data_10267_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 10267
_Entry.PDB_ID 2EDZ
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 1 A 6 6 SER HA H 6 4.483 5.058 -0.575 1
1 4 . 1 1 1 A 6 6 SER C C 6 175.167 174.446 0.721 1
1 5 . 1 1 1 A 6 6 SER CA C 6 58.759 57.566 1.193 1
1 6 . 1 1 1 A 6 6 SER CB C 6 64.069 65.601 -1.532 1
1 7 . 1 1 1 A 7 7 GLY H H 7 8.431 8.511 -0.080 1
1 8 . 1 1 1 A 7 7 GLY HA2 H 7 3.973 4.073 -0.100 1
1 9 . 1 1 1 A 7 7 GLY HA3 H 7 3.973 4.074 -0.101 1
1 10 . 1 1 1 A 7 7 GLY C C 7 174.570 174.682 -0.112 1
1 11 . 1 1 1 A 7 7 GLY CA C 7 45.483 46.095 -0.612 1
1 12 . 1 1 1 A 7 7 GLY N N 7 110.640 113.163 -2.523 1
1 13 . 1 1 1 A 8 8 MET H H 8 8.239 8.102 0.137 1
1 14 . 1 1 1 A 8 8 MET HA H 8 4.386 4.428 -0.042 1
1 22 . 1 1 1 A 8 8 MET C C 8 176.621 176.051 0.570 1
1 23 . 1 1 1 A 8 8 MET CA C 8 55.991 55.220 0.771 1
1 24 . 1 1 1 A 8 8 MET CB C 8 32.986 34.048 -1.062 1
1 27 . 1 1 1 A 8 8 MET N N 8 120.219 117.787 2.432 1
1 28 . 1 1 1 A 9 9 ALA H H 9 8.435 8.736 -0.301 1
1 29 . 1 1 1 A 9 9 ALA HA H 9 4.182 4.378 -0.196 1
1 33 . 1 1 1 A 9 9 ALA C C 9 177.951 176.757 1.194 1
1 34 . 1 1 1 A 9 9 ALA CA C 9 53.399 54.114 -0.715 1
1 35 . 1 1 1 A 9 9 ALA CB C 9 18.955 19.631 -0.676 1
1 36 . 1 1 1 A 9 9 ALA N N 9 124.459 122.635 1.824 1
1 37 . 1 1 1 A 10 10 SER H H 10 8.100 7.654 0.446 1
1 38 . 1 1 1 A 10 10 SER HA H 10 4.391 4.701 -0.310 1
1 41 . 1 1 1 A 10 10 SER C C 10 174.467 172.321 2.146 1
1 42 . 1 1 1 A 10 10 SER CA C 10 58.709 57.678 1.031 1
1 43 . 1 1 1 A 10 10 SER CB C 10 63.778 66.690 -2.912 1
1 44 . 1 1 1 A 10 10 SER N N 10 113.881 109.640 4.241 1
1 45 . 1 1 1 A 11 11 THR H H 11 7.821 8.216 -0.395 1
1 46 . 1 1 1 A 11 11 THR HA H 11 4.191 4.991 -0.800 1
1 51 . 1 1 1 A 11 11 THR C C 11 173.610 172.090 1.520 1
1 52 . 1 1 1 A 11 11 THR CA C 11 61.936 60.336 1.600 1
1 53 . 1 1 1 A 11 11 THR CB C 11 69.713 71.827 -2.114 1
1 55 . 1 1 1 A 11 11 THR N N 11 114.471 112.399 2.072 1
1 56 . 1 1 1 A 12 12 PHE H H 12 7.946 8.969 -1.023 1
1 57 . 1 1 1 A 12 12 PHE HA H 12 4.769 4.861 -0.092 1
1 65 . 1 1 1 A 12 12 PHE C C 12 174.211 175.351 -1.140 1
1 66 . 1 1 1 A 12 12 PHE CA C 12 56.644 57.891 -1.247 1
1 67 . 1 1 1 A 12 12 PHE CB C 12 40.609 40.330 0.279 1
1 73 . 1 1 1 A 12 12 PHE N N 12 120.763 122.635 -1.872 1
1 74 . 1 1 1 A 13 13 ASN H H 13 9.004 8.670 0.334 1
1 75 . 1 1 1 A 13 13 ASN HA H 13 5.366 5.503 -0.137 1
1 80 . 1 1 1 A 13 13 ASN C C 13 172.158 172.738 -0.580 1
1 81 . 1 1 1 A 13 13 ASN CA C 13 50.988 50.558 0.430 1
1 82 . 1 1 1 A 13 13 ASN CB C 13 39.942 39.201 0.741 1
1 83 . 1 1 1 A 13 13 ASN N N 13 119.973 118.477 1.496 1
1 85 . 1 1 1 A 14 14 PRO HA H 14 4.945 4.594 0.351 1
1 92 . 1 1 1 A 14 14 PRO C C 14 174.901 175.614 -0.713 1
1 93 . 1 1 1 A 14 14 PRO CA C 14 63.096 62.789 0.307 1
1 94 . 1 1 1 A 14 14 PRO CB C 14 32.739 32.777 -0.038 1
1 97 . 1 1 1 A 15 15 ARG H H 15 8.908 8.576 0.332 1
1 98 . 1 1 1 A 15 15 ARG HA H 15 4.626 4.644 -0.018 1
1 106 . 1 1 1 A 15 15 ARG C C 15 174.432 175.569 -1.137 1
1 107 . 1 1 1 A 15 15 ARG CA C 15 54.827 55.143 -0.316 1
1 108 . 1 1 1 A 15 15 ARG CB C 15 32.439 32.207 0.232 1
1 111 . 1 1 1 A 15 15 ARG N N 15 118.947 121.717 -2.770 1
1 113 . 1 1 1 A 16 16 GLU H H 16 8.838 8.993 -0.155 1
1 114 . 1 1 1 A 16 16 GLU HA H 16 4.876 4.598 0.278 1
1 119 . 1 1 1 A 16 16 GLU C C 16 175.767 175.504 0.263 1
1 120 . 1 1 1 A 16 16 GLU CA C 16 55.621 56.326 -0.705 1
1 121 . 1 1 1 A 16 16 GLU CB C 16 31.093 30.671 0.422 1
1 123 . 1 1 1 A 16 16 GLU N N 16 125.316 127.930 -2.614 1
1 124 . 1 1 1 A 17 17 CYS H H 17 9.327 8.513 0.814 1
1 125 . 1 1 1 A 17 17 CYS HA H 17 4.804 5.137 -0.333 1
1 128 . 1 1 1 A 17 17 CYS C C 17 172.973 173.217 -0.244 1
1 129 . 1 1 1 A 17 17 CYS CA C 17 57.930 57.687 0.243 1
1 130 . 1 1 1 A 17 17 CYS CB C 17 30.105 31.758 -1.653 1
1 131 . 1 1 1 A 17 17 CYS N N 17 127.909 122.515 5.394 1
1 132 . 1 1 1 A 18 18 LYS H H 18 9.022 8.824 0.198 1
1 133 . 1 1 1 A 18 18 LYS HA H 18 4.769 4.754 0.015 1
1 142 . 1 1 1 A 18 18 LYS C C 18 174.586 175.371 -0.785 1
1 143 . 1 1 1 A 18 18 LYS CA C 18 55.956 55.030 0.926 1
1 144 . 1 1 1 A 18 18 LYS CB C 18 32.203 33.546 -1.343 1
1 148 . 1 1 1 A 18 18 LYS N N 18 127.039 124.228 2.811 1
1 149 . 1 1 1 A 19 19 LEU H H 19 8.784 8.891 -0.107 1
1 150 . 1 1 1 A 19 19 LEU HA H 19 4.852 4.864 -0.012 1
1 160 . 1 1 1 A 19 19 LEU C C 19 176.862 175.960 0.902 1
1 161 . 1 1 1 A 19 19 LEU CA C 19 55.391 53.867 1.524 1
1 162 . 1 1 1 A 19 19 LEU CB C 19 44.442 42.775 1.667 1
1 166 . 1 1 1 A 19 19 LEU N N 19 126.311 126.198 0.113 1
1 167 . 1 1 1 A 20 20 SER H H 20 8.215 8.917 -0.702 1
1 168 . 1 1 1 A 20 20 SER HA H 20 5.461 5.461 0.000 1
1 171 . 1 1 1 A 20 20 SER C C 20 171.960 173.382 -1.422 1
1 172 . 1 1 1 A 20 20 SER CA C 20 57.525 56.809 0.716 1
1 173 . 1 1 1 A 20 20 SER CB C 20 65.794 65.835 -0.041 1
1 174 . 1 1 1 A 20 20 SER N N 20 115.113 117.368 -2.255 1
1 175 . 1 1 1 A 21 21 LYS H H 21 9.001 8.780 0.221 1
1 176 . 1 1 1 A 21 21 LYS HA H 21 4.887 4.937 -0.050 1
1 185 . 1 1 1 A 21 21 LYS C C 21 174.133 175.019 -0.886 1
1 186 . 1 1 1 A 21 21 LYS CA C 21 53.840 54.178 -0.338 1
1 187 . 1 1 1 A 21 21 LYS CB C 21 36.553 35.789 0.764 1
1 191 . 1 1 1 A 21 21 LYS N N 21 120.938 121.330 -0.392 1
1 192 . 1 1 1 A 22 22 GLN H H 22 8.201 8.277 -0.076 1
1 193 . 1 1 1 A 22 22 GLN HA H 22 4.448 4.536 -0.088 1
1 200 . 1 1 1 A 22 22 GLN C C 22 176.372 175.242 1.130 1
1 201 . 1 1 1 A 22 22 GLN CA C 22 53.658 54.395 -0.737 1
1 202 . 1 1 1 A 22 22 GLN CB C 22 30.473 30.103 0.370 1
1 204 . 1 1 1 A 22 22 GLN N N 22 116.816 119.256 -2.440 1
1 206 . 1 1 1 A 23 23 GLU H H 23 8.624 8.607 0.017 1
1 207 . 1 1 1 A 23 23 GLU HA H 23 4.056 4.103 -0.047 1
1 212 . 1 1 1 A 23 23 GLU C C 23 177.778 176.951 0.827 1
1 213 . 1 1 1 A 23 23 GLU CA C 23 58.001 57.596 0.405 1
1 214 . 1 1 1 A 23 23 GLU CB C 23 29.237 29.168 0.069 1
1 216 . 1 1 1 A 23 23 GLU N N 23 122.364 121.123 1.241 1
1 217 . 1 1 1 A 24 24 GLY H H 24 8.962 8.911 0.051 1
1 218 . 1 1 1 A 24 24 GLY HA2 H 24 4.139 3.968 0.171 1
1 219 . 1 1 1 A 24 24 GLY HA3 H 24 3.711 3.971 -0.260 1
1 220 . 1 1 1 A 24 24 GLY C C 24 173.857 174.763 -0.906 1
1 221 . 1 1 1 A 24 24 GLY CA C 24 45.288 45.039 0.249 1
1 222 . 1 1 1 A 24 24 GLY N N 24 113.942 113.248 0.694 1
1 223 . 1 1 1 A 25 25 GLN H H 25 7.643 7.642 0.001 1
1 224 . 1 1 1 A 25 25 GLN HA H 25 4.488 4.347 0.141 1
1 231 . 1 1 1 A 25 25 GLN C C 25 174.727 174.303 0.424 1
1 232 . 1 1 1 A 25 25 GLN CA C 25 54.052 56.020 -1.968 1
1 233 . 1 1 1 A 25 25 GLN CB C 25 30.843 30.238 0.605 1
1 235 . 1 1 1 A 25 25 GLN N N 25 119.538 120.366 -0.828 1
1 237 . 1 1 1 A 26 26 ASN H H 26 8.625 8.372 0.253 1
1 238 . 1 1 1 A 26 26 ASN HA H 26 4.862 4.964 -0.102 1
1 243 . 1 1 1 A 26 26 ASN C C 26 176.261 175.305 0.956 1
1 244 . 1 1 1 A 26 26 ASN CA C 26 51.812 51.722 0.090 1
1 245 . 1 1 1 A 26 26 ASN CB C 26 40.403 40.945 -0.542 1
1 246 . 1 1 1 A 26 26 ASN N N 26 120.047 119.817 0.230 1
1 248 . 1 1 1 A 27 27 TYR HA H 27 4.152 4.461 -0.309 1
1 255 . 1 1 1 A 27 27 TYR C C 27 176.731 175.789 0.942 1
1 256 . 1 1 1 A 27 27 TYR CA C 27 62.462 60.128 2.334 1
1 257 . 1 1 1 A 27 27 TYR CB C 27 40.240 38.808 1.432 1
1 262 . 1 1 1 A 27 27 TYR N N 27 121.761 123.007 -1.246 1
1 263 . 1 1 1 A 28 28 GLY H H 28 8.285 8.177 0.108 1
1 264 . 1 1 1 A 28 28 GLY HA2 H 28 4.490 4.066 0.424 1
1 265 . 1 1 1 A 28 28 GLY HA3 H 28 3.759 4.111 -0.352 1
1 266 . 1 1 1 A 28 28 GLY C C 28 172.198 174.126 -1.928 1
1 267 . 1 1 1 A 28 28 GLY CA C 28 46.139 45.311 0.828 1
1 268 . 1 1 1 A 28 28 GLY N N 28 103.567 107.262 -3.695 1
1 269 . 1 1 1 A 29 29 PHE H H 29 6.878 7.944 -1.066 1
1 270 . 1 1 1 A 29 29 PHE HA H 29 5.179 5.286 -0.107 1
1 278 . 1 1 1 A 29 29 PHE C C 29 172.840 173.969 -1.129 1
1 279 . 1 1 1 A 29 29 PHE CA C 29 55.262 55.217 0.045 1
1 280 . 1 1 1 A 29 29 PHE CB C 29 41.779 42.514 -0.735 1
1 286 . 1 1 1 A 29 29 PHE N N 29 111.027 117.650 -6.623 1
1 287 . 1 1 1 A 30 30 PHE H H 30 8.806 8.679 0.127 1
1 288 . 1 1 1 A 30 30 PHE HA H 30 4.923 4.695 0.228 1
1 296 . 1 1 1 A 30 30 PHE C C 30 174.501 174.822 -0.321 1
1 297 . 1 1 1 A 30 30 PHE CA C 30 55.356 55.904 -0.548 1
1 298 . 1 1 1 A 30 30 PHE CB C 30 41.681 43.224 -1.543 1
1 304 . 1 1 1 A 30 30 PHE N N 30 118.710 117.082 1.628 1
1 305 . 1 1 1 A 31 31 LEU H H 31 8.441 8.997 -0.556 1
1 306 . 1 1 1 A 31 31 LEU HA H 31 5.447 5.087 0.360 1
1 316 . 1 1 1 A 31 31 LEU C C 31 177.306 175.997 1.309 1
1 317 . 1 1 1 A 31 31 LEU CA C 31 53.610 54.194 -0.584 1
1 318 . 1 1 1 A 31 31 LEU CB C 31 43.696 41.508 2.188 1
1 322 . 1 1 1 A 31 31 LEU N N 31 123.765 124.026 -0.261 1
1 323 . 1 1 1 A 32 32 ARG H H 32 9.381 9.210 0.171 1
1 324 . 1 1 1 A 32 32 ARG HA H 32 4.840 4.830 0.010 1
1 331 . 1 1 1 A 32 32 ARG C C 32 175.155 175.324 -0.169 1
1 332 . 1 1 1 A 32 32 ARG CA C 32 54.210 53.940 0.270 1
1 333 . 1 1 1 A 32 32 ARG CB C 32 35.087 33.560 1.527 1
1 336 . 1 1 1 A 32 32 ARG N N 32 123.160 123.863 -0.703 1
1 337 . 1 1 1 A 33 33 ILE H H 33 7.891 8.642 -0.751 1
1 338 . 1 1 1 A 33 33 ILE HA H 33 4.495 5.019 -0.524 1
1 348 . 1 1 1 A 33 33 ILE C C 33 175.850 173.482 2.368 1
1 349 . 1 1 1 A 33 33 ILE CA C 33 59.641 58.681 0.960 1
1 350 . 1 1 1 A 33 33 ILE CB C 33 39.538 42.434 -2.896 1
1 354 . 1 1 1 A 33 33 ILE N N 33 118.924 117.378 1.546 1
1 355 . 1 1 1 A 34 34 GLU H H 34 8.971 8.868 0.103 1
1 356 . 1 1 1 A 34 34 GLU HA H 34 4.578 5.079 -0.501 1
1 361 . 1 1 1 A 34 34 GLU C C 34 175.766 175.907 -0.141 1
1 362 . 1 1 1 A 34 34 GLU CA C 34 54.263 54.354 -0.091 1
1 363 . 1 1 1 A 34 34 GLU CB C 34 32.128 33.227 -1.099 1
1 365 . 1 1 1 A 34 34 GLU N N 34 125.447 122.392 3.055 1
1 366 . 1 1 1 A 35 35 LYS H H 35 8.504 8.484 0.020 1
1 367 . 1 1 1 A 35 35 LYS HA H 35 4.026 4.122 -0.096 1
1 376 . 1 1 1 A 35 35 LYS C C 35 177.701 175.782 1.919 1
1 377 . 1 1 1 A 35 35 LYS CA C 35 57.591 57.090 0.501 1
1 378 . 1 1 1 A 35 35 LYS CB C 35 32.491 32.725 -0.234 1
1 382 . 1 1 1 A 35 35 LYS N N 35 122.893 123.249 -0.356 1
1 383 . 1 1 1 A 36 36 ASP H H 36 9.020 9.046 -0.026 1
1 384 . 1 1 1 A 36 36 ASP HA H 36 4.385 4.128 0.257 1
1 387 . 1 1 1 A 36 36 ASP C C 36 174.554 174.749 -0.195 1
1 388 . 1 1 1 A 36 36 ASP CA C 36 55.868 55.223 0.645 1
1 389 . 1 1 1 A 36 36 ASP CB C 36 39.826 39.739 0.087 1
1 390 . 1 1 1 A 36 36 ASP N N 36 121.412 117.361 4.051 1
1 391 . 1 1 1 A 37 37 THR H H 37 7.464 7.556 -0.092 1
1 392 . 1 1 1 A 37 37 THR HA H 37 4.454 4.707 -0.253 1
1 397 . 1 1 1 A 37 37 THR C C 37 172.012 173.239 -1.227 1
1 398 . 1 1 1 A 37 37 THR CA C 37 61.686 61.026 0.660 1
1 399 . 1 1 1 A 37 37 THR CB C 37 70.927 72.062 -1.135 1
1 401 . 1 1 1 A 37 37 THR N N 37 113.147 112.908 0.239 1
1 402 . 1 1 1 A 38 38 ASP H H 38 8.931 8.695 0.236 1
1 403 . 1 1 1 A 38 38 ASP HA H 38 4.852 4.754 0.098 1
1 406 . 1 1 1 A 38 38 ASP CA C 38 54.826 54.184 0.642 1
1 407 . 1 1 1 A 38 38 ASP CB C 38 43.332 42.209 1.123 1
1 408 . 1 1 1 A 38 38 ASP N N 38 120.401 123.830 -3.429 1
1 409 . 1 1 1 A 39 39 GLY H H 39 8.068 8.484 -0.416 1
1 410 . 1 1 1 A 39 39 GLY HA2 H 39 3.774 3.910 -0.136 1
1 411 . 1 1 1 A 39 39 GLY HA3 H 39 3.555 3.925 -0.370 1
1 412 . 1 1 1 A 39 39 GLY C C 39 172.578 172.990 -0.412 1
1 413 . 1 1 1 A 39 39 GLY CA C 39 43.967 44.710 -0.743 1
1 414 . 1 1 1 A 39 39 GLY N N 39 107.925 109.442 -1.517 1
1 415 . 1 1 1 A 40 40 HIS H H 40 9.111 8.308 0.803 1
1 416 . 1 1 1 A 40 40 HIS HA H 40 4.650 5.128 -0.478 1
1 421 . 1 1 1 A 40 40 HIS C C 40 174.330 174.616 -0.286 1
1 422 . 1 1 1 A 40 40 HIS CA C 40 55.886 55.315 0.571 1
1 423 . 1 1 1 A 40 40 HIS CB C 40 30.507 32.869 -2.362 1
1 426 . 1 1 1 A 40 40 HIS N N 40 119.179 120.408 -1.229 1
1 427 . 1 1 1 A 41 41 LEU H H 41 8.254 8.972 -0.718 1
1 428 . 1 1 1 A 41 41 LEU HA H 41 4.626 5.103 -0.477 1
1 438 . 1 1 1 A 41 41 LEU C C 41 176.035 176.180 -0.145 1
1 439 . 1 1 1 A 41 41 LEU CA C 41 55.621 53.432 2.189 1
1 440 . 1 1 1 A 41 41 LEU CB C 41 45.091 44.312 0.779 1
1 444 . 1 1 1 A 41 41 LEU N N 41 124.808 121.222 3.586 1
1 445 . 1 1 1 A 42 42 ILE H H 42 8.685 9.114 -0.429 1
1 446 . 1 1 1 A 42 42 ILE HA H 42 4.578 5.024 -0.446 1
1 456 . 1 1 1 A 42 42 ILE C C 42 175.369 174.772 0.597 1
1 457 . 1 1 1 A 42 42 ILE CA C 42 59.852 60.637 -0.785 1
1 458 . 1 1 1 A 42 42 ILE CB C 42 36.778 39.899 -3.121 1
1 462 . 1 1 1 A 42 42 ILE N N 42 121.814 123.522 -1.708 1
1 463 . 1 1 1 A 43 43 ARG H H 43 8.787 8.406 0.381 1
1 464 . 1 1 1 A 43 43 ARG HA H 43 4.852 4.961 -0.109 1
1 472 . 1 1 1 A 43 43 ARG C C 43 174.029 175.192 -1.163 1
1 473 . 1 1 1 A 43 43 ARG CA C 43 52.730 54.700 -1.970 1
1 474 . 1 1 1 A 43 43 ARG CB C 43 36.983 33.699 3.284 1
1 477 . 1 1 1 A 43 43 ARG N N 43 125.771 128.663 -2.892 1
1 479 . 1 1 1 A 44 44 VAL H H 44 8.661 8.613 0.048 1
1 480 . 1 1 1 A 44 44 VAL HA H 44 3.276 3.738 -0.462 1
1 488 . 1 1 1 A 44 44 VAL C C 44 173.227 175.103 -1.876 1
1 489 . 1 1 1 A 44 44 VAL CA C 44 63.161 63.302 -0.141 1
1 490 . 1 1 1 A 44 44 VAL CB C 44 29.054 29.687 -0.633 1
1 493 . 1 1 1 A 44 44 VAL N N 44 117.026 119.667 -2.641 1
1 494 . 1 1 1 A 45 45 ILE H H 45 8.464 8.002 0.462 1
1 495 . 1 1 1 A 45 45 ILE HA H 45 4.579 4.246 0.333 1
1 505 . 1 1 1 A 45 45 ILE C C 45 178.108 175.041 3.067 1
1 506 . 1 1 1 A 45 45 ILE CA C 45 59.888 61.310 -1.422 1
1 507 . 1 1 1 A 45 45 ILE CB C 45 36.998 36.423 0.575 1
1 511 . 1 1 1 A 45 45 ILE N N 45 122.767 122.812 -0.045 1
1 512 . 1 1 1 A 46 46 GLU H H 46 9.015 8.098 0.917 1
1 513 . 1 1 1 A 46 46 GLU HA H 46 4.206 4.274 -0.068 1
1 518 . 1 1 1 A 46 46 GLU C C 46 177.746 176.677 1.069 1
1 519 . 1 1 1 A 46 46 GLU CA C 46 56.130 57.265 -1.135 1
1 520 . 1 1 1 A 46 46 GLU CB C 46 30.581 30.511 0.070 1
1 522 . 1 1 1 A 46 46 GLU N N 46 131.076 127.112 3.964 1
1 523 . 1 1 1 A 47 47 GLU H H 47 9.213 8.659 0.554 1
1 524 . 1 1 1 A 47 47 GLU HA H 47 4.194 4.119 0.075 1
1 529 . 1 1 1 A 47 47 GLU C C 47 178.088 177.657 0.431 1
1 530 . 1 1 1 A 47 47 GLU CA C 47 58.212 57.975 0.237 1
1 531 . 1 1 1 A 47 47 GLU CB C 47 29.390 29.979 -0.589 1
1 533 . 1 1 1 A 47 47 GLU N N 47 129.592 123.320 6.272 1
1 534 . 1 1 1 A 48 48 GLY H H 48 9.586 8.930 0.656 1
1 535 . 1 1 1 A 48 48 GLY HA2 H 48 4.141 3.869 0.272 1
1 536 . 1 1 1 A 48 48 GLY HA3 H 48 3.757 3.871 -0.114 1
1 537 . 1 1 1 A 48 48 GLY C C 48 173.790 174.082 -0.292 1
1 538 . 1 1 1 A 48 48 GLY CA C 48 45.764 46.653 -0.889 1
1 539 . 1 1 1 A 48 48 GLY N N 48 114.819 114.842 -0.023 1
1 540 . 1 1 1 A 49 49 SER H H 49 7.580 7.961 -0.381 1
1 541 . 1 1 1 A 49 49 SER HA H 49 4.728 4.702 0.026 1
1 544 . 1 1 1 A 49 49 SER C C 49 173.542 174.594 -1.052 1
1 545 . 1 1 1 A 49 49 SER CA C 49 57.560 56.542 1.018 1
1 546 . 1 1 1 A 49 49 SER CB C 49 64.529 63.525 1.004 1
1 547 . 1 1 1 A 49 49 SER N N 49 114.688 115.283 -0.595 1
1 548 . 1 1 1 A 50 50 PRO HA H 50 4.431 4.576 -0.145 1
1 555 . 1 1 1 A 50 50 PRO C C 50 179.377 177.560 1.817 1
1 556 . 1 1 1 A 50 50 PRO CA C 50 66.059 64.263 1.796 1
1 557 . 1 1 1 A 50 50 PRO CB C 50 32.598 31.862 0.736 1
1 560 . 1 1 1 A 51 51 ALA H H 51 8.264 8.311 -0.047 1
1 561 . 1 1 1 A 51 51 ALA HA H 51 3.817 3.977 -0.160 1
1 565 . 1 1 1 A 51 51 ALA C C 51 177.508 179.823 -2.315 1
1 566 . 1 1 1 A 51 51 ALA CA C 51 55.392 55.073 0.319 1
1 567 . 1 1 1 A 51 51 ALA CB C 51 20.474 18.543 1.931 1
1 568 . 1 1 1 A 51 51 ALA N N 51 117.604 120.290 -2.686 1
1 569 . 1 1 1 A 52 52 GLU H H 52 7.794 7.654 0.140 1
1 570 . 1 1 1 A 52 52 GLU HA H 52 3.881 4.022 -0.141 1
1 575 . 1 1 1 A 52 52 GLU C C 52 181.401 178.506 2.895 1
1 576 . 1 1 1 A 52 52 GLU CA C 52 59.454 58.776 0.678 1
1 577 . 1 1 1 A 52 52 GLU CB C 52 30.247 29.405 0.842 1
1 579 . 1 1 1 A 52 52 GLU N N 52 119.474 118.821 0.653 1
1 580 . 1 1 1 A 53 53 LYS H H 53 8.557 7.756 0.801 1
1 581 . 1 1 1 A 53 53 LYS HA H 53 4.020 4.036 -0.016 1
1 588 . 1 1 1 A 53 53 LYS C C 53 177.939 178.157 -0.218 1
1 589 . 1 1 1 A 53 53 LYS CA C 53 59.012 58.852 0.160 1
1 590 . 1 1 1 A 53 53 LYS CB C 53 32.438 32.122 0.316 1
1 594 . 1 1 1 A 53 53 LYS N N 53 120.057 119.675 0.382 1
1 595 . 1 1 1 A 54 54 ALA H H 54 7.764 7.440 0.324 1
1 596 . 1 1 1 A 54 54 ALA HA H 54 4.400 4.307 0.093 1
1 600 . 1 1 1 A 54 54 ALA C C 54 177.658 177.968 -0.310 1
1 601 . 1 1 1 A 54 54 ALA CA C 54 52.412 51.691 0.721 1
1 602 . 1 1 1 A 54 54 ALA CB C 54 20.739 18.207 2.532 1
1 603 . 1 1 1 A 54 54 ALA N N 54 117.678 118.608 -0.930 1
1 604 . 1 1 1 A 55 55 GLY H H 55 7.583 7.778 -0.195 1
1 605 . 1 1 1 A 55 55 GLY HA2 H 55 4.266 3.911 0.355 1
1 606 . 1 1 1 A 55 55 GLY HA3 H 55 3.775 3.913 -0.138 1
1 607 . 1 1 1 A 55 55 GLY C C 55 175.232 174.413 0.819 1
1 608 . 1 1 1 A 55 55 GLY CA C 55 45.368 46.499 -1.131 1
1 609 . 1 1 1 A 55 55 GLY N N 55 103.265 107.574 -4.309 1
1 610 . 1 1 1 A 56 56 LEU H H 56 7.280 7.538 -0.258 1
1 611 . 1 1 1 A 56 56 LEU HA H 56 3.984 4.391 -0.407 1
1 621 . 1 1 1 A 56 56 LEU C C 56 174.708 175.182 -0.474 1
1 622 . 1 1 1 A 56 56 LEU CA C 56 55.603 54.828 0.775 1
1 623 . 1 1 1 A 56 56 LEU CB C 56 42.752 42.274 0.478 1
1 627 . 1 1 1 A 56 56 LEU N N 56 119.211 123.222 -4.011 1
1 628 . 1 1 1 A 57 57 LEU H H 57 8.693 8.508 0.185 1
1 629 . 1 1 1 A 57 57 LEU HA H 57 4.499 4.909 -0.410 1
1 639 . 1 1 1 A 57 57 LEU C C 57 176.124 175.927 0.197 1
1 640 . 1 1 1 A 57 57 LEU CA C 57 52.959 53.334 -0.375 1
1 641 . 1 1 1 A 57 57 LEU CB C 57 45.122 44.293 0.829 1
1 645 . 1 1 1 A 57 57 LEU N N 57 121.969 129.255 -7.286 1
1 646 . 1 1 1 A 58 58 ASP H H 58 8.334 8.727 -0.393 1
1 647 . 1 1 1 A 58 58 ASP HA H 58 4.139 4.900 -0.761 1
1 650 . 1 1 1 A 58 58 ASP C C 58 178.636 176.677 1.959 1
1 651 . 1 1 1 A 58 58 ASP CA C 58 56.079 55.253 0.826 1
1 652 . 1 1 1 A 58 58 ASP CB C 58 42.135 40.497 1.638 1
1 653 . 1 1 1 A 58 58 ASP N N 58 120.401 121.472 -1.071 1
1 654 . 1 1 1 A 59 59 GLY H H 59 9.378 8.657 0.721 1
1 655 . 1 1 1 A 59 59 GLY HA2 H 59 4.317 3.949 0.368 1
1 656 . 1 1 1 A 59 59 GLY HA3 H 59 3.260 3.956 -0.696 1
1 657 . 1 1 1 A 59 59 GLY C C 59 173.359 173.935 -0.576 1
1 658 . 1 1 1 A 59 59 GLY CA C 59 45.517 44.998 0.519 1
1 659 . 1 1 1 A 59 59 GLY N N 59 116.622 111.861 4.761 1
1 660 . 1 1 1 A 60 60 ASP H H 60 8.009 7.655 0.354 1
1 661 . 1 1 1 A 60 60 ASP HA H 60 4.638 4.555 0.083 1
1 664 . 1 1 1 A 60 60 ASP C C 60 175.555 175.685 -0.130 1
1 665 . 1 1 1 A 60 60 ASP CA C 60 55.286 55.200 0.086 1
1 666 . 1 1 1 A 60 60 ASP CB C 60 42.381 41.557 0.824 1
1 667 . 1 1 1 A 60 60 ASP N N 60 121.370 122.149 -0.779 1
1 668 . 1 1 1 A 61 61 ARG H H 61 8.648 8.549 0.099 1
1 669 . 1 1 1 A 61 61 ARG HA H 61 5.179 4.958 0.221 1
1 677 . 1 1 1 A 61 61 ARG C C 61 177.381 174.868 2.513 1
1 678 . 1 1 1 A 61 61 ARG CA C 61 53.704 55.719 -2.015 1
1 679 . 1 1 1 A 61 61 ARG CB C 61 34.017 31.093 2.924 1
1 682 . 1 1 1 A 61 61 ARG N N 61 116.958 124.220 -7.262 1
1 684 . 1 1 1 A 62 62 VAL H H 62 8.247 8.770 -0.523 1
1 685 . 1 1 1 A 62 62 VAL HA H 62 3.806 4.698 -0.892 1
1 693 . 1 1 1 A 62 62 VAL C C 62 174.748 176.012 -1.264 1
1 694 . 1 1 1 A 62 62 VAL CA C 62 63.149 61.683 1.466 1
1 695 . 1 1 1 A 62 62 VAL CB C 62 32.574 30.980 1.594 1
1 698 . 1 1 1 A 62 62 VAL N N 62 118.546 126.257 -7.711 1
1 699 . 1 1 1 A 63 63 LEU H H 63 9.262 8.648 0.614 1
1 700 . 1 1 1 A 63 63 LEU HA H 63 4.412 4.023 0.389 1
1 710 . 1 1 1 A 63 63 LEU C C 63 177.649 177.574 0.075 1
1 711 . 1 1 1 A 63 63 LEU CA C 63 56.044 58.389 -2.345 1
1 712 . 1 1 1 A 63 63 LEU CB C 63 43.339 42.069 1.270 1
1 716 . 1 1 1 A 63 63 LEU N N 63 125.413 130.691 -5.278 1
1 717 . 1 1 1 A 64 64 ARG H H 64 7.806 7.881 -0.075 1
1 718 . 1 1 1 A 64 64 ARG HA H 64 5.704 4.932 0.772 1
1 726 . 1 1 1 A 64 64 ARG C C 64 175.091 173.948 1.143 1
1 727 . 1 1 1 A 64 64 ARG CA C 64 54.148 54.468 -0.320 1
1 728 . 1 1 1 A 64 64 ARG CB C 64 35.742 35.020 0.722 1
1 731 . 1 1 1 A 64 64 ARG N N 64 112.961 116.955 -3.994 1
1 733 . 1 1 1 A 65 65 ILE H H 65 8.327 9.205 -0.878 1
1 734 . 1 1 1 A 65 65 ILE HA H 65 4.384 4.644 -0.260 1
1 744 . 1 1 1 A 65 65 ILE C C 65 175.722 175.627 0.095 1
1 745 . 1 1 1 A 65 65 ILE CA C 65 60.501 59.464 1.037 1
1 746 . 1 1 1 A 65 65 ILE CB C 65 39.547 39.958 -0.411 1
1 750 . 1 1 1 A 65 65 ILE N N 65 119.175 122.730 -3.555 1
1 751 . 1 1 1 A 66 66 ASN H H 66 9.911 9.816 0.095 1
1 752 . 1 1 1 A 66 66 ASN HA H 66 4.428 4.380 0.048 1
1 757 . 1 1 1 A 66 66 ASN C C 66 175.349 174.648 0.701 1
1 758 . 1 1 1 A 66 66 ASN CA C 66 54.157 54.199 -0.042 1
1 759 . 1 1 1 A 66 66 ASN CB C 66 37.024 37.419 -0.395 1
1 760 . 1 1 1 A 66 66 ASN N N 66 128.952 128.151 0.801 1
1 762 . 1 1 1 A 67 67 GLY H H 67 9.230 8.662 0.568 1
1 763 . 1 1 1 A 67 67 GLY HA2 H 67 4.322 3.925 0.397 1
1 764 . 1 1 1 A 67 67 GLY HA3 H 67 3.508 3.934 -0.426 1
1 765 . 1 1 1 A 67 67 GLY C C 67 174.393 173.890 0.503 1
1 766 . 1 1 1 A 67 67 GLY CA C 67 45.341 46.399 -1.058 1
1 767 . 1 1 1 A 67 67 GLY N N 67 103.238 104.556 -1.318 1
1 768 . 1 1 1 A 68 68 VAL H H 68 8.063 7.668 0.395 1
1 769 . 1 1 1 A 68 68 VAL HA H 68 4.015 4.560 -0.545 1
1 777 . 1 1 1 A 68 68 VAL C C 68 175.833 174.895 0.938 1
1 778 . 1 1 1 A 68 68 VAL CA C 68 62.603 61.303 1.300 1
1 779 . 1 1 1 A 68 68 VAL CB C 68 32.574 35.027 -2.453 1
1 782 . 1 1 1 A 68 68 VAL N N 68 125.696 119.711 5.985 1
1 783 . 1 1 1 A 69 69 PHE H H 69 9.301 9.117 0.184 1
1 784 . 1 1 1 A 69 69 PHE HA H 69 4.947 4.573 0.374 1
1 792 . 1 1 1 A 69 69 PHE C C 69 177.120 175.735 1.385 1
1 793 . 1 1 1 A 69 69 PHE CA C 69 59.200 59.304 -0.104 1
1 794 . 1 1 1 A 69 69 PHE CB C 69 39.320 39.505 -0.185 1
1 800 . 1 1 1 A 69 69 PHE N N 69 128.641 128.963 -0.322 1
1 801 . 1 1 1 A 70 70 VAL H H 70 8.312 7.948 0.364 1
1 802 . 1 1 1 A 70 70 VAL HA H 70 4.517 4.451 0.066 1
1 810 . 1 1 1 A 70 70 VAL CA C 70 60.734 60.562 0.172 1
1 811 . 1 1 1 A 70 70 VAL CB C 70 32.976 31.305 1.671 1
1 814 . 1 1 1 A 70 70 VAL N N 70 118.381 120.745 -2.364 1
1 815 . 1 1 1 A 71 71 ASP H H 71 5.373 7.415 -2.042 1
1 816 . 1 1 1 A 71 71 ASP HA H 71 4.413 4.341 0.072 1
1 819 . 1 1 1 A 71 71 ASP C C 71 174.896 178.077 -3.181 1
1 820 . 1 1 1 A 71 71 ASP CA C 71 58.334 56.108 2.226 1
1 821 . 1 1 1 A 71 71 ASP CB C 71 46.097 40.987 5.110 1
1 822 . 1 1 1 A 71 71 ASP N N 71 119.008 122.309 -3.301 1
1 823 . 1 1 1 A 72 72 LYS H H 72 7.874 7.766 0.108 1
1 824 . 1 1 1 A 72 72 LYS HA H 72 4.522 4.049 0.473 1
1 833 . 1 1 1 A 72 72 LYS C C 72 177.209 177.187 0.022 1
1 834 . 1 1 1 A 72 72 LYS CA C 72 54.122 58.627 -4.505 1
1 835 . 1 1 1 A 72 72 LYS CB C 72 31.640 32.008 -0.368 1
1 839 . 1 1 1 A 72 72 LYS N N 72 110.259 118.588 -8.329 1
1 840 . 1 1 1 A 73 73 GLU H H 73 7.421 7.843 -0.422 1
1 841 . 1 1 1 A 73 73 GLU HA H 73 4.401 4.425 -0.024 1
1 846 . 1 1 1 A 73 73 GLU C C 73 176.728 176.163 0.565 1
1 847 . 1 1 1 A 73 73 GLU CA C 73 54.950 56.955 -2.005 1
1 848 . 1 1 1 A 73 73 GLU CB C 73 30.390 30.445 -0.055 1
1 850 . 1 1 1 A 73 73 GLU N N 73 120.043 119.186 0.857 1
1 851 . 1 1 1 A 74 74 GLU H H 74 9.360 8.953 0.407 1
1 852 . 1 1 1 A 74 74 GLU HA H 74 4.403 4.542 -0.139 1
1 857 . 1 1 1 A 74 74 GLU C C 74 178.234 178.120 0.114 1
1 858 . 1 1 1 A 74 74 GLU CA C 74 56.516 55.541 0.975 1
1 859 . 1 1 1 A 74 74 GLU CB C 74 30.390 30.583 -0.193 1
1 861 . 1 1 1 A 74 74 GLU N N 74 122.193 121.589 0.604 1
1 862 . 1 1 1 A 75 75 HIS H H 75 9.553 9.212 0.341 1
1 863 . 1 1 1 A 75 75 HIS HA H 75 4.080 4.243 -0.163 1
1 868 . 1 1 1 A 75 75 HIS C C 75 175.985 176.816 -0.831 1
1 869 . 1 1 1 A 75 75 HIS CA C 75 61.016 60.299 0.717 1
1 870 . 1 1 1 A 75 75 HIS CB C 75 29.468 30.235 -0.767 1
1 873 . 1 1 1 A 75 75 HIS N N 75 123.587 122.941 0.646 1
1 874 . 1 1 1 A 76 76 ALA H H 76 9.129 8.230 0.899 1
1 875 . 1 1 1 A 76 76 ALA HA H 76 3.826 3.836 -0.010 1
1 879 . 1 1 1 A 76 76 ALA C C 76 180.475 179.565 0.910 1
1 880 . 1 1 1 A 76 76 ALA CA C 76 55.392 54.686 0.706 1
1 881 . 1 1 1 A 76 76 ALA CB C 76 18.182 18.262 -0.080 1
1 882 . 1 1 1 A 76 76 ALA N N 76 117.795 120.887 -3.092 1
1 883 . 1 1 1 A 77 77 GLN H H 77 7.099 7.972 -0.873 1
1 884 . 1 1 1 A 77 77 GLN HA H 77 4.198 4.062 0.136 1
1 891 . 1 1 1 A 77 77 GLN C C 77 177.860 178.690 -0.830 1
1 892 . 1 1 1 A 77 77 GLN CA C 77 57.790 58.775 -0.985 1
1 893 . 1 1 1 A 77 77 GLN CB C 77 28.536 28.669 -0.133 1
1 895 . 1 1 1 A 77 77 GLN N N 77 115.764 117.657 -1.893 1
1 897 . 1 1 1 A 78 78 VAL H H 78 7.430 7.303 0.127 1
1 898 . 1 1 1 A 78 78 VAL HA H 78 3.241 3.592 -0.351 1
1 906 . 1 1 1 A 78 78 VAL C C 78 177.042 177.764 -0.722 1
1 907 . 1 1 1 A 78 78 VAL CA C 78 67.299 66.220 1.079 1
1 908 . 1 1 1 A 78 78 VAL CB C 78 30.819 31.554 -0.735 1
1 911 . 1 1 1 A 78 78 VAL N N 78 121.143 120.697 0.446 1
1 912 . 1 1 1 A 79 79 VAL H H 79 7.773 7.859 -0.086 1
1 913 . 1 1 1 A 79 79 VAL HA H 79 3.315 3.615 -0.300 1
1 921 . 1 1 1 A 79 79 VAL C C 79 179.179 177.982 1.197 1
1 922 . 1 1 1 A 79 79 VAL CA C 79 66.694 65.230 1.464 1
1 923 . 1 1 1 A 79 79 VAL CB C 79 31.841 31.743 0.098 1
1 926 . 1 1 1 A 79 79 VAL N N 79 117.473 120.194 -2.721 1
1 927 . 1 1 1 A 80 80 GLU H H 80 7.410 7.746 -0.336 1
1 928 . 1 1 1 A 80 80 GLU HA H 80 4.258 4.022 0.236 1
1 933 . 1 1 1 A 80 80 GLU C C 80 178.018 178.847 -0.829 1
1 934 . 1 1 1 A 80 80 GLU CA C 80 58.566 59.427 -0.861 1
1 935 . 1 1 1 A 80 80 GLU CB C 80 29.072 29.438 -0.366 1
1 937 . 1 1 1 A 80 80 GLU N N 80 120.451 121.063 -0.612 1
1 938 . 1 1 1 A 81 81 LEU H H 81 8.070 7.873 0.197 1
1 939 . 1 1 1 A 81 81 LEU HA H 81 3.976 3.992 -0.016 1
1 949 . 1 1 1 A 81 81 LEU C C 81 180.658 178.875 1.783 1
1 950 . 1 1 1 A 81 81 LEU CA C 81 58.061 58.174 -0.113 1
1 951 . 1 1 1 A 81 81 LEU CB C 81 42.115 41.691 0.424 1
1 955 . 1 1 1 A 81 81 LEU N N 81 119.943 119.956 -0.013 1
1 956 . 1 1 1 A 82 82 VAL H H 82 7.609 8.245 -0.636 1
1 957 . 1 1 1 A 82 82 VAL HA H 82 3.474 3.550 -0.076 1
1 965 . 1 1 1 A 82 82 VAL C C 82 178.927 178.282 0.645 1
1 966 . 1 1 1 A 82 82 VAL CA C 82 67.398 66.906 0.492 1
1 967 . 1 1 1 A 82 82 VAL CB C 82 31.306 31.606 -0.300 1
1 970 . 1 1 1 A 82 82 VAL N N 82 118.150 118.994 -0.844 1
1 971 . 1 1 1 A 83 83 ARG H H 83 8.186 8.141 0.045 1
1 972 . 1 1 1 A 83 83 ARG HA H 83 3.994 4.168 -0.174 1
1 979 . 1 1 1 A 83 83 ARG C C 83 179.999 179.042 0.957 1
1 980 . 1 1 1 A 83 83 ARG CA C 83 60.205 59.735 0.470 1
1 981 . 1 1 1 A 83 83 ARG CB C 83 30.103 30.239 -0.136 1
1 984 . 1 1 1 A 83 83 ARG N N 83 122.902 119.326 3.576 1
1 985 . 1 1 1 A 84 84 LYS H H 84 8.772 7.880 0.892 1
1 986 . 1 1 1 A 84 84 LYS HA H 84 4.047 4.116 -0.069 1
1 995 . 1 1 1 A 84 84 LYS C C 84 176.934 178.664 -1.730 1
1 996 . 1 1 1 A 84 84 LYS CA C 84 58.142 58.738 -0.596 1
1 997 . 1 1 1 A 84 84 LYS CB C 84 32.492 31.301 1.191 1
1 1001 . 1 1 1 A 84 84 LYS N N 84 117.548 119.066 -1.518 1
1 1002 . 1 1 1 A 85 85 SER H H 85 7.333 8.111 -0.778 1
1 1003 . 1 1 1 A 85 85 SER HA H 85 4.235 4.218 0.017 1
1 1006 . 1 1 1 A 85 85 SER C C 85 175.588 175.134 0.454 1
1 1007 . 1 1 1 A 85 85 SER CA C 85 59.535 61.039 -1.504 1
1 1008 . 1 1 1 A 85 85 SER CB C 85 63.571 63.708 -0.137 1
1 1009 . 1 1 1 A 85 85 SER N N 85 113.544 115.861 -2.317 1
1 1010 . 1 1 1 A 86 86 GLY H H 86 7.459 7.388 0.071 1
1 1011 . 1 1 1 A 86 86 GLY HA2 H 86 4.176 4.116 0.060 1
1 1012 . 1 1 1 A 86 86 GLY HA3 H 86 3.762 4.123 -0.361 1
1 1013 . 1 1 1 A 86 86 GLY C C 86 176.407 175.309 1.098 1
1 1014 . 1 1 1 A 86 86 GLY CA C 86 46.109 43.863 2.246 1
1 1015 . 1 1 1 A 86 86 GLY N N 86 104.331 107.196 -2.865 1
1 1016 . 1 1 1 A 87 87 ASN HA H 87 4.650 4.472 0.178 1
1 1021 . 1 1 1 A 87 87 ASN C C 87 173.653 175.820 -2.167 1
1 1022 . 1 1 1 A 87 87 ASN CA C 87 54.492 55.512 -1.020 1
1 1023 . 1 1 1 A 87 87 ASN CB C 87 38.425 38.517 -0.092 1
1 1024 . 1 1 1 A 87 87 ASN N N 87 118.401 120.166 -1.765 1
1 1026 . 1 1 1 A 88 88 SER H H 88 7.435 7.877 -0.442 1
1 1027 . 1 1 1 A 88 88 SER HA H 88 5.438 5.668 -0.230 1
1 1030 . 1 1 1 A 88 88 SER C C 88 172.867 173.241 -0.374 1
1 1031 . 1 1 1 A 88 88 SER CA C 88 58.160 57.776 0.384 1
1 1032 . 1 1 1 A 88 88 SER CB C 88 65.861 64.837 1.024 1
1 1033 . 1 1 1 A 88 88 SER N N 88 113.765 115.096 -1.331 1
1 1034 . 1 1 1 A 89 89 VAL H H 89 8.452 8.963 -0.511 1
1 1035 . 1 1 1 A 89 89 VAL HA H 89 4.519 5.061 -0.542 1
1 1043 . 1 1 1 A 89 89 VAL C C 89 171.391 174.474 -3.083 1
1 1044 . 1 1 1 A 89 89 VAL CA C 89 61.333 60.452 0.881 1
1 1045 . 1 1 1 A 89 89 VAL CB C 89 33.897 35.028 -1.131 1
1 1048 . 1 1 1 A 89 89 VAL N N 89 120.001 126.729 -6.728 1
1 1049 . 1 1 1 A 90 90 THR H H 90 8.348 8.698 -0.350 1
1 1050 . 1 1 1 A 90 90 THR HA H 90 5.042 5.426 -0.384 1
1 1055 . 1 1 1 A 90 90 THR C C 90 173.926 173.448 0.478 1
1 1056 . 1 1 1 A 90 90 THR CA C 90 61.403 61.304 0.099 1
1 1057 . 1 1 1 A 90 90 THR CB C 90 69.553 70.688 -1.135 1
1 1059 . 1 1 1 A 90 90 THR N N 90 123.477 124.102 -0.625 1
1 1060 . 1 1 1 A 91 91 LEU H H 91 9.195 8.376 0.819 1
1 1061 . 1 1 1 A 91 91 LEU HA H 91 5.161 4.882 0.279 1
1 1071 . 1 1 1 A 91 91 LEU C C 91 174.564 175.608 -1.044 1
1 1072 . 1 1 1 A 91 91 LEU CA C 91 52.590 53.634 -1.044 1
1 1073 . 1 1 1 A 91 91 LEU CB C 91 44.998 45.986 -0.988 1
1 1077 . 1 1 1 A 91 91 LEU N N 91 128.419 125.193 3.226 1
1 1078 . 1 1 1 A 92 92 LEU H H 92 8.644 8.501 0.143 1
1 1079 . 1 1 1 A 92 92 LEU HA H 92 5.335 5.208 0.127 1
1 1089 . 1 1 1 A 92 92 LEU C C 92 176.451 175.428 1.023 1
1 1090 . 1 1 1 A 92 92 LEU CA C 92 54.220 53.960 0.260 1
1 1091 . 1 1 1 A 92 92 LEU CB C 92 44.323 43.016 1.307 1
1 1095 . 1 1 1 A 92 92 LEU N N 92 125.894 123.342 2.552 1
1 1096 . 1 1 1 A 93 93 VAL H H 93 9.249 9.029 0.220 1
1 1097 . 1 1 1 A 93 93 VAL HA H 93 5.573 5.339 0.234 1
1 1105 . 1 1 1 A 93 93 VAL C C 93 173.550 174.323 -0.773 1
1 1106 . 1 1 1 A 93 93 VAL CA C 93 58.340 60.748 -2.408 1
1 1107 . 1 1 1 A 93 93 VAL CB C 93 36.159 33.552 2.607 1
1 1110 . 1 1 1 A 93 93 VAL N N 93 120.660 120.436 0.224 1
1 1111 . 1 1 1 A 94 94 LEU H H 94 8.634 8.598 0.036 1
1 1112 . 1 1 1 A 94 94 LEU HA H 94 4.911 5.196 -0.285 1
1 1122 . 1 1 1 A 94 94 LEU C C 94 174.172 174.757 -0.585 1
1 1123 . 1 1 1 A 94 94 LEU CA C 94 52.659 53.255 -0.596 1
1 1124 . 1 1 1 A 94 94 LEU CB C 94 47.910 45.740 2.170 1
1 1128 . 1 1 1 A 94 94 LEU N N 94 120.304 127.431 -7.127 1
1 1129 . 1 1 1 A 95 95 ASP H H 95 8.210 8.661 -0.451 1
1 1130 . 1 1 1 A 95 95 ASP HA H 95 5.190 4.694 0.496 1
1 1133 . 1 1 1 A 95 95 ASP C C 95 175.887 177.870 -1.983 1
1 1134 . 1 1 1 A 95 95 ASP CA C 95 53.899 54.757 -0.858 1
1 1135 . 1 1 1 A 95 95 ASP CB C 95 41.188 42.871 -1.683 1
1 1136 . 1 1 1 A 95 95 ASP N N 95 122.184 123.747 -1.563 1
1 1137 . 1 1 1 A 96 96 GLY H H 96 8.478 8.801 -0.323 1
1 1138 . 1 1 1 A 96 96 GLY HA2 H 96 4.002 3.796 0.206 1
1 1139 . 1 1 1 A 96 96 GLY HA3 H 96 3.757 3.803 -0.046 1
1 1140 . 1 1 1 A 96 96 GLY C C 96 175.497 175.415 0.082 1
1 1141 . 1 1 1 A 96 96 GLY CA C 96 49.944 47.339 2.605 1
1 1142 . 1 1 1 A 96 96 GLY N N 96 108.610 111.500 -2.890 1
1 1143 . 1 1 1 A 97 97 ASP H H 97 8.401 8.178 0.223 1
1 1144 . 1 1 1 A 97 97 ASP HA H 97 4.454 4.383 0.071 1
1 1147 . 1 1 1 A 97 97 ASP C C 97 179.612 178.673 0.939 1
1 1148 . 1 1 1 A 97 97 ASP CA C 97 57.913 57.163 0.750 1
1 1149 . 1 1 1 A 97 97 ASP CB C 97 41.145 40.650 0.495 1
1 1150 . 1 1 1 A 97 97 ASP N N 97 120.034 121.697 -1.663 1
1 1151 . 1 1 1 A 98 98 SER H H 98 8.152 7.759 0.393 1
1 1152 . 1 1 1 A 98 98 SER HA H 98 4.218 4.196 0.022 1
1 1155 . 1 1 1 A 98 98 SER C C 98 175.061 175.448 -0.387 1
1 1156 . 1 1 1 A 98 98 SER CA C 98 62.180 62.361 -0.181 1
1 1157 . 1 1 1 A 98 98 SER CB C 98 62.179 62.745 -0.566 1
1 1158 . 1 1 1 A 98 98 SER N N 98 117.174 115.773 1.401 1
1 1159 . 1 1 1 A 99 99 TYR H H 99 9.051 8.512 0.539 1
1 1160 . 1 1 1 A 99 99 TYR HA H 99 3.692 3.817 -0.125 1
1 1167 . 1 1 1 A 99 99 TYR C C 99 176.460 177.036 -0.576 1
1 1168 . 1 1 1 A 99 99 TYR CA C 99 62.814 62.106 0.708 1
1 1169 . 1 1 1 A 99 99 TYR CB C 99 38.829 38.442 0.387 1
1 1174 . 1 1 1 A 99 99 TYR N N 99 123.539 122.238 1.301 1
1 1175 . 1 1 1 A 100 100 GLU H H 100 8.520 8.834 -0.314 1
1 1176 . 1 1 1 A 100 100 GLU HA H 100 3.952 4.012 -0.060 1
1 1181 . 1 1 1 A 100 100 GLU C C 100 180.151 179.069 1.082 1
1 1182 . 1 1 1 A 100 100 GLU CA C 100 60.099 59.871 0.228 1
1 1183 . 1 1 1 A 100 100 GLU CB C 100 29.435 29.049 0.386 1
1 1185 . 1 1 1 A 100 100 GLU N N 100 117.082 118.248 -1.166 1
1 1186 . 1 1 1 A 101 101 LYS H H 101 7.740 8.018 -0.278 1
1 1187 . 1 1 1 A 101 101 LYS HA H 101 3.984 4.077 -0.093 1
1 1196 . 1 1 1 A 101 101 LYS C C 101 178.377 178.619 -0.242 1
1 1197 . 1 1 1 A 101 101 LYS CA C 101 59.888 58.684 1.204 1
1 1198 . 1 1 1 A 101 101 LYS CB C 101 32.821 32.410 0.411 1
1 1202 . 1 1 1 A 101 101 LYS N N 101 119.851 120.700 -0.849 1
1 1203 . 1 1 1 A 102 102 ALA H H 102 8.538 7.769 0.769 1
1 1204 . 1 1 1 A 102 102 ALA HA H 102 3.632 4.047 -0.415 1
1 1208 . 1 1 1 A 102 102 ALA C C 102 179.870 179.284 0.586 1
1 1209 . 1 1 1 A 102 102 ALA CA C 102 55.285 54.983 0.302 1
1 1210 . 1 1 1 A 102 102 ALA CB C 102 17.163 18.558 -1.395 1
1 1211 . 1 1 1 A 102 102 ALA N N 102 124.176 122.016 2.160 1
1 1212 . 1 1 1 A 103 103 VAL H H 103 8.147 8.099 0.048 1
1 1213 . 1 1 1 A 103 103 VAL HA H 103 3.658 3.770 -0.112 1
1 1221 . 1 1 1 A 103 103 VAL C C 103 181.113 177.205 3.908 1
1 1222 . 1 1 1 A 103 103 VAL CA C 103 66.090 64.620 1.470 1
1 1223 . 1 1 1 A 103 103 VAL CB C 103 31.822 31.415 0.407 1
1 1226 . 1 1 1 A 103 103 VAL N N 103 117.841 117.025 0.816 1
1 1227 . 1 1 1 A 104 104 LYS H H 104 7.903 7.718 0.185 1
1 1228 . 1 1 1 A 104 104 LYS HA H 104 4.065 4.181 -0.116 1
1 1235 . 1 1 1 A 104 104 LYS C C 104 177.715 177.984 -0.269 1
1 1236 . 1 1 1 A 104 104 LYS CA C 104 59.094 58.861 0.233 1
1 1237 . 1 1 1 A 104 104 LYS CB C 104 32.285 33.146 -0.861 1
1 1241 . 1 1 1 A 104 104 LYS N N 104 121.515 120.812 0.703 1
1 1242 . 1 1 1 A 105 105 ASN H H 105 7.747 7.806 -0.059 1
1 1243 . 1 1 1 A 105 105 ASN HA H 105 4.721 4.857 -0.136 1
1 1248 . 1 1 1 A 105 105 ASN C C 105 173.320 174.126 -0.806 1
1 1249 . 1 1 1 A 105 105 ASN CA C 105 53.399 52.860 0.539 1
1 1250 . 1 1 1 A 105 105 ASN CB C 105 39.249 38.557 0.692 1
1 1251 . 1 1 1 A 105 105 ASN N N 105 114.941 114.970 -0.029 1
1 1253 . 1 1 1 A 106 106 GLN H H 106 7.850 7.903 -0.053 1
1 1254 . 1 1 1 A 106 106 GLN HA H 106 3.902 3.866 0.036 1
1 1261 . 1 1 1 A 106 106 GLN C C 106 175.168 174.875 0.293 1
1 1262 . 1 1 1 A 106 106 GLN CA C 106 56.978 56.898 0.080 1
1 1263 . 1 1 1 A 106 106 GLN CB C 106 25.770 26.313 -0.543 1
1 1265 . 1 1 1 A 106 106 GLN N N 106 114.989 115.815 -0.826 1
1 1267 . 1 1 1 A 107 107 VAL H H 107 8.005 7.688 0.317 1
1 1268 . 1 1 1 A 107 107 VAL HA H 107 3.664 4.008 -0.344 1
1 1276 . 1 1 1 A 107 107 VAL C C 107 175.468 175.251 0.217 1
1 1277 . 1 1 1 A 107 107 VAL CA C 107 62.726 62.344 0.382 1
1 1278 . 1 1 1 A 107 107 VAL CB C 107 32.535 31.876 0.659 1
1 1281 . 1 1 1 A 107 107 VAL N N 107 120.216 120.136 0.080 1
1 1282 . 1 1 1 A 108 108 ASP H H 108 8.484 8.658 -0.174 1
1 1283 . 1 1 1 A 108 108 ASP HA H 108 4.467 4.565 -0.098 1
1 1286 . 1 1 1 A 108 108 ASP C C 108 177.179 175.918 1.261 1
1 1287 . 1 1 1 A 108 108 ASP CA C 108 53.417 54.787 -1.370 1
1 1288 . 1 1 1 A 108 108 ASP CB C 108 40.030 40.416 -0.386 1
1 1289 . 1 1 1 A 108 108 ASP N N 108 125.414 127.581 -2.167 1
1 1290 . 1 1 1 A 109 109 LEU H H 109 8.470 8.421 0.049 1
1 1291 . 1 1 1 A 109 109 LEU HA H 109 3.846 4.046 -0.200 1
1 1301 . 1 1 1 A 109 109 LEU C C 109 178.145 178.814 -0.669 1
1 1302 . 1 1 1 A 109 109 LEU CA C 109 56.573 56.930 -0.357 1
1 1303 . 1 1 1 A 109 109 LEU CB C 109 42.011 41.530 0.481 1
1 1307 . 1 1 1 A 109 109 LEU N N 109 127.577 126.140 1.437 1
1 1308 . 1 1 1 A 110 110 LYS H H 110 8.062 7.810 0.252 1
1 1309 . 1 1 1 A 110 110 LYS HA H 110 3.022 3.820 -0.798 1
1 1317 . 1 1 1 A 110 110 LYS C C 110 177.248 178.171 -0.923 1
1 1318 . 1 1 1 A 110 110 LYS CA C 110 58.742 58.455 0.287 1
1 1319 . 1 1 1 A 110 110 LYS CB C 110 31.667 30.557 1.110 1
1 1323 . 1 1 1 A 110 110 LYS N N 110 118.873 117.559 1.314 1
1 1324 . 1 1 1 A 111 111 GLU H H 111 7.113 7.823 -0.710 1
1 1325 . 1 1 1 A 111 111 GLU HA H 111 4.117 4.070 0.047 1
1 1330 . 1 1 1 A 111 111 GLU C C 111 176.519 177.717 -1.198 1
1 1331 . 1 1 1 A 111 111 GLU CA C 111 55.621 59.097 -3.476 1
1 1332 . 1 1 1 A 111 111 GLU CB C 111 29.943 29.071 0.872 1
1 1334 . 1 1 1 A 111 111 GLU N N 111 114.282 118.103 -3.821 1
1 1335 . 1 1 1 A 112 112 LEU H H 112 6.848 7.701 -0.853 1
1 1336 . 1 1 1 A 112 112 LEU HA H 112 4.293 4.166 0.127 1
1 1346 . 1 1 1 A 112 112 LEU C C 112 175.674 176.013 -0.339 1
1 1347 . 1 1 1 A 112 112 LEU CA C 112 55.197 56.031 -0.834 1
1 1348 . 1 1 1 A 112 112 LEU CB C 112 41.681 41.911 -0.230 1
1 1352 . 1 1 1 A 112 112 LEU N N 112 118.934 122.203 -3.269 1
1 1353 . 1 1 1 A 113 113 ASP H H 113 8.466 8.536 -0.070 1
1 1354 . 1 1 1 A 113 113 ASP HA H 113 4.593 5.371 -0.778 1
1 1357 . 1 1 1 A 113 113 ASP C C 113 174.511 174.827 -0.316 1
1 1358 . 1 1 1 A 113 113 ASP CA C 113 53.558 52.660 0.898 1
1 1359 . 1 1 1 A 113 113 ASP CB C 113 42.448 41.552 0.896 1
1 1360 . 1 1 1 A 113 113 ASP N N 113 122.148 123.746 -1.598 1
1 1 . 2 1 1 A 6 6 SER HA H 6 4.483 4.545 -0.062 1
1 4 . 2 1 1 A 6 6 SER C C 6 175.167 174.210 0.957 1
1 5 . 2 1 1 A 6 6 SER CA C 6 58.759 57.511 1.248 1
1 6 . 2 1 1 A 6 6 SER CB C 6 64.069 64.624 -0.555 1
1 7 . 2 1 1 A 7 7 GLY H H 7 8.431 8.527 -0.096 1
1 8 . 2 1 1 A 7 7 GLY HA2 H 7 3.973 4.021 -0.048 1
1 9 . 2 1 1 A 7 7 GLY HA3 H 7 3.973 4.034 -0.061 1
1 10 . 2 1 1 A 7 7 GLY C C 7 174.570 172.531 2.039 1
1 11 . 2 1 1 A 7 7 GLY CA C 7 45.483 45.224 0.259 1
1 12 . 2 1 1 A 7 7 GLY N N 7 110.640 108.199 2.441 1
1 13 . 2 1 1 A 8 8 MET H H 8 8.239 8.752 -0.513 1
1 14 . 2 1 1 A 8 8 MET HA H 8 4.386 4.793 -0.407 1
1 22 . 2 1 1 A 8 8 MET C C 8 176.621 176.105 0.516 1
1 23 . 2 1 1 A 8 8 MET CA C 8 55.991 54.165 1.826 1
1 24 . 2 1 1 A 8 8 MET CB C 8 32.986 33.427 -0.441 1
1 27 . 2 1 1 A 8 8 MET N N 8 120.219 126.000 -5.781 1
1 28 . 2 1 1 A 9 9 ALA H H 9 8.435 8.473 -0.038 1
1 29 . 2 1 1 A 9 9 ALA HA H 9 4.182 3.904 0.278 1
1 33 . 2 1 1 A 9 9 ALA C C 9 177.951 175.861 2.090 1
1 34 . 2 1 1 A 9 9 ALA CA C 9 53.399 53.101 0.298 1
1 35 . 2 1 1 A 9 9 ALA CB C 9 18.955 17.367 1.588 1
1 36 . 2 1 1 A 9 9 ALA N N 9 124.459 124.889 -0.430 1
1 37 . 2 1 1 A 10 10 SER H H 10 8.100 7.638 0.462 1
1 38 . 2 1 1 A 10 10 SER HA H 10 4.391 4.822 -0.431 1
1 41 . 2 1 1 A 10 10 SER C C 10 174.467 173.572 0.895 1
1 42 . 2 1 1 A 10 10 SER CA C 10 58.709 56.178 2.531 1
1 43 . 2 1 1 A 10 10 SER CB C 10 63.778 66.266 -2.488 1
1 44 . 2 1 1 A 10 10 SER N N 10 113.881 110.019 3.862 1
1 45 . 2 1 1 A 11 11 THR H H 11 7.821 8.439 -0.618 1
1 46 . 2 1 1 A 11 11 THR HA H 11 4.191 4.260 -0.069 1
1 51 . 2 1 1 A 11 11 THR C C 11 173.610 174.587 -0.977 1
1 52 . 2 1 1 A 11 11 THR CA C 11 61.936 62.388 -0.452 1
1 53 . 2 1 1 A 11 11 THR CB C 11 69.713 68.644 1.069 1
1 55 . 2 1 1 A 11 11 THR N N 11 114.471 113.091 1.380 1
1 56 . 2 1 1 A 12 12 PHE H H 12 7.946 8.865 -0.919 1
1 57 . 2 1 1 A 12 12 PHE HA H 12 4.769 4.620 0.149 1
1 65 . 2 1 1 A 12 12 PHE C C 12 174.211 175.341 -1.130 1
1 66 . 2 1 1 A 12 12 PHE CA C 12 56.644 57.850 -1.206 1
1 67 . 2 1 1 A 12 12 PHE CB C 12 40.609 39.348 1.261 1
1 73 . 2 1 1 A 12 12 PHE N N 12 120.763 126.610 -5.847 1
1 74 . 2 1 1 A 13 13 ASN H H 13 9.004 8.971 0.033 1
1 75 . 2 1 1 A 13 13 ASN HA H 13 5.366 5.469 -0.103 1
1 80 . 2 1 1 A 13 13 ASN C C 13 172.158 174.210 -2.052 1
1 81 . 2 1 1 A 13 13 ASN CA C 13 50.988 50.639 0.349 1
1 82 . 2 1 1 A 13 13 ASN CB C 13 39.942 38.812 1.130 1
1 83 . 2 1 1 A 13 13 ASN N N 13 119.973 117.135 2.838 1
1 85 . 2 1 1 A 14 14 PRO HA H 14 4.945 4.596 0.349 1
1 92 . 2 1 1 A 14 14 PRO C C 14 174.901 175.798 -0.897 1
1 93 . 2 1 1 A 14 14 PRO CA C 14 63.096 62.666 0.430 1
1 94 . 2 1 1 A 14 14 PRO CB C 14 32.739 32.640 0.099 1
1 97 . 2 1 1 A 15 15 ARG H H 15 8.908 8.812 0.096 1
1 98 . 2 1 1 A 15 15 ARG HA H 15 4.626 4.733 -0.107 1
1 106 . 2 1 1 A 15 15 ARG C C 15 174.432 174.994 -0.562 1
1 107 . 2 1 1 A 15 15 ARG CA C 15 54.827 55.377 -0.550 1
1 108 . 2 1 1 A 15 15 ARG CB C 15 32.439 32.026 0.413 1
1 111 . 2 1 1 A 15 15 ARG N N 15 118.947 121.481 -2.534 1
1 113 . 2 1 1 A 16 16 GLU H H 16 8.838 8.747 0.091 1
1 114 . 2 1 1 A 16 16 GLU HA H 16 4.876 4.979 -0.103 1
1 119 . 2 1 1 A 16 16 GLU C C 16 175.767 174.947 0.820 1
1 120 . 2 1 1 A 16 16 GLU CA C 16 55.621 55.685 -0.064 1
1 121 . 2 1 1 A 16 16 GLU CB C 16 31.093 32.095 -1.002 1
1 123 . 2 1 1 A 16 16 GLU N N 16 125.316 126.747 -1.431 1
1 124 . 2 1 1 A 17 17 CYS H H 17 9.327 8.965 0.362 1
1 125 . 2 1 1 A 17 17 CYS HA H 17 4.804 5.067 -0.263 1
1 128 . 2 1 1 A 17 17 CYS C C 17 172.973 173.279 -0.306 1
1 129 . 2 1 1 A 17 17 CYS CA C 17 57.930 58.255 -0.325 1
1 130 . 2 1 1 A 17 17 CYS CB C 17 30.105 31.267 -1.162 1
1 131 . 2 1 1 A 17 17 CYS N N 17 127.909 123.024 4.885 1
1 132 . 2 1 1 A 18 18 LYS H H 18 9.022 8.781 0.241 1
1 133 . 2 1 1 A 18 18 LYS HA H 18 4.769 4.634 0.135 1
1 142 . 2 1 1 A 18 18 LYS C C 18 174.586 175.537 -0.951 1
1 143 . 2 1 1 A 18 18 LYS CA C 18 55.956 55.193 0.763 1
1 144 . 2 1 1 A 18 18 LYS CB C 18 32.203 32.671 -0.468 1
1 148 . 2 1 1 A 18 18 LYS N N 18 127.039 125.513 1.526 1
1 149 . 2 1 1 A 19 19 LEU H H 19 8.784 8.503 0.281 1
1 150 . 2 1 1 A 19 19 LEU HA H 19 4.852 4.305 0.547 1
1 160 . 2 1 1 A 19 19 LEU C C 19 176.862 176.629 0.233 1
1 161 . 2 1 1 A 19 19 LEU CA C 19 55.391 54.885 0.506 1
1 162 . 2 1 1 A 19 19 LEU CB C 19 44.442 42.044 2.398 1
1 166 . 2 1 1 A 19 19 LEU N N 19 126.311 126.625 -0.314 1
1 167 . 2 1 1 A 20 20 SER H H 20 8.215 8.899 -0.684 1
1 168 . 2 1 1 A 20 20 SER HA H 20 5.461 5.501 -0.040 1
1 171 . 2 1 1 A 20 20 SER C C 20 171.960 173.988 -2.028 1
1 172 . 2 1 1 A 20 20 SER CA C 20 57.525 56.528 0.997 1
1 173 . 2 1 1 A 20 20 SER CB C 20 65.794 65.758 0.036 1
1 174 . 2 1 1 A 20 20 SER N N 20 115.113 116.908 -1.795 1
1 175 . 2 1 1 A 21 21 LYS H H 21 9.001 8.619 0.382 1
1 176 . 2 1 1 A 21 21 LYS HA H 21 4.887 5.055 -0.168 1
1 185 . 2 1 1 A 21 21 LYS C C 21 174.133 174.866 -0.733 1
1 186 . 2 1 1 A 21 21 LYS CA C 21 53.840 54.545 -0.705 1
1 187 . 2 1 1 A 21 21 LYS CB C 21 36.553 35.957 0.596 1
1 191 . 2 1 1 A 21 21 LYS N N 21 120.938 121.414 -0.476 1
1 192 . 2 1 1 A 22 22 GLN H H 22 8.201 8.329 -0.128 1
1 193 . 2 1 1 A 22 22 GLN HA H 22 4.448 4.561 -0.113 1
1 200 . 2 1 1 A 22 22 GLN C C 22 176.372 175.512 0.860 1
1 201 . 2 1 1 A 22 22 GLN CA C 22 53.658 54.517 -0.859 1
1 202 . 2 1 1 A 22 22 GLN CB C 22 30.473 30.007 0.466 1
1 204 . 2 1 1 A 22 22 GLN N N 22 116.816 119.924 -3.108 1
1 206 . 2 1 1 A 23 23 GLU H H 23 8.624 8.650 -0.026 1
1 207 . 2 1 1 A 23 23 GLU HA H 23 4.056 4.060 -0.004 1
1 212 . 2 1 1 A 23 23 GLU C C 23 177.778 176.777 1.001 1
1 213 . 2 1 1 A 23 23 GLU CA C 23 58.001 57.514 0.487 1
1 214 . 2 1 1 A 23 23 GLU CB C 23 29.237 29.224 0.013 1
1 216 . 2 1 1 A 23 23 GLU N N 23 122.364 122.373 -0.009 1
1 217 . 2 1 1 A 24 24 GLY H H 24 8.962 8.861 0.101 1
1 218 . 2 1 1 A 24 24 GLY HA2 H 24 4.139 3.976 0.163 1
1 219 . 2 1 1 A 24 24 GLY HA3 H 24 3.711 3.979 -0.268 1
1 220 . 2 1 1 A 24 24 GLY C C 24 173.857 174.053 -0.196 1
1 221 . 2 1 1 A 24 24 GLY CA C 24 45.288 45.042 0.246 1
1 222 . 2 1 1 A 24 24 GLY N N 24 113.942 112.720 1.222 1
1 223 . 2 1 1 A 25 25 GLN H H 25 7.643 7.805 -0.162 1
1 224 . 2 1 1 A 25 25 GLN HA H 25 4.488 4.417 0.071 1
1 231 . 2 1 1 A 25 25 GLN C C 25 174.727 174.763 -0.036 1
1 232 . 2 1 1 A 25 25 GLN CA C 25 54.052 54.955 -0.903 1
1 233 . 2 1 1 A 25 25 GLN CB C 25 30.843 30.014 0.829 1
1 235 . 2 1 1 A 25 25 GLN N N 25 119.538 121.145 -1.607 1
1 237 . 2 1 1 A 26 26 ASN H H 26 8.625 8.508 0.117 1
1 238 . 2 1 1 A 26 26 ASN HA H 26 4.862 4.816 0.046 1
1 243 . 2 1 1 A 26 26 ASN C C 26 176.261 175.641 0.620 1
1 244 . 2 1 1 A 26 26 ASN CA C 26 51.812 52.081 -0.269 1
1 245 . 2 1 1 A 26 26 ASN CB C 26 40.403 40.031 0.372 1
1 246 . 2 1 1 A 26 26 ASN N N 26 120.047 123.174 -3.127 1
1 248 . 2 1 1 A 27 27 TYR HA H 27 4.152 4.387 -0.235 1
1 255 . 2 1 1 A 27 27 TYR C C 27 176.731 175.676 1.055 1
1 256 . 2 1 1 A 27 27 TYR CA C 27 62.462 61.038 1.424 1
1 257 . 2 1 1 A 27 27 TYR CB C 27 40.240 38.807 1.433 1
1 262 . 2 1 1 A 27 27 TYR N N 27 121.761 123.759 -1.998 1
1 263 . 2 1 1 A 28 28 GLY H H 28 8.285 7.808 0.477 1
1 264 . 2 1 1 A 28 28 GLY HA2 H 28 4.490 3.952 0.538 1
1 265 . 2 1 1 A 28 28 GLY HA3 H 28 3.759 4.053 -0.294 1
1 266 . 2 1 1 A 28 28 GLY C C 28 172.198 173.967 -1.769 1
1 267 . 2 1 1 A 28 28 GLY CA C 28 46.139 45.156 0.983 1
1 268 . 2 1 1 A 28 28 GLY N N 28 103.567 107.217 -3.650 1
1 269 . 2 1 1 A 29 29 PHE H H 29 6.878 7.788 -0.910 1
1 270 . 2 1 1 A 29 29 PHE HA H 29 5.179 5.026 0.153 1
1 278 . 2 1 1 A 29 29 PHE C C 29 172.840 174.001 -1.161 1
1 279 . 2 1 1 A 29 29 PHE CA C 29 55.262 55.089 0.173 1
1 280 . 2 1 1 A 29 29 PHE CB C 29 41.779 42.526 -0.747 1
1 286 . 2 1 1 A 29 29 PHE N N 29 111.027 117.567 -6.540 1
1 287 . 2 1 1 A 30 30 PHE H H 30 8.806 8.624 0.182 1
1 288 . 2 1 1 A 30 30 PHE HA H 30 4.923 4.777 0.146 1
1 296 . 2 1 1 A 30 30 PHE C C 30 174.501 175.088 -0.587 1
1 297 . 2 1 1 A 30 30 PHE CA C 30 55.356 55.898 -0.542 1
1 298 . 2 1 1 A 30 30 PHE CB C 30 41.681 43.554 -1.873 1
1 304 . 2 1 1 A 30 30 PHE N N 30 118.710 117.364 1.346 1
1 305 . 2 1 1 A 31 31 LEU H H 31 8.441 8.889 -0.448 1
1 306 . 2 1 1 A 31 31 LEU HA H 31 5.447 5.168 0.279 1
1 316 . 2 1 1 A 31 31 LEU C C 31 177.306 176.215 1.091 1
1 317 . 2 1 1 A 31 31 LEU CA C 31 53.610 53.970 -0.360 1
1 318 . 2 1 1 A 31 31 LEU CB C 31 43.696 43.335 0.361 1
1 322 . 2 1 1 A 31 31 LEU N N 31 123.765 123.750 0.015 1
1 323 . 2 1 1 A 32 32 ARG H H 32 9.381 8.708 0.673 1
1 324 . 2 1 1 A 32 32 ARG HA H 32 4.840 4.980 -0.140 1
1 331 . 2 1 1 A 32 32 ARG C C 32 175.155 175.086 0.069 1
1 332 . 2 1 1 A 32 32 ARG CA C 32 54.210 54.092 0.118 1
1 333 . 2 1 1 A 32 32 ARG CB C 32 35.087 34.315 0.772 1
1 336 . 2 1 1 A 32 32 ARG N N 32 123.160 123.198 -0.038 1
1 337 . 2 1 1 A 33 33 ILE H H 33 7.891 8.805 -0.914 1
1 338 . 2 1 1 A 33 33 ILE HA H 33 4.495 4.864 -0.369 1
1 348 . 2 1 1 A 33 33 ILE C C 33 175.850 173.903 1.947 1
1 349 . 2 1 1 A 33 33 ILE CA C 33 59.641 59.172 0.469 1
1 350 . 2 1 1 A 33 33 ILE CB C 33 39.538 39.845 -0.307 1
1 354 . 2 1 1 A 33 33 ILE N N 33 118.924 119.016 -0.092 1
1 355 . 2 1 1 A 34 34 GLU H H 34 8.971 8.802 0.169 1
1 356 . 2 1 1 A 34 34 GLU HA H 34 4.578 5.027 -0.449 1
1 361 . 2 1 1 A 34 34 GLU C C 34 175.766 175.651 0.115 1
1 362 . 2 1 1 A 34 34 GLU CA C 34 54.263 54.554 -0.291 1
1 363 . 2 1 1 A 34 34 GLU CB C 34 32.128 32.713 -0.585 1
1 365 . 2 1 1 A 34 34 GLU N N 34 125.447 122.497 2.950 1
1 366 . 2 1 1 A 35 35 LYS H H 35 8.504 8.697 -0.193 1
1 367 . 2 1 1 A 35 35 LYS HA H 35 4.026 3.885 0.141 1
1 376 . 2 1 1 A 35 35 LYS C C 35 177.701 177.211 0.490 1
1 377 . 2 1 1 A 35 35 LYS CA C 35 57.591 57.313 0.278 1
1 378 . 2 1 1 A 35 35 LYS CB C 35 32.491 32.547 -0.056 1
1 382 . 2 1 1 A 35 35 LYS N N 35 122.893 126.853 -3.960 1
1 383 . 2 1 1 A 36 36 ASP H H 36 9.020 9.049 -0.029 1
1 384 . 2 1 1 A 36 36 ASP HA H 36 4.385 4.198 0.187 1
1 387 . 2 1 1 A 36 36 ASP C C 36 174.554 174.682 -0.128 1
1 388 . 2 1 1 A 36 36 ASP CA C 36 55.868 55.068 0.800 1
1 389 . 2 1 1 A 36 36 ASP CB C 36 39.826 39.843 -0.017 1
1 390 . 2 1 1 A 36 36 ASP N N 36 121.412 123.407 -1.995 1
1 391 . 2 1 1 A 37 37 THR H H 37 7.464 7.055 0.409 1
1 392 . 2 1 1 A 37 37 THR HA H 37 4.454 4.875 -0.421 1
1 397 . 2 1 1 A 37 37 THR C C 37 172.012 172.656 -0.644 1
1 398 . 2 1 1 A 37 37 THR CA C 37 61.686 60.813 0.873 1
1 399 . 2 1 1 A 37 37 THR CB C 37 70.927 72.867 -1.940 1
1 401 . 2 1 1 A 37 37 THR N N 37 113.147 112.307 0.840 1
1 402 . 2 1 1 A 38 38 ASP H H 38 8.931 8.854 0.077 1
1 403 . 2 1 1 A 38 38 ASP HA H 38 4.852 5.048 -0.196 1
1 406 . 2 1 1 A 38 38 ASP CA C 38 54.826 52.987 1.839 1
1 407 . 2 1 1 A 38 38 ASP CB C 38 43.332 43.592 -0.260 1
1 408 . 2 1 1 A 38 38 ASP N N 38 120.401 122.126 -1.725 1
1 409 . 2 1 1 A 39 39 GLY H H 39 8.068 8.392 -0.324 1
1 410 . 2 1 1 A 39 39 GLY HA2 H 39 3.774 3.887 -0.113 1
1 411 . 2 1 1 A 39 39 GLY HA3 H 39 3.555 4.028 -0.473 1
1 412 . 2 1 1 A 39 39 GLY C C 39 172.578 173.291 -0.713 1
1 413 . 2 1 1 A 39 39 GLY CA C 39 43.967 44.668 -0.701 1
1 414 . 2 1 1 A 39 39 GLY N N 39 107.925 109.053 -1.128 1
1 415 . 2 1 1 A 40 40 HIS H H 40 9.111 8.485 0.626 1
1 416 . 2 1 1 A 40 40 HIS HA H 40 4.650 4.723 -0.073 1
1 421 . 2 1 1 A 40 40 HIS C C 40 174.330 174.488 -0.158 1
1 422 . 2 1 1 A 40 40 HIS CA C 40 55.886 55.947 -0.061 1
1 423 . 2 1 1 A 40 40 HIS CB C 40 30.507 29.835 0.672 1
1 426 . 2 1 1 A 40 40 HIS N N 40 119.179 119.069 0.110 1
1 427 . 2 1 1 A 41 41 LEU H H 41 8.254 8.326 -0.072 1
1 428 . 2 1 1 A 41 41 LEU HA H 41 4.626 4.653 -0.027 1
1 438 . 2 1 1 A 41 41 LEU C C 41 176.035 176.740 -0.705 1
1 439 . 2 1 1 A 41 41 LEU CA C 41 55.621 54.543 1.078 1
1 440 . 2 1 1 A 41 41 LEU CB C 41 45.091 41.564 3.527 1
1 444 . 2 1 1 A 41 41 LEU N N 41 124.808 125.278 -0.470 1
1 445 . 2 1 1 A 42 42 ILE H H 42 8.685 8.435 0.250 1
1 446 . 2 1 1 A 42 42 ILE HA H 42 4.578 4.591 -0.013 1
1 456 . 2 1 1 A 42 42 ILE C C 42 175.369 176.026 -0.657 1
1 457 . 2 1 1 A 42 42 ILE CA C 42 59.852 60.588 -0.736 1
1 458 . 2 1 1 A 42 42 ILE CB C 42 36.778 38.580 -1.802 1
1 462 . 2 1 1 A 42 42 ILE N N 42 121.814 125.118 -3.304 1
1 463 . 2 1 1 A 43 43 ARG H H 43 8.787 8.574 0.213 1
1 464 . 2 1 1 A 43 43 ARG HA H 43 4.852 4.586 0.266 1
1 472 . 2 1 1 A 43 43 ARG C C 43 174.029 174.783 -0.754 1
1 473 . 2 1 1 A 43 43 ARG CA C 43 52.730 55.649 -2.919 1
1 474 . 2 1 1 A 43 43 ARG CB C 43 36.983 33.541 3.442 1
1 477 . 2 1 1 A 43 43 ARG N N 43 125.771 125.694 0.077 1
1 479 . 2 1 1 A 44 44 VAL H H 44 8.661 8.592 0.069 1
1 480 . 2 1 1 A 44 44 VAL HA H 44 3.276 3.728 -0.452 1
1 488 . 2 1 1 A 44 44 VAL C C 44 173.227 175.243 -2.016 1
1 489 . 2 1 1 A 44 44 VAL CA C 44 63.161 63.286 -0.125 1
1 490 . 2 1 1 A 44 44 VAL CB C 44 29.054 29.717 -0.663 1
1 493 . 2 1 1 A 44 44 VAL N N 44 117.026 119.808 -2.782 1
1 494 . 2 1 1 A 45 45 ILE H H 45 8.464 7.963 0.501 1
1 495 . 2 1 1 A 45 45 ILE HA H 45 4.579 4.215 0.364 1
1 505 . 2 1 1 A 45 45 ILE C C 45 178.108 175.086 3.022 1
1 506 . 2 1 1 A 45 45 ILE CA C 45 59.888 61.065 -1.177 1
1 507 . 2 1 1 A 45 45 ILE CB C 45 36.998 37.224 -0.226 1
1 511 . 2 1 1 A 45 45 ILE N N 45 122.767 122.407 0.360 1
1 512 . 2 1 1 A 46 46 GLU H H 46 9.015 8.237 0.778 1
1 513 . 2 1 1 A 46 46 GLU HA H 46 4.206 4.320 -0.114 1
1 518 . 2 1 1 A 46 46 GLU C C 46 177.746 176.492 1.254 1
1 519 . 2 1 1 A 46 46 GLU CA C 46 56.130 57.172 -1.042 1
1 520 . 2 1 1 A 46 46 GLU CB C 46 30.581 30.218 0.363 1
1 522 . 2 1 1 A 46 46 GLU N N 46 131.076 127.297 3.779 1
1 523 . 2 1 1 A 47 47 GLU H H 47 9.213 8.765 0.448 1
1 524 . 2 1 1 A 47 47 GLU HA H 47 4.194 3.992 0.202 1
1 529 . 2 1 1 A 47 47 GLU C C 47 178.088 177.621 0.467 1
1 530 . 2 1 1 A 47 47 GLU CA C 47 58.212 58.155 0.057 1
1 531 . 2 1 1 A 47 47 GLU CB C 47 29.390 29.564 -0.174 1
1 533 . 2 1 1 A 47 47 GLU N N 47 129.592 123.668 5.924 1
1 534 . 2 1 1 A 48 48 GLY H H 48 9.586 8.854 0.732 1
1 535 . 2 1 1 A 48 48 GLY HA2 H 48 4.141 3.872 0.269 1
1 536 . 2 1 1 A 48 48 GLY HA3 H 48 3.757 3.872 -0.115 1
1 537 . 2 1 1 A 48 48 GLY C C 48 173.790 173.898 -0.108 1
1 538 . 2 1 1 A 48 48 GLY CA C 48 45.764 45.868 -0.104 1
1 539 . 2 1 1 A 48 48 GLY N N 48 114.819 115.412 -0.593 1
1 540 . 2 1 1 A 49 49 SER H H 49 7.580 7.915 -0.335 1
1 541 . 2 1 1 A 49 49 SER HA H 49 4.728 4.777 -0.049 1
1 544 . 2 1 1 A 49 49 SER C C 49 173.542 174.516 -0.974 1
1 545 . 2 1 1 A 49 49 SER CA C 49 57.560 55.923 1.637 1
1 546 . 2 1 1 A 49 49 SER CB C 49 64.529 63.921 0.608 1
1 547 . 2 1 1 A 49 49 SER N N 49 114.688 114.629 0.059 1
1 548 . 2 1 1 A 50 50 PRO HA H 50 4.431 4.571 -0.140 1
1 555 . 2 1 1 A 50 50 PRO C C 50 179.377 177.610 1.767 1
1 556 . 2 1 1 A 50 50 PRO CA C 50 66.059 64.278 1.781 1
1 557 . 2 1 1 A 50 50 PRO CB C 50 32.598 31.836 0.762 1
1 560 . 2 1 1 A 51 51 ALA H H 51 8.264 8.047 0.217 1
1 561 . 2 1 1 A 51 51 ALA HA H 51 3.817 4.094 -0.277 1
1 565 . 2 1 1 A 51 51 ALA C C 51 177.508 179.957 -2.449 1
1 566 . 2 1 1 A 51 51 ALA CA C 51 55.392 54.863 0.529 1
1 567 . 2 1 1 A 51 51 ALA CB C 51 20.474 18.451 2.023 1
1 568 . 2 1 1 A 51 51 ALA N N 51 117.604 120.546 -2.942 1
1 569 . 2 1 1 A 52 52 GLU H H 52 7.794 7.347 0.447 1
1 570 . 2 1 1 A 52 52 GLU HA H 52 3.881 4.110 -0.229 1
1 575 . 2 1 1 A 52 52 GLU C C 52 181.401 179.170 2.231 1
1 576 . 2 1 1 A 52 52 GLU CA C 52 59.454 58.718 0.736 1
1 577 . 2 1 1 A 52 52 GLU CB C 52 30.247 29.597 0.650 1
1 579 . 2 1 1 A 52 52 GLU N N 52 119.474 118.231 1.243 1
1 580 . 2 1 1 A 53 53 LYS H H 53 8.557 7.722 0.835 1
1 581 . 2 1 1 A 53 53 LYS HA H 53 4.020 4.055 -0.035 1
1 588 . 2 1 1 A 53 53 LYS C C 53 177.939 177.754 0.185 1
1 589 . 2 1 1 A 53 53 LYS CA C 53 59.012 58.413 0.599 1
1 590 . 2 1 1 A 53 53 LYS CB C 53 32.438 32.115 0.323 1
1 594 . 2 1 1 A 53 53 LYS N N 53 120.057 120.020 0.037 1
1 595 . 2 1 1 A 54 54 ALA H H 54 7.764 7.540 0.224 1
1 596 . 2 1 1 A 54 54 ALA HA H 54 4.400 4.319 0.081 1
1 600 . 2 1 1 A 54 54 ALA C C 54 177.658 177.828 -0.170 1
1 601 . 2 1 1 A 54 54 ALA CA C 54 52.412 51.740 0.672 1
1 602 . 2 1 1 A 54 54 ALA CB C 54 20.739 18.380 2.359 1
1 603 . 2 1 1 A 54 54 ALA N N 54 117.678 118.771 -1.093 1
1 604 . 2 1 1 A 55 55 GLY H H 55 7.583 7.937 -0.354 1
1 605 . 2 1 1 A 55 55 GLY HA2 H 55 4.266 3.909 0.357 1
1 606 . 2 1 1 A 55 55 GLY HA3 H 55 3.775 3.915 -0.140 1
1 607 . 2 1 1 A 55 55 GLY C C 55 175.232 173.919 1.313 1
1 608 . 2 1 1 A 55 55 GLY CA C 55 45.368 45.874 -0.506 1
1 609 . 2 1 1 A 55 55 GLY N N 55 103.265 107.789 -4.524 1
1 610 . 2 1 1 A 56 56 LEU H H 56 7.280 7.808 -0.528 1
1 611 . 2 1 1 A 56 56 LEU HA H 56 3.984 4.391 -0.407 1
1 621 . 2 1 1 A 56 56 LEU C C 56 174.708 175.382 -0.674 1
1 622 . 2 1 1 A 56 56 LEU CA C 56 55.603 54.813 0.790 1
1 623 . 2 1 1 A 56 56 LEU CB C 56 42.752 42.608 0.144 1
1 627 . 2 1 1 A 56 56 LEU N N 56 119.211 123.321 -4.110 1
1 628 . 2 1 1 A 57 57 LEU H H 57 8.693 8.631 0.062 1
1 629 . 2 1 1 A 57 57 LEU HA H 57 4.499 4.923 -0.424 1
1 639 . 2 1 1 A 57 57 LEU C C 57 176.124 175.878 0.246 1
1 640 . 2 1 1 A 57 57 LEU CA C 57 52.959 53.532 -0.573 1
1 641 . 2 1 1 A 57 57 LEU CB C 57 45.122 45.966 -0.844 1
1 645 . 2 1 1 A 57 57 LEU N N 57 121.969 127.851 -5.882 1
1 646 . 2 1 1 A 58 58 ASP H H 58 8.334 8.722 -0.388 1
1 647 . 2 1 1 A 58 58 ASP HA H 58 4.139 4.830 -0.691 1
1 650 . 2 1 1 A 58 58 ASP C C 58 178.636 176.635 2.001 1
1 651 . 2 1 1 A 58 58 ASP CA C 58 56.079 55.461 0.618 1
1 652 . 2 1 1 A 58 58 ASP CB C 58 42.135 40.294 1.841 1
1 653 . 2 1 1 A 58 58 ASP N N 58 120.401 122.349 -1.948 1
1 654 . 2 1 1 A 59 59 GLY H H 59 9.378 9.097 0.281 1
1 655 . 2 1 1 A 59 59 GLY HA2 H 59 4.317 3.926 0.391 1
1 656 . 2 1 1 A 59 59 GLY HA3 H 59 3.260 3.931 -0.671 1
1 657 . 2 1 1 A 59 59 GLY C C 59 173.359 174.022 -0.663 1
1 658 . 2 1 1 A 59 59 GLY CA C 59 45.517 45.078 0.439 1
1 659 . 2 1 1 A 59 59 GLY N N 59 116.622 111.983 4.639 1
1 660 . 2 1 1 A 60 60 ASP H H 60 8.009 7.945 0.064 1
1 661 . 2 1 1 A 60 60 ASP HA H 60 4.638 4.854 -0.216 1
1 664 . 2 1 1 A 60 60 ASP C C 60 175.555 175.406 0.149 1
1 665 . 2 1 1 A 60 60 ASP CA C 60 55.286 53.498 1.788 1
1 666 . 2 1 1 A 60 60 ASP CB C 60 42.381 41.990 0.391 1
1 667 . 2 1 1 A 60 60 ASP N N 60 121.370 120.716 0.654 1
1 668 . 2 1 1 A 61 61 ARG H H 61 8.648 8.682 -0.034 1
1 669 . 2 1 1 A 61 61 ARG HA H 61 5.179 4.919 0.260 1
1 677 . 2 1 1 A 61 61 ARG C C 61 177.381 174.683 2.698 1
1 678 . 2 1 1 A 61 61 ARG CA C 61 53.704 54.635 -0.931 1
1 679 . 2 1 1 A 61 61 ARG CB C 61 34.017 31.799 2.218 1
1 682 . 2 1 1 A 61 61 ARG N N 61 116.958 122.203 -5.245 1
1 684 . 2 1 1 A 62 62 VAL H H 62 8.247 8.325 -0.078 1
1 685 . 2 1 1 A 62 62 VAL HA H 62 3.806 4.598 -0.792 1
1 693 . 2 1 1 A 62 62 VAL C C 62 174.748 174.967 -0.219 1
1 694 . 2 1 1 A 62 62 VAL CA C 62 63.149 62.188 0.961 1
1 695 . 2 1 1 A 62 62 VAL CB C 62 32.574 31.891 0.683 1
1 698 . 2 1 1 A 62 62 VAL N N 62 118.546 125.988 -7.442 1
1 699 . 2 1 1 A 63 63 LEU H H 63 9.262 9.035 0.227 1
1 700 . 2 1 1 A 63 63 LEU HA H 63 4.412 4.389 0.023 1
1 710 . 2 1 1 A 63 63 LEU C C 63 177.649 177.297 0.352 1
1 711 . 2 1 1 A 63 63 LEU CA C 63 56.044 56.705 -0.661 1
1 712 . 2 1 1 A 63 63 LEU CB C 63 43.339 42.885 0.454 1
1 716 . 2 1 1 A 63 63 LEU N N 63 125.413 131.310 -5.897 1
1 717 . 2 1 1 A 64 64 ARG H H 64 7.806 7.743 0.063 1
1 718 . 2 1 1 A 64 64 ARG HA H 64 5.704 4.932 0.772 1
1 726 . 2 1 1 A 64 64 ARG C C 64 175.091 174.170 0.921 1
1 727 . 2 1 1 A 64 64 ARG CA C 64 54.148 54.733 -0.585 1
1 728 . 2 1 1 A 64 64 ARG CB C 64 35.742 34.028 1.714 1
1 731 . 2 1 1 A 64 64 ARG N N 64 112.961 117.127 -4.166 1
1 733 . 2 1 1 A 65 65 ILE H H 65 8.327 9.134 -0.807 1
1 734 . 2 1 1 A 65 65 ILE HA H 65 4.384 4.686 -0.302 1
1 744 . 2 1 1 A 65 65 ILE C C 65 175.722 175.413 0.309 1
1 745 . 2 1 1 A 65 65 ILE CA C 65 60.501 59.304 1.197 1
1 746 . 2 1 1 A 65 65 ILE CB C 65 39.547 40.430 -0.883 1
1 750 . 2 1 1 A 65 65 ILE N N 65 119.175 123.186 -4.011 1
1 751 . 2 1 1 A 66 66 ASN H H 66 9.911 9.802 0.109 1
1 752 . 2 1 1 A 66 66 ASN HA H 66 4.428 4.378 0.050 1
1 757 . 2 1 1 A 66 66 ASN C C 66 175.349 174.661 0.688 1
1 758 . 2 1 1 A 66 66 ASN CA C 66 54.157 54.243 -0.086 1
1 759 . 2 1 1 A 66 66 ASN CB C 66 37.024 37.474 -0.450 1
1 760 . 2 1 1 A 66 66 ASN N N 66 128.952 128.080 0.872 1
1 762 . 2 1 1 A 67 67 GLY H H 67 9.230 8.665 0.565 1
1 763 . 2 1 1 A 67 67 GLY HA2 H 67 4.322 3.979 0.343 1
1 764 . 2 1 1 A 67 67 GLY HA3 H 67 3.508 3.987 -0.479 1
1 765 . 2 1 1 A 67 67 GLY C C 67 174.393 173.983 0.410 1
1 766 . 2 1 1 A 67 67 GLY CA C 67 45.341 46.553 -1.212 1
1 767 . 2 1 1 A 67 67 GLY N N 67 103.238 104.662 -1.424 1
1 768 . 2 1 1 A 68 68 VAL H H 68 8.063 7.739 0.324 1
1 769 . 2 1 1 A 68 68 VAL HA H 68 4.015 4.631 -0.616 1
1 777 . 2 1 1 A 68 68 VAL C C 68 175.833 174.781 1.052 1
1 778 . 2 1 1 A 68 68 VAL CA C 68 62.603 61.377 1.226 1
1 779 . 2 1 1 A 68 68 VAL CB C 68 32.574 34.924 -2.350 1
1 782 . 2 1 1 A 68 68 VAL N N 68 125.696 119.453 6.243 1
1 783 . 2 1 1 A 69 69 PHE H H 69 9.301 9.156 0.145 1
1 784 . 2 1 1 A 69 69 PHE HA H 69 4.947 4.605 0.342 1
1 792 . 2 1 1 A 69 69 PHE C C 69 177.120 175.822 1.298 1
1 793 . 2 1 1 A 69 69 PHE CA C 69 59.200 58.657 0.543 1
1 794 . 2 1 1 A 69 69 PHE CB C 69 39.320 39.343 -0.023 1
1 800 . 2 1 1 A 69 69 PHE N N 69 128.641 128.946 -0.305 1
1 801 . 2 1 1 A 70 70 VAL H H 70 8.312 7.881 0.431 1
1 802 . 2 1 1 A 70 70 VAL HA H 70 4.517 4.459 0.058 1
1 810 . 2 1 1 A 70 70 VAL CA C 70 60.734 60.450 0.284 1
1 811 . 2 1 1 A 70 70 VAL CB C 70 32.976 31.365 1.611 1
1 814 . 2 1 1 A 70 70 VAL N N 70 118.381 120.312 -1.931 1
1 815 . 2 1 1 A 71 71 ASP H H 71 5.373 7.091 -1.718 1
1 816 . 2 1 1 A 71 71 ASP HA H 71 4.413 4.241 0.172 1
1 819 . 2 1 1 A 71 71 ASP C C 71 174.896 177.977 -3.081 1
1 820 . 2 1 1 A 71 71 ASP CA C 71 58.334 56.989 1.345 1
1 821 . 2 1 1 A 71 71 ASP CB C 71 46.097 40.700 5.397 1
1 822 . 2 1 1 A 71 71 ASP N N 71 119.008 122.114 -3.106 1
1 823 . 2 1 1 A 72 72 LYS H H 72 7.874 7.737 0.137 1
1 824 . 2 1 1 A 72 72 LYS HA H 72 4.522 4.222 0.300 1
1 833 . 2 1 1 A 72 72 LYS C C 72 177.209 177.165 0.044 1
1 834 . 2 1 1 A 72 72 LYS CA C 72 54.122 58.123 -4.001 1
1 835 . 2 1 1 A 72 72 LYS CB C 72 31.640 32.342 -0.702 1
1 839 . 2 1 1 A 72 72 LYS N N 72 110.259 118.414 -8.155 1
1 840 . 2 1 1 A 73 73 GLU H H 73 7.421 7.794 -0.373 1
1 841 . 2 1 1 A 73 73 GLU HA H 73 4.401 4.360 0.041 1
1 846 . 2 1 1 A 73 73 GLU C C 73 176.728 176.294 0.434 1
1 847 . 2 1 1 A 73 73 GLU CA C 73 54.950 57.062 -2.112 1
1 848 . 2 1 1 A 73 73 GLU CB C 73 30.390 30.455 -0.065 1
1 850 . 2 1 1 A 73 73 GLU N N 73 120.043 119.163 0.880 1
1 851 . 2 1 1 A 74 74 GLU H H 74 9.360 8.476 0.884 1
1 852 . 2 1 1 A 74 74 GLU HA H 74 4.403 4.575 -0.172 1
1 857 . 2 1 1 A 74 74 GLU C C 74 178.234 177.276 0.958 1
1 858 . 2 1 1 A 74 74 GLU CA C 74 56.516 55.839 0.677 1
1 859 . 2 1 1 A 74 74 GLU CB C 74 30.390 31.825 -1.435 1
1 861 . 2 1 1 A 74 74 GLU N N 74 122.193 122.093 0.100 1
1 862 . 2 1 1 A 75 75 HIS H H 75 9.553 9.263 0.290 1
1 863 . 2 1 1 A 75 75 HIS HA H 75 4.080 4.135 -0.055 1
1 868 . 2 1 1 A 75 75 HIS C C 75 175.985 176.859 -0.874 1
1 869 . 2 1 1 A 75 75 HIS CA C 75 61.016 60.483 0.533 1
1 870 . 2 1 1 A 75 75 HIS CB C 75 29.468 30.662 -1.194 1
1 873 . 2 1 1 A 75 75 HIS N N 75 123.587 127.529 -3.942 1
1 874 . 2 1 1 A 76 76 ALA H H 76 9.129 8.291 0.838 1
1 875 . 2 1 1 A 76 76 ALA HA H 76 3.826 3.749 0.077 1
1 879 . 2 1 1 A 76 76 ALA C C 76 180.475 179.531 0.944 1
1 880 . 2 1 1 A 76 76 ALA CA C 76 55.392 54.852 0.540 1
1 881 . 2 1 1 A 76 76 ALA CB C 76 18.182 18.186 -0.004 1
1 882 . 2 1 1 A 76 76 ALA N N 76 117.795 120.907 -3.112 1
1 883 . 2 1 1 A 77 77 GLN H H 77 7.099 8.049 -0.950 1
1 884 . 2 1 1 A 77 77 GLN HA H 77 4.198 4.031 0.167 1
1 891 . 2 1 1 A 77 77 GLN C C 77 177.860 178.689 -0.829 1
1 892 . 2 1 1 A 77 77 GLN CA C 77 57.790 58.776 -0.986 1
1 893 . 2 1 1 A 77 77 GLN CB C 77 28.536 28.426 0.110 1
1 895 . 2 1 1 A 77 77 GLN N N 77 115.764 117.926 -2.162 1
1 897 . 2 1 1 A 78 78 VAL H H 78 7.430 7.722 -0.292 1
1 898 . 2 1 1 A 78 78 VAL HA H 78 3.241 3.535 -0.294 1
1 906 . 2 1 1 A 78 78 VAL C C 78 177.042 177.789 -0.747 1
1 907 . 2 1 1 A 78 78 VAL CA C 78 67.299 66.472 0.827 1
1 908 . 2 1 1 A 78 78 VAL CB C 78 30.819 31.383 -0.564 1
1 911 . 2 1 1 A 78 78 VAL N N 78 121.143 120.340 0.803 1
1 912 . 2 1 1 A 79 79 VAL H H 79 7.773 7.878 -0.105 1
1 913 . 2 1 1 A 79 79 VAL HA H 79 3.315 3.644 -0.329 1
1 921 . 2 1 1 A 79 79 VAL C C 79 179.179 177.565 1.614 1
1 922 . 2 1 1 A 79 79 VAL CA C 79 66.694 65.406 1.288 1
1 923 . 2 1 1 A 79 79 VAL CB C 79 31.841 31.138 0.703 1
1 926 . 2 1 1 A 79 79 VAL N N 79 117.473 119.933 -2.460 1
1 927 . 2 1 1 A 80 80 GLU H H 80 7.410 7.501 -0.091 1
1 928 . 2 1 1 A 80 80 GLU HA H 80 4.258 4.117 0.141 1
1 933 . 2 1 1 A 80 80 GLU C C 80 178.018 179.142 -1.124 1
1 934 . 2 1 1 A 80 80 GLU CA C 80 58.566 58.532 0.034 1
1 935 . 2 1 1 A 80 80 GLU CB C 80 29.072 29.273 -0.201 1
1 937 . 2 1 1 A 80 80 GLU N N 80 120.451 120.934 -0.483 1
1 938 . 2 1 1 A 81 81 LEU H H 81 8.070 8.263 -0.193 1
1 939 . 2 1 1 A 81 81 LEU HA H 81 3.976 4.012 -0.036 1
1 949 . 2 1 1 A 81 81 LEU C C 81 180.658 179.502 1.156 1
1 950 . 2 1 1 A 81 81 LEU CA C 81 58.061 57.911 0.150 1
1 951 . 2 1 1 A 81 81 LEU CB C 81 42.115 41.975 0.140 1
1 955 . 2 1 1 A 81 81 LEU N N 81 119.943 120.861 -0.918 1
1 956 . 2 1 1 A 82 82 VAL H H 82 7.609 8.195 -0.586 1
1 957 . 2 1 1 A 82 82 VAL HA H 82 3.474 3.602 -0.128 1
1 965 . 2 1 1 A 82 82 VAL C C 82 178.927 178.330 0.597 1
1 966 . 2 1 1 A 82 82 VAL CA C 82 67.398 67.153 0.245 1
1 967 . 2 1 1 A 82 82 VAL CB C 82 31.306 31.529 -0.223 1
1 970 . 2 1 1 A 82 82 VAL N N 82 118.150 118.456 -0.306 1
1 971 . 2 1 1 A 83 83 ARG H H 83 8.186 7.701 0.485 1
1 972 . 2 1 1 A 83 83 ARG HA H 83 3.994 4.072 -0.078 1
1 979 . 2 1 1 A 83 83 ARG C C 83 179.999 179.076 0.923 1
1 980 . 2 1 1 A 83 83 ARG CA C 83 60.205 59.937 0.268 1
1 981 . 2 1 1 A 83 83 ARG CB C 83 30.103 30.063 0.040 1
1 984 . 2 1 1 A 83 83 ARG N N 83 122.902 119.457 3.445 1
1 985 . 2 1 1 A 84 84 LYS H H 84 8.772 7.883 0.889 1
1 986 . 2 1 1 A 84 84 LYS HA H 84 4.047 4.090 -0.043 1
1 995 . 2 1 1 A 84 84 LYS C C 84 176.934 178.810 -1.876 1
1 996 . 2 1 1 A 84 84 LYS CA C 84 58.142 59.189 -1.047 1
1 997 . 2 1 1 A 84 84 LYS CB C 84 32.492 31.768 0.724 1
1 1001 . 2 1 1 A 84 84 LYS N N 84 117.548 119.318 -1.770 1
1 1002 . 2 1 1 A 85 85 SER H H 85 7.333 8.280 -0.947 1
1 1003 . 2 1 1 A 85 85 SER HA H 85 4.235 4.244 -0.009 1
1 1006 . 2 1 1 A 85 85 SER C C 85 175.588 175.114 0.474 1
1 1007 . 2 1 1 A 85 85 SER CA C 85 59.535 61.946 -2.411 1
1 1008 . 2 1 1 A 85 85 SER CB C 85 63.571 63.783 -0.212 1
1 1009 . 2 1 1 A 85 85 SER N N 85 113.544 115.939 -2.395 1
1 1010 . 2 1 1 A 86 86 GLY H H 86 7.459 7.562 -0.103 1
1 1011 . 2 1 1 A 86 86 GLY HA2 H 86 4.176 4.113 0.063 1
1 1012 . 2 1 1 A 86 86 GLY HA3 H 86 3.762 4.121 -0.359 1
1 1013 . 2 1 1 A 86 86 GLY C C 86 176.407 175.125 1.282 1
1 1014 . 2 1 1 A 86 86 GLY CA C 86 46.109 44.056 2.053 1
1 1015 . 2 1 1 A 86 86 GLY N N 86 104.331 106.198 -1.867 1
1 1016 . 2 1 1 A 87 87 ASN HA H 87 4.650 4.491 0.159 1
1 1021 . 2 1 1 A 87 87 ASN C C 87 173.653 175.872 -2.219 1
1 1022 . 2 1 1 A 87 87 ASN CA C 87 54.492 55.647 -1.155 1
1 1023 . 2 1 1 A 87 87 ASN CB C 87 38.425 38.845 -0.420 1
1 1024 . 2 1 1 A 87 87 ASN N N 87 118.401 120.527 -2.126 1
1 1026 . 2 1 1 A 88 88 SER H H 88 7.435 8.046 -0.611 1
1 1027 . 2 1 1 A 88 88 SER HA H 88 5.438 5.197 0.241 1
1 1030 . 2 1 1 A 88 88 SER C C 88 172.867 173.549 -0.682 1
1 1031 . 2 1 1 A 88 88 SER CA C 88 58.160 56.718 1.442 1
1 1032 . 2 1 1 A 88 88 SER CB C 88 65.861 64.768 1.093 1
1 1033 . 2 1 1 A 88 88 SER N N 88 113.765 112.233 1.532 1
1 1034 . 2 1 1 A 89 89 VAL H H 89 8.452 8.894 -0.442 1
1 1035 . 2 1 1 A 89 89 VAL HA H 89 4.519 4.904 -0.385 1
1 1043 . 2 1 1 A 89 89 VAL C C 89 171.391 174.770 -3.379 1
1 1044 . 2 1 1 A 89 89 VAL CA C 89 61.333 60.521 0.812 1
1 1045 . 2 1 1 A 89 89 VAL CB C 89 33.897 35.829 -1.932 1
1 1048 . 2 1 1 A 89 89 VAL N N 89 120.001 124.174 -4.173 1
1 1049 . 2 1 1 A 90 90 THR H H 90 8.348 8.779 -0.431 1
1 1050 . 2 1 1 A 90 90 THR HA H 90 5.042 5.013 0.029 1
1 1055 . 2 1 1 A 90 90 THR C C 90 173.926 173.805 0.121 1
1 1056 . 2 1 1 A 90 90 THR CA C 90 61.403 62.055 -0.652 1
1 1057 . 2 1 1 A 90 90 THR CB C 90 69.553 69.728 -0.175 1
1 1059 . 2 1 1 A 90 90 THR N N 90 123.477 123.901 -0.424 1
1 1060 . 2 1 1 A 91 91 LEU H H 91 9.195 9.012 0.183 1
1 1061 . 2 1 1 A 91 91 LEU HA H 91 5.161 5.056 0.105 1
1 1071 . 2 1 1 A 91 91 LEU C C 91 174.564 175.401 -0.837 1
1 1072 . 2 1 1 A 91 91 LEU CA C 91 52.590 53.467 -0.877 1
1 1073 . 2 1 1 A 91 91 LEU CB C 91 44.998 43.261 1.737 1
1 1077 . 2 1 1 A 91 91 LEU N N 91 128.419 128.304 0.115 1
1 1078 . 2 1 1 A 92 92 LEU H H 92 8.644 8.805 -0.161 1
1 1079 . 2 1 1 A 92 92 LEU HA H 92 5.335 4.946 0.389 1
1 1089 . 2 1 1 A 92 92 LEU C C 92 176.451 176.331 0.120 1
1 1090 . 2 1 1 A 92 92 LEU CA C 92 54.220 53.553 0.667 1
1 1091 . 2 1 1 A 92 92 LEU CB C 92 44.323 41.690 2.633 1
1 1095 . 2 1 1 A 92 92 LEU N N 92 125.894 125.560 0.334 1
1 1096 . 2 1 1 A 93 93 VAL H H 93 9.249 9.321 -0.072 1
1 1097 . 2 1 1 A 93 93 VAL HA H 93 5.573 5.173 0.400 1
1 1105 . 2 1 1 A 93 93 VAL C C 93 173.550 174.127 -0.577 1
1 1106 . 2 1 1 A 93 93 VAL CA C 93 58.340 59.463 -1.123 1
1 1107 . 2 1 1 A 93 93 VAL CB C 93 36.159 34.260 1.899 1
1 1110 . 2 1 1 A 93 93 VAL N N 93 120.660 120.592 0.068 1
1 1111 . 2 1 1 A 94 94 LEU H H 94 8.634 8.507 0.127 1
1 1112 . 2 1 1 A 94 94 LEU HA H 94 4.911 5.161 -0.250 1
1 1122 . 2 1 1 A 94 94 LEU C C 94 174.172 175.359 -1.187 1
1 1123 . 2 1 1 A 94 94 LEU CA C 94 52.659 53.553 -0.894 1
1 1124 . 2 1 1 A 94 94 LEU CB C 94 47.910 46.540 1.370 1
1 1128 . 2 1 1 A 94 94 LEU N N 94 120.304 125.334 -5.030 1
1 1129 . 2 1 1 A 95 95 ASP H H 95 8.210 8.778 -0.568 1
1 1130 . 2 1 1 A 95 95 ASP HA H 95 5.190 4.576 0.614 1
1 1133 . 2 1 1 A 95 95 ASP C C 95 175.887 177.995 -2.108 1
1 1134 . 2 1 1 A 95 95 ASP CA C 95 53.899 54.845 -0.946 1
1 1135 . 2 1 1 A 95 95 ASP CB C 95 41.188 40.902 0.286 1
1 1136 . 2 1 1 A 95 95 ASP N N 95 122.184 124.250 -2.066 1
1 1137 . 2 1 1 A 96 96 GLY H H 96 8.478 8.847 -0.369 1
1 1138 . 2 1 1 A 96 96 GLY HA2 H 96 4.002 3.809 0.193 1
1 1139 . 2 1 1 A 96 96 GLY HA3 H 96 3.757 3.811 -0.054 1
1 1140 . 2 1 1 A 96 96 GLY C C 96 175.497 175.420 0.077 1
1 1141 . 2 1 1 A 96 96 GLY CA C 96 49.944 47.424 2.520 1
1 1142 . 2 1 1 A 96 96 GLY N N 96 108.610 110.856 -2.246 1
1 1143 . 2 1 1 A 97 97 ASP H H 97 8.401 8.171 0.230 1
1 1144 . 2 1 1 A 97 97 ASP HA H 97 4.454 4.334 0.120 1
1 1147 . 2 1 1 A 97 97 ASP C C 97 179.612 178.585 1.027 1
1 1148 . 2 1 1 A 97 97 ASP CA C 97 57.913 57.406 0.507 1
1 1149 . 2 1 1 A 97 97 ASP CB C 97 41.145 40.420 0.725 1
1 1150 . 2 1 1 A 97 97 ASP N N 97 120.034 121.485 -1.451 1
1 1151 . 2 1 1 A 98 98 SER H H 98 8.152 8.048 0.104 1
1 1152 . 2 1 1 A 98 98 SER HA H 98 4.218 4.101 0.117 1
1 1155 . 2 1 1 A 98 98 SER C C 98 175.061 176.405 -1.344 1
1 1156 . 2 1 1 A 98 98 SER CA C 98 62.180 61.400 0.780 1
1 1157 . 2 1 1 A 98 98 SER CB C 98 62.179 63.163 -0.984 1
1 1158 . 2 1 1 A 98 98 SER N N 98 117.174 113.866 3.308 1
1 1159 . 2 1 1 A 99 99 TYR H H 99 9.051 8.461 0.590 1
1 1160 . 2 1 1 A 99 99 TYR HA H 99 3.692 3.838 -0.146 1
1 1167 . 2 1 1 A 99 99 TYR C C 99 176.460 177.091 -0.631 1
1 1168 . 2 1 1 A 99 99 TYR CA C 99 62.814 62.156 0.658 1
1 1169 . 2 1 1 A 99 99 TYR CB C 99 38.829 38.466 0.363 1
1 1174 . 2 1 1 A 99 99 TYR N N 99 123.539 122.480 1.059 1
1 1175 . 2 1 1 A 100 100 GLU H H 100 8.520 8.332 0.188 1
1 1176 . 2 1 1 A 100 100 GLU HA H 100 3.952 3.951 0.001 1
1 1181 . 2 1 1 A 100 100 GLU C C 100 180.151 179.204 0.947 1
1 1182 . 2 1 1 A 100 100 GLU CA C 100 60.099 59.930 0.169 1
1 1183 . 2 1 1 A 100 100 GLU CB C 100 29.435 29.170 0.265 1
1 1185 . 2 1 1 A 100 100 GLU N N 100 117.082 118.087 -1.005 1
1 1186 . 2 1 1 A 101 101 LYS H H 101 7.740 8.163 -0.423 1
1 1187 . 2 1 1 A 101 101 LYS HA H 101 3.984 4.095 -0.111 1
1 1196 . 2 1 1 A 101 101 LYS C C 101 178.377 178.764 -0.387 1
1 1197 . 2 1 1 A 101 101 LYS CA C 101 59.888 59.071 0.817 1
1 1198 . 2 1 1 A 101 101 LYS CB C 101 32.821 32.350 0.471 1
1 1202 . 2 1 1 A 101 101 LYS N N 101 119.851 120.823 -0.972 1
1 1203 . 2 1 1 A 102 102 ALA H H 102 8.538 7.760 0.778 1
1 1204 . 2 1 1 A 102 102 ALA HA H 102 3.632 4.045 -0.413 1
1 1208 . 2 1 1 A 102 102 ALA C C 102 179.870 179.269 0.601 1
1 1209 . 2 1 1 A 102 102 ALA CA C 102 55.285 55.040 0.245 1
1 1210 . 2 1 1 A 102 102 ALA CB C 102 17.163 18.695 -1.532 1
1 1211 . 2 1 1 A 102 102 ALA N N 102 124.176 121.131 3.045 1
1 1212 . 2 1 1 A 103 103 VAL H H 103 8.147 8.128 0.019 1
1 1213 . 2 1 1 A 103 103 VAL HA H 103 3.658 3.720 -0.062 1
1 1221 . 2 1 1 A 103 103 VAL C C 103 181.113 177.273 3.840 1
1 1222 . 2 1 1 A 103 103 VAL CA C 103 66.090 65.093 0.997 1
1 1223 . 2 1 1 A 103 103 VAL CB C 103 31.822 31.280 0.542 1
1 1226 . 2 1 1 A 103 103 VAL N N 103 117.841 117.188 0.653 1
1 1227 . 2 1 1 A 104 104 LYS H H 104 7.903 7.505 0.398 1
1 1228 . 2 1 1 A 104 104 LYS HA H 104 4.065 4.120 -0.055 1
1 1235 . 2 1 1 A 104 104 LYS C C 104 177.715 178.269 -0.554 1
1 1236 . 2 1 1 A 104 104 LYS CA C 104 59.094 59.228 -0.134 1
1 1237 . 2 1 1 A 104 104 LYS CB C 104 32.285 32.957 -0.672 1
1 1241 . 2 1 1 A 104 104 LYS N N 104 121.515 121.268 0.247 1
1 1242 . 2 1 1 A 105 105 ASN H H 105 7.747 8.214 -0.467 1
1 1243 . 2 1 1 A 105 105 ASN HA H 105 4.721 4.857 -0.136 1
1 1248 . 2 1 1 A 105 105 ASN C C 105 173.320 174.015 -0.695 1
1 1249 . 2 1 1 A 105 105 ASN CA C 105 53.399 53.032 0.367 1
1 1250 . 2 1 1 A 105 105 ASN CB C 105 39.249 38.594 0.655 1
1 1251 . 2 1 1 A 105 105 ASN N N 105 114.941 114.996 -0.055 1
1 1253 . 2 1 1 A 106 106 GLN H H 106 7.850 7.574 0.276 1
1 1254 . 2 1 1 A 106 106 GLN HA H 106 3.902 3.865 0.037 1
1 1261 . 2 1 1 A 106 106 GLN C C 106 175.168 175.089 0.079 1
1 1262 . 2 1 1 A 106 106 GLN CA C 106 56.978 56.779 0.199 1
1 1263 . 2 1 1 A 106 106 GLN CB C 106 25.770 26.278 -0.508 1
1 1265 . 2 1 1 A 106 106 GLN N N 106 114.989 115.746 -0.757 1
1 1267 . 2 1 1 A 107 107 VAL H H 107 8.005 7.667 0.338 1
1 1268 . 2 1 1 A 107 107 VAL HA H 107 3.664 4.044 -0.380 1
1 1276 . 2 1 1 A 107 107 VAL C C 107 175.468 175.363 0.105 1
1 1277 . 2 1 1 A 107 107 VAL CA C 107 62.726 62.533 0.193 1
1 1278 . 2 1 1 A 107 107 VAL CB C 107 32.535 31.898 0.637 1
1 1281 . 2 1 1 A 107 107 VAL N N 107 120.216 120.137 0.079 1
1 1282 . 2 1 1 A 108 108 ASP H H 108 8.484 8.729 -0.245 1
1 1283 . 2 1 1 A 108 108 ASP HA H 108 4.467 4.464 0.003 1
1 1286 . 2 1 1 A 108 108 ASP C C 108 177.179 176.055 1.124 1
1 1287 . 2 1 1 A 108 108 ASP CA C 108 53.417 55.075 -1.658 1
1 1288 . 2 1 1 A 108 108 ASP CB C 108 40.030 40.425 -0.395 1
1 1289 . 2 1 1 A 108 108 ASP N N 108 125.414 127.009 -1.595 1
1 1290 . 2 1 1 A 109 109 LEU H H 109 8.470 8.447 0.023 1
1 1291 . 2 1 1 A 109 109 LEU HA H 109 3.846 4.148 -0.302 1
1 1301 . 2 1 1 A 109 109 LEU C C 109 178.145 178.341 -0.196 1
1 1302 . 2 1 1 A 109 109 LEU CA C 109 56.573 56.365 0.208 1
1 1303 . 2 1 1 A 109 109 LEU CB C 109 42.011 41.964 0.047 1
1 1307 . 2 1 1 A 109 109 LEU N N 109 127.577 126.156 1.421 1
1 1308 . 2 1 1 A 110 110 LYS H H 110 8.062 8.053 0.009 1
1 1309 . 2 1 1 A 110 110 LYS HA H 110 3.022 3.676 -0.654 1
1 1317 . 2 1 1 A 110 110 LYS C C 110 177.248 178.395 -1.147 1
1 1318 . 2 1 1 A 110 110 LYS CA C 110 58.742 58.698 0.044 1
1 1319 . 2 1 1 A 110 110 LYS CB C 110 31.667 31.706 -0.039 1
1 1323 . 2 1 1 A 110 110 LYS N N 110 118.873 119.483 -0.610 1
1 1324 . 2 1 1 A 111 111 GLU H H 111 7.113 7.758 -0.645 1
1 1325 . 2 1 1 A 111 111 GLU HA H 111 4.117 4.245 -0.128 1
1 1330 . 2 1 1 A 111 111 GLU C C 111 176.519 177.509 -0.990 1
1 1331 . 2 1 1 A 111 111 GLU CA C 111 55.621 58.942 -3.321 1
1 1332 . 2 1 1 A 111 111 GLU CB C 111 29.943 29.826 0.117 1
1 1334 . 2 1 1 A 111 111 GLU N N 111 114.282 117.499 -3.217 1
1 1335 . 2 1 1 A 112 112 LEU H H 112 6.848 7.237 -0.389 1
1 1336 . 2 1 1 A 112 112 LEU HA H 112 4.293 4.170 0.123 1
1 1346 . 2 1 1 A 112 112 LEU C C 112 175.674 175.992 -0.318 1
1 1347 . 2 1 1 A 112 112 LEU CA C 112 55.197 55.698 -0.501 1
1 1348 . 2 1 1 A 112 112 LEU CB C 112 41.681 41.149 0.532 1
1 1352 . 2 1 1 A 112 112 LEU N N 112 118.934 122.452 -3.518 1
1 1353 . 2 1 1 A 113 113 ASP H H 113 8.466 8.058 0.408 1
1 1354 . 2 1 1 A 113 113 ASP HA H 113 4.593 5.330 -0.737 1
1 1357 . 2 1 1 A 113 113 ASP C C 113 174.511 175.131 -0.620 1
1 1358 . 2 1 1 A 113 113 ASP CA C 113 53.558 52.563 0.995 1
1 1359 . 2 1 1 A 113 113 ASP CB C 113 42.448 41.676 0.772 1
1 1360 . 2 1 1 A 113 113 ASP N N 113 122.148 124.122 -1.974 1
1 1 . 3 1 1 A 6 6 SER HA H 6 4.483 5.108 -0.625 1
1 4 . 3 1 1 A 6 6 SER C C 6 175.167 173.549 1.618 1
1 5 . 3 1 1 A 6 6 SER CA C 6 58.759 56.178 2.581 1
1 6 . 3 1 1 A 6 6 SER CB C 6 64.069 65.267 -1.198 1
1 7 . 3 1 1 A 7 7 GLY H H 7 8.431 8.379 0.052 1
1 8 . 3 1 1 A 7 7 GLY HA2 H 7 3.973 4.366 -0.393 1
1 9 . 3 1 1 A 7 7 GLY HA3 H 7 3.973 4.368 -0.395 1
1 10 . 3 1 1 A 7 7 GLY C C 7 174.570 173.710 0.860 1
1 11 . 3 1 1 A 7 7 GLY CA C 7 45.483 45.418 0.065 1
1 12 . 3 1 1 A 7 7 GLY N N 7 110.640 113.706 -3.066 1
1 13 . 3 1 1 A 8 8 MET H H 8 8.239 8.738 -0.499 1
1 14 . 3 1 1 A 8 8 MET HA H 8 4.386 4.621 -0.235 1
1 22 . 3 1 1 A 8 8 MET C C 8 176.621 174.689 1.932 1
1 23 . 3 1 1 A 8 8 MET CA C 8 55.991 56.827 -0.836 1
1 24 . 3 1 1 A 8 8 MET CB C 8 32.986 35.484 -2.498 1
1 27 . 3 1 1 A 8 8 MET N N 8 120.219 118.232 1.987 1
1 28 . 3 1 1 A 9 9 ALA H H 9 8.435 7.923 0.512 1
1 29 . 3 1 1 A 9 9 ALA HA H 9 4.182 4.811 -0.629 1
1 33 . 3 1 1 A 9 9 ALA C C 9 177.951 176.751 1.200 1
1 34 . 3 1 1 A 9 9 ALA CA C 9 53.399 50.533 2.866 1
1 35 . 3 1 1 A 9 9 ALA CB C 9 18.955 22.049 -3.094 1
1 36 . 3 1 1 A 9 9 ALA N N 9 124.459 120.402 4.057 1
1 37 . 3 1 1 A 10 10 SER H H 10 8.100 8.731 -0.631 1
1 38 . 3 1 1 A 10 10 SER HA H 10 4.391 4.608 -0.217 1
1 41 . 3 1 1 A 10 10 SER C C 10 174.467 173.621 0.846 1
1 42 . 3 1 1 A 10 10 SER CA C 10 58.709 58.368 0.341 1
1 43 . 3 1 1 A 10 10 SER CB C 10 63.778 64.817 -1.039 1
1 44 . 3 1 1 A 10 10 SER N N 10 113.881 117.046 -3.165 1
1 45 . 3 1 1 A 11 11 THR H H 11 7.821 8.524 -0.703 1
1 46 . 3 1 1 A 11 11 THR HA H 11 4.191 5.012 -0.821 1
1 51 . 3 1 1 A 11 11 THR C C 11 173.610 173.031 0.579 1
1 52 . 3 1 1 A 11 11 THR CA C 11 61.936 60.270 1.666 1
1 53 . 3 1 1 A 11 11 THR CB C 11 69.713 72.177 -2.464 1
1 55 . 3 1 1 A 11 11 THR N N 11 114.471 114.978 -0.507 1
1 56 . 3 1 1 A 12 12 PHE H H 12 7.946 9.233 -1.287 1
1 57 . 3 1 1 A 12 12 PHE HA H 12 4.769 4.789 -0.020 1
1 65 . 3 1 1 A 12 12 PHE C C 12 174.211 175.056 -0.845 1
1 66 . 3 1 1 A 12 12 PHE CA C 12 56.644 58.046 -1.402 1
1 67 . 3 1 1 A 12 12 PHE CB C 12 40.609 40.199 0.410 1
1 73 . 3 1 1 A 12 12 PHE N N 12 120.763 124.714 -3.951 1
1 74 . 3 1 1 A 13 13 ASN H H 13 9.004 9.305 -0.301 1
1 75 . 3 1 1 A 13 13 ASN HA H 13 5.366 5.568 -0.202 1
1 80 . 3 1 1 A 13 13 ASN C C 13 172.158 174.030 -1.872 1
1 81 . 3 1 1 A 13 13 ASN CA C 13 50.988 50.574 0.414 1
1 82 . 3 1 1 A 13 13 ASN CB C 13 39.942 39.136 0.806 1
1 83 . 3 1 1 A 13 13 ASN N N 13 119.973 118.676 1.297 1
1 85 . 3 1 1 A 14 14 PRO HA H 14 4.945 4.618 0.327 1
1 92 . 3 1 1 A 14 14 PRO C C 14 174.901 175.725 -0.824 1
1 93 . 3 1 1 A 14 14 PRO CA C 14 63.096 62.421 0.675 1
1 94 . 3 1 1 A 14 14 PRO CB C 14 32.739 32.856 -0.117 1
1 97 . 3 1 1 A 15 15 ARG H H 15 8.908 8.385 0.523 1
1 98 . 3 1 1 A 15 15 ARG HA H 15 4.626 4.750 -0.124 1
1 106 . 3 1 1 A 15 15 ARG C C 15 174.432 174.720 -0.288 1
1 107 . 3 1 1 A 15 15 ARG CA C 15 54.827 55.336 -0.509 1
1 108 . 3 1 1 A 15 15 ARG CB C 15 32.439 32.340 0.099 1
1 111 . 3 1 1 A 15 15 ARG N N 15 118.947 121.310 -2.363 1
1 113 . 3 1 1 A 16 16 GLU H H 16 8.838 8.694 0.144 1
1 114 . 3 1 1 A 16 16 GLU HA H 16 4.876 4.915 -0.039 1
1 119 . 3 1 1 A 16 16 GLU C C 16 175.767 175.413 0.354 1
1 120 . 3 1 1 A 16 16 GLU CA C 16 55.621 55.344 0.277 1
1 121 . 3 1 1 A 16 16 GLU CB C 16 31.093 31.504 -0.411 1
1 123 . 3 1 1 A 16 16 GLU N N 16 125.316 126.818 -1.502 1
1 124 . 3 1 1 A 17 17 CYS H H 17 9.327 8.945 0.382 1
1 125 . 3 1 1 A 17 17 CYS HA H 17 4.804 5.164 -0.360 1
1 128 . 3 1 1 A 17 17 CYS C C 17 172.973 173.374 -0.401 1
1 129 . 3 1 1 A 17 17 CYS CA C 17 57.930 57.424 0.506 1
1 130 . 3 1 1 A 17 17 CYS CB C 17 30.105 30.177 -0.072 1
1 131 . 3 1 1 A 17 17 CYS N N 17 127.909 125.166 2.743 1
1 132 . 3 1 1 A 18 18 LYS H H 18 9.022 8.906 0.116 1
1 133 . 3 1 1 A 18 18 LYS HA H 18 4.769 4.962 -0.193 1
1 142 . 3 1 1 A 18 18 LYS C C 18 174.586 175.179 -0.593 1
1 143 . 3 1 1 A 18 18 LYS CA C 18 55.956 54.889 1.067 1
1 144 . 3 1 1 A 18 18 LYS CB C 18 32.203 34.780 -2.577 1
1 148 . 3 1 1 A 18 18 LYS N N 18 127.039 124.025 3.014 1
1 149 . 3 1 1 A 19 19 LEU H H 19 8.784 9.405 -0.621 1
1 150 . 3 1 1 A 19 19 LEU HA H 19 4.852 5.208 -0.356 1
1 160 . 3 1 1 A 19 19 LEU C C 19 176.862 176.060 0.802 1
1 161 . 3 1 1 A 19 19 LEU CA C 19 55.391 53.364 2.027 1
1 162 . 3 1 1 A 19 19 LEU CB C 19 44.442 44.696 -0.254 1
1 166 . 3 1 1 A 19 19 LEU N N 19 126.311 126.931 -0.620 1
1 167 . 3 1 1 A 20 20 SER H H 20 8.215 8.932 -0.717 1
1 168 . 3 1 1 A 20 20 SER HA H 20 5.461 5.580 -0.119 1
1 171 . 3 1 1 A 20 20 SER C C 20 171.960 173.201 -1.241 1
1 172 . 3 1 1 A 20 20 SER CA C 20 57.525 56.884 0.641 1
1 173 . 3 1 1 A 20 20 SER CB C 20 65.794 65.656 0.138 1
1 174 . 3 1 1 A 20 20 SER N N 20 115.113 117.069 -1.956 1
1 175 . 3 1 1 A 21 21 LYS H H 21 9.001 8.572 0.429 1
1 176 . 3 1 1 A 21 21 LYS HA H 21 4.887 4.855 0.032 1
1 185 . 3 1 1 A 21 21 LYS C C 21 174.133 174.383 -0.250 1
1 186 . 3 1 1 A 21 21 LYS CA C 21 53.840 54.220 -0.380 1
1 187 . 3 1 1 A 21 21 LYS CB C 21 36.553 35.852 0.701 1
1 191 . 3 1 1 A 21 21 LYS N N 21 120.938 120.777 0.161 1
1 192 . 3 1 1 A 22 22 GLN H H 22 8.201 8.376 -0.175 1
1 193 . 3 1 1 A 22 22 GLN HA H 22 4.448 4.692 -0.244 1
1 200 . 3 1 1 A 22 22 GLN C C 22 176.372 176.012 0.360 1
1 201 . 3 1 1 A 22 22 GLN CA C 22 53.658 53.985 -0.327 1
1 202 . 3 1 1 A 22 22 GLN CB C 22 30.473 30.969 -0.496 1
1 204 . 3 1 1 A 22 22 GLN N N 22 116.816 119.096 -2.280 1
1 206 . 3 1 1 A 23 23 GLU H H 23 8.624 8.804 -0.180 1
1 207 . 3 1 1 A 23 23 GLU HA H 23 4.056 3.835 0.221 1
1 212 . 3 1 1 A 23 23 GLU C C 23 177.778 177.213 0.565 1
1 213 . 3 1 1 A 23 23 GLU CA C 23 58.001 58.596 -0.595 1
1 214 . 3 1 1 A 23 23 GLU CB C 23 29.237 29.186 0.051 1
1 216 . 3 1 1 A 23 23 GLU N N 23 122.364 122.892 -0.528 1
1 217 . 3 1 1 A 24 24 GLY H H 24 8.962 8.808 0.154 1
1 218 . 3 1 1 A 24 24 GLY HA2 H 24 4.139 3.981 0.158 1
1 219 . 3 1 1 A 24 24 GLY HA3 H 24 3.711 3.982 -0.271 1
1 220 . 3 1 1 A 24 24 GLY C C 24 173.857 174.937 -1.080 1
1 221 . 3 1 1 A 24 24 GLY CA C 24 45.288 45.065 0.223 1
1 222 . 3 1 1 A 24 24 GLY N N 24 113.942 112.660 1.282 1
1 223 . 3 1 1 A 25 25 GLN H H 25 7.643 7.746 -0.103 1
1 224 . 3 1 1 A 25 25 GLN HA H 25 4.488 4.495 -0.007 1
1 231 . 3 1 1 A 25 25 GLN C C 25 174.727 175.420 -0.693 1
1 232 . 3 1 1 A 25 25 GLN CA C 25 54.052 55.712 -1.660 1
1 233 . 3 1 1 A 25 25 GLN CB C 25 30.843 30.684 0.159 1
1 235 . 3 1 1 A 25 25 GLN N N 25 119.538 120.304 -0.766 1
1 237 . 3 1 1 A 26 26 ASN H H 26 8.625 8.326 0.299 1
1 238 . 3 1 1 A 26 26 ASN HA H 26 4.862 5.009 -0.147 1
1 243 . 3 1 1 A 26 26 ASN C C 26 176.261 175.631 0.630 1
1 244 . 3 1 1 A 26 26 ASN CA C 26 51.812 51.148 0.664 1
1 245 . 3 1 1 A 26 26 ASN CB C 26 40.403 39.782 0.621 1
1 246 . 3 1 1 A 26 26 ASN N N 26 120.047 117.800 2.247 1
1 248 . 3 1 1 A 27 27 TYR HA H 27 4.152 4.632 -0.480 1
1 255 . 3 1 1 A 27 27 TYR C C 27 176.731 175.877 0.854 1
1 256 . 3 1 1 A 27 27 TYR CA C 27 62.462 58.230 4.232 1
1 257 . 3 1 1 A 27 27 TYR CB C 27 40.240 39.008 1.232 1
1 262 . 3 1 1 A 27 27 TYR N N 27 121.761 119.962 1.799 1
1 263 . 3 1 1 A 28 28 GLY H H 28 8.285 8.034 0.251 1
1 264 . 3 1 1 A 28 28 GLY HA2 H 28 4.490 3.912 0.578 1
1 265 . 3 1 1 A 28 28 GLY HA3 H 28 3.759 3.992 -0.233 1
1 266 . 3 1 1 A 28 28 GLY C C 28 172.198 173.863 -1.665 1
1 267 . 3 1 1 A 28 28 GLY CA C 28 46.139 45.189 0.950 1
1 268 . 3 1 1 A 28 28 GLY N N 28 103.567 106.907 -3.340 1
1 269 . 3 1 1 A 29 29 PHE H H 29 6.878 7.793 -0.915 1
1 270 . 3 1 1 A 29 29 PHE HA H 29 5.179 4.961 0.218 1
1 278 . 3 1 1 A 29 29 PHE C C 29 172.840 173.782 -0.942 1
1 279 . 3 1 1 A 29 29 PHE CA C 29 55.262 55.005 0.257 1
1 280 . 3 1 1 A 29 29 PHE CB C 29 41.779 42.562 -0.783 1
1 286 . 3 1 1 A 29 29 PHE N N 29 111.027 117.401 -6.374 1
1 287 . 3 1 1 A 30 30 PHE H H 30 8.806 8.633 0.173 1
1 288 . 3 1 1 A 30 30 PHE HA H 30 4.923 4.689 0.234 1
1 296 . 3 1 1 A 30 30 PHE C C 30 174.501 175.427 -0.926 1
1 297 . 3 1 1 A 30 30 PHE CA C 30 55.356 56.054 -0.698 1
1 298 . 3 1 1 A 30 30 PHE CB C 30 41.681 42.646 -0.965 1
1 304 . 3 1 1 A 30 30 PHE N N 30 118.710 117.465 1.245 1
1 305 . 3 1 1 A 31 31 LEU H H 31 8.441 8.735 -0.294 1
1 306 . 3 1 1 A 31 31 LEU HA H 31 5.447 4.779 0.668 1
1 316 . 3 1 1 A 31 31 LEU C C 31 177.306 176.555 0.751 1
1 317 . 3 1 1 A 31 31 LEU CA C 31 53.610 54.952 -1.342 1
1 318 . 3 1 1 A 31 31 LEU CB C 31 43.696 42.037 1.659 1
1 322 . 3 1 1 A 31 31 LEU N N 31 123.765 125.392 -1.627 1
1 323 . 3 1 1 A 32 32 ARG H H 32 9.381 8.915 0.466 1
1 324 . 3 1 1 A 32 32 ARG HA H 32 4.840 5.033 -0.193 1
1 331 . 3 1 1 A 32 32 ARG C C 32 175.155 175.476 -0.321 1
1 332 . 3 1 1 A 32 32 ARG CA C 32 54.210 54.313 -0.103 1
1 333 . 3 1 1 A 32 32 ARG CB C 32 35.087 33.677 1.410 1
1 336 . 3 1 1 A 32 32 ARG N N 32 123.160 123.946 -0.786 1
1 337 . 3 1 1 A 33 33 ILE H H 33 7.891 8.900 -1.009 1
1 338 . 3 1 1 A 33 33 ILE HA H 33 4.495 5.001 -0.506 1
1 348 . 3 1 1 A 33 33 ILE C C 33 175.850 174.293 1.557 1
1 349 . 3 1 1 A 33 33 ILE CA C 33 59.641 58.757 0.884 1
1 350 . 3 1 1 A 33 33 ILE CB C 33 39.538 41.175 -1.637 1
1 354 . 3 1 1 A 33 33 ILE N N 33 118.924 118.368 0.556 1
1 355 . 3 1 1 A 34 34 GLU H H 34 8.971 8.764 0.207 1
1 356 . 3 1 1 A 34 34 GLU HA H 34 4.578 4.879 -0.301 1
1 361 . 3 1 1 A 34 34 GLU C C 34 175.766 175.960 -0.194 1
1 362 . 3 1 1 A 34 34 GLU CA C 34 54.263 54.175 0.088 1
1 363 . 3 1 1 A 34 34 GLU CB C 34 32.128 33.418 -1.290 1
1 365 . 3 1 1 A 34 34 GLU N N 34 125.447 121.260 4.187 1
1 366 . 3 1 1 A 35 35 LYS H H 35 8.504 8.514 -0.010 1
1 367 . 3 1 1 A 35 35 LYS HA H 35 4.026 4.082 -0.056 1
1 376 . 3 1 1 A 35 35 LYS C C 35 177.701 176.272 1.429 1
1 377 . 3 1 1 A 35 35 LYS CA C 35 57.591 56.596 0.995 1
1 378 . 3 1 1 A 35 35 LYS CB C 35 32.491 33.073 -0.582 1
1 382 . 3 1 1 A 35 35 LYS N N 35 122.893 122.316 0.577 1
1 383 . 3 1 1 A 36 36 ASP H H 36 9.020 8.972 0.048 1
1 384 . 3 1 1 A 36 36 ASP HA H 36 4.385 4.118 0.267 1
1 387 . 3 1 1 A 36 36 ASP C C 36 174.554 174.696 -0.142 1
1 388 . 3 1 1 A 36 36 ASP CA C 36 55.868 55.032 0.836 1
1 389 . 3 1 1 A 36 36 ASP CB C 36 39.826 39.373 0.453 1
1 390 . 3 1 1 A 36 36 ASP N N 36 121.412 118.779 2.633 1
1 391 . 3 1 1 A 37 37 THR H H 37 7.464 7.553 -0.089 1
1 392 . 3 1 1 A 37 37 THR HA H 37 4.454 4.892 -0.438 1
1 397 . 3 1 1 A 37 37 THR C C 37 172.012 173.289 -1.277 1
1 398 . 3 1 1 A 37 37 THR CA C 37 61.686 60.833 0.853 1
1 399 . 3 1 1 A 37 37 THR CB C 37 70.927 71.923 -0.996 1
1 401 . 3 1 1 A 37 37 THR N N 37 113.147 112.281 0.866 1
1 402 . 3 1 1 A 38 38 ASP H H 38 8.931 8.771 0.160 1
1 403 . 3 1 1 A 38 38 ASP HA H 38 4.852 4.867 -0.015 1
1 406 . 3 1 1 A 38 38 ASP CA C 38 54.826 53.679 1.147 1
1 407 . 3 1 1 A 38 38 ASP CB C 38 43.332 42.658 0.674 1
1 408 . 3 1 1 A 38 38 ASP N N 38 120.401 123.428 -3.027 1
1 409 . 3 1 1 A 39 39 GLY H H 39 8.068 8.577 -0.509 1
1 410 . 3 1 1 A 39 39 GLY HA2 H 39 3.774 3.978 -0.204 1
1 411 . 3 1 1 A 39 39 GLY HA3 H 39 3.555 4.060 -0.505 1
1 412 . 3 1 1 A 39 39 GLY C C 39 172.578 173.194 -0.616 1
1 413 . 3 1 1 A 39 39 GLY CA C 39 43.967 44.903 -0.936 1
1 414 . 3 1 1 A 39 39 GLY N N 39 107.925 108.933 -1.008 1
1 415 . 3 1 1 A 40 40 HIS H H 40 9.111 8.575 0.536 1
1 416 . 3 1 1 A 40 40 HIS HA H 40 4.650 4.857 -0.207 1
1 421 . 3 1 1 A 40 40 HIS C C 40 174.330 174.792 -0.462 1
1 422 . 3 1 1 A 40 40 HIS CA C 40 55.886 56.135 -0.249 1
1 423 . 3 1 1 A 40 40 HIS CB C 40 30.507 31.201 -0.694 1
1 426 . 3 1 1 A 40 40 HIS N N 40 119.179 118.642 0.537 1
1 427 . 3 1 1 A 41 41 LEU H H 41 8.254 8.677 -0.423 1
1 428 . 3 1 1 A 41 41 LEU HA H 41 4.626 4.738 -0.112 1
1 438 . 3 1 1 A 41 41 LEU C C 41 176.035 176.158 -0.123 1
1 439 . 3 1 1 A 41 41 LEU CA C 41 55.621 53.748 1.873 1
1 440 . 3 1 1 A 41 41 LEU CB C 41 45.091 42.617 2.474 1
1 444 . 3 1 1 A 41 41 LEU N N 41 124.808 124.168 0.640 1
1 445 . 3 1 1 A 42 42 ILE H H 42 8.685 8.646 0.039 1
1 446 . 3 1 1 A 42 42 ILE HA H 42 4.578 4.702 -0.124 1
1 456 . 3 1 1 A 42 42 ILE C C 42 175.369 176.594 -1.225 1
1 457 . 3 1 1 A 42 42 ILE CA C 42 59.852 60.996 -1.144 1
1 458 . 3 1 1 A 42 42 ILE CB C 42 36.778 38.115 -1.337 1
1 462 . 3 1 1 A 42 42 ILE N N 42 121.814 125.239 -3.425 1
1 463 . 3 1 1 A 43 43 ARG H H 43 8.787 8.381 0.406 1
1 464 . 3 1 1 A 43 43 ARG HA H 43 4.852 4.852 0.000 1
1 472 . 3 1 1 A 43 43 ARG C C 43 174.029 175.431 -1.402 1
1 473 . 3 1 1 A 43 43 ARG CA C 43 52.730 53.935 -1.205 1
1 474 . 3 1 1 A 43 43 ARG CB C 43 36.983 33.903 3.080 1
1 477 . 3 1 1 A 43 43 ARG N N 43 125.771 126.865 -1.094 1
1 479 . 3 1 1 A 44 44 VAL H H 44 8.661 8.577 0.084 1
1 480 . 3 1 1 A 44 44 VAL HA H 44 3.276 3.722 -0.446 1
1 488 . 3 1 1 A 44 44 VAL C C 44 173.227 175.037 -1.810 1
1 489 . 3 1 1 A 44 44 VAL CA C 44 63.161 63.162 -0.001 1
1 490 . 3 1 1 A 44 44 VAL CB C 44 29.054 30.194 -1.140 1
1 493 . 3 1 1 A 44 44 VAL N N 44 117.026 116.361 0.665 1
1 494 . 3 1 1 A 45 45 ILE H H 45 8.464 7.959 0.505 1
1 495 . 3 1 1 A 45 45 ILE HA H 45 4.579 4.408 0.171 1
1 505 . 3 1 1 A 45 45 ILE C C 45 178.108 175.479 2.629 1
1 506 . 3 1 1 A 45 45 ILE CA C 45 59.888 60.684 -0.796 1
1 507 . 3 1 1 A 45 45 ILE CB C 45 36.998 36.692 0.306 1
1 511 . 3 1 1 A 45 45 ILE N N 45 122.767 122.672 0.095 1
1 512 . 3 1 1 A 46 46 GLU H H 46 9.015 8.466 0.549 1
1 513 . 3 1 1 A 46 46 GLU HA H 46 4.206 4.296 -0.090 1
1 518 . 3 1 1 A 46 46 GLU C C 46 177.746 175.968 1.778 1
1 519 . 3 1 1 A 46 46 GLU CA C 46 56.130 57.085 -0.955 1
1 520 . 3 1 1 A 46 46 GLU CB C 46 30.581 30.724 -0.143 1
1 522 . 3 1 1 A 46 46 GLU N N 46 131.076 128.905 2.171 1
1 523 . 3 1 1 A 47 47 GLU H H 47 9.213 8.675 0.538 1
1 524 . 3 1 1 A 47 47 GLU HA H 47 4.194 4.078 0.116 1
1 529 . 3 1 1 A 47 47 GLU C C 47 178.088 177.663 0.425 1
1 530 . 3 1 1 A 47 47 GLU CA C 47 58.212 57.965 0.247 1
1 531 . 3 1 1 A 47 47 GLU CB C 47 29.390 30.083 -0.693 1
1 533 . 3 1 1 A 47 47 GLU N N 47 129.592 124.738 4.854 1
1 534 . 3 1 1 A 48 48 GLY H H 48 9.586 8.969 0.617 1
1 535 . 3 1 1 A 48 48 GLY HA2 H 48 4.141 3.839 0.302 1
1 536 . 3 1 1 A 48 48 GLY HA3 H 48 3.757 3.839 -0.082 1
1 537 . 3 1 1 A 48 48 GLY C C 48 173.790 174.086 -0.296 1
1 538 . 3 1 1 A 48 48 GLY CA C 48 45.764 46.839 -1.075 1
1 539 . 3 1 1 A 48 48 GLY N N 48 114.819 114.629 0.190 1
1 540 . 3 1 1 A 49 49 SER H H 49 7.580 7.873 -0.293 1
1 541 . 3 1 1 A 49 49 SER HA H 49 4.728 4.812 -0.084 1
1 544 . 3 1 1 A 49 49 SER C C 49 173.542 174.540 -0.998 1
1 545 . 3 1 1 A 49 49 SER CA C 49 57.560 56.019 1.541 1
1 546 . 3 1 1 A 49 49 SER CB C 49 64.529 63.683 0.846 1
1 547 . 3 1 1 A 49 49 SER N N 49 114.688 114.491 0.197 1
1 548 . 3 1 1 A 50 50 PRO HA H 50 4.431 4.568 -0.137 1
1 555 . 3 1 1 A 50 50 PRO C C 50 179.377 177.572 1.805 1
1 556 . 3 1 1 A 50 50 PRO CA C 50 66.059 64.282 1.777 1
1 557 . 3 1 1 A 50 50 PRO CB C 50 32.598 31.844 0.754 1
1 560 . 3 1 1 A 51 51 ALA H H 51 8.264 7.933 0.331 1
1 561 . 3 1 1 A 51 51 ALA HA H 51 3.817 4.030 -0.213 1
1 565 . 3 1 1 A 51 51 ALA C C 51 177.508 179.704 -2.196 1
1 566 . 3 1 1 A 51 51 ALA CA C 51 55.392 55.117 0.275 1
1 567 . 3 1 1 A 51 51 ALA CB C 51 20.474 18.570 1.904 1
1 568 . 3 1 1 A 51 51 ALA N N 51 117.604 120.279 -2.675 1
1 569 . 3 1 1 A 52 52 GLU H H 52 7.794 7.748 0.046 1
1 570 . 3 1 1 A 52 52 GLU HA H 52 3.881 4.150 -0.269 1
1 575 . 3 1 1 A 52 52 GLU C C 52 181.401 178.949 2.452 1
1 576 . 3 1 1 A 52 52 GLU CA C 52 59.454 59.467 -0.013 1
1 577 . 3 1 1 A 52 52 GLU CB C 52 30.247 29.414 0.833 1
1 579 . 3 1 1 A 52 52 GLU N N 52 119.474 118.944 0.530 1
1 580 . 3 1 1 A 53 53 LYS H H 53 8.557 7.835 0.722 1
1 581 . 3 1 1 A 53 53 LYS HA H 53 4.020 4.083 -0.063 1
1 588 . 3 1 1 A 53 53 LYS C C 53 177.939 178.102 -0.163 1
1 589 . 3 1 1 A 53 53 LYS CA C 53 59.012 58.410 0.602 1
1 590 . 3 1 1 A 53 53 LYS CB C 53 32.438 32.171 0.267 1
1 594 . 3 1 1 A 53 53 LYS N N 53 120.057 118.915 1.142 1
1 595 . 3 1 1 A 54 54 ALA H H 54 7.764 7.503 0.261 1
1 596 . 3 1 1 A 54 54 ALA HA H 54 4.400 4.316 0.084 1
1 600 . 3 1 1 A 54 54 ALA C C 54 177.658 178.204 -0.546 1
1 601 . 3 1 1 A 54 54 ALA CA C 54 52.412 51.793 0.619 1
1 602 . 3 1 1 A 54 54 ALA CB C 54 20.739 18.757 1.982 1
1 603 . 3 1 1 A 54 54 ALA N N 54 117.678 118.577 -0.899 1
1 604 . 3 1 1 A 55 55 GLY H H 55 7.583 8.393 -0.810 1
1 605 . 3 1 1 A 55 55 GLY HA2 H 55 4.266 3.922 0.344 1
1 606 . 3 1 1 A 55 55 GLY HA3 H 55 3.775 3.930 -0.155 1
1 607 . 3 1 1 A 55 55 GLY C C 55 175.232 174.143 1.089 1
1 608 . 3 1 1 A 55 55 GLY CA C 55 45.368 44.920 0.448 1
1 609 . 3 1 1 A 55 55 GLY N N 55 103.265 107.574 -4.309 1
1 610 . 3 1 1 A 56 56 LEU H H 56 7.280 7.703 -0.423 1
1 611 . 3 1 1 A 56 56 LEU HA H 56 3.984 4.108 -0.124 1
1 621 . 3 1 1 A 56 56 LEU C C 56 174.708 175.481 -0.773 1
1 622 . 3 1 1 A 56 56 LEU CA C 56 55.603 56.018 -0.415 1
1 623 . 3 1 1 A 56 56 LEU CB C 56 42.752 42.462 0.290 1
1 627 . 3 1 1 A 56 56 LEU N N 56 119.211 122.917 -3.706 1
1 628 . 3 1 1 A 57 57 LEU H H 57 8.693 8.594 0.099 1
1 629 . 3 1 1 A 57 57 LEU HA H 57 4.499 5.084 -0.585 1
1 639 . 3 1 1 A 57 57 LEU C C 57 176.124 175.710 0.414 1
1 640 . 3 1 1 A 57 57 LEU CA C 57 52.959 53.415 -0.456 1
1 641 . 3 1 1 A 57 57 LEU CB C 57 45.122 46.233 -1.111 1
1 645 . 3 1 1 A 57 57 LEU N N 57 121.969 127.242 -5.273 1
1 646 . 3 1 1 A 58 58 ASP H H 58 8.334 8.734 -0.400 1
1 647 . 3 1 1 A 58 58 ASP HA H 58 4.139 4.915 -0.776 1
1 650 . 3 1 1 A 58 58 ASP C C 58 178.636 176.848 1.788 1
1 651 . 3 1 1 A 58 58 ASP CA C 58 56.079 55.321 0.758 1
1 652 . 3 1 1 A 58 58 ASP CB C 58 42.135 40.315 1.820 1
1 653 . 3 1 1 A 58 58 ASP N N 58 120.401 121.617 -1.216 1
1 654 . 3 1 1 A 59 59 GLY H H 59 9.378 8.515 0.863 1
1 655 . 3 1 1 A 59 59 GLY HA2 H 59 4.317 3.951 0.366 1
1 656 . 3 1 1 A 59 59 GLY HA3 H 59 3.260 3.955 -0.695 1
1 657 . 3 1 1 A 59 59 GLY C C 59 173.359 173.717 -0.358 1
1 658 . 3 1 1 A 59 59 GLY CA C 59 45.517 45.078 0.439 1
1 659 . 3 1 1 A 59 59 GLY N N 59 116.622 112.184 4.438 1
1 660 . 3 1 1 A 60 60 ASP H H 60 8.009 7.919 0.090 1
1 661 . 3 1 1 A 60 60 ASP HA H 60 4.638 4.771 -0.133 1
1 664 . 3 1 1 A 60 60 ASP C C 60 175.555 175.623 -0.068 1
1 665 . 3 1 1 A 60 60 ASP CA C 60 55.286 53.371 1.915 1
1 666 . 3 1 1 A 60 60 ASP CB C 60 42.381 42.108 0.273 1
1 667 . 3 1 1 A 60 60 ASP N N 60 121.370 120.676 0.694 1
1 668 . 3 1 1 A 61 61 ARG H H 61 8.648 8.693 -0.045 1
1 669 . 3 1 1 A 61 61 ARG HA H 61 5.179 5.055 0.124 1
1 677 . 3 1 1 A 61 61 ARG C C 61 177.381 174.762 2.619 1
1 678 . 3 1 1 A 61 61 ARG CA C 61 53.704 55.355 -1.651 1
1 679 . 3 1 1 A 61 61 ARG CB C 61 34.017 31.680 2.337 1
1 682 . 3 1 1 A 61 61 ARG N N 61 116.958 123.577 -6.619 1
1 684 . 3 1 1 A 62 62 VAL H H 62 8.247 8.701 -0.454 1
1 685 . 3 1 1 A 62 62 VAL HA H 62 3.806 4.521 -0.715 1
1 693 . 3 1 1 A 62 62 VAL C C 62 174.748 174.825 -0.077 1
1 694 . 3 1 1 A 62 62 VAL CA C 62 63.149 61.310 1.839 1
1 695 . 3 1 1 A 62 62 VAL CB C 62 32.574 32.518 0.056 1
1 698 . 3 1 1 A 62 62 VAL N N 62 118.546 125.573 -7.027 1
1 699 . 3 1 1 A 63 63 LEU H H 63 9.262 9.187 0.075 1
1 700 . 3 1 1 A 63 63 LEU HA H 63 4.412 4.302 0.110 1
1 710 . 3 1 1 A 63 63 LEU C C 63 177.649 177.141 0.508 1
1 711 . 3 1 1 A 63 63 LEU CA C 63 56.044 56.383 -0.339 1
1 712 . 3 1 1 A 63 63 LEU CB C 63 43.339 42.893 0.446 1
1 716 . 3 1 1 A 63 63 LEU N N 63 125.413 130.997 -5.584 1
1 717 . 3 1 1 A 64 64 ARG H H 64 7.806 7.677 0.129 1
1 718 . 3 1 1 A 64 64 ARG HA H 64 5.704 5.085 0.619 1
1 726 . 3 1 1 A 64 64 ARG C C 64 175.091 173.912 1.179 1
1 727 . 3 1 1 A 64 64 ARG CA C 64 54.148 54.511 -0.363 1
1 728 . 3 1 1 A 64 64 ARG CB C 64 35.742 34.051 1.691 1
1 731 . 3 1 1 A 64 64 ARG N N 64 112.961 116.974 -4.013 1
1 733 . 3 1 1 A 65 65 ILE H H 65 8.327 9.117 -0.790 1
1 734 . 3 1 1 A 65 65 ILE HA H 65 4.384 4.601 -0.217 1
1 744 . 3 1 1 A 65 65 ILE C C 65 175.722 175.622 0.100 1
1 745 . 3 1 1 A 65 65 ILE CA C 65 60.501 59.360 1.141 1
1 746 . 3 1 1 A 65 65 ILE CB C 65 39.547 40.214 -0.667 1
1 750 . 3 1 1 A 65 65 ILE N N 65 119.175 123.564 -4.389 1
1 751 . 3 1 1 A 66 66 ASN H H 66 9.911 9.654 0.257 1
1 752 . 3 1 1 A 66 66 ASN HA H 66 4.428 4.365 0.063 1
1 757 . 3 1 1 A 66 66 ASN C C 66 175.349 174.619 0.730 1
1 758 . 3 1 1 A 66 66 ASN CA C 66 54.157 54.198 -0.041 1
1 759 . 3 1 1 A 66 66 ASN CB C 66 37.024 37.439 -0.415 1
1 760 . 3 1 1 A 66 66 ASN N N 66 128.952 127.978 0.974 1
1 762 . 3 1 1 A 67 67 GLY H H 67 9.230 8.607 0.623 1
1 763 . 3 1 1 A 67 67 GLY HA2 H 67 4.322 3.928 0.394 1
1 764 . 3 1 1 A 67 67 GLY HA3 H 67 3.508 3.935 -0.427 1
1 765 . 3 1 1 A 67 67 GLY C C 67 174.393 173.901 0.492 1
1 766 . 3 1 1 A 67 67 GLY CA C 67 45.341 46.421 -1.080 1
1 767 . 3 1 1 A 67 67 GLY N N 67 103.238 104.603 -1.365 1
1 768 . 3 1 1 A 68 68 VAL H H 68 8.063 7.671 0.392 1
1 769 . 3 1 1 A 68 68 VAL HA H 68 4.015 4.542 -0.527 1
1 777 . 3 1 1 A 68 68 VAL C C 68 175.833 174.754 1.079 1
1 778 . 3 1 1 A 68 68 VAL CA C 68 62.603 61.277 1.326 1
1 779 . 3 1 1 A 68 68 VAL CB C 68 32.574 34.916 -2.342 1
1 782 . 3 1 1 A 68 68 VAL N N 68 125.696 119.763 5.933 1
1 783 . 3 1 1 A 69 69 PHE H H 69 9.301 9.107 0.194 1
1 784 . 3 1 1 A 69 69 PHE HA H 69 4.947 4.637 0.310 1
1 792 . 3 1 1 A 69 69 PHE C C 69 177.120 175.792 1.328 1
1 793 . 3 1 1 A 69 69 PHE CA C 69 59.200 57.203 1.997 1
1 794 . 3 1 1 A 69 69 PHE CB C 69 39.320 39.062 0.258 1
1 800 . 3 1 1 A 69 69 PHE N N 69 128.641 128.737 -0.096 1
1 801 . 3 1 1 A 70 70 VAL H H 70 8.312 7.875 0.437 1
1 802 . 3 1 1 A 70 70 VAL HA H 70 4.517 4.431 0.086 1
1 810 . 3 1 1 A 70 70 VAL CA C 70 60.734 60.480 0.254 1
1 811 . 3 1 1 A 70 70 VAL CB C 70 32.976 31.423 1.553 1
1 814 . 3 1 1 A 70 70 VAL N N 70 118.381 120.123 -1.742 1
1 815 . 3 1 1 A 71 71 ASP H H 71 5.373 7.667 -2.294 1
1 816 . 3 1 1 A 71 71 ASP HA H 71 4.413 4.199 0.214 1
1 819 . 3 1 1 A 71 71 ASP C C 71 174.896 178.408 -3.512 1
1 820 . 3 1 1 A 71 71 ASP CA C 71 58.334 56.602 1.732 1
1 821 . 3 1 1 A 71 71 ASP CB C 71 46.097 39.558 6.539 1
1 822 . 3 1 1 A 71 71 ASP N N 71 119.008 122.482 -3.474 1
1 823 . 3 1 1 A 72 72 LYS H H 72 7.874 7.769 0.105 1
1 824 . 3 1 1 A 72 72 LYS HA H 72 4.522 4.303 0.219 1
1 833 . 3 1 1 A 72 72 LYS C C 72 177.209 177.314 -0.105 1
1 834 . 3 1 1 A 72 72 LYS CA C 72 54.122 58.015 -3.893 1
1 835 . 3 1 1 A 72 72 LYS CB C 72 31.640 32.951 -1.311 1
1 839 . 3 1 1 A 72 72 LYS N N 72 110.259 118.529 -8.270 1
1 840 . 3 1 1 A 73 73 GLU H H 73 7.421 7.739 -0.318 1
1 841 . 3 1 1 A 73 73 GLU HA H 73 4.401 4.292 0.109 1
1 846 . 3 1 1 A 73 73 GLU C C 73 176.728 176.425 0.303 1
1 847 . 3 1 1 A 73 73 GLU CA C 73 54.950 57.276 -2.326 1
1 848 . 3 1 1 A 73 73 GLU CB C 73 30.390 30.104 0.286 1
1 850 . 3 1 1 A 73 73 GLU N N 73 120.043 119.149 0.894 1
1 851 . 3 1 1 A 74 74 GLU H H 74 9.360 8.601 0.759 1
1 852 . 3 1 1 A 74 74 GLU HA H 74 4.403 4.462 -0.059 1
1 857 . 3 1 1 A 74 74 GLU C C 74 178.234 177.511 0.723 1
1 858 . 3 1 1 A 74 74 GLU CA C 74 56.516 56.693 -0.177 1
1 859 . 3 1 1 A 74 74 GLU CB C 74 30.390 31.802 -1.412 1
1 861 . 3 1 1 A 74 74 GLU N N 74 122.193 123.980 -1.787 1
1 862 . 3 1 1 A 75 75 HIS H H 75 9.553 9.217 0.336 1
1 863 . 3 1 1 A 75 75 HIS HA H 75 4.080 4.227 -0.147 1
1 868 . 3 1 1 A 75 75 HIS C C 75 175.985 176.620 -0.635 1
1 869 . 3 1 1 A 75 75 HIS CA C 75 61.016 60.568 0.448 1
1 870 . 3 1 1 A 75 75 HIS CB C 75 29.468 30.662 -1.194 1
1 873 . 3 1 1 A 75 75 HIS N N 75 123.587 127.529 -3.942 1
1 874 . 3 1 1 A 76 76 ALA H H 76 9.129 8.362 0.767 1
1 875 . 3 1 1 A 76 76 ALA HA H 76 3.826 3.907 -0.081 1
1 879 . 3 1 1 A 76 76 ALA C C 76 180.475 179.533 0.942 1
1 880 . 3 1 1 A 76 76 ALA CA C 76 55.392 55.214 0.178 1
1 881 . 3 1 1 A 76 76 ALA CB C 76 18.182 18.247 -0.065 1
1 882 . 3 1 1 A 76 76 ALA N N 76 117.795 121.016 -3.221 1
1 883 . 3 1 1 A 77 77 GLN H H 77 7.099 7.994 -0.895 1
1 884 . 3 1 1 A 77 77 GLN HA H 77 4.198 4.095 0.103 1
1 891 . 3 1 1 A 77 77 GLN C C 77 177.860 178.850 -0.990 1
1 892 . 3 1 1 A 77 77 GLN CA C 77 57.790 58.656 -0.866 1
1 893 . 3 1 1 A 77 77 GLN CB C 77 28.536 28.529 0.007 1
1 895 . 3 1 1 A 77 77 GLN N N 77 115.764 118.044 -2.280 1
1 897 . 3 1 1 A 78 78 VAL H H 78 7.430 7.767 -0.337 1
1 898 . 3 1 1 A 78 78 VAL HA H 78 3.241 3.508 -0.267 1
1 906 . 3 1 1 A 78 78 VAL C C 78 177.042 177.805 -0.763 1
