20 20 GLU H H 20 8.610 9.087 -0.477 1
1 182 . 19 1 1 A 20 20 GLU HA H 20 5.211 4.957 0.254 1
1 187 . 19 1 1 A 20 20 GLU C C 20 174.783 175.537 -0.754 1
1 188 . 19 1 1 A 20 20 GLU CA C 20 54.793 54.833 -0.040 1
1 189 . 19 1 1 A 20 20 GLU CB C 20 32.058 31.837 0.221 1
1 191 . 19 1 1 A 20 20 GLU N N 20 127.095 127.762 -0.667 1
1 192 . 19 1 1 A 21 21 VAL H H 21 8.727 8.835 -0.108 1
1 193 . 19 1 1 A 21 21 VAL HA H 21 4.633 5.175 -0.542 1
1 201 . 19 1 1 A 21 21 VAL C C 21 173.894 174.915 -1.021 1
1 202 . 19 1 1 A 21 21 VAL CA C 21 59.695 60.013 -0.318 1
1 203 . 19 1 1 A 21 21 VAL CB C 21 35.865 34.526 1.339 1
1 206 . 19 1 1 A 21 21 VAL N N 21 120.489 121.955 -1.466 1
1 207 . 19 1 1 A 22 22 HIS H H 22 8.680 8.897 -0.217 1
1 208 . 19 1 1 A 22 22 HIS HA H 22 5.552 5.610 -0.058 1
1 212 . 19 1 1 A 22 22 HIS C C 22 174.298 173.323 0.975 1
1 213 . 19 1 1 A 22 22 HIS CA C 22 55.331 53.716 1.615 1
1 214 . 19 1 1 A 22 22 HIS CB C 22 32.369 31.819 0.550 1
1 216 . 19 1 1 A 22 22 HIS N N 22 124.991 117.734 7.257 1
1 217 . 19 1 1 A 23 23 ILE H H 23 9.179 8.800 0.379 1
1 218 . 19 1 1 A 23 23 ILE HA H 23 5.046 4.634 0.412 1
1 228 . 19 1 1 A 23 23 ILE C C 23 171.552 174.293 -2.741 1
1 229 . 19 1 1 A 23 23 ILE CA C 23 55.551 57.154 -1.603 1
1 230 . 19 1 1 A 23 23 ILE CB C 23 42.053 41.896 0.157 1
1 234 . 19 1 1 A 23 23 ILE N N 23 123.121 125.566 -2.445 1
1 235 . 19 1 1 A 24 24 PRO HA H 24 4.816 4.675 0.141 1
1 242 . 19 1 1 A 24 24 PRO C C 24 178.887 176.682 2.205 1
1 243 . 19 1 1 A 24 24 PRO CA C 24 62.216 62.474 -0.258 1
1 244 . 19 1 1 A 24 24 PRO CB C 24 32.895 33.449 -0.554 1
1 247 . 19 1 1 A 25 25 GLU H H 25 8.399 8.658 -0.259 1
1 248 . 19 1 1 A 25 25 GLU HA H 25 3.785 4.088 -0.303 1
1 253 . 19 1 1 A 25 25 GLU C C 25 175.244 178.682 -3.438 1
1 254 . 19 1 1 A 25 25 GLU CA C 25 58.425 58.551 -0.126 1
1 255 . 19 1 1 A 25 25 GLU CB C 25 30.011 29.727 0.284 1
1 257 . 19 1 1 A 25 25 GLU N N 25 117.706 121.223 -3.517 1
1 258 . 19 1 1 A 26 26 ASN H H 26 7.488 7.812 -0.324 1
1 259 . 19 1 1 A 26 26 ASN HA H 26 4.702 4.711 -0.009 1
1 264 . 19 1 1 A 26 26 ASN C C 26 175.425 176.143 -0.718 1
1 265 . 19 1 1 A 26 26 ASN CA C 26 51.584 54.312 -2.728 1
1 266 . 19 1 1 A 26 26 ASN CB C 26 37.243 38.880 -1.637 1
1 267 . 19 1 1 A 26 26 ASN N N 26 112.383 118.366 -5.983 1
1 269 . 19 1 1 A 27 27 ALA H H 27 7.716 7.504 0.212 1
1 270 . 19 1 1 A 27 27 ALA HA H 27 4.409 4.265 0.144 1
1 274 . 19 1 1 A 27 27 ALA C C 27 175.850 175.845 0.005 1
1 275 . 19 1 1 A 27 27 ALA CA C 27 51.037 51.088 -0.051 1
1 276 . 19 1 1 A 27 27 ALA CB C 27 18.152 18.902 -0.750 1
1 277 . 19 1 1 A 27 27 ALA N N 27 125.139 122.894 2.245 1
1 278 . 19 1 1 A 28 28 PRO HA H 28 4.422 4.510 -0.088 1
1 285 . 19 1 1 A 28 28 PRO C C 28 178.442 176.674 1.768 1
1 286 . 19 1 1 A 28 28 PRO CA C 28 62.067 62.633 -0.566 1
1 287 . 19 1 1 A 28 28 PRO CB C 28 32.642 32.206 0.436 1
1 290 . 19 1 1 A 29 29 VAL H H 29 8.691 8.279 0.412 1
1 291 . 19 1 1 A 29 29 VAL HA H 29 3.239 3.631 -0.392 1
1 299 . 19 1 1 A 29 29 VAL C C 29 176.887 177.006 -0.119 1
1 300 . 19 1 1 A 29 29 VAL CA C 29 65.812 64.188 1.624 1
1 301 . 19 1 1 A 29 29 VAL CB C 29 31.174 31.224 -0.050 1
1 304 . 19 1 1 A 29 29 VAL N N 29 123.592 122.778 0.814 1
1 305 . 19 1 1 A 30 30 GLY H H 30 9.197 8.600 0.597 1
1 306 . 19 1 1 A 30 30 GLY HA2 H 30 4.486 3.964 0.522 1
1 307 . 19 1 1 A 30 30 GLY HA3 H 30 3.581 3.966 -0.385 1
1 308 . 19 1 1 A 30 30 GLY C C 30 174.347 174.576 -0.229 1
1 309 . 19 1 1 A 30 30 GLY CA C 30 44.320 44.940 -0.620 1
1 310 . 19 1 1 A 30 30 GLY N N 30 116.042 115.265 0.777 1
1 311 . 19 1 1 A 31 31 THR H H 31 7.838 7.215 0.623 1
1 312 . 19 1 1 A 31 31 THR HA H 31 3.959 4.194 -0.235 1
1 317 . 19 1 1 A 31 31 THR C C 31 174.274 174.023 0.251 1
1 318 . 19 1 1 A 31 31 THR CA C 31 65.160 62.881 2.279 1
1 319 . 19 1 1 A 31 31 THR CB C 31 69.972 69.520 0.452 1
1 321 . 19 1 1 A 31 31 THR N N 31 117.679 117.315 0.364 1
1 322 . 19 1 1 A 32 32 SER H H 32 9.022 8.689 0.333 1
1 323 . 19 1 1 A 32 32 SER HA H 32 4.273 4.778 -0.505 1
1 326 . 19 1 1 A 32 32 SER C C 32 172.692 174.245 -1.553 1
1 327 . 19 1 1 A 32 32 SER CA C 32 59.642 57.398 2.244 1
1 328 . 19 1 1 A 32 32 SER CB C 32 63.102 63.217 -0.115 1
1 329 . 19 1 1 A 32 32 SER N N 32 123.045 119.408 3.637 1
1 330 . 19 1 1 A 33 33 VAL H H 33 9.202 8.866 0.336 1
1 331 . 19 1 1 A 33 33 VAL HA H 33 3.844 4.041 -0.197 1
1 339 . 19 1 1 A 33 33 VAL C C 33 174.782 175.729 -0.947 1
1 340 . 19 1 1 A 33 33 VAL CA C 33 64.242 64.066 0.176 1
1 341 . 19 1 1 A 33 33 VAL CB C 33 32.893 32.446 0.447 1
1 344 . 19 1 1 A 33 33 VAL N N 33 126.861 124.872 1.989 1
1 345 . 19 1 1 A 34 34 ILE H H 34 7.074 7.897 -0.823 1
1 346 . 19 1 1 A 34 34 ILE HA H 34 4.295 4.655 -0.360 1
1 356 . 19 1 1 A 34 34 ILE C C 34 170.577 173.285 -2.708 1
1 357 . 19 1 1 A 34 34 ILE CA C 34 59.500 59.240 0.260 1
1 358 . 19 1 1 A 34 34 ILE CB C 34 39.251 42.178 -2.927 1
1 362 . 19 1 1 A 34 34 ILE N N 34 111.445 118.722 -7.277 1
1 363 . 19 1 1 A 35 35 GLN H H 35 8.450 8.759 -0.309 1
1 364 . 19 1 1 A 35 35 GLN HA H 35 4.633 4.972 -0.339 1
1 371 . 19 1 1 A 35 35 GLN C C 35 174.354 174.336 0.018 1
1 372 . 19 1 1 A 35 35 GLN CA C 35 54.176 54.364 -0.188 1
1 373 . 19 1 1 A 35 35 GLN CB C 35 29.456 31.634 -2.178 1
1 375 . 19 1 1 A 35 35 GLN N N 35 127.342 126.965 0.377 1
1 377 . 19 1 1 A 36 36 LEU H H 36 7.761 8.856 -1.095 1
1 378 . 19 1 1 A 36 36 LEU HA H 36 4.492 5.127 -0.635 1
1 388 . 19 1 1 A 36 36 LEU C C 36 175.543 175.809 -0.266 1
1 389 . 19 1 1 A 36 36 LEU CA C 36 53.982 54.046 -0.064 1
1 390 . 19 1 1 A 36 36 LEU CB C 36 42.776 43.916 -1.140 1
1 394 . 19 1 1 A 36 36 LEU N N 36 128.895 128.525 0.370 1
1 395 . 19 1 1 A 37 37 HIS H H 37 8.529 8.949 -0.420 1
1 396 . 19 1 1 A 37 37 HIS HA H 37 4.851 5.433 -0.582 1
1 400 . 19 1 1 A 37 37 HIS C C 37 172.985 173.397 -0.412 1
1 401 . 19 1 1 A 37 37 HIS CA C 37 55.833 54.306 1.527 1
1 402 . 19 1 1 A 37 37 HIS CB C 37 32.204 32.951 -0.747 1
1 404 . 19 1 1 A 37 37 HIS N N 37 115.903 124.783 -8.880 1
1 405 . 19 1 1 A 38 38 ALA H H 38 8.474 8.917 -0.443 1
1 406 . 19 1 1 A 38 38 ALA HA H 38 4.691 4.613 0.078 1
1 410 . 19 1 1 A 38 38 ALA C C 38 175.548 176.214 -0.666 1
1 411 . 19 1 1 A 38 38 ALA CA C 38 50.491 50.546 -0.055 1
1 412 . 19 1 1 A 38 38 ALA CB C 38 19.842 19.956 -0.114 1
1 413 . 19 1 1 A 38 38 ALA N N 38 128.891 129.830 -0.939 1
1 414 . 19 1 1 A 39 39 THR H H 39 8.095 8.524 -0.429 1
1 415 . 19 1 1 A 39 39 THR HA H 39 4.336 5.064 -0.728 1
1 420 . 19 1 1 A 39 39 THR C C 39 173.553 172.812 0.741 1
1 421 . 19 1 1 A 39 39 THR CA C 39 60.417 60.363 0.054 1
1 422 . 19 1 1 A 39 39 THR CB C 39 70.912 69.974 0.938 1
1 424 . 19 1 1 A 39 39 THR N N 39 110.982 115.265 -4.283 1
1 425 . 19 1 1 A 40 40 ASP H H 40 8.417 8.769 -0.352 1
1 426 . 19 1 1 A 40 40 ASP HA H 40 4.553 5.233 -0.680 1
1 429 . 19 1 1 A 40 40 ASP C C 40 176.462 174.843 1.619 1
1 430 . 19 1 1 A 40 40 ASP CA C 40 54.158 52.396 1.762 1
1 431 . 19 1 1 A 40 40 ASP CB C 40 41.517 44.483 -2.966 1
1 432 . 19 1 1 A 40 40 ASP N N 40 121.450 126.527 -5.077 1
1 433 . 19 1 1 A 41 41 ALA H H 41 8.435 8.709 -0.274 1
1 434 . 19 1 1 A 41 41 ALA HA H 41 4.129 4.178 -0.049 1
1 438 . 19 1 1 A 41 41 ALA C C 41 177.718 178.539 -0.821 1
1 439 . 19 1 1 A 41 41 ALA CA C 41 53.436 52.888 0.548 1
1 440 . 19 1 1 A 41 41 ALA CB C 41 19.183 19.256 -0.073 1
1 441 . 19 1 1 A 41 41 ALA N N 41 124.607 125.603 -0.996 1
1 442 . 19 1 1 A 42 42 ASP H H 42 8.310 8.673 -0.363 1
1 443 . 19 1 1 A 42 42 ASP HA H 42 4.588 4.724 -0.136 1
1 446 . 19 1 1 A 42 42 ASP C C 42 176.546 175.955 0.591 1
1 447 . 19 1 1 A 42 42 ASP CA C 42 54.599 53.187 1.412 1
1 448 . 19 1 1 A 42 42 ASP CB C 42 41.146 40.212 0.934 1
1 449 . 19 1 1 A 42 42 ASP N N 42 118.030 120.671 -2.641 1
1 450 . 19 1 1 A 43 43 ILE H H 43 8.000 7.520 0.480 1
1 451 . 19 1 1 A 43 43 ILE HA H 43 4.130 3.877 0.253 1
1 461 . 19 1 1 A 43 43 ILE C C 43 176.901 176.568 0.333 1
1 462 . 19 1 1 A 43 43 ILE CA C 43 61.740 62.854 -1.114 1
1 463 . 19 1 1 A 43 43 ILE CB C 43 38.491 37.577 0.914 1
1 467 . 19 1 1 A 43 43 ILE N N 43 119.301 121.115 -1.814 1
1 468 . 19 1 1 A 44 44 GLY H H 44 8.448 8.585 -0.137 1
1 469 . 19 1 1 A 44 44 GLY HA2 H 44 3.939 4.015 -0.076 1
1 470 . 19 1 1 A 44 44 GLY HA3 H 44 3.939 4.017 -0.078 1
1 471 . 19 1 1 A 44 44 GLY C C 44 174.393 172.935 1.458 1
1 472 . 19 1 1 A 44 44 GLY CA C 44 45.501 45.586 -0.085 1
1 473 . 19 1 1 A 44 44 GLY N N 44 111.333 116.666 -5.333 1
1 474 . 19 1 1 A 45 45 SER H H 45 8.061 7.957 0.104 1
1 475 . 19 1 1 A 45 45 SER HA H 45 4.416 4.606 -0.190 1
1 478 . 19 1 1 A 45 45 SER C C 45 174.480 172.290 2.190 1
1 479 . 19 1 1 A 45 45 SER CA C 45 58.478 57.353 1.125 1
1 480 . 19 1 1 A 45 45 SER CB C 45 63.943 65.402 -1.459 1
1 481 . 19 1 1 A 45 45 SER N N 45 115.551 114.951 0.600 1
1 482 . 19 1 1 A 46 46 ASN H H 46 8.547 8.587 -0.040 1
1 483 . 19 1 1 A 46 46 ASN HA H 46 4.725 4.674 0.051 1
1 488 . 19 1 1 A 46 46 ASN C C 46 175.031 174.647 0.384 1
1 489 . 19 1 1 A 46 46 ASN CA C 46 53.277 53.492 -0.215 1
1 490 . 19 1 1 A 46 46 ASN CB C 46 38.798 39.385 -0.587 1
1 491 . 19 1 1 A 46 46 ASN N N 46 120.698 123.449 -2.751 1
1 493 . 19 1 1 A 47 47 ALA H H 47 8.239 8.515 -0.276 1
1 494 . 19 1 1 A 47 47 ALA HA H 47 4.283 4.995 -0.712 1
1 498 . 19 1 1 A 47 47 ALA C C 47 177.240 175.435 1.805 1
1 499 . 19 1 1 A 47 47 ALA CA C 47 52.731 51.374 1.357 1
1 500 . 19 1 1 A 47 47 ALA CB C 47 19.594 21.081 -1.487 1
1 501 . 19 1 1 A 47 47 ALA N N 47 124.093 126.389 -2.296 1
1 502 . 19 1 1 A 48 48 GLU H H 48 8.376 8.807 -0.431 1
1 503 . 19 1 1 A 48 48 GLU HA H 48 4.264 4.624 -0.360 1
1 508 . 19 1 1 A 48 48 GLU C C 48 175.702 175.300 0.402 1
1 509 . 19 1 1 A 48 48 GLU CA C 48 55.992 55.412 0.580 1
1 510 . 19 1 1 A 48 48 GLU CB C 48 30.210 29.590 0.620 1
1 512 . 19 1 1 A 48 48 GLU N N 48 119.750 123.228 -3.478 1
1 513 . 19 1 1 A 49 49 ILE H H 49 7.806 8.287 -0.481 1
1 514 . 19 1 1 A 49 49 ILE HA H 49 3.919 4.023 -0.104 1
1 524 . 19 1 1 A 49 49 ILE C C 49 175.894 175.193 0.701 1
1 525 . 19 1 1 A 49 49 ILE CA C 49 60.559 61.527 -0.968 1
1 526 . 19 1 1 A 49 49 ILE CB C 49 37.860 37.206 0.654 1
1 530 . 19 1 1 A 49 49 ILE N N 49 122.772 125.681 -2.909 1
1 531 . 19 1 1 A 50 50 ARG H H 50 8.247 8.089 0.158 1
1 532 . 19 1 1 A 50 50 ARG HA H 50 4.999 5.031 -0.032 1
1 539 . 19 1 1 A 50 50 ARG C C 50 174.603 174.646 -0.043 1
1 540 . 19 1 1 A 50 50 ARG CA C 50 53.189 55.018 -1.829 1
1 541 . 19 1 1 A 50 50 ARG CB C 50 33.152 31.284 1.868 1
1 544 . 19 1 1 A 50 50 ARG N N 50 126.912 127.274 -0.362 1
1 545 . 19 1 1 A 51 51 TYR H H 51 9.041 9.015 0.026 1
1 546 . 19 1 1 A 51 51 TYR HA H 51 5.395 4.956 0.439 1
1 553 . 19 1 1 A 51 51 TYR C C 51 175.555 175.853 -0.298 1
1 554 . 19 1 1 A 51 51 TYR CA C 51 56.909 58.007 -1.098 1
1 555 . 19 1 1 A 51 51 TYR CB C 51 40.116 40.242 -0.126 1
1 560 . 19 1 1 A 51 51 TYR N N 51 121.627 122.895 -1.268 1
1 561 . 19 1 1 A 52 52 ILE H H 52 8.850 8.283 0.567 1
1 562 . 19 1 1 A 52 52 ILE HA H 52 4.576 4.882 -0.306 1
1 572 . 19 1 1 A 52 52 ILE C C 52 175.371 174.927 0.444 1
1 573 . 19 1 1 A 52 52 ILE CA C 52 59.624 58.991 0.633 1
1 574 . 19 1 1 A 52 52 ILE CB C 52 42.895 42.282 0.613 1
1 578 . 19 1 1 A 52 52 ILE N N 52 117.697 116.726 0.971 1
1 579 . 19 1 1 A 53 53 PHE H H 53 8.748 8.861 -0.113 1
1 580 . 19 1 1 A 53 53 PHE HA H 53 5.132 4.752 0.380 1
1 588 . 19 1 1 A 53 53 PHE C C 53 178.146 176.469 1.677 1
1 589 . 19 1 1 A 53 53 PHE CA C 53 57.667 57.258 0.409 1
1 590 . 19 1 1 A 53 53 PHE CB C 53 39.614 39.526 0.088 1
1 596 . 19 1 1 A 53 53 PHE N N 53 121.433 120.649 0.784 1
1 597 . 19 1 1 A 54 54 GLY H H 54 8.538 8.490 0.048 1
1 598 . 19 1 1 A 54 54 GLY HA2 H 54 4.074 4.118 -0.044 1
1 599 . 19 1 1 A 54 54 GLY HA3 H 54 3.840 4.120 -0.280 1
1 600 . 19 1 1 A 54 54 GLY C C 54 174.530 172.891 1.639 1
1 601 . 19 1 1 A 54 54 GLY CA C 54 44.884 44.564 0.320 1
1 602 . 19 1 1 A 54 54 GLY N N 54 106.444 110.232 -3.788 1
1 603 . 19 1 1 A 55 55 ALA H H 55 8.594 8.418 0.176 1
1 604 . 19 1 1 A 55 55 ALA HA H 55 4.172 4.582 -0.410 1
1 608 . 19 1 1 A 55 55 ALA C C 55 178.718 177.474 1.244 1
1 609 . 19 1 1 A 55 55 ALA CA C 55 54.423 51.356 3.067 1
1 610 . 19 1 1 A 55 55 ALA CB C 55 19.059 19.973 -0.914 1
1 611 . 19 1 1 A 55 55 ALA N N 55 123.470 121.799 1.671 1
1 612 . 19 1 1 A 56 56 GLN H H 56 8.727 8.725 0.002 1
1 613 . 19 1 1 A 56 56 GLN HA H 56 4.367 3.763 0.604 1
1 620 . 19 1 1 A 56 56 GLN C C 56 176.134 174.780 1.354 1
1 621 . 19 1 1 A 56 56 GLN CA C 56 55.660 56.737 -1.077 1
1 622 . 19 1 1 A 56 56 GLN CB C 56 28.152 26.825 1.327 1
1 624 . 19 1 1 A 56 56 GLN N N 56 114.221 117.489 -3.268 1
1 626 . 19 1 1 A 57 57 VAL H H 57 7.204 7.853 -0.649 1
1 627 . 19 1 1 A 57 57 VAL HA H 57 3.889 4.104 -0.215 1
1 635 . 19 1 1 A 57 57 VAL C C 57 175.371 175.482 -0.111 1
1 636 . 19 1 1 A 57 57 VAL CA C 57 63.908 61.665 2.243 1
1 637 . 19 1 1 A 57 57 VAL CB C 57 31.557 32.664 -1.107 1
1 640 . 19 1 1 A 57 57 VAL N N 57 121.341 119.760 1.581 1
1 641 . 19 1 1 A 58 58 ALA H H 58 8.920 8.478 0.442 1
1 642 . 19 1 1 A 58 58 ALA HA H 58 4.547 4.313 0.234 1
1 646 . 19 1 1 A 58 58 ALA C C 58 177.064 177.786 -0.722 1
1 647 . 19 1 1 A 58 58 ALA CA C 58 51.173 50.767 0.406 1
1 648 . 19 1 1 A 58 58 ALA CB C 58 17.842 17.805 0.037 1
1 649 . 19 1 1 A 58 58 ALA N N 58 132.726 130.213 2.513 1
1 650 . 19 1 1 A 59 59 PRO HA H 59 4.101 4.246 -0.145 1
1 657 . 19 1 1 A 59 59 PRO C C 59 179.482 178.785 0.697 1
1 658 . 19 1 1 A 59 59 PRO CA C 59 66.060 65.787 0.273 1
1 659 . 19 1 1 A 59 59 PRO CB C 59 31.951 31.672 0.279 1
1 662 . 19 1 1 A 60 60 ALA H H 60 8.706 8.157 0.549 1
1 663 . 19 1 1 A 60 60 ALA HA H 60 4.057 4.014 0.043 1
1 667 . 19 1 1 A 60 60 ALA C C 60 179.627 180.102 -0.475 1
1 668 . 19 1 1 A 60 60 ALA CA C 60 55.305 55.373 -0.068 1
1 669 . 19 1 1 A 60 60 ALA CB C 60 18.737 18.582 0.155 1
1 670 . 19 1 1 A 60 60 ALA N N 60 117.882 118.853 -0.971 1