1 907 . 3 1 1 A 78 78 VAL CA C 78 67.299 66.162 1.137 1
1 908 . 3 1 1 A 78 78 VAL CB C 78 30.819 31.529 -0.710 1
1 911 . 3 1 1 A 78 78 VAL N N 78 121.143 120.590 0.553 1
1 912 . 3 1 1 A 79 79 VAL H H 79 7.773 8.190 -0.417 1
1 913 . 3 1 1 A 79 79 VAL HA H 79 3.315 3.571 -0.256 1
1 921 . 3 1 1 A 79 79 VAL C C 79 179.179 177.718 1.461 1
1 922 . 3 1 1 A 79 79 VAL CA C 79 66.694 65.201 1.493 1
1 923 . 3 1 1 A 79 79 VAL CB C 79 31.841 31.178 0.663 1
1 926 . 3 1 1 A 79 79 VAL N N 79 117.473 119.842 -2.369 1
1 927 . 3 1 1 A 80 80 GLU H H 80 7.410 7.741 -0.331 1
1 928 . 3 1 1 A 80 80 GLU HA H 80 4.258 4.008 0.250 1
1 933 . 3 1 1 A 80 80 GLU C C 80 178.018 179.076 -1.058 1
1 934 . 3 1 1 A 80 80 GLU CA C 80 58.566 59.392 -0.826 1
1 935 . 3 1 1 A 80 80 GLU CB C 80 29.072 29.508 -0.436 1
1 937 . 3 1 1 A 80 80 GLU N N 80 120.451 120.957 -0.506 1
1 938 . 3 1 1 A 81 81 LEU H H 81 8.070 8.053 0.017 1
1 939 . 3 1 1 A 81 81 LEU HA H 81 3.976 4.039 -0.063 1
1 949 . 3 1 1 A 81 81 LEU C C 81 180.658 178.943 1.715 1
1 950 . 3 1 1 A 81 81 LEU CA C 81 58.061 58.109 -0.048 1
1 951 . 3 1 1 A 81 81 LEU CB C 81 42.115 42.106 0.009 1
1 955 . 3 1 1 A 81 81 LEU N N 81 119.943 120.517 -0.574 1
1 956 . 3 1 1 A 82 82 VAL H H 82 7.609 7.782 -0.173 1
1 957 . 3 1 1 A 82 82 VAL HA H 82 3.474 3.461 0.013 1
1 965 . 3 1 1 A 82 82 VAL C C 82 178.927 177.919 1.008 1
1 966 . 3 1 1 A 82 82 VAL CA C 82 67.398 67.218 0.180 1
1 967 . 3 1 1 A 82 82 VAL CB C 82 31.306 31.434 -0.128 1
1 970 . 3 1 1 A 82 82 VAL N N 82 118.150 118.081 0.069 1
1 971 . 3 1 1 A 83 83 ARG H H 83 8.186 8.072 0.114 1
1 972 . 3 1 1 A 83 83 ARG HA H 83 3.994 4.027 -0.033 1
1 979 . 3 1 1 A 83 83 ARG C C 83 179.999 179.308 0.691 1
1 980 . 3 1 1 A 83 83 ARG CA C 83 60.205 59.813 0.392 1
1 981 . 3 1 1 A 83 83 ARG CB C 83 30.103 30.062 0.041 1
1 984 . 3 1 1 A 83 83 ARG N N 83 122.902 119.309 3.593 1
1 985 . 3 1 1 A 84 84 LYS H H 84 8.772 7.958 0.814 1
1 986 . 3 1 1 A 84 84 LYS HA H 84 4.047 4.077 -0.030 1
1 995 . 3 1 1 A 84 84 LYS C C 84 176.934 179.274 -2.340 1
1 996 . 3 1 1 A 84 84 LYS CA C 84 58.142 59.426 -1.284 1
1 997 . 3 1 1 A 84 84 LYS CB C 84 32.492 32.196 0.296 1
1 1001 . 3 1 1 A 84 84 LYS N N 84 117.548 120.570 -3.022 1
1 1002 . 3 1 1 A 85 85 SER H H 85 7.333 8.284 -0.951 1
1 1003 . 3 1 1 A 85 85 SER HA H 85 4.235 4.226 0.009 1
1 1006 . 3 1 1 A 85 85 SER C C 85 175.588 175.076 0.512 1
1 1007 . 3 1 1 A 85 85 SER CA C 85 59.535 61.886 -2.351 1
1 1008 . 3 1 1 A 85 85 SER CB C 85 63.571 63.753 -0.182 1
1 1009 . 3 1 1 A 85 85 SER N N 85 113.544 115.122 -1.578 1
1 1010 . 3 1 1 A 86 86 GLY H H 86 7.459 7.289 0.170 1
1 1011 . 3 1 1 A 86 86 GLY HA2 H 86 4.176 4.140 0.036 1
1 1012 . 3 1 1 A 86 86 GLY HA3 H 86 3.762 4.140 -0.378 1
1 1013 . 3 1 1 A 86 86 GLY C C 86 176.407 175.208 1.199 1
1 1014 . 3 1 1 A 86 86 GLY CA C 86 46.109 43.923 2.186 1
1 1015 . 3 1 1 A 86 86 GLY N N 86 104.331 106.118 -1.787 1
1 1016 . 3 1 1 A 87 87 ASN HA H 87 4.650 4.470 0.180 1
1 1021 . 3 1 1 A 87 87 ASN C C 87 173.653 175.959 -2.306 1
1 1022 . 3 1 1 A 87 87 ASN CA C 87 54.492 55.801 -1.309 1
1 1023 . 3 1 1 A 87 87 ASN CB C 87 38.425 38.255 0.170 1
1 1024 . 3 1 1 A 87 87 ASN N N 87 118.401 120.111 -1.710 1
1 1026 . 3 1 1 A 88 88 SER H H 88 7.435 8.000 -0.565 1
1 1027 . 3 1 1 A 88 88 SER HA H 88 5.438 5.432 0.006 1
1 1030 . 3 1 1 A 88 88 SER C C 88 172.867 173.708 -0.841 1
1 1031 . 3 1 1 A 88 88 SER CA C 88 58.160 56.879 1.281 1
1 1032 . 3 1 1 A 88 88 SER CB C 88 65.861 64.753 1.108 1
1 1033 . 3 1 1 A 88 88 SER N N 88 113.765 111.875 1.890 1
1 1034 . 3 1 1 A 89 89 VAL H H 89 8.452 9.076 -0.624 1
1 1035 . 3 1 1 A 89 89 VAL HA H 89 4.519 4.990 -0.471 1
1 1043 . 3 1 1 A 89 89 VAL C C 89 171.391 174.760 -3.369 1
1 1044 . 3 1 1 A 89 89 VAL CA C 89 61.333 60.379 0.954 1
1 1045 . 3 1 1 A 89 89 VAL CB C 89 33.897 34.791 -0.894 1
1 1048 . 3 1 1 A 89 89 VAL N N 89 120.001 125.610 -5.609 1
1 1049 . 3 1 1 A 90 90 THR H H 90 8.348 8.617 -0.269 1
1 1050 . 3 1 1 A 90 90 THR HA H 90 5.042 5.318 -0.276 1
1 1055 . 3 1 1 A 90 90 THR C C 90 173.926 173.584 0.342 1
1 1056 . 3 1 1 A 90 90 THR CA C 90 61.403 60.978 0.425 1
1 1057 . 3 1 1 A 90 90 THR CB C 90 69.553 71.859 -2.306 1
1 1059 . 3 1 1 A 90 90 THR N N 90 123.477 120.498 2.979 1
1 1060 . 3 1 1 A 91 91 LEU H H 91 9.195 8.552 0.643 1
1 1061 . 3 1 1 A 91 91 LEU HA H 91 5.161 4.862 0.299 1
1 1071 . 3 1 1 A 91 91 LEU C C 91 174.564 175.579 -1.015 1
1 1072 . 3 1 1 A 91 91 LEU CA C 91 52.590 53.604 -1.014 1
1 1073 . 3 1 1 A 91 91 LEU CB C 91 44.998 46.007 -1.009 1
1 1077 . 3 1 1 A 91 91 LEU N N 91 128.419 125.198 3.221 1
1 1078 . 3 1 1 A 92 92 LEU H H 92 8.644 8.472 0.172 1
1 1079 . 3 1 1 A 92 92 LEU HA H 92 5.335 5.022 0.313 1
1 1089 . 3 1 1 A 92 92 LEU C C 92 176.451 175.413 1.038 1
1 1090 . 3 1 1 A 92 92 LEU CA C 92 54.220 53.866 0.354 1
1 1091 . 3 1 1 A 92 92 LEU CB C 92 44.323 43.107 1.216 1
1 1095 . 3 1 1 A 92 92 LEU N N 92 125.894 123.292 2.602 1
1 1096 . 3 1 1 A 93 93 VAL H H 93 9.249 8.795 0.454 1
1 1097 . 3 1 1 A 93 93 VAL HA H 93 5.573 5.304 0.269 1
1 1105 . 3 1 1 A 93 93 VAL C C 93 173.550 174.082 -0.532 1
1 1106 . 3 1 1 A 93 93 VAL CA C 93 58.340 59.931 -1.591 1
1 1107 . 3 1 1 A 93 93 VAL CB C 93 36.159 34.123 2.036 1
1 1110 . 3 1 1 A 93 93 VAL N N 93 120.660 120.158 0.502 1
1 1111 . 3 1 1 A 94 94 LEU H H 94 8.634 8.428 0.206 1
1 1112 . 3 1 1 A 94 94 LEU HA H 94 4.911 5.030 -0.119 1
1 1122 . 3 1 1 A 94 94 LEU C C 94 174.172 176.054 -1.882 1
1 1123 . 3 1 1 A 94 94 LEU CA C 94 52.659 53.402 -0.743 1
1 1124 . 3 1 1 A 94 94 LEU CB C 94 47.910 45.203 2.707 1
1 1128 . 3 1 1 A 94 94 LEU N N 94 120.304 127.363 -7.059 1
1 1129 . 3 1 1 A 95 95 ASP H H 95 8.210 8.886 -0.676 1
1 1130 . 3 1 1 A 95 95 ASP HA H 95 5.190 4.616 0.574 1
1 1133 . 3 1 1 A 95 95 ASP C C 95 175.887 177.940 -2.053 1
1 1134 . 3 1 1 A 95 95 ASP CA C 95 53.899 54.639 -0.740 1
1 1135 . 3 1 1 A 95 95 ASP CB C 95 41.188 41.087 0.101 1
1 1136 . 3 1 1 A 95 95 ASP N N 95 122.184 123.794 -1.610 1
1 1137 . 3 1 1 A 96 96 GLY H H 96 8.478 8.849 -0.371 1
1 1138 . 3 1 1 A 96 96 GLY HA2 H 96 4.002 3.812 0.190 1
1 1139 . 3 1 1 A 96 96 GLY HA3 H 96 3.757 3.822 -0.065 1
1 1140 . 3 1 1 A 96 96 GLY C C 96 175.497 175.669 -0.172 1
1 1141 . 3 1 1 A 96 96 GLY CA C 96 49.944 47.430 2.514 1
1 1142 . 3 1 1 A 96 96 GLY N N 96 108.610 110.819 -2.209 1
1 1143 . 3 1 1 A 97 97 ASP H H 97 8.401 8.447 -0.046 1
1 1144 . 3 1 1 A 97 97 ASP HA H 97 4.454 4.368 0.086 1
1 1147 . 3 1 1 A 97 97 ASP C C 97 179.612 178.553 1.059 1
1 1148 . 3 1 1 A 97 97 ASP CA C 97 57.913 57.259 0.654 1
1 1149 . 3 1 1 A 97 97 ASP CB C 97 41.145 41.294 -0.149 1
1 1150 . 3 1 1 A 97 97 ASP N N 97 120.034 122.489 -2.455 1
1 1151 . 3 1 1 A 98 98 SER H H 98 8.152 8.277 -0.125 1
1 1152 . 3 1 1 A 98 98 SER HA H 98 4.218 4.316 -0.098 1
1 1155 . 3 1 1 A 98 98 SER C C 98 175.061 175.643 -0.582 1
1 1156 . 3 1 1 A 98 98 SER CA C 98 62.180 62.320 -0.140 1
1 1157 . 3 1 1 A 98 98 SER CB C 98 62.179 62.643 -0.464 1
1 1158 . 3 1 1 A 98 98 SER N N 98 117.174 115.966 1.208 1
1 1159 . 3 1 1 A 99 99 TYR H H 99 9.051 8.555 0.496 1
1 1160 . 3 1 1 A 99 99 TYR HA H 99 3.692 3.864 -0.172 1
1 1167 . 3 1 1 A 99 99 TYR C C 99 176.460 176.981 -0.521 1
1 1168 . 3 1 1 A 99 99 TYR CA C 99 62.814 62.116 0.698 1
1 1169 . 3 1 1 A 99 99 TYR CB C 99 38.829 38.468 0.361 1
1 1174 . 3 1 1 A 99 99 TYR N N 99 123.539 122.415 1.124 1
1 1175 . 3 1 1 A 100 100 GLU H H 100 8.520 8.333 0.187 1
1 1176 . 3 1 1 A 100 100 GLU HA H 100 3.952 4.000 -0.048 1
1 1181 . 3 1 1 A 100 100 GLU C C 100 180.151 179.054 1.097 1
1 1182 . 3 1 1 A 100 100 GLU CA C 100 60.099 59.859 0.240 1
1 1183 . 3 1 1 A 100 100 GLU CB C 100 29.435 29.053 0.382 1
1 1185 . 3 1 1 A 100 100 GLU N N 100 117.082 118.215 -1.133 1
1 1186 . 3 1 1 A 101 101 LYS H H 101 7.740 7.955 -0.215 1
1 1187 . 3 1 1 A 101 101 LYS HA H 101 3.984 4.028 -0.044 1
1 1196 . 3 1 1 A 101 101 LYS C C 101 178.377 178.457 -0.080 1
1 1197 . 3 1 1 A 101 101 LYS CA C 101 59.888 59.430 0.458 1
1 1198 . 3 1 1 A 101 101 LYS CB C 101 32.821 32.425 0.396 1
1 1202 . 3 1 1 A 101 101 LYS N N 101 119.851 120.817 -0.966 1
1 1203 . 3 1 1 A 102 102 ALA H H 102 8.538 7.779 0.759 1
1 1204 . 3 1 1 A 102 102 ALA HA H 102 3.632 3.956 -0.324 1
1 1208 . 3 1 1 A 102 102 ALA C C 102 179.870 179.635 0.235 1
1 1209 . 3 1 1 A 102 102 ALA CA C 102 55.285 54.945 0.340 1
1 1210 . 3 1 1 A 102 102 ALA CB C 102 17.163 18.288 -1.125 1
1 1211 . 3 1 1 A 102 102 ALA N N 102 124.176 121.146 3.030 1
1 1212 . 3 1 1 A 103 103 VAL H H 103 8.147 7.969 0.178 1
1 1213 . 3 1 1 A 103 103 VAL HA H 103 3.658 3.420 0.238 1
1 1221 . 3 1 1 A 103 103 VAL C C 103 181.113 178.094 3.019 1
1 1222 . 3 1 1 A 103 103 VAL CA C 103 66.090 67.026 -0.936 1
1 1223 . 3 1 1 A 103 103 VAL CB C 103 31.822 31.458 0.364 1
1 1226 . 3 1 1 A 103 103 VAL N N 103 117.841 118.123 -0.282 1
1 1227 . 3 1 1 A 104 104 LYS H H 104 7.903 7.873 0.030 1
1 1228 . 3 1 1 A 104 104 LYS HA H 104 4.065 3.978 0.087 1
1 1235 . 3 1 1 A 104 104 LYS C C 104 177.715 178.077 -0.362 1
1 1236 . 3 1 1 A 104 104 LYS CA C 104 59.094 59.117 -0.023 1
1 1237 . 3 1 1 A 104 104 LYS CB C 104 32.285 32.257 0.028 1
1 1241 . 3 1 1 A 104 104 LYS N N 104 121.515 120.127 1.388 1
1 1242 . 3 1 1 A 105 105 ASN H H 105 7.747 8.093 -0.346 1
1 1243 . 3 1 1 A 105 105 ASN HA H 105 4.721 4.852 -0.131 1
1 1248 . 3 1 1 A 105 105 ASN C C 105 173.320 174.003 -0.683 1
1 1249 . 3 1 1 A 105 105 ASN CA C 105 53.399 53.027 0.372 1
1 1250 . 3 1 1 A 105 105 ASN CB C 105 39.249 38.558 0.691 1
1 1251 . 3 1 1 A 105 105 ASN N N 105 114.941 114.544 0.397 1
1 1253 . 3 1 1 A 106 106 GLN H H 106 7.850 7.620 0.230 1
1 1254 . 3 1 1 A 106 106 GLN HA H 106 3.902 3.824 0.078 1
1 1261 . 3 1 1 A 106 106 GLN C C 106 175.168 175.049 0.119 1
1 1262 . 3 1 1 A 106 106 GLN CA C 106 56.978 56.869 0.109 1
1 1263 . 3 1 1 A 106 106 GLN CB C 106 25.770 26.727 -0.957 1
1 1265 . 3 1 1 A 106 106 GLN N N 106 114.989 115.694 -0.705 1
1 1267 . 3 1 1 A 107 107 VAL H H 107 8.005 7.984 0.021 1
1 1268 . 3 1 1 A 107 107 VAL HA H 107 3.664 4.021 -0.357 1
1 1276 . 3 1 1 A 107 107 VAL C C 107 175.468 175.220 0.248 1
1 1277 . 3 1 1 A 107 107 VAL CA C 107 62.726 62.611 0.115 1
1 1278 . 3 1 1 A 107 107 VAL CB C 107 32.535 31.884 0.651 1
1 1281 . 3 1 1 A 107 107 VAL N N 107 120.216 119.995 0.221 1
1 1282 . 3 1 1 A 108 108 ASP H H 108 8.484 8.638 -0.154 1
1 1283 . 3 1 1 A 108 108 ASP HA H 108 4.467 4.501 -0.034 1
1 1286 . 3 1 1 A 108 108 ASP C C 108 177.179 176.288 0.891 1
1 1287 . 3 1 1 A 108 108 ASP CA C 108 53.417 55.027 -1.610 1
1 1288 . 3 1 1 A 108 108 ASP CB C 108 40.030 40.931 -0.901 1
1 1289 . 3 1 1 A 108 108 ASP N N 108 125.414 127.459 -2.045 1
1 1290 . 3 1 1 A 109 109 LEU H H 109 8.470 8.395 0.075 1
1 1291 . 3 1 1 A 109 109 LEU HA H 109 3.846 4.207 -0.361 1
1 1301 . 3 1 1 A 109 109 LEU C C 109 178.145 178.510 -0.365 1
1 1302 . 3 1 1 A 109 109 LEU CA C 109 56.573 55.875 0.698 1
1 1303 . 3 1 1 A 109 109 LEU CB C 109 42.011 42.144 -0.133 1
1 1307 . 3 1 1 A 109 109 LEU N N 109 127.577 125.410 2.167 1
1 1308 . 3 1 1 A 110 110 LYS H H 110 8.062 8.036 0.026 1
1 1309 . 3 1 1 A 110 110 LYS HA H 110 3.022 3.756 -0.734 1
1 1317 . 3 1 1 A 110 110 LYS C C 110 177.248 179.270 -2.022 1
1 1318 . 3 1 1 A 110 110 LYS CA C 110 58.742 58.925 -0.183 1
1 1319 . 3 1 1 A 110 110 LYS CB C 110 31.667 31.582 0.085 1
1 1323 . 3 1 1 A 110 110 LYS N N 110 118.873 120.102 -1.229 1
1 1324 . 3 1 1 A 111 111 GLU H H 111 7.113 7.800 -0.687 1
1 1325 . 3 1 1 A 111 111 GLU HA H 111 4.117 4.184 -0.067 1
1 1330 . 3 1 1 A 111 111 GLU C C 111 176.519 177.693 -1.174 1
1 1331 . 3 1 1 A 111 111 GLU CA C 111 55.621 58.989 -3.368 1
1 1332 . 3 1 1 A 111 111 GLU CB C 111 29.943 30.196 -0.253 1
1 1334 . 3 1 1 A 111 111 GLU N N 111 114.282 118.439 -4.157 1
1 1335 . 3 1 1 A 112 112 LEU H H 112 6.848 7.291 -0.443 1
1 1336 . 3 1 1 A 112 112 LEU HA H 112 4.293 4.179 0.114 1
1 1346 . 3 1 1 A 112 112 LEU C C 112 175.674 176.204 -0.530 1
1 1347 . 3 1 1 A 112 112 LEU CA C 112 55.197 56.021 -0.824 1
1 1348 . 3 1 1 A 112 112 LEU CB C 112 41.681 41.789 -0.108 1
1 1352 . 3 1 1 A 112 112 LEU N N 112 118.934 122.308 -3.374 1
1 1353 . 3 1 1 A 113 113 ASP H H 113 8.466 8.289 0.177 1
1 1354 . 3 1 1 A 113 113 ASP HA H 113 4.593 5.310 -0.717 1
1 1357 . 3 1 1 A 113 113 ASP C C 113 174.511 174.896 -0.385 1
1 1358 . 3 1 1 A 113 113 ASP CA C 113 53.558 52.581 0.977 1
1 1359 . 3 1 1 A 113 113 ASP CB C 113 42.448 42.088 0.360 1
1 1360 . 3 1 1 A 113 113 ASP N N 113 122.148 124.508 -2.360 1
1 1 . 4 1 1 A 6 6 SER HA H 6 4.483 5.050 -0.567 1
1 4 . 4 1 1 A 6 6 SER C C 6 175.167 174.036 1.131 1
1 5 . 4 1 1 A 6 6 SER CA C 6 58.759 56.505 2.254 1
1 6 . 4 1 1 A 6 6 SER CB C 6 64.069 66.240 -2.171 1
1 7 . 4 1 1 A 7 7 GLY H H 7 8.431 8.559 -0.128 1
1 8 . 4 1 1 A 7 7 GLY HA2 H 7 3.973 3.911 0.062 1
1 9 . 4 1 1 A 7 7 GLY HA3 H 7 3.973 3.914 0.059 1
1 10 . 4 1 1 A 7 7 GLY C C 7 174.570 174.704 -0.134 1
1 11 . 4 1 1 A 7 7 GLY CA C 7 45.483 46.282 -0.799 1
1 12 . 4 1 1 A 7 7 GLY N N 7 110.640 111.763 -1.123 1
1 13 . 4 1 1 A 8 8 MET H H 8 8.239 8.156 0.083 1
1 14 . 4 1 1 A 8 8 MET HA H 8 4.386 4.451 -0.065 1
1 22 . 4 1 1 A 8 8 MET C C 8 176.621 175.915 0.706 1
1 23 . 4 1 1 A 8 8 MET CA C 8 55.991 56.143 -0.152 1
1 24 . 4 1 1 A 8 8 MET CB C 8 32.986 33.690 -0.704 1
1 27 . 4 1 1 A 8 8 MET N N 8 120.219 120.286 -0.067 1
1 28 . 4 1 1 A 9 9 ALA H H 9 8.435 8.077 0.358 1
1 29 . 4 1 1 A 9 9 ALA HA H 9 4.182 4.225 -0.043 1
1 33 . 4 1 1 A 9 9 ALA C C 9 177.951 177.639 0.312 1
1 34 . 4 1 1 A 9 9 ALA CA C 9 53.399 52.901 0.498 1
1 35 . 4 1 1 A 9 9 ALA CB C 9 18.955 19.243 -0.288 1
1 36 . 4 1 1 A 9 9 ALA N N 9 124.459 127.216 -2.757 1
1 37 . 4 1 1 A 10 10 SER H H 10 8.100 8.612 -0.512 1
1 38 . 4 1 1 A 10 10 SER HA H 10 4.391 5.112 -0.721 1
1 41 . 4 1 1 A 10 10 SER C C 10 174.467 173.702 0.765 1
1 42 . 4 1 1 A 10 10 SER CA C 10 58.709 57.606 1.103 1
1 43 . 4 1 1 A 10 10 SER CB C 10 63.778 64.995 -1.217 1
1 44 . 4 1 1 A 10 10 SER N N 10 113.881 118.215 -4.334 1
1 45 . 4 1 1 A 11 11 THR H H 11 7.821 8.847 -1.026 1
1 46 . 4 1 1 A 11 11 THR HA H 11 4.191 5.151 -0.960 1
1 51 . 4 1 1 A 11 11 THR C C 11 173.610 172.848 0.762 1
1 52 . 4 1 1 A 11 11 THR CA C 11 61.936 60.387 1.549 1
1 53 . 4 1 1 A 11 11 THR CB C 11 69.713 71.741 -2.028 1
1 55 . 4 1 1 A 11 11 THR N N 11 114.471 113.272 1.199 1
1 56 . 4 1 1 A 12 12 PHE H H 12 7.946 9.004 -1.058 1
1 57 . 4 1 1 A 12 12 PHE HA H 12 4.769 4.912 -0.143 1
1 65 . 4 1 1 A 12 12 PHE C C 12 174.211 175.385 -1.174 1
1 66 . 4 1 1 A 12 12 PHE CA C 12 56.644 57.690 -1.046 1
1 67 . 4 1 1 A 12 12 PHE CB C 12 40.609 40.656 -0.047 1
1 73 . 4 1 1 A 12 12 PHE N N 12 120.763 122.078 -1.315 1
1 74 . 4 1 1 A 13 13 ASN H H 13 9.004 8.795 0.209 1
1 75 . 4 1 1 A 13 13 ASN HA H 13 5.366 5.469 -0.103 1
1 80 . 4 1 1 A 13 13 ASN C C 13 172.158 172.548 -0.390 1
1 81 . 4 1 1 A 13 13 ASN CA C 13 50.988 50.465 0.523 1
1 82 . 4 1 1 A 13 13 ASN CB C 13 39.942 39.275 0.667 1
1 83 . 4 1 1 A 13 13 ASN N N 13 119.973 117.786 2.187 1
1 85 . 4 1 1 A 14 14 PRO HA H 14 4.945 4.642 0.303 1
1 92 . 4 1 1 A 14 14 PRO C C 14 174.901 175.250 -0.349 1
1 93 . 4 1 1 A 14 14 PRO CA C 14 63.096 62.443 0.653 1
1 94 . 4 1 1 A 14 14 PRO CB C 14 32.739 33.027 -0.288 1
1 97 . 4 1 1 A 15 15 ARG H H 15 8.908 8.695 0.213 1
1 98 . 4 1 1 A 15 15 ARG HA H 15 4.626 4.806 -0.180 1
1 106 . 4 1 1 A 15 15 ARG C C 15 174.432 174.878 -0.446 1
1 107 . 4 1 1 A 15 15 ARG CA C 15 54.827 54.707 0.120 1
1 108 . 4 1 1 A 15 15 ARG CB C 15 32.439 31.935 0.504 1
1 111 . 4 1 1 A 15 15 ARG N N 15 118.947 120.853 -1.906 1
1 113 . 4 1 1 A 16 16 GLU H H 16 8.838 8.969 -0.131 1
1 114 . 4 1 1 A 16 16 GLU HA H 16 4.876 4.809 0.067 1
1 119 . 4 1 1 A 16 16 GLU C C 16 175.767 175.184 0.583 1
1 120 . 4 1 1 A 16 16 GLU CA C 16 55.621 56.603 -0.982 1
1 121 . 4 1 1 A 16 16 GLU CB C 16 31.093 30.622 0.471 1
1 123 . 4 1 1 A 16 16 GLU N N 16 125.316 125.231 0.085 1
1 124 . 4 1 1 A 17 17 CYS H H 17 9.327 9.076 0.251 1
1 125 . 4 1 1 A 17 17 CYS HA H 17 4.804 5.228 -0.424 1
1 128 . 4 1 1 A 17 17 CYS C C 17 172.973 172.984 -0.011 1
1 129 . 4 1 1 A 17 17 CYS CA C 17 57.930 57.343 0.587 1
1 130 . 4 1 1 A 17 17 CYS CB C 17 30.105 29.449 0.656 1
1 131 . 4 1 1 A 17 17 CYS N N 17 127.909 124.333 3.576 1
1 132 . 4 1 1 A 18 18 LYS H H 18 9.022 8.915 0.107 1
1 133 . 4 1 1 A 18 18 LYS HA H 18 4.769 4.720 0.049 1
1 142 . 4 1 1 A 18 18 LYS C C 18 174.586 175.443 -0.857 1
1 143 . 4 1 1 A 18 18 LYS CA C 18 55.956 55.553 0.403 1
1 144 . 4 1 1 A 18 18 LYS CB C 18 32.203 32.566 -0.363 1
1 148 . 4 1 1 A 18 18 LYS N N 18 127.039 125.586 1.453 1
1 149 . 4 1 1 A 19 19 LEU H H 19 8.784 8.660 0.124 1
1 150 . 4 1 1 A 19 19 LEU HA H 19 4.852 4.533 0.319 1
1 160 . 4 1 1 A 19 19 LEU C C 19 176.862 176.003 0.859 1
1 161 . 4 1 1 A 19 19 LEU CA C 19 55.391 54.411 0.980 1
1 162 . 4 1 1 A 19 19 LEU CB C 19 44.442 42.100 2.342 1
1 166 . 4 1 1 A 19 19 LEU N N 19 126.311 126.917 -0.606 1
1 167 . 4 1 1 A 20 20 SER H H 20 8.215 8.900 -0.685 1
1 168 . 4 1 1 A 20 20 SER HA H 20 5.461 5.390 0.071 1
1 171 . 4 1 1 A 20 20 SER C C 20 171.960 172.950 -0.990 1
1 172 . 4 1 1 A 20 20 SER CA C 20 57.525 57.011 0.514 1
1 173 . 4 1 1 A 20 20 SER CB C 20 65.794 65.034 0.760 1
1 174 . 4 1 1 A 20 20 SER N N 20 115.113 118.377 -3.264 1
1 175 . 4 1 1 A 21 21 LYS H H 21 9.001 8.850 0.151 1
1 176 . 4 1 1 A 21 21 LYS HA H 21 4.887 4.971 -0.084 1
1 185 . 4 1 1 A 21 21 LYS C C 21 174.133 175.173 -1.040 1
1 186 . 4 1 1 A 21 21 LYS CA C 21 53.840 54.097 -0.257 1
1 187 . 4 1 1 A 21 21 LYS CB C 21 36.553 35.663 0.890 1
1 191 . 4 1 1 A 21 21 LYS N N 21 120.938 124.263 -3.325 1
1 192 . 4 1 1 A 22 22 GLN H H 22 8.201 8.277 -0.076 1
1 193 . 4 1 1 A 22 22 GLN HA H 22 4.448 4.501 -0.053 1
1 200 . 4 1 1 A 22 22 GLN C C 22 176.372 176.196 0.176 1
1 201 . 4 1 1 A 22 22 GLN CA C 22 53.658 55.193 -1.535 1
1 202 . 4 1 1 A 22 22 GLN CB C 22 30.473 29.871 0.602 1
1 204 . 4 1 1 A 22 22 GLN N N 22 116.816 119.578 -2.762 1
1 206 . 4 1 1 A 23 23 GLU H H 23 8.624 8.760 -0.136 1
1 207 . 4 1 1 A 23 23 GLU HA H 23 4.056 4.344 -0.288 1
1 212 . 4 1 1 A 23 23 GLU C C 23 177.778 177.113 0.665 1
1 213 . 4 1 1 A 23 23 GLU CA C 23 58.001 56.759 1.242 1
1 214 . 4 1 1 A 23 23 GLU CB C 23 29.237 28.128 1.109 1
1 216 . 4 1 1 A 23 23 GLU N N 23 122.364 121.160 1.204 1
1 217 . 4 1 1 A 24 24 GLY H H 24 8.962 8.364 0.598 1
1 218 . 4 1 1 A 24 24 GLY HA2 H 24 4.139 4.004 0.135 1
1 219 . 4 1 1 A 24 24 GLY HA3 H 24 3.711 4.014 -0.303 1
1 220 . 4 1 1 A 24 24 GLY C C 24 173.857 173.851 0.006 1
1 221 . 4 1 1 A 24 24 GLY CA C 24 45.288 45.079 0.209 1
1 222 . 4 1 1 A 24 24 GLY N N 24 113.942 113.044 0.898 1
1 223 . 4 1 1 A 25 25 GLN H H 25 7.643 7.227 0.416 1
1 224 . 4 1 1 A 25 25 GLN HA H 25 4.488 4.635 -0.147 1
1 231 . 4 1 1 A 25 25 GLN C C 25 174.727 174.731 -0.004 1
1 232 . 4 1 1 A 25 25 GLN CA C 25 54.052 53.890 0.162 1
1 233 . 4 1 1 A 25 25 GLN CB C 25 30.843 31.608 -0.765 1
1 235 . 4 1 1 A 25 25 GLN N N 25 119.538 120.032 -0.494 1
1 237 . 4 1 1 A 26 26 ASN H H 26 8.625 8.774 -0.149 1
1 238 . 4 1 1 A 26 26 ASN HA H 26 4.862 4.736 0.126 1
1 243 . 4 1 1 A 26 26 ASN C C 26 176.261 174.645 1.616 1
1 244 . 4 1 1 A 26 26 ASN CA C 26 51.812 53.209 -1.397 1
1 245 . 4 1 1 A 26 26 ASN CB C 26 40.403 39.728 0.675 1
1 246 . 4 1 1 A 26 26 ASN N N 26 120.047 123.910 -3.863 1
1 248 . 4 1 1 A 27 27 TYR HA H 27 4.152 4.694 -0.542 1
1 255 . 4 1 1 A 27 27 TYR C C 27 176.731 176.163 0.568 1
1 256 . 4 1 1 A 27 27 TYR CA C 27 62.462 58.327 4.135 1
1 257 . 4 1 1 A 27 27 TYR CB C 27 40.240 39.214 1.026 1
1 262 . 4 1 1 A 27 27 TYR N N 27 121.761 121.223 0.538 1
1 263 . 4 1 1 A 28 28 GLY H H 28 8.285 8.184 0.101 1
1 264 . 4 1 1 A 28 28 GLY HA2 H 28 4.490 3.987 0.503 1
1 265 . 4 1 1 A 28 28 GLY HA3 H 28 3.759 4.049 -0.290 1
1 266 . 4 1 1 A 28 28 GLY C C 28 172.198 173.918 -1.720 1
1 267 . 4 1 1 A 28 28 GLY CA C 28 46.139 45.210 0.929 1
1 268 . 4 1 1 A 28 28 GLY N N 28 103.567 107.552 -3.985 1
1 269 . 4 1 1 A 29 29 PHE H H 29 6.878 7.985 -1.107 1
1 270 . 4 1 1 A 29 29 PHE HA H 29 5.179 5.219 -0.040 1
1 278 . 4 1 1 A 29 29 PHE C C 29 172.840 174.036 -1.196 1
1 279 . 4 1 1 A 29 29 PHE CA C 29 55.262 55.139 0.123 1
1 280 . 4 1 1 A 29 29 PHE CB C 29 41.779 42.473 -0.694 1
1 286 . 4 1 1 A 29 29 PHE N N 29 111.027 117.547 -6.520 1
1 287 . 4 1 1 A 30 30 PHE H H 30 8.806 8.514 0.292 1
1 288 . 4 1 1 A 30 30 PHE HA H 30 4.923 4.785 0.138 1
1 296 . 4 1 1 A 30 30 PHE C C 30 174.501 174.708 -0.207 1
1 297 . 4 1 1 A 30 30 PHE CA C 30 55.356 55.654 -0.298 1
1 298 . 4 1 1 A 30 30 PHE CB C 30 41.681 43.563 -1.882 1
1 304 . 4 1 1 A 30 30 PHE N N 30 118.710 117.216 1.494 1
1 305 . 4 1 1 A 31 31 LEU H H 31 8.441 9.198 -0.757 1
1 306 . 4 1 1 A 31 31 LEU HA H 31 5.447 5.014 0.433 1
1 316 . 4 1 1 A 31 31 LEU C C 31 177.306 175.704 1.602 1
1 317 . 4 1 1 A 31 31 LEU CA C 31 53.610 53.898 -0.288 1
1 318 . 4 1 1 A 31 31 LEU CB C 31 43.696 42.148 1.548 1
1 322 . 4 1 1 A 31 31 LEU N N 31 123.765 122.699 1.066 1
1 323 . 4 1 1 A 32 32 ARG H H 32 9.381 8.995 0.386 1
1 324 . 4 1 1 A 32 32 ARG HA H 32 4.840 4.842 -0.002 1
1 331 . 4 1 1 A 32 32 ARG C C 32 175.155 175.676 -0.521 1
1 332 . 4 1 1 A 32 32 ARG CA C 32 54.210 54.603 -0.393 1
1 333 . 4 1 1 A 32 32 ARG CB C 32 35.087 32.904 2.183 1
1 336 . 4 1 1 A 32 32 ARG N N 32 123.160 124.409 -1.249 1
1 337 . 4 1 1 A 33 33 ILE H H 33 7.891 9.029 -1.138 1
1 338 . 4 1 1 A 33 33 ILE HA H 33 4.495 4.969 -0.474 1
1 348 . 4 1 1 A 33 33 ILE C C 33 175.850 174.544 1.306 1
1 349 . 4 1 1 A 33 33 ILE CA C 33 59.641 58.836 0.805 1
1 350 . 4 1 1 A 33 33 ILE CB C 33 39.538 41.079 -1.541 1
1 354 . 4 1 1 A 33 33 ILE N N 33 118.924 119.389 -0.465 1
1 355 . 4 1 1 A 34 34 GLU H H 34 8.971 8.985 -0.014 1
1 356 . 4 1 1 A 34 34 GLU HA H 34 4.578 4.864 -0.286 1
1 361 . 4 1 1 A 34 34 GLU C C 34 175.766 176.163 -0.397 1
1 362 . 4 1 1 A 34 34 GLU CA C 34 54.263 54.277 -0.014 1
1 363 . 4 1 1 A 34 34 GLU CB C 34 32.128 33.133 -1.005 1
1 365 . 4 1 1 A 34 34 GLU N N 34 125.447 121.671 3.776 1
1 366 . 4 1 1 A 35 35 LYS H H 35 8.504 8.659 -0.155 1
1 367 . 4 1 1 A 35 35 LYS HA H 35 4.026 4.210 -0.184 1
1 376 . 4 1 1 A 35 35 LYS C C 35 177.701 176.976 0.725 1
1 377 . 4 1 1 A 35 35 LYS CA C 35 57.591 56.376 1.215 1
1 378 . 4 1 1 A 35 35 LYS CB C 35 32.491 32.444 0.047 1
1 382 . 4 1 1 A 35 35 LYS N N 35 122.893 121.474 1.419 1
1 383 . 4 1 1 A 36 36 ASP H H 36 9.020 9.091 -0.071 1
1 384 . 4 1 1 A 36 36 ASP HA H 36 4.385 4.203 0.182 1
1 387 . 4 1 1 A 36 36 ASP C C 36 174.554 175.006 -0.452 1
1 388 . 4 1 1 A 36 36 ASP CA C 36 55.868 55.075 0.793 1
1 389 . 4 1 1 A 36 36 ASP CB C 36 39.826 39.706 0.120 1
1 390 . 4 1 1 A 36 36 ASP N N 36 121.412 123.345 -1.933 1
1 391 . 4 1 1 A 37 37 THR H H 37 7.464 7.709 -0.245 1
1 392 . 4 1 1 A 37 37 THR HA H 37 4.454 4.905 -0.451 1
1 397 . 4 1 1 A 37 37 THR C C 37 172.012 171.963 0.049 1
1 398 . 4 1 1 A 37 37 THR CA C 37 61.686 60.164 1.522 1
1 399 . 4 1 1 A 37 37 THR CB C 37 70.927 71.724 -0.797 1
1 401 . 4 1 1 A 37 37 THR N N 37 113.147 111.502 1.645 1
1 402 . 4 1 1 A 38 38 ASP H H 38 8.931 8.738 0.193 1
1 403 . 4 1 1 A 38 38 ASP HA H 38 4.852 4.768 0.084 1
1 406 . 4 1 1 A 38 38 ASP CA C 38 54.826 54.559 0.267 1
1 407 . 4 1 1 A 38 38 ASP CB C 38 43.332 41.710 1.622 1
1 408 . 4 1 1 A 38 38 ASP N N 38 120.401 129.547 -9.146 1
1 409 . 4 1 1 A 39 39 GLY H H 39 8.068 8.566 -0.498 1
1 410 . 4 1 1 A 39 39 GLY HA2 H 39 3.774 4.018 -0.244 1
1 411 . 4 1 1 A 39 39 GLY HA3 H 39 3.555 4.029 -0.474 1
1 412 . 4 1 1 A 39 39 GLY C C 39 172.578 173.355 -0.777 1
1 413 . 4 1 1 A 39 39 GLY CA C 39 43.967 44.859 -0.892 1
1 414 . 4 1 1 A 39 39 GLY N N 39 107.925 113.117 -5.192 1
1 415 . 4 1 1 A 40 40 HIS H H 40 9.111 8.612 0.499 1
1 416 . 4 1 1 A 40 40 HIS HA H 40 4.650 4.751 -0.101 1
1 421 . 4 1 1 A 40 40 HIS C C 40 174.330 175.126 -0.796 1
1 422 . 4 1 1 A 40 40 HIS CA C 40 55.886 56.386 -0.500 1
1 423 . 4 1 1 A 40 40 HIS CB C 40 30.507 30.578 -0.071 1
1 426 . 4 1 1 A 40 40 HIS N N 40 119.179 119.252 -0.073 1
1 427 . 4 1 1 A 41 41 LEU H H 41 8.254 8.535 -0.281 1
1 428 . 4 1 1 A 41 41 LEU HA H 41 4.626 4.758 -0.132 1
1 438 . 4 1 1 A 41 41 LEU C C 41 176.035 176.258 -0.223 1
1 439 . 4 1 1 A 41 41 LEU CA C 41 55.621 53.917 1.704 1
1 440 . 4 1 1 A 41 41 LEU CB C 41 45.091 43.373 1.718 1
1 444 . 4 1 1 A 41 41 LEU N N 41 124.808 124.234 0.574 1
1 445 . 4 1 1 A 42 42 ILE H H 42 8.685 8.611 0.074 1
1 446 . 4 1 1 A 42 42 ILE HA H 42 4.578 4.738 -0.160 1
1 456 . 4 1 1 A 42 42 ILE C C 42 175.369 175.953 -0.584 1
1 457 . 4 1 1 A 42 42 ILE CA C 42 59.852 60.760 -0.908 1
1 458 . 4 1 1 A 42 42 ILE CB C 42 36.778 37.823 -1.045 1
1 462 . 4 1 1 A 42 42 ILE N N 42 121.814 125.534 -3.720 1
1 463 . 4 1 1 A 43 43 ARG H H 43 8.787 8.347 0.440 1
1 464 . 4 1 1 A 43 43 ARG HA H 43 4.852 5.203 -0.351 1
1 472 . 4 1 1 A 43 43 ARG C C 43 174.029 175.508 -1.479 1
1 473 . 4 1 1 A 43 43 ARG CA C 43 52.730 54.090 -1.360 1
1 474 . 4 1 1 A 43 43 ARG CB C 43 36.983 33.505 3.478 1
1 477 . 4 1 1 A 43 43 ARG N N 43 125.771 126.675 -0.904 1
1 479 . 4 1 1 A 44 44 VAL H H 44 8.661 8.613 0.048 1
1 480 . 4 1 1 A 44 44 VAL HA H 44 3.276 3.754 -0.478 1
1 488 . 4 1 1 A 44 44 VAL C C 44 173.227 175.103 -1.876 1
1 489 . 4 1 1 A 44 44 VAL CA C 44 63.161 63.196 -0.035 1
1 490 . 4 1 1 A 44 44 VAL CB C 44 29.054 29.788 -0.734 1
1 493 . 4 1 1 A 44 44 VAL N N 44 117.026 116.170 0.856 1
1 494 . 4 1 1 A 45 45 ILE H H 45 8.464 7.973 0.491 1
1 495 . 4 1 1 A 45 45 ILE HA H 45 4.579 4.214 0.365 1
1 505 . 4 1 1 A 45 45 ILE C C 45 178.108 175.240 2.868 1
1 506 . 4 1 1 A 45 45 ILE CA C 45 59.888 60.926 -1.038 1
1 507 . 4 1 1 A 45 45 ILE CB C 45 36.998 36.985 0.013 1
1 511 . 4 1 1 A 45 45 ILE N N 45 122.767 122.349 0.418 1
1 512 . 4 1 1 A 46 46 GLU H H 46 9.015 8.655 0.360 1
1 513 . 4 1 1 A 46 46 GLU HA H 46 4.206 4.318 -0.112 1
1 518 . 4 1 1 A 46 46 GLU C C 46 177.746 176.176 1.570 1
1 519 . 4 1 1 A 46 46 GLU CA C 46 56.130 56.829 -0.699 1
1 520 . 4 1 1 A 46 46 GLU CB C 46 30.581 30.172 0.409 1
1 522 . 4 1 1 A 46 46 GLU N N 46 131.076 129.122 1.954 1
1 523 . 4 1 1 A 47 47 GLU H H 47 9.213 8.742 0.471 1
1 524 . 4 1 1 A 47 47 GLU HA H 47 4.194 4.036 0.158 1
1 529 . 4 1 1 A 47 47 GLU C C 47 178.088 177.693 0.395 1
1 530 . 4 1 1 A 47 47 GLU CA C 47 58.212 58.199 0.013 1
1 531 . 4 1 1 A 47 47 GLU CB C 47 29.390 29.876 -0.486 1
1 533 . 4 1 1 A 47 47 GLU N N 47 129.592 124.837 4.755 1
1 534 . 4 1 1 A 48 48 GLY H H 48 9.586 8.941 0.645 1
1 535 . 4 1 1 A 48 48 GLY HA2 H 48 4.141 3.858 0.283 1
1 536 . 4 1 1 A 48 48 GLY HA3 H 48 3.757 3.861 -0.104 1
1 537 . 4 1 1 A 48 48 GLY C C 48 173.790 174.091 -0.301 1
1 538 . 4 1 1 A 48 48 GLY CA C 48 45.764 46.692 -0.928 1
1 539 . 4 1 1 A 48 48 GLY N N 48 114.819 114.807 0.012 1
1 540 . 4 1 1 A 49 49 SER H H 49 7.580 7.884 -0.304 1
1 541 . 4 1 1 A 49 49 SER HA H 49 4.728 4.797 -0.069 1
1 544 . 4 1 1 A 49 49 SER C C 49 173.542 174.452 -0.910 1
1 545 . 4 1 1 A 49 49 SER CA C 49 57.560 56.022 1.538 1
1 546 . 4 1 1 A 49 49 SER CB C 49 64.529 63.695 0.834 1
1 547 . 4 1 1 A 49 49 SER N N 49 114.688 114.490 0.198 1
1 548 . 4 1 1 A 50 50 PRO HA H 50 4.431 4.556 -0.125 1
1 555 . 4 1 1 A 50 50 PRO C C 50 179.377 177.407 1.970 1
1 556 . 4 1 1 A 50 50 PRO CA C 50 66.059 64.217 1.842 1
1 557 . 4 1 1 A 50 50 PRO CB C 50 32.598 31.821 0.777 1
1 560 . 4 1 1 A 51 51 ALA H H 51 8.264 8.099 0.165 1
1 561 . 4 1 1 A 51 51 ALA HA H 51 3.817 3.977 -0.160 1
1 565 . 4 1 1 A 51 51 ALA C C 51 177.508 179.851 -2.343 1
1 566 . 4 1 1 A 51 51 ALA CA C 51 55.392 54.631 0.761 1
1 567 . 4 1 1 A 51 51 ALA CB C 51 20.474 18.563 1.911 1
1 568 . 4 1 1 A 51 51 ALA N N 51 117.604 120.638 -3.034 1
1 569 . 4 1 1 A 52 52 GLU H H 52 7.794 7.420 0.374 1
1 570 . 4 1 1 A 52 52 GLU HA H 52 3.881 4.049 -0.168 1
1 575 . 4 1 1 A 52 52 GLU C C 52 181.401 178.642 2.759 1
1 576 . 4 1 1 A 52 52 GLU CA C 52 59.454 58.866 0.588 1
1 577 . 4 1 1 A 52 52 GLU CB C 52 30.247 29.596 0.651 1
1 579 . 4 1 1 A 52 52 GLU N N 52 119.474 117.994 1.480 1
1 580 . 4 1 1 A 53 53 LYS H H 53 8.557 7.896 0.661 1
1 581 . 4 1 1 A 53 53 LYS HA H 53 4.020 4.105 -0.085 1
1 588 . 4 1 1 A 53 53 LYS C C 53 177.939 177.397 0.542 1
1 589 . 4 1 1 A 53 53 LYS CA C 53 59.012 58.843 0.169 1
1 590 . 4 1 1 A 53 53 LYS CB C 53 32.438 31.660 0.778 1
1 594 . 4 1 1 A 53 53 LYS N N 53 120.057 117.794 2.263 1
1 595 . 4 1 1 A 54 54 ALA H H 54 7.764 7.440 0.324 1
1 596 . 4 1 1 A 54 54 ALA HA H 54 4.400 4.290 0.110 1
1 600 . 4 1 1 A 54 54 ALA C C 54 177.658 178.022 -0.364 1
1 601 . 4 1 1 A 54 54 ALA CA C 54 52.412 51.705 0.707 1
1 602 . 4 1 1 A 54 54 ALA CB C 54 20.739 18.408 2.331 1
1 603 . 4 1 1 A 54 54 ALA N N 54 117.678 120.633 -2.955 1
1 604 . 4 1 1 A 55 55 GLY H H 55 7.583 7.836 -0.253 1
1 605 . 4 1 1 A 55 55 GLY HA2 H 55 4.266 3.908 0.358 1
1 606 . 4 1 1 A 55 55 GLY HA3 H 55 3.775 3.909 -0.134 1
1 607 . 4 1 1 A 55 55 GLY C C 55 175.232 174.594 0.638 1
1 608 . 4 1 1 A 55 55 GLY CA C 55 45.368 46.587 -1.219 1
1 609 . 4 1 1 A 55 55 GLY N N 55 103.265 107.626 -4.361 1
1 610 . 4 1 1 A 56 56 LEU H H 56 7.280 7.573 -0.293 1
1 611 . 4 1 1 A 56 56 LEU HA H 56 3.984 4.358 -0.374 1
1 621 . 4 1 1 A 56 56 LEU C C 56 174.708 175.751 -1.043 1
1 622 . 4 1 1 A 56 56 LEU CA C 56 55.603 54.883 0.720 1
1 623 . 4 1 1 A 56 56 LEU CB C 56 42.752 42.334 0.418 1
1 627 . 4 1 1 A 56 56 LEU N N 56 119.211 123.288 -4.077 1
1 628 . 4 1 1 A 57 57 LEU H H 57 8.693 8.833 -0.140 1
1 629 . 4 1 1 A 57 57 LEU HA H 57 4.499 4.745 -0.246 1
1 639 . 4 1 1 A 57 57 LEU C C 57 176.124 175.513 0.611 1
1 640 . 4 1 1 A 57 57 LEU CA C 57 52.959 53.399 -0.440 1
1 641 . 4 1 1 A 57 57 LEU CB C 57 45.122 43.772 1.350 1
1 645 . 4 1 1 A 57 57 LEU N N 57 121.969 128.389 -6.420 1
1 646 . 4 1 1 A 58 58 ASP H H 58 8.334 8.736 -0.402 1
1 647 . 4 1 1 A 58 58 ASP HA H 58 4.139 4.392 -0.253 1
1 650 . 4 1 1 A 58 58 ASP C C 58 178.636 176.899 1.737 1
1 651 . 4 1 1 A 58 58 ASP CA C 58 56.079 55.761 0.318 1
1 652 . 4 1 1 A 58 58 ASP CB C 58 42.135 40.392 1.743 1
1 653 . 4 1 1 A 58 58 ASP N N 58 120.401 122.437 -2.036 1
1 654 . 4 1 1 A 59 59 GLY H H 59 9.378 9.256 0.122 1
1 655 . 4 1 1 A 59 59 GLY HA2 H 59 4.317 3.966 0.351 1
1 656 . 4 1 1 A 59 59 GLY HA3 H 59 3.260 3.976 -0.716 1
1 657 . 4 1 1 A 59 59 GLY C C 59 173.359 173.987 -0.628 1
1 658 . 4 1 1 A 59 59 GLY CA C 59 45.517 45.021 0.496 1
1 659 . 4 1 1 A 59 59 GLY N N 59 116.622 114.044 2.578 1
1 660 . 4 1 1 A 60 60 ASP H H 60 8.009 7.527 0.482 1
1 661 . 4 1 1 A 60 60 ASP HA H 60 4.638 4.515 0.123 1
1 664 . 4 1 1 A 60 60 ASP C C 60 175.555 175.694 -0.139 1
1 665 . 4 1 1 A 60 60 ASP CA C 60 55.286 54.539 0.747 1
1 666 . 4 1 1 A 60 60 ASP CB C 60 42.381 41.864 0.517 1
1 667 . 4 1 1 A 60 60 ASP N N 60 121.370 121.781 -0.411 1
1 668 . 4 1 1 A 61 61 ARG H H 61 8.648 8.639 0.009 1
1 669 . 4 1 1 A 61 61 ARG HA H 61 5.179 5.335 -0.156 1
1 677 . 4 1 1 A 61 61 ARG C C 61 177.381 174.301 3.080 1
1 678 . 4 1 1 A 61 61 ARG CA C 61 53.704 54.446 -0.742 1
1 679 . 4 1 1 A 61 61 ARG CB C 61 34.017 33.281 0.736 1
1 682 . 4 1 1 A 61 61 ARG N N 61 116.958 123.960 -7.002 1
1 684 . 4 1 1 A 62 62 VAL H H 62 8.247 8.364 -0.117 1
1 685 . 4 1 1 A 62 62 VAL HA H 62 3.806 4.513 -0.707 1
1 693 . 4 1 1 A 62 62 VAL C C 62 174.748 174.837 -0.089 1
1 694 . 4 1 1 A 62 62 VAL CA C 62 63.149 60.596 2.553 1
1 695 . 4 1 1 A 62 62 VAL CB C 62 32.574 33.050 -0.476 1
1 698 . 4 1 1 A 62 62 VAL N N 62 118.546 123.481 -4.935 1
1 699 . 4 1 1 A 63 63 LEU H H 63 9.262 9.278 -0.016 1
1 700 . 4 1 1 A 63 63 LEU HA H 63 4.412 4.251 0.161 1
1 710 . 4 1 1 A 63 63 LEU C C 63 177.649 177.058 0.591 1
1 711 . 4 1 1 A 63 63 LEU CA C 63 56.044 56.540 -0.496 1
1 712 . 4 1 1 A 63 63 LEU CB C 63 43.339 42.751 0.588 1
1 716 . 4 1 1 A 63 63 LEU N N 63 125.413 130.866 -5.453 1
1 717 . 4 1 1 A 64 64 ARG H H 64 7.806 7.611 0.195 1
1 718 . 4 1 1 A 64 64 ARG HA H 64 5.704 4.696 1.008 1
1 726 . 4 1 1 A 64 64 ARG C C 64 175.091 174.075 1.016 1
1 727 . 4 1 1 A 64 64 ARG CA C 64 54.148 54.601 -0.453 1
1 728 . 4 1 1 A 64 64 ARG CB C 64 35.742 33.997 1.745 1
1 731 . 4 1 1 A 64 64 ARG N N 64 112.961 116.938 -3.977 1
1 733 . 4 1 1 A 65 65 ILE H H 65 8.327 9.123 -0.796 1
1 734 . 4 1 1 A 65 65 ILE HA H 65 4.384 4.632 -0.248 1
1 744 . 4 1 1 A 65 65 ILE C C 65 175.722 175.484 0.238 1
1 745 . 4 1 1 A 65 65 ILE CA C 65 60.501 59.477 1.024 1
1 746 . 4 1 1 A 65 65 ILE CB C 65 39.547 39.997 -0.450 1
1 750 . 4 1 1 A 65 65 ILE N N 65 119.175 123.521 -4.346 1
1 751 . 4 1 1 A 66 66 ASN H H 66 9.911 9.605 0.306 1
1 752 . 4 1 1 A 66 66 ASN HA H 66 4.428 4.375 0.053 1
1 757 . 4 1 1 A 66 66 ASN C C 66 175.349 174.606 0.743 1
1 758 . 4 1 1 A 66 66 ASN CA C 66 54.157 54.162 -0.005 1
1 759 . 4 1 1 A 66 66 ASN CB C 66 37.024 37.438 -0.414 1
1 760 . 4 1 1 A 66 66 ASN N N 66 128.952 128.020 0.932 1
1 762 . 4 1 1 A 67 67 GLY H H 67 9.230 8.583 0.647 1
1 763 . 4 1 1 A 67 67 GLY HA2 H 67 4.322 3.882 0.440 1
1 764 . 4 1 1 A 67 67 GLY HA3 H 67 3.508 3.891 -0.383 1
1 765 . 4 1 1 A 67 67 GLY C C 67 174.393 174.070 0.323 1
1 766 . 4 1 1 A 67 67 GLY CA C 67 45.341 46.288 -0.947 1
1 767 . 4 1 1 A 67 67 GLY N N 67 103.238 104.690 -1.452 1
1 768 . 4 1 1 A 68 68 VAL H H 68 8.063 7.626 0.437 1
1 769 . 4 1 1 A 68 68 VAL HA H 68 4.015 4.458 -0.443 1
1 777 . 4 1 1 A 68 68 VAL C C 68 175.833 174.905 0.928 1
1 778 . 4 1 1 A 68 68 VAL CA C 68 62.603 61.285 1.318 1
1 779 . 4 1 1 A 68 68 VAL CB C 68 32.574 34.336 -1.762 1
1 782 . 4 1 1 A 68 68 VAL N N 68 125.696 120.087 5.609 1
1 783 . 4 1 1 A 69 69 PHE H H 69 9.301 9.142 0.159 1
1 784 . 4 1 1 A 69 69 PHE HA H 69 4.947 4.551 0.396 1
1 792 . 4 1 1 A 69 69 PHE C C 69 177.120 175.491 1.629 1
1 793 . 4 1 1 A 69 69 PHE CA C 69 59.200 59.283 -0.083 1
1 794 . 4 1 1 A 69 69 PHE CB C 69 39.320 39.510 -0.190 1
1 800 . 4 1 1 A 69 69 PHE N N 69 128.641 129.108 -0.467 1
1 801 . 4 1 1 A 70 70 VAL H H 70 8.312 7.822 0.490 1
1 802 . 4 1 1 A 70 70 VAL HA H 70 4.517 4.470 0.047 1
1 810 . 4 1 1 A 70 70 VAL CA C 70 60.734 60.492 0.242 1
1 811 . 4 1 1 A 70 70 VAL CB C 70 32.976 31.218 1.758 1
1 814 . 4 1 1 A 70 70 VAL N N 70 118.381 120.287 -1.906 1
1 815 . 4 1 1 A 71 71 ASP H H 71 5.373 7.312 -1.939 1
1 816 . 4 1 1 A 71 71 ASP HA H 71 4.413 4.246 0.167 1
1 819 . 4 1 1 A 71 71 ASP C C 71 174.896 177.984 -3.088 1
1 820 . 4 1 1 A 71 71 ASP CA C 71 58.334 56.952 1.382 1
1 821 . 4 1 1 A 71 71 ASP CB C 71 46.097 40.849 5.248 1
1 822 . 4 1 1 A 71 71 ASP N N 71 119.008 122.439 -3.431 1
1 823 . 4 1 1 A 72 72 LYS H H 72 7.874 7.899 -0.025 1
1 824 . 4 1 1 A 72 72 LYS HA H 72 4.522 4.462 0.060 1
1 833 . 4 1 1 A 72 72 LYS C C 72 177.209 177.055 0.154 1
1 834 . 4 1 1 A 72 72 LYS CA C 72 54.122 57.763 -3.641 1
1 835 . 4 1 1 A 72 72 LYS CB C 72 31.640 33.746 -2.106 1
1 839 . 4 1 1 A 72 72 LYS N N 72 110.259 118.282 -8.023 1
1 840 . 4 1 1 A 73 73 GLU H H 73 7.421 7.753 -0.332 1
1 841 . 4 1 1 A 73 73 GLU HA H 73 4.401 4.374 0.027 1
1 846 . 4 1 1 A 73 73 GLU C C 73 176.728 176.328 0.400 1
1 847 . 4 1 1 A 73 73 GLU CA C 73 54.950 57.194 -2.244 1
1 848 . 4 1 1 A 73 73 GLU CB C 73 30.390 30.504 -0.114 1
1 850 . 4 1 1 A 73 73 GLU N N 73 120.043 119.200 0.843 1
1 851 . 4 1 1 A 74 74 GLU H H 74 9.360 8.464 0.896 1
1 852 . 4 1 1 A 74 74 GLU HA H 74 4.403 4.797 -0.394 1
1 857 . 4 1 1 A 74 74 GLU C C 74 178.234 176.445 1.789 1
1 858 . 4 1 1 A 74 74 GLU CA C 74 56.516 54.958 1.558 1
1 859 . 4 1 1 A 74 74 GLU CB C 74 30.390 30.551 -0.161 1
1 861 . 4 1 1 A 74 74 GLU N N 74 122.193 121.198 0.995 1
1 862 . 4 1 1 A 75 75 HIS H H 75 9.553 9.119 0.434 1
1 863 . 4 1 1 A 75 75 HIS HA H 75 4.080 4.259 -0.179 1
1 868 . 4 1 1 A 75 75 HIS C C 75 175.985 176.958 -0.973 1
1 869 . 4 1 1 A 75 75 HIS CA C 75 61.016 60.327 0.689 1
1 870 . 4 1 1 A 75 75 HIS CB C 75 29.468 30.089 -0.621 1
1 873 . 4 1 1 A 75 75 HIS N N 75 123.587 120.123 3.464 1
1 874 . 4 1 1 A 76 76 ALA H H 76 9.129 8.424 0.705 1
1 875 . 4 1 1 A 76 76 ALA HA H 76 3.826 4.070 -0.244 1
1 879 . 4 1 1 A 76 76 ALA C C 76 180.475 178.810 1.665 1
1 880 . 4 1 1 A 76 76 ALA CA C 76 55.392 54.846 0.546 1
1 881 . 4 1 1 A 76 76 ALA CB C 76 18.182 18.036 0.146 1
1 882 . 4 1 1 A 76 76 ALA N N 76 117.795 121.229 -3.434 1
1 883 . 4 1 1 A 77 77 GLN H H 77 7.099 7.245 -0.146 1
1 884 . 4 1 1 A 77 77 GLN HA H 77 4.198 4.237 -0.039 1
1 891 . 4 1 1 A 77 77 GLN C C 77 177.860 178.668 -0.808 1
1 892 . 4 1 1 A 77 77 GLN CA C 77 57.790 58.136 -0.346 1
1 893 . 4 1 1 A 77 77 GLN CB C 77 28.536 29.011 -0.475 1
1 895 . 4 1 1 A 77 77 GLN N N 77 115.764 116.671 -0.907 1
1 897 . 4 1 1 A 78 78 VAL H H 78 7.430 7.582 -0.152 1
1 898 . 4 1 1 A 78 78 VAL HA H 78 3.241 3.462 -0.221 1
1 906 . 4 1 1 A 78 78 VAL C C 78 177.042 178.081 -1.039 1
1 907 . 4 1 1 A 78 78 VAL CA C 78 67.299 66.120 1.179 1
1 908 . 4 1 1 A 78 78 VAL CB C 78 30.819 31.430 -0.611 1
1 911 . 4 1 1 A 78 78 VAL N N 78 121.143 120.771 0.372 1
1 912 . 4 1 1 A 79 79 VAL H H 79 7.773 8.272 -0.499 1
1 913 . 4 1 1 A 79 79 VAL HA H 79 3.315 3.541 -0.226 1
1 921 . 4 1 1 A 79 79 VAL C C 79 179.179 177.399 1.780 1
1 922 . 4 1 1 A 79 79 VAL CA C 79 66.694 64.925 1.769 1
1 923 . 4 1 1 A 79 79 VAL CB C 79 31.841 30.811 1.030 1
1 926 . 4 1 1 A 79 79 VAL N N 79 117.473 119.486 -2.013 1
1 927 . 4 1 1 A 80 80 GLU H H 80 7.410 8.028 -0.618 1
1 928 . 4 1 1 A 80 80 GLU HA H 80 4.258 4.042 0.216 1
1 933 . 4 1 1 A 80 80 GLU C C 80 178.018 178.934 -0.916 1
1 934 . 4 1 1 A 80 80 GLU CA C 80 58.566 58.892 -0.326 1
1 935 . 4 1 1 A 80 80 GLU CB C 80 29.072 29.394 -0.322 1
1 937 . 4 1 1 A 80 80 GLU N N 80 120.451 121.129 -0.678 1
1 938 . 4 1 1 A 81 81 LEU H H 81 8.070 7.801 0.269 1
1 939 . 4 1 1 A 81 81 LEU HA H 81 3.976 3.945 0.031 1
1 949 . 4 1 1 A 81 81 LEU C C 81 180.658 179.132 1.526 1
1 950 . 4 1 1 A 81 81 LEU CA C 81 58.061 58.071 -0.010 1
1 951 . 4 1 1 A 81 81 LEU CB C 81 42.115 41.647 0.468 1
1 955 . 4 1 1 A 81 81 LEU N N 81 119.943 119.907 0.036 1
1 956 . 4 1 1 A 82 82 VAL H H 82 7.609 8.269 -0.660 1
1 957 . 4 1 1 A 82 82 VAL HA H 82 3.474 3.585 -0.111 1
1 965 . 4 1 1 A 82 82 VAL C C 82 178.927 178.431 0.496 1
1 966 . 4 1 1 A 82 82 VAL CA C 82 67.398 67.012 0.386 1
1 967 . 4 1 1 A 82 82 VAL CB C 82 31.306 31.351 -0.045 1
1 970 . 4 1 1 A 82 82 VAL N N 82 118.150 118.813 -0.663 1
1 971 . 4 1 1 A 83 83 ARG H H 83 8.186 7.816 0.370 1
1 972 . 4 1 1 A 83 83 ARG HA H 83 3.994 3.994 0.000 1
1 979 . 4 1 1 A 83 83 ARG C C 83 179.999 178.694 1.305 1
1 980 . 4 1 1 A 83 83 ARG CA C 83 60.205 60.006 0.199 1
1 981 . 4 1 1 A 83 83 ARG CB C 83 30.103 29.765 0.338 1
1 984 . 4 1 1 A 83 83 ARG N N 83 122.902 119.772 3.130 1
1 985 . 4 1 1 A 84 84 LYS H H 84 8.772 8.291 0.481 1
1 986 . 4 1 1 A 84 84 LYS HA H 84 4.047 4.097 -0.050 1
1 995 . 4 1 1 A 84 84 LYS C C 84 176.934 178.839 -1.905 1
1 996 . 4 1 1 A 84 84 LYS CA C 84 58.142 59.168 -1.026 1
1 997 . 4 1 1 A 84 84 LYS CB C 84 32.492 31.863 0.629 1
1 1001 . 4 1 1 A 84 84 LYS N N 84 117.548 118.713 -1.165 1
1 1002 . 4 1 1 A 85 85 SER H H 85 7.333 8.166 -0.833 1
1 1003 . 4 1 1 A 85 85 SER HA H 85 4.235 4.254 -0.019 1
1 1006 . 4 1 1 A 85 85 SER C C 85 175.588 175.203 0.385 1
1 1007 . 4 1 1 A 85 85 SER CA C 85 59.535 61.792 -2.257 1
1 1008 . 4 1 1 A 85 85 SER CB C 85 63.571 63.788 -0.217 1
1 1009 . 4 1 1 A 85 85 SER N N 85 113.544 115.610 -2.066 1
1 1010 . 4 1 1 A 86 86 GLY H H 86 7.459 7.700 -0.241 1
1 1011 . 4 1 1 A 86 86 GLY HA2 H 86 4.176 4.122 0.054 1
1 1012 . 4 1 1 A 86 86 GLY HA3 H 86 3.762 4.126 -0.364 1
1 1013 . 4 1 1 A 86 86 GLY C C 86 176.407 175.243 1.164 1
1 1014 . 4 1 1 A 86 86 GLY CA C 86 46.109 43.917 2.192 1
1 1015 . 4 1 1 A 86 86 GLY N N 86 104.331 106.688 -2.357 1
1 1016 . 4 1 1 A 87 87 ASN HA H 87 4.650 4.557 0.093 1
1 1021 . 4 1 1 A 87 87 ASN C C 87 173.653 175.839 -2.186 1
1 1022 . 4 1 1 A 87 87 ASN CA C 87 54.492 55.402 -0.910 1
1 1023 . 4 1 1 A 87 87 ASN CB C 87 38.425 39.159 -0.734 1
1 1024 . 4 1 1 A 87 87 ASN N N 87 118.401 122.054 -3.653 1
1 1026 . 4 1 1 A 88 88 SER H H 88 7.435 8.014 -0.579 1
1 1027 . 4 1 1 A 88 88 SER HA H 88 5.438 5.209 0.229 1
1 1030 . 4 1 1 A 88 88 SER C C 88 172.867 173.426 -0.559 1
1 1031 . 4 1 1 A 88 88 SER CA C 88 58.160 56.275 1.885 1
1 1032 . 4 1 1 A 88 88 SER CB C 88 65.861 65.214 0.647 1
1 1033 . 4 1 1 A 88 88 SER N N 88 113.765 112.050 1.715 1
1 1034 . 4 1 1 A 89 89 VAL H H 89 8.452 8.588 -0.136 1
1 1035 . 4 1 1 A 89 89 VAL HA H 89 4.519 4.826 -0.307 1
1 1043 . 4 1 1 A 89 89 VAL C C 89 171.391 174.537 -3.146 1
1 1044 . 4 1 1 A 89 89 VAL CA C 89 61.333 60.493 0.840 1
1 1045 . 4 1 1 A 89 89 VAL CB C 89 33.897 35.994 -2.097 1
1 1048 . 4 1 1 A 89 89 VAL N N 89 120.001 122.655 -2.654 1
1 1049 . 4 1 1 A 90 90 THR H H 90 8.348 8.703 -0.355 1
1 1050 . 4 1 1 A 90 90 THR HA H 90 5.042 4.914 0.128 1
1 1055 . 4 1 1 A 90 90 THR C C 90 173.926 173.655 0.271 1
1 1056 . 4 1 1 A 90 90 THR CA C 90 61.403 61.770 -0.367 1
1 1057 . 4 1 1 A 90 90 THR CB C 90 69.553 70.431 -0.878 1
1 1059 . 4 1 1 A 90 90 THR N N 90 123.477 123.151 0.326 1
1 1060 . 4 1 1 A 91 91 LEU H H 91 9.195 8.693 0.502 1
1 1061 . 4 1 1 A 91 91 LEU HA H 91 5.161 4.987 0.174 1
1 1071 . 4 1 1 A 91 91 LEU C C 91 174.564 175.601 -1.037 1
1 1072 . 4 1 1 A 91 91 LEU CA C 91 52.590 53.594 -1.004 1
1 1073 . 4 1 1 A 91 91 LEU CB C 91 44.998 45.916 -0.918 1
1 1077 . 4 1 1 A 91 91 LEU N N 91 128.419 126.304 2.115 1
1 1078 . 4 1 1 A 92 92 LEU H H 92 8.644 8.570 0.074 1
1 1079 . 4 1 1 A 92 92 LEU HA H 92 5.335 5.045 0.290 1
1 1089 . 4 1 1 A 92 92 LEU C C 92 176.451 175.164 1.287 1
1 1090 . 4 1 1 A 92 92 LEU CA C 92 54.220 53.927 0.293 1
1 1091 . 4 1 1 A 92 92 LEU CB C 92 44.323 43.065 1.258 1
1 1095 . 4 1 1 A 92 92 LEU N N 92 125.894 123.476 2.418 1
1 1096 . 4 1 1 A 93 93 VAL H H 93 9.249 9.332 -0.083 1
1 1097 . 4 1 1 A 93 93 VAL HA H 93 5.573 5.140 0.433 1
1 1105 . 4 1 1 A 93 93 VAL C C 93 173.550 174.073 -0.523 1
1 1106 . 4 1 1 A 93 93 VAL CA C 93 58.340 60.389 -2.049 1
1 1107 . 4 1 1 A 93 93 VAL CB C 93 36.159 34.282 1.877 1
1 1110 . 4 1 1 A 93 93 VAL N N 93 120.660 120.195 0.465 1
1 1111 . 4 1 1 A 94 94 LEU H H 94 8.634 8.838 -0.204 1
1 1112 . 4 1 1 A 94 94 LEU HA H 94 4.911 4.855 0.056 1
1 1122 . 4 1 1 A 94 94 LEU C C 94 174.172 176.432 -2.260 1
1 1123 . 4 1 1 A 94 94 LEU CA C 94 52.659 53.673 -1.014 1
1 1124 . 4 1 1 A 94 94 LEU CB C 94 47.910 44.365 3.545 1
1 1128 . 4 1 1 A 94 94 LEU N N 94 120.304 128.210 -7.906 1
1 1129 . 4 1 1 A 95 95 ASP H H 95 8.210 8.809 -0.599 1
1 1130 . 4 1 1 A 95 95 ASP HA H 95 5.190 4.539 0.651 1
1 1133 . 4 1 1 A 95 95 ASP C C 95 175.887 177.825 -1.938 1
1 1134 . 4 1 1 A 95 95 ASP CA C 95 53.899 55.165 -1.266 1
1 1135 . 4 1 1 A 95 95 ASP CB C 95 41.188 41.245 -0.057 1
1 1136 . 4 1 1 A 95 95 ASP N N 95 122.184 124.530 -2.346 1
1 1137 . 4 1 1 A 96 96 GLY H H 96 8.478 8.870 -0.392 1
1 1138 . 4 1 1 A 96 96 GLY HA2 H 96 4.002 3.806 0.196 1
1 1139 . 4 1 1 A 96 96 GLY HA3 H 96 3.757 3.813 -0.056 1
1 1140 . 4 1 1 A 96 96 GLY C C 96 175.497 175.418 0.079 1
1 1141 . 4 1 1 A 96 96 GLY CA C 96 49.944 47.482 2.462 1
1 1142 . 4 1 1 A 96 96 GLY N N 96 108.610 110.985 -2.375 1
1 1143 . 4 1 1 A 97 97 ASP H H 97 8.401 8.491 -0.090 1
1 1144 . 4 1 1 A 97 97 ASP HA H 97 4.454 4.330 0.124 1
1 1147 . 4 1 1 A 97 97 ASP C C 97 179.612 178.622 0.990 1
1 1148 . 4 1 1 A 97 97 ASP CA C 97 57.913 57.376 0.537 1
1 1149 . 4 1 1 A 97 97 ASP CB C 97 41.145 41.473 -0.328 1
1 1150 . 4 1 1 A 97 97 ASP N N 97 120.034 122.375 -2.341 1
1 1151 . 4 1 1 A 98 98 SER H H 98 8.152 7.992 0.160 1
1 1152 . 4 1 1 A 98 98 SER HA H 98 4.218 4.197 0.021 1
1 1155 . 4 1 1 A 98 98 SER C C 98 175.061 175.473 -0.412 1
1 1156 . 4 1 1 A 98 98 SER CA C 98 62.180 62.389 -0.209 1
1 1157 . 4 1 1 A 98 98 SER CB C 98 62.179 62.969 -0.790 1
1 1158 . 4 1 1 A 98 98 SER N N 98 117.174 116.363 0.811 1
1 1159 . 4 1 1 A 99 99 TYR H H 99 9.051 8.431 0.620 1
1 1160 . 4 1 1 A 99 99 TYR HA H 99 3.692 3.817 -0.125 1
1 1167 . 4 1 1 A 99 99 TYR C C 99 176.460 176.923 -0.463 1
1 1168 . 4 1 1 A 99 99 TYR CA C 99 62.814 61.979 0.835 1
1 1169 . 4 1 1 A 99 99 TYR CB C 99 38.829 38.438 0.391 1
1 1174 . 4 1 1 A 99 99 TYR N N 99 123.539 122.267 1.272 1
1 1175 . 4 1 1 A 100 100 GLU H H 100 8.520 8.454 0.066 1
1 1176 . 4 1 1 A 100 100 GLU HA H 100 3.952 3.966 -0.014 1
1 1181 . 4 1 1 A 100 100 GLU C C 100 180.151 179.075 1.076 1
1 1182 . 4 1 1 A 100 100 GLU CA C 100 60.099 59.774 0.325 1
1 1183 . 4 1 1 A 100 100 GLU CB C 100 29.435 29.057 0.378 1
1 1185 . 4 1 1 A 100 100 GLU N N 100 117.082 118.375 -1.293 1
1 1186 . 4 1 1 A 101 101 LYS H H 101 7.740 7.511 0.229 1
1 1187 . 4 1 1 A 101 101 LYS HA H 101 3.984 4.056 -0.072 1
1 1196 . 4 1 1 A 101 101 LYS C C 101 178.377 178.401 -0.024 1
1 1197 . 4 1 1 A 101 101 LYS CA C 101 59.888 59.458 0.430 1
1 1198 . 4 1 1 A 101 101 LYS CB C 101 32.821 32.376 0.445 1
1 1202 . 4 1 1 A 101 101 LYS N N 101 119.851 120.803 -0.952 1
1 1203 . 4 1 1 A 102 102 ALA H H 102 8.538 7.961 0.577 1
1 1204 . 4 1 1 A 102 102 ALA HA H 102 3.632 4.275 -0.643 1
1 1208 . 4 1 1 A 102 102 ALA C C 102 179.870 180.029 -0.159 1
1 1209 . 4 1 1 A 102 102 ALA CA C 102 55.285 55.122 0.163 1
1 1210 . 4 1 1 A 102 102 ALA CB C 102 17.163 18.331 -1.168 1
1 1211 . 4 1 1 A 102 102 ALA N N 102 124.176 121.390 2.786 1
1 1212 . 4 1 1 A 103 103 VAL H H 103 8.147 7.767 0.380 1
1 1213 . 4 1 1 A 103 103 VAL HA H 103 3.658 3.539 0.119 1
1 1221 . 4 1 1 A 103 103 VAL C C 103 181.113 177.744 3.369 1
1 1222 . 4 1 1 A 103 103 VAL CA C 103 66.090 67.064 -0.974 1
1 1223 . 4 1 1 A 103 103 VAL CB C 103 31.822 31.581 0.241 1
1 1226 . 4 1 1 A 103 103 VAL N N 103 117.841 117.977 -0.136 1
1 1227 . 4 1 1 A 104 104 LYS H H 104 7.903 8.050 -0.147 1
1 1228 . 4 1 1 A 104 104 LYS HA H 104 4.065 3.920 0.145 1
1 1235 . 4 1 1 A 104 104 LYS C C 104 177.715 178.328 -0.613 1
1 1236 . 4 1 1 A 104 104 LYS CA C 104 59.094 59.745 -0.651 1
1 1237 . 4 1 1 A 104 104 LYS CB C 104 32.285 32.249 0.036 1
1 1241 . 4 1 1 A 104 104 LYS N N 104 121.515 120.299 1.216 1
1 1242 . 4 1 1 A 105 105 ASN H H 105 7.747 7.889 -0.142 1
1 1243 . 4 1 1 A 105 105 ASN HA H 105 4.721 4.860 -0.139 1
1 1248 . 4 1 1 A 105 105 ASN C C 105 173.320 174.862 -1.542 1
1 1249 . 4 1 1 A 105 105 ASN CA C 105 53.399 53.046 0.353 1
1 1250 . 4 1 1 A 105 105 ASN CB C 105 39.249 38.484 0.765 1
1 1251 . 4 1 1 A 105 105 ASN N N 105 114.941 114.878 0.063 1
1 1253 . 4 1 1 A 106 106 GLN H H 106 7.850 8.208 -0.358 1
1 1254 . 4 1 1 A 106 106 GLN HA H 106 3.902 4.008 -0.106 1
1 1261 . 4 1 1 A 106 106 GLN C C 106 175.168 174.915 0.253 1
1 1262 . 4 1 1 A 106 106 GLN CA C 106 56.978 56.640 0.338 1
1 1263 . 4 1 1 A 106 106 GLN CB C 106 25.770 26.588 -0.818 1
1 1265 . 4 1 1 A 106 106 GLN N N 106 114.989 117.042 -2.053 1
1 1267 . 4 1 1 A 107 107 VAL H H 107 8.005 7.815 0.190 1
1 1268 . 4 1 1 A 107 107 VAL HA H 107 3.664 4.028 -0.364 1
1 1276 . 4 1 1 A 107 107 VAL C C 107 175.468 175.075 0.393 1
1 1277 . 4 1 1 A 107 107 VAL CA C 107 62.726 62.591 0.135 1
1 1278 . 4 1 1 A 107 107 VAL CB C 107 32.535 31.971 0.564 1
1 1281 . 4 1 1 A 107 107 VAL N N 107 120.216 120.194 0.022 1
1 1282 . 4 1 1 A 108 108 ASP H H 108 8.484 8.703 -0.219 1
1 1283 . 4 1 1 A 108 108 ASP HA H 108 4.467 4.532 -0.065 1
1 1286 . 4 1 1 A 108 108 ASP C C 108 177.179 176.135 1.044 1
1 1287 . 4 1 1 A 108 108 ASP CA C 108 53.417 55.128 -1.711 1
1 1288 . 4 1 1 A 108 108 ASP CB C 108 40.030 41.097 -1.067 1
1 1289 . 4 1 1 A 108 108 ASP N N 108 125.414 128.047 -2.633 1
1 1290 . 4 1 1 A 109 109 LEU H H 109 8.470 8.567 -0.097 1
1 1291 . 4 1 1 A 109 109 LEU HA H 109 3.846 4.094 -0.248 1
1 1301 . 4 1 1 A 109 109 LEU C C 109 178.145 178.694 -0.549 1
1 1302 . 4 1 1 A 109 109 LEU CA C 109 56.573 57.022 -0.449 1
1 1303 . 4 1 1 A 109 109 LEU CB C 109 42.011 42.002 0.009 1
1 1307 . 4 1 1 A 109 109 LEU N N 109 127.577 124.484 3.093 1
1 1308 . 4 1 1 A 110 110 LYS H H 110 8.062 7.948 0.114 1
1 1309 . 4 1 1 A 110 110 LYS HA H 110 3.022 3.735 -0.713 1
1 1317 . 4 1 1 A 110 110 LYS C C 110 177.248 179.414 -2.166 1
1 1318 . 4 1 1 A 110 110 LYS CA C 110 58.742 59.808 -1.066 1
1 1319 . 4 1 1 A 110 110 LYS CB C 110 31.667 32.013 -0.346 1
1 1323 . 4 1 1 A 110 110 LYS N N 110 118.873 117.419 1.454 1
1 1324 . 4 1 1 A 111 111 GLU H H 111 7.113 8.107 -0.994 1
1 1325 . 4 1 1 A 111 111 GLU HA H 111 4.117 4.111 0.006 1
1 1330 . 4 1 1 A 111 111 GLU C C 111 176.519 177.760 -1.241 1
1 1331 . 4 1 1 A 111 111 GLU CA C 111 55.621 59.096 -3.475 1
1 1332 . 4 1 1 A 111 111 GLU CB C 111 29.943 29.225 0.718 1
1 1334 . 4 1 1 A 111 111 GLU N N 111 114.282 119.855 -5.573 1
1 1335 . 4 1 1 A 112 112 LEU H H 112 6.848 7.880 -1.032 1
1 1336 . 4 1 1 A 112 112 LEU HA H 112 4.293 4.192 0.101 1
1 1346 . 4 1 1 A 112 112 LEU C C 112 175.674 175.981 -0.307 1
1 1347 . 4 1 1 A 112 112 LEU CA C 112 55.197 56.024 -0.827 1
1 1348 . 4 1 1 A 112 112 LEU CB C 112 41.681 41.430 0.251 1
1 1352 . 4 1 1 A 112 112 LEU N N 112 118.934 122.314 -3.380 1
1 1353 . 4 1 1 A 113 113 ASP H H 113 8.466 8.462 0.004 1
1 1354 . 4 1 1 A 113 113 ASP HA H 113 4.593 5.429 -0.836 1
1 1357 . 4 1 1 A 113 113 ASP C C 113 174.511 175.562 -1.051 1
1 1358 . 4 1 1 A 113 113 ASP CA C 113 53.558 53.003 0.555 1
1 1359 . 4 1 1 A 113 113 ASP CB C 113 42.448 43.037 -0.589 1
1 1360 . 4 1 1 A 113 113 ASP N N 113 122.148 122.570 -0.422 1
1 1 . 5 1 1 A 6 6 SER HA H 6 4.483 5.039 -0.556 1
1 4 . 5 1 1 A 6 6 SER C C 6 175.167 173.815 1.352 1
1 5 . 5 1 1 A 6 6 SER CA C 6 58.759 56.358 2.401 1
1 6 . 5 1 1 A 6 6 SER CB C 6 64.069 65.316 -1.247 1
1 7 . 5 1 1 A 7 7 GLY H H 7 8.431 9.071 -0.640 1
1 8 . 5 1 1 A 7 7 GLY HA2 H 7 3.973 3.802 0.171 1
1 9 . 5 1 1 A 7 7 GLY HA3 H 7 3.973 3.803 0.170 1
1 10 . 5 1 1 A 7 7 GLY C C 7 174.570 173.176 1.394 1
1 11 . 5 1 1 A 7 7 GLY CA C 7 45.483 47.016 -1.533 1
1 12 . 5 1 1 A 7 7 GLY N N 7 110.640 114.786 -4.146 1
1 13 . 5 1 1 A 8 8 MET H H 8 8.239 8.381 -0.142 1
1 14 . 5 1 1 A 8 8 MET HA H 8 4.386 4.892 -0.506 1
1 22 . 5 1 1 A 8 8 MET C C 8 176.621 175.025 1.596 1
1 23 . 5 1 1 A 8 8 MET CA C 8 55.991 54.188 1.803 1
1 24 . 5 1 1 A 8 8 MET CB C 8 32.986 35.331 -2.345 1
1 27 . 5 1 1 A 8 8 MET N N 8 120.219 121.707 -1.488 1
1 28 . 5 1 1 A 9 9 ALA H H 9 8.435 8.650 -0.215 1
1 29 . 5 1 1 A 9 9 ALA HA H 9 4.182 4.844 -0.662 1
1 33 . 5 1 1 A 9 9 ALA C C 9 177.951 177.446 0.505 1
1 34 . 5 1 1 A 9 9 ALA CA C 9 53.399 50.287 3.112 1
1 35 . 5 1 1 A 9 9 ALA CB C 9 18.955 21.468 -2.513 1
1 36 . 5 1 1 A 9 9 ALA N N 9 124.459 126.766 -2.307 1
1 37 . 5 1 1 A 10 10 SER H H 10 8.100 8.479 -0.379 1
1 38 . 5 1 1 A 10 10 SER HA H 10 4.391 4.297 0.094 1
1 41 . 5 1 1 A 10 10 SER C C 10 174.467 174.251 0.216 1
1 42 . 5 1 1 A 10 10 SER CA C 10 58.709 59.646 -0.937 1
1 43 . 5 1 1 A 10 10 SER CB C 10 63.778 63.850 -0.072 1
1 44 . 5 1 1 A 10 10 SER N N 10 113.881 116.825 -2.944 1
1 45 . 5 1 1 A 11 11 THR H H 11 7.821 8.435 -0.614 1
1 46 . 5 1 1 A 11 11 THR HA H 11 4.191 4.941 -0.750 1
1 51 . 5 1 1 A 11 11 THR C C 11 173.610 174.187 -0.577 1
1 52 . 5 1 1 A 11 11 THR CA C 11 61.936 60.762 1.174 1
1 53 . 5 1 1 A 11 11 THR CB C 11 69.713 70.105 -0.392 1
1 55 . 5 1 1 A 11 11 THR N N 11 114.471 114.462 0.009 1
1 56 . 5 1 1 A 12 12 PHE H H 12 7.946 8.889 -0.943 1
1 57 . 5 1 1 A 12 12 PHE HA H 12 4.769 4.609 0.160 1
1 65 . 5 1 1 A 12 12 PHE C C 12 174.211 175.829 -1.618 1
1 66 . 5 1 1 A 12 12 PHE CA C 12 56.644 58.127 -1.483 1
1 67 . 5 1 1 A 12 12 PHE CB C 12 40.609 39.351 1.258 1
1 73 . 5 1 1 A 12 12 PHE N N 12 120.763 126.664 -5.901 1
1 74 . 5 1 1 A 13 13 ASN H H 13 9.004 8.745 0.259 1
1 75 . 5 1 1 A 13 13 ASN HA H 13 5.366 5.511 -0.145 1
1 80 . 5 1 1 A 13 13 ASN C C 13 172.158 172.653 -0.495 1
1 81 . 5 1 1 A 13 13 ASN CA C 13 50.988 50.575 0.413 1
1 82 . 5 1 1 A 13 13 ASN CB C 13 39.942 39.213 0.729 1
1 83 . 5 1 1 A 13 13 ASN N N 13 119.973 118.428 1.545 1
1 85 . 5 1 1 A 14 14 PRO HA H 14 4.945 4.640 0.305 1
1 92 . 5 1 1 A 14 14 PRO C C 14 174.901 175.466 -0.565 1
1 93 . 5 1 1 A 14 14 PRO CA C 14 63.096 62.622 0.474 1
1 94 . 5 1 1 A 14 14 PRO CB C 14 32.739 33.004 -0.265 1
1 97 . 5 1 1 A 15 15 ARG H H 15 8.908 8.804 0.104 1
1 98 . 5 1 1 A 15 15 ARG HA H 15 4.626 4.841 -0.215 1
1 106 . 5 1 1 A 15 15 ARG C C 15 174.432 174.364 0.068 1
1 107 . 5 1 1 A 15 15 ARG CA C 15 54.827 55.010 -0.183 1
1 108 . 5 1 1 A 15 15 ARG CB C 15 32.439 33.759 -1.320 1
1 111 . 5 1 1 A 15 15 ARG N N 15 118.947 122.157 -3.210 1
1 113 . 5 1 1 A 16 16 GLU H H 16 8.838 8.919 -0.081 1
1 114 . 5 1 1 A 16 16 GLU HA H 16 4.876 4.895 -0.019 1
1 119 . 5 1 1 A 16 16 GLU C C 16 175.767 174.749 1.018 1
1 120 . 5 1 1 A 16 16 GLU CA C 16 55.621 56.061 -0.440 1
1 121 . 5 1 1 A 16 16 GLU CB C 16 31.093 30.728 0.365 1
1 123 . 5 1 1 A 16 16 GLU N N 16 125.316 126.900 -1.584 1
1 124 . 5 1 1 A 17 17 CYS H H 17 9.327 8.995 0.332 1
1 125 . 5 1 1 A 17 17 CYS HA H 17 4.804 5.116 -0.312 1
1 128 . 5 1 1 A 17 17 CYS C C 17 172.973 173.274 -0.301 1
1 129 . 5 1 1 A 17 17 CYS CA C 17 57.930 57.835 0.095 1
1 130 . 5 1 1 A 17 17 CYS CB C 17 30.105 30.221 -0.116 1
1 131 . 5 1 1 A 17 17 CYS N N 17 127.909 123.794 4.115 1
1 132 . 5 1 1 A 18 18 LYS H H 18 9.022 8.938 0.084 1
1 133 . 5 1 1 A 18 18 LYS HA H 18 4.769 4.816 -0.047 1
1 142 . 5 1 1 A 18 18 LYS C C 18 174.586 175.394 -0.808 1
1 143 . 5 1 1 A 18 18 LYS CA C 18 55.956 55.660 0.296 1
1 144 . 5 1 1 A 18 18 LYS CB C 18 32.203 33.809 -1.606 1
1 148 . 5 1 1 A 18 18 LYS N N 18 127.039 125.510 1.529 1
1 149 . 5 1 1 A 19 19 LEU H H 19 8.784 9.414 -0.630 1
1 150 . 5 1 1 A 19 19 LEU HA H 19 4.852 5.130 -0.278 1
1 160 . 5 1 1 A 19 19 LEU C C 19 176.862 176.032 0.830 1
1 161 . 5 1 1 A 19 19 LEU CA C 19 55.391 53.390 2.001 1
1 162 . 5 1 1 A 19 19 LEU CB C 19 44.442 44.189 0.253 1
1 166 . 5 1 1 A 19 19 LEU N N 19 126.311 126.914 -0.603 1
1 167 . 5 1 1 A 20 20 SER H H 20 8.215 9.040 -0.825 1
1 168 . 5 1 1 A 20 20 SER HA H 20 5.461 5.770 -0.309 1
1 171 . 5 1 1 A 20 20 SER C C 20 171.960 173.709 -1.749 1
1 172 . 5 1 1 A 20 20 SER CA C 20 57.525 56.644 0.881 1
1 173 . 5 1 1 A 20 20 SER CB C 20 65.794 65.552 0.242 1
1 174 . 5 1 1 A 20 20 SER N N 20 115.113 117.728 -2.615 1
1 175 . 5 1 1 A 21 21 LYS H H 21 9.001 8.896 0.105 1
1 176 . 5 1 1 A 21 21 LYS HA H 21 4.887 4.962 -0.075 1
1 185 . 5 1 1 A 21 21 LYS C C 21 174.133 175.160 -1.027 1
1 186 . 5 1 1 A 21 21 LYS CA C 21 53.840 54.156 -0.316 1
1 187 . 5 1 1 A 21 21 LYS CB C 21 36.553 35.654 0.899 1
1 191 . 5 1 1 A 21 21 LYS N N 21 120.938 121.536 -0.598 1
1 192 . 5 1 1 A 22 22 GLN H H 22 8.201 8.202 -0.001 1
1 193 . 5 1 1 A 22 22 GLN HA H 22 4.448 4.578 -0.130 1
1 200 . 5 1 1 A 22 22 GLN C C 22 176.372 175.240 1.132 1
1 201 . 5 1 1 A 22 22 GLN CA C 22 53.658 55.209 -1.551 1
1 202 . 5 1 1 A 22 22 GLN CB C 22 30.473 29.883 0.590 1
1 204 . 5 1 1 A 22 22 GLN N N 22 116.816 119.614 -2.798 1
1 206 . 5 1 1 A 23 23 GLU H H 23 8.624 8.600 0.024 1
1 207 . 5 1 1 A 23 23 GLU HA H 23 4.056 4.133 -0.077 1
1 212 . 5 1 1 A 23 23 GLU C C 23 177.778 176.913 0.865 1
1 213 . 5 1 1 A 23 23 GLU CA C 23 58.001 57.378 0.623 1
1 214 . 5 1 1 A 23 23 GLU CB C 23 29.237 29.239 -0.002 1
1 216 . 5 1 1 A 23 23 GLU N N 23 122.364 120.574 1.790 1
1 217 . 5 1 1 A 24 24 GLY H H 24 8.962 8.958 0.004 1
1 218 . 5 1 1 A 24 24 GLY HA2 H 24 4.139 3.969 0.170 1
1 219 . 5 1 1 A 24 24 GLY HA3 H 24 3.711 3.971 -0.260 1
1 220 . 5 1 1 A 24 24 GLY C C 24 173.857 174.164 -0.307 1
1 221 . 5 1 1 A 24 24 GLY CA C 24 45.288 45.056 0.232 1
1 222 . 5 1 1 A 24 24 GLY N N 24 113.942 112.862 1.080 1
1 223 . 5 1 1 A 25 25 GLN H H 25 7.643 7.879 -0.236 1
1 224 . 5 1 1 A 25 25 GLN HA H 25 4.488 4.307 0.181 1
1 231 . 5 1 1 A 25 25 GLN C C 25 174.727 174.546 0.181 1
1 232 . 5 1 1 A 25 25 GLN CA C 25 54.052 55.511 -1.459 1
1 233 . 5 1 1 A 25 25 GLN CB C 25 30.843 30.243 0.600 1
1 235 . 5 1 1 A 25 25 GLN N N 25 119.538 121.470 -1.932 1
1 237 . 5 1 1 A 26 26 ASN H H 26 8.625 8.465 0.160 1
1 238 . 5 1 1 A 26 26 ASN HA H 26 4.862 4.773 0.089 1
1 243 . 5 1 1 A 26 26 ASN C C 26 176.261 174.852 1.409 1
1 244 . 5 1 1 A 26 26 ASN CA C 26 51.812 51.654 0.158 1
1 245 . 5 1 1 A 26 26 ASN CB C 26 40.403 40.492 -0.089 1
1 246 . 5 1 1 A 26 26 ASN N N 26 120.047 122.245 -2.198 1
1 248 . 5 1 1 A 27 27 TYR HA H 27 4.152 4.649 -0.497 1
1 255 . 5 1 1 A 27 27 TYR C C 27 176.731 176.096 0.635 1
1 256 . 5 1 1 A 27 27 TYR CA C 27 62.462 58.477 3.985 1
1 257 . 5 1 1 A 27 27 TYR CB C 27 40.240 39.150 1.090 1
1 262 . 5 1 1 A 27 27 TYR N N 27 121.761 121.892 -0.131 1
1 263 . 5 1 1 A 28 28 GLY H H 28 8.285 7.970 0.315 1
1 264 . 5 1 1 A 28 28 GLY HA2 H 28 4.490 3.904 0.586 1
1 265 . 5 1 1 A 28 28 GLY HA3 H 28 3.759 4.002 -0.243 1
1 266 . 5 1 1 A 28 28 GLY C C 28 172.198 173.920 -1.722 1
1 267 . 5 1 1 A 28 28 GLY CA C 28 46.139 45.208 0.931 1
1 268 . 5 1 1 A 28 28 GLY N N 28 103.567 107.257 -3.690 1
1 269 . 5 1 1 A 29 29 PHE H H 29 6.878 7.833 -0.955 1
1 270 . 5 1 1 A 29 29 PHE HA H 29 5.179 4.841 0.338 1
1 278 . 5 1 1 A 29 29 PHE C C 29 172.840 173.825 -0.985 1
1 279 . 5 1 1 A 29 29 PHE CA C 29 55.262 54.996 0.266 1
1 280 . 5 1 1 A 29 29 PHE CB C 29 41.779 42.404 -0.625 1
1 286 . 5 1 1 A 29 29 PHE N N 29 111.027 117.471 -6.444 1
1 287 . 5 1 1 A 30 30 PHE H H 30 8.806 8.571 0.235 1
1 288 . 5 1 1 A 30 30 PHE HA H 30 4.923 4.824 0.099 1
1 296 . 5 1 1 A 30 30 PHE C C 30 174.501 174.802 -0.301 1
1 297 . 5 1 1 A 30 30 PHE CA C 30 55.356 56.178 -0.822 1
1 298 . 5 1 1 A 30 30 PHE CB C 30 41.681 43.515 -1.834 1
1 304 . 5 1 1 A 30 30 PHE N N 30 118.710 117.557 1.153 1
1 305 . 5 1 1 A 31 31 LEU H H 31 8.441 8.957 -0.516 1
1 306 . 5 1 1 A 31 31 LEU HA H 31 5.447 5.100 0.347 1
1 316 . 5 1 1 A 31 31 LEU C C 31 177.306 175.808 1.498 1
1 317 . 5 1 1 A 31 31 LEU CA C 31 53.610 53.465 0.145 1
1 318 . 5 1 1 A 31 31 LEU CB C 31 43.696 42.702 0.994 1
1 322 . 5 1 1 A 31 31 LEU N N 31 123.765 122.630 1.135 1
1 323 . 5 1 1 A 32 32 ARG H H 32 9.381 8.701 0.680 1
1 324 . 5 1 1 A 32 32 ARG HA H 32 4.840 4.817 0.023 1
1 331 . 5 1 1 A 32 32 ARG C C 32 175.155 175.690 -0.535 1
1 332 . 5 1 1 A 32 32 ARG CA C 32 54.210 54.147 0.063 1
1 333 . 5 1 1 A 32 32 ARG CB C 32 35.087 31.840 3.247 1
1 336 . 5 1 1 A 32 32 ARG N N 32 123.160 124.292 -1.132 1
1 337 . 5 1 1 A 33 33 ILE H H 33 7.891 8.935 -1.044 1
1 338 . 5 1 1 A 33 33 ILE HA H 33 4.495 4.767 -0.272 1
1 348 . 5 1 1 A 33 33 ILE C C 33 175.850 175.011 0.839 1
1 349 . 5 1 1 A 33 33 ILE CA C 33 59.641 59.819 -0.178 1
1 350 . 5 1 1 A 33 33 ILE CB C 33 39.538 39.441 0.097 1
1 354 . 5 1 1 A 33 33 ILE N N 33 118.924 120.936 -2.012 1
1 355 . 5 1 1 A 34 34 GLU H H 34 8.971 8.667 0.304 1
1 356 . 5 1 1 A 34 34 GLU HA H 34 4.578 4.725 -0.147 1
1 361 . 5 1 1 A 34 34 GLU C C 34 175.766 176.512 -0.746 1
1 362 . 5 1 1 A 34 34 GLU CA C 34 54.263 54.438 -0.175 1
1 363 . 5 1 1 A 34 34 GLU CB C 34 32.128 32.193 -0.065 1
1 365 . 5 1 1 A 34 34 GLU N N 34 125.447 123.913 1.534 1
1 366 . 5 1 1 A 35 35 LYS H H 35 8.504 8.662 -0.158 1
1 367 . 5 1 1 A 35 35 LYS HA H 35 4.026 4.162 -0.136 1
1 376 . 5 1 1 A 35 35 LYS C C 35 177.701 176.268 1.433 1
1 377 . 5 1 1 A 35 35 LYS CA C 35 57.591 56.310 1.281 1
1 378 . 5 1 1 A 35 35 LYS CB C 35 32.491 32.977 -0.486 1
1 382 . 5 1 1 A 35 35 LYS N N 35 122.893 122.079 0.814 1
1 383 . 5 1 1 A 36 36 ASP H H 36 9.020 8.947 0.073 1
1 384 . 5 1 1 A 36 36 ASP HA H 36 4.385 4.152 0.233 1
1 387 . 5 1 1 A 36 36 ASP C C 36 174.554 174.669 -0.115 1
1 388 . 5 1 1 A 36 36 ASP CA C 36 55.868 55.140 0.728 1
1 389 . 5 1 1 A 36 36 ASP CB C 36 39.826 39.520 0.306 1
1 390 . 5 1 1 A 36 36 ASP N N 36 121.412 118.869 2.543 1
1 391 . 5 1 1 A 37 37 THR H H 37 7.464 7.484 -0.020 1
1 392 . 5 1 1 A 37 37 THR HA H 37 4.454 4.862 -0.408 1
1 397 . 5 1 1 A 37 37 THR C C 37 172.012 172.571 -0.559 1
1 398 . 5 1 1 A 37 37 THR CA C 37 61.686 60.888 0.798 1
1 399 . 5 1 1 A 37 37 THR CB C 37 70.927 72.407 -1.480 1
1 401 . 5 1 1 A 37 37 THR N N 37 113.147 112.394 0.753 1
1 402 . 5 1 1 A 38 38 ASP H H 38 8.931 8.878 0.053 1
1 403 . 5 1 1 A 38 38 ASP HA H 38 4.852 5.075 -0.223 1
1 406 . 5 1 1 A 38 38 ASP CA C 38 54.826 53.134 1.692 1
1 407 . 5 1 1 A 38 38 ASP CB C 38 43.332 43.064 0.268 1
1 408 . 5 1 1 A 38 38 ASP N N 38 120.401 122.429 -2.028 1
1 409 . 5 1 1 A 39 39 GLY H H 39 8.068 7.824 0.244 1
1 410 . 5 1 1 A 39 39 GLY HA2 H 39 3.774 3.995 -0.221 1
1 411 . 5 1 1 A 39 39 GLY HA3 H 39 3.555 4.021 -0.466 1
1 412 . 5 1 1 A 39 39 GLY C C 39 172.578 172.858 -0.280 1
1 413 . 5 1 1 A 39 39 GLY CA C 39 43.967 44.444 -0.477 1
1 414 . 5 1 1 A 39 39 GLY N N 39 107.925 109.103 -1.178 1
1 415 . 5 1 1 A 40 40 HIS H H 40 9.111 8.313 0.798 1
1 416 . 5 1 1 A 40 40 HIS HA H 40 4.650 4.949 -0.299 1
1 421 . 5 1 1 A 40 40 HIS C C 40 174.330 174.556 -0.226 1
1 422 . 5 1 1 A 40 40 HIS CA C 40 55.886 55.412 0.474 1
1 423 . 5 1 1 A 40 40 HIS CB C 40 30.507 31.115 -0.608 1
1 426 . 5 1 1 A 40 40 HIS N N 40 119.179 118.593 0.586 1
1 427 . 5 1 1 A 41 41 LEU H H 41 8.254 8.822 -0.568 1
1 428 . 5 1 1 A 41 41 LEU HA H 41 4.626 4.482 0.144 1
1 438 . 5 1 1 A 41 41 LEU C C 41 176.035 176.434 -0.399 1
1 439 . 5 1 1 A 41 41 LEU CA C 41 55.621 54.531 1.090 1
1 440 . 5 1 1 A 41 41 LEU CB C 41 45.091 41.762 3.329 1
1 444 . 5 1 1 A 41 41 LEU N N 41 124.808 125.622 -0.814 1
1 445 . 5 1 1 A 42 42 ILE H H 42 8.685 8.930 -0.245 1
1 446 . 5 1 1 A 42 42 ILE HA H 42 4.578 4.619 -0.041 1
1 456 . 5 1 1 A 42 42 ILE C C 42 175.369 176.495 -1.126 1
1 457 . 5 1 1 A 42 42 ILE CA C 42 59.852 61.160 -1.308 1
1 458 . 5 1 1 A 42 42 ILE CB C 42 36.778 37.177 -0.399 1
1 462 . 5 1 1 A 42 42 ILE N N 42 121.814 125.720 -3.906 1
1 463 . 5 1 1 A 43 43 ARG H H 43 8.787 8.280 0.507 1
1 464 . 5 1 1 A 43 43 ARG HA H 43 4.852 4.867 -0.015 1
1 472 . 5 1 1 A 43 43 ARG C C 43 174.029 175.427 -1.398 1
1 473 . 5 1 1 A 43 43 ARG CA C 43 52.730 54.167 -1.437 1
1 474 . 5 1 1 A 43 43 ARG CB C 43 36.983 33.509 3.474 1
1 477 . 5 1 1 A 43 43 ARG N N 43 125.771 126.614 -0.843 1
1 479 . 5 1 1 A 44 44 VAL H H 44 8.661 8.598 0.063 1
1 480 . 5 1 1 A 44 44 VAL HA H 44 3.276 3.740 -0.464 1
1 488 . 5 1 1 A 44 44 VAL C C 44 173.227 174.957 -1.730 1
1 489 . 5 1 1 A 44 44 VAL CA C 44 63.161 63.174 -0.013 1
1 490 . 5 1 1 A 44 44 VAL CB C 44 29.054 29.968 -0.914 1
1 493 . 5 1 1 A 44 44 VAL N N 44 117.026 116.444 0.582 1
1 494 . 5 1 1 A 45 45 ILE H H 45 8.464 7.951 0.513 1
1 495 . 5 1 1 A 45 45 ILE HA H 45 4.579 4.144 0.435 1
1 505 . 5 1 1 A 45 45 ILE C C 45 178.108 175.158 2.950 1
1 506 . 5 1 1 A 45 45 ILE CA C 45 59.888 61.173 -1.285 1
1 507 . 5 1 1 A 45 45 ILE CB C 45 36.998 36.528 0.470 1
1 511 . 5 1 1 A 45 45 ILE N N 45 122.767 122.573 0.194 1
1 512 . 5 1 1 A 46 46 GLU H H 46 9.015 8.754 0.261 1
1 513 . 5 1 1 A 46 46 GLU HA H 46 4.206 4.330 -0.124 1
1 518 . 5 1 1 A 46 46 GLU C C 46 177.746 176.737 1.009 1
1 519 . 5 1 1 A 46 46 GLU CA C 46 56.130 56.671 -0.541 1
1 520 . 5 1 1 A 46 46 GLU CB C 46 30.581 30.790 -0.209 1
1 522 . 5 1 1 A 46 46 GLU N N 46 131.076 128.609 2.467 1
1 523 . 5 1 1 A 47 47 GLU H H 47 9.213 8.776 0.437 1
1 524 . 5 1 1 A 47 47 GLU HA H 47 4.194 4.397 -0.203 1
1 529 . 5 1 1 A 47 47 GLU C C 47 178.088 177.411 0.677 1
1 530 . 5 1 1 A 47 47 GLU CA C 47 58.212 56.167 2.045 1
1 531 . 5 1 1 A 47 47 GLU CB C 47 29.390 30.878 -1.488 1
1 533 . 5 1 1 A 47 47 GLU N N 47 129.592 123.615 5.977 1
1 534 . 5 1 1 A 48 48 GLY H H 48 9.586 8.936 0.650 1
1 535 . 5 1 1 A 48 48 GLY HA2 H 48 4.141 3.832 0.309 1
1 536 . 5 1 1 A 48 48 GLY HA3 H 48 3.757 3.833 -0.076 1
1 537 . 5 1 1 A 48 48 GLY C C 48 173.790 174.056 -0.266 1
1 538 . 5 1 1 A 48 48 GLY CA C 48 45.764 46.767 -1.003 1
1 539 . 5 1 1 A 48 48 GLY N N 48 114.819 111.805 3.014 1
1 540 . 5 1 1 A 49 49 SER H H 49 7.580 7.844 -0.264 1
1 541 . 5 1 1 A 49 49 SER HA H 49 4.728 4.784 -0.056 1
1 544 . 5 1 1 A 49 49 SER C C 49 173.542 174.567 -1.025 1
1 545 . 5 1 1 A 49 49 SER CA C 49 57.560 55.981 1.579 1
1 546 . 5 1 1 A 49 49 SER CB C 49 64.529 63.771 0.758 1
1 547 . 5 1 1 A 49 49 SER N N 49 114.688 114.382 0.306 1
1 548 . 5 1 1 A 50 50 PRO HA H 50 4.431 4.575 -0.144 1
1 555 . 5 1 1 A 50 50 PRO C C 50 179.377 177.638 1.739 1
1 556 . 5 1 1 A 50 50 PRO CA C 50 66.059 64.287 1.772 1
1 557 . 5 1 1 A 50 50 PRO CB C 50 32.598 31.847 0.751 1
1 560 . 5 1 1 A 51 51 ALA H H 51 8.264 8.002 0.262 1
1 561 . 5 1 1 A 51 51 ALA HA H 51 3.817 4.077 -0.260 1
1 565 . 5 1 1 A 51 51 ALA C C 51 177.508 179.869 -2.361 1
1 566 . 5 1 1 A 51 51 ALA CA C 51 55.392 55.099 0.293 1
1 567 . 5 1 1 A 51 51 ALA CB C 51 20.474 18.450 2.024 1
1 568 . 5 1 1 A 51 51 ALA N N 51 117.604 120.339 -2.735 1
1 569 . 5 1 1 A 52 52 GLU H H 52 7.794 7.480 0.314 1
1 570 . 5 1 1 A 52 52 GLU HA H 52 3.881 4.033 -0.152 1
1 575 . 5 1 1 A 52 52 GLU C C 52 181.401 178.316 3.085 1
1 576 . 5 1 1 A 52 52 GLU CA C 52 59.454 59.151 0.303 1
1 577 . 5 1 1 A 52 52 GLU CB C 52 30.247 29.451 0.796 1
1 579 . 5 1 1 A 52 52 GLU N N 52 119.474 118.812 0.662 1
1 580 . 5 1 1 A 53 53 LYS H H 53 8.557 7.712 0.845 1
1 581 . 5 1 1 A 53 53 LYS HA H 53 4.020 4.032 -0.012 1
1 588 . 5 1 1 A 53 53 LYS C C 53 177.939 178.073 -0.134 1
1 589 . 5 1 1 A 53 53 LYS CA C 53 59.012 59.067 -0.055 1
1 590 . 5 1 1 A 53 53 LYS CB C 53 32.438 32.055 0.383 1
1 594 . 5 1 1 A 53 53 LYS N N 53 120.057 118.908 1.149 1
1 595 . 5 1 1 A 54 54 ALA H H 54 7.764 7.529 0.235 1
1 596 . 5 1 1 A 54 54 ALA HA H 54 4.400 4.327 0.073 1
1 600 . 5 1 1 A 54 54 ALA C C 54 177.658 177.870 -0.212 1
1 601 . 5 1 1 A 54 54 ALA CA C 54 52.412 51.751 0.661 1
1 602 . 5 1 1 A 54 54 ALA CB C 54 20.739 18.351 2.388 1
1 603 . 5 1 1 A 54 54 ALA N N 54 117.678 118.658 -0.980 1
1 604 . 5 1 1 A 55 55 GLY H H 55 7.583 8.290 -0.707 1
1 605 . 5 1 1 A 55 55 GLY HA2 H 55 4.266 3.916 0.350 1
1 606 . 5 1 1 A 55 55 GLY HA3 H 55 3.775 3.920 -0.145 1
1 607 . 5 1 1 A 55 55 GLY C C 55 175.232 174.244 0.988 1
1 608 . 5 1 1 A 55 55 GLY CA C 55 45.368 45.995 -0.627 1
1 609 . 5 1 1 A 55 55 GLY N N 55 103.265 107.717 -4.452 1
1 610 . 5 1 1 A 56 56 LEU H H 56 7.280 7.874 -0.594 1
1 611 . 5 1 1 A 56 56 LEU HA H 56 3.984 4.109 -0.125 1
1 621 . 5 1 1 A 56 56 LEU C C 56 174.708 175.298 -0.590 1
1 622 . 5 1 1 A 56 56 LEU CA C 56 55.603 55.733 -0.130 1
1 623 . 5 1 1 A 56 56 LEU CB C 56 42.752 42.524 0.228 1
1 627 . 5 1 1 A 56 56 LEU N N 56 119.211 123.351 -4.140 1
1 628 . 5 1 1 A 57 57 LEU H H 57 8.693 8.533 0.160 1
1 629 . 5 1 1 A 57 57 LEU HA H 57 4.499 4.964 -0.465 1
1 639 . 5 1 1 A 57 57 LEU C C 57 176.124 175.842 0.282 1
1 640 . 5 1 1 A 57 57 LEU CA C 57 52.959 53.395 -0.436 1
1 641 . 5 1 1 A 57 57 LEU CB C 57 45.122 45.599 -0.477 1
1 645 . 5 1 1 A 57 57 LEU N N 57 121.969 128.318 -6.349 1
1 646 . 5 1 1 A 58 58 ASP H H 58 8.334 8.741 -0.407 1
1 647 . 5 1 1 A 58 58 ASP HA H 58 4.139 4.856 -0.717 1
1 650 . 5 1 1 A 58 58 ASP C C 58 178.636 176.668 1.968 1
1 651 . 5 1 1 A 58 58 ASP CA C 58 56.079 54.881 1.198 1
1 652 . 5 1 1 A 58 58 ASP CB C 58 42.135 40.667 1.468 1
1 653 . 5 1 1 A 58 58 ASP N N 58 120.401 121.632 -1.231 1
1 654 . 5 1 1 A 59 59 GLY H H 59 9.378 8.787 0.591 1
1 655 . 5 1 1 A 59 59 GLY HA2 H 59 4.317 3.940 0.377 1
1 656 . 5 1 1 A 59 59 GLY HA3 H 59 3.260 3.943 -0.683 1
1 657 . 5 1 1 A 59 59 GLY C C 59 173.359 173.919 -0.560 1
1 658 . 5 1 1 A 59 59 GLY CA C 59 45.517 44.911 0.606 1
1 659 . 5 1 1 A 59 59 GLY N N 59 116.622 111.773 4.849 1
1 660 . 5 1 1 A 60 60 ASP H H 60 8.009 8.061 -0.052 1
1 661 . 5 1 1 A 60 60 ASP HA H 60 4.638 4.678 -0.040 1
1 664 . 5 1 1 A 60 60 ASP C C 60 175.555 175.071 0.484 1
1 665 . 5 1 1 A 60 60 ASP CA C 60 55.286 54.059 1.227 1
1 666 . 5 1 1 A 60 60 ASP CB C 60 42.381 41.764 0.617 1
1 667 . 5 1 1 A 60 60 ASP N N 60 121.370 121.747 -0.377 1
1 668 . 5 1 1 A 61 61 ARG H H 61 8.648 8.634 0.014 1
1 669 . 5 1 1 A 61 61 ARG HA H 61 5.179 5.256 -0.077 1
1 677 . 5 1 1 A 61 61 ARG C C 61 177.381 174.593 2.788 1
1 678 . 5 1 1 A 61 61 ARG CA C 61 53.704 54.428 -0.724 1
1 679 . 5 1 1 A 61 61 ARG CB C 61 34.017 33.260 0.757 1
1 682 . 5 1 1 A 61 61 ARG N N 61 116.958 121.901 -4.943 1
1 684 . 5 1 1 A 62 62 VAL H H 62 8.247 8.235 0.012 1
1 685 . 5 1 1 A 62 62 VAL HA H 62 3.806 4.473 -0.667 1
1 693 . 5 1 1 A 62 62 VAL C C 62 174.748 174.876 -0.128 1
1 694 . 5 1 1 A 62 62 VAL CA C 62 63.149 61.166 1.983 1
1 695 . 5 1 1 A 62 62 VAL CB C 62 32.574 32.751 -0.177 1
1 698 . 5 1 1 A 62 62 VAL N N 62 118.546 123.237 -4.691 1
1 699 . 5 1 1 A 63 63 LEU H H 63 9.262 9.296 -0.034 1
1 700 . 5 1 1 A 63 63 LEU HA H 63 4.412 4.261 0.151 1
1 710 . 5 1 1 A 63 63 LEU C C 63 177.649 177.083 0.566 1
1 711 . 5 1 1 A 63 63 LEU CA C 63 56.044 56.367 -0.323 1
1 712 . 5 1 1 A 63 63 LEU CB C 63 43.339 42.903 0.436 1
1 716 . 5 1 1 A 63 63 LEU N N 63 125.413 130.953 -5.540 1
1 717 . 5 1 1 A 64 64 ARG H H 64 7.806 7.674 0.132 1
1 718 . 5 1 1 A 64 64 ARG HA H 64 5.704 4.747 0.957 1
1 726 . 5 1 1 A 64 64 ARG C C 64 175.091 173.997 1.094 1
1 727 . 5 1 1 A 64 64 ARG CA C 64 54.148 54.689 -0.541 1
1 728 . 5 1 1 A 64 64 ARG CB C 64 35.742 34.076 1.666 1
1 731 . 5 1 1 A 64 64 ARG N N 64 112.961 116.904 -3.943 1
1 733 . 5 1 1 A 65 65 ILE H H 65 8.327 9.182 -0.855 1
1 734 . 5 1 1 A 65 65 ILE HA H 65 4.384 4.647 -0.263 1
1 744 . 5 1 1 A 65 65 ILE C C 65 175.722 175.579 0.143 1
1 745 . 5 1 1 A 65 65 ILE CA C 65 60.501 59.392 1.109 1
1 746 . 5 1 1 A 65 65 ILE CB C 65 39.547 40.150 -0.603 1
1 750 . 5 1 1 A 65 65 ILE N N 65 119.175 123.506 -4.331 1
1 751 . 5 1 1 A 66 66 ASN H H 66 9.911 9.377 0.534 1
1 752 . 5 1 1 A 66 66 ASN HA H 66 4.428 4.383 0.045 1
1 757 . 5 1 1 A 66 66 ASN C C 66 175.349 174.591 0.758 1
1 758 . 5 1 1 A 66 66 ASN CA C 66 54.157 54.183 -0.026 1
1 759 . 5 1 1 A 66 66 ASN CB C 66 37.024 37.468 -0.444 1
1 760 . 5 1 1 A 66 66 ASN N N 66 128.952 128.012 0.940 1
1 762 . 5 1 1 A 67 67 GLY H H 67 9.230 8.554 0.676 1
1 763 . 5 1 1 A 67 67 GLY HA2 H 67 4.322 3.893 0.429 1
1 764 . 5 1 1 A 67 67 GLY HA3 H 67 3.508 3.902 -0.394 1
1 765 . 5 1 1 A 67 67 GLY C C 67 174.393 174.167 0.226 1
1 766 . 5 1 1 A 67 67 GLY CA C 67 45.341 46.024 -0.683 1
1 767 . 5 1 1 A 67 67 GLY N N 67 103.238 104.686 -1.448 1
1 768 . 5 1 1 A 68 68 VAL H H 68 8.063 8.035 0.028 1
1 769 . 5 1 1 A 68 68 VAL HA H 68 4.015 4.473 -0.458 1
1 777 . 5 1 1 A 68 68 VAL C C 68 175.833 175.111 0.722 1
1 778 . 5 1 1 A 68 68 VAL CA C 68 62.603 61.284 1.319 1
1 779 . 5 1 1 A 68 68 VAL CB C 68 32.574 34.320 -1.746 1
1 782 . 5 1 1 A 68 68 VAL N N 68 125.696 120.394 5.302 1
1 783 . 5 1 1 A 69 69 PHE H H 69 9.301 9.148 0.153 1
1 784 . 5 1 1 A 69 69 PHE HA H 69 4.947 4.569 0.378 1
1 792 . 5 1 1 A 69 69 PHE C C 69 177.120 175.831 1.289 1
1 793 . 5 1 1 A 69 69 PHE CA C 69 59.200 59.070 0.130 1
1 794 . 5 1 1 A 69 69 PHE CB C 69 39.320 39.492 -0.172 1
1 800 . 5 1 1 A 69 69 PHE N N 69 128.641 129.094 -0.453 1
1 801 . 5 1 1 A 70 70 VAL H H 70 8.312 8.219 0.093 1
1 802 . 5 1 1 A 70 70 VAL HA H 70 4.517 4.514 0.003 1
1 810 . 5 1 1 A 70 70 VAL CA C 70 60.734 60.504 0.230 1
1 811 . 5 1 1 A 70 70 VAL CB C 70 32.976 31.227 1.749 1
1 814 . 5 1 1 A 70 70 VAL N N 70 118.381 120.060 -1.679 1
1 815 . 5 1 1 A 71 71 ASP H H 71 5.373 7.343 -1.970 1
1 816 . 5 1 1 A 71 71 ASP HA H 71 4.413 4.283 0.130 1
1 819 . 5 1 1 A 71 71 ASP C C 71 174.896 177.929 -3.033 1
1 820 . 5 1 1 A 71 71 ASP CA C 71 58.334 56.783 1.551 1
1 821 . 5 1 1 A 71 71 ASP CB C 71 46.097 40.797 5.300 1
1 822 . 5 1 1 A 71 71 ASP N N 71 119.008 122.183 -3.175 1
1 823 . 5 1 1 A 72 72 LYS H H 72 7.874 7.860 0.014 1
1 824 . 5 1 1 A 72 72 LYS HA H 72 4.522 4.499 0.023 1
1 833 . 5 1 1 A 72 72 LYS C C 72 177.209 177.020 0.189 1
1 834 . 5 1 1 A 72 72 LYS CA C 72 54.122 57.556 -3.434 1
1 835 . 5 1 1 A 72 72 LYS CB C 72 31.640 33.800 -2.160 1
1 839 . 5 1 1 A 72 72 LYS N N 72 110.259 118.298 -8.039 1
1 840 . 5 1 1 A 73 73 GLU H H 73 7.421 7.832 -0.411 1
1 841 . 5 1 1 A 73 73 GLU HA H 73 4.401 4.380 0.021 1
1 846 . 5 1 1 A 73 73 GLU C C 73 176.728 176.171 0.557 1
1 847 . 5 1 1 A 73 73 GLU CA C 73 54.950 57.004 -2.054 1
1 848 . 5 1 1 A 73 73 GLU CB C 73 30.390 30.629 -0.239 1
1 850 . 5 1 1 A 73 73 GLU N N 73 120.043 119.243 0.800 1
1 851 . 5 1 1 A 74 74 GLU H H 74 9.360 8.918 0.442 1
1 852 . 5 1 1 A 74 74 GLU HA H 74 4.403 4.559 -0.156 1
1 857 . 5 1 1 A 74 74 GLU C C 74 178.234 178.086 0.148 1
1 858 . 5 1 1 A 74 74 GLU CA C 74 56.516 55.620 0.896 1
1 859 . 5 1 1 A 74 74 GLU CB C 74 30.390 30.675 -0.285 1
1 861 . 5 1 1 A 74 74 GLU N N 74 122.193 121.133 1.060 1
1 862 . 5 1 1 A 75 75 HIS H H 75 9.553 9.274 0.279 1
1 863 . 5 1 1 A 75 75 HIS HA H 75 4.080 4.248 -0.168 1
1 868 . 5 1 1 A 75 75 HIS C C 75 175.985 176.813 -0.828 1
1 869 . 5 1 1 A 75 75 HIS CA C 75 61.016 60.569 0.447 1
1 870 . 5 1 1 A 75 75 HIS CB C 75 29.468 30.591 -1.123 1
1 873 . 5 1 1 A 75 75 HIS N N 75 123.587 123.140 0.447 1
1 874 . 5 1 1 A 76 76 ALA H H 76 9.129 8.328 0.801 1
1 875 . 5 1 1 A 76 76 ALA HA H 76 3.826 3.804 0.022 1
1 879 . 5 1 1 A 76 76 ALA C C 76 180.475 179.529 0.946 1
1 880 . 5 1 1 A 76 76 ALA CA C 76 55.392 54.874 0.518 1
1 881 . 5 1 1 A 76 76 ALA CB C 76 18.182 18.142 0.040 1
1 882 . 5 1 1 A 76 76 ALA N N 76 117.795 120.922 -3.127 1
1 883 . 5 1 1 A 77 77 GLN H H 77 7.099 7.711 -0.612 1
1 884 . 5 1 1 A 77 77 GLN HA H 77 4.198 4.102 0.096 1
1 891 . 5 1 1 A 77 77 GLN C C 77 177.860 178.530 -0.670 1
1 892 . 5 1 1 A 77 77 GLN CA C 77 57.790 58.676 -0.886 1
1 893 . 5 1 1 A 77 77 GLN CB C 77 28.536 28.499 0.037 1
1 895 . 5 1 1 A 77 77 GLN N N 77 115.764 117.521 -1.757 1
1 897 . 5 1 1 A 78 78 VAL H H 78 7.430 7.429 0.001 1
1 898 . 5 1 1 A 78 78 VAL HA H 78 3.241 3.649 -0.408 1
1 906 . 5 1 1 A 78 78 VAL C C 78 177.042 177.782 -0.740 1
1 907 . 5 1 1 A 78 78 VAL CA C 78 67.299 66.129 1.170 1
1 908 . 5 1 1 A 78 78 VAL CB C 78 30.819 31.609 -0.790 1
1 911 . 5 1 1 A 78 78 VAL N N 78 121.143 120.828 0.315 1
1 912 . 5 1 1 A 79 79 VAL H H 79 7.773 8.247 -0.474 1
1 913 . 5 1 1 A 79 79 VAL HA H 79 3.315 3.645 -0.330 1
1 921 . 5 1 1 A 79 79 VAL C C 79 179.179 177.894 1.285 1
1 922 . 5 1 1 A 79 79 VAL CA C 79 66.694 65.296 1.398 1
1 923 . 5 1 1 A 79 79 VAL CB C 79 31.841 31.476 0.365 1
1 926 . 5 1 1 A 79 79 VAL N N 79 117.473 120.013 -2.540 1
1 927 . 5 1 1 A 80 80 GLU H H 80 7.410 7.458 -0.048 1
1 928 . 5 1 1 A 80 80 GLU HA H 80 4.258 4.027 0.231 1
1 933 . 5 1 1 A 80 80 GLU C C 80 178.018 179.207 -1.189 1
1 934 . 5 1 1 A 80 80 GLU CA C 80 58.566 59.012 -0.446 1
1 935 . 5 1 1 A 80 80 GLU CB C 80 29.072 29.370 -0.298 1
1 937 . 5 1 1 A 80 80 GLU N N 80 120.451 120.830 -0.379 1
1 938 . 5 1 1 A 81 81 LEU H H 81 8.070 8.294 -0.224 1
1 939 . 5 1 1 A 81 81 LEU HA H 81 3.976 4.102 -0.126 1
1 949 . 5 1 1 A 81 81 LEU C C 81 180.658 179.141 1.517 1
1 950 . 5 1 1 A 81 81 LEU CA C 81 58.061 58.140 -0.079 1
1 951 . 5 1 1 A 81 81 LEU CB C 81 42.115 41.895 0.220 1
1 955 . 5 1 1 A 81 81 LEU N N 81 119.943 120.404 -0.461 1
1 956 . 5 1 1 A 82 82 VAL H H 82 7.609 8.264 -0.655 1
1 957 . 5 1 1 A 82 82 VAL HA H 82 3.474 3.537 -0.063 1
1 965 . 5 1 1 A 82 82 VAL C C 82 178.927 178.661 0.266 1
1 966 . 5 1 1 A 82 82 VAL CA C 82 67.398 67.041 0.357 1
1 967 . 5 1 1 A 82 82 VAL CB C 82 31.306 31.523 -0.217 1
1 970 . 5 1 1 A 82 82 VAL N N 82 118.150 118.362 -0.212 1
1 971 . 5 1 1 A 83 83 ARG H H 83 8.186 7.756 0.430 1
1 972 . 5 1 1 A 83 83 ARG HA H 83 3.994 4.019 -0.025 1
1 979 . 5 1 1 A 83 83 ARG C C 83 179.999 179.016 0.983 1
1 980 . 5 1 1 A 83 83 ARG CA C 83 60.205 59.992 0.213 1
1 981 . 5 1 1 A 83 83 ARG CB C 83 30.103 29.819 0.284 1
1 984 . 5 1 1 A 83 83 ARG N N 83 122.902 119.942 2.960 1
1 985 . 5 1 1 A 84 84 LYS H H 84 8.772 8.067 0.705 1
1 986 . 5 1 1 A 84 84 LYS HA H 84 4.047 4.091 -0.044 1
1 995 . 5 1 1 A 84 84 LYS C C 84 176.934 178.829 -1.895 1
1 996 . 5 1 1 A 84 84 LYS CA C 84 58.142 58.984 -0.842 1
1 997 . 5 1 1 A 84 84 LYS CB C 84 32.492 31.769 0.723 1
1 1001 . 5 1 1 A 84 84 LYS N N 84 117.548 118.508 -0.960 1
1 1002 . 5 1 1 A 85 85 SER H H 85 7.333 8.287 -0.954 1
1 1003 . 5 1 1 A 85 85 SER HA H 85 4.235 4.221 0.014 1
1 1006 . 5 1 1 A 85 85 SER C C 85 175.588 175.194 0.394 1
1 1007 . 5 1 1 A 85 85 SER CA C 85 59.535 61.467 -1.932 1
1 1008 . 5 1 1 A 85 85 SER CB C 85 63.571 63.863 -0.292 1
1 1009 . 5 1 1 A 85 85 SER N N 85 113.544 115.793 -2.249 1
1 1010 . 5 1 1 A 86 86 GLY H H 86 7.459 7.295 0.164 1
1 1011 . 5 1 1 A 86 86 GLY HA2 H 86 4.176 4.103 0.073 1
1 1012 . 5 1 1 A 86 86 GLY HA3 H 86 3.762 4.106 -0.344 1
1 1013 . 5 1 1 A 86 86 GLY C C 86 176.407 175.343 1.064 1
1 1014 . 5 1 1 A 86 86 GLY CA C 86 46.109 43.987 2.122 1
1 1015 . 5 1 1 A 86 86 GLY N N 86 104.331 106.669 -2.338 1
1 1016 . 5 1 1 A 87 87 ASN HA H 87 4.650 4.452 0.198 1
1 1021 . 5 1 1 A 87 87 ASN C C 87 173.653 176.033 -2.380 1
1 1022 . 5 1 1 A 87 87 ASN CA C 87 54.492 55.762 -1.270 1
1 1023 . 5 1 1 A 87 87 ASN CB C 87 38.425 38.276 0.149 1
1 1024 . 5 1 1 A 87 87 ASN N N 87 118.401 120.377 -1.976 1
1 1026 . 5 1 1 A 88 88 SER H H 88 7.435 7.943 -0.508 1
1 1027 . 5 1 1 A 88 88 SER HA H 88 5.438 5.276 0.162 1
1 1030 . 5 1 1 A 88 88 SER C C 88 172.867 173.760 -0.893 1
1 1031 . 5 1 1 A 88 88 SER CA C 88 58.160 56.874 1.286 1
1 1032 . 5 1 1 A 88 88 SER CB C 88 65.861 64.645 1.216 1
1 1033 . 5 1 1 A 88 88 SER N N 88 113.765 112.072 1.693 1
1 1034 . 5 1 1 A 89 89 VAL H H 89 8.452 9.135 -0.683 1
1 1035 . 5 1 1 A 89 89 VAL HA H 89 4.519 5.067 -0.548 1
1 1043 . 5 1 1 A 89 89 VAL C C 89 171.391 174.449 -3.058 1
1 1044 . 5 1 1 A 89 89 VAL CA C 89 61.333 60.336 0.997 1
1 1045 . 5 1 1 A 89 89 VAL CB C 89 33.897 35.453 -1.556 1
1 1048 . 5 1 1 A 89 89 VAL N N 89 120.001 125.420 -5.419 1
1 1049 . 5 1 1 A 90 90 THR H H 90 8.348 8.659 -0.311 1
1 1050 . 5 1 1 A 90 90 THR HA H 90 5.042 5.031 0.011 1
1 1055 . 5 1 1 A 90 90 THR C C 90 173.926 173.413 0.513 1
1 1056 . 5 1 1 A 90 90 THR CA C 90 61.403 61.336 0.067 1
1 1057 . 5 1 1 A 90 90 THR CB C 90 69.553 70.701 -1.148 1
1 1059 . 5 1 1 A 90 90 THR N N 90 123.477 122.899 0.578 1
1 1060 . 5 1 1 A 91 91 LEU H H 91 9.195 8.356 0.839 1
1 1061 . 5 1 1 A 91 91 LEU HA H 91 5.161 4.889 0.272 1
1 1071 . 5 1 1 A 91 91 LEU C C 91 174.564 175.395 -0.831 1
1 1072 . 5 1 1 A 91 91 LEU CA C 91 52.590 53.668 -1.078 1
1 1073 . 5 1 1 A 91 91 LEU CB C 91 44.998 46.258 -1.260 1
1 1077 . 5 1 1 A 91 91 LEU N N 91 128.419 125.007 3.412 1
1 1078 . 5 1 1 A 92 92 LEU H H 92 8.644 8.515 0.129 1
1 1079 . 5 1 1 A 92 92 LEU HA H 92 5.335 5.215 0.120 1
1 1089 . 5 1 1 A 92 92 LEU C C 92 176.451 175.752 0.699 1
1 1090 . 5 1 1 A 92 92 LEU CA C 92 54.220 54.223 -0.003 1
1 1091 . 5 1 1 A 92 92 LEU CB C 92 44.323 42.988 1.335 1
1 1095 . 5 1 1 A 92 92 LEU N N 92 125.894 123.356 2.538 1
1 1096 . 5 1 1 A 93 93 VAL H H 93 9.249 9.320 -0.071 1
1 1097 . 5 1 1 A 93 93 VAL HA H 93 5.573 5.198 0.375 1
1 1105 . 5 1 1 A 93 93 VAL C C 93 173.550 174.193 -0.643 1
1 1106 . 5 1 1 A 93 93 VAL CA C 93 58.340 60.206 -1.866 1
1 1107 . 5 1 1 A 93 93 VAL CB C 93 36.159 33.459 2.700 1
1 1110 . 5 1 1 A 93 93 VAL N N 93 120.660 120.806 -0.146 1
1 1111 . 5 1 1 A 94 94 LEU H H 94 8.634 8.392 0.242 1
1 1112 . 5 1 1 A 94 94 LEU HA H 94 4.911 5.171 -0.260 1
1 1122 . 5 1 1 A 94 94 LEU C C 94 174.172 174.219 -0.047 1
1 1123 . 5 1 1 A 94 94 LEU CA C 94 52.659 53.285 -0.626 1
1 1124 . 5 1 1 A 94 94 LEU CB C 94 47.910 46.183 1.727 1
1 1128 . 5 1 1 A 94 94 LEU N N 94 120.304 126.700 -6.396 1
1 1129 . 5 1 1 A 95 95 ASP H H 95 8.210 8.683 -0.473 1
1 1130 . 5 1 1 A 95 95 ASP HA H 95 5.190 4.709 0.481 1
1 1133 . 5 1 1 A 95 95 ASP C C 95 175.887 177.669 -1.782 1
1 1134 . 5 1 1 A 95 95 ASP CA C 95 53.899 54.415 -0.516 1
1 1135 . 5 1 1 A 95 95 ASP CB C 95 41.188 42.538 -1.350 1
1 1136 . 5 1 1 A 95 95 ASP N N 95 122.184 123.570 -1.386 1
1 1137 . 5 1 1 A 96 96 GLY H H 96 8.478 8.821 -0.343 1
1 1138 . 5 1 1 A 96 96 GLY HA2 H 96 4.002 3.813 0.189 1
1 1139 . 5 1 1 A 96 96 GLY HA3 H 96 3.757 3.817 -0.060 1
1 1140 . 5 1 1 A 96 96 GLY C C 96 175.497 175.497 0.000 1
1 1141 . 5 1 1 A 96 96 GLY CA C 96 49.944 47.335 2.609 1
1 1142 . 5 1 1 A 96 96 GLY N N 96 108.610 112.008 -3.398 1
1 1143 . 5 1 1 A 97 97 ASP H H 97 8.401 8.204 0.197 1
1 1144 . 5 1 1 A 97 97 ASP HA H 97 4.454 4.345 0.109 1
1 1147 . 5 1 1 A 97 97 ASP C C 97 179.612 178.585 1.027 1
1 1148 . 5 1 1 A 97 97 ASP CA C 97 57.913 57.359 0.554 1
1 1149 . 5 1 1 A 97 97 ASP CB C 97 41.145 40.353 0.792 1
1 1150 . 5 1 1 A 97 97 ASP N N 97 120.034 121.574 -1.540 1
1 1151 . 5 1 1 A 98 98 SER H H 98 8.152 8.103 0.049 1
1 1152 . 5 1 1 A 98 98 SER HA H 98 4.218 4.142 0.076 1
1 1155 . 5 1 1 A 98 98 SER C C 98 175.061 176.322 -1.261 1
1 1156 . 5 1 1 A 98 98 SER CA C 98 62.180 61.562 0.618 1
1 1157 . 5 1 1 A 98 98 SER CB C 98 62.179 62.892 -0.713 1
1 1158 . 5 1 1 A 98 98 SER N N 98 117.174 113.930 3.244 1
1 1159 . 5 1 1 A 99 99 TYR H H 99 9.051 8.299 0.752 1
1 1160 . 5 1 1 A 99 99 TYR HA H 99 3.692 3.835 -0.143 1
1 1167 . 5 1 1 A 99 99 TYR C C 99 176.460 176.993 -0.533 1
1 1168 . 5 1 1 A 99 99 TYR CA C 99 62.814 61.937 0.877 1
1 1169 . 5 1 1 A 99 99 TYR CB C 99 38.829 38.687 0.142 1
1 1174 . 5 1 1 A 99 99 TYR N N 99 123.539 122.594 0.945 1
1 1175 . 5 1 1 A 100 100 GLU H H 100 8.520 8.334 0.186 1
1 1176 . 5 1 1 A 100 100 GLU HA H 100 3.952 4.076 -0.124 1
1 1181 . 5 1 1 A 100 100 GLU C C 100 180.151 179.134 1.017 1
1 1182 . 5 1 1 A 100 100 GLU CA C 100 60.099 59.805 0.294 1
1 1183 . 5 1 1 A 100 100 GLU CB C 100 29.435 29.491 -0.056 1
1 1185 . 5 1 1 A 100 100 GLU N N 100 117.082 118.410 -1.328 1
1 1186 . 5 1 1 A 101 101 LYS H H 101 7.740 8.053 -0.313 1
1 1187 . 5 1 1 A 101 101 LYS HA H 101 3.984 4.111 -0.127 1
1 1196 . 5 1 1 A 101 101 LYS C C 101 178.377 178.522 -0.145 1
1 1197 . 5 1 1 A 101 101 LYS CA C 101 59.888 59.456 0.432 1
1 1198 . 5 1 1 A 101 101 LYS CB C 101 32.821 32.304 0.517 1
1 1202 . 5 1 1 A 101 101 LYS N N 101 119.851 120.659 -0.808 1
1 1203 . 5 1 1 A 102 102 ALA H H 102 8.538 8.174 0.364 1
1 1204 . 5 1 1 A 102 102 ALA HA H 102 3.632 4.166 -0.534 1
1 1208 . 5 1 1 A 102 102 ALA C C 102 179.870 179.515 0.355 1
1 1209 . 5 1 1 A 102 102 ALA CA C 102 55.285 55.115 0.170 1
1 1210 . 5 1 1 A 102 102 ALA CB C 102 17.163 18.468 -1.305 1
1 1211 . 5 1 1 A 102 102 ALA N N 102 124.176 121.516 2.660 1
1 1212 . 5 1 1 A 103 103 VAL H H 103 8.147 8.013 0.134 1
1 1213 . 5 1 1 A 103 103 VAL HA H 103 3.658 3.690 -0.032 1
1 1221 . 5 1 1 A 103 103 VAL C C 103 181.113 177.466 3.647 1
1 1222 . 5 1 1 A 103 103 VAL CA C 103 66.090 65.181 0.909 1
1 1223 . 5 1 1 A 103 103 VAL CB C 103 31.822 31.369 0.453 1
1 1226 . 5 1 1 A 103 103 VAL N N 103 117.841 117.086 0.755 1
1 1227 . 5 1 1 A 104 104 LYS H H 104 7.903 7.501 0.402 1
1 1228 . 5 1 1 A 104 104 LYS HA H 104 4.065 4.029 0.036 1
1 1235 . 5 1 1 A 104 104 LYS C C 104 177.715 178.164 -0.449 1
1 1236 . 5 1 1 A 104 104 LYS CA C 104 59.094 59.560 -0.466 1
1 1237 . 5 1 1 A 104 104 LYS CB C 104 32.285 32.471 -0.186 1
1 1241 . 5 1 1 A 104 104 LYS N N 104 121.515 121.817 -0.302 1
1 1242 . 5 1 1 A 105 105 ASN H H 105 7.747 8.012 -0.265 1
1 1243 . 5 1 1 A 105 105 ASN HA H 105 4.721 4.848 -0.127 1
1 1248 . 5 1 1 A 105 105 ASN C C 105 173.320 173.932 -0.612 1
1 1249 . 5 1 1 A 105 105 ASN CA C 105 53.399 53.048 0.351 1
1 1250 . 5 1 1 A 105 105 ASN CB C 105 39.249 38.515 0.734 1
1 1251 . 5 1 1 A 105 105 ASN N N 105 114.941 114.873 0.068 1
1 1253 . 5 1 1 A 106 106 GLN H H 106 7.850 7.930 -0.080 1
1 1254 . 5 1 1 A 106 106 GLN HA H 106 3.902 3.835 0.067 1
1 1261 . 5 1 1 A 106 106 GLN C C 106 175.168 175.068 0.100 1
1 1262 . 5 1 1 A 106 106 GLN CA C 106 56.978 56.786 0.192 1
1 1263 . 5 1 1 A 106 106 GLN CB C 106 25.770 26.685 -0.915 1
1 1265 . 5 1 1 A 106 106 GLN N N 106 114.989 115.575 -0.586 1
1 1267 . 5 1 1 A 107 107 VAL H H 107 8.005 7.729 0.276 1
1 1268 . 5 1 1 A 107 107 VAL HA H 107 3.664 4.027 -0.363 1
1 1276 . 5 1 1 A 107 107 VAL C C 107 175.468 175.028 0.440 1
1 1277 . 5 1 1 A 107 107 VAL CA C 107 62.726 62.436 0.290 1
1 1278 . 5 1 1 A 107 107 VAL CB C 107 32.535 31.978 0.557 1
1 1281 . 5 1 1 A 107 107 VAL N N 107 120.216 120.158 0.058 1
1 1282 . 5 1 1 A 108 108 ASP H H 108 8.484 8.746 -0.262 1
1 1283 . 5 1 1 A 108 108 ASP HA H 108 4.467 4.552 -0.085 1
1 1286 . 5 1 1 A 108 108 ASP C C 108 177.179 176.190 0.989 1
1 1287 . 5 1 1 A 108 108 ASP CA C 108 53.417 54.963 -1.546 1
1 1288 . 5 1 1 A 108 108 ASP CB C 108 40.030 41.159 -1.129 1
1 1289 . 5 1 1 A 108 108 ASP N N 108 125.414 127.331 -1.917 1
1 1290 . 5 1 1 A 109 109 LEU H H 109 8.470 8.284 0.186 1
1 1291 . 5 1 1 A 109 109 LEU HA H 109 3.846 4.428 -0.582 1
1 1301 . 5 1 1 A 109 109 LEU C C 109 178.145 178.217 -0.072 1
1 1302 . 5 1 1 A 109 109 LEU CA C 109 56.573 55.093 1.480 1
1 1303 . 5 1 1 A 109 109 LEU CB C 109 42.011 42.573 -0.562 1
1 1307 . 5 1 1 A 109 109 LEU N N 109 127.577 124.816 2.761 1
1 1308 . 5 1 1 A 110 110 LYS H H 110 8.062 7.883 0.179 1
1 1309 . 5 1 1 A 110 110 LYS HA H 110 3.022 3.505 -0.483 1
1 1317 . 5 1 1 A 110 110 LYS C C 110 177.248 179.187 -1.939 1
1 1318 . 5 1 1 A 110 110 LYS CA C 110 58.742 59.066 -0.324 1
1 1319 . 5 1 1 A 110 110 LYS CB C 110 31.667 31.403 0.264 1
1 1323 . 5 1 1 A 110 110 LYS N N 110 118.873 119.896 -1.023 1
1 1324 . 5 1 1 A 111 111 GLU H H 111 7.113 7.828 -0.715 1
1 1325 . 5 1 1 A 111 111 GLU HA H 111 4.117 4.162 -0.045 1
1 1330 . 5 1 1 A 111 111 GLU C C 111 176.519 177.653 -1.134 1
1 1331 . 5 1 1 A 111 111 GLU CA C 111 55.621 59.236 -3.615 1
1 1332 . 5 1 1 A 111 111 GLU CB C 111 29.943 29.861 0.082 1
1 1334 . 5 1 1 A 111 111 GLU N N 111 114.282 118.413 -4.131 1
1 1335 . 5 1 1 A 112 112 LEU H H 112 6.848 7.415 -0.567 1
1 1336 . 5 1 1 A 112 112 LEU HA H 112 4.293 4.197 0.096 1
1 1346 . 5 1 1 A 112 112 LEU C C 112 175.674 175.997 -0.323 1
1 1347 . 5 1 1 A 112 112 LEU CA C 112 55.197 55.574 -0.377 1
1 1348 . 5 1 1 A 112 112 LEU CB C 112 41.681 41.257 0.424 1
1 1352 . 5 1 1 A 112 112 LEU N N 112 118.934 122.482 -3.548 1
1 1353 . 5 1 1 A 113 113 ASP H H 113 8.466 8.638 -0.172 1
1 1354 . 5 1 1 A 113 113 ASP HA H 113 4.593 5.101 -0.508 1
1 1357 . 5 1 1 A 113 113 ASP C C 113 174.511 176.025 -1.514 1
1 1358 . 5 1 1 A 113 113 ASP CA C 113 53.558 52.689 0.869 1
1 1359 . 5 1 1 A 113 113 ASP CB C 113 42.448 41.346 1.102 1
1 1360 . 5 1 1 A 113 113 ASP N N 113 122.148 125.635 -3.487 1
1 1 . 6 1 1 A 6 6 SER HA H 6 4.483 4.508 -0.025 1
1 4 . 6 1 1 A 6 6 SER C C 6 175.167 174.415 0.752 1
1 5 . 6 1 1 A 6 6 SER CA C 6 58.759 58.758 0.001 1
1 6 . 6 1 1 A 6 6 SER CB C 6 64.069 64.537 -0.468 1
1 7 . 6 1 1 A 7 7 GLY H H 7 8.431 7.596 0.835 1
1 8 . 6 1 1 A 7 7 GLY HA2 H 7 3.973 4.091 -0.118 1
1 9 . 6 1 1 A 7 7 GLY HA3 H 7 3.973 4.094 -0.121 1
1 10 . 6 1 1 A 7 7 GLY C C 7 174.570 174.887 -0.317 1
1 11 . 6 1 1 A 7 7 GLY CA C 7 45.483 44.693 0.790 1
1 12 . 6 1 1 A 7 7 GLY N N 7 110.640 108.560 2.080 1
1 13 . 6 1 1 A 8 8 MET H H 8 8.239 8.685 -0.446 1
1 14 . 6 1 1 A 8 8 MET HA H 8 4.386 4.508 -0.122 1
1 22 . 6 1 1 A 8 8 MET C C 8 176.621 176.474 0.147 1
1 23 . 6 1 1 A 8 8 MET CA C 8 55.991 57.913 -1.922 1
1 24 . 6 1 1 A 8 8 MET CB C 8 32.986 33.454 -0.468 1
1 27 . 6 1 1 A 8 8 MET N N 8 120.219 120.744 -0.525 1
1 28 . 6 1 1 A 9 9 ALA H H 9 8.435 7.673 0.762 1
1 29 . 6 1 1 A 9 9 ALA HA H 9 4.182 4.408 -0.226 1
1 33 . 6 1 1 A 9 9 ALA C C 9 177.951 176.480 1.471 1
1 34 . 6 1 1 A 9 9 ALA CA C 9 53.399 51.847 1.552 1
1 35 . 6 1 1 A 9 9 ALA CB C 9 18.955 20.558 -1.603 1
1 36 . 6 1 1 A 9 9 ALA N N 9 124.459 121.263 3.196 1
1 37 . 6 1 1 A 10 10 SER H H 10 8.100 8.414 -0.314 1
1 38 . 6 1 1 A 10 10 SER HA H 10 4.391 5.463 -1.072 1
1 41 . 6 1 1 A 10 10 SER C C 10 174.467 172.990 1.477 1
1 42 . 6 1 1 A 10 10 SER CA C 10 58.709 56.893 1.816 1
1 43 . 6 1 1 A 10 10 SER CB C 10 63.778 66.516 -2.738 1
1 44 . 6 1 1 A 10 10 SER N N 10 113.881 116.264 -2.383 1
1 45 . 6 1 1 A 11 11 THR H H 11 7.821 8.693 -0.872 1
1 46 . 6 1 1 A 11 11 THR HA H 11 4.191 5.025 -0.834 1
1 51 . 6 1 1 A 11 11 THR C C 11 173.610 172.990 0.620 1
1 52 . 6 1 1 A 11 11 THR CA C 11 61.936 60.090 1.846 1
1 53 . 6 1 1 A 11 11 THR CB C 11 69.713 72.072 -2.359 1
1 55 . 6 1 1 A 11 11 THR N N 11 114.471 111.665 2.806 1
1 56 . 6 1 1 A 12 12 PHE H H 12 7.946 9.156 -1.210 1
1 57 . 6 1 1 A 12 12 PHE HA H 12 4.769 4.783 -0.014 1
1 65 . 6 1 1 A 12 12 PHE C C 12 174.211 175.532 -1.321 1
1 66 . 6 1 1 A 12 12 PHE CA C 12 56.644 58.173 -1.529 1
1 67 . 6 1 1 A 12 12 PHE CB C 12 40.609 39.657 0.952 1
1 73 . 6 1 1 A 12 12 PHE N N 12 120.763 123.540 -2.777 1
1 74 . 6 1 1 A 13 13 ASN H H 13 9.004 9.153 -0.149 1
1 75 . 6 1 1 A 13 13 ASN HA H 13 5.366 5.459 -0.093 1
1 80 . 6 1 1 A 13 13 ASN C C 13 172.158 174.348 -2.190 1
1 81 . 6 1 1 A 13 13 ASN CA C 13 50.988 50.708 0.280 1
1 82 . 6 1 1 A 13 13 ASN CB C 13 39.942 38.684 1.258 1
1 83 . 6 1 1 A 13 13 ASN N N 13 119.973 117.899 2.074 1
1 85 . 6 1 1 A 14 14 PRO HA H 14 4.945 4.645 0.300 1
1 92 . 6 1 1 A 14 14 PRO C C 14 174.901 175.542 -0.641 1
1 93 . 6 1 1 A 14 14 PRO CA C 14 63.096 62.371 0.725 1
1 94 . 6 1 1 A 14 14 PRO CB C 14 32.739 32.840 -0.101 1
1 97 . 6 1 1 A 15 15 ARG H H 15 8.908 8.341 0.567 1
1 98 . 6 1 1 A 15 15 ARG HA H 15 4.626 4.723 -0.097 1
1 106 . 6 1 1 A 15 15 ARG C C 15 174.432 174.209 0.223 1
1 107 . 6 1 1 A 15 15 ARG CA C 15 54.827 55.092 -0.265 1
1 108 . 6 1 1 A 15 15 ARG CB C 15 32.439 33.758 -1.319 1
1 111 . 6 1 1 A 15 15 ARG N N 15 118.947 121.773 -2.826 1
1 113 . 6 1 1 A 16 16 GLU H H 16 8.838 8.832 0.006 1
1 114 . 6 1 1 A 16 16 GLU HA H 16 4.876 4.990 -0.114 1
1 119 . 6 1 1 A 16 16 GLU C C 16 175.767 175.387 0.380 1
1 120 . 6 1 1 A 16 16 GLU CA C 16 55.621 55.218 0.403 1
1 121 . 6 1 1 A 16 16 GLU CB C 16 31.093 31.533 -0.440 1
1 123 . 6 1 1 A 16 16 GLU N N 16 125.316 127.232 -1.916 1
1 124 . 6 1 1 A 17 17 CYS H H 17 9.327 9.047 0.280 1
1 125 . 6 1 1 A 17 17 CYS HA H 17 4.804 5.148 -0.344 1
1 128 . 6 1 1 A 17 17 CYS C C 17 172.973 173.537 -0.564 1
1 129 . 6 1 1 A 17 17 CYS CA C 17 57.930 57.645 0.285 1
1 130 . 6 1 1 A 17 17 CYS CB C 17 30.105 29.855 0.250 1
1 131 . 6 1 1 A 17 17 CYS N N 17 127.909 125.100 2.809 1
1 132 . 6 1 1 A 18 18 LYS H H 18 9.022 8.922 0.100 1
1 133 . 6 1 1 A 18 18 LYS HA H 18 4.769 4.735 0.034 1
1 142 . 6 1 1 A 18 18 LYS C C 18 174.586 175.535 -0.949 1
1 143 . 6 1 1 A 18 18 LYS CA C 18 55.956 55.023 0.933 1
1 144 . 6 1 1 A 18 18 LYS CB C 18 32.203 33.426 -1.223 1
1 148 . 6 1 1 A 18 18 LYS N N 18 127.039 124.448 2.591 1
1 149 . 6 1 1 A 19 19 LEU H H 19 8.784 8.578 0.206 1
1 150 . 6 1 1 A 19 19 LEU HA H 19 4.852 4.494 0.358 1
1 160 . 6 1 1 A 19 19 LEU C C 19 176.862 176.593 0.269 1
1 161 . 6 1 1 A 19 19 LEU CA C 19 55.391 54.741 0.650 1
1 162 . 6 1 1 A 19 19 LEU CB C 19 44.442 42.089 2.353 1
1 166 . 6 1 1 A 19 19 LEU N N 19 126.311 126.151 0.160 1
1 167 . 6 1 1 A 20 20 SER H H 20 8.215 8.831 -0.616 1
1 168 . 6 1 1 A 20 20 SER HA H 20 5.461 5.576 -0.115 1
1 171 . 6 1 1 A 20 20 SER C C 20 171.960 173.472 -1.512 1
1 172 . 6 1 1 A 20 20 SER CA C 20 57.525 56.525 1.000 1
1 173 . 6 1 1 A 20 20 SER CB C 20 65.794 65.433 0.361 1
1 174 . 6 1 1 A 20 20 SER N N 20 115.113 117.158 -2.045 1
1 175 . 6 1 1 A 21 21 LYS H H 21 9.001 8.804 0.197 1
1 176 . 6 1 1 A 21 21 LYS HA H 21 4.887 5.012 -0.125 1
1 185 . 6 1 1 A 21 21 LYS C C 21 174.133 175.078 -0.945 1
1 186 . 6 1 1 A 21 21 LYS CA C 21 53.840 54.001 -0.161 1
1 187 . 6 1 1 A 21 21 LYS CB C 21 36.553 35.894 0.659 1
1 191 . 6 1 1 A 21 21 LYS N N 21 120.938 121.368 -0.430 1
1 192 . 6 1 1 A 22 22 GLN H H 22 8.201 8.014 0.187 1
1 193 . 6 1 1 A 22 22 GLN HA H 22 4.448 4.620 -0.172 1
1 200 . 6 1 1 A 22 22 GLN C C 22 176.372 175.564 0.808 1
1 201 . 6 1 1 A 22 22 GLN CA C 22 53.658 54.166 -0.508 1
1 202 . 6 1 1 A 22 22 GLN CB C 22 30.473 30.468 0.005 1
1 204 . 6 1 1 A 22 22 GLN N N 22 116.816 118.876 -2.060 1
1 206 . 6 1 1 A 23 23 GLU H H 23 8.624 8.721 -0.097 1
1 207 . 6 1 1 A 23 23 GLU HA H 23 4.056 3.843 0.213 1
1 212 . 6 1 1 A 23 23 GLU C C 23 177.778 177.427 0.351 1
1 213 . 6 1 1 A 23 23 GLU CA C 23 58.001 58.306 -0.305 1
1 214 . 6 1 1 A 23 23 GLU CB C 23 29.237 29.279 -0.042 1
1 216 . 6 1 1 A 23 23 GLU N N 23 122.364 122.869 -0.505 1
1 217 . 6 1 1 A 24 24 GLY H H 24 8.962 8.783 0.179 1
1 218 . 6 1 1 A 24 24 GLY HA2 H 24 4.139 3.885 0.254 1
1 219 . 6 1 1 A 24 24 GLY HA3 H 24 3.711 3.890 -0.179 1
1 220 . 6 1 1 A 24 24 GLY C C 24 173.857 173.568 0.289 1
1 221 . 6 1 1 A 24 24 GLY CA C 24 45.288 45.489 -0.201 1
1 222 . 6 1 1 A 24 24 GLY N N 24 113.942 114.717 -0.775 1
1 223 . 6 1 1 A 25 25 GLN H H 25 7.643 7.613 0.030 1
1 224 . 6 1 1 A 25 25 GLN HA H 25 4.488 4.654 -0.166 1
1 231 . 6 1 1 A 25 25 GLN C C 25 174.727 174.688 0.039 1
1 232 . 6 1 1 A 25 25 GLN CA C 25 54.052 54.097 -0.045 1
1 233 . 6 1 1 A 25 25 GLN CB C 25 30.843 31.331 -0.488 1
1 235 . 6 1 1 A 25 25 GLN N N 25 119.538 119.802 -0.264 1
1 237 . 6 1 1 A 26 26 ASN H H 26 8.625 8.888 -0.263 1
1 238 . 6 1 1 A 26 26 ASN HA H 26 4.862 4.739 0.123 1
1 243 . 6 1 1 A 26 26 ASN C C 26 176.261 175.020 1.241 1
1 244 . 6 1 1 A 26 26 ASN CA C 26 51.812 53.366 -1.554 1
1 245 . 6 1 1 A 26 26 ASN CB C 26 40.403 39.735 0.668 1
1 246 . 6 1 1 A 26 26 ASN N N 26 120.047 125.044 -4.997 1
1 248 . 6 1 1 A 27 27 TYR HA H 27 4.152 4.607 -0.455 1
1 255 . 6 1 1 A 27 27 TYR C C 27 176.731 175.812 0.919 1
1 256 . 6 1 1 A 27 27 TYR CA C 27 62.462 59.720 2.742 1
1 257 . 6 1 1 A 27 27 TYR CB C 27 40.240 39.673 0.567 1
1 262 . 6 1 1 A 27 27 TYR N N 27 121.761 121.696 0.065 1
1 263 . 6 1 1 A 28 28 GLY H H 28 8.285 7.788 0.497 1
1 264 . 6 1 1 A 28 28 GLY HA2 H 28 4.490 3.939 0.551 1
1 265 . 6 1 1 A 28 28 GLY HA3 H 28 3.759 4.029 -0.270 1
1 266 . 6 1 1 A 28 28 GLY C C 28 172.198 174.069 -1.871 1
1 267 . 6 1 1 A 28 28 GLY CA C 28 46.139 45.306 0.833 1
1 268 . 6 1 1 A 28 28 GLY N N 28 103.567 107.132 -3.565 1
1 269 . 6 1 1 A 29 29 PHE H H 29 6.878 7.828 -0.950 1
1 270 . 6 1 1 A 29 29 PHE HA H 29 5.179 4.879 0.300 1
1 278 . 6 1 1 A 29 29 PHE C C 29 172.840 173.752 -0.912 1
1 279 . 6 1 1 A 29 29 PHE CA C 29 55.262 55.017 0.245 1
1 280 . 6 1 1 A 29 29 PHE CB C 29 41.779 42.271 -0.492 1
1 286 . 6 1 1 A 29 29 PHE N N 29 111.027 117.461 -6.434 1
1 287 . 6 1 1 A 30 30 PHE H H 30 8.806 8.574 0.232 1
1 288 . 6 1 1 A 30 30 PHE HA H 30 4.923 4.664 0.259 1
1 296 . 6 1 1 A 30 30 PHE C C 30 174.501 175.287 -0.786 1
1 297 . 6 1 1 A 30 30 PHE CA C 30 55.356 56.036 -0.680 1
1 298 . 6 1 1 A 30 30 PHE CB C 30 41.681 42.213 -0.532 1
1 304 . 6 1 1 A 30 30 PHE N N 30 118.710 118.071 0.639 1
1 305 . 6 1 1 A 31 31 LEU H H 31 8.441 8.770 -0.329 1
1 306 . 6 1 1 A 31 31 LEU HA H 31 5.447 4.858 0.589 1
1 316 . 6 1 1 A 31 31 LEU C C 31 177.306 175.835 1.471 1
1 317 . 6 1 1 A 31 31 LEU CA C 31 53.610 54.453 -0.843 1
1 318 . 6 1 1 A 31 31 LEU CB C 31 43.696 41.051 2.645 1
1 322 . 6 1 1 A 31 31 LEU N N 31 123.765 124.380 -0.615 1
1 323 . 6 1 1 A 32 32 ARG H H 32 9.381 8.844 0.537 1
1 324 . 6 1 1 A 32 32 ARG HA H 32 4.840 4.717 0.123 1
1 331 . 6 1 1 A 32 32 ARG C C 32 175.155 175.823 -0.668 1
1 332 . 6 1 1 A 32 32 ARG CA C 32 54.210 54.528 -0.318 1
1 333 . 6 1 1 A 32 32 ARG CB C 32 35.087 32.914 2.173 1
1 336 . 6 1 1 A 32 32 ARG N N 32 123.160 124.425 -1.265 1
1 337 . 6 1 1 A 33 33 ILE H H 33 7.891 8.728 -0.837 1
1 338 . 6 1 1 A 33 33 ILE HA H 33 4.495 4.667 -0.172 1
1 348 . 6 1 1 A 33 33 ILE C C 33 175.850 174.106 1.744 1
1 349 . 6 1 1 A 33 33 ILE CA C 33 59.641 59.316 0.325 1
1 350 . 6 1 1 A 33 33 ILE CB C 33 39.538 39.265 0.273 1
1 354 . 6 1 1 A 33 33 ILE N N 33 118.924 119.678 -0.754 1
1 355 . 6 1 1 A 34 34 GLU H H 34 8.971 8.719 0.252 1
1 356 . 6 1 1 A 34 34 GLU HA H 34 4.578 5.019 -0.441 1
1 361 . 6 1 1 A 34 34 GLU C C 34 175.766 175.593 0.173 1
1 362 . 6 1 1 A 34 34 GLU CA C 34 54.263 54.449 -0.186 1
1 363 . 6 1 1 A 34 34 GLU CB C 34 32.128 33.312 -1.184 1
1 365 . 6 1 1 A 34 34 GLU N N 34 125.447 122.632 2.815 1
1 366 . 6 1 1 A 35 35 LYS H H 35 8.504 8.659 -0.155 1
1 367 . 6 1 1 A 35 35 LYS HA H 35 4.026 3.972 0.054 1
1 376 . 6 1 1 A 35 35 LYS C C 35 177.701 176.451 1.250 1
1 377 . 6 1 1 A 35 35 LYS CA C 35 57.591 56.703 0.888 1
1 378 . 6 1 1 A 35 35 LYS CB C 35 32.491 32.776 -0.285 1
1 382 . 6 1 1 A 35 35 LYS N N 35 122.893 125.780 -2.887 1
1 383 . 6 1 1 A 36 36 ASP H H 36 9.020 9.017 0.003 1
1 384 . 6 1 1 A 36 36 ASP HA H 36 4.385 4.172 0.213 1
1 387 . 6 1 1 A 36 36 ASP C C 36 174.554 174.636 -0.082 1
1 388 . 6 1 1 A 36 36 ASP CA C 36 55.868 55.248 0.620 1
1 389 . 6 1 1 A 36 36 ASP CB C 36 39.826 39.633 0.193 1
1 390 . 6 1 1 A 36 36 ASP N N 36 121.412 119.097 2.315 1
1 391 . 6 1 1 A 37 37 THR H H 37 7.464 7.446 0.018 1
1 392 . 6 1 1 A 37 37 THR HA H 37 4.454 4.863 -0.409 1
1 397 . 6 1 1 A 37 37 THR C C 37 172.012 172.876 -0.864 1
1 398 . 6 1 1 A 37 37 THR CA C 37 61.686 60.915 0.771 1
1 399 . 6 1 1 A 37 37 THR CB C 37 70.927 72.717 -1.790 1
1 401 . 6 1 1 A 37 37 THR N N 37 113.147 112.239 0.908 1
1 402 . 6 1 1 A 38 38 ASP H H 38 8.931 8.771 0.160 1
1 403 . 6 1 1 A 38 38 ASP HA H 38 4.852 4.894 -0.042 1
1 406 . 6 1 1 A 38 38 ASP CA C 38 54.826 53.422 1.404 1
1 407 . 6 1 1 A 38 38 ASP CB C 38 43.332 42.918 0.414 1
1 408 . 6 1 1 A 38 38 ASP N N 38 120.401 122.352 -1.951 1
1 409 . 6 1 1 A 39 39 GLY H H 39 8.068 8.435 -0.367 1
1 410 . 6 1 1 A 39 39 GLY HA2 H 39 3.774 3.880 -0.106 1
1 411 . 6 1 1 A 39 39 GLY HA3 H 39 3.555 4.063 -0.508 1
1 412 . 6 1 1 A 39 39 GLY C C 39 172.578 173.298 -0.720 1
1 413 . 6 1 1 A 39 39 GLY CA C 39 43.967 44.773 -0.806 1
1 414 . 6 1 1 A 39 39 GLY N N 39 107.925 109.473 -1.548 1
1 415 . 6 1 1 A 40 40 HIS H H 40 9.111 8.596 0.515 1
1 416 . 6 1 1 A 40 40 HIS HA H 40 4.650 4.745 -0.095 1
1 421 . 6 1 1 A 40 40 HIS C C 40 174.330 174.805 -0.475 1
1 422 . 6 1 1 A 40 40 HIS CA C 40 55.886 56.382 -0.496 1
1 423 . 6 1 1 A 40 40 HIS CB C 40 30.507 30.726 -0.219 1
1 426 . 6 1 1 A 40 40 HIS N N 40 119.179 118.866 0.313 1
1 427 . 6 1 1 A 41 41 LEU H H 41 8.254 8.716 -0.462 1
1 428 . 6 1 1 A 41 41 LEU HA H 41 4.626 5.222 -0.596 1
1 438 . 6 1 1 A 41 41 LEU C C 41 176.035 176.176 -0.141 1
1 439 . 6 1 1 A 41 41 LEU CA C 41 55.621 53.635 1.986 1
1 440 . 6 1 1 A 41 41 LEU CB C 41 45.091 43.835 1.256 1
1 444 . 6 1 1 A 41 41 LEU N N 41 124.808 123.962 0.846 1
1 445 . 6 1 1 A 42 42 ILE H H 42 8.685 8.609 0.076 1
1 446 . 6 1 1 A 42 42 ILE HA H 42 4.578 4.817 -0.239 1
1 456 . 6 1 1 A 42 42 ILE C C 42 175.369 175.730 -0.361 1
1 457 . 6 1 1 A 42 42 ILE CA C 42 59.852 60.355 -0.503 1
1 458 . 6 1 1 A 42 42 ILE CB C 42 36.778 39.320 -2.542 1
1 462 . 6 1 1 A 42 42 ILE N N 42 121.814 124.282 -2.468 1
1 463 . 6 1 1 A 43 43 ARG H H 43 8.787 8.613 0.174 1
1 464 . 6 1 1 A 43 43 ARG HA H 43 4.852 4.624 0.228 1
1 472 . 6 1 1 A 43 43 ARG C C 43 174.029 174.857 -0.828 1
1 473 . 6 1 1 A 43 43 ARG CA C 43 52.730 55.707 -2.977 1
1 474 . 6 1 1 A 43 43 ARG CB C 43 36.983 33.350 3.633 1
1 477 . 6 1 1 A 43 43 ARG N N 43 125.771 126.007 -0.236 1
1 479 . 6 1 1 A 44 44 VAL H H 44 8.661 8.593 0.068 1
1 480 . 6 1 1 A 44 44 VAL HA H 44 3.276 3.734 -0.458 1
1 488 . 6 1 1 A 44 44 VAL C C 44 173.227 175.203 -1.976 1
1 489 . 6 1 1 A 44 44 VAL CA C 44 63.161 63.328 -0.167 1
1 490 . 6 1 1 A 44 44 VAL CB C 44 29.054 29.800 -0.746 1
1 493 . 6 1 1 A 44 44 VAL N N 44 117.026 119.632 -2.606 1
1 494 . 6 1 1 A 45 45 ILE H H 45 8.464 7.961 0.503 1
1 495 . 6 1 1 A 45 45 ILE HA H 45 4.579 4.107 0.472 1
1 505 . 6 1 1 A 45 45 ILE C C 45 178.108 174.915 3.193 1
1 506 . 6 1 1 A 45 45 ILE CA C 45 59.888 60.998 -1.110 1
1 507 . 6 1 1 A 45 45 ILE CB C 45 36.998 37.607 -0.609 1
1 511 . 6 1 1 A 45 45 ILE N N 45 122.767 122.220 0.547 1
1 512 . 6 1 1 A 46 46 GLU H H 46 9.015 8.745 0.270 1
1 513 . 6 1 1 A 46 46 GLU HA H 46 4.206 4.534 -0.328 1
1 518 . 6 1 1 A 46 46 GLU C C 46 177.746 176.929 0.817 1
1 519 . 6 1 1 A 46 46 GLU CA C 46 56.130 56.088 0.042 1
1 520 . 6 1 1 A 46 46 GLU CB C 46 30.581 30.496 0.085 1
1 522 . 6 1 1 A 46 46 GLU N N 46 131.076 128.742 2.334 1
1 523 . 6 1 1 A 47 47 GLU H H 47 9.213 8.944 0.269 1
1 524 . 6 1 1 A 47 47 GLU HA H 47 4.194 4.060 0.134 1
1 529 . 6 1 1 A 47 47 GLU C C 47 178.088 177.657 0.431 1
1 530 . 6 1 1 A 47 47 GLU CA C 47 58.212 57.938 0.274 1
1 531 . 6 1 1 A 47 47 GLU CB C 47 29.390 29.949 -0.559 1
1 533 . 6 1 1 A 47 47 GLU N N 47 129.592 124.100 5.492 1
1 534 . 6 1 1 A 48 48 GLY H H 48 9.586 9.007 0.579 1
1 535 . 6 1 1 A 48 48 GLY HA2 H 48 4.141 3.845 0.296 1
1 536 . 6 1 1 A 48 48 GLY HA3 H 48 3.757 3.846 -0.089 1
1 537 . 6 1 1 A 48 48 GLY C C 48 173.790 174.021 -0.231 1
1 538 . 6 1 1 A 48 48 GLY CA C 48 45.764 46.896 -1.132 1
1 539 . 6 1 1 A 48 48 GLY N N 48 114.819 112.253 2.566 1
1 540 . 6 1 1 A 49 49 SER H H 49 7.580 7.889 -0.309 1
1 541 . 6 1 1 A 49 49 SER HA H 49 4.728 4.926 -0.198 1
1 544 . 6 1 1 A 49 49 SER C C 49 173.542 174.371 -0.829 1
1 545 . 6 1 1 A 49 49 SER CA C 49 57.560 55.556 2.004 1
1 546 . 6 1 1 A 49 49 SER CB C 49 64.529 64.228 0.301 1
1 547 . 6 1 1 A 49 49 SER N N 49 114.688 113.508 1.180 1
1 548 . 6 1 1 A 50 50 PRO HA H 50 4.431 4.565 -0.134 1
1 555 . 6 1 1 A 50 50 PRO C C 50 179.377 177.574 1.803 1
1 556 . 6 1 1 A 50 50 PRO CA C 50 66.059 64.258 1.801 1
1 557 . 6 1 1 A 50 50 PRO CB C 50 32.598 31.833 0.765 1
1 560 . 6 1 1 A 51 51 ALA H H 51 8.264 8.302 -0.038 1
1 561 . 6 1 1 A 51 51 ALA HA H 51 3.817 4.010 -0.193 1
1 565 . 6 1 1 A 51 51 ALA C C 51 177.508 179.716 -2.208 1
1 566 . 6 1 1 A 51 51 ALA CA C 51 55.392 55.087 0.305 1
1 567 . 6 1 1 A 51 51 ALA CB C 51 20.474 18.532 1.942 1
1 568 . 6 1 1 A 51 51 ALA N N 51 117.604 120.287 -2.683 1
1 569 . 6 1 1 A 52 52 GLU H H 52 7.794 7.455 0.339 1
1 570 . 6 1 1 A 52 52 GLU HA H 52 3.881 4.019 -0.138 1
1 575 . 6 1 1 A 52 52 GLU C C 52 181.401 178.684 2.717 1
1 576 . 6 1 1 A 52 52 GLU CA C 52 59.454 58.685 0.769 1
1 577 . 6 1 1 A 52 52 GLU CB C 52 30.247 29.392 0.855 1
1 579 . 6 1 1 A 52 52 GLU N N 52 119.474 118.514 0.960 1
1 580 . 6 1 1 A 53 53 LYS H H 53 8.557 7.741 0.816 1
1 581 . 6 1 1 A 53 53 LYS HA H 53 4.020 4.032 -0.012 1
1 588 . 6 1 1 A 53 53 LYS C C 53 177.939 177.909 0.030 1
1 589 . 6 1 1 A 53 53 LYS CA C 53 59.012 58.559 0.453 1
1 590 . 6 1 1 A 53 53 LYS CB C 53 32.438 32.011 0.427 1
1 594 . 6 1 1 A 53 53 LYS N N 53 120.057 119.793 0.264 1
1 595 . 6 1 1 A 54 54 ALA H H 54 7.764 7.560 0.204 1
1 596 . 6 1 1 A 54 54 ALA HA H 54 4.400 4.297 0.103 1
1 600 . 6 1 1 A 54 54 ALA C C 54 177.658 177.706 -0.048 1
1 601 . 6 1 1 A 54 54 ALA CA C 54 52.412 51.678 0.734 1
1 602 . 6 1 1 A 54 54 ALA CB C 54 20.739 18.224 2.515 1
1 603 . 6 1 1 A 54 54 ALA N N 54 117.678 118.774 -1.096 1
1 604 . 6 1 1 A 55 55 GLY H H 55 7.583 8.046 -0.463 1
1 605 . 6 1 1 A 55 55 GLY HA2 H 55 4.266 3.908 0.358 1
1 606 . 6 1 1 A 55 55 GLY HA3 H 55 3.775 3.912 -0.137 1
1 607 . 6 1 1 A 55 55 GLY C C 55 175.232 174.165 1.067 1
1 608 . 6 1 1 A 55 55 GLY CA C 55 45.368 46.215 -0.847 1
1 609 . 6 1 1 A 55 55 GLY N N 55 103.265 107.589 -4.324 1
1 610 . 6 1 1 A 56 56 LEU H H 56 7.280 7.429 -0.149 1
1 611 . 6 1 1 A 56 56 LEU HA H 56 3.984 4.359 -0.375 1
1 621 . 6 1 1 A 56 56 LEU C C 56 174.708 175.445 -0.737 1
1 622 . 6 1 1 A 56 56 LEU CA C 56 55.603 54.765 0.838 1
1 623 . 6 1 1 A 56 56 LEU CB C 56 42.752 42.324 0.428 1
1 627 . 6 1 1 A 56 56 LEU N N 56 119.211 123.398 -4.187 1
1 628 . 6 1 1 A 57 57 LEU H H 57 8.693 8.866 -0.173 1
1 629 . 6 1 1 A 57 57 LEU HA H 57 4.499 4.895 -0.396 1
1 639 . 6 1 1 A 57 57 LEU C C 57 176.124 175.289 0.835 1
1 640 . 6 1 1 A 57 57 LEU CA C 57 52.959 53.207 -0.248 1
1 641 . 6 1 1 A 57 57 LEU CB C 57 45.122 43.243 1.879 1
1 645 . 6 1 1 A 57 57 LEU N N 57 121.969 129.160 -7.191 1
1 646 . 6 1 1 A 58 58 ASP H H 58 8.334 8.635 -0.301 1
1 647 . 6 1 1 A 58 58 ASP HA H 58 4.139 4.661 -0.522 1
1 650 . 6 1 1 A 58 58 ASP C C 58 178.636 176.721 1.915 1
1 651 . 6 1 1 A 58 58 ASP CA C 58 56.079 54.462 1.617 1
1 652 . 6 1 1 A 58 58 ASP CB C 58 42.135 41.447 0.688 1
1 653 . 6 1 1 A 58 58 ASP N N 58 120.401 121.362 -0.961 1
1 654 . 6 1 1 A 59 59 GLY H H 59 9.378 8.467 0.911 1
1 655 . 6 1 1 A 59 59 GLY HA2 H 59 4.317 3.991 0.326 1
1 656 . 6 1 1 A 59 59 GLY HA3 H 59 3.260 3.993 -0.733 1
1 657 . 6 1 1 A 59 59 GLY C C 59 173.359 174.266 -0.907 1
1 658 . 6 1 1 A 59 59 GLY CA C 59 45.517 44.990 0.527 1
1 659 . 6 1 1 A 59 59 GLY N N 59 116.622 113.966 2.656 1
1 660 . 6 1 1 A 60 60 ASP H H 60 8.009 7.925 0.084 1
1 661 . 6 1 1 A 60 60 ASP HA H 60 4.638 4.709 -0.071 1
1 664 . 6 1 1 A 60 60 ASP C C 60 175.555 174.705 0.850 1
1 665 . 6 1 1 A 60 60 ASP CA C 60 55.286 54.050 1.236 1
1 666 . 6 1 1 A 60 60 ASP CB C 60 42.381 42.044 0.337 1
1 667 . 6 1 1 A 60 60 ASP N N 60 121.370 120.697 0.673 1
1 668 . 6 1 1 A 61 61 ARG H H 61 8.648 8.665 -0.017 1
1 669 . 6 1 1 A 61 61 ARG HA H 61 5.179 5.162 0.017 1
1 677 . 6 1 1 A 61 61 ARG C C 61 177.381 174.603 2.778 1
1 678 . 6 1 1 A 61 61 ARG CA C 61 53.704 54.680 -0.976 1
1 679 . 6 1 1 A 61 61 ARG CB C 61 34.017 31.787 2.230 1
1 682 . 6 1 1 A 61 61 ARG N N 61 116.958 121.601 -4.643 1
1 684 . 6 1 1 A 62 62 VAL H H 62 8.247 8.437 -0.190 1
1 685 . 6 1 1 A 62 62 VAL HA H 62 3.806 4.607 -0.801 1
1 693 . 6 1 1 A 62 62 VAL C C 62 174.748 175.033 -0.285 1
1 694 . 6 1 1 A 62 62 VAL CA C 62 63.149 62.253 0.896 1
1 695 . 6 1 1 A 62 62 VAL CB C 62 32.574 32.096 0.478 1
1 698 . 6 1 1 A 62 62 VAL N N 62 118.546 126.540 -7.994 1
1 699 . 6 1 1 A 63 63 LEU H H 63 9.262 9.143 0.119 1
1 700 . 6 1 1 A 63 63 LEU HA H 63 4.412 4.373 0.039 1
1 710 . 6 1 1 A 63 63 LEU C C 63 177.649 177.303 0.346 1
1 711 . 6 1 1 A 63 63 LEU CA C 63 56.044 56.685 -0.641 1
1 712 . 6 1 1 A 63 63 LEU CB C 63 43.339 42.826 0.513 1
1 716 . 6 1 1 A 63 63 LEU N N 63 125.413 131.053 -5.640 1
1 717 . 6 1 1 A 64 64 ARG H H 64 7.806 7.710 0.096 1
1 718 . 6 1 1 A 64 64 ARG HA H 64 5.704 5.189 0.515 1
1 726 . 6 1 1 A 64 64 ARG C C 64 175.091 174.053 1.038 1
1 727 . 6 1 1 A 64 64 ARG CA C 64 54.148 54.719 -0.571 1
1 728 . 6 1 1 A 64 64 ARG CB C 64 35.742 33.917 1.825 1
1 731 . 6 1 1 A 64 64 ARG N N 64 112.961 117.141 -4.180 1
1 733 . 6 1 1 A 65 65 ILE H H 65 8.327 9.148 -0.821 1
1 734 . 6 1 1 A 65 65 ILE HA H 65 4.384 4.616 -0.232 1
1 744 . 6 1 1 A 65 65 ILE C C 65 175.722 175.658 0.064 1
1 745 . 6 1 1 A 65 65 ILE CA C 65 60.501 59.408 1.093 1
1 746 . 6 1 1 A 65 65 ILE CB C 65 39.547 40.091 -0.544 1
1 750 . 6 1 1 A 65 65 ILE N N 65 119.175 123.112 -3.937 1
1 751 . 6 1 1 A 66 66 ASN H H 66 9.911 9.814 0.097 1
1 752 . 6 1 1 A 66 66 ASN HA H 66 4.428 4.387 0.041 1
1 757 . 6 1 1 A 66 66 ASN C C 66 175.349 174.648 0.701 1
1 758 . 6 1 1 A 66 66 ASN CA C 66 54.157 54.178 -0.021 1
1 759 . 6 1 1 A 66 66 ASN CB C 66 37.024 37.443 -0.419 1
1 760 . 6 1 1 A 66 66 ASN N N 66 128.952 128.047 0.905 1
1 762 . 6 1 1 A 67 67 GLY H H 67 9.230 8.626 0.604 1
1 763 . 6 1 1 A 67 67 GLY HA2 H 67 4.322 3.937 0.385 1
1 764 . 6 1 1 A 67 67 GLY HA3 H 67 3.508 3.946 -0.438 1
1 765 . 6 1 1 A 67 67 GLY C C 67 174.393 173.953 0.440 1
1 766 . 6 1 1 A 67 67 GLY CA C 67 45.341 46.522 -1.181 1
1 767 . 6 1 1 A 67 67 GLY N N 67 103.238 104.685 -1.447 1
1 768 . 6 1 1 A 68 68 VAL H H 68 8.063 7.689 0.374 1
1 769 . 6 1 1 A 68 68 VAL HA H 68 4.015 4.653 -0.638 1
1 777 . 6 1 1 A 68 68 VAL C C 68 175.833 174.675 1.158 1
1 778 . 6 1 1 A 68 68 VAL CA C 68 62.603 61.098 1.505 1
1 779 . 6 1 1 A 68 68 VAL CB C 68 32.574 35.859 -3.285 1
1 782 . 6 1 1 A 68 68 VAL N N 68 125.696 119.415 6.281 1
1 783 . 6 1 1 A 69 69 PHE H H 69 9.301 9.071 0.230 1
1 784 . 6 1 1 A 69 69 PHE HA H 69 4.947 4.581 0.366 1
1 792 . 6 1 1 A 69 69 PHE C C 69 177.120 175.445 1.675 1
1 793 . 6 1 1 A 69 69 PHE CA C 69 59.200 59.285 -0.085 1
1 794 . 6 1 1 A 69 69 PHE CB C 69 39.320 39.728 -0.408 1
1 800 . 6 1 1 A 69 69 PHE N N 69 128.641 128.428 0.213 1
1 801 . 6 1 1 A 70 70 VAL H H 70 8.312 8.005 0.307 1
1 802 . 6 1 1 A 70 70 VAL HA H 70 4.517 4.477 0.040 1
1 810 . 6 1 1 A 70 70 VAL CA C 70 60.734 60.614 0.120 1
1 811 . 6 1 1 A 70 70 VAL CB C 70 32.976 31.502 1.474 1
1 814 . 6 1 1 A 70 70 VAL N N 70 118.381 120.951 -2.570 1
1 815 . 6 1 1 A 71 71 ASP H H 71 5.373 7.395 -2.022 1
1 816 . 6 1 1 A 71 71 ASP HA H 71 4.413 4.299 0.114 1
1 819 . 6 1 1 A 71 71 ASP C C 71 174.896 177.725 -2.829 1
1 820 . 6 1 1 A 71 71 ASP CA C 71 58.334 56.219 2.115 1
1 821 . 6 1 1 A 71 71 ASP CB C 71 46.097 40.641 5.456 1
1 822 . 6 1 1 A 71 71 ASP N N 71 119.008 123.754 -4.746 1
1 823 . 6 1 1 A 72 72 LYS H H 72 7.874 7.439 0.435 1
1 824 . 6 1 1 A 72 72 LYS HA H 72 4.522 4.509 0.013 1
1 833 . 6 1 1 A 72 72 LYS C C 72 177.209 176.545 0.664 1
1 834 . 6 1 1 A 72 72 LYS CA C 72 54.122 55.622 -1.500 1
1 835 . 6 1 1 A 72 72 LYS CB C 72 31.640 32.691 -1.051 1
1 839 . 6 1 1 A 72 72 LYS N N 72 110.259 115.484 -5.225 1
1 840 . 6 1 1 A 73 73 GLU H H 73 7.421 7.676 -0.255 1
1 841 . 6 1 1 A 73 73 GLU HA H 73 4.401 4.446 -0.045 1
1 846 . 6 1 1 A 73 73 GLU C C 73 176.728 176.192 0.536 1
1 847 . 6 1 1 A 73 73 GLU CA C 73 54.950 56.399 -1.449 1
1 848 . 6 1 1 A 73 73 GLU CB C 73 30.390 30.492 -0.102 1
1 850 . 6 1 1 A 73 73 GLU N N 73 120.043 120.635 -0.592 1
1 851 . 6 1 1 A 74 74 GLU H H 74 9.360 8.977 0.383 1
1 852 . 6 1 1 A 74 74 GLU HA H 74 4.403 4.480 -0.077 1
1 857 . 6 1 1 A 74 74 GLU C C 74 178.234 178.138 0.096 1
1 858 . 6 1 1 A 74 74 GLU CA C 74 56.516 56.318 0.198 1
1 859 . 6 1 1 A 74 74 GLU CB C 74 30.390 30.179 0.211 1
1 861 . 6 1 1 A 74 74 GLU N N 74 122.193 121.650 0.543 1
1 862 . 6 1 1 A 75 75 HIS H H 75 9.553 9.174 0.379 1
1 863 . 6 1 1 A 75 75 HIS HA H 75 4.080 4.277 -0.197 1
1 868 . 6 1 1 A 75 75 HIS C C 75 175.985 177.052 -1.067 1
1 869 . 6 1 1 A 75 75 HIS CA C 75 61.016 60.335 0.681 1
1 870 . 6 1 1 A 75 75 HIS CB C 75 29.468 30.297 -0.829 1
1 873 . 6 1 1 A 75 75 HIS N N 75 123.587 122.714 0.873 1
1 874 . 6 1 1 A 76 76 ALA H H 76 9.129 8.212 0.917 1
1 875 . 6 1 1 A 76 76 ALA HA H 76 3.826 3.903 -0.077 1
1 879 . 6 1 1 A 76 76 ALA C C 76 180.475 178.382 2.093 1
1 880 . 6 1 1 A 76 76 ALA CA C 76 55.392 54.288 1.104 1
1 881 . 6 1 1 A 76 76 ALA CB C 76 18.182 18.173 0.009 1
1 882 . 6 1 1 A 76 76 ALA N N 76 117.795 120.986 -3.191 1
1 883 . 6 1 1 A 77 77 GLN H H 77 7.099 7.608 -0.509 1
1 884 . 6 1 1 A 77 77 GLN HA H 77 4.198 4.243 -0.045 1
1 891 . 6 1 1 A 77 77 GLN C C 77 177.860 178.598 -0.738 1
1 892 . 6 1 1 A 77 77 GLN CA C 77 57.790 57.992 -0.202 1
1 893 . 6 1 1 A 77 77 GLN CB C 77 28.536 28.797 -0.261 1
1 895 . 6 1 1 A 77 77 GLN N N 77 115.764 116.508 -0.744 1
1 897 . 6 1 1 A 78 78 VAL H H 78 7.430 7.801 -0.371 1
1 898 . 6 1 1 A 78 78 VAL HA H 78 3.241 3.576 -0.335 1
1 906 . 6 1 1 A 78 78 VAL C C 78 177.042 177.990 -0.948 1
1 907 . 6 1 1 A 78 78 VAL CA C 78 67.299 66.039 1.260 1
1 908 . 6 1 1 A 78 78 VAL CB C 78 30.819 31.570 -0.751 1
1 911 . 6 1 1 A 78 78 VAL N N 78 121.143 121.231 -0.088 1
1 912 . 6 1 1 A 79 79 VAL H H 79 7.773 7.992 -0.219 1
1 913 . 6 1 1 A 79 79 VAL HA H 79 3.315 3.615 -0.300 1
1 921 . 6 1 1 A 79 79 VAL C C 79 179.179 177.764 1.415 1
1 922 . 6 1 1 A 79 79 VAL CA C 79 66.694 65.342 1.352 1
1 923 . 6 1 1 A 79 79 VAL CB C 79 31.841 30.884 0.957 1
1 926 . 6 1 1 A 79 79 VAL N N 79 117.473 119.802 -2.329 1
1 927 . 6 1 1 A 80 80 GLU H H 80 7.410 8.145 -0.735 1
1 928 . 6 1 1 A 80 80 GLU HA H 80 4.258 3.940 0.318 1
1 933 . 6 1 1 A 80 80 GLU C C 80 178.018 179.339 -1.321 1
1 934 . 6 1 1 A 80 80 GLU CA C 80 58.566 59.313 -0.747 1
1 935 . 6 1 1 A 80 80 GLU CB C 80 29.072 29.298 -0.226 1
1 937 . 6 1 1 A 80 80 GLU N N 80 120.451 120.550 -0.099 1
1 938 . 6 1 1 A 81 81 LEU H H 81 8.070 7.990 0.080 1
1 939 . 6 1 1 A 81 81 LEU HA H 81 3.976 3.936 0.040 1
1 949 . 6 1 1 A 81 81 LEU C C 81 180.658 178.646 2.012 1
1 950 . 6 1 1 A 81 81 LEU CA C 81 58.061 58.236 -0.175 1
1 951 . 6 1 1 A 81 81 LEU CB C 81 42.115 42.038 0.077 1
1 955 . 6 1 1 A 81 81 LEU N N 81 119.943 120.373 -0.430 1
1 956 . 6 1 1 A 82 82 VAL H H 82 7.609 7.587 0.022 1
1 957 . 6 1 1 A 82 82 VAL HA H 82 3.474 3.491 -0.017 1
1 965 . 6 1 1 A 82 82 VAL C C 82 178.927 178.140 0.787 1
1 966 . 6 1 1 A 82 82 VAL CA C 82 67.398 67.309 0.089 1
1 967 . 6 1 1 A 82 82 VAL CB C 82 31.306 31.606 -0.300 1
1 970 . 6 1 1 A 82 82 VAL N N 82 118.150 117.353 0.797 1
1 971 . 6 1 1 A 83 83 ARG H H 83 8.186 8.041 0.145 1
1 972 . 6 1 1 A 83 83 ARG HA H 83 3.994 3.983 0.011 1
1 979 . 6 1 1 A 83 83 ARG C C 83 179.999 179.385 0.614 1
1 980 . 6 1 1 A 83 83 ARG CA C 83 60.205 59.931 0.274 1
1 981 . 6 1 1 A 83 83 ARG CB C 83 30.103 30.144 -0.041 1
1 984 . 6 1 1 A 83 83 ARG N N 83 122.902 119.160 3.742 1
1 985 . 6 1 1 A 84 84 LYS H H 84 8.772 8.094 0.678 1
1 986 . 6 1 1 A 84 84 LYS HA H 84 4.047 3.995 0.052 1
1 995 . 6 1 1 A 84 84 LYS C C 84 176.934 179.273 -2.339 1
1 996 . 6 1 1 A 84 84 LYS CA C 84 58.142 59.347 -1.205 1
1 997 . 6 1 1 A 84 84 LYS CB C 84 32.492 32.184 0.308 1
1 1001 . 6 1 1 A 84 84 LYS N N 84 117.548 120.357 -2.809 1
1 1002 . 6 1 1 A 85 85 SER H H 85 7.333 8.323 -0.990 1
1 1003 . 6 1 1 A 85 85 SER HA H 85 4.235 4.250 -0.015 1
1 1006 . 6 1 1 A 85 85 SER C C 85 175.588 175.209 0.379 1
1 1007 . 6 1 1 A 85 85 SER CA C 85 59.535 61.751 -2.216 1
1 1008 . 6 1 1 A 85 85 SER CB C 85 63.571 63.760 -0.189 1
1 1009 . 6 1 1 A 85 85 SER N N 85 113.544 115.354 -1.810 1
1 1010 . 6 1 1 A 86 86 GLY H H 86 7.459 7.203 0.256 1
1 1011 . 6 1 1 A 86 86 GLY HA2 H 86 4.176 4.133 0.043 1
1 1012 . 6 1 1 A 86 86 GLY HA3 H 86 3.762 4.137 -0.375 1
1 1013 . 6 1 1 A 86 86 GLY C C 86 176.407 175.270 1.137 1
1 1014 . 6 1 1 A 86 86 GLY CA C 86 46.109 43.993 2.116 1
1 1015 . 6 1 1 A 86 86 GLY N N 86 104.331 106.366 -2.035 1
1 1016 . 6 1 1 A 87 87 ASN HA H 87 4.650 4.460 0.190 1
1 1021 . 6 1 1 A 87 87 ASN C C 87 173.653 175.133 -1.480 1
1 1022 . 6 1 1 A 87 87 ASN CA C 87 54.492 55.899 -1.407 1
1 1023 . 6 1 1 A 87 87 ASN CB C 87 38.425 38.739 -0.314 1
1 1024 . 6 1 1 A 87 87 ASN N N 87 118.401 122.359 -3.958 1
1 1026 . 6 1 1 A 88 88 SER H H 88 7.435 8.070 -0.635 1
1 1027 . 6 1 1 A 88 88 SER HA H 88 5.438 5.325 0.113 1
1 1030 . 6 1 1 A 88 88 SER C C 88 172.867 173.239 -0.372 1
1 1031 . 6 1 1 A 88 88 SER CA C 88 58.160 56.485 1.675 1
1 1032 . 6 1 1 A 88 88 SER CB C 88 65.861 65.531 0.330 1
1 1033 . 6 1 1 A 88 88 SER N N 88 113.765 112.830 0.935 1
1 1034 . 6 1 1 A 89 89 VAL H H 89 8.452 8.705 -0.253 1
1 1035 . 6 1 1 A 89 89 VAL HA H 89 4.519 5.087 -0.568 1
1 1043 . 6 1 1 A 89 89 VAL C C 89 171.391 174.759 -3.368 1
1 1044 . 6 1 1 A 89 89 VAL CA C 89 61.333 59.950 1.383 1
1 1045 . 6 1 1 A 89 89 VAL CB C 89 33.897 35.598 -1.701 1
1 1048 . 6 1 1 A 89 89 VAL N N 89 120.001 124.895 -4.894 1
1 1049 . 6 1 1 A 90 90 THR H H 90 8.348 8.689 -0.341 1
1 1050 . 6 1 1 A 90 90 THR HA H 90 5.042 5.352 -0.310 1
1 1055 . 6 1 1 A 90 90 THR C C 90 173.926 173.511 0.415 1
1 1056 . 6 1 1 A 90 90 THR CA C 90 61.403 61.377 0.026 1
1 1057 . 6 1 1 A 90 90 THR CB C 90 69.553 70.762 -1.209 1
1 1059 . 6 1 1 A 90 90 THR N N 90 123.477 121.649 1.828 1
1 1060 . 6 1 1 A 91 91 LEU H H 91 9.195 8.489 0.706 1
1 1061 . 6 1 1 A 91 91 LEU HA H 91 5.161 4.900 0.261 1
1 1071 . 6 1 1 A 91 91 LEU C C 91 174.564 175.620 -1.056 1
1 1072 . 6 1 1 A 91 91 LEU CA C 91 52.590 53.648 -1.058 1
1 1073 . 6 1 1 A 91 91 LEU CB C 91 44.998 46.080 -1.082 1
1 1077 . 6 1 1 A 91 91 LEU N N 91 128.419 125.594 2.825 1
1 1078 . 6 1 1 A 92 92 LEU H H 92 8.644 8.467 0.177 1
1 1079 . 6 1 1 A 92 92 LEU HA H 92 5.335 5.156 0.179 1
1 1089 . 6 1 1 A 92 92 LEU C C 92 176.451 175.410 1.041 1
1 1090 . 6 1 1 A 92 92 LEU CA C 92 54.220 53.895 0.325 1
1 1091 . 6 1 1 A 92 92 LEU CB C 92 44.323 43.129 1.194 1
1 1095 . 6 1 1 A 92 92 LEU N N 92 125.894 122.849 3.045 1
1 1096 . 6 1 1 A 93 93 VAL H H 93 9.249 8.706 0.543 1
1 1097 . 6 1 1 A 93 93 VAL HA H 93 5.573 5.180 0.393 1
1 1105 . 6 1 1 A 93 93 VAL C C 93 173.550 174.220 -0.670 1
1 1106 . 6 1 1 A 93 93 VAL CA C 93 58.340 60.798 -2.458 1
1 1107 . 6 1 1 A 93 93 VAL CB C 93 36.159 33.612 2.547 1
1 1110 . 6 1 1 A 93 93 VAL N N 93 120.660 120.448 0.212 1
1 1111 . 6 1 1 A 94 94 LEU H H 94 8.634 8.721 -0.087 1
1 1112 . 6 1 1 A 94 94 LEU HA H 94 4.911 5.158 -0.247 1
1 1122 . 6 1 1 A 94 94 LEU C C 94 174.172 174.704 -0.532 1
1 1123 . 6 1 1 A 94 94 LEU CA C 94 52.659 53.217 -0.558 1
1 1124 . 6 1 1 A 94 94 LEU CB C 94 47.910 46.004 1.906 1
1 1128 . 6 1 1 A 94 94 LEU N N 94 120.304 127.565 -7.261 1
1 1129 . 6 1 1 A 95 95 ASP H H 95 8.210 8.691 -0.481 1
1 1130 . 6 1 1 A 95 95 ASP HA H 95 5.190 4.526 0.664 1
1 1133 . 6 1 1 A 95 95 ASP C C 95 175.887 178.126 -2.239 1
1 1134 . 6 1 1 A 95 95 ASP CA C 95 53.899 54.898 -0.999 1
1 1135 . 6 1 1 A 95 95 ASP CB C 95 41.188 42.423 -1.235 1
1 1136 . 6 1 1 A 95 95 ASP N N 95 122.184 123.556 -1.372 1
1 1137 . 6 1 1 A 96 96 GLY H H 96 8.478 8.859 -0.381 1
1 1138 . 6 1 1 A 96 96 GLY HA2 H 96 4.002 3.782 0.220 1
1 1139 . 6 1 1 A 96 96 GLY HA3 H 96 3.757 3.789 -0.032 1
1 1140 . 6 1 1 A 96 96 GLY C C 96 175.497 175.619 -0.122 1
1 1141 . 6 1 1 A 96 96 GLY CA C 96 49.944 47.746 2.198 1
1 1142 . 6 1 1 A 96 96 GLY N N 96 108.610 111.615 -3.005 1
1 1143 . 6 1 1 A 97 97 ASP H H 97 8.401 8.409 -0.008 1
1 1144 . 6 1 1 A 97 97 ASP HA H 97 4.454 4.333 0.121 1
1 1147 . 6 1 1 A 97 97 ASP C C 97 179.612 178.451 1.161 1
1 1148 . 6 1 1 A 97 97 ASP CA C 97 57.913 57.313 0.600 1
1 1149 . 6 1 1 A 97 97 ASP CB C 97 41.145 41.592 -0.447 1
1 1150 . 6 1 1 A 97 97 ASP N N 97 120.034 122.320 -2.286 1
1 1151 . 6 1 1 A 98 98 SER H H 98 8.152 8.168 -0.016 1
1 1152 . 6 1 1 A 98 98 SER HA H 98 4.218 4.216 0.002 1
1 1155 . 6 1 1 A 98 98 SER C C 98 175.061 175.407 -0.346 1
1 1156 . 6 1 1 A 98 98 SER CA C 98 62.180 62.306 -0.126 1
1 1157 . 6 1 1 A 98 98 SER CB C 98 62.179 62.753 -0.574 1
1 1158 . 6 1 1 A 98 98 SER N N 98 117.174 116.032 1.142 1
1 1159 . 6 1 1 A 99 99 TYR H H 99 9.051 8.515 0.536 1
1 1160 . 6 1 1 A 99 99 TYR HA H 99 3.692 3.791 -0.099 1
1 1167 . 6 1 1 A 99 99 TYR C C 99 176.460 176.909 -0.449 1
1 1168 . 6 1 1 A 99 99 TYR CA C 99 62.814 61.996 0.818 1
1 1169 . 6 1 1 A 99 99 TYR CB C 99 38.829 38.408 0.421 1
1 1174 . 6 1 1 A 99 99 TYR N N 99 123.539 122.311 1.228 1
1 1175 . 6 1 1 A 100 100 GLU H H 100 8.520 8.296 0.224 1
1 1176 . 6 1 1 A 100 100 GLU HA H 100 3.952 3.966 -0.014 1
1 1181 . 6 1 1 A 100 100 GLU C C 100 180.151 178.972 1.179 1
1 1182 . 6 1 1 A 100 100 GLU CA C 100 60.099 59.887 0.212 1
1 1183 . 6 1 1 A 100 100 GLU CB C 100 29.435 29.295 0.140 1
1 1185 . 6 1 1 A 100 100 GLU N N 100 117.082 118.754 -1.672 1
1 1186 . 6 1 1 A 101 101 LYS H H 101 7.740 8.325 -0.585 1
1 1187 . 6 1 1 A 101 101 LYS HA H 101 3.984 4.043 -0.059 1
1 1196 . 6 1 1 A 101 101 LYS C C 101 178.377 178.572 -0.195 1
1 1197 . 6 1 1 A 101 101 LYS CA C 101 59.888 59.415 0.473 1
1 1198 . 6 1 1 A 101 101 LYS CB C 101 32.821 32.422 0.399 1
1 1202 . 6 1 1 A 101 101 LYS N N 101 119.851 120.991 -1.140 1
1 1203 . 6 1 1 A 102 102 ALA H H 102 8.538 8.085 0.453 1
1 1204 . 6 1 1 A 102 102 ALA HA H 102 3.632 4.242 -0.610 1
1 1208 . 6 1 1 A 102 102 ALA C C 102 179.870 179.965 -0.095 1
1 1209 . 6 1 1 A 102 102 ALA CA C 102 55.285 55.190 0.095 1
1 1210 . 6 1 1 A 102 102 ALA CB C 102 17.163 18.508 -1.345 1
1 1211 . 6 1 1 A 102 102 ALA N N 102 124.176 121.552 2.624 1
1 1212 . 6 1 1 A 103 103 VAL H H 103 8.147 7.776 0.371 1
1 1213 . 6 1 1 A 103 103 VAL HA H 103 3.658 3.595 0.063 1
1 1221 . 6 1 1 A 103 103 VAL C C 103 181.113 178.085 3.028 1
1 1222 . 6 1 1 A 103 103 VAL CA C 103 66.090 67.028 -0.938 1
1 1223 . 6 1 1 A 103 103 VAL CB C 103 31.822 31.600 0.222 1
1 1226 . 6 1 1 A 103 103 VAL N N 103 117.841 118.099 -0.258 1
1 1227 . 6 1 1 A 104 104 LYS H H 104 7.903 8.126 -0.223 1
1 1228 . 6 1 1 A 104 104 LYS HA H 104 4.065 3.925 0.140 1
1 1235 . 6 1 1 A 104 104 LYS C C 104 177.715 178.699 -0.984 1
1 1236 . 6 1 1 A 104 104 LYS CA C 104 59.094 60.435 -1.341 1
1 1237 . 6 1 1 A 104 104 LYS CB C 104 32.285 32.414 -0.129 1
1 1241 . 6 1 1 A 104 104 LYS N N 104 121.515 119.270 2.245 1
1 1242 . 6 1 1 A 105 105 ASN H H 105 7.747 7.802 -0.055 1
1 1243 . 6 1 1 A 105 105 ASN HA H 105 4.721 4.868 -0.147 1
1 1248 . 6 1 1 A 105 105 ASN C C 105 173.320 173.961 -0.641 1
1 1249 . 6 1 1 A 105 105 ASN CA C 105 53.399 53.070 0.329 1
1 1250 . 6 1 1 A 105 105 ASN CB C 105 39.249 38.447 0.802 1
1 1251 . 6 1 1 A 105 105 ASN N N 105 114.941 114.767 0.174 1
1 1253 . 6 1 1 A 106 106 GLN H H 106 7.850 8.265 -0.415 1
1 1254 . 6 1 1 A 106 106 GLN HA H 106 3.902 3.851 0.051 1
1 1261 . 6 1 1 A 106 106 GLN C C 106 175.168 175.001 0.167 1
1 1262 . 6 1 1 A 106 106 GLN CA C 106 56.978 56.812 0.166 1
1 1263 . 6 1 1 A 106 106 GLN CB C 106 25.770 27.095 -1.325 1
1 1265 . 6 1 1 A 106 106 GLN N N 106 114.989 115.599 -0.610 1
1 1267 . 6 1 1 A 107 107 VAL H H 107 8.005 7.815 0.190 1
1 1268 . 6 1 1 A 107 107 VAL HA H 107 3.664 4.034 -0.370 1
1 1276 . 6 1 1 A 107 107 VAL C C 107 175.468 175.066 0.402 1
1 1277 . 6 1 1 A 107 107 VAL CA C 107 62.726 62.547 0.179 1
1 1278 . 6 1 1 A 107 107 VAL CB C 107 32.535 31.977 0.558 1
1 1281 . 6 1 1 A 107 107 VAL N N 107 120.216 120.303 -0.087 1
1 1282 . 6 1 1 A 108 108 ASP H H 108 8.484 8.734 -0.250 1
1 1283 . 6 1 1 A 108 108 ASP HA H 108 4.467 4.608 -0.141 1
1 1286 . 6 1 1 A 108 108 ASP C C 108 177.179 176.080 1.099 1
1 1287 . 6 1 1 A 108 108 ASP CA C 108 53.417 54.920 -1.503 1
1 1288 . 6 1 1 A 108 108 ASP CB C 108 40.030 41.083 -1.053 1
1 1289 . 6 1 1 A 108 108 ASP N N 108 125.414 126.884 -1.470 1
1 1290 . 6 1 1 A 109 109 LEU H H 109 8.470 8.360 0.110 1
1 1291 . 6 1 1 A 109 109 LEU HA H 109 3.846 4.324 -0.478 1
1 1301 . 6 1 1 A 109 109 LEU C C 109 178.145 178.468 -0.323 1
1 1302 . 6 1 1 A 109 109 LEU CA C 109 56.573 56.192 0.381 1
1 1303 . 6 1 1 A 109 109 LEU CB C 109 42.011 41.749 0.262 1
1 1307 . 6 1 1 A 109 109 LEU N N 109 127.577 125.177 2.400 1
1 1308 . 6 1 1 A 110 110 LYS H H 110 8.062 7.960 0.102 1
1 1309 . 6 1 1 A 110 110 LYS HA H 110 3.022 3.497 -0.475 1
1 1317 . 6 1 1 A 110 110 LYS C C 110 177.248 179.706 -2.458 1
1 1318 . 6 1 1 A 110 110 LYS CA C 110 58.742 59.710 -0.968 1
1 1319 . 6 1 1 A 110 110 LYS CB C 110 31.667 31.920 -0.253 1
1 1323 . 6 1 1 A 110 110 LYS N N 110 118.873 119.441 -0.568 1
1 1324 . 6 1 1 A 111 111 GLU H H 111 7.113 7.968 -0.855 1
1 1325 . 6 1 1 A 111 111 GLU HA H 111 4.117 4.172 -0.055 1
1 1330 . 6 1 1 A 111 111 GLU C C 111 176.519 177.637 -1.118 1
1 1331 . 6 1 1 A 111 111 GLU CA C 111 55.621 58.912 -3.291 1
1 1332 . 6 1 1 A 111 111 GLU CB C 111 29.943 29.548 0.395 1
1 1334 . 6 1 1 A 111 111 GLU N N 111 114.282 119.060 -4.778 1
1 1335 . 6 1 1 A 112 112 LEU H H 112 6.848 7.503 -0.655 1
1 1336 . 6 1 1 A 112 112 LEU HA H 112 4.293 4.162 0.131 1
1 1346 . 6 1 1 A 112 112 LEU C C 112 175.674 176.511 -0.837 1
1 1347 . 6 1 1 A 112 112 LEU CA C 112 55.197 56.003 -0.806 1
1 1348 . 6 1 1 A 112 112 LEU CB C 112 41.681 42.067 -0.386 1
1 1352 . 6 1 1 A 112 112 LEU N N 112 118.934 121.991 -3.057 1
1 1353 . 6 1 1 A 113 113 ASP H H 113 8.466 8.656 -0.190 1
1 1354 . 6 1 1 A 113 113 ASP HA H 113 4.593 4.831 -0.238 1
1 1357 . 6 1 1 A 113 113 ASP C C 113 174.511 175.338 -0.827 1
1 1358 . 6 1 1 A 113 113 ASP CA C 113 53.558 54.007 -0.449 1
1 1359 . 6 1 1 A 113 113 ASP CB C 113 42.448 42.341 0.107 1
1 1360 . 6 1 1 A 113 113 ASP N N 113 122.148 125.515 -3.367 1
1 1 . 7 1 1 A 6 6 SER HA H 6 4.483 4.411 0.072 1
1 4 . 7 1 1 A 6 6 SER C C 6 175.167 174.388 0.779 1
1 5 . 7 1 1 A 6 6 SER CA C 6 58.759 59.570 -0.811 1
1 6 . 7 1 1 A 6 6 SER CB C 6 64.069 62.917 1.152 1
1 7 . 7 1 1 A 7 7 GLY H H 7 8.431 8.488 -0.057 1
1 8 . 7 1 1 A 7 7 GLY HA2 H 7 3.973 4.111 -0.138 1
1 9 . 7 1 1 A 7 7 GLY HA3 H 7 3.973 4.111 -0.138 1
1 10 . 7 1 1 A 7 7 GLY C C 7 174.570 172.454 2.116 1
1 11 . 7 1 1 A 7 7 GLY CA C 7 45.483 45.593 -0.110 1
1 12 . 7 1 1 A 7 7 GLY N N 7 110.640 109.620 1.020 1
1 13 . 7 1 1 A 8 8 MET H H 8 8.239 8.768 -0.529 1
1 14 . 7 1 1 A 8 8 MET HA H 8 4.386 4.289 0.097 1
1 22 . 7 1 1 A 8 8 MET C C 8 176.621 175.832 0.789 1
1 23 . 7 1 1 A 8 8 MET CA C 8 55.991 56.138 -0.147 1
1 24 . 7 1 1 A 8 8 MET CB C 8 32.986 33.635 -0.649 1
1 27 . 7 1 1 A 8 8 MET N N 8 120.219 125.246 -5.027 1
1 28 . 7 1 1 A 9 9 ALA H H 9 8.435 8.530 -0.095 1
1 29 . 7 1 1 A 9 9 ALA HA H 9 4.182 4.652 -0.470 1
1 33 . 7 1 1 A 9 9 ALA C C 9 177.951 176.598 1.353 1
1 34 . 7 1 1 A 9 9 ALA CA C 9 53.399 51.581 1.818 1
1 35 . 7 1 1 A 9 9 ALA CB C 9 18.955 20.473 -1.518 1
1 36 . 7 1 1 A 9 9 ALA N N 9 124.459 128.629 -4.170 1
1 37 . 7 1 1 A 10 10 SER H H 10 8.100 8.456 -0.356 1
1 38 . 7 1 1 A 10 10 SER HA H 10 4.391 5.147 -0.756 1
1 41 . 7 1 1 A 10 10 SER C C 10 174.467 173.640 0.827 1
1 42 . 7 1 1 A 10 10 SER CA C 10 58.709 57.340 1.369 1
1 43 . 7 1 1 A 10 10 SER CB C 10 63.778 64.612 -0.834 1
1 44 . 7 1 1 A 10 10 SER N N 10 113.881 116.910 -3.029 1
1 45 . 7 1 1 A 11 11 THR H H 11 7.821 8.763 -0.942 1
1 46 . 7 1 1 A 11 11 THR HA H 11 4.191 5.033 -0.842 1
1 51 . 7 1 1 A 11 11 THR C C 11 173.610 172.920 0.690 1
1 52 . 7 1 1 A 11 11 THR CA C 11 61.936 60.291 1.645 1
1 53 . 7 1 1 A 11 11 THR CB C 11 69.713 71.113 -1.400 1
1 55 . 7 1 1 A 11 11 THR N N 11 114.471 115.506 -1.035 1
1 56 . 7 1 1 A 12 12 PHE H H 12 7.946 8.762 -0.816 1
1 57 . 7 1 1 A 12 12 PHE HA H 12 4.769 5.000 -0.231 1
1 65 . 7 1 1 A 12 12 PHE C C 12 174.211 175.205 -0.994 1
1 66 . 7 1 1 A 12 12 PHE CA C 12 56.644 57.168 -0.524 1
1 67 . 7 1 1 A 12 12 PHE CB C 12 40.609 41.216 -0.607 1
1 73 . 7 1 1 A 12 12 PHE N N 12 120.763 124.146 -3.383 1
1 74 . 7 1 1 A 13 13 ASN H H 13 9.004 8.708 0.296 1
1 75 . 7 1 1 A 13 13 ASN HA H 13 5.366 5.398 -0.032 1
1 80 . 7 1 1 A 13 13 ASN C C 13 172.158 173.313 -1.155 1
1 81 . 7 1 1 A 13 13 ASN CA C 13 50.988 49.997 0.991 1
1 82 . 7 1 1 A 13 13 ASN CB C 13 39.942 39.128 0.814 1
1 83 . 7 1 1 A 13 13 ASN N N 13 119.973 120.435 -0.462 1
1 85 . 7 1 1 A 14 14 PRO HA H 14 4.945 4.701 0.244 1
1 92 . 7 1 1 A 14 14 PRO C C 14 174.901 175.587 -0.686 1
1 93 . 7 1 1 A 14 14 PRO CA C 14 63.096 62.367 0.729 1
1 94 . 7 1 1 A 14 14 PRO CB C 14 32.739 32.950 -0.211 1
1 97 . 7 1 1 A 15 15 ARG H H 15 8.908 8.740 0.168 1
1 98 . 7 1 1 A 15 15 ARG HA H 15 4.626 4.808 -0.182 1
1 106 . 7 1 1 A 15 15 ARG C C 15 174.432 174.442 -0.010 1
1 107 . 7 1 1 A 15 15 ARG CA C 15 54.827 55.142 -0.315 1
1 108 . 7 1 1 A 15 15 ARG CB C 15 32.439 33.826 -1.387 1
1 111 . 7 1 1 A 15 15 ARG N N 15 118.947 121.785 -2.838 1
1 113 . 7 1 1 A 16 16 GLU H H 16 8.838 8.975 -0.137 1
1 114 . 7 1 1 A 16 16 GLU HA H 16 4.876 4.792 0.084 1
1 119 . 7 1 1 A 16 16 GLU C C 16 175.767 175.178 0.589 1
1 120 . 7 1 1 A 16 16 GLU CA C 16 55.621 55.975 -0.354 1
1 121 . 7 1 1 A 16 16 GLU CB C 16 31.093 30.946 0.147 1
1 123 . 7 1 1 A 16 16 GLU N N 16 125.316 127.200 -1.884 1
1 124 . 7 1 1 A 17 17 CYS H H 17 9.327 8.562 0.765 1
1 125 . 7 1 1 A 17 17 CYS HA H 17 4.804 5.066 -0.262 1
1 128 . 7 1 1 A 17 17 CYS C C 17 172.973 173.310 -0.337 1
1 129 . 7 1 1 A 17 17 CYS CA C 17 57.930 57.948 -0.018 1
1 130 . 7 1 1 A 17 17 CYS CB C 17 30.105 31.200 -1.095 1
1 131 . 7 1 1 A 17 17 CYS N N 17 127.909 122.898 5.011 1
1 132 . 7 1 1 A 18 18 LYS H H 18 9.022 8.860 0.162 1
1 133 . 7 1 1 A 18 18 LYS HA H 18 4.769 4.992 -0.223 1
1 142 . 7 1 1 A 18 18 LYS C C 18 174.586 175.336 -0.750 1
1 143 . 7 1 1 A 18 18 LYS CA C 18 55.956 55.242 0.714 1
1 144 . 7 1 1 A 18 18 LYS CB C 18 32.203 33.038 -0.835 1
1 148 . 7 1 1 A 18 18 LYS N N 18 127.039 125.937 1.102 1
1 149 . 7 1 1 A 19 19 LEU H H 19 8.784 9.015 -0.231 1
1 150 . 7 1 1 A 19 19 LEU HA H 19 4.852 4.766 0.086 1
1 160 . 7 1 1 A 19 19 LEU C C 19 176.862 176.165 0.697 1
1 161 . 7 1 1 A 19 19 LEU CA C 19 55.391 53.860 1.531 1
1 162 . 7 1 1 A 19 19 LEU CB C 19 44.442 42.861 1.581 1
1 166 . 7 1 1 A 19 19 LEU N N 19 126.311 126.379 -0.068 1
1 167 . 7 1 1 A 20 20 SER H H 20 8.215 8.913 -0.698 1
1 168 . 7 1 1 A 20 20 SER HA H 20 5.461 5.727 -0.266 1
1 171 . 7 1 1 A 20 20 SER C C 20 171.960 173.045 -1.085 1
1 172 . 7 1 1 A 20 20 SER CA C 20 57.525 56.922 0.603 1
1 173 . 7 1 1 A 20 20 SER CB C 20 65.794 65.078 0.716 1
1 174 . 7 1 1 A 20 20 SER N N 20 115.113 119.167 -4.054 1
1 175 . 7 1 1 A 21 21 LYS H H 21 9.001 8.674 0.327 1
1 176 . 7 1 1 A 21 21 LYS HA H 21 4.887 5.093 -0.206 1
1 185 . 7 1 1 A 21 21 LYS C C 21 174.133 175.340 -1.207 1
1 186 . 7 1 1 A 21 21 LYS CA C 21 53.840 54.195 -0.355 1
1 187 . 7 1 1 A 21 21 LYS CB C 21 36.553 35.582 0.971 1
1 191 . 7 1 1 A 21 21 LYS N N 21 120.938 124.181 -3.243 1
1 192 . 7 1 1 A 22 22 GLN H H 22 8.201 8.311 -0.110 1
1 193 . 7 1 1 A 22 22 GLN HA H 22 4.448 4.484 -0.036 1
1 200 . 7 1 1 A 22 22 GLN C C 22 176.372 175.651 0.721 1
1 201 . 7 1 1 A 22 22 GLN CA C 22 53.658 54.924 -1.266 1
1 202 . 7 1 1 A 22 22 GLN CB C 22 30.473 29.914 0.559 1
1 204 . 7 1 1 A 22 22 GLN N N 22 116.816 119.881 -3.065 1
1 206 . 7 1 1 A 23 23 GLU H H 23 8.624 8.693 -0.069 1
1 207 . 7 1 1 A 23 23 GLU HA H 23 4.056 3.960 0.096 1
1 212 . 7 1 1 A 23 23 GLU C C 23 177.778 177.217 0.561 1
1 213 . 7 1 1 A 23 23 GLU CA C 23 58.001 58.334 -0.333 1
1 214 . 7 1 1 A 23 23 GLU CB C 23 29.237 29.243 -0.006 1
1 216 . 7 1 1 A 23 23 GLU N N 23 122.364 123.333 -0.969 1
1 217 . 7 1 1 A 24 24 GLY H H 24 8.962 8.796 0.166 1
1 218 . 7 1 1 A 24 24 GLY HA2 H 24 4.139 3.988 0.151 1
1 219 . 7 1 1 A 24 24 GLY HA3 H 24 3.711 3.993 -0.282 1
1 220 . 7 1 1 A 24 24 GLY C C 24 173.857 174.312 -0.455 1
1 221 . 7 1 1 A 24 24 GLY CA C 24 45.288 45.049 0.239 1
1 222 . 7 1 1 A 24 24 GLY N N 24 113.942 114.731 -0.789 1
1 223 . 7 1 1 A 25 25 GLN H H 25 7.643 8.133 -0.490 1
1 224 . 7 1 1 A 25 25 GLN HA H 25 4.488 4.310 0.178 1
1 231 . 7 1 1 A 25 25 GLN C C 25 174.727 175.357 -0.630 1
1 232 . 7 1 1 A 25 25 GLN CA C 25 54.052 55.526 -1.474 1
1 233 . 7 1 1 A 25 25 GLN CB C 25 30.843 30.268 0.575 1
1 235 . 7 1 1 A 25 25 GLN N N 25 119.538 121.400 -1.862 1
1 237 . 7 1 1 A 26 26 ASN H H 26 8.625 9.033 -0.408 1
1 238 . 7 1 1 A 26 26 ASN HA H 26 4.862 4.911 -0.049 1
1 243 . 7 1 1 A 26 26 ASN C C 26 176.261 175.214 1.047 1
1 244 . 7 1 1 A 26 26 ASN CA C 26 51.812 51.810 0.002 1
1 245 . 7 1 1 A 26 26 ASN CB C 26 40.403 40.395 0.008 1
1 246 . 7 1 1 A 26 26 ASN N N 26 120.047 122.318 -2.271 1
1 248 . 7 1 1 A 27 27 TYR HA H 27 4.152 4.612 -0.460 1
1 255 . 7 1 1 A 27 27 TYR C C 27 176.731 176.008 0.723 1
1 256 . 7 1 1 A 27 27 TYR CA C 27 62.462 58.512 3.950 1
1 257 . 7 1 1 A 27 27 TYR CB C 27 40.240 39.066 1.174 1
1 262 . 7 1 1 A 27 27 TYR N N 27 121.761 121.017 0.744 1
1 263 . 7 1 1 A 28 28 GLY H H 28 8.285 8.019 0.266 1
1 264 . 7 1 1 A 28 28 GLY HA2 H 28 4.490 3.896 0.594 1
1 265 . 7 1 1 A 28 28 GLY HA3 H 28 3.759 3.978 -0.219 1
1 266 . 7 1 1 A 28 28 GLY C C 28 172.198 173.703 -1.505 1
1 267 . 7 1 1 A 28 28 GLY CA C 28 46.139 45.149 0.990 1
1 268 . 7 1 1 A 28 28 GLY N N 28 103.567 108.070 -4.503 1
1 269 . 7 1 1 A 29 29 PHE H H 29 6.878 7.744 -0.866 1
1 270 . 7 1 1 A 29 29 PHE HA H 29 5.179 4.859 0.320 1
1 278 . 7 1 1 A 29 29 PHE C C 29 172.840 173.872 -1.032 1
1 279 . 7 1 1 A 29 29 PHE CA C 29 55.262 54.929 0.333 1
1 280 . 7 1 1 A 29 29 PHE CB C 29 41.779 42.283 -0.504 1
1 286 . 7 1 1 A 29 29 PHE N N 29 111.027 117.388 -6.361 1
1 287 . 7 1 1 A 30 30 PHE H H 30 8.806 8.533 0.273 1
1 288 . 7 1 1 A 30 30 PHE HA H 30 4.923 4.788 0.135 1
1 296 . 7 1 1 A 30 30 PHE C C 30 174.501 175.166 -0.665 1
1 297 . 7 1 1 A 30 30 PHE CA C 30 55.356 55.994 -0.638 1
1 298 . 7 1 1 A 30 30 PHE CB C 30 41.681 43.450 -1.769 1
1 304 . 7 1 1 A 30 30 PHE N N 30 118.710 117.670 1.040 1
1 305 . 7 1 1 A 31 31 LEU H H 31 8.441 8.775 -0.334 1
1 306 . 7 1 1 A 31 31 LEU HA H 31 5.447 4.902 0.545 1
1 316 . 7 1 1 A 31 31 LEU C C 31 177.306 176.167 1.139 1
1 317 . 7 1 1 A 31 31 LEU CA C 31 53.610 54.136 -0.526 1
1 318 . 7 1 1 A 31 31 LEU CB C 31 43.696 42.258 1.438 1
1 322 . 7 1 1 A 31 31 LEU N N 31 123.765 123.719 0.046 1
1 323 . 7 1 1 A 32 32 ARG H H 32 9.381 8.641 0.740 1
1 324 . 7 1 1 A 32 32 ARG HA H 32 4.840 5.042 -0.202 1
1 331 . 7 1 1 A 32 32 ARG C C 32 175.155 175.392 -0.237 1
1 332 . 7 1 1 A 32 32 ARG CA C 32 54.210 54.412 -0.202 1
1 333 . 7 1 1 A 32 32 ARG CB C 32 35.087 33.842 1.245 1
1 336 . 7 1 1 A 32 32 ARG N N 32 123.160 123.595 -0.435 1
1 337 . 7 1 1 A 33 33 ILE H H 33 7.891 8.793 -0.902 1
1 338 . 7 1 1 A 33 33 ILE HA H 33 4.495 4.830 -0.335 1
1 348 . 7 1 1 A 33 33 ILE C C 33 175.850 174.634 1.216 1
1 349 . 7 1 1 A 33 33 ILE CA C 33 59.641 59.448 0.193 1
1 350 . 7 1 1 A 33 33 ILE CB C 33 39.538 39.557 -0.019 1
1 354 . 7 1 1 A 33 33 ILE N N 33 118.924 119.733 -0.809 1
1 355 . 7 1 1 A 34 34 GLU H H 34 8.971 8.823 0.148 1
1 356 . 7 1 1 A 34 34 GLU HA H 34 4.578 4.850 -0.272 1
1 361 . 7 1 1 A 34 34 GLU C C 34 175.766 175.502 0.264 1
1 362 . 7 1 1 A 34 34 GLU CA C 34 54.263 54.296 -0.033 1
1 363 . 7 1 1 A 34 34 GLU CB C 34 32.128 33.237 -1.109 1
1 365 . 7 1 1 A 34 34 GLU N N 34 125.447 121.295 4.152 1
1 366 . 7 1 1 A 35 35 LYS H H 35 8.504 8.584 -0.080 1
1 367 . 7 1 1 A 35 35 LYS HA H 35 4.026 3.886 0.140 1
1 376 . 7 1 1 A 35 35 LYS C C 35 177.701 177.036 0.665 1
1 377 . 7 1 1 A 35 35 LYS CA C 35 57.591 58.059 -0.468 1
1 378 . 7 1 1 A 35 35 LYS CB C 35 32.491 32.175 0.316 1
1 382 . 7 1 1 A 35 35 LYS N N 35 122.893 124.206 -1.313 1
1 383 . 7 1 1 A 36 36 ASP H H 36 9.020 9.077 -0.057 1
1 384 . 7 1 1 A 36 36 ASP HA H 36 4.385 4.185 0.200 1
1 387 . 7 1 1 A 36 36 ASP C C 36 174.554 174.628 -0.074 1
1 388 . 7 1 1 A 36 36 ASP CA C 36 55.868 55.042 0.826 1
1 389 . 7 1 1 A 36 36 ASP CB C 36 39.826 39.822 0.004 1
1 390 . 7 1 1 A 36 36 ASP N N 36 121.412 126.170 -4.758 1
1 391 . 7 1 1 A 37 37 THR H H 37 7.464 7.098 0.366 1
1 392 . 7 1 1 A 37 37 THR HA H 37 4.454 4.779 -0.325 1
1 397 . 7 1 1 A 37 37 THR C C 37 172.012 173.281 -1.269 1
1 398 . 7 1 1 A 37 37 THR CA C 37 61.686 61.038 0.648 1
1 399 . 7 1 1 A 37 37 THR CB C 37 70.927 72.284 -1.357 1
1 401 . 7 1 1 A 37 37 THR N N 37 113.147 112.415 0.732 1
1 402 . 7 1 1 A 38 38 ASP H H 38 8.931 8.756 0.175 1
1 403 . 7 1 1 A 38 38 ASP HA H 38 4.852 4.751 0.101 1
1 406 . 7 1 1 A 38 38 ASP CA C 38 54.826 54.107 0.719 1
1 407 . 7 1 1 A 38 38 ASP CB C 38 43.332 42.267 1.065 1
1 408 . 7 1 1 A 38 38 ASP N N 38 120.401 124.939 -4.538 1
1 409 . 7 1 1 A 39 39 GLY H H 39 8.068 8.460 -0.392 1
1 410 . 7 1 1 A 39 39 GLY HA2 H 39 3.774 4.028 -0.254 1
1 411 . 7 1 1 A 39 39 GLY HA3 H 39 3.555 4.047 -0.492 1
1 412 . 7 1 1 A 39 39 GLY C C 39 172.578 172.560 0.018 1
1 413 . 7 1 1 A 39 39 GLY CA C 39 43.967 44.808 -0.841 1
1 414 . 7 1 1 A 39 39 GLY N N 39 107.925 109.302 -1.377 1
1 415 . 7 1 1 A 40 40 HIS H H 40 9.111 8.386 0.725 1
1 416 . 7 1 1 A 40 40 HIS HA H 40 4.650 5.064 -0.414 1
1 421 . 7 1 1 A 40 40 HIS C C 40 174.330 174.493 -0.163 1
1 422 . 7 1 1 A 40 40 HIS CA C 40 55.886 54.999 0.887 1
1 423 . 7 1 1 A 40 40 HIS CB C 40 30.507 31.883 -1.376 1
1 426 . 7 1 1 A 40 40 HIS N N 40 119.179 118.621 0.558 1
1 427 . 7 1 1 A 41 41 LEU H H 41 8.254 8.932 -0.678 1
1 428 . 7 1 1 A 41 41 LEU HA H 41 4.626 4.523 0.103 1
1 438 . 7 1 1 A 41 41 LEU C C 41 176.035 176.537 -0.502 1
1 439 . 7 1 1 A 41 41 LEU CA C 41 55.621 54.219 1.402 1
1 440 . 7 1 1 A 41 41 LEU CB C 41 45.091 42.666 2.425 1
1 444 . 7 1 1 A 41 41 LEU N N 41 124.808 124.769 0.039 1
1 445 . 7 1 1 A 42 42 ILE H H 42 8.685 8.328 0.357 1
1 446 . 7 1 1 A 42 42 ILE HA H 42 4.578 4.923 -0.345 1
1 456 . 7 1 1 A 42 42 ILE C C 42 175.369 176.104 -0.735 1
1 457 . 7 1 1 A 42 42 ILE CA C 42 59.852 60.670 -0.818 1
1 458 . 7 1 1 A 42 42 ILE CB C 42 36.778 38.297 -1.519 1
1 462 . 7 1 1 A 42 42 ILE N N 42 121.814 124.127 -2.313 1
1 463 . 7 1 1 A 43 43 ARG H H 43 8.787 8.292 0.495 1
1 464 . 7 1 1 A 43 43 ARG HA H 43 4.852 4.870 -0.018 1
1 472 . 7 1 1 A 43 43 ARG C C 43 174.029 175.473 -1.444 1
1 473 . 7 1 1 A 43 43 ARG CA C 43 52.730 54.086 -1.356 1
1 474 . 7 1 1 A 43 43 ARG CB C 43 36.983 33.529 3.454 1
1 477 . 7 1 1 A 43 43 ARG N N 43 125.771 126.727 -0.956 1
1 479 . 7 1 1 A 44 44 VAL H H 44 8.661 8.599 0.062 1
1 480 . 7 1 1 A 44 44 VAL HA H 44 3.276 3.717 -0.441 1
1 488 . 7 1 1 A 44 44 VAL C C 44 173.227 175.012 -1.785 1
1 489 . 7 1 1 A 44 44 VAL CA C 44 63.161 63.199 -0.038 1
1 490 . 7 1 1 A 44 44 VAL CB C 44 29.054 29.968 -0.914 1
1 493 . 7 1 1 A 44 44 VAL N N 44 117.026 116.458 0.568 1
1 494 . 7 1 1 A 45 45 ILE H H 45 8.464 7.993 0.471 1
1 495 . 7 1 1 A 45 45 ILE HA H 45 4.579 4.240 0.339 1
1 505 . 7 1 1 A 45 45 ILE C C 45 178.108 175.506 2.602 1
1 506 . 7 1 1 A 45 45 ILE CA C 45 59.888 61.198 -1.310 1
1 507 . 7 1 1 A 45 45 ILE CB C 45 36.998 36.370 0.628 1
1 511 . 7 1 1 A 45 45 ILE N N 45 122.767 122.541 0.226 1
1 512 . 7 1 1 A 46 46 GLU H H 46 9.015 8.583 0.432 1
1 513 . 7 1 1 A 46 46 GLU HA H 46 4.206 4.290 -0.084 1
1 518 . 7 1 1 A 46 46 GLU C C 46 177.746 176.699 1.047 1
1 519 . 7 1 1 A 46 46 GLU CA C 46 56.130 57.040 -0.910 1
1 520 . 7 1 1 A 46 46 GLU CB C 46 30.581 30.727 -0.146 1
1 522 . 7 1 1 A 46 46 GLU N N 46 131.076 128.548 2.528 1
1 523 . 7 1 1 A 47 47 GLU H H 47 9.213 8.768 0.445 1
1 524 . 7 1 1 A 47 47 GLU HA H 47 4.194 4.310 -0.116 1
1 529 . 7 1 1 A 47 47 GLU C C 47 178.088 177.481 0.607 1
1 530 . 7 1 1 A 47 47 GLU CA C 47 58.212 56.741 1.471 1
1 531 . 7 1 1 A 47 47 GLU CB C 47 29.390 30.677 -1.287 1
1 533 . 7 1 1 A 47 47 GLU N N 47 129.592 123.478 6.114 1
1 534 . 7 1 1 A 48 48 GLY H H 48 9.586 8.938 0.648 1
1 535 . 7 1 1 A 48 48 GLY HA2 H 48 4.141 3.864 0.277 1
1 536 . 7 1 1 A 48 48 GLY HA3 H 48 3.757 3.866 -0.109 1
1 537 . 7 1 1 A 48 48 GLY C C 48 173.790 174.041 -0.251 1
1 538 . 7 1 1 A 48 48 GLY CA C 48 45.764 46.596 -0.832 1
1 539 . 7 1 1 A 48 48 GLY N N 48 114.819 112.176 2.643 1
1 540 . 7 1 1 A 49 49 SER H H 49 7.580 7.913 -0.333 1
1 541 . 7 1 1 A 49 49 SER HA H 49 4.728 4.790 -0.062 1
1 544 . 7 1 1 A 49 49 SER C C 49 173.542 174.355 -0.813 1
1 545 . 7 1 1 A 49 49 SER CA C 49 57.560 55.801 1.759 1
1 546 . 7 1 1 A 49 49 SER CB C 49 64.529 63.979 0.550 1
1 547 . 7 1 1 A 49 49 SER N N 49 114.688 114.191 0.497 1
1 548 . 7 1 1 A 50 50 PRO HA H 50 4.431 4.566 -0.135 1
1 555 . 7 1 1 A 50 50 PRO C C 50 179.377 177.423 1.954 1
1 556 . 7 1 1 A 50 50 PRO CA C 50 66.059 64.202 1.857 1
1 557 . 7 1 1 A 50 50 PRO CB C 50 32.598 31.836 0.762 1
1 560 . 7 1 1 A 51 51 ALA H H 51 8.264 8.114 0.150 1
1 561 . 7 1 1 A 51 51 ALA HA H 51 3.817 4.067 -0.250 1
1 565 . 7 1 1 A 51 51 ALA C C 51 177.508 179.824 -2.316 1
1 566 . 7 1 1 A 51 51 ALA CA C 51 55.392 54.803 0.589 1
1 567 . 7 1 1 A 51 51 ALA CB C 51 20.474 18.687 1.787 1
1 568 . 7 1 1 A 51 51 ALA N N 51 117.604 120.691 -3.087 1
1 569 . 7 1 1 A 52 52 GLU H H 52 7.794 7.447 0.347 1
1 570 . 7 1 1 A 52 52 GLU HA H 52 3.881 4.087 -0.206 1
1 575 . 7 1 1 A 52 52 GLU C C 52 181.401 178.526 2.875 1
1 576 . 7 1 1 A 52 52 GLU CA C 52 59.454 58.988 0.466 1
1 577 . 7 1 1 A 52 52 GLU CB C 52 30.247 29.637 0.610 1
1 579 . 7 1 1 A 52 52 GLU N N 52 119.474 118.047 1.427 1
1 580 . 7 1 1 A 53 53 LYS H H 53 8.557 7.883 0.674 1
1 581 . 7 1 1 A 53 53 LYS HA H 53 4.020 4.101 -0.081 1
1 588 . 7 1 1 A 53 53 LYS C C 53 177.939 177.405 0.534 1
1 589 . 7 1 1 A 53 53 LYS CA C 53 59.012 58.928 0.084 1
1 590 . 7 1 1 A 53 53 LYS CB C 53 32.438 31.777 0.661 1
1 594 . 7 1 1 A 53 53 LYS N N 53 120.057 117.804 2.253 1
1 595 . 7 1 1 A 54 54 ALA H H 54 7.764 7.506 0.258 1
1 596 . 7 1 1 A 54 54 ALA HA H 54 4.400 4.304 0.096 1
1 600 . 7 1 1 A 54 54 ALA C C 54 177.658 178.043 -0.385 1
1 601 . 7 1 1 A 54 54 ALA CA C 54 52.412 51.724 0.688 1
1 602 . 7 1 1 A 54 54 ALA CB C 54 20.739 18.378 2.361 1
1 603 . 7 1 1 A 54 54 ALA N N 54 117.678 120.568 -2.890 1
1 604 . 7 1 1 A 55 55 GLY H H 55 7.583 7.905 -0.322 1
1 605 . 7 1 1 A 55 55 GLY HA2 H 55 4.266 3.913 0.353 1
1 606 . 7 1 1 A 55 55 GLY HA3 H 55 3.775 3.916 -0.141 1
1 607 . 7 1 1 A 55 55 GLY C C 55 175.232 174.509 0.723 1
1 608 . 7 1 1 A 55 55 GLY CA C 55 45.368 46.547 -1.179 1
1 609 . 7 1 1 A 55 55 GLY N N 55 103.265 107.517 -4.252 1
1 610 . 7 1 1 A 56 56 LEU H H 56 7.280 7.546 -0.266 1
1 611 . 7 1 1 A 56 56 LEU HA H 56 3.984 4.492 -0.508 1
1 621 . 7 1 1 A 56 56 LEU C C 56 174.708 175.331 -0.623 1
1 622 . 7 1 1 A 56 56 LEU CA C 56 55.603 54.579 1.024 1
1 623 . 7 1 1 A 56 56 LEU CB C 56 42.752 42.269 0.483 1
1 627 . 7 1 1 A 56 56 LEU N N 56 119.211 123.251 -4.040 1
1 628 . 7 1 1 A 57 57 LEU H H 57 8.693 8.580 0.113 1
1 629 . 7 1 1 A 57 57 LEU HA H 57 4.499 4.898 -0.399 1
1 639 . 7 1 1 A 57 57 LEU C C 57 176.124 175.305 0.819 1
1 640 . 7 1 1 A 57 57 LEU CA C 57 52.959 53.343 -0.384 1
1 641 . 7 1 1 A 57 57 LEU CB C 57 45.122 42.735 2.387 1
1 645 . 7 1 1 A 57 57 LEU N N 57 121.969 129.423 -7.454 1
1 646 . 7 1 1 A 58 58 ASP H H 58 8.334 8.623 -0.289 1
1 647 . 7 1 1 A 58 58 ASP HA H 58 4.139 4.365 -0.226 1
1 650 . 7 1 1 A 58 58 ASP C C 58 178.636 176.988 1.648 1
1 651 . 7 1 1 A 58 58 ASP CA C 58 56.079 55.604 0.475 1
1 652 . 7 1 1 A 58 58 ASP CB C 58 42.135 40.411 1.724 1
1 653 . 7 1 1 A 58 58 ASP N N 58 120.401 121.858 -1.457 1
1 654 . 7 1 1 A 59 59 GLY H H 59 9.378 8.446 0.932 1
1 655 . 7 1 1 A 59 59 GLY HA2 H 59 4.317 3.940 0.377 1
1 656 . 7 1 1 A 59 59 GLY HA3 H 59 3.260 3.943 -0.683 1
1 657 . 7 1 1 A 59 59 GLY C C 59 173.359 174.158 -0.799 1
1 658 . 7 1 1 A 59 59 GLY CA C 59 45.517 45.021 0.496 1
1 659 . 7 1 1 A 59 59 GLY N N 59 116.622 113.825 2.797 1
1 660 . 7 1 1 A 60 60 ASP H H 60 8.009 7.969 0.040 1
1 661 . 7 1 1 A 60 60 ASP HA H 60 4.638 4.618 0.020 1
1 664 . 7 1 1 A 60 60 ASP C C 60 175.555 175.373 0.182 1
1 665 . 7 1 1 A 60 60 ASP CA C 60 55.286 53.497 1.789 1
1 666 . 7 1 1 A 60 60 ASP CB C 60 42.381 40.738 1.643 1
1 667 . 7 1 1 A 60 60 ASP N N 60 121.370 120.709 0.661 1
1 668 . 7 1 1 A 61 61 ARG H H 61 8.648 8.735 -0.087 1
1 669 . 7 1 1 A 61 61 ARG HA H 61 5.179 4.899 0.280 1
1 677 . 7 1 1 A 61 61 ARG C C 61 177.381 175.262 2.119 1
1 678 . 7 1 1 A 61 61 ARG CA C 61 53.704 55.609 -1.905 1
1 679 . 7 1 1 A 61 61 ARG CB C 61 34.017 31.293 2.724 1
1 682 . 7 1 1 A 61 61 ARG N N 61 116.958 124.241 -7.283 1
1 684 . 7 1 1 A 62 62 VAL H H 62 8.247 8.587 -0.340 1
1 685 . 7 1 1 A 62 62 VAL HA H 62 3.806 4.477 -0.671 1
1 693 . 7 1 1 A 62 62 VAL C C 62 174.748 175.093 -0.345 1
1 694 . 7 1 1 A 62 62 VAL CA C 62 63.149 62.360 0.789 1
1 695 . 7 1 1 A 62 62 VAL CB C 62 32.574 32.472 0.102 1
1 698 . 7 1 1 A 62 62 VAL N N 62 118.546 126.039 -7.493 1
1 699 . 7 1 1 A 63 63 LEU H H 63 9.262 9.444 -0.182 1
1 700 . 7 1 1 A 63 63 LEU HA H 63 4.412 4.396 0.016 1
1 710 . 7 1 1 A 63 63 LEU C C 63 177.649 177.098 0.551 1
1 711 . 7 1 1 A 63 63 LEU CA C 63 56.044 56.492 -0.448 1
1 712 . 7 1 1 A 63 63 LEU CB C 63 43.339 42.682 0.657 1
1 716 . 7 1 1 A 63 63 LEU N N 63 125.413 130.701 -5.288 1
1 717 . 7 1 1 A 64 64 ARG H H 64 7.806 7.671 0.135 1
1 718 . 7 1 1 A 64 64 ARG HA H 64 5.704 4.905 0.799 1
1 726 . 7 1 1 A 64 64 ARG C C 64 175.091 174.082 1.009 1
1 727 . 7 1 1 A 64 64 ARG CA C 64 54.148 54.732 -0.584 1
1 728 . 7 1 1 A 64 64 ARG CB C 64 35.742 33.918 1.824 1
1 731 . 7 1 1 A 64 64 ARG N N 64 112.961 117.048 -4.087 1
1 733 . 7 1 1 A 65 65 ILE H H 65 8.327 8.837 -0.510 1
1 734 . 7 1 1 A 65 65 ILE HA H 65 4.384 4.606 -0.222 1
1 744 . 7 1 1 A 65 65 ILE C C 65 175.722 175.278 0.444 1
1 745 . 7 1 1 A 65 65 ILE CA C 65 60.501 59.443 1.058 1
1 746 . 7 1 1 A 65 65 ILE CB C 65 39.547 40.233 -0.686 1
1 750 . 7 1 1 A 65 65 ILE N N 65 119.175 123.854 -4.679 1
1 751 . 7 1 1 A 66 66 ASN H H 66 9.911 9.741 0.170 1
1 752 . 7 1 1 A 66 66 ASN HA H 66 4.428 4.454 -0.026 1
1 757 . 7 1 1 A 66 66 ASN C C 66 175.349 175.580 -0.231 1
1 758 . 7 1 1 A 66 66 ASN CA C 66 54.157 54.489 -0.332 1
1 759 . 7 1 1 A 66 66 ASN CB C 66 37.024 37.135 -0.111 1
1 760 . 7 1 1 A 66 66 ASN N N 66 128.952 128.781 0.171 1
1 762 . 7 1 1 A 67 67 GLY H H 67 9.230 8.625 0.605 1
1 763 . 7 1 1 A 67 67 GLY HA2 H 67 4.322 3.954 0.368 1
1 764 . 7 1 1 A 67 67 GLY HA3 H 67 3.508 3.964 -0.456 1
1 765 . 7 1 1 A 67 67 GLY C C 67 174.393 174.067 0.326 1
1 766 . 7 1 1 A 67 67 GLY CA C 67 45.341 46.529 -1.188 1
1 767 . 7 1 1 A 67 67 GLY N N 67 103.238 104.689 -1.451 1
1 768 . 7 1 1 A 68 68 VAL H H 68 8.063 7.731 0.332 1
1 769 . 7 1 1 A 68 68 VAL HA H 68 4.015 4.523 -0.508 1
1 777 . 7 1 1 A 68 68 VAL C C 68 175.833 174.878 0.955 1
1 778 . 7 1 1 A 68 68 VAL CA C 68 62.603 61.590 1.013 1
1 779 . 7 1 1 A 68 68 VAL CB C 68 32.574 35.014 -2.440 1
1 782 . 7 1 1 A 68 68 VAL N N 68 125.696 119.711 5.985 1
1 783 . 7 1 1 A 69 69 PHE H H 69 9.301 9.177 0.124 1
1 784 . 7 1 1 A 69 69 PHE HA H 69 4.947 4.484 0.463 1
1 792 . 7 1 1 A 69 69 PHE C C 69 177.120 175.586 1.534 1
1 793 . 7 1 1 A 69 69 PHE CA C 69 59.200 59.333 -0.133 1
1 794 . 7 1 1 A 69 69 PHE CB C 69 39.320 39.529 -0.209 1
1 800 . 7 1 1 A 69 69 PHE N N 69 128.641 129.182 -0.541 1
1 801 . 7 1 1 A 70 70 VAL H H 70 8.312 8.134 0.178 1
1 802 . 7 1 1 A 70 70 VAL HA H 70 4.517 4.479 0.038 1
1 810 . 7 1 1 A 70 70 VAL CA C 70 60.734 60.589 0.145 1
1 811 . 7 1 1 A 70 70 VAL CB C 70 32.976 31.439 1.537 1
1 814 . 7 1 1 A 70 70 VAL N N 70 118.381 120.216 -1.835 1
1 815 . 7 1 1 A 71 71 ASP H H 71 5.373 7.137 -1.764 1
1 816 . 7 1 1 A 71 71 ASP HA H 71 4.413 4.195 0.218 1
1 819 . 7 1 1 A 71 71 ASP C C 71 174.896 177.724 -2.828 1
1 820 . 7 1 1 A 71 71 ASP CA C 71 58.334 57.261 1.073 1
1 821 . 7 1 1 A 71 71 ASP CB C 71 46.097 40.648 5.449 1
1 822 . 7 1 1 A 71 71 ASP N N 71 119.008 122.144 -3.136 1
1 823 . 7 1 1 A 72 72 LYS H H 72 7.874 7.203 0.671 1
1 824 . 7 1 1 A 72 72 LYS HA H 72 4.522 4.310 0.212 1
1 833 . 7 1 1 A 72 72 LYS C C 72 177.209 176.839 0.370 1
1 834 . 7 1 1 A 72 72 LYS CA C 72 54.122 56.473 -2.351 1
1 835 . 7 1 1 A 72 72 LYS CB C 72 31.640 33.676 -2.036 1
1 839 . 7 1 1 A 72 72 LYS N N 72 110.259 116.190 -5.931 1
1 840 . 7 1 1 A 73 73 GLU H H 73 7.421 7.759 -0.338 1
1 841 . 7 1 1 A 73 73 GLU HA H 73 4.401 4.349 0.052 1
1 846 . 7 1 1 A 73 73 GLU C C 73 176.728 176.316 0.412 1
1 847 . 7 1 1 A 73 73 GLU CA C 73 54.950 57.086 -2.136 1
1 848 . 7 1 1 A 73 73 GLU CB C 73 30.390 30.546 -0.156 1
1 850 . 7 1 1 A 73 73 GLU N N 73 120.043 118.680 1.363 1
1 851 . 7 1 1 A 74 74 GLU H H 74 9.360 8.444 0.916 1
1 852 . 7 1 1 A 74 74 GLU HA H 74 4.403 4.729 -0.326 1
1 857 . 7 1 1 A 74 74 GLU C C 74 178.234 177.333 0.901 1
1 858 . 7 1 1 A 74 74 GLU CA C 74 56.516 55.770 0.746 1
1 859 . 7 1 1 A 74 74 GLU CB C 74 30.390 31.797 -1.407 1
1 861 . 7 1 1 A 74 74 GLU N N 74 122.193 121.987 0.206 1
1 862 . 7 1 1 A 75 75 HIS H H 75 9.553 9.272 0.281 1
1 863 . 7 1 1 A 75 75 HIS HA H 75 4.080 4.157 -0.077 1
1 868 . 7 1 1 A 75 75 HIS C C 75 175.985 176.756 -0.771 1
1 869 . 7 1 1 A 75 75 HIS CA C 75 61.016 60.815 0.201 1
1 870 . 7 1 1 A 75 75 HIS CB C 75 29.468 30.657 -1.189 1
1 873 . 7 1 1 A 75 75 HIS N N 75 123.587 127.473 -3.886 1
1 874 . 7 1 1 A 76 76 ALA H H 76 9.129 8.345 0.784 1
1 875 . 7 1 1 A 76 76 ALA HA H 76 3.826 3.850 -0.024 1
1 879 . 7 1 1 A 76 76 ALA C C 76 180.475 179.373 1.102 1
1 880 . 7 1 1 A 76 76 ALA CA C 76 55.392 54.904 0.488 1
1 881 . 7 1 1 A 76 76 ALA CB C 76 18.182 18.169 0.013 1
1 882 . 7 1 1 A 76 76 ALA N N 76 117.795 120.842 -3.047 1
1 883 . 7 1 1 A 77 77 GLN H H 77 7.099 7.485 -0.386 1
1 884 . 7 1 1 A 77 77 GLN HA H 77 4.198 4.133 0.065 1
1 891 . 7 1 1 A 77 77 GLN C C 77 177.860 178.705 -0.845 1
1 892 . 7 1 1 A 77 77 GLN CA C 77 57.790 58.522 -0.732 1
1 893 . 7 1 1 A 77 77 GLN CB C 77 28.536 28.524 0.012 1
1 895 . 7 1 1 A 77 77 GLN N N 77 115.764 117.141 -1.377 1
1 897 . 7 1 1 A 78 78 VAL H H 78 7.430 7.975 -0.545 1
1 898 . 7 1 1 A 78 78 VAL HA H 78 3.241 3.555 -0.314 1
1 906 . 7 1 1 A 78 78 VAL C C 78 177.042 177.901 -0.859 1
1 907 . 7 1 1 A 78 78 VAL CA C 78 67.299 66.230 1.069 1
1 908 . 7 1 1 A 78 78 VAL CB C 78 30.819 31.673 -0.854 1
1 911 . 7 1 1 A 78 78 VAL N N 78 121.143 120.145 0.998 1
1 912 . 7 1 1 A 79 79 VAL H H 79 7.773 8.287 -0.514 1
1 913 . 7 1 1 A 79 79 VAL HA H 79 3.315 3.614 -0.299 1
1 921 . 7 1 1 A 79 79 VAL C C 79 179.179 177.837 1.342 1
1 922 . 7 1 1 A 79 79 VAL CA C 79 66.694 65.198 1.496 1
1 923 . 7 1 1 A 79 79 VAL CB C 79 31.841 31.325 0.516 1
1 926 . 7 1 1 A 79 79 VAL N N 79 117.473 119.483 -2.010 1
1 927 . 7 1 1 A 80 80 GLU H H 80 7.410 7.919 -0.509 1
1 928 . 7 1 1 A 80 80 GLU HA H 80 4.258 4.024 0.234 1
1 933 . 7 1 1 A 80 80 GLU C C 80 178.018 178.946 -0.928 1
1 934 . 7 1 1 A 80 80 GLU CA C 80 58.566 59.171 -0.605 1
1 935 . 7 1 1 A 80 80 GLU CB C 80 29.072 29.408 -0.336 1
1 937 . 7 1 1 A 80 80 GLU N N 80 120.451 121.235 -0.784 1
1 938 . 7 1 1 A 81 81 LEU H H 81 8.070 8.305 -0.235 1
1 939 . 7 1 1 A 81 81 LEU HA H 81 3.976 4.020 -0.044 1
1 949 . 7 1 1 A 81 81 LEU C C 81 180.658 179.158 1.500 1
1 950 . 7 1 1 A 81 81 LEU CA C 81 58.061 58.154 -0.093 1
1 951 . 7 1 1 A 81 81 LEU CB C 81 42.115 41.712 0.403 1
1 955 . 7 1 1 A 81 81 LEU N N 81 119.943 119.870 0.073 1
1 956 . 7 1 1 A 82 82 VAL H H 82 7.609 8.037 -0.428 1
1 957 . 7 1 1 A 82 82 VAL HA H 82 3.474 3.937 -0.463 1
1 965 . 7 1 1 A 82 82 VAL C C 82 178.927 178.216 0.711 1
1 966 . 7 1 1 A 82 82 VAL CA C 82 67.398 67.144 0.254 1
1 967 . 7 1 1 A 82 82 VAL CB C 82 31.306 31.224 0.082 1
1 970 . 7 1 1 A 82 82 VAL N N 82 118.150 120.024 -1.874 1
1 971 . 7 1 1 A 83 83 ARG H H 83 8.186 8.038 0.148 1
1 972 . 7 1 1 A 83 83 ARG HA H 83 3.994 4.027 -0.033 1
1 979 . 7 1 1 A 83 83 ARG C C 83 179.999 179.165 0.834 1
1 980 . 7 1 1 A 83 83 ARG CA C 83 60.205 60.039 0.166 1
1 981 . 7 1 1 A 83 83 ARG CB C 83 30.103 29.927 0.176 1
1 984 . 7 1 1 A 83 83 ARG N N 83 122.902 119.197 3.705 1
1 985 . 7 1 1 A 84 84 LYS H H 84 8.772 8.099 0.673 1
1 986 . 7 1 1 A 84 84 LYS HA H 84 4.047 4.106 -0.059 1
1 995 . 7 1 1 A 84 84 LYS C C 84 176.934 178.931 -1.997 1
1 996 . 7 1 1 A 84 84 LYS CA C 84 58.142 59.092 -0.950 1
1 997 . 7 1 1 A 84 84 LYS CB C 84 32.492 31.745 0.747 1
1 1001 . 7 1 1 A 84 84 LYS N N 84 117.548 119.132 -1.584 1
1 1002 . 7 1 1 A 85 85 SER H H 85 7.333 7.823 -0.490 1
1 1003 . 7 1 1 A 85 85 SER HA H 85 4.235 4.213 0.022 1
1 1006 . 7 1 1 A 85 85 SER C C 85 175.588 175.218 0.370 1
1 1007 . 7 1 1 A 85 85 SER CA C 85 59.535 61.268 -1.733 1
1 1008 . 7 1 1 A 85 85 SER CB C 85 63.571 63.604 -0.033 1
1 1009 . 7 1 1 A 85 85 SER N N 85 113.544 115.848 -2.304 1
1 1010 . 7 1 1 A 86 86 GLY H H 86 7.459 7.875 -0.416 1
1 1011 . 7 1 1 A 86 86 GLY HA2 H 86 4.176 4.037 0.139 1
1 1012 . 7 1 1 A 86 86 GLY HA3 H 86 3.762 4.039 -0.277 1
1 1013 . 7 1 1 A 86 86 GLY C C 86 176.407 175.401 1.006 1
1 1014 . 7 1 1 A 86 86 GLY CA C 86 46.109 45.690 0.419 1
1 1015 . 7 1 1 A 86 86 GLY N N 86 104.331 107.550 -3.219 1
1 1016 . 7 1 1 A 87 87 ASN HA H 87 4.650 4.821 -0.171 1
1 1021 . 7 1 1 A 87 87 ASN C C 87 173.653 175.660 -2.007 1
1 1022 . 7 1 1 A 87 87 ASN CA C 87 54.492 54.763 -0.271 1
1 1023 . 7 1 1 A 87 87 ASN CB C 87 38.425 39.717 -1.292 1
1 1024 . 7 1 1 A 87 87 ASN N N 87 118.401 125.169 -6.768 1
1 1026 . 7 1 1 A 88 88 SER H H 88 7.435 7.978 -0.543 1
1 1027 . 7 1 1 A 88 88 SER HA H 88 5.438 5.242 0.196 1
1 1030 . 7 1 1 A 88 88 SER C C 88 172.867 173.710 -0.843 1
1 1031 . 7 1 1 A 88 88 SER CA C 88 58.160 56.718 1.442 1
1 1032 . 7 1 1 A 88 88 SER CB C 88 65.861 64.775 1.086 1
1 1033 . 7 1 1 A 88 88 SER N N 88 113.765 112.383 1.382 1
1 1034 . 7 1 1 A 89 89 VAL H H 89 8.452 9.179 -0.727 1
1 1035 . 7 1 1 A 89 89 VAL HA H 89 4.519 4.982 -0.463 1
1 1043 . 7 1 1 A 89 89 VAL C C 89 171.391 174.809 -3.418 1
1 1044 . 7 1 1 A 89 89 VAL CA C 89 61.333 60.410 0.923 1
1 1045 . 7 1 1 A 89 89 VAL CB C 89 33.897 34.842 -0.945 1
1 1048 . 7 1 1 A 89 89 VAL N N 89 120.001 125.239 -5.238 1
1 1049 . 7 1 1 A 90 90 THR H H 90 8.348 8.832 -0.484 1
1 1050 . 7 1 1 A 90 90 THR HA H 90 5.042 5.168 -0.126 1
1 1055 . 7 1 1 A 90 90 THR C C 90 173.926 173.612 0.314 1
1 1056 . 7 1 1 A 90 90 THR CA C 90 61.403 61.818 -0.415 1
1 1057 . 7 1 1 A 90 90 THR CB C 90 69.553 70.290 -0.737 1
1 1059 . 7 1 1 A 90 90 THR N N 90 123.477 124.151 -0.674 1
1 1060 . 7 1 1 A 91 91 LEU H H 91 9.195 8.837 0.358 1
1 1061 . 7 1 1 A 91 91 LEU HA H 91 5.161 4.917 0.244 1
1 1071 . 7 1 1 A 91 91 LEU C C 91 174.564 175.404 -0.840 1
1 1072 . 7 1 1 A 91 91 LEU CA C 91 52.590 53.464 -0.874 1
1 1073 . 7 1 1 A 91 91 LEU CB C 91 44.998 46.084 -1.086 1
1 1077 . 7 1 1 A 91 91 LEU N N 91 128.419 127.021 1.398 1
1 1078 . 7 1 1 A 92 92 LEU H H 92 8.644 8.691 -0.047 1
1 1079 . 7 1 1 A 92 92 LEU HA H 92 5.335 5.158 0.177 1
1 1089 . 7 1 1 A 92 92 LEU C C 92 176.451 175.577 0.874 1
1 1090 . 7 1 1 A 92 92 LEU CA C 92 54.220 53.575 0.645 1
1 1091 . 7 1 1 A 92 92 LEU CB C 92 44.323 42.631 1.692 1
1 1095 . 7 1 1 A 92 92 LEU N N 92 125.894 124.712 1.182 1
1 1096 . 7 1 1 A 93 93 VAL H H 93 9.249 9.143 0.106 1
1 1097 . 7 1 1 A 93 93 VAL HA H 93 5.573 5.253 0.320 1
1 1105 . 7 1 1 A 93 93 VAL C C 93 173.550 174.254 -0.704 1
1 1106 . 7 1 1 A 93 93 VAL CA C 93 58.340 60.672 -2.332 1
1 1107 . 7 1 1 A 93 93 VAL CB C 93 36.159 33.861 2.298 1
1 1110 . 7 1 1 A 93 93 VAL N N 93 120.660 120.988 -0.328 1
1 1111 . 7 1 1 A 94 94 LEU H H 94 8.634 8.683 -0.049 1
1 1112 . 7 1 1 A 94 94 LEU HA H 94 4.911 5.218 -0.307 1
1 1122 . 7 1 1 A 94 94 LEU C C 94 174.172 175.553 -1.381 1
1 1123 . 7 1 1 A 94 94 LEU CA C 94 52.659 53.260 -0.601 1
1 1124 . 7 1 1 A 94 94 LEU CB C 94 47.910 45.958 1.952 1
1 1128 . 7 1 1 A 94 94 LEU N N 94 120.304 127.772 -7.468 1
1 1129 . 7 1 1 A 95 95 ASP H H 95 8.210 8.655 -0.445 1
1 1130 . 7 1 1 A 95 95 ASP HA H 95 5.190 4.705 0.485 1
1 1133 . 7 1 1 A 95 95 ASP C C 95 175.887 177.400 -1.513 1
1 1134 . 7 1 1 A 95 95 ASP CA C 95 53.899 53.718 0.181 1
1 1135 . 7 1 1 A 95 95 ASP CB C 95 41.188 41.458 -0.270 1
1 1136 . 7 1 1 A 95 95 ASP N N 95 122.184 123.788 -1.604 1
1 1137 . 7 1 1 A 96 96 GLY H H 96 8.478 8.831 -0.353 1
1 1138 . 7 1 1 A 96 96 GLY HA2 H 96 4.002 3.766 0.236 1
1 1139 . 7 1 1 A 96 96 GLY HA3 H 96 3.757 3.802 -0.045 1
1 1140 . 7 1 1 A 96 96 GLY C C 96 175.497 175.453 0.044 1
1 1141 . 7 1 1 A 96 96 GLY CA C 96 49.944 47.806 2.138 1
1 1142 . 7 1 1 A 96 96 GLY N N 96 108.610 108.988 -0.378 1
1 1143 . 7 1 1 A 97 97 ASP H H 97 8.401 8.006 0.395 1
1 1144 . 7 1 1 A 97 97 ASP HA H 97 4.454 4.293 0.161 1
1 1147 . 7 1 1 A 97 97 ASP C C 97 179.612 178.209 1.403 1
1 1148 . 7 1 1 A 97 97 ASP CA C 97 57.913 57.001 0.912 1
1 1149 . 7 1 1 A 97 97 ASP CB C 97 41.145 40.209 0.936 1
1 1150 . 7 1 1 A 97 97 ASP N N 97 120.034 121.844 -1.810 1
1 1151 . 7 1 1 A 98 98 SER H H 98 8.152 7.683 0.469 1
1 1152 . 7 1 1 A 98 98 SER HA H 98 4.218 3.797 0.421 1
1 1155 . 7 1 1 A 98 98 SER C C 98 175.061 175.624 -0.563 1
1 1156 . 7 1 1 A 98 98 SER CA C 98 62.180 61.660 0.520 1
1 1157 . 7 1 1 A 98 98 SER CB C 98 62.179 62.347 -0.168 1
1 1158 . 7 1 1 A 98 98 SER N N 98 117.174 115.811 1.363 1
1 1159 . 7 1 1 A 99 99 TYR H H 99 9.051 8.321 0.730 1
1 1160 . 7 1 1 A 99 99 TYR HA H 99 3.692 3.892 -0.200 1
1 1167 . 7 1 1 A 99 99 TYR C C 99 176.460 177.186 -0.726 1
1 1168 . 7 1 1 A 99 99 TYR CA C 99 62.814 61.902 0.912 1
1 1169 . 7 1 1 A 99 99 TYR CB C 99 38.829 38.717 0.112 1
1 1174 . 7 1 1 A 99 99 TYR N N 99 123.539 122.803 0.736 1
1 1175 . 7 1 1 A 100 100 GLU H H 100 8.520 8.878 -0.358 1
1 1176 . 7 1 1 A 100 100 GLU HA H 100 3.952 3.993 -0.041 1
1 1181 . 7 1 1 A 100 100 GLU C C 100 180.151 179.015 1.136 1
1 1182 . 7 1 1 A 100 100 GLU CA C 100 60.099 59.796 0.303 1
1 1183 . 7 1 1 A 100 100 GLU CB C 100 29.435 29.125 0.310 1
1 1185 . 7 1 1 A 100 100 GLU N N 100 117.082 118.661 -1.579 1
1 1186 . 7 1 1 A 101 101 LYS H H 101 7.740 7.464 0.276 1
1 1187 . 7 1 1 A 101 101 LYS HA H 101 3.984 4.035 -0.051 1
1 1196 . 7 1 1 A 101 101 LYS C C 101 178.377 178.498 -0.121 1
1 1197 . 7 1 1 A 101 101 LYS CA C 101 59.888 59.398 0.490 1
1 1198 . 7 1 1 A 101 101 LYS CB C 101 32.821 32.426 0.395 1
1 1202 . 7 1 1 A 101 101 LYS N N 101 119.851 120.834 -0.983 1
1 1203 . 7 1 1 A 102 102 ALA H H 102 8.538 8.221 0.317 1
1 1204 . 7 1 1 A 102 102 ALA HA H 102 3.632 4.186 -0.554 1
1 1208 . 7 1 1 A 102 102 ALA C C 102 179.870 180.028 -0.158 1
1 1209 . 7 1 1 A 102 102 ALA CA C 102 55.285 55.310 -0.025 1
1 1210 . 7 1 1 A 102 102 ALA CB C 102 17.163 18.442 -1.279 1
1 1211 . 7 1 1 A 102 102 ALA N N 102 124.176 121.188 2.988 1
1 1212 . 7 1 1 A 103 103 VAL H H 103 8.147 7.947 0.200 1
1 1213 . 7 1 1 A 103 103 VAL HA H 103 3.658 3.590 0.068 1
1 1221 . 7 1 1 A 103 103 VAL C C 103 181.113 177.988 3.125 1
1 1222 . 7 1 1 A 103 103 VAL CA C 103 66.090 67.107 -1.017 1
1 1223 . 7 1 1 A 103 103 VAL CB C 103 31.822 31.630 0.192 1
1 1226 . 7 1 1 A 103 103 VAL N N 103 117.841 118.483 -0.642 1
1 1227 . 7 1 1 A 104 104 LYS H H 104 7.903 7.856 0.047 1
1 1228 . 7 1 1 A 104 104 LYS HA H 104 4.065 3.957 0.108 1
1 1235 . 7 1 1 A 104 104 LYS C C 104 177.715 178.383 -0.668 1
1 1236 . 7 1 1 A 104 104 LYS CA C 104 59.094 60.159 -1.065 1
1 1237 . 7 1 1 A 104 104 LYS CB C 104 32.285 32.389 -0.104 1
1 1241 . 7 1 1 A 104 104 LYS N N 104 121.515 119.132 2.383 1
1 1242 . 7 1 1 A 105 105 ASN H H 105 7.747 7.871 -0.124 1
1 1243 . 7 1 1 A 105 105 ASN HA H 105 4.721 4.860 -0.139 1
1 1248 . 7 1 1 A 105 105 ASN C C 105 173.320 174.033 -0.713 1
1 1249 . 7 1 1 A 105 105 ASN CA C 105 53.399 53.046 0.353 1
1 1250 . 7 1 1 A 105 105 ASN CB C 105 39.249 38.499 0.750 1
1 1251 . 7 1 1 A 105 105 ASN N N 105 114.941 114.983 -0.042 1
1 1253 . 7 1 1 A 106 106 GLN H H 106 7.850 8.036 -0.186 1
1 1254 . 7 1 1 A 106 106 GLN HA H 106 3.902 3.847 0.055 1
1 1261 . 7 1 1 A 106 106 GLN C C 106 175.168 175.025 0.143 1
1 1262 . 7 1 1 A 106 106 GLN CA C 106 56.978 56.823 0.155 1
1 1263 . 7 1 1 A 106 106 GLN CB C 106 25.770 27.274 -1.504 1
1 1265 . 7 1 1 A 106 106 GLN N N 106 114.989 115.804 -0.815 1
1 1267 . 7 1 1 A 107 107 VAL H H 107 8.005 8.048 -0.043 1
1 1268 . 7 1 1 A 107 107 VAL HA H 107 3.664 4.042 -0.378 1
1 1276 . 7 1 1 A 107 107 VAL C C 107 175.468 174.981 0.487 1
1 1277 . 7 1 1 A 107 107 VAL CA C 107 62.726 62.925 -0.199 1
1 1278 . 7 1 1 A 107 107 VAL CB C 107 32.535 32.235 0.300 1
1 1281 . 7 1 1 A 107 107 VAL N N 107 120.216 120.219 -0.003 1
1 1282 . 7 1 1 A 108 108 ASP H H 108 8.484 8.679 -0.195 1
1 1283 . 7 1 1 A 108 108 ASP HA H 108 4.467 4.573 -0.106 1
1 1286 . 7 1 1 A 108 108 ASP C C 108 177.179 175.755 1.424 1
1 1287 . 7 1 1 A 108 108 ASP CA C 108 53.417 54.636 -1.219 1
1 1288 . 7 1 1 A 108 108 ASP CB C 108 40.030 40.309 -0.279 1
1 1289 . 7 1 1 A 108 108 ASP N N 108 125.414 126.184 -0.770 1
1 1290 . 7 1 1 A 109 109 LEU H H 109 8.470 8.506 -0.036 1
1 1291 . 7 1 1 A 109 109 LEU HA H 109 3.846 4.085 -0.239 1
1 1301 . 7 1 1 A 109 109 LEU C C 109 178.145 178.584 -0.439 1
1 1302 . 7 1 1 A 109 109 LEU CA C 109 56.573 57.255 -0.682 1
1 1303 . 7 1 1 A 109 109 LEU CB C 109 42.011 41.472 0.539 1
1 1307 . 7 1 1 A 109 109 LEU N N 109 127.577 126.658 0.919 1
1 1308 . 7 1 1 A 110 110 LYS H H 110 8.062 7.956 0.106 1
1 1309 . 7 1 1 A 110 110 LYS HA H 110 3.022 3.388 -0.366 1
1 1317 . 7 1 1 A 110 110 LYS C C 110 177.248 179.829 -2.581 1
1 1318 . 7 1 1 A 110 110 LYS CA C 110 58.742 59.959 -1.217 1
1 1319 . 7 1 1 A 110 110 LYS CB C 110 31.667 31.633 0.034 1
1 1323 . 7 1 1 A 110 110 LYS N N 110 118.873 118.479 0.394 1
1 1324 . 7 1 1 A 111 111 GLU H H 111 7.113 8.028 -0.915 1
1 1325 . 7 1 1 A 111 111 GLU HA H 111 4.117 4.067 0.050 1
1 1330 . 7 1 1 A 111 111 GLU C C 111 176.519 177.686 -1.167 1
1 1331 . 7 1 1 A 111 111 GLU CA C 111 55.621 59.115 -3.494 1
1 1332 . 7 1 1 A 111 111 GLU CB C 111 29.943 29.125 0.818 1
1 1334 . 7 1 1 A 111 111 GLU N N 111 114.282 120.034 -5.752 1
1 1335 . 7 1 1 A 112 112 LEU H H 112 6.848 7.386 -0.538 1
1 1336 . 7 1 1 A 112 112 LEU HA H 112 4.293 4.160 0.133 1
1 1346 . 7 1 1 A 112 112 LEU C C 112 175.674 176.019 -0.345 1
1 1347 . 7 1 1 A 112 112 LEU CA C 112 55.197 55.987 -0.790 1
1 1348 . 7 1 1 A 112 112 LEU CB C 112 41.681 41.960 -0.279 1
1 1352 . 7 1 1 A 112 112 LEU N N 112 118.934 122.252 -3.318 1
1 1353 . 7 1 1 A 113 113 ASP H H 113 8.466 8.345 0.121 1
1 1354 . 7 1 1 A 113 113 ASP HA H 113 4.593 5.442 -0.849 1
1 1357 . 7 1 1 A 113 113 ASP C C 113 174.511 175.578 -1.067 1
1 1358 . 7 1 1 A 113 113 ASP CA C 113 53.558 52.563 0.995 1
1 1359 . 7 1 1 A 113 113 ASP CB C 113 42.448 42.199 0.249 1
1 1360 . 7 1 1 A 113 113 ASP N N 113 122.148 124.511 -2.363 1
1 1 . 8 1 1 A 6 6 SER HA H 6 4.483 4.110 0.373 1
1 4 . 8 1 1 A 6 6 SER C C 6 175.167 174.528 0.639 1
1 5 . 8 1 1 A 6 6 SER CA C 6 58.759 59.091 -0.332 1
1 6 . 8 1 1 A 6 6 SER CB C 6 64.069 61.482 2.587 1
1 7 . 8 1 1 A 7 7 GLY H H 7 8.431 8.162 0.269 1
1 8 . 8 1 1 A 7 7 GLY HA2 H 7 3.973 4.040 -0.067 1
1 9 . 8 1 1 A 7 7 GLY HA3 H 7 3.973 4.041 -0.068 1
1 10 . 8 1 1 A 7 7 GLY C C 7 174.570 172.954 1.616 1
1 11 . 8 1 1 A 7 7 GLY CA C 7 45.483 46.061 -0.578 1
1 12 . 8 1 1 A 7 7 GLY N N 7 110.640 107.768 2.872 1
1 13 . 8 1 1 A 8 8 MET H H 8 8.239 8.251 -0.012 1
1 14 . 8 1 1 A 8 8 MET HA H 8 4.386 4.891 -0.505 1
1 22 . 8 1 1 A 8 8 MET C C 8 176.621 175.190 1.431 1
1 23 . 8 1 1 A 8 8 MET CA C 8 55.991 54.203 1.788 1
1 24 . 8 1 1 A 8 8 MET CB C 8 32.986 35.287 -2.301 1
1 27 . 8 1 1 A 8 8 MET N N 8 120.219 121.651 -1.432 1
1 28 . 8 1 1 A 9 9 ALA H H 9 8.435 8.425 0.010 1
1 29 . 8 1 1 A 9 9 ALA HA H 9 4.182 4.297 -0.115 1
1 33 . 8 1 1 A 9 9 ALA C C 9 177.951 177.102 0.849 1
1 34 . 8 1 1 A 9 9 ALA CA C 9 53.399 52.155 1.244 1
1 35 . 8 1 1 A 9 9 ALA CB C 9 18.955 19.181 -0.226 1
1 36 . 8 1 1 A 9 9 ALA N N 9 124.459 126.636 -2.177 1
1 37 . 8 1 1 A 10 10 SER H H 10 8.100 8.673 -0.573 1
1 38 . 8 1 1 A 10 10 SER HA H 10 4.391 4.347 0.044 1
1 41 . 8 1 1 A 10 10 SER C C 10 174.467 173.599 0.868 1
1 42 . 8 1 1 A 10 10 SER CA C 10 58.709 58.879 -0.170 1
1 43 . 8 1 1 A 10 10 SER CB C 10 63.778 63.424 0.354 1
1 44 . 8 1 1 A 10 10 SER N N 10 113.881 118.809 -4.928 1
1 45 . 8 1 1 A 11 11 THR H H 11 7.821 8.154 -0.333 1
1 46 . 8 1 1 A 11 11 THR HA H 11 4.191 4.796 -0.605 1
1 51 . 8 1 1 A 11 11 THR C C 11 173.610 171.837 1.773 1
1 52 . 8 1 1 A 11 11 THR CA C 11 61.936 60.264 1.672 1
1 53 . 8 1 1 A 11 11 THR CB C 11 69.713 71.506 -1.793 1
1 55 . 8 1 1 A 11 11 THR N N 11 114.471 119.067 -4.596 1
1 56 . 8 1 1 A 12 12 PHE H H 12 7.946 9.161 -1.215 1
1 57 . 8 1 1 A 12 12 PHE HA H 12 4.769 5.195 -0.426 1
1 65 . 8 1 1 A 12 12 PHE C C 12 174.211 174.159 0.052 1
1 66 . 8 1 1 A 12 12 PHE CA C 12 56.644 55.987 0.657 1
1 67 . 8 1 1 A 12 12 PHE CB C 12 40.609 43.087 -2.478 1
1 73 . 8 1 1 A 12 12 PHE N N 12 120.763 124.307 -3.544 1
1 74 . 8 1 1 A 13 13 ASN H H 13 9.004 9.076 -0.072 1
1 75 . 8 1 1 A 13 13 ASN HA H 13 5.366 5.394 -0.028 1
1 80 . 8 1 1 A 13 13 ASN C C 13 172.158 174.340 -2.182 1
1 81 . 8 1 1 A 13 13 ASN CA C 13 50.988 50.792 0.196 1
1 82 . 8 1 1 A 13 13 ASN CB C 13 39.942 38.967 0.975 1
1 83 . 8 1 1 A 13 13 ASN N N 13 119.973 119.418 0.555 1
1 85 . 8 1 1 A 14 14 PRO HA H 14 4.945 4.590 0.355 1
1 92 . 8 1 1 A 14 14 PRO C C 14 174.901 176.184 -1.283 1
1 93 . 8 1 1 A 14 14 PRO CA C 14 63.096 62.683 0.413 1
1 94 . 8 1 1 A 14 14 PRO CB C 14 32.739 32.347 0.392 1
1 97 . 8 1 1 A 15 15 ARG H H 15 8.908 8.637 0.271 1
1 98 . 8 1 1 A 15 15 ARG HA H 15 4.626 4.776 -0.150 1
1 106 . 8 1 1 A 15 15 ARG C C 15 174.432 174.833 -0.401 1
1 107 . 8 1 1 A 15 15 ARG CA C 15 54.827 55.271 -0.444 1
1 108 . 8 1 1 A 15 15 ARG CB C 15 32.439 32.464 -0.025 1
1 111 . 8 1 1 A 15 15 ARG N N 15 118.947 121.775 -2.828 1
1 113 . 8 1 1 A 16 16 GLU H H 16 8.838 8.682 0.156 1
1 114 . 8 1 1 A 16 16 GLU HA H 16 4.876 4.997 -0.121 1
1 119 . 8 1 1 A 16 16 GLU C C 16 175.767 175.169 0.598 1
1 120 . 8 1 1 A 16 16 GLU CA C 16 55.621 55.763 -0.142 1
1 121 . 8 1 1 A 16 16 GLU CB C 16 31.093 31.672 -0.579 1
1 123 . 8 1 1 A 16 16 GLU N N 16 125.316 122.729 2.587 1
1 124 . 8 1 1 A 17 17 CYS H H 17 9.327 8.875 0.452 1
1 125 . 8 1 1 A 17 17 CYS HA H 17 4.804 5.249 -0.445 1
1 128 . 8 1 1 A 17 17 CYS C C 17 172.973 172.946 0.027 1
1 129 . 8 1 1 A 17 17 CYS CA C 17 57.930 57.343 0.587 1
1 130 . 8 1 1 A 17 17 CYS CB C 17 30.105 31.544 -1.439 1
1 131 . 8 1 1 A 17 17 CYS N N 17 127.909 123.560 4.349 1
1 132 . 8 1 1 A 18 18 LYS H H 18 9.022 8.879 0.143 1
1 133 . 8 1 1 A 18 18 LYS HA H 18 4.769 4.778 -0.009 1
1 142 . 8 1 1 A 18 18 LYS C C 18 174.586 175.202 -0.616 1
1 143 . 8 1 1 A 18 18 LYS CA C 18 55.956 55.041 0.915 1
1 144 . 8 1 1 A 18 18 LYS CB C 18 32.203 34.215 -2.012 1
1 148 . 8 1 1 A 18 18 LYS N N 18 127.039 124.844 2.195 1
1 149 . 8 1 1 A 19 19 LEU H H 19 8.784 9.003 -0.219 1
1 150 . 8 1 1 A 19 19 LEU HA H 19 4.852 5.032 -0.180 1
1 160 . 8 1 1 A 19 19 LEU C C 19 176.862 176.009 0.853 1
1 161 . 8 1 1 A 19 19 LEU CA C 19 55.391 53.492 1.899 1
1 162 . 8 1 1 A 19 19 LEU CB C 19 44.442 43.420 1.022 1
1 166 . 8 1 1 A 19 19 LEU N N 19 126.311 126.873 -0.562 1
1 167 . 8 1 1 A 20 20 SER H H 20 8.215 8.866 -0.651 1
1 168 . 8 1 1 A 20 20 SER HA H 20 5.461 5.535 -0.074 1
1 171 . 8 1 1 A 20 20 SER C C 20 171.960 173.389 -1.429 1
1 172 . 8 1 1 A 20 20 SER CA C 20 57.525 56.767 0.758 1
1 173 . 8 1 1 A 20 20 SER CB C 20 65.794 65.916 -0.122 1
1 174 . 8 1 1 A 20 20 SER N N 20 115.113 117.886 -2.773 1
1 175 . 8 1 1 A 21 21 LYS H H 21 9.001 8.663 0.338 1
1 176 . 8 1 1 A 21 21 LYS HA H 21 4.887 4.989 -0.102 1
1 185 . 8 1 1 A 21 21 LYS C C 21 174.133 175.346 -1.213 1
1 186 . 8 1 1 A 21 21 LYS CA C 21 53.840 53.931 -0.091 1
1 187 . 8 1 1 A 21 21 LYS CB C 21 36.553 35.744 0.809 1
1 191 . 8 1 1 A 21 21 LYS N N 21 120.938 121.204 -0.266 1
1 192 . 8 1 1 A 22 22 GLN H H 22 8.201 8.201 0.000 1
1 193 . 8 1 1 A 22 22 GLN HA H 22 4.448 4.554 -0.106 1
1 200 . 8 1 1 A 22 22 GLN C C 22 176.372 175.464 0.908 1
1 201 . 8 1 1 A 22 22 GLN CA C 22 53.658 54.945 -1.287 1
1 202 . 8 1 1 A 22 22 GLN CB C 22 30.473 30.133 0.340 1
1 204 . 8 1 1 A 22 22 GLN N N 22 116.816 119.223 -2.407 1
1 206 . 8 1 1 A 23 23 GLU H H 23 8.624 8.668 -0.044 1
1 207 . 8 1 1 A 23 23 GLU HA H 23 4.056 4.297 -0.241 1
1 212 . 8 1 1 A 23 23 GLU C C 23 177.778 177.100 0.678 1
1 213 . 8 1 1 A 23 23 GLU CA C 23 58.001 57.022 0.979 1
1 214 . 8 1 1 A 23 23 GLU CB C 23 29.237 30.390 -1.153 1
1 216 . 8 1 1 A 23 23 GLU N N 23 122.364 122.378 -0.014 1
1 217 . 8 1 1 A 24 24 GLY H H 24 8.962 8.798 0.164 1
1 218 . 8 1 1 A 24 24 GLY HA2 H 24 4.139 3.987 0.152 1
1 219 . 8 1 1 A 24 24 GLY HA3 H 24 3.711 3.989 -0.278 1
1 220 . 8 1 1 A 24 24 GLY C C 24 173.857 174.298 -0.441 1
1 221 . 8 1 1 A 24 24 GLY CA C 24 45.288 45.008 0.280 1
1 222 . 8 1 1 A 24 24 GLY N N 24 113.942 114.829 -0.887 1
1 223 . 8 1 1 A 25 25 GLN H H 25 7.643 7.833 -0.190 1
1 224 . 8 1 1 A 25 25 GLN HA H 25 4.488 4.363 0.125 1
1 231 . 8 1 1 A 25 25 GLN C C 25 174.727 175.411 -0.684 1
1 232 . 8 1 1 A 25 25 GLN CA C 25 54.052 55.253 -1.201 1
1 233 . 8 1 1 A 25 25 GLN CB C 25 30.843 30.054 0.789 1
1 235 . 8 1 1 A 25 25 GLN N N 25 119.538 121.216 -1.678 1
1 237 . 8 1 1 A 26 26 ASN H H 26 8.625 8.883 -0.258 1
1 238 . 8 1 1 A 26 26 ASN HA H 26 4.862 4.836 0.026 1
1 243 . 8 1 1 A 26 26 ASN C C 26 176.261 176.241 0.020 1
1 244 . 8 1 1 A 26 26 ASN CA C 26 51.812 52.912 -1.100 1
1 245 . 8 1 1 A 26 26 ASN CB C 26 40.403 39.621 0.782 1
1 246 . 8 1 1 A 26 26 ASN N N 26 120.047 122.451 -2.404 1
1 248 . 8 1 1 A 27 27 TYR HA H 27 4.152 4.463 -0.311 1
1 255 . 8 1 1 A 27 27 TYR C C 27 176.731 175.782 0.949 1
1 256 . 8 1 1 A 27 27 TYR CA C 27 62.462 60.992 1.470 1
1 257 . 8 1 1 A 27 27 TYR CB C 27 40.240 39.245 0.995 1
1 262 . 8 1 1 A 27 27 TYR N N 27 121.761 121.495 0.266 1
1 263 . 8 1 1 A 28 28 GLY H H 28 8.285 7.782 0.503 1
1 264 . 8 1 1 A 28 28 GLY HA2 H 28 4.490 4.036 0.454 1
1 265 . 8 1 1 A 28 28 GLY HA3 H 28 3.759 4.102 -0.343 1
1 266 . 8 1 1 A 28 28 GLY C C 28 172.198 174.311 -2.113 1
1 267 . 8 1 1 A 28 28 GLY CA C 28 46.139 45.437 0.702 1
1 268 . 8 1 1 A 28 28 GLY N N 28 103.567 107.007 -3.440 1
1 269 . 8 1 1 A 29 29 PHE H H 29 6.878 7.970 -1.092 1
1 270 . 8 1 1 A 29 29 PHE HA H 29 5.179 5.032 0.147 1
1 278 . 8 1 1 A 29 29 PHE C C 29 172.840 173.834 -0.994 1
1 279 . 8 1 1 A 29 29 PHE CA C 29 55.262 55.233 0.029 1
1 280 . 8 1 1 A 29 29 PHE CB C 29 41.779 42.207 -0.428 1
1 286 . 8 1 1 A 29 29 PHE N N 29 111.027 117.516 -6.489 1
1 287 . 8 1 1 A 30 30 PHE H H 30 8.806 8.793 0.013 1
1 288 . 8 1 1 A 30 30 PHE HA H 30 4.923 4.738 0.185 1
1 296 . 8 1 1 A 30 30 PHE C C 30 174.501 174.969 -0.468 1
1 297 . 8 1 1 A 30 30 PHE CA C 30 55.356 56.340 -0.984 1
1 298 . 8 1 1 A 30 30 PHE CB C 30 41.681 42.040 -0.359 1
1 304 . 8 1 1 A 30 30 PHE N N 30 118.710 118.524 0.186 1
1 305 . 8 1 1 A 31 31 LEU H H 31 8.441 8.778 -0.337 1
1 306 . 8 1 1 A 31 31 LEU HA H 31 5.447 4.923 0.524 1
1 316 . 8 1 1 A 31 31 LEU C C 31 177.306 175.972 1.334 1
1 317 . 8 1 1 A 31 31 LEU CA C 31 53.610 54.175 -0.565 1
1 318 . 8 1 1 A 31 31 LEU CB C 31 43.696 41.171 2.525 1
1 322 . 8 1 1 A 31 31 LEU N N 31 123.765 124.085 -0.320 1
1 323 . 8 1 1 A 32 32 ARG H H 32 9.381 8.719 0.662 1
1 324 . 8 1 1 A 32 32 ARG HA H 32 4.840 4.993 -0.153 1
1 331 . 8 1 1 A 32 32 ARG C C 32 175.155 175.584 -0.429 1
1 332 . 8 1 1 A 32 32 ARG CA C 32 54.210 54.718 -0.508 1
1 333 . 8 1 1 A 32 32 ARG CB C 32 35.087 33.009 2.078 1
1 336 . 8 1 1 A 32 32 ARG N N 32 123.160 122.143 1.017 1
1 337 . 8 1 1 A 33 33 ILE H H 33 7.891 8.670 -0.779 1
1 338 . 8 1 1 A 33 33 ILE HA H 33 4.495 4.650 -0.155 1
1 348 . 8 1 1 A 33 33 ILE C C 33 175.850 175.295 0.555 1
1 349 . 8 1 1 A 33 33 ILE CA C 33 59.641 59.514 0.127 1
1 350 . 8 1 1 A 33 33 ILE CB C 33 39.538 39.203 0.335 1
1 354 . 8 1 1 A 33 33 ILE N N 33 118.924 120.053 -1.129 1
1 355 . 8 1 1 A 34 34 GLU H H 34 8.971 8.648 0.323 1
1 356 . 8 1 1 A 34 34 GLU HA H 34 4.578 4.751 -0.173 1
1 361 . 8 1 1 A 34 34 GLU C C 34 175.766 176.182 -0.416 1
1 362 . 8 1 1 A 34 34 GLU CA C 34 54.263 54.614 -0.351 1
1 363 . 8 1 1 A 34 34 GLU CB C 34 32.128 32.675 -0.547 1
1 365 . 8 1 1 A 34 34 GLU N N 34 125.447 121.988 3.459 1
1 366 . 8 1 1 A 35 35 LYS H H 35 8.504 8.660 -0.156 1
1 367 . 8 1 1 A 35 35 LYS HA H 35 4.026 4.261 -0.235 1
1 376 . 8 1 1 A 35 35 LYS C C 35 177.701 176.217 1.484 1
1 377 . 8 1 1 A 35 35 LYS CA C 35 57.591 56.171 1.420 1
1 378 . 8 1 1 A 35 35 LYS CB C 35 32.491 32.705 -0.214 1
1 382 . 8 1 1 A 35 35 LYS N N 35 122.893 121.160 1.733 1
1 383 . 8 1 1 A 36 36 ASP H H 36 9.020 8.856 0.164 1
1 384 . 8 1 1 A 36 36 ASP HA H 36 4.385 4.164 0.221 1
1 387 . 8 1 1 A 36 36 ASP C C 36 174.554 174.656 -0.102 1
1 388 . 8 1 1 A 36 36 ASP CA C 36 55.868 55.207 0.661 1
1 389 . 8 1 1 A 36 36 ASP CB C 36 39.826 39.514 0.312 1
1 390 . 8 1 1 A 36 36 ASP N N 36 121.412 119.833 1.579 1
1 391 . 8 1 1 A 37 37 THR H H 37 7.464 7.496 -0.032 1
1 392 . 8 1 1 A 37 37 THR HA H 37 4.454 4.853 -0.399 1
1 397 . 8 1 1 A 37 37 THR C C 37 172.012 173.203 -1.191 1
1 398 . 8 1 1 A 37 37 THR CA C 37 61.686 61.199 0.487 1
1 399 . 8 1 1 A 37 37 THR CB C 37 70.927 72.178 -1.251 1
1 401 . 8 1 1 A 37 37 THR N N 37 113.147 112.367 0.780 1
1 402 . 8 1 1 A 38 38 ASP H H 38 8.931 8.694 0.237 1
1 403 . 8 1 1 A 38 38 ASP HA H 38 4.852 4.718 0.134 1
1 406 . 8 1 1 A 38 38 ASP CA C 38 54.826 54.195 0.631 1
1 407 . 8 1 1 A 38 38 ASP CB C 38 43.332 42.098 1.234 1
1 408 . 8 1 1 A 38 38 ASP N N 38 120.401 125.106 -4.705 1
1 409 . 8 1 1 A 39 39 GLY H H 39 8.068 8.438 -0.370 1
1 410 . 8 1 1 A 39 39 GLY HA2 H 39 3.774 4.001 -0.227 1
1 411 . 8 1 1 A 39 39 GLY HA3 H 39 3.555 4.067 -0.512 1
1 412 . 8 1 1 A 39 39 GLY C C 39 172.578 173.431 -0.853 1
1 413 . 8 1 1 A 39 39 GLY CA C 39 43.967 44.818 -0.851 1
1 414 . 8 1 1 A 39 39 GLY N N 39 107.925 108.855 -0.930 1
1 415 . 8 1 1 A 40 40 HIS H H 40 9.111 8.604 0.507 1
1 416 . 8 1 1 A 40 40 HIS HA H 40 4.650 4.791 -0.141 1
1 421 . 8 1 1 A 40 40 HIS C C 40 174.330 175.256 -0.926 1
1 422 . 8 1 1 A 40 40 HIS CA C 40 55.886 56.504 -0.618 1
1 423 . 8 1 1 A 40 40 HIS CB C 40 30.507 30.600 -0.093 1
1 426 . 8 1 1 A 40 40 HIS N N 40 119.179 119.247 -0.068 1
1 427 . 8 1 1 A 41 41 LEU H H 41 8.254 9.044 -0.790 1
1 428 . 8 1 1 A 41 41 LEU HA H 41 4.626 5.368 -0.742 1
1 438 . 8 1 1 A 41 41 LEU C C 41 176.035 175.923 0.112 1
1 439 . 8 1 1 A 41 41 LEU CA C 41 55.621 53.330 2.291 1
1 440 . 8 1 1 A 41 41 LEU CB C 41 45.091 44.394 0.697 1
1 444 . 8 1 1 A 41 41 LEU N N 41 124.808 123.761 1.047 1
1 445 . 8 1 1 A 42 42 ILE H H 42 8.685 8.404 0.281 1
1 446 . 8 1 1 A 42 42 ILE HA H 42 4.578 4.767 -0.189 1
1 456 . 8 1 1 A 42 42 ILE C C 42 175.369 175.230 0.139 1
1 457 . 8 1 1 A 42 42 ILE CA C 42 59.852 60.900 -1.048 1
1 458 . 8 1 1 A 42 42 ILE CB C 42 36.778 38.039 -1.261 1
1 462 . 8 1 1 A 42 42 ILE N N 42 121.814 123.905 -2.091 1
1 463 . 8 1 1 A 43 43 ARG H H 43 8.787 8.495 0.292 1
1 464 . 8 1 1 A 43 43 ARG HA H 43 4.852 4.935 -0.083 1
1 472 . 8 1 1 A 43 43 ARG C C 43 174.029 175.163 -1.134 1
1 473 . 8 1 1 A 43 43 ARG CA C 43 52.730 54.622 -1.892 1
1 474 . 8 1 1 A 43 43 ARG CB C 43 36.983 33.804 3.179 1
1 477 . 8 1 1 A 43 43 ARG N N 43 125.771 128.137 -2.366 1
1 479 . 8 1 1 A 44 44 VAL H H 44 8.661 8.522 0.139 1
1 480 . 8 1 1 A 44 44 VAL HA H 44 3.276 3.691 -0.415 1
1 488 . 8 1 1 A 44 44 VAL C C 44 173.227 175.107 -1.880 1
1 489 . 8 1 1 A 44 44 VAL CA C 44 63.161 63.165 -0.004 1
1 490 . 8 1 1 A 44 44 VAL CB C 44 29.054 29.851 -0.797 1
1 493 . 8 1 1 A 44 44 VAL N N 44 117.026 119.486 -2.460 1
1 494 . 8 1 1 A 45 45 ILE H H 45 8.464 7.903 0.561 1
1 495 . 8 1 1 A 45 45 ILE HA H 45 4.579 4.249 0.330 1
1 505 . 8 1 1 A 45 45 ILE C C 45 178.108 175.005 3.103 1
1 506 . 8 1 1 A 45 45 ILE CA C 45 59.888 60.594 -0.706 1
1 507 . 8 1 1 A 45 45 ILE CB C 45 36.998 38.117 -1.119 1
1 511 . 8 1 1 A 45 45 ILE N N 45 122.767 122.133 0.634 1
1 512 . 8 1 1 A 46 46 GLU H H 46 9.015 8.832 0.183 1
1 513 . 8 1 1 A 46 46 GLU HA H 46 4.206 4.532 -0.326 1
1 518 . 8 1 1 A 46 46 GLU C C 46 177.746 176.089 1.657 1
1 519 . 8 1 1 A 46 46 GLU CA C 46 56.130 56.003 0.127 1
1 520 . 8 1 1 A 46 46 GLU CB C 46 30.581 30.651 -0.070 1
1 522 . 8 1 1 A 46 46 GLU N N 46 131.076 128.712 2.364 1
1 523 . 8 1 1 A 47 47 GLU H H 47 9.213 8.770 0.443 1
1 524 . 8 1 1 A 47 47 GLU HA H 47 4.194 4.150 0.044 1
1 529 . 8 1 1 A 47 47 GLU C C 47 178.088 177.449 0.639 1
1 530 . 8 1 1 A 47 47 GLU CA C 47 58.212 57.729 0.483 1
1 531 . 8 1 1 A 47 47 GLU CB C 47 29.390 30.057 -0.667 1
1 533 . 8 1 1 A 47 47 GLU N N 47 129.592 124.729 4.863 1
1 534 . 8 1 1 A 48 48 GLY H H 48 9.586 8.991 0.595 1
1 535 . 8 1 1 A 48 48 GLY HA2 H 48 4.141 3.895 0.246 1
1 536 . 8 1 1 A 48 48 GLY HA3 H 48 3.757 3.897 -0.140 1
1 537 . 8 1 1 A 48 48 GLY C C 48 173.790 173.995 -0.205 1
1 538 . 8 1 1 A 48 48 GLY CA C 48 45.764 46.071 -0.307 1
1 539 . 8 1 1 A 48 48 GLY N N 48 114.819 115.053 -0.234 1
1 540 . 8 1 1 A 49 49 SER H H 49 7.580 7.869 -0.289 1
1 541 . 8 1 1 A 49 49 SER HA H 49 4.728 4.931 -0.203 1
1 544 . 8 1 1 A 49 49 SER C C 49 173.542 174.380 -0.838 1
1 545 . 8 1 1 A 49 49 SER CA C 49 57.560 55.422 2.138 1
1 546 . 8 1 1 A 49 49 SER CB C 49 64.529 64.534 -0.005 1
1 547 . 8 1 1 A 49 49 SER N N 49 114.688 113.996 0.692 1
1 548 . 8 1 1 A 50 50 PRO HA H 50 4.431 4.561 -0.130 1
1 555 . 8 1 1 A 50 50 PRO C C 50 179.377 177.435 1.942 1
1 556 . 8 1 1 A 50 50 PRO CA C 50 66.059 64.310 1.749 1
1 557 . 8 1 1 A 50 50 PRO CB C 50 32.598 31.839 0.759 1
1 560 . 8 1 1 A 51 51 ALA H H 51 8.264 8.475 -0.211 1
1 561 . 8 1 1 A 51 51 ALA HA H 51 3.817 4.098 -0.281 1
1 565 . 8 1 1 A 51 51 ALA C C 51 177.508 179.701 -2.193 1
1 566 . 8 1 1 A 51 51 ALA CA C 51 55.392 54.121 1.271 1
1 567 . 8 1 1 A 51 51 ALA CB C 51 20.474 18.767 1.707 1
1 568 . 8 1 1 A 51 51 ALA N N 51 117.604 120.668 -3.064 1
1 569 . 8 1 1 A 52 52 GLU H H 52 7.794 7.417 0.377 1
1 570 . 8 1 1 A 52 52 GLU HA H 52 3.881 4.117 -0.236 1
1 575 . 8 1 1 A 52 52 GLU C C 52 181.401 178.656 2.745 1
1 576 . 8 1 1 A 52 52 GLU CA C 52 59.454 58.493 0.961 1
1 577 . 8 1 1 A 52 52 GLU CB C 52 30.247 29.836 0.411 1
1 579 . 8 1 1 A 52 52 GLU N N 52 119.474 117.949 1.525 1
1 580 . 8 1 1 A 53 53 LYS H H 53 8.557 7.929 0.628 1
1 581 . 8 1 1 A 53 53 LYS HA H 53 4.020 4.114 -0.094 1
1 588 . 8 1 1 A 53 53 LYS C C 53 177.939 177.303 0.636 1
1 589 . 8 1 1 A 53 53 LYS CA C 53 59.012 58.772 0.240 1
1 590 . 8 1 1 A 53 53 LYS CB C 53 32.438 31.719 0.719 1
1 594 . 8 1 1 A 53 53 LYS N N 53 120.057 117.915 2.142 1
1 595 . 8 1 1 A 54 54 ALA H H 54 7.764 7.491 0.273 1
1 596 . 8 1 1 A 54 54 ALA HA H 54 4.400 4.292 0.108 1
1 600 . 8 1 1 A 54 54 ALA C C 54 177.658 177.884 -0.226 1
1 601 . 8 1 1 A 54 54 ALA CA C 54 52.412 51.727 0.685 1
1 602 . 8 1 1 A 54 54 ALA CB C 54 20.739 18.158 2.581 1
1 603 . 8 1 1 A 54 54 ALA N N 54 117.678 120.987 -3.309 1
1 604 . 8 1 1 A 55 55 GLY H H 55 7.583 7.888 -0.305 1
1 605 . 8 1 1 A 55 55 GLY HA2 H 55 4.266 3.913 0.353 1
1 606 . 8 1 1 A 55 55 GLY HA3 H 55 3.775 3.917 -0.142 1
1 607 . 8 1 1 A 55 55 GLY C C 55 175.232 174.237 0.995 1
1 608 . 8 1 1 A 55 55 GLY CA C 55 45.368 46.352 -0.984 1
1 609 . 8 1 1 A 55 55 GLY N N 55 103.265 107.653 -4.388 1
1 610 . 8 1 1 A 56 56 LEU H H 56 7.280 7.562 -0.282 1
1 611 . 8 1 1 A 56 56 LEU HA H 56 3.984 4.374 -0.390 1
1 621 . 8 1 1 A 56 56 LEU C C 56 174.708 175.423 -0.715 1
1 622 . 8 1 1 A 56 56 LEU CA C 56 55.603 54.798 0.805 1
1 623 . 8 1 1 A 56 56 LEU CB C 56 42.752 42.169 0.583 1
1 627 . 8 1 1 A 56 56 LEU N N 56 119.211 123.360 -4.149 1
1 628 . 8 1 1 A 57 57 LEU H H 57 8.693 8.716 -0.023 1
1 629 . 8 1 1 A 57 57 LEU HA H 57 4.499 4.900 -0.401 1
1 639 . 8 1 1 A 57 57 LEU C C 57 176.124 176.114 0.010 1
1 640 . 8 1 1 A 57 57 LEU CA C 57 52.959 53.340 -0.381 1
1 641 . 8 1 1 A 57 57 LEU CB C 57 45.122 43.822 1.300 1
1 645 . 8 1 1 A 57 57 LEU N N 57 121.969 129.476 -7.507 1
1 646 . 8 1 1 A 58 58 ASP H H 58 8.334 8.683 -0.349 1
1 647 . 8 1 1 A 58 58 ASP HA H 58 4.139 4.881 -0.742 1
1 650 . 8 1 1 A 58 58 ASP C C 58 178.636 176.816 1.820 1
1 651 . 8 1 1 A 58 58 ASP CA C 58 56.079 55.195 0.884 1
1 652 . 8 1 1 A 58 58 ASP CB C 58 42.135 40.509 1.626 1
1 653 . 8 1 1 A 58 58 ASP N N 58 120.401 121.529 -1.128 1
1 654 . 8 1 1 A 59 59 GLY H H 59 9.378 8.610 0.768 1
1 655 . 8 1 1 A 59 59 GLY HA2 H 59 4.317 3.945 0.372 1
1 656 . 8 1 1 A 59 59 GLY HA3 H 59 3.260 3.947 -0.687 1
1 657 . 8 1 1 A 59 59 GLY C C 59 173.359 173.984 -0.625 1
1 658 . 8 1 1 A 59 59 GLY CA C 59 45.517 45.274 0.243 1
1 659 . 8 1 1 A 59 59 GLY N N 59 116.622 112.066 4.556 1
1 660 . 8 1 1 A 60 60 ASP H H 60 8.009 8.041 -0.032 1
1 661 . 8 1 1 A 60 60 ASP HA H 60 4.638 4.904 -0.266 1
1 664 . 8 1 1 A 60 60 ASP C C 60 175.555 175.497 0.058 1
1 665 . 8 1 1 A 60 60 ASP CA C 60 55.286 53.487 1.799 1
1 666 . 8 1 1 A 60 60 ASP CB C 60 42.381 42.023 0.358 1
1 667 . 8 1 1 A 60 60 ASP N N 60 121.370 120.585 0.785 1
1 668 . 8 1 1 A 61 61 ARG H H 61 8.648 8.697 -0.049 1
1 669 . 8 1 1 A 61 61 ARG HA H 61 5.179 5.311 -0.132 1
1 677 . 8 1 1 A 61 61 ARG C C 61 177.381 174.361 3.020 1
1 678 . 8 1 1 A 61 61 ARG CA C 61 53.704 54.530 -0.826 1
1 679 . 8 1 1 A 61 61 ARG CB C 61 34.017 32.626 1.391 1
1 682 . 8 1 1 A 61 61 ARG N N 61 116.958 122.242 -5.284 1
1 684 . 8 1 1 A 62 62 VAL H H 62 8.247 8.610 -0.363 1
1 685 . 8 1 1 A 62 62 VAL HA H 62 3.806 4.639 -0.833 1
1 693 . 8 1 1 A 62 62 VAL C C 62 174.748 174.933 -0.185 1
1 694 . 8 1 1 A 62 62 VAL CA C 62 63.149 61.029 2.120 1
1 695 . 8 1 1 A 62 62 VAL CB C 62 32.574 32.709 -0.135 1
1 698 . 8 1 1 A 62 62 VAL N N 62 118.546 125.406 -6.860 1
1 699 . 8 1 1 A 63 63 LEU H H 63 9.262 8.988 0.274 1
1 700 . 8 1 1 A 63 63 LEU HA H 63 4.412 4.290 0.122 1
1 710 . 8 1 1 A 63 63 LEU C C 63 177.649 177.215 0.434 1
1 711 . 8 1 1 A 63 63 LEU CA C 63 56.044 56.783 -0.739 1
1 712 . 8 1 1 A 63 63 LEU CB C 63 43.339 42.787 0.552 1
1 716 . 8 1 1 A 63 63 LEU N N 63 125.413 131.035 -5.622 1
1 717 . 8 1 1 A 64 64 ARG H H 64 7.806 7.692 0.114 1
1 718 . 8 1 1 A 64 64 ARG HA H 64 5.704 4.881 0.823 1
1 726 . 8 1 1 A 64 64 ARG C C 64 175.091 174.022 1.069 1
1 727 . 8 1 1 A 64 64 ARG CA C 64 54.148 54.681 -0.533 1
1 728 . 8 1 1 A 64 64 ARG CB C 64 35.742 33.937 1.805 1
1 731 . 8 1 1 A 64 64 ARG N N 64 112.961 117.020 -4.059 1
1 733 . 8 1 1 A 65 65 ILE H H 65 8.327 9.094 -0.767 1
1 734 . 8 1 1 A 65 65 ILE HA H 65 4.384 4.660 -0.276 1
1 744 . 8 1 1 A 65 65 ILE C C 65 175.722 175.720 0.002 1
1 745 . 8 1 1 A 65 65 ILE CA C 65 60.501 59.385 1.116 1
1 746 . 8 1 1 A 65 65 ILE CB C 65 39.547 40.154 -0.607 1
1 750 . 8 1 1 A 65 65 ILE N N 65 119.175 123.038 -3.863 1
1 751 . 8 1 1 A 66 66 ASN H H 66 9.911 9.404 0.507 1
1 752 . 8 1 1 A 66 66 ASN HA H 66 4.428 4.370 0.058 1
1 757 . 8 1 1 A 66 66 ASN C C 66 175.349 174.624 0.725 1
1 758 . 8 1 1 A 66 66 ASN CA C 66 54.157 54.164 -0.007 1
1 759 . 8 1 1 A 66 66 ASN CB C 66 37.024 37.470 -0.446 1
1 760 . 8 1 1 A 66 66 ASN N N 66 128.952 128.072 0.880 1
1 762 . 8 1 1 A 67 67 GLY H H 67 9.230 8.671 0.559 1
1 763 . 8 1 1 A 67 67 GLY HA2 H 67 4.322 3.974 0.348 1
1 764 . 8 1 1 A 67 67 GLY HA3 H 67 3.508 3.983 -0.475 1
1 765 . 8 1 1 A 67 67 GLY C C 67 174.393 174.042 0.351 1
1 766 . 8 1 1 A 67 67 GLY CA C 67 45.341 46.536 -1.195 1
1 767 . 8 1 1 A 67 67 GLY N N 67 103.238 104.644 -1.406 1
1 768 . 8 1 1 A 68 68 VAL H H 68 8.063 7.589 0.474 1
1 769 . 8 1 1 A 68 68 VAL HA H 68 4.015 4.545 -0.530 1
1 777 . 8 1 1 A 68 68 VAL C C 68 175.833 174.732 1.101 1
1 778 . 8 1 1 A 68 68 VAL CA C 68 62.603 61.367 1.236 1
1 779 . 8 1 1 A 68 68 VAL CB C 68 32.574 35.131 -2.557 1
1 782 . 8 1 1 A 68 68 VAL N N 68 125.696 119.685 6.011 1
1 783 . 8 1 1 A 69 69 PHE H H 69 9.301 9.146 0.155 1
1 784 . 8 1 1 A 69 69 PHE HA H 69 4.947 4.531 0.416 1
1 792 . 8 1 1 A 69 69 PHE C C 69 177.120 175.686 1.434 1
1 793 . 8 1 1 A 69 69 PHE CA C 69 59.200 59.286 -0.086 1
1 794 . 8 1 1 A 69 69 PHE CB C 69 39.320 39.552 -0.232 1
1 800 . 8 1 1 A 69 69 PHE N N 69 128.641 128.822 -0.181 1
1 801 . 8 1 1 A 70 70 VAL H H 70 8.312 7.965 0.347 1
1 802 . 8 1 1 A 70 70 VAL HA H 70 4.517 4.489 0.028 1
1 810 . 8 1 1 A 70 70 VAL CA C 70 60.734 60.498 0.236 1
1 811 . 8 1 1 A 70 70 VAL CB C 70 32.976 31.280 1.696 1
1 814 . 8 1 1 A 70 70 VAL N N 70 118.381 120.184 -1.803 1
1 815 . 8 1 1 A 71 71 ASP H H 71 5.373 7.342 -1.969 1
1 816 . 8 1 1 A 71 71 ASP HA H 71 4.413 4.198 0.215 1
1 819 . 8 1 1 A 71 71 ASP C C 71 174.896 177.793 -2.897 1
1 820 . 8 1 1 A 71 71 ASP CA C 71 58.334 57.182 1.152 1
1 821 . 8 1 1 A 71 71 ASP CB C 71 46.097 40.629 5.468 1
1 822 . 8 1 1 A 71 71 ASP N N 71 119.008 122.354 -3.346 1
1 823 . 8 1 1 A 72 72 LYS H H 72 7.874 7.410 0.464 1
1 824 . 8 1 1 A 72 72 LYS HA H 72 4.522 4.374 0.148 1
1 833 . 8 1 1 A 72 72 LYS C C 72 177.209 176.796 0.413 1
1 834 . 8 1 1 A 72 72 LYS CA C 72 54.122 56.249 -2.127 1
1 835 . 8 1 1 A 72 72 LYS CB C 72 31.640 33.682 -2.042 1
1 839 . 8 1 1 A 72 72 LYS N N 72 110.259 116.368 -6.109 1
1 840 . 8 1 1 A 73 73 GLU H H 73 7.421 7.841 -0.420 1
1 841 . 8 1 1 A 73 73 GLU HA H 73 4.401 4.364 0.037 1
1 846 . 8 1 1 A 73 73 GLU C C 73 176.728 176.177 0.551 1
1 847 . 8 1 1 A 73 73 GLU CA C 73 54.950 57.283 -2.333 1
1 848 . 8 1 1 A 73 73 GLU CB C 73 30.390 30.261 0.129 1
1 850 . 8 1 1 A 73 73 GLU N N 73 120.043 118.747 1.296 1
1 851 . 8 1 1 A 74 74 GLU H H 74 9.360 8.931 0.429 1
1 852 . 8 1 1 A 74 74 GLU HA H 74 4.403 4.597 -0.194 1
1 857 . 8 1 1 A 74 74 GLU C C 74 178.234 178.493 -0.259 1
1 858 . 8 1 1 A 74 74 GLU CA C 74 56.516 55.938 0.578 1
1 859 . 8 1 1 A 74 74 GLU CB C 74 30.390 30.565 -0.175 1
1 861 . 8 1 1 A 74 74 GLU N N 74 122.193 122.481 -0.288 1
1 862 . 8 1 1 A 75 75 HIS H H 75 9.553 9.070 0.483 1
1 863 . 8 1 1 A 75 75 HIS HA H 75 4.080 4.242 -0.162 1
1 868 . 8 1 1 A 75 75 HIS C C 75 175.985 176.936 -0.951 1
1 869 . 8 1 1 A 75 75 HIS CA C 75 61.016 60.307 0.709 1
1 870 . 8 1 1 A 75 75 HIS CB C 75 29.468 30.181 -0.713 1
1 873 . 8 1 1 A 75 75 HIS N N 75 123.587 123.230 0.357 1
1 874 . 8 1 1 A 76 76 ALA H H 76 9.129 8.315 0.814 1
1 875 . 8 1 1 A 76 76 ALA HA H 76 3.826 3.823 0.003 1
1 879 . 8 1 1 A 76 76 ALA C C 76 180.475 179.482 0.993 1
1 880 . 8 1 1 A 76 76 ALA CA C 76 55.392 54.937 0.455 1
1 881 . 8 1 1 A 76 76 ALA CB C 76 18.182 18.168 0.014 1
1 882 . 8 1 1 A 76 76 ALA N N 76 117.795 121.021 -3.226 1
1 883 . 8 1 1 A 77 77 GLN H H 77 7.099 7.652 -0.553 1
1 884 . 8 1 1 A 77 77 GLN HA H 77 4.198 4.060 0.138 1
1 891 . 8 1 1 A 77 77 GLN C C 77 177.860 178.869 -1.009 1
1 892 . 8 1 1 A 77 77 GLN CA C 77 57.790 58.727 -0.937 1
1 893 . 8 1 1 A 77 77 GLN CB C 77 28.536 28.491 0.045 1
1 895 . 8 1 1 A 77 77 GLN N N 77 115.764 117.742 -1.978 1
1 897 . 8 1 1 A 78 78 VAL H H 78 7.430 7.614 -0.184 1
1 898 . 8 1 1 A 78 78 VAL HA H 78 3.241 3.507 -0.266 1
1 906 . 8 1 1 A 78 78 VAL C C 78 177.042 177.902 -0.860 1
1 907 . 8 1 1 A 78 78 VAL CA C 78 67.299 66.357 0.942 1
1 908 . 8 1 1 A 78 78 VAL CB C 78 30.819 31.379 -0.560 1
1 911 . 8 1 1 A 78 78 VAL N N 78 121.143 120.146 0.997 1
1 912 . 8 1 1 A 79 79 VAL H H 79 7.773 8.130 -0.357 1
1 913 . 8 1 1 A 79 79 VAL HA H 79 3.315 3.590 -0.275 1
1 921 . 8 1 1 A 79 79 VAL C C 79 179.179 177.907 1.272 1
1 922 . 8 1 1 A 79 79 VAL CA C 79 66.694 65.119 1.575 1
1 923 . 8 1 1 A 79 79 VAL CB C 79 31.841 31.486 0.355 1
1 926 . 8 1 1 A 79 79 VAL N N 79 117.473 119.632 -2.159 1
1 927 . 8 1 1 A 80 80 GLU H H 80 7.410 7.921 -0.511 1
1 928 . 8 1 1 A 80 80 GLU HA H 80 4.258 4.028 0.230 1
1 933 . 8 1 1 A 80 80 GLU C C 80 178.018 178.828 -0.810 1
1 934 . 8 1 1 A 80 80 GLU CA C 80 58.566 59.087 -0.521 1
1 935 . 8 1 1 A 80 80 GLU CB C 80 29.072 29.466 -0.394 1
1 937 . 8 1 1 A 80 80 GLU N N 80 120.451 120.873 -0.422 1
1 938 . 8 1 1 A 81 81 LEU H H 81 8.070 7.814 0.256 1
1 939 . 8 1 1 A 81 81 LEU HA H 81 3.976 4.013 -0.037 1
1 949 . 8 1 1 A 81 81 LEU C C 81 180.658 179.336 1.322 1
1 950 . 8 1 1 A 81 81 LEU CA C 81 58.061 58.161 -0.100 1
1 951 . 8 1 1 A 81 81 LEU CB C 81 42.115 41.696 0.419 1
1 955 . 8 1 1 A 81 81 LEU N N 81 119.943 119.840 0.103 1
1 956 . 8 1 1 A 82 82 VAL H H 82 7.609 8.451 -0.842 1
1 957 . 8 1 1 A 82 82 VAL HA H 82 3.474 3.584 -0.110 1
1 965 . 8 1 1 A 82 82 VAL C C 82 178.927 178.429 0.498 1
1 966 . 8 1 1 A 82 82 VAL CA C 82 67.398 67.123 0.275 1
1 967 . 8 1 1 A 82 82 VAL CB C 82 31.306 31.392 -0.086 1
1 970 . 8 1 1 A 82 82 VAL N N 82 118.150 120.051 -1.901 1
1 971 . 8 1 1 A 83 83 ARG H H 83 8.186 7.985 0.201 1
1 972 . 8 1 1 A 83 83 ARG HA H 83 3.994 4.006 -0.012 1
1 979 . 8 1 1 A 83 83 ARG C C 83 179.999 178.695 1.304 1
1 980 . 8 1 1 A 83 83 ARG CA C 83 60.205 59.977 0.228 1
1 981 . 8 1 1 A 83 83 ARG CB C 83 30.103 29.804 0.299 1
1 984 . 8 1 1 A 83 83 ARG N N 83 122.902 119.904 2.998 1
1 985 . 8 1 1 A 84 84 LYS H H 84 8.772 8.248 0.524 1
1 986 . 8 1 1 A 84 84 LYS HA H 84 4.047 4.062 -0.015 1
1 995 . 8 1 1 A 84 84 LYS C C 84 176.934 178.835 -1.901 1
1 996 . 8 1 1 A 84 84 LYS CA C 84 58.142 59.050 -0.908 1
1 997 . 8 1 1 A 84 84 LYS CB C 84 32.492 32.281 0.211 1
1 1001 . 8 1 1 A 84 84 LYS N N 84 117.548 118.344 -0.796 1
1 1002 . 8 1 1 A 85 85 SER H H 85 7.333 7.790 -0.457 1
1 1003 . 8 1 1 A 85 85 SER HA H 85 4.235 4.241 -0.006 1
1 1006 . 8 1 1 A 85 85 SER C C 85 175.588 175.199 0.389 1
1 1007 . 8 1 1 A 85 85 SER CA C 85 59.535 61.449 -1.914 1
1 1008 . 8 1 1 A 85 85 SER CB C 85 63.571 63.615 -0.044 1
1 1009 . 8 1 1 A 85 85 SER N N 85 113.544 115.928 -2.384 1
1 1010 . 8 1 1 A 86 86 GLY H H 86 7.459 7.490 -0.031 1
1 1011 . 8 1 1 A 86 86 GLY HA2 H 86 4.176 4.101 0.075 1
1 1012 . 8 1 1 A 86 86 GLY HA3 H 86 3.762 4.105 -0.343 1
1 1013 . 8 1 1 A 86 86 GLY C C 86 176.407 175.303 1.104 1
1 1014 . 8 1 1 A 86 86 GLY CA C 86 46.109 44.392 1.717 1
1 1015 . 8 1 1 A 86 86 GLY N N 86 104.331 107.363 -3.032 1
1 1016 . 8 1 1 A 87 87 ASN HA H 87 4.650 4.760 -0.110 1
1 1021 . 8 1 1 A 87 87 ASN C C 87 173.653 175.750 -2.097 1
1 1022 . 8 1 1 A 87 87 ASN CA C 87 54.492 55.162 -0.670 1
1 1023 . 8 1 1 A 87 87 ASN CB C 87 38.425 39.849 -1.424 1
1 1024 . 8 1 1 A 87 87 ASN N N 87 118.401 124.762 -6.361 1
1 1026 . 8 1 1 A 88 88 SER H H 88 7.435 8.036 -0.601 1
1 1027 . 8 1 1 A 88 88 SER HA H 88 5.438 5.265 0.173 1
1 1030 . 8 1 1 A 88 88 SER C C 88 172.867 173.512 -0.645 1
1 1031 . 8 1 1 A 88 88 SER CA C 88 58.160 56.566 1.594 1
1 1032 . 8 1 1 A 88 88 SER CB C 88 65.861 64.755 1.106 1
1 1033 . 8 1 1 A 88 88 SER N N 88 113.765 112.470 1.295 1
1 1034 . 8 1 1 A 89 89 VAL H H 89 8.452 8.830 -0.378 1
1 1035 . 8 1 1 A 89 89 VAL HA H 89 4.519 4.893 -0.374 1
1 1043 . 8 1 1 A 89 89 VAL C C 89 171.391 174.427 -3.036 1
1 1044 . 8 1 1 A 89 89 VAL CA C 89 61.333 60.457 0.876 1
1 1045 . 8 1 1 A 89 89 VAL CB C 89 33.897 35.903 -2.006 1
1 1048 . 8 1 1 A 89 89 VAL N N 89 120.001 123.983 -3.982 1
1 1049 . 8 1 1 A 90 90 THR H H 90 8.348 8.662 -0.314 1
1 1050 . 8 1 1 A 90 90 THR HA H 90 5.042 5.149 -0.107 1
1 1055 . 8 1 1 A 90 90 THR C C 90 173.926 173.715 0.211 1
1 1056 . 8 1 1 A 90 90 THR CA C 90 61.403 61.481 -0.078 1
1 1057 . 8 1 1 A 90 90 THR CB C 90 69.553 70.530 -0.977 1
1 1059 . 8 1 1 A 90 90 THR N N 90 123.477 123.718 -0.241 1
1 1060 . 8 1 1 A 91 91 LEU H H 91 9.195 8.737 0.458 1
1 1061 . 8 1 1 A 91 91 LEU HA H 91 5.161 4.979 0.182 1
1 1071 . 8 1 1 A 91 91 LEU C C 91 174.564 175.575 -1.011 1
1 1072 . 8 1 1 A 91 91 LEU CA C 91 52.590 53.487 -0.897 1
1 1073 . 8 1 1 A 91 91 LEU CB C 91 44.998 45.947 -0.949 1
1 1077 . 8 1 1 A 91 91 LEU N N 91 128.419 125.789 2.630 1
1 1078 . 8 1 1 A 92 92 LEU H H 92 8.644 8.576 0.068 1
1 1079 . 8 1 1 A 92 92 LEU HA H 92 5.335 5.192 0.143 1
1 1089 . 8 1 1 A 92 92 LEU C C 92 176.451 175.411 1.040 1
1 1090 . 8 1 1 A 92 92 LEU CA C 92 54.220 53.822 0.398 1
1 1091 . 8 1 1 A 92 92 LEU CB C 92 44.323 42.896 1.427 1
1 1095 . 8 1 1 A 92 92 LEU N N 92 125.894 123.926 1.968 1
1 1096 . 8 1 1 A 93 93 VAL H H 93 9.249 8.967 0.282 1
1 1097 . 8 1 1 A 93 93 VAL HA H 93 5.573 5.239 0.334 1
1 1105 . 8 1 1 A 93 93 VAL C C 93 173.550 174.312 -0.762 1
1 1106 . 8 1 1 A 93 93 VAL CA C 93 58.340 60.751 -2.411 1
1 1107 . 8 1 1 A 93 93 VAL CB C 93 36.159 33.579 2.580 1
1 1110 . 8 1 1 A 93 93 VAL N N 93 120.660 120.698 -0.038 1
1 1111 . 8 1 1 A 94 94 LEU H H 94 8.634 8.671 -0.037 1
1 1112 . 8 1 1 A 94 94 LEU HA H 94 4.911 5.131 -0.220 1
1 1122 . 8 1 1 A 94 94 LEU C C 94 174.172 175.740 -1.568 1
1 1123 . 8 1 1 A 94 94 LEU CA C 94 52.659 53.243 -0.584 1
1 1124 . 8 1 1 A 94 94 LEU CB C 94 47.910 45.599 2.311 1
1 1128 . 8 1 1 A 94 94 LEU N N 94 120.304 127.436 -7.132 1
1 1129 . 8 1 1 A 95 95 ASP H H 95 8.210 8.800 -0.590 1
1 1130 . 8 1 1 A 95 95 ASP HA H 95 5.190 4.548 0.642 1
1 1133 . 8 1 1 A 95 95 ASP C C 95 175.887 177.732 -1.845 1
1 1134 . 8 1 1 A 95 95 ASP CA C 95 53.899 55.118 -1.219 1
1 1135 . 8 1 1 A 95 95 ASP CB C 95 41.188 41.119 0.069 1
1 1136 . 8 1 1 A 95 95 ASP N N 95 122.184 124.753 -2.569 1
1 1137 . 8 1 1 A 96 96 GLY H H 96 8.478 8.870 -0.392 1
1 1138 . 8 1 1 A 96 96 GLY HA2 H 96 4.002 3.806 0.196 1
1 1139 . 8 1 1 A 96 96 GLY HA3 H 96 3.757 3.806 -0.049 1
1 1140 . 8 1 1 A 96 96 GLY C C 96 175.497 175.526 -0.029 1
1 1141 . 8 1 1 A 96 96 GLY CA C 96 49.944 47.591 2.353 1
1 1142 . 8 1 1 A 96 96 GLY N N 96 108.610 110.976 -2.366 1
1 1143 . 8 1 1 A 97 97 ASP H H 97 8.401 8.069 0.332 1
1 1144 . 8 1 1 A 97 97 ASP HA H 97 4.454 4.412 0.042 1
1 1147 . 8 1 1 A 97 97 ASP C C 97 179.612 178.542 1.070 1
1 1148 . 8 1 1 A 97 97 ASP CA C 97 57.913 57.011 0.902 1
1 1149 . 8 1 1 A 97 97 ASP CB C 97 41.145 40.714 0.431 1
1 1150 . 8 1 1 A 97 97 ASP N N 97 120.034 122.149 -2.115 1
1 1151 . 8 1 1 A 98 98 SER H H 98 8.152 8.006 0.146 1
1 1152 . 8 1 1 A 98 98 SER HA H 98 4.218 4.095 0.123 1
1 1155 . 8 1 1 A 98 98 SER C C 98 175.061 175.129 -0.068 1
1 1156 . 8 1 1 A 98 98 SER CA C 98 62.180 62.160 0.020 1
1 1157 . 8 1 1 A 98 98 SER CB C 98 62.179 62.674 -0.495 1
1 1158 . 8 1 1 A 98 98 SER N N 98 117.174 116.508 0.666 1
1 1159 . 8 1 1 A 99 99 TYR H H 99 9.051 8.353 0.698 1
1 1160 . 8 1 1 A 99 99 TYR HA H 99 3.692 3.782 -0.090 1
1 1167 . 8 1 1 A 99 99 TYR C C 99 176.460 177.006 -0.546 1
1 1168 . 8 1 1 A 99 99 TYR CA C 99 62.814 61.846 0.968 1
1 1169 . 8 1 1 A 99 99 TYR CB C 99 38.829 38.711 0.118 1
1 1174 . 8 1 1 A 99 99 TYR N N 99 123.539 122.216 1.323 1
1 1175 . 8 1 1 A 100 100 GLU H H 100 8.520 8.852 -0.332 1
1 1176 . 8 1 1 A 100 100 GLU HA H 100 3.952 4.001 -0.049 1
1 1181 . 8 1 1 A 100 100 GLU C C 100 180.151 179.110 1.041 1
1 1182 . 8 1 1 A 100 100 GLU CA C 100 60.099 59.816 0.283 1
1 1183 . 8 1 1 A 100 100 GLU CB C 100 29.435 29.052 0.383 1
1 1185 . 8 1 1 A 100 100 GLU N N 100 117.082 118.656 -1.574 1
1 1186 . 8 1 1 A 101 101 LYS H H 101 7.740 8.069 -0.329 1
1 1187 . 8 1 1 A 101 101 LYS HA H 101 3.984 4.057 -0.073 1
1 1196 . 8 1 1 A 101 101 LYS C C 101 178.377 178.217 0.160 1
1 1197 . 8 1 1 A 101 101 LYS CA C 101 59.888 59.444 0.444 1
1 1198 . 8 1 1 A 101 101 LYS CB C 101 32.821 32.549 0.272 1
1 1202 . 8 1 1 A 101 101 LYS N N 101 119.851 120.797 -0.946 1
1 1203 . 8 1 1 A 102 102 ALA H H 102 8.538 8.317 0.221 1
1 1204 . 8 1 1 A 102 102 ALA HA H 102 3.632 4.197 -0.565 1
1 1208 . 8 1 1 A 102 102 ALA C C 102 179.870 180.184 -0.314 1
1 1209 . 8 1 1 A 102 102 ALA CA C 102 55.285 55.267 0.018 1
1 1210 . 8 1 1 A 102 102 ALA CB C 102 17.163 18.389 -1.226 1
1 1211 . 8 1 1 A 102 102 ALA N N 102 124.176 120.558 3.618 1
1 1212 . 8 1 1 A 103 103 VAL H H 103 8.147 8.055 0.092 1
1 1213 . 8 1 1 A 103 103 VAL HA H 103 3.658 3.586 0.072 1
1 1221 . 8 1 1 A 103 103 VAL C C 103 181.113 178.078 3.035 1
1 1222 . 8 1 1 A 103 103 VAL CA C 103 66.090 67.166 -1.076 1
1 1223 . 8 1 1 A 103 103 VAL CB C 103 31.822 31.561 0.261 1
1 1226 . 8 1 1 A 103 103 VAL N N 103 117.841 118.169 -0.328 1
1 1227 . 8 1 1 A 104 104 LYS H H 104 7.903 7.741 0.162 1
1 1228 . 8 1 1 A 104 104 LYS HA H 104 4.065 4.012 0.053 1
1 1235 . 8 1 1 A 104 104 LYS C C 104 177.715 178.387 -0.672 1
1 1236 . 8 1 1 A 104 104 LYS CA C 104 59.094 59.479 -0.385 1
1 1237 . 8 1 1 A 104 104 LYS CB C 104 32.285 32.461 -0.176 1
1 1241 . 8 1 1 A 104 104 LYS N N 104 121.515 120.062 1.453 1
1 1242 . 8 1 1 A 105 105 ASN H H 105 7.747 7.981 -0.234 1
1 1243 . 8 1 1 A 105 105 ASN HA H 105 4.721 4.857 -0.136 1
1 1248 . 8 1 1 A 105 105 ASN C C 105 173.320 174.010 -0.690 1
1 1249 . 8 1 1 A 105 105 ASN CA C 105 53.399 53.011 0.388 1
1 1250 . 8 1 1 A 105 105 ASN CB C 105 39.249 38.441 0.808 1
1 1251 . 8 1 1 A 105 105 ASN N N 105 114.941 114.918 0.023 1
1 1253 . 8 1 1 A 106 106 GLN H H 106 7.850 7.669 0.181 1
1 1254 . 8 1 1 A 106 106 GLN HA H 106 3.902 3.849 0.053 1
1 1261 . 8 1 1 A 106 106 GLN C C 106 175.168 174.995 0.173 1
1 1262 . 8 1 1 A 106 106 GLN CA C 106 56.978 56.916 0.062 1
1 1263 . 8 1 1 A 106 106 GLN CB C 106 25.770 27.130 -1.360 1
1 1265 . 8 1 1 A 106 106 GLN N N 106 114.989 115.791 -0.802 1
1 1267 . 8 1 1 A 107 107 VAL H H 107 8.005 7.844 0.161 1
1 1268 . 8 1 1 A 107 107 VAL HA H 107 3.664 4.058 -0.394 1
1 1276 . 8 1 1 A 107 107 VAL C C 107 175.468 175.172 0.296 1
1 1277 . 8 1 1 A 107 107 VAL CA C 107 62.726 62.302 0.424 1
1 1278 . 8 1 1 A 107 107 VAL CB C 107 32.535 32.069 0.466 1
1 1281 . 8 1 1 A 107 107 VAL N N 107 120.216 120.156 0.060 1
1 1282 . 8 1 1 A 108 108 ASP H H 108 8.484 8.782 -0.298 1
1 1283 . 8 1 1 A 108 108 ASP HA H 108 4.467 4.616 -0.149 1
1 1286 . 8 1 1 A 108 108 ASP C C 108 177.179 176.055 1.124 1
1 1287 . 8 1 1 A 108 108 ASP CA C 108 53.417 54.953 -1.536 1
1 1288 . 8 1 1 A 108 108 ASP CB C 108 40.030 41.062 -1.032 1
1 1289 . 8 1 1 A 108 108 ASP N N 108 125.414 126.697 -1.283 1
1 1290 . 8 1 1 A 109 109 LEU H H 109 8.470 8.452 0.018 1
1 1291 . 8 1 1 A 109 109 LEU HA H 109 3.846 4.238 -0.392 1
1 1301 . 8 1 1 A 109 109 LEU C C 109 178.145 178.629 -0.484 1
1 1302 . 8 1 1 A 109 109 LEU CA C 109 56.573 56.236 0.337 1
1 1303 . 8 1 1 A 109 109 LEU CB C 109 42.011 41.829 0.182 1
1 1307 . 8 1 1 A 109 109 LEU N N 109 127.577 125.413 2.164 1
1 1308 . 8 1 1 A 110 110 LYS H H 110 8.062 8.019 0.043 1
1 1309 . 8 1 1 A 110 110 LYS HA H 110 3.022 3.552 -0.530 1
1 1317 . 8 1 1 A 110 110 LYS C C 110 177.248 179.595 -2.347 1
1 1318 . 8 1 1 A 110 110 LYS CA C 110 58.742 60.157 -1.415 1
1 1319 . 8 1 1 A 110 110 LYS CB C 110 31.667 31.832 -0.165 1
1 1323 . 8 1 1 A 110 110 LYS N N 110 118.873 118.120 0.753 1
1 1324 . 8 1 1 A 111 111 GLU H H 111 7.113 8.042 -0.929 1
1 1325 . 8 1 1 A 111 111 GLU HA H 111 4.117 4.064 0.053 1
1 1330 . 8 1 1 A 111 111 GLU C C 111 176.519 177.852 -1.333 1
1 1331 . 8 1 1 A 111 111 GLU CA C 111 55.621 59.037 -3.416 1
1 1332 . 8 1 1 A 111 111 GLU CB C 111 29.943 29.122 0.821 1
1 1334 . 8 1 1 A 111 111 GLU N N 111 114.282 120.045 -5.763 1
1 1335 . 8 1 1 A 112 112 LEU H H 112 6.848 7.867 -1.019 1
1 1336 . 8 1 1 A 112 112 LEU HA H 112 4.293 4.153 0.140 1
1 1346 . 8 1 1 A 112 112 LEU C C 112 175.674 176.053 -0.379 1