1 671 . 19 1 1 A 61 61 THR H H 61 7.312 8.245 -0.933 1
1 672 . 19 1 1 A 61 61 THR HA H 61 4.153 4.008 0.145 1
1 677 . 19 1 1 A 61 61 THR C C 61 175.824 176.488 -0.664 1
1 678 . 19 1 1 A 61 61 THR CA C 61 66.412 66.605 -0.193 1
1 679 . 19 1 1 A 61 61 THR CB C 61 68.787 68.898 -0.111 1
1 681 . 19 1 1 A 61 61 THR N N 61 114.483 112.710 1.773 1
1 682 . 19 1 1 A 62 62 LYS H H 62 7.556 7.527 0.029 1
1 683 . 19 1 1 A 62 62 LYS HA H 62 3.943 4.084 -0.141 1
1 692 . 19 1 1 A 62 62 LYS C C 62 176.884 178.839 -1.955 1
1 693 . 19 1 1 A 62 62 LYS CA C 62 59.095 59.018 0.077 1
1 694 . 19 1 1 A 62 62 LYS CB C 62 32.204 32.193 0.011 1
1 698 . 19 1 1 A 62 62 LYS N N 62 118.994 119.193 -0.199 1
1 699 . 19 1 1 A 63 63 ARG H H 63 7.474 8.148 -0.674 1
1 700 . 19 1 1 A 63 63 ARG HA H 63 4.034 4.062 -0.028 1
1 707 . 19 1 1 A 63 63 ARG C C 63 177.574 178.583 -1.009 1
1 708 . 19 1 1 A 63 63 ARG CA C 63 58.143 58.966 -0.823 1
1 709 . 19 1 1 A 63 63 ARG CB C 63 30.755 29.744 1.011 1
1 712 . 19 1 1 A 63 63 ARG N N 63 114.251 119.744 -5.493 1
1 713 . 19 1 1 A 64 64 LEU H H 64 6.991 7.507 -0.516 1
1 714 . 19 1 1 A 64 64 LEU HA H 64 3.904 3.828 0.076 1
1 724 . 19 1 1 A 64 64 LEU C C 64 176.632 176.213 0.419 1
1 725 . 19 1 1 A 64 64 LEU CA C 64 56.503 57.512 -1.009 1
1 726 . 19 1 1 A 64 64 LEU CB C 64 42.929 41.824 1.105 1
1 730 . 19 1 1 A 64 64 LEU N N 64 116.109 118.787 -2.678 1
1 731 . 19 1 1 A 65 65 PHE H H 65 7.673 7.815 -0.142 1
1 732 . 19 1 1 A 65 65 PHE HA H 65 5.386 5.023 0.363 1
1 740 . 19 1 1 A 65 65 PHE C C 65 173.067 175.077 -2.010 1
1 741 . 19 1 1 A 65 65 PHE CA C 65 56.521 57.174 -0.653 1
1 742 . 19 1 1 A 65 65 PHE CB C 65 41.270 40.331 0.939 1
1 748 . 19 1 1 A 65 65 PHE N N 65 116.182 115.590 0.592 1
1 749 . 19 1 1 A 66 66 ALA H H 66 8.914 8.915 -0.001 1
1 750 . 19 1 1 A 66 66 ALA HA H 66 4.748 5.273 -0.525 1
1 754 . 19 1 1 A 66 66 ALA C C 66 175.223 175.922 -0.699 1
1 755 . 19 1 1 A 66 66 ALA CA C 66 50.050 50.712 -0.662 1
1 756 . 19 1 1 A 66 66 ALA CB C 66 21.161 21.245 -0.084 1
1 757 . 19 1 1 A 66 66 ALA N N 66 122.870 126.720 -3.850 1
1 758 . 19 1 1 A 67 67 LEU H H 67 8.498 8.895 -0.397 1
1 759 . 19 1 1 A 67 67 LEU HA H 67 4.713 4.899 -0.186 1
1 769 . 19 1 1 A 67 67 LEU C C 67 175.146 175.137 0.009 1
1 770 . 19 1 1 A 67 67 LEU CA C 67 52.518 53.337 -0.819 1
1 771 . 19 1 1 A 67 67 LEU CB C 67 45.308 45.583 -0.275 1
1 775 . 19 1 1 A 67 67 LEU N N 67 122.208 123.176 -0.968 1
1 776 . 19 1 1 A 68 68 ASN H H 68 8.357 8.661 -0.304 1
1 777 . 19 1 1 A 68 68 ASN HA H 68 4.679 4.811 -0.132 1
1 782 . 19 1 1 A 68 68 ASN C C 68 176.228 175.772 0.456 1
1 783 . 19 1 1 A 68 68 ASN CA C 68 53.524 53.612 -0.088 1
1 784 . 19 1 1 A 68 68 ASN CB C 68 39.580 39.160 0.420 1
1 785 . 19 1 1 A 68 68 ASN N N 68 126.940 124.866 2.074 1
1 787 . 19 1 1 A 69 69 ASN H H 69 8.861 9.046 -0.185 1
1 788 . 19 1 1 A 69 69 ASN HA H 69 5.137 5.052 0.085 1
1 793 . 19 1 1 A 69 69 ASN C C 69 175.631 176.359 -0.728 1
1 794 . 19 1 1 A 69 69 ASN CA C 69 56.009 53.721 2.288 1
1 795 . 19 1 1 A 69 69 ASN CB C 69 40.314 38.836 1.478 1
1 796 . 19 1 1 A 69 69 ASN N N 69 124.980 122.701 2.279 1
1 798 . 19 1 1 A 70 70 THR H H 70 8.635 8.035 0.600 1
1 799 . 19 1 1 A 70 70 THR HA H 70 4.815 4.668 0.147 1
1 804 . 19 1 1 A 70 70 THR C C 70 176.223 175.653 0.570 1
1 805 . 19 1 1 A 70 70 THR CA C 70 63.944 62.591 1.353 1
1 806 . 19 1 1 A 70 70 THR CB C 70 69.727 70.240 -0.513 1
1 808 . 19 1 1 A 70 70 THR N N 70 110.394 109.634 0.760 1
1 809 . 19 1 1 A 71 71 THR H H 71 8.069 7.999 0.070 1
1 810 . 19 1 1 A 71 71 THR HA H 71 4.566 4.769 -0.203 1
1 815 . 19 1 1 A 71 71 THR C C 71 176.213 175.858 0.355 1
1 816 . 19 1 1 A 71 71 THR CA C 71 61.683 62.125 -0.442 1
1 817 . 19 1 1 A 71 71 THR CB C 71 70.832 71.439 -0.607 1
1 819 . 19 1 1 A 71 71 THR N N 71 110.507 110.724 -0.217 1
1 820 . 19 1 1 A 72 72 GLY H H 72 7.990 8.232 -0.242 1
1 821 . 19 1 1 A 72 72 GLY HA2 H 72 3.186 2.576 0.610 1
1 822 . 19 1 1 A 72 72 GLY HA3 H 72 2.516 3.454 -0.938 1
1 823 . 19 1 1 A 72 72 GLY C C 72 172.988 173.845 -0.857 1
1 824 . 19 1 1 A 72 72 GLY CA C 72 45.149 44.824 0.325 1
1 825 . 19 1 1 A 72 72 GLY N N 72 110.788 111.440 -0.652 1
1 826 . 19 1 1 A 73 73 LEU H H 73 7.138 7.435 -0.297 1
1 827 . 19 1 1 A 73 73 LEU HA H 73 4.414 4.384 0.030 1
1 837 . 19 1 1 A 73 73 LEU C C 73 176.836 175.412 1.424 1
1 838 . 19 1 1 A 73 73 LEU CA C 73 55.252 54.947 0.305 1
1 839 . 19 1 1 A 73 73 LEU CB C 73 43.574 42.975 0.599 1
1 843 . 19 1 1 A 73 73 LEU N N 73 119.222 122.803 -3.581 1
1 844 . 19 1 1 A 74 74 ILE H H 74 8.925 8.406 0.519 1
1 845 . 19 1 1 A 74 74 ILE HA H 74 5.555 5.377 0.178 1
1 855 . 19 1 1 A 74 74 ILE C C 74 175.978 175.516 0.462 1
1 856 . 19 1 1 A 74 74 ILE CA C 74 60.100 59.975 0.125 1
1 857 . 19 1 1 A 74 74 ILE CB C 74 38.550 40.122 -1.572 1
1 861 . 19 1 1 A 74 74 ILE N N 74 129.871 126.672 3.199 1
1 862 . 19 1 1 A 75 75 THR H H 75 9.161 8.636 0.525 1
1 863 . 19 1 1 A 75 75 THR HA H 75 5.375 5.576 -0.201 1
1 868 . 19 1 1 A 75 75 THR C C 75 174.798 173.304 1.494 1
1 869 . 19 1 1 A 75 75 THR CA C 75 58.796 59.471 -0.675 1
1 870 . 19 1 1 A 75 75 THR CB C 75 72.978 72.084 0.894 1
1 872 . 19 1 1 A 75 75 THR N N 75 117.522 117.468 0.054 1
1 873 . 19 1 1 A 76 76 VAL H H 76 8.327 8.544 -0.217 1
1 874 . 19 1 1 A 76 76 VAL HA H 76 3.973 3.989 -0.016 1
1 882 . 19 1 1 A 76 76 VAL C C 76 176.495 176.162 0.333 1
1 883 . 19 1 1 A 76 76 VAL CA C 76 64.085 62.997 1.088 1
1 884 . 19 1 1 A 76 76 VAL CB C 76 32.863 30.995 1.868 1
1 887 . 19 1 1 A 76 76 VAL N N 76 120.876 122.169 -1.293 1
1 888 . 19 1 1 A 77 77 GLN H H 77 9.525 8.965 0.560 1
1 889 . 19 1 1 A 77 77 GLN HA H 77 4.702 4.157 0.545 1
1 896 . 19 1 1 A 77 77 GLN C C 77 173.838 175.411 -1.573 1
1 897 . 19 1 1 A 77 77 GLN CA C 77 55.728 57.680 -1.952 1
1 898 . 19 1 1 A 77 77 GLN CB C 77 30.762 29.634 1.128 1
1 900 . 19 1 1 A 77 77 GLN N N 77 129.825 129.183 0.642 1
1 902 . 19 1 1 A 78 78 ARG H H 78 7.621 7.227 0.394 1
1 903 . 19 1 1 A 78 78 ARG HA H 78 4.347 4.703 -0.356 1
1 910 . 19 1 1 A 78 78 ARG C C 78 172.304 174.883 -2.579 1
1 911 . 19 1 1 A 78 78 ARG CA C 78 54.634 54.338 0.296 1
1 912 . 19 1 1 A 78 78 ARG CB C 78 34.685 34.391 0.294 1
1 915 . 19 1 1 A 78 78 ARG N N 78 120.595 117.163 3.432 1
1 916 . 19 1 1 A 79 79 SER H H 79 7.958 8.462 -0.504 1
1 917 . 19 1 1 A 79 79 SER HA H 79 4.030 4.289 -0.259 1
1 920 . 19 1 1 A 79 79 SER C C 79 174.311 174.574 -0.263 1
1 921 . 19 1 1 A 79 79 SER CA C 79 59.889 58.787 1.102 1
1 922 . 19 1 1 A 79 79 SER CB C 79 63.548 63.544 0.004 1
1 923 . 19 1 1 A 79 79 SER N N 79 112.565 119.102 -6.537 1
1 924 . 19 1 1 A 80 80 LEU H H 80 8.715 8.418 0.297 1
1 925 . 19 1 1 A 80 80 LEU HA H 80 4.114 4.818 -0.704 1
1 935 . 19 1 1 A 80 80 LEU C C 80 176.057 176.074 -0.017 1
1 936 . 19 1 1 A 80 80 LEU CA C 80 55.091 53.284 1.807 1
1 937 . 19 1 1 A 80 80 LEU CB C 80 42.341 44.195 -1.854 1
1 941 . 19 1 1 A 80 80 LEU N N 80 123.070 124.281 -1.211 1
1 942 . 19 1 1 A 81 81 ASP H H 81 7.298 8.693 -1.395 1
1 943 . 19 1 1 A 81 81 ASP HA H 81 4.725 5.222 -0.497 1
1 946 . 19 1 1 A 81 81 ASP C C 81 175.939 175.980 -0.041 1
1 947 . 19 1 1 A 81 81 ASP CA C 81 53.664 53.003 0.661 1
1 948 . 19 1 1 A 81 81 ASP CB C 81 42.947 42.749 0.198 1
1 949 . 19 1 1 A 81 81 ASP N N 81 115.229 121.515 -6.286 1
1 950 . 19 1 1 A 82 82 ARG H H 82 9.289 8.758 0.531 1
1 951 . 19 1 1 A 82 82 ARG HA H 82 4.416 4.412 0.004 1
1 959 . 19 1 1 A 82 82 ARG C C 82 176.406 178.452 -2.046 1
1 960 . 19 1 1 A 82 82 ARG CA C 82 56.397 58.907 -2.510 1
1 961 . 19 1 1 A 82 82 ARG CB C 82 30.638 30.086 0.552 1
1 964 . 19 1 1 A 82 82 ARG N N 82 123.174 126.493 -3.319 1
1 966 . 19 1 1 A 83 83 GLU H H 83 8.468 8.371 0.097 1
1 967 . 19 1 1 A 83 83 GLU HA H 83 3.982 4.015 -0.033 1
1 972 . 19 1 1 A 83 83 GLU C C 83 177.740 179.067 -1.327 1
1 973 . 19 1 1 A 83 83 GLU CA C 83 58.425 59.460 -1.035 1
1 974 . 19 1 1 A 83 83 GLU CB C 83 29.701 29.237 0.464 1
1 976 . 19 1 1 A 83 83 GLU N N 83 119.549 118.785 0.764 1
1 977 . 19 1 1 A 84 84 GLU H H 84 8.033 7.893 0.140 1
1 978 . 19 1 1 A 84 84 GLU HA H 84 4.206 4.305 -0.099 1
1 983 . 19 1 1 A 84 84 GLU C C 84 176.837 175.998 0.839 1
1 984 . 19 1 1 A 84 84 GLU CA C 84 58.056 58.323 -0.267 1
1 985 . 19 1 1 A 84 84 GLU CB C 84 30.432 30.483 -0.051 1
1 987 . 19 1 1 A 84 84 GLU N N 84 118.333 118.643 -0.310 1
1 988 . 19 1 1 A 85 85 THR H H 85 7.651 7.913 -0.262 1
1 989 . 19 1 1 A 85 85 THR HA H 85 4.307 4.692 -0.385 1
1 994 . 19 1 1 A 85 85 THR C C 85 171.568 173.399 -1.831 1
1 995 . 19 1 1 A 85 85 THR CA C 85 61.387 59.191 2.196 1
1 996 . 19 1 1 A 85 85 THR CB C 85 69.963 70.812 -0.849 1
1 998 . 19 1 1 A 85 85 THR N N 85 112.444 112.110 0.334 1
1 999 . 19 1 1 A 86 86 ALA H H 86 8.639 8.500 0.139 1
1 1000 . 19 1 1 A 86 86 ALA HA H 86 4.603 4.450 0.153 1
1 1004 . 19 1 1 A 86 86 ALA C C 86 175.560 176.826 -1.266 1
1 1005 . 19 1 1 A 86 86 ALA CA C 86 52.156 53.152 -0.996 1
1 1006 . 19 1 1 A 86 86 ALA CB C 86 20.378 20.694 -0.316 1
1 1007 . 19 1 1 A 86 86 ALA N N 86 127.705 127.428 0.277 1
1 1008 . 19 1 1 A 87 87 ILE H H 87 7.663 7.575 0.088 1
1 1009 . 19 1 1 A 87 87 ILE HA H 87 4.828 4.584 0.244 1
1 1019 . 19 1 1 A 87 87 ILE C C 87 174.537 174.564 -0.027 1
1 1020 . 19 1 1 A 87 87 ILE CA C 87 60.329 59.982 0.347 1
1 1021 . 19 1 1 A 87 87 ILE CB C 87 41.090 40.551 0.539 1
1 1025 . 19 1 1 A 87 87 ILE N N 87 118.712 117.079 1.633 1
1 1026 . 19 1 1 A 88 88 HIS H H 88 9.098 9.059 0.039 1
1 1027 . 19 1 1 A 88 88 HIS HA H 88 4.576 5.085 -0.509 1
1 1032 . 19 1 1 A 88 88 HIS C C 88 174.354 174.078 0.276 1
1 1033 . 19 1 1 A 88 88 HIS CA C 88 54.740 54.059 0.681 1
1 1034 . 19 1 1 A 88 88 HIS CB C 88 33.955 31.718 2.237 1
1 1037 . 19 1 1 A 88 88 HIS N N 88 126.285 125.681 0.604 1
1 1038 . 19 1 1 A 89 89 LYS H H 89 8.957 8.921 0.036 1
1 1039 . 19 1 1 A 89 89 LYS HA H 89 4.873 4.647 0.226 1
1 1048 . 19 1 1 A 89 89 LYS C C 89 175.906 175.597 0.309 1
1 1049 . 19 1 1 A 89 89 LYS CA C 89 55.269 55.497 -0.228 1
1 1050 . 19 1 1 A 89 89 LYS CB C 89 32.945 33.236 -0.291 1
1 1054 . 19 1 1 A 89 89 LYS N N 89 124.332 124.507 -0.175 1
1 1055 . 19 1 1 A 90 90 VAL H H 90 9.174 8.772 0.402 1
1 1056 . 19 1 1 A 90 90 VAL HA H 90 4.227 5.003 -0.776 1
1 1064 . 19 1 1 A 90 90 VAL C C 90 174.168 174.577 -0.409 1
1 1065 . 19 1 1 A 90 90 VAL CA C 90 61.369 61.049 0.320 1
1 1066 . 19 1 1 A 90 90 VAL CB C 90 34.082 34.709 -0.627 1
1 1069 . 19 1 1 A 90 90 VAL N N 90 124.319 125.094 -0.775 1
1 1070 . 19 1 1 A 91 91 THR H H 91 6.697 8.977 -2.280 1
1 1071 . 19 1 1 A 91 91 THR HA H 91 5.163 5.349 -0.186 1
1 1076 . 19 1 1 A 91 91 THR C C 91 173.812 173.866 -0.054 1
1 1077 . 19 1 1 A 91 91 THR CA C 91 61.935 62.000 -0.065 1
1 1078 . 19 1 1 A 91 91 THR CB C 91 70.412 70.485 -0.073 1
1 1080 . 19 1 1 A 91 91 THR N N 91 122.637 123.530 -0.893 1
1 1081 . 19 1 1 A 92 92 VAL H H 92 9.292 9.008 0.284 1
1 1082 . 19 1 1 A 92 92 VAL HA H 92 4.736 4.967 -0.231 1
1 1090 . 19 1 1 A 92 92 VAL C C 92 173.160 175.195 -2.035 1
1 1091 . 19 1 1 A 92 92 VAL CA C 92 60.982 60.617 0.365 1
1 1092 . 19 1 1 A 92 92 VAL CB C 92 35.130 35.090 0.040 1
1 1095 . 19 1 1 A 92 92 VAL N N 92 128.265 124.393 3.872 1
1 1096 . 19 1 1 A 93 93 LEU H H 93 9.495 8.533 0.962 1
1 1097 . 19 1 1 A 93 93 LEU HA H 93 5.628 5.571 0.057 1
1 1107 . 19 1 1 A 93 93 LEU C C 93 176.274 175.513 0.761 1
1 1108 . 19 1 1 A 93 93 LEU CA C 93 52.773 53.802 -1.029 1
1 1109 . 19 1 1 A 93 93 LEU CB C 93 43.454 45.115 -1.661 1
1 1113 . 19 1 1 A 93 93 LEU N N 93 126.350 126.142 0.208 1
1 1114 . 19 1 1 A 94 94 ALA H H 94 8.688 9.196 -0.508 1
1 1115 . 19 1 1 A 94 94 ALA HA H 94 4.986 4.906 0.080 1
1 1119 . 19 1 1 A 94 94 ALA C C 94 175.787 176.263 -0.476 1
1 1120 . 19 1 1 A 94 94 ALA CA C 94 49.610 50.443 -0.833 1
1 1121 . 19 1 1 A 94 94 ALA CB C 94 21.463 20.040 1.423 1
1 1122 . 19 1 1 A 94 94 ALA N N 94 123.429 128.890 -5.461 1
1 1123 . 19 1 1 A 95 95 SER H H 95 8.401 8.765 -0.364 1
1 1124 . 19 1 1 A 95 95 SER HA H 95 4.828 5.097 -0.269 1
1 1127 . 19 1 1 A 95 95 SER C C 95 174.327 173.144 1.183 1
1 1128 . 19 1 1 A 95 95 SER CA C 95 56.239 56.525 -0.286 1
1 1129 . 19 1 1 A 95 95 SER CB C 95 65.561 65.331 0.230 1
1 1130 . 19 1 1 A 95 95 SER N N 95 114.418 118.505 -4.087 1
1 1131 . 19 1 1 A 96 96 ASP H H 96 8.690 8.980 -0.290 1
1 1132 . 19 1 1 A 96 96 ASP HA H 96 4.908 4.726 0.182 1
1 1135 . 19 1 1 A 96 96 ASP C C 96 177.096 176.484 0.612 1
1 1136 . 19 1 1 A 96 96 ASP CA C 96 52.818 55.120 -2.302 1
1 1137 . 19 1 1 A 96 96 ASP CB C 96 41.253 43.330 -2.077 1
1 1138 . 19 1 1 A 96 96 ASP N N 96 125.624 125.417 0.207 1
1 1139 . 19 1 1 A 97 97 GLY H H 97 8.524 7.468 1.056 1
1 1140 . 19 1 1 A 97 97 GLY HA2 H 97 4.320 4.022 0.298 1
1 1141 . 19 1 1 A 97 97 GLY HA3 H 97 3.620 4.024 -0.404 1
1 1142 . 19 1 1 A 97 97 GLY C C 97 174.620 173.652 0.968 1
1 1143 . 19 1 1 A 97 97 GLY CA C 97 45.422 45.134 0.288 1
1 1144 . 19 1 1 A 97 97 GLY N N 97 109.283 106.994 2.289 1
1 1145 . 19 1 1 A 98 98 SER H H 98 8.575 7.695 0.880 1
1 1146 . 19 1 1 A 98 98 SER HA H 98 4.607 5.017 -0.410 1
1 1149 . 19 1 1 A 98 98 SER C C 98 174.478 172.808 1.670 1
1 1150 . 19 1 1 A 98 98 SER CA C 98 59.095 56.263 2.832 1
1 1151 . 19 1 1 A 98 98 SER CB C 98 64.800 66.513 -1.713 1
1 1152 . 19 1 1 A 98 98 SER N N 98 116.640 112.835 3.805 1
1 1153 . 19 1 1 A 99 99 SER H H 99 8.945 8.668 0.277 1
1 1154 . 19 1 1 A 99 99 SER HA H 99 4.530 4.567 -0.037 1
1 1157 . 19 1 1 A 99 99 SER C C 99 174.491 174.396 0.095 1
1 1158 . 19 1 1 A 99 99 SER CA C 99 58.460 58.390 0.070 1
1 1159 . 19 1 1 A 99 99 SER CB C 99 64.146 63.716 0.430 1
1 1160 . 19 1 1 A 99 99 SER N N 99 117.676 116.861 0.815 1
1 1161 . 19 1 1 A 100 100 THR H H 100 8.411 8.321 0.090 1
1 1162 . 19 1 1 A 100 100 THR HA H 100 4.490 4.211 0.279 1
1 1167 . 19 1 1 A 100 100 THR C C 100 172.766 173.137 -0.371 1
1 1168 . 19 1 1 A 100 100 THR CA C 100 60.629 61.417 -0.788 1
1 1169 . 19 1 1 A 100 100 THR CB C 100 69.778 69.398 0.380 1