1 1347 . 8 1 1 A 112 112 LEU CA C 112 55.197 56.063 -0.866 1
1 1348 . 8 1 1 A 112 112 LEU CB C 112 41.681 41.681 0.000 1
1 1352 . 8 1 1 A 112 112 LEU N N 112 118.934 122.123 -3.189 1
1 1353 . 8 1 1 A 113 113 ASP H H 113 8.466 8.478 -0.012 1
1 1354 . 8 1 1 A 113 113 ASP HA H 113 4.593 5.300 -0.707 1
1 1357 . 8 1 1 A 113 113 ASP C C 113 174.511 175.444 -0.933 1
1 1358 . 8 1 1 A 113 113 ASP CA C 113 53.558 53.131 0.427 1
1 1359 . 8 1 1 A 113 113 ASP CB C 113 42.448 43.008 -0.560 1
1 1360 . 8 1 1 A 113 113 ASP N N 113 122.148 123.052 -0.904 1
1 1 . 9 1 1 A 6 6 SER HA H 6 4.483 4.646 -0.163 1
1 4 . 9 1 1 A 6 6 SER C C 6 175.167 174.297 0.870 1
1 5 . 9 1 1 A 6 6 SER CA C 6 58.759 57.435 1.324 1
1 6 . 9 1 1 A 6 6 SER CB C 6 64.069 63.327 0.742 1
1 7 . 9 1 1 A 7 7 GLY H H 7 8.431 8.321 0.110 1
1 8 . 9 1 1 A 7 7 GLY HA2 H 7 3.973 3.912 0.061 1
1 9 . 9 1 1 A 7 7 GLY HA3 H 7 3.973 3.913 0.060 1
1 10 . 9 1 1 A 7 7 GLY C C 7 174.570 174.308 0.262 1
1 11 . 9 1 1 A 7 7 GLY CA C 7 45.483 47.000 -1.517 1
1 12 . 9 1 1 A 7 7 GLY N N 7 110.640 115.001 -4.361 1
1 13 . 9 1 1 A 8 8 MET H H 8 8.239 8.047 0.192 1
1 14 . 9 1 1 A 8 8 MET HA H 8 4.386 4.609 -0.223 1
1 22 . 9 1 1 A 8 8 MET C C 8 176.621 176.149 0.472 1
1 23 . 9 1 1 A 8 8 MET CA C 8 55.991 53.946 2.045 1
1 24 . 9 1 1 A 8 8 MET CB C 8 32.986 32.483 0.503 1
1 27 . 9 1 1 A 8 8 MET N N 8 120.219 119.123 1.096 1
1 28 . 9 1 1 A 9 9 ALA H H 9 8.435 8.834 -0.399 1
1 29 . 9 1 1 A 9 9 ALA HA H 9 4.182 3.971 0.211 1
1 33 . 9 1 1 A 9 9 ALA C C 9 177.951 176.885 1.066 1
1 34 . 9 1 1 A 9 9 ALA CA C 9 53.399 55.547 -2.148 1
1 35 . 9 1 1 A 9 9 ALA CB C 9 18.955 19.132 -0.177 1
1 36 . 9 1 1 A 9 9 ALA N N 9 124.459 129.452 -4.993 1
1 37 . 9 1 1 A 10 10 SER H H 10 8.100 7.716 0.384 1
1 38 . 9 1 1 A 10 10 SER HA H 10 4.391 4.794 -0.403 1
1 41 . 9 1 1 A 10 10 SER C C 10 174.467 172.131 2.336 1
1 42 . 9 1 1 A 10 10 SER CA C 10 58.709 57.758 0.951 1
1 43 . 9 1 1 A 10 10 SER CB C 10 63.778 67.379 -3.601 1
1 44 . 9 1 1 A 10 10 SER N N 10 113.881 109.587 4.294 1
1 45 . 9 1 1 A 11 11 THR H H 11 7.821 8.430 -0.609 1
1 46 . 9 1 1 A 11 11 THR HA H 11 4.191 4.917 -0.726 1
1 51 . 9 1 1 A 11 11 THR C C 11 173.610 172.202 1.408 1
1 52 . 9 1 1 A 11 11 THR CA C 11 61.936 60.359 1.577 1
1 53 . 9 1 1 A 11 11 THR CB C 11 69.713 71.745 -2.032 1
1 55 . 9 1 1 A 11 11 THR N N 11 114.471 115.493 -1.022 1
1 56 . 9 1 1 A 12 12 PHE H H 12 7.946 9.159 -1.213 1
1 57 . 9 1 1 A 12 12 PHE HA H 12 4.769 5.223 -0.454 1
1 65 . 9 1 1 A 12 12 PHE C C 12 174.211 174.319 -0.108 1
1 66 . 9 1 1 A 12 12 PHE CA C 12 56.644 56.433 0.211 1
1 67 . 9 1 1 A 12 12 PHE CB C 12 40.609 41.531 -0.922 1
1 73 . 9 1 1 A 12 12 PHE N N 12 120.763 125.899 -5.136 1
1 74 . 9 1 1 A 13 13 ASN H H 13 9.004 9.091 -0.087 1
1 75 . 9 1 1 A 13 13 ASN HA H 13 5.366 5.400 -0.034 1
1 80 . 9 1 1 A 13 13 ASN C C 13 172.158 174.281 -2.123 1
1 81 . 9 1 1 A 13 13 ASN CA C 13 50.988 50.798 0.190 1
1 82 . 9 1 1 A 13 13 ASN CB C 13 39.942 38.962 0.980 1
1 83 . 9 1 1 A 13 13 ASN N N 13 119.973 119.887 0.086 1
1 85 . 9 1 1 A 14 14 PRO HA H 14 4.945 4.689 0.256 1
1 92 . 9 1 1 A 14 14 PRO C C 14 174.901 175.505 -0.604 1
1 93 . 9 1 1 A 14 14 PRO CA C 14 63.096 62.397 0.699 1
1 94 . 9 1 1 A 14 14 PRO CB C 14 32.739 33.072 -0.333 1
1 97 . 9 1 1 A 15 15 ARG H H 15 8.908 8.478 0.430 1
1 98 . 9 1 1 A 15 15 ARG HA H 15 4.626 4.720 -0.094 1
1 106 . 9 1 1 A 15 15 ARG C C 15 174.432 174.884 -0.452 1
1 107 . 9 1 1 A 15 15 ARG CA C 15 54.827 55.168 -0.341 1
1 108 . 9 1 1 A 15 15 ARG CB C 15 32.439 33.611 -1.172 1
1 111 . 9 1 1 A 15 15 ARG N N 15 118.947 122.022 -3.075 1
1 113 . 9 1 1 A 16 16 GLU H H 16 8.838 8.949 -0.111 1
1 114 . 9 1 1 A 16 16 GLU HA H 16 4.876 4.478 0.398 1
1 119 . 9 1 1 A 16 16 GLU C C 16 175.767 175.644 0.123 1
1 120 . 9 1 1 A 16 16 GLU CA C 16 55.621 56.673 -1.052 1
1 121 . 9 1 1 A 16 16 GLU CB C 16 31.093 30.608 0.485 1
1 123 . 9 1 1 A 16 16 GLU N N 16 125.316 127.948 -2.632 1
1 124 . 9 1 1 A 17 17 CYS H H 17 9.327 8.295 1.032 1
1 125 . 9 1 1 A 17 17 CYS HA H 17 4.804 5.149 -0.345 1
1 128 . 9 1 1 A 17 17 CYS C C 17 172.973 172.890 0.083 1
1 129 . 9 1 1 A 17 17 CYS CA C 17 57.930 58.233 -0.303 1
1 130 . 9 1 1 A 17 17 CYS CB C 17 30.105 30.734 -0.629 1
1 131 . 9 1 1 A 17 17 CYS N N 17 127.909 123.413 4.496 1
1 132 . 9 1 1 A 18 18 LYS H H 18 9.022 8.876 0.146 1
1 133 . 9 1 1 A 18 18 LYS HA H 18 4.769 4.963 -0.194 1
1 142 . 9 1 1 A 18 18 LYS C C 18 174.586 175.140 -0.554 1
1 143 . 9 1 1 A 18 18 LYS CA C 18 55.956 55.446 0.510 1
1 144 . 9 1 1 A 18 18 LYS CB C 18 32.203 33.395 -1.192 1
1 148 . 9 1 1 A 18 18 LYS N N 18 127.039 125.920 1.119 1
1 149 . 9 1 1 A 19 19 LEU H H 19 8.784 9.432 -0.648 1
1 150 . 9 1 1 A 19 19 LEU HA H 19 4.852 5.251 -0.399 1
1 160 . 9 1 1 A 19 19 LEU C C 19 176.862 176.590 0.272 1
1 161 . 9 1 1 A 19 19 LEU CA C 19 55.391 53.517 1.874 1
1 162 . 9 1 1 A 19 19 LEU CB C 19 44.442 43.694 0.748 1
1 166 . 9 1 1 A 19 19 LEU N N 19 126.311 127.447 -1.136 1
1 167 . 9 1 1 A 20 20 SER H H 20 8.215 9.232 -1.017 1
1 168 . 9 1 1 A 20 20 SER HA H 20 5.461 5.629 -0.168 1
1 171 . 9 1 1 A 20 20 SER C C 20 171.960 173.505 -1.545 1
1 172 . 9 1 1 A 20 20 SER CA C 20 57.525 57.506 0.019 1
1 173 . 9 1 1 A 20 20 SER CB C 20 65.794 65.003 0.791 1
1 174 . 9 1 1 A 20 20 SER N N 20 115.113 122.434 -7.321 1
1 175 . 9 1 1 A 21 21 LYS H H 21 9.001 8.538 0.463 1
1 176 . 9 1 1 A 21 21 LYS HA H 21 4.887 5.011 -0.124 1
1 185 . 9 1 1 A 21 21 LYS C C 21 174.133 175.322 -1.189 1
1 186 . 9 1 1 A 21 21 LYS CA C 21 53.840 53.697 0.143 1
1 187 . 9 1 1 A 21 21 LYS CB C 21 36.553 35.691 0.862 1
1 191 . 9 1 1 A 21 21 LYS N N 21 120.938 123.021 -2.083 1
1 192 . 9 1 1 A 22 22 GLN H H 22 8.201 8.207 -0.006 1
1 193 . 9 1 1 A 22 22 GLN HA H 22 4.448 4.528 -0.080 1
1 200 . 9 1 1 A 22 22 GLN C C 22 176.372 175.264 1.108 1
1 201 . 9 1 1 A 22 22 GLN CA C 22 53.658 54.556 -0.898 1
1 202 . 9 1 1 A 22 22 GLN CB C 22 30.473 30.022 0.451 1
1 204 . 9 1 1 A 22 22 GLN N N 22 116.816 118.993 -2.177 1
1 206 . 9 1 1 A 23 23 GLU H H 23 8.624 8.569 0.055 1
1 207 . 9 1 1 A 23 23 GLU HA H 23 4.056 4.141 -0.085 1
1 212 . 9 1 1 A 23 23 GLU C C 23 177.778 176.997 0.781 1
1 213 . 9 1 1 A 23 23 GLU CA C 23 58.001 57.687 0.314 1
1 214 . 9 1 1 A 23 23 GLU CB C 23 29.237 29.044 0.193 1
1 216 . 9 1 1 A 23 23 GLU N N 23 122.364 122.840 -0.476 1
1 217 . 9 1 1 A 24 24 GLY H H 24 8.962 8.875 0.087 1
1 218 . 9 1 1 A 24 24 GLY HA2 H 24 4.139 3.984 0.155 1
1 219 . 9 1 1 A 24 24 GLY HA3 H 24 3.711 3.987 -0.276 1
1 220 . 9 1 1 A 24 24 GLY C C 24 173.857 174.280 -0.423 1
1 221 . 9 1 1 A 24 24 GLY CA C 24 45.288 45.017 0.271 1
1 222 . 9 1 1 A 24 24 GLY N N 24 113.942 113.513 0.429 1
1 223 . 9 1 1 A 25 25 GLN H H 25 7.643 7.927 -0.284 1
1 224 . 9 1 1 A 25 25 GLN HA H 25 4.488 4.271 0.217 1
1 231 . 9 1 1 A 25 25 GLN C C 25 174.727 174.753 -0.026 1
1 232 . 9 1 1 A 25 25 GLN CA C 25 54.052 55.569 -1.517 1
1 233 . 9 1 1 A 25 25 GLN CB C 25 30.843 30.017 0.826 1
1 235 . 9 1 1 A 25 25 GLN N N 25 119.538 121.415 -1.877 1
1 237 . 9 1 1 A 26 26 ASN H H 26 8.625 8.509 0.116 1
1 238 . 9 1 1 A 26 26 ASN HA H 26 4.862 4.743 0.119 1
1 243 . 9 1 1 A 26 26 ASN C C 26 176.261 175.084 1.177 1
1 244 . 9 1 1 A 26 26 ASN CA C 26 51.812 51.738 0.074 1
1 245 . 9 1 1 A 26 26 ASN CB C 26 40.403 40.132 0.271 1
1 246 . 9 1 1 A 26 26 ASN N N 26 120.047 122.323 -2.276 1
1 248 . 9 1 1 A 27 27 TYR HA H 27 4.152 4.588 -0.436 1
1 255 . 9 1 1 A 27 27 TYR C C 27 176.731 175.930 0.801 1
1 256 . 9 1 1 A 27 27 TYR CA C 27 62.462 58.468 3.994 1
1 257 . 9 1 1 A 27 27 TYR CB C 27 40.240 39.072 1.168 1
1 262 . 9 1 1 A 27 27 TYR N N 27 121.761 122.683 -0.922 1
1 263 . 9 1 1 A 28 28 GLY H H 28 8.285 7.972 0.313 1
1 264 . 9 1 1 A 28 28 GLY HA2 H 28 4.490 3.944 0.546 1
1 265 . 9 1 1 A 28 28 GLY HA3 H 28 3.759 4.034 -0.275 1
1 266 . 9 1 1 A 28 28 GLY C C 28 172.198 174.051 -1.853 1
1 267 . 9 1 1 A 28 28 GLY CA C 28 46.139 45.194 0.945 1
1 268 . 9 1 1 A 28 28 GLY N N 28 103.567 106.933 -3.366 1
1 269 . 9 1 1 A 29 29 PHE H H 29 6.878 7.899 -1.021 1
1 270 . 9 1 1 A 29 29 PHE HA H 29 5.179 5.001 0.178 1
1 278 . 9 1 1 A 29 29 PHE C C 29 172.840 173.864 -1.024 1
1 279 . 9 1 1 A 29 29 PHE CA C 29 55.262 55.145 0.117 1
1 280 . 9 1 1 A 29 29 PHE CB C 29 41.779 42.423 -0.644 1
1 286 . 9 1 1 A 29 29 PHE N N 29 111.027 117.536 -6.509 1
1 287 . 9 1 1 A 30 30 PHE H H 30 8.806 8.565 0.241 1
1 288 . 9 1 1 A 30 30 PHE HA H 30 4.923 4.922 0.001 1
1 296 . 9 1 1 A 30 30 PHE C C 30 174.501 175.010 -0.509 1
1 297 . 9 1 1 A 30 30 PHE CA C 30 55.356 56.012 -0.656 1
1 298 . 9 1 1 A 30 30 PHE CB C 30 41.681 43.646 -1.965 1
1 304 . 9 1 1 A 30 30 PHE N N 30 118.710 117.264 1.446 1
1 305 . 9 1 1 A 31 31 LEU H H 31 8.441 8.983 -0.542 1
1 306 . 9 1 1 A 31 31 LEU HA H 31 5.447 4.889 0.558 1
1 316 . 9 1 1 A 31 31 LEU C C 31 177.306 175.527 1.779 1
1 317 . 9 1 1 A 31 31 LEU CA C 31 53.610 53.791 -0.181 1
1 318 . 9 1 1 A 31 31 LEU CB C 31 43.696 43.558 0.138 1
1 322 . 9 1 1 A 31 31 LEU N N 31 123.765 121.538 2.227 1
1 323 . 9 1 1 A 32 32 ARG H H 32 9.381 8.942 0.439 1
1 324 . 9 1 1 A 32 32 ARG HA H 32 4.840 4.707 0.133 1
1 331 . 9 1 1 A 32 32 ARG C C 32 175.155 174.993 0.162 1
1 332 . 9 1 1 A 32 32 ARG CA C 32 54.210 54.283 -0.073 1
1 333 . 9 1 1 A 32 32 ARG CB C 32 35.087 33.648 1.439 1
1 336 . 9 1 1 A 32 32 ARG N N 32 123.160 121.725 1.435 1
1 337 . 9 1 1 A 33 33 ILE H H 33 7.891 8.904 -1.013 1
1 338 . 9 1 1 A 33 33 ILE HA H 33 4.495 5.125 -0.630 1
1 348 . 9 1 1 A 33 33 ILE C C 33 175.850 174.760 1.090 1
1 349 . 9 1 1 A 33 33 ILE CA C 33 59.641 59.014 0.627 1
1 350 . 9 1 1 A 33 33 ILE CB C 33 39.538 40.889 -1.351 1
1 354 . 9 1 1 A 33 33 ILE N N 33 118.924 118.464 0.460 1
1 355 . 9 1 1 A 34 34 GLU H H 34 8.971 8.818 0.153 1
1 356 . 9 1 1 A 34 34 GLU HA H 34 4.578 4.942 -0.364 1
1 361 . 9 1 1 A 34 34 GLU C C 34 175.766 175.052 0.714 1
1 362 . 9 1 1 A 34 34 GLU CA C 34 54.263 54.297 -0.034 1
1 363 . 9 1 1 A 34 34 GLU CB C 34 32.128 33.623 -1.495 1
1 365 . 9 1 1 A 34 34 GLU N N 34 125.447 121.149 4.298 1
1 366 . 9 1 1 A 35 35 LYS H H 35 8.504 8.574 -0.070 1
1 367 . 9 1 1 A 35 35 LYS HA H 35 4.026 4.074 -0.048 1
1 376 . 9 1 1 A 35 35 LYS C C 35 177.701 176.803 0.898 1
1 377 . 9 1 1 A 35 35 LYS CA C 35 57.591 56.813 0.778 1
1 378 . 9 1 1 A 35 35 LYS CB C 35 32.491 32.727 -0.236 1
1 382 . 9 1 1 A 35 35 LYS N N 35 122.893 122.817 0.076 1
1 383 . 9 1 1 A 36 36 ASP H H 36 9.020 8.913 0.107 1
1 384 . 9 1 1 A 36 36 ASP HA H 36 4.385 4.157 0.228 1
1 387 . 9 1 1 A 36 36 ASP C C 36 174.554 174.659 -0.105 1
1 388 . 9 1 1 A 36 36 ASP CA C 36 55.868 55.174 0.694 1
1 389 . 9 1 1 A 36 36 ASP CB C 36 39.826 39.307 0.519 1
1 390 . 9 1 1 A 36 36 ASP N N 36 121.412 120.902 0.510 1
1 391 . 9 1 1 A 37 37 THR H H 37 7.464 7.495 -0.031 1
1 392 . 9 1 1 A 37 37 THR HA H 37 4.454 4.913 -0.459 1
1 397 . 9 1 1 A 37 37 THR C C 37 172.012 173.167 -1.155 1
1 398 . 9 1 1 A 37 37 THR CA C 37 61.686 60.793 0.893 1
1 399 . 9 1 1 A 37 37 THR CB C 37 70.927 72.255 -1.328 1
1 401 . 9 1 1 A 37 37 THR N N 37 113.147 111.855 1.292 1
1 402 . 9 1 1 A 38 38 ASP H H 38 8.931 8.650 0.281 1
1 403 . 9 1 1 A 38 38 ASP HA H 38 4.852 4.942 -0.090 1
1 406 . 9 1 1 A 38 38 ASP CA C 38 54.826 53.081 1.745 1
1 407 . 9 1 1 A 38 38 ASP CB C 38 43.332 42.273 1.059 1
1 408 . 9 1 1 A 38 38 ASP N N 38 120.401 124.390 -3.989 1
1 409 . 9 1 1 A 39 39 GLY H H 39 8.068 8.545 -0.477 1
1 410 . 9 1 1 A 39 39 GLY HA2 H 39 3.774 3.678 0.096 1
1 411 . 9 1 1 A 39 39 GLY HA3 H 39 3.555 3.805 -0.250 1
1 412 . 9 1 1 A 39 39 GLY C C 39 172.578 172.701 -0.123 1
1 413 . 9 1 1 A 39 39 GLY CA C 39 43.967 44.687 -0.720 1
1 414 . 9 1 1 A 39 39 GLY N N 39 107.925 109.022 -1.097 1
1 415 . 9 1 1 A 40 40 HIS H H 40 9.111 8.239 0.872 1
1 416 . 9 1 1 A 40 40 HIS HA H 40 4.650 5.101 -0.451 1
1 421 . 9 1 1 A 40 40 HIS C C 40 174.330 174.202 0.128 1
1 422 . 9 1 1 A 40 40 HIS CA C 40 55.886 55.352 0.534 1
1 423 . 9 1 1 A 40 40 HIS CB C 40 30.507 32.647 -2.140 1
1 426 . 9 1 1 A 40 40 HIS N N 40 119.179 119.408 -0.229 1
1 427 . 9 1 1 A 41 41 LEU H H 41 8.254 9.130 -0.876 1
1 428 . 9 1 1 A 41 41 LEU HA H 41 4.626 4.725 -0.099 1
1 438 . 9 1 1 A 41 41 LEU C C 41 176.035 175.645 0.390 1
1 439 . 9 1 1 A 41 41 LEU CA C 41 55.621 53.783 1.838 1
1 440 . 9 1 1 A 41 41 LEU CB C 41 45.091 43.433 1.658 1
1 444 . 9 1 1 A 41 41 LEU N N 41 124.808 121.543 3.265 1
1 445 . 9 1 1 A 42 42 ILE H H 42 8.685 8.832 -0.147 1
1 446 . 9 1 1 A 42 42 ILE HA H 42 4.578 4.544 0.034 1
1 456 . 9 1 1 A 42 42 ILE C C 42 175.369 175.619 -0.250 1
1 457 . 9 1 1 A 42 42 ILE CA C 42 59.852 61.288 -1.436 1
1 458 . 9 1 1 A 42 42 ILE CB C 42 36.778 36.743 0.035 1
1 462 . 9 1 1 A 42 42 ILE N N 42 121.814 125.936 -4.122 1
1 463 . 9 1 1 A 43 43 ARG H H 43 8.787 8.719 0.068 1
1 464 . 9 1 1 A 43 43 ARG HA H 43 4.852 4.771 0.081 1
1 472 . 9 1 1 A 43 43 ARG C C 43 174.029 175.534 -1.505 1
1 473 . 9 1 1 A 43 43 ARG CA C 43 52.730 54.542 -1.812 1
1 474 . 9 1 1 A 43 43 ARG CB C 43 36.983 32.810 4.173 1
1 477 . 9 1 1 A 43 43 ARG N N 43 125.771 127.037 -1.266 1
1 479 . 9 1 1 A 44 44 VAL H H 44 8.661 8.571 0.090 1
1 480 . 9 1 1 A 44 44 VAL HA H 44 3.276 3.716 -0.440 1
1 488 . 9 1 1 A 44 44 VAL C C 44 173.227 175.029 -1.802 1
1 489 . 9 1 1 A 44 44 VAL CA C 44 63.161 63.241 -0.080 1
1 490 . 9 1 1 A 44 44 VAL CB C 44 29.054 29.992 -0.938 1
1 493 . 9 1 1 A 44 44 VAL N N 44 117.026 116.291 0.735 1
1 494 . 9 1 1 A 45 45 ILE H H 45 8.464 7.985 0.479 1
1 495 . 9 1 1 A 45 45 ILE HA H 45 4.579 4.147 0.432 1
1 505 . 9 1 1 A 45 45 ILE C C 45 178.108 175.077 3.031 1
1 506 . 9 1 1 A 45 45 ILE CA C 45 59.888 61.285 -1.397 1
1 507 . 9 1 1 A 45 45 ILE CB C 45 36.998 36.669 0.329 1
1 511 . 9 1 1 A 45 45 ILE N N 45 122.767 122.758 0.009 1
1 512 . 9 1 1 A 46 46 GLU H H 46 9.015 8.136 0.879 1
1 513 . 9 1 1 A 46 46 GLU HA H 46 4.206 4.325 -0.119 1
1 518 . 9 1 1 A 46 46 GLU C C 46 177.746 176.495 1.251 1
1 519 . 9 1 1 A 46 46 GLU CA C 46 56.130 57.006 -0.876 1
1 520 . 9 1 1 A 46 46 GLU CB C 46 30.581 30.630 -0.049 1
1 522 . 9 1 1 A 46 46 GLU N N 46 131.076 127.102 3.974 1
1 523 . 9 1 1 A 47 47 GLU H H 47 9.213 8.551 0.662 1
1 524 . 9 1 1 A 47 47 GLU HA H 47 4.194 4.449 -0.255 1
1 529 . 9 1 1 A 47 47 GLU C C 47 178.088 176.485 1.603 1
1 530 . 9 1 1 A 47 47 GLU CA C 47 58.212 55.310 2.902 1
1 531 . 9 1 1 A 47 47 GLU CB C 47 29.390 30.563 -1.173 1
1 533 . 9 1 1 A 47 47 GLU N N 47 129.592 121.123 8.469 1
1 534 . 9 1 1 A 48 48 GLY H H 48 9.586 8.937 0.649 1
1 535 . 9 1 1 A 48 48 GLY HA2 H 48 4.141 3.825 0.316 1
1 536 . 9 1 1 A 48 48 GLY HA3 H 48 3.757 3.825 -0.068 1
1 537 . 9 1 1 A 48 48 GLY C C 48 173.790 173.988 -0.198 1
1 538 . 9 1 1 A 48 48 GLY CA C 48 45.764 46.946 -1.182 1
1 539 . 9 1 1 A 48 48 GLY N N 48 114.819 110.903 3.916 1
1 540 . 9 1 1 A 49 49 SER H H 49 7.580 7.839 -0.259 1
1 541 . 9 1 1 A 49 49 SER HA H 49 4.728 4.946 -0.218 1
1 544 . 9 1 1 A 49 49 SER C C 49 173.542 174.166 -0.624 1
1 545 . 9 1 1 A 49 49 SER CA C 49 57.560 55.504 2.056 1
1 546 . 9 1 1 A 49 49 SER CB C 49 64.529 64.230 0.299 1
1 547 . 9 1 1 A 49 49 SER N N 49 114.688 113.476 1.212 1
1 548 . 9 1 1 A 50 50 PRO HA H 50 4.431 4.565 -0.134 1
1 555 . 9 1 1 A 50 50 PRO C C 50 179.377 177.495 1.882 1
1 556 . 9 1 1 A 50 50 PRO CA C 50 66.059 64.200 1.859 1
1 557 . 9 1 1 A 50 50 PRO CB C 50 32.598 31.940 0.658 1
1 560 . 9 1 1 A 51 51 ALA H H 51 8.264 8.023 0.241 1
1 561 . 9 1 1 A 51 51 ALA HA H 51 3.817 4.020 -0.203 1
1 565 . 9 1 1 A 51 51 ALA C C 51 177.508 179.708 -2.200 1
1 566 . 9 1 1 A 51 51 ALA CA C 51 55.392 55.113 0.279 1
1 567 . 9 1 1 A 51 51 ALA CB C 51 20.474 18.561 1.913 1
1 568 . 9 1 1 A 51 51 ALA N N 51 117.604 120.803 -3.199 1
1 569 . 9 1 1 A 52 52 GLU H H 52 7.794 7.434 0.360 1
1 570 . 9 1 1 A 52 52 GLU HA H 52 3.881 4.054 -0.173 1
1 575 . 9 1 1 A 52 52 GLU C C 52 181.401 178.585 2.816 1
1 576 . 9 1 1 A 52 52 GLU CA C 52 59.454 58.870 0.584 1
1 577 . 9 1 1 A 52 52 GLU CB C 52 30.247 29.482 0.765 1
1 579 . 9 1 1 A 52 52 GLU N N 52 119.474 118.536 0.938 1
1 580 . 9 1 1 A 53 53 LYS H H 53 8.557 7.838 0.719 1
1 581 . 9 1 1 A 53 53 LYS HA H 53 4.020 4.008 0.012 1
1 588 . 9 1 1 A 53 53 LYS C C 53 177.939 177.928 0.011 1
1 589 . 9 1 1 A 53 53 LYS CA C 53 59.012 58.975 0.037 1
1 590 . 9 1 1 A 53 53 LYS CB C 53 32.438 32.043 0.395 1
1 594 . 9 1 1 A 53 53 LYS N N 53 120.057 119.440 0.617 1
1 595 . 9 1 1 A 54 54 ALA H H 54 7.764 7.486 0.278 1
1 596 . 9 1 1 A 54 54 ALA HA H 54 4.400 4.301 0.099 1
1 600 . 9 1 1 A 54 54 ALA C C 54 177.658 178.075 -0.417 1
1 601 . 9 1 1 A 54 54 ALA CA C 54 52.412 51.740 0.672 1
1 602 . 9 1 1 A 54 54 ALA CB C 54 20.739 18.220 2.519 1
1 603 . 9 1 1 A 54 54 ALA N N 54 117.678 118.760 -1.082 1
1 604 . 9 1 1 A 55 55 GLY H H 55 7.583 8.000 -0.417 1
1 605 . 9 1 1 A 55 55 GLY HA2 H 55 4.266 3.916 0.350 1
1 606 . 9 1 1 A 55 55 GLY HA3 H 55 3.775 3.918 -0.143 1
1 607 . 9 1 1 A 55 55 GLY C C 55 175.232 174.286 0.946 1
1 608 . 9 1 1 A 55 55 GLY CA C 55 45.368 46.518 -1.150 1
1 609 . 9 1 1 A 55 55 GLY N N 55 103.265 107.637 -4.372 1
1 610 . 9 1 1 A 56 56 LEU H H 56 7.280 7.511 -0.231 1
1 611 . 9 1 1 A 56 56 LEU HA H 56 3.984 4.430 -0.446 1
1 621 . 9 1 1 A 56 56 LEU C C 56 174.708 175.489 -0.781 1
1 622 . 9 1 1 A 56 56 LEU CA C 56 55.603 54.693 0.910 1
1 623 . 9 1 1 A 56 56 LEU CB C 56 42.752 42.718 0.034 1
1 627 . 9 1 1 A 56 56 LEU N N 56 119.211 123.103 -3.892 1
1 628 . 9 1 1 A 57 57 LEU H H 57 8.693 8.906 -0.213 1
1 629 . 9 1 1 A 57 57 LEU HA H 57 4.499 5.145 -0.646 1
1 639 . 9 1 1 A 57 57 LEU C C 57 176.124 175.151 0.973 1
1 640 . 9 1 1 A 57 57 LEU CA C 57 52.959 52.600 0.359 1
1 641 . 9 1 1 A 57 57 LEU CB C 57 45.122 45.734 -0.612 1
1 645 . 9 1 1 A 57 57 LEU N N 57 121.969 122.344 -0.375 1
1 646 . 9 1 1 A 58 58 ASP H H 58 8.334 8.623 -0.289 1
1 647 . 9 1 1 A 58 58 ASP HA H 58 4.139 4.632 -0.493 1
1 650 . 9 1 1 A 58 58 ASP C C 58 178.636 176.974 1.662 1
1 651 . 9 1 1 A 58 58 ASP CA C 58 56.079 55.611 0.468 1
1 652 . 9 1 1 A 58 58 ASP CB C 58 42.135 40.417 1.718 1
1 653 . 9 1 1 A 58 58 ASP N N 58 120.401 122.413 -2.012 1
1 654 . 9 1 1 A 59 59 GLY H H 59 9.378 8.892 0.486 1
1 655 . 9 1 1 A 59 59 GLY HA2 H 59 4.317 3.931 0.386 1
1 656 . 9 1 1 A 59 59 GLY HA3 H 59 3.260 3.937 -0.677 1
1 657 . 9 1 1 A 59 59 GLY C C 59 173.359 173.996 -0.637 1
1 658 . 9 1 1 A 59 59 GLY CA C 59 45.517 45.079 0.438 1
1 659 . 9 1 1 A 59 59 GLY N N 59 116.622 113.909 2.713 1
1 660 . 9 1 1 A 60 60 ASP H H 60 8.009 7.940 0.069 1
1 661 . 9 1 1 A 60 60 ASP HA H 60 4.638 4.666 -0.028 1
1 664 . 9 1 1 A 60 60 ASP C C 60 175.555 175.523 0.032 1
1 665 . 9 1 1 A 60 60 ASP CA C 60 55.286 53.412 1.874 1
1 666 . 9 1 1 A 60 60 ASP CB C 60 42.381 41.369 1.012 1
1 667 . 9 1 1 A 60 60 ASP N N 60 121.370 120.517 0.853 1
1 668 . 9 1 1 A 61 61 ARG H H 61 8.648 8.645 0.003 1
1 669 . 9 1 1 A 61 61 ARG HA H 61 5.179 4.976 0.203 1
1 677 . 9 1 1 A 61 61 ARG C C 61 177.381 174.892 2.489 1
1 678 . 9 1 1 A 61 61 ARG CA C 61 53.704 55.714 -2.010 1
1 679 . 9 1 1 A 61 61 ARG CB C 61 34.017 30.720 3.297 1
1 682 . 9 1 1 A 61 61 ARG N N 61 116.958 123.909 -6.951 1
1 684 . 9 1 1 A 62 62 VAL H H 62 8.247 8.689 -0.442 1
1 685 . 9 1 1 A 62 62 VAL HA H 62 3.806 4.445 -0.639 1
1 693 . 9 1 1 A 62 62 VAL C C 62 174.748 175.029 -0.281 1
1 694 . 9 1 1 A 62 62 VAL CA C 62 63.149 62.104 1.045 1
1 695 . 9 1 1 A 62 62 VAL CB C 62 32.574 31.809 0.765 1
1 698 . 9 1 1 A 62 62 VAL N N 62 118.546 126.319 -7.773 1
1 699 . 9 1 1 A 63 63 LEU H H 63 9.262 9.164 0.098 1
1 700 . 9 1 1 A 63 63 LEU HA H 63 4.412 4.167 0.245 1
1 710 . 9 1 1 A 63 63 LEU C C 63 177.649 177.265 0.384 1
1 711 . 9 1 1 A 63 63 LEU CA C 63 56.044 56.475 -0.431 1
1 712 . 9 1 1 A 63 63 LEU CB C 63 43.339 42.769 0.570 1
1 716 . 9 1 1 A 63 63 LEU N N 63 125.413 131.395 -5.982 1
1 717 . 9 1 1 A 64 64 ARG H H 64 7.806 7.635 0.171 1
1 718 . 9 1 1 A 64 64 ARG HA H 64 5.704 4.677 1.027 1
1 726 . 9 1 1 A 64 64 ARG C C 64 175.091 174.036 1.055 1
1 727 . 9 1 1 A 64 64 ARG CA C 64 54.148 54.490 -0.342 1
1 728 . 9 1 1 A 64 64 ARG CB C 64 35.742 33.889 1.853 1
1 731 . 9 1 1 A 64 64 ARG N N 64 112.961 117.047 -4.086 1
1 733 . 9 1 1 A 65 65 ILE H H 65 8.327 9.124 -0.797 1
1 734 . 9 1 1 A 65 65 ILE HA H 65 4.384 4.693 -0.309 1
1 744 . 9 1 1 A 65 65 ILE C C 65 175.722 175.590 0.132 1
1 745 . 9 1 1 A 65 65 ILE CA C 65 60.501 59.156 1.345 1
1 746 . 9 1 1 A 65 65 ILE CB C 65 39.547 40.230 -0.683 1
1 750 . 9 1 1 A 65 65 ILE N N 65 119.175 123.548 -4.373 1
1 751 . 9 1 1 A 66 66 ASN H H 66 9.911 9.613 0.298 1
1 752 . 9 1 1 A 66 66 ASN HA H 66 4.428 4.376 0.052 1
1 757 . 9 1 1 A 66 66 ASN C C 66 175.349 174.637 0.712 1
1 758 . 9 1 1 A 66 66 ASN CA C 66 54.157 54.137 0.020 1
1 759 . 9 1 1 A 66 66 ASN CB C 66 37.024 37.482 -0.458 1
1 760 . 9 1 1 A 66 66 ASN N N 66 128.952 128.019 0.933 1
1 762 . 9 1 1 A 67 67 GLY H H 67 9.230 8.608 0.622 1
1 763 . 9 1 1 A 67 67 GLY HA2 H 67 4.322 3.965 0.357 1
1 764 . 9 1 1 A 67 67 GLY HA3 H 67 3.508 3.974 -0.466 1
1 765 . 9 1 1 A 67 67 GLY C C 67 174.393 174.028 0.365 1
1 766 . 9 1 1 A 67 67 GLY CA C 67 45.341 46.529 -1.188 1
1 767 . 9 1 1 A 67 67 GLY N N 67 103.238 104.833 -1.595 1
1 768 . 9 1 1 A 68 68 VAL H H 68 8.063 7.744 0.319 1
1 769 . 9 1 1 A 68 68 VAL HA H 68 4.015 4.536 -0.521 1
1 777 . 9 1 1 A 68 68 VAL C C 68 175.833 174.777 1.056 1
1 778 . 9 1 1 A 68 68 VAL CA C 68 62.603 61.670 0.933 1
1 779 . 9 1 1 A 68 68 VAL CB C 68 32.574 34.984 -2.410 1
1 782 . 9 1 1 A 68 68 VAL N N 68 125.696 119.486 6.210 1
1 783 . 9 1 1 A 69 69 PHE H H 69 9.301 9.161 0.140 1
1 784 . 9 1 1 A 69 69 PHE HA H 69 4.947 4.560 0.387 1
1 792 . 9 1 1 A 69 69 PHE C C 69 177.120 175.481 1.639 1
1 793 . 9 1 1 A 69 69 PHE CA C 69 59.200 59.805 -0.605 1
1 794 . 9 1 1 A 69 69 PHE CB C 69 39.320 39.634 -0.314 1
1 800 . 9 1 1 A 69 69 PHE N N 69 128.641 129.021 -0.380 1
1 801 . 9 1 1 A 70 70 VAL H H 70 8.312 7.964 0.348 1
1 802 . 9 1 1 A 70 70 VAL HA H 70 4.517 4.566 -0.049 1
1 810 . 9 1 1 A 70 70 VAL CA C 70 60.734 60.559 0.175 1
1 811 . 9 1 1 A 70 70 VAL CB C 70 32.976 31.356 1.620 1
1 814 . 9 1 1 A 70 70 VAL N N 70 118.381 120.870 -2.489 1
1 815 . 9 1 1 A 71 71 ASP H H 71 5.373 8.175 -2.802 1
1 816 . 9 1 1 A 71 71 ASP HA H 71 4.413 4.266 0.147 1
1 819 . 9 1 1 A 71 71 ASP C C 71 174.896 177.196 -2.300 1
1 820 . 9 1 1 A 71 71 ASP CA C 71 58.334 56.890 1.444 1
1 821 . 9 1 1 A 71 71 ASP CB C 71 46.097 40.203 5.894 1
1 822 . 9 1 1 A 71 71 ASP N N 71 119.008 122.681 -3.673 1
1 823 . 9 1 1 A 72 72 LYS H H 72 7.874 7.808 0.066 1
1 824 . 9 1 1 A 72 72 LYS HA H 72 4.522 4.581 -0.059 1
1 833 . 9 1 1 A 72 72 LYS C C 72 177.209 176.194 1.015 1
1 834 . 9 1 1 A 72 72 LYS CA C 72 54.122 55.164 -1.042 1
1 835 . 9 1 1 A 72 72 LYS CB C 72 31.640 32.563 -0.923 1
1 839 . 9 1 1 A 72 72 LYS N N 72 110.259 116.373 -6.114 1
1 840 . 9 1 1 A 73 73 GLU H H 73 7.421 7.748 -0.327 1
1 841 . 9 1 1 A 73 73 GLU HA H 73 4.401 4.433 -0.032 1
1 846 . 9 1 1 A 73 73 GLU C C 73 176.728 176.377 0.351 1
1 847 . 9 1 1 A 73 73 GLU CA C 73 54.950 56.533 -1.583 1
1 848 . 9 1 1 A 73 73 GLU CB C 73 30.390 30.524 -0.134 1
1 850 . 9 1 1 A 73 73 GLU N N 73 120.043 121.161 -1.118 1
1 851 . 9 1 1 A 74 74 GLU H H 74 9.360 8.465 0.895 1
1 852 . 9 1 1 A 74 74 GLU HA H 74 4.403 4.280 0.123 1
1 857 . 9 1 1 A 74 74 GLU C C 74 178.234 177.667 0.567 1
1 858 . 9 1 1 A 74 74 GLU CA C 74 56.516 56.693 -0.177 1
1 859 . 9 1 1 A 74 74 GLU CB C 74 30.390 31.613 -1.223 1
1 861 . 9 1 1 A 74 74 GLU N N 74 122.193 122.747 -0.554 1
1 862 . 9 1 1 A 75 75 HIS H H 75 9.553 9.136 0.417 1
1 863 . 9 1 1 A 75 75 HIS HA H 75 4.080 4.166 -0.086 1
1 868 . 9 1 1 A 75 75 HIS C C 75 175.985 176.801 -0.816 1
1 869 . 9 1 1 A 75 75 HIS CA C 75 61.016 60.286 0.730 1
1 870 . 9 1 1 A 75 75 HIS CB C 75 29.468 30.342 -0.874 1
1 873 . 9 1 1 A 75 75 HIS N N 75 123.587 127.902 -4.315 1
1 874 . 9 1 1 A 76 76 ALA H H 76 9.129 8.267 0.862 1
1 875 . 9 1 1 A 76 76 ALA HA H 76 3.826 3.770 0.056 1
1 879 . 9 1 1 A 76 76 ALA C C 76 180.475 179.642 0.833 1
1 880 . 9 1 1 A 76 76 ALA CA C 76 55.392 54.911 0.481 1
1 881 . 9 1 1 A 76 76 ALA CB C 76 18.182 18.223 -0.041 1
1 882 . 9 1 1 A 76 76 ALA N N 76 117.795 120.936 -3.141 1
1 883 . 9 1 1 A 77 77 GLN H H 77 7.099 7.745 -0.646 1
1 884 . 9 1 1 A 77 77 GLN HA H 77 4.198 4.082 0.116 1
1 891 . 9 1 1 A 77 77 GLN C C 77 177.860 178.972 -1.112 1
1 892 . 9 1 1 A 77 77 GLN CA C 77 57.790 58.854 -1.064 1
1 893 . 9 1 1 A 77 77 GLN CB C 77 28.536 28.830 -0.294 1
1 895 . 9 1 1 A 77 77 GLN N N 77 115.764 118.223 -2.459 1
1 897 . 9 1 1 A 78 78 VAL H H 78 7.430 7.614 -0.184 1
1 898 . 9 1 1 A 78 78 VAL HA H 78 3.241 3.536 -0.295 1
1 906 . 9 1 1 A 78 78 VAL C C 78 177.042 178.045 -1.003 1
1 907 . 9 1 1 A 78 78 VAL CA C 78 67.299 66.363 0.936 1
1 908 . 9 1 1 A 78 78 VAL CB C 78 30.819 31.560 -0.741 1
1 911 . 9 1 1 A 78 78 VAL N N 78 121.143 120.387 0.756 1
1 912 . 9 1 1 A 79 79 VAL H H 79 7.773 8.014 -0.241 1
1 913 . 9 1 1 A 79 79 VAL HA H 79 3.315 3.627 -0.312 1
1 921 . 9 1 1 A 79 79 VAL C C 79 179.179 178.021 1.158 1
1 922 . 9 1 1 A 79 79 VAL CA C 79 66.694 65.315 1.379 1
1 923 . 9 1 1 A 79 79 VAL CB C 79 31.841 31.440 0.401 1
1 926 . 9 1 1 A 79 79 VAL N N 79 117.473 120.027 -2.554 1
1 927 . 9 1 1 A 80 80 GLU H H 80 7.410 7.871 -0.461 1
1 928 . 9 1 1 A 80 80 GLU HA H 80 4.258 4.013 0.245 1
1 933 . 9 1 1 A 80 80 GLU C C 80 178.018 179.076 -1.058 1
1 934 . 9 1 1 A 80 80 GLU CA C 80 58.566 59.572 -1.006 1
1 935 . 9 1 1 A 80 80 GLU CB C 80 29.072 29.555 -0.483 1
1 937 . 9 1 1 A 80 80 GLU N N 80 120.451 121.010 -0.559 1
1 938 . 9 1 1 A 81 81 LEU H H 81 8.070 7.607 0.463 1
1 939 . 9 1 1 A 81 81 LEU HA H 81 3.976 4.018 -0.042 1
1 949 . 9 1 1 A 81 81 LEU C C 81 180.658 179.198 1.460 1
1 950 . 9 1 1 A 81 81 LEU CA C 81 58.061 58.111 -0.050 1
1 951 . 9 1 1 A 81 81 LEU CB C 81 42.115 41.769 0.346 1
1 955 . 9 1 1 A 81 81 LEU N N 81 119.943 119.985 -0.042 1
1 956 . 9 1 1 A 82 82 VAL H H 82 7.609 8.201 -0.592 1
1 957 . 9 1 1 A 82 82 VAL HA H 82 3.474 3.524 -0.050 1
1 965 . 9 1 1 A 82 82 VAL C C 82 178.927 178.428 0.499 1
1 966 . 9 1 1 A 82 82 VAL CA C 82 67.398 66.808 0.590 1
1 967 . 9 1 1 A 82 82 VAL CB C 82 31.306 31.430 -0.124 1
1 970 . 9 1 1 A 82 82 VAL N N 82 118.150 118.845 -0.695 1
1 971 . 9 1 1 A 83 83 ARG H H 83 8.186 7.950 0.236 1
1 972 . 9 1 1 A 83 83 ARG HA H 83 3.994 3.975 0.019 1
1 979 . 9 1 1 A 83 83 ARG C C 83 179.999 178.905 1.094 1
1 980 . 9 1 1 A 83 83 ARG CA C 83 60.205 59.580 0.625 1
1 981 . 9 1 1 A 83 83 ARG CB C 83 30.103 30.000 0.103 1
1 984 . 9 1 1 A 83 83 ARG N N 83 122.902 119.704 3.198 1
1 985 . 9 1 1 A 84 84 LYS H H 84 8.772 8.066 0.706 1
1 986 . 9 1 1 A 84 84 LYS HA H 84 4.047 4.087 -0.040 1
1 995 . 9 1 1 A 84 84 LYS C C 84 176.934 179.324 -2.390 1
1 996 . 9 1 1 A 84 84 LYS CA C 84 58.142 59.270 -1.128 1
1 997 . 9 1 1 A 84 84 LYS CB C 84 32.492 32.250 0.242 1
1 1001 . 9 1 1 A 84 84 LYS N N 84 117.548 119.240 -1.692 1
1 1002 . 9 1 1 A 85 85 SER H H 85 7.333 8.150 -0.817 1
1 1003 . 9 1 1 A 85 85 SER HA H 85 4.235 4.260 -0.025 1
1 1006 . 9 1 1 A 85 85 SER C C 85 175.588 175.132 0.456 1
1 1007 . 9 1 1 A 85 85 SER CA C 85 59.535 61.633 -2.098 1
1 1008 . 9 1 1 A 85 85 SER CB C 85 63.571 63.780 -0.209 1
1 1009 . 9 1 1 A 85 85 SER N N 85 113.544 116.176 -2.632 1
1 1010 . 9 1 1 A 86 86 GLY H H 86 7.459 7.774 -0.315 1
1 1011 . 9 1 1 A 86 86 GLY HA2 H 86 4.176 4.104 0.072 1
1 1012 . 9 1 1 A 86 86 GLY HA3 H 86 3.762 4.108 -0.346 1
1 1013 . 9 1 1 A 86 86 GLY C C 86 176.407 175.170 1.237 1
1 1014 . 9 1 1 A 86 86 GLY CA C 86 46.109 44.668 1.441 1
1 1015 . 9 1 1 A 86 86 GLY N N 86 104.331 107.114 -2.783 1
1 1016 . 9 1 1 A 87 87 ASN HA H 87 4.650 4.774 -0.124 1
1 1021 . 9 1 1 A 87 87 ASN C C 87 173.653 175.591 -1.938 1
1 1022 . 9 1 1 A 87 87 ASN CA C 87 54.492 54.846 -0.354 1
1 1023 . 9 1 1 A 87 87 ASN CB C 87 38.425 39.194 -0.769 1
1 1024 . 9 1 1 A 87 87 ASN N N 87 118.401 125.057 -6.656 1
1 1026 . 9 1 1 A 88 88 SER H H 88 7.435 7.981 -0.546 1
1 1027 . 9 1 1 A 88 88 SER HA H 88 5.438 5.202 0.236 1
1 1030 . 9 1 1 A 88 88 SER C C 88 172.867 173.535 -0.668 1
1 1031 . 9 1 1 A 88 88 SER CA C 88 58.160 56.681 1.479 1
1 1032 . 9 1 1 A 88 88 SER CB C 88 65.861 64.686 1.175 1
1 1033 . 9 1 1 A 88 88 SER N N 88 113.765 112.071 1.694 1
1 1034 . 9 1 1 A 89 89 VAL H H 89 8.452 8.945 -0.493 1
1 1035 . 9 1 1 A 89 89 VAL HA H 89 4.519 4.998 -0.479 1
1 1043 . 9 1 1 A 89 89 VAL C C 89 171.391 174.721 -3.330 1
1 1044 . 9 1 1 A 89 89 VAL CA C 89 61.333 60.303 1.030 1
1 1045 . 9 1 1 A 89 89 VAL CB C 89 33.897 35.896 -1.999 1
1 1048 . 9 1 1 A 89 89 VAL N N 89 120.001 123.771 -3.770 1
1 1049 . 9 1 1 A 90 90 THR H H 90 8.348 8.732 -0.384 1
1 1050 . 9 1 1 A 90 90 THR HA H 90 5.042 5.062 -0.020 1
1 1055 . 9 1 1 A 90 90 THR C C 90 173.926 173.818 0.108 1
1 1056 . 9 1 1 A 90 90 THR CA C 90 61.403 61.806 -0.403 1
1 1057 . 9 1 1 A 90 90 THR CB C 90 69.553 70.350 -0.797 1
1 1059 . 9 1 1 A 90 90 THR N N 90 123.477 122.874 0.603 1
1 1060 . 9 1 1 A 91 91 LEU H H 91 9.195 8.924 0.271 1
1 1061 . 9 1 1 A 91 91 LEU HA H 91 5.161 4.921 0.240 1
1 1071 . 9 1 1 A 91 91 LEU C C 91 174.564 175.486 -0.922 1
1 1072 . 9 1 1 A 91 91 LEU CA C 91 52.590 53.246 -0.656 1
1 1073 . 9 1 1 A 91 91 LEU CB C 91 44.998 45.021 -0.023 1
1 1077 . 9 1 1 A 91 91 LEU N N 91 128.419 127.074 1.345 1
1 1078 . 9 1 1 A 92 92 LEU H H 92 8.644 8.736 -0.092 1
1 1079 . 9 1 1 A 92 92 LEU HA H 92 5.335 5.115 0.220 1
1 1089 . 9 1 1 A 92 92 LEU C C 92 176.451 175.501 0.950 1
1 1090 . 9 1 1 A 92 92 LEU CA C 92 54.220 53.587 0.633 1
1 1091 . 9 1 1 A 92 92 LEU CB C 92 44.323 42.857 1.466 1
1 1095 . 9 1 1 A 92 92 LEU N N 92 125.894 125.329 0.565 1
1 1096 . 9 1 1 A 93 93 VAL H H 93 9.249 8.808 0.441 1
1 1097 . 9 1 1 A 93 93 VAL HA H 93 5.573 5.300 0.273 1
1 1105 . 9 1 1 A 93 93 VAL C C 93 173.550 174.201 -0.651 1
1 1106 . 9 1 1 A 93 93 VAL CA C 93 58.340 60.542 -2.202 1
1 1107 . 9 1 1 A 93 93 VAL CB C 93 36.159 34.086 2.073 1
1 1110 . 9 1 1 A 93 93 VAL N N 93 120.660 120.808 -0.148 1
1 1111 . 9 1 1 A 94 94 LEU H H 94 8.634 8.624 0.010 1
1 1112 . 9 1 1 A 94 94 LEU HA H 94 4.911 4.875 0.036 1
1 1122 . 9 1 1 A 94 94 LEU C C 94 174.172 175.224 -1.052 1
1 1123 . 9 1 1 A 94 94 LEU CA C 94 52.659 53.386 -0.727 1
1 1124 . 9 1 1 A 94 94 LEU CB C 94 47.910 44.781 3.129 1
1 1128 . 9 1 1 A 94 94 LEU N N 94 120.304 127.894 -7.590 1
1 1129 . 9 1 1 A 95 95 ASP H H 95 8.210 8.701 -0.491 1
1 1130 . 9 1 1 A 95 95 ASP HA H 95 5.190 4.637 0.553 1
1 1133 . 9 1 1 A 95 95 ASP C C 95 175.887 177.884 -1.997 1
1 1134 . 9 1 1 A 95 95 ASP CA C 95 53.899 54.929 -1.030 1
1 1135 . 9 1 1 A 95 95 ASP CB C 95 41.188 42.716 -1.528 1
1 1136 . 9 1 1 A 95 95 ASP N N 95 122.184 123.462 -1.278 1
1 1137 . 9 1 1 A 96 96 GLY H H 96 8.478 8.790 -0.312 1
1 1138 . 9 1 1 A 96 96 GLY HA2 H 96 4.002 3.795 0.207 1
1 1139 . 9 1 1 A 96 96 GLY HA3 H 96 3.757 3.806 -0.049 1
1 1140 . 9 1 1 A 96 96 GLY C C 96 175.497 175.586 -0.089 1
1 1141 . 9 1 1 A 96 96 GLY CA C 96 49.944 47.356 2.588 1
1 1142 . 9 1 1 A 96 96 GLY N N 96 108.610 111.330 -2.720 1
1 1143 . 9 1 1 A 97 97 ASP H H 97 8.401 8.454 -0.053 1
1 1144 . 9 1 1 A 97 97 ASP HA H 97 4.454 4.348 0.106 1
1 1147 . 9 1 1 A 97 97 ASP C C 97 179.612 178.546 1.066 1
1 1148 . 9 1 1 A 97 97 ASP CA C 97 57.913 57.481 0.432 1
1 1149 . 9 1 1 A 97 97 ASP CB C 97 41.145 41.902 -0.757 1
1 1150 . 9 1 1 A 97 97 ASP N N 97 120.034 122.595 -2.561 1
1 1151 . 9 1 1 A 98 98 SER H H 98 8.152 8.183 -0.031 1
1 1152 . 9 1 1 A 98 98 SER HA H 98 4.218 4.331 -0.113 1
1 1155 . 9 1 1 A 98 98 SER C C 98 175.061 175.302 -0.241 1
1 1156 . 9 1 1 A 98 98 SER CA C 98 62.180 62.489 -0.309 1
1 1157 . 9 1 1 A 98 98 SER CB C 98 62.179 63.220 -1.041 1
1 1158 . 9 1 1 A 98 98 SER N N 98 117.174 116.059 1.115 1
1 1159 . 9 1 1 A 99 99 TYR H H 99 9.051 8.345 0.706 1
1 1160 . 9 1 1 A 99 99 TYR HA H 99 3.692 3.770 -0.078 1
1 1167 . 9 1 1 A 99 99 TYR C C 99 176.460 177.343 -0.883 1
1 1168 . 9 1 1 A 99 99 TYR CA C 99 62.814 61.470 1.344 1
1 1169 . 9 1 1 A 99 99 TYR CB C 99 38.829 38.384 0.445 1
1 1174 . 9 1 1 A 99 99 TYR N N 99 123.539 122.451 1.088 1
1 1175 . 9 1 1 A 100 100 GLU H H 100 8.520 8.322 0.198 1
1 1176 . 9 1 1 A 100 100 GLU HA H 100 3.952 3.923 0.029 1
1 1181 . 9 1 1 A 100 100 GLU C C 100 180.151 179.053 1.098 1
1 1182 . 9 1 1 A 100 100 GLU CA C 100 60.099 59.698 0.401 1
1 1183 . 9 1 1 A 100 100 GLU CB C 100 29.435 29.043 0.392 1
1 1185 . 9 1 1 A 100 100 GLU N N 100 117.082 118.072 -0.990 1
1 1186 . 9 1 1 A 101 101 LYS H H 101 7.740 7.946 -0.206 1
1 1187 . 9 1 1 A 101 101 LYS HA H 101 3.984 4.019 -0.035 1
1 1196 . 9 1 1 A 101 101 LYS C C 101 178.377 178.595 -0.218 1
1 1197 . 9 1 1 A 101 101 LYS CA C 101 59.888 58.824 1.064 1
1 1198 . 9 1 1 A 101 101 LYS CB C 101 32.821 32.520 0.301 1
1 1202 . 9 1 1 A 101 101 LYS N N 101 119.851 120.622 -0.771 1
1 1203 . 9 1 1 A 102 102 ALA H H 102 8.538 7.559 0.979 1
1 1204 . 9 1 1 A 102 102 ALA HA H 102 3.632 4.158 -0.526 1
1 1208 . 9 1 1 A 102 102 ALA C C 102 179.870 179.220 0.650 1
1 1209 . 9 1 1 A 102 102 ALA CA C 102 55.285 55.052 0.233 1
1 1210 . 9 1 1 A 102 102 ALA CB C 102 17.163 18.922 -1.759 1
1 1211 . 9 1 1 A 102 102 ALA N N 102 124.176 121.928 2.248 1
1 1212 . 9 1 1 A 103 103 VAL H H 103 8.147 7.897 0.250 1
1 1213 . 9 1 1 A 103 103 VAL HA H 103 3.658 3.644 0.014 1
1 1221 . 9 1 1 A 103 103 VAL C C 103 181.113 177.501 3.612 1
1 1222 . 9 1 1 A 103 103 VAL CA C 103 66.090 65.277 0.813 1
1 1223 . 9 1 1 A 103 103 VAL CB C 103 31.822 31.100 0.722 1
1 1226 . 9 1 1 A 103 103 VAL N N 103 117.841 117.288 0.553 1
1 1227 . 9 1 1 A 104 104 LYS H H 104 7.903 7.916 -0.013 1
1 1228 . 9 1 1 A 104 104 LYS HA H 104 4.065 4.050 0.015 1
1 1235 . 9 1 1 A 104 104 LYS C C 104 177.715 178.170 -0.455 1
1 1236 . 9 1 1 A 104 104 LYS CA C 104 59.094 59.495 -0.401 1
1 1237 . 9 1 1 A 104 104 LYS CB C 104 32.285 32.625 -0.340 1
1 1241 . 9 1 1 A 104 104 LYS N N 104 121.515 121.914 -0.399 1
1 1242 . 9 1 1 A 105 105 ASN H H 105 7.747 7.804 -0.057 1
1 1243 . 9 1 1 A 105 105 ASN HA H 105 4.721 4.847 -0.126 1
1 1248 . 9 1 1 A 105 105 ASN C C 105 173.320 173.947 -0.627 1
1 1249 . 9 1 1 A 105 105 ASN CA C 105 53.399 53.086 0.313 1
1 1250 . 9 1 1 A 105 105 ASN CB C 105 39.249 38.507 0.742 1
1 1251 . 9 1 1 A 105 105 ASN N N 105 114.941 114.861 0.080 1
1 1253 . 9 1 1 A 106 106 GLN H H 106 7.850 7.636 0.214 1
1 1254 . 9 1 1 A 106 106 GLN HA H 106 3.902 3.855 0.047 1
1 1261 . 9 1 1 A 106 106 GLN C C 106 175.168 175.096 0.072 1
1 1262 . 9 1 1 A 106 106 GLN CA C 106 56.978 56.861 0.117 1
1 1263 . 9 1 1 A 106 106 GLN CB C 106 25.770 26.801 -1.031 1
1 1265 . 9 1 1 A 106 106 GLN N N 106 114.989 115.204 -0.215 1
1 1267 . 9 1 1 A 107 107 VAL H H 107 8.005 7.698 0.307 1
1 1268 . 9 1 1 A 107 107 VAL HA H 107 3.664 4.037 -0.373 1
1 1276 . 9 1 1 A 107 107 VAL C C 107 175.468 175.288 0.180 1
1 1277 . 9 1 1 A 107 107 VAL CA C 107 62.726 62.665 0.061 1
1 1278 . 9 1 1 A 107 107 VAL CB C 107 32.535 32.066 0.469 1
1 1281 . 9 1 1 A 107 107 VAL N N 107 120.216 120.012 0.204 1
1 1282 . 9 1 1 A 108 108 ASP H H 108 8.484 8.654 -0.170 1
1 1283 . 9 1 1 A 108 108 ASP HA H 108 4.467 4.506 -0.039 1
1 1286 . 9 1 1 A 108 108 ASP C C 108 177.179 176.222 0.957 1
1 1287 . 9 1 1 A 108 108 ASP CA C 108 53.417 55.372 -1.955 1
1 1288 . 9 1 1 A 108 108 ASP CB C 108 40.030 40.987 -0.957 1
1 1289 . 9 1 1 A 108 108 ASP N N 108 125.414 127.331 -1.917 1
1 1290 . 9 1 1 A 109 109 LEU H H 109 8.470 8.415 0.055 1
1 1291 . 9 1 1 A 109 109 LEU HA H 109 3.846 4.438 -0.592 1
1 1301 . 9 1 1 A 109 109 LEU C C 109 178.145 178.560 -0.415 1
1 1302 . 9 1 1 A 109 109 LEU CA C 109 56.573 56.300 0.273 1
1 1303 . 9 1 1 A 109 109 LEU CB C 109 42.011 42.508 -0.497 1
1 1307 . 9 1 1 A 109 109 LEU N N 109 127.577 125.131 2.446 1
1 1308 . 9 1 1 A 110 110 LYS H H 110 8.062 7.997 0.065 1
1 1309 . 9 1 1 A 110 110 LYS HA H 110 3.022 3.821 -0.799 1
1 1317 . 9 1 1 A 110 110 LYS C C 110 177.248 179.434 -2.186 1
1 1318 . 9 1 1 A 110 110 LYS CA C 110 58.742 60.032 -1.290 1
1 1319 . 9 1 1 A 110 110 LYS CB C 110 31.667 32.029 -0.362 1
1 1323 . 9 1 1 A 110 110 LYS N N 110 118.873 119.023 -0.150 1
1 1324 . 9 1 1 A 111 111 GLU H H 111 7.113 8.417 -1.304 1
1 1325 . 9 1 1 A 111 111 GLU HA H 111 4.117 4.138 -0.021 1
1 1330 . 9 1 1 A 111 111 GLU C C 111 176.519 177.041 -0.522 1
1 1331 . 9 1 1 A 111 111 GLU CA C 111 55.621 59.302 -3.681 1
1 1332 . 9 1 1 A 111 111 GLU CB C 111 29.943 28.992 0.951 1
1 1334 . 9 1 1 A 111 111 GLU N N 111 114.282 117.742 -3.460 1
1 1335 . 9 1 1 A 112 112 LEU H H 112 6.848 7.570 -0.722 1
1 1336 . 9 1 1 A 112 112 LEU HA H 112 4.293 4.184 0.109 1
1 1346 . 9 1 1 A 112 112 LEU C C 112 175.674 176.485 -0.811 1
1 1347 . 9 1 1 A 112 112 LEU CA C 112 55.197 56.033 -0.836 1
1 1348 . 9 1 1 A 112 112 LEU CB C 112 41.681 42.122 -0.441 1
1 1352 . 9 1 1 A 112 112 LEU N N 112 118.934 123.187 -4.253 1
1 1353 . 9 1 1 A 113 113 ASP H H 113 8.466 8.653 -0.187 1
1 1354 . 9 1 1 A 113 113 ASP HA H 113 4.593 4.884 -0.291 1
1 1357 . 9 1 1 A 113 113 ASP C C 113 174.511 175.437 -0.926 1
1 1358 . 9 1 1 A 113 113 ASP CA C 113 53.558 53.910 -0.352 1
1 1359 . 9 1 1 A 113 113 ASP CB C 113 42.448 42.487 -0.039 1
1 1360 . 9 1 1 A 113 113 ASP N N 113 122.148 125.599 -3.451 1
1 1 . 10 1 1 A 6 6 SER HA H 6 4.483 4.193 0.290 1
1 4 . 10 1 1 A 6 6 SER C C 6 175.167 175.225 -0.058 1
1 5 . 10 1 1 A 6 6 SER CA C 6 58.759 62.464 -3.705 1
1 6 . 10 1 1 A 6 6 SER CB C 6 64.069 62.806 1.263 1
1 7 . 10 1 1 A 7 7 GLY H H 7 8.431 7.868 0.563 1
1 8 . 10 1 1 A 7 7 GLY HA2 H 7 3.973 4.044 -0.071 1
1 9 . 10 1 1 A 7 7 GLY HA3 H 7 3.973 4.050 -0.077 1
1 10 . 10 1 1 A 7 7 GLY C C 7 174.570 175.061 -0.491 1
1 11 . 10 1 1 A 7 7 GLY CA C 7 45.483 44.543 0.940 1
1 12 . 10 1 1 A 7 7 GLY N N 7 110.640 108.077 2.563 1
1 13 . 10 1 1 A 8 8 MET H H 8 8.239 8.877 -0.638 1
1 14 . 10 1 1 A 8 8 MET HA H 8 4.386 4.140 0.246 1
1 22 . 10 1 1 A 8 8 MET C C 8 176.621 175.918 0.703 1
1 23 . 10 1 1 A 8 8 MET CA C 8 55.991 58.448 -2.457 1
1 24 . 10 1 1 A 8 8 MET CB C 8 32.986 32.077 0.909 1
1 27 . 10 1 1 A 8 8 MET N N 8 120.219 120.991 -0.772 1
1 28 . 10 1 1 A 9 9 ALA H H 9 8.435 7.774 0.661 1
1 29 . 10 1 1 A 9 9 ALA HA H 9 4.182 4.549 -0.367 1
1 33 . 10 1 1 A 9 9 ALA C C 9 177.951 176.418 1.533 1
1 34 . 10 1 1 A 9 9 ALA CA C 9 53.399 50.704 2.695 1
1 35 . 10 1 1 A 9 9 ALA CB C 9 18.955 20.921 -1.966 1
1 36 . 10 1 1 A 9 9 ALA N N 9 124.459 120.399 4.060 1
1 37 . 10 1 1 A 10 10 SER H H 10 8.100 8.680 -0.580 1
1 38 . 10 1 1 A 10 10 SER HA H 10 4.391 4.588 -0.197 1
1 41 . 10 1 1 A 10 10 SER C C 10 174.467 174.401 0.066 1
1 42 . 10 1 1 A 10 10 SER CA C 10 58.709 58.441 0.268 1
1 43 . 10 1 1 A 10 10 SER CB C 10 63.778 64.443 -0.665 1
1 44 . 10 1 1 A 10 10 SER N N 10 113.881 113.955 -0.074 1
1 45 . 10 1 1 A 11 11 THR H H 11 7.821 7.867 -0.046 1
1 46 . 10 1 1 A 11 11 THR HA H 11 4.191 4.849 -0.658 1
1 51 . 10 1 1 A 11 11 THR C C 11 173.610 172.960 0.650 1
1 52 . 10 1 1 A 11 11 THR CA C 11 61.936 60.222 1.714 1
1 53 . 10 1 1 A 11 11 THR CB C 11 69.713 71.671 -1.958 1
1 55 . 10 1 1 A 11 11 THR N N 11 114.471 111.403 3.068 1
1 56 . 10 1 1 A 12 12 PHE H H 12 7.946 8.984 -1.038 1
1 57 . 10 1 1 A 12 12 PHE HA H 12 4.769 4.777 -0.008 1
1 65 . 10 1 1 A 12 12 PHE C C 12 174.211 176.149 -1.938 1
1 66 . 10 1 1 A 12 12 PHE CA C 12 56.644 58.113 -1.469 1
1 67 . 10 1 1 A 12 12 PHE CB C 12 40.609 39.734 0.875 1
1 73 . 10 1 1 A 12 12 PHE N N 12 120.763 123.780 -3.017 1
1 74 . 10 1 1 A 13 13 ASN H H 13 9.004 8.719 0.285 1
1 75 . 10 1 1 A 13 13 ASN HA H 13 5.366 5.455 -0.089 1
1 80 . 10 1 1 A 13 13 ASN C C 13 172.158 172.772 -0.614 1
1 81 . 10 1 1 A 13 13 ASN CA C 13 50.988 50.427 0.561 1
1 82 . 10 1 1 A 13 13 ASN CB C 13 39.942 39.128 0.814 1
1 83 . 10 1 1 A 13 13 ASN N N 13 119.973 118.571 1.402 1
1 85 . 10 1 1 A 14 14 PRO HA H 14 4.945 4.656 0.289 1
1 92 . 10 1 1 A 14 14 PRO C C 14 174.901 175.555 -0.654 1
1 93 . 10 1 1 A 14 14 PRO CA C 14 63.096 62.487 0.609 1
1 94 . 10 1 1 A 14 14 PRO CB C 14 32.739 33.071 -0.332 1
1 97 . 10 1 1 A 15 15 ARG H H 15 8.908 8.619 0.289 1
1 98 . 10 1 1 A 15 15 ARG HA H 15 4.626 4.772 -0.146 1
1 106 . 10 1 1 A 15 15 ARG C C 15 174.432 174.892 -0.460 1
1 107 . 10 1 1 A 15 15 ARG CA C 15 54.827 55.065 -0.238 1
1 108 . 10 1 1 A 15 15 ARG CB C 15 32.439 33.261 -0.822 1
1 111 . 10 1 1 A 15 15 ARG N N 15 118.947 121.958 -3.011 1
1 113 . 10 1 1 A 16 16 GLU H H 16 8.838 8.942 -0.104 1
1 114 . 10 1 1 A 16 16 GLU HA H 16 4.876 4.504 0.372 1
1 119 . 10 1 1 A 16 16 GLU C C 16 175.767 175.564 0.203 1
1 120 . 10 1 1 A 16 16 GLU CA C 16 55.621 56.822 -1.201 1
1 121 . 10 1 1 A 16 16 GLU CB C 16 31.093 30.584 0.509 1
1 123 . 10 1 1 A 16 16 GLU N N 16 125.316 127.983 -2.667 1
1 124 . 10 1 1 A 17 17 CYS H H 17 9.327 8.277 1.050 1
1 125 . 10 1 1 A 17 17 CYS HA H 17 4.804 5.138 -0.334 1
1 128 . 10 1 1 A 17 17 CYS C C 17 172.973 173.051 -0.078 1
1 129 . 10 1 1 A 17 17 CYS CA C 17 57.930 57.955 -0.025 1
1 130 . 10 1 1 A 17 17 CYS CB C 17 30.105 31.220 -1.115 1
1 131 . 10 1 1 A 17 17 CYS N N 17 127.909 123.654 4.255 1
1 132 . 10 1 1 A 18 18 LYS H H 18 9.022 8.912 0.110 1
1 133 . 10 1 1 A 18 18 LYS HA H 18 4.769 4.793 -0.024 1
1 142 . 10 1 1 A 18 18 LYS C C 18 174.586 175.079 -0.493 1
1 143 . 10 1 1 A 18 18 LYS CA C 18 55.956 55.469 0.487 1
1 144 . 10 1 1 A 18 18 LYS CB C 18 32.203 33.446 -1.243 1
1 148 . 10 1 1 A 18 18 LYS N N 18 127.039 125.574 1.465 1
1 149 . 10 1 1 A 19 19 LEU H H 19 8.784 9.503 -0.719 1
1 150 . 10 1 1 A 19 19 LEU HA H 19 4.852 5.016 -0.164 1
1 160 . 10 1 1 A 19 19 LEU C C 19 176.862 176.355 0.507 1
1 161 . 10 1 1 A 19 19 LEU CA C 19 55.391 53.480 1.911 1
1 162 . 10 1 1 A 19 19 LEU CB C 19 44.442 43.909 0.533 1
1 166 . 10 1 1 A 19 19 LEU N N 19 126.311 127.293 -0.982 1
1 167 . 10 1 1 A 20 20 SER H H 20 8.215 9.017 -0.802 1
1 168 . 10 1 1 A 20 20 SER HA H 20 5.461 5.580 -0.119 1
1 171 . 10 1 1 A 20 20 SER C C 20 171.960 173.334 -1.374 1
1 172 . 10 1 1 A 20 20 SER CA C 20 57.525 56.742 0.783 1
1 173 . 10 1 1 A 20 20 SER CB C 20 65.794 65.565 0.229 1
1 174 . 10 1 1 A 20 20 SER N N 20 115.113 117.106 -1.993 1
1 175 . 10 1 1 A 21 21 LYS H H 21 9.001 9.450 -0.449 1
1 176 . 10 1 1 A 21 21 LYS HA H 21 4.887 5.026 -0.139 1
1 185 . 10 1 1 A 21 21 LYS C C 21 174.133 175.388 -1.255 1
1 186 . 10 1 1 A 21 21 LYS CA C 21 53.840 53.971 -0.131 1
1 187 . 10 1 1 A 21 21 LYS CB C 21 36.553 35.291 1.262 1
1 191 . 10 1 1 A 21 21 LYS N N 21 120.938 122.527 -1.589 1
1 192 . 10 1 1 A 22 22 GLN H H 22 8.201 8.412 -0.211 1
1 193 . 10 1 1 A 22 22 GLN HA H 22 4.448 4.518 -0.070 1
1 200 . 10 1 1 A 22 22 GLN C C 22 176.372 175.355 1.017 1
1 201 . 10 1 1 A 22 22 GLN CA C 22 53.658 54.768 -1.110 1
1 202 . 10 1 1 A 22 22 GLN CB C 22 30.473 30.399 0.074 1
1 204 . 10 1 1 A 22 22 GLN N N 22 116.816 119.652 -2.836 1
1 206 . 10 1 1 A 23 23 GLU H H 23 8.624 8.634 -0.010 1
1 207 . 10 1 1 A 23 23 GLU HA H 23 4.056 4.335 -0.279 1
1 212 . 10 1 1 A 23 23 GLU C C 23 177.778 176.990 0.788 1
1 213 . 10 1 1 A 23 23 GLU CA C 23 58.001 56.451 1.550 1
1 214 . 10 1 1 A 23 23 GLU CB C 23 29.237 30.138 -0.901 1
1 216 . 10 1 1 A 23 23 GLU N N 23 122.364 122.145 0.219 1
1 217 . 10 1 1 A 24 24 GLY H H 24 8.962 8.696 0.266 1
1 218 . 10 1 1 A 24 24 GLY HA2 H 24 4.139 3.971 0.168 1
1 219 . 10 1 1 A 24 24 GLY HA3 H 24 3.711 3.973 -0.262 1
1 220 . 10 1 1 A 24 24 GLY C C 24 173.857 174.325 -0.468 1
1 221 . 10 1 1 A 24 24 GLY CA C 24 45.288 45.094 0.194 1
1 222 . 10 1 1 A 24 24 GLY N N 24 113.942 114.403 -0.461 1
1 223 . 10 1 1 A 25 25 GLN H H 25 7.643 7.802 -0.159 1
1 224 . 10 1 1 A 25 25 GLN HA H 25 4.488 4.396 0.092 1
1 231 . 10 1 1 A 25 25 GLN C C 25 174.727 175.753 -1.026 1
1 232 . 10 1 1 A 25 25 GLN CA C 25 54.052 55.112 -1.060 1
1 233 . 10 1 1 A 25 25 GLN CB C 25 30.843 29.920 0.923 1
1 235 . 10 1 1 A 25 25 GLN N N 25 119.538 121.081 -1.543 1
1 237 . 10 1 1 A 26 26 ASN H H 26 8.625 8.507 0.118 1
1 238 . 10 1 1 A 26 26 ASN HA H 26 4.862 4.902 -0.040 1
1 243 . 10 1 1 A 26 26 ASN C C 26 176.261 176.174 0.087 1
1 244 . 10 1 1 A 26 26 ASN CA C 26 51.812 51.549 0.263 1
1 245 . 10 1 1 A 26 26 ASN CB C 26 40.403 38.865 1.538 1
1 246 . 10 1 1 A 26 26 ASN N N 26 120.047 123.489 -3.442 1
1 248 . 10 1 1 A 27 27 TYR HA H 27 4.152 4.531 -0.379 1
1 255 . 10 1 1 A 27 27 TYR C C 27 176.731 175.744 0.987 1
1 256 . 10 1 1 A 27 27 TYR CA C 27 62.462 59.029 3.433 1
1 257 . 10 1 1 A 27 27 TYR CB C 27 40.240 38.980 1.260 1
1 262 . 10 1 1 A 27 27 TYR N N 27 121.761 119.828 1.933 1
1 263 . 10 1 1 A 28 28 GLY H H 28 8.285 7.912 0.373 1
1 264 . 10 1 1 A 28 28 GLY HA2 H 28 4.490 3.929 0.561 1
1 265 . 10 1 1 A 28 28 GLY HA3 H 28 3.759 4.020 -0.261 1
1 266 . 10 1 1 A 28 28 GLY C C 28 172.198 173.904 -1.706 1
1 267 . 10 1 1 A 28 28 GLY CA C 28 46.139 45.196 0.943 1
1 268 . 10 1 1 A 28 28 GLY N N 28 103.567 107.147 -3.580 1
1 269 . 10 1 1 A 29 29 PHE H H 29 6.878 7.706 -0.828 1
1 270 . 10 1 1 A 29 29 PHE HA H 29 5.179 4.934 0.245 1
1 278 . 10 1 1 A 29 29 PHE C C 29 172.840 173.817 -0.977 1
1 279 . 10 1 1 A 29 29 PHE CA C 29 55.262 54.970 0.292 1
1 280 . 10 1 1 A 29 29 PHE CB C 29 41.779 42.551 -0.772 1
1 286 . 10 1 1 A 29 29 PHE N N 29 111.027 117.460 -6.433 1
1 287 . 10 1 1 A 30 30 PHE H H 30 8.806 9.061 -0.255 1
1 288 . 10 1 1 A 30 30 PHE HA H 30 4.923 4.933 -0.010 1
1 296 . 10 1 1 A 30 30 PHE C C 30 174.501 174.804 -0.303 1
1 297 . 10 1 1 A 30 30 PHE CA C 30 55.356 55.749 -0.393 1
1 298 . 10 1 1 A 30 30 PHE CB C 30 41.681 43.680 -1.999 1
1 304 . 10 1 1 A 30 30 PHE N N 30 118.710 117.399 1.311 1
1 305 . 10 1 1 A 31 31 LEU H H 31 8.441 9.180 -0.739 1
1 306 . 10 1 1 A 31 31 LEU HA H 31 5.447 5.161 0.286 1
1 316 . 10 1 1 A 31 31 LEU C C 31 177.306 175.883 1.423 1
1 317 . 10 1 1 A 31 31 LEU CA C 31 53.610 53.541 0.069 1
1 318 . 10 1 1 A 31 31 LEU CB C 31 43.696 43.096 0.600 1
1 322 . 10 1 1 A 31 31 LEU N N 31 123.765 122.807 0.958 1
1 323 . 10 1 1 A 32 32 ARG H H 32 9.381 8.942 0.439 1
1 324 . 10 1 1 A 32 32 ARG HA H 32 4.840 4.849 -0.009 1
1 331 . 10 1 1 A 32 32 ARG C C 32 175.155 175.791 -0.636 1
1 332 . 10 1 1 A 32 32 ARG CA C 32 54.210 54.237 -0.027 1
1 333 . 10 1 1 A 32 32 ARG CB C 32 35.087 33.312 1.775 1
1 336 . 10 1 1 A 32 32 ARG N N 32 123.160 124.359 -1.199 1
1 337 . 10 1 1 A 33 33 ILE H H 33 7.891 8.742 -0.851 1
1 338 . 10 1 1 A 33 33 ILE HA H 33 4.495 4.921 -0.426 1
1 348 . 10 1 1 A 33 33 ILE C C 33 175.850 173.979 1.871 1
1 349 . 10 1 1 A 33 33 ILE CA C 33 59.641 58.894 0.747 1
1 350 . 10 1 1 A 33 33 ILE CB C 33 39.538 40.599 -1.061 1
1 354 . 10 1 1 A 33 33 ILE N N 33 118.924 118.537 0.387 1
1 355 . 10 1 1 A 34 34 GLU H H 34 8.971 8.902 0.069 1
1 356 . 10 1 1 A 34 34 GLU HA H 34 4.578 5.003 -0.425 1
1 361 . 10 1 1 A 34 34 GLU C C 34 175.766 174.874 0.892 1
1 362 . 10 1 1 A 34 34 GLU CA C 34 54.263 54.367 -0.104 1
1 363 . 10 1 1 A 34 34 GLU CB C 34 32.128 33.395 -1.267 1
1 365 . 10 1 1 A 34 34 GLU N N 34 125.447 122.827 2.620 1
1 366 . 10 1 1 A 35 35 LYS H H 35 8.504 8.621 -0.117 1
1 367 . 10 1 1 A 35 35 LYS HA H 35 4.026 4.194 -0.168 1
1 376 . 10 1 1 A 35 35 LYS C C 35 177.701 176.929 0.772 1
1 377 . 10 1 1 A 35 35 LYS CA C 35 57.591 56.067 1.524 1
1 378 . 10 1 1 A 35 35 LYS CB C 35 32.491 33.535 -1.044 1
1 382 . 10 1 1 A 35 35 LYS N N 35 122.893 125.710 -2.817 1
1 383 . 10 1 1 A 36 36 ASP H H 36 9.020 9.044 -0.024 1
1 384 . 10 1 1 A 36 36 ASP HA H 36 4.385 4.311 0.074 1
1 387 . 10 1 1 A 36 36 ASP C C 36 174.554 174.878 -0.324 1
1 388 . 10 1 1 A 36 36 ASP CA C 36 55.868 54.861 1.007 1
1 389 . 10 1 1 A 36 36 ASP CB C 36 39.826 38.577 1.249 1
1 390 . 10 1 1 A 36 36 ASP N N 36 121.412 125.516 -4.104 1
1 391 . 10 1 1 A 37 37 THR H H 37 7.464 7.529 -0.065 1
1 392 . 10 1 1 A 37 37 THR HA H 37 4.454 4.872 -0.418 1
1 397 . 10 1 1 A 37 37 THR C C 37 172.012 173.146 -1.134 1
1 398 . 10 1 1 A 37 37 THR CA C 37 61.686 60.698 0.988 1
1 399 . 10 1 1 A 37 37 THR CB C 37 70.927 72.722 -1.795 1
1 401 . 10 1 1 A 37 37 THR N N 37 113.147 113.715 -0.568 1
1 402 . 10 1 1 A 38 38 ASP H H 38 8.931 8.814 0.117 1
1 403 . 10 1 1 A 38 38 ASP HA H 38 4.852 4.912 -0.060 1
1 406 . 10 1 1 A 38 38 ASP CA C 38 54.826 53.526 1.300 1
1 407 . 10 1 1 A 38 38 ASP CB C 38 43.332 43.053 0.279 1
1 408 . 10 1 1 A 38 38 ASP N N 38 120.401 122.693 -2.292 1
1 409 . 10 1 1 A 39 39 GLY H H 39 8.068 8.585 -0.517 1
1 410 . 10 1 1 A 39 39 GLY HA2 H 39 3.774 3.977 -0.203 1
1 411 . 10 1 1 A 39 39 GLY HA3 H 39 3.555 4.028 -0.473 1
1 412 . 10 1 1 A 39 39 GLY C C 39 172.578 173.262 -0.684 1
1 413 . 10 1 1 A 39 39 GLY CA C 39 43.967 44.908 -0.941 1
1 414 . 10 1 1 A 39 39 GLY N N 39 107.925 109.369 -1.444 1
1 415 . 10 1 1 A 40 40 HIS H H 40 9.111 8.545 0.566 1
1 416 . 10 1 1 A 40 40 HIS HA H 40 4.650 4.816 -0.166 1
1 421 . 10 1 1 A 40 40 HIS C C 40 174.330 174.844 -0.514 1
1 422 . 10 1 1 A 40 40 HIS CA C 40 55.886 56.370 -0.484 1
1 423 . 10 1 1 A 40 40 HIS CB C 40 30.507 30.690 -0.183 1
1 426 . 10 1 1 A 40 40 HIS N N 40 119.179 118.930 0.249 1
1 427 . 10 1 1 A 41 41 LEU H H 41 8.254 8.515 -0.261 1
1 428 . 10 1 1 A 41 41 LEU HA H 41 4.626 5.103 -0.477 1
1 438 . 10 1 1 A 41 41 LEU C C 41 176.035 176.102 -0.067 1
1 439 . 10 1 1 A 41 41 LEU CA C 41 55.621 53.717 1.904 1
1 440 . 10 1 1 A 41 41 LEU CB C 41 45.091 43.821 1.270 1
1 444 . 10 1 1 A 41 41 LEU N N 41 124.808 123.667 1.141 1
1 445 . 10 1 1 A 42 42 ILE H H 42 8.685 8.545 0.140 1
1 446 . 10 1 1 A 42 42 ILE HA H 42 4.578 4.781 -0.203 1
1 456 . 10 1 1 A 42 42 ILE C C 42 175.369 175.005 0.364 1
1 457 . 10 1 1 A 42 42 ILE CA C 42 59.852 60.522 -0.670 1
1 458 . 10 1 1 A 42 42 ILE CB C 42 36.778 38.471 -1.693 1
1 462 . 10 1 1 A 42 42 ILE N N 42 121.814 123.822 -2.008 1
1 463 . 10 1 1 A 43 43 ARG H H 43 8.787 8.914 -0.127 1
1 464 . 10 1 1 A 43 43 ARG HA H 43 4.852 4.774 0.078 1
1 472 . 10 1 1 A 43 43 ARG C C 43 174.029 175.012 -0.983 1
1 473 . 10 1 1 A 43 43 ARG CA C 43 52.730 55.098 -2.368 1
1 474 . 10 1 1 A 43 43 ARG CB C 43 36.983 33.858 3.125 1
1 477 . 10 1 1 A 43 43 ARG N N 43 125.771 128.092 -2.321 1
1 479 . 10 1 1 A 44 44 VAL H H 44 8.661 8.541 0.120 1
1 480 . 10 1 1 A 44 44 VAL HA H 44 3.276 3.699 -0.423 1
1 488 . 10 1 1 A 44 44 VAL C C 44 173.227 175.123 -1.896 1
1 489 . 10 1 1 A 44 44 VAL CA C 44 63.161 63.200 -0.039 1
1 490 . 10 1 1 A 44 44 VAL CB C 44 29.054 29.831 -0.777 1
1 493 . 10 1 1 A 44 44 VAL N N 44 117.026 119.410 -2.384 1
1 494 . 10 1 1 A 45 45 ILE H H 45 8.464 7.952 0.512 1
1 495 . 10 1 1 A 45 45 ILE HA H 45 4.579 4.190 0.389 1
1 505 . 10 1 1 A 45 45 ILE C C 45 178.108 175.201 2.907 1
1 506 . 10 1 1 A 45 45 ILE CA C 45 59.888 60.970 -1.082 1
1 507 . 10 1 1 A 45 45 ILE CB C 45 36.998 37.158 -0.160 1
1 511 . 10 1 1 A 45 45 ILE N N 45 122.767 122.497 0.270 1
1 512 . 10 1 1 A 46 46 GLU H H 46 9.015 8.306 0.709 1
1 513 . 10 1 1 A 46 46 GLU HA H 46 4.206 4.336 -0.130 1
1 518 . 10 1 1 A 46 46 GLU C C 46 177.746 176.328 1.418 1
1 519 . 10 1 1 A 46 46 GLU CA C 46 56.130 56.983 -0.853 1
1 520 . 10 1 1 A 46 46 GLU CB C 46 30.581 30.111 0.470 1
1 522 . 10 1 1 A 46 46 GLU N N 46 131.076 128.968 2.108 1
1 523 . 10 1 1 A 47 47 GLU H H 47 9.213 8.743 0.470 1
1 524 . 10 1 1 A 47 47 GLU HA H 47 4.194 4.077 0.117 1
1 529 . 10 1 1 A 47 47 GLU C C 47 178.088 177.633 0.455 1
1 530 . 10 1 1 A 47 47 GLU CA C 47 58.212 57.951 0.261 1
1 531 . 10 1 1 A 47 47 GLU CB C 47 29.390 29.959 -0.569 1
1 533 . 10 1 1 A 47 47 GLU N N 47 129.592 124.962 4.630 1
1 534 . 10 1 1 A 48 48 GLY H H 48 9.586 8.972 0.614 1
1 535 . 10 1 1 A 48 48 GLY HA2 H 48 4.141 3.823 0.318 1
1 536 . 10 1 1 A 48 48 GLY HA3 H 48 3.757 3.824 -0.067 1
1 537 . 10 1 1 A 48 48 GLY C C 48 173.790 173.994 -0.204 1
1 538 . 10 1 1 A 48 48 GLY CA C 48 45.764 46.946 -1.182 1
1 539 . 10 1 1 A 48 48 GLY N N 48 114.819 114.553 0.266 1
1 540 . 10 1 1 A 49 49 SER H H 49 7.580 7.901 -0.321 1
1 541 . 10 1 1 A 49 49 SER HA H 49 4.728 4.930 -0.202 1
1 544 . 10 1 1 A 49 49 SER C C 49 173.542 174.214 -0.672 1
1 545 . 10 1 1 A 49 49 SER CA C 49 57.560 55.569 1.991 1
1 546 . 10 1 1 A 49 49 SER CB C 49 64.529 64.210 0.319 1
1 547 . 10 1 1 A 49 49 SER N N 49 114.688 113.510 1.178 1
1 548 . 10 1 1 A 50 50 PRO HA H 50 4.431 4.569 -0.138 1
1 555 . 10 1 1 A 50 50 PRO C C 50 179.377 177.850 1.527 1
1 556 . 10 1 1 A 50 50 PRO CA C 50 66.059 64.242 1.817 1
1 557 . 10 1 1 A 50 50 PRO CB C 50 32.598 31.837 0.761 1
1 560 . 10 1 1 A 51 51 ALA H H 51 8.264 7.924 0.340 1
1 561 . 10 1 1 A 51 51 ALA HA H 51 3.817 4.039 -0.222 1
1 565 . 10 1 1 A 51 51 ALA C C 51 177.508 179.744 -2.236 1
1 566 . 10 1 1 A 51 51 ALA CA C 51 55.392 55.232 0.160 1
1 567 . 10 1 1 A 51 51 ALA CB C 51 20.474 18.273 2.201 1
1 568 . 10 1 1 A 51 51 ALA N N 51 117.604 120.115 -2.511 1
1 569 . 10 1 1 A 52 52 GLU H H 52 7.794 7.571 0.223 1
1 570 . 10 1 1 A 52 52 GLU HA H 52 3.881 4.210 -0.329 1
1 575 . 10 1 1 A 52 52 GLU C C 52 181.401 178.470 2.931 1
1 576 . 10 1 1 A 52 52 GLU CA C 52 59.454 59.248 0.206 1
1 577 . 10 1 1 A 52 52 GLU CB C 52 30.247 29.444 0.803 1
1 579 . 10 1 1 A 52 52 GLU N N 52 119.474 118.929 0.545 1
1 580 . 10 1 1 A 53 53 LYS H H 53 8.557 7.769 0.788 1
1 581 . 10 1 1 A 53 53 LYS HA H 53 4.020 4.043 -0.023 1
1 588 . 10 1 1 A 53 53 LYS C C 53 177.939 178.022 -0.083 1
1 589 . 10 1 1 A 53 53 LYS CA C 53 59.012 59.236 -0.224 1
1 590 . 10 1 1 A 53 53 LYS CB C 53 32.438 32.173 0.265 1
1 594 . 10 1 1 A 53 53 LYS N N 53 120.057 118.686 1.371 1
1 595 . 10 1 1 A 54 54 ALA H H 54 7.764 7.506 0.258 1
1 596 . 10 1 1 A 54 54 ALA HA H 54 4.400 4.304 0.096 1
1 600 . 10 1 1 A 54 54 ALA C C 54 177.658 178.048 -0.390 1
1 601 . 10 1 1 A 54 54 ALA CA C 54 52.412 51.704 0.708 1
1 602 . 10 1 1 A 54 54 ALA CB C 54 20.739 18.321 2.418 1
1 603 . 10 1 1 A 54 54 ALA N N 54 117.678 118.487 -0.809 1
1 604 . 10 1 1 A 55 55 GLY H H 55 7.583 7.920 -0.337 1
1 605 . 10 1 1 A 55 55 GLY HA2 H 55 4.266 3.914 0.352 1
1 606 . 10 1 1 A 55 55 GLY HA3 H 55 3.775 3.917 -0.142 1
1 607 . 10 1 1 A 55 55 GLY C C 55 175.232 174.371 0.861 1
1 608 . 10 1 1 A 55 55 GLY CA C 55 45.368 46.547 -1.179 1
1 609 . 10 1 1 A 55 55 GLY N N 55 103.265 107.617 -4.352 1
1 610 . 10 1 1 A 56 56 LEU H H 56 7.280 7.536 -0.256 1
1 611 . 10 1 1 A 56 56 LEU HA H 56 3.984 4.635 -0.651 1
1 621 . 10 1 1 A 56 56 LEU C C 56 174.708 175.079 -0.371 1
1 622 . 10 1 1 A 56 56 LEU CA C 56 55.603 54.122 1.481 1
1 623 . 10 1 1 A 56 56 LEU CB C 56 42.752 42.363 0.389 1
1 627 . 10 1 1 A 56 56 LEU N N 56 119.211 123.023 -3.812 1
1 628 . 10 1 1 A 57 57 LEU H H 57 8.693 8.690 0.003 1
1 629 . 10 1 1 A 57 57 LEU HA H 57 4.499 4.913 -0.414 1
1 639 . 10 1 1 A 57 57 LEU C C 57 176.124 175.975 0.149 1
1 640 . 10 1 1 A 57 57 LEU CA C 57 52.959 53.289 -0.330 1
1 641 . 10 1 1 A 57 57 LEU CB C 57 45.122 44.038 1.084 1
1 645 . 10 1 1 A 57 57 LEU N N 57 121.969 129.006 -7.037 1
1 646 . 10 1 1 A 58 58 ASP H H 58 8.334 8.694 -0.360 1
1 647 . 10 1 1 A 58 58 ASP HA H 58 4.139 5.005 -0.866 1
1 650 . 10 1 1 A 58 58 ASP C C 58 178.636 176.820 1.816 1
1 651 . 10 1 1 A 58 58 ASP CA C 58 56.079 55.222 0.857 1
1 652 . 10 1 1 A 58 58 ASP CB C 58 42.135 40.528 1.607 1
1 653 . 10 1 1 A 58 58 ASP N N 58 120.401 121.663 -1.262 1
1 654 . 10 1 1 A 59 59 GLY H H 59 9.378 8.587 0.791 1
1 655 . 10 1 1 A 59 59 GLY HA2 H 59 4.317 3.962 0.355 1
1 656 . 10 1 1 A 59 59 GLY HA3 H 59 3.260 3.964 -0.704 1
1 657 . 10 1 1 A 59 59 GLY C C 59 173.359 173.845 -0.486 1
1 658 . 10 1 1 A 59 59 GLY CA C 59 45.517 45.001 0.516 1
1 659 . 10 1 1 A 59 59 GLY N N 59 116.622 112.136 4.486 1
1 660 . 10 1 1 A 60 60 ASP H H 60 8.009 7.937 0.072 1
1 661 . 10 1 1 A 60 60 ASP HA H 60 4.638 4.918 -0.280 1
1 664 . 10 1 1 A 60 60 ASP C C 60 175.555 175.425 0.130 1
1 665 . 10 1 1 A 60 60 ASP CA C 60 55.286 53.357 1.929 1
1 666 . 10 1 1 A 60 60 ASP CB C 60 42.381 42.427 -0.046 1
1 667 . 10 1 1 A 60 60 ASP N N 60 121.370 120.514 0.856 1
1 668 . 10 1 1 A 61 61 ARG H H 61 8.648 8.650 -0.002 1
1 669 . 10 1 1 A 61 61 ARG HA H 61 5.179 5.246 -0.067 1
1 677 . 10 1 1 A 61 61 ARG C C 61 177.381 174.922 2.459 1
1 678 . 10 1 1 A 61 61 ARG CA C 61 53.704 54.621 -0.917 1
1 679 . 10 1 1 A 61 61 ARG CB C 61 34.017 32.216 1.801 1
1 682 . 10 1 1 A 61 61 ARG N N 61 116.958 121.099 -4.141 1
1 684 . 10 1 1 A 62 62 VAL H H 62 8.247 8.641 -0.394 1
1 685 . 10 1 1 A 62 62 VAL HA H 62 3.806 4.290 -0.484 1
1 693 . 10 1 1 A 62 62 VAL C C 62 174.748 175.221 -0.473 1
1 694 . 10 1 1 A 62 62 VAL CA C 62 63.149 62.457 0.692 1
1 695 . 10 1 1 A 62 62 VAL CB C 62 32.574 31.890 0.684 1
1 698 . 10 1 1 A 62 62 VAL N N 62 118.546 126.113 -7.567 1
1 699 . 10 1 1 A 63 63 LEU H H 63 9.262 9.113 0.149 1
1 700 . 10 1 1 A 63 63 LEU HA H 63 4.412 4.321 0.091 1
1 710 . 10 1 1 A 63 63 LEU C C 63 177.649 177.441 0.208 1
1 711 . 10 1 1 A 63 63 LEU CA C 63 56.044 57.149 -1.105 1
1 712 . 10 1 1 A 63 63 LEU CB C 63 43.339 42.772 0.567 1
1 716 . 10 1 1 A 63 63 LEU N N 63 125.413 131.415 -6.002 1
1 717 . 10 1 1 A 64 64 ARG H H 64 7.806 7.893 -0.087 1
1 718 . 10 1 1 A 64 64 ARG HA H 64 5.704 4.874 0.830 1
1 726 . 10 1 1 A 64 64 ARG C C 64 175.091 174.108 0.983 1
1 727 . 10 1 1 A 64 64 ARG CA C 64 54.148 54.684 -0.536 1
1 728 . 10 1 1 A 64 64 ARG CB C 64 35.742 33.487 2.255 1
1 731 . 10 1 1 A 64 64 ARG N N 64 112.961 117.211 -4.250 1
1 733 . 10 1 1 A 65 65 ILE H H 65 8.327 9.141 -0.814 1
1 734 . 10 1 1 A 65 65 ILE HA H 65 4.384 4.662 -0.278 1
1 744 . 10 1 1 A 65 65 ILE C C 65 175.722 175.563 0.159 1
1 745 . 10 1 1 A 65 65 ILE CA C 65 60.501 59.264 1.237 1
1 746 . 10 1 1 A 65 65 ILE CB C 65 39.547 40.150 -0.603 1
1 750 . 10 1 1 A 65 65 ILE N N 65 119.175 124.006 -4.831 1
1 751 . 10 1 1 A 66 66 ASN H H 66 9.911 9.568 0.343 1
1 752 . 10 1 1 A 66 66 ASN HA H 66 4.428 4.386 0.042 1
1 757 . 10 1 1 A 66 66 ASN C C 66 175.349 174.603 0.746 1
1 758 . 10 1 1 A 66 66 ASN CA C 66 54.157 54.160 -0.003 1
1 759 . 10 1 1 A 66 66 ASN CB C 66 37.024 37.471 -0.447 1
1 760 . 10 1 1 A 66 66 ASN N N 66 128.952 128.003 0.949 1
1 762 . 10 1 1 A 67 67 GLY H H 67 9.230 8.592 0.638 1
1 763 . 10 1 1 A 67 67 GLY HA2 H 67 4.322 3.884 0.438 1
1 764 . 10 1 1 A 67 67 GLY HA3 H 67 3.508 3.893 -0.385 1
1 765 . 10 1 1 A 67 67 GLY C C 67 174.393 174.118 0.275 1
1 766 . 10 1 1 A 67 67 GLY CA C 67 45.341 46.237 -0.896 1
1 767 . 10 1 1 A 67 67 GLY N N 67 103.238 104.716 -1.478 1
1 768 . 10 1 1 A 68 68 VAL H H 68 8.063 7.869 0.194 1
1 769 . 10 1 1 A 68 68 VAL HA H 68 4.015 4.443 -0.428 1
1 777 . 10 1 1 A 68 68 VAL C C 68 175.833 175.145 0.688 1
1 778 . 10 1 1 A 68 68 VAL CA C 68 62.603 61.444 1.159 1
1 779 . 10 1 1 A 68 68 VAL CB C 68 32.574 34.230 -1.656 1
1 782 . 10 1 1 A 68 68 VAL N N 68 125.696 120.134 5.562 1
1 783 . 10 1 1 A 69 69 PHE H H 69 9.301 9.156 0.145 1
1 784 . 10 1 1 A 69 69 PHE HA H 69 4.947 4.519 0.428 1
1 792 . 10 1 1 A 69 69 PHE C C 69 177.120 175.141 1.979 1
1 793 . 10 1 1 A 69 69 PHE CA C 69 59.200 59.994 -0.794 1
1 794 . 10 1 1 A 69 69 PHE CB C 69 39.320 39.614 -0.294 1
1 800 . 10 1 1 A 69 69 PHE N N 69 128.641 128.934 -0.293 1
1 801 . 10 1 1 A 70 70 VAL H H 70 8.312 7.985 0.327 1
1 802 . 10 1 1 A 70 70 VAL HA H 70 4.517 4.347 0.170 1
1 810 . 10 1 1 A 70 70 VAL CA C 70 60.734 60.153 0.581 1
1 811 . 10 1 1 A 70 70 VAL CB C 70 32.976 31.534 1.442 1
1 814 . 10 1 1 A 70 70 VAL N N 70 118.381 120.829 -2.448 1
1 815 . 10 1 1 A 71 71 ASP H H 71 5.373 7.911 -2.538 1
1 816 . 10 1 1 A 71 71 ASP HA H 71 4.413 4.444 -0.031 1
1 819 . 10 1 1 A 71 71 ASP C C 71 174.896 177.818 -2.922 1
1 820 . 10 1 1 A 71 71 ASP CA C 71 58.334 55.887 2.447 1
1 821 . 10 1 1 A 71 71 ASP CB C 71 46.097 41.183 4.914 1
1 822 . 10 1 1 A 71 71 ASP N N 71 119.008 121.958 -2.950 1
1 823 . 10 1 1 A 72 72 LYS H H 72 7.874 7.301 0.573 1
1 824 . 10 1 1 A 72 72 LYS HA H 72 4.522 4.333 0.189 1
1 833 . 10 1 1 A 72 72 LYS C C 72 177.209 176.623 0.586 1
1 834 . 10 1 1 A 72 72 LYS CA C 72 54.122 56.071 -1.949 1
1 835 . 10 1 1 A 72 72 LYS CB C 72 31.640 33.602 -1.962 1
1 839 . 10 1 1 A 72 72 LYS N N 72 110.259 116.488 -6.229 1
1 840 . 10 1 1 A 73 73 GLU H H 73 7.421 7.814 -0.393 1
1 841 . 10 1 1 A 73 73 GLU HA H 73 4.401 4.352 0.049 1
1 846 . 10 1 1 A 73 73 GLU C C 73 176.728 176.027 0.701 1
1 847 . 10 1 1 A 73 73 GLU CA C 73 54.950 57.042 -2.092 1
1 848 . 10 1 1 A 73 73 GLU CB C 73 30.390 30.358 0.032 1
1 850 . 10 1 1 A 73 73 GLU N N 73 120.043 119.367 0.676 1
1 851 . 10 1 1 A 74 74 GLU H H 74 9.360 8.484 0.876 1
1 852 . 10 1 1 A 74 74 GLU HA H 74 4.403 4.759 -0.356 1
1 857 . 10 1 1 A 74 74 GLU C C 74 178.234 176.239 1.995 1
1 858 . 10 1 1 A 74 74 GLU CA C 74 56.516 55.291 1.225 1
1 859 . 10 1 1 A 74 74 GLU CB C 74 30.390 31.030 -0.640 1
1 861 . 10 1 1 A 74 74 GLU N N 74 122.193 121.060 1.133 1
1 862 . 10 1 1 A 75 75 HIS H H 75 9.553 9.226 0.327 1
1 863 . 10 1 1 A 75 75 HIS HA H 75 4.080 4.164 -0.084 1
1 868 . 10 1 1 A 75 75 HIS C C 75 175.985 176.523 -0.538 1
1 869 . 10 1 1 A 75 75 HIS CA C 75 61.016 60.684 0.332 1
1 870 . 10 1 1 A 75 75 HIS CB C 75 29.468 30.385 -0.917 1
1 873 . 10 1 1 A 75 75 HIS N N 75 123.587 120.687 2.900 1
1 874 . 10 1 1 A 76 76 ALA H H 76 9.129 8.306 0.823 1
1 875 . 10 1 1 A 76 76 ALA HA H 76 3.826 3.816 0.010 1
1 879 . 10 1 1 A 76 76 ALA C C 76 180.475 179.982 0.493 1
1 880 . 10 1 1 A 76 76 ALA CA C 76 55.392 55.109 0.283 1
1 881 . 10 1 1 A 76 76 ALA CB C 76 18.182 18.559 -0.377 1
1 882 . 10 1 1 A 76 76 ALA N N 76 117.795 120.518 -2.723 1
1 883 . 10 1 1 A 77 77 GLN H H 77 7.099 7.851 -0.752 1
1 884 . 10 1 1 A 77 77 GLN HA H 77 4.198 4.029 0.169 1
1 891 . 10 1 1 A 77 77 GLN C C 77 177.860 179.049 -1.189 1
1 892 . 10 1 1 A 77 77 GLN CA C 77 57.790 58.918 -1.128 1
1 893 . 10 1 1 A 77 77 GLN CB C 77 28.536 28.610 -0.074 1
1 895 . 10 1 1 A 77 77 GLN N N 77 115.764 117.555 -1.791 1
1 897 . 10 1 1 A 78 78 VAL H H 78 7.430 7.800 -0.370 1
1 898 . 10 1 1 A 78 78 VAL HA H 78 3.241 3.496 -0.255 1
1 906 . 10 1 1 A 78 78 VAL C C 78 177.042 177.893 -0.851 1
1 907 . 10 1 1 A 78 78 VAL CA C 78 67.299 66.300 0.999 1
1 908 . 10 1 1 A 78 78 VAL CB C 78 30.819 31.483 -0.664 1
1 911 . 10 1 1 A 78 78 VAL N N 78 121.143 119.994 1.149 1
1 912 . 10 1 1 A 79 79 VAL H H 79 7.773 8.081 -0.308 1
1 913 . 10 1 1 A 79 79 VAL HA H 79 3.315 3.603 -0.288 1
1 921 . 10 1 1 A 79 79 VAL C C 79 179.179 177.452 1.727 1
1 922 . 10 1 1 A 79 79 VAL CA C 79 66.694 64.823 1.871 1
1 923 . 10 1 1 A 79 79 VAL CB C 79 31.841 31.020 0.821 1
1 926 . 10 1 1 A 79 79 VAL N N 79 117.473 119.855 -2.382 1
1 927 . 10 1 1 A 80 80 GLU H H 80 7.410 7.513 -0.103 1
1 928 . 10 1 1 A 80 80 GLU HA H 80 4.258 4.055 0.203 1
1 933 . 10 1 1 A 80 80 GLU C C 80 178.018 179.134 -1.116 1
1 934 . 10 1 1 A 80 80 GLU CA C 80 58.566 58.572 -0.006 1
1 935 . 10 1 1 A 80 80 GLU CB C 80 29.072 29.397 -0.325 1
1 937 . 10 1 1 A 80 80 GLU N N 80 120.451 121.333 -0.882 1
1 938 . 10 1 1 A 81 81 LEU H H 81 8.070 8.415 -0.345 1
1 939 . 10 1 1 A 81 81 LEU HA H 81 3.976 4.018 -0.042 1
1 949 . 10 1 1 A 81 81 LEU C C 81 180.658 178.921 1.737 1
1 950 . 10 1 1 A 81 81 LEU CA C 81 58.061 57.885 0.176 1
1 951 . 10 1 1 A 81 81 LEU CB C 81 42.115 41.800 0.315 1
1 955 . 10 1 1 A 81 81 LEU N N 81 119.943 120.387 -0.444 1
1 956 . 10 1 1 A 82 82 VAL H H 82 7.609 7.902 -0.293 1
1 957 . 10 1 1 A 82 82 VAL HA H 82 3.474 3.501 -0.027 1
1 965 . 10 1 1 A 82 82 VAL C C 82 178.927 178.130 0.797 1
1 966 . 10 1 1 A 82 82 VAL CA C 82 67.398 67.021 0.377 1
1 967 . 10 1 1 A 82 82 VAL CB C 82 31.306 31.398 -0.092 1
1 970 . 10 1 1 A 82 82 VAL N N 82 118.150 117.892 0.258 1
1 971 . 10 1 1 A 83 83 ARG H H 83 8.186 7.764 0.422 1
1 972 . 10 1 1 A 83 83 ARG HA H 83 3.994 4.059 -0.065 1
1 979 . 10 1 1 A 83 83 ARG C C 83 179.999 179.507 0.492 1
1 980 . 10 1 1 A 83 83 ARG CA C 83 60.205 59.938 0.267 1
1 981 . 10 1 1 A 83 83 ARG CB C 83 30.103 30.097 0.006 1
1 984 . 10 1 1 A 83 83 ARG N N 83 122.902 119.325 3.577 1
1 985 . 10 1 1 A 84 84 LYS H H 84 8.772 7.845 0.927 1
1 986 . 10 1 1 A 84 84 LYS HA H 84 4.047 4.087 -0.040 1
1 995 . 10 1 1 A 84 84 LYS C C 84 176.934 179.217 -2.283 1
1 996 . 10 1 1 A 84 84 LYS CA C 84 58.142 59.332 -1.190 1
1 997 . 10 1 1 A 84 84 LYS CB C 84 32.492 32.075 0.417 1
1 1001 . 10 1 1 A 84 84 LYS N N 84 117.548 120.323 -2.775 1
1 1002 . 10 1 1 A 85 85 SER H H 85 7.333 8.302 -0.969 1
1 1003 . 10 1 1 A 85 85 SER HA H 85 4.235 4.339 -0.104 1
1 1006 . 10 1 1 A 85 85 SER C C 85 175.588 175.207 0.381 1
1 1007 . 10 1 1 A 85 85 SER CA C 85 59.535 61.748 -2.213 1
1 1008 . 10 1 1 A 85 85 SER CB C 85 63.571 63.824 -0.253 1
1 1009 . 10 1 1 A 85 85 SER N N 85 113.544 115.314 -1.770 1
1 1010 . 10 1 1 A 86 86 GLY H H 86 7.459 7.377 0.082 1
1 1011 . 10 1 1 A 86 86 GLY HA2 H 86 4.176 4.107 0.069 1
1 1012 . 10 1 1 A 86 86 GLY HA3 H 86 3.762 4.112 -0.350 1
1 1013 . 10 1 1 A 86 86 GLY C C 86 176.407 175.350 1.057 1
1 1014 . 10 1 1 A 86 86 GLY CA C 86 46.109 43.917 2.192 1
1 1015 . 10 1 1 A 86 86 GLY N N 86 104.331 106.679 -2.348 1
1 1016 . 10 1 1 A 87 87 ASN HA H 87 4.650 4.449 0.201 1
1 1021 . 10 1 1 A 87 87 ASN C C 87 173.653 175.719 -2.066 1
1 1022 . 10 1 1 A 87 87 ASN CA C 87 54.492 55.688 -1.196 1
1 1023 . 10 1 1 A 87 87 ASN CB C 87 38.425 38.369 0.056 1
1 1024 . 10 1 1 A 87 87 ASN N N 87 118.401 120.237 -1.836 1
1 1026 . 10 1 1 A 88 88 SER H H 88 7.435 7.849 -0.414 1
1 1027 . 10 1 1 A 88 88 SER HA H 88 5.438 5.492 -0.054 1
1 1030 . 10 1 1 A 88 88 SER C C 88 172.867 173.511 -0.644 1
1 1031 . 10 1 1 A 88 88 SER CA C 88 58.160 57.121 1.039 1
1 1032 . 10 1 1 A 88 88 SER CB C 88 65.861 64.798 1.063 1
1 1033 . 10 1 1 A 88 88 SER N N 88 113.765 113.134 0.631 1
1 1034 . 10 1 1 A 89 89 VAL H H 89 8.452 8.863 -0.411 1
1 1035 . 10 1 1 A 89 89 VAL HA H 89 4.519 4.958 -0.439 1
1 1043 . 10 1 1 A 89 89 VAL C C 89 171.391 174.859 -3.468 1
1 1044 . 10 1 1 A 89 89 VAL CA C 89 61.333 60.471 0.862 1
1 1045 . 10 1 1 A 89 89 VAL CB C 89 33.897 35.876 -1.979 1
1 1048 . 10 1 1 A 89 89 VAL N N 89 120.001 126.202 -6.201 1
1 1049 . 10 1 1 A 90 90 THR H H 90 8.348 8.716 -0.368 1
1 1050 . 10 1 1 A 90 90 THR HA H 90 5.042 5.204 -0.162 1
1 1055 . 10 1 1 A 90 90 THR C C 90 173.926 173.518 0.408 1
1 1056 . 10 1 1 A 90 90 THR CA C 90 61.403 61.497 -0.094 1
1 1057 . 10 1 1 A 90 90 THR CB C 90 69.553 70.664 -1.111 1
1 1059 . 10 1 1 A 90 90 THR N N 90 123.477 122.515 0.962 1
1 1060 . 10 1 1 A 91 91 LEU H H 91 9.195 8.555 0.640 1
1 1061 . 10 1 1 A 91 91 LEU HA H 91 5.161 5.051 0.110 1
1 1071 . 10 1 1 A 91 91 LEU C C 91 174.564 175.576 -1.012 1
1 1072 . 10 1 1 A 91 91 LEU CA C 91 52.590 53.575 -0.985 1
1 1073 . 10 1 1 A 91 91 LEU CB C 91 44.998 45.667 -0.669 1
1 1077 . 10 1 1 A 91 91 LEU N N 91 128.419 125.937 2.482 1
1 1078 . 10 1 1 A 92 92 LEU H H 92 8.644 8.613 0.031 1
1 1079 . 10 1 1 A 92 92 LEU HA H 92 5.335 5.133 0.202 1
1 1089 . 10 1 1 A 92 92 LEU C C 92 176.451 175.480 0.971 1
1 1090 . 10 1 1 A 92 92 LEU CA C 92 54.220 53.611 0.609 1
1 1091 . 10 1 1 A 92 92 LEU CB C 92 44.323 42.679 1.644 1
1 1095 . 10 1 1 A 92 92 LEU N N 92 125.894 125.079 0.815 1
1 1096 . 10 1 1 A 93 93 VAL H H 93 9.249 8.585 0.664 1
1 1097 . 10 1 1 A 93 93 VAL HA H 93 5.573 4.994 0.579 1
1 1105 . 10 1 1 A 93 93 VAL C C 93 173.550 174.272 -0.722 1
1 1106 . 10 1 1 A 93 93 VAL CA C 93 58.340 60.721 -2.381 1
1 1107 . 10 1 1 A 93 93 VAL CB C 93 36.159 33.701 2.458 1
1 1110 . 10 1 1 A 93 93 VAL N N 93 120.660 120.934 -0.274 1
1 1111 . 10 1 1 A 94 94 LEU H H 94 8.634 9.005 -0.371 1
1 1112 . 10 1 1 A 94 94 LEU HA H 94 4.911 5.047 -0.136 1
1 1122 . 10 1 1 A 94 94 LEU C C 94 174.172 176.054 -1.882 1
1 1123 . 10 1 1 A 94 94 LEU CA C 94 52.659 53.339 -0.680 1
1 1124 . 10 1 1 A 94 94 LEU CB C 94 47.910 45.561 2.349 1
1 1128 . 10 1 1 A 94 94 LEU N N 94 120.304 127.984 -7.680 1
1 1129 . 10 1 1 A 95 95 ASP H H 95 8.210 8.859 -0.649 1
1 1130 . 10 1 1 A 95 95 ASP HA H 95 5.190 4.609 0.581 1
1 1133 . 10 1 1 A 95 95 ASP C C 95 175.887 178.004 -2.117 1
1 1134 . 10 1 1 A 95 95 ASP CA C 95 53.899 54.409 -0.510 1
1 1135 . 10 1 1 A 95 95 ASP CB C 95 41.188 41.230 -0.042 1
1 1136 . 10 1 1 A 95 95 ASP N N 95 122.184 124.313 -2.129 1
1 1137 . 10 1 1 A 96 96 GLY H H 96 8.478 8.850 -0.372 1
1 1138 . 10 1 1 A 96 96 GLY HA2 H 96 4.002 3.806 0.196 1
1 1139 . 10 1 1 A 96 96 GLY HA3 H 96 3.757 3.812 -0.055 1
1 1140 . 10 1 1 A 96 96 GLY C C 96 175.497 175.404 0.093 1
1 1141 . 10 1 1 A 96 96 GLY CA C 96 49.944 47.325 2.619 1
1 1142 . 10 1 1 A 96 96 GLY N N 96 108.610 110.857 -2.247 1
1 1143 . 10 1 1 A 97 97 ASP H H 97 8.401 8.166 0.235 1
1 1144 . 10 1 1 A 97 97 ASP HA H 97 4.454 4.344 0.110 1
1 1147 . 10 1 1 A 97 97 ASP C C 97 179.612 178.735 0.877 1
1 1148 . 10 1 1 A 97 97 ASP CA C 97 57.913 57.435 0.478 1
1 1149 . 10 1 1 A 97 97 ASP CB C 97 41.145 40.512 0.633 1
1 1150 . 10 1 1 A 97 97 ASP N N 97 120.034 121.594 -1.560 1
1 1151 . 10 1 1 A 98 98 SER H H 98 8.152 8.186 -0.034 1
1 1152 . 10 1 1 A 98 98 SER HA H 98 4.218 4.282 -0.064 1
1 1155 . 10 1 1 A 98 98 SER C C 98 175.061 175.529 -0.468 1
1 1156 . 10 1 1 A 98 98 SER CA C 98 62.180 62.233 -0.053 1
1 1157 . 10 1 1 A 98 98 SER CB C 98 62.179 62.799 -0.620 1
1 1158 . 10 1 1 A 98 98 SER N N 98 117.174 116.172 1.002 1
1 1159 . 10 1 1 A 99 99 TYR H H 99 9.051 8.422 0.629 1
1 1160 . 10 1 1 A 99 99 TYR HA H 99 3.692 3.759 -0.067 1
1 1167 . 10 1 1 A 99 99 TYR C C 99 176.460 177.113 -0.653 1
1 1168 . 10 1 1 A 99 99 TYR CA C 99 62.814 62.037 0.777 1
1 1169 . 10 1 1 A 99 99 TYR CB C 99 38.829 38.532 0.297 1
1 1174 . 10 1 1 A 99 99 TYR N N 99 123.539 122.339 1.200 1
1 1175 . 10 1 1 A 100 100 GLU H H 100 8.520 8.661 -0.141 1
1 1176 . 10 1 1 A 100 100 GLU HA H 100 3.952 3.972 -0.020 1
1 1181 . 10 1 1 A 100 100 GLU C C 100 180.151 179.265 0.886 1
1 1182 . 10 1 1 A 100 100 GLU CA C 100 60.099 59.774 0.325 1
1 1183 . 10 1 1 A 100 100 GLU CB C 100 29.435 29.446 -0.011 1
1 1185 . 10 1 1 A 100 100 GLU N N 100 117.082 118.133 -1.051 1
1 1186 . 10 1 1 A 101 101 LYS H H 101 7.740 8.023 -0.283 1
1 1187 . 10 1 1 A 101 101 LYS HA H 101 3.984 4.136 -0.152 1
1 1196 . 10 1 1 A 101 101 LYS C C 101 178.377 178.907 -0.530 1
1 1197 . 10 1 1 A 101 101 LYS CA C 101 59.888 58.886 1.002 1
1 1198 . 10 1 1 A 101 101 LYS CB C 101 32.821 32.438 0.383 1
1 1202 . 10 1 1 A 101 101 LYS N N 101 119.851 121.218 -1.367 1
1 1203 . 10 1 1 A 102 102 ALA H H 102 8.538 7.777 0.761 1
1 1204 . 10 1 1 A 102 102 ALA HA H 102 3.632 4.144 -0.512 1
1 1208 . 10 1 1 A 102 102 ALA C C 102 179.870 179.664 0.206 1
1 1209 . 10 1 1 A 102 102 ALA CA C 102 55.285 55.116 0.169 1
1 1210 . 10 1 1 A 102 102 ALA CB C 102 17.163 18.717 -1.554 1
1 1211 . 10 1 1 A 102 102 ALA N N 102 124.176 121.734 2.442 1
1 1212 . 10 1 1 A 103 103 VAL H H 103 8.147 8.079 0.068 1
1 1213 . 10 1 1 A 103 103 VAL HA H 103 3.658 3.655 0.003 1
1 1221 . 10 1 1 A 103 103 VAL C C 103 181.113 177.533 3.580 1
1 1222 . 10 1 1 A 103 103 VAL CA C 103 66.090 65.276 0.814 1
1 1223 . 10 1 1 A 103 103 VAL CB C 103 31.822 31.796 0.026 1
1 1226 . 10 1 1 A 103 103 VAL N N 103 117.841 117.519 0.322 1
1 1227 . 10 1 1 A 104 104 LYS H H 104 7.903 7.672 0.231 1
1 1228 . 10 1 1 A 104 104 LYS HA H 104 4.065 3.974 0.091 1
1 1235 . 10 1 1 A 104 104 LYS C C 104 177.715 178.582 -0.867 1
1 1236 . 10 1 1 A 104 104 LYS CA C 104 59.094 60.193 -1.099 1
1 1237 . 10 1 1 A 104 104 LYS CB C 104 32.285 31.929 0.356 1
1 1241 . 10 1 1 A 104 104 LYS N N 104 121.515 121.815 -0.300 1
1 1242 . 10 1 1 A 105 105 ASN H H 105 7.747 8.167 -0.420 1
1 1243 . 10 1 1 A 105 105 ASN HA H 105 4.721 4.856 -0.135 1
1 1248 . 10 1 1 A 105 105 ASN C C 105 173.320 173.965 -0.645 1
1 1249 . 10 1 1 A 105 105 ASN CA C 105 53.399 53.014 0.385 1
1 1250 . 10 1 1 A 105 105 ASN CB C 105 39.249 38.460 0.789 1
1 1251 . 10 1 1 A 105 105 ASN N N 105 114.941 114.925 0.016 1
1 1253 . 10 1 1 A 106 106 GLN H H 106 7.850 7.648 0.202 1
1 1254 . 10 1 1 A 106 106 GLN HA H 106 3.902 3.864 0.038 1
1 1261 . 10 1 1 A 106 106 GLN C C 106 175.168 174.834 0.334 1
1 1262 . 10 1 1 A 106 106 GLN CA C 106 56.978 56.806 0.172 1
1 1263 . 10 1 1 A 106 106 GLN CB C 106 25.770 26.469 -0.699 1
1 1265 . 10 1 1 A 106 106 GLN N N 106 114.989 115.745 -0.756 1
1 1267 . 10 1 1 A 107 107 VAL H H 107 8.005 7.520 0.485 1
1 1268 . 10 1 1 A 107 107 VAL HA H 107 3.664 4.050 -0.386 1
1 1276 . 10 1 1 A 107 107 VAL C C 107 175.468 175.092 0.376 1
1 1277 . 10 1 1 A 107 107 VAL CA C 107 62.726 62.084 0.642 1
1 1278 . 10 1 1 A 107 107 VAL CB C 107 32.535 31.898 0.637 1
1 1281 . 10 1 1 A 107 107 VAL N N 107 120.216 120.182 0.034 1
1 1282 . 10 1 1 A 108 108 ASP H H 108 8.484 8.702 -0.218 1
1 1283 . 10 1 1 A 108 108 ASP HA H 108 4.467 4.521 -0.054 1
1 1286 . 10 1 1 A 108 108 ASP C C 108 177.179 176.041 1.138 1
1 1287 . 10 1 1 A 108 108 ASP CA C 108 53.417 54.960 -1.543 1
1 1288 . 10 1 1 A 108 108 ASP CB C 108 40.030 40.704 -0.674 1
1 1289 . 10 1 1 A 108 108 ASP N N 108 125.414 127.029 -1.615 1
1 1290 . 10 1 1 A 109 109 LEU H H 109 8.470 8.411 0.059 1
1 1291 . 10 1 1 A 109 109 LEU HA H 109 3.846 4.040 -0.194 1
1 1301 . 10 1 1 A 109 109 LEU C C 109 178.145 178.539 -0.394 1
1 1302 . 10 1 1 A 109 109 LEU CA C 109 56.573 56.757 -0.184 1
1 1303 . 10 1 1 A 109 109 LEU CB C 109 42.011 41.816 0.195 1
1 1307 . 10 1 1 A 109 109 LEU N N 109 127.577 126.576 1.001 1
1 1308 . 10 1 1 A 110 110 LYS H H 110 8.062 7.806 0.256 1
1 1309 . 10 1 1 A 110 110 LYS HA H 110 3.022 3.782 -0.760 1
1 1317 . 10 1 1 A 110 110 LYS C C 110 177.248 178.012 -0.764 1
1 1318 . 10 1 1 A 110 110 LYS CA C 110 58.742 58.437 0.305 1
1 1319 . 10 1 1 A 110 110 LYS CB C 110 31.667 30.520 1.147 1
1 1323 . 10 1 1 A 110 110 LYS N N 110 118.873 117.776 1.097 1
1 1324 . 10 1 1 A 111 111 GLU H H 111 7.113 7.909 -0.796 1
1 1325 . 10 1 1 A 111 111 GLU HA H 111 4.117 4.052 0.065 1
1 1330 . 10 1 1 A 111 111 GLU C C 111 176.519 177.764 -1.245 1
1 1331 . 10 1 1 A 111 111 GLU CA C 111 55.621 59.205 -3.584 1
1 1332 . 10 1 1 A 111 111 GLU CB C 111 29.943 29.050 0.893 1
1 1334 . 10 1 1 A 111 111 GLU N N 111 114.282 118.241 -3.959 1
1 1335 . 10 1 1 A 112 112 LEU H H 112 6.848 7.905 -1.057 1
1 1336 . 10 1 1 A 112 112 LEU HA H 112 4.293 4.131 0.162 1
1 1346 . 10 1 1 A 112 112 LEU C C 112 175.674 176.075 -0.401 1
1 1347 . 10 1 1 A 112 112 LEU CA C 112 55.197 55.897 -0.700 1
1 1348 . 10 1 1 A 112 112 LEU CB C 112 41.681 41.678 0.003 1
1 1352 . 10 1 1 A 112 112 LEU N N 112 118.934 121.906 -2.972 1
1 1353 . 10 1 1 A 113 113 ASP H H 113 8.466 8.562 -0.096 1
1 1354 . 10 1 1 A 113 113 ASP HA H 113 4.593 5.245 -0.652 1
1 1357 . 10 1 1 A 113 113 ASP C C 113 174.511 175.708 -1.197 1
1 1358 . 10 1 1 A 113 113 ASP CA C 113 53.558 53.166 0.392 1
1 1359 . 10 1 1 A 113 113 ASP CB C 113 42.448 43.406 -0.958 1
1 1360 . 10 1 1 A 113 113 ASP N N 113 122.148 124.696 -2.548 1
1 1 . 11 1 1 A 6 6 SER HA H 6 4.483 4.963 -0.480 1
1 4 . 11 1 1 A 6 6 SER C C 6 175.167 172.855 2.312 1
1 5 . 11 1 1 A 6 6 SER CA C 6 58.759 57.101 1.658 1
1 6 . 11 1 1 A 6 6 SER CB C 6 64.069 65.596 -1.527 1
1 7 . 11 1 1 A 7 7 GLY H H 7 8.431 8.673 -0.242 1
1 8 . 11 1 1 A 7 7 GLY HA2 H 7 3.973 4.373 -0.400 1
1 9 . 11 1 1 A 7 7 GLY HA3 H 7 3.973 4.378 -0.405 1
1 10 . 11 1 1 A 7 7 GLY C C 7 174.570 171.817 2.753 1
1 11 . 11 1 1 A 7 7 GLY CA C 7 45.483 44.693 0.790 1
1 12 . 11 1 1 A 7 7 GLY N N 7 110.640 112.638 -1.998 1
1 13 . 11 1 1 A 8 8 MET H H 8 8.239 9.026 -0.787 1
1 14 . 11 1 1 A 8 8 MET HA H 8 4.386 4.888 -0.502 1
1 22 . 11 1 1 A 8 8 MET C C 8 176.621 176.092 0.529 1
1 23 . 11 1 1 A 8 8 MET CA C 8 55.991 53.905 2.086 1
1 24 . 11 1 1 A 8 8 MET CB C 8 32.986 33.752 -0.766 1
1 27 . 11 1 1 A 8 8 MET N N 8 120.219 120.358 -0.139 1
1 28 . 11 1 1 A 9 9 ALA H H 9 8.435 8.698 -0.263 1
1 29 . 11 1 1 A 9 9 ALA HA H 9 4.182 3.651 0.531 1
1 33 . 11 1 1 A 9 9 ALA C C 9 177.951 177.082 0.869 1
1 34 . 11 1 1 A 9 9 ALA CA C 9 53.399 52.831 0.568 1
1 35 . 11 1 1 A 9 9 ALA CB C 9 18.955 17.462 1.493 1
1 36 . 11 1 1 A 9 9 ALA N N 9 124.459 127.771 -3.312 1
1 37 . 11 1 1 A 10 10 SER H H 10 8.100 7.857 0.243 1
1 38 . 11 1 1 A 10 10 SER HA H 10 4.391 4.418 -0.027 1
1 41 . 11 1 1 A 10 10 SER C C 10 174.467 174.843 -0.376 1
1 42 . 11 1 1 A 10 10 SER CA C 10 58.709 61.856 -3.147 1
1 43 . 11 1 1 A 10 10 SER CB C 10 63.778 63.586 0.192 1
1 44 . 11 1 1 A 10 10 SER N N 10 113.881 111.120 2.761 1
1 45 . 11 1 1 A 11 11 THR H H 11 7.821 7.745 0.076 1
1 46 . 11 1 1 A 11 11 THR HA H 11 4.191 4.886 -0.695 1
1 51 . 11 1 1 A 11 11 THR C C 11 173.610 173.354 0.256 1
1 52 . 11 1 1 A 11 11 THR CA C 11 61.936 60.675 1.261 1
1 53 . 11 1 1 A 11 11 THR CB C 11 69.713 71.056 -1.343 1
1 55 . 11 1 1 A 11 11 THR N N 11 114.471 110.857 3.614 1
1 56 . 11 1 1 A 12 12 PHE H H 12 7.946 9.126 -1.180 1
1 57 . 11 1 1 A 12 12 PHE HA H 12 4.769 4.797 -0.028 1
1 65 . 11 1 1 A 12 12 PHE C C 12 174.211 175.905 -1.694 1
1 66 . 11 1 1 A 12 12 PHE CA C 12 56.644 58.060 -1.416 1
1 67 . 11 1 1 A 12 12 PHE CB C 12 40.609 40.033 0.576 1
1 73 . 11 1 1 A 12 12 PHE N N 12 120.763 125.079 -4.316 1
1 74 . 11 1 1 A 13 13 ASN H H 13 9.004 8.754 0.250 1
1 75 . 11 1 1 A 13 13 ASN HA H 13 5.366 5.475 -0.109 1
1 80 . 11 1 1 A 13 13 ASN C C 13 172.158 172.602 -0.444 1
1 81 . 11 1 1 A 13 13 ASN CA C 13 50.988 50.580 0.408 1
1 82 . 11 1 1 A 13 13 ASN CB C 13 39.942 39.499 0.443 1
1 83 . 11 1 1 A 13 13 ASN N N 13 119.973 117.988 1.985 1
1 85 . 11 1 1 A 14 14 PRO HA H 14 4.945 4.615 0.330 1
1 92 . 11 1 1 A 14 14 PRO C C 14 174.901 175.831 -0.930 1
1 93 . 11 1 1 A 14 14 PRO CA C 14 63.096 62.673 0.423 1
1 94 . 11 1 1 A 14 14 PRO CB C 14 32.739 32.487 0.252 1
1 97 . 11 1 1 A 15 15 ARG H H 15 8.908 8.715 0.193 1
1 98 . 11 1 1 A 15 15 ARG HA H 15 4.626 4.677 -0.051 1
1 106 . 11 1 1 A 15 15 ARG C C 15 174.432 175.774 -1.342 1
1 107 . 11 1 1 A 15 15 ARG CA C 15 54.827 55.336 -0.509 1
1 108 . 11 1 1 A 15 15 ARG CB C 15 32.439 31.993 0.446 1
1 111 . 11 1 1 A 15 15 ARG N N 15 118.947 121.389 -2.442 1
1 113 . 11 1 1 A 16 16 GLU H H 16 8.838 8.981 -0.143 1
1 114 . 11 1 1 A 16 16 GLU HA H 16 4.876 4.683 0.193 1
1 119 . 11 1 1 A 16 16 GLU C C 16 175.767 175.248 0.519 1
1 120 . 11 1 1 A 16 16 GLU CA C 16 55.621 56.235 -0.614 1
1 121 . 11 1 1 A 16 16 GLU CB C 16 31.093 30.830 0.263 1
1 123 . 11 1 1 A 16 16 GLU N N 16 125.316 127.907 -2.591 1
1 124 . 11 1 1 A 17 17 CYS H H 17 9.327 8.544 0.783 1
1 125 . 11 1 1 A 17 17 CYS HA H 17 4.804 5.007 -0.203 1
1 128 . 11 1 1 A 17 17 CYS C C 17 172.973 172.949 0.024 1
1 129 . 11 1 1 A 17 17 CYS CA C 17 57.930 57.634 0.296 1
1 130 . 11 1 1 A 17 17 CYS CB C 17 30.105 31.583 -1.478 1
1 131 . 11 1 1 A 17 17 CYS N N 17 127.909 123.217 4.692 1
1 132 . 11 1 1 A 18 18 LYS H H 18 9.022 8.745 0.277 1
1 133 . 11 1 1 A 18 18 LYS HA H 18 4.769 4.844 -0.075 1
1 142 . 11 1 1 A 18 18 LYS C C 18 174.586 175.247 -0.661 1
1 143 . 11 1 1 A 18 18 LYS CA C 18 55.956 55.101 0.855 1
1 144 . 11 1 1 A 18 18 LYS CB C 18 32.203 34.328 -2.125 1
1 148 . 11 1 1 A 18 18 LYS N N 18 127.039 124.861 2.178 1
1 149 . 11 1 1 A 19 19 LEU H H 19 8.784 9.062 -0.278 1
1 150 . 11 1 1 A 19 19 LEU HA H 19 4.852 4.921 -0.069 1
1 160 . 11 1 1 A 19 19 LEU C C 19 176.862 176.052 0.810 1
1 161 . 11 1 1 A 19 19 LEU CA C 19 55.391 53.461 1.930 1
1 162 . 11 1 1 A 19 19 LEU CB C 19 44.442 43.086 1.356 1
1 166 . 11 1 1 A 19 19 LEU N N 19 126.311 126.889 -0.578 1
1 167 . 11 1 1 A 20 20 SER H H 20 8.215 8.922 -0.707 1
1 168 . 11 1 1 A 20 20 SER HA H 20 5.461 5.573 -0.112 1
1 171 . 11 1 1 A 20 20 SER C C 20 171.960 173.603 -1.643 1
1 172 . 11 1 1 A 20 20 SER CA C 20 57.525 56.654 0.871 1
1 173 . 11 1 1 A 20 20 SER CB C 20 65.794 65.555 0.239 1
1 174 . 11 1 1 A 20 20 SER N N 20 115.113 117.652 -2.539 1
1 175 . 11 1 1 A 21 21 LYS H H 21 9.001 8.729 0.272 1
1 176 . 11 1 1 A 21 21 LYS HA H 21 4.887 5.004 -0.117 1
1 185 . 11 1 1 A 21 21 LYS C C 21 174.133 175.147 -1.014 1
1 186 . 11 1 1 A 21 21 LYS CA C 21 53.840 54.346 -0.506 1
1 187 . 11 1 1 A 21 21 LYS CB C 21 36.553 35.788 0.765 1
1 191 . 11 1 1 A 21 21 LYS N N 21 120.938 122.080 -1.142 1
1 192 . 11 1 1 A 22 22 GLN H H 22 8.201 8.343 -0.142 1
1 193 . 11 1 1 A 22 22 GLN HA H 22 4.448 4.516 -0.068 1
1 200 . 11 1 1 A 22 22 GLN C C 22 176.372 176.285 0.087 1
1 201 . 11 1 1 A 22 22 GLN CA C 22 53.658 55.035 -1.377 1
1 202 . 11 1 1 A 22 22 GLN CB C 22 30.473 30.277 0.196 1
1 204 . 11 1 1 A 22 22 GLN N N 22 116.816 119.370 -2.554 1
1 206 . 11 1 1 A 23 23 GLU H H 23 8.624 8.776 -0.152 1
1 207 . 11 1 1 A 23 23 GLU HA H 23 4.056 3.931 0.125 1
1 212 . 11 1 1 A 23 23 GLU C C 23 177.778 177.216 0.562 1
1 213 . 11 1 1 A 23 23 GLU CA C 23 58.001 58.317 -0.316 1
1 214 . 11 1 1 A 23 23 GLU CB C 23 29.237 28.859 0.378 1
1 216 . 11 1 1 A 23 23 GLU N N 23 122.364 121.978 0.386 1
1 217 . 11 1 1 A 24 24 GLY H H 24 8.962 8.811 0.151 1
1 218 . 11 1 1 A 24 24 GLY HA2 H 24 4.139 3.979 0.160 1
1 219 . 11 1 1 A 24 24 GLY HA3 H 24 3.711 3.984 -0.273 1
1 220 . 11 1 1 A 24 24 GLY C C 24 173.857 174.253 -0.396 1
1 221 . 11 1 1 A 24 24 GLY CA C 24 45.288 44.996 0.292 1
1 222 . 11 1 1 A 24 24 GLY N N 24 113.942 112.781 1.161 1
1 223 . 11 1 1 A 25 25 GLN H H 25 7.643 7.463 0.180 1
1 224 . 11 1 1 A 25 25 GLN HA H 25 4.488 4.269 0.219 1
1 231 . 11 1 1 A 25 25 GLN C C 25 174.727 175.314 -0.587 1
1 232 . 11 1 1 A 25 25 GLN CA C 25 54.052 55.381 -1.329 1
1 233 . 11 1 1 A 25 25 GLN CB C 25 30.843 30.232 0.611 1
1 235 . 11 1 1 A 25 25 GLN N N 25 119.538 121.388 -1.850 1
1 237 . 11 1 1 A 26 26 ASN H H 26 8.625 9.056 -0.431 1
1 238 . 11 1 1 A 26 26 ASN HA H 26 4.862 4.874 -0.012 1
1 243 . 11 1 1 A 26 26 ASN C C 26 176.261 174.979 1.282 1
1 244 . 11 1 1 A 26 26 ASN CA C 26 51.812 51.749 0.063 1
1 245 . 11 1 1 A 26 26 ASN CB C 26 40.403 40.695 -0.292 1
1 246 . 11 1 1 A 26 26 ASN N N 26 120.047 122.407 -2.360 1
1 248 . 11 1 1 A 27 27 TYR HA H 27 4.152 4.702 -0.550 1
1 255 . 11 1 1 A 27 27 TYR C C 27 176.731 176.240 0.491 1
1 256 . 11 1 1 A 27 27 TYR CA C 27 62.462 58.469 3.993 1
1 257 . 11 1 1 A 27 27 TYR CB C 27 40.240 39.920 0.320 1
1 262 . 11 1 1 A 27 27 TYR N N 27 121.761 120.665 1.096 1
1 263 . 11 1 1 A 28 28 GLY H H 28 8.285 8.026 0.259 1
1 264 . 11 1 1 A 28 28 GLY HA2 H 28 4.490 3.956 0.534 1
1 265 . 11 1 1 A 28 28 GLY HA3 H 28 3.759 4.042 -0.283 1
1 266 . 11 1 1 A 28 28 GLY C C 28 172.198 174.032 -1.834 1
1 267 . 11 1 1 A 28 28 GLY CA C 28 46.139 45.312 0.827 1
1 268 . 11 1 1 A 28 28 GLY N N 28 103.567 107.385 -3.818 1
1 269 . 11 1 1 A 29 29 PHE H H 29 6.878 7.963 -1.085 1
1 270 . 11 1 1 A 29 29 PHE HA H 29 5.179 5.042 0.137 1
1 278 . 11 1 1 A 29 29 PHE C C 29 172.840 173.961 -1.121 1
1 279 . 11 1 1 A 29 29 PHE CA C 29 55.262 55.169 0.093 1
1 280 . 11 1 1 A 29 29 PHE CB C 29 41.779 42.406 -0.627 1
1 286 . 11 1 1 A 29 29 PHE N N 29 111.027 117.643 -6.616 1
1 287 . 11 1 1 A 30 30 PHE H H 30 8.806 8.785 0.021 1
1 288 . 11 1 1 A 30 30 PHE HA H 30 4.923 4.939 -0.016 1
1 296 . 11 1 1 A 30 30 PHE C C 30 174.501 174.916 -0.415 1
1 297 . 11 1 1 A 30 30 PHE CA C 30 55.356 56.208 -0.852 1
1 298 . 11 1 1 A 30 30 PHE CB C 30 41.681 43.103 -1.422 1
1 304 . 11 1 1 A 30 30 PHE N N 30 118.710 117.996 0.714 1
1 305 . 11 1 1 A 31 31 LEU H H 31 8.441 9.190 -0.749 1
1 306 . 11 1 1 A 31 31 LEU HA H 31 5.447 5.058 0.389 1
1 316 . 11 1 1 A 31 31 LEU C C 31 177.306 175.938 1.368 1
1 317 . 11 1 1 A 31 31 LEU CA C 31 53.610 53.309 0.301 1
1 318 . 11 1 1 A 31 31 LEU CB C 31 43.696 43.039 0.657 1
1 322 . 11 1 1 A 31 31 LEU N N 31 123.765 122.231 1.534 1
1 323 . 11 1 1 A 32 32 ARG H H 32 9.381 8.932 0.449 1
1 324 . 11 1 1 A 32 32 ARG HA H 32 4.840 4.804 0.036 1
1 331 . 11 1 1 A 32 32 ARG C C 32 175.155 175.707 -0.552 1
1 332 . 11 1 1 A 32 32 ARG CA C 32 54.210 54.207 0.003 1
1 333 . 11 1 1 A 32 32 ARG CB C 32 35.087 33.211 1.876 1
1 336 . 11 1 1 A 32 32 ARG N N 32 123.160 124.159 -0.999 1
1 337 . 11 1 1 A 33 33 ILE H H 33 7.891 8.604 -0.713 1
1 338 . 11 1 1 A 33 33 ILE HA H 33 4.495 4.966 -0.471 1
1 348 . 11 1 1 A 33 33 ILE C C 33 175.850 174.272 1.578 1
1 349 . 11 1 1 A 33 33 ILE CA C 33 59.641 58.668 0.973 1
1 350 . 11 1 1 A 33 33 ILE CB C 33 39.538 42.382 -2.844 1
1 354 . 11 1 1 A 33 33 ILE N N 33 118.924 117.541 1.383 1
1 355 . 11 1 1 A 34 34 GLU H H 34 8.971 8.823 0.148 1
1 356 . 11 1 1 A 34 34 GLU HA H 34 4.578 4.880 -0.302 1
1 361 . 11 1 1 A 34 34 GLU C C 34 175.766 174.886 0.880 1
1 362 . 11 1 1 A 34 34 GLU CA C 34 54.263 54.172 0.091 1
1 363 . 11 1 1 A 34 34 GLU CB C 34 32.128 33.275 -1.147 1
1 365 . 11 1 1 A 34 34 GLU N N 34 125.447 121.421 4.026 1
1 366 . 11 1 1 A 35 35 LYS H H 35 8.504 8.524 -0.020 1
1 367 . 11 1 1 A 35 35 LYS HA H 35 4.026 4.110 -0.084 1
1 376 . 11 1 1 A 35 35 LYS C C 35 177.701 176.780 0.921 1
1 377 . 11 1 1 A 35 35 LYS CA C 35 57.591 56.688 0.903 1
1 378 . 11 1 1 A 35 35 LYS CB C 35 32.491 32.776 -0.285 1
1 382 . 11 1 1 A 35 35 LYS N N 35 122.893 123.261 -0.368 1
1 383 . 11 1 1 A 36 36 ASP H H 36 9.020 8.863 0.157 1
1 384 . 11 1 1 A 36 36 ASP HA H 36 4.385 4.157 0.228 1
1 387 . 11 1 1 A 36 36 ASP C C 36 174.554 174.778 -0.224 1
1 388 . 11 1 1 A 36 36 ASP CA C 36 55.868 55.249 0.619 1
1 389 . 11 1 1 A 36 36 ASP CB C 36 39.826 39.759 0.067 1
1 390 . 11 1 1 A 36 36 ASP N N 36 121.412 120.806 0.606 1
1 391 . 11 1 1 A 37 37 THR H H 37 7.464 7.527 -0.063 1
1 392 . 11 1 1 A 37 37 THR HA H 37 4.454 4.764 -0.310 1
1 397 . 11 1 1 A 37 37 THR C C 37 172.012 172.865 -0.853 1
1 398 . 11 1 1 A 37 37 THR CA C 37 61.686 60.958 0.728 1
1 399 . 11 1 1 A 37 37 THR CB C 37 70.927 71.857 -0.930 1
1 401 . 11 1 1 A 37 37 THR N N 37 113.147 113.046 0.101 1
1 402 . 11 1 1 A 38 38 ASP H H 38 8.931 8.839 0.092 1
1 403 . 11 1 1 A 38 38 ASP HA H 38 4.852 4.948 -0.096 1
1 406 . 11 1 1 A 38 38 ASP CA C 38 54.826 53.380 1.446 1
1 407 . 11 1 1 A 38 38 ASP CB C 38 43.332 42.507 0.825 1
1 408 . 11 1 1 A 38 38 ASP N N 38 120.401 122.278 -1.877 1
1 409 . 11 1 1 A 39 39 GLY H H 39 8.068 8.354 -0.286 1
1 410 . 11 1 1 A 39 39 GLY HA2 H 39 3.774 4.020 -0.246 1
1 411 . 11 1 1 A 39 39 GLY HA3 H 39 3.555 4.047 -0.492 1
1 412 . 11 1 1 A 39 39 GLY C C 39 172.578 172.596 -0.018 1
1 413 . 11 1 1 A 39 39 GLY CA C 39 43.967 44.431 -0.464 1
1 414 . 11 1 1 A 39 39 GLY N N 39 107.925 109.390 -1.465 1
1 415 . 11 1 1 A 40 40 HIS H H 40 9.111 8.340 0.771 1
1 416 . 11 1 1 A 40 40 HIS HA H 40 4.650 5.186 -0.536 1
1 421 . 11 1 1 A 40 40 HIS C C 40 174.330 174.615 -0.285 1
1 422 . 11 1 1 A 40 40 HIS CA C 40 55.886 54.604 1.282 1
1 423 . 11 1 1 A 40 40 HIS CB C 40 30.507 32.072 -1.565 1
1 426 . 11 1 1 A 40 40 HIS N N 40 119.179 118.372 0.807 1
1 427 . 11 1 1 A 41 41 LEU H H 41 8.254 8.915 -0.661 1
1 428 . 11 1 1 A 41 41 LEU HA H 41 4.626 4.873 -0.247 1
1 438 . 11 1 1 A 41 41 LEU C C 41 176.035 176.243 -0.208 1
1 439 . 11 1 1 A 41 41 LEU CA C 41 55.621 54.213 1.408 1
1 440 . 11 1 1 A 41 41 LEU CB C 41 45.091 42.450 2.641 1
1 444 . 11 1 1 A 41 41 LEU N N 41 124.808 124.256 0.552 1
1 445 . 11 1 1 A 42 42 ILE H H 42 8.685 8.531 0.154 1
1 446 . 11 1 1 A 42 42 ILE HA H 42 4.578 5.285 -0.707 1
1 456 . 11 1 1 A 42 42 ILE C C 42 175.369 174.508 0.861 1
1 457 . 11 1 1 A 42 42 ILE CA C 42 59.852 59.426 0.426 1
1 458 . 11 1 1 A 42 42 ILE CB C 42 36.778 40.756 -3.978 1
1 462 . 11 1 1 A 42 42 ILE N N 42 121.814 122.197 -0.383 1
1 463 . 11 1 1 A 43 43 ARG H H 43 8.787 8.350 0.437 1
1 464 . 11 1 1 A 43 43 ARG HA H 43 4.852 4.948 -0.096 1
1 472 . 11 1 1 A 43 43 ARG C C 43 174.029 174.981 -0.952 1
1 473 . 11 1 1 A 43 43 ARG CA C 43 52.730 54.160 -1.430 1
1 474 . 11 1 1 A 43 43 ARG CB C 43 36.983 33.644 3.339 1
1 477 . 11 1 1 A 43 43 ARG N N 43 125.771 124.171 1.600 1
1 479 . 11 1 1 A 44 44 VAL H H 44 8.661 8.593 0.068 1
1 480 . 11 1 1 A 44 44 VAL HA H 44 3.276 3.721 -0.445 1
1 488 . 11 1 1 A 44 44 VAL C C 44 173.227 175.036 -1.809 1
1 489 . 11 1 1 A 44 44 VAL CA C 44 63.161 63.432 -0.271 1
1 490 . 11 1 1 A 44 44 VAL CB C 44 29.054 30.079 -1.025 1
1 493 . 11 1 1 A 44 44 VAL N N 44 117.026 116.256 0.770 1
1 494 . 11 1 1 A 45 45 ILE H H 45 8.464 8.082 0.382 1
1 495 . 11 1 1 A 45 45 ILE HA H 45 4.579 4.188 0.391 1
1 505 . 11 1 1 A 45 45 ILE C C 45 178.108 175.176 2.932 1
1 506 . 11 1 1 A 45 45 ILE CA C 45 59.888 61.365 -1.477 1
1 507 . 11 1 1 A 45 45 ILE CB C 45 36.998 36.483 0.515 1
1 511 . 11 1 1 A 45 45 ILE N N 45 122.767 123.012 -0.245 1
1 512 . 11 1 1 A 46 46 GLU H H 46 9.015 8.330 0.685 1
1 513 . 11 1 1 A 46 46 GLU HA H 46 4.206 4.317 -0.111 1
1 518 . 11 1 1 A 46 46 GLU C C 46 177.746 176.667 1.079 1
1 519 . 11 1 1 A 46 46 GLU CA C 46 56.130 56.971 -0.841 1
1 520 . 11 1 1 A 46 46 GLU CB C 46 30.581 30.266 0.315 1
1 522 . 11 1 1 A 46 46 GLU N N 46 131.076 128.786 2.290 1
1 523 . 11 1 1 A 47 47 GLU H H 47 9.213 8.864 0.349 1
1 524 . 11 1 1 A 47 47 GLU HA H 47 4.194 4.549 -0.355 1
1 529 . 11 1 1 A 47 47 GLU C C 47 178.088 177.504 0.584 1
1 530 . 11 1 1 A 47 47 GLU CA C 47 58.212 56.769 1.443 1
1 531 . 11 1 1 A 47 47 GLU CB C 47 29.390 30.624 -1.234 1
1 533 . 11 1 1 A 47 47 GLU N N 47 129.592 124.511 5.081 1
1 534 . 11 1 1 A 48 48 GLY H H 48 9.586 8.959 0.627 1
1 535 . 11 1 1 A 48 48 GLY HA2 H 48 4.141 3.841 0.300 1
1 536 . 11 1 1 A 48 48 GLY HA3 H 48 3.757 3.842 -0.085 1
1 537 . 11 1 1 A 48 48 GLY C C 48 173.790 173.940 -0.150 1
1 538 . 11 1 1 A 48 48 GLY CA C 48 45.764 46.681 -0.917 1
1 539 . 11 1 1 A 48 48 GLY N N 48 114.819 111.909 2.910 1
1 540 . 11 1 1 A 49 49 SER H H 49 7.580 7.890 -0.310 1
1 541 . 11 1 1 A 49 49 SER HA H 49 4.728 4.719 0.009 1
1 544 . 11 1 1 A 49 49 SER C C 49 173.542 174.486 -0.944 1
1 545 . 11 1 1 A 49 49 SER CA C 49 57.560 56.263 1.297 1
1 546 . 11 1 1 A 49 49 SER CB C 49 64.529 63.780 0.749 1
1 547 . 11 1 1 A 49 49 SER N N 49 114.688 115.208 -0.520 1
1 548 . 11 1 1 A 50 50 PRO HA H 50 4.431 4.497 -0.066 1
1 555 . 11 1 1 A 50 50 PRO C C 50 179.377 177.922 1.455 1
1 556 . 11 1 1 A 50 50 PRO CA C 50 66.059 64.523 1.536 1
1 557 . 11 1 1 A 50 50 PRO CB C 50 32.598 31.976 0.622 1
1 560 . 11 1 1 A 51 51 ALA H H 51 8.264 7.752 0.512 1
1 561 . 11 1 1 A 51 51 ALA HA H 51 3.817 3.938 -0.121 1
1 565 . 11 1 1 A 51 51 ALA C C 51 177.508 180.068 -2.560 1
1 566 . 11 1 1 A 51 51 ALA CA C 51 55.392 54.903 0.489 1
1 567 . 11 1 1 A 51 51 ALA CB C 51 20.474 18.311 2.163 1
1 568 . 11 1 1 A 51 51 ALA N N 51 117.604 119.358 -1.754 1
1 569 . 11 1 1 A 52 52 GLU H H 52 7.794 7.476 0.318 1
1 570 . 11 1 1 A 52 52 GLU HA H 52 3.881 4.062 -0.181 1
1 575 . 11 1 1 A 52 52 GLU C C 52 181.401 178.532 2.869 1
1 576 . 11 1 1 A 52 52 GLU CA C 52 59.454 58.574 0.880 1
1 577 . 11 1 1 A 52 52 GLU CB C 52 30.247 29.298 0.949 1
1 579 . 11 1 1 A 52 52 GLU N N 52 119.474 118.206 1.268 1
1 580 . 11 1 1 A 53 53 LYS H H 53 8.557 7.853 0.704 1
1 581 . 11 1 1 A 53 53 LYS HA H 53 4.020 4.008 0.012 1
1 588 . 11 1 1 A 53 53 LYS C C 53 177.939 177.996 -0.057 1
1 589 . 11 1 1 A 53 53 LYS CA C 53 59.012 58.737 0.275 1
1 590 . 11 1 1 A 53 53 LYS CB C 53 32.438 32.196 0.242 1
1 594 . 11 1 1 A 53 53 LYS N N 53 120.057 119.676 0.381 1
1 595 . 11 1 1 A 54 54 ALA H H 54 7.764 7.505 0.259 1
1 596 . 11 1 1 A 54 54 ALA HA H 54 4.400 4.302 0.098 1
1 600 . 11 1 1 A 54 54 ALA C C 54 177.658 177.842 -0.184 1
1 601 . 11 1 1 A 54 54 ALA CA C 54 52.412 51.677 0.735 1
1 602 . 11 1 1 A 54 54 ALA CB C 54 20.739 18.204 2.535 1
1 603 . 11 1 1 A 54 54 ALA N N 54 117.678 118.734 -1.056 1
1 604 . 11 1 1 A 55 55 GLY H H 55 7.583 7.980 -0.397 1
1 605 . 11 1 1 A 55 55 GLY HA2 H 55 4.266 3.924 0.342 1
1 606 . 11 1 1 A 55 55 GLY HA3 H 55 3.775 3.928 -0.153 1
1 607 . 11 1 1 A 55 55 GLY C C 55 175.232 174.544 0.688 1
1 608 . 11 1 1 A 55 55 GLY CA C 55 45.368 46.516 -1.148 1
1 609 . 11 1 1 A 55 55 GLY N N 55 103.265 107.662 -4.397 1
1 610 . 11 1 1 A 56 56 LEU H H 56 7.280 7.542 -0.262 1
1 611 . 11 1 1 A 56 56 LEU HA H 56 3.984 4.479 -0.495 1
1 621 . 11 1 1 A 56 56 LEU C C 56 174.708 175.226 -0.518 1
1 622 . 11 1 1 A 56 56 LEU CA C 56 55.603 54.646 0.957 1
1 623 . 11 1 1 A 56 56 LEU CB C 56 42.752 42.401 0.351 1
1 627 . 11 1 1 A 56 56 LEU N N 56 119.211 123.082 -3.871 1
1 628 . 11 1 1 A 57 57 LEU H H 57 8.693 8.253 0.440 1
1 629 . 11 1 1 A 57 57 LEU HA H 57 4.499 5.015 -0.516 1
1 639 . 11 1 1 A 57 57 LEU C C 57 176.124 175.393 0.731 1
1 640 . 11 1 1 A 57 57 LEU CA C 57 52.959 53.502 -0.543 1
1 641 . 11 1 1 A 57 57 LEU CB C 57 45.122 45.276 -0.154 1
1 645 . 11 1 1 A 57 57 LEU N N 57 121.969 129.503 -7.534 1
1 646 . 11 1 1 A 58 58 ASP H H 58 8.334 8.656 -0.322 1
1 647 . 11 1 1 A 58 58 ASP HA H 58 4.139 4.449 -0.310 1
1 650 . 11 1 1 A 58 58 ASP C C 58 178.636 176.985 1.651 1
1 651 . 11 1 1 A 58 58 ASP CA C 58 56.079 55.922 0.157 1
1 652 . 11 1 1 A 58 58 ASP CB C 58 42.135 40.422 1.713 1
1 653 . 11 1 1 A 58 58 ASP N N 58 120.401 122.604 -2.203 1
1 654 . 11 1 1 A 59 59 GLY H H 59 9.378 8.678 0.700 1
1 655 . 11 1 1 A 59 59 GLY HA2 H 59 4.317 3.942 0.375 1
1 656 . 11 1 1 A 59 59 GLY HA3 H 59 3.260 3.947 -0.687 1
1 657 . 11 1 1 A 59 59 GLY C C 59 173.359 174.008 -0.649 1
1 658 . 11 1 1 A 59 59 GLY CA C 59 45.517 45.078 0.439 1
1 659 . 11 1 1 A 59 59 GLY N N 59 116.622 113.911 2.711 1
1 660 . 11 1 1 A 60 60 ASP H H 60 8.009 7.992 0.017 1
1 661 . 11 1 1 A 60 60 ASP HA H 60 4.638 4.804 -0.166 1
1 664 . 11 1 1 A 60 60 ASP C C 60 175.555 175.437 0.118 1
1 665 . 11 1 1 A 60 60 ASP CA C 60 55.286 53.645 1.641 1
1 666 . 11 1 1 A 60 60 ASP CB C 60 42.381 41.897 0.484 1
1 667 . 11 1 1 A 60 60 ASP N N 60 121.370 120.601 0.769 1
1 668 . 11 1 1 A 61 61 ARG H H 61 8.648 8.822 -0.174 1
1 669 . 11 1 1 A 61 61 ARG HA H 61 5.179 5.144 0.035 1
1 677 . 11 1 1 A 61 61 ARG C C 61 177.381 174.927 2.454 1
1 678 . 11 1 1 A 61 61 ARG CA C 61 53.704 54.751 -1.047 1
1 679 . 11 1 1 A 61 61 ARG CB C 61 34.017 31.777 2.240 1
1 682 . 11 1 1 A 61 61 ARG N N 61 116.958 123.416 -6.458 1
1 684 . 11 1 1 A 62 62 VAL H H 62 8.247 8.469 -0.222 1
1 685 . 11 1 1 A 62 62 VAL HA H 62 3.806 4.383 -0.577 1
1 693 . 11 1 1 A 62 62 VAL C C 62 174.748 175.223 -0.475 1
1 694 . 11 1 1 A 62 62 VAL CA C 62 63.149 62.839 0.310 1
1 695 . 11 1 1 A 62 62 VAL CB C 62 32.574 32.296 0.278 1
1 698 . 11 1 1 A 62 62 VAL N N 62 118.546 126.375 -7.829 1
1 699 . 11 1 1 A 63 63 LEU H H 63 9.262 9.441 -0.179 1
1 700 . 11 1 1 A 63 63 LEU HA H 63 4.412 4.283 0.129 1
1 710 . 11 1 1 A 63 63 LEU C C 63 177.649 177.093 0.556 1
1 711 . 11 1 1 A 63 63 LEU CA C 63 56.044 56.492 -0.448 1
1 712 . 11 1 1 A 63 63 LEU CB C 63 43.339 42.749 0.590 1
1 716 . 11 1 1 A 63 63 LEU N N 63 125.413 130.881 -5.468 1
1 717 . 11 1 1 A 64 64 ARG H H 64 7.806 7.687 0.119 1
1 718 . 11 1 1 A 64 64 ARG HA H 64 5.704 4.908 0.796 1
1 726 . 11 1 1 A 64 64 ARG C C 64 175.091 174.098 0.993 1
1 727 . 11 1 1 A 64 64 ARG CA C 64 54.148 54.745 -0.597 1
1 728 . 11 1 1 A 64 64 ARG CB C 64 35.742 33.891 1.851 1
1 731 . 11 1 1 A 64 64 ARG N N 64 112.961 117.006 -4.045 1
1 733 . 11 1 1 A 65 65 ILE H H 65 8.327 9.137 -0.810 1
1 734 . 11 1 1 A 65 65 ILE HA H 65 4.384 4.631 -0.247 1
1 744 . 11 1 1 A 65 65 ILE C C 65 175.722 175.629 0.093 1
1 745 . 11 1 1 A 65 65 ILE CA C 65 60.501 59.503 0.998 1
1 746 . 11 1 1 A 65 65 ILE CB C 65 39.547 40.249 -0.702 1
1 750 . 11 1 1 A 65 65 ILE N N 65 119.175 124.183 -5.008 1
1 751 . 11 1 1 A 66 66 ASN H H 66 9.911 9.521 0.390 1
1 752 . 11 1 1 A 66 66 ASN HA H 66 4.428 4.380 0.048 1
1 757 . 11 1 1 A 66 66 ASN C C 66 175.349 174.634 0.715 1
1 758 . 11 1 1 A 66 66 ASN CA C 66 54.157 54.159 -0.002 1
1 759 . 11 1 1 A 66 66 ASN CB C 66 37.024 37.446 -0.422 1
1 760 . 11 1 1 A 66 66 ASN N N 66 128.952 128.010 0.942 1
1 762 . 11 1 1 A 67 67 GLY H H 67 9.230 8.620 0.610 1
1 763 . 11 1 1 A 67 67 GLY HA2 H 67 4.322 3.950 0.372 1
1 764 . 11 1 1 A 67 67 GLY HA3 H 67 3.508 3.960 -0.452 1
1 765 . 11 1 1 A 67 67 GLY C C 67 174.393 173.966 0.427 1
1 766 . 11 1 1 A 67 67 GLY CA C 67 45.341 46.457 -1.116 1
1 767 . 11 1 1 A 67 67 GLY N N 67 103.238 104.730 -1.492 1
1 768 . 11 1 1 A 68 68 VAL H H 68 8.063 7.679 0.384 1
1 769 . 11 1 1 A 68 68 VAL HA H 68 4.015 4.603 -0.588 1
1 777 . 11 1 1 A 68 68 VAL C C 68 175.833 174.778 1.055 1
1 778 . 11 1 1 A 68 68 VAL CA C 68 62.603 61.203 1.400 1
1 779 . 11 1 1 A 68 68 VAL CB C 68 32.574 34.896 -2.322 1
1 782 . 11 1 1 A 68 68 VAL N N 68 125.696 119.679 6.017 1
1 783 . 11 1 1 A 69 69 PHE H H 69 9.301 9.147 0.154 1
1 784 . 11 1 1 A 69 69 PHE HA H 69 4.947 4.550 0.397 1
1 792 . 11 1 1 A 69 69 PHE C C 69 177.120 175.690 1.430 1
1 793 . 11 1 1 A 69 69 PHE CA C 69 59.200 59.502 -0.302 1
1 794 . 11 1 1 A 69 69 PHE CB C 69 39.320 39.589 -0.269 1
1 800 . 11 1 1 A 69 69 PHE N N 69 128.641 128.969 -0.328 1
1 801 . 11 1 1 A 70 70 VAL H H 70 8.312 7.926 0.386 1
1 802 . 11 1 1 A 70 70 VAL HA H 70 4.517 4.482 0.035 1
1 810 . 11 1 1 A 70 70 VAL CA C 70 60.734 60.553 0.181 1
1 811 . 11 1 1 A 70 70 VAL CB C 70 32.976 31.374 1.602 1
1 814 . 11 1 1 A 70 70 VAL N N 70 118.381 120.583 -2.202 1
1 815 . 11 1 1 A 71 71 ASP H H 71 5.373 7.196 -1.823 1
1 816 . 11 1 1 A 71 71 ASP HA H 71 4.413 4.222 0.191 1
1 819 . 11 1 1 A 71 71 ASP C C 71 174.896 177.966 -3.070 1
1 820 . 11 1 1 A 71 71 ASP CA C 71 58.334 57.028 1.306 1
1 821 . 11 1 1 A 71 71 ASP CB C 71 46.097 40.734 5.363 1
1 822 . 11 1 1 A 71 71 ASP N N 71 119.008 122.003 -2.995 1
1 823 . 11 1 1 A 72 72 LYS H H 72 7.874 7.851 0.023 1
1 824 . 11 1 1 A 72 72 LYS HA H 72 4.522 4.364 0.158 1
1 833 . 11 1 1 A 72 72 LYS C C 72 177.209 177.042 0.167 1
1 834 . 11 1 1 A 72 72 LYS CA C 72 54.122 57.977 -3.855 1
1 835 . 11 1 1 A 72 72 LYS CB C 72 31.640 33.538 -1.898 1
1 839 . 11 1 1 A 72 72 LYS N N 72 110.259 118.188 -7.929 1
1 840 . 11 1 1 A 73 73 GLU H H 73 7.421 7.798 -0.377 1
1 841 . 11 1 1 A 73 73 GLU HA H 73 4.401 4.412 -0.011 1
1 846 . 11 1 1 A 73 73 GLU C C 73 176.728 176.350 0.378 1
1 847 . 11 1 1 A 73 73 GLU CA C 73 54.950 56.986 -2.036 1
1 848 . 11 1 1 A 73 73 GLU CB C 73 30.390 30.496 -0.106 1
1 850 . 11 1 1 A 73 73 GLU N N 73 120.043 119.174 0.869 1
1 851 . 11 1 1 A 74 74 GLU H H 74 9.360 8.465 0.895 1