1 1171 . 19 1 1 A 100 100 THR N N 100 118.401 118.388 0.013 1
1 1172 . 19 1 1 A 101 101 PRO HA H 101 4.631 4.556 0.075 1
1 1179 . 19 1 1 A 101 101 PRO C C 101 177.227 175.934 1.293 1
1 1180 . 19 1 1 A 101 101 PRO CA C 101 63.097 62.317 0.780 1
1 1181 . 19 1 1 A 101 101 PRO CB C 101 32.917 32.718 0.199 1
1 1184 . 19 1 1 A 102 102 ALA H H 102 8.497 8.312 0.185 1
1 1185 . 19 1 1 A 102 102 ALA HA H 102 4.619 4.842 -0.223 1
1 1189 . 19 1 1 A 102 102 ALA C C 102 176.542 176.697 -0.155 1
1 1190 . 19 1 1 A 102 102 ALA CA C 102 51.390 51.581 -0.191 1
1 1191 . 19 1 1 A 102 102 ALA CB C 102 20.815 20.889 -0.074 1
1 1192 . 19 1 1 A 102 102 ALA N N 102 124.487 122.535 1.952 1
1 1193 . 19 1 1 A 103 103 ARG H H 103 8.663 8.670 -0.007 1
1 1194 . 19 1 1 A 103 103 ARG HA H 103 5.515 5.093 0.422 1
1 1201 . 19 1 1 A 103 103 ARG C C 103 174.539 175.391 -0.852 1
1 1202 . 19 1 1 A 103 103 ARG CA C 103 55.164 55.116 0.048 1
1 1203 . 19 1 1 A 103 103 ARG CB C 103 34.393 32.836 1.557 1
1 1206 . 19 1 1 A 103 103 ARG N N 103 119.596 121.383 -1.787 1
1 1207 . 19 1 1 A 104 104 ALA H H 104 9.027 8.597 0.430 1
1 1208 . 19 1 1 A 104 104 ALA HA H 104 4.782 4.837 -0.055 1
1 1212 . 19 1 1 A 104 104 ALA C C 104 176.276 175.301 0.975 1
1 1213 . 19 1 1 A 104 104 ALA CA C 104 50.297 50.718 -0.421 1
1 1214 . 19 1 1 A 104 104 ALA CB C 104 20.810 20.868 -0.058 1
1 1215 . 19 1 1 A 104 104 ALA N N 104 126.962 123.570 3.392 1
1 1216 . 19 1 1 A 105 105 THR H H 105 8.384 8.771 -0.387 1
1 1217 . 19 1 1 A 105 105 THR HA H 105 4.954 4.845 0.109 1
1 1222 . 19 1 1 A 105 105 THR C C 105 173.243 173.804 -0.561 1
1 1223 . 19 1 1 A 105 105 THR CA C 105 61.475 62.239 -0.764 1
1 1224 . 19 1 1 A 105 105 THR CB C 105 70.569 69.121 1.448 1
1 1226 . 19 1 1 A 105 105 THR N N 105 115.327 119.360 -4.033 1
1 1227 . 19 1 1 A 106 106 VAL H H 106 8.970 8.969 0.001 1
1 1228 . 19 1 1 A 106 106 VAL HA H 106 4.702 4.601 0.101 1
1 1236 . 19 1 1 A 106 106 VAL C C 106 174.743 174.970 -0.227 1
1 1237 . 19 1 1 A 106 106 VAL CA C 106 59.712 60.983 -1.271 1
1 1238 . 19 1 1 A 106 106 VAL CB C 106 34.327 32.676 1.651 1
1 1241 . 19 1 1 A 106 106 VAL N N 106 126.226 128.194 -1.968 1
1 1242 . 19 1 1 A 107 107 THR H H 107 8.833 8.508 0.325 1
1 1243 . 19 1 1 A 107 107 THR HA H 107 4.862 4.696 0.166 1
1 1248 . 19 1 1 A 107 107 THR C C 107 172.970 174.020 -1.050 1
1 1249 . 19 1 1 A 107 107 THR CA C 107 62.322 62.171 0.151 1
1 1250 . 19 1 1 A 107 107 THR CB C 107 69.463 70.175 -0.712 1
1 1252 . 19 1 1 A 107 107 THR N N 107 125.403 122.904 2.499 1
1 1253 . 19 1 1 A 108 108 ILE H H 108 9.234 8.862 0.372 1
1 1254 . 19 1 1 A 108 108 ILE HA H 108 4.178 4.697 -0.519 1
1 1264 . 19 1 1 A 108 108 ILE C C 108 174.087 175.187 -1.100 1
1 1265 . 19 1 1 A 108 108 ILE CA C 108 60.365 60.415 -0.050 1
1 1266 . 19 1 1 A 108 108 ILE CB C 108 39.745 39.714 0.031 1
1 1270 . 19 1 1 A 108 108 ILE N N 108 127.152 126.876 0.276 1
1 1271 . 19 1 1 A 109 109 ASN H H 109 8.723 8.600 0.123 1
1 1272 . 19 1 1 A 109 109 ASN HA H 109 5.147 5.185 -0.038 1
1 1277 . 19 1 1 A 109 109 ASN C C 109 173.592 174.830 -1.238 1
1 1278 . 19 1 1 A 109 109 ASN CA C 109 52.501 53.158 -0.657 1
1 1279 . 19 1 1 A 109 109 ASN CB C 109 40.791 40.310 0.481 1
1 1280 . 19 1 1 A 109 109 ASN N N 109 126.866 126.158 0.708 1
1 1282 . 19 1 1 A 110 110 VAL H H 110 9.046 8.032 1.014 1
1 1283 . 19 1 1 A 110 110 VAL HA H 110 5.081 5.084 -0.003 1
1 1291 . 19 1 1 A 110 110 VAL C C 110 176.921 175.713 1.208 1
1 1292 . 19 1 1 A 110 110 VAL CA C 110 61.634 61.315 0.319 1
1 1293 . 19 1 1 A 110 110 VAL CB C 110 31.809 33.738 -1.929 1
1 1296 . 19 1 1 A 110 110 VAL N N 110 126.070 121.531 4.539 1
1 1297 . 19 1 1 A 111 111 THR H H 111 9.197 9.079 0.118 1
1 1298 . 19 1 1 A 111 111 THR HA H 111 4.566 5.121 -0.555 1
1 1303 . 19 1 1 A 111 111 THR C C 111 174.087 173.858 0.229 1
1 1304 . 19 1 1 A 111 111 THR CA C 111 61.145 59.868 1.277 1
1 1305 . 19 1 1 A 111 111 THR CB C 111 70.706 71.045 -0.339 1
1 1307 . 19 1 1 A 111 111 THR N N 111 121.425 116.933 4.492 1
1 1308 . 19 1 1 A 112 112 ASP H H 112 8.435 8.591 -0.156 1
1 1309 . 19 1 1 A 112 112 ASP HA H 112 4.656 4.945 -0.289 1
1 1312 . 19 1 1 A 112 112 ASP C C 112 176.745 176.691 0.054 1
1 1313 . 19 1 1 A 112 112 ASP CA C 112 54.158 52.957 1.201 1
1 1314 . 19 1 1 A 112 112 ASP CB C 112 41.575 42.176 -0.601 1
1 1315 . 19 1 1 A 112 112 ASP N N 112 119.566 121.945 -2.379 1
1 1316 . 19 1 1 A 113 113 VAL H H 113 8.629 8.475 0.154 1
1 1317 . 19 1 1 A 113 113 VAL HA H 113 4.078 4.316 -0.238 1
1 1325 . 19 1 1 A 113 113 VAL C C 113 175.247 176.632 -1.385 1
1 1326 . 19 1 1 A 113 113 VAL CA C 113 62.533 62.002 0.531 1
1 1327 . 19 1 1 A 113 113 VAL CB C 113 32.534 32.939 -0.405 1
1 1330 . 19 1 1 A 113 113 VAL N N 113 119.356 117.258 2.098 1
1 4 . 20 1 1 A 2 2 SER H H 2 8.289 8.457 -0.168 1
1 5 . 20 1 1 A 2 2 SER HA H 2 4.530 4.850 -0.320 1
1 7 . 20 1 1 A 2 2 SER C C 2 174.868 174.257 0.611 1
1 8 . 20 1 1 A 2 2 SER CA C 2 58.284 59.327 -1.043 1
1 9 . 20 1 1 A 2 2 SER CB C 2 63.769 65.925 -2.156 1
1 10 . 20 1 1 A 2 2 SER N N 2 115.842 117.100 -1.258 1
1 11 . 20 1 1 A 3 3 SER H H 3 8.490 7.956 0.534 1
1 12 . 20 1 1 A 3 3 SER HA H 3 4.496 4.363 0.133 1
1 14 . 20 1 1 A 3 3 SER C C 3 175.043 173.699 1.344 1
1 15 . 20 1 1 A 3 3 SER CA C 3 58.549 57.803 0.746 1
1 16 . 20 1 1 A 3 3 SER CB C 3 63.687 62.858 0.829 1
1 17 . 20 1 1 A 3 3 SER N N 3 117.930 116.400 1.530 1
1 18 . 20 1 1 A 4 4 GLY H H 4 8.482 8.461 0.021 1
1 19 . 20 1 1 A 4 4 GLY C C 4 174.344 173.020 1.324 1
1 20 . 20 1 1 A 4 4 GLY CA C 4 45.536 44.618 0.918 1
1 21 . 20 1 1 A 4 4 GLY N N 4 110.985 115.092 -4.107 1
1 22 . 20 1 1 A 6 6 SER HA H 6 4.508 4.959 -0.451 1
1 24 . 20 1 1 A 6 6 SER C C 6 175.026 174.487 0.539 1
1 25 . 20 1 1 A 6 6 SER CA C 6 58.584 57.695 0.889 1
1 26 . 20 1 1 A 6 6 SER CB C 6 63.646 63.881 -0.235 1
1 27 . 20 1 1 A 7 7 GLY H H 7 8.419 8.943 -0.524 1
1 28 . 20 1 1 A 7 7 GLY HA2 H 7 3.993 4.159 -0.166 1
1 29 . 20 1 1 A 7 7 GLY C C 7 173.995 174.785 -0.790 1
1 30 . 20 1 1 A 7 7 GLY CA C 7 45.466 44.938 0.528 1
1 31 . 20 1 1 A 7 7 GLY N N 7 110.615 113.856 -3.241 1
1 32 . 20 1 1 A 8 8 ASN H H 8 8.322 8.696 -0.374 1
1 33 . 20 1 1 A 8 8 ASN HA H 8 4.736 4.742 -0.006 1
1 38 . 20 1 1 A 8 8 ASN C C 8 174.907 174.945 -0.038 1
1 39 . 20 1 1 A 8 8 ASN CA C 8 53.259 55.352 -2.093 1
1 40 . 20 1 1 A 8 8 ASN CB C 8 39.127 39.258 -0.131 1
1 41 . 20 1 1 A 8 8 ASN N N 8 118.602 121.123 -2.521 1
1 43 . 20 1 1 A 9 9 ASP H H 9 8.370 7.919 0.451 1
1 44 . 20 1 1 A 9 9 ASP HA H 9 4.594 5.091 -0.497 1
1 47 . 20 1 1 A 9 9 ASP C C 9 175.765 174.521 1.244 1
1 48 . 20 1 1 A 9 9 ASP CA C 9 54.440 52.848 1.592 1
1 49 . 20 1 1 A 9 9 ASP CB C 9 40.898 44.437 -3.539 1
1 50 . 20 1 1 A 9 9 ASP N N 9 120.504 117.665 2.839 1
1 51 . 20 1 1 A 10 10 ASN H H 10 8.382 9.100 -0.718 1
1 52 . 20 1 1 A 10 10 ASN HA H 10 4.691 5.433 -0.742 1
1 57 . 20 1 1 A 10 10 ASN C C 10 174.383 173.744 0.639 1
1 58 . 20 1 1 A 10 10 ASN CA C 10 53.241 52.116 1.125 1
1 59 . 20 1 1 A 10 10 ASN CB C 10 38.674 40.431 -1.757 1
1 60 . 20 1 1 A 10 10 ASN N N 10 119.406 121.967 -2.561 1
1 62 . 20 1 1 A 11 11 ARG H H 11 7.942 8.781 -0.839 1
1 63 . 20 1 1 A 11 11 ARG HA H 11 4.684 4.933 -0.249 1
1 70 . 20 1 1 A 11 11 ARG C C 11 173.640 174.032 -0.392 1
1 71 . 20 1 1 A 11 11 ARG CA C 11 54.246 53.925 0.321 1
1 72 . 20 1 1 A 11 11 ARG CB C 11 30.337 33.509 -3.172 1
1 75 . 20 1 1 A 11 11 ARG N N 11 121.145 121.186 -0.041 1
1 76 . 20 1 1 A 12 12 PRO HA H 12 4.507 4.520 -0.013 1
1 83 . 20 1 1 A 12 12 PRO CA C 12 62.714 62.448 0.266 1
1 84 . 20 1 1 A 12 12 PRO CB C 12 31.942 33.033 -1.091 1
1 87 . 20 1 1 A 13 13 VAL H H 13 8.252 8.443 -0.191 1
1 88 . 20 1 1 A 13 13 VAL HA H 13 4.159 4.605 -0.446 1
1 96 . 20 1 1 A 13 13 VAL CA C 13 61.409 60.228 1.181 1
1 97 . 20 1 1 A 13 13 VAL CB C 13 34.858 34.777 0.081 1
1 100 . 20 1 1 A 13 13 VAL N N 13 118.395 120.892 -2.497 1
1 101 . 20 1 1 A 14 14 PHE H H 14 8.725 8.723 0.002 1
1 102 . 20 1 1 A 14 14 PHE HA H 14 4.781 4.855 -0.074 1
1 110 . 20 1 1 A 14 14 PHE CA C 14 58.594 57.721 0.873 1
1 111 . 20 1 1 A 14 14 PHE CB C 14 39.594 41.091 -1.497 1
1 117 . 20 1 1 A 14 14 PHE N N 14 122.950 125.033 -2.083 1
1 118 . 20 1 1 A 15 15 LYS H H 15 8.885 9.006 -0.121 1
1 119 . 20 1 1 A 15 15 LYS HA H 15 4.130 4.185 -0.055 1
1 128 . 20 1 1 A 15 15 LYS C C 15 177.027 176.219 0.808 1
1 129 . 20 1 1 A 15 15 LYS CA C 15 58.478 58.883 -0.405 1
1 130 . 20 1 1 A 15 15 LYS CB C 15 32.748 33.343 -0.595 1
1 134 . 20 1 1 A 15 15 LYS N N 15 123.863 122.240 1.623 1
1 135 . 20 1 1 A 16 16 GLU H H 16 8.091 7.995 0.096 1
1 136 . 20 1 1 A 16 16 GLU HA H 16 4.438 4.604 -0.166 1
1 141 . 20 1 1 A 16 16 GLU C C 16 175.947 177.184 -1.237 1
1 142 . 20 1 1 A 16 16 GLU CA C 16 56.045 55.186 0.859 1
1 143 . 20 1 1 A 16 16 GLU CB C 16 30.766 32.160 -1.394 1
1 145 . 20 1 1 A 16 16 GLU N N 16 117.026 117.368 -0.342 1
1 146 . 20 1 1 A 17 17 GLY H H 17 8.421 8.763 -0.342 1
1 147 . 20 1 1 A 17 17 GLY HA2 H 17 3.993 3.903 0.090 1
1 148 . 20 1 1 A 17 17 GLY HA3 H 17 3.913 3.920 -0.007 1
1 149 . 20 1 1 A 17 17 GLY C C 17 173.564 174.429 -0.865 1
1 150 . 20 1 1 A 17 17 GLY CA C 17 45.448 47.842 -2.394 1
1 151 . 20 1 1 A 17 17 GLY N N 17 109.577 111.883 -2.306 1
1 152 . 20 1 1 A 18 18 GLN H H 18 7.858 7.978 -0.120 1
1 153 . 20 1 1 A 18 18 GLN HA H 18 5.065 5.232 -0.167 1
1 160 . 20 1 1 A 18 18 GLN C C 18 174.596 174.579 0.017 1
1 161 . 20 1 1 A 18 18 GLN CA C 18 55.110 54.383 0.727 1
1 162 . 20 1 1 A 18 18 GLN CB C 18 30.329 31.244 -0.915 1
1 164 . 20 1 1 A 18 18 GLN N N 18 120.202 117.603 2.599 1
1 166 . 20 1 1 A 19 19 VAL H H 19 8.216 8.853 -0.637 1
1 167 . 20 1 1 A 19 19 VAL HA H 19 4.450 4.642 -0.192 1
1 175 . 20 1 1 A 19 19 VAL C C 19 173.648 173.530 0.118 1
1 176 . 20 1 1 A 19 19 VAL CA C 19 60.788 60.739 0.049 1
1 177 . 20 1 1 A 19 19 VAL CB C 19 35.336 35.144 0.192 1
1 180 . 20 1 1 A 19 19 VAL N N 19 121.257 123.166 -1.909 1
1 181 . 20 1 1 A 20 20 GLU H H 20 8.610 9.040 -0.430 1
1 182 . 20 1 1 A 20 20 GLU HA H 20 5.211 5.281 -0.070 1
1 187 . 20 1 1 A 20 20 GLU C C 20 174.783 175.791 -1.008 1
1 188 . 20 1 1 A 20 20 GLU CA C 20 54.793 55.559 -0.766 1
1 189 . 20 1 1 A 20 20 GLU CB C 20 32.058 31.487 0.571 1
1 191 . 20 1 1 A 20 20 GLU N N 20 127.095 128.334 -1.239 1
1 192 . 20 1 1 A 21 21 VAL H H 21 8.727 8.541 0.186 1
1 193 . 20 1 1 A 21 21 VAL HA H 21 4.633 4.971 -0.338 1
1 201 . 20 1 1 A 21 21 VAL C C 21 173.894 174.023 -0.129 1
1 202 . 20 1 1 A 21 21 VAL CA C 21 59.695 59.276 0.419 1
1 203 . 20 1 1 A 21 21 VAL CB C 21 35.865 36.287 -0.422 1
1 206 . 20 1 1 A 21 21 VAL N N 21 120.489 118.973 1.516 1
1 207 . 20 1 1 A 22 22 HIS H H 22 8.680 8.990 -0.310 1
1 208 . 20 1 1 A 22 22 HIS HA H 22 5.552 5.686 -0.134 1
1 212 . 20 1 1 A 22 22 HIS C C 22 174.298 173.183 1.115 1
1 213 . 20 1 1 A 22 22 HIS CA C 22 55.331 53.638 1.693 1
1 214 . 20 1 1 A 22 22 HIS CB C 22 32.369 32.627 -0.258 1
1 216 . 20 1 1 A 22 22 HIS N N 22 124.991 118.712 6.279 1
1 217 . 20 1 1 A 23 23 ILE H H 23 9.179 8.435 0.744 1
1 218 . 20 1 1 A 23 23 ILE HA H 23 5.046 4.455 0.591 1
1 228 . 20 1 1 A 23 23 ILE C C 23 171.552 173.608 -2.056 1
1 229 . 20 1 1 A 23 23 ILE CA C 23 55.551 57.200 -1.649 1
1 230 . 20 1 1 A 23 23 ILE CB C 23 42.053 42.044 0.009 1
1 234 . 20 1 1 A 23 23 ILE N N 23 123.121 123.023 0.098 1
1 235 . 20 1 1 A 24 24 PRO HA H 24 4.816 4.745 0.071 1
1 242 . 20 1 1 A 24 24 PRO C C 24 178.887 177.541 1.346 1
1 243 . 20 1 1 A 24 24 PRO CA C 24 62.216 62.559 -0.343 1
1 244 . 20 1 1 A 24 24 PRO CB C 24 32.895 32.854 0.041 1
1 247 . 20 1 1 A 25 25 GLU H H 25 8.399 8.356 0.043 1
1 248 . 20 1 1 A 25 25 GLU HA H 25 3.785 4.017 -0.232 1
1 253 . 20 1 1 A 25 25 GLU C C 25 175.244 177.165 -1.921 1
1 254 . 20 1 1 A 25 25 GLU CA C 25 58.425 59.088 -0.663 1
1 255 . 20 1 1 A 25 25 GLU CB C 25 30.011 28.899 1.112 1
1 257 . 20 1 1 A 25 25 GLU N N 25 117.706 121.799 -4.093 1
1 258 . 20 1 1 A 26 26 ASN H H 26 7.488 7.759 -0.271 1
1 259 . 20 1 1 A 26 26 ASN HA H 26 4.702 4.779 -0.077 1
1 264 . 20 1 1 A 26 26 ASN C C 26 175.425 175.315 0.110 1
1 265 . 20 1 1 A 26 26 ASN CA C 26 51.584 52.136 -0.552 1
1 266 . 20 1 1 A 26 26 ASN CB C 26 37.243 38.606 -1.363 1
1 267 . 20 1 1 A 26 26 ASN N N 26 112.383 117.587 -5.204 1
1 269 . 20 1 1 A 27 27 ALA H H 27 7.716 6.951 0.765 1
1 270 . 20 1 1 A 27 27 ALA HA H 27 4.409 4.312 0.097 1
1 274 . 20 1 1 A 27 27 ALA C C 27 175.850 175.875 -0.025 1
1 275 . 20 1 1 A 27 27 ALA CA C 27 51.037 50.958 0.079 1
1 276 . 20 1 1 A 27 27 ALA CB C 27 18.152 18.399 -0.247 1
1 277 . 20 1 1 A 27 27 ALA N N 27 125.139 122.501 2.638 1
1 278 . 20 1 1 A 28 28 PRO HA H 28 4.422 4.536 -0.114 1
1 285 . 20 1 1 A 28 28 PRO C C 28 178.442 177.160 1.282 1
1 286 . 20 1 1 A 28 28 PRO CA C 28 62.067 62.832 -0.765 1
1 287 . 20 1 1 A 28 28 PRO CB C 28 32.642 32.319 0.323 1
1 290 . 20 1 1 A 29 29 VAL H H 29 8.691 8.341 0.350 1
1 291 . 20 1 1 A 29 29 VAL HA H 29 3.239 3.569 -0.330 1
1 299 . 20 1 1 A 29 29 VAL C C 29 176.887 177.216 -0.329 1
1 300 . 20 1 1 A 29 29 VAL CA C 29 65.812 64.218 1.594 1
1 301 . 20 1 1 A 29 29 VAL CB C 29 31.174 31.483 -0.309 1
1 304 . 20 1 1 A 29 29 VAL N N 29 123.592 122.641 0.951 1
1 305 . 20 1 1 A 30 30 GLY H H 30 9.197 8.723 0.474 1
1 306 . 20 1 1 A 30 30 GLY HA2 H 30 4.486 3.970 0.516 1
1 307 . 20 1 1 A 30 30 GLY HA3 H 30 3.581 3.971 -0.390 1
1 308 . 20 1 1 A 30 30 GLY C C 30 174.347 174.700 -0.353 1
1 309 . 20 1 1 A 30 30 GLY CA C 30 44.320 44.794 -0.474 1
1 310 . 20 1 1 A 30 30 GLY N N 30 116.042 115.692 0.350 1
1 311 . 20 1 1 A 31 31 THR H H 31 7.838 7.205 0.633 1
1 312 . 20 1 1 A 31 31 THR HA H 31 3.959 4.158 -0.199 1
1 317 . 20 1 1 A 31 31 THR C C 31 174.274 174.193 0.081 1
1 318 . 20 1 1 A 31 31 THR CA C 31 65.160 63.134 2.026 1
1 319 . 20 1 1 A 31 31 THR CB C 31 69.972 69.290 0.682 1
1 321 . 20 1 1 A 31 31 THR N N 31 117.679 117.322 0.357 1
1 322 . 20 1 1 A 32 32 SER H H 32 9.022 8.645 0.377 1
1 323 . 20 1 1 A 32 32 SER HA H 32 4.273 4.661 -0.388 1
1 326 . 20 1 1 A 32 32 SER C C 32 172.692 174.340 -1.648 1
1 327 . 20 1 1 A 32 32 SER CA C 32 59.642 57.830 1.812 1
1 328 . 20 1 1 A 32 32 SER CB C 32 63.102 63.152 -0.050 1
1 329 . 20 1 1 A 32 32 SER N N 32 123.045 119.944 3.101 1
1 330 . 20 1 1 A 33 33 VAL H H 33 9.202 8.525 0.677 1
1 331 . 20 1 1 A 33 33 VAL HA H 33 3.844 4.035 -0.191 1
1 339 . 20 1 1 A 33 33 VAL C C 33 174.782 175.737 -0.955 1
1 340 . 20 1 1 A 33 33 VAL CA C 33 64.242 63.962 0.280 1
1 341 . 20 1 1 A 33 33 VAL CB C 33 32.893 32.241 0.652 1
1 344 . 20 1 1 A 33 33 VAL N N 33 126.861 124.937 1.924 1
1 345 . 20 1 1 A 34 34 ILE H H 34 7.074 7.454 -0.380 1
1 346 . 20 1 1 A 34 34 ILE HA H 34 4.295 4.665 -0.370 1
1 356 . 20 1 1 A 34 34 ILE C C 34 170.577 172.941 -2.364 1
1 357 . 20 1 1 A 34 34 ILE CA C 34 59.500 59.291 0.209 1
1 358 . 20 1 1 A 34 34 ILE CB C 34 39.251 41.929 -2.678 1
1 362 . 20 1 1 A 34 34 ILE N N 34 111.445 119.236 -7.791 1
1 363 . 20 1 1 A 35 35 GLN H H 35 8.450 9.111 -0.661 1
1 364 . 20 1 1 A 35 35 GLN HA H 35 4.633 4.857 -0.224 1
1 371 . 20 1 1 A 35 35 GLN C C 35 174.354 174.210 0.144 1
1 372 . 20 1 1 A 35 35 GLN CA C 35 54.176 54.299 -0.123 1
1 373 . 20 1 1 A 35 35 GLN CB C 35 29.456 30.943 -1.487 1
1 375 . 20 1 1 A 35 35 GLN N N 35 127.342 129.380 -2.038 1
1 377 . 20 1 1 A 36 36 LEU H H 36 7.761 8.567 -0.806 1
1 378 . 20 1 1 A 36 36 LEU HA H 36 4.492 5.087 -0.595 1
1 388 . 20 1 1 A 36 36 LEU C C 36 175.543 175.458 0.085 1
1 389 . 20 1 1 A 36 36 LEU CA C 36 53.982 53.618 0.364 1
1 390 . 20 1 1 A 36 36 LEU CB C 36 42.776 42.941 -0.165 1
1 394 . 20 1 1 A 36 36 LEU N N 36 128.895 128.695 0.200 1
1 395 . 20 1 1 A 37 37 HIS H H 37 8.529 9.003 -0.474 1
1 396 . 20 1 1 A 37 37 HIS HA H 37 4.851 5.556 -0.705 1
1 400 . 20 1 1 A 37 37 HIS C C 37 172.985 173.554 -0.569 1
1 401 . 20 1 1 A 37 37 HIS CA C 37 55.833 53.302 2.531 1
1 402 . 20 1 1 A 37 37 HIS CB C 37 32.204 32.394 -0.190 1
1 404 . 20 1 1 A 37 37 HIS N N 37 115.903 124.695 -8.792 1
1 405 . 20 1 1 A 38 38 ALA H H 38 8.474 8.681 -0.207 1
1 406 . 20 1 1 A 38 38 ALA HA H 38 4.691 5.150 -0.459 1
1 410 . 20 1 1 A 38 38 ALA C C 38 175.548 175.737 -0.189 1
1 411 . 20 1 1 A 38 38 ALA CA C 38 50.491 50.810 -0.319 1
1 412 . 20 1 1 A 38 38 ALA CB C 38 19.842 20.573 -0.731 1
1 413 . 20 1 1 A 38 38 ALA N N 38 128.891 130.742 -1.851 1
1 414 . 20 1 1 A 39 39 THR H H 39 8.095 8.838 -0.743 1
1 415 . 20 1 1 A 39 39 THR HA H 39 4.336 5.045 -0.709 1
1 420 . 20 1 1 A 39 39 THR C C 39 173.553 172.040 1.513 1
1 421 . 20 1 1 A 39 39 THR CA C 39 60.417 59.701 0.716 1
1 422 . 20 1 1 A 39 39 THR CB C 39 70.912 71.894 -0.982 1
1 424 . 20 1 1 A 39 39 THR N N 39 110.982 113.642 -2.660 1
1 425 . 20 1 1 A 40 40 ASP H H 40 8.417 8.855 -0.438 1
1 426 . 20 1 1 A 40 40 ASP HA H 40 4.553 5.273 -0.720 1
1 429 . 20 1 1 A 40 40 ASP C C 40 176.462 175.489 0.973 1
1 430 . 20 1 1 A 40 40 ASP CA C 40 54.158 52.285 1.873 1
1 431 . 20 1 1 A 40 40 ASP CB C 40 41.517 44.060 -2.543 1
1 432 . 20 1 1 A 40 40 ASP N N 40 121.450 122.539 -1.089 1
1 433 . 20 1 1 A 41 41 ALA H H 41 8.435 8.510 -0.075 1
1 434 . 20 1 1 A 41 41 ALA HA H 41 4.129 4.212 -0.083 1
1 438 . 20 1 1 A 41 41 ALA C C 41 177.718 176.853 0.865 1
1 439 . 20 1 1 A 41 41 ALA CA C 41 53.436 52.720 0.716 1
1 440 . 20 1 1 A 41 41 ALA CB C 41 19.183 19.350 -0.167 1
1 441 . 20 1 1 A 41 41 ALA N N 41 124.607 126.822 -2.215 1
1 442 . 20 1 1 A 42 42 ASP H H 42 8.310 8.653 -0.343 1
1 443 . 20 1 1 A 42 42 ASP HA H 42 4.588 4.710 -0.122 1
1 446 . 20 1 1 A 42 42 ASP C C 42 176.546 175.312 1.234 1
1 447 . 20 1 1 A 42 42 ASP CA C 42 54.599 53.690 0.909 1
1 448 . 20 1 1 A 42 42 ASP CB C 42 41.146 39.006 2.140 1
1 449 . 20 1 1 A 42 42 ASP N N 42 118.030 123.377 -5.347 1
1 450 . 20 1 1 A 43 43 ILE H H 43 8.000 8.574 -0.574 1
1 451 . 20 1 1 A 43 43 ILE HA H 43 4.130 4.518 -0.388 1
1 461 . 20 1 1 A 43 43 ILE C C 43 176.901 176.610 0.291 1
1 462 . 20 1 1 A 43 43 ILE CA C 43 61.740 60.306 1.434 1
1 463 . 20 1 1 A 43 43 ILE CB C 43 38.491 38.882 -0.391 1
1 467 . 20 1 1 A 43 43 ILE N N 43 119.301 120.330 -1.029 1
1 468 . 20 1 1 A 44 44 GLY H H 44 8.448 8.723 -0.275 1
1 469 . 20 1 1 A 44 44 GLY HA2 H 44 3.939 3.973 -0.034 1
1 470 . 20 1 1 A 44 44 GLY HA3 H 44 3.939 3.974 -0.035 1
1 471 . 20 1 1 A 44 44 GLY C C 44 174.393 173.648 0.745 1
1 472 . 20 1 1 A 44 44 GLY CA C 44 45.501 45.822 -0.321 1
1 473 . 20 1 1 A 44 44 GLY N N 44 111.333 116.142 -4.809 1
1 474 . 20 1 1 A 45 45 SER H H 45 8.061 7.843 0.218 1
1 475 . 20 1 1 A 45 45 SER HA H 45 4.416 5.104 -0.688 1
1 478 . 20 1 1 A 45 45 SER C C 45 174.480 173.578 0.902 1
1 479 . 20 1 1 A 45 45 SER CA C 45 58.478 55.747 2.731 1
1 480 . 20 1 1 A 45 45 SER CB C 45 63.943 66.740 -2.797 1
1 481 . 20 1 1 A 45 45 SER N N 45 115.551 113.923 1.628 1
1 482 . 20 1 1 A 46 46 ASN H H 46 8.547 8.449 0.098 1
1 483 . 20 1 1 A 46 46 ASN HA H 46 4.725 4.986 -0.261 1
1 488 . 20 1 1 A 46 46 ASN C C 46 175.031 175.293 -0.262 1
1 489 . 20 1 1 A 46 46 ASN CA C 46 53.277 52.898 0.379 1
1 490 . 20 1 1 A 46 46 ASN CB C 46 38.798 38.777 0.021 1
1 491 . 20 1 1 A 46 46 ASN N N 46 120.698 119.186 1.512 1
1 493 . 20 1 1 A 47 47 ALA H H 47 8.239 8.429 -0.190 1
1 494 . 20 1 1 A 47 47 ALA HA H 47 4.283 5.165 -0.882 1
1 498 . 20 1 1 A 47 47 ALA C C 47 177.240 175.833 1.407 1
1 499 . 20 1 1 A 47 47 ALA CA C 47 52.731 50.448 2.283 1
1 500 . 20 1 1 A 47 47 ALA CB C 47 19.594 20.928 -1.334 1
1 501 . 20 1 1 A 47 47 ALA N N 47 124.093 122.751 1.342 1
1 502 . 20 1 1 A 48 48 GLU H H 48 8.376 8.819 -0.443 1
1 503 . 20 1 1 A 48 48 GLU HA H 48 4.264 4.493 -0.229 1
1 508 . 20 1 1 A 48 48 GLU C C 48 175.702 175.299 0.403 1
1 509 . 20 1 1 A 48 48 GLU CA C 48 55.992 55.471 0.521 1
1 510 . 20 1 1 A 48 48 GLU CB C 48 30.210 29.191 1.019 1
1 512 . 20 1 1 A 48 48 GLU N N 48 119.750 123.128 -3.378 1
1 513 . 20 1 1 A 49 49 ILE H H 49 7.806 7.732 0.074 1
1 514 . 20 1 1 A 49 49 ILE HA H 49 3.919 3.987 -0.068 1
1 524 . 20 1 1 A 49 49 ILE C C 49 175.894 175.145 0.749 1
1 525 . 20 1 1 A 49 49 ILE CA C 49 60.559 61.693 -1.134 1
1 526 . 20 1 1 A 49 49 ILE CB C 49 37.860 37.517 0.343 1
1 530 . 20 1 1 A 49 49 ILE N N 49 122.772 125.083 -2.311 1
1 531 . 20 1 1 A 50 50 ARG H H 50 8.247 8.579 -0.332 1
1 532 . 20 1 1 A 50 50 ARG HA H 50 4.999 4.997 0.002 1
1 539 . 20 1 1 A 50 50 ARG C C 50 174.603 174.739 -0.136 1
1 540 . 20 1 1 A 50 50 ARG CA C 50 53.189 54.618 -1.429 1
1 541 . 20 1 1 A 50 50 ARG CB C 50 33.152 32.051 1.101 1
1 544 . 20 1 1 A 50 50 ARG N N 50 126.912 127.728 -0.816 1
1 545 . 20 1 1 A 51 51 TYR H H 51 9.041 8.858 0.183 1
1 546 . 20 1 1 A 51 51 TYR HA H 51 5.395 5.005 0.390 1
1 553 . 20 1 1 A 51 51 TYR C C 51 175.555 176.116 -0.561 1
1 554 . 20 1 1 A 51 51 TYR CA C 51 56.909 58.280 -1.371 1
1 555 . 20 1 1 A 51 51 TYR CB C 51 40.116 40.162 -0.046 1
1 560 . 20 1 1 A 51 51 TYR N N 51 121.627 123.425 -1.798 1
1 561 . 20 1 1 A 52 52 ILE H H 52 8.850 8.361 0.489 1
1 562 . 20 1 1 A 52 52 ILE HA H 52 4.576 4.939 -0.363 1
1 572 . 20 1 1 A 52 52 ILE C C 52 175.371 174.819 0.552 1
1 573 . 20 1 1 A 52 52 ILE CA C 52 59.624 59.476 0.148 1
1 574 . 20 1 1 A 52 52 ILE CB C 52 42.895 42.016 0.879 1
1 578 . 20 1 1 A 52 52 ILE N N 52 117.697 118.201 -0.504 1
1 579 . 20 1 1 A 53 53 PHE H H 53 8.748 8.985 -0.237 1
1 580 . 20 1 1 A 53 53 PHE HA H 53 5.132 4.650 0.482 1
1 588 . 20 1 1 A 53 53 PHE C C 53 178.146 176.158 1.988 1
1 589 . 20 1 1 A 53 53 PHE CA C 53 57.667 58.145 -0.478 1
1 590 . 20 1 1 A 53 53 PHE CB C 53 39.614 38.850 0.764 1
1 596 . 20 1 1 A 53 53 PHE N N 53 121.433 122.973 -1.540 1
1 597 . 20 1 1 A 54 54 GLY H H 54 8.538 8.562 -0.024 1
1 598 . 20 1 1 A 54 54 GLY HA2 H 54 4.074 4.125 -0.051 1
1 599 . 20 1 1 A 54 54 GLY HA3 H 54 3.840 4.128 -0.288 1
1 600 . 20 1 1 A 54 54 GLY C C 54 174.530 173.022 1.508 1
1 601 . 20 1 1 A 54 54 GLY CA C 54 44.884 44.717 0.167 1
1 602 . 20 1 1 A 54 54 GLY N N 54 106.444 111.272 -4.828 1
1 603 . 20 1 1 A 55 55 ALA H H 55 8.594 8.371 0.223 1
1 604 . 20 1 1 A 55 55 ALA HA H 55 4.172 4.362 -0.190 1
1 608 . 20 1 1 A 55 55 ALA C C 55 178.718 177.656 1.062 1
1 609 . 20 1 1 A 55 55 ALA CA C 55 54.423 51.514 2.909 1
1 610 . 20 1 1 A 55 55 ALA CB C 55 19.059 19.974 -0.915 1
1 611 . 20 1 1 A 55 55 ALA N N 55 123.470 121.809 1.661 1
1 612 . 20 1 1 A 56 56 GLN H H 56 8.727 8.777 -0.050 1
1 613 . 20 1 1 A 56 56 GLN HA H 56 4.367 3.793 0.574 1
1 620 . 20 1 1 A 56 56 GLN C C 56 176.134 174.536 1.598 1
1 621 . 20 1 1 A 56 56 GLN CA C 56 55.660 56.843 -1.183 1
1 622 . 20 1 1 A 56 56 GLN CB C 56 28.152 26.754 1.398 1
1 624 . 20 1 1 A 56 56 GLN N N 56 114.221 115.822 -1.601 1
1 626 . 20 1 1 A 57 57 VAL H H 57 7.204 7.676 -0.472 1
1 627 . 20 1 1 A 57 57 VAL HA H 57 3.889 4.434 -0.545 1
1 635 . 20 1 1 A 57 57 VAL C C 57 175.371 175.336 0.035 1
1 636 . 20 1 1 A 57 57 VAL CA C 57 63.908 60.765 3.143 1
1 637 . 20 1 1 A 57 57 VAL CB C 57 31.557 33.863 -2.306 1
1 640 . 20 1 1 A 57 57 VAL N N 57 121.341 119.143 2.198 1
1 641 . 20 1 1 A 58 58 ALA H H 58 8.920 8.586 0.334 1
1 642 . 20 1 1 A 58 58 ALA HA H 58 4.547 4.463 0.084 1
1 646 . 20 1 1 A 58 58 ALA C C 58 177.064 177.749 -0.685 1
1 647 . 20 1 1 A 58 58 ALA CA C 58 51.173 50.711 0.462 1
1 648 . 20 1 1 A 58 58 ALA CB C 58 17.842 17.842 0.000 1
1 649 . 20 1 1 A 58 58 ALA N N 58 132.726 130.537 2.189 1
1 650 . 20 1 1 A 59 59 PRO HA H 59 4.101 4.217 -0.116 1
1 657 . 20 1 1 A 59 59 PRO C C 59 179.482 178.775 0.707 1
1 658 . 20 1 1 A 59 59 PRO CA C 59 66.060 65.798 0.262 1
1 659 . 20 1 1 A 59 59 PRO CB C 59 31.951 31.647 0.304 1
1 662 . 20 1 1 A 60 60 ALA H H 60 8.706 8.219 0.487 1
1 663 . 20 1 1 A 60 60 ALA HA H 60 4.057 4.010 0.047 1
1 667 . 20 1 1 A 60 60 ALA C C 60 179.627 180.166 -0.539 1
1 668 . 20 1 1 A 60 60 ALA CA C 60 55.305 55.432 -0.127 1
1 669 . 20 1 1 A 60 60 ALA CB C 60 18.737 18.666 0.071 1
1 670 . 20 1 1 A 60 60 ALA N N 60 117.882 118.405 -0.523 1
1 671 . 20 1 1 A 61 61 THR H H 61 7.312 8.324 -1.012 1
1 672 . 20 1 1 A 61 61 THR HA H 61 4.153 3.955 0.198 1
1 677 . 20 1 1 A 61 61 THR C C 61 175.824 176.693 -0.869 1
1 678 . 20 1 1 A 61 61 THR CA C 61 66.412 67.076 -0.664 1
1 679 . 20 1 1 A 61 61 THR CB C 61 68.787 69.087 -0.300 1
1 681 . 20 1 1 A 61 61 THR N N 61 114.483 114.117 0.366 1
1 682 . 20 1 1 A 62 62 LYS H H 62 7.556 8.010 -0.454 1
1 683 . 20 1 1 A 62 62 LYS HA H 62 3.943 4.273 -0.330 1
1 692 . 20 1 1 A 62 62 LYS C C 62 176.884 178.743 -1.859 1
1 693 . 20 1 1 A 62 62 LYS CA C 62 59.095 59.464 -0.369 1
1 694 . 20 1 1 A 62 62 LYS CB C 62 32.204 32.038 0.166 1
1 698 . 20 1 1 A 62 62 LYS N N 62 118.994 119.464 -0.470 1
1 699 . 20 1 1 A 63 63 ARG H H 63 7.474 7.983 -0.509 1
1 700 . 20 1 1 A 63 63 ARG HA H 63 4.034 4.048 -0.014 1
1 707 . 20 1 1 A 63 63 ARG C C 63 177.574 178.412 -0.838 1
1 708 . 20 1 1 A 63 63 ARG CA C 63 58.143 58.785 -0.642 1
1 709 . 20 1 1 A 63 63 ARG CB C 63 30.755 29.946 0.809 1
1 712 . 20 1 1 A 63 63 ARG N N 63 114.251 120.199 -5.948 1
1 713 . 20 1 1 A 64 64 LEU H H 64 6.991 7.442 -0.451 1
1 714 . 20 1 1 A 64 64 LEU HA H 64 3.904 4.081 -0.177 1
1 724 . 20 1 1 A 64 64 LEU C C 64 176.632 176.444 0.188 1
1 725 . 20 1 1 A 64 64 LEU CA C 64 56.503 56.912 -0.409 1
1 726 . 20 1 1 A 64 64 LEU CB C 64 42.929 42.880 0.049 1
1 730 . 20 1 1 A 64 64 LEU N N 64 116.109 118.502 -2.393 1
1 731 . 20 1 1 A 65 65 PHE H H 65 7.673 8.321 -0.648 1
1 732 . 20 1 1 A 65 65 PHE HA H 65 5.386 4.837 0.549 1
1 740 . 20 1 1 A 65 65 PHE C C 65 173.067 174.737 -1.670 1
1 741 . 20 1 1 A 65 65 PHE CA C 65 56.521 57.593 -1.072 1
1 742 . 20 1 1 A 65 65 PHE CB C 65 41.270 40.137 1.133 1
1 748 . 20 1 1 A 65 65 PHE N N 65 116.182 115.664 0.518 1
1 749 . 20 1 1 A 66 66 ALA H H 66 8.914 8.705 0.209 1
1 750 . 20 1 1 A 66 66 ALA HA H 66 4.748 5.237 -0.489 1
1 754 . 20 1 1 A 66 66 ALA C C 66 175.223 175.694 -0.471 1
1 755 . 20 1 1 A 66 66 ALA CA C 66 50.050 50.401 -0.351 1
1 756 . 20 1 1 A 66 66 ALA CB C 66 21.161 20.607 0.554 1
1 757 . 20 1 1 A 66 66 ALA N N 66 122.870 126.673 -3.803 1
1 758 . 20 1 1 A 67 67 LEU H H 67 8.498 8.995 -0.497 1
1 759 . 20 1 1 A 67 67 LEU HA H 67 4.713 4.857 -0.144 1
1 769 . 20 1 1 A 67 67 LEU C C 67 175.146 174.638 0.508 1
1 770 . 20 1 1 A 67 67 LEU CA C 67 52.518 53.851 -1.333 1
1 771 . 20 1 1 A 67 67 LEU CB C 67 45.308 44.228 1.080 1
1 775 . 20 1 1 A 67 67 LEU N N 67 122.208 125.850 -3.642 1
1 776 . 20 1 1 A 68 68 ASN H H 68 8.357 8.819 -0.462 1
1 777 . 20 1 1 A 68 68 ASN HA H 68 4.679 5.134 -0.455 1
1 782 . 20 1 1 A 68 68 ASN C C 68 176.228 175.076 1.152 1
1 783 . 20 1 1 A 68 68 ASN CA C 68 53.524 52.331 1.193 1
1 784 . 20 1 1 A 68 68 ASN CB C 68 39.580 40.351 -0.771 1
1 785 . 20 1 1 A 68 68 ASN N N 68 126.940 123.984 2.956 1
1 787 . 20 1 1 A 69 69 ASN H H 69 8.861 9.140 -0.279 1
1 788 . 20 1 1 A 69 69 ASN HA H 69 5.137 5.162 -0.025 1
1 793 . 20 1 1 A 69 69 ASN C C 69 175.631 176.514 -0.883 1
1 794 . 20 1 1 A 69 69 ASN CA C 69 56.009 53.995 2.014 1
1 795 . 20 1 1 A 69 69 ASN CB C 69 40.314 39.033 1.281 1
1 796 . 20 1 1 A 69 69 ASN N N 69 124.980 123.082 1.898 1
1 798 . 20 1 1 A 70 70 THR H H 70 8.635 7.889 0.746 1
1 799 . 20 1 1 A 70 70 THR HA H 70 4.815 4.625 0.190 1
1 804 . 20 1 1 A 70 70 THR C C 70 176.223 175.645 0.578 1
1 805 . 20 1 1 A 70 70 THR CA C 70 63.944 62.490 1.454 1
1 806 . 20 1 1 A 70 70 THR CB C 70 69.727 70.276 -0.549 1
1 808 . 20 1 1 A 70 70 THR N N 70 110.394 109.374 1.020 1
1 809 . 20 1 1 A 71 71 THR H H 71 8.069 7.914 0.155 1
1 810 . 20 1 1 A 71 71 THR HA H 71 4.566 4.599 -0.033 1
1 815 . 20 1 1 A 71 71 THR C C 71 176.213 175.491 0.722 1
1 816 . 20 1 1 A 71 71 THR CA C 71 61.683 62.026 -0.343 1
1 817 . 20 1 1 A 71 71 THR CB C 71 70.832 71.066 -0.234 1
1 819 . 20 1 1 A 71 71 THR N N 71 110.507 110.558 -0.051 1
1 820 . 20 1 1 A 72 72 GLY H H 72 7.990 7.854 0.136 1
1 821 . 20 1 1 A 72 72 GLY HA2 H 72 3.186 2.390 0.796 1
1 822 . 20 1 1 A 72 72 GLY HA3 H 72 2.516 3.174 -0.658 1