1 852 . 11 1 1 A 74 74 GLU HA H 74 4.403 4.599 -0.196 1
1 857 . 11 1 1 A 74 74 GLU C C 74 178.234 177.578 0.656 1
1 858 . 11 1 1 A 74 74 GLU CA C 74 56.516 55.971 0.545 1
1 859 . 11 1 1 A 74 74 GLU CB C 74 30.390 31.488 -1.098 1
1 861 . 11 1 1 A 74 74 GLU N N 74 122.193 121.548 0.645 1
1 862 . 11 1 1 A 75 75 HIS H H 75 9.553 9.246 0.307 1
1 863 . 11 1 1 A 75 75 HIS HA H 75 4.080 4.113 -0.033 1
1 868 . 11 1 1 A 75 75 HIS C C 75 175.985 176.862 -0.877 1
1 869 . 11 1 1 A 75 75 HIS CA C 75 61.016 60.111 0.905 1
1 870 . 11 1 1 A 75 75 HIS CB C 75 29.468 30.264 -0.796 1
1 873 . 11 1 1 A 75 75 HIS N N 75 123.587 126.934 -3.347 1
1 874 . 11 1 1 A 76 76 ALA H H 76 9.129 8.234 0.895 1
1 875 . 11 1 1 A 76 76 ALA HA H 76 3.826 3.919 -0.093 1
1 879 . 11 1 1 A 76 76 ALA C C 76 180.475 178.744 1.731 1
1 880 . 11 1 1 A 76 76 ALA CA C 76 55.392 54.660 0.732 1
1 881 . 11 1 1 A 76 76 ALA CB C 76 18.182 18.212 -0.030 1
1 882 . 11 1 1 A 76 76 ALA N N 76 117.795 120.994 -3.199 1
1 883 . 11 1 1 A 77 77 GLN H H 77 7.099 7.357 -0.258 1
1 884 . 11 1 1 A 77 77 GLN HA H 77 4.198 4.200 -0.002 1
1 891 . 11 1 1 A 77 77 GLN C C 77 177.860 178.473 -0.613 1
1 892 . 11 1 1 A 77 77 GLN CA C 77 57.790 58.204 -0.414 1
1 893 . 11 1 1 A 77 77 GLN CB C 77 28.536 28.505 0.031 1
1 895 . 11 1 1 A 77 77 GLN N N 77 115.764 116.941 -1.177 1
1 897 . 11 1 1 A 78 78 VAL H H 78 7.430 7.528 -0.098 1
1 898 . 11 1 1 A 78 78 VAL HA H 78 3.241 3.637 -0.396 1
1 906 . 11 1 1 A 78 78 VAL C C 78 177.042 177.858 -0.816 1
1 907 . 11 1 1 A 78 78 VAL CA C 78 67.299 65.631 1.668 1
1 908 . 11 1 1 A 78 78 VAL CB C 78 30.819 31.170 -0.351 1
1 911 . 11 1 1 A 78 78 VAL N N 78 121.143 120.926 0.217 1
1 912 . 11 1 1 A 79 79 VAL H H 79 7.773 7.713 0.060 1
1 913 . 11 1 1 A 79 79 VAL HA H 79 3.315 3.675 -0.360 1
1 921 . 11 1 1 A 79 79 VAL C C 79 179.179 177.622 1.557 1
1 922 . 11 1 1 A 79 79 VAL CA C 79 66.694 65.795 0.899 1
1 923 . 11 1 1 A 79 79 VAL CB C 79 31.841 31.341 0.500 1
1 926 . 11 1 1 A 79 79 VAL N N 79 117.473 120.222 -2.749 1
1 927 . 11 1 1 A 80 80 GLU H H 80 7.410 7.987 -0.577 1
1 928 . 11 1 1 A 80 80 GLU HA H 80 4.258 4.038 0.220 1
1 933 . 11 1 1 A 80 80 GLU C C 80 178.018 179.350 -1.332 1
1 934 . 11 1 1 A 80 80 GLU CA C 80 58.566 59.110 -0.544 1
1 935 . 11 1 1 A 80 80 GLU CB C 80 29.072 29.415 -0.343 1
1 937 . 11 1 1 A 80 80 GLU N N 80 120.451 119.663 0.788 1
1 938 . 11 1 1 A 81 81 LEU H H 81 8.070 7.677 0.393 1
1 939 . 11 1 1 A 81 81 LEU HA H 81 3.976 4.085 -0.109 1
1 949 . 11 1 1 A 81 81 LEU C C 81 180.658 179.118 1.540 1
1 950 . 11 1 1 A 81 81 LEU CA C 81 58.061 58.112 -0.051 1
1 951 . 11 1 1 A 81 81 LEU CB C 81 42.115 41.939 0.176 1
1 955 . 11 1 1 A 81 81 LEU N N 81 119.943 121.450 -1.507 1
1 956 . 11 1 1 A 82 82 VAL H H 82 7.609 7.904 -0.295 1
1 957 . 11 1 1 A 82 82 VAL HA H 82 3.474 3.592 -0.118 1
1 965 . 11 1 1 A 82 82 VAL C C 82 178.927 178.565 0.362 1
1 966 . 11 1 1 A 82 82 VAL CA C 82 67.398 67.146 0.252 1
1 967 . 11 1 1 A 82 82 VAL CB C 82 31.306 31.315 -0.009 1
1 970 . 11 1 1 A 82 82 VAL N N 82 118.150 118.421 -0.271 1
1 971 . 11 1 1 A 83 83 ARG H H 83 8.186 7.898 0.288 1
1 972 . 11 1 1 A 83 83 ARG HA H 83 3.994 3.950 0.044 1
1 979 . 11 1 1 A 83 83 ARG C C 83 179.999 178.885 1.114 1
1 980 . 11 1 1 A 83 83 ARG CA C 83 60.205 59.807 0.398 1
1 981 . 11 1 1 A 83 83 ARG CB C 83 30.103 29.831 0.272 1
1 984 . 11 1 1 A 83 83 ARG N N 83 122.902 120.104 2.798 1
1 985 . 11 1 1 A 84 84 LYS H H 84 8.772 8.301 0.471 1
1 986 . 11 1 1 A 84 84 LYS HA H 84 4.047 4.092 -0.045 1
1 995 . 11 1 1 A 84 84 LYS C C 84 176.934 178.945 -2.011 1
1 996 . 11 1 1 A 84 84 LYS CA C 84 58.142 59.119 -0.977 1
1 997 . 11 1 1 A 84 84 LYS CB C 84 32.492 31.810 0.682 1
1 1001 . 11 1 1 A 84 84 LYS N N 84 117.548 118.784 -1.236 1
1 1002 . 11 1 1 A 85 85 SER H H 85 7.333 8.264 -0.931 1
1 1003 . 11 1 1 A 85 85 SER HA H 85 4.235 4.207 0.028 1
1 1006 . 11 1 1 A 85 85 SER C C 85 175.588 175.130 0.458 1
1 1007 . 11 1 1 A 85 85 SER CA C 85 59.535 61.182 -1.647 1
1 1008 . 11 1 1 A 85 85 SER CB C 85 63.571 63.633 -0.062 1
1 1009 . 11 1 1 A 85 85 SER N N 85 113.544 115.581 -2.037 1
1 1010 . 11 1 1 A 86 86 GLY H H 86 7.459 7.781 -0.322 1
1 1011 . 11 1 1 A 86 86 GLY HA2 H 86 4.176 4.080 0.096 1
1 1012 . 11 1 1 A 86 86 GLY HA3 H 86 3.762 4.086 -0.324 1
1 1013 . 11 1 1 A 86 86 GLY C C 86 176.407 175.374 1.033 1
1 1014 . 11 1 1 A 86 86 GLY CA C 86 46.109 44.364 1.745 1
1 1015 . 11 1 1 A 86 86 GLY N N 86 104.331 107.282 -2.951 1
1 1016 . 11 1 1 A 87 87 ASN HA H 87 4.650 4.722 -0.072 1
1 1021 . 11 1 1 A 87 87 ASN C C 87 173.653 175.783 -2.130 1
1 1022 . 11 1 1 A 87 87 ASN CA C 87 54.492 55.588 -1.096 1
1 1023 . 11 1 1 A 87 87 ASN CB C 87 38.425 39.625 -1.200 1
1 1024 . 11 1 1 A 87 87 ASN N N 87 118.401 124.560 -6.159 1
1 1026 . 11 1 1 A 88 88 SER H H 88 7.435 8.008 -0.573 1
1 1027 . 11 1 1 A 88 88 SER HA H 88 5.438 5.162 0.276 1
1 1030 . 11 1 1 A 88 88 SER C C 88 172.867 173.483 -0.616 1
1 1031 . 11 1 1 A 88 88 SER CA C 88 58.160 56.679 1.481 1
1 1032 . 11 1 1 A 88 88 SER CB C 88 65.861 64.757 1.104 1
1 1033 . 11 1 1 A 88 88 SER N N 88 113.765 112.599 1.166 1
1 1034 . 11 1 1 A 89 89 VAL H H 89 8.452 8.922 -0.470 1
1 1035 . 11 1 1 A 89 89 VAL HA H 89 4.519 4.705 -0.186 1
1 1043 . 11 1 1 A 89 89 VAL C C 89 171.391 174.607 -3.216 1
1 1044 . 11 1 1 A 89 89 VAL CA C 89 61.333 60.978 0.355 1
1 1045 . 11 1 1 A 89 89 VAL CB C 89 33.897 35.268 -1.371 1
1 1048 . 11 1 1 A 89 89 VAL N N 89 120.001 124.312 -4.311 1
1 1049 . 11 1 1 A 90 90 THR H H 90 8.348 8.937 -0.589 1
1 1050 . 11 1 1 A 90 90 THR HA H 90 5.042 5.100 -0.058 1
1 1055 . 11 1 1 A 90 90 THR C C 90 173.926 173.792 0.134 1
1 1056 . 11 1 1 A 90 90 THR CA C 90 61.403 61.999 -0.596 1
1 1057 . 11 1 1 A 90 90 THR CB C 90 69.553 69.751 -0.198 1
1 1059 . 11 1 1 A 90 90 THR N N 90 123.477 124.261 -0.784 1
1 1060 . 11 1 1 A 91 91 LEU H H 91 9.195 9.146 0.049 1
1 1061 . 11 1 1 A 91 91 LEU HA H 91 5.161 5.115 0.046 1
1 1071 . 11 1 1 A 91 91 LEU C C 91 174.564 176.097 -1.533 1
1 1072 . 11 1 1 A 91 91 LEU CA C 91 52.590 53.810 -1.220 1
1 1073 . 11 1 1 A 91 91 LEU CB C 91 44.998 45.008 -0.010 1
1 1077 . 11 1 1 A 91 91 LEU N N 91 128.419 127.139 1.280 1
1 1078 . 11 1 1 A 92 92 LEU H H 92 8.644 8.477 0.167 1
1 1079 . 11 1 1 A 92 92 LEU HA H 92 5.335 4.999 0.336 1
1 1089 . 11 1 1 A 92 92 LEU C C 92 176.451 175.532 0.919 1
1 1090 . 11 1 1 A 92 92 LEU CA C 92 54.220 53.802 0.418 1
1 1091 . 11 1 1 A 92 92 LEU CB C 92 44.323 43.332 0.991 1
1 1095 . 11 1 1 A 92 92 LEU N N 92 125.894 122.662 3.232 1
1 1096 . 11 1 1 A 93 93 VAL H H 93 9.249 9.047 0.202 1
1 1097 . 11 1 1 A 93 93 VAL HA H 93 5.573 5.120 0.453 1
1 1105 . 11 1 1 A 93 93 VAL C C 93 173.550 174.059 -0.509 1
1 1106 . 11 1 1 A 93 93 VAL CA C 93 58.340 59.532 -1.192 1
1 1107 . 11 1 1 A 93 93 VAL CB C 93 36.159 34.270 1.889 1
1 1110 . 11 1 1 A 93 93 VAL N N 93 120.660 119.915 0.745 1
1 1111 . 11 1 1 A 94 94 LEU H H 94 8.634 8.438 0.196 1
1 1112 . 11 1 1 A 94 94 LEU HA H 94 4.911 5.199 -0.288 1
1 1122 . 11 1 1 A 94 94 LEU C C 94 174.172 174.678 -0.506 1
1 1123 . 11 1 1 A 94 94 LEU CA C 94 52.659 53.309 -0.650 1
1 1124 . 11 1 1 A 94 94 LEU CB C 94 47.910 46.099 1.811 1
1 1128 . 11 1 1 A 94 94 LEU N N 94 120.304 126.527 -6.223 1
1 1129 . 11 1 1 A 95 95 ASP H H 95 8.210 8.689 -0.479 1
1 1130 . 11 1 1 A 95 95 ASP HA H 95 5.190 4.702 0.488 1
1 1133 . 11 1 1 A 95 95 ASP C C 95 175.887 177.950 -2.063 1
1 1134 . 11 1 1 A 95 95 ASP CA C 95 53.899 54.989 -1.090 1
1 1135 . 11 1 1 A 95 95 ASP CB C 95 41.188 42.652 -1.464 1
1 1136 . 11 1 1 A 95 95 ASP N N 95 122.184 123.420 -1.236 1
1 1137 . 11 1 1 A 96 96 GLY H H 96 8.478 8.815 -0.337 1
1 1138 . 11 1 1 A 96 96 GLY HA2 H 96 4.002 3.800 0.202 1
1 1139 . 11 1 1 A 96 96 GLY HA3 H 96 3.757 3.805 -0.048 1
1 1140 . 11 1 1 A 96 96 GLY C C 96 175.497 175.504 -0.007 1
1 1141 . 11 1 1 A 96 96 GLY CA C 96 49.944 47.885 2.059 1
1 1142 . 11 1 1 A 96 96 GLY N N 96 108.610 111.017 -2.407 1
1 1143 . 11 1 1 A 97 97 ASP H H 97 8.401 7.938 0.463 1
1 1144 . 11 1 1 A 97 97 ASP HA H 97 4.454 4.450 0.004 1
1 1147 . 11 1 1 A 97 97 ASP C C 97 179.612 178.738 0.874 1
1 1148 . 11 1 1 A 97 97 ASP CA C 97 57.913 57.080 0.833 1
1 1149 . 11 1 1 A 97 97 ASP CB C 97 41.145 40.858 0.287 1
1 1150 . 11 1 1 A 97 97 ASP N N 97 120.034 122.321 -2.287 1
1 1151 . 11 1 1 A 98 98 SER H H 98 8.152 8.596 -0.444 1
1 1152 . 11 1 1 A 98 98 SER HA H 98 4.218 4.422 -0.204 1
1 1155 . 11 1 1 A 98 98 SER C C 98 175.061 176.534 -1.473 1
1 1156 . 11 1 1 A 98 98 SER CA C 98 62.180 61.748 0.432 1
1 1157 . 11 1 1 A 98 98 SER CB C 98 62.179 62.756 -0.577 1
1 1158 . 11 1 1 A 98 98 SER N N 98 117.174 114.950 2.224 1
1 1159 . 11 1 1 A 99 99 TYR H H 99 9.051 8.043 1.008 1
1 1160 . 11 1 1 A 99 99 TYR HA H 99 3.692 3.904 -0.212 1
1 1167 . 11 1 1 A 99 99 TYR C C 99 176.460 177.051 -0.591 1
1 1168 . 11 1 1 A 99 99 TYR CA C 99 62.814 61.890 0.924 1
1 1169 . 11 1 1 A 99 99 TYR CB C 99 38.829 38.804 0.025 1
1 1174 . 11 1 1 A 99 99 TYR N N 99 123.539 123.652 -0.113 1
1 1175 . 11 1 1 A 100 100 GLU H H 100 8.520 8.349 0.171 1
1 1176 . 11 1 1 A 100 100 GLU HA H 100 3.952 4.088 -0.136 1
1 1181 . 11 1 1 A 100 100 GLU C C 100 180.151 178.392 1.759 1
1 1182 . 11 1 1 A 100 100 GLU CA C 100 60.099 59.910 0.189 1
1 1183 . 11 1 1 A 100 100 GLU CB C 100 29.435 29.501 -0.066 1
1 1185 . 11 1 1 A 100 100 GLU N N 100 117.082 118.478 -1.396 1
1 1186 . 11 1 1 A 101 101 LYS H H 101 7.740 7.779 -0.039 1
1 1187 . 11 1 1 A 101 101 LYS HA H 101 3.984 4.143 -0.159 1
1 1196 . 11 1 1 A 101 101 LYS C C 101 178.377 178.416 -0.039 1
1 1197 . 11 1 1 A 101 101 LYS CA C 101 59.888 58.859 1.029 1
1 1198 . 11 1 1 A 101 101 LYS CB C 101 32.821 32.395 0.426 1
1 1202 . 11 1 1 A 101 101 LYS N N 101 119.851 120.567 -0.716 1
1 1203 . 11 1 1 A 102 102 ALA H H 102 8.538 8.286 0.252 1
1 1204 . 11 1 1 A 102 102 ALA HA H 102 3.632 3.989 -0.357 1
1 1208 . 11 1 1 A 102 102 ALA C C 102 179.870 179.414 0.456 1
1 1209 . 11 1 1 A 102 102 ALA CA C 102 55.285 54.944 0.341 1
1 1210 . 11 1 1 A 102 102 ALA CB C 102 17.163 17.811 -0.648 1
1 1211 . 11 1 1 A 102 102 ALA N N 102 124.176 121.632 2.544 1
1 1212 . 11 1 1 A 103 103 VAL H H 103 8.147 8.078 0.069 1
1 1213 . 11 1 1 A 103 103 VAL HA H 103 3.658 3.756 -0.098 1
1 1221 . 11 1 1 A 103 103 VAL C C 103 181.113 177.426 3.687 1
1 1222 . 11 1 1 A 103 103 VAL CA C 103 66.090 64.814 1.276 1
1 1223 . 11 1 1 A 103 103 VAL CB C 103 31.822 31.408 0.414 1
1 1226 . 11 1 1 A 103 103 VAL N N 103 117.841 116.786 1.055 1
1 1227 . 11 1 1 A 104 104 LYS H H 104 7.903 7.554 0.349 1
1 1228 . 11 1 1 A 104 104 LYS HA H 104 4.065 4.118 -0.053 1
1 1235 . 11 1 1 A 104 104 LYS C C 104 177.715 178.037 -0.322 1
1 1236 . 11 1 1 A 104 104 LYS CA C 104 59.094 59.319 -0.225 1
1 1237 . 11 1 1 A 104 104 LYS CB C 104 32.285 32.576 -0.291 1
1 1241 . 11 1 1 A 104 104 LYS N N 104 121.515 121.324 0.191 1
1 1242 . 11 1 1 A 105 105 ASN H H 105 7.747 7.751 -0.004 1
1 1243 . 11 1 1 A 105 105 ASN HA H 105 4.721 4.877 -0.156 1
1 1248 . 11 1 1 A 105 105 ASN C C 105 173.320 174.159 -0.839 1
1 1249 . 11 1 1 A 105 105 ASN CA C 105 53.399 52.816 0.583 1
1 1250 . 11 1 1 A 105 105 ASN CB C 105 39.249 38.518 0.731 1
1 1251 . 11 1 1 A 105 105 ASN N N 105 114.941 114.964 -0.023 1
1 1253 . 11 1 1 A 106 106 GLN H H 106 7.850 7.876 -0.026 1
1 1254 . 11 1 1 A 106 106 GLN HA H 106 3.902 3.877 0.025 1
1 1261 . 11 1 1 A 106 106 GLN C C 106 175.168 175.159 0.009 1
1 1262 . 11 1 1 A 106 106 GLN CA C 106 56.978 56.748 0.230 1
1 1263 . 11 1 1 A 106 106 GLN CB C 106 25.770 26.206 -0.436 1
1 1265 . 11 1 1 A 106 106 GLN N N 106 114.989 115.634 -0.645 1
1 1267 . 11 1 1 A 107 107 VAL H H 107 8.005 7.794 0.211 1
1 1268 . 11 1 1 A 107 107 VAL HA H 107 3.664 3.996 -0.332 1
1 1276 . 11 1 1 A 107 107 VAL C C 107 175.468 175.118 0.350 1
1 1277 . 11 1 1 A 107 107 VAL CA C 107 62.726 62.590 0.136 1
1 1278 . 11 1 1 A 107 107 VAL CB C 107 32.535 31.971 0.564 1
1 1281 . 11 1 1 A 107 107 VAL N N 107 120.216 119.795 0.421 1
1 1282 . 11 1 1 A 108 108 ASP H H 108 8.484 8.626 -0.142 1
1 1283 . 11 1 1 A 108 108 ASP HA H 108 4.467 4.506 -0.039 1
1 1286 . 11 1 1 A 108 108 ASP C C 108 177.179 176.332 0.847 1
1 1287 . 11 1 1 A 108 108 ASP CA C 108 53.417 55.187 -1.770 1
1 1288 . 11 1 1 A 108 108 ASP CB C 108 40.030 41.013 -0.983 1
1 1289 . 11 1 1 A 108 108 ASP N N 108 125.414 127.783 -2.369 1
1 1290 . 11 1 1 A 109 109 LEU H H 109 8.470 8.337 0.133 1
1 1291 . 11 1 1 A 109 109 LEU HA H 109 3.846 4.290 -0.444 1
1 1301 . 11 1 1 A 109 109 LEU C C 109 178.145 178.017 0.128 1
1 1302 . 11 1 1 A 109 109 LEU CA C 109 56.573 54.794 1.779 1
1 1303 . 11 1 1 A 109 109 LEU CB C 109 42.011 42.318 -0.307 1
1 1307 . 11 1 1 A 109 109 LEU N N 109 127.577 125.236 2.341 1
1 1308 . 11 1 1 A 110 110 LYS H H 110 8.062 7.944 0.118 1
1 1309 . 11 1 1 A 110 110 LYS HA H 110 3.022 3.846 -0.824 1
1 1317 . 11 1 1 A 110 110 LYS C C 110 177.248 177.490 -0.242 1
1 1318 . 11 1 1 A 110 110 LYS CA C 110 58.742 58.383 0.359 1
1 1319 . 11 1 1 A 110 110 LYS CB C 110 31.667 31.652 0.015 1
1 1323 . 11 1 1 A 110 110 LYS N N 110 118.873 119.006 -0.133 1
1 1324 . 11 1 1 A 111 111 GLU H H 111 7.113 8.297 -1.184 1
1 1325 . 11 1 1 A 111 111 GLU HA H 111 4.117 4.316 -0.199 1
1 1330 . 11 1 1 A 111 111 GLU C C 111 176.519 175.590 0.929 1
1 1331 . 11 1 1 A 111 111 GLU CA C 111 55.621 56.050 -0.429 1
1 1332 . 11 1 1 A 111 111 GLU CB C 111 29.943 29.157 0.786 1
1 1334 . 11 1 1 A 111 111 GLU N N 111 114.282 115.544 -1.262 1
1 1335 . 11 1 1 A 112 112 LEU H H 112 6.848 7.326 -0.478 1
1 1336 . 11 1 1 A 112 112 LEU HA H 112 4.293 4.578 -0.285 1
1 1346 . 11 1 1 A 112 112 LEU C C 112 175.674 175.336 0.338 1
1 1347 . 11 1 1 A 112 112 LEU CA C 112 55.197 53.989 1.208 1
1 1348 . 11 1 1 A 112 112 LEU CB C 112 41.681 42.005 -0.324 1
1 1352 . 11 1 1 A 112 112 LEU N N 112 118.934 122.691 -3.757 1
1 1353 . 11 1 1 A 113 113 ASP H H 113 8.466 8.742 -0.276 1
1 1354 . 11 1 1 A 113 113 ASP HA H 113 4.593 5.260 -0.667 1
1 1357 . 11 1 1 A 113 113 ASP C C 113 174.511 174.827 -0.316 1
1 1358 . 11 1 1 A 113 113 ASP CA C 113 53.558 53.457 0.101 1
1 1359 . 11 1 1 A 113 113 ASP CB C 113 42.448 43.314 -0.866 1
1 1360 . 11 1 1 A 113 113 ASP N N 113 122.148 121.932 0.216 1
1 1 . 12 1 1 A 6 6 SER HA H 6 4.483 4.440 0.043 1
1 4 . 12 1 1 A 6 6 SER C C 6 175.167 174.400 0.767 1
1 5 . 12 1 1 A 6 6 SER CA C 6 58.759 60.183 -1.424 1
1 6 . 12 1 1 A 6 6 SER CB C 6 64.069 63.607 0.462 1
1 7 . 12 1 1 A 7 7 GLY H H 7 8.431 7.418 1.013 1
1 8 . 12 1 1 A 7 7 GLY HA2 H 7 3.973 4.060 -0.087 1
1 9 . 12 1 1 A 7 7 GLY HA3 H 7 3.973 4.066 -0.093 1
1 10 . 12 1 1 A 7 7 GLY C C 7 174.570 173.499 1.071 1
1 11 . 12 1 1 A 7 7 GLY CA C 7 45.483 45.514 -0.031 1
1 12 . 12 1 1 A 7 7 GLY N N 7 110.640 106.046 4.594 1
1 13 . 12 1 1 A 8 8 MET H H 8 8.239 8.376 -0.137 1
1 14 . 12 1 1 A 8 8 MET HA H 8 4.386 4.657 -0.271 1
1 22 . 12 1 1 A 8 8 MET C C 8 176.621 175.950 0.671 1
1 23 . 12 1 1 A 8 8 MET CA C 8 55.991 56.200 -0.209 1
1 24 . 12 1 1 A 8 8 MET CB C 8 32.986 35.098 -2.112 1
1 27 . 12 1 1 A 8 8 MET N N 8 120.219 119.951 0.268 1
1 28 . 12 1 1 A 9 9 ALA H H 9 8.435 7.769 0.666 1
1 29 . 12 1 1 A 9 9 ALA HA H 9 4.182 4.339 -0.157 1
1 33 . 12 1 1 A 9 9 ALA C C 9 177.951 176.501 1.450 1
1 34 . 12 1 1 A 9 9 ALA CA C 9 53.399 52.351 1.048 1
1 35 . 12 1 1 A 9 9 ALA CB C 9 18.955 19.805 -0.850 1
1 36 . 12 1 1 A 9 9 ALA N N 9 124.459 121.685 2.774 1
1 37 . 12 1 1 A 10 10 SER H H 10 8.100 8.632 -0.532 1
1 38 . 12 1 1 A 10 10 SER HA H 10 4.391 5.195 -0.804 1
1 41 . 12 1 1 A 10 10 SER C C 10 174.467 173.538 0.929 1
1 42 . 12 1 1 A 10 10 SER CA C 10 58.709 57.410 1.299 1
1 43 . 12 1 1 A 10 10 SER CB C 10 63.778 64.964 -1.186 1
1 44 . 12 1 1 A 10 10 SER N N 10 113.881 116.329 -2.448 1
1 45 . 12 1 1 A 11 11 THR H H 11 7.821 8.676 -0.855 1
1 46 . 12 1 1 A 11 11 THR HA H 11 4.191 5.185 -0.994 1
1 51 . 12 1 1 A 11 11 THR C C 11 173.610 173.820 -0.210 1
1 52 . 12 1 1 A 11 11 THR CA C 11 61.936 60.786 1.150 1
1 53 . 12 1 1 A 11 11 THR CB C 11 69.713 70.107 -0.394 1
1 55 . 12 1 1 A 11 11 THR N N 11 114.471 117.763 -3.292 1
1 56 . 12 1 1 A 12 12 PHE H H 12 7.946 9.255 -1.309 1
1 57 . 12 1 1 A 12 12 PHE HA H 12 4.769 4.834 -0.065 1
1 65 . 12 1 1 A 12 12 PHE C C 12 174.211 175.038 -0.827 1
1 66 . 12 1 1 A 12 12 PHE CA C 12 56.644 58.142 -1.498 1
1 67 . 12 1 1 A 12 12 PHE CB C 12 40.609 40.385 0.224 1
1 73 . 12 1 1 A 12 12 PHE N N 12 120.763 125.691 -4.928 1
1 74 . 12 1 1 A 13 13 ASN H H 13 9.004 9.316 -0.312 1
1 75 . 12 1 1 A 13 13 ASN HA H 13 5.366 5.480 -0.114 1
1 80 . 12 1 1 A 13 13 ASN C C 13 172.158 174.063 -1.905 1
1 81 . 12 1 1 A 13 13 ASN CA C 13 50.988 50.633 0.355 1
1 82 . 12 1 1 A 13 13 ASN CB C 13 39.942 39.257 0.685 1
1 83 . 12 1 1 A 13 13 ASN N N 13 119.973 120.776 -0.803 1
1 85 . 12 1 1 A 14 14 PRO HA H 14 4.945 4.598 0.347 1
1 92 . 12 1 1 A 14 14 PRO C C 14 174.901 175.959 -1.058 1
1 93 . 12 1 1 A 14 14 PRO CA C 14 63.096 62.623 0.473 1
1 94 . 12 1 1 A 14 14 PRO CB C 14 32.739 32.376 0.363 1
1 97 . 12 1 1 A 15 15 ARG H H 15 8.908 8.638 0.270 1
1 98 . 12 1 1 A 15 15 ARG HA H 15 4.626 4.629 -0.003 1
1 106 . 12 1 1 A 15 15 ARG C C 15 174.432 175.526 -1.094 1
1 107 . 12 1 1 A 15 15 ARG CA C 15 54.827 55.631 -0.804 1
1 108 . 12 1 1 A 15 15 ARG CB C 15 32.439 31.300 1.139 1
1 111 . 12 1 1 A 15 15 ARG N N 15 118.947 121.507 -2.560 1
1 113 . 12 1 1 A 16 16 GLU H H 16 8.838 8.909 -0.071 1
1 114 . 12 1 1 A 16 16 GLU HA H 16 4.876 4.684 0.192 1
1 119 . 12 1 1 A 16 16 GLU C C 16 175.767 175.380 0.387 1
1 120 . 12 1 1 A 16 16 GLU CA C 16 55.621 56.603 -0.982 1
1 121 . 12 1 1 A 16 16 GLU CB C 16 31.093 30.000 1.093 1
1 123 . 12 1 1 A 16 16 GLU N N 16 125.316 127.910 -2.594 1
1 124 . 12 1 1 A 17 17 CYS H H 17 9.327 9.002 0.325 1
1 125 . 12 1 1 A 17 17 CYS HA H 17 4.804 5.247 -0.443 1
1 128 . 12 1 1 A 17 17 CYS C C 17 172.973 173.251 -0.278 1
1 129 . 12 1 1 A 17 17 CYS CA C 17 57.930 56.887 1.043 1
1 130 . 12 1 1 A 17 17 CYS CB C 17 30.105 29.073 1.032 1
1 131 . 12 1 1 A 17 17 CYS N N 17 127.909 125.084 2.825 1
1 132 . 12 1 1 A 18 18 LYS H H 18 9.022 8.882 0.140 1
1 133 . 12 1 1 A 18 18 LYS HA H 18 4.769 4.648 0.121 1
1 142 . 12 1 1 A 18 18 LYS C C 18 174.586 175.356 -0.770 1
1 143 . 12 1 1 A 18 18 LYS CA C 18 55.956 55.549 0.407 1
1 144 . 12 1 1 A 18 18 LYS CB C 18 32.203 32.690 -0.487 1
1 148 . 12 1 1 A 18 18 LYS N N 18 127.039 126.076 0.963 1
1 149 . 12 1 1 A 19 19 LEU H H 19 8.784 8.667 0.117 1
1 150 . 12 1 1 A 19 19 LEU HA H 19 4.852 4.651 0.201 1
1 160 . 12 1 1 A 19 19 LEU C C 19 176.862 176.364 0.498 1
1 161 . 12 1 1 A 19 19 LEU CA C 19 55.391 54.363 1.028 1
1 162 . 12 1 1 A 19 19 LEU CB C 19 44.442 42.477 1.965 1
1 166 . 12 1 1 A 19 19 LEU N N 19 126.311 126.509 -0.198 1
1 167 . 12 1 1 A 20 20 SER H H 20 8.215 8.942 -0.727 1
1 168 . 12 1 1 A 20 20 SER HA H 20 5.461 5.442 0.019 1
1 171 . 12 1 1 A 20 20 SER C C 20 171.960 173.234 -1.274 1
1 172 . 12 1 1 A 20 20 SER CA C 20 57.525 56.870 0.655 1
1 173 . 12 1 1 A 20 20 SER CB C 20 65.794 65.965 -0.171 1
1 174 . 12 1 1 A 20 20 SER N N 20 115.113 115.405 -0.292 1
1 175 . 12 1 1 A 21 21 LYS H H 21 9.001 8.541 0.460 1
1 176 . 12 1 1 A 21 21 LYS HA H 21 4.887 4.906 -0.019 1
1 185 . 12 1 1 A 21 21 LYS C C 21 174.133 175.213 -1.080 1
1 186 . 12 1 1 A 21 21 LYS CA C 21 53.840 54.367 -0.527 1
1 187 . 12 1 1 A 21 21 LYS CB C 21 36.553 35.320 1.233 1
1 191 . 12 1 1 A 21 21 LYS N N 21 120.938 120.612 0.326 1
1 192 . 12 1 1 A 22 22 GLN H H 22 8.201 8.169 0.032 1
1 193 . 12 1 1 A 22 22 GLN HA H 22 4.448 4.484 -0.036 1
1 200 . 12 1 1 A 22 22 GLN C C 22 176.372 176.142 0.230 1
1 201 . 12 1 1 A 22 22 GLN CA C 22 53.658 55.230 -1.572 1
1 202 . 12 1 1 A 22 22 GLN CB C 22 30.473 29.970 0.503 1
1 204 . 12 1 1 A 22 22 GLN N N 22 116.816 119.619 -2.803 1
1 206 . 12 1 1 A 23 23 GLU H H 23 8.624 8.684 -0.060 1
1 207 . 12 1 1 A 23 23 GLU HA H 23 4.056 4.073 -0.017 1
1 212 . 12 1 1 A 23 23 GLU C C 23 177.778 177.324 0.454 1
1 213 . 12 1 1 A 23 23 GLU CA C 23 58.001 58.145 -0.144 1
1 214 . 12 1 1 A 23 23 GLU CB C 23 29.237 28.764 0.473 1
1 216 . 12 1 1 A 23 23 GLU N N 23 122.364 121.179 1.185 1
1 217 . 12 1 1 A 24 24 GLY H H 24 8.962 8.760 0.202 1
1 218 . 12 1 1 A 24 24 GLY HA2 H 24 4.139 3.864 0.275 1
1 219 . 12 1 1 A 24 24 GLY HA3 H 24 3.711 3.872 -0.161 1
1 220 . 12 1 1 A 24 24 GLY C C 24 173.857 173.652 0.205 1
1 221 . 12 1 1 A 24 24 GLY CA C 24 45.288 45.567 -0.279 1
1 222 . 12 1 1 A 24 24 GLY N N 24 113.942 113.076 0.866 1
1 223 . 12 1 1 A 25 25 GLN H H 25 7.643 7.300 0.343 1
1 224 . 12 1 1 A 25 25 GLN HA H 25 4.488 4.607 -0.119 1
1 231 . 12 1 1 A 25 25 GLN C C 25 174.727 174.858 -0.131 1
1 232 . 12 1 1 A 25 25 GLN CA C 25 54.052 54.218 -0.166 1
1 233 . 12 1 1 A 25 25 GLN CB C 25 30.843 30.886 -0.043 1
1 235 . 12 1 1 A 25 25 GLN N N 25 119.538 120.837 -1.299 1
1 237 . 12 1 1 A 26 26 ASN H H 26 8.625 8.876 -0.251 1
1 238 . 12 1 1 A 26 26 ASN HA H 26 4.862 4.857 0.005 1
1 243 . 12 1 1 A 26 26 ASN C C 26 176.261 175.843 0.418 1
1 244 . 12 1 1 A 26 26 ASN CA C 26 51.812 52.760 -0.948 1
1 245 . 12 1 1 A 26 26 ASN CB C 26 40.403 39.566 0.837 1
1 246 . 12 1 1 A 26 26 ASN N N 26 120.047 122.091 -2.044 1
1 248 . 12 1 1 A 27 27 TYR HA H 27 4.152 4.489 -0.337 1
1 255 . 12 1 1 A 27 27 TYR C C 27 176.731 175.995 0.736 1
1 256 . 12 1 1 A 27 27 TYR CA C 27 62.462 60.472 1.990 1
1 257 . 12 1 1 A 27 27 TYR CB C 27 40.240 39.638 0.602 1
1 262 . 12 1 1 A 27 27 TYR N N 27 121.761 121.512 0.249 1
1 263 . 12 1 1 A 28 28 GLY H H 28 8.285 7.722 0.563 1
1 264 . 12 1 1 A 28 28 GLY HA2 H 28 4.490 3.921 0.569 1
1 265 . 12 1 1 A 28 28 GLY HA3 H 28 3.759 4.030 -0.271 1
1 266 . 12 1 1 A 28 28 GLY C C 28 172.198 174.142 -1.944 1
1 267 . 12 1 1 A 28 28 GLY CA C 28 46.139 45.317 0.822 1
1 268 . 12 1 1 A 28 28 GLY N N 28 103.567 106.865 -3.298 1
1 269 . 12 1 1 A 29 29 PHE H H 29 6.878 7.712 -0.834 1
1 270 . 12 1 1 A 29 29 PHE HA H 29 5.179 4.893 0.286 1
1 278 . 12 1 1 A 29 29 PHE C C 29 172.840 173.925 -1.085 1
1 279 . 12 1 1 A 29 29 PHE CA C 29 55.262 54.920 0.342 1
1 280 . 12 1 1 A 29 29 PHE CB C 29 41.779 42.480 -0.701 1
1 286 . 12 1 1 A 29 29 PHE N N 29 111.027 117.649 -6.622 1
1 287 . 12 1 1 A 30 30 PHE H H 30 8.806 9.015 -0.209 1
1 288 . 12 1 1 A 30 30 PHE HA H 30 4.923 4.989 -0.066 1
1 296 . 12 1 1 A 30 30 PHE C C 30 174.501 174.940 -0.439 1
1 297 . 12 1 1 A 30 30 PHE CA C 30 55.356 55.291 0.065 1
1 298 . 12 1 1 A 30 30 PHE CB C 30 41.681 43.267 -1.586 1
1 304 . 12 1 1 A 30 30 PHE N N 30 118.710 117.222 1.488 1
1 305 . 12 1 1 A 31 31 LEU H H 31 8.441 9.219 -0.778 1
1 306 . 12 1 1 A 31 31 LEU HA H 31 5.447 5.169 0.278 1
1 316 . 12 1 1 A 31 31 LEU C C 31 177.306 176.030 1.276 1
1 317 . 12 1 1 A 31 31 LEU CA C 31 53.610 53.373 0.237 1
1 318 . 12 1 1 A 31 31 LEU CB C 31 43.696 43.272 0.424 1
1 322 . 12 1 1 A 31 31 LEU N N 31 123.765 122.124 1.641 1
1 323 . 12 1 1 A 32 32 ARG H H 32 9.381 9.206 0.175 1
1 324 . 12 1 1 A 32 32 ARG HA H 32 4.840 4.866 -0.026 1
1 331 . 12 1 1 A 32 32 ARG C C 32 175.155 176.004 -0.849 1
1 332 . 12 1 1 A 32 32 ARG CA C 32 54.210 54.172 0.038 1
1 333 . 12 1 1 A 32 32 ARG CB C 32 35.087 32.038 3.049 1
1 336 . 12 1 1 A 32 32 ARG N N 32 123.160 124.607 -1.447 1
1 337 . 12 1 1 A 33 33 ILE H H 33 7.891 8.832 -0.941 1
1 338 . 12 1 1 A 33 33 ILE HA H 33 4.495 4.898 -0.403 1
1 348 . 12 1 1 A 33 33 ILE C C 33 175.850 174.048 1.802 1
1 349 . 12 1 1 A 33 33 ILE CA C 33 59.641 59.239 0.402 1
1 350 . 12 1 1 A 33 33 ILE CB C 33 39.538 40.755 -1.217 1
1 354 . 12 1 1 A 33 33 ILE N N 33 118.924 118.026 0.898 1
1 355 . 12 1 1 A 34 34 GLU H H 34 8.971 8.910 0.061 1
1 356 . 12 1 1 A 34 34 GLU HA H 34 4.578 5.017 -0.439 1
1 361 . 12 1 1 A 34 34 GLU C C 34 175.766 175.851 -0.085 1
1 362 . 12 1 1 A 34 34 GLU CA C 34 54.263 54.471 -0.208 1
1 363 . 12 1 1 A 34 34 GLU CB C 34 32.128 33.306 -1.178 1
1 365 . 12 1 1 A 34 34 GLU N N 34 125.447 123.778 1.669 1
1 366 . 12 1 1 A 35 35 LYS H H 35 8.504 8.580 -0.076 1
1 367 . 12 1 1 A 35 35 LYS HA H 35 4.026 4.321 -0.295 1
1 376 . 12 1 1 A 35 35 LYS C C 35 177.701 176.209 1.492 1
1 377 . 12 1 1 A 35 35 LYS CA C 35 57.591 56.211 1.380 1
1 378 . 12 1 1 A 35 35 LYS CB C 35 32.491 33.220 -0.729 1
1 382 . 12 1 1 A 35 35 LYS N N 35 122.893 121.894 0.999 1
1 383 . 12 1 1 A 36 36 ASP H H 36 9.020 9.228 -0.208 1
1 384 . 12 1 1 A 36 36 ASP HA H 36 4.385 4.164 0.221 1
1 387 . 12 1 1 A 36 36 ASP C C 36 174.554 174.609 -0.055 1
1 388 . 12 1 1 A 36 36 ASP CA C 36 55.868 54.955 0.913 1
1 389 . 12 1 1 A 36 36 ASP CB C 36 39.826 39.707 0.119 1
1 390 . 12 1 1 A 36 36 ASP N N 36 121.412 120.353 1.059 1
1 391 . 12 1 1 A 37 37 THR H H 37 7.464 7.461 0.003 1
1 392 . 12 1 1 A 37 37 THR HA H 37 4.454 4.836 -0.382 1
1 397 . 12 1 1 A 37 37 THR C C 37 172.012 171.411 0.601 1
1 398 . 12 1 1 A 37 37 THR CA C 37 61.686 60.895 0.791 1
1 399 . 12 1 1 A 37 37 THR CB C 37 70.927 72.639 -1.712 1
1 401 . 12 1 1 A 37 37 THR N N 37 113.147 112.281 0.866 1
1 402 . 12 1 1 A 38 38 ASP H H 38 8.931 8.668 0.263 1
1 403 . 12 1 1 A 38 38 ASP HA H 38 4.852 5.075 -0.223 1
1 406 . 12 1 1 A 38 38 ASP CA C 38 54.826 52.521 2.305 1
1 407 . 12 1 1 A 38 38 ASP CB C 38 43.332 43.005 0.327 1
1 408 . 12 1 1 A 38 38 ASP N N 38 120.401 125.025 -4.624 1
1 409 . 12 1 1 A 39 39 GLY H H 39 8.068 8.290 -0.222 1
1 410 . 12 1 1 A 39 39 GLY HA2 H 39 3.774 4.046 -0.272 1
1 411 . 12 1 1 A 39 39 GLY HA3 H 39 3.555 4.052 -0.497 1
1 412 . 12 1 1 A 39 39 GLY C C 39 172.578 173.451 -0.873 1
1 413 . 12 1 1 A 39 39 GLY CA C 39 43.967 44.615 -0.648 1
1 414 . 12 1 1 A 39 39 GLY N N 39 107.925 113.071 -5.146 1
1 415 . 12 1 1 A 40 40 HIS H H 40 9.111 8.592 0.519 1
1 416 . 12 1 1 A 40 40 HIS HA H 40 4.650 4.759 -0.109 1
1 421 . 12 1 1 A 40 40 HIS C C 40 174.330 174.685 -0.355 1
1 422 . 12 1 1 A 40 40 HIS CA C 40 55.886 56.387 -0.501 1
1 423 . 12 1 1 A 40 40 HIS CB C 40 30.507 30.669 -0.162 1
1 426 . 12 1 1 A 40 40 HIS N N 40 119.179 119.330 -0.151 1
1 427 . 12 1 1 A 41 41 LEU H H 41 8.254 8.624 -0.370 1
1 428 . 12 1 1 A 41 41 LEU HA H 41 4.626 4.822 -0.196 1
1 438 . 12 1 1 A 41 41 LEU C C 41 176.035 176.564 -0.529 1
1 439 . 12 1 1 A 41 41 LEU CA C 41 55.621 53.592 2.029 1
1 440 . 12 1 1 A 41 41 LEU CB C 41 45.091 43.475 1.616 1
1 444 . 12 1 1 A 41 41 LEU N N 41 124.808 124.337 0.471 1
1 445 . 12 1 1 A 42 42 ILE H H 42 8.685 8.244 0.441 1
1 446 . 12 1 1 A 42 42 ILE HA H 42 4.578 4.609 -0.031 1
1 456 . 12 1 1 A 42 42 ILE C C 42 175.369 175.606 -0.237 1
1 457 . 12 1 1 A 42 42 ILE CA C 42 59.852 60.810 -0.958 1
1 458 . 12 1 1 A 42 42 ILE CB C 42 36.778 38.044 -1.266 1
1 462 . 12 1 1 A 42 42 ILE N N 42 121.814 125.075 -3.261 1
1 463 . 12 1 1 A 43 43 ARG H H 43 8.787 8.991 -0.204 1
1 464 . 12 1 1 A 43 43 ARG HA H 43 4.852 4.656 0.196 1
1 472 . 12 1 1 A 43 43 ARG C C 43 174.029 175.042 -1.013 1
1 473 . 12 1 1 A 43 43 ARG CA C 43 52.730 55.720 -2.990 1
1 474 . 12 1 1 A 43 43 ARG CB C 43 36.983 33.376 3.607 1
1 477 . 12 1 1 A 43 43 ARG N N 43 125.771 126.347 -0.576 1
1 479 . 12 1 1 A 44 44 VAL H H 44 8.661 8.572 0.089 1
1 480 . 12 1 1 A 44 44 VAL HA H 44 3.276 3.751 -0.475 1
1 488 . 12 1 1 A 44 44 VAL C C 44 173.227 174.999 -1.772 1
1 489 . 12 1 1 A 44 44 VAL CA C 44 63.161 63.270 -0.109 1
1 490 . 12 1 1 A 44 44 VAL CB C 44 29.054 29.928 -0.874 1
1 493 . 12 1 1 A 44 44 VAL N N 44 117.026 121.127 -4.101 1
1 494 . 12 1 1 A 45 45 ILE H H 45 8.464 7.998 0.466 1
1 495 . 12 1 1 A 45 45 ILE HA H 45 4.579 4.221 0.358 1
1 505 . 12 1 1 A 45 45 ILE C C 45 178.108 175.607 2.501 1
1 506 . 12 1 1 A 45 45 ILE CA C 45 59.888 61.045 -1.157 1
1 507 . 12 1 1 A 45 45 ILE CB C 45 36.998 36.269 0.729 1
1 511 . 12 1 1 A 45 45 ILE N N 45 122.767 122.438 0.329 1
1 512 . 12 1 1 A 46 46 GLU H H 46 9.015 8.384 0.631 1
1 513 . 12 1 1 A 46 46 GLU HA H 46 4.206 4.284 -0.078 1
1 518 . 12 1 1 A 46 46 GLU C C 46 177.746 176.005 1.741 1
1 519 . 12 1 1 A 46 46 GLU CA C 46 56.130 57.292 -1.162 1
1 520 . 12 1 1 A 46 46 GLU CB C 46 30.581 30.367 0.214 1
1 522 . 12 1 1 A 46 46 GLU N N 46 131.076 128.319 2.757 1
1 523 . 12 1 1 A 47 47 GLU H H 47 9.213 8.625 0.588 1
1 524 . 12 1 1 A 47 47 GLU HA H 47 4.194 4.118 0.076 1
1 529 . 12 1 1 A 47 47 GLU C C 47 178.088 177.589 0.499 1
1 530 . 12 1 1 A 47 47 GLU CA C 47 58.212 57.816 0.396 1
1 531 . 12 1 1 A 47 47 GLU CB C 47 29.390 30.056 -0.666 1
1 533 . 12 1 1 A 47 47 GLU N N 47 129.592 124.795 4.797 1
1 534 . 12 1 1 A 48 48 GLY H H 48 9.586 8.928 0.658 1
1 535 . 12 1 1 A 48 48 GLY HA2 H 48 4.141 3.819 0.322 1
1 536 . 12 1 1 A 48 48 GLY HA3 H 48 3.757 3.820 -0.063 1
1 537 . 12 1 1 A 48 48 GLY C C 48 173.790 174.080 -0.290 1
1 538 . 12 1 1 A 48 48 GLY CA C 48 45.764 46.943 -1.179 1
1 539 . 12 1 1 A 48 48 GLY N N 48 114.819 114.591 0.228 1
1 540 . 12 1 1 A 49 49 SER H H 49 7.580 7.881 -0.301 1
1 541 . 12 1 1 A 49 49 SER HA H 49 4.728 4.950 -0.222 1
1 544 . 12 1 1 A 49 49 SER C C 49 173.542 174.437 -0.895 1
1 545 . 12 1 1 A 49 49 SER CA C 49 57.560 55.756 1.804 1
1 546 . 12 1 1 A 49 49 SER CB C 49 64.529 64.018 0.511 1
1 547 . 12 1 1 A 49 49 SER N N 49 114.688 113.574 1.114 1
1 548 . 12 1 1 A 50 50 PRO HA H 50 4.431 4.562 -0.131 1
1 555 . 12 1 1 A 50 50 PRO C C 50 179.377 177.835 1.542 1
1 556 . 12 1 1 A 50 50 PRO CA C 50 66.059 64.274 1.785 1
1 557 . 12 1 1 A 50 50 PRO CB C 50 32.598 31.882 0.716 1
1 560 . 12 1 1 A 51 51 ALA H H 51 8.264 7.876 0.388 1
1 561 . 12 1 1 A 51 51 ALA HA H 51 3.817 3.963 -0.146 1
1 565 . 12 1 1 A 51 51 ALA C C 51 177.508 179.721 -2.213 1
1 566 . 12 1 1 A 51 51 ALA CA C 51 55.392 55.156 0.236 1
1 567 . 12 1 1 A 51 51 ALA CB C 51 20.474 18.315 2.159 1
1 568 . 12 1 1 A 51 51 ALA N N 51 117.604 119.985 -2.381 1
1 569 . 12 1 1 A 52 52 GLU H H 52 7.794 7.583 0.211 1
1 570 . 12 1 1 A 52 52 GLU HA H 52 3.881 4.235 -0.354 1
1 575 . 12 1 1 A 52 52 GLU C C 52 181.401 178.566 2.835 1
1 576 . 12 1 1 A 52 52 GLU CA C 52 59.454 58.968 0.486 1
1 577 . 12 1 1 A 52 52 GLU CB C 52 30.247 29.475 0.772 1
1 579 . 12 1 1 A 52 52 GLU N N 52 119.474 118.845 0.629 1
1 580 . 12 1 1 A 53 53 LYS H H 53 8.557 7.855 0.702 1
1 581 . 12 1 1 A 53 53 LYS HA H 53 4.020 4.023 -0.003 1
1 588 . 12 1 1 A 53 53 LYS C C 53 177.939 177.923 0.016 1
1 589 . 12 1 1 A 53 53 LYS CA C 53 59.012 58.802 0.210 1
1 590 . 12 1 1 A 53 53 LYS CB C 53 32.438 32.108 0.330 1
1 594 . 12 1 1 A 53 53 LYS N N 53 120.057 119.553 0.504 1
1 595 . 12 1 1 A 54 54 ALA H H 54 7.764 7.557 0.207 1
1 596 . 12 1 1 A 54 54 ALA HA H 54 4.400 4.315 0.085 1
1 600 . 12 1 1 A 54 54 ALA C C 54 177.658 177.743 -0.085 1
1 601 . 12 1 1 A 54 54 ALA CA C 54 52.412 51.637 0.775 1
1 602 . 12 1 1 A 54 54 ALA CB C 54 20.739 18.306 2.433 1
1 603 . 12 1 1 A 54 54 ALA N N 54 117.678 118.766 -1.088 1
1 604 . 12 1 1 A 55 55 GLY H H 55 7.583 7.946 -0.363 1
1 605 . 12 1 1 A 55 55 GLY HA2 H 55 4.266 3.926 0.340 1
1 606 . 12 1 1 A 55 55 GLY HA3 H 55 3.775 3.928 -0.153 1
1 607 . 12 1 1 A 55 55 GLY C C 55 175.232 174.342 0.890 1
1 608 . 12 1 1 A 55 55 GLY CA C 55 45.368 46.438 -1.070 1
1 609 . 12 1 1 A 55 55 GLY N N 55 103.265 107.611 -4.346 1
1 610 . 12 1 1 A 56 56 LEU H H 56 7.280 7.570 -0.290 1
1 611 . 12 1 1 A 56 56 LEU HA H 56 3.984 4.706 -0.722 1
1 621 . 12 1 1 A 56 56 LEU C C 56 174.708 175.927 -1.219 1
1 622 . 12 1 1 A 56 56 LEU CA C 56 55.603 53.981 1.622 1
1 623 . 12 1 1 A 56 56 LEU CB C 56 42.752 42.528 0.224 1
1 627 . 12 1 1 A 56 56 LEU N N 56 119.211 123.008 -3.797 1
1 628 . 12 1 1 A 57 57 LEU H H 57 8.693 8.844 -0.151 1
1 629 . 12 1 1 A 57 57 LEU HA H 57 4.499 5.225 -0.726 1
1 639 . 12 1 1 A 57 57 LEU C C 57 176.124 175.759 0.365 1
1 640 . 12 1 1 A 57 57 LEU CA C 57 52.959 52.700 0.259 1
1 641 . 12 1 1 A 57 57 LEU CB C 57 45.122 45.021 0.101 1
1 645 . 12 1 1 A 57 57 LEU N N 57 121.969 122.612 -0.643 1
1 646 . 12 1 1 A 58 58 ASP H H 58 8.334 8.683 -0.349 1
1 647 . 12 1 1 A 58 58 ASP HA H 58 4.139 4.503 -0.364 1
1 650 . 12 1 1 A 58 58 ASP C C 58 178.636 176.633 2.003 1
1 651 . 12 1 1 A 58 58 ASP CA C 58 56.079 55.080 0.999 1
1 652 . 12 1 1 A 58 58 ASP CB C 58 42.135 40.543 1.592 1
1 653 . 12 1 1 A 58 58 ASP N N 58 120.401 120.055 0.346 1
1 654 . 12 1 1 A 59 59 GLY H H 59 9.378 9.151 0.227 1
1 655 . 12 1 1 A 59 59 GLY HA2 H 59 4.317 3.977 0.340 1
1 656 . 12 1 1 A 59 59 GLY HA3 H 59 3.260 3.977 -0.717 1
1 657 . 12 1 1 A 59 59 GLY C C 59 173.359 173.924 -0.565 1
1 658 . 12 1 1 A 59 59 GLY CA C 59 45.517 45.069 0.448 1
1 659 . 12 1 1 A 59 59 GLY N N 59 116.622 111.721 4.901 1
1 660 . 12 1 1 A 60 60 ASP H H 60 8.009 8.007 0.002 1
1 661 . 12 1 1 A 60 60 ASP HA H 60 4.638 4.578 0.060 1
1 664 . 12 1 1 A 60 60 ASP C C 60 175.555 175.631 -0.076 1
1 665 . 12 1 1 A 60 60 ASP CA C 60 55.286 55.233 0.053 1
1 666 . 12 1 1 A 60 60 ASP CB C 60 42.381 41.467 0.914 1
1 667 . 12 1 1 A 60 60 ASP N N 60 121.370 121.861 -0.491 1
1 668 . 12 1 1 A 61 61 ARG H H 61 8.648 8.660 -0.012 1
1 669 . 12 1 1 A 61 61 ARG HA H 61 5.179 5.075 0.104 1
1 677 . 12 1 1 A 61 61 ARG C C 61 177.381 174.707 2.674 1
1 678 . 12 1 1 A 61 61 ARG CA C 61 53.704 55.401 -1.697 1
1 679 . 12 1 1 A 61 61 ARG CB C 61 34.017 31.646 2.371 1
1 682 . 12 1 1 A 61 61 ARG N N 61 116.958 123.833 -6.875 1
1 684 . 12 1 1 A 62 62 VAL H H 62 8.247 8.640 -0.393 1
1 685 . 12 1 1 A 62 62 VAL HA H 62 3.806 4.592 -0.786 1
1 693 . 12 1 1 A 62 62 VAL C C 62 174.748 174.998 -0.250 1
1 694 . 12 1 1 A 62 62 VAL CA C 62 63.149 61.760 1.389 1
1 695 . 12 1 1 A 62 62 VAL CB C 62 32.574 32.037 0.537 1
1 698 . 12 1 1 A 62 62 VAL N N 62 118.546 125.766 -7.220 1
1 699 . 12 1 1 A 63 63 LEU H H 63 9.262 9.128 0.134 1
1 700 . 12 1 1 A 63 63 LEU HA H 63 4.412 4.339 0.073 1
1 710 . 12 1 1 A 63 63 LEU C C 63 177.649 177.315 0.334 1
1 711 . 12 1 1 A 63 63 LEU CA C 63 56.044 56.403 -0.359 1
1 712 . 12 1 1 A 63 63 LEU CB C 63 43.339 42.905 0.434 1
1 716 . 12 1 1 A 63 63 LEU N N 63 125.413 131.307 -5.894 1
1 717 . 12 1 1 A 64 64 ARG H H 64 7.806 7.615 0.191 1
1 718 . 12 1 1 A 64 64 ARG HA H 64 5.704 5.003 0.701 1
1 726 . 12 1 1 A 64 64 ARG C C 64 175.091 174.030 1.061 1
1 727 . 12 1 1 A 64 64 ARG CA C 64 54.148 54.609 -0.461 1
1 728 . 12 1 1 A 64 64 ARG CB C 64 35.742 34.317 1.425 1
1 731 . 12 1 1 A 64 64 ARG N N 64 112.961 117.287 -4.326 1
1 733 . 12 1 1 A 65 65 ILE H H 65 8.327 9.226 -0.899 1
1 734 . 12 1 1 A 65 65 ILE HA H 65 4.384 4.672 -0.288 1
1 744 . 12 1 1 A 65 65 ILE C C 65 175.722 175.415 0.307 1
1 745 . 12 1 1 A 65 65 ILE CA C 65 60.501 59.400 1.101 1
1 746 . 12 1 1 A 65 65 ILE CB C 65 39.547 40.544 -0.997 1
1 750 . 12 1 1 A 65 65 ILE N N 65 119.175 122.782 -3.607 1
1 751 . 12 1 1 A 66 66 ASN H H 66 9.911 9.613 0.298 1
1 752 . 12 1 1 A 66 66 ASN HA H 66 4.428 4.396 0.032 1
1 757 . 12 1 1 A 66 66 ASN C C 66 175.349 174.657 0.692 1
1 758 . 12 1 1 A 66 66 ASN CA C 66 54.157 54.221 -0.064 1
1 759 . 12 1 1 A 66 66 ASN CB C 66 37.024 37.437 -0.413 1
1 760 . 12 1 1 A 66 66 ASN N N 66 128.952 128.121 0.831 1
1 762 . 12 1 1 A 67 67 GLY H H 67 9.230 8.695 0.535 1
1 763 . 12 1 1 A 67 67 GLY HA2 H 67 4.322 3.962 0.360 1
1 764 . 12 1 1 A 67 67 GLY HA3 H 67 3.508 3.970 -0.462 1
1 765 . 12 1 1 A 67 67 GLY C C 67 174.393 173.933 0.460 1
1 766 . 12 1 1 A 67 67 GLY CA C 67 45.341 46.475 -1.134 1
1 767 . 12 1 1 A 67 67 GLY N N 67 103.238 104.587 -1.349 1
1 768 . 12 1 1 A 68 68 VAL H H 68 8.063 7.681 0.382 1
1 769 . 12 1 1 A 68 68 VAL HA H 68 4.015 4.612 -0.597 1
1 777 . 12 1 1 A 68 68 VAL C C 68 175.833 174.727 1.106 1
1 778 . 12 1 1 A 68 68 VAL CA C 68 62.603 61.198 1.405 1
1 779 . 12 1 1 A 68 68 VAL CB C 68 32.574 35.105 -2.531 1
1 782 . 12 1 1 A 68 68 VAL N N 68 125.696 119.524 6.172 1
1 783 . 12 1 1 A 69 69 PHE H H 69 9.301 9.115 0.186 1
1 784 . 12 1 1 A 69 69 PHE HA H 69 4.947 4.571 0.376 1
1 792 . 12 1 1 A 69 69 PHE C C 69 177.120 175.816 1.304 1
1 793 . 12 1 1 A 69 69 PHE CA C 69 59.200 58.139 1.061 1
1 794 . 12 1 1 A 69 69 PHE CB C 69 39.320 39.375 -0.055 1
1 800 . 12 1 1 A 69 69 PHE N N 69 128.641 128.777 -0.136 1
1 801 . 12 1 1 A 70 70 VAL H H 70 8.312 7.977 0.335 1
1 802 . 12 1 1 A 70 70 VAL HA H 70 4.517 4.464 0.053 1
1 810 . 12 1 1 A 70 70 VAL CA C 70 60.734 60.443 0.291 1
1 811 . 12 1 1 A 70 70 VAL CB C 70 32.976 31.348 1.628 1
1 814 . 12 1 1 A 70 70 VAL N N 70 118.381 120.032 -1.651 1
1 815 . 12 1 1 A 71 71 ASP H H 71 5.373 7.135 -1.762 1
1 816 . 12 1 1 A 71 71 ASP HA H 71 4.413 4.248 0.165 1
1 819 . 12 1 1 A 71 71 ASP C C 71 174.896 177.294 -2.398 1
1 820 . 12 1 1 A 71 71 ASP CA C 71 58.334 56.799 1.535 1
1 821 . 12 1 1 A 71 71 ASP CB C 71 46.097 40.658 5.439 1
1 822 . 12 1 1 A 71 71 ASP N N 71 119.008 122.088 -3.080 1
1 823 . 12 1 1 A 72 72 LYS H H 72 7.874 7.408 0.466 1
1 824 . 12 1 1 A 72 72 LYS HA H 72 4.522 4.373 0.149 1
1 833 . 12 1 1 A 72 72 LYS C C 72 177.209 176.521 0.688 1
1 834 . 12 1 1 A 72 72 LYS CA C 72 54.122 56.144 -2.022 1
1 835 . 12 1 1 A 72 72 LYS CB C 72 31.640 34.345 -2.705 1
1 839 . 12 1 1 A 72 72 LYS N N 72 110.259 116.005 -5.746 1
1 840 . 12 1 1 A 73 73 GLU H H 73 7.421 7.699 -0.278 1
1 841 . 12 1 1 A 73 73 GLU HA H 73 4.401 4.356 0.045 1
1 846 . 12 1 1 A 73 73 GLU C C 73 176.728 176.090 0.638 1
1 847 . 12 1 1 A 73 73 GLU CA C 73 54.950 57.059 -2.109 1
1 848 . 12 1 1 A 73 73 GLU CB C 73 30.390 30.598 -0.208 1
1 850 . 12 1 1 A 73 73 GLU N N 73 120.043 119.127 0.916 1
1 851 . 12 1 1 A 74 74 GLU H H 74 9.360 8.873 0.487 1
1 852 . 12 1 1 A 74 74 GLU HA H 74 4.403 4.551 -0.148 1
1 857 . 12 1 1 A 74 74 GLU C C 74 178.234 178.071 0.163 1
1 858 . 12 1 1 A 74 74 GLU CA C 74 56.516 55.632 0.884 1
1 859 . 12 1 1 A 74 74 GLU CB C 74 30.390 30.578 -0.188 1
1 861 . 12 1 1 A 74 74 GLU N N 74 122.193 121.015 1.178 1
1 862 . 12 1 1 A 75 75 HIS H H 75 9.553 9.260 0.293 1
1 863 . 12 1 1 A 75 75 HIS HA H 75 4.080 4.192 -0.112 1
1 868 . 12 1 1 A 75 75 HIS C C 75 175.985 176.857 -0.872 1
1 869 . 12 1 1 A 75 75 HIS CA C 75 61.016 60.604 0.412 1
1 870 . 12 1 1 A 75 75 HIS CB C 75 29.468 30.590 -1.122 1
1 873 . 12 1 1 A 75 75 HIS N N 75 123.587 122.927 0.660 1
1 874 . 12 1 1 A 76 76 ALA H H 76 9.129 8.328 0.801 1
1 875 . 12 1 1 A 76 76 ALA HA H 76 3.826 3.958 -0.132 1
1 879 . 12 1 1 A 76 76 ALA C C 76 180.475 178.973 1.502 1
1 880 . 12 1 1 A 76 76 ALA CA C 76 55.392 54.613 0.779 1
1 881 . 12 1 1 A 76 76 ALA CB C 76 18.182 18.086 0.096 1
1 882 . 12 1 1 A 76 76 ALA N N 76 117.795 120.893 -3.098 1
1 883 . 12 1 1 A 77 77 GLN H H 77 7.099 7.609 -0.510 1
1 884 . 12 1 1 A 77 77 GLN HA H 77 4.198 4.234 -0.036 1
1 891 . 12 1 1 A 77 77 GLN C C 77 177.860 178.633 -0.773 1
1 892 . 12 1 1 A 77 77 GLN CA C 77 57.790 58.315 -0.525 1
1 893 . 12 1 1 A 77 77 GLN CB C 77 28.536 29.031 -0.495 1
1 895 . 12 1 1 A 77 77 GLN N N 77 115.764 116.622 -0.858 1
1 897 . 12 1 1 A 78 78 VAL H H 78 7.430 7.798 -0.368 1
1 898 . 12 1 1 A 78 78 VAL HA H 78 3.241 3.525 -0.284 1
1 906 . 12 1 1 A 78 78 VAL C C 78 177.042 177.885 -0.843 1
1 907 . 12 1 1 A 78 78 VAL CA C 78 67.299 66.189 1.110 1
1 908 . 12 1 1 A 78 78 VAL CB C 78 30.819 31.628 -0.809 1
1 911 . 12 1 1 A 78 78 VAL N N 78 121.143 120.816 0.327 1
1 912 . 12 1 1 A 79 79 VAL H H 79 7.773 8.018 -0.245 1
1 913 . 12 1 1 A 79 79 VAL HA H 79 3.315 3.549 -0.234 1
1 921 . 12 1 1 A 79 79 VAL C C 79 179.179 177.864 1.315 1
1 922 . 12 1 1 A 79 79 VAL CA C 79 66.694 65.077 1.617 1
1 923 . 12 1 1 A 79 79 VAL CB C 79 31.841 31.347 0.494 1
1 926 . 12 1 1 A 79 79 VAL N N 79 117.473 119.496 -2.023 1
1 927 . 12 1 1 A 80 80 GLU H H 80 7.410 7.955 -0.545 1
1 928 . 12 1 1 A 80 80 GLU HA H 80 4.258 4.001 0.257 1
1 933 . 12 1 1 A 80 80 GLU C C 80 178.018 178.613 -0.595 1
1 934 . 12 1 1 A 80 80 GLU CA C 80 58.566 59.276 -0.710 1
1 935 . 12 1 1 A 80 80 GLU CB C 80 29.072 29.513 -0.441 1
1 937 . 12 1 1 A 80 80 GLU N N 80 120.451 120.868 -0.417 1
1 938 . 12 1 1 A 81 81 LEU H H 81 8.070 7.996 0.074 1
1 939 . 12 1 1 A 81 81 LEU HA H 81 3.976 4.003 -0.027 1
1 949 . 12 1 1 A 81 81 LEU C C 81 180.658 178.763 1.895 1
1 950 . 12 1 1 A 81 81 LEU CA C 81 58.061 58.135 -0.074 1
1 951 . 12 1 1 A 81 81 LEU CB C 81 42.115 41.736 0.379 1
1 955 . 12 1 1 A 81 81 LEU N N 81 119.943 119.977 -0.034 1
1 956 . 12 1 1 A 82 82 VAL H H 82 7.609 8.140 -0.531 1
1 957 . 12 1 1 A 82 82 VAL HA H 82 3.474 3.674 -0.200 1
1 965 . 12 1 1 A 82 82 VAL C C 82 178.927 178.338 0.589 1
1 966 . 12 1 1 A 82 82 VAL CA C 82 67.398 66.547 0.851 1
1 967 . 12 1 1 A 82 82 VAL CB C 82 31.306 31.338 -0.032 1
1 970 . 12 1 1 A 82 82 VAL N N 82 118.150 120.179 -2.029 1
1 971 . 12 1 1 A 83 83 ARG H H 83 8.186 8.088 0.098 1
1 972 . 12 1 1 A 83 83 ARG HA H 83 3.994 4.145 -0.151 1
1 979 . 12 1 1 A 83 83 ARG C C 83 179.999 179.041 0.958 1
1 980 . 12 1 1 A 83 83 ARG CA C 83 60.205 58.979 1.226 1
1 981 . 12 1 1 A 83 83 ARG CB C 83 30.103 30.650 -0.547 1
1 984 . 12 1 1 A 83 83 ARG N N 83 122.902 120.558 2.344 1
1 985 . 12 1 1 A 84 84 LYS H H 84 8.772 8.228 0.544 1
1 986 . 12 1 1 A 84 84 LYS HA H 84 4.047 4.116 -0.069 1
1 995 . 12 1 1 A 84 84 LYS C C 84 176.934 178.351 -1.417 1
1 996 . 12 1 1 A 84 84 LYS CA C 84 58.142 58.832 -0.690 1
1 997 . 12 1 1 A 84 84 LYS CB C 84 32.492 31.291 1.201 1
1 1001 . 12 1 1 A 84 84 LYS N N 84 117.548 119.093 -1.545 1
1 1002 . 12 1 1 A 85 85 SER H H 85 7.333 7.770 -0.437 1
1 1003 . 12 1 1 A 85 85 SER HA H 85 4.235 4.250 -0.015 1
1 1006 . 12 1 1 A 85 85 SER C C 85 175.588 174.847 0.741 1
1 1007 . 12 1 1 A 85 85 SER CA C 85 59.535 60.676 -1.141 1
1 1008 . 12 1 1 A 85 85 SER CB C 85 63.571 63.511 0.060 1
1 1009 . 12 1 1 A 85 85 SER N N 85 113.544 112.837 0.707 1
1 1010 . 12 1 1 A 86 86 GLY H H 86 7.459 7.828 -0.369 1
1 1011 . 12 1 1 A 86 86 GLY HA2 H 86 4.176 4.097 0.079 1
1 1012 . 12 1 1 A 86 86 GLY HA3 H 86 3.762 4.105 -0.343 1
1 1013 . 12 1 1 A 86 86 GLY C C 86 176.407 174.901 1.506 1
1 1014 . 12 1 1 A 86 86 GLY CA C 86 46.109 45.558 0.551 1
1 1015 . 12 1 1 A 86 86 GLY N N 86 104.331 109.131 -4.800 1
1 1016 . 12 1 1 A 87 87 ASN HA H 87 4.650 4.822 -0.172 1
1 1021 . 12 1 1 A 87 87 ASN C C 87 173.653 175.366 -1.713 1
1 1022 . 12 1 1 A 87 87 ASN CA C 87 54.492 53.914 0.578 1
1 1023 . 12 1 1 A 87 87 ASN CB C 87 38.425 40.735 -2.310 1
1 1024 . 12 1 1 A 87 87 ASN N N 87 118.401 124.883 -6.482 1
1 1026 . 12 1 1 A 88 88 SER H H 88 7.435 8.283 -0.848 1
1 1027 . 12 1 1 A 88 88 SER HA H 88 5.438 5.381 0.057 1
1 1030 . 12 1 1 A 88 88 SER C C 88 172.867 173.517 -0.650 1
1 1031 . 12 1 1 A 88 88 SER CA C 88 58.160 56.167 1.993 1
1 1032 . 12 1 1 A 88 88 SER CB C 88 65.861 66.626 -0.765 1
1 1033 . 12 1 1 A 88 88 SER N N 88 113.765 111.422 2.343 1
1 1034 . 12 1 1 A 89 89 VAL H H 89 8.452 8.249 0.203 1
1 1035 . 12 1 1 A 89 89 VAL HA H 89 4.519 4.754 -0.235 1
1 1043 . 12 1 1 A 89 89 VAL C C 89 171.391 174.402 -3.011 1
1 1044 . 12 1 1 A 89 89 VAL CA C 89 61.333 60.898 0.435 1
1 1045 . 12 1 1 A 89 89 VAL CB C 89 33.897 35.678 -1.781 1
1 1048 . 12 1 1 A 89 89 VAL N N 89 120.001 120.842 -0.841 1
1 1049 . 12 1 1 A 90 90 THR H H 90 8.348 8.850 -0.502 1
1 1050 . 12 1 1 A 90 90 THR HA H 90 5.042 4.809 0.233 1
1 1055 . 12 1 1 A 90 90 THR C C 90 173.926 173.703 0.223 1
1 1056 . 12 1 1 A 90 90 THR CA C 90 61.403 62.008 -0.605 1
1 1057 . 12 1 1 A 90 90 THR CB C 90 69.553 69.435 0.118 1
1 1059 . 12 1 1 A 90 90 THR N N 90 123.477 123.657 -0.180 1
1 1060 . 12 1 1 A 91 91 LEU H H 91 9.195 8.748 0.447 1
1 1061 . 12 1 1 A 91 91 LEU HA H 91 5.161 5.223 -0.062 1
1 1071 . 12 1 1 A 91 91 LEU C C 91 174.564 176.155 -1.591 1
1 1072 . 12 1 1 A 91 91 LEU CA C 91 52.590 53.671 -1.081 1
1 1073 . 12 1 1 A 91 91 LEU CB C 91 44.998 45.013 -0.015 1
1 1077 . 12 1 1 A 91 91 LEU N N 91 128.419 127.741 0.678 1
1 1078 . 12 1 1 A 92 92 LEU H H 92 8.644 8.454 0.190 1
1 1079 . 12 1 1 A 92 92 LEU HA H 92 5.335 5.038 0.297 1
1 1089 . 12 1 1 A 92 92 LEU C C 92 176.451 175.437 1.014 1
1 1090 . 12 1 1 A 92 92 LEU CA C 92 54.220 53.790 0.430 1
1 1091 . 12 1 1 A 92 92 LEU CB C 92 44.323 43.449 0.874 1
1 1095 . 12 1 1 A 92 92 LEU N N 92 125.894 122.869 3.025 1
1 1096 . 12 1 1 A 93 93 VAL H H 93 9.249 8.828 0.421 1
1 1097 . 12 1 1 A 93 93 VAL HA H 93 5.573 5.452 0.121 1
1 1105 . 12 1 1 A 93 93 VAL C C 93 173.550 174.227 -0.677 1
1 1106 . 12 1 1 A 93 93 VAL CA C 93 58.340 60.025 -1.685 1
1 1107 . 12 1 1 A 93 93 VAL CB C 93 36.159 34.002 2.157 1
1 1110 . 12 1 1 A 93 93 VAL N N 93 120.660 120.006 0.654 1
1 1111 . 12 1 1 A 94 94 LEU H H 94 8.634 8.534 0.100 1
1 1112 . 12 1 1 A 94 94 LEU HA H 94 4.911 5.229 -0.318 1
1 1122 . 12 1 1 A 94 94 LEU C C 94 174.172 175.442 -1.270 1
1 1123 . 12 1 1 A 94 94 LEU CA C 94 52.659 53.389 -0.730 1
1 1124 . 12 1 1 A 94 94 LEU CB C 94 47.910 46.266 1.644 1
1 1128 . 12 1 1 A 94 94 LEU N N 94 120.304 126.493 -6.189 1
1 1129 . 12 1 1 A 95 95 ASP H H 95 8.210 8.854 -0.644 1
1 1130 . 12 1 1 A 95 95 ASP HA H 95 5.190 4.627 0.563 1
1 1133 . 12 1 1 A 95 95 ASP C C 95 175.887 177.742 -1.855 1
1 1134 . 12 1 1 A 95 95 ASP CA C 95 53.899 55.130 -1.231 1
1 1135 . 12 1 1 A 95 95 ASP CB C 95 41.188 41.248 -0.060 1
1 1136 . 12 1 1 A 95 95 ASP N N 95 122.184 123.959 -1.775 1
1 1137 . 12 1 1 A 96 96 GLY H H 96 8.478 8.901 -0.423 1
1 1138 . 12 1 1 A 96 96 GLY HA2 H 96 4.002 3.852 0.150 1
1 1139 . 12 1 1 A 96 96 GLY HA3 H 96 3.757 3.864 -0.107 1
1 1140 . 12 1 1 A 96 96 GLY C C 96 175.497 175.423 0.074 1
1 1141 . 12 1 1 A 96 96 GLY CA C 96 49.944 47.477 2.467 1
1 1142 . 12 1 1 A 96 96 GLY N N 96 108.610 111.033 -2.423 1
1 1143 . 12 1 1 A 97 97 ASP H H 97 8.401 8.200 0.201 1
1 1144 . 12 1 1 A 97 97 ASP HA H 97 4.454 4.356 0.098 1
1 1147 . 12 1 1 A 97 97 ASP C C 97 179.612 178.830 0.782 1
1 1148 . 12 1 1 A 97 97 ASP CA C 97 57.913 57.368 0.545 1
1 1149 . 12 1 1 A 97 97 ASP CB C 97 41.145 40.315 0.830 1
1 1150 . 12 1 1 A 97 97 ASP N N 97 120.034 121.540 -1.506 1
1 1151 . 12 1 1 A 98 98 SER H H 98 8.152 8.058 0.094 1
1 1152 . 12 1 1 A 98 98 SER HA H 98 4.218 4.349 -0.131 1
1 1155 . 12 1 1 A 98 98 SER C C 98 175.061 176.501 -1.440 1
1 1156 . 12 1 1 A 98 98 SER CA C 98 62.180 61.265 0.915 1
1 1157 . 12 1 1 A 98 98 SER CB C 98 62.179 63.190 -1.011 1
1 1158 . 12 1 1 A 98 98 SER N N 98 117.174 114.002 3.172 1
1 1159 . 12 1 1 A 99 99 TYR H H 99 9.051 8.611 0.440 1
1 1160 . 12 1 1 A 99 99 TYR HA H 99 3.692 3.885 -0.193 1
1 1167 . 12 1 1 A 99 99 TYR C C 99 176.460 177.015 -0.555 1
1 1168 . 12 1 1 A 99 99 TYR CA C 99 62.814 61.811 1.003 1
1 1169 . 12 1 1 A 99 99 TYR CB C 99 38.829 38.912 -0.083 1
1 1174 . 12 1 1 A 99 99 TYR N N 99 123.539 123.560 -0.021 1
1 1175 . 12 1 1 A 100 100 GLU H H 100 8.520 8.426 0.094 1
1 1176 . 12 1 1 A 100 100 GLU HA H 100 3.952 4.055 -0.103 1
1 1181 . 12 1 1 A 100 100 GLU C C 100 180.151 179.278 0.873 1
1 1182 . 12 1 1 A 100 100 GLU CA C 100 60.099 60.026 0.073 1
1 1183 . 12 1 1 A 100 100 GLU CB C 100 29.435 29.253 0.182 1
1 1185 . 12 1 1 A 100 100 GLU N N 100 117.082 118.623 -1.541 1
1 1186 . 12 1 1 A 101 101 LYS H H 101 7.740 7.970 -0.230 1
1 1187 . 12 1 1 A 101 101 LYS HA H 101 3.984 4.072 -0.088 1
1 1196 . 12 1 1 A 101 101 LYS C C 101 178.377 178.324 0.053 1
1 1197 . 12 1 1 A 101 101 LYS CA C 101 59.888 59.524 0.364 1
1 1198 . 12 1 1 A 101 101 LYS CB C 101 32.821 32.554 0.267 1
1 1202 . 12 1 1 A 101 101 LYS N N 101 119.851 121.083 -1.232 1
1 1203 . 12 1 1 A 102 102 ALA H H 102 8.538 7.912 0.626 1
1 1204 . 12 1 1 A 102 102 ALA HA H 102 3.632 4.067 -0.435 1
1 1208 . 12 1 1 A 102 102 ALA C C 102 179.870 180.043 -0.173 1
1 1209 . 12 1 1 A 102 102 ALA CA C 102 55.285 54.984 0.301 1
1 1210 . 12 1 1 A 102 102 ALA CB C 102 17.163 17.899 -0.736 1
1 1211 . 12 1 1 A 102 102 ALA N N 102 124.176 120.787 3.389 1
1 1212 . 12 1 1 A 103 103 VAL H H 103 8.147 7.747 0.400 1
1 1213 . 12 1 1 A 103 103 VAL HA H 103 3.658 3.546 0.112 1
1 1221 . 12 1 1 A 103 103 VAL C C 103 181.113 178.016 3.097 1
1 1222 . 12 1 1 A 103 103 VAL CA C 103 66.090 67.099 -1.009 1
1 1223 . 12 1 1 A 103 103 VAL CB C 103 31.822 31.594 0.228 1
1 1226 . 12 1 1 A 103 103 VAL N N 103 117.841 117.968 -0.127 1
1 1227 . 12 1 1 A 104 104 LYS H H 104 7.903 8.300 -0.397 1
1 1228 . 12 1 1 A 104 104 LYS HA H 104 4.065 3.924 0.141 1
1 1235 . 12 1 1 A 104 104 LYS C C 104 177.715 178.600 -0.885 1
1 1236 . 12 1 1 A 104 104 LYS CA C 104 59.094 60.236 -1.142 1
1 1237 . 12 1 1 A 104 104 LYS CB C 104 32.285 32.565 -0.280 1
1 1241 . 12 1 1 A 104 104 LYS N N 104 121.515 119.046 2.469 1
1 1242 . 12 1 1 A 105 105 ASN H H 105 7.747 7.902 -0.155 1
1 1243 . 12 1 1 A 105 105 ASN HA H 105 4.721 4.863 -0.142 1
1 1248 . 12 1 1 A 105 105 ASN C C 105 173.320 173.973 -0.653 1
1 1249 . 12 1 1 A 105 105 ASN CA C 105 53.399 53.018 0.381 1
1 1250 . 12 1 1 A 105 105 ASN CB C 105 39.249 38.487 0.762 1
1 1251 . 12 1 1 A 105 105 ASN N N 105 114.941 114.925 0.016 1
1 1253 . 12 1 1 A 106 106 GLN H H 106 7.850 8.192 -0.342 1
1 1254 . 12 1 1 A 106 106 GLN HA H 106 3.902 3.872 0.030 1
1 1261 . 12 1 1 A 106 106 GLN C C 106 175.168 174.897 0.271 1
1 1262 . 12 1 1 A 106 106 GLN CA C 106 56.978 56.841 0.137 1
1 1263 . 12 1 1 A 106 106 GLN CB C 106 25.770 26.462 -0.692 1
1 1265 . 12 1 1 A 106 106 GLN N N 106 114.989 115.772 -0.783 1
1 1267 . 12 1 1 A 107 107 VAL H H 107 8.005 7.749 0.256 1
1 1268 . 12 1 1 A 107 107 VAL HA H 107 3.664 4.027 -0.363 1
1 1276 . 12 1 1 A 107 107 VAL C C 107 175.468 175.080 0.388 1
1 1277 . 12 1 1 A 107 107 VAL CA C 107 62.726 61.918 0.808 1
1 1278 . 12 1 1 A 107 107 VAL CB C 107 32.535 32.070 0.465 1
1 1281 . 12 1 1 A 107 107 VAL N N 107 120.216 120.162 0.054 1
1 1282 . 12 1 1 A 108 108 ASP H H 108 8.484 8.686 -0.202 1
1 1283 . 12 1 1 A 108 108 ASP HA H 108 4.467 4.483 -0.016 1
1 1286 . 12 1 1 A 108 108 ASP C C 108 177.179 176.198 0.981 1
1 1287 . 12 1 1 A 108 108 ASP CA C 108 53.417 55.188 -1.771 1
1 1288 . 12 1 1 A 108 108 ASP CB C 108 40.030 40.954 -0.924 1
1 1289 . 12 1 1 A 108 108 ASP N N 108 125.414 128.413 -2.999 1
1 1290 . 12 1 1 A 109 109 LEU H H 109 8.470 8.350 0.120 1
1 1291 . 12 1 1 A 109 109 LEU HA H 109 3.846 4.247 -0.401 1
1 1301 . 12 1 1 A 109 109 LEU C C 109 178.145 178.105 0.040 1
1 1302 . 12 1 1 A 109 109 LEU CA C 109 56.573 54.971 1.602 1
1 1303 . 12 1 1 A 109 109 LEU CB C 109 42.011 42.157 -0.146 1
1 1307 . 12 1 1 A 109 109 LEU N N 109 127.577 124.652 2.925 1
1 1308 . 12 1 1 A 110 110 LYS H H 110 8.062 7.930 0.132 1
1 1309 . 12 1 1 A 110 110 LYS HA H 110 3.022 3.253 -0.231 1
1 1317 . 12 1 1 A 110 110 LYS C C 110 177.248 179.593 -2.345 1
1 1318 . 12 1 1 A 110 110 LYS CA C 110 58.742 59.248 -0.506 1
1 1319 . 12 1 1 A 110 110 LYS CB C 110 31.667 31.459 0.208 1
1 1323 . 12 1 1 A 110 110 LYS N N 110 118.873 120.111 -1.238 1
1 1324 . 12 1 1 A 111 111 GLU H H 111 7.113 7.878 -0.765 1
1 1325 . 12 1 1 A 111 111 GLU HA H 111 4.117 4.117 0.000 1
1 1330 . 12 1 1 A 111 111 GLU C C 111 176.519 177.663 -1.144 1
1 1331 . 12 1 1 A 111 111 GLU CA C 111 55.621 58.967 -3.346 1
1 1332 . 12 1 1 A 111 111 GLU CB C 111 29.943 29.537 0.406 1
1 1334 . 12 1 1 A 111 111 GLU N N 111 114.282 119.381 -5.099 1
1 1335 . 12 1 1 A 112 112 LEU H H 112 6.848 7.534 -0.686 1
1 1336 . 12 1 1 A 112 112 LEU HA H 112 4.293 4.201 0.092 1
1 1346 . 12 1 1 A 112 112 LEU C C 112 175.674 176.002 -0.328 1
1 1347 . 12 1 1 A 112 112 LEU CA C 112 55.197 56.132 -0.935 1
1 1348 . 12 1 1 A 112 112 LEU CB C 112 41.681 41.950 -0.269 1
1 1352 . 12 1 1 A 112 112 LEU N N 112 118.934 121.828 -2.894 1
1 1353 . 12 1 1 A 113 113 ASP H H 113 8.466 8.761 -0.295 1
1 1354 . 12 1 1 A 113 113 ASP HA H 113 4.593 4.989 -0.396 1
1 1357 . 12 1 1 A 113 113 ASP C C 113 174.511 175.750 -1.239 1
1 1358 . 12 1 1 A 113 113 ASP CA C 113 53.558 52.696 0.862 1
1 1359 . 12 1 1 A 113 113 ASP CB C 113 42.448 41.798 0.650 1
1 1360 . 12 1 1 A 113 113 ASP N N 113 122.148 125.933 -3.785 1
1 1 . 13 1 1 A 6 6 SER HA H 6 4.483 3.953 0.530 1
1 4 . 13 1 1 A 6 6 SER C C 6 175.167 173.787 1.380 1
1 5 . 13 1 1 A 6 6 SER CA C 6 58.759 59.156 -0.397 1
1 6 . 13 1 1 A 6 6 SER CB C 6 64.069 61.959 2.110 1
1 7 . 13 1 1 A 7 7 GLY H H 7 8.431 8.001 0.430 1
1 8 . 13 1 1 A 7 7 GLY HA2 H 7 3.973 3.854 0.119 1
1 9 . 13 1 1 A 7 7 GLY HA3 H 7 3.973 3.855 0.118 1
1 10 . 13 1 1 A 7 7 GLY C C 7 174.570 175.005 -0.435 1
1 11 . 13 1 1 A 7 7 GLY CA C 7 45.483 45.969 -0.486 1
1 12 . 13 1 1 A 7 7 GLY N N 7 110.640 107.788 2.852 1
1 13 . 13 1 1 A 8 8 MET H H 8 8.239 8.030 0.209 1
1 14 . 13 1 1 A 8 8 MET HA H 8 4.386 4.554 -0.168 1
1 22 . 13 1 1 A 8 8 MET C C 8 176.621 176.056 0.565 1
1 23 . 13 1 1 A 8 8 MET CA C 8 55.991 56.576 -0.585 1
1 24 . 13 1 1 A 8 8 MET CB C 8 32.986 34.716 -1.730 1
1 27 . 13 1 1 A 8 8 MET N N 8 120.219 122.243 -2.024 1
1 28 . 13 1 1 A 9 9 ALA H H 9 8.435 7.841 0.594 1
1 29 . 13 1 1 A 9 9 ALA HA H 9 4.182 4.479 -0.297 1
1 33 . 13 1 1 A 9 9 ALA C C 9 177.951 176.058 1.893 1
1 34 . 13 1 1 A 9 9 ALA CA C 9 53.399 51.104 2.295 1
1 35 . 13 1 1 A 9 9 ALA CB C 9 18.955 18.791 0.164 1
1 36 . 13 1 1 A 9 9 ALA N N 9 124.459 121.926 2.533 1
1 37 . 13 1 1 A 10 10 SER H H 10 8.100 8.551 -0.451 1
1 38 . 13 1 1 A 10 10 SER HA H 10 4.391 4.335 0.056 1
1 41 . 13 1 1 A 10 10 SER C C 10 174.467 174.194 0.273 1
1 42 . 13 1 1 A 10 10 SER CA C 10 58.709 58.909 -0.200 1
1 43 . 13 1 1 A 10 10 SER CB C 10 63.778 62.558 1.220 1
1 44 . 13 1 1 A 10 10 SER N N 10 113.881 119.433 -5.552 1
1 45 . 13 1 1 A 11 11 THR H H 11 7.821 7.875 -0.054 1
1 46 . 13 1 1 A 11 11 THR HA H 11 4.191 4.495 -0.304 1
1 51 . 13 1 1 A 11 11 THR C C 11 173.610 174.593 -0.983 1
1 52 . 13 1 1 A 11 11 THR CA C 11 61.936 61.978 -0.042 1
1 53 . 13 1 1 A 11 11 THR CB C 11 69.713 68.885 0.828 1
1 55 . 13 1 1 A 11 11 THR N N 11 114.471 117.781 -3.310 1
1 56 . 13 1 1 A 12 12 PHE H H 12 7.946 9.233 -1.287 1
1 57 . 13 1 1 A 12 12 PHE HA H 12 4.769 4.757 0.012 1
1 65 . 13 1 1 A 12 12 PHE C C 12 174.211 175.419 -1.208 1
1 66 . 13 1 1 A 12 12 PHE CA C 12 56.644 58.077 -1.433 1
1 67 . 13 1 1 A 12 12 PHE CB C 12 40.609 39.823 0.786 1
1 73 . 13 1 1 A 12 12 PHE N N 12 120.763 126.519 -5.756 1
1 74 . 13 1 1 A 13 13 ASN H H 13 9.004 8.849 0.155 1
1 75 . 13 1 1 A 13 13 ASN HA H 13 5.366 5.462 -0.096 1
1 80 . 13 1 1 A 13 13 ASN C C 13 172.158 173.674 -1.516 1
1 81 . 13 1 1 A 13 13 ASN CA C 13 50.988 49.588 1.400 1
1 82 . 13 1 1 A 13 13 ASN CB C 13 39.942 39.874 0.068 1
1 83 . 13 1 1 A 13 13 ASN N N 13 119.973 120.902 -0.929 1
1 85 . 13 1 1 A 14 14 PRO HA H 14 4.945 4.626 0.319 1
1 92 . 13 1 1 A 14 14 PRO C C 14 174.901 175.891 -0.990 1
1 93 . 13 1 1 A 14 14 PRO CA C 14 63.096 62.473 0.623 1
1 94 . 13 1 1 A 14 14 PRO CB C 14 32.739 32.598 0.141 1
1 97 . 13 1 1 A 15 15 ARG H H 15 8.908 8.465 0.443 1
1 98 . 13 1 1 A 15 15 ARG HA H 15 4.626 4.756 -0.130 1
1 106 . 13 1 1 A 15 15 ARG C C 15 174.432 174.480 -0.048 1
1 107 . 13 1 1 A 15 15 ARG CA C 15 54.827 55.366 -0.539 1
1 108 . 13 1 1 A 15 15 ARG CB C 15 32.439 31.852 0.587 1
1 111 . 13 1 1 A 15 15 ARG N N 15 118.947 121.371 -2.424 1
1 113 . 13 1 1 A 16 16 GLU H H 16 8.838 8.741 0.097 1
1 114 . 13 1 1 A 16 16 GLU HA H 16 4.876 5.051 -0.175 1
1 119 . 13 1 1 A 16 16 GLU C C 16 175.767 175.243 0.524 1
1 120 . 13 1 1 A 16 16 GLU CA C 16 55.621 55.105 0.516 1
1 121 . 13 1 1 A 16 16 GLU CB C 16 31.093 31.693 -0.600 1
1 123 . 13 1 1 A 16 16 GLU N N 16 125.316 126.267 -0.951 1
1 124 . 13 1 1 A 17 17 CYS H H 17 9.327 8.849 0.478 1
1 125 . 13 1 1 A 17 17 CYS HA H 17 4.804 5.367 -0.563 1
1 128 . 13 1 1 A 17 17 CYS C C 17 172.973 173.168 -0.195 1
1 129 . 13 1 1 A 17 17 CYS CA C 17 57.930 57.189 0.741 1
1 130 . 13 1 1 A 17 17 CYS CB C 17 30.105 31.077 -0.972 1
1 131 . 13 1 1 A 17 17 CYS N N 17 127.909 125.040 2.869 1
1 132 . 13 1 1 A 18 18 LYS H H 18 9.022 8.894 0.128 1
1 133 . 13 1 1 A 18 18 LYS HA H 18 4.769 5.156 -0.387 1
1 142 . 13 1 1 A 18 18 LYS C C 18 174.586 175.299 -0.713 1
1 143 . 13 1 1 A 18 18 LYS CA C 18 55.956 54.825 1.131 1
1 144 . 13 1 1 A 18 18 LYS CB C 18 32.203 34.771 -2.568 1
1 148 . 13 1 1 A 18 18 LYS N N 18 127.039 124.476 2.563 1
1 149 . 13 1 1 A 19 19 LEU H H 19 8.784 9.285 -0.501 1
1 150 . 13 1 1 A 19 19 LEU HA H 19 4.852 5.132 -0.280 1
1 160 . 13 1 1 A 19 19 LEU C C 19 176.862 175.610 1.252 1
1 161 . 13 1 1 A 19 19 LEU CA C 19 55.391 53.429 1.962 1
1 162 . 13 1 1 A 19 19 LEU CB C 19 44.442 42.585 1.857 1
1 166 . 13 1 1 A 19 19 LEU N N 19 126.311 126.663 -0.352 1
1 167 . 13 1 1 A 20 20 SER H H 20 8.215 9.079 -0.864 1
1 168 . 13 1 1 A 20 20 SER HA H 20 5.461 5.891 -0.430 1
1 171 . 13 1 1 A 20 20 SER C C 20 171.960 173.481 -1.521 1
1 172 . 13 1 1 A 20 20 SER CA C 20 57.525 56.838 0.687 1
1 173 . 13 1 1 A 20 20 SER CB C 20 65.794 65.449 0.345 1
1 174 . 13 1 1 A 20 20 SER N N 20 115.113 119.511 -4.398 1
1 175 . 13 1 1 A 21 21 LYS H H 21 9.001 8.330 0.671 1
1 176 . 13 1 1 A 21 21 LYS HA H 21 4.887 4.803 0.084 1
1 185 . 13 1 1 A 21 21 LYS C C 21 174.133 175.779 -1.646 1
1 186 . 13 1 1 A 21 21 LYS CA C 21 53.840 54.434 -0.594 1
1 187 . 13 1 1 A 21 21 LYS CB C 21 36.553 33.773 2.780 1
1 191 . 13 1 1 A 21 21 LYS N N 21 120.938 122.779 -1.841 1
1 192 . 13 1 1 A 22 22 GLN H H 22 8.201 8.514 -0.313 1
1 193 . 13 1 1 A 22 22 GLN HA H 22 4.448 4.720 -0.272 1
1 200 . 13 1 1 A 22 22 GLN C C 22 176.372 175.473 0.899 1
1 201 . 13 1 1 A 22 22 GLN CA C 22 53.658 54.140 -0.482 1
1 202 . 13 1 1 A 22 22 GLN CB C 22 30.473 31.312 -0.839 1
1 204 . 13 1 1 A 22 22 GLN N N 22 116.816 118.327 -1.511 1
1 206 . 13 1 1 A 23 23 GLU H H 23 8.624 8.678 -0.054 1
1 207 . 13 1 1 A 23 23 GLU HA H 23 4.056 3.921 0.135 1
1 212 . 13 1 1 A 23 23 GLU C C 23 177.778 177.282 0.496 1
1 213 . 13 1 1 A 23 23 GLU CA C 23 58.001 58.341 -0.340 1
1 214 . 13 1 1 A 23 23 GLU CB C 23 29.237 29.268 -0.031 1
1 216 . 13 1 1 A 23 23 GLU N N 23 122.364 122.901 -0.537 1
1 217 . 13 1 1 A 24 24 GLY H H 24 8.962 8.768 0.194 1
1 218 . 13 1 1 A 24 24 GLY HA2 H 24 4.139 3.927 0.212 1
1 219 . 13 1 1 A 24 24 GLY HA3 H 24 3.711 3.933 -0.222 1
1 220 . 13 1 1 A 24 24 GLY C C 24 173.857 173.525 0.332 1
1 221 . 13 1 1 A 24 24 GLY CA C 24 45.288 45.549 -0.261 1
1 222 . 13 1 1 A 24 24 GLY N N 24 113.942 114.733 -0.791 1
1 223 . 13 1 1 A 25 25 GLN H H 25 7.643 7.871 -0.228 1
1 224 . 13 1 1 A 25 25 GLN HA H 25 4.488 4.666 -0.178 1
1 231 . 13 1 1 A 25 25 GLN C C 25 174.727 173.750 0.977 1
1 232 . 13 1 1 A 25 25 GLN CA C 25 54.052 53.946 0.106 1
1 233 . 13 1 1 A 25 25 GLN CB C 25 30.843 31.699 -0.856 1
1 235 . 13 1 1 A 25 25 GLN N N 25 119.538 119.858 -0.320 1
1 237 . 13 1 1 A 26 26 ASN H H 26 8.625 8.767 -0.142 1
1 238 . 13 1 1 A 26 26 ASN HA H 26 4.862 4.915 -0.053 1
1 243 . 13 1 1 A 26 26 ASN C C 26 176.261 175.343 0.918 1
1 244 . 13 1 1 A 26 26 ASN CA C 26 51.812 51.900 -0.088 1
1 245 . 13 1 1 A 26 26 ASN CB C 26 40.403 40.225 0.178 1
1 246 . 13 1 1 A 26 26 ASN N N 26 120.047 122.773 -2.726 1
1 248 . 13 1 1 A 27 27 TYR HA H 27 4.152 4.548 -0.396 1
1 255 . 13 1 1 A 27 27 TYR C C 27 176.731 175.893 0.838 1
1 256 . 13 1 1 A 27 27 TYR CA C 27 62.462 59.481 2.981 1
1 257 . 13 1 1 A 27 27 TYR CB C 27 40.240 39.114 1.126 1
1 262 . 13 1 1 A 27 27 TYR N N 27 121.761 123.201 -1.440 1
1 263 . 13 1 1 A 28 28 GLY H H 28 8.285 8.051 0.234 1
1 264 . 13 1 1 A 28 28 GLY HA2 H 28 4.490 3.968 0.522 1
1 265 . 13 1 1 A 28 28 GLY HA3 H 28 3.759 4.028 -0.269 1
1 266 . 13 1 1 A 28 28 GLY C C 28 172.198 173.941 -1.743 1
1 267 . 13 1 1 A 28 28 GLY CA C 28 46.139 45.220 0.919 1
1 268 . 13 1 1 A 28 28 GLY N N 28 103.567 107.414 -3.847 1
1 269 . 13 1 1 A 29 29 PHE H H 29 6.878 8.005 -1.127 1
1 270 . 13 1 1 A 29 29 PHE HA H 29 5.179 4.999 0.180 1
1 278 . 13 1 1 A 29 29 PHE C C 29 172.840 173.531 -0.691 1
1 279 . 13 1 1 A 29 29 PHE CA C 29 55.262 55.290 -0.028 1
1 280 . 13 1 1 A 29 29 PHE CB C 29 41.779 42.215 -0.436 1
1 286 . 13 1 1 A 29 29 PHE N N 29 111.027 117.458 -6.431 1
1 287 . 13 1 1 A 30 30 PHE H H 30 8.806 8.580 0.226 1
1 288 . 13 1 1 A 30 30 PHE HA H 30 4.923 4.615 0.308 1
1 296 . 13 1 1 A 30 30 PHE C C 30 174.501 175.165 -0.664 1
1 297 . 13 1 1 A 30 30 PHE CA C 30 55.356 55.986 -0.630 1
1 298 . 13 1 1 A 30 30 PHE CB C 30 41.681 42.102 -0.421 1
1 304 . 13 1 1 A 30 30 PHE N N 30 118.710 118.550 0.160 1
1 305 . 13 1 1 A 31 31 LEU H H 31 8.441 8.696 -0.255 1
1 306 . 13 1 1 A 31 31 LEU HA H 31 5.447 4.756 0.691 1
1 316 . 13 1 1 A 31 31 LEU C C 31 177.306 175.787 1.519 1
1 317 . 13 1 1 A 31 31 LEU CA C 31 53.610 54.429 -0.819 1
1 318 . 13 1 1 A 31 31 LEU CB C 31 43.696 40.676 3.020 1
1 322 . 13 1 1 A 31 31 LEU N N 31 123.765 124.533 -0.768 1
1 323 . 13 1 1 A 32 32 ARG H H 32 9.381 8.529 0.852 1
1 324 . 13 1 1 A 32 32 ARG HA H 32 4.840 4.668 0.172 1
1 331 . 13 1 1 A 32 32 ARG C C 32 175.155 175.746 -0.591 1
1 332 . 13 1 1 A 32 32 ARG CA C 32 54.210 53.913 0.297 1
1 333 . 13 1 1 A 32 32 ARG CB C 32 35.087 33.404 1.683 1
1 336 . 13 1 1 A 32 32 ARG N N 32 123.160 124.340 -1.180 1
1 337 . 13 1 1 A 33 33 ILE H H 33 7.891 8.572 -0.681 1
1 338 . 13 1 1 A 33 33 ILE HA H 33 4.495 4.777 -0.282 1
1 348 . 13 1 1 A 33 33 ILE C C 33 175.850 173.738 2.112 1
1 349 . 13 1 1 A 33 33 ILE CA C 33 59.641 58.869 0.772 1
1 350 . 13 1 1 A 33 33 ILE CB C 33 39.538 41.140 -1.602 1
1 354 . 13 1 1 A 33 33 ILE N N 33 118.924 117.903 1.021 1
1 355 . 13 1 1 A 34 34 GLU H H 34 8.971 8.632 0.339 1
1 356 . 13 1 1 A 34 34 GLU HA H 34 4.578 5.015 -0.437 1
1 361 . 13 1 1 A 34 34 GLU C C 34 175.766 176.085 -0.319 1
1 362 . 13 1 1 A 34 34 GLU CA C 34 54.263 54.837 -0.574 1
1 363 . 13 1 1 A 34 34 GLU CB C 34 32.128 32.745 -0.617 1
1 365 . 13 1 1 A 34 34 GLU N N 34 125.447 123.583 1.864 1
1 366 . 13 1 1 A 35 35 LYS H H 35 8.504 8.437 0.067 1
1 367 . 13 1 1 A 35 35 LYS HA H 35 4.026 4.118 -0.092 1
1 376 . 13 1 1 A 35 35 LYS C C 35 177.701 175.755 1.946 1
1 377 . 13 1 1 A 35 35 LYS CA C 35 57.591 56.924 0.667 1
1 378 . 13 1 1 A 35 35 LYS CB C 35 32.491 32.698 -0.207 1
1 382 . 13 1 1 A 35 35 LYS N N 35 122.893 124.077 -1.184 1
1 383 . 13 1 1 A 36 36 ASP H H 36 9.020 8.964 0.056 1
1 384 . 13 1 1 A 36 36 ASP HA H 36 4.385 4.109 0.276 1
1 387 . 13 1 1 A 36 36 ASP C C 36 174.554 174.675 -0.121 1
1 388 . 13 1 1 A 36 36 ASP CA C 36 55.868 54.979 0.889 1
1 389 . 13 1 1 A 36 36 ASP CB C 36 39.826 39.483 0.343 1
1 390 . 13 1 1 A 36 36 ASP N N 36 121.412 117.542 3.870 1
1 391 . 13 1 1 A 37 37 THR H H 37 7.464 7.460 0.004 1
1 392 . 13 1 1 A 37 37 THR HA H 37 4.454 4.862 -0.408 1
1 397 . 13 1 1 A 37 37 THR C C 37 172.012 171.547 0.465 1
1 398 . 13 1 1 A 37 37 THR CA C 37 61.686 60.828 0.858 1
1 399 . 13 1 1 A 37 37 THR CB C 37 70.927 72.597 -1.670 1
1 401 . 13 1 1 A 37 37 THR N N 37 113.147 112.291 0.856 1
1 402 . 13 1 1 A 38 38 ASP H H 38 8.931 8.610 0.321 1
1 403 . 13 1 1 A 38 38 ASP HA H 38 4.852 5.155 -0.303 1
1 406 . 13 1 1 A 38 38 ASP CA C 38 54.826 52.668 2.158 1
1 407 . 13 1 1 A 38 38 ASP CB C 38 43.332 43.091 0.241 1
1 408 . 13 1 1 A 38 38 ASP N N 38 120.401 124.129 -3.728 1
1 409 . 13 1 1 A 39 39 GLY H H 39 8.068 8.444 -0.376 1
1 410 . 13 1 1 A 39 39 GLY HA2 H 39 3.774 3.995 -0.221 1
1 411 . 13 1 1 A 39 39 GLY HA3 H 39 3.555 4.022 -0.467 1
1 412 . 13 1 1 A 39 39 GLY C C 39 172.578 172.570 0.008 1
1 413 . 13 1 1 A 39 39 GLY CA C 39 43.967 44.601 -0.634 1
1 414 . 13 1 1 A 39 39 GLY N N 39 107.925 112.842 -4.917 1
1 415 . 13 1 1 A 40 40 HIS H H 40 9.111 8.359 0.752 1
1 416 . 13 1 1 A 40 40 HIS HA H 40 4.650 5.112 -0.462 1
1 421 . 13 1 1 A 40 40 HIS C C 40 174.330 174.494 -0.164 1
1 422 . 13 1 1 A 40 40 HIS CA C 40 55.886 54.863 1.023 1
1 423 . 13 1 1 A 40 40 HIS CB C 40 30.507 32.066 -1.559 1
1 426 . 13 1 1 A 40 40 HIS N N 40 119.179 118.969 0.210 1
1 427 . 13 1 1 A 41 41 LEU H H 41 8.254 8.599 -0.345 1
1 428 . 13 1 1 A 41 41 LEU HA H 41 4.626 5.118 -0.492 1
1 438 . 13 1 1 A 41 41 LEU C C 41 176.035 176.422 -0.387 1
1 439 . 13 1 1 A 41 41 LEU CA C 41 55.621 53.761 1.860 1
1 440 . 13 1 1 A 41 41 LEU CB C 41 45.091 43.379 1.712 1
1 444 . 13 1 1 A 41 41 LEU N N 41 124.808 123.966 0.842 1
1 445 . 13 1 1 A 42 42 ILE H H 42 8.685 8.154 0.531 1
1 446 . 13 1 1 A 42 42 ILE HA H 42 4.578 4.510 0.068 1
1 456 . 13 1 1 A 42 42 ILE C C 42 175.369 176.541 -1.172 1
1 457 . 13 1 1 A 42 42 ILE CA C 42 59.852 61.321 -1.469 1
1 458 . 13 1 1 A 42 42 ILE CB C 42 36.778 37.076 -0.298 1
1 462 . 13 1 1 A 42 42 ILE N N 42 121.814 125.313 -3.499 1
1 463 . 13 1 1 A 43 43 ARG H H 43 8.787 8.294 0.493 1
1 464 . 13 1 1 A 43 43 ARG HA H 43 4.852 4.923 -0.071 1
1 472 . 13 1 1 A 43 43 ARG C C 43 174.029 175.441 -1.412 1
1 473 . 13 1 1 A 43 43 ARG CA C 43 52.730 54.102 -1.372 1
1 474 . 13 1 1 A 43 43 ARG CB C 43 36.983 33.927 3.056 1
1 477 . 13 1 1 A 43 43 ARG N N 43 125.771 126.922 -1.151 1
1 479 . 13 1 1 A 44 44 VAL H H 44 8.661 8.605 0.056 1
1 480 . 13 1 1 A 44 44 VAL HA H 44 3.276 3.745 -0.469 1
1 488 . 13 1 1 A 44 44 VAL C C 44 173.227 175.141 -1.914 1
1 489 . 13 1 1 A 44 44 VAL CA C 44 63.161 63.459 -0.298 1
1 490 . 13 1 1 A 44 44 VAL CB C 44 29.054 29.514 -0.460 1
1 493 . 13 1 1 A 44 44 VAL N N 44 117.026 116.327 0.699 1
1 494 . 13 1 1 A 45 45 ILE H H 45 8.464 7.934 0.530 1
1 495 . 13 1 1 A 45 45 ILE HA H 45 4.579 4.185 0.394 1
1 505 . 13 1 1 A 45 45 ILE C C 45 178.108 175.026 3.082 1
1 506 . 13 1 1 A 45 45 ILE CA C 45 59.888 61.531 -1.643 1
1 507 . 13 1 1 A 45 45 ILE CB C 45 36.998 37.162 -0.164 1
1 511 . 13 1 1 A 45 45 ILE N N 45 122.767 122.798 -0.031 1
1 512 . 13 1 1 A 46 46 GLU H H 46 9.015 8.475 0.540 1
1 513 . 13 1 1 A 46 46 GLU HA H 46 4.206 4.348 -0.142 1
1 518 . 13 1 1 A 46 46 GLU C C 46 177.746 176.343 1.403 1
1 519 . 13 1 1 A 46 46 GLU CA C 46 56.130 56.949 -0.819 1
1 520 . 13 1 1 A 46 46 GLU CB C 46 30.581 30.591 -0.010 1
1 522 . 13 1 1 A 46 46 GLU N N 46 131.076 127.131 3.945 1
1 523 . 13 1 1 A 47 47 GLU H H 47 9.213 8.671 0.542 1
1 524 . 13 1 1 A 47 47 GLU HA H 47 4.194 4.328 -0.134 1
1 529 . 13 1 1 A 47 47 GLU C C 47 178.088 177.545 0.543 1
1 530 . 13 1 1 A 47 47 GLU CA C 47 58.212 57.534 0.678 1
1 531 . 13 1 1 A 47 47 GLU CB C 47 29.390 30.434 -1.044 1
1 533 . 13 1 1 A 47 47 GLU N N 47 129.592 122.995 6.597 1
1 534 . 13 1 1 A 48 48 GLY H H 48 9.586 8.958 0.628 1
1 535 . 13 1 1 A 48 48 GLY HA2 H 48 4.141 3.853 0.288 1
1 536 . 13 1 1 A 48 48 GLY HA3 H 48 3.757 3.855 -0.098 1
1 537 . 13 1 1 A 48 48 GLY C C 48 173.790 173.978 -0.188 1
1 538 . 13 1 1 A 48 48 GLY CA C 48 45.764 46.825 -1.061 1
1 539 . 13 1 1 A 48 48 GLY N N 48 114.819 114.621 0.198 1
1 540 . 13 1 1 A 49 49 SER H H 49 7.580 7.836 -0.256 1
1 541 . 13 1 1 A 49 49 SER HA H 49 4.728 4.945 -0.217 1
1 544 . 13 1 1 A 49 49 SER C C 49 173.542 174.220 -0.678 1
1 545 . 13 1 1 A 49 49 SER CA C 49 57.560 55.493 2.067 1
1 546 . 13 1 1 A 49 49 SER CB C 49 64.529 64.393 0.136 1
1 547 . 13 1 1 A 49 49 SER N N 49 114.688 113.455 1.233 1
1 548 . 13 1 1 A 50 50 PRO HA H 50 4.431 4.544 -0.113 1
1 555 . 13 1 1 A 50 50 PRO C C 50 179.377 177.361 2.016 1
1 556 . 13 1 1 A 50 50 PRO CA C 50 66.059 64.251 1.808 1
1 557 . 13 1 1 A 50 50 PRO CB C 50 32.598 31.806 0.792 1
1 560 . 13 1 1 A 51 51 ALA H H 51 8.264 8.120 0.144 1
1 561 . 13 1 1 A 51 51 ALA HA H 51 3.817 4.019 -0.202 1
1 565 . 13 1 1 A 51 51 ALA C C 51 177.508 179.960 -2.452 1
1 566 . 13 1 1 A 51 51 ALA CA C 51 55.392 54.593 0.799 1
1 567 . 13 1 1 A 51 51 ALA CB C 51 20.474 18.724 1.750 1
1 568 . 13 1 1 A 51 51 ALA N N 51 117.604 120.633 -3.029 1
1 569 . 13 1 1 A 52 52 GLU H H 52 7.794 7.371 0.423 1
1 570 . 13 1 1 A 52 52 GLU HA H 52 3.881 4.083 -0.202 1
1 575 . 13 1 1 A 52 52 GLU C C 52 181.401 178.490 2.911 1
1 576 . 13 1 1 A 52 52 GLU CA C 52 59.454 58.528 0.926 1
1 577 . 13 1 1 A 52 52 GLU CB C 52 30.247 29.317 0.930 1
1 579 . 13 1 1 A 52 52 GLU N N 52 119.474 118.177 1.297 1
1 580 . 13 1 1 A 53 53 LYS H H 53 8.557 8.007 0.550 1
1 581 . 13 1 1 A 53 53 LYS HA H 53 4.020 4.054 -0.034 1
1 588 . 13 1 1 A 53 53 LYS C C 53 177.939 178.434 -0.495 1
1 589 . 13 1 1 A 53 53 LYS CA C 53 59.012 58.956 0.056 1
1 590 . 13 1 1 A 53 53 LYS CB C 53 32.438 32.218 0.220 1
1 594 . 13 1 1 A 53 53 LYS N N 53 120.057 118.131 1.926 1
1 595 . 13 1 1 A 54 54 ALA H H 54 7.764 7.466 0.298 1
1 596 . 13 1 1 A 54 54 ALA HA H 54 4.400 4.271 0.129 1
1 600 . 13 1 1 A 54 54 ALA C C 54 177.658 177.681 -0.023 1
1 601 . 13 1 1 A 54 54 ALA CA C 54 52.412 52.241 0.171 1
1 602 . 13 1 1 A 54 54 ALA CB C 54 20.739 19.315 1.424 1
1 603 . 13 1 1 A 54 54 ALA N N 54 117.678 119.465 -1.787 1
1 604 . 13 1 1 A 55 55 GLY H H 55 7.583 8.071 -0.488 1
1 605 . 13 1 1 A 55 55 GLY HA2 H 55 4.266 4.001 0.265 1
1 606 . 13 1 1 A 55 55 GLY HA3 H 55 3.775 4.004 -0.229 1
1 607 . 13 1 1 A 55 55 GLY C C 55 175.232 174.206 1.026 1
1 608 . 13 1 1 A 55 55 GLY CA C 55 45.368 45.124 0.244 1
1 609 . 13 1 1 A 55 55 GLY N N 55 103.265 106.587 -3.322 1
1 610 . 13 1 1 A 56 56 LEU H H 56 7.280 7.436 -0.156 1
1 611 . 13 1 1 A 56 56 LEU HA H 56 3.984 4.475 -0.491 1
1 621 . 13 1 1 A 56 56 LEU C C 56 174.708 175.142 -0.434 1
1 622 . 13 1 1 A 56 56 LEU CA C 56 55.603 54.569 1.034 1
1 623 . 13 1 1 A 56 56 LEU CB C 56 42.752 42.656 0.096 1
1 627 . 13 1 1 A 56 56 LEU N N 56 119.211 123.380 -4.169 1
1 628 . 13 1 1 A 57 57 LEU H H 57 8.693 8.775 -0.082 1
1 629 . 13 1 1 A 57 57 LEU HA H 57 4.499 4.869 -0.370 1
1 639 . 13 1 1 A 57 57 LEU C C 57 176.124 176.148 -0.024 1
1 640 . 13 1 1 A 57 57 LEU CA C 57 52.959 53.356 -0.397 1
1 641 . 13 1 1 A 57 57 LEU CB C 57 45.122 43.765 1.357 1
1 645 . 13 1 1 A 57 57 LEU N N 57 121.969 129.136 -7.167 1
1 646 . 13 1 1 A 58 58 ASP H H 58 8.334 8.725 -0.391 1
1 647 . 13 1 1 A 58 58 ASP HA H 58 4.139 4.887 -0.748 1
1 650 . 13 1 1 A 58 58 ASP C C 58 178.636 176.688 1.948 1
1 651 . 13 1 1 A 58 58 ASP CA C 58 56.079 55.041 1.038 1
1 652 . 13 1 1 A 58 58 ASP CB C 58 42.135 40.597 1.538 1
1 653 . 13 1 1 A 58 58 ASP N N 58 120.401 121.740 -1.339 1
1 654 . 13 1 1 A 59 59 GLY H H 59 9.378 8.779 0.599 1
1 655 . 13 1 1 A 59 59 GLY HA2 H 59 4.317 3.989 0.328 1
1 656 . 13 1 1 A 59 59 GLY HA3 H 59 3.260 3.993 -0.733 1
1 657 . 13 1 1 A 59 59 GLY C C 59 173.359 174.128 -0.769 1
1 658 . 13 1 1 A 59 59 GLY CA C 59 45.517 45.018 0.499 1
1 659 . 13 1 1 A 59 59 GLY N N 59 116.622 111.890 4.732 1
1 660 . 13 1 1 A 60 60 ASP H H 60 8.009 8.098 -0.089 1
1 661 . 13 1 1 A 60 60 ASP HA H 60 4.638 4.598 0.040 1
1 664 . 13 1 1 A 60 60 ASP C C 60 175.555 174.619 0.936 1
1 665 . 13 1 1 A 60 60 ASP CA C 60 55.286 54.989 0.297 1
1 666 . 13 1 1 A 60 60 ASP CB C 60 42.381 41.850 0.531 1
1 667 . 13 1 1 A 60 60 ASP N N 60 121.370 122.022 -0.652 1
1 668 . 13 1 1 A 61 61 ARG H H 61 8.648 8.621 0.027 1
1 669 . 13 1 1 A 61 61 ARG HA H 61 5.179 5.380 -0.201 1
1 677 . 13 1 1 A 61 61 ARG C C 61 177.381 174.491 2.890 1
1 678 . 13 1 1 A 61 61 ARG CA C 61 53.704 54.576 -0.872 1
1 679 . 13 1 1 A 61 61 ARG CB C 61 34.017 33.067 0.950 1
1 682 . 13 1 1 A 61 61 ARG N N 61 116.958 121.218 -4.260 1
1 684 . 13 1 1 A 62 62 VAL H H 62 8.247 8.450 -0.203 1
1 685 . 13 1 1 A 62 62 VAL HA H 62 3.806 4.790 -0.984 1
1 693 . 13 1 1 A 62 62 VAL C C 62 174.748 174.841 -0.093 1
1 694 . 13 1 1 A 62 62 VAL CA C 62 63.149 61.408 1.741 1
1 695 . 13 1 1 A 62 62 VAL CB C 62 32.574 32.760 -0.186 1
1 698 . 13 1 1 A 62 62 VAL N N 62 118.546 125.375 -6.829 1
1 699 . 13 1 1 A 63 63 LEU H H 63 9.262 9.216 0.046 1
1 700 . 13 1 1 A 63 63 LEU HA H 63 4.412 4.353 0.059 1
1 710 . 13 1 1 A 63 63 LEU C C 63 177.649 177.051 0.598 1
1 711 . 13 1 1 A 63 63 LEU CA C 63 56.044 56.267 -0.223 1
1 712 . 13 1 1 A 63 63 LEU CB C 63 43.339 42.706 0.633 1
1 716 . 13 1 1 A 63 63 LEU N N 63 125.413 130.857 -5.444 1
1 717 . 13 1 1 A 64 64 ARG H H 64 7.806 7.698 0.108 1
1 718 . 13 1 1 A 64 64 ARG HA H 64 5.704 5.078 0.626 1
1 726 . 13 1 1 A 64 64 ARG C C 64 175.091 174.104 0.987 1
1 727 . 13 1 1 A 64 64 ARG CA C 64 54.148 54.522 -0.374 1
1 728 . 13 1 1 A 64 64 ARG CB C 64 35.742 34.063 1.679 1
1 731 . 13 1 1 A 64 64 ARG N N 64 112.961 117.030 -4.069 1
1 733 . 13 1 1 A 65 65 ILE H H 65 8.327 9.211 -0.884 1
1 734 . 13 1 1 A 65 65 ILE HA H 65 4.384 4.662 -0.278 1
1 744 . 13 1 1 A 65 65 ILE C C 65 175.722 175.579 0.143 1
1 745 . 13 1 1 A 65 65 ILE CA C 65 60.501 59.513 0.988 1
1 746 . 13 1 1 A 65 65 ILE CB C 65 39.547 40.313 -0.766 1
1 750 . 13 1 1 A 65 65 ILE N N 65 119.175 123.412 -4.237 1
1 751 . 13 1 1 A 66 66 ASN H H 66 9.911 9.801 0.110 1
1 752 . 13 1 1 A 66 66 ASN HA H 66 4.428 4.383 0.045 1
1 757 . 13 1 1 A 66 66 ASN C C 66 175.349 174.639 0.710 1
1 758 . 13 1 1 A 66 66 ASN CA C 66 54.157 54.199 -0.042 1
1 759 . 13 1 1 A 66 66 ASN CB C 66 37.024 37.472 -0.448 1
1 760 . 13 1 1 A 66 66 ASN N N 66 128.952 128.020 0.932 1
1 762 . 13 1 1 A 67 67 GLY H H 67 9.230 8.626 0.604 1
1 763 . 13 1 1 A 67 67 GLY HA2 H 67 4.322 3.945 0.377 1
1 764 . 13 1 1 A 67 67 GLY HA3 H 67 3.508 3.955 -0.447 1
1 765 . 13 1 1 A 67 67 GLY C C 67 174.393 173.989 0.404 1
1 766 . 13 1 1 A 67 67 GLY CA C 67 45.341 46.533 -1.192 1
1 767 . 13 1 1 A 67 67 GLY N N 67 103.238 104.655 -1.417 1
1 768 . 13 1 1 A 68 68 VAL H H 68 8.063 7.691 0.372 1
1 769 . 13 1 1 A 68 68 VAL HA H 68 4.015 4.619 -0.604 1
1 777 . 13 1 1 A 68 68 VAL C C 68 175.833 174.629 1.204 1
1 778 . 13 1 1 A 68 68 VAL CA C 68 62.603 61.181 1.422 1
1 779 . 13 1 1 A 68 68 VAL CB C 68 32.574 35.412 -2.838 1
1 782 . 13 1 1 A 68 68 VAL N N 68 125.696 119.439 6.257 1
1 783 . 13 1 1 A 69 69 PHE H H 69 9.301 9.092 0.209 1
1 784 . 13 1 1 A 69 69 PHE HA H 69 4.947 4.546 0.401 1
1 792 . 13 1 1 A 69 69 PHE C C 69 177.120 175.638 1.482 1
1 793 . 13 1 1 A 69 69 PHE CA C 69 59.200 58.800 0.400 1
1 794 . 13 1 1 A 69 69 PHE CB C 69 39.320 39.472 -0.152 1
1 800 . 13 1 1 A 69 69 PHE N N 69 128.641 128.583 0.058 1
1 801 . 13 1 1 A 70 70 VAL H H 70 8.312 7.990 0.322 1
1 802 . 13 1 1 A 70 70 VAL HA H 70 4.517 4.467 0.050 1
1 810 . 13 1 1 A 70 70 VAL CA C 70 60.734 60.509 0.225 1
1 811 . 13 1 1 A 70 70 VAL CB C 70 32.976 31.261 1.715 1
1 814 . 13 1 1 A 70 70 VAL N N 70 118.381 120.719 -2.338 1
1 815 . 13 1 1 A 71 71 ASP H H 71 5.373 7.251 -1.878 1
1 816 . 13 1 1 A 71 71 ASP HA H 71 4.413 4.338 0.075 1
1 819 . 13 1 1 A 71 71 ASP C C 71 174.896 178.106 -3.210 1
1 820 . 13 1 1 A 71 71 ASP CA C 71 58.334 56.704 1.630 1
1 821 . 13 1 1 A 71 71 ASP CB C 71 46.097 40.834 5.263 1
1 822 . 13 1 1 A 71 71 ASP N N 71 119.008 122.119 -3.111 1
1 823 . 13 1 1 A 72 72 LYS H H 72 7.874 7.791 0.083 1
1 824 . 13 1 1 A 72 72 LYS HA H 72 4.522 4.354 0.168 1
1 833 . 13 1 1 A 72 72 LYS C C 72 177.209 177.024 0.185 1
1 834 . 13 1 1 A 72 72 LYS CA C 72 54.122 57.969 -3.847 1
1 835 . 13 1 1 A 72 72 LYS CB C 72 31.640 33.484 -1.844 1
1 839 . 13 1 1 A 72 72 LYS N N 72 110.259 118.254 -7.995 1
1 840 . 13 1 1 A 73 73 GLU H H 73 7.421 7.830 -0.409 1
1 841 . 13 1 1 A 73 73 GLU HA H 73 4.401 4.384 0.017 1
1 846 . 13 1 1 A 73 73 GLU C C 73 176.728 176.154 0.574 1
1 847 . 13 1 1 A 73 73 GLU CA C 73 54.950 56.966 -2.016 1
1 848 . 13 1 1 A 73 73 GLU CB C 73 30.390 30.595 -0.205 1
1 850 . 13 1 1 A 73 73 GLU N N 73 120.043 119.174 0.869 1
1 851 . 13 1 1 A 74 74 GLU H H 74 9.360 8.905 0.455 1
1 852 . 13 1 1 A 74 74 GLU HA H 74 4.403 4.576 -0.173 1
1 857 . 13 1 1 A 74 74 GLU C C 74 178.234 178.073 0.161 1
1 858 . 13 1 1 A 74 74 GLU CA C 74 56.516 55.545 0.971 1
1 859 . 13 1 1 A 74 74 GLU CB C 74 30.390 30.668 -0.278 1
1 861 . 13 1 1 A 74 74 GLU N N 74 122.193 121.286 0.907 1
1 862 . 13 1 1 A 75 75 HIS H H 75 9.553 9.248 0.305 1
1 863 . 13 1 1 A 75 75 HIS HA H 75 4.080 4.046 0.034 1
1 868 . 13 1 1 A 75 75 HIS C C 75 175.985 176.590 -0.605 1
1 869 . 13 1 1 A 75 75 HIS CA C 75 61.016 60.761 0.255 1
1 870 . 13 1 1 A 75 75 HIS CB C 75 29.468 30.699 -1.231 1
1 873 . 13 1 1 A 75 75 HIS N N 75 123.587 123.079 0.508 1
1 874 . 13 1 1 A 76 76 ALA H H 76 9.129 8.158 0.971 1
1 875 . 13 1 1 A 76 76 ALA HA H 76 3.826 3.721 0.105 1
1 879 . 13 1 1 A 76 76 ALA C C 76 180.475 179.648 0.827 1
1 880 . 13 1 1 A 76 76 ALA CA C 76 55.392 55.123 0.269 1
1 881 . 13 1 1 A 76 76 ALA CB C 76 18.182 18.400 -0.218 1
1 882 . 13 1 1 A 76 76 ALA N N 76 117.795 120.813 -3.018 1
1 883 . 13 1 1 A 77 77 GLN H H 77 7.099 7.539 -0.440 1
1 884 . 13 1 1 A 77 77 GLN HA H 77 4.198 4.106 0.092 1
1 891 . 13 1 1 A 77 77 GLN C C 77 177.860 178.798 -0.938 1
1 892 . 13 1 1 A 77 77 GLN CA C 77 57.790 58.653 -0.863 1
1 893 . 13 1 1 A 77 77 GLN CB C 77 28.536 28.578 -0.042 1
1 895 . 13 1 1 A 77 77 GLN N N 77 115.764 117.930 -2.166 1
1 897 . 13 1 1 A 78 78 VAL H H 78 7.430 7.587 -0.157 1
1 898 . 13 1 1 A 78 78 VAL HA H 78 3.241 3.550 -0.309 1
1 906 . 13 1 1 A 78 78 VAL C C 78 177.042 177.851 -0.809 1
1 907 . 13 1 1 A 78 78 VAL CA C 78 67.299 66.194 1.105 1
1 908 . 13 1 1 A 78 78 VAL CB C 78 30.819 31.628 -0.809 1
1 911 . 13 1 1 A 78 78 VAL N N 78 121.143 120.718 0.425 1
1 912 . 13 1 1 A 79 79 VAL H H 79 7.773 8.196 -0.423 1
1 913 . 13 1 1 A 79 79 VAL HA H 79 3.315 3.625 -0.310 1
1 921 . 13 1 1 A 79 79 VAL C C 79 179.179 177.738 1.441 1
1 922 . 13 1 1 A 79 79 VAL CA C 79 66.694 65.220 1.474 1
1 923 . 13 1 1 A 79 79 VAL CB C 79 31.841 31.078 0.763 1
1 926 . 13 1 1 A 79 79 VAL N N 79 117.473 119.943 -2.470 1
1 927 . 13 1 1 A 80 80 GLU H H 80 7.410 7.630 -0.220 1
1 928 . 13 1 1 A 80 80 GLU HA H 80 4.258 3.974 0.284 1
1 933 . 13 1 1 A 80 80 GLU C C 80 178.018 179.175 -1.157 1
1 934 . 13 1 1 A 80 80 GLU CA C 80 58.566 59.226 -0.660 1
1 935 . 13 1 1 A 80 80 GLU CB C 80 29.072 29.268 -0.196 1
1 937 . 13 1 1 A 80 80 GLU N N 80 120.451 121.033 -0.582 1
1 938 . 13 1 1 A 81 81 LEU H H 81 8.070 8.467 -0.397 1
1 939 . 13 1 1 A 81 81 LEU HA H 81 3.976 4.065 -0.089 1
1 949 . 13 1 1 A 81 81 LEU C C 81 180.658 179.129 1.529 1
1 950 . 13 1 1 A 81 81 LEU CA C 81 58.061 58.083 -0.022 1
1 951 . 13 1 1 A 81 81 LEU CB C 81 42.115 41.955 0.160 1
1 955 . 13 1 1 A 81 81 LEU N N 81 119.943 120.391 -0.448 1
1 956 . 13 1 1 A 82 82 VAL H H 82 7.609 7.971 -0.362 1
1 957 . 13 1 1 A 82 82 VAL HA H 82 3.474 3.569 -0.095 1
1 965 . 13 1 1 A 82 82 VAL C C 82 178.927 178.388 0.539 1
1 966 . 13 1 1 A 82 82 VAL CA C 82 67.398 67.211 0.187 1
1 967 . 13 1 1 A 82 82 VAL CB C 82 31.306 31.328 -0.022 1
1 970 . 13 1 1 A 82 82 VAL N N 82 118.150 118.758 -0.608 1
1 971 . 13 1 1 A 83 83 ARG H H 83 8.186 8.065 0.121 1
1 972 . 13 1 1 A 83 83 ARG HA H 83 3.994 4.052 -0.058 1
1 979 . 13 1 1 A 83 83 ARG C C 83 179.999 178.808 1.191 1
1 980 . 13 1 1 A 83 83 ARG CA C 83 60.205 59.734 0.471 1
1 981 . 13 1 1 A 83 83 ARG CB C 83 30.103 30.046 0.057 1
1 984 . 13 1 1 A 83 83 ARG N N 83 122.902 119.521 3.381 1
1 985 . 13 1 1 A 84 84 LYS H H 84 8.772 7.972 0.800 1
1 986 . 13 1 1 A 84 84 LYS HA H 84 4.047 4.068 -0.021 1
1 995 . 13 1 1 A 84 84 LYS C C 84 176.934 179.025 -2.091 1
1 996 . 13 1 1 A 84 84 LYS CA C 84 58.142 58.949 -0.807 1
1 997 . 13 1 1 A 84 84 LYS CB C 84 32.492 32.252 0.240 1
1 1001 . 13 1 1 A 84 84 LYS N N 84 117.548 118.959 -1.411 1
1 1002 . 13 1 1 A 85 85 SER H H 85 7.333 8.087 -0.754 1
1 1003 . 13 1 1 A 85 85 SER HA H 85 4.235 4.205 0.030 1
1 1006 . 13 1 1 A 85 85 SER C C 85 175.588 175.159 0.429 1
1 1007 . 13 1 1 A 85 85 SER CA C 85 59.535 60.888 -1.353 1
1 1008 . 13 1 1 A 85 85 SER CB C 85 63.571 63.654 -0.083 1
1 1009 . 13 1 1 A 85 85 SER N N 85 113.544 115.493 -1.949 1
1 1010 . 13 1 1 A 86 86 GLY H H 86 7.459 7.322 0.137 1
1 1011 . 13 1 1 A 86 86 GLY HA2 H 86 4.176 4.102 0.074 1
1 1012 . 13 1 1 A 86 86 GLY HA3 H 86 3.762 4.103 -0.341 1
1 1013 . 13 1 1 A 86 86 GLY C C 86 176.407 175.499 0.908 1
1 1014 . 13 1 1 A 86 86 GLY CA C 86 46.109 43.837 2.272 1
1 1015 . 13 1 1 A 86 86 GLY N N 86 104.331 106.999 -2.668 1
1 1016 . 13 1 1 A 87 87 ASN HA H 87 4.650 4.470 0.180 1
1 1021 . 13 1 1 A 87 87 ASN C C 87 173.653 176.154 -2.501 1
1 1022 . 13 1 1 A 87 87 ASN CA C 87 54.492 55.918 -1.426 1
1 1023 . 13 1 1 A 87 87 ASN CB C 87 38.425 38.795 -0.370 1
1 1024 . 13 1 1 A 87 87 ASN N N 87 118.401 121.959 -3.558 1
1 1026 . 13 1 1 A 88 88 SER H H 88 7.435 7.867 -0.432 1
1 1027 . 13 1 1 A 88 88 SER HA H 88 5.438 5.109 0.329 1
1 1030 . 13 1 1 A 88 88 SER C C 88 172.867 173.744 -0.877 1
1 1031 . 13 1 1 A 88 88 SER CA C 88 58.160 57.123 1.037 1
1 1032 . 13 1 1 A 88 88 SER CB C 88 65.861 64.740 1.121 1
1 1033 . 13 1 1 A 88 88 SER N N 88 113.765 112.330 1.435 1
1 1034 . 13 1 1 A 89 89 VAL H H 89 8.452 8.828 -0.376 1
1 1035 . 13 1 1 A 89 89 VAL HA H 89 4.519 4.811 -0.292 1
1 1043 . 13 1 1 A 89 89 VAL C C 89 171.391 174.296 -2.905 1
1 1044 . 13 1 1 A 89 89 VAL CA C 89 61.333 60.657 0.676 1
1 1045 . 13 1 1 A 89 89 VAL CB C 89 33.897 36.012 -2.115 1
1 1048 . 13 1 1 A 89 89 VAL N N 89 120.001 123.756 -3.755 1
1 1049 . 13 1 1 A 90 90 THR H H 90 8.348 8.807 -0.459 1
1 1050 . 13 1 1 A 90 90 THR HA H 90 5.042 4.970 0.072 1
1 1055 . 13 1 1 A 90 90 THR C C 90 173.926 173.884 0.042 1
1 1056 . 13 1 1 A 90 90 THR CA C 90 61.403 62.178 -0.775 1
1 1057 . 13 1 1 A 90 90 THR CB C 90 69.553 70.245 -0.692 1
1 1059 . 13 1 1 A 90 90 THR N N 90 123.477 123.264 0.213 1
1 1060 . 13 1 1 A 91 91 LEU H H 91 9.195 8.822 0.373 1
1 1061 . 13 1 1 A 91 91 LEU HA H 91 5.161 5.059 0.102 1
1 1071 . 13 1 1 A 91 91 LEU C C 91 174.564 176.040 -1.476 1
1 1072 . 13 1 1 A 91 91 LEU CA C 91 52.590 53.872 -1.282 1
1 1073 . 13 1 1 A 91 91 LEU CB C 91 44.998 45.610 -0.612 1
1 1077 . 13 1 1 A 91 91 LEU N N 91 128.419 126.272 2.147 1
1 1078 . 13 1 1 A 92 92 LEU H H 92 8.644 8.448 0.196 1
1 1079 . 13 1 1 A 92 92 LEU HA H 92 5.335 5.236 0.099 1
1 1089 . 13 1 1 A 92 92 LEU C C 92 176.451 175.469 0.982 1
1 1090 . 13 1 1 A 92 92 LEU CA C 92 54.220 53.815 0.405 1
1 1091 . 13 1 1 A 92 92 LEU CB C 92 44.323 43.429 0.894 1
1 1095 . 13 1 1 A 92 92 LEU N N 92 125.894 122.539 3.355 1
1 1096 . 13 1 1 A 93 93 VAL H H 93 9.249 8.830 0.419 1
1 1097 . 13 1 1 A 93 93 VAL HA H 93 5.573 5.347 0.226 1
1 1105 . 13 1 1 A 93 93 VAL C C 93 173.550 174.273 -0.723 1
1 1106 . 13 1 1 A 93 93 VAL CA C 93 58.340 60.692 -2.352 1
1 1107 . 13 1 1 A 93 93 VAL CB C 93 36.159 33.894 2.265 1
1 1110 . 13 1 1 A 93 93 VAL N N 93 120.660 120.511 0.149 1
1 1111 . 13 1 1 A 94 94 LEU H H 94 8.634 8.829 -0.195 1
1 1112 . 13 1 1 A 94 94 LEU HA H 94 4.911 5.103 -0.192 1
1 1122 . 13 1 1 A 94 94 LEU C C 94 174.172 176.084 -1.912 1
1 1123 . 13 1 1 A 94 94 LEU CA C 94 52.659 53.313 -0.654 1
1 1124 . 13 1 1 A 94 94 LEU CB C 94 47.910 45.275 2.635 1
1 1128 . 13 1 1 A 94 94 LEU N N 94 120.304 127.987 -7.683 1
1 1129 . 13 1 1 A 95 95 ASP H H 95 8.210 8.789 -0.579 1
1 1130 . 13 1 1 A 95 95 ASP HA H 95 5.190 4.590 0.600 1
1 1133 . 13 1 1 A 95 95 ASP C C 95 175.887 178.101 -2.214 1
1 1134 . 13 1 1 A 95 95 ASP CA C 95 53.899 54.725 -0.826 1
1 1135 . 13 1 1 A 95 95 ASP CB C 95 41.188 41.126 0.062 1
1 1136 . 13 1 1 A 95 95 ASP N N 95 122.184 124.568 -2.384 1
1 1137 . 13 1 1 A 96 96 GLY H H 96 8.478 8.854 -0.376 1
1 1138 . 13 1 1 A 96 96 GLY HA2 H 96 4.002 3.810 0.192 1
1 1139 . 13 1 1 A 96 96 GLY HA3 H 96 3.757 3.813 -0.056 1
1 1140 . 13 1 1 A 96 96 GLY C C 96 175.497 175.412 0.085 1
1 1141 . 13 1 1 A 96 96 GLY CA C 96 49.944 47.330 2.614 1
1 1142 . 13 1 1 A 96 96 GLY N N 96 108.610 110.831 -2.221 1
1 1143 . 13 1 1 A 97 97 ASP H H 97 8.401 8.179 0.222 1
1 1144 . 13 1 1 A 97 97 ASP HA H 97 4.454 4.361 0.093 1
1 1147 . 13 1 1 A 97 97 ASP C C 97 179.612 178.594 1.018 1
1 1148 . 13 1 1 A 97 97 ASP CA C 97 57.913 57.381 0.532 1
1 1149 . 13 1 1 A 97 97 ASP CB C 97 41.145 40.519 0.626 1
1 1150 . 13 1 1 A 97 97 ASP N N 97 120.034 121.754 -1.720 1
1 1151 . 13 1 1 A 98 98 SER H H 98 8.152 8.112 0.040 1
1 1152 . 13 1 1 A 98 98 SER HA H 98 4.218 4.110 0.108 1
1 1155 . 13 1 1 A 98 98 SER C C 98 175.061 176.234 -1.173 1
1 1156 . 13 1 1 A 98 98 SER CA C 98 62.180 61.581 0.599 1
1 1157 . 13 1 1 A 98 98 SER CB C 98 62.179 63.075 -0.896 1
1 1158 . 13 1 1 A 98 98 SER N N 98 117.174 113.890 3.284 1
1 1159 . 13 1 1 A 99 99 TYR H H 99 9.051 8.482 0.569 1
1 1160 . 13 1 1 A 99 99 TYR HA H 99 3.692 3.826 -0.134 1
1 1167 . 13 1 1 A 99 99 TYR C C 99 176.460 177.316 -0.856 1
1 1168 . 13 1 1 A 99 99 TYR CA C 99 62.814 62.036 0.778 1
1 1169 . 13 1 1 A 99 99 TYR CB C 99 38.829 38.558 0.271 1
1 1174 . 13 1 1 A 99 99 TYR N N 99 123.539 122.684 0.855 1
1 1175 . 13 1 1 A 100 100 GLU H H 100 8.520 8.141 0.379 1
1 1176 . 13 1 1 A 100 100 GLU HA H 100 3.952 3.925 0.027 1
1 1181 . 13 1 1 A 100 100 GLU C C 100 180.151 178.878 1.273 1
1 1182 . 13 1 1 A 100 100 GLU CA C 100 60.099 59.954 0.145 1
1 1183 . 13 1 1 A 100 100 GLU CB C 100 29.435 29.499 -0.064 1
1 1185 . 13 1 1 A 100 100 GLU N N 100 117.082 118.287 -1.205 1
1 1186 . 13 1 1 A 101 101 LYS H H 101 7.740 8.085 -0.345 1
1 1187 . 13 1 1 A 101 101 LYS HA H 101 3.984 4.036 -0.052 1
1 1196 . 13 1 1 A 101 101 LYS C C 101 178.377 178.740 -0.363 1
1 1197 . 13 1 1 A 101 101 LYS CA C 101 59.888 59.417 0.471 1
1 1198 . 13 1 1 A 101 101 LYS CB C 101 32.821 32.444 0.377 1
1 1202 . 13 1 1 A 101 101 LYS N N 101 119.851 121.178 -1.327 1
1 1203 . 13 1 1 A 102 102 ALA H H 102 8.538 7.432 1.106 1
1 1204 . 13 1 1 A 102 102 ALA HA H 102 3.632 4.158 -0.526 1
1 1208 . 13 1 1 A 102 102 ALA C C 102 179.870 179.858 0.012 1
1 1209 . 13 1 1 A 102 102 ALA CA C 102 55.285 55.142 0.143 1
1 1210 . 13 1 1 A 102 102 ALA CB C 102 17.163 18.523 -1.360 1
1 1211 . 13 1 1 A 102 102 ALA N N 102 124.176 121.729 2.447 1
1 1212 . 13 1 1 A 103 103 VAL H H 103 8.147 7.657 0.490 1
1 1213 . 13 1 1 A 103 103 VAL HA H 103 3.658 3.582 0.076 1
1 1221 . 13 1 1 A 103 103 VAL C C 103 181.113 177.799 3.314 1
1 1222 . 13 1 1 A 103 103 VAL CA C 103 66.090 67.132 -1.042 1
1 1223 . 13 1 1 A 103 103 VAL CB C 103 31.822 31.615 0.207 1
1 1226 . 13 1 1 A 103 103 VAL N N 103 117.841 118.032 -0.191 1
1 1227 . 13 1 1 A 104 104 LYS H H 104 7.903 8.332 -0.429 1
1 1228 . 13 1 1 A 104 104 LYS HA H 104 4.065 3.971 0.094 1
1 1235 . 13 1 1 A 104 104 LYS C C 104 177.715 177.938 -0.223 1
1 1236 . 13 1 1 A 104 104 LYS CA C 104 59.094 59.433 -0.339 1
1 1237 . 13 1 1 A 104 104 LYS CB C 104 32.285 32.097 0.188 1
1 1241 . 13 1 1 A 104 104 LYS N N 104 121.515 120.337 1.178 1
1 1242 . 13 1 1 A 105 105 ASN H H 105 7.747 7.968 -0.221 1
1 1243 . 13 1 1 A 105 105 ASN HA H 105 4.721 4.875 -0.154 1
1 1248 . 13 1 1 A 105 105 ASN C C 105 173.320 173.936 -0.616 1
1 1249 . 13 1 1 A 105 105 ASN CA C 105 53.399 53.078 0.321 1
1 1250 . 13 1 1 A 105 105 ASN CB C 105 39.249 38.578 0.671 1
1 1251 . 13 1 1 A 105 105 ASN N N 105 114.941 114.506 0.435 1
1 1253 . 13 1 1 A 106 106 GLN H H 106 7.850 7.980 -0.130 1
1 1254 . 13 1 1 A 106 106 GLN HA H 106 3.902 3.858 0.044 1
1 1261 . 13 1 1 A 106 106 GLN C C 106 175.168 175.087 0.081 1
1 1262 . 13 1 1 A 106 106 GLN CA C 106 56.978 56.803 0.175 1
1 1263 . 13 1 1 A 106 106 GLN CB C 106 25.770 26.544 -0.774 1
1 1265 . 13 1 1 A 106 106 GLN N N 106 114.989 115.758 -0.769 1
1 1267 . 13 1 1 A 107 107 VAL H H 107 8.005 8.215 -0.210 1
1 1268 . 13 1 1 A 107 107 VAL HA H 107 3.664 4.033 -0.369 1
1 1276 . 13 1 1 A 107 107 VAL C C 107 175.468 175.228 0.240 1
1 1277 . 13 1 1 A 107 107 VAL CA C 107 62.726 63.126 -0.400 1
1 1278 . 13 1 1 A 107 107 VAL CB C 107 32.535 32.213 0.322 1
1 1281 . 13 1 1 A 107 107 VAL N N 107 120.216 120.089 0.127 1
1 1282 . 13 1 1 A 108 108 ASP H H 108 8.484 8.788 -0.304 1
1 1283 . 13 1 1 A 108 108 ASP HA H 108 4.467 4.633 -0.166 1
1 1286 . 13 1 1 A 108 108 ASP C C 108 177.179 176.345 0.834 1
1 1287 . 13 1 1 A 108 108 ASP CA C 108 53.417 54.958 -1.541 1
1 1288 . 13 1 1 A 108 108 ASP CB C 108 40.030 40.669 -0.639 1
1 1289 . 13 1 1 A 108 108 ASP N N 108 125.414 126.647 -1.233 1
1 1290 . 13 1 1 A 109 109 LEU H H 109 8.470 8.603 -0.133 1
1 1291 . 13 1 1 A 109 109 LEU HA H 109 3.846 4.096 -0.250 1
1 1301 . 13 1 1 A 109 109 LEU C C 109 178.145 178.605 -0.460 1
1 1302 . 13 1 1 A 109 109 LEU CA C 109 56.573 56.911 -0.338 1
1 1303 . 13 1 1 A 109 109 LEU CB C 109 42.011 41.717 0.294 1
1 1307 . 13 1 1 A 109 109 LEU N N 109 127.577 125.671 1.906 1
1 1308 . 13 1 1 A 110 110 LYS H H 110 8.062 8.068 -0.006 1
1 1309 . 13 1 1 A 110 110 LYS HA H 110 3.022 3.461 -0.439 1
1 1317 . 13 1 1 A 110 110 LYS C C 110 177.248 179.774 -2.526 1
1 1318 . 13 1 1 A 110 110 LYS CA C 110 58.742 59.505 -0.763 1
1 1319 . 13 1 1 A 110 110 LYS CB C 110 31.667 31.995 -0.328 1
1 1323 . 13 1 1 A 110 110 LYS N N 110 118.873 118.844 0.029 1
1 1324 . 13 1 1 A 111 111 GLU H H 111 7.113 7.905 -0.792 1
1 1325 . 13 1 1 A 111 111 GLU HA H 111 4.117 4.191 -0.074 1
1 1330 . 13 1 1 A 111 111 GLU C C 111 176.519 177.664 -1.145 1
1 1331 . 13 1 1 A 111 111 GLU CA C 111 55.621 58.925 -3.304 1
1 1332 . 13 1 1 A 111 111 GLU CB C 111 29.943 29.469 0.474 1
1 1334 . 13 1 1 A 111 111 GLU N N 111 114.282 118.608 -4.326 1
1 1335 . 13 1 1 A 112 112 LEU H H 112 6.848 7.518 -0.670 1
1 1336 . 13 1 1 A 112 112 LEU HA H 112 4.293 4.158 0.135 1
1 1346 . 13 1 1 A 112 112 LEU C C 112 175.674 176.150 -0.476 1
1 1347 . 13 1 1 A 112 112 LEU CA C 112 55.197 56.026 -0.829 1
1 1348 . 13 1 1 A 112 112 LEU CB C 112 41.681 42.008 -0.327 1
1 1352 . 13 1 1 A 112 112 LEU N N 112 118.934 121.994 -3.060 1
1 1353 . 13 1 1 A 113 113 ASP H H 113 8.466 8.672 -0.206 1
1 1354 . 13 1 1 A 113 113 ASP HA H 113 4.593 5.137 -0.544 1
1 1357 . 13 1 1 A 113 113 ASP C C 113 174.511 176.091 -1.580 1
1 1358 . 13 1 1 A 113 113 ASP CA C 113 53.558 53.108 0.450 1
1 1359 . 13 1 1 A 113 113 ASP CB C 113 42.448 43.988 -1.540 1
1 1360 . 13 1 1 A 113 113 ASP N N 113 122.148 125.080 -2.932 1
1 1 . 14 1 1 A 6 6 SER HA H 6 4.483 5.266 -0.783 1
1 4 . 14 1 1 A 6 6 SER C C 6 175.167 173.224 1.943 1
1 5 . 14 1 1 A 6 6 SER CA C 6 58.759 56.132 2.627 1
1 6 . 14 1 1 A 6 6 SER CB C 6 64.069 65.244 -1.175 1
1 7 . 14 1 1 A 7 7 GLY H H 7 8.431 8.610 -0.179 1
1 8 . 14 1 1 A 7 7 GLY HA2 H 7 3.973 4.075 -0.102 1
1 9 . 14 1 1 A 7 7 GLY HA3 H 7 3.973 4.083 -0.110 1
1 10 . 14 1 1 A 7 7 GLY C C 7 174.570 172.468 2.102 1
1 11 . 14 1 1 A 7 7 GLY CA C 7 45.483 45.349 0.134 1
1 12 . 14 1 1 A 7 7 GLY N N 7 110.640 112.679 -2.039 1
1 13 . 14 1 1 A 8 8 MET H H 8 8.239 8.840 -0.601 1
1 14 . 14 1 1 A 8 8 MET HA H 8 4.386 4.795 -0.409 1
1 22 . 14 1 1 A 8 8 MET C C 8 176.621 176.178 0.443 1
1 23 . 14 1 1 A 8 8 MET CA C 8 55.991 53.902 2.089 1
1 24 . 14 1 1 A 8 8 MET CB C 8 32.986 32.235 0.751 1
1 27 . 14 1 1 A 8 8 MET N N 8 120.219 125.510 -5.291 1
1 28 . 14 1 1 A 9 9 ALA H H 9 8.435 8.596 -0.161 1
1 29 . 14 1 1 A 9 9 ALA HA H 9 4.182 3.867 0.315 1
1 33 . 14 1 1 A 9 9 ALA C C 9 177.951 176.654 1.297 1
1 34 . 14 1 1 A 9 9 ALA CA C 9 53.399 53.026 0.373 1
1 35 . 14 1 1 A 9 9 ALA CB C 9 18.955 17.262 1.693 1
1 36 . 14 1 1 A 9 9 ALA N N 9 124.459 125.265 -0.806 1
1 37 . 14 1 1 A 10 10 SER H H 10 8.100 7.821 0.279 1
1 38 . 14 1 1 A 10 10 SER HA H 10 4.391 4.701 -0.310 1
1 41 . 14 1 1 A 10 10 SER C C 10 174.467 173.519 0.948 1
1 42 . 14 1 1 A 10 10 SER CA C 10 58.709 58.080 0.629 1
1 43 . 14 1 1 A 10 10 SER CB C 10 63.778 65.044 -1.266 1
1 44 . 14 1 1 A 10 10 SER N N 10 113.881 112.655 1.226 1
1 45 . 14 1 1 A 11 11 THR H H 11 7.821 8.601 -0.780 1
1 46 . 14 1 1 A 11 11 THR HA H 11 4.191 4.340 -0.149 1
1 51 . 14 1 1 A 11 11 THR C C 11 173.610 174.532 -0.922 1
1 52 . 14 1 1 A 11 11 THR CA C 11 61.936 62.330 -0.394 1
1 53 . 14 1 1 A 11 11 THR CB C 11 69.713 68.712 1.001 1
1 55 . 14 1 1 A 11 11 THR N N 11 114.471 115.077 -0.606 1
1 56 . 14 1 1 A 12 12 PHE H H 12 7.946 8.912 -0.966 1
1 57 . 14 1 1 A 12 12 PHE HA H 12 4.769 4.571 0.198 1
1 65 . 14 1 1 A 12 12 PHE C C 12 174.211 176.097 -1.886 1
1 66 . 14 1 1 A 12 12 PHE CA C 12 56.644 58.173 -1.529 1
1 67 . 14 1 1 A 12 12 PHE CB C 12 40.609 39.280 1.329 1
1 73 . 14 1 1 A 12 12 PHE N N 12 120.763 126.748 -5.985 1
1 74 . 14 1 1 A 13 13 ASN H H 13 9.004 8.653 0.351 1
1 75 . 14 1 1 A 13 13 ASN HA H 13 5.366 5.468 -0.102 1
1 80 . 14 1 1 A 13 13 ASN C C 13 172.158 172.969 -0.811 1
1 81 . 14 1 1 A 13 13 ASN CA C 13 50.988 50.522 0.466 1
1 82 . 14 1 1 A 13 13 ASN CB C 13 39.942 39.216 0.726 1
1 83 . 14 1 1 A 13 13 ASN N N 13 119.973 119.063 0.910 1
1 85 . 14 1 1 A 14 14 PRO HA H 14 4.945 4.636 0.309 1
1 92 . 14 1 1 A 14 14 PRO C C 14 174.901 175.876 -0.975 1
1 93 . 14 1 1 A 14 14 PRO CA C 14 63.096 62.672 0.424 1
1 94 . 14 1 1 A 14 14 PRO CB C 14 32.739 32.536 0.203 1
1 97 . 14 1 1 A 15 15 ARG H H 15 8.908 8.410 0.498 1
1 98 . 14 1 1 A 15 15 ARG HA H 15 4.626 4.798 -0.172 1
1 106 . 14 1 1 A 15 15 ARG C C 15 174.432 174.692 -0.260 1
1 107 . 14 1 1 A 15 15 ARG CA C 15 54.827 55.236 -0.409 1
1 108 . 14 1 1 A 15 15 ARG CB C 15 32.439 32.799 -0.360 1
1 111 . 14 1 1 A 15 15 ARG N N 15 118.947 121.719 -2.772 1
1 113 . 14 1 1 A 16 16 GLU H H 16 8.838 8.695 0.143 1
1 114 . 14 1 1 A 16 16 GLU HA H 16 4.876 5.091 -0.215 1
1 119 . 14 1 1 A 16 16 GLU C C 16 175.767 174.830 0.937 1
1 120 . 14 1 1 A 16 16 GLU CA C 16 55.621 55.130 0.491 1
1 121 . 14 1 1 A 16 16 GLU CB C 16 31.093 32.665 -1.572 1
1 123 . 14 1 1 A 16 16 GLU N N 16 125.316 122.425 2.891 1
1 124 . 14 1 1 A 17 17 CYS H H 17 9.327 8.784 0.543 1
1 125 . 14 1 1 A 17 17 CYS HA H 17 4.804 5.133 -0.329 1
1 128 . 14 1 1 A 17 17 CYS C C 17 172.973 173.055 -0.082 1
1 129 . 14 1 1 A 17 17 CYS CA C 17 57.930 57.894 0.036 1
1 130 . 14 1 1 A 17 17 CYS CB C 17 30.105 30.967 -0.862 1
1 131 . 14 1 1 A 17 17 CYS N N 17 127.909 122.617 5.292 1
1 132 . 14 1 1 A 18 18 LYS H H 18 9.022 8.911 0.111 1
1 133 . 14 1 1 A 18 18 LYS HA H 18 4.769 4.707 0.062 1
1 142 . 14 1 1 A 18 18 LYS C C 18 174.586 175.412 -0.826 1
1 143 . 14 1 1 A 18 18 LYS CA C 18 55.956 55.259 0.697 1
1 144 . 14 1 1 A 18 18 LYS CB C 18 32.203 32.873 -0.670 1
1 148 . 14 1 1 A 18 18 LYS N N 18 127.039 125.805 1.234 1
1 149 . 14 1 1 A 19 19 LEU H H 19 8.784 8.988 -0.204 1
1 150 . 14 1 1 A 19 19 LEU HA H 19 4.852 4.821 0.031 1
1 160 . 14 1 1 A 19 19 LEU C C 19 176.862 175.988 0.874 1
1 161 . 14 1 1 A 19 19 LEU CA C 19 55.391 53.859 1.532 1
1 162 . 14 1 1 A 19 19 LEU CB C 19 44.442 42.957 1.485 1
1 166 . 14 1 1 A 19 19 LEU N N 19 126.311 126.599 -0.288 1
1 167 . 14 1 1 A 20 20 SER H H 20 8.215 8.948 -0.733 1
1 168 . 14 1 1 A 20 20 SER HA H 20 5.461 5.720 -0.259 1
1 171 . 14 1 1 A 20 20 SER C C 20 171.960 173.085 -1.125 1
1 172 . 14 1 1 A 20 20 SER CA C 20 57.525 56.858 0.667 1
1 173 . 14 1 1 A 20 20 SER CB C 20 65.794 65.680 0.114 1
1 174 . 14 1 1 A 20 20 SER N N 20 115.113 116.474 -1.361 1
1 175 . 14 1 1 A 21 21 LYS H H 21 9.001 8.617 0.384 1
1 176 . 14 1 1 A 21 21 LYS HA H 21 4.887 4.875 0.012 1
1 185 . 14 1 1 A 21 21 LYS C C 21 174.133 175.214 -1.081 1
1 186 . 14 1 1 A 21 21 LYS CA C 21 53.840 54.336 -0.496 1
1 187 . 14 1 1 A 21 21 LYS CB C 21 36.553 35.380 1.173 1
1 191 . 14 1 1 A 21 21 LYS N N 21 120.938 120.906 0.032 1
1 192 . 14 1 1 A 22 22 GLN H H 22 8.201 8.184 0.017 1
1 193 . 14 1 1 A 22 22 GLN HA H 22 4.448 4.579 -0.131 1
1 200 . 14 1 1 A 22 22 GLN C C 22 176.372 175.221 1.151 1
1 201 . 14 1 1 A 22 22 GLN CA C 22 53.658 54.652 -0.994 1
1 202 . 14 1 1 A 22 22 GLN CB C 22 30.473 30.566 -0.093 1
1 204 . 14 1 1 A 22 22 GLN N N 22 116.816 119.132 -2.316 1
1 206 . 14 1 1 A 23 23 GLU H H 23 8.624 8.639 -0.015 1
1 207 . 14 1 1 A 23 23 GLU HA H 23 4.056 4.484 -0.428 1
1 212 . 14 1 1 A 23 23 GLU C C 23 177.778 176.813 0.965 1
1 213 . 14 1 1 A 23 23 GLU CA C 23 58.001 55.935 2.066 1
1 214 . 14 1 1 A 23 23 GLU CB C 23 29.237 30.019 -0.782 1
1 216 . 14 1 1 A 23 23 GLU N N 23 122.364 122.089 0.275 1
1 217 . 14 1 1 A 24 24 GLY H H 24 8.962 8.218 0.744 1
1 218 . 14 1 1 A 24 24 GLY HA2 H 24 4.139 3.990 0.149 1
1 219 . 14 1 1 A 24 24 GLY HA3 H 24 3.711 3.990 -0.279 1
1 220 . 14 1 1 A 24 24 GLY C C 24 173.857 173.701 0.156 1
1 221 . 14 1 1 A 24 24 GLY CA C 24 45.288 45.208 0.080 1
1 222 . 14 1 1 A 24 24 GLY N N 24 113.942 113.559 0.383 1
1 223 . 14 1 1 A 25 25 GLN H H 25 7.643 7.584 0.059 1
1 224 . 14 1 1 A 25 25 GLN HA H 25 4.488 4.719 -0.231 1
1 231 . 14 1 1 A 25 25 GLN C C 25 174.727 174.150 0.577 1
1 232 . 14 1 1 A 25 25 GLN CA C 25 54.052 53.950 0.102 1
1 233 . 14 1 1 A 25 25 GLN CB C 25 30.843 31.864 -1.021 1
1 235 . 14 1 1 A 25 25 GLN N N 25 119.538 119.644 -0.106 1
1 237 . 14 1 1 A 26 26 ASN H H 26 8.625 8.817 -0.192 1
1 238 . 14 1 1 A 26 26 ASN HA H 26 4.862 4.934 -0.072 1
1 243 . 14 1 1 A 26 26 ASN C C 26 176.261 174.837 1.424 1
1 244 . 14 1 1 A 26 26 ASN CA C 26 51.812 52.863 -1.051 1
1 245 . 14 1 1 A 26 26 ASN CB C 26 40.403 39.751 0.652 1
1 246 . 14 1 1 A 26 26 ASN N N 26 120.047 121.663 -1.616 1
1 248 . 14 1 1 A 27 27 TYR HA H 27 4.152 4.679 -0.527 1
1 255 . 14 1 1 A 27 27 TYR C C 27 176.731 176.046 0.685 1
1 256 . 14 1 1 A 27 27 TYR CA C 27 62.462 58.863 3.599 1
1 257 . 14 1 1 A 27 27 TYR CB C 27 40.240 40.235 0.005 1
1 262 . 14 1 1 A 27 27 TYR N N 27 121.761 121.658 0.103 1
1 263 . 14 1 1 A 28 28 GLY H H 28 8.285 7.845 0.440 1
1 264 . 14 1 1 A 28 28 GLY HA2 H 28 4.490 3.932 0.558 1
1 265 . 14 1 1 A 28 28 GLY HA3 H 28 3.759 4.014 -0.255 1
1 266 . 14 1 1 A 28 28 GLY C C 28 172.198 173.921 -1.723 1
1 267 . 14 1 1 A 28 28 GLY CA C 28 46.139 45.174 0.965 1
1 268 . 14 1 1 A 28 28 GLY N N 28 103.567 107.402 -3.835 1
1 269 . 14 1 1 A 29 29 PHE H H 29 6.878 7.823 -0.945 1
1 270 . 14 1 1 A 29 29 PHE HA H 29 5.179 4.815 0.364 1
1 278 . 14 1 1 A 29 29 PHE C C 29 172.840 173.816 -0.976 1
1 279 . 14 1 1 A 29 29 PHE CA C 29 55.262 54.889 0.373 1
1 280 . 14 1 1 A 29 29 PHE CB C 29 41.779 42.447 -0.668 1
1 286 . 14 1 1 A 29 29 PHE N N 29 111.027 117.388 -6.361 1
1 287 . 14 1 1 A 30 30 PHE H H 30 8.806 8.426 0.380 1
1 288 . 14 1 1 A 30 30 PHE HA H 30 4.923 4.568 0.355 1
1 296 . 14 1 1 A 30 30 PHE C C 30 174.501 175.395 -0.894 1
1 297 . 14 1 1 A 30 30 PHE CA C 30 55.356 55.865 -0.509 1
1 298 . 14 1 1 A 30 30 PHE CB C 30 41.681 42.806 -1.125 1
1 304 . 14 1 1 A 30 30 PHE N N 30 118.710 117.429 1.281 1
1 305 . 14 1 1 A 31 31 LEU H H 31 8.441 8.482 -0.041 1
1 306 . 14 1 1 A 31 31 LEU HA H 31 5.447 4.511 0.936 1
1 316 . 14 1 1 A 31 31 LEU C C 31 177.306 176.058 1.248 1
1 317 . 14 1 1 A 31 31 LEU CA C 31 53.610 54.826 -1.216 1
1 318 . 14 1 1 A 31 31 LEU CB C 31 43.696 41.587 2.109 1
1 322 . 14 1 1 A 31 31 LEU N N 31 123.765 124.850 -1.085 1
1 323 . 14 1 1 A 32 32 ARG H H 32 9.381 9.129 0.252 1
1 324 . 14 1 1 A 32 32 ARG HA H 32 4.840 4.787 0.053 1