1 823 . 20 1 1 A 72 72 GLY C C 72 172.988 174.095 -1.107 1
1 824 . 20 1 1 A 72 72 GLY CA C 72 45.149 45.904 -0.755 1
1 825 . 20 1 1 A 72 72 GLY N N 72 110.788 112.381 -1.593 1
1 826 . 20 1 1 A 73 73 LEU H H 73 7.138 7.582 -0.444 1
1 827 . 20 1 1 A 73 73 LEU HA H 73 4.414 4.612 -0.198 1
1 837 . 20 1 1 A 73 73 LEU C C 73 176.836 174.891 1.945 1
1 838 . 20 1 1 A 73 73 LEU CA C 73 55.252 53.338 1.914 1
1 839 . 20 1 1 A 73 73 LEU CB C 73 43.574 44.693 -1.119 1
1 843 . 20 1 1 A 73 73 LEU N N 73 119.222 121.143 -1.921 1
1 844 . 20 1 1 A 74 74 ILE H H 74 8.925 8.743 0.182 1
1 845 . 20 1 1 A 74 74 ILE HA H 74 5.555 4.536 1.019 1
1 855 . 20 1 1 A 74 74 ILE C C 74 175.978 175.722 0.256 1
1 856 . 20 1 1 A 74 74 ILE CA C 74 60.100 61.352 -1.252 1
1 857 . 20 1 1 A 74 74 ILE CB C 74 38.550 37.781 0.769 1
1 861 . 20 1 1 A 74 74 ILE N N 74 129.871 128.508 1.363 1
1 862 . 20 1 1 A 75 75 THR H H 75 9.161 8.415 0.746 1
1 863 . 20 1 1 A 75 75 THR HA H 75 5.375 5.209 0.166 1
1 868 . 20 1 1 A 75 75 THR C C 75 174.798 173.722 1.076 1
1 869 . 20 1 1 A 75 75 THR CA C 75 58.796 59.708 -0.912 1
1 870 . 20 1 1 A 75 75 THR CB C 75 72.978 71.866 1.112 1
1 872 . 20 1 1 A 75 75 THR N N 75 117.522 118.080 -0.558 1
1 873 . 20 1 1 A 76 76 VAL H H 76 8.327 8.729 -0.402 1
1 874 . 20 1 1 A 76 76 VAL HA H 76 3.973 3.835 0.138 1
1 882 . 20 1 1 A 76 76 VAL C C 76 176.495 175.833 0.662 1
1 883 . 20 1 1 A 76 76 VAL CA C 76 64.085 63.578 0.507 1
1 884 . 20 1 1 A 76 76 VAL CB C 76 32.863 31.610 1.253 1
1 887 . 20 1 1 A 76 76 VAL N N 76 120.876 122.626 -1.750 1
1 888 . 20 1 1 A 77 77 GLN H H 77 9.525 8.910 0.615 1
1 889 . 20 1 1 A 77 77 GLN HA H 77 4.702 4.434 0.268 1
1 896 . 20 1 1 A 77 77 GLN C C 77 173.838 174.928 -1.090 1
1 897 . 20 1 1 A 77 77 GLN CA C 77 55.728 56.621 -0.893 1
1 898 . 20 1 1 A 77 77 GLN CB C 77 30.762 30.766 -0.004 1
1 900 . 20 1 1 A 77 77 GLN N N 77 129.825 128.178 1.647 1
1 902 . 20 1 1 A 78 78 ARG H H 78 7.621 7.381 0.240 1
1 903 . 20 1 1 A 78 78 ARG HA H 78 4.347 4.731 -0.384 1
1 910 . 20 1 1 A 78 78 ARG C C 78 172.304 175.489 -3.185 1
1 911 . 20 1 1 A 78 78 ARG CA C 78 54.634 54.065 0.569 1
1 912 . 20 1 1 A 78 78 ARG CB C 78 34.685 35.218 -0.533 1
1 915 . 20 1 1 A 78 78 ARG N N 78 120.595 117.608 2.987 1
1 916 . 20 1 1 A 79 79 SER H H 79 7.958 8.624 -0.666 1
1 917 . 20 1 1 A 79 79 SER HA H 79 4.030 4.499 -0.469 1
1 920 . 20 1 1 A 79 79 SER C C 79 174.311 174.465 -0.154 1
1 921 . 20 1 1 A 79 79 SER CA C 79 59.889 59.643 0.246 1
1 922 . 20 1 1 A 79 79 SER CB C 79 63.548 63.374 0.174 1
1 923 . 20 1 1 A 79 79 SER N N 79 112.565 118.266 -5.701 1
1 924 . 20 1 1 A 80 80 LEU H H 80 8.715 8.532 0.183 1
1 925 . 20 1 1 A 80 80 LEU HA H 80 4.114 4.243 -0.129 1
1 935 . 20 1 1 A 80 80 LEU C C 80 176.057 176.067 -0.010 1
1 936 . 20 1 1 A 80 80 LEU CA C 80 55.091 55.093 -0.002 1
1 937 . 20 1 1 A 80 80 LEU CB C 80 42.341 42.336 0.005 1
1 941 . 20 1 1 A 80 80 LEU N N 80 123.070 126.017 -2.947 1
1 942 . 20 1 1 A 81 81 ASP H H 81 7.298 8.606 -1.308 1
1 943 . 20 1 1 A 81 81 ASP HA H 81 4.725 5.330 -0.605 1
1 946 . 20 1 1 A 81 81 ASP C C 81 175.939 176.171 -0.232 1
1 947 . 20 1 1 A 81 81 ASP CA C 81 53.664 52.848 0.816 1
1 948 . 20 1 1 A 81 81 ASP CB C 81 42.947 43.411 -0.464 1
1 949 . 20 1 1 A 81 81 ASP N N 81 115.229 122.987 -7.758 1
1 950 . 20 1 1 A 82 82 ARG H H 82 9.289 8.440 0.849 1
1 951 . 20 1 1 A 82 82 ARG HA H 82 4.416 4.176 0.240 1
1 959 . 20 1 1 A 82 82 ARG C C 82 176.406 177.862 -1.456 1
1 960 . 20 1 1 A 82 82 ARG CA C 82 56.397 59.024 -2.627 1
1 961 . 20 1 1 A 82 82 ARG CB C 82 30.638 30.059 0.579 1
1 964 . 20 1 1 A 82 82 ARG N N 82 123.174 125.771 -2.597 1
1 966 . 20 1 1 A 83 83 GLU H H 83 8.468 8.244 0.224 1
1 967 . 20 1 1 A 83 83 GLU HA H 83 3.982 4.108 -0.126 1
1 972 . 20 1 1 A 83 83 GLU C C 83 177.740 178.277 -0.537 1
1 973 . 20 1 1 A 83 83 GLU CA C 83 58.425 59.381 -0.956 1
1 974 . 20 1 1 A 83 83 GLU CB C 83 29.701 29.119 0.582 1
1 976 . 20 1 1 A 83 83 GLU N N 83 119.549 117.416 2.133 1
1 977 . 20 1 1 A 84 84 GLU H H 84 8.033 7.739 0.294 1
1 978 . 20 1 1 A 84 84 GLU HA H 84 4.206 4.224 -0.018 1
1 983 . 20 1 1 A 84 84 GLU C C 84 176.837 175.870 0.967 1
1 984 . 20 1 1 A 84 84 GLU CA C 84 58.056 58.265 -0.209 1
1 985 . 20 1 1 A 84 84 GLU CB C 84 30.432 30.753 -0.321 1
1 987 . 20 1 1 A 84 84 GLU N N 84 118.333 119.755 -1.422 1
1 988 . 20 1 1 A 85 85 THR H H 85 7.651 7.429 0.222 1
1 989 . 20 1 1 A 85 85 THR HA H 85 4.307 4.535 -0.228 1
1 994 . 20 1 1 A 85 85 THR C C 85 171.568 174.305 -2.737 1
1 995 . 20 1 1 A 85 85 THR CA C 85 61.387 59.760 1.627 1
1 996 . 20 1 1 A 85 85 THR CB C 85 69.963 70.502 -0.539 1
1 998 . 20 1 1 A 85 85 THR N N 85 112.444 112.582 -0.138 1
1 999 . 20 1 1 A 86 86 ALA H H 86 8.639 8.588 0.051 1
1 1000 . 20 1 1 A 86 86 ALA HA H 86 4.603 4.333 0.270 1
1 1004 . 20 1 1 A 86 86 ALA C C 86 175.560 177.125 -1.565 1
1 1005 . 20 1 1 A 86 86 ALA CA C 86 52.156 53.233 -1.077 1
1 1006 . 20 1 1 A 86 86 ALA CB C 86 20.378 20.079 0.299 1
1 1007 . 20 1 1 A 86 86 ALA N N 86 127.705 128.052 -0.347 1
1 1008 . 20 1 1 A 87 87 ILE H H 87 7.663 7.622 0.041 1
1 1009 . 20 1 1 A 87 87 ILE HA H 87 4.828 5.004 -0.176 1
1 1019 . 20 1 1 A 87 87 ILE C C 87 174.537 174.227 0.310 1
1 1020 . 20 1 1 A 87 87 ILE CA C 87 60.329 59.880 0.449 1
1 1021 . 20 1 1 A 87 87 ILE CB C 87 41.090 42.220 -1.130 1
1 1025 . 20 1 1 A 87 87 ILE N N 87 118.712 116.724 1.988 1
1 1026 . 20 1 1 A 88 88 HIS H H 88 9.098 9.281 -0.183 1
1 1027 . 20 1 1 A 88 88 HIS HA H 88 4.576 5.204 -0.628 1
1 1032 . 20 1 1 A 88 88 HIS C C 88 174.354 174.192 0.162 1
1 1033 . 20 1 1 A 88 88 HIS CA C 88 54.740 54.217 0.523 1
1 1034 . 20 1 1 A 88 88 HIS CB C 88 33.955 32.443 1.512 1
1 1037 . 20 1 1 A 88 88 HIS N N 88 126.285 125.115 1.170 1
1 1038 . 20 1 1 A 89 89 LYS H H 89 8.957 8.925 0.032 1
1 1039 . 20 1 1 A 89 89 LYS HA H 89 4.873 4.689 0.184 1
1 1048 . 20 1 1 A 89 89 LYS C C 89 175.906 175.527 0.379 1
1 1049 . 20 1 1 A 89 89 LYS CA C 89 55.269 55.337 -0.068 1
1 1050 . 20 1 1 A 89 89 LYS CB C 89 32.945 33.373 -0.428 1
1 1054 . 20 1 1 A 89 89 LYS N N 89 124.332 124.124 0.208 1
1 1055 . 20 1 1 A 90 90 VAL H H 90 9.174 8.516 0.658 1
1 1056 . 20 1 1 A 90 90 VAL HA H 90 4.227 4.878 -0.651 1
1 1064 . 20 1 1 A 90 90 VAL C C 90 174.168 174.893 -0.725 1
1 1065 . 20 1 1 A 90 90 VAL CA C 90 61.369 61.099 0.270 1
1 1066 . 20 1 1 A 90 90 VAL CB C 90 34.082 34.993 -0.911 1
1 1069 . 20 1 1 A 90 90 VAL N N 90 124.319 124.983 -0.664 1
1 1070 . 20 1 1 A 91 91 THR H H 91 6.697 8.914 -2.217 1
1 1071 . 20 1 1 A 91 91 THR HA H 91 5.163 5.201 -0.038 1
1 1076 . 20 1 1 A 91 91 THR C C 91 173.812 173.291 0.521 1
1 1077 . 20 1 1 A 91 91 THR CA C 91 61.935 61.823 0.112 1
1 1078 . 20 1 1 A 91 91 THR CB C 91 70.412 70.387 0.025 1
1 1080 . 20 1 1 A 91 91 THR N N 91 122.637 122.732 -0.095 1
1 1081 . 20 1 1 A 92 92 VAL H H 92 9.292 8.808 0.484 1
1 1082 . 20 1 1 A 92 92 VAL HA H 92 4.736 4.587 0.149 1
1 1090 . 20 1 1 A 92 92 VAL C C 92 173.160 175.162 -2.002 1
1 1091 . 20 1 1 A 92 92 VAL CA C 92 60.982 61.443 -0.461 1
1 1092 . 20 1 1 A 92 92 VAL CB C 92 35.130 33.312 1.818 1
1 1095 . 20 1 1 A 92 92 VAL N N 92 128.265 128.576 -0.311 1
1 1096 . 20 1 1 A 93 93 LEU H H 93 9.495 8.830 0.665 1
1 1097 . 20 1 1 A 93 93 LEU HA H 93 5.628 5.723 -0.095 1
1 1107 . 20 1 1 A 93 93 LEU C C 93 176.274 175.572 0.702 1
1 1108 . 20 1 1 A 93 93 LEU CA C 93 52.773 53.710 -0.937 1
1 1109 . 20 1 1 A 93 93 LEU CB C 93 43.454 44.767 -1.313 1
1 1113 . 20 1 1 A 93 93 LEU N N 93 126.350 126.877 -0.527 1
1 1114 . 20 1 1 A 94 94 ALA H H 94 8.688 8.846 -0.158 1
1 1115 . 20 1 1 A 94 94 ALA HA H 94 4.986 5.087 -0.101 1
1 1119 . 20 1 1 A 94 94 ALA C C 94 175.787 175.621 0.166 1
1 1120 . 20 1 1 A 94 94 ALA CA C 94 49.610 50.531 -0.921 1
1 1121 . 20 1 1 A 94 94 ALA CB C 94 21.463 21.317 0.146 1
1 1122 . 20 1 1 A 94 94 ALA N N 94 123.429 126.049 -2.620 1
1 1123 . 20 1 1 A 95 95 SER H H 95 8.401 8.644 -0.243 1
1 1124 . 20 1 1 A 95 95 SER HA H 95 4.828 4.843 -0.015 1
1 1127 . 20 1 1 A 95 95 SER C C 95 174.327 174.262 0.065 1
1 1128 . 20 1 1 A 95 95 SER CA C 95 56.239 56.214 0.025 1
1 1129 . 20 1 1 A 95 95 SER CB C 95 65.561 65.175 0.386 1
1 1130 . 20 1 1 A 95 95 SER N N 95 114.418 117.657 -3.239 1
1 1131 . 20 1 1 A 96 96 ASP H H 96 8.690 8.872 -0.182 1
1 1132 . 20 1 1 A 96 96 ASP HA H 96 4.908 4.339 0.569 1
1 1135 . 20 1 1 A 96 96 ASP C C 96 177.096 176.334 0.762 1
1 1136 . 20 1 1 A 96 96 ASP CA C 96 52.818 56.194 -3.376 1
1 1137 . 20 1 1 A 96 96 ASP CB C 96 41.253 41.387 -0.134 1
1 1138 . 20 1 1 A 96 96 ASP N N 96 125.624 127.127 -1.503 1
1 1139 . 20 1 1 A 97 97 GLY H H 97 8.524 7.265 1.259 1
1 1140 . 20 1 1 A 97 97 GLY HA2 H 97 4.320 4.037 0.283 1
1 1141 . 20 1 1 A 97 97 GLY HA3 H 97 3.620 4.040 -0.420 1
1 1142 . 20 1 1 A 97 97 GLY C C 97 174.620 173.663 0.957 1
1 1143 . 20 1 1 A 97 97 GLY CA C 97 45.422 45.816 -0.394 1
1 1144 . 20 1 1 A 97 97 GLY N N 97 109.283 105.149 4.134 1
1 1145 . 20 1 1 A 98 98 SER H H 98 8.575 8.700 -0.125 1
1 1146 . 20 1 1 A 98 98 SER HA H 98 4.607 3.971 0.636 1
1 1149 . 20 1 1 A 98 98 SER C C 98 174.478 173.144 1.334 1
1 1150 . 20 1 1 A 98 98 SER CA C 98 59.095 58.990 0.105 1
1 1151 . 20 1 1 A 98 98 SER CB C 98 64.800 61.425 3.375 1
1 1152 . 20 1 1 A 98 98 SER N N 98 116.640 119.406 -2.766 1
1 1153 . 20 1 1 A 99 99 SER H H 99 8.945 7.628 1.317 1
1 1154 . 20 1 1 A 99 99 SER HA H 99 4.530 4.918 -0.388 1
1 1157 . 20 1 1 A 99 99 SER C C 99 174.491 173.104 1.387 1
1 1158 . 20 1 1 A 99 99 SER CA C 99 58.460 57.620 0.840 1
1 1159 . 20 1 1 A 99 99 SER CB C 99 64.146 66.940 -2.794 1
1 1160 . 20 1 1 A 99 99 SER N N 99 117.676 114.768 2.908 1
1 1161 . 20 1 1 A 100 100 THR H H 100 8.411 8.322 0.089 1
1 1162 . 20 1 1 A 100 100 THR HA H 100 4.490 4.179 0.311 1
1 1167 . 20 1 1 A 100 100 THR C C 100 172.766 172.967 -0.201 1
1 1168 . 20 1 1 A 100 100 THR CA C 100 60.629 61.401 -0.772 1
1 1169 . 20 1 1 A 100 100 THR CB C 100 69.778 69.659 0.119 1
1 1171 . 20 1 1 A 100 100 THR N N 100 118.401 119.012 -0.611 1
1 1172 . 20 1 1 A 101 101 PRO HA H 101 4.631 4.772 -0.141 1
1 1179 . 20 1 1 A 101 101 PRO C C 101 177.227 175.457 1.770 1
1 1180 . 20 1 1 A 101 101 PRO CA C 101 63.097 62.213 0.884 1
1 1181 . 20 1 1 A 101 101 PRO CB C 101 32.917 32.283 0.634 1
1 1184 . 20 1 1 A 102 102 ALA H H 102 8.497 8.389 0.108 1
1 1185 . 20 1 1 A 102 102 ALA HA H 102 4.619 4.840 -0.221 1
1 1189 . 20 1 1 A 102 102 ALA C C 102 176.542 176.928 -0.386 1
1 1190 . 20 1 1 A 102 102 ALA CA C 102 51.390 50.938 0.452 1
1 1191 . 20 1 1 A 102 102 ALA CB C 102 20.815 20.343 0.472 1
1 1192 . 20 1 1 A 102 102 ALA N N 102 124.487 124.509 -0.022 1
1 1193 . 20 1 1 A 103 103 ARG H H 103 8.663 8.641 0.022 1
1 1194 . 20 1 1 A 103 103 ARG HA H 103 5.515 5.387 0.128 1
1 1201 . 20 1 1 A 103 103 ARG C C 103 174.539 175.516 -0.977 1
1 1202 . 20 1 1 A 103 103 ARG CA C 103 55.164 55.466 -0.302 1
1 1203 . 20 1 1 A 103 103 ARG CB C 103 34.393 31.769 2.624 1
1 1206 . 20 1 1 A 103 103 ARG N N 103 119.596 122.132 -2.536 1
1 1207 . 20 1 1 A 104 104 ALA H H 104 9.027 8.467 0.560 1
1 1208 . 20 1 1 A 104 104 ALA HA H 104 4.782 5.116 -0.334 1
1 1212 . 20 1 1 A 104 104 ALA C C 104 176.276 175.482 0.794 1
1 1213 . 20 1 1 A 104 104 ALA CA C 104 50.297 51.066 -0.769 1
1 1214 . 20 1 1 A 104 104 ALA CB C 104 20.810 21.614 -0.804 1
1 1215 . 20 1 1 A 104 104 ALA N N 104 126.962 123.789 3.173 1
1 1216 . 20 1 1 A 105 105 THR H H 105 8.384 8.761 -0.377 1
1 1217 . 20 1 1 A 105 105 THR HA H 105 4.954 5.187 -0.233 1
1 1222 . 20 1 1 A 105 105 THR C C 105 173.243 173.971 -0.728 1
1 1223 . 20 1 1 A 105 105 THR CA C 105 61.475 62.391 -0.916 1
1 1224 . 20 1 1 A 105 105 THR CB C 105 70.569 69.261 1.308 1
1 1226 . 20 1 1 A 105 105 THR N N 105 115.327 119.018 -3.691 1
1 1227 . 20 1 1 A 106 106 VAL H H 106 8.970 8.955 0.015 1
1 1228 . 20 1 1 A 106 106 VAL HA H 106 4.702 4.546 0.156 1
1 1236 . 20 1 1 A 106 106 VAL C C 106 174.743 175.206 -0.463 1
1 1237 . 20 1 1 A 106 106 VAL CA C 106 59.712 61.642 -1.930 1
1 1238 . 20 1 1 A 106 106 VAL CB C 106 34.327 32.043 2.284 1
1 1241 . 20 1 1 A 106 106 VAL N N 106 126.226 128.177 -1.951 1
1 1242 . 20 1 1 A 107 107 THR H H 107 8.833 8.563 0.270 1
1 1243 . 20 1 1 A 107 107 THR HA H 107 4.862 4.566 0.296 1
1 1248 . 20 1 1 A 107 107 THR C C 107 172.970 174.082 -1.112 1
1 1249 . 20 1 1 A 107 107 THR CA C 107 62.322 62.630 -0.308 1
1 1250 . 20 1 1 A 107 107 THR CB C 107 69.463 68.576 0.887 1
1 1252 . 20 1 1 A 107 107 THR N N 107 125.403 123.020 2.383 1
1 1253 . 20 1 1 A 108 108 ILE H H 108 9.234 9.047 0.187 1
1 1254 . 20 1 1 A 108 108 ILE HA H 108 4.178 4.731 -0.553 1
1 1264 . 20 1 1 A 108 108 ILE C C 108 174.087 175.549 -1.462 1
1 1265 . 20 1 1 A 108 108 ILE CA C 108 60.365 60.159 0.206 1
1 1266 . 20 1 1 A 108 108 ILE CB C 108 39.745 38.526 1.219 1
1 1270 . 20 1 1 A 108 108 ILE N N 108 127.152 128.426 -1.274 1
1 1271 . 20 1 1 A 109 109 ASN H H 109 8.723 8.604 0.119 1
1 1272 . 20 1 1 A 109 109 ASN HA H 109 5.147 5.246 -0.099 1
1 1277 . 20 1 1 A 109 109 ASN C C 109 173.592 174.735 -1.143 1
1 1278 . 20 1 1 A 109 109 ASN CA C 109 52.501 53.098 -0.597 1
1 1279 . 20 1 1 A 109 109 ASN CB C 109 40.791 40.353 0.438 1
1 1280 . 20 1 1 A 109 109 ASN N N 109 126.866 126.359 0.507 1
1 1282 . 20 1 1 A 110 110 VAL H H 110 9.046 8.595 0.451 1
1 1283 . 20 1 1 A 110 110 VAL HA H 110 5.081 5.116 -0.035 1
1 1291 . 20 1 1 A 110 110 VAL C C 110 176.921 176.034 0.887 1
1 1292 . 20 1 1 A 110 110 VAL CA C 110 61.634 61.174 0.460 1
1 1293 . 20 1 1 A 110 110 VAL CB C 110 31.809 33.975 -2.166 1
1 1296 . 20 1 1 A 110 110 VAL N N 110 126.070 121.656 4.414 1
1 1297 . 20 1 1 A 111 111 THR H H 111 9.197 8.792 0.405 1
1 1298 . 20 1 1 A 111 111 THR HA H 111 4.566 5.199 -0.633 1
1 1303 . 20 1 1 A 111 111 THR C C 111 174.087 174.321 -0.234 1
1 1304 . 20 1 1 A 111 111 THR CA C 111 61.145 59.923 1.222 1
1 1305 . 20 1 1 A 111 111 THR CB C 111 70.706 70.979 -0.273 1
1 1307 . 20 1 1 A 111 111 THR N N 111 121.425 118.196 3.229 1
1 1308 . 20 1 1 A 112 112 ASP H H 112 8.435 8.491 -0.056 1
1 1309 . 20 1 1 A 112 112 ASP HA H 112 4.656 4.961 -0.305 1
1 1312 . 20 1 1 A 112 112 ASP C C 112 176.745 176.722 0.023 1
1 1313 . 20 1 1 A 112 112 ASP CA C 112 54.158 52.686 1.472 1
1 1314 . 20 1 1 A 112 112 ASP CB C 112 41.575 42.084 -0.509 1
1 1315 . 20 1 1 A 112 112 ASP N N 112 119.566 121.411 -1.845 1
1 1316 . 20 1 1 A 113 113 VAL H H 113 8.629 8.597 0.032 1
1 1317 . 20 1 1 A 113 113 VAL HA H 113 4.078 4.369 -0.291 1
1 1325 . 20 1 1 A 113 113 VAL C C 113 175.247 176.631 -1.384 1
1 1326 . 20 1 1 A 113 113 VAL CA C 113 62.533 61.671 0.862 1
1 1327 . 20 1 1 A 113 113 VAL CB C 113 32.534 33.293 -0.759 1
1 1330 . 20 1 1 A 113 113 VAL N N 113 119.356 116.642 2.714 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 108 1.071 1
2 1 1 1 "RMS(OBS, PRED)" CA 111 1.287 1
3 1 1 1 "RMS(OBS, PRED)" CB 103 1.217 1
4 1 1 1 "RMS(OBS, PRED)" H 105 0.555 1
5 1 1 1 "RMS(OBS, PRED)" HA 116 0.339 1
6 1 1 1 "RMS(OBS, PRED)" N 105 3.173 1
7 1 2 1 "RMS(OBS, PRED)" C 108 1.098 1
8 1 2 1 "RMS(OBS, PRED)" CA 111 1.201 1
9 1 2 1 "RMS(OBS, PRED)" CB 103 1.268 1
10 1 2 1 "RMS(OBS, PRED)" H 105 0.501 1
11 1 2 1 "RMS(OBS, PRED)" HA 116 0.361 1
12 1 2 1 "RMS(OBS, PRED)" N 105 2.898 1
13 1 3 1 "RMS(OBS, PRED)" C 108 1.075 1
14 1 3 1 "RMS(OBS, PRED)" CA 111 1.033 1
15 1 3 1 "RMS(OBS, PRED)" CB 103 1.297 1
16 1 3 1 "RMS(OBS, PRED)" H 105 0.534 1
17 1 3 1 "RMS(OBS, PRED)" HA 116 0.339 1
18 1 3 1 "RMS(OBS, PRED)" N 105 3.110 1
19 1 4 1 "RMS(OBS, PRED)" C 108 1.005 1
20 1 4 1 "RMS(OBS, PRED)" CA 111 1.197 1
21 1 4 1 "RMS(OBS, PRED)" CB 103 1.174 1
22 1 4 1 "RMS(OBS, PRED)" H 105 0.505 1
23 1 4 1 "RMS(OBS, PRED)" HA 116 0.346 1
24 1 4 1 "RMS(OBS, PRED)" N 105 2.861 1
25 1 5 1 "RMS(OBS, PRED)" C 108 1.168 1
26 1 5 1 "RMS(OBS, PRED)" CA 111 1.136 1
27 1 5 1 "RMS(OBS, PRED)" CB 103 1.278 1
28 1 5 1 "RMS(OBS, PRED)" H 105 0.496 1
29 1 5 1 "RMS(OBS, PRED)" HA 116 0.391 1
30 1 5 1 "RMS(OBS, PRED)" N 105 2.923 1
31 1 6 1 "RMS(OBS, PRED)" C 108 1.149 1
32 1 6 1 "RMS(OBS, PRED)" CA 111 1.153 1
33 1 6 1 "RMS(OBS, PRED)" CB 103 1.340 1
34 1 6 1 "RMS(OBS, PRED)" H 105 0.513 1
35 1 6 1 "RMS(OBS, PRED)" HA 116 0.350 1
36 1 6 1 "RMS(OBS, PRED)" N 105 2.727 1
37 1 7 1 "RMS(OBS, PRED)" C 108 1.016 1
38 1 7 1 "RMS(OBS, PRED)" CA 111 1.248 1
39 1 7 1 "RMS(OBS, PRED)" CB 103 1.098 1
40 1 7 1 "RMS(OBS, PRED)" H 105 0.532 1
41 1 7 1 "RMS(OBS, PRED)" HA 116 0.337 1
42 1 7 1 "RMS(OBS, PRED)" N 105 3.089 1
43 1 8 1 "RMS(OBS, PRED)" C 108 1.109 1
44 1 8 1 "RMS(OBS, PRED)" CA 111 1.187 1
45 1 8 1 "RMS(OBS, PRED)" CB 103 1.249 1
46 1 8 1 "RMS(OBS, PRED)" H 105 0.518 1
47 1 8 1 "RMS(OBS, PRED)" HA 116 0.336 1
48 1 8 1 "RMS(OBS, PRED)" N 105 2.671 1
49 1 9 1 "RMS(OBS, PRED)" C 108 1.076 1
50 1 9 1 "RMS(OBS, PRED)" CA 111 1.210 1
51 1 9 1 "RMS(OBS, PRED)" CB 103 1.138 1
52 1 9 1 "RMS(OBS, PRED)" H 105 0.525 1
53 1 9 1 "RMS(OBS, PRED)" HA 116 0.365 1
54 1 9 1 "RMS(OBS, PRED)" N 105 3.028 1
55 1 10 1 "RMS(OBS, PRED)" C 108 1.060 1
56 1 10 1 "RMS(OBS, PRED)" CA 111 1.201 1
57 1 10 1 "RMS(OBS, PRED)" CB 103 1.170 1
58 1 10 1 "RMS(OBS, PRED)" H 105 0.515 1
59 1 10 1 "RMS(OBS, PRED)" HA 116 0.326 1
60 1 10 1 "RMS(OBS, PRED)" N 105 3.015 1
61 1 11 1 "RMS(OBS, PRED)" C 108 1.101 1
62 1 11 1 "RMS(OBS, PRED)" CA 111 1.206 1
63 1 11 1 "RMS(OBS, PRED)" CB 103 1.180 1
64 1 11 1 "RMS(OBS, PRED)" H 105 0.459 1
65 1 11 1 "RMS(OBS, PRED)" HA 116 0.333 1
66 1 11 1 "RMS(OBS, PRED)" N 105 2.816 1
67 1 12 1 "RMS(OBS, PRED)" C 108 1.051 1
68 1 12 1 "RMS(OBS, PRED)" CA 111 1.172 1
69 1 12 1 "RMS(OBS, PRED)" CB 103 1.059 1
70 1 12 1 "RMS(OBS, PRED)" H 105 0.516 1
71 1 12 1 "RMS(OBS, PRED)" HA 116 0.332 1
72 1 12 1 "RMS(OBS, PRED)" N 105 3.004 1
73 1 13 1 "RMS(OBS, PRED)" C 108 1.028 1
74 1 13 1 "RMS(OBS, PRED)" CA 111 1.237 1
75 1 13 1 "RMS(OBS, PRED)" CB 103 1.178 1
76 1 13 1 "RMS(OBS, PRED)" H 105 0.495 1
77 1 13 1 "RMS(OBS, PRED)" HA 116 0.352 1
78 1 13 1 "RMS(OBS, PRED)" N 105 2.723 1
79 1 14 1 "RMS(OBS, PRED)" C 108 1.153 1
80 1 14 1 "RMS(OBS, PRED)" CA 111 1.164 1
81 1 14 1 "RMS(OBS, PRED)" CB 103 1.068 1
82 1 14 1 "RMS(OBS, PRED)" H 105 0.489 1
83 1 14 1 "RMS(OBS, PRED)" HA 116 0.354 1
84 1 14 1 "RMS(OBS, PRED)" N 105 2.819 1
85 1 15 1 "RMS(OBS, PRED)" C 108 1.049 1
86 1 15 1 "RMS(OBS, PRED)" CA 111 1.183 1
87 1 15 1 "RMS(OBS, PRED)" CB 103 1.242 1
88 1 15 1 "RMS(OBS, PRED)" H 105 0.491 1
89 1 15 1 "RMS(OBS, PRED)" HA 116 0.347 1
90 1 15 1 "RMS(OBS, PRED)" N 105 2.946 1
91 1 16 1 "RMS(OBS, PRED)" C 108 1.067 1
92 1 16 1 "RMS(OBS, PRED)" CA 111 1.263 1
93 1 16 1 "RMS(OBS, PRED)" CB 103 1.192 1
94 1 16 1 "RMS(OBS, PRED)" H 105 0.506 1
95 1 16 1 "RMS(OBS, PRED)" HA 116 0.349 1
96 1 16 1 "RMS(OBS, PRED)" N 105 2.752 1
97 1 17 1 "RMS(OBS, PRED)" C 108 1.083 1
98 1 17 1 "RMS(OBS, PRED)" CA 111 1.137 1
99 1 17 1 "RMS(OBS, PRED)" CB 103 1.099 1
100 1 17 1 "RMS(OBS, PRED)" H 105 0.493 1
101 1 17 1 "RMS(OBS, PRED)" HA 116 0.312 1
102 1 17 1 "RMS(OBS, PRED)" N 105 2.805 1
103 1 18 1 "RMS(OBS, PRED)" C 108 1.030 1
104 1 18 1 "RMS(OBS, PRED)" CA 111 1.159 1
105 1 18 1 "RMS(OBS, PRED)" CB 103 1.165 1
106 1 18 1 "RMS(OBS, PRED)" H 105 0.511 1
107 1 18 1 "RMS(OBS, PRED)" HA 116 0.341 1
108 1 18 1 "RMS(OBS, PRED)" N 105 2.721 1
109 1 19 1 "RMS(OBS, PRED)" C 108 1.207 1
110 1 19 1 "RMS(OBS, PRED)" CA 111 1.129 1
111 1 19 1 "RMS(OBS, PRED)" CB 103 1.204 1
112 1 19 1 "RMS(OBS, PRED)" H 105 0.487 1
113 1 19 1 "RMS(OBS, PRED)" HA 116 0.334 1
114 1 19 1 "RMS(OBS, PRED)" N 105 2.842 1
115 1 20 1 "RMS(OBS, PRED)" C 108 1.065 1
116 1 20 1 "RMS(OBS, PRED)" CA 111 1.172 1
117 1 20 1 "RMS(OBS, PRED)" CB 103 1.216 1
118 1 20 1 "RMS(OBS, PRED)" H 105 0.519 1
119 1 20 1 "RMS(OBS, PRED)" HA 116 0.355 1
120 1 20 1 "RMS(OBS, PRED)" N 105 2.829 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 4 . 1 1 A 2 2 SER H H 2 8.289 8.598 -0.309 2
1 5 . 1 1 A 2 2 SER HA H 2 4.530 4.776 -0.246 2
1 7 . 1 1 A 2 2 SER C C 2 174.868 173.752 1.116 2
1 8 . 1 1 A 2 2 SER CA C 2 58.284 58.275 0.009 2
1 9 . 1 1 A 2 2 SER CB C 2 63.769 64.657 -0.888 2
1 10 . 1 1 A 2 2 SER N N 2 115.842 117.220 -1.378 2
1 11 . 1 1 A 3 3 SER H H 3 8.490 8.383 0.107 2
1 12 . 1 1 A 3 3 SER HA H 3 4.496 4.612 -0.116 2
1 14 . 1 1 A 3 3 SER C C 3 175.043 174.136 0.907 2
1 15 . 1 1 A 3 3 SER CA C 3 58.549 58.340 0.209 2
1 16 . 1 1 A 3 3 SER CB C 3 63.687 63.830 -0.143 2
1 17 . 1 1 A 3 3 SER N N 3 117.930 117.363 0.567 2
1 18 . 1 1 A 4 4 GLY H H 4 8.482 8.342 0.140 2
1 19 . 1 1 A 4 4 GLY C C 4 174.344 173.619 0.725 2
1 20 . 1 1 A 4 4 GLY CA C 4 45.536 45.322 0.214 2
1 21 . 1 1 A 4 4 GLY N N 4 110.985 111.350 -0.365 2
1 22 . 1 1 A 6 6 SER HA H 6 4.508 4.764 -0.256 2
1 24 . 1 1 A 6 6 SER C C 6 175.026 174.260 0.766 2
1 25 . 1 1 A 6 6 SER CA C 6 58.584 58.109 0.475 2
1 26 . 1 1 A 6 6 SER CB C 6 63.646 64.710 -1.064 2
1 27 . 1 1 A 7 7 GLY H H 7 8.419 8.504 -0.085 2
1 28 . 1 1 A 7 7 GLY HA2 H 7 3.993 4.112 -0.119 2
1 29 . 1 1 A 7 7 GLY C C 7 173.995 173.753 0.242 2
1 30 . 1 1 A 7 7 GLY CA C 7 45.466 45.325 0.141 2
1 31 . 1 1 A 7 7 GLY N N 7 110.615 111.035 -0.420 2
1 32 . 1 1 A 8 8 ASN H H 8 8.322 8.478 -0.156 2
1 33 . 1 1 A 8 8 ASN HA H 8 4.736 5.015 -0.279 2
1 38 . 1 1 A 8 8 ASN C C 8 174.907 174.422 0.485 2
1 39 . 1 1 A 8 8 ASN CA C 8 53.259 53.102 0.157 2
1 40 . 1 1 A 8 8 ASN CB C 8 39.127 40.527 -1.400 2
1 41 . 1 1 A 8 8 ASN N N 8 118.602 119.400 -0.798 2
1 43 . 1 1 A 9 9 ASP H H 9 8.370 8.380 -0.009 2
1 44 . 1 1 A 9 9 ASP HA H 9 4.594 4.783 -0.189 2
1 47 . 1 1 A 9 9 ASP C C 9 175.765 175.544 0.221 2
1 48 . 1 1 A 9 9 ASP CA C 9 54.440 54.098 0.342 2
1 49 . 1 1 A 9 9 ASP CB C 9 40.898 41.860 -0.962 2
1 50 . 1 1 A 9 9 ASP N N 9 120.504 120.040 0.464 2
1 51 . 1 1 A 10 10 ASN H H 10 8.382 8.608 -0.226 2
1 52 . 1 1 A 10 10 ASN HA H 10 4.691 4.981 -0.290 2
1 57 . 1 1 A 10 10 ASN C C 10 174.383 174.251 0.132 2
1 58 . 1 1 A 10 10 ASN CA C 10 53.241 52.991 0.250 2
1 59 . 1 1 A 10 10 ASN CB C 10 38.674 39.892 -1.218 2
1 60 . 1 1 A 10 10 ASN N N 10 119.406 119.524 -0.118 2
1 62 . 1 1 A 11 11 ARG H H 11 7.942 8.157 -0.215 2
1 63 . 1 1 A 11 11 ARG HA H 11 4.684 4.715 -0.031 2
1 70 . 1 1 A 11 11 ARG C C 11 173.640 174.395 -0.755 2
1 71 . 1 1 A 11 11 ARG CA C 11 54.246 53.857 0.389 2
1 72 . 1 1 A 11 11 ARG CB C 11 30.337 31.645 -1.308 2
1 75 . 1 1 A 11 11 ARG N N 11 121.145 121.170 -0.025 2
1 76 . 1 1 A 12 12 PRO HA H 12 4.507 4.649 -0.142 2
1 83 . 1 1 A 12 12 PRO CA C 12 62.714 62.455 0.259 2
1 84 . 1 1 A 12 12 PRO CB C 12 31.942 31.986 -0.044 2
1 87 . 1 1 A 13 13 VAL H H 13 8.252 8.252 0.000 2
1 88 . 1 1 A 13 13 VAL HA H 13 4.159 4.511 -0.352 2
1 96 . 1 1 A 13 13 VAL CA C 13 61.409 60.322 1.087 2
1 97 . 1 1 A 13 13 VAL CB C 13 34.858 34.346 0.512 2
1 100 . 1 1 A 13 13 VAL N N 13 118.395 120.302 -1.907 2
1 101 . 1 1 A 14 14 PHE H H 14 8.725 8.780 -0.055 2
1 102 . 1 1 A 14 14 PHE HA H 14 4.781 4.744 0.037 2
1 110 . 1 1 A 14 14 PHE CA C 14 58.594 58.020 0.574 2
1 111 . 1 1 A 14 14 PHE CB C 14 39.594 39.833 -0.239 2
1 117 . 1 1 A 14 14 PHE N N 14 122.950 125.988 -3.038 2
1 118 . 1 1 A 15 15 LYS H H 15 8.885 8.901 -0.016 2
1 119 . 1 1 A 15 15 LYS HA H 15 4.130 4.081 0.049 2
1 128 . 1 1 A 15 15 LYS C C 15 177.027 176.333 0.694 2
1 129 . 1 1 A 15 15 LYS CA C 15 58.478 59.106 -0.628 2
1 130 . 1 1 A 15 15 LYS CB C 15 32.748 32.608 0.140 2
1 134 . 1 1 A 15 15 LYS N N 15 123.863 123.891 -0.028 2
1 135 . 1 1 A 16 16 GLU H H 16 8.091 8.167 -0.076 2
1 136 . 1 1 A 16 16 GLU HA H 16 4.438 4.614 -0.176 2
1 141 . 1 1 A 16 16 GLU C C 16 175.947 176.996 -1.049 2
1 142 . 1 1 A 16 16 GLU CA C 16 56.045 55.408 0.637 2
1 143 . 1 1 A 16 16 GLU CB C 16 30.766 31.675 -0.909 2
1 145 . 1 1 A 16 16 GLU N N 16 117.026 117.481 -0.455 2
1 146 . 1 1 A 17 17 GLY H H 17 8.421 8.564 -0.143 2
1 147 . 1 1 A 17 17 GLY HA2 H 17 3.993 3.885 0.108 2
1 148 . 1 1 A 17 17 GLY HA3 H 17 3.913 3.911 0.002 2
1 149 . 1 1 A 17 17 GLY C C 17 173.564 174.298 -0.734 2
1 150 . 1 1 A 17 17 GLY CA C 17 45.448 47.145 -1.697 2
1 151 . 1 1 A 17 17 GLY N N 17 109.577 110.404 -0.827 2
1 152 . 1 1 A 18 18 GLN H H 18 7.858 7.883 -0.025 2
1 153 . 1 1 A 18 18 GLN HA H 18 5.065 4.904 0.161 2
1 160 . 1 1 A 18 18 GLN C C 18 174.596 174.814 -0.218 2
1 161 . 1 1 A 18 18 GLN CA C 18 55.110 54.862 0.248 2
1 162 . 1 1 A 18 18 GLN CB C 18 30.329 30.703 -0.374 2
1 164 . 1 1 A 18 18 GLN N N 18 120.202 118.505 1.697 2
1 166 . 1 1 A 19 19 VAL H H 19 8.216 8.643 -0.427 2
1 167 . 1 1 A 19 19 VAL HA H 19 4.450 4.668 -0.218 2
1 175 . 1 1 A 19 19 VAL C C 19 173.648 173.942 -0.294 2
1 176 . 1 1 A 19 19 VAL CA C 19 60.788 60.643 0.145 2
1 177 . 1 1 A 19 19 VAL CB C 19 35.336 35.429 -0.093 2
1 180 . 1 1 A 19 19 VAL N N 19 121.257 124.287 -3.030 2
1 181 . 1 1 A 20 20 GLU H H 20 8.610 8.946 -0.336 2
1 182 . 1 1 A 20 20 GLU HA H 20 5.211 5.144 0.067 2
1 187 . 1 1 A 20 20 GLU C C 20 174.783 175.778 -0.995 2
1 188 . 1 1 A 20 20 GLU CA C 20 54.793 55.233 -0.440 2
1 189 . 1 1 A 20 20 GLU CB C 20 32.058 31.920 0.138 2
1 191 . 1 1 A 20 20 GLU N N 20 127.095 127.523 -0.428 2
1 192 . 1 1 A 21 21 VAL H H 21 8.727 8.756 -0.029 2
1 193 . 1 1 A 21 21 VAL HA H 21 4.633 5.005 -0.372 2
1 201 . 1 1 A 21 21 VAL C C 21 173.894 174.592 -0.698 2
1 202 . 1 1 A 21 21 VAL CA C 21 59.695 59.386 0.309 2
1 203 . 1 1 A 21 21 VAL CB C 21 35.865 35.215 0.650 2
1 206 . 1 1 A 21 21 VAL N N 21 120.489 120.374 0.115 2
1 207 . 1 1 A 22 22 HIS H H 22 8.680 8.864 -0.184 2
1 208 . 1 1 A 22 22 HIS HA H 22 5.552 5.545 0.007 2
1 212 . 1 1 A 22 22 HIS C C 22 174.298 173.563 0.735 2
1 213 . 1 1 A 22 22 HIS CA C 22 55.331 53.974 1.357 2
1 214 . 1 1 A 22 22 HIS CB C 22 32.369 31.948 0.421 2
1 216 . 1 1 A 22 22 HIS N N 22 124.991 119.471 5.520 2
1 217 . 1 1 A 23 23 ILE H H 23 9.179 8.814 0.365 2
1 218 . 1 1 A 23 23 ILE HA H 23 5.046 4.637 0.409 2
1 228 . 1 1 A 23 23 ILE C C 23 171.552 173.661 -2.109 2
1 229 . 1 1 A 23 23 ILE CA C 23 55.551 57.194 -1.643 2
1 230 . 1 1 A 23 23 ILE CB C 23 42.053 41.927 0.126 2
1 234 . 1 1 A 23 23 ILE N N 23 123.121 123.789 -0.668 2
1 235 . 1 1 A 24 24 PRO HA H 24 4.816 4.812 0.004 2
1 242 . 1 1 A 24 24 PRO C C 24 178.887 177.668 1.219 2
1 243 . 1 1 A 24 24 PRO CA C 24 62.216 62.687 -0.471 2
1 244 . 1 1 A 24 24 PRO CB C 24 32.895 32.726 0.169 2
1 247 . 1 1 A 25 25 GLU H H 25 8.399 8.395 0.004 2
1 248 . 1 1 A 25 25 GLU HA H 25 3.785 4.042 -0.257 2
1 253 . 1 1 A 25 25 GLU C C 25 175.244 177.401 -2.157 2
1 254 . 1 1 A 25 25 GLU CA C 25 58.425 59.040 -0.615 2
1 255 . 1 1 A 25 25 GLU CB C 25 30.011 29.093 0.918 2
1 257 . 1 1 A 25 25 GLU N N 25 117.706 122.163 -4.457 2
1 258 . 1 1 A 26 26 ASN H H 26 7.488 7.759 -0.271 2
1 259 . 1 1 A 26 26 ASN HA H 26 4.702 4.804 -0.102 2
1 264 . 1 1 A 26 26 ASN C C 26 175.425 175.301 0.124 2
1 265 . 1 1 A 26 26 ASN CA C 26 51.584 52.773 -1.189 2
1 266 . 1 1 A 26 26 ASN CB C 26 37.243 38.643 -1.400 2
1 267 . 1 1 A 26 26 ASN N N 26 112.383 117.114 -4.731 2
1 269 . 1 1 A 27 27 ALA H H 27 7.716 7.345 0.371 2
1 270 . 1 1 A 27 27 ALA HA H 27 4.409 4.341 0.068 2
1 274 . 1 1 A 27 27 ALA C C 27 175.850 175.851 -0.001 2
1 275 . 1 1 A 27 27 ALA CA C 27 51.037 50.998 0.039 2
1 276 . 1 1 A 27 27 ALA CB C 27 18.152 18.477 -0.325 2
1 277 . 1 1 A 27 27 ALA N N 27 125.139 122.803 2.336 2
1 278 . 1 1 A 28 28 PRO HA H 28 4.422 4.523 -0.101 2
1 285 . 1 1 A 28 28 PRO C C 28 178.442 176.916 1.526 2
1 286 . 1 1 A 28 28 PRO CA C 28 62.067 62.751 -0.684 2
1 287 . 1 1 A 28 28 PRO CB C 28 32.642 32.232 0.410 2
1 290 . 1 1 A 29 29 VAL H H 29 8.691 8.321 0.370 2
1 291 . 1 1 A 29 29 VAL HA H 29 3.239 3.612 -0.373 2
1 299 . 1 1 A 29 29 VAL C C 29 176.887 177.094 -0.207 2
1 300 . 1 1 A 29 29 VAL CA C 29 65.812 64.197 1.615 2
1 301 . 1 1 A 29 29 VAL CB C 29 31.174 31.347 -0.173 2
1 304 . 1 1 A 29 29 VAL N N 29 123.592 122.694 0.898 2
1 305 . 1 1 A 30 30 GLY H H 30 9.197 8.798 0.399 2