1 331 . 14 1 1 A 32 32 ARG C C 32 175.155 175.712 -0.557 1
1 332 . 14 1 1 A 32 32 ARG CA C 32 54.210 54.455 -0.245 1
1 333 . 14 1 1 A 32 32 ARG CB C 32 35.087 33.208 1.879 1
1 336 . 14 1 1 A 32 32 ARG N N 32 123.160 124.246 -1.086 1
1 337 . 14 1 1 A 33 33 ILE H H 33 7.891 8.907 -1.016 1
1 338 . 14 1 1 A 33 33 ILE HA H 33 4.495 4.809 -0.314 1
1 348 . 14 1 1 A 33 33 ILE C C 33 175.850 174.109 1.741 1
1 349 . 14 1 1 A 33 33 ILE CA C 33 59.641 59.233 0.408 1
1 350 . 14 1 1 A 33 33 ILE CB C 33 39.538 39.703 -0.165 1
1 354 . 14 1 1 A 33 33 ILE N N 33 118.924 119.856 -0.932 1
1 355 . 14 1 1 A 34 34 GLU H H 34 8.971 8.799 0.172 1
1 356 . 14 1 1 A 34 34 GLU HA H 34 4.578 5.115 -0.537 1
1 361 . 14 1 1 A 34 34 GLU C C 34 175.766 175.465 0.301 1
1 362 . 14 1 1 A 34 34 GLU CA C 34 54.263 54.502 -0.239 1
1 363 . 14 1 1 A 34 34 GLU CB C 34 32.128 32.941 -0.813 1
1 365 . 14 1 1 A 34 34 GLU N N 34 125.447 122.511 2.936 1
1 366 . 14 1 1 A 35 35 LYS H H 35 8.504 8.598 -0.094 1
1 367 . 14 1 1 A 35 35 LYS HA H 35 4.026 3.865 0.161 1
1 376 . 14 1 1 A 35 35 LYS C C 35 177.701 176.993 0.708 1
1 377 . 14 1 1 A 35 35 LYS CA C 35 57.591 58.150 -0.559 1
1 378 . 14 1 1 A 35 35 LYS CB C 35 32.491 32.150 0.341 1
1 382 . 14 1 1 A 35 35 LYS N N 35 122.893 127.931 -5.038 1
1 383 . 14 1 1 A 36 36 ASP H H 36 9.020 9.025 -0.005 1
1 384 . 14 1 1 A 36 36 ASP HA H 36 4.385 4.185 0.200 1
1 387 . 14 1 1 A 36 36 ASP C C 36 174.554 174.674 -0.120 1
1 388 . 14 1 1 A 36 36 ASP CA C 36 55.868 55.257 0.611 1
1 389 . 14 1 1 A 36 36 ASP CB C 36 39.826 39.566 0.260 1
1 390 . 14 1 1 A 36 36 ASP N N 36 121.412 120.625 0.787 1
1 391 . 14 1 1 A 37 37 THR H H 37 7.464 7.466 -0.002 1
1 392 . 14 1 1 A 37 37 THR HA H 37 4.454 4.896 -0.442 1
1 397 . 14 1 1 A 37 37 THR C C 37 172.012 173.222 -1.210 1
1 398 . 14 1 1 A 37 37 THR CA C 37 61.686 60.697 0.989 1
1 399 . 14 1 1 A 37 37 THR CB C 37 70.927 72.654 -1.727 1
1 401 . 14 1 1 A 37 37 THR N N 37 113.147 112.214 0.933 1
1 402 . 14 1 1 A 38 38 ASP H H 38 8.931 8.583 0.348 1
1 403 . 14 1 1 A 38 38 ASP HA H 38 4.852 4.899 -0.047 1
1 406 . 14 1 1 A 38 38 ASP CA C 38 54.826 52.957 1.869 1
1 407 . 14 1 1 A 38 38 ASP CB C 38 43.332 42.252 1.080 1
1 408 . 14 1 1 A 38 38 ASP N N 38 120.401 124.326 -3.925 1
1 409 . 14 1 1 A 39 39 GLY H H 39 8.068 8.306 -0.238 1
1 410 . 14 1 1 A 39 39 GLY HA2 H 39 3.774 3.797 -0.023 1
1 411 . 14 1 1 A 39 39 GLY HA3 H 39 3.555 3.975 -0.420 1
1 412 . 14 1 1 A 39 39 GLY C C 39 172.578 173.356 -0.778 1
1 413 . 14 1 1 A 39 39 GLY CA C 39 43.967 44.621 -0.654 1
1 414 . 14 1 1 A 39 39 GLY N N 39 107.925 109.055 -1.130 1
1 415 . 14 1 1 A 40 40 HIS H H 40 9.111 8.578 0.533 1
1 416 . 14 1 1 A 40 40 HIS HA H 40 4.650 4.709 -0.059 1
1 421 . 14 1 1 A 40 40 HIS C C 40 174.330 174.796 -0.466 1
1 422 . 14 1 1 A 40 40 HIS CA C 40 55.886 56.377 -0.491 1
1 423 . 14 1 1 A 40 40 HIS CB C 40 30.507 30.717 -0.210 1
1 426 . 14 1 1 A 40 40 HIS N N 40 119.179 119.065 0.114 1
1 427 . 14 1 1 A 41 41 LEU H H 41 8.254 8.902 -0.648 1
1 428 . 14 1 1 A 41 41 LEU HA H 41 4.626 4.890 -0.264 1
1 438 . 14 1 1 A 41 41 LEU C C 41 176.035 176.601 -0.566 1
1 439 . 14 1 1 A 41 41 LEU CA C 41 55.621 53.617 2.004 1
1 440 . 14 1 1 A 41 41 LEU CB C 41 45.091 43.558 1.533 1
1 444 . 14 1 1 A 41 41 LEU N N 41 124.808 123.825 0.983 1
1 445 . 14 1 1 A 42 42 ILE H H 42 8.685 8.556 0.129 1
1 446 . 14 1 1 A 42 42 ILE HA H 42 4.578 4.575 0.003 1
1 456 . 14 1 1 A 42 42 ILE C C 42 175.369 175.664 -0.295 1
1 457 . 14 1 1 A 42 42 ILE CA C 42 59.852 60.581 -0.729 1
1 458 . 14 1 1 A 42 42 ILE CB C 42 36.778 38.440 -1.662 1
1 462 . 14 1 1 A 42 42 ILE N N 42 121.814 124.644 -2.830 1
1 463 . 14 1 1 A 43 43 ARG H H 43 8.787 8.552 0.235 1
1 464 . 14 1 1 A 43 43 ARG HA H 43 4.852 4.605 0.247 1
1 472 . 14 1 1 A 43 43 ARG C C 43 174.029 174.837 -0.808 1
1 473 . 14 1 1 A 43 43 ARG CA C 43 52.730 55.522 -2.792 1
1 474 . 14 1 1 A 43 43 ARG CB C 43 36.983 33.591 3.392 1
1 477 . 14 1 1 A 43 43 ARG N N 43 125.771 125.827 -0.056 1
1 479 . 14 1 1 A 44 44 VAL H H 44 8.661 8.575 0.086 1
1 480 . 14 1 1 A 44 44 VAL HA H 44 3.276 3.713 -0.437 1
1 488 . 14 1 1 A 44 44 VAL C C 44 173.227 175.132 -1.905 1
1 489 . 14 1 1 A 44 44 VAL CA C 44 63.161 63.260 -0.099 1
1 490 . 14 1 1 A 44 44 VAL CB C 44 29.054 29.759 -0.705 1
1 493 . 14 1 1 A 44 44 VAL N N 44 117.026 119.477 -2.451 1
1 494 . 14 1 1 A 45 45 ILE H H 45 8.464 7.908 0.556 1
1 495 . 14 1 1 A 45 45 ILE HA H 45 4.579 4.065 0.514 1
1 505 . 14 1 1 A 45 45 ILE C C 45 178.108 174.917 3.191 1
1 506 . 14 1 1 A 45 45 ILE CA C 45 59.888 60.910 -1.022 1
1 507 . 14 1 1 A 45 45 ILE CB C 45 36.998 37.580 -0.582 1
1 511 . 14 1 1 A 45 45 ILE N N 45 122.767 122.204 0.563 1
1 512 . 14 1 1 A 46 46 GLU H H 46 9.015 8.822 0.193 1
1 513 . 14 1 1 A 46 46 GLU HA H 46 4.206 4.543 -0.337 1
1 518 . 14 1 1 A 46 46 GLU C C 46 177.746 176.243 1.503 1
1 519 . 14 1 1 A 46 46 GLU CA C 46 56.130 56.183 -0.053 1
1 520 . 14 1 1 A 46 46 GLU CB C 46 30.581 30.625 -0.044 1
1 522 . 14 1 1 A 46 46 GLU N N 46 131.076 128.535 2.541 1
1 523 . 14 1 1 A 47 47 GLU H H 47 9.213 8.771 0.442 1
1 524 . 14 1 1 A 47 47 GLU HA H 47 4.194 4.115 0.079 1
1 529 . 14 1 1 A 47 47 GLU C C 47 178.088 177.315 0.773 1
1 530 . 14 1 1 A 47 47 GLU CA C 47 58.212 58.062 0.150 1
1 531 . 14 1 1 A 47 47 GLU CB C 47 29.390 29.687 -0.297 1
1 533 . 14 1 1 A 47 47 GLU N N 47 129.592 125.775 3.817 1
1 534 . 14 1 1 A 48 48 GLY H H 48 9.586 8.770 0.816 1
1 535 . 14 1 1 A 48 48 GLY HA2 H 48 4.141 3.967 0.174 1
1 536 . 14 1 1 A 48 48 GLY HA3 H 48 3.757 3.968 -0.211 1
1 537 . 14 1 1 A 48 48 GLY C C 48 173.790 173.872 -0.082 1
1 538 . 14 1 1 A 48 48 GLY CA C 48 45.764 46.069 -0.305 1
1 539 . 14 1 1 A 48 48 GLY N N 48 114.819 115.106 -0.287 1
1 540 . 14 1 1 A 49 49 SER H H 49 7.580 7.802 -0.222 1
1 541 . 14 1 1 A 49 49 SER HA H 49 4.728 5.003 -0.275 1
1 544 . 14 1 1 A 49 49 SER C C 49 173.542 174.519 -0.977 1
1 545 . 14 1 1 A 49 49 SER CA C 49 57.560 55.245 2.315 1
1 546 . 14 1 1 A 49 49 SER CB C 49 64.529 65.220 -0.691 1
1 547 . 14 1 1 A 49 49 SER N N 49 114.688 112.932 1.756 1
1 548 . 14 1 1 A 50 50 PRO HA H 50 4.431 4.546 -0.115 1
1 555 . 14 1 1 A 50 50 PRO C C 50 179.377 177.504 1.873 1
1 556 . 14 1 1 A 50 50 PRO CA C 50 66.059 64.244 1.815 1
1 557 . 14 1 1 A 50 50 PRO CB C 50 32.598 31.941 0.657 1
1 560 . 14 1 1 A 51 51 ALA H H 51 8.264 8.325 -0.061 1
1 561 . 14 1 1 A 51 51 ALA HA H 51 3.817 3.998 -0.181 1
1 565 . 14 1 1 A 51 51 ALA C C 51 177.508 179.505 -1.997 1
1 566 . 14 1 1 A 51 51 ALA CA C 51 55.392 55.065 0.327 1
1 567 . 14 1 1 A 51 51 ALA CB C 51 20.474 18.398 2.076 1
1 568 . 14 1 1 A 51 51 ALA N N 51 117.604 120.823 -3.219 1
1 569 . 14 1 1 A 52 52 GLU H H 52 7.794 7.833 -0.039 1
1 570 . 14 1 1 A 52 52 GLU HA H 52 3.881 4.045 -0.164 1
1 575 . 14 1 1 A 52 52 GLU C C 52 181.401 178.619 2.782 1
1 576 . 14 1 1 A 52 52 GLU CA C 52 59.454 59.173 0.281 1
1 577 . 14 1 1 A 52 52 GLU CB C 52 30.247 29.539 0.708 1
1 579 . 14 1 1 A 52 52 GLU N N 52 119.474 118.411 1.063 1
1 580 . 14 1 1 A 53 53 LYS H H 53 8.557 7.829 0.728 1
1 581 . 14 1 1 A 53 53 LYS HA H 53 4.020 4.102 -0.082 1
1 588 . 14 1 1 A 53 53 LYS C C 53 177.939 177.384 0.555 1
1 589 . 14 1 1 A 53 53 LYS CA C 53 59.012 58.816 0.196 1
1 590 . 14 1 1 A 53 53 LYS CB C 53 32.438 31.719 0.719 1
1 594 . 14 1 1 A 53 53 LYS N N 53 120.057 117.825 2.232 1
1 595 . 14 1 1 A 54 54 ALA H H 54 7.764 7.476 0.288 1
1 596 . 14 1 1 A 54 54 ALA HA H 54 4.400 4.308 0.092 1
1 600 . 14 1 1 A 54 54 ALA C C 54 177.658 178.060 -0.402 1
1 601 . 14 1 1 A 54 54 ALA CA C 54 52.412 51.727 0.685 1
1 602 . 14 1 1 A 54 54 ALA CB C 54 20.739 18.315 2.424 1
1 603 . 14 1 1 A 54 54 ALA N N 54 117.678 120.991 -3.313 1
1 604 . 14 1 1 A 55 55 GLY H H 55 7.583 8.009 -0.426 1
1 605 . 14 1 1 A 55 55 GLY HA2 H 55 4.266 3.903 0.363 1
1 606 . 14 1 1 A 55 55 GLY HA3 H 55 3.775 3.905 -0.130 1
1 607 . 14 1 1 A 55 55 GLY C C 55 175.232 174.185 1.047 1
1 608 . 14 1 1 A 55 55 GLY CA C 55 45.368 46.557 -1.189 1
1 609 . 14 1 1 A 55 55 GLY N N 55 103.265 107.605 -4.340 1
1 610 . 14 1 1 A 56 56 LEU H H 56 7.280 7.503 -0.223 1
1 611 . 14 1 1 A 56 56 LEU HA H 56 3.984 4.608 -0.624 1
1 621 . 14 1 1 A 56 56 LEU C C 56 174.708 175.654 -0.946 1
1 622 . 14 1 1 A 56 56 LEU CA C 56 55.603 54.340 1.263 1
1 623 . 14 1 1 A 56 56 LEU CB C 56 42.752 42.622 0.130 1
1 627 . 14 1 1 A 56 56 LEU N N 56 119.211 123.006 -3.795 1
1 628 . 14 1 1 A 57 57 LEU H H 57 8.693 8.946 -0.253 1
1 629 . 14 1 1 A 57 57 LEU HA H 57 4.499 5.187 -0.688 1
1 639 . 14 1 1 A 57 57 LEU C C 57 176.124 175.272 0.852 1
1 640 . 14 1 1 A 57 57 LEU CA C 57 52.959 52.510 0.449 1
1 641 . 14 1 1 A 57 57 LEU CB C 57 45.122 45.766 -0.644 1
1 645 . 14 1 1 A 57 57 LEU N N 57 121.969 122.513 -0.544 1
1 646 . 14 1 1 A 58 58 ASP H H 58 8.334 8.679 -0.345 1
1 647 . 14 1 1 A 58 58 ASP HA H 58 4.139 4.589 -0.450 1
1 650 . 14 1 1 A 58 58 ASP C C 58 178.636 176.803 1.833 1
1 651 . 14 1 1 A 58 58 ASP CA C 58 56.079 55.337 0.742 1
1 652 . 14 1 1 A 58 58 ASP CB C 58 42.135 40.377 1.758 1
1 653 . 14 1 1 A 58 58 ASP N N 58 120.401 120.041 0.360 1
1 654 . 14 1 1 A 59 59 GLY H H 59 9.378 8.881 0.497 1
1 655 . 14 1 1 A 59 59 GLY HA2 H 59 4.317 3.953 0.364 1
1 656 . 14 1 1 A 59 59 GLY HA3 H 59 3.260 3.956 -0.696 1
1 657 . 14 1 1 A 59 59 GLY C C 59 173.359 174.015 -0.656 1
1 658 . 14 1 1 A 59 59 GLY CA C 59 45.517 44.991 0.526 1
1 659 . 14 1 1 A 59 59 GLY N N 59 116.622 112.164 4.458 1
1 660 . 14 1 1 A 60 60 ASP H H 60 8.009 7.934 0.075 1
1 661 . 14 1 1 A 60 60 ASP HA H 60 4.638 4.713 -0.075 1
1 664 . 14 1 1 A 60 60 ASP C C 60 175.555 175.481 0.074 1
1 665 . 14 1 1 A 60 60 ASP CA C 60 55.286 53.889 1.397 1
1 666 . 14 1 1 A 60 60 ASP CB C 60 42.381 41.298 1.083 1
1 667 . 14 1 1 A 60 60 ASP N N 60 121.370 120.629 0.741 1
1 668 . 14 1 1 A 61 61 ARG H H 61 8.648 8.666 -0.018 1
1 669 . 14 1 1 A 61 61 ARG HA H 61 5.179 5.034 0.145 1
1 677 . 14 1 1 A 61 61 ARG C C 61 177.381 174.728 2.653 1
1 678 . 14 1 1 A 61 61 ARG CA C 61 53.704 55.342 -1.638 1
1 679 . 14 1 1 A 61 61 ARG CB C 61 34.017 31.060 2.957 1
1 682 . 14 1 1 A 61 61 ARG N N 61 116.958 123.906 -6.948 1
1 684 . 14 1 1 A 62 62 VAL H H 62 8.247 8.284 -0.037 1
1 685 . 14 1 1 A 62 62 VAL HA H 62 3.806 4.648 -0.842 1
1 693 . 14 1 1 A 62 62 VAL C C 62 174.748 175.110 -0.362 1
1 694 . 14 1 1 A 62 62 VAL CA C 62 63.149 61.985 1.164 1
1 695 . 14 1 1 A 62 62 VAL CB C 62 32.574 31.848 0.726 1
1 698 . 14 1 1 A 62 62 VAL N N 62 118.546 126.230 -7.684 1
1 699 . 14 1 1 A 63 63 LEU H H 63 9.262 9.176 0.086 1
1 700 . 14 1 1 A 63 63 LEU HA H 63 4.412 4.285 0.127 1
1 710 . 14 1 1 A 63 63 LEU C C 63 177.649 177.401 0.248 1
1 711 . 14 1 1 A 63 63 LEU CA C 63 56.044 56.882 -0.838 1
1 712 . 14 1 1 A 63 63 LEU CB C 63 43.339 42.704 0.635 1
1 716 . 14 1 1 A 63 63 LEU N N 63 125.413 131.480 -6.067 1
1 717 . 14 1 1 A 64 64 ARG H H 64 7.806 7.722 0.084 1
1 718 . 14 1 1 A 64 64 ARG HA H 64 5.704 4.907 0.797 1
1 726 . 14 1 1 A 64 64 ARG C C 64 175.091 174.204 0.887 1
1 727 . 14 1 1 A 64 64 ARG CA C 64 54.148 54.643 -0.495 1
1 728 . 14 1 1 A 64 64 ARG CB C 64 35.742 33.924 1.818 1
1 731 . 14 1 1 A 64 64 ARG N N 64 112.961 117.043 -4.082 1
1 733 . 14 1 1 A 65 65 ILE H H 65 8.327 9.192 -0.865 1
1 734 . 14 1 1 A 65 65 ILE HA H 65 4.384 4.689 -0.305 1
1 744 . 14 1 1 A 65 65 ILE C C 65 175.722 175.412 0.310 1
1 745 . 14 1 1 A 65 65 ILE CA C 65 60.501 59.297 1.204 1
1 746 . 14 1 1 A 65 65 ILE CB C 65 39.547 40.456 -0.909 1
1 750 . 14 1 1 A 65 65 ILE N N 65 119.175 123.118 -3.943 1
1 751 . 14 1 1 A 66 66 ASN H H 66 9.911 9.534 0.377 1
1 752 . 14 1 1 A 66 66 ASN HA H 66 4.428 4.388 0.040 1
1 757 . 14 1 1 A 66 66 ASN C C 66 175.349 174.625 0.724 1
1 758 . 14 1 1 A 66 66 ASN CA C 66 54.157 54.244 -0.087 1
1 759 . 14 1 1 A 66 66 ASN CB C 66 37.024 37.470 -0.446 1
1 760 . 14 1 1 A 66 66 ASN N N 66 128.952 128.063 0.889 1
1 762 . 14 1 1 A 67 67 GLY H H 67 9.230 8.678 0.552 1
1 763 . 14 1 1 A 67 67 GLY HA2 H 67 4.322 3.923 0.399 1
1 764 . 14 1 1 A 67 67 GLY HA3 H 67 3.508 3.933 -0.425 1
1 765 . 14 1 1 A 67 67 GLY C C 67 174.393 174.080 0.313 1
1 766 . 14 1 1 A 67 67 GLY CA C 67 45.341 46.344 -1.003 1
1 767 . 14 1 1 A 67 67 GLY N N 67 103.238 104.554 -1.316 1
1 768 . 14 1 1 A 68 68 VAL H H 68 8.063 7.601 0.462 1
1 769 . 14 1 1 A 68 68 VAL HA H 68 4.015 4.460 -0.445 1
1 777 . 14 1 1 A 68 68 VAL C C 68 175.833 174.871 0.962 1
1 778 . 14 1 1 A 68 68 VAL CA C 68 62.603 61.403 1.200 1
1 779 . 14 1 1 A 68 68 VAL CB C 68 32.574 34.693 -2.119 1
1 782 . 14 1 1 A 68 68 VAL N N 68 125.696 119.950 5.746 1
1 783 . 14 1 1 A 69 69 PHE H H 69 9.301 9.146 0.155 1
1 784 . 14 1 1 A 69 69 PHE HA H 69 4.947 4.604 0.343 1
1 792 . 14 1 1 A 69 69 PHE C C 69 177.120 175.954 1.166 1
1 793 . 14 1 1 A 69 69 PHE CA C 69 59.200 57.808 1.392 1
1 794 . 14 1 1 A 69 69 PHE CB C 69 39.320 39.105 0.215 1
1 800 . 14 1 1 A 69 69 PHE N N 69 128.641 128.801 -0.160 1
1 801 . 14 1 1 A 70 70 VAL H H 70 8.312 7.843 0.469 1
1 802 . 14 1 1 A 70 70 VAL HA H 70 4.517 4.476 0.041 1
1 810 . 14 1 1 A 70 70 VAL CA C 70 60.734 60.521 0.213 1
1 811 . 14 1 1 A 70 70 VAL CB C 70 32.976 31.474 1.502 1
1 814 . 14 1 1 A 70 70 VAL N N 70 118.381 119.865 -1.484 1
1 815 . 14 1 1 A 71 71 ASP H H 71 5.373 7.270 -1.897 1
1 816 . 14 1 1 A 71 71 ASP HA H 71 4.413 4.167 0.246 1
1 819 . 14 1 1 A 71 71 ASP C C 71 174.896 177.718 -2.822 1
1 820 . 14 1 1 A 71 71 ASP CA C 71 58.334 57.096 1.238 1
1 821 . 14 1 1 A 71 71 ASP CB C 71 46.097 40.656 5.441 1
1 822 . 14 1 1 A 71 71 ASP N N 71 119.008 122.316 -3.308 1
1 823 . 14 1 1 A 72 72 LYS H H 72 7.874 7.331 0.543 1
1 824 . 14 1 1 A 72 72 LYS HA H 72 4.522 4.332 0.190 1
1 833 . 14 1 1 A 72 72 LYS C C 72 177.209 176.767 0.442 1
1 834 . 14 1 1 A 72 72 LYS CA C 72 54.122 56.561 -2.439 1
1 835 . 14 1 1 A 72 72 LYS CB C 72 31.640 33.782 -2.142 1
1 839 . 14 1 1 A 72 72 LYS N N 72 110.259 116.365 -6.106 1
1 840 . 14 1 1 A 73 73 GLU H H 73 7.421 7.810 -0.389 1
1 841 . 14 1 1 A 73 73 GLU HA H 73 4.401 4.425 -0.024 1
1 846 . 14 1 1 A 73 73 GLU C C 73 176.728 175.792 0.936 1
1 847 . 14 1 1 A 73 73 GLU CA C 73 54.950 56.957 -2.007 1
1 848 . 14 1 1 A 73 73 GLU CB C 73 30.390 30.662 -0.272 1
1 850 . 14 1 1 A 73 73 GLU N N 73 120.043 118.571 1.472 1
1 851 . 14 1 1 A 74 74 GLU H H 74 9.360 8.479 0.881 1
1 852 . 14 1 1 A 74 74 GLU HA H 74 4.403 4.787 -0.384 1
1 857 . 14 1 1 A 74 74 GLU C C 74 178.234 176.922 1.312 1
1 858 . 14 1 1 A 74 74 GLU CA C 74 56.516 55.251 1.265 1
1 859 . 14 1 1 A 74 74 GLU CB C 74 30.390 32.122 -1.732 1
1 861 . 14 1 1 A 74 74 GLU N N 74 122.193 121.920 0.273 1
1 862 . 14 1 1 A 75 75 HIS H H 75 9.553 9.207 0.346 1
1 863 . 14 1 1 A 75 75 HIS HA H 75 4.080 3.999 0.081 1
1 868 . 14 1 1 A 75 75 HIS C C 75 175.985 176.649 -0.664 1
1 869 . 14 1 1 A 75 75 HIS CA C 75 61.016 60.724 0.292 1
1 870 . 14 1 1 A 75 75 HIS CB C 75 29.468 30.637 -1.169 1
1 873 . 14 1 1 A 75 75 HIS N N 75 123.587 127.492 -3.905 1
1 874 . 14 1 1 A 76 76 ALA H H 76 9.129 8.208 0.921 1
1 875 . 14 1 1 A 76 76 ALA HA H 76 3.826 3.700 0.126 1
1 879 . 14 1 1 A 76 76 ALA C C 76 180.475 179.183 1.292 1
1 880 . 14 1 1 A 76 76 ALA CA C 76 55.392 54.989 0.403 1
1 881 . 14 1 1 A 76 76 ALA CB C 76 18.182 18.336 -0.154 1
1 882 . 14 1 1 A 76 76 ALA N N 76 117.795 120.792 -2.997 1
1 883 . 14 1 1 A 77 77 GLN H H 77 7.099 7.808 -0.709 1
1 884 . 14 1 1 A 77 77 GLN HA H 77 4.198 4.220 -0.022 1
1 891 . 14 1 1 A 77 77 GLN C C 77 177.860 178.550 -0.690 1
1 892 . 14 1 1 A 77 77 GLN CA C 77 57.790 58.472 -0.682 1
1 893 . 14 1 1 A 77 77 GLN CB C 77 28.536 28.897 -0.361 1
1 895 . 14 1 1 A 77 77 GLN N N 77 115.764 116.632 -0.868 1
1 897 . 14 1 1 A 78 78 VAL H H 78 7.430 7.786 -0.356 1
1 898 . 14 1 1 A 78 78 VAL HA H 78 3.241 3.555 -0.314 1
1 906 . 14 1 1 A 78 78 VAL C C 78 177.042 177.871 -0.829 1
1 907 . 14 1 1 A 78 78 VAL CA C 78 67.299 66.362 0.937 1
1 908 . 14 1 1 A 78 78 VAL CB C 78 30.819 31.623 -0.804 1
1 911 . 14 1 1 A 78 78 VAL N N 78 121.143 120.552 0.591 1
1 912 . 14 1 1 A 79 79 VAL H H 79 7.773 8.467 -0.694 1
1 913 . 14 1 1 A 79 79 VAL HA H 79 3.315 3.670 -0.355 1
1 921 . 14 1 1 A 79 79 VAL C C 79 179.179 177.643 1.536 1
1 922 . 14 1 1 A 79 79 VAL CA C 79 66.694 65.429 1.265 1
1 923 . 14 1 1 A 79 79 VAL CB C 79 31.841 31.036 0.805 1
1 926 . 14 1 1 A 79 79 VAL N N 79 117.473 119.784 -2.311 1
1 927 . 14 1 1 A 80 80 GLU H H 80 7.410 7.905 -0.495 1
1 928 . 14 1 1 A 80 80 GLU HA H 80 4.258 4.061 0.197 1
1 933 . 14 1 1 A 80 80 GLU C C 80 178.018 178.865 -0.847 1
1 934 . 14 1 1 A 80 80 GLU CA C 80 58.566 59.023 -0.457 1
1 935 . 14 1 1 A 80 80 GLU CB C 80 29.072 29.450 -0.378 1
1 937 . 14 1 1 A 80 80 GLU N N 80 120.451 121.303 -0.852 1
1 938 . 14 1 1 A 81 81 LEU H H 81 8.070 7.826 0.244 1
1 939 . 14 1 1 A 81 81 LEU HA H 81 3.976 4.057 -0.081 1
1 949 . 14 1 1 A 81 81 LEU C C 81 180.658 179.625 1.033 1
1 950 . 14 1 1 A 81 81 LEU CA C 81 58.061 58.064 -0.003 1
1 951 . 14 1 1 A 81 81 LEU CB C 81 42.115 41.504 0.611 1
1 955 . 14 1 1 A 81 81 LEU N N 81 119.943 119.958 -0.015 1
1 956 . 14 1 1 A 82 82 VAL H H 82 7.609 8.134 -0.525 1
1 957 . 14 1 1 A 82 82 VAL HA H 82 3.474 3.639 -0.165 1
1 965 . 14 1 1 A 82 82 VAL C C 82 178.927 178.327 0.600 1
1 966 . 14 1 1 A 82 82 VAL CA C 82 67.398 66.918 0.480 1
1 967 . 14 1 1 A 82 82 VAL CB C 82 31.306 31.387 -0.081 1
1 970 . 14 1 1 A 82 82 VAL N N 82 118.150 120.390 -2.240 1
1 971 . 14 1 1 A 83 83 ARG H H 83 8.186 8.091 0.095 1
1 972 . 14 1 1 A 83 83 ARG HA H 83 3.994 4.014 -0.020 1
1 979 . 14 1 1 A 83 83 ARG C C 83 179.999 178.933 1.066 1
1 980 . 14 1 1 A 83 83 ARG CA C 83 60.205 59.824 0.381 1
1 981 . 14 1 1 A 83 83 ARG CB C 83 30.103 29.865 0.238 1
1 984 . 14 1 1 A 83 83 ARG N N 83 122.902 120.047 2.855 1
1 985 . 14 1 1 A 84 84 LYS H H 84 8.772 8.137 0.635 1
1 986 . 14 1 1 A 84 84 LYS HA H 84 4.047 4.103 -0.056 1
1 995 . 14 1 1 A 84 84 LYS C C 84 176.934 178.845 -1.911 1
1 996 . 14 1 1 A 84 84 LYS CA C 84 58.142 59.099 -0.957 1
1 997 . 14 1 1 A 84 84 LYS CB C 84 32.492 31.840 0.652 1
1 1001 . 14 1 1 A 84 84 LYS N N 84 117.548 118.768 -1.220 1
1 1002 . 14 1 1 A 85 85 SER H H 85 7.333 7.827 -0.494 1
1 1003 . 14 1 1 A 85 85 SER HA H 85 4.235 4.253 -0.018 1
1 1006 . 14 1 1 A 85 85 SER C C 85 175.588 175.166 0.422 1
1 1007 . 14 1 1 A 85 85 SER CA C 85 59.535 61.816 -2.281 1
1 1008 . 14 1 1 A 85 85 SER CB C 85 63.571 63.748 -0.177 1
1 1009 . 14 1 1 A 85 85 SER N N 85 113.544 115.804 -2.260 1
1 1010 . 14 1 1 A 86 86 GLY H H 86 7.459 7.712 -0.253 1
1 1011 . 14 1 1 A 86 86 GLY HA2 H 86 4.176 4.136 0.040 1
1 1012 . 14 1 1 A 86 86 GLY HA3 H 86 3.762 4.139 -0.377 1
1 1013 . 14 1 1 A 86 86 GLY C C 86 176.407 175.310 1.097 1
1 1014 . 14 1 1 A 86 86 GLY CA C 86 46.109 43.953 2.156 1
1 1015 . 14 1 1 A 86 86 GLY N N 86 104.331 106.660 -2.329 1
1 1016 . 14 1 1 A 87 87 ASN HA H 87 4.650 4.460 0.190 1
1 1021 . 14 1 1 A 87 87 ASN C C 87 173.653 176.192 -2.539 1
1 1022 . 14 1 1 A 87 87 ASN CA C 87 54.492 55.900 -1.408 1
1 1023 . 14 1 1 A 87 87 ASN CB C 87 38.425 38.525 -0.100 1
1 1024 . 14 1 1 A 87 87 ASN N N 87 118.401 120.315 -1.914 1
1 1026 . 14 1 1 A 88 88 SER H H 88 7.435 8.027 -0.592 1
1 1027 . 14 1 1 A 88 88 SER HA H 88 5.438 5.290 0.148 1
1 1030 . 14 1 1 A 88 88 SER C C 88 172.867 173.571 -0.704 1
1 1031 . 14 1 1 A 88 88 SER CA C 88 58.160 56.808 1.352 1
1 1032 . 14 1 1 A 88 88 SER CB C 88 65.861 64.747 1.114 1
1 1033 . 14 1 1 A 88 88 SER N N 88 113.765 112.156 1.609 1
1 1034 . 14 1 1 A 89 89 VAL H H 89 8.452 8.947 -0.495 1
1 1035 . 14 1 1 A 89 89 VAL HA H 89 4.519 4.945 -0.426 1
1 1043 . 14 1 1 A 89 89 VAL C C 89 171.391 174.463 -3.072 1
1 1044 . 14 1 1 A 89 89 VAL CA C 89 61.333 60.401 0.932 1
1 1045 . 14 1 1 A 89 89 VAL CB C 89 33.897 35.580 -1.683 1
1 1048 . 14 1 1 A 89 89 VAL N N 89 120.001 125.163 -5.162 1
1 1049 . 14 1 1 A 90 90 THR H H 90 8.348 8.706 -0.358 1
1 1050 . 14 1 1 A 90 90 THR HA H 90 5.042 5.198 -0.156 1
1 1055 . 14 1 1 A 90 90 THR C C 90 173.926 173.527 0.399 1
1 1056 . 14 1 1 A 90 90 THR CA C 90 61.403 61.427 -0.024 1
1 1057 . 14 1 1 A 90 90 THR CB C 90 69.553 70.624 -1.071 1
1 1059 . 14 1 1 A 90 90 THR N N 90 123.477 124.073 -0.596 1
1 1060 . 14 1 1 A 91 91 LEU H H 91 9.195 8.661 0.534 1
1 1061 . 14 1 1 A 91 91 LEU HA H 91 5.161 4.925 0.236 1
1 1071 . 14 1 1 A 91 91 LEU C C 91 174.564 175.522 -0.958 1
1 1072 . 14 1 1 A 91 91 LEU CA C 91 52.590 53.586 -0.996 1
1 1073 . 14 1 1 A 91 91 LEU CB C 91 44.998 46.468 -1.470 1
1 1077 . 14 1 1 A 91 91 LEU N N 91 128.419 125.528 2.891 1
1 1078 . 14 1 1 A 92 92 LEU H H 92 8.644 8.595 0.049 1
1 1079 . 14 1 1 A 92 92 LEU HA H 92 5.335 5.296 0.039 1
1 1089 . 14 1 1 A 92 92 LEU C C 92 176.451 175.507 0.944 1
1 1090 . 14 1 1 A 92 92 LEU CA C 92 54.220 54.093 0.127 1
1 1091 . 14 1 1 A 92 92 LEU CB C 92 44.323 43.032 1.291 1
1 1095 . 14 1 1 A 92 92 LEU N N 92 125.894 123.386 2.508 1
1 1096 . 14 1 1 A 93 93 VAL H H 93 9.249 8.772 0.477 1
1 1097 . 14 1 1 A 93 93 VAL HA H 93 5.573 5.356 0.217 1
1 1105 . 14 1 1 A 93 93 VAL C C 93 173.550 174.337 -0.787 1
1 1106 . 14 1 1 A 93 93 VAL CA C 93 58.340 60.359 -2.019 1
1 1107 . 14 1 1 A 93 93 VAL CB C 93 36.159 33.554 2.605 1
1 1110 . 14 1 1 A 93 93 VAL N N 93 120.660 120.712 -0.052 1
1 1111 . 14 1 1 A 94 94 LEU H H 94 8.634 8.701 -0.067 1
1 1112 . 14 1 1 A 94 94 LEU HA H 94 4.911 5.212 -0.301 1
1 1122 . 14 1 1 A 94 94 LEU C C 94 174.172 175.567 -1.395 1
1 1123 . 14 1 1 A 94 94 LEU CA C 94 52.659 53.291 -0.632 1
1 1124 . 14 1 1 A 94 94 LEU CB C 94 47.910 45.990 1.920 1
1 1128 . 14 1 1 A 94 94 LEU N N 94 120.304 126.903 -6.599 1
1 1129 . 14 1 1 A 95 95 ASP H H 95 8.210 8.803 -0.593 1
1 1130 . 14 1 1 A 95 95 ASP HA H 95 5.190 4.542 0.648 1
1 1133 . 14 1 1 A 95 95 ASP C C 95 175.887 177.966 -2.079 1
1 1134 . 14 1 1 A 95 95 ASP CA C 95 53.899 54.978 -1.079 1
1 1135 . 14 1 1 A 95 95 ASP CB C 95 41.188 41.169 0.019 1
1 1136 . 14 1 1 A 95 95 ASP N N 95 122.184 124.670 -2.486 1
1 1137 . 14 1 1 A 96 96 GLY H H 96 8.478 8.852 -0.374 1
1 1138 . 14 1 1 A 96 96 GLY HA2 H 96 4.002 3.808 0.194 1
1 1139 . 14 1 1 A 96 96 GLY HA3 H 96 3.757 3.813 -0.056 1
1 1140 . 14 1 1 A 96 96 GLY C C 96 175.497 175.690 -0.193 1
1 1141 . 14 1 1 A 96 96 GLY CA C 96 49.944 47.456 2.488 1
1 1142 . 14 1 1 A 96 96 GLY N N 96 108.610 110.906 -2.296 1
1 1143 . 14 1 1 A 97 97 ASP H H 97 8.401 8.401 0.000 1
1 1144 . 14 1 1 A 97 97 ASP HA H 97 4.454 4.355 0.099 1
1 1147 . 14 1 1 A 97 97 ASP C C 97 179.612 178.459 1.153 1
1 1148 . 14 1 1 A 97 97 ASP CA C 97 57.913 56.675 1.238 1
1 1149 . 14 1 1 A 97 97 ASP CB C 97 41.145 40.270 0.875 1
1 1150 . 14 1 1 A 97 97 ASP N N 97 120.034 122.609 -2.575 1
1 1151 . 14 1 1 A 98 98 SER H H 98 8.152 8.177 -0.025 1
1 1152 . 14 1 1 A 98 98 SER HA H 98 4.218 4.149 0.069 1
1 1155 . 14 1 1 A 98 98 SER C C 98 175.061 175.489 -0.428 1
1 1156 . 14 1 1 A 98 98 SER CA C 98 62.180 62.412 -0.232 1
1 1157 . 14 1 1 A 98 98 SER CB C 98 62.179 63.155 -0.976 1
1 1158 . 14 1 1 A 98 98 SER N N 98 117.174 115.892 1.282 1
1 1159 . 14 1 1 A 99 99 TYR H H 99 9.051 8.175 0.876 1
1 1160 . 14 1 1 A 99 99 TYR HA H 99 3.692 3.876 -0.184 1
1 1167 . 14 1 1 A 99 99 TYR C C 99 176.460 176.886 -0.426 1
1 1168 . 14 1 1 A 99 99 TYR CA C 99 62.814 61.680 1.134 1
1 1169 . 14 1 1 A 99 99 TYR CB C 99 38.829 38.716 0.113 1
1 1174 . 14 1 1 A 99 99 TYR N N 99 123.539 122.194 1.345 1
1 1175 . 14 1 1 A 100 100 GLU H H 100 8.520 8.656 -0.136 1
1 1176 . 14 1 1 A 100 100 GLU HA H 100 3.952 4.036 -0.084 1
1 1181 . 14 1 1 A 100 100 GLU C C 100 180.151 179.089 1.062 1
1 1182 . 14 1 1 A 100 100 GLU CA C 100 60.099 59.955 0.144 1
1 1183 . 14 1 1 A 100 100 GLU CB C 100 29.435 29.358 0.077 1
1 1185 . 14 1 1 A 100 100 GLU N N 100 117.082 118.602 -1.520 1
1 1186 . 14 1 1 A 101 101 LYS H H 101 7.740 8.097 -0.357 1
1 1187 . 14 1 1 A 101 101 LYS HA H 101 3.984 4.074 -0.090 1
1 1196 . 14 1 1 A 101 101 LYS C C 101 178.377 178.512 -0.135 1
1 1197 . 14 1 1 A 101 101 LYS CA C 101 59.888 59.393 0.495 1
1 1198 . 14 1 1 A 101 101 LYS CB C 101 32.821 32.221 0.600 1
1 1202 . 14 1 1 A 101 101 LYS N N 101 119.851 120.769 -0.918 1
1 1203 . 14 1 1 A 102 102 ALA H H 102 8.538 7.764 0.774 1
1 1204 . 14 1 1 A 102 102 ALA HA H 102 3.632 4.096 -0.464 1
1 1208 . 14 1 1 A 102 102 ALA C C 102 179.870 179.649 0.221 1
1 1209 . 14 1 1 A 102 102 ALA CA C 102 55.285 55.056 0.229 1
1 1210 . 14 1 1 A 102 102 ALA CB C 102 17.163 18.273 -1.110 1
1 1211 . 14 1 1 A 102 102 ALA N N 102 124.176 121.440 2.736 1
1 1212 . 14 1 1 A 103 103 VAL H H 103 8.147 8.045 0.102 1
1 1213 . 14 1 1 A 103 103 VAL HA H 103 3.658 3.682 -0.024 1
1 1221 . 14 1 1 A 103 103 VAL C C 103 181.113 177.817 3.296 1
1 1222 . 14 1 1 A 103 103 VAL CA C 103 66.090 65.474 0.616 1
1 1223 . 14 1 1 A 103 103 VAL CB C 103 31.822 31.103 0.719 1
1 1226 . 14 1 1 A 103 103 VAL N N 103 117.841 117.073 0.768 1
1 1227 . 14 1 1 A 104 104 LYS H H 104 7.903 7.921 -0.018 1
1 1228 . 14 1 1 A 104 104 LYS HA H 104 4.065 3.971 0.094 1
1 1235 . 14 1 1 A 104 104 LYS C C 104 177.715 178.252 -0.537 1
1 1236 . 14 1 1 A 104 104 LYS CA C 104 59.094 59.430 -0.336 1
1 1237 . 14 1 1 A 104 104 LYS CB C 104 32.285 32.304 -0.019 1
1 1241 . 14 1 1 A 104 104 LYS N N 104 121.515 121.358 0.157 1
1 1242 . 14 1 1 A 105 105 ASN H H 105 7.747 7.783 -0.036 1
1 1243 . 14 1 1 A 105 105 ASN HA H 105 4.721 4.865 -0.144 1
1 1248 . 14 1 1 A 105 105 ASN C C 105 173.320 173.918 -0.598 1
1 1249 . 14 1 1 A 105 105 ASN CA C 105 53.399 53.008 0.391 1
1 1250 . 14 1 1 A 105 105 ASN CB C 105 39.249 38.498 0.751 1
1 1251 . 14 1 1 A 105 105 ASN N N 105 114.941 114.576 0.365 1
1 1253 . 14 1 1 A 106 106 GLN H H 106 7.850 7.881 -0.031 1
1 1254 . 14 1 1 A 106 106 GLN HA H 106 3.902 3.854 0.048 1
1 1261 . 14 1 1 A 106 106 GLN C C 106 175.168 175.036 0.132 1
1 1262 . 14 1 1 A 106 106 GLN CA C 106 56.978 56.888 0.090 1
1 1263 . 14 1 1 A 106 106 GLN CB C 106 25.770 26.305 -0.535 1
1 1265 . 14 1 1 A 106 106 GLN N N 106 114.989 115.324 -0.335 1
1 1267 . 14 1 1 A 107 107 VAL H H 107 8.005 8.074 -0.069 1
1 1268 . 14 1 1 A 107 107 VAL HA H 107 3.664 4.027 -0.363 1
1 1276 . 14 1 1 A 107 107 VAL C C 107 175.468 175.161 0.307 1
1 1277 . 14 1 1 A 107 107 VAL CA C 107 62.726 62.049 0.677 1
1 1278 . 14 1 1 A 107 107 VAL CB C 107 32.535 32.004 0.531 1
1 1281 . 14 1 1 A 107 107 VAL N N 107 120.216 120.221 -0.005 1
1 1282 . 14 1 1 A 108 108 ASP H H 108 8.484 8.728 -0.244 1
1 1283 . 14 1 1 A 108 108 ASP HA H 108 4.467 4.513 -0.046 1
1 1286 . 14 1 1 A 108 108 ASP C C 108 177.179 176.006 1.173 1
1 1287 . 14 1 1 A 108 108 ASP CA C 108 53.417 55.304 -1.887 1
1 1288 . 14 1 1 A 108 108 ASP CB C 108 40.030 41.119 -1.089 1
1 1289 . 14 1 1 A 108 108 ASP N N 108 125.414 128.273 -2.859 1
1 1290 . 14 1 1 A 109 109 LEU H H 109 8.470 8.408 0.062 1
1 1291 . 14 1 1 A 109 109 LEU HA H 109 3.846 4.362 -0.516 1
1 1301 . 14 1 1 A 109 109 LEU C C 109 178.145 178.502 -0.357 1
1 1302 . 14 1 1 A 109 109 LEU CA C 109 56.573 56.279 0.294 1
1 1303 . 14 1 1 A 109 109 LEU CB C 109 42.011 42.279 -0.268 1
1 1307 . 14 1 1 A 109 109 LEU N N 109 127.577 125.107 2.470 1
1 1308 . 14 1 1 A 110 110 LYS H H 110 8.062 8.024 0.038 1
1 1309 . 14 1 1 A 110 110 LYS HA H 110 3.022 3.216 -0.194 1
1 1317 . 14 1 1 A 110 110 LYS C C 110 177.248 179.345 -2.097 1
1 1318 . 14 1 1 A 110 110 LYS CA C 110 58.742 59.670 -0.928 1
1 1319 . 14 1 1 A 110 110 LYS CB C 110 31.667 31.774 -0.107 1
1 1323 . 14 1 1 A 110 110 LYS N N 110 118.873 117.524 1.349 1
1 1324 . 14 1 1 A 111 111 GLU H H 111 7.113 8.011 -0.898 1
1 1325 . 14 1 1 A 111 111 GLU HA H 111 4.117 4.136 -0.019 1
1 1330 . 14 1 1 A 111 111 GLU C C 111 176.519 177.662 -1.143 1
1 1331 . 14 1 1 A 111 111 GLU CA C 111 55.621 58.901 -3.280 1
1 1332 . 14 1 1 A 111 111 GLU CB C 111 29.943 29.264 0.679 1
1 1334 . 14 1 1 A 111 111 GLU N N 111 114.282 119.753 -5.471 1
1 1335 . 14 1 1 A 112 112 LEU H H 112 6.848 7.661 -0.813 1
1 1336 . 14 1 1 A 112 112 LEU HA H 112 4.293 4.144 0.149 1
1 1346 . 14 1 1 A 112 112 LEU C C 112 175.674 176.551 -0.877 1
1 1347 . 14 1 1 A 112 112 LEU CA C 112 55.197 55.886 -0.689 1
1 1348 . 14 1 1 A 112 112 LEU CB C 112 41.681 42.080 -0.399 1
1 1352 . 14 1 1 A 112 112 LEU N N 112 118.934 121.956 -3.022 1
1 1353 . 14 1 1 A 113 113 ASP H H 113 8.466 8.650 -0.184 1
1 1354 . 14 1 1 A 113 113 ASP HA H 113 4.593 4.847 -0.254 1
1 1357 . 14 1 1 A 113 113 ASP C C 113 174.511 175.296 -0.785 1
1 1358 . 14 1 1 A 113 113 ASP CA C 113 53.558 53.931 -0.373 1
1 1359 . 14 1 1 A 113 113 ASP CB C 113 42.448 42.303 0.145 1
1 1360 . 14 1 1 A 113 113 ASP N N 113 122.148 125.514 -3.366 1
1 1 . 15 1 1 A 6 6 SER HA H 6 4.483 5.193 -0.710 1
1 4 . 15 1 1 A 6 6 SER C C 6 175.167 173.082 2.085 1
1 5 . 15 1 1 A 6 6 SER CA C 6 58.759 56.958 1.801 1
1 6 . 15 1 1 A 6 6 SER CB C 6 64.069 66.002 -1.933 1
1 7 . 15 1 1 A 7 7 GLY H H 7 8.431 8.387 0.044 1
1 8 . 15 1 1 A 7 7 GLY HA2 H 7 3.973 4.217 -0.244 1
1 9 . 15 1 1 A 7 7 GLY HA3 H 7 3.973 4.221 -0.248 1
1 10 . 15 1 1 A 7 7 GLY C C 7 174.570 172.331 2.239 1
1 11 . 15 1 1 A 7 7 GLY CA C 7 45.483 46.227 -0.744 1
1 12 . 15 1 1 A 7 7 GLY N N 7 110.640 113.512 -2.872 1
1 13 . 15 1 1 A 8 8 MET H H 8 8.239 8.480 -0.241 1
1 14 . 15 1 1 A 8 8 MET HA H 8 4.386 4.645 -0.259 1
1 22 . 15 1 1 A 8 8 MET C C 8 176.621 174.561 2.060 1
1 23 . 15 1 1 A 8 8 MET CA C 8 55.991 54.392 1.599 1
1 24 . 15 1 1 A 8 8 MET CB C 8 32.986 32.121 0.865 1
1 27 . 15 1 1 A 8 8 MET N N 8 120.219 125.364 -5.145 1
1 28 . 15 1 1 A 9 9 ALA H H 9 8.435 7.724 0.711 1
1 29 . 15 1 1 A 9 9 ALA HA H 9 4.182 5.131 -0.949 1
1 33 . 15 1 1 A 9 9 ALA C C 9 177.951 175.740 2.211 1
1 34 . 15 1 1 A 9 9 ALA CA C 9 53.399 50.763 2.636 1
1 35 . 15 1 1 A 9 9 ALA CB C 9 18.955 23.703 -4.748 1
1 36 . 15 1 1 A 9 9 ALA N N 9 124.459 123.929 0.530 1
1 37 . 15 1 1 A 10 10 SER H H 10 8.100 8.658 -0.558 1
1 38 . 15 1 1 A 10 10 SER HA H 10 4.391 4.973 -0.582 1
1 41 . 15 1 1 A 10 10 SER C C 10 174.467 172.903 1.564 1
1 42 . 15 1 1 A 10 10 SER CA C 10 58.709 57.167 1.542 1
1 43 . 15 1 1 A 10 10 SER CB C 10 63.778 66.337 -2.559 1
1 44 . 15 1 1 A 10 10 SER N N 10 113.881 113.215 0.666 1
1 45 . 15 1 1 A 11 11 THR H H 11 7.821 8.452 -0.631 1
1 46 . 15 1 1 A 11 11 THR HA H 11 4.191 4.371 -0.180 1
1 51 . 15 1 1 A 11 11 THR C C 11 173.610 174.588 -0.978 1
1 52 . 15 1 1 A 11 11 THR CA C 11 61.936 62.326 -0.390 1
1 53 . 15 1 1 A 11 11 THR CB C 11 69.713 68.692 1.021 1
1 55 . 15 1 1 A 11 11 THR N N 11 114.471 115.046 -0.575 1
1 56 . 15 1 1 A 12 12 PHE H H 12 7.946 9.041 -1.095 1
1 57 . 15 1 1 A 12 12 PHE HA H 12 4.769 4.612 0.157 1
1 65 . 15 1 1 A 12 12 PHE C C 12 174.211 175.499 -1.288 1
1 66 . 15 1 1 A 12 12 PHE CA C 12 56.644 58.243 -1.599 1
1 67 . 15 1 1 A 12 12 PHE CB C 12 40.609 39.447 1.162 1
1 73 . 15 1 1 A 12 12 PHE N N 12 120.763 126.709 -5.946 1
1 74 . 15 1 1 A 13 13 ASN H H 13 9.004 9.052 -0.048 1
1 75 . 15 1 1 A 13 13 ASN HA H 13 5.366 5.337 0.029 1
1 80 . 15 1 1 A 13 13 ASN C C 13 172.158 174.306 -2.148 1
1 81 . 15 1 1 A 13 13 ASN CA C 13 50.988 50.868 0.120 1
1 82 . 15 1 1 A 13 13 ASN CB C 13 39.942 38.487 1.455 1
1 83 . 15 1 1 A 13 13 ASN N N 13 119.973 117.884 2.089 1
1 85 . 15 1 1 A 14 14 PRO HA H 14 4.945 4.602 0.343 1
1 92 . 15 1 1 A 14 14 PRO C C 14 174.901 175.335 -0.434 1
1 93 . 15 1 1 A 14 14 PRO CA C 14 63.096 62.706 0.390 1
1 94 . 15 1 1 A 14 14 PRO CB C 14 32.739 32.581 0.158 1
1 97 . 15 1 1 A 15 15 ARG H H 15 8.908 8.836 0.072 1
1 98 . 15 1 1 A 15 15 ARG HA H 15 4.626 4.933 -0.307 1
1 106 . 15 1 1 A 15 15 ARG C C 15 174.432 174.214 0.218 1
1 107 . 15 1 1 A 15 15 ARG CA C 15 54.827 55.031 -0.204 1
1 108 . 15 1 1 A 15 15 ARG CB C 15 32.439 32.523 -0.084 1
1 111 . 15 1 1 A 15 15 ARG N N 15 118.947 121.386 -2.439 1
1 113 . 15 1 1 A 16 16 GLU H H 16 8.838 8.716 0.122 1
1 114 . 15 1 1 A 16 16 GLU HA H 16 4.876 4.920 -0.044 1
1 119 . 15 1 1 A 16 16 GLU C C 16 175.767 175.428 0.339 1
1 120 . 15 1 1 A 16 16 GLU CA C 16 55.621 55.429 0.192 1
1 121 . 15 1 1 A 16 16 GLU CB C 16 31.093 31.569 -0.476 1
1 123 . 15 1 1 A 16 16 GLU N N 16 125.316 122.851 2.465 1
1 124 . 15 1 1 A 17 17 CYS H H 17 9.327 9.002 0.325 1
1 125 . 15 1 1 A 17 17 CYS HA H 17 4.804 5.393 -0.589 1
1 128 . 15 1 1 A 17 17 CYS C C 17 172.973 173.270 -0.297 1
1 129 . 15 1 1 A 17 17 CYS CA C 17 57.930 57.225 0.705 1
1 130 . 15 1 1 A 17 17 CYS CB C 17 30.105 30.991 -0.886 1
1 131 . 15 1 1 A 17 17 CYS N N 17 127.909 124.803 3.106 1
1 132 . 15 1 1 A 18 18 LYS H H 18 9.022 8.824 0.198 1
1 133 . 15 1 1 A 18 18 LYS HA H 18 4.769 5.154 -0.385 1
1 142 . 15 1 1 A 18 18 LYS C C 18 174.586 175.186 -0.600 1
1 143 . 15 1 1 A 18 18 LYS CA C 18 55.956 54.715 1.241 1
1 144 . 15 1 1 A 18 18 LYS CB C 18 32.203 34.896 -2.693 1
1 148 . 15 1 1 A 18 18 LYS N N 18 127.039 123.607 3.432 1
1 149 . 15 1 1 A 19 19 LEU H H 19 8.784 8.980 -0.196 1
1 150 . 15 1 1 A 19 19 LEU HA H 19 4.852 5.149 -0.297 1
1 160 . 15 1 1 A 19 19 LEU C C 19 176.862 176.014 0.848 1
1 161 . 15 1 1 A 19 19 LEU CA C 19 55.391 53.288 2.103 1
1 162 . 15 1 1 A 19 19 LEU CB C 19 44.442 44.925 -0.483 1
1 166 . 15 1 1 A 19 19 LEU N N 19 126.311 126.193 0.118 1
1 167 . 15 1 1 A 20 20 SER H H 20 8.215 8.907 -0.692 1
1 168 . 15 1 1 A 20 20 SER HA H 20 5.461 5.661 -0.200 1
1 171 . 15 1 1 A 20 20 SER C C 20 171.960 173.570 -1.610 1
1 172 . 15 1 1 A 20 20 SER CA C 20 57.525 56.738 0.787 1
1 173 . 15 1 1 A 20 20 SER CB C 20 65.794 65.750 0.044 1
1 174 . 15 1 1 A 20 20 SER N N 20 115.113 116.561 -1.448 1
1 175 . 15 1 1 A 21 21 LYS H H 21 9.001 8.720 0.281 1
1 176 . 15 1 1 A 21 21 LYS HA H 21 4.887 4.933 -0.046 1
1 185 . 15 1 1 A 21 21 LYS C C 21 174.133 174.908 -0.775 1
1 186 . 15 1 1 A 21 21 LYS CA C 21 53.840 54.206 -0.366 1
1 187 . 15 1 1 A 21 21 LYS CB C 21 36.553 35.788 0.765 1
1 191 . 15 1 1 A 21 21 LYS N N 21 120.938 121.106 -0.168 1
1 192 . 15 1 1 A 22 22 GLN H H 22 8.201 8.284 -0.083 1
1 193 . 15 1 1 A 22 22 GLN HA H 22 4.448 4.574 -0.126 1
1 200 . 15 1 1 A 22 22 GLN C C 22 176.372 175.333 1.039 1
1 201 . 15 1 1 A 22 22 GLN CA C 22 53.658 54.266 -0.608 1
1 202 . 15 1 1 A 22 22 GLN CB C 22 30.473 30.121 0.352 1
1 204 . 15 1 1 A 22 22 GLN N N 22 116.816 119.265 -2.449 1
1 206 . 15 1 1 A 23 23 GLU H H 23 8.624 8.549 0.075 1
1 207 . 15 1 1 A 23 23 GLU HA H 23 4.056 4.133 -0.077 1
1 212 . 15 1 1 A 23 23 GLU C C 23 177.778 177.030 0.748 1
1 213 . 15 1 1 A 23 23 GLU CA C 23 58.001 57.606 0.395 1
1 214 . 15 1 1 A 23 23 GLU CB C 23 29.237 29.076 0.161 1
1 216 . 15 1 1 A 23 23 GLU N N 23 122.364 121.230 1.134 1
1 217 . 15 1 1 A 24 24 GLY H H 24 8.962 8.822 0.140 1
1 218 . 15 1 1 A 24 24 GLY HA2 H 24 4.139 3.977 0.162 1
1 219 . 15 1 1 A 24 24 GLY HA3 H 24 3.711 3.979 -0.268 1
1 220 . 15 1 1 A 24 24 GLY C C 24 173.857 174.853 -0.996 1
1 221 . 15 1 1 A 24 24 GLY CA C 24 45.288 45.056 0.232 1
1 222 . 15 1 1 A 24 24 GLY N N 24 113.942 113.618 0.324 1
1 223 . 15 1 1 A 25 25 GLN H H 25 7.643 7.738 -0.095 1
1 224 . 15 1 1 A 25 25 GLN HA H 25 4.488 4.345 0.143 1
1 231 . 15 1 1 A 25 25 GLN C C 25 174.727 175.038 -0.311 1
1 232 . 15 1 1 A 25 25 GLN CA C 25 54.052 56.102 -2.050 1
1 233 . 15 1 1 A 25 25 GLN CB C 25 30.843 30.276 0.567 1
1 235 . 15 1 1 A 25 25 GLN N N 25 119.538 120.583 -1.045 1
1 237 . 15 1 1 A 26 26 ASN H H 26 8.625 8.919 -0.294 1
1 238 . 15 1 1 A 26 26 ASN HA H 26 4.862 4.998 -0.136 1
1 243 . 15 1 1 A 26 26 ASN C C 26 176.261 175.140 1.121 1
1 244 . 15 1 1 A 26 26 ASN CA C 26 51.812 51.797 0.015 1
1 245 . 15 1 1 A 26 26 ASN CB C 26 40.403 40.813 -0.410 1
1 246 . 15 1 1 A 26 26 ASN N N 26 120.047 118.672 1.375 1
1 248 . 15 1 1 A 27 27 TYR HA H 27 4.152 4.701 -0.549 1
1 255 . 15 1 1 A 27 27 TYR C C 27 176.731 176.109 0.622 1
1 256 . 15 1 1 A 27 27 TYR CA C 27 62.462 58.430 4.032 1
1 257 . 15 1 1 A 27 27 TYR CB C 27 40.240 39.230 1.010 1
1 262 . 15 1 1 A 27 27 TYR N N 27 121.761 120.761 1.000 1
1 263 . 15 1 1 A 28 28 GLY H H 28 8.285 8.156 0.129 1
1 264 . 15 1 1 A 28 28 GLY HA2 H 28 4.490 3.913 0.577 1
1 265 . 15 1 1 A 28 28 GLY HA3 H 28 3.759 3.993 -0.234 1
1 266 . 15 1 1 A 28 28 GLY C C 28 172.198 173.751 -1.553 1
1 267 . 15 1 1 A 28 28 GLY CA C 28 46.139 45.178 0.961 1
1 268 . 15 1 1 A 28 28 GLY N N 28 103.567 108.203 -4.636 1
1 269 . 15 1 1 A 29 29 PHE H H 29 6.878 7.872 -0.994 1
1 270 . 15 1 1 A 29 29 PHE HA H 29 5.179 4.850 0.329 1
1 278 . 15 1 1 A 29 29 PHE C C 29 172.840 173.748 -0.908 1
1 279 . 15 1 1 A 29 29 PHE CA C 29 55.262 55.075 0.187 1
1 280 . 15 1 1 A 29 29 PHE CB C 29 41.779 42.201 -0.422 1
1 286 . 15 1 1 A 29 29 PHE N N 29 111.027 117.417 -6.390 1
1 287 . 15 1 1 A 30 30 PHE H H 30 8.806 8.489 0.317 1
1 288 . 15 1 1 A 30 30 PHE HA H 30 4.923 4.656 0.267 1
1 296 . 15 1 1 A 30 30 PHE C C 30 174.501 175.399 -0.898 1
1 297 . 15 1 1 A 30 30 PHE CA C 30 55.356 55.977 -0.621 1
1 298 . 15 1 1 A 30 30 PHE CB C 30 41.681 42.852 -1.171 1
1 304 . 15 1 1 A 30 30 PHE N N 30 118.710 117.932 0.778 1
1 305 . 15 1 1 A 31 31 LEU H H 31 8.441 8.814 -0.373 1
1 306 . 15 1 1 A 31 31 LEU HA H 31 5.447 4.688 0.759 1
1 316 . 15 1 1 A 31 31 LEU C C 31 177.306 175.821 1.485 1
1 317 . 15 1 1 A 31 31 LEU CA C 31 53.610 54.736 -1.126 1
1 318 . 15 1 1 A 31 31 LEU CB C 31 43.696 40.941 2.755 1
1 322 . 15 1 1 A 31 31 LEU N N 31 123.765 124.566 -0.801 1
1 323 . 15 1 1 A 32 32 ARG H H 32 9.381 8.530 0.851 1
1 324 . 15 1 1 A 32 32 ARG HA H 32 4.840 4.763 0.077 1
1 331 . 15 1 1 A 32 32 ARG C C 32 175.155 175.965 -0.810 1
1 332 . 15 1 1 A 32 32 ARG CA C 32 54.210 54.678 -0.468 1
1 333 . 15 1 1 A 32 32 ARG CB C 32 35.087 32.735 2.352 1
1 336 . 15 1 1 A 32 32 ARG N N 32 123.160 124.444 -1.284 1
1 337 . 15 1 1 A 33 33 ILE H H 33 7.891 8.620 -0.729 1
1 338 . 15 1 1 A 33 33 ILE HA H 33 4.495 4.649 -0.154 1
1 348 . 15 1 1 A 33 33 ILE C C 33 175.850 175.776 0.074 1
1 349 . 15 1 1 A 33 33 ILE CA C 33 59.641 59.735 -0.094 1
1 350 . 15 1 1 A 33 33 ILE CB C 33 39.538 39.233 0.305 1
1 354 . 15 1 1 A 33 33 ILE N N 33 118.924 120.382 -1.458 1
1 355 . 15 1 1 A 34 34 GLU H H 34 8.971 8.561 0.410 1
1 356 . 15 1 1 A 34 34 GLU HA H 34 4.578 4.610 -0.032 1
1 361 . 15 1 1 A 34 34 GLU C C 34 175.766 176.800 -1.034 1
1 362 . 15 1 1 A 34 34 GLU CA C 34 54.263 54.670 -0.407 1
1 363 . 15 1 1 A 34 34 GLU CB C 34 32.128 31.078 1.050 1
1 365 . 15 1 1 A 34 34 GLU N N 34 125.447 122.914 2.533 1
1 366 . 15 1 1 A 35 35 LYS H H 35 8.504 8.615 -0.111 1
1 367 . 15 1 1 A 35 35 LYS HA H 35 4.026 4.306 -0.280 1
1 376 . 15 1 1 A 35 35 LYS C C 35 177.701 176.213 1.488 1
1 377 . 15 1 1 A 35 35 LYS CA C 35 57.591 56.354 1.237 1
1 378 . 15 1 1 A 35 35 LYS CB C 35 32.491 32.398 0.093 1
1 382 . 15 1 1 A 35 35 LYS N N 35 122.893 121.508 1.385 1
1 383 . 15 1 1 A 36 36 ASP H H 36 9.020 8.984 0.036 1
1 384 . 15 1 1 A 36 36 ASP HA H 36 4.385 4.154 0.231 1
1 387 . 15 1 1 A 36 36 ASP C C 36 174.554 174.633 -0.079 1
1 388 . 15 1 1 A 36 36 ASP CA C 36 55.868 55.260 0.608 1
1 389 . 15 1 1 A 36 36 ASP CB C 36 39.826 39.351 0.475 1
1 390 . 15 1 1 A 36 36 ASP N N 36 121.412 121.359 0.053 1
1 391 . 15 1 1 A 37 37 THR H H 37 7.464 7.507 -0.043 1
1 392 . 15 1 1 A 37 37 THR HA H 37 4.454 4.886 -0.432 1
1 397 . 15 1 1 A 37 37 THR C C 37 172.012 173.315 -1.303 1
1 398 . 15 1 1 A 37 37 THR CA C 37 61.686 60.826 0.860 1
1 399 . 15 1 1 A 37 37 THR CB C 37 70.927 72.337 -1.410 1
1 401 . 15 1 1 A 37 37 THR N N 37 113.147 112.142 1.005 1
1 402 . 15 1 1 A 38 38 ASP H H 38 8.931 8.854 0.077 1
1 403 . 15 1 1 A 38 38 ASP HA H 38 4.852 4.854 -0.002 1
1 406 . 15 1 1 A 38 38 ASP CA C 38 54.826 53.919 0.907 1
1 407 . 15 1 1 A 38 38 ASP CB C 38 43.332 42.557 0.775 1
1 408 . 15 1 1 A 38 38 ASP N N 38 120.401 123.615 -3.214 1
1 409 . 15 1 1 A 39 39 GLY H H 39 8.068 8.422 -0.354 1
1 410 . 15 1 1 A 39 39 GLY HA2 H 39 3.774 3.943 -0.169 1
1 411 . 15 1 1 A 39 39 GLY HA3 H 39 3.555 4.044 -0.489 1
1 412 . 15 1 1 A 39 39 GLY C C 39 172.578 173.497 -0.919 1
1 413 . 15 1 1 A 39 39 GLY CA C 39 43.967 44.642 -0.675 1
1 414 . 15 1 1 A 39 39 GLY N N 39 107.925 109.049 -1.124 1
1 415 . 15 1 1 A 40 40 HIS H H 40 9.111 8.681 0.430 1
1 416 . 15 1 1 A 40 40 HIS HA H 40 4.650 4.758 -0.108 1
1 421 . 15 1 1 A 40 40 HIS C C 40 174.330 174.817 -0.487 1
1 422 . 15 1 1 A 40 40 HIS CA C 40 55.886 56.600 -0.714 1
1 423 . 15 1 1 A 40 40 HIS CB C 40 30.507 29.980 0.527 1
1 426 . 15 1 1 A 40 40 HIS N N 40 119.179 119.341 -0.162 1
1 427 . 15 1 1 A 41 41 LEU H H 41 8.254 9.042 -0.788 1
1 428 . 15 1 1 A 41 41 LEU HA H 41 4.626 5.168 -0.542 1
1 438 . 15 1 1 A 41 41 LEU C C 41 176.035 176.795 -0.760 1
1 439 . 15 1 1 A 41 41 LEU CA C 41 55.621 53.453 2.168 1
1 440 . 15 1 1 A 41 41 LEU CB C 41 45.091 43.157 1.934 1
1 444 . 15 1 1 A 41 41 LEU N N 41 124.808 124.745 0.063 1
1 445 . 15 1 1 A 42 42 ILE H H 42 8.685 8.202 0.483 1
1 446 . 15 1 1 A 42 42 ILE HA H 42 4.578 4.432 0.146 1
1 456 . 15 1 1 A 42 42 ILE C C 42 175.369 175.852 -0.483 1
1 457 . 15 1 1 A 42 42 ILE CA C 42 59.852 61.456 -1.604 1
1 458 . 15 1 1 A 42 42 ILE CB C 42 36.778 38.201 -1.423 1
1 462 . 15 1 1 A 42 42 ILE N N 42 121.814 124.955 -3.141 1
1 463 . 15 1 1 A 43 43 ARG H H 43 8.787 8.553 0.234 1
1 464 . 15 1 1 A 43 43 ARG HA H 43 4.852 4.682 0.170 1
1 472 . 15 1 1 A 43 43 ARG C C 43 174.029 174.816 -0.787 1
1 473 . 15 1 1 A 43 43 ARG CA C 43 52.730 55.124 -2.394 1
1 474 . 15 1 1 A 43 43 ARG CB C 43 36.983 33.568 3.415 1
1 477 . 15 1 1 A 43 43 ARG N N 43 125.771 126.042 -0.271 1
1 479 . 15 1 1 A 44 44 VAL H H 44 8.661 8.574 0.087 1
1 480 . 15 1 1 A 44 44 VAL HA H 44 3.276 3.692 -0.416 1
1 488 . 15 1 1 A 44 44 VAL C C 44 173.227 175.017 -1.790 1
1 489 . 15 1 1 A 44 44 VAL CA C 44 63.161 63.130 0.031 1
1 490 . 15 1 1 A 44 44 VAL CB C 44 29.054 30.088 -1.034 1
1 493 . 15 1 1 A 44 44 VAL N N 44 117.026 119.899 -2.873 1
1 494 . 15 1 1 A 45 45 ILE H H 45 8.464 7.917 0.547 1
1 495 . 15 1 1 A 45 45 ILE HA H 45 4.579 4.085 0.494 1
1 505 . 15 1 1 A 45 45 ILE C C 45 178.108 175.006 3.102 1
1 506 . 15 1 1 A 45 45 ILE CA C 45 59.888 61.074 -1.186 1
1 507 . 15 1 1 A 45 45 ILE CB C 45 36.998 37.135 -0.137 1
1 511 . 15 1 1 A 45 45 ILE N N 45 122.767 122.304 0.463 1
1 512 . 15 1 1 A 46 46 GLU H H 46 9.015 8.392 0.623 1
1 513 . 15 1 1 A 46 46 GLU HA H 46 4.206 4.485 -0.279 1
1 518 . 15 1 1 A 46 46 GLU C C 46 177.746 176.276 1.470 1
1 519 . 15 1 1 A 46 46 GLU CA C 46 56.130 56.099 0.031 1
1 520 . 15 1 1 A 46 46 GLU CB C 46 30.581 30.369 0.212 1
1 522 . 15 1 1 A 46 46 GLU N N 46 131.076 128.715 2.361 1
1 523 . 15 1 1 A 47 47 GLU H H 47 9.213 8.772 0.441 1
1 524 . 15 1 1 A 47 47 GLU HA H 47 4.194 4.046 0.148 1
1 529 . 15 1 1 A 47 47 GLU C C 47 178.088 177.652 0.436 1
1 530 . 15 1 1 A 47 47 GLU CA C 47 58.212 58.057 0.155 1
1 531 . 15 1 1 A 47 47 GLU CB C 47 29.390 29.887 -0.497 1
1 533 . 15 1 1 A 47 47 GLU N N 47 129.592 124.634 4.958 1
1 534 . 15 1 1 A 48 48 GLY H H 48 9.586 9.024 0.562 1
1 535 . 15 1 1 A 48 48 GLY HA2 H 48 4.141 3.819 0.322 1
1 536 . 15 1 1 A 48 48 GLY HA3 H 48 3.757 3.821 -0.064 1
1 537 . 15 1 1 A 48 48 GLY C C 48 173.790 174.100 -0.310 1
1 538 . 15 1 1 A 48 48 GLY CA C 48 45.764 46.976 -1.212 1
1 539 . 15 1 1 A 48 48 GLY N N 48 114.819 114.611 0.208 1
1 540 . 15 1 1 A 49 49 SER H H 49 7.580 7.889 -0.309 1
1 541 . 15 1 1 A 49 49 SER HA H 49 4.728 4.927 -0.199 1
1 544 . 15 1 1 A 49 49 SER C C 49 173.542 174.273 -0.731 1
1 545 . 15 1 1 A 49 49 SER CA C 49 57.560 55.622 1.938 1
1 546 . 15 1 1 A 49 49 SER CB C 49 64.529 64.214 0.315 1
1 547 . 15 1 1 A 49 49 SER N N 49 114.688 113.550 1.138 1
1 548 . 15 1 1 A 50 50 PRO HA H 50 4.431 4.553 -0.122 1
1 555 . 15 1 1 A 50 50 PRO C C 50 179.377 177.510 1.867 1
1 556 . 15 1 1 A 50 50 PRO CA C 50 66.059 64.207 1.852 1
1 557 . 15 1 1 A 50 50 PRO CB C 50 32.598 31.815 0.783 1
1 560 . 15 1 1 A 51 51 ALA H H 51 8.264 7.980 0.284 1
1 561 . 15 1 1 A 51 51 ALA HA H 51 3.817 3.981 -0.164 1
1 565 . 15 1 1 A 51 51 ALA C C 51 177.508 179.849 -2.341 1
1 566 . 15 1 1 A 51 51 ALA CA C 51 55.392 54.936 0.456 1
1 567 . 15 1 1 A 51 51 ALA CB C 51 20.474 18.714 1.760 1
1 568 . 15 1 1 A 51 51 ALA N N 51 117.604 120.589 -2.985 1
1 569 . 15 1 1 A 52 52 GLU H H 52 7.794 7.515 0.279 1
1 570 . 15 1 1 A 52 52 GLU HA H 52 3.881 4.026 -0.145 1
1 575 . 15 1 1 A 52 52 GLU C C 52 181.401 178.464 2.937 1
1 576 . 15 1 1 A 52 52 GLU CA C 52 59.454 58.460 0.994 1
1 577 . 15 1 1 A 52 52 GLU CB C 52 30.247 29.295 0.952 1
1 579 . 15 1 1 A 52 52 GLU N N 52 119.474 118.920 0.554 1
1 580 . 15 1 1 A 53 53 LYS H H 53 8.557 7.769 0.788 1
1 581 . 15 1 1 A 53 53 LYS HA H 53 4.020 4.032 -0.012 1
1 588 . 15 1 1 A 53 53 LYS C C 53 177.939 179.035 -1.096 1
1 589 . 15 1 1 A 53 53 LYS CA C 53 59.012 59.055 -0.043 1
1 590 . 15 1 1 A 53 53 LYS CB C 53 32.438 32.179 0.259 1
1 594 . 15 1 1 A 53 53 LYS N N 53 120.057 119.438 0.619 1
1 595 . 15 1 1 A 54 54 ALA H H 54 7.764 7.469 0.295 1
1 596 . 15 1 1 A 54 54 ALA HA H 54 4.400 4.286 0.114 1
1 600 . 15 1 1 A 54 54 ALA C C 54 177.658 177.662 -0.004 1
1 601 . 15 1 1 A 54 54 ALA CA C 54 52.412 52.146 0.266 1
1 602 . 15 1 1 A 54 54 ALA CB C 54 20.739 19.177 1.562 1
1 603 . 15 1 1 A 54 54 ALA N N 54 117.678 118.597 -0.919 1
1 604 . 15 1 1 A 55 55 GLY H H 55 7.583 8.029 -0.446 1
1 605 . 15 1 1 A 55 55 GLY HA2 H 55 4.266 3.991 0.275 1
1 606 . 15 1 1 A 55 55 GLY HA3 H 55 3.775 3.995 -0.220 1
1 607 . 15 1 1 A 55 55 GLY C C 55 175.232 174.136 1.096 1
1 608 . 15 1 1 A 55 55 GLY CA C 55 45.368 45.182 0.186 1
1 609 . 15 1 1 A 55 55 GLY N N 55 103.265 106.375 -3.110 1
1 610 . 15 1 1 A 56 56 LEU H H 56 7.280 7.417 -0.137 1
1 611 . 15 1 1 A 56 56 LEU HA H 56 3.984 4.496 -0.512 1
1 621 . 15 1 1 A 56 56 LEU C C 56 174.708 175.962 -1.254 1
1 622 . 15 1 1 A 56 56 LEU CA C 56 55.603 54.323 1.280 1
1 623 . 15 1 1 A 56 56 LEU CB C 56 42.752 42.645 0.107 1
1 627 . 15 1 1 A 56 56 LEU N N 56 119.211 123.192 -3.981 1
1 628 . 15 1 1 A 57 57 LEU H H 57 8.693 8.531 0.162 1
1 629 . 15 1 1 A 57 57 LEU HA H 57 4.499 5.026 -0.527 1
1 639 . 15 1 1 A 57 57 LEU C C 57 176.124 175.601 0.523 1
1 640 . 15 1 1 A 57 57 LEU CA C 57 52.959 52.778 0.181 1
1 641 . 15 1 1 A 57 57 LEU CB C 57 45.122 44.695 0.427 1
1 645 . 15 1 1 A 57 57 LEU N N 57 121.969 122.810 -0.841 1
1 646 . 15 1 1 A 58 58 ASP H H 58 8.334 8.658 -0.324 1
1 647 . 15 1 1 A 58 58 ASP HA H 58 4.139 4.660 -0.521 1
1 650 . 15 1 1 A 58 58 ASP C C 58 178.636 176.874 1.762 1
1 651 . 15 1 1 A 58 58 ASP CA C 58 56.079 54.765 1.314 1
1 652 . 15 1 1 A 58 58 ASP CB C 58 42.135 41.300 0.835 1
1 653 . 15 1 1 A 58 58 ASP N N 58 120.401 122.634 -2.233 1
1 654 . 15 1 1 A 59 59 GLY H H 59 9.378 8.483 0.895 1
1 655 . 15 1 1 A 59 59 GLY HA2 H 59 4.317 3.960 0.357 1
1 656 . 15 1 1 A 59 59 GLY HA3 H 59 3.260 3.964 -0.704 1
1 657 . 15 1 1 A 59 59 GLY C C 59 173.359 173.948 -0.589 1
1 658 . 15 1 1 A 59 59 GLY CA C 59 45.517 44.994 0.523 1
1 659 . 15 1 1 A 59 59 GLY N N 59 116.622 114.026 2.596 1
1 660 . 15 1 1 A 60 60 ASP H H 60 8.009 7.927 0.082 1
1 661 . 15 1 1 A 60 60 ASP HA H 60 4.638 4.698 -0.060 1
1 664 . 15 1 1 A 60 60 ASP C C 60 175.555 175.470 0.085 1
1 665 . 15 1 1 A 60 60 ASP CA C 60 55.286 53.756 1.530 1
1 666 . 15 1 1 A 60 60 ASP CB C 60 42.381 41.577 0.804 1
1 667 . 15 1 1 A 60 60 ASP N N 60 121.370 120.565 0.805 1
1 668 . 15 1 1 A 61 61 ARG H H 61 8.648 8.625 0.023 1
1 669 . 15 1 1 A 61 61 ARG HA H 61 5.179 5.056 0.123 1
1 677 . 15 1 1 A 61 61 ARG C C 61 177.381 175.066 2.315 1
1 678 . 15 1 1 A 61 61 ARG CA C 61 53.704 54.878 -1.174 1
1 679 . 15 1 1 A 61 61 ARG CB C 61 34.017 31.261 2.756 1
1 682 . 15 1 1 A 61 61 ARG N N 61 116.958 123.380 -6.422 1
1 684 . 15 1 1 A 62 62 VAL H H 62 8.247 8.325 -0.078 1
1 685 . 15 1 1 A 62 62 VAL HA H 62 3.806 4.378 -0.572 1
1 693 . 15 1 1 A 62 62 VAL C C 62 174.748 175.161 -0.413 1
1 694 . 15 1 1 A 62 62 VAL CA C 62 63.149 62.518 0.631 1
1 695 . 15 1 1 A 62 62 VAL CB C 62 32.574 32.604 -0.030 1
1 698 . 15 1 1 A 62 62 VAL N N 62 118.546 126.229 -7.683 1
1 699 . 15 1 1 A 63 63 LEU H H 63 9.262 9.516 -0.254 1
1 700 . 15 1 1 A 63 63 LEU HA H 63 4.412 4.234 0.178 1
1 710 . 15 1 1 A 63 63 LEU C C 63 177.649 176.945 0.704 1
1 711 . 15 1 1 A 63 63 LEU CA C 63 56.044 56.305 -0.261 1
1 712 . 15 1 1 A 63 63 LEU CB C 63 43.339 42.566 0.773 1
1 716 . 15 1 1 A 63 63 LEU N N 63 125.413 130.536 -5.123 1
1 717 . 15 1 1 A 64 64 ARG H H 64 7.806 7.610 0.196 1
1 718 . 15 1 1 A 64 64 ARG HA H 64 5.704 4.932 0.772 1
1 726 . 15 1 1 A 64 64 ARG C C 64 175.091 173.971 1.120 1
1 727 . 15 1 1 A 64 64 ARG CA C 64 54.148 54.583 -0.435 1
1 728 . 15 1 1 A 64 64 ARG CB C 64 35.742 33.948 1.794 1
1 731 . 15 1 1 A 64 64 ARG N N 64 112.961 116.917 -3.956 1
1 733 . 15 1 1 A 65 65 ILE H H 65 8.327 9.143 -0.816 1
1 734 . 15 1 1 A 65 65 ILE HA H 65 4.384 4.621 -0.237 1
1 744 . 15 1 1 A 65 65 ILE C C 65 175.722 175.569 0.153 1
1 745 . 15 1 1 A 65 65 ILE CA C 65 60.501 59.164 1.337 1
1 746 . 15 1 1 A 65 65 ILE CB C 65 39.547 40.085 -0.538 1
1 750 . 15 1 1 A 65 65 ILE N N 65 119.175 123.278 -4.103 1
1 751 . 15 1 1 A 66 66 ASN H H 66 9.911 9.345 0.566 1
1 752 . 15 1 1 A 66 66 ASN HA H 66 4.428 4.368 0.060 1
1 757 . 15 1 1 A 66 66 ASN C C 66 175.349 174.639 0.710 1
1 758 . 15 1 1 A 66 66 ASN CA C 66 54.157 54.185 -0.028 1
1 759 . 15 1 1 A 66 66 ASN CB C 66 37.024 37.465 -0.441 1
1 760 . 15 1 1 A 66 66 ASN N N 66 128.952 128.224 0.728 1
1 762 . 15 1 1 A 67 67 GLY H H 67 9.230 8.651 0.579 1
1 763 . 15 1 1 A 67 67 GLY HA2 H 67 4.322 3.983 0.339 1
1 764 . 15 1 1 A 67 67 GLY HA3 H 67 3.508 3.993 -0.485 1
1 765 . 15 1 1 A 67 67 GLY C C 67 174.393 173.980 0.413 1
1 766 . 15 1 1 A 67 67 GLY CA C 67 45.341 46.501 -1.160 1
1 767 . 15 1 1 A 67 67 GLY N N 67 103.238 104.675 -1.437 1
1 768 . 15 1 1 A 68 68 VAL H H 68 8.063 7.724 0.339 1
1 769 . 15 1 1 A 68 68 VAL HA H 68 4.015 4.661 -0.646 1
1 777 . 15 1 1 A 68 68 VAL C C 68 175.833 174.687 1.146 1
1 778 . 15 1 1 A 68 68 VAL CA C 68 62.603 61.246 1.357 1
1 779 . 15 1 1 A 68 68 VAL CB C 68 32.574 35.463 -2.889 1
1 782 . 15 1 1 A 68 68 VAL N N 68 125.696 119.426 6.270 1
1 783 . 15 1 1 A 69 69 PHE H H 69 9.301 9.163 0.138 1
1 784 . 15 1 1 A 69 69 PHE HA H 69 4.947 4.608 0.339 1
1 792 . 15 1 1 A 69 69 PHE C C 69 177.120 175.852 1.268 1
1 793 . 15 1 1 A 69 69 PHE CA C 69 59.200 57.891 1.309 1
1 794 . 15 1 1 A 69 69 PHE CB C 69 39.320 39.318 0.002 1
1 800 . 15 1 1 A 69 69 PHE N N 69 128.641 129.060 -0.419 1
1 801 . 15 1 1 A 70 70 VAL H H 70 8.312 7.849 0.463 1
1 802 . 15 1 1 A 70 70 VAL HA H 70 4.517 4.541 -0.024 1
1 810 . 15 1 1 A 70 70 VAL CA C 70 60.734 60.690 0.044 1
1 811 . 15 1 1 A 70 70 VAL CB C 70 32.976 31.623 1.353 1
1 814 . 15 1 1 A 70 70 VAL N N 70 118.381 119.956 -1.575 1
1 815 . 15 1 1 A 71 71 ASP H H 71 5.373 7.536 -2.163 1
1 816 . 15 1 1 A 71 71 ASP HA H 71 4.413 4.105 0.308 1
1 819 . 15 1 1 A 71 71 ASP C C 71 174.896 178.328 -3.432 1
1 820 . 15 1 1 A 71 71 ASP CA C 71 58.334 57.687 0.647 1
1 821 . 15 1 1 A 71 71 ASP CB C 71 46.097 41.089 5.008 1
1 822 . 15 1 1 A 71 71 ASP N N 71 119.008 122.759 -3.751 1
1 823 . 15 1 1 A 72 72 LYS H H 72 7.874 7.965 -0.091 1
1 824 . 15 1 1 A 72 72 LYS HA H 72 4.522 4.199 0.323 1
1 833 . 15 1 1 A 72 72 LYS C C 72 177.209 177.102 0.107 1
1 834 . 15 1 1 A 72 72 LYS CA C 72 54.122 58.543 -4.421 1
1 835 . 15 1 1 A 72 72 LYS CB C 72 31.640 32.099 -0.459 1
1 839 . 15 1 1 A 72 72 LYS N N 72 110.259 118.942 -8.683 1
1 840 . 15 1 1 A 73 73 GLU H H 73 7.421 7.889 -0.468 1
1 841 . 15 1 1 A 73 73 GLU HA H 73 4.401 4.405 -0.004 1
1 846 . 15 1 1 A 73 73 GLU C C 73 176.728 175.693 1.035 1
1 847 . 15 1 1 A 73 73 GLU CA C 73 54.950 57.014 -2.064 1
1 848 . 15 1 1 A 73 73 GLU CB C 73 30.390 30.675 -0.285 1
1 850 . 15 1 1 A 73 73 GLU N N 73 120.043 119.214 0.829 1
1 851 . 15 1 1 A 74 74 GLU H H 74 9.360 8.532 0.828 1
1 852 . 15 1 1 A 74 74 GLU HA H 74 4.403 4.919 -0.516 1
1 857 . 15 1 1 A 74 74 GLU C C 74 178.234 176.846 1.388 1
1 858 . 15 1 1 A 74 74 GLU CA C 74 56.516 55.256 1.260 1
1 859 . 15 1 1 A 74 74 GLU CB C 74 30.390 32.229 -1.839 1
1 861 . 15 1 1 A 74 74 GLU N N 74 122.193 121.868 0.325 1
1 862 . 15 1 1 A 75 75 HIS H H 75 9.553 9.252 0.301 1
1 863 . 15 1 1 A 75 75 HIS HA H 75 4.080 4.182 -0.102 1
1 868 . 15 1 1 A 75 75 HIS C C 75 175.985 176.649 -0.664 1
1 869 . 15 1 1 A 75 75 HIS CA C 75 61.016 60.650 0.366 1
1 870 . 15 1 1 A 75 75 HIS CB C 75 29.468 30.540 -1.072 1
1 873 . 15 1 1 A 75 75 HIS N N 75 123.587 127.319 -3.732 1
1 874 . 15 1 1 A 76 76 ALA H H 76 9.129 8.227 0.902 1
1 875 . 15 1 1 A 76 76 ALA HA H 76 3.826 3.834 -0.008 1
1 879 . 15 1 1 A 76 76 ALA C C 76 180.475 179.729 0.746 1
1 880 . 15 1 1 A 76 76 ALA CA C 76 55.392 54.999 0.393 1
1 881 . 15 1 1 A 76 76 ALA CB C 76 18.182 18.333 -0.151 1
1 882 . 15 1 1 A 76 76 ALA N N 76 117.795 120.744 -2.949 1
1 883 . 15 1 1 A 77 77 GLN H H 77 7.099 8.098 -0.999 1
1 884 . 15 1 1 A 77 77 GLN HA H 77 4.198 4.045 0.153 1
1 891 . 15 1 1 A 77 77 GLN C C 77 177.860 178.827 -0.967 1
1 892 . 15 1 1 A 77 77 GLN CA C 77 57.790 58.911 -1.121 1
1 893 . 15 1 1 A 77 77 GLN CB C 77 28.536 28.435 0.101 1
1 895 . 15 1 1 A 77 77 GLN N N 77 115.764 117.732 -1.968 1
1 897 . 15 1 1 A 78 78 VAL H H 78 7.430 7.861 -0.431 1
1 898 . 15 1 1 A 78 78 VAL HA H 78 3.241 3.515 -0.274 1
1 906 . 15 1 1 A 78 78 VAL C C 78 177.042 177.663 -0.621 1
1 907 . 15 1 1 A 78 78 VAL CA C 78 67.299 66.458 0.841 1
1 908 . 15 1 1 A 78 78 VAL CB C 78 30.819 31.370 -0.551 1
1 911 . 15 1 1 A 78 78 VAL N N 78 121.143 120.172 0.971 1
1 912 . 15 1 1 A 79 79 VAL H H 79 7.773 8.248 -0.475 1
1 913 . 15 1 1 A 79 79 VAL HA H 79 3.315 3.590 -0.275 1
1 921 . 15 1 1 A 79 79 VAL C C 79 179.179 177.518 1.661 1
1 922 . 15 1 1 A 79 79 VAL CA C 79 66.694 65.311 1.383 1
1 923 . 15 1 1 A 79 79 VAL CB C 79 31.841 31.088 0.753 1
1 926 . 15 1 1 A 79 79 VAL N N 79 117.473 119.746 -2.273 1
1 927 . 15 1 1 A 80 80 GLU H H 80 7.410 8.069 -0.659 1
1 928 . 15 1 1 A 80 80 GLU HA H 80 4.258 4.088 0.170 1
1 933 . 15 1 1 A 80 80 GLU C C 80 178.018 179.335 -1.317 1
1 934 . 15 1 1 A 80 80 GLU CA C 80 58.566 58.578 -0.012 1
1 935 . 15 1 1 A 80 80 GLU CB C 80 29.072 29.659 -0.587 1
1 937 . 15 1 1 A 80 80 GLU N N 80 120.451 121.245 -0.794 1
1 938 . 15 1 1 A 81 81 LEU H H 81 8.070 8.328 -0.258 1
1 939 . 15 1 1 A 81 81 LEU HA H 81 3.976 4.046 -0.070 1
1 949 . 15 1 1 A 81 81 LEU C C 81 180.658 178.952 1.706 1
1 950 . 15 1 1 A 81 81 LEU CA C 81 58.061 57.814 0.247 1
1 951 . 15 1 1 A 81 81 LEU CB C 81 42.115 41.701 0.414 1
1 955 . 15 1 1 A 81 81 LEU N N 81 119.943 120.735 -0.792 1
1 956 . 15 1 1 A 82 82 VAL H H 82 7.609 7.944 -0.335 1
1 957 . 15 1 1 A 82 82 VAL HA H 82 3.474 3.501 -0.027 1
1 965 . 15 1 1 A 82 82 VAL C C 82 178.927 177.936 0.991 1
1 966 . 15 1 1 A 82 82 VAL CA C 82 67.398 66.948 0.450 1
1 967 . 15 1 1 A 82 82 VAL CB C 82 31.306 31.449 -0.143 1
1 970 . 15 1 1 A 82 82 VAL N N 82 118.150 118.361 -0.211 1
1 971 . 15 1 1 A 83 83 ARG H H 83 8.186 8.216 -0.030 1
1 972 . 15 1 1 A 83 83 ARG HA H 83 3.994 4.091 -0.097 1
1 979 . 15 1 1 A 83 83 ARG C C 83 179.999 178.708 1.291 1
1 980 . 15 1 1 A 83 83 ARG CA C 83 60.205 58.946 1.259 1
1 981 . 15 1 1 A 83 83 ARG CB C 83 30.103 30.192 -0.089 1
1 984 . 15 1 1 A 83 83 ARG N N 83 122.902 120.408 2.494 1
1 985 . 15 1 1 A 84 84 LYS H H 84 8.772 7.971 0.801 1
1 986 . 15 1 1 A 84 84 LYS HA H 84 4.047 4.074 -0.027 1
1 995 . 15 1 1 A 84 84 LYS C C 84 176.934 179.424 -2.490 1
1 996 . 15 1 1 A 84 84 LYS CA C 84 58.142 59.286 -1.144 1
1 997 . 15 1 1 A 84 84 LYS CB C 84 32.492 32.423 0.069 1
1 1001 . 15 1 1 A 84 84 LYS N N 84 117.548 119.986 -2.438 1
1 1002 . 15 1 1 A 85 85 SER H H 85 7.333 8.341 -1.008 1
1 1003 . 15 1 1 A 85 85 SER HA H 85 4.235 4.257 -0.022 1
1 1006 . 15 1 1 A 85 85 SER C C 85 175.588 175.224 0.364 1
1 1007 . 15 1 1 A 85 85 SER CA C 85 59.535 61.896 -2.361 1
1 1008 . 15 1 1 A 85 85 SER CB C 85 63.571 63.767 -0.196 1
1 1009 . 15 1 1 A 85 85 SER N N 85 113.544 116.365 -2.821 1
1 1010 . 15 1 1 A 86 86 GLY H H 86 7.459 7.808 -0.349 1
1 1011 . 15 1 1 A 86 86 GLY HA2 H 86 4.176 4.124 0.052 1
1 1012 . 15 1 1 A 86 86 GLY HA3 H 86 3.762 4.125 -0.363 1
1 1013 . 15 1 1 A 86 86 GLY C C 86 176.407 175.442 0.965 1
1 1014 . 15 1 1 A 86 86 GLY CA C 86 46.109 44.388 1.721 1
1 1015 . 15 1 1 A 86 86 GLY N N 86 104.331 107.415 -3.084 1
1 1016 . 15 1 1 A 87 87 ASN HA H 87 4.650 4.523 0.127 1
1 1021 . 15 1 1 A 87 87 ASN C C 87 173.653 175.948 -2.295 1
1 1022 . 15 1 1 A 87 87 ASN CA C 87 54.492 55.931 -1.439 1
1 1023 . 15 1 1 A 87 87 ASN CB C 87 38.425 39.106 -0.681 1
1 1024 . 15 1 1 A 87 87 ASN N N 87 118.401 124.565 -6.164 1
1 1026 . 15 1 1 A 88 88 SER H H 88 7.435 7.965 -0.530 1
1 1027 . 15 1 1 A 88 88 SER HA H 88 5.438 5.019 0.419 1
1 1030 . 15 1 1 A 88 88 SER C C 88 172.867 173.685 -0.818 1
1 1031 . 15 1 1 A 88 88 SER CA C 88 58.160 56.678 1.482 1
1 1032 . 15 1 1 A 88 88 SER CB C 88 65.861 65.173 0.688 1
1 1033 . 15 1 1 A 88 88 SER N N 88 113.765 112.044 1.721 1
1 1034 . 15 1 1 A 89 89 VAL H H 89 8.452 8.501 -0.049 1
1 1035 . 15 1 1 A 89 89 VAL HA H 89 4.519 4.802 -0.283 1
1 1043 . 15 1 1 A 89 89 VAL C C 89 171.391 174.607 -3.216 1
1 1044 . 15 1 1 A 89 89 VAL CA C 89 61.333 60.568 0.765 1
1 1045 . 15 1 1 A 89 89 VAL CB C 89 33.897 35.995 -2.098 1
1 1048 . 15 1 1 A 89 89 VAL N N 89 120.001 121.928 -1.927 1
1 1049 . 15 1 1 A 90 90 THR H H 90 8.348 8.757 -0.409 1
1 1050 . 15 1 1 A 90 90 THR HA H 90 5.042 5.180 -0.138 1
1 1055 . 15 1 1 A 90 90 THR C C 90 173.926 173.553 0.373 1
1 1056 . 15 1 1 A 90 90 THR CA C 90 61.403 61.280 0.123 1
1 1057 . 15 1 1 A 90 90 THR CB C 90 69.553 70.918 -1.365 1
1 1059 . 15 1 1 A 90 90 THR N N 90 123.477 122.489 0.988 1
1 1060 . 15 1 1 A 91 91 LEU H H 91 9.195 8.619 0.576 1
1 1061 . 15 1 1 A 91 91 LEU HA H 91 5.161 4.887 0.274 1
1 1071 . 15 1 1 A 91 91 LEU C C 91 174.564 175.265 -0.701 1
1 1072 . 15 1 1 A 91 91 LEU CA C 91 52.590 53.703 -1.113 1
1 1073 . 15 1 1 A 91 91 LEU CB C 91 44.998 45.849 -0.851 1
1 1077 . 15 1 1 A 91 91 LEU N N 91 128.419 125.175 3.244 1
1 1078 . 15 1 1 A 92 92 LEU H H 92 8.644 8.505 0.139 1
1 1079 . 15 1 1 A 92 92 LEU HA H 92 5.335 5.193 0.142 1
1 1089 . 15 1 1 A 92 92 LEU C C 92 176.451 175.987 0.464 1
1 1090 . 15 1 1 A 92 92 LEU CA C 92 54.220 53.506 0.714 1
1 1091 . 15 1 1 A 92 92 LEU CB C 92 44.323 42.559 1.764 1
1 1095 . 15 1 1 A 92 92 LEU N N 92 125.894 124.722 1.172 1
1 1096 . 15 1 1 A 93 93 VAL H H 93 9.249 9.067 0.182 1
1 1097 . 15 1 1 A 93 93 VAL HA H 93 5.573 5.109 0.464 1
1 1105 . 15 1 1 A 93 93 VAL C C 93 173.550 174.129 -0.579 1
1 1106 . 15 1 1 A 93 93 VAL CA C 93 58.340 60.170 -1.830 1
1 1107 . 15 1 1 A 93 93 VAL CB C 93 36.159 33.685 2.474 1
1 1110 . 15 1 1 A 93 93 VAL N N 93 120.660 120.787 -0.127 1
1 1111 . 15 1 1 A 94 94 LEU H H 94 8.634 8.431 0.203 1
1 1112 . 15 1 1 A 94 94 LEU HA H 94 4.911 4.846 0.065 1
1 1122 . 15 1 1 A 94 94 LEU C C 94 174.172 176.134 -1.962 1
1 1123 . 15 1 1 A 94 94 LEU CA C 94 52.659 53.359 -0.700 1
1 1124 . 15 1 1 A 94 94 LEU CB C 94 47.910 44.776 3.134 1
1 1128 . 15 1 1 A 94 94 LEU N N 94 120.304 127.274 -6.970 1
1 1129 . 15 1 1 A 95 95 ASP H H 95 8.210 8.807 -0.597 1
1 1130 . 15 1 1 A 95 95 ASP HA H 95 5.190 4.620 0.570 1
1 1133 . 15 1 1 A 95 95 ASP C C 95 175.887 177.950 -2.063 1
1 1134 . 15 1 1 A 95 95 ASP CA C 95 53.899 54.558 -0.659 1
1 1135 . 15 1 1 A 95 95 ASP CB C 95 41.188 41.120 0.068 1
1 1136 . 15 1 1 A 95 95 ASP N N 95 122.184 123.441 -1.257 1
1 1137 . 15 1 1 A 96 96 GLY H H 96 8.478 8.855 -0.377 1
1 1138 . 15 1 1 A 96 96 GLY HA2 H 96 4.002 3.824 0.178 1
1 1139 . 15 1 1 A 96 96 GLY HA3 H 96 3.757 3.832 -0.075 1
1 1140 . 15 1 1 A 96 96 GLY C C 96 175.497 175.535 -0.038 1
1 1141 . 15 1 1 A 96 96 GLY CA C 96 49.944 47.417 2.527 1
1 1142 . 15 1 1 A 96 96 GLY N N 96 108.610 110.798 -2.188 1
1 1143 . 15 1 1 A 97 97 ASP H H 97 8.401 8.440 -0.039 1
1 1144 . 15 1 1 A 97 97 ASP HA H 97 4.454 4.382 0.072 1
1 1147 . 15 1 1 A 97 97 ASP C C 97 179.612 178.446 1.166 1
1 1148 . 15 1 1 A 97 97 ASP CA C 97 57.913 57.527 0.386 1
1 1149 . 15 1 1 A 97 97 ASP CB C 97 41.145 41.648 -0.503 1
1 1150 . 15 1 1 A 97 97 ASP N N 97 120.034 122.497 -2.463 1
1 1151 . 15 1 1 A 98 98 SER H H 98 8.152 8.141 0.011 1
1 1152 . 15 1 1 A 98 98 SER HA H 98 4.218 4.200 0.018 1
1 1155 . 15 1 1 A 98 98 SER C C 98 175.061 175.920 -0.859 1
1 1156 . 15 1 1 A 98 98 SER CA C 98 62.180 62.370 -0.190 1
1 1157 . 15 1 1 A 98 98 SER CB C 98 62.179 62.778 -0.599 1
1 1158 . 15 1 1 A 98 98 SER N N 98 117.174 115.982 1.192 1
1 1159 . 15 1 1 A 99 99 TYR H H 99 9.051 8.460 0.591 1
1 1160 . 15 1 1 A 99 99 TYR HA H 99 3.692 3.879 -0.187 1
1 1167 . 15 1 1 A 99 99 TYR C C 99 176.460 177.392 -0.932 1
1 1168 . 15 1 1 A 99 99 TYR CA C 99 62.814 61.427 1.387 1
1 1169 . 15 1 1 A 99 99 TYR CB C 99 38.829 38.431 0.398 1
1 1174 . 15 1 1 A 99 99 TYR N N 99 123.539 122.465 1.074 1
1 1175 . 15 1 1 A 100 100 GLU H H 100 8.520 8.032 0.488 1
1 1176 . 15 1 1 A 100 100 GLU HA H 100 3.952 3.909 0.043 1
1 1181 . 15 1 1 A 100 100 GLU C C 100 180.151 179.018 1.133 1
1 1182 . 15 1 1 A 100 100 GLU CA C 100 60.099 59.683 0.416 1
1 1183 . 15 1 1 A 100 100 GLU CB C 100 29.435 29.009 0.426 1
1 1185 . 15 1 1 A 100 100 GLU N N 100 117.082 118.132 -1.050 1
1 1186 . 15 1 1 A 101 101 LYS H H 101 7.740 8.173 -0.433 1
1 1187 . 15 1 1 A 101 101 LYS HA H 101 3.984 4.065 -0.081 1
1 1196 . 15 1 1 A 101 101 LYS C C 101 178.377 178.142 0.235 1
1 1197 . 15 1 1 A 101 101 LYS CA C 101 59.888 59.433 0.455 1
1 1198 . 15 1 1 A 101 101 LYS CB C 101 32.821 32.415 0.406 1
1 1202 . 15 1 1 A 101 101 LYS N N 101 119.851 121.260 -1.409 1
1 1203 . 15 1 1 A 102 102 ALA H H 102 8.538 8.365 0.173 1
1 1204 . 15 1 1 A 102 102 ALA HA H 102 3.632 4.134 -0.502 1
1 1208 . 15 1 1 A 102 102 ALA C C 102 179.870 180.092 -0.222 1
1 1209 . 15 1 1 A 102 102 ALA CA C 102 55.285 55.079 0.206 1
1 1210 . 15 1 1 A 102 102 ALA CB C 102 17.163 17.922 -0.759 1
1 1211 . 15 1 1 A 102 102 ALA N N 102 124.176 120.484 3.692 1
1 1212 . 15 1 1 A 103 103 VAL H H 103 8.147 8.013 0.134 1
1 1213 . 15 1 1 A 103 103 VAL HA H 103 3.658 3.433 0.225 1
1 1221 . 15 1 1 A 103 103 VAL C C 103 181.113 178.200 2.913 1
1 1222 . 15 1 1 A 103 103 VAL CA C 103 66.090 66.947 -0.857 1
1 1223 . 15 1 1 A 103 103 VAL CB C 103 31.822 31.195 0.627 1
1 1226 . 15 1 1 A 103 103 VAL N N 103 117.841 117.977 -0.136 1
1 1227 . 15 1 1 A 104 104 LYS H H 104 7.903 7.765 0.138 1
1 1228 . 15 1 1 A 104 104 LYS HA H 104 4.065 3.994 0.071 1
1 1235 . 15 1 1 A 104 104 LYS C C 104 177.715 178.424 -0.709 1
1 1236 . 15 1 1 A 104 104 LYS CA C 104 59.094 58.787 0.307 1
1 1237 . 15 1 1 A 104 104 LYS CB C 104 32.285 31.731 0.554 1
1 1241 . 15 1 1 A 104 104 LYS N N 104 121.515 120.104 1.411 1
1 1242 . 15 1 1 A 105 105 ASN H H 105 7.747 8.204 -0.457 1
1 1243 . 15 1 1 A 105 105 ASN HA H 105 4.721 4.822 -0.101 1
1 1248 . 15 1 1 A 105 105 ASN C C 105 173.320 174.387 -1.067 1
1 1249 . 15 1 1 A 105 105 ASN CA C 105 53.399 52.883 0.516 1
1 1250 . 15 1 1 A 105 105 ASN CB C 105 39.249 38.606 0.643 1
1 1251 . 15 1 1 A 105 105 ASN N N 105 114.941 114.422 0.519 1
1 1253 . 15 1 1 A 106 106 GLN H H 106 7.850 7.650 0.200 1
1 1254 . 15 1 1 A 106 106 GLN HA H 106 3.902 3.906 -0.004 1
1 1261 . 15 1 1 A 106 106 GLN C C 106 175.168 174.762 0.406 1
1 1262 . 15 1 1 A 106 106 GLN CA C 106 56.978 56.911 0.067 1
1 1263 . 15 1 1 A 106 106 GLN CB C 106 25.770 26.760 -0.990 1
1 1265 . 15 1 1 A 106 106 GLN N N 106 114.989 115.655 -0.666 1
1 1267 . 15 1 1 A 107 107 VAL H H 107 8.005 7.527 0.478 1
1 1268 . 15 1 1 A 107 107 VAL HA H 107 3.664 4.055 -0.391 1
1 1276 . 15 1 1 A 107 107 VAL C C 107 175.468 175.580 -0.112 1
1 1277 . 15 1 1 A 107 107 VAL CA C 107 62.726 62.530 0.196 1
1 1278 . 15 1 1 A 107 107 VAL CB C 107 32.535 32.927 -0.392 1
1 1281 . 15 1 1 A 107 107 VAL N N 107 120.216 119.277 0.939 1
1 1282 . 15 1 1 A 108 108 ASP H H 108 8.484 8.793 -0.309 1
1 1283 . 15 1 1 A 108 108 ASP HA H 108 4.467 4.683 -0.216 1
1 1286 . 15 1 1 A 108 108 ASP C C 108 177.179 176.104 1.075 1
1 1287 . 15 1 1 A 108 108 ASP CA C 108 53.417 53.274 0.143 1
1 1288 . 15 1 1 A 108 108 ASP CB C 108 40.030 38.684 1.346 1
1 1289 . 15 1 1 A 108 108 ASP N N 108 125.414 127.421 -2.007 1
1 1290 . 15 1 1 A 109 109 LEU H H 109 8.470 8.006 0.464 1
1 1291 . 15 1 1 A 109 109 LEU HA H 109 3.846 4.021 -0.175 1
1 1301 . 15 1 1 A 109 109 LEU C C 109 178.145 179.157 -1.012 1
1 1302 . 15 1 1 A 109 109 LEU CA C 109 56.573 58.100 -1.527 1
1 1303 . 15 1 1 A 109 109 LEU CB C 109 42.011 41.510 0.501 1
1 1307 . 15 1 1 A 109 109 LEU N N 109 127.577 124.709 2.868 1
1 1308 . 15 1 1 A 110 110 LYS H H 110 8.062 8.048 0.014 1
1 1309 . 15 1 1 A 110 110 LYS HA H 110 3.022 3.555 -0.533 1
1 1317 . 15 1 1 A 110 110 LYS C C 110 177.248 179.193 -1.945 1
1 1318 . 15 1 1 A 110 110 LYS CA C 110 58.742 59.053 -0.311 1
1 1319 . 15 1 1 A 110 110 LYS CB C 110 31.667 31.917 -0.250 1
1 1323 . 15 1 1 A 110 110 LYS N N 110 118.873 117.713 1.160 1
1 1324 . 15 1 1 A 111 111 GLU H H 111 7.113 7.962 -0.849 1
1 1325 . 15 1 1 A 111 111 GLU HA H 111 4.117 4.222 -0.105 1
1 1330 . 15 1 1 A 111 111 GLU C C 111 176.519 177.644 -1.125 1
1 1331 . 15 1 1 A 111 111 GLU CA C 111 55.621 58.849 -3.228 1
1 1332 . 15 1 1 A 111 111 GLU CB C 111 29.943 29.995 -0.052 1
1 1334 . 15 1 1 A 111 111 GLU N N 111 114.282 117.428 -3.146 1
1 1335 . 15 1 1 A 112 112 LEU H H 112 6.848 7.941 -1.093 1
1 1336 . 15 1 1 A 112 112 LEU HA H 112 4.293 4.187 0.106 1
1 1346 . 15 1 1 A 112 112 LEU C C 112 175.674 176.082 -0.408 1
1 1347 . 15 1 1 A 112 112 LEU CA C 112 55.197 55.910 -0.713 1
1 1348 . 15 1 1 A 112 112 LEU CB C 112 41.681 41.985 -0.304 1
1 1352 . 15 1 1 A 112 112 LEU N N 112 118.934 122.440 -3.506 1
1 1353 . 15 1 1 A 113 113 ASP H H 113 8.466 8.842 -0.376 1
1 1354 . 15 1 1 A 113 113 ASP HA H 113 4.593 5.164 -0.571 1
1 1357 . 15 1 1 A 113 113 ASP C C 113 174.511 175.308 -0.797 1
1 1358 . 15 1 1 A 113 113 ASP CA C 113 53.558 53.484 0.074 1
1 1359 . 15 1 1 A 113 113 ASP CB C 113 42.448 43.436 -0.988 1
1 1360 . 15 1 1 A 113 113 ASP N N 113 122.148 124.402 -2.254 1
1 1 . 16 1 1 A 6 6 SER HA H 6 4.483 4.743 -0.260 1
1 4 . 16 1 1 A 6 6 SER C C 6 175.167 175.184 -0.017 1
1 5 . 16 1 1 A 6 6 SER CA C 6 58.759 59.212 -0.453 1
1 6 . 16 1 1 A 6 6 SER CB C 6 64.069 65.127 -1.058 1
1 7 . 16 1 1 A 7 7 GLY H H 7 8.431 8.148 0.283 1
1 8 . 16 1 1 A 7 7 GLY HA2 H 7 3.973 4.000 -0.027 1
1 9 . 16 1 1 A 7 7 GLY HA3 H 7 3.973 4.001 -0.028 1
1 10 . 16 1 1 A 7 7 GLY C C 7 174.570 174.493 0.077 1
1 11 . 16 1 1 A 7 7 GLY CA C 7 45.483 45.558 -0.075 1
1 12 . 16 1 1 A 7 7 GLY N N 7 110.640 108.938 1.702 1
1 13 . 16 1 1 A 8 8 MET H H 8 8.239 7.952 0.287 1
1 14 . 16 1 1 A 8 8 MET HA H 8 4.386 4.446 -0.060 1
1 22 . 16 1 1 A 8 8 MET C C 8 176.621 176.357 0.264 1
1 23 . 16 1 1 A 8 8 MET CA C 8 55.991 55.249 0.742 1
1 24 . 16 1 1 A 8 8 MET CB C 8 32.986 34.006 -1.020 1
1 27 . 16 1 1 A 8 8 MET N N 8 120.219 119.936 0.283 1
1 28 . 16 1 1 A 9 9 ALA H H 9 8.435 8.562 -0.127 1
1 29 . 16 1 1 A 9 9 ALA HA H 9 4.182 4.354 -0.172 1
1 33 . 16 1 1 A 9 9 ALA C C 9 177.951 176.718 1.233 1
1 34 . 16 1 1 A 9 9 ALA CA C 9 53.399 54.314 -0.915 1
1 35 . 16 1 1 A 9 9 ALA CB C 9 18.955 19.027 -0.072 1
1 36 . 16 1 1 A 9 9 ALA N N 9 124.459 122.654 1.805 1
1 37 . 16 1 1 A 10 10 SER H H 10 8.100 7.657 0.443 1
1 38 . 16 1 1 A 10 10 SER HA H 10 4.391 4.790 -0.399 1
1 41 . 16 1 1 A 10 10 SER C C 10 174.467 172.572 1.895 1
1 42 . 16 1 1 A 10 10 SER CA C 10 58.709 57.728 0.981 1
1 43 . 16 1 1 A 10 10 SER CB C 10 63.778 66.640 -2.862 1
1 44 . 16 1 1 A 10 10 SER N N 10 113.881 108.551 5.330 1
1 45 . 16 1 1 A 11 11 THR H H 11 7.821 8.592 -0.771 1
1 46 . 16 1 1 A 11 11 THR HA H 11 4.191 5.216 -1.025 1
1 51 . 16 1 1 A 11 11 THR C C 11 173.610 172.494 1.116 1
1 52 . 16 1 1 A 11 11 THR CA C 11 61.936 60.644 1.292 1
1 53 . 16 1 1 A 11 11 THR CB C 11 69.713 71.667 -1.954 1
1 55 . 16 1 1 A 11 11 THR N N 11 114.471 115.333 -0.862 1
1 56 . 16 1 1 A 12 12 PHE H H 12 7.946 9.081 -1.135 1
1 57 . 16 1 1 A 12 12 PHE HA H 12 4.769 4.872 -0.103 1
1 65 . 16 1 1 A 12 12 PHE C C 12 174.211 174.469 -0.258 1
1 66 . 16 1 1 A 12 12 PHE CA C 12 56.644 57.696 -1.052 1
1 67 . 16 1 1 A 12 12 PHE CB C 12 40.609 40.908 -0.299 1
1 73 . 16 1 1 A 12 12 PHE N N 12 120.763 123.192 -2.429 1
1 74 . 16 1 1 A 13 13 ASN H H 13 9.004 9.353 -0.349 1
1 75 . 16 1 1 A 13 13 ASN HA H 13 5.366 5.524 -0.158 1
1 80 . 16 1 1 A 13 13 ASN C C 13 172.158 174.017 -1.859 1
1 81 . 16 1 1 A 13 13 ASN CA C 13 50.988 50.636 0.352 1
1 82 . 16 1 1 A 13 13 ASN CB C 13 39.942 39.267 0.675 1
1 83 . 16 1 1 A 13 13 ASN N N 13 119.973 118.667 1.306 1
1 85 . 16 1 1 A 14 14 PRO HA H 14 4.945 4.616 0.329 1
1 92 . 16 1 1 A 14 14 PRO C C 14 174.901 175.998 -1.097 1
1 93 . 16 1 1 A 14 14 PRO CA C 14 63.096 62.679 0.417 1
1 94 . 16 1 1 A 14 14 PRO CB C 14 32.739 32.341 0.398 1
1 97 . 16 1 1 A 15 15 ARG H H 15 8.908 8.707 0.201 1
1 98 . 16 1 1 A 15 15 ARG HA H 15 4.626 4.667 -0.041 1
1 106 . 16 1 1 A 15 15 ARG C C 15 174.432 176.077 -1.645 1
1 107 . 16 1 1 A 15 15 ARG CA C 15 54.827 55.357 -0.530 1
1 108 . 16 1 1 A 15 15 ARG CB C 15 32.439 31.841 0.598 1
1 111 . 16 1 1 A 15 15 ARG N N 15 118.947 121.491 -2.544 1
1 113 . 16 1 1 A 16 16 GLU H H 16 8.838 8.905 -0.067 1
1 114 . 16 1 1 A 16 16 GLU HA H 16 4.876 4.582 0.294 1
1 119 . 16 1 1 A 16 16 GLU C C 16 175.767 175.266 0.501 1
1 120 . 16 1 1 A 16 16 GLU CA C 16 55.621 56.670 -1.049 1
1 121 . 16 1 1 A 16 16 GLU CB C 16 31.093 30.701 0.392 1
1 123 . 16 1 1 A 16 16 GLU N N 16 125.316 127.478 -2.162 1
1 124 . 16 1 1 A 17 17 CYS H H 17 9.327 8.697 0.630 1
1 125 . 16 1 1 A 17 17 CYS HA H 17 4.804 4.894 -0.090 1
1 128 . 16 1 1 A 17 17 CYS C C 17 172.973 172.909 0.064 1
1 129 . 16 1 1 A 17 17 CYS CA C 17 57.930 57.297 0.633 1
1 130 . 16 1 1 A 17 17 CYS CB C 17 30.105 30.110 -0.005 1
1 131 . 16 1 1 A 17 17 CYS N N 17 127.909 125.217 2.692 1
1 132 . 16 1 1 A 18 18 LYS H H 18 9.022 8.959 0.063 1
1 133 . 16 1 1 A 18 18 LYS HA H 18 4.769 4.967 -0.198 1
1 142 . 16 1 1 A 18 18 LYS C C 18 174.586 175.300 -0.714 1
1 143 . 16 1 1 A 18 18 LYS CA C 18 55.956 55.214 0.742 1
1 144 . 16 1 1 A 18 18 LYS CB C 18 32.203 33.800 -1.597 1
1 148 . 16 1 1 A 18 18 LYS N N 18 127.039 127.168 -0.129 1
1 149 . 16 1 1 A 19 19 LEU H H 19 8.784 9.328 -0.544 1
1 150 . 16 1 1 A 19 19 LEU HA H 19 4.852 5.168 -0.316 1
1 160 . 16 1 1 A 19 19 LEU C C 19 176.862 176.159 0.703 1
1 161 . 16 1 1 A 19 19 LEU CA C 19 55.391 53.264 2.127 1
1 162 . 16 1 1 A 19 19 LEU CB C 19 44.442 45.042 -0.600 1
1 166 . 16 1 1 A 19 19 LEU N N 19 126.311 126.329 -0.018 1
1 167 . 16 1 1 A 20 20 SER H H 20 8.215 9.016 -0.801 1
1 168 . 16 1 1 A 20 20 SER HA H 20 5.461 5.625 -0.164 1
1 171 . 16 1 1 A 20 20 SER C C 20 171.960 173.574 -1.614 1
1 172 . 16 1 1 A 20 20 SER CA C 20 57.525 56.709 0.816 1
1 173 . 16 1 1 A 20 20 SER CB C 20 65.794 65.686 0.108 1
1 174 . 16 1 1 A 20 20 SER N N 20 115.113 116.139 -1.026 1
1 175 . 16 1 1 A 21 21 LYS H H 21 9.001 8.697 0.304 1
1 176 . 16 1 1 A 21 21 LYS HA H 21 4.887 4.970 -0.083 1
1 185 . 16 1 1 A 21 21 LYS C C 21 174.133 174.587 -0.454 1
1 186 . 16 1 1 A 21 21 LYS CA C 21 53.840 54.386 -0.546 1
1 187 . 16 1 1 A 21 21 LYS CB C 21 36.553 35.926 0.627 1
1 191 . 16 1 1 A 21 21 LYS N N 21 120.938 121.763 -0.825 1
1 192 . 16 1 1 A 22 22 GLN H H 22 8.201 8.398 -0.197 1
1 193 . 16 1 1 A 22 22 GLN HA H 22 4.448 4.660 -0.212 1
1 200 . 16 1 1 A 22 22 GLN C C 22 176.372 175.472 0.900 1
1 201 . 16 1 1 A 22 22 GLN CA C 22 53.658 54.120 -0.462 1
1 202 . 16 1 1 A 22 22 GLN CB C 22 30.473 30.631 -0.158 1
1 204 . 16 1 1 A 22 22 GLN N N 22 116.816 118.968 -2.152 1
1 206 . 16 1 1 A 23 23 GLU H H 23 8.624 8.625 -0.001 1
1 207 . 16 1 1 A 23 23 GLU HA H 23 4.056 4.109 -0.053 1
1 212 . 16 1 1 A 23 23 GLU C C 23 177.778 176.919 0.859 1
1 213 . 16 1 1 A 23 23 GLU CA C 23 58.001 57.592 0.409 1
1 214 . 16 1 1 A 23 23 GLU CB C 23 29.237 29.111 0.126 1
1 216 . 16 1 1 A 23 23 GLU N N 23 122.364 122.341 0.023 1
1 217 . 16 1 1 A 24 24 GLY H H 24 8.962 8.898 0.064 1
1 218 . 16 1 1 A 24 24 GLY HA2 H 24 4.139 3.979 0.160 1
1 219 . 16 1 1 A 24 24 GLY HA3 H 24 3.711 3.980 -0.269 1
1 220 . 16 1 1 A 24 24 GLY C C 24 173.857 174.236 -0.379 1
1 221 . 16 1 1 A 24 24 GLY CA C 24 45.288 45.028 0.260 1
1 222 . 16 1 1 A 24 24 GLY N N 24 113.942 113.232 0.710 1
1 223 . 16 1 1 A 25 25 GLN H H 25 7.643 8.274 -0.631 1
1 224 . 16 1 1 A 25 25 GLN HA H 25 4.488 4.277 0.211 1
1 231 . 16 1 1 A 25 25 GLN C C 25 174.727 175.308 -0.581 1
1 232 . 16 1 1 A 25 25 GLN CA C 25 54.052 55.636 -1.584 1
1 233 . 16 1 1 A 25 25 GLN CB C 25 30.843 30.300 0.543 1
1 235 . 16 1 1 A 25 25 GLN N N 25 119.538 121.411 -1.873 1
1 237 . 16 1 1 A 26 26 ASN H H 26 8.625 8.542 0.083 1
1 238 . 16 1 1 A 26 26 ASN HA H 26 4.862 4.936 -0.074 1
1 243 . 16 1 1 A 26 26 ASN C C 26 176.261 175.208 1.053 1
1 244 . 16 1 1 A 26 26 ASN CA C 26 51.812 51.195 0.617 1
1 245 . 16 1 1 A 26 26 ASN CB C 26 40.403 39.520 0.883 1
1 246 . 16 1 1 A 26 26 ASN N N 26 120.047 120.426 -0.379 1
1 248 . 16 1 1 A 27 27 TYR HA H 27 4.152 4.704 -0.552 1
1 255 . 16 1 1 A 27 27 TYR C C 27 176.731 176.178 0.553 1
1 256 . 16 1 1 A 27 27 TYR CA C 27 62.462 58.158 4.304 1
1 257 . 16 1 1 A 27 27 TYR CB C 27 40.240 39.486 0.754 1
1 262 . 16 1 1 A 27 27 TYR N N 27 121.761 118.099 3.662 1
1 263 . 16 1 1 A 28 28 GLY H H 28 8.285 8.161 0.124 1
1 264 . 16 1 1 A 28 28 GLY HA2 H 28 4.490 3.936 0.554 1
1 265 . 16 1 1 A 28 28 GLY HA3 H 28 3.759 4.014 -0.255 1
1 266 . 16 1 1 A 28 28 GLY C C 28 172.198 174.009 -1.811 1
1 267 . 16 1 1 A 28 28 GLY CA C 28 46.139 45.181 0.958 1
1 268 . 16 1 1 A 28 28 GLY N N 28 103.567 107.612 -4.045 1
1 269 . 16 1 1 A 29 29 PHE H H 29 6.878 7.927 -1.049 1
1 270 . 16 1 1 A 29 29 PHE HA H 29 5.179 4.969 0.210 1
1 278 . 16 1 1 A 29 29 PHE C C 29 172.840 173.890 -1.050 1
1 279 . 16 1 1 A 29 29 PHE CA C 29 55.262 55.264 -0.002 1
1 280 . 16 1 1 A 29 29 PHE CB C 29 41.779 42.203 -0.424 1
1 286 . 16 1 1 A 29 29 PHE N N 29 111.027 117.498 -6.471 1
1 287 . 16 1 1 A 30 30 PHE H H 30 8.806 8.724 0.082 1
1 288 . 16 1 1 A 30 30 PHE HA H 30 4.923 4.884 0.039 1
1 296 . 16 1 1 A 30 30 PHE C C 30 174.501 175.528 -1.027 1
1 297 . 16 1 1 A 30 30 PHE CA C 30 55.356 56.342 -0.986 1
1 298 . 16 1 1 A 30 30 PHE CB C 30 41.681 42.660 -0.979 1
1 304 . 16 1 1 A 30 30 PHE N N 30 118.710 118.522 0.188 1
1 305 . 16 1 1 A 31 31 LEU H H 31 8.441 8.688 -0.247 1
1 306 . 16 1 1 A 31 31 LEU HA H 31 5.447 4.885 0.562 1
1 316 . 16 1 1 A 31 31 LEU C C 31 177.306 176.054 1.252 1
1 317 . 16 1 1 A 31 31 LEU CA C 31 53.610 54.101 -0.491 1
1 318 . 16 1 1 A 31 31 LEU CB C 31 43.696 43.309 0.387 1
1 322 . 16 1 1 A 31 31 LEU N N 31 123.765 123.288 0.477 1
1 323 . 16 1 1 A 32 32 ARG H H 32 9.381 8.683 0.698 1
1 324 . 16 1 1 A 32 32 ARG HA H 32 4.840 5.290 -0.450 1
1 331 . 16 1 1 A 32 32 ARG C C 32 175.155 175.279 -0.124 1
1 332 . 16 1 1 A 32 32 ARG CA C 32 54.210 54.599 -0.389 1
1 333 . 16 1 1 A 32 32 ARG CB C 32 35.087 33.483 1.604 1
1 336 . 16 1 1 A 32 32 ARG N N 32 123.160 123.413 -0.253 1
1 337 . 16 1 1 A 33 33 ILE H H 33 7.891 9.096 -1.205 1
1 338 . 16 1 1 A 33 33 ILE HA H 33 4.495 4.882 -0.387 1
1 348 . 16 1 1 A 33 33 ILE C C 33 175.850 174.121 1.729 1
1 349 . 16 1 1 A 33 33 ILE CA C 33 59.641 59.249 0.392 1
1 350 . 16 1 1 A 33 33 ILE CB C 33 39.538 39.990 -0.452 1
1 354 . 16 1 1 A 33 33 ILE N N 33 118.924 120.175 -1.251 1
1 355 . 16 1 1 A 34 34 GLU H H 34 8.971 8.734 0.237 1
1 356 . 16 1 1 A 34 34 GLU HA H 34 4.578 5.008 -0.430 1
1 361 . 16 1 1 A 34 34 GLU C C 34 175.766 175.516 0.250 1
1 362 . 16 1 1 A 34 34 GLU CA C 34 54.263 54.343 -0.080 1
1 363 . 16 1 1 A 34 34 GLU CB C 34 32.128 33.374 -1.246 1
1 365 . 16 1 1 A 34 34 GLU N N 34 125.447 122.390 3.057 1
1 366 . 16 1 1 A 35 35 LYS H H 35 8.504 8.663 -0.159 1
1 367 . 16 1 1 A 35 35 LYS HA H 35 4.026 4.137 -0.111 1
1 376 . 16 1 1 A 35 35 LYS C C 35 177.701 176.264 1.437 1
1 377 . 16 1 1 A 35 35 LYS CA C 35 57.591 56.330 1.261 1
1 378 . 16 1 1 A 35 35 LYS CB C 35 32.491 32.984 -0.493 1
1 382 . 16 1 1 A 35 35 LYS N N 35 122.893 124.233 -1.340 1
1 383 . 16 1 1 A 36 36 ASP H H 36 9.020 8.876 0.144 1
1 384 . 16 1 1 A 36 36 ASP HA H 36 4.385 4.153 0.232 1
1 387 . 16 1 1 A 36 36 ASP C C 36 174.554 174.651 -0.097 1
1 388 . 16 1 1 A 36 36 ASP CA C 36 55.868 55.174 0.694 1
1 389 . 16 1 1 A 36 36 ASP CB C 36 39.826 39.559 0.267 1
1 390 . 16 1 1 A 36 36 ASP N N 36 121.412 119.033 2.379 1
1 391 . 16 1 1 A 37 37 THR H H 37 7.464 7.554 -0.090 1
1 392 . 16 1 1 A 37 37 THR HA H 37 4.454 4.828 -0.374 1
1 397 . 16 1 1 A 37 37 THR C C 37 172.012 172.394 -0.382 1
1 398 . 16 1 1 A 37 37 THR CA C 37 61.686 60.992 0.694 1
1 399 . 16 1 1 A 37 37 THR CB C 37 70.927 72.290 -1.363 1
1 401 . 16 1 1 A 37 37 THR N N 37 113.147 112.574 0.573 1
1 402 . 16 1 1 A 38 38 ASP H H 38 8.931 8.673 0.258 1
1 403 . 16 1 1 A 38 38 ASP HA H 38 4.852 4.762 0.090 1
1 406 . 16 1 1 A 38 38 ASP CA C 38 54.826 54.512 0.314 1
1 407 . 16 1 1 A 38 38 ASP CB C 38 43.332 41.464 1.868 1
1 408 . 16 1 1 A 38 38 ASP N N 38 120.401 126.682 -6.281 1
1 409 . 16 1 1 A 39 39 GLY H H 39 8.068 8.008 0.060 1
1 410 . 16 1 1 A 39 39 GLY HA2 H 39 3.774 3.990 -0.216 1
1 411 . 16 1 1 A 39 39 GLY HA3 H 39 3.555 4.009 -0.454 1
1 412 . 16 1 1 A 39 39 GLY C C 39 172.578 172.929 -0.351 1
1 413 . 16 1 1 A 39 39 GLY CA C 39 43.967 44.785 -0.818 1
1 414 . 16 1 1 A 39 39 GLY N N 39 107.925 113.155 -5.230 1
1 415 . 16 1 1 A 40 40 HIS H H 40 9.111 8.339 0.772 1
1 416 . 16 1 1 A 40 40 HIS HA H 40 4.650 4.900 -0.250 1
1 421 . 16 1 1 A 40 40 HIS C C 40 174.330 174.514 -0.184 1
1 422 . 16 1 1 A 40 40 HIS CA C 40 55.886 55.777 0.109 1
1 423 . 16 1 1 A 40 40 HIS CB C 40 30.507 32.227 -1.720 1
1 426 . 16 1 1 A 40 40 HIS N N 40 119.179 118.618 0.561 1
1 427 . 16 1 1 A 41 41 LEU H H 41 8.254 8.611 -0.357 1
1 428 . 16 1 1 A 41 41 LEU HA H 41 4.626 5.331 -0.705 1
1 438 . 16 1 1 A 41 41 LEU C C 41 176.035 176.297 -0.262 1
1 439 . 16 1 1 A 41 41 LEU CA C 41 55.621 53.273 2.348 1
1 440 . 16 1 1 A 41 41 LEU CB C 41 45.091 43.779 1.312 1
1 444 . 16 1 1 A 41 41 LEU N N 41 124.808 122.281 2.527 1
1 445 . 16 1 1 A 42 42 ILE H H 42 8.685 8.362 0.323 1
1 446 . 16 1 1 A 42 42 ILE HA H 42 4.578 4.507 0.071 1
1 456 . 16 1 1 A 42 42 ILE C C 42 175.369 175.415 -0.046 1
1 457 . 16 1 1 A 42 42 ILE CA C 42 59.852 61.456 -1.604 1
1 458 . 16 1 1 A 42 42 ILE CB C 42 36.778 37.600 -0.822 1
1 462 . 16 1 1 A 42 42 ILE N N 42 121.814 124.804 -2.990 1
1 463 . 16 1 1 A 43 43 ARG H H 43 8.787 8.672 0.115 1
1 464 . 16 1 1 A 43 43 ARG HA H 43 4.852 4.753 0.099 1
1 472 . 16 1 1 A 43 43 ARG C C 43 174.029 175.119 -1.090 1
1 473 . 16 1 1 A 43 43 ARG CA C 43 52.730 55.466 -2.736 1
1 474 . 16 1 1 A 43 43 ARG CB C 43 36.983 33.542 3.441 1
1 477 . 16 1 1 A 43 43 ARG N N 43 125.771 127.115 -1.344 1
1 479 . 16 1 1 A 44 44 VAL H H 44 8.661 8.615 0.046 1
1 480 . 16 1 1 A 44 44 VAL HA H 44 3.276 3.758 -0.482 1
1 488 . 16 1 1 A 44 44 VAL C C 44 173.227 175.072 -1.845 1
1 489 . 16 1 1 A 44 44 VAL CA C 44 63.161 63.229 -0.068 1
1 490 . 16 1 1 A 44 44 VAL CB C 44 29.054 29.855 -0.801 1
1 493 . 16 1 1 A 44 44 VAL N N 44 117.026 120.979 -3.953 1
1 494 . 16 1 1 A 45 45 ILE H H 45 8.464 8.009 0.455 1
1 495 . 16 1 1 A 45 45 ILE HA H 45 4.579 4.325 0.254 1
1 505 . 16 1 1 A 45 45 ILE C C 45 178.108 175.305 2.803 1
1 506 . 16 1 1 A 45 45 ILE CA C 45 59.888 61.290 -1.402 1
1 507 . 16 1 1 A 45 45 ILE CB C 45 36.998 36.500 0.498 1
1 511 . 16 1 1 A 45 45 ILE N N 45 122.767 122.665 0.102 1
1 512 . 16 1 1 A 46 46 GLU H H 46 9.015 9.127 -0.112 1
1 513 . 16 1 1 A 46 46 GLU HA H 46 4.206 4.327 -0.121 1
1 518 . 16 1 1 A 46 46 GLU C C 46 177.746 176.141 1.605 1
1 519 . 16 1 1 A 46 46 GLU CA C 46 56.130 56.910 -0.780 1
1 520 . 16 1 1 A 46 46 GLU CB C 46 30.581 30.533 0.048 1
1 522 . 16 1 1 A 46 46 GLU N N 46 131.076 128.660 2.416 1
1 523 . 16 1 1 A 47 47 GLU H H 47 9.213 8.706 0.507 1
1 524 . 16 1 1 A 47 47 GLU HA H 47 4.194 4.154 0.040 1
1 529 . 16 1 1 A 47 47 GLU C C 47 178.088 177.572 0.516 1
1 530 . 16 1 1 A 47 47 GLU CA C 47 58.212 57.656 0.556 1
1 531 . 16 1 1 A 47 47 GLU CB C 47 29.390 30.249 -0.859 1
1 533 . 16 1 1 A 47 47 GLU N N 47 129.592 124.841 4.751 1
1 534 . 16 1 1 A 48 48 GLY H H 48 9.586 8.943 0.643 1
1 535 . 16 1 1 A 48 48 GLY HA2 H 48 4.141 3.832 0.309 1
1 536 . 16 1 1 A 48 48 GLY HA3 H 48 3.757 3.834 -0.077 1
1 537 . 16 1 1 A 48 48 GLY C C 48 173.790 173.923 -0.133 1
1 538 . 16 1 1 A 48 48 GLY CA C 48 45.764 46.852 -1.088 1
1 539 . 16 1 1 A 48 48 GLY N N 48 114.819 114.384 0.435 1
1 540 . 16 1 1 A 49 49 SER H H 49 7.580 7.838 -0.258 1
1 541 . 16 1 1 A 49 49 SER HA H 49 4.728 4.947 -0.219 1
1 544 . 16 1 1 A 49 49 SER C C 49 173.542 174.164 -0.622 1
1 545 . 16 1 1 A 49 49 SER CA C 49 57.560 55.347 2.213 1
1 546 . 16 1 1 A 49 49 SER CB C 49 64.529 64.395 0.134 1
1 547 . 16 1 1 A 49 49 SER N N 49 114.688 113.438 1.250 1
1 548 . 16 1 1 A 50 50 PRO HA H 50 4.431 4.557 -0.126 1
1 555 . 16 1 1 A 50 50 PRO C C 50 179.377 177.325 2.052 1
1 556 . 16 1 1 A 50 50 PRO CA C 50 66.059 64.257 1.802 1
1 557 . 16 1 1 A 50 50 PRO CB C 50 32.598 31.808 0.790 1
1 560 . 16 1 1 A 51 51 ALA H H 51 8.264 8.097 0.167 1
1 561 . 16 1 1 A 51 51 ALA HA H 51 3.817 4.115 -0.298 1
1 565 . 16 1 1 A 51 51 ALA C C 51 177.508 179.884 -2.376 1
1 566 . 16 1 1 A 51 51 ALA CA C 51 55.392 54.006 1.386 1
1 567 . 16 1 1 A 51 51 ALA CB C 51 20.474 19.088 1.386 1
1 568 . 16 1 1 A 51 51 ALA N N 51 117.604 120.917 -3.313 1
1 569 . 16 1 1 A 52 52 GLU H H 52 7.794 7.463 0.331 1
1 570 . 16 1 1 A 52 52 GLU HA H 52 3.881 4.123 -0.242 1
1 575 . 16 1 1 A 52 52 GLU C C 52 181.401 178.532 2.869 1
1 576 . 16 1 1 A 52 52 GLU CA C 52 59.454 58.656 0.798 1
1 577 . 16 1 1 A 52 52 GLU CB C 52 30.247 29.518 0.729 1
1 579 . 16 1 1 A 52 52 GLU N N 52 119.474 118.097 1.377 1
1 580 . 16 1 1 A 53 53 LYS H H 53 8.557 7.877 0.680 1
1 581 . 16 1 1 A 53 53 LYS HA H 53 4.020 4.054 -0.034 1
1 588 . 16 1 1 A 53 53 LYS C C 53 177.939 178.448 -0.509 1
1 589 . 16 1 1 A 53 53 LYS CA C 53 59.012 58.788 0.224 1
1 590 . 16 1 1 A 53 53 LYS CB C 53 32.438 32.243 0.195 1
1 594 . 16 1 1 A 53 53 LYS N N 53 120.057 118.177 1.880 1
1 595 . 16 1 1 A 54 54 ALA H H 54 7.764 7.465 0.299 1
1 596 . 16 1 1 A 54 54 ALA HA H 54 4.400 4.274 0.126 1
1 600 . 16 1 1 A 54 54 ALA C C 54 177.658 177.674 -0.016 1
1 601 . 16 1 1 A 54 54 ALA CA C 54 52.412 52.182 0.230 1
1 602 . 16 1 1 A 54 54 ALA CB C 54 20.739 19.257 1.482 1
1 603 . 16 1 1 A 54 54 ALA N N 54 117.678 119.418 -1.740 1
1 604 . 16 1 1 A 55 55 GLY H H 55 7.583 8.022 -0.439 1
1 605 . 16 1 1 A 55 55 GLY HA2 H 55 4.266 4.004 0.262 1
1 606 . 16 1 1 A 55 55 GLY HA3 H 55 3.775 4.009 -0.234 1
1 607 . 16 1 1 A 55 55 GLY C C 55 175.232 174.176 1.056 1
1 608 . 16 1 1 A 55 55 GLY CA C 55 45.368 45.149 0.219 1
1 609 . 16 1 1 A 55 55 GLY N N 55 103.265 106.472 -3.207 1
1 610 . 16 1 1 A 56 56 LEU H H 56 7.280 7.366 -0.086 1
1 611 . 16 1 1 A 56 56 LEU HA H 56 3.984 4.533 -0.549 1
1 621 . 16 1 1 A 56 56 LEU C C 56 174.708 175.005 -0.297 1
1 622 . 16 1 1 A 56 56 LEU CA C 56 55.603 54.459 1.144 1
1 623 . 16 1 1 A 56 56 LEU CB C 56 42.752 42.660 0.092 1
1 627 . 16 1 1 A 56 56 LEU N N 56 119.211 123.211 -4.000 1
1 628 . 16 1 1 A 57 57 LEU H H 57 8.693 8.782 -0.089 1
1 629 . 16 1 1 A 57 57 LEU HA H 57 4.499 4.895 -0.396 1
1 639 . 16 1 1 A 57 57 LEU C C 57 176.124 175.515 0.609 1
1 640 . 16 1 1 A 57 57 LEU CA C 57 52.959 53.320 -0.361 1
1 641 . 16 1 1 A 57 57 LEU CB C 57 45.122 44.509 0.613 1
1 645 . 16 1 1 A 57 57 LEU N N 57 121.969 129.289 -7.320 1
1 646 . 16 1 1 A 58 58 ASP H H 58 8.334 8.674 -0.340 1
1 647 . 16 1 1 A 58 58 ASP HA H 58 4.139 4.594 -0.455 1
1 650 . 16 1 1 A 58 58 ASP C C 58 178.636 176.942 1.694 1
1 651 . 16 1 1 A 58 58 ASP CA C 58 56.079 55.925 0.154 1
1 652 . 16 1 1 A 58 58 ASP CB C 58 42.135 40.442 1.693 1
1 653 . 16 1 1 A 58 58 ASP N N 58 120.401 122.343 -1.942 1
1 654 . 16 1 1 A 59 59 GLY H H 59 9.378 9.081 0.297 1
1 655 . 16 1 1 A 59 59 GLY HA2 H 59 4.317 3.996 0.321 1
1 656 . 16 1 1 A 59 59 GLY HA3 H 59 3.260 3.996 -0.736 1
1 657 . 16 1 1 A 59 59 GLY C C 59 173.359 174.075 -0.716 1
1 658 . 16 1 1 A 59 59 GLY CA C 59 45.517 45.053 0.464 1
1 659 . 16 1 1 A 59 59 GLY N N 59 116.622 114.066 2.556 1
1 660 . 16 1 1 A 60 60 ASP H H 60 8.009 7.690 0.319 1
1 661 . 16 1 1 A 60 60 ASP HA H 60 4.638 4.557 0.081 1
1 664 . 16 1 1 A 60 60 ASP C C 60 175.555 174.758 0.797 1
1 665 . 16 1 1 A 60 60 ASP CA C 60 55.286 55.256 0.030 1
1 666 . 16 1 1 A 60 60 ASP CB C 60 42.381 41.822 0.559 1
1 667 . 16 1 1 A 60 60 ASP N N 60 121.370 121.818 -0.448 1
1 668 . 16 1 1 A 61 61 ARG H H 61 8.648 8.771 -0.123 1
1 669 . 16 1 1 A 61 61 ARG HA H 61 5.179 5.312 -0.133 1
1 677 . 16 1 1 A 61 61 ARG C C 61 177.381 174.470 2.911 1
1 678 . 16 1 1 A 61 61 ARG CA C 61 53.704 54.545 -0.841 1
1 679 . 16 1 1 A 61 61 ARG CB C 61 34.017 32.165 1.852 1
1 682 . 16 1 1 A 61 61 ARG N N 61 116.958 120.962 -4.004 1
1 684 . 16 1 1 A 62 62 VAL H H 62 8.247 8.704 -0.457 1
1 685 . 16 1 1 A 62 62 VAL HA H 62 3.806 4.522 -0.716 1
1 693 . 16 1 1 A 62 62 VAL C C 62 174.748 174.785 -0.037 1
1 694 . 16 1 1 A 62 62 VAL CA C 62 63.149 61.844 1.305 1
1 695 . 16 1 1 A 62 62 VAL CB C 62 32.574 32.277 0.297 1
1 698 . 16 1 1 A 62 62 VAL N N 62 118.546 125.767 -7.221 1
1 699 . 16 1 1 A 63 63 LEU H H 63 9.262 9.108 0.154 1
1 700 . 16 1 1 A 63 63 LEU HA H 63 4.412 4.288 0.124 1
1 710 . 16 1 1 A 63 63 LEU C C 63 177.649 177.083 0.566 1
1 711 . 16 1 1 A 63 63 LEU CA C 63 56.044 56.467 -0.423 1
1 712 . 16 1 1 A 63 63 LEU CB C 63 43.339 42.767 0.572 1
1 716 . 16 1 1 A 63 63 LEU N N 63 125.413 131.159 -5.746 1
1 717 . 16 1 1 A 64 64 ARG H H 64 7.806 7.694 0.112 1
1 718 . 16 1 1 A 64 64 ARG HA H 64 5.704 4.992 0.712 1
1 726 . 16 1 1 A 64 64 ARG C C 64 175.091 174.220 0.871 1
1 727 . 16 1 1 A 64 64 ARG CA C 64 54.148 54.687 -0.539 1
1 728 . 16 1 1 A 64 64 ARG CB C 64 35.742 33.884 1.858 1
1 731 . 16 1 1 A 64 64 ARG N N 64 112.961 117.104 -4.143 1
1 733 . 16 1 1 A 65 65 ILE H H 65 8.327 9.188 -0.861 1
1 734 . 16 1 1 A 65 65 ILE HA H 65 4.384 4.652 -0.268 1
1 744 . 16 1 1 A 65 65 ILE C C 65 175.722 175.480 0.242 1
1 745 . 16 1 1 A 65 65 ILE CA C 65 60.501 59.279 1.222 1
1 746 . 16 1 1 A 65 65 ILE CB C 65 39.547 40.369 -0.822 1
1 750 . 16 1 1 A 65 65 ILE N N 65 119.175 124.104 -4.929 1
1 751 . 16 1 1 A 66 66 ASN H H 66 9.911 9.813 0.098 1
1 752 . 16 1 1 A 66 66 ASN HA H 66 4.428 4.372 0.056 1
1 757 . 16 1 1 A 66 66 ASN C C 66 175.349 174.634 0.715 1
1 758 . 16 1 1 A 66 66 ASN CA C 66 54.157 54.165 -0.008 1
1 759 . 16 1 1 A 66 66 ASN CB C 66 37.024 37.419 -0.395 1
1 760 . 16 1 1 A 66 66 ASN N N 66 128.952 128.068 0.884 1
1 762 . 16 1 1 A 67 67 GLY H H 67 9.230 8.646 0.584 1
1 763 . 16 1 1 A 67 67 GLY HA2 H 67 4.322 3.941 0.381 1
1 764 . 16 1 1 A 67 67 GLY HA3 H 67 3.508 3.949 -0.441 1
1 765 . 16 1 1 A 67 67 GLY C C 67 174.393 173.903 0.490 1
1 766 . 16 1 1 A 67 67 GLY CA C 67 45.341 46.380 -1.039 1
1 767 . 16 1 1 A 67 67 GLY N N 67 103.238 104.673 -1.435 1
1 768 . 16 1 1 A 68 68 VAL H H 68 8.063 7.669 0.394 1
1 769 . 16 1 1 A 68 68 VAL HA H 68 4.015 4.577 -0.562 1
1 777 . 16 1 1 A 68 68 VAL C C 68 175.833 174.880 0.953 1
1 778 . 16 1 1 A 68 68 VAL CA C 68 62.603 61.265 1.338 1
1 779 . 16 1 1 A 68 68 VAL CB C 68 32.574 35.181 -2.607 1
1 782 . 16 1 1 A 68 68 VAL N N 68 125.696 119.700 5.996 1
1 783 . 16 1 1 A 69 69 PHE H H 69 9.301 9.133 0.168 1
1 784 . 16 1 1 A 69 69 PHE HA H 69 4.947 4.540 0.407 1
1 792 . 16 1 1 A 69 69 PHE C C 69 177.120 176.123 0.997 1
1 793 . 16 1 1 A 69 69 PHE CA C 69 59.200 58.615 0.585 1
1 794 . 16 1 1 A 69 69 PHE CB C 69 39.320 39.403 -0.083 1
1 800 . 16 1 1 A 69 69 PHE N N 69 128.641 128.929 -0.288 1
1 801 . 16 1 1 A 70 70 VAL H H 70 8.312 8.122 0.190 1
1 802 . 16 1 1 A 70 70 VAL HA H 70 4.517 4.450 0.067 1
1 810 . 16 1 1 A 70 70 VAL CA C 70 60.734 60.458 0.276 1
1 811 . 16 1 1 A 70 70 VAL CB C 70 32.976 31.303 1.673 1
1 814 . 16 1 1 A 70 70 VAL N N 70 118.381 120.422 -2.041 1
1 815 . 16 1 1 A 71 71 ASP H H 71 5.373 7.373 -2.000 1
1 816 . 16 1 1 A 71 71 ASP HA H 71 4.413 4.360 0.053 1
1 819 . 16 1 1 A 71 71 ASP C C 71 174.896 177.351 -2.455 1
1 820 . 16 1 1 A 71 71 ASP CA C 71 58.334 56.403 1.931 1
1 821 . 16 1 1 A 71 71 ASP CB C 71 46.097 40.901 5.196 1
1 822 . 16 1 1 A 71 71 ASP N N 71 119.008 122.336 -3.328 1
1 823 . 16 1 1 A 72 72 LYS H H 72 7.874 7.366 0.508 1
1 824 . 16 1 1 A 72 72 LYS HA H 72 4.522 4.381 0.141 1
1 833 . 16 1 1 A 72 72 LYS C C 72 177.209 176.710 0.499 1
1 834 . 16 1 1 A 72 72 LYS CA C 72 54.122 56.278 -2.156 1
1 835 . 16 1 1 A 72 72 LYS CB C 72 31.640 34.211 -2.571 1
1 839 . 16 1 1 A 72 72 LYS N N 72 110.259 116.151 -5.892 1
1 840 . 16 1 1 A 73 73 GLU H H 73 7.421 7.742 -0.321 1
1 841 . 16 1 1 A 73 73 GLU HA H 73 4.401 4.345 0.056 1
1 846 . 16 1 1 A 73 73 GLU C C 73 176.728 176.297 0.431 1
1 847 . 16 1 1 A 73 73 GLU CA C 73 54.950 57.206 -2.256 1
1 848 . 16 1 1 A 73 73 GLU CB C 73 30.390 30.384 0.006 1
1 850 . 16 1 1 A 73 73 GLU N N 73 120.043 119.200 0.843 1
1 851 . 16 1 1 A 74 74 GLU H H 74 9.360 8.516 0.844 1
1 852 . 16 1 1 A 74 74 GLU HA H 74 4.403 4.523 -0.120 1
1 857 . 16 1 1 A 74 74 GLU C C 74 178.234 177.468 0.766 1
1 858 . 16 1 1 A 74 74 GLU CA C 74 56.516 56.167 0.349 1
1 859 . 16 1 1 A 74 74 GLU CB C 74 30.390 31.713 -1.323 1
1 861 . 16 1 1 A 74 74 GLU N N 74 122.193 122.864 -0.671 1
1 862 . 16 1 1 A 75 75 HIS H H 75 9.553 9.305 0.248 1
1 863 . 16 1 1 A 75 75 HIS HA H 75 4.080 4.177 -0.097 1
1 868 . 16 1 1 A 75 75 HIS C C 75 175.985 176.829 -0.844 1
1 869 . 16 1 1 A 75 75 HIS CA C 75 61.016 60.467 0.549 1
1 870 . 16 1 1 A 75 75 HIS CB C 75 29.468 30.747 -1.279 1
1 873 . 16 1 1 A 75 75 HIS N N 75 123.587 127.631 -4.044 1
1 874 . 16 1 1 A 76 76 ALA H H 76 9.129 8.437 0.692 1
1 875 . 16 1 1 A 76 76 ALA HA H 76 3.826 4.212 -0.386 1
1 879 . 16 1 1 A 76 76 ALA C C 76 180.475 179.239 1.236 1
1 880 . 16 1 1 A 76 76 ALA CA C 76 55.392 55.095 0.297 1
1 881 . 16 1 1 A 76 76 ALA CB C 76 18.182 18.294 -0.112 1
1 882 . 16 1 1 A 76 76 ALA N N 76 117.795 121.300 -3.505 1
1 883 . 16 1 1 A 77 77 GLN H H 77 7.099 7.675 -0.576 1
1 884 . 16 1 1 A 77 77 GLN HA H 77 4.198 4.434 -0.236 1
1 891 . 16 1 1 A 77 77 GLN C C 77 177.860 177.386 0.474 1
1 892 . 16 1 1 A 77 77 GLN CA C 77 57.790 57.995 -0.205 1
1 893 . 16 1 1 A 77 77 GLN CB C 77 28.536 28.508 0.028 1
1 895 . 16 1 1 A 77 77 GLN N N 77 115.764 116.883 -1.119 1
1 897 . 16 1 1 A 78 78 VAL H H 78 7.430 7.639 -0.209 1
1 898 . 16 1 1 A 78 78 VAL HA H 78 3.241 3.741 -0.500 1
1 906 . 16 1 1 A 78 78 VAL C C 78 177.042 177.993 -0.951 1
1 907 . 16 1 1 A 78 78 VAL CA C 78 67.299 65.045 2.254 1
1 908 . 16 1 1 A 78 78 VAL CB C 78 30.819 31.598 -0.779 1
1 911 . 16 1 1 A 78 78 VAL N N 78 121.143 119.997 1.146 1
1 912 . 16 1 1 A 79 79 VAL H H 79 7.773 8.286 -0.513 1
1 913 . 16 1 1 A 79 79 VAL HA H 79 3.315 3.599 -0.284 1
1 921 . 16 1 1 A 79 79 VAL C C 79 179.179 177.416 1.763 1
1 922 . 16 1 1 A 79 79 VAL CA C 79 66.694 65.012 1.682 1
1 923 . 16 1 1 A 79 79 VAL CB C 79 31.841 31.072 0.769 1
1 926 . 16 1 1 A 79 79 VAL N N 79 117.473 119.418 -1.945 1
1 927 . 16 1 1 A 80 80 GLU H H 80 7.410 8.000 -0.590 1
1 928 . 16 1 1 A 80 80 GLU HA H 80 4.258 4.045 0.213 1
1 933 . 16 1 1 A 80 80 GLU C C 80 178.018 179.366 -1.348 1
1 934 . 16 1 1 A 80 80 GLU CA C 80 58.566 59.105 -0.539 1
1 935 . 16 1 1 A 80 80 GLU CB C 80 29.072 29.320 -0.248 1
1 937 . 16 1 1 A 80 80 GLU N N 80 120.451 119.694 0.757 1
1 938 . 16 1 1 A 81 81 LEU H H 81 8.070 7.905 0.165 1
1 939 . 16 1 1 A 81 81 LEU HA H 81 3.976 4.038 -0.062 1
1 949 . 16 1 1 A 81 81 LEU C C 81 180.658 179.105 1.553 1
1 950 . 16 1 1 A 81 81 LEU CA C 81 58.061 57.950 0.111 1
1 951 . 16 1 1 A 81 81 LEU CB C 81 42.115 41.744 0.371 1
1 955 . 16 1 1 A 81 81 LEU N N 81 119.943 121.250 -1.307 1
1 956 . 16 1 1 A 82 82 VAL H H 82 7.609 7.926 -0.317 1
1 957 . 16 1 1 A 82 82 VAL HA H 82 3.474 3.555 -0.081 1
1 965 . 16 1 1 A 82 82 VAL C C 82 178.927 178.495 0.432 1
1 966 . 16 1 1 A 82 82 VAL CA C 82 67.398 67.245 0.153 1
1 967 . 16 1 1 A 82 82 VAL CB C 82 31.306 31.322 -0.016 1
1 970 . 16 1 1 A 82 82 VAL N N 82 118.150 120.105 -1.955 1
1 971 . 16 1 1 A 83 83 ARG H H 83 8.186 7.837 0.349 1
1 972 . 16 1 1 A 83 83 ARG HA H 83 3.994 4.011 -0.017 1
1 979 . 16 1 1 A 83 83 ARG C C 83 179.999 179.013 0.986 1
1 980 . 16 1 1 A 83 83 ARG CA C 83 60.205 59.673 0.532 1
1 981 . 16 1 1 A 83 83 ARG CB C 83 30.103 29.953 0.150 1
1 984 . 16 1 1 A 83 83 ARG N N 83 122.902 120.132 2.770 1
1 985 . 16 1 1 A 84 84 LYS H H 84 8.772 8.089 0.683 1
1 986 . 16 1 1 A 84 84 LYS HA H 84 4.047 4.101 -0.054 1
1 995 . 16 1 1 A 84 84 LYS C C 84 176.934 179.071 -2.137 1
1 996 . 16 1 1 A 84 84 LYS CA C 84 58.142 59.077 -0.935 1
1 997 . 16 1 1 A 84 84 LYS CB C 84 32.492 31.831 0.661 1
1 1001 . 16 1 1 A 84 84 LYS N N 84 117.548 118.727 -1.179 1
1 1002 . 16 1 1 A 85 85 SER H H 85 7.333 8.143 -0.810 1
1 1003 . 16 1 1 A 85 85 SER HA H 85 4.235 4.243 -0.008 1
1 1006 . 16 1 1 A 85 85 SER C C 85 175.588 175.176 0.412 1
1 1007 . 16 1 1 A 85 85 SER CA C 85 59.535 61.066 -1.531 1
1 1008 . 16 1 1 A 85 85 SER CB C 85 63.571 63.523 0.048 1
1 1009 . 16 1 1 A 85 85 SER N N 85 113.544 115.755 -2.211 1
1 1010 . 16 1 1 A 86 86 GLY H H 86 7.459 7.363 0.096 1
1 1011 . 16 1 1 A 86 86 GLY HA2 H 86 4.176 4.083 0.093 1
1 1012 . 16 1 1 A 86 86 GLY HA3 H 86 3.762 4.087 -0.325 1
1 1013 . 16 1 1 A 86 86 GLY C C 86 176.407 175.260 1.147 1
1 1014 . 16 1 1 A 86 86 GLY CA C 86 46.109 44.463 1.646 1
1 1015 . 16 1 1 A 86 86 GLY N N 86 104.331 107.410 -3.079 1
1 1016 . 16 1 1 A 87 87 ASN HA H 87 4.650 4.758 -0.108 1
1 1021 . 16 1 1 A 87 87 ASN C C 87 173.653 175.604 -1.951 1
1 1022 . 16 1 1 A 87 87 ASN CA C 87 54.492 55.477 -0.985 1
1 1023 . 16 1 1 A 87 87 ASN CB C 87 38.425 39.737 -1.312 1
1 1024 . 16 1 1 A 87 87 ASN N N 87 118.401 124.656 -6.255 1
1 1026 . 16 1 1 A 88 88 SER H H 88 7.435 7.935 -0.500 1
1 1027 . 16 1 1 A 88 88 SER HA H 88 5.438 5.260 0.178 1
1 1030 . 16 1 1 A 88 88 SER C C 88 172.867 173.726 -0.859 1
1 1031 . 16 1 1 A 88 88 SER CA C 88 58.160 57.290 0.870 1
1 1032 . 16 1 1 A 88 88 SER CB C 88 65.861 64.278 1.583 1
1 1033 . 16 1 1 A 88 88 SER N N 88 113.765 113.637 0.128 1
1 1034 . 16 1 1 A 89 89 VAL H H 89 8.452 8.657 -0.205 1
1 1035 . 16 1 1 A 89 89 VAL HA H 89 4.519 4.710 -0.191 1
1 1043 . 16 1 1 A 89 89 VAL C C 89 171.391 174.420 -3.029 1
1 1044 . 16 1 1 A 89 89 VAL CA C 89 61.333 60.852 0.481 1
1 1045 . 16 1 1 A 89 89 VAL CB C 89 33.897 35.883 -1.986 1
1 1048 . 16 1 1 A 89 89 VAL N N 89 120.001 126.690 -6.689 1
1 1049 . 16 1 1 A 90 90 THR H H 90 8.348 8.850 -0.502 1
1 1050 . 16 1 1 A 90 90 THR HA H 90 5.042 4.957 0.085 1
1 1055 . 16 1 1 A 90 90 THR C C 90 173.926 173.460 0.466 1
1 1056 . 16 1 1 A 90 90 THR CA C 90 61.403 61.712 -0.309 1
1 1057 . 16 1 1 A 90 90 THR CB C 90 69.553 70.703 -1.150 1
1 1059 . 16 1 1 A 90 90 THR N N 90 123.477 123.404 0.073 1
1 1060 . 16 1 1 A 91 91 LEU H H 91 9.195 8.583 0.612 1
1 1061 . 16 1 1 A 91 91 LEU HA H 91 5.161 4.827 0.334 1
1 1071 . 16 1 1 A 91 91 LEU C C 91 174.564 175.401 -0.837 1
1 1072 . 16 1 1 A 91 91 LEU CA C 91 52.590 53.803 -1.213 1
1 1073 . 16 1 1 A 91 91 LEU CB C 91 44.998 45.261 -0.263 1
1 1077 . 16 1 1 A 91 91 LEU N N 91 128.419 125.241 3.178 1
1 1078 . 16 1 1 A 92 92 LEU H H 92 8.644 8.756 -0.112 1
1 1079 . 16 1 1 A 92 92 LEU HA H 92 5.335 5.196 0.139 1
1 1089 . 16 1 1 A 92 92 LEU C C 92 176.451 175.481 0.970 1
1 1090 . 16 1 1 A 92 92 LEU CA C 92 54.220 53.602 0.618 1
1 1091 . 16 1 1 A 92 92 LEU CB C 92 44.323 42.388 1.935 1
1 1095 . 16 1 1 A 92 92 LEU N N 92 125.894 125.508 0.386 1
1 1096 . 16 1 1 A 93 93 VAL H H 93 9.249 9.129 0.120 1
1 1097 . 16 1 1 A 93 93 VAL HA H 93 5.573 5.248 0.325 1
1 1105 . 16 1 1 A 93 93 VAL C C 93 173.550 174.279 -0.729 1
1 1106 . 16 1 1 A 93 93 VAL CA C 93 58.340 60.766 -2.426 1
1 1107 . 16 1 1 A 93 93 VAL CB C 93 36.159 33.608 2.551 1
1 1110 . 16 1 1 A 93 93 VAL N N 93 120.660 121.219 -0.559 1
1 1111 . 16 1 1 A 94 94 LEU H H 94 8.634 8.967 -0.333 1
1 1112 . 16 1 1 A 94 94 LEU HA H 94 4.911 4.956 -0.045 1
1 1122 . 16 1 1 A 94 94 LEU C C 94 174.172 176.170 -1.998 1
1 1123 . 16 1 1 A 94 94 LEU CA C 94 52.659 53.434 -0.775 1
1 1124 . 16 1 1 A 94 94 LEU CB C 94 47.910 45.066 2.844 1
1 1128 . 16 1 1 A 94 94 LEU N N 94 120.304 127.979 -7.675 1
1 1129 . 16 1 1 A 95 95 ASP H H 95 8.210 8.804 -0.594 1
1 1130 . 16 1 1 A 95 95 ASP HA H 95 5.190 4.652 0.538 1
1 1133 . 16 1 1 A 95 95 ASP C C 95 175.887 178.094 -2.207 1
1 1134 . 16 1 1 A 95 95 ASP CA C 95 53.899 54.495 -0.596 1
1 1135 . 16 1 1 A 95 95 ASP CB C 95 41.188 41.458 -0.270 1
1 1136 . 16 1 1 A 95 95 ASP N N 95 122.184 123.341 -1.157 1
1 1137 . 16 1 1 A 96 96 GLY H H 96 8.478 8.819 -0.341 1
1 1138 . 16 1 1 A 96 96 GLY HA2 H 96 4.002 3.820 0.182 1
1 1139 . 16 1 1 A 96 96 GLY HA3 H 96 3.757 3.825 -0.068 1
1 1140 . 16 1 1 A 96 96 GLY C C 96 175.497 175.532 -0.035 1
1 1141 . 16 1 1 A 96 96 GLY CA C 96 49.944 47.123 2.821 1
1 1142 . 16 1 1 A 96 96 GLY N N 96 108.610 110.733 -2.123 1
1 1143 . 16 1 1 A 97 97 ASP H H 97 8.401 8.216 0.185 1
1 1144 . 16 1 1 A 97 97 ASP HA H 97 4.454 4.375 0.079 1
1 1147 . 16 1 1 A 97 97 ASP C C 97 179.612 178.570 1.042 1
1 1148 . 16 1 1 A 97 97 ASP CA C 97 57.913 57.399 0.514 1
1 1149 . 16 1 1 A 97 97 ASP CB C 97 41.145 40.599 0.546 1
1 1150 . 16 1 1 A 97 97 ASP N N 97 120.034 121.641 -1.607 1
1 1151 . 16 1 1 A 98 98 SER H H 98 8.152 8.273 -0.121 1
1 1152 . 16 1 1 A 98 98 SER HA H 98 4.218 4.353 -0.135 1
1 1155 . 16 1 1 A 98 98 SER C C 98 175.061 175.705 -0.644 1
1 1156 . 16 1 1 A 98 98 SER CA C 98 62.180 62.457 -0.277 1
1 1157 . 16 1 1 A 98 98 SER CB C 98 62.179 62.852 -0.673 1
1 1158 . 16 1 1 A 98 98 SER N N 98 117.174 115.640 1.534 1