1 306 . 1 1 A 30 30 GLY HA2 H 30 4.486 3.968 0.518 2
1 307 . 1 1 A 30 30 GLY HA3 H 30 3.581 3.969 -0.388 2
1 308 . 1 1 A 30 30 GLY C C 30 174.347 174.684 -0.337 2
1 309 . 1 1 A 30 30 GLY CA C 30 44.320 44.943 -0.623 2
1 310 . 1 1 A 30 30 GLY N N 30 116.042 115.360 0.682 2
1 311 . 1 1 A 31 31 THR H H 31 7.838 7.504 0.334 2
1 312 . 1 1 A 31 31 THR HA H 31 3.959 4.190 -0.231 2
1 317 . 1 1 A 31 31 THR C C 31 174.274 174.008 0.266 2
1 318 . 1 1 A 31 31 THR CA C 31 65.160 63.080 2.080 2
1 319 . 1 1 A 31 31 THR CB C 31 69.972 69.245 0.727 2
1 321 . 1 1 A 31 31 THR N N 31 117.679 117.687 -0.008 2
1 322 . 1 1 A 32 32 SER H H 32 9.022 8.694 0.328 2
1 323 . 1 1 A 32 32 SER HA H 32 4.273 4.674 -0.401 2
1 326 . 1 1 A 32 32 SER C C 32 172.692 174.298 -1.606 2
1 327 . 1 1 A 32 32 SER CA C 32 59.642 57.957 1.685 2
1 328 . 1 1 A 32 32 SER CB C 32 63.102 63.139 -0.037 2
1 329 . 1 1 A 32 32 SER N N 32 123.045 120.768 2.277 2
1 330 . 1 1 A 33 33 VAL H H 33 9.202 8.822 0.380 2
1 331 . 1 1 A 33 33 VAL HA H 33 3.844 3.990 -0.146 2
1 339 . 1 1 A 33 33 VAL C C 33 174.782 175.788 -1.006 2
1 340 . 1 1 A 33 33 VAL CA C 33 64.242 64.357 -0.115 2
1 341 . 1 1 A 33 33 VAL CB C 33 32.893 32.280 0.613 2
1 344 . 1 1 A 33 33 VAL N N 33 126.861 125.863 0.998 2
1 345 . 1 1 A 34 34 ILE H H 34 7.074 7.730 -0.656 2
1 346 . 1 1 A 34 34 ILE HA H 34 4.295 4.673 -0.378 2
1 356 . 1 1 A 34 34 ILE C C 34 170.577 173.133 -2.556 2
1 357 . 1 1 A 34 34 ILE CA C 34 59.500 59.258 0.242 2
1 358 . 1 1 A 34 34 ILE CB C 34 39.251 42.101 -2.850 2
1 362 . 1 1 A 34 34 ILE N N 34 111.445 119.071 -7.626 2
1 363 . 1 1 A 35 35 GLN H H 35 8.450 8.941 -0.491 2
1 364 . 1 1 A 35 35 GLN HA H 35 4.633 4.968 -0.335 2
1 371 . 1 1 A 35 35 GLN C C 35 174.354 174.294 0.060 2
1 372 . 1 1 A 35 35 GLN CA C 35 54.176 54.201 -0.025 2
1 373 . 1 1 A 35 35 GLN CB C 35 29.456 31.618 -2.162 2
1 375 . 1 1 A 35 35 GLN N N 35 127.342 128.118 -0.776 2
1 377 . 1 1 A 36 36 LEU H H 36 7.761 8.606 -0.845 2
1 378 . 1 1 A 36 36 LEU HA H 36 4.492 4.949 -0.457 2
1 388 . 1 1 A 36 36 LEU C C 36 175.543 175.477 0.066 2
1 389 . 1 1 A 36 36 LEU CA C 36 53.982 53.916 0.066 2
1 390 . 1 1 A 36 36 LEU CB C 36 42.776 43.089 -0.313 2
1 394 . 1 1 A 36 36 LEU N N 36 128.895 127.986 0.909 2
1 395 . 1 1 A 37 37 HIS H H 37 8.529 9.023 -0.494 2
1 396 . 1 1 A 37 37 HIS HA H 37 4.851 5.356 -0.505 2
1 400 . 1 1 A 37 37 HIS C C 37 172.985 173.525 -0.540 2
1 401 . 1 1 A 37 37 HIS CA C 37 55.833 53.822 2.011 2
1 402 . 1 1 A 37 37 HIS CB C 37 32.204 32.137 0.067 2
1 404 . 1 1 A 37 37 HIS N N 37 115.903 124.589 -8.686 2
1 405 . 1 1 A 38 38 ALA H H 38 8.474 8.898 -0.424 2
1 406 . 1 1 A 38 38 ALA HA H 38 4.691 4.967 -0.276 2
1 410 . 1 1 A 38 38 ALA C C 38 175.548 176.136 -0.588 2
1 411 . 1 1 A 38 38 ALA CA C 38 50.491 50.616 -0.125 2
1 412 . 1 1 A 38 38 ALA CB C 38 19.842 20.622 -0.780 2
1 413 . 1 1 A 38 38 ALA N N 38 128.891 130.376 -1.485 2
1 414 . 1 1 A 39 39 THR H H 39 8.095 8.675 -0.580 2
1 415 . 1 1 A 39 39 THR HA H 39 4.336 5.126 -0.790 2
1 420 . 1 1 A 39 39 THR C C 39 173.553 173.309 0.244 2
1 421 . 1 1 A 39 39 THR CA C 39 60.417 60.088 0.329 2
1 422 . 1 1 A 39 39 THR CB C 39 70.912 71.313 -0.401 2
1 424 . 1 1 A 39 39 THR N N 39 110.982 113.659 -2.677 2
1 425 . 1 1 A 40 40 ASP H H 40 8.417 8.816 -0.399 2
1 426 . 1 1 A 40 40 ASP HA H 40 4.553 4.890 -0.337 2
1 429 . 1 1 A 40 40 ASP C C 40 176.462 175.517 0.945 2
1 430 . 1 1 A 40 40 ASP CA C 40 54.158 53.713 0.445 2
1 431 . 1 1 A 40 40 ASP CB C 40 41.517 42.726 -1.209 2
1 432 . 1 1 A 40 40 ASP N N 40 121.450 123.062 -1.612 2
1 433 . 1 1 A 41 41 ALA H H 41 8.435 8.224 0.211 2
1 434 . 1 1 A 41 41 ALA HA H 41 4.129 4.258 -0.129 2
1 438 . 1 1 A 41 41 ALA C C 41 177.718 177.432 0.286 2
1 439 . 1 1 A 41 41 ALA CA C 41 53.436 52.460 0.976 2
1 440 . 1 1 A 41 41 ALA CB C 41 19.183 19.525 -0.342 2
1 441 . 1 1 A 41 41 ALA N N 41 124.607 123.504 1.103 2
1 442 . 1 1 A 42 42 ASP H H 42 8.310 8.620 -0.310 2
1 443 . 1 1 A 42 42 ASP HA H 42 4.588 4.588 -0.000 2
1 446 . 1 1 A 42 42 ASP C C 42 176.546 176.049 0.497 2
1 447 . 1 1 A 42 42 ASP CA C 42 54.599 55.065 -0.466 2
1 448 . 1 1 A 42 42 ASP CB C 42 41.146 40.370 0.776 2
1 449 . 1 1 A 42 42 ASP N N 42 118.030 121.450 -3.420 2
1 450 . 1 1 A 43 43 ILE H H 43 8.000 7.886 0.114 2
1 451 . 1 1 A 43 43 ILE HA H 43 4.130 4.204 -0.074 2
1 461 . 1 1 A 43 43 ILE C C 43 176.901 176.187 0.714 2
1 462 . 1 1 A 43 43 ILE CA C 43 61.740 61.348 0.392 2
1 463 . 1 1 A 43 43 ILE CB C 43 38.491 38.238 0.253 2
1 467 . 1 1 A 43 43 ILE N N 43 119.301 118.573 0.728 2
1 468 . 1 1 A 44 44 GLY H H 44 8.448 8.595 -0.147 2
1 469 . 1 1 A 44 44 GLY HA2 H 44 3.939 3.994 -0.055 2
1 470 . 1 1 A 44 44 GLY HA3 H 44 3.939 3.997 -0.057 2
1 471 . 1 1 A 44 44 GLY C C 44 174.393 173.803 0.590 2
1 472 . 1 1 A 44 44 GLY CA C 44 45.501 46.026 -0.525 2
1 473 . 1 1 A 44 44 GLY N N 44 111.333 115.532 -4.199 2
1 474 . 1 1 A 45 45 SER H H 45 8.061 8.246 -0.185 2
1 475 . 1 1 A 45 45 SER HA H 45 4.416 4.720 -0.304 2
1 478 . 1 1 A 45 45 SER C C 45 174.480 173.692 0.788 2
1 479 . 1 1 A 45 45 SER CA C 45 58.478 57.772 0.706 2
1 480 . 1 1 A 45 45 SER CB C 45 63.943 64.401 -0.458 2
1 481 . 1 1 A 45 45 SER N N 45 115.551 117.336 -1.785 2
1 482 . 1 1 A 46 46 ASN H H 46 8.547 8.511 0.036 2
1 483 . 1 1 A 46 46 ASN HA H 46 4.725 4.864 -0.139 2
1 488 . 1 1 A 46 46 ASN C C 46 175.031 174.449 0.582 2
1 489 . 1 1 A 46 46 ASN CA C 46 53.277 53.141 0.136 2
1 490 . 1 1 A 46 46 ASN CB C 46 38.798 38.905 -0.107 2
1 491 . 1 1 A 46 46 ASN N N 46 120.698 121.890 -1.192 2
1 493 . 1 1 A 47 47 ALA H H 47 8.239 8.215 0.024 2
1 494 . 1 1 A 47 47 ALA HA H 47 4.283 4.733 -0.450 2
1 498 . 1 1 A 47 47 ALA C C 47 177.240 176.059 1.181 2
1 499 . 1 1 A 47 47 ALA CA C 47 52.731 51.217 1.514 2
1 500 . 1 1 A 47 47 ALA CB C 47 19.594 20.835 -1.241 2
1 501 . 1 1 A 47 47 ALA N N 47 124.093 124.493 -0.400 2
1 502 . 1 1 A 48 48 GLU H H 48 8.376 8.603 -0.227 2
1 503 . 1 1 A 48 48 GLU HA H 48 4.264 4.608 -0.344 2
1 508 . 1 1 A 48 48 GLU C C 48 175.702 175.305 0.397 2
1 509 . 1 1 A 48 48 GLU CA C 48 55.992 55.381 0.611 2
1 510 . 1 1 A 48 48 GLU CB C 48 30.210 29.755 0.455 2
1 512 . 1 1 A 48 48 GLU N N 48 119.750 121.239 -1.489 2
1 513 . 1 1 A 49 49 ILE H H 49 7.806 8.270 -0.464 2
1 514 . 1 1 A 49 49 ILE HA H 49 3.919 4.151 -0.232 2
1 524 . 1 1 A 49 49 ILE C C 49 175.894 175.206 0.688 2
1 525 . 1 1 A 49 49 ILE CA C 49 60.559 61.351 -0.792 2
1 526 . 1 1 A 49 49 ILE CB C 49 37.860 37.535 0.325 2
1 530 . 1 1 A 49 49 ILE N N 49 122.772 125.676 -2.904 2
1 531 . 1 1 A 50 50 ARG H H 50 8.247 8.365 -0.118 2
1 532 . 1 1 A 50 50 ARG HA H 50 4.999 4.762 0.237 2
1 539 . 1 1 A 50 50 ARG C C 50 174.603 174.577 0.026 2
1 540 . 1 1 A 50 50 ARG CA C 50 53.189 54.741 -1.552 2
1 541 . 1 1 A 50 50 ARG CB C 50 33.152 32.339 0.813 2
1 544 . 1 1 A 50 50 ARG N N 50 126.912 127.632 -0.720 2
1 545 . 1 1 A 51 51 TYR H H 51 9.041 8.956 0.085 2
1 546 . 1 1 A 51 51 TYR HA H 51 5.395 5.384 0.011 2
1 553 . 1 1 A 51 51 TYR C C 51 175.555 175.744 -0.189 2
1 554 . 1 1 A 51 51 TYR CA C 51 56.909 57.003 -0.094 2
1 555 . 1 1 A 51 51 TYR CB C 51 40.116 40.196 -0.080 2
1 560 . 1 1 A 51 51 TYR N N 51 121.627 122.617 -0.990 2
1 561 . 1 1 A 52 52 ILE H H 52 8.850 8.515 0.335 2
1 562 . 1 1 A 52 52 ILE HA H 52 4.576 4.887 -0.311 2
1 572 . 1 1 A 52 52 ILE C C 52 175.371 175.224 0.147 2
1 573 . 1 1 A 52 52 ILE CA C 52 59.624 59.226 0.398 2
1 574 . 1 1 A 52 52 ILE CB C 52 42.895 41.469 1.426 2
1 578 . 1 1 A 52 52 ILE N N 52 117.697 118.572 -0.875 2
1 579 . 1 1 A 53 53 PHE H H 53 8.748 8.793 -0.045 2
1 580 . 1 1 A 53 53 PHE HA H 53 5.132 4.643 0.489 2
1 588 . 1 1 A 53 53 PHE C C 53 178.146 176.401 1.745 2
1 589 . 1 1 A 53 53 PHE CA C 53 57.667 58.148 -0.481 2
1 590 . 1 1 A 53 53 PHE CB C 53 39.614 39.566 0.048 2
1 596 . 1 1 A 53 53 PHE N N 53 121.433 122.420 -0.987 2
1 597 . 1 1 A 54 54 GLY H H 54 8.538 8.662 -0.124 2
1 598 . 1 1 A 54 54 GLY HA2 H 54 4.074 4.112 -0.037 2
1 599 . 1 1 A 54 54 GLY HA3 H 54 3.840 4.114 -0.274 2
1 600 . 1 1 A 54 54 GLY C C 54 174.530 172.929 1.601 2
1 601 . 1 1 A 54 54 GLY CA C 54 44.884 44.533 0.351 2
1 602 . 1 1 A 54 54 GLY N N 54 106.444 110.615 -4.171 2
1 603 . 1 1 A 55 55 ALA H H 55 8.594 8.295 0.299 2
1 604 . 1 1 A 55 55 ALA HA H 55 4.172 4.614 -0.443 2
1 608 . 1 1 A 55 55 ALA C C 55 178.718 177.357 1.361 2
1 609 . 1 1 A 55 55 ALA CA C 55 54.423 51.070 3.353 2
1 610 . 1 1 A 55 55 ALA CB C 55 19.059 20.660 -1.601 2
1 611 . 1 1 A 55 55 ALA N N 55 123.470 122.081 1.389 2
1 612 . 1 1 A 56 56 GLN H H 56 8.727 8.740 -0.013 2
1 613 . 1 1 A 56 56 GLN HA H 56 4.367 3.768 0.599 2
1 620 . 1 1 A 56 56 GLN C C 56 176.134 174.674 1.460 2
1 621 . 1 1 A 56 56 GLN CA C 56 55.660 56.735 -1.075 2
1 622 . 1 1 A 56 56 GLN CB C 56 28.152 26.888 1.264 2
1 624 . 1 1 A 56 56 GLN N N 56 114.221 115.642 -1.421 2
1 626 . 1 1 A 57 57 VAL H H 57 7.204 7.765 -0.561 2
1 627 . 1 1 A 57 57 VAL HA H 57 3.889 4.221 -0.332 2
1 635 . 1 1 A 57 57 VAL C C 57 175.371 175.333 0.038 2
1 636 . 1 1 A 57 57 VAL CA C 57 63.908 61.396 2.512 2
1 637 . 1 1 A 57 57 VAL CB C 57 31.557 32.866 -1.309 2
1 640 . 1 1 A 57 57 VAL N N 57 121.341 119.590 1.751 2
1 641 . 1 1 A 58 58 ALA H H 58 8.920 8.532 0.388 2
1 642 . 1 1 A 58 58 ALA HA H 58 4.547 4.392 0.155 2
1 646 . 1 1 A 58 58 ALA C C 58 177.064 177.753 -0.689 2
1 647 . 1 1 A 58 58 ALA CA C 58 51.173 50.737 0.436 2
1 648 . 1 1 A 58 58 ALA CB C 58 17.842 17.876 -0.034 2
1 649 . 1 1 A 58 58 ALA N N 58 132.726 130.457 2.269 2
1 650 . 1 1 A 59 59 PRO HA H 59 4.101 4.248 -0.147 2
1 657 . 1 1 A 59 59 PRO C C 59 179.482 178.552 0.930 2
1 658 . 1 1 A 59 59 PRO CA C 59 66.060 65.479 0.581 2
1 659 . 1 1 A 59 59 PRO CB C 59 31.951 31.822 0.129 2
1 662 . 1 1 A 60 60 ALA H H 60 8.706 8.213 0.493 2
1 663 . 1 1 A 60 60 ALA HA H 60 4.057 4.013 0.044 2
1 667 . 1 1 A 60 60 ALA C C 60 179.627 180.177 -0.550 2
1 668 . 1 1 A 60 60 ALA CA C 60 55.305 55.370 -0.065 2
1 669 . 1 1 A 60 60 ALA CB C 60 18.737 18.570 0.167 2
1 670 . 1 1 A 60 60 ALA N N 60 117.882 118.746 -0.864 2
1 671 . 1 1 A 61 61 THR H H 61 7.312 8.106 -0.794 2
1 672 . 1 1 A 61 61 THR HA H 61 4.153 4.011 0.142 2
1 677 . 1 1 A 61 61 THR C C 61 175.824 176.583 -0.759 2
1 678 . 1 1 A 61 61 THR CA C 61 66.412 66.718 -0.306 2
1 679 . 1 1 A 61 61 THR CB C 61 68.787 68.691 0.096 2
1 681 . 1 1 A 61 61 THR N N 61 114.483 114.243 0.240 2
1 682 . 1 1 A 62 62 LYS H H 62 7.556 7.694 -0.138 2
1 683 . 1 1 A 62 62 LYS HA H 62 3.943 3.970 -0.027 2
1 692 . 1 1 A 62 62 LYS C C 62 176.884 178.845 -1.961 2
1 693 . 1 1 A 62 62 LYS CA C 62 59.095 59.008 0.088 2
1 694 . 1 1 A 62 62 LYS CB C 62 32.204 31.929 0.275 2
1 698 . 1 1 A 62 62 LYS N N 62 118.994 119.386 -0.392 2
1 699 . 1 1 A 63 63 ARG H H 63 7.474 7.865 -0.391 2
1 700 . 1 1 A 63 63 ARG HA H 63 4.034 4.070 -0.036 2
1 707 . 1 1 A 63 63 ARG C C 63 177.574 178.607 -1.033 2
1 708 . 1 1 A 63 63 ARG CA C 63 58.143 58.863 -0.720 2
1 709 . 1 1 A 63 63 ARG CB C 63 30.755 30.081 0.674 2
1 712 . 1 1 A 63 63 ARG N N 63 114.251 119.913 -5.662 2
1 713 . 1 1 A 64 64 LEU H H 64 6.991 7.748 -0.757 2
1 714 . 1 1 A 64 64 LEU HA H 64 3.904 3.913 -0.009 2
1 724 . 1 1 A 64 64 LEU C C 64 176.632 176.509 0.123 2
1 725 . 1 1 A 64 64 LEU CA C 64 56.503 57.404 -0.901 2
1 726 . 1 1 A 64 64 LEU CB C 64 42.929 42.184 0.745 2
1 730 . 1 1 A 64 64 LEU N N 64 116.109 119.209 -3.100 2
1 731 . 1 1 A 65 65 PHE H H 65 7.673 8.075 -0.402 2
1 732 . 1 1 A 65 65 PHE HA H 65 5.386 5.086 0.300 2
1 740 . 1 1 A 65 65 PHE C C 65 173.067 174.884 -1.817 2
1 741 . 1 1 A 65 65 PHE CA C 65 56.521 56.915 -0.394 2
1 742 . 1 1 A 65 65 PHE CB C 65 41.270 41.100 0.170 2
1 748 . 1 1 A 65 65 PHE N N 65 116.182 115.292 0.890 2
1 749 . 1 1 A 66 66 ALA H H 66 8.914 8.973 -0.059 2
1 750 . 1 1 A 66 66 ALA HA H 66 4.748 5.241 -0.493 2
1 754 . 1 1 A 66 66 ALA C C 66 175.223 175.656 -0.433 2
1 755 . 1 1 A 66 66 ALA CA C 66 50.050 50.529 -0.479 2
1 756 . 1 1 A 66 66 ALA CB C 66 21.161 20.985 0.176 2
1 757 . 1 1 A 66 66 ALA N N 66 122.870 125.784 -2.914 2
1 758 . 1 1 A 67 67 LEU H H 67 8.498 9.069 -0.571 2
1 759 . 1 1 A 67 67 LEU HA H 67 4.713 5.037 -0.324 2
1 769 . 1 1 A 67 67 LEU C C 67 175.146 174.879 0.267 2
1 770 . 1 1 A 67 67 LEU CA C 67 52.518 53.589 -1.071 2
1 771 . 1 1 A 67 67 LEU CB C 67 45.308 44.505 0.803 2
1 775 . 1 1 A 67 67 LEU N N 67 122.208 125.292 -3.084 2
1 776 . 1 1 A 68 68 ASN H H 68 8.357 8.690 -0.333 2
1 777 . 1 1 A 68 68 ASN HA H 68 4.679 4.980 -0.301 2
1 782 . 1 1 A 68 68 ASN C C 68 176.228 175.415 0.813 2
1 783 . 1 1 A 68 68 ASN CA C 68 53.524 52.899 0.625 2
1 784 . 1 1 A 68 68 ASN CB C 68 39.580 39.650 -0.070 2
1 785 . 1 1 A 68 68 ASN N N 68 126.940 124.642 2.298 2
1 787 . 1 1 A 69 69 ASN H H 69 8.861 9.059 -0.198 2
1 788 . 1 1 A 69 69 ASN HA H 69 5.137 5.049 0.088 2
1 793 . 1 1 A 69 69 ASN C C 69 175.631 176.389 -0.758 2
1 794 . 1 1 A 69 69 ASN CA C 69 56.009 54.075 1.934 2
1 795 . 1 1 A 69 69 ASN CB C 69 40.314 38.822 1.492 2
1 796 . 1 1 A 69 69 ASN N N 69 124.980 122.864 2.116 2
1 798 . 1 1 A 70 70 THR H H 70 8.635 7.882 0.753 2
1 799 . 1 1 A 70 70 THR HA H 70 4.815 4.567 0.248 2
1 804 . 1 1 A 70 70 THR C C 70 176.223 175.714 0.509 2
1 805 . 1 1 A 70 70 THR CA C 70 63.944 62.831 1.113 2
1 806 . 1 1 A 70 70 THR CB C 70 69.727 70.182 -0.455 2
1 808 . 1 1 A 70 70 THR N N 70 110.394 110.422 -0.028 2
1 809 . 1 1 A 71 71 THR H H 71 8.069 7.898 0.171 2
1 810 . 1 1 A 71 71 THR HA H 71 4.566 4.614 -0.048 2
1 815 . 1 1 A 71 71 THR C C 71 176.213 175.552 0.661 2
1 816 . 1 1 A 71 71 THR CA C 71 61.683 61.939 -0.256 2
1 817 . 1 1 A 71 71 THR CB C 71 70.832 71.152 -0.320 2
1 819 . 1 1 A 71 71 THR N N 71 110.507 110.207 0.300 2
1 820 . 1 1 A 72 72 GLY H H 72 7.990 8.073 -0.083 2
1 821 . 1 1 A 72 72 GLY HA2 H 72 3.186 2.833 0.353 2
1 822 . 1 1 A 72 72 GLY HA3 H 72 2.516 3.535 -1.019 2
1 823 . 1 1 A 72 72 GLY C C 72 172.988 174.073 -1.085 2