1 1159 . 16 1 1 A 99 99 TYR H H 99 9.051 8.255 0.796 1
1 1160 . 16 1 1 A 99 99 TYR HA H 99 3.692 3.729 -0.037 1
1 1167 . 16 1 1 A 99 99 TYR C C 99 176.460 177.047 -0.587 1
1 1168 . 16 1 1 A 99 99 TYR CA C 99 62.814 61.961 0.853 1
1 1169 . 16 1 1 A 99 99 TYR CB C 99 38.829 38.645 0.184 1
1 1174 . 16 1 1 A 99 99 TYR N N 99 123.539 122.361 1.178 1
1 1175 . 16 1 1 A 100 100 GLU H H 100 8.520 8.615 -0.095 1
1 1176 . 16 1 1 A 100 100 GLU HA H 100 3.952 4.013 -0.061 1
1 1181 . 16 1 1 A 100 100 GLU C C 100 180.151 179.141 1.010 1
1 1182 . 16 1 1 A 100 100 GLU CA C 100 60.099 59.897 0.202 1
1 1183 . 16 1 1 A 100 100 GLU CB C 100 29.435 29.116 0.319 1
1 1185 . 16 1 1 A 100 100 GLU N N 100 117.082 118.401 -1.319 1
1 1186 . 16 1 1 A 101 101 LYS H H 101 7.740 8.219 -0.479 1
1 1187 . 16 1 1 A 101 101 LYS HA H 101 3.984 4.075 -0.091 1
1 1196 . 16 1 1 A 101 101 LYS C C 101 178.377 178.424 -0.047 1
1 1197 . 16 1 1 A 101 101 LYS CA C 101 59.888 59.466 0.422 1
1 1198 . 16 1 1 A 101 101 LYS CB C 101 32.821 32.394 0.427 1
1 1202 . 16 1 1 A 101 101 LYS N N 101 119.851 120.811 -0.960 1
1 1203 . 16 1 1 A 102 102 ALA H H 102 8.538 8.015 0.523 1
1 1204 . 16 1 1 A 102 102 ALA HA H 102 3.632 4.135 -0.503 1
1 1208 . 16 1 1 A 102 102 ALA C C 102 179.870 180.021 -0.151 1
1 1209 . 16 1 1 A 102 102 ALA CA C 102 55.285 55.164 0.121 1
1 1210 . 16 1 1 A 102 102 ALA CB C 102 17.163 18.239 -1.076 1
1 1211 . 16 1 1 A 102 102 ALA N N 102 124.176 121.259 2.917 1
1 1212 . 16 1 1 A 103 103 VAL H H 103 8.147 7.904 0.243 1
1 1213 . 16 1 1 A 103 103 VAL HA H 103 3.658 3.641 0.017 1
1 1221 . 16 1 1 A 103 103 VAL C C 103 181.113 178.178 2.935 1
1 1222 . 16 1 1 A 103 103 VAL CA C 103 66.090 66.890 -0.800 1
1 1223 . 16 1 1 A 103 103 VAL CB C 103 31.822 31.569 0.253 1
1 1226 . 16 1 1 A 103 103 VAL N N 103 117.841 118.286 -0.445 1
1 1227 . 16 1 1 A 104 104 LYS H H 104 7.903 7.632 0.271 1
1 1228 . 16 1 1 A 104 104 LYS HA H 104 4.065 3.972 0.093 1
1 1235 . 16 1 1 A 104 104 LYS C C 104 177.715 178.550 -0.835 1
1 1236 . 16 1 1 A 104 104 LYS CA C 104 59.094 60.301 -1.207 1
1 1237 . 16 1 1 A 104 104 LYS CB C 104 32.285 32.284 0.001 1
1 1241 . 16 1 1 A 104 104 LYS N N 104 121.515 119.060 2.455 1
1 1242 . 16 1 1 A 105 105 ASN H H 105 7.747 7.779 -0.032 1
1 1243 . 16 1 1 A 105 105 ASN HA H 105 4.721 4.853 -0.132 1
1 1248 . 16 1 1 A 105 105 ASN C C 105 173.320 173.950 -0.630 1
1 1249 . 16 1 1 A 105 105 ASN CA C 105 53.399 53.012 0.387 1
1 1250 . 16 1 1 A 105 105 ASN CB C 105 39.249 38.465 0.784 1
1 1251 . 16 1 1 A 105 105 ASN N N 105 114.941 114.781 0.160 1
1 1253 . 16 1 1 A 106 106 GLN H H 106 7.850 7.721 0.129 1
1 1254 . 16 1 1 A 106 106 GLN HA H 106 3.902 3.847 0.055 1
1 1261 . 16 1 1 A 106 106 GLN C C 106 175.168 175.143 0.025 1
1 1262 . 16 1 1 A 106 106 GLN CA C 106 56.978 56.963 0.015 1
1 1263 . 16 1 1 A 106 106 GLN CB C 106 25.770 26.704 -0.934 1
1 1265 . 16 1 1 A 106 106 GLN N N 106 114.989 115.767 -0.778 1
1 1267 . 16 1 1 A 107 107 VAL H H 107 8.005 7.704 0.301 1
1 1268 . 16 1 1 A 107 107 VAL HA H 107 3.664 3.989 -0.325 1
1 1276 . 16 1 1 A 107 107 VAL C C 107 175.468 175.223 0.245 1
1 1277 . 16 1 1 A 107 107 VAL CA C 107 62.726 63.475 -0.749 1
1 1278 . 16 1 1 A 107 107 VAL CB C 107 32.535 32.336 0.199 1
1 1281 . 16 1 1 A 107 107 VAL N N 107 120.216 119.898 0.318 1
1 1282 . 16 1 1 A 108 108 ASP H H 108 8.484 8.739 -0.255 1
1 1283 . 16 1 1 A 108 108 ASP HA H 108 4.467 4.612 -0.145 1
1 1286 . 16 1 1 A 108 108 ASP C C 108 177.179 176.161 1.018 1
1 1287 . 16 1 1 A 108 108 ASP CA C 108 53.417 54.851 -1.434 1
1 1288 . 16 1 1 A 108 108 ASP CB C 108 40.030 40.279 -0.249 1
1 1289 . 16 1 1 A 108 108 ASP N N 108 125.414 125.760 -0.346 1
1 1290 . 16 1 1 A 109 109 LEU H H 109 8.470 8.009 0.461 1
1 1291 . 16 1 1 A 109 109 LEU HA H 109 3.846 4.242 -0.396 1
1 1301 . 16 1 1 A 109 109 LEU C C 109 178.145 178.295 -0.150 1
1 1302 . 16 1 1 A 109 109 LEU CA C 109 56.573 54.876 1.697 1
1 1303 . 16 1 1 A 109 109 LEU CB C 109 42.011 42.281 -0.270 1
1 1307 . 16 1 1 A 109 109 LEU N N 109 127.577 125.198 2.379 1
1 1308 . 16 1 1 A 110 110 LYS H H 110 8.062 7.990 0.072 1
1 1309 . 16 1 1 A 110 110 LYS HA H 110 3.022 2.968 0.054 1
1 1317 . 16 1 1 A 110 110 LYS C C 110 177.248 177.773 -0.525 1
1 1318 . 16 1 1 A 110 110 LYS CA C 110 58.742 58.892 -0.150 1
1 1319 . 16 1 1 A 110 110 LYS CB C 110 31.667 31.636 0.031 1
1 1323 . 16 1 1 A 110 110 LYS N N 110 118.873 119.300 -0.427 1
1 1324 . 16 1 1 A 111 111 GLU H H 111 7.113 7.400 -0.287 1
1 1325 . 16 1 1 A 111 111 GLU HA H 111 4.117 4.444 -0.327 1
1 1330 . 16 1 1 A 111 111 GLU C C 111 176.519 175.479 1.040 1
1 1331 . 16 1 1 A 111 111 GLU CA C 111 55.621 55.698 -0.077 1
1 1332 . 16 1 1 A 111 111 GLU CB C 111 29.943 29.788 0.155 1
1 1334 . 16 1 1 A 111 111 GLU N N 111 114.282 117.061 -2.779 1
1 1335 . 16 1 1 A 112 112 LEU H H 112 6.848 7.132 -0.284 1
1 1336 . 16 1 1 A 112 112 LEU HA H 112 4.293 4.675 -0.382 1
1 1346 . 16 1 1 A 112 112 LEU C C 112 175.674 175.595 0.079 1
1 1347 . 16 1 1 A 112 112 LEU CA C 112 55.197 54.356 0.841 1
1 1348 . 16 1 1 A 112 112 LEU CB C 112 41.681 41.009 0.672 1
1 1352 . 16 1 1 A 112 112 LEU N N 112 118.934 122.761 -3.827 1
1 1353 . 16 1 1 A 113 113 ASP H H 113 8.466 8.442 0.024 1
1 1354 . 16 1 1 A 113 113 ASP HA H 113 4.593 4.907 -0.314 1
1 1357 . 16 1 1 A 113 113 ASP C C 113 174.511 175.400 -0.889 1
1 1358 . 16 1 1 A 113 113 ASP CA C 113 53.558 53.834 -0.276 1
1 1359 . 16 1 1 A 113 113 ASP CB C 113 42.448 42.528 -0.080 1
1 1360 . 16 1 1 A 113 113 ASP N N 113 122.148 124.784 -2.636 1
1 1 . 17 1 1 A 6 6 SER HA H 6 4.483 5.091 -0.608 1
1 4 . 17 1 1 A 6 6 SER C C 6 175.167 173.282 1.885 1
1 5 . 17 1 1 A 6 6 SER CA C 6 58.759 56.785 1.974 1
1 6 . 17 1 1 A 6 6 SER CB C 6 64.069 65.610 -1.541 1
1 7 . 17 1 1 A 7 7 GLY H H 7 8.431 8.845 -0.414 1
1 8 . 17 1 1 A 7 7 GLY HA2 H 7 3.973 4.072 -0.099 1
1 9 . 17 1 1 A 7 7 GLY HA3 H 7 3.973 4.075 -0.102 1
1 10 . 17 1 1 A 7 7 GLY C C 7 174.570 174.617 -0.047 1
1 11 . 17 1 1 A 7 7 GLY CA C 7 45.483 45.385 0.098 1
1 12 . 17 1 1 A 7 7 GLY N N 7 110.640 110.579 0.061 1
1 13 . 17 1 1 A 8 8 MET H H 8 8.239 8.770 -0.531 1
1 14 . 17 1 1 A 8 8 MET HA H 8 4.386 4.611 -0.225 1
1 22 . 17 1 1 A 8 8 MET C C 8 176.621 175.717 0.904 1
1 23 . 17 1 1 A 8 8 MET CA C 8 55.991 56.971 -0.980 1
1 24 . 17 1 1 A 8 8 MET CB C 8 32.986 34.694 -1.708 1
1 27 . 17 1 1 A 8 8 MET N N 8 120.219 120.577 -0.358 1
1 28 . 17 1 1 A 9 9 ALA H H 9 8.435 7.573 0.862 1
1 29 . 17 1 1 A 9 9 ALA HA H 9 4.182 4.289 -0.107 1
1 33 . 17 1 1 A 9 9 ALA C C 9 177.951 176.871 1.080 1
1 34 . 17 1 1 A 9 9 ALA CA C 9 53.399 52.013 1.386 1
1 35 . 17 1 1 A 9 9 ALA CB C 9 18.955 19.282 -0.327 1
1 36 . 17 1 1 A 9 9 ALA N N 9 124.459 122.494 1.965 1
1 37 . 17 1 1 A 10 10 SER H H 10 8.100 8.685 -0.585 1
1 38 . 17 1 1 A 10 10 SER HA H 10 4.391 4.362 0.029 1
1 41 . 17 1 1 A 10 10 SER C C 10 174.467 173.647 0.820 1
1 42 . 17 1 1 A 10 10 SER CA C 10 58.709 58.867 -0.158 1
1 43 . 17 1 1 A 10 10 SER CB C 10 63.778 63.791 -0.013 1
1 44 . 17 1 1 A 10 10 SER N N 10 113.881 119.495 -5.614 1
1 45 . 17 1 1 A 11 11 THR H H 11 7.821 8.233 -0.412 1
1 46 . 17 1 1 A 11 11 THR HA H 11 4.191 5.069 -0.878 1
1 51 . 17 1 1 A 11 11 THR C C 11 173.610 172.235 1.375 1
1 52 . 17 1 1 A 11 11 THR CA C 11 61.936 60.116 1.820 1
1 53 . 17 1 1 A 11 11 THR CB C 11 69.713 71.738 -2.025 1
1 55 . 17 1 1 A 11 11 THR N N 11 114.471 118.290 -3.819 1
1 56 . 17 1 1 A 12 12 PHE H H 12 7.946 9.249 -1.303 1
1 57 . 17 1 1 A 12 12 PHE HA H 12 4.769 4.994 -0.225 1
1 65 . 17 1 1 A 12 12 PHE C C 12 174.211 174.410 -0.199 1
1 66 . 17 1 1 A 12 12 PHE CA C 12 56.644 57.205 -0.561 1
1 67 . 17 1 1 A 12 12 PHE CB C 12 40.609 41.406 -0.797 1
1 73 . 17 1 1 A 12 12 PHE N N 12 120.763 125.793 -5.030 1
1 74 . 17 1 1 A 13 13 ASN H H 13 9.004 9.180 -0.176 1
1 75 . 17 1 1 A 13 13 ASN HA H 13 5.366 5.388 -0.022 1
1 80 . 17 1 1 A 13 13 ASN C C 13 172.158 174.326 -2.168 1
1 81 . 17 1 1 A 13 13 ASN CA C 13 50.988 50.671 0.317 1
1 82 . 17 1 1 A 13 13 ASN CB C 13 39.942 38.995 0.947 1
1 83 . 17 1 1 A 13 13 ASN N N 13 119.973 119.601 0.372 1
1 85 . 17 1 1 A 14 14 PRO HA H 14 4.945 4.706 0.239 1
1 92 . 17 1 1 A 14 14 PRO C C 14 174.901 175.551 -0.650 1
1 93 . 17 1 1 A 14 14 PRO CA C 14 63.096 62.381 0.715 1
1 94 . 17 1 1 A 14 14 PRO CB C 14 32.739 32.973 -0.234 1
1 97 . 17 1 1 A 15 15 ARG H H 15 8.908 9.065 -0.157 1
1 98 . 17 1 1 A 15 15 ARG HA H 15 4.626 4.829 -0.203 1
1 106 . 17 1 1 A 15 15 ARG C C 15 174.432 174.607 -0.175 1
1 107 . 17 1 1 A 15 15 ARG CA C 15 54.827 55.109 -0.282 1
1 108 . 17 1 1 A 15 15 ARG CB C 15 32.439 33.751 -1.312 1
1 111 . 17 1 1 A 15 15 ARG N N 15 118.947 121.874 -2.927 1
1 113 . 17 1 1 A 16 16 GLU H H 16 8.838 8.826 0.012 1
1 114 . 17 1 1 A 16 16 GLU HA H 16 4.876 5.028 -0.152 1
1 119 . 17 1 1 A 16 16 GLU C C 16 175.767 175.130 0.637 1
1 120 . 17 1 1 A 16 16 GLU CA C 16 55.621 56.062 -0.441 1
1 121 . 17 1 1 A 16 16 GLU CB C 16 31.093 31.267 -0.174 1
1 123 . 17 1 1 A 16 16 GLU N N 16 125.316 127.793 -2.477 1
1 124 . 17 1 1 A 17 17 CYS H H 17 9.327 9.195 0.132 1
1 125 . 17 1 1 A 17 17 CYS HA H 17 4.804 5.172 -0.368 1
1 128 . 17 1 1 A 17 17 CYS C C 17 172.973 173.324 -0.351 1
1 129 . 17 1 1 A 17 17 CYS CA C 17 57.930 56.947 0.983 1
1 130 . 17 1 1 A 17 17 CYS CB C 17 30.105 28.865 1.240 1
1 131 . 17 1 1 A 17 17 CYS N N 17 127.909 125.268 2.641 1
1 132 . 17 1 1 A 18 18 LYS H H 18 9.022 8.844 0.178 1
1 133 . 17 1 1 A 18 18 LYS HA H 18 4.769 4.613 0.156 1
1 142 . 17 1 1 A 18 18 LYS C C 18 174.586 175.421 -0.835 1
1 143 . 17 1 1 A 18 18 LYS CA C 18 55.956 55.250 0.706 1
1 144 . 17 1 1 A 18 18 LYS CB C 18 32.203 32.610 -0.407 1
1 148 . 17 1 1 A 18 18 LYS N N 18 127.039 125.646 1.393 1
1 149 . 17 1 1 A 19 19 LEU H H 19 8.784 8.570 0.214 1
1 150 . 17 1 1 A 19 19 LEU HA H 19 4.852 4.717 0.135 1
1 160 . 17 1 1 A 19 19 LEU C C 19 176.862 176.113 0.749 1
1 161 . 17 1 1 A 19 19 LEU CA C 19 55.391 53.976 1.415 1
1 162 . 17 1 1 A 19 19 LEU CB C 19 44.442 42.483 1.959 1
1 166 . 17 1 1 A 19 19 LEU N N 19 126.311 126.362 -0.051 1
1 167 . 17 1 1 A 20 20 SER H H 20 8.215 8.925 -0.710 1
1 168 . 17 1 1 A 20 20 SER HA H 20 5.461 5.461 0.000 1
1 171 . 17 1 1 A 20 20 SER C C 20 171.960 173.429 -1.469 1
1 172 . 17 1 1 A 20 20 SER CA C 20 57.525 56.797 0.728 1
1 173 . 17 1 1 A 20 20 SER CB C 20 65.794 65.720 0.074 1
1 174 . 17 1 1 A 20 20 SER N N 20 115.113 116.306 -1.193 1
1 175 . 17 1 1 A 21 21 LYS H H 21 9.001 8.746 0.255 1
1 176 . 17 1 1 A 21 21 LYS HA H 21 4.887 4.963 -0.076 1
1 185 . 17 1 1 A 21 21 LYS C C 21 174.133 175.211 -1.078 1
1 186 . 17 1 1 A 21 21 LYS CA C 21 53.840 54.222 -0.382 1
1 187 . 17 1 1 A 21 21 LYS CB C 21 36.553 35.749 0.804 1
1 191 . 17 1 1 A 21 21 LYS N N 21 120.938 121.096 -0.158 1
1 192 . 17 1 1 A 22 22 GLN H H 22 8.201 8.216 -0.015 1
1 193 . 17 1 1 A 22 22 GLN HA H 22 4.448 4.436 0.012 1
1 200 . 17 1 1 A 22 22 GLN C C 22 176.372 175.417 0.955 1
1 201 . 17 1 1 A 22 22 GLN CA C 22 53.658 55.199 -1.541 1
1 202 . 17 1 1 A 22 22 GLN CB C 22 30.473 29.931 0.542 1
1 204 . 17 1 1 A 22 22 GLN N N 22 116.816 119.620 -2.804 1
1 206 . 17 1 1 A 23 23 GLU H H 23 8.624 8.472 0.152 1
1 207 . 17 1 1 A 23 23 GLU HA H 23 4.056 4.234 -0.178 1
1 212 . 17 1 1 A 23 23 GLU C C 23 177.778 177.114 0.664 1
1 213 . 17 1 1 A 23 23 GLU CA C 23 58.001 57.174 0.827 1
1 214 . 17 1 1 A 23 23 GLU CB C 23 29.237 28.987 0.250 1
1 216 . 17 1 1 A 23 23 GLU N N 23 122.364 120.283 2.081 1
1 217 . 17 1 1 A 24 24 GLY H H 24 8.962 8.670 0.292 1
1 218 . 17 1 1 A 24 24 GLY HA2 H 24 4.139 3.916 0.223 1
1 219 . 17 1 1 A 24 24 GLY HA3 H 24 3.711 3.923 -0.212 1
1 220 . 17 1 1 A 24 24 GLY C C 24 173.857 173.652 0.205 1
1 221 . 17 1 1 A 24 24 GLY CA C 24 45.288 45.517 -0.229 1
1 222 . 17 1 1 A 24 24 GLY N N 24 113.942 113.531 0.411 1
1 223 . 17 1 1 A 25 25 GLN H H 25 7.643 7.362 0.281 1
1 224 . 17 1 1 A 25 25 GLN HA H 25 4.488 4.648 -0.160 1
1 231 . 17 1 1 A 25 25 GLN C C 25 174.727 175.700 -0.973 1
1 232 . 17 1 1 A 25 25 GLN CA C 25 54.052 54.009 0.043 1
1 233 . 17 1 1 A 25 25 GLN CB C 25 30.843 31.475 -0.632 1
1 235 . 17 1 1 A 25 25 GLN N N 25 119.538 120.193 -0.655 1
1 237 . 17 1 1 A 26 26 ASN H H 26 8.625 8.490 0.135 1
1 238 . 17 1 1 A 26 26 ASN HA H 26 4.862 4.878 -0.016 1
1 243 . 17 1 1 A 26 26 ASN C C 26 176.261 175.745 0.516 1
1 244 . 17 1 1 A 26 26 ASN CA C 26 51.812 51.506 0.306 1
1 245 . 17 1 1 A 26 26 ASN CB C 26 40.403 38.840 1.563 1
1 246 . 17 1 1 A 26 26 ASN N N 26 120.047 122.301 -2.254 1
1 248 . 17 1 1 A 27 27 TYR HA H 27 4.152 4.708 -0.556 1
1 255 . 17 1 1 A 27 27 TYR C C 27 176.731 176.115 0.616 1
1 256 . 17 1 1 A 27 27 TYR CA C 27 62.462 58.437 4.025 1
1 257 . 17 1 1 A 27 27 TYR CB C 27 40.240 39.889 0.351 1
1 262 . 17 1 1 A 27 27 TYR N N 27 121.761 118.367 3.394 1
1 263 . 17 1 1 A 28 28 GLY H H 28 8.285 7.979 0.306 1
1 264 . 17 1 1 A 28 28 GLY HA2 H 28 4.490 3.924 0.566 1
1 265 . 17 1 1 A 28 28 GLY HA3 H 28 3.759 4.025 -0.266 1
1 266 . 17 1 1 A 28 28 GLY C C 28 172.198 173.988 -1.790 1
1 267 . 17 1 1 A 28 28 GLY CA C 28 46.139 45.259 0.880 1
1 268 . 17 1 1 A 28 28 GLY N N 28 103.567 107.212 -3.645 1
1 269 . 17 1 1 A 29 29 PHE H H 29 6.878 7.896 -1.018 1
1 270 . 17 1 1 A 29 29 PHE HA H 29 5.179 4.934 0.245 1
1 278 . 17 1 1 A 29 29 PHE C C 29 172.840 173.784 -0.944 1
1 279 . 17 1 1 A 29 29 PHE CA C 29 55.262 55.277 -0.015 1
1 280 . 17 1 1 A 29 29 PHE CB C 29 41.779 42.070 -0.291 1
1 286 . 17 1 1 A 29 29 PHE N N 29 111.027 117.442 -6.415 1
1 287 . 17 1 1 A 30 30 PHE H H 30 8.806 8.996 -0.190 1
1 288 . 17 1 1 A 30 30 PHE HA H 30 4.923 4.671 0.252 1
1 296 . 17 1 1 A 30 30 PHE C C 30 174.501 175.560 -1.059 1
1 297 . 17 1 1 A 30 30 PHE CA C 30 55.356 56.326 -0.970 1
1 298 . 17 1 1 A 30 30 PHE CB C 30 41.681 42.018 -0.337 1
1 304 . 17 1 1 A 30 30 PHE N N 30 118.710 118.583 0.127 1
1 305 . 17 1 1 A 31 31 LEU H H 31 8.441 8.743 -0.302 1
1 306 . 17 1 1 A 31 31 LEU HA H 31 5.447 4.752 0.695 1
1 316 . 17 1 1 A 31 31 LEU C C 31 177.306 176.261 1.045 1
1 317 . 17 1 1 A 31 31 LEU CA C 31 53.610 54.547 -0.937 1
1 318 . 17 1 1 A 31 31 LEU CB C 31 43.696 41.165 2.531 1
1 322 . 17 1 1 A 31 31 LEU N N 31 123.765 124.427 -0.662 1
1 323 . 17 1 1 A 32 32 ARG H H 32 9.381 9.165 0.216 1
1 324 . 17 1 1 A 32 32 ARG HA H 32 4.840 4.863 -0.023 1
1 331 . 17 1 1 A 32 32 ARG C C 32 175.155 175.208 -0.053 1
1 332 . 17 1 1 A 32 32 ARG CA C 32 54.210 53.967 0.243 1
1 333 . 17 1 1 A 32 32 ARG CB C 32 35.087 33.700 1.387 1
1 336 . 17 1 1 A 32 32 ARG N N 32 123.160 124.063 -0.903 1
1 337 . 17 1 1 A 33 33 ILE H H 33 7.891 8.595 -0.704 1
1 338 . 17 1 1 A 33 33 ILE HA H 33 4.495 4.905 -0.410 1
1 348 . 17 1 1 A 33 33 ILE C C 33 175.850 173.741 2.109 1
1 349 . 17 1 1 A 33 33 ILE CA C 33 59.641 59.062 0.579 1
1 350 . 17 1 1 A 33 33 ILE CB C 33 39.538 41.548 -2.010 1
1 354 . 17 1 1 A 33 33 ILE N N 33 118.924 117.529 1.395 1
1 355 . 17 1 1 A 34 34 GLU H H 34 8.971 8.911 0.060 1
1 356 . 17 1 1 A 34 34 GLU HA H 34 4.578 4.888 -0.310 1
1 361 . 17 1 1 A 34 34 GLU C C 34 175.766 175.259 0.507 1
1 362 . 17 1 1 A 34 34 GLU CA C 34 54.263 54.441 -0.178 1
1 363 . 17 1 1 A 34 34 GLU CB C 34 32.128 32.878 -0.750 1
1 365 . 17 1 1 A 34 34 GLU N N 34 125.447 124.374 1.073 1
1 366 . 17 1 1 A 35 35 LYS H H 35 8.504 8.574 -0.070 1
1 367 . 17 1 1 A 35 35 LYS HA H 35 4.026 4.313 -0.287 1
1 376 . 17 1 1 A 35 35 LYS C C 35 177.701 176.452 1.249 1
1 377 . 17 1 1 A 35 35 LYS CA C 35 57.591 56.225 1.366 1
1 378 . 17 1 1 A 35 35 LYS CB C 35 32.491 33.402 -0.911 1
1 382 . 17 1 1 A 35 35 LYS N N 35 122.893 124.600 -1.707 1
1 383 . 17 1 1 A 36 36 ASP H H 36 9.020 8.884 0.136 1
1 384 . 17 1 1 A 36 36 ASP HA H 36 4.385 4.151 0.234 1
1 387 . 17 1 1 A 36 36 ASP C C 36 174.554 174.729 -0.175 1
1 388 . 17 1 1 A 36 36 ASP CA C 36 55.868 55.187 0.681 1
1 389 . 17 1 1 A 36 36 ASP CB C 36 39.826 39.588 0.238 1
1 390 . 17 1 1 A 36 36 ASP N N 36 121.412 120.700 0.712 1
1 391 . 17 1 1 A 37 37 THR H H 37 7.464 7.691 -0.227 1
1 392 . 17 1 1 A 37 37 THR HA H 37 4.454 4.875 -0.421 1
1 397 . 17 1 1 A 37 37 THR C C 37 172.012 171.718 0.294 1
1 398 . 17 1 1 A 37 37 THR CA C 37 61.686 59.724 1.962 1
1 399 . 17 1 1 A 37 37 THR CB C 37 70.927 71.122 -0.195 1
1 401 . 17 1 1 A 37 37 THR N N 37 113.147 111.606 1.541 1
1 402 . 17 1 1 A 38 38 ASP H H 38 8.931 8.649 0.282 1
1 403 . 17 1 1 A 38 38 ASP HA H 38 4.852 5.127 -0.275 1
1 406 . 17 1 1 A 38 38 ASP CA C 38 54.826 52.759 2.067 1
1 407 . 17 1 1 A 38 38 ASP CB C 38 43.332 43.521 -0.189 1
1 408 . 17 1 1 A 38 38 ASP N N 38 120.401 124.372 -3.971 1
1 409 . 17 1 1 A 39 39 GLY H H 39 8.068 8.461 -0.393 1
1 410 . 17 1 1 A 39 39 GLY HA2 H 39 3.774 4.001 -0.227 1
1 411 . 17 1 1 A 39 39 GLY HA3 H 39 3.555 4.004 -0.449 1
1 412 . 17 1 1 A 39 39 GLY C C 39 172.578 173.411 -0.833 1
1 413 . 17 1 1 A 39 39 GLY CA C 39 43.967 44.588 -0.621 1
1 414 . 17 1 1 A 39 39 GLY N N 39 107.925 113.804 -5.879 1
1 415 . 17 1 1 A 40 40 HIS H H 40 9.111 8.457 0.654 1
1 416 . 17 1 1 A 40 40 HIS HA H 40 4.650 4.931 -0.281 1
1 421 . 17 1 1 A 40 40 HIS C C 40 174.330 174.679 -0.349 1
1 422 . 17 1 1 A 40 40 HIS CA C 40 55.886 55.981 -0.095 1
1 423 . 17 1 1 A 40 40 HIS CB C 40 30.507 32.218 -1.711 1
1 426 . 17 1 1 A 40 40 HIS N N 40 119.179 119.676 -0.497 1
1 427 . 17 1 1 A 41 41 LEU H H 41 8.254 8.922 -0.668 1
1 428 . 17 1 1 A 41 41 LEU HA H 41 4.626 5.058 -0.432 1
1 438 . 17 1 1 A 41 41 LEU C C 41 176.035 176.013 0.022 1
1 439 . 17 1 1 A 41 41 LEU CA C 41 55.621 53.204 2.417 1
1 440 . 17 1 1 A 41 41 LEU CB C 41 45.091 44.227 0.864 1
1 444 . 17 1 1 A 41 41 LEU N N 41 124.808 121.175 3.633 1
1 445 . 17 1 1 A 42 42 ILE H H 42 8.685 8.282 0.403 1
1 446 . 17 1 1 A 42 42 ILE HA H 42 4.578 4.576 0.002 1
1 456 . 17 1 1 A 42 42 ILE C C 42 175.369 176.278 -0.909 1
1 457 . 17 1 1 A 42 42 ILE CA C 42 59.852 61.037 -1.185 1
1 458 . 17 1 1 A 42 42 ILE CB C 42 36.778 38.132 -1.354 1
1 462 . 17 1 1 A 42 42 ILE N N 42 121.814 124.860 -3.046 1
1 463 . 17 1 1 A 43 43 ARG H H 43 8.787 8.677 0.110 1
1 464 . 17 1 1 A 43 43 ARG HA H 43 4.852 4.922 -0.070 1
1 472 . 17 1 1 A 43 43 ARG C C 43 174.029 175.530 -1.501 1
1 473 . 17 1 1 A 43 43 ARG CA C 43 52.730 54.021 -1.291 1
1 474 . 17 1 1 A 43 43 ARG CB C 43 36.983 34.015 2.968 1
1 477 . 17 1 1 A 43 43 ARG N N 43 125.771 126.697 -0.926 1
1 479 . 17 1 1 A 44 44 VAL H H 44 8.661 8.602 0.059 1
1 480 . 17 1 1 A 44 44 VAL HA H 44 3.276 3.703 -0.427 1
1 488 . 17 1 1 A 44 44 VAL C C 44 173.227 175.001 -1.774 1
1 489 . 17 1 1 A 44 44 VAL CA C 44 63.161 63.282 -0.121 1
1 490 . 17 1 1 A 44 44 VAL CB C 44 29.054 29.805 -0.751 1
1 493 . 17 1 1 A 44 44 VAL N N 44 117.026 116.594 0.432 1
1 494 . 17 1 1 A 45 45 ILE H H 45 8.464 7.975 0.489 1
1 495 . 17 1 1 A 45 45 ILE HA H 45 4.579 4.288 0.291 1
1 505 . 17 1 1 A 45 45 ILE C C 45 178.108 175.482 2.626 1
1 506 . 17 1 1 A 45 45 ILE CA C 45 59.888 61.146 -1.258 1
1 507 . 17 1 1 A 45 45 ILE CB C 45 36.998 36.312 0.686 1
1 511 . 17 1 1 A 45 45 ILE N N 45 122.767 122.668 0.099 1
1 512 . 17 1 1 A 46 46 GLU H H 46 9.015 8.582 0.433 1
1 513 . 17 1 1 A 46 46 GLU HA H 46 4.206 4.226 -0.020 1
1 518 . 17 1 1 A 46 46 GLU C C 46 177.746 176.025 1.721 1
1 519 . 17 1 1 A 46 46 GLU CA C 46 56.130 57.199 -1.069 1
1 520 . 17 1 1 A 46 46 GLU CB C 46 30.581 30.183 0.398 1
1 522 . 17 1 1 A 46 46 GLU N N 46 131.076 127.990 3.086 1
1 523 . 17 1 1 A 47 47 GLU H H 47 9.213 8.715 0.498 1
1 524 . 17 1 1 A 47 47 GLU HA H 47 4.194 4.004 0.190 1
1 529 . 17 1 1 A 47 47 GLU C C 47 178.088 177.698 0.390 1
1 530 . 17 1 1 A 47 47 GLU CA C 47 58.212 58.183 0.029 1
1 531 . 17 1 1 A 47 47 GLU CB C 47 29.390 29.749 -0.359 1
1 533 . 17 1 1 A 47 47 GLU N N 47 129.592 124.866 4.726 1
1 534 . 17 1 1 A 48 48 GLY H H 48 9.586 8.948 0.638 1
1 535 . 17 1 1 A 48 48 GLY HA2 H 48 4.141 3.874 0.267 1
1 536 . 17 1 1 A 48 48 GLY HA3 H 48 3.757 3.874 -0.117 1
1 537 . 17 1 1 A 48 48 GLY C C 48 173.790 174.001 -0.211 1
1 538 . 17 1 1 A 48 48 GLY CA C 48 45.764 46.835 -1.071 1
1 539 . 17 1 1 A 48 48 GLY N N 48 114.819 114.943 -0.124 1
1 540 . 17 1 1 A 49 49 SER H H 49 7.580 7.867 -0.287 1
1 541 . 17 1 1 A 49 49 SER HA H 49 4.728 4.972 -0.244 1
1 544 . 17 1 1 A 49 49 SER C C 49 173.542 174.154 -0.612 1
1 545 . 17 1 1 A 49 49 SER CA C 49 57.560 55.518 2.042 1
1 546 . 17 1 1 A 49 49 SER CB C 49 64.529 64.314 0.215 1
1 547 . 17 1 1 A 49 49 SER N N 49 114.688 113.507 1.181 1
1 548 . 17 1 1 A 50 50 PRO HA H 50 4.431 4.560 -0.129 1
1 555 . 17 1 1 A 50 50 PRO C C 50 179.377 177.623 1.754 1
1 556 . 17 1 1 A 50 50 PRO CA C 50 66.059 64.237 1.822 1
1 557 . 17 1 1 A 50 50 PRO CB C 50 32.598 31.913 0.685 1
1 560 . 17 1 1 A 51 51 ALA H H 51 8.264 8.107 0.157 1
1 561 . 17 1 1 A 51 51 ALA HA H 51 3.817 4.036 -0.219 1
1 565 . 17 1 1 A 51 51 ALA C C 51 177.508 179.645 -2.137 1
1 566 . 17 1 1 A 51 51 ALA CA C 51 55.392 54.848 0.544 1
1 567 . 17 1 1 A 51 51 ALA CB C 51 20.474 18.578 1.896 1
1 568 . 17 1 1 A 51 51 ALA N N 51 117.604 120.723 -3.119 1
1 569 . 17 1 1 A 52 52 GLU H H 52 7.794 7.359 0.435 1
1 570 . 17 1 1 A 52 52 GLU HA H 52 3.881 4.251 -0.370 1
1 575 . 17 1 1 A 52 52 GLU C C 52 181.401 179.453 1.948 1
1 576 . 17 1 1 A 52 52 GLU CA C 52 59.454 59.086 0.368 1
1 577 . 17 1 1 A 52 52 GLU CB C 52 30.247 29.571 0.676 1
1 579 . 17 1 1 A 52 52 GLU N N 52 119.474 118.314 1.160 1
1 580 . 17 1 1 A 53 53 LYS H H 53 8.557 7.605 0.952 1
1 581 . 17 1 1 A 53 53 LYS HA H 53 4.020 4.083 -0.063 1
1 588 . 17 1 1 A 53 53 LYS C C 53 177.939 177.805 0.134 1
1 589 . 17 1 1 A 53 53 LYS CA C 53 59.012 58.455 0.557 1
1 590 . 17 1 1 A 53 53 LYS CB C 53 32.438 32.174 0.264 1
1 594 . 17 1 1 A 53 53 LYS N N 53 120.057 119.915 0.142 1
1 595 . 17 1 1 A 54 54 ALA H H 54 7.764 7.572 0.192 1
1 596 . 17 1 1 A 54 54 ALA HA H 54 4.400 4.330 0.070 1
1 600 . 17 1 1 A 54 54 ALA C C 54 177.658 178.353 -0.695 1
1 601 . 17 1 1 A 54 54 ALA CA C 54 52.412 51.645 0.767 1
1 602 . 17 1 1 A 54 54 ALA CB C 54 20.739 18.493 2.246 1
1 603 . 17 1 1 A 54 54 ALA N N 54 117.678 118.824 -1.146 1
1 604 . 17 1 1 A 55 55 GLY H H 55 7.583 8.439 -0.856 1
1 605 . 17 1 1 A 55 55 GLY HA2 H 55 4.266 3.937 0.329 1
1 606 . 17 1 1 A 55 55 GLY HA3 H 55 3.775 3.943 -0.168 1
1 607 . 17 1 1 A 55 55 GLY C C 55 175.232 174.325 0.907 1
1 608 . 17 1 1 A 55 55 GLY CA C 55 45.368 45.120 0.248 1
1 609 . 17 1 1 A 55 55 GLY N N 55 103.265 107.793 -4.528 1
1 610 . 17 1 1 A 56 56 LEU H H 56 7.280 7.770 -0.490 1
1 611 . 17 1 1 A 56 56 LEU HA H 56 3.984 4.134 -0.150 1
1 621 . 17 1 1 A 56 56 LEU C C 56 174.708 175.275 -0.567 1
1 622 . 17 1 1 A 56 56 LEU CA C 56 55.603 55.465 0.138 1
1 623 . 17 1 1 A 56 56 LEU CB C 56 42.752 42.461 0.291 1
1 627 . 17 1 1 A 56 56 LEU N N 56 119.211 123.027 -3.816 1
1 628 . 17 1 1 A 57 57 LEU H H 57 8.693 8.341 0.352 1
1 629 . 17 1 1 A 57 57 LEU HA H 57 4.499 4.962 -0.463 1
1 639 . 17 1 1 A 57 57 LEU C C 57 176.124 175.771 0.353 1
1 640 . 17 1 1 A 57 57 LEU CA C 57 52.959 53.315 -0.356 1
1 641 . 17 1 1 A 57 57 LEU CB C 57 45.122 44.875 0.247 1
1 645 . 17 1 1 A 57 57 LEU N N 57 121.969 129.138 -7.169 1
1 646 . 17 1 1 A 58 58 ASP H H 58 8.334 8.718 -0.384 1
1 647 . 17 1 1 A 58 58 ASP HA H 58 4.139 4.508 -0.369 1
1 650 . 17 1 1 A 58 58 ASP C C 58 178.636 176.807 1.829 1
1 651 . 17 1 1 A 58 58 ASP CA C 58 56.079 55.352 0.727 1
1 652 . 17 1 1 A 58 58 ASP CB C 58 42.135 40.415 1.720 1
1 653 . 17 1 1 A 58 58 ASP N N 58 120.401 121.446 -1.045 1
1 654 . 17 1 1 A 59 59 GLY H H 59 9.378 8.873 0.505 1
1 655 . 17 1 1 A 59 59 GLY HA2 H 59 4.317 3.946 0.371 1
1 656 . 17 1 1 A 59 59 GLY HA3 H 59 3.260 3.951 -0.691 1
1 657 . 17 1 1 A 59 59 GLY C C 59 173.359 173.536 -0.177 1
1 658 . 17 1 1 A 59 59 GLY CA C 59 45.517 45.086 0.431 1
1 659 . 17 1 1 A 59 59 GLY N N 59 116.622 112.096 4.526 1
1 660 . 17 1 1 A 60 60 ASP H H 60 8.009 7.879 0.130 1
1 661 . 17 1 1 A 60 60 ASP HA H 60 4.638 4.960 -0.322 1
1 664 . 17 1 1 A 60 60 ASP C C 60 175.555 175.434 0.121 1
1 665 . 17 1 1 A 60 60 ASP CA C 60 55.286 53.395 1.891 1
1 666 . 17 1 1 A 60 60 ASP CB C 60 42.381 42.713 -0.332 1
1 667 . 17 1 1 A 60 60 ASP N N 60 121.370 120.685 0.685 1
1 668 . 17 1 1 A 61 61 ARG H H 61 8.648 8.706 -0.058 1
1 669 . 17 1 1 A 61 61 ARG HA H 61 5.179 5.309 -0.130 1
1 677 . 17 1 1 A 61 61 ARG C C 61 177.381 174.229 3.152 1
1 678 . 17 1 1 A 61 61 ARG CA C 61 53.704 54.473 -0.769 1
1 679 . 17 1 1 A 61 61 ARG CB C 61 34.017 32.812 1.205 1
1 682 . 17 1 1 A 61 61 ARG N N 61 116.958 120.743 -3.785 1
1 684 . 17 1 1 A 62 62 VAL H H 62 8.247 8.492 -0.245 1
1 685 . 17 1 1 A 62 62 VAL HA H 62 3.806 4.721 -0.915 1
1 693 . 17 1 1 A 62 62 VAL C C 62 174.748 174.781 -0.033 1
1 694 . 17 1 1 A 62 62 VAL CA C 62 63.149 60.787 2.362 1
1 695 . 17 1 1 A 62 62 VAL CB C 62 32.574 32.751 -0.177 1
1 698 . 17 1 1 A 62 62 VAL N N 62 118.546 124.908 -6.362 1
1 699 . 17 1 1 A 63 63 LEU H H 63 9.262 9.094 0.168 1
1 700 . 17 1 1 A 63 63 LEU HA H 63 4.412 4.231 0.181 1
1 710 . 17 1 1 A 63 63 LEU C C 63 177.649 177.120 0.529 1
1 711 . 17 1 1 A 63 63 LEU CA C 63 56.044 56.634 -0.590 1
1 712 . 17 1 1 A 63 63 LEU CB C 63 43.339 42.707 0.632 1
1 716 . 17 1 1 A 63 63 LEU N N 63 125.413 131.004 -5.591 1
1 717 . 17 1 1 A 64 64 ARG H H 64 7.806 7.682 0.124 1
1 718 . 17 1 1 A 64 64 ARG HA H 64 5.704 4.993 0.711 1
1 726 . 17 1 1 A 64 64 ARG C C 64 175.091 174.113 0.978 1
1 727 . 17 1 1 A 64 64 ARG CA C 64 54.148 54.687 -0.539 1
1 728 . 17 1 1 A 64 64 ARG CB C 64 35.742 33.670 2.072 1
1 731 . 17 1 1 A 64 64 ARG N N 64 112.961 117.035 -4.074 1
1 733 . 17 1 1 A 65 65 ILE H H 65 8.327 9.158 -0.831 1
1 734 . 17 1 1 A 65 65 ILE HA H 65 4.384 4.598 -0.214 1
1 744 . 17 1 1 A 65 65 ILE C C 65 175.722 175.666 0.056 1
1 745 . 17 1 1 A 65 65 ILE CA C 65 60.501 59.425 1.076 1
1 746 . 17 1 1 A 65 65 ILE CB C 65 39.547 40.148 -0.601 1
1 750 . 17 1 1 A 65 65 ILE N N 65 119.175 123.781 -4.606 1
1 751 . 17 1 1 A 66 66 ASN H H 66 9.911 9.321 0.590 1
1 752 . 17 1 1 A 66 66 ASN HA H 66 4.428 4.383 0.045 1
1 757 . 17 1 1 A 66 66 ASN C C 66 175.349 174.635 0.714 1
1 758 . 17 1 1 A 66 66 ASN CA C 66 54.157 54.193 -0.036 1
1 759 . 17 1 1 A 66 66 ASN CB C 66 37.024 37.483 -0.459 1
1 760 . 17 1 1 A 66 66 ASN N N 66 128.952 127.993 0.959 1
1 762 . 17 1 1 A 67 67 GLY H H 67 9.230 8.617 0.613 1
1 763 . 17 1 1 A 67 67 GLY HA2 H 67 4.322 3.952 0.370 1
1 764 . 17 1 1 A 67 67 GLY HA3 H 67 3.508 3.960 -0.452 1
1 765 . 17 1 1 A 67 67 GLY C C 67 174.393 173.994 0.399 1
1 766 . 17 1 1 A 67 67 GLY CA C 67 45.341 46.536 -1.195 1
1 767 . 17 1 1 A 67 67 GLY N N 67 103.238 104.675 -1.437 1
1 768 . 17 1 1 A 68 68 VAL H H 68 8.063 7.678 0.385 1
1 769 . 17 1 1 A 68 68 VAL HA H 68 4.015 4.608 -0.593 1
1 777 . 17 1 1 A 68 68 VAL C C 68 175.833 174.782 1.051 1
1 778 . 17 1 1 A 68 68 VAL CA C 68 62.603 61.357 1.246 1
1 779 . 17 1 1 A 68 68 VAL CB C 68 32.574 35.197 -2.623 1
1 782 . 17 1 1 A 68 68 VAL N N 68 125.696 119.539 6.157 1
1 783 . 17 1 1 A 69 69 PHE H H 69 9.301 9.122 0.179 1
1 784 . 17 1 1 A 69 69 PHE HA H 69 4.947 4.571 0.376 1
1 792 . 17 1 1 A 69 69 PHE C C 69 177.120 175.444 1.676 1
1 793 . 17 1 1 A 69 69 PHE CA C 69 59.200 59.638 -0.438 1
1 794 . 17 1 1 A 69 69 PHE CB C 69 39.320 39.598 -0.278 1
1 800 . 17 1 1 A 69 69 PHE N N 69 128.641 128.969 -0.328 1
1 801 . 17 1 1 A 70 70 VAL H H 70 8.312 8.038 0.274 1
1 802 . 17 1 1 A 70 70 VAL HA H 70 4.517 4.506 0.011 1
1 810 . 17 1 1 A 70 70 VAL CA C 70 60.734 60.522 0.212 1
1 811 . 17 1 1 A 70 70 VAL CB C 70 32.976 31.320 1.656 1
1 814 . 17 1 1 A 70 70 VAL N N 70 118.381 120.863 -2.482 1
1 815 . 17 1 1 A 71 71 ASP H H 71 5.373 7.386 -2.013 1
1 816 . 17 1 1 A 71 71 ASP HA H 71 4.413 4.300 0.113 1
1 819 . 17 1 1 A 71 71 ASP C C 71 174.896 178.028 -3.132 1
1 820 . 17 1 1 A 71 71 ASP CA C 71 58.334 57.046 1.288 1
1 821 . 17 1 1 A 71 71 ASP CB C 71 46.097 40.905 5.192 1
1 822 . 17 1 1 A 71 71 ASP N N 71 119.008 122.223 -3.215 1
1 823 . 17 1 1 A 72 72 LYS H H 72 7.874 7.914 -0.040 1
1 824 . 17 1 1 A 72 72 LYS HA H 72 4.522 4.460 0.062 1
1 833 . 17 1 1 A 72 72 LYS C C 72 177.209 177.018 0.191 1
1 834 . 17 1 1 A 72 72 LYS CA C 72 54.122 57.740 -3.618 1
1 835 . 17 1 1 A 72 72 LYS CB C 72 31.640 33.790 -2.150 1
1 839 . 17 1 1 A 72 72 LYS N N 72 110.259 118.348 -8.089 1
1 840 . 17 1 1 A 73 73 GLU H H 73 7.421 7.840 -0.419 1
1 841 . 17 1 1 A 73 73 GLU HA H 73 4.401 4.410 -0.009 1
1 846 . 17 1 1 A 73 73 GLU C C 73 176.728 175.583 1.145 1
1 847 . 17 1 1 A 73 73 GLU CA C 73 54.950 57.050 -2.100 1
1 848 . 17 1 1 A 73 73 GLU CB C 73 30.390 30.662 -0.272 1
1 850 . 17 1 1 A 73 73 GLU N N 73 120.043 119.184 0.859 1
1 851 . 17 1 1 A 74 74 GLU H H 74 9.360 8.517 0.843 1
1 852 . 17 1 1 A 74 74 GLU HA H 74 4.403 4.810 -0.407 1
1 857 . 17 1 1 A 74 74 GLU C C 74 178.234 176.967 1.267 1
1 858 . 17 1 1 A 74 74 GLU CA C 74 56.516 55.182 1.334 1
1 859 . 17 1 1 A 74 74 GLU CB C 74 30.390 32.296 -1.906 1
1 861 . 17 1 1 A 74 74 GLU N N 74 122.193 122.038 0.155 1
1 862 . 17 1 1 A 75 75 HIS H H 75 9.553 9.205 0.348 1
1 863 . 17 1 1 A 75 75 HIS HA H 75 4.080 4.217 -0.137 1
1 868 . 17 1 1 A 75 75 HIS C C 75 175.985 176.700 -0.715 1
1 869 . 17 1 1 A 75 75 HIS CA C 75 61.016 60.798 0.218 1
1 870 . 17 1 1 A 75 75 HIS CB C 75 29.468 30.694 -1.226 1
1 873 . 17 1 1 A 75 75 HIS N N 75 123.587 127.318 -3.731 1
1 874 . 17 1 1 A 76 76 ALA H H 76 9.129 8.273 0.856 1
1 875 . 17 1 1 A 76 76 ALA HA H 76 3.826 3.764 0.062 1
1 879 . 17 1 1 A 76 76 ALA C C 76 180.475 178.805 1.670 1
1 880 . 17 1 1 A 76 76 ALA CA C 76 55.392 55.037 0.355 1
1 881 . 17 1 1 A 76 76 ALA CB C 76 18.182 18.635 -0.453 1
1 882 . 17 1 1 A 76 76 ALA N N 76 117.795 120.836 -3.041 1
1 883 . 17 1 1 A 77 77 GLN H H 77 7.099 7.873 -0.774 1
1 884 . 17 1 1 A 77 77 GLN HA H 77 4.198 4.260 -0.062 1
1 891 . 17 1 1 A 77 77 GLN C C 77 177.860 178.348 -0.488 1
1 892 . 17 1 1 A 77 77 GLN CA C 77 57.790 57.661 0.129 1
1 893 . 17 1 1 A 77 77 GLN CB C 77 28.536 29.444 -0.908 1
1 895 . 17 1 1 A 77 77 GLN N N 77 115.764 115.637 0.127 1
1 897 . 17 1 1 A 78 78 VAL H H 78 7.430 8.098 -0.668 1
1 898 . 17 1 1 A 78 78 VAL HA H 78 3.241 3.630 -0.389 1
1 906 . 17 1 1 A 78 78 VAL C C 78 177.042 178.074 -1.032 1
1 907 . 17 1 1 A 78 78 VAL CA C 78 67.299 65.731 1.568 1
1 908 . 17 1 1 A 78 78 VAL CB C 78 30.819 31.486 -0.667 1
1 911 . 17 1 1 A 78 78 VAL N N 78 121.143 120.739 0.404 1
1 912 . 17 1 1 A 79 79 VAL H H 79 7.773 7.834 -0.061 1
1 913 . 17 1 1 A 79 79 VAL HA H 79 3.315 3.776 -0.461 1
1 921 . 17 1 1 A 79 79 VAL C C 79 179.179 177.388 1.791 1
1 922 . 17 1 1 A 79 79 VAL CA C 79 66.694 64.801 1.893 1
1 923 . 17 1 1 A 79 79 VAL CB C 79 31.841 31.460 0.381 1
1 926 . 17 1 1 A 79 79 VAL N N 79 117.473 119.322 -1.849 1
1 927 . 17 1 1 A 80 80 GLU H H 80 7.410 7.754 -0.344 1
1 928 . 17 1 1 A 80 80 GLU HA H 80 4.258 4.089 0.169 1
1 933 . 17 1 1 A 80 80 GLU C C 80 178.018 178.521 -0.503 1
1 934 . 17 1 1 A 80 80 GLU CA C 80 58.566 58.688 -0.122 1
1 935 . 17 1 1 A 80 80 GLU CB C 80 29.072 29.253 -0.181 1
1 937 . 17 1 1 A 80 80 GLU N N 80 120.451 121.398 -0.947 1
1 938 . 17 1 1 A 81 81 LEU H H 81 8.070 7.400 0.670 1
1 939 . 17 1 1 A 81 81 LEU HA H 81 3.976 4.228 -0.252 1
1 949 . 17 1 1 A 81 81 LEU C C 81 180.658 179.029 1.629 1
1 950 . 17 1 1 A 81 81 LEU CA C 81 58.061 57.190 0.871 1
1 951 . 17 1 1 A 81 81 LEU CB C 81 42.115 42.153 -0.038 1
1 955 . 17 1 1 A 81 81 LEU N N 81 119.943 119.161 0.782 1
1 956 . 17 1 1 A 82 82 VAL H H 82 7.609 7.713 -0.104 1
1 957 . 17 1 1 A 82 82 VAL HA H 82 3.474 3.617 -0.143 1
1 965 . 17 1 1 A 82 82 VAL C C 82 178.927 178.084 0.843 1
1 966 . 17 1 1 A 82 82 VAL CA C 82 67.398 67.239 0.159 1
1 967 . 17 1 1 A 82 82 VAL CB C 82 31.306 31.334 -0.028 1
1 970 . 17 1 1 A 82 82 VAL N N 82 118.150 118.965 -0.815 1
1 971 . 17 1 1 A 83 83 ARG H H 83 8.186 8.178 0.008 1
1 972 . 17 1 1 A 83 83 ARG HA H 83 3.994 4.102 -0.108 1
1 979 . 17 1 1 A 83 83 ARG C C 83 179.999 178.046 1.953 1
1 980 . 17 1 1 A 83 83 ARG CA C 83 60.205 58.839 1.366 1
1 981 . 17 1 1 A 83 83 ARG CB C 83 30.103 29.870 0.233 1
1 984 . 17 1 1 A 83 83 ARG N N 83 122.902 120.403 2.499 1
1 985 . 17 1 1 A 84 84 LYS H H 84 8.772 8.093 0.679 1
1 986 . 17 1 1 A 84 84 LYS HA H 84 4.047 4.119 -0.072 1
1 995 . 17 1 1 A 84 84 LYS C C 84 176.934 178.728 -1.794 1
1 996 . 17 1 1 A 84 84 LYS CA C 84 58.142 58.801 -0.659 1
1 997 . 17 1 1 A 84 84 LYS CB C 84 32.492 31.896 0.596 1
1 1001 . 17 1 1 A 84 84 LYS N N 84 117.548 119.041 -1.493 1
1 1002 . 17 1 1 A 85 85 SER H H 85 7.333 8.022 -0.689 1
1 1003 . 17 1 1 A 85 85 SER HA H 85 4.235 4.231 0.004 1
1 1006 . 17 1 1 A 85 85 SER C C 85 175.588 175.067 0.521 1
1 1007 . 17 1 1 A 85 85 SER CA C 85 59.535 60.695 -1.160 1
1 1008 . 17 1 1 A 85 85 SER CB C 85 63.571 63.540 0.031 1
1 1009 . 17 1 1 A 85 85 SER N N 85 113.544 112.602 0.942 1
1 1010 . 17 1 1 A 86 86 GLY H H 86 7.459 7.965 -0.506 1
1 1011 . 17 1 1 A 86 86 GLY HA2 H 86 4.176 4.069 0.107 1
1 1012 . 17 1 1 A 86 86 GLY HA3 H 86 3.762 4.078 -0.316 1
1 1013 . 17 1 1 A 86 86 GLY C C 86 176.407 174.688 1.719 1
1 1014 . 17 1 1 A 86 86 GLY CA C 86 46.109 45.750 0.359 1
1 1015 . 17 1 1 A 86 86 GLY N N 86 104.331 109.536 -5.205 1
1 1016 . 17 1 1 A 87 87 ASN HA H 87 4.650 4.881 -0.231 1
1 1021 . 17 1 1 A 87 87 ASN C C 87 173.653 174.851 -1.198 1
1 1022 . 17 1 1 A 87 87 ASN CA C 87 54.492 53.819 0.673 1
1 1023 . 17 1 1 A 87 87 ASN CB C 87 38.425 41.427 -3.002 1
1 1024 . 17 1 1 A 87 87 ASN N N 87 118.401 124.451 -6.050 1
1 1026 . 17 1 1 A 88 88 SER H H 88 7.435 8.081 -0.646 1
1 1027 . 17 1 1 A 88 88 SER HA H 88 5.438 5.540 -0.102 1
1 1030 . 17 1 1 A 88 88 SER C C 88 172.867 172.769 0.098 1
1 1031 . 17 1 1 A 88 88 SER CA C 88 58.160 57.285 0.875 1
1 1032 . 17 1 1 A 88 88 SER CB C 88 65.861 66.517 -0.656 1
1 1033 . 17 1 1 A 88 88 SER N N 88 113.765 114.576 -0.811 1
1 1034 . 17 1 1 A 89 89 VAL H H 89 8.452 8.379 0.073 1
1 1035 . 17 1 1 A 89 89 VAL HA H 89 4.519 4.690 -0.171 1
1 1043 . 17 1 1 A 89 89 VAL C C 89 171.391 174.561 -3.170 1
1 1044 . 17 1 1 A 89 89 VAL CA C 89 61.333 61.223 0.110 1
1 1045 . 17 1 1 A 89 89 VAL CB C 89 33.897 35.239 -1.342 1
1 1048 . 17 1 1 A 89 89 VAL N N 89 120.001 122.953 -2.952 1
1 1049 . 17 1 1 A 90 90 THR H H 90 8.348 8.888 -0.540 1
1 1050 . 17 1 1 A 90 90 THR HA H 90 5.042 5.055 -0.013 1
1 1055 . 17 1 1 A 90 90 THR C C 90 173.926 173.859 0.067 1
1 1056 . 17 1 1 A 90 90 THR CA C 90 61.403 62.277 -0.874 1
1 1057 . 17 1 1 A 90 90 THR CB C 90 69.553 69.219 0.334 1
1 1059 . 17 1 1 A 90 90 THR N N 90 123.477 122.811 0.666 1
1 1060 . 17 1 1 A 91 91 LEU H H 91 9.195 9.061 0.134 1
1 1061 . 17 1 1 A 91 91 LEU HA H 91 5.161 5.030 0.131 1
1 1071 . 17 1 1 A 91 91 LEU C C 91 174.564 176.466 -1.902 1
1 1072 . 17 1 1 A 91 91 LEU CA C 91 52.590 53.375 -0.785 1
1 1073 . 17 1 1 A 91 91 LEU CB C 91 44.998 45.089 -0.091 1
1 1077 . 17 1 1 A 91 91 LEU N N 91 128.419 127.655 0.764 1
1 1078 . 17 1 1 A 92 92 LEU H H 92 8.644 8.727 -0.083 1
1 1079 . 17 1 1 A 92 92 LEU HA H 92 5.335 5.282 0.053 1
1 1089 . 17 1 1 A 92 92 LEU C C 92 176.451 175.426 1.025 1
1 1090 . 17 1 1 A 92 92 LEU CA C 92 54.220 53.983 0.237 1
1 1091 . 17 1 1 A 92 92 LEU CB C 92 44.323 43.889 0.434 1
1 1095 . 17 1 1 A 92 92 LEU N N 92 125.894 121.769 4.125 1
1 1096 . 17 1 1 A 93 93 VAL H H 93 9.249 9.211 0.038 1
1 1097 . 17 1 1 A 93 93 VAL HA H 93 5.573 5.424 0.149 1
1 1105 . 17 1 1 A 93 93 VAL C C 93 173.550 174.140 -0.590 1
1 1106 . 17 1 1 A 93 93 VAL CA C 93 58.340 59.687 -1.347 1
1 1107 . 17 1 1 A 93 93 VAL CB C 93 36.159 34.127 2.032 1
1 1110 . 17 1 1 A 93 93 VAL N N 93 120.660 120.111 0.549 1
1 1111 . 17 1 1 A 94 94 LEU H H 94 8.634 8.431 0.203 1
1 1112 . 17 1 1 A 94 94 LEU HA H 94 4.911 5.158 -0.247 1
1 1122 . 17 1 1 A 94 94 LEU C C 94 174.172 175.390 -1.218 1
1 1123 . 17 1 1 A 94 94 LEU CA C 94 52.659 53.213 -0.554 1
1 1124 . 17 1 1 A 94 94 LEU CB C 94 47.910 46.052 1.858 1
1 1128 . 17 1 1 A 94 94 LEU N N 94 120.304 126.842 -6.538 1
1 1129 . 17 1 1 A 95 95 ASP H H 95 8.210 8.812 -0.602 1
1 1130 . 17 1 1 A 95 95 ASP HA H 95 5.190 4.609 0.581 1
1 1133 . 17 1 1 A 95 95 ASP C C 95 175.887 177.713 -1.826 1
1 1134 . 17 1 1 A 95 95 ASP CA C 95 53.899 55.106 -1.207 1
1 1135 . 17 1 1 A 95 95 ASP CB C 95 41.188 41.215 -0.027 1
1 1136 . 17 1 1 A 95 95 ASP N N 95 122.184 123.855 -1.671 1
1 1137 . 17 1 1 A 96 96 GLY H H 96 8.478 8.881 -0.403 1
1 1138 . 17 1 1 A 96 96 GLY HA2 H 96 4.002 3.838 0.164 1
1 1139 . 17 1 1 A 96 96 GLY HA3 H 96 3.757 3.840 -0.083 1
1 1140 . 17 1 1 A 96 96 GLY C C 96 175.497 175.808 -0.311 1
1 1141 . 17 1 1 A 96 96 GLY CA C 96 49.944 47.456 2.488 1
1 1142 . 17 1 1 A 96 96 GLY N N 96 108.610 111.006 -2.396 1
1 1143 . 17 1 1 A 97 97 ASP H H 97 8.401 8.464 -0.063 1
1 1144 . 17 1 1 A 97 97 ASP HA H 97 4.454 4.406 0.048 1
1 1147 . 17 1 1 A 97 97 ASP C C 97 179.612 178.700 0.912 1
1 1148 . 17 1 1 A 97 97 ASP CA C 97 57.913 56.907 1.006 1
1 1149 . 17 1 1 A 97 97 ASP CB C 97 41.145 40.349 0.796 1
1 1150 . 17 1 1 A 97 97 ASP N N 97 120.034 122.630 -2.596 1
1 1151 . 17 1 1 A 98 98 SER H H 98 8.152 8.219 -0.067 1
1 1152 . 17 1 1 A 98 98 SER HA H 98 4.218 4.323 -0.105 1
1 1155 . 17 1 1 A 98 98 SER C C 98 175.061 175.467 -0.406 1
1 1156 . 17 1 1 A 98 98 SER CA C 98 62.180 62.535 -0.355 1
1 1157 . 17 1 1 A 98 98 SER CB C 98 62.179 63.392 -1.213 1
1 1158 . 17 1 1 A 98 98 SER N N 98 117.174 115.994 1.180 1
1 1159 . 17 1 1 A 99 99 TYR H H 99 9.051 8.279 0.772 1
1 1160 . 17 1 1 A 99 99 TYR HA H 99 3.692 3.888 -0.196 1
1 1167 . 17 1 1 A 99 99 TYR C C 99 176.460 177.274 -0.814 1
1 1168 . 17 1 1 A 99 99 TYR CA C 99 62.814 61.167 1.647 1
1 1169 . 17 1 1 A 99 99 TYR CB C 99 38.829 38.535 0.294 1
1 1174 . 17 1 1 A 99 99 TYR N N 99 123.539 122.483 1.056 1
1 1175 . 17 1 1 A 100 100 GLU H H 100 8.520 8.845 -0.325 1
1 1176 . 17 1 1 A 100 100 GLU HA H 100 3.952 3.983 -0.031 1
1 1181 . 17 1 1 A 100 100 GLU C C 100 180.151 179.293 0.858 1
1 1182 . 17 1 1 A 100 100 GLU CA C 100 60.099 60.099 0.000 1
1 1183 . 17 1 1 A 100 100 GLU CB C 100 29.435 29.287 0.148 1
1 1185 . 17 1 1 A 100 100 GLU N N 100 117.082 118.450 -1.368 1
1 1186 . 17 1 1 A 101 101 LYS H H 101 7.740 8.150 -0.410 1
1 1187 . 17 1 1 A 101 101 LYS HA H 101 3.984 4.122 -0.138 1
1 1196 . 17 1 1 A 101 101 LYS C C 101 178.377 178.459 -0.082 1
1 1197 . 17 1 1 A 101 101 LYS CA C 101 59.888 59.484 0.404 1
1 1198 . 17 1 1 A 101 101 LYS CB C 101 32.821 32.280 0.541 1
1 1202 . 17 1 1 A 101 101 LYS N N 101 119.851 121.190 -1.339 1
1 1203 . 17 1 1 A 102 102 ALA H H 102 8.538 8.024 0.514 1
1 1204 . 17 1 1 A 102 102 ALA HA H 102 3.632 4.158 -0.526 1
1 1208 . 17 1 1 A 102 102 ALA C C 102 179.870 179.582 0.288 1
1 1209 . 17 1 1 A 102 102 ALA CA C 102 55.285 55.136 0.149 1
1 1210 . 17 1 1 A 102 102 ALA CB C 102 17.163 18.385 -1.222 1
1 1211 . 17 1 1 A 102 102 ALA N N 102 124.176 120.801 3.375 1
1 1212 . 17 1 1 A 103 103 VAL H H 103 8.147 8.074 0.073 1
1 1213 . 17 1 1 A 103 103 VAL HA H 103 3.658 3.793 -0.135 1
1 1221 . 17 1 1 A 103 103 VAL C C 103 181.113 177.230 3.883 1
1 1222 . 17 1 1 A 103 103 VAL CA C 103 66.090 64.890 1.200 1
1 1223 . 17 1 1 A 103 103 VAL CB C 103 31.822 31.366 0.456 1
1 1226 . 17 1 1 A 103 103 VAL N N 103 117.841 117.067 0.774 1
1 1227 . 17 1 1 A 104 104 LYS H H 104 7.903 7.917 -0.014 1
1 1228 . 17 1 1 A 104 104 LYS HA H 104 4.065 4.124 -0.059 1
1 1235 . 17 1 1 A 104 104 LYS C C 104 177.715 178.142 -0.427 1
1 1236 . 17 1 1 A 104 104 LYS CA C 104 59.094 59.212 -0.118 1
1 1237 . 17 1 1 A 104 104 LYS CB C 104 32.285 32.798 -0.513 1
1 1241 . 17 1 1 A 104 104 LYS N N 104 121.515 121.248 0.267 1
1 1242 . 17 1 1 A 105 105 ASN H H 105 7.747 8.019 -0.272 1
1 1243 . 17 1 1 A 105 105 ASN HA H 105 4.721 4.855 -0.134 1
1 1248 . 17 1 1 A 105 105 ASN C C 105 173.320 173.946 -0.626 1
1 1249 . 17 1 1 A 105 105 ASN CA C 105 53.399 53.097 0.302 1
1 1250 . 17 1 1 A 105 105 ASN CB C 105 39.249 38.507 0.742 1
1 1251 . 17 1 1 A 105 105 ASN N N 105 114.941 114.930 0.011 1
1 1253 . 17 1 1 A 106 106 GLN H H 106 7.850 7.946 -0.096 1
1 1254 . 17 1 1 A 106 106 GLN HA H 106 3.902 3.866 0.036 1
1 1261 . 17 1 1 A 106 106 GLN C C 106 175.168 175.100 0.068 1
1 1262 . 17 1 1 A 106 106 GLN CA C 106 56.978 56.821 0.157 1
1 1263 . 17 1 1 A 106 106 GLN CB C 106 25.770 26.464 -0.694 1
1 1265 . 17 1 1 A 106 106 GLN N N 106 114.989 115.679 -0.690 1
1 1267 . 17 1 1 A 107 107 VAL H H 107 8.005 7.731 0.274 1
1 1268 . 17 1 1 A 107 107 VAL HA H 107 3.664 4.010 -0.346 1
1 1276 . 17 1 1 A 107 107 VAL C C 107 175.468 175.055 0.413 1
1 1277 . 17 1 1 A 107 107 VAL CA C 107 62.726 62.859 -0.133 1
1 1278 . 17 1 1 A 107 107 VAL CB C 107 32.535 32.090 0.445 1
1 1281 . 17 1 1 A 107 107 VAL N N 107 120.216 120.163 0.053 1
1 1282 . 17 1 1 A 108 108 ASP H H 108 8.484 8.727 -0.243 1
1 1283 . 17 1 1 A 108 108 ASP HA H 108 4.467 4.653 -0.186 1
1 1286 . 17 1 1 A 108 108 ASP C C 108 177.179 176.088 1.091 1
1 1287 . 17 1 1 A 108 108 ASP CA C 108 53.417 54.937 -1.520 1
1 1288 . 17 1 1 A 108 108 ASP CB C 108 40.030 41.084 -1.054 1
1 1289 . 17 1 1 A 108 108 ASP N N 108 125.414 126.104 -0.690 1
1 1290 . 17 1 1 A 109 109 LEU H H 109 8.470 8.372 0.098 1
1 1291 . 17 1 1 A 109 109 LEU HA H 109 3.846 4.411 -0.565 1
1 1301 . 17 1 1 A 109 109 LEU C C 109 178.145 178.458 -0.313 1
1 1302 . 17 1 1 A 109 109 LEU CA C 109 56.573 55.958 0.615 1
1 1303 . 17 1 1 A 109 109 LEU CB C 109 42.011 42.477 -0.466 1
1 1307 . 17 1 1 A 109 109 LEU N N 109 127.577 124.926 2.651 1
1 1308 . 17 1 1 A 110 110 LYS H H 110 8.062 8.077 -0.015 1
1 1309 . 17 1 1 A 110 110 LYS HA H 110 3.022 3.856 -0.834 1
1 1317 . 17 1 1 A 110 110 LYS C C 110 177.248 179.145 -1.897 1
1 1318 . 17 1 1 A 110 110 LYS CA C 110 58.742 59.574 -0.832 1
1 1319 . 17 1 1 A 110 110 LYS CB C 110 31.667 31.957 -0.290 1
1 1323 . 17 1 1 A 110 110 LYS N N 110 118.873 119.550 -0.677 1
1 1324 . 17 1 1 A 111 111 GLU H H 111 7.113 8.350 -1.237 1
1 1325 . 17 1 1 A 111 111 GLU HA H 111 4.117 4.152 -0.035 1
1 1330 . 17 1 1 A 111 111 GLU C C 111 176.519 177.030 -0.511 1
1 1331 . 17 1 1 A 111 111 GLU CA C 111 55.621 58.994 -3.373 1
1 1332 . 17 1 1 A 111 111 GLU CB C 111 29.943 28.762 1.181 1
1 1334 . 17 1 1 A 111 111 GLU N N 111 114.282 117.191 -2.909 1
1 1335 . 17 1 1 A 112 112 LEU H H 112 6.848 7.766 -0.918 1
1 1336 . 17 1 1 A 112 112 LEU HA H 112 4.293 4.166 0.127 1
1 1346 . 17 1 1 A 112 112 LEU C C 112 175.674 176.215 -0.541 1
1 1347 . 17 1 1 A 112 112 LEU CA C 112 55.197 56.075 -0.878 1
1 1348 . 17 1 1 A 112 112 LEU CB C 112 41.681 41.730 -0.049 1
1 1352 . 17 1 1 A 112 112 LEU N N 112 118.934 123.432 -4.498 1
1 1353 . 17 1 1 A 113 113 ASP H H 113 8.466 8.267 0.199 1
1 1354 . 17 1 1 A 113 113 ASP HA H 113 4.593 5.458 -0.865 1
1 1357 . 17 1 1 A 113 113 ASP C C 113 174.511 175.073 -0.562 1
1 1358 . 17 1 1 A 113 113 ASP CA C 113 53.558 52.587 0.971 1
1 1359 . 17 1 1 A 113 113 ASP CB C 113 42.448 42.187 0.261 1
1 1360 . 17 1 1 A 113 113 ASP N N 113 122.148 124.440 -2.292 1
1 1 . 18 1 1 A 6 6 SER HA H 6 4.483 5.374 -0.891 1
1 4 . 18 1 1 A 6 6 SER C C 6 175.167 173.300 1.867 1
1 5 . 18 1 1 A 6 6 SER CA C 6 58.759 56.748 2.011 1
1 6 . 18 1 1 A 6 6 SER CB C 6 64.069 65.279 -1.210 1
1 7 . 18 1 1 A 7 7 GLY H H 7 8.431 9.103 -0.672 1
1 8 . 18 1 1 A 7 7 GLY HA2 H 7 3.973 4.141 -0.168 1
1 9 . 18 1 1 A 7 7 GLY HA3 H 7 3.973 4.142 -0.169 1
1 10 . 18 1 1 A 7 7 GLY C C 7 174.570 172.372 2.198 1
1 11 . 18 1 1 A 7 7 GLY CA C 7 45.483 45.079 0.404 1
1 12 . 18 1 1 A 7 7 GLY N N 7 110.640 111.508 -0.868 1
1 13 . 18 1 1 A 8 8 MET H H 8 8.239 8.947 -0.708 1
1 14 . 18 1 1 A 8 8 MET HA H 8 4.386 5.161 -0.775 1
1 22 . 18 1 1 A 8 8 MET C C 8 176.621 175.572 1.049 1
1 23 . 18 1 1 A 8 8 MET CA C 8 55.991 54.362 1.629 1
1 24 . 18 1 1 A 8 8 MET CB C 8 32.986 36.905 -3.919 1
1 27 . 18 1 1 A 8 8 MET N N 8 120.219 125.872 -5.653 1
1 28 . 18 1 1 A 9 9 ALA H H 9 8.435 8.793 -0.358 1
1 29 . 18 1 1 A 9 9 ALA HA H 9 4.182 4.353 -0.171 1
1 33 . 18 1 1 A 9 9 ALA C C 9 177.951 177.489 0.462 1
1 34 . 18 1 1 A 9 9 ALA CA C 9 53.399 54.174 -0.775 1
1 35 . 18 1 1 A 9 9 ALA CB C 9 18.955 19.034 -0.079 1
1 36 . 18 1 1 A 9 9 ALA N N 9 124.459 124.811 -0.352 1
1 37 . 18 1 1 A 10 10 SER H H 10 8.100 7.773 0.327 1
1 38 . 18 1 1 A 10 10 SER HA H 10 4.391 4.669 -0.278 1
1 41 . 18 1 1 A 10 10 SER C C 10 174.467 172.777 1.690 1
1 42 . 18 1 1 A 10 10 SER CA C 10 58.709 57.514 1.195 1
1 43 . 18 1 1 A 10 10 SER CB C 10 63.778 65.488 -1.710 1
1 44 . 18 1 1 A 10 10 SER N N 10 113.881 108.712 5.169 1
1 45 . 18 1 1 A 11 11 THR H H 11 7.821 8.377 -0.556 1
1 46 . 18 1 1 A 11 11 THR HA H 11 4.191 4.721 -0.530 1
1 51 . 18 1 1 A 11 11 THR C C 11 173.610 172.387 1.223 1
1 52 . 18 1 1 A 11 11 THR CA C 11 61.936 60.508 1.428 1
1 53 . 18 1 1 A 11 11 THR CB C 11 69.713 71.055 -1.342 1
1 55 . 18 1 1 A 11 11 THR N N 11 114.471 115.403 -0.932 1
1 56 . 18 1 1 A 12 12 PHE H H 12 7.946 9.031 -1.085 1
1 57 . 18 1 1 A 12 12 PHE HA H 12 4.769 4.887 -0.118 1
1 65 . 18 1 1 A 12 12 PHE C C 12 174.211 174.776 -0.565 1
1 66 . 18 1 1 A 12 12 PHE CA C 12 56.644 57.784 -1.140 1
1 67 . 18 1 1 A 12 12 PHE CB C 12 40.609 41.226 -0.617 1
1 73 . 18 1 1 A 12 12 PHE N N 12 120.763 125.113 -4.350 1
1 74 . 18 1 1 A 13 13 ASN H H 13 9.004 8.990 0.014 1
1 75 . 18 1 1 A 13 13 ASN HA H 13 5.366 5.435 -0.069 1
1 80 . 18 1 1 A 13 13 ASN C C 13 172.158 173.746 -1.588 1
1 81 . 18 1 1 A 13 13 ASN CA C 13 50.988 49.499 1.489 1
1 82 . 18 1 1 A 13 13 ASN CB C 13 39.942 39.934 0.008 1
1 83 . 18 1 1 A 13 13 ASN N N 13 119.973 120.361 -0.388 1
1 85 . 18 1 1 A 14 14 PRO HA H 14 4.945 4.650 0.295 1
1 92 . 18 1 1 A 14 14 PRO C C 14 174.901 175.328 -0.427 1
1 93 . 18 1 1 A 14 14 PRO CA C 14 63.096 62.639 0.457 1
1 94 . 18 1 1 A 14 14 PRO CB C 14 32.739 32.791 -0.052 1
1 97 . 18 1 1 A 15 15 ARG H H 15 8.908 8.578 0.330 1
1 98 . 18 1 1 A 15 15 ARG HA H 15 4.626 4.903 -0.277 1
1 106 . 18 1 1 A 15 15 ARG C C 15 174.432 174.535 -0.103 1
1 107 . 18 1 1 A 15 15 ARG CA C 15 54.827 54.663 0.164 1
1 108 . 18 1 1 A 15 15 ARG CB C 15 32.439 33.561 -1.122 1
1 111 . 18 1 1 A 15 15 ARG N N 15 118.947 120.945 -1.998 1
1 113 . 18 1 1 A 16 16 GLU H H 16 8.838 8.887 -0.049 1
1 114 . 18 1 1 A 16 16 GLU HA H 16 4.876 5.047 -0.171 1
1 119 . 18 1 1 A 16 16 GLU C C 16 175.767 175.082 0.685 1
1 120 . 18 1 1 A 16 16 GLU CA C 16 55.621 55.956 -0.335 1
1 121 . 18 1 1 A 16 16 GLU CB C 16 31.093 31.489 -0.396 1
1 123 . 18 1 1 A 16 16 GLU N N 16 125.316 123.672 1.644 1
1 124 . 18 1 1 A 17 17 CYS H H 17 9.327 8.888 0.439 1
1 125 . 18 1 1 A 17 17 CYS HA H 17 4.804 5.005 -0.201 1
1 128 . 18 1 1 A 17 17 CYS C C 17 172.973 173.467 -0.494 1
1 129 . 18 1 1 A 17 17 CYS CA C 17 57.930 57.514 0.416 1
1 130 . 18 1 1 A 17 17 CYS CB C 17 30.105 31.596 -1.491 1
1 131 . 18 1 1 A 17 17 CYS N N 17 127.909 123.454 4.455 1
1 132 . 18 1 1 A 18 18 LYS H H 18 9.022 8.703 0.319 1
1 133 . 18 1 1 A 18 18 LYS HA H 18 4.769 4.947 -0.178 1
1 142 . 18 1 1 A 18 18 LYS C C 18 174.586 175.462 -0.876 1
1 143 . 18 1 1 A 18 18 LYS CA C 18 55.956 55.062 0.894 1
1 144 . 18 1 1 A 18 18 LYS CB C 18 32.203 33.256 -1.053 1
1 148 . 18 1 1 A 18 18 LYS N N 18 127.039 124.564 2.475 1
1 149 . 18 1 1 A 19 19 LEU H H 19 8.784 8.762 0.022 1
1 150 . 18 1 1 A 19 19 LEU HA H 19 4.852 4.440 0.412 1
1 160 . 18 1 1 A 19 19 LEU C C 19 176.862 176.081 0.781 1
1 161 . 18 1 1 A 19 19 LEU CA C 19 55.391 54.869 0.522 1
1 162 . 18 1 1 A 19 19 LEU CB C 19 44.442 42.006 2.436 1
1 166 . 18 1 1 A 19 19 LEU N N 19 126.311 126.543 -0.232 1
1 167 . 18 1 1 A 20 20 SER H H 20 8.215 9.061 -0.846 1
1 168 . 18 1 1 A 20 20 SER HA H 20 5.461 5.661 -0.200 1
1 171 . 18 1 1 A 20 20 SER C C 20 171.960 172.874 -0.914 1
1 172 . 18 1 1 A 20 20 SER CA C 20 57.525 56.973 0.552 1
1 173 . 18 1 1 A 20 20 SER CB C 20 65.794 65.172 0.622 1
1 174 . 18 1 1 A 20 20 SER N N 20 115.113 120.187 -5.074 1
1 175 . 18 1 1 A 21 21 LYS H H 21 9.001 8.554 0.447 1
1 176 . 18 1 1 A 21 21 LYS HA H 21 4.887 5.004 -0.117 1
1 185 . 18 1 1 A 21 21 LYS C C 21 174.133 175.074 -0.941 1
1 186 . 18 1 1 A 21 21 LYS CA C 21 53.840 54.397 -0.557 1
1 187 . 18 1 1 A 21 21 LYS CB C 21 36.553 35.776 0.777 1
1 191 . 18 1 1 A 21 21 LYS N N 21 120.938 123.291 -2.353 1
1 192 . 18 1 1 A 22 22 GLN H H 22 8.201 8.299 -0.098 1
1 193 . 18 1 1 A 22 22 GLN HA H 22 4.448 4.568 -0.120 1
1 200 . 18 1 1 A 22 22 GLN C C 22 176.372 175.555 0.817 1
1 201 . 18 1 1 A 22 22 GLN CA C 22 53.658 54.579 -0.921 1
1 202 . 18 1 1 A 22 22 GLN CB C 22 30.473 30.047 0.426 1
1 204 . 18 1 1 A 22 22 GLN N N 22 116.816 119.309 -2.493 1
1 206 . 18 1 1 A 23 23 GLU H H 23 8.624 8.641 -0.017 1
1 207 . 18 1 1 A 23 23 GLU HA H 23 4.056 4.097 -0.041 1
1 212 . 18 1 1 A 23 23 GLU C C 23 177.778 176.879 0.899 1
1 213 . 18 1 1 A 23 23 GLU CA C 23 58.001 57.627 0.374 1
1 214 . 18 1 1 A 23 23 GLU CB C 23 29.237 29.143 0.094 1
1 216 . 18 1 1 A 23 23 GLU N N 23 122.364 121.689 0.675 1
1 217 . 18 1 1 A 24 24 GLY H H 24 8.962 8.950 0.012 1
1 218 . 18 1 1 A 24 24 GLY HA2 H 24 4.139 3.975 0.164 1
1 219 . 18 1 1 A 24 24 GLY HA3 H 24 3.711 3.976 -0.265 1
1 220 . 18 1 1 A 24 24 GLY C C 24 173.857 174.173 -0.316 1
1 221 . 18 1 1 A 24 24 GLY CA C 24 45.288 45.067 0.221 1
1 222 . 18 1 1 A 24 24 GLY N N 24 113.942 112.884 1.058 1
1 223 . 18 1 1 A 25 25 GLN H H 25 7.643 7.702 -0.059 1
1 224 . 18 1 1 A 25 25 GLN HA H 25 4.488 4.311 0.177 1
1 231 . 18 1 1 A 25 25 GLN C C 25 174.727 175.306 -0.579 1
1 232 . 18 1 1 A 25 25 GLN CA C 25 54.052 55.430 -1.378 1
1 233 . 18 1 1 A 25 25 GLN CB C 25 30.843 30.250 0.593 1
1 235 . 18 1 1 A 25 25 GLN N N 25 119.538 121.469 -1.931 1
1 237 . 18 1 1 A 26 26 ASN H H 26 8.625 8.902 -0.277 1
1 238 . 18 1 1 A 26 26 ASN HA H 26 4.862 4.934 -0.072 1
1 243 . 18 1 1 A 26 26 ASN C C 26 176.261 175.262 0.999 1
1 244 . 18 1 1 A 26 26 ASN CA C 26 51.812 51.830 -0.018 1
1 245 . 18 1 1 A 26 26 ASN CB C 26 40.403 40.828 -0.425 1
1 246 . 18 1 1 A 26 26 ASN N N 26 120.047 122.228 -2.181 1
1 248 . 18 1 1 A 27 27 TYR HA H 27 4.152 4.640 -0.488 1
1 255 . 18 1 1 A 27 27 TYR C C 27 176.731 175.959 0.772 1
1 256 . 18 1 1 A 27 27 TYR CA C 27 62.462 58.732 3.730 1
1 257 . 18 1 1 A 27 27 TYR CB C 27 40.240 39.043 1.197 1
1 262 . 18 1 1 A 27 27 TYR N N 27 121.761 121.053 0.708 1
1 263 . 18 1 1 A 28 28 GLY H H 28 8.285 7.966 0.319 1
1 264 . 18 1 1 A 28 28 GLY HA2 H 28 4.490 3.913 0.577 1
1 265 . 18 1 1 A 28 28 GLY HA3 H 28 3.759 4.000 -0.241 1
1 266 . 18 1 1 A 28 28 GLY C C 28 172.198 173.833 -1.635 1
1 267 . 18 1 1 A 28 28 GLY CA C 28 46.139 45.188 0.951 1
1 268 . 18 1 1 A 28 28 GLY N N 28 103.567 107.329 -3.762 1
1 269 . 18 1 1 A 29 29 PHE H H 29 6.878 7.770 -0.892 1
1 270 . 18 1 1 A 29 29 PHE HA H 29 5.179 5.016 0.163 1
1 278 . 18 1 1 A 29 29 PHE C C 29 172.840 173.685 -0.845 1
1 279 . 18 1 1 A 29 29 PHE CA C 29 55.262 54.972 0.290 1
1 280 . 18 1 1 A 29 29 PHE CB C 29 41.779 42.453 -0.674 1
1 286 . 18 1 1 A 29 29 PHE N N 29 111.027 117.325 -6.298 1
1 287 . 18 1 1 A 30 30 PHE H H 30 8.806 8.589 0.217 1
1 288 . 18 1 1 A 30 30 PHE HA H 30 4.923 4.727 0.196 1
1 296 . 18 1 1 A 30 30 PHE C C 30 174.501 175.335 -0.834 1
1 297 . 18 1 1 A 30 30 PHE CA C 30 55.356 56.028 -0.672 1
1 298 . 18 1 1 A 30 30 PHE CB C 30 41.681 43.515 -1.834 1
1 304 . 18 1 1 A 30 30 PHE N N 30 118.710 117.569 1.141 1
1 305 . 18 1 1 A 31 31 LEU H H 31 8.441 8.854 -0.413 1
1 306 . 18 1 1 A 31 31 LEU HA H 31 5.447 4.792 0.655 1
1 316 . 18 1 1 A 31 31 LEU C C 31 177.306 175.899 1.407 1
1 317 . 18 1 1 A 31 31 LEU CA C 31 53.610 54.201 -0.591 1
1 318 . 18 1 1 A 31 31 LEU CB C 31 43.696 41.464 2.232 1
1 322 . 18 1 1 A 31 31 LEU N N 31 123.765 124.093 -0.328 1
1 323 . 18 1 1 A 32 32 ARG H H 32 9.381 9.002 0.379 1
1 324 . 18 1 1 A 32 32 ARG HA H 32 4.840 4.859 -0.019 1
1 331 . 18 1 1 A 32 32 ARG C C 32 175.155 175.873 -0.718 1
1 332 . 18 1 1 A 32 32 ARG CA C 32 54.210 54.689 -0.479 1
1 333 . 18 1 1 A 32 32 ARG CB C 32 35.087 32.884 2.203 1
1 336 . 18 1 1 A 32 32 ARG N N 32 123.160 124.613 -1.453 1
1 337 . 18 1 1 A 33 33 ILE H H 33 7.891 8.912 -1.021 1
1 338 . 18 1 1 A 33 33 ILE HA H 33 4.495 4.886 -0.391 1
1 348 . 18 1 1 A 33 33 ILE C C 33 175.850 174.247 1.603 1
1 349 . 18 1 1 A 33 33 ILE CA C 33 59.641 59.628 0.013 1
1 350 . 18 1 1 A 33 33 ILE CB C 33 39.538 39.483 0.055 1
1 354 . 18 1 1 A 33 33 ILE N N 33 118.924 120.361 -1.437 1
1 355 . 18 1 1 A 34 34 GLU H H 34 8.971 8.850 0.121 1
1 356 . 18 1 1 A 34 34 GLU HA H 34 4.578 5.075 -0.497 1
1 361 . 18 1 1 A 34 34 GLU C C 34 175.766 175.138 0.628 1
1 362 . 18 1 1 A 34 34 GLU CA C 34 54.263 54.483 -0.220 1
1 363 . 18 1 1 A 34 34 GLU CB C 34 32.128 33.389 -1.261 1
1 365 . 18 1 1 A 34 34 GLU N N 34 125.447 122.989 2.458 1
1 366 . 18 1 1 A 35 35 LYS H H 35 8.504 8.560 -0.056 1
1 367 . 18 1 1 A 35 35 LYS HA H 35 4.026 4.078 -0.052 1
1 376 . 18 1 1 A 35 35 LYS C C 35 177.701 176.788 0.913 1
1 377 . 18 1 1 A 35 35 LYS CA C 35 57.591 57.205 0.386 1
1 378 . 18 1 1 A 35 35 LYS CB C 35 32.491 32.642 -0.151 1
1 382 . 18 1 1 A 35 35 LYS N N 35 122.893 126.810 -3.917 1
1 383 . 18 1 1 A 36 36 ASP H H 36 9.020 8.919 0.101 1
1 384 . 18 1 1 A 36 36 ASP HA H 36 4.385 4.181 0.204 1
1 387 . 18 1 1 A 36 36 ASP C C 36 174.554 174.642 -0.088 1
1 388 . 18 1 1 A 36 36 ASP CA C 36 55.868 55.233 0.635 1
1 389 . 18 1 1 A 36 36 ASP CB C 36 39.826 39.555 0.271 1
1 390 . 18 1 1 A 36 36 ASP N N 36 121.412 120.878 0.534 1
1 391 . 18 1 1 A 37 37 THR H H 37 7.464 7.498 -0.034 1
1 392 . 18 1 1 A 37 37 THR HA H 37 4.454 4.900 -0.446 1
1 397 . 18 1 1 A 37 37 THR C C 37 172.012 172.965 -0.953 1
1 398 . 18 1 1 A 37 37 THR CA C 37 61.686 60.806 0.880 1
1 399 . 18 1 1 A 37 37 THR CB C 37 70.927 72.385 -1.458 1
1 401 . 18 1 1 A 37 37 THR N N 37 113.147 112.253 0.894 1
1 402 . 18 1 1 A 38 38 ASP H H 38 8.931 8.840 0.091 1
1 403 . 18 1 1 A 38 38 ASP HA H 38 4.852 4.941 -0.089 1
1 406 . 18 1 1 A 38 38 ASP CA C 38 54.826 53.422 1.404 1
1 407 . 18 1 1 A 38 38 ASP CB C 38 43.332 42.787 0.545 1
1 408 . 18 1 1 A 38 38 ASP N N 38 120.401 123.006 -2.605 1
1 409 . 18 1 1 A 39 39 GLY H H 39 8.068 8.361 -0.293 1
1 410 . 18 1 1 A 39 39 GLY HA2 H 39 3.774 3.957 -0.183 1
1 411 . 18 1 1 A 39 39 GLY HA3 H 39 3.555 3.981 -0.426 1
1 412 . 18 1 1 A 39 39 GLY C C 39 172.578 172.526 0.052 1
1 413 . 18 1 1 A 39 39 GLY CA C 39 43.967 44.419 -0.452 1
1 414 . 18 1 1 A 39 39 GLY N N 39 107.925 108.993 -1.068 1
1 415 . 18 1 1 A 40 40 HIS H H 40 9.111 8.267 0.844 1
1 416 . 18 1 1 A 40 40 HIS HA H 40 4.650 5.066 -0.416 1
1 421 . 18 1 1 A 40 40 HIS C C 40 174.330 174.434 -0.104 1
1 422 . 18 1 1 A 40 40 HIS CA C 40 55.886 55.130 0.756 1
1 423 . 18 1 1 A 40 40 HIS CB C 40 30.507 31.747 -1.240 1
1 426 . 18 1 1 A 40 40 HIS N N 40 119.179 118.717 0.462 1
1 427 . 18 1 1 A 41 41 LEU H H 41 8.254 8.610 -0.356 1
1 428 . 18 1 1 A 41 41 LEU HA H 41 4.626 5.197 -0.571 1
1 438 . 18 1 1 A 41 41 LEU C C 41 176.035 176.226 -0.191 1
1 439 . 18 1 1 A 41 41 LEU CA C 41 55.621 53.496 2.125 1
1 440 . 18 1 1 A 41 41 LEU CB C 41 45.091 43.418 1.673 1
1 444 . 18 1 1 A 41 41 LEU N N 41 124.808 123.779 1.029 1
1 445 . 18 1 1 A 42 42 ILE H H 42 8.685 8.160 0.525 1
1 446 . 18 1 1 A 42 42 ILE HA H 42 4.578 4.784 -0.206 1
1 456 . 18 1 1 A 42 42 ILE C C 42 175.369 175.508 -0.139 1
1 457 . 18 1 1 A 42 42 ILE CA C 42 59.852 60.358 -0.506 1
1 458 . 18 1 1 A 42 42 ILE CB C 42 36.778 39.098 -2.320 1
1 462 . 18 1 1 A 42 42 ILE N N 42 121.814 124.566 -2.752 1
1 463 . 18 1 1 A 43 43 ARG H H 43 8.787 8.668 0.119 1
1 464 . 18 1 1 A 43 43 ARG HA H 43 4.852 4.642 0.210 1
1 472 . 18 1 1 A 43 43 ARG C C 43 174.029 174.860 -0.831 1
1 473 . 18 1 1 A 43 43 ARG CA C 43 52.730 55.390 -2.660 1
1 474 . 18 1 1 A 43 43 ARG CB C 43 36.983 33.603 3.380 1
1 477 . 18 1 1 A 43 43 ARG N N 43 125.771 125.944 -0.173 1
1 479 . 18 1 1 A 44 44 VAL H H 44 8.661 8.590 0.071 1
1 480 . 18 1 1 A 44 44 VAL HA H 44 3.276 3.687 -0.411 1
1 488 . 18 1 1 A 44 44 VAL C C 44 173.227 175.076 -1.849 1
1 489 . 18 1 1 A 44 44 VAL CA C 44 63.161 63.182 -0.021 1
1 490 . 18 1 1 A 44 44 VAL CB C 44 29.054 29.712 -0.658 1
1 493 . 18 1 1 A 44 44 VAL N N 44 117.026 120.366 -3.340 1
1 494 . 18 1 1 A 45 45 ILE H H 45 8.464 7.901 0.563 1
1 495 . 18 1 1 A 45 45 ILE HA H 45 4.579 4.181 0.398 1
1 505 . 18 1 1 A 45 45 ILE C C 45 178.108 175.082 3.026 1
1 506 . 18 1 1 A 45 45 ILE CA C 45 59.888 60.769 -0.881 1
1 507 . 18 1 1 A 45 45 ILE CB C 45 36.998 37.334 -0.336 1
1 511 . 18 1 1 A 45 45 ILE N N 45 122.767 122.638 0.129 1
1 512 . 18 1 1 A 46 46 GLU H H 46 9.015 8.322 0.693 1
1 513 . 18 1 1 A 46 46 GLU HA H 46 4.206 4.403 -0.197 1
1 518 . 18 1 1 A 46 46 GLU C C 46 177.746 176.154 1.592 1
1 519 . 18 1 1 A 46 46 GLU CA C 46 56.130 56.628 -0.498 1
1 520 . 18 1 1 A 46 46 GLU CB C 46 30.581 30.071 0.510 1
1 522 . 18 1 1 A 46 46 GLU N N 46 131.076 128.787 2.289 1
1 523 . 18 1 1 A 47 47 GLU H H 47 9.213 8.756 0.457 1
1 524 . 18 1 1 A 47 47 GLU HA H 47 4.194 4.001 0.193 1
1 529 . 18 1 1 A 47 47 GLU C C 47 178.088 177.535 0.553 1
1 530 . 18 1 1 A 47 47 GLU CA C 47 58.212 58.111 0.101 1
1 531 . 18 1 1 A 47 47 GLU CB C 47 29.390 29.381 0.009 1
1 533 . 18 1 1 A 47 47 GLU N N 47 129.592 125.055 4.537 1
1 534 . 18 1 1 A 48 48 GLY H H 48 9.586 8.892 0.694 1
1 535 . 18 1 1 A 48 48 GLY HA2 H 48 4.141 3.900 0.241 1
1 536 . 18 1 1 A 48 48 GLY HA3 H 48 3.757 3.901 -0.144 1
1 537 . 18 1 1 A 48 48 GLY C C 48 173.790 174.036 -0.246 1
1 538 . 18 1 1 A 48 48 GLY CA C 48 45.764 46.361 -0.597 1
1 539 . 18 1 1 A 48 48 GLY N N 48 114.819 115.133 -0.314 1
1 540 . 18 1 1 A 49 49 SER H H 49 7.580 7.931 -0.351 1
1 541 . 18 1 1 A 49 49 SER HA H 49 4.728 4.865 -0.137 1
1 544 . 18 1 1 A 49 49 SER C C 49 173.542 174.444 -0.902 1
1 545 . 18 1 1 A 49 49 SER CA C 49 57.560 55.682 1.878 1
1 546 . 18 1 1 A 49 49 SER CB C 49 64.529 64.058 0.471 1
1 547 . 18 1 1 A 49 49 SER N N 49 114.688 113.849 0.839 1
1 548 . 18 1 1 A 50 50 PRO HA H 50 4.431 4.564 -0.133 1
1 555 . 18 1 1 A 50 50 PRO C C 50 179.377 177.492 1.885 1
1 556 . 18 1 1 A 50 50 PRO CA C 50 66.059 64.243 1.816 1
1 557 . 18 1 1 A 50 50 PRO CB C 50 32.598 31.952 0.646 1
1 560 . 18 1 1 A 51 51 ALA H H 51 8.264 7.917 0.347 1
1 561 . 18 1 1 A 51 51 ALA HA H 51 3.817 3.977 -0.160 1
1 565 . 18 1 1 A 51 51 ALA C C 51 177.508 179.691 -2.183 1
1 566 . 18 1 1 A 51 51 ALA CA C 51 55.392 55.053 0.339 1
1 567 . 18 1 1 A 51 51 ALA CB C 51 20.474 18.504 1.970 1
1 568 . 18 1 1 A 51 51 ALA N N 51 117.604 120.612 -3.008 1
1 569 . 18 1 1 A 52 52 GLU H H 52 7.794 7.809 -0.015 1
1 570 . 18 1 1 A 52 52 GLU HA H 52 3.881 4.022 -0.141 1
1 575 . 18 1 1 A 52 52 GLU C C 52 181.401 178.384 3.017 1
1 576 . 18 1 1 A 52 52 GLU CA C 52 59.454 58.669 0.785 1
1 577 . 18 1 1 A 52 52 GLU CB C 52 30.247 29.323 0.924 1
1 579 . 18 1 1 A 52 52 GLU N N 52 119.474 118.868 0.606 1
1 580 . 18 1 1 A 53 53 LYS H H 53 8.557 7.726 0.831 1
1 581 . 18 1 1 A 53 53 LYS HA H 53 4.020 4.011 0.009 1
1 588 . 18 1 1 A 53 53 LYS C C 53 177.939 177.903 0.036 1
1 589 . 18 1 1 A 53 53 LYS CA C 53 59.012 58.910 0.102 1
1 590 . 18 1 1 A 53 53 LYS CB C 53 32.438 32.038 0.400 1
1 594 . 18 1 1 A 53 53 LYS N N 53 120.057 119.723 0.334 1
1 595 . 18 1 1 A 54 54 ALA H H 54 7.764 7.534 0.230 1
1 596 . 18 1 1 A 54 54 ALA HA H 54 4.400 4.309 0.091 1
1 600 . 18 1 1 A 54 54 ALA C C 54 177.658 177.884 -0.226 1
1 601 . 18 1 1 A 54 54 ALA CA C 54 52.412 51.670 0.742 1
1 602 . 18 1 1 A 54 54 ALA CB C 54 20.739 18.183 2.556 1
1 603 . 18 1 1 A 54 54 ALA N N 54 117.678 118.757 -1.079 1
1 604 . 18 1 1 A 55 55 GLY H H 55 7.583 8.114 -0.531 1
1 605 . 18 1 1 A 55 55 GLY HA2 H 55 4.266 3.916 0.350 1
1 606 . 18 1 1 A 55 55 GLY HA3 H 55 3.775 3.919 -0.144 1
1 607 . 18 1 1 A 55 55 GLY C C 55 175.232 174.532 0.700 1
1 608 . 18 1 1 A 55 55 GLY CA C 55 45.368 46.494 -1.126 1
1 609 . 18 1 1 A 55 55 GLY N N 55 103.265 107.649 -4.384 1
1 610 . 18 1 1 A 56 56 LEU H H 56 7.280 7.489 -0.209 1
1 611 . 18 1 1 A 56 56 LEU HA H 56 3.984 4.447 -0.463 1
1 621 . 18 1 1 A 56 56 LEU C C 56 174.708 175.175 -0.467 1
1 622 . 18 1 1 A 56 56 LEU CA C 56 55.603 54.595 1.008 1
1 623 . 18 1 1 A 56 56 LEU CB C 56 42.752 42.166 0.586 1
1 627 . 18 1 1 A 56 56 LEU N N 56 119.211 123.157 -3.946 1
1 628 . 18 1 1 A 57 57 LEU H H 57 8.693 9.033 -0.340 1
1 629 . 18 1 1 A 57 57 LEU HA H 57 4.499 4.908 -0.409 1
1 639 . 18 1 1 A 57 57 LEU C C 57 176.124 175.847 0.277 1
1 640 . 18 1 1 A 57 57 LEU CA C 57 52.959 53.271 -0.312 1
1 641 . 18 1 1 A 57 57 LEU CB C 57 45.122 44.756 0.366 1
1 645 . 18 1 1 A 57 57 LEU N N 57 121.969 129.523 -7.554 1
1 646 . 18 1 1 A 58 58 ASP H H 58 8.334 8.729 -0.395 1
1 647 . 18 1 1 A 58 58 ASP HA H 58 4.139 4.519 -0.380 1
1 650 . 18 1 1 A 58 58 ASP C C 58 178.636 176.717 1.919 1
1 651 . 18 1 1 A 58 58 ASP CA C 58 56.079 55.454 0.625 1
1 652 . 18 1 1 A 58 58 ASP CB C 58 42.135 40.305 1.830 1
1 653 . 18 1 1 A 58 58 ASP N N 58 120.401 121.926 -1.525 1
1 654 . 18 1 1 A 59 59 GLY H H 59 9.378 8.581 0.797 1
1 655 . 18 1 1 A 59 59 GLY HA2 H 59 4.317 3.925 0.392 1
1 656 . 18 1 1 A 59 59 GLY HA3 H 59 3.260 3.927 -0.667 1
1 657 . 18 1 1 A 59 59 GLY C C 59 173.359 174.316 -0.957 1
1 658 . 18 1 1 A 59 59 GLY CA C 59 45.517 45.082 0.435 1
1 659 . 18 1 1 A 59 59 GLY N N 59 116.622 112.082 4.540 1
1 660 . 18 1 1 A 60 60 ASP H H 60 8.009 7.884 0.125 1
1 661 . 18 1 1 A 60 60 ASP HA H 60 4.638 4.809 -0.171 1
1 664 . 18 1 1 A 60 60 ASP C C 60 175.555 174.939 0.616 1
1 665 . 18 1 1 A 60 60 ASP CA C 60 55.286 53.827 1.459 1
1 666 . 18 1 1 A 60 60 ASP CB C 60 42.381 42.196 0.185 1
1 667 . 18 1 1 A 60 60 ASP N N 60 121.370 120.639 0.731 1
1 668 . 18 1 1 A 61 61 ARG H H 61 8.648 8.524 0.124 1
1 669 . 18 1 1 A 61 61 ARG HA H 61 5.179 5.221 -0.042 1
1 677 . 18 1 1 A 61 61 ARG C C 61 177.381 174.386 2.995 1
1 678 . 18 1 1 A 61 61 ARG CA C 61 53.704 54.432 -0.728 1
1 679 . 18 1 1 A 61 61 ARG CB C 61 34.017 32.132 1.885 1
1 682 . 18 1 1 A 61 61 ARG N N 61 116.958 120.423 -3.465 1
1 684 . 18 1 1 A 62 62 VAL H H 62 8.247 8.419 -0.172 1
1 685 . 18 1 1 A 62 62 VAL HA H 62 3.806 4.592 -0.786 1
1 693 . 18 1 1 A 62 62 VAL C C 62 174.748 174.837 -0.089 1
1 694 . 18 1 1 A 62 62 VAL CA C 62 63.149 61.604 1.545 1
1 695 . 18 1 1 A 62 62 VAL CB C 62 32.574 32.018 0.556 1
1 698 . 18 1 1 A 62 62 VAL N N 62 118.546 125.670 -7.124 1
1 699 . 18 1 1 A 63 63 LEU H H 63 9.262 9.072 0.190 1
1 700 . 18 1 1 A 63 63 LEU HA H 63 4.412 4.154 0.258 1
1 710 . 18 1 1 A 63 63 LEU C C 63 177.649 177.162 0.487 1
1 711 . 18 1 1 A 63 63 LEU CA C 63 56.044 56.710 -0.666 1
1 712 . 18 1 1 A 63 63 LEU CB C 63 43.339 42.714 0.625 1
1 716 . 18 1 1 A 63 63 LEU N N 63 125.413 131.213 -5.800 1
1 717 . 18 1 1 A 64 64 ARG H H 64 7.806 7.731 0.075 1
1 718 . 18 1 1 A 64 64 ARG HA H 64 5.704 4.881 0.823 1
1 726 . 18 1 1 A 64 64 ARG C C 64 175.091 174.185 0.906 1
1 727 . 18 1 1 A 64 64 ARG CA C 64 54.148 54.632 -0.484 1
1 728 . 18 1 1 A 64 64 ARG CB C 64 35.742 33.447 2.295 1
1 731 . 18 1 1 A 64 64 ARG N N 64 112.961 117.085 -4.124 1
1 733 . 18 1 1 A 65 65 ILE H H 65 8.327 9.201 -0.874 1
1 734 . 18 1 1 A 65 65 ILE HA H 65 4.384 4.634 -0.250 1
1 744 . 18 1 1 A 65 65 ILE C C 65 175.722 175.493 0.229 1
1 745 . 18 1 1 A 65 65 ILE CA C 65 60.501 59.519 0.982 1
1 746 . 18 1 1 A 65 65 ILE CB C 65 39.547 40.268 -0.721 1
1 750 . 18 1 1 A 65 65 ILE N N 65 119.175 123.920 -4.745 1
1 751 . 18 1 1 A 66 66 ASN H H 66 9.911 9.579 0.332 1
1 752 . 18 1 1 A 66 66 ASN HA H 66 4.428 4.376 0.052 1
1 757 . 18 1 1 A 66 66 ASN C C 66 175.349 174.631 0.718 1
1 758 . 18 1 1 A 66 66 ASN CA C 66 54.157 54.159 -0.002 1
1 759 . 18 1 1 A 66 66 ASN CB C 66 37.024 37.447 -0.423 1
1 760 . 18 1 1 A 66 66 ASN N N 66 128.952 128.005 0.947 1
1 762 . 18 1 1 A 67 67 GLY H H 67 9.230 8.604 0.626 1
1 763 . 18 1 1 A 67 67 GLY HA2 H 67 4.322 3.934 0.388 1
1 764 . 18 1 1 A 67 67 GLY HA3 H 67 3.508 3.943 -0.435 1
1 765 . 18 1 1 A 67 67 GLY C C 67 174.393 173.987 0.406 1
1 766 . 18 1 1 A 67 67 GLY CA C 67 45.341 46.478 -1.137 1
1 767 . 18 1 1 A 67 67 GLY N N 67 103.238 104.780 -1.542 1
1 768 . 18 1 1 A 68 68 VAL H H 68 8.063 7.737 0.326 1
1 769 . 18 1 1 A 68 68 VAL HA H 68 4.015 4.564 -0.549 1
1 777 . 18 1 1 A 68 68 VAL C C 68 175.833 174.662 1.171 1
1 778 . 18 1 1 A 68 68 VAL CA C 68 62.603 61.544 1.059 1
1 779 . 18 1 1 A 68 68 VAL CB C 68 32.574 35.081 -2.507 1
1 782 . 18 1 1 A 68 68 VAL N N 68 125.696 119.587 6.109 1
1 783 . 18 1 1 A 69 69 PHE H H 69 9.301 9.155 0.146 1
1 784 . 18 1 1 A 69 69 PHE HA H 69 4.947 4.557 0.390 1
1 792 . 18 1 1 A 69 69 PHE C C 69 177.120 175.950 1.170 1
1 793 . 18 1 1 A 69 69 PHE CA C 69 59.200 58.848 0.352 1
1 794 . 18 1 1 A 69 69 PHE CB C 69 39.320 39.435 -0.115 1
1 800 . 18 1 1 A 69 69 PHE N N 69 128.641 128.970 -0.329 1
1 801 . 18 1 1 A 70 70 VAL H H 70 8.312 8.053 0.259 1
1 802 . 18 1 1 A 70 70 VAL HA H 70 4.517 4.546 -0.029 1
1 810 . 18 1 1 A 70 70 VAL CA C 70 60.734 60.517 0.217 1
1 811 . 18 1 1 A 70 70 VAL CB C 70 32.976 31.415 1.561 1
1 814 . 18 1 1 A 70 70 VAL N N 70 118.381 119.959 -1.578 1
1 815 . 18 1 1 A 71 71 ASP H H 71 5.373 7.552 -2.179 1
1 816 . 18 1 1 A 71 71 ASP HA H 71 4.413 4.232 0.181 1
1 819 . 18 1 1 A 71 71 ASP C C 71 174.896 177.605 -2.709 1
1 820 . 18 1 1 A 71 71 ASP CA C 71 58.334 57.309 1.025 1
1 821 . 18 1 1 A 71 71 ASP CB C 71 46.097 40.901 5.196 1
1 822 . 18 1 1 A 71 71 ASP N N 71 119.008 122.451 -3.443 1
1 823 . 18 1 1 A 72 72 LYS H H 72 7.874 7.466 0.408 1
1 824 . 18 1 1 A 72 72 LYS HA H 72 4.522 4.367 0.155 1
1 833 . 18 1 1 A 72 72 LYS C C 72 177.209 176.848 0.361 1
1 834 . 18 1 1 A 72 72 LYS CA C 72 54.122 56.211 -2.089 1
1 835 . 18 1 1 A 72 72 LYS CB C 72 31.640 33.846 -2.206 1
1 839 . 18 1 1 A 72 72 LYS N N 72 110.259 116.416 -6.157 1
1 840 . 18 1 1 A 73 73 GLU H H 73 7.421 7.925 -0.504 1
1 841 . 18 1 1 A 73 73 GLU HA H 73 4.401 4.420 -0.019 1
1 846 . 18 1 1 A 73 73 GLU C C 73 176.728 176.227 0.501 1
1 847 . 18 1 1 A 73 73 GLU CA C 73 54.950 57.011 -2.061 1
1 848 . 18 1 1 A 73 73 GLU CB C 73 30.390 30.642 -0.252 1
1 850 . 18 1 1 A 73 73 GLU N N 73 120.043 118.740 1.303 1
1 851 . 18 1 1 A 74 74 GLU H H 74 9.360 8.490 0.870 1
1 852 . 18 1 1 A 74 74 GLU HA H 74 4.403 4.772 -0.369 1
1 857 . 18 1 1 A 74 74 GLU C C 74 178.234 177.218 1.016 1
1 858 . 18 1 1 A 74 74 GLU CA C 74 56.516 55.757 0.759 1
1 859 . 18 1 1 A 74 74 GLU CB C 74 30.390 31.884 -1.494 1
1 861 . 18 1 1 A 74 74 GLU N N 74 122.193 121.663 0.530 1
1 862 . 18 1 1 A 75 75 HIS H H 75 9.553 9.234 0.319 1
1 863 . 18 1 1 A 75 75 HIS HA H 75 4.080 4.012 0.068 1
1 868 . 18 1 1 A 75 75 HIS C C 75 175.985 176.576 -0.591 1
1 869 . 18 1 1 A 75 75 HIS CA C 75 61.016 60.705 0.311 1
1 870 . 18 1 1 A 75 75 HIS CB C 75 29.468 30.572 -1.104 1
1 873 . 18 1 1 A 75 75 HIS N N 75 123.587 127.526 -3.939 1
1 874 . 18 1 1 A 76 76 ALA H H 76 9.129 8.376 0.753 1
1 875 . 18 1 1 A 76 76 ALA HA H 76 3.826 4.072 -0.246 1
1 879 . 18 1 1 A 76 76 ALA C C 76 180.475 179.676 0.799 1
1 880 . 18 1 1 A 76 76 ALA CA C 76 55.392 55.164 0.228 1
1 881 . 18 1 1 A 76 76 ALA CB C 76 18.182 18.443 -0.261 1
1 882 . 18 1 1 A 76 76 ALA N N 76 117.795 120.913 -3.118 1
1 883 . 18 1 1 A 77 77 GLN H H 77 7.099 7.798 -0.699 1
1 884 . 18 1 1 A 77 77 GLN HA H 77 4.198 4.134 0.064 1
1 891 . 18 1 1 A 77 77 GLN C C 77 177.860 178.794 -0.934 1
1 892 . 18 1 1 A 77 77 GLN CA C 77 57.790 58.642 -0.852 1
1 893 . 18 1 1 A 77 77 GLN CB C 77 28.536 28.619 -0.083 1
1 895 . 18 1 1 A 77 77 GLN N N 77 115.764 117.905 -2.141 1
1 897 . 18 1 1 A 78 78 VAL H H 78 7.430 7.636 -0.206 1
1 898 . 18 1 1 A 78 78 VAL HA H 78 3.241 3.526 -0.285 1
1 906 . 18 1 1 A 78 78 VAL C C 78 177.042 177.792 -0.750 1
1 907 . 18 1 1 A 78 78 VAL CA C 78 67.299 66.151 1.148 1
1 908 . 18 1 1 A 78 78 VAL CB C 78 30.819 31.579 -0.760 1
1 911 . 18 1 1 A 78 78 VAL N N 78 121.143 120.699 0.444 1
1 912 . 18 1 1 A 79 79 VAL H H 79 7.773 8.133 -0.360 1
1 913 . 18 1 1 A 79 79 VAL HA H 79 3.315 3.524 -0.209 1
1 921 . 18 1 1 A 79 79 VAL C C 79 179.179 177.713 1.466 1
1 922 . 18 1 1 A 79 79 VAL CA C 79 66.694 65.166 1.528 1
1 923 . 18 1 1 A 79 79 VAL CB C 79 31.841 31.276 0.565 1
1 926 . 18 1 1 A 79 79 VAL N N 79 117.473 119.856 -2.383 1
1 927 . 18 1 1 A 80 80 GLU H H 80 7.410 7.594 -0.184 1
1 928 . 18 1 1 A 80 80 GLU HA H 80 4.258 4.019 0.239 1
1 933 . 18 1 1 A 80 80 GLU C C 80 178.018 179.165 -1.147 1
1 934 . 18 1 1 A 80 80 GLU CA C 80 58.566 59.359 -0.793 1
1 935 . 18 1 1 A 80 80 GLU CB C 80 29.072 29.447 -0.375 1
1 937 . 18 1 1 A 80 80 GLU N N 80 120.451 120.903 -0.452 1
1 938 . 18 1 1 A 81 81 LEU H H 81 8.070 7.981 0.089 1
1 939 . 18 1 1 A 81 81 LEU HA H 81 3.976 4.046 -0.070 1
1 949 . 18 1 1 A 81 81 LEU C C 81 180.658 179.190 1.468 1
1 950 . 18 1 1 A 81 81 LEU CA C 81 58.061 57.873 0.188 1
1 951 . 18 1 1 A 81 81 LEU CB C 81 42.115 41.694 0.421 1
1 955 . 18 1 1 A 81 81 LEU N N 81 119.943 120.709 -0.766 1
1 956 . 18 1 1 A 82 82 VAL H H 82 7.609 8.271 -0.662 1
1 957 . 18 1 1 A 82 82 VAL HA H 82 3.474 3.533 -0.059 1
1 965 . 18 1 1 A 82 82 VAL C C 82 178.927 178.431 0.496 1
1 966 . 18 1 1 A 82 82 VAL CA C 82 67.398 67.240 0.158 1
1 967 . 18 1 1 A 82 82 VAL CB C 82 31.306 31.296 0.010 1
1 970 . 18 1 1 A 82 82 VAL N N 82 118.150 119.743 -1.593 1
1 971 . 18 1 1 A 83 83 ARG H H 83 8.186 8.046 0.140 1
1 972 . 18 1 1 A 83 83 ARG HA H 83 3.994 3.998 -0.004 1
1 979 . 18 1 1 A 83 83 ARG C C 83 179.999 178.685 1.314 1
1 980 . 18 1 1 A 83 83 ARG CA C 83 60.205 59.733 0.472 1
1 981 . 18 1 1 A 83 83 ARG CB C 83 30.103 29.990 0.113 1
1 984 . 18 1 1 A 83 83 ARG N N 83 122.902 120.354 2.548 1
1 985 . 18 1 1 A 84 84 LYS H H 84 8.772 8.033 0.739 1
1 986 . 18 1 1 A 84 84 LYS HA H 84 4.047 4.073 -0.026 1
1 995 . 18 1 1 A 84 84 LYS C C 84 176.934 178.800 -1.866 1
1 996 . 18 1 1 A 84 84 LYS CA C 84 58.142 59.052 -0.910 1
1 997 . 18 1 1 A 84 84 LYS CB C 84 32.492 32.194 0.298 1
1 1001 . 18 1 1 A 84 84 LYS N N 84 117.548 118.419 -0.871 1
1 1002 . 18 1 1 A 85 85 SER H H 85 7.333 7.879 -0.546 1
1 1003 . 18 1 1 A 85 85 SER HA H 85 4.235 4.212 0.023 1
1 1006 . 18 1 1 A 85 85 SER C C 85 175.588 175.142 0.446 1
1 1007 . 18 1 1 A 85 85 SER CA C 85 59.535 61.357 -1.822 1
1 1008 . 18 1 1 A 85 85 SER CB C 85 63.571 63.614 -0.043 1
1 1009 . 18 1 1 A 85 85 SER N N 85 113.544 115.789 -2.245 1
1 1010 . 18 1 1 A 86 86 GLY H H 86 7.459 7.504 -0.045 1
1 1011 . 18 1 1 A 86 86 GLY HA2 H 86 4.176 4.099 0.077 1
1 1012 . 18 1 1 A 86 86 GLY HA3 H 86 3.762 4.102 -0.340 1
1 1013 . 18 1 1 A 86 86 GLY C C 86 176.407 175.482 0.925 1
1 1014 . 18 1 1 A 86 86 GLY CA C 86 46.109 43.923 2.186 1
1 1015 . 18 1 1 A 86 86 GLY N N 86 104.331 107.208 -2.877 1
1 1016 . 18 1 1 A 87 87 ASN HA H 87 4.650 4.584 0.066 1
1 1021 . 18 1 1 A 87 87 ASN C C 87 173.653 175.833 -2.180 1
1 1022 . 18 1 1 A 87 87 ASN CA C 87 54.492 55.652 -1.160 1
1 1023 . 18 1 1 A 87 87 ASN CB C 87 38.425 39.311 -0.886 1
1 1024 . 18 1 1 A 87 87 ASN N N 87 118.401 123.270 -4.869 1
1 1026 . 18 1 1 A 88 88 SER H H 88 7.435 7.986 -0.551 1
1 1027 . 18 1 1 A 88 88 SER HA H 88 5.438 5.257 0.181 1
1 1030 . 18 1 1 A 88 88 SER C C 88 172.867 173.572 -0.705 1
1 1031 . 18 1 1 A 88 88 SER CA C 88 58.160 56.617 1.543 1
1 1032 . 18 1 1 A 88 88 SER CB C 88 65.861 64.763 1.098 1
1 1033 . 18 1 1 A 88 88 SER N N 88 113.765 112.389 1.376 1
1 1034 . 18 1 1 A 89 89 VAL H H 89 8.452 9.238 -0.786 1
1 1035 . 18 1 1 A 89 89 VAL HA H 89 4.519 4.757 -0.238 1
1 1043 . 18 1 1 A 89 89 VAL C C 89 171.391 174.417 -3.026 1
1 1044 . 18 1 1 A 89 89 VAL CA C 89 61.333 60.785 0.548 1
1 1045 . 18 1 1 A 89 89 VAL CB C 89 33.897 35.408 -1.511 1
1 1048 . 18 1 1 A 89 89 VAL N N 89 120.001 124.028 -4.027 1
1 1049 . 18 1 1 A 90 90 THR H H 90 8.348 8.835 -0.487 1
1 1050 . 18 1 1 A 90 90 THR HA H 90 5.042 5.367 -0.325 1
1 1055 . 18 1 1 A 90 90 THR C C 90 173.926 173.561 0.365 1
1 1056 . 18 1 1 A 90 90 THR CA C 90 61.403 61.579 -0.176 1
1 1057 . 18 1 1 A 90 90 THR CB C 90 69.553 70.563 -1.010 1
1 1059 . 18 1 1 A 90 90 THR N N 90 123.477 123.616 -0.139 1
1 1060 . 18 1 1 A 91 91 LEU H H 91 9.195 8.794 0.401 1
1 1061 . 18 1 1 A 91 91 LEU HA H 91 5.161 4.870 0.291 1
1 1071 . 18 1 1 A 91 91 LEU C C 91 174.564 175.583 -1.019 1
1 1072 . 18 1 1 A 91 91 LEU CA C 91 52.590 53.745 -1.155 1
1 1073 . 18 1 1 A 91 91 LEU CB C 91 44.998 46.013 -1.015 1
1 1077 . 18 1 1 A 91 91 LEU N N 91 128.419 125.342 3.077 1
1 1078 . 18 1 1 A 92 92 LEU H H 92 8.644 8.401 0.243 1
1 1079 . 18 1 1 A 92 92 LEU HA H 92 5.335 5.262 0.073 1
1 1089 . 18 1 1 A 92 92 LEU C C 92 176.451 175.452 0.999 1
1 1090 . 18 1 1 A 92 92 LEU CA C 92 54.220 53.841 0.379 1
1 1091 . 18 1 1 A 92 92 LEU CB C 92 44.323 43.429 0.894 1
1 1095 . 18 1 1 A 92 92 LEU N N 92 125.894 122.202 3.692 1
1 1096 . 18 1 1 A 93 93 VAL H H 93 9.249 9.201 0.048 1
1 1097 . 18 1 1 A 93 93 VAL HA H 93 5.573 5.333 0.240 1
1 1105 . 18 1 1 A 93 93 VAL C C 93 173.550 174.083 -0.533 1
1 1106 . 18 1 1 A 93 93 VAL CA C 93 58.340 59.695 -1.355 1
1 1107 . 18 1 1 A 93 93 VAL CB C 93 36.159 34.110 2.049 1
1 1110 . 18 1 1 A 93 93 VAL N N 93 120.660 119.967 0.693 1
1 1111 . 18 1 1 A 94 94 LEU H H 94 8.634 8.487 0.147 1
1 1112 . 18 1 1 A 94 94 LEU HA H 94 4.911 5.108 -0.197 1
1 1122 . 18 1 1 A 94 94 LEU C C 94 174.172 175.970 -1.798 1
1 1123 . 18 1 1 A 94 94 LEU CA C 94 52.659 53.271 -0.612 1
1 1124 . 18 1 1 A 94 94 LEU CB C 94 47.910 45.748 2.162 1
1 1128 . 18 1 1 A 94 94 LEU N N 94 120.304 127.028 -6.724 1
1 1129 . 18 1 1 A 95 95 ASP H H 95 8.210 8.809 -0.599 1
1 1130 . 18 1 1 A 95 95 ASP HA H 95 5.190 4.574 0.616 1
1 1133 . 18 1 1 A 95 95 ASP C C 95 175.887 178.033 -2.146 1
1 1134 . 18 1 1 A 95 95 ASP CA C 95 53.899 54.713 -0.814 1
1 1135 . 18 1 1 A 95 95 ASP CB C 95 41.188 41.207 -0.019 1
1 1136 . 18 1 1 A 95 95 ASP N N 95 122.184 124.120 -1.936 1
1 1137 . 18 1 1 A 96 96 GLY H H 96 8.478 8.842 -0.364 1
1 1138 . 18 1 1 A 96 96 GLY HA2 H 96 4.002 3.821 0.181 1
1 1139 . 18 1 1 A 96 96 GLY HA3 H 96 3.757 3.826 -0.069 1
1 1140 . 18 1 1 A 96 96 GLY C C 96 175.497 175.367 0.130 1
1 1141 . 18 1 1 A 96 96 GLY CA C 96 49.944 47.328 2.616 1
1 1142 . 18 1 1 A 96 96 GLY N N 96 108.610 110.841 -2.231 1
1 1143 . 18 1 1 A 97 97 ASP H H 97 8.401 8.173 0.228 1
1 1144 . 18 1 1 A 97 97 ASP HA H 97 4.454 4.349 0.105 1
1 1147 . 18 1 1 A 97 97 ASP C C 97 179.612 178.671 0.941 1
1 1148 . 18 1 1 A 97 97 ASP CA C 97 57.913 56.953 0.960 1
1 1149 . 18 1 1 A 97 97 ASP CB C 97 41.145 40.432 0.713 1
1 1150 . 18 1 1 A 97 97 ASP N N 97 120.034 121.572 -1.538 1
1 1151 . 18 1 1 A 98 98 SER H H 98 8.152 8.108 0.044 1
1 1152 . 18 1 1 A 98 98 SER HA H 98 4.218 4.183 0.035 1
1 1155 . 18 1 1 A 98 98 SER C C 98 175.061 175.438 -0.377 1
1 1156 . 18 1 1 A 98 98 SER CA C 98 62.180 62.337 -0.157 1
1 1157 . 18 1 1 A 98 98 SER CB C 98 62.179 62.702 -0.523 1
1 1158 . 18 1 1 A 98 98 SER N N 98 117.174 116.021 1.153 1
1 1159 . 18 1 1 A 99 99 TYR H H 99 9.051 8.642 0.409 1
1 1160 . 18 1 1 A 99 99 TYR HA H 99 3.692 3.750 -0.058 1
1 1167 . 18 1 1 A 99 99 TYR C C 99 176.460 177.136 -0.676 1
1 1168 . 18 1 1 A 99 99 TYR CA C 99 62.814 62.039 0.775 1
1 1169 . 18 1 1 A 99 99 TYR CB C 99 38.829 38.562 0.267 1
1 1174 . 18 1 1 A 99 99 TYR N N 99 123.539 122.328 1.211 1
1 1175 . 18 1 1 A 100 100 GLU H H 100 8.520 8.514 0.006 1
1 1176 . 18 1 1 A 100 100 GLU HA H 100 3.952 4.008 -0.056 1
1 1181 . 18 1 1 A 100 100 GLU C C 100 180.151 179.125 1.026 1
1 1182 . 18 1 1 A 100 100 GLU CA C 100 60.099 59.924 0.175 1
1 1183 . 18 1 1 A 100 100 GLU CB C 100 29.435 29.250 0.185 1
1 1185 . 18 1 1 A 100 100 GLU N N 100 117.082 118.478 -1.396 1
1 1186 . 18 1 1 A 101 101 LYS H H 101 7.740 7.986 -0.246 1
1 1187 . 18 1 1 A 101 101 LYS HA H 101 3.984 4.059 -0.075 1
1 1196 . 18 1 1 A 101 101 LYS C C 101 178.377 178.124 0.253 1
1 1197 . 18 1 1 A 101 101 LYS CA C 101 59.888 59.445 0.443 1
1 1198 . 18 1 1 A 101 101 LYS CB C 101 32.821 32.373 0.448 1
1 1202 . 18 1 1 A 101 101 LYS N N 101 119.851 121.023 -1.172 1
1 1203 . 18 1 1 A 102 102 ALA H H 102 8.538 8.269 0.269 1
1 1204 . 18 1 1 A 102 102 ALA HA H 102 3.632 4.160 -0.528 1
1 1208 . 18 1 1 A 102 102 ALA C C 102 179.870 180.076 -0.206 1
1 1209 . 18 1 1 A 102 102 ALA CA C 102 55.285 55.225 0.060 1
1 1210 . 18 1 1 A 102 102 ALA CB C 102 17.163 18.234 -1.071 1
1 1211 . 18 1 1 A 102 102 ALA N N 102 124.176 120.520 3.656 1
1 1212 . 18 1 1 A 103 103 VAL H H 103 8.147 8.105 0.042 1
1 1213 . 18 1 1 A 103 103 VAL HA H 103 3.658 3.538 0.120 1
1 1221 . 18 1 1 A 103 103 VAL C C 103 181.113 177.833 3.280 1
1 1222 . 18 1 1 A 103 103 VAL CA C 103 66.090 67.018 -0.928 1
1 1223 . 18 1 1 A 103 103 VAL CB C 103 31.822 31.495 0.327 1
1 1226 . 18 1 1 A 103 103 VAL N N 103 117.841 118.039 -0.198 1
1 1227 . 18 1 1 A 104 104 LYS H H 104 7.903 7.830 0.073 1
1 1228 . 18 1 1 A 104 104 LYS HA H 104 4.065 3.970 0.095 1
1 1235 . 18 1 1 A 104 104 LYS C C 104 177.715 178.335 -0.620 1
1 1236 . 18 1 1 A 104 104 LYS CA C 104 59.094 59.776 -0.682 1
1 1237 . 18 1 1 A 104 104 LYS CB C 104 32.285 32.321 -0.036 1
1 1241 . 18 1 1 A 104 104 LYS N N 104 121.515 120.211 1.304 1
1 1242 . 18 1 1 A 105 105 ASN H H 105 7.747 7.823 -0.076 1
1 1243 . 18 1 1 A 105 105 ASN HA H 105 4.721 4.848 -0.127 1
1 1248 . 18 1 1 A 105 105 ASN C C 105 173.320 173.953 -0.633 1
1 1249 . 18 1 1 A 105 105 ASN CA C 105 53.399 53.051 0.348 1
1 1250 . 18 1 1 A 105 105 ASN CB C 105 39.249 38.462 0.787 1
1 1251 . 18 1 1 A 105 105 ASN N N 105 114.941 115.553 -0.612 1
1 1253 . 18 1 1 A 106 106 GLN H H 106 7.850 7.883 -0.033 1
1 1254 . 18 1 1 A 106 106 GLN HA H 106 3.902 3.825 0.077 1
1 1261 . 18 1 1 A 106 106 GLN C C 106 175.168 174.954 0.214 1
1 1262 . 18 1 1 A 106 106 GLN CA C 106 56.978 56.879 0.099 1
1 1263 . 18 1 1 A 106 106 GLN CB C 106 25.770 26.957 -1.187 1
1 1265 . 18 1 1 A 106 106 GLN N N 106 114.989 115.499 -0.510 1
1 1267 . 18 1 1 A 107 107 VAL H H 107 8.005 7.842 0.163 1
1 1268 . 18 1 1 A 107 107 VAL HA H 107 3.664 4.020 -0.356 1
1 1276 . 18 1 1 A 107 107 VAL C C 107 175.468 175.248 0.220 1
1 1277 . 18 1 1 A 107 107 VAL CA C 107 62.726 62.624 0.102 1
1 1278 . 18 1 1 A 107 107 VAL CB C 107 32.535 31.932 0.603 1
1 1281 . 18 1 1 A 107 107 VAL N N 107 120.216 120.117 0.099 1
1 1282 . 18 1 1 A 108 108 ASP H H 108 8.484 8.731 -0.247 1
1 1283 . 18 1 1 A 108 108 ASP HA H 108 4.467 4.613 -0.146 1
1 1286 . 18 1 1 A 108 108 ASP C C 108 177.179 176.005 1.174 1
1 1287 . 18 1 1 A 108 108 ASP CA C 108 53.417 54.998 -1.581 1
1 1288 . 18 1 1 A 108 108 ASP CB C 108 40.030 40.758 -0.728 1
1 1289 . 18 1 1 A 108 108 ASP N N 108 125.414 128.415 -3.001 1
1 1290 . 18 1 1 A 109 109 LEU H H 109 8.470 8.456 0.014 1
1 1291 . 18 1 1 A 109 109 LEU HA H 109 3.846 4.277 -0.431 1
1 1301 . 18 1 1 A 109 109 LEU C C 109 178.145 178.667 -0.522 1
1 1302 . 18 1 1 A 109 109 LEU CA C 109 56.573 56.223 0.350 1
1 1303 . 18 1 1 A 109 109 LEU CB C 109 42.011 41.864 0.147 1
1 1307 . 18 1 1 A 109 109 LEU N N 109 127.577 124.767 2.810 1
1 1308 . 18 1 1 A 110 110 LYS H H 110 8.062 8.072 -0.010 1
1 1309 . 18 1 1 A 110 110 LYS HA H 110 3.022 3.628 -0.606 1
1 1317 . 18 1 1 A 110 110 LYS C C 110 177.248 179.437 -2.189 1
1 1318 . 18 1 1 A 110 110 LYS CA C 110 58.742 59.739 -0.997 1
1 1319 . 18 1 1 A 110 110 LYS CB C 110 31.667 31.936 -0.269 1
1 1323 . 18 1 1 A 110 110 LYS N N 110 118.873 118.250 0.623 1
1 1324 . 18 1 1 A 111 111 GLU H H 111 7.113 8.055 -0.942 1
1 1325 . 18 1 1 A 111 111 GLU HA H 111 4.117 4.157 -0.040 1
1 1330 . 18 1 1 A 111 111 GLU C C 111 176.519 177.726 -1.207 1
1 1331 . 18 1 1 A 111 111 GLU CA C 111 55.621 59.072 -3.451 1
1 1332 . 18 1 1 A 111 111 GLU CB C 111 29.943 29.204 0.739 1
1 1334 . 18 1 1 A 111 111 GLU N N 111 114.282 119.488 -5.206 1
1 1335 . 18 1 1 A 112 112 LEU H H 112 6.848 7.763 -0.915 1
1 1336 . 18 1 1 A 112 112 LEU HA H 112 4.293 4.177 0.116 1
1 1346 . 18 1 1 A 112 112 LEU C C 112 175.674 176.275 -0.601 1
1 1347 . 18 1 1 A 112 112 LEU CA C 112 55.197 55.944 -0.747 1
1 1348 . 18 1 1 A 112 112 LEU CB C 112 41.681 41.763 -0.082 1
1 1352 . 18 1 1 A 112 112 LEU N N 112 118.934 122.001 -3.067 1
1 1353 . 18 1 1 A 113 113 ASP H H 113 8.466 8.449 0.017 1
1 1354 . 18 1 1 A 113 113 ASP HA H 113 4.593 5.358 -0.765 1
1 1357 . 18 1 1 A 113 113 ASP C C 113 174.511 174.737 -0.226 1
1 1358 . 18 1 1 A 113 113 ASP CA C 113 53.558 53.217 0.341 1
1 1359 . 18 1 1 A 113 113 ASP CB C 113 42.448 43.196 -0.748 1
1 1360 . 18 1 1 A 113 113 ASP N N 113 122.148 122.492 -0.344 1
1 1 . 19 1 1 A 6 6 SER HA H 6 4.483 4.414 0.069 1
1 4 . 19 1 1 A 6 6 SER C C 6 175.167 175.062 0.105 1
1 5 . 19 1 1 A 6 6 SER CA C 6 58.759 57.471 1.288 1
1 6 . 19 1 1 A 6 6 SER CB C 6 64.069 62.981 1.088 1
1 7 . 19 1 1 A 7 7 GLY H H 7 8.431 8.726 -0.295 1
1 8 . 19 1 1 A 7 7 GLY HA2 H 7 3.973 3.817 0.156 1
1 9 . 19 1 1 A 7 7 GLY HA3 H 7 3.973 3.820 0.153 1
1 10 . 19 1 1 A 7 7 GLY C C 7 174.570 175.593 -1.023 1
1 11 . 19 1 1 A 7 7 GLY CA C 7 45.483 46.788 -1.305 1
1 12 . 19 1 1 A 7 7 GLY N N 7 110.640 114.196 -3.556 1
1 13 . 19 1 1 A 8 8 MET H H 8 8.239 8.197 0.042 1
1 14 . 19 1 1 A 8 8 MET HA H 8 4.386 4.734 -0.348 1
1 22 . 19 1 1 A 8 8 MET C C 8 176.621 174.681 1.940 1
1 23 . 19 1 1 A 8 8 MET CA C 8 55.991 56.888 -0.897 1
1 24 . 19 1 1 A 8 8 MET CB C 8 32.986 34.661 -1.675 1
1 27 . 19 1 1 A 8 8 MET N N 8 120.219 123.294 -3.075 1
1 28 . 19 1 1 A 9 9 ALA H H 9 8.435 7.841 0.594 1
1 29 . 19 1 1 A 9 9 ALA HA H 9 4.182 4.750 -0.568 1
1 33 . 19 1 1 A 9 9 ALA C C 9 177.951 176.404 1.547 1
1 34 . 19 1 1 A 9 9 ALA CA C 9 53.399 50.566 2.833 1
1 35 . 19 1 1 A 9 9 ALA CB C 9 18.955 22.273 -3.318 1
1 36 . 19 1 1 A 9 9 ALA N N 9 124.459 120.516 3.943 1
1 37 . 19 1 1 A 10 10 SER H H 10 8.100 8.592 -0.492 1
1 38 . 19 1 1 A 10 10 SER HA H 10 4.391 4.445 -0.054 1
1 41 . 19 1 1 A 10 10 SER C C 10 174.467 174.539 -0.072 1
1 42 . 19 1 1 A 10 10 SER CA C 10 58.709 59.252 -0.543 1
1 43 . 19 1 1 A 10 10 SER CB C 10 63.778 63.868 -0.090 1
1 44 . 19 1 1 A 10 10 SER N N 10 113.881 117.905 -4.024 1
1 45 . 19 1 1 A 11 11 THR H H 11 7.821 8.261 -0.440 1
1 46 . 19 1 1 A 11 11 THR HA H 11 4.191 4.679 -0.488 1
1 51 . 19 1 1 A 11 11 THR C C 11 173.610 172.150 1.460 1
1 52 . 19 1 1 A 11 11 THR CA C 11 61.936 60.596 1.340 1
1 53 . 19 1 1 A 11 11 THR CB C 11 69.713 71.487 -1.774 1
1 55 . 19 1 1 A 11 11 THR N N 11 114.471 116.998 -2.527 1
1 56 . 19 1 1 A 12 12 PHE H H 12 7.946 9.160 -1.214 1
1 57 . 19 1 1 A 12 12 PHE HA H 12 4.769 4.965 -0.196 1
1 65 . 19 1 1 A 12 12 PHE C C 12 174.211 175.236 -1.025 1
1 66 . 19 1 1 A 12 12 PHE CA C 12 56.644 57.200 -0.556 1
1 67 . 19 1 1 A 12 12 PHE CB C 12 40.609 41.569 -0.960 1
1 73 . 19 1 1 A 12 12 PHE N N 12 120.763 125.421 -4.658 1
1 74 . 19 1 1 A 13 13 ASN H H 13 9.004 8.754 0.250 1
1 75 . 19 1 1 A 13 13 ASN HA H 13 5.366 5.474 -0.108 1
1 80 . 19 1 1 A 13 13 ASN C C 13 172.158 172.867 -0.709 1
1 81 . 19 1 1 A 13 13 ASN CA C 13 50.988 50.492 0.496 1
1 82 . 19 1 1 A 13 13 ASN CB C 13 39.942 39.142 0.800 1
1 83 . 19 1 1 A 13 13 ASN N N 13 119.973 118.738 1.235 1
1 85 . 19 1 1 A 14 14 PRO HA H 14 4.945 4.581 0.364 1
1 92 . 19 1 1 A 14 14 PRO C C 14 174.901 176.013 -1.112 1
1 93 . 19 1 1 A 14 14 PRO CA C 14 63.096 62.701 0.395 1
1 94 . 19 1 1 A 14 14 PRO CB C 14 32.739 32.104 0.635 1
1 97 . 19 1 1 A 15 15 ARG H H 15 8.908 8.483 0.425 1
1 98 . 19 1 1 A 15 15 ARG HA H 15 4.626 4.715 -0.089 1
1 106 . 19 1 1 A 15 15 ARG C C 15 174.432 174.785 -0.353 1
1 107 . 19 1 1 A 15 15 ARG CA C 15 54.827 55.779 -0.952 1
1 108 . 19 1 1 A 15 15 ARG CB C 15 32.439 31.189 1.250 1
1 111 . 19 1 1 A 15 15 ARG N N 15 118.947 122.383 -3.436 1
1 113 . 19 1 1 A 16 16 GLU H H 16 8.838 8.790 0.048 1
1 114 . 19 1 1 A 16 16 GLU HA H 16 4.876 4.808 0.068 1
1 119 . 19 1 1 A 16 16 GLU C C 16 175.767 175.462 0.305 1
1 120 . 19 1 1 A 16 16 GLU CA C 16 55.621 56.021 -0.400 1
1 121 . 19 1 1 A 16 16 GLU CB C 16 31.093 30.641 0.452 1
1 123 . 19 1 1 A 16 16 GLU N N 16 125.316 124.370 0.946 1
1 124 . 19 1 1 A 17 17 CYS H H 17 9.327 9.013 0.314 1
1 125 . 19 1 1 A 17 17 CYS HA H 17 4.804 5.139 -0.335 1
1 128 . 19 1 1 A 17 17 CYS C C 17 172.973 173.372 -0.399 1
1 129 . 19 1 1 A 17 17 CYS CA C 17 57.930 57.586 0.344 1
1 130 . 19 1 1 A 17 17 CYS CB C 17 30.105 29.223 0.882 1
1 131 . 19 1 1 A 17 17 CYS N N 17 127.909 126.091 1.818 1
1 132 . 19 1 1 A 18 18 LYS H H 18 9.022 8.825 0.197 1
1 133 . 19 1 1 A 18 18 LYS HA H 18 4.769 4.676 0.093 1
1 142 . 19 1 1 A 18 18 LYS C C 18 174.586 175.593 -1.007 1
1 143 . 19 1 1 A 18 18 LYS CA C 18 55.956 55.081 0.875 1
1 144 . 19 1 1 A 18 18 LYS CB C 18 32.203 33.215 -1.012 1
1 148 . 19 1 1 A 18 18 LYS N N 18 127.039 124.811 2.228 1
1 149 . 19 1 1 A 19 19 LEU H H 19 8.784 8.471 0.313 1
1 150 . 19 1 1 A 19 19 LEU HA H 19 4.852 4.601 0.251 1
1 160 . 19 1 1 A 19 19 LEU C C 19 176.862 176.332 0.530 1
1 161 . 19 1 1 A 19 19 LEU CA C 19 55.391 54.419 0.972 1
1 162 . 19 1 1 A 19 19 LEU CB C 19 44.442 42.314 2.128 1
1 166 . 19 1 1 A 19 19 LEU N N 19 126.311 126.266 0.045 1
1 167 . 19 1 1 A 20 20 SER H H 20 8.215 8.954 -0.739 1
1 168 . 19 1 1 A 20 20 SER HA H 20 5.461 5.682 -0.221 1
1 171 . 19 1 1 A 20 20 SER C C 20 171.960 173.659 -1.699 1
1 172 . 19 1 1 A 20 20 SER CA C 20 57.525 56.692 0.833 1
1 173 . 19 1 1 A 20 20 SER CB C 20 65.794 65.759 0.035 1
1 174 . 19 1 1 A 20 20 SER N N 20 115.113 116.855 -1.742 1
1 175 . 19 1 1 A 21 21 LYS H H 21 9.001 9.141 -0.140 1
1 176 . 19 1 1 A 21 21 LYS HA H 21 4.887 5.007 -0.120 1
1 185 . 19 1 1 A 21 21 LYS C C 21 174.133 175.370 -1.237 1
1 186 . 19 1 1 A 21 21 LYS CA C 21 53.840 54.139 -0.299 1
1 187 . 19 1 1 A 21 21 LYS CB C 21 36.553 35.703 0.850 1
1 191 . 19 1 1 A 21 21 LYS N N 21 120.938 121.367 -0.429 1
1 192 . 19 1 1 A 22 22 GLN H H 22 8.201 8.241 -0.040 1
1 193 . 19 1 1 A 22 22 GLN HA H 22 4.448 4.501 -0.053 1
1 200 . 19 1 1 A 22 22 GLN C C 22 176.372 175.645 0.727 1
1 201 . 19 1 1 A 22 22 GLN CA C 22 53.658 55.201 -1.543 1
1 202 . 19 1 1 A 22 22 GLN CB C 22 30.473 29.985 0.488 1
1 204 . 19 1 1 A 22 22 GLN N N 22 116.816 120.146 -3.330 1
1 206 . 19 1 1 A 23 23 GLU H H 23 8.624 8.661 -0.037 1
1 207 . 19 1 1 A 23 23 GLU HA H 23 4.056 4.277 -0.221 1
1 212 . 19 1 1 A 23 23 GLU C C 23 177.778 177.108 0.670 1
1 213 . 19 1 1 A 23 23 GLU CA C 23 58.001 57.063 0.938 1
1 214 . 19 1 1 A 23 23 GLU CB C 23 29.237 30.352 -1.115 1
1 216 . 19 1 1 A 23 23 GLU N N 23 122.364 122.430 -0.066 1
1 217 . 19 1 1 A 24 24 GLY H H 24 8.962 8.776 0.186 1
1 218 . 19 1 1 A 24 24 GLY HA2 H 24 4.139 4.001 0.138 1
1 219 . 19 1 1 A 24 24 GLY HA3 H 24 3.711 4.004 -0.293 1
1 220 . 19 1 1 A 24 24 GLY C C 24 173.857 174.281 -0.424 1
1 221 . 19 1 1 A 24 24 GLY CA C 24 45.288 45.019 0.269 1
1 222 . 19 1 1 A 24 24 GLY N N 24 113.942 114.844 -0.902 1
1 223 . 19 1 1 A 25 25 GLN H H 25 7.643 7.819 -0.176 1
1 224 . 19 1 1 A 25 25 GLN HA H 25 4.488 4.446 0.042 1
1 231 . 19 1 1 A 25 25 GLN C C 25 174.727 175.635 -0.908 1
1 232 . 19 1 1 A 25 25 GLN CA C 25 54.052 54.919 -0.867 1
1 233 . 19 1 1 A 25 25 GLN CB C 25 30.843 29.938 0.905 1
1 235 . 19 1 1 A 25 25 GLN N N 25 119.538 121.161 -1.623 1
1 237 . 19 1 1 A 26 26 ASN H H 26 8.625 8.575 0.050 1
1 238 . 19 1 1 A 26 26 ASN HA H 26 4.862 4.970 -0.108 1
1 243 . 19 1 1 A 26 26 ASN C C 26 176.261 176.286 -0.025 1
1 244 . 19 1 1 A 26 26 ASN CA C 26 51.812 51.702 0.110 1
1 245 . 19 1 1 A 26 26 ASN CB C 26 40.403 38.983 1.420 1
1 246 . 19 1 1 A 26 26 ASN N N 26 120.047 123.536 -3.489 1
1 248 . 19 1 1 A 27 27 TYR HA H 27 4.152 4.438 -0.286 1
1 255 . 19 1 1 A 27 27 TYR C C 27 176.731 175.758 0.973 1
1 256 . 19 1 1 A 27 27 TYR CA C 27 62.462 60.435 2.027 1
1 257 . 19 1 1 A 27 27 TYR CB C 27 40.240 39.082 1.158 1
1 262 . 19 1 1 A 27 27 TYR N N 27 121.761 120.854 0.907 1
1 263 . 19 1 1 A 28 28 GLY H H 28 8.285 8.195 0.090 1
1 264 . 19 1 1 A 28 28 GLY HA2 H 28 4.490 3.970 0.520 1
1 265 . 19 1 1 A 28 28 GLY HA3 H 28 3.759 4.025 -0.266 1
1 266 . 19 1 1 A 28 28 GLY C C 28 172.198 173.820 -1.622 1
1 267 . 19 1 1 A 28 28 GLY CA C 28 46.139 45.218 0.921 1
1 268 . 19 1 1 A 28 28 GLY N N 28 103.567 107.271 -3.704 1
1 269 . 19 1 1 A 29 29 PHE H H 29 6.878 7.959 -1.081 1
1 270 . 19 1 1 A 29 29 PHE HA H 29 5.179 4.634 0.545 1
1 278 . 19 1 1 A 29 29 PHE C C 29 172.840 173.961 -1.121 1
1 279 . 19 1 1 A 29 29 PHE CA C 29 55.262 54.890 0.372 1
1 280 . 19 1 1 A 29 29 PHE CB C 29 41.779 42.246 -0.467 1
1 286 . 19 1 1 A 29 29 PHE N N 29 111.027 117.430 -6.403 1
1 287 . 19 1 1 A 30 30 PHE H H 30 8.806 8.386 0.420 1
1 288 . 19 1 1 A 30 30 PHE HA H 30 4.923 4.714 0.209 1
1 296 . 19 1 1 A 30 30 PHE C C 30 174.501 175.075 -0.574 1
1 297 . 19 1 1 A 30 30 PHE CA C 30 55.356 55.920 -0.564 1
1 298 . 19 1 1 A 30 30 PHE CB C 30 41.681 42.768 -1.087 1
1 304 . 19 1 1 A 30 30 PHE N N 30 118.710 117.657 1.053 1
1 305 . 19 1 1 A 31 31 LEU H H 31 8.441 8.903 -0.462 1
1 306 . 19 1 1 A 31 31 LEU HA H 31 5.447 4.928 0.519 1
1 316 . 19 1 1 A 31 31 LEU C C 31 177.306 175.647 1.659 1
1 317 . 19 1 1 A 31 31 LEU CA C 31 53.610 53.964 -0.354 1
1 318 . 19 1 1 A 31 31 LEU CB C 31 43.696 41.427 2.269 1
1 322 . 19 1 1 A 31 31 LEU N N 31 123.765 124.100 -0.335 1
1 323 . 19 1 1 A 32 32 ARG H H 32 9.381 8.722 0.659 1
1 324 . 19 1 1 A 32 32 ARG HA H 32 4.840 4.686 0.154 1
1 331 . 19 1 1 A 32 32 ARG C C 32 175.155 175.874 -0.719 1
1 332 . 19 1 1 A 32 32 ARG CA C 32 54.210 54.056 0.154 1
1 333 . 19 1 1 A 32 32 ARG CB C 32 35.087 32.347 2.740 1
1 336 . 19 1 1 A 32 32 ARG N N 32 123.160 124.210 -1.050 1
1 337 . 19 1 1 A 33 33 ILE H H 33 7.891 8.735 -0.844 1
1 338 . 19 1 1 A 33 33 ILE HA H 33 4.495 4.929 -0.434 1
1 348 . 19 1 1 A 33 33 ILE C C 33 175.850 174.531 1.319 1
1 349 . 19 1 1 A 33 33 ILE CA C 33 59.641 59.197 0.444 1
1 350 . 19 1 1 A 33 33 ILE CB C 33 39.538 41.072 -1.534 1
1 354 . 19 1 1 A 33 33 ILE N N 33 118.924 118.181 0.743 1
1 355 . 19 1 1 A 34 34 GLU H H 34 8.971 8.848 0.123 1
1 356 . 19 1 1 A 34 34 GLU HA H 34 4.578 4.666 -0.088 1
1 361 . 19 1 1 A 34 34 GLU C C 34 175.766 176.481 -0.715 1
1 362 . 19 1 1 A 34 34 GLU CA C 34 54.263 54.654 -0.391 1
1 363 . 19 1 1 A 34 34 GLU CB C 34 32.128 31.992 0.136 1
1 365 . 19 1 1 A 34 34 GLU N N 34 125.447 122.742 2.705 1
1 366 . 19 1 1 A 35 35 LYS H H 35 8.504 8.739 -0.235 1
1 367 . 19 1 1 A 35 35 LYS HA H 35 4.026 4.225 -0.199 1
1 376 . 19 1 1 A 35 35 LYS C C 35 177.701 176.265 1.436 1
1 377 . 19 1 1 A 35 35 LYS CA C 35 57.591 56.151 1.440 1
1 378 . 19 1 1 A 35 35 LYS CB C 35 32.491 32.884 -0.393 1
1 382 . 19 1 1 A 35 35 LYS N N 35 122.893 121.187 1.706 1
1 383 . 19 1 1 A 36 36 ASP H H 36 9.020 8.888 0.132 1
1 384 . 19 1 1 A 36 36 ASP HA H 36 4.385 4.122 0.263 1
1 387 . 19 1 1 A 36 36 ASP C C 36 174.554 174.754 -0.200 1
1 388 . 19 1 1 A 36 36 ASP CA C 36 55.868 55.111 0.757 1
1 389 . 19 1 1 A 36 36 ASP CB C 36 39.826 39.638 0.188 1
1 390 . 19 1 1 A 36 36 ASP N N 36 121.412 119.317 2.095 1
1 391 . 19 1 1 A 37 37 THR H H 37 7.464 7.577 -0.113 1
1 392 . 19 1 1 A 37 37 THR HA H 37 4.454 4.708 -0.254 1
1 397 . 19 1 1 A 37 37 THR C C 37 172.012 173.109 -1.097 1
1 398 . 19 1 1 A 37 37 THR CA C 37 61.686 61.427 0.259 1
1 399 . 19 1 1 A 37 37 THR CB C 37 70.927 71.678 -0.751 1
1 401 . 19 1 1 A 37 37 THR N N 37 113.147 113.002 0.145 1
1 402 . 19 1 1 A 38 38 ASP H H 38 8.931 8.765 0.166 1
1 403 . 19 1 1 A 38 38 ASP HA H 38 4.852 4.773 0.079 1
1 406 . 19 1 1 A 38 38 ASP CA C 38 54.826 54.163 0.663 1
1 407 . 19 1 1 A 38 38 ASP CB C 38 43.332 42.068 1.264 1
1 408 . 19 1 1 A 38 38 ASP N N 38 120.401 124.865 -4.464 1
1 409 . 19 1 1 A 39 39 GLY H H 39 8.068 8.409 -0.341 1
1 410 . 19 1 1 A 39 39 GLY HA2 H 39 3.774 3.974 -0.200 1
1 411 . 19 1 1 A 39 39 GLY HA3 H 39 3.555 4.044 -0.489 1
1 412 . 19 1 1 A 39 39 GLY C C 39 172.578 173.306 -0.728 1
1 413 . 19 1 1 A 39 39 GLY CA C 39 43.967 44.703 -0.736 1
1 414 . 19 1 1 A 39 39 GLY N N 39 107.925 109.266 -1.341 1
1 415 . 19 1 1 A 40 40 HIS H H 40 9.111 8.445 0.666 1
1 416 . 19 1 1 A 40 40 HIS HA H 40 4.650 4.885 -0.235 1
1 421 . 19 1 1 A 40 40 HIS C C 40 174.330 174.795 -0.465 1
1 422 . 19 1 1 A 40 40 HIS CA C 40 55.886 55.970 -0.084 1
1 423 . 19 1 1 A 40 40 HIS CB C 40 30.507 31.705 -1.198 1
1 426 . 19 1 1 A 40 40 HIS N N 40 119.179 118.933 0.246 1
1 427 . 19 1 1 A 41 41 LEU H H 41 8.254 8.292 -0.038 1
1 428 . 19 1 1 A 41 41 LEU HA H 41 4.626 5.392 -0.766 1
1 438 . 19 1 1 A 41 41 LEU C C 41 176.035 174.999 1.036 1
1 439 . 19 1 1 A 41 41 LEU CA C 41 55.621 53.692 1.929 1
1 440 . 19 1 1 A 41 41 LEU CB C 41 45.091 45.434 -0.343 1
1 444 . 19 1 1 A 41 41 LEU N N 41 124.808 121.636 3.172 1
1 445 . 19 1 1 A 42 42 ILE H H 42 8.685 8.245 0.440 1
1 446 . 19 1 1 A 42 42 ILE HA H 42 4.578 4.929 -0.351 1
1 456 . 19 1 1 A 42 42 ILE C C 42 175.369 176.011 -0.642 1
1 457 . 19 1 1 A 42 42 ILE CA C 42 59.852 60.692 -0.840 1
1 458 . 19 1 1 A 42 42 ILE CB C 42 36.778 38.742 -1.964 1
1 462 . 19 1 1 A 42 42 ILE N N 42 121.814 122.107 -0.293 1
1 463 . 19 1 1 A 43 43 ARG H H 43 8.787 8.544 0.243 1
1 464 . 19 1 1 A 43 43 ARG HA H 43 4.852 4.940 -0.088 1
1 472 . 19 1 1 A 43 43 ARG C C 43 174.029 175.445 -1.416 1
1 473 . 19 1 1 A 43 43 ARG CA C 43 52.730 53.946 -1.216 1
1 474 . 19 1 1 A 43 43 ARG CB C 43 36.983 33.884 3.099 1
1 477 . 19 1 1 A 43 43 ARG N N 43 125.771 126.703 -0.932 1
1 479 . 19 1 1 A 44 44 VAL H H 44 8.661 8.582 0.079 1
1 480 . 19 1 1 A 44 44 VAL HA H 44 3.276 3.618 -0.342 1
1 488 . 19 1 1 A 44 44 VAL C C 44 173.227 174.888 -1.661 1
1 489 . 19 1 1 A 44 44 VAL CA C 44 63.161 63.025 0.136 1
1 490 . 19 1 1 A 44 44 VAL CB C 44 29.054 29.554 -0.500 1
1 493 . 19 1 1 A 44 44 VAL N N 44 117.026 116.403 0.623 1
1 494 . 19 1 1 A 45 45 ILE H H 45 8.464 7.944 0.520 1
1 495 . 19 1 1 A 45 45 ILE HA H 45 4.579 4.013 0.566 1
1 505 . 19 1 1 A 45 45 ILE C C 45 178.108 175.004 3.104 1
1 506 . 19 1 1 A 45 45 ILE CA C 45 59.888 60.973 -1.085 1
1 507 . 19 1 1 A 45 45 ILE CB C 45 36.998 37.339 -0.341 1
1 511 . 19 1 1 A 45 45 ILE N N 45 122.767 122.103 0.664 1
1 512 . 19 1 1 A 46 46 GLU H H 46 9.015 8.217 0.798 1
1 513 . 19 1 1 A 46 46 GLU HA H 46 4.206 4.372 -0.166 1
1 518 . 19 1 1 A 46 46 GLU C C 46 177.746 176.205 1.541 1
1 519 . 19 1 1 A 46 46 GLU CA C 46 56.130 56.375 -0.245 1
1 520 . 19 1 1 A 46 46 GLU CB C 46 30.581 30.294 0.287 1
1 522 . 19 1 1 A 46 46 GLU N N 46 131.076 128.476 2.600 1
1 523 . 19 1 1 A 47 47 GLU H H 47 9.213 8.763 0.450 1
1 524 . 19 1 1 A 47 47 GLU HA H 47 4.194 3.990 0.204 1
1 529 . 19 1 1 A 47 47 GLU C C 47 178.088 177.677 0.411 1
1 530 . 19 1 1 A 47 47 GLU CA C 47 58.212 58.175 0.037 1
1 531 . 19 1 1 A 47 47 GLU CB C 47 29.390 29.684 -0.294 1
1 533 . 19 1 1 A 47 47 GLU N N 47 129.592 124.909 4.683 1
1 534 . 19 1 1 A 48 48 GLY H H 48 9.586 8.837 0.749 1
1 535 . 19 1 1 A 48 48 GLY HA2 H 48 4.141 3.879 0.262 1
1 536 . 19 1 1 A 48 48 GLY HA3 H 48 3.757 3.881 -0.124 1
1 537 . 19 1 1 A 48 48 GLY C C 48 173.790 174.085 -0.295 1
1 538 . 19 1 1 A 48 48 GLY CA C 48 45.764 46.450 -0.686 1
1 539 . 19 1 1 A 48 48 GLY N N 48 114.819 114.969 -0.150 1
1 540 . 19 1 1 A 49 49 SER H H 49 7.580 7.875 -0.295 1
1 541 . 19 1 1 A 49 49 SER HA H 49 4.728 4.708 0.020 1
1 544 . 19 1 1 A 49 49 SER C C 49 173.542 174.701 -1.159 1
1 545 . 19 1 1 A 49 49 SER CA C 49 57.560 56.121 1.439 1
1 546 . 19 1 1 A 49 49 SER CB C 49 64.529 63.535 0.994 1
1 547 . 19 1 1 A 49 49 SER N N 49 114.688 114.941 -0.253 1
1 548 . 19 1 1 A 50 50 PRO HA H 50 4.431 4.559 -0.128 1
1 555 . 19 1 1 A 50 50 PRO C C 50 179.377 177.617 1.760 1
1 556 . 19 1 1 A 50 50 PRO CA C 50 66.059 64.224 1.835 1
1 557 . 19 1 1 A 50 50 PRO CB C 50 32.598 31.854 0.744 1
1 560 . 19 1 1 A 51 51 ALA H H 51 8.264 7.970 0.294 1
1 561 . 19 1 1 A 51 51 ALA HA H 51 3.817 3.970 -0.153 1
1 565 . 19 1 1 A 51 51 ALA C C 51 177.508 179.608 -2.100 1
1 566 . 19 1 1 A 51 51 ALA CA C 51 55.392 54.767 0.625 1
1 567 . 19 1 1 A 51 51 ALA CB C 51 20.474 18.399 2.075 1
1 568 . 19 1 1 A 51 51 ALA N N 51 117.604 120.280 -2.676 1
1 569 . 19 1 1 A 52 52 GLU H H 52 7.794 7.540 0.254 1
1 570 . 19 1 1 A 52 52 GLU HA H 52 3.881 4.002 -0.121 1
1 575 . 19 1 1 A 52 52 GLU C C 52 181.401 178.639 2.762 1
1 576 . 19 1 1 A 52 52 GLU CA C 52 59.454 59.108 0.346 1
1 577 . 19 1 1 A 52 52 GLU CB C 52 30.247 29.509 0.738 1
1 579 . 19 1 1 A 52 52 GLU N N 52 119.474 118.258 1.216 1
1 580 . 19 1 1 A 53 53 LYS H H 53 8.557 7.998 0.559 1
1 581 . 19 1 1 A 53 53 LYS HA H 53 4.020 4.100 -0.080 1
1 588 . 19 1 1 A 53 53 LYS C C 53 177.939 177.330 0.609 1
1 589 . 19 1 1 A 53 53 LYS CA C 53 59.012 58.860 0.152 1
1 590 . 19 1 1 A 53 53 LYS CB C 53 32.438 31.714 0.724 1
1 594 . 19 1 1 A 53 53 LYS N N 53 120.057 117.823 2.234 1
1 595 . 19 1 1 A 54 54 ALA H H 54 7.764 7.482 0.282 1
1 596 . 19 1 1 A 54 54 ALA HA H 54 4.400 4.290 0.110 1
1 600 . 19 1 1 A 54 54 ALA C C 54 177.658 178.191 -0.533 1
1 601 . 19 1 1 A 54 54 ALA CA C 54 52.412 51.690 0.722 1
1 602 . 19 1 1 A 54 54 ALA CB C 54 20.739 18.304 2.435 1
1 603 . 19 1 1 A 54 54 ALA N N 54 117.678 120.648 -2.970 1
1 604 . 19 1 1 A 55 55 GLY H H 55 7.583 7.769 -0.186 1
1 605 . 19 1 1 A 55 55 GLY HA2 H 55 4.266 3.904 0.362 1
1 606 . 19 1 1 A 55 55 GLY HA3 H 55 3.775 3.905 -0.130 1
1 607 . 19 1 1 A 55 55 GLY C C 55 175.232 174.381 0.851 1
1 608 . 19 1 1 A 55 55 GLY CA C 55 45.368 46.631 -1.263 1
1 609 . 19 1 1 A 55 55 GLY N N 55 103.265 107.476 -4.211 1
1 610 . 19 1 1 A 56 56 LEU H H 56 7.280 7.530 -0.250 1
1 611 . 19 1 1 A 56 56 LEU HA H 56 3.984 4.642 -0.658 1
1 621 . 19 1 1 A 56 56 LEU C C 56 174.708 175.587 -0.879 1
1 622 . 19 1 1 A 56 56 LEU CA C 56 55.603 54.122 1.481 1
1 623 . 19 1 1 A 56 56 LEU CB C 56 42.752 42.427 0.325 1
1 627 . 19 1 1 A 56 56 LEU N N 56 119.211 123.022 -3.811 1
1 628 . 19 1 1 A 57 57 LEU H H 57 8.693 8.205 0.488 1
1 629 . 19 1 1 A 57 57 LEU HA H 57 4.499 5.062 -0.563 1
1 639 . 19 1 1 A 57 57 LEU C C 57 176.124 175.888 0.236 1
1 640 . 19 1 1 A 57 57 LEU CA C 57 52.959 52.745 0.214 1
1 641 . 19 1 1 A 57 57 LEU CB C 57 45.122 44.821 0.301 1
1 645 . 19 1 1 A 57 57 LEU N N 57 121.969 122.626 -0.657 1
1 646 . 19 1 1 A 58 58 ASP H H 58 8.334 8.691 -0.357 1
1 647 . 19 1 1 A 58 58 ASP HA H 58 4.139 4.715 -0.576 1
1 650 . 19 1 1 A 58 58 ASP C C 58 178.636 176.763 1.873 1
1 651 . 19 1 1 A 58 58 ASP CA C 58 56.079 55.277 0.802 1
1 652 . 19 1 1 A 58 58 ASP CB C 58 42.135 40.359 1.776 1
1 653 . 19 1 1 A 58 58 ASP N N 58 120.401 120.194 0.207 1
1 654 . 19 1 1 A 59 59 GLY H H 59 9.378 8.750 0.628 1
1 655 . 19 1 1 A 59 59 GLY HA2 H 59 4.317 3.987 0.330 1
1 656 . 19 1 1 A 59 59 GLY HA3 H 59 3.260 3.988 -0.728 1
1 657 . 19 1 1 A 59 59 GLY C C 59 173.359 173.999 -0.640 1
1 658 . 19 1 1 A 59 59 GLY CA C 59 45.517 45.058 0.459 1
1 659 . 19 1 1 A 59 59 GLY N N 59 116.622 112.032 4.590 1
1 660 . 19 1 1 A 60 60 ASP H H 60 8.009 7.569 0.440 1
1 661 . 19 1 1 A 60 60 ASP HA H 60 4.638 4.540 0.098 1
1 664 . 19 1 1 A 60 60 ASP C C 60 175.555 174.953 0.602 1
1 665 . 19 1 1 A 60 60 ASP CA C 60 55.286 55.312 -0.026 1
1 666 . 19 1 1 A 60 60 ASP CB C 60 42.381 41.912 0.469 1
1 667 . 19 1 1 A 60 60 ASP N N 60 121.370 121.934 -0.564 1
1 668 . 19 1 1 A 61 61 ARG H H 61 8.648 8.777 -0.129 1
1 669 . 19 1 1 A 61 61 ARG HA H 61 5.179 5.335 -0.156 1
1 677 . 19 1 1 A 61 61 ARG C C 61 177.381 174.213 3.168 1
1 678 . 19 1 1 A 61 61 ARG CA C 61 53.704 54.496 -0.792 1
1 679 . 19 1 1 A 61 61 ARG CB C 61 34.017 33.231 0.786 1
1 682 . 19 1 1 A 61 61 ARG N N 61 116.958 122.417 -5.459 1
1 684 . 19 1 1 A 62 62 VAL H H 62 8.247 8.556 -0.309 1
1 685 . 19 1 1 A 62 62 VAL HA H 62 3.806 4.688 -0.882 1
1 693 . 19 1 1 A 62 62 VAL C C 62 174.748 174.799 -0.051 1
1 694 . 19 1 1 A 62 62 VAL CA C 62 63.149 60.812 2.337 1
1 695 . 19 1 1 A 62 62 VAL CB C 62 32.574 32.773 -0.199 1
1 698 . 19 1 1 A 62 62 VAL N N 62 118.546 123.363 -4.817 1
1 699 . 19 1 1 A 63 63 LEU H H 63 9.262 8.843 0.419 1
1 700 . 19 1 1 A 63 63 LEU HA H 63 4.412 4.311 0.101 1
1 710 . 19 1 1 A 63 63 LEU C C 63 177.649 177.317 0.332 1
1 711 . 19 1 1 A 63 63 LEU CA C 63 56.044 56.754 -0.710 1
1 712 . 19 1 1 A 63 63 LEU CB C 63 43.339 42.774 0.565 1
1 716 . 19 1 1 A 63 63 LEU N N 63 125.413 131.286 -5.873 1
1 717 . 19 1 1 A 64 64 ARG H H 64 7.806 7.725 0.081 1
1 718 . 19 1 1 A 64 64 ARG HA H 64 5.704 5.155 0.549 1
1 726 . 19 1 1 A 64 64 ARG C C 64 175.091 174.162 0.929 1
1 727 . 19 1 1 A 64 64 ARG CA C 64 54.148 54.738 -0.590 1
1 728 . 19 1 1 A 64 64 ARG CB C 64 35.742 33.886 1.856 1
1 731 . 19 1 1 A 64 64 ARG N N 64 112.961 117.273 -4.312 1
1 733 . 19 1 1 A 65 65 ILE H H 65 8.327 9.207 -0.880 1
1 734 . 19 1 1 A 65 65 ILE HA H 65 4.384 4.629 -0.245 1
1 744 . 19 1 1 A 65 65 ILE C C 65 175.722 175.666 0.056 1
1 745 . 19 1 1 A 65 65 ILE CA C 65 60.501 59.543 0.958 1
1 746 . 19 1 1 A 65 65 ILE CB C 65 39.547 40.160 -0.613 1
1 750 . 19 1 1 A 65 65 ILE N N 65 119.175 124.435 -5.260 1
1 751 . 19 1 1 A 66 66 ASN H H 66 9.911 9.273 0.638 1
1 752 . 19 1 1 A 66 66 ASN HA H 66 4.428 4.390 0.038 1
1 757 . 19 1 1 A 66 66 ASN C C 66 175.349 174.658 0.691 1
1 758 . 19 1 1 A 66 66 ASN CA C 66 54.157 54.280 -0.123 1
1 759 . 19 1 1 A 66 66 ASN CB C 66 37.024 37.528 -0.504 1
1 760 . 19 1 1 A 66 66 ASN N N 66 128.952 128.180 0.772 1
1 762 . 19 1 1 A 67 67 GLY H H 67 9.230 8.676 0.554 1
1 763 . 19 1 1 A 67 67 GLY HA2 H 67 4.322 3.978 0.344 1
1 764 . 19 1 1 A 67 67 GLY HA3 H 67 3.508 3.987 -0.479 1
1 765 . 19 1 1 A 67 67 GLY C C 67 174.393 173.925 0.468 1
1 766 . 19 1 1 A 67 67 GLY CA C 67 45.341 46.539 -1.198 1
1 767 . 19 1 1 A 67 67 GLY N N 67 103.238 104.565 -1.327 1
1 768 . 19 1 1 A 68 68 VAL H H 68 8.063 7.739 0.324 1
1 769 . 19 1 1 A 68 68 VAL HA H 68 4.015 4.664 -0.649 1
1 777 . 19 1 1 A 68 68 VAL C C 68 175.833 174.647 1.186 1
1 778 . 19 1 1 A 68 68 VAL CA C 68 62.603 61.230 1.373 1
1 779 . 19 1 1 A 68 68 VAL CB C 68 32.574 35.687 -3.113 1
1 782 . 19 1 1 A 68 68 VAL N N 68 125.696 119.371 6.325 1
1 783 . 19 1 1 A 69 69 PHE H H 69 9.301 9.157 0.144 1
1 784 . 19 1 1 A 69 69 PHE HA H 69 4.947 4.598 0.349 1
1 792 . 19 1 1 A 69 69 PHE C C 69 177.120 175.824 1.296 1
1 793 . 19 1 1 A 69 69 PHE CA C 69 59.200 58.031 1.169 1
1 794 . 19 1 1 A 69 69 PHE CB C 69 39.320 39.392 -0.072 1
1 800 . 19 1 1 A 69 69 PHE N N 69 128.641 128.595 0.046 1
1 801 . 19 1 1 A 70 70 VAL H H 70 8.312 7.887 0.425 1
1 802 . 19 1 1 A 70 70 VAL HA H 70 4.517 4.498 0.019 1
1 810 . 19 1 1 A 70 70 VAL CA C 70 60.734 60.600 0.134 1
1 811 . 19 1 1 A 70 70 VAL CB C 70 32.976 31.478 1.498 1
1 814 . 19 1 1 A 70 70 VAL N N 70 118.381 120.308 -1.927 1
1 815 . 19 1 1 A 71 71 ASP H H 71 5.373 7.168 -1.795 1
1 816 . 19 1 1 A 71 71 ASP HA H 71 4.413 4.098 0.315 1
1 819 . 19 1 1 A 71 71 ASP C C 71 174.896 178.068 -3.172 1
1 820 . 19 1 1 A 71 71 ASP CA C 71 58.334 57.430 0.904 1
1 821 . 19 1 1 A 71 71 ASP CB C 71 46.097 40.575 5.522 1
1 822 . 19 1 1 A 71 71 ASP N N 71 119.008 122.158 -3.150 1
1 823 . 19 1 1 A 72 72 LYS H H 72 7.874 7.729 0.145 1
1 824 . 19 1 1 A 72 72 LYS HA H 72 4.522 4.190 0.332 1
1 833 . 19 1 1 A 72 72 LYS C C 72 177.209 177.074 0.135 1
1 834 . 19 1 1 A 72 72 LYS CA C 72 54.122 58.081 -3.959 1
1 835 . 19 1 1 A 72 72 LYS CB C 72 31.640 32.537 -0.897 1
1 839 . 19 1 1 A 72 72 LYS N N 72 110.259 118.158 -7.899 1
1 840 . 19 1 1 A 73 73 GLU H H 73 7.421 7.854 -0.433 1
1 841 . 19 1 1 A 73 73 GLU HA H 73 4.401 4.385 0.016 1
1 846 . 19 1 1 A 73 73 GLU C C 73 176.728 176.200 0.528 1
1 847 . 19 1 1 A 73 73 GLU CA C 73 54.950 56.994 -2.044 1
1 848 . 19 1 1 A 73 73 GLU CB C 73 30.390 30.630 -0.240 1
1 850 . 19 1 1 A 73 73 GLU N N 73 120.043 119.204 0.839 1
1 851 . 19 1 1 A 74 74 GLU H H 74 9.360 8.953 0.407 1
1 852 . 19 1 1 A 74 74 GLU HA H 74 4.403 4.634 -0.231 1
1 857 . 19 1 1 A 74 74 GLU C C 74 178.234 178.180 0.054 1
1 858 . 19 1 1 A 74 74 GLU CA C 74 56.516 55.326 1.190 1
1 859 . 19 1 1 A 74 74 GLU CB C 74 30.390 31.223 -0.833 1
1 861 . 19 1 1 A 74 74 GLU N N 74 122.193 121.454 0.739 1
1 862 . 19 1 1 A 75 75 HIS H H 75 9.553 9.337 0.216 1
1 863 . 19 1 1 A 75 75 HIS HA H 75 4.080 3.870 0.210 1
1 868 . 19 1 1 A 75 75 HIS C C 75 175.985 176.828 -0.843 1
1 869 . 19 1 1 A 75 75 HIS CA C 75 61.016 60.273 0.743 1
1 870 . 19 1 1 A 75 75 HIS CB C 75 29.468 30.211 -0.743 1
1 873 . 19 1 1 A 75 75 HIS N N 75 123.587 123.103 0.484 1
1 874 . 19 1 1 A 76 76 ALA H H 76 9.129 8.255 0.874 1
1 875 . 19 1 1 A 76 76 ALA HA H 76 3.826 3.866 -0.040 1
1 879 . 19 1 1 A 76 76 ALA C C 76 180.475 178.968 1.507 1
1 880 . 19 1 1 A 76 76 ALA CA C 76 55.392 54.492 0.900 1
1 881 . 19 1 1 A 76 76 ALA CB C 76 18.182 18.188 -0.006 1
1 882 . 19 1 1 A 76 76 ALA N N 76 117.795 120.984 -3.189 1
1 883 . 19 1 1 A 77 77 GLN H H 77 7.099 7.727 -0.628 1
1 884 . 19 1 1 A 77 77 GLN HA H 77 4.198 4.250 -0.052 1
1 891 . 19 1 1 A 77 77 GLN C C 77 177.860 178.585 -0.725 1
1 892 . 19 1 1 A 77 77 GLN CA C 77 57.790 58.273 -0.483 1
1 893 . 19 1 1 A 77 77 GLN CB C 77 28.536 29.219 -0.683 1
1 895 . 19 1 1 A 77 77 GLN N N 77 115.764 116.716 -0.952 1
1 897 . 19 1 1 A 78 78 VAL H H 78 7.430 7.705 -0.275 1
1 898 . 19 1 1 A 78 78 VAL HA H 78 3.241 3.562 -0.321 1
1 906 . 19 1 1 A 78 78 VAL C C 78 177.042 178.012 -0.970 1
1 907 . 19 1 1 A 78 78 VAL CA C 78 67.299 66.434 0.865 1
1 908 . 19 1 1 A 78 78 VAL CB C 78 30.819 31.385 -0.566 1
1 911 . 19 1 1 A 78 78 VAL N N 78 121.143 120.349 0.794 1
1 912 . 19 1 1 A 79 79 VAL H H 79 7.773 8.037 -0.264 1
1 913 . 19 1 1 A 79 79 VAL HA H 79 3.315 3.714 -0.399 1
1 921 . 19 1 1 A 79 79 VAL C C 79 179.179 177.168 2.011 1
1 922 . 19 1 1 A 79 79 VAL CA C 79 66.694 64.875 1.819 1
1 923 . 19 1 1 A 79 79 VAL CB C 79 31.841 31.021 0.820 1
1 926 . 19 1 1 A 79 79 VAL N N 79 117.473 119.591 -2.118 1
1 927 . 19 1 1 A 80 80 GLU H H 80 7.410 7.801 -0.391 1
1 928 . 19 1 1 A 80 80 GLU HA H 80 4.258 4.062 0.196 1
1 933 . 19 1 1 A 80 80 GLU C C 80 178.018 179.009 -0.991 1
1 934 . 19 1 1 A 80 80 GLU CA C 80 58.566 58.542 0.024 1
1 935 . 19 1 1 A 80 80 GLU CB C 80 29.072 29.908 -0.836 1
1 937 . 19 1 1 A 80 80 GLU N N 80 120.451 121.125 -0.674 1
1 938 . 19 1 1 A 81 81 LEU H H 81 8.070 7.813 0.257 1
1 939 . 19 1 1 A 81 81 LEU HA H 81 3.976 4.040 -0.064 1
1 949 . 19 1 1 A 81 81 LEU C C 81 180.658 179.704 0.954 1
1 950 . 19 1 1 A 81 81 LEU CA C 81 58.061 58.061 0.000 1
1 951 . 19 1 1 A 81 81 LEU CB C 81 42.115 41.494 0.621 1
1 955 . 19 1 1 A 81 81 LEU N N 81 119.943 119.742 0.201 1
1 956 . 19 1 1 A 82 82 VAL H H 82 7.609 7.949 -0.340 1
1 957 . 19 1 1 A 82 82 VAL HA H 82 3.474 3.925 -0.451 1
1 965 . 19 1 1 A 82 82 VAL C C 82 178.927 178.110 0.817 1
1 966 . 19 1 1 A 82 82 VAL CA C 82 67.398 66.822 0.576 1
1 967 . 19 1 1 A 82 82 VAL CB C 82 31.306 31.303 0.003 1
1 970 . 19 1 1 A 82 82 VAL N N 82 118.150 120.195 -2.045 1
1 971 . 19 1 1 A 83 83 ARG H H 83 8.186 8.214 -0.028 1
1 972 . 19 1 1 A 83 83 ARG HA H 83 3.994 4.063 -0.069 1
1 979 . 19 1 1 A 83 83 ARG C C 83 179.999 178.487 1.512 1
1 980 . 19 1 1 A 83 83 ARG CA C 83 60.205 59.869 0.336 1
1 981 . 19 1 1 A 83 83 ARG CB C 83 30.103 29.821 0.282 1
1 984 . 19 1 1 A 83 83 ARG N N 83 122.902 120.194 2.708 1
1 985 . 19 1 1 A 84 84 LYS H H 84 8.772 7.828 0.944 1
1 986 . 19 1 1 A 84 84 LYS HA H 84 4.047 4.080 -0.033 1
1 995 . 19 1 1 A 84 84 LYS C C 84 176.934 178.572 -1.638 1
1 996 . 19 1 1 A 84 84 LYS CA C 84 58.142 59.052 -0.910 1
1 997 . 19 1 1 A 84 84 LYS CB C 84 32.492 32.328 0.164 1
1 1001 . 19 1 1 A 84 84 LYS N N 84 117.548 118.561 -1.013 1
1 1002 . 19 1 1 A 85 85 SER H H 85 7.333 7.554 -0.221 1
1 1003 . 19 1 1 A 85 85 SER HA H 85 4.235 4.280 -0.045 1
1 1006 . 19 1 1 A 85 85 SER C C 85 175.588 175.211 0.377 1
1 1007 . 19 1 1 A 85 85 SER CA C 85 59.535 61.574 -2.039 1
1 1008 . 19 1 1 A 85 85 SER CB C 85 63.571 63.807 -0.236 1
1 1009 . 19 1 1 A 85 85 SER N N 85 113.544 115.754 -2.210 1
1 1010 . 19 1 1 A 86 86 GLY H H 86 7.459 7.527 -0.068 1
1 1011 . 19 1 1 A 86 86 GLY HA2 H 86 4.176 4.116 0.060 1
1 1012 . 19 1 1 A 86 86 GLY HA3 H 86 3.762 4.125 -0.363 1
1 1013 . 19 1 1 A 86 86 GLY C C 86 176.407 175.271 1.136 1
1 1014 . 19 1 1 A 86 86 GLY CA C 86 46.109 44.106 2.003 1
1 1015 . 19 1 1 A 86 86 GLY N N 86 104.331 107.050 -2.719 1
1 1016 . 19 1 1 A 87 87 ASN HA H 87 4.650 4.715 -0.065 1
1 1021 . 19 1 1 A 87 87 ASN C C 87 173.653 175.295 -1.642 1
1 1022 . 19 1 1 A 87 87 ASN CA C 87 54.492 53.776 0.716 1
1 1023 . 19 1 1 A 87 87 ASN CB C 87 38.425 39.103 -0.678 1
1 1024 . 19 1 1 A 87 87 ASN N N 87 118.401 124.323 -5.922 1
1 1026 . 19 1 1 A 88 88 SER H H 88 7.435 8.148 -0.713 1
1 1027 . 19 1 1 A 88 88 SER HA H 88 5.438 5.558 -0.120 1
1 1030 . 19 1 1 A 88 88 SER C C 88 172.867 173.536 -0.669 1
1 1031 . 19 1 1 A 88 88 SER CA C 88 58.160 56.638 1.522 1
1 1032 . 19 1 1 A 88 88 SER CB C 88 65.861 65.559 0.302 1
1 1033 . 19 1 1 A 88 88 SER N N 88 113.765 113.160 0.605 1
1 1034 . 19 1 1 A 89 89 VAL H H 89 8.452 8.799 -0.347 1
1 1035 . 19 1 1 A 89 89 VAL HA H 89 4.519 4.795 -0.276 1
1 1043 . 19 1 1 A 89 89 VAL C C 89 171.391 174.763 -3.372 1
1 1044 . 19 1 1 A 89 89 VAL CA C 89 61.333 60.871 0.462 1
1 1045 . 19 1 1 A 89 89 VAL CB C 89 33.897 35.697 -1.800 1
1 1048 . 19 1 1 A 89 89 VAL N N 89 120.001 123.487 -3.486 1
1 1049 . 19 1 1 A 90 90 THR H H 90 8.348 8.897 -0.549 1
1 1050 . 19 1 1 A 90 90 THR HA H 90 5.042 4.898 0.144 1
1 1055 . 19 1 1 A 90 90 THR C C 90 173.926 173.813 0.113 1
1 1056 . 19 1 1 A 90 90 THR CA C 90 61.403 62.075 -0.672 1
1 1057 . 19 1 1 A 90 90 THR CB C 90 69.553 69.306 0.247 1
1 1059 . 19 1 1 A 90 90 THR N N 90 123.477 123.678 -0.201 1
1 1060 . 19 1 1 A 91 91 LEU H H 91 9.195 8.791 0.404 1
1 1061 . 19 1 1 A 91 91 LEU HA H 91 5.161 5.207 -0.046 1
1 1071 . 19 1 1 A 91 91 LEU C C 91 174.564 175.420 -0.856 1
1 1072 . 19 1 1 A 91 91 LEU CA C 91 52.590 53.203 -0.613 1
1 1073 . 19 1 1 A 91 91 LEU CB C 91 44.998 44.504 0.494 1
1 1077 . 19 1 1 A 91 91 LEU N N 91 128.419 127.902 0.517 1
1 1078 . 19 1 1 A 92 92 LEU H H 92 8.644 8.618 0.026 1
1 1079 . 19 1 1 A 92 92 LEU HA H 92 5.335 5.213 0.122 1
1 1089 . 19 1 1 A 92 92 LEU C C 92 176.451 175.383 1.068 1
1 1090 . 19 1 1 A 92 92 LEU CA C 92 54.220 53.883 0.337 1
1 1091 . 19 1 1 A 92 92 LEU CB C 92 44.323 43.291 1.032 1
1 1095 . 19 1 1 A 92 92 LEU N N 92 125.894 124.275 1.619 1
1 1096 . 19 1 1 A 93 93 VAL H H 93 9.249 8.911 0.338 1
1 1097 . 19 1 1 A 93 93 VAL HA H 93 5.573 5.335 0.238 1
1 1105 . 19 1 1 A 93 93 VAL C C 93 173.550 174.240 -0.690 1
1 1106 . 19 1 1 A 93 93 VAL CA C 93 58.340 60.609 -2.269 1
1 1107 . 19 1 1 A 93 93 VAL CB C 93 36.159 33.926 2.233 1
1 1110 . 19 1 1 A 93 93 VAL N N 93 120.660 120.912 -0.252 1
1 1111 . 19 1 1 A 94 94 LEU H H 94 8.634 8.556 0.078 1
1 1112 . 19 1 1 A 94 94 LEU HA H 94 4.911 5.046 -0.135 1
1 1122 . 19 1 1 A 94 94 LEU C C 94 174.172 176.212 -2.040 1
1 1123 . 19 1 1 A 94 94 LEU CA C 94 52.659 53.245 -0.586 1
1 1124 . 19 1 1 A 94 94 LEU CB C 94 47.910 44.784 3.126 1
1 1128 . 19 1 1 A 94 94 LEU N N 94 120.304 128.005 -7.701 1
1 1129 . 19 1 1 A 95 95 ASP H H 95 8.210 8.778 -0.568 1
1 1130 . 19 1 1 A 95 95 ASP HA H 95 5.190 4.552 0.638 1
1 1133 . 19 1 1 A 95 95 ASP C C 95 175.887 177.994 -2.107 1
1 1134 . 19 1 1 A 95 95 ASP CA C 95 53.899 54.861 -0.962 1
1 1135 . 19 1 1 A 95 95 ASP CB C 95 41.188 40.839 0.349 1
1 1136 . 19 1 1 A 95 95 ASP N N 95 122.184 124.998 -2.814 1
1 1137 . 19 1 1 A 96 96 GLY H H 96 8.478 8.844 -0.366 1
1 1138 . 19 1 1 A 96 96 GLY HA2 H 96 4.002 3.798 0.204 1
1 1139 . 19 1 1 A 96 96 GLY HA3 H 96 3.757 3.803 -0.046 1
1 1140 . 19 1 1 A 96 96 GLY C C 96 175.497 175.249 0.248 1
1 1141 . 19 1 1 A 96 96 GLY CA C 96 49.944 47.404 2.540 1
1 1142 . 19 1 1 A 96 96 GLY N N 96 108.610 110.892 -2.282 1
1 1143 . 19 1 1 A 97 97 ASP H H 97 8.401 8.165 0.236 1
1 1144 . 19 1 1 A 97 97 ASP HA H 97 4.454 4.386 0.068 1
1 1147 . 19 1 1 A 97 97 ASP C C 97 179.612 178.452 1.160 1
1 1148 . 19 1 1 A 97 97 ASP CA C 97 57.913 57.012 0.901 1
1 1149 . 19 1 1 A 97 97 ASP CB C 97 41.145 40.817 0.328 1
1 1150 . 19 1 1 A 97 97 ASP N N 97 120.034 121.719 -1.685 1
1 1151 . 19 1 1 A 98 98 SER H H 98 8.152 8.210 -0.058 1
1 1152 . 19 1 1 A 98 98 SER HA H 98 4.218 4.171 0.047 1
1 1155 . 19 1 1 A 98 98 SER C C 98 175.061 175.363 -0.302 1
1 1156 . 19 1 1 A 98 98 SER CA C 98 62.180 62.245 -0.065 1
1 1157 . 19 1 1 A 98 98 SER CB C 98 62.179 63.246 -1.067 1
1 1158 . 19 1 1 A 98 98 SER N N 98 117.174 115.749 1.425 1
1 1159 . 19 1 1 A 99 99 TYR H H 99 9.051 8.147 0.904 1
1 1160 . 19 1 1 A 99 99 TYR HA H 99 3.692 3.842 -0.150 1
1 1167 . 19 1 1 A 99 99 TYR C C 99 176.460 176.901 -0.441 1
1 1168 . 19 1 1 A 99 99 TYR CA C 99 62.814 61.455 1.359 1
1 1169 . 19 1 1 A 99 99 TYR CB C 99 38.829 38.577 0.252 1
1 1174 . 19 1 1 A 99 99 TYR N N 99 123.539 122.257 1.282 1
1 1175 . 19 1 1 A 100 100 GLU H H 100 8.520 8.829 -0.309 1
1 1176 . 19 1 1 A 100 100 GLU HA H 100 3.952 4.039 -0.087 1
1 1181 . 19 1 1 A 100 100 GLU C C 100 180.151 179.182 0.969 1
1 1182 . 19 1 1 A 100 100 GLU CA C 100 60.099 59.988 0.111 1
1 1183 . 19 1 1 A 100 100 GLU CB C 100 29.435 29.344 0.091 1
1 1185 . 19 1 1 A 100 100 GLU N N 100 117.082 118.538 -1.456 1
1 1186 . 19 1 1 A 101 101 LYS H H 101 7.740 8.231 -0.491 1
1 1187 . 19 1 1 A 101 101 LYS HA H 101 3.984 4.096 -0.112 1
1 1196 . 19 1 1 A 101 101 LYS C C 101 178.377 178.745 -0.368 1
1 1197 . 19 1 1 A 101 101 LYS CA C 101 59.888 59.367 0.521 1
1 1198 . 19 1 1 A 101 101 LYS CB C 101 32.821 32.348 0.473 1
1 1202 . 19 1 1 A 101 101 LYS N N 101 119.851 121.066 -1.215 1
1 1203 . 19 1 1 A 102 102 ALA H H 102 8.538 7.567 0.971 1
1 1204 . 19 1 1 A 102 102 ALA HA H 102 3.632 4.202 -0.570 1
1 1208 . 19 1 1 A 102 102 ALA C C 102 179.870 179.745 0.125 1
1 1209 . 19 1 1 A 102 102 ALA CA C 102 55.285 55.220 0.065 1
1 1210 . 19 1 1 A 102 102 ALA CB C 102 17.163 18.866 -1.703 1
1 1211 . 19 1 1 A 102 102 ALA N N 102 124.176 121.944 2.232 1
1 1212 . 19 1 1 A 103 103 VAL H H 103 8.147 7.868 0.279 1
1 1213 . 19 1 1 A 103 103 VAL HA H 103 3.658 3.767 -0.109 1
1 1221 . 19 1 1 A 103 103 VAL C C 103 181.113 177.896 3.217 1
1 1222 . 19 1 1 A 103 103 VAL CA C 103 66.090 65.508 0.582 1
1 1223 . 19 1 1 A 103 103 VAL CB C 103 31.822 31.508 0.314 1
1 1226 . 19 1 1 A 103 103 VAL N N 103 117.841 117.242 0.599 1
1 1227 . 19 1 1 A 104 104 LYS H H 104 7.903 7.925 -0.022 1
1 1228 . 19 1 1 A 104 104 LYS HA H 104 4.065 4.029 0.036 1
1 1235 . 19 1 1 A 104 104 LYS C C 104 177.715 178.062 -0.347 1
1 1236 . 19 1 1 A 104 104 LYS CA C 104 59.094 58.986 0.108 1
1 1237 . 19 1 1 A 104 104 LYS CB C 104 32.285 32.303 -0.018 1
1 1241 . 19 1 1 A 104 104 LYS N N 104 121.515 121.360 0.155 1
1 1242 . 19 1 1 A 105 105 ASN H H 105 7.747 8.175 -0.428 1
1 1243 . 19 1 1 A 105 105 ASN HA H 105 4.721 4.866 -0.145 1
1 1248 . 19 1 1 A 105 105 ASN C C 105 173.320 174.001 -0.681 1
1 1249 . 19 1 1 A 105 105 ASN CA C 105 53.399 53.009 0.390 1
1 1250 . 19 1 1 A 105 105 ASN CB C 105 39.249 38.587 0.662 1
1 1251 . 19 1 1 A 105 105 ASN N N 105 114.941 114.510 0.431 1
1 1253 . 19 1 1 A 106 106 GLN H H 106 7.850 7.665 0.185 1
1 1254 . 19 1 1 A 106 106 GLN HA H 106 3.902 3.868 0.034 1
1 1261 . 19 1 1 A 106 106 GLN C C 106 175.168 175.094 0.074 1
1 1262 . 19 1 1 A 106 106 GLN CA C 106 56.978 56.807 0.171 1
1 1263 . 19 1 1 A 106 106 GLN CB C 106 25.770 26.505 -0.735 1
1 1265 . 19 1 1 A 106 106 GLN N N 106 114.989 115.733 -0.744 1
1 1267 . 19 1 1 A 107 107 VAL H H 107 8.005 7.775 0.230 1
1 1268 . 19 1 1 A 107 107 VAL HA H 107 3.664 4.026 -0.362 1
1 1276 . 19 1 1 A 107 107 VAL C C 107 175.468 175.120 0.348 1
1 1277 . 19 1 1 A 107 107 VAL CA C 107 62.726 63.084 -0.358 1
1 1278 . 19 1 1 A 107 107 VAL CB C 107 32.535 32.200 0.335 1
1 1281 . 19 1 1 A 107 107 VAL N N 107 120.216 120.066 0.150 1
1 1282 . 19 1 1 A 108 108 ASP H H 108 8.484 8.633 -0.149 1
1 1283 . 19 1 1 A 108 108 ASP HA H 108 4.467 4.651 -0.184 1
1 1286 . 19 1 1 A 108 108 ASP C C 108 177.179 176.104 1.075 1
1 1287 . 19 1 1 A 108 108 ASP CA C 108 53.417 54.941 -1.524 1
1 1288 . 19 1 1 A 108 108 ASP CB C 108 40.030 41.161 -1.131 1
1 1289 . 19 1 1 A 108 108 ASP N N 108 125.414 125.788 -0.374 1
1 1290 . 19 1 1 A 109 109 LEU H H 109 8.470 8.340 0.130 1
1 1291 . 19 1 1 A 109 109 LEU HA H 109 3.846 4.357 -0.511 1
1 1301 . 19 1 1 A 109 109 LEU C C 109 178.145 178.313 -0.168 1
1 1302 . 19 1 1 A 109 109 LEU CA C 109 56.573 55.906 0.667 1
1 1303 . 19 1 1 A 109 109 LEU CB C 109 42.011 41.940 0.071 1
1 1307 . 19 1 1 A 109 109 LEU N N 109 127.577 125.133 2.444 1
1 1308 . 19 1 1 A 110 110 LYS H H 110 8.062 7.875 0.187 1
1 1309 . 19 1 1 A 110 110 LYS HA H 110 3.022 3.436 -0.414 1
1 1317 . 19 1 1 A 110 110 LYS C C 110 177.248 179.337 -2.089 1
1 1318 . 19 1 1 A 110 110 LYS CA C 110 58.742 59.650 -0.908 1
1 1319 . 19 1 1 A 110 110 LYS CB C 110 31.667 31.873 -0.206 1
1 1323 . 19 1 1 A 110 110 LYS N N 110 118.873 119.829 -0.956 1
1 1324 . 19 1 1 A 111 111 GLU H H 111 7.113 8.360 -1.247 1
1 1325 . 19 1 1 A 111 111 GLU HA H 111 4.117 4.081 0.036 1
1 1330 . 19 1 1 A 111 111 GLU C C 111 176.519 176.980 -0.461 1
1 1331 . 19 1 1 A 111 111 GLU CA C 111 55.621 59.066 -3.445 1
1 1332 . 19 1 1 A 111 111 GLU CB C 111 29.943 28.973 0.970 1
1 1334 . 19 1 1 A 111 111 GLU N N 111 114.282 117.449 -3.167 1
1 1335 . 19 1 1 A 112 112 LEU H H 112 6.848 7.522 -0.674 1
1 1336 . 19 1 1 A 112 112 LEU HA H 112 4.293 4.147 0.146 1
1 1346 . 19 1 1 A 112 112 LEU C C 112 175.674 176.342 -0.668 1
1 1347 . 19 1 1 A 112 112 LEU CA C 112 55.197 56.026 -0.829 1
1 1348 . 19 1 1 A 112 112 LEU CB C 112 41.681 41.962 -0.281 1
1 1352 . 19 1 1 A 112 112 LEU N N 112 118.934 122.764 -3.830 1
1 1353 . 19 1 1 A 113 113 ASP H H 113 8.466 8.470 -0.004 1
1 1354 . 19 1 1 A 113 113 ASP HA H 113 4.593 5.242 -0.649 1
1 1357 . 19 1 1 A 113 113 ASP C C 113 174.511 175.067 -0.556 1
1 1358 . 19 1 1 A 113 113 ASP CA C 113 53.558 53.477 0.081 1
1 1359 . 19 1 1 A 113 113 ASP CB C 113 42.448 43.315 -0.867 1
1 1360 . 19 1 1 A 113 113 ASP N N 113 122.148 122.667 -0.519 1
1 1 . 20 1 1 A 6 6 SER HA H 6 4.483 4.917 -0.434 1
1 4 . 20 1 1 A 6 6 SER C C 6 175.167 173.064 2.103 1
1 5 . 20 1 1 A 6 6 SER CA C 6 58.759 57.703 1.056 1
1 6 . 20 1 1 A 6 6 SER CB C 6 64.069 67.559 -3.490 1
1 7 . 20 1 1 A 7 7 GLY H H 7 8.431 8.728 -0.297 1
1 8 . 20 1 1 A 7 7 GLY HA2 H 7 3.973 3.840 0.133 1
1 9 . 20 1 1 A 7 7 GLY HA3 H 7 3.973 3.841 0.132 1
1 10 . 20 1 1 A 7 7 GLY C C 7 174.570 173.011 1.559 1
1 11 . 20 1 1 A 7 7 GLY CA C 7 45.483 46.663 -1.180 1
1 12 . 20 1 1 A 7 7 GLY N N 7 110.640 110.277 0.363 1
1 13 . 20 1 1 A 8 8 MET H H 8 8.239 7.821 0.418 1
1 14 . 20 1 1 A 8 8 MET HA H 8 4.386 5.114 -0.728 1
1 22 . 20 1 1 A 8 8 MET C C 8 176.621 174.707 1.914 1
1 23 . 20 1 1 A 8 8 MET CA C 8 55.991 54.508 1.483 1
1 24 . 20 1 1 A 8 8 MET CB C 8 32.986 35.979 -2.993 1
1 27 . 20 1 1 A 8 8 MET N N 8 120.219 121.315 -1.096 1
1 28 . 20 1 1 A 9 9 ALA H H 9 8.435 8.719 -0.284 1
1 29 . 20 1 1 A 9 9 ALA HA H 9 4.182 4.416 -0.234 1
1 33 . 20 1 1 A 9 9 ALA C C 9 177.951 177.103 0.848 1
1 34 . 20 1 1 A 9 9 ALA CA C 9 53.399 51.519 1.880 1
1 35 . 20 1 1 A 9 9 ALA CB C 9 18.955 20.463 -1.508 1
1 36 . 20 1 1 A 9 9 ALA N N 9 124.459 127.261 -2.802 1
1 37 . 20 1 1 A 10 10 SER H H 10 8.100 8.593 -0.493 1
1 38 . 20 1 1 A 10 10 SER HA H 10 4.391 4.824 -0.433 1
1 41 . 20 1 1 A 10 10 SER C C 10 174.467 173.532 0.935 1
1 42 . 20 1 1 A 10 10 SER CA C 10 58.709 57.543 1.166 1
1 43 . 20 1 1 A 10 10 SER CB C 10 63.778 64.757 -0.979 1
1 44 . 20 1 1 A 10 10 SER N N 10 113.881 116.601 -2.720 1
1 45 . 20 1 1 A 11 11 THR H H 11 7.821 8.463 -0.642 1
1 46 . 20 1 1 A 11 11 THR HA H 11 4.191 4.534 -0.343 1
1 51 . 20 1 1 A 11 11 THR C C 11 173.610 172.344 1.266 1
1 52 . 20 1 1 A 11 11 THR CA C 11 61.936 60.708 1.228 1
1 53 . 20 1 1 A 11 11 THR CB C 11 69.713 71.072 -1.359 1
1 55 . 20 1 1 A 11 11 THR N N 11 114.471 116.058 -1.587 1
1 56 . 20 1 1 A 12 12 PHE H H 12 7.946 8.905 -0.959 1
1 57 . 20 1 1 A 12 12 PHE HA H 12 4.769 4.848 -0.079 1
1 65 . 20 1 1 A 12 12 PHE C C 12 174.211 175.653 -1.442 1
1 66 . 20 1 1 A 12 12 PHE CA C 12 56.644 57.880 -1.236 1
1 67 . 20 1 1 A 12 12 PHE CB C 12 40.609 41.104 -0.495 1
1 73 . 20 1 1 A 12 12 PHE N N 12 120.763 124.986 -4.223 1
1 74 . 20 1 1 A 13 13 ASN H H 13 9.004 8.698 0.306 1
1 75 . 20 1 1 A 13 13 ASN HA H 13 5.366 5.408 -0.042 1
1 80 . 20 1 1 A 13 13 ASN C C 13 172.158 173.056 -0.898 1
1 81 . 20 1 1 A 13 13 ASN CA C 13 50.988 49.943 1.045 1
1 82 . 20 1 1 A 13 13 ASN CB C 13 39.942 39.042 0.900 1
1 83 . 20 1 1 A 13 13 ASN N N 13 119.973 119.301 0.672 1
1 85 . 20 1 1 A 14 14 PRO HA H 14 4.945 4.571 0.374 1
1 92 . 20 1 1 A 14 14 PRO C C 14 174.901 175.684 -0.783 1
1 93 . 20 1 1 A 14 14 PRO CA C 14 63.096 62.623 0.473 1
1 94 . 20 1 1 A 14 14 PRO CB C 14 32.739 32.645 0.094 1
1 97 . 20 1 1 A 15 15 ARG H H 15 8.908 8.495 0.413 1
1 98 . 20 1 1 A 15 15 ARG HA H 15 4.626 4.649 -0.023 1
1 106 . 20 1 1 A 15 15 ARG C C 15 174.432 175.286 -0.854 1
1 107 . 20 1 1 A 15 15 ARG CA C 15 54.827 55.079 -0.252 1
1 108 . 20 1 1 A 15 15 ARG CB C 15 32.439 31.892 0.547 1
1 111 . 20 1 1 A 15 15 ARG N N 15 118.947 121.467 -2.520 1
1 113 . 20 1 1 A 16 16 GLU H H 16 8.838 8.927 -0.089 1
1 114 . 20 1 1 A 16 16 GLU HA H 16 4.876 4.627 0.249 1
1 119 . 20 1 1 A 16 16 GLU C C 16 175.767 175.382 0.385 1
1 120 . 20 1 1 A 16 16 GLU CA C 16 55.621 56.959 -1.338 1
1 121 . 20 1 1 A 16 16 GLU CB C 16 31.093 30.389 0.704 1
1 123 . 20 1 1 A 16 16 GLU N N 16 125.316 128.162 -2.846 1
1 124 . 20 1 1 A 17 17 CYS H H 17 9.327 8.932 0.395 1
1 125 . 20 1 1 A 17 17 CYS HA H 17 4.804 5.225 -0.421 1
1 128 . 20 1 1 A 17 17 CYS C C 17 172.973 173.235 -0.262 1
1 129 . 20 1 1 A 17 17 CYS CA C 17 57.930 57.191 0.739 1
1 130 . 20 1 1 A 17 17 CYS CB C 17 30.105 30.442 -0.337 1
1 131 . 20 1 1 A 17 17 CYS N N 17 127.909 123.964 3.945 1
1 132 . 20 1 1 A 18 18 LYS H H 18 9.022 8.789 0.233 1
1 133 . 20 1 1 A 18 18 LYS HA H 18 4.769 4.797 -0.028 1
1 142 . 20 1 1 A 18 18 LYS C C 18 174.586 175.594 -1.008 1
1 143 . 20 1 1 A 18 18 LYS CA C 18 55.956 55.003 0.953 1
1 144 . 20 1 1 A 18 18 LYS CB C 18 32.203 32.561 -0.358 1
1 148 . 20 1 1 A 18 18 LYS N N 18 127.039 125.717 1.322 1
1 149 . 20 1 1 A 19 19 LEU H H 19 8.784 8.528 0.256 1
1 150 . 20 1 1 A 19 19 LEU HA H 19 4.852 4.484 0.368 1
1 160 . 20 1 1 A 19 19 LEU C C 19 176.862 176.661 0.201 1
1 161 . 20 1 1 A 19 19 LEU CA C 19 55.391 54.962 0.429 1
1 162 . 20 1 1 A 19 19 LEU CB C 19 44.442 42.049 2.393 1
1 166 . 20 1 1 A 19 19 LEU N N 19 126.311 126.495 -0.184 1
1 167 . 20 1 1 A 20 20 SER H H 20 8.215 8.981 -0.766 1
1 168 . 20 1 1 A 20 20 SER HA H 20 5.461 5.682 -0.221 1
1 171 . 20 1 1 A 20 20 SER C C 20 171.960 173.715 -1.755 1
1 172 . 20 1 1 A 20 20 SER CA C 20 57.525 56.490 1.035 1
1 173 . 20 1 1 A 20 20 SER CB C 20 65.794 65.517 0.277 1
1 174 . 20 1 1 A 20 20 SER N N 20 115.113 118.276 -3.163 1
1 175 . 20 1 1 A 21 21 LYS H H 21 9.001 9.051 -0.050 1
1 176 . 20 1 1 A 21 21 LYS HA H 21 4.887 4.971 -0.084 1
1 185 . 20 1 1 A 21 21 LYS C C 21 174.133 175.128 -0.995 1
1 186 . 20 1 1 A 21 21 LYS CA C 21 53.840 53.892 -0.052 1
1 187 . 20 1 1 A 21 21 LYS CB C 21 36.553 35.651 0.902 1
1 191 . 20 1 1 A 21 21 LYS N N 21 120.938 121.065 -0.127 1
1 192 . 20 1 1 A 22 22 GLN H H 22 8.201 8.288 -0.087 1
1 193 . 20 1 1 A 22 22 GLN HA H 22 4.448 4.583 -0.135 1
1 200 . 20 1 1 A 22 22 GLN C C 22 176.372 175.626 0.746 1
1 201 . 20 1 1 A 22 22 GLN CA C 22 53.658 54.252 -0.594 1
1 202 . 20 1 1 A 22 22 GLN CB C 22 30.473 30.400 0.073 1
1 204 . 20 1 1 A 22 22 GLN N N 22 116.816 118.761 -1.945 1
1 206 . 20 1 1 A 23 23 GLU H H 23 8.624 8.727 -0.103 1
1 207 . 20 1 1 A 23 23 GLU HA H 23 4.056 3.838 0.218 1
1 212 . 20 1 1 A 23 23 GLU C C 23 177.778 177.315 0.463 1
1 213 . 20 1 1 A 23 23 GLU CA C 23 58.001 58.372 -0.371 1
1 214 . 20 1 1 A 23 23 GLU CB C 23 29.237 29.338 -0.101 1
1 216 . 20 1 1 A 23 23 GLU N N 23 122.364 122.845 -0.481 1
1 217 . 20 1 1 A 24 24 GLY H H 24 8.962 8.952 0.010 1
1 218 . 20 1 1 A 24 24 GLY HA2 H 24 4.139 3.970 0.169 1
1 219 . 20 1 1 A 24 24 GLY HA3 H 24 3.711 3.971 -0.260 1
1 220 . 20 1 1 A 24 24 GLY C C 24 173.857 174.150 -0.293 1
1 221 . 20 1 1 A 24 24 GLY CA C 24 45.288 45.076 0.212 1
1 222 . 20 1 1 A 24 24 GLY N N 24 113.942 114.760 -0.818 1
1 223 . 20 1 1 A 25 25 GLN H H 25 7.643 7.886 -0.243 1
1 224 . 20 1 1 A 25 25 GLN HA H 25 4.488 4.296 0.192 1
1 231 . 20 1 1 A 25 25 GLN C C 25 174.727 175.468 -0.741 1
1 232 . 20 1 1 A 25 25 GLN CA C 25 54.052 55.758 -1.706 1
1 233 . 20 1 1 A 25 25 GLN CB C 25 30.843 30.322 0.521 1
1 235 . 20 1 1 A 25 25 GLN N N 25 119.538 121.503 -1.965 1
1 237 . 20 1 1 A 26 26 ASN H H 26 8.625 9.050 -0.425 1
1 238 . 20 1 1 A 26 26 ASN HA H 26 4.862 4.930 -0.068 1
1 243 . 20 1 1 A 26 26 ASN C C 26 176.261 175.364 0.897 1
1 244 . 20 1 1 A 26 26 ASN CA C 26 51.812 52.280 -0.468 1
1 245 . 20 1 1 A 26 26 ASN CB C 26 40.403 40.003 0.400 1
1 246 . 20 1 1 A 26 26 ASN N N 26 120.047 122.205 -2.158 1
1 248 . 20 1 1 A 27 27 TYR HA H 27 4.152 4.664 -0.512 1
1 255 . 20 1 1 A 27 27 TYR C C 27 176.731 175.812 0.919 1
1 256 . 20 1 1 A 27 27 TYR CA C 27 62.462 59.301 3.161 1
1 257 . 20 1 1 A 27 27 TYR CB C 27 40.240 39.594 0.646 1
1 262 . 20 1 1 A 27 27 TYR N N 27 121.761 120.928 0.833 1
1 263 . 20 1 1 A 28 28 GLY H H 28 8.285 7.862 0.423 1
1 264 . 20 1 1 A 28 28 GLY HA2 H 28 4.490 3.941 0.549 1
1 265 . 20 1 1 A 28 28 GLY HA3 H 28 3.759 4.023 -0.264 1
1 266 . 20 1 1 A 28 28 GLY C C 28 172.198 173.894 -1.696 1
1 267 . 20 1 1 A 28 28 GLY CA C 28 46.139 45.211 0.928 1
1 268 . 20 1 1 A 28 28 GLY N N 28 103.567 107.397 -3.830 1
1 269 . 20 1 1 A 29 29 PHE H H 29 6.878 7.872 -0.994 1
1 270 . 20 1 1 A 29 29 PHE HA H 29 5.179 4.904 0.275 1
1 278 . 20 1 1 A 29 29 PHE C C 29 172.840 173.799 -0.959 1
1 279 . 20 1 1 A 29 29 PHE CA C 29 55.262 54.802 0.460 1
1 280 . 20 1 1 A 29 29 PHE CB C 29 41.779 42.286 -0.507 1
1 286 . 20 1 1 A 29 29 PHE N N 29 111.027 117.442 -6.415 1
1 287 . 20 1 1 A 30 30 PHE H H 30 8.806 8.422 0.384 1
1 288 . 20 1 1 A 30 30 PHE HA H 30 4.923 4.598 0.325 1
1 296 . 20 1 1 A 30 30 PHE C C 30 174.501 174.469 0.032 1
1 297 . 20 1 1 A 30 30 PHE CA C 30 55.356 55.719 -0.363 1
1 298 . 20 1 1 A 30 30 PHE CB C 30 41.681 43.526 -1.845 1
1 304 . 20 1 1 A 30 30 PHE N N 30 118.710 116.850 1.860 1
1 305 . 20 1 1 A 31 31 LEU H H 31 8.441 9.110 -0.669 1
1 306 . 20 1 1 A 31 31 LEU HA H 31 5.447 5.101 0.346 1
1 316 . 20 1 1 A 31 31 LEU C C 31 177.306 176.218 1.088 1
1 317 . 20 1 1 A 31 31 LEU CA C 31 53.610 53.310 0.300 1
1 318 . 20 1 1 A 31 31 LEU CB C 31 43.696 43.008 0.688 1
1 322 . 20 1 1 A 31 31 LEU N N 31 123.765 122.930 0.835 1
1 323 . 20 1 1 A 32 32 ARG H H 32 9.381 9.181 0.200 1
1 324 . 20 1 1 A 32 32 ARG HA H 32 4.840 4.862 -0.022 1
1 331 . 20 1 1 A 32 32 ARG C C 32 175.155 175.744 -0.589 1
1 332 . 20 1 1 A 32 32 ARG CA C 32 54.210 54.325 -0.115 1
1 333 . 20 1 1 A 32 32 ARG CB C 32 35.087 32.473 2.614 1
1 336 . 20 1 1 A 32 32 ARG N N 32 123.160 124.330 -1.170 1
1 337 . 20 1 1 A 33 33 ILE H H 33 7.891 8.633 -0.742 1
1 338 . 20 1 1 A 33 33 ILE HA H 33 4.495 5.006 -0.511 1
1 348 . 20 1 1 A 33 33 ILE C C 33 175.850 174.381 1.469 1
1 349 . 20 1 1 A 33 33 ILE CA C 33 59.641 59.027 0.614 1
1 350 . 20 1 1 A 33 33 ILE CB C 33 39.538 41.794 -2.256 1
1 354 . 20 1 1 A 33 33 ILE N N 33 118.924 117.594 1.330 1
1 355 . 20 1 1 A 34 34 GLU H H 34 8.971 8.824 0.147 1
1 356 . 20 1 1 A 34 34 GLU HA H 34 4.578 4.898 -0.320 1
1 361 . 20 1 1 A 34 34 GLU C C 34 175.766 174.525 1.241 1
1 362 . 20 1 1 A 34 34 GLU CA C 34 54.263 54.314 -0.051 1
1 363 . 20 1 1 A 34 34 GLU CB C 34 32.128 33.801 -1.673 1
1 365 . 20 1 1 A 34 34 GLU N N 34 125.447 122.062 3.385 1
1 366 . 20 1 1 A 35 35 LYS H H 35 8.504 8.565 -0.061 1
1 367 . 20 1 1 A 35 35 LYS HA H 35 4.026 4.363 -0.337 1
1 376 . 20 1 1 A 35 35 LYS C C 35 177.701 176.569 1.132 1
1 377 . 20 1 1 A 35 35 LYS CA C 35 57.591 55.851 1.740 1
1 378 . 20 1 1 A 35 35 LYS CB C 35 32.491 33.797 -1.306 1
1 382 . 20 1 1 A 35 35 LYS N N 35 122.893 123.135 -0.242 1
1 383 . 20 1 1 A 36 36 ASP H H 36 9.020 8.793 0.227 1
1 384 . 20 1 1 A 36 36 ASP HA H 36 4.385 4.155 0.230 1
1 387 . 20 1 1 A 36 36 ASP C C 36 174.554 174.804 -0.250 1
1 388 . 20 1 1 A 36 36 ASP CA C 36 55.868 55.138 0.730 1
1 389 . 20 1 1 A 36 36 ASP CB C 36 39.826 39.669 0.157 1
1 390 . 20 1 1 A 36 36 ASP N N 36 121.412 120.609 0.803 1
1 391 . 20 1 1 A 37 37 THR H H 37 7.464 7.649 -0.185 1
1 392 . 20 1 1 A 37 37 THR HA H 37 4.454 4.972 -0.518 1
1 397 . 20 1 1 A 37 37 THR C C 37 172.012 172.617 -0.605 1
1 398 . 20 1 1 A 37 37 THR CA C 37 61.686 59.947 1.739 1
1 399 . 20 1 1 A 37 37 THR CB C 37 70.927 71.416 -0.489 1
1 401 . 20 1 1 A 37 37 THR N N 37 113.147 108.133 5.014 1
1 402 . 20 1 1 A 38 38 ASP H H 38 8.931 8.698 0.233 1
1 403 . 20 1 1 A 38 38 ASP HA H 38 4.852 5.125 -0.273 1
1 406 . 20 1 1 A 38 38 ASP CA C 38 54.826 52.786 2.040 1
1 407 . 20 1 1 A 38 38 ASP CB C 38 43.332 43.065 0.267 1
1 408 . 20 1 1 A 38 38 ASP N N 38 120.401 121.554 -1.153 1
1 409 . 20 1 1 A 39 39 GLY H H 39 8.068 8.335 -0.267 1
1 410 . 20 1 1 A 39 39 GLY HA2 H 39 3.774 3.865 -0.091 1
1 411 . 20 1 1 A 39 39 GLY HA3 H 39 3.555 3.980 -0.425 1
1 412 . 20 1 1 A 39 39 GLY C C 39 172.578 173.097 -0.519 1
1 413 . 20 1 1 A 39 39 GLY CA C 39 43.967 45.940 -1.973 1
1 414 . 20 1 1 A 39 39 GLY N N 39 107.925 114.639 -6.714 1
1 415 . 20 1 1 A 40 40 HIS H H 40 9.111 8.416 0.695 1
1 416 . 20 1 1 A 40 40 HIS HA H 40 4.650 5.315 -0.665 1
1 421 . 20 1 1 A 40 40 HIS C C 40 174.330 174.533 -0.203 1
1 422 . 20 1 1 A 40 40 HIS CA C 40 55.886 54.402 1.484 1
1 423 . 20 1 1 A 40 40 HIS CB C 40 30.507 33.077 -2.570 1
1 426 . 20 1 1 A 40 40 HIS N N 40 119.179 120.569 -1.390 1
1 427 . 20 1 1 A 41 41 LEU H H 41 8.254 8.442 -0.188 1
1 428 . 20 1 1 A 41 41 LEU HA H 41 4.626 4.597 0.029 1
1 438 . 20 1 1 A 41 41 LEU C C 41 176.035 176.275 -0.240 1
1 439 . 20 1 1 A 41 41 LEU CA C 41 55.621 54.276 1.345 1
1 440 . 20 1 1 A 41 41 LEU CB C 41 45.091 42.651 2.440 1
1 444 . 20 1 1 A 41 41 LEU N N 41 124.808 124.088 0.720 1
1 445 . 20 1 1 A 42 42 ILE H H 42 8.685 8.217 0.468 1
1 446 . 20 1 1 A 42 42 ILE HA H 42 4.578 5.379 -0.801 1
1 456 . 20 1 1 A 42 42 ILE C C 42 175.369 175.148 0.221 1
1 457 . 20 1 1 A 42 42 ILE CA C 42 59.852 59.800 0.052 1
1 458 . 20 1 1 A 42 42 ILE CB C 42 36.778 40.330 -3.552 1
1 462 . 20 1 1 A 42 42 ILE N N 42 121.814 122.538 -0.724 1
1 463 . 20 1 1 A 43 43 ARG H H 43 8.787 8.386 0.401 1
1 464 . 20 1 1 A 43 43 ARG HA H 43 4.852 4.814 0.038 1
1 472 . 20 1 1 A 43 43 ARG C C 43 174.029 175.239 -1.210 1
1 473 . 20 1 1 A 43 43 ARG CA C 43 52.730 54.173 -1.443 1
1 474 . 20 1 1 A 43 43 ARG CB C 43 36.983 33.997 2.986 1
1 477 . 20 1 1 A 43 43 ARG N N 43 125.771 126.360 -0.589 1
1 479 . 20 1 1 A 44 44 VAL H H 44 8.661 8.585 0.076 1
1 480 . 20 1 1 A 44 44 VAL HA H 44 3.276 3.696 -0.420 1
1 488 . 20 1 1 A 44 44 VAL C C 44 173.227 175.009 -1.782 1
1 489 . 20 1 1 A 44 44 VAL CA C 44 63.161 63.157 0.004 1
1 490 . 20 1 1 A 44 44 VAL CB C 44 29.054 29.831 -0.777 1
1 493 . 20 1 1 A 44 44 VAL N N 44 117.026 116.480 0.546 1
1 494 . 20 1 1 A 45 45 ILE H H 45 8.464 7.890 0.574 1
1 495 . 20 1 1 A 45 45 ILE HA H 45 4.579 4.076 0.503 1
1 505 . 20 1 1 A 45 45 ILE C C 45 178.108 175.039 3.069 1
1 506 . 20 1 1 A 45 45 ILE CA C 45 59.888 60.765 -0.877 1
1 507 . 20 1 1 A 45 45 ILE CB C 45 36.998 37.356 -0.358 1
1 511 . 20 1 1 A 45 45 ILE N N 45 122.767 122.328 0.439 1
1 512 . 20 1 1 A 46 46 GLU H H 46 9.015 8.207 0.808 1
1 513 . 20 1 1 A 46 46 GLU HA H 46 4.206 4.402 -0.196 1
1 518 . 20 1 1 A 46 46 GLU C C 46 177.746 176.241 1.505 1
1 519 . 20 1 1 A 46 46 GLU CA C 46 56.130 56.461 -0.331 1
1 520 . 20 1 1 A 46 46 GLU CB C 46 30.581 30.239 0.342 1
1 522 . 20 1 1 A 46 46 GLU N N 46 131.076 128.545 2.531 1
1 523 . 20 1 1 A 47 47 GLU H H 47 9.213 8.766 0.447 1
1 524 . 20 1 1 A 47 47 GLU HA H 47 4.194 4.072 0.122 1
1 529 . 20 1 1 A 47 47 GLU C C 47 178.088 177.658 0.430 1
1 530 . 20 1 1 A 47 47 GLU CA C 47 58.212 57.954 0.258 1
1 531 . 20 1 1 A 47 47 GLU CB C 47 29.390 29.934 -0.544 1
1 533 . 20 1 1 A 47 47 GLU N N 47 129.592 124.605 4.987 1
1 534 . 20 1 1 A 48 48 GLY H H 48 9.586 8.937 0.649 1
1 535 . 20 1 1 A 48 48 GLY HA2 H 48 4.141 3.835 0.306 1
1 536 . 20 1 1 A 48 48 GLY HA3 H 48 3.757 3.836 -0.079 1
1 537 . 20 1 1 A 48 48 GLY C C 48 173.790 174.053 -0.263 1
1 538 . 20 1 1 A 48 48 GLY CA C 48 45.764 46.748 -0.984 1
1 539 . 20 1 1 A 48 48 GLY N N 48 114.819 114.623 0.196 1
1 540 . 20 1 1 A 49 49 SER H H 49 7.580 7.840 -0.260 1
1 541 . 20 1 1 A 49 49 SER HA H 49 4.728 4.779 -0.051 1
1 544 . 20 1 1 A 49 49 SER C C 49 173.542 174.373 -0.831 1
1 545 . 20 1 1 A 49 49 SER CA C 49 57.560 55.825 1.735 1
1 546 . 20 1 1 A 49 49 SER CB C 49 64.529 63.919 0.610 1
1 547 . 20 1 1 A 49 49 SER N N 49 114.688 114.211 0.477 1
1 548 . 20 1 1 A 50 50 PRO HA H 50 4.431 4.563 -0.132 1
1 555 . 20 1 1 A 50 50 PRO C C 50 179.377 177.416 1.961 1
1 556 . 20 1 1 A 50 50 PRO CA C 50 66.059 64.234 1.825 1
1 557 . 20 1 1 A 50 50 PRO CB C 50 32.598 31.826 0.772 1
1 560 . 20 1 1 A 51 51 ALA H H 51 8.264 8.097 0.167 1
1 561 . 20 1 1 A 51 51 ALA HA H 51 3.817 4.086 -0.269 1
1 565 . 20 1 1 A 51 51 ALA C C 51 177.508 179.887 -2.379 1
1 566 . 20 1 1 A 51 51 ALA CA C 51 55.392 54.293 1.099 1
1 567 . 20 1 1 A 51 51 ALA CB C 51 20.474 18.744 1.730 1
1 568 . 20 1 1 A 51 51 ALA N N 51 117.604 120.672 -3.068 1
1 569 . 20 1 1 A 52 52 GLU H H 52 7.794 7.349 0.445 1
1 570 . 20 1 1 A 52 52 GLU HA H 52 3.881 4.095 -0.214 1
1 575 . 20 1 1 A 52 52 GLU C C 52 181.401 178.596 2.805 1
1 576 . 20 1 1 A 52 52 GLU CA C 52 59.454 58.513 0.941 1
1 577 . 20 1 1 A 52 52 GLU CB C 52 30.247 29.688 0.559 1
1 579 . 20 1 1 A 52 52 GLU N N 52 119.474 118.047 1.427 1
1 580 . 20 1 1 A 53 53 LYS H H 53 8.557 7.985 0.572 1
1 581 . 20 1 1 A 53 53 LYS HA H 53 4.020 4.110 -0.090 1
1 588 . 20 1 1 A 53 53 LYS C C 53 177.939 177.301 0.638 1
1 589 . 20 1 1 A 53 53 LYS CA C 53 59.012 58.761 0.251 1
1 590 . 20 1 1 A 53 53 LYS CB C 53 32.438 31.746 0.692 1
1 594 . 20 1 1 A 53 53 LYS N N 53 120.057 117.811 2.246 1
1 595 . 20 1 1 A 54 54 ALA H H 54 7.764 7.528 0.236 1
1 596 . 20 1 1 A 54 54 ALA HA H 54 4.400 4.306 0.094 1
1 600 . 20 1 1 A 54 54 ALA C C 54 177.658 178.178 -0.520 1
1 601 . 20 1 1 A 54 54 ALA CA C 54 52.412 51.667 0.745 1
1 602 . 20 1 1 A 54 54 ALA CB C 54 20.739 18.308 2.431 1
1 603 . 20 1 1 A 54 54 ALA N N 54 117.678 120.771 -3.093 1
1 604 . 20 1 1 A 55 55 GLY H H 55 7.583 7.858 -0.275 1
1 605 . 20 1 1 A 55 55 GLY HA2 H 55 4.266 3.903 0.363 1
1 606 . 20 1 1 A 55 55 GLY HA3 H 55 3.775 3.904 -0.129 1
1 607 . 20 1 1 A 55 55 GLY C C 55 175.232 174.302 0.930 1
1 608 . 20 1 1 A 55 55 GLY CA C 55 45.368 46.623 -1.255 1
1 609 . 20 1 1 A 55 55 GLY N N 55 103.265 107.610 -4.345 1
1 610 . 20 1 1 A 56 56 LEU H H 56 7.280 7.408 -0.128 1
1 611 . 20 1 1 A 56 56 LEU HA H 56 3.984 4.549 -0.565 1
1 621 . 20 1 1 A 56 56 LEU C C 56 174.708 175.244 -0.536 1
1 622 . 20 1 1 A 56 56 LEU CA C 56 55.603 54.478 1.125 1
1 623 . 20 1 1 A 56 56 LEU CB C 56 42.752 42.577 0.175 1
1 627 . 20 1 1 A 56 56 LEU N N 56 119.211 123.062 -3.851 1
1 628 . 20 1 1 A 57 57 LEU H H 57 8.693 8.674 0.019 1
1 629 . 20 1 1 A 57 57 LEU HA H 57 4.499 5.021 -0.522 1
1 639 . 20 1 1 A 57 57 LEU C C 57 176.124 175.864 0.260 1
1 640 . 20 1 1 A 57 57 LEU CA C 57 52.959 53.351 -0.392 1
1 641 . 20 1 1 A 57 57 LEU CB C 57 45.122 45.545 -0.423 1
1 645 . 20 1 1 A 57 57 LEU N N 57 121.969 128.723 -6.754 1
1 646 . 20 1 1 A 58 58 ASP H H 58 8.334 8.749 -0.415 1
1 647 . 20 1 1 A 58 58 ASP HA H 58 4.139 4.817 -0.678 1
1 650 . 20 1 1 A 58 58 ASP C C 58 178.636 176.510 2.126 1
1 651 . 20 1 1 A 58 58 ASP CA C 58 56.079 55.241 0.838 1
1 652 . 20 1 1 A 58 58 ASP CB C 58 42.135 40.922 1.213 1
1 653 . 20 1 1 A 58 58 ASP N N 58 120.401 122.138 -1.737 1
1 654 . 20 1 1 A 59 59 GLY H H 59 9.378 8.933 0.445 1
1 655 . 20 1 1 A 59 59 GLY HA2 H 59 4.317 3.957 0.360 1
1 656 . 20 1 1 A 59 59 GLY HA3 H 59 3.260 3.957 -0.697 1
1 657 . 20 1 1 A 59 59 GLY C C 59 173.359 173.925 -0.566 1
1 658 . 20 1 1 A 59 59 GLY CA C 59 45.517 45.083 0.434 1
1 659 . 20 1 1 A 59 59 GLY N N 59 116.622 111.184 5.438 1
1 660 . 20 1 1 A 60 60 ASP H H 60 8.009 7.723 0.286 1
1 661 . 20 1 1 A 60 60 ASP HA H 60 4.638 4.553 0.085 1
1 664 . 20 1 1 A 60 60 ASP C C 60 175.555 174.747 0.808 1
1 665 . 20 1 1 A 60 60 ASP CA C 60 55.286 55.276 0.010 1
1 666 . 20 1 1 A 60 60 ASP CB C 60 42.381 41.769 0.612 1
1 667 . 20 1 1 A 60 60 ASP N N 60 121.370 121.827 -0.457 1
1 668 . 20 1 1 A 61 61 ARG H H 61 8.648 8.732 -0.084 1
1 669 . 20 1 1 A 61 61 ARG HA H 61 5.179 5.381 -0.202 1
1 677 . 20 1 1 A 61 61 ARG C C 61 177.381 174.671 2.710 1
1 678 . 20 1 1 A 61 61 ARG CA C 61 53.704 54.540 -0.836 1
1 679 . 20 1 1 A 61 61 ARG CB C 61 34.017 33.354 0.663 1
1 682 . 20 1 1 A 61 61 ARG N N 61 116.958 121.816 -4.858 1
1 684 . 20 1 1 A 62 62 VAL H H 62 8.247 8.562 -0.315 1
1 685 . 20 1 1 A 62 62 VAL HA H 62 3.806 4.405 -0.599 1
1 693 . 20 1 1 A 62 62 VAL C C 62 174.748 174.947 -0.199 1
1 694 . 20 1 1 A 62 62 VAL CA C 62 63.149 61.978 1.171 1
1 695 . 20 1 1 A 62 62 VAL CB C 62 32.574 32.254 0.320 1
1 698 . 20 1 1 A 62 62 VAL N N 62 118.546 124.455 -5.909 1
1 699 . 20 1 1 A 63 63 LEU H H 63 9.262 9.397 -0.135 1
1 700 . 20 1 1 A 63 63 LEU HA H 63 4.412 4.356 0.056 1
1 710 . 20 1 1 A 63 63 LEU C C 63 177.649 177.234 0.415 1
1 711 . 20 1 1 A 63 63 LEU CA C 63 56.044 56.573 -0.529 1
1 712 . 20 1 1 A 63 63 LEU CB C 63 43.339 42.935 0.404 1
1 716 . 20 1 1 A 63 63 LEU N N 63 125.413 131.073 -5.660 1
1 717 . 20 1 1 A 64 64 ARG H H 64 7.806 7.745 0.061 1
1 718 . 20 1 1 A 64 64 ARG HA H 64 5.704 4.965 0.739 1
1 726 . 20 1 1 A 64 64 ARG C C 64 175.091 174.064 1.027 1
1 727 . 20 1 1 A 64 64 ARG CA C 64 54.148 54.766 -0.618 1
1 728 . 20 1 1 A 64 64 ARG CB C 64 35.742 34.023 1.719 1
1 731 . 20 1 1 A 64 64 ARG N N 64 112.961 117.125 -4.164 1
1 733 . 20 1 1 A 65 65 ILE H H 65 8.327 9.140 -0.813 1
1 734 . 20 1 1 A 65 65 ILE HA H 65 4.384 4.659 -0.275 1
1 744 . 20 1 1 A 65 65 ILE C C 65 175.722 175.656 0.066 1
1 745 . 20 1 1 A 65 65 ILE CA C 65 60.501 59.543 0.958 1
1 746 . 20 1 1 A 65 65 ILE CB C 65 39.547 40.196 -0.649 1
1 750 . 20 1 1 A 65 65 ILE N N 65 119.175 124.095 -4.920 1
1 751 . 20 1 1 A 66 66 ASN H H 66 9.911 9.421 0.490 1
1 752 . 20 1 1 A 66 66 ASN HA H 66 4.428 4.392 0.036 1
1 757 . 20 1 1 A 66 66 ASN C C 66 175.349 174.652 0.697 1
1 758 . 20 1 1 A 66 66 ASN CA C 66 54.157 54.231 -0.074 1
1 759 . 20 1 1 A 66 66 ASN CB C 66 37.024 37.481 -0.457 1
1 760 . 20 1 1 A 66 66 ASN N N 66 128.952 128.080 0.872 1
1 762 . 20 1 1 A 67 67 GLY H H 67 9.230 8.688 0.542 1
1 763 . 20 1 1 A 67 67 GLY HA2 H 67 4.322 3.980 0.342 1
1 764 . 20 1 1 A 67 67 GLY HA3 H 67 3.508 3.990 -0.482 1
1 765 . 20 1 1 A 67 67 GLY C C 67 174.393 174.019 0.374 1
1 766 . 20 1 1 A 67 67 GLY CA C 67 45.341 46.490 -1.149 1
1 767 . 20 1 1 A 67 67 GLY N N 67 103.238 104.710 -1.472 1
1 768 . 20 1 1 A 68 68 VAL H H 68 8.063 7.755 0.308 1
1 769 . 20 1 1 A 68 68 VAL HA H 68 4.015 4.532 -0.517 1
1 777 . 20 1 1 A 68 68 VAL C C 68 175.833 175.013 0.820 1
1 778 . 20 1 1 A 68 68 VAL CA C 68 62.603 61.812 0.791 1
1 779 . 20 1 1 A 68 68 VAL CB C 68 32.574 34.957 -2.383 1
1 782 . 20 1 1 A 68 68 VAL N N 68 125.696 119.513 6.183 1
1 783 . 20 1 1 A 69 69 PHE H H 69 9.301 9.200 0.101 1
1 784 . 20 1 1 A 69 69 PHE HA H 69 4.947 4.745 0.202 1
1 792 . 20 1 1 A 69 69 PHE C C 69 177.120 176.107 1.013 1
1 793 . 20 1 1 A 69 69 PHE CA C 69 59.200 57.712 1.488 1
1 794 . 20 1 1 A 69 69 PHE CB C 69 39.320 39.155 0.165 1
1 800 . 20 1 1 A 69 69 PHE N N 69 128.641 129.119 -0.478 1
1 801 . 20 1 1 A 70 70 VAL H H 70 8.312 8.264 0.048 1
1 802 . 20 1 1 A 70 70 VAL HA H 70 4.517 4.465 0.052 1
1 810 . 20 1 1 A 70 70 VAL CA C 70 60.734 60.703 0.031 1
1 811 . 20 1 1 A 70 70 VAL CB C 70 32.976 31.555 1.421 1
1 814 . 20 1 1 A 70 70 VAL N N 70 118.381 120.354 -1.973 1
1 815 . 20 1 1 A 71 71 ASP H H 71 5.373 7.273 -1.900 1
1 816 . 20 1 1 A 71 71 ASP HA H 71 4.413 4.072 0.341 1
1 819 . 20 1 1 A 71 71 ASP C C 71 174.896 178.033 -3.137 1
1 820 . 20 1 1 A 71 71 ASP CA C 71 58.334 57.514 0.820 1
1 821 . 20 1 1 A 71 71 ASP CB C 71 46.097 40.580 5.517 1
1 822 . 20 1 1 A 71 71 ASP N N 71 119.008 122.506 -3.498 1
1 823 . 20 1 1 A 72 72 LYS H H 72 7.874 7.428 0.446 1
1 824 . 20 1 1 A 72 72 LYS HA H 72 4.522 4.306 0.216 1
1 833 . 20 1 1 A 72 72 LYS C C 72 177.209 176.923 0.286 1
1 834 . 20 1 1 A 72 72 LYS CA C 72 54.122 57.304 -3.182 1
1 835 . 20 1 1 A 72 72 LYS CB C 72 31.640 33.117 -1.477 1
1 839 . 20 1 1 A 72 72 LYS N N 72 110.259 116.562 -6.303 1
1 840 . 20 1 1 A 73 73 GLU H H 73 7.421 7.902 -0.481 1
1 841 . 20 1 1 A 73 73 GLU HA H 73 4.401 4.404 -0.003 1
1 846 . 20 1 1 A 73 73 GLU C C 73 176.728 176.036 0.692 1
1 847 . 20 1 1 A 73 73 GLU CA C 73 54.950 56.677 -1.727 1
1 848 . 20 1 1 A 73 73 GLU CB C 73 30.390 30.679 -0.289 1
1 850 . 20 1 1 A 73 73 GLU N N 73 120.043 118.691 1.352 1
1 851 . 20 1 1 A 74 74 GLU H H 74 9.360 8.467 0.893 1
1 852 . 20 1 1 A 74 74 GLU HA H 74 4.403 4.801 -0.398 1
1 857 . 20 1 1 A 74 74 GLU C C 74 178.234 177.003 1.231 1
1 858 . 20 1 1 A 74 74 GLU CA C 74 56.516 55.318 1.198 1
1 859 . 20 1 1 A 74 74 GLU CB C 74 30.390 32.200 -1.810 1
1 861 . 20 1 1 A 74 74 GLU N N 74 122.193 121.748 0.445 1
1 862 . 20 1 1 A 75 75 HIS H H 75 9.553 9.257 0.296 1
1 863 . 20 1 1 A 75 75 HIS HA H 75 4.080 4.144 -0.064 1
1 868 . 20 1 1 A 75 75 HIS C C 75 175.985 176.607 -0.622 1
1 869 . 20 1 1 A 75 75 HIS CA C 75 61.016 60.750 0.266 1
1 870 . 20 1 1 A 75 75 HIS CB C 75 29.468 30.713 -1.245 1
1 873 . 20 1 1 A 75 75 HIS N N 75 123.587 127.025 -3.438 1
1 874 . 20 1 1 A 76 76 ALA H H 76 9.129 8.224 0.905 1
1 875 . 20 1 1 A 76 76 ALA HA H 76 3.826 3.764 0.062 1
1 879 . 20 1 1 A 76 76 ALA C C 76 180.475 179.636 0.839 1
1 880 . 20 1 1 A 76 76 ALA CA C 76 55.392 55.133 0.259 1
1 881 . 20 1 1 A 76 76 ALA CB C 76 18.182 18.212 -0.030 1
1 882 . 20 1 1 A 76 76 ALA N N 76 117.795 120.728 -2.933 1
1 883 . 20 1 1 A 77 77 GLN H H 77 7.099 7.712 -0.613 1
1 884 . 20 1 1 A 77 77 GLN HA H 77 4.198 4.015 0.183 1
1 891 . 20 1 1 A 77 77 GLN C C 77 177.860 178.836 -0.976 1
1 892 . 20 1 1 A 77 77 GLN CA C 77 57.790 59.104 -1.314 1
1 893 . 20 1 1 A 77 77 GLN CB C 77 28.536 28.384 0.152 1
1 895 . 20 1 1 A 77 77 GLN N N 77 115.764 117.981 -2.217 1
1 897 . 20 1 1 A 78 78 VAL H H 78 7.430 7.908 -0.478 1
1 898 . 20 1 1 A 78 78 VAL HA H 78 3.241 3.491 -0.250 1
1 906 . 20 1 1 A 78 78 VAL C C 78 177.042 177.743 -0.701 1
1 907 . 20 1 1 A 78 78 VAL CA C 78 67.299 66.286 1.013 1
1 908 . 20 1 1 A 78 78 VAL CB C 78 30.819 31.332 -0.513 1
1 911 . 20 1 1 A 78 78 VAL N N 78 121.143 120.049 1.094 1
1 912 . 20 1 1 A 79 79 VAL H H 79 7.773 8.021 -0.248 1
1 913 . 20 1 1 A 79 79 VAL HA H 79 3.315 3.517 -0.202 1
1 921 . 20 1 1 A 79 79 VAL C C 79 179.179 177.711 1.468 1
1 922 . 20 1 1 A 79 79 VAL CA C 79 66.694 65.186 1.508 1
1 923 . 20 1 1 A 79 79 VAL CB C 79 31.841 31.336 0.505 1
1 926 . 20 1 1 A 79 79 VAL N N 79 117.473 119.729 -2.256 1
1 927 . 20 1 1 A 80 80 GLU H H 80 7.410 7.695 -0.285 1
1 928 . 20 1 1 A 80 80 GLU HA H 80 4.258 3.987 0.271 1
1 933 . 20 1 1 A 80 80 GLU C C 80 178.018 178.860 -0.842 1
1 934 . 20 1 1 A 80 80 GLU CA C 80 58.566 59.334 -0.768 1
1 935 . 20 1 1 A 80 80 GLU CB C 80 29.072 29.463 -0.391 1
1 937 . 20 1 1 A 80 80 GLU N N 80 120.451 120.706 -0.255 1
1 938 . 20 1 1 A 81 81 LEU H H 81 8.070 8.421 -0.351 1
1 939 . 20 1 1 A 81 81 LEU HA H 81 3.976 3.917 0.059 1
1 949 . 20 1 1 A 81 81 LEU C C 81 180.658 178.582 2.076 1
1 950 . 20 1 1 A 81 81 LEU CA C 81 58.061 58.155 -0.094 1
1 951 . 20 1 1 A 81 81 LEU CB C 81 42.115 41.967 0.148 1
1 955 . 20 1 1 A 81 81 LEU N N 81 119.943 120.280 -0.337 1
1 956 . 20 1 1 A 82 82 VAL H H 82 7.609 7.496 0.113 1
1 957 . 20 1 1 A 82 82 VAL HA H 82 3.474 3.593 -0.119 1
1 965 . 20 1 1 A 82 82 VAL C C 82 178.927 178.116 0.811 1
1 966 . 20 1 1 A 82 82 VAL CA C 82 67.398 66.826 0.572 1
1 967 . 20 1 1 A 82 82 VAL CB C 82 31.306 31.580 -0.274 1
1 970 . 20 1 1 A 82 82 VAL N N 82 118.150 117.579 0.571 1
1 971 . 20 1 1 A 83 83 ARG H H 83 8.186 7.795 0.391 1
1 972 . 20 1 1 A 83 83 ARG HA H 83 3.994 3.999 -0.005 1
1 979 . 20 1 1 A 83 83 ARG C C 83 179.999 179.112 0.887 1
1 980 . 20 1 1 A 83 83 ARG CA C 83 60.205 59.960 0.245 1
1 981 . 20 1 1 A 83 83 ARG CB C 83 30.103 30.015 0.088 1
1 984 . 20 1 1 A 83 83 ARG N N 83 122.902 119.266 3.636 1
1 985 . 20 1 1 A 84 84 LYS H H 84 8.772 7.981 0.791 1
1 986 . 20 1 1 A 84 84 LYS HA H 84 4.047 4.048 -0.001 1
1 995 . 20 1 1 A 84 84 LYS C C 84 176.934 178.593 -1.659 1
1 996 . 20 1 1 A 84 84 LYS CA C 84 58.142 59.207 -1.065 1
1 997 . 20 1 1 A 84 84 LYS CB C 84 32.492 32.052 0.440 1
1 1001 . 20 1 1 A 84 84 LYS N N 84 117.548 119.995 -2.447 1
1 1002 . 20 1 1 A 85 85 SER H H 85 7.333 8.148 -0.815 1
1 1003 . 20 1 1 A 85 85 SER HA H 85 4.235 4.264 -0.029 1
1 1006 . 20 1 1 A 85 85 SER C C 85 175.588 174.792 0.796 1
1 1007 . 20 1 1 A 85 85 SER CA C 85 59.535 61.306 -1.771 1
1 1008 . 20 1 1 A 85 85 SER CB C 85 63.571 63.671 -0.100 1
1 1009 . 20 1 1 A 85 85 SER N N 85 113.544 113.990 -0.446 1
1 1010 . 20 1 1 A 86 86 GLY H H 86 7.459 7.812 -0.353 1
1 1011 . 20 1 1 A 86 86 GLY HA2 H 86 4.176 4.095 0.081 1
1 1012 . 20 1 1 A 86 86 GLY HA3 H 86 3.762 4.100 -0.338 1
1 1013 . 20 1 1 A 86 86 GLY C C 86 176.407 175.173 1.234 1
1 1014 . 20 1 1 A 86 86 GLY CA C 86 46.109 45.045 1.064 1
1 1015 . 20 1 1 A 86 86 GLY N N 86 104.331 107.900 -3.569 1
1 1016 . 20 1 1 A 87 87 ASN HA H 87 4.650 4.739 -0.089 1
1 1021 . 20 1 1 A 87 87 ASN C C 87 173.653 175.524 -1.871 1
1 1022 . 20 1 1 A 87 87 ASN CA C 87 54.492 54.187 0.305 1
1 1023 . 20 1 1 A 87 87 ASN CB C 87 38.425 39.987 -1.562 1
1 1024 . 20 1 1 A 87 87 ASN N N 87 118.401 125.241 -6.840 1
1 1026 . 20 1 1 A 88 88 SER H H 88 7.435 8.108 -0.673 1
1 1027 . 20 1 1 A 88 88 SER HA H 88 5.438 5.474 -0.036 1
1 1030 . 20 1 1 A 88 88 SER C C 88 172.867 173.385 -0.518 1
1 1031 . 20 1 1 A 88 88 SER CA C 88 58.160 55.957 2.203 1
1 1032 . 20 1 1 A 88 88 SER CB C 88 65.861 66.115 -0.254 1
1 1033 . 20 1 1 A 88 88 SER N N 88 113.765 111.818 1.947 1
1 1034 . 20 1 1 A 89 89 VAL H H 89 8.452 9.146 -0.694 1
1 1035 . 20 1 1 A 89 89 VAL HA H 89 4.519 5.427 -0.908 1
1 1043 . 20 1 1 A 89 89 VAL C C 89 171.391 174.719 -3.328 1
1 1044 . 20 1 1 A 89 89 VAL CA C 89 61.333 59.710 1.623 1
1 1045 . 20 1 1 A 89 89 VAL CB C 89 33.897 35.469 -1.572 1
1 1048 . 20 1 1 A 89 89 VAL N N 89 120.001 122.200 -2.199 1
1 1049 . 20 1 1 A 90 90 THR H H 90 8.348 8.765 -0.417 1
1 1050 . 20 1 1 A 90 90 THR HA H 90 5.042 5.117 -0.075 1
1 1055 . 20 1 1 A 90 90 THR C C 90 173.926 173.392 0.534 1
1 1056 . 20 1 1 A 90 90 THR CA C 90 61.403 61.784 -0.381 1
1 1057 . 20 1 1 A 90 90 THR CB C 90 69.553 69.986 -0.433 1
1 1059 . 20 1 1 A 90 90 THR N N 90 123.477 121.062 2.415 1
1 1060 . 20 1 1 A 91 91 LEU H H 91 9.195 9.103 0.092 1
1 1061 . 20 1 1 A 91 91 LEU HA H 91 5.161 5.200 -0.039 1
1 1071 . 20 1 1 A 91 91 LEU C C 91 174.564 175.692 -1.128 1
1 1072 . 20 1 1 A 91 91 LEU CA C 91 52.590 53.464 -0.874 1
1 1073 . 20 1 1 A 91 91 LEU CB C 91 44.998 44.733 0.265 1
1 1077 . 20 1 1 A 91 91 LEU N N 91 128.419 127.677 0.742 1
1 1078 . 20 1 1 A 92 92 LEU H H 92 8.644 8.682 -0.038 1
1 1079 . 20 1 1 A 92 92 LEU HA H 92 5.335 5.028 0.307 1
1 1089 . 20 1 1 A 92 92 LEU C C 92 176.451 175.226 1.225 1
1 1090 . 20 1 1 A 92 92 LEU CA C 92 54.220 53.938 0.282 1
1 1091 . 20 1 1 A 92 92 LEU CB C 92 44.323 43.051 1.272 1
1 1095 . 20 1 1 A 92 92 LEU N N 92 125.894 123.329 2.565 1
1 1096 . 20 1 1 A 93 93 VAL H H 93 9.249 8.858 0.391 1
1 1097 . 20 1 1 A 93 93 VAL HA H 93 5.573 5.216 0.357 1
1 1105 . 20 1 1 A 93 93 VAL C C 93 173.550 174.327 -0.777 1
1 1106 . 20 1 1 A 93 93 VAL CA C 93 58.340 60.698 -2.358 1
1 1107 . 20 1 1 A 93 93 VAL CB C 93 36.159 33.857 2.302 1
1 1110 . 20 1 1 A 93 93 VAL N N 93 120.660 120.373 0.287 1
1 1111 . 20 1 1 A 94 94 LEU H H 94 8.634 9.085 -0.451 1
1 1112 . 20 1 1 A 94 94 LEU HA H 94 4.911 5.140 -0.229 1
1 1122 . 20 1 1 A 94 94 LEU C C 94 174.172 176.184 -2.012 1
1 1123 . 20 1 1 A 94 94 LEU CA C 94 52.659 53.212 -0.553 1
1 1124 . 20 1 1 A 94 94 LEU CB C 94 47.910 45.174 2.736 1
1 1128 . 20 1 1 A 94 94 LEU N N 94 120.304 128.158 -7.854 1
1 1129 . 20 1 1 A 95 95 ASP H H 95 8.210 8.756 -0.546 1
1 1130 . 20 1 1 A 95 95 ASP HA H 95 5.190 4.731 0.459 1
1 1133 . 20 1 1 A 95 95 ASP C C 95 175.887 177.267 -1.380 1
1 1134 . 20 1 1 A 95 95 ASP CA C 95 53.899 53.845 0.054 1
1 1135 . 20 1 1 A 95 95 ASP CB C 95 41.188 41.451 -0.263 1
1 1136 . 20 1 1 A 95 95 ASP N N 95 122.184 124.266 -2.082 1
1 1137 . 20 1 1 A 96 96 GLY H H 96 8.478 8.862 -0.384 1
1 1138 . 20 1 1 A 96 96 GLY HA2 H 96 4.002 3.789 0.213 1
1 1139 . 20 1 1 A 96 96 GLY HA3 H 96 3.757 3.822 -0.065 1
1 1140 . 20 1 1 A 96 96 GLY C C 96 175.497 175.495 0.002 1
1 1141 . 20 1 1 A 96 96 GLY CA C 96 49.944 47.606 2.338 1
1 1142 . 20 1 1 A 96 96 GLY N N 96 108.610 108.858 -0.248 1
1 1143 . 20 1 1 A 97 97 ASP H H 97 8.401 8.170 0.231 1
1 1144 . 20 1 1 A 97 97 ASP HA H 97 4.454 4.327 0.127 1
1 1147 . 20 1 1 A 97 97 ASP C C 97 179.612 178.802 0.810 1
1 1148 . 20 1 1 A 97 97 ASP CA C 97 57.913 57.333 0.580 1
1 1149 . 20 1 1 A 97 97 ASP CB C 97 41.145 40.556 0.589 1
1 1150 . 20 1 1 A 97 97 ASP N N 97 120.034 121.945 -1.911 1
1 1151 . 20 1 1 A 98 98 SER H H 98 8.152 8.126 0.026 1
1 1152 . 20 1 1 A 98 98 SER HA H 98 4.218 4.032 0.186 1
1 1155 . 20 1 1 A 98 98 SER C C 98 175.061 175.237 -0.176 1
1 1156 . 20 1 1 A 98 98 SER CA C 98 62.180 62.355 -0.175 1
1 1157 . 20 1 1 A 98 98 SER CB C 98 62.179 62.746 -0.567 1
1 1158 . 20 1 1 A 98 98 SER N N 98 117.174 116.763 0.411 1
1 1159 . 20 1 1 A 99 99 TYR H H 99 9.051 8.522 0.529 1
1 1160 . 20 1 1 A 99 99 TYR HA H 99 3.692 3.811 -0.119 1
1 1167 . 20 1 1 A 99 99 TYR C C 99 176.460 177.487 -1.027 1
1 1168 . 20 1 1 A 99 99 TYR CA C 99 62.814 61.974 0.840 1
1 1169 . 20 1 1 A 99 99 TYR CB C 99 38.829 38.576 0.253 1
1 1174 . 20 1 1 A 99 99 TYR N N 99 123.539 122.474 1.065 1
1 1175 . 20 1 1 A 100 100 GLU H H 100 8.520 8.254 0.266 1
1 1176 . 20 1 1 A 100 100 GLU HA H 100 3.952 4.163 -0.211 1
1 1181 . 20 1 1 A 100 100 GLU C C 100 180.151 178.979 1.172 1
1 1182 . 20 1 1 A 100 100 GLU CA C 100 60.099 59.484 0.615 1
1 1183 . 20 1 1 A 100 100 GLU CB C 100 29.435 29.117 0.318 1
1 1185 . 20 1 1 A 100 100 GLU N N 100 117.082 118.871 -1.789 1
1 1186 . 20 1 1 A 101 101 LYS H H 101 7.740 8.153 -0.413 1
1 1187 . 20 1 1 A 101 101 LYS HA H 101 3.984 4.063 -0.079 1
1 1196 . 20 1 1 A 101 101 LYS C C 101 178.377 178.720 -0.343 1
1 1197 . 20 1 1 A 101 101 LYS CA C 101 59.888 59.320 0.568 1
1 1198 . 20 1 1 A 101 101 LYS CB C 101 32.821 32.399 0.422 1
1 1202 . 20 1 1 A 101 101 LYS N N 101 119.851 121.294 -1.443 1
1 1203 . 20 1 1 A 102 102 ALA H H 102 8.538 7.457 1.081 1
1 1204 . 20 1 1 A 102 102 ALA HA H 102 3.632 4.272 -0.640 1
1 1208 . 20 1 1 A 102 102 ALA C C 102 179.870 179.838 0.032 1
1 1209 . 20 1 1 A 102 102 ALA CA C 102 55.285 55.158 0.127 1
1 1210 . 20 1 1 A 102 102 ALA CB C 102 17.163 18.847 -1.684 1
1 1211 . 20 1 1 A 102 102 ALA N N 102 124.176 121.731 2.445 1
1 1212 . 20 1 1 A 103 103 VAL H H 103 8.147 7.616 0.531 1
1 1213 . 20 1 1 A 103 103 VAL HA H 103 3.658 3.589 0.069 1
1 1221 . 20 1 1 A 103 103 VAL C C 103 181.113 178.064 3.049 1
1 1222 . 20 1 1 A 103 103 VAL CA C 103 66.090 67.189 -1.099 1
1 1223 . 20 1 1 A 103 103 VAL CB C 103 31.822 31.627 0.195 1
1 1226 . 20 1 1 A 103 103 VAL N N 103 117.841 118.113 -0.272 1
1 1227 . 20 1 1 A 104 104 LYS H H 104 7.903 8.434 -0.531 1
1 1228 . 20 1 1 A 104 104 LYS HA H 104 4.065 3.922 0.143 1
1 1235 . 20 1 1 A 104 104 LYS C C 104 177.715 178.466 -0.751 1
1 1236 . 20 1 1 A 104 104 LYS CA C 104 59.094 60.195 -1.101 1
1 1237 . 20 1 1 A 104 104 LYS CB C 104 32.285 32.389 -0.104 1
1 1241 . 20 1 1 A 104 104 LYS N N 104 121.515 119.135 2.380 1
1 1242 . 20 1 1 A 105 105 ASN H H 105 7.747 7.883 -0.136 1
1 1243 . 20 1 1 A 105 105 ASN HA H 105 4.721 4.874 -0.153 1
1 1248 . 20 1 1 A 105 105 ASN C C 105 173.320 174.065 -0.745 1
1 1249 . 20 1 1 A 105 105 ASN CA C 105 53.399 53.006 0.393 1
1 1250 . 20 1 1 A 105 105 ASN CB C 105 39.249 38.500 0.749 1
1 1251 . 20 1 1 A 105 105 ASN N N 105 114.941 114.888 0.053 1
1 1253 . 20 1 1 A 106 106 GLN H H 106 7.850 7.978 -0.128 1
1 1254 . 20 1 1 A 106 106 GLN HA H 106 3.902 3.864 0.038 1
1 1261 . 20 1 1 A 106 106 GLN C C 106 175.168 174.533 0.635 1
1 1262 . 20 1 1 A 106 106 GLN CA C 106 56.978 56.938 0.040 1
1 1263 . 20 1 1 A 106 106 GLN CB C 106 25.770 26.581 -0.811 1
1 1265 . 20 1 1 A 106 106 GLN N N 106 114.989 115.703 -0.714 1
1 1267 . 20 1 1 A 107 107 VAL H H 107 8.005 7.909 0.096 1
1 1268 . 20 1 1 A 107 107 VAL HA H 107 3.664 4.294 -0.630 1
1 1276 . 20 1 1 A 107 107 VAL C C 107 175.468 174.963 0.505 1
1 1277 . 20 1 1 A 107 107 VAL CA C 107 62.726 61.197 1.529 1
1 1278 . 20 1 1 A 107 107 VAL CB C 107 32.535 33.257 -0.722 1
1 1281 . 20 1 1 A 107 107 VAL N N 107 120.216 119.587 0.629 1
1 1282 . 20 1 1 A 108 108 ASP H H 108 8.484 8.770 -0.286 1
1 1283 . 20 1 1 A 108 108 ASP HA H 108 4.467 4.670 -0.203 1
1 1286 . 20 1 1 A 108 108 ASP C C 108 177.179 176.138 1.041 1
1 1287 . 20 1 1 A 108 108 ASP CA C 108 53.417 54.899 -1.482 1
1 1288 . 20 1 1 A 108 108 ASP CB C 108 40.030 40.961 -0.931 1
1 1289 . 20 1 1 A 108 108 ASP N N 108 125.414 127.110 -1.696 1
1 1290 . 20 1 1 A 109 109 LEU H H 109 8.470 8.649 -0.179 1
1 1291 . 20 1 1 A 109 109 LEU HA H 109 3.846 4.039 -0.193 1
1 1301 . 20 1 1 A 109 109 LEU C C 109 178.145 178.701 -0.556 1
1 1302 . 20 1 1 A 109 109 LEU CA C 109 56.573 56.924 -0.351 1
1 1303 . 20 1 1 A 109 109 LEU CB C 109 42.011 41.769 0.242 1
1 1307 . 20 1 1 A 109 109 LEU N N 109 127.577 125.161 2.416 1
1 1308 . 20 1 1 A 110 110 LYS H H 110 8.062 7.992 0.070 1
1 1309 . 20 1 1 A 110 110 LYS HA H 110 3.022 1.290 1.732 1
1 1317 . 20 1 1 A 110 110 LYS C C 110 177.248 177.489 -0.241 1
1 1318 . 20 1 1 A 110 110 LYS CA C 110 58.742 57.400 1.342 1
1 1319 . 20 1 1 A 110 110 LYS CB C 110 31.667 30.954 0.713 1
1 1323 . 20 1 1 A 110 110 LYS N N 110 118.873 117.238 1.635 1
1 1324 . 20 1 1 A 111 111 GLU H H 111 7.113 7.585 -0.472 1
1 1325 . 20 1 1 A 111 111 GLU HA H 111 4.117 4.159 -0.042 1
1 1330 . 20 1 1 A 111 111 GLU C C 111 176.519 177.525 -1.006 1
1 1331 . 20 1 1 A 111 111 GLU CA C 111 55.621 58.746 -3.125 1
1 1332 . 20 1 1 A 111 111 GLU CB C 111 29.943 29.865 0.078 1
1 1334 . 20 1 1 A 111 111 GLU N N 111 114.282 117.265 -2.983 1
1 1335 . 20 1 1 A 112 112 LEU H H 112 6.848 7.690 -0.842 1
1 1336 . 20 1 1 A 112 112 LEU HA H 112 4.293 4.064 0.229 1
1 1346 . 20 1 1 A 112 112 LEU C C 112 175.674 176.125 -0.451 1
1 1347 . 20 1 1 A 112 112 LEU CA C 112 55.197 55.511 -0.314 1
1 1348 . 20 1 1 A 112 112 LEU CB C 112 41.681 41.534 0.147 1
1 1352 . 20 1 1 A 112 112 LEU N N 112 118.934 122.164 -3.230 1
1 1353 . 20 1 1 A 113 113 ASP H H 113 8.466 8.507 -0.041 1
1 1354 . 20 1 1 A 113 113 ASP HA H 113 4.593 4.858 -0.265 1
1 1357 . 20 1 1 A 113 113 ASP C C 113 174.511 175.455 -0.944 1
1 1358 . 20 1 1 A 113 113 ASP CA C 113 53.558 53.888 -0.330 1
1 1359 . 20 1 1 A 113 113 ASP CB C 113 42.448 42.560 -0.112 1
1 1360 . 20 1 1 A 113 113 ASP N N 113 122.148 125.020 -2.872 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 106 1.240 1
2 1 1 1 "RMS(OBS, PRED)" CA 108 1.174 1
3 1 1 1 "RMS(OBS, PRED)" CB 98 1.347 1
4 1 1 1 "RMS(OBS, PRED)" H 103 0.497 1
5 1 1 1 "RMS(OBS, PRED)" HA 118 0.316 1
6 1 1 1 "RMS(OBS, PRED)" N 105 3.019 1
7 1 2 1 "RMS(OBS, PRED)" C 106 1.243 1
8 1 2 1 "RMS(OBS, PRED)" CA 108 1.107 1
9 1 2 1 "RMS(OBS, PRED)" CB 98 1.278 1
10 1 2 1 "RMS(OBS, PRED)" H 103 0.472 1
11 1 2 1 "RMS(OBS, PRED)" HA 118 0.292 1
12 1 2 1 "RMS(OBS, PRED)" N 105 2.919 1
13 1 3 1 "RMS(OBS, PRED)" C 106 1.237 1
14 1 3 1 "RMS(OBS, PRED)" CA 108 1.252 1
15 1 3 1 "RMS(OBS, PRED)" CB 98 1.340 1
16 1 3 1 "RMS(OBS, PRED)" H 103 0.514 1
17 1 3 1 "RMS(OBS, PRED)" HA 118 0.314 1
18 1 3 1 "RMS(OBS, PRED)" N 105 2.889 1
19 1 4 1 "RMS(OBS, PRED)" C 106 1.247 1
20 1 4 1 "RMS(OBS, PRED)" CA 108 1.196 1
21 1 4 1 "RMS(OBS, PRED)" CB 98 1.249 1
22 1 4 1 "RMS(OBS, PRED)" H 103 0.489 1
23 1 4 1 "RMS(OBS, PRED)" HA 118 0.315 1
24 1 4 1 "RMS(OBS, PRED)" N 105 3.024 1
25 1 5 1 "RMS(OBS, PRED)" C 106 1.220 1
26 1 5 1 "RMS(OBS, PRED)" CA 108 1.229 1
27 1 5 1 "RMS(OBS, PRED)" CB 98 1.274 1
28 1 5 1 "RMS(OBS, PRED)" H 103 0.488 1
29 1 5 1 "RMS(OBS, PRED)" HA 118 0.305 1
30 1 5 1 "RMS(OBS, PRED)" N 105 2.842 1
31 1 6 1 "RMS(OBS, PRED)" C 106 1.252 1
32 1 6 1 "RMS(OBS, PRED)" CA 108 1.138 1
33 1 6 1 "RMS(OBS, PRED)" CB 98 1.310 1
34 1 6 1 "RMS(OBS, PRED)" H 103 0.490 1
35 1 6 1 "RMS(OBS, PRED)" HA 118 0.314 1
36 1 6 1 "RMS(OBS, PRED)" N 105 2.856 1
37 1 7 1 "RMS(OBS, PRED)" C 106 1.186 1
38 1 7 1 "RMS(OBS, PRED)" CA 108 1.094 1
39 1 7 1 "RMS(OBS, PRED)" CB 98 1.282 1
40 1 7 1 "RMS(OBS, PRED)" H 103 0.476 1
41 1 7 1 "RMS(OBS, PRED)" HA 118 0.308 1
42 1 7 1 "RMS(OBS, PRED)" N 105 3.111 1
43 1 8 1 "RMS(OBS, PRED)" C 106 1.238 1
44 1 8 1 "RMS(OBS, PRED)" CA 108 1.097 1
45 1 8 1 "RMS(OBS, PRED)" CB 98 1.287 1
46 1 8 1 "RMS(OBS, PRED)" H 103 0.476 1
47 1 8 1 "RMS(OBS, PRED)" HA 118 0.306 1
48 1 8 1 "RMS(OBS, PRED)" N 105 2.959 1
49 1 9 1 "RMS(OBS, PRED)" C 106 1.234 1
50 1 9 1 "RMS(OBS, PRED)" CA 108 1.209 1
51 1 9 1 "RMS(OBS, PRED)" CB 98 1.373 1
52 1 9 1 "RMS(OBS, PRED)" H 103 0.564 1
53 1 9 1 "RMS(OBS, PRED)" HA 118 0.309 1
54 1 9 1 "RMS(OBS, PRED)" N 105 3.172 1
55 1 10 1 "RMS(OBS, PRED)" C 106 1.228 1
56 1 10 1 "RMS(OBS, PRED)" CA 108 1.273 1
57 1 10 1 "RMS(OBS, PRED)" CB 98 1.230 1
58 1 10 1 "RMS(OBS, PRED)" H 103 0.545 1
59 1 10 1 "RMS(OBS, PRED)" HA 118 0.303 1
60 1 10 1 "RMS(OBS, PRED)" N 105 2.837 1
61 1 11 1 "RMS(OBS, PRED)" C 106 1.245 1
62 1 11 1 "RMS(OBS, PRED)" CA 108 1.154 1
63 1 11 1 "RMS(OBS, PRED)" CB 98 1.297 1
64 1 11 1 "RMS(OBS, PRED)" H 103 0.491 1
65 1 11 1 "RMS(OBS, PRED)" HA 118 0.313 1
66 1 11 1 "RMS(OBS, PRED)" N 105 2.903 1
67 1 12 1 "RMS(OBS, PRED)" C 106 1.190 1
68 1 12 1 "RMS(OBS, PRED)" CA 108 1.126 1
69 1 12 1 "RMS(OBS, PRED)" CB 98 1.261 1
70 1 12 1 "RMS(OBS, PRED)" H 103 0.482 1
71 1 12 1 "RMS(OBS, PRED)" HA 118 0.301 1
72 1 12 1 "RMS(OBS, PRED)" N 105 2.881 1
73 1 13 1 "RMS(OBS, PRED)" C 106 1.303 1
74 1 13 1 "RMS(OBS, PRED)" CA 108 1.157 1
75 1 13 1 "RMS(OBS, PRED)" CB 98 1.267 1
76 1 13 1 "RMS(OBS, PRED)" H 103 0.494 1
77 1 13 1 "RMS(OBS, PRED)" HA 118 0.307 1
78 1 13 1 "RMS(OBS, PRED)" N 105 3.017 1
79 1 14 1 "RMS(OBS, PRED)" C 106 1.251 1
80 1 14 1 "RMS(OBS, PRED)" CA 108 1.192 1
81 1 14 1 "RMS(OBS, PRED)" CB 98 1.271 1
82 1 14 1 "RMS(OBS, PRED)" H 103 0.491 1
83 1 14 1 "RMS(OBS, PRED)" HA 118 0.314 1
84 1 14 1 "RMS(OBS, PRED)" N 105 2.896 1
85 1 15 1 "RMS(OBS, PRED)" C 106 1.332 1
86 1 15 1 "RMS(OBS, PRED)" CA 108 1.258 1
87 1 15 1 "RMS(OBS, PRED)" CB 98 1.373 1
88 1 15 1 "RMS(OBS, PRED)" H 103 0.521 1
89 1 15 1 "RMS(OBS, PRED)" HA 118 0.326 1
90 1 15 1 "RMS(OBS, PRED)" N 105 2.858 1
91 1 16 1 "RMS(OBS, PRED)" C 106 1.202 1
92 1 16 1 "RMS(OBS, PRED)" CA 108 1.135 1
93 1 16 1 "RMS(OBS, PRED)" CB 98 1.237 1
94 1 16 1 "RMS(OBS, PRED)" H 103 0.481 1
95 1 16 1 "RMS(OBS, PRED)" HA 118 0.304 1
96 1 16 1 "RMS(OBS, PRED)" N 105 2.972 1
97 1 17 1 "RMS(OBS, PRED)" C 106 1.249 1
98 1 17 1 "RMS(OBS, PRED)" CA 108 1.193 1
99 1 17 1 "RMS(OBS, PRED)" CB 98 1.235 1
100 1 17 1 "RMS(OBS, PRED)" H 103 0.513 1
101 1 17 1 "RMS(OBS, PRED)" HA 118 0.319 1
102 1 17 1 "RMS(OBS, PRED)" N 105 2.972 1
103 1 18 1 "RMS(OBS, PRED)" C 106 1.235 1
104 1 18 1 "RMS(OBS, PRED)" CA 108 1.113 1
105 1 18 1 "RMS(OBS, PRED)" CB 98 1.322 1
106 1 18 1 "RMS(OBS, PRED)" H 103 0.501 1
107 1 18 1 "RMS(OBS, PRED)" HA 118 0.321 1
108 1 18 1 "RMS(OBS, PRED)" N 105 2.959 1
109 1 19 1 "RMS(OBS, PRED)" C 106 1.253 1
110 1 19 1 "RMS(OBS, PRED)" CA 108 1.134 1
111 1 19 1 "RMS(OBS, PRED)" CB 98 1.310 1
112 1 19 1 "RMS(OBS, PRED)" H 103 0.496 1
113 1 19 1 "RMS(OBS, PRED)" HA 118 0.312 1
114 1 19 1 "RMS(OBS, PRED)" N 105 2.796 1
115 1 20 1 "RMS(OBS, PRED)" C 106 1.237 1
116 1 20 1 "RMS(OBS, PRED)" CA 108 1.163 1
117 1 20 1 "RMS(OBS, PRED)" CB 98 1.370 1
118 1 20 1 "RMS(OBS, PRED)" H 103 0.491 1
119 1 20 1 "RMS(OBS, PRED)" HA 118 0.361 1
120 1 20 1 "RMS(OBS, PRED)" N 105 2.951 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 A 6 6 SER HA H 6 4.483 4.751 -0.268 2
1 4 . 1 1 A 6 6 SER C C 6 175.167 174.007 1.160 2
1 5 . 1 1 A 6 6 SER CA C 6 58.759 57.944 0.815 2
1 6 . 1 1 A 6 6 SER CB C 6 64.069 64.554 -0.485 2
1 7 . 1 1 A 7 7 GLY H H 7 8.431 8.406 0.025 2
1 8 . 1 1 A 7 7 GLY HA2 H 7 3.973 4.041 -0.068 2
1 9 . 1 1 A 7 7 GLY HA3 H 7 3.973 4.044 -0.071 2
1 10 . 1 1 A 7 7 GLY C C 7 174.570 173.684 0.886 2
1 11 . 1 1 A 7 7 GLY CA C 7 45.483 45.758 -0.275 2
1 12 . 1 1 A 7 7 GLY N N 7 110.640 110.940 -0.300 2
1 13 . 1 1 A 8 8 MET H H 8 8.239 8.460 -0.221 2
1 14 . 1 1 A 8 8 MET HA H 8 4.386 4.661 -0.275 2
1 22 . 1 1 A 8 8 MET C C 8 176.621 175.661 0.960 2
1 23 . 1 1 A 8 8 MET CA C 8 55.991 55.507 0.484 2
1 24 . 1 1 A 8 8 MET CB C 8 32.986 34.154 -1.168 2
1 27 . 1 1 A 8 8 MET N N 8 120.219 121.809 -1.590 2
1 28 . 1 1 A 9 9 ALA H H 9 8.435 8.261 0.174 2
1 29 . 1 1 A 9 9 ALA HA H 9 4.182 4.383 -0.201 2
1 33 . 1 1 A 9 9 ALA C C 9 177.951 176.728 1.223 2
1 34 . 1 1 A 9 9 ALA CA C 9 53.399 52.272 1.127 2
1 35 . 1 1 A 9 9 ALA CB C 9 18.955 19.856 -0.901 2
1 36 . 1 1 A 9 9 ALA N N 9 124.459 124.330 0.129 2
1 37 . 1 1 A 10 10 SER H H 10 8.100 8.294 -0.194 2
1 38 . 1 1 A 10 10 SER HA H 10 4.391 4.730 -0.339 2
1 41 . 1 1 A 10 10 SER C C 10 174.467 173.515 0.952 2
1 42 . 1 1 A 10 10 SER CA C 10 58.709 58.156 0.553 2
1 43 . 1 1 A 10 10 SER CB C 10 63.778 65.001 -1.223 2
1 44 . 1 1 A 10 10 SER N N 10 113.881 114.564 -0.683 2
1 45 . 1 1 A 11 11 THR H H 11 7.821 8.382 -0.561 2
1 46 . 1 1 A 11 11 THR HA H 11 4.191 4.824 -0.633 2
1 51 . 1 1 A 11 11 THR C C 11 173.610 173.107 0.503 2
1 52 . 1 1 A 11 11 THR CA C 11 61.936 60.802 1.134 2
1 53 . 1 1 A 11 11 THR CB C 11 69.713 70.854 -1.141 2
1 55 . 1 1 A 11 11 THR N N 11 114.471 114.997 -0.526 2
1 56 . 1 1 A 12 12 PHE H H 12 7.946 9.059 -1.113 2
1 57 . 1 1 A 12 12 PHE HA H 12 4.769 4.845 -0.076 2
1 65 . 1 1 A 12 12 PHE C C 12 174.211 175.241 -1.030 2
1 66 . 1 1 A 12 12 PHE CA C 12 56.644 57.697 -1.053 2
1 67 . 1 1 A 12 12 PHE CB C 12 40.609 40.514 0.095 2
1 73 . 1 1 A 12 12 PHE N N 12 120.763 124.981 -4.218 2
1 74 . 1 1 A 13 13 ASN H H 13 9.004 8.942 0.062 2
1 75 . 1 1 A 13 13 ASN HA H 13 5.366 5.454 -0.088 2
1 80 . 1 1 A 13 13 ASN C C 13 172.158 173.543 -1.385 2
1 81 . 1 1 A 13 13 ASN CA C 13 50.988 50.448 0.540 2
1 82 . 1 1 A 13 13 ASN CB C 13 39.942 39.161 0.781 2
1 83 . 1 1 A 13 13 ASN N N 13 119.973 119.000 0.973 2
1 85 . 1 1 A 14 14 PRO HA H 14 4.945 4.629 0.316 2
1 92 . 1 1 A 14 14 PRO C C 14 174.901 175.685 -0.784 2
1 93 . 1 1 A 14 14 PRO CA C 14 63.096 62.571 0.525 2
1 94 . 1 1 A 14 14 PRO CB C 14 32.739 32.701 0.038 2
1 97 . 1 1 A 15 15 ARG H H 15 8.908 8.624 0.284 2
1 98 . 1 1 A 15 15 ARG HA H 15 4.626 4.756 -0.130 2
1 106 . 1 1 A 15 15 ARG C C 15 174.432 174.888 -0.456 2
1 107 . 1 1 A 15 15 ARG CA C 15 54.827 55.195 -0.368 2
1 108 . 1 1 A 15 15 ARG CB C 15 32.439 32.594 -0.155 2
1 111 . 1 1 A 15 15 ARG N N 15 118.947 121.618 -2.671 2
1 113 . 1 1 A 16 16 GLU H H 16 8.838 8.854 -0.016 2
1 114 . 1 1 A 16 16 GLU HA H 16 4.876 4.824 0.052 2
1 119 . 1 1 A 16 16 GLU C C 16 175.767 175.260 0.507 2
1 120 . 1 1 A 16 16 GLU CA C 16 55.621 56.032 -0.411 2
1 121 . 1 1 A 16 16 GLU CB C 16 31.093 31.110 -0.017 2
1 123 . 1 1 A 16 16 GLU N N 16 125.316 126.278 -0.962 2
1 124 . 1 1 A 17 17 CYS H H 17 9.327 8.823 0.504 2
1 125 . 1 1 A 17 17 CYS HA H 17 4.804 5.152 -0.348 2
1 128 . 1 1 A 17 17 CYS C C 17 172.973 173.193 -0.220 2
1 129 . 1 1 A 17 17 CYS CA C 17 57.930 57.552 0.378 2
1 130 . 1 1 A 17 17 CYS CB C 17 30.105 30.568 -0.463 2
1 131 . 1 1 A 17 17 CYS N N 17 127.909 124.111 3.798 2
1 132 . 1 1 A 18 18 LYS H H 18 9.022 8.859 0.163 2
1 133 . 1 1 A 18 18 LYS HA H 18 4.769 4.833 -0.064 2
1 142 . 1 1 A 18 18 LYS C C 18 174.586 175.354 -0.768 2
1 143 . 1 1 A 18 18 LYS CA C 18 55.956 55.180 0.776 2
1 144 . 1 1 A 18 18 LYS CB C 18 32.203 33.495 -1.292 2
1 148 . 1 1 A 18 18 LYS N N 18 127.039 125.216 1.823 2
1 149 . 1 1 A 19 19 LEU H H 19 8.784 8.952 -0.168 2
1 150 . 1 1 A 19 19 LEU HA H 19 4.852 4.834 0.018 2
1 160 . 1 1 A 19 19 LEU C C 19 176.862 176.189 0.673 2
1 161 . 1 1 A 19 19 LEU CA C 19 55.391 53.945 1.446 2
1 162 . 1 1 A 19 19 LEU CB C 19 44.442 43.085 1.357 2
1 166 . 1 1 A 19 19 LEU N N 19 126.311 126.629 -0.318 2
1 167 . 1 1 A 20 20 SER H H 20 8.215 8.964 -0.749 2
1 168 . 1 1 A 20 20 SER HA H 20 5.461 5.607 -0.146 2
1 171 . 1 1 A 20 20 SER C C 20 171.960 173.410 -1.450 2
1 172 . 1 1 A 20 20 SER CA C 20 57.525 56.798 0.727 2
1 173 . 1 1 A 20 20 SER CB C 20 65.794 65.554 0.240 2
1 174 . 1 1 A 20 20 SER N N 20 115.113 117.728 -2.615 2
1 175 . 1 1 A 21 21 LYS H H 21 9.001 8.749 0.252 2
1 176 . 1 1 A 21 21 LYS HA H 21 4.887 4.967 -0.080 2
1 185 . 1 1 A 21 21 LYS C C 21 174.133 175.135 -1.002 2
1 186 . 1 1 A 21 21 LYS CA C 21 53.840 54.186 -0.346 2
1 187 . 1 1 A 21 21 LYS CB C 21 36.553 35.599 0.954 2
1 191 . 1 1 A 21 21 LYS N N 21 120.938 121.884 -0.946 2
1 192 . 1 1 A 22 22 GLN H H 22 8.201 8.277 -0.076 2
1 193 . 1 1 A 22 22 GLN HA H 22 4.448 4.560 -0.112 2
1 200 . 1 1 A 22 22 GLN C C 22 176.372 175.583 0.789 2
1 201 . 1 1 A 22 22 GLN CA C 22 53.658 54.667 -1.009 2
1 202 . 1 1 A 22 22 GLN CB C 22 30.473 30.250 0.223 2
1 204 . 1 1 A 22 22 GLN N N 22 116.816 119.331 -2.515 2
1 206 . 1 1 A 23 23 GLU H H 23 8.624 8.658 -0.034 2
1 207 . 1 1 A 23 23 GLU HA H 23 4.056 4.107 -0.051 2
1 212 . 1 1 A 23 23 GLU C C 23 177.778 177.085 0.693 2
1 213 . 1 1 A 23 23 GLU CA C 23 58.001 57.591 0.410 2
1 214 . 1 1 A 23 23 GLU CB C 23 29.237 29.298 -0.061 2
1 216 . 1 1 A 23 23 GLU N N 23 122.364 122.033 0.331 2
1 217 . 1 1 A 24 24 GLY H H 24 8.962 8.774 0.188 2
1 218 . 1 1 A 24 24 GLY HA2 H 24 4.139 3.965 0.174 2
1 219 . 1 1 A 24 24 GLY HA3 H 24 3.711 3.968 -0.257 2
1 220 . 1 1 A 24 24 GLY C C 24 173.857 174.151 -0.294 2
1 221 . 1 1 A 24 24 GLY CA C 24 45.288 45.151 0.137 2
1 222 . 1 1 A 24 24 GLY N N 24 113.942 113.687 0.255 2
1 223 . 1 1 A 25 25 GLN H H 25 7.643 7.730 -0.087 2
1 224 . 1 1 A 25 25 GLN HA H 25 4.488 4.439 0.049 2
1 231 . 1 1 A 25 25 GLN C C 25 174.727 175.013 -0.286 2
1 232 . 1 1 A 25 25 GLN CA C 25 54.052 55.050 -0.998 2
1 233 . 1 1 A 25 25 GLN CB C 25 30.843 30.581 0.262 2
1 235 . 1 1 A 25 25 GLN N N 25 119.538 120.814 -1.276 2
1 237 . 1 1 A 26 26 ASN H H 26 8.625 8.713 -0.088 2
1 238 . 1 1 A 26 26 ASN HA H 26 4.862 4.883 -0.021 2
1 243 . 1 1 A 26 26 ASN C C 26 176.261 175.391 0.870 2
1 244 . 1 1 A 26 26 ASN CA C 26 51.812 52.039 -0.227 2
1 245 . 1 1 A 26 26 ASN CB C 26 40.403 39.947 0.456 2
1 246 . 1 1 A 26 26 ASN N N 26 120.047 122.044 -1.997 2
1 248 . 1 1 A 27 27 TYR HA H 27 4.152 4.595 -0.443 2
1 255 . 1 1 A 27 27 TYR C C 27 176.731 175.949 0.782 2
1 256 . 1 1 A 27 27 TYR CA C 27 62.462 59.185 3.277 2
1 257 . 1 1 A 27 27 TYR CB C 27 40.240 39.313 0.927 2
1 262 . 1 1 A 27 27 TYR N N 27 121.761 121.183 0.578 2
1 263 . 1 1 A 28 28 GLY H H 28 8.285 7.980 0.305 2
1 264 . 1 1 A 28 28 GLY HA2 H 28 4.490 3.947 0.543 2
1 265 . 1 1 A 28 28 GLY HA3 H 28 3.759 4.028 -0.269 2
1 266 . 1 1 A 28 28 GLY C C 28 172.198 173.958 -1.760 2
1 267 . 1 1 A 28 28 GLY CA C 28 46.139 45.231 0.908 2
1 268 . 1 1 A 28 28 GLY N N 28 103.567 107.329 -3.762 2
1 269 . 1 1 A 29 29 PHE H H 29 6.878 7.864 -0.986 2
1 270 . 1 1 A 29 29 PHE HA H 29 5.179 4.955 0.224 2
1 278 . 1 1 A 29 29 PHE C C 29 172.840 173.843 -1.003 2
1 279 . 1 1 A 29 29 PHE CA C 29 55.262 55.064 0.198 2
1 280 . 1 1 A 29 29 PHE CB C 29 41.779 42.361 -0.582 2
1 286 . 1 1 A 29 29 PHE N N 29 111.027 117.484 -6.457 2
1 287 . 1 1 A 30 30 PHE H H 30 8.806 8.648 0.158 2
1 288 . 1 1 A 30 30 PHE HA H 30 4.923 4.759 0.164 2
1 296 . 1 1 A 30 30 PHE C C 30 174.501 175.093 -0.592 2
1 297 . 1 1 A 30 30 PHE CA C 30 55.356 55.974 -0.618 2
1 298 . 1 1 A 30 30 PHE CB C 30 41.681 43.007 -1.326 2
1 304 . 1 1 A 30 30 PHE N N 30 118.710 117.696 1.014 2
1 305 . 1 1 A 31 31 LEU H H 31 8.441 8.898 -0.457 2
1 306 . 1 1 A 31 31 LEU HA H 31 5.447 4.926 0.521 2
1 316 . 1 1 A 31 31 LEU C C 31 177.306 175.969 1.337 2
1 317 . 1 1 A 31 31 LEU CA C 31 53.610 54.069 -0.459 2
1 318 . 1 1 A 31 31 LEU CB C 31 43.696 42.138 1.558 2
1 322 . 1 1 A 31 31 LEU N N 31 123.765 123.608 0.157 2
1 323 . 1 1 A 32 32 ARG H H 32 9.381 8.885 0.496 2
1 324 . 1 1 A 32 32 ARG HA H 32 4.840 4.863 -0.023 2
1 331 . 1 1 A 32 32 ARG C C 32 175.155 175.597 -0.442 2
1 332 . 1 1 A 32 32 ARG CA C 32 54.210 54.317 -0.107 2
1 333 . 1 1 A 32 32 ARG CB C 32 35.087 33.125 1.962 2
1 336 . 1 1 A 32 32 ARG N N 32 123.160 123.919 -0.759 2
1 337 . 1 1 A 33 33 ILE H H 33 7.891 8.783 -0.892 2
1 338 . 1 1 A 33 33 ILE HA H 33 4.495 4.876 -0.381 2
1 348 . 1 1 A 33 33 ILE C C 33 175.850 174.349 1.501 2
1 349 . 1 1 A 33 33 ILE CA C 33 59.641 59.168 0.473 2
1 350 . 1 1 A 33 33 ILE CB C 33 39.538 40.529 -0.991 2
1 354 . 1 1 A 33 33 ILE N N 33 118.924 118.955 -0.031 2
1 355 . 1 1 A 34 34 GLU H H 34 8.971 8.794 0.177 2
1 356 . 1 1 A 34 34 GLU HA H 34 4.578 4.916 -0.338 2
1 361 . 1 1 A 34 34 GLU C C 34 175.766 175.670 0.096 2
1 362 . 1 1 A 34 34 GLU CA C 34 54.263 54.435 -0.172 2
1 363 . 1 1 A 34 34 GLU CB C 34 32.128 32.985 -0.857 2
1 365 . 1 1 A 34 34 GLU N N 34 125.447 122.519 2.928 2
1 366 . 1 1 A 35 35 LYS H H 35 8.504 8.598 -0.094 2
1 367 . 1 1 A 35 35 LYS HA H 35 4.026 4.134 -0.108 2
1 376 . 1 1 A 35 35 LYS C C 35 177.701 176.512 1.189 2
1 377 . 1 1 A 35 35 LYS CA C 35 57.591 56.679 0.912 2
1 378 . 1 1 A 35 35 LYS CB C 35 32.491 32.832 -0.341 2
1 382 . 1 1 A 35 35 LYS N N 35 122.893 123.714 -0.821 2
1 383 . 1 1 A 36 36 ASP H H 36 9.020 8.972 0.048 2
1 384 . 1 1 A 36 36 ASP HA H 36 4.385 4.166 0.219 2
1 387 . 1 1 A 36 36 ASP C C 36 174.554 174.710 -0.156 2
1 388 . 1 1 A 36 36 ASP CA C 36 55.868 55.131 0.737 2
1 389 . 1 1 A 36 36 ASP CB C 36 39.826 39.545 0.281 2
1 390 . 1 1 A 36 36 ASP N N 36 121.412 120.725 0.687 2
1 391 . 1 1 A 37 37 THR H H 37 7.464 7.491 -0.027 2
1 392 . 1 1 A 37 37 THR HA H 37 4.454 4.852 -0.398 2
1 397 . 1 1 A 37 37 THR C C 37 172.012 172.728 -0.716 2
1 398 . 1 1 A 37 37 THR CA C 37 61.686 60.773 0.913 2
1 399 . 1 1 A 37 37 THR CB C 37 70.927 72.206 -1.279 2
1 401 . 1 1 A 37 37 THR N N 37 113.147 112.176 0.971 2
1 402 . 1 1 A 38 38 ASP H H 38 8.931 8.740 0.191 2
1 403 . 1 1 A 38 38 ASP HA H 38 4.852 4.919 -0.067 2
1 406 . 1 1 A 38 38 ASP CA C 38 54.826 53.498 1.328 2
1 407 . 1 1 A 38 38 ASP CB C 38 43.332 42.608 0.724 2
1 408 . 1 1 A 38 38 ASP N N 38 120.401 124.035 -3.634 2
1 409 . 1 1 A 39 39 GLY H H 39 8.068 8.385 -0.317 2
1 410 . 1 1 A 39 39 GLY HA2 H 39 3.774 3.947 -0.173 2
1 411 . 1 1 A 39 39 GLY HA3 H 39 3.555 4.012 -0.457 2
1 412 . 1 1 A 39 39 GLY C C 39 172.578 173.084 -0.506 2
1 413 . 1 1 A 39 39 GLY CA C 39 43.967 44.746 -0.779 2
1 414 . 1 1 A 39 39 GLY N N 39 107.925 110.447 -2.522 2
1 415 . 1 1 A 40 40 HIS H H 40 9.111 8.457 0.654 2
1 416 . 1 1 A 40 40 HIS HA H 40 4.650 4.927 -0.277 2
1 421 . 1 1 A 40 40 HIS C C 40 174.330 174.677 -0.347 2
1 422 . 1 1 A 40 40 HIS CA C 40 55.886 55.745 0.141 2
1 423 . 1 1 A 40 40 HIS CB C 40 30.507 31.431 -0.924 2
1 426 . 1 1 A 40 40 HIS N N 40 119.179 119.131 0.048 2
1 427 . 1 1 A 41 41 LEU H H 41 8.254 8.731 -0.477 2
1 428 . 1 1 A 41 41 LEU HA H 41 4.626 4.956 -0.330 2
1 438 . 1 1 A 41 41 LEU C C 41 176.035 176.229 -0.194 2
1 439 . 1 1 A 41 41 LEU CA C 41 55.621 53.772 1.849 2
1 440 . 1 1 A 41 41 LEU CB C 41 45.091 43.365 1.726 2
1 444 . 1 1 A 41 41 LEU N N 41 124.808 123.616 1.192 2
1 445 . 1 1 A 42 42 ILE H H 42 8.685 8.470 0.215 2
1 446 . 1 1 A 42 42 ILE HA H 42 4.578 4.755 -0.177 2
1 456 . 1 1 A 42 42 ILE C C 42 175.369 175.703 -0.334 2
1 457 . 1 1 A 42 42 ILE CA C 42 59.852 60.741 -0.889 2
1 458 . 1 1 A 42 42 ILE CB C 42 36.778 38.444 -1.666 2
1 462 . 1 1 A 42 42 ILE N N 42 121.814 124.413 -2.599 2
1 463 . 1 1 A 43 43 ARG H H 43 8.787 8.535 0.252 2
1 464 . 1 1 A 43 43 ARG HA H 43 4.852 4.816 0.036 2
1 472 . 1 1 A 43 43 ARG C C 43 174.029 175.185 -1.156 2
1 473 . 1 1 A 43 43 ARG CA C 43 52.730 54.711 -1.981 2
1 474 . 1 1 A 43 43 ARG CB C 43 36.983 33.633 3.350 2
1 477 . 1 1 A 43 43 ARG N N 43 125.771 126.632 -0.861 2
1 479 . 1 1 A 44 44 VAL H H 44 8.661 8.586 0.075 2
1 480 . 1 1 A 44 44 VAL HA H 44 3.276 3.716 -0.440 2
1 488 . 1 1 A 44 44 VAL C C 44 173.227 175.064 -1.837 2
1 489 . 1 1 A 44 44 VAL CA C 44 63.161 63.234 -0.073 2
1 490 . 1 1 A 44 44 VAL CB C 44 29.054 29.846 -0.792 2
1 493 . 1 1 A 44 44 VAL N N 44 117.026 118.182 -1.156 2
1 494 . 1 1 A 45 45 ILE H H 45 8.464 7.960 0.504 2
1 495 . 1 1 A 45 45 ILE HA H 45 4.579 4.189 0.390 2
1 505 . 1 1 A 45 45 ILE C C 45 178.108 175.168 2.940 2
1 506 . 1 1 A 45 45 ILE CA C 45 59.888 61.054 -1.166 2
1 507 . 1 1 A 45 45 ILE CB C 45 36.998 36.962 0.036 2
1 511 . 1 1 A 45 45 ILE N N 45 122.767 122.506 0.261 2
1 512 . 1 1 A 46 46 GLU H H 46 9.015 8.483 0.532 2
1 513 . 1 1 A 46 46 GLU HA H 46 4.206 4.363 -0.157 2
1 518 . 1 1 A 46 46 GLU C C 46 177.746 176.345 1.402 2
1 519 . 1 1 A 46 46 GLU CA C 46 56.130 56.760 -0.630 2
1 520 . 1 1 A 46 46 GLU CB C 46 30.581 30.428 0.153 2
1 522 . 1 1 A 46 46 GLU N N 46 131.076 128.353 2.723 2
1 523 . 1 1 A 47 47 GLU H H 47 9.213 8.740 0.473 2
1 524 . 1 1 A 47 47 GLU HA H 47 4.194 4.152 0.042 2
1 529 . 1 1 A 47 47 GLU C C 47 178.088 177.525 0.563 2
1 530 . 1 1 A 47 47 GLU CA C 47 58.212 57.622 0.590 2
1 531 . 1 1 A 47 47 GLU CB C 47 29.390 30.064 -0.673 2
1 533 . 1 1 A 47 47 GLU N N 47 129.592 124.278 5.314 2
1 534 . 1 1 A 48 48 GLY H H 48 9.586 8.934 0.652 2
1 535 . 1 1 A 48 48 GLY HA2 H 48 4.141 3.857 0.284 2
1 536 . 1 1 A 48 48 GLY HA3 H 48 3.757 3.858 -0.101 2
1 537 . 1 1 A 48 48 GLY C C 48 173.790 174.016 -0.226 2
1 538 . 1 1 A 48 48 GLY CA C 48 45.764 46.651 -0.887 2
1 539 . 1 1 A 48 48 GLY N N 48 114.819 114.066 0.753 2
1 540 . 1 1 A 49 49 SER H H 49 7.580 7.877 -0.297 2
1 541 . 1 1 A 49 49 SER HA H 49 4.728 4.861 -0.132 2
1 544 . 1 1 A 49 49 SER C C 49 173.542 174.396 -0.854 2
1 545 . 1 1 A 49 49 SER CA C 49 57.560 55.761 1.799 2
1 546 . 1 1 A 49 49 SER CB C 49 64.529 64.081 0.448 2
1 547 . 1 1 A 49 49 SER N N 49 114.688 114.031 0.657 2
1 548 . 1 1 A 50 50 PRO HA H 50 4.431 4.559 -0.128 2
1 555 . 1 1 A 50 50 PRO C C 50 179.377 177.558 1.819 2
1 556 . 1 1 A 50 50 PRO CA C 50 66.059 64.262 1.797 2
1 557 . 1 1 A 50 50 PRO CB C 50 32.598 31.863 0.735 2
1 560 . 1 1 A 51 51 ALA H H 51 8.264 8.074 0.190 2
1 561 . 1 1 A 51 51 ALA HA H 51 3.817 4.024 -0.207 2
1 565 . 1 1 A 51 51 ALA C C 51 177.508 179.786 -2.278 2
1 566 . 1 1 A 51 51 ALA CA C 51 55.392 54.838 0.554 2
1 567 . 1 1 A 51 51 ALA CB C 51 20.474 18.559 1.915 2
1 568 . 1 1 A 51 51 ALA N N 51 117.604 120.462 -2.858 2
1 569 . 1 1 A 52 52 GLU H H 52 7.794 7.514 0.280 2
1 570 . 1 1 A 52 52 GLU HA H 52 3.881 4.090 -0.209 2
1 575 . 1 1 A 52 52 GLU C C 52 181.401 178.639 2.762 2
1 576 . 1 1 A 52 52 GLU CA C 52 59.454 58.850 0.604 2
1 577 . 1 1 A 52 52 GLU CB C 52 30.247 29.489 0.758 2
1 579 . 1 1 A 52 52 GLU N N 52 119.474 118.446 1.028 2
1 580 . 1 1 A 53 53 LYS H H 53 8.557 7.829 0.728 2
1 581 . 1 1 A 53 53 LYS HA H 53 4.020 4.059 -0.039 2
1 588 . 1 1 A 53 53 LYS C C 53 177.939 177.880 0.059 2
1 589 . 1 1 A 53 53 LYS CA C 53 59.012 58.810 0.202 2
1 590 . 1 1 A 53 53 LYS CB C 53 32.438 32.009 0.429 2
1 594 . 1 1 A 53 53 LYS N N 53 120.057 118.851 1.206 2
1 595 . 1 1 A 54 54 ALA H H 54 7.764 7.503 0.261 2
1 596 . 1 1 A 54 54 ALA HA H 54 4.400 4.302 0.098 2
1 600 . 1 1 A 54 54 ALA C C 54 177.658 177.946 -0.288 2
1 601 . 1 1 A 54 54 ALA CA C 54 52.412 51.777 0.635 2
1 602 . 1 1 A 54 54 ALA CB C 54 20.739 18.463 2.276 2
1 603 . 1 1 A 54 54 ALA N N 54 117.678 119.390 -1.712 2
1 604 . 1 1 A 55 55 GLY H H 55 7.583 8.011 -0.429 2
1 605 . 1 1 A 55 55 GLY HA2 H 55 4.266 3.927 0.339 2
1 606 . 1 1 A 55 55 GLY HA3 H 55 3.775 3.930 -0.155 2
1 607 . 1 1 A 55 55 GLY C C 55 175.232 174.300 0.931 2
1 608 . 1 1 A 55 55 GLY CA C 55 45.368 46.094 -0.726 2
1 609 . 1 1 A 55 55 GLY N N 55 103.265 107.457 -4.192 2
1 610 . 1 1 A 56 56 LEU H H 56 7.280 7.556 -0.276 2
1 611 . 1 1 A 56 56 LEU HA H 56 3.984 4.436 -0.452 2
1 621 . 1 1 A 56 56 LEU C C 56 174.708 175.403 -0.695 2
1 622 . 1 1 A 56 56 LEU CA C 56 55.603 54.711 0.892 2
1 623 . 1 1 A 56 56 LEU CB C 56 42.752 42.459 0.293 2
1 627 . 1 1 A 56 56 LEU N N 56 119.211 123.169 -3.958 2
1 628 . 1 1 A 57 57 LEU H H 57 8.693 8.662 0.031 2
1 629 . 1 1 A 57 57 LEU HA H 57 4.499 4.977 -0.478 2
1 639 . 1 1 A 57 57 LEU C C 57 176.124 175.688 0.436 2
1 640 . 1 1 A 57 57 LEU CA C 57 52.959 53.185 -0.226 2
1 641 . 1 1 A 57 57 LEU CB C 57 45.122 44.723 0.399 2
1 645 . 1 1 A 57 57 LEU N N 57 121.969 127.317 -5.348 2
1 646 . 1 1 A 58 58 ASP H H 58 8.334 8.694 -0.360 2
1 647 . 1 1 A 58 58 ASP HA H 58 4.139 4.684 -0.545 2
1 650 . 1 1 A 58 58 ASP C C 58 178.636 176.788 1.848 2
1 651 . 1 1 A 58 58 ASP CA C 58 56.079 55.308 0.771 2
1 652 . 1 1 A 58 58 ASP CB C 58 42.135 40.558 1.577 2
1 653 . 1 1 A 58 58 ASP N N 58 120.401 121.673 -1.272 2
1 654 . 1 1 A 59 59 GLY H H 59 9.378 8.775 0.603 2
1 655 . 1 1 A 59 59 GLY HA2 H 59 4.317 3.957 0.360 2
1 656 . 1 1 A 59 59 GLY HA3 H 59 3.260 3.960 -0.700 2
1 657 . 1 1 A 59 59 GLY C C 59 173.359 173.985 -0.626 2
1 658 . 1 1 A 59 59 GLY CA C 59 45.517 45.048 0.469 2
1 659 . 1 1 A 59 59 GLY N N 59 116.622 112.646 3.976 2
1 660 . 1 1 A 60 60 ASP H H 60 8.009 7.881 0.128 2
1 661 . 1 1 A 60 60 ASP HA H 60 4.638 4.700 -0.062 2
1 664 . 1 1 A 60 60 ASP C C 60 175.555 175.274 0.281 2
1 665 . 1 1 A 60 60 ASP CA C 60 55.286 54.152 1.134 2
1 666 . 1 1 A 60 60 ASP CB C 60 42.381 41.819 0.562 2
1 667 . 1 1 A 60 60 ASP N N 60 121.370 121.134 0.236 2
1 668 . 1 1 A 61 61 ARG H H 61 8.648 8.675 -0.027 2
1 669 . 1 1 A 61 61 ARG HA H 61 5.179 5.168 0.011 2
1 677 . 1 1 A 61 61 ARG C C 61 177.381 174.657 2.724 2
1 678 . 1 1 A 61 61 ARG CA C 61 53.704 54.859 -1.155 2
1 679 . 1 1 A 61 61 ARG CB C 61 34.017 32.113 1.904 2
1 682 . 1 1 A 61 61 ARG N N 61 116.958 122.553 -5.595 2
1 684 . 1 1 A 62 62 VAL H H 62 8.247 8.513 -0.266 2
1 685 . 1 1 A 62 62 VAL HA H 62 3.806 4.549 -0.743 2
1 693 . 1 1 A 62 62 VAL C C 62 174.748 175.015 -0.267 2
1 694 . 1 1 A 62 62 VAL CA C 62 63.149 61.734 1.415 2
1 695 . 1 1 A 62 62 VAL CB C 62 32.574 32.289 0.285 2
1 698 . 1 1 A 62 62 VAL N N 62 118.546 125.455 -6.909 2
1 699 . 1 1 A 63 63 LEU H H 63 9.262 9.164 0.098 2
1 700 . 1 1 A 63 63 LEU HA H 63 4.412 4.280 0.132 2
1 710 . 1 1 A 63 63 LEU C C 63 177.649 177.210 0.439 2
1 711 . 1 1 A 63 63 LEU CA C 63 56.044 56.673 -0.629 2
1 712 . 1 1 A 63 63 LEU CB C 63 43.339 42.743 0.596 2
1 716 . 1 1 A 63 63 LEU N N 63 125.413 131.061 -5.648 2
1 717 . 1 1 A 64 64 ARG H H 64 7.806 7.705 0.101 2
1 718 . 1 1 A 64 64 ARG HA H 64 5.704 4.937 0.767 2
1 726 . 1 1 A 64 64 ARG C C 64 175.091 174.078 1.013 2
1 727 . 1 1 A 64 64 ARG CA C 64 54.148 54.646 -0.498 2
1 728 . 1 1 A 64 64 ARG CB C 64 35.742 33.969 1.773 2
1 731 . 1 1 A 64 64 ARG N N 64 112.961 117.064 -4.103 2
1 733 . 1 1 A 65 65 ILE H H 65 8.327 9.145 -0.818 2
1 734 . 1 1 A 65 65 ILE HA H 65 4.384 4.645 -0.261 2
1 744 . 1 1 A 65 65 ILE C C 65 175.722 175.555 0.167 2
1 745 . 1 1 A 65 65 ILE CA C 65 60.501 59.392 1.109 2
1 746 . 1 1 A 65 65 ILE CB C 65 39.547 40.220 -0.673 2
1 750 . 1 1 A 65 65 ILE N N 65 119.175 123.559 -4.384 2
1 751 . 1 1 A 66 66 ASN H H 66 9.911 9.581 0.330 2
1 752 . 1 1 A 66 66 ASN HA H 66 4.428 4.384 0.044 2
1 757 . 1 1 A 66 66 ASN C C 66 175.349 174.681 0.668 2
1 758 . 1 1 A 66 66 ASN CA C 66 54.157 54.207 -0.050 2
1 759 . 1 1 A 66 66 ASN CB C 66 37.024 37.444 -0.420 2
1 760 . 1 1 A 66 66 ASN N N 66 128.952 128.096 0.856 2
1 762 . 1 1 A 67 67 GLY H H 67 9.230 8.635 0.595 2
1 763 . 1 1 A 67 67 GLY HA2 H 67 4.322 3.943 0.379 2
1 764 . 1 1 A 67 67 GLY HA3 H 67 3.508 3.952 -0.444 2
1 765 . 1 1 A 67 67 GLY C C 67 174.393 174.000 0.393 2
1 766 . 1 1 A 67 67 GLY CA C 67 45.341 46.439 -1.098 2
1 767 . 1 1 A 67 67 GLY N N 67 103.238 104.668 -1.430 2
1 768 . 1 1 A 68 68 VAL H H 68 8.063 7.716 0.347 2
1 769 . 1 1 A 68 68 VAL HA H 68 4.015 4.563 -0.548 2
1 777 . 1 1 A 68 68 VAL C C 68 175.833 174.816 1.017 2
1 778 . 1 1 A 68 68 VAL CA C 68 62.603 61.357 1.246 2
1 779 . 1 1 A 68 68 VAL CB C 68 32.574 35.021 -2.447 2
1 782 . 1 1 A 68 68 VAL N N 68 125.696 119.678 6.018 2
1 783 . 1 1 A 69 69 PHE H H 69 9.301 9.141 0.160 2
1 784 . 1 1 A 69 69 PHE HA H 69 4.947 4.575 0.372 2
1 792 . 1 1 A 69 69 PHE C C 69 177.120 175.720 1.400 2
1 793 . 1 1 A 69 69 PHE CA C 69 59.200 58.810 0.390 2
1 794 . 1 1 A 69 69 PHE CB C 69 39.320 39.441 -0.121 2
1 800 . 1 1 A 69 69 PHE N N 69 128.641 128.900 -0.259 2
1 801 . 1 1 A 70 70 VAL H H 70 8.312 7.987 0.325 2
1 802 . 1 1 A 70 70 VAL HA H 70 4.517 4.479 0.038 2
1 810 . 1 1 A 70 70 VAL CA C 70 60.734 60.521 0.213 2
1 811 . 1 1 A 70 70 VAL CB C 70 32.976 31.390 1.586 2
1 814 . 1 1 A 70 70 VAL N N 70 118.381 120.382 -2.001 2
1 815 . 1 1 A 71 71 ASP H H 71 5.373 7.396 -2.023 2
1 816 . 1 1 A 71 71 ASP HA H 71 4.413 4.243 0.170 2
1 819 . 1 1 A 71 71 ASP C C 71 174.896 177.856 -2.960 2
1 820 . 1 1 A 71 71 ASP CA C 71 58.334 56.894 1.440 2
1 821 . 1 1 A 71 71 ASP CB C 71 46.097 40.701 5.396 2
1 822 . 1 1 A 71 71 ASP N N 71 119.008 122.369 -3.361 2
1 823 . 1 1 A 72 72 LYS H H 72 7.874 7.622 0.252 2
1 824 . 1 1 A 72 72 LYS HA H 72 4.522 4.348 0.174 2
1 833 . 1 1 A 72 72 LYS C C 72 177.209 176.888 0.321 2
1 834 . 1 1 A 72 72 LYS CA C 72 54.122 57.124 -3.002 2
1 835 . 1 1 A 72 72 LYS CB C 72 31.640 33.291 -1.650 2
1 839 . 1 1 A 72 72 LYS N N 72 110.259 117.320 -7.061 2
1 840 . 1 1 A 73 73 GLU H H 73 7.421 7.804 -0.383 2
1 841 . 1 1 A 73 73 GLU HA H 73 4.401 4.386 0.015 2
1 846 . 1 1 A 73 73 GLU C C 73 176.728 176.145 0.583 2
1 847 . 1 1 A 73 73 GLU CA C 73 54.950 56.988 -2.038 2
1 848 . 1 1 A 73 73 GLU CB C 73 30.390 30.517 -0.127 2
1 850 . 1 1 A 73 73 GLU N N 73 120.043 119.240 0.803 2
1 851 . 1 1 A 74 74 GLU H H 74 9.360 8.646 0.714 2
1 852 . 1 1 A 74 74 GLU HA H 74 4.403 4.638 -0.235 2
1 857 . 1 1 A 74 74 GLU C C 74 178.234 177.482 0.752 2
1 858 . 1 1 A 74 74 GLU CA C 74 56.516 55.703 0.813 2
1 859 . 1 1 A 74 74 GLU CB C 74 30.390 31.351 -0.961 2
1 861 . 1 1 A 74 74 GLU N N 74 122.193 121.866 0.327 2
1 862 . 1 1 A 75 75 HIS H H 75 9.553 9.226 0.327 2
1 863 . 1 1 A 75 75 HIS HA H 75 4.080 4.154 -0.074 2
1 868 . 1 1 A 75 75 HIS C C 75 175.985 176.764 -0.779 2
1 869 . 1 1 A 75 75 HIS CA C 75 61.016 60.526 0.490 2
1 870 . 1 1 A 75 75 HIS CB C 75 29.468 30.488 -1.020 2
1 873 . 1 1 A 75 75 HIS N N 75 123.587 125.181 -1.594 2
1 874 . 1 1 A 76 76 ALA H H 76 9.129 8.290 0.839 2
1 875 . 1 1 A 76 76 ALA HA H 76 3.826 3.867 -0.041 2
1 879 . 1 1 A 76 76 ALA C C 76 180.475 179.321 1.154 2
1 880 . 1 1 A 76 76 ALA CA C 76 55.392 54.896 0.496 2
1 881 . 1 1 A 76 76 ALA CB C 76 18.182 18.265 -0.083 2
1 882 . 1 1 A 76 76 ALA N N 76 117.795 120.913 -3.118 2
1 883 . 1 1 A 77 77 GLN H H 77 7.099 7.725 -0.626 2
1 884 . 1 1 A 77 77 GLN HA H 77 4.198 4.149 0.049 2
1 891 . 1 1 A 77 77 GLN C C 77 177.860 178.643 -0.782 2
1 892 . 1 1 A 77 77 GLN CA C 77 57.790 58.513 -0.723 2
1 893 . 1 1 A 77 77 GLN CB C 77 28.536 28.700 -0.164 2
1 895 . 1 1 A 77 77 GLN N N 77 115.764 117.298 -1.534 2
1 897 . 1 1 A 78 78 VAL H H 78 7.430 7.708 -0.278 2
1 898 . 1 1 A 78 78 VAL HA H 78 3.241 3.557 -0.316 2
1 906 . 1 1 A 78 78 VAL C C 78 177.042 177.885 -0.843 2
1 907 . 1 1 A 78 78 VAL CA C 78 67.299 66.144 1.155 2
1 908 . 1 1 A 78 78 VAL CB C 78 30.819 31.498 -0.679 2
1 911 . 1 1 A 78 78 VAL N N 78 121.143 120.507 0.636 2
1 912 . 1 1 A 79 79 VAL H H 79 7.773 8.095 -0.322 2
1 913 . 1 1 A 79 79 VAL HA H 79 3.315 3.615 -0.300 2
1 921 . 1 1 A 79 79 VAL C C 79 179.179 177.666 1.513 2
1 922 . 1 1 A 79 79 VAL CA C 79 66.694 65.186 1.508 2
1 923 . 1 1 A 79 79 VAL CB C 79 31.841 31.228 0.613 2
1 926 . 1 1 A 79 79 VAL N N 79 117.473 119.769 -2.296 2
1 927 . 1 1 A 80 80 GLU H H 80 7.410 7.812 -0.402 2
1 928 . 1 1 A 80 80 GLU HA H 80 4.258 4.032 0.226 2
1 933 . 1 1 A 80 80 GLU C C 80 178.018 179.039 -1.021 2
1 934 . 1 1 A 80 80 GLU CA C 80 58.566 59.061 -0.495 2
1 935 . 1 1 A 80 80 GLU CB C 80 29.072 29.440 -0.368 2
1 937 . 1 1 A 80 80 GLU N N 80 120.451 120.893 -0.442 2
1 938 . 1 1 A 81 81 LEU H H 81 8.070 8.011 0.059 2
1 939 . 1 1 A 81 81 LEU HA H 81 3.976 4.031 -0.055 2
1 949 . 1 1 A 81 81 LEU C C 81 180.658 179.102 1.556 2
1 950 . 1 1 A 81 81 LEU CA C 81 58.061 58.019 0.042 2
1 951 . 1 1 A 81 81 LEU CB C 81 42.115 41.811 0.304 2
1 955 . 1 1 A 81 81 LEU N N 81 119.943 120.288 -0.345 2
1 956 . 1 1 A 82 82 VAL H H 82 7.609 8.019 -0.410 2
1 957 . 1 1 A 82 82 VAL HA H 82 3.474 3.599 -0.124 2
1 965 . 1 1 A 82 82 VAL C C 82 178.927 178.288 0.639 2
1 966 . 1 1 A 82 82 VAL CA C 82 67.398 67.044 0.354 2
1 967 . 1 1 A 82 82 VAL CB C 82 31.306 31.407 -0.101 2
1 970 . 1 1 A 82 82 VAL N N 82 118.150 118.978 -0.828 2
1 971 . 1 1 A 83 83 ARG H H 83 8.186 7.985 0.201 2
1 972 . 1 1 A 83 83 ARG HA H 83 3.994 4.038 -0.044 2
1 979 . 1 1 A 83 83 ARG C C 83 179.999 178.926 1.073 2
1 980 . 1 1 A 83 83 ARG CA C 83 60.205 59.716 0.489 2
1 981 . 1 1 A 83 83 ARG CB C 83 30.103 30.008 0.095 2
1 984 . 1 1 A 83 83 ARG N N 83 122.902 119.804 3.098 2
1 985 . 1 1 A 84 84 LYS H H 84 8.772 8.053 0.719 2
1 986 . 1 1 A 84 84 LYS HA H 84 4.047 4.084 -0.037 2
1 995 . 1 1 A 84 84 LYS C C 84 176.934 178.917 -1.983 2
1 996 . 1 1 A 84 84 LYS CA C 84 58.142 59.103 -0.962 2
1 997 . 1 1 A 84 84 LYS CB C 84 32.492 31.967 0.525 2
1 1001 . 1 1 A 84 84 LYS N N 84 117.548 119.195 -1.647 2
1 1002 . 1 1 A 85 85 SER H H 85 7.333 8.078 -0.745 2
1 1003 . 1 1 A 85 85 SER HA H 85 4.235 4.243 -0.008 2
1 1006 . 1 1 A 85 85 SER C C 85 175.588 175.130 0.458 2
1 1007 . 1 1 A 85 85 SER CA C 85 59.535 61.422 -1.887 2
1 1008 . 1 1 A 85 85 SER CB C 85 63.571 63.697 -0.126 2
1 1009 . 1 1 A 85 85 SER N N 85 113.544 115.346 -1.802 2
1 1010 . 1 1 A 86 86 GLY H H 86 7.459 7.579 -0.120 2
1 1011 . 1 1 A 86 86 GLY HA2 H 86 4.176 4.104 0.072 2
1 1012 . 1 1 A 86 86 GLY HA3 H 86 3.762 4.108 -0.346 2
1 1013 . 1 1 A 86 86 GLY C C 86 176.407 175.256 1.151 2
1 1014 . 1 1 A 86 86 GLY CA C 86 46.109 44.390 1.719 2
1 1015 . 1 1 A 86 86 GLY N N 86 104.331 107.227 -2.896 2
1 1016 . 1 1 A 87 87 ASN HA H 87 4.650 4.619 0.031 2
1 1021 . 1 1 A 87 87 ASN C C 87 173.653 175.696 -2.043 2
1 1022 . 1 1 A 87 87 ASN CA C 87 54.492 55.232 -0.740 2
1 1023 . 1 1 A 87 87 ASN CB C 87 38.425 39.264 -0.839 2
1 1024 . 1 1 A 87 87 ASN N N 87 118.401 122.952 -4.551 2
1 1026 . 1 1 A 88 88 SER H H 88 7.435 8.010 -0.575 2
1 1027 . 1 1 A 88 88 SER HA H 88 5.438 5.318 0.120 2
1 1030 . 1 1 A 88 88 SER C C 88 172.867 173.509 -0.642 2
1 1031 . 1 1 A 88 88 SER CA C 88 58.160 56.767 1.393 2
1 1032 . 1 1 A 88 88 SER CB C 88 65.861 65.102 0.759 2
1 1033 . 1 1 A 88 88 SER N N 88 113.765 112.617 1.148 2
1 1034 . 1 1 A 89 89 VAL H H 89 8.452 8.842 -0.390 2
1 1035 . 1 1 A 89 89 VAL HA H 89 4.519 4.908 -0.389 2
1 1043 . 1 1 A 89 89 VAL C C 89 171.391 174.591 -3.200 2
1 1044 . 1 1 A 89 89 VAL CA C 89 61.333 60.536 0.797 2
1 1045 . 1 1 A 89 89 VAL CB C 89 33.897 35.572 -1.675 2
1 1048 . 1 1 A 89 89 VAL N N 89 120.001 124.202 -4.201 2
1 1049 . 1 1 A 90 90 THR H H 90 8.348 8.769 -0.421 2
1 1050 . 1 1 A 90 90 THR HA H 90 5.042 5.114 -0.072 2
1 1055 . 1 1 A 90 90 THR C C 90 173.926 173.631 0.295 2
1 1056 . 1 1 A 90 90 THR CA C 90 61.403 61.687 -0.284 2
1 1057 . 1 1 A 90 90 THR CB C 90 69.553 70.338 -0.785 2
1 1059 . 1 1 A 90 90 THR N N 90 123.477 123.089 0.388 2
1 1060 . 1 1 A 91 91 LEU H H 91 9.195 8.743 0.452 2
1 1061 . 1 1 A 91 91 LEU HA H 91 5.161 4.989 0.172 2
1 1071 . 1 1 A 91 91 LEU C C 91 174.564 175.644 -1.080 2
1 1072 . 1 1 A 91 91 LEU CA C 91 52.590 53.581 -0.991 2
1 1073 . 1 1 A 91 91 LEU CB C 91 44.998 45.489 -0.491 2
1 1077 . 1 1 A 91 91 LEU N N 91 128.419 126.355 2.064 2
1 1078 . 1 1 A 92 92 LEU H H 92 8.644 8.580 0.064 2
1 1079 . 1 1 A 92 92 LEU HA H 92 5.335 5.147 0.188 2
1 1089 . 1 1 A 92 92 LEU C C 92 176.451 175.518 0.933 2
1 1090 . 1 1 A 92 92 LEU CA C 92 54.220 53.814 0.406 2
1 1091 . 1 1 A 92 92 LEU CB C 92 44.323 42.995 1.328 2
1 1095 . 1 1 A 92 92 LEU N N 92 125.894 123.709 2.185 2
1 1096 . 1 1 A 93 93 VAL H H 93 9.249 8.993 0.256 2
1 1097 . 1 1 A 93 93 VAL HA H 93 5.573 5.253 0.320 2
1 1105 . 1 1 A 93 93 VAL C C 93 173.550 174.208 -0.658 2
1 1106 . 1 1 A 93 93 VAL CA C 93 58.340 60.323 -1.983 2
1 1107 . 1 1 A 93 93 VAL CB C 93 36.159 33.877 2.282 2
1 1110 . 1 1 A 93 93 VAL N N 93 120.660 120.529 0.131 2
1 1111 . 1 1 A 94 94 LEU H H 94 8.634 8.646 -0.012 2
1 1112 . 1 1 A 94 94 LEU HA H 94 4.911 5.092 -0.181 2
1 1122 . 1 1 A 94 94 LEU C C 94 174.172 175.596 -1.424 2
1 1123 . 1 1 A 94 94 LEU CA C 94 52.659 53.332 -0.673 2
1 1124 . 1 1 A 94 94 LEU CB C 94 47.910 45.558 2.352 2
1 1128 . 1 1 A 94 94 LEU N N 94 120.304 127.344 -7.040 2
1 1129 . 1 1 A 95 95 ASP H H 95 8.210 8.771 -0.561 2
1 1130 . 1 1 A 95 95 ASP HA H 95 5.190 4.618 0.572 2
1 1133 . 1 1 A 95 95 ASP C C 95 175.887 177.863 -1.976 2
1 1134 . 1 1 A 95 95 ASP CA C 95 53.899 54.715 -0.816 2
1 1135 . 1 1 A 95 95 ASP CB C 95 41.188 41.554 -0.366 2
1 1136 . 1 1 A 95 95 ASP N N 95 122.184 124.020 -1.836 2
1 1137 . 1 1 A 96 96 GLY H H 96 8.478 8.846 -0.368 2
1 1138 . 1 1 A 96 96 GLY HA2 H 96 4.002 3.808 0.194 2
1 1139 . 1 1 A 96 96 GLY HA3 H 96 3.757 3.816 -0.059 2
1 1140 . 1 1 A 96 96 GLY C C 96 175.497 175.501 -0.004 2
1 1141 . 1 1 A 96 96 GLY CA C 96 49.944 47.466 2.478 2
1 1142 . 1 1 A 96 96 GLY N N 96 108.610 110.842 -2.232 2
1 1143 . 1 1 A 97 97 ASP H H 97 8.401 8.247 0.154 2
1 1144 . 1 1 A 97 97 ASP HA H 97 4.454 4.362 0.092 2
1 1147 . 1 1 A 97 97 ASP C C 97 179.612 178.588 1.024 2
1 1148 . 1 1 A 97 97 ASP CA C 97 57.913 57.222 0.691 2
1 1149 . 1 1 A 97 97 ASP CB C 97 41.145 40.774 0.371 2
1 1150 . 1 1 A 97 97 ASP N N 97 120.034 122.017 -1.984 2
1 1151 . 1 1 A 98 98 SER H H 98 8.152 8.121 0.031 2
1 1152 . 1 1 A 98 98 SER HA H 98 4.218 4.198 0.020 2
1 1155 . 1 1 A 98 98 SER C C 98 175.061 175.708 -0.648 2
1 1156 . 1 1 A 98 98 SER CA C 98 62.180 62.109 0.071 2
1 1157 . 1 1 A 98 98 SER CB C 98 62.179 62.905 -0.726 2
1 1158 . 1 1 A 98 98 SER N N 98 117.174 115.568 1.606 2
1 1159 . 1 1 A 99 99 TYR H H 99 9.051 8.392 0.660 2
1 1160 . 1 1 A 99 99 TYR HA H 99 3.692 3.828 -0.136 2
1 1167 . 1 1 A 99 99 TYR C C 99 176.460 177.104 -0.644 2
1 1168 . 1 1 A 99 99 TYR CA C 99 62.814 61.849 0.965 2
1 1169 . 1 1 A 99 99 TYR CB C 99 38.829 38.578 0.251 2
1 1174 . 1 1 A 99 99 TYR N N 99 123.539 122.529 1.010 2
1 1175 . 1 1 A 100 100 GLU H H 100 8.520 8.498 0.022 2
1 1176 . 1 1 A 100 100 GLU HA H 100 3.952 4.004 -0.052 2
1 1181 . 1 1 A 100 100 GLU C C 100 180.151 179.066 1.085 2
1 1182 . 1 1 A 100 100 GLU CA C 100 60.099 59.856 0.242 2
1 1183 . 1 1 A 100 100 GLU CB C 100 29.435 29.226 0.209 2
1 1185 . 1 1 A 100 100 GLU N N 100 117.082 118.424 -1.342 2
1 1186 . 1 1 A 101 101 LYS H H 101 7.740 8.018 -0.278 2
1 1187 . 1 1 A 101 101 LYS HA H 101 3.984 4.073 -0.089 2
1 1196 . 1 1 A 101 101 LYS C C 101 178.377 178.508 -0.131 2
1 1197 . 1 1 A 101 101 LYS CA C 101 59.888 59.289 0.599 2
1 1198 . 1 1 A 101 101 LYS CB C 101 32.821 32.402 0.419 2
1 1202 . 1 1 A 101 101 LYS N N 101 119.851 120.925 -1.074 2
1 1203 . 1 1 A 102 102 ALA H H 102 8.538 7.925 0.613 2
1 1204 . 1 1 A 102 102 ALA HA H 102 3.632 4.139 -0.507 2
1 1208 . 1 1 A 102 102 ALA C C 102 179.870 179.756 0.114 2
1 1209 . 1 1 A 102 102 ALA CA C 102 55.285 55.112 0.173 2
1 1210 . 1 1 A 102 102 ALA CB C 102 17.163 18.416 -1.253 2
1 1211 . 1 1 A 102 102 ALA N N 102 124.176 121.324 2.852 2
1 1212 . 1 1 A 103 103 VAL H H 103 8.147 7.942 0.205 2
1 1213 . 1 1 A 103 103 VAL HA H 103 3.658 3.627 0.031 2
1 1221 . 1 1 A 103 103 VAL C C 103 181.113 177.771 3.342 2
1 1222 . 1 1 A 103 103 VAL CA C 103 66.090 66.190 -0.100 2
1 1223 . 1 1 A 103 103 VAL CB C 103 31.822 31.463 0.358 2
1 1226 . 1 1 A 103 103 VAL N N 103 117.841 117.677 0.164 2
1 1227 . 1 1 A 104 104 LYS H H 104 7.903 7.878 0.025 2
1 1228 . 1 1 A 104 104 LYS HA H 104 4.065 4.007 0.058 2
1 1235 . 1 1 A 104 104 LYS C C 104 177.715 178.292 -0.577 2
1 1236 . 1 1 A 104 104 LYS CA C 104 59.094 59.597 -0.503 2
1 1237 . 1 1 A 104 104 LYS CB C 104 32.285 32.413 -0.128 2
1 1241 . 1 1 A 104 104 LYS N N 104 121.515 120.485 1.030 2
1 1242 . 1 1 A 105 105 ASN H H 105 7.747 7.946 -0.199 2
1 1243 . 1 1 A 105 105 ASN HA H 105 4.721 4.858 -0.137 2
1 1248 . 1 1 A 105 105 ASN C C 105 173.320 174.057 -0.737 2
1 1249 . 1 1 A 105 105 ASN CA C 105 53.399 53.011 0.388 2
1 1250 . 1 1 A 105 105 ASN CB C 105 39.249 38.514 0.735 2
1 1251 . 1 1 A 105 105 ASN N N 105 114.941 114.838 0.103 2
1 1253 . 1 1 A 106 106 GLN H H 106 7.850 7.863 -0.013 2
1 1254 . 1 1 A 106 106 GLN HA H 106 3.902 3.865 0.037 2
1 1261 . 1 1 A 106 106 GLN C C 106 175.168 174.986 0.182 2
1 1262 . 1 1 A 106 106 GLN CA C 106 56.978 56.839 0.139 2
1 1263 . 1 1 A 106 106 GLN CB C 106 25.770 26.642 -0.872 2
1 1265 . 1 1 A 106 106 GLN N N 106 114.989 115.727 -0.738 2
1 1267 . 1 1 A 107 107 VAL H H 107 8.005 7.806 0.199 2
1 1268 . 1 1 A 107 107 VAL HA H 107 3.664 4.041 -0.377 2
1 1276 . 1 1 A 107 107 VAL C C 107 175.468 175.166 0.302 2
1 1277 . 1 1 A 107 107 VAL CA C 107 62.726 62.525 0.201 2
1 1278 . 1 1 A 107 107 VAL CB C 107 32.535 32.143 0.392 2
1 1281 . 1 1 A 107 107 VAL N N 107 120.216 120.043 0.173 2
1 1282 . 1 1 A 108 108 ASP H H 108 8.484 8.712 -0.228 2
1 1283 . 1 1 A 108 108 ASP HA H 108 4.467 4.573 -0.106 2
1 1286 . 1 1 A 108 108 ASP C C 108 177.179 176.111 1.068 2
1 1287 . 1 1 A 108 108 ASP CA C 108 53.417 54.918 -1.501 2
1 1288 . 1 1 A 108 108 ASP CB C 108 40.030 40.743 -0.713 2
1 1289 . 1 1 A 108 108 ASP N N 108 125.414 127.163 -1.749 2
1 1290 . 1 1 A 109 109 LEU H H 109 8.470 8.389 0.081 2
1 1291 . 1 1 A 109 109 LEU HA H 109 3.846 4.220 -0.373 2
1 1301 . 1 1 A 109 109 LEU C C 109 178.145 178.509 -0.364 2
1 1302 . 1 1 A 109 109 LEU CA C 109 56.573 56.248 0.325 2
1 1303 . 1 1 A 109 109 LEU CB C 109 42.011 41.995 0.016 2
1 1307 . 1 1 A 109 109 LEU N N 109 127.577 125.326 2.251 2
1 1308 . 1 1 A 110 110 LYS H H 110 8.062 7.974 0.088 2
1 1309 . 1 1 A 110 110 LYS HA H 110 3.022 3.452 -0.430 2
1 1317 . 1 1 A 110 110 LYS C C 110 177.248 178.979 -1.731 2
1 1318 . 1 1 A 110 110 LYS CA C 110 58.742 59.218 -0.476 2
1 1319 . 1 1 A 110 110 LYS CB C 110 31.667 31.617 0.050 2
1 1323 . 1 1 A 110 110 LYS N N 110 118.873 118.733 0.140 2
1 1324 . 1 1 A 111 111 GLU H H 111 7.113 7.974 -0.861 2
1 1325 . 1 1 A 111 111 GLU HA H 111 4.117 4.162 -0.045 2
1 1330 . 1 1 A 111 111 GLU C C 111 176.519 177.364 -0.845 2
1 1331 . 1 1 A 111 111 GLU CA C 111 55.621 58.710 -3.089 2
1 1332 . 1 1 A 111 111 GLU CB C 111 29.943 29.401 0.542 2
1 1334 . 1 1 A 111 111 GLU N N 111 114.282 118.330 -4.048 2
1 1335 . 1 1 A 112 112 LEU H H 112 6.848 7.580 -0.732 2
1 1336 . 1 1 A 112 112 LEU HA H 112 4.293 4.210 0.083 2
1 1346 . 1 1 A 112 112 LEU C C 112 175.674 176.100 -0.426 2
1 1347 . 1 1 A 112 112 LEU CA C 112 55.197 55.759 -0.562 2
1 1348 . 1 1 A 112 112 LEU CB C 112 41.681 41.754 -0.073 2
1 1352 . 1 1 A 112 112 LEU N N 112 118.934 122.362 -3.428 2
1 1353 . 1 1 A 113 113 ASP H H 113 8.466 8.524 -0.058 2
1 1354 . 1 1 A 113 113 ASP HA H 113 4.593 5.173 -0.580 2
1 1357 . 1 1 A 113 113 ASP C C 113 174.511 175.347 -0.837 2
1 1358 . 1 1 A 113 113 ASP CA C 113 53.558 53.198 0.360 2
1 1359 . 1 1 A 113 113 ASP CB C 113 42.448 42.588 -0.140 2
1 1360 . 1 1 A 113 113 ASP N N 113 122.148 124.311 -2.163 2
stop_
save_