1 824 . 1 1 A 72 72 GLY CA C 72 45.149 45.907 -0.758 2
1 825 . 1 1 A 72 72 GLY N N 72 110.788 112.052 -1.264 2
1 826 . 1 1 A 73 73 LEU H H 73 7.138 7.495 -0.357 2
1 827 . 1 1 A 73 73 LEU HA H 73 4.414 4.655 -0.241 2
1 837 . 1 1 A 73 73 LEU C C 73 176.836 174.898 1.938 2
1 838 . 1 1 A 73 73 LEU CA C 73 55.252 53.623 1.629 2
1 839 . 1 1 A 73 73 LEU CB C 73 43.574 44.529 -0.955 2
1 843 . 1 1 A 73 73 LEU N N 73 119.222 121.542 -2.320 2
1 844 . 1 1 A 74 74 ILE H H 74 8.925 8.751 0.174 2
1 845 . 1 1 A 74 74 ILE HA H 74 5.555 4.982 0.573 2
1 855 . 1 1 A 74 74 ILE C C 74 175.978 175.528 0.450 2
1 856 . 1 1 A 74 74 ILE CA C 74 60.100 60.441 -0.341 2
1 857 . 1 1 A 74 74 ILE CB C 74 38.550 38.842 -0.292 2
1 861 . 1 1 A 74 74 ILE N N 74 129.871 127.371 2.500 2
1 862 . 1 1 A 75 75 THR H H 75 9.161 8.764 0.397 2
1 863 . 1 1 A 75 75 THR HA H 75 5.375 5.421 -0.046 2
1 868 . 1 1 A 75 75 THR C C 75 174.798 173.603 1.195 2
1 869 . 1 1 A 75 75 THR CA C 75 58.796 59.581 -0.785 2
1 870 . 1 1 A 75 75 THR CB C 75 72.978 71.837 1.141 2
1 872 . 1 1 A 75 75 THR N N 75 117.522 118.028 -0.506 2
1 873 . 1 1 A 76 76 VAL H H 76 8.327 8.702 -0.375 2
1 874 . 1 1 A 76 76 VAL HA H 76 3.973 3.852 0.121 2
1 882 . 1 1 A 76 76 VAL C C 76 176.495 175.963 0.532 2
1 883 . 1 1 A 76 76 VAL CA C 76 64.085 63.153 0.932 2
1 884 . 1 1 A 76 76 VAL CB C 76 32.863 31.327 1.536 2
1 887 . 1 1 A 76 76 VAL N N 76 120.876 122.424 -1.548 2
1 888 . 1 1 A 77 77 GLN H H 77 9.525 9.053 0.472 2
1 889 . 1 1 A 77 77 GLN HA H 77 4.702 4.270 0.432 2
1 896 . 1 1 A 77 77 GLN C C 77 173.838 175.222 -1.384 2
1 897 . 1 1 A 77 77 GLN CA C 77 55.728 57.193 -1.465 2
1 898 . 1 1 A 77 77 GLN CB C 77 30.762 30.154 0.608 2
1 900 . 1 1 A 77 77 GLN N N 77 129.825 128.746 1.079 2
1 902 . 1 1 A 78 78 ARG H H 78 7.621 7.308 0.313 2
1 903 . 1 1 A 78 78 ARG HA H 78 4.347 4.715 -0.368 2
1 910 . 1 1 A 78 78 ARG C C 78 172.304 175.091 -2.787 2
1 911 . 1 1 A 78 78 ARG CA C 78 54.634 54.041 0.593 2
1 912 . 1 1 A 78 78 ARG CB C 78 34.685 34.828 -0.143 2
1 915 . 1 1 A 78 78 ARG N N 78 120.595 117.276 3.319 2
1 916 . 1 1 A 79 79 SER H H 79 7.958 8.510 -0.552 2
1 917 . 1 1 A 79 79 SER HA H 79 4.030 4.339 -0.309 2
1 920 . 1 1 A 79 79 SER C C 79 174.311 174.436 -0.126 2
1 921 . 1 1 A 79 79 SER CA C 79 59.889 59.040 0.849 2
1 922 . 1 1 A 79 79 SER CB C 79 63.548 63.689 -0.141 2
1 923 . 1 1 A 79 79 SER N N 79 112.565 117.586 -5.021 2
1 924 . 1 1 A 80 80 LEU H H 80 8.715 8.186 0.529 2
1 925 . 1 1 A 80 80 LEU HA H 80 4.114 4.908 -0.794 2
1 935 . 1 1 A 80 80 LEU C C 80 176.057 175.765 0.292 2
1 936 . 1 1 A 80 80 LEU CA C 80 55.091 53.590 1.501 2
1 937 . 1 1 A 80 80 LEU CB C 80 42.341 44.542 -2.201 2
1 941 . 1 1 A 80 80 LEU N N 80 123.070 124.555 -1.485 2
1 942 . 1 1 A 81 81 ASP H H 81 7.298 8.756 -1.458 2
1 943 . 1 1 A 81 81 ASP HA H 81 4.725 5.296 -0.571 2
1 946 . 1 1 A 81 81 ASP C C 81 175.939 175.985 -0.046 2
1 947 . 1 1 A 81 81 ASP CA C 81 53.664 52.935 0.729 2
1 948 . 1 1 A 81 81 ASP CB C 81 42.947 43.515 -0.568 2
1 949 . 1 1 A 81 81 ASP N N 81 115.229 121.468 -6.239 2
1 950 . 1 1 A 82 82 ARG H H 82 9.289 8.796 0.493 2
1 951 . 1 1 A 82 82 ARG HA H 82 4.416 4.322 0.094 2
1 959 . 1 1 A 82 82 ARG C C 82 176.406 178.120 -1.714 2
1 960 . 1 1 A 82 82 ARG CA C 82 56.397 58.695 -2.298 2
1 961 . 1 1 A 82 82 ARG CB C 82 30.638 30.307 0.331 2
1 964 . 1 1 A 82 82 ARG N N 82 123.174 125.521 -2.347 2
1 966 . 1 1 A 83 83 GLU H H 83 8.468 8.311 0.157 2
1 967 . 1 1 A 83 83 GLU HA H 83 3.982 4.077 -0.095 2
1 972 . 1 1 A 83 83 GLU C C 83 177.740 178.553 -0.813 2
1 973 . 1 1 A 83 83 GLU CA C 83 58.425 59.241 -0.816 2
1 974 . 1 1 A 83 83 GLU CB C 83 29.701 29.039 0.662 2
1 976 . 1 1 A 83 83 GLU N N 83 119.549 118.002 1.547 2
1 977 . 1 1 A 84 84 GLU H H 84 8.033 7.905 0.128 2
1 978 . 1 1 A 84 84 GLU HA H 84 4.206 4.291 -0.085 2
1 983 . 1 1 A 84 84 GLU C C 84 176.837 175.905 0.932 2
1 984 . 1 1 A 84 84 GLU CA C 84 58.056 58.274 -0.218 2
1 985 . 1 1 A 84 84 GLU CB C 84 30.432 30.939 -0.507 2
1 987 . 1 1 A 84 84 GLU N N 84 118.333 119.287 -0.954 2
1 988 . 1 1 A 85 85 THR H H 85 7.651 7.518 0.133 2
1 989 . 1 1 A 85 85 THR HA H 85 4.307 4.614 -0.307 2
1 994 . 1 1 A 85 85 THR C C 85 171.568 173.752 -2.184 2
1 995 . 1 1 A 85 85 THR CA C 85 61.387 59.799 1.588 2
1 996 . 1 1 A 85 85 THR CB C 85 69.963 70.764 -0.801 2
1 998 . 1 1 A 85 85 THR N N 85 112.444 112.260 0.184 2
1 999 . 1 1 A 86 86 ALA H H 86 8.639 8.544 0.095 2
1 1000 . 1 1 A 86 86 ALA HA H 86 4.603 4.387 0.216 2
1 1004 . 1 1 A 86 86 ALA C C 86 175.560 177.096 -1.536 2
1 1005 . 1 1 A 86 86 ALA CA C 86 52.156 53.518 -1.362 2
1 1006 . 1 1 A 86 86 ALA CB C 86 20.378 20.250 0.128 2
1 1007 . 1 1 A 86 86 ALA N N 86 127.705 127.800 -0.095 2
1 1008 . 1 1 A 87 87 ILE H H 87 7.663 7.670 -0.007 2
1 1009 . 1 1 A 87 87 ILE HA H 87 4.828 4.701 0.127 2
1 1019 . 1 1 A 87 87 ILE C C 87 174.537 174.457 0.080 2
1 1020 . 1 1 A 87 87 ILE CA C 87 60.329 60.070 0.259 2
1 1021 . 1 1 A 87 87 ILE CB C 87 41.090 40.414 0.676 2
1 1025 . 1 1 A 87 87 ILE N N 87 118.712 117.221 1.491 2
1 1026 . 1 1 A 88 88 HIS H H 88 9.098 8.893 0.205 2
1 1027 . 1 1 A 88 88 HIS HA H 88 4.576 5.189 -0.613 2
1 1032 . 1 1 A 88 88 HIS C C 88 174.354 174.267 0.087 2
1 1033 . 1 1 A 88 88 HIS CA C 88 54.740 54.301 0.439 2
1 1034 . 1 1 A 88 88 HIS CB C 88 33.955 32.166 1.789 2
1 1037 . 1 1 A 88 88 HIS N N 88 126.285 125.534 0.751 2
1 1038 . 1 1 A 89 89 LYS H H 89 8.957 8.956 0.001 2
1 1039 . 1 1 A 89 89 LYS HA H 89 4.873 4.742 0.131 2
1 1048 . 1 1 A 89 89 LYS C C 89 175.906 175.495 0.411 2
1 1049 . 1 1 A 89 89 LYS CA C 89 55.269 55.354 -0.085 2
1 1050 . 1 1 A 89 89 LYS CB C 89 32.945 33.502 -0.557 2
1 1054 . 1 1 A 89 89 LYS N N 89 124.332 123.730 0.602 2
1 1055 . 1 1 A 90 90 VAL H H 90 9.174 8.747 0.427 2
1 1056 . 1 1 A 90 90 VAL HA H 90 4.227 4.923 -0.696 2
1 1064 . 1 1 A 90 90 VAL C C 90 174.168 174.724 -0.556 2
1 1065 . 1 1 A 90 90 VAL CA C 90 61.369 61.093 0.276 2
1 1066 . 1 1 A 90 90 VAL CB C 90 34.082 34.364 -0.282 2
1 1069 . 1 1 A 90 90 VAL N N 90 124.319 125.192 -0.873 2
1 1070 . 1 1 A 91 91 THR H H 91 6.697 8.961 -2.264 2
1 1071 . 1 1 A 91 91 THR HA H 91 5.163 5.132 0.031 2
1 1076 . 1 1 A 91 91 THR C C 91 173.812 173.895 -0.083 2
1 1077 . 1 1 A 91 91 THR CA C 91 61.935 61.859 0.076 2
1 1078 . 1 1 A 91 91 THR CB C 91 70.412 70.373 0.039 2
1 1080 . 1 1 A 91 91 THR N N 91 122.637 123.860 -1.223 2
1 1081 . 1 1 A 92 92 VAL H H 92 9.292 8.754 0.538 2
1 1082 . 1 1 A 92 92 VAL HA H 92 4.736 4.720 0.016 2
1 1090 . 1 1 A 92 92 VAL C C 92 173.160 174.945 -1.785 2
1 1091 . 1 1 A 92 92 VAL CA C 92 60.982 61.013 -0.031 2
1 1092 . 1 1 A 92 92 VAL CB C 92 35.130 33.876 1.254 2
1 1095 . 1 1 A 92 92 VAL N N 92 128.265 127.228 1.037 2
1 1096 . 1 1 A 93 93 LEU H H 93 9.495 8.840 0.655 2
1 1097 . 1 1 A 93 93 LEU HA H 93 5.628 5.622 0.006 2
1 1107 . 1 1 A 93 93 LEU C C 93 176.274 175.625 0.649 2
1 1108 . 1 1 A 93 93 LEU CA C 93 52.773 53.615 -0.842 2
1 1109 . 1 1 A 93 93 LEU CB C 93 43.454 44.431 -0.977 2
1 1113 . 1 1 A 93 93 LEU N N 93 126.350 127.025 -0.675 2
1 1114 . 1 1 A 94 94 ALA H H 94 8.688 8.932 -0.244 2
1 1115 . 1 1 A 94 94 ALA HA H 94 4.986 5.115 -0.129 2
1 1119 . 1 1 A 94 94 ALA C C 94 175.787 175.815 -0.028 2
1 1120 . 1 1 A 94 94 ALA CA C 94 49.610 50.383 -0.773 2
1 1121 . 1 1 A 94 94 ALA CB C 94 21.463 20.834 0.629 2
1 1122 . 1 1 A 94 94 ALA N N 94 123.429 127.129 -3.700 2
1 1123 . 1 1 A 95 95 SER H H 95 8.401 8.467 -0.066 2
1 1124 . 1 1 A 95 95 SER HA H 95 4.828 5.072 -0.244 2
1 1127 . 1 1 A 95 95 SER C C 95 174.327 173.453 0.874 2
1 1128 . 1 1 A 95 95 SER CA C 95 56.239 56.395 -0.156 2
1 1129 . 1 1 A 95 95 SER CB C 95 65.561 65.052 0.509 2
1 1130 . 1 1 A 95 95 SER N N 95 114.418 117.735 -3.317 2
1 1131 . 1 1 A 96 96 ASP H H 96 8.690 8.796 -0.106 2
1 1132 . 1 1 A 96 96 ASP HA H 96 4.908 4.754 0.154 2
1 1135 . 1 1 A 96 96 ASP C C 96 177.096 176.325 0.771 2
1 1136 . 1 1 A 96 96 ASP CA C 96 52.818 54.436 -1.618 2
1 1137 . 1 1 A 96 96 ASP CB C 96 41.253 42.034 -0.781 2
1 1138 . 1 1 A 96 96 ASP N N 96 125.624 124.913 0.711 2
1 1139 . 1 1 A 97 97 GLY H H 97 8.524 7.581 0.943 2
1 1140 . 1 1 A 97 97 GLY HA2 H 97 4.320 4.037 0.283 2
1 1141 . 1 1 A 97 97 GLY HA3 H 97 3.620 4.038 -0.418 2
1 1142 . 1 1 A 97 97 GLY C C 97 174.620 173.609 1.011 2
1 1143 . 1 1 A 97 97 GLY CA C 97 45.422 45.667 -0.245 2
1 1144 . 1 1 A 97 97 GLY N N 97 109.283 107.196 2.087 2
1 1145 . 1 1 A 98 98 SER H H 98 8.575 8.164 0.411 2
1 1146 . 1 1 A 98 98 SER HA H 98 4.607 4.642 -0.035 2
1 1149 . 1 1 A 98 98 SER C C 98 174.478 173.762 0.717 2
1 1150 . 1 1 A 98 98 SER CA C 98 59.095 57.546 1.549 2
1 1151 . 1 1 A 98 98 SER CB C 98 64.800 64.672 0.128 2
1 1152 . 1 1 A 98 98 SER N N 98 116.640 116.610 0.030 2
1 1153 . 1 1 A 99 99 SER H H 99 8.945 8.274 0.671 2
1 1154 . 1 1 A 99 99 SER HA H 99 4.530 4.505 0.025 2
1 1157 . 1 1 A 99 99 SER C C 99 174.491 173.900 0.591 2
1 1158 . 1 1 A 99 99 SER CA C 99 58.460 59.440 -0.980 2
1 1159 . 1 1 A 99 99 SER CB C 99 64.146 64.278 -0.132 2
1 1160 . 1 1 A 99 99 SER N N 99 117.676 116.832 0.844 2
1 1161 . 1 1 A 100 100 THR H H 100 8.411 8.224 0.187 2
1 1162 . 1 1 A 100 100 THR HA H 100 4.490 4.515 -0.025 2
1 1167 . 1 1 A 100 100 THR C C 100 172.766 173.056 -0.290 2
1 1168 . 1 1 A 100 100 THR CA C 100 60.629 60.183 0.446 2
1 1169 . 1 1 A 100 100 THR CB C 100 69.778 69.696 0.082 2
1 1171 . 1 1 A 100 100 THR N N 100 118.401 116.134 2.267 2
1 1172 . 1 1 A 101 101 PRO HA H 101 4.631 4.707 -0.076 2
1 1179 . 1 1 A 101 101 PRO C C 101 177.227 176.110 1.117 2
1 1180 . 1 1 A 101 101 PRO CA C 101 63.097 62.292 0.805 2
1 1181 . 1 1 A 101 101 PRO CB C 101 32.917 32.405 0.512 2
1 1184 . 1 1 A 102 102 ALA H H 102 8.497 8.070 0.427 2
1 1185 . 1 1 A 102 102 ALA HA H 102 4.619 4.658 -0.039 2
1 1189 . 1 1 A 102 102 ALA C C 102 176.542 177.245 -0.703 2
1 1190 . 1 1 A 102 102 ALA CA C 102 51.390 51.894 -0.504 2
1 1191 . 1 1 A 102 102 ALA CB C 102 20.815 20.188 0.627 2
1 1192 . 1 1 A 102 102 ALA N N 102 124.487 123.400 1.087 2
1 1193 . 1 1 A 103 103 ARG H H 103 8.663 8.818 -0.155 2
1 1194 . 1 1 A 103 103 ARG HA H 103 5.515 5.209 0.306 2
1 1201 . 1 1 A 103 103 ARG C C 103 174.539 175.161 -0.622 2
1 1202 . 1 1 A 103 103 ARG CA C 103 55.164 54.814 0.350 2
1 1203 . 1 1 A 103 103 ARG CB C 103 34.393 32.978 1.415 2
1 1206 . 1 1 A 103 103 ARG N N 103 119.596 120.128 -0.532 2
1 1207 . 1 1 A 104 104 ALA H H 104 9.027 8.433 0.594 2
1 1208 . 1 1 A 104 104 ALA HA H 104 4.782 5.037 -0.255 2
1 1212 . 1 1 A 104 104 ALA C C 104 176.276 175.465 0.811 2
1 1213 . 1 1 A 104 104 ALA CA C 104 50.297 50.997 -0.700 2
1 1214 . 1 1 A 104 104 ALA CB C 104 20.810 21.443 -0.633 2
1 1215 . 1 1 A 104 104 ALA N N 104 126.962 123.551 3.411 2
1 1216 . 1 1 A 105 105 THR H H 105 8.384 8.702 -0.318 2
1 1217 . 1 1 A 105 105 THR HA H 105 4.954 4.831 0.123 2
1 1222 . 1 1 A 105 105 THR C C 105 173.243 173.951 -0.708 2
1 1223 . 1 1 A 105 105 THR CA C 105 61.475 62.218 -0.743 2
1 1224 . 1 1 A 105 105 THR CB C 105 70.569 69.965 0.604 2
1 1226 . 1 1 A 105 105 THR N N 105 115.327 118.603 -3.276 2
1 1227 . 1 1 A 106 106 VAL H H 106 8.970 8.743 0.227 2
1 1228 . 1 1 A 106 106 VAL HA H 106 4.702 4.648 0.054 2
1 1236 . 1 1 A 106 106 VAL C C 106 174.743 174.974 -0.231 2
1 1237 . 1 1 A 106 106 VAL CA C 106 59.712 60.933 -1.221 2
1 1238 . 1 1 A 106 106 VAL CB C 106 34.327 33.643 0.684 2
1 1241 . 1 1 A 106 106 VAL N N 106 126.226 127.180 -0.954 2
1 1242 . 1 1 A 107 107 THR H H 107 8.833 8.654 0.179 2
1 1243 . 1 1 A 107 107 THR HA H 107 4.862 4.712 0.150 2
1 1248 . 1 1 A 107 107 THR C C 107 172.970 174.008 -1.038 2
1 1249 . 1 1 A 107 107 THR CA C 107 62.322 62.380 -0.058 2
1 1250 . 1 1 A 107 107 THR CB C 107 69.463 69.362 0.101 2
1 1252 . 1 1 A 107 107 THR N N 107 125.403 122.851 2.552 2
1 1253 . 1 1 A 108 108 ILE H H 108 9.234 8.906 0.328 2
1 1254 . 1 1 A 108 108 ILE HA H 108 4.178 4.654 -0.476 2
1 1264 . 1 1 A 108 108 ILE C C 108 174.087 174.887 -0.800 2
1 1265 . 1 1 A 108 108 ILE CA C 108 60.365 60.322 0.043 2
1 1266 . 1 1 A 108 108 ILE CB C 108 39.745 39.184 0.561 2
1 1270 . 1 1 A 108 108 ILE N N 108 127.152 128.396 -1.244 2
1 1271 . 1 1 A 109 109 ASN H H 109 8.723 8.886 -0.163 2
1 1272 . 1 1 A 109 109 ASN HA H 109 5.147 5.238 -0.091 2
1 1277 . 1 1 A 109 109 ASN C C 109 173.592 174.637 -1.044 2
1 1278 . 1 1 A 109 109 ASN CA C 109 52.501 52.839 -0.338 2
1 1279 . 1 1 A 109 109 ASN CB C 109 40.791 40.123 0.668 2
1 1280 . 1 1 A 109 109 ASN N N 109 126.866 126.194 0.672 2
1 1282 . 1 1 A 110 110 VAL H H 110 9.046 8.631 0.415 2
1 1283 . 1 1 A 110 110 VAL HA H 110 5.081 4.866 0.215 2
1 1291 . 1 1 A 110 110 VAL C C 110 176.921 176.050 0.870 2
1 1292 . 1 1 A 110 110 VAL CA C 110 61.634 61.783 -0.149 2
1 1293 . 1 1 A 110 110 VAL CB C 110 31.809 32.561 -0.752 2
1 1296 . 1 1 A 110 110 VAL N N 110 126.070 123.995 2.075 2
1 1297 . 1 1 A 111 111 THR H H 111 9.197 8.650 0.547 2
1 1298 . 1 1 A 111 111 THR HA H 111 4.566 5.016 -0.450 2
1 1303 . 1 1 A 111 111 THR C C 111 174.087 174.148 -0.061 2
1 1304 . 1 1 A 111 111 THR CA C 111 61.145 59.929 1.216 2
1 1305 . 1 1 A 111 111 THR CB C 111 70.706 71.182 -0.476 2
1 1307 . 1 1 A 111 111 THR N N 111 121.425 118.719 2.706 2
1 1308 . 1 1 A 112 112 ASP H H 112 8.435 8.600 -0.165 2
1 1309 . 1 1 A 112 112 ASP HA H 112 4.656 4.821 -0.165 2
1 1312 . 1 1 A 112 112 ASP C C 112 176.745 176.177 0.568 2
1 1313 . 1 1 A 112 112 ASP CA C 112 54.158 54.009 0.149 2
1 1314 . 1 1 A 112 112 ASP CB C 112 41.575 41.977 -0.402 2
1 1315 . 1 1 A 112 112 ASP N N 112 119.566 122.119 -2.553 2
1 1316 . 1 1 A 113 113 VAL H H 113 8.629 8.555 0.074 2
1 1317 . 1 1 A 113 113 VAL HA H 113 4.078 4.540 -0.462 2
1 1325 . 1 1 A 113 113 VAL C C 113 175.247 175.490 -0.243 2
1 1326 . 1 1 A 113 113 VAL CA C 113 62.533 61.170 1.363 2
1 1327 . 1 1 A 113 113 VAL CB C 113 32.534 34.057 -1.524 2
1 1330 . 1 1 A 113 113 VAL N N 113 119.356 117.882 1.474 2
stop_
save